0 B7R0.1 BrCCCCCCBr Amb2686735 [0,0,0,0,0,0|3,0,0]=3 1 B7R0.1 BrCCSSCCBr Amb27876631 [0,0,0,0,0,0|3,1,0]=4 2 B7R0.1 BrCC\C=C\CCBr Amb17612549 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.1 C#CCC#CCCO Amb27410487 [0,0,0,0,0,0|1,0,3]=4 4 B7R0.1 C#CCCC#CCO Amb28315204 [0,0,0,0,0,0|1,0,3]=4 5 B7R0.1 C#CCCCCCBr Amb26620641 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.1 C#CCCCCCC Amb3940499 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.1 C#CCCCCCCl Amb24586504 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.1 C#CCCCCCF Amb24538507 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.1 C#CCCCCCN Amb33544857 [0,0,0,0,0,0|2,0,2]=4 10 B7R0.1 C#CCCCCCO Amb10603074 [0,0,0,0,0,0|1,0,2]=3 11 B7R0.1 C#CCCCCOC Amb25191860 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.1 C#CCCCCSC Amb33197631 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.1 C#CCCCSCC Amb25960035 [0,0,0,0,0,0|3,0,1]=4 14 B7R0.1 C#CCCOCC#C Amb21960123 [0,0,0,0,0,0|1,0,3]=4 15 B7R0.1 C#CCCOCC=C Amb28247850 [0,0,0,0,0,0|1,0,3]=4 16 B7R0.1 C#CCCSCCC Amb27410296 [0,0,0,0,0,0|1,1,2]=4 17 B7R0.1 C#CCCSCCN Amb6258722 [0,0,0,0,0,0|1,1,2]=4 18 B7R0.1 C#CCNCCCN Amb27780787 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.1 C#CCNCCCN Amb34157744 [0,0,0,0,0,0|3,0,1]=4 20 B7R0.1 C#CCNCCOC Amb6706432 [0,0,0,0,0,0|3,0,1]=4 21 B7R0.1 C#CCOCCC#N Amb17755651 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.1 C#CCOCCC=O Amb27877538 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.1 C#CCOCCCO Amb26043047 [0,0,0,0,0,0|2,0,1]=3 24 B7R0.1 C#CCOCCNC Amb19020586 [0,0,0,0,0,0|2,0,1]=3 25 B7R0.1 C#CCOCCNC Amb20669278 [0,0,0,0,0,0|2,0,1]=3 26 B7R0.1 C#CCOCCOC Amb24524633 [0,0,0,0,0,0|2,0,1]=3 27 B7R0.1 C#CCOCCON Amb33456090 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.1 C#CCSCCCC Amb26066454 [0,0,0,0,0,0|1,1,1]=3 29 B7R0.1 C#CCSCCCN Amb17500721 [0,0,0,0,0,0|2,1,1]=4 30 B7R0.1 C#CCSCCCO Amb17502862 [0,0,0,0,0,0|2,0,2]=4 31 B7R0.1 C#CC\C=C\CCC Amb33424838 [0,0,0,0,0,0|2,0,2]=4 32 B7R0.1 C=C=CCCCCO Amb17593159 [0,0,0,0,0,0|1,0,3]=4 33 B7R0.1 C=CC#CCCCC Amb17673844 [0,0,0,0,0,0|2,0,2]=4 34 B7R0.1 C=CCC#CCCO Amb25889239 [0,0,0,0,0,0|1,0,3]=4 35 B7R0.1 C=CCCCCCBr Amb16234121 [0,0,0,0,0,0|2,0,2]=4 36 B7R0.1 C=CCCCCCC Amb3940500 [0,0,0,0,0,0|2,0,1]=3 37 B7R0.1 C=CCCCCCCl Amb6298878 [0,0,0,0,0,0|2,0,2]=4 38 B7R0.1 C=CCCCCCI Amb24483139 [0,0,0,0,0,0|2,0,2]=4 39 B7R0.1 C=CCCCCCN Amb18641754 [0,0,0,0,0,0|2,0,2]=4 40 B7R0.1 C=CCCCCCO Amb4017321 [0,0,0,0,0,0|1,0,2]=3 41 B7R0.1 C=CCCCCNC Amb19886674 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.1 C=CCCCCNC Amb22495849 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.1 C=CCCCNCC Amb28461005 [0,0,0,0,0,0|3,0,1]=4 44 B7R0.1 C=CCCCNCC Amb32988644 [0,0,0,0,0,0|3,0,1]=4 45 B7R0.1 C=CCCCSCC Amb27600986 [0,0,0,0,0,0|3,0,1]=4 46 B7R0.1 C=CCCNCCC Amb27796644 [0,0,0,0,0,0|2,0,2]=4 47 B7R0.1 C=CCCOCCBr Amb9208733 [0,0,0,0,0,0|1,0,2]=3 48 B7R0.1 C=CCCOCCN Amb22059113 [0,0,0,0,0,0|1,0,2]=3 49 B7R0.1 C=CCCOCCO Amb26613595 [0,0,0,0,0,0|0,0,2]=2 50 B7R0.1 C=CCCOCOC Amb27664092 [0,0,0,0,0,0|2,0,2]=4 51 B7R0.1 C=CCCSCCC Amb27806215 [0,0,0,0,0,0|1,1,2]=4 52 B7R0.1 C=CCCSCCN Amb25889820 [0,0,0,0,0,0|1,1,2]=4 53 B7R0.1 C=CCCSCCO Amb28283935 [0,0,0,0,0,0|0,1,2]=3 54 B7R0.1 C=CCC\C=C\CO Amb27406831 [0,0,0,0,0,0|1,0,3]=4 55 B7R0.1 C=CCNCCCCl Amb27655586 [0,0,0,0,0,0|3,0,1]=4 56 B7R0.1 C=CCNCCCI Amb28256753 [0,0,0,0,0,0|3,0,1]=4 57 B7R0.1 C=CCNCCCN Amb17315274 [0,0,0,0,0,0|3,0,1]=4 58 B7R0.1 C=CCNCCCO Amb17308751 [0,0,0,0,0,0|2,0,2]=4 59 B7R0.1 C=CCNCCOC Amb6706505 [0,0,0,0,0,0|3,0,1]=4 60 B7R0.1 C=CCNOCCC Amb28077176 [0,0,0,0,0,0|2,0,2]=4 61 B7R0.1 C=CCOCCC#N Amb9208769 [0,0,0,0,0,0|2,0,2]=4 62 B7R0.1 C=CCOCCC=O Amb26516382 [0,0,0,0,0,0|2,0,2]=4 63 B7R0.1 C=CCOCCCBr Amb8828250 [0,0,0,0,0,0|2,0,1]=3 64 B7R0.1 C=CCOCCCC Amb3940494 [0,0,0,0,0,0|1,0,1]=2 65 B7R0.1 C=CCOCCCCl Amb9208730 [0,0,0,0,0,0|2,0,1]=3 66 B7R0.1 C=CCOCCCN Amb25190295 [0,0,0,0,0,0|2,0,1]=3 67 B7R0.1 C=CCOCCCO Amb25097051 [0,0,0,0,0,0|2,0,1]=3 68 B7R0.1 C=CCOCCSC Amb27983164 [0,0,0,0,0,0|2,0,1]=3 69 B7R0.1 C=CCSCCCBr Amb27228626 [0,0,0,0,0,0|2,1,1]=4 70 B7R0.1 C=CCSCCCN Amb17500693 [0,0,0,0,0,0|2,1,1]=4 71 B7R0.1 C=CCSCCCS Amb28293414 [0,0,0,0,0,0|2,1,1]=4 72 B7R0.1 C=CCSCCNC Amb27594788 [0,0,0,0,0,0|2,1,1]=4 73 B7R0.1 C=CCSCCOC Amb17799422 [0,0,0,0,0,0|2,1,1]=4 74 B7R0.1 C=CCSCCSC Amb27594231 [0,0,0,0,0,0|2,1,1]=4 75 B7R0.1 C=CCSSCCC Amb8393142 [0,0,0,0,0,0|2,1,1]=4 76 B7R0.1 C=CC\C=C\CCC Amb4035888 [0,0,0,0,0,0|2,0,2]=4 77 B7R0.1 C=COCCCCO Amb8517109 [0,0,0,0,0,0|2,0,2]=4 78 B7R0.1 C=COCOCCCl Amb27874117 [0,0,0,0,0,0|2,0,2]=4 79 B7R0.1 C=CSCCCCC Amb27666051 [0,0,0,0,0,0|3,0,1]=4 80 B7R0.1 C=C\C=C\CCCC Amb22729011 [0,0,0,0,0,0|2,0,2]=4 81 B7R0.1 CC#CC#CCCO Amb28194224 [0,0,0,0,0,0|1,0,3]=4 82 B7R0.1 CC#CCCCCBr Amb27459340 [0,0,0,0,0,0|2,0,2]=4 83 B7R0.1 CC#CCCCCC Amb9134714 [0,0,0,0,0,0|2,0,2]=4 84 B7R0.1 CC#CCCCCO Amb17593158 [0,0,0,0,0,0|1,0,2]=3 85 B7R0.1 CC#CCNCCF Amb28142964 [0,0,0,0,0,0|2,0,2]=4 86 B7R0.1 CC#CCNCCN Amb28367851 [0,0,0,0,0,0|2,0,2]=4 87 B7R0.1 CC#CCNCCS Amb28240717 [0,0,0,0,0,0|1,1,2]=4 88 B7R0.1 CC#CCSCCN Amb27482457 [0,0,0,0,0,0|1,1,2]=4 89 B7R0.1 CC#CC\C=C\CO Amb27969438 [0,0,0,0,0,0|1,0,3]=4 90 B7R0.1 CC=C=CCCCC Amb28284500 [0,0,0,0,0,0|2,0,2]=4 91 B7R0.1 CCC#CC#CCO Amb27946590 [0,0,0,0,0,0|1,0,3]=4 92 B7R0.1 CCC#CCCCBr Amb24443559 [0,0,0,0,0,0|2,0,2]=4 93 B7R0.1 CCC#CCCCC Amb4017968 [0,0,0,0,0,0|2,0,1]=3 94 B7R0.1 CCC#CCCCCl Amb28188357 [0,0,0,0,0,0|2,0,2]=4 95 B7R0.1 CCC#CCCCN Amb27838381 [0,0,0,0,0,0|2,0,2]=4 96 B7R0.1 CCC#CCCNC Amb27838421 [0,0,0,0,0,0|3,0,1]=4 97 B7R0.1 CCC#CSCCCl Amb27597938 [0,0,0,0,0,0|1,1,2]=4 98 B7R0.1 CCC#C\C=C\CO Amb17779113 [0,0,0,0,0,0|1,0,3]=4 99 B7R0.1 CCCC#CCCC Amb8514642 [0,0,0,0,0,0|2,0,1]=3 100 B7R0.1 CCCC#CCCO Amb2721487 [0,0,0,0,0,0|1,0,1]=2 101 B7R0.1 CCCC#CCNC Amb27815061 [0,0,0,0,0,0|3,0,1]=4 102 B7R0.1 CCCC=C=CCN Amb27838307 [0,0,0,0,0,0|2,0,2]=4 103 B7R0.1 CCCCC#CC#N Amb17593112 [0,0,0,0,0,0|2,0,2]=4 104 B7R0.1 CCCCC#CC=O Amb17593134 [0,0,0,0,0,0|1,0,3]=4 105 B7R0.1 CCCCC#CCBr Amb17670640 [0,0,0,0,0,0|2,0,1]=3 106 B7R0.1 CCCCCC#CI Amb17940367 [0,0,0,0,0,0|2,0,2]=4 107 B7R0.1 CCCCCCC#N Amb7764659 [0,0,0,0,0,0|2,0,1]=3 108 B7R0.1 CCCCCCC=O Amb3939948 [0,0,0,0,0,0|1,0,2]=3 109 B7R0.1 CCCCCCCBr Amb3941482 [0,0,0,0,0,0|2,0,0]=2 110 B7R0.1 CCCCCCCC Amb8513274 [0,0,0,0,0,0|2,0,0]=2 111 B7R0.1 CCCCCCCCl Amb6608669 [0,0,0,0,0,0|2,0,0]=2 112 B7R0.1 CCCCCCCI Amb3940283 [0,0,0,0,0,0|2,0,0]=2 113 B7R0.1 CCCCCCCN Amb3940125 [0,0,0,0,0,0|2,0,0]=2 114 B7R0.1 CCCCCCCO Amb6608791 [0,0,0,0,0,0|1,0,0]=1 115 B7R0.1 CCCCCCC[Mg+] Amb22351260 [0,0,0,0,0,0|2,0,0]=2 116 B7R0.1 CCCCCCNC Amb4037010 [0,0,0,0,0,0|3,0,0]=3 117 B7R0.1 CCCCCCNN Amb7786617 [0,0,0,0,0,0|3,0,0]=3 118 B7R0.1 CCCCCCNO Amb24591654 [0,0,0,0,0,0|2,0,0]=2 119 B7R0.1 CCCCCCNO Amb32687464 [0,0,0,0,0,0|2,0,0]=2 120 B7R0.1 CCCCCCON Amb18641933 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.1 CCCCCCSC Amb22359692 [0,0,0,0,0,0|3,0,0]=3 122 B7R0.1 CCCCCC[Mg]Br Amb22337740 [0,0,0,0,0,0|3,0,0]=3 123 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [0,0,0,0,0,0|3,0,0]=3 124 B7R0.1 CCCCCN=C=O Amb3939207 [0,0,0,0,0,0|2,0,2]=4 125 B7R0.1 CCCCCN=C=S Amb6565433 [0,0,0,0,0,0|2,1,1]=4 126 B7R0.1 CCCCCN=[N+]=[N-] Amb17939435 [0,0,0,0,0,0|4,0,0]=4 127 B7R0.1 CCCCCNC#N Amb28288523 [0,0,0,0,0,0|3,0,1]=4 128 B7R0.1 CCCCCNCC Amb6243353 [0,0,0,0,0,0|3,0,0]=3 129 B7R0.1 CCCCCNCN Amb28388761 [0,0,0,0,0,0|3,0,0]=3 130 B7R0.1 CCCCCNCO Amb28133981 [0,0,0,0,0,0|2,0,0]=2 131 B7R0.1 CCCCCOCC Amb22733705 [0,0,0,0,0,0|3,0,0]=3 132 B7R0.1 CCCCCON=O Amb17939401 [0,0,0,0,0,0|3,0,1]=4 133 B7R0.1 CCCCCSSC Amb25679654 [0,0,0,0,0,0|4,0,0]=4 134 B7R0.1 CCCCC\C=C\Br Amb27985859 [0,0,0,0,0,0|2,0,2]=4 135 B7R0.1 CCCCC\C=C\Cl Amb28384465 [0,0,0,0,0,0|2,0,2]=4 136 B7R0.1 CCCCC\C=C\I Amb22641605 [0,0,0,0,0,0|2,0,2]=4 137 B7R0.1 CCCCC\C=N\N Amb27837897 [0,0,0,0,0,0|3,0,1]=4 138 B7R0.1 CCCCC\C=N\O Amb27477089 [0,0,0,0,0,0|2,0,1]=3 139 B7R0.1 CCCCNCC#N Amb3997177 [0,0,0,0,0,0|2,0,1]=3 140 B7R0.1 CCCCNCCC Amb3939261 [0,0,0,0,0,0|2,0,0]=2 141 B7R0.1 CCCCNCCF Amb27597327 [0,0,0,0,0,0|2,0,0]=2 142 B7R0.1 CCCCNCCN Amb4020675 [0,0,0,0,0,0|2,0,0]=2 143 B7R0.1 CCCCNCCO Amb2685641 [0,0,0,0,0,0|1,0,0]=1 144 B7R0.1 CCCCNCCS Amb22232390 [0,0,0,0,0,0|1,1,0]=2 145 B7R0.1 CCCCOCC=O Amb26515709 [0,0,0,0,0,0|0,0,2]=2 146 B7R0.1 CCCCOCCBr Amb2720768 [0,0,0,0,0,0|1,0,0]=1 147 B7R0.1 CCCCOCCCl Amb8873731 [0,0,0,0,0,0|1,0,0]=1 148 B7R0.1 CCCCOCCI Amb24474438 [0,0,0,0,0,0|1,0,0]=1 149 B7R0.1 CCCCOCCN Amb8895131 [0,0,0,0,0,0|1,0,0]=1 150 B7R0.1 CCCCOCCO Amb3939290 [0,0,0,0,0,0|0,0,0]=0 151 B7R0.1 CCCCO\C=C/Cl Amb27777227 [0,0,0,0,0,0|1,0,2]=3 152 B7R0.1 CCCCO\C=C\Br Amb27858551 [0,0,0,0,0,0|1,0,2]=3 153 B7R0.1 CCCCPCCN Amb27831609 [0,0,0,0,0,0|2,0,0]=2 154 B7R0.1 CCCCSCC#N Amb6760935 [0,0,0,0,0,0|1,1,1]=3 155 B7R0.1 CCCCSCC=O Amb28189740 [0,0,0,0,0,0|0,1,2]=3 156 B7R0.1 CCCCSCCC Amb4017586 [0,0,0,0,0,0|1,1,0]=2 157 B7R0.1 CCCCSCCCl Amb9479748 [0,0,0,0,0,0|1,1,0]=2 158 B7R0.1 CCCCSCCN Amb2209242 [0,0,0,0,0,0|1,1,0]=2 159 B7R0.1 CCCCSCCO Amb1032995 [0,0,0,0,0,0|0,1,0]=1 160 B7R0.1 CCCCSSCC Amb26515761 [0,0,0,0,0,0|2,1,0]=3 161 B7R0.1 CCCCS\C=C/Cl Amb28048891 [0,0,0,0,0,0|1,1,2]=4 162 B7R0.1 CCCC\C=C\C#N Amb18641342 [0,0,0,0,0,0|2,0,2]=4 163 B7R0.1 CCCC\C=C\C=O Amb2720528 [0,0,0,0,0,0|1,0,3]=4 164 B7R0.1 CCCC\C=C\CN Amb25175053 [0,0,0,0,0,0|2,0,1]=3 165 B7R0.1 CCCC\C=C\CO Amb8514979 [0,0,0,0,0,0|1,0,1]=2 166 B7R0.1 CCCC\C=N\OC Amb27969362 [0,0,0,0,0,0|4,0,0]=4 167 B7R0.1 CCCC\N=C\CCl Amb28141548 [0,0,0,0,0,0|2,0,1]=3 168 B7R0.1 CCCNCCC#N Amb2690405 [0,0,0,0,0,0|3,0,1]=4 169 B7R0.1 CCCNCCC=O Amb27838403 [0,0,0,0,0,0|2,0,2]=4 170 B7R0.1 CCCNCCCCl Amb27593175 [0,0,0,0,0,0|3,0,0]=3 171 B7R0.1 CCCNCCCN Amb8515464 [0,0,0,0,0,0|3,0,0]=3 172 B7R0.1 CCCNCCCO Amb6733725 [0,0,0,0,0,0|2,0,0]=2 173 B7R0.1 CCCNCCSC Amb27162672 [0,0,0,0,0,0|3,0,0]=3 174 B7R0.1 CCCNNCCC Amb27818086 [0,0,0,0,0,0|3,0,0]=3 175 B7R0.1 CCCNOCCC Amb27792152 [0,0,0,0,0,0|2,0,0]=2 176 B7R0.1 CCCNOCCO Amb28139467 [0,0,0,0,0,0|1,0,0]=1 177 B7R0.1 CCCOCCCBr Amb8874784 [0,0,0,0,0,0|2,0,0]=2 178 B7R0.1 CCCOCCCCl Amb8874785 [0,0,0,0,0,0|2,0,0]=2 179 B7R0.1 CCCOCCCN Amb3940017 [0,0,0,0,0,0|2,0,0]=2 180 B7R0.1 CCCOCCCO Amb19962968 [0,0,0,0,0,0|2,0,0]=2 181 B7R0.1 CCCOCCCS Amb27212962 [0,0,0,0,0,0|2,0,0]=2 182 B7R0.1 CCCOC\C=C/Cl Amb27839016 [0,0,0,0,0,0|2,0,2]=4 183 B7R0.1 CCCONCCN Amb27838359 [0,0,0,0,0,0|3,0,0]=3 184 B7R0.1 CCCONCCO Amb27455527 [0,0,0,0,0,0|2,0,0]=2 185 B7R0.1 CCCSC#CCO Amb27835121 [0,0,0,0,0,0|2,0,1]=3 186 B7R0.1 CCCSCCC#N Amb6680722 [0,0,0,0,0,0|2,1,1]=4 187 B7R0.1 CCCSCCCN Amb6680225 [0,0,0,0,0,0|2,1,0]=3 188 B7R0.1 CCCSCCCO Amb9370793 [0,0,0,0,0,0|2,0,0]=2 189 B7R0.1 CCCSCCON Amb27262198 [0,0,0,0,0,0|3,1,0]=4 190 B7R0.1 CCCSCCSC Amb27837913 [0,0,0,0,0,0|2,1,0]=3 191 B7R0.1 CCCSSCCO Amb27185480 [0,0,0,0,0,0|1,1,0]=2 192 B7R0.1 CCCSSSCC Amb26415260 [0,0,0,0,0,0|3,1,0]=4 193 B7R0.1 CCC[SiH2]CCCCl Amb28208530 [0,0,0,0,0,0|2,1,0]=3 194 B7R0.1 CCC\C=C/CCC Amb27838401 [0,0,0,0,0,0|2,0,1]=3 195 B7R0.1 CCC\C=C/CCO Amb22052625 [0,0,0,0,0,0|1,0,1]=2 196 B7R0.1 CCC\C=C\CC#N Amb33172503 [0,0,0,0,0,0|2,0,2]=4 197 B7R0.1 CCC\C=C\CC=O Amb32954538 [0,0,0,0,0,0|1,0,3]=4 198 B7R0.1 CCC\C=C\CCBr Amb33242599 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.1 CCC\C=C\CCC Amb9134769 [0,0,0,0,0,0|2,0,1]=3 200 B7R0.1 CCC\C=C\CCCl Amb32686957 [0,0,0,0,0,0|2,0,1]=3 201 B7R0.1 CCC\C=C\CCN Amb25221747 [0,0,0,0,0,0|2,0,1]=3 202 B7R0.1 CCC\C=C\CCO Amb22730273 [0,0,0,0,0,0|1,0,1]=2 203 B7R0.1 CCC\C=C\CCS Amb33373718 [0,0,0,0,0,0|1,1,1]=3 204 B7R0.1 CCC\C=C\CNC Amb33172653 [0,0,0,0,0,0|3,0,1]=4 205 B7R0.1 CCC\C=C\CNN Amb33425693 [0,0,0,0,0,0|3,0,1]=4 206 B7R0.1 CCC\C=C\CNO Amb33327497 [0,0,0,0,0,0|2,0,1]=3 207 B7R0.1 CCC\C=C\CON Amb33424912 [0,0,0,0,0,0|3,0,1]=4 208 B7R0.1 CCC\C=C\OCC Amb25074036 [0,0,0,0,0,0|3,0,1]=4 209 B7R0.1 CCC\C=N\CCO Amb28207113 [0,0,0,0,0,0|1,0,1]=2 210 B7R0.1 CCC\C=N\OCC Amb27880086 [0,0,0,0,0,0|3,0,1]=4 211 B7R0.1 CCNCCCCO Amb3940019 [0,0,0,0,0,0|2,0,0]=2 212 B7R0.1 CCNCCCOC Amb6730311 [0,0,0,0,0,0|4,0,0]=4 213 B7R0.1 CCNCCNCC Amb9885560 [0,0,0,0,0,0|4,0,0]=4 214 B7R0.1 CCNCCOCC Amb33529222 [0,0,0,0,0,0|4,0,0]=4 215 B7R0.1 CCNC\C=C/CO Amb28072875 [0,0,0,0,0,0|2,0,1]=3 216 B7R0.1 CCNC\C=C\CN Amb27972499 [0,0,0,0,0,0|3,0,1]=4 217 B7R0.1 CCNOCCOC Amb28315578 [0,0,0,0,0,0|3,0,0]=3 218 B7R0.1 CCOCCCC#N Amb6260880 [0,0,0,0,0,0|3,0,1]=4 219 B7R0.1 CCOCCCC=O Amb27236777 [0,0,0,0,0,0|2,0,2]=4 220 B7R0.1 CCOCCCCBr Amb8855444 [0,0,0,0,0,0|3,0,0]=3 221 B7R0.1 CCOCCCCCl Amb20242741 [0,0,0,0,0,0|3,0,0]=3 222 B7R0.1 CCOCCCCN Amb6249686 [0,0,0,0,0,0|3,0,0]=3 223 B7R0.1 CCOCCCCO Amb19148112 [0,0,0,0,0,0|2,0,0]=2 224 B7R0.1 CCOCCCON Amb18061683 [0,0,0,0,0,0|4,0,0]=4 225 B7R0.1 CCOCCOCC Amb8517552 [0,0,0,0,0,0|4,0,0]=4 226 B7R0.1 CCOC\C=C\CO Amb25221278 [0,0,0,0,0,0|2,0,1]=3 227 B7R0.1 CCOC\C=C\CS Amb28254606 [0,0,0,0,0,0|2,1,1]=4 228 B7R0.1 CCONCCCN Amb27244679 [0,0,0,0,0,0|4,0,0]=4 229 B7R0.1 CCONCCCO Amb28319900 [0,0,0,0,0,0|3,0,0]=3 230 B7R0.1 CCO\C=C\CCO Amb28189265 [0,0,0,0,0,0|2,0,1]=3 231 B7R0.1 CCSCCCC#N Amb6680685 [0,0,0,0,0,0|3,0,1]=4 232 B7R0.1 CCSCCCC=O Amb33323662 [0,0,0,0,0,0|2,0,2]=4 233 B7R0.1 CCSCCCCBr Amb9304999 [0,0,0,0,0,0|3,0,0]=3 234 B7R0.1 CCSCCCCCl Amb18796695 [0,0,0,0,0,0|3,0,0]=3 235 B7R0.1 CCSCCCCN Amb9391471 [0,0,0,0,0,0|3,0,0]=3 236 B7R0.1 CCSCCCCO Amb9370799 [0,0,0,0,0,0|2,0,0]=2 237 B7R0.1 CCSCCCCS Amb27223548 [0,0,0,0,0,0|2,1,0]=3 238 B7R0.1 CCSCCCNC Amb25044529 [0,0,0,0,0,0|4,0,0]=4 239 B7R0.1 CCSCCCNO Amb27778147 [0,0,0,0,0,0|3,0,0]=3 240 B7R0.1 CCSCCCON Amb26975230 [0,0,0,0,0,0|4,0,0]=4 241 B7R0.1 CCSCCSCC Amb4017493 [0,0,0,0,0,0|4,0,0]=4 242 B7R0.1 CCSCSCCCl Amb27645434 [0,0,0,0,0,0|2,1,0]=3 243 B7R0.1 CCSC\C=C\CN Amb33474425 [0,0,0,0,0,0|3,0,1]=4 244 B7R0.1 CCSC\C=C\CO Amb33475304 [0,0,0,0,0,0|2,0,1]=3 245 B7R0.1 CC\C=C/CCCO Amb22053865 [0,0,0,0,0,0|1,0,2]=3 246 B7R0.1 CC\C=C\C#CCO Amb28206471 [0,0,0,0,0,0|1,0,3]=4 247 B7R0.1 CC\C=C\C=C\CO Amb32953372 [0,0,0,0,0,0|1,0,3]=4 248 B7R0.1 CC\C=C\CCCBr Amb27232700 [0,0,0,0,0,0|2,0,2]=4 249 B7R0.1 CC\C=C\CCCC Amb19930202 [0,0,0,0,0,0|2,0,1]=3 250 B7R0.1 CC\C=C\CCCCl Amb28410595 [0,0,0,0,0,0|2,0,2]=4 251 B7R0.1 CC\C=C\CCCN Amb33474692 [0,0,0,0,0,0|2,0,2]=4 252 B7R0.1 CC\C=C\CCCO Amb33172698 [0,0,0,0,0,0|1,0,2]=3 253 B7R0.1 CC\C=C\CCCS Amb32882557 [0,0,0,0,0,0|1,1,2]=4 254 B7R0.1 CC\C=C\CCNC Amb32953435 [0,0,0,0,0,0|3,0,1]=4 255 B7R0.1 CC\C=C\CCSC Amb27397344 [0,0,0,0,0,0|3,0,1]=4 256 B7R0.1 CC\C=N\CCCC Amb27946052 [0,0,0,0,0,0|2,0,1]=3 257 B7R0.1 CC\C=N\OCCCl Amb27770489 [0,0,0,0,0,0|2,0,1]=3 258 B7R0.1 CNCC#CCCN Amb27839104 [0,0,0,0,0,0|3,0,1]=4 259 B7R0.1 CNCC#CCCO Amb26509827 [0,0,0,0,0,0|2,0,1]=3 260 B7R0.1 CNCCCCC#N Amb18307043 [0,0,0,0,0,0|3,0,1]=4 261 B7R0.1 CNCCCCCF Amb27595210 [0,0,0,0,0,0|3,0,0]=3 262 B7R0.1 CNCCCCCI Amb27953747 [0,0,0,0,0,0|3,0,0]=3 263 B7R0.1 CNCCCCCN Amb23448496 [0,0,0,0,0,0|3,0,0]=3 264 B7R0.1 CNCCCCCO Amb17334069 [0,0,0,0,0,0|2,0,0]=2 265 B7R0.1 CNCCCCCO Amb33551687 [0,0,0,0,0,0|2,0,0]=2 266 B7R0.1 CNCCCCNC Amb19374448 [0,0,0,0,0,0|4,0,0]=4 267 B7R0.1 CNCCCCOC Amb17569912 [0,0,0,0,0,0|4,0,0]=4 268 B7R0.1 CNCCCCSC Amb27433707 [0,0,0,0,0,0|4,0,0]=4 269 B7R0.1 CNCCNCCN Amb18641939 [0,0,0,0,0,0|3,0,0]=3 270 B7R0.1 CNCCNCCO Amb4020109 [0,0,0,0,0,0|2,0,0]=2 271 B7R0.1 CNCCNCCS Amb27424661 [0,0,0,0,0,0|2,1,0]=3 272 B7R0.1 CNCCOCCCl Amb25708208 [0,0,0,0,0,0|2,0,0]=2 273 B7R0.1 CNCCOCCCl Amb32659597 [0,0,0,0,0,0|2,0,0]=2 274 B7R0.1 CNCCOCCN Amb27246939 [0,0,0,0,0,0|2,0,0]=2 275 B7R0.1 CNCCOCCO Amb33536922 [0,0,0,0,0,0|1,0,0]=1 276 B7R0.1 CNCCSCC#N Amb27669176 [0,0,0,0,0,0|2,1,1]=4 277 B7R0.1 CNCCSCCO Amb27475549 [0,0,0,0,0,0|1,1,0]=2 278 B7R0.1 COCC#CCCO Amb28069664 [0,0,0,0,0,0|2,0,1]=3 279 B7R0.1 COCCCCC#N Amb13951615 [0,0,0,0,0,0|3,0,1]=4 280 B7R0.1 COCCCCC=O Amb27410175 [0,0,0,0,0,0|2,0,2]=4 281 B7R0.1 COCCCCCBr Amb18182548 [0,0,0,0,0,0|3,0,0]=3 282 B7R0.1 COCCCCCCl Amb9001649 [0,0,0,0,0,0|3,0,0]=3 283 B7R0.1 COCCCCCI Amb27603403 [0,0,0,0,0,0|3,0,0]=3 284 B7R0.1 COCCCCCN Amb13951647 [0,0,0,0,0,0|3,0,0]=3 285 B7R0.1 COCCCCCO Amb19374978 [0,0,0,0,0,0|2,0,0]=2 286 B7R0.1 COCCCCCS Amb25138209 [0,0,0,0,0,0|2,1,0]=3 287 B7R0.1 COCCCCNN Amb27753483 [0,0,0,0,0,0|4,0,0]=4 288 B7R0.1 COCCCCOC Amb6296783 [0,0,0,0,0,0|4,0,0]=4 289 B7R0.1 COCCCCON Amb25357703 [0,0,0,0,0,0|4,0,0]=4 290 B7R0.1 COCCCCSC Amb28193488 [0,0,0,0,0,0|4,0,0]=4 291 B7R0.1 COCCCOCCl Amb28073904 [0,0,0,0,0,0|4,0,0]=4 292 B7R0.1 COCCCSCCl Amb27466078 [0,0,0,0,0,0|4,0,0]=4 293 B7R0.1 COCCNCC#N Amb6600494 [0,0,0,0,0,0|3,0,1]=4 294 B7R0.1 COCCNCCF Amb25677392 [0,0,0,0,0,0|3,0,0]=3 295 B7R0.1 COCCNCCF Amb33552357 [0,0,0,0,0,0|3,0,0]=3 296 B7R0.1 COCCNCCN Amb17091020 [0,0,0,0,0,0|3,0,0]=3 297 B7R0.1 COCCNCCN Amb30585091 [0,0,0,0,0,0|3,0,0]=3 298 B7R0.1 COCCNCCO Amb3939014 [0,0,0,0,0,0|2,0,0]=2 299 B7R0.1 COCCNCCS Amb27405418 [0,0,0,0,0,0|2,1,0]=3 300 B7R0.1 COCCOCC#N Amb6256277 [0,0,0,0,0,0|2,0,1]=3 301 B7R0.1 COCCOCC=O Amb26051823 [0,0,0,0,0,0|1,0,2]=3 302 B7R0.1 COCCOCCBr Amb3938999 [0,0,0,0,0,0|2,0,0]=2 303 B7R0.1 COCCOCCCl Amb9209785 [0,0,0,0,0,0|2,0,0]=2 304 B7R0.1 COCCOCCI Amb22497515 [0,0,0,0,0,0|2,0,0]=2 305 B7R0.1 COCCOCCN Amb6244884 [0,0,0,0,0,0|2,0,0]=2 306 B7R0.1 COCCOCCN Amb7969459 [0,0,0,0,0,0|2,0,0]=2 307 B7R0.1 COCCOCCO Amb4605829 [0,0,0,0,0,0|1,0,0]=1 308 B7R0.1 COCCOCCS Amb9787645 [0,0,0,0,0,0|1,1,0]=2 309 B7R0.1 COCCOCON Amb24421661 [0,0,0,0,0,0|3,0,0]=3 310 B7R0.1 COCCONC#N Amb27848459 [0,0,0,0,0,0|3,0,1]=4 311 B7R0.1 COCCONC=O Amb28049001 [0,0,0,0,0,0|2,0,2]=4 312 B7R0.1 COCCSCCF Amb28142604 [0,0,0,0,0,0|2,1,0]=3 313 B7R0.1 COCCSCCO Amb9273918 [0,0,0,0,0,0|1,1,0]=2 314 B7R0.1 COCCSCOC Amb27883297 [0,0,0,0,0,0|3,1,0]=4 315 B7R0.1 COCC\C=C\CCl Amb10844762 [0,0,0,0,0,0|3,0,1]=4 316 B7R0.1 COCC\C=C\CN Amb33474375 [0,0,0,0,0,0|3,0,1]=4 317 B7R0.1 COCC\C=C\CO Amb32954125 [0,0,0,0,0,0|2,0,1]=3 318 B7R0.1 COCOCCC#N Amb25318078 [0,0,0,0,0,0|3,0,1]=4 319 B7R0.1 COCOCCC=O Amb25804170 [0,0,0,0,0,0|3,0,1]=4 320 B7R0.1 COCOCCCBr Amb28385749 [0,0,0,0,0,0|3,0,0]=3 321 B7R0.1 COCOCCCCl Amb27194584 [0,0,0,0,0,0|3,0,0]=3 322 B7R0.1 COCOCCCN Amb25989339 [0,0,0,0,0,0|3,0,0]=3 323 B7R0.1 COCOCCCO Amb23591016 [0,0,0,0,0,0|3,0,0]=3 324 B7R0.1 CONCCCCF Amb28401069 [0,0,0,0,0,0|4,0,0]=4 325 B7R0.1 CSCCCCC#N Amb27832899 [0,0,0,0,0,0|3,0,1]=4 326 B7R0.1 CSCCCCC=O Amb25760866 [0,0,0,0,0,0|2,0,2]=4 327 B7R0.1 CSCCCCCBr Amb25052398 [0,0,0,0,0,0|3,0,0]=3 328 B7R0.1 CSCCCCCCl Amb18179464 [0,0,0,0,0,0|3,0,0]=3 329 B7R0.1 CSCCCCCF Amb28049310 [0,0,0,0,0,0|3,0,0]=3 330 B7R0.1 CSCCCCCN Amb24271082 [0,0,0,0,0,0|3,0,0]=3 331 B7R0.1 CSCCCCCO Amb24271084 [0,0,0,0,0,0|2,0,0]=2 332 B7R0.1 CSCCCCCS Amb24633807 [0,0,0,0,0,0|2,1,0]=3 333 B7R0.1 CSCCCCON Amb33198301 [0,0,0,0,0,0|4,0,0]=4 334 B7R0.1 CSCCNCC#N Amb27812181 [0,0,0,0,0,0|3,0,1]=4 335 B7R0.1 CSCCNCCBr Amb27833219 [0,0,0,0,0,0|3,0,0]=3 336 B7R0.1 CSCCNCCCl Amb27870606 [0,0,0,0,0,0|3,0,0]=3 337 B7R0.1 CSCCOCC#N Amb27823913 [0,0,0,0,0,0|2,0,1]=3 338 B7R0.1 CSCCOCCBr Amb28321116 [0,0,0,0,0,0|2,0,0]=2 339 B7R0.1 CSCCOCCN Amb17501991 [0,0,0,0,0,0|2,0,0]=2 340 B7R0.1 CSCCOCCO Amb28368979 [0,0,0,0,0,0|1,0,0]=1 341 B7R0.1 CSCC\C=C\CN Amb33198278 [0,0,0,0,0,0|3,0,1]=4 342 B7R0.1 CSCC\C=C\CO Amb33198279 [0,0,0,0,0,0|2,0,1]=3 343 B7R0.1 CSCOCCCBr Amb27477765 [0,0,0,0,0,0|3,0,0]=3 344 B7R0.1 C\C=C/CCCCC Amb4035902 [0,0,0,0,0,0|2,0,2]=4 345 B7R0.1 C\C=C/CCCCO Amb4019856 [0,0,0,0,0,0|1,0,2]=3 346 B7R0.1 C\C=C\C#CCCO Amb15695309 [0,0,0,0,0,0|1,0,3]=4 347 B7R0.1 C\C=C\C=C\CCO Amb27459750 [0,0,0,0,0,0|1,0,3]=4 348 B7R0.1 C\C=C\CCCCC Amb8513437 [0,0,0,0,0,0|2,0,2]=4 349 B7R0.1 C\C=C\CCCCN Amb27209196 [0,0,0,0,0,0|2,0,2]=4 350 B7R0.1 C\C=C\CNCCC Amb28127654 [0,0,0,0,0,0|2,0,2]=4 351 B7R0.1 C\C=C\CNCCN Amb27983366 [0,0,0,0,0,0|2,0,2]=4 352 B7R0.1 C\C=C\CSCCO Amb9362982 [0,0,0,0,0,0|0,1,2]=3 353 B7R0.1 C\C=N/CCCCN Amb27838890 [0,0,0,0,0,0|3,0,1]=4 354 B7R0.1 ClCCCCCCBr Amb10602445 [0,0,0,0,0,0|3,0,0]=3 355 B7R0.1 ClCCCCCCCl Amb8513108 [0,0,0,0,0,0|3,0,0]=3 356 B7R0.1 ClCCCCCCI Amb20670134 [0,0,0,0,0,0|3,0,0]=3 357 B7R0.1 ClCCCCC[Zn]Br Amb22000392 [0,0,0,0,0,0|4,0,0]=4 358 B7R0.1 ClCCCCOCCl Amb27628371 [0,0,0,0,0,0|4,0,0]=4 359 B7R0.1 ClCCCNCCCl Amb13952668 [0,0,0,0,0,0|3,0,0]=3 360 B7R0.1 ClCCCNCCCl Amb18125911 [0,0,0,0,0,0|3,0,0]=3 361 B7R0.1 ClCCCSCCCl Amb24426165 [0,0,0,0,0,0|2,1,0]=3 362 B7R0.1 ClCCSSCCCl Amb27232729 [0,0,0,0,0,0|3,1,0]=4 363 B7R0.1 ClCC\C=C\CCCl Amb24481434 [0,0,0,0,0,0|3,0,1]=4 364 B7R0.1 ClCOCCCCBr Amb28195199 [0,0,0,0,0,0|4,0,0]=4 365 B7R0.1 ClC\C=C\CCCCl Amb27421977 [0,0,0,0,0,0|3,0,1]=4 366 B7R0.1 FCCCCCCCl Amb27817669 [0,0,0,0,0,0|3,0,0]=3 367 B7R0.1 FCCCCCCI Amb25080138 [0,0,0,0,0,0|3,0,0]=3 368 B7R0.1 FCCCCCCS Amb24569228 [0,0,0,0,0,0|2,1,0]=3 369 B7R0.1 FCCNCCCCl Amb27233248 [0,0,0,0,0,0|3,0,0]=3 370 B7R0.1 FCCSCCCCl Amb27172909 [0,0,0,0,0,0|2,1,0]=3 371 B7R0.1 ICCCCCCI Amb8514815 [0,0,0,0,0,0|3,0,0]=3 372 B7R0.1 ICCSSCCI Amb33352021 [0,0,0,0,0,0|3,1,0]=4 373 B7R0.1 N#CCCCCCBr Amb2685266 [0,0,0,0,0,0|3,0,1]=4 374 B7R0.1 N#CCCCCCF Amb17593193 [0,0,0,0,0,0|3,0,1]=4 375 B7R0.1 N#CCCCCCN Amb2721249 [0,0,0,0,0,0|3,0,1]=4 376 B7R0.1 N#CCCCCCN Amb31031060 [0,0,0,0,0,0|3,0,1]=4 377 B7R0.1 N#CCCCCCO Amb27665577 [0,0,0,0,0,0|2,0,1]=3 378 B7R0.1 N#CCCCCCS Amb28144803 [0,0,0,0,0,0|2,1,1]=4 379 B7R0.1 N#CCCNCCO Amb9243302 [0,0,0,0,0,0|2,0,1]=3 380 B7R0.1 N#CCCNCCS Amb27838355 [0,0,0,0,0,0|2,1,1]=4 381 B7R0.1 N#CCCOCC=O Amb27613546 [0,0,0,0,0,0|1,0,3]=4 382 B7R0.1 N#CCCOCCCl Amb22170576 [0,0,0,0,0,0|2,0,1]=3 383 B7R0.1 N#CCCOCCI Amb28324157 [0,0,0,0,0,0|2,0,1]=3 384 B7R0.1 N#CCCSCCO Amb3939502 [0,0,0,0,0,0|1,1,1]=3 385 B7R0.1 N#CCNCCCF Amb28282075 [0,0,0,0,0,0|3,0,1]=4 386 B7R0.1 N#CCOCCCO Amb24720648 [0,0,0,0,0,0|2,0,1]=3 387 B7R0.1 N#CCSCCCCl Amb20623081 [0,0,0,0,0,0|2,1,1]=4 388 B7R0.1 N#CCSCCCN Amb17500697 [0,0,0,0,0,0|2,1,1]=4 389 B7R0.1 NCCC#CCCO Amb27229366 [0,0,0,0,0,0|2,0,1]=3 390 B7R0.1 NCCCCCCBr Amb18648322 [0,0,0,0,0,0|3,0,0]=3 391 B7R0.1 NCCCCCCCl Amb31030966 [0,0,0,0,0,0|3,0,0]=3 392 B7R0.1 NCCCCCCF Amb28314228 [0,0,0,0,0,0|3,0,0]=3 393 B7R0.1 NCCCCCCN Amb2573303 [0,0,0,0,0,0|3,0,0]=3 394 B7R0.1 NCCCCCCN Amb8516658 [0,0,0,0,0,0|3,0,0]=3 395 B7R0.1 NCCCCCCO Amb2720515 [0,0,0,0,0,0|2,0,0]=2 396 B7R0.1 NCCCCCCS Amb18642745 [0,0,0,0,0,0|2,1,0]=3 397 B7R0.1 NCCCCCCS Amb24099361 [0,0,0,0,0,0|2,1,0]=3 398 B7R0.1 NCCCCCNO Amb24381036 [0,0,0,0,0,0|3,0,0]=3 399 B7R0.1 NCCCCCNO Amb33483225 [0,0,0,0,0,0|3,0,0]=3 400 B7R0.1 NCCCNCCBr Amb26319089 [0,0,0,0,0,0|3,0,0]=3 401 B7R0.1 NCCCNCCBr Amb8391138 [0,0,0,0,0,0|3,0,0]=3 402 B7R0.1 NCCCNCCF Amb28076267 [0,0,0,0,0,0|3,0,0]=3 403 B7R0.1 NCCCNCCN Amb2725582 [0,0,0,0,0,0|3,0,0]=3 404 B7R0.1 NCCCNCCO Amb4035734 [0,0,0,0,0,0|2,0,0]=2 405 B7R0.1 NCCCNCCS Amb17607860 [0,0,0,0,0,0|2,1,0]=3 406 B7R0.1 NCCCOCCCl Amb27199285 [0,0,0,0,0,0|2,0,0]=2 407 B7R0.1 NCCCOCCF Amb27169291 [0,0,0,0,0,0|2,0,0]=2 408 B7R0.1 NCCCOCCF Amb33299411 [0,0,0,0,0,0|2,0,0]=2 409 B7R0.1 NCCCOCCO Amb33534338 [0,0,0,0,0,0|1,0,0]=1 410 B7R0.1 NCCCSCCO Amb9481738 [0,0,0,0,0,0|1,1,0]=2 411 B7R0.1 NCCC\C=C/CO Amb27838308 [0,0,0,0,0,0|2,0,1]=3 412 B7R0.1 NCCC\C=C\CO Amb24117506 [0,0,0,0,0,0|2,0,1]=3 413 B7R0.1 NCCC\C=C\CO Amb33734220 [0,0,0,0,0,0|2,0,1]=3 414 B7R0.1 NCCC\C=C\CO Amb33743765 [0,0,0,0,0,0|2,0,1]=3 415 B7R0.1 NCCNCCCCl Amb27429827 [0,0,0,0,0,0|3,0,0]=3 416 B7R0.1 NCCNCCCO Amb22732348 [0,0,0,0,0,0|3,0,0]=3 417 B7R0.1 NCCOCCCBr Amb33804025 [0,0,0,0,0,0|2,0,0]=2 418 B7R0.1 NCCOCCCBr Amb33804759 [0,0,0,0,0,0|2,0,0]=2 419 B7R0.1 NCCOCCCCl Amb33803399 [0,0,0,0,0,0|2,0,0]=2 420 B7R0.1 NCCOCCCCl Amb33804230 [0,0,0,0,0,0|2,0,0]=2 421 B7R0.1 NCCOCCCO Amb33551903 [0,0,0,0,0,0|2,0,0]=2 422 B7R0.1 NCCOCCCO Amb9392883 [0,0,0,0,0,0|2,0,0]=2 423 B7R0.1 NCCSCCCF Amb28284467 [0,0,0,0,0,0|2,1,0]=3 424 B7R0.1 NCCSCCCO Amb8876329 [0,0,0,0,0,0|2,1,0]=3 425 B7R0.1 NCCSSCCN Amb22492440 [0,0,0,0,0,0|3,1,0]=4 426 B7R0.1 NCCSSCCN Amb2720039 [0,0,0,0,0,0|3,1,0]=4 427 B7R0.1 NCCSSCCN Amb33716969 [0,0,0,0,0,0|3,1,0]=4 428 B7R0.1 NCCSSCCN Amb534126 [0,0,0,0,0,0|3,1,0]=4 429 B7R0.1 NCCSSCCN Amb9825357 [0,0,0,0,0,0|3,1,0]=4 430 B7R0.1 NCC[Se][Se]CCN Amb31292471 [0,0,0,0,0,0|3,1,0]=4 431 B7R0.1 NNCCOCCO Amb27389862 [0,0,0,0,0,0|2,0,0]=2 432 B7R0.1 NOCCOCCO Amb25952759 [0,0,0,0,0,0|2,0,0]=2 433 B7R0.1 NOCCSCCO Amb27198425 [0,0,0,0,0,0|2,1,0]=3 434 B7R0.1 O=C=NCCCCO Amb27758809 [0,0,0,0,0,0|3,0,1]=4 435 B7R0.1 O=CCCCCCBr Amb18127461 [0,0,0,0,0,0|2,0,2]=4 436 B7R0.1 O=CCCCCCCl Amb16185781 [0,0,0,0,0,0|2,0,2]=4 437 B7R0.1 O=CCCCCCF Amb24533888 [0,0,0,0,0,0|2,0,2]=4 438 B7R0.1 O=CCCCCCO Amb18641885 [0,0,0,0,0,0|2,0,1]=3 439 B7R0.1 O=CCCOCCO Amb18641946 [0,0,0,0,0,0|1,0,1]=2 440 B7R0.1 O=CCSCCCO Amb27871143 [0,0,0,0,0,0|1,1,2]=4 441 B7R0.1 O=CNCCCCO Amb28187191 [0,0,0,0,0,0|3,0,1]=4 442 B7R0.1 O=COCOCCCl Amb28326081 [0,0,0,0,0,0|3,0,1]=4 443 B7R0.1 OCC#CCCCO Amb22365275 [0,0,0,0,0,0|2,0,1]=3 444 B7R0.1 OCCC#CCCO Amb2721707 [0,0,0,0,0,0|2,0,1]=3 445 B7R0.1 OCCCCCCBr Amb24063183 [0,0,0,0,0,0|2,0,0]=2 446 B7R0.1 OCCCCCCBr Amb8514955 [0,0,0,0,0,0|2,0,0]=2 447 B7R0.1 OCCCCCCCl Amb2686112 [0,0,0,0,0,0|2,0,0]=2 448 B7R0.1 OCCCCCCF Amb24428671 [0,0,0,0,0,0|2,0,0]=2 449 B7R0.1 OCCCCCCI Amb28048917 [0,0,0,0,0,0|2,0,0]=2 450 B7R0.1 OCCCCCCO Amb6869970 [0,0,0,0,0,0|2,0,0]=2 451 B7R0.1 OCCCCCCS Amb9786744 [0,0,0,0,0,0|2,0,0]=2 452 B7R0.1 OCCCC\C=N\O Amb22336271 [0,0,0,0,0,0|3,0,1]=4 453 B7R0.1 OCCCNCCCl Amb27599845 [0,0,0,0,0,0|3,0,0]=3 454 B7R0.1 OCCCNCCO Amb4034437 [0,0,0,0,0,0|2,0,0]=2 455 B7R0.1 OCCCOCCCl Amb28194887 [0,0,0,0,0,0|2,0,0]=2 456 B7R0.1 OCCCSCCO Amb33531539 [0,0,0,0,0,0|1,1,0]=2 457 B7R0.1 OCCNCCCCl Amb27655296 [0,0,0,0,0,0|2,0,0]=2 458 B7R0.1 OCCOCCCCl Amb28128414 [0,0,0,0,0,0|1,0,0]=1 459 B7R0.1 OCCOCCCF Amb22008105 [0,0,0,0,0,0|1,0,0]=1 460 B7R0.1 OCCOCCOCl Amb27423637 [0,0,0,0,0,0|2,0,0]=2 461 B7R0.1 OCCSSCCO Amb8513773 [0,0,0,0,0,0|2,1,0]=3 462 B7R0.1 OCC\C=C/CCCl Amb27424782 [0,0,0,0,0,0|2,0,1]=3 463 B7R0.1 OCC\C=C\CCO Amb17614949 [0,0,0,0,0,0|2,0,1]=3 464 B7R0.1 OCOCCOCO Amb24609373 [0,0,0,0,0,0|4,0,0]=4 465 B7R0.1 OC\C=C/CCCCl Amb27862350 [0,0,0,0,0,0|2,0,1]=3 466 B7R0.1 OC\C=C\CCCO Amb27205649 [0,0,0,0,0,0|2,0,1]=3 467 B7R0.1 SCCCSCCS Amb27656809 [0,0,0,0,0,0|1,2,0]=3 468 B7R0.1 [*]OCCOCCN Amb32409718 [0,0,0,0,0,0|3,0,0]=3 469 B7R0.1 [C-]#[N+]CCCCCC Amb2235425 [0,0,0,0,0,0|3,0,0]=3 470 B7R0.1 [C-]#[N+]CCCCOC Amb33377812 [0,0,0,0,0,0|4,0,0]=4 471 B7R0.1 [C-]#[N+]CCCCSC Amb33198737 [0,0,0,0,0,0|4,0,0]=4 472 B7R0.1 [C-]#[N+]CCCOCC Amb3973110 [0,0,0,0,0,0|4,0,0]=4 473 B7R0.1 [C-]#[N+]CCCSCC Amb33324017 [0,0,0,0,0,0|4,0,0]=4 474 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [0,0,0,0,0,0|2,0,1]=3 475 B7R0.1 [C-]#[N+]C\C=C\CCC Amb33327126 [0,0,0,0,0,0|3,0,1]=4 476 B7R0.1 [N-]=[N+]=NCCCCO Amb20623556 [0,0,0,0,0,0|4,0,0]=4 477 B6R0.6 BrCCCCCBr Amb6608668 [1,0,0,0,0,0|2,0,0]=3 478 B6R0.6 BrCCNCCBr Amb19869481 [1,0,0,0,0,0|3,0,0]=4 479 B6R0.6 BrCCOCCBr Amb2684741 [1,0,0,0,0,0|2,0,0]=3 480 B6R0.6 BrCCSCCBr Amb28468000 [1,0,0,0,0,0|2,1,0]=4 481 B6R0.6 BrCC[NH2+]CCBr Amb22166796 [1,0,0,0,0,0|3,0,0]=4 482 B6R0.6 C#CCCCCC Amb6297206 [1,0,0,0,0,0|1,0,1]=3 483 B6R0.6 C#CCCCCCl Amb6336487 [1,0,0,0,0,0|1,0,2]=4 484 B6R0.6 C#CCCCCF Amb33196082 [1,0,0,0,0,0|1,0,2]=4 485 B6R0.6 C#CCCCCI Amb22752649 [1,0,0,0,0,0|1,0,2]=4 486 B6R0.6 C#CCCCCN Amb22059283 [1,0,0,0,0,0|1,0,2]=4 487 B6R0.6 C#CCCCCN Amb33549738 [1,0,0,0,0,0|1,0,2]=4 488 B6R0.6 C#CCCCCO Amb6336500 [1,0,0,0,0,0|0,0,2]=3 489 B6R0.6 C#CCCCNC Amb29083253 [1,0,0,0,0,0|2,0,1]=4 490 B6R0.6 C#CCCCOC Amb25694831 [1,0,0,0,0,0|2,0,1]=4 491 B6R0.6 C#CCCCSC Amb26996684 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.6 C#CCCOCC Amb33169090 [1,0,0,0,0,0|0,0,2]=3 493 B6R0.6 C#CCCSCC Amb24670860 [1,0,0,0,0,0|0,1,2]=4 494 B6R0.6 C#CCNCCC Amb10610181 [1,0,0,0,0,0|2,0,1]=4 495 B6R0.6 C#CCNCCC Amb5262802 [1,0,0,0,0,0|2,0,1]=4 496 B6R0.6 C#CCNCCO Amb19148766 [1,0,0,0,0,0|1,0,2]=4 497 B6R0.6 C#CCNCCO Amb33527970 [1,0,0,0,0,0|1,0,2]=4 498 B6R0.6 C#CCOCCI Amb27828017 [1,0,0,0,0,0|1,0,2]=4 499 B6R0.6 C#CCOCCN Amb18976416 [1,0,0,0,0,0|1,0,2]=4 500 B6R0.6 C#CCOCCN Amb32718823 [1,0,0,0,0,0|1,0,2]=4 501 B6R0.6 C#CCOCCO Amb16232584 [1,0,0,0,0,0|0,0,2]=3 502 B6R0.6 C#CCSCCO Amb33531540 [1,0,0,0,0,0|0,1,2]=4 503 B6R0.6 C=C=CCCCO Amb10605300 [1,0,0,0,0,0|0,0,3]=4 504 B6R0.6 C=C=COCCO Amb25721997 [1,0,0,0,0,0|0,0,3]=4 505 B6R0.6 C=CCCCCBr Amb3940222 [1,0,0,0,0,0|1,0,2]=4 506 B6R0.6 C=CCCCCC Amb3940498 [1,0,0,0,0,0|1,0,1]=3 507 B6R0.6 C=CCCCCCl Amb2692039 [1,0,0,0,0,0|1,0,2]=4 508 B6R0.6 C=CCCCCF Amb24409527 [1,0,0,0,0,0|1,0,2]=4 509 B6R0.6 C=CCCCCI Amb26858458 [1,0,0,0,0,0|1,0,2]=4 510 B6R0.6 C=CCCCCN Amb18639514 [1,0,0,0,0,0|1,0,2]=4 511 B6R0.6 C=CCCCCO Amb3940341 [1,0,0,0,0,0|0,0,2]=3 512 B6R0.6 C=CCCCNC Amb18523846 [1,0,0,0,0,0|2,0,1]=4 513 B6R0.6 C=CCCCNC Amb32651835 [1,0,0,0,0,0|2,0,1]=4 514 B6R0.6 C=CCCCNO Amb27437399 [1,0,0,0,0,0|1,0,2]=4 515 B6R0.6 C=CCCCOC Amb24432882 [1,0,0,0,0,0|2,0,1]=4 516 B6R0.6 C=CCCOCCl Amb2696084 [1,0,0,0,0,0|1,0,2]=4 517 B6R0.6 C=CCCSCC Amb27213772 [1,0,0,0,0,0|0,1,2]=4 518 B6R0.6 C=CCNCCC Amb22587187 [1,0,0,0,0,0|2,0,1]=4 519 B6R0.6 C=CCNCCC Amb6683949 [1,0,0,0,0,0|2,0,1]=4 520 B6R0.6 C=CCNCCO Amb6706545 [1,0,0,0,0,0|1,0,2]=4 521 B6R0.6 C=CCOCCBr Amb33531510 [1,0,0,0,0,0|1,0,2]=4 522 B6R0.6 C=CCOCCC Amb3940491 [1,0,0,0,0,0|1,0,1]=3 523 B6R0.6 C=CCOCCCl Amb2696085 [1,0,0,0,0,0|1,0,2]=4 524 B6R0.6 C=CCOCCI Amb24739964 [1,0,0,0,0,0|1,0,2]=4 525 B6R0.6 C=CCOCCN Amb32667523 [1,0,0,0,0,0|1,0,2]=4 526 B6R0.6 C=CCOCCN Amb33530047 [1,0,0,0,0,0|1,0,2]=4 527 B6R0.6 C=CCOCCO Amb3940609 [1,0,0,0,0,0|0,0,2]=3 528 B6R0.6 C=CCOCOC Amb24385255 [1,0,0,0,0,0|2,0,1]=4 529 B6R0.6 C=COCCCC Amb8513427 [1,0,0,0,0,0|0,0,2]=3 530 B6R0.6 C=COCCCCl Amb27613489 [1,0,0,0,0,0|1,0,2]=4 531 B6R0.6 C=COCCCF Amb22008255 [1,0,0,0,0,0|1,0,2]=4 532 B6R0.6 C=COCCCN Amb3997182 [1,0,0,0,0,0|1,0,2]=4 533 B6R0.6 C=COCCOC Amb21520356 [1,0,0,0,0,0|1,0,2]=4 534 B6R0.6 CC#CCCCBr Amb18791571 [1,0,0,0,0,0|1,0,2]=4 535 B6R0.6 CC#CCCCCl Amb27865837 [1,0,0,0,0,0|1,0,2]=4 536 B6R0.6 CC#CCCCO Amb20242139 [1,0,0,0,0,0|0,0,2]=3 537 B6R0.6 CC#CCCSC Amb27594693 [1,0,0,0,0,0|2,0,1]=4 538 B6R0.6 CC#CCOCC Amb24332856 [1,0,0,0,0,0|0,0,2]=3 539 B6R0.6 CC=C=CCCO Amb25888408 [1,0,0,0,0,0|0,0,3]=4 540 B6R0.6 CCC#CCCBr Amb24712364 [1,0,0,0,0,0|1,0,2]=4 541 B6R0.6 CCC#CCCC Amb9134713 [1,0,0,0,0,0|1,0,1]=3 542 B6R0.6 CCC#CCCCl Amb25147478 [1,0,0,0,0,0|1,0,2]=4 543 B6R0.6 CCC#CCCI Amb24636544 [1,0,0,0,0,0|1,0,2]=4 544 B6R0.6 CCC#CCCN Amb26415259 [1,0,0,0,0,0|1,0,2]=4 545 B6R0.6 CCC#CCCO Amb8514641 [1,0,0,0,0,0|0,0,2]=3 546 B6R0.6 CCC#COCC Amb6336486 [1,0,0,0,0,0|0,0,2]=3 547 B6R0.6 CCCC#CCBr Amb25061301 [1,0,0,0,0,0|1,0,2]=4 548 B6R0.6 CCCC#CCN Amb17593063 [1,0,0,0,0,0|1,0,2]=4 549 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|2,0,0]=3 550 B6R0.6 CCCCC#CI Amb27632377 [1,0,0,0,0,0|1,0,2]=4 551 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [1,0,0,0,0,0|2,0,1]=4 552 B6R0.6 CCCCCC#N Amb6250301 [1,0,0,0,0,0|1,0,1]=3 553 B6R0.6 CCCCCC=O Amb3939522 [1,0,0,0,0,0|0,0,2]=3 554 B6R0.6 CCCCCCBr Amb3940085 [1,0,0,0,0,0|1,0,0]=2 555 B6R0.6 CCCCCCC Amb8513177 [1,0,0,0,0,0|1,0,0]=2 556 B6R0.6 CCCCCCCl Amb7764628 [1,0,0,0,0,0|1,0,0]=2 557 B6R0.6 CCCCCCF Amb8516643 [1,0,0,0,0,0|1,0,0]=2 558 B6R0.6 CCCCCCI Amb6608700 [1,0,0,0,0,0|1,0,0]=2 559 B6R0.6 CCCCCCN Amb2721179 [1,0,0,0,0,0|1,0,0]=2 560 B6R0.6 CCCCCCN Amb3940465 [1,0,0,0,0,0|1,0,0]=2 561 B6R0.6 CCCCCCO Amb3941500 [1,0,0,0,0,0|0,0,0]=1 562 B6R0.6 CCCCCCS Amb8514502 [1,0,0,0,0,0|0,1,0]=2 563 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|1,0,0]=2 564 B6R0.6 CCCCCNC Amb3939381 [1,0,0,0,0,0|2,0,0]=3 565 B6R0.6 CCCCCNN Amb32693399 [1,0,0,0,0,0|2,0,0]=3 566 B6R0.6 CCCCCNN Amb6249376 [1,0,0,0,0,0|2,0,0]=3 567 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|1,0,0]=2 568 B6R0.6 CCCCCOC Amb9787609 [1,0,0,0,0,0|2,0,0]=3 569 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|2,0,0]=3 570 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|2,0,0]=3 571 B6R0.6 CCCCN=C=O Amb3939310 [1,0,0,0,0,0|1,0,2]=4 572 B6R0.6 CCCCN=C=S Amb6572520 [1,0,0,0,0,0|1,1,1]=4 573 B6R0.6 CCCCN=[N+]=N Amb34916661 [1,0,0,0,0,0|3,0,0]=4 574 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,0,0,0,0,0|3,0,0]=4 575 B6R0.6 CCCCN=[N+]=[N-] Amb33526892 [1,0,0,0,0,0|3,0,0]=4 576 B6R0.6 CCCCNC=O Amb4017838 [1,0,0,0,0,0|1,0,2]=4 577 B6R0.6 CCCCNCC Amb3939842 [1,0,0,0,0,0|1,0,0]=2 578 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|2,0,0]=3 579 B6R0.6 CCCCOB=O Amb26900238 [1,0,0,0,0,0|1,0,1]=3 580 B6R0.6 CCCCOC=O Amb6608882 [1,0,0,0,0,0|0,0,2]=3 581 B6R0.6 CCCCOCC Amb2685642 [1,0,0,0,0,0|0,0,0]=1 582 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|0,0,0]=1 583 B6R0.6 CCCCON=O Amb8515227 [1,0,0,0,0,0|1,0,1]=3 584 B6R0.6 CCCCSC#N Amb4035931 [1,0,0,0,0,0|1,1,1]=4 585 B6R0.6 CCCCSCC Amb9787545 [1,0,0,0,0,0|0,1,0]=2 586 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|1,1,0]=3 587 B6R0.6 CCCCSCO Amb27623932 [1,0,0,0,0,0|0,1,0]=2 588 B6R0.6 CCCC\C=C\I Amb25173925 [1,0,0,0,0,0|1,0,2]=4 589 B6R0.6 CCCNCC#N Amb6714443 [1,0,0,0,0,0|2,0,1]=4 590 B6R0.6 CCCNCCC Amb3939352 [1,0,0,0,0,0|2,0,0]=3 591 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,0]=3 592 B6R0.6 CCCNCCN Amb8515461 [1,0,0,0,0,0|2,0,0]=3 593 B6R0.6 CCCNCCO Amb3939869 [1,0,0,0,0,0|1,0,0]=2 594 B6R0.6 CCCNCOC Amb27830080 [1,0,0,0,0,0|3,0,0]=4 595 B6R0.6 CCCNNCC Amb27409240 [1,0,0,0,0,0|2,0,0]=3 596 B6R0.6 CCCOCC#N Amb8874819 [1,0,0,0,0,0|1,0,1]=3 597 B6R0.6 CCCOCCC Amb8513440 [1,0,0,0,0,0|1,0,0]=2 598 B6R0.6 CCCOCCCl Amb8514866 [1,0,0,0,0,0|1,0,0]=2 599 B6R0.6 CCCOCCI Amb27596856 [1,0,0,0,0,0|1,0,0]=2 600 B6R0.6 CCCOCCN Amb3939563 [1,0,0,0,0,0|1,0,0]=2 601 B6R0.6 CCCOCCO Amb3939227 [1,0,0,0,0,0|0,0,0]=1 602 B6R0.6 CCCSCC#N Amb6680723 [1,0,0,0,0,0|1,1,1]=4 603 B6R0.6 CCCSCCBr Amb9304990 [1,0,0,0,0,0|1,1,0]=3 604 B6R0.6 CCCSCCC Amb9787473 [1,0,0,0,0,0|1,1,0]=3 605 B6R0.6 CCCSCCCl Amb9304987 [1,0,0,0,0,0|1,1,0]=3 606 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|1,1,0]=3 607 B6R0.6 CCCSCCN Amb6268693 [1,0,0,0,0,0|1,1,0]=3 608 B6R0.6 CCCSCCS Amb28050075 [1,0,0,0,0,0|0,2,0]=3 609 B6R0.6 CCCSCNC Amb27879006 [1,0,0,0,0,0|2,1,0]=4 610 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|1,1,0]=3 611 B6R0.6 CCCSSSC Amb8392859 [1,0,0,0,0,0|2,1,0]=4 612 B6R0.6 CCC\C=C\CCl Amb27482813 [1,0,0,0,0,0|1,0,2]=4 613 B6R0.6 CCC\C=C\CN Amb33475254 [1,0,0,0,0,0|1,0,2]=4 614 B6R0.6 CCC\C=C\CO Amb32660968 [1,0,0,0,0,0|0,0,2]=3 615 B6R0.6 CCC\C=C\CS Amb33373719 [1,0,0,0,0,0|0,1,2]=4 616 B6R0.6 CCN=C=NCC Amb27664435 [1,0,0,0,0,0|2,0,1]=4 617 B6R0.6 CCNCCC#N Amb2720499 [1,0,0,0,0,0|2,0,1]=4 618 B6R0.6 CCNCCCBr Amb27265760 [1,0,0,0,0,0|2,0,0]=3 619 B6R0.6 CCNCCCF Amb28050218 [1,0,0,0,0,0|2,0,0]=3 620 B6R0.6 CCNCCCN Amb17315269 [1,0,0,0,0,0|2,0,0]=3 621 B6R0.6 CCNCCCO Amb6733726 [1,0,0,0,0,0|1,0,0]=2 622 B6R0.6 CCNCCOC Amb32653021 [1,0,0,0,0,0|2,0,0]=3 623 B6R0.6 CCNCCOC Amb3939818 [1,0,0,0,0,0|2,0,0]=3 624 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|2,0,0]=3 625 B6R0.6 CCNCCSC Amb28941534 [1,0,0,0,0,0|2,0,0]=3 626 B6R0.6 CCNCNCC Amb27174562 [1,0,0,0,0,0|2,0,0]=3 627 B6R0.6 CCNOCCO Amb28281707 [1,0,0,0,0,0|1,0,0]=2 628 B6R0.6 CCOCCC#N Amb4019489 [1,0,0,0,0,0|1,0,1]=3 629 B6R0.6 CCOCCC=O Amb25688261 [1,0,0,0,0,0|1,0,1]=3 630 B6R0.6 CCOCCCBr Amb8828206 [1,0,0,0,0,0|1,0,0]=2 631 B6R0.6 CCOCCCCl Amb6255304 [1,0,0,0,0,0|1,0,0]=2 632 B6R0.6 CCOCCCN Amb3939347 [1,0,0,0,0,0|1,0,0]=2 633 B6R0.6 CCOCCCO Amb3939322 [1,0,0,0,0,0|1,0,0]=2 634 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|1,0,0]=2 635 B6R0.6 CCOCCNC Amb33529221 [1,0,0,0,0,0|1,0,0]=2 636 B6R0.6 CCOCCNN Amb22587352 [1,0,0,0,0,0|2,0,0]=3 637 B6R0.6 CCOCCNN Amb6744628 [1,0,0,0,0,0|2,0,0]=3 638 B6R0.6 CCOCCOC Amb22052684 [1,0,0,0,0,0|1,0,0]=2 639 B6R0.6 CCOCCON Amb18061689 [1,0,0,0,0,0|2,0,0]=3 640 B6R0.6 CCOCN=[N+]=[N-] Amb27838235 [1,0,0,0,0,0|3,0,0]=4 641 B6R0.6 CCOCNC=O Amb28252363 [1,0,0,0,0,0|2,0,1]=4 642 B6R0.6 CCOCOCC Amb8515183 [1,0,0,0,0,0|1,0,0]=2 643 B6R0.6 CCOC\C=C\Br Amb28244732 [1,0,0,0,0,0|1,0,2]=4 644 B6R0.6 CCONOCC Amb27590258 [1,0,0,0,0,0|2,0,0]=3 645 B6R0.6 CCO[SiH2]OCC Amb27655870 [1,0,0,0,0,0|1,1,0]=3 646 B6R0.6 CCO\C=C\SC Amb30621789 [1,0,0,0,0,0|1,0,2]=4 647 B6R0.6 CCSCCC#N Amb6680683 [1,0,0,0,0,0|1,1,1]=4 648 B6R0.6 CCSCCC=O Amb27254551 [1,0,0,0,0,0|1,0,2]=4 649 B6R0.6 CCSCCCBr Amb9305000 [1,0,0,0,0,0|1,1,0]=3 650 B6R0.6 CCSCCCI Amb28461625 [1,0,0,0,0,0|1,1,0]=3 651 B6R0.6 CCSCCCN Amb6680223 [1,0,0,0,0,0|1,1,0]=3 652 B6R0.6 CCSCCCO Amb3939588 [1,0,0,0,0,0|1,0,0]=2 653 B6R0.6 CCSCCCS Amb26476929 [1,0,0,0,0,0|1,1,0]=3 654 B6R0.6 CCSCCNC Amb16186669 [1,0,0,0,0,0|1,1,0]=3 655 B6R0.6 CCSCCNN Amb27218047 [1,0,0,0,0,0|2,1,0]=4 656 B6R0.6 CCSCCNO Amb33324087 [1,0,0,0,0,0|2,0,0]=3 657 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|2,1,0]=4 658 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|1,1,0]=3 659 B6R0.6 CCSSSCC Amb22168293 [1,0,0,0,0,0|2,1,0]=4 660 B6R0.6 CC\C=C/CCC Amb26600858 [1,0,0,0,0,0|1,0,1]=3 661 B6R0.6 CC\C=C/CCCl Amb27815138 [1,0,0,0,0,0|1,0,2]=4 662 B6R0.6 CC\C=C/CCI Amb28399922 [1,0,0,0,0,0|1,0,2]=4 663 B6R0.6 CC\C=C/CCO Amb2720771 [1,0,0,0,0,0|0,0,2]=3 664 B6R0.6 CC\C=C\CCBr Amb17570067 [1,0,0,0,0,0|1,0,2]=4 665 B6R0.6 CC\C=C\CCC Amb19930065 [1,0,0,0,0,0|1,0,1]=3 666 B6R0.6 CC\C=C\CCCl Amb27452933 [1,0,0,0,0,0|1,0,2]=4 667 B6R0.6 CC\C=C\CCN Amb17569886 [1,0,0,0,0,0|1,0,2]=4 668 B6R0.6 CC\C=C\CCO Amb3940339 [1,0,0,0,0,0|0,0,2]=3 669 B6R0.6 CC\C=C\CCS Amb32882654 [1,0,0,0,0,0|0,1,2]=4 670 B6R0.6 CC\C=C\CNC Amb26618015 [1,0,0,0,0,0|2,0,1]=4 671 B6R0.6 CC\C=C\CNO Amb33225042 [1,0,0,0,0,0|1,0,2]=4 672 B6R0.6 CC\C=C\OCC Amb33986090 [1,0,0,0,0,0|0,0,2]=3 673 B6R0.6 CNCC#CCO Amb26413870 [1,0,0,0,0,0|1,0,2]=4 674 B6R0.6 CNCCCCCl Amb34916601 [1,0,0,0,0,0|2,0,0]=3 675 B6R0.6 CNCCCCF Amb27231439 [1,0,0,0,0,0|2,0,0]=3 676 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|2,0,0]=3 677 B6R0.6 CNCCCCN Amb2698063 [1,0,0,0,0,0|2,0,0]=3 678 B6R0.6 CNCCCCO Amb33539277 [1,0,0,0,0,0|1,0,0]=2 679 B6R0.6 CNCCCNC Amb3940467 [1,0,0,0,0,0|3,0,0]=4 680 B6R0.6 CNCCCOC Amb33801534 [1,0,0,0,0,0|3,0,0]=4 681 B6R0.6 CNCCCOC Amb9204018 [1,0,0,0,0,0|3,0,0]=4 682 B6R0.6 CNCCCON Amb27430260 [1,0,0,0,0,0|3,0,0]=4 683 B6R0.6 CNCCCSC Amb6718995 [1,0,0,0,0,0|3,0,0]=4 684 B6R0.6 CNCCSSC Amb28146208 [1,0,0,0,0,0|2,1,0]=4 685 B6R0.6 CNOCCOC Amb32412843 [1,0,0,0,0,0|2,0,0]=3 686 B6R0.6 CN\N=N\CCO Amb27857439 [1,0,0,0,0,0|3,0,0]=4 687 B6R0.6 COCCCC#N Amb6258835 [1,0,0,0,0,0|2,0,1]=4 688 B6R0.6 COCCCC=O Amb33530955 [1,0,0,0,0,0|1,0,2]=4 689 B6R0.6 COCCCCBr Amb8855443 [1,0,0,0,0,0|2,0,0]=3 690 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|2,0,0]=3 691 B6R0.6 COCCCCI Amb25933499 [1,0,0,0,0,0|2,0,0]=3 692 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|2,0,0]=3 693 B6R0.6 COCCCCN Amb6251056 [1,0,0,0,0,0|2,0,0]=3 694 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|1,0,0]=2 695 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|1,1,0]=3 696 B6R0.6 COCCCNN Amb25887940 [1,0,0,0,0,0|3,0,0]=4 697 B6R0.6 COCCCNN Amb33204509 [1,0,0,0,0,0|3,0,0]=4 698 B6R0.6 COCCCNN Amb33553392 [1,0,0,0,0,0|3,0,0]=4 699 B6R0.6 COCCCNO Amb33378127 [1,0,0,0,0,0|2,0,0]=3 700 B6R0.6 COCCCOC Amb22168275 [1,0,0,0,0,0|3,0,0]=4 701 B6R0.6 COCCCON Amb18559290 [1,0,0,0,0,0|3,0,0]=4 702 B6R0.6 COCCCSC Amb28139052 [1,0,0,0,0,0|3,0,0]=4 703 B6R0.6 COCCOCCl Amb6608984 [1,0,0,0,0,0|2,0,0]=3 704 B6R0.6 COCCOCO Amb28281708 [1,0,0,0,0,0|1,0,0]=2 705 B6R0.6 COCCSCCl Amb33545127 [1,0,0,0,0,0|2,1,0]=4 706 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|2,0,0]=3 707 B6R0.6 COCOCC#N Amb28288512 [1,0,0,0,0,0|2,0,1]=4 708 B6R0.6 COCOCC=O Amb27409311 [1,0,0,0,0,0|1,0,2]=4 709 B6R0.6 COCOCCCl Amb22546806 [1,0,0,0,0,0|2,0,0]=3 710 B6R0.6 COCOCCI Amb26443893 [1,0,0,0,0,0|2,0,0]=3 711 B6R0.6 COCOCCN Amb25314793 [1,0,0,0,0,0|2,0,0]=3 712 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|1,0,0]=2 713 B6R0.6 COC\C=C\CO Amb33428788 [1,0,0,0,0,0|1,0,2]=4 714 B6R0.6 CONCCCN Amb26953498 [1,0,0,0,0,0|3,0,0]=4 715 B6R0.6 CONCCCN Amb30584683 [1,0,0,0,0,0|3,0,0]=4 716 B6R0.6 CONCCCN Amb32666616 [1,0,0,0,0,0|3,0,0]=4 717 B6R0.6 CONCCCO Amb24479622 [1,0,0,0,0,0|2,0,0]=3 718 B6R0.6 CONCCCO Amb33456216 [1,0,0,0,0,0|2,0,0]=3 719 B6R0.6 CSC#CCCO Amb17593203 [1,0,0,0,0,0|1,0,2]=4 720 B6R0.6 CSCCCC#N Amb17504231 [1,0,0,0,0,0|2,0,1]=4 721 B6R0.6 CSCCCC=O Amb25992553 [1,0,0,0,0,0|1,0,2]=4 722 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|2,0,0]=3 723 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|2,0,0]=3 724 B6R0.6 CSCCCCF Amb27620229 [1,0,0,0,0,0|2,0,0]=3 725 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|2,0,0]=3 726 B6R0.6 CSCCCCO Amb9825911 [1,0,0,0,0,0|1,0,0]=2 727 B6R0.6 CSCCCCS Amb27461555 [1,0,0,0,0,0|1,1,0]=3 728 B6R0.6 CSCCCNN Amb24093854 [1,0,0,0,0,0|3,0,0]=4 729 B6R0.6 CSCCCNO Amb27948053 [1,0,0,0,0,0|2,0,0]=3 730 B6R0.6 CSCCCON Amb27947150 [1,0,0,0,0,0|3,0,0]=4 731 B6R0.6 CSCCCSC Amb22043311 [1,0,0,0,0,0|3,0,0]=4 732 B6R0.6 CSC\C=C\CO Amb33079758 [1,0,0,0,0,0|1,0,2]=4 733 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|1,0,1]=3 734 B6R0.6 C\C=C/CCCN Amb27658374 [1,0,0,0,0,0|1,0,2]=4 735 B6R0.6 C\C=C/CCCO Amb17614951 [1,0,0,0,0,0|0,0,2]=3 736 B6R0.6 C\C=C\CCCC Amb8515158 [1,0,0,0,0,0|1,0,1]=3 737 B6R0.6 C\C=C\CCCI Amb25837122 [1,0,0,0,0,0|1,0,2]=4 738 B6R0.6 C\C=C\CCCO Amb22347882 [1,0,0,0,0,0|0,0,2]=3 739 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|2,0,1]=4 740 B6R0.6 C\C=N\NCCO Amb25888442 [1,0,0,0,0,0|2,0,1]=4 741 B6R0.6 ClCCCCCBr Amb2724373 [1,0,0,0,0,0|2,0,0]=3 742 B6R0.6 ClCCCCCCl Amb6608828 [1,0,0,0,0,0|2,0,0]=3 743 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|2,0,0]=3 744 B6R0.6 ClCCCOCBr Amb28458531 [1,0,0,0,0,0|2,0,0]=3 745 B6R0.6 ClCCCOCCl Amb24479881 [1,0,0,0,0,0|2,0,0]=3 746 B6R0.6 ClCCNCCCl Amb2583221 [1,0,0,0,0,0|3,0,0]=4 747 B6R0.6 ClCCNCCCl Amb6366187 [1,0,0,0,0,0|3,0,0]=4 748 B6R0.6 ClCCOCCCl Amb2684745 [1,0,0,0,0,0|2,0,0]=3 749 B6R0.6 ClCCOCCI Amb24055322 [1,0,0,0,0,0|2,0,0]=3 750 B6R0.6 ClCCSCCBr Amb27838203 [1,0,0,0,0,0|2,1,0]=4 751 B6R0.6 ClCCSCCCl Amb22731869 [1,0,0,0,0,0|2,1,0]=4 752 B6R0.6 ClCOCCCBr Amb25889019 [1,0,0,0,0,0|2,0,0]=3 753 B6R0.6 ClCOCOCCl Amb22330563 [1,0,0,0,0,0|3,0,0]=4 754 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|2,0,0]=3 755 B6R0.6 FCCCCCF Amb27397467 [1,0,0,0,0,0|2,0,0]=3 756 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|1,1,0]=3 757 B6R0.6 FCCNCCBr Amb28041488 [1,0,0,0,0,0|3,0,0]=4 758 B6R0.6 FCCNCCF Amb27627389 [1,0,0,0,0,0|3,0,0]=4 759 B6R0.6 FCCSCCCl Amb28423486 [1,0,0,0,0,0|2,1,0]=4 760 B6R0.6 ICCCCCI Amb8514835 [1,0,0,0,0,0|2,0,0]=3 761 B6R0.6 ICCOCCI Amb2694690 [1,0,0,0,0,0|2,0,0]=3 762 B6R0.6 N#CCCCCBr Amb2685556 [1,0,0,0,0,0|2,0,1]=4 763 B6R0.6 N#CCCCCCl Amb3940299 [1,0,0,0,0,0|2,0,1]=4 764 B6R0.6 N#CCCCCF Amb26935678 [1,0,0,0,0,0|2,0,1]=4 765 B6R0.6 N#CCCCCI Amb27650166 [1,0,0,0,0,0|2,0,1]=4 766 B6R0.6 N#CCCCCN Amb30628578 [1,0,0,0,0,0|2,0,1]=4 767 B6R0.6 N#CCCCCN Amb33532899 [1,0,0,0,0,0|2,0,1]=4 768 B6R0.6 N#CCCCCO Amb33531864 [1,0,0,0,0,0|1,0,1]=3 769 B6R0.6 N#CCOCCBr Amb27985513 [1,0,0,0,0,0|2,0,1]=4 770 B6R0.6 N#CCOCCCl Amb22002338 [1,0,0,0,0,0|2,0,1]=4 771 B6R0.6 N#CCOCCF Amb27959065 [1,0,0,0,0,0|2,0,1]=4 772 B6R0.6 NCC#CCCO Amb27175344 [1,0,0,0,0,0|1,0,2]=4 773 B6R0.6 NCCCCC=O Amb26627836 [1,0,0,0,0,0|1,0,2]=4 774 B6R0.6 NCCCCCBr Amb26581378 [1,0,0,0,0,0|2,0,0]=3 775 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|2,0,0]=3 776 B6R0.6 NCCCCCF Amb28383861 [1,0,0,0,0,0|2,0,0]=3 777 B6R0.6 NCCCCCF Amb35747648 [1,0,0,0,0,0|2,0,0]=3 778 B6R0.6 NCCCCCI Amb27596855 [1,0,0,0,0,0|2,0,0]=3 779 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|2,0,0]=3 780 B6R0.6 NCCCCCN Amb8513099 [1,0,0,0,0,0|2,0,0]=3 781 B6R0.6 NCCCCCO Amb3939337 [1,0,0,0,0,0|1,0,0]=2 782 B6R0.6 NCCCCCS Amb33362345 [1,0,0,0,0,0|1,1,0]=3 783 B6R0.6 NCCCCCS Amb33527075 [1,0,0,0,0,0|1,1,0]=3 784 B6R0.6 NCCCCNO Amb24117989 [1,0,0,0,0,0|2,0,0]=3 785 B6R0.6 NCCCCNO Amb27668394 [1,0,0,0,0,0|2,0,0]=3 786 B6R0.6 NCCCCON Amb28188672 [1,0,0,0,0,0|3,0,0]=4 787 B6R0.6 NCCCOCF Amb33224234 [1,0,0,0,0,0|2,0,0]=3 788 B6R0.6 NCCNCCBr Amb27478238 [1,0,0,0,0,0|3,0,0]=4 789 B6R0.6 NCCNCCN Amb5722362 [1,0,0,0,0,0|3,0,0]=4 790 B6R0.6 NCCNCCO Amb6600573 [1,0,0,0,0,0|2,0,0]=3 791 B6R0.6 NCCNCCS Amb24763096 [1,0,0,0,0,0|2,1,0]=4 792 B6R0.6 NCCNCCS Amb33483741 [1,0,0,0,0,0|2,1,0]=4 793 B6R0.6 NCCOCCBr Amb25888513 [1,0,0,0,0,0|2,0,0]=3 794 B6R0.6 NCCOCCBr Amb35747990 [1,0,0,0,0,0|2,0,0]=3 795 B6R0.6 NCCOCCCl Amb22036609 [1,0,0,0,0,0|2,0,0]=3 796 B6R0.6 NCCOCCF Amb28320518 [1,0,0,0,0,0|2,0,0]=3 797 B6R0.6 NCCOCCF Amb33536623 [1,0,0,0,0,0|2,0,0]=3 798 B6R0.6 NCCOCCN Amb2583212 [1,0,0,0,0,0|2,0,0]=3 799 B6R0.6 NCCOCCN Amb8504888 [1,0,0,0,0,0|2,0,0]=3 800 B6R0.6 NCCOCCO Amb3939011 [1,0,0,0,0,0|1,0,0]=2 801 B6R0.6 NCCOCCS Amb17502015 [1,0,0,0,0,0|1,1,0]=3 802 B6R0.6 NCCOCCS Amb35789823 [1,0,0,0,0,0|1,1,0]=3 803 B6R0.6 NCCSCCN Amb32679817 [1,0,0,0,0,0|2,1,0]=4 804 B6R0.6 NCCSCCN Amb9695000 [1,0,0,0,0,0|2,1,0]=4 805 B6R0.6 NCCSCCO Amb2725559 [1,0,0,0,0,0|1,1,0]=3 806 B6R0.6 NC\C=C\CCO Amb27969293 [1,0,0,0,0,0|1,0,2]=4 807 B6R0.6 NNCCCCO Amb24692523 [1,0,0,0,0,0|2,0,0]=3 808 B6R0.6 NOCCCCF Amb27160797 [1,0,0,0,0,0|3,0,0]=4 809 B6R0.6 O=CCCCCBr Amb18126353 [1,0,0,0,0,0|1,0,2]=4 810 B6R0.6 O=CCCCCCl Amb18123550 [1,0,0,0,0,0|1,0,2]=4 811 B6R0.6 O=CCCCCO Amb10603837 [1,0,0,0,0,0|1,0,1]=3 812 B6R0.6 O=CNCCCO Amb27248821 [1,0,0,0,0,0|2,0,1]=4 813 B6R0.6 O=[PH2]OCCCO Amb27218913 [1,0,0,0,0,0|2,0,1]=4 814 B6R0.6 OCC#CCCBr Amb27261630 [1,0,0,0,0,0|1,0,2]=4 815 B6R0.6 OCC#CCCCl Amb27254169 [1,0,0,0,0,0|1,0,2]=4 816 B6R0.6 OCCC#CCBr Amb27401919 [1,0,0,0,0,0|1,0,2]=4 817 B6R0.6 OCCCC#CBr Amb28401370 [1,0,0,0,0,0|1,0,2]=4 818 B6R0.6 OCCCC#CCl Amb27457965 [1,0,0,0,0,0|1,0,2]=4 819 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|1,0,0]=2 820 B6R0.6 OCCCCCCl Amb8386939 [1,0,0,0,0,0|1,0,0]=2 821 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|1,0,0]=2 822 B6R0.6 OCCCCCO Amb6296608 [1,0,0,0,0,0|1,0,0]=2 823 B6R0.6 OCCCCNO Amb27396013 [1,0,0,0,0,0|2,0,0]=3 824 B6R0.6 OCCC\C=C\Br Amb27483322 [1,0,0,0,0,0|1,0,2]=4 825 B6R0.6 OCCC\C=C\I Amb27879078 [1,0,0,0,0,0|1,0,2]=4 826 B6R0.6 OCCNCCF Amb27468539 [1,0,0,0,0,0|2,0,0]=3 827 B6R0.6 OCCNCCO Amb22035219 [1,0,0,0,0,0|2,0,0]=3 828 B6R0.6 OCCNCCO Amb3997179 [1,0,0,0,0,0|2,0,0]=3 829 B6R0.6 OCCNCCS Amb18522180 [1,0,0,0,0,0|2,0,0]=3 830 B6R0.6 OCCOCCBr Amb24057456 [1,0,0,0,0,0|1,0,0]=2 831 B6R0.6 OCCOCCCl Amb3940337 [1,0,0,0,0,0|1,0,0]=2 832 B6R0.6 OCCOCCF Amb17593119 [1,0,0,0,0,0|1,0,0]=2 833 B6R0.6 OCCOCCI Amb27602214 [1,0,0,0,0,0|1,0,0]=2 834 B6R0.6 OCCOCCO Amb32671216 [1,0,0,0,0,0|1,0,0]=2 835 B6R0.6 OCCOCCO Amb6608789 [1,0,0,0,0,0|1,0,0]=2 836 B6R0.6 OCCOCCS Amb22008751 [1,0,0,0,0,0|1,0,0]=2 837 B6R0.6 OCCPCCO Amb27185495 [1,0,0,0,0,0|2,0,0]=3 838 B6R0.6 OCCSCCCl Amb27413860 [1,0,0,0,0,0|1,1,0]=3 839 B6R0.6 OCCSCCO Amb6891967 [1,0,0,0,0,0|1,1,0]=3 840 B6R0.6 OCCSCCS Amb27829564 [1,0,0,0,0,0|1,1,0]=3 841 B6R0.6 OCC\C=C/CBr Amb27750410 [1,0,0,0,0,0|1,0,2]=4 842 B6R0.6 OCC\C=C\CCl Amb27227431 [1,0,0,0,0,0|1,0,2]=4 843 B6R0.6 OCSCSCO Amb27826296 [1,0,0,0,0,0|2,1,0]=4 844 B6R0.6 OC\C=C\CCF Amb33196119 [1,0,0,0,0,0|1,0,2]=4 845 B6R0.6 OC\C=C\CCO Amb26017278 [1,0,0,0,0,0|1,0,2]=4 846 B6R0.6 SCCCCCS Amb8514611 [1,0,0,0,0,0|1,1,0]=3 847 B6R0.6 SCCOCCS Amb9786765 [1,0,0,0,0,0|1,1,0]=3 848 B6R0.6 SCCSCCS Amb9826816 [1,0,0,0,0,0|1,2,0]=4 849 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [1,0,0,0,0,0|2,0,0]=3 850 B6R0.6 [C-]#[N+]CCCCF Amb26005128 [1,0,0,0,0,0|2,0,1]=4 851 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,0,0,0,0,0|3,0,0]=4 852 B6R0.6 [C-]#[N+]CCCSC Amb33198739 [1,0,0,0,0,0|3,0,0]=4 853 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,0,0,0,0,0|1,0,1]=3 854 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [1,0,0,0,0,0|1,1,1]=4 855 B6R0.6 [N-]=[N+]=NCCCO Amb33538391 [1,0,0,0,0,0|3,0,0]=4 856 B8R0.1 C#CCC(=O)CCCC Amb8390126 [0,1,0,0,0,0|2,0,1]=4 857 B8R0.1 C#CCC(O)CCCC Amb8390125 [0,1,0,0,0,0|2,0,1]=4 858 B8R0.1 C#CCCC(=O)CCO Amb24384003 [0,1,0,0,0,0|1,0,2]=4 859 B8R0.1 C#CCCC(C)CCC Amb33320827 [0,1,0,0,0,0|2,0,1]=4 860 B8R0.1 C#CCCC(Cl)CCC Amb28207451 [0,1,0,0,0,0|2,0,1]=4 861 B8R0.1 C#CCCC(N)CCC Amb27837513 [0,1,0,0,0,0|2,0,1]=4 862 B8R0.1 C#CCN[C@@H](C)CCC Amb27796836 [0,1,0,0,0,0|2,0,1]=4 863 B8R0.1 C#CCOC(=O)CCC Amb27775365 [0,1,0,0,0,0|1,0,2]=4 864 B8R0.1 C#CCOC(C)CNC Amb18308378 [0,1,0,0,0,0|2,0,1]=4 865 B8R0.1 C#CCOC(C)OCC Amb2721532 [0,1,0,0,0,0|2,0,1]=4 866 B8R0.1 C=C(CCN)CCCC Amb25883662 [0,1,0,0,0,0|2,0,0]=3 867 B8R0.1 C=C(CCN)CCOC Amb33377324 [0,1,0,0,0,0|3,0,0]=4 868 B8R0.1 C=C(CCN)CCSC Amb33203372 [0,1,0,0,0,0|3,0,0]=4 869 B8R0.1 C=C(CCN)CSCC Amb33323663 [0,1,0,0,0,0|3,0,0]=4 870 B8R0.1 C=C(CCO)CCC=O Amb28367058 [0,1,0,0,0,0|2,0,1]=4 871 B8R0.1 C=CCC(=O)CCCC Amb10567269 [0,1,0,0,0,0|2,0,1]=4 872 B8R0.1 C=CCCC(=C)CCO Amb27218611 [0,1,0,0,0,0|1,0,2]=4 873 B8R0.1 C=CCCC(Cl)CCC Amb27646258 [0,1,0,0,0,0|2,0,1]=4 874 B8R0.1 C=CCCC(N)CCO Amb27595567 [0,1,0,0,0,0|1,0,2]=4 875 B8R0.1 C=CCCC(O)CCC Amb27837426 [0,1,0,0,0,0|2,0,1]=4 876 B8R0.1 C=CCCC(O)CCO Amb28049164 [0,1,0,0,0,0|1,0,2]=4 877 B8R0.1 C=CCOC(=O)CCC Amb3940492 [0,1,0,0,0,0|1,0,2]=4 878 B8R0.1 C=CCOC(C)CCO Amb28400858 [0,1,0,0,0,0|2,0,1]=4 879 B8R0.1 C=CCO[C@H](C)CCBr Amb27634910 [0,1,0,0,0,0|2,0,1]=4 880 B8R0.1 C=CCO[C@H](C)CCO Amb27752319 [0,1,0,0,0,0|2,0,1]=4 881 B8R0.1 C=CC[C@@H](O)CCCC Amb28139816 [0,1,0,0,0,0|2,0,1]=4 882 B8R0.1 CC#CC[C@@H](C)CCO Amb27768833 [0,1,0,0,0,0|1,0,2]=4 883 B8R0.1 CC(CC#N)NCCO Amb18304430 [0,1,0,0,0,0|2,0,1]=4 884 B8R0.1 CC(CC#N)OCCO Amb27397154 [0,1,0,0,0,0|1,0,1]=3 885 B8R0.1 CC(CCBr)CCCO Amb27863912 [0,1,0,0,0,0|2,0,0]=3 886 B8R0.1 CC(CCN)NCCN Amb27947771 [0,1,0,0,0,0|3,0,0]=4 887 B8R0.1 CC(CCN)SCCF Amb28062736 [0,1,0,0,0,0|2,1,0]=4 888 B8R0.1 CC(CCO)CCCO Amb28189390 [0,1,0,0,0,0|2,0,0]=3 889 B8R0.1 CC(CCO)NCCN Amb27473736 [0,1,0,0,0,0|3,0,0]=4 890 B8R0.1 CC(CCO)SCCF Amb27164900 [0,1,0,0,0,0|2,1,0]=4 891 B8R0.1 CCC#CC(Br)CCC Amb27243978 [0,1,0,0,0,0|2,0,1]=4 892 B8R0.1 CCCC(=N)NCCF Amb28314727 [0,1,0,0,0,0|2,0,1]=4 893 B8R0.1 CCCC(=O)CCCF Amb28182770 [0,1,0,0,0,0|2,0,1]=4 894 B8R0.1 CCCC(=O)CCCN Amb27866597 [0,1,0,0,0,0|2,0,1]=4 895 B8R0.1 CCCC(=O)NCCCl Amb17103189 [0,1,0,0,0,0|2,0,1]=4 896 B8R0.1 CCCC(=O)NCCI Amb27225208 [0,1,0,0,0,0|2,0,1]=4 897 B8R0.1 CCCC(=O)NCCN Amb6242301 [0,1,0,0,0,0|2,0,1]=4 898 B8R0.1 CCCC(=O)NCCO Amb5797547 [0,1,0,0,0,0|1,0,1]=3 899 B8R0.1 CCCC(=O)OCC#N Amb27455769 [0,1,0,0,0,0|1,0,2]=4 900 B8R0.1 CCCC(=O)OCCBr Amb25087679 [0,1,0,0,0,0|1,0,1]=3 901 B8R0.1 CCCC(=O)OCCF Amb27448709 [0,1,0,0,0,0|1,0,1]=3 902 B8R0.1 CCCC(=O)OCCO Amb25937003 [0,1,0,0,0,0|0,0,1]=2 903 B8R0.1 CCCC(=O)OCSC Amb8393187 [0,1,0,0,0,0|2,0,1]=4 904 B8R0.1 CCCC(=O)SCCBr Amb27264823 [0,1,0,0,0,0|1,1,1]=4 905 B8R0.1 CCCC(=O)SCCO Amb27841882 [0,1,0,0,0,0|0,1,1]=3 906 B8R0.1 CCCC(=O)\C=C\CO Amb27806763 [0,1,0,0,0,0|1,0,2]=4 907 B8R0.1 CCCC(Br)CCCN Amb27645439 [0,1,0,0,0,0|2,0,0]=3 908 B8R0.1 CCCC(C)CCC#N Amb25104393 [0,1,0,0,0,0|2,0,1]=4 909 B8R0.1 CCCC(C)CCC=O Amb25032222 [0,1,0,0,0,0|1,0,2]=4 910 B8R0.1 CCCC(C)CCCBr Amb33533621 [0,1,0,0,0,0|2,0,0]=3 911 B8R0.1 CCCC(C)CCCCl Amb27859186 [0,1,0,0,0,0|2,0,0]=3 912 B8R0.1 CCCC(C)CCCN Amb27654811 [0,1,0,0,0,0|2,0,0]=3 913 B8R0.1 CCCC(C)CCCO Amb25135097 [0,1,0,0,0,0|1,0,0]=2 914 B8R0.1 CCCC(C)CCCS Amb33320795 [0,1,0,0,0,0|1,1,0]=3 915 B8R0.1 CCCC(C)CCNC Amb26948262 [0,1,0,0,0,0|3,0,0]=4 916 B8R0.1 CCCC(C)CCON Amb33320572 [0,1,0,0,0,0|3,0,0]=4 917 B8R0.1 CCCC(C)COCCl Amb27213174 [0,1,0,0,0,0|3,0,0]=4 918 B8R0.1 CCCC(C)NCCCl Amb27801679 [0,1,0,0,0,0|2,0,0]=3 919 B8R0.1 CCCC(C)NCCF Amb27838496 [0,1,0,0,0,0|2,0,0]=3 920 B8R0.1 CCCC(C)NCCN Amb28049074 [0,1,0,0,0,0|2,0,0]=3 921 B8R0.1 CCCC(C)OCCBr Amb27812220 [0,1,0,0,0,0|1,0,0]=2 922 B8R0.1 CCCC(C)OCCCl Amb27663690 [0,1,0,0,0,0|1,0,0]=2 923 B8R0.1 CCCC(C)OCCN Amb27267655 [0,1,0,0,0,0|1,0,0]=2 924 B8R0.1 CCCC(C)OCCS Amb27812221 [0,1,0,0,0,0|0,1,0]=2 925 B8R0.1 CCCC(C)\C=C\CN Amb28197349 [0,1,0,0,0,0|2,0,1]=4 926 B8R0.1 CCCC(C)\C=C\CO Amb33449086 [0,1,0,0,0,0|1,0,1]=3 927 B8R0.1 CCCC(N)CCCN Amb27255552 [0,1,0,0,0,0|2,0,0]=3 928 B8R0.1 CCCC(N)CCNC Amb27196610 [0,1,0,0,0,0|3,0,0]=4 929 B8R0.1 CCCC(O)CCCBr Amb27591160 [0,1,0,0,0,0|2,0,0]=3 930 B8R0.1 CCCC(O)CCCO Amb4035231 [0,1,0,0,0,0|1,0,0]=2 931 B8R0.1 CCCC(O)CCCS Amb25740546 [0,1,0,0,0,0|1,1,0]=3 932 B8R0.1 CCCC(O)CCOC Amb28049045 [0,1,0,0,0,0|3,0,0]=4 933 B8R0.1 CCCC(O)CNCC Amb27175353 [0,1,0,0,0,0|3,0,0]=4 934 B8R0.1 CCCC(O)\C=C\CO Amb27406730 [0,1,0,0,0,0|1,0,1]=3 935 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,1,0,0,0,0|3,0,0]=4 936 B8R0.1 CCCCC(=N)OCC Amb26549922 [0,1,0,0,0,0|3,0,0]=4 937 B8R0.1 CCCCC(=O)CC#N Amb7768265 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.1 CCCCC(=O)CCC Amb3940685 [0,1,0,0,0,0|2,0,0]=3 939 B8R0.1 CCCCC(=O)CCN Amb28186730 [0,1,0,0,0,0|2,0,0]=3 940 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,1,0,0,0,0|3,0,0]=4 941 B8R0.1 CCCCC(=O)COC Amb19374627 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.1 CCCCC(=O)CSC Amb27837495 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.1 CCCCC(=O)OCC Amb6296060 [0,1,0,0,0,0|3,0,0]=4 944 B8R0.1 CCCCC(=O)OCCl Amb28314260 [0,1,0,0,0,0|3,0,0]=4 945 B8R0.1 CCCCC(=O)\C=C\O Amb26515841 [0,1,0,0,0,0|1,0,2]=4 946 B8R0.1 CCCCC(=O)\C=N\O Amb27963887 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.1 CCCCC(Br)CCC Amb13951105 [0,1,0,0,0,0|2,0,0]=3 948 B8R0.1 CCCCC(C)CC#N Amb24703016 [0,1,0,0,0,0|2,0,1]=4 949 B8R0.1 CCCCC(C)CC=O Amb18642676 [0,1,0,0,0,0|1,0,2]=4 950 B8R0.1 CCCCC(C)CCBr Amb25809503 [0,1,0,0,0,0|2,0,0]=3 951 B8R0.1 CCCCC(C)CCC Amb22229830 [0,1,0,0,0,0|2,0,0]=3 952 B8R0.1 CCCCC(C)CCN Amb27817638 [0,1,0,0,0,0|2,0,0]=3 953 B8R0.1 CCCCC(C)CCO Amb22229364 [0,1,0,0,0,0|1,0,0]=2 954 B8R0.1 CCCCC(C)CON Amb33428412 [0,1,0,0,0,0|3,0,0]=4 955 B8R0.1 CCCCC(Cl)CCC Amb22229751 [0,1,0,0,0,0|2,0,0]=3 956 B8R0.1 CCCCC(Cl)CCO Amb27791848 [0,1,0,0,0,0|1,0,0]=2 957 B8R0.1 CCCCC(F)CCN Amb28383115 [0,1,0,0,0,0|2,0,0]=3 958 B8R0.1 CCCCC(F)CCO Amb27664743 [0,1,0,0,0,0|1,0,0]=2 959 B8R0.1 CCCCC(I)CCC Amb25314282 [0,1,0,0,0,0|2,0,0]=3 960 B8R0.1 CCCCC(N)CCC Amb9031790 [0,1,0,0,0,0|2,0,0]=3 961 B8R0.1 CCCCC(N)CCO Amb18642854 [0,1,0,0,0,0|1,0,0]=2 962 B8R0.1 CCCCC(N)CCO Amb24117271 [0,1,0,0,0,0|1,0,0]=2 963 B8R0.1 CCCCC(N)COC Amb19374470 [0,1,0,0,0,0|3,0,0]=4 964 B8R0.1 CCCCC(O)CC#N Amb18642535 [0,1,0,0,0,0|2,0,1]=4 965 B8R0.1 CCCCC(O)CCN Amb25784846 [0,1,0,0,0,0|2,0,0]=3 966 B8R0.1 CCCCC(O)CNC Amb24351205 [0,1,0,0,0,0|3,0,0]=4 967 B8R0.1 CCCCN(C)CC=O Amb27651977 [0,1,0,0,0,0|1,0,2]=4 968 B8R0.1 CCCCN(C)CCF Amb28049439 [0,1,0,0,0,0|2,0,0]=3 969 B8R0.1 CCCCN(C)CCN Amb5357834 [0,1,0,0,0,0|2,0,0]=3 970 B8R0.1 CCCCN(C)CCO Amb3204758 [0,1,0,0,0,0|1,0,0]=2 971 B8R0.1 CCCCN(N)CCO Amb28398931 [0,1,0,0,0,0|1,0,0]=2 972 B8R0.1 CCCCS(=O)CCO Amb6752517 [0,1,0,0,0,0|0,1,0]=2 973 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,1,0,0,0,0|1,0,0]=2 974 B8R0.1 CCCC[C@@H](Cl)CCC Amb27185673 [0,1,0,0,0,0|2,0,0]=3 975 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,1,0,0,0,0|1,0,0]=2 976 B8R0.1 CCCC[C@@H](O)CCBr Amb28320766 [0,1,0,0,0,0|2,0,0]=3 977 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,1,0,0,0,0|2,0,0]=3 978 B8R0.1 CCCC[C@H](F)CCO Amb28049226 [0,1,0,0,0,0|1,0,0]=2 979 B8R0.1 CCCC[C@H](N)CCO Amb27947953 [0,1,0,0,0,0|1,0,0]=2 980 B8R0.1 CCCC[C@H](N)CNC Amb27853746 [0,1,0,0,0,0|3,0,0]=4 981 B8R0.1 CCCC[C@H](O)CC#N Amb27208114 [0,1,0,0,0,0|2,0,1]=4 982 B8R0.1 CCCC[C@H](O)CCBr Amb27483780 [0,1,0,0,0,0|2,0,0]=3 983 B8R0.1 CCCC[C@H](O)CCN Amb26996017 [0,1,0,0,0,0|2,0,0]=3 984 B8R0.1 CCCC\C(C)=C\CO Amb28041191 [0,1,0,0,0,0|1,0,1]=3 985 B8R0.1 CCCC\C(F)=C\CO Amb28315526 [0,1,0,0,0,0|1,0,1]=3 986 B8R0.1 CCCC\C(I)=C\CO Amb28057014 [0,1,0,0,0,0|1,0,1]=3 987 B8R0.1 CCCN(C)CCCI Amb28318380 [0,1,0,0,0,0|3,0,0]=4 988 B8R0.1 CCCN(C)CCCN Amb6670577 [0,1,0,0,0,0|3,0,0]=4 989 B8R0.1 CCCNC(=O)CCBr Amb17333407 [0,1,0,0,0,0|3,0,0]=4 990 B8R0.1 CCCNC(=O)CCCl Amb1128924 [0,1,0,0,0,0|3,0,0]=4 991 B8R0.1 CCCNC(=O)CCN Amb1133966 [0,1,0,0,0,0|3,0,0]=4 992 B8R0.1 CCCNC(=O)CCN Amb21957303 [0,1,0,0,0,0|3,0,0]=4 993 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,1,0,0,0,0|2,0,0]=3 994 B8R0.1 CCCNC(C)CCCl Amb28285307 [0,1,0,0,0,0|3,0,0]=4 995 B8R0.1 CCCNS(=O)CCC Amb28144943 [0,1,0,0,0,0|2,1,0]=4 996 B8R0.1 CCCOC(=N)CCO Amb27757381 [0,1,0,0,0,0|2,0,0]=3 997 B8R0.1 CCCOC(=O)CCC Amb8517637 [0,1,0,0,0,0|1,0,1]=3 998 B8R0.1 CCCOC(=O)CCN Amb19409653 [0,1,0,0,0,0|2,0,1]=4 999 B8R0.1 CCCOC(=O)CCN Amb8874764 [0,1,0,0,0,0|2,0,1]=4 1000 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,1,0,0,0,0|2,0,0]=3 1001 B8R0.1 CCCOC(=O)CCS Amb22053845 [0,1,0,0,0,0|2,0,1]=4 1002 B8R0.1 CCCOC(=O)NCC Amb26642760 [0,1,0,0,0,0|2,0,1]=4 1003 B8R0.1 CCCOC(=O)NCO Amb25082749 [0,1,0,0,0,0|3,0,0]=4 1004 B8R0.1 CCCOC(=S)NCC Amb28340500 [0,1,0,0,0,0|2,0,1]=4 1005 B8R0.1 CCCOC(C)CNC Amb28397738 [0,1,0,0,0,0|2,0,0]=3 1006 B8R0.1 CCCS(=O)CCCBr Amb27398529 [0,1,0,0,0,0|2,1,0]=4 1007 B8R0.1 CCCSC(C)COC Amb27837602 [0,1,0,0,0,0|2,1,0]=4 1008 B8R0.1 CCCSS(=O)CCC Amb28077285 [0,1,0,0,0,0|2,1,0]=4 1009 B8R0.1 CCC[C@@H](C)CCCBr Amb27607669 [0,1,0,0,0,0|2,0,0]=3 1010 B8R0.1 CCC[C@@H](C)CCCN Amb27488815 [0,1,0,0,0,0|2,0,0]=3 1011 B8R0.1 CCC[C@@H](C)CCCO Amb28292905 [0,1,0,0,0,0|1,0,0]=2 1012 B8R0.1 CCC[C@@H](O)CCOC Amb27660393 [0,1,0,0,0,0|3,0,0]=4 1013 B8R0.1 CCC[C@H](C)CCCO Amb28065801 [0,1,0,0,0,0|1,0,0]=2 1014 B8R0.1 CCC[C@H](C)\C=C\CO Amb28049085 [0,1,0,0,0,0|1,0,1]=3 1015 B8R0.1 CCC[C@H](N)CNCC Amb26957468 [0,1,0,0,0,0|3,0,0]=4 1016 B8R0.1 CCC[C@H](N)CSCC Amb28369366 [0,1,0,0,0,0|3,0,0]=4 1017 B8R0.1 CCC[C@H](O)CCCO Amb28049112 [0,1,0,0,0,0|1,0,0]=2 1018 B8R0.1 CCC\C(C)=N\CCN Amb27784288 [0,1,0,0,0,0|2,0,1]=4 1019 B8R0.1 CCC\N=[N+](/[O-])CCC Amb27173662 [0,1,0,0,0,0|3,0,0]=4 1020 B8R0.1 CCNC(=N)NCCO Amb27793991 [0,1,0,0,0,0|2,0,1]=4 1021 B8R0.1 CCNC(=O)CCCO Amb17231872 [0,1,0,0,0,0|2,0,1]=4 1022 B8R0.1 CCNC(=O)NCCO Amb9361462 [0,1,0,0,0,0|2,0,1]=4 1023 B8R0.1 CCNC(=O)OCCN Amb28132703 [0,1,0,0,0,0|2,0,1]=4 1024 B8R0.1 CCNCC(C)CCCl Amb27950091 [0,1,0,0,0,0|3,0,0]=4 1025 B8R0.1 CCOC(=N)CCCO Amb27390716 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,1,0,0,0,0|2,0,1]=4 1027 B8R0.1 CCOC(=O)NCCO Amb3939457 [0,1,0,0,0,0|2,0,1]=4 1028 B8R0.1 CCOC(=O)OCCBr Amb24480075 [0,1,0,0,0,0|2,0,1]=4 1029 B8R0.1 CCOC(=O)OCCO Amb28072969 [0,1,0,0,0,0|1,0,1]=3 1030 B8R0.1 CCOC(=O)OCCS Amb26511404 [0,1,0,0,0,0|1,1,1]=4 1031 B8R0.1 CCOC(C)CCCBr Amb33006294 [0,1,0,0,0,0|3,0,0]=4 1032 B8R0.1 CCOC(C)CCCN Amb28049325 [0,1,0,0,0,0|3,0,0]=4 1033 B8R0.1 CCOC(C)CCCO Amb26454825 [0,1,0,0,0,0|2,0,0]=3 1034 B8R0.1 CCOC(C)CCCS Amb33424965 [0,1,0,0,0,0|2,1,0]=4 1035 B8R0.1 CCOC(C)OCC=O Amb28046272 [0,1,0,0,0,0|1,0,2]=4 1036 B8R0.1 CCOC(C)OCCBr Amb27657234 [0,1,0,0,0,0|2,0,0]=3 1037 B8R0.1 CCOC(C)OCCCl Amb10075209 [0,1,0,0,0,0|2,0,0]=3 1038 B8R0.1 CCOC(C)OCCN Amb33343240 [0,1,0,0,0,0|2,0,0]=3 1039 B8R0.1 CCOC(C)\C=C\CO Amb33225077 [0,1,0,0,0,0|2,0,1]=4 1040 B8R0.1 CCOCC(C)CCBr Amb27632410 [0,1,0,0,0,0|3,0,0]=4 1041 B8R0.1 CCOCC(C)CCO Amb27662371 [0,1,0,0,0,0|2,0,0]=3 1042 B8R0.1 CCOCC(Cl)CCO Amb27983791 [0,1,0,0,0,0|2,0,0]=3 1043 B8R0.1 CCOCC(N)CCO Amb27955043 [0,1,0,0,0,0|2,0,0]=3 1044 B8R0.1 CCOCC(O)CCN Amb26342443 [0,1,0,0,0,0|3,0,0]=4 1045 B8R0.1 CCOCN(C)CCO Amb27394886 [0,1,0,0,0,0|2,0,0]=3 1046 B8R0.1 CCOC[C@@H](O)CCN Amb32660151 [0,1,0,0,0,0|3,0,0]=4 1047 B8R0.1 CCOC[C@H](O)CCN Amb32660157 [0,1,0,0,0,0|3,0,0]=4 1048 B8R0.1 CCONC(=O)CCO Amb27826995 [0,1,0,0,0,0|3,0,0]=4 1049 B8R0.1 CCOP(O)OCCCl Amb27491323 [0,1,0,0,0,0|3,0,0]=4 1050 B8R0.1 CCO[PH](=O)OCCO Amb27768647 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.1 CCSCC(=O)CCN Amb33324045 [0,1,0,0,0,0|3,0,0]=4 1052 B8R0.1 CCSCC(C)CCN Amb33324044 [0,1,0,0,0,0|3,0,0]=4 1053 B8R0.1 CCSCC(F)CCN Amb33323743 [0,1,0,0,0,0|3,0,0]=4 1054 B8R0.1 CCSCC(N)CCO Amb25336776 [0,1,0,0,0,0|2,0,0]=3 1055 B8R0.1 CCSCC(O)CCN Amb26613825 [0,1,0,0,0,0|3,0,0]=4 1056 B8R0.1 CCSC[C@@H](O)CCN Amb33321297 [0,1,0,0,0,0|3,0,0]=4 1057 B8R0.1 CCSC[C@H](O)CCN Amb33321513 [0,1,0,0,0,0|3,0,0]=4 1058 B8R0.1 CC\C=C(\C)CCCO Amb28192896 [0,1,0,0,0,0|1,0,2]=4 1059 B8R0.1 CC\C=C(\C)SCCO Amb27260247 [0,1,0,0,0,0|0,1,2]=4 1060 B8R0.1 CC\C=C\C(N)CCO Amb33225039 [0,1,0,0,0,0|1,0,2]=4 1061 B8R0.1 CN(CCCl)CCCO Amb27403185 [0,1,0,0,0,0|3,0,0]=4 1062 B8R0.1 CN(CCN)CCCN Amb28198079 [0,1,0,0,0,0|3,0,0]=4 1063 B8R0.1 CN(CCN)CCCO Amb25735966 [0,1,0,0,0,0|3,0,0]=4 1064 B8R0.1 CN(CCO)CCC=O Amb27837419 [0,1,0,0,0,0|2,0,1]=4 1065 B8R0.1 CN(CCO)CCCBr Amb18318021 [0,1,0,0,0,0|2,0,0]=3 1066 B8R0.1 CN(CCO)CCCN Amb6702401 [0,1,0,0,0,0|2,0,0]=3 1067 B8R0.1 CN(CCO)CCCO Amb28049324 [0,1,0,0,0,0|2,0,0]=3 1068 B8R0.1 CN(CCO)CCON Amb28137272 [0,1,0,0,0,0|3,0,0]=4 1069 B8R0.1 CNCC(=O)NCCO Amb8866820 [0,1,0,0,0,0|2,0,1]=4 1070 B8R0.1 CNCC(C)NCCO Amb27639751 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.1 CNCC(C)OCC#N Amb18308382 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.1 CNCCC(C)CCBr Amb27867638 [0,1,0,0,0,0|3,0,0]=4 1073 B8R0.1 CNCCC(C)CCO Amb17569925 [0,1,0,0,0,0|2,0,0]=3 1074 B8R0.1 CNCCN(C)CCN Amb24477889 [0,1,0,0,0,0|3,0,0]=4 1075 B8R0.1 CNCCN(C)CCO Amb27810553 [0,1,0,0,0,0|2,0,0]=3 1076 B8R0.1 CNCCN(C)CCO Amb28934953 [0,1,0,0,0,0|2,0,0]=3 1077 B8R0.1 CNCCS(=O)CCF Amb27452574 [0,1,0,0,0,0|2,1,0]=4 1078 B8R0.1 COCC(=O)CCCO Amb27869244 [0,1,0,0,0,0|2,0,1]=4 1079 B8R0.1 COCC(=O)NCCO Amb25828239 [0,1,0,0,0,0|2,0,1]=4 1080 B8R0.1 COCC(=O)OCCBr Amb33276573 [0,1,0,0,0,0|2,0,1]=4 1081 B8R0.1 COCC(=O)OCCCl Amb28137490 [0,1,0,0,0,0|2,0,1]=4 1082 B8R0.1 COCC(=O)OCCO Amb28366893 [0,1,0,0,0,0|1,0,1]=3 1083 B8R0.1 COCC(C)NCCF Amb27627751 [0,1,0,0,0,0|3,0,0]=4 1084 B8R0.1 COCC(C)OCCN Amb28079304 [0,1,0,0,0,0|2,0,0]=3 1085 B8R0.1 COCC(C)OCCO Amb27199610 [0,1,0,0,0,0|1,0,0]=2 1086 B8R0.1 COCC(C)SCCO Amb28200280 [0,1,0,0,0,0|1,1,0]=3 1087 B8R0.1 COCC(O)CCCCl Amb27838445 [0,1,0,0,0,0|3,0,0]=4 1088 B8R0.1 COCC(O)CCCO Amb27806873 [0,1,0,0,0,0|2,0,0]=3 1089 B8R0.1 COCC(S)CCCN Amb32788185 [0,1,0,0,0,0|3,0,0]=4 1090 B8R0.1 COCCC(=O)CCN Amb33377832 [0,1,0,0,0,0|3,0,0]=4 1091 B8R0.1 COCCC(C)CCBr Amb28121179 [0,1,0,0,0,0|3,0,0]=4 1092 B8R0.1 COCCC(C)CCCl Amb24524178 [0,1,0,0,0,0|3,0,0]=4 1093 B8R0.1 COCCC(C)CCN Amb17569943 [0,1,0,0,0,0|3,0,0]=4 1094 B8R0.1 COCCC(F)CCN Amb33376830 [0,1,0,0,0,0|3,0,0]=4 1095 B8R0.1 COCCC(N)CCO Amb32946713 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.1 COCCC(O)CCN Amb27210699 [0,1,0,0,0,0|3,0,0]=4 1097 B8R0.1 COCCC(O)CCO Amb28189604 [0,1,0,0,0,0|2,0,0]=3 1098 B8R0.1 COCCN(C)CCBr Amb18321374 [0,1,0,0,0,0|3,0,0]=4 1099 B8R0.1 COCCN(C)CCCl Amb17334318 [0,1,0,0,0,0|3,0,0]=4 1100 B8R0.1 COCCN(C)CCF Amb27968931 [0,1,0,0,0,0|3,0,0]=4 1101 B8R0.1 COCCN(C)CCN Amb8956740 [0,1,0,0,0,0|3,0,0]=4 1102 B8R0.1 COCCN(C)CCO Amb17334138 [0,1,0,0,0,0|2,0,0]=3 1103 B8R0.1 COCC[C@@H](O)CCN Amb33377802 [0,1,0,0,0,0|3,0,0]=4 1104 B8R0.1 COCC[C@H](O)CCN Amb33377803 [0,1,0,0,0,0|3,0,0]=4 1105 B8R0.1 COCOC(C)CCO Amb26875634 [0,1,0,0,0,0|3,0,0]=4 1106 B8R0.1 COCSC(C)CCO Amb27180843 [0,1,0,0,0,0|3,0,0]=4 1107 B8R0.1 COC[C@H](C)OCC=O Amb27222608 [0,1,0,0,0,0|1,0,2]=4 1108 B8R0.1 CSCC(C)NCCN Amb27956549 [0,1,0,0,0,0|3,0,0]=4 1109 B8R0.1 CSCCC(=O)CCN Amb33198765 [0,1,0,0,0,0|3,0,0]=4 1110 B8R0.1 CSCCC(C)CCN Amb28048195 [0,1,0,0,0,0|3,0,0]=4 1111 B8R0.1 CSCCC(C)CCS Amb27838577 [0,1,0,0,0,0|2,1,0]=4 1112 B8R0.1 CSCCC(F)CCN Amb33198730 [0,1,0,0,0,0|3,0,0]=4 1113 B8R0.1 CSCCC(N)CCO Amb27455675 [0,1,0,0,0,0|2,0,0]=3 1114 B8R0.1 CSCCC(O)CCN Amb25899755 [0,1,0,0,0,0|3,0,0]=4 1115 B8R0.1 CSCCN(C)CCN Amb28348114 [0,1,0,0,0,0|3,0,0]=4 1116 B8R0.1 CSCC[C@@H](N)CCO Amb27950118 [0,1,0,0,0,0|2,0,0]=3 1117 B8R0.1 CSCC[C@@H](O)CCN Amb33198731 [0,1,0,0,0,0|3,0,0]=4 1118 B8R0.1 CSCC[C@H](N)CCO Amb27236737 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.1 CSCC[C@H](O)CCN Amb33198732 [0,1,0,0,0,0|3,0,0]=4 1120 B8R0.1 C\C(=C/CCO)CCBr Amb27489112 [0,1,0,0,0,0|2,0,1]=4 1121 B8R0.1 C\C(=C/CO)CCCN Amb27469758 [0,1,0,0,0,0|2,0,1]=4 1122 B8R0.1 C\C=C\CS(=O)CCO Amb28345117 [0,1,0,0,0,0|0,1,2]=4 1123 B8R0.1 N#CCCS(=O)CCO Amb27761663 [0,1,0,0,0,0|1,1,1]=4 1124 B8R0.1 NCCC(Cl)CCNO Amb27431500 [0,1,0,0,0,0|3,0,0]=4 1125 B8R0.1 NCCCC(N)CCN Amb25145974 [0,1,0,0,0,0|3,0,0]=4 1126 B8R0.1 NCCCC(N)CCO Amb28285147 [0,1,0,0,0,0|2,0,0]=3 1127 B8R0.1 NCCCS(=O)CCF Amb27838501 [0,1,0,0,0,0|2,1,0]=4 1128 B8R0.1 NCCNC(=O)CCO Amb27624387 [0,1,0,0,0,0|3,0,0]=4 1129 B8R0.1 NCCOC(=O)CCN Amb28201809 [0,1,0,0,0,0|2,0,1]=4 1130 B8R0.1 O=C(CCBr)CCCCl Amb24434557 [0,1,0,0,0,0|3,0,0]=4 1131 B8R0.1 O=C(CCBr)NCCO Amb17325574 [0,1,0,0,0,0|2,0,1]=4 1132 B8R0.1 O=C(CCCl)NCCO Amb17326981 [0,1,0,0,0,0|2,0,1]=4 1133 B8R0.1 O=C(CCO)NCCO Amb28197638 [0,1,0,0,0,0|2,0,1]=4 1134 B8R0.1 O=C(CCS)NCCO Amb24417502 [0,1,0,0,0,0|2,0,1]=4 1135 B8R0.1 O=C(CCS)OCCO Amb2721244 [0,1,0,0,0,0|1,0,1]=3 1136 B8R0.1 OCCCC(Cl)CCCl Amb27409130 [0,1,0,0,0,0|2,0,0]=3 1137 B8R0.1 OCCCC(O)CCO Amb28366883 [0,1,0,0,0,0|2,0,0]=3 1138 B8R0.1 OC\C=C\C(O)CCBr Amb28434657 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.1 [C-]#[N+]CCC(C)CCC Amb33322329 [0,1,0,0,0,0|3,0,0]=4 1140 B8R0.4 BrCCCCCCCBr Amb10069015 [0,1,0,0,0,0|2,0,0]=3 1141 B8R0.4 BrCCCOCCCBr Amb27206373 [0,1,0,0,0,0|2,0,0]=3 1142 B8R0.4 C#CCCCCCCBr Amb28119815 [0,1,0,0,0,0|2,0,1]=4 1143 B8R0.4 C#CCCCCCCC Amb3940501 [0,1,0,0,0,0|2,0,0]=3 1144 B8R0.4 C#CCCCCCCCl Amb24671901 [0,1,0,0,0,0|2,0,1]=4 1145 B8R0.4 C#CCCCCCCF Amb25702933 [0,1,0,0,0,0|2,0,1]=4 1146 B8R0.4 C#CCCCCCCO Amb16231466 [0,1,0,0,0,0|1,0,1]=3 1147 B8R0.4 C#CCCCOCCN Amb28061797 [0,1,0,0,0,0|1,0,1]=3 1148 B8R0.4 C#CCCCSCCN Amb27970230 [0,1,0,0,0,0|1,1,1]=4 1149 B8R0.4 C#CCCCSCCO Amb27242865 [0,1,0,0,0,0|0,1,1]=3 1150 B8R0.4 C#CCCNCCCN Amb27837512 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.4 C#CCCNCCCO Amb27837526 [0,1,0,0,0,0|1,0,2]=4 1152 B8R0.4 C#CCCNCCOC Amb27404296 [0,1,0,0,0,0|1,0,2]=4 1153 B8R0.4 C#CCCOCCCN Amb27463863 [0,1,0,0,0,0|2,0,0]=3 1154 B8R0.4 C#CCCOCCOC Amb33169102 [0,1,0,0,0,0|0,0,2]=3 1155 B8R0.4 C#CCCO\C=C\CO Amb28315455 [0,1,0,0,0,0|0,0,3]=4 1156 B8R0.4 C#CCCSCCCN Amb28422179 [0,1,0,0,0,0|2,1,0]=4 1157 B8R0.4 C#CCCSCCOC Amb27979692 [0,1,0,0,0,0|0,1,2]=4 1158 B8R0.4 C#CCC\C=C\CCC Amb33373746 [0,1,0,0,0,0|2,0,1]=4 1159 B8R0.4 C#CCNCCCCC Amb5262803 [0,1,0,0,0,0|2,0,1]=4 1160 B8R0.4 C#CCNCCCCN Amb27399534 [0,1,0,0,0,0|2,0,1]=4 1161 B8R0.4 C#CCNCCCOC Amb17308607 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.4 C#CCOCCCC#N Amb9208684 [0,1,0,0,0,0|1,0,2]=4 1163 B8R0.4 C#CCOCCCCN Amb27167146 [0,1,0,0,0,0|1,0,1]=3 1164 B8R0.4 C#CCOCCCCO Amb28292910 [0,1,0,0,0,0|1,0,1]=3 1165 B8R0.4 C#CCOCCNCC Amb27797913 [0,1,0,0,0,0|1,0,1]=3 1166 B8R0.4 C#CCO\N=C\CCC Amb27604806 [0,1,0,0,0,0|1,0,2]=4 1167 B8R0.4 C#CCSCCCCF Amb27487103 [0,1,0,0,0,0|1,1,1]=4 1168 B8R0.4 C#CCSCCCCN Amb17500974 [0,1,0,0,0,0|1,1,1]=4 1169 B8R0.4 C=C=CCNCCCC Amb28043104 [0,1,0,0,0,0|2,0,1]=4 1170 B8R0.4 C=CCC#CCCCC Amb22228000 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.4 C=CCCC#CCCO Amb27826982 [0,1,0,0,0,0|1,0,2]=4 1172 B8R0.4 C=CCCCC#CCO Amb27835887 [0,1,0,0,0,0|1,0,2]=4 1173 B8R0.4 C=CCCCCCCBr Amb3940223 [0,1,0,0,0,0|2,0,1]=4 1174 B8R0.4 C=CCCCCCCC Amb3940502 [0,1,0,0,0,0|2,0,0]=3 1175 B8R0.4 C=CCCCCCCCl Amb6298879 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.4 C=CCCCCCCI Amb26577493 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.4 C=CCCCCCCN Amb33543931 [0,1,0,0,0,0|2,0,1]=4 1178 B8R0.4 C=CCCCCCCO Amb22230162 [0,1,0,0,0,0|1,0,1]=3 1179 B8R0.4 C=CCCCCCNC Amb19335339 [0,1,0,0,0,0|2,0,1]=4 1180 B8R0.4 C=CCCCCCSC Amb27780646 [0,1,0,0,0,0|2,0,1]=4 1181 B8R0.4 C=CCCCCNCC Amb27461423 [0,1,0,0,0,0|2,0,1]=4 1182 B8R0.4 C=CCCCOCCN Amb25760642 [0,1,0,0,0,0|1,0,1]=3 1183 B8R0.4 C=CCCCOCCN Amb33189185 [0,1,0,0,0,0|1,0,1]=3 1184 B8R0.4 C=CCCCOCCS Amb27833751 [0,1,0,0,0,0|0,1,1]=3 1185 B8R0.4 C=CCCCSCCO Amb28352314 [0,1,0,0,0,0|0,1,1]=3 1186 B8R0.4 C=CCCC\C=C\CO Amb19930201 [0,1,0,0,0,0|1,0,2]=4 1187 B8R0.4 C=CCCNCCCF Amb27221526 [0,1,0,0,0,0|3,0,0]=4 1188 B8R0.4 C=CCCNCCCN Amb28129396 [0,1,0,0,0,0|3,0,0]=4 1189 B8R0.4 C=CCCNCCOC Amb22504625 [0,1,0,0,0,0|1,0,2]=4 1190 B8R0.4 C=CCCOCCC=O Amb28341311 [0,1,0,0,0,0|0,0,3]=4 1191 B8R0.4 C=CCCOCCCCl Amb9208734 [0,1,0,0,0,0|2,0,0]=3 1192 B8R0.4 C=CCCOCCCS Amb28206821 [0,1,0,0,0,0|2,0,0]=3 1193 B8R0.4 C=CCCSCCCC Amb28078650 [0,1,0,0,0,0|1,1,0]=3 1194 B8R0.4 C=CCNCCCCC Amb6706493 [0,1,0,0,0,0|2,0,1]=4 1195 B8R0.4 C=CCNCCCCCl Amb27815966 [0,1,0,0,0,0|2,0,1]=4 1196 B8R0.4 C=CCNCCCCF Amb27798055 [0,1,0,0,0,0|2,0,1]=4 1197 B8R0.4 C=CCNCCCCI Amb27596400 [0,1,0,0,0,0|2,0,1]=4 1198 B8R0.4 C=CCNCCNCC Amb27185783 [0,1,0,0,0,0|2,0,1]=4 1199 B8R0.4 C=CCOCCCC#N Amb9208774 [0,1,0,0,0,0|1,0,2]=4 1200 B8R0.4 C=CCOCCCC=O Amb26885457 [0,1,0,0,0,0|1,0,2]=4 1201 B8R0.4 C=CCOCCCCCl Amb28072994 [0,1,0,0,0,0|1,0,1]=3 1202 B8R0.4 C=CCOCCCCN Amb28345525 [0,1,0,0,0,0|1,0,1]=3 1203 B8R0.4 C=CCOCCCCO Amb26022466 [0,1,0,0,0,0|1,0,1]=3 1204 B8R0.4 C=CCOCCCCS Amb28068525 [0,1,0,0,0,0|1,0,1]=3 1205 B8R0.4 C=CCOCCCNC Amb27948343 [0,1,0,0,0,0|1,0,1]=3 1206 B8R0.4 C=CCOCCCSC Amb27868832 [0,1,0,0,0,0|1,0,1]=3 1207 B8R0.4 C=CCOCOCCO Amb28049259 [0,1,0,0,0,0|0,0,2]=3 1208 B8R0.4 C=CCONCCCC Amb27244013 [0,1,0,0,0,0|1,0,1]=3 1209 B8R0.4 C=CCONCCOC Amb27433219 [0,1,0,0,0,0|2,0,1]=4 1210 B8R0.4 C=CCSCCCCBr Amb27465812 [0,1,0,0,0,0|1,1,1]=4 1211 B8R0.4 C=CCSCCCCC Amb27837635 [0,1,0,0,0,0|1,1,1]=4 1212 B8R0.4 C=CCSCCCCCl Amb27795958 [0,1,0,0,0,0|1,1,1]=4 1213 B8R0.4 C=CCSCCCCF Amb28184818 [0,1,0,0,0,0|1,1,1]=4 1214 B8R0.4 C=CCSCCCCN Amb17500942 [0,1,0,0,0,0|1,1,1]=4 1215 B8R0.4 C=CCSCCCNC Amb27975525 [0,1,0,0,0,0|1,1,1]=4 1216 B8R0.4 C=CCSCCCSC Amb27628484 [0,1,0,0,0,0|1,1,1]=4 1217 B8R0.4 C=CNCCCCCC Amb27398596 [0,1,0,0,0,0|2,0,1]=4 1218 B8R0.4 C=COCCCCCC Amb24440550 [0,1,0,0,0,0|2,0,1]=4 1219 B8R0.4 C=COCCOCCN Amb27248278 [0,1,0,0,0,0|1,0,2]=4 1220 B8R0.4 C=COCCOCCO Amb22230541 [0,1,0,0,0,0|0,0,2]=3 1221 B8R0.4 CC#CCC#CCCO Amb28194180 [0,1,0,0,0,0|1,0,2]=4 1222 B8R0.4 CC#CCCCCCC Amb9134715 [0,1,0,0,0,0|2,0,1]=4 1223 B8R0.4 CC#CCCCCCO Amb27243915 [0,1,0,0,0,0|1,0,1]=3 1224 B8R0.4 CC#CCCNCCO Amb27410371 [0,1,0,0,0,0|1,0,1]=3 1225 B8R0.4 CC#CCCSCCC Amb27489037 [0,1,0,0,0,0|1,1,1]=4 1226 B8R0.4 CC#CCCSCCN Amb27780539 [0,1,0,0,0,0|1,1,1]=4 1227 B8R0.4 CC#CCSCCCC Amb27206321 [0,1,0,0,0,0|1,1,1]=4 1228 B8R0.4 CC#CCSCCOC Amb27479460 [0,1,0,0,0,0|0,1,2]=4 1229 B8R0.4 CCC#CC#CCCO Amb17593246 [0,1,0,0,0,0|1,0,2]=4 1230 B8R0.4 CCC#CCC#CCO Amb9134785 [0,1,0,0,0,0|1,0,2]=4 1231 B8R0.4 CCC#CCCCCC Amb9134716 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.4 CCC#CCCCCN Amb28049876 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.4 CCC#CCCCCO Amb26362942 [0,1,0,0,0,0|1,0,1]=3 1234 B8R0.4 CCC#CCOCCBr Amb28075793 [0,1,0,0,0,0|1,0,1]=3 1235 B8R0.4 CCC#CC\C=C/CO Amb17593279 [0,1,0,0,0,0|1,0,2]=4 1236 B8R0.4 CCC#C\C=C\CCO Amb27472464 [0,1,0,0,0,0|1,0,2]=4 1237 B8R0.4 CCCC#CCCCC Amb9134717 [0,1,0,0,0,0|2,0,0]=3 1238 B8R0.4 CCCC=C=CCCO Amb17593316 [0,1,0,0,0,0|1,0,1]=3 1239 B8R0.4 CCCCBCCCC Amb27624537 [0,1,0,0,0,0|2,0,0]=3 1240 B8R0.4 CCCCC#CCC#N Amb17593239 [0,1,0,0,0,0|2,0,1]=4 1241 B8R0.4 CCCCC#CCCCl Amb28050989 [0,1,0,0,0,0|2,0,0]=3 1242 B8R0.4 CCCCC#CCCO Amb2721716 [0,1,0,0,0,0|1,0,0]=2 1243 B8R0.4 CCCCCC#CCBr Amb2685374 [0,1,0,0,0,0|2,0,1]=4 1244 B8R0.4 CCCCCCCC#N Amb7764637 [0,1,0,0,0,0|2,0,0]=3 1245 B8R0.4 CCCCCCCC=O Amb6891949 [0,1,0,0,0,0|1,0,1]=3 1246 B8R0.4 CCCCCCCCBr Amb2689971 [0,1,0,0,0,0|2,0,0]=3 1247 B8R0.4 CCCCCCCCC Amb8513269 [0,1,0,0,0,0|2,0,0]=3 1248 B8R0.4 CCCCCCCCCl Amb7757832 [0,1,0,0,0,0|2,0,0]=3 1249 B8R0.4 CCCCCCCCF Amb10840379 [0,1,0,0,0,0|2,0,0]=3 1250 B8R0.4 CCCCCCCCI Amb637144 [0,1,0,0,0,0|2,0,0]=3 1251 B8R0.4 CCCCCCCCN Amb2720240 [0,1,0,0,0,0|2,0,0]=3 1252 B8R0.4 CCCCCCCCN Amb3940466 [0,1,0,0,0,0|2,0,0]=3 1253 B8R0.4 CCCCCCCCO Amb6608788 [0,1,0,0,0,0|1,0,0]=2 1254 B8R0.4 CCCCCCCCS Amb8513530 [0,1,0,0,0,0|1,1,0]=3 1255 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [0,1,0,0,0,0|2,0,0]=3 1256 B8R0.4 CCCCCCCNC Amb7761453 [0,1,0,0,0,0|2,0,0]=3 1257 B8R0.4 CCCCCCCNN Amb7794376 [0,1,0,0,0,0|2,0,0]=3 1258 B8R0.4 CCCCCCCOC Amb24584912 [0,1,0,0,0,0|1,0,0]=2 1259 B8R0.4 CCCCCCCSC Amb22359861 [0,1,0,0,0,0|1,1,0]=3 1260 B8R0.4 CCCCCCN=C=O Amb8516659 [0,1,0,0,0,0|1,0,2]=4 1261 B8R0.4 CCCCCCN=C=S Amb6572524 [0,1,0,0,0,0|1,1,1]=4 1262 B8R0.4 CCCCCCN=[N+]=[N-] Amb17939436 [0,1,0,0,0,0|3,0,0]=4 1263 B8R0.4 CCCCCCNC=S Amb27880264 [0,1,0,0,0,0|1,1,1]=4 1264 B8R0.4 CCCCCCNCC Amb6730567 [0,1,0,0,0,0|2,0,0]=3 1265 B8R0.4 CCCCCCOCC Amb17672946 [0,1,0,0,0,0|2,0,0]=3 1266 B8R0.4 CCCCCCOCCl Amb27473208 [0,1,0,0,0,0|2,0,0]=3 1267 B8R0.4 CCCCCCON=O Amb17672945 [0,1,0,0,0,0|2,0,1]=4 1268 B8R0.4 CCCCCCSC#N Amb2691625 [0,1,0,0,0,0|2,0,1]=4 1269 B8R0.4 CCCCCC\C=C\Br Amb24677708 [0,1,0,0,0,0|2,0,1]=4 1270 B8R0.4 CCCCCC\C=C\I Amb24446897 [0,1,0,0,0,0|2,0,1]=4 1271 B8R0.4 CCCCCC\C=N\N Amb28049289 [0,1,0,0,0,0|2,0,1]=4 1272 B8R0.4 CCCCCNCCC Amb6688182 [0,1,0,0,0,0|2,0,0]=3 1273 B8R0.4 CCCCCNCCCl Amb17334288 [0,1,0,0,0,0|2,0,0]=3 1274 B8R0.4 CCCCCNCCI Amb27411190 [0,1,0,0,0,0|2,0,0]=3 1275 B8R0.4 CCCCCNCCN Amb17091049 [0,1,0,0,0,0|2,0,0]=3 1276 B8R0.4 CCCCCNCCO Amb3940022 [0,1,0,0,0,0|1,0,0]=2 1277 B8R0.4 CCCCCOCC=O Amb27230502 [0,1,0,0,0,0|0,0,2]=3 1278 B8R0.4 CCCCCOCCCl Amb8902963 [0,1,0,0,0,0|1,0,0]=2 1279 B8R0.4 CCCCCOCCO Amb22264988 [0,1,0,0,0,0|0,0,0]=1 1280 B8R0.4 CCCCCOCCS Amb27752940 [0,1,0,0,0,0|0,1,0]=2 1281 B8R0.4 CCCCCSCCCl Amb25887277 [0,1,0,0,0,0|1,1,0]=3 1282 B8R0.4 CCCCCSCCN Amb6275043 [0,1,0,0,0,0|1,1,0]=3 1283 B8R0.4 CCCCCSCCO Amb1032987 [0,1,0,0,0,0|0,1,0]=2 1284 B8R0.4 CCCCCSCOC Amb27771414 [0,1,0,0,0,0|2,0,0]=3 1285 B8R0.4 CCCCC\C=C\CBr Amb17666913 [0,1,0,0,0,0|2,0,1]=4 1286 B8R0.4 CCCCC\C=C\CO Amb33038088 [0,1,0,0,0,0|1,0,1]=3 1287 B8R0.4 CCCCC\C=N\OC Amb28204102 [0,1,0,0,0,0|2,0,1]=4 1288 B8R0.4 CCCCNCCC#N Amb2685599 [0,1,0,0,0,0|2,0,0]=3 1289 B8R0.4 CCCCNCCCBr Amb28399869 [0,1,0,0,0,0|2,0,0]=3 1290 B8R0.4 CCCCNCCCC Amb22348285 [0,1,0,0,0,0|2,0,0]=3 1291 B8R0.4 CCCCNCCCC Amb3939027 [0,1,0,0,0,0|2,0,0]=3 1292 B8R0.4 CCCCNCCCC Amb4017913 [0,1,0,0,0,0|2,0,0]=3 1293 B8R0.4 CCCCNCCCCl Amb24529030 [0,1,0,0,0,0|2,0,0]=3 1294 B8R0.4 CCCCNCCCCl Amb33164142 [0,1,0,0,0,0|2,0,0]=3 1295 B8R0.4 CCCCNCCCN Amb17315267 [0,1,0,0,0,0|2,0,0]=3 1296 B8R0.4 CCCCNCCCO Amb4304116 [0,1,0,0,0,0|1,0,0]=2 1297 B8R0.4 CCCCNCCOC Amb6685727 [0,1,0,0,0,0|1,0,0]=2 1298 B8R0.4 CCCCNC\C=C\Br Amb27631443 [0,1,0,0,0,0|2,0,1]=4 1299 B8R0.4 CCCCNC\C=C\Cl Amb27860069 [0,1,0,0,0,0|2,0,1]=4 1300 B8R0.4 CCCCNOCCO Amb27956595 [0,1,0,0,0,0|0,0,0]=1 1301 B8R0.4 CCCCOC#CC=O Amb27947485 [0,1,0,0,0,0|0,0,3]=4 1302 B8R0.4 CCCCOCCC#N Amb8873730 [0,1,0,0,0,0|1,0,0]=2 1303 B8R0.4 CCCCOCCC=O Amb27880111 [0,1,0,0,0,0|0,0,1]=2 1304 B8R0.4 CCCCOCCCBr Amb8895241 [0,1,0,0,0,0|1,0,0]=2 1305 B8R0.4 CCCCOCCCC Amb8513426 [0,1,0,0,0,0|1,0,0]=2 1306 B8R0.4 CCCCOCCCN Amb3939348 [0,1,0,0,0,0|1,0,0]=2 1307 B8R0.4 CCCCOCCNN Amb27979085 [0,1,0,0,0,0|1,0,0]=2 1308 B8R0.4 CCCCOCCOC Amb33847381 [0,1,0,0,0,0|0,0,0]=1 1309 B8R0.4 CCCCOCN=C=O Amb28077635 [0,1,0,0,0,0|0,0,2]=3 1310 B8R0.4 CCCCOCNC=O Amb27392745 [0,1,0,0,0,0|0,0,2]=3 1311 B8R0.4 CCCCPCCCC Amb22730293 [0,1,0,0,0,0|2,0,0]=3 1312 B8R0.4 CCCCPCCCN Amb27217298 [0,1,0,0,0,0|2,0,0]=3 1313 B8R0.4 CCCCSCCC#N Amb9479932 [0,1,0,0,0,0|1,1,0]=3 1314 B8R0.4 CCCCSCCCF Amb27449027 [0,1,0,0,0,0|1,1,0]=3 1315 B8R0.4 CCCCSCCCN Amb9261123 [0,1,0,0,0,0|1,1,0]=3 1316 B8R0.4 CCCCSCCCS Amb28453845 [0,1,0,0,0,0|0,2,0]=3 1317 B8R0.4 CCCCSCCOC Amb27827301 [0,1,0,0,0,0|0,1,0]=2 1318 B8R0.4 CCCCSCNC=O Amb27656061 [0,1,0,0,0,0|0,1,2]=4 1319 B8R0.4 CCCCS\C=C\CO Amb27219509 [0,1,0,0,0,0|0,1,1]=3 1320 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [0,1,0,0,0,0|2,0,0]=3 1321 B8R0.4 CCCC[NH2+]CCCC Amb8516289 [0,1,0,0,0,0|2,0,0]=3 1322 B8R0.4 CCCC[SnH4+2]CCCC Amb22045422 [0,1,0,0,0,0|2,0,0]=3 1323 B8R0.4 CCCC[SnH4+2]CCCC Amb22045423 [0,1,0,0,0,0|2,0,0]=3 1324 B8R0.4 CCCC\C=C/CCO Amb26586236 [0,1,0,0,0,0|1,0,0]=2 1325 B8R0.4 CCCC\C=C\CCN Amb27788288 [0,1,0,0,0,0|2,0,0]=3 1326 B8R0.4 CCCC\C=C\CCO Amb9134733 [0,1,0,0,0,0|1,0,0]=2 1327 B8R0.4 CCCC\C=C\OCC Amb17674075 [0,1,0,0,0,0|2,0,1]=4 1328 B8R0.4 CCCN=C=NCCC Amb28248732 [0,1,0,0,0,0|2,0,1]=4 1329 B8R0.4 CCCNCCCCI Amb28072729 [0,1,0,0,0,0|2,0,0]=3 1330 B8R0.4 CCCNCCCCN Amb17334115 [0,1,0,0,0,0|2,0,0]=3 1331 B8R0.4 CCCNCCCCS Amb28349265 [0,1,0,0,0,0|1,1,0]=3 1332 B8R0.4 CCCNCCCOC Amb6730309 [0,1,0,0,0,0|2,0,0]=3 1333 B8R0.4 CCCNCCOCC Amb8841458 [0,1,0,0,0,0|2,0,0]=3 1334 B8R0.4 CCCNCCSCC Amb27837542 [0,1,0,0,0,0|2,0,0]=3 1335 B8R0.4 CCCNCNCCC Amb28250874 [0,1,0,0,0,0|2,0,0]=3 1336 B8R0.4 CCCNCSCCC Amb27784117 [0,1,0,0,0,0|1,1,0]=3 1337 B8R0.4 CCCOCC#CCCl Amb27619183 [0,1,0,0,0,0|1,0,2]=4 1338 B8R0.4 CCCOCCCC#N Amb8874818 [0,1,0,0,0,0|1,0,1]=3 1339 B8R0.4 CCCOCCCC=O Amb27795367 [0,1,0,0,0,0|1,0,1]=3 1340 B8R0.4 CCCOCCCCBr Amb8874783 [0,1,0,0,0,0|1,0,0]=2 1341 B8R0.4 CCCOCCCCCl Amb18181651 [0,1,0,0,0,0|1,0,0]=2 1342 B8R0.4 CCCOCCCCO Amb27395455 [0,1,0,0,0,0|1,0,0]=2 1343 B8R0.4 CCCOCCCON Amb27420839 [0,1,0,0,0,0|2,0,0]=3 1344 B8R0.4 CCCOCCNCC Amb28146663 [0,1,0,0,0,0|1,0,0]=2 1345 B8R0.4 CCCOCCOCCl Amb28246338 [0,1,0,0,0,0|2,0,0]=3 1346 B8R0.4 CCCOCOCCC Amb22230733 [0,1,0,0,0,0|1,0,0]=2 1347 B8R0.4 CCCOC\C=C\CCl Amb27628817 [0,1,0,0,0,0|1,0,2]=4 1348 B8R0.4 CCCSCCCC#N Amb6680724 [0,1,0,0,0,0|1,1,1]=4 1349 B8R0.4 CCCSCCCCCl Amb18798739 [0,1,0,0,0,0|1,1,0]=3 1350 B8R0.4 CCCSCCCCN Amb9391521 [0,1,0,0,0,0|1,1,0]=3 1351 B8R0.4 CCCSCCCCO Amb9370795 [0,1,0,0,0,0|1,0,0]=2 1352 B8R0.4 CCCSCCCCS Amb27766901 [0,1,0,0,0,0|1,1,0]=3 1353 B8R0.4 CCCSCCCOC Amb27837637 [0,1,0,0,0,0|1,1,0]=3 1354 B8R0.4 CCCSCCOCC Amb27970679 [0,1,0,0,0,0|1,1,0]=3 1355 B8R0.4 CCCSSSCCC Amb22002286 [0,1,0,0,0,0|2,1,0]=4 1356 B8R0.4 CCC\C=C/CCCC Amb26023943 [0,1,0,0,0,0|2,0,0]=3 1357 B8R0.4 CCC\C=C\C#CCO Amb27661089 [0,1,0,0,0,0|1,0,2]=4 1358 B8R0.4 CCC\C=C\C=C\CO Amb22053869 [0,1,0,0,0,0|1,0,2]=4 1359 B8R0.4 CCC\C=C\CCC#N Amb33226017 [0,1,0,0,0,0|2,0,1]=4 1360 B8R0.4 CCC\C=C\CCC=O Amb33172232 [0,1,0,0,0,0|1,0,2]=4 1361 B8R0.4 CCC\C=C\CCCBr Amb26574256 [0,1,0,0,0,0|2,0,1]=4 1362 B8R0.4 CCC\C=C\CCCC Amb2778543 [0,1,0,0,0,0|2,0,0]=3 1363 B8R0.4 CCC\C=C\CCCN Amb33327176 [0,1,0,0,0,0|2,0,1]=4 1364 B8R0.4 CCC\C=C\CCCS Amb33373717 [0,1,0,0,0,0|1,1,1]=4 1365 B8R0.4 CCC\C=C\CCNC Amb33429318 [0,1,0,0,0,0|2,0,1]=4 1366 B8R0.4 CCC\C=C\CCON Amb33424856 [0,1,0,0,0,0|1,0,1]=3 1367 B8R0.4 CCC\C=C\CCSC Amb27810331 [0,1,0,0,0,0|1,1,1]=4 1368 B8R0.4 CCC\C=N\CCCC Amb19375587 [0,1,0,0,0,0|2,0,0]=3 1369 B8R0.4 CCNCCCCC#N Amb27763344 [0,1,0,0,0,0|2,0,1]=4 1370 B8R0.4 CCNCCCCCF Amb27956469 [0,1,0,0,0,0|2,0,0]=3 1371 B8R0.4 CCNCCCCCI Amb27761837 [0,1,0,0,0,0|2,0,0]=3 1372 B8R0.4 CCNCCCCCN Amb27447573 [0,1,0,0,0,0|2,0,0]=3 1373 B8R0.4 CCNCCCCCO Amb17334130 [0,1,0,0,0,0|1,0,0]=2 1374 B8R0.4 CCNCCCCOC Amb27837458 [0,1,0,0,0,0|2,0,0]=3 1375 B8R0.4 CCNCCCCSC Amb27837487 [0,1,0,0,0,0|2,1,0]=4 1376 B8R0.4 CCNCCCNCC Amb20171936 [0,1,0,0,0,0|3,0,0]=4 1377 B8R0.4 CCNCCCSCC Amb27647486 [0,1,0,0,0,0|3,0,0]=4 1378 B8R0.4 CCNCCNCCF Amb27768816 [0,1,0,0,0,0|2,0,0]=3 1379 B8R0.4 CCNCCNCCN Amb27411449 [0,1,0,0,0,0|2,0,0]=3 1380 B8R0.4 CCNCCOCCBr Amb27208133 [0,1,0,0,0,0|1,0,0]=2 1381 B8R0.4 CCNCCOCCN Amb25305457 [0,1,0,0,0,0|1,0,0]=2 1382 B8R0.4 CCNCCOCCO Amb6736237 [0,1,0,0,0,0|0,0,0]=1 1383 B8R0.4 CCN\N=C\CCCO Amb27662112 [0,1,0,0,0,0|2,0,1]=4 1384 B8R0.4 CCOCCCCCBr Amb24502334 [0,1,0,0,0,0|2,0,0]=3 1385 B8R0.4 CCOCCCCCCl Amb9001650 [0,1,0,0,0,0|2,0,0]=3 1386 B8R0.4 CCOCCCCCS Amb27835597 [0,1,0,0,0,0|1,1,0]=3 1387 B8R0.4 CCOCCCCNC Amb28049603 [0,1,0,0,0,0|3,0,0]=4 1388 B8R0.4 CCOCCNCCBr Amb27629210 [0,1,0,0,0,0|2,0,0]=3 1389 B8R0.4 CCOCCNCCCl Amb27801916 [0,1,0,0,0,0|2,0,0]=3 1390 B8R0.4 CCOCCNCCN Amb27603963 [0,1,0,0,0,0|2,0,0]=3 1391 B8R0.4 CCOCCNCCS Amb28048707 [0,1,0,0,0,0|1,1,0]=3 1392 B8R0.4 CCOCCOCC=O Amb33539619 [0,1,0,0,0,0|0,0,2]=3 1393 B8R0.4 CCOCCOCCCl Amb8828467 [0,1,0,0,0,0|1,0,0]=2 1394 B8R0.4 CCOCCOCCN Amb30585145 [0,1,0,0,0,0|1,0,0]=2 1395 B8R0.4 CCOCCOCCN Amb6243196 [0,1,0,0,0,0|1,0,0]=2 1396 B8R0.4 CCOCCOCCO Amb8513162 [0,1,0,0,0,0|0,0,0]=1 1397 B8R0.4 CCOCCSCCF Amb28122264 [0,1,0,0,0,0|1,1,0]=3 1398 B8R0.4 CCOCCSCSC Amb27179570 [0,1,0,0,0,0|2,1,0]=4 1399 B8R0.4 CCOCC\C=C\CCl Amb27470132 [0,1,0,0,0,0|2,0,1]=4 1400 B8R0.4 CCOCSCCCN Amb28143434 [0,1,0,0,0,0|2,1,0]=4 1401 B8R0.4 CCOCSCCCO Amb27842168 [0,1,0,0,0,0|1,1,0]=3 1402 B8R0.4 CCOC\C=C\CCO Amb27972232 [0,1,0,0,0,0|1,0,1]=3 1403 B8R0.4 CCONCCCCO Amb28326276 [0,1,0,0,0,0|2,0,0]=3 1404 B8R0.4 CCSCCCCC=O Amb24690525 [0,1,0,0,0,0|1,0,2]=4 1405 B8R0.4 CCSCCCCCBr Amb25887441 [0,1,0,0,0,0|2,0,0]=3 1406 B8R0.4 CCSCCCCCCl Amb9304998 [0,1,0,0,0,0|2,0,0]=3 1407 B8R0.4 CCSCCCCCF Amb28207049 [0,1,0,0,0,0|2,0,0]=3 1408 B8R0.4 CCSCCCCCN Amb28049047 [0,1,0,0,0,0|2,0,0]=3 1409 B8R0.4 CCSCCCCNC Amb27837488 [0,1,0,0,0,0|3,0,0]=4 1410 B8R0.4 CCSCCCCOC Amb27651458 [0,1,0,0,0,0|2,0,0]=3 1411 B8R0.4 CCSCCNCCF Amb27241603 [0,1,0,0,0,0|2,0,0]=3 1412 B8R0.4 CCSCCNCCO Amb27454287 [0,1,0,0,0,0|1,0,0]=2 1413 B8R0.4 CCSCCOCC#N Amb27944934 [0,1,0,0,0,0|1,0,1]=3 1414 B8R0.4 CCSCCOCCBr Amb27856710 [0,1,0,0,0,0|1,0,0]=2 1415 B8R0.4 CCSCCOCCCl Amb27978105 [0,1,0,0,0,0|1,0,0]=2 1416 B8R0.4 CCSCCOCCN Amb17501990 [0,1,0,0,0,0|1,0,0]=2 1417 B8R0.4 CCSCCSCC#N Amb27617252 [0,1,0,0,0,0|1,1,1]=4 1418 B8R0.4 CCSCCSCCF Amb27768840 [0,1,0,0,0,0|1,1,0]=3 1419 B8R0.4 CC\C=C/CCCCC Amb25258581 [0,1,0,0,0,0|2,0,1]=4 1420 B8R0.4 CC\C=C/CCCCN Amb28313712 [0,1,0,0,0,0|2,0,1]=4 1421 B8R0.4 CC\C=C/CCCCO Amb22052636 [0,1,0,0,0,0|1,0,1]=3 1422 B8R0.4 CC\C=C\CC#CCO Amb27398594 [0,1,0,0,0,0|1,0,2]=4 1423 B8R0.4 CC\C=C\CCCCC Amb22347893 [0,1,0,0,0,0|2,0,1]=4 1424 B8R0.4 CC\C=C\CCCCN Amb33079175 [0,1,0,0,0,0|2,0,1]=4 1425 B8R0.4 CC\C=C\CCNCC Amb27647277 [0,1,0,0,0,0|2,0,1]=4 1426 B8R0.4 CC\C=C\CCSCC Amb27260956 [0,1,0,0,0,0|2,0,1]=4 1427 B8R0.4 CNCCC#CCCN Amb27398662 [0,1,0,0,0,0|2,0,1]=4 1428 B8R0.4 CNCCCCCC#N Amb27489366 [0,1,0,0,0,0|2,0,1]=4 1429 B8R0.4 CNCCCCCCF Amb28137350 [0,1,0,0,0,0|2,0,0]=3 1430 B8R0.4 CNCCCCCCN Amb22641938 [0,1,0,0,0,0|2,0,0]=3 1431 B8R0.4 CNCCCCCCN Amb32667312 [0,1,0,0,0,0|2,0,0]=3 1432 B8R0.4 CNCCCCCCO Amb2721293 [0,1,0,0,0,0|1,0,0]=2 1433 B8R0.4 CNCCCCCOC Amb17569940 [0,1,0,0,0,0|2,0,0]=3 1434 B8R0.4 CNCCCNCCF Amb27465811 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.4 CNCCCNCCS Amb25146120 [0,1,0,0,0,0|1,1,0]=3 1436 B8R0.4 CNCCCOCCO Amb27855882 [0,1,0,0,0,0|0,0,0]=1 1437 B8R0.4 CNCCNCCC#N Amb28313763 [0,1,0,0,0,0|3,0,0]=4 1438 B8R0.4 CNCCNCCCF Amb27768818 [0,1,0,0,0,0|3,0,0]=4 1439 B8R0.4 CNCCNCCNC Amb8480392 [0,1,0,0,0,0|3,0,0]=4 1440 B8R0.4 CNCCNCCSC Amb27639961 [0,1,0,0,0,0|2,1,0]=4 1441 B8R0.4 CNCCOCCC#N Amb27226784 [0,1,0,0,0,0|2,0,0]=3 1442 B8R0.4 CNCCOCCCF Amb27393733 [0,1,0,0,0,0|2,0,0]=3 1443 B8R0.4 CNCCOCCNC Amb2583286 [0,1,0,0,0,0|2,0,0]=3 1444 B8R0.4 CNCCOCCOC Amb25691167 [0,1,0,0,0,0|1,0,0]=2 1445 B8R0.4 CNCCSCCCN Amb27768770 [0,1,0,0,0,0|2,1,0]=4 1446 B8R0.4 CNCCSCCSC Amb27669026 [0,1,0,0,0,0|1,2,0]=4 1447 B8R0.4 COCC#CCCCBr Amb27613532 [0,1,0,0,0,0|2,0,1]=4 1448 B8R0.4 COCCCCCC=O Amb27467958 [0,1,0,0,0,0|1,0,2]=4 1449 B8R0.4 COCCCCCCBr Amb26928164 [0,1,0,0,0,0|2,0,0]=3 1450 B8R0.4 COCCCCCCCl Amb18180174 [0,1,0,0,0,0|2,0,0]=3 1451 B8R0.4 COCCCCCCN Amb27799019 [0,1,0,0,0,0|2,0,0]=3 1452 B8R0.4 COCCCCCCO Amb28189816 [0,1,0,0,0,0|1,0,0]=2 1453 B8R0.4 COCCCCCOC Amb22348093 [0,1,0,0,0,0|2,0,0]=3 1454 B8R0.4 COCCCCNOC Amb27593039 [0,1,0,0,0,0|3,0,0]=4 1455 B8R0.4 COCCCNCCCl Amb17334317 [0,1,0,0,0,0|2,0,0]=3 1456 B8R0.4 COCCCNCCN Amb17091021 [0,1,0,0,0,0|2,0,0]=3 1457 B8R0.4 COCCCNCCO Amb9213213 [0,1,0,0,0,0|1,0,0]=2 1458 B8R0.4 COCCCOCC#N Amb27837408 [0,1,0,0,0,0|1,0,1]=3 1459 B8R0.4 COCCCOCCCl Amb18177244 [0,1,0,0,0,0|1,0,0]=2 1460 B8R0.4 COCCCOCCI Amb27253165 [0,1,0,0,0,0|1,0,0]=2 1461 B8R0.4 COCCCOCCN Amb27751129 [0,1,0,0,0,0|1,0,0]=2 1462 B8R0.4 COCCCOCCO Amb26344833 [0,1,0,0,0,0|0,0,0]=1 1463 B8R0.4 COCCCSCCBr Amb28049052 [0,1,0,0,0,0|1,1,0]=3 1464 B8R0.4 COCCCSCCCl Amb28411442 [0,1,0,0,0,0|1,1,0]=3 1465 B8R0.4 COCCCSCCS Amb27980898 [0,1,0,0,0,0|0,2,0]=3 1466 B8R0.4 COCCNCCC#N Amb8827847 [0,1,0,0,0,0|2,0,1]=4 1467 B8R0.4 COCCNCCCN Amb17315289 [0,1,0,0,0,0|2,0,0]=3 1468 B8R0.4 COCCNCCCO Amb9246587 [0,1,0,0,0,0|2,0,0]=3 1469 B8R0.4 COCCNCCOC Amb6608693 [0,1,0,0,0,0|2,0,0]=3 1470 B8R0.4 COCCNCCSC Amb27979037 [0,1,0,0,0,0|2,0,0]=3 1471 B8R0.4 COCCOCCC#N Amb6280034 [0,1,0,0,0,0|1,0,1]=3 1472 B8R0.4 COCCOCCC=O Amb26078964 [0,1,0,0,0,0|1,0,1]=3 1473 B8R0.4 COCCOCCCBr Amb9204139 [0,1,0,0,0,0|1,0,0]=2 1474 B8R0.4 COCCOCCCCl Amb6256006 [0,1,0,0,0,0|1,0,0]=2 1475 B8R0.4 COCCOCCCN Amb1154665 [0,1,0,0,0,0|1,0,0]=2 1476 B8R0.4 COCCOCCCO Amb26608683 [0,1,0,0,0,0|1,0,0]=2 1477 B8R0.4 COCCOCCCS Amb27981281 [0,1,0,0,0,0|1,0,0]=2 1478 B8R0.4 COCCOCCOC Amb6608783 [0,1,0,0,0,0|1,0,0]=2 1479 B8R0.4 COCCOCCON Amb25369730 [0,1,0,0,0,0|1,0,0]=2 1480 B8R0.4 COCCOCN=[N+]=[N-] Amb27479718 [0,1,0,0,0,0|3,0,0]=4 1481 B8R0.4 COCCOCOCCl Amb25844560 [0,1,0,0,0,0|2,0,0]=3 1482 B8R0.4 COCCONCCF Amb27470436 [0,1,0,0,0,0|2,0,0]=3 1483 B8R0.4 COCCONCCO Amb27257086 [0,1,0,0,0,0|1,0,0]=2 1484 B8R0.4 COCCSCCC=O Amb27837422 [0,1,0,0,0,0|1,1,1]=4 1485 B8R0.4 COCCSCCCBr Amb9304977 [0,1,0,0,0,0|1,1,0]=3 1486 B8R0.4 COCCSCCCF Amb28293660 [0,1,0,0,0,0|1,1,0]=3 1487 B8R0.4 COCCSCCCS Amb27838576 [0,1,0,0,0,0|1,1,0]=3 1488 B8R0.4 COCCSCCON Amb28062817 [0,1,0,0,0,0|1,1,0]=3 1489 B8R0.4 COCOCCCC=O Amb27234488 [0,1,0,0,0,0|2,0,1]=4 1490 B8R0.4 COCOCCCCCl Amb22641569 [0,1,0,0,0,0|2,0,0]=3 1491 B8R0.4 COCOCOCOC Amb22728072 [0,1,0,0,0,0|3,0,0]=4 1492 B8R0.4 CONCCCCSC Amb27593538 [0,1,0,0,0,0|3,0,0]=4 1493 B8R0.4 CO\C=C\CCCCO Amb27448464 [0,1,0,0,0,0|1,0,2]=4 1494 B8R0.4 CO\N=C\CCCCO Amb28049141 [0,1,0,0,0,0|2,0,1]=4 1495 B8R0.4 CSCCCCCC#N Amb26626575 [0,1,0,0,0,0|2,0,1]=4 1496 B8R0.4 CSCCCCCC=O Amb27981887 [0,1,0,0,0,0|1,0,2]=4 1497 B8R0.4 CSCCCCCCN Amb24532830 [0,1,0,0,0,0|2,0,0]=3 1498 B8R0.4 CSCCCCCCO Amb22367888 [0,1,0,0,0,0|1,0,0]=2 1499 B8R0.4 CSCCCCCCS Amb27801758 [0,1,0,0,0,0|1,1,0]=3 1500 B8R0.4 CSCCCCCSC Amb4020033 [0,1,0,0,0,0|2,1,0]=4 1501 B8R0.4 CSCCCNCCBr Amb27217836 [0,1,0,0,0,0|2,0,0]=3 1502 B8R0.4 CSCCCNCCCl Amb27869237 [0,1,0,0,0,0|2,0,0]=3 1503 B8R0.4 CSCCCOCC=O Amb28286017 [0,1,0,0,0,0|0,0,2]=3 1504 B8R0.4 CSCCCOCCS Amb27257161 [0,1,0,0,0,0|0,1,0]=2 1505 B8R0.4 CSCCCSCCBr Amb28326052 [0,1,0,0,0,0|1,1,0]=3 1506 B8R0.4 CSCCCSCCS Amb27666422 [0,1,0,0,0,0|0,2,0]=3 1507 B8R0.4 CSCCNCCC#N Amb27235470 [0,1,0,0,0,0|3,0,0]=4 1508 B8R0.4 CSCCNCCCBr Amb28137679 [0,1,0,0,0,0|2,1,0]=4 1509 B8R0.4 CSCCNCCCCl Amb27599936 [0,1,0,0,0,0|2,1,0]=4 1510 B8R0.4 CSCCNCCCF Amb28136726 [0,1,0,0,0,0|2,1,0]=4 1511 B8R0.4 CSCCOCCC#N Amb28044446 [0,1,0,0,0,0|2,0,0]=3 1512 B8R0.4 CSCCOCCC=O Amb27823932 [0,1,0,0,0,0|1,0,1]=3 1513 B8R0.4 CSCCOCCCN Amb27146302 [0,1,0,0,0,0|1,1,0]=3 1514 B8R0.4 CSCCOCCSC Amb27170781 [0,1,0,0,0,0|1,1,0]=3 1515 B8R0.4 CSCCSCCC=O Amb27956184 [0,1,0,0,0,0|1,1,1]=4 1516 B8R0.4 CSCOC\C=C\CO Amb27452450 [0,1,0,0,0,0|2,0,1]=4 1517 B8R0.4 CSSCCNCCF Amb27975905 [0,1,0,0,0,0|3,0,0]=4 1518 B8R0.4 C\C=C/CCCCCC Amb27478896 [0,1,0,0,0,0|2,0,1]=4 1519 B8R0.4 C\C=C\CCCCCC Amb19930200 [0,1,0,0,0,0|2,0,1]=4 1520 B8R0.4 C\C=C\CCCCCO Amb25247777 [0,1,0,0,0,0|1,0,1]=3 1521 B8R0.4 C\C=C\CCCCNO Amb27849039 [0,1,0,0,0,0|1,0,2]=4 1522 B8R0.4 C\C=C\COCCC#N Amb27779498 [0,1,0,0,0,0|1,0,2]=4 1523 B8R0.4 C\C=C\COCCCBr Amb27949261 [0,1,0,0,0,0|1,0,2]=4 1524 B8R0.4 C\C=C\COCCNC Amb27852522 [0,1,0,0,0,0|1,0,2]=4 1525 B8R0.4 C\C=C\CSCCOC Amb27766159 [0,1,0,0,0,0|0,1,2]=4 1526 B8R0.4 C\C=C\C\C=C\CCO Amb27978414 [0,1,0,0,0,0|1,0,2]=4 1527 B8R0.4 C\C=C\OCCCCO Amb27486247 [0,1,0,0,0,0|1,0,2]=4 1528 B8R0.4 ClCC#CCCCCCl Amb28422510 [0,1,0,0,0,0|2,0,1]=4 1529 B8R0.4 ClCCCCCCCBr Amb24323576 [0,1,0,0,0,0|2,0,0]=3 1530 B8R0.4 ClCCCCCCCCl Amb22232563 [0,1,0,0,0,0|2,0,0]=3 1531 B8R0.4 ClCCCCCC[Zn]Br Amb22000406 [0,1,0,0,0,0|3,0,0]=4 1532 B8R0.4 ClCCCNCCCCl Amb25147083 [0,1,0,0,0,0|3,0,0]=4 1533 B8R0.4 ClCCCOCCCCl Amb2700587 [0,1,0,0,0,0|2,0,0]=3 1534 B8R0.4 ClCCCSCCCCl Amb27808763 [0,1,0,0,0,0|2,1,0]=4 1535 B8R0.4 FCCCCNCCBr Amb28457765 [0,1,0,0,0,0|2,0,0]=3 1536 B8R0.4 FCCCCNCCCl Amb27255714 [0,1,0,0,0,0|2,0,0]=3 1537 B8R0.4 FCCCCNCCF Amb27799430 [0,1,0,0,0,0|2,0,0]=3 1538 B8R0.4 FCCCNCCCBr Amb27843825 [0,1,0,0,0,0|3,0,0]=4 1539 B8R0.4 FCCCNCCCCl Amb27838497 [0,1,0,0,0,0|3,0,0]=4 1540 B8R0.4 FCCCSCCCCl Amb27243197 [0,1,0,0,0,0|2,1,0]=4 1541 B8R0.4 FCCCSCCCF Amb27977388 [0,1,0,0,0,0|2,1,0]=4 1542 B8R0.4 N#CCCCC#CCO Amb27980037 [0,1,0,0,0,0|1,0,2]=4 1543 B8R0.4 N#CCCCCCCBr Amb8515196 [0,1,0,0,0,0|2,0,1]=4 1544 B8R0.4 N#CCCCCCCCl Amb22045160 [0,1,0,0,0,0|2,0,1]=4 1545 B8R0.4 N#CCCCCCON Amb27431737 [0,1,0,0,0,0|2,0,1]=4 1546 B8R0.4 N#CCCCNCCF Amb28045226 [0,1,0,0,0,0|2,0,1]=4 1547 B8R0.4 N#CCCCNCCN Amb27837506 [0,1,0,0,0,0|2,0,1]=4 1548 B8R0.4 N#CCCCNCCO Amb9247394 [0,1,0,0,0,0|1,0,1]=3 1549 B8R0.4 N#CCCCOCCN Amb27475883 [0,1,0,0,0,0|1,0,1]=3 1550 B8R0.4 N#CCCNCCCN Amb27396494 [0,1,0,0,0,0|3,0,0]=4 1551 B8R0.4 N#CCCNCCCO Amb9243306 [0,1,0,0,0,0|2,0,1]=4 1552 B8R0.4 N#CCCOCCC#N Amb2720803 [0,1,0,0,0,0|2,0,1]=4 1553 B8R0.4 N#CCCSCCCO Amb17502405 [0,1,0,0,0,0|1,1,1]=4 1554 B8R0.4 N#CCSCCCCN Amb17500946 [0,1,0,0,0,0|1,1,1]=4 1555 B8R0.4 N#CSCCOCCCl Amb28252617 [0,1,0,0,0,0|2,0,1]=4 1556 B8R0.4 N#CSCCOCCO Amb27766481 [0,1,0,0,0,0|1,0,1]=3 1557 B8R0.4 NCCCCCCCBr Amb27817795 [0,1,0,0,0,0|2,0,0]=3 1558 B8R0.4 NCCCCCCCBr Amb33321489 [0,1,0,0,0,0|2,0,0]=3 1559 B8R0.4 NCCCCCCCF Amb25918508 [0,1,0,0,0,0|2,0,0]=3 1560 B8R0.4 NCCCCCCCN Amb3370862 [0,1,0,0,0,0|2,0,0]=3 1561 B8R0.4 NCCCCCCCO Amb24120448 [0,1,0,0,0,0|1,0,0]=2 1562 B8R0.4 NCCCCCCCO Amb33544521 [0,1,0,0,0,0|1,0,0]=2 1563 B8R0.4 NCCCCCCCS Amb25147209 [0,1,0,0,0,0|1,1,0]=3 1564 B8R0.4 NCCCCNCCBr Amb27865413 [0,1,0,0,0,0|2,0,0]=3 1565 B8R0.4 NCCCCNCCN Amb24117220 [0,1,0,0,0,0|2,0,0]=3 1566 B8R0.4 NCCCCNCCN Amb25378773 [0,1,0,0,0,0|2,0,0]=3 1567 B8R0.4 NCCCCNCCO Amb8394908 [0,1,0,0,0,0|1,0,0]=2 1568 B8R0.4 NCCCCOCCO Amb6681146 [0,1,0,0,0,0|0,0,0]=1 1569 B8R0.4 NCCCCSCCN Amb27872081 [0,1,0,0,0,0|1,1,0]=3 1570 B8R0.4 NCCCCSCCO Amb17500958 [0,1,0,0,0,0|0,1,0]=2 1571 B8R0.4 NCCCC\C=C\CO Amb24117507 [0,1,0,0,0,0|1,0,1]=3 1572 B8R0.4 NCCCC\C=C\CO Amb27780423 [0,1,0,0,0,0|1,0,1]=3 1573 B8R0.4 NCCCNCCCN Amb8513191 [0,1,0,0,0,0|3,0,0]=4 1574 B8R0.4 NCCCNCCCO Amb19959935 [0,1,0,0,0,0|2,0,0]=3 1575 B8R0.4 NCCCOCCCF Amb27391202 [0,1,0,0,0,0|2,0,0]=3 1576 B8R0.4 NCCCOCCCN Amb17593392 [0,1,0,0,0,0|2,0,0]=3 1577 B8R0.4 NCCCOCCCO Amb35788244 [0,1,0,0,0,0|1,0,0]=2 1578 B8R0.4 NCCCOCCCO Amb9392882 [0,1,0,0,0,0|1,0,0]=2 1579 B8R0.4 NCCCSCCCO Amb17500713 [0,1,0,0,0,0|1,1,0]=3 1580 B8R0.4 NCCCSCCON Amb28319278 [0,1,0,0,0,0|1,1,0]=3 1581 B8R0.4 NCCOCCOCN Amb27460097 [0,1,0,0,0,0|2,0,0]=3 1582 B8R0.4 NCCOCOCCN Amb28254456 [0,1,0,0,0,0|2,0,0]=3 1583 B8R0.4 NCCSCCCCF Amb27830248 [0,1,0,0,0,0|1,1,0]=3 1584 B8R0.4 NCCSCCCCS Amb27878524 [0,1,0,0,0,0|1,1,0]=3 1585 B8R0.4 NCCSCSCCN Amb25100916 [0,1,0,0,0,0|2,1,0]=4 1586 B8R0.4 NCC\C=C/CCCN Amb28056104 [0,1,0,0,0,0|2,0,1]=4 1587 B8R0.4 NCC\C=N\CCCN Amb28041352 [0,1,0,0,0,0|3,0,0]=4 1588 B8R0.4 NC\C=C\CSCCO Amb27185672 [0,1,0,0,0,0|0,1,2]=4 1589 B8R0.4 NOCCCSCCO Amb27420973 [0,1,0,0,0,0|1,1,0]=3 1590 B8R0.4 NOCCOCCON Amb25118127 [0,1,0,0,0,0|2,0,0]=3 1591 B8R0.4 O=CCCC#CCCO Amb27164553 [0,1,0,0,0,0|1,0,2]=4 1592 B8R0.4 O=CCCCCCCBr Amb22755463 [0,1,0,0,0,0|1,0,2]=4 1593 B8R0.4 O=CCCCCCCCl Amb27262031 [0,1,0,0,0,0|1,0,2]=4 1594 B8R0.4 O=CCCC\C=C\CO Amb27169480 [0,1,0,0,0,0|1,0,2]=4 1595 B8R0.4 O=CCCOCCCO Amb28428559 [0,1,0,0,0,0|1,0,1]=3 1596 B8R0.4 O=CNCCOCCO Amb4034567 [0,1,0,0,0,0|1,0,1]=3 1597 B8R0.4 O=COCCOCCO Amb28049268 [0,1,0,0,0,0|1,0,1]=3 1598 B8R0.4 O=NOCCOCCCl Amb27185721 [0,1,0,0,0,0|3,0,0]=4 1599 B8R0.4 OCC#CCOCCCl Amb27470782 [0,1,0,0,0,0|1,0,2]=4 1600 B8R0.4 OCCCCCCCBr Amb9787726 [0,1,0,0,0,0|1,0,0]=2 1601 B8R0.4 OCCCCCCCF Amb25381297 [0,1,0,0,0,0|1,0,0]=2 1602 B8R0.4 OCCCCCCCI Amb32411247 [0,1,0,0,0,0|1,0,0]=2 1603 B8R0.4 OCCCCCCCO Amb8513178 [0,1,0,0,0,0|1,0,0]=2 1604 B8R0.4 OCCCCNCCO Amb28049076 [0,1,0,0,0,0|1,0,0]=2 1605 B8R0.4 OCCCCOCCO Amb25185198 [0,1,0,0,0,0|0,0,0]=1 1606 B8R0.4 OCCCNCCCO Amb28984089 [0,1,0,0,0,0|2,0,0]=3 1607 B8R0.4 OCCCNCCCO Amb8393926 [0,1,0,0,0,0|2,0,0]=3 1608 B8R0.4 OCCCOCCCCl Amb28058754 [0,1,0,0,0,0|1,0,0]=2 1609 B8R0.4 OCCCOCCCO Amb24626114 [0,1,0,0,0,0|1,0,0]=2 1610 B8R0.4 OCCC\C=C\CCI Amb22364705 [0,1,0,0,0,0|1,0,2]=4 1611 B8R0.4 OCCNCNCCO Amb10790096 [0,1,0,0,0,0|2,0,0]=3 1612 B8R0.4 OCCOCCOCO Amb27651930 [0,1,0,0,0,0|1,0,0]=2 1613 B8R0.4 OCCOCOCCO Amb25923012 [0,1,0,0,0,0|1,0,0]=2 1614 B8R0.4 OC\C=C\CCCCO Amb27642149 [0,1,0,0,0,0|1,0,1]=3 1615 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [0,1,0,0,0,0|2,0,0]=3 1616 B8R0.4 [C-]#[N+]CC\C=C\CCC Amb33424871 [0,1,0,0,0,0|2,0,1]=4 1617 B8R0.4 [N-]=[N+]=NCCCCCO Amb33529811 [0,1,0,0,0,0|3,0,0]=4 1618 B8R0.4 [N-]=[N+]=NCCOCCBr Amb27596358 [0,1,0,0,0,0|3,0,0]=4 1619 B8R0.4 [N-]=[N+]=NCCOCCN Amb21982547 [0,1,0,0,0,0|3,0,0]=4 1620 B8R0.4 [N-]=[N+]=NCCOCCN Amb33330106 [0,1,0,0,0,0|3,0,0]=4 1621 B8R0.4 [N-]=[N+]=NCCOCCO Amb33538403 [0,1,0,0,0,0|2,0,0]=3 1622 B8R0.4 [N-]=[N+]=NCCSCCO Amb27239290 [0,1,0,0,0,0|2,1,0]=4 1623 B8R0.6 C#CC(=O)OCCCC Amb25839203 [0,1,0,0,0,0|1,0,2]=4 1624 B8R0.6 C#CC(C)COCCO Amb27956606 [0,1,0,0,0,0|0,0,2]=3 1625 B8R0.6 C#CC(C)NCCCC Amb25918608 [0,1,0,0,0,0|2,0,1]=4 1626 B8R0.6 C#CC(O)CCCCC Amb2721717 [0,1,0,0,0,0|2,0,1]=4 1627 B8R0.6 C#CC(O)OCCCC Amb27432239 [0,1,0,0,0,0|1,0,1]=3 1628 B8R0.6 C#CCCCC(Br)CC Amb27601282 [0,1,0,0,0,0|2,0,1]=4 1629 B8R0.6 C#CCCCC(C)CO Amb27399800 [0,1,0,0,0,0|1,0,2]=4 1630 B8R0.6 C#CCCCC(N)CO Amb28061736 [0,1,0,0,0,0|1,0,2]=4 1631 B8R0.6 C#CCCC[C@@H](N)CO Amb32620213 [0,1,0,0,0,0|1,0,2]=4 1632 B8R0.6 C#CCCC[C@H](N)CO Amb32620183 [0,1,0,0,0,0|1,0,2]=4 1633 B8R0.6 C#CCCOC(=O)CO Amb27632704 [0,1,0,0,0,0|0,0,3]=4 1634 B8R0.6 C#CCCOC(Cl)CC Amb28239817 [0,1,0,0,0,0|1,0,2]=4 1635 B8R0.6 C#CCOCC(O)CCl Amb26872783 [0,1,0,0,0,0|2,0,1]=4 1636 B8R0.6 C#CCOCC(O)CN Amb27961490 [0,1,0,0,0,0|2,0,1]=4 1637 B8R0.6 C#CCOCC(O)CO Amb16232583 [0,1,0,0,0,0|2,0,1]=4 1638 B8R0.6 C#CCSCC(C)CC Amb27662850 [0,1,0,0,0,0|1,1,1]=4 1639 B8R0.6 C#CCSCC(F)CC Amb27768839 [0,1,0,0,0,0|1,1,1]=4 1640 B8R0.6 C#C[C@@H](O)CCCCC Amb8516365 [0,1,0,0,0,0|2,0,1]=4 1641 B8R0.6 C#C[C@H](C)CCCCO Amb27766839 [0,1,0,0,0,0|1,0,2]=4 1642 B8R0.6 C#C[C@H](O)CCCCC Amb8516404 [0,1,0,0,0,0|2,0,1]=4 1643 B8R0.6 C=C(CBr)CCCCC Amb27875113 [0,1,0,0,0,0|2,0,1]=4 1644 B8R0.6 C=C(CC)CCCCCl Amb27430621 [0,1,0,0,0,0|2,0,1]=4 1645 B8R0.6 C=C(CC)CCCCO Amb25057130 [0,1,0,0,0,0|1,0,1]=3 1646 B8R0.6 C=C(CC)CNCCC Amb27456809 [0,1,0,0,0,0|2,0,1]=4 1647 B8R0.6 C=C(CC)CNCCF Amb27979485 [0,1,0,0,0,0|2,0,1]=4 1648 B8R0.6 C=C(CC)CSCCN Amb27174810 [0,1,0,0,0,0|1,1,1]=4 1649 B8R0.6 C=C(CC)NCCCC Amb27230099 [0,1,0,0,0,0|2,0,1]=4 1650 B8R0.6 C=C(CCl)COCCC Amb27629932 [0,1,0,0,0,0|2,0,1]=4 1651 B8R0.6 C=C(CCl)OCOCC Amb28045981 [0,1,0,0,0,0|2,0,1]=4 1652 B8R0.6 C=C(CO)CCCCO Amb27405284 [0,1,0,0,0,0|2,0,1]=4 1653 B8R0.6 C=C(CO)CSCCO Amb27959258 [0,1,0,0,0,0|1,1,1]=4 1654 B8R0.6 C=CC(=O)OCCCC Amb3940493 [0,1,0,0,0,0|1,0,2]=4 1655 B8R0.6 C=CC(=O)OCCCC Amb3940920 [0,1,0,0,0,0|1,0,2]=4 1656 B8R0.6 C=CC(C)CCCCC Amb27963700 [0,1,0,0,0,0|2,0,1]=4 1657 B8R0.6 C=CC(C)OCCCC Amb27420990 [0,1,0,0,0,0|1,0,1]=3 1658 B8R0.6 C=CC(C)SCCCC Amb28190115 [0,1,0,0,0,0|1,1,1]=4 1659 B8R0.6 C=CC(O)CCCCC Amb3940384 [0,1,0,0,0,0|2,0,1]=4 1660 B8R0.6 C=CC(O)CCCCO Amb28193458 [0,1,0,0,0,0|1,0,2]=4 1661 B8R0.6 C=CC(O)CNCCO Amb27410210 [0,1,0,0,0,0|1,0,2]=4 1662 B8R0.6 C=CCCCC(N)CC Amb27806538 [0,1,0,0,0,0|2,0,1]=4 1663 B8R0.6 C=CCCCC(N)CO Amb25147202 [0,1,0,0,0,0|1,0,2]=4 1664 B8R0.6 C=CCCCC(O)CC Amb27470890 [0,1,0,0,0,0|2,0,1]=4 1665 B8R0.6 C=CCCCC(O)CO Amb28049202 [0,1,0,0,0,0|1,0,2]=4 1666 B8R0.6 C=CCCC[C@H](O)CC Amb27857959 [0,1,0,0,0,0|2,0,1]=4 1667 B8R0.6 C=CCCC[C@H](O)CO Amb27594001 [0,1,0,0,0,0|1,0,2]=4 1668 B8R0.6 C=CCCOC(=O)CO Amb27487083 [0,1,0,0,0,0|0,0,3]=4 1669 B8R0.6 C=CCNC[C@H](O)CC Amb27979109 [0,1,0,0,0,0|2,0,1]=4 1670 B8R0.6 C=CCOCC(=O)CC Amb27181141 [0,1,0,0,0,0|1,0,2]=4 1671 B8R0.6 C=CCOCC(C)CBr Amb25918823 [0,1,0,0,0,0|2,0,1]=4 1672 B8R0.6 C=CCOCC(C)CCl Amb25887426 [0,1,0,0,0,0|2,0,1]=4 1673 B8R0.6 C=CCOCC(C)CN Amb27668488 [0,1,0,0,0,0|2,0,1]=4 1674 B8R0.6 C=CCOCC(N)CO Amb27597791 [0,1,0,0,0,0|2,0,1]=4 1675 B8R0.6 C=CCOCC(O)CBr Amb28076631 [0,1,0,0,0,0|2,0,1]=4 1676 B8R0.6 C=CCOCC(O)CCl Amb4017847 [0,1,0,0,0,0|2,0,1]=4 1677 B8R0.6 C=CCOCC(O)CN Amb5248323 [0,1,0,0,0,0|2,0,1]=4 1678 B8R0.6 C=CCOCC(O)CS Amb27485236 [0,1,0,0,0,0|2,0,1]=4 1679 B8R0.6 C=CCOC[C@@H](O)CO Amb27478722 [0,1,0,0,0,0|2,0,1]=4 1680 B8R0.6 C=CCOC[C@H](C)CO Amb27598546 [0,1,0,0,0,0|2,0,1]=4 1681 B8R0.6 C=CCOC[C@H](O)CC Amb27429584 [0,1,0,0,0,0|1,0,1]=3 1682 B8R0.6 C=CCOC[C@H](O)CO Amb26498763 [0,1,0,0,0,0|2,0,1]=4 1683 B8R0.6 C=CCSCC(C)CC Amb27760930 [0,1,0,0,0,0|1,1,1]=4 1684 B8R0.6 C=CCSCC(F)CC Amb28124203 [0,1,0,0,0,0|1,1,1]=4 1685 B8R0.6 C=CCSCC(O)CC Amb27805379 [0,1,0,0,0,0|1,1,1]=4 1686 B8R0.6 C=C[C@@H](O)CCCCC Amb8513277 [0,1,0,0,0,0|2,0,1]=4 1687 B8R0.6 C=C[C@H](Cl)CCCCC Amb27863541 [0,1,0,0,0,0|2,0,1]=4 1688 B8R0.6 C=C[C@H](O)CCCCC Amb8515093 [0,1,0,0,0,0|2,0,1]=4 1689 B8R0.6 CC(C#N)CNCCO Amb9243304 [0,1,0,0,0,0|2,0,1]=4 1690 B8R0.6 CC(C#N)OCCCN Amb19020793 [0,1,0,0,0,0|2,0,1]=4 1691 B8R0.6 CC(C=O)COCCO Amb28313015 [0,1,0,0,0,0|1,0,1]=3 1692 B8R0.6 CC(CCCCN)NO Amb27956523 [0,1,0,0,0,0|3,0,0]=4 1693 B8R0.6 CC(CCl)CNCCF Amb27492785 [0,1,0,0,0,0|3,0,0]=4 1694 B8R0.6 CC(CN)CNCCF Amb27811732 [0,1,0,0,0,0|3,0,0]=4 1695 B8R0.6 CC(CN)CNCCO Amb27985692 [0,1,0,0,0,0|2,0,0]=3 1696 B8R0.6 CC(CN)OCCCO Amb26646401 [0,1,0,0,0,0|2,0,0]=3 1697 B8R0.6 CC(CN)SCCCF Amb27851238 [0,1,0,0,0,0|2,1,0]=4 1698 B8R0.6 CC(CO)CCCCO Amb27751851 [0,1,0,0,0,0|2,0,0]=3 1699 B8R0.6 CC(CO)COCCO Amb35752401 [0,1,0,0,0,0|1,0,0]=2 1700 B8R0.6 CC(CO)CSCCF Amb27861873 [0,1,0,0,0,0|2,1,0]=4 1701 B8R0.6 CC(CO)NCCCN Amb28367225 [0,1,0,0,0,0|2,0,0]=3 1702 B8R0.6 CC(CO)NCCCO Amb27245497 [0,1,0,0,0,0|2,0,0]=3 1703 B8R0.6 CC(CO)OCCCO Amb28049139 [0,1,0,0,0,0|1,0,0]=2 1704 B8R0.6 CC(CO)SCCC#N Amb28140198 [0,1,0,0,0,0|1,1,1]=4 1705 B8R0.6 CC(CO)SCCCN Amb27755869 [0,1,0,0,0,0|1,1,0]=3 1706 B8R0.6 CC(CO)SCCON Amb27421065 [0,1,0,0,0,0|2,1,0]=4 1707 B8R0.6 CCC#CCC(N)CO Amb28058292 [0,1,0,0,0,0|1,0,2]=4 1708 B8R0.6 CCC(=O)CCCCO Amb27867195 [0,1,0,0,0,0|1,0,1]=3 1709 B8R0.6 CCC(=O)CSCCCl Amb28399270 [0,1,0,0,0,0|1,1,1]=4 1710 B8R0.6 CCC(=O)CSCCO Amb4165967 [0,1,0,0,0,0|0,1,1]=3 1711 B8R0.6 CCC(=O)NCCCO Amb5797471 [0,1,0,0,0,0|2,0,1]=4 1712 B8R0.6 CCC(=O)NOCCO Amb27946298 [0,1,0,0,0,0|1,0,1]=3 1713 B8R0.6 CCC(=O)OCCCBr Amb27262082 [0,1,0,0,0,0|2,0,1]=4 1714 B8R0.6 CCC(=O)OCCCO Amb28138647 [0,1,0,0,0,0|2,0,1]=4 1715 B8R0.6 CCC(=O)OCCOC Amb27977811 [0,1,0,0,0,0|2,0,1]=4 1716 B8R0.6 CCC(C)=C=CCCO Amb27978471 [0,1,0,0,0,0|1,0,2]=4 1717 B8R0.6 CCC(C)CCCC#N Amb27480159 [0,1,0,0,0,0|2,0,1]=4 1718 B8R0.6 CCC(C)CCCC=O Amb18642680 [0,1,0,0,0,0|1,0,2]=4 1719 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|2,0,0]=3 1720 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|1,0,0]=2 1721 B8R0.6 CCC(C)CNCCO Amb3940071 [0,1,0,0,0,0|1,0,0]=2 1722 B8R0.6 CCC(C)COCCO Amb27198059 [0,1,0,0,0,0|0,0,0]=1 1723 B8R0.6 CCC(C)CSCCBr Amb27493953 [0,1,0,0,0,0|1,1,0]=3 1724 B8R0.6 CCC(C)CSCCF Amb27218787 [0,1,0,0,0,0|1,1,0]=3 1725 B8R0.6 CCC(C)CSCCN Amb27983415 [0,1,0,0,0,0|1,1,0]=3 1726 B8R0.6 CCC(C)CSCCS Amb27471047 [0,1,0,0,0,0|0,2,0]=3 1727 B8R0.6 CCC(C)CSCOC Amb27977816 [0,1,0,0,0,0|2,1,0]=4 1728 B8R0.6 CCC(C)C\C=C\CBr Amb27607864 [0,1,0,0,0,0|2,0,1]=4 1729 B8R0.6 CCC(C)NCCCBr Amb27838582 [0,1,0,0,0,0|3,0,0]=4 1730 B8R0.6 CCC(C)NCCCF Amb27838485 [0,1,0,0,0,0|3,0,0]=4 1731 B8R0.6 CCC(C)NCCCN Amb17315265 [0,1,0,0,0,0|3,0,0]=4 1732 B8R0.6 CCC(C)NCCCO Amb6733732 [0,1,0,0,0,0|2,0,0]=3 1733 B8R0.6 CCC(C)NCCOC Amb6685733 [0,1,0,0,0,0|3,0,0]=4 1734 B8R0.6 CCC(C)OCCC=O Amb27866656 [0,1,0,0,0,0|2,0,1]=4 1735 B8R0.6 CCC(C)OCCCBr Amb18321256 [0,1,0,0,0,0|2,0,0]=3 1736 B8R0.6 CCC(C)OCCCCl Amb18176654 [0,1,0,0,0,0|2,0,0]=3 1737 B8R0.6 CCC(C)OCCCN Amb20076070 [0,1,0,0,0,0|2,0,0]=3 1738 B8R0.6 CCC(C)SCCCO Amb9273773 [0,1,0,0,0,0|2,0,0]=3 1739 B8R0.6 CCC(C)SCCOC Amb27962134 [0,1,0,0,0,0|2,1,0]=4 1740 B8R0.6 CCC(C)S\C=C\CO Amb28074680 [0,1,0,0,0,0|2,0,1]=4 1741 B8R0.6 CCC(Cl)CCCOC Amb18180141 [0,1,0,0,0,0|3,0,0]=4 1742 B8R0.6 CCC(F)CSCCO Amb27757051 [0,1,0,0,0,0|0,1,0]=2 1743 B8R0.6 CCC(N)CCCNC Amb27231954 [0,1,0,0,0,0|3,0,0]=4 1744 B8R0.6 CCC(N)CNCCO Amb33230048 [0,1,0,0,0,0|1,0,0]=2 1745 B8R0.6 CCC(N)COCC#N Amb18111716 [0,1,0,0,0,0|1,0,1]=3 1746 B8R0.6 CCC(N)CSCC#N Amb28397055 [0,1,0,0,0,0|1,1,1]=4 1747 B8R0.6 CCC(N)CSCCO Amb28285128 [0,1,0,0,0,0|0,1,0]=2 1748 B8R0.6 CCC(N)CSCOC Amb28141151 [0,1,0,0,0,0|2,1,0]=4 1749 B8R0.6 CCC(O)CCCCCl Amb27786918 [0,1,0,0,0,0|2,0,0]=3 1750 B8R0.6 CCC(O)CCCCO Amb27762946 [0,1,0,0,0,0|1,0,0]=2 1751 B8R0.6 CCC(O)CCCNC Amb27655789 [0,1,0,0,0,0|3,0,0]=4 1752 B8R0.6 CCC(O)CCCOC Amb28249167 [0,1,0,0,0,0|3,0,0]=4 1753 B8R0.6 CCCBCC(C)CCl Amb27771247 [0,1,0,0,0,0|3,0,0]=4 1754 B8R0.6 CCCC#CC(Br)CC Amb28385620 [0,1,0,0,0,0|2,0,1]=4 1755 B8R0.6 CCCC#CC(C)CO Amb27662312 [0,1,0,0,0,0|1,0,1]=3 1756 B8R0.6 CCCC#CC(O)CCl Amb27212807 [0,1,0,0,0,0|2,0,1]=4 1757 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,1,0,0,0,0|2,0,1]=4 1758 B8R0.6 CCCCCC(=O)CO Amb27956467 [0,1,0,0,0,0|1,0,1]=3 1759 B8R0.6 CCCCCC(=O)CS Amb27750258 [0,1,0,0,0,0|1,1,1]=4 1760 B8R0.6 CCCCCC(=O)NO Amb2720996 [0,1,0,0,0,0|2,0,1]=4 1761 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|2,0,0]=3 1762 B8R0.6 CCCCCC(C)C#N Amb18642348 [0,1,0,0,0,0|2,0,1]=4 1763 B8R0.6 CCCCCC(C)CBr Amb26013045 [0,1,0,0,0,0|2,0,0]=3 1764 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|2,0,0]=3 1765 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|2,0,0]=3 1766 B8R0.6 CCCCCC(C)CN Amb27624450 [0,1,0,0,0,0|2,0,0]=3 1767 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|1,0,0]=2 1768 B8R0.6 CCCCCC(C)NC Amb3939451 [0,1,0,0,0,0|3,0,0]=4 1769 B8R0.6 CCCCCC(C)[Zn]Br Amb22000405 [0,1,0,0,0,0|3,0,0]=4 1770 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,1,0,0,0,0|1,0,2]=4 1771 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|2,0,0]=3 1772 B8R0.6 CCCCCC(Cl)CN Amb28410342 [0,1,0,0,0,0|2,0,0]=3 1773 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|2,0,0]=3 1774 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|1,0,0]=2 1775 B8R0.6 CCCCCC(O)C#N Amb9295066 [0,1,0,0,0,0|2,0,1]=4 1776 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,1,0,0,0,0|1,0,2]=4 1777 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|2,0,0]=3 1778 B8R0.6 CCCCCC(O)CN Amb8630208 [0,1,0,0,0,0|2,0,0]=3 1779 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|1,0,0]=2 1780 B8R0.6 CCCCCC(O)CS Amb27404970 [0,1,0,0,0,0|1,1,0]=3 1781 B8R0.6 CCCCCC(S)CN Amb27469627 [0,1,0,0,0,0|2,0,0]=3 1782 B8R0.6 CCCCCN(C)CC Amb27809466 [0,1,0,0,0,0|3,0,0]=4 1783 B8R0.6 CCCCC[C@@H](C)C=O Amb28351479 [0,1,0,0,0,0|1,0,2]=4 1784 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [0,1,0,0,0,0|1,0,0]=2 1785 B8R0.6 CCCCC[C@@H](O)C#N Amb27593479 [0,1,0,0,0,0|2,0,1]=4 1786 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|2,0,0]=3 1787 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [0,1,0,0,0,0|1,0,0]=2 1788 B8R0.6 CCCCC[C@H](Cl)C=O Amb28400198 [0,1,0,0,0,0|1,0,2]=4 1789 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [0,1,0,0,0,0|1,0,2]=4 1790 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|2,0,0]=3 1791 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [0,1,0,0,0,0|1,0,0]=2 1792 B8R0.6 CCCCC\C(C)=N\O Amb22338237 [0,1,0,0,0,0|2,0,1]=4 1793 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,1,0,0,0,0|2,0,1]=4 1794 B8R0.6 CCCCNC(=O)CC Amb3373336 [0,1,0,0,0,0|2,0,1]=4 1795 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,1,0,0,0,0|2,0,1]=4 1796 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,1,0,0,0,0|2,0,1]=4 1797 B8R0.6 CCCCNC(=O)CN Amb5783028 [0,1,0,0,0,0|2,0,1]=4 1798 B8R0.6 CCCCNC(=O)CO Amb5798171 [0,1,0,0,0,0|1,0,1]=3 1799 B8R0.6 CCCCNC(=S)CC Amb27975765 [0,1,0,0,0,0|2,0,1]=4 1800 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,1,0,0,0,0|2,0,1]=4 1801 B8R0.6 CCCCNC(C)C#N Amb17044849 [0,1,0,0,0,0|2,0,1]=4 1802 B8R0.6 CCCCNC(C)CBr Amb27652350 [0,1,0,0,0,0|2,0,0]=3 1803 B8R0.6 CCCCNC(C)CC Amb6608873 [0,1,0,0,0,0|2,0,0]=3 1804 B8R0.6 CCCCN[C@@H](C)CN Amb27272617 [0,1,0,0,0,0|2,0,0]=3 1805 B8R0.6 CCCCN[C@H](C)CN Amb27236730 [0,1,0,0,0,0|2,0,0]=3 1806 B8R0.6 CCCCN\C(C)=N/O Amb27173635 [0,1,0,0,0,0|2,0,1]=4 1807 B8R0.6 CCCCN\C(N)=N\O Amb24735707 [0,1,0,0,0,0|2,0,1]=4 1808 B8R0.6 CCCCOC(=N)CBr Amb27758698 [0,1,0,0,0,0|1,0,1]=3 1809 B8R0.6 CCCCOC(=N)CCl Amb29847969 [0,1,0,0,0,0|1,0,1]=3 1810 B8R0.6 CCCCOC(=O)C=O Amb3941041 [0,1,0,0,0,0|0,0,3]=4 1811 B8R0.6 CCCCOC(=O)CCl Amb2724515 [0,1,0,0,0,0|1,0,1]=3 1812 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,1,0,0,0,0|1,0,1]=3 1813 B8R0.6 CCCCOC(=O)CN Amb3939626 [0,1,0,0,0,0|1,0,1]=3 1814 B8R0.6 CCCCOC(=O)CO Amb9277787 [0,1,0,0,0,0|0,0,1]=2 1815 B8R0.6 CCCCOC(=O)CS Amb4034596 [0,1,0,0,0,0|0,1,1]=3 1816 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,1,0,0,0,0|1,0,1]=3 1817 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,1,0,0,0,0|2,0,1]=4 1818 B8R0.6 CCCCOC(=O)OC Amb25921901 [0,1,0,0,0,0|2,0,1]=4 1819 B8R0.6 CCCCOC(=S)NC Amb28120184 [0,1,0,0,0,0|2,0,1]=4 1820 B8R0.6 CCCCOC(C)C#N Amb28049084 [0,1,0,0,0,0|1,0,1]=3 1821 B8R0.6 CCCCOC(C)CBr Amb27985886 [0,1,0,0,0,0|1,0,0]=2 1822 B8R0.6 CCCCOC(C)CCl Amb27777639 [0,1,0,0,0,0|1,0,0]=2 1823 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|0,0,0]=1 1824 B8R0.6 CCCCOC(O)CC Amb28429916 [0,1,0,0,0,0|1,0,0]=2 1825 B8R0.6 CCCCOS(=O)CCl Amb27863540 [0,1,0,0,0,0|2,0,0]=3 1826 B8R0.6 CCCCO[C@@H](C)CBr Amb28285274 [0,1,0,0,0,0|1,0,0]=2 1827 B8R0.6 CCCCO[C@@H](C)CO Amb27631909 [0,1,0,0,0,0|0,0,0]=1 1828 B8R0.6 CCCCO\C(Cl)=C/Cl Amb27792254 [0,1,0,0,0,0|1,0,2]=4 1829 B8R0.6 CCCCSC(=O)CBr Amb27627822 [0,1,0,0,0,0|1,1,1]=4 1830 B8R0.6 CCCCSC(=O)CCl Amb27660104 [0,1,0,0,0,0|1,1,1]=4 1831 B8R0.6 CCCCSC(C)CC Amb4017931 [0,1,0,0,0,0|1,1,0]=3 1832 B8R0.6 CCCC\C=C(/C)CBr Amb27865492 [0,1,0,0,0,0|2,0,1]=4 1833 B8R0.6 CCCC\C=C(\C)CBr Amb27444640 [0,1,0,0,0,0|2,0,1]=4 1834 B8R0.6 CCCC\C=C(\C)CCl Amb25317209 [0,1,0,0,0,0|2,0,1]=4 1835 B8R0.6 CCCC\C=C(\C)CI Amb27879768 [0,1,0,0,0,0|2,0,1]=4 1836 B8R0.6 CCCC\C=C(\C)CN Amb28288856 [0,1,0,0,0,0|2,0,1]=4 1837 B8R0.6 CCCC\C=C(\Cl)CO Amb28315452 [0,1,0,0,0,0|1,0,1]=3 1838 B8R0.6 CCCC\C=C(\F)CO Amb27835021 [0,1,0,0,0,0|1,0,1]=3 1839 B8R0.6 CCCNCC(C)CCl Amb27976521 [0,1,0,0,0,0|3,0,0]=4 1840 B8R0.6 CCCNCC(C)NC Amb27837459 [0,1,0,0,0,0|3,0,0]=4 1841 B8R0.6 CCCNCC(Cl)CC Amb27856521 [0,1,0,0,0,0|2,0,0]=3 1842 B8R0.6 CCCNCC(N)CC Amb25918794 [0,1,0,0,0,0|2,0,0]=3 1843 B8R0.6 CCCNCC(O)CCl Amb27267938 [0,1,0,0,0,0|3,0,0]=4 1844 B8R0.6 CCCNCC(O)CF Amb28254417 [0,1,0,0,0,0|3,0,0]=4 1845 B8R0.6 CCCNCC(O)CO Amb8854777 [0,1,0,0,0,0|2,0,0]=3 1846 B8R0.6 CCCNC[C@@H](O)CC Amb27662024 [0,1,0,0,0,0|2,0,0]=3 1847 B8R0.6 CCCNC[C@@H](O)CO Amb33041826 [0,1,0,0,0,0|2,0,0]=3 1848 B8R0.6 CCCOCC(=O)CBr Amb28319117 [0,1,0,0,0,0|2,0,1]=4 1849 B8R0.6 CCCOCC(=O)CC Amb27837457 [0,1,0,0,0,0|1,0,1]=3 1850 B8R0.6 CCCOCC(=O)CCl Amb27882673 [0,1,0,0,0,0|2,0,1]=4 1851 B8R0.6 CCCOCC(Br)CCl Amb28367013 [0,1,0,0,0,0|2,0,0]=3 1852 B8R0.6 CCCOCC(C)C=O Amb28241425 [0,1,0,0,0,0|2,0,1]=4 1853 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,0,0]=3 1854 B8R0.6 CCCOCC(C)CCl Amb26053445 [0,1,0,0,0,0|2,0,0]=3 1855 B8R0.6 CCCOCC(C)CS Amb27834985 [0,1,0,0,0,0|2,0,0]=3 1856 B8R0.6 CCCOCC(C)NN Amb27648579 [0,1,0,0,0,0|3,0,0]=4 1857 B8R0.6 CCCOCC(Cl)CBr Amb27391140 [0,1,0,0,0,0|2,0,0]=3 1858 B8R0.6 CCCOCC(Cl)CCl Amb27657524 [0,1,0,0,0,0|2,0,0]=3 1859 B8R0.6 CCCOCC(N)CC Amb17485992 [0,1,0,0,0,0|1,0,0]=2 1860 B8R0.6 CCCOCC(N)CN Amb28312993 [0,1,0,0,0,0|2,0,0]=3 1861 B8R0.6 CCCOCC(O)CCl Amb28144574 [0,1,0,0,0,0|2,0,0]=3 1862 B8R0.6 CCCOCC(O)CO Amb10071476 [0,1,0,0,0,0|2,0,0]=3 1863 B8R0.6 CCCOC[C@@H](N)CC Amb27804406 [0,1,0,0,0,0|1,0,0]=2 1864 B8R0.6 CCCOC[C@H](N)CC Amb28139029 [0,1,0,0,0,0|1,0,0]=2 1865 B8R0.6 CCCOC[C@H](O)CO Amb28049195 [0,1,0,0,0,0|2,0,0]=3 1866 B8R0.6 CCCSCC(=O)CC Amb27837484 [0,1,0,0,0,0|1,1,1]=4 1867 B8R0.6 CCCSCC(C)CBr Amb28122637 [0,1,0,0,0,0|2,1,0]=4 1868 B8R0.6 CCCSCC(C)CS Amb27981763 [0,1,0,0,0,0|2,1,0]=4 1869 B8R0.6 CCCSCC(F)CC Amb28190116 [0,1,0,0,0,0|1,1,0]=3 1870 B8R0.6 CCCSCC(N)CC Amb17485961 [0,1,0,0,0,0|1,1,0]=3 1871 B8R0.6 CCCSCC(N)CO Amb28364274 [0,1,0,0,0,0|2,0,0]=3 1872 B8R0.6 CCCSCC(O)CC Amb28049075 [0,1,0,0,0,0|1,1,0]=3 1873 B8R0.6 CCCSCC(O)CO Amb27858570 [0,1,0,0,0,0|2,0,0]=3 1874 B8R0.6 CCCSC[C@@H](O)CC Amb27956460 [0,1,0,0,0,0|1,1,0]=3 1875 B8R0.6 CCC\C=C\C(C)CBr Amb33335692 [0,1,0,0,0,0|2,0,1]=4 1876 B8R0.6 CCC\C=C\C(C)CN Amb33327177 [0,1,0,0,0,0|2,0,1]=4 1877 B8R0.6 CCC\C=C\C(F)CN Amb33424867 [0,1,0,0,0,0|2,0,1]=4 1878 B8R0.6 CCC\C=C\C(N)CO Amb33475098 [0,1,0,0,0,0|1,0,1]=3 1879 B8R0.6 CCC\C=C\C(O)CBr Amb33335721 [0,1,0,0,0,0|2,0,1]=4 1880 B8R0.6 CCC\C=C\C(O)CC Amb27247981 [0,1,0,0,0,0|2,0,1]=4 1881 B8R0.6 CCC\C=C\C(O)CF Amb33424833 [0,1,0,0,0,0|2,0,1]=4 1882 B8R0.6 CCC\C=C\C(O)CN Amb24565967 [0,1,0,0,0,0|2,0,1]=4 1883 B8R0.6 CCC\C=C\C(O)CO Amb28458069 [0,1,0,0,0,0|1,0,1]=3 1884 B8R0.6 CCC\C=C\[C@@H](N)CO Amb33429684 [0,1,0,0,0,0|1,0,1]=3 1885 B8R0.6 CCC\C=C\[C@@H](O)CN Amb33424865 [0,1,0,0,0,0|2,0,1]=4 1886 B8R0.6 CCC\C=C\[C@H](N)CO Amb33424863 [0,1,0,0,0,0|1,0,1]=3 1887 B8R0.6 CCC\C=C\[C@H](O)CN Amb33424864 [0,1,0,0,0,0|2,0,1]=4 1888 B8R0.6 CCN(C)CC#CCO Amb28062947 [0,1,0,0,0,0|2,0,1]=4 1889 B8R0.6 CCNCCC(O)CC Amb27483130 [0,1,0,0,0,0|3,0,0]=4 1890 B8R0.6 CCOCCC(Br)CCl Amb27440196 [0,1,0,0,0,0|3,0,0]=4 1891 B8R0.6 CCOCCC(C)CBr Amb24552402 [0,1,0,0,0,0|3,0,0]=4 1892 B8R0.6 CCOCCC(C)CCl Amb24478711 [0,1,0,0,0,0|3,0,0]=4 1893 B8R0.6 CCOCCC(Cl)CBr Amb27262848 [0,1,0,0,0,0|3,0,0]=4 1894 B8R0.6 CCOCCC(Cl)CCl Amb28458365 [0,1,0,0,0,0|3,0,0]=4 1895 B8R0.6 CCOCCC(Cl)CO Amb28118931 [0,1,0,0,0,0|2,0,0]=3 1896 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [0,1,0,0,0,0|2,0,0]=3 1897 B8R0.6 CCOCC[C@H](N)CS Amb28247584 [0,1,0,0,0,0|2,1,0]=4 1898 B8R0.6 CCOCOC(C)CCl Amb28325962 [0,1,0,0,0,0|2,0,0]=3 1899 B8R0.6 CCOCSC(C)CN Amb28245692 [0,1,0,0,0,0|2,1,0]=4 1900 B8R0.6 CCS(=O)NCCCO Amb27443514 [0,1,0,0,0,0|3,0,0]=4 1901 B8R0.6 CCSCCC(C)CBr Amb25112497 [0,1,0,0,0,0|3,0,0]=4 1902 B8R0.6 CCSCCC(C)CCl Amb25829491 [0,1,0,0,0,0|3,0,0]=4 1903 B8R0.6 CCSCCC(N)CN Amb27392673 [0,1,0,0,0,0|3,0,0]=4 1904 B8R0.6 CCSCCC(N)CO Amb25820753 [0,1,0,0,0,0|2,0,0]=3 1905 B8R0.6 CCSCCC(O)CN Amb24581930 [0,1,0,0,0,0|3,0,0]=4 1906 B8R0.6 CCSCSC(C)CO Amb27255978 [0,1,0,0,0,0|1,1,0]=3 1907 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|1,0,0]=2 1908 B8R0.6 CC[C@@H](N)CCCOC Amb27180543 [0,1,0,0,0,0|3,0,0]=4 1909 B8R0.6 CC[C@@H](N)CNCCF Amb27187234 [0,1,0,0,0,0|2,0,0]=3 1910 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|1,0,0]=2 1911 B8R0.6 CC[C@H](C)OCCCBr Amb27477872 [0,1,0,0,0,0|2,0,0]=3 1912 B8R0.6 CC[C@H](C)OCCCO Amb28315453 [0,1,0,0,0,0|2,0,0]=3 1913 B8R0.6 CC\C(C)=N\CCCO Amb28190308 [0,1,0,0,0,0|2,0,1]=4 1914 B8R0.6 CC\C(C)=N\NCCO Amb25889624 [0,1,0,0,0,0|2,0,1]=4 1915 B8R0.6 CC\C(C)=N\OCCO Amb28315448 [0,1,0,0,0,0|1,0,1]=3 1916 B8R0.6 CC\C=C\CC(C)CO Amb27956568 [0,1,0,0,0,0|1,0,2]=4 1917 B8R0.6 CC\C=C\CC(N)CO Amb26437812 [0,1,0,0,0,0|1,0,2]=4 1918 B8R0.6 CC\C=C\CC(O)CO Amb27775912 [0,1,0,0,0,0|1,0,2]=4 1919 B8R0.6 CC\C=C\C[C@H](C)CO Amb27765926 [0,1,0,0,0,0|1,0,2]=4 1920 B8R0.6 CC\C=C\C[C@H](O)CC Amb27164460 [0,1,0,0,0,0|2,0,1]=4 1921 B8R0.6 CC\C=C\C[C@H](O)CO Amb27432264 [0,1,0,0,0,0|1,0,2]=4 1922 B8R0.6 CNC(=O)CCCCO Amb17231874 [0,1,0,0,0,0|2,0,1]=4 1923 B8R0.6 CNC(=O)COCCN Amb19016737 [0,1,0,0,0,0|2,0,1]=4 1924 B8R0.6 CNC(=O)COCCN Amb24271094 [0,1,0,0,0,0|2,0,1]=4 1925 B8R0.6 CNC(=O)COCCO Amb28285253 [0,1,0,0,0,0|1,0,1]=3 1926 B8R0.6 CNC(C)CCCCBr Amb28072213 [0,1,0,0,0,0|3,0,0]=4 1927 B8R0.6 CNC(C)CCCCCl Amb28058471 [0,1,0,0,0,0|3,0,0]=4 1928 B8R0.6 CNC(C)CCCCO Amb17569927 [0,1,0,0,0,0|2,0,0]=3 1929 B8R0.6 CNC(C)COCCN Amb27859601 [0,1,0,0,0,0|2,0,0]=3 1930 B8R0.6 CN[C@@H](C)CNCCF Amb27461568 [0,1,0,0,0,0|3,0,0]=4 1931 B8R0.6 COC(=N)COCCO Amb27857878 [0,1,0,0,0,0|1,0,1]=3 1932 B8R0.6 COC(=O)CCCCO Amb22641583 [0,1,0,0,0,0|2,0,1]=4 1933 B8R0.6 COC(=O)COCCBr Amb27657286 [0,1,0,0,0,0|2,0,1]=4 1934 B8R0.6 COC(=O)COCCCl Amb8389878 [0,1,0,0,0,0|2,0,1]=4 1935 B8R0.6 COC(=O)COCCN Amb24401799 [0,1,0,0,0,0|2,0,1]=4 1936 B8R0.6 COC(=O)COCCN Amb33495145 [0,1,0,0,0,0|2,0,1]=4 1937 B8R0.6 COC(=O)COCCO Amb24113538 [0,1,0,0,0,0|1,0,1]=3 1938 B8R0.6 COC(=O)CSCCO Amb9245011 [0,1,0,0,0,0|1,1,1]=4 1939 B8R0.6 COC(C)CCCCCl Amb27881913 [0,1,0,0,0,0|3,0,0]=4 1940 B8R0.6 COC(C)CNCCBr Amb27971924 [0,1,0,0,0,0|3,0,0]=4 1941 B8R0.6 COC(C)CNCCCl Amb27409885 [0,1,0,0,0,0|3,0,0]=4 1942 B8R0.6 COC(C)COCCO Amb28049137 [0,1,0,0,0,0|1,0,0]=2 1943 B8R0.6 COCC#CC(O)CO Amb27662370 [0,1,0,0,0,0|2,0,1]=4 1944 B8R0.6 COCCCC(C)CBr Amb24692425 [0,1,0,0,0,0|3,0,0]=4 1945 B8R0.6 COCCCC(C)CCl Amb24340257 [0,1,0,0,0,0|3,0,0]=4 1946 B8R0.6 COCCCC(C)CN Amb17569944 [0,1,0,0,0,0|3,0,0]=4 1947 B8R0.6 COCCCC(N)CO Amb26550641 [0,1,0,0,0,0|2,0,0]=3 1948 B8R0.6 COCCCC(O)CN Amb26323215 [0,1,0,0,0,0|3,0,0]=4 1949 B8R0.6 COCCCC(O)CO Amb27588922 [0,1,0,0,0,0|2,0,0]=3 1950 B8R0.6 COCCNC(=O)CO Amb9421655 [0,1,0,0,0,0|2,0,1]=4 1951 B8R0.6 COCCNC(C)CBr Amb27833848 [0,1,0,0,0,0|3,0,0]=4 1952 B8R0.6 COCCN[C@@H](C)CO Amb27254350 [0,1,0,0,0,0|2,0,0]=3 1953 B8R0.6 COCCN[C@H](C)CN Amb27168949 [0,1,0,0,0,0|3,0,0]=4 1954 B8R0.6 COCCOC(=O)CBr Amb18602737 [0,1,0,0,0,0|2,0,1]=4 1955 B8R0.6 COCCOC(=O)CN Amb28252338 [0,1,0,0,0,0|2,0,1]=4 1956 B8R0.6 COCCOC(=O)CS Amb26859402 [0,1,0,0,0,0|1,1,1]=4 1957 B8R0.6 COCCOC(C)C#N Amb27782316 [0,1,0,0,0,0|2,0,1]=4 1958 B8R0.6 COCCOC(C)CN Amb27949440 [0,1,0,0,0,0|2,0,0]=3 1959 B8R0.6 COCCOC(C)CO Amb28188184 [0,1,0,0,0,0|1,0,0]=2 1960 B8R0.6 COCCSC(C)CN Amb28049082 [0,1,0,0,0,0|2,1,0]=4 1961 B8R0.6 COCCSC(C)CO Amb27174627 [0,1,0,0,0,0|1,1,0]=3 1962 B8R0.6 COCOCC(C)CBr Amb28208286 [0,1,0,0,0,0|3,0,0]=4 1963 B8R0.6 COCOCC(C)CI Amb27795856 [0,1,0,0,0,0|3,0,0]=4 1964 B8R0.6 COCOCC(N)CO Amb27601063 [0,1,0,0,0,0|3,0,0]=4 1965 B8R0.6 COCOCC(O)CCl Amb27432084 [0,1,0,0,0,0|3,0,0]=4 1966 B8R0.6 COCOCC(O)CO Amb27632031 [0,1,0,0,0,0|3,0,0]=4 1967 B8R0.6 COCOC[C@@H](C)CO Amb24478614 [0,1,0,0,0,0|3,0,0]=4 1968 B8R0.6 CSC(C)CNCCF Amb27771700 [0,1,0,0,0,0|3,0,0]=4 1969 B8R0.6 CSC(C)CNCCN Amb27589325 [0,1,0,0,0,0|3,0,0]=4 1970 B8R0.6 CSCCCC(C)CBr Amb25936940 [0,1,0,0,0,0|3,0,0]=4 1971 B8R0.6 CSCCCC(C)CCl Amb25333579 [0,1,0,0,0,0|3,0,0]=4 1972 B8R0.6 CSCCCC(C)CN Amb27863048 [0,1,0,0,0,0|3,0,0]=4 1973 B8R0.6 CSCCCC(N)CO Amb25888586 [0,1,0,0,0,0|2,0,0]=3 1974 B8R0.6 CSCCCC(O)CN Amb25809175 [0,1,0,0,0,0|3,0,0]=4 1975 B8R0.6 CSCCNC(C)CO Amb27654830 [0,1,0,0,0,0|2,0,0]=3 1976 B8R0.6 CSCCN[C@H](C)CN Amb28118325 [0,1,0,0,0,0|3,0,0]=4 1977 B8R0.6 CSCCOC(=O)CO Amb28193244 [0,1,0,0,0,0|1,0,1]=3 1978 B8R0.6 CSCSCC(O)CO Amb27212112 [0,1,0,0,0,0|3,0,0]=4 1979 B8R0.6 CS[C@H](C)\C=C\CCO Amb27605380 [0,1,0,0,0,0|2,0,1]=4 1980 B8R0.6 C[C@H](CO)CCCCO Amb27804560 [0,1,0,0,0,0|2,0,0]=3 1981 B8R0.6 C\C(=C/CCCBr)CO Amb28348616 [0,1,0,0,0,0|2,0,1]=4 1982 B8R0.6 C\C(=C/CCCN)CO Amb28077171 [0,1,0,0,0,0|2,0,1]=4 1983 B8R0.6 C\C=C(/C)CCCCO Amb28385373 [0,1,0,0,0,0|1,0,2]=4 1984 B8R0.6 C\C=C\CCC(C)CO Amb27662361 [0,1,0,0,0,0|1,0,2]=4 1985 B8R0.6 C\C=C\CSC(C)CO Amb27641132 [0,1,0,0,0,0|0,1,2]=4 1986 B8R0.6 ClCCOCC(Cl)CCl Amb27777183 [0,1,0,0,0,0|2,0,0]=3 1987 B8R0.6 N#CC(O)CCCCO Amb17593356 [0,1,0,0,0,0|2,0,1]=4 1988 B8R0.6 N#CCCC[C@H](O)CO Amb27805249 [0,1,0,0,0,0|2,0,1]=4 1989 B8R0.6 N#CCOC[C@@H](N)CO Amb27965088 [0,1,0,0,0,0|2,0,1]=4 1990 B8R0.6 NC(CO)COCCO Amb27956486 [0,1,0,0,0,0|1,0,0]=2 1991 B8R0.6 NCC(=O)OCCCO Amb27430485 [0,1,0,0,0,0|2,0,1]=4 1992 B8R0.6 NCC(O)CCCCBr Amb27956026 [0,1,0,0,0,0|3,0,0]=4 1993 B8R0.6 NCCCCC(N)CN Amb27602480 [0,1,0,0,0,0|3,0,0]=4 1994 B8R0.6 NCCCCC(N)CO Amb27403112 [0,1,0,0,0,0|2,0,0]=3 1995 B8R0.6 NCCCCC(N)CS Amb27409203 [0,1,0,0,0,0|2,1,0]=4 1996 B8R0.6 NCCCC[C@H](N)CN Amb27173098 [0,1,0,0,0,0|3,0,0]=4 1997 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [0,1,0,0,0,0|2,0,0]=3 1998 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [0,1,0,0,0,0|2,0,0]=3 1999 B8R0.6 NCCCNC(=O)CO Amb28346767 [0,1,0,0,0,0|2,0,1]=4 2000 B8R0.6 NCCNCC(N)CO Amb27234820 [0,1,0,0,0,0|3,0,0]=4 2001 B8R0.6 NCCNCC(O)CO Amb28198046 [0,1,0,0,0,0|3,0,0]=4 2002 B8R0.6 NCCNC[C@H](N)CO Amb27218189 [0,1,0,0,0,0|3,0,0]=4 2003 B8R0.6 NCCNC[C@H](O)CO Amb27480727 [0,1,0,0,0,0|3,0,0]=4 2004 B8R0.6 NCCOCC(O)CF Amb27774801 [0,1,0,0,0,0|2,0,0]=3 2005 B8R0.6 NC[C@H](O)CCCCBr Amb27165807 [0,1,0,0,0,0|3,0,0]=4 2006 B8R0.6 O=C(CCl)OCCCO Amb27198162 [0,1,0,0,0,0|2,0,1]=4 2007 B8R0.6 O=C(CO)NCCCO Amb5798092 [0,1,0,0,0,0|2,0,1]=4 2008 B8R0.6 O=C(CO)OCCCCl Amb27457140 [0,1,0,0,0,0|1,0,1]=3 2009 B8R0.6 O=C(CO)OCCCF Amb27765133 [0,1,0,0,0,0|1,0,1]=3 2010 B8R0.6 OC(CCl)CCCCCl Amb27490964 [0,1,0,0,0,0|3,0,0]=4 2011 B8R0.6 OC(CF)CNCCF Amb27243820 [0,1,0,0,0,0|3,0,0]=4 2012 B8R0.6 OC(CS)CCCCS Amb27487018 [0,1,0,0,0,0|2,1,0]=4 2013 B8R0.6 OCC#CC[C@@H](O)CO Amb28191975 [0,1,0,0,0,0|2,0,1]=4 2014 B8R0.6 OCC#CC[C@H](O)CO Amb27589715 [0,1,0,0,0,0|2,0,1]=4 2015 B8R0.6 OCC(O)CCCCBr Amb27444663 [0,1,0,0,0,0|2,0,0]=3 2016 B8R0.6 OCC(O)COCCCl Amb27596579 [0,1,0,0,0,0|2,0,0]=3 2017 B8R0.6 OCCCCC(O)CBr Amb27219046 [0,1,0,0,0,0|2,0,0]=3 2018 B8R0.6 OCCCCC(O)CO Amb8513368 [0,1,0,0,0,0|2,0,0]=3 2019 B8R0.6 OCCNCC(O)CO Amb25288018 [0,1,0,0,0,0|2,0,0]=3 2020 B8R0.6 OCCNC[C@H](O)CO Amb27980519 [0,1,0,0,0,0|2,0,0]=3 2021 B8R0.6 OCCOCC(Cl)CO Amb28142003 [0,1,0,0,0,0|1,0,0]=2 2022 B8R0.6 OCCOCC(O)CCl Amb9787504 [0,1,0,0,0,0|1,0,0]=2 2023 B8R0.6 OCCOC\C(Br)=C\Br Amb2780595 [0,1,0,0,0,0|1,0,2]=4 2024 B8R0.6 OCCSCC(O)CCl Amb27180291 [0,1,0,0,0,0|1,1,0]=3 2025 B8R0.6 OCCSCC(O)CF Amb27778008 [0,1,0,0,0,0|1,1,0]=3 2026 B8R0.6 OCCSCC(O)CO Amb25945811 [0,1,0,0,0,0|1,1,0]=3 2027 B8R0.6 OC[C@@H](O)CNCCF Amb27852630 [0,1,0,0,0,0|3,0,0]=4 2028 B8R0.6 OC\C(F)=C\CCCCl Amb27623942 [0,1,0,0,0,0|2,0,1]=4 2029 B8R0.7 C#CCCCCC(C)C Amb24628581 [0,1,0,0,0,0|2,0,1]=4 2030 B8R0.7 C#CCCCC[C@@H](C)O Amb27207329 [0,1,0,0,0,0|1,0,2]=4 2031 B8R0.7 C#CCCCC[C@H](C)O Amb28315512 [0,1,0,0,0,0|1,0,2]=4 2032 B8R0.7 C#CCCNC[C@@H](C)O Amb27790440 [0,1,0,0,0,0|1,0,2]=4 2033 B8R0.7 C#CCCNC[C@H](C)O Amb27626433 [0,1,0,0,0,0|1,0,2]=4 2034 B8R0.7 C#CCCOCC(=O)O Amb28118359 [0,1,0,0,0,0|0,0,3]=4 2035 B8R0.7 C#CCNCCC(C)C Amb6683588 [0,1,0,0,0,0|2,0,1]=4 2036 B8R0.7 C#CCOCCN(C)C Amb33456252 [0,1,0,0,0,0|2,0,1]=4 2037 B8R0.7 C#CCONCC(C)C Amb27837688 [0,1,0,0,0,0|2,0,1]=4 2038 B8R0.7 C#CCONCC(C)O Amb27205989 [0,1,0,0,0,0|2,0,1]=4 2039 B8R0.7 C#CCSCCC(C)C Amb27493954 [0,1,0,0,0,0|1,1,1]=4 2040 B8R0.7 C=C(Br)CCNCCO Amb27616621 [0,1,0,0,0,0|1,0,2]=4 2041 B8R0.7 C=C(Br)COCCCC Amb27956559 [0,1,0,0,0,0|1,0,1]=3 2042 B8R0.7 C=C(Br)COCCNC Amb18324681 [0,1,0,0,0,0|2,0,1]=4 2043 B8R0.7 C=C(C)CCCCCBr Amb28436917 [0,1,0,0,0,0|2,0,1]=4 2044 B8R0.7 C=C(C)CCCCCC Amb6298939 [0,1,0,0,0,0|2,0,1]=4 2045 B8R0.7 C=C(C)CCCCCO Amb27641867 [0,1,0,0,0,0|1,0,1]=3 2046 B8R0.7 C=C(C)CCNCCC Amb27813957 [0,1,0,0,0,0|2,0,1]=4 2047 B8R0.7 C=C(C)CCOCCBr Amb27242287 [0,1,0,0,0,0|1,0,1]=3 2048 B8R0.7 C=C(C)CCSCCN Amb28123809 [0,1,0,0,0,0|1,1,1]=4 2049 B8R0.7 C=C(C)CNCCCC Amb17308646 [0,1,0,0,0,0|2,0,1]=4 2050 B8R0.7 C=C(C)CNCCCO Amb28285230 [0,1,0,0,0,0|2,0,1]=4 2051 B8R0.7 C=C(C)COCCCC Amb22641495 [0,1,0,0,0,0|1,0,1]=3 2052 B8R0.7 C=C(C)COCCCN Amb28123400 [0,1,0,0,0,0|2,0,1]=4 2053 B8R0.7 C=C(C)COCCNC Amb27217708 [0,1,0,0,0,0|2,0,1]=4 2054 B8R0.7 C=C(C)CONCCC Amb28074460 [0,1,0,0,0,0|2,0,1]=4 2055 B8R0.7 C=C(C)CONCCO Amb28197415 [0,1,0,0,0,0|2,0,1]=4 2056 B8R0.7 C=C(C)CSCCCC Amb9787751 [0,1,0,0,0,0|1,1,1]=4 2057 B8R0.7 C=C(C)CSSCCO Amb28049272 [0,1,0,0,0,0|1,1,1]=4 2058 B8R0.7 C=C(Cl)COCCCN Amb28197915 [0,1,0,0,0,0|2,0,1]=4 2059 B8R0.7 C=CCCCCC(C)C Amb27180770 [0,1,0,0,0,0|2,0,1]=4 2060 B8R0.7 C=CCCCCC(C)N Amb22059559 [0,1,0,0,0,0|2,0,1]=4 2061 B8R0.7 C=CCCOCC(=O)O Amb7793843 [0,1,0,0,0,0|0,0,3]=4 2062 B8R0.7 C=CCOCCN(C)C Amb27243517 [0,1,0,0,0,0|2,0,1]=4 2063 B8R0.7 C=CCONCC(C)C Amb27859587 [0,1,0,0,0,0|2,0,1]=4 2064 B8R0.7 C=CCONCC(C)O Amb27424413 [0,1,0,0,0,0|2,0,1]=4 2065 B8R0.7 C=CCONC[C@H](C)O Amb27244019 [0,1,0,0,0,0|2,0,1]=4 2066 B8R0.7 C=CCSCCC(C)O Amb28315462 [0,1,0,0,0,0|1,1,1]=4 2067 B8R0.7 CC#CCOCC(C)N Amb30017160 [0,1,0,0,0,0|1,0,2]=4 2068 B8R0.7 CC(=O)CCC#CCO Amb27867270 [0,1,0,0,0,0|1,0,2]=4 2069 B8R0.7 CC(=O)CCCCCBr Amb27401578 [0,1,0,0,0,0|2,0,1]=4 2070 B8R0.7 CC(=O)CCCCCCl Amb26591097 [0,1,0,0,0,0|2,0,1]=4 2071 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,1,0,0,0,0|2,0,1]=4 2072 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,1,0,0,0,0|2,0,1]=4 2073 B8R0.7 CC(=O)CCCCCO Amb27237283 [0,1,0,0,0,0|1,0,1]=3 2074 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,1,0,0,0,0|1,0,1]=3 2075 B8R0.7 CC(=O)CCOCCBr Amb32651831 [0,1,0,0,0,0|1,0,1]=3 2076 B8R0.7 CC(=O)CCOCCCl Amb27982282 [0,1,0,0,0,0|1,0,1]=3 2077 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,1,0,0,0,0|1,0,1]=3 2078 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [0,1,0,0,0,0|1,0,2]=4 2079 B8R0.7 CC(=O)COCCCN Amb18630475 [0,1,0,0,0,0|1,0,2]=4 2080 B8R0.7 CC(=O)NCCCCO Amb17102977 [0,1,0,0,0,0|2,0,1]=4 2081 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,1,0,0,0,0|2,0,1]=4 2082 B8R0.7 CC(=O)OCOCCBr Amb28458426 [0,1,0,0,0,0|2,0,1]=4 2083 B8R0.7 CC(Br)CCCCC#N Amb27831403 [0,1,0,0,0,0|2,0,1]=4 2084 B8R0.7 CC(C)=CCCCCO Amb28315431 [0,1,0,0,0,0|1,0,2]=4 2085 B8R0.7 CC(C)=CCOCCN Amb19020763 [0,1,0,0,0,0|1,0,2]=4 2086 B8R0.7 CC(C)CC#CCCN Amb28285174 [0,1,0,0,0,0|2,0,1]=4 2087 B8R0.7 CC(C)CC#CCCO Amb28206065 [0,1,0,0,0,0|1,0,1]=3 2088 B8R0.7 CC(C)CCC#CCO Amb27660911 [0,1,0,0,0,0|1,0,1]=3 2089 B8R0.7 CC(C)CCCCC#N Amb25079358 [0,1,0,0,0,0|2,0,1]=4 2090 B8R0.7 CC(C)CCCCC=O Amb18642674 [0,1,0,0,0,0|1,0,2]=4 2091 B8R0.7 CC(C)CCCCCBr Amb16231055 [0,1,0,0,0,0|2,0,0]=3 2092 B8R0.7 CC(C)CCCCCCl Amb27592473 [0,1,0,0,0,0|2,0,0]=3 2093 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|2,0,0]=3 2094 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|1,0,0]=2 2095 B8R0.7 CC(C)CCNCC#N Amb6710514 [0,1,0,0,0,0|2,0,1]=4 2096 B8R0.7 CC(C)CCNCCBr Amb25721799 [0,1,0,0,0,0|2,0,0]=3 2097 B8R0.7 CC(C)CCNCCBr Amb32653537 [0,1,0,0,0,0|2,0,0]=3 2098 B8R0.7 CC(C)CCNCCI Amb28188514 [0,1,0,0,0,0|2,0,0]=3 2099 B8R0.7 CC(C)CCNCCO Amb4034535 [0,1,0,0,0,0|1,0,0]=2 2100 B8R0.7 CC(C)CCOCCBr Amb6255121 [0,1,0,0,0,0|1,0,0]=2 2101 B8R0.7 CC(C)CCOCCCl Amb9209784 [0,1,0,0,0,0|1,0,0]=2 2102 B8R0.7 CC(C)CCOCCI Amb27446465 [0,1,0,0,0,0|1,0,0]=2 2103 B8R0.7 CC(C)CCOCCN Amb6245091 [0,1,0,0,0,0|1,0,0]=2 2104 B8R0.7 CC(C)CCOCCO Amb10609610 [0,1,0,0,0,0|0,0,0]=1 2105 B8R0.7 CC(C)CCSCC=O Amb27215189 [0,1,0,0,0,0|0,1,2]=4 2106 B8R0.7 CC(C)CCSCCCl Amb24080319 [0,1,0,0,0,0|1,1,0]=3 2107 B8R0.7 CC(C)CCSCCN Amb6260831 [0,1,0,0,0,0|1,1,0]=3 2108 B8R0.7 CC(C)CC\C=C\CCl Amb28133989 [0,1,0,0,0,0|2,0,1]=4 2109 B8R0.7 CC(C)CNCCCBr Amb27401785 [0,1,0,0,0,0|3,0,0]=4 2110 B8R0.7 CC(C)CNCCCN Amb17315266 [0,1,0,0,0,0|3,0,0]=4 2111 B8R0.7 CC(C)CNCCCO Amb534463 [0,1,0,0,0,0|2,0,0]=3 2112 B8R0.7 CC(C)COCCC#N Amb6262948 [0,1,0,0,0,0|2,0,1]=4 2113 B8R0.7 CC(C)COCCC=O Amb28366423 [0,1,0,0,0,0|2,0,1]=4 2114 B8R0.7 CC(C)COCCCBr Amb8828212 [0,1,0,0,0,0|2,0,0]=3 2115 B8R0.7 CC(C)COCCCCl Amb6255740 [0,1,0,0,0,0|2,0,0]=3 2116 B8R0.7 CC(C)COCCCN Amb1154609 [0,1,0,0,0,0|2,0,0]=3 2117 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|2,0,0]=3 2118 B8R0.7 CC(C)COCCCS Amb27842108 [0,1,0,0,0,0|2,0,0]=3 2119 B8R0.7 CC(C)COCCON Amb28457759 [0,1,0,0,0,0|3,0,0]=4 2120 B8R0.7 CC(C)CONCCF Amb28385085 [0,1,0,0,0,0|3,0,0]=4 2121 B8R0.7 CC(C)CSCCCCl Amb9304955 [0,1,0,0,0,0|2,1,0]=4 2122 B8R0.7 CC(C)CSCCCN Amb9203029 [0,1,0,0,0,0|2,1,0]=4 2123 B8R0.7 CC(C)CSCCCO Amb9273779 [0,1,0,0,0,0|2,0,0]=3 2124 B8R0.7 CC(C)CS\C=C\CO Amb28051939 [0,1,0,0,0,0|2,0,1]=4 2125 B8R0.7 CC(C)C\C=C\CCCl Amb27255207 [0,1,0,0,0,0|2,0,1]=4 2126 B8R0.7 CC(C)C\C=C\CCO Amb24340184 [0,1,0,0,0,0|1,0,1]=3 2127 B8R0.7 CC(C)C\C=N\CCN Amb27653243 [0,1,0,0,0,0|2,0,1]=4 2128 B8R0.7 CC(C)NCCCCCl Amb27759406 [0,1,0,0,0,0|3,0,0]=4 2129 B8R0.7 CC(C)NCCCCF Amb27852540 [0,1,0,0,0,0|3,0,0]=4 2130 B8R0.7 CC(C)NCCCCN Amb17334116 [0,1,0,0,0,0|3,0,0]=4 2131 B8R0.7 CC(C)NCCCCO Amb17334129 [0,1,0,0,0,0|2,0,0]=3 2132 B8R0.7 CC(C)OCCCCBr Amb8855453 [0,1,0,0,0,0|3,0,0]=4 2133 B8R0.7 CC(C)OCCCCCl Amb18181677 [0,1,0,0,0,0|3,0,0]=4 2134 B8R0.7 CC(C)OCCCCN Amb6243226 [0,1,0,0,0,0|3,0,0]=4 2135 B8R0.7 CC(C)OCCCCO Amb24704996 [0,1,0,0,0,0|2,0,0]=3 2136 B8R0.7 CC(C)OCCCCS Amb27220452 [0,1,0,0,0,0|2,1,0]=4 2137 B8R0.7 CC(C)OCOCCCl Amb28140242 [0,1,0,0,0,0|2,0,0]=3 2138 B8R0.7 CC(C)OCOCCN Amb25962115 [0,1,0,0,0,0|2,0,0]=3 2139 B8R0.7 CC(C)OCSCCN Amb27841799 [0,1,0,0,0,0|2,1,0]=4 2140 B8R0.7 CC(C)OC\C=C\CO Amb33079442 [0,1,0,0,0,0|2,0,1]=4 2141 B8R0.7 CC(C)O\C=C\CCO Amb28315471 [0,1,0,0,0,0|2,0,1]=4 2142 B8R0.7 CC(C)SCCCCBr Amb26443109 [0,1,0,0,0,0|3,0,0]=4 2143 B8R0.7 CC(C)SCCCCCl Amb18798740 [0,1,0,0,0,0|3,0,0]=4 2144 B8R0.7 CC(C)SCCCCN Amb17500947 [0,1,0,0,0,0|3,0,0]=4 2145 B8R0.7 CC(C)SCCCCO Amb28049080 [0,1,0,0,0,0|2,0,0]=3 2146 B8R0.7 CC(C)SCCCCS Amb27833171 [0,1,0,0,0,0|2,1,0]=4 2147 B8R0.7 CC(C)\C=C\CCCO Amb28045718 [0,1,0,0,0,0|1,0,2]=4 2148 B8R0.7 CC(C)\C=N\NCCO Amb24644241 [0,1,0,0,0,0|2,0,1]=4 2149 B8R0.7 CC(C)\C=N\OCCBr Amb27408587 [0,1,0,0,0,0|2,0,1]=4 2150 B8R0.7 CC(C)\C=N\OCCO Amb27632055 [0,1,0,0,0,0|1,0,1]=3 2151 B8R0.7 CC(Cl)CCCCC=O Amb18643832 [0,1,0,0,0,0|1,0,2]=4 2152 B8R0.7 CC(Cl)CCCCCO Amb27656999 [0,1,0,0,0,0|1,0,0]=2 2153 B8R0.7 CC(Cl)CCOCCCl Amb27606700 [0,1,0,0,0,0|1,0,0]=2 2154 B8R0.7 CC(Cl)CNCCCCl Amb27637862 [0,1,0,0,0,0|3,0,0]=4 2155 B8R0.7 CC(Cl)C\C=C\CCO Amb26421608 [0,1,0,0,0,0|1,0,1]=3 2156 B8R0.7 CC(Cl)OCCCCCl Amb28383422 [0,1,0,0,0,0|3,0,0]=4 2157 B8R0.7 CC(F)CCCCCBr Amb27781575 [0,1,0,0,0,0|2,0,0]=3 2158 B8R0.7 CC(F)CCSCCN Amb27848652 [0,1,0,0,0,0|1,1,0]=3 2159 B8R0.7 CC(F)CSCCCN Amb27209900 [0,1,0,0,0,0|2,1,0]=4 2160 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|1,0,0]=2 2161 B8R0.7 CC(N)CNCCCF Amb27162848 [0,1,0,0,0,0|3,0,0]=4 2162 B8R0.7 CC(N)COCCCO Amb27635056 [0,1,0,0,0,0|2,0,0]=3 2163 B8R0.7 CC(N)CSCCCF Amb27223251 [0,1,0,0,0,0|2,1,0]=4 2164 B8R0.7 CC(O)CCC#CCO Amb28315496 [0,1,0,0,0,0|1,0,1]=3 2165 B8R0.7 CC(O)CCCCCF Amb27660009 [0,1,0,0,0,0|2,0,0]=3 2166 B8R0.7 CC(O)CCCCCO Amb27464322 [0,1,0,0,0,0|1,0,0]=2 2167 B8R0.7 CC(O)CCNCCN Amb27768810 [0,1,0,0,0,0|2,0,0]=3 2168 B8R0.7 CC(O)CNCCC#N Amb9243318 [0,1,0,0,0,0|2,0,1]=4 2169 B8R0.7 CC(O)CNCCCF Amb27273615 [0,1,0,0,0,0|2,0,0]=3 2170 B8R0.7 CC(O)CNCCCO Amb17308669 [0,1,0,0,0,0|2,0,0]=3 2171 B8R0.7 CC(O)COCCCN Amb28318924 [0,1,0,0,0,0|1,0,0]=2 2172 B8R0.7 CC(O)COCOCO Amb28248280 [0,1,0,0,0,0|2,0,0]=3 2173 B8R0.7 CC(O)CSCCCS Amb27956596 [0,1,0,0,0,0|1,1,0]=3 2174 B8R0.7 CCC#CCCC(O)O Amb28064154 [0,1,0,0,0,0|1,0,2]=4 2175 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,1,0,0,0,0|1,0,2]=4 2176 B8R0.7 CCCC#CCC(C)C Amb26876551 [0,1,0,0,0,0|2,0,1]=4 2177 B8R0.7 CCCC#CC[C@@H](C)O Amb27652867 [0,1,0,0,0,0|1,0,1]=3 2178 B8R0.7 CCCCC#CC(=O)O Amb2721486 [0,1,0,0,0,0|1,0,2]=4 2179 B8R0.7 CCCCC#CC(C)Br Amb27645420 [0,1,0,0,0,0|2,0,1]=4 2180 B8R0.7 CCCCC#CC(C)C Amb28291437 [0,1,0,0,0,0|2,0,1]=4 2181 B8R0.7 CCCCC#CC(C)O Amb27231182 [0,1,0,0,0,0|1,0,1]=3 2182 B8R0.7 CCCCC#C[C@@H](C)O Amb27835165 [0,1,0,0,0,0|1,0,1]=3 2183 B8R0.7 CCCCCCB(O)O Amb2722519 [0,1,0,0,0,0|2,0,0]=3 2184 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [0,1,0,0,0,0|1,0,2]=4 2185 B8R0.7 CCCCCCC(=O)O Amb34915914 [0,1,0,0,0,0|1,0,1]=3 2186 B8R0.7 CCCCCCC(=O)O Amb3499439 [0,1,0,0,0,0|1,0,1]=3 2187 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [0,1,0,0,0,0|1,0,2]=4 2188 B8R0.7 CCCCCCC(Br)Br Amb33299433 [0,1,0,0,0,0|2,0,0]=3 2189 B8R0.7 CCCCCCC(C)=O Amb6891961 [0,1,0,0,0,0|1,0,2]=4 2190 B8R0.7 CCCCCCC(C)Br Amb8387237 [0,1,0,0,0,0|2,0,0]=3 2191 B8R0.7 CCCCCCC(C)C Amb6366318 [0,1,0,0,0,0|2,0,0]=3 2192 B8R0.7 CCCCCCC(C)Cl Amb7795644 [0,1,0,0,0,0|2,0,0]=3 2193 B8R0.7 CCCCCCC(C)I Amb3940584 [0,1,0,0,0,0|2,0,0]=3 2194 B8R0.7 CCCCCCC(C)N Amb3940458 [0,1,0,0,0,0|2,0,0]=3 2195 B8R0.7 CCCCCCC(C)O Amb3940385 [0,1,0,0,0,0|1,0,0]=2 2196 B8R0.7 CCCCCCC(C)S Amb7795225 [0,1,0,0,0,0|1,1,0]=3 2197 B8R0.7 CCCCCCC(N)=O Amb8858816 [0,1,0,0,0,0|1,0,2]=4 2198 B8R0.7 CCCCCCC(O)O Amb27451028 [0,1,0,0,0,0|1,0,0]=2 2199 B8R0.7 CCCCCC[C@@H](C)Br Amb26563385 [0,1,0,0,0,0|2,0,0]=3 2200 B8R0.7 CCCCCC[C@@H](C)N Amb8516401 [0,1,0,0,0,0|2,0,0]=3 2201 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [0,1,0,0,0,0|1,0,0]=2 2202 B8R0.7 CCCCCC[C@H](C)Br Amb28401131 [0,1,0,0,0,0|2,0,0]=3 2203 B8R0.7 CCCCCC[C@H](C)N Amb8516350 [0,1,0,0,0,0|2,0,0]=3 2204 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,1,0,0,0,0|2,0,1]=4 2205 B8R0.7 CCCCCC[SiH](Cl)Cl Amb22733063 [0,1,0,0,0,0|2,1,0]=4 2206 B8R0.7 CCCCCNC(C)C Amb6250709 [0,1,0,0,0,0|3,0,0]=4 2207 B8R0.7 CCCCCOB(O)O Amb24716868 [0,1,0,0,0,0|3,0,0]=4 2208 B8R0.7 CCCCCSC(C)C Amb27197323 [0,1,0,0,0,0|3,0,0]=4 2209 B8R0.7 CCCCCSC(C)Cl Amb27477698 [0,1,0,0,0,0|3,0,0]=4 2210 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [0,1,0,0,0,0|1,0,2]=4 2211 B8R0.7 CCCCNCC(=O)O Amb7766471 [0,1,0,0,0,0|1,0,1]=3 2212 B8R0.7 CCCCNCC(C)C Amb6690984 [0,1,0,0,0,0|2,0,0]=3 2213 B8R0.7 CCCCNCC(C)O Amb9246458 [0,1,0,0,0,0|1,0,0]=2 2214 B8R0.7 CCCCNCC(N)=O Amb1126543 [0,1,0,0,0,0|1,0,2]=4 2215 B8R0.7 CCCCNCC(N)=O Amb7969721 [0,1,0,0,0,0|1,0,2]=4 2216 B8R0.7 CCCCOCC(=O)O Amb8514871 [0,1,0,0,0,0|0,0,1]=2 2217 B8R0.7 CCCCOCC(C)Br Amb27390173 [0,1,0,0,0,0|1,0,0]=2 2218 B8R0.7 CCCCOCC(C)C Amb26035939 [0,1,0,0,0,0|1,0,0]=2 2219 B8R0.7 CCCCOCC(C)O Amb4019960 [0,1,0,0,0,0|0,0,0]=1 2220 B8R0.7 CCCCOCC(N)=O Amb27855875 [0,1,0,0,0,0|0,0,2]=3 2221 B8R0.7 CCCCOC[C@@H](C)N Amb27838727 [0,1,0,0,0,0|1,0,0]=2 2222 B8R0.7 CCCCOC[C@H](C)N Amb28326216 [0,1,0,0,0,0|1,0,0]=2 2223 B8R0.7 CCCCONC(N)=O Amb2899789 [0,1,0,0,0,0|1,0,2]=4 2224 B8R0.7 CCCCSCC(=N)N Amb9479963 [0,1,0,0,0,0|1,1,1]=4 2225 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,1,0,0,0,0|0,1,1]=3 2226 B8R0.7 CCCCSCC(C)C Amb4017929 [0,1,0,0,0,0|1,1,0]=3 2227 B8R0.7 CCCCSCC(C)N Amb27772074 [0,1,0,0,0,0|1,1,0]=3 2228 B8R0.7 CCCCSCC(C)O Amb27768766 [0,1,0,0,0,0|0,1,0]=2 2229 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [0,1,0,0,0,0|2,0,1]=4 2230 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [0,1,0,0,0,0|1,0,2]=4 2231 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [0,1,0,0,0,0|1,0,1]=3 2232 B8R0.7 CCCC\N=C\[C@H](C)Cl Amb27401792 [0,1,0,0,0,0|2,0,1]=4 2233 B8R0.7 CCCNCCC(=O)O Amb18633174 [0,1,0,0,0,0|2,0,1]=4 2234 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,1,0,0,0,0|2,0,1]=4 2235 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,1,0,0,0,0|2,0,1]=4 2236 B8R0.7 CCCNCCC(C)C Amb6279764 [0,1,0,0,0,0|2,0,0]=3 2237 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|3,0,0]=4 2238 B8R0.7 CCCNCCC(F)F Amb26012789 [0,1,0,0,0,0|3,0,0]=4 2239 B8R0.7 CCCNCCN(C)C Amb1131117 [0,1,0,0,0,0|3,0,0]=4 2240 B8R0.7 CCCNCCN(C)C Amb19515715 [0,1,0,0,0,0|3,0,0]=4 2241 B8R0.7 CCCNCC[C@@H](C)O Amb27251174 [0,1,0,0,0,0|2,0,0]=3 2242 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [0,1,0,0,0,0|3,0,0]=4 2243 B8R0.7 CCCNCNC(C)C Amb28367897 [0,1,0,0,0,0|3,0,0]=4 2244 B8R0.7 CCCOCCC(=O)O Amb8874502 [0,1,0,0,0,0|2,0,1]=4 2245 B8R0.7 CCCOCCC(C)=O Amb8874915 [0,1,0,0,0,0|1,0,1]=3 2246 B8R0.7 CCCOCCC(C)Cl Amb27768653 [0,1,0,0,0,0|1,0,0]=2 2247 B8R0.7 CCCOCCC(C)O Amb27438490 [0,1,0,0,0,0|1,0,0]=2 2248 B8R0.7 CCCONCC(=O)O Amb27401902 [0,1,0,0,0,0|2,0,1]=4 2249 B8R0.7 CCCONCC(C)C Amb28326057 [0,1,0,0,0,0|2,0,0]=3 2250 B8R0.7 CCCSCCC(C)C Amb28400564 [0,1,0,0,0,0|1,1,0]=3 2251 B8R0.7 CCCSCCN(C)C Amb27660717 [0,1,0,0,0,0|2,1,0]=4 2252 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [0,1,0,0,0,0|1,0,2]=4 2253 B8R0.7 CCC\C=C\CC(C)Br Amb26397126 [0,1,0,0,0,0|2,0,1]=4 2254 B8R0.7 CCC\C=C\CC(C)Cl Amb26636688 [0,1,0,0,0,0|2,0,1]=4 2255 B8R0.7 CCC\C=C\CC(C)O Amb27766099 [0,1,0,0,0,0|1,0,1]=3 2256 B8R0.7 CCC\C=C\CN(C)O Amb33224461 [0,1,0,0,0,0|2,0,1]=4 2257 B8R0.7 CCC\C=C\C[C@@H](C)N Amb33424842 [0,1,0,0,0,0|2,0,1]=4 2258 B8R0.7 CCC\C=C\C[C@@H](C)O Amb33424840 [0,1,0,0,0,0|1,0,1]=3 2259 B8R0.7 CCC\C=C\C[C@H](C)N Amb33424841 [0,1,0,0,0,0|2,0,1]=4 2260 B8R0.7 CCC\C=C\C[C@H](C)O Amb33358968 [0,1,0,0,0,0|1,0,1]=3 2261 B8R0.7 CCNCCCC(=O)O Amb30585148 [0,1,0,0,0,0|2,0,1]=4 2262 B8R0.7 CCNCCCC(=O)O Amb6253896 [0,1,0,0,0,0|2,0,1]=4 2263 B8R0.7 CCNCCCC(C)Cl Amb27768830 [0,1,0,0,0,0|3,0,0]=4 2264 B8R0.7 CCOC#CCC(C)O Amb27804467 [0,1,0,0,0,0|2,0,1]=4 2265 B8R0.7 CCOCCCC(=O)O Amb6257602 [0,1,0,0,0,0|2,0,1]=4 2266 B8R0.7 CCOCOCC(Cl)Cl Amb27859215 [0,1,0,0,0,0|2,0,0]=3 2267 B8R0.7 CCONCCC(C)F Amb27617250 [0,1,0,0,0,0|3,0,0]=4 2268 B8R0.7 CCSCCCB(O)O Amb24351131 [0,1,0,0,0,0|3,0,0]=4 2269 B8R0.7 CCSCCCC(=O)O Amb6680204 [0,1,0,0,0,0|2,0,1]=4 2270 B8R0.7 CCSCCCC(C)C Amb27588655 [0,1,0,0,0,0|3,0,0]=4 2271 B8R0.7 CCSCCCC(C)N Amb26049335 [0,1,0,0,0,0|3,0,0]=4 2272 B8R0.7 CCSCCCC(C)O Amb26319707 [0,1,0,0,0,0|2,0,0]=3 2273 B8R0.7 CCSCCC[C@@H](C)N Amb33323737 [0,1,0,0,0,0|3,0,0]=4 2274 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [0,1,0,0,0,0|2,0,0]=3 2275 B8R0.7 CCSCCC[C@H](C)N Amb33323735 [0,1,0,0,0,0|3,0,0]=4 2276 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [0,1,0,0,0,0|2,0,0]=3 2277 B8R0.7 CC\C=C\CCC(C)C Amb25811237 [0,1,0,0,0,0|2,0,1]=4 2278 B8R0.7 CC\C=C\CCC(C)N Amb27875423 [0,1,0,0,0,0|2,0,1]=4 2279 B8R0.7 CC\C=C\CCC(C)O Amb33079835 [0,1,0,0,0,0|1,0,2]=4 2280 B8R0.7 CC\C=C\CC[C@@H](C)N Amb33267990 [0,1,0,0,0,0|2,0,1]=4 2281 B8R0.7 CC\C=C\CC[C@@H](C)O Amb33267991 [0,1,0,0,0,0|1,0,2]=4 2282 B8R0.7 CC\C=C\CC[C@H](C)N Amb33267989 [0,1,0,0,0,0|2,0,1]=4 2283 B8R0.7 CC\C=C\CC[C@H](C)O Amb33267992 [0,1,0,0,0,0|1,0,2]=4 2284 B8R0.7 CN(C)CC#CCCO Amb27145796 [0,1,0,0,0,0|2,0,1]=4 2285 B8R0.7 CN(C)CCCCCBr Amb26490317 [0,1,0,0,0,0|3,0,0]=4 2286 B8R0.7 CN(C)CCCCCN Amb2721306 [0,1,0,0,0,0|3,0,0]=4 2287 B8R0.7 CN(C)CCCCCN Amb31291017 [0,1,0,0,0,0|3,0,0]=4 2288 B8R0.7 CN(C)CCCCCN Amb33800157 [0,1,0,0,0,0|3,0,0]=4 2289 B8R0.7 CN(C)CCCCCO Amb17334131 [0,1,0,0,0,0|2,0,0]=3 2290 B8R0.7 CN(C)CCCCCS Amb25730651 [0,1,0,0,0,0|2,1,0]=4 2291 B8R0.7 CN(C)CCNCCBr Amb534833 [0,1,0,0,0,0|3,0,0]=4 2292 B8R0.7 CN(C)CCNCCO Amb1017223 [0,1,0,0,0,0|2,0,0]=3 2293 B8R0.7 CN(C)CCOCCCl Amb20668192 [0,1,0,0,0,0|2,0,0]=3 2294 B8R0.7 CN(C)CCOCCN Amb33528887 [0,1,0,0,0,0|2,0,0]=3 2295 B8R0.7 CN(C)CCOCCN Amb34913197 [0,1,0,0,0,0|2,0,0]=3 2296 B8R0.7 CN(C)CCOCCO Amb8393255 [0,1,0,0,0,0|1,0,0]=2 2297 B8R0.7 CN(C)CCSCCN Amb6281250 [0,1,0,0,0,0|2,1,0]=4 2298 B8R0.7 CN(C)CCSCCO Amb9247586 [0,1,0,0,0,0|1,1,0]=3 2299 B8R0.7 CN(C)CC\C=C\CO Amb33272512 [0,1,0,0,0,0|2,0,1]=4 2300 B8R0.7 CN(C)NCCCCO Amb27635131 [0,1,0,0,0,0|3,0,0]=4 2301 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,1,0,0,0,0|2,0,1]=4 2302 B8R0.7 CNCCCCC(=O)O Amb24340485 [0,1,0,0,0,0|2,0,1]=4 2303 B8R0.7 CNCCCCC(C)C Amb25769955 [0,1,0,0,0,0|3,0,0]=4 2304 B8R0.7 CNCCCCC(C)O Amb17569923 [0,1,0,0,0,0|2,0,0]=3 2305 B8R0.7 CNCCNCC(F)F Amb27984517 [0,1,0,0,0,0|3,0,0]=4 2306 B8R0.7 CNCCOCC(=O)O Amb18630741 [0,1,0,0,0,0|1,0,1]=3 2307 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,1,0,0,0,0|1,0,2]=4 2308 B8R0.7 CNCCOCC(C)C Amb28283736 [0,1,0,0,0,0|2,0,0]=3 2309 B8R0.7 CNCCOCC(N)=O Amb27447982 [0,1,0,0,0,0|1,0,2]=4 2310 B8R0.7 CNCCSCC(C)N Amb27248798 [0,1,0,0,0,0|2,1,0]=4 2311 B8R0.7 COCCCCB(O)O Amb27230891 [0,1,0,0,0,0|3,0,0]=4 2312 B8R0.7 COCCCCC(=O)O Amb9207785 [0,1,0,0,0,0|2,0,1]=4 2313 B8R0.7 COCCCCC(C)N Amb17569945 [0,1,0,0,0,0|3,0,0]=4 2314 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|2,0,0]=3 2315 B8R0.7 COCCCC[C@@H](C)N Amb33377489 [0,1,0,0,0,0|3,0,0]=4 2316 B8R0.7 COCCCC[C@@H](C)O Amb33377490 [0,1,0,0,0,0|2,0,0]=3 2317 B8R0.7 COCCCC[C@H](C)N Amb33377488 [0,1,0,0,0,0|3,0,0]=4 2318 B8R0.7 COCCCC[C@H](C)O Amb33377491 [0,1,0,0,0,0|2,0,0]=3 2319 B8R0.7 COCCNCC(=O)O Amb19514667 [0,1,0,0,0,0|2,0,1]=4 2320 B8R0.7 COCCNCC(=O)O Amb7766415 [0,1,0,0,0,0|2,0,1]=4 2321 B8R0.7 COCCNCC(C)C Amb6685598 [0,1,0,0,0,0|3,0,0]=4 2322 B8R0.7 COCCNCC(Cl)Cl Amb27255715 [0,1,0,0,0,0|3,0,0]=4 2323 B8R0.7 COCCNCC(F)F Amb13952502 [0,1,0,0,0,0|3,0,0]=4 2324 B8R0.7 COCCNCC(F)F Amb16229893 [0,1,0,0,0,0|3,0,0]=4 2325 B8R0.7 COCCOCC(=O)O Amb2721259 [0,1,0,0,0,0|1,0,1]=3 2326 B8R0.7 COCCOCC(C)=O Amb9665444 [0,1,0,0,0,0|1,0,2]=4 2327 B8R0.7 COCCOCC(C)N Amb19375047 [0,1,0,0,0,0|2,0,0]=3 2328 B8R0.7 COCCOCC(C)N Amb6661949 [0,1,0,0,0,0|2,0,0]=3 2329 B8R0.7 COCCOCC(C)O Amb25939469 [0,1,0,0,0,0|1,0,0]=2 2330 B8R0.7 COCCOCC(O)O Amb27397097 [0,1,0,0,0,0|1,0,0]=2 2331 B8R0.7 COCCOC[C@@H](C)N Amb27862644 [0,1,0,0,0,0|2,0,0]=3 2332 B8R0.7 COCCSCC(=O)O Amb6245777 [0,1,0,0,0,0|1,1,1]=4 2333 B8R0.7 COCCSCC(C)C Amb27837668 [0,1,0,0,0,0|2,1,0]=4 2334 B8R0.7 COCCSCC(C)O Amb18179365 [0,1,0,0,0,0|1,1,0]=3 2335 B8R0.7 COCCSC[C@H](C)O Amb27977734 [0,1,0,0,0,0|1,1,0]=3 2336 B8R0.7 CS(=O)CCCCCCl Amb27173793 [0,1,0,0,0,0|3,0,0]=4 2337 B8R0.7 CS(=O)CCNCCCl Amb27222833 [0,1,0,0,0,0|3,0,0]=4 2338 B8R0.7 CS(=O)CCNCCF Amb28138817 [0,1,0,0,0,0|3,0,0]=4 2339 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,1,0,0,0,0|2,0,1]=4 2340 B8R0.7 CSCCCCC(C)N Amb27475432 [0,1,0,0,0,0|3,0,0]=4 2341 B8R0.7 CSCCCCC(C)O Amb27863049 [0,1,0,0,0,0|2,0,0]=3 2342 B8R0.7 CSCCCC[C@@H](C)N Amb33198290 [0,1,0,0,0,0|3,0,0]=4 2343 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [0,1,0,0,0,0|2,0,0]=3 2344 B8R0.7 CSCCCC[C@H](C)N Amb33198289 [0,1,0,0,0,0|3,0,0]=4 2345 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [0,1,0,0,0,0|2,0,0]=3 2346 B8R0.7 CSCCNCC(=O)O Amb24401934 [0,1,0,0,0,0|2,0,1]=4 2347 B8R0.7 CSCCNCC(=O)O Amb28934977 [0,1,0,0,0,0|2,0,1]=4 2348 B8R0.7 CSCCNCC(C)C Amb27452217 [0,1,0,0,0,0|3,0,0]=4 2349 B8R0.7 CSCCNC[C@@H](C)O Amb27785175 [0,1,0,0,0,0|2,0,0]=3 2350 B8R0.7 CSCCOCC(=O)O Amb27392229 [0,1,0,0,0,0|1,0,1]=3 2351 B8R0.7 CSCCSCC(=O)O Amb27964765 [0,1,0,0,0,0|1,1,1]=4 2352 B8R0.7 CSCCSCC(C)C Amb28454546 [0,1,0,0,0,0|2,1,0]=4 2353 B8R0.7 CSCCSC[C@@H](C)N Amb27861407 [0,1,0,0,0,0|2,1,0]=4 2354 B8R0.7 C[C@@H](N)CNCCCF Amb27956501 [0,1,0,0,0,0|3,0,0]=4 2355 B8R0.7 C[C@@H](O)CC#CCCO Amb27618252 [0,1,0,0,0,0|1,0,1]=3 2356 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [0,1,0,0,0,0|1,0,0]=2 2357 B8R0.7 C[C@H](O)CCCCC=O Amb27793108 [0,1,0,0,0,0|1,0,2]=4 2358 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,1,0,0,0,0|2,0,0]=3 2359 B8R0.7 C[SiH2]CCCCC(C)O Amb28049251 [0,1,0,0,0,0|1,1,0]=3 2360 B8R0.7 C\C(N)=N\CCCCO Amb28457978 [0,1,0,0,0,0|2,0,1]=4 2361 B8R0.7 FC(F)CCCCCBr Amb24459890 [0,1,0,0,0,0|3,0,0]=4 2362 B8R0.7 FC(F)CCCCCCl Amb32688145 [0,1,0,0,0,0|3,0,0]=4 2363 B8R0.7 FC(F)CNCCCBr Amb28123865 [0,1,0,0,0,0|3,0,0]=4 2364 B8R0.7 FC(F)CNCCCI Amb27480558 [0,1,0,0,0,0|3,0,0]=4 2365 B8R0.7 FCCCNCC(F)F Amb28137541 [0,1,0,0,0,0|3,0,0]=4 2366 B8R0.7 N#CCCOCC(F)F Amb22008448 [0,1,0,0,0,0|2,0,1]=4 2367 B8R0.7 N=C(N)CCCCCO Amb27447678 [0,1,0,0,0,0|2,0,1]=4 2368 B8R0.7 N=C(N)CCOCCO Amb6681748 [0,1,0,0,0,0|1,0,1]=3 2369 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,1,0,0,0,0|2,0,1]=4 2370 B8R0.7 NC(=O)CCNCCO Amb4303499 [0,1,0,0,0,0|2,0,1]=4 2371 B8R0.7 NC(=O)CCOCCO Amb28289325 [0,1,0,0,0,0|1,0,1]=3 2372 B8R0.7 NC(=S)CCOCCO Amb6681260 [0,1,0,0,0,0|1,0,1]=3 2373 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,1,0,0,0,0|2,0,1]=4 2374 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,1,0,0,0,0|2,0,1]=4 2375 B8R0.7 NCCCNCC(Cl)Cl Amb27844026 [0,1,0,0,0,0|3,0,0]=4 2376 B8R0.7 NCCCNCC(F)F Amb28120763 [0,1,0,0,0,0|3,0,0]=4 2377 B8R0.7 NCCCOCC(=O)O Amb18111435 [0,1,0,0,0,0|1,0,1]=3 2378 B8R0.7 NCCCOCC(=O)O Amb31217489 [0,1,0,0,0,0|1,0,1]=3 2379 B8R0.7 NCCCOCC(F)F Amb20669153 [0,1,0,0,0,0|2,0,0]=3 2380 B8R0.7 NCCCOCC(F)F Amb25855538 [0,1,0,0,0,0|2,0,0]=3 2381 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,1,0,0,0,0|1,1,1]=4 2382 B8R0.7 NCCOCCC(=O)O Amb18630461 [0,1,0,0,0,0|2,0,1]=4 2383 B8R0.7 NCCOCCC(=O)O Amb33330744 [0,1,0,0,0,0|2,0,1]=4 2384 B8R0.7 NCCOCCC(N)=O Amb27751130 [0,1,0,0,0,0|2,0,1]=4 2385 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [0,1,0,0,0,0|2,0,1]=4 2386 B8R0.7 O=C(Cl)CCOCCCl Amb27966437 [0,1,0,0,0,0|2,0,1]=4 2387 B8R0.7 O=C(O)CCCCCBr Amb2081955 [0,1,0,0,0,0|2,0,1]=4 2388 B8R0.7 O=C(O)CCCCCCl Amb18796646 [0,1,0,0,0,0|2,0,1]=4 2389 B8R0.7 O=C(O)CCCCCF Amb26063796 [0,1,0,0,0,0|2,0,1]=4 2390 B8R0.7 O=C(O)CCCCCI Amb22736492 [0,1,0,0,0,0|2,0,1]=4 2391 B8R0.7 O=C(O)CCCCCO Amb8515991 [0,1,0,0,0,0|2,0,1]=4 2392 B8R0.7 O=C(O)CCNCCO Amb1110010 [0,1,0,0,0,0|2,0,1]=4 2393 B8R0.7 O=C(O)CCOCCBr Amb24057757 [0,1,0,0,0,0|2,0,1]=4 2394 B8R0.7 O=C(O)CCOCCF Amb27807548 [0,1,0,0,0,0|2,0,1]=4 2395 B8R0.7 O=C(O)CCOCCO Amb6680916 [0,1,0,0,0,0|1,0,1]=3 2396 B8R0.7 O=C(O)CCOCCS Amb27226892 [0,1,0,0,0,0|1,1,1]=4 2397 B8R0.7 O=C(O)CNCCCCl Amb28055692 [0,1,0,0,0,0|2,0,1]=4 2398 B8R0.7 O=C(O)CNCCCF Amb27649256 [0,1,0,0,0,0|2,0,1]=4 2399 B8R0.7 O=C(O)CNCCCO Amb9325805 [0,1,0,0,0,0|2,0,1]=4 2400 B8R0.7 O=C(O)COCCCO Amb28288633 [0,1,0,0,0,0|1,0,1]=3 2401 B8R0.7 O=C([O-])CCCCCO Amb22491268 [0,1,0,0,0,0|2,0,1]=4 2402 B8R0.7 O=CCCCCC(O)O Amb28285175 [0,1,0,0,0,0|2,0,1]=4 2403 B8R0.7 O=CCCOCC(F)F Amb25997333 [0,1,0,0,0,0|2,0,1]=4 2404 B8R0.7 O=S([O-])CCCCCO Amb27394866 [0,1,0,0,0,0|3,0,0]=4 2405 B8R0.7 O=[N+]([O-])CCCCCO Amb25911225 [0,1,0,0,0,0|3,0,0]=4 2406 B8R0.7 O=[N+]([O-])CCSCCO Amb28045665 [0,1,0,0,0,0|2,1,0]=4 2407 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,1,0,0,0,0|3,0,0]=4 2408 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,1,0,0,0,0|3,0,0]=4 2409 B8R0.7 OCCCCCB(O)O Amb27614305 [0,1,0,0,0,0|3,0,0]=4 2410 B8R0.7 OCCCOCC(F)F Amb26407194 [0,1,0,0,0,0|2,0,0]=3 2411 B8R0.7 OCCSCCB(O)O Amb27593951 [0,1,0,0,0,0|2,1,0]=4 2412 B8R0.7 [C-]#[N+]CCCCC(C)C Amb27963247 [0,1,0,0,0,0|3,0,0]=4 2413 B8R1.2 BrCC1=CCCCC1 Amb23439167 [0,0,0,1,0,0|2,0,1]=4 2414 B8R1.2 BrCC1=COCCO1 Amb29866238 [0,0,0,1,0,0|1,0,2]=4 2415 B8R1.2 BrCC1=NOCCO1 Amb27984826 [0,0,0,1,0,0|2,0,1]=4 2416 B8R1.2 BrCC1C=CCCC1 Amb25869978 [0,0,0,1,0,0|2,0,1]=4 2417 B8R1.2 BrCC1CC=CCO1 Amb27985852 [0,0,0,1,0,0|1,0,2]=4 2418 B8R1.2 BrCC1CCCCC1 Amb3940090 [0,0,0,1,0,0|2,0,0]=3 2419 B8R1.2 BrCC1CCCCN1 Amb18128036 [0,0,0,1,0,0|2,0,0]=3 2420 B8R1.2 BrCC1CCCCN1 Amb20171159 [0,0,0,1,0,0|2,0,0]=3 2421 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,0,0,1,0,0|1,0,0]=2 2422 B8R1.2 BrCC1CCCNC1 Amb22229216 [0,0,0,1,0,0|3,0,0]=4 2423 B8R1.2 BrCC1CCCNC1 Amb6316208 [0,0,0,1,0,0|3,0,0]=4 2424 B8R1.2 BrCC1CCCOC1 Amb18178619 [0,0,0,1,0,0|2,0,0]=3 2425 B8R1.2 BrCC1CCCSC1 Amb28206709 [0,0,0,1,0,0|2,1,0]=4 2426 B8R1.2 BrCC1CCNCC1 Amb17935872 [0,0,0,1,0,0|3,0,0]=4 2427 B8R1.2 BrCC1CCNCC1 Amb19516018 [0,0,0,1,0,0|3,0,0]=4 2428 B8R1.2 BrCC1CCNCC1 Amb8631527 [0,0,0,1,0,0|3,0,0]=4 2429 B8R1.2 BrCC1CCOCC1 Amb2684131 [0,0,0,1,0,0|3,0,0]=4 2430 B8R1.2 BrCC1CCOCO1 Amb28382346 [0,0,0,1,0,0|2,0,0]=3 2431 B8R1.2 BrCC1CCSCC1 Amb22011704 [0,0,0,1,0,0|3,0,0]=4 2432 B8R1.2 BrCC1CNCCN1 Amb22228149 [0,0,0,1,0,0|3,0,0]=4 2433 B8R1.2 BrCC1CNCCO1 Amb28205537 [0,0,0,1,0,0|2,0,0]=3 2434 B8R1.2 BrCC1CNCCO1 Amb32652610 [0,0,0,1,0,0|2,0,0]=3 2435 B8R1.2 BrCC1COCCN1 Amb27603516 [0,0,0,1,0,0|2,0,0]=3 2436 B8R1.2 BrCC1COCCO1 Amb18796390 [0,0,0,1,0,0|1,0,0]=2 2437 B8R1.2 BrCC1COCOC1 Amb25701384 [0,0,0,1,0,0|3,0,0]=4 2438 B8R1.2 BrCC1OCCCO1 Amb10576216 [0,0,0,1,0,0|2,0,0]=3 2439 B8R1.2 BrCN1CCCCC1 Amb27831216 [0,0,0,1,0,0|3,0,0]=4 2440 B8R1.2 BrC[C@@H]1CCCCO1 Amb27793586 [0,0,0,1,0,0|1,0,0]=2 2441 B8R1.2 Br[Mg]C1CCCCC1 Amb19944556 [0,0,0,1,0,0|3,0,0]=4 2442 B8R1.2 C#CC1CCCCC1 Amb8517385 [0,0,0,1,0,0|2,0,1]=4 2443 B8R1.2 C#CC1CCCCN1 Amb22170138 [0,0,0,1,0,0|2,0,1]=4 2444 B8R1.2 C#CC1CCCCN1 Amb22228818 [0,0,0,1,0,0|2,0,1]=4 2445 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,0,0,1,0,0|1,0,1]=3 2446 B8R1.2 C#CC1CCCCS1 Amb33169139 [0,0,0,1,0,0|1,1,1]=4 2447 B8R1.2 C#CC1CCCOC1 Amb33547093 [0,0,0,1,0,0|1,0,2]=4 2448 B8R1.2 C#CC1CNCCO1 Amb33169103 [0,0,0,1,0,0|1,0,2]=4 2449 B8R1.2 C#CC1COCCN1 Amb24692089 [0,0,0,1,0,0|1,0,2]=4 2450 B8R1.2 C#CC1COCCN1 Amb28820612 [0,0,0,1,0,0|1,0,2]=4 2451 B8R1.2 C#C[C@H]1CCCCN1 Amb27445453 [0,0,0,1,0,0|2,0,1]=4 2452 B8R1.2 C=CC1CCCCC1 Amb8513441 [0,0,0,1,0,0|2,0,1]=4 2453 B8R1.2 C=CC1CCCCN1 Amb33551305 [0,0,0,1,0,0|2,0,1]=4 2454 B8R1.2 C=CC1CCCCN1 Amb6740273 [0,0,0,1,0,0|2,0,1]=4 2455 B8R1.2 C=CC1CCCCO1 Amb35672708 [0,0,0,1,0,0|1,0,1]=3 2456 B8R1.2 C=CC1CCCOC1 Amb25100920 [0,0,0,1,0,0|1,0,2]=4 2457 B8R1.2 C=CC1OCCCO1 Amb24725153 [0,0,0,1,0,0|2,0,1]=4 2458 B8R1.2 C=C[C@H]1COCCN1 Amb28315874 [0,0,0,1,0,0|1,0,2]=4 2459 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,0,0,1,0,0|2,0,1]=4 2460 B8R1.2 CCC1C=CCCC1 Amb27883191 [0,0,0,1,0,0|2,0,1]=4 2461 B8R1.2 CCC1CCCCC1 Amb6296025 [0,0,0,1,0,0|2,0,0]=3 2462 B8R1.2 CCC1CCCCN1 Amb10683459 [0,0,0,1,0,0|2,0,0]=3 2463 B8R1.2 CCC1CCCCN1 Amb5716839 [0,0,0,1,0,0|2,0,0]=3 2464 B8R1.2 CCC1CCCCO1 Amb2703732 [0,0,0,1,0,0|1,0,0]=2 2465 B8R1.2 CCC1CCCNC1 Amb19516506 [0,0,0,1,0,0|2,0,0]=3 2466 B8R1.2 CCC1CCCNC1 Amb7969496 [0,0,0,1,0,0|2,0,0]=3 2467 B8R1.2 CCC1CCNCC1 Amb17760296 [0,0,0,1,0,0|3,0,0]=4 2468 B8R1.2 CCC1CCNCC1 Amb19272296 [0,0,0,1,0,0|3,0,0]=4 2469 B8R1.2 CCC1CNCCN1 Amb10606910 [0,0,0,1,0,0|2,0,0]=3 2470 B8R1.2 CCC1CNCCN1 Amb20240995 [0,0,0,1,0,0|2,0,0]=3 2471 B8R1.2 CCC1CNCCN1 Amb6307247 [0,0,0,1,0,0|2,0,0]=3 2472 B8R1.2 CCC1CNCCO1 Amb13951287 [0,0,0,1,0,0|1,0,0]=2 2473 B8R1.2 CCC1CNCCO1 Amb6892218 [0,0,0,1,0,0|1,0,0]=2 2474 B8R1.2 CCC1CNCCS1 Amb19149092 [0,0,0,1,0,0|1,1,0]=3 2475 B8R1.2 CCC1COCCN1 Amb21864708 [0,0,0,1,0,0|1,0,0]=2 2476 B8R1.2 CCC1COCCN1 Amb22492291 [0,0,0,1,0,0|1,0,0]=2 2477 B8R1.2 CCC1COCCN1 Amb9028259 [0,0,0,1,0,0|1,0,0]=2 2478 B8R1.2 CCC1CSCCN1 Amb18124338 [0,0,0,1,0,0|1,1,0]=3 2479 B8R1.2 CCC1NCCCN1 Amb24445855 [0,0,0,1,0,0|3,0,0]=4 2480 B8R1.2 CCC1NCCCO1 Amb17506192 [0,0,0,1,0,0|2,0,0]=3 2481 B8R1.2 CCN1CCCCC1 Amb8387388 [0,0,0,1,0,0|3,0,0]=4 2482 B8R1.2 CCN1CCCCN1 Amb27473714 [0,0,0,1,0,0|3,0,0]=4 2483 B8R1.2 CCN1CCCNC1 Amb18641821 [0,0,0,1,0,0|3,0,0]=4 2484 B8R1.2 CC[C@@H]1CCCCN1 Amb22892832 [0,0,0,1,0,0|2,0,0]=3 2485 B8R1.2 CC[C@@H]1CCCNC1 Amb27166756 [0,0,0,1,0,0|2,0,0]=3 2486 B8R1.2 CC[C@@H]1CNCCN1 Amb15690747 [0,0,0,1,0,0|2,0,0]=3 2487 B8R1.2 CC[C@@H]1CNCCN1 Amb6307246 [0,0,0,1,0,0|2,0,0]=3 2488 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,0,0,1,0,0|1,0,0]=2 2489 B8R1.2 CC[C@@H]1CNCCO1 Amb34144519 [0,0,0,1,0,0|1,0,0]=2 2490 B8R1.2 CC[C@@H]1COCCN1 Amb20242298 [0,0,0,1,0,0|1,0,0]=2 2491 B8R1.2 CC[C@@H]1COCCN1 Amb20242895 [0,0,0,1,0,0|1,0,0]=2 2492 B8R1.2 CC[C@@H]1CSCCN1 Amb27201741 [0,0,0,1,0,0|1,1,0]=3 2493 B8R1.2 CC[C@H]1CCCCN1 Amb20241520 [0,0,0,1,0,0|2,0,0]=3 2494 B8R1.2 CC[C@H]1CCCNC1 Amb27872130 [0,0,0,1,0,0|2,0,0]=3 2495 B8R1.2 CC[C@H]1CNCCN1 Amb20671343 [0,0,0,1,0,0|2,0,0]=3 2496 B8R1.2 CC[C@H]1CNCCN1 Amb8384867 [0,0,0,1,0,0|2,0,0]=3 2497 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,0,0,1,0,0|1,0,0]=2 2498 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,0,0,1,0,0|1,0,0]=2 2499 B8R1.2 CC[C@H]1COCCN1 Amb19516643 [0,0,0,1,0,0|1,0,0]=2 2500 B8R1.2 CC[C@H]1COCCN1 Amb22226455 [0,0,0,1,0,0|1,0,0]=2 2501 B8R1.2 CC[C@H]1CSCCN1 Amb27861044 [0,0,0,1,0,0|1,1,0]=3 2502 B8R1.2 CNC1CCCCC1 Amb2720339 [0,0,0,1,0,0|3,0,0]=4 2503 B8R1.2 CNC1CCCCO1 Amb26068497 [0,0,0,1,0,0|2,0,0]=3 2504 B8R1.2 CNC1CCCNC1 Amb18276901 [0,0,0,1,0,0|3,0,0]=4 2505 B8R1.2 CNC1CCCNC1 Amb8390243 [0,0,0,1,0,0|3,0,0]=4 2506 B8R1.2 CNC1CCCOC1 Amb18641845 [0,0,0,1,0,0|2,0,0]=3 2507 B8R1.2 CNC1CCCSC1 Amb18948508 [0,0,0,1,0,0|2,1,0]=4 2508 B8R1.2 CNC1CCCSC1 Amb24271087 [0,0,0,1,0,0|2,1,0]=4 2509 B8R1.2 CN[C@H]1CCCNC1 Amb24744577 [0,0,0,1,0,0|3,0,0]=4 2510 B8R1.2 CN[C@H]1CCCNC1 Amb32671254 [0,0,0,1,0,0|3,0,0]=4 2511 B8R1.2 CN[C@H]1CCCOC1 Amb26014588 [0,0,0,1,0,0|2,0,0]=3 2512 B8R1.2 COC1=NCCOC1 Amb25304653 [0,0,0,1,0,0|2,0,1]=4 2513 B8R1.2 COC1C=CCCO1 Amb27443733 [0,0,0,1,0,0|2,0,1]=4 2514 B8R1.2 COC1CCCCC1 Amb4035423 [0,0,0,1,0,0|3,0,0]=4 2515 B8R1.2 COC1CCCCN1 Amb24384593 [0,0,0,1,0,0|3,0,0]=4 2516 B8R1.2 COC1CCCCO1 Amb21955138 [0,0,0,1,0,0|2,0,0]=3 2517 B8R1.2 COC1CCCNC1 Amb22586710 [0,0,0,1,0,0|3,0,0]=4 2518 B8R1.2 COC1CCCNC1 Amb33528076 [0,0,0,1,0,0|3,0,0]=4 2519 B8R1.2 COC1CCCNC1 Amb9752773 [0,0,0,1,0,0|3,0,0]=4 2520 B8R1.2 COC1CNCCO1 Amb20669241 [0,0,0,1,0,0|2,0,0]=3 2521 B8R1.2 CO[C@@H]1CCCNC1 Amb22225358 [0,0,0,1,0,0|3,0,0]=4 2522 B8R1.2 CO[C@@H]1CCCNC1 Amb31204718 [0,0,0,1,0,0|3,0,0]=4 2523 B8R1.2 CO[C@H]1CCCNC1 Amb22226700 [0,0,0,1,0,0|3,0,0]=4 2524 B8R1.2 CO[C@H]1CCCNC1 Amb22756499 [0,0,0,1,0,0|3,0,0]=4 2525 B8R1.2 CSC1CCCNC1 Amb33801787 [0,0,0,1,0,0|3,0,0]=4 2526 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,0,0,1,0,0|1,0,2]=4 2527 B8R1.2 ClCC1=COCCO1 Amb28199866 [0,0,0,1,0,0|1,0,2]=4 2528 B8R1.2 ClCC1C=CCCC1 Amb17672830 [0,0,0,1,0,0|2,0,1]=4 2529 B8R1.2 ClCC1CC=CCO1 Amb27494302 [0,0,0,1,0,0|1,0,2]=4 2530 B8R1.2 ClCC1CCCCC1 Amb6717235 [0,0,0,1,0,0|2,0,0]=3 2531 B8R1.2 ClCC1CCCCN1 Amb18124395 [0,0,0,1,0,0|2,0,0]=3 2532 B8R1.2 ClCC1CCCCN1 Amb4021742 [0,0,0,1,0,0|2,0,0]=3 2533 B8R1.2 ClCC1CCCCO1 Amb2723692 [0,0,0,1,0,0|1,0,0]=2 2534 B8R1.2 ClCC1CCCNC1 Amb20618020 [0,0,0,1,0,0|3,0,0]=4 2535 B8R1.2 ClCC1CCCNC1 Amb22229227 [0,0,0,1,0,0|3,0,0]=4 2536 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,0,0,1,0,0|2,0,0]=3 2537 B8R1.2 ClCC1CCCSC1 Amb33223993 [0,0,0,1,0,0|2,1,0]=4 2538 B8R1.2 ClCC1CCNCC1 Amb20618009 [0,0,0,1,0,0|3,0,0]=4 2539 B8R1.2 ClCC1CCNCC1 Amb22229730 [0,0,0,1,0,0|3,0,0]=4 2540 B8R1.2 ClCC1CCOCC1 Amb33530364 [0,0,0,1,0,0|3,0,0]=4 2541 B8R1.2 ClCC1CCOCO1 Amb386984 [0,0,0,1,0,0|2,0,0]=3 2542 B8R1.2 ClCC1CCSCC1 Amb35694770 [0,0,0,1,0,0|3,0,0]=4 2543 B8R1.2 ClCC1CNCCO1 Amb20668892 [0,0,0,1,0,0|2,0,0]=3 2544 B8R1.2 ClCC1CNCCO1 Amb26509697 [0,0,0,1,0,0|2,0,0]=3 2545 B8R1.2 ClCC1COCCO1 Amb6600554 [0,0,0,1,0,0|1,0,0]=2 2546 B8R1.2 ClCC1CSCCN1 Amb27444300 [0,0,0,1,0,0|2,1,0]=4 2547 B8R1.2 ClCC1CSCCS1 Amb27656405 [0,0,0,1,0,0|1,2,0]=4 2548 B8R1.2 ClCC1OCCCO1 Amb4035387 [0,0,0,1,0,0|2,0,0]=3 2549 B8R1.2 ClCC1SCCCS1 Amb27235460 [0,0,0,1,0,0|2,1,0]=4 2550 B8R1.2 ClC[C@H]1CCCCO1 Amb27879106 [0,0,0,1,0,0|1,0,0]=2 2551 B8R1.2 ClC[C@H]1CNCCO1 Amb27642085 [0,0,0,1,0,0|2,0,0]=3 2552 B8R1.2 ClNC1CCCCC1 Amb28048682 [0,0,0,1,0,0|3,0,0]=4 2553 B8R1.2 FCC1CCCCN1 Amb13953138 [0,0,0,1,0,0|2,0,0]=3 2554 B8R1.2 FCC1CCCCN1 Amb21960708 [0,0,0,1,0,0|2,0,0]=3 2555 B8R1.2 FCC1CCCNC1 Amb13885420 [0,0,0,1,0,0|3,0,0]=4 2556 B8R1.2 FCC1CCCNC1 Amb13889108 [0,0,0,1,0,0|3,0,0]=4 2557 B8R1.2 FCC1CCNCC1 Amb13885415 [0,0,0,1,0,0|3,0,0]=4 2558 B8R1.2 FCC1CCNCC1 Amb21960845 [0,0,0,1,0,0|3,0,0]=4 2559 B8R1.2 FCC1CNCCN1 Amb27838361 [0,0,0,1,0,0|3,0,0]=4 2560 B8R1.2 FCC1CNCCO1 Amb27806605 [0,0,0,1,0,0|2,0,0]=3 2561 B8R1.2 FCC1CNCCO1 Amb28934920 [0,0,0,1,0,0|2,0,0]=3 2562 B8R1.2 FCC1COCCN1 Amb27394167 [0,0,0,1,0,0|2,0,0]=3 2563 B8R1.2 FC[C@@H]1CCCCN1 Amb23439341 [0,0,0,1,0,0|2,0,0]=3 2564 B8R1.2 FC[C@@H]1COCCN1 Amb28397564 [0,0,0,1,0,0|2,0,0]=3 2565 B8R1.2 FC[C@H]1CCCCN1 Amb27225654 [0,0,0,1,0,0|2,0,0]=3 2566 B8R1.2 FC[C@H]1CNCCN1 Amb27468704 [0,0,0,1,0,0|3,0,0]=4 2567 B8R1.2 FC[C@H]1COCCN1 Amb27413301 [0,0,0,1,0,0|2,0,0]=3 2568 B8R1.2 ICC1CCCCC1 Amb22263046 [0,0,0,1,0,0|2,0,0]=3 2569 B8R1.2 ICC1CCCCN1 Amb22228857 [0,0,0,1,0,0|2,0,0]=3 2570 B8R1.2 ICC1CCCCO1 Amb24060887 [0,0,0,1,0,0|1,0,0]=2 2571 B8R1.2 ICC1CCNCC1 Amb21860434 [0,0,0,1,0,0|3,0,0]=4 2572 B8R1.2 ICC1CCNCC1 Amb22229802 [0,0,0,1,0,0|3,0,0]=4 2573 B8R1.2 ICC1CCNCC1 Amb33299469 [0,0,0,1,0,0|3,0,0]=4 2574 B8R1.2 ICC1CCOCC1 Amb2723455 [0,0,0,1,0,0|3,0,0]=4 2575 B8R1.2 ICC1CCOCO1 Amb19373646 [0,0,0,1,0,0|2,0,0]=3 2576 B8R1.2 ICC1COCCO1 Amb24061260 [0,0,0,1,0,0|1,0,0]=2 2577 B8R1.2 N#CC1CCCCC1 Amb2721190 [0,0,0,1,0,0|2,0,1]=4 2578 B8R1.2 N#CC1CCCCC1 Amb33512936 [0,0,0,1,0,0|2,0,1]=4 2579 B8R1.2 N#CC1CCCCN1 Amb1160385 [0,0,0,1,0,0|2,0,1]=4 2580 B8R1.2 N#CC1CCCCN1 Amb21964343 [0,0,0,1,0,0|2,0,1]=4 2581 B8R1.2 N#CC1CCCCN1 Amb23439300 [0,0,0,1,0,0|2,0,1]=4 2582 B8R1.2 N#CC1CCCCO1 Amb26630839 [0,0,0,1,0,0|1,0,1]=3 2583 B8R1.2 N#CC1CCCCS1 Amb24483258 [0,0,0,1,0,0|1,1,1]=4 2584 B8R1.2 N#CC1CCCOC1 Amb19148306 [0,0,0,1,0,0|2,0,1]=4 2585 B8R1.2 N#CC1CNCCO1 Amb10604011 [0,0,0,1,0,0|2,0,1]=4 2586 B8R1.2 N#CC1CNCCO1 Amb19373292 [0,0,0,1,0,0|2,0,1]=4 2587 B8R1.2 N#CC1COCCN1 Amb18124242 [0,0,0,1,0,0|2,0,1]=4 2588 B8R1.2 N#CC1COCCO1 Amb22002145 [0,0,0,1,0,0|1,0,1]=3 2589 B8R1.2 N#CC1CSCCO1 Amb20622840 [0,0,0,1,0,0|1,1,1]=4 2590 B8R1.2 N#C[C@@H]1CCCCN1 Amb23439301 [0,0,0,1,0,0|2,0,1]=4 2591 B8R1.2 N#C[C@@H]1CCCCN1 Amb31308044 [0,0,0,1,0,0|2,0,1]=4 2592 B8R1.2 N#C[C@@H]1CCCCN1 Amb8383547 [0,0,0,1,0,0|2,0,1]=4 2593 B8R1.2 N#C[C@@H]1CNCCO1 Amb33801913 [0,0,0,1,0,0|2,0,1]=4 2594 B8R1.2 N#C[C@@H]1COCCN1 Amb27875393 [0,0,0,1,0,0|2,0,1]=4 2595 B8R1.2 N#C[C@H]1CCCCN1 Amb26582583 [0,0,0,1,0,0|2,0,1]=4 2596 B8R1.2 N#C[C@H]1CCCCN1 Amb33806066 [0,0,0,1,0,0|2,0,1]=4 2597 B8R1.2 N#C[C@H]1CNCCO1 Amb27445442 [0,0,0,1,0,0|2,0,1]=4 2598 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,0,0,1,0,0|2,0,1]=4 2599 B8R1.2 NCC1=CCCCC1 Amb22587029 [0,0,0,1,0,0|2,0,1]=4 2600 B8R1.2 NCC1=CCCCO1 Amb33457505 [0,0,0,1,0,0|1,0,2]=4 2601 B8R1.2 NCC1=CCCCO1 Amb8009853 [0,0,0,1,0,0|1,0,2]=4 2602 B8R1.2 NCC1=CCCOC1 Amb24329061 [0,0,0,1,0,0|2,0,1]=4 2603 B8R1.2 NCC1=CCCOC1 Amb28934826 [0,0,0,1,0,0|2,0,1]=4 2604 B8R1.2 NCC1=COCCO1 Amb9677510 [0,0,0,1,0,0|1,0,2]=4 2605 B8R1.2 NCC1C=CCCC1 Amb18641664 [0,0,0,1,0,0|2,0,1]=4 2606 B8R1.2 NCC1CC=CCO1 Amb33457361 [0,0,0,1,0,0|1,0,2]=4 2607 B8R1.2 NCC1CC=CCO1 Amb33457362 [0,0,0,1,0,0|1,0,2]=4 2608 B8R1.2 NCC1CCC=CO1 Amb16233709 [0,0,0,1,0,0|1,0,2]=4 2609 B8R1.2 NCC1CCCCC1 Amb1158677 [0,0,0,1,0,0|2,0,0]=3 2610 B8R1.2 NCC1CCCCN1 Amb21964855 [0,0,0,1,0,0|2,0,0]=3 2611 B8R1.2 NCC1CCCCN1 Amb8385684 [0,0,0,1,0,0|2,0,0]=3 2612 B8R1.2 NCC1CCCCO1 Amb19372867 [0,0,0,1,0,0|1,0,0]=2 2613 B8R1.2 NCC1CCCCO1 Amb2723691 [0,0,0,1,0,0|1,0,0]=2 2614 B8R1.2 NCC1CCCCS1 Amb24443454 [0,0,0,1,0,0|1,1,0]=3 2615 B8R1.2 NCC1CCCNC1 Amb8393087 [0,0,0,1,0,0|3,0,0]=4 2616 B8R1.2 NCC1CCCNC1 Amb8631270 [0,0,0,1,0,0|3,0,0]=4 2617 B8R1.2 NCC1CCCOC1 Amb10603286 [0,0,0,1,0,0|2,0,0]=3 2618 B8R1.2 NCC1CCCOC1 Amb1092537 [0,0,0,1,0,0|2,0,0]=3 2619 B8R1.2 NCC1CCCOC1 Amb22492350 [0,0,0,1,0,0|2,0,0]=3 2620 B8R1.2 NCC1CCCSC1 Amb18831922 [0,0,0,1,0,0|2,1,0]=4 2621 B8R1.2 NCC1CCNCC1 Amb2684474 [0,0,0,1,0,0|3,0,0]=4 2622 B8R1.2 NCC1CCOCC1 Amb1099138 [0,0,0,1,0,0|3,0,0]=4 2623 B8R1.2 NCC1CCOCC1 Amb33534332 [0,0,0,1,0,0|3,0,0]=4 2624 B8R1.2 NCC1CCOCO1 Amb20669541 [0,0,0,1,0,0|2,0,0]=3 2625 B8R1.2 NCC1CCOCO1 Amb22157235 [0,0,0,1,0,0|2,0,0]=3 2626 B8R1.2 NCC1CCSCC1 Amb18279249 [0,0,0,1,0,0|3,0,0]=4 2627 B8R1.2 NCC1CCSCC1 Amb6572257 [0,0,0,1,0,0|3,0,0]=4 2628 B8R1.2 NCC1CNCCN1 Amb22489613 [0,0,0,1,0,0|3,0,0]=4 2629 B8R1.2 NCC1CNCCO1 Amb33538849 [0,0,0,1,0,0|2,0,0]=3 2630 B8R1.2 NCC1CNCCO1 Amb34912956 [0,0,0,1,0,0|2,0,0]=3 2631 B8R1.2 NCC1COCCN1 Amb20670555 [0,0,0,1,0,0|2,0,0]=3 2632 B8R1.2 NCC1COCCN1 Amb22898761 [0,0,0,1,0,0|2,0,0]=3 2633 B8R1.2 NCC1COCCO1 Amb1087841 [0,0,0,1,0,0|1,0,0]=2 2634 B8R1.2 NCC1COCCO1 Amb8503476 [0,0,0,1,0,0|1,0,0]=2 2635 B8R1.2 NCC1COCOC1 Amb27489393 [0,0,0,1,0,0|3,0,0]=4 2636 B8R1.2 NCC1CSCCN1 Amb33532858 [0,0,0,1,0,0|2,1,0]=4 2637 B8R1.2 NCC1CSCCO1 Amb27852369 [0,0,0,1,0,0|1,1,0]=3 2638 B8R1.2 NCC1CSCCS1 Amb20667611 [0,0,0,1,0,0|1,2,0]=4 2639 B8R1.2 NCC1OCCCO1 Amb17226711 [0,0,0,1,0,0|2,0,0]=3 2640 B8R1.2 NCC1SCCCS1 Amb27655686 [0,0,0,1,0,0|2,1,0]=4 2641 B8R1.2 NCN1CCCCC1 Amb27170318 [0,0,0,1,0,0|3,0,0]=4 2642 B8R1.2 NC[C@@H]1CCCCN1 Amb24674195 [0,0,0,1,0,0|2,0,0]=3 2643 B8R1.2 NC[C@@H]1CCCCN1 Amb32660589 [0,0,0,1,0,0|2,0,0]=3 2644 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,0,0,1,0,0|1,0,0]=2 2645 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,0,0,1,0,0|1,0,0]=2 2646 B8R1.2 NC[C@@H]1CCCCS1 Amb27469696 [0,0,0,1,0,0|1,1,0]=3 2647 B8R1.2 NC[C@@H]1CCCNC1 Amb2699508 [0,0,0,1,0,0|3,0,0]=4 2648 B8R1.2 NC[C@@H]1CCCOC1 Amb25849361 [0,0,0,1,0,0|2,0,0]=3 2649 B8R1.2 NC[C@@H]1CCCOC1 Amb31028901 [0,0,0,1,0,0|2,0,0]=3 2650 B8R1.2 NC[C@@H]1COCCO1 Amb22406261 [0,0,0,1,0,0|1,0,0]=2 2651 B8R1.2 NC[C@@H]1COCCO1 Amb24704288 [0,0,0,1,0,0|1,0,0]=2 2652 B8R1.2 NC[C@H]1CCCCN1 Amb24434930 [0,0,0,1,0,0|2,0,0]=3 2653 B8R1.2 NC[C@H]1CCCCN1 Amb32657137 [0,0,0,1,0,0|2,0,0]=3 2654 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,0,0,1,0,0|1,0,0]=2 2655 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,0,0,1,0,0|1,0,0]=2 2656 B8R1.2 NC[C@H]1CCCNC1 Amb2699507 [0,0,0,1,0,0|3,0,0]=4 2657 B8R1.2 NC[C@H]1CCCNC1 Amb32660927 [0,0,0,1,0,0|3,0,0]=4 2658 B8R1.2 NC[C@H]1CCCOC1 Amb24483141 [0,0,0,1,0,0|2,0,0]=3 2659 B8R1.2 NC[C@H]1CCCOC1 Amb31028900 [0,0,0,1,0,0|2,0,0]=3 2660 B8R1.2 NC[C@H]1CNCCO1 Amb25197821 [0,0,0,1,0,0|2,0,0]=3 2661 B8R1.2 NC[C@H]1COCCO1 Amb22406262 [0,0,0,1,0,0|1,0,0]=2 2662 B8R1.2 NC[C@H]1COCCO1 Amb24686998 [0,0,0,1,0,0|1,0,0]=2 2663 B8R1.2 NNC1CCCCC1 Amb10071075 [0,0,0,1,0,0|3,0,0]=4 2664 B8R1.2 NNC1CCCCC1 Amb10808130 [0,0,0,1,0,0|3,0,0]=4 2665 B8R1.2 NNC1CCCCC1 Amb6244749 [0,0,0,1,0,0|3,0,0]=4 2666 B8R1.2 NNC1CCCOC1 Amb23412249 [0,0,0,1,0,0|3,0,0]=4 2667 B8R1.2 NNC1CCCOC1 Amb23412255 [0,0,0,1,0,0|3,0,0]=4 2668 B8R1.2 NOC1CCCCC1 Amb18641839 [0,0,0,1,0,0|3,0,0]=4 2669 B8R1.2 NOC1CCCCO1 Amb10975936 [0,0,0,1,0,0|2,0,0]=3 2670 B8R1.2 NOC1CCCOC1 Amb28134643 [0,0,0,1,0,0|3,0,0]=4 2671 B8R1.2 O=CC1CCCCC1 Amb3939850 [0,0,0,1,0,0|1,0,2]=4 2672 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,0,0,1,0,0|1,0,2]=4 2673 B8R1.2 O=CC1CCCCN1 Amb8384317 [0,0,0,1,0,0|1,0,2]=4 2674 B8R1.2 O=CC1CCCCO1 Amb8009759 [0,0,0,1,0,0|0,0,2]=3 2675 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,0,0,1,0,0|0,1,2]=4 2676 B8R1.2 O=CC1CCCOC1 Amb8009553 [0,0,0,1,0,0|2,0,1]=4 2677 B8R1.2 O=CC1COCCN1 Amb18833023 [0,0,0,1,0,0|2,0,1]=4 2678 B8R1.2 O=CC1COCCO1 Amb8011456 [0,0,0,1,0,0|1,0,1]=3 2679 B8R1.2 O=C[C@@H]1CCCCN1 Amb27468660 [0,0,0,1,0,0|1,0,2]=4 2680 B8R1.2 O=C[C@@H]1CCCOC1 Amb27843270 [0,0,0,1,0,0|2,0,1]=4 2681 B8R1.2 O=C[C@H]1CCCCN1 Amb27203300 [0,0,0,1,0,0|1,0,2]=4 2682 B8R1.2 O=NN1CCCCO1 Amb27472845 [0,0,0,1,0,0|2,0,1]=4 2683 B8R1.2 OCC1=CCCCC1 Amb24122911 [0,0,0,1,0,0|1,0,1]=3 2684 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,0,0,1,0,0|0,0,2]=3 2685 B8R1.2 OCC1=CCCOC1 Amb24329074 [0,0,0,1,0,0|2,0,1]=4 2686 B8R1.2 OCC1=CCOCC1 Amb27394889 [0,0,0,1,0,0|2,0,1]=4 2687 B8R1.2 OCC1=CCSCC1 Amb28189541 [0,0,0,1,0,0|2,0,1]=4 2688 B8R1.2 OCC1=COCCC1 Amb24426430 [0,0,0,1,0,0|2,0,1]=4 2689 B8R1.2 OCC1=COCCO1 Amb19319714 [0,0,0,1,0,0|1,0,2]=4 2690 B8R1.2 OCC1=NCCCN1 Amb28326118 [0,0,0,1,0,0|2,0,1]=4 2691 B8R1.2 OCC1=NOCCC1 Amb25675358 [0,0,0,1,0,0|2,0,1]=4 2692 B8R1.2 OCC1C=CCCC1 Amb17593156 [0,0,0,1,0,0|1,0,1]=3 2693 B8R1.2 OCC1C=CCCN1 Amb32683449 [0,0,0,1,0,0|1,0,2]=4 2694 B8R1.2 OCC1C=CCCO1 Amb27249902 [0,0,0,1,0,0|0,0,2]=3 2695 B8R1.2 OCC1C=CCOC1 Amb27755980 [0,0,0,1,0,0|2,0,1]=4 2696 B8R1.2 OCC1CC=CCC1 Amb3939071 [0,0,0,1,0,0|1,0,2]=4 2697 B8R1.2 OCC1CC=CCO1 Amb25316226 [0,0,0,1,0,0|0,0,2]=3 2698 B8R1.2 OCC1CCC=CO1 Amb3939374 [0,0,0,1,0,0|0,0,2]=3 2699 B8R1.2 OCC1CCCCC1 Amb3939316 [0,0,0,1,0,0|1,0,0]=2 2700 B8R1.2 OCC1CCCCN1 Amb6768986 [0,0,0,1,0,0|1,0,0]=2 2701 B8R1.2 OCC1CCCCN1 Amb9703110 [0,0,0,1,0,0|1,0,0]=2 2702 B8R1.2 OCC1CCCCO1 Amb9703167 [0,0,0,1,0,0|0,0,0]=1 2703 B8R1.2 OCC1CCCCS1 Amb20669084 [0,0,0,1,0,0|0,1,0]=2 2704 B8R1.2 OCC1CCCNC1 Amb22001796 [0,0,0,1,0,0|2,0,0]=3 2705 B8R1.2 OCC1CCCNC1 Amb2695684 [0,0,0,1,0,0|2,0,0]=3 2706 B8R1.2 OCC1CCCOC1 Amb1093253 [0,0,0,1,0,0|2,0,0]=3 2707 B8R1.2 OCC1CCCSC1 Amb18202835 [0,0,0,1,0,0|2,0,0]=3 2708 B8R1.2 OCC1CCNCC1 Amb20242610 [0,0,0,1,0,0|2,0,0]=3 2709 B8R1.2 OCC1CCNCC1 Amb2695656 [0,0,0,1,0,0|2,0,0]=3 2710 B8R1.2 OCC1CCOCC1 Amb2684132 [0,0,0,1,0,0|2,0,0]=3 2711 B8R1.2 OCC1CCSCC1 Amb7990078 [0,0,0,1,0,0|2,0,0]=3 2712 B8R1.2 OCC1CCSCN1 Amb27216503 [0,0,0,1,0,0|2,0,0]=3 2713 B8R1.2 OCC1CNCCN1 Amb20240990 [0,0,0,1,0,0|2,0,0]=3 2714 B8R1.2 OCC1CNCCN1 Amb8630776 [0,0,0,1,0,0|2,0,0]=3 2715 B8R1.2 OCC1CNCCO1 Amb19957720 [0,0,0,1,0,0|1,0,0]=2 2716 B8R1.2 OCC1CNCCO1 Amb33546015 [0,0,0,1,0,0|1,0,0]=2 2717 B8R1.2 OCC1COCCN1 Amb10067154 [0,0,0,1,0,0|2,0,0]=3 2718 B8R1.2 OCC1COCCN1 Amb19516092 [0,0,0,1,0,0|2,0,0]=3 2719 B8R1.2 OCC1COCCO1 Amb10607696 [0,0,0,1,0,0|1,0,0]=2 2720 B8R1.2 OCC1CSCCN1 Amb4009237 [0,0,0,1,0,0|2,0,0]=3 2721 B8R1.2 OCN1CCCCC1 Amb25949562 [0,0,0,1,0,0|2,0,0]=3 2722 B8R1.2 OCN1CCNCC1 Amb22231021 [0,0,0,1,0,0|3,0,0]=4 2723 B8R1.2 OC[C@@H]1C=CCOC1 Amb27398322 [0,0,0,1,0,0|2,0,1]=4 2724 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,0,0,1,0,0|1,0,0]=2 2725 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,0,0,1,0,0|0,0,0]=1 2726 B8R1.2 OC[C@@H]1CCCNC1 Amb10603201 [0,0,0,1,0,0|2,0,0]=3 2727 B8R1.2 OC[C@@H]1CCCNC1 Amb22504548 [0,0,0,1,0,0|2,0,0]=3 2728 B8R1.2 OC[C@@H]1CCCNN1 Amb28138668 [0,0,0,1,0,0|2,0,0]=3 2729 B8R1.2 OC[C@@H]1CCCOC1 Amb27236984 [0,0,0,1,0,0|2,0,0]=3 2730 B8R1.2 OC[C@@H]1CNCCN1 Amb15690750 [0,0,0,1,0,0|2,0,0]=3 2731 B8R1.2 OC[C@@H]1CNCCO1 Amb10067152 [0,0,0,1,0,0|1,0,0]=2 2732 B8R1.2 OC[C@@H]1CNCCO1 Amb17933818 [0,0,0,1,0,0|1,0,0]=2 2733 B8R1.2 OC[C@@H]1COCCN1 Amb2695533 [0,0,0,1,0,0|2,0,0]=3 2734 B8R1.2 OC[C@@H]1COCCN1 Amb8630125 [0,0,0,1,0,0|2,0,0]=3 2735 B8R1.2 OC[C@@H]1COCCO1 Amb22752848 [0,0,0,1,0,0|1,0,0]=2 2736 B8R1.2 OC[C@H]1CC=CCO1 Amb27198230 [0,0,0,1,0,0|0,0,2]=3 2737 B8R1.2 OC[C@H]1CCC=CO1 Amb27771482 [0,0,0,1,0,0|0,0,2]=3 2738 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,0,0,1,0,0|1,0,0]=2 2739 B8R1.2 OC[C@H]1CCCCO1 Amb25873825 [0,0,0,1,0,0|0,0,0]=1 2740 B8R1.2 OC[C@H]1CCCNC1 Amb10603243 [0,0,0,1,0,0|2,0,0]=3 2741 B8R1.2 OC[C@H]1CCCNC1 Amb22388477 [0,0,0,1,0,0|2,0,0]=3 2742 B8R1.2 OC[C@H]1CCCOC1 Amb24413844 [0,0,0,1,0,0|2,0,0]=3 2743 B8R1.2 OC[C@H]1CNCCN1 Amb22288655 [0,0,0,1,0,0|2,0,0]=3 2744 B8R1.2 OC[C@H]1CNCCN1 Amb24444183 [0,0,0,1,0,0|2,0,0]=3 2745 B8R1.2 OC[C@H]1CNCCO1 Amb10067151 [0,0,0,1,0,0|1,0,0]=2 2746 B8R1.2 OC[C@H]1CNCCO1 Amb8630630 [0,0,0,1,0,0|1,0,0]=2 2747 B8R1.2 OC[C@H]1COCCN1 Amb15691976 [0,0,0,1,0,0|2,0,0]=3 2748 B8R1.2 OC[C@H]1COCCN1 Amb2695534 [0,0,0,1,0,0|2,0,0]=3 2749 B8R1.2 OC[C@H]1COCCO1 Amb25724377 [0,0,0,1,0,0|1,0,0]=2 2750 B8R1.2 ON=C1CCCCC1 Amb6364727 [0,0,0,1,0,0|2,0,1]=4 2751 B8R1.2 ONC1CCCCO1 Amb27428911 [0,0,0,1,0,0|1,0,0]=2 2752 B8R1.2 ONC1CCCNC1 Amb28048987 [0,0,0,1,0,0|3,0,0]=4 2753 B8R1.2 O[NH2+]C1CCCCC1 Amb9826874 [0,0,0,1,0,0|2,0,0]=3 2754 B8R1.2 O\N=C1\CCCCN1 Amb4136429 [0,0,0,1,0,0|2,0,1]=4 2755 B8R1.2 SCC1=CCCOC1 Amb32788343 [0,0,0,1,0,0|2,0,1]=4 2756 B8R1.2 SCC1CCC=CO1 Amb32788204 [0,0,0,1,0,0|0,1,2]=4 2757 B8R1.2 SCC1CCCCC1 Amb6255606 [0,0,0,1,0,0|1,1,0]=3 2758 B8R1.2 SCC1CCCCN1 Amb26349710 [0,0,0,1,0,0|1,1,0]=3 2759 B8R1.2 SCC1CCCCO1 Amb23585661 [0,0,0,1,0,0|0,1,0]=2 2760 B8R1.2 SCC1CCCNC1 Amb17503130 [0,0,0,1,0,0|2,1,0]=4 2761 B8R1.2 SCC1CCCOC1 Amb26590340 [0,0,0,1,0,0|2,0,0]=3 2762 B8R1.2 SCC1CCCSC1 Amb32788278 [0,0,0,1,0,0|2,1,0]=4 2763 B8R1.2 SCC1CCNCC1 Amb17503031 [0,0,0,1,0,0|2,1,0]=4 2764 B8R1.2 SCC1CCOCC1 Amb25708148 [0,0,0,1,0,0|2,1,0]=4 2765 B8R1.2 SCC1CNCCO1 Amb29855425 [0,0,0,1,0,0|1,1,0]=3 2766 B8R1.2 SCC1CSCCN1 Amb27811622 [0,0,0,1,0,0|2,1,0]=4 2767 B8R1.2 SC[C@H]1COCCN1 Amb24524252 [0,0,0,1,0,0|2,0,0]=3 2768 B8R1.2 [C-]#[N+]C1CCCCC1 Amb2235424 [0,0,0,1,0,0|3,0,0]=4 2769 B8R1.2 [C-]#[N+]C1CCCCN1 Amb28129502 [0,0,0,1,0,0|3,0,0]=4 2770 B8R1.2 [C-]#[N+]C1CCCCS1 Amb27872577 [0,0,0,1,0,0|2,1,0]=4 2771 B8R1.2 [C-]#[N+]C1CCCOC1 Amb33323212 [0,0,0,1,0,0|2,0,1]=4 2772 B8R1.2 [CH2-]CC1CCCCC1 Amb24117227 [0,0,0,1,0,0|2,0,0]=3 2773 B8R1.5 BrC1CCCCC1Br Amb10563786 [0,0,0,1,0,0|3,0,0]=4 2774 B8R1.5 BrC1CCCC[C@H]1Br Amb30866922 [0,0,0,1,0,0|3,0,0]=4 2775 B8R1.5 BrC1CCOCC1Br Amb29848082 [0,0,0,1,0,0|2,0,0]=3 2776 B8R1.5 Br[C@H]1CCCC[C@@H]1Br Amb27800706 [0,0,0,1,0,0|3,0,0]=4 2777 B8R1.5 Br[C@H]1CCCC[C@H]1Br Amb33827804 [0,0,0,1,0,0|3,0,0]=4 2778 B8R1.5 C=C1CCCCC1C Amb25203919 [0,0,0,1,0,0|2,0,1]=4 2779 B8R1.5 C=C1CCCCC1O Amb28316215 [0,0,0,1,0,0|1,0,2]=4 2780 B8R1.5 CC1=CCCCC1O Amb22365276 [0,0,0,1,0,0|1,0,2]=4 2781 B8R1.5 CC1=CCOCC1O Amb28411303 [0,0,0,1,0,0|0,0,2]=3 2782 B8R1.5 CC1CC=CCC1C Amb22364352 [0,0,0,1,0,0|2,0,1]=4 2783 B8R1.5 CC1CC=CCC1N Amb25975568 [0,0,0,1,0,0|2,0,1]=4 2784 B8R1.5 CC1CCC=CC1N Amb18641660 [0,0,0,1,0,0|2,0,1]=4 2785 B8R1.5 CC1CCCCC1=O Amb6608749 [0,0,0,1,0,0|1,0,2]=4 2786 B8R1.5 CC1CCCCC1Br Amb8835443 [0,0,0,1,0,0|2,0,0]=3 2787 B8R1.5 CC1CCCCC1C Amb8513143 [0,0,0,1,0,0|2,0,0]=3 2788 B8R1.5 CC1CCCCC1Cl Amb9205060 [0,0,0,1,0,0|2,0,0]=3 2789 B8R1.5 CC1CCCCC1N Amb9702773 [0,0,0,1,0,0|2,0,0]=3 2790 B8R1.5 CC1CCCCC1O Amb3940289 [0,0,0,1,0,0|1,0,0]=2 2791 B8R1.5 CC1CCCCC1S Amb9208050 [0,0,0,1,0,0|1,1,0]=3 2792 B8R1.5 CC1CCCCN1C Amb9787355 [0,0,0,1,0,0|3,0,0]=4 2793 B8R1.5 CC1CCCCN1N Amb17231818 [0,0,0,1,0,0|3,0,0]=4 2794 B8R1.5 CC1CCCCN1O Amb28121416 [0,0,0,1,0,0|2,0,0]=3 2795 B8R1.5 CC1CCCNC1C Amb1089738 [0,0,0,1,0,0|3,0,0]=4 2796 B8R1.5 CC1CCCNC1C Amb19338160 [0,0,0,1,0,0|3,0,0]=4 2797 B8R1.5 CC1CCCOC1O Amb28207170 [0,0,0,1,0,0|2,0,0]=3 2798 B8R1.5 CC1CCNCC1=O Amb28990014 [0,0,0,1,0,0|1,0,2]=4 2799 B8R1.5 CC1CCNCC1=O Amb8388554 [0,0,0,1,0,0|1,0,2]=4 2800 B8R1.5 CC1CCNCC1C Amb22059495 [0,0,0,1,0,0|2,0,0]=3 2801 B8R1.5 CC1CCNCC1F Amb27476489 [0,0,0,1,0,0|2,0,0]=3 2802 B8R1.5 CC1CCNCC1F Amb32941869 [0,0,0,1,0,0|2,0,0]=3 2803 B8R1.5 CC1CCNCC1N Amb19374853 [0,0,0,1,0,0|2,0,0]=3 2804 B8R1.5 CC1CCNCC1O Amb22406220 [0,0,0,1,0,0|1,0,0]=2 2805 B8R1.5 CC1CCNCC1O Amb23440259 [0,0,0,1,0,0|1,0,0]=2 2806 B8R1.5 CC1CCOCC1=O Amb25718285 [0,0,0,1,0,0|0,0,2]=3 2807 B8R1.5 CC1CNCCC1Br Amb25125494 [0,0,0,1,0,0|3,0,0]=4 2808 B8R1.5 CC1CNCCC1F Amb26572956 [0,0,0,1,0,0|3,0,0]=4 2809 B8R1.5 CC1CNCCC1N Amb23440690 [0,0,0,1,0,0|3,0,0]=4 2810 B8R1.5 CC1CNCCC1O Amb33544532 [0,0,0,1,0,0|2,0,0]=3 2811 B8R1.5 CC1CNCCC1O Amb4362742 [0,0,0,1,0,0|2,0,0]=3 2812 B8R1.5 CC1CNCCC1S Amb26641892 [0,0,0,1,0,0|2,1,0]=4 2813 B8R1.5 CC1CNCCN1C Amb19148798 [0,0,0,1,0,0|3,0,0]=4 2814 B8R1.5 CC1CNCCN1C Amb22586682 [0,0,0,1,0,0|3,0,0]=4 2815 B8R1.5 CC1CNCCN1C Amb2694471 [0,0,0,1,0,0|3,0,0]=4 2816 B8R1.5 CC1COCCC1=O Amb21856147 [0,0,0,1,0,0|2,0,1]=4 2817 B8R1.5 CC1COCCC1Br Amb27242904 [0,0,0,1,0,0|2,0,0]=3 2818 B8R1.5 CC1COCCC1N Amb18833016 [0,0,0,1,0,0|2,0,0]=3 2819 B8R1.5 CC1COCCC1N Amb28934837 [0,0,0,1,0,0|2,0,0]=3 2820 B8R1.5 CC1COCCC1O Amb22299437 [0,0,0,1,0,0|2,0,0]=3 2821 B8R1.5 CC1COCCC1S Amb22299438 [0,0,0,1,0,0|2,0,0]=3 2822 B8R1.5 CC1COCCN1N Amb18559532 [0,0,0,1,0,0|3,0,0]=4 2823 B8R1.5 CC1COCOC1C Amb25829514 [0,0,0,1,0,0|2,0,0]=3 2824 B8R1.5 CC1CSCCC1N Amb18202892 [0,0,0,1,0,0|2,1,0]=4 2825 B8R1.5 CC1CSCCC1O Amb26370414 [0,0,0,1,0,0|2,0,0]=3 2826 B8R1.5 CC1NCCCC1N Amb24715672 [0,0,0,1,0,0|3,0,0]=4 2827 B8R1.5 CC1NCCCC1O Amb27839609 [0,0,0,1,0,0|2,0,0]=3 2828 B8R1.5 CC1NCCCC1O Amb28934842 [0,0,0,1,0,0|2,0,0]=3 2829 B8R1.5 CC1NCCCC1S Amb32788772 [0,0,0,1,0,0|2,1,0]=4 2830 B8R1.5 CC1NCCOC1O Amb25031508 [0,0,0,1,0,0|3,0,0]=4 2831 B8R1.5 CC1OCC=CC1O Amb27978022 [0,0,0,1,0,0|2,0,1]=4 2832 B8R1.5 CC1OCCCC1Br Amb22500038 [0,0,0,1,0,0|3,0,0]=4 2833 B8R1.5 CC1SCCCC1Br Amb24483260 [0,0,0,1,0,0|3,0,0]=4 2834 B8R1.5 CC1SCCCC1N Amb24699153 [0,0,0,1,0,0|3,0,0]=4 2835 B8R1.5 CC1SCCCC1O Amb26865931 [0,0,0,1,0,0|2,0,0]=3 2836 B8R1.5 CC1SCCCC1S Amb24658420 [0,0,0,1,0,0|2,1,0]=4 2837 B8R1.5 CN1CCCCC1Br Amb28318404 [0,0,0,1,0,0|3,0,0]=4 2838 B8R1.5 CN1CCOCC1=O Amb22301593 [0,0,0,1,0,0|1,0,2]=4 2839 B8R1.5 C[C@@H]1C=CCC[C@@H]1O Amb27208180 [0,0,0,1,0,0|1,0,2]=4 2840 B8R1.5 C[C@@H]1C=CCC[C@H]1O Amb27442958 [0,0,0,1,0,0|1,0,2]=4 2841 B8R1.5 C[C@@H]1CC=CC[C@@H]1N Amb27799251 [0,0,0,1,0,0|2,0,1]=4 2842 B8R1.5 C[C@@H]1CC=CC[C@H]1C Amb28061692 [0,0,0,1,0,0|2,0,1]=4 2843 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb24568280 [0,0,0,1,0,0|2,0,1]=4 2844 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb32721599 [0,0,0,1,0,0|2,0,1]=4 2845 B8R1.5 C[C@@H]1CC=CC[C@H]1O Amb28318165 [0,0,0,1,0,0|1,0,1]=3 2846 B8R1.5 C[C@@H]1CCC=CC1O Amb28435732 [0,0,0,1,0,0|1,0,1]=3 2847 B8R1.5 C[C@@H]1CCC=C[C@@H]1Cl Amb28134614 [0,0,0,1,0,0|2,0,1]=4 2848 B8R1.5 C[C@@H]1CCC=C[C@@H]1O Amb27652339 [0,0,0,1,0,0|1,0,1]=3 2849 B8R1.5 C[C@@H]1CCC=C[C@H]1N Amb27487557 [0,0,0,1,0,0|2,0,1]=4 2850 B8R1.5 C[C@@H]1CCC=C[C@H]1O Amb28053681 [0,0,0,1,0,0|1,0,1]=3 2851 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22746982 [0,0,0,1,0,0|2,0,0]=3 2852 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22899193 [0,0,0,1,0,0|2,0,0]=3 2853 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,0,0,1,0,0|1,0,0]=2 2854 B8R1.5 C[C@@H]1CCCC[C@H]1Br Amb27250883 [0,0,0,1,0,0|2,0,0]=3 2855 B8R1.5 C[C@@H]1CCCC[C@H]1C Amb22801359 [0,0,0,1,0,0|2,0,0]=3 2856 B8R1.5 C[C@@H]1CCCC[C@H]1N Amb8393225 [0,0,0,1,0,0|2,0,0]=3 2857 B8R1.5 C[C@@H]1CCCC[C@H]1O Amb2780856 [0,0,0,1,0,0|1,0,0]=2 2858 B8R1.5 C[C@@H]1CCCN[C@@H]1C Amb34912851 [0,0,0,1,0,0|3,0,0]=4 2859 B8R1.5 C[C@@H]1CCCO[C@@H]1O Amb27452063 [0,0,0,1,0,0|2,0,0]=3 2860 B8R1.5 C[C@@H]1CCNC[C@@H]1F Amb33338925 [0,0,0,1,0,0|2,0,0]=3 2861 B8R1.5 C[C@@H]1CCNC[C@@H]1F Amb33338926 [0,0,0,1,0,0|2,0,0]=3 2862 B8R1.5 C[C@@H]1CCNC[C@@H]1N Amb32667966 [0,0,0,1,0,0|2,0,0]=3 2863 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb22886317 [0,0,0,1,0,0|1,0,0]=2 2864 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb24694415 [0,0,0,1,0,0|1,0,0]=2 2865 B8R1.5 C[C@@H]1CCNC[C@H]1N Amb26959701 [0,0,0,1,0,0|2,0,0]=3 2866 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb22886316 [0,0,0,1,0,0|1,0,0]=2 2867 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb24553941 [0,0,0,1,0,0|1,0,0]=2 2868 B8R1.5 C[C@@H]1CCOC[C@H]1O Amb28345042 [0,0,0,1,0,0|0,0,0]=1 2869 B8R1.5 C[C@@H]1CNCCN1C Amb18833029 [0,0,0,1,0,0|3,0,0]=4 2870 B8R1.5 C[C@@H]1CNCCN1C Amb22745842 [0,0,0,1,0,0|3,0,0]=4 2871 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb22232040 [0,0,0,1,0,0|2,0,0]=3 2872 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb31291752 [0,0,0,1,0,0|2,0,0]=3 2873 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22270263 [0,0,0,1,0,0|2,0,0]=3 2874 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22757834 [0,0,0,1,0,0|2,0,0]=3 2875 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,0,0,1,0,0|2,0,0]=3 2876 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,0,0,1,0,0|2,0,0]=3 2877 B8R1.5 C[C@@H]1COCC[C@H]1N Amb25929881 [0,0,0,1,0,0|2,0,0]=3 2878 B8R1.5 C[C@@H]1COCN[C@H]1C Amb27469346 [0,0,0,1,0,0|2,0,0]=3 2879 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb26431095 [0,0,0,1,0,0|2,0,0]=3 2880 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb32680789 [0,0,0,1,0,0|2,0,0]=3 2881 B8R1.5 C[C@@H]1OCCC[C@H]1Br Amb27444138 [0,0,0,1,0,0|3,0,0]=4 2882 B8R1.5 C[C@@H]1OCCC[C@H]1Cl Amb27453022 [0,0,0,1,0,0|3,0,0]=4 2883 B8R1.5 C[C@H]1CCC=C[C@@H]1O Amb27443159 [0,0,0,1,0,0|1,0,1]=3 2884 B8R1.5 C[C@H]1CCCC[C@@H]1C Amb6298314 [0,0,0,1,0,0|2,0,0]=3 2885 B8R1.5 C[C@H]1CCCC[C@@H]1Cl Amb27198993 [0,0,0,1,0,0|2,0,0]=3 2886 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,0,0,1,0,0|1,0,0]=2 2887 B8R1.5 C[C@H]1CCCC[C@H]1Br Amb27656872 [0,0,0,1,0,0|2,0,0]=3 2888 B8R1.5 C[C@H]1CCCC[C@H]1C Amb6298877 [0,0,0,1,0,0|2,0,0]=3 2889 B8R1.5 C[C@H]1CCCC[C@H]1N Amb25911858 [0,0,0,1,0,0|2,0,0]=3 2890 B8R1.5 C[C@H]1CCCC[C@H]1N Amb33620881 [0,0,0,1,0,0|2,0,0]=3 2891 B8R1.5 C[C@H]1CCCO[C@@H]1O Amb27452053 [0,0,0,1,0,0|2,0,0]=3 2892 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb26892110 [0,0,0,1,0,0|1,0,0]=2 2893 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb33726126 [0,0,0,1,0,0|1,0,0]=2 2894 B8R1.5 C[C@H]1CCNC[C@H]1O Amb25339261 [0,0,0,1,0,0|1,0,0]=2 2895 B8R1.5 C[C@H]1CCNC[C@H]1O Amb32409390 [0,0,0,1,0,0|1,0,0]=2 2896 B8R1.5 C[C@H]1CCOC[C@H]1O Amb27484771 [0,0,0,1,0,0|0,0,0]=1 2897 B8R1.5 C[C@H]1CNCCN1C Amb22587566 [0,0,0,1,0,0|3,0,0]=4 2898 B8R1.5 C[C@H]1CNCCN1C Amb33725445 [0,0,0,1,0,0|3,0,0]=4 2899 B8R1.5 C[C@H]1CNCC[C@@H]1O Amb24059398 [0,0,0,1,0,0|2,0,0]=3 2900 B8R1.5 C[C@H]1COCC[C@@H]1N Amb27440842 [0,0,0,1,0,0|2,0,0]=3 2901 B8R1.5 C[C@H]1COCC[C@@H]1N Amb33726124 [0,0,0,1,0,0|2,0,0]=3 2902 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,0,0,1,0,0|2,0,0]=3 2903 B8R1.5 C[C@H]1COCC[C@H]1N Amb32409393 [0,0,0,1,0,0|2,0,0]=3 2904 B8R1.5 C[C@H]1CSCC[C@@H]1O Amb28286731 [0,0,0,1,0,0|2,0,0]=3 2905 B8R1.5 ClC1CCCCC1Br Amb27477421 [0,0,0,1,0,0|3,0,0]=4 2906 B8R1.5 ClC1CCOCC1Cl Amb28384990 [0,0,0,1,0,0|2,0,0]=3 2907 B8R1.5 Cl[C@@H]1CCCC[C@H]1Br Amb24308900 [0,0,0,1,0,0|3,0,0]=4 2908 B8R1.5 Cl[C@@H]1CCCC[C@H]1Cl Amb8513105 [0,0,0,1,0,0|3,0,0]=4 2909 B8R1.5 Cl[C@@H]1CCOC[C@H]1Cl Amb27797196 [0,0,0,1,0,0|2,0,0]=3 2910 B8R1.5 Cl[C@H]1CCCC[C@@H]1Br Amb26073947 [0,0,0,1,0,0|3,0,0]=4 2911 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl Amb27800760 [0,0,0,1,0,0|3,0,0]=4 2912 B8R1.5 Cl[C@H]1CCCC[C@H]1Br Amb28068995 [0,0,0,1,0,0|3,0,0]=4 2913 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl Amb2720826 [0,0,0,1,0,0|3,0,0]=4 2914 B8R1.5 FC1CCCCC1Br Amb10841597 [0,0,0,1,0,0|3,0,0]=4 2915 B8R1.5 FC1CCCCC1I Amb28320496 [0,0,0,1,0,0|3,0,0]=4 2916 B8R1.5 FC1CCNCC1F Amb25227141 [0,0,0,1,0,0|3,0,0]=4 2917 B8R1.5 F[C@@H]1CCCC[C@H]1Br Amb27447303 [0,0,0,1,0,0|3,0,0]=4 2918 B8R1.5 F[C@@H]1CCNC[C@H]1F Amb23440303 [0,0,0,1,0,0|3,0,0]=4 2919 B8R1.5 F[C@@H]1CCNC[C@H]1F Amb27620409 [0,0,0,1,0,0|3,0,0]=4 2920 B8R1.5 F[C@H]1CCCC[C@@H]1Br Amb27440070 [0,0,0,1,0,0|3,0,0]=4 2921 B8R1.5 F[C@H]1CCCC[C@H]1Cl Amb27878815 [0,0,0,1,0,0|3,0,0]=4 2922 B8R1.5 F[C@H]1CCNC[C@@H]1F Amb28056020 [0,0,0,1,0,0|3,0,0]=4 2923 B8R1.5 F[C@H]1CCNC[C@@H]1F Amb34161398 [0,0,0,1,0,0|3,0,0]=4 2924 B8R1.5 F[C@H]1CCNC[C@H]1F Amb23440304 [0,0,0,1,0,0|3,0,0]=4 2925 B8R1.5 F[C@H]1CNCC[C@H]1F Amb28195480 [0,0,0,1,0,0|3,0,0]=4 2926 B8R1.5 F[C@H]1CNCC[C@H]1F Amb34148517 [0,0,0,1,0,0|3,0,0]=4 2927 B8R1.5 NC1CCCCC1Br Amb20622391 [0,0,0,1,0,0|3,0,0]=4 2928 B8R1.5 NC1CCCCC1Br Amb27267997 [0,0,0,1,0,0|3,0,0]=4 2929 B8R1.5 NC1CCCCC1Cl Amb20622338 [0,0,0,1,0,0|3,0,0]=4 2930 B8R1.5 NC1CCCCC1Cl Amb27776644 [0,0,0,1,0,0|3,0,0]=4 2931 B8R1.5 NC1CCCCC1F Amb22886179 [0,0,0,1,0,0|3,0,0]=4 2932 B8R1.5 NC1CCCCC1F Amb25831178 [0,0,0,1,0,0|3,0,0]=4 2933 B8R1.5 NC1CCCCC1F Amb32653040 [0,0,0,1,0,0|3,0,0]=4 2934 B8R1.5 NC1CCCCC1I Amb28194292 [0,0,0,1,0,0|3,0,0]=4 2935 B8R1.5 NC1CCCCC1N Amb32666334 [0,0,0,1,0,0|3,0,0]=4 2936 B8R1.5 NC1CCCCC1N Amb9703103 [0,0,0,1,0,0|3,0,0]=4 2937 B8R1.5 NC1CCCCC1O Amb22228578 [0,0,0,1,0,0|2,0,0]=3 2938 B8R1.5 NC1CCCCC1O Amb31302362 [0,0,0,1,0,0|2,0,0]=3 2939 B8R1.5 NC1CCCCC1O Amb3428551 [0,0,0,1,0,0|2,0,0]=3 2940 B8R1.5 NC1CCCCC1S Amb24117988 [0,0,0,1,0,0|2,1,0]=4 2941 B8R1.5 NC1CCCC[C@H]1N Amb9787721 [0,0,0,1,0,0|3,0,0]=4 2942 B8R1.5 NC1CCNCC1F Amb27473229 [0,0,0,1,0,0|3,0,0]=4 2943 B8R1.5 NC1CCNCC1O Amb22388661 [0,0,0,1,0,0|2,0,0]=3 2944 B8R1.5 NC1CCOCC1Br Amb32657381 [0,0,0,1,0,0|2,0,0]=3 2945 B8R1.5 NC1CCOCC1F Amb22436824 [0,0,0,1,0,0|2,0,0]=3 2946 B8R1.5 NC1CCOCC1O Amb18198453 [0,0,0,1,0,0|1,0,0]=2 2947 B8R1.5 NC1CCOCC1O Amb28934888 [0,0,0,1,0,0|1,0,0]=2 2948 B8R1.5 NC1CNCCC1F Amb27466061 [0,0,0,1,0,0|3,0,0]=4 2949 B8R1.5 NC1CNCCC1F Amb32951201 [0,0,0,1,0,0|3,0,0]=4 2950 B8R1.5 NC1CNCCC1O Amb26874176 [0,0,0,1,0,0|3,0,0]=4 2951 B8R1.5 NC1COCCC1=O Amb18833021 [0,0,0,1,0,0|2,0,1]=4 2952 B8R1.5 NC1COCCC1=O Amb32670691 [0,0,0,1,0,0|2,0,1]=4 2953 B8R1.5 NC1COCCC1O Amb18198755 [0,0,0,1,0,0|2,0,0]=3 2954 B8R1.5 NC1COCCC1O Amb32753157 [0,0,0,1,0,0|2,0,0]=3 2955 B8R1.5 N[C@@H]1CCCC[C@@H]1Br Amb35750364 [0,0,0,1,0,0|3,0,0]=4 2956 B8R1.5 N[C@@H]1CCCC[C@@H]1Br Amb35752107 [0,0,0,1,0,0|3,0,0]=4 2957 B8R1.5 N[C@@H]1CCCC[C@@H]1F Amb26885648 [0,0,0,1,0,0|3,0,0]=4 2958 B8R1.5 N[C@@H]1CCCC[C@@H]1F Amb32660921 [0,0,0,1,0,0|3,0,0]=4 2959 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [0,0,0,1,0,0|2,0,0]=3 2960 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [0,0,0,1,0,0|2,0,0]=3 2961 B8R1.5 N[C@@H]1CCCC[C@H]1Br Amb27781093 [0,0,0,1,0,0|3,0,0]=4 2962 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb22831446 [0,0,0,1,0,0|3,0,0]=4 2963 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb22886180 [0,0,0,1,0,0|3,0,0]=4 2964 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb33379067 [0,0,0,1,0,0|3,0,0]=4 2965 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb32662723 [0,0,0,1,0,0|3,0,0]=4 2966 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb33523993 [0,0,0,1,0,0|3,0,0]=4 2967 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb6296933 [0,0,0,1,0,0|3,0,0]=4 2968 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [0,0,0,1,0,0|2,0,0]=3 2969 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [0,0,0,1,0,0|2,0,0]=3 2970 B8R1.5 N[C@@H]1CCCC[C@H]1S Amb28457242 [0,0,0,1,0,0|2,1,0]=4 2971 B8R1.5 N[C@@H]1CCNC[C@H]1O Amb27421907 [0,0,0,1,0,0|2,0,0]=3 2972 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb23439434 [0,0,0,1,0,0|2,0,0]=3 2973 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb25780287 [0,0,0,1,0,0|2,0,0]=3 2974 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,0,0,1,0,0|1,0,0]=2 2975 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,0,0,1,0,0|1,0,0]=2 2976 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb23439433 [0,0,0,1,0,0|2,0,0]=3 2977 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,0,0,1,0,0|1,0,0]=2 2978 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,0,0,1,0,0|1,0,0]=2 2979 B8R1.5 N[C@@H]1CCSC[C@@H]1O Amb27207385 [0,0,0,1,0,0|1,1,0]=3 2980 B8R1.5 N[C@@H]1CCSC[C@H]1O Amb27456499 [0,0,0,1,0,0|1,1,0]=3 2981 B8R1.5 N[C@@H]1CNCC[C@H]1O Amb32674491 [0,0,0,1,0,0|3,0,0]=4 2982 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,0,0,1,0,0|2,0,0]=3 2983 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb26888092 [0,0,0,1,0,0|2,0,0]=3 2984 B8R1.5 N[C@@H]1COCC[C@H]1F Amb27435652 [0,0,0,1,0,0|2,0,0]=3 2985 B8R1.5 N[C@@H]1COCC[C@H]1N Amb24120364 [0,0,0,1,0,0|2,0,0]=3 2986 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,0,0,1,0,0|2,0,0]=3 2987 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,0,0,1,0,0|2,0,0]=3 2988 B8R1.5 N[C@H]1CCCC[C@@H]1N Amb8396717 [0,0,0,1,0,0|3,0,0]=4 2989 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [0,0,0,1,0,0|2,0,0]=3 2990 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb2612694 [0,0,0,1,0,0|2,0,0]=3 2991 B8R1.5 N[C@H]1CCCC[C@H]1F Amb24117513 [0,0,0,1,0,0|3,0,0]=4 2992 B8R1.5 N[C@H]1CCCC[C@H]1N Amb22745943 [0,0,0,1,0,0|3,0,0]=4 2993 B8R1.5 N[C@H]1CCCC[C@H]1N Amb8396716 [0,0,0,1,0,0|3,0,0]=4 2994 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [0,0,0,1,0,0|2,0,0]=3 2995 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [0,0,0,1,0,0|2,0,0]=3 2996 B8R1.5 N[C@H]1CCNC[C@@H]1O Amb28052491 [0,0,0,1,0,0|2,0,0]=3 2997 B8R1.5 N[C@H]1CCNC[C@H]1O Amb27815748 [0,0,0,1,0,0|2,0,0]=3 2998 B8R1.5 N[C@H]1CCOC[C@@H]1F Amb33726121 [0,0,0,1,0,0|2,0,0]=3 2999 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb25970035 [0,0,0,1,0,0|1,0,0]=2 3000 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb33725444 [0,0,0,1,0,0|1,0,0]=2 3001 B8R1.5 N[C@H]1CCOC[C@H]1F Amb26532518 [0,0,0,1,0,0|2,0,0]=3 3002 B8R1.5 N[C@H]1CCOC[C@H]1F Amb31291469 [0,0,0,1,0,0|2,0,0]=3 3003 B8R1.5 N[C@H]1CCOC[C@H]1O Amb26407654 [0,0,0,1,0,0|1,0,0]=2 3004 B8R1.5 N[C@H]1CCOC[C@H]1O Amb33801116 [0,0,0,1,0,0|1,0,0]=2 3005 B8R1.5 N[C@H]1CCSC[C@@H]1O Amb28052492 [0,0,0,1,0,0|1,1,0]=3 3006 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,0,0,1,0,0|2,0,0]=3 3007 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,0,0,1,0,0|2,0,0]=3 3008 B8R1.5 N[C@H]1COCC[C@H]1O Amb33872533 [0,0,0,1,0,0|2,0,0]=3 3009 B8R1.5 O=C1CCCCC1O Amb8390042 [0,0,0,1,0,0|2,0,1]=4 3010 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,0,0,1,0,0|2,0,1]=4 3011 B8R1.5 O=C1CCNCC1O Amb24075970 [0,0,0,1,0,0|2,0,1]=4 3012 B8R1.5 O=C1CCNCC1O Amb27230548 [0,0,0,1,0,0|2,0,1]=4 3013 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,0,0,1,0,0|2,0,1]=4 3014 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,0,0,1,0,0|2,0,1]=4 3015 B8R1.5 O=C1CCOCC1F Amb19958536 [0,0,0,1,0,0|2,0,1]=4 3016 B8R1.5 O=C1CCOCC1O Amb26966688 [0,0,0,1,0,0|1,0,1]=3 3017 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,0,0,1,0,0|2,0,1]=4 3018 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,0,0,1,0,0|2,0,1]=4 3019 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,0,0,1,0,0|2,0,1]=4 3020 B8R1.5 O=C1CCSCC1O Amb27762936 [0,0,0,1,0,0|1,1,1]=4 3021 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,0,0,1,0,0|1,1,1]=4 3022 B8R1.5 O=C1COCCC1Br Amb24416092 [0,0,0,1,0,0|1,0,2]=4 3023 B8R1.5 O=C1COCCC1F Amb28048950 [0,0,0,1,0,0|1,0,2]=4 3024 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,0,0,1,0,0|1,0,2]=4 3025 B8R1.5 OC1CCCCC1Br Amb17594580 [0,0,0,1,0,0|2,0,0]=3 3026 B8R1.5 OC1CCCCC1F Amb28141588 [0,0,0,1,0,0|2,0,0]=3 3027 B8R1.5 OC1CCCCC1I Amb10601565 [0,0,0,1,0,0|2,0,0]=3 3028 B8R1.5 OC1CCCCC1O Amb534699 [0,0,0,1,0,0|2,0,0]=3 3029 B8R1.5 OC1CCCCC1S Amb28061858 [0,0,0,1,0,0|2,0,0]=3 3030 B8R1.5 OC1CCCOC1O Amb27594250 [0,0,0,1,0,0|3,0,0]=4 3031 B8R1.5 OC1CCNCC1F Amb23401846 [0,0,0,1,0,0|3,0,0]=4 3032 B8R1.5 OC1CCNCC1F Amb23401853 [0,0,0,1,0,0|3,0,0]=4 3033 B8R1.5 OC1CCNCC1O Amb22493773 [0,0,0,1,0,0|2,0,0]=3 3034 B8R1.5 OC1CCNCC1O Amb33992215 [0,0,0,1,0,0|2,0,0]=3 3035 B8R1.5 OC1CCOCC1F Amb28079111 [0,0,0,1,0,0|2,0,0]=3 3036 B8R1.5 OC1CCSCC1O Amb27211025 [0,0,0,1,0,0|1,1,0]=3 3037 B8R1.5 OC1CNCCC1F Amb22886287 [0,0,0,1,0,0|2,0,0]=3 3038 B8R1.5 OC1CNCCC1F Amb28423403 [0,0,0,1,0,0|2,0,0]=3 3039 B8R1.5 OC1COCCC1Br Amb27607882 [0,0,0,1,0,0|1,0,0]=2 3040 B8R1.5 OC1COCCC1Cl Amb27483869 [0,0,0,1,0,0|1,0,0]=2 3041 B8R1.5 OC1CSSCC1O Amb26894783 [0,0,0,1,0,0|2,1,0]=4 3042 B8R1.5 O[C@@H]1C=CCC[C@H]1Br Amb28245256 [0,0,0,1,0,0|2,0,1]=4 3043 B8R1.5 O[C@@H]1CC=CC[C@H]1Br Amb27666976 [0,0,0,1,0,0|2,0,1]=4 3044 B8R1.5 O[C@@H]1CC=CC[C@H]1Cl Amb27782069 [0,0,0,1,0,0|2,0,1]=4 3045 B8R1.5 O[C@@H]1CC=CC[C@H]1O Amb28318474 [0,0,0,1,0,0|2,0,1]=4 3046 B8R1.5 O[C@@H]1CCCC[C@@H]1Cl Amb8394050 [0,0,0,1,0,0|2,0,0]=3 3047 B8R1.5 O[C@@H]1CCCC[C@H]1Br Amb17940195 [0,0,0,1,0,0|2,0,0]=3 3048 B8R1.5 O[C@@H]1CCCC[C@H]1Cl Amb17844352 [0,0,0,1,0,0|2,0,0]=3 3049 B8R1.5 O[C@@H]1CCCC[C@H]1F Amb10606383 [0,0,0,1,0,0|2,0,0]=3 3050 B8R1.5 O[C@@H]1CCCC[C@H]1O Amb6754065 [0,0,0,1,0,0|2,0,0]=3 3051 B8R1.5 O[C@@H]1CCCC[C@H]1S Amb27205716 [0,0,0,1,0,0|2,0,0]=3 3052 B8R1.5 O[C@@H]1CCCO[C@H]1O Amb27659639 [0,0,0,1,0,0|3,0,0]=4 3053 B8R1.5 O[C@@H]1CCNC[C@@H]1F Amb22886301 [0,0,0,1,0,0|3,0,0]=4 3054 B8R1.5 O[C@@H]1CCNC[C@@H]1F Amb23439240 [0,0,0,1,0,0|3,0,0]=4 3055 B8R1.5 O[C@@H]1CCNC[C@H]1F Amb22886315 [0,0,0,1,0,0|3,0,0]=4 3056 B8R1.5 O[C@@H]1CCNC[C@H]1F Amb23439239 [0,0,0,1,0,0|3,0,0]=4 3057 B8R1.5 O[C@@H]1CCNC[C@H]1O Amb22746225 [0,0,0,1,0,0|2,0,0]=3 3058 B8R1.5 O[C@@H]1CCNC[C@H]1O Amb22748912 [0,0,0,1,0,0|2,0,0]=3 3059 B8R1.5 O[C@@H]1CCOC[C@@H]1F Amb26443063 [0,0,0,1,0,0|2,0,0]=3 3060 B8R1.5 O[C@@H]1CCOC[C@H]1F Amb25054496 [0,0,0,1,0,0|2,0,0]=3 3061 B8R1.5 O[C@@H]1CNCC[C@H]1F Amb22739017 [0,0,0,1,0,0|2,0,0]=3 3062 B8R1.5 O[C@@H]1CNCC[C@H]1F Amb23439238 [0,0,0,1,0,0|2,0,0]=3 3063 B8R1.5 O[C@@H]1CNNC[C@H]1O Amb27466405 [0,0,0,1,0,0|3,0,0]=4 3064 B8R1.5 O[C@@H]1COCC[C@H]1Br Amb32686594 [0,0,0,1,0,0|1,0,0]=2 3065 B8R1.5 O[C@@H]1COCC[C@H]1Cl Amb27791772 [0,0,0,1,0,0|1,0,0]=2 3066 B8R1.5 O[C@@H]1CSSC[C@@H]1O Amb17621830 [0,0,0,1,0,0|2,1,0]=4 3067 B8R1.5 O[C@@H]1CSSC[C@H]1O Amb2747253 [0,0,0,1,0,0|2,1,0]=4 3068 B8R1.5 O[C@@H]1OCCC[C@@H]1Cl Amb27788417 [0,0,0,1,0,0|3,0,0]=4 3069 B8R1.5 O[C@H]1CC=CC[C@@H]1S Amb27219069 [0,0,0,1,0,0|2,0,1]=4 3070 B8R1.5 O[C@H]1CCCC[C@@H]1Cl Amb27420202 [0,0,0,1,0,0|2,0,0]=3 3071 B8R1.5 O[C@H]1CCCC[C@@H]1F Amb26565801 [0,0,0,1,0,0|2,0,0]=3 3072 B8R1.5 O[C@H]1CCCC[C@@H]1O Amb2778553 [0,0,0,1,0,0|2,0,0]=3 3073 B8R1.5 O[C@H]1CCCC[C@H]1Br Amb8394049 [0,0,0,1,0,0|2,0,0]=3 3074 B8R1.5 O[C@H]1CCCC[C@H]1Cl Amb27629800 [0,0,0,1,0,0|2,0,0]=3 3075 B8R1.5 O[C@H]1CCCC[C@H]1O Amb2720739 [0,0,0,1,0,0|2,0,0]=3 3076 B8R1.5 O[C@H]1CCCC[C@H]1S Amb28205526 [0,0,0,1,0,0|2,0,0]=3 3077 B8R1.5 O[C@H]1CCNC[C@@H]1F Amb27850581 [0,0,0,1,0,0|3,0,0]=4 3078 B8R1.5 O[C@H]1CCNC[C@@H]1F Amb33801195 [0,0,0,1,0,0|3,0,0]=4 3079 B8R1.5 O[C@H]1CCNC[C@@H]1O Amb33805289 [0,0,0,1,0,0|2,0,0]=3 3080 B8R1.5 O[C@H]1CCNC[C@@H]1O Amb8630297 [0,0,0,1,0,0|2,0,0]=3 3081 B8R1.5 O[C@H]1CCNC[C@H]1F Amb32643985 [0,0,0,1,0,0|3,0,0]=4 3082 B8R1.5 O[C@H]1CCNC[C@H]1O Amb15701275 [0,0,0,1,0,0|2,0,0]=3 3083 B8R1.5 O[C@H]1CCNC[C@H]1O Amb22754314 [0,0,0,1,0,0|2,0,0]=3 3084 B8R1.5 O[C@H]1CCOC[C@@H]1F Amb34160539 [0,0,0,1,0,0|2,0,0]=3 3085 B8R1.5 O[C@H]1CCOC[C@H]1F Amb26389608 [0,0,0,1,0,0|2,0,0]=3 3086 B8R1.5 O[C@H]1CNCC[C@@H]1Cl Amb27960302 [0,0,0,1,0,0|2,0,0]=3 3087 B8R1.5 O[C@H]1CNCC[C@H]1Br Amb27211495 [0,0,0,1,0,0|2,0,0]=3 3088 B8R1.5 O[C@H]1CNCC[C@H]1F Amb33875431 [0,0,0,1,0,0|2,0,0]=3 3089 B8R1.5 O[C@H]1CNCC[C@H]1O Amb22406028 [0,0,0,1,0,0|2,0,0]=3 3090 B8R1.5 O[C@H]1CNCC[C@H]1O Amb8630296 [0,0,0,1,0,0|2,0,0]=3 3091 B8R1.5 O[C@H]1CONC[C@H]1O Amb31258099 [0,0,0,1,0,0|2,0,0]=3 3092 B8R1.5 O[C@H]1CONC[C@H]1O Amb32679452 [0,0,0,1,0,0|2,0,0]=3 3093 B8R1.5 O[C@H]1CSSC[C@@H]1O Amb27974094 [0,0,0,1,0,0|2,1,0]=4 3094 B8R1.5 SC1CCCCC1Cl Amb27875327 [0,0,0,1,0,0|2,1,0]=4 3095 B8R1.5 [NH-]C1CCCCC1[NH-] Amb20240925 [0,0,0,1,0,0|3,0,0]=4 3096 B8R1.5 [NH3+][C@@H]1CCCC[C@@H]1O Amb24112952 [0,0,0,1,0,0|2,0,0]=3 3097 B8R1.8 BrCC=C1CCCC1 Amb28458294 [0,0,0,1,0,0|2,0,1]=4 3098 B8R1.8 BrCCC1CCCC1 Amb18178329 [0,0,0,1,0,0|2,0,0]=3 3099 B8R1.8 BrCCC1CCCN1 Amb26066464 [0,0,0,1,0,0|3,0,0]=4 3100 B8R1.8 BrCCC1CCCN1 Amb32663240 [0,0,0,1,0,0|3,0,0]=4 3101 B8R1.8 BrCCC1CCCO1 Amb33547829 [0,0,0,1,0,0|2,0,0]=3 3102 B8R1.8 BrCCC1CCCS1 Amb33433092 [0,0,0,1,0,0|2,1,0]=4 3103 B8R1.8 BrCCC1CCNC1 Amb22274601 [0,0,0,1,0,0|3,0,0]=4 3104 B8R1.8 BrCCC1CCOC1 Amb15701388 [0,0,0,1,0,0|3,0,0]=4 3105 B8R1.8 BrCCC1CCSC1 Amb32688122 [0,0,0,1,0,0|3,0,0]=4 3106 B8R1.8 BrCCC1OCCO1 Amb3940103 [0,0,0,1,0,0|1,0,0]=2 3107 B8R1.8 BrCCC1OCCS1 Amb27634855 [0,0,0,1,0,0|1,1,0]=3 3108 B8R1.8 BrCCC1SCCS1 Amb25758690 [0,0,0,1,0,0|1,2,0]=4 3109 B8R1.8 BrCCN1CCCC1 Amb8387808 [0,0,0,1,0,0|2,0,0]=3 3110 B8R1.8 BrCCN1CCCC1 Amb8387809 [0,0,0,1,0,0|2,0,0]=3 3111 B8R1.8 BrCCN1CCCC1 Amb8631544 [0,0,0,1,0,0|2,0,0]=3 3112 B8R1.8 Br[Mg]CC1OCCO1 Amb16226924 [0,0,0,1,0,0|2,0,0]=3 3113 B8R1.8 Br[Zn]CC1OCCO1 Amb22000494 [0,0,0,1,0,0|2,0,0]=3 3114 B8R1.8 C#CCC1CCCC1 Amb2721549 [0,0,0,1,0,0|2,0,1]=4 3115 B8R1.8 C#CCC1CCCO1 Amb33318708 [0,0,0,1,0,0|1,0,2]=4 3116 B8R1.8 C#CCN1CCCC1 Amb17670646 [0,0,0,1,0,0|2,0,1]=4 3117 B8R1.8 C#CCN1CCCC1 Amb22085943 [0,0,0,1,0,0|2,0,1]=4 3118 B8R1.8 C#NCC1CCCC1 Amb31132340 [0,0,0,1,0,0|3,0,0]=4 3119 B8R1.8 C=CCC1CCCC1 Amb2721534 [0,0,0,1,0,0|2,0,1]=4 3120 B8R1.8 C=CCC1CCCO1 Amb33484168 [0,0,0,1,0,0|1,0,2]=4 3121 B8R1.8 C=CCN1CCCC1 Amb4018980 [0,0,0,1,0,0|2,0,1]=4 3122 B8R1.8 CCCC1=NCCO1 Amb4034543 [0,0,0,1,0,0|1,0,1]=3 3123 B8R1.8 CCCC1=NCCS1 Amb9805517 [0,0,0,1,0,0|1,1,1]=4 3124 B8R1.8 CCCC1C=CCC1 Amb4019564 [0,0,0,1,0,0|2,0,1]=4 3125 B8R1.8 CCCC1C=CCN1 Amb10608151 [0,0,0,1,0,0|2,0,1]=4 3126 B8R1.8 CCCC1CCCC1 Amb4019556 [0,0,0,1,0,0|2,0,0]=3 3127 B8R1.8 CCCC1CCCN1 Amb22587167 [0,0,0,1,0,0|2,0,0]=3 3128 B8R1.8 CCCC1CCCN1 Amb9714691 [0,0,0,1,0,0|2,0,0]=3 3129 B8R1.8 CCCC1CCNC1 Amb10607827 [0,0,0,1,0,0|3,0,0]=4 3130 B8R1.8 CCCC1CCNC1 Amb32414607 [0,0,0,1,0,0|3,0,0]=4 3131 B8R1.8 CCCC1CNCO1 Amb27391630 [0,0,0,1,0,0|2,0,0]=3 3132 B8R1.8 CCCC1NCCS1 Amb19515280 [0,0,0,1,0,0|1,1,0]=3 3133 B8R1.8 CCCC1NCCS1 Amb22059065 [0,0,0,1,0,0|1,1,0]=3 3134 B8R1.8 CCCC1OCCS1 Amb9786141 [0,0,0,1,0,0|0,1,0]=2 3135 B8R1.8 CCCN1CCCO1 Amb27589395 [0,0,0,1,0,0|2,0,0]=3 3136 B8R1.8 CCNB1CCCC1 Amb28072082 [0,0,0,1,0,0|3,0,0]=4 3137 B8R1.8 CCNC1CCCC1 Amb6250623 [0,0,0,1,0,0|3,0,0]=4 3138 B8R1.8 CCNC1CCCC1 Amb8503448 [0,0,0,1,0,0|3,0,0]=4 3139 B8R1.8 CCNC1CCCN1 Amb28133387 [0,0,0,1,0,0|3,0,0]=4 3140 B8R1.8 CCOC1CCCO1 Amb22228805 [0,0,0,1,0,0|2,0,0]=3 3141 B8R1.8 CCOC1OCCO1 Amb10569618 [0,0,0,1,0,0|1,0,0]=2 3142 B8R1.8 CCOC1OCCS1 Amb10569619 [0,0,0,1,0,0|1,1,0]=3 3143 B8R1.8 CCSC1CCCC1 Amb27764393 [0,0,0,1,0,0|3,0,0]=4 3144 B8R1.8 CNCC1=CCCO1 Amb28048914 [0,0,0,1,0,0|2,0,1]=4 3145 B8R1.8 CNCC1CCCC1 Amb13951600 [0,0,0,1,0,0|3,0,0]=4 3146 B8R1.8 CNCC1CCCC1 Amb8853677 [0,0,0,1,0,0|3,0,0]=4 3147 B8R1.8 CNCC1CCCN1 Amb17231816 [0,0,0,1,0,0|3,0,0]=4 3148 B8R1.8 CNCC1CCCN1 Amb32753028 [0,0,0,1,0,0|3,0,0]=4 3149 B8R1.8 CNCC1CCCO1 Amb33483486 [0,0,0,1,0,0|2,0,0]=3 3150 B8R1.8 CNCC1CCCO1 Amb9714028 [0,0,0,1,0,0|2,0,0]=3 3151 B8R1.8 CNCC1CCCS1 Amb27859030 [0,0,0,1,0,0|2,1,0]=4 3152 B8R1.8 CNCC1OCCO1 Amb3941372 [0,0,0,1,0,0|1,0,0]=2 3153 B8R1.8 CNC[C@@H]1CCCN1 Amb25189015 [0,0,0,1,0,0|3,0,0]=4 3154 B8R1.8 CNC[C@@H]1CCCN1 Amb32662530 [0,0,0,1,0,0|3,0,0]=4 3155 B8R1.8 CNC[C@@H]1CCCO1 Amb27153906 [0,0,0,1,0,0|2,0,0]=3 3156 B8R1.8 CNC[C@H]1CCCN1 Amb24763299 [0,0,0,1,0,0|3,0,0]=4 3157 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,0,0,1,0,0|2,0,0]=3 3158 B8R1.8 COCC1CCCC1 Amb25264349 [0,0,0,1,0,0|3,0,0]=4 3159 B8R1.8 COCC1CCCN1 Amb20622354 [0,0,0,1,0,0|3,0,0]=4 3160 B8R1.8 COCC1CCCN1 Amb2234472 [0,0,0,1,0,0|3,0,0]=4 3161 B8R1.8 COCN1CCCC1 Amb28281272 [0,0,0,1,0,0|3,0,0]=4 3162 B8R1.8 COC[C@@H]1CCCN1 Amb24182058 [0,0,0,1,0,0|3,0,0]=4 3163 B8R1.8 COC[C@@H]1CCCN1 Amb2713317 [0,0,0,1,0,0|3,0,0]=4 3164 B8R1.8 COC[C@H]1CCCN1 Amb22293917 [0,0,0,1,0,0|3,0,0]=4 3165 B8R1.8 COC[C@H]1CCCN1 Amb6298382 [0,0,0,1,0,0|3,0,0]=4 3166 B8R1.8 CSCC1CCCN1 Amb2237163 [0,0,0,1,0,0|3,0,0]=4 3167 B8R1.8 CSCC1CCCO1 Amb26894759 [0,0,0,1,0,0|2,0,0]=3 3168 B8R1.8 CSCC1OCCO1 Amb27810244 [0,0,0,1,0,0|1,0,0]=2 3169 B8R1.8 CSC[C@@H]1CCCN1 Amb27230855 [0,0,0,1,0,0|3,0,0]=4 3170 B8R1.8 C\C=C\C1OCCO1 Amb17334061 [0,0,0,1,0,0|0,0,2]=3 3171 B8R1.8 ClCCC1=NCCO1 Amb28399375 [0,0,0,1,0,0|2,0,1]=4 3172 B8R1.8 ClCCC1CCCC1 Amb27452931 [0,0,0,1,0,0|2,0,0]=3 3173 B8R1.8 ClCCC1CCCO1 Amb25888267 [0,0,0,1,0,0|2,0,0]=3 3174 B8R1.8 ClCCC1CCOC1 Amb24532020 [0,0,0,1,0,0|3,0,0]=4 3175 B8R1.8 ClCCC1CCSC1 Amb32688121 [0,0,0,1,0,0|3,0,0]=4 3176 B8R1.8 ClCCC1COCO1 Amb27421374 [0,0,0,1,0,0|3,0,0]=4 3177 B8R1.8 ClCCN1CCCC1 Amb6608907 [0,0,0,1,0,0|2,0,0]=3 3178 B8R1.8 ClCCN1CCCC1 Amb8387807 [0,0,0,1,0,0|2,0,0]=3 3179 B8R1.8 ClCC[C@@H]1CCCN1 Amb27874071 [0,0,0,1,0,0|3,0,0]=4 3180 B8R1.8 ClCC[C@H]1CCNC1 Amb27788406 [0,0,0,1,0,0|3,0,0]=4 3181 B8R1.8 ClCC[NH+]1CCCC1 Amb24113840 [0,0,0,1,0,0|2,0,0]=3 3182 B8R1.8 ClCOC1CCCC1 Amb28435517 [0,0,0,1,0,0|3,0,0]=4 3183 B8R1.8 FCCC1CCCN1 Amb27798978 [0,0,0,1,0,0|3,0,0]=4 3184 B8R1.8 FCCC1CCNC1 Amb21959205 [0,0,0,1,0,0|3,0,0]=4 3185 B8R1.8 FCCN1CCCC1 Amb27837554 [0,0,0,1,0,0|2,0,0]=3 3186 B8R1.8 FCCN1CCCN1 Amb27960655 [0,0,0,1,0,0|3,0,0]=4 3187 B8R1.8 ICCC1CCCC1 Amb24383289 [0,0,0,1,0,0|2,0,0]=3 3188 B8R1.8 ICCC1CCCO1 Amb27860272 [0,0,0,1,0,0|2,0,0]=3 3189 B8R1.8 ICCC1CCNC1 Amb22296926 [0,0,0,1,0,0|3,0,0]=4 3190 B8R1.8 ICCC1OCCO1 Amb27478594 [0,0,0,1,0,0|1,0,0]=2 3191 B8R1.8 ICCN1CCCC1 Amb25057107 [0,0,0,1,0,0|2,0,0]=3 3192 B8R1.8 ICCN1CCCC1 Amb32669018 [0,0,0,1,0,0|2,0,0]=3 3193 B8R1.8 N#CCC1CCCC1 Amb17138362 [0,0,0,1,0,0|2,0,1]=4 3194 B8R1.8 N#CCC1CCCO1 Amb9702955 [0,0,0,1,0,0|2,0,1]=4 3195 B8R1.8 N#CCC1OCCO1 Amb17334055 [0,0,0,1,0,0|1,0,1]=3 3196 B8R1.8 N#CCN1CCCC1 Amb4010746 [0,0,0,1,0,0|2,0,1]=4 3197 B8R1.8 N#CC[NH+]1CCCC1 Amb22728209 [0,0,0,1,0,0|2,0,1]=4 3198 B8R1.8 NCCC1=CCCC1 Amb18641665 [0,0,0,1,0,0|2,0,1]=4 3199 B8R1.8 NCCC1=CCCC1 Amb32681165 [0,0,0,1,0,0|2,0,1]=4 3200 B8R1.8 NCCC1=NCCO1 Amb27665941 [0,0,0,1,0,0|2,0,1]=4 3201 B8R1.8 NCCC1CCCC1 Amb1089736 [0,0,0,1,0,0|2,0,0]=3 3202 B8R1.8 NCCC1CCCC1 Amb2099819 [0,0,0,1,0,0|2,0,0]=3 3203 B8R1.8 NCCC1CCCC1 Amb7969704 [0,0,0,1,0,0|2,0,0]=3 3204 B8R1.8 NCCC1CCCN1 Amb18954128 [0,0,0,1,0,0|3,0,0]=4 3205 B8R1.8 NCCC1CCCN1 Amb32651929 [0,0,0,1,0,0|3,0,0]=4 3206 B8R1.8 NCCC1CCCO1 Amb13952618 [0,0,0,1,0,0|2,0,0]=3 3207 B8R1.8 NCCC1CCCO1 Amb9708331 [0,0,0,1,0,0|2,0,0]=3 3208 B8R1.8 NCCC1CCCS1 Amb32656287 [0,0,0,1,0,0|2,1,0]=4 3209 B8R1.8 NCCC1CCCS1 Amb32656288 [0,0,0,1,0,0|2,1,0]=4 3210 B8R1.8 NCCC1CCNC1 Amb18833027 [0,0,0,1,0,0|3,0,0]=4 3211 B8R1.8 NCCC1CCNC1 Amb32675662 [0,0,0,1,0,0|3,0,0]=4 3212 B8R1.8 NCCC1CCOC1 Amb15701360 [0,0,0,1,0,0|3,0,0]=4 3213 B8R1.8 NCCC1CCOC1 Amb22001860 [0,0,0,1,0,0|3,0,0]=4 3214 B8R1.8 NCCC1CCSC1 Amb18199484 [0,0,0,1,0,0|3,0,0]=4 3215 B8R1.8 NCCC1OCCO1 Amb3939988 [0,0,0,1,0,0|1,0,0]=2 3216 B8R1.8 NCCC1SCCS1 Amb25317389 [0,0,0,1,0,0|1,2,0]=4 3217 B8R1.8 NCCN1CCCC1 Amb10610085 [0,0,0,1,0,0|2,0,0]=3 3218 B8R1.8 NCCN1CCCC1 Amb2720335 [0,0,0,1,0,0|2,0,0]=3 3219 B8R1.8 NCCN1CCCN1 Amb27461471 [0,0,0,1,0,0|3,0,0]=4 3220 B8R1.8 NCCN1CCCO1 Amb27629498 [0,0,0,1,0,0|3,0,0]=4 3221 B8R1.8 NCC[C@@H]1CCCN1 Amb28341793 [0,0,0,1,0,0|3,0,0]=4 3222 B8R1.8 NCC[C@H]1CCCN1 Amb27984256 [0,0,0,1,0,0|3,0,0]=4 3223 B8R1.8 NCC[C@H]1CCCN1 Amb32651958 [0,0,0,1,0,0|3,0,0]=4 3224 B8R1.8 NCC[C@H]1CCCO1 Amb32664981 [0,0,0,1,0,0|2,0,0]=3 3225 B8R1.8 NCC[C@H]1CCCO1 Amb32670639 [0,0,0,1,0,0|2,0,0]=3 3226 B8R1.8 NCC[C@H]1CCNC1 Amb27633932 [0,0,0,1,0,0|3,0,0]=4 3227 B8R1.8 NCNC1CCCC1 Amb27869404 [0,0,0,1,0,0|3,0,0]=4 3228 B8R1.8 NNCC1CCCC1 Amb10608985 [0,0,0,1,0,0|3,0,0]=4 3229 B8R1.8 NNCC1CCCC1 Amb6249695 [0,0,0,1,0,0|3,0,0]=4 3230 B8R1.8 NNCC1CCCC1 Amb9677429 [0,0,0,1,0,0|3,0,0]=4 3231 B8R1.8 NNCC1CCCO1 Amb10610188 [0,0,0,1,0,0|3,0,0]=4 3232 B8R1.8 NNCC1CCCO1 Amb10610215 [0,0,0,1,0,0|3,0,0]=4 3233 B8R1.8 NNCC1CCCO1 Amb6250908 [0,0,0,1,0,0|3,0,0]=4 3234 B8R1.8 NNC[C@@H]1CCCO1 Amb28396855 [0,0,0,1,0,0|3,0,0]=4 3235 B8R1.8 NNC[C@H]1CCCO1 Amb28057953 [0,0,0,1,0,0|3,0,0]=4 3236 B8R1.8 NOCC1CCCC1 Amb21858976 [0,0,0,1,0,0|3,0,0]=4 3237 B8R1.8 NOCC1CCCC1 Amb25189022 [0,0,0,1,0,0|3,0,0]=4 3238 B8R1.8 NOCC1CCCO1 Amb17231830 [0,0,0,1,0,0|3,0,0]=4 3239 B8R1.8 O=CCC1CCCC1 Amb17672924 [0,0,0,1,0,0|1,0,2]=4 3240 B8R1.8 O=CCC1CCCO1 Amb18641800 [0,0,0,1,0,0|2,0,1]=4 3241 B8R1.8 O=CCC1OCCO1 Amb18831794 [0,0,0,1,0,0|1,0,1]=3 3242 B8R1.8 O=CCN1CCCC1 Amb33801466 [0,0,0,1,0,0|1,0,2]=4 3243 B8R1.8 OCCC1CC=CC1 Amb24482557 [0,0,0,1,0,0|1,0,2]=4 3244 B8R1.8 OCCC1CCCC1 Amb2721230 [0,0,0,1,0,0|1,0,0]=2 3245 B8R1.8 OCCC1CCCN1 Amb22754588 [0,0,0,1,0,0|2,0,0]=3 3246 B8R1.8 OCCC1CCCN1 Amb8630850 [0,0,0,1,0,0|2,0,0]=3 3247 B8R1.8 OCCC1CCCO1 Amb20622383 [0,0,0,1,0,0|2,0,0]=3 3248 B8R1.8 OCCC1CCCS1 Amb25998759 [0,0,0,1,0,0|2,0,0]=3 3249 B8R1.8 OCCC1CCNC1 Amb22406195 [0,0,0,1,0,0|2,0,0]=3 3250 B8R1.8 OCCC1CCNC1 Amb9782130 [0,0,0,1,0,0|2,0,0]=3 3251 B8R1.8 OCCC1CCOC1 Amb33541612 [0,0,0,1,0,0|2,0,0]=3 3252 B8R1.8 OCCC1CCSC1 Amb18202827 [0,0,0,1,0,0|2,0,0]=3 3253 B8R1.8 OCCC1CSCN1 Amb32946528 [0,0,0,1,0,0|3,0,0]=4 3254 B8R1.8 OCCC1NCCS1 Amb24446611 [0,0,0,1,0,0|2,1,0]=4 3255 B8R1.8 OCCC1OCCO1 Amb22264778 [0,0,0,1,0,0|1,0,0]=2 3256 B8R1.8 OCCN1CCC=N1 Amb15701438 [0,0,0,1,0,0|2,0,1]=4 3257 B8R1.8 OCCN1CCCC1 Amb22002207 [0,0,0,1,0,0|1,0,0]=2 3258 B8R1.8 OCCN1CCCC1 Amb535402 [0,0,0,1,0,0|1,0,0]=2 3259 B8R1.8 OCCN1CCOC1 Amb2721125 [0,0,0,1,0,0|2,0,0]=3 3260 B8R1.8 OCC[C@@H]1C=CCO1 Amb27206175 [0,0,0,1,0,0|2,0,1]=4 3261 B8R1.8 OCC[C@@H]1CCCN1 Amb8630851 [0,0,0,1,0,0|2,0,0]=3 3262 B8R1.8 OCC[C@@H]1CCCO1 Amb27836253 [0,0,0,1,0,0|2,0,0]=3 3263 B8R1.8 OCC[C@@H]1CCNC1 Amb22299725 [0,0,0,1,0,0|2,0,0]=3 3264 B8R1.8 OCC[C@@H]1CCNC1 Amb24411426 [0,0,0,1,0,0|2,0,0]=3 3265 B8R1.8 OCC[C@H]1CCCO1 Amb27431469 [0,0,0,1,0,0|2,0,0]=3 3266 B8R1.8 OCC[C@H]1CCNC1 Amb22299669 [0,0,0,1,0,0|2,0,0]=3 3267 B8R1.8 OCC[C@H]1CCNC1 Amb27785890 [0,0,0,1,0,0|2,0,0]=3 3268 B8R1.8 ONCC1CCCC1 Amb25952639 [0,0,0,1,0,0|2,0,0]=3 3269 B8R1.8 ONCC1CCCO1 Amb25684501 [0,0,0,1,0,0|3,0,0]=4 3270 B8R1.8 ONCC1CCCS1 Amb33416564 [0,0,0,1,0,0|3,0,0]=4 3271 B8R1.8 ONCC1CCOC1 Amb25935174 [0,0,0,1,0,0|3,0,0]=4 3272 B8R1.8 ONCC1CCSC1 Amb27981633 [0,0,0,1,0,0|3,0,0]=4 3273 B8R1.8 O\N=C\C1CCCC1 Amb27424660 [0,0,0,1,0,0|2,0,1]=4 3274 B8R1.8 SCCC1CCCC1 Amb26475267 [0,0,0,1,0,0|1,1,0]=3 3275 B8R1.8 SCCC1CCCO1 Amb27220272 [0,0,0,1,0,0|2,0,0]=3 3276 B8R1.8 SCCC1CCCS1 Amb33415373 [0,0,0,1,0,0|2,1,0]=4 3277 B8R1.8 SCCC1CCNC1 Amb22298487 [0,0,0,1,0,0|2,1,0]=4 3278 B8R1.8 SCCC1CCOC1 Amb27783671 [0,0,0,1,0,0|2,1,0]=4 3279 B8R1.8 SCCC1CCSC1 Amb33141475 [0,0,0,1,0,0|2,1,0]=4 3280 B8R1.8 SCCN1CCCC1 Amb7776944 [0,0,0,1,0,0|1,1,0]=3 3281 B8R1.8 SCCN1CCSC1 Amb22230991 [0,0,0,1,0,0|2,1,0]=4 3282 B8R1.8 [C-]#[N+]CC1CCCC1 Amb33315796 [0,0,0,1,0,0|3,0,0]=4 3283 B8R1.8 [C-]#[N+]CC1CCCO1 Amb3973129 [0,0,0,1,0,0|2,0,1]=4 3284 B8R1.9 C#CCCC1CC1C Amb33143874 [0,0,0,1,0,0|2,0,1]=4 3285 B8R1.9 C=C1CC1CCCO Amb27801929 [0,0,0,1,0,0|1,0,2]=4 3286 B8R1.9 CC1CC1CCC#N Amb33146005 [0,0,0,1,0,0|2,0,1]=4 3287 B8R1.9 CC1CC1CCC=O Amb33143873 [0,0,0,1,0,0|1,0,2]=4 3288 B8R1.9 CC1CC1CCCBr Amb33431531 [0,0,0,1,0,0|2,0,0]=3 3289 B8R1.9 CC1CC1CCCN Amb33224007 [0,0,0,1,0,0|2,0,0]=3 3290 B8R1.9 CC1CC1CCCO Amb33213606 [0,0,0,1,0,0|1,0,0]=2 3291 B8R1.9 CC1CC1CCCS Amb33143845 [0,0,0,1,0,0|1,1,0]=3 3292 B8R1.9 CC1CC1CCON Amb33144254 [0,0,0,1,0,0|3,0,0]=4 3293 B8R1.9 CC1CC1NCC#N Amb18285947 [0,0,0,1,0,0|2,0,1]=4 3294 B8R1.9 CC1CC1NCCF Amb27765088 [0,0,0,1,0,0|2,0,0]=3 3295 B8R1.9 CC1CC1NCCO Amb18298792 [0,0,0,1,0,0|1,0,0]=2 3296 B8R1.9 CC1CC1OCCN Amb33144888 [0,0,0,1,0,0|1,0,0]=2 3297 B8R1.9 CC1CC1\C=C\CN Amb33144897 [0,0,0,1,0,0|2,0,1]=4 3298 B8R1.9 CC1CC1\C=C\CO Amb33358423 [0,0,0,1,0,0|1,0,1]=3 3299 B8R1.9 CC1OC1CCCBr Amb28383540 [0,0,0,1,0,0|3,0,0]=4 3300 B8R1.9 CC1OC1CCCO Amb28344681 [0,0,0,1,0,0|2,0,0]=3 3301 B8R1.9 CCCCC1CC1N Amb25989937 [0,0,0,1,0,0|2,0,0]=3 3302 B8R1.9 CCCCC1OC1O Amb27493204 [0,0,0,1,0,0|2,0,0]=3 3303 B8R1.9 CCCC[C@@H]1C[C@@H]1Cl Amb27857045 [0,0,0,1,0,0|2,0,0]=3 3304 B8R1.9 CCCC[C@@H]1C[C@H]1N Amb27188372 [0,0,0,1,0,0|2,0,0]=3 3305 B8R1.9 CCCO[C@@H]1C[C@H]1N Amb33347099 [0,0,0,1,0,0|2,0,0]=3 3306 B8R1.9 CCSCC1CC1N Amb33324026 [0,0,0,1,0,0|3,0,0]=4 3307 B8R1.9 CCSC[C@@H]1C[C@H]1N Amb33324037 [0,0,0,1,0,0|3,0,0]=4 3308 B8R1.9 CNCCC1CC1C Amb33359776 [0,0,0,1,0,0|3,0,0]=4 3309 B8R1.9 COCCC1CC1N Amb33377825 [0,0,0,1,0,0|3,0,0]=4 3310 B8R1.9 COCC[C@@H]1C[C@H]1N Amb33377826 [0,0,0,1,0,0|3,0,0]=4 3311 B8R1.9 CSCCC1CC1N Amb33198754 [0,0,0,1,0,0|3,0,0]=4 3312 B8R1.9 CSCC[C@@H]1C[C@H]1N Amb33198755 [0,0,0,1,0,0|3,0,0]=4 3313 B8R1.9 C[C@@H]1C[C@H]1NCCO Amb35750313 [0,0,0,1,0,0|1,0,0]=2 3314 B8R1.9 C[C@@H]1C[C@H]1OCCO Amb28430706 [0,0,0,1,0,0|0,0,0]=1 3315 B8R1.9 C[C@H]1C[C@H]1OCCCl Amb27420175 [0,0,0,1,0,0|1,0,0]=2 3316 B8R1.9 C[C@H]1O[C@@H]1CCCCl Amb27229206 [0,0,0,1,0,0|3,0,0]=4 3317 B8R1.9 C[C@H]1O[C@H]1CCCBr Amb27863536 [0,0,0,1,0,0|3,0,0]=4 3318 B8R1.9 O[C@@H]1C[C@H]1CCCCl Amb27202822 [0,0,0,1,0,0|2,0,0]=3 3319 B8R1.9 O[C@H]1C[C@@H]1CCCCl Amb27428217 [0,0,0,1,0,0|2,0,0]=3 3320 B8R1.9 [C-]#[N+]CCC1CC1C Amb33144265 [0,0,0,1,0,0|3,0,0]=4 3321 B8R1.10 BrCCCC1CCC1 Amb25756718 [0,0,0,1,0,0|2,0,0]=3 3322 B8R1.10 BrCCCN1CCC1 Amb24412145 [0,0,0,1,0,0|3,0,0]=4 3323 B8R1.10 BrCCNC1CCC1 Amb27227343 [0,0,0,1,0,0|2,0,0]=3 3324 B8R1.10 BrCCOC1CCC1 Amb18796095 [0,0,0,1,0,0|1,0,0]=2 3325 B8R1.10 BrCCOC1COC1 Amb33456412 [0,0,0,1,0,0|2,0,0]=3 3326 B8R1.10 BrC\C=C\C1CCC1 Amb27448944 [0,0,0,1,0,0|2,0,1]=4 3327 B8R1.10 C#CCCC1CCC1 Amb33313828 [0,0,0,1,0,0|2,0,1]=4 3328 B8R1.10 C#CCNC1CCC1 Amb18957035 [0,0,0,1,0,0|2,0,1]=4 3329 B8R1.10 C#CCOC1CCC1 Amb23598916 [0,0,0,1,0,0|1,0,1]=3 3330 B8R1.10 C#CCOC1CNC1 Amb21956108 [0,0,0,1,0,0|2,0,1]=4 3331 B8R1.10 C#CCOC1CNC1 Amb22011668 [0,0,0,1,0,0|2,0,1]=4 3332 B8R1.10 C#CCOC1COC1 Amb32685226 [0,0,0,1,0,0|2,0,1]=4 3333 B8R1.10 C=CCCC1CCC1 Amb35680297 [0,0,0,1,0,0|2,0,1]=4 3334 B8R1.10 C=CCNC1CCC1 Amb18291589 [0,0,0,1,0,0|2,0,1]=4 3335 B8R1.10 C=CCOC1CNC1 Amb21956109 [0,0,0,1,0,0|2,0,1]=4 3336 B8R1.10 C=CCOC1COC1 Amb22737293 [0,0,0,1,0,0|2,0,1]=4 3337 B8R1.10 CCCCC1CCN1 Amb25353385 [0,0,0,1,0,0|2,0,0]=3 3338 B8R1.10 CCCCC1CNC1 Amb27589087 [0,0,0,1,0,0|3,0,0]=4 3339 B8R1.10 CCCNC1CCC1 Amb18989245 [0,0,0,1,0,0|2,0,0]=3 3340 B8R1.10 CCCNC1CNC1 Amb24374352 [0,0,0,1,0,0|3,0,0]=4 3341 B8R1.10 CCCNC1COC1 Amb15693523 [0,0,0,1,0,0|3,0,0]=4 3342 B8R1.10 CCCOC1CNC1 Amb18301144 [0,0,0,1,0,0|2,0,0]=3 3343 B8R1.10 CCCOC1CNC1 Amb22489787 [0,0,0,1,0,0|2,0,0]=3 3344 B8R1.10 CCNCC1CCC1 Amb33545240 [0,0,0,1,0,0|3,0,0]=4 3345 B8R1.10 CCNCC1CCC1 Amb8853715 [0,0,0,1,0,0|3,0,0]=4 3346 B8R1.10 CCNCC1CCN1 Amb27228331 [0,0,0,1,0,0|3,0,0]=4 3347 B8R1.10 CCSCC1CCC1 Amb27838037 [0,0,0,1,0,0|3,0,0]=4 3348 B8R1.10 CCSCC1CCN1 Amb33324020 [0,0,0,1,0,0|3,0,0]=4 3349 B8R1.10 CNCCC1CCC1 Amb23580285 [0,0,0,1,0,0|3,0,0]=4 3350 B8R1.10 CNCCN1CCC1 Amb26612442 [0,0,0,1,0,0|3,0,0]=4 3351 B8R1.10 COCCC1CCN1 Amb27613131 [0,0,0,1,0,0|3,0,0]=4 3352 B8R1.10 COCOC1CNC1 Amb26370338 [0,0,0,1,0,0|3,0,0]=4 3353 B8R1.10 CSCCC1CCN1 Amb33198741 [0,0,0,1,0,0|3,0,0]=4 3354 B8R1.10 CSCOC1CCC1 Amb27956432 [0,0,0,1,0,0|2,0,0]=3 3355 B8R1.10 ClCCCN1CCC1 Amb27220226 [0,0,0,1,0,0|3,0,0]=4 3356 B8R1.10 ClCCOC1CCC1 Amb25277094 [0,0,0,1,0,0|1,0,0]=2 3357 B8R1.10 FCCCC1CNC1 Amb33196439 [0,0,0,1,0,0|3,0,0]=4 3358 B8R1.10 FCCNC1CNC1 Amb28189801 [0,0,0,1,0,0|3,0,0]=4 3359 B8R1.10 FCCOC1CNC1 Amb21956400 [0,0,0,1,0,0|2,0,0]=3 3360 B8R1.10 FCCOC1CNC1 Amb22011644 [0,0,0,1,0,0|2,0,0]=3 3361 B8R1.10 FCCOC1CNC1 Amb22898973 [0,0,0,1,0,0|2,0,0]=3 3362 B8R1.10 ICCCC1CCC1 Amb29849579 [0,0,0,1,0,0|2,0,0]=3 3363 B8R1.10 ICCOC1CCC1 Amb35626247 [0,0,0,1,0,0|1,0,0]=2 3364 B8R1.10 N#CCCC1CCC1 Amb26370301 [0,0,0,1,0,0|2,0,1]=4 3365 B8R1.10 N#CCOC1CCC1 Amb24435052 [0,0,0,1,0,0|1,0,1]=3 3366 B8R1.10 N#CCOC1CNC1 Amb27874945 [0,0,0,1,0,0|2,0,1]=4 3367 B8R1.10 NCCCC1CCC1 Amb23570814 [0,0,0,1,0,0|2,0,0]=3 3368 B8R1.10 NCCCC1CCC1 Amb28934907 [0,0,0,1,0,0|2,0,0]=3 3369 B8R1.10 NCCCN1CCC1 Amb22039460 [0,0,0,1,0,0|3,0,0]=4 3370 B8R1.10 NCCNC1CCC1 Amb18989453 [0,0,0,1,0,0|2,0,0]=3 3371 B8R1.10 NCCNC1CNC1 Amb27658321 [0,0,0,1,0,0|3,0,0]=4 3372 B8R1.10 NCCNC1COC1 Amb22736604 [0,0,0,1,0,0|3,0,0]=4 3373 B8R1.10 NCCOC1CCC1 Amb18993208 [0,0,0,1,0,0|1,0,0]=2 3374 B8R1.10 NCCOC1CCC1 Amb28990915 [0,0,0,1,0,0|1,0,0]=2 3375 B8R1.10 NCCOC1COC1 Amb23512834 [0,0,0,1,0,0|2,0,0]=3 3376 B8R1.10 NCCOC1CSC1 Amb28196182 [0,0,0,1,0,0|2,0,0]=3 3377 B8R1.10 NCCSC1CCC1 Amb28049037 [0,0,0,1,0,0|1,1,0]=3 3378 B8R1.10 NC\C=C\C1CCC1 Amb33449322 [0,0,0,1,0,0|2,0,1]=4 3379 B8R1.10 NNCCC1CCC1 Amb27855874 [0,0,0,1,0,0|3,0,0]=4 3380 B8R1.10 NNCCC1CCO1 Amb27209825 [0,0,0,1,0,0|3,0,0]=4 3381 B8R1.10 NOCCC1CCC1 Amb27779680 [0,0,0,1,0,0|3,0,0]=4 3382 B8R1.10 O=CCCC1CCC1 Amb27244128 [0,0,0,1,0,0|1,0,2]=4 3383 B8R1.10 O=CCCC1CCO1 Amb28056173 [0,0,0,1,0,0|2,0,1]=4 3384 B8R1.10 O=CCOC1COC1 Amb27775737 [0,0,0,1,0,0|1,0,2]=4 3385 B8R1.10 OCCCC1CCC1 Amb23570813 [0,0,0,1,0,0|1,0,0]=2 3386 B8R1.10 OCCCC1CCN1 Amb27792141 [0,0,0,1,0,0|2,0,0]=3 3387 B8R1.10 OCCCC1CNC1 Amb22737371 [0,0,0,1,0,0|2,0,0]=3 3388 B8R1.10 OCCCN1CCC1 Amb22292344 [0,0,0,1,0,0|2,0,0]=3 3389 B8R1.10 OCCNC1CCC1 Amb18982433 [0,0,0,1,0,0|1,0,0]=2 3390 B8R1.10 OCCNC1CNC1 Amb27791573 [0,0,0,1,0,0|2,0,0]=3 3391 B8R1.10 OCCNC1COC1 Amb22737363 [0,0,0,1,0,0|2,0,0]=3 3392 B8R1.10 OCCNC1CSC1 Amb28049330 [0,0,0,1,0,0|2,0,0]=3 3393 B8R1.10 OCCOC1CCC1 Amb20622528 [0,0,0,1,0,0|0,0,0]=1 3394 B8R1.10 OCCOC1CNC1 Amb25262576 [0,0,0,1,0,0|1,0,0]=2 3395 B8R1.10 OCCOC1CNC1 Amb32664026 [0,0,0,1,0,0|1,0,0]=2 3396 B8R1.10 OCCOC1CNC1 Amb35752857 [0,0,0,1,0,0|1,0,0]=2 3397 B8R1.10 OCCOC1COC1 Amb26051158 [0,0,0,1,0,0|1,0,0]=2 3398 B8R1.10 OCCSC1CCC1 Amb27424672 [0,0,0,1,0,0|0,1,0]=2 3399 B8R1.10 OCNCC1CCC1 Amb27838337 [0,0,0,1,0,0|2,0,0]=3 3400 B8R1.10 OC\C=C\C1CCC1 Amb33079656 [0,0,0,1,0,0|1,0,1]=3 3401 B8R1.10 SCCCC1CCC1 Amb33197136 [0,0,0,1,0,0|1,1,0]=3 3402 B8R1.10 SCCNC1CNC1 Amb27200584 [0,0,0,1,0,0|2,1,0]=4 3403 B8R1.10 SCCOC1CCC1 Amb27424228 [0,0,0,1,0,0|0,1,0]=2 3404 B8R1.10 [C-]#[N+]CCC1CCC1 Amb27636011 [0,0,0,1,0,0|3,0,0]=4 3405 B8R1.11 C#CC1CCCC1O Amb22496803 [0,0,0,1,0,0|1,0,2]=4 3406 B8R1.11 C#CC1CNCC1O Amb32950267 [0,0,0,1,0,0|1,0,2]=4 3407 B8R1.11 C#CC1COCC1O Amb33213633 [0,0,0,1,0,0|0,0,2]=3 3408 B8R1.11 C#CC1NCCC1C Amb33169130 [0,0,0,1,0,0|2,0,1]=4 3409 B8R1.11 C#C[C@@H]1CCC[C@@H]1O Amb27186868 [0,0,0,1,0,0|1,0,2]=4 3410 B8R1.11 C#C[C@@H]1CCC[C@H]1O Amb25746628 [0,0,0,1,0,0|1,0,2]=4 3411 B8R1.11 C#C[C@@H]1CNC[C@H]1O Amb32950555 [0,0,0,1,0,0|1,0,2]=4 3412 B8R1.11 C#C[C@@H]1COC[C@H]1O Amb33078521 [0,0,0,1,0,0|0,0,2]=3 3413 B8R1.11 C#C[C@@H]1OCC[C@@H]1Cl Amb24520205 [0,0,0,1,0,0|2,0,1]=4 3414 B8R1.11 C#C[C@@H]1OCC[C@H]1Cl Amb33295212 [0,0,0,1,0,0|2,0,1]=4 3415 B8R1.11 C#C[C@H]1CCC[C@@H]1O Amb4019199 [0,0,0,1,0,0|1,0,2]=4 3416 B8R1.11 C#C[C@H]1OCC[C@H]1Cl Amb24624692 [0,0,0,1,0,0|2,0,1]=4 3417 B8R1.11 C=C1CCC[C@@H]1CO Amb27775869 [0,0,0,1,0,0|1,0,2]=4 3418 B8R1.11 C=C1COCC1CC Amb35646844 [0,0,0,1,0,0|1,0,1]=3 3419 B8R1.11 C=CC1CCCC1O Amb28460729 [0,0,0,1,0,0|1,0,2]=4 3420 B8R1.11 C=CC1CNCC1O Amb25189891 [0,0,0,1,0,0|1,0,2]=4 3421 B8R1.11 C=CC1COCC1N Amb27596175 [0,0,0,1,0,0|1,0,2]=4 3422 B8R1.11 C=CC1COCC1O Amb25869017 [0,0,0,1,0,0|0,0,2]=3 3423 B8R1.11 C=CC1OCCC1N Amb25080525 [0,0,0,1,0,0|2,0,1]=4 3424 B8R1.11 C=CC1OCCC1N Amb32661547 [0,0,0,1,0,0|2,0,1]=4 3425 B8R1.11 C=C[C@@H]1CCC[C@H]1O Amb22802079 [0,0,0,1,0,0|1,0,2]=4 3426 B8R1.11 C=C[C@@H]1CNC[C@H]1O Amb24561646 [0,0,0,1,0,0|1,0,2]=4 3427 B8R1.11 C=C[C@@H]1COC[C@H]1O Amb26438837 [0,0,0,1,0,0|0,0,2]=3 3428 B8R1.11 C=C[C@@H]1OCC[C@@H]1Cl Amb27959188 [0,0,0,1,0,0|2,0,1]=4 3429 B8R1.11 C=C[C@@H]1OCC[C@@H]1O Amb27215074 [0,0,0,1,0,0|2,0,1]=4 3430 B8R1.11 C=C[C@@H]1OCC[C@H]1N Amb27250501 [0,0,0,1,0,0|2,0,1]=4 3431 B8R1.11 C=C[C@@H]1OCC[C@H]1N Amb32661830 [0,0,0,1,0,0|2,0,1]=4 3432 B8R1.11 C=C[C@@H]1OCC[C@H]1O Amb28053797 [0,0,0,1,0,0|2,0,1]=4 3433 B8R1.11 C=C[C@H]1OCC[C@@H]1N Amb28283159 [0,0,0,1,0,0|2,0,1]=4 3434 B8R1.11 C=C[C@H]1OCC[C@H]1O Amb27210232 [0,0,0,1,0,0|2,0,1]=4 3435 B8R1.11 CC1CCC=C1CCl Amb27816584 [0,0,0,1,0,0|2,0,1]=4 3436 B8R1.11 CC1CCCC1C#N Amb24415234 [0,0,0,1,0,0|2,0,1]=4 3437 B8R1.11 CC1CCCC1C=O Amb18124243 [0,0,0,1,0,0|1,0,2]=4 3438 B8R1.11 CC1CCCC1CBr Amb27484135 [0,0,0,1,0,0|2,0,0]=3 3439 B8R1.11 CC1CCCC1CN Amb28990978 [0,0,0,1,0,0|2,0,0]=3 3440 B8R1.11 CC1CCCC1CN Amb33527076 [0,0,0,1,0,0|2,0,0]=3 3441 B8R1.11 CC1CCCC1NN Amb27839227 [0,0,0,1,0,0|3,0,0]=4 3442 B8R1.11 CC1CCNC1CN Amb28256754 [0,0,0,1,0,0|2,0,0]=3 3443 B8R1.11 CC1CCNC1CO Amb23441154 [0,0,0,1,0,0|1,0,0]=2 3444 B8R1.11 CC1CCOC1C=O Amb28068828 [0,0,0,1,0,0|0,0,2]=3 3445 B8R1.11 CC1CCOC1CCl Amb27780309 [0,0,0,1,0,0|1,0,0]=2 3446 B8R1.11 CC1CCOC1CI Amb28287052 [0,0,0,1,0,0|1,0,0]=2 3447 B8R1.11 CC1CNCC1CCl Amb27467789 [0,0,0,1,0,0|3,0,0]=4 3448 B8R1.11 CC1CNCC1CN Amb2696276 [0,0,0,1,0,0|3,0,0]=4 3449 B8R1.11 CC1CNCC1CO Amb25739981 [0,0,0,1,0,0|2,0,0]=3 3450 B8R1.11 CC1CNCC1CO Amb29083427 [0,0,0,1,0,0|2,0,0]=3 3451 B8R1.11 CC1COCC1C#N Amb29849568 [0,0,0,1,0,0|2,0,1]=4 3452 B8R1.11 CC1COCC1C=O Amb29882774 [0,0,0,1,0,0|2,0,1]=4 3453 B8R1.11 CC1COCC1CBr Amb35616316 [0,0,0,1,0,0|2,0,0]=3 3454 B8R1.11 CC1COCC1CCl Amb25889386 [0,0,0,1,0,0|2,0,0]=3 3455 B8R1.11 CC1COCC1CO Amb23399676 [0,0,0,1,0,0|2,0,0]=3 3456 B8R1.11 CC1COCC1NN Amb35616344 [0,0,0,1,0,0|3,0,0]=4 3457 B8R1.11 CC1COCC1NO Amb35635908 [0,0,0,1,0,0|3,0,0]=4 3458 B8R1.11 CC1NC=NC1CO Amb8389436 [0,0,0,1,0,0|2,0,1]=4 3459 B8R1.11 CC1NCCC1CCl Amb27249431 [0,0,0,1,0,0|3,0,0]=4 3460 B8R1.11 CC1NCCC1CN Amb18203354 [0,0,0,1,0,0|3,0,0]=4 3461 B8R1.11 CC1NCCC1CO Amb26463701 [0,0,0,1,0,0|2,0,0]=3 3462 B8R1.11 CC1OCCC1CBr Amb33550567 [0,0,0,1,0,0|3,0,0]=4 3463 B8R1.11 CC1OCCC1CCl Amb25882789 [0,0,0,1,0,0|3,0,0]=4 3464 B8R1.11 CC1OCCC1CO Amb26515717 [0,0,0,1,0,0|2,0,0]=3 3465 B8R1.11 CC1OCCC1CS Amb33426771 [0,0,0,1,0,0|2,1,0]=4 3466 B8R1.11 CC1SCCC1CN Amb27625343 [0,0,0,1,0,0|3,0,0]=4 3467 B8R1.11 CCC1=CCCC1C Amb26515704 [0,0,0,1,0,0|2,0,1]=4 3468 B8R1.11 CCC1=NCCC1C Amb26621065 [0,0,0,1,0,0|2,0,1]=4 3469 B8R1.11 CCC1C=CCC1Br Amb27794804 [0,0,0,1,0,0|2,0,1]=4 3470 B8R1.11 CCC1CCCC1=O Amb16187019 [0,0,0,1,0,0|1,0,2]=4 3471 B8R1.11 CCC1CCCC1C Amb25788505 [0,0,0,1,0,0|2,0,0]=3 3472 B8R1.11 CCC1CCCC1N Amb9776220 [0,0,0,1,0,0|2,0,0]=3 3473 B8R1.11 CCC1CCCC1O Amb20621081 [0,0,0,1,0,0|1,0,0]=2 3474 B8R1.11 CCC1CCCC1S Amb24759652 [0,0,0,1,0,0|1,1,0]=3 3475 B8R1.11 CCC1CCCN1N Amb24354847 [0,0,0,1,0,0|3,0,0]=4 3476 B8R1.11 CCC1CCNC1C Amb28934809 [0,0,0,1,0,0|3,0,0]=4 3477 B8R1.11 CCC1CNCC1C Amb28346924 [0,0,0,1,0,0|2,0,0]=3 3478 B8R1.11 CCC1CNCC1F Amb27167810 [0,0,0,1,0,0|2,0,0]=3 3479 B8R1.11 CCC1CNCC1N Amb26993384 [0,0,0,1,0,0|2,0,0]=3 3480 B8R1.11 CCC1CNCC1O Amb28245846 [0,0,0,1,0,0|1,0,0]=2 3481 B8R1.11 CCC1COCC1=O Amb29866231 [0,0,0,1,0,0|0,0,2]=3 3482 B8R1.11 CCC1COCC1Br Amb35736875 [0,0,0,1,0,0|1,0,0]=2 3483 B8R1.11 CCC1COCC1Cl Amb35631935 [0,0,0,1,0,0|1,0,0]=2 3484 B8R1.11 CCC1COCC1N Amb29866237 [0,0,0,1,0,0|1,0,0]=2 3485 B8R1.11 CCC1COCC1O Amb24675632 [0,0,0,1,0,0|0,0,0]=1 3486 B8R1.11 CCC1COCC1S Amb32788757 [0,0,0,1,0,0|0,1,0]=2 3487 B8R1.11 CCC1CSCC1Cl Amb28316137 [0,0,0,1,0,0|1,1,0]=3 3488 B8R1.11 CCC1CSCC1N Amb18202902 [0,0,0,1,0,0|1,1,0]=3 3489 B8R1.11 CCC1CSCC1O Amb28316138 [0,0,0,1,0,0|0,1,0]=2 3490 B8R1.11 CCC1NCCC1C Amb28934808 [0,0,0,1,0,0|2,0,0]=3 3491 B8R1.11 CCC1NCCC1N Amb18203353 [0,0,0,1,0,0|3,0,0]=4 3492 B8R1.11 CCC1NCCC1O Amb18833009 [0,0,0,1,0,0|2,0,0]=3 3493 B8R1.11 CCC1NCCC1O Amb32411997 [0,0,0,1,0,0|2,0,0]=3 3494 B8R1.11 CCC1OCCC1=O Amb28324362 [0,0,0,1,0,0|2,0,1]=4 3495 B8R1.11 CCC1OCCC1N Amb25702085 [0,0,0,1,0,0|2,0,0]=3 3496 B8R1.11 CCC1OCCC1O Amb27197541 [0,0,0,1,0,0|2,0,0]=3 3497 B8R1.11 CCC1SCCC1Br Amb28285217 [0,0,0,1,0,0|2,1,0]=4 3498 B8R1.11 CCC1SCCC1O Amb27409767 [0,0,0,1,0,0|2,0,0]=3 3499 B8R1.11 CC[C@@H]1C=CC[C@H]1Br Amb27965412 [0,0,0,1,0,0|2,0,1]=4 3500 B8R1.11 CC[C@@H]1C=CC[C@H]1O Amb27208141 [0,0,0,1,0,0|1,0,1]=3 3501 B8R1.11 CC[C@@H]1CCCC1=O Amb27164677 [0,0,0,1,0,0|1,0,2]=4 3502 B8R1.11 CC[C@@H]1CCC[C@@H]1N Amb27786242 [0,0,0,1,0,0|2,0,0]=3 3503 B8R1.11 CC[C@@H]1CCC[C@H]1N Amb27786896 [0,0,0,1,0,0|2,0,0]=3 3504 B8R1.11 CC[C@@H]1CCC[C@H]1O Amb26421340 [0,0,0,1,0,0|1,0,0]=2 3505 B8R1.11 CC[C@@H]1CNC[C@@H]1N Amb25186818 [0,0,0,1,0,0|2,0,0]=3 3506 B8R1.11 CC[C@@H]1CNC[C@H]1N Amb27627282 [0,0,0,1,0,0|2,0,0]=3 3507 B8R1.11 CC[C@@H]1CNC[C@H]1O Amb24560816 [0,0,0,1,0,0|1,0,0]=2 3508 B8R1.11 CC[C@@H]1COC[C@H]1O Amb32944586 [0,0,0,1,0,0|0,0,0]=1 3509 B8R1.11 CC[C@@H]1NCC[C@H]1C Amb18833052 [0,0,0,1,0,0|2,0,0]=3 3510 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb25168928 [0,0,0,1,0,0|2,0,0]=3 3511 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb33379057 [0,0,0,1,0,0|2,0,0]=3 3512 B8R1.11 CC[C@@H]1OCC[C@H]1Br Amb27634877 [0,0,0,1,0,0|2,0,0]=3 3513 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,0,0,1,0,0|2,0,0]=3 3514 B8R1.11 CC[C@H]1C=CC[C@@H]1O Amb27653157 [0,0,0,1,0,0|1,0,1]=3 3515 B8R1.11 CC[C@H]1CCCC1=O Amb27256510 [0,0,0,1,0,0|1,0,2]=4 3516 B8R1.11 CC[C@H]1CCC[C@@H]1C Amb26430749 [0,0,0,1,0,0|2,0,0]=3 3517 B8R1.11 CC[C@H]1CCC[C@H]1C Amb28194950 [0,0,0,1,0,0|2,0,0]=3 3518 B8R1.11 CC[C@H]1CNC[C@H]1O Amb27459736 [0,0,0,1,0,0|1,0,0]=2 3519 B8R1.11 CC[C@H]1OCC[C@H]1O Amb28435763 [0,0,0,1,0,0|2,0,0]=3 3520 B8R1.11 CC[C@H]1SCC[C@H]1O Amb27625677 [0,0,0,1,0,0|2,0,0]=3 3521 B8R1.11 CN1CCCC1CBr Amb19650986 [0,0,0,1,0,0|3,0,0]=4 3522 B8R1.11 CN1CCCC1CBr Amb33550876 [0,0,0,1,0,0|3,0,0]=4 3523 B8R1.11 CN1CCCC1CCl Amb15701611 [0,0,0,1,0,0|3,0,0]=4 3524 B8R1.11 CN1CCCC1CCl Amb22499600 [0,0,0,1,0,0|3,0,0]=4 3525 B8R1.11 CN1CCCC1CN Amb22587695 [0,0,0,1,0,0|3,0,0]=4 3526 B8R1.11 CN1CCCC1CN Amb9731098 [0,0,0,1,0,0|3,0,0]=4 3527 B8R1.11 CN1CCCC1CO Amb13951143 [0,0,0,1,0,0|2,0,0]=3 3528 B8R1.11 CN1CCCC1CS Amb28145111 [0,0,0,1,0,0|2,1,0]=4 3529 B8R1.11 CN1CCC[C@@H]1CBr Amb22756484 [0,0,0,1,0,0|3,0,0]=4 3530 B8R1.11 CN1CCC[C@@H]1CCl Amb27267910 [0,0,0,1,0,0|3,0,0]=4 3531 B8R1.11 CN1CCC[C@@H]1CCl Amb29752239 [0,0,0,1,0,0|3,0,0]=4 3532 B8R1.11 CN1CCC[C@@H]1CN Amb22406270 [0,0,0,1,0,0|3,0,0]=4 3533 B8R1.11 CN1CCC[C@@H]1CN Amb22751420 [0,0,0,1,0,0|3,0,0]=4 3534 B8R1.11 CN1CCC[C@@H]1CO Amb13887229 [0,0,0,1,0,0|2,0,0]=3 3535 B8R1.11 CN1CCC[C@H]1CBr Amb22225946 [0,0,0,1,0,0|3,0,0]=4 3536 B8R1.11 CN1CCC[C@H]1CCl Amb22226497 [0,0,0,1,0,0|3,0,0]=4 3537 B8R1.11 CN1CCC[C@H]1CN Amb10603238 [0,0,0,1,0,0|3,0,0]=4 3538 B8R1.11 CN1CCC[C@H]1CN Amb33801735 [0,0,0,1,0,0|3,0,0]=4 3539 B8R1.11 CN1CCC[C@H]1CO Amb3939162 [0,0,0,1,0,0|2,0,0]=3 3540 B8R1.11 CN1CCN=C1CO Amb27208097 [0,0,0,1,0,0|2,0,1]=4 3541 B8R1.11 CN1CSCC1CO Amb28145118 [0,0,0,1,0,0|3,0,0]=4 3542 B8R1.11 CN1NCCC1CO Amb27849176 [0,0,0,1,0,0|3,0,0]=4 3543 B8R1.11 CN1NCCC1CO Amb35826247 [0,0,0,1,0,0|3,0,0]=4 3544 B8R1.11 CNC1CCCC1C Amb18276776 [0,0,0,1,0,0|3,0,0]=4 3545 B8R1.11 CNC1CCCC1F Amb27461856 [0,0,0,1,0,0|3,0,0]=4 3546 B8R1.11 CNC1CCCC1O Amb17231821 [0,0,0,1,0,0|2,0,0]=3 3547 B8R1.11 CNC1COCC1C Amb35632266 [0,0,0,1,0,0|2,0,0]=3 3548 B8R1.11 CNC1COCC1O Amb18944293 [0,0,0,1,0,0|1,0,0]=2 3549 B8R1.11 CNC1CSCC1C Amb27234038 [0,0,0,1,0,0|2,1,0]=4 3550 B8R1.11 CN[C@@H]1CCC[C@@H]1O Amb27240798 [0,0,0,1,0,0|2,0,0]=3 3551 B8R1.11 CN[C@@H]1CCC[C@H]1O Amb16230279 [0,0,0,1,0,0|2,0,0]=3 3552 B8R1.11 CN[C@@H]1CNC[C@H]1C Amb28388700 [0,0,0,1,0,0|3,0,0]=4 3553 B8R1.11 CN[C@@H]1COC[C@@H]1O Amb24700231 [0,0,0,1,0,0|1,0,0]=2 3554 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22748628 [0,0,0,1,0,0|1,0,0]=2 3555 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22757852 [0,0,0,1,0,0|1,0,0]=2 3556 B8R1.11 CN[C@H]1COC[C@@H]1O Amb10608328 [0,0,0,1,0,0|1,0,0]=2 3557 B8R1.11 COC1C=CCC1O Amb27805128 [0,0,0,1,0,0|2,0,1]=4 3558 B8R1.11 COC1CCCC1Br Amb18796094 [0,0,0,1,0,0|3,0,0]=4 3559 B8R1.11 COC1CCCC1Cl Amb27877535 [0,0,0,1,0,0|3,0,0]=4 3560 B8R1.11 COC1CCCC1I Amb27766967 [0,0,0,1,0,0|3,0,0]=4 3561 B8R1.11 COC1CCCC1N Amb1141892 [0,0,0,1,0,0|3,0,0]=4 3562 B8R1.11 COC1CCCC1N Amb9677364 [0,0,0,1,0,0|3,0,0]=4 3563 B8R1.11 COC1CCCC1O Amb19515034 [0,0,0,1,0,0|2,0,0]=3 3564 B8R1.11 COC1CCCC1S Amb26589597 [0,0,0,1,0,0|2,1,0]=4 3565 B8R1.11 COC1CNCC1F Amb24745837 [0,0,0,1,0,0|3,0,0]=4 3566 B8R1.11 COC1CNCC1F Amb33611624 [0,0,0,1,0,0|3,0,0]=4 3567 B8R1.11 COC1CNCC1O Amb25209957 [0,0,0,1,0,0|2,0,0]=3 3568 B8R1.11 COC1COCC1Br Amb27254386 [0,0,0,1,0,0|2,0,0]=3 3569 B8R1.11 COC1COCC1I Amb28316198 [0,0,0,1,0,0|2,0,0]=3 3570 B8R1.11 COC1COCC1N Amb17606146 [0,0,0,1,0,0|2,0,0]=3 3571 B8R1.11 COC1COCC1N Amb28994082 [0,0,0,1,0,0|2,0,0]=3 3572 B8R1.11 COC1OCCC1Br Amb27865593 [0,0,0,1,0,0|3,0,0]=4 3573 B8R1.11 COC1OCCC1Cl Amb27875300 [0,0,0,1,0,0|3,0,0]=4 3574 B8R1.11 CO[C@@H]1CC=C[C@H]1O Amb28069634 [0,0,0,1,0,0|2,0,1]=4 3575 B8R1.11 CO[C@@H]1CCC[C@@H]1N Amb25168975 [0,0,0,1,0,0|3,0,0]=4 3576 B8R1.11 CO[C@@H]1CCC[C@@H]1O Amb28400066 [0,0,0,1,0,0|2,0,0]=3 3577 B8R1.11 CO[C@@H]1CCC[C@H]1Br Amb27860439 [0,0,0,1,0,0|3,0,0]=4 3578 B8R1.11 CO[C@@H]1CCC[C@H]1N Amb19514596 [0,0,0,1,0,0|3,0,0]=4 3579 B8R1.11 CO[C@@H]1CCC[C@H]1N Amb19514597 [0,0,0,1,0,0|3,0,0]=4 3580 B8R1.11 CO[C@@H]1CCC[C@H]1O Amb19372843 [0,0,0,1,0,0|2,0,0]=3 3581 B8R1.11 CO[C@@H]1CNC[C@@H]1F Amb22886227 [0,0,0,1,0,0|3,0,0]=4 3582 B8R1.11 CO[C@@H]1CNC[C@@H]1N Amb25823639 [0,0,0,1,0,0|3,0,0]=4 3583 B8R1.11 CO[C@@H]1CNC[C@@H]1O Amb24183504 [0,0,0,1,0,0|2,0,0]=3 3584 B8R1.11 CO[C@@H]1CNC[C@H]1F Amb22406200 [0,0,0,1,0,0|3,0,0]=4 3585 B8R1.11 CO[C@@H]1CNC[C@H]1F Amb26418923 [0,0,0,1,0,0|3,0,0]=4 3586 B8R1.11 CO[C@@H]1CNC[C@H]1N Amb24612402 [0,0,0,1,0,0|3,0,0]=4 3587 B8R1.11 CO[C@@H]1CNC[C@H]1O Amb22748758 [0,0,0,1,0,0|2,0,0]=3 3588 B8R1.11 CO[C@@H]1CNC[C@H]1O Amb23440213 [0,0,0,1,0,0|2,0,0]=3 3589 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb22757962 [0,0,0,1,0,0|2,0,0]=3 3590 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb24539352 [0,0,0,1,0,0|2,0,0]=3 3591 B8R1.11 CO[C@@H]1COC[C@H]1Br Amb26565848 [0,0,0,1,0,0|2,0,0]=3 3592 B8R1.11 CO[C@@H]1COC[C@H]1N Amb22757840 [0,0,0,1,0,0|2,0,0]=3 3593 B8R1.11 CO[C@@H]1COC[C@H]1N Amb23438206 [0,0,0,1,0,0|2,0,0]=3 3594 B8R1.11 CO[C@@H]1COC[C@H]1O Amb28053367 [0,0,0,1,0,0|1,0,0]=2 3595 B8R1.11 CO[C@@H]1OCC[C@@H]1Br Amb27192193 [0,0,0,1,0,0|3,0,0]=4 3596 B8R1.11 CO[C@H]1CCC[C@@H]1N Amb13951500 [0,0,0,1,0,0|3,0,0]=4 3597 B8R1.11 CO[C@H]1CCC[C@@H]1O Amb27245897 [0,0,0,1,0,0|2,0,0]=3 3598 B8R1.11 CO[C@H]1CNC[C@@H]1F Amb33726103 [0,0,0,1,0,0|3,0,0]=4 3599 B8R1.11 CO[C@H]1CNC[C@@H]1O Amb10608287 [0,0,0,1,0,0|2,0,0]=3 3600 B8R1.11 CO[C@H]1CNC[C@@H]1O Amb33758698 [0,0,0,1,0,0|2,0,0]=3 3601 B8R1.11 CO[C@H]1CNC[C@H]1F Amb24381039 [0,0,0,1,0,0|3,0,0]=4 3602 B8R1.11 CO[C@H]1CNC[C@H]1N Amb28385476 [0,0,0,1,0,0|3,0,0]=4 3603 B8R1.11 CO[C@H]1CNC[C@H]1O Amb28077255 [0,0,0,1,0,0|2,0,0]=3 3604 B8R1.11 CO[C@H]1CNC[C@H]1O Amb35825518 [0,0,0,1,0,0|2,0,0]=3 3605 B8R1.11 CO[C@H]1COC[C@@H]1Br Amb28070133 [0,0,0,1,0,0|2,0,0]=3 3606 B8R1.11 CO[C@H]1COC[C@@H]1N Amb10608202 [0,0,0,1,0,0|2,0,0]=3 3607 B8R1.11 CO[C@H]1COC[C@H]1N Amb25683516 [0,0,0,1,0,0|2,0,0]=3 3608 B8R1.11 CO[C@H]1COC[C@H]1O Amb27201452 [0,0,0,1,0,0|1,0,0]=2 3609 B8R1.11 CO[C@H]1OCC[C@H]1Cl Amb27985879 [0,0,0,1,0,0|3,0,0]=4 3610 B8R1.11 CSC1CCCC1N Amb18642859 [0,0,0,1,0,0|3,0,0]=4 3611 B8R1.11 CSC1COCC1N Amb22504265 [0,0,0,1,0,0|2,0,0]=3 3612 B8R1.11 CS[C@@H]1CCC[C@@H]1O Amb27853579 [0,0,0,1,0,0|2,0,0]=3 3613 B8R1.11 CS[C@@H]1COC[C@H]1O Amb26388461 [0,0,0,1,0,0|1,0,0]=2 3614 B8R1.11 CS[C@H]1CNC[C@@H]1N Amb27968642 [0,0,0,1,0,0|3,0,0]=4 3615 B8R1.11 C[C@@H]1CCC[C@H]1C=O Amb28146820 [0,0,0,1,0,0|1,0,2]=4 3616 B8R1.11 C[C@@H]1CCC[C@H]1CBr Amb24603453 [0,0,0,1,0,0|2,0,0]=3 3617 B8R1.11 C[C@@H]1CCC[C@H]1CO Amb25258782 [0,0,0,1,0,0|1,0,0]=2 3618 B8R1.11 C[C@@H]1CCO[C@@H]1CBr Amb33328854 [0,0,0,1,0,0|1,0,0]=2 3619 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33329080 [0,0,0,1,0,0|1,0,0]=2 3620 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33331033 [0,0,0,1,0,0|1,0,0]=2 3621 B8R1.11 C[C@@H]1CCO[C@@H]1CO Amb33328615 [0,0,0,1,0,0|0,0,0]=1 3622 B8R1.11 C[C@@H]1CNC[C@H]1CN Amb28062618 [0,0,0,1,0,0|3,0,0]=4 3623 B8R1.11 C[C@@H]1CNC[C@H]1CO Amb13883444 [0,0,0,1,0,0|2,0,0]=3 3624 B8R1.11 C[C@@H]1COC[C@H]1CO Amb28346310 [0,0,0,1,0,0|2,0,0]=3 3625 B8R1.11 C[C@@H]1NCC[C@@H]1CO Amb26414508 [0,0,0,1,0,0|2,0,0]=3 3626 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb22886286 [0,0,0,1,0,0|3,0,0]=4 3627 B8R1.11 C[C@@H]1OCC[C@@H]1CO Amb22886851 [0,0,0,1,0,0|2,0,0]=3 3628 B8R1.11 C[C@H]1CCC[C@@H]1CN Amb28423931 [0,0,0,1,0,0|2,0,0]=3 3629 B8R1.11 C[C@H]1CCN[C@@H]1CO Amb27631283 [0,0,0,1,0,0|1,0,0]=2 3630 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb22232058 [0,0,0,1,0,0|2,0,0]=3 3631 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb34159412 [0,0,0,1,0,0|2,0,0]=3 3632 B8R1.11 C[C@H]1CNC[C@H]1CN Amb32672061 [0,0,0,1,0,0|3,0,0]=4 3633 B8R1.11 C[C@H]1NCC[C@H]1CO Amb27629700 [0,0,0,1,0,0|2,0,0]=3 3634 B8R1.11 C[C@H]1OCC[C@@H]1CO Amb34915718 [0,0,0,1,0,0|2,0,0]=3 3635 B8R1.11 C[C@H]1OCC[C@H]1CO Amb25328798 [0,0,0,1,0,0|2,0,0]=3 3636 B8R1.11 N#CC1CCCC1O Amb8923607 [0,0,0,1,0,0|2,0,1]=4 3637 B8R1.11 N#CC1COCC1Br Amb27227687 [0,0,0,1,0,0|2,0,1]=4 3638 B8R1.11 N#CC1COCC1N Amb28048960 [0,0,0,1,0,0|2,0,1]=4 3639 B8R1.11 N#CC1COCC1O Amb23448392 [0,0,0,1,0,0|1,0,1]=3 3640 B8R1.11 N#C[C@@H]1CCC[C@@H]1O Amb28285606 [0,0,0,1,0,0|2,0,1]=4 3641 B8R1.11 N#C[C@@H]1CCC[C@H]1O Amb19148606 [0,0,0,1,0,0|2,0,1]=4 3642 B8R1.11 N#C[C@@H]1COC[C@H]1O Amb29871193 [0,0,0,1,0,0|1,0,1]=3 3643 B8R1.11 N#C[C@@H]1OCC[C@@H]1Cl Amb33038504 [0,0,0,1,0,0|2,0,1]=4 3644 B8R1.11 N#C[C@@H]1OCC[C@H]1Br Amb33299279 [0,0,0,1,0,0|2,0,1]=4 3645 B8R1.11 N#C[C@@H]1OCC[C@H]1Cl Amb27228676 [0,0,0,1,0,0|2,0,1]=4 3646 B8R1.11 N#C[C@H]1CNC[C@@H]1O Amb27208175 [0,0,0,1,0,0|2,0,1]=4 3647 B8R1.11 NC1CCCC1CO Amb18641836 [0,0,0,1,0,0|2,0,0]=3 3648 B8R1.11 NC1CCCC1CO Amb32666151 [0,0,0,1,0,0|2,0,0]=3 3649 B8R1.11 NC1COCC1CO Amb24581733 [0,0,0,1,0,0|2,0,0]=3 3650 B8R1.11 NC1COCC1CO Amb30585130 [0,0,0,1,0,0|2,0,0]=3 3651 B8R1.11 NCC1CCCC1F Amb28282081 [0,0,0,1,0,0|3,0,0]=4 3652 B8R1.11 NCC1CCCC1N Amb9781735 [0,0,0,1,0,0|3,0,0]=4 3653 B8R1.11 NCC1CCCC1O Amb22756654 [0,0,0,1,0,0|2,0,0]=3 3654 B8R1.11 NCC1CCCC1O Amb9286702 [0,0,0,1,0,0|2,0,0]=3 3655 B8R1.11 NCC1CCCC1S Amb32788471 [0,0,0,1,0,0|2,1,0]=4 3656 B8R1.11 NCC1CNCC1Cl Amb27816505 [0,0,0,1,0,0|3,0,0]=4 3657 B8R1.11 NCC1CNCC1F Amb28052878 [0,0,0,1,0,0|3,0,0]=4 3658 B8R1.11 NCC1CNCC1O Amb22284842 [0,0,0,1,0,0|2,0,0]=3 3659 B8R1.11 NCC1COCC1N Amb27459550 [0,0,0,1,0,0|2,0,0]=3 3660 B8R1.11 NCC1COCC1O Amb25728184 [0,0,0,1,0,0|1,0,0]=2 3661 B8R1.11 NCC1COCC1O Amb32753532 [0,0,0,1,0,0|1,0,0]=2 3662 B8R1.11 NCC1CSCC1O Amb18203161 [0,0,0,1,0,0|1,1,0]=3 3663 B8R1.11 NCC1NCCC1F Amb28048966 [0,0,0,1,0,0|3,0,0]=4 3664 B8R1.11 NCC1NCCC1O Amb28245401 [0,0,0,1,0,0|3,0,0]=4 3665 B8R1.11 NCC1OCCC1S Amb27201418 [0,0,0,1,0,0|2,0,0]=3 3666 B8R1.11 NC[C@@H]1CCC[C@@H]1N Amb24580548 [0,0,0,1,0,0|3,0,0]=4 3667 B8R1.11 NC[C@@H]1CCC[C@@H]1O Amb25983417 [0,0,0,1,0,0|2,0,0]=3 3668 B8R1.11 NC[C@@H]1CCC[C@@H]1O Amb33743299 [0,0,0,1,0,0|2,0,0]=3 3669 B8R1.11 NC[C@@H]1CCC[C@H]1F Amb22886328 [0,0,0,1,0,0|3,0,0]=4 3670 B8R1.11 NC[C@@H]1CCC[C@H]1O Amb26550059 [0,0,0,1,0,0|2,0,0]=3 3671 B8R1.11 NC[C@@H]1CCC[C@H]1O Amb32663131 [0,0,0,1,0,0|2,0,0]=3 3672 B8R1.11 NC[C@@H]1CNC[C@@H]1Cl Amb28250864 [0,0,0,1,0,0|3,0,0]=4 3673 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb23439671 [0,0,0,1,0,0|1,0,0]=2 3674 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb32680795 [0,0,0,1,0,0|1,0,0]=2 3675 B8R1.11 NC[C@@H]1COC[C@H]1O Amb23439670 [0,0,0,1,0,0|1,0,0]=2 3676 B8R1.11 NC[C@@H]1COC[C@H]1O Amb25277795 [0,0,0,1,0,0|1,0,0]=2 3677 B8R1.11 NC[C@H]1CCC[C@@H]1O Amb26873019 [0,0,0,1,0,0|2,0,0]=3 3678 B8R1.11 NC[C@H]1CCC[C@@H]1O Amb32663080 [0,0,0,1,0,0|2,0,0]=3 3679 B8R1.11 NC[C@H]1CCC[C@H]1O Amb25218839 [0,0,0,1,0,0|2,0,0]=3 3680 B8R1.11 NC[C@H]1CCC[C@H]1O Amb33743876 [0,0,0,1,0,0|2,0,0]=3 3681 B8R1.11 NC[C@H]1COC[C@@H]1O Amb26894025 [0,0,0,1,0,0|1,0,0]=2 3682 B8R1.11 NC[C@H]1COC[C@@H]1O Amb34156215 [0,0,0,1,0,0|1,0,0]=2 3683 B8R1.11 NC[C@H]1COC[C@H]1O Amb25351472 [0,0,0,1,0,0|1,0,0]=2 3684 B8R1.11 NC[C@H]1NCC[C@@H]1O Amb28056116 [0,0,0,1,0,0|3,0,0]=4 3685 B8R1.11 NN1CCCC1CO Amb18641896 [0,0,0,1,0,0|3,0,0]=4 3686 B8R1.11 NN1CCC[C@@H]1CO Amb22757469 [0,0,0,1,0,0|3,0,0]=4 3687 B8R1.11 NNC1CCCC1O Amb13952358 [0,0,0,1,0,0|3,0,0]=4 3688 B8R1.11 NNC1CCCC1O Amb21979355 [0,0,0,1,0,0|3,0,0]=4 3689 B8R1.11 NNC1COCC1O Amb24706024 [0,0,0,1,0,0|2,0,0]=3 3690 B8R1.11 NNC1COCC1O Amb32646040 [0,0,0,1,0,0|2,0,0]=3 3691 B8R1.11 NN[C@@H]1CCC[C@@H]1O Amb34916202 [0,0,0,1,0,0|3,0,0]=4 3692 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb22397265 [0,0,0,1,0,0|3,0,0]=4 3693 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb32663884 [0,0,0,1,0,0|3,0,0]=4 3694 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb32724354 [0,0,0,1,0,0|3,0,0]=4 3695 B8R1.11 NN[C@@H]1COC[C@H]1O Amb33069638 [0,0,0,1,0,0|2,0,0]=3 3696 B8R1.11 NOC1COCC1O Amb27479135 [0,0,0,1,0,0|2,0,0]=3 3697 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb22746052 [0,0,0,1,0,0|2,0,0]=3 3698 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb24056609 [0,0,0,1,0,0|2,0,0]=3 3699 B8R1.11 N[C@@H]1CCC[C@H]1CO Amb22231643 [0,0,0,1,0,0|2,0,0]=3 3700 B8R1.11 N[C@@H]1CNC[C@H]1CCl Amb27851776 [0,0,0,1,0,0|3,0,0]=4 3701 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb31169044 [0,0,0,1,0,0|2,0,0]=3 3702 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb33456236 [0,0,0,1,0,0|2,0,0]=3 3703 B8R1.11 N[C@H]1CCC[C@H]1CBr Amb27637665 [0,0,0,1,0,0|3,0,0]=4 3704 B8R1.11 N[C@H]1CCC[C@H]1CO Amb1994025 [0,0,0,1,0,0|2,0,0]=3 3705 B8R1.11 N[C@H]1COC[C@H]1CO Amb27188192 [0,0,0,1,0,0|2,0,0]=3 3706 B8R1.11 O=C1CCCC1CO Amb22491993 [0,0,0,1,0,0|2,0,1]=4 3707 B8R1.11 O=C1CCC[C@@H]1CO Amb28049022 [0,0,0,1,0,0|2,0,1]=4 3708 B8R1.11 O=CC1CCCC1O Amb28048922 [0,0,0,1,0,0|2,0,1]=4 3709 B8R1.11 OC1CCCC1CCl Amb24386443 [0,0,0,1,0,0|2,0,0]=3 3710 B8R1.11 OCC1CC=CC1O Amb25923040 [0,0,0,1,0,0|2,0,1]=4 3711 B8R1.11 OCC1CCCC1F Amb28318750 [0,0,0,1,0,0|2,0,0]=3 3712 B8R1.11 OCC1CCCC1O Amb8504106 [0,0,0,1,0,0|2,0,0]=3 3713 B8R1.11 OCC1CNCC1O Amb22587601 [0,0,0,1,0,0|2,0,0]=3 3714 B8R1.11 OCC1CNCC1O Amb26440714 [0,0,0,1,0,0|2,0,0]=3 3715 B8R1.11 OCC1NCCC1F Amb25693929 [0,0,0,1,0,0|2,0,0]=3 3716 B8R1.11 OCC1NCCC1O Amb18641923 [0,0,0,1,0,0|2,0,0]=3 3717 B8R1.11 OCC1NCCC1O Amb24117910 [0,0,0,1,0,0|2,0,0]=3 3718 B8R1.11 OCC1OCCC1F Amb25808078 [0,0,0,1,0,0|1,0,0]=2 3719 B8R1.11 OCC1OCCC1O Amb26993579 [0,0,0,1,0,0|1,0,0]=2 3720 B8R1.11 OC[C@@H]1CC=C[C@@H]1O Amb22233136 [0,0,0,1,0,0|2,0,1]=4 3721 B8R1.11 OC[C@@H]1CCCN1O Amb27756423 [0,0,0,1,0,0|3,0,0]=4 3722 B8R1.11 OC[C@@H]1CCC[C@H]1Cl Amb27454845 [0,0,0,1,0,0|2,0,0]=3 3723 B8R1.11 OC[C@@H]1CCC[C@H]1O Amb28077597 [0,0,0,1,0,0|2,0,0]=3 3724 B8R1.11 OC[C@@H]1CNC[C@H]1F Amb31251496 [0,0,0,1,0,0|3,0,0]=4 3725 B8R1.11 OC[C@@H]1CNC[C@H]1F Amb33457278 [0,0,0,1,0,0|3,0,0]=4 3726 B8R1.11 OC[C@@H]1CNC[C@H]1O Amb22757877 [0,0,0,1,0,0|2,0,0]=3 3727 B8R1.11 OC[C@@H]1OC=C[C@H]1O Amb25376799 [0,0,0,1,0,0|1,0,2]=4 3728 B8R1.11 OC[C@H]1C=CC[C@@H]1O Amb27427837 [0,0,0,1,0,0|2,0,1]=4 3729 B8R1.11 OC[C@H]1CC=C[C@H]1O Amb24514501 [0,0,0,1,0,0|2,0,1]=4 3730 B8R1.11 OC[C@H]1CNC[C@H]1O Amb22757874 [0,0,0,1,0,0|2,0,0]=3 3731 B8R1.11 OC[C@H]1CNC[C@H]1O Amb27420150 [0,0,0,1,0,0|2,0,0]=3 3732 B8R1.11 OC[C@H]1NCC[C@@H]1O Amb27246014 [0,0,0,1,0,0|2,0,0]=3 3733 B8R1.11 OC[C@H]1NCC[C@@H]1O Amb31291450 [0,0,0,1,0,0|2,0,0]=3 3734 B8R1.11 OC[C@H]1OC=C[C@@H]1O Amb27967186 [0,0,0,1,0,0|1,0,2]=4 3735 B8R1.11 OC[C@H]1OCCC1O Amb27594751 [0,0,0,1,0,0|1,0,0]=2 3736 B8R1.11 OC[C@H]1OCC[C@@H]1O Amb27194035 [0,0,0,1,0,0|1,0,0]=2 3737 B8R1.11 OC[C@H]1OCC[C@H]1F Amb27789566 [0,0,0,1,0,0|1,0,0]=2 3738 B8R1.11 OC[C@H]1OCC[C@H]1O Amb27423676 [0,0,0,1,0,0|1,0,0]=2 3739 B8R1.11 ONC1CCCC1Cl Amb27238541 [0,0,0,1,0,0|3,0,0]=4 3740 B8R1.12 CCC1C=CC1CO Amb28285219 [0,0,0,1,0,0|1,0,1]=3 3741 B8R1.12 CCC1CCC1CBr Amb33512084 [0,0,0,1,0,0|2,0,0]=3 3742 B8R1.12 CCC1CCC1CN Amb24483083 [0,0,0,1,0,0|2,0,0]=3 3743 B8R1.12 CCC1CCC1NC Amb27247645 [0,0,0,1,0,0|3,0,0]=4 3744 B8R1.12 CCC1CCN1CC Amb27833239 [0,0,0,1,0,0|3,0,0]=4 3745 B8R1.12 CCC1COC1CO Amb25948271 [0,0,0,1,0,0|0,0,0]=1 3746 B8R1.12 CCN1CCC1CN Amb27631267 [0,0,0,1,0,0|3,0,0]=4 3747 B8R1.12 CCN1CCC1CO Amb32668190 [0,0,0,1,0,0|2,0,0]=3 3748 B8R1.12 CNC1CCC1CO Amb27657865 [0,0,0,1,0,0|2,0,0]=3 3749 B8R1.12 CN[C@@H]1CC[C@H]1CO Amb27785815 [0,0,0,1,0,0|2,0,0]=3 3750 B8R1.12 COC1CCC1CN Amb25877244 [0,0,0,1,0,0|3,0,0]=4 3751 B8R1.12 COC1CCC1CO Amb24473419 [0,0,0,1,0,0|2,0,0]=3 3752 B8R1.12 CO[C@@H]1CC[C@@H]1CO Amb34913167 [0,0,0,1,0,0|2,0,0]=3 3753 B8R1.12 CO[C@@H]1CC[C@H]1CO Amb28059364 [0,0,0,1,0,0|2,0,0]=3 3754 B8R1.12 N#CC1CCC1CO Amb27197414 [0,0,0,1,0,0|2,0,1]=4 3755 B8R1.12 NCC1CCC1CF Amb20668104 [0,0,0,1,0,0|3,0,0]=4 3756 B8R1.12 NCC1CCC1CN Amb25131632 [0,0,0,1,0,0|3,0,0]=4 3757 B8R1.12 NCC1CCC1CN Amb33512810 [0,0,0,1,0,0|3,0,0]=4 3758 B8R1.12 NC[C@@H]1CC[C@H]1CN Amb9786836 [0,0,0,1,0,0|3,0,0]=4 3759 B8R1.12 OCC1C=CC1CO Amb27471112 [0,0,0,1,0,0|2,0,1]=4 3760 B8R1.12 OCC1CCC1CF Amb27965576 [0,0,0,1,0,0|2,0,0]=3 3761 B8R1.12 OCC1CCC1CO Amb20248362 [0,0,0,1,0,0|2,0,0]=3 3762 B8R1.12 OC[C@@H]1CC[C@H]1CO Amb24725649 [0,0,0,1,0,0|2,0,0]=3 3763 B8R1.12 OC[C@H]1C=C[C@H]1CO Amb27472626 [0,0,0,1,0,0|2,0,1]=4 3764 B8R1.12 OC[C@H]1CC[C@H]1CO Amb26476284 [0,0,0,1,0,0|2,0,0]=3 3765 B8R1.13 C#CCC1CCC1O Amb32944354 [0,0,0,1,0,0|1,0,2]=4 3766 B8R1.13 C=CCC1CCC1O Amb33213296 [0,0,0,1,0,0|1,0,2]=4 3767 B8R1.13 CC#CC1CCC1O Amb32945208 [0,0,0,1,0,0|1,0,2]=4 3768 B8R1.13 CC1CCC1CCN Amb28049312 [0,0,0,1,0,0|2,0,0]=3 3769 B8R1.13 CC1CC\C1=C/CN Amb27969937 [0,0,0,1,0,0|2,0,1]=4 3770 B8R1.13 CCCC1CCC1O Amb24359183 [0,0,0,1,0,0|1,0,0]=2 3771 B8R1.13 CCCC1SCC1O Amb27803103 [0,0,0,1,0,0|0,1,0]=2 3772 B8R1.13 CCO[C@@H]1CC[C@@H]1N Amb33495620 [0,0,0,1,0,0|3,0,0]=4 3773 B8R1.13 CCO[C@@H]1CC[C@H]1O Amb33495613 [0,0,0,1,0,0|2,0,0]=3 3774 B8R1.13 CN1CCC1CCN Amb28436400 [0,0,0,1,0,0|3,0,0]=4 3775 B8R1.13 CNCC1CCC1F Amb33715806 [0,0,0,1,0,0|3,0,0]=4 3776 B8R1.13 CNCC1CCC1F Amb33719038 [0,0,0,1,0,0|3,0,0]=4 3777 B8R1.13 COCC1CCC1N Amb24483084 [0,0,0,1,0,0|3,0,0]=4 3778 B8R1.13 COCC1CCC1N Amb32653541 [0,0,0,1,0,0|3,0,0]=4 3779 B8R1.13 COCC1CCC1O Amb32944318 [0,0,0,1,0,0|2,0,0]=3 3780 B8R1.13 COC[C@@H]1CC[C@@H]1N Amb25937527 [0,0,0,1,0,0|3,0,0]=4 3781 B8R1.13 COC[C@@H]1CC[C@@H]1N Amb32661045 [0,0,0,1,0,0|3,0,0]=4 3782 B8R1.13 COC[C@@H]1CC[C@H]1N Amb25237707 [0,0,0,1,0,0|3,0,0]=4 3783 B8R1.13 COC[C@@H]1CC[C@H]1N Amb32661046 [0,0,0,1,0,0|3,0,0]=4 3784 B8R1.13 COC[C@H]1CC[C@@H]1N Amb25175635 [0,0,0,1,0,0|3,0,0]=4 3785 B8R1.13 COC[C@H]1CC[C@H]1N Amb25175719 [0,0,0,1,0,0|3,0,0]=4 3786 B8R1.13 C\C=C\C1CCC1O Amb33212898 [0,0,0,1,0,0|1,0,2]=4 3787 B8R1.17 C#C[C@H]1O[C@H]1CCBr Amb27444463 [0,0,0,1,0,0|2,0,1]=4 3788 B8R1.17 C#C[C@H]1O[C@H]1CCO Amb28207198 [0,0,0,1,0,0|2,0,1]=4 3789 B8R1.17 C=CC1OC1CCBr Amb28240205 [0,0,0,1,0,0|2,0,1]=4 3790 B8R1.17 C=CCC1OC1CCl Amb27592474 [0,0,0,1,0,0|1,0,2]=4 3791 B8R1.17 C=CC[C@@H]1O[C@@H]1CO Amb27972324 [0,0,0,1,0,0|0,0,2]=3 3792 B8R1.17 C=C[C@H]1O[C@H]1CCO Amb27208168 [0,0,0,1,0,0|2,0,1]=4 3793 B8R1.17 CC#CC1OC1CO Amb28069464 [0,0,0,1,0,0|0,0,2]=3 3794 B8R1.17 CC#C[C@H]1O[C@@H]1CO Amb27970931 [0,0,0,1,0,0|0,0,2]=3 3795 B8R1.17 CCC1C[C@H]1CCO Amb28429951 [0,0,0,1,0,0|1,0,0]=2 3796 B8R1.17 CCC1OC1CCO Amb25144428 [0,0,0,1,0,0|2,0,0]=3 3797 B8R1.17 CCCC1=CC1CO Amb27804429 [0,0,0,1,0,0|1,0,1]=3 3798 B8R1.17 CCCC1CC1CC Amb25784549 [0,0,0,1,0,0|2,0,0]=3 3799 B8R1.17 CCCC1CC1NC Amb28131197 [0,0,0,1,0,0|3,0,0]=4 3800 B8R1.17 CCCC1SC1CO Amb27751937 [0,0,0,1,0,0|0,1,0]=2 3801 B8R1.17 CCC[C@@H]1C[C@@H]1C=O Amb27841173 [0,0,0,1,0,0|1,0,2]=4 3802 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33209408 [0,0,0,1,0,0|2,0,0]=3 3803 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33465479 [0,0,0,1,0,0|2,0,0]=3 3804 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,0,0,1,0,0|1,0,0]=2 3805 B8R1.17 CCC[C@@H]1O[C@@H]1C=O Amb28142382 [0,0,0,1,0,0|0,0,2]=3 3806 B8R1.17 CCC[C@@H]1O[C@@H]1CO Amb26564240 [0,0,0,1,0,0|0,0,0]=1 3807 B8R1.17 CCC[C@@H]1O[C@H]1CBr Amb28319242 [0,0,0,1,0,0|1,0,0]=2 3808 B8R1.17 CCC[C@H]1C[C@H]1CO Amb28345377 [0,0,0,1,0,0|1,0,0]=2 3809 B8R1.17 CCC[C@H]1S[C@@H]1CO Amb27977865 [0,0,0,1,0,0|0,1,0]=2 3810 B8R1.17 CCOC1CC1CBr Amb35732117 [0,0,0,1,0,0|3,0,0]=4 3811 B8R1.17 CCOC1CC1CCl Amb35732115 [0,0,0,1,0,0|3,0,0]=4 3812 B8R1.17 CCOC1CC1CN Amb35713826 [0,0,0,1,0,0|3,0,0]=4 3813 B8R1.17 CCOC1CC1CO Amb28048916 [0,0,0,1,0,0|2,0,0]=3 3814 B8R1.17 CC[C@@H]1C[C@H]1CC#N Amb32697068 [0,0,0,1,0,0|2,0,1]=4 3815 B8R1.17 CC[C@@H]1C[C@H]1CCN Amb32697069 [0,0,0,1,0,0|2,0,0]=3 3816 B8R1.17 CC[C@@H]1O[C@H]1CC=O Amb27224841 [0,0,0,1,0,0|2,0,1]=4 3817 B8R1.17 CC[C@@H]1O[C@H]1CCCl Amb28436373 [0,0,0,1,0,0|2,0,0]=3 3818 B8R1.17 CC[C@@H]1O[C@H]1CCN Amb27810614 [0,0,0,1,0,0|2,0,0]=3 3819 B8R1.17 CC[C@H]1O[C@@H]1CCBr Amb28247992 [0,0,0,1,0,0|2,0,0]=3 3820 B8R1.17 CC[C@H]1O[C@@H]1CCN Amb28369654 [0,0,0,1,0,0|2,0,0]=3 3821 B8R1.17 CC[C@H]1O[C@H]1CCBr Amb27640561 [0,0,0,1,0,0|2,0,0]=3 3822 B8R1.17 CC[C@H]1O[C@H]1CCCl Amb27630507 [0,0,0,1,0,0|2,0,0]=3 3823 B8R1.17 CC\C=C1\CC1CO Amb27879710 [0,0,0,1,0,0|1,0,2]=4 3824 B8R1.17 CNCC1CC1CN Amb23538703 [0,0,0,1,0,0|3,0,0]=4 3825 B8R1.17 COCC1CC1CN Amb33428667 [0,0,0,1,0,0|3,0,0]=4 3826 B8R1.17 COC[C@@H]1C[C@H]1CBr Amb27454431 [0,0,0,1,0,0|3,0,0]=4 3827 B8R1.17 COC[C@@H]1C[C@H]1CN Amb33428668 [0,0,0,1,0,0|3,0,0]=4 3828 B8R1.17 COC[C@@H]1C[C@H]1CO Amb27853195 [0,0,0,1,0,0|2,0,0]=3 3829 B8R1.17 CONC1CC1CO Amb27783686 [0,0,0,1,0,0|3,0,0]=4 3830 B8R1.17 CSCC1CC1CN Amb33271715 [0,0,0,1,0,0|3,0,0]=4 3831 B8R1.17 CSC[C@@H]1C[C@H]1CN Amb33271716 [0,0,0,1,0,0|3,0,0]=4 3832 B8R1.17 C\C=C\C1CC1CO Amb28069598 [0,0,0,1,0,0|1,0,2]=4 3833 B8R1.17 C\C=C\[C@@H]1C[C@@H]1CO Amb27219006 [0,0,0,1,0,0|1,0,2]=4 3834 B8R1.17 C\C=C\[C@@H]1O[C@H]1CO Amb27980584 [0,0,0,1,0,0|0,0,2]=3 3835 B8R1.17 NCC1CC1CCF Amb33196092 [0,0,0,1,0,0|3,0,0]=4 3836 B8R1.17 NC[C@@H]1C[C@H]1CCF Amb33196093 [0,0,0,1,0,0|3,0,0]=4 3837 B8R1.17 O=CC1OC1CCBr Amb27657238 [0,0,0,1,0,0|1,0,2]=4 3838 B8R1.17 OC[C@@H]1C[C@H]1CCBr Amb28193405 [0,0,0,1,0,0|2,0,0]=3 3839 B8R1.22 BrC1CCCCCC1 Amb3940357 [0,0,0,1,0,0|2,0,0]=3 3840 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,0,0]=3 3841 B8R1.22 BrC1CCCSCC1 Amb35627432 [0,0,0,1,0,0|2,1,0]=4 3842 B8R1.22 BrC1CNCCOC1 Amb27785215 [0,0,0,1,0,0|2,0,0]=3 3843 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,0,0,1,0,0|2,0,1]=4 3844 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|2,0,0]=3 3845 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|2,0,0]=3 3846 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|1,0,0]=2 3847 B8R1.22 CC1CCCCNC1 Amb22886304 [0,0,0,1,0,0|2,0,0]=3 3848 B8R1.22 CC1CCCCNC1 Amb27202179 [0,0,0,1,0,0|2,0,0]=3 3849 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,0]=3 3850 B8R1.22 CC1CCCNCC1 Amb9316855 [0,0,0,1,0,0|2,0,0]=3 3851 B8R1.22 CC1CCCOCO1 Amb28046311 [0,0,0,1,0,0|2,0,0]=3 3852 B8R1.22 CC1CCNCCN1 Amb24053173 [0,0,0,1,0,0|2,0,0]=3 3853 B8R1.22 CC1CCNCCN1 Amb8630390 [0,0,0,1,0,0|2,0,0]=3 3854 B8R1.22 CC1CCNCCO1 Amb26412871 [0,0,0,1,0,0|1,0,0]=2 3855 B8R1.22 CC1CCNCCO1 Amb30585117 [0,0,0,1,0,0|1,0,0]=2 3856 B8R1.22 CC1CCNCCS1 Amb33530238 [0,0,0,1,0,0|1,1,0]=3 3857 B8R1.22 CC1CCOCCN1 Amb25108477 [0,0,0,1,0,0|1,0,0]=2 3858 B8R1.22 CC1CCOCCN1 Amb30585116 [0,0,0,1,0,0|1,0,0]=2 3859 B8R1.22 CC1CCSCCN1 Amb28934844 [0,0,0,1,0,0|1,1,0]=3 3860 B8R1.22 CC1CCSCCN1 Amb33540166 [0,0,0,1,0,0|1,1,0]=3 3861 B8R1.22 CC1CNCCCN1 Amb33544983 [0,0,0,1,0,0|3,0,0]=4 3862 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|2,0,0]=3 3863 B8R1.22 CC1CNCCCO1 Amb9358449 [0,0,0,1,0,0|2,0,0]=3 3864 B8R1.22 CC1CNCCCS1 Amb27238313 [0,0,0,1,0,0|2,1,0]=4 3865 B8R1.22 CC1CNCCNC1 Amb10608863 [0,0,0,1,0,0|3,0,0]=4 3866 B8R1.22 CC1CNCCNC1 Amb8630420 [0,0,0,1,0,0|3,0,0]=4 3867 B8R1.22 CC1CNCCOC1 Amb22886318 [0,0,0,1,0,0|2,0,0]=3 3868 B8R1.22 CC1CNCCOC1 Amb33545514 [0,0,0,1,0,0|2,0,0]=3 3869 B8R1.22 CC1CNCCSC1 Amb22642304 [0,0,0,1,0,0|2,1,0]=4 3870 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,0,0]=3 3871 B8R1.22 CC1CSCCCN1 Amb25870575 [0,0,0,1,0,0|2,1,0]=4 3872 B8R1.22 CC1CSCCCN1 Amb30585125 [0,0,0,1,0,0|2,1,0]=4 3873 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,1,0,0|2,0,0]=3 3874 B8R1.22 CN1CCCCCC1 Amb22729377 [0,0,0,1,0,0|3,0,0]=4 3875 B8R1.22 CN1CCCNCC1 Amb22167533 [0,0,0,1,0,0|3,0,0]=4 3876 B8R1.22 CN1CCCNCC1 Amb3939085 [0,0,0,1,0,0|3,0,0]=4 3877 B8R1.22 CN1CCNCCO1 Amb27226764 [0,0,0,1,0,0|2,0,0]=3 3878 B8R1.22 C[C@@H]1CCCCCN1 Amb27391648 [0,0,0,1,0,0|2,0,0]=3 3879 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,0,0,1,0,0|1,0,0]=2 3880 B8R1.22 C[C@@H]1CNCCCN1 Amb35825205 [0,0,0,1,0,0|3,0,0]=4 3881 B8R1.22 C[C@@H]1COCCCN1 Amb27881643 [0,0,0,1,0,0|2,0,0]=3 3882 B8R1.22 C[C@H]1CNCCCN1 Amb26461498 [0,0,0,1,0,0|3,0,0]=4 3883 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,0,0,1,0,0|2,0,0]=3 3884 B8R1.22 ClC1CCCCNC1 Amb28048243 [0,0,0,1,0,0|2,0,0]=3 3885 B8R1.22 ClC1CCCCOC1 Amb27409037 [0,0,0,1,0,0|1,0,0]=2 3886 B8R1.22 ClC1CCCOCC1 Amb27471515 [0,0,0,1,0,0|2,0,0]=3 3887 B8R1.22 ClC1CCCSCC1 Amb35650778 [0,0,0,1,0,0|2,1,0]=4 3888 B8R1.22 ClN1CCCOCC1 Amb27217968 [0,0,0,1,0,0|3,0,0]=4 3889 B8R1.22 FC1CCCCCC1 Amb28049012 [0,0,0,1,0,0|2,0,0]=3 3890 B8R1.22 FC1CCCCNC1 Amb13953139 [0,0,0,1,0,0|2,0,0]=3 3891 B8R1.22 FC1CCCCNC1 Amb22886275 [0,0,0,1,0,0|2,0,0]=3 3892 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|3,0,0]=4 3893 B8R1.22 FC1CCCNCC1 Amb27453588 [0,0,0,1,0,0|3,0,0]=4 3894 B8R1.22 FC1CNCCNC1 Amb22496406 [0,0,0,1,0,0|3,0,0]=4 3895 B8R1.22 IC1CCCOCC1 Amb26563301 [0,0,0,1,0,0|2,0,0]=3 3896 B8R1.22 NC1C=CCCCC1 Amb24377373 [0,0,0,1,0,0|2,0,1]=4 3897 B8R1.22 NC1CC=CCCC1 Amb27408037 [0,0,0,1,0,0|2,0,1]=4 3898 B8R1.22 NC1CCCCCC1 Amb2720336 [0,0,0,1,0,0|2,0,0]=3 3899 B8R1.22 NC1CCCCNC1 Amb2684433 [0,0,0,1,0,0|2,0,0]=3 3900 B8R1.22 NC1CCCCNC1 Amb8631384 [0,0,0,1,0,0|2,0,0]=3 3901 B8R1.22 NC1CCCNCC1 Amb4296999 [0,0,0,1,0,0|3,0,0]=4 3902 B8R1.22 NC1CCCOCC1 Amb33547346 [0,0,0,1,0,0|2,0,0]=3 3903 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,1,0]=4 3904 B8R1.22 NC1CCCSCC1 Amb33328660 [0,0,0,1,0,0|2,1,0]=4 3905 B8R1.22 NC1CNCCNC1 Amb8630421 [0,0,0,1,0,0|3,0,0]=4 3906 B8R1.22 NC1COCCOC1 Amb20669196 [0,0,0,1,0,0|2,0,0]=3 3907 B8R1.22 NC1COCCOC1 Amb24452281 [0,0,0,1,0,0|2,0,0]=3 3908 B8R1.22 NC1CSCCSC1 Amb27252120 [0,0,0,1,0,0|2,1,0]=4 3909 B8R1.22 NN1CCCCCC1 Amb836794 [0,0,0,1,0,0|3,0,0]=4 3910 B8R1.22 N[C@@H]1CCCCNC1 Amb16185497 [0,0,0,1,0,0|2,0,0]=3 3911 B8R1.22 N[C@H]1CCCCNC1 Amb22744950 [0,0,0,1,0,0|2,0,0]=3 3912 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,0,0,1,0,0|1,0,2]=4 3913 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,0,0,1,0,0|2,0,1]=4 3914 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,0,0,1,0,0|1,0,2]=4 3915 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,0,0,1,0,0|1,0,2]=4 3916 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,0,0,1,0,0|2,0,1]=4 3917 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,0,0,1,0,0|2,0,1]=4 3918 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,0,0,1,0,0|2,0,1]=4 3919 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,0,0,1,0,0|1,0,2]=4 3920 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,1,0,0|1,0,2]=4 3921 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,1,0,0|1,0,2]=4 3922 B8R1.22 OC1C=CCCCC1 Amb26034783 [0,0,0,1,0,0|1,0,1]=3 3923 B8R1.22 OC1C=COCOC1 Amb27653186 [0,0,0,1,0,0|1,0,2]=4 3924 B8R1.22 OC1CCC=CCO1 Amb28197000 [0,0,0,1,0,0|2,0,1]=4 3925 B8R1.22 OC1CCCCCC1 Amb3940358 [0,0,0,1,0,0|1,0,0]=2 3926 B8R1.22 OC1CCCCCO1 Amb4034492 [0,0,0,1,0,0|2,0,0]=3 3927 B8R1.22 OC1CCCCCS1 Amb17615898 [0,0,0,1,0,0|2,0,0]=3 3928 B8R1.22 OC1CCCCNC1 Amb22371121 [0,0,0,1,0,0|1,0,0]=2 3929 B8R1.22 OC1CCCCNC1 Amb22886250 [0,0,0,1,0,0|1,0,0]=2 3930 B8R1.22 OC1CCCCOC1 Amb27424901 [0,0,0,1,0,0|0,0,0]=1 3931 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|2,0,0]=3 3932 B8R1.22 OC1CCCNCC1 Amb2695607 [0,0,0,1,0,0|2,0,0]=3 3933 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|2,0,0]=3 3934 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|2,0,0]=3 3935 B8R1.22 OC1CNCCNC1 Amb30867933 [0,0,0,1,0,0|2,0,0]=3 3936 B8R1.22 OC1CNCCNC1 Amb8630419 [0,0,0,1,0,0|2,0,0]=3 3937 B8R1.22 OC1CNCCOC1 Amb22886365 [0,0,0,1,0,0|1,0,0]=2 3938 B8R1.22 OC1CNCCOC1 Amb27258663 [0,0,0,1,0,0|1,0,0]=2 3939 B8R1.22 OC1COCCOC1 Amb27478103 [0,0,0,1,0,0|1,0,0]=2 3940 B8R1.22 OC1OCCCCO1 Amb27197834 [0,0,0,1,0,0|3,0,0]=4 3941 B8R1.22 O[C@@H]1C=CCCCC1 Amb28205998 [0,0,0,1,0,0|1,0,1]=3 3942 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,0,0,1,0,0|0,0,0]=1 3943 B8R1.22 O[C@@H]1CNCCOC1 Amb22325588 [0,0,0,1,0,0|1,0,0]=2 3944 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,0,0,1,0,0|2,0,0]=3 3945 B8R1.22 O[C@H]1CNCCOC1 Amb28074197 [0,0,0,1,0,0|1,0,0]=2 3946 B8R1.22 SC1CCCCCC1 Amb9208052 [0,0,0,1,0,0|1,1,0]=3 3947 B8R1.22 SC1CCCNCC1 Amb32788297 [0,0,0,1,0,0|2,1,0]=4 3948 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|2,0,0]=3 3949 B8R1.22 SC1CCCSCC1 Amb32788173 [0,0,0,1,0,0|2,1,0]=4 3950 B8R1.22 SC1COCCOC1 Amb26924486 [0,0,0,1,0,0|1,1,0]=3 3951 B8R1.36 BrCCC#CC1CC1 Amb28458509 [0,0,0,1,0,0|2,0,1]=4 3952 B8R1.36 BrCCCCC1CC1 Amb27220703 [0,0,0,1,0,0|2,0,0]=3 3953 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,0,0,1,0,0|2,0,0]=3 3954 B8R1.36 BrCCOCC1CC1 Amb6681170 [0,0,0,1,0,0|1,0,0]=2 3955 B8R1.36 BrCCOCC1CO1 Amb33743831 [0,0,0,1,0,0|2,0,0]=3 3956 B8R1.36 C#CCCCC1CC1 Amb33361008 [0,0,0,1,0,0|2,0,1]=4 3957 B8R1.36 C#CCNCC1CC1 Amb33550303 [0,0,0,1,0,0|2,0,1]=4 3958 B8R1.36 C#CCNCC1CC1 Amb9423017 [0,0,0,1,0,0|2,0,1]=4 3959 B8R1.36 C#CCOCC1CC1 Amb23598933 [0,0,0,1,0,0|1,0,1]=3 3960 B8R1.36 C#CCSCC1CC1 Amb28188282 [0,0,0,1,0,0|1,1,1]=4 3961 B8R1.36 C=CCCOC1CC1 Amb27395678 [0,0,0,1,0,0|1,0,2]=4 3962 B8R1.36 C=CCNCC1CC1 Amb9423018 [0,0,0,1,0,0|2,0,1]=4 3963 B8R1.36 C=CCOCC1CC1 Amb25303107 [0,0,0,1,0,0|1,0,1]=3 3964 B8R1.36 CCCCCC1CC1 Amb27203905 [0,0,0,1,0,0|2,0,0]=3 3965 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|1,0,0]=2 3966 B8R1.36 CCCCC[C@@H]1CO1 Amb27862379 [0,0,0,1,0,0|1,0,0]=2 3967 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,0]=3 3968 B8R1.36 CCCCNC1CC1 Amb6892806 [0,0,0,1,0,0|2,0,0]=3 3969 B8R1.36 CCCNCC1CC1 Amb3939845 [0,0,0,1,0,0|2,0,0]=3 3970 B8R1.36 CCC\C=C\C1CO1 Amb33475203 [0,0,0,1,0,0|1,0,1]=3 3971 B8R1.36 CCC\C=C\[C@@H]1CO1 Amb33373326 [0,0,0,1,0,0|1,0,1]=3 3972 B8R1.36 CCC\C=C\[C@H]1CO1 Amb33373327 [0,0,0,1,0,0|1,0,1]=3 3973 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|3,0,0]=4 3974 B8R1.36 CCOCCC1CO1 Amb25679046 [0,0,0,1,0,0|2,0,0]=3 3975 B8R1.36 CCSCCC1CO1 Amb26575735 [0,0,0,1,0,0|2,0,0]=3 3976 B8R1.36 CC\C=C\CC1CO1 Amb33079841 [0,0,0,1,0,0|1,0,2]=4 3977 B8R1.36 CNCCCC1CC1 Amb26658568 [0,0,0,1,0,0|3,0,0]=4 3978 B8R1.36 CNCCNC1CC1 Amb2691995 [0,0,0,1,0,0|3,0,0]=4 3979 B8R1.36 CNCCOC1CC1 Amb25831972 [0,0,0,1,0,0|2,0,0]=3 3980 B8R1.36 COCCCC1CO1 Amb24676522 [0,0,0,1,0,0|2,0,0]=3 3981 B8R1.36 COCCNC1CC1 Amb24271078 [0,0,0,1,0,0|3,0,0]=4 3982 B8R1.36 COCCNC1CC1 Amb6247358 [0,0,0,1,0,0|3,0,0]=4 3983 B8R1.36 COCOCC1CC1 Amb27972311 [0,0,0,1,0,0|2,0,0]=3 3984 B8R1.36 CSCCCC1CO1 Amb24687956 [0,0,0,1,0,0|2,0,0]=3 3985 B8R1.36 C\C=C\CCC1CO1 Amb27662671 [0,0,0,1,0,0|1,0,2]=4 3986 B8R1.36 C\C=C\CC[C@H]1CO1 Amb27852839 [0,0,0,1,0,0|1,0,2]=4 3987 B8R1.36 ClCCCCC1CC1 Amb27422896 [0,0,0,1,0,0|2,0,0]=3 3988 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,0,0,1,0,0|2,0,0]=3 3989 B8R1.36 ClCCOCC1CC1 Amb8828487 [0,0,0,1,0,0|1,0,0]=2 3990 B8R1.36 ClCCOC[C@@H]1CO1 Amb28255551 [0,0,0,1,0,0|2,0,0]=3 3991 B8R1.36 FCCNCC1CC1 Amb27829483 [0,0,0,1,0,0|2,0,0]=3 3992 B8R1.36 ICCNCC1CC1 Amb27801832 [0,0,0,1,0,0|2,0,0]=3 3993 B8R1.36 N#CCCCC1CC1 Amb33362400 [0,0,0,1,0,0|2,0,1]=4 3994 B8R1.36 N#CCNCC1CC1 Amb6707442 [0,0,0,1,0,0|2,0,1]=4 3995 B8R1.36 N#CCOCC1CC1 Amb6681183 [0,0,0,1,0,0|1,0,1]=3 3996 B8R1.36 N#CNOCC1CC1 Amb35592252 [0,0,0,1,0,0|2,0,1]=4 3997 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|2,0,0]=3 3998 B8R1.36 NCCCNC1CC1 Amb17315307 [0,0,0,1,0,0|3,0,0]=4 3999 B8R1.36 NCCCOC1CC1 Amb28436320 [0,0,0,1,0,0|2,0,0]=3 4000 B8R1.36 NCCNCC1CC1 Amb18523825 [0,0,0,1,0,0|2,0,0]=3 4001 B8R1.36 NCCNCC1CC1 Amb30585085 [0,0,0,1,0,0|2,0,0]=3 4002 B8R1.36 NCCOCC1CC1 Amb33545837 [0,0,0,1,0,0|1,0,0]=2 4003 B8R1.36 NCCOCC1CC1 Amb6681126 [0,0,0,1,0,0|1,0,0]=2 4004 B8R1.36 NCCSCC1CC1 Amb6760936 [0,0,0,1,0,0|1,1,0]=3 4005 B8R1.36 NCC\N=C\C1CC1 Amb27599822 [0,0,0,1,0,0|2,0,1]=4 4006 B8R1.36 NC\C=C\CC1CC1 Amb33361219 [0,0,0,1,0,0|2,0,1]=4 4007 B8R1.36 NNCCCC1CC1 Amb28316216 [0,0,0,1,0,0|3,0,0]=4 4008 B8R1.36 NOCCCC1CC1 Amb33362397 [0,0,0,1,0,0|3,0,0]=4 4009 B8R1.36 O=CCCCC1CC1 Amb27948530 [0,0,0,1,0,0|1,0,2]=4 4010 B8R1.36 O=CCCCC1CO1 Amb27643593 [0,0,0,1,0,0|2,0,1]=4 4011 B8R1.36 O=CCCC[C@H]1CO1 Amb28134306 [0,0,0,1,0,0|2,0,1]=4 4012 B8R1.36 O=CCOCC1CC1 Amb28401147 [0,0,0,1,0,0|0,0,2]=3 4013 B8R1.36 O=CNOCC1CC1 Amb35636971 [0,0,0,1,0,0|1,0,2]=4 4014 B8R1.36 OCCCC=C1CC1 Amb28400996 [0,0,0,1,0,0|1,0,2]=4 4015 B8R1.36 OCCCCC1CC1 Amb26059385 [0,0,0,1,0,0|1,0,0]=2 4016 B8R1.36 OCCCCC1CO1 Amb28410478 [0,0,0,1,0,0|2,0,0]=3 4017 B8R1.36 OCCCC[C@H]1CO1 Amb28206206 [0,0,0,1,0,0|2,0,0]=3 4018 B8R1.36 OCCCNC1CC1 Amb17317872 [0,0,0,1,0,0|2,0,0]=3 4019 B8R1.36 OCCCOC1CC1 Amb27260208 [0,0,0,1,0,0|2,0,0]=3 4020 B8R1.36 OCCCSC1CC1 Amb28284998 [0,0,0,1,0,0|2,0,0]=3 4021 B8R1.36 OCCNCC1CC1 Amb30640115 [0,0,0,1,0,0|1,0,0]=2 4022 B8R1.36 OCCNCC1CC1 Amb6707494 [0,0,0,1,0,0|1,0,0]=2 4023 B8R1.36 OCCOCC1CC1 Amb24729221 [0,0,0,1,0,0|0,0,0]=1 4024 B8R1.36 OCCOCC1CO1 Amb9731370 [0,0,0,1,0,0|1,0,0]=2 4025 B8R1.36 OCCSCC1CC1 Amb9423411 [0,0,0,1,0,0|0,1,0]=2 4026 B8R1.36 OC\C=C\CC1CC1 Amb33361220 [0,0,0,1,0,0|1,0,1]=3 4027 B8R1.36 ONCCCC1CC1 Amb27427292 [0,0,0,1,0,0|2,0,0]=3 4028 B8R1.36 SCCCCC1CC1 Amb32788277 [0,0,0,1,0,0|1,1,0]=3 4029 B8R1.36 [C-]#[N+]CCCC1CC1 Amb33361456 [0,0,0,1,0,0|3,0,0]=4 4030 B8R1.49 C1=CCCCCCC1 Amb8513502 [0,0,0,1,0,0|2,0,1]=4 4031 B8R1.49 C1=CCCNCCC1 Amb28346195 [0,0,0,1,0,0|2,0,1]=4 4032 B8R1.49 C1=CCNCCCC1 Amb33038369 [0,0,0,1,0,0|2,0,1]=4 4033 B8R1.49 C1=CCNCCCC1 Amb33038370 [0,0,0,1,0,0|2,0,1]=4 4034 B8R1.49 C1CCCNCCC1 Amb3997183 [0,0,0,1,0,0|2,0,0]=3 4035 B8R1.49 C1CCNCCNC1 Amb24428659 [0,0,0,1,0,0|2,0,0]=3 4036 B8R1.49 C1CNCCCNC1 Amb6740292 [0,0,0,1,0,0|3,0,0]=4 4037 B8R1.49 C1CNCCCOC1 Amb26627441 [0,0,0,1,0,0|2,0,0]=3 4038 B8R1.49 C1COCOCCN1 Amb20669185 [0,0,0,1,0,0|2,0,0]=3 4039 B8R1.49 C1COCOCCO1 Amb22227715 [0,0,0,1,0,0|1,0,0]=2 4040 B5R0.2 BrCCCCBr Amb2686718 [2,0,0,0,0,0|2,0,0]=4 4041 B5R0.2 BrCCCCI Amb25861429 [2,0,0,0,0,0|2,0,0]=4 4042 B5R0.2 C#CCCCC Amb4135448 [2,0,0,0,0,0|0,0,2]=4 4043 B5R0.2 C#CCCCO Amb1219893 [2,0,0,0,0,0|0,0,2]=4 4044 B5R0.2 C#CCCOC Amb18117254 [2,0,0,0,0,0|0,0,2]=4 4045 B5R0.2 C#CCOCC Amb17673317 [2,0,0,0,0,0|0,0,2]=4 4046 B5R0.2 C#CCOCO Amb28453666 [2,0,0,0,0,0|0,0,2]=4 4047 B5R0.2 C#NCCCC Amb31132446 [2,0,0,0,0,0|1,0,1]=4 4048 B5R0.2 C=CCCCC Amb3940497 [2,0,0,0,0,0|0,0,2]=4 4049 B5R0.2 C=CCCCO Amb8513439 [2,0,0,0,0,0|0,0,2]=4 4050 B5R0.2 C=CCCOC Amb28065418 [2,0,0,0,0,0|0,0,2]=4 4051 B5R0.2 C=CCOCC Amb2684299 [2,0,0,0,0,0|0,0,2]=4 4052 B5R0.2 C=COCCC Amb17940706 [2,0,0,0,0,0|0,0,2]=4 4053 B5R0.2 C=COCCO Amb17674184 [2,0,0,0,0,0|0,0,2]=4 4054 B5R0.2 CC#CCCC Amb8515369 [2,0,0,0,0,0|0,0,2]=4 4055 B5R0.2 CC#CCCO Amb2721725 [2,0,0,0,0,0|0,0,2]=4 4056 B5R0.2 CC#CCOC Amb27424463 [2,0,0,0,0,0|0,0,2]=4 4057 B5R0.2 CC#COCC Amb17673840 [2,0,0,0,0,0|0,0,2]=4 4058 B5R0.2 CCC#CCC Amb8515372 [2,0,0,0,0,0|0,0,2]=4 4059 B5R0.2 CCC#CCO Amb2721726 [2,0,0,0,0,0|0,0,2]=4 4060 B5R0.2 CCCCC#N Amb6662839 [2,0,0,0,0,0|1,0,1]=4 4061 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,2]=4 4062 B5R0.2 CCCCCBr Amb3940084 [2,0,0,0,0,0|1,0,0]=3 4063 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,0]=2 4064 B5R0.2 CCCCCCl Amb8514576 [2,0,0,0,0,0|1,0,0]=3 4065 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 4066 B5R0.2 CCCCCI Amb6891946 [2,0,0,0,0,0|1,0,0]=3 4067 B5R0.2 CCCCCN Amb3939830 [2,0,0,0,0,0|1,0,0]=3 4068 B5R0.2 CCCCCO Amb3939051 [2,0,0,0,0,0|0,0,0]=2 4069 B5R0.2 CCCCCS Amb8513287 [2,0,0,0,0,0|0,1,0]=3 4070 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|0,1,0]=3 4071 B5R0.2 CCCCNC Amb3939351 [2,0,0,0,0,0|1,0,0]=3 4072 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 4073 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 4074 B5R0.2 CCCCNN Amb33055062 [2,0,0,0,0,0|2,0,0]=4 4075 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,0]=3 4076 B5R0.2 CCCCNO Amb32687485 [2,0,0,0,0,0|1,0,0]=3 4077 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|1,0,0]=3 4078 B5R0.2 CCCCON Amb6308542 [2,0,0,0,0,0|1,0,0]=3 4079 B5R0.2 CCCCSC Amb4036342 [2,0,0,0,0,0|0,1,0]=3 4080 B5R0.2 CCCNCC Amb3939843 [2,0,0,0,0,0|1,0,0]=3 4081 B5R0.2 CCCNNC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 4082 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|1,0,0]=3 4083 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|0,0,0]=2 4084 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|1,0,0]=3 4085 B5R0.2 CCCSCC Amb22168047 [2,0,0,0,0,0|0,1,0]=3 4086 B5R0.2 CCCSCCl Amb28146719 [2,0,0,0,0,0|1,1,0]=4 4087 B5R0.2 CCC\C=N\O Amb27213413 [2,0,0,0,0,0|1,0,1]=4 4088 B5R0.2 CCNCCBr Amb27950012 [2,0,0,0,0,0|2,0,0]=4 4089 B5R0.2 CCNCCCl Amb17334050 [2,0,0,0,0,0|2,0,0]=4 4090 B5R0.2 CCNCCCl Amb33869917 [2,0,0,0,0,0|2,0,0]=4 4091 B5R0.2 CCNCCF Amb27858242 [2,0,0,0,0,0|2,0,0]=4 4092 B5R0.2 CCNCCI Amb27856942 [2,0,0,0,0,0|2,0,0]=4 4093 B5R0.2 CCNCCN Amb6297789 [2,0,0,0,0,0|2,0,0]=4 4094 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,0]=3 4095 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|1,0,0]=3 4096 B5R0.2 CCNCCP Amb27188285 [2,0,0,0,0,0|2,0,0]=4 4097 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 4098 B5R0.2 CCNOCC Amb26852166 [2,0,0,0,0,0|1,0,0]=3 4099 B5R0.2 CCNOCC Amb32655926 [2,0,0,0,0,0|1,0,0]=3 4100 B5R0.2 CCOCC#N Amb6263119 [2,0,0,0,0,0|1,0,1]=4 4101 B5R0.2 CCOCCBr Amb1158671 [2,0,0,0,0,0|1,0,0]=3 4102 B5R0.2 CCOCCCl Amb8390350 [2,0,0,0,0,0|1,0,0]=3 4103 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|1,0,0]=3 4104 B5R0.2 CCOCCN Amb1130918 [2,0,0,0,0,0|1,0,0]=3 4105 B5R0.2 CCOCCN Amb29844456 [2,0,0,0,0,0|1,0,0]=3 4106 B5R0.2 CCOCCO Amb3939142 [2,0,0,0,0,0|0,0,0]=2 4107 B5R0.2 CCOCCS Amb9316644 [2,0,0,0,0,0|0,1,0]=3 4108 B5R0.2 CCSCCBr Amb2685158 [2,0,0,0,0,0|1,1,0]=4 4109 B5R0.2 CCSCCCl Amb3940261 [2,0,0,0,0,0|1,1,0]=4 4110 B5R0.2 CCSCCN Amb2687948 [2,0,0,0,0,0|1,1,0]=4 4111 B5R0.2 CCSCCN Amb9825826 [2,0,0,0,0,0|1,1,0]=4 4112 B5R0.2 CCSCCO Amb1085958 [2,0,0,0,0,0|0,1,0]=3 4113 B5R0.2 CCSCCS Amb27167723 [2,0,0,0,0,0|0,2,0]=4 4114 B5R0.2 CCSSCC Amb8516624 [2,0,0,0,0,0|1,1,0]=4 4115 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|1,1,0]=4 4116 B5R0.2 CC\C=C/CC Amb8517211 [2,0,0,0,0,0|0,0,2]=4 4117 B5R0.2 CC\C=C/CO Amb10975881 [2,0,0,0,0,0|0,0,2]=4 4118 B5R0.2 CC\C=C\CC Amb4016243 [2,0,0,0,0,0|0,0,2]=4 4119 B5R0.2 CC\C=C\CO Amb22347892 [2,0,0,0,0,0|0,0,2]=4 4120 B5R0.2 CC\N=N/CC Amb27851864 [2,0,0,0,0,0|2,0,0]=4 4121 B5R0.2 CC\N=N\CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 4122 B5R0.2 CNCCCBr Amb28291325 [2,0,0,0,0,0|2,0,0]=4 4123 B5R0.2 CNCCCBr Amb33473632 [2,0,0,0,0,0|2,0,0]=4 4124 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 4125 B5R0.2 CNCCCCl Amb3941419 [2,0,0,0,0,0|2,0,0]=4 4126 B5R0.2 CNCCCF Amb27405698 [2,0,0,0,0,0|2,0,0]=4 4127 B5R0.2 CNCCCN Amb2698065 [2,0,0,0,0,0|2,0,0]=4 4128 B5R0.2 CNCCCO Amb9246656 [2,0,0,0,0,0|1,0,0]=3 4129 B5R0.2 CNCCNC Amb4037059 [2,0,0,0,0,0|2,0,0]=4 4130 B5R0.2 CNCCNO Amb27976196 [2,0,0,0,0,0|2,0,0]=4 4131 B5R0.2 CNCCOC Amb10609606 [2,0,0,0,0,0|1,0,0]=3 4132 B5R0.2 CNCCOC Amb2689126 [2,0,0,0,0,0|1,0,0]=3 4133 B5R0.2 CNCCSC Amb15701319 [2,0,0,0,0,0|1,1,0]=4 4134 B5R0.2 CNCCSC Amb20625111 [2,0,0,0,0,0|1,1,0]=4 4135 B5R0.2 CNOCCN Amb22411501 [2,0,0,0,0,0|2,0,0]=4 4136 B5R0.2 CNOCCN Amb22490915 [2,0,0,0,0,0|2,0,0]=4 4137 B5R0.2 CNOCCO Amb27637954 [2,0,0,0,0,0|1,0,0]=3 4138 B5R0.2 COCCC#N Amb2819688 [2,0,0,0,0,0|1,0,1]=4 4139 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,1]=4 4140 B5R0.2 COCCCBr Amb8828205 [2,0,0,0,0,0|1,0,0]=3 4141 B5R0.2 COCCCCl Amb6255994 [2,0,0,0,0,0|1,0,0]=3 4142 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|1,0,0]=3 4143 B5R0.2 COCCCI Amb33546474 [2,0,0,0,0,0|1,0,0]=3 4144 B5R0.2 COCCCN Amb3939346 [2,0,0,0,0,0|1,0,0]=3 4145 B5R0.2 COCCCO Amb8385593 [2,0,0,0,0,0|1,0,0]=3 4146 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|1,0,0]=3 4147 B5R0.2 COCCNN Amb10609107 [2,0,0,0,0,0|2,0,0]=4 4148 B5R0.2 COCCNN Amb19374182 [2,0,0,0,0,0|2,0,0]=4 4149 B5R0.2 COCCNN Amb22233534 [2,0,0,0,0,0|2,0,0]=4 4150 B5R0.2 COCCNN Amb22587527 [2,0,0,0,0,0|2,0,0]=4 4151 B5R0.2 COCCNN Amb6248350 [2,0,0,0,0,0|2,0,0]=4 4152 B5R0.2 COCCNO Amb25284480 [2,0,0,0,0,0|2,0,0]=4 4153 B5R0.2 COCCOC Amb6741456 [2,0,0,0,0,0|1,0,0]=3 4154 B5R0.2 COCCON Amb17194148 [2,0,0,0,0,0|2,0,0]=4 4155 B5R0.2 COCCON Amb20623946 [2,0,0,0,0,0|2,0,0]=4 4156 B5R0.2 COCCSC Amb4020919 [2,0,0,0,0,0|1,0,0]=3 4157 B5R0.2 CONCCN Amb25733738 [2,0,0,0,0,0|2,0,0]=4 4158 B5R0.2 CONCCN Amb32645968 [2,0,0,0,0,0|2,0,0]=4 4159 B5R0.2 CONCCO Amb27658816 [2,0,0,0,0,0|2,0,0]=4 4160 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|1,1,0]=4 4161 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|1,1,0]=4 4162 B5R0.2 CSCCCN Amb33801570 [2,0,0,0,0,0|1,1,0]=4 4163 B5R0.2 CSCCCN Amb6718923 [2,0,0,0,0,0|1,1,0]=4 4164 B5R0.2 CSCCCO Amb3939523 [2,0,0,0,0,0|1,0,0]=3 4165 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|1,1,0]=4 4166 B5R0.2 CSCCNO Amb33272071 [2,0,0,0,0,0|2,0,0]=4 4167 B5R0.2 CSCCON Amb25806571 [2,0,0,0,0,0|2,0,0]=4 4168 B5R0.2 CSCCSC Amb25101746 [2,0,0,0,0,0|1,1,0]=4 4169 B5R0.2 C[SiH2]CCCN Amb28049027 [2,0,0,0,0,0|1,1,0]=4 4170 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|0,0,2]=4 4171 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|0,0,2]=4 4172 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|0,0,2]=4 4173 B5R0.2 C\C=C\OCC Amb8516635 [2,0,0,0,0,0|0,0,2]=4 4174 B5R0.2 C\C=N\CCC Amb27954749 [2,0,0,0,0,0|1,0,1]=4 4175 B5R0.2 ClCCCCBr Amb8391065 [2,0,0,0,0,0|2,0,0]=4 4176 B5R0.2 ClCCCCCl Amb6608890 [2,0,0,0,0,0|2,0,0]=4 4177 B5R0.2 ClCCCCI Amb8517518 [2,0,0,0,0,0|2,0,0]=4 4178 B5R0.2 ClCCOCCl Amb22000864 [2,0,0,0,0,0|2,0,0]=4 4179 B5R0.2 ClCOCCBr Amb2696015 [2,0,0,0,0,0|2,0,0]=4 4180 B5R0.2 FCCCCBr Amb2685210 [2,0,0,0,0,0|2,0,0]=4 4181 B5R0.2 FCCCCCl Amb27655616 [2,0,0,0,0,0|2,0,0]=4 4182 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 4183 B5R0.2 FCCCCI Amb28283837 [2,0,0,0,0,0|2,0,0]=4 4184 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|1,1,0]=4 4185 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 4186 B5R0.2 N#CCCCO Amb4021727 [2,0,0,0,0,0|1,0,1]=4 4187 B5R0.2 N#COCCO Amb27790421 [2,0,0,0,0,0|1,0,1]=4 4188 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 4189 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 4190 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 4191 B5R0.2 NCCCCF Amb26017241 [2,0,0,0,0,0|2,0,0]=4 4192 B5R0.2 NCCCCF Amb28555328 [2,0,0,0,0,0|2,0,0]=4 4193 B5R0.2 NCCCCI Amb27837961 [2,0,0,0,0,0|2,0,0]=4 4194 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 4195 B5R0.2 NCCCCN Amb6608640 [2,0,0,0,0,0|2,0,0]=4 4196 B5R0.2 NCCCCN Amb8514498 [2,0,0,0,0,0|2,0,0]=4 4197 B5R0.2 NCCCCO Amb3939336 [2,0,0,0,0,0|1,0,0]=3 4198 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|1,1,0]=4 4199 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|1,1,0]=4 4200 B5R0.2 NCCCNO Amb27882495 [2,0,0,0,0,0|2,0,0]=4 4201 B5R0.2 NCCCNO Amb32729324 [2,0,0,0,0,0|2,0,0]=4 4202 B5R0.2 NCCOCF Amb33378706 [2,0,0,0,0,0|2,0,0]=4 4203 B5R0.2 NNCCCO Amb19514839 [2,0,0,0,0,0|2,0,0]=4 4204 B5R0.2 NNCCCO Amb22058994 [2,0,0,0,0,0|2,0,0]=4 4205 B5R0.2 NOCCCF Amb24632017 [2,0,0,0,0,0|2,0,0]=4 4206 B5R0.2 NOCCCO Amb18061671 [2,0,0,0,0,0|2,0,0]=4 4207 B5R0.2 NOCCCS Amb17608230 [2,0,0,0,0,0|2,0,0]=4 4208 B5R0.2 NOCCCS Amb27489799 [2,0,0,0,0,0|2,0,0]=4 4209 B5R0.2 O=CCCCO Amb24589235 [2,0,0,0,0,0|1,0,1]=4 4210 B5R0.2 O=COCCO Amb26625741 [2,0,0,0,0,0|1,0,1]=4 4211 B5R0.2 O=NOCCO Amb22363071 [2,0,0,0,0,0|2,0,0]=4 4212 B5R0.2 OCCCCBr Amb8395353 [2,0,0,0,0,0|1,0,0]=3 4213 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,0]=3 4214 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,0]=3 4215 B5R0.2 OCCCCO Amb2793029 [2,0,0,0,0,0|1,0,0]=3 4216 B5R0.2 OCCNCO Amb22228429 [2,0,0,0,0,0|2,0,0]=4 4217 B5R0.2 OCCOCCl Amb24673634 [2,0,0,0,0,0|1,0,0]=3 4218 B5R0.2 ONCCCF Amb25931859 [2,0,0,0,0,0|2,0,0]=4 4219 B5R0.2 SCCCCS Amb8513069 [2,0,0,0,0,0|1,1,0]=4 4220 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|1,0,1]=4 4221 B5R0.2 [C-]#[N+]CCOC Amb1981032 [2,0,0,0,0,0|1,0,1]=4 4222 B7R0.3 C#CC(Br)CCCC Amb27483407 [1,1,0,0,0,0|1,0,1]=4 4223 B7R0.3 C#CC(C)CCCC Amb33169085 [1,1,0,0,0,0|1,0,1]=4 4224 B7R0.3 C#CC(C)OCCO Amb26370403 [1,1,0,0,0,0|0,0,2]=4 4225 B7R0.3 C#CC(N)CCCC Amb25798992 [1,1,0,0,0,0|1,0,1]=4 4226 B7R0.3 C#CCCC(C)CC Amb33318457 [1,1,0,0,0,0|1,0,1]=4 4227 B7R0.3 C#CCCC(Cl)CC Amb28138763 [1,1,0,0,0,0|1,0,1]=4 4228 B7R0.3 C#CCCC(O)CC Amb20669410 [1,1,0,0,0,0|1,0,1]=4 4229 B7R0.3 C#CCC[C@@H](N)CO Amb32620217 [1,1,0,0,0,0|0,0,2]=4 4230 B7R0.3 C#CCC[C@H](N)CO Amb27468137 [1,1,0,0,0,0|0,0,2]=4 4231 B7R0.3 C#CCC[C@H](N)CO Amb32620220 [1,1,0,0,0,0|0,0,2]=4 4232 B7R0.3 C#CCOC(C)CO Amb22168840 [1,1,0,0,0,0|0,0,2]=4 4233 B7R0.3 C#C[C@H](C)CCCO Amb28126416 [1,1,0,0,0,0|0,0,2]=4 4234 B7R0.3 C#C[C@H](N)CCCC Amb27797061 [1,1,0,0,0,0|1,0,1]=4 4235 B7R0.3 C=C(CBr)CCCC Amb25249105 [1,1,0,0,0,0|1,0,1]=4 4236 B7R0.3 C=C(CC)CCCBr Amb27491082 [1,1,0,0,0,0|1,0,1]=4 4237 B7R0.3 C=C(CC)CCCC Amb9787281 [1,1,0,0,0,0|1,0,0]=3 4238 B7R0.3 C=C(CC)CCCCl Amb28397002 [1,1,0,0,0,0|1,0,1]=4 4239 B7R0.3 C=C(CC)CCCN Amb27631266 [1,1,0,0,0,0|1,0,1]=4 4240 B7R0.3 C=C(CC)CCCO Amb26032857 [1,1,0,0,0,0|0,0,1]=3 4241 B7R0.3 C=C(CC)CCNC Amb28325353 [1,1,0,0,0,0|2,0,0]=4 4242 B7R0.3 C=C(CC)CSCC Amb28291726 [1,1,0,0,0,0|0,1,1]=4 4243 B7R0.3 C=C(CCl)CCCC Amb25889368 [1,1,0,0,0,0|1,0,1]=4 4244 B7R0.3 C=C(CN)CCCC Amb27630595 [1,1,0,0,0,0|1,0,1]=4 4245 B7R0.3 C=CC(Br)CCCC Amb25758328 [1,1,0,0,0,0|1,0,1]=4 4246 B7R0.3 C=CC(C)CCCC Amb22641469 [1,1,0,0,0,0|1,0,1]=4 4247 B7R0.3 C=CC(C)CCCO Amb22641468 [1,1,0,0,0,0|0,0,2]=4 4248 B7R0.3 C=CC(N)COCC Amb27248147 [1,1,0,0,0,0|0,0,2]=4 4249 B7R0.3 C=CC(O)COCC Amb28316201 [1,1,0,0,0,0|0,0,2]=4 4250 B7R0.3 C=CCCC(C)CC Amb26860723 [1,1,0,0,0,0|1,0,1]=4 4251 B7R0.3 C=CCCC(C)CO Amb27760347 [1,1,0,0,0,0|0,0,2]=4 4252 B7R0.3 C=CCCC(Cl)CC Amb27394730 [1,1,0,0,0,0|1,0,1]=4 4253 B7R0.3 C=CCCC(N)CO Amb33532619 [1,1,0,0,0,0|0,0,2]=4 4254 B7R0.3 C=CCCC(O)CC Amb22052608 [1,1,0,0,0,0|1,0,1]=4 4255 B7R0.3 C=CCCC(O)CO Amb10071251 [1,1,0,0,0,0|0,0,2]=4 4256 B7R0.3 C=CCC[C@@H](O)CO Amb27405919 [1,1,0,0,0,0|0,0,2]=4 4257 B7R0.3 C=CCC[C@H](N)CO Amb27390564 [1,1,0,0,0,0|0,0,2]=4 4258 B7R0.3 C=CCC[C@H](O)CC Amb27946057 [1,1,0,0,0,0|1,0,1]=4 4259 B7R0.3 C=CCO[C@@H](C)CO Amb25228448 [1,1,0,0,0,0|0,0,2]=4 4260 B7R0.3 C=COCC(N)CC Amb27413821 [1,1,0,0,0,0|0,0,2]=4 4261 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [1,1,0,0,0,0|1,0,1]=4 4262 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [1,1,0,0,0,0|1,0,1]=4 4263 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [1,1,0,0,0,0|1,0,1]=4 4264 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [1,1,0,0,0,0|0,0,2]=4 4265 B7R0.3 CC#CCC(N)CC Amb18988280 [1,1,0,0,0,0|1,0,1]=4 4266 B7R0.3 CC#CCC(N)CO Amb26475841 [1,1,0,0,0,0|0,0,2]=4 4267 B7R0.3 CC#CCC(O)CC Amb2721490 [1,1,0,0,0,0|1,0,1]=4 4268 B7R0.3 CC#CC[C@@H](O)CC Amb28292195 [1,1,0,0,0,0|1,0,1]=4 4269 B7R0.3 CC#CC[C@H](N)CO Amb27493024 [1,1,0,0,0,0|0,0,2]=4 4270 B7R0.3 CC#CC[C@H](O)CC Amb27466967 [1,1,0,0,0,0|1,0,1]=4 4271 B7R0.3 CC#CC[C@H](O)CO Amb27805825 [1,1,0,0,0,0|0,0,2]=4 4272 B7R0.3 CC(CCCO)NN Amb24462745 [1,1,0,0,0,0|2,0,0]=4 4273 B7R0.3 CC(CCl)CCCN Amb27472589 [1,1,0,0,0,0|2,0,0]=4 4274 B7R0.3 CC(CCl)CCCO Amb27439284 [1,1,0,0,0,0|1,0,0]=3 4275 B7R0.3 CC(CN)CCCBr Amb28246470 [1,1,0,0,0,0|2,0,0]=4 4276 B7R0.3 CC(CN)CCCO Amb17569906 [1,1,0,0,0,0|1,0,0]=3 4277 B7R0.3 CC(CN)CCCO Amb28934846 [1,1,0,0,0,0|1,0,0]=3 4278 B7R0.3 CC(CN)NCCO Amb24738477 [1,1,0,0,0,0|2,0,0]=4 4279 B7R0.3 CC(CN)OCCO Amb27883131 [1,1,0,0,0,0|1,0,0]=3 4280 B7R0.3 CC(CO)CCC#N Amb28128191 [1,1,0,0,0,0|1,0,1]=4 4281 B7R0.3 CC(CO)CCCN Amb17569904 [1,1,0,0,0,0|1,0,0]=3 4282 B7R0.3 CC(CO)CCCN Amb32686956 [1,1,0,0,0,0|1,0,0]=3 4283 B7R0.3 CC(CO)CCCO Amb25098490 [1,1,0,0,0,0|1,0,0]=3 4284 B7R0.3 CC(CO)NCCN Amb27805491 [1,1,0,0,0,0|2,0,0]=4 4285 B7R0.3 CC(CO)NCCO Amb9360025 [1,1,0,0,0,0|2,0,0]=4 4286 B7R0.3 CC(CO)OCCCl Amb27788349 [1,1,0,0,0,0|1,0,0]=3 4287 B7R0.3 CC(CO)OCCO Amb27594177 [1,1,0,0,0,0|1,0,0]=3 4288 B7R0.3 CC(CO)SCCO Amb27440688 [1,1,0,0,0,0|1,1,0]=4 4289 B7R0.3 CCC#CC(Br)CC Amb27232694 [1,1,0,0,0,0|1,0,1]=4 4290 B7R0.3 CCC#CC(C)CC Amb27860422 [1,1,0,0,0,0|1,0,1]=4 4291 B7R0.3 CCC#CC(O)CC Amb2721491 [1,1,0,0,0,0|1,0,1]=4 4292 B7R0.3 CCC#C[C@H](O)CC Amb28400640 [1,1,0,0,0,0|1,0,1]=4 4293 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|1,0,1]=4 4294 B7R0.3 CCC(=O)CCCCl Amb17593423 [1,1,0,0,0,0|1,0,1]=4 4295 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|1,0,1]=4 4296 B7R0.3 CCC(=O)CCNC Amb27963044 [1,1,0,0,0,0|2,0,0]=4 4297 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|2,0,0]=4 4298 B7R0.3 CCC(=O)NCCO Amb5797470 [1,1,0,0,0,0|1,0,1]=4 4299 B7R0.3 CCC(=O)OCCBr Amb27424669 [1,1,0,0,0,0|1,0,1]=4 4300 B7R0.3 CCC(=O)OCCF Amb27981291 [1,1,0,0,0,0|1,0,1]=4 4301 B7R0.3 CCC(=O)OCCO Amb27217859 [1,1,0,0,0,0|0,0,1]=3 4302 B7R0.3 CCC(=S)NCCO Amb27203312 [1,1,0,0,0,0|1,0,1]=4 4303 B7R0.3 CCC(Br)CCC#N Amb27475650 [1,1,0,0,0,0|1,0,1]=4 4304 B7R0.3 CCC(C)CCC#N Amb26382039 [1,1,0,0,0,0|1,0,1]=4 4305 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,0]=3 4306 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,0]=3 4307 B7R0.3 CCC(C)CCCN Amb17569898 [1,1,0,0,0,0|1,0,0]=3 4308 B7R0.3 CCC(C)CCCO Amb28070020 [1,1,0,0,0,0|0,0,0]=2 4309 B7R0.3 CCC(C)CCCS Amb33318441 [1,1,0,0,0,0|0,1,0]=3 4310 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|2,0,0]=4 4311 B7R0.3 CCC(C)CCNN Amb27852367 [1,1,0,0,0,0|2,0,0]=4 4312 B7R0.3 CCC(C)CCNO Amb27442658 [1,1,0,0,0,0|1,0,0]=3 4313 B7R0.3 CCC(C)CCON Amb33226956 [1,1,0,0,0,0|2,0,0]=4 4314 B7R0.3 CCC(C)COCCl Amb27663126 [1,1,0,0,0,0|1,0,0]=3 4315 B7R0.3 CCC(C)C\C=N\O Amb27843883 [1,1,0,0,0,0|1,0,1]=4 4316 B7R0.3 CCC(C)NCCBr Amb27641912 [1,1,0,0,0,0|2,0,0]=4 4317 B7R0.3 CCC(C)NCCCl Amb17334146 [1,1,0,0,0,0|2,0,0]=4 4318 B7R0.3 CCC(C)NCCN Amb29844468 [1,1,0,0,0,0|2,0,0]=4 4319 B7R0.3 CCC(C)NCCN Amb4016515 [1,1,0,0,0,0|2,0,0]=4 4320 B7R0.3 CCC(C)NCCO Amb6707239 [1,1,0,0,0,0|1,0,0]=3 4321 B7R0.3 CCC(C)OCCN Amb18307952 [1,1,0,0,0,0|1,0,0]=3 4322 B7R0.3 CCC(C)OCCS Amb27228171 [1,1,0,0,0,0|0,1,0]=3 4323 B7R0.3 CCC(C)OCON Amb27947124 [1,1,0,0,0,0|2,0,0]=4 4324 B7R0.3 CCC(C)SCCN Amb6680221 [1,1,0,0,0,0|1,1,0]=4 4325 B7R0.3 CCC(C)SCCS Amb27424484 [1,1,0,0,0,0|0,2,0]=4 4326 B7R0.3 CCC(C)\C=C\CO Amb32954901 [1,1,0,0,0,0|0,0,2]=4 4327 B7R0.3 CCC(Cl)CCC=O Amb27637733 [1,1,0,0,0,0|0,0,2]=4 4328 B7R0.3 CCC(Cl)CCCCl Amb19959959 [1,1,0,0,0,0|1,0,0]=3 4329 B7R0.3 CCC(Cl)CCNC Amb27197718 [1,1,0,0,0,0|2,0,0]=4 4330 B7R0.3 CCC(Cl)CCOC Amb27811831 [1,1,0,0,0,0|2,0,0]=4 4331 B7R0.3 CCC(Cl)OCCCl Amb27803657 [1,1,0,0,0,0|1,0,0]=3 4332 B7R0.3 CCC(N)CCC=O Amb33036216 [1,1,0,0,0,0|0,0,2]=4 4333 B7R0.3 CCC(N)CCCN Amb27392660 [1,1,0,0,0,0|1,0,0]=3 4334 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|0,0,0]=2 4335 B7R0.3 CCC(N)CCNC Amb28048985 [1,1,0,0,0,0|2,0,0]=4 4336 B7R0.3 CCC(N)CCOC Amb19016193 [1,1,0,0,0,0|2,0,0]=4 4337 B7R0.3 CCC(N)CCSC Amb28048993 [1,1,0,0,0,0|2,0,0]=4 4338 B7R0.3 CCC(N)NCCN Amb27438454 [1,1,0,0,0,0|2,0,0]=4 4339 B7R0.3 CCC(O)CCCN Amb18202667 [1,1,0,0,0,0|1,0,0]=3 4340 B7R0.3 CCC(O)CCCN Amb19374975 [1,1,0,0,0,0|1,0,0]=3 4341 B7R0.3 CCC(O)CCCO Amb17593216 [1,1,0,0,0,0|0,0,0]=2 4342 B7R0.3 CCC(O)CCOC Amb22058972 [1,1,0,0,0,0|2,0,0]=4 4343 B7R0.3 CCC(O)CNOC Amb27589244 [1,1,0,0,0,0|2,0,0]=4 4344 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|2,0,0]=4 4345 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|2,0,0]=4 4346 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|1,0,1]=4 4347 B7R0.3 CCCCC(=O)CC Amb4605999 [1,1,0,0,0,0|1,0,0]=3 4348 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|1,0,1]=4 4349 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|1,0,1]=4 4350 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,1]=3 4351 B7R0.3 CCCCC(=O)NC Amb5797766 [1,1,0,0,0,0|2,0,0]=4 4352 B7R0.3 CCCCC(=O)NO Amb6269796 [1,1,0,0,0,0|1,0,1]=4 4353 B7R0.3 CCCCC(=S)NC Amb27838397 [1,1,0,0,0,0|2,0,0]=4 4354 B7R0.3 CCCCC(Br)C=O Amb17594581 [1,1,0,0,0,0|0,0,2]=4 4355 B7R0.3 CCCCC(Br)CBr Amb8517633 [1,1,0,0,0,0|1,0,0]=3 4356 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|1,0,0]=3 4357 B7R0.3 CCCCC(Br)CF Amb28410717 [1,1,0,0,0,0|1,0,0]=3 4358 B7R0.3 CCCCC(C)C#N Amb18641663 [1,1,0,0,0,0|1,0,1]=4 4359 B7R0.3 CCCCC(C)C=O Amb17593191 [1,1,0,0,0,0|0,0,2]=4 4360 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,0]=3 4361 B7R0.3 CCCCC(C)CC Amb10071971 [1,1,0,0,0,0|1,0,0]=3 4362 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,0]=3 4363 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,0]=3 4364 B7R0.3 CCCCC(C)CO Amb17593205 [1,1,0,0,0,0|0,0,0]=2 4365 B7R0.3 CCCCC(C)NC Amb9620956 [1,1,0,0,0,0|2,0,0]=4 4366 B7R0.3 CCCCC(C)ON Amb33428411 [1,1,0,0,0,0|2,0,0]=4 4367 B7R0.3 CCCCC(Cl)C#N Amb26017572 [1,1,0,0,0,0|1,0,1]=4 4368 B7R0.3 CCCCC(Cl)CBr Amb27490970 [1,1,0,0,0,0|1,0,0]=3 4369 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|1,0,0]=3 4370 B7R0.3 CCCCC(Cl)CCl Amb9787250 [1,1,0,0,0,0|1,0,0]=3 4371 B7R0.3 CCCCC(Cl)CN Amb31030967 [1,1,0,0,0,0|1,0,0]=3 4372 B7R0.3 CCCCC(F)C=O Amb27838938 [1,1,0,0,0,0|0,0,2]=4 4373 B7R0.3 CCCCC(F)CBr Amb27758689 [1,1,0,0,0,0|1,0,0]=3 4374 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|1,0,0]=3 4375 B7R0.3 CCCCC(N)C#N Amb18975861 [1,1,0,0,0,0|1,0,1]=4 4376 B7R0.3 CCCCC(N)C=O Amb28422291 [1,1,0,0,0,0|0,0,2]=4 4377 B7R0.3 CCCCC(N)CC Amb33527796 [1,1,0,0,0,0|1,0,0]=3 4378 B7R0.3 CCCCC(N)CC Amb9031866 [1,1,0,0,0,0|1,0,0]=3 4379 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|1,0,0]=3 4380 B7R0.3 CCCCC(N)CO Amb3939373 [1,1,0,0,0,0|0,0,0]=2 4381 B7R0.3 CCCCC(N)CS Amb27961155 [1,1,0,0,0,0|0,1,0]=3 4382 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|1,0,0]=3 4383 B7R0.3 CCCCC(O)CC Amb10844720 [1,1,0,0,0,0|1,0,0]=3 4384 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|1,0,0]=3 4385 B7R0.3 CCCCC(O)CF Amb27807497 [1,1,0,0,0,0|1,0,0]=3 4386 B7R0.3 CCCCC(O)CN Amb8630130 [1,1,0,0,0,0|1,0,0]=3 4387 B7R0.3 CCCCC(O)CO Amb8390318 [1,1,0,0,0,0|0,0,0]=2 4388 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|1,0,0]=3 4389 B7R0.3 CCCCC(S)CN Amb27643759 [1,1,0,0,0,0|1,0,0]=3 4390 B7R0.3 CCCCN(N)CC Amb17593206 [1,1,0,0,0,0|1,0,0]=3 4391 B7R0.3 CCCCN(O)CC Amb27230146 [1,1,0,0,0,0|1,0,0]=3 4392 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,1,0,0,0,0|0,0,0]=2 4393 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [1,1,0,0,0,0|1,0,0]=3 4394 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,1,0,0,0,0|0,0,0]=2 4395 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,1,0,0,0,0|0,0,0]=2 4396 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [1,1,0,0,0,0|1,0,0]=3 4397 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,1,0,0,0,0|0,0,0]=2 4398 B7R0.3 CCCC[C@@H](O)C#N Amb27798698 [1,1,0,0,0,0|1,0,1]=4 4399 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,1,0,0,0,0|1,0,0]=3 4400 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [1,1,0,0,0,0|0,0,2]=4 4401 B7R0.3 CCCC[C@H](C)CN Amb25889982 [1,1,0,0,0,0|1,0,0]=3 4402 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,1,0,0,0,0|0,0,0]=2 4403 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,1,0,0,0,0|0,0,0]=2 4404 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,1,0,0,0,0|0,0,0]=2 4405 B7R0.3 CCCC[C@H](O)CF Amb27656199 [1,1,0,0,0,0|1,0,0]=3 4406 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,1,0,0,0,0|1,0,0]=3 4407 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,1,0,0,0,0|0,0,0]=2 4408 B7R0.3 CCCC\C(Cl)=N\O Amb28397410 [1,1,0,0,0,0|1,0,1]=4 4409 B7R0.3 CCCC\C(N)=N/O Amb2696577 [1,1,0,0,0,0|1,0,1]=4 4410 B7R0.3 CCCC\C(N)=N\O Amb8391665 [1,1,0,0,0,0|1,0,1]=4 4411 B7R0.3 CCCNC(=O)CC Amb5797516 [1,1,0,0,0,0|2,0,0]=4 4412 B7R0.3 CCCNC(=O)CO Amb5798169 [1,1,0,0,0,0|1,0,1]=4 4413 B7R0.3 CCCNC(C)CC Amb3939844 [1,1,0,0,0,0|2,0,0]=4 4414 B7R0.3 CCCNC(C)CO Amb9359690 [1,1,0,0,0,0|1,0,0]=3 4415 B7R0.3 CCCOC(=O)CCl Amb9787444 [1,1,0,0,0,0|1,0,1]=4 4416 B7R0.3 CCCOC(=O)CN Amb9826861 [1,1,0,0,0,0|1,0,1]=4 4417 B7R0.3 CCCOC(=O)CO Amb25964379 [1,1,0,0,0,0|0,0,1]=3 4418 B7R0.3 CCCOC(C)CC Amb27250865 [1,1,0,0,0,0|1,0,0]=3 4419 B7R0.3 CCCOC(C)CN Amb10608199 [1,1,0,0,0,0|1,0,0]=3 4420 B7R0.3 CCCOC(C)CN Amb21956046 [1,1,0,0,0,0|1,0,0]=3 4421 B7R0.3 CCCOC(C)CO Amb26370350 [1,1,0,0,0,0|0,0,0]=2 4422 B7R0.3 CCCOS(=O)CCl Amb27391160 [1,1,0,0,0,0|2,0,0]=4 4423 B7R0.3 CCCSC(=O)CC Amb25882938 [1,1,0,0,0,0|2,0,0]=4 4424 B7R0.3 CCCSC(C)CC Amb4017932 [1,1,0,0,0,0|1,1,0]=4 4425 B7R0.3 CCCSC(C)CCl Amb27817405 [1,1,0,0,0,0|1,1,0]=4 4426 B7R0.3 CCCSC(C)CN Amb17485962 [1,1,0,0,0,0|1,1,0]=4 4427 B7R0.3 CCCSC(C)CO Amb27593226 [1,1,0,0,0,0|0,1,0]=3 4428 B7R0.3 CCC\C=C(/C)CC Amb25260956 [1,1,0,0,0,0|1,0,1]=4 4429 B7R0.3 CCN(C)CCCCl Amb10608259 [1,1,0,0,0,0|2,0,0]=4 4430 B7R0.3 CCN(C)CCCCl Amb22587199 [1,1,0,0,0,0|2,0,0]=4 4431 B7R0.3 CCN(C)CCCF Amb27837917 [1,1,0,0,0,0|2,0,0]=4 4432 B7R0.3 CCN(C)CCCN Amb6670583 [1,1,0,0,0,0|2,0,0]=4 4433 B7R0.3 CCN(C)CCCO Amb8428182 [1,1,0,0,0,0|1,0,0]=3 4434 B7R0.3 CCN(C)CCNC Amb8890909 [1,1,0,0,0,0|2,0,0]=4 4435 B7R0.3 CCN(O)CCCN Amb27839388 [1,1,0,0,0,0|2,0,0]=4 4436 B7R0.3 CCNCC(C)CC Amb20623802 [1,1,0,0,0,0|1,0,0]=3 4437 B7R0.3 CCNCC(C)CC Amb6719189 [1,1,0,0,0,0|1,0,0]=3 4438 B7R0.3 CCNCC(C)CCl Amb28254657 [1,1,0,0,0,0|2,0,0]=4 4439 B7R0.3 CCNCC(C)CN Amb18314895 [1,1,0,0,0,0|2,0,0]=4 4440 B7R0.3 CCNCC(C)OC Amb19025030 [1,1,0,0,0,0|2,0,0]=4 4441 B7R0.3 CCNCC(C)SC Amb19025520 [1,1,0,0,0,0|2,0,0]=4 4442 B7R0.3 CCNCC(Cl)CC Amb28049008 [1,1,0,0,0,0|1,0,0]=3 4443 B7R0.3 CCNCC(N)CC Amb18304998 [1,1,0,0,0,0|1,0,0]=3 4444 B7R0.3 CCNCC(O)CC Amb9870468 [1,1,0,0,0,0|1,0,0]=3 4445 B7R0.3 CCNCC(O)CCl Amb18124503 [1,1,0,0,0,0|2,0,0]=4 4446 B7R0.3 CCNCC(O)CF Amb26895337 [1,1,0,0,0,0|2,0,0]=4 4447 B7R0.3 CCNCC(O)CN Amb18062380 [1,1,0,0,0,0|2,0,0]=4 4448 B7R0.3 CCNCC(O)CO Amb8856483 [1,1,0,0,0,0|1,0,0]=3 4449 B7R0.3 CCNC[C@@H](N)CC Amb27588708 [1,1,0,0,0,0|1,0,0]=3 4450 B7R0.3 CCNC[C@@H](O)CC Amb28129052 [1,1,0,0,0,0|1,0,0]=3 4451 B7R0.3 CCNC[C@H](C)NC Amb28049316 [1,1,0,0,0,0|2,0,0]=4 4452 B7R0.3 CCNC[C@H](O)CC Amb26984963 [1,1,0,0,0,0|1,0,0]=3 4453 B7R0.3 CCNC[C@H](O)CO Amb27830790 [1,1,0,0,0,0|1,0,0]=3 4454 B7R0.3 CCOCC(=O)CC Amb27406475 [1,1,0,0,0,0|0,0,1]=3 4455 B7R0.3 CCOCC(=O)CCl Amb25087764 [1,1,0,0,0,0|1,0,1]=4 4456 B7R0.3 CCOCC(=O)CF Amb28316133 [1,1,0,0,0,0|1,0,1]=4 4457 B7R0.3 CCOCC(=O)CN Amb27453616 [1,1,0,0,0,0|1,0,1]=4 4458 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,1]=4 4459 B7R0.3 CCOCC(=O)OC Amb7753022 [1,1,0,0,0,0|1,0,1]=4 4460 B7R0.3 CCOCC(Br)CF Amb32863276 [1,1,0,0,0,0|1,0,0]=3 4461 B7R0.3 CCOCC(Br)CO Amb27791752 [1,1,0,0,0,0|1,0,0]=3 4462 B7R0.3 CCOCC(C)C#N Amb9028552 [1,1,0,0,0,0|1,0,1]=4 4463 B7R0.3 CCOCC(C)CBr Amb26847509 [1,1,0,0,0,0|1,0,0]=3 4464 B7R0.3 CCOCC(C)CCl Amb26887689 [1,1,0,0,0,0|1,0,0]=3 4465 B7R0.3 CCOCC(C)CN Amb8868817 [1,1,0,0,0,0|1,0,0]=3 4466 B7R0.3 CCOCC(C)CO Amb25823989 [1,1,0,0,0,0|1,0,0]=3 4467 B7R0.3 CCOCC(Cl)CCl Amb27644856 [1,1,0,0,0,0|1,0,0]=3 4468 B7R0.3 CCOCC(Cl)CO Amb27974227 [1,1,0,0,0,0|1,0,0]=3 4469 B7R0.3 CCOCC(Cl)OC Amb26366295 [1,1,0,0,0,0|1,0,0]=3 4470 B7R0.3 CCOCC(N)CC Amb17485991 [1,1,0,0,0,0|0,0,0]=2 4471 B7R0.3 CCOCC(N)CO Amb25890491 [1,1,0,0,0,0|1,0,0]=3 4472 B7R0.3 CCOCC(N)CO Amb32666301 [1,1,0,0,0,0|1,0,0]=3 4473 B7R0.3 CCOCC(O)C#N Amb27472427 [1,1,0,0,0,0|1,0,1]=4 4474 B7R0.3 CCOCC(O)C=O Amb27883256 [1,1,0,0,0,0|1,0,1]=4 4475 B7R0.3 CCOCC(O)CF Amb28321363 [1,1,0,0,0,0|1,0,0]=3 4476 B7R0.3 CCOCC(O)CN Amb31202384 [1,1,0,0,0,0|1,0,0]=3 4477 B7R0.3 CCOCC(O)CN Amb9707991 [1,1,0,0,0,0|1,0,0]=3 4478 B7R0.3 CCOCC(O)CO Amb19148881 [1,1,0,0,0,0|1,0,0]=3 4479 B7R0.3 CCOCC(S)CN Amb32788187 [1,1,0,0,0,0|1,0,0]=3 4480 B7R0.3 CCOC[C@@H](C)CN Amb33748152 [1,1,0,0,0,0|1,0,0]=3 4481 B7R0.3 CCOC[C@@H](C)CO Amb33735552 [1,1,0,0,0,0|1,0,0]=3 4482 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [1,1,0,0,0,0|1,0,0]=3 4483 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [1,1,0,0,0,0|1,0,0]=3 4484 B7R0.3 CCOC[C@H](C)CN Amb33747417 [1,1,0,0,0,0|1,0,0]=3 4485 B7R0.3 CCOC[C@H](C)CO Amb25999202 [1,1,0,0,0,0|1,0,0]=3 4486 B7R0.3 CCOC[C@H](N)CC Amb28400800 [1,1,0,0,0,0|0,0,0]=2 4487 B7R0.3 CCOC[C@H](O)CN Amb27457943 [1,1,0,0,0,0|1,0,0]=3 4488 B7R0.3 CCONC(C)CN Amb27947132 [1,1,0,0,0,0|2,0,0]=4 4489 B7R0.3 CCS(=O)CCCCl Amb27188737 [1,1,0,0,0,0|1,1,0]=4 4490 B7R0.3 CCS(=O)CCCN Amb18306016 [1,1,0,0,0,0|1,1,0]=4 4491 B7R0.3 CCS(=O)CCNC Amb21984659 [1,1,0,0,0,0|1,1,0]=4 4492 B7R0.3 CCS(=O)CCOC Amb27838120 [1,1,0,0,0,0|1,1,0]=4 4493 B7R0.3 CCS(=O)NCCO Amb28437123 [1,1,0,0,0,0|2,0,0]=4 4494 B7R0.3 CCSCC(C)CBr Amb26852087 [1,1,0,0,0,0|1,1,0]=4 4495 B7R0.3 CCSCC(C)CC Amb27395876 [1,1,0,0,0,0|0,1,0]=3 4496 B7R0.3 CCSCC(C)CCl Amb27469104 [1,1,0,0,0,0|1,1,0]=4 4497 B7R0.3 CCSCC(C)CN Amb9391465 [1,1,0,0,0,0|1,1,0]=4 4498 B7R0.3 CCSCC(C)NC Amb19149257 [1,1,0,0,0,0|1,1,0]=4 4499 B7R0.3 CCSCC(F)CN Amb33324013 [1,1,0,0,0,0|1,1,0]=4 4500 B7R0.3 CCSCC(N)CC Amb17485958 [1,1,0,0,0,0|0,1,0]=3 4501 B7R0.3 CCSCC(N)CO Amb18643038 [1,1,0,0,0,0|1,0,0]=3 4502 B7R0.3 CCSCC(O)CBr Amb26957421 [1,1,0,0,0,0|1,1,0]=4 4503 B7R0.3 CCSCC(O)CC Amb27827536 [1,1,0,0,0,0|0,1,0]=3 4504 B7R0.3 CCSCC(O)CCl Amb17593873 [1,1,0,0,0,0|1,1,0]=4 4505 B7R0.3 CCSCC(O)CF Amb28062913 [1,1,0,0,0,0|1,1,0]=4 4506 B7R0.3 CCSCC(O)CN Amb6680865 [1,1,0,0,0,0|1,1,0]=4 4507 B7R0.3 CCSCC(O)CO Amb4019001 [1,1,0,0,0,0|1,0,0]=3 4508 B7R0.3 CCSCS(=O)CC Amb4014439 [1,1,0,0,0,0|1,1,0]=4 4509 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [1,1,0,0,0,0|1,0,0]=3 4510 B7R0.3 CCSC[C@@H](O)CN Amb26370394 [1,1,0,0,0,0|1,1,0]=4 4511 B7R0.3 CCSC[C@H](N)CC Amb27987520 [1,1,0,0,0,0|0,1,0]=3 4512 B7R0.3 CCSC[C@H](N)CO Amb26564857 [1,1,0,0,0,0|1,0,0]=3 4513 B7R0.3 CCSC[C@H](O)CN Amb27213896 [1,1,0,0,0,0|1,1,0]=4 4514 B7R0.3 CCSSC(C)CC Amb28284462 [1,1,0,0,0,0|1,1,0]=4 4515 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,1,0,0,0,0|0,0,2]=4 4516 B7R0.3 CC[C@@H](C)CCCCl Amb27166913 [1,1,0,0,0,0|1,0,0]=3 4517 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,0]=2 4518 B7R0.3 CC[C@@H](O)CCC#N Amb28455273 [1,1,0,0,0,0|1,0,1]=4 4519 B7R0.3 CC[C@@H](O)CNOC Amb27458289 [1,1,0,0,0,0|2,0,0]=4 4520 B7R0.3 CC[C@H](C)CCCBr Amb27619630 [1,1,0,0,0,0|1,0,0]=3 4521 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,0]=2 4522 B7R0.3 CC[C@H](N)CCOC Amb28123823 [1,1,0,0,0,0|2,0,0]=4 4523 B7R0.3 CC[C@H](O)C#CCO Amb27641896 [1,1,0,0,0,0|0,0,2]=4 4524 B7R0.3 CC[PH](=O)OCCO Amb27456713 [1,1,0,0,0,0|1,0,0]=3 4525 B7R0.3 CC\C(Br)=C\CCO Amb28453501 [1,1,0,0,0,0|0,0,2]=4 4526 B7R0.3 CC\C(C)=C/CCO Amb25264354 [1,1,0,0,0,0|0,0,2]=4 4527 B7R0.3 CC\C(C)=C\CCO Amb28388883 [1,1,0,0,0,0|0,0,2]=4 4528 B7R0.3 CC\C=C\C(C)CC Amb26433198 [1,1,0,0,0,0|1,0,1]=4 4529 B7R0.3 CC\C=C\C(N)CO Amb33268713 [1,1,0,0,0,0|0,0,2]=4 4530 B7R0.3 CC\C=C\C(O)CC Amb27619562 [1,1,0,0,0,0|1,0,1]=4 4531 B7R0.3 CC\C=C\C(O)CO Amb32953425 [1,1,0,0,0,0|0,0,2]=4 4532 B7R0.3 CC\C=C\[C@@H](C)CO Amb28366044 [1,1,0,0,0,0|0,0,2]=4 4533 B7R0.3 CC\C=C\[C@@H](N)CO Amb33268251 [1,1,0,0,0,0|0,0,2]=4 4534 B7R0.3 CC\C=C\[C@@H](O)CC Amb28188274 [1,1,0,0,0,0|1,0,1]=4 4535 B7R0.3 CC\C=C\[C@H](N)CO Amb33268252 [1,1,0,0,0,0|0,0,2]=4 4536 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|1,0,1]=4 4537 B7R0.3 CNC(=O)OCCO Amb3939460 [1,1,0,0,0,0|1,0,1]=4 4538 B7R0.3 CNC(C)CCCO Amb17569902 [1,1,0,0,0,0|1,0,0]=3 4539 B7R0.3 CNCCC(C)CN Amb17334066 [1,1,0,0,0,0|2,0,0]=4 4540 B7R0.3 CNCCC(C)CO Amb17569900 [1,1,0,0,0,0|1,0,0]=3 4541 B7R0.3 CNCCC(O)CN Amb27881647 [1,1,0,0,0,0|2,0,0]=4 4542 B7R0.3 COC(C)CCCBr Amb27198618 [1,1,0,0,0,0|2,0,0]=4 4543 B7R0.3 COC(C)CCCCl Amb28397922 [1,1,0,0,0,0|2,0,0]=4 4544 B7R0.3 COC(C)CCCN Amb17569913 [1,1,0,0,0,0|2,0,0]=4 4545 B7R0.3 COCCC(C)CBr Amb27210700 [1,1,0,0,0,0|2,0,0]=4 4546 B7R0.3 COCCC(C)CCl Amb26887699 [1,1,0,0,0,0|2,0,0]=4 4547 B7R0.3 COCCC(C)CN Amb17569915 [1,1,0,0,0,0|2,0,0]=4 4548 B7R0.3 COCCC(Cl)CCl Amb28314216 [1,1,0,0,0,0|2,0,0]=4 4549 B7R0.3 COCCC(F)CN Amb33377810 [1,1,0,0,0,0|2,0,0]=4 4550 B7R0.3 COCCC(N)CN Amb19023234 [1,1,0,0,0,0|2,0,0]=4 4551 B7R0.3 COCCC(N)CN Amb33309583 [1,1,0,0,0,0|2,0,0]=4 4552 B7R0.3 COCCC(N)CO Amb32952892 [1,1,0,0,0,0|1,0,0]=3 4553 B7R0.3 COCCC(N)CO Amb33532817 [1,1,0,0,0,0|1,0,0]=3 4554 B7R0.3 COCCC(O)CBr Amb33227254 [1,1,0,0,0,0|2,0,0]=4 4555 B7R0.3 COCCC(O)CCl Amb27457414 [1,1,0,0,0,0|2,0,0]=4 4556 B7R0.3 COCCC(O)CF Amb33377484 [1,1,0,0,0,0|2,0,0]=4 4557 B7R0.3 COCCC(O)CN Amb27966623 [1,1,0,0,0,0|2,0,0]=4 4558 B7R0.3 COCCC(O)CO Amb28128880 [1,1,0,0,0,0|1,0,0]=3 4559 B7R0.3 COCC[C@@H](N)CO Amb33377807 [1,1,0,0,0,0|1,0,0]=3 4560 B7R0.3 COCC[C@@H](O)CN Amb33377809 [1,1,0,0,0,0|2,0,0]=4 4561 B7R0.3 COCC[C@H](N)CO Amb25937729 [1,1,0,0,0,0|1,0,0]=3 4562 B7R0.3 COCC[C@H](O)CN Amb33377791 [1,1,0,0,0,0|2,0,0]=4 4563 B7R0.3 COCOC(C)CN Amb27848774 [1,1,0,0,0,0|2,0,0]=4 4564 B7R0.3 COCO[C@@H](C)CO Amb22169783 [1,1,0,0,0,0|1,0,0]=3 4565 B7R0.3 COCO[C@H](C)CO Amb8386157 [1,1,0,0,0,0|1,0,0]=3 4566 B7R0.3 COCSC(C)CO Amb28284985 [1,1,0,0,0,0|1,1,0]=4 4567 B7R0.3 CON(C)CCCO Amb26370515 [1,1,0,0,0,0|2,0,0]=4 4568 B7R0.3 COS(=O)OCCO Amb27835054 [1,1,0,0,0,0|2,0,0]=4 4569 B7R0.3 CSCCC(C)CBr Amb26508349 [1,1,0,0,0,0|2,0,0]=4 4570 B7R0.3 CSCCC(C)CCl Amb27870601 [1,1,0,0,0,0|2,0,0]=4 4571 B7R0.3 CSCCC(C)CN Amb28291178 [1,1,0,0,0,0|2,0,0]=4 4572 B7R0.3 CSCCC(F)CN Amb33198736 [1,1,0,0,0,0|2,0,0]=4 4573 B7R0.3 CSCCC(N)CN Amb19003937 [1,1,0,0,0,0|2,0,0]=4 4574 B7R0.3 CSCCC(N)CN Amb33291358 [1,1,0,0,0,0|2,0,0]=4 4575 B7R0.3 CSCCC(N)CO Amb4036829 [1,1,0,0,0,0|1,0,0]=3 4576 B7R0.3 CSCCC(O)CBr Amb25824128 [1,1,0,0,0,0|2,0,0]=4 4577 B7R0.3 CSCCC(O)CCl Amb25067893 [1,1,0,0,0,0|2,0,0]=4 4578 B7R0.3 CSCCC(O)CF Amb33198282 [1,1,0,0,0,0|2,0,0]=4 4579 B7R0.3 CSCCC(O)CN Amb25785761 [1,1,0,0,0,0|2,0,0]=4 4580 B7R0.3 CSCCC(O)CO Amb26019209 [1,1,0,0,0,0|1,0,0]=3 4581 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [1,1,0,0,0,0|1,0,0]=3 4582 B7R0.3 CSCC[C@@H](O)CN Amb26515632 [1,1,0,0,0,0|2,0,0]=4 4583 B7R0.3 CSCC[C@H](N)CN Amb26023438 [1,1,0,0,0,0|2,0,0]=4 4584 B7R0.3 CSCC[C@H](N)CO Amb2720562 [1,1,0,0,0,0|1,0,0]=3 4585 B7R0.3 CSCC[C@H](O)CN Amb33198735 [1,1,0,0,0,0|2,0,0]=4 4586 B7R0.3 CSSCC(C)CO Amb27166642 [1,1,0,0,0,0|2,0,0]=4 4587 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [1,1,0,0,0,0|1,0,0]=3 4588 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [1,1,0,0,0,0|1,0,0]=3 4589 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [1,1,0,0,0,0|1,0,0]=3 4590 B7R0.3 C[C@@H](CO)NCCO Amb27881216 [1,1,0,0,0,0|2,0,0]=4 4591 B7R0.3 C[C@@H](CO)OCCO Amb28461084 [1,1,0,0,0,0|1,0,0]=3 4592 B7R0.3 C[C@H](CN)NCCO Amb28049033 [1,1,0,0,0,0|2,0,0]=4 4593 B7R0.3 C[C@H](CO)NCCO Amb27173258 [1,1,0,0,0,0|2,0,0]=4 4594 B7R0.3 C\C=C(/C)CCCC Amb22229367 [1,1,0,0,0,0|1,0,1]=4 4595 B7R0.3 C\C=C/CC(Cl)CC Amb27760501 [1,1,0,0,0,0|1,0,1]=4 4596 B7R0.3 C\C=C\CC(N)CO Amb24625761 [1,1,0,0,0,0|0,0,2]=4 4597 B7R0.3 C\C=C\CC(N)CO Amb30585118 [1,1,0,0,0,0|0,0,2]=4 4598 B7R0.3 C\C=C\CC(O)CO Amb27761815 [1,1,0,0,0,0|0,0,2]=4 4599 B7R0.3 C\C=C\C[C@@H](C)CO Amb27650152 [1,1,0,0,0,0|0,0,2]=4 4600 B7R0.3 C\C=C\C[C@@H](O)CO Amb27981099 [1,1,0,0,0,0|0,0,2]=4 4601 B7R0.3 C\C=C\C[C@H](O)CO Amb27452087 [1,1,0,0,0,0|0,0,2]=4 4602 B7R0.3 ClCOCC(Br)CBr Amb32671519 [1,1,0,0,0,0|2,0,0]=4 4603 B7R0.3 NC(CO)CCCF Amb28069002 [1,1,0,0,0,0|1,0,0]=3 4604 B7R0.3 NC(CO)CCCO Amb18641979 [1,1,0,0,0,0|1,0,0]=3 4605 B7R0.3 NCC(N)CCCCl Amb28421823 [1,1,0,0,0,0|2,0,0]=4 4606 B7R0.3 NCC(O)CCCF Amb33196094 [1,1,0,0,0,0|2,0,0]=4 4607 B7R0.3 NCC(O)OCCO Amb28341718 [1,1,0,0,0,0|1,0,0]=3 4608 B7R0.3 NCCCC(N)CF Amb28410605 [1,1,0,0,0,0|2,0,0]=4 4609 B7R0.3 NCCCC(N)CN Amb26640553 [1,1,0,0,0,0|2,0,0]=4 4610 B7R0.3 NCCCC(N)CO Amb27665423 [1,1,0,0,0,0|1,0,0]=3 4611 B7R0.3 NCCCC(O)CO Amb27759884 [1,1,0,0,0,0|1,0,0]=3 4612 B7R0.3 NC[C@H](O)CCCO Amb27632965 [1,1,0,0,0,0|1,0,0]=3 4613 B7R0.3 NOCC[C@H](N)CO Amb27430113 [1,1,0,0,0,0|2,0,0]=4 4614 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [1,1,0,0,0,0|1,0,0]=3 4615 B7R0.3 N[C@H](CO)CCCO Amb24117047 [1,1,0,0,0,0|1,0,0]=3 4616 B7R0.3 N[C@H](CS)CCCS Amb27836721 [1,1,0,0,0,0|1,1,0]=4 4617 B7R0.3 O=C(CO)CCCO Amb27227084 [1,1,0,0,0,0|1,0,1]=4 4618 B7R0.3 O=C(CO)OCCF Amb28049311 [1,1,0,0,0,0|1,0,1]=4 4619 B7R0.3 O=C(CS)OCCO Amb26476359 [1,1,0,0,0,0|1,0,1]=4 4620 B7R0.3 O=CC(Cl)CCCO Amb27831369 [1,1,0,0,0,0|1,0,1]=4 4621 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [1,1,0,0,0,0|1,0,1]=4 4622 B7R0.3 OC(CBr)CCCBr Amb27268592 [1,1,0,0,0,0|2,0,0]=4 4623 B7R0.3 OC(CCl)CCCCl Amb26019455 [1,1,0,0,0,0|2,0,0]=4 4624 B7R0.3 OCC(O)CCCCl Amb17593523 [1,1,0,0,0,0|1,0,0]=3 4625 B7R0.3 OCCCC(Cl)CCl Amb27203325 [1,1,0,0,0,0|1,0,0]=3 4626 B7R0.3 OCCCC(O)CO Amb17593225 [1,1,0,0,0,0|1,0,0]=3 4627 B7R0.3 OCCCC(S)CS Amb27185627 [1,1,0,0,0,0|1,0,0]=3 4628 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [1,1,0,0,0,0|1,0,0]=3 4629 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [1,1,0,0,0,0|1,0,0]=3 4630 B7R0.3 OCOCC(O)CO Amb27181053 [1,1,0,0,0,0|1,0,0]=3 4631 B7R0.3 OC[C@@H](O)CCCCl Amb27235461 [1,1,0,0,0,0|1,0,0]=3 4632 B7R0.3 [C-]#[N+]C(C)CCCC Amb3973080 [1,1,0,0,0,0|2,0,0]=4 4633 B7R0.3 [C-]#[N+]CCC(C)CC Amb33373874 [1,1,0,0,0,0|2,0,0]=4 4634 B7R0.3 [NH3+]CCCC(F)C[NH3+] Amb24117175 [1,1,0,0,0,0|2,0,0]=4 4635 B7R0.4 C#CCCCC(C)C Amb18635315 [1,1,0,0,0,0|1,0,1]=4 4636 B7R0.4 C#CCCCC(C)O Amb24360348 [1,1,0,0,0,0|0,0,2]=4 4637 B7R0.4 C#CCCC[C@@H](C)O Amb26936874 [1,1,0,0,0,0|0,0,2]=4 4638 B7R0.4 C#CCCC[C@H](C)O Amb27809722 [1,1,0,0,0,0|0,0,2]=4 4639 B7R0.4 C#CCCOC(C)C Amb33473566 [1,1,0,0,0,0|0,0,2]=4 4640 B7R0.4 C#CCOCC(C)N Amb35735351 [1,1,0,0,0,0|1,0,1]=4 4641 B7R0.4 C#CCOCC(C)O Amb27829561 [1,1,0,0,0,0|0,0,2]=4 4642 B7R0.4 C=C(Br)COCCO Amb28453509 [1,1,0,0,0,0|0,0,2]=4 4643 B7R0.4 C=C(C)CCCCC Amb6298938 [1,1,0,0,0,0|1,0,1]=4 4644 B7R0.4 C=C(C)CCCCO Amb26872404 [1,1,0,0,0,0|0,0,1]=3 4645 B7R0.4 C=C(C)CCOCCl Amb28366369 [1,1,0,0,0,0|1,0,1]=4 4646 B7R0.4 C=C(C)CNOCC Amb27254563 [1,1,0,0,0,0|1,0,1]=4 4647 B7R0.4 C=C(C)COCCN Amb19020764 [1,1,0,0,0,0|1,0,1]=4 4648 B7R0.4 C=C(C)COCCN Amb20631068 [1,1,0,0,0,0|1,0,1]=4 4649 B7R0.4 C=C(C)COCCO Amb27452088 [1,1,0,0,0,0|0,0,1]=3 4650 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|0,0,2]=4 4651 B7R0.4 C=CCCCC(C)C Amb25127926 [1,1,0,0,0,0|1,0,1]=4 4652 B7R0.4 C=CCCCC(C)N Amb25880150 [1,1,0,0,0,0|1,0,1]=4 4653 B7R0.4 C=CCCCC(C)O Amb22059432 [1,1,0,0,0,0|0,0,2]=4 4654 B7R0.4 C=CCCOC(C)C Amb28184344 [1,1,0,0,0,0|0,0,2]=4 4655 B7R0.4 C=CCOCC(C)O Amb22733640 [1,1,0,0,0,0|0,0,2]=4 4656 B7R0.4 C=CCOC[C@@H](C)O Amb27780603 [1,1,0,0,0,0|0,0,2]=4 4657 B7R0.4 C=COCCC(C)Br Amb28343139 [1,1,0,0,0,0|0,0,2]=4 4658 B7R0.4 CC#CCCC(C)C Amb22052677 [1,1,0,0,0,0|1,0,1]=4 4659 B7R0.4 CC#CCCC(C)Cl Amb27978357 [1,1,0,0,0,0|1,0,1]=4 4660 B7R0.4 CC(=N)NCCCO Amb27967298 [1,1,0,0,0,0|1,0,1]=4 4661 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,1,0,0,0,0|1,0,1]=4 4662 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,1,0,0,0,0|1,0,1]=4 4663 B7R0.4 CC(=O)CCCCF Amb27490855 [1,1,0,0,0,0|1,0,1]=4 4664 B7R0.4 CC(=O)CCCCN Amb27401218 [1,1,0,0,0,0|1,0,1]=4 4665 B7R0.4 CC(=O)CCCCO Amb10603864 [1,1,0,0,0,0|0,0,1]=3 4666 B7R0.4 CC(=O)CNOCO Amb27244723 [1,1,0,0,0,0|1,0,1]=4 4667 B7R0.4 CC(=O)COCCCl Amb25346574 [1,1,0,0,0,0|1,0,1]=4 4668 B7R0.4 CC(=O)COCCF Amb27463527 [1,1,0,0,0,0|1,0,1]=4 4669 B7R0.4 CC(=O)COCCO Amb28122841 [1,1,0,0,0,0|0,0,1]=3 4670 B7R0.4 CC(=O)CSCCO Amb4165952 [1,1,0,0,0,0|0,1,1]=4 4671 B7R0.4 CC(=O)NCCCO Amb3429354 [1,1,0,0,0,0|1,0,1]=4 4672 B7R0.4 CC(=O)NOCCO Amb27484242 [1,1,0,0,0,0|1,0,1]=4 4673 B7R0.4 CC(=O)OCCCBr Amb26515737 [1,1,0,0,0,0|1,0,1]=4 4674 B7R0.4 CC(=O)OCCCCl Amb3940269 [1,1,0,0,0,0|1,0,1]=4 4675 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|1,0,1]=4 4676 B7R0.4 CC(=O)OCCCS Amb4018773 [1,1,0,0,0,0|1,0,1]=4 4677 B7R0.4 CC(=S)OCCCO Amb28381661 [1,1,0,0,0,0|1,0,1]=4 4678 B7R0.4 CC(Br)CCCCCl Amb27858670 [1,1,0,0,0,0|1,0,0]=3 4679 B7R0.4 CC(C)=CCCCO Amb26478086 [1,1,0,0,0,0|0,0,2]=4 4680 B7R0.4 CC(C)=COCCO Amb27662198 [1,1,0,0,0,0|0,0,2]=4 4681 B7R0.4 CC(C)=NOCCO Amb8385274 [1,1,0,0,0,0|1,0,1]=4 4682 B7R0.4 CC(C)CC#CCO Amb27780210 [1,1,0,0,0,0|0,0,2]=4 4683 B7R0.4 CC(C)CCCC#N Amb21811944 [1,1,0,0,0,0|1,0,1]=4 4684 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,2]=4 4685 B7R0.4 CC(C)CCCCBr Amb2721514 [1,1,0,0,0,0|1,0,0]=3 4686 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|1,0,0]=3 4687 B7R0.4 CC(C)CCCCN Amb33548422 [1,1,0,0,0,0|1,0,0]=3 4688 B7R0.4 CC(C)CCCCN Amb9304907 [1,1,0,0,0,0|1,0,0]=3 4689 B7R0.4 CC(C)CCCCO Amb3939382 [1,1,0,0,0,0|0,0,0]=2 4690 B7R0.4 CC(C)CCCCS Amb32788388 [1,1,0,0,0,0|0,1,0]=3 4691 B7R0.4 CC(C)CCCON Amb28315398 [1,1,0,0,0,0|2,0,0]=4 4692 B7R0.4 CC(C)CCNCN Amb27194901 [1,1,0,0,0,0|2,0,0]=4 4693 B7R0.4 CC(C)CCNCO Amb27403355 [1,1,0,0,0,0|1,0,0]=3 4694 B7R0.4 CC(C)CCON=O Amb7809245 [1,1,0,0,0,0|1,0,1]=4 4695 B7R0.4 CC(C)CNCCCl Amb17334145 [1,1,0,0,0,0|2,0,0]=4 4696 B7R0.4 CC(C)CNCCI Amb27801831 [1,1,0,0,0,0|2,0,0]=4 4697 B7R0.4 CC(C)CNCCN Amb17091016 [1,1,0,0,0,0|2,0,0]=4 4698 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|1,0,0]=3 4699 B7R0.4 CC(C)CNCCO Amb6707299 [1,1,0,0,0,0|1,0,0]=3 4700 B7R0.4 CC(C)CNCCS Amb24616771 [1,1,0,0,0,0|1,1,0]=4 4701 B7R0.4 CC(C)COCCBr Amb6255231 [1,1,0,0,0,0|1,0,0]=3 4702 B7R0.4 CC(C)COCCN Amb33548979 [1,1,0,0,0,0|1,0,0]=3 4703 B7R0.4 CC(C)COCCN Amb6247554 [1,1,0,0,0,0|1,0,0]=3 4704 B7R0.4 CC(C)COCCO Amb3939640 [1,1,0,0,0,0|0,0,0]=2 4705 B7R0.4 CC(C)COCCS Amb24589392 [1,1,0,0,0,0|0,1,0]=3 4706 B7R0.4 CC(C)CSCCCl Amb9304957 [1,1,0,0,0,0|1,1,0]=4 4707 B7R0.4 CC(C)CSCCN Amb28934790 [1,1,0,0,0,0|1,1,0]=4 4708 B7R0.4 CC(C)CSCCN Amb6274135 [1,1,0,0,0,0|1,1,0]=4 4709 B7R0.4 CC(C)C\C=C\CO Amb25851501 [1,1,0,0,0,0|0,0,2]=4 4710 B7R0.4 CC(C)NCCCF Amb27753882 [1,1,0,0,0,0|2,0,0]=4 4711 B7R0.4 CC(C)NCCCN Amb8515462 [1,1,0,0,0,0|2,0,0]=4 4712 B7R0.4 CC(C)NCCCO Amb22492397 [1,1,0,0,0,0|1,0,0]=3 4713 B7R0.4 CC(C)NCCCO Amb4422880 [1,1,0,0,0,0|1,0,0]=3 4714 B7R0.4 CC(C)OCCC#N Amb4017899 [1,1,0,0,0,0|1,0,1]=4 4715 B7R0.4 CC(C)OCCC=O Amb26443003 [1,1,0,0,0,0|1,0,1]=4 4716 B7R0.4 CC(C)OCCCBr Amb8828214 [1,1,0,0,0,0|1,0,0]=3 4717 B7R0.4 CC(C)OCCCCl Amb6255095 [1,1,0,0,0,0|1,0,0]=3 4718 B7R0.4 CC(C)OCCCN Amb6608864 [1,1,0,0,0,0|1,0,0]=3 4719 B7R0.4 CC(C)OCCCN Amb6892638 [1,1,0,0,0,0|1,0,0]=3 4720 B7R0.4 CC(C)OCCCO Amb10608350 [1,1,0,0,0,0|1,0,0]=3 4721 B7R0.4 CC(C)OCCCS Amb24551906 [1,1,0,0,0,0|1,0,0]=3 4722 B7R0.4 CC(C)OCCNN Amb32712146 [1,1,0,0,0,0|2,0,0]=4 4723 B7R0.4 CC(C)OCCNO Amb33274852 [1,1,0,0,0,0|2,0,0]=4 4724 B7R0.4 CC(C)OCCON Amb25113499 [1,1,0,0,0,0|2,0,0]=4 4725 B7R0.4 CC(C)ONCCO Amb27421126 [1,1,0,0,0,0|2,0,0]=4 4726 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|1,1,0]=4 4727 B7R0.4 CC(C)SCCCN Amb10075505 [1,1,0,0,0,0|1,1,0]=4 4728 B7R0.4 CC(C)SCCCO Amb17502841 [1,1,0,0,0,0|1,0,0]=3 4729 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,2]=4 4730 B7R0.4 CC(Cl)CCCC=O Amb27983674 [1,1,0,0,0,0|0,0,2]=4 4731 B7R0.4 CC(Cl)CNCCCl Amb24442200 [1,1,0,0,0,0|2,0,0]=4 4732 B7R0.4 CC(Cl)CNCCCl Amb32653331 [1,1,0,0,0,0|2,0,0]=4 4733 B7R0.4 CC(F)CCCCCl Amb27596141 [1,1,0,0,0,0|1,0,0]=3 4734 B7R0.4 CC(F)CSCCN Amb27782477 [1,1,0,0,0,0|1,1,0]=4 4735 B7R0.4 CC(N)CCCCBr Amb27814547 [1,1,0,0,0,0|1,0,0]=3 4736 B7R0.4 CC(N)CCCCCl Amb27867737 [1,1,0,0,0,0|1,0,0]=3 4737 B7R0.4 CC(N)CCCCF Amb25954668 [1,1,0,0,0,0|1,0,0]=3 4738 B7R0.4 CC(N)CCCCN Amb25214697 [1,1,0,0,0,0|1,0,0]=3 4739 B7R0.4 CC(N)CCCCN Amb33551364 [1,1,0,0,0,0|1,0,0]=3 4740 B7R0.4 CC(N)CCCCO Amb17569907 [1,1,0,0,0,0|0,0,0]=2 4741 B7R0.4 CC(N)CCCCO Amb28934868 [1,1,0,0,0,0|0,0,0]=2 4742 B7R0.4 CC(N)CNCCN Amb28198270 [1,1,0,0,0,0|2,0,0]=4 4743 B7R0.4 CC(N)COCC#N Amb35735352 [1,1,0,0,0,0|1,0,1]=4 4744 B7R0.4 CC(N)CSCCF Amb27233247 [1,1,0,0,0,0|1,1,0]=4 4745 B7R0.4 CC(O)CCCC=O Amb18641887 [1,1,0,0,0,0|0,0,2]=4 4746 B7R0.4 CC(O)CCCCF Amb27486303 [1,1,0,0,0,0|1,0,0]=3 4747 B7R0.4 CC(O)CCCCN Amb17569903 [1,1,0,0,0,0|1,0,0]=3 4748 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|0,0,0]=2 4749 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [1,1,0,0,0,0|0,1,0]=3 4750 B7R0.4 CC(O)CCOP=O Amb27443310 [1,1,0,0,0,0|1,0,1]=4 4751 B7R0.4 CC(O)CCO[PH2]=O Amb27594830 [1,1,0,0,0,0|1,0,1]=4 4752 B7R0.4 CC(O)CNCCN Amb4034606 [1,1,0,0,0,0|2,0,0]=4 4753 B7R0.4 CC(O)CNCCO Amb4020001 [1,1,0,0,0,0|1,0,0]=3 4754 B7R0.4 CC(O)CNCCS Amb27838396 [1,1,0,0,0,0|1,1,0]=4 4755 B7R0.4 CC(O)COCCCl Amb27410199 [1,1,0,0,0,0|1,0,0]=3 4756 B7R0.4 CC(O)COCCN Amb27404532 [1,1,0,0,0,0|1,0,0]=3 4757 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|0,1,0]=3 4758 B7R0.4 CC(O)CSCCS Amb28074830 [1,1,0,0,0,0|0,2,0]=4 4759 B7R0.4 CC(O)C\C=C\CO Amb27432058 [1,1,0,0,0,0|0,0,2]=4 4760 B7R0.4 CC(O)\C=C\CCO Amb28138579 [1,1,0,0,0,0|0,0,2]=4 4761 B7R0.4 CC(S)CCCCN Amb32788406 [1,1,0,0,0,0|1,0,0]=3 4762 B7R0.4 CC(S)COCCN Amb32788415 [1,1,0,0,0,0|1,0,0]=3 4763 B7R0.4 CCC#CCC(C)C Amb6336495 [1,1,0,0,0,0|1,0,1]=4 4764 B7R0.4 CCC#CCC(C)O Amb22045231 [1,1,0,0,0,0|0,0,2]=4 4765 B7R0.4 CCC#CC[C@@H](C)O Amb27659866 [1,1,0,0,0,0|0,0,2]=4 4766 B7R0.4 CCCC#CC(C)Br Amb28384079 [1,1,0,0,0,0|1,0,1]=4 4767 B7R0.4 CCCC#CC(C)O Amb24273363 [1,1,0,0,0,0|0,0,2]=4 4768 B7R0.4 CCCC#CC(O)O Amb27879620 [1,1,0,0,0,0|0,0,2]=4 4769 B7R0.4 CCCC#C[C@@H](C)O Amb27826359 [1,1,0,0,0,0|0,0,2]=4 4770 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|1,0,1]=4 4771 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,0]=3 4772 B7R0.4 CCCCCC(=N)N Amb19890171 [1,1,0,0,0,0|1,0,1]=4 4773 B7R0.4 CCCCCC(=N)N Amb2696574 [1,1,0,0,0,0|1,0,1]=4 4774 B7R0.4 CCCCCC(=N)N Amb35747068 [1,1,0,0,0,0|1,0,1]=4 4775 B7R0.4 CCCCCC(=O)F Amb26061517 [1,1,0,0,0,0|0,0,2]=4 4776 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|0,0,1]=3 4777 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [1,1,0,0,0,0|0,0,2]=4 4778 B7R0.4 CCCCCC(C)=O Amb6608885 [1,1,0,0,0,0|0,0,2]=4 4779 B7R0.4 CCCCCC(C)Br Amb3940202 [1,1,0,0,0,0|1,0,0]=3 4780 B7R0.4 CCCCCC(C)C Amb8513253 [1,1,0,0,0,0|1,0,0]=3 4781 B7R0.4 CCCCCC(C)Cl Amb22228752 [1,1,0,0,0,0|1,0,0]=3 4782 B7R0.4 CCCCCC(C)N Amb21962698 [1,1,0,0,0,0|1,0,0]=3 4783 B7R0.4 CCCCCC(C)N Amb3939364 [1,1,0,0,0,0|1,0,0]=3 4784 B7R0.4 CCCCCC(C)O Amb8383668 [1,1,0,0,0,0|0,0,0]=2 4785 B7R0.4 CCCCCC(C)S Amb17939452 [1,1,0,0,0,0|0,1,0]=3 4786 B7R0.4 CCCCCC(Cl)Cl Amb27206941 [1,1,0,0,0,0|1,0,0]=3 4787 B7R0.4 CCCCCC(F)Br Amb24641242 [1,1,0,0,0,0|1,0,0]=3 4788 B7R0.4 CCCCCC(N)=S Amb6246072 [1,1,0,0,0,0|0,1,1]=4 4789 B7R0.4 CCCCCC(O)Cl Amb27232933 [1,1,0,0,0,0|0,0,0]=2 4790 B7R0.4 CCCCCC(O)O Amb25921998 [1,1,0,0,0,0|0,0,0]=2 4791 B7R0.4 CCCCCN(C)O Amb33428427 [1,1,0,0,0,0|1,0,0]=3 4792 B7R0.4 CCCCCS(=O)Cl Amb32720370 [1,1,0,0,0,0|1,0,1]=4 4793 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [1,1,0,0,0,0|1,0,1]=4 4794 B7R0.4 CCCCCS(C)=O Amb27457494 [1,1,0,0,0,0|1,0,1]=4 4795 B7R0.4 CCCCCS(N)=O Amb32720371 [1,1,0,0,0,0|1,0,1]=4 4796 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [1,1,0,0,0,0|1,0,0]=3 4797 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|0,0,0]=2 4798 B7R0.4 CCCCC[C@H](C)N Amb8516349 [1,1,0,0,0,0|1,0,0]=3 4799 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,1,0,0,0,0|0,0,0]=2 4800 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [1,1,0,0,0,0|1,0,1]=4 4801 B7R0.4 CCCCNC(C)=N Amb27663050 [1,1,0,0,0,0|1,0,1]=4 4802 B7R0.4 CCCCNC(C)=O Amb5835711 [1,1,0,0,0,0|1,0,1]=4 4803 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|1,0,0]=3 4804 B7R0.4 CCCCNC(C)C Amb6251422 [1,1,0,0,0,0|1,0,0]=3 4805 B7R0.4 CCCCOB(O)O Amb25687500 [1,1,0,0,0,0|1,0,0]=3 4806 B7R0.4 CCCCOC(=O)Cl Amb6608833 [1,1,0,0,0,0|0,0,2]=4 4807 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [1,1,0,0,0,0|0,1,1]=4 4808 B7R0.4 CCCCOC(C)=O Amb6608782 [1,1,0,0,0,0|0,0,1]=3 4809 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,1,0,0,0,0|0,0,0]=2 4810 B7R0.4 CCCCOC(C)O Amb26537694 [1,1,0,0,0,0|0,0,0]=2 4811 B7R0.4 CCCCOC(N)=O Amb4136361 [1,1,0,0,0,0|0,0,2]=4 4812 B7R0.4 CCCCOP(Cl)Cl Amb4297340 [1,1,0,0,0,0|2,0,0]=4 4813 B7R0.4 CCCCO[PH](=O)O Amb26035392 [1,1,0,0,0,0|1,0,0]=3 4814 B7R0.4 CCCCSC(C)C Amb4020661 [1,1,0,0,0,0|0,1,0]=3 4815 B7R0.4 CCCCSC(C)O Amb27191967 [1,1,0,0,0,0|0,1,0]=3 4816 B7R0.4 CCCC\N=[N+](/C)[O-] Amb28135976 [1,1,0,0,0,0|2,0,0]=4 4817 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|1,0,1]=4 4818 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|1,0,1]=4 4819 B7R0.4 CCCNCC(C)C Amb6258024 [1,1,0,0,0,0|2,0,0]=4 4820 B7R0.4 CCCNCC(C)O Amb9359420 [1,1,0,0,0,0|1,0,0]=3 4821 B7R0.4 CCCNCC(C)S Amb18124358 [1,1,0,0,0,0|1,1,0]=4 4822 B7R0.4 CCCNCC(Cl)Cl Amb28064059 [1,1,0,0,0,0|2,0,0]=4 4823 B7R0.4 CCCNCC(F)F Amb13951924 [1,1,0,0,0,0|2,0,0]=4 4824 B7R0.4 CCCNCC(F)F Amb8853727 [1,1,0,0,0,0|2,0,0]=4 4825 B7R0.4 CCCNC[C@@H](C)N Amb27835548 [1,1,0,0,0,0|2,0,0]=4 4826 B7R0.4 CCCNOC(C)C Amb27203616 [1,1,0,0,0,0|1,0,0]=3 4827 B7R0.4 CCCOCB(O)O Amb27461328 [1,1,0,0,0,0|1,0,0]=3 4828 B7R0.4 CCCOCC(=O)Cl Amb27260778 [1,1,0,0,0,0|0,0,2]=4 4829 B7R0.4 CCCOCC(=O)O Amb8874504 [1,1,0,0,0,0|0,0,1]=3 4830 B7R0.4 CCCOCC(N)=O Amb27844884 [1,1,0,0,0,0|0,0,2]=4 4831 B7R0.4 CCCOCC(N)=S Amb8874828 [1,1,0,0,0,0|0,1,1]=4 4832 B7R0.4 CCCOC[C@@H](C)N Amb28048953 [1,1,0,0,0,0|1,0,0]=3 4833 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [1,1,0,0,0,0|0,0,0]=2 4834 B7R0.4 CCCO[SiH2]C(Cl)Cl Amb28244810 [1,1,0,0,0,0|1,1,0]=4 4835 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,1,1]=4 4836 B7R0.4 CCCSCC(C)C Amb4017817 [1,1,0,0,0,0|1,1,0]=4 4837 B7R0.4 CCCSCC(C)O Amb27463818 [1,1,0,0,0,0|0,1,0]=3 4838 B7R0.4 CCCSCC(C)S Amb32788151 [1,1,0,0,0,0|0,2,0]=4 4839 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [1,1,0,0,0,0|0,1,0]=3 4840 B7R0.4 CCCSSC(C)C Amb25952313 [1,1,0,0,0,0|1,1,0]=4 4841 B7R0.4 CCC\C=C\C(C)C Amb4019553 [1,1,0,0,0,0|1,0,1]=4 4842 B7R0.4 CCC\C=C\C(C)N Amb33374704 [1,1,0,0,0,0|1,0,1]=4 4843 B7R0.4 CCC\C=C\C(C)O Amb25083446 [1,1,0,0,0,0|0,0,2]=4 4844 B7R0.4 CCC\C=C\[C@@H](C)N Amb33327161 [1,1,0,0,0,0|1,0,1]=4 4845 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [1,1,0,0,0,0|0,0,2]=4 4846 B7R0.4 CCC\C=C\[C@H](C)N Amb33327160 [1,1,0,0,0,0|1,0,1]=4 4847 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [1,1,0,0,0,0|0,0,2]=4 4848 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|1,0,1]=4 4849 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|1,0,1]=4 4850 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,1]=4 4851 B7R0.4 CCNCCC(C)C Amb6244455 [1,1,0,0,0,0|1,0,0]=3 4852 B7R0.4 CCNCCC(C)O Amb27239293 [1,1,0,0,0,0|1,0,0]=3 4853 B7R0.4 CCNCCN(C)C Amb1128271 [1,1,0,0,0,0|2,0,0]=4 4854 B7R0.4 CCOCCC(=N)N Amb2696677 [1,1,0,0,0,0|1,0,1]=4 4855 B7R0.4 CCOCCC(=N)N Amb33551393 [1,1,0,0,0,0|1,0,1]=4 4856 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,1,0,0,0,0|1,0,1]=4 4857 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|1,0,1]=4 4858 B7R0.4 CCOCCC(C)=O Amb7764636 [1,1,0,0,0,0|0,0,1]=3 4859 B7R0.4 CCOCCC(C)Cl Amb28422675 [1,1,0,0,0,0|0,0,0]=2 4860 B7R0.4 CCOCCC(C)N Amb7772189 [1,1,0,0,0,0|0,0,0]=2 4861 B7R0.4 CCOCCC(C)O Amb27852957 [1,1,0,0,0,0|0,0,0]=2 4862 B7R0.4 CCOCCC(Cl)Cl Amb27984892 [1,1,0,0,0,0|1,0,0]=3 4863 B7R0.4 CCOCCC(N)=S Amb6263797 [1,1,0,0,0,0|1,0,1]=4 4864 B7R0.4 CCOCCS(=O)Cl Amb24625733 [1,1,0,0,0,0|2,0,0]=4 4865 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [1,1,0,0,0,0|2,0,0]=4 4866 B7R0.4 CCOCCS(N)=O Amb32720346 [1,1,0,0,0,0|2,0,0]=4 4867 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,1,0,0,0,0|0,0,0]=2 4868 B7R0.4 CCOCC[C@H](C)O Amb27946039 [1,1,0,0,0,0|0,0,0]=2 4869 B7R0.4 CCO\C=C\C(C)C Amb22261439 [1,1,0,0,0,0|0,0,2]=4 4870 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|1,0,1]=4 4871 B7R0.4 CCSCCC(C)=O Amb9655821 [1,1,0,0,0,0|0,1,1]=4 4872 B7R0.4 CCSCCC(C)Br Amb33435746 [1,1,0,0,0,0|0,1,0]=3 4873 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|0,1,0]=3 4874 B7R0.4 CCSCCC(C)Cl Amb28458510 [1,1,0,0,0,0|0,1,0]=3 4875 B7R0.4 CCSCCC(C)N Amb19149259 [1,1,0,0,0,0|0,1,0]=3 4876 B7R0.4 CCSCCC(C)O Amb28048927 [1,1,0,0,0,0|0,1,0]=3 4877 B7R0.4 CCSCCN(C)C Amb27198418 [1,1,0,0,0,0|1,1,0]=4 4878 B7R0.4 CCSCCN(C)O Amb33324043 [1,1,0,0,0,0|1,1,0]=4 4879 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [1,1,0,0,0,0|0,1,0]=3 4880 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [1,1,0,0,0,0|0,1,0]=3 4881 B7R0.4 CCSCC[C@H](C)N Amb33323728 [1,1,0,0,0,0|0,1,0]=3 4882 B7R0.4 CCSCC[C@H](C)O Amb33323733 [1,1,0,0,0,0|0,1,0]=3 4883 B7R0.4 CC\C=C\CC(C)Br Amb33009075 [1,1,0,0,0,0|1,0,1]=4 4884 B7R0.4 CC\C=C\CC(C)C Amb4016285 [1,1,0,0,0,0|1,0,1]=4 4885 B7R0.4 CC\C=C\CC(C)N Amb25357984 [1,1,0,0,0,0|1,0,1]=4 4886 B7R0.4 CC\C=C\CC(C)O Amb33079090 [1,1,0,0,0,0|0,0,2]=4 4887 B7R0.4 CC\C=C\C[C@@H](C)N Amb33225016 [1,1,0,0,0,0|1,0,1]=4 4888 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [1,1,0,0,0,0|0,0,2]=4 4889 B7R0.4 CC\C=C\C[C@H](C)N Amb33267988 [1,1,0,0,0,0|1,0,1]=4 4890 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [1,1,0,0,0,0|0,0,2]=4 4891 B7R0.4 CN(C)CCCCBr Amb18178257 [1,1,0,0,0,0|2,0,0]=4 4892 B7R0.4 CN(C)CCCCBr Amb19148184 [1,1,0,0,0,0|2,0,0]=4 4893 B7R0.4 CN(C)CCCCCl Amb17334150 [1,1,0,0,0,0|2,0,0]=4 4894 B7R0.4 CN(C)CCCCCl Amb20668164 [1,1,0,0,0,0|2,0,0]=4 4895 B7R0.4 CN(C)CCCCN Amb2687444 [1,1,0,0,0,0|2,0,0]=4 4896 B7R0.4 CN(C)CCCCO Amb9273966 [1,1,0,0,0,0|1,0,0]=3 4897 B7R0.4 CN(C)CCCCS Amb26480331 [1,1,0,0,0,0|1,1,0]=4 4898 B7R0.4 CN(C)CCCNO Amb33272652 [1,1,0,0,0,0|2,0,0]=4 4899 B7R0.4 CN(C)CCOCCl Amb28052737 [1,1,0,0,0,0|2,0,0]=4 4900 B7R0.4 CN(N)CCCCO Amb28133877 [1,1,0,0,0,0|1,0,0]=3 4901 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|1,0,1]=4 4902 B7R0.4 CNCCCC(=O)O Amb4521435 [1,1,0,0,0,0|1,0,1]=4 4903 B7R0.4 CNCCCC(C)C Amb32757651 [1,1,0,0,0,0|2,0,0]=4 4904 B7R0.4 CNCCCC(C)C Amb8853654 [1,1,0,0,0,0|2,0,0]=4 4905 B7R0.4 CNCCCC(C)O Amb17569899 [1,1,0,0,0,0|1,0,0]=3 4906 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [1,1,0,0,0,0|1,0,0]=3 4907 B7R0.4 CNCCOC(C)=O Amb18124262 [1,1,0,0,0,0|1,0,1]=4 4908 B7R0.4 CNCCOC(C)=O Amb33621071 [1,1,0,0,0,0|1,0,1]=4 4909 B7R0.4 CNCCOC(C)C Amb33538267 [1,1,0,0,0,0|1,0,0]=3 4910 B7R0.4 CNCCOC(F)F Amb26591917 [1,1,0,0,0,0|2,0,0]=4 4911 B7R0.4 CNCCSC(C)C Amb19024679 [1,1,0,0,0,0|1,1,0]=4 4912 B7R0.4 COCCCB(O)O Amb27754195 [1,1,0,0,0,0|2,0,0]=4 4913 B7R0.4 COCCCC(=O)O Amb6275629 [1,1,0,0,0,0|1,0,1]=4 4914 B7R0.4 COCCCC(C)Br Amb18185551 [1,1,0,0,0,0|2,0,0]=4 4915 B7R0.4 COCCCC(C)Cl Amb26489622 [1,1,0,0,0,0|2,0,0]=4 4916 B7R0.4 COCCCC(C)N Amb9031757 [1,1,0,0,0,0|2,0,0]=4 4917 B7R0.4 COCCCC(C)O Amb4020863 [1,1,0,0,0,0|1,0,0]=3 4918 B7R0.4 COCCCC(C)S Amb25810805 [1,1,0,0,0,0|1,1,0]=4 4919 B7R0.4 COCCCC(Cl)Cl Amb28396614 [1,1,0,0,0,0|2,0,0]=4 4920 B7R0.4 COCCCN(C)O Amb33377831 [1,1,0,0,0,0|2,0,0]=4 4921 B7R0.4 COCCC[C@@H](C)Cl Amb27590769 [1,1,0,0,0,0|2,0,0]=4 4922 B7R0.4 COCCC[C@@H](C)N Amb24749054 [1,1,0,0,0,0|2,0,0]=4 4923 B7R0.4 COCCC[C@@H](C)O Amb33428680 [1,1,0,0,0,0|1,0,0]=3 4924 B7R0.4 COCCC[C@H](C)N Amb27164382 [1,1,0,0,0,0|2,0,0]=4 4925 B7R0.4 COCCC[C@H](C)O Amb27396064 [1,1,0,0,0,0|1,0,0]=3 4926 B7R0.4 COCCNC(C)C Amb2785295 [1,1,0,0,0,0|2,0,0]=4 4927 B7R0.4 COCCOC(C)=O Amb4037074 [1,1,0,0,0,0|1,0,1]=4 4928 B7R0.4 COCOCC(=O)O Amb28059312 [1,1,0,0,0,0|1,0,1]=4 4929 B7R0.4 CONCCC(C)C Amb20669574 [1,1,0,0,0,0|2,0,0]=4 4930 B7R0.4 CONCCC(C)F Amb28120126 [1,1,0,0,0,0|2,0,0]=4 4931 B7R0.4 CP(O)OCCCCl Amb28254545 [1,1,0,0,0,0|2,0,0]=4 4932 B7R0.4 CS(=O)CCCCBr Amb27874454 [1,1,0,0,0,0|2,0,0]=4 4933 B7R0.4 CS(=O)CCCCCl Amb27253421 [1,1,0,0,0,0|2,0,0]=4 4934 B7R0.4 CS(=O)CCCCN Amb17617794 [1,1,0,0,0,0|2,0,0]=4 4935 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|1,0,1]=4 4936 B7R0.4 CSCCCC(C)Br Amb27798199 [1,1,0,0,0,0|2,0,0]=4 4937 B7R0.4 CSCCCC(C)C Amb28289938 [1,1,0,0,0,0|2,0,0]=4 4938 B7R0.4 CSCCCC(C)N Amb18124381 [1,1,0,0,0,0|2,0,0]=4 4939 B7R0.4 CSCCCC(C)O Amb25958947 [1,1,0,0,0,0|1,0,0]=3 4940 B7R0.4 CSCCCN(C)O Amb33198763 [1,1,0,0,0,0|2,0,0]=4 4941 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [1,1,0,0,0,0|2,0,0]=4 4942 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [1,1,0,0,0,0|1,0,0]=3 4943 B7R0.4 CSCCC[C@H](C)N Amb33200176 [1,1,0,0,0,0|2,0,0]=4 4944 B7R0.4 CSCCC[C@H](C)O Amb33198288 [1,1,0,0,0,0|1,0,0]=3 4945 B7R0.4 CSSCCC(C)N Amb28316247 [1,1,0,0,0,0|1,1,0]=4 4946 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [1,1,0,0,0,0|1,0,0]=3 4947 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [1,1,0,0,0,0|1,0,0]=3 4948 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [1,1,0,0,0,0|1,0,0]=3 4949 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [1,1,0,0,0,0|1,0,0]=3 4950 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,1,0,0,0,0|1,0,0]=3 4951 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [1,1,0,0,0,0|2,0,0]=4 4952 B7R0.4 C[C@H](F)CCCCO Amb27945000 [1,1,0,0,0,0|0,0,0]=2 4953 B7R0.4 C[C@H](N)CCCCF Amb33480694 [1,1,0,0,0,0|1,0,0]=3 4954 B7R0.4 C[C@H](N)CNCCF Amb27449099 [1,1,0,0,0,0|2,0,0]=4 4955 B7R0.4 C[C@H](O)CCCC#N Amb27979195 [1,1,0,0,0,0|1,0,1]=4 4956 B7R0.4 C[C@H](O)CCCCF Amb33196129 [1,1,0,0,0,0|1,0,0]=3 4957 B7R0.4 C[C@H](O)CCCCO Amb28381637 [1,1,0,0,0,0|0,0,0]=2 4958 B7R0.4 C[C@H](O)C\C=C\CO Amb27945050 [1,1,0,0,0,0|0,0,2]=4 4959 B7R0.4 C[SiH](C)OCCCO Amb28065227 [1,1,0,0,0,0|1,1,0]=4 4960 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [1,1,0,0,0,0|0,0,2]=4 4961 B7R0.4 C\C=C\CCC(C)Br Amb25889216 [1,1,0,0,0,0|1,0,1]=4 4962 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,1]=4 4963 B7R0.4 C\C=C\CCC(C)N Amb27838292 [1,1,0,0,0,0|1,0,1]=4 4964 B7R0.4 C\C=C\CCC(C)O Amb32665057 [1,1,0,0,0,0|0,0,2]=4 4965 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [1,1,0,0,0,0|0,0,2]=4 4966 B7R0.4 FC(F)COCCBr Amb26357993 [1,1,0,0,0,0|2,0,0]=4 4967 B7R0.4 FC(F)COCCCl Amb22008152 [1,1,0,0,0,0|2,0,0]=4 4968 B7R0.4 FC(F)COCCS Amb26861649 [1,1,0,0,0,0|1,1,0]=4 4969 B7R0.4 FC(F)OCCCBr Amb33299231 [1,1,0,0,0,0|2,0,0]=4 4970 B7R0.4 NC(=O)CCCCO Amb3939470 [1,1,0,0,0,0|1,0,1]=4 4971 B7R0.4 NCCCCB(O)O Amb27436221 [1,1,0,0,0,0|2,0,0]=4 4972 B7R0.4 NCCCCC(=O)O Amb2780021 [1,1,0,0,0,0|1,0,1]=4 4973 B7R0.4 NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|1,0,1]=4 4974 B7R0.4 NCCCCC(=O)O Amb9825855 [1,1,0,0,0,0|1,0,1]=4 4975 B7R0.4 NCCCCC(F)F Amb32812804 [1,1,0,0,0,0|2,0,0]=4 4976 B7R0.4 NCCCCS(=O)O Amb27882127 [1,1,0,0,0,0|2,0,0]=4 4977 B7R0.4 NCCCOC(F)F Amb26485921 [1,1,0,0,0,0|2,0,0]=4 4978 B7R0.4 NCCCOS(=O)O Amb26007874 [1,1,0,0,0,0|2,0,0]=4 4979 B7R0.4 NCCOCC(=O)O Amb18630146 [1,1,0,0,0,0|1,0,1]=4 4980 B7R0.4 NCCOCC(=O)O Amb33550947 [1,1,0,0,0,0|1,0,1]=4 4981 B7R0.4 NCCOCC(F)F Amb33329374 [1,1,0,0,0,0|2,0,0]=4 4982 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,1,0,0,0,0|1,0,1]=4 4983 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,1,0,0,0,0|1,0,1]=4 4984 B7R0.4 O=C(O)CCCCF Amb26639920 [1,1,0,0,0,0|1,0,1]=4 4985 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|1,0,1]=4 4986 B7R0.4 O=C(O)CCCCS Amb17503767 [1,1,0,0,0,0|1,0,1]=4 4987 B7R0.4 O=C(O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,1]=4 4988 B7R0.4 O=C(O)COCCF Amb27866609 [1,1,0,0,0,0|1,0,1]=4 4989 B7R0.4 O=C(O)COCCO Amb6680914 [1,1,0,0,0,0|1,0,1]=4 4990 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,1,0,0,0,0|1,0,1]=4 4991 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,1,0,0,0,0|1,0,1]=4 4992 B7R0.4 O=C([O-])COCCO Amb33553026 [1,1,0,0,0,0|1,0,1]=4 4993 B7R0.4 O=CCCCC(O)O Amb25889261 [1,1,0,0,0,0|1,0,1]=4 4994 B7R0.4 O=S([O-])CCCCO Amb27181023 [1,1,0,0,0,0|2,0,0]=4 4995 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [1,1,0,0,0,0|2,0,0]=4 4996 B7R0.4 OB(O)CCCCBr Amb20171450 [1,1,0,0,0,0|2,0,0]=4 4997 B7R0.4 OC(Cl)CCCCCl Amb27410884 [1,1,0,0,0,0|1,0,0]=3 4998 B7R0.4 OC(O)CCCSS Amb27978339 [1,1,0,0,0,0|2,0,0]=4 4999 B7R0.4 OCCCCB(O)O Amb25351122 [1,1,0,0,0,0|2,0,0]=4 5000 B7R0.4 OCCCOB(O)O Amb27491736 [1,1,0,0,0,0|2,0,0]=4 5001 B7R0.4 OCCNCC(F)F Amb24398313 [1,1,0,0,0,0|2,0,0]=4 5002 B7R0.4 OCCOCC(F)F Amb22008072 [1,1,0,0,0,0|1,0,0]=3 5003 B7R0.4 [C-]#[N+]CCCC(C)C Amb27792444 [1,1,0,0,0,0|2,0,0]=4 5004 B7R0.4 [C-]#[N+]CCOC(C)C Amb1981101 [1,1,0,0,0,0|1,0,1]=4 5005 B7R0.7 C#CCC(C)CCC Amb33321138 [1,1,0,0,0,0|1,0,1]=4 5006 B7R0.7 C#CCC(C)OCC Amb33425044 [1,1,0,0,0,0|0,0,2]=4 5007 B7R0.7 C#CCC(O)CCO Amb27213934 [1,1,0,0,0,0|0,0,2]=4 5008 B7R0.7 C#CC[C@H](O)CCC Amb27950875 [1,1,0,0,0,0|1,0,1]=4 5009 B7R0.7 C=C(CCC)CCC Amb25088297 [1,1,0,0,0,0|1,0,1]=4 5010 B7R0.7 C=C(CCC)CCN Amb33374808 [1,1,0,0,0,0|1,0,1]=4 5011 B7R0.7 C=C(CCC)CCO Amb27642086 [1,1,0,0,0,0|0,0,1]=3 5012 B7R0.7 C=C(CCO)CCO Amb25371349 [1,1,0,0,0,0|1,0,1]=4 5013 B7R0.7 C=C(CCO)COC Amb32945409 [1,1,0,0,0,0|1,0,1]=4 5014 B7R0.7 C=CCC(C)CCC Amb26958532 [1,1,0,0,0,0|1,0,1]=4 5015 B7R0.7 C=CCC(C)CCO Amb27603507 [1,1,0,0,0,0|0,0,2]=4 5016 B7R0.7 C=CCC(O)CCC Amb4019981 [1,1,0,0,0,0|1,0,1]=4 5017 B7R0.7 C=CC[C@@H](N)CCO Amb27398150 [1,1,0,0,0,0|0,0,2]=4 5018 B7R0.7 C=CC[C@@H](O)CCC Amb28315693 [1,1,0,0,0,0|1,0,1]=4 5019 B7R0.7 C=CC[C@H](O)CCC Amb27221895 [1,1,0,0,0,0|1,0,1]=4 5020 B7R0.7 C=COC(O)CCC Amb27222270 [1,1,0,0,0,0|0,0,2]=4 5021 B7R0.7 CC#CC(C)CCO Amb28455683 [1,1,0,0,0,0|0,0,2]=4 5022 B7R0.7 CC(CCBr)CCBr Amb8515114 [1,1,0,0,0,0|2,0,0]=4 5023 B7R0.7 CC(CCCl)CCCl Amb26942744 [1,1,0,0,0,0|2,0,0]=4 5024 B7R0.7 CC(CCI)CCI Amb24483140 [1,1,0,0,0,0|2,0,0]=4 5025 B7R0.7 CC(CCN)CCBr Amb28122972 [1,1,0,0,0,0|2,0,0]=4 5026 B7R0.7 CC(CCN)CCF Amb33196462 [1,1,0,0,0,0|2,0,0]=4 5027 B7R0.7 CC(CCN)CCN Amb25138224 [1,1,0,0,0,0|2,0,0]=4 5028 B7R0.7 CC(CCN)CCO Amb17569905 [1,1,0,0,0,0|1,0,0]=3 5029 B7R0.7 CC(CCO)CCI Amb25262818 [1,1,0,0,0,0|1,0,0]=3 5030 B7R0.7 CC(CCO)CCO Amb17939001 [1,1,0,0,0,0|1,0,0]=3 5031 B7R0.7 CCCC(=N)OCC Amb20672875 [1,1,0,0,0,0|0,0,1]=3 5032 B7R0.7 CCCC(=N)OCC Amb25070806 [1,1,0,0,0,0|0,0,1]=3 5033 B7R0.7 CCCC(=O)CCBr Amb27845324 [1,1,0,0,0,0|1,0,1]=4 5034 B7R0.7 CCCC(=O)CCC Amb6608653 [1,1,0,0,0,0|1,0,1]=4 5035 B7R0.7 CCCC(=O)CCCl Amb17593421 [1,1,0,0,0,0|1,0,1]=4 5036 B7R0.7 CCCC(=O)CCN Amb25104618 [1,1,0,0,0,0|1,0,1]=4 5037 B7R0.7 CCCC(=O)OCBr Amb27659135 [1,1,0,0,0,0|1,0,1]=4 5038 B7R0.7 CCCC(=O)OCC Amb3940136 [1,1,0,0,0,0|0,0,1]=3 5039 B7R0.7 CCCC(=O)OCCl Amb8384806 [1,1,0,0,0,0|1,0,1]=4 5040 B7R0.7 CCCC(=S)OCC Amb22168045 [1,1,0,0,0,0|0,0,1]=3 5041 B7R0.7 CCCC(Br)CCC Amb8968455 [1,1,0,0,0,0|1,0,0]=3 5042 B7R0.7 CCCC(Br)CCCl Amb27472207 [1,1,0,0,0,0|1,0,0]=3 5043 B7R0.7 CCCC(Br)\C=C\O Amb28458444 [1,1,0,0,0,0|0,0,2]=4 5044 B7R0.7 CCCC(C)CC#N Amb26515743 [1,1,0,0,0,0|1,0,1]=4 5045 B7R0.7 CCCC(C)CC=S Amb22168291 [1,1,0,0,0,0|0,1,1]=4 5046 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,0]=3 5047 B7R0.7 CCCC(C)CCC Amb22229829 [1,1,0,0,0,0|1,0,0]=3 5048 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,0]=3 5049 B7R0.7 CCCC(C)CCN Amb31145475 [1,1,0,0,0,0|1,0,0]=3 5050 B7R0.7 CCCC(C)CCN Amb839082 [1,1,0,0,0,0|1,0,0]=3 5051 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,0]=2 5052 B7R0.7 CCCC(C)CCS Amb33320804 [1,1,0,0,0,0|0,1,0]=3 5053 B7R0.7 CCCC(C)CNC Amb33330634 [1,1,0,0,0,0|2,0,0]=4 5054 B7R0.7 CCCC(C)CNC Amb6719001 [1,1,0,0,0,0|2,0,0]=4 5055 B7R0.7 CCCC(C)CNN Amb6744626 [1,1,0,0,0,0|2,0,0]=4 5056 B7R0.7 CCCC(C)CNO Amb26632405 [1,1,0,0,0,0|1,0,0]=3 5057 B7R0.7 CCCC(C)CON Amb27630051 [1,1,0,0,0,0|2,0,0]=4 5058 B7R0.7 CCCC(C)NCC Amb22586730 [1,1,0,0,0,0|1,0,0]=3 5059 B7R0.7 CCCC(C)NCC Amb9726218 [1,1,0,0,0,0|1,0,0]=3 5060 B7R0.7 CCCC(C)OCC Amb22733741 [1,1,0,0,0,0|0,0,0]=2 5061 B7R0.7 CCCC(C)\C=N\O Amb28247268 [1,1,0,0,0,0|1,0,1]=4 5062 B7R0.7 CCCC(Cl)CSC Amb27966841 [1,1,0,0,0,0|2,0,0]=4 5063 B7R0.7 CCCC(F)CCN Amb25869704 [1,1,0,0,0,0|1,0,0]=3 5064 B7R0.7 CCCC(F)CCO Amb27662632 [1,1,0,0,0,0|0,0,0]=2 5065 B7R0.7 CCCC(N)CC#N Amb27960346 [1,1,0,0,0,0|1,0,1]=4 5066 B7R0.7 CCCC(N)CCC Amb1102706 [1,1,0,0,0,0|1,0,0]=3 5067 B7R0.7 CCCC(N)CCN Amb27838332 [1,1,0,0,0,0|1,0,0]=3 5068 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|0,0,0]=2 5069 B7R0.7 CCCC(N)CSC Amb18313615 [1,1,0,0,0,0|2,0,0]=4 5070 B7R0.7 CCCC(O)CCC Amb4035747 [1,1,0,0,0,0|1,0,0]=3 5071 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|1,0,0]=3 5072 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|0,0,0]=2 5073 B7R0.7 CCCC(O)CNC Amb18314672 [1,1,0,0,0,0|2,0,0]=4 5074 B7R0.7 CCCC(O)CNN Amb28316120 [1,1,0,0,0,0|2,0,0]=4 5075 B7R0.7 CCCC(O)COC Amb28347497 [1,1,0,0,0,0|2,0,0]=4 5076 B7R0.7 CCCC(S)CC=O Amb24481552 [1,1,0,0,0,0|0,0,2]=4 5077 B7R0.7 CCCC(S)CCC Amb7784733 [1,1,0,0,0,0|1,0,0]=3 5078 B7R0.7 CCCN(C)CCBr Amb18178281 [1,1,0,0,0,0|2,0,0]=4 5079 B7R0.7 CCCN(C)CCC Amb9787750 [1,1,0,0,0,0|2,0,0]=4 5080 B7R0.7 CCCN(C)CCCl Amb17334148 [1,1,0,0,0,0|2,0,0]=4 5081 B7R0.7 CCCN(C)CCF Amb27951092 [1,1,0,0,0,0|2,0,0]=4 5082 B7R0.7 CCCN(C)CCN Amb8898636 [1,1,0,0,0,0|2,0,0]=4 5083 B7R0.7 CCCN(C)CCO Amb3204757 [1,1,0,0,0,0|1,0,0]=3 5084 B7R0.7 CCCN(N)CCC Amb17593208 [1,1,0,0,0,0|2,0,0]=4 5085 B7R0.7 CCCN(N)CCO Amb27424310 [1,1,0,0,0,0|1,0,0]=3 5086 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|2,0,0]=4 5087 B7R0.7 CCCS(=O)CCC Amb6366329 [1,1,0,0,0,0|1,1,0]=4 5088 B7R0.7 CCCS(=O)NCC Amb28062922 [1,1,0,0,0,0|2,0,0]=4 5089 B7R0.7 CCC[C@@H](C)CC=O Amb27393066 [1,1,0,0,0,0|0,0,2]=4 5090 B7R0.7 CCC[C@@H](C)CCBr Amb28363763 [1,1,0,0,0,0|1,0,0]=3 5091 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|0,0,0]=2 5092 B7R0.7 CCC[C@@H](N)CNC Amb27452197 [1,1,0,0,0,0|2,0,0]=4 5093 B7R0.7 CCC[C@@H](O)CCN Amb33204237 [1,1,0,0,0,0|1,0,0]=3 5094 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|0,0,0]=2 5095 B7R0.7 CCC[C@H](N)CC#N Amb28241461 [1,1,0,0,0,0|1,0,1]=4 5096 B7R0.7 CCC[C@H](N)CCO Amb25889377 [1,1,0,0,0,0|0,0,0]=2 5097 B7R0.7 CCC[C@H](N)CCO Amb32409602 [1,1,0,0,0,0|0,0,0]=2 5098 B7R0.7 CCC[C@H](N)COC Amb28316177 [1,1,0,0,0,0|2,0,0]=4 5099 B7R0.7 CCC[C@H](N)CSC Amb28206579 [1,1,0,0,0,0|2,0,0]=4 5100 B7R0.7 CCC[C@H](O)CCN Amb33204238 [1,1,0,0,0,0|1,0,0]=3 5101 B7R0.7 CCC[PH](=O)CCC Amb26366296 [1,1,0,0,0,0|2,0,0]=4 5102 B7R0.7 CCC\C(C)=C\CO Amb28287554 [1,1,0,0,0,0|0,0,2]=4 5103 B7R0.7 CCNC(=O)CCO Amb17334068 [1,1,0,0,0,0|1,0,1]=4 5104 B7R0.7 CCNC(=O)OCC Amb8517332 [1,1,0,0,0,0|1,0,1]=4 5105 B7R0.7 CCNC(C)CCO Amb8428187 [1,1,0,0,0,0|1,0,0]=3 5106 B7R0.7 CCNC(C)COC Amb6689696 [1,1,0,0,0,0|2,0,0]=4 5107 B7R0.7 CCNC(C)COC Amb7969718 [1,1,0,0,0,0|2,0,0]=4 5108 B7R0.7 CCNC(C)CSC Amb18313762 [1,1,0,0,0,0|2,0,0]=4 5109 B7R0.7 CCOC(=N)CCBr Amb20672901 [1,1,0,0,0,0|1,0,1]=4 5110 B7R0.7 CCOC(=N)CCBr Amb25798516 [1,1,0,0,0,0|1,0,1]=4 5111 B7R0.7 CCOC(=N)CCCl Amb8427995 [1,1,0,0,0,0|1,0,1]=4 5112 B7R0.7 CCOC(=N)CCCl Amb9173330 [1,1,0,0,0,0|1,0,1]=4 5113 B7R0.7 CCOC(=N)CCO Amb27827757 [1,1,0,0,0,0|1,0,1]=4 5114 B7R0.7 CCOC(=N)CNC Amb24529172 [1,1,0,0,0,0|1,0,1]=4 5115 B7R0.7 CCOC(=N)COC Amb23504134 [1,1,0,0,0,0|1,0,1]=4 5116 B7R0.7 CCOC(=N)COC Amb28989436 [1,1,0,0,0,0|1,0,1]=4 5117 B7R0.7 CCOC(=N)OCC Amb26911602 [1,1,0,0,0,0|1,0,1]=4 5118 B7R0.7 CCOC(=O)CCBr Amb3940217 [1,1,0,0,0,0|1,0,1]=4 5119 B7R0.7 CCOC(=O)CCCl Amb3940265 [1,1,0,0,0,0|1,0,1]=4 5120 B7R0.7 CCOC(=O)CCF Amb22492835 [1,1,0,0,0,0|1,0,1]=4 5121 B7R0.7 CCOC(=O)CCI Amb19957952 [1,1,0,0,0,0|1,0,1]=4 5122 B7R0.7 CCOC(=O)CCN Amb2684293 [1,1,0,0,0,0|1,0,1]=4 5123 B7R0.7 CCOC(=O)CCN Amb2697378 [1,1,0,0,0,0|1,0,1]=4 5124 B7R0.7 CCOC(=O)CCO Amb8867845 [1,1,0,0,0,0|1,0,1]=4 5125 B7R0.7 CCOC(=O)CCS Amb20620159 [1,1,0,0,0,0|1,0,1]=4 5126 B7R0.7 CCOC(=O)CC[NH3+] Amb24113699 [1,1,0,0,0,0|1,0,1]=4 5127 B7R0.7 CCOC(=O)CNC Amb33531143 [1,1,0,0,0,0|1,0,1]=4 5128 B7R0.7 CCOC(=O)CNC Amb3941374 [1,1,0,0,0,0|1,0,1]=4 5129 B7R0.7 CCOC(=O)COC Amb2726240 [1,1,0,0,0,0|1,0,1]=4 5130 B7R0.7 CCOC(=O)CSC Amb8514150 [1,1,0,0,0,0|1,0,1]=4 5131 B7R0.7 CCOC(=O)OCC Amb6608863 [1,1,0,0,0,0|1,0,1]=4 5132 B7R0.7 CCOC(=S)CCBr Amb27634903 [1,1,0,0,0,0|1,0,1]=4 5133 B7R0.7 CCOC(=S)CCCl Amb28067770 [1,1,0,0,0,0|1,0,1]=4 5134 B7R0.7 CCOC(=S)SCC Amb17939407 [1,1,0,0,0,0|1,0,1]=4 5135 B7R0.7 CCOC(C)CC#N Amb33425703 [1,1,0,0,0,0|1,0,1]=4 5136 B7R0.7 CCOC(C)CC=O Amb25702447 [1,1,0,0,0,0|1,0,1]=4 5137 B7R0.7 CCOC(C)CCBr Amb28123922 [1,1,0,0,0,0|1,0,0]=3 5138 B7R0.7 CCOC(C)CCN Amb19022809 [1,1,0,0,0,0|1,0,0]=3 5139 B7R0.7 CCOC(C)CCO Amb4017406 [1,1,0,0,0,0|1,0,0]=3 5140 B7R0.7 CCOC(C)CCS Amb33424966 [1,1,0,0,0,0|1,0,0]=3 5141 B7R0.7 CCOC(C)CNC Amb10608191 [1,1,0,0,0,0|1,0,0]=3 5142 B7R0.7 CCOC(C)CNN Amb24436336 [1,1,0,0,0,0|2,0,0]=4 5143 B7R0.7 CCOC(C)CNO Amb33425739 [1,1,0,0,0,0|2,0,0]=4 5144 B7R0.7 CCOC(C)CON Amb33425326 [1,1,0,0,0,0|2,0,0]=4 5145 B7R0.7 CCOC(C)OCC Amb6891962 [1,1,0,0,0,0|1,0,0]=3 5146 B7R0.7 CCOC(Cl)OCC Amb27750361 [1,1,0,0,0,0|1,0,0]=3 5147 B7R0.7 CCOC(O)SCC Amb27653105 [1,1,0,0,0,0|1,0,0]=3 5148 B7R0.7 CCOP(C)OCC Amb33544404 [1,1,0,0,0,0|2,0,0]=4 5149 B7R0.7 CCOP(Cl)OCC Amb4297342 [1,1,0,0,0,0|2,0,0]=4 5150 B7R0.7 CCOP(O)OCC Amb17938598 [1,1,0,0,0,0|2,0,0]=4 5151 B7R0.7 CCOS(=O)CCCl Amb27635353 [1,1,0,0,0,0|2,0,0]=4 5152 B7R0.7 CCOS(=O)OCC Amb8514410 [1,1,0,0,0,0|2,0,0]=4 5153 B7R0.7 CCO[PH](=O)CCCl Amb27811333 [1,1,0,0,0,0|2,0,0]=4 5154 B7R0.7 CCO[PH](=O)CNC Amb27669686 [1,1,0,0,0,0|2,0,0]=4 5155 B7R0.7 CCO[PH](=O)OCC Amb8513123 [1,1,0,0,0,0|2,0,0]=4 5156 B7R0.7 CCO[PH](=S)OCC Amb4297286 [1,1,0,0,0,0|2,0,0]=4 5157 B7R0.7 CCO[SiH](C)OCC Amb8517630 [1,1,0,0,0,0|1,1,0]=4 5158 B7R0.7 CCO[SiH](Cl)OCC Amb27838961 [1,1,0,0,0,0|1,1,0]=4 5159 B7R0.7 CCSC(=O)CCO Amb28044792 [1,1,0,0,0,0|1,0,1]=4 5160 B7R0.7 CCSC(C)CCCl Amb27880855 [1,1,0,0,0,0|1,1,0]=4 5161 B7R0.7 CCSC(C)CCO Amb26655908 [1,1,0,0,0,0|1,0,0]=3 5162 B7R0.7 CC\C=C(/C)CCC Amb28140596 [1,1,0,0,0,0|1,0,1]=4 5163 B7R0.7 CC\C=C(/C)CCO Amb27640229 [1,1,0,0,0,0|0,0,2]=4 5164 B7R0.7 CC\C=C(\C)CCO Amb27441640 [1,1,0,0,0,0|0,0,2]=4 5165 B7R0.7 CN(CCN)CCO Amb33536070 [1,1,0,0,0,0|2,0,0]=4 5166 B7R0.7 CN(CCO)CCBr Amb18179238 [1,1,0,0,0,0|2,0,0]=4 5167 B7R0.7 CN(CCO)CCF Amb25889300 [1,1,0,0,0,0|2,0,0]=4 5168 B7R0.7 CN(CCO)CCI Amb27260958 [1,1,0,0,0,0|2,0,0]=4 5169 B7R0.7 CN(CCO)CCO Amb3940336 [1,1,0,0,0,0|2,0,0]=4 5170 B7R0.7 CN(CCO)CCS Amb27424305 [1,1,0,0,0,0|2,0,0]=4 5171 B7R0.7 CNCC(C)CCN Amb17334067 [1,1,0,0,0,0|2,0,0]=4 5172 B7R0.7 CNCC(C)CCO Amb17569901 [1,1,0,0,0,0|1,0,0]=3 5173 B7R0.7 CNCC(O)CCF Amb33196461 [1,1,0,0,0,0|2,0,0]=4 5174 B7R0.7 CNCC(O)CCN Amb18559793 [1,1,0,0,0,0|2,0,0]=4 5175 B7R0.7 CNCC(O)CCO Amb27593318 [1,1,0,0,0,0|1,0,0]=3 5176 B7R0.7 COCC(Br)CCN Amb27218920 [1,1,0,0,0,0|2,0,0]=4 5177 B7R0.7 COCC(C)CCBr Amb28187454 [1,1,0,0,0,0|2,0,0]=4 5178 B7R0.7 COCC(C)CCCl Amb26515746 [1,1,0,0,0,0|2,0,0]=4 5179 B7R0.7 COCC(C)CCN Amb17569914 [1,1,0,0,0,0|2,0,0]=4 5180 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|1,0,0]=3 5181 B7R0.7 COCC(C)CNO Amb27250879 [1,1,0,0,0,0|2,0,0]=4 5182 B7R0.7 COCC(C)OCCl Amb27752205 [1,1,0,0,0,0|2,0,0]=4 5183 B7R0.7 COCC(Cl)CCO Amb28454426 [1,1,0,0,0,0|1,0,0]=3 5184 B7R0.7 COCC(F)CCN Amb27397139 [1,1,0,0,0,0|2,0,0]=4 5185 B7R0.7 COCC(N)CCCl Amb28207136 [1,1,0,0,0,0|2,0,0]=4 5186 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|1,0,0]=3 5187 B7R0.7 COCC(O)CCN Amb18203347 [1,1,0,0,0,0|2,0,0]=4 5188 B7R0.7 COC[C@@H](N)CCO Amb27964057 [1,1,0,0,0,0|1,0,0]=3 5189 B7R0.7 COC[C@@H](O)CCN Amb24474146 [1,1,0,0,0,0|2,0,0]=4 5190 B7R0.7 COC[C@H](O)CCN Amb27650451 [1,1,0,0,0,0|2,0,0]=4 5191 B7R0.7 CP(CCO)CCO Amb26926465 [1,1,0,0,0,0|2,0,0]=4 5192 B7R0.7 CSCC(C)CCN Amb33272059 [1,1,0,0,0,0|2,0,0]=4 5193 B7R0.7 CSCC(F)CCN Amb33225468 [1,1,0,0,0,0|2,0,0]=4 5194 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|1,0,0]=3 5195 B7R0.7 CSCC(O)CCN Amb25078322 [1,1,0,0,0,0|2,0,0]=4 5196 B7R0.7 CSC[C@@H](O)CCN Amb33271743 [1,1,0,0,0,0|2,0,0]=4 5197 B7R0.7 CSC[C@H](O)CCN Amb33271745 [1,1,0,0,0,0|2,0,0]=4 5198 B7R0.7 CSSC(C)CCO Amb27593225 [1,1,0,0,0,0|2,0,0]=4 5199 B7R0.7 C\C=C\C(Br)CCC Amb17672603 [1,1,0,0,0,0|1,0,1]=4 5200 B7R0.7 C\C=C\C(C)CCC Amb26633016 [1,1,0,0,0,0|1,0,1]=4 5201 B7R0.7 C\C=C\C(C)CCO Amb27437234 [1,1,0,0,0,0|0,0,2]=4 5202 B7R0.7 C\C=C\C(O)CCO Amb3354799 [1,1,0,0,0,0|0,0,2]=4 5203 B7R0.7 C\C=C\[C@@H](C)CCO Amb27651868 [1,1,0,0,0,0|0,0,2]=4 5204 B7R0.7 C\C=C\[C@H](O)CCO Amb27164439 [1,1,0,0,0,0|0,0,2]=4 5205 B7R0.7 ClC(CCBr)CCBr Amb27983162 [1,1,0,0,0,0|2,0,0]=4 5206 B7R0.7 NC(CCBr)CCBr Amb27953786 [1,1,0,0,0,0|2,0,0]=4 5207 B7R0.7 NC(CCCl)CCCl Amb17593888 [1,1,0,0,0,0|2,0,0]=4 5208 B7R0.7 NC(CCO)CCF Amb32946596 [1,1,0,0,0,0|1,0,0]=3 5209 B7R0.7 NC(CCO)CCO Amb25324048 [1,1,0,0,0,0|1,0,0]=3 5210 B7R0.7 NCCC(F)CCF Amb33196409 [1,1,0,0,0,0|2,0,0]=4 5211 B7R0.7 NCCC(N)CCN Amb18641937 [1,1,0,0,0,0|2,0,0]=4 5212 B7R0.7 NCCC(O)CCF Amb33196467 [1,1,0,0,0,0|2,0,0]=4 5213 B7R0.7 NCCC(O)CCN Amb25890416 [1,1,0,0,0,0|2,0,0]=4 5214 B7R0.7 NCCC(O)CCO Amb27876317 [1,1,0,0,0,0|1,0,0]=3 5215 B7R0.7 NCCS(=O)CCO Amb28126881 [1,1,0,0,0,0|1,1,0]=4 5216 B7R0.7 NCC[C@@H](O)CCF Amb33196425 [1,1,0,0,0,0|2,0,0]=4 5217 B7R0.7 NCC[C@@H](O)CCO Amb28187429 [1,1,0,0,0,0|1,0,0]=3 5218 B7R0.7 NCC[C@H](O)CCF Amb33196424 [1,1,0,0,0,0|2,0,0]=4 5219 B7R0.7 NN(CCO)CCO Amb17593230 [1,1,0,0,0,0|2,0,0]=4 5220 B7R0.7 O=C(CCO)CCO Amb22002370 [1,1,0,0,0,0|1,0,1]=4 5221 B7R0.7 O=S(CCO)CCO Amb1039000 [1,1,0,0,0,0|1,1,0]=4 5222 B7R0.7 OCCC(O)CCO Amb17593226 [1,1,0,0,0,0|1,0,0]=3 5223 B7R0.7 OCCN(Br)CCO Amb27649646 [1,1,0,0,0,0|2,0,0]=4 5224 B7R0.7 OCCN(O)CCO Amb27487053 [1,1,0,0,0,0|2,0,0]=4 5225 B7R0.7 [C-]#[N+]CC(C)CCC Amb33322331 [1,1,0,0,0,0|2,0,0]=4 5226 B7R0.7 [C-]#[N+]CC(C)OCC Amb33425393 [1,1,0,0,0,0|1,0,1]=4 5227 B7R0.7 [C-]#[N+]CC(F)CCC Amb27421865 [1,1,0,0,0,0|2,0,0]=4 5228 B9R0.4 C=C(C)CC(=O)OCCO Amb27839229 [0,2,0,0,0,0|0,0,2]=4 5229 B9R0.4 C=C(CCCC)CC(=O)O Amb18643896 [0,2,0,0,0,0|1,0,1]=4 5230 B9R0.4 C=CCOC(Cl)CC(C)C Amb27837875 [0,2,0,0,0,0|1,0,1]=4 5231 B9R0.4 CC(=O)CC(=O)OCCO Amb24620465 [0,2,0,0,0,0|0,0,2]=4 5232 B9R0.4 CC(Br)CC(C)NCCF Amb27590486 [0,2,0,0,0,0|2,0,0]=4 5233 B9R0.4 CC(C)CC(=O)NCCO Amb5797805 [0,2,0,0,0,0|1,0,1]=4 5234 B9R0.4 CC(C)CC(=O)OCCBr Amb33276531 [0,2,0,0,0,0|1,0,1]=4 5235 B9R0.4 CC(C)CC(=O)OCCO Amb26515094 [0,2,0,0,0,0|0,0,1]=3 5236 B9R0.4 CC(C)CC(C)CCCBr Amb24064688 [0,2,0,0,0,0|2,0,0]=4 5237 B9R0.4 CC(C)CC(C)CCCCl Amb24432723 [0,2,0,0,0,0|2,0,0]=4 5238 B9R0.4 CC(C)CC(C)NCCCl Amb27490671 [0,2,0,0,0,0|2,0,0]=4 5239 B9R0.4 CC(C)CC(C)NCCF Amb27837830 [0,2,0,0,0,0|2,0,0]=4 5240 B9R0.4 CC(C)CC(C)NCCN Amb27649362 [0,2,0,0,0,0|2,0,0]=4 5241 B9R0.4 CC(C)CC(C)NCCS Amb27208970 [0,2,0,0,0,0|1,1,0]=4 5242 B9R0.4 CC(C)CC(C)OCC=O Amb27809027 [0,2,0,0,0,0|0,0,2]=4 5243 B9R0.4 CC(C)CC(O)C#CCO Amb27394768 [0,2,0,0,0,0|1,0,1]=4 5244 B9R0.4 CC(C)CC(O)CCCF Amb27410874 [0,2,0,0,0,0|2,0,0]=4 5245 B9R0.4 CC(C)CC(O)CCCO Amb27791444 [0,2,0,0,0,0|1,0,0]=3 5246 B9R0.4 CC(C)C[C@H](C)\C=C\CO Amb27208174 [0,2,0,0,0,0|1,0,1]=4 5247 B9R0.4 CC(CC(F)F)NCCO Amb27590969 [0,2,0,0,0,0|2,0,0]=4 5248 B9R0.4 CC(CCCO)CN(C)C Amb28324038 [0,2,0,0,0,0|2,0,0]=4 5249 B9R0.4 CC(CN(C)C)NCCO Amb28313600 [0,2,0,0,0,0|2,0,0]=4 5250 B9R0.4 CC(Cl)CC(C)NCCF Amb27454052 [0,2,0,0,0,0|2,0,0]=4 5251 B9R0.4 CC(Cl)C[PH](=O)OCCCl Amb27881227 [0,2,0,0,0,0|2,0,0]=4 5252 B9R0.4 CC(O)CC(C)NCCO Amb27974890 [0,2,0,0,0,0|1,0,0]=3 5253 B9R0.4 CC(O)CN(C)CCCF Amb27590878 [0,2,0,0,0,0|2,0,0]=4 5254 B9R0.4 CC(O)CS(=O)CCCN Amb27951177 [0,2,0,0,0,0|1,1,0]=4 5255 B9R0.4 CCCCC(=O)CC(C)Cl Amb27984861 [0,2,0,0,0,0|2,0,0]=4 5256 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [0,2,0,0,0,0|1,0,1]=4 5257 B9R0.4 CCCCC(C)CC(C)Cl Amb27972096 [0,2,0,0,0,0|2,0,0]=4 5258 B9R0.4 CCCCC(C)CC(C)N Amb27618079 [0,2,0,0,0,0|2,0,0]=4 5259 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [0,2,0,0,0,0|1,0,0]=3 5260 B9R0.4 CCCCC(C)CC(Cl)Cl Amb28239773 [0,2,0,0,0,0|2,0,0]=4 5261 B9R0.4 CCCCC(Cl)CC(C)C Amb27758354 [0,2,0,0,0,0|2,0,0]=4 5262 B9R0.4 CCCCC(Cl)CC(Cl)Cl Amb28049950 [0,2,0,0,0,0|2,0,0]=4 5263 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [0,2,0,0,0,0|1,0,1]=4 5264 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [0,2,0,0,0,0|1,0,1]=4 5265 B9R0.4 CCCCC(N)CC(C)C Amb27168956 [0,2,0,0,0,0|2,0,0]=4 5266 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [0,2,0,0,0,0|1,0,1]=4 5267 B9R0.4 CCCCC(O)CC(C)C Amb22734801 [0,2,0,0,0,0|2,0,0]=4 5268 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [0,2,0,0,0,0|1,0,1]=4 5269 B9R0.4 CCCCN(C)CC(C)N Amb6661193 [0,2,0,0,0,0|2,0,0]=4 5270 B9R0.4 CCCCN(C)CC(Cl)Cl Amb28290204 [0,2,0,0,0,0|2,0,0]=4 5271 B9R0.4 CCCCN(C)C[C@@H](C)N Amb18014373 [0,2,0,0,0,0|2,0,0]=4 5272 B9R0.4 CCCCN(C)C[C@H](C)N Amb5782063 [0,2,0,0,0,0|2,0,0]=4 5273 B9R0.4 CCCCS(=O)CC(=O)O Amb18792577 [0,2,0,0,0,0|0,1,1]=4 5274 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [0,2,0,0,0,0|1,0,1]=4 5275 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [0,2,0,0,0,0|1,0,1]=4 5276 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [0,2,0,0,0,0|1,0,1]=4 5277 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [0,2,0,0,0,0|1,0,1]=4 5278 B9R0.4 CCCC[C@@H](O)CC(C)C Amb27399625 [0,2,0,0,0,0|2,0,0]=4 5279 B9R0.4 CCCC[C@@H](O)C[C@@H](C)O Amb27394748 [0,2,0,0,0,0|1,0,0]=3 5280 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [0,2,0,0,0,0|1,0,1]=4 5281 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [0,2,0,0,0,0|1,0,1]=4 5282 B9R0.4 CCCC[C@H](O)CC(C)C Amb28429013 [0,2,0,0,0,0|2,0,0]=4 5283 B9R0.4 CCCC[C@H](O)C[C@@H](C)O Amb27833061 [0,2,0,0,0,0|1,0,0]=3 5284 B9R0.4 CCCC[C@H](O)C[C@H](C)O Amb27594737 [0,2,0,0,0,0|1,0,0]=3 5285 B9R0.4 CCCC\C(C)=C\C(C)O Amb27977773 [0,2,0,0,0,0|1,0,1]=4 5286 B9R0.4 CCCC\C(C)=C\[C@H](C)O Amb27766553 [0,2,0,0,0,0|1,0,1]=4 5287 B9R0.4 CCCNC(C)CC(C)Br Amb27860452 [0,2,0,0,0,0|2,0,0]=4 5288 B9R0.4 CCCOC(=O)CC(C)C Amb4035815 [0,2,0,0,0,0|1,0,1]=4 5289 B9R0.4 CCCOC(=O)CC(C)Cl Amb27668995 [0,2,0,0,0,0|1,0,1]=4 5290 B9R0.4 CCCOC(C)CC(C)=O Amb28344519 [0,2,0,0,0,0|1,0,1]=4 5291 B9R0.4 CCNCC(C)CC(C)O Amb27961754 [0,2,0,0,0,0|2,0,0]=4 5292 B9R0.4 COCCC(C)CC(C)O Amb27399300 [0,2,0,0,0,0|2,0,0]=4 5293 B9R0.4 COCCN(C)C[C@@H](C)O Amb27205779 [0,2,0,0,0,0|2,0,0]=4 5294 B9R0.4 CSCCN(C)C[C@@H](C)O Amb27614988 [0,2,0,0,0,0|2,0,0]=4 5295 B9R0.4 CSCCN(C)C[C@H](C)O Amb27398644 [0,2,0,0,0,0|2,0,0]=4 5296 B9R0.4 C[C@H](O)CN(C)CCCI Amb28316045 [0,2,0,0,0,0|2,0,0]=4 5297 B9R0.4 C[C@H](O)CN(C)CCCO Amb28126891 [0,2,0,0,0,0|2,0,0]=4 5298 B9R0.5 C#CCC(C)NCCCC Amb27647747 [0,2,0,0,0,0|2,0,0]=4 5299 B9R0.5 C#CCCCC(N)CCC Amb27839183 [0,2,0,0,0,0|2,0,0]=4 5300 B9R0.5 C#CCCCC(O)CCC Amb27403872 [0,2,0,0,0,0|2,0,0]=4 5301 B9R0.5 C#CCCNC(C)CCC Amb27754245 [0,2,0,0,0,0|2,0,0]=4 5302 B9R0.5 C#CCCOC(=O)CCC Amb28349346 [0,2,0,0,0,0|1,0,1]=4 5303 B9R0.5 C#CCOCC(O)COC Amb28280935 [0,2,0,0,0,0|1,0,1]=4 5304 B9R0.5 C#CCONC(C)CCC Amb27233226 [0,2,0,0,0,0|1,0,1]=4 5305 B9R0.5 C=C(C#CCCC)CCO Amb28050753 [0,2,0,0,0,0|1,0,1]=4 5306 B9R0.5 C=C(CCC)CCCCCl Amb27835284 [0,2,0,0,0,0|2,0,0]=4 5307 B9R0.5 C=C(CCO)CCCC#N Amb27651756 [0,2,0,0,0,0|1,0,1]=4 5308 B9R0.5 C=C(CCO)CCCCN Amb28193274 [0,2,0,0,0,0|1,0,0]=3 5309 B9R0.5 C=C(CNC)COCCC Amb27982049 [0,2,0,0,0,0|1,0,1]=4 5310 B9R0.5 C=CCC(=O)OCCCC Amb28049467 [0,2,0,0,0,0|1,0,1]=4 5311 B9R0.5 C=CCC(O)CCCCO Amb27839188 [0,2,0,0,0,0|1,0,1]=4 5312 B9R0.5 C=CCCCC(=O)CCO Amb27262946 [0,2,0,0,0,0|1,0,1]=4 5313 B9R0.5 C=CCCCC(C)CCO Amb28455077 [0,2,0,0,0,0|1,0,1]=4 5314 B9R0.5 C=CCCCC(O)CCO Amb27598491 [0,2,0,0,0,0|1,0,1]=4 5315 B9R0.5 C=CCCNC(C)CCC Amb28056748 [0,2,0,0,0,0|2,0,0]=4 5316 B9R0.5 C=CCOCC(=O)CCC Amb27171042 [0,2,0,0,0,0|1,0,1]=4 5317 B9R0.5 C=CCOCC(C)CNC Amb27412659 [0,2,0,0,0,0|1,0,1]=4 5318 B9R0.5 C=CCOCC(O)CCC Amb28455074 [0,2,0,0,0,0|1,0,1]=4 5319 B9R0.5 C=CCOCC(O)COC Amb28321455 [0,2,0,0,0,0|1,0,1]=4 5320 B9R0.5 C=CC[C@H](O)CCCCC Amb27839428 [0,2,0,0,0,0|2,0,0]=4 5321 B9R0.5 CC(CC#N)CSCCO Amb27206507 [0,2,0,0,0,0|0,1,1]=4 5322 B9R0.5 CC(CC=O)OCCCO Amb27392434 [0,2,0,0,0,0|1,0,1]=4 5323 B9R0.5 CC(CCN)SCCON Amb27420919 [0,2,0,0,0,0|1,1,0]=4 5324 B9R0.5 CC(CCO)NCCCF Amb27229545 [0,2,0,0,0,0|2,0,0]=4 5325 B9R0.5 CC(CCO)SCCON Amb27432325 [0,2,0,0,0,0|1,1,0]=4 5326 B9R0.5 CC(\C=C\CCO)CCO Amb28294140 [0,2,0,0,0,0|1,0,1]=4 5327 B9R0.5 CCCC(=O)CCCCN Amb28058184 [0,2,0,0,0,0|2,0,0]=4 5328 B9R0.5 CCCC(=O)CCCSC Amb27758287 [0,2,0,0,0,0|2,0,0]=4 5329 B9R0.5 CCCC(=O)COCCCl Amb27244905 [0,2,0,0,0,0|1,0,0]=3 5330 B9R0.5 CCCC(=O)COCCN Amb27413187 [0,2,0,0,0,0|1,0,0]=3 5331 B9R0.5 CCCC(=O)CSCCO Amb18800667 [0,2,0,0,0,0|0,1,0]=3 5332 B9R0.5 CCCC(=O)NOCCO Amb28293706 [0,2,0,0,0,0|0,0,1]=3 5333 B9R0.5 CCCC(=O)OCCC#N Amb18643713 [0,2,0,0,0,0|1,0,1]=4 5334 B9R0.5 CCCC(=O)OCCC=O Amb28049893 [0,2,0,0,0,0|0,0,2]=4 5335 B9R0.5 CCCC(=O)OCCCN Amb27272615 [0,2,0,0,0,0|1,0,1]=4 5336 B9R0.5 CCCC(=O)OCCCO Amb28292589 [0,2,0,0,0,0|0,0,1]=3 5337 B9R0.5 CCCC(=O)\C=C\CCO Amb27409476 [0,2,0,0,0,0|1,0,1]=4 5338 B9R0.5 CCCC(Br)CCOCC Amb27392491 [0,2,0,0,0,0|2,0,0]=4 5339 B9R0.5 CCCC(C)CCCC=O Amb27425021 [0,2,0,0,0,0|1,0,1]=4 5340 B9R0.5 CCCC(C)CCCCCl Amb27626477 [0,2,0,0,0,0|2,0,0]=4 5341 B9R0.5 CCCC(C)CCCCN Amb25950864 [0,2,0,0,0,0|2,0,0]=4 5342 B9R0.5 CCCC(C)CCCCO Amb28046661 [0,2,0,0,0,0|1,0,0]=3 5343 B9R0.5 CCCC(C)CCNCC Amb27615018 [0,2,0,0,0,0|2,0,0]=4 5344 B9R0.5 CCCC(C)CNCCCl Amb28140434 [0,2,0,0,0,0|2,0,0]=4 5345 B9R0.5 CCCC(C)COCCCl Amb27961291 [0,2,0,0,0,0|1,0,0]=3 5346 B9R0.5 CCCC(C)COCCN Amb27645084 [0,2,0,0,0,0|1,0,0]=3 5347 B9R0.5 CCCC(C)COCCO Amb26080123 [0,2,0,0,0,0|0,0,0]=2 5348 B9R0.5 CCCC(C)NCCCBr Amb27223537 [0,2,0,0,0,0|2,0,0]=4 5349 B9R0.5 CCCC(C)OCCC#N Amb27759100 [0,2,0,0,0,0|1,0,0]=3 5350 B9R0.5 CCCC(C)OCCCCl Amb27442914 [0,2,0,0,0,0|1,0,0]=3 5351 B9R0.5 CCCC(C)OCCCN Amb26057752 [0,2,0,0,0,0|1,0,0]=3 5352 B9R0.5 CCCC(C)OCCCS Amb27234480 [0,2,0,0,0,0|0,1,0]=3 5353 B9R0.5 CCCC(C)SCCCCl Amb27812508 [0,2,0,0,0,0|1,1,0]=4 5354 B9R0.5 CCCC(C)SCCOC Amb27827232 [0,2,0,0,0,0|0,1,0]=3 5355 B9R0.5 CCCC(C)\C=C\CCN Amb27812532 [0,2,0,0,0,0|2,0,0]=4 5356 B9R0.5 CCCC(Cl)CCCC#N Amb27591872 [0,2,0,0,0,0|2,0,0]=4 5357 B9R0.5 CCCC(Cl)CCCCCl Amb27823562 [0,2,0,0,0,0|2,0,0]=4 5358 B9R0.5 CCCC(F)CCCCO Amb27856506 [0,2,0,0,0,0|1,0,0]=3 5359 B9R0.5 CCCC(N)CCOCC Amb27816889 [0,2,0,0,0,0|2,0,0]=4 5360 B9R0.5 CCCC(N)CCSCC Amb27480968 [0,2,0,0,0,0|2,0,0]=4 5361 B9R0.5 CCCC(N)CSCCO Amb27968788 [0,2,0,0,0,0|0,1,0]=3 5362 B9R0.5 CCCC(O)C#CCOC Amb27427492 [0,2,0,0,0,0|1,0,1]=4 5363 B9R0.5 CCCC(O)CCCC#N Amb18643761 [0,2,0,0,0,0|2,0,0]=4 5364 B9R0.5 CCCC(O)CCNCC Amb28050120 [0,2,0,0,0,0|2,0,0]=4 5365 B9R0.5 CCCC(O)COCOC Amb28435648 [0,2,0,0,0,0|2,0,0]=4 5366 B9R0.5 CCCC(O)C\C=C\CO Amb27614990 [0,2,0,0,0,0|1,0,1]=4 5367 B9R0.5 CCCCCC(=O)CCC Amb2720457 [0,2,0,0,0,0|2,0,0]=4 5368 B9R0.5 CCCCCC(=O)CCO Amb27627789 [0,2,0,0,0,0|1,0,0]=3 5369 B9R0.5 CCCCCC(=O)COC Amb27171123 [0,2,0,0,0,0|1,0,1]=4 5370 B9R0.5 CCCCCC(Br)CCC Amb28318288 [0,2,0,0,0,0|2,0,0]=4 5371 B9R0.5 CCCCCC(Br)COC Amb27849558 [0,2,0,0,0,0|1,0,0]=3 5372 B9R0.5 CCCCCC(C)CC=O Amb21953169 [0,2,0,0,0,0|1,0,1]=4 5373 B9R0.5 CCCCCC(C)CCBr Amb26637488 [0,2,0,0,0,0|2,0,0]=4 5374 B9R0.5 CCCCCC(C)CCC Amb4035718 [0,2,0,0,0,0|2,0,0]=4 5375 B9R0.5 CCCCCC(C)CCCl Amb27392063 [0,2,0,0,0,0|2,0,0]=4 5376 B9R0.5 CCCCCC(C)CCN Amb24738346 [0,2,0,0,0,0|2,0,0]=4 5377 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|1,0,0]=3 5378 B9R0.5 CCCCCC(Cl)CCCl Amb27831205 [0,2,0,0,0,0|2,0,0]=4 5379 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|1,0,0]=3 5380 B9R0.5 CCCCCC(N)CCC Amb8869705 [0,2,0,0,0,0|2,0,0]=4 5381 B9R0.5 CCCCCC(N)COC Amb27206898 [0,2,0,0,0,0|1,0,0]=3 5382 B9R0.5 CCCCCC(O)CC#N Amb18643749 [0,2,0,0,0,0|2,0,0]=4 5383 B9R0.5 CCCCCC(O)CCN Amb24730197 [0,2,0,0,0,0|2,0,0]=4 5384 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|1,0,0]=3 5385 B9R0.5 CCCCCC(O)CNC Amb27973914 [0,2,0,0,0,0|2,0,0]=4 5386 B9R0.5 CCCCCC(S)CC=O Amb27424790 [0,2,0,0,0,0|1,0,1]=4 5387 B9R0.5 CCCCCN(C)CCCl Amb17334595 [0,2,0,0,0,0|2,0,0]=4 5388 B9R0.5 CCCCCN(C)CCO Amb3204759 [0,2,0,0,0,0|1,0,0]=3 5389 B9R0.5 CCCCCN(C)CCS Amb27834912 [0,2,0,0,0,0|1,1,0]=4 5390 B9R0.5 CCCCCS(=O)CCN Amb27954729 [0,2,0,0,0,0|1,1,0]=4 5391 B9R0.5 CCCCC[C@@H](O)CCO Amb27946548 [0,2,0,0,0,0|1,0,0]=3 5392 B9R0.5 CCCCC[C@H](C)CCO Amb26861853 [0,2,0,0,0,0|1,0,0]=3 5393 B9R0.5 CCCCC[C@H](O)CCC Amb27652271 [0,2,0,0,0,0|2,0,0]=4 5394 B9R0.5 CCCCC\C(I)=C\CO Amb4017430 [0,2,0,0,0,0|1,0,1]=4 5395 B9R0.5 CCCCNC(=O)CCBr Amb17330970 [0,2,0,0,0,0|2,0,0]=4 5396 B9R0.5 CCCCNC(=O)CCC Amb5797594 [0,2,0,0,0,0|2,0,0]=4 5397 B9R0.5 CCCCNC(=O)CCCl Amb6248093 [0,2,0,0,0,0|2,0,0]=4 5398 B9R0.5 CCCCNC(=O)CCN Amb5784977 [0,2,0,0,0,0|2,0,0]=4 5399 B9R0.5 CCCCNC(C)CCBr Amb27403208 [0,2,0,0,0,0|2,0,0]=4 5400 B9R0.5 CCCCNC(C)CCO Amb27594265 [0,2,0,0,0,0|1,0,0]=3 5401 B9R0.5 CCCCOC(=O)CC#N Amb8383765 [0,2,0,0,0,0|1,0,1]=4 5402 B9R0.5 CCCCOC(=O)CCCl Amb2722788 [0,2,0,0,0,0|1,0,0]=3 5403 B9R0.5 CCCCOC(=O)CCO Amb27211287 [0,2,0,0,0,0|0,0,0]=2 5404 B9R0.5 CCCCOC(=O)CCS Amb8516995 [0,2,0,0,0,0|0,1,0]=3 5405 B9R0.5 CCCCOC(=O)CNN Amb27768106 [0,2,0,0,0,0|1,0,1]=4 5406 B9R0.5 CCCCOC(=O)COC Amb20620642 [0,2,0,0,0,0|0,0,1]=3 5407 B9R0.5 CCCCOC(=O)CON Amb25691107 [0,2,0,0,0,0|0,0,1]=3 5408 B9R0.5 CCCCOC(=O)NCC Amb27412996 [0,2,0,0,0,0|1,0,1]=4 5409 B9R0.5 CCCCOC(=O)OCCl Amb26509700 [0,2,0,0,0,0|1,0,1]=4 5410 B9R0.5 CCCCOC(=S)NCC Amb27393051 [0,2,0,0,0,0|1,0,1]=4 5411 B9R0.5 CCCCOC(C)CC=O Amb27838097 [0,2,0,0,0,0|0,0,1]=3 5412 B9R0.5 CCCCOC(C)OCC Amb4019615 [0,2,0,0,0,0|1,0,0]=3 5413 B9R0.5 CCCCOC(O)CCC Amb27839284 [0,2,0,0,0,0|1,0,0]=3 5414 B9R0.5 CCCCSC(C)CCCl Amb27848679 [0,2,0,0,0,0|1,1,0]=4 5415 B9R0.5 CCCCSC(C)CCN Amb9174079 [0,2,0,0,0,0|1,1,0]=4 5416 B9R0.5 CCCCSC(C)COC Amb28078829 [0,2,0,0,0,0|0,1,0]=3 5417 B9R0.5 CCCCS\C(C)=C\CO Amb27651728 [0,2,0,0,0,0|0,1,1]=4 5418 B9R0.5 CCCC\C=C(\C)CCO Amb27662306 [0,2,0,0,0,0|1,0,0]=3 5419 B9R0.5 CCCN(C)CCCCF Amb27946988 [0,2,0,0,0,0|2,0,0]=4 5420 B9R0.5 CCCN(C)CCCCS Amb28049591 [0,2,0,0,0,0|1,1,0]=4 5421 B9R0.5 CCCNCC(C)CCCl Amb27877425 [0,2,0,0,0,0|2,0,0]=4 5422 B9R0.5 CCCNCC(N)COC Amb28137479 [0,2,0,0,0,0|2,0,0]=4 5423 B9R0.5 CCCNCC(O)CCO Amb27453664 [0,2,0,0,0,0|1,0,0]=3 5424 B9R0.5 CCCNC[C@@H](N)CCC Amb27877347 [0,2,0,0,0,0|2,0,0]=4 5425 B9R0.5 CCCNC[C@H](O)COC Amb28126305 [0,2,0,0,0,0|2,0,0]=4 5426 B9R0.5 CCCN\N=C(/C)CCO Amb27598275 [0,2,0,0,0,0|2,0,0]=4 5427 B9R0.5 CCCOCC(=N)OCC Amb27399250 [0,2,0,0,0,0|1,0,1]=4 5428 B9R0.5 CCCOCC(N)COC Amb27807201 [0,2,0,0,0,0|1,0,0]=3 5429 B9R0.5 CCCSCC(=O)CCC Amb18800477 [0,2,0,0,0,0|1,1,0]=4 5430 B9R0.5 CCCSCC(N)CCC Amb27218055 [0,2,0,0,0,0|1,1,0]=4 5431 B9R0.5 CCCSCC(O)COC Amb27620692 [0,2,0,0,0,0|1,1,0]=4 5432 B9R0.5 CCCSC[C@@H](N)CCC Amb27755000 [0,2,0,0,0,0|1,1,0]=4 5433 B9R0.5 CCC[C@@H](C)CCCCBr Amb27956034 [0,2,0,0,0,0|2,0,0]=4 5434 B9R0.5 CCC[C@@H](F)CCCCO Amb27617034 [0,2,0,0,0,0|1,0,0]=3 5435 B9R0.5 CCC[C@@H](N)CCCOC Amb27167802 [0,2,0,0,0,0|1,0,0]=3 5436 B9R0.5 CCC[C@@H](N)CCOCC Amb27839454 [0,2,0,0,0,0|2,0,0]=4 5437 B9R0.5 CCC[C@H](C)CCCCO Amb27972560 [0,2,0,0,0,0|1,0,0]=3 5438 B9R0.5 CCC[C@H](C)OCCCO Amb27839315 [0,2,0,0,0,0|0,0,0]=2 5439 B9R0.5 CCC[C@H](F)CCCCO Amb27835909 [0,2,0,0,0,0|1,0,0]=3 5440 B9R0.5 CCC[C@H](N)CCCCO Amb27799723 [0,2,0,0,0,0|1,0,0]=3 5441 B9R0.5 CCC[C@H](N)CCOCC Amb28239931 [0,2,0,0,0,0|2,0,0]=4 5442 B9R0.5 CCC[C@H](N)CNCCF Amb28397419 [0,2,0,0,0,0|2,0,0]=4 5443 B9R0.5 CCC[C@H](O)C\C=C\CO Amb27617048 [0,2,0,0,0,0|1,0,1]=4 5444 B9R0.5 CCC\C=C\C(C)CON Amb33424693 [0,2,0,0,0,0|1,0,1]=4 5445 B9R0.5 CCC\C=C\C(N)CCO Amb33327183 [0,2,0,0,0,0|1,0,1]=4 5446 B9R0.5 CCC\C=C\C(O)CCC Amb27839603 [0,2,0,0,0,0|2,0,0]=4 5447 B9R0.5 CCC\C=C\C(O)CCO Amb27456608 [0,2,0,0,0,0|1,0,1]=4 5448 B9R0.5 CCNC(=O)CNCCO Amb9246603 [0,2,0,0,0,0|1,0,1]=4 5449 B9R0.5 CCNC(=O)COCCN Amb27837714 [0,2,0,0,0,0|1,0,1]=4 5450 B9R0.5 CCNC(=O)OCCOC Amb26558291 [0,2,0,0,0,0|1,0,1]=4 5451 B9R0.5 CCNC(C)CCCCBr Amb27867569 [0,2,0,0,0,0|2,0,0]=4 5452 B9R0.5 CCNC(C)CCCCN Amb28256279 [0,2,0,0,0,0|2,0,0]=4 5453 B9R0.5 CCNC(C)CCCCO Amb28280233 [0,2,0,0,0,0|1,0,0]=3 5454 B9R0.5 CCNC(C)CCCOC Amb28122940 [0,2,0,0,0,0|2,0,0]=4 5455 B9R0.5 CCNCCC(C)CCBr Amb28058060 [0,2,0,0,0,0|2,0,0]=4 5456 B9R0.5 CCOC(=N)COCCO Amb28345357 [0,2,0,0,0,0|0,0,1]=3 5457 B9R0.5 CCOC(=O)COCCBr Amb8394720 [0,2,0,0,0,0|1,0,1]=4 5458 B9R0.5 CCOC(=O)COCCCl Amb19958740 [0,2,0,0,0,0|1,0,1]=4 5459 B9R0.5 CCOC(=O)COCCN Amb25850783 [0,2,0,0,0,0|1,0,1]=4 5460 B9R0.5 CCOC(=O)COCCN Amb28555601 [0,2,0,0,0,0|1,0,1]=4 5461 B9R0.5 CCOC(=O)COCCO Amb24113532 [0,2,0,0,0,0|0,0,1]=3 5462 B9R0.5 CCOC(=O)OCCCO Amb28050600 [0,2,0,0,0,0|1,0,1]=4 5463 B9R0.5 CCOC(C)CCCCN Amb26327066 [0,2,0,0,0,0|2,0,0]=4 5464 B9R0.5 CCOC(C)CCCCO Amb28050663 [0,2,0,0,0,0|1,0,0]=3 5465 B9R0.5 CCOC(C)OCCCBr Amb22357028 [0,2,0,0,0,0|2,0,0]=4 5466 B9R0.5 CCOC(C)OCCCN Amb33343241 [0,2,0,0,0,0|2,0,0]=4 5467 B9R0.5 CCOC(Cl)COCCO Amb27666865 [0,2,0,0,0,0|0,0,0]=2 5468 B9R0.5 CCOCCC(=O)CCCl Amb27214166 [0,2,0,0,0,0|2,0,0]=4 5469 B9R0.5 CCOCCC(Br)COC Amb28050030 [0,2,0,0,0,0|2,0,0]=4 5470 B9R0.5 CCOCCC(C)CCBr Amb27185579 [0,2,0,0,0,0|2,0,0]=4 5471 B9R0.5 CCOCCC(C)CCS Amb27649002 [0,2,0,0,0,0|1,1,0]=4 5472 B9R0.5 CCOCCC(O)CCO Amb27663664 [0,2,0,0,0,0|1,0,0]=3 5473 B9R0.5 CCOCCN(C)CCF Amb27617514 [0,2,0,0,0,0|2,0,0]=4 5474 B9R0.5 CCOCCN(C)CCO Amb27427761 [0,2,0,0,0,0|1,0,0]=3 5475 B9R0.5 CCSCCC(O)CCN Amb24607786 [0,2,0,0,0,0|2,0,0]=4 5476 B9R0.5 CCSCCN(C)CCO Amb27663085 [0,2,0,0,0,0|1,0,0]=3 5477 B9R0.5 CC\C=C\CC(O)CCO Amb27605392 [0,2,0,0,0,0|1,0,1]=4 5478 B9R0.5 CN(CCBr)CCCCF Amb27799664 [0,2,0,0,0,0|2,0,0]=4 5479 B9R0.5 CN(CCF)CCCCN Amb28250262 [0,2,0,0,0,0|2,0,0]=4 5480 B9R0.5 CN(CCO)CCCCCl Amb18798507 [0,2,0,0,0,0|1,0,0]=3 5481 B9R0.5 CN(CCO)CCCCS Amb27753508 [0,2,0,0,0,0|1,0,0]=3 5482 B9R0.5 CNCC(=O)OCCOC Amb27770571 [0,2,0,0,0,0|1,0,1]=4 5483 B9R0.5 CNCC(C)NCCOC Amb27650909 [0,2,0,0,0,0|2,0,0]=4 5484 B9R0.5 CNCC(O)CCCOC Amb27853280 [0,2,0,0,0,0|2,0,0]=4 5485 B9R0.5 CNCCCC(C)COC Amb17569969 [0,2,0,0,0,0|2,0,0]=4 5486 B9R0.5 CNCCOC(=O)COC Amb27214682 [0,2,0,0,0,0|1,0,1]=4 5487 B9R0.5 CNCCOC(C)COC Amb27475499 [0,2,0,0,0,0|1,0,0]=3 5488 B9R0.5 COCC(=O)OCCCO Amb26408081 [0,2,0,0,0,0|1,0,1]=4 5489 B9R0.5 COCC(C)CNCCF Amb27837853 [0,2,0,0,0,0|2,0,0]=4 5490 B9R0.5 COCC(C)NCCCO Amb27768603 [0,2,0,0,0,0|2,0,0]=4 5491 B9R0.5 COCC(C)NCCSC Amb18800728 [0,2,0,0,0,0|2,0,0]=4 5492 B9R0.5 COCC(C)OCCC#N Amb27395407 [0,2,0,0,0,0|1,0,1]=4 5493 B9R0.5 COCC(C)OCCCS Amb27761361 [0,2,0,0,0,0|1,0,0]=3 5494 B9R0.5 COCC(C)SCCCN Amb27669037 [0,2,0,0,0,0|1,1,0]=4 5495 B9R0.5 COCC(Cl)CCCSC Amb28341860 [0,2,0,0,0,0|2,0,0]=4 5496 B9R0.5 COCC(Cl)COCCCl Amb28121066 [0,2,0,0,0,0|1,0,0]=3 5497 B9R0.5 COCC(N)CSCCO Amb28315396 [0,2,0,0,0,0|0,1,0]=3 5498 B9R0.5 COCC(O)CCCCO Amb27760907 [0,2,0,0,0,0|1,0,0]=3 5499 B9R0.5 COCC(O)CCCSC Amb27956009 [0,2,0,0,0,0|2,0,0]=4 5500 B9R0.5 COCC(O)CNCCF Amb27857017 [0,2,0,0,0,0|2,0,0]=4 5501 B9R0.5 COCCCC(C)CCCl Amb27607417 [0,2,0,0,0,0|2,0,0]=4 5502 B9R0.5 COCCCC(C)CCN Amb27230132 [0,2,0,0,0,0|2,0,0]=4 5503 B9R0.5 COCCCC(Cl)COC Amb18798738 [0,2,0,0,0,0|2,0,0]=4 5504 B9R0.5 COCCCC(O)CCN Amb28126850 [0,2,0,0,0,0|2,0,0]=4 5505 B9R0.5 COCCCN(C)CCBr Amb28280533 [0,2,0,0,0,0|2,0,0]=4 5506 B9R0.5 COCCCN(C)CCCl Amb17334659 [0,2,0,0,0,0|2,0,0]=4 5507 B9R0.5 COCCCN(C)CCI Amb28430518 [0,2,0,0,0,0|2,0,0]=4 5508 B9R0.5 COCCCN(C)CCN Amb17334263 [0,2,0,0,0,0|2,0,0]=4 5509 B9R0.5 COCCCN(C)CCS Amb27595228 [0,2,0,0,0,0|1,1,0]=4 5510 B9R0.5 COCCCS(=O)CCO Amb28349796 [0,2,0,0,0,0|0,1,0]=3 5511 B9R0.5 COCCC\C(C)=C\CO Amb27826189 [0,2,0,0,0,0|1,0,1]=4 5512 B9R0.5 COCCNC(C)CCO Amb28246289 [0,2,0,0,0,0|2,0,0]=4 5513 B9R0.5 COCCNC(C)COC Amb9752982 [0,2,0,0,0,0|2,0,0]=4 5514 B9R0.5 COCCOC(=O)CCS Amb27272878 [0,2,0,0,0,0|1,0,1]=4 5515 B9R0.5 COCCSC(C)CCN Amb18792519 [0,2,0,0,0,0|1,1,0]=4 5516 B9R0.5 COC[C@@H](O)CNCCO Amb27945380 [0,2,0,0,0,0|1,0,0]=3 5517 B9R0.5 CSCC(C)CNCCN Amb27478171 [0,2,0,0,0,0|2,0,0]=4 5518 B9R0.5 CSCC(C)CNCCO Amb27638627 [0,2,0,0,0,0|1,0,0]=3 5519 B9R0.5 CSCC(C)COCC#N Amb28322674 [0,2,0,0,0,0|1,0,1]=4 5520 B9R0.5 CSCC(O)CSCCO Amb27989135 [0,2,0,0,0,0|0,1,0]=3 5521 B9R0.5 CSCCCC(O)CCN Amb27974794 [0,2,0,0,0,0|2,0,0]=4 5522 B9R0.5 CSCCCN(C)CCI Amb27764666 [0,2,0,0,0,0|2,0,0]=4 5523 B9R0.5 CSCCSC(C)CCO Amb28456145 [0,2,0,0,0,0|1,1,0]=4 5524 B9R0.5 C\C(=C/CO)CCCCCl Amb27254213 [0,2,0,0,0,0|1,0,1]=4 5525 B9R0.5 C\C(=C/CO)CCCCO Amb27594384 [0,2,0,0,0,0|1,0,1]=4 5526 B9R0.5 C\C=C\C(O)COCCCl Amb27254142 [0,2,0,0,0,0|1,0,1]=4 5527 B9R0.5 C\C=C\CCC(O)CCO Amb28350050 [0,2,0,0,0,0|1,0,1]=4 5528 B9R0.5 NC(CCO)CSCCO Amb27262281 [0,2,0,0,0,0|0,1,0]=3 5529 B9R0.5 NCCC(=O)OCCCO Amb27482412 [0,2,0,0,0,0|1,0,1]=4 5530 B9R0.5 NCCSCC(O)CCN Amb27393782 [0,2,0,0,0,0|1,1,0]=4 5531 B9R0.5 N\C(CCO)=N/OCCO Amb27223157 [0,2,0,0,0,0|1,0,1]=4 5532 B9R0.5 O=C(CCCl)OCCCCl Amb27477838 [0,2,0,0,0,0|2,0,0]=4 5533 B9R0.5 O=C(CCO)OCCCO Amb27652860 [0,2,0,0,0,0|1,0,0]=3 5534 B9R0.5 O=CCCOC(O)CCO Amb27169395 [0,2,0,0,0,0|1,0,1]=4 5535 B9R0.5 OCCC#CC(Br)CCO Amb28197919 [0,2,0,0,0,0|1,0,1]=4 5536 B9R0.8 C=C(CCCC)C(O)CO Amb28188216 [0,2,0,0,0,0|1,0,0]=3 5537 B9R0.8 C=C(CCCC)[C@@H](O)CC Amb28138626 [0,2,0,0,0,0|2,0,0]=4 5538 B9R0.8 C=C(CCCC)[C@H](O)CO Amb27617035 [0,2,0,0,0,0|1,0,0]=3 5539 B9R0.8 C=C(CO)C(O)CCCC Amb27839533 [0,2,0,0,0,0|1,0,1]=4 5540 B9R0.8 CC(CO)C(O)CCCO Amb27593922 [0,2,0,0,0,0|2,0,0]=4 5541 B9R0.8 CCC(=O)C(C)CCCO Amb28314429 [0,2,0,0,0,0|1,0,1]=4 5542 B9R0.8 CCC(C)C(=O)OCCBr Amb26620937 [0,2,0,0,0,0|1,0,1]=4 5543 B9R0.8 CCC(C)C(=O)OCCO Amb25677455 [0,2,0,0,0,0|0,0,1]=3 5544 B9R0.8 CCC(C)C(C)CCCN Amb27408165 [0,2,0,0,0,0|2,0,0]=4 5545 B9R0.8 CCC(C)C(C)NCCF Amb27837850 [0,2,0,0,0,0|2,0,0]=4 5546 B9R0.8 CCC(C)C(C)NCCI Amb27866695 [0,2,0,0,0,0|2,0,0]=4 5547 B9R0.8 CCC(C)C(C)NCCO Amb7809087 [0,2,0,0,0,0|1,0,0]=3 5548 B9R0.8 CCC(C)C(C)SCCN Amb28313467 [0,2,0,0,0,0|1,1,0]=4 5549 B9R0.8 CCC(C)C(C)SCCO Amb28342503 [0,2,0,0,0,0|0,1,0]=3 5550 B9R0.8 CCC(C)C(O)\C=C\CO Amb27196838 [0,2,0,0,0,0|1,0,1]=4 5551 B9R0.8 CCC(Cl)C(Cl)CCCO Amb27758675 [0,2,0,0,0,0|1,0,0]=3 5552 B9R0.8 CCC(N)C(C)SCCO Amb28045310 [0,2,0,0,0,0|0,1,0]=3 5553 B9R0.8 CCC(O)C(C)NCCN Amb28383818 [0,2,0,0,0,0|2,0,0]=4 5554 B9R0.8 CCC(S)C(=O)NCCO Amb27197046 [0,2,0,0,0,0|1,0,1]=4 5555 B9R0.8 CCCCC(=O)C(N)CC Amb28341962 [0,2,0,0,0,0|2,0,0]=4 5556 B9R0.8 CCCCC(=O)[C@H](F)CC Amb28253956 [0,2,0,0,0,0|2,0,0]=4 5557 B9R0.8 CCCCC(C)C(F)CO Amb27261654 [0,2,0,0,0,0|1,0,0]=3 5558 B9R0.8 CCCCC(Cl)C(Cl)CC Amb26948736 [0,2,0,0,0,0|2,0,0]=4 5559 B9R0.8 CCCCC(F)[C@@H](O)CO Amb24122595 [0,2,0,0,0,0|1,0,0]=3 5560 B9R0.8 CCCCC(O)C(=O)CO Amb27434084 [0,2,0,0,0,0|1,0,1]=4 5561 B9R0.8 CCCCC(O)C(C)CC Amb4020074 [0,2,0,0,0,0|2,0,0]=4 5562 B9R0.8 CCCCC(O)C(C)CN Amb26392245 [0,2,0,0,0,0|2,0,0]=4 5563 B9R0.8 CCCCC(O)C(N)CO Amb27862099 [0,2,0,0,0,0|1,0,0]=3 5564 B9R0.8 CCCCC(O)C(O)CO Amb8514775 [0,2,0,0,0,0|1,0,0]=3 5565 B9R0.8 CCCCN(C)C(=O)CO Amb17334237 [0,2,0,0,0,0|1,0,1]=4 5566 B9R0.8 CCCCN(C)C(C)CN Amb5357914 [0,2,0,0,0,0|2,0,0]=4 5567 B9R0.8 CCCCS(=O)C(C)CN Amb27203768 [0,2,0,0,0,0|1,1,0]=4 5568 B9R0.8 CCCC[C@@H](C)[C@@H](O)CC Amb27981905 [0,2,0,0,0,0|2,0,0]=4 5569 B9R0.8 CCCC[C@@H](C)[C@H](O)CC Amb27980692 [0,2,0,0,0,0|2,0,0]=4 5570 B9R0.8 CCCC[C@@H](Cl)[C@H](C)CO Amb27843309 [0,2,0,0,0,0|1,0,0]=3 5571 B9R0.8 CCCC[C@@H](N)[C@@H](C)CC Amb27240864 [0,2,0,0,0,0|2,0,0]=4 5572 B9R0.8 CCCC[C@@H](O)[C@@H](C)CC Amb27839219 [0,2,0,0,0,0|2,0,0]=4 5573 B9R0.8 CCCC[C@@H](O)[C@@H](C)CO Amb28125795 [0,2,0,0,0,0|1,0,0]=3 5574 B9R0.8 CCCC[C@@H](O)[C@@H](N)CO Amb28313946 [0,2,0,0,0,0|1,0,0]=3 5575 B9R0.8 CCCC[C@@H](O)[C@H](C)CO Amb27756413 [0,2,0,0,0,0|1,0,0]=3 5576 B9R0.8 CCCC[C@H](O)[C@@H](C)CO Amb27775544 [0,2,0,0,0,0|1,0,0]=3 5577 B9R0.8 CCCC\C(F)=C(/F)CO Amb28069334 [0,2,0,0,0,0|1,0,1]=4 5578 B9R0.8 CCCNC(=O)[C@@H](N)CO Amb28312910 [0,2,0,0,0,0|2,0,0]=4 5579 B9R0.8 CCCNC(C)C(C)CC Amb6719115 [0,2,0,0,0,0|2,0,0]=4 5580 B9R0.8 CCCOC(=O)C(Br)CC Amb18090817 [0,2,0,0,0,0|1,0,1]=4 5581 B9R0.8 CCCOC(=O)C(Cl)CC Amb27865645 [0,2,0,0,0,0|1,0,1]=4 5582 B9R0.8 CCCOC(=O)C(O)CC Amb28281680 [0,2,0,0,0,0|1,0,1]=4 5583 B9R0.8 CCCOC(=O)[C@@H](N)CO Amb27590544 [0,2,0,0,0,0|2,0,0]=4 5584 B9R0.8 CCCOC(C)C(N)CC Amb8874669 [0,2,0,0,0,0|1,0,0]=3 5585 B9R0.8 CCCO[C@@H](C)C(=O)CC Amb27433171 [0,2,0,0,0,0|1,0,1]=4 5586 B9R0.8 CC[C@@H](N)C(=O)NCCO Amb27273549 [0,2,0,0,0,0|1,0,1]=4 5587 B9R0.8 CC[C@H](N)C(=O)NCCO Amb28041840 [0,2,0,0,0,0|1,0,1]=4 5588 B9R0.8 CNCCN(C)C(C)CO Amb28047696 [0,2,0,0,0,0|2,0,0]=4 5589 B9R0.8 COCCC(C)C(C)CO Amb27163441 [0,2,0,0,0,0|2,0,0]=4 5590 B9R0.8 COCCN(C)C(C)CO Amb27603775 [0,2,0,0,0,0|2,0,0]=4 5591 B9R0.8 COCCN(C)[C@@H](C)CO Amb27451832 [0,2,0,0,0,0|2,0,0]=4 5592 B9R0.8 COCC[C@H](O)[C@H](O)CO Amb20242865 [0,2,0,0,0,0|2,0,0]=4 5593 B9R0.8 CSCCN(C)[C@@H](C)CO Amb27869145 [0,2,0,0,0,0|2,0,0]=4 5594 B9R0.8 CSCCN(C)[C@H](C)CO Amb27162514 [0,2,0,0,0,0|2,0,0]=4 5595 B9R0.8 C[C@@H](CO)N(C)CCCF Amb28316063 [0,2,0,0,0,0|2,0,0]=4 5596 B9R0.8 C[C@@H](CO)N(C)CCCO Amb27484786 [0,2,0,0,0,0|2,0,0]=4 5597 B9R0.8 C[C@H](CO)N(C)CCCF Amb28316093 [0,2,0,0,0,0|2,0,0]=4 5598 B9R0.8 C[C@H](CO)N(C)CCCI Amb27810273 [0,2,0,0,0,0|2,0,0]=4 5599 B9R0.8 N[C@@H](CS)C(=O)OCCO Amb28384548 [0,2,0,0,0,0|1,0,1]=4 5600 B9R0.8 O=C(OCCO)C(Br)CBr Amb28315666 [0,2,0,0,0,0|1,0,1]=4 5601 B9R0.8 OCCCC(O)C(O)CO Amb4017918 [0,2,0,0,0,0|2,0,0]=4 5602 B9R0.8 OCCC[C@H](O)[C@H](O)CO Amb28065159 [0,2,0,0,0,0|2,0,0]=4 5603 B9R0.18 C#CCCC(=O)OCCO Amb27163850 [0,2,0,0,0,0|0,0,2]=4 5604 B9R0.18 C#CCCC(N)CCCC Amb28189655 [0,2,0,0,0,0|2,0,0]=4 5605 B9R0.18 C#CCCC(O)CCCC Amb27606840 [0,2,0,0,0,0|2,0,0]=4 5606 B9R0.18 C#CCCN(C)CCCC Amb27447929 [0,2,0,0,0,0|2,0,0]=4 5607 B9R0.18 C=C(CCCC)CCCC Amb22641581 [0,2,0,0,0,0|2,0,0]=4 5608 B9R0.18 C=C(CCCC)CCCN Amb27168161 [0,2,0,0,0,0|2,0,0]=4 5609 B9R0.18 C=C(CCCC)CCCO Amb28318705 [0,2,0,0,0,0|1,0,0]=3 5610 B9R0.18 C=C(CCCO)CCCO Amb27451061 [0,2,0,0,0,0|1,0,1]=4 5611 B9R0.18 C=CCCC(C)NCCO Amb27600494 [0,2,0,0,0,0|1,0,1]=4 5612 B9R0.18 C=CCOC(O)COCC Amb28044331 [0,2,0,0,0,0|1,0,1]=4 5613 B9R0.18 CC(CCCCl)NCCF Amb27247964 [0,2,0,0,0,0|2,0,0]=4 5614 B9R0.18 CC(CCCN)NCCO Amb27828381 [0,2,0,0,0,0|1,0,0]=3 5615 B9R0.18 CC(OCCCl)OCCCl Amb27392175 [0,2,0,0,0,0|2,0,0]=4 5616 B9R0.18 CC(OCCO)OCCO Amb27869875 [0,2,0,0,0,0|1,0,0]=3 5617 B9R0.18 CC(SCCO)SCCO Amb27652984 [0,2,0,0,0,0|1,1,0]=4 5618 B9R0.18 CCC#CC(C)OCCBr Amb28143864 [0,2,0,0,0,0|1,0,1]=4 5619 B9R0.18 CCCCB(O)CCCC Amb25797237 [0,2,0,0,0,0|2,0,0]=4 5620 B9R0.18 CCCCC(=O)CCCC Amb534166 [0,2,0,0,0,0|2,0,0]=4 5621 B9R0.18 CCCCC(=O)CCCCl Amb26353274 [0,2,0,0,0,0|2,0,0]=4 5622 B9R0.18 CCCCC(=O)CCCN Amb28050428 [0,2,0,0,0,0|2,0,0]=4 5623 B9R0.18 CCCCC(=O)CCCO Amb25146585 [0,2,0,0,0,0|1,0,0]=3 5624 B9R0.18 CCCCC(=O)CCNC Amb27771104 [0,2,0,0,0,0|2,0,0]=4 5625 B9R0.18 CCCCC(=O)COCC Amb26504310 [0,2,0,0,0,0|2,0,0]=4 5626 B9R0.18 CCCCC(=O)OCCBr Amb24709719 [0,2,0,0,0,0|1,0,0]=3 5627 B9R0.18 CCCCC(=O)OCCO Amb27218716 [0,2,0,0,0,0|0,0,0]=2 5628 B9R0.18 CCCCC(C)CCCO Amb28256728 [0,2,0,0,0,0|1,0,0]=3 5629 B9R0.18 CCCCC(C)NCCF Amb27196528 [0,2,0,0,0,0|2,0,0]=4 5630 B9R0.18 CCCCC(C)NCCO Amb9640301 [0,2,0,0,0,0|1,0,0]=3 5631 B9R0.18 CCCCC(C)OCC#N Amb4019617 [0,2,0,0,0,0|1,0,1]=4 5632 B9R0.18 CCCCC(Cl)CCC#N Amb27615071 [0,2,0,0,0,0|2,0,0]=4 5633 B9R0.18 CCCCC(Cl)CCCC Amb26844527 [0,2,0,0,0,0|2,0,0]=4 5634 B9R0.18 CCCCC(Cl)CCCCl Amb28313997 [0,2,0,0,0,0|2,0,0]=4 5635 B9R0.18 CCCCC(Cl)CCCO Amb24482147 [0,2,0,0,0,0|1,0,0]=3 5636 B9R0.18 CCCCC(N)CCC=O Amb33036353 [0,2,0,0,0,0|1,0,1]=4 5637 B9R0.18 CCCCC(N)CCCC Amb22229936 [0,2,0,0,0,0|2,0,0]=4 5638 B9R0.18 CCCCC(N)CCSC Amb27466169 [0,2,0,0,0,0|1,1,0]=4 5639 B9R0.18 CCCCC(N)COCC Amb28138872 [0,2,0,0,0,0|2,0,0]=4 5640 B9R0.18 CCCCC(N)CSCC Amb27966627 [0,2,0,0,0,0|2,0,0]=4 5641 B9R0.18 CCCCC(O)CCC#N Amb27198555 [0,2,0,0,0,0|2,0,0]=4 5642 B9R0.18 CCCCC(O)CCC=O Amb27236595 [0,2,0,0,0,0|1,0,1]=4 5643 B9R0.18 CCCCC(O)CCCF Amb28345334 [0,2,0,0,0,0|2,0,0]=4 5644 B9R0.18 CCCCC(O)CCCO Amb27952639 [0,2,0,0,0,0|1,0,0]=3 5645 B9R0.18 CCCCC(O)CCCS Amb27431295 [0,2,0,0,0,0|1,1,0]=4 5646 B9R0.18 CCCCC(O)CCOC Amb27410357 [0,2,0,0,0,0|1,0,0]=3 5647 B9R0.18 CCCCC(O)\C=C\CO Amb28050649 [0,2,0,0,0,0|1,0,1]=4 5648 B9R0.18 CCCCN(C)CCCC Amb8515459 [0,2,0,0,0,0|2,0,0]=4 5649 B9R0.18 CCCCN(C)CCCCl Amb17334590 [0,2,0,0,0,0|2,0,0]=4 5650 B9R0.18 CCCCN(C)CCCN Amb1108729 [0,2,0,0,0,0|2,0,0]=4 5651 B9R0.18 CCCCN(C)CCNN Amb27444813 [0,2,0,0,0,0|2,0,0]=4 5652 B9R0.18 CCCCN(N)CCCC Amb836806 [0,2,0,0,0,0|2,0,0]=4 5653 B9R0.18 CCCCN(O)CCCC Amb28062392 [0,2,0,0,0,0|2,0,0]=4 5654 B9R0.18 CCCCP(Cl)CCCC Amb22353630 [0,2,0,0,0,0|2,0,0]=4 5655 B9R0.18 CCCCS(=O)CCC#N Amb27839078 [0,2,0,0,0,0|1,1,0]=4 5656 B9R0.18 CCCCS(=O)CCON Amb27855618 [0,2,0,0,0,0|0,1,0]=3 5657 B9R0.18 CCCC[C@@H](C)C#CCO Amb28345058 [0,2,0,0,0,0|1,0,1]=4 5658 B9R0.18 CCCC[C@@H](C)CCCO Amb27598602 [0,2,0,0,0,0|1,0,0]=3 5659 B9R0.18 CCCC[C@@H](C)\C=C\CO Amb28350350 [0,2,0,0,0,0|1,0,1]=4 5660 B9R0.18 CCCC[C@@H](O)CCC#N Amb27456652 [0,2,0,0,0,0|2,0,0]=4 5661 B9R0.18 CCCC[C@H](C)C#CCO Amb27969794 [0,2,0,0,0,0|1,0,1]=4 5662 B9R0.18 CCCC[C@H](C)CCCBr Amb27646432 [0,2,0,0,0,0|2,0,0]=4 5663 B9R0.18 CCCC[C@H](C)CCCO Amb27869929 [0,2,0,0,0,0|1,0,0]=3 5664 B9R0.18 CCCC[C@H](N)CNCC Amb27828439 [0,2,0,0,0,0|2,0,0]=4 5665 B9R0.18 CCCC[C@H](O)CCC#N Amb27605391 [0,2,0,0,0,0|2,0,0]=4 5666 B9R0.18 CCCC[C@H](O)\C=C\CO Amb27213889 [0,2,0,0,0,0|1,0,1]=4 5667 B9R0.18 CCCC[NH+](C)CCCC Amb33512914 [0,2,0,0,0,0|2,0,0]=4 5668 B9R0.18 CCCC[PH-](=O)CCCC Amb27230858 [0,2,0,0,0,0|2,0,0]=4 5669 B9R0.18 CCCC[PH](=O)CCCC Amb4297292 [0,2,0,0,0,0|2,0,0]=4 5670 B9R0.18 CCCC[Sn](=O)CCCC Amb8513797 [0,2,0,0,0,0|2,0,0]=4 5671 B9R0.18 CCCC\C(C)=C\CCBr Amb27231454 [0,2,0,0,0,0|2,0,0]=4 5672 B9R0.18 CCCC\C(C)=C\CCCl Amb28064307 [0,2,0,0,0,0|2,0,0]=4 5673 B9R0.18 CCCC\C(C)=C\CCN Amb27864878 [0,2,0,0,0,0|2,0,0]=4 5674 B9R0.18 CCCNC(=O)CCOC Amb24480776 [0,2,0,0,0,0|2,0,0]=4 5675 B9R0.18 CCCNC(=O)OCCC Amb24460257 [0,2,0,0,0,0|1,0,1]=4 5676 B9R0.18 CCCNC(=O)OCCO Amb27593341 [0,2,0,0,0,0|0,0,1]=3 5677 B9R0.18 CCCNC(=S)OCCC Amb28068732 [0,2,0,0,0,0|1,0,1]=4 5678 B9R0.18 CCCNC(C)CCOC Amb27768598 [0,2,0,0,0,0|2,0,0]=4 5679 B9R0.18 CCCNC(C)CNCC Amb28281328 [0,2,0,0,0,0|2,0,0]=4 5680 B9R0.18 CCCOC(=N)OCCC Amb24698422 [0,2,0,0,0,0|1,0,1]=4 5681 B9R0.18 CCCOC(=O)CCCBr Amb28287770 [0,2,0,0,0,0|1,0,1]=4 5682 B9R0.18 CCCOC(=O)CCCS Amb27466699 [0,2,0,0,0,0|1,0,1]=4 5683 B9R0.18 CCCOC(=O)CCNC Amb28074901 [0,2,0,0,0,0|1,0,1]=4 5684 B9R0.18 CCCOC(=O)COCC Amb9243004 [0,2,0,0,0,0|1,0,1]=4 5685 B9R0.18 CCCOC(=O)NCCO Amb28043117 [0,2,0,0,0,0|1,0,1]=4 5686 B9R0.18 CCCOC(=O)OCCC Amb22336422 [0,2,0,0,0,0|1,0,1]=4 5687 B9R0.18 CCCOC(C)CNCC Amb27644225 [0,2,0,0,0,0|1,0,0]=3 5688 B9R0.18 CCCOC(C)OCCC Amb22729236 [0,2,0,0,0,0|1,0,0]=3 5689 B9R0.18 CCCOC(C)OCCCl Amb27862425 [0,2,0,0,0,0|1,0,0]=3 5690 B9R0.18 CCCOP(O)OCCC Amb10606107 [0,2,0,0,0,0|2,0,0]=4 5691 B9R0.18 CCCOS(=O)OCCC Amb10807470 [0,2,0,0,0,0|2,0,0]=4 5692 B9R0.18 CCCO[PH](=O)OCCO Amb27980612 [0,2,0,0,0,0|1,0,0]=3 5693 B9R0.18 CCNCC(C)CCCBr Amb28074983 [0,2,0,0,0,0|2,0,0]=4 5694 B9R0.18 CCNCC(C)CCCO Amb27255822 [0,2,0,0,0,0|1,0,0]=3 5695 B9R0.18 CCNCC(O)CCCO Amb25952361 [0,2,0,0,0,0|1,0,0]=3 5696 B9R0.18 CCOCC(=O)OCCBr Amb33050548 [0,2,0,0,0,0|1,0,1]=4 5697 B9R0.18 CCOCC(=O)OCCO Amb27839369 [0,2,0,0,0,0|0,0,1]=3 5698 B9R0.18 CCOCC(Br)CCCO Amb27617162 [0,2,0,0,0,0|1,0,0]=3 5699 B9R0.18 CCOCC(C)OCCCl Amb28367652 [0,2,0,0,0,0|1,0,0]=3 5700 B9R0.18 CCOCC(C)OCCN Amb27983379 [0,2,0,0,0,0|1,0,0]=3 5701 B9R0.18 CCOCC(C)OCCO Amb27600580 [0,2,0,0,0,0|0,0,0]=2 5702 B9R0.18 CCOCC(N)CCOC Amb28204579 [0,2,0,0,0,0|2,0,0]=4 5703 B9R0.18 CCOCC(O)C#CCO Amb27839334 [0,2,0,0,0,0|1,0,1]=4 5704 B9R0.18 CCOCC(O)CCCBr Amb27481557 [0,2,0,0,0,0|2,0,0]=4 5705 B9R0.18 CCOCC(O)CCOC Amb27465405 [0,2,0,0,0,0|2,0,0]=4 5706 B9R0.18 CN(CCCN)CCCO Amb26327590 [0,2,0,0,0,0|2,0,0]=4 5707 B9R0.18 CNCCN(C)CCCO Amb27471059 [0,2,0,0,0,0|2,0,0]=4 5708 B9R0.18 CNCCN(C)CCOC Amb8957416 [0,2,0,0,0,0|2,0,0]=4 5709 B9R0.18 COCCC(=O)CCOC Amb32662019 [0,2,0,0,0,0|2,0,0]=4 5710 B9R0.18 COCCC(=O)NCCO Amb27604690 [0,2,0,0,0,0|1,0,1]=4 5711 B9R0.18 COCCC(=O)OCCBr Amb33050387 [0,2,0,0,0,0|1,0,1]=4 5712 B9R0.18 COCCC(=O)OCCO Amb25845430 [0,2,0,0,0,0|0,0,1]=3 5713 B9R0.18 COCCC(Br)CCCO Amb27753938 [0,2,0,0,0,0|1,0,0]=3 5714 B9R0.18 COCCC(C)CCCCl Amb27617182 [0,2,0,0,0,0|2,0,0]=4 5715 B9R0.18 COCCC(C)CCCN Amb27436126 [0,2,0,0,0,0|2,0,0]=4 5716 B9R0.18 COCCC(C)CCCO Amb27663082 [0,2,0,0,0,0|1,0,0]=3 5717 B9R0.18 COCCC(C)SCCN Amb27617183 [0,2,0,0,0,0|1,1,0]=4 5718 B9R0.18 COCCN(C)CCCCl Amb17334658 [0,2,0,0,0,0|2,0,0]=4 5719 B9R0.18 COCCN(C)CCCF Amb28045632 [0,2,0,0,0,0|2,0,0]=4 5720 B9R0.18 COCCN(C)CCCN Amb6670591 [0,2,0,0,0,0|2,0,0]=4 5721 B9R0.18 COCCN(C)CCCO Amb17334275 [0,2,0,0,0,0|2,0,0]=4 5722 B9R0.18 COCCN(C)CCOC Amb24120427 [0,2,0,0,0,0|2,0,0]=4 5723 B9R0.18 COCCN(N)CCOC Amb836845 [0,2,0,0,0,0|2,0,0]=4 5724 B9R0.18 COCCN(O)CCOC Amb26865917 [0,2,0,0,0,0|2,0,0]=4 5725 B9R0.18 COCCS(=O)CCON Amb27212393 [0,2,0,0,0,0|1,1,0]=4 5726 B9R0.18 COCC[C@H](C)CCCBr Amb28325897 [0,2,0,0,0,0|2,0,0]=4 5727 B9R0.18 COCC[C@H](C)CCCO Amb27216439 [0,2,0,0,0,0|1,0,0]=3 5728 B9R0.18 CP(CCCO)CCCO Amb28050734 [0,2,0,0,0,0|2,0,0]=4 5729 B9R0.18 CP(OCCO)OCCO Amb27652888 [0,2,0,0,0,0|2,0,0]=4 5730 B9R0.18 CSCCC(C)NCCF Amb27669274 [0,2,0,0,0,0|2,0,0]=4 5731 B9R0.18 CSCCC(C)NCCO Amb27614939 [0,2,0,0,0,0|1,0,0]=3 5732 B9R0.18 CSCCN(C)CCON Amb27859241 [0,2,0,0,0,0|2,0,0]=4 5733 B9R0.18 NCCCC(N)CCCN Amb26548774 [0,2,0,0,0,0|2,0,0]=4 5734 B9R0.18 NCCOC(=O)CCCO Amb27811652 [0,2,0,0,0,0|1,0,1]=4 5735 B9R0.18 O=C(CCCO)NCCO Amb25147346 [0,2,0,0,0,0|1,0,1]=4 5736 B9R0.18 O=C(CCCS)NCCO Amb27872364 [0,2,0,0,0,0|1,0,1]=4 5737 B9R0.18 O=C(NCCO)OCCO Amb24661614 [0,2,0,0,0,0|1,0,1]=4 5738 B9R0.18 O=[PH](OCCO)OCCO Amb28454339 [0,2,0,0,0,0|2,0,0]=4 5739 B9R0.18 OCCCC(O)CCCCl Amb27873417 [0,2,0,0,0,0|1,0,0]=3 5740 B9R0.18 OCCC[C@@H](O)CCCCl Amb27391692 [0,2,0,0,0,0|1,0,0]=3 5741 B9R0.18 OCCC[C@H](O)CCCCl Amb27879294 [0,2,0,0,0,0|1,0,0]=3 5742 B9R0.18 OC\C=C\[C@@H](O)CCCO Amb28064019 [0,2,0,0,0,0|1,0,1]=4 5743 B9R0.34 C#CC(C)OC(Cl)CCC Amb27232957 [0,2,0,0,0,0|1,0,1]=4 5744 B9R0.34 C=C(CC)CN(C)CCO Amb27952083 [0,2,0,0,0,0|1,0,1]=4 5745 B9R0.34 CC(CN)CN(C)CCO Amb5751516 [0,2,0,0,0,0|2,0,0]=4 5746 B9R0.34 CC(CO)CC(C)CCO Amb27616375 [0,2,0,0,0,0|2,0,0]=4 5747 B9R0.34 CC(CO)NC(C)CCO Amb27795976 [0,2,0,0,0,0|2,0,0]=4 5748 B9R0.34 CCC(=O)CN(C)CCO Amb27776420 [0,2,0,0,0,0|1,0,1]=4 5749 B9R0.34 CCC(C)CC(N)CCO Amb28399464 [0,2,0,0,0,0|1,0,0]=3 5750 B9R0.34 CCC(C)CC(O)CCN Amb25127021 [0,2,0,0,0,0|2,0,0]=4 5751 B9R0.34 CCC(C)CN(C)CCI Amb27605141 [0,2,0,0,0,0|2,0,0]=4 5752 B9R0.34 CCC(C)CN(C)CCN Amb33204473 [0,2,0,0,0,0|2,0,0]=4 5753 B9R0.34 CCC(C)CN(C)CCN Amb8926212 [0,2,0,0,0,0|2,0,0]=4 5754 B9R0.34 CCC(C)CN(C)CCS Amb28044717 [0,2,0,0,0,0|1,1,0]=4 5755 B9R0.34 CCC(C)CS(=O)CCO Amb27594392 [0,2,0,0,0,0|0,1,0]=3 5756 B9R0.34 CCC(C)NC(=O)CCO Amb17334240 [0,2,0,0,0,0|2,0,0]=4 5757 B9R0.34 CCC(N)CC(O)CCO Amb27866271 [0,2,0,0,0,0|1,0,0]=3 5758 B9R0.34 CCC(N)CS(=O)CCF Amb27401432 [0,2,0,0,0,0|1,1,0]=4 5759 B9R0.34 CCC(N)CS(=O)CCO Amb28322242 [0,2,0,0,0,0|0,1,0]=3 5760 B9R0.34 CCC(O)CN(C)CCO Amb27471689 [0,2,0,0,0,0|1,0,0]=3 5761 B9R0.34 CCCC(=O)CC(C)CO Amb28381269 [0,2,0,0,0,0|1,0,1]=4 5762 B9R0.34 CCCC(=O)CC(N)CC Amb27247540 [0,2,0,0,0,0|2,0,0]=4 5763 B9R0.34 CCCC(=O)C[C@@H](C)CC Amb28351517 [0,2,0,0,0,0|2,0,0]=4 5764 B9R0.34 CCCC(=O)C[C@H](O)CC Amb27434206 [0,2,0,0,0,0|2,0,0]=4 5765 B9R0.34 CCCC(=O)NC(C)CO Amb9275926 [0,2,0,0,0,0|1,0,1]=4 5766 B9R0.34 CCCC(=O)N[C@@H](C)CO Amb26490619 [0,2,0,0,0,0|1,0,1]=4 5767 B9R0.34 CCCC(=O)OC(C)CC Amb22732903 [0,2,0,0,0,0|1,0,1]=4 5768 B9R0.34 CCCC(=O)OC(C)CCl Amb27784873 [0,2,0,0,0,0|1,0,1]=4 5769 B9R0.34 CCCC(=O)OC(C)CO Amb28206439 [0,2,0,0,0,0|0,0,1]=3 5770 B9R0.34 CCCC(Br)CC(C)CC Amb28320357 [0,2,0,0,0,0|2,0,0]=4 5771 B9R0.34 CCCC(C)CC(C)CBr Amb26876493 [0,2,0,0,0,0|2,0,0]=4 5772 B9R0.34 CCCC(C)CC(C)CCl Amb25853124 [0,2,0,0,0,0|2,0,0]=4 5773 B9R0.34 CCCC(C)CC(C)CO Amb27869680 [0,2,0,0,0,0|1,0,0]=3 5774 B9R0.34 CCCC(C)CC(N)CO Amb27770369 [0,2,0,0,0,0|1,0,0]=3 5775 B9R0.34 CCCC(C)CC(O)CC Amb27946318 [0,2,0,0,0,0|2,0,0]=4 5776 B9R0.34 CCCC(C)CC(O)CN Amb24718688 [0,2,0,0,0,0|2,0,0]=4 5777 B9R0.34 CCCC(C)N[C@@H](C)CO Amb27983372 [0,2,0,0,0,0|1,0,0]=3 5778 B9R0.34 CCCC(C)OC(=O)CCl Amb27234645 [0,2,0,0,0,0|1,0,1]=4 5779 B9R0.34 CCCC(C)OC(=O)CN Amb28422290 [0,2,0,0,0,0|1,0,1]=4 5780 B9R0.34 CCCC(C)\C=C(\C)CO Amb27171160 [0,2,0,0,0,0|1,0,1]=4 5781 B9R0.34 CCCC(Cl)CC(C)CC Amb27779055 [0,2,0,0,0,0|2,0,0]=4 5782 B9R0.34 CCCC(Cl)OC(=O)CCl Amb27983612 [0,2,0,0,0,0|1,0,1]=4 5783 B9R0.34 CCCC(N)CC(C)CC Amb27667483 [0,2,0,0,0,0|2,0,0]=4 5784 B9R0.34 CCCC(O)CC(O)CC Amb9134757 [0,2,0,0,0,0|2,0,0]=4 5785 B9R0.34 CCCC(O)C[C@@H](C)CC Amb27470864 [0,2,0,0,0,0|2,0,0]=4 5786 B9R0.34 CCCN(C)CC(F)CC Amb27456100 [0,2,0,0,0,0|2,0,0]=4 5787 B9R0.34 CCCN(C)CC(N)CC Amb9514565 [0,2,0,0,0,0|2,0,0]=4 5788 B9R0.34 CCC[C@@H](C)C[C@@H](C)CO Amb26920680 [0,2,0,0,0,0|1,0,0]=3 5789 B9R0.34 CCC[C@@H](C)C[C@H](C)CO Amb26632583 [0,2,0,0,0,0|1,0,0]=3 5790 B9R0.34 CCNC(=O)OC(C)CO Amb28252827 [0,2,0,0,0,0|1,0,1]=4 5791 B9R0.34 CCOC(=O)OC(C)CO Amb28190260 [0,2,0,0,0,0|1,0,1]=4 5792 B9R0.34 CCOC(C)CC(N)CO Amb33425390 [0,2,0,0,0,0|2,0,0]=4 5793 B9R0.34 CCOC(C)OC(C)CO Amb28436929 [0,2,0,0,0,0|1,0,0]=3 5794 B9R0.34 CCOC(C)O[C@H](C)CO Amb22363059 [0,2,0,0,0,0|1,0,0]=3 5795 B9R0.34 CC[C@H](C)CC(C)CCBr Amb27403512 [0,2,0,0,0,0|2,0,0]=4 5796 B9R0.34 CC[C@H](C)C[C@@H](C)CCO Amb27197151 [0,2,0,0,0,0|1,0,0]=3 5797 B9R0.34 CN(CCO)CC(O)CO Amb27162994 [0,2,0,0,0,0|2,0,0]=4 5798 B9R0.34 CNCC(C)CC(C)CO Amb32759415 [0,2,0,0,0,0|2,0,0]=4 5799 B9R0.34 CNCC(C)OC(C)CO Amb27465623 [0,2,0,0,0,0|1,0,0]=3 5800 B9R0.34 COCC(C)CC(C)CO Amb27792548 [0,2,0,0,0,0|2,0,0]=4 5801 B9R0.34 COCC(C)NC(C)CO Amb25768870 [0,2,0,0,0,0|2,0,0]=4 5802 B9R0.34 COCC(C)OC(C)CN Amb27971438 [0,2,0,0,0,0|2,0,0]=4 5803 B9R0.34 COCC(C)OC(C)CO Amb26959238 [0,2,0,0,0,0|1,0,0]=3 5804 B9R0.34 COCC(C)SC(C)CO Amb28347863 [0,2,0,0,0,0|1,1,0]=4 5805 B9R0.34 CSCC(C)NC(C)CO Amb27968416 [0,2,0,0,0,0|2,0,0]=4 5806 B9R0.35 C=C(CCC)C(O)CCC Amb27598582 [0,2,0,0,0,0|2,0,0]=4 5807 B9R0.35 C=C(CCN)C(C)CCC Amb33320823 [0,2,0,0,0,0|2,0,0]=4 5808 B9R0.35 CCCC(=O)C(C)CCC Amb22230010 [0,2,0,0,0,0|2,0,0]=4 5809 B9R0.35 CCCC(=O)C(Cl)CCC Amb28384164 [0,2,0,0,0,0|2,0,0]=4 5810 B9R0.35 CCCC(=O)C(O)CCC Amb2721183 [0,2,0,0,0,0|2,0,0]=4 5811 B9R0.35 CCCC(=O)[C@@H](O)CCC Amb27613184 [0,2,0,0,0,0|2,0,0]=4 5812 B9R0.35 CCCC(C)C(=O)CCN Amb28290008 [0,2,0,0,0,0|2,0,0]=4 5813 B9R0.35 CCCC(C)C(Br)CCC Amb28049951 [0,2,0,0,0,0|2,0,0]=4 5814 B9R0.35 CCCC(C)C(C)CCC Amb10069377 [0,2,0,0,0,0|2,0,0]=4 5815 B9R0.35 CCCC(C)C(C)CCN Amb25070997 [0,2,0,0,0,0|2,0,0]=4 5816 B9R0.35 CCCC(C)C(F)CCN Amb27436975 [0,2,0,0,0,0|2,0,0]=4 5817 B9R0.35 CCCC(C)C(O)CCC Amb22229849 [0,2,0,0,0,0|2,0,0]=4 5818 B9R0.35 CCCC(C)C(O)CCN Amb26417455 [0,2,0,0,0,0|2,0,0]=4 5819 B9R0.35 CCCC(C)N(C)CCI Amb27945371 [0,2,0,0,0,0|2,0,0]=4 5820 B9R0.35 CCCC(C)N(C)CCN Amb9434718 [0,2,0,0,0,0|2,0,0]=4 5821 B9R0.35 CCCC(C)N(C)CCS Amb28049589 [0,2,0,0,0,0|1,1,0]=4 5822 B9R0.35 CCCC(C)[C@@H](O)CCN Amb33320627 [0,2,0,0,0,0|2,0,0]=4 5823 B9R0.35 CCCC(C)[C@H](O)CCN Amb33418205 [0,2,0,0,0,0|2,0,0]=4 5824 B9R0.35 CCCC(F)C(Br)CCC Amb27855476 [0,2,0,0,0,0|2,0,0]=4 5825 B9R0.35 CCCC(O)C(Cl)CCC Amb27454832 [0,2,0,0,0,0|2,0,0]=4 5826 B9R0.35 CCC[C@@H](C)[C@@H](O)CCO Amb27790262 [0,2,0,0,0,0|1,0,0]=3 5827 B9R0.35 CCC[C@@H](C)[C@H](O)CCC Amb28050718 [0,2,0,0,0,0|2,0,0]=4 5828 B9R0.35 CCC[C@@H](Cl)[C@H](Cl)CCC Amb28365860 [0,2,0,0,0,0|2,0,0]=4 5829 B9R0.35 CCC[C@H](Cl)[C@H](Cl)CCC Amb27228458 [0,2,0,0,0,0|2,0,0]=4 5830 B9R0.35 CCC[C@H](N)[C@H](N)CCC Amb27617082 [0,2,0,0,0,0|2,0,0]=4 5831 B9R0.35 CCC[C@H](O)[C@H](Br)CCC Amb27439075 [0,2,0,0,0,0|2,0,0]=4 5832 B9R0.35 CCC[C@H](O)[C@H](O)CCC Amb28428987 [0,2,0,0,0,0|2,0,0]=4 5833 B9R0.35 CCOC(C)C(N)CCO Amb33425728 [0,2,0,0,0,0|2,0,0]=4 5834 B9R0.35 CSCC(C)N(C)CCO Amb27172063 [0,2,0,0,0,0|2,0,0]=4 5835 B9R0.40 C#CC(CCC)NCCC Amb27770399 [0,2,0,0,0,0|2,0,0]=4 5836 B9R0.40 C#CC(CCC)OCCO Amb27980613 [0,2,0,0,0,0|0,0,0]=2 5837 B9R0.40 C=C=C(CCN)CCCC Amb27459158 [0,2,0,0,0,0|2,0,0]=4 5838 B9R0.40 C=CC(CCC)OCOC Amb28050417 [0,2,0,0,0,0|2,0,0]=4 5839 B9R0.40 C=CC(CCCO)COC Amb27424919 [0,2,0,0,0,0|2,0,0]=4 5840 B9R0.40 C=CCOC(C=O)CCC Amb27409278 [0,2,0,0,0,0|1,0,1]=4 5841 B9R0.40 CCC(CNC)OCCO Amb27407256 [0,2,0,0,0,0|1,0,0]=3 5842 B9R0.40 CCC(CSC)NCCO Amb27404113 [0,2,0,0,0,0|2,0,0]=4 5843 B9R0.40 CCCC(C#N)OCCCl Amb27257292 [0,2,0,0,0,0|1,0,0]=3 5844 B9R0.40 CCCC(C#N)OCCO Amb27955065 [0,2,0,0,0,0|0,0,0]=2 5845 B9R0.40 CCCC(C#N)SCCCl Amb27873416 [0,2,0,0,0,0|1,1,0]=4 5846 B9R0.40 CCCC(C#N)SCCO Amb28400841 [0,2,0,0,0,0|0,1,0]=3 5847 B9R0.40 CCCC(CC)NCCF Amb27479995 [0,2,0,0,0,0|2,0,0]=4 5848 B9R0.40 CCCC(CC)SCCF Amb27775287 [0,2,0,0,0,0|1,1,0]=4 5849 B9R0.40 CCCC(CCCCl)NN Amb28208512 [0,2,0,0,0,0|2,0,0]=4 5850 B9R0.40 CCCC(CN)NCCO Amb27170330 [0,2,0,0,0,0|1,0,0]=3 5851 B9R0.40 CCCC(CN)OCCO Amb25769435 [0,2,0,0,0,0|0,0,0]=2 5852 B9R0.40 CCCC(CO)CCCO Amb27424905 [0,2,0,0,0,0|1,0,0]=3 5853 B9R0.40 CCCCC(C=O)CCC Amb27237029 [0,2,0,0,0,0|2,0,0]=4 5854 B9R0.40 CCCCC(CBr)CCC Amb26369676 [0,2,0,0,0,0|2,0,0]=4 5855 B9R0.40 CCCCC(CC)CCC Amb25335776 [0,2,0,0,0,0|2,0,0]=4 5856 B9R0.40 CCCCC(CC)CCN Amb28430735 [0,2,0,0,0,0|2,0,0]=4 5857 B9R0.40 CCCCC(CC)CCO Amb28293407 [0,2,0,0,0,0|1,0,0]=3 5858 B9R0.40 CCCCC(CCC)ON Amb28292987 [0,2,0,0,0,0|2,0,0]=4 5859 B9R0.40 CCCCC(CCCl)OC Amb28364152 [0,2,0,0,0,0|2,0,0]=4 5860 B9R0.40 CCCCC(CCl)CCC Amb25206828 [0,2,0,0,0,0|2,0,0]=4 5861 B9R0.40 CCCCC(CN)CCC Amb20632050 [0,2,0,0,0,0|2,0,0]=4 5862 B9R0.40 CCCCC(CO)CCC Amb26011965 [0,2,0,0,0,0|2,0,0]=4 5863 B9R0.40 CCCCC(CO)CCO Amb27810571 [0,2,0,0,0,0|1,0,0]=3 5864 B9R0.40 CCCCN(C#N)CCO Amb27145778 [0,2,0,0,0,0|1,0,0]=3 5865 B9R0.40 CCCCN(C=O)CCO Amb26609531 [0,2,0,0,0,0|1,0,0]=3 5866 B9R0.40 CCCCN(CC)CCI Amb27455843 [0,2,0,0,0,0|2,0,0]=4 5867 B9R0.40 CCCCN(CC)CCN Amb6247703 [0,2,0,0,0,0|2,0,0]=4 5868 B9R0.40 CCCCN(CCC)N=O Amb26462487 [0,2,0,0,0,0|2,0,0]=4 5869 B9R0.40 CCCCN(CO)CCO Amb27829883 [0,2,0,0,0,0|1,0,0]=3 5870 B9R0.40 CCCC[C@@H](CC)CCO Amb27829957 [0,2,0,0,0,0|1,0,0]=3 5871 B9R0.40 CCCC[C@@H](CO)CCO Amb27665485 [0,2,0,0,0,0|1,0,0]=3 5872 B9R0.40 CCCC\C(=C\CO)CO Amb27761569 [0,2,0,0,0,0|1,0,1]=4 5873 B9R0.40 CCCNC(C#N)CCC Amb9205143 [0,2,0,0,0,0|2,0,0]=4 5874 B9R0.40 CCCNC(CC)CCC Amb28064267 [0,2,0,0,0,0|2,0,0]=4 5875 B9R0.40 CCCN[C@H](CO)CCC Amb27195642 [0,2,0,0,0,0|2,0,0]=4 5876 B9R0.40 CCCOC(CC)CNC Amb27963423 [0,2,0,0,0,0|2,0,0]=4 5877 B9R0.40 CCCOC(CCl)COC Amb28058310 [0,2,0,0,0,0|2,0,0]=4 5878 B9R0.40 CCC\C=C(\CO)CCO Amb27471088 [0,2,0,0,0,0|1,0,1]=4 5879 B9R0.40 CCN(CCO)CCCBr Amb28203274 [0,2,0,0,0,0|2,0,0]=4 5880 B9R0.40 CCN(CCO)CCCCl Amb18788422 [0,2,0,0,0,0|2,0,0]=4 5881 B9R0.40 CCN(CCO)CCCF Amb27395029 [0,2,0,0,0,0|2,0,0]=4 5882 B9R0.40 CCN(CCO)CCCN Amb8830059 [0,2,0,0,0,0|2,0,0]=4 5883 B9R0.40 CCNC(CO)CCCO Amb27838837 [0,2,0,0,0,0|2,0,0]=4 5884 B9R0.40 CCNCC(CC)CCO Amb27837793 [0,2,0,0,0,0|2,0,0]=4 5885 B9R0.40 CCOC(C=O)CCCO Amb28050007 [0,2,0,0,0,0|2,0,0]=4 5886 B9R0.40 CCOC(CCl)OCCO Amb28207534 [0,2,0,0,0,0|1,0,0]=3 5887 B9R0.40 CCSCC(CCO)NC Amb28141426 [0,2,0,0,0,0|2,0,0]=4 5888 B9R0.40 COCC(C#N)NCCO Amb27192501 [0,2,0,0,0,0|2,0,0]=4 5889 B9R0.40 COCC(C#N)OCCO Amb27826580 [0,2,0,0,0,0|1,0,0]=3 5890 B9R0.40 COCC(C=O)OCCO Amb27760652 [0,2,0,0,0,0|1,0,0]=3 5891 B9R0.40 COCC(CN)OCCO Amb28293505 [0,2,0,0,0,0|1,0,0]=3 5892 B9R0.40 COCCN(C#N)CCO Amb27272622 [0,2,0,0,0,0|2,0,0]=4 5893 B9R0.40 COCCN(C=O)CCO Amb27607421 [0,2,0,0,0,0|2,0,0]=4 5894 B9R0.40 COCCN(CCO)OC Amb27834824 [0,2,0,0,0,0|2,0,0]=4 5895 B9R0.40 CON(CCO)CCCI Amb27456052 [0,2,0,0,0,0|2,0,0]=4 5896 B9R0.40 CON(CCO)CCCO Amb27487016 [0,2,0,0,0,0|2,0,0]=4 5897 B9R0.40 C\C=C(/CCO)CCCC Amb27839280 [0,2,0,0,0,0|1,0,0]=3 5898 B9R0.40 N#CC(CCO)CCCCl Amb28066683 [0,2,0,0,0,0|2,0,0]=4 5899 B9R0.40 N#C[C@@H](CCO)OCCO Amb27197513 [0,2,0,0,0,0|1,0,0]=3 5900 B9R0.40 OCCC[C@@H](CO)CCO Amb28460677 [0,2,0,0,0,0|2,0,0]=4 5901 B9R0.40 OCCO[C@@H](CO)CCO Amb28350168 [0,2,0,0,0,0|1,0,0]=3 5902 B9R0.40 OCCO[C@H](CO)CCO Amb27953726 [0,2,0,0,0,0|1,0,0]=3 5903 B9R0.48 CC(=O)CC[C@@H](C)CCO Amb27944575 [0,2,0,0,0,0|1,0,1]=4 5904 B9R0.48 CC(C)CCC(F)CCN Amb27436790 [0,2,0,0,0,0|2,0,0]=4 5905 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|2,0,0]=4 5906 B9R0.48 CC(C)CCN(C)CCF Amb27589441 [0,2,0,0,0,0|2,0,0]=4 5907 B9R0.48 CC(C)CCN(C)CCS Amb28065039 [0,2,0,0,0,0|1,1,0]=4 5908 B9R0.48 CC(C)CCS(=O)CCN Amb27263412 [0,2,0,0,0,0|1,1,0]=4 5909 B9R0.48 CC(C)CNC(=N)CCO Amb28401358 [0,2,0,0,0,0|2,0,0]=4 5910 B9R0.48 CC(C)CNC(=O)CCO Amb17334239 [0,2,0,0,0,0|2,0,0]=4 5911 B9R0.48 CC(C)CN[C@H](C)CCO Amb27802244 [0,2,0,0,0,0|2,0,0]=4 5912 B9R0.48 CC(C)OCC(N)CCO Amb32946597 [0,2,0,0,0,0|2,0,0]=4 5913 B9R0.48 CC(CCO)CCN(C)C Amb27839328 [0,2,0,0,0,0|2,0,0]=4 5914 B9R0.48 CC(O)CCN(C)CCN Amb25876545 [0,2,0,0,0,0|2,0,0]=4 5915 B9R0.48 CC(O)CCN(C)CCN Amb33313512 [0,2,0,0,0,0|2,0,0]=4 5916 B9R0.48 CCCC(=O)CCC(C)C Amb9031590 [0,2,0,0,0,0|2,0,0]=4 5917 B9R0.48 CCCC(=O)CCC(C)N Amb27866591 [0,2,0,0,0,0|2,0,0]=4 5918 B9R0.48 CCCC(=O)NCC(C)O Amb9275481 [0,2,0,0,0,0|1,0,1]=4 5919 B9R0.48 CCCC(=O)OCC(=O)O Amb27655588 [0,2,0,0,0,0|0,0,2]=4 5920 B9R0.48 CCCC(=O)OCC(C)Br Amb25887822 [0,2,0,0,0,0|1,0,1]=4 5921 B9R0.48 CCCC(=O)OCC(C)C Amb4017886 [0,2,0,0,0,0|1,0,1]=4 5922 B9R0.48 CCCC(=O)OCC(C)O Amb26603876 [0,2,0,0,0,0|0,0,1]=3 5923 B9R0.48 CCCC(=O)OCC(Cl)Cl Amb27656883 [0,2,0,0,0,0|1,0,1]=4 5924 B9R0.48 CCCC(=O)OCC(F)F Amb22008230 [0,2,0,0,0,0|1,0,1]=4 5925 B9R0.48 CCCC(Br)CCC(C)C Amb28063055 [0,2,0,0,0,0|2,0,0]=4 5926 B9R0.48 CCCC(C)CCB(O)O Amb25104756 [0,2,0,0,0,0|2,0,0]=4 5927 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,2,0,0,0,0|1,0,1]=4 5928 B9R0.48 CCCC(C)CCC(C)N Amb25775537 [0,2,0,0,0,0|2,0,0]=4 5929 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,2,0,0,0,0|1,0,0]=3 5930 B9R0.48 CCCC(C)CC[C@@H](C)N Amb33223658 [0,2,0,0,0,0|2,0,0]=4 5931 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,2,0,0,0,0|1,0,0]=3 5932 B9R0.48 CCCC(C)CC[C@H](C)N Amb33321143 [0,2,0,0,0,0|2,0,0]=4 5933 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,2,0,0,0,0|1,0,0]=3 5934 B9R0.48 CCCC(C)NC[C@H](C)O Amb27442940 [0,2,0,0,0,0|1,0,0]=3 5935 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [0,2,0,0,0,0|0,0,1]=3 5936 B9R0.48 CCCC(C)OCC(C)=O Amb27444940 [0,2,0,0,0,0|0,0,2]=4 5937 B9R0.48 CCCC(C)OCC(C)N Amb28077537 [0,2,0,0,0,0|1,0,0]=3 5938 B9R0.48 CCCC(C)OC[C@H](C)N Amb27424873 [0,2,0,0,0,0|1,0,0]=3 5939 B9R0.48 CCCC(C)OC[C@H](C)O Amb27424875 [0,2,0,0,0,0|0,0,0]=2 5940 B9R0.48 CCCC(C)\C=C\C(C)O Amb27262557 [0,2,0,0,0,0|1,0,1]=4 5941 B9R0.48 CCCC(Cl)OCC(C)C Amb28050900 [0,2,0,0,0,0|1,0,0]=3 5942 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [0,2,0,0,0,0|1,0,1]=4 5943 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [0,2,0,0,0,0|1,0,1]=4 5944 B9R0.48 CCCC(O)CCC(C)C Amb27971606 [0,2,0,0,0,0|2,0,0]=4 5945 B9R0.48 CCCN(C)CCC(C)Br Amb27224607 [0,2,0,0,0,0|2,0,0]=4 5946 B9R0.48 CCCN(C)CCC(C)Cl Amb28186132 [0,2,0,0,0,0|2,0,0]=4 5947 B9R0.48 CCCS(=O)NC[C@@H](C)O Amb27613575 [0,2,0,0,0,0|2,0,0]=4 5948 B9R0.48 CCC[C@@H](N)CCC(C)C Amb28050311 [0,2,0,0,0,0|2,0,0]=4 5949 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [0,2,0,0,0,0|1,0,1]=4 5950 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,2,0,0,0,0|1,0,1]=4 5951 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [0,2,0,0,0,0|1,0,1]=4 5952 B9R0.48 CCOC(=O)OCC(C)O Amb27763424 [0,2,0,0,0,0|1,0,1]=4 5953 B9R0.48 CCOC(C)CCC(C)O Amb33425313 [0,2,0,0,0,0|2,0,0]=4 5954 B9R0.48 CCOC(C)CC[C@@H](C)O Amb33425310 [0,2,0,0,0,0|2,0,0]=4 5955 B9R0.48 CCOC(C)CC[C@H](C)O Amb33425312 [0,2,0,0,0,0|2,0,0]=4 5956 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,2,0,0,0,0|1,0,1]=4 5957 B9R0.48 CN(C)CCC(N)CCO Amb33273735 [0,2,0,0,0,0|2,0,0]=4 5958 B9R0.48 CN(C)CCN(C)CCO Amb9825884 [0,2,0,0,0,0|2,0,0]=4 5959 B9R0.48 COCC(C)NCC(C)O Amb27197241 [0,2,0,0,0,0|2,0,0]=4 5960 B9R0.48 COCC(C)NC[C@H](C)O Amb27474135 [0,2,0,0,0,0|2,0,0]=4 5961 B9R0.48 COCC(C)OCC(=O)O Amb27807862 [0,2,0,0,0,0|1,0,1]=4 5962 B9R0.48 COCC(C)OC[C@H](C)N Amb27658399 [0,2,0,0,0,0|2,0,0]=4 5963 B9R0.48 CSCC(C)NCC(C)O Amb27424857 [0,2,0,0,0,0|2,0,0]=4 5964 B9R0.66 CC(C)(CCN)CCCO Amb28060526 [0,2,0,0,0,0|2,0,0]=4 5965 B9R0.66 CC(C)(CCO)CCCO Amb27979141 [0,2,0,0,0,0|2,0,0]=4 5966 B9R0.66 CCCC(C)(O)C#CCO Amb27839537 [0,2,0,0,0,0|1,0,1]=4 5967 B9R0.66 CCCCC(C)(C)CCC Amb22052712 [0,2,0,0,0,0|2,0,0]=4 5968 B9R0.66 CCCCC(C)(C)CCN Amb24746135 [0,2,0,0,0,0|2,0,0]=4 5969 B9R0.66 CCCCC(C)(C)CCO Amb27472532 [0,2,0,0,0,0|1,0,0]=3 5970 B9R0.66 CCCCC(C)(Cl)CCC Amb25840834 [0,2,0,0,0,0|2,0,0]=4 5971 B9R0.66 CCCCC(C)(O)CCBr Amb28143708 [0,2,0,0,0,0|2,0,0]=4 5972 B9R0.66 CCCCC(C)(O)CCN Amb28193269 [0,2,0,0,0,0|2,0,0]=4 5973 B9R0.66 CCCCS(=O)(=O)CCN Amb9479757 [0,2,0,0,0,0|1,1,0]=4 5974 B9R0.66 CCCCS(=O)(=O)CCO Amb10669567 [0,2,0,0,0,0|0,1,0]=3 5975 B9R0.66 CCCNS(=O)(=O)CCO Amb27185578 [0,2,0,0,0,0|1,1,0]=4 5976 B9R0.66 CCCP(C)(=O)OCCCl Amb28119852 [0,2,0,0,0,0|2,0,0]=4 5977 B9R0.66 CCCS(=O)(=O)CCCO Amb17138615 [0,2,0,0,0,0|2,0,0]=4 5978 B9R0.66 CCOC(C)(C)CCCO Amb28453453 [0,2,0,0,0,0|2,0,0]=4 5979 B9R0.66 CCOC[N+](C)(C)CCO Amb28321302 [0,2,0,0,0,0|2,0,0]=4 5980 B9R0.66 CCOP(C)(=O)OCCO Amb27486532 [0,2,0,0,0,0|2,0,0]=4 5981 B9R0.66 CNCC(C)(C)NCCO Amb27233783 [0,2,0,0,0,0|2,0,0]=4 5982 B9R0.66 CNCC(C)(C)OCCCl Amb28318566 [0,2,0,0,0,0|2,0,0]=4 5983 B9R0.66 CNCCC(C)(C)CCO Amb17569965 [0,2,0,0,0,0|2,0,0]=4 5984 B9R0.66 COCC(C)(C)CCCO Amb27661927 [0,2,0,0,0,0|2,0,0]=4 5985 B9R0.66 COCCC(C)(N)CCO Amb27487975 [0,2,0,0,0,0|2,0,0]=4 5986 B9R0.66 COCCS(=O)(=O)CCO Amb27209490 [0,2,0,0,0,0|1,1,0]=4 5987 B9R0.66 C[C@](O)(CCO)CCCO Amb28050644 [0,2,0,0,0,0|2,0,0]=4 5988 B9R0.66 C[N+](C)(CCO)CCCO Amb26606927 [0,2,0,0,0,0|2,0,0]=4 5989 B9R0.66 NCCCS(=O)(=O)CCO Amb17500832 [0,2,0,0,0,0|1,1,0]=4 5990 B9R0.66 O=S(=O)(CCO)CCCO Amb17502969 [0,2,0,0,0,0|1,1,0]=4 5991 B9R0.2 C#CCCCNC[C@H](C)O Amb28207467 [0,2,0,0,0,0|1,0,1]=4 5992 B9R0.2 C#CCCNCCC(C)C Amb27624980 [0,2,0,0,0,0|2,0,0]=4 5993 B9R0.2 C#CCCOCCC(=O)O Amb27406242 [0,2,0,0,0,0|0,0,2]=4 5994 B9R0.2 C=C(Br)COCCCOC Amb27778814 [0,2,0,0,0,0|1,0,1]=4 5995 B9R0.2 C=C(Br)COCCSCC Amb27643203 [0,2,0,0,0,0|1,0,1]=4 5996 B9R0.2 C=C(C)CCC#CCCO Amb27839496 [0,2,0,0,0,0|1,0,1]=4 5997 B9R0.2 C=C(C)CCCCCCC Amb6298940 [0,2,0,0,0,0|2,0,0]=4 5998 B9R0.2 C=C(C)CCCCCCCl Amb6298888 [0,2,0,0,0,0|2,0,0]=4 5999 B9R0.2 C=C(C)CCCOCC=O Amb27617165 [0,2,0,0,0,0|0,0,2]=4 6000 B9R0.2 C=C(C)CCOCCCN Amb27615177 [0,2,0,0,0,0|1,0,1]=4 6001 B9R0.2 C=C(C)CCSCCCC Amb27199306 [0,2,0,0,0,0|1,1,0]=4 6002 B9R0.2 C=C(C)COCCCCC Amb27862423 [0,2,0,0,0,0|1,0,1]=4 6003 B9R0.2 C=CCCCCCC(C)C Amb27205011 [0,2,0,0,0,0|2,0,0]=4 6004 B9R0.2 C=CCCCCC[C@@H](C)O Amb28318202 [0,2,0,0,0,0|1,0,1]=4 6005 B9R0.2 C=CCCCNC[C@@H](C)O Amb28065922 [0,2,0,0,0,0|1,0,1]=4 6006 B9R0.2 C=CCCCNC[C@H](C)O Amb28456202 [0,2,0,0,0,0|1,0,1]=4 6007 B9R0.2 C=CCCCOCC(=O)O Amb27217276 [0,2,0,0,0,0|0,0,2]=4 6008 B9R0.2 C=CCCNCCC(C)C Amb27458308 [0,2,0,0,0,0|2,0,0]=4 6009 B9R0.2 C=CCOCCCC(C)=O Amb27590994 [0,2,0,0,0,0|1,0,1]=4 6010 B9R0.2 C=CCOCCNC(C)C Amb27168988 [0,2,0,0,0,0|1,0,1]=4 6011 B9R0.2 C=CCOCSCC(C)Cl Amb26032294 [0,2,0,0,0,0|1,0,1]=4 6012 B9R0.2 C=CCONCCC(C)O Amb27424455 [0,2,0,0,0,0|1,0,1]=4 6013 B9R0.2 CC#CCCNCC(C)O Amb28067256 [0,2,0,0,0,0|1,0,1]=4 6014 B9R0.2 CC(=O)CCCC#CCO Amb28201537 [0,2,0,0,0,0|1,0,1]=4 6015 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,2,0,0,0,0|2,0,0]=4 6016 B9R0.2 CC(=O)CCCCCCN Amb32663700 [0,2,0,0,0,0|2,0,0]=4 6017 B9R0.2 CC(=O)CCCSCCO Amb9660259 [0,2,0,0,0,0|0,1,0]=3 6018 B9R0.2 CC(=O)NCCOCCBr Amb33528182 [0,2,0,0,0,0|1,0,1]=4 6019 B9R0.2 CC(=O)NCCOCCCl Amb27461485 [0,2,0,0,0,0|1,0,1]=4 6020 B9R0.2 CC(=O)NCCOCCN Amb16233780 [0,2,0,0,0,0|1,0,1]=4 6021 B9R0.2 CC(=O)NCCOCCO Amb24477952 [0,2,0,0,0,0|0,0,1]=3 6022 B9R0.2 CC(=O)OCCOCCCl Amb9787226 [0,2,0,0,0,0|1,0,1]=4 6023 B9R0.2 CC(=O)OCCOCCI Amb28050483 [0,2,0,0,0,0|1,0,1]=4 6024 B9R0.2 CC(=O)OCCSCCO Amb27825930 [0,2,0,0,0,0|0,1,1]=4 6025 B9R0.2 CC(=O)SCCOCCO Amb28050523 [0,2,0,0,0,0|0,0,1]=3 6026 B9R0.2 CC(C)CC=C=CCCO Amb27427142 [0,2,0,0,0,0|1,0,1]=4 6027 B9R0.2 CC(C)CCCCCC#N Amb18643473 [0,2,0,0,0,0|2,0,0]=4 6028 B9R0.2 CC(C)CCCCCC=O Amb22233123 [0,2,0,0,0,0|1,0,1]=4 6029 B9R0.2 CC(C)CCCCCCBr Amb20240805 [0,2,0,0,0,0|2,0,0]=4 6030 B9R0.2 CC(C)CCCCCCN Amb6608741 [0,2,0,0,0,0|2,0,0]=4 6031 B9R0.2 CC(C)CCCNCCBr Amb28368030 [0,2,0,0,0,0|2,0,0]=4 6032 B9R0.2 CC(C)CCCNCCN Amb27950337 [0,2,0,0,0,0|2,0,0]=4 6033 B9R0.2 CC(C)CCCOCCS Amb27979122 [0,2,0,0,0,0|0,1,0]=3 6034 B9R0.2 CC(C)CCC\C=C\CO Amb27427814 [0,2,0,0,0,0|1,0,1]=4 6035 B9R0.2 CC(C)CCNCCC#N Amb6736407 [0,2,0,0,0,0|2,0,0]=4 6036 B9R0.2 CC(C)CCNCCCCl Amb27466095 [0,2,0,0,0,0|2,0,0]=4 6037 B9R0.2 CC(C)CCNCCCN Amb17315309 [0,2,0,0,0,0|2,0,0]=4 6038 B9R0.2 CC(C)CCNCCCO Amb6733599 [0,2,0,0,0,0|1,0,0]=3 6039 B9R0.2 CC(C)CCOCCC#N Amb6258407 [0,2,0,0,0,0|1,0,0]=3 6040 B9R0.2 CC(C)CCOCCCN Amb6248634 [0,2,0,0,0,0|1,0,0]=3 6041 B9R0.2 CC(C)CCOCCCS Amb27594404 [0,2,0,0,0,0|0,1,0]=3 6042 B9R0.2 CC(C)CCSCCC=O Amb27589044 [0,2,0,0,0,0|0,1,1]=4 6043 B9R0.2 CC(C)CCSCCCN Amb17500699 [0,2,0,0,0,0|1,1,0]=4 6044 B9R0.2 CC(C)CCSCCCO Amb17502843 [0,2,0,0,0,0|0,1,0]=3 6045 B9R0.2 CC(C)CCSCCON Amb28062828 [0,2,0,0,0,0|0,1,0]=3 6046 B9R0.2 CC(C)CCS\C=C\CO Amb27839319 [0,2,0,0,0,0|0,1,1]=4 6047 B9R0.2 CC(C)CC\C=C\CCCl Amb27489237 [0,2,0,0,0,0|2,0,0]=4 6048 B9R0.2 CC(C)CC\C=C\CCN Amb27590783 [0,2,0,0,0,0|2,0,0]=4 6049 B9R0.2 CC(C)CNCCCCBr Amb27839561 [0,2,0,0,0,0|2,0,0]=4 6050 B9R0.2 CC(C)CNCCCCN Amb17334222 [0,2,0,0,0,0|2,0,0]=4 6051 B9R0.2 CC(C)CNCCCCO Amb17334252 [0,2,0,0,0,0|1,0,0]=3 6052 B9R0.2 CC(C)COCCCCBr Amb8855451 [0,2,0,0,0,0|1,0,0]=3 6053 B9R0.2 CC(C)COCCCCCl Amb18798375 [0,2,0,0,0,0|1,0,0]=3 6054 B9R0.2 CC(C)COCCCCO Amb27617219 [0,2,0,0,0,0|1,0,0]=3 6055 B9R0.2 CC(C)COCCCON Amb27420849 [0,2,0,0,0,0|2,0,0]=4 6056 B9R0.2 CC(C)CONCCCF Amb27425111 [0,2,0,0,0,0|2,0,0]=4 6057 B9R0.2 CC(C)CONCCCN Amb27227696 [0,2,0,0,0,0|2,0,0]=4 6058 B9R0.2 CC(C)CSCCCCN Amb9391257 [0,2,0,0,0,0|1,1,0]=4 6059 B9R0.2 CC(C)C\C=N\NCCO Amb28321549 [0,2,0,0,0,0|1,0,1]=4 6060 B9R0.2 CC(C)NCCCCCCl Amb27257059 [0,2,0,0,0,0|2,0,0]=4 6061 B9R0.2 CC(C)NCCCCCF Amb27594142 [0,2,0,0,0,0|2,0,0]=4 6062 B9R0.2 CC(C)NCCCCCI Amb27619570 [0,2,0,0,0,0|2,0,0]=4 6063 B9R0.2 CC(C)NCCCCCN Amb21953734 [0,2,0,0,0,0|2,0,0]=4 6064 B9R0.2 CC(C)NCCCCCO Amb17334255 [0,2,0,0,0,0|1,0,0]=3 6065 B9R0.2 CC(C)NCCNCCN Amb9825991 [0,2,0,0,0,0|2,0,0]=4 6066 B9R0.2 CC(C)NCCOCC#N Amb27813765 [0,2,0,0,0,0|1,0,1]=4 6067 B9R0.2 CC(C)NCCOCCCl Amb27978738 [0,2,0,0,0,0|1,0,0]=3 6068 B9R0.2 CC(C)NCCOCCF Amb27209446 [0,2,0,0,0,0|1,0,0]=3 6069 B9R0.2 CC(C)NCCOCCN Amb33541976 [0,2,0,0,0,0|1,0,0]=3 6070 B9R0.2 CC(C)NCCOCCO Amb28555415 [0,2,0,0,0,0|0,0,0]=2 6071 B9R0.2 CC(C)NCCOCCO Amb6736183 [0,2,0,0,0,0|0,0,0]=2 6072 B9R0.2 CC(C)NCCSCCN Amb18798167 [0,2,0,0,0,0|1,1,0]=4 6073 B9R0.2 CC(C)OCCCCCBr Amb25060878 [0,2,0,0,0,0|2,0,0]=4 6074 B9R0.2 CC(C)OCCCCCCl Amb9001658 [0,2,0,0,0,0|2,0,0]=4 6075 B9R0.2 CC(C)OCCCCCN Amb25049832 [0,2,0,0,0,0|2,0,0]=4 6076 B9R0.2 CC(C)OCCNCCCl Amb27833064 [0,2,0,0,0,0|2,0,0]=4 6077 B9R0.2 CC(C)OCCOCCCl Amb9209786 [0,2,0,0,0,0|1,0,0]=3 6078 B9R0.2 CC(C)OCCOCCN Amb6249926 [0,2,0,0,0,0|1,0,0]=3 6079 B9R0.2 CC(C)OCCOCCO Amb26512332 [0,2,0,0,0,0|0,0,0]=2 6080 B9R0.2 CC(C)OCCOCCS Amb28139968 [0,2,0,0,0,0|0,1,0]=3 6081 B9R0.2 CC(C)OCCSCCO Amb18800853 [0,2,0,0,0,0|0,1,0]=3 6082 B9R0.2 CC(C)OCC\C=C\CO Amb27169927 [0,2,0,0,0,0|1,0,1]=4 6083 B9R0.2 CC(C)OCOCCCN Amb28241664 [0,2,0,0,0,0|2,0,0]=4 6084 B9R0.2 CC(C)OCOCCCO Amb27805428 [0,2,0,0,0,0|1,0,0]=3 6085 B9R0.2 CC(C)SCCCCCN Amb18792402 [0,2,0,0,0,0|2,0,0]=4 6086 B9R0.2 CC(C)SCCCCCS Amb27833893 [0,2,0,0,0,0|1,1,0]=4 6087 B9R0.2 CC(C)SCCOCCCl Amb28341147 [0,2,0,0,0,0|1,0,0]=3 6088 B9R0.2 CC(C)SCCOCCN Amb17501989 [0,2,0,0,0,0|1,0,0]=3 6089 B9R0.2 CC(C)SCCOCCO Amb18180082 [0,2,0,0,0,0|0,0,0]=2 6090 B9R0.2 CC(C)SCCOCCS Amb27837885 [0,2,0,0,0,0|0,1,0]=3 6091 B9R0.2 CC(C)SCCSCCO Amb27603017 [0,2,0,0,0,0|0,1,0]=3 6092 B9R0.2 CC(Cl)CCCCCCN Amb28137853 [0,2,0,0,0,0|2,0,0]=4 6093 B9R0.2 CC(N)CCSCCCN Amb27755582 [0,2,0,0,0,0|1,1,0]=4 6094 B9R0.2 CC(N)CSCCCCO Amb27801506 [0,2,0,0,0,0|1,0,0]=3 6095 B9R0.2 CC(O)CC#CCCCO Amb28050415 [0,2,0,0,0,0|1,0,1]=4 6096 B9R0.2 CC(O)CCCCCCO Amb27272851 [0,2,0,0,0,0|1,0,0]=3 6097 B9R0.2 CC(O)CCCNCCN Amb27253160 [0,2,0,0,0,0|2,0,0]=4 6098 B9R0.2 CC(O)CCCNCCO Amb28343143 [0,2,0,0,0,0|1,0,0]=3 6099 B9R0.2 CC(O)CCC\C=C\CO Amb27604113 [0,2,0,0,0,0|1,0,1]=4 6100 B9R0.2 CC(O)CCNCCC#N Amb27754005 [0,2,0,0,0,0|2,0,0]=4 6101 B9R0.2 CC(O)CCNCCCF Amb27817504 [0,2,0,0,0,0|2,0,0]=4 6102 B9R0.2 CC(O)COCCCCN Amb28246831 [0,2,0,0,0,0|0,0,0]=2 6103 B9R0.2 CC(S)\C=C\CCCCO Amb27486620 [0,2,0,0,0,0|1,0,1]=4 6104 B9R0.2 CCC#CCOCC(=O)O Amb27425006 [0,2,0,0,0,0|0,0,2]=4 6105 B9R0.2 CCCC#CCCC(=O)O Amb27663886 [0,2,0,0,0,0|1,0,1]=4 6106 B9R0.2 CCCC=C=CCC(C)O Amb27826112 [0,2,0,0,0,0|1,0,1]=4 6107 B9R0.2 CCCCC#CCC(=O)O Amb26327934 [0,2,0,0,0,0|1,0,1]=4 6108 B9R0.2 CCCCC#CCC(C)O Amb28190297 [0,2,0,0,0,0|1,0,0]=3 6109 B9R0.2 CCCCC#CC[C@@H](C)O Amb27812433 [0,2,0,0,0,0|1,0,0]=3 6110 B9R0.2 CCCCC#CC[C@H](C)O Amb27755474 [0,2,0,0,0,0|1,0,0]=3 6111 B9R0.2 CCCCCC#CC(O)O Amb27978450 [0,2,0,0,0,0|1,0,1]=4 6112 B9R0.2 CCCCCCCB(O)O Amb13890611 [0,2,0,0,0,0|1,0,0]=3 6113 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [0,2,0,0,0,0|1,0,1]=4 6114 B9R0.2 CCCCCCCC(=O)O Amb3940371 [0,2,0,0,0,0|1,0,0]=3 6115 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,2,0,0,0,0|1,0,1]=4 6116 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [0,2,0,0,0,0|1,0,1]=4 6117 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [0,2,0,0,0,0|1,0,1]=4 6118 B9R0.2 CCCCCCCC(C)=O Amb6891951 [0,2,0,0,0,0|1,0,1]=4 6119 B9R0.2 CCCCCCCC(C)Br Amb3940567 [0,2,0,0,0,0|2,0,0]=4 6120 B9R0.2 CCCCCCCC(C)C Amb6366303 [0,2,0,0,0,0|2,0,0]=4 6121 B9R0.2 CCCCCCCC(C)S Amb7795228 [0,2,0,0,0,0|1,1,0]=4 6122 B9R0.2 CCCCCCCC(N)=O Amb8999028 [0,2,0,0,0,0|1,0,1]=4 6123 B9R0.2 CCCCCCCP(O)O Amb28042243 [0,2,0,0,0,0|1,0,0]=3 6124 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [0,2,0,0,0,0|1,0,1]=4 6125 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [0,2,0,0,0,0|1,0,1]=4 6126 B9R0.2 CCCCCCCS(N)=O Amb32720352 [0,2,0,0,0,0|1,0,1]=4 6127 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [0,2,0,0,0,0|2,0,0]=4 6128 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [0,2,0,0,0,0|2,0,0]=4 6129 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|1,0,0]=3 6130 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [0,2,0,0,0,0|2,0,0]=4 6131 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|1,0,0]=3 6132 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [0,2,0,0,0,0|1,0,1]=4 6133 B9R0.2 CCCCCCOC(C)C Amb28320041 [0,2,0,0,0,0|2,0,0]=4 6134 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [0,2,0,0,0,0|2,0,0]=4 6135 B9R0.2 CCCCCCOC(C)O Amb28347016 [0,2,0,0,0,0|1,0,0]=3 6136 B9R0.2 CCCCCCSC(C)C Amb28315852 [0,2,0,0,0,0|2,0,0]=4 6137 B9R0.2 CCCCCOCC(=O)O Amb8902706 [0,2,0,0,0,0|0,0,1]=3 6138 B9R0.2 CCCCCOCC(C)N Amb8902896 [0,2,0,0,0,0|1,0,0]=3 6139 B9R0.2 CCCCCOC[C@@H](C)N Amb27490460 [0,2,0,0,0,0|1,0,0]=3 6140 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [0,2,0,0,0,0|0,0,0]=2 6141 B9R0.2 CCCCCSCC(=O)O Amb6249571 [0,2,0,0,0,0|0,1,1]=4 6142 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [0,2,0,0,0,0|1,0,1]=4 6143 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [0,2,0,0,0,0|1,0,1]=4 6144 B9R0.2 CCCCNCCC(=O)O Amb7755713 [0,2,0,0,0,0|1,0,0]=3 6145 B9R0.2 CCCCNCCC(C)=O Amb26381876 [0,2,0,0,0,0|1,0,1]=4 6146 B9R0.2 CCCCNCCC(C)O Amb27986026 [0,2,0,0,0,0|1,0,0]=3 6147 B9R0.2 CCCCNCCC(N)=O Amb8841106 [0,2,0,0,0,0|1,0,1]=4 6148 B9R0.2 CCCCNCCN(C)C Amb1124804 [0,2,0,0,0,0|2,0,0]=4 6149 B9R0.2 CCCCOCCC(Cl)Cl Amb27232855 [0,2,0,0,0,0|1,0,0]=3 6150 B9R0.2 CCCCOCCC(N)=O Amb27480748 [0,2,0,0,0,0|0,0,1]=3 6151 B9R0.2 CCCCOCCC(N)=S Amb8895295 [0,2,0,0,0,0|0,1,0]=3 6152 B9R0.2 CCCCOCCN(C)C Amb27192355 [0,2,0,0,0,0|1,0,0]=3 6153 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,2,0,0,0,0|0,1,0]=3 6154 B9R0.2 CCCCSCCC(C)C Amb27651351 [0,2,0,0,0,0|1,1,0]=4 6155 B9R0.2 CCCCSCCC(C)N Amb28189560 [0,2,0,0,0,0|1,1,0]=4 6156 B9R0.2 CCCCSCCC(N)=S Amb17503251 [0,2,0,0,0,0|0,2,0]=4 6157 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [0,2,0,0,0,0|1,0,1]=4 6158 B9R0.2 CCCC\C=C\CC(C)O Amb27839464 [0,2,0,0,0,0|1,0,0]=3 6159 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,2,0,0,0,0|1,0,1]=4 6160 B9R0.2 CCCNCCCC(C)C Amb8853733 [0,2,0,0,0,0|2,0,0]=4 6161 B9R0.2 CCCNCCCC(C)N Amb27475709 [0,2,0,0,0,0|2,0,0]=4 6162 B9R0.2 CCCNCCCN(C)C Amb6699374 [0,2,0,0,0,0|2,0,0]=4 6163 B9R0.2 CCCOCCCC(=N)N Amb8874875 [0,2,0,0,0,0|1,0,1]=4 6164 B9R0.2 CCCOCCCC(=O)O Amb8874517 [0,2,0,0,0,0|1,0,1]=4 6165 B9R0.2 CCCOCCCC(C)Cl Amb27795432 [0,2,0,0,0,0|1,0,0]=3 6166 B9R0.2 CCCOCCCC(N)=S Amb8874843 [0,2,0,0,0,0|1,0,1]=4 6167 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,2,0,0,0,0|1,0,1]=4 6168 B9R0.2 CCCONCCC(=O)O Amb27233908 [0,2,0,0,0,0|2,0,0]=4 6169 B9R0.2 CCCONCCC(C)C Amb28396906 [0,2,0,0,0,0|1,0,0]=3 6170 B9R0.2 CCCONCCC(C)O Amb27244555 [0,2,0,0,0,0|1,0,0]=3 6171 B9R0.2 CCCSCCCC(=O)O Amb6680215 [0,2,0,0,0,0|1,0,1]=4 6172 B9R0.2 CCCSCCCC(C)=O Amb9660304 [0,2,0,0,0,0|1,1,0]=4 6173 B9R0.2 CCCSCCCC(C)N Amb27838926 [0,2,0,0,0,0|1,1,0]=4 6174 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [0,2,0,0,0,0|1,0,1]=4 6175 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [0,2,0,0,0,0|1,0,1]=4 6176 B9R0.2 CCC\C=C\CCC(C)N Amb33424850 [0,2,0,0,0,0|2,0,0]=4 6177 B9R0.2 CCC\C=C\CCC(C)O Amb33424849 [0,2,0,0,0,0|1,0,1]=4 6178 B9R0.2 CCC\C=C\CC[C@@H](C)N Amb33424844 [0,2,0,0,0,0|2,0,0]=4 6179 B9R0.2 CCC\C=C\CC[C@@H](C)O Amb33424845 [0,2,0,0,0,0|1,0,1]=4 6180 B9R0.2 CCC\C=C\CC[C@H](C)N Amb33424843 [0,2,0,0,0,0|2,0,0]=4 6181 B9R0.2 CCC\C=C\CC[C@H](C)O Amb33424847 [0,2,0,0,0,0|1,0,1]=4 6182 B9R0.2 CCC\C=N\OCC(C)C Amb27660759 [0,2,0,0,0,0|1,0,1]=4 6183 B9R0.2 CCNCCCCC(=O)O Amb24385094 [0,2,0,0,0,0|1,0,1]=4 6184 B9R0.2 CCNCCCCC(=O)O Amb32686610 [0,2,0,0,0,0|1,0,1]=4 6185 B9R0.2 CCNCCNCC(C)C Amb27232336 [0,2,0,0,0,0|2,0,0]=4 6186 B9R0.2 CCNCCOCC(C)C Amb27834453 [0,2,0,0,0,0|1,0,0]=3 6187 B9R0.2 CCNCCSCC(C)N Amb27467377 [0,2,0,0,0,0|1,1,0]=4 6188 B9R0.2 CCOCCCCC(=O)O Amb9207786 [0,2,0,0,0,0|1,0,1]=4 6189 B9R0.2 CCOCCNCC(C)C Amb9241020 [0,2,0,0,0,0|2,0,0]=4 6190 B9R0.2 CCOCCOCC(=O)O Amb6258165 [0,2,0,0,0,0|0,0,1]=3 6191 B9R0.2 CCOCCOCC(C)O Amb9787531 [0,2,0,0,0,0|0,0,0]=2 6192 B9R0.2 CCOCCOCC(N)=O Amb28203011 [0,2,0,0,0,0|0,0,2]=4 6193 B9R0.2 CCOCSCCC(=O)O Amb27447358 [0,2,0,0,0,0|1,1,0]=4 6194 B9R0.2 CCSCCCCC(=O)O Amb7782874 [0,2,0,0,0,0|1,0,1]=4 6195 B9R0.2 CCSCCCCC(C)Br Amb27867199 [0,2,0,0,0,0|2,0,0]=4 6196 B9R0.2 CCSCCNC[C@H](C)O Amb27972582 [0,2,0,0,0,0|1,0,0]=3 6197 B9R0.2 CCSCCSCC(=O)O Amb28126747 [0,2,0,0,0,0|0,1,1]=4 6198 B9R0.2 CC\C=C\CNCC(C)O Amb27226293 [0,2,0,0,0,0|1,0,1]=4 6199 B9R0.2 CN(C)CCCCCCBr Amb27759352 [0,2,0,0,0,0|2,0,0]=4 6200 B9R0.2 CN(C)CCCCCCCl Amb18800750 [0,2,0,0,0,0|2,0,0]=4 6201 B9R0.2 CN(C)CCCCCCN Amb2721296 [0,2,0,0,0,0|2,0,0]=4 6202 B9R0.2 CN(C)CCCCCCO Amb17613201 [0,2,0,0,0,0|1,0,0]=3 6203 B9R0.2 CN(C)CCCNCCCl Amb17334624 [0,2,0,0,0,0|2,0,0]=4 6204 B9R0.2 CN(C)CCCNCCN Amb5722657 [0,2,0,0,0,0|2,0,0]=4 6205 B9R0.2 CN(C)CCCSCCN Amb28050313 [0,2,0,0,0,0|1,1,0]=4 6206 B9R0.2 CN(C)CCOCCCN Amb23308391 [0,2,0,0,0,0|2,0,0]=4 6207 B9R0.2 CN(C)CCONCCN Amb27196382 [0,2,0,0,0,0|2,0,0]=4 6208 B9R0.2 CN(C)NCCOCCO Amb27831100 [0,2,0,0,0,0|1,0,0]=3 6209 B9R0.2 CNCCCNCC(C)C Amb28193252 [0,2,0,0,0,0|2,0,0]=4 6210 B9R0.2 CNCCCSCC(C)N Amb27815759 [0,2,0,0,0,0|1,1,0]=4 6211 B9R0.2 CNCCOCCC(=O)O Amb18111840 [0,2,0,0,0,0|1,0,0]=3 6212 B9R0.2 CNCCOCCC(C)=O Amb18630756 [0,2,0,0,0,0|1,0,1]=4 6213 B9R0.2 CNCCOCCC(N)=O Amb28122222 [0,2,0,0,0,0|1,0,1]=4 6214 B9R0.2 CNCCOCCS(C)=O Amb28197250 [0,2,0,0,0,0|1,0,1]=4 6215 B9R0.2 CNCCSCCC(=O)O Amb27442544 [0,2,0,0,0,0|1,1,0]=4 6216 B9R0.2 CNCCSCCC(C)N Amb27404073 [0,2,0,0,0,0|1,1,0]=4 6217 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,2,0,0,0,0|1,0,1]=4 6218 B9R0.2 COCCCCCC(C)=O Amb27227265 [0,2,0,0,0,0|1,0,1]=4 6219 B9R0.2 COCCCNCC(C)C Amb6730181 [0,2,0,0,0,0|2,0,0]=4 6220 B9R0.2 COCCCNCC(C)N Amb28281327 [0,2,0,0,0,0|2,0,0]=4 6221 B9R0.2 COCCCNCC(C)O Amb17138417 [0,2,0,0,0,0|1,0,0]=3 6222 B9R0.2 COCCCOCC(=O)O Amb25304314 [0,2,0,0,0,0|0,0,1]=3 6223 B9R0.2 COCCCOCC(C)N Amb27837579 [0,2,0,0,0,0|1,0,0]=3 6224 B9R0.2 COCCCOCC(C)O Amb27600623 [0,2,0,0,0,0|0,0,0]=2 6225 B9R0.2 COCCCOCC(N)=S Amb18792509 [0,2,0,0,0,0|0,1,1]=4 6226 B9R0.2 COCCCOC[C@@H](C)N Amb28382568 [0,2,0,0,0,0|1,0,0]=3 6227 B9R0.2 COCCCSC[C@H](C)N Amb28344655 [0,2,0,0,0,0|1,1,0]=4 6228 B9R0.2 COCCNCCC(=O)O Amb33527038 [0,2,0,0,0,0|2,0,0]=4 6229 B9R0.2 COCCNCCC(=O)O Amb7755691 [0,2,0,0,0,0|2,0,0]=4 6230 B9R0.2 COCCNCCC(C)=O Amb24473587 [0,2,0,0,0,0|1,0,1]=4 6231 B9R0.2 COCCNCCC(C)Cl Amb28369525 [0,2,0,0,0,0|1,0,0]=3 6232 B9R0.2 COCCNCCC(F)F Amb18796701 [0,2,0,0,0,0|2,0,0]=4 6233 B9R0.2 COCCNCCC(F)F Amb20667926 [0,2,0,0,0,0|2,0,0]=4 6234 B9R0.2 COCCNCCN(C)C Amb6714684 [0,2,0,0,0,0|2,0,0]=4 6235 B9R0.2 COCCNCCS(C)=O Amb27220298 [0,2,0,0,0,0|2,0,0]=4 6236 B9R0.2 COCCOCCC(=O)O Amb6268336 [0,2,0,0,0,0|1,0,0]=3 6237 B9R0.2 COCCOCCC(N)=O Amb28428996 [0,2,0,0,0,0|1,0,1]=4 6238 B9R0.2 COCCOCCC(N)=S Amb6276300 [0,2,0,0,0,0|1,0,1]=4 6239 B9R0.2 COCCOCCS(=O)Cl Amb32720478 [0,2,0,0,0,0|1,0,1]=4 6240 B9R0.2 COCCOCCS(=O)[O-] Amb32754578 [0,2,0,0,0,0|1,0,1]=4 6241 B9R0.2 COCCOCCS(N)=O Amb32720479 [0,2,0,0,0,0|1,0,1]=4 6242 B9R0.2 COCCOCOC(C)=O Amb28126918 [0,2,0,0,0,0|1,0,1]=4 6243 B9R0.2 COCCONC[C@@H](C)O Amb27823230 [0,2,0,0,0,0|1,0,0]=3 6244 B9R0.2 COCCSCCC(C)F Amb27457248 [0,2,0,0,0,0|0,1,0]=3 6245 B9R0.2 COCCSCCS(C)=O Amb28078807 [0,2,0,0,0,0|1,1,0]=4 6246 B9R0.2 COCC\C=C\C[C@H](C)O Amb28044299 [0,2,0,0,0,0|1,0,1]=4 6247 B9R0.2 COC\C=C\CCC(C)O Amb28065896 [0,2,0,0,0,0|1,0,1]=4 6248 B9R0.2 CONCCOCC(C)C Amb27979527 [0,2,0,0,0,0|2,0,0]=4 6249 B9R0.2 CS(=O)CCCCCCO Amb27771220 [0,2,0,0,0,0|1,0,0]=3 6250 B9R0.2 CSCCCCCC(=O)O Amb27444761 [0,2,0,0,0,0|1,0,1]=4 6251 B9R0.2 CSCCCNCC(=O)O Amb8827601 [0,2,0,0,0,0|1,0,1]=4 6252 B9R0.2 CSCCCNCC(F)F Amb27803486 [0,2,0,0,0,0|2,0,0]=4 6253 B9R0.2 CSCCCNC[C@@H](C)O Amb27449650 [0,2,0,0,0,0|1,0,0]=3 6254 B9R0.2 CSCCCOCC(=O)O Amb28042679 [0,2,0,0,0,0|0,0,1]=3 6255 B9R0.2 CSCCCSCC(C)C Amb27253070 [0,2,0,0,0,0|1,1,0]=4 6256 B9R0.2 CSCCCSC[C@H](C)N Amb27482910 [0,2,0,0,0,0|1,1,0]=4 6257 B9R0.2 CSCCCSC[C@H](C)O Amb27875476 [0,2,0,0,0,0|0,1,0]=3 6258 B9R0.2 CSCCNCCC(=O)O Amb25055507 [0,2,0,0,0,0|2,0,0]=4 6259 B9R0.2 CSCCNCCC(C)C Amb18800588 [0,2,0,0,0,0|1,1,0]=4 6260 B9R0.2 CSCCNOCC(C)C Amb27167542 [0,2,0,0,0,0|2,0,0]=4 6261 B9R0.2 CSCCOCCC(=N)N Amb27613566 [0,2,0,0,0,0|2,0,0]=4 6262 B9R0.2 CSSCCNCC(C)O Amb27627847 [0,2,0,0,0,0|2,0,0]=4 6263 B9R0.2 C[C@@H](O)CCCCCCO Amb27406493 [0,2,0,0,0,0|1,0,0]=3 6264 B9R0.2 C[C@@H](O)CNCCCCO Amb27235176 [0,2,0,0,0,0|1,0,0]=3 6265 B9R0.2 C[C@H](O)CC#CCCCO Amb28344979 [0,2,0,0,0,0|1,0,1]=4 6266 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [0,2,0,0,0,0|1,0,1]=4 6267 B9R0.2 C\C=C\CCNCC(C)O Amb27823058 [0,2,0,0,0,0|1,0,1]=4 6268 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [0,2,0,0,0,0|0,0,2]=4 6269 B9R0.2 FC(F)CNCCCCBr Amb27614982 [0,2,0,0,0,0|2,0,0]=4 6270 B9R0.2 N=C(N)NCCOCCO Amb27216518 [0,2,0,0,0,0|1,0,1]=4 6271 B9R0.2 N=C(N)SCCOCCO Amb27823570 [0,2,0,0,0,0|1,0,1]=4 6272 B9R0.2 NC(=O)COCCCCO Amb27195620 [0,2,0,0,0,0|0,0,2]=4 6273 B9R0.2 NC(=O)NCCOCCO Amb26350475 [0,2,0,0,0,0|1,0,1]=4 6274 B9R0.2 NCCCCCCB(O)O Amb28401029 [0,2,0,0,0,0|2,0,0]=4 6275 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,2,0,0,0,0|1,0,1]=4 6276 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,2,0,0,0,0|1,0,1]=4 6277 B9R0.2 NCCCCNCC(=O)O Amb27800960 [0,2,0,0,0,0|1,0,1]=4 6278 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,2,0,0,0,0|0,1,1]=4 6279 B9R0.2 NCCCNCCC(=O)O Amb27959846 [0,2,0,0,0,0|2,0,0]=4 6280 B9R0.2 NCCCOCCC(=O)O Amb18111494 [0,2,0,0,0,0|1,0,0]=3 6281 B9R0.2 NCCCOCCC(N)=O Amb27412120 [0,2,0,0,0,0|1,0,1]=4 6282 B9R0.2 NCCCSCCC(=O)O Amb24496605 [0,2,0,0,0,0|1,1,0]=4 6283 B9R0.2 NCCOCCCC(=O)O Amb18111467 [0,2,0,0,0,0|1,0,1]=4 6284 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [0,2,0,0,0,0|1,0,1]=4 6285 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [0,2,0,0,0,0|1,0,1]=4 6286 B9R0.2 O=C(O)CCCCCCF Amb25132501 [0,2,0,0,0,0|1,0,1]=4 6287 B9R0.2 O=C(O)CCCCCCO Amb9787028 [0,2,0,0,0,0|1,0,1]=4 6288 B9R0.2 O=C(O)CCCCCCS Amb24710334 [0,2,0,0,0,0|1,0,1]=4 6289 B9R0.2 O=C(O)CCCNCCO Amb9333522 [0,2,0,0,0,0|1,0,1]=4 6290 B9R0.2 O=C(O)CCCOCCO Amb6680919 [0,2,0,0,0,0|0,0,1]=3 6291 B9R0.2 O=C(O)CCCSCCO Amb9481728 [0,2,0,0,0,0|0,1,1]=4 6292 B9R0.2 O=C(O)CCNCCCF Amb28049536 [0,2,0,0,0,0|2,0,0]=4 6293 B9R0.2 O=C(O)CCNCCCO Amb9239888 [0,2,0,0,0,0|2,0,0]=4 6294 B9R0.2 O=C(O)CCOCCCO Amb24476864 [0,2,0,0,0,0|1,0,0]=3 6295 B9R0.2 O=C(O)CCSCCCCl Amb26421708 [0,2,0,0,0,0|1,1,0]=4 6296 B9R0.2 O=C(O)CCSCCCF Amb27251653 [0,2,0,0,0,0|1,1,0]=4 6297 B9R0.2 O=C(O)CNCCCCO Amb28063278 [0,2,0,0,0,0|1,0,1]=4 6298 B9R0.2 O=C(O)COCCCCF Amb27770553 [0,2,0,0,0,0|0,0,1]=3 6299 B9R0.2 O=C(O)COCCCCO Amb27465121 [0,2,0,0,0,0|0,0,1]=3 6300 B9R0.2 O=C(O)CSCCCCCl Amb27165750 [0,2,0,0,0,0|0,1,1]=4 6301 B9R0.2 O=C(O)CSCCCCF Amb28062594 [0,2,0,0,0,0|0,1,1]=4 6302 B9R0.2 O=S([O-])CCCCCCO Amb27485557 [0,2,0,0,0,0|2,0,0]=4 6303 B9R0.2 O=[N+]([O-])OCCOCCO Amb27777594 [0,2,0,0,0,0|2,0,0]=4 6304 B9R0.2 OB(O)CCCCCCCl Amb27614247 [0,2,0,0,0,0|2,0,0]=4 6305 B9R0.2 OCCOCCNC(=S)S Amb27230241 [0,2,0,0,0,0|1,0,1]=4 6306 B9R0.45 BrCCCCCCCCBr Amb2725461 [0,2,0,0,0,0|2,0,0]=4 6307 B9R0.45 BrCCNCCNCCBr Amb28323311 [0,2,0,0,0,0|2,0,0]=4 6308 B9R0.45 BrCCOCCOCCBr Amb16184320 [0,2,0,0,0,0|1,0,0]=3 6309 B9R0.45 BrCCSCCSCCBr Amb25890188 [0,2,0,0,0,0|1,1,0]=4 6310 B9R0.45 C#CCCC#CCCCC Amb2721537 [0,2,0,0,0,0|2,0,0]=4 6311 B9R0.45 C#CCCCC#CCCO Amb27410769 [0,2,0,0,0,0|1,0,1]=4 6312 B9R0.45 C#CCCCCCCCC Amb2721541 [0,2,0,0,0,0|2,0,0]=4 6313 B9R0.45 C#CCCCCCCCF Amb27845935 [0,2,0,0,0,0|2,0,0]=4 6314 B9R0.45 C#CCCCCCCCN Amb24117276 [0,2,0,0,0,0|2,0,0]=4 6315 B9R0.45 C#CCCCCCCCO Amb10563785 [0,2,0,0,0,0|1,0,0]=3 6316 B9R0.45 C#CCCCCCCNC Amb28204575 [0,2,0,0,0,0|2,0,0]=4 6317 B9R0.45 C#CCCCCOCOC Amb22641579 [0,2,0,0,0,0|2,0,0]=4 6318 B9R0.45 C#CCCCNCCCC Amb27413122 [0,2,0,0,0,0|2,0,0]=4 6319 B9R0.45 C#CCCCOCCNC Amb27978621 [0,2,0,0,0,0|1,0,1]=4 6320 B9R0.45 C#CCCNCCCCC Amb27770336 [0,2,0,0,0,0|2,0,0]=4 6321 B9R0.45 C#CCCNCCCSC Amb27245095 [0,2,0,0,0,0|2,0,0]=4 6322 B9R0.45 C#CCCOCCNCC Amb27478327 [0,2,0,0,0,0|1,0,0]=3 6323 B9R0.45 C#CCCOCCOCC Amb27615179 [0,2,0,0,0,0|1,0,0]=3 6324 B9R0.45 C#CCCSCCCOC Amb27454502 [0,2,0,0,0,0|1,1,0]=4 6325 B9R0.45 C#CCC\C=C\CCCC Amb24505097 [0,2,0,0,0,0|2,0,0]=4 6326 B9R0.45 C#CCNCCCCCC Amb5262804 [0,2,0,0,0,0|2,0,0]=4 6327 B9R0.45 C#CCNCCOCCO Amb28352181 [0,2,0,0,0,0|0,0,1]=3 6328 B9R0.45 C#CCOCCOCCBr Amb27777238 [0,2,0,0,0,0|1,0,1]=4 6329 B9R0.45 C#CCOCCOCCI Amb32414196 [0,2,0,0,0,0|1,0,1]=4 6330 B9R0.45 C#CCOCCOCCN Amb18521910 [0,2,0,0,0,0|1,0,1]=4 6331 B9R0.45 C#CCOCCOCCO Amb4477227 [0,2,0,0,0,0|0,0,1]=3 6332 B9R0.45 C#CCONCCCCC Amb27617050 [0,2,0,0,0,0|1,0,1]=4 6333 B9R0.45 C#CCSCCCCCC Amb28349721 [0,2,0,0,0,0|2,0,0]=4 6334 B9R0.45 C#CCSCCNCCO Amb27449476 [0,2,0,0,0,0|1,0,1]=4 6335 B9R0.45 C#CCSCCOCCN Amb17502013 [0,2,0,0,0,0|1,0,1]=4 6336 B9R0.45 C#CCSCCOCCO Amb27826122 [0,2,0,0,0,0|0,0,1]=3 6337 B9R0.45 C=C=CCCCCCCO Amb28050724 [0,2,0,0,0,0|1,0,1]=4 6338 B9R0.45 C=CCCCCC#CCO Amb27972321 [0,2,0,0,0,0|1,0,1]=4 6339 B9R0.45 C=CCCCCCCCBr Amb19895211 [0,2,0,0,0,0|2,0,0]=4 6340 B9R0.45 C=CCCCCCCCC Amb3940503 [0,2,0,0,0,0|2,0,0]=4 6341 B9R0.45 C=CCCCCCCCCl Amb6298880 [0,2,0,0,0,0|2,0,0]=4 6342 B9R0.45 C=CCCCCCCCN Amb24763980 [0,2,0,0,0,0|2,0,0]=4 6343 B9R0.45 C=CCCCCCCCN Amb32653343 [0,2,0,0,0,0|2,0,0]=4 6344 B9R0.45 C=CCCCCCCCO Amb22733549 [0,2,0,0,0,0|1,0,0]=3 6345 B9R0.45 C=CCCCCCCNC Amb28120535 [0,2,0,0,0,0|2,0,0]=4 6346 B9R0.45 C=CCCCCCSCC Amb27396740 [0,2,0,0,0,0|2,0,0]=4 6347 B9R0.45 C=CCCCCNCCC Amb26576689 [0,2,0,0,0,0|2,0,0]=4 6348 B9R0.45 C=CCCCC\C=C\CO Amb8389620 [0,2,0,0,0,0|1,0,1]=4 6349 B9R0.45 C=CCCCNCCCC Amb27799206 [0,2,0,0,0,0|2,0,0]=4 6350 B9R0.45 C=CCCCOCCC#N Amb27171013 [0,2,0,0,0,0|1,0,1]=4 6351 B9R0.45 C=CCCCSCCOC Amb27424920 [0,2,0,0,0,0|0,1,1]=4 6352 B9R0.45 C=CCCC\C=C\CCO Amb27835106 [0,2,0,0,0,0|1,0,1]=4 6353 B9R0.45 C=CCCNCCCCC Amb27838999 [0,2,0,0,0,0|2,0,0]=4 6354 B9R0.45 C=CCCNCCCCO Amb28141464 [0,2,0,0,0,0|1,0,1]=4 6355 B9R0.45 C=CCCNCCCOC Amb28126721 [0,2,0,0,0,0|2,0,0]=4 6356 B9R0.45 C=CCCNCCCSC Amb27838985 [0,2,0,0,0,0|2,0,0]=4 6357 B9R0.45 C=CCCNCCOCC Amb28126723 [0,2,0,0,0,0|2,0,0]=4 6358 B9R0.45 C=CCCOCCCNC Amb27768715 [0,2,0,0,0,0|1,0,0]=3 6359 B9R0.45 C=CCCSCCCOC Amb28280277 [0,2,0,0,0,0|1,1,0]=4 6360 B9R0.45 C=CCCSCCSCC Amb27197363 [0,2,0,0,0,0|1,1,0]=4 6361 B9R0.45 C=CCNCCCCCC Amb7756950 [0,2,0,0,0,0|2,0,0]=4 6362 B9R0.45 C=CCOCCCCCC Amb17933923 [0,2,0,0,0,0|1,0,1]=4 6363 B9R0.45 C=CCOCCCSCC Amb28187852 [0,2,0,0,0,0|1,0,1]=4 6364 B9R0.45 C=CCOCCNCCC Amb27866133 [0,2,0,0,0,0|1,0,1]=4 6365 B9R0.45 C=CCOCCNCCN Amb28065791 [0,2,0,0,0,0|1,0,1]=4 6366 B9R0.45 C=CCOCCNCCO Amb28321523 [0,2,0,0,0,0|1,0,1]=4 6367 B9R0.45 C=CCOCCOCCCl Amb27615017 [0,2,0,0,0,0|1,0,1]=4 6368 B9R0.45 C=CCOCCOCCN Amb18111246 [0,2,0,0,0,0|1,0,1]=4 6369 B9R0.45 C=CCOCCOCCO Amb17933929 [0,2,0,0,0,0|0,0,1]=3 6370 B9R0.45 C=CCOCCOCCS Amb28049570 [0,2,0,0,0,0|0,1,1]=4 6371 B9R0.45 C=CCONCCOCC Amb27267386 [0,2,0,0,0,0|1,0,1]=4 6372 B9R0.45 C=CCONCCSCC Amb27266026 [0,2,0,0,0,0|1,0,1]=4 6373 B9R0.45 C=CCSCCCCCC Amb22733767 [0,2,0,0,0,0|2,0,0]=4 6374 B9R0.45 C=CCSCCOCCN Amb17501982 [0,2,0,0,0,0|1,0,1]=4 6375 B9R0.45 C=CCSCCOCCO Amb27595240 [0,2,0,0,0,0|0,0,1]=3 6376 B9R0.45 C=COCCCCCCO Amb26931083 [0,2,0,0,0,0|1,0,1]=4 6377 B9R0.45 C=COCCNCCCC Amb28364273 [0,2,0,0,0,0|1,0,0]=3 6378 B9R0.45 C=COCCOCCOC Amb27852644 [0,2,0,0,0,0|1,0,0]=3 6379 B9R0.45 C=COCCSCCOC Amb27486713 [0,2,0,0,0,0|1,1,0]=4 6380 B9R0.45 CC#CCCCCCCC Amb2721539 [0,2,0,0,0,0|2,0,0]=4 6381 B9R0.45 CC#CCCCCCCO Amb27478697 [0,2,0,0,0,0|1,0,0]=3 6382 B9R0.45 CC#CCCNCCOC Amb27795461 [0,2,0,0,0,0|1,0,1]=4 6383 B9R0.45 CC#CCCNOCCC Amb27824900 [0,2,0,0,0,0|1,0,1]=4 6384 B9R0.45 CC#CCCSCCCO Amb28383676 [0,2,0,0,0,0|0,1,1]=4 6385 B9R0.45 CC#CCOC\C=C\CO Amb27604264 [0,2,0,0,0,0|0,0,2]=4 6386 B9R0.45 CCC#CCCCCCC Amb2721540 [0,2,0,0,0,0|2,0,0]=4 6387 B9R0.45 CCC#CCCCCCO Amb28050678 [0,2,0,0,0,0|1,0,0]=3 6388 B9R0.45 CCC#CCCOCCO Amb4016675 [0,2,0,0,0,0|0,0,0]=2 6389 B9R0.45 CCC#CCNCCCC Amb28437319 [0,2,0,0,0,0|2,0,0]=4 6390 B9R0.45 CCC=C=CCCCCO Amb28248694 [0,2,0,0,0,0|1,0,1]=4 6391 B9R0.45 CCCC#CCCCCC Amb2721550 [0,2,0,0,0,0|2,0,0]=4 6392 B9R0.45 CCCC=C=CCCCO Amb27839599 [0,2,0,0,0,0|1,0,1]=4 6393 B9R0.45 CCCCC#CCCC=O Amb27790685 [0,2,0,0,0,0|1,0,1]=4 6394 B9R0.45 CCCCC#CCCCC Amb2721554 [0,2,0,0,0,0|2,0,0]=4 6395 B9R0.45 CCCCC#CCCCCl Amb2721557 [0,2,0,0,0,0|2,0,0]=4 6396 B9R0.45 CCCCC#CCCCN Amb26348518 [0,2,0,0,0,0|2,0,0]=4 6397 B9R0.45 CCCCC#C\C=C\CO Amb28293235 [0,2,0,0,0,0|1,0,1]=4 6398 B9R0.45 CCCCCC#CCCN Amb25146331 [0,2,0,0,0,0|2,0,0]=4 6399 B9R0.45 CCCCCC#CCCO Amb2721746 [0,2,0,0,0,0|1,0,0]=3 6400 B9R0.45 CCCCCCC#CCBr Amb26974428 [0,2,0,0,0,0|2,0,0]=4 6401 B9R0.45 CCCCCCC#CCN Amb28313948 [0,2,0,0,0,0|2,0,0]=4 6402 B9R0.45 CCCCCCC#CCO Amb2721748 [0,2,0,0,0,0|1,0,0]=3 6403 B9R0.45 CCCCCCCCC#N Amb7764626 [0,2,0,0,0,0|2,0,0]=4 6404 B9R0.45 CCCCCCCCCBr Amb3940224 [0,2,0,0,0,0|2,0,0]=4 6405 B9R0.45 CCCCCCCCCC Amb7757835 [0,2,0,0,0,0|2,0,0]=4 6406 B9R0.45 CCCCCCCCCCl Amb6652537 [0,2,0,0,0,0|2,0,0]=4 6407 B9R0.45 CCCCCCCCCF Amb8515361 [0,2,0,0,0,0|2,0,0]=4 6408 B9R0.45 CCCCCCCCCI Amb3940284 [0,2,0,0,0,0|2,0,0]=4 6409 B9R0.45 CCCCCCCCCN Amb3987584 [0,2,0,0,0,0|2,0,0]=4 6410 B9R0.45 CCCCCCCCCO Amb3940342 [0,2,0,0,0,0|1,0,0]=3 6411 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [0,2,0,0,0,0|2,0,0]=4 6412 B9R0.45 CCCCCCCCNC Amb7757640 [0,2,0,0,0,0|2,0,0]=4 6413 B9R0.45 CCCCCCCCNN Amb7786451 [0,2,0,0,0,0|2,0,0]=4 6414 B9R0.45 CCCCCCCCNO Amb28069968 [0,2,0,0,0,0|1,0,0]=3 6415 B9R0.45 CCCCCCCCON Amb2818885 [0,2,0,0,0,0|1,0,0]=3 6416 B9R0.45 CCCCCCCCSC Amb10553780 [0,2,0,0,0,0|1,1,0]=4 6417 B9R0.45 CCCCCCCN=C=O Amb3940866 [0,2,0,0,0,0|1,0,1]=4 6418 B9R0.45 CCCCCCCN=C=S Amb6860842 [0,2,0,0,0,0|1,1,0]=4 6419 B9R0.45 CCCCCCCN=[N+]=[N-] Amb17939437 [0,2,0,0,0,0|2,0,0]=4 6420 B9R0.45 CCCCCCCNC=O Amb27170738 [0,2,0,0,0,0|1,0,1]=4 6421 B9R0.45 CCCCCCCOC=O Amb9787223 [0,2,0,0,0,0|1,0,0]=3 6422 B9R0.45 CCCCCCCOCC Amb26332517 [0,2,0,0,0,0|1,0,0]=3 6423 B9R0.45 CCCCCCCSC#N Amb17939431 [0,2,0,0,0,0|1,1,0]=4 6424 B9R0.45 CCCCCCC\C=N\N Amb28193253 [0,2,0,0,0,0|2,0,0]=4 6425 B9R0.45 CCCCCCNCCC Amb6730565 [0,2,0,0,0,0|2,0,0]=4 6426 B9R0.45 CCCCCCNCCCl Amb27175028 [0,2,0,0,0,0|2,0,0]=4 6427 B9R0.45 CCCCCCNCCN Amb33611669 [0,2,0,0,0,0|2,0,0]=4 6428 B9R0.45 CCCCCCNCCN Amb9786764 [0,2,0,0,0,0|2,0,0]=4 6429 B9R0.45 CCCCCCNCCO Amb2720857 [0,2,0,0,0,0|1,0,0]=3 6430 B9R0.45 CCCCCCOCC#N Amb7792031 [0,2,0,0,0,0|1,0,1]=4 6431 B9R0.45 CCCCCCOCC=O Amb26624223 [0,2,0,0,0,0|0,0,2]=4 6432 B9R0.45 CCCCCCOCCC Amb27838831 [0,2,0,0,0,0|1,0,0]=3 6433 B9R0.45 CCCCCCOCCCl Amb8828502 [0,2,0,0,0,0|1,0,0]=3 6434 B9R0.45 CCCCCCOCCO Amb9787183 [0,2,0,0,0,0|0,0,0]=2 6435 B9R0.45 CCCCCCPCCN Amb28121064 [0,2,0,0,0,0|2,0,0]=4 6436 B9R0.45 CCCCCCSCCCl Amb22228746 [0,2,0,0,0,0|1,1,0]=4 6437 B9R0.45 CCCCCCSCCN Amb7794935 [0,2,0,0,0,0|1,1,0]=4 6438 B9R0.45 CCCCCC\C=C/CO Amb10807383 [0,2,0,0,0,0|1,0,0]=3 6439 B9R0.45 CCCCCC\C=C\CO Amb22168300 [0,2,0,0,0,0|1,0,0]=3 6440 B9R0.45 CCCCCC\C=C\OC Amb30621739 [0,2,0,0,0,0|1,0,1]=4 6441 B9R0.45 CCCCCNCCC#N Amb2690074 [0,2,0,0,0,0|2,0,0]=4 6442 B9R0.45 CCCCCNCCCBr Amb27171159 [0,2,0,0,0,0|2,0,0]=4 6443 B9R0.45 CCCCCNCCCC Amb6688183 [0,2,0,0,0,0|2,0,0]=4 6444 B9R0.45 CCCCCNCCCF Amb27757655 [0,2,0,0,0,0|2,0,0]=4 6445 B9R0.45 CCCCCNCCCN Amb17315271 [0,2,0,0,0,0|2,0,0]=4 6446 B9R0.45 CCCCCNCCCO Amb6733807 [0,2,0,0,0,0|1,0,0]=3 6447 B9R0.45 CCCCCNCCNC Amb2691992 [0,2,0,0,0,0|2,0,0]=4 6448 B9R0.45 CCCCCNCCOC Amb6708081 [0,2,0,0,0,0|1,0,0]=3 6449 B9R0.45 CCCCCOCCC=O Amb27628424 [0,2,0,0,0,0|0,0,1]=3 6450 B9R0.45 CCCCCSCCCF Amb28204722 [0,2,0,0,0,0|1,1,0]=4 6451 B9R0.45 CCCCCSCCCN Amb17500694 [0,2,0,0,0,0|1,1,0]=4 6452 B9R0.45 CCCCCSCCCO Amb17502837 [0,2,0,0,0,0|0,1,0]=3 6453 B9R0.45 CCCCCSCCSC Amb28282346 [0,2,0,0,0,0|0,2,0]=4 6454 B9R0.45 CCCCC\C=C/CCBr Amb27781314 [0,2,0,0,0,0|2,0,0]=4 6455 B9R0.45 CCCCC\C=C/CCO Amb9825885 [0,2,0,0,0,0|1,0,0]=3 6456 B9R0.45 CCCCC\C=C\CCBr Amb27864879 [0,2,0,0,0,0|2,0,0]=4 6457 B9R0.45 CCCCC\C=C\CCN Amb25123460 [0,2,0,0,0,0|2,0,0]=4 6458 B9R0.45 CCCCC\C=C\CCO Amb27953070 [0,2,0,0,0,0|1,0,0]=3 6459 B9R0.45 CCCCNCCCC#N Amb6709574 [0,2,0,0,0,0|2,0,0]=4 6460 B9R0.45 CCCCNCCCCBr Amb27403712 [0,2,0,0,0,0|2,0,0]=4 6461 B9R0.45 CCCCNCCCNC Amb24502382 [0,2,0,0,0,0|2,0,0]=4 6462 B9R0.45 CCCCNCCCOC Amb6730310 [0,2,0,0,0,0|1,0,0]=3 6463 B9R0.45 CCCCNCCOCC Amb9241010 [0,2,0,0,0,0|1,0,0]=3 6464 B9R0.45 CCCCNCCSSC Amb27975856 [0,2,0,0,0,0|1,1,0]=4 6465 B9R0.45 CCCCNC\C=C\CN Amb27391026 [0,2,0,0,0,0|2,0,0]=4 6466 B9R0.45 CCCCOCCCC#N Amb8895274 [0,2,0,0,0,0|1,0,0]=3 6467 B9R0.45 CCCCOCCCCBr Amb8895240 [0,2,0,0,0,0|1,0,0]=3 6468 B9R0.45 CCCCOCCCCCl Amb18798377 [0,2,0,0,0,0|1,0,0]=3 6469 B9R0.45 CCCCOCCCCO Amb19375051 [0,2,0,0,0,0|0,0,0]=2 6470 B9R0.45 CCCCOCCCON Amb27212384 [0,2,0,0,0,0|0,0,0]=2 6471 B9R0.45 CCCCOCCN=[N+]=[N-] Amb28077654 [0,2,0,0,0,0|1,0,0]=3 6472 B9R0.45 CCCCOCCNC#N Amb28193249 [0,2,0,0,0,0|1,0,0]=3 6473 B9R0.45 CCCCOCCOCC Amb25248413 [0,2,0,0,0,0|0,0,0]=2 6474 B9R0.45 CCCCOCCOCCl Amb28399346 [0,2,0,0,0,0|0,0,0]=2 6475 B9R0.45 CCCCOC\C=C/CBr Amb27798436 [0,2,0,0,0,0|1,0,0]=3 6476 B9R0.45 CCCCOC\C=C\CBr Amb28318470 [0,2,0,0,0,0|1,0,0]=3 6477 B9R0.45 CCCCOC\C=C\CN Amb27877410 [0,2,0,0,0,0|1,0,0]=3 6478 B9R0.45 CCCCOC\C=C\CO Amb28453524 [0,2,0,0,0,0|0,0,0]=2 6479 B9R0.45 CCCCOC\C=C\CS Amb27809829 [0,2,0,0,0,0|0,1,0]=3 6480 B9R0.45 CCCCSCCCCN Amb9480126 [0,2,0,0,0,0|1,1,0]=4 6481 B9R0.45 CCCCSCCCCS Amb28206440 [0,2,0,0,0,0|0,2,0]=4 6482 B9R0.45 CCCCSCCCOC Amb27651352 [0,2,0,0,0,0|0,1,0]=3 6483 B9R0.45 CCCCSCCOCC Amb10669603 [0,2,0,0,0,0|0,1,0]=3 6484 B9R0.45 CCCCSC\C=C\CO Amb28205928 [0,2,0,0,0,0|0,1,0]=3 6485 B9R0.45 CCCCSC\C=C\CS Amb27632116 [0,2,0,0,0,0|0,2,0]=4 6486 B9R0.45 CCCCSSCCCC Amb8513071 [0,2,0,0,0,0|1,1,0]=4 6487 B9R0.45 CCCC[Te][Te]CCCC Amb8515301 [0,2,0,0,0,0|1,1,0]=4 6488 B9R0.45 CCCC\C=C/CCCC Amb27196227 [0,2,0,0,0,0|2,0,0]=4 6489 B9R0.45 CCCC\C=C\C=C\CO Amb27445447 [0,2,0,0,0,0|1,0,1]=4 6490 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [0,2,0,0,0,0|1,0,1]=4 6491 B9R0.45 CCCC\C=C\CCCC Amb2721542 [0,2,0,0,0,0|2,0,0]=4 6492 B9R0.45 CCCNCCCCCBr Amb27614955 [0,2,0,0,0,0|2,0,0]=4 6493 B9R0.45 CCCNCCCCCO Amb17334254 [0,2,0,0,0,0|1,0,0]=3 6494 B9R0.45 CCCNCCCCSC Amb18798068 [0,2,0,0,0,0|1,1,0]=4 6495 B9R0.45 CCCNCCCSCC Amb18177748 [0,2,0,0,0,0|2,0,0]=4 6496 B9R0.45 CCCNCCNCCF Amb27945344 [0,2,0,0,0,0|2,0,0]=4 6497 B9R0.45 CCCNCCNCCO Amb24644910 [0,2,0,0,0,0|1,0,0]=3 6498 B9R0.45 CCCNCCOCC#N Amb28140114 [0,2,0,0,0,0|1,0,1]=4 6499 B9R0.45 CCCNCCOCCCl Amb27652262 [0,2,0,0,0,0|1,0,0]=3 6500 B9R0.45 CCCNCCOCCF Amb27794080 [0,2,0,0,0,0|1,0,0]=3 6501 B9R0.45 CCCNCCOCCO Amb6736235 [0,2,0,0,0,0|0,0,0]=2 6502 B9R0.45 CCCNCCSCCN Amb28192624 [0,2,0,0,0,0|1,1,0]=4 6503 B9R0.45 CCCOCCC#CCO Amb27763825 [0,2,0,0,0,0|1,0,1]=4 6504 B9R0.45 CCCOCCCCCBr Amb27494337 [0,2,0,0,0,0|1,0,0]=3 6505 B9R0.45 CCCOCCCCCN Amb27869443 [0,2,0,0,0,0|1,0,0]=3 6506 B9R0.45 CCCOCCCN=C=S Amb27425148 [0,2,0,0,0,0|1,0,1]=4 6507 B9R0.45 CCCOCCCNC=O Amb27453700 [0,2,0,0,0,0|1,0,1]=4 6508 B9R0.45 CCCOCCNCCBr Amb28281047 [0,2,0,0,0,0|1,0,0]=3 6509 B9R0.45 CCCOCCNOCC Amb27617220 [0,2,0,0,0,0|1,0,0]=3 6510 B9R0.45 CCCOCCOCC#N Amb28429850 [0,2,0,0,0,0|1,0,1]=4 6511 B9R0.45 CCCOCCOCCC Amb27441214 [0,2,0,0,0,0|1,0,0]=3 6512 B9R0.45 CCCOCCOCCO Amb22351569 [0,2,0,0,0,0|0,0,0]=2 6513 B9R0.45 CCCOC\C=C\CCBr Amb27621713 [0,2,0,0,0,0|1,0,1]=4 6514 B9R0.45 CCCO\N=C\CCCO Amb27604558 [0,2,0,0,0,0|1,0,1]=4 6515 B9R0.45 CCCSCCCCC#N Amb18178253 [0,2,0,0,0,0|1,1,0]=4 6516 B9R0.45 CCCSCCCCCBr Amb27603024 [0,2,0,0,0,0|1,1,0]=4 6517 B9R0.45 CCCSCCCCCCl Amb9304986 [0,2,0,0,0,0|1,1,0]=4 6518 B9R0.45 CCCSCCCCCS Amb27431515 [0,2,0,0,0,0|1,1,0]=4 6519 B9R0.45 CCCSCCNCCN Amb27400239 [0,2,0,0,0,0|1,1,0]=4 6520 B9R0.45 CCCSCCNCCO Amb27618844 [0,2,0,0,0,0|1,0,0]=3 6521 B9R0.45 CCCSCCOCCCl Amb27764394 [0,2,0,0,0,0|1,0,0]=3 6522 B9R0.45 CCCSCCOCCN Amb17501983 [0,2,0,0,0,0|1,0,0]=3 6523 B9R0.45 CCCSCCOCCS Amb27833892 [0,2,0,0,0,0|0,1,0]=3 6524 B9R0.45 CCCSCCSCCC Amb4019972 [0,2,0,0,0,0|1,1,0]=4 6525 B9R0.45 CCCSCCSCCCl Amb28076466 [0,2,0,0,0,0|1,1,0]=4 6526 B9R0.45 CCCSCCSCCO Amb27433297 [0,2,0,0,0,0|0,1,0]=3 6527 B9R0.45 CCC\C=C\C#CCCO Amb27485438 [0,2,0,0,0,0|1,0,1]=4 6528 B9R0.45 CCC\C=C\CC#CCO Amb27838882 [0,2,0,0,0,0|1,0,1]=4 6529 B9R0.45 CCC\C=C\CCCCC Amb22231673 [0,2,0,0,0,0|2,0,0]=4 6530 B9R0.45 CCC\C=C\CCCCN Amb33373745 [0,2,0,0,0,0|2,0,0]=4 6531 B9R0.45 CCC\C=N\NCCCO Amb27396709 [0,2,0,0,0,0|1,0,1]=4 6532 B9R0.45 CCC\C=N\OCCSC Amb27411002 [0,2,0,0,0,0|0,1,1]=4 6533 B9R0.45 CCNCCCCCCN Amb25855319 [0,2,0,0,0,0|2,0,0]=4 6534 B9R0.45 CCNCCCCCOC Amb28186272 [0,2,0,0,0,0|1,0,0]=3 6535 B9R0.45 CCNCCCCCSC Amb27167121 [0,2,0,0,0,0|1,1,0]=4 6536 B9R0.45 CCNCCCCNCC Amb20621746 [0,2,0,0,0,0|2,0,0]=4 6537 B9R0.45 CCNCCCNCCBr Amb27411819 [0,2,0,0,0,0|2,0,0]=4 6538 B9R0.45 CCNCCCNCCO Amb27770477 [0,2,0,0,0,0|1,0,0]=3 6539 B9R0.45 CCNCCCOCCCl Amb28068633 [0,2,0,0,0,0|1,0,0]=3 6540 B9R0.45 CCNCCOCCOC Amb24672932 [0,2,0,0,0,0|0,0,0]=2 6541 B9R0.45 CCNCCSCCOC Amb18788239 [0,2,0,0,0,0|0,1,0]=3 6542 B9R0.45 CCN\N=C\CCCCO Amb27457985 [0,2,0,0,0,0|1,0,1]=4 6543 B9R0.45 CCOCCCCCCS Amb27834959 [0,2,0,0,0,0|1,1,0]=4 6544 B9R0.45 CCOCCCCOCC Amb10807403 [0,2,0,0,0,0|2,0,0]=4 6545 B9R0.45 CCOCCCNCCBr Amb27822856 [0,2,0,0,0,0|2,0,0]=4 6546 B9R0.45 CCOCCCNCCI Amb27393933 [0,2,0,0,0,0|2,0,0]=4 6547 B9R0.45 CCOCCCNCCS Amb27412412 [0,2,0,0,0,0|1,1,0]=4 6548 B9R0.45 CCOCCCOCCN Amb27849613 [0,2,0,0,0,0|1,0,0]=3 6549 B9R0.45 CCOCCNCCCBr Amb28049448 [0,2,0,0,0,0|2,0,0]=4 6550 B9R0.45 CCOCCNCCCN Amb27391621 [0,2,0,0,0,0|2,0,0]=4 6551 B9R0.45 CCOCCNCCNC Amb28382584 [0,2,0,0,0,0|2,0,0]=4 6552 B9R0.45 CCOCCNCCSC Amb18183509 [0,2,0,0,0,0|1,1,0]=4 6553 B9R0.45 CCOCCOCCC=O Amb27167183 [0,2,0,0,0,0|0,0,1]=3 6554 B9R0.45 CCOCCOCCCBr Amb8828207 [0,2,0,0,0,0|1,0,0]=3 6555 B9R0.45 CCOCCOCCCN Amb6246853 [0,2,0,0,0,0|1,0,0]=3 6556 B9R0.45 CCOCCOCCNC Amb28049307 [0,2,0,0,0,0|1,0,0]=3 6557 B9R0.45 CCOCCOCCOC Amb8394637 [0,2,0,0,0,0|0,0,0]=2 6558 B9R0.45 CCOCCSCCCO Amb27830336 [0,2,0,0,0,0|0,1,0]=3 6559 B9R0.45 CCOCCSCCNC Amb28146212 [0,2,0,0,0,0|1,1,0]=4 6560 B9R0.45 CCOCCSCSCC Amb27179618 [0,2,0,0,0,0|1,1,0]=4 6561 B9R0.45 CCOCOCCCCBr Amb28388750 [0,2,0,0,0,0|1,0,0]=3 6562 B9R0.45 CCONCCCCCO Amb28245082 [0,2,0,0,0,0|1,0,0]=3 6563 B9R0.45 CCSCCCCCCCl Amb18186755 [0,2,0,0,0,0|2,0,0]=4 6564 B9R0.45 CCSCCCCSCC Amb4017492 [0,2,0,0,0,0|2,0,0]=4 6565 B9R0.45 CCSCCCNCCBr Amb27442249 [0,2,0,0,0,0|2,0,0]=4 6566 B9R0.45 CCSCCCNCCCl Amb27982314 [0,2,0,0,0,0|2,0,0]=4 6567 B9R0.45 CCSCCCNCCN Amb27669366 [0,2,0,0,0,0|2,0,0]=4 6568 B9R0.45 CCSCCNCCCBr Amb27171099 [0,2,0,0,0,0|2,0,0]=4 6569 B9R0.45 CCSCCNCCCF Amb27165285 [0,2,0,0,0,0|2,0,0]=4 6570 B9R0.45 CCSCCNCCCO Amb27797112 [0,2,0,0,0,0|1,0,0]=3 6571 B9R0.45 CCSCCOCCCS Amb27971481 [0,2,0,0,0,0|0,1,0]=3 6572 B9R0.45 CCSCCSCCCO Amb27489348 [0,2,0,0,0,0|0,1,0]=3 6573 B9R0.45 CCSCCSCCSC Amb28062167 [0,2,0,0,0,0|0,2,0]=4 6574 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [0,2,0,0,0,0|0,0,2]=4 6575 B9R0.45 CC\C=C/CC\C=C\CO Amb8515211 [0,2,0,0,0,0|1,0,1]=4 6576 B9R0.45 CC\C=C/C\C=C/CCO Amb22226805 [0,2,0,0,0,0|1,0,1]=4 6577 B9R0.45 CC\C=C\CCCCCC Amb22231672 [0,2,0,0,0,0|2,0,0]=4 6578 B9R0.45 CC\C=C\CNCCOC Amb27432873 [0,2,0,0,0,0|1,0,1]=4 6579 B9R0.45 CC\C=C\COCCCC Amb25912010 [0,2,0,0,0,0|1,0,0]=3 6580 B9R0.45 CC\C=C\C\C=C\CCO Amb27982236 [0,2,0,0,0,0|1,0,1]=4 6581 B9R0.45 CC\N=N\CCCCCO Amb27631929 [0,2,0,0,0,0|1,0,0]=3 6582 B9R0.45 CNCCCCCCC#N Amb27192989 [0,2,0,0,0,0|2,0,0]=4 6583 B9R0.45 CNCCCCCCNC Amb9826092 [0,2,0,0,0,0|2,0,0]=4 6584 B9R0.45 CNCCCCNCCO Amb27630866 [0,2,0,0,0,0|1,0,0]=3 6585 B9R0.45 CNCCCNCCCN Amb27617090 [0,2,0,0,0,0|2,0,0]=4 6586 B9R0.45 CNCCCNCCOC Amb20171974 [0,2,0,0,0,0|1,0,0]=3 6587 B9R0.45 CNCCCOCCOC Amb27768848 [0,2,0,0,0,0|0,0,0]=2 6588 B9R0.45 CNCCCSCCSC Amb27165838 [0,2,0,0,0,0|0,2,0]=4 6589 B9R0.45 CNCCOCCCOC Amb21954035 [0,2,0,0,0,0|1,0,0]=3 6590 B9R0.45 CNCCOCCCSC Amb27650781 [0,2,0,0,0,0|1,0,0]=3 6591 B9R0.45 CNCCSCCCCO Amb28193864 [0,2,0,0,0,0|1,0,0]=3 6592 B9R0.45 COCCCCCCCCl Amb28066514 [0,2,0,0,0,0|1,0,0]=3 6593 B9R0.45 COCCCCCCOC Amb10807404 [0,2,0,0,0,0|1,0,0]=3 6594 B9R0.45 COCCCCNCCBr Amb27847371 [0,2,0,0,0,0|2,0,0]=4 6595 B9R0.45 COCCCCNCCO Amb28368980 [0,2,0,0,0,0|1,0,0]=3 6596 B9R0.45 COCCCCOCCN Amb28047109 [0,2,0,0,0,0|1,0,0]=3 6597 B9R0.45 COCCCCSCCN Amb27951686 [0,2,0,0,0,0|1,1,0]=4 6598 B9R0.45 COCCCNCCC#N Amb8841110 [0,2,0,0,0,0|2,0,0]=4 6599 B9R0.45 COCCCNCCCN Amb17315264 [0,2,0,0,0,0|2,0,0]=4 6600 B9R0.45 COCCCNCCCO Amb17308606 [0,2,0,0,0,0|1,0,0]=3 6601 B9R0.45 COCCCNCCOC Amb8841615 [0,2,0,0,0,0|1,0,0]=3 6602 B9R0.45 COCCCNCCSC Amb18800727 [0,2,0,0,0,0|1,1,0]=4 6603 B9R0.45 COCCCOCCC#N Amb28041771 [0,2,0,0,0,0|1,0,0]=3 6604 B9R0.45 COCCCOCCCN Amb28196278 [0,2,0,0,0,0|1,0,0]=3 6605 B9R0.45 COCCCOCCCO Amb20242414 [0,2,0,0,0,0|0,0,0]=2 6606 B9R0.45 COCCCOCCON Amb27817087 [0,2,0,0,0,0|0,0,0]=2 6607 B9R0.45 COCCCSCCC#N Amb28287619 [0,2,0,0,0,0|1,1,0]=4 6608 B9R0.45 COCCCSCCCCl Amb27393495 [0,2,0,0,0,0|1,1,0]=4 6609 B9R0.45 COCCCSCCCS Amb28058832 [0,2,0,0,0,0|0,2,0]=4 6610 B9R0.45 COCCCSCCOC Amb28064860 [0,2,0,0,0,0|0,1,0]=3 6611 B9R0.45 COCCNCCCSC Amb6719616 [0,2,0,0,0,0|1,0,0]=3 6612 B9R0.45 COCCOCCCC#N Amb6278119 [0,2,0,0,0,0|0,0,1]=3 6613 B9R0.45 COCCOCCCCBr Amb8855450 [0,2,0,0,0,0|0,0,0]=2 6614 B9R0.45 COCCOCCCCCl Amb18798737 [0,2,0,0,0,0|0,0,0]=2 6615 B9R0.45 COCCOCCCCN Amb6250163 [0,2,0,0,0,0|0,0,0]=2 6616 B9R0.45 COCCOCCCNN Amb27244139 [0,2,0,0,0,0|1,0,0]=3 6617 B9R0.45 COCCOCCN=C=O Amb18559240 [0,2,0,0,0,0|1,0,1]=4 6618 B9R0.45 COCCOCCN=[N+]=[N-] Amb24057924 [0,2,0,0,0,0|2,0,0]=4 6619 B9R0.45 COCCOCCNC#N Amb27475773 [0,2,0,0,0,0|1,0,1]=4 6620 B9R0.45 COCCOCCNOC Amb27806535 [0,2,0,0,0,0|1,0,0]=3 6621 B9R0.45 COCCOCOCCO Amb28189033 [0,2,0,0,0,0|0,0,0]=2 6622 B9R0.45 COCCOC\C=C\CN Amb27459640 [0,2,0,0,0,0|0,0,2]=4 6623 B9R0.45 COCCONCCCF Amb27632576 [0,2,0,0,0,0|1,0,0]=3 6624 B9R0.45 COCCONCCCO Amb27477812 [0,2,0,0,0,0|1,0,0]=3 6625 B9R0.45 COCCSCCCC#N Amb9305283 [0,2,0,0,0,0|0,1,1]=4 6626 B9R0.45 COCCSCCCCF Amb28064856 [0,2,0,0,0,0|0,1,0]=3 6627 B9R0.45 COCCSCCCON Amb27199029 [0,2,0,0,0,0|1,1,0]=4 6628 B9R0.45 COCCSCCOCCl Amb28184961 [0,2,0,0,0,0|1,1,0]=4 6629 B9R0.45 COCOCC#CCCO Amb27621779 [0,2,0,0,0,0|1,0,1]=4 6630 B9R0.45 COCOCCCCCBr Amb27408460 [0,2,0,0,0,0|2,0,0]=4 6631 B9R0.45 COCOCCCCCN Amb28291853 [0,2,0,0,0,0|2,0,0]=4 6632 B9R0.45 COCOCCCCCO Amb27839456 [0,2,0,0,0,0|1,0,0]=3 6633 B9R0.45 COCOCCOCCO Amb28205950 [0,2,0,0,0,0|0,0,0]=2 6634 B9R0.45 CONCCCCCCO Amb27952629 [0,2,0,0,0,0|1,0,0]=3 6635 B9R0.45 CSCCCCCCCN Amb27860341 [0,2,0,0,0,0|1,1,0]=4 6636 B9R0.45 CSCCCCCCSC Amb6366244 [0,2,0,0,0,0|1,1,0]=4 6637 B9R0.45 CSCCCCNCCF Amb27591973 [0,2,0,0,0,0|2,0,0]=4 6638 B9R0.45 CSCCCCNCCN Amb27770492 [0,2,0,0,0,0|2,0,0]=4 6639 B9R0.45 CSCCCC\C=C\CO Amb27604531 [0,2,0,0,0,0|1,0,1]=4 6640 B9R0.45 CSCCCNCCCBr Amb27235561 [0,2,0,0,0,0|2,0,0]=4 6641 B9R0.45 CSCCCSCCCF Amb27171622 [0,2,0,0,0,0|1,1,0]=4 6642 B9R0.45 CSCCCSCCCO Amb28132547 [0,2,0,0,0,0|0,1,0]=3 6643 B9R0.45 CSCCCSCCON Amb27402152 [0,2,0,0,0,0|0,1,0]=3 6644 B9R0.45 CSCCOCCCC#N Amb27944940 [0,2,0,0,0,0|0,1,1]=4 6645 B9R0.45 CSCCOCCCCCl Amb28041418 [0,2,0,0,0,0|0,1,0]=3 6646 B9R0.45 CSCCOCCCCS Amb27834483 [0,2,0,0,0,0|0,1,0]=3 6647 B9R0.45 CSCCOC\C=C\CCl Amb28369177 [0,2,0,0,0,0|2,0,0]=4 6648 B9R0.45 CSCCOC\C=C\CS Amb27188248 [0,2,0,0,0,0|1,1,0]=4 6649 B9R0.45 CSCCSCCCCBr Amb27758249 [0,2,0,0,0,0|0,2,0]=4 6650 B9R0.45 CSCCSCCCCS Amb28382933 [0,2,0,0,0,0|0,2,0]=4 6651 B9R0.45 CSC\C=C\CCCCO Amb27603346 [0,2,0,0,0,0|1,0,1]=4 6652 B9R0.45 C\C=C/CCCCCCC Amb26019969 [0,2,0,0,0,0|2,0,0]=4 6653 B9R0.45 C\C=C\CCCCCCO Amb27980554 [0,2,0,0,0,0|1,0,0]=3 6654 B9R0.45 C\C=C\CCNCCCC Amb27789929 [0,2,0,0,0,0|2,0,0]=4 6655 B9R0.45 C\C=C\CC\C=C\CCO Amb27210858 [0,2,0,0,0,0|1,0,1]=4 6656 B9R0.45 C\C=C\COCCCNC Amb27487855 [0,2,0,0,0,0|1,0,1]=4 6657 B9R0.45 C\C=C\OCCCCCO Amb28350349 [0,2,0,0,0,0|1,0,1]=4 6658 B9R0.45 ClCCCCCCCCCl Amb2721447 [0,2,0,0,0,0|2,0,0]=4 6659 B9R0.45 ClCCCCCCOCCl Amb28126752 [0,2,0,0,0,0|2,0,0]=4 6660 B9R0.45 ClCCNCCNCCCl Amb27811997 [0,2,0,0,0,0|2,0,0]=4 6661 B9R0.45 ClCCOCCOCCCl Amb2684744 [0,2,0,0,0,0|1,0,0]=3 6662 B9R0.45 FCCCCCCCCBr Amb27265588 [0,2,0,0,0,0|2,0,0]=4 6663 B9R0.45 FCCCCCCCCCl Amb28067739 [0,2,0,0,0,0|2,0,0]=4 6664 B9R0.45 FCCCCCCCCF Amb22641491 [0,2,0,0,0,0|2,0,0]=4 6665 B9R0.45 FCCCCCNCCCl Amb28126872 [0,2,0,0,0,0|2,0,0]=4 6666 B9R0.45 FCCCCCNCCF Amb28069963 [0,2,0,0,0,0|2,0,0]=4 6667 B9R0.45 FCCCCCSCCCl Amb28063270 [0,2,0,0,0,0|1,1,0]=4 6668 B9R0.45 FCCCCNCCCBr Amb27263407 [0,2,0,0,0,0|2,0,0]=4 6669 B9R0.45 FCCCNCCCCBr Amb27199870 [0,2,0,0,0,0|2,0,0]=4 6670 B9R0.45 FCCNCCCCCBr Amb27664326 [0,2,0,0,0,0|2,0,0]=4 6671 B9R0.45 FCCNCCOCCCl Amb27837873 [0,2,0,0,0,0|1,0,0]=3 6672 B9R0.45 ICCOCCOCCI Amb8517603 [0,2,0,0,0,0|1,0,0]=3 6673 B9R0.45 N#CCCCCC#CCO Amb27770509 [0,2,0,0,0,0|1,0,1]=4 6674 B9R0.45 N#CCCCCCCCN Amb27867353 [0,2,0,0,0,0|2,0,0]=4 6675 B9R0.45 N#CCCCCNCCF Amb27858508 [0,2,0,0,0,0|2,0,0]=4 6676 B9R0.45 N#CCCCCNCCN Amb27976894 [0,2,0,0,0,0|2,0,0]=4 6677 B9R0.45 N#CCCCCSCCN Amb8876140 [0,2,0,0,0,0|1,1,0]=4 6678 B9R0.45 N#CCCCC\C=C\CO Amb27770521 [0,2,0,0,0,0|1,0,1]=4 6679 B9R0.45 N#CCCC\C=C\CCO Amb28050627 [0,2,0,0,0,0|1,0,1]=4 6680 B9R0.45 N#CCSCCOCCN Amb17501988 [0,2,0,0,0,0|1,0,1]=4 6681 B9R0.45 NCCCCCCCCN Amb8387247 [0,2,0,0,0,0|2,0,0]=4 6682 B9R0.45 NCCCCCCCCO Amb24116967 [0,2,0,0,0,0|1,0,0]=3 6683 B9R0.45 NCCCCCNCCCl Amb27804050 [0,2,0,0,0,0|2,0,0]=4 6684 B9R0.45 NCCCCCNCCO Amb8394909 [0,2,0,0,0,0|1,0,0]=3 6685 B9R0.45 NCCCCCOCCF Amb27242054 [0,2,0,0,0,0|1,0,0]=3 6686 B9R0.45 NCCCCNCCCCl Amb24117237 [0,2,0,0,0,0|2,0,0]=4 6687 B9R0.45 NCCCCNCCCCl Amb28067741 [0,2,0,0,0,0|2,0,0]=4 6688 B9R0.45 NCCCCNCCCF Amb26506888 [0,2,0,0,0,0|2,0,0]=4 6689 B9R0.45 NCCCCNCCCN Amb8514497 [0,2,0,0,0,0|2,0,0]=4 6690 B9R0.45 NCCCCNCCCO Amb27473423 [0,2,0,0,0,0|1,0,0]=3 6691 B9R0.45 NCCCCNCCON Amb28058839 [0,2,0,0,0,0|1,0,0]=3 6692 B9R0.45 NCCCCOC\C=C\Cl Amb27431761 [0,2,0,0,0,0|1,0,1]=4 6693 B9R0.45 NCCCCSCCCO Amb17500966 [0,2,0,0,0,0|0,1,0]=3 6694 B9R0.45 NCCCNCCCON Amb27629053 [0,2,0,0,0,0|2,0,0]=4 6695 B9R0.45 NCCCOCCCCO Amb28454517 [0,2,0,0,0,0|1,0,0]=3 6696 B9R0.45 NCCCSCCCCF Amb27770557 [0,2,0,0,0,0|1,1,0]=4 6697 B9R0.45 NCCCSCCCON Amb27857566 [0,2,0,0,0,0|1,1,0]=4 6698 B9R0.45 NCCNCCCCCF Amb27661429 [0,2,0,0,0,0|2,0,0]=4 6699 B9R0.45 NCCNCCNCCCl Amb27607084 [0,2,0,0,0,0|2,0,0]=4 6700 B9R0.45 NCCNCCNCCN Amb8395678 [0,2,0,0,0,0|2,0,0]=4 6701 B9R0.45 NCCNCCNCCO Amb17593677 [0,2,0,0,0,0|1,0,0]=3 6702 B9R0.45 NCCNCCOCCO Amb24376947 [0,2,0,0,0,0|0,0,0]=2 6703 B9R0.45 NCCNCCSCCN Amb28384901 [0,2,0,0,0,0|1,1,0]=4 6704 B9R0.45 NCCOCCCCCF Amb27660390 [0,2,0,0,0,0|1,0,0]=3 6705 B9R0.45 NCCOCCCOCN Amb27790445 [0,2,0,0,0,0|1,0,0]=3 6706 B9R0.45 NCCOCCOCCF Amb28369775 [0,2,0,0,0,0|1,0,0]=3 6707 B9R0.45 NCCOCCOCCN Amb2583233 [0,2,0,0,0,0|1,0,0]=3 6708 B9R0.45 NCCOCCOCCO Amb10604950 [0,2,0,0,0,0|0,0,0]=2 6709 B9R0.45 NCCOCCSCCO Amb17501998 [0,2,0,0,0,0|0,1,0]=3 6710 B9R0.45 NCCSCCOCCO Amb18792709 [0,2,0,0,0,0|0,0,0]=2 6711 B9R0.45 NCCSCCSCCN Amb21953303 [0,2,0,0,0,0|1,1,0]=4 6712 B9R0.45 NCCSCCSCCN Amb27858857 [0,2,0,0,0,0|1,1,0]=4 6713 B9R0.45 O=C=NCCCCCCO Amb27873254 [0,2,0,0,0,0|1,0,1]=4 6714 B9R0.45 O=CCCCCCCCF Amb25075653 [0,2,0,0,0,0|1,0,1]=4 6715 B9R0.45 O=CCCCCCCCO Amb25765567 [0,2,0,0,0,0|1,0,0]=3 6716 B9R0.45 O=CCOCCOCCO Amb26024891 [0,2,0,0,0,0|0,0,1]=3 6717 B9R0.45 OCCC=C=CCCCO Amb28188308 [0,2,0,0,0,0|1,0,1]=4 6718 B9R0.45 OCCCC#CCCCO Amb26558079 [0,2,0,0,0,0|1,0,1]=4 6719 B9R0.45 OCCCCCCC#CI Amb32643987 [0,2,0,0,0,0|1,0,1]=4 6720 B9R0.45 OCCCCCCCCBr Amb4296902 [0,2,0,0,0,0|1,0,0]=3 6721 B9R0.45 OCCCCCCCCCl Amb6366711 [0,2,0,0,0,0|1,0,0]=3 6722 B9R0.45 OCCCCCCCCF Amb25330666 [0,2,0,0,0,0|1,0,0]=3 6723 B9R0.45 OCCCCCCCCI Amb32411246 [0,2,0,0,0,0|1,0,0]=3 6724 B9R0.45 OCCCCCCCCO Amb8383419 [0,2,0,0,0,0|1,0,0]=3 6725 B9R0.45 OCCCCCCCCS Amb28046913 [0,2,0,0,0,0|1,0,0]=3 6726 B9R0.45 OCCCCCOCCCl Amb28321747 [0,2,0,0,0,0|1,0,0]=3 6727 B9R0.45 OCCCCCOCCO Amb27847385 [0,2,0,0,0,0|0,0,0]=2 6728 B9R0.45 OCCCCCSCCO Amb18800854 [0,2,0,0,0,0|0,1,0]=3 6729 B9R0.45 OCCCCOCC#CCl Amb27978293 [0,2,0,0,0,0|1,0,1]=4 6730 B9R0.45 OCCCCOCCCO Amb27218138 [0,2,0,0,0,0|0,0,0]=2 6731 B9R0.45 OCCCC\C=C\CCBr Amb27646614 [0,2,0,0,0,0|1,0,1]=4 6732 B9R0.45 OCCCC\C=C\CCI Amb22364697 [0,2,0,0,0,0|1,0,1]=4 6733 B9R0.45 OCCCNCCCCF Amb27752581 [0,2,0,0,0,0|1,0,0]=3 6734 B9R0.45 OCCCSCCCCF Amb28204584 [0,2,0,0,0,0|0,1,0]=3 6735 B9R0.45 OCCCSCCCCS Amb27452872 [0,2,0,0,0,0|0,1,0]=3 6736 B9R0.45 OCCCSSCCCO Amb24573663 [0,2,0,0,0,0|1,1,0]=4 6737 B9R0.45 OCCC\C=C/CCCCl Amb27437510 [0,2,0,0,0,0|1,0,1]=4 6738 B9R0.45 OCCNCCCCCF Amb27805496 [0,2,0,0,0,0|1,0,0]=3 6739 B9R0.45 OCCNCCNCCO Amb3986551 [0,2,0,0,0,0|1,0,0]=3 6740 B9R0.45 OCCNCCOCCO Amb9787082 [0,2,0,0,0,0|0,0,0]=2 6741 B9R0.45 OCCOCCOCCBr Amb24057506 [0,2,0,0,0,0|0,0,0]=2 6742 B9R0.45 OCCOCCOCCCl Amb9787115 [0,2,0,0,0,0|0,0,0]=2 6743 B9R0.45 OCCOCCOCCF Amb24082372 [0,2,0,0,0,0|0,0,0]=2 6744 B9R0.45 OCCOCCOCCI Amb22497537 [0,2,0,0,0,0|0,0,0]=2 6745 B9R0.45 OCCOCCOCCO Amb33820646 [0,2,0,0,0,0|0,0,0]=2 6746 B9R0.45 OCCOCCOCCO Amb34915482 [0,2,0,0,0,0|0,0,0]=2 6747 B9R0.45 OCCOCCOCCO Amb6608820 [0,2,0,0,0,0|0,0,0]=2 6748 B9R0.45 OCCOCCOCCS Amb17613418 [0,2,0,0,0,0|0,0,0]=2 6749 B9R0.45 OCCOCCSCCO Amb18180098 [0,2,0,0,0,0|0,0,0]=2 6750 B9R0.45 OCCSCCOCCCl Amb28118946 [0,2,0,0,0,0|0,1,0]=3 6751 B9R0.45 OCCSCCOCCS Amb28050612 [0,2,0,0,0,0|0,1,0]=3 6752 B9R0.45 OCCSCCSCCCl Amb27455143 [0,2,0,0,0,0|0,1,0]=3 6753 B9R0.45 OCCSCCSCCO Amb1200412 [0,2,0,0,0,0|0,1,0]=3 6754 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [0,2,0,0,0,0|1,0,1]=4 6755 B9R0.45 OC\C=C\CCCCCO Amb27204813 [0,2,0,0,0,0|1,0,1]=4 6756 B9R0.45 SCCNCCNCCS Amb27461939 [0,2,0,0,0,0|1,1,0]=4 6757 B9R0.45 [*]CCOCCOCC[*] Amb28983996 [0,2,0,0,0,0|1,0,0]=3 6758 B9R0.45 [C-]#[N+]CCCOCCCC Amb3973111 [0,2,0,0,0,0|1,0,0]=3 6759 B9R0.45 [N-]=[N+]=NCCCCCCO Amb27759380 [0,2,0,0,0,0|2,0,0]=4 6760 B9R0.45 [N-]=[N+]=NCOCCCCO Amb27965370 [0,2,0,0,0,0|2,0,0]=4 6761 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [0,2,0,0,0,0|2,0,0]=4 6762 B9R0.46 C#CC(Br)CCCCCC Amb17939781 [0,2,0,0,0,0|2,0,0]=4 6763 B9R0.46 C#CC(C)NCCCCO Amb27228684 [0,2,0,0,0,0|2,0,0]=4 6764 B9R0.46 C#CC(Cl)CCCCCC Amb28320596 [0,2,0,0,0,0|2,0,0]=4 6765 B9R0.46 C#CC(O)C#CCCCC Amb28344513 [0,2,0,0,0,0|1,0,1]=4 6766 B9R0.46 C#CC(O)CCCCCBr Amb22388470 [0,2,0,0,0,0|2,0,0]=4 6767 B9R0.46 C#CC(O)CCCCCC Amb27838900 [0,2,0,0,0,0|1,0,0]=3 6768 B9R0.46 C#CC(O)CCCCCCl Amb28126894 [0,2,0,0,0,0|2,0,0]=4 6769 B9R0.46 C#CC(O)CCCOCC Amb28401329 [0,2,0,0,0,0|2,0,0]=4 6770 B9R0.46 C#CC(O)\C=C\CCCC Amb28050685 [0,2,0,0,0,0|1,0,1]=4 6771 B9R0.46 C#CCCCCC(Br)CC Amb28320070 [0,2,0,0,0,0|2,0,0]=4 6772 B9R0.46 C#CCCCCC(O)CC Amb27839167 [0,2,0,0,0,0|2,0,0]=4 6773 B9R0.46 C#CCCCC[C@@H](O)CC Amb27981324 [0,2,0,0,0,0|2,0,0]=4 6774 B9R0.46 C#CCCCC[C@H](O)CC Amb27981609 [0,2,0,0,0,0|2,0,0]=4 6775 B9R0.46 C#CCCNCC(O)CC Amb28079271 [0,2,0,0,0,0|2,0,0]=4 6776 B9R0.46 C#CCCNC[C@@H](O)CC Amb27248944 [0,2,0,0,0,0|2,0,0]=4 6777 B9R0.46 C#CCCSCC(C)CC Amb27766820 [0,2,0,0,0,0|1,1,0]=4 6778 B9R0.46 C#CCCSCC(N)CC Amb27607634 [0,2,0,0,0,0|1,1,0]=4 6779 B9R0.46 C#C[C@H](O)CCCCCC Amb27970533 [0,2,0,0,0,0|1,0,0]=3 6780 B9R0.46 C=C(CC)COCCCN Amb28064279 [0,2,0,0,0,0|1,0,1]=4 6781 B9R0.46 C=C(CC)COCCNC Amb27853310 [0,2,0,0,0,0|1,0,1]=4 6782 B9R0.46 C=C(CC)CSCCCC Amb28370393 [0,2,0,0,0,0|1,1,0]=4 6783 B9R0.46 C=C(CS)COCCSC Amb27399947 [0,2,0,0,0,0|1,1,0]=4 6784 B9R0.46 C=CC(C)CNCCCC Amb27785858 [0,2,0,0,0,0|2,0,0]=4 6785 B9R0.46 C=CC(C)OCCNCC Amb27777855 [0,2,0,0,0,0|1,0,1]=4 6786 B9R0.46 C=CC(Cl)CCCCCC Amb26636765 [0,2,0,0,0,0|2,0,0]=4 6787 B9R0.46 C=CC(Cl)CCOCCCl Amb28384138 [0,2,0,0,0,0|1,0,1]=4 6788 B9R0.46 C=CC(N)CCOCCC Amb28050316 [0,2,0,0,0,0|1,0,1]=4 6789 B9R0.46 C=CC(O)CCCCCC Amb8515213 [0,2,0,0,0,0|1,0,0]=3 6790 B9R0.46 C=CC(O)CCCCOC Amb27839199 [0,2,0,0,0,0|2,0,0]=4 6791 B9R0.46 C=CC(O)CCCOCC Amb27766080 [0,2,0,0,0,0|2,0,0]=4 6792 B9R0.46 C=CC(O)CNCCOC Amb27424788 [0,2,0,0,0,0|2,0,0]=4 6793 B9R0.46 C=CC(O)COCCCC Amb27839257 [0,2,0,0,0,0|0,0,0]=2 6794 B9R0.46 C=CCCCCC(Br)CO Amb28120546 [0,2,0,0,0,0|1,0,1]=4 6795 B9R0.46 C=CCCCCC(Cl)CC Amb28182453 [0,2,0,0,0,0|2,0,0]=4 6796 B9R0.46 C=CCCCCC(F)CO Amb28401074 [0,2,0,0,0,0|1,0,1]=4 6797 B9R0.46 C=CCCCCC(O)CO Amb3940525 [0,2,0,0,0,0|1,0,1]=4 6798 B9R0.46 C=CCCCC[C@H](O)CO Amb27839187 [0,2,0,0,0,0|1,0,1]=4 6799 B9R0.46 C=CCCCNC(C)CO Amb28186828 [0,2,0,0,0,0|1,0,1]=4 6800 B9R0.46 C=CCCCOC(=O)CO Amb27765648 [0,2,0,0,0,0|0,0,2]=4 6801 B9R0.46 C=CCCOCC(C)CBr Amb27458932 [0,2,0,0,0,0|2,0,0]=4 6802 B9R0.46 C=CCCOCC(N)CC Amb27406917 [0,2,0,0,0,0|1,0,0]=3 6803 B9R0.46 C=CCCOCC(O)CCl Amb28042360 [0,2,0,0,0,0|0,0,2]=4 6804 B9R0.46 C=CCCOC[C@@H](N)CO Amb28289961 [0,2,0,0,0,0|0,0,2]=4 6805 B9R0.46 C=CCCSCC(C)CC Amb28138309 [0,2,0,0,0,0|1,1,0]=4 6806 B9R0.46 C=CCCSCC(N)CC Amb27763096 [0,2,0,0,0,0|1,1,0]=4 6807 B9R0.46 C=CCOCCC(N)CO Amb27192039 [0,2,0,0,0,0|1,0,1]=4 6808 B9R0.46 C=CCOCCN(C)CC Amb27842961 [0,2,0,0,0,0|1,0,1]=4 6809 B9R0.46 C=CCOCC[C@@H](C)CO Amb27198011 [0,2,0,0,0,0|1,0,1]=4 6810 B9R0.46 C=C[C@@H](O)CCCCCC Amb27197186 [0,2,0,0,0,0|1,0,0]=3 6811 B9R0.46 C=C[C@H](C)CCCCCO Amb28138710 [0,2,0,0,0,0|1,0,0]=3 6812 B9R0.46 CC#CCCOC(=O)CO Amb27867952 [0,2,0,0,0,0|0,0,2]=4 6813 B9R0.46 CC#CCCSC(C)CO Amb27442392 [0,2,0,0,0,0|0,1,1]=4 6814 B9R0.46 CC(C#N)NCCCCO Amb28435975 [0,2,0,0,0,0|2,0,0]=4 6815 B9R0.46 CC(CN)CNCCCO Amb27262382 [0,2,0,0,0,0|2,0,0]=4 6816 B9R0.46 CC(CN)NCCCCN Amb27831077 [0,2,0,0,0,0|2,0,0]=4 6817 B9R0.46 CC(CO)CCCCC#N Amb27256801 [0,2,0,0,0,0|1,0,1]=4 6818 B9R0.46 CC(CO)CNCCCO Amb27866214 [0,2,0,0,0,0|2,0,0]=4 6819 B9R0.46 CCC(=O)CCCCCO Amb27627259 [0,2,0,0,0,0|1,0,0]=3 6820 B9R0.46 CCC(=O)OCCCCBr Amb28120684 [0,2,0,0,0,0|1,0,1]=4 6821 B9R0.46 CCC(=O)OCCCCCl Amb27494048 [0,2,0,0,0,0|1,0,1]=4 6822 B9R0.46 CCC(=O)OCCCCO Amb26485117 [0,2,0,0,0,0|1,0,1]=4 6823 B9R0.46 CCC(=O)OCCCSC Amb28070380 [0,2,0,0,0,0|1,0,1]=4 6824 B9R0.46 CCC(=O)OCSCCO Amb27466870 [0,2,0,0,0,0|0,1,1]=4 6825 B9R0.46 CCC(Br)CCNCCF Amb27973194 [0,2,0,0,0,0|2,0,0]=4 6826 B9R0.46 CCC(C)CCCCC=O Amb28077640 [0,2,0,0,0,0|1,0,1]=4 6827 B9R0.46 CCC(C)CCCCCBr Amb28428516 [0,2,0,0,0,0|2,0,0]=4 6828 B9R0.46 CCC(C)CCCCCN Amb28385774 [0,2,0,0,0,0|2,0,0]=4 6829 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|1,0,0]=3 6830 B9R0.46 CCC(C)CCNCCO Amb28050561 [0,2,0,0,0,0|1,0,0]=3 6831 B9R0.46 CCC(C)CCOCCN Amb27618047 [0,2,0,0,0,0|1,0,0]=3 6832 B9R0.46 CCC(C)CNCCC#N Amb6736615 [0,2,0,0,0,0|2,0,0]=4 6833 B9R0.46 CCC(C)CNCCCBr Amb28049449 [0,2,0,0,0,0|2,0,0]=4 6834 B9R0.46 CCC(C)CNCCCCl Amb27763526 [0,2,0,0,0,0|2,0,0]=4 6835 B9R0.46 CCC(C)CNCCCF Amb27425077 [0,2,0,0,0,0|2,0,0]=4 6836 B9R0.46 CCC(C)COCCCBr Amb27875135 [0,2,0,0,0,0|1,0,0]=3 6837 B9R0.46 CCC(C)COCCCN Amb27768706 [0,2,0,0,0,0|1,0,0]=3 6838 B9R0.46 CCC(C)CSCCC=O Amb27809578 [0,2,0,0,0,0|0,1,1]=4 6839 B9R0.46 CCC(C)C\C=C\CCN Amb27835226 [0,2,0,0,0,0|2,0,0]=4 6840 B9R0.46 CCC(C)NCCCCF Amb27766784 [0,2,0,0,0,0|2,0,0]=4 6841 B9R0.46 CCC(C)NCCCOC Amb6730317 [0,2,0,0,0,0|2,0,0]=4 6842 B9R0.46 CCC(C)NCCCSC Amb6719664 [0,2,0,0,0,0|2,0,0]=4 6843 B9R0.46 CCC(C)OCCCCS Amb27588540 [0,2,0,0,0,0|1,0,0]=3 6844 B9R0.46 CCC(C)OCCCON Amb28062345 [0,2,0,0,0,0|2,0,0]=4 6845 B9R0.46 CCC(C)SCCCCN Amb9391446 [0,2,0,0,0,0|1,1,0]=4 6846 B9R0.46 CCC(C)SCCCCS Amb27801732 [0,2,0,0,0,0|1,1,0]=4 6847 B9R0.46 CCC(C)SCCCOC Amb28400490 [0,2,0,0,0,0|1,1,0]=4 6848 B9R0.46 CCC(C)SCCCON Amb28193724 [0,2,0,0,0,0|2,0,0]=4 6849 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|1,0,0]=3 6850 B9R0.46 CCC(N)CCCCC#N Amb28244686 [0,2,0,0,0,0|2,0,0]=4 6851 B9R0.46 CCC(N)CCCCCO Amb26865511 [0,2,0,0,0,0|1,0,0]=3 6852 B9R0.46 CCC(N)CNCCOC Amb25375423 [0,2,0,0,0,0|1,0,0]=3 6853 B9R0.46 CCC(N)COCCOC Amb27618093 [0,2,0,0,0,0|0,0,0]=2 6854 B9R0.46 CCC(N)CSCCCO Amb28344434 [0,2,0,0,0,0|0,1,0]=3 6855 B9R0.46 CCC(N)CSCCON Amb27843898 [0,2,0,0,0,0|0,1,0]=3 6856 B9R0.46 CCC(O)CCCCNC Amb28193277 [0,2,0,0,0,0|2,0,0]=4 6857 B9R0.46 CCC(O)CCNCCF Amb27458264 [0,2,0,0,0,0|2,0,0]=4 6858 B9R0.46 CCC(O)CNCCC#N Amb27656284 [0,2,0,0,0,0|2,0,0]=4 6859 B9R0.46 CCC(O)CNCCCS Amb27985489 [0,2,0,0,0,0|1,1,0]=4 6860 B9R0.46 CCC(O)COCCOC Amb26506871 [0,2,0,0,0,0|0,0,0]=2 6861 B9R0.46 CCC(O)CSCCCN Amb27615088 [0,2,0,0,0,0|1,1,0]=4 6862 B9R0.46 CCC(O)CSCCSC Amb27233915 [0,2,0,0,0,0|0,2,0]=4 6863 B9R0.46 CCCC#CCC(O)CC Amb2721744 [0,2,0,0,0,0|1,0,1]=4 6864 B9R0.46 CCCCC#CC(C)CN Amb27413705 [0,2,0,0,0,0|2,0,0]=4 6865 B9R0.46 CCCCC#CC(O)C#N Amb28050781 [0,2,0,0,0,0|1,0,1]=4 6866 B9R0.46 CCCCC#CC(O)CCl Amb27227943 [0,2,0,0,0,0|1,0,1]=4 6867 B9R0.46 CCCCC#CC(O)CF Amb27219496 [0,2,0,0,0,0|1,0,1]=4 6868 B9R0.46 CCCCC#C[C@@H](N)CO Amb27867093 [0,2,0,0,0,0|1,0,0]=3 6869 B9R0.46 CCCCC#C[C@@H](O)C#N Amb27757875 [0,2,0,0,0,0|1,0,1]=4 6870 B9R0.46 CCCCCCC(=N)NO Amb22733338 [0,2,0,0,0,0|1,0,1]=4 6871 B9R0.46 CCCCCCC(=O)CBr Amb24078361 [0,2,0,0,0,0|2,0,0]=4 6872 B9R0.46 CCCCCCC(=O)CC Amb2720775 [0,2,0,0,0,0|2,0,0]=4 6873 B9R0.46 CCCCCCC(=O)CF Amb27265611 [0,2,0,0,0,0|2,0,0]=4 6874 B9R0.46 CCCCCCC(=O)CO Amb28254622 [0,2,0,0,0,0|1,0,0]=3 6875 B9R0.46 CCCCCCC(=O)NO Amb25146254 [0,2,0,0,0,0|1,0,1]=4 6876 B9R0.46 CCCCCCC(=O)OC Amb9787230 [0,2,0,0,0,0|1,0,1]=4 6877 B9R0.46 CCCCCCC(Br)CBr Amb17845325 [0,2,0,0,0,0|2,0,0]=4 6878 B9R0.46 CCCCCCC(Br)CN Amb27626902 [0,2,0,0,0,0|2,0,0]=4 6879 B9R0.46 CCCCCCC(Br)CO Amb28126801 [0,2,0,0,0,0|1,0,0]=3 6880 B9R0.46 CCCCCCC(C)C#N Amb8950096 [0,2,0,0,0,0|2,0,0]=4 6881 B9R0.46 CCCCCCC(C)CBr Amb20240804 [0,2,0,0,0,0|2,0,0]=4 6882 B9R0.46 CCCCCCC(C)CC Amb6366304 [0,2,0,0,0,0|2,0,0]=4 6883 B9R0.46 CCCCCCC(C)CCl Amb26403332 [0,2,0,0,0,0|2,0,0]=4 6884 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|1,0,0]=3 6885 B9R0.46 CCCCCCC(C)NN Amb20623338 [0,2,0,0,0,0|2,0,0]=4 6886 B9R0.46 CCCCCCC(C)NN Amb7795640 [0,2,0,0,0,0|2,0,0]=4 6887 B9R0.46 CCCCCCC(Cl)C#N Amb18177676 [0,2,0,0,0,0|2,0,0]=4 6888 B9R0.46 CCCCCCC(Cl)C=O Amb26493540 [0,2,0,0,0,0|1,0,1]=4 6889 B9R0.46 CCCCCCC(Cl)CC Amb27872816 [0,2,0,0,0,0|2,0,0]=4 6890 B9R0.46 CCCCCCC(Cl)CCl Amb9787127 [0,2,0,0,0,0|2,0,0]=4 6891 B9R0.46 CCCCCCC(N)C#N Amb7795987 [0,2,0,0,0,0|2,0,0]=4 6892 B9R0.46 CCCCCCC(N)CBr Amb27614898 [0,2,0,0,0,0|2,0,0]=4 6893 B9R0.46 CCCCCCC(N)CO Amb27770563 [0,2,0,0,0,0|1,0,0]=3 6894 B9R0.46 CCCCCCC(O)CC Amb10068521 [0,2,0,0,0,0|1,0,0]=3 6895 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|1,0,0]=3 6896 B9R0.46 CCCCCCC(O)CO Amb8514191 [0,2,0,0,0,0|1,0,0]=3 6897 B9R0.46 CCCCCCC(O)CS Amb27823218 [0,2,0,0,0,0|1,0,0]=3 6898 B9R0.46 CCCCCCC(S)CS Amb16232249 [0,2,0,0,0,0|1,1,0]=4 6899 B9R0.46 CCCCCC[C@@H](C)CBr Amb27224123 [0,2,0,0,0,0|2,0,0]=4 6900 B9R0.46 CCCCCC[C@@H](Cl)C=O Amb27477830 [0,2,0,0,0,0|1,0,1]=4 6901 B9R0.46 CCCCCC[C@@H](Cl)CC Amb27185588 [0,2,0,0,0,0|2,0,0]=4 6902 B9R0.46 CCCCCC[C@@H](F)CBr Amb27872246 [0,2,0,0,0,0|2,0,0]=4 6903 B9R0.46 CCCCCC[C@@H](F)CO Amb27213919 [0,2,0,0,0,0|1,0,0]=3 6904 B9R0.46 CCCCCC[C@@H](N)CO Amb27812823 [0,2,0,0,0,0|1,0,0]=3 6905 B9R0.46 CCCCCC[C@@H](O)CBr Amb27214043 [0,2,0,0,0,0|1,0,0]=3 6906 B9R0.46 CCCCCC[C@@H](O)CCl Amb27630055 [0,2,0,0,0,0|1,0,0]=3 6907 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|1,0,0]=3 6908 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|1,0,0]=3 6909 B9R0.46 CCCCCC[C@H](N)CO Amb28126944 [0,2,0,0,0,0|1,0,0]=3 6910 B9R0.46 CCCCCC[C@H](O)C#N Amb28256387 [0,2,0,0,0,0|1,0,0]=3 6911 B9R0.46 CCCCCC[C@H](O)CF Amb27480605 [0,2,0,0,0,0|1,0,0]=3 6912 B9R0.46 CCCCCC[C@H](O)CN Amb27413021 [0,2,0,0,0,0|1,0,0]=3 6913 B9R0.46 CCCCCC\C(Cl)=N\O Amb27604397 [0,2,0,0,0,0|1,0,1]=4 6914 B9R0.46 CCCCCNC(C)CC Amb6688188 [0,2,0,0,0,0|2,0,0]=4 6915 B9R0.46 CCCCCNC(C)CCl Amb27805497 [0,2,0,0,0,0|2,0,0]=4 6916 B9R0.46 CCCCCOC(=O)CBr Amb22036620 [0,2,0,0,0,0|1,0,1]=4 6917 B9R0.46 CCCCCOC(=O)CN Amb22277108 [0,2,0,0,0,0|1,0,1]=4 6918 B9R0.46 CCCCCOC(=O)CO Amb27839431 [0,2,0,0,0,0|0,0,1]=3 6919 B9R0.46 CCCCCOC(C)CO Amb27857498 [0,2,0,0,0,0|0,0,0]=2 6920 B9R0.46 CCCCCO[C@@H](C)CO Amb27394892 [0,2,0,0,0,0|0,0,0]=2 6921 B9R0.46 CCCCC\C=C(\F)CO Amb27406000 [0,2,0,0,0,0|1,0,1]=4 6922 B9R0.46 CCCCNCC(C)CCl Amb27424764 [0,2,0,0,0,0|2,0,0]=4 6923 B9R0.46 CCCCNCC(Cl)CC Amb27242061 [0,2,0,0,0,0|2,0,0]=4 6924 B9R0.46 CCCCNCC(N)CC Amb27806280 [0,2,0,0,0,0|2,0,0]=4 6925 B9R0.46 CCCCNCC(O)CC Amb27591960 [0,2,0,0,0,0|1,0,0]=3 6926 B9R0.46 CCCCNCC(O)CO Amb17308645 [0,2,0,0,0,0|1,0,0]=3 6927 B9R0.46 CCCCNCC(S)CS Amb27487335 [0,2,0,0,0,0|1,1,0]=4 6928 B9R0.46 CCCCNC[C@H](O)CC Amb28144394 [0,2,0,0,0,0|1,0,0]=3 6929 B9R0.46 CCCCOCC(=O)CCl Amb27865684 [0,2,0,0,0,0|1,0,0]=3 6930 B9R0.46 CCCCOCC(C)CC Amb27803945 [0,2,0,0,0,0|1,0,0]=3 6931 B9R0.46 CCCCOCC(C)CCl Amb27228843 [0,2,0,0,0,0|1,0,0]=3 6932 B9R0.46 CCCCOCC(N)CC Amb17485997 [0,2,0,0,0,0|1,0,0]=3 6933 B9R0.46 CCCCOCC(N)CO Amb27839156 [0,2,0,0,0,0|0,0,0]=2 6934 B9R0.46 CCCCOCC(O)C=O Amb27646119 [0,2,0,0,0,0|0,0,0]=2 6935 B9R0.46 CCCCOCC(O)CCl Amb9787120 [0,2,0,0,0,0|0,0,0]=2 6936 B9R0.46 CCCCOCC(O)CN Amb8895238 [0,2,0,0,0,0|0,0,0]=2 6937 B9R0.46 CCCCOCC(O)CS Amb28050761 [0,2,0,0,0,0|0,0,0]=2 6938 B9R0.46 CCCCOC[C@@H](O)CC Amb27615814 [0,2,0,0,0,0|0,0,0]=2 6939 B9R0.46 CCCCOC[C@H](N)CO Amb28130815 [0,2,0,0,0,0|0,0,0]=2 6940 B9R0.46 CCCCSCC(=O)OC Amb9262932 [0,2,0,0,0,0|0,1,1]=4 6941 B9R0.46 CCCCSCC(C)C=O Amb27837938 [0,2,0,0,0,0|0,1,1]=4 6942 B9R0.46 CCCCSCC(Cl)C#N Amb27395189 [0,2,0,0,0,0|1,1,0]=4 6943 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|0,1,0]=3 6944 B9R0.46 CCCCSCC(O)CO Amb10669577 [0,2,0,0,0,0|0,1,0]=3 6945 B9R0.46 CCCCSC[C@H](O)CN Amb27221761 [0,2,0,0,0,0|0,1,0]=3 6946 B9R0.46 CCCC\C=C\C(O)C#N Amb28455022 [0,2,0,0,0,0|1,0,1]=4 6947 B9R0.46 CCCC\C=C\[C@@H](O)C#N Amb27972574 [0,2,0,0,0,0|1,0,1]=4 6948 B9R0.46 CCCC\C=C\[C@H](O)CCl Amb27617086 [0,2,0,0,0,0|1,0,1]=4 6949 B9R0.46 CCCC\N=C\C(O)CC Amb28050660 [0,2,0,0,0,0|1,0,1]=4 6950 B9R0.46 CCCNCCC(C)CC Amb28124478 [0,2,0,0,0,0|2,0,0]=4 6951 B9R0.46 CCCNCCC(N)CC Amb28123553 [0,2,0,0,0,0|2,0,0]=4 6952 B9R0.46 CCCNCCC(O)CO Amb32645150 [0,2,0,0,0,0|1,0,0]=3 6953 B9R0.46 CCCNCC[C@H](O)CC Amb27770360 [0,2,0,0,0,0|2,0,0]=4 6954 B9R0.46 CCCNC\C=C(\C)CO Amb18644033 [0,2,0,0,0,0|1,0,1]=4 6955 B9R0.46 CCCOCCC(=O)CO Amb27616444 [0,2,0,0,0,0|1,0,1]=4 6956 B9R0.46 CCCOCCC(C)CBr Amb26369433 [0,2,0,0,0,0|1,0,0]=3 6957 B9R0.46 CCCOCCC(C)CCl Amb25921281 [0,2,0,0,0,0|1,0,0]=3 6958 B9R0.46 CCCOCCC(C)NC Amb28070797 [0,2,0,0,0,0|1,0,0]=3 6959 B9R0.46 CCCOCCC(C)NN Amb28288881 [0,2,0,0,0,0|1,0,0]=3 6960 B9R0.46 CCCOCCC(O)CN Amb27454686 [0,2,0,0,0,0|1,0,0]=3 6961 B9R0.46 CCCONCC(C)C#N Amb28186051 [0,2,0,0,0,0|2,0,0]=4 6962 B9R0.46 CCCONCC(C)CN Amb27985329 [0,2,0,0,0,0|2,0,0]=4 6963 B9R0.46 CCCONCC(C)OC Amb27246429 [0,2,0,0,0,0|2,0,0]=4 6964 B9R0.46 CCCSCCC(N)CO Amb27839116 [0,2,0,0,0,0|1,0,0]=3 6965 B9R0.46 CCC\C=C\CC(N)CC Amb27198430 [0,2,0,0,0,0|2,0,0]=4 6966 B9R0.46 CCC\C=C\CC(N)CO Amb26848586 [0,2,0,0,0,0|1,0,1]=4 6967 B9R0.46 CCC\C=C\CC(O)CN Amb33422858 [0,2,0,0,0,0|1,0,1]=4 6968 B9R0.46 CCC\C=C\C[C@@H](O)CO Amb27484703 [0,2,0,0,0,0|1,0,1]=4 6969 B9R0.46 CCC\C=N\NC(C)CO Amb28063652 [0,2,0,0,0,0|1,0,1]=4 6970 B9R0.46 CCC\C=N\OC(C)CC Amb28293977 [0,2,0,0,0,0|1,0,1]=4 6971 B9R0.46 CCN(C)CCCCCCl Amb18788251 [0,2,0,0,0,0|2,0,0]=4 6972 B9R0.46 CCN(C)CCCCCF Amb27944768 [0,2,0,0,0,0|2,0,0]=4 6973 B9R0.46 CCN(C)CCCCCN Amb24700898 [0,2,0,0,0,0|2,0,0]=4 6974 B9R0.46 CCN(C)CCNCCN Amb27809535 [0,2,0,0,0,0|2,0,0]=4 6975 B9R0.46 CCN(C)CCNCCO Amb25071808 [0,2,0,0,0,0|1,0,0]=3 6976 B9R0.46 CCN(C)CCOCCBr Amb27982095 [0,2,0,0,0,0|1,0,0]=3 6977 B9R0.46 CCN(C)CCOCCCl Amb27424958 [0,2,0,0,0,0|1,0,0]=3 6978 B9R0.46 CCN(C)CCOCCN Amb27812529 [0,2,0,0,0,0|1,0,0]=3 6979 B9R0.46 CCN(C)CCOCCO Amb24616704 [0,2,0,0,0,0|0,0,0]=2 6980 B9R0.46 CCN(C)CCOCCS Amb28049573 [0,2,0,0,0,0|0,1,0]=3 6981 B9R0.46 CCN(N)CCOCCO Amb27832473 [0,2,0,0,0,0|0,0,0]=2 6982 B9R0.46 CCNCCCC(C)OC Amb25738781 [0,2,0,0,0,0|2,0,0]=4 6983 B9R0.46 CCNCCCC(O)CC Amb27618908 [0,2,0,0,0,0|2,0,0]=4 6984 B9R0.46 CCNCCSC(C)CO Amb28079466 [0,2,0,0,0,0|0,1,0]=3 6985 B9R0.46 CCOCCCC(C)CBr Amb26392239 [0,2,0,0,0,0|2,0,0]=4 6986 B9R0.46 CCOCCCC(C)CCl Amb26981336 [0,2,0,0,0,0|2,0,0]=4 6987 B9R0.46 CCOCCCC(C)CN Amb27838971 [0,2,0,0,0,0|2,0,0]=4 6988 B9R0.46 CCOCCCC(O)CO Amb27813119 [0,2,0,0,0,0|1,0,0]=3 6989 B9R0.46 CCOCCC[C@H](N)CO Amb27175345 [0,2,0,0,0,0|1,0,0]=3 6990 B9R0.46 CCOCCNC(C)CBr Amb27590522 [0,2,0,0,0,0|2,0,0]=4 6991 B9R0.46 CCOCCN[C@H](C)CN Amb27210693 [0,2,0,0,0,0|2,0,0]=4 6992 B9R0.46 CCOCCOC(=O)CCl Amb18602724 [0,2,0,0,0,0|1,0,1]=4 6993 B9R0.46 CCOCCOC(=O)CO Amb28139347 [0,2,0,0,0,0|0,0,1]=3 6994 B9R0.46 CCOCCOC(C)C=O Amb27599434 [0,2,0,0,0,0|0,0,2]=4 6995 B9R0.46 CCOCCOC(C)CO Amb27661033 [0,2,0,0,0,0|0,0,0]=2 6996 B9R0.46 CCOCCSC(C)CCl Amb27212971 [0,2,0,0,0,0|1,1,0]=4 6997 B9R0.46 CCOCCSC(C)CN Amb28077667 [0,2,0,0,0,0|1,1,0]=4 6998 B9R0.46 CCOCCSC(C)CO Amb27771669 [0,2,0,0,0,0|0,1,0]=3 6999 B9R0.46 CCOCOCC(N)CC Amb27859010 [0,2,0,0,0,0|1,0,0]=3 7000 B9R0.46 CCOCOCC(N)CO Amb27398859 [0,2,0,0,0,0|1,0,0]=3 7001 B9R0.46 CCOCOCC(O)CCl Amb27839097 [0,2,0,0,0,0|1,0,0]=3 7002 B9R0.46 CCS(=O)CCOCCN Amb27976568 [0,2,0,0,0,0|1,0,0]=3 7003 B9R0.46 CCS(=O)NOCCOC Amb27431922 [0,2,0,0,0,0|2,0,0]=4 7004 B9R0.46 CCSCCCC(Br)CC Amb27652366 [0,2,0,0,0,0|2,0,0]=4 7005 B9R0.46 CCSCCCC(C)CBr Amb24509145 [0,2,0,0,0,0|2,0,0]=4 7006 B9R0.46 CCSCCCC(C)CCl Amb26362369 [0,2,0,0,0,0|2,0,0]=4 7007 B9R0.46 CCSCCCC(C)CO Amb27967129 [0,2,0,0,0,0|1,0,0]=3 7008 B9R0.46 CCSCCCC(Cl)CC Amb28044995 [0,2,0,0,0,0|2,0,0]=4 7009 B9R0.46 CCSCCCC(N)CO Amb27779485 [0,2,0,0,0,0|1,0,0]=3 7010 B9R0.46 CCSCCCC(O)CN Amb28401101 [0,2,0,0,0,0|2,0,0]=4 7011 B9R0.46 CCSCCNC(C)CN Amb27960201 [0,2,0,0,0,0|2,0,0]=4 7012 B9R0.46 CCSCCOC(=O)CCl Amb27656954 [0,2,0,0,0,0|1,0,1]=4 7013 B9R0.46 CCSCCOC(=O)CO Amb28078370 [0,2,0,0,0,0|0,0,1]=3 7014 B9R0.46 CCSCCOC(C)CN Amb27774530 [0,2,0,0,0,0|1,0,0]=3 7015 B9R0.46 CCSCCSC(C)CN Amb27791495 [0,2,0,0,0,0|1,1,0]=4 7016 B9R0.46 CCSCCSC(C)CO Amb27620222 [0,2,0,0,0,0|0,1,0]=3 7017 B9R0.46 CCSCSCC(O)CO Amb27432512 [0,2,0,0,0,0|1,1,0]=4 7018 B9R0.46 CC[C@@H](C)CCCCC=O Amb28247098 [0,2,0,0,0,0|1,0,1]=4 7019 B9R0.46 CC[C@@H](N)CNCCCF Amb27828441 [0,2,0,0,0,0|2,0,0]=4 7020 B9R0.46 CC[C@@H](O)CNCCCF Amb27212129 [0,2,0,0,0,0|2,0,0]=4 7021 B9R0.46 CC[C@@H](O)CNCCCN Amb27823263 [0,2,0,0,0,0|2,0,0]=4 7022 B9R0.46 CC[C@@H](O)CNCCCO Amb27256818 [0,2,0,0,0,0|1,0,0]=3 7023 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|1,0,0]=3 7024 B9R0.46 CC[C@H](C)CC\C=C\CO Amb27410556 [0,2,0,0,0,0|1,0,1]=4 7025 B9R0.46 CC[C@H](N)CNCCCF Amb27259964 [0,2,0,0,0,0|2,0,0]=4 7026 B9R0.46 CC[C@H](N)CNCCOC Amb27259962 [0,2,0,0,0,0|1,0,0]=3 7027 B9R0.46 CC[C@H](O)CCCCCF Amb27651955 [0,2,0,0,0,0|2,0,0]=4 7028 B9R0.46 CC[C@H](O)CSCCOC Amb27433227 [0,2,0,0,0,0|0,1,0]=3 7029 B9R0.46 CC\C(C)=N\OCCOC Amb27485231 [0,2,0,0,0,0|1,0,1]=4 7030 B9R0.46 CC\C=C\CNC(C)CO Amb28200613 [0,2,0,0,0,0|1,0,1]=4 7031 B9R0.46 CC\C=C\COC(=O)CO Amb27479358 [0,2,0,0,0,0|0,0,2]=4 7032 B9R0.46 CC\C=C\OCC(O)CO Amb28070548 [0,2,0,0,0,0|0,0,2]=4 7033 B9R0.46 CNC(=O)CCCCCO Amb27592471 [0,2,0,0,0,0|1,0,1]=4 7034 B9R0.46 CNC(=O)CCOCCN Amb28249892 [0,2,0,0,0,0|1,0,1]=4 7035 B9R0.46 CNC(C)CNCCOC Amb27816941 [0,2,0,0,0,0|2,0,0]=4 7036 B9R0.46 CNC(C)COCCOC Amb27272846 [0,2,0,0,0,0|1,0,0]=3 7037 B9R0.46 CNCCOCC(=O)OC Amb27481250 [0,2,0,0,0,0|1,0,1]=4 7038 B9R0.46 CNCCSCC(C)OC Amb27434606 [0,2,0,0,0,0|1,1,0]=4 7039 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,2,0,0,0,0|1,0,1]=4 7040 B9R0.46 COC(=O)CCNCCO Amb9243303 [0,2,0,0,0,0|1,0,1]=4 7041 B9R0.46 COC(=O)CCOCCN Amb26516683 [0,2,0,0,0,0|1,0,1]=4 7042 B9R0.46 COC(=O)CCOCCN Amb33330774 [0,2,0,0,0,0|1,0,1]=4 7043 B9R0.46 COC(=O)CCOCCO Amb33986072 [0,2,0,0,0,0|0,0,1]=3 7044 B9R0.46 COC(=O)COCCCN Amb27597156 [0,2,0,0,0,0|1,0,1]=4 7045 B9R0.46 COC(=O)COCCSC Amb28256796 [0,2,0,0,0,0|1,0,1]=4 7046 B9R0.46 COC(C)CCNCCO Amb28254062 [0,2,0,0,0,0|1,0,0]=3 7047 B9R0.46 COC(C)CNCCCCl Amb27166373 [0,2,0,0,0,0|2,0,0]=4 7048 B9R0.46 COC(C)COCCCCl Amb27846482 [0,2,0,0,0,0|1,0,0]=3 7049 B9R0.46 COC(C)COCCCN Amb27402975 [0,2,0,0,0,0|1,0,0]=3 7050 B9R0.46 COC(C)CSCCCCl Amb27234548 [0,2,0,0,0,0|1,1,0]=4 7051 B9R0.46 COC(C)CSCCCN Amb28068618 [0,2,0,0,0,0|1,1,0]=4 7052 B9R0.46 COCCCCC(=O)CO Amb28254576 [0,2,0,0,0,0|1,0,1]=4 7053 B9R0.46 COCCCCC(C)CBr Amb27254567 [0,2,0,0,0,0|2,0,0]=4 7054 B9R0.46 COCCCCC(C)CCl Amb28248640 [0,2,0,0,0,0|2,0,0]=4 7055 B9R0.46 COCCCCC(O)CCl Amb27478160 [0,2,0,0,0,0|2,0,0]=4 7056 B9R0.46 COCCCNC(=O)CO Amb9421653 [0,2,0,0,0,0|1,0,1]=4 7057 B9R0.46 COCCCNC(C)CO Amb27869590 [0,2,0,0,0,0|1,0,0]=3 7058 B9R0.46 COCCCN[C@H](C)CN Amb27426683 [0,2,0,0,0,0|2,0,0]=4 7059 B9R0.46 COCCCOC(=O)CN Amb27848859 [0,2,0,0,0,0|1,0,1]=4 7060 B9R0.46 COCCCOC(=O)CO Amb27207808 [0,2,0,0,0,0|0,0,1]=3 7061 B9R0.46 COCCCOC(=O)CS Amb27648593 [0,2,0,0,0,0|0,1,1]=4 7062 B9R0.46 COCCCOC(C)C#N Amb28143768 [0,2,0,0,0,0|1,0,1]=4 7063 B9R0.46 COCCNCC(C)CO Amb27606270 [0,2,0,0,0,0|2,0,0]=4 7064 B9R0.46 COCCNCC(C)SC Amb18182605 [0,2,0,0,0,0|2,0,0]=4 7065 B9R0.46 COCCNCC(O)CO Amb17308972 [0,2,0,0,0,0|2,0,0]=4 7066 B9R0.46 COCCOCC(=O)OC Amb9206379 [0,2,0,0,0,0|1,0,1]=4 7067 B9R0.46 COCCOCC(Br)C#N Amb27192469 [0,2,0,0,0,0|1,0,1]=4 7068 B9R0.46 COCCOCC(C)CBr Amb24664875 [0,2,0,0,0,0|1,0,0]=3 7069 B9R0.46 COCCOCC(C)CCl Amb25321390 [0,2,0,0,0,0|1,0,0]=3 7070 B9R0.46 COCCOCC(N)CN Amb28400838 [0,2,0,0,0,0|1,0,0]=3 7071 B9R0.46 COCCOCC(O)C#N Amb27815705 [0,2,0,0,0,0|1,0,0]=3 7072 B9R0.46 COCCOCC(O)CN Amb6250261 [0,2,0,0,0,0|1,0,0]=3 7073 B9R0.46 COCCOCC(O)CO Amb27630246 [0,2,0,0,0,0|1,0,0]=3 7074 B9R0.46 COCCOC[C@@H](N)CO Amb28410598 [0,2,0,0,0,0|1,0,0]=3 7075 B9R0.46 COCCOC[C@H](O)CN Amb28068606 [0,2,0,0,0,0|1,0,0]=3 7076 B9R0.46 COCCOC\C(Cl)=N\O Amb27192138 [0,2,0,0,0,0|1,0,1]=4 7077 B9R0.46 COCCOC\C(N)=N\O Amb6277456 [0,2,0,0,0,0|1,0,1]=4 7078 B9R0.46 COCCONC(C)CN Amb27863052 [0,2,0,0,0,0|2,0,0]=4 7079 B9R0.46 COCCSCC(C)CBr Amb27754626 [0,2,0,0,0,0|1,1,0]=4 7080 B9R0.46 COCCSCC(C)CN Amb9391276 [0,2,0,0,0,0|1,1,0]=4 7081 B9R0.46 COCCSCC(C)CS Amb27614888 [0,2,0,0,0,0|1,1,0]=4 7082 B9R0.46 COCCSCC(C)OC Amb28256683 [0,2,0,0,0,0|1,1,0]=4 7083 B9R0.46 COCCSCC(O)CN Amb9305325 [0,2,0,0,0,0|1,1,0]=4 7084 B9R0.46 COCOCCC(C)CO Amb27480403 [0,2,0,0,0,0|2,0,0]=4 7085 B9R0.46 COCOCC[C@@H](C)CO Amb27472642 [0,2,0,0,0,0|2,0,0]=4 7086 B9R0.46 COCOCC[C@H](C)CO Amb28138711 [0,2,0,0,0,0|2,0,0]=4 7087 B9R0.46 CSCCCCC(C)CBr Amb27833849 [0,2,0,0,0,0|2,0,0]=4 7088 B9R0.46 CSCCCCC(C)CN Amb27857677 [0,2,0,0,0,0|2,0,0]=4 7089 B9R0.46 CSCCCNC(C)CCl Amb28342536 [0,2,0,0,0,0|2,0,0]=4 7090 B9R0.46 CSCCCNC(C)CO Amb9359625 [0,2,0,0,0,0|1,0,0]=3 7091 B9R0.46 CSCCCOC(=O)CO Amb28285323 [0,2,0,0,0,0|0,0,1]=3 7092 B9R0.46 CSCCCSC(C)CCl Amb28131146 [0,2,0,0,0,0|1,1,0]=4 7093 B9R0.46 CSCCNC[C@H](O)CO Amb27389888 [0,2,0,0,0,0|2,0,0]=4 7094 B9R0.46 CSCCOCC(C)CBr Amb27823942 [0,2,0,0,0,0|1,1,0]=4 7095 B9R0.46 CSCCOCC(Cl)C#N Amb27223514 [0,2,0,0,0,0|2,0,0]=4 7096 B9R0.46 CSCCOC[C@@H](N)CO Amb28255955 [0,2,0,0,0,0|1,0,0]=3 7097 B9R0.46 CSCCSCC(O)CF Amb27491697 [0,2,0,0,0,0|1,1,0]=4 7098 B9R0.46 CSCCSCC(O)CO Amb27817441 [0,2,0,0,0,0|1,1,0]=4 7099 B9R0.46 CSCCSC[C@H](O)CN Amb27409404 [0,2,0,0,0,0|1,1,0]=4 7100 B9R0.46 C\C=C\CCNC(C)CO Amb27641704 [0,2,0,0,0,0|1,0,1]=4 7101 B9R0.46 N#CC(O)CCCCCBr Amb27875174 [0,2,0,0,0,0|2,0,0]=4 7102 B9R0.46 N#CC(O)CCCCCO Amb27752315 [0,2,0,0,0,0|1,0,1]=4 7103 B9R0.46 N#CCCOCC(O)CO Amb27835411 [0,2,0,0,0,0|1,0,1]=4 7104 B9R0.46 N#C[C@H](O)CCCCCBr Amb27195572 [0,2,0,0,0,0|2,0,0]=4 7105 B9R0.46 NC(CO)COCCCO Amb28410875 [0,2,0,0,0,0|1,0,0]=3 7106 B9R0.46 NCC(=O)OCCCCO Amb27657505 [0,2,0,0,0,0|1,0,1]=4 7107 B9R0.46 NCC(O)CNCCCO Amb28072645 [0,2,0,0,0,0|2,0,0]=4 7108 B9R0.46 NCCCCCC(N)CN Amb27210080 [0,2,0,0,0,0|2,0,0]=4 7109 B9R0.46 NCCCNCC(N)CO Amb27815029 [0,2,0,0,0,0|2,0,0]=4 7110 B9R0.46 NCCCNCC(O)CN Amb25198252 [0,2,0,0,0,0|2,0,0]=4 7111 B9R0.46 NCCCNC[C@H](O)CO Amb27779433 [0,2,0,0,0,0|2,0,0]=4 7112 B9R0.46 NCCCOCC(O)CO Amb24654813 [0,2,0,0,0,0|1,0,0]=3 7113 B9R0.46 NCCCSCC(O)CO Amb27486689 [0,2,0,0,0,0|1,1,0]=4 7114 B9R0.46 NC[C@H](O)CCCCCBr Amb27640190 [0,2,0,0,0,0|2,0,0]=4 7115 B9R0.46 NOCCSCC(O)CO Amb27660259 [0,2,0,0,0,0|1,1,0]=4 7116 B9R0.46 N[C@@H](CO)COCCCF Amb27755335 [0,2,0,0,0,0|1,0,0]=3 7117 B9R0.46 O=C(CBr)OCCCCBr Amb24598197 [0,2,0,0,0,0|1,0,1]=4 7118 B9R0.46 O=C(CBr)OCCCCO Amb28208349 [0,2,0,0,0,0|1,0,1]=4 7119 B9R0.46 O=C(CCl)CCCCCO Amb27799874 [0,2,0,0,0,0|1,0,1]=4 7120 B9R0.46 OC(CCl)COCCCCl Amb27592162 [0,2,0,0,0,0|1,0,0]=3 7121 B9R0.46 OC(CF)CNCCCF Amb28319350 [0,2,0,0,0,0|2,0,0]=4 7122 B9R0.46 OCC(O)CCCCCBr Amb27252942 [0,2,0,0,0,0|1,0,0]=3 7123 B9R0.46 OCCCCCC(Cl)CCl Amb28244982 [0,2,0,0,0,0|1,0,0]=3 7124 B9R0.46 OCCCCCC(O)CO Amb22731576 [0,2,0,0,0,0|1,0,0]=3 7125 B9R0.46 OCCCSCC(O)CCl Amb28385596 [0,2,0,0,0,0|1,1,0]=4 7126 B9R0.46 OCCCSCC(O)CO Amb27390520 [0,2,0,0,0,0|1,1,0]=4 7127 B9R0.46 [C-]#[N+]C(C)CCCCCC Amb2688921 [0,2,0,0,0,0|2,0,0]=4 7128 B9R0.1 C=C(C)CCCC(C)CO Amb25888306 [0,2,0,0,0,0|1,0,1]=4 7129 B9R0.1 C=C(C)CCC[C@H](C)CO Amb28369841 [0,2,0,0,0,0|1,0,1]=4 7130 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [0,2,0,0,0,0|0,0,2]=4 7131 B9R0.1 C=C(C)CCSC(C)CO Amb27268746 [0,2,0,0,0,0|0,1,1]=4 7132 B9R0.1 C=C(C)COCC(N)CC Amb18111719 [0,2,0,0,0,0|1,0,1]=4 7133 B9R0.1 C=C(CO)SCCC(C)C Amb27972273 [0,2,0,0,0,0|0,1,1]=4 7134 B9R0.1 CC(=O)CCC[C@@H](C)CO Amb26391997 [0,2,0,0,0,0|1,0,1]=4 7135 B9R0.1 CC(=O)CCNC(C)CO Amb32675833 [0,2,0,0,0,0|1,0,1]=4 7136 B9R0.1 CC(C)CCCC(=O)CO Amb26467261 [0,2,0,0,0,0|1,0,1]=4 7137 B9R0.1 CC(C)CCCC(C)CBr Amb27485270 [0,2,0,0,0,0|2,0,0]=4 7138 B9R0.1 CC(C)CCCC(C)CCl Amb25056436 [0,2,0,0,0,0|2,0,0]=4 7139 B9R0.1 CC(C)CCCC(C)CN Amb18644042 [0,2,0,0,0,0|2,0,0]=4 7140 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,2,0,0,0,0|1,0,0]=3 7141 B9R0.1 CC(C)CCCC(F)CN Amb27489384 [0,2,0,0,0,0|2,0,0]=4 7142 B9R0.1 CC(C)CCCC(N)CO Amb27233021 [0,2,0,0,0,0|1,0,0]=3 7143 B9R0.1 CC(C)CCC[C@@H](C)CBr Amb28424339 [0,2,0,0,0,0|2,0,0]=4 7144 B9R0.1 CC(C)CCC[C@@H](C)CCl Amb28054799 [0,2,0,0,0,0|2,0,0]=4 7145 B9R0.1 CC(C)CCC[C@@H](C)CN Amb25147597 [0,2,0,0,0,0|2,0,0]=4 7146 B9R0.1 CC(C)CCC[C@@H](C)CO Amb26336716 [0,2,0,0,0,0|1,0,0]=3 7147 B9R0.1 CC(C)CCC[C@H](C)CN Amb28132685 [0,2,0,0,0,0|2,0,0]=4 7148 B9R0.1 CC(C)CCC[C@H](C)CO Amb33730882 [0,2,0,0,0,0|1,0,0]=3 7149 B9R0.1 CC(C)CCNC(=O)CO Amb9421652 [0,2,0,0,0,0|1,0,1]=4 7150 B9R0.1 CC(C)CCN[C@H](C)CN Amb27656290 [0,2,0,0,0,0|2,0,0]=4 7151 B9R0.1 CC(C)CCOC(=O)CN Amb17569860 [0,2,0,0,0,0|1,0,1]=4 7152 B9R0.1 CC(C)CCOC(=O)CO Amb27626229 [0,2,0,0,0,0|0,0,1]=3 7153 B9R0.1 CC(C)CCOC(=O)CS Amb22230770 [0,2,0,0,0,0|0,1,1]=4 7154 B9R0.1 CC(C)CCOC(C)CO Amb28050709 [0,2,0,0,0,0|0,0,0]=2 7155 B9R0.1 CC(C)CCOC(Cl)CCl Amb17689391 [0,2,0,0,0,0|1,0,0]=3 7156 B9R0.1 CC(C)CNCC(C)CO Amb28323127 [0,2,0,0,0,0|2,0,0]=4 7157 B9R0.1 CC(C)CNCC(O)CO Amb17308639 [0,2,0,0,0,0|2,0,0]=4 7158 B9R0.1 CC(C)CNC[C@@H](O)CO Amb33041847 [0,2,0,0,0,0|2,0,0]=4 7159 B9R0.1 CC(C)CNC[C@H](O)CO Amb27837587 [0,2,0,0,0,0|2,0,0]=4 7160 B9R0.1 CC(C)COCC(C)CBr Amb25253385 [0,2,0,0,0,0|2,0,0]=4 7161 B9R0.1 CC(C)COCC(C)CCl Amb25772268 [0,2,0,0,0,0|2,0,0]=4 7162 B9R0.1 CC(C)COCC(C)CS Amb27652624 [0,2,0,0,0,0|2,0,0]=4 7163 B9R0.1 CC(C)COCC(N)CO Amb27976629 [0,2,0,0,0,0|2,0,0]=4 7164 B9R0.1 CC(C)COCC(O)CBr Amb27945542 [0,2,0,0,0,0|2,0,0]=4 7165 B9R0.1 CC(C)COCC(O)CN Amb842783 [0,2,0,0,0,0|2,0,0]=4 7166 B9R0.1 CC(C)COCC(O)CO Amb9787114 [0,2,0,0,0,0|2,0,0]=4 7167 B9R0.1 CC(C)CSCC(N)CO Amb27799380 [0,2,0,0,0,0|2,0,0]=4 7168 B9R0.1 CC(C)OCCC(N)CO Amb24592118 [0,2,0,0,0,0|2,0,0]=4 7169 B9R0.1 CC(C)PCCC(N)CO Amb27617153 [0,2,0,0,0,0|2,0,0]=4 7170 B9R0.1 CC(CN)CNC[C@H](C)O Amb28054468 [0,2,0,0,0,0|2,0,0]=4 7171 B9R0.1 CC(CN)OCCN(C)C Amb27424962 [0,2,0,0,0,0|2,0,0]=4 7172 B9R0.1 CC(CN)OCCS(C)=O Amb27397178 [0,2,0,0,0,0|2,0,0]=4 7173 B9R0.1 CC(CO)CCOC(C)C Amb28434553 [0,2,0,0,0,0|2,0,0]=4 7174 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,2,0,0,0,0|1,0,1]=4 7175 B9R0.1 CC(CO)NCCS(C)=O Amb28205542 [0,2,0,0,0,0|2,0,0]=4 7176 B9R0.1 CC(CO)OCCN(C)C Amb27261696 [0,2,0,0,0,0|1,0,0]=3 7177 B9R0.1 CC(N)CCCC(C)CN Amb28424147 [0,2,0,0,0,0|2,0,0]=4 7178 B9R0.1 CC(N)CCCC(C)CO Amb27226928 [0,2,0,0,0,0|1,0,0]=3 7179 B9R0.1 CC(N)CCSC(C)CN Amb27602011 [0,2,0,0,0,0|1,1,0]=4 7180 B9R0.1 CC(N)CSCC(O)CO Amb28248541 [0,2,0,0,0,0|2,0,0]=4 7181 B9R0.1 CC(O)CNC[C@H](O)CO Amb27412288 [0,2,0,0,0,0|2,0,0]=4 7182 B9R0.1 CC(O)COCC(O)CCl Amb28075540 [0,2,0,0,0,0|1,0,0]=3 7183 B9R0.1 CC(O)COCC(S)CS Amb28188141 [0,2,0,0,0,0|1,0,0]=3 7184 B9R0.1 CC(O)CSCC(C)CO Amb27425054 [0,2,0,0,0,0|1,1,0]=4 7185 B9R0.1 CCC(=O)OCCC(C)F Amb28293863 [0,2,0,0,0,0|1,0,1]=4 7186 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,2,0,0,0,0|1,0,1]=4 7187 B9R0.1 CCC(C)CCCC(C)Br Amb28313037 [0,2,0,0,0,0|2,0,0]=4 7188 B9R0.1 CCC(C)CCCC(C)C Amb4036389 [0,2,0,0,0,0|2,0,0]=4 7189 B9R0.1 CCC(C)CCCC(C)N Amb26516233 [0,2,0,0,0,0|2,0,0]=4 7190 B9R0.1 CCC(C)CCC[C@@H](C)N Amb33731287 [0,2,0,0,0,0|2,0,0]=4 7191 B9R0.1 CCC(C)CCC[C@H](C)N Amb33729331 [0,2,0,0,0,0|2,0,0]=4 7192 B9R0.1 CCC(C)CNCC(C)C Amb6719710 [0,2,0,0,0,0|2,0,0]=4 7193 B9R0.1 CCC(C)CNCC(C)N Amb27261520 [0,2,0,0,0,0|2,0,0]=4 7194 B9R0.1 CCC(C)CNC[C@H](C)N Amb28135566 [0,2,0,0,0,0|2,0,0]=4 7195 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,2,0,0,0,0|0,0,1]=3 7196 B9R0.1 CCC(C)NCCC(C)Cl Amb28246887 [0,2,0,0,0,0|2,0,0]=4 7197 B9R0.1 CCC(C)NCCC(C)N Amb27185683 [0,2,0,0,0,0|2,0,0]=4 7198 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,2,0,0,0,0|1,0,1]=4 7199 B9R0.1 CCC(Cl)CCCC(Cl)Cl Amb28042880 [0,2,0,0,0,0|2,0,0]=4 7200 B9R0.1 CCC(Cl)CNCC(F)F Amb27426681 [0,2,0,0,0,0|2,0,0]=4 7201 B9R0.1 CCC(F)CSCC(C)C Amb28126923 [0,2,0,0,0,0|1,1,0]=4 7202 B9R0.1 CCC(N)CNCC(C)C Amb25083649 [0,2,0,0,0,0|2,0,0]=4 7203 B9R0.1 CCC(N)COCC(F)F Amb27444885 [0,2,0,0,0,0|1,0,0]=3 7204 B9R0.1 CCC(N)CSCC(C)C Amb28050870 [0,2,0,0,0,0|1,1,0]=4 7205 B9R0.1 CCC(N)CSCC(C)O Amb27867791 [0,2,0,0,0,0|0,1,0]=3 7206 B9R0.1 CCC(N)CSCC(F)F Amb27792560 [0,2,0,0,0,0|1,1,0]=4 7207 B9R0.1 CCC(O)CCCB(O)O Amb26967521 [0,2,0,0,0,0|2,0,0]=4 7208 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [0,2,0,0,0,0|1,0,1]=4 7209 B9R0.1 CCC(O)CNCC(C)O Amb28344778 [0,2,0,0,0,0|1,0,0]=3 7210 B9R0.1 CCC(O)CNCC(F)F Amb28076364 [0,2,0,0,0,0|2,0,0]=4 7211 B9R0.1 CCC(O)CNC[C@H](C)O Amb27772022 [0,2,0,0,0,0|1,0,0]=3 7212 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [0,2,0,0,0,0|0,1,1]=4 7213 B9R0.1 CCC(O)CSCC(C)C Amb18792450 [0,2,0,0,0,0|1,1,0]=4 7214 B9R0.1 CC[C@@H](O)CNCC(C)O Amb27770562 [0,2,0,0,0,0|1,0,0]=3 7215 B9R0.1 CC[C@@H](O)CNCC(F)F Amb28324647 [0,2,0,0,0,0|2,0,0]=4 7216 B9R0.1 CC[C@@H](O)CSCC(C)C Amb28381554 [0,2,0,0,0,0|1,1,0]=4 7217 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,2,0,0,0,0|1,0,1]=4 7218 B9R0.1 CC[C@H](N)CNCC(F)F Amb27454359 [0,2,0,0,0,0|2,0,0]=4 7219 B9R0.1 CC[C@H](N)CSCC(C)C Amb27771983 [0,2,0,0,0,0|1,1,0]=4 7220 B9R0.1 CC[C@H](O)CNCC(F)F Amb28193128 [0,2,0,0,0,0|2,0,0]=4 7221 B9R0.1 CN(C)CCCC(N)CO Amb18202279 [0,2,0,0,0,0|2,0,0]=4 7222 B9R0.1 CN(C)CCOC(=O)CO Amb33016861 [0,2,0,0,0,0|1,0,1]=4 7223 B9R0.1 CNC(C)COCC(C)C Amb27843354 [0,2,0,0,0,0|2,0,0]=4 7224 B9R0.1 COC(C)CCCC(C)O Amb27833630 [0,2,0,0,0,0|2,0,0]=4 7225 B9R0.1 COC(C)COCC(C)O Amb22729718 [0,2,0,0,0,0|1,0,0]=3 7226 B9R0.1 C[C@@H](N)COC[C@H](O)CCl Amb33623496 [0,2,0,0,0,0|2,0,0]=4 7227 B9R0.1 C[C@H](N)CSCC(O)CO Amb27809787 [0,2,0,0,0,0|2,0,0]=4 7228 B9R0.1 C[C@H](O)CNCC(O)CO Amb27469837 [0,2,0,0,0,0|2,0,0]=4 7229 B9R0.1 NC(CO)COCC(F)F Amb27270680 [0,2,0,0,0,0|2,0,0]=4 7230 B9R0.1 NC[C@H](O)COCC(F)F Amb28423686 [0,2,0,0,0,0|2,0,0]=4 7231 B9R0.1 N[C@@H](CO)COCC(F)F Amb28079473 [0,2,0,0,0,0|2,0,0]=4 7232 B9R0.20 CC(C)(CN)CCCCO Amb25840677 [0,2,0,0,0,0|2,0,0]=4 7233 B9R0.20 CC(C)(CN)OCCCO Amb24656854 [0,2,0,0,0,0|2,0,0]=4 7234 B9R0.20 CC(C)(CO)CCCCN Amb28398641 [0,2,0,0,0,0|2,0,0]=4 7235 B9R0.20 CC(C)(CO)NCCCF Amb27790068 [0,2,0,0,0,0|2,0,0]=4 7236 B9R0.20 CC(C)(CO)NCCCO Amb28381220 [0,2,0,0,0,0|2,0,0]=4 7237 B9R0.20 CC(C)(CO)OCCCN Amb33226352 [0,2,0,0,0,0|1,0,0]=3 7238 B9R0.20 CC(O)(CO)CCCCBr Amb27816217 [0,2,0,0,0,0|2,0,0]=4 7239 B9R0.20 CC(O)(CO)CCCCCl Amb27843362 [0,2,0,0,0,0|2,0,0]=4 7240 B9R0.20 CCC(C)(C)C#CCCO Amb28050334 [0,2,0,0,0,0|1,0,1]=4 7241 B9R0.20 CCC(C)(C)CCCCBr Amb32690602 [0,2,0,0,0,0|2,0,0]=4 7242 B9R0.20 CCC(C)(C)CCCCCl Amb32690601 [0,2,0,0,0,0|2,0,0]=4 7243 B9R0.20 CCC(C)(C)CCCCN Amb28191397 [0,2,0,0,0,0|2,0,0]=4 7244 B9R0.20 CCC(C)(C)CNCCN Amb27751051 [0,2,0,0,0,0|2,0,0]=4 7245 B9R0.20 CCC(C)(C)CNCCO Amb27650620 [0,2,0,0,0,0|1,0,0]=3 7246 B9R0.20 CCC(C)(C)OCCCN Amb7790916 [0,2,0,0,0,0|2,0,0]=4 7247 B9R0.20 CCC(C)(F)COCCN Amb28383816 [0,2,0,0,0,0|1,0,0]=3 7248 B9R0.20 CCC(C)(N)COCCF Amb27223674 [0,2,0,0,0,0|1,0,0]=3 7249 B9R0.20 CCC(C)(O)CNCCO Amb27770392 [0,2,0,0,0,0|1,0,0]=3 7250 B9R0.20 CCC(C)(O)CSCCN Amb27457085 [0,2,0,0,0,0|1,1,0]=4 7251 B9R0.20 CCCCCC(C)(C)CBr Amb26353944 [0,2,0,0,0,0|2,0,0]=4 7252 B9R0.20 CCCCCC(C)(C)CC Amb22052710 [0,2,0,0,0,0|2,0,0]=4 7253 B9R0.20 CCCCCC(C)(C)CCl Amb25804367 [0,2,0,0,0,0|2,0,0]=4 7254 B9R0.20 CCCCCC(C)(C)CN Amb20632202 [0,2,0,0,0,0|2,0,0]=4 7255 B9R0.20 CCCCCC(C)(C)CO Amb26369679 [0,2,0,0,0,0|1,0,0]=3 7256 B9R0.20 CCCCCC(C)(Cl)CC Amb22229257 [0,2,0,0,0,0|2,0,0]=4 7257 B9R0.20 CCCCCC(C)(N)CC Amb27799493 [0,2,0,0,0,0|2,0,0]=4 7258 B9R0.20 CCCCCC(C)(N)CO Amb28049699 [0,2,0,0,0,0|1,0,0]=3 7259 B9R0.20 CCCCCC(C)(O)CC Amb4017959 [0,2,0,0,0,0|2,0,0]=4 7260 B9R0.20 CCCCCC(C)(O)CCl Amb25084549 [0,2,0,0,0,0|2,0,0]=4 7261 B9R0.20 CCCCNC(C)(C)CCl Amb28134632 [0,2,0,0,0,0|2,0,0]=4 7262 B9R0.20 CCCCNC(C)(C)CO Amb6735476 [0,2,0,0,0,0|1,0,0]=3 7263 B9R0.20 CCCCOC(C)(C)C=O Amb27490093 [0,2,0,0,0,0|0,0,2]=4 7264 B9R0.20 CCCCOC(C)(C)CBr Amb27615182 [0,2,0,0,0,0|1,0,0]=3 7265 B9R0.20 CCCCOC(C)(C)CI Amb26614794 [0,2,0,0,0,0|1,0,0]=3 7266 B9R0.20 CCCCOC(C)(C)CN Amb27166410 [0,2,0,0,0,0|1,0,0]=3 7267 B9R0.20 CCCCOC(C)(C)CO Amb26484518 [0,2,0,0,0,0|0,0,0]=2 7268 B9R0.20 CCCCOP(=O)(O)CCl Amb27955777 [0,2,0,0,0,0|2,0,0]=4 7269 B9R0.20 CCCCOS(=O)(=O)CC Amb27839376 [0,2,0,0,0,0|2,0,0]=4 7270 B9R0.20 CCCCO[Si](C)(C)CCl Amb27592120 [0,2,0,0,0,0|1,1,0]=4 7271 B9R0.20 CCCCSC(C)(C)CCl Amb27480208 [0,2,0,0,0,0|1,1,0]=4 7272 B9R0.20 CCCNCC(C)(C)CO Amb28049341 [0,2,0,0,0,0|2,0,0]=4 7273 B9R0.20 CCCNCC(C)(N)CC Amb27837742 [0,2,0,0,0,0|2,0,0]=4 7274 B9R0.20 CCCOCC(C)(C)CBr Amb24720067 [0,2,0,0,0,0|2,0,0]=4 7275 B9R0.20 CCCOCC(C)(C)CCl Amb32689896 [0,2,0,0,0,0|2,0,0]=4 7276 B9R0.20 CCCOCC(C)(C)CO Amb28315855 [0,2,0,0,0,0|2,0,0]=4 7277 B9R0.20 CCCOCC(C)(F)CN Amb28250557 [0,2,0,0,0,0|2,0,0]=4 7278 B9R0.20 CCCOCC(C)(N)CO Amb27262138 [0,2,0,0,0,0|2,0,0]=4 7279 B9R0.20 CCCOCC(F)(F)CN Amb33169321 [0,2,0,0,0,0|2,0,0]=4 7280 B9R0.20 CCCSCC(C)(N)CO Amb27851558 [0,2,0,0,0,0|2,0,0]=4 7281 B9R0.20 CCCSCC(C)(O)CC Amb27406273 [0,2,0,0,0,0|1,1,0]=4 7282 B9R0.20 CCC\C=C\C(C)(C)CO Amb28138688 [0,2,0,0,0,0|1,0,1]=4 7283 B9R0.20 CCC\C=C\C(C)(N)CO Amb33424823 [0,2,0,0,0,0|1,0,1]=4 7284 B9R0.20 CCC\C=C\C(F)(F)CO Amb32745549 [0,2,0,0,0,0|1,0,1]=4 7285 B9R0.20 CCOCCC(C)(N)CO Amb27168833 [0,2,0,0,0,0|2,0,0]=4 7286 B9R0.20 CCOCSC(C)(C)CO Amb27207889 [0,2,0,0,0,0|1,1,0]=4 7287 B9R0.20 CCSCCC(C)(C)CO Amb24335083 [0,2,0,0,0,0|2,0,0]=4 7288 B9R0.20 CCSCCC(C)(N)CO Amb25785411 [0,2,0,0,0,0|2,0,0]=4 7289 B9R0.20 CC[Si](C)(C)CCCCO Amb27752358 [0,2,0,0,0,0|1,1,0]=4 7290 B9R0.20 CNC(C)(C)CCCCO Amb17569967 [0,2,0,0,0,0|2,0,0]=4 7291 B9R0.20 CNCCSC(C)(C)CO Amb27967663 [0,2,0,0,0,0|1,1,0]=4 7292 B9R0.20 COC(C)(C)CCCCO Amb27869876 [0,2,0,0,0,0|2,0,0]=4 7293 B9R0.20 COC(C)(C)COCCBr Amb27185778 [0,2,0,0,0,0|2,0,0]=4 7294 B9R0.20 COC(C)(C)COCCN Amb27426462 [0,2,0,0,0,0|2,0,0]=4 7295 B9R0.20 COCCCC(C)(C)CO Amb28056349 [0,2,0,0,0,0|2,0,0]=4 7296 B9R0.20 COCCCC(C)(N)CO Amb27196281 [0,2,0,0,0,0|2,0,0]=4 7297 B9R0.20 COCCNC(C)(C)CO Amb9273300 [0,2,0,0,0,0|2,0,0]=4 7298 B9R0.20 COCCOC(C)(C)CBr Amb24459822 [0,2,0,0,0,0|2,0,0]=4 7299 B9R0.20 COCCOC(C)(C)CI Amb28188225 [0,2,0,0,0,0|2,0,0]=4 7300 B9R0.20 COCCOC(C)(C)CN Amb19515688 [0,2,0,0,0,0|2,0,0]=4 7301 B9R0.20 COCCOC(C)(C)CN Amb24112401 [0,2,0,0,0,0|2,0,0]=4 7302 B9R0.20 CSC(C)(C)CNCCO Amb27626407 [0,2,0,0,0,0|2,0,0]=4 7303 B9R0.20 CSCCCC(C)(C)CO Amb24473183 [0,2,0,0,0,0|2,0,0]=4 7304 B9R0.20 CSCCCC(C)(N)CO Amb24757368 [0,2,0,0,0,0|2,0,0]=4 7305 B9R0.24 CC(CO)CCC(C)CO Amb25232821 [0,2,0,0,0,0|2,0,0]=4 7306 B9R0.24 CC(CO)NCC(O)CF Amb27431951 [0,2,0,0,0,0|2,0,0]=4 7307 B9R0.24 CC(CO)NC[C@H](O)CO Amb28126928 [0,2,0,0,0,0|2,0,0]=4 7308 B9R0.24 CC(CO)OCC(N)CO Amb27812541 [0,2,0,0,0,0|1,0,0]=3 7309 B9R0.24 CC(CO)SCC(O)CN Amb27867141 [0,2,0,0,0,0|1,1,0]=4 7310 B9R0.24 CCC(=O)COC(C)CC Amb27395562 [0,2,0,0,0,0|1,0,1]=4 7311 B9R0.24 CCC(=O)OCC(Br)CC Amb33276519 [0,2,0,0,0,0|1,0,1]=4 7312 B9R0.24 CCC(C)CCC(C)CCl Amb27838951 [0,2,0,0,0,0|2,0,0]=4 7313 B9R0.24 CCC(C)CCC(C)CN Amb27838972 [0,2,0,0,0,0|2,0,0]=4 7314 B9R0.24 CCC(C)CCC(N)CC Amb27436682 [0,2,0,0,0,0|2,0,0]=4 7315 B9R0.24 CCC(C)CCC(O)CCl Amb27770538 [0,2,0,0,0,0|2,0,0]=4 7316 B9R0.24 CCC(C)CNC(C)CBr Amb27602322 [0,2,0,0,0,0|2,0,0]=4 7317 B9R0.24 CCC(C)CNC(C)CC Amb6719670 [0,2,0,0,0,0|2,0,0]=4 7318 B9R0.24 CCC(C)COC(=O)CO Amb27425710 [0,2,0,0,0,0|0,0,1]=3 7319 B9R0.24 CCC(C)CSC(C)CN Amb28202833 [0,2,0,0,0,0|1,1,0]=4 7320 B9R0.24 CCC(C)NC[C@@H](O)CC Amb27802859 [0,2,0,0,0,0|2,0,0]=4 7321 B9R0.24 CCC(C)OCC(C)CBr Amb25889940 [0,2,0,0,0,0|2,0,0]=4 7322 B9R0.24 CCC(C)OCC(C)CCl Amb25273966 [0,2,0,0,0,0|2,0,0]=4 7323 B9R0.24 CCC(C)OCC(O)CN Amb27392806 [0,2,0,0,0,0|2,0,0]=4 7324 B9R0.24 CCC(C)OCC(O)CO Amb27978502 [0,2,0,0,0,0|2,0,0]=4 7325 B9R0.24 CCC(C)SCC(O)CO Amb28049667 [0,2,0,0,0,0|2,0,0]=4 7326 B9R0.24 CCC(Cl)CNC(C)CC Amb27656286 [0,2,0,0,0,0|2,0,0]=4 7327 B9R0.24 CCC(N)CCC(N)CC Amb28388809 [0,2,0,0,0,0|2,0,0]=4 7328 B9R0.24 CCC(N)CNC(C)CC Amb24477987 [0,2,0,0,0,0|2,0,0]=4 7329 B9R0.24 CCC(N)CNC(C)CO Amb33230049 [0,2,0,0,0,0|1,0,0]=3 7330 B9R0.24 CCC(N)CSC(C)CC Amb28140085 [0,2,0,0,0,0|1,1,0]=4 7331 B9R0.24 CCC(O)CCC(O)CC Amb27218701 [0,2,0,0,0,0|2,0,0]=4 7332 B9R0.24 CCC(O)CNC(C)CF Amb27762662 [0,2,0,0,0,0|2,0,0]=4 7333 B9R0.24 CCC(O)CSC(C)CN Amb28195768 [0,2,0,0,0,0|1,1,0]=4 7334 B9R0.24 CCC(O)CSC(C)CO Amb27460957 [0,2,0,0,0,0|0,1,0]=3 7335 B9R0.24 CC[C@@H](O)CC[C@H](O)CC Amb8516406 [0,2,0,0,0,0|2,0,0]=4 7336 B9R0.24 CC[C@@H](O)CNC(C)CO Amb27945389 [0,2,0,0,0,0|1,0,0]=3 7337 B9R0.24 CC[C@H](C)\C=C\[C@@H](O)CO Amb28050738 [0,2,0,0,0,0|1,0,1]=4 7338 B9R0.24 CC[C@H](O)CC[C@@H](O)CC Amb8516407 [0,2,0,0,0,0|2,0,0]=4 7339 B9R0.24 CC[C@H](O)CSC(C)CO Amb27226500 [0,2,0,0,0,0|0,1,0]=3 7340 B9R0.24 OCC(O)CCC(O)CO Amb27590583 [0,2,0,0,0,0|2,0,0]=4 7341 B9R0.47 C=C(C)C(C)OCCCC Amb27595789 [0,2,0,0,0,0|1,0,1]=4 7342 B9R0.47 C=C(C)C(O)CCCCO Amb27765710 [0,2,0,0,0,0|1,0,1]=4 7343 B9R0.47 C=C(CCCCC)[C@H](C)O Amb27406775 [0,2,0,0,0,0|1,0,1]=4 7344 B9R0.47 C=CCOC[C@@H](N)C(C)C Amb27402860 [0,2,0,0,0,0|1,0,1]=4 7345 B9R0.47 C=CCOC[C@H](N)C(C)C Amb27474127 [0,2,0,0,0,0|1,0,1]=4 7346 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [0,2,0,0,0,0|1,0,1]=4 7347 B9R0.47 CC(C)C(=O)COCCN Amb27859717 [0,2,0,0,0,0|1,0,1]=4 7348 B9R0.47 CC(C)C(C)COCCN Amb27229612 [0,2,0,0,0,0|1,0,0]=3 7349 B9R0.47 CC(C)C(C)NCCCO Amb6733655 [0,2,0,0,0,0|2,0,0]=4 7350 B9R0.47 CC(C)C(C)OCCCBr Amb27460635 [0,2,0,0,0,0|2,0,0]=4 7351 B9R0.47 CC(C)C(C)OCCCO Amb27621610 [0,2,0,0,0,0|2,0,0]=4 7352 B9R0.47 CC(C)C(Cl)CNCCF Amb27426495 [0,2,0,0,0,0|2,0,0]=4 7353 B9R0.47 CC(C)C(N)CCCCF Amb27218723 [0,2,0,0,0,0|2,0,0]=4 7354 B9R0.47 CC(C)C(N)C\C=C\CO Amb27838023 [0,2,0,0,0,0|1,0,1]=4 7355 B9R0.47 CC(C)C(O)CC#CCO Amb27761535 [0,2,0,0,0,0|1,0,1]=4 7356 B9R0.47 CC(C)C(O)CCCCF Amb27425079 [0,2,0,0,0,0|2,0,0]=4 7357 B9R0.47 CC(C)C(O)CNCCF Amb27426457 [0,2,0,0,0,0|2,0,0]=4 7358 B9R0.47 CC(C)N(C)CCCCO Amb9370173 [0,2,0,0,0,0|2,0,0]=4 7359 B9R0.47 CC(C)[C@H](N)CNCCF Amb28071812 [0,2,0,0,0,0|2,0,0]=4 7360 B9R0.47 CC(C)\C(N)=N\OCCO Amb27836461 [0,2,0,0,0,0|1,0,1]=4 7361 B9R0.47 CC(CCCCO)N(C)C Amb27959595 [0,2,0,0,0,0|2,0,0]=4 7362 B9R0.47 CC(CNCCO)S(C)=O Amb27245628 [0,2,0,0,0,0|2,0,0]=4 7363 B9R0.47 CC(N)C(C)SCCCO Amb27471461 [0,2,0,0,0,0|2,0,0]=4 7364 B9R0.47 CC(O)C(=O)OCCCCl Amb26979833 [0,2,0,0,0,0|1,0,1]=4 7365 B9R0.47 CC(O)C(=O)OCCCI Amb28062159 [0,2,0,0,0,0|1,0,1]=4 7366 B9R0.47 CC(O)C(C)C\C=C\CO Amb28050669 [0,2,0,0,0,0|1,0,1]=4 7367 B9R0.47 CC(O)C(C)NCCCF Amb27470329 [0,2,0,0,0,0|2,0,0]=4 7368 B9R0.47 CC(O)C(C)SCCCF Amb27763099 [0,2,0,0,0,0|1,1,0]=4 7369 B9R0.47 CC(O)C(O)C\C=C\CO Amb27807724 [0,2,0,0,0,0|1,0,1]=4 7370 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [0,2,0,0,0,0|1,0,1]=4 7371 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [0,2,0,0,0,0|1,0,1]=4 7372 B9R0.47 CCCCCC(Br)C(C)C Amb27877198 [0,2,0,0,0,0|2,0,0]=4 7373 B9R0.47 CCCCCC(Br)C(C)F Amb27947488 [0,2,0,0,0,0|2,0,0]=4 7374 B9R0.47 CCCCCC(Br)C(C)O Amb28049966 [0,2,0,0,0,0|1,0,0]=3 7375 B9R0.47 CCCCCC(C)C(C)C Amb10069375 [0,2,0,0,0,0|2,0,0]=4 7376 B9R0.47 CCCCCC(C)C(C)N Amb27155602 [0,2,0,0,0,0|2,0,0]=4 7377 B9R0.47 CCCCCC(C)[C@@H](C)N Amb33738432 [0,2,0,0,0,0|2,0,0]=4 7378 B9R0.47 CCCCCC(C)[C@H](C)N Amb33745259 [0,2,0,0,0,0|2,0,0]=4 7379 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [0,2,0,0,0,0|1,0,1]=4 7380 B9R0.47 CCCCCC(F)C(C)O Amb27769908 [0,2,0,0,0,0|1,0,0]=3 7381 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [0,2,0,0,0,0|1,0,1]=4 7382 B9R0.47 CCCCCC(N)C(F)F Amb28135618 [0,2,0,0,0,0|2,0,0]=4 7383 B9R0.47 CCCCCC(N)[PH](=O)O Amb28421761 [0,2,0,0,0,0|2,0,0]=4 7384 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [0,2,0,0,0,0|1,0,1]=4 7385 B9R0.47 CCCCCC(O)C(C)C Amb4036433 [0,2,0,0,0,0|2,0,0]=4 7386 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [0,2,0,0,0,0|1,0,0]=3 7387 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [0,2,0,0,0,0|1,0,1]=4 7388 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [0,2,0,0,0,0|1,0,1]=4 7389 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [0,2,0,0,0,0|1,0,1]=4 7390 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [0,2,0,0,0,0|1,0,1]=4 7391 B9R0.47 CCCCC[C@@H](O)[C@H](C)Br Amb28049949 [0,2,0,0,0,0|2,0,0]=4 7392 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [0,2,0,0,0,0|1,0,1]=4 7393 B9R0.47 CCCCC[C@H](Br)[C@H](C)O Amb27830165 [0,2,0,0,0,0|1,0,0]=3 7394 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [0,2,0,0,0,0|1,0,1]=4 7395 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [0,2,0,0,0,0|1,0,1]=4 7396 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [0,2,0,0,0,0|1,0,1]=4 7397 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,2,0,0,0,0|1,0,0]=3 7398 B9R0.47 CCCCC[C@H](O)C(C)C Amb28064175 [0,2,0,0,0,0|2,0,0]=4 7399 B9R0.47 CCCCC[C@H](O)[C@@H](C)N Amb27488726 [0,2,0,0,0,0|2,0,0]=4 7400 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [0,2,0,0,0,0|1,0,0]=3 7401 B9R0.47 CCCCNC(=O)C(C)O Amb9421393 [0,2,0,0,0,0|1,0,1]=4 7402 B9R0.47 CCCCNC(=O)[C@@H](C)O Amb25740293 [0,2,0,0,0,0|1,0,1]=4 7403 B9R0.47 CCCCNC(=O)[C@H](C)O Amb27259099 [0,2,0,0,0,0|1,0,1]=4 7404 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [0,2,0,0,0,0|1,0,1]=4 7405 B9R0.47 CCCCNC(C)C(C)Cl Amb27424247 [0,2,0,0,0,0|2,0,0]=4 7406 B9R0.47 CCCCNC(C)C(C)O Amb27874111 [0,2,0,0,0,0|1,0,0]=3 7407 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [0,2,0,0,0,0|1,0,1]=4 7408 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [0,2,0,0,0,0|1,0,1]=4 7409 B9R0.47 CCCCOC(=O)C(=O)O Amb26367223 [0,2,0,0,0,0|0,0,2]=4 7410 B9R0.47 CCCCOC(=O)C(C)Br Amb3939973 [0,2,0,0,0,0|1,0,1]=4 7411 B9R0.47 CCCCOC(=O)C(C)Cl Amb9786084 [0,2,0,0,0,0|1,0,1]=4 7412 B9R0.47 CCCCOC(=O)C(C)F Amb27816837 [0,2,0,0,0,0|1,0,1]=4 7413 B9R0.47 CCCCOC(=O)C(C)N Amb8894984 [0,2,0,0,0,0|1,0,1]=4 7414 B9R0.47 CCCCOC(=O)C(C)O Amb3939678 [0,2,0,0,0,0|0,0,1]=3 7415 B9R0.47 CCCCOC(=O)C(F)Cl Amb10840262 [0,2,0,0,0,0|1,0,1]=4 7416 B9R0.47 CCCCOC(=O)C(F)F Amb10838765 [0,2,0,0,0,0|1,0,1]=4 7417 B9R0.47 CCCCOC(=O)C(O)O Amb26507421 [0,2,0,0,0,0|0,0,1]=3 7418 B9R0.47 CCCCOC(=O)[C@H](C)N Amb26979455 [0,2,0,0,0,0|1,0,1]=4 7419 B9R0.47 CCCCOC(=O)[C@H](C)O Amb3939703 [0,2,0,0,0,0|0,0,1]=3 7420 B9R0.47 CCCCOC(C)C(=N)N Amb27393859 [0,2,0,0,0,0|1,0,1]=4 7421 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [0,2,0,0,0,0|0,0,1]=3 7422 B9R0.47 CCCCOC(C)C(C)Cl Amb28383768 [0,2,0,0,0,0|1,0,0]=3 7423 B9R0.47 CCCCOC(C)C(N)=O Amb27852771 [0,2,0,0,0,0|0,0,2]=4 7424 B9R0.47 CCCCOC(C)C(N)=S Amb18798045 [0,2,0,0,0,0|0,1,1]=4 7425 B9R0.47 CCCCOC(C)[C@@H](C)N Amb27201179 [0,2,0,0,0,0|1,0,0]=3 7426 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [0,2,0,0,0,0|0,0,1]=3 7427 B9R0.47 CCCCOC(O)C(C)C Amb27764938 [0,2,0,0,0,0|1,0,0]=3 7428 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [0,2,0,0,0,0|0,0,1]=3 7429 B9R0.47 CCCCO[C@@H](C)[C@@H](C)O Amb28050639 [0,2,0,0,0,0|0,0,0]=2 7430 B9R0.47 CCCCO[C@@H](C)[C@H](C)O Amb27790251 [0,2,0,0,0,0|0,0,0]=2 7431 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [0,2,0,0,0,0|0,1,1]=4 7432 B9R0.47 CCCCSC(C)C(C)Cl Amb27424775 [0,2,0,0,0,0|1,1,0]=4 7433 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [0,2,0,0,0,0|0,1,1]=4 7434 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [0,2,0,0,0,0|0,1,1]=4 7435 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [0,2,0,0,0,0|0,1,1]=4 7436 B9R0.47 CCCCS[C@H](C)[C@@H](C)O Amb27835113 [0,2,0,0,0,0|0,1,0]=3 7437 B9R0.47 CCCNCC(Cl)C(C)C Amb27207030 [0,2,0,0,0,0|2,0,0]=4 7438 B9R0.47 CCCNCC(O)C(C)C Amb27427929 [0,2,0,0,0,0|2,0,0]=4 7439 B9R0.47 CCCOCC(=O)C(C)N Amb28050473 [0,2,0,0,0,0|1,0,1]=4 7440 B9R0.47 CCCOCC(Cl)C(C)Cl Amb27659302 [0,2,0,0,0,0|1,0,0]=3 7441 B9R0.47 CCCOCC(N)C(C)C Amb22009215 [0,2,0,0,0,0|1,0,0]=3 7442 B9R0.47 CCCONC(C)C(C)O Amb28397524 [0,2,0,0,0,0|2,0,0]=4 7443 B9R0.47 CCCSCC(N)C(C)C Amb27649482 [0,2,0,0,0,0|1,1,0]=4 7444 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [0,2,0,0,0,0|1,0,1]=4 7445 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [0,2,0,0,0,0|1,0,1]=4 7446 B9R0.47 CCSCCC(C)C(C)O Amb27762859 [0,2,0,0,0,0|2,0,0]=4 7447 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [0,2,0,0,0,0|1,0,1]=4 7448 B9R0.47 COCCNC(C)C(C)O Amb27615108 [0,2,0,0,0,0|2,0,0]=4 7449 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [0,2,0,0,0,0|1,0,1]=4 7450 B9R0.47 COCCOC(C)[C@@H](C)N Amb28137298 [0,2,0,0,0,0|2,0,0]=4 7451 B9R0.47 COCCOC(C)[C@H](C)N Amb28066458 [0,2,0,0,0,0|2,0,0]=4 7452 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [0,2,0,0,0,0|1,0,1]=4 7453 B9R0.47 CSCCNC(C)C(C)O Amb27405157 [0,2,0,0,0,0|2,0,0]=4 7454 B9R0.47 CSCCOC(=O)C(C)O Amb28142790 [0,2,0,0,0,0|1,0,1]=4 7455 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [0,2,0,0,0,0|1,0,1]=4 7456 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [0,2,0,0,0,0|1,0,1]=4 7457 B9R0.47 C[C@@H](O)[C@@H](O)C\C=C\CO Amb27650524 [0,2,0,0,0,0|1,0,1]=4 7458 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [0,2,0,0,0,0|1,0,1]=4 7459 B9R0.47 C\C(=N/OCCO)C(C)C Amb27171866 [0,2,0,0,0,0|1,0,1]=4 7460 B9R0.47 NCCCOC(N)C(=O)O Amb27838076 [0,2,0,0,0,0|1,0,1]=4 7461 B9R0.50 C#CC(CBr)OCCCC Amb28458090 [0,2,0,0,0,0|1,0,0]=3 7462 B9R0.50 C#CC(CC)NCCCC Amb28137650 [0,2,0,0,0,0|2,0,0]=4 7463 B9R0.50 C=C=C(CC)CCCCO Amb27614980 [0,2,0,0,0,0|1,0,1]=4 7464 B9R0.50 C=C=C(CC)COCCCl Amb27473379 [0,2,0,0,0,0|1,0,1]=4 7465 B9R0.50 C=C=C(CC)COCCO Amb27662187 [0,2,0,0,0,0|0,0,1]=3 7466 B9R0.50 C=CC(CO)CCCCC Amb27977343 [0,2,0,0,0,0|1,0,0]=3 7467 B9R0.50 C=CC(CO)CCCCO Amb27664638 [0,2,0,0,0,0|2,0,0]=4 7468 B9R0.50 C=CC(COCCO)OC Amb27589018 [0,2,0,0,0,0|1,0,0]=3 7469 B9R0.50 C=CCCOC(CO)CO Amb27835873 [0,2,0,0,0,0|0,0,2]=4 7470 B9R0.50 C=CCCO[C@H](C=C)CO Amb28050631 [0,2,0,0,0,0|0,0,2]=4 7471 B9R0.50 C=CCOCC(CC)CBr Amb24524562 [0,2,0,0,0,0|1,0,1]=4 7472 B9R0.50 C=CCOCC(CC)CCl Amb32689852 [0,2,0,0,0,0|1,0,1]=4 7473 B9R0.50 C=CCOCC(CC)CS Amb27488013 [0,2,0,0,0,0|1,0,1]=4 7474 B9R0.50 CCC(C#N)SCCCO Amb28386291 [0,2,0,0,0,0|2,0,0]=4 7475 B9R0.50 CCC(CC)CCCCBr Amb27460595 [0,2,0,0,0,0|2,0,0]=4 7476 B9R0.50 CCC(CC)CCCCCl Amb27823192 [0,2,0,0,0,0|2,0,0]=4 7477 B9R0.50 CCC(CC)CCCCN Amb24373288 [0,2,0,0,0,0|2,0,0]=4 7478 B9R0.50 CCC(CC)CCCCO Amb26581149 [0,2,0,0,0,0|1,0,0]=3 7479 B9R0.50 CCC(CC)CNCCBr Amb28126841 [0,2,0,0,0,0|2,0,0]=4 7480 B9R0.50 CCC(CC)CNCCCl Amb28254878 [0,2,0,0,0,0|2,0,0]=4 7481 B9R0.50 CCC(CC)CNCCO Amb9203174 [0,2,0,0,0,0|1,0,0]=3 7482 B9R0.50 CCC(CC)CNCCS Amb28456178 [0,2,0,0,0,0|1,1,0]=4 7483 B9R0.50 CCC(CC)COCC#N Amb28253263 [0,2,0,0,0,0|1,0,1]=4 7484 B9R0.50 CCC(CC)CSCCO Amb27874567 [0,2,0,0,0,0|0,1,0]=3 7485 B9R0.50 CCC(CC)OCCCBr Amb25916495 [0,2,0,0,0,0|2,0,0]=4 7486 B9R0.50 CCC(CC)OCCCCl Amb25851628 [0,2,0,0,0,0|2,0,0]=4 7487 B9R0.50 CCC(CC)OCCCN Amb27208537 [0,2,0,0,0,0|2,0,0]=4 7488 B9R0.50 CCC(CC)SCCCO Amb28364480 [0,2,0,0,0,0|2,0,0]=4 7489 B9R0.50 CCC(CCCCN)OC Amb25959007 [0,2,0,0,0,0|2,0,0]=4 7490 B9R0.50 CCC(CCCCO)OC Amb27617717 [0,2,0,0,0,0|1,0,0]=3 7491 B9R0.50 CCC(CN)OCCCO Amb24750188 [0,2,0,0,0,0|2,0,0]=4 7492 B9R0.50 CCC(CNCCBr)OC Amb28457398 [0,2,0,0,0,0|2,0,0]=4 7493 B9R0.50 CCC(CNCCCl)OC Amb27216441 [0,2,0,0,0,0|2,0,0]=4 7494 B9R0.50 CCC(CNCCO)OC Amb27973560 [0,2,0,0,0,0|1,0,0]=3 7495 B9R0.50 CCC(CO)CCCCO Amb27770514 [0,2,0,0,0,0|1,0,0]=3 7496 B9R0.50 CCC(CO)NCCCN Amb27770580 [0,2,0,0,0,0|2,0,0]=4 7497 B9R0.50 CCC(CO)NCCSC Amb28188146 [0,2,0,0,0,0|2,0,0]=4 7498 B9R0.50 CCC(CSCCO)NC Amb28182647 [0,2,0,0,0,0|0,1,0]=3 7499 B9R0.50 CCC(CSCCO)OC Amb27195641 [0,2,0,0,0,0|0,1,0]=3 7500 B9R0.50 CCC(OC)OCCCN Amb33341580 [0,2,0,0,0,0|2,0,0]=4 7501 B9R0.50 CCC(OC)OCCCO Amb27605448 [0,2,0,0,0,0|2,0,0]=4 7502 B9R0.50 CCC(\C=C\CCO)CO Amb27220507 [0,2,0,0,0,0|1,0,1]=4 7503 B9R0.50 CCCC#CC(CO)CO Amb27761555 [0,2,0,0,0,0|1,0,1]=4 7504 B9R0.50 CCCCCC(C=O)CC Amb25883306 [0,2,0,0,0,0|2,0,0]=4 7505 B9R0.50 CCCCCC(CC)CBr Amb26369673 [0,2,0,0,0,0|2,0,0]=4 7506 B9R0.50 CCCCCC(CC)CC Amb22229275 [0,2,0,0,0,0|2,0,0]=4 7507 B9R0.50 CCCCCC(CC)CCl Amb26369462 [0,2,0,0,0,0|2,0,0]=4 7508 B9R0.50 CCCCCC(CC)CO Amb27831173 [0,2,0,0,0,0|1,0,0]=3 7509 B9R0.50 CCCCCC(CC)NN Amb28072731 [0,2,0,0,0,0|2,0,0]=4 7510 B9R0.50 CCCCCC(CC)OC Amb27425019 [0,2,0,0,0,0|2,0,0]=4 7511 B9R0.50 CCCCCC(CC)ON Amb28292988 [0,2,0,0,0,0|2,0,0]=4 7512 B9R0.50 CCCCCC(CN)CO Amb27465223 [0,2,0,0,0,0|1,0,0]=3 7513 B9R0.50 CCCCCC(CN)OC Amb25989930 [0,2,0,0,0,0|2,0,0]=4 7514 B9R0.50 CCCCCC(CN)SC Amb27249496 [0,2,0,0,0,0|2,0,0]=4 7515 B9R0.50 CCCCCC(CO)CS Amb27839186 [0,2,0,0,0,0|1,0,0]=3 7516 B9R0.50 CCCCCC(CO)SC Amb27457183 [0,2,0,0,0,0|1,0,0]=3 7517 B9R0.50 CCCCC[C@@H](C=O)CC Amb27792864 [0,2,0,0,0,0|2,0,0]=4 7518 B9R0.50 CCCCC[C@@H](CC)CO Amb28050752 [0,2,0,0,0,0|1,0,0]=3 7519 B9R0.50 CCCCNC(C#N)CC Amb27424952 [0,2,0,0,0,0|2,0,0]=4 7520 B9R0.50 CCCCNC(CC)CBr Amb28198883 [0,2,0,0,0,0|2,0,0]=4 7521 B9R0.50 CCCCNC(CC)CO Amb4304056 [0,2,0,0,0,0|1,0,0]=3 7522 B9R0.50 CCCCN[C@@H](CC)CO Amb28369528 [0,2,0,0,0,0|1,0,0]=3 7523 B9R0.50 CCCCOC(C#N)CC Amb28066543 [0,2,0,0,0,0|1,0,0]=3 7524 B9R0.50 CCCCOC(CC)CBr Amb5494000 [0,2,0,0,0,0|1,0,0]=3 7525 B9R0.50 CCCCOC(CC)CO Amb26324075 [0,2,0,0,0,0|0,0,0]=2 7526 B9R0.50 CCCCOC(CN)CO Amb32721464 [0,2,0,0,0,0|0,0,0]=2 7527 B9R0.50 CCCCOC(CO)CCl Amb28042708 [0,2,0,0,0,0|0,0,0]=2 7528 B9R0.50 CCCCOC(CO)CO Amb28050521 [0,2,0,0,0,0|0,0,0]=2 7529 B9R0.50 CCCCOC(CO)OC Amb27606709 [0,2,0,0,0,0|0,0,0]=2 7530 B9R0.50 CCCCSC(C=O)CC Amb27799813 [0,2,0,0,0,0|1,1,0]=4 7531 B9R0.50 CCCCSC(CC)CC Amb28349735 [0,2,0,0,0,0|1,1,0]=4 7532 B9R0.50 CCCCSC(CCl)CCl Amb28121934 [0,2,0,0,0,0|1,1,0]=4 7533 B9R0.50 CCCNCC(CC)CC Amb6262228 [0,2,0,0,0,0|2,0,0]=4 7534 B9R0.50 CCCNCC(CC)OC Amb27229568 [0,2,0,0,0,0|2,0,0]=4 7535 B9R0.50 CCCOCC(CC)CBr Amb26554699 [0,2,0,0,0,0|1,0,0]=3 7536 B9R0.50 CCCOCC(CC)CCl Amb32689897 [0,2,0,0,0,0|1,0,0]=3 7537 B9R0.50 CCCOCC(CO)NC Amb27448150 [0,2,0,0,0,0|2,0,0]=4 7538 B9R0.50 CCCONC(CC)CC Amb27875478 [0,2,0,0,0,0|2,0,0]=4 7539 B9R0.50 CCCSCC(CO)NC Amb27839117 [0,2,0,0,0,0|2,0,0]=4 7540 B9R0.50 CCC\C=C\C(CN)CO Amb33424868 [0,2,0,0,0,0|1,0,1]=4 7541 B9R0.50 CCN(CC)CCCCO Amb4313869 [0,2,0,0,0,0|2,0,0]=4 7542 B9R0.50 CCOCCC(CO)NC Amb27615062 [0,2,0,0,0,0|2,0,0]=4 7543 B9R0.50 CCOCOC(CO)CO Amb28138864 [0,2,0,0,0,0|1,0,0]=3 7544 B9R0.50 CCSCCC(CO)NC Amb27839120 [0,2,0,0,0,0|2,0,0]=4 7545 B9R0.50 CC[C@H](CO)NCCOC Amb27437256 [0,2,0,0,0,0|2,0,0]=4 7546 B9R0.50 CNC(C#N)CCCCO Amb24479129 [0,2,0,0,0,0|2,0,0]=4 7547 B9R0.50 COC(CCCCO)OC Amb28288932 [0,2,0,0,0,0|2,0,0]=4 7548 B9R0.50 COC(CNCCO)OC Amb18633482 [0,2,0,0,0,0|2,0,0]=4 7549 B9R0.50 COC(COCCN)OC Amb25703974 [0,2,0,0,0,0|2,0,0]=4 7550 B9R0.50 COCCCC(C#N)CO Amb27982323 [0,2,0,0,0,0|2,0,0]=4 7551 B9R0.50 COCCCC(CO)CO Amb27219939 [0,2,0,0,0,0|2,0,0]=4 7552 B9R0.50 COCCNC(CN)CO Amb27250953 [0,2,0,0,0,0|2,0,0]=4 7553 B9R0.50 COCCOC(CO)OC Amb28350083 [0,2,0,0,0,0|1,0,0]=3 7554 B9R0.50 CSC(CCCCO)SC Amb28050731 [0,2,0,0,0,0|2,0,0]=4 7555 B9R0.50 CSCCCC(C#N)CO Amb28250573 [0,2,0,0,0,0|2,0,0]=4 7556 B9R0.50 CSCCCC(CN)CO Amb28136196 [0,2,0,0,0,0|2,0,0]=4 7557 B9R0.50 OCC(CO)NCCCF Amb28049567 [0,2,0,0,0,0|2,0,0]=4 7558 B9R0.50 OCCCOC(CO)CO Amb27978234 [0,2,0,0,0,0|1,0,0]=3 7559 B9R0.38 CC(C)(C)CCCCCBr Amb27153170 [0,2,0,0,0,0|2,0,0]=4 7560 B9R0.38 CC(C)(C)CCCCCCl Amb27247922 [0,2,0,0,0,0|2,0,0]=4 7561 B9R0.38 CC(C)(C)CCCCCN Amb28241232 [0,2,0,0,0,0|2,0,0]=4 7562 B9R0.38 CC(C)(C)CCCCCO Amb27880910 [0,2,0,0,0,0|1,0,0]=3 7563 B9R0.38 CC(C)(C)CCNCCCl Amb27833793 [0,2,0,0,0,0|2,0,0]=4 7564 B9R0.38 CC(C)(C)CCNCCO Amb27452436 [0,2,0,0,0,0|1,0,0]=3 7565 B9R0.38 CC(C)(C)CCOCCCl Amb27869842 [0,2,0,0,0,0|1,0,0]=3 7566 B9R0.38 CC(C)(C)CCOCCN Amb21954029 [0,2,0,0,0,0|1,0,0]=3 7567 B9R0.38 CC(C)(C)CCOCCO Amb28249832 [0,2,0,0,0,0|0,0,0]=2 7568 B9R0.38 CC(C)(C)CCOCON Amb27213394 [0,2,0,0,0,0|2,0,0]=4 7569 B9R0.38 CC(C)(C)CCSCCCl Amb28347862 [0,2,0,0,0,0|1,1,0]=4 7570 B9R0.38 CC(C)(C)CCSCCN Amb8876133 [0,2,0,0,0,0|1,1,0]=4 7571 B9R0.38 CC(C)(C)CNCCCO Amb19373346 [0,2,0,0,0,0|2,0,0]=4 7572 B9R0.38 CC(C)(C)COCCCN Amb23449223 [0,2,0,0,0,0|2,0,0]=4 7573 B9R0.38 CC(C)(C)OCOCCN Amb27594104 [0,2,0,0,0,0|2,0,0]=4 7574 B9R0.38 CC(C)(C)OCSCCO Amb27594110 [0,2,0,0,0,0|1,1,0]=4 7575 B9R0.38 CC(C)(Cl)CCOCCCl Amb27770400 [0,2,0,0,0,0|1,0,0]=3 7576 B9R0.38 CC(C)(F)CCOCC#N Amb28135796 [0,2,0,0,0,0|1,0,1]=4 7577 B9R0.38 CC(C)(N)CNCCCO Amb28321691 [0,2,0,0,0,0|2,0,0]=4 7578 B9R0.38 CC(C)(N)COCCCF Amb27590877 [0,2,0,0,0,0|2,0,0]=4 7579 B9R0.38 CC(C)(O)CCCCCBr Amb25737898 [0,2,0,0,0,0|2,0,0]=4 7580 B9R0.38 CC(C)(O)CCCCCN Amb27593876 [0,2,0,0,0,0|2,0,0]=4 7581 B9R0.38 CC(C)(O)CC\C=C\CO Amb27839190 [0,2,0,0,0,0|1,0,1]=4 7582 B9R0.38 CC(C)(O)CNCCCF Amb27167783 [0,2,0,0,0,0|2,0,0]=4 7583 B9R0.38 CC(C)(O)CNCCCO Amb22723314 [0,2,0,0,0,0|2,0,0]=4 7584 B9R0.38 CC(C)(O)COCCCCl Amb27461452 [0,2,0,0,0,0|1,0,0]=3 7585 B9R0.38 CC(C)(O)COCCCN Amb27640883 [0,2,0,0,0,0|1,0,0]=3 7586 B9R0.38 CC(C)(S)CCCCCO Amb27853563 [0,2,0,0,0,0|1,0,0]=3 7587 B9R0.38 CC(F)(F)CCCCCBr Amb25309673 [0,2,0,0,0,0|2,0,0]=4 7588 B9R0.38 CC(F)(F)CCCCCCl Amb32691350 [0,2,0,0,0,0|2,0,0]=4 7589 B9R0.38 CC(F)(F)CCCCCN Amb28045023 [0,2,0,0,0,0|2,0,0]=4 7590 B9R0.38 CC(F)(F)CCCCCO Amb27827320 [0,2,0,0,0,0|1,0,0]=3 7591 B9R0.38 CC(F)(F)CCNCCF Amb28054693 [0,2,0,0,0,0|2,0,0]=4 7592 B9R0.38 CC(F)(F)CCOCC#N Amb27246731 [0,2,0,0,0,0|1,0,1]=4 7593 B9R0.38 CC(F)(F)CCSCCN Amb27199896 [0,2,0,0,0,0|1,1,0]=4 7594 B9R0.38 CC(F)(F)COCCCN Amb27877162 [0,2,0,0,0,0|2,0,0]=4 7595 B9R0.38 CCCCC#CC(C)(C)O Amb27958438 [0,2,0,0,0,0|1,0,1]=4 7596 B9R0.38 CCCCCCC(C)(C)C Amb10069374 [0,2,0,0,0,0|2,0,0]=4 7597 B9R0.38 CCCCCCC(C)(C)Cl Amb22228729 [0,2,0,0,0,0|2,0,0]=4 7598 B9R0.38 CCCCCCC(C)(C)N Amb26336797 [0,2,0,0,0,0|2,0,0]=4 7599 B9R0.38 CCCCCCC(C)(C)S Amb6366514 [0,2,0,0,0,0|1,1,0]=4 7600 B9R0.38 CCCCCCC(F)(Cl)Cl Amb10840161 [0,2,0,0,0,0|2,0,0]=4 7601 B9R0.38 CCCCCCC(F)(F)F Amb17672623 [0,2,0,0,0,0|2,0,0]=4 7602 B9R0.38 CCCCCCP(=O)(O)O Amb3371952 [0,2,0,0,0,0|2,0,0]=4 7603 B9R0.38 CCCCCCS(=O)(=O)O Amb25138206 [0,2,0,0,0,0|2,0,0]=4 7604 B9R0.38 CCCCNCC(C)(C)Br Amb27838125 [0,2,0,0,0,0|2,0,0]=4 7605 B9R0.38 CCCCNCC(C)(C)F Amb27453060 [0,2,0,0,0,0|2,0,0]=4 7606 B9R0.38 CCCCNCC(F)(F)Br Amb28119694 [0,2,0,0,0,0|2,0,0]=4 7607 B9R0.38 CCCCNCC(F)(F)F Amb6276541 [0,2,0,0,0,0|2,0,0]=4 7608 B9R0.38 CCCCNCC(F)(F)F Amb7969722 [0,2,0,0,0,0|2,0,0]=4 7609 B9R0.38 CCCCNCP(C)(=O)O Amb1776475 [0,2,0,0,0,0|2,0,0]=4 7610 B9R0.38 CCCCOCC(C)(C)N Amb17485999 [0,2,0,0,0,0|1,0,0]=3 7611 B9R0.38 CCCCSCC(C)(C)N Amb28422265 [0,2,0,0,0,0|1,1,0]=4 7612 B9R0.38 CCCCSCC(C)(C)O Amb18792455 [0,2,0,0,0,0|0,1,0]=3 7613 B9R0.38 CCCNCCC(C)(C)C Amb9204027 [0,2,0,0,0,0|2,0,0]=4 7614 B9R0.38 CCCNCCC(C)(C)N Amb27839014 [0,2,0,0,0,0|2,0,0]=4 7615 B9R0.38 CCCNCCC(C)(C)O Amb27786325 [0,2,0,0,0,0|2,0,0]=4 7616 B9R0.38 CCCONCC(C)(C)N Amb28143126 [0,2,0,0,0,0|2,0,0]=4 7617 B9R0.38 CCCSCCC(C)(C)O Amb28254020 [0,2,0,0,0,0|1,1,0]=4 7618 B9R0.38 CCC\C=C\CC(C)(C)O Amb33327140 [0,2,0,0,0,0|1,0,1]=4 7619 B9R0.38 CNCCCCC(C)(C)O Amb17569963 [0,2,0,0,0,0|2,0,0]=4 7620 B9R0.38 CNCCOCC(C)(C)O Amb27660741 [0,2,0,0,0,0|1,0,0]=3 7621 B9R0.38 CNCCOCC(F)(F)F Amb18791798 [0,2,0,0,0,0|2,0,0]=4 7622 B9R0.38 COCCNCC(C)(C)O Amb17138418 [0,2,0,0,0,0|2,0,0]=4 7623 B9R0.38 COCCOCC(C)(C)C Amb25146240 [0,2,0,0,0,0|2,0,0]=4 7624 B9R0.38 COCCOCC(C)(C)N Amb26435429 [0,2,0,0,0,0|2,0,0]=4 7625 B9R0.38 COCCOCC(C)(C)O Amb22348060 [0,2,0,0,0,0|1,0,0]=3 7626 B9R0.38 COCCOCC(F)(F)F Amb28382057 [0,2,0,0,0,0|2,0,0]=4 7627 B9R0.38 COCCSCC(C)(C)O Amb18792608 [0,2,0,0,0,0|1,1,0]=4 7628 B9R0.38 CS(=O)(=O)CCOCCN Amb17502064 [0,2,0,0,0,0|2,0,0]=4 7629 B9R0.38 CS(=O)(=O)CCOCCN Amb19352281 [0,2,0,0,0,0|2,0,0]=4 7630 B9R0.38 CS(=O)(=O)CCSCCO Amb18324344 [0,2,0,0,0,0|1,1,0]=4 7631 B9R0.38 CSCCNCC(C)(C)O Amb27224600 [0,2,0,0,0,0|2,0,0]=4 7632 B9R0.38 CSCCOCC(C)(C)N Amb27477588 [0,2,0,0,0,0|2,0,0]=4 7633 B9R0.38 C[N+](C)(C)CCCCCO Amb27980112 [0,2,0,0,0,0|2,0,0]=4 7634 B9R0.38 C[N+](C)(C)CCNCCO Amb27169593 [0,2,0,0,0,0|2,0,0]=4 7635 B9R0.38 C[N+](C)(C)CCOCCCl Amb27839634 [0,2,0,0,0,0|2,0,0]=4 7636 B9R0.38 C[Si](C)(C)CCCCCO Amb28350371 [0,2,0,0,0,0|1,1,0]=4 7637 B9R0.38 C[Si](C)(C)CCSCCO Amb27762981 [0,2,0,0,0,0|0,2,0]=4 7638 B9R0.38 FC(F)(F)CCOCCCl Amb27479660 [0,2,0,0,0,0|2,0,0]=4 7639 B9R0.38 FC(F)(F)CCOCCS Amb27391812 [0,2,0,0,0,0|1,1,0]=4 7640 B9R0.38 FC(F)(F)COCCCBr Amb9209731 [0,2,0,0,0,0|2,0,0]=4 7641 B9R0.38 FC(F)(F)COCCCCl Amb6256083 [0,2,0,0,0,0|2,0,0]=4 7642 B9R0.38 NCCCOCC(F)(F)F Amb10203828 [0,2,0,0,0,0|2,0,0]=4 7643 B9R0.38 NCCCOCC(F)(F)F Amb1138245 [0,2,0,0,0,0|2,0,0]=4 7644 B9R0.38 O=S(=O)([O-])CCOCCO Amb27752361 [0,2,0,0,0,0|2,0,0]=4 7645 B9R0.38 OCCCCCC(F)(F)F Amb27410956 [0,2,0,0,0,0|2,0,0]=4 7646 B9R0.38 OCCCOCC(F)(F)F Amb18787748 [0,2,0,0,0,0|2,0,0]=4 7647 B9R0.38 OCCNCCC(F)(F)F Amb27843075 [0,2,0,0,0,0|2,0,0]=4 7648 B9R0.38 OCCOCCC(F)(F)F Amb27823193 [0,2,0,0,0,0|1,0,0]=3 7649 B9R0.55 C=C(C)CCCCC(C)O Amb27590791 [0,2,0,0,0,0|1,0,1]=4 7650 B9R0.55 C=C(C)CCNC[C@@H](C)O Amb27232911 [0,2,0,0,0,0|1,0,1]=4 7651 B9R0.55 C=C(C)COCCC(C)O Amb28315218 [0,2,0,0,0,0|1,0,1]=4 7652 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [0,2,0,0,0,0|1,0,1]=4 7653 B9R0.55 CC(=O)CCOCC(=O)O Amb27241199 [0,2,0,0,0,0|0,0,2]=4 7654 B9R0.55 CC(=O)CCOCC(C)C Amb7764634 [0,2,0,0,0,0|1,0,1]=4 7655 B9R0.55 CC(C)=CCOCC(C)O Amb27839572 [0,2,0,0,0,0|0,0,2]=4 7656 B9R0.55 CC(C)CCCCB(O)O Amb27615027 [0,2,0,0,0,0|2,0,0]=4 7657 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,2,0,0,0,0|1,0,1]=4 7658 B9R0.55 CC(C)CCCCC(C)C Amb22043289 [0,2,0,0,0,0|2,0,0]=4 7659 B9R0.55 CC(C)CCCCC(C)N Amb27830700 [0,2,0,0,0,0|2,0,0]=4 7660 B9R0.55 CC(C)CCCCC(O)O Amb27761556 [0,2,0,0,0,0|1,0,0]=3 7661 B9R0.55 CC(C)CCCC[C@@H](C)N Amb33731285 [0,2,0,0,0,0|2,0,0]=4 7662 B9R0.55 CC(C)CCCC[C@H](C)N Amb33729329 [0,2,0,0,0,0|2,0,0]=4 7663 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,2,0,0,0,0|1,0,1]=4 7664 B9R0.55 CC(C)CCNCC(C)C Amb6692732 [0,2,0,0,0,0|2,0,0]=4 7665 B9R0.55 CC(C)CCNCC(F)F Amb18177901 [0,2,0,0,0,0|2,0,0]=4 7666 B9R0.55 CC(C)CCNC[C@@H](C)O Amb27812132 [0,2,0,0,0,0|1,0,0]=3 7667 B9R0.55 CC(C)CCOCC(=O)Cl Amb27441228 [0,2,0,0,0,0|0,0,2]=4 7668 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,2,0,0,0,0|0,0,1]=3 7669 B9R0.55 CC(C)CCOCC(C)N Amb6661416 [0,2,0,0,0,0|1,0,0]=3 7670 B9R0.55 CC(C)CCOCC(N)=S Amb6262163 [0,2,0,0,0,0|0,1,1]=4 7671 B9R0.55 CC(C)CCOC[C@@H](C)O Amb28145728 [0,2,0,0,0,0|0,0,0]=2 7672 B9R0.55 CC(C)CCOC[C@H](C)N Amb28255350 [0,2,0,0,0,0|1,0,0]=3 7673 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,2,0,0,0,0|0,1,1]=4 7674 B9R0.55 CC(C)CCSCC(C)N Amb28128185 [0,2,0,0,0,0|1,1,0]=4 7675 B9R0.55 CC(C)CNCCC(C)Cl Amb28256358 [0,2,0,0,0,0|2,0,0]=4 7676 B9R0.55 CC(C)CNCC[C@@H](C)N Amb27216669 [0,2,0,0,0,0|2,0,0]=4 7677 B9R0.55 CC(C)CNCC[C@H](C)N Amb27804036 [0,2,0,0,0,0|2,0,0]=4 7678 B9R0.55 CC(C)COCCN(C)C Amb27755711 [0,2,0,0,0,0|2,0,0]=4 7679 B9R0.55 CC(C)CONC[C@@H](C)O Amb28200140 [0,2,0,0,0,0|2,0,0]=4 7680 B9R0.55 CC(C)CONC[C@H](C)O Amb27859515 [0,2,0,0,0,0|2,0,0]=4 7681 B9R0.55 CC(C)CSCCC(C)F Amb27484345 [0,2,0,0,0,0|1,1,0]=4 7682 B9R0.55 CC(C)C\C=C\CC(C)O Amb27968433 [0,2,0,0,0,0|1,0,1]=4 7683 B9R0.55 CC(C)OCCC[C@@H](C)O Amb33274398 [0,2,0,0,0,0|2,0,0]=4 7684 B9R0.55 CC(C)OCCC[C@H](C)O Amb33274415 [0,2,0,0,0,0|2,0,0]=4 7685 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,2,0,0,0,0|1,0,1]=4 7686 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [0,2,0,0,0,0|0,0,1]=3 7687 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [0,2,0,0,0,0|0,1,1]=4 7688 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [0,2,0,0,0,0|1,0,1]=4 7689 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [0,2,0,0,0,0|1,0,1]=4 7690 B9R0.55 CC(N)CCNCC(F)F Amb28245176 [0,2,0,0,0,0|2,0,0]=4 7691 B9R0.55 CC(N)CCOCC(F)F Amb27270748 [0,2,0,0,0,0|1,0,0]=3 7692 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [0,2,0,0,0,0|0,1,1]=4 7693 B9R0.55 CC(N)CCSCC(C)N Amb27771520 [0,2,0,0,0,0|1,1,0]=4 7694 B9R0.55 CC(N)CCSCC(C)O Amb27975275 [0,2,0,0,0,0|0,1,0]=3 7695 B9R0.55 CC(N)CCSCC(F)F Amb27201182 [0,2,0,0,0,0|1,1,0]=4 7696 B9R0.55 CC(O)C#CCCC(C)C Amb27457739 [0,2,0,0,0,0|1,0,1]=4 7697 B9R0.55 CC(O)CCCCC(C)O Amb27839243 [0,2,0,0,0,0|1,0,0]=3 7698 B9R0.55 CC(O)CCCCN(C)C Amb24271124 [0,2,0,0,0,0|2,0,0]=4 7699 B9R0.55 CC(O)CCCCS(C)=O Amb28197304 [0,2,0,0,0,0|2,0,0]=4 7700 B9R0.55 CC(O)CCCOC(C)C Amb24450979 [0,2,0,0,0,0|2,0,0]=4 7701 B9R0.55 CC(O)CCCSC(C)C Amb27472017 [0,2,0,0,0,0|2,0,0]=4 7702 B9R0.55 CC(O)CCNCC(C)O Amb28382659 [0,2,0,0,0,0|1,0,0]=3 7703 B9R0.55 CC(O)CCOCC(F)F Amb28140922 [0,2,0,0,0,0|1,0,0]=3 7704 B9R0.55 CC(O)CNCCC(F)F Amb28049767 [0,2,0,0,0,0|2,0,0]=4 7705 B9R0.55 CC(O)CNCCN(C)C Amb5722654 [0,2,0,0,0,0|2,0,0]=4 7706 B9R0.55 CC(O)CNNCC(C)O Amb27839323 [0,2,0,0,0,0|2,0,0]=4 7707 B9R0.55 CC(O)CSSCC(C)O Amb27618453 [0,2,0,0,0,0|1,1,0]=4 7708 B9R0.55 CN(C)CCOCC(=O)O Amb20667765 [0,2,0,0,0,0|1,0,1]=4 7709 B9R0.55 CN(C)CCOCC(=O)O Amb22059502 [0,2,0,0,0,0|1,0,1]=4 7710 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [0,2,0,0,0,0|1,0,1]=4 7711 B9R0.55 C[C@@H](O)CCCCN(C)C Amb33272253 [0,2,0,0,0,0|2,0,0]=4 7712 B9R0.55 C[C@H](N)CCOCC(F)F Amb27402799 [0,2,0,0,0,0|1,0,0]=3 7713 B9R0.55 C[C@H](O)CCCCN(C)C Amb33272255 [0,2,0,0,0,0|2,0,0]=4 7714 B9R0.55 C[C@H](O)CNCCC(F)F Amb28325226 [0,2,0,0,0,0|2,0,0]=4 7715 B9R0.55 C[C@H](O)CSSC[C@H](C)O Amb27977693 [0,2,0,0,0,0|1,1,0]=4 7716 B9R0.55 O=C(O)COCCC(F)F Amb27848670 [0,2,0,0,0,0|1,0,1]=4 7717 B7R1.1 BrCC1CCCC1 Amb8631537 [1,0,0,1,0,0|1,0,0]=3 7718 B7R1.1 BrCC1CCCN1 Amb20618588 [1,0,0,1,0,0|2,0,0]=4 7719 B7R1.1 BrCC1CCCN1 Amb21962027 [1,0,0,1,0,0|2,0,0]=4 7720 B7R1.1 BrCC1CCCN1 Amb32411817 [1,0,0,1,0,0|2,0,0]=4 7721 B7R1.1 BrCC1CCCO1 Amb9703505 [1,0,0,1,0,0|1,0,0]=3 7722 B7R1.1 BrCC1CCCS1 Amb27832399 [1,0,0,1,0,0|1,1,0]=4 7723 B7R1.1 BrCC1CCNC1 Amb20618587 [1,0,0,1,0,0|2,0,0]=4 7724 B7R1.1 BrCC1CCNC1 Amb22229236 [1,0,0,1,0,0|2,0,0]=4 7725 B7R1.1 BrCC1CCNC1 Amb33483362 [1,0,0,1,0,0|2,0,0]=4 7726 B7R1.1 BrCC1CCOC1 Amb8835455 [1,0,0,1,0,0|1,0,0]=3 7727 B7R1.1 BrCC1CCSC1 Amb27630698 [1,0,0,1,0,0|1,1,0]=4 7728 B7R1.1 BrCC1OCCO1 Amb3940345 [1,0,0,1,0,0|1,0,0]=3 7729 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [1,0,0,1,0,0|2,0,0]=4 7730 B7R1.1 BrC[C@@H]1CCCN1 Amb32668728 [1,0,0,1,0,0|2,0,0]=4 7731 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [1,0,0,1,0,0|1,0,0]=3 7732 B7R1.1 BrC[C@H]1CCCO1 Amb26844489 [1,0,0,1,0,0|1,0,0]=3 7733 B7R1.1 Br[Mg][C@H]1CCOC1 Amb32643924 [1,0,0,1,0,0|2,0,0]=4 7734 B7R1.1 C#CC1CCCC1 Amb8396063 [1,0,0,1,0,0|1,0,1]=4 7735 B7R1.1 C#CC1CCCO1 Amb27874548 [1,0,0,1,0,0|0,0,2]=4 7736 B7R1.1 C#CC1CCOC1 Amb23439658 [1,0,0,1,0,0|0,0,2]=4 7737 B7R1.1 C=CC1CCCC1 Amb17934190 [1,0,0,1,0,0|1,0,1]=4 7738 B7R1.1 C=CC1CCCO1 Amb28137321 [1,0,0,1,0,0|0,0,2]=4 7739 B7R1.1 C=CC1CCOC1 Amb24478877 [1,0,0,1,0,0|0,0,2]=4 7740 B7R1.1 C=CC1OCCO1 Amb3941557 [1,0,0,1,0,0|0,0,2]=4 7741 B7R1.1 CC=C1CCCC1 Amb4035880 [1,0,0,1,0,0|1,0,1]=4 7742 B7R1.1 CCC1=CCCC1 Amb4035875 [1,0,0,1,0,0|1,0,1]=4 7743 B7R1.1 CCC1=NCCC1 Amb22055207 [1,0,0,1,0,0|1,0,1]=4 7744 B7R1.1 CCC1=NCCO1 Amb8513557 [1,0,0,1,0,0|1,0,1]=4 7745 B7R1.1 CCC1C=CCC1 Amb4020582 [1,0,0,1,0,0|1,0,1]=4 7746 B7R1.1 CCC1CC=CC1 Amb30033009 [1,0,0,1,0,0|1,0,1]=4 7747 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|1,0,0]=3 7748 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,0]=3 7749 B7R1.1 CCC1CCCN1 Amb3788096 [1,0,0,1,0,0|1,0,0]=3 7750 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,1,0]=3 7751 B7R1.1 CCC1CCC[Cl+]1 Amb28076649 [1,0,0,1,0,0|1,0,0]=3 7752 B7R1.1 CCC1CCNC1 Amb18946548 [1,0,0,1,0,0|1,0,0]=3 7753 B7R1.1 CCC1CCNC1 Amb20630619 [1,0,0,1,0,0|1,0,0]=3 7754 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|0,0,0]=2 7755 B7R1.1 CCC1NCCO1 Amb17506183 [1,0,0,1,0,0|1,0,0]=3 7756 B7R1.1 CCC1OCCO1 Amb19892413 [1,0,0,1,0,0|0,0,0]=2 7757 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|1,0,0]=3 7758 B7R1.1 CCN1CCCN1 Amb27776139 [1,0,0,1,0,0|2,0,0]=4 7759 B7R1.1 CCN1CCOC1 Amb26603215 [1,0,0,1,0,0|1,0,0]=3 7760 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,0]=3 7761 B7R1.1 CC[C@@H]1CCNC1 Amb33801216 [1,0,0,1,0,0|1,0,0]=3 7762 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,0]=3 7763 B7R1.1 CC[C@H]1CCNC1 Amb27458282 [1,0,0,1,0,0|1,0,0]=3 7764 B7R1.1 CC[C@H]1CCNC1 Amb30594227 [1,0,0,1,0,0|1,0,0]=3 7765 B7R1.1 CNC1CCCC1 Amb1223228 [1,0,0,1,0,0|2,0,0]=4 7766 B7R1.1 CNC1CCCC1 Amb9677383 [1,0,0,1,0,0|2,0,0]=4 7767 B7R1.1 CNC1CCCO1 Amb27254048 [1,0,0,1,0,0|1,0,0]=3 7768 B7R1.1 CNC1CCNC1 Amb22491402 [1,0,0,1,0,0|2,0,0]=4 7769 B7R1.1 CNC1CCNC1 Amb8396671 [1,0,0,1,0,0|2,0,0]=4 7770 B7R1.1 CNC1CCNC1 Amb8397135 [1,0,0,1,0,0|2,0,0]=4 7771 B7R1.1 CNC1CCOC1 Amb20241377 [1,0,0,1,0,0|1,0,0]=3 7772 B7R1.1 CNC1CCOC1 Amb8009837 [1,0,0,1,0,0|1,0,0]=3 7773 B7R1.1 CNC1CCSC1 Amb22741543 [1,0,0,1,0,0|1,1,0]=4 7774 B7R1.1 CNC1CCSC1 Amb31291647 [1,0,0,1,0,0|1,1,0]=4 7775 B7R1.1 CNC1CCSC1 Amb9711007 [1,0,0,1,0,0|1,1,0]=4 7776 B7R1.1 CN[C@@H]1CCNC1 Amb8396672 [1,0,0,1,0,0|2,0,0]=4 7777 B7R1.1 CN[C@@H]1CCNC1 Amb8397134 [1,0,0,1,0,0|2,0,0]=4 7778 B7R1.1 CN[C@@H]1CCOC1 Amb20241026 [1,0,0,1,0,0|1,0,0]=3 7779 B7R1.1 CN[C@@H]1CCOC1 Amb33330851 [1,0,0,1,0,0|1,0,0]=3 7780 B7R1.1 CN[C@H]1CCNC1 Amb8396673 [1,0,0,1,0,0|2,0,0]=4 7781 B7R1.1 CN[C@H]1CCNC1 Amb8397133 [1,0,0,1,0,0|2,0,0]=4 7782 B7R1.1 CN[C@H]1CCOC1 Amb20240861 [1,0,0,1,0,0|1,0,0]=3 7783 B7R1.1 CN[C@H]1CCOC1 Amb20241500 [1,0,0,1,0,0|1,0,0]=3 7784 B7R1.1 COC1CCCC1 Amb8517656 [1,0,0,1,0,0|2,0,0]=4 7785 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|1,0,0]=3 7786 B7R1.1 COC1CCNC1 Amb10603699 [1,0,0,1,0,0|2,0,0]=4 7787 B7R1.1 COC1CCNC1 Amb8011289 [1,0,0,1,0,0|2,0,0]=4 7788 B7R1.1 COP1OCCO1 Amb26476014 [1,0,0,1,0,0|2,0,0]=4 7789 B7R1.1 CO[C@@H]1CCCN1 Amb27948785 [1,0,0,1,0,0|2,0,0]=4 7790 B7R1.1 CO[C@@H]1CCNC1 Amb10603225 [1,0,0,1,0,0|2,0,0]=4 7791 B7R1.1 CO[C@@H]1CCNC1 Amb10603226 [1,0,0,1,0,0|2,0,0]=4 7792 B7R1.1 CO[C@H]1CCNC1 Amb10603275 [1,0,0,1,0,0|2,0,0]=4 7793 B7R1.1 CO[C@H]1CCNC1 Amb20241379 [1,0,0,1,0,0|2,0,0]=4 7794 B7R1.1 CSC1CCCC1 Amb22230463 [1,0,0,1,0,0|2,0,0]=4 7795 B7R1.1 CSC1CCNC1 Amb18279428 [1,0,0,1,0,0|2,0,0]=4 7796 B7R1.1 CSC1CCNC1 Amb32662537 [1,0,0,1,0,0|2,0,0]=4 7797 B7R1.1 ClCC1CCCC1 Amb9004338 [1,0,0,1,0,0|1,0,0]=3 7798 B7R1.1 ClCC1CCCN1 Amb1102532 [1,0,0,1,0,0|2,0,0]=4 7799 B7R1.1 ClCC1CCCN1 Amb22228750 [1,0,0,1,0,0|2,0,0]=4 7800 B7R1.1 ClCC1CCCO1 Amb5716848 [1,0,0,1,0,0|1,0,0]=3 7801 B7R1.1 ClCC1CCCS1 Amb25339278 [1,0,0,1,0,0|1,1,0]=4 7802 B7R1.1 ClCC1CCOC1 Amb9754529 [1,0,0,1,0,0|1,0,0]=3 7803 B7R1.1 ClCC1CCSC1 Amb28423424 [1,0,0,1,0,0|1,1,0]=4 7804 B7R1.1 ClCC1COCO1 Amb25147241 [1,0,0,1,0,0|1,0,0]=3 7805 B7R1.1 ClCC1OCCO1 Amb2792894 [1,0,0,1,0,0|1,0,0]=3 7806 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [1,0,0,1,0,0|2,0,0]=4 7807 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [1,0,0,1,0,0|2,0,0]=4 7808 B7R1.1 ClC[C@@H]1CCNC1 Amb26551071 [1,0,0,1,0,0|2,0,0]=4 7809 B7R1.1 ClC[C@H]1CCCN1 Amb26577168 [1,0,0,1,0,0|2,0,0]=4 7810 B7R1.1 ClC[C@H]1CCNC1 Amb25064501 [1,0,0,1,0,0|2,0,0]=4 7811 B7R1.1 FCC1CCCN1 Amb13953136 [1,0,0,1,0,0|2,0,0]=4 7812 B7R1.1 FCC1CCCN1 Amb28827628 [1,0,0,1,0,0|2,0,0]=4 7813 B7R1.1 FCC1CCNC1 Amb24423478 [1,0,0,1,0,0|2,0,0]=4 7814 B7R1.1 FCC1CCNC1 Amb32676678 [1,0,0,1,0,0|2,0,0]=4 7815 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [1,0,0,1,0,0|2,0,0]=4 7816 B7R1.1 FC[C@@H]1CCCN1 Amb27973462 [1,0,0,1,0,0|2,0,0]=4 7817 B7R1.1 FC[C@@H]1CCNC1 Amb27246397 [1,0,0,1,0,0|2,0,0]=4 7818 B7R1.1 FC[C@@H]1CCNC1 Amb33874890 [1,0,0,1,0,0|2,0,0]=4 7819 B7R1.1 FC[C@H]1CCCN1 Amb27602129 [1,0,0,1,0,0|2,0,0]=4 7820 B7R1.1 FC[C@H]1CCCN1 Amb32409431 [1,0,0,1,0,0|2,0,0]=4 7821 B7R1.1 FC[C@H]1CCNC1 Amb24184002 [1,0,0,1,0,0|2,0,0]=4 7822 B7R1.1 FC[C@H]1CCNC1 Amb28435036 [1,0,0,1,0,0|2,0,0]=4 7823 B7R1.1 ICC1CCCC1 Amb8517132 [1,0,0,1,0,0|1,0,0]=3 7824 B7R1.1 ICC1CCCO1 Amb24060886 [1,0,0,1,0,0|1,0,0]=3 7825 B7R1.1 ICC1CCOC1 Amb23439064 [1,0,0,1,0,0|1,0,0]=3 7826 B7R1.1 N#CC1CCCC1 Amb2721544 [1,0,0,1,0,0|1,0,1]=4 7827 B7R1.1 N#CC1CCCO1 Amb17506326 [1,0,0,1,0,0|1,0,1]=4 7828 B7R1.1 N#CC1CCOC1 Amb33529813 [1,0,0,1,0,0|1,0,1]=4 7829 B7R1.1 N#C[C@@H]1CCCO1 Amb4166302 [1,0,0,1,0,0|1,0,1]=4 7830 B7R1.1 N#C[C@@H]1CCOC1 Amb28137320 [1,0,0,1,0,0|1,0,1]=4 7831 B7R1.1 N#C[C@H]1CCCO1 Amb4166296 [1,0,0,1,0,0|1,0,1]=4 7832 B7R1.1 N#C[C@H]1CCOC1 Amb23439943 [1,0,0,1,0,0|1,0,1]=4 7833 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|1,0,0]=3 7834 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|1,0,0]=3 7835 B7R1.1 NCC1CCCC1 Amb6892868 [1,0,0,1,0,0|1,0,0]=3 7836 B7R1.1 NCC1CCCN1 Amb19516137 [1,0,0,1,0,0|2,0,0]=4 7837 B7R1.1 NCC1CCCN1 Amb4418336 [1,0,0,1,0,0|2,0,0]=4 7838 B7R1.1 NCC1CCCO1 Amb2568046 [1,0,0,1,0,0|1,0,0]=3 7839 B7R1.1 NCC1CCCO1 Amb3903680 [1,0,0,1,0,0|1,0,0]=3 7840 B7R1.1 NCC1CCCS1 Amb20668756 [1,0,0,1,0,0|1,1,0]=4 7841 B7R1.1 NCC1CCOC1 Amb33536658 [1,0,0,1,0,0|1,0,0]=3 7842 B7R1.1 NCC1CCOC1 Amb7969615 [1,0,0,1,0,0|1,0,0]=3 7843 B7R1.1 NCC1CCSC1 Amb18198289 [1,0,0,1,0,0|1,1,0]=4 7844 B7R1.1 NCC1COCO1 Amb25261501 [1,0,0,1,0,0|1,0,0]=3 7845 B7R1.1 NCC1COCO1 Amb28827653 [1,0,0,1,0,0|1,0,0]=3 7846 B7R1.1 NCC1CSCO1 Amb27234625 [1,0,0,1,0,0|1,1,0]=4 7847 B7R1.1 NCC1OCCO1 Amb3940009 [1,0,0,1,0,0|1,0,0]=3 7848 B7R1.1 NCC1OCCS1 Amb23447046 [1,0,0,1,0,0|1,1,0]=4 7849 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [1,0,0,1,0,0|2,0,0]=4 7850 B7R1.1 NC[C@@H]1CCCO1 Amb32661832 [1,0,0,1,0,0|1,0,0]=3 7851 B7R1.1 NC[C@@H]1CCCO1 Amb3940181 [1,0,0,1,0,0|1,0,0]=3 7852 B7R1.1 NC[C@@H]1CCOC1 Amb26870648 [1,0,0,1,0,0|1,0,0]=3 7853 B7R1.1 NC[C@@H]1CCOC1 Amb31204704 [1,0,0,1,0,0|1,0,0]=3 7854 B7R1.1 NC[C@H]1CCCN1 Amb2699509 [1,0,0,1,0,0|2,0,0]=4 7855 B7R1.1 NC[C@H]1CCCN1 Amb30584681 [1,0,0,1,0,0|2,0,0]=4 7856 B7R1.1 NC[C@H]1CCCO1 Amb33859030 [1,0,0,1,0,0|1,0,0]=3 7857 B7R1.1 NC[C@H]1CCCO1 Amb3940188 [1,0,0,1,0,0|1,0,0]=3 7858 B7R1.1 NC[C@H]1CCNC1 Amb25079280 [1,0,0,1,0,0|2,0,0]=4 7859 B7R1.1 NC[C@H]1CCOC1 Amb23439065 [1,0,0,1,0,0|1,0,0]=3 7860 B7R1.1 NC[C@H]1CCOC1 Amb23439174 [1,0,0,1,0,0|1,0,0]=3 7861 B7R1.1 NC[C@H]1CNCO1 Amb27950283 [1,0,0,1,0,0|2,0,0]=4 7862 B7R1.1 NNC1CCCC1 Amb10071294 [1,0,0,1,0,0|2,0,0]=4 7863 B7R1.1 NNC1CCCC1 Amb2785873 [1,0,0,1,0,0|2,0,0]=4 7864 B7R1.1 NNC1CCCC1 Amb8371028 [1,0,0,1,0,0|2,0,0]=4 7865 B7R1.1 NNC1CCOC1 Amb20668064 [1,0,0,1,0,0|2,0,0]=4 7866 B7R1.1 NNC1CCOC1 Amb22059240 [1,0,0,1,0,0|2,0,0]=4 7867 B7R1.1 NNC1CCOC1 Amb22491679 [1,0,0,1,0,0|2,0,0]=4 7868 B7R1.1 NN[C@@H]1CCOC1 Amb31291316 [1,0,0,1,0,0|2,0,0]=4 7869 B7R1.1 NOC1CCCC1 Amb17101093 [1,0,0,1,0,0|2,0,0]=4 7870 B7R1.1 NOC1CCOC1 Amb22295766 [1,0,0,1,0,0|2,0,0]=4 7871 B7R1.1 O=CC1CCCC1 Amb31292855 [1,0,0,1,0,0|0,0,2]=4 7872 B7R1.1 O=CC1CCCC1 Amb4605847 [1,0,0,1,0,0|0,0,2]=4 7873 B7R1.1 O=CC1CCCC1 Amb6297186 [1,0,0,1,0,0|0,0,2]=4 7874 B7R1.1 O=CC1CCCO1 Amb3939388 [1,0,0,1,0,0|0,0,2]=4 7875 B7R1.1 O=CC1CCOC1 Amb6608994 [1,0,0,1,0,0|1,0,1]=4 7876 B7R1.1 O=CC1OCCO1 Amb27592967 [1,0,0,1,0,0|1,0,1]=4 7877 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [1,0,0,1,0,0|1,0,1]=4 7878 B7R1.1 OCC1=CCCC1 Amb24479891 [1,0,0,1,0,0|0,0,2]=4 7879 B7R1.1 OCC1C=CCC1 Amb23455253 [1,0,0,1,0,0|0,0,2]=4 7880 B7R1.1 OCC1CC=CC1 Amb2695403 [1,0,0,1,0,0|0,0,2]=4 7881 B7R1.1 OCC1CCCC1 Amb2721271 [1,0,0,1,0,0|0,0,0]=2 7882 B7R1.1 OCC1CCCN1 Amb2237182 [1,0,0,1,0,0|1,0,0]=3 7883 B7R1.1 OCC1CCCO1 Amb3939084 [1,0,0,1,0,0|0,0,0]=2 7884 B7R1.1 OCC1CCCS1 Amb33545363 [1,0,0,1,0,0|0,1,0]=3 7885 B7R1.1 OCC1CCNC1 Amb20240954 [1,0,0,1,0,0|1,0,0]=3 7886 B7R1.1 OCC1CCNC1 Amb21858960 [1,0,0,1,0,0|1,0,0]=3 7887 B7R1.1 OCC1CCNC1 Amb9782649 [1,0,0,1,0,0|1,0,0]=3 7888 B7R1.1 OCC1CCOC1 Amb9748290 [1,0,0,1,0,0|1,0,0]=3 7889 B7R1.1 OCC1CCON1 Amb25888553 [1,0,0,1,0,0|2,0,0]=4 7890 B7R1.1 OCC1CCON1 Amb33483283 [1,0,0,1,0,0|2,0,0]=4 7891 B7R1.1 OCC1CCSC1 Amb18203349 [1,0,0,1,0,0|1,0,0]=3 7892 B7R1.1 OCC1CNOC1 Amb27867600 [1,0,0,1,0,0|2,0,0]=4 7893 B7R1.1 OCC1COCO1 Amb8393650 [1,0,0,1,0,0|1,0,0]=3 7894 B7R1.1 OCC1NCCS1 Amb25821150 [1,0,0,1,0,0|1,1,0]=4 7895 B7R1.1 OCC1OCCO1 Amb9786986 [1,0,0,1,0,0|1,0,0]=3 7896 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [1,0,0,1,0,0|1,0,0]=3 7897 B7R1.1 OC[C@@H]1CCCN1 Amb3938965 [1,0,0,1,0,0|1,0,0]=3 7898 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [1,0,0,1,0,0|0,0,0]=2 7899 B7R1.1 OC[C@@H]1CCNC1 Amb34916128 [1,0,0,1,0,0|1,0,0]=3 7900 B7R1.1 OC[C@@H]1CCNC1 Amb6893877 [1,0,0,1,0,0|1,0,0]=3 7901 B7R1.1 OC[C@@H]1CCNC1 Amb8630261 [1,0,0,1,0,0|1,0,0]=3 7902 B7R1.1 OC[C@@H]1CCOC1 Amb28189753 [1,0,0,1,0,0|1,0,0]=3 7903 B7R1.1 OC[C@@H]1OCCS1 Amb22748777 [1,0,0,1,0,0|1,0,0]=3 7904 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [1,0,0,1,0,0|1,0,0]=3 7905 B7R1.1 OC[C@H]1CCCN1 Amb30874072 [1,0,0,1,0,0|1,0,0]=3 7906 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [1,0,0,1,0,0|0,0,0]=2 7907 B7R1.1 OC[C@H]1CCNC1 Amb10067155 [1,0,0,1,0,0|1,0,0]=3 7908 B7R1.1 OC[C@H]1CCNC1 Amb6893876 [1,0,0,1,0,0|1,0,0]=3 7909 B7R1.1 OC[C@H]1CCOC1 Amb22746669 [1,0,0,1,0,0|1,0,0]=3 7910 B7R1.1 ON=C1CCCC1 Amb6538721 [1,0,0,1,0,0|1,0,1]=4 7911 B7R1.1 ONC1CCCC1 Amb27467457 [1,0,0,1,0,0|1,0,0]=3 7912 B7R1.1 ONC1CCCC1 Amb30625652 [1,0,0,1,0,0|1,0,0]=3 7913 B7R1.1 ONC1CCOC1 Amb25888397 [1,0,0,1,0,0|2,0,0]=4 7914 B7R1.1 ONC1CCOC1 Amb32653528 [1,0,0,1,0,0|2,0,0]=4 7915 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|0,1,0]=3 7916 B7R1.1 SCC1CCCN1 Amb25874415 [1,0,0,1,0,0|1,1,0]=4 7917 B7R1.1 SCC1CCCN1 Amb35752888 [1,0,0,1,0,0|1,1,0]=4 7918 B7R1.1 SCC1CCCO1 Amb33531279 [1,0,0,1,0,0|0,1,0]=3 7919 B7R1.1 SCC1CCCS1 Amb33416783 [1,0,0,1,0,0|0,2,0]=4 7920 B7R1.1 SCC1CCOC1 Amb26919281 [1,0,0,1,0,0|1,0,0]=3 7921 B7R1.1 SCC1CCSC1 Amb32788496 [1,0,0,1,0,0|1,1,0]=4 7922 B7R1.1 SCC1COCO1 Amb32650877 [1,0,0,1,0,0|1,0,0]=3 7923 B7R1.1 SCC1OCCO1 Amb32650838 [1,0,0,1,0,0|1,0,0]=3 7924 B7R1.1 SC[C@H]1CCCN1 Amb29854514 [1,0,0,1,0,0|1,1,0]=4 7925 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [1,0,0,1,0,0|2,0,0]=4 7926 B7R1.1 [C-]#[N+]C1CCCO1 Amb27635418 [1,0,0,1,0,0|1,0,1]=4 7927 B7R1.1 [C-]#[N+]C1CCOC1 Amb33420733 [1,0,0,1,0,0|1,0,1]=4 7928 B7R1.3 BrC1CCCCC1 Amb3940351 [1,0,0,1,0,0|1,0,0]=3 7929 B7R1.3 BrC1CCCCN1 Amb8629038 [1,0,0,1,0,0|2,0,0]=4 7930 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,1,0,0|1,0,0]=3 7931 B7R1.3 BrC1CCCNC1 Amb22497824 [1,0,0,1,0,0|2,0,0]=4 7932 B7R1.3 BrC1CCCNC1 Amb8629039 [1,0,0,1,0,0|2,0,0]=4 7933 B7R1.3 BrC1CCCOC1 Amb9173669 [1,0,0,1,0,0|1,0,0]=3 7934 B7R1.3 BrC1CCCSC1 Amb26545490 [1,0,0,1,0,0|1,1,0]=4 7935 B7R1.3 BrC1CCNCC1 Amb22229718 [1,0,0,1,0,0|2,0,0]=4 7936 B7R1.3 BrC1CCNCC1 Amb2778981 [1,0,0,1,0,0|2,0,0]=4 7937 B7R1.3 BrC1CCNCC1 Amb3941704 [1,0,0,1,0,0|2,0,0]=4 7938 B7R1.3 BrC1CCOCC1 Amb9472764 [1,0,0,1,0,0|1,0,0]=3 7939 B7R1.3 BrC1CCSCC1 Amb18181050 [1,0,0,1,0,0|1,1,0]=4 7940 B7R1.3 BrC1COCCO1 Amb24322807 [1,0,0,1,0,0|1,0,0]=3 7941 B7R1.3 C=C1CCCCC1 Amb8515603 [1,0,0,1,0,0|1,0,1]=4 7942 B7R1.3 C=C1CCCCO1 Amb28345156 [1,0,0,1,0,0|0,0,2]=4 7943 B7R1.3 C=C1CCCOC1 Amb27594580 [1,0,0,1,0,0|1,0,1]=4 7944 B7R1.3 C=C1CCOCC1 Amb22000865 [1,0,0,1,0,0|0,0,2]=4 7945 B7R1.3 CC1=CCCCC1 Amb8513524 [1,0,0,1,0,0|1,0,1]=4 7946 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|0,0,2]=4 7947 B7R1.3 CC1=CCOCC1 Amb24070517 [1,0,0,1,0,0|0,0,2]=4 7948 B7R1.3 CC1=NCCCC1 Amb27459940 [1,0,0,1,0,0|1,0,1]=4 7949 B7R1.3 CC1C=CCCC1 Amb8515346 [1,0,0,1,0,0|1,0,1]=4 7950 B7R1.3 CC1C=CCCO1 Amb33715160 [1,0,0,1,0,0|0,0,2]=4 7951 B7R1.3 CC1C=COCC1 Amb27985265 [1,0,0,1,0,0|0,0,2]=4 7952 B7R1.3 CC1CC=NCC1 Amb27453017 [1,0,0,1,0,0|1,0,1]=4 7953 B7R1.3 CC1CCCCN1 Amb2792828 [1,0,0,1,0,0|1,0,0]=3 7954 B7R1.3 CC1CCCCO1 Amb4035049 [1,0,0,1,0,0|0,0,0]=2 7955 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|0,1,0]=3 7956 B7R1.3 CC1CCCNC1 Amb22491688 [1,0,0,1,0,0|2,0,0]=4 7957 B7R1.3 CC1CCCNC1 Amb9703089 [1,0,0,1,0,0|2,0,0]=4 7958 B7R1.3 CC1CCCOC1 Amb22347806 [1,0,0,1,0,0|1,0,0]=3 7959 B7R1.3 CC1CCNCC1 Amb2689655 [1,0,0,1,0,0|1,0,0]=3 7960 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|0,0,0]=2 7961 B7R1.3 CC1CCOCN1 Amb32651825 [1,0,0,1,0,0|1,0,0]=3 7962 B7R1.3 CC1CCOCO1 Amb17776591 [1,0,0,1,0,0|0,0,0]=2 7963 B7R1.3 CC1CCSCC1 Amb27436849 [1,0,0,1,0,0|0,1,0]=3 7964 B7R1.3 CC1CNCCN1 Amb32666272 [1,0,0,1,0,0|2,0,0]=4 7965 B7R1.3 CC1CNCCN1 Amb9702774 [1,0,0,1,0,0|2,0,0]=4 7966 B7R1.3 CC1CNCCO1 Amb20621613 [1,0,0,1,0,0|1,0,0]=3 7967 B7R1.3 CC1CNCCO1 Amb32666325 [1,0,0,1,0,0|1,0,0]=3 7968 B7R1.3 CC1CNCCO1 Amb9703073 [1,0,0,1,0,0|1,0,0]=3 7969 B7R1.3 CC1CNCCS1 Amb32753223 [1,0,0,1,0,0|1,1,0]=4 7970 B7R1.3 CC1CNCCS1 Amb6683465 [1,0,0,1,0,0|1,1,0]=4 7971 B7R1.3 CC1COCCN1 Amb22728071 [1,0,0,1,0,0|1,0,0]=3 7972 B7R1.3 CC1COCCN1 Amb6740293 [1,0,0,1,0,0|1,0,0]=3 7973 B7R1.3 CC1CSCCN1 Amb9735876 [1,0,0,1,0,0|1,1,0]=4 7974 B7R1.3 CC1NCCCN1 Amb24381838 [1,0,0,1,0,0|2,0,0]=4 7975 B7R1.3 CC1NCCCO1 Amb17506191 [1,0,0,1,0,0|1,0,0]=3 7976 B7R1.3 CC1OCCCO1 Amb26557606 [1,0,0,1,0,0|1,0,0]=3 7977 B7R1.3 CC1SCCCS1 Amb10071965 [1,0,0,1,0,0|1,1,0]=4 7978 B7R1.3 CN1CCCCC1 Amb8387007 [1,0,0,1,0,0|2,0,0]=4 7979 B7R1.3 CN1CCNCC1 Amb2689644 [1,0,0,1,0,0|2,0,0]=4 7980 B7R1.3 CN1CCNCC1 Amb2720207 [1,0,0,1,0,0|2,0,0]=4 7981 B7R1.3 CN1CCOCC1 Amb5718750 [1,0,0,1,0,0|1,0,0]=3 7982 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|1,0,0]=3 7983 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [1,0,0,1,0,0|1,0,0]=3 7984 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [1,0,0,1,0,0|2,0,0]=4 7985 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [1,0,0,1,0,0|2,0,0]=4 7986 B7R1.3 C[C@@H]1CNCCN1 Amb23399598 [1,0,0,1,0,0|2,0,0]=4 7987 B7R1.3 C[C@@H]1CNCCN1 Amb33716484 [1,0,0,1,0,0|2,0,0]=4 7988 B7R1.3 C[C@@H]1CNCCN1 Amb8396882 [1,0,0,1,0,0|2,0,0]=4 7989 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [1,0,0,1,0,0|1,0,0]=3 7990 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [1,0,0,1,0,0|1,0,0]=3 7991 B7R1.3 C[C@@H]1CNCCS1 Amb28423156 [1,0,0,1,0,0|1,1,0]=4 7992 B7R1.3 C[C@@H]1CNCCS1 Amb32671471 [1,0,0,1,0,0|1,1,0]=4 7993 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [1,0,0,1,0,0|1,0,0]=3 7994 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [1,0,0,1,0,0|1,0,0]=3 7995 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [1,0,0,1,0,0|1,1,0]=4 7996 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [1,0,0,1,0,0|1,0,0]=3 7997 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [1,0,0,1,0,0|2,0,0]=4 7998 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [1,0,0,1,0,0|2,0,0]=4 7999 B7R1.3 C[C@H]1CNCCN1 Amb6306665 [1,0,0,1,0,0|2,0,0]=4 8000 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [1,0,0,1,0,0|1,0,0]=3 8001 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [1,0,0,1,0,0|1,0,0]=3 8002 B7R1.3 C[C@H]1CNCCO1 Amb32661569 [1,0,0,1,0,0|1,0,0]=3 8003 B7R1.3 C[C@H]1CNCCO1 Amb34916143 [1,0,0,1,0,0|1,0,0]=3 8004 B7R1.3 C[C@H]1COCCN1 Amb10066947 [1,0,0,1,0,0|1,0,0]=3 8005 B7R1.3 C[C@H]1COCCN1 Amb19516190 [1,0,0,1,0,0|1,0,0]=3 8006 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [1,0,0,1,0,0|1,1,0]=4 8007 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [1,0,0,1,0,0|0,1,0]=3 8008 B7R1.3 ClC1CCCCC1 Amb3940352 [1,0,0,1,0,0|1,0,0]=3 8009 B7R1.3 ClC1CCCCN1 Amb20242688 [1,0,0,1,0,0|2,0,0]=4 8010 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,1,0,0|1,0,0]=3 8011 B7R1.3 ClC1CCCCS1 Amb28123985 [1,0,0,1,0,0|1,1,0]=4 8012 B7R1.3 ClC1CCCOC1 Amb20622589 [1,0,0,1,0,0|1,0,0]=3 8013 B7R1.3 ClC1CCNCC1 Amb8009567 [1,0,0,1,0,0|2,0,0]=4 8014 B7R1.3 ClC1CCNCC1 Amb8629021 [1,0,0,1,0,0|2,0,0]=4 8015 B7R1.3 ClC1CCOCC1 Amb6760778 [1,0,0,1,0,0|1,0,0]=3 8016 B7R1.3 ClN1CCCCC1 Amb25950915 [1,0,0,1,0,0|2,0,0]=4 8017 B7R1.3 ClN1CCOCC1 Amb20670597 [1,0,0,1,0,0|2,0,0]=4 8018 B7R1.3 FC1CCCCC1 Amb2688084 [1,0,0,1,0,0|1,0,0]=3 8019 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,1,0,0|1,0,0]=3 8020 B7R1.3 FC1CCCNC1 Amb13953137 [1,0,0,1,0,0|2,0,0]=4 8021 B7R1.3 FC1CCCNC1 Amb2688404 [1,0,0,1,0,0|2,0,0]=4 8022 B7R1.3 FC1CCCOC1 Amb24322825 [1,0,0,1,0,0|1,0,0]=3 8023 B7R1.3 FC1CCC[NH2+]C1 Amb22042691 [1,0,0,1,0,0|2,0,0]=4 8024 B7R1.3 FC1CCNCC1 Amb13885425 [1,0,0,1,0,0|2,0,0]=4 8025 B7R1.3 FC1CCNCC1 Amb2688405 [1,0,0,1,0,0|2,0,0]=4 8026 B7R1.3 FC1CCOCC1 Amb22296909 [1,0,0,1,0,0|1,0,0]=3 8027 B7R1.3 FC1CNCCO1 Amb27641873 [1,0,0,1,0,0|2,0,0]=4 8028 B7R1.3 FC1COCCO1 Amb24322827 [1,0,0,1,0,0|1,0,0]=3 8029 B7R1.3 F[C@@H]1CCCNC1 Amb20242276 [1,0,0,1,0,0|2,0,0]=4 8030 B7R1.3 F[C@@H]1CCCNC1 Amb27619341 [1,0,0,1,0,0|2,0,0]=4 8031 B7R1.3 F[C@H]1CCCNC1 Amb20242275 [1,0,0,1,0,0|2,0,0]=4 8032 B7R1.3 IC1CCCCC1 Amb6608670 [1,0,0,1,0,0|1,0,0]=3 8033 B7R1.3 IC1CCCNC1 Amb22496356 [1,0,0,1,0,0|2,0,0]=4 8034 B7R1.3 IC1CCCOC1 Amb22831295 [1,0,0,1,0,0|1,0,0]=3 8035 B7R1.3 IC1CCOCC1 Amb2723453 [1,0,0,1,0,0|1,0,0]=3 8036 B7R1.3 IC1CCSCC1 Amb2724105 [1,0,0,1,0,0|1,1,0]=4 8037 B7R1.3 IN1CCOCC1 Amb24106962 [1,0,0,1,0,0|2,0,0]=4 8038 B7R1.3 N=C1CCCCC1 Amb26924126 [1,0,0,1,0,0|1,0,1]=4 8039 B7R1.3 NC1CCCCC1 Amb2792843 [1,0,0,1,0,0|1,0,0]=3 8040 B7R1.3 NC1CCCCC1 Amb4035820 [1,0,0,1,0,0|1,0,0]=3 8041 B7R1.3 NC1CCCCC1 Amb6366094 [1,0,0,1,0,0|1,0,0]=3 8042 B7R1.3 NC1CCCCN1 Amb16233706 [1,0,0,1,0,0|2,0,0]=4 8043 B7R1.3 NC1CCCCS1 Amb28052869 [1,0,0,1,0,0|1,1,0]=4 8044 B7R1.3 NC1CCCNC1 Amb2694718 [1,0,0,1,0,0|2,0,0]=4 8045 B7R1.3 NC1CCCNC1 Amb2720311 [1,0,0,1,0,0|2,0,0]=4 8046 B7R1.3 NC1CCCNC1 Amb8385620 [1,0,0,1,0,0|2,0,0]=4 8047 B7R1.3 NC1CCCOC1 Amb1091859 [1,0,0,1,0,0|1,0,0]=3 8048 B7R1.3 NC1CCCOC1 Amb19889218 [1,0,0,1,0,0|1,0,0]=3 8049 B7R1.3 NC1CCCSC1 Amb13953228 [1,0,0,1,0,0|1,1,0]=4 8050 B7R1.3 NC1CCCSC1 Amb32660970 [1,0,0,1,0,0|1,1,0]=4 8051 B7R1.3 NC1CCNCC1 Amb17943826 [1,0,0,1,0,0|2,0,0]=4 8052 B7R1.3 NC1CCNCC1 Amb6270512 [1,0,0,1,0,0|2,0,0]=4 8053 B7R1.3 NC1CCOCC1 Amb1102242 [1,0,0,1,0,0|1,0,0]=3 8054 B7R1.3 NC1CCOCC1 Amb8503255 [1,0,0,1,0,0|1,0,0]=3 8055 B7R1.3 NC1CCSCC1 Amb13952147 [1,0,0,1,0,0|1,1,0]=4 8056 B7R1.3 NC1CCSCC1 Amb2724106 [1,0,0,1,0,0|1,1,0]=4 8057 B7R1.3 NC1COCOC1 Amb28384919 [1,0,0,1,0,0|2,0,0]=4 8058 B7R1.3 NC1COCOC1 Amb32667993 [1,0,0,1,0,0|2,0,0]=4 8059 B7R1.3 NN1CCCCC1 Amb535734 [1,0,0,1,0,0|2,0,0]=4 8060 B7R1.3 NN1CCCCC1 Amb6892706 [1,0,0,1,0,0|2,0,0]=4 8061 B7R1.3 NN1CCOCC1 Amb836802 [1,0,0,1,0,0|2,0,0]=4 8062 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [1,0,0,1,0,0|2,0,0]=4 8063 B7R1.3 N[C@@H]1CCCNC1 Amb2695443 [1,0,0,1,0,0|2,0,0]=4 8064 B7R1.3 N[C@@H]1CCCOC1 Amb19516292 [1,0,0,1,0,0|1,0,0]=3 8065 B7R1.3 N[C@@H]1CCCOC1 Amb20241267 [1,0,0,1,0,0|1,0,0]=3 8066 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [1,0,0,1,0,0|1,0,0]=3 8067 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [1,0,0,1,0,0|2,0,0]=4 8068 B7R1.3 N[C@H]1CCCNC1 Amb2695444 [1,0,0,1,0,0|2,0,0]=4 8069 B7R1.3 N[C@H]1CCCOC1 Amb19516313 [1,0,0,1,0,0|1,0,0]=3 8070 B7R1.3 N[C@H]1CCCOC1 Amb20241266 [1,0,0,1,0,0|1,0,0]=3 8071 B7R1.3 N[C@H]1CCCOC1 Amb34916114 [1,0,0,1,0,0|1,0,0]=3 8072 B7R1.3 O=C1CCCCC1 Amb2793026 [1,0,0,1,0,0|0,0,2]=4 8073 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|0,0,2]=4 8074 B7R1.3 O=C1CCCOC1 Amb19373430 [1,0,0,1,0,0|0,0,2]=4 8075 B7R1.3 O=C1CCOCC1 Amb2725565 [1,0,0,1,0,0|1,0,1]=4 8076 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,1]=4 8077 B7R1.3 O=S1CCOCC1 Amb26535052 [1,0,0,1,0,0|2,0,0]=4 8078 B7R1.3 OC1C=CCCC1 Amb4605824 [1,0,0,1,0,0|0,0,2]=4 8079 B7R1.3 OC1C=CCOC1 Amb25662556 [1,0,0,1,0,0|0,0,2]=4 8080 B7R1.3 OC1CCCCC1 Amb4605832 [1,0,0,1,0,0|0,0,0]=2 8081 B7R1.3 OC1CCCCN1 Amb8393085 [1,0,0,1,0,0|1,0,0]=3 8082 B7R1.3 OC1CCCCO1 Amb8517292 [1,0,0,1,0,0|0,0,0]=2 8083 B7R1.3 OC1CCCNC1 Amb3939221 [1,0,0,1,0,0|1,0,0]=3 8084 B7R1.3 OC1CCCNC1 Amb4036802 [1,0,0,1,0,0|1,0,0]=3 8085 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|0,0,0]=2 8086 B7R1.3 OC1CCCSC1 Amb4034626 [1,0,0,1,0,0|0,1,0]=3 8087 B7R1.3 OC1CCNCC1 Amb1152974 [1,0,0,1,0,0|1,0,0]=3 8088 B7R1.3 OC1CCNCC1 Amb2720309 [1,0,0,1,0,0|1,0,0]=3 8089 B7R1.3 OC1CCNCC1 Amb32679563 [1,0,0,1,0,0|1,0,0]=3 8090 B7R1.3 OC1CCNOC1 Amb32698233 [1,0,0,1,0,0|1,0,0]=3 8091 B7R1.3 OC1CCOCC1 Amb2723454 [1,0,0,1,0,0|1,0,0]=3 8092 B7R1.3 OC1CCONC1 Amb33017243 [1,0,0,1,0,0|2,0,0]=4 8093 B7R1.3 OC1CCSCC1 Amb2610612 [1,0,0,1,0,0|1,0,0]=3 8094 B7R1.3 OC1CNCCO1 Amb13883759 [1,0,0,1,0,0|1,0,0]=3 8095 B7R1.3 OC1CNCCO1 Amb22011707 [1,0,0,1,0,0|1,0,0]=3 8096 B7R1.3 OC1CNCNC1 Amb27854350 [1,0,0,1,0,0|2,0,0]=4 8097 B7R1.3 OC1COCOC1 Amb4020024 [1,0,0,1,0,0|1,0,0]=3 8098 B7R1.3 OC1COCOC1 Amb6357756 [1,0,0,1,0,0|1,0,0]=3 8099 B7R1.3 ON1CCCCC1 Amb6468702 [1,0,0,1,0,0|1,0,0]=3 8100 B7R1.3 ON1CCOCC1 Amb25243510 [1,0,0,1,0,0|2,0,0]=4 8101 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [1,0,0,1,0,0|1,0,0]=3 8102 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [1,0,0,1,0,0|1,0,0]=3 8103 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|0,0,0]=2 8104 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [1,0,0,1,0,0|0,0,2]=4 8105 B7R1.3 O[C@H]1C=CCOC1 Amb8393976 [1,0,0,1,0,0|0,0,2]=4 8106 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [1,0,0,1,0,0|1,0,0]=3 8107 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [1,0,0,1,0,0|1,0,0]=3 8108 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [1,0,0,1,0,0|0,0,0]=2 8109 B7R1.3 SC1CCCCC1 Amb6608750 [1,0,0,1,0,0|0,1,0]=3 8110 B7R1.3 SC1CCCCN1 Amb27639704 [1,0,0,1,0,0|1,1,0]=4 8111 B7R1.3 SC1CCCNC1 Amb22371077 [1,0,0,1,0,0|1,1,0]=4 8112 B7R1.3 SC1CCCNC1 Amb27453630 [1,0,0,1,0,0|1,1,0]=4 8113 B7R1.3 SC1CCCOC1 Amb24066221 [1,0,0,1,0,0|0,1,0]=3 8114 B7R1.3 SC1CCCSC1 Amb27480711 [1,0,0,1,0,0|0,2,0]=4 8115 B7R1.3 SC1CCNCC1 Amb17502200 [1,0,0,1,0,0|1,1,0]=4 8116 B7R1.3 SC1CCNCC1 Amb22371055 [1,0,0,1,0,0|1,1,0]=4 8117 B7R1.3 SC1CCOCC1 Amb9472951 [1,0,0,1,0,0|1,0,0]=3 8118 B7R1.3 SC1CCSCC1 Amb26045860 [1,0,0,1,0,0|1,1,0]=4 8119 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|1,0,0]=3 8120 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [1,0,0,1,0,0|1,0,0]=3 8121 B7R1.4 BrC1CCCC1Br Amb9787330 [1,0,0,1,0,0|2,0,0]=4 8122 B7R1.4 BrC1CCOC1Br Amb17673849 [1,0,0,1,0,0|2,0,0]=4 8123 B7R1.4 Br[C@@H]1CCC[C@H]1Br Amb26627934 [1,0,0,1,0,0|2,0,0]=4 8124 B7R1.4 C=C1COCC1O Amb24423437 [1,0,0,1,0,0|0,0,2]=4 8125 B7R1.4 CC1=CCCC1C Amb24479857 [1,0,0,1,0,0|1,0,1]=4 8126 B7R1.4 CC1=CCCC1O Amb25220686 [1,0,0,1,0,0|0,0,2]=4 8127 B7R1.4 CC1C=CCC1C Amb27454828 [1,0,0,1,0,0|1,0,1]=4 8128 B7R1.4 CC1C=CCC1O Amb28324626 [1,0,0,1,0,0|0,0,2]=4 8129 B7R1.4 CC1CCCC1=O Amb8514830 [1,0,0,1,0,0|0,0,2]=4 8130 B7R1.4 CC1CCCC1=S Amb27483022 [1,0,0,1,0,0|0,1,1]=4 8131 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|1,0,0]=3 8132 B7R1.4 CC1CCCC1C Amb4019559 [1,0,0,1,0,0|1,0,0]=3 8133 B7R1.4 CC1CCCC1Cl Amb27853965 [1,0,0,1,0,0|1,0,0]=3 8134 B7R1.4 CC1CCCC1N Amb33548666 [1,0,0,1,0,0|1,0,0]=3 8135 B7R1.4 CC1CCCC1N Amb9776219 [1,0,0,1,0,0|1,0,0]=3 8136 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|0,0,0]=2 8137 B7R1.4 CC1CCCC1S Amb26021537 [1,0,0,1,0,0|0,1,0]=3 8138 B7R1.4 CC1CCCN1N Amb25068361 [1,0,0,1,0,0|2,0,0]=4 8139 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,0]=3 8140 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,0]=3 8141 B7R1.4 CC1CCOC1=O Amb16185414 [1,0,0,1,0,0|0,0,2]=4 8142 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|2,0,0]=4 8143 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|2,0,0]=4 8144 B7R1.4 CC1CNCC1F Amb27595797 [1,0,0,1,0,0|2,0,0]=4 8145 B7R1.4 CC1CNCC1N Amb24070522 [1,0,0,1,0,0|2,0,0]=4 8146 B7R1.4 CC1CNCC1N Amb32682475 [1,0,0,1,0,0|2,0,0]=4 8147 B7R1.4 CC1CNCC1O Amb22886911 [1,0,0,1,0,0|1,0,0]=3 8148 B7R1.4 CC1CNCC1O Amb25792196 [1,0,0,1,0,0|1,0,0]=3 8149 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|0,0,2]=4 8150 B7R1.4 CC1COCC1Br Amb35736874 [1,0,0,1,0,0|1,0,0]=3 8151 B7R1.4 CC1COCC1Cl Amb35631934 [1,0,0,1,0,0|1,0,0]=3 8152 B7R1.4 CC1COCC1N Amb26929448 [1,0,0,1,0,0|1,0,0]=3 8153 B7R1.4 CC1COCC1O Amb26864629 [1,0,0,1,0,0|0,0,0]=2 8154 B7R1.4 CC1COCC1S Amb32788669 [1,0,0,1,0,0|0,1,0]=3 8155 B7R1.4 CC1CSCC1Br Amb27252722 [1,0,0,1,0,0|1,1,0]=4 8156 B7R1.4 CC1CSCC1N Amb18202602 [1,0,0,1,0,0|1,1,0]=4 8157 B7R1.4 CC1CSCC1S Amb24386420 [1,0,0,1,0,0|0,2,0]=4 8158 B7R1.4 CC1NCCC1O Amb27838277 [1,0,0,1,0,0|1,0,0]=3 8159 B7R1.4 CC1NCCC1O Amb32882554 [1,0,0,1,0,0|1,0,0]=3 8160 B7R1.4 CC1NCCN1C Amb27805583 [1,0,0,1,0,0|2,0,0]=4 8161 B7R1.4 CC1OCCC1=O Amb2725497 [1,0,0,1,0,0|1,0,1]=4 8162 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,1,0,0|1,0,0]=3 8163 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,1,0,0|1,0,0]=3 8164 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|1,0,0]=3 8165 B7R1.4 CC1OCCC1N Amb32660981 [1,0,0,1,0,0|1,0,0]=3 8166 B7R1.4 CC1OCCC1O Amb25888399 [1,0,0,1,0,0|1,0,0]=3 8167 B7R1.4 CC1OCCC1S Amb8515792 [1,0,0,1,0,0|1,0,0]=3 8168 B7R1.4 CC1OCOC1C Amb26430935 [1,0,0,1,0,0|1,0,0]=3 8169 B7R1.4 CC1SCCC1Cl Amb28144167 [1,0,0,1,0,0|1,1,0]=4 8170 B7R1.4 CC1SCCC1N Amb20623835 [1,0,0,1,0,0|1,1,0]=4 8171 B7R1.4 CC1SCCC1N Amb28827634 [1,0,0,1,0,0|1,1,0]=4 8172 B7R1.4 CC1SCCC1O Amb20623836 [1,0,0,1,0,0|1,0,0]=3 8173 B7R1.4 CC1SCCC1S Amb26335064 [1,0,0,1,0,0|1,1,0]=4 8174 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [1,0,0,1,0,0|1,0,0]=3 8175 B7R1.4 CC1SCC[C@H]1O Amb20623837 [1,0,0,1,0,0|1,0,0]=3 8176 B7R1.4 CN1=NCCC1O Amb21952741 [1,0,0,1,0,0|2,0,0]=4 8177 B7R1.4 CN1CCCC1N Amb27631265 [1,0,0,1,0,0|2,0,0]=4 8178 B7R1.4 C[C@@H]1C=CC[C@H]1C Amb25957944 [1,0,0,1,0,0|1,0,1]=4 8179 B7R1.4 C[C@@H]1C=CC[C@H]1O Amb27486253 [1,0,0,1,0,0|0,0,2]=4 8180 B7R1.4 C[C@@H]1CCCN1N Amb26843100 [1,0,0,1,0,0|2,0,0]=4 8181 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|1,0,0]=3 8182 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|1,0,0]=3 8183 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|0,0,0]=2 8184 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|1,0,0]=3 8185 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [1,0,0,1,0,0|1,0,0]=3 8186 B7R1.4 C[C@@H]1CCC[C@H]1O Amb8513780 [1,0,0,1,0,0|0,0,0]=2 8187 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,0]=3 8188 B7R1.4 C[C@@H]1CCOC1O Amb28074771 [1,0,0,1,0,0|0,0,0]=2 8189 B7R1.4 C[C@@H]1CCO[C@H]1O Amb27857930 [1,0,0,1,0,0|0,0,0]=2 8190 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|2,0,0]=4 8191 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb22886189 [1,0,0,1,0,0|2,0,0]=4 8192 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb25947246 [1,0,0,1,0,0|2,0,0]=4 8193 B7R1.4 C[C@@H]1CNC[C@@H]1N Amb25988639 [1,0,0,1,0,0|2,0,0]=4 8194 B7R1.4 C[C@@H]1CNC[C@@H]1O Amb22886215 [1,0,0,1,0,0|1,0,0]=3 8195 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|2,0,0]=4 8196 B7R1.4 C[C@@H]1CNC[C@H]1O Amb22886846 [1,0,0,1,0,0|1,0,0]=3 8197 B7R1.4 C[C@@H]1CNC[C@H]1O Amb25110287 [1,0,0,1,0,0|1,0,0]=3 8198 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|0,0,0]=2 8199 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [1,0,0,1,0,0|1,0,0]=3 8200 B7R1.4 C[C@@H]1COC[C@H]1N Amb30869718 [1,0,0,1,0,0|1,0,0]=3 8201 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|0,0,0]=2 8202 B7R1.4 C[C@@H]1CSC[C@@H]1O Amb27422447 [1,0,0,1,0,0|0,1,0]=3 8203 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [1,0,0,1,0,0|2,0,0]=4 8204 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [1,0,0,1,0,0|1,0,0]=3 8205 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [1,0,0,1,0,0|1,0,0]=3 8206 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb32412686 [1,0,0,1,0,0|1,0,0]=3 8207 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [1,0,0,1,0,0|1,0,0]=3 8208 B7R1.4 C[C@@H]1NCC[C@H]1N Amb28250867 [1,0,0,1,0,0|2,0,0]=4 8209 B7R1.4 C[C@@H]1NCC[C@H]1O Amb26412930 [1,0,0,1,0,0|1,0,0]=3 8210 B7R1.4 C[C@@H]1NCC[C@H]1O Amb32412687 [1,0,0,1,0,0|1,0,0]=3 8211 B7R1.4 C[C@@H]1OCC[C@@H]1I Amb27962293 [1,0,0,1,0,0|1,0,0]=3 8212 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|1,0,0]=3 8213 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|1,0,0]=3 8214 B7R1.4 C[C@@H]1OCC[C@H]1I Amb27664288 [1,0,0,1,0,0|1,0,0]=3 8215 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [1,0,0,1,0,0|1,0,0]=3 8216 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [1,0,0,1,0,0|1,0,0]=3 8217 B7R1.4 C[C@@H]1SCC[C@@H]1O Amb28144028 [1,0,0,1,0,0|1,0,0]=3 8218 B7R1.4 C[C@@H]1SCC[C@H]1O Amb27853254 [1,0,0,1,0,0|1,0,0]=3 8219 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [1,0,0,1,0,0|0,0,2]=4 8220 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|1,0,0]=3 8221 B7R1.4 C[C@H]1CCC[C@@H]1O Amb10844719 [1,0,0,1,0,0|0,0,0]=2 8222 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [1,0,0,1,0,0|1,0,0]=3 8223 B7R1.4 C[C@H]1CCC[C@H]1I Amb28135188 [1,0,0,1,0,0|1,0,0]=3 8224 B7R1.4 C[C@H]1CCC[C@H]1O Amb26012367 [1,0,0,1,0,0|0,0,0]=2 8225 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [1,0,0,1,0,0|1,0,0]=3 8226 B7R1.4 C[C@H]1CCO[C@H]1Cl Amb27444980 [1,0,0,1,0,0|1,0,0]=3 8227 B7R1.4 C[C@H]1CCO[C@H]1O Amb27642053 [1,0,0,1,0,0|0,0,0]=2 8228 B7R1.4 C[C@H]1CNC[C@@H]1O Amb33805301 [1,0,0,1,0,0|1,0,0]=3 8229 B7R1.4 C[C@H]1CNC[C@H]1N Amb25174297 [1,0,0,1,0,0|2,0,0]=4 8230 B7R1.4 C[C@H]1CNC[C@H]1O Amb27203947 [1,0,0,1,0,0|1,0,0]=3 8231 B7R1.4 C[C@H]1CNC[C@H]1O Amb33871574 [1,0,0,1,0,0|1,0,0]=3 8232 B7R1.4 C[C@H]1COC[C@@H]1N Amb33805302 [1,0,0,1,0,0|1,0,0]=3 8233 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|0,0,0]=2 8234 B7R1.4 C[C@H]1COC[C@H]1N Amb27202968 [1,0,0,1,0,0|1,0,0]=3 8235 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [1,0,0,1,0,0|0,0,0]=2 8236 B7R1.4 C[C@H]1CSC[C@H]1N Amb27961505 [1,0,0,1,0,0|1,1,0]=4 8237 B7R1.4 C[C@H]1CSC[C@H]1O Amb27448475 [1,0,0,1,0,0|0,1,0]=3 8238 B7R1.4 C[C@H]1NCC[C@@H]1O Amb28322208 [1,0,0,1,0,0|1,0,0]=3 8239 B7R1.4 C[C@H]1OCC[C@@H]1O Amb28388631 [1,0,0,1,0,0|1,0,0]=3 8240 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|1,0,0]=3 8241 B7R1.4 C[C@H]1SCC[C@@H]1O Amb27441450 [1,0,0,1,0,0|1,0,0]=3 8242 B7R1.4 ClC1CCCC1Cl Amb9787196 [1,0,0,1,0,0|2,0,0]=4 8243 B7R1.4 ClC1CCOC1Cl Amb22731370 [1,0,0,1,0,0|2,0,0]=4 8244 B7R1.4 Cl[C@@H]1CCC[C@@H]1Br Amb27658896 [1,0,0,1,0,0|2,0,0]=4 8245 B7R1.4 Cl[C@@H]1OCC[C@H]1Cl Amb27430492 [1,0,0,1,0,0|2,0,0]=4 8246 B7R1.4 Cl[C@H]1CCC[C@@H]1Br Amb27227433 [1,0,0,1,0,0|2,0,0]=4 8247 B7R1.4 Cl[C@H]1CCO[C@@H]1Cl Amb27419902 [1,0,0,1,0,0|2,0,0]=4 8248 B7R1.4 FC1CCCC1I Amb27236860 [1,0,0,1,0,0|2,0,0]=4 8249 B7R1.4 F[C@@H]1CCC[C@H]1I Amb27811995 [1,0,0,1,0,0|2,0,0]=4 8250 B7R1.4 NC1CCCC1Br Amb20667786 [1,0,0,1,0,0|2,0,0]=4 8251 B7R1.4 NC1CCCC1Br Amb24691577 [1,0,0,1,0,0|2,0,0]=4 8252 B7R1.4 NC1CCCC1Cl Amb3428719 [1,0,0,1,0,0|2,0,0]=4 8253 B7R1.4 NC1CCCC1Cl Amb4451124 [1,0,0,1,0,0|2,0,0]=4 8254 B7R1.4 NC1CCCC1F Amb23538754 [1,0,0,1,0,0|2,0,0]=4 8255 B7R1.4 NC1CCCC1F Amb32658048 [1,0,0,1,0,0|2,0,0]=4 8256 B7R1.4 NC1CCCC1N Amb18639642 [1,0,0,1,0,0|2,0,0]=4 8257 B7R1.4 NC1CCCC1N Amb31291256 [1,0,0,1,0,0|2,0,0]=4 8258 B7R1.4 NC1CCCC1O Amb13951342 [1,0,0,1,0,0|1,0,0]=3 8259 B7R1.4 NC1CCCC1O Amb8385206 [1,0,0,1,0,0|1,0,0]=3 8260 B7R1.4 NC1CCOC1O Amb27408022 [1,0,0,1,0,0|1,0,0]=3 8261 B7R1.4 NC1CNCC1O Amb22235661 [1,0,0,1,0,0|2,0,0]=4 8262 B7R1.4 NC1COCC1N Amb23590778 [1,0,0,1,0,0|2,0,0]=4 8263 B7R1.4 NC1COCC1N Amb32665881 [1,0,0,1,0,0|2,0,0]=4 8264 B7R1.4 NC1COCC1O Amb18277417 [1,0,0,1,0,0|1,0,0]=3 8265 B7R1.4 NC1COCC1O Amb19515137 [1,0,0,1,0,0|1,0,0]=3 8266 B7R1.4 NC1CSCC1O Amb2693597 [1,0,0,1,0,0|1,1,0]=4 8267 B7R1.4 NC1CSCC1O Amb5634210 [1,0,0,1,0,0|1,1,0]=4 8268 B7R1.4 NC1CSCC1O Amb8565080 [1,0,0,1,0,0|1,1,0]=4 8269 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650234 [1,0,0,1,0,0|2,0,0]=4 8270 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650235 [1,0,0,1,0,0|2,0,0]=4 8271 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb25174659 [1,0,0,1,0,0|2,0,0]=4 8272 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661555 [1,0,0,1,0,0|2,0,0]=4 8273 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661660 [1,0,0,1,0,0|2,0,0]=4 8274 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [1,0,0,1,0,0|1,0,0]=3 8275 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [1,0,0,1,0,0|1,0,0]=3 8276 B7R1.4 N[C@@H]1CCC[C@H]1Cl Amb27882439 [1,0,0,1,0,0|2,0,0]=4 8277 B7R1.4 N[C@@H]1CCC[C@H]1F Amb28429786 [1,0,0,1,0,0|2,0,0]=4 8278 B7R1.4 N[C@@H]1CCC[C@H]1F Amb31308557 [1,0,0,1,0,0|2,0,0]=4 8279 B7R1.4 N[C@@H]1CCC[C@H]1N Amb16231433 [1,0,0,1,0,0|2,0,0]=4 8280 B7R1.4 N[C@@H]1CCC[C@H]1N Amb22748826 [1,0,0,1,0,0|2,0,0]=4 8281 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [1,0,0,1,0,0|1,0,0]=3 8282 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [1,0,0,1,0,0|1,0,0]=3 8283 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [1,0,0,1,0,0|1,0,0]=3 8284 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [1,0,0,1,0,0|1,0,0]=3 8285 B7R1.4 N[C@@H]1CCC[C@H]1S Amb28345579 [1,0,0,1,0,0|1,1,0]=4 8286 B7R1.4 N[C@@H]1CNC[C@@H]1O Amb25911176 [1,0,0,1,0,0|2,0,0]=4 8287 B7R1.4 N[C@@H]1COC[C@@H]1F Amb31188298 [1,0,0,1,0,0|2,0,0]=4 8288 B7R1.4 N[C@@H]1COC[C@@H]1F Amb33456080 [1,0,0,1,0,0|2,0,0]=4 8289 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [1,0,0,1,0,0|2,0,0]=4 8290 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [1,0,0,1,0,0|2,0,0]=4 8291 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [1,0,0,1,0,0|1,0,0]=3 8292 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [1,0,0,1,0,0|1,0,0]=3 8293 B7R1.4 N[C@@H]1COC[C@H]1F Amb33719125 [1,0,0,1,0,0|2,0,0]=4 8294 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [1,0,0,1,0,0|2,0,0]=4 8295 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [1,0,0,1,0,0|2,0,0]=4 8296 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [1,0,0,1,0,0|1,0,0]=3 8297 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [1,0,0,1,0,0|1,0,0]=3 8298 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [1,0,0,1,0,0|1,0,0]=3 8299 B7R1.4 N[C@@H]1COC[C@H]1O Amb33715897 [1,0,0,1,0,0|1,0,0]=3 8300 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [1,0,0,1,0,0|1,1,0]=4 8301 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb532933 [1,0,0,1,0,0|1,1,0]=4 8302 B7R1.4 N[C@@H]1CSC[C@H]1O Amb1099355 [1,0,0,1,0,0|1,1,0]=4 8303 B7R1.4 N[C@H]1CCC[C@@H]1Cl Amb27203393 [1,0,0,1,0,0|2,0,0]=4 8304 B7R1.4 N[C@H]1CCC[C@@H]1F Amb34916180 [1,0,0,1,0,0|2,0,0]=4 8305 B7R1.4 N[C@H]1CCC[C@@H]1N Amb16231434 [1,0,0,1,0,0|2,0,0]=4 8306 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [1,0,0,1,0,0|1,0,0]=3 8307 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [1,0,0,1,0,0|1,0,0]=3 8308 B7R1.4 N[C@H]1CCC[C@H]1F Amb27476530 [1,0,0,1,0,0|2,0,0]=4 8309 B7R1.4 N[C@H]1CCC[C@H]1F Amb34162936 [1,0,0,1,0,0|2,0,0]=4 8310 B7R1.4 N[C@H]1CCC[C@H]1N Amb28346940 [1,0,0,1,0,0|2,0,0]=4 8311 B7R1.4 N[C@H]1CCC[C@H]1N Amb30988009 [1,0,0,1,0,0|2,0,0]=4 8312 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [1,0,0,1,0,0|1,0,0]=3 8313 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [1,0,0,1,0,0|1,0,0]=3 8314 B7R1.4 N[C@H]1CNC[C@H]1O Amb27621416 [1,0,0,1,0,0|2,0,0]=4 8315 B7R1.4 N[C@H]1COC[C@@H]1N Amb26937236 [1,0,0,1,0,0|2,0,0]=4 8316 B7R1.4 N[C@H]1COC[C@@H]1O Amb10608341 [1,0,0,1,0,0|1,0,0]=3 8317 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [1,0,0,1,0,0|1,0,0]=3 8318 B7R1.4 N[C@H]1COC[C@H]1F Amb35825425 [1,0,0,1,0,0|2,0,0]=4 8319 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [1,0,0,1,0,0|1,0,0]=3 8320 B7R1.4 N[C@H]1COC[C@H]1O Amb33774994 [1,0,0,1,0,0|1,0,0]=3 8321 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,1]=4 8322 B7R1.4 OC1CCCC1Br Amb27201322 [1,0,0,1,0,0|1,0,0]=3 8323 B7R1.4 OC1CCCC1Cl Amb9787194 [1,0,0,1,0,0|1,0,0]=3 8324 B7R1.4 OC1CCCC1F Amb25746323 [1,0,0,1,0,0|1,0,0]=3 8325 B7R1.4 OC1CCCC1I Amb27478744 [1,0,0,1,0,0|1,0,0]=3 8326 B7R1.4 OC1CCCC1O Amb17935884 [1,0,0,1,0,0|1,0,0]=3 8327 B7R1.4 OC1CCOC1O Amb28291442 [1,0,0,1,0,0|1,0,0]=3 8328 B7R1.4 OC1CNCC1F Amb24377167 [1,0,0,1,0,0|2,0,0]=4 8329 B7R1.4 OC1CNCC1O Amb18640019 [1,0,0,1,0,0|2,0,0]=4 8330 B7R1.4 OC1CNCC1O Amb33527029 [1,0,0,1,0,0|2,0,0]=4 8331 B7R1.4 OC1CNCC1S Amb29854580 [1,0,0,1,0,0|2,0,0]=4 8332 B7R1.4 OC1COCC1Br Amb25321008 [1,0,0,1,0,0|1,0,0]=3 8333 B7R1.4 OC1COCC1F Amb26475960 [1,0,0,1,0,0|1,0,0]=3 8334 B7R1.4 OC1COCC1I Amb24332672 [1,0,0,1,0,0|1,0,0]=3 8335 B7R1.4 OC1COCC1O Amb532982 [1,0,0,1,0,0|1,0,0]=3 8336 B7R1.4 OC1COCC1S Amb27970973 [1,0,0,1,0,0|1,0,0]=3 8337 B7R1.4 OC1CSCC1O Amb17593233 [1,0,0,1,0,0|1,1,0]=4 8338 B7R1.4 OC1OCCC1F Amb22641467 [1,0,0,1,0,0|1,0,0]=3 8339 B7R1.4 O[C@@H]1CCC[C@@H]1Br Amb24470331 [1,0,0,1,0,0|1,0,0]=3 8340 B7R1.4 O[C@@H]1CCC[C@@H]1F Amb34916184 [1,0,0,1,0,0|1,0,0]=3 8341 B7R1.4 O[C@@H]1CCC[C@H]1Br Amb26427919 [1,0,0,1,0,0|1,0,0]=3 8342 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb17938993 [1,0,0,1,0,0|1,0,0]=3 8343 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb30628647 [1,0,0,1,0,0|1,0,0]=3 8344 B7R1.4 O[C@@H]1CCC[C@H]1F Amb26891974 [1,0,0,1,0,0|1,0,0]=3 8345 B7R1.4 O[C@@H]1CCC[C@H]1O Amb33524011 [1,0,0,1,0,0|1,0,0]=3 8346 B7R1.4 O[C@@H]1CNC[C@@H]1F Amb22886226 [1,0,0,1,0,0|2,0,0]=4 8347 B7R1.4 O[C@@H]1CNC[C@@H]1F Amb24714910 [1,0,0,1,0,0|2,0,0]=4 8348 B7R1.4 O[C@@H]1CNC[C@H]1F Amb22406204 [1,0,0,1,0,0|2,0,0]=4 8349 B7R1.4 O[C@@H]1CNC[C@H]1F Amb22757855 [1,0,0,1,0,0|2,0,0]=4 8350 B7R1.4 O[C@@H]1CNC[C@H]1O Amb22746349 [1,0,0,1,0,0|2,0,0]=4 8351 B7R1.4 O[C@@H]1CNC[C@H]1O Amb8630288 [1,0,0,1,0,0|2,0,0]=4 8352 B7R1.4 O[C@@H]1CNC[C@H]1S Amb35672842 [1,0,0,1,0,0|2,0,0]=4 8353 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [1,0,0,1,0,0|1,0,0]=3 8354 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [1,0,0,1,0,0|1,0,0]=3 8355 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [1,0,0,1,0,0|1,0,0]=3 8356 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [1,0,0,1,0,0|1,0,0]=3 8357 B7R1.4 O[C@@H]1CSC[C@@H]1O Amb28455182 [1,0,0,1,0,0|1,1,0]=4 8358 B7R1.4 O[C@@H]1CSC[C@@H]1S Amb27422639 [1,0,0,1,0,0|1,1,0]=4 8359 B7R1.4 O[C@@H]1CSC[C@H]1S Amb27981741 [1,0,0,1,0,0|1,1,0]=4 8360 B7R1.4 O[C@H]1CCC[C@@H]1F Amb24612635 [1,0,0,1,0,0|1,0,0]=3 8361 B7R1.4 O[C@H]1CCC[C@@H]1I Amb27857258 [1,0,0,1,0,0|1,0,0]=3 8362 B7R1.4 O[C@H]1CCC[C@@H]1O Amb22350708 [1,0,0,1,0,0|1,0,0]=3 8363 B7R1.4 O[C@H]1CCC[C@H]1Br Amb8394047 [1,0,0,1,0,0|1,0,0]=3 8364 B7R1.4 O[C@H]1CCC[C@H]1Cl Amb8394048 [1,0,0,1,0,0|1,0,0]=3 8365 B7R1.4 O[C@H]1CCC[C@H]1O Amb2721263 [1,0,0,1,0,0|1,0,0]=3 8366 B7R1.4 O[C@H]1CNC[C@@H]1F Amb26904343 [1,0,0,1,0,0|2,0,0]=4 8367 B7R1.4 O[C@H]1CNC[C@@H]1F Amb32665177 [1,0,0,1,0,0|2,0,0]=4 8368 B7R1.4 O[C@H]1CNC[C@@H]1O Amb23385333 [1,0,0,1,0,0|2,0,0]=4 8369 B7R1.4 O[C@H]1CNC[C@@H]1O Amb32409384 [1,0,0,1,0,0|2,0,0]=4 8370 B7R1.4 O[C@H]1CNC[C@H]1F Amb33874271 [1,0,0,1,0,0|2,0,0]=4 8371 B7R1.4 O[C@H]1CNC[C@H]1F Amb34916235 [1,0,0,1,0,0|2,0,0]=4 8372 B7R1.4 O[C@H]1CNC[C@H]1O Amb22406184 [1,0,0,1,0,0|2,0,0]=4 8373 B7R1.4 O[C@H]1CNC[C@H]1O Amb8630287 [1,0,0,1,0,0|2,0,0]=4 8374 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [1,0,0,1,0,0|1,0,0]=3 8375 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [1,0,0,1,0,0|1,0,0]=3 8376 B7R1.4 O[C@H]1COC[C@H]1O Amb22406017 [1,0,0,1,0,0|1,0,0]=3 8377 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O Amb4269724 [1,0,0,1,0,0|1,1,0]=4 8378 B7R1.5 C#CCC1CC1C Amb33144239 [1,0,0,1,0,0|1,0,1]=4 8379 B7R1.5 C=CCC1CC1O Amb26478050 [1,0,0,1,0,0|0,0,2]=4 8380 B7R1.5 C=CC[C@@H]1C[C@@H]1O Amb28053769 [1,0,0,1,0,0|0,0,2]=4 8381 B7R1.5 CC1CC1CC#N Amb25888500 [1,0,0,1,0,0|1,0,1]=4 8382 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,2]=4 8383 B7R1.5 CC1CC1CCBr Amb26055211 [1,0,0,1,0,0|1,0,0]=3 8384 B7R1.5 CC1CC1CCN Amb27835415 [1,0,0,1,0,0|1,0,0]=3 8385 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,0]=2 8386 B7R1.5 CC1CC1CCS Amb33143846 [1,0,0,1,0,0|0,1,0]=3 8387 B7R1.5 CC1CC1CNN Amb10610283 [1,0,0,1,0,0|2,0,0]=4 8388 B7R1.5 CC1CC1CNN Amb6246477 [1,0,0,1,0,0|2,0,0]=4 8389 B7R1.5 CC1CC1CNO Amb32954149 [1,0,0,1,0,0|1,0,0]=3 8390 B7R1.5 CC1CC1CON Amb33144974 [1,0,0,1,0,0|2,0,0]=4 8391 B7R1.5 CC1OC1CC#N Amb16233004 [1,0,0,1,0,0|1,0,1]=4 8392 B7R1.5 CCCC1CC1Cl Amb28193341 [1,0,0,1,0,0|1,0,0]=3 8393 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|1,0,0]=3 8394 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|1,0,0]=3 8395 B7R1.5 CCCC1ON1C Amb22232363 [1,0,0,1,0,0|1,0,0]=3 8396 B7R1.5 CCC[C@@H]1C[C@@H]1N Amb34915319 [1,0,0,1,0,0|1,0,0]=3 8397 B7R1.5 CCC[C@@H]1C[C@H]1N Amb27488941 [1,0,0,1,0,0|1,0,0]=3 8398 B7R1.5 CCC[C@@H]1C[C@H]1N Amb33032253 [1,0,0,1,0,0|1,0,0]=3 8399 B7R1.5 CCOC1CC1Br Amb24650022 [1,0,0,1,0,0|1,0,0]=3 8400 B7R1.5 CCOC1CC1F Amb27969430 [1,0,0,1,0,0|1,0,0]=3 8401 B7R1.5 CCOC1CC1N Amb19515720 [1,0,0,1,0,0|1,0,0]=3 8402 B7R1.5 CCOC1CC1N Amb32718753 [1,0,0,1,0,0|1,0,0]=3 8403 B7R1.5 CCO[C@@H]1C[C@@H]1Br Amb27966858 [1,0,0,1,0,0|1,0,0]=3 8404 B7R1.5 CCO[C@@H]1C[C@H]1Br Amb25362288 [1,0,0,1,0,0|1,0,0]=3 8405 B7R1.5 CCO[C@@H]1C[C@H]1N Amb32992425 [1,0,0,1,0,0|1,0,0]=3 8406 B7R1.5 CCO[C@@H]1C[C@H]1N Amb32992585 [1,0,0,1,0,0|1,0,0]=3 8407 B7R1.5 CCO[C@H]1C[C@H]1Cl Amb28246620 [1,0,0,1,0,0|1,0,0]=3 8408 B7R1.5 CNCC1CC1C Amb35789304 [1,0,0,1,0,0|2,0,0]=4 8409 B7R1.5 CNCC1CC1C Amb8853678 [1,0,0,1,0,0|2,0,0]=4 8410 B7R1.5 CNC[C@@H]1C[C@H]1C Amb27214669 [1,0,0,1,0,0|2,0,0]=4 8411 B7R1.5 COCC1CC1N Amb26004208 [1,0,0,1,0,0|2,0,0]=4 8412 B7R1.5 COC[C@@H]1C[C@H]1N Amb33428856 [1,0,0,1,0,0|2,0,0]=4 8413 B7R1.5 CSCC1CC1N Amb33272055 [1,0,0,1,0,0|2,0,0]=4 8414 B7R1.5 CSC[C@@H]1C[C@H]1N Amb33272056 [1,0,0,1,0,0|2,0,0]=4 8415 B7R1.5 C[C@@H]1C[C@@H]1CCBr Amb27454257 [1,0,0,1,0,0|1,0,0]=3 8416 B7R1.5 C[C@@H]1C[C@@H]1CCO Amb26012892 [1,0,0,1,0,0|0,0,0]=2 8417 B7R1.5 C[C@@H]1O[C@H]1CCO Amb27184243 [1,0,0,1,0,0|1,0,0]=3 8418 B7R1.5 C[C@H]1C[C@H]1CCCl Amb27630412 [1,0,0,1,0,0|1,0,0]=3 8419 B7R1.5 C[C@H]1O[C@H]1CCBr Amb27454808 [1,0,0,1,0,0|1,0,0]=3 8420 B7R1.5 NC1CC1CCF Amb33480869 [1,0,0,1,0,0|2,0,0]=4 8421 B7R1.5 N[C@@H]1C[C@H]1CCF Amb33480870 [1,0,0,1,0,0|2,0,0]=4 8422 B7R1.5 N[C@@H]1C[C@H]1CCO Amb28074110 [1,0,0,1,0,0|1,0,0]=3 8423 B7R1.5 OCCC1CC1F Amb27238848 [1,0,0,1,0,0|1,0,0]=3 8424 B7R1.5 [C-]#[N+]CC1CC1C Amb33144641 [1,0,0,1,0,0|2,0,0]=4 8425 B7R1.6 BrCCC1CCC1 Amb25930029 [1,0,0,1,0,0|1,0,0]=3 8426 B7R1.6 BrCCC1CCN1 Amb27392177 [1,0,0,1,0,0|2,0,0]=4 8427 B7R1.6 BrCCC1COC1 Amb26331124 [1,0,0,1,0,0|2,0,0]=4 8428 B7R1.6 BrCCN1CCC1 Amb25830678 [1,0,0,1,0,0|2,0,0]=4 8429 B7R1.6 BrCCN1CCC1 Amb33456334 [1,0,0,1,0,0|2,0,0]=4 8430 B7R1.6 Br[Mg]CC1CCC1 Amb32643968 [1,0,0,1,0,0|2,0,0]=4 8431 B7R1.6 C#CCC1CCC1 Amb33314111 [1,0,0,1,0,0|1,0,1]=4 8432 B7R1.6 C=CCC1CCC1 Amb27198597 [1,0,0,1,0,0|1,0,1]=4 8433 B7R1.6 CCC=C1CCC1 Amb28120199 [1,0,0,1,0,0|1,0,1]=4 8434 B7R1.6 CCCC1CCN1 Amb33543494 [1,0,0,1,0,0|1,0,0]=3 8435 B7R1.6 CCCC1CCS1 Amb26614197 [1,0,0,1,0,0|0,1,0]=3 8436 B7R1.6 CCCC1CNC1 Amb25297768 [1,0,0,1,0,0|2,0,0]=4 8437 B7R1.6 CCCC1CNC1 Amb33802188 [1,0,0,1,0,0|2,0,0]=4 8438 B7R1.6 CCCC1COC1 Amb27147877 [1,0,0,1,0,0|2,0,0]=4 8439 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|1,0,0]=3 8440 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|1,0,0]=3 8441 B7R1.6 CCNC1CNC1 Amb24619347 [1,0,0,1,0,0|2,0,0]=4 8442 B7R1.6 CCNC1CNC1 Amb33544003 [1,0,0,1,0,0|2,0,0]=4 8443 B7R1.6 CCNC1COC1 Amb22406248 [1,0,0,1,0,0|2,0,0]=4 8444 B7R1.6 CCNC1COC1 Amb22736884 [1,0,0,1,0,0|2,0,0]=4 8445 B7R1.6 CCNC1CSC1 Amb27457315 [1,0,0,1,0,0|2,0,0]=4 8446 B7R1.6 CCOC1CNC1 Amb18523751 [1,0,0,1,0,0|1,0,0]=3 8447 B7R1.6 CCOC1CNC1 Amb19889815 [1,0,0,1,0,0|1,0,0]=3 8448 B7R1.6 CCOC1CNC1 Amb32411735 [1,0,0,1,0,0|1,0,0]=3 8449 B7R1.6 CCSC1CNC1 Amb22395437 [1,0,0,1,0,0|1,1,0]=4 8450 B7R1.6 CCSC1CNC1 Amb26073964 [1,0,0,1,0,0|1,1,0]=4 8451 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|2,0,0]=4 8452 B7R1.6 CNCC1CCC1 Amb9214718 [1,0,0,1,0,0|2,0,0]=4 8453 B7R1.6 COCC1CCN1 Amb23439866 [1,0,0,1,0,0|2,0,0]=4 8454 B7R1.6 COCC1CCN1 Amb28827660 [1,0,0,1,0,0|2,0,0]=4 8455 B7R1.6 COC[C@@H]1CCN1 Amb22757160 [1,0,0,1,0,0|2,0,0]=4 8456 B7R1.6 COC[C@@H]1CCN1 Amb23440214 [1,0,0,1,0,0|2,0,0]=4 8457 B7R1.6 COC[C@H]1CCN1 Amb25808228 [1,0,0,1,0,0|2,0,0]=4 8458 B7R1.6 COC[C@H]1CCN1 Amb33805195 [1,0,0,1,0,0|2,0,0]=4 8459 B7R1.6 CONC1CCC1 Amb27425058 [1,0,0,1,0,0|2,0,0]=4 8460 B7R1.6 CONC1CCC1 Amb35789042 [1,0,0,1,0,0|2,0,0]=4 8461 B7R1.6 CSCC1CCN1 Amb33272485 [1,0,0,1,0,0|2,0,0]=4 8462 B7R1.6 ClCCC1CCC1 Amb27831996 [1,0,0,1,0,0|1,0,0]=3 8463 B7R1.6 ClCCC1CNC1 Amb27807375 [1,0,0,1,0,0|2,0,0]=4 8464 B7R1.6 ClCCN1CCC1 Amb10069966 [1,0,0,1,0,0|2,0,0]=4 8465 B7R1.6 ClCOC1CCC1 Amb28314243 [1,0,0,1,0,0|1,0,0]=3 8466 B7R1.6 FCCC1CCN1 Amb25377475 [1,0,0,1,0,0|2,0,0]=4 8467 B7R1.6 FCCC1CNC1 Amb28050421 [1,0,0,1,0,0|2,0,0]=4 8468 B7R1.6 FCCC1CNC1 Amb33743843 [1,0,0,1,0,0|2,0,0]=4 8469 B7R1.6 FCCC1CNC1 Amb34153675 [1,0,0,1,0,0|2,0,0]=4 8470 B7R1.6 FCCN1CCC1 Amb28280056 [1,0,0,1,0,0|2,0,0]=4 8471 B7R1.6 FCOC1CNC1 Amb33378698 [1,0,0,1,0,0|2,0,0]=4 8472 B7R1.6 ICCC1COC1 Amb25207110 [1,0,0,1,0,0|2,0,0]=4 8473 B7R1.6 N#CCC1CCC1 Amb9870414 [1,0,0,1,0,0|1,0,1]=4 8474 B7R1.6 N#CCC1CCO1 Amb32645031 [1,0,0,1,0,0|1,0,1]=4 8475 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,0]=3 8476 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,0]=3 8477 B7R1.6 NCCC1CCO1 Amb27843371 [1,0,0,1,0,0|1,0,0]=3 8478 B7R1.6 NCCC1CNC1 Amb25997240 [1,0,0,1,0,0|2,0,0]=4 8479 B7R1.6 NCCC1COC1 Amb21864698 [1,0,0,1,0,0|2,0,0]=4 8480 B7R1.6 NCCC1CSC1 Amb27971340 [1,0,0,1,0,0|2,0,0]=4 8481 B7R1.6 NCCN1CCC1 Amb20622304 [1,0,0,1,0,0|2,0,0]=4 8482 B7R1.6 NCC[C@H]1CCO1 Amb25920109 [1,0,0,1,0,0|1,0,0]=3 8483 B7R1.6 NNCC1CCC1 Amb19893039 [1,0,0,1,0,0|2,0,0]=4 8484 B7R1.6 NNCC1CCC1 Amb6248618 [1,0,0,1,0,0|2,0,0]=4 8485 B7R1.6 NOCC1CCC1 Amb22896602 [1,0,0,1,0,0|2,0,0]=4 8486 B7R1.6 NOCC1CCC1 Amb32667096 [1,0,0,1,0,0|2,0,0]=4 8487 B7R1.6 O=CCC1CCC1 Amb22002603 [1,0,0,1,0,0|0,0,2]=4 8488 B7R1.6 O=CCC1CCO1 Amb26626501 [1,0,0,1,0,0|1,0,1]=4 8489 B7R1.6 OCC=C1CCC1 Amb28346163 [1,0,0,1,0,0|0,0,2]=4 8490 B7R1.6 OCCC1=CCC1 Amb28189596 [1,0,0,1,0,0|0,0,2]=4 8491 B7R1.6 OCCC1CCC1 Amb33543947 [1,0,0,1,0,0|0,0,0]=2 8492 B7R1.6 OCCC1CCN1 Amb25350591 [1,0,0,1,0,0|1,0,0]=3 8493 B7R1.6 OCCC1CCO1 Amb25780445 [1,0,0,1,0,0|1,0,0]=3 8494 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|1,0,0]=3 8495 B7R1.6 OCCC1CNC1 Amb30869764 [1,0,0,1,0,0|1,0,0]=3 8496 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|1,0,0]=3 8497 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|1,0,0]=3 8498 B7R1.6 OCCN1CCC1 Amb22002602 [1,0,0,1,0,0|1,0,0]=3 8499 B7R1.6 OCC[C@@H]1CCN1 Amb24479867 [1,0,0,1,0,0|1,0,0]=3 8500 B7R1.6 OCC[C@@H]1CCO1 Amb26009491 [1,0,0,1,0,0|1,0,0]=3 8501 B7R1.6 OCC[C@H]1CCO1 Amb25129832 [1,0,0,1,0,0|1,0,0]=3 8502 B7R1.6 ONCC1CCC1 Amb25888398 [1,0,0,1,0,0|1,0,0]=3 8503 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,0]=3 8504 B7R1.6 SCCC1CNC1 Amb29854367 [1,0,0,1,0,0|1,1,0]=4 8505 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|1,0,0]=3 8506 B7R1.7 BrCCCC1CO1 Amb27407723 [1,0,0,1,0,0|1,0,0]=3 8507 B7R1.7 BrCCOC1CC1 Amb32667448 [1,0,0,1,0,0|1,0,0]=3 8508 B7R1.7 C#CCCC1CC1 Amb33429088 [1,0,0,1,0,0|1,0,1]=4 8509 B7R1.7 C#CCCC1CO1 Amb10606899 [1,0,0,1,0,0|0,0,2]=4 8510 B7R1.7 C=CCCC1CO1 Amb3940512 [1,0,0,1,0,0|0,0,2]=4 8511 B7R1.7 C=CCC[C@@H]1CO1 Amb28050706 [1,0,0,1,0,0|0,0,2]=4 8512 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [1,0,0,1,0,0|0,0,2]=4 8513 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|0,0,0]=2 8514 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|0,0,0]=2 8515 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|0,0,0]=2 8516 B7R1.7 CCCNC1CC1 Amb1135100 [1,0,0,1,0,0|2,0,0]=4 8517 B7R1.7 CCCNC1CC1 Amb32644830 [1,0,0,1,0,0|2,0,0]=4 8518 B7R1.7 CCNCC1CC1 Amb30584675 [1,0,0,1,0,0|1,0,0]=3 8519 B7R1.7 CCNCC1CC1 Amb6686877 [1,0,0,1,0,0|1,0,0]=3 8520 B7R1.7 CCOCC1CO1 Amb9709641 [1,0,0,1,0,0|1,0,0]=3 8521 B7R1.7 CCOC[C@@H]1CO1 Amb25954691 [1,0,0,1,0,0|1,0,0]=3 8522 B7R1.7 CCOC[C@H]1CO1 Amb25888471 [1,0,0,1,0,0|1,0,0]=3 8523 B7R1.7 CCSCC1CC1 Amb27206075 [1,0,0,1,0,0|0,1,0]=3 8524 B7R1.7 CCSCC1CO1 Amb6680858 [1,0,0,1,0,0|1,0,0]=3 8525 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [1,0,0,1,0,0|1,0,0]=3 8526 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [1,0,0,1,0,0|1,0,0]=3 8527 B7R1.7 CC\C=C\C1CO1 Amb33449783 [1,0,0,1,0,0|0,0,2]=4 8528 B7R1.7 CC\C=C\[C@@H]1CO1 Amb33272599 [1,0,0,1,0,0|0,0,2]=4 8529 B7R1.7 CC\C=C\[C@H]1CO1 Amb33272601 [1,0,0,1,0,0|0,0,2]=4 8530 B7R1.7 CNCCC1CC1 Amb18979588 [1,0,0,1,0,0|2,0,0]=4 8531 B7R1.7 CNCCC1CC1 Amb33550263 [1,0,0,1,0,0|2,0,0]=4 8532 B7R1.7 CNOCC1CC1 Amb32412838 [1,0,0,1,0,0|1,0,0]=3 8533 B7R1.7 COCCC1CO1 Amb27984185 [1,0,0,1,0,0|1,0,0]=3 8534 B7R1.7 COCC[C@@H]1CO1 Amb33377003 [1,0,0,1,0,0|1,0,0]=3 8535 B7R1.7 COCC[C@H]1CO1 Amb33377005 [1,0,0,1,0,0|1,0,0]=3 8536 B7R1.7 CSCCC1CC1 Amb28079007 [1,0,0,1,0,0|2,0,0]=4 8537 B7R1.7 CSCCC1CO1 Amb25241000 [1,0,0,1,0,0|1,0,0]=3 8538 B7R1.7 CSCC[C@@H]1CO1 Amb33203333 [1,0,0,1,0,0|1,0,0]=3 8539 B7R1.7 CSCC[C@H]1CO1 Amb33203334 [1,0,0,1,0,0|1,0,0]=3 8540 B7R1.7 C\C=C\CC1CO1 Amb25285825 [1,0,0,1,0,0|0,0,2]=4 8541 B7R1.7 ClCCNC1CC1 Amb17334071 [1,0,0,1,0,0|2,0,0]=4 8542 B7R1.7 ClCCNC1CC1 Amb32664797 [1,0,0,1,0,0|2,0,0]=4 8543 B7R1.7 ClCCOC1CC1 Amb10603117 [1,0,0,1,0,0|1,0,0]=3 8544 B7R1.7 ClCCOC1CO1 Amb27794624 [1,0,0,1,0,0|1,0,0]=3 8545 B7R1.7 ClCOCC1CC1 Amb33545122 [1,0,0,1,0,0|1,0,0]=3 8546 B7R1.7 FCCCC1CO1 Amb33196122 [1,0,0,1,0,0|1,0,0]=3 8547 B7R1.7 FCCOC1CC1 Amb27436850 [1,0,0,1,0,0|1,0,0]=3 8548 B7R1.7 ICCCC1CC1 Amb35720662 [1,0,0,1,0,0|1,0,0]=3 8549 B7R1.7 ICCCC1CO1 Amb27838220 [1,0,0,1,0,0|1,0,0]=3 8550 B7R1.7 N#CCCC1CC1 Amb33548668 [1,0,0,1,0,0|1,0,1]=4 8551 B7R1.7 N#CCCC1CO1 Amb27475428 [1,0,0,1,0,0|1,0,1]=4 8552 B7R1.7 N#CCC[C@@H]1CO1 Amb27767931 [1,0,0,1,0,0|1,0,1]=4 8553 B7R1.7 N#CCC[C@H]1CO1 Amb28208660 [1,0,0,1,0,0|1,0,1]=4 8554 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|1,0,0]=3 8555 B7R1.7 NCCCC1CC1 Amb33548306 [1,0,0,1,0,0|1,0,0]=3 8556 B7R1.7 NCCCC1CO1 Amb27816302 [1,0,0,1,0,0|1,0,0]=3 8557 B7R1.7 NCCNC1CC1 Amb13951961 [1,0,0,1,0,0|2,0,0]=4 8558 B7R1.7 NCCOC1CC1 Amb26943548 [1,0,0,1,0,0|1,0,0]=3 8559 B7R1.7 NCCOC1CC1 Amb30584692 [1,0,0,1,0,0|1,0,0]=3 8560 B7R1.7 NNCCC1CC1 Amb27806776 [1,0,0,1,0,0|2,0,0]=4 8561 B7R1.7 NOCCC1CC1 Amb28050766 [1,0,0,1,0,0|2,0,0]=4 8562 B7R1.7 NOCCC1CC1 Amb6308072 [1,0,0,1,0,0|2,0,0]=4 8563 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,2]=4 8564 B7R1.7 OCC#CC1CC1 Amb25773951 [1,0,0,1,0,0|0,0,2]=4 8565 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|0,0,0]=2 8566 B7R1.7 OCCCC1CO1 Amb28294234 [1,0,0,1,0,0|1,0,0]=3 8567 B7R1.7 OCCC[C@@H]1CO1 Amb27394788 [1,0,0,1,0,0|1,0,0]=3 8568 B7R1.7 OCCNC1CC1 Amb6251502 [1,0,0,1,0,0|1,0,0]=3 8569 B7R1.7 OCCOC1CC1 Amb26852318 [1,0,0,1,0,0|0,0,0]=2 8570 B7R1.7 OC\C=C/C1CC1 Amb33483698 [1,0,0,1,0,0|0,0,2]=4 8571 B7R1.7 OC\C=C\C1CC1 Amb26963162 [1,0,0,1,0,0|0,0,2]=4 8572 B7R1.7 ONCCC1CC1 Amb33361506 [1,0,0,1,0,0|1,0,0]=3 8573 B7R1.7 O\N=C\CC1CC1 Amb24627412 [1,0,0,1,0,0|1,0,1]=4 8574 B7R1.7 SCCCC1CC1 Amb28244922 [1,0,0,1,0,0|0,1,0]=3 8575 B7R1.7 SCCNC1CC1 Amb35639655 [1,0,0,1,0,0|1,1,0]=4 8576 B7R1.7 [C-]#[N+]CCC1CC1 Amb33428962 [1,0,0,1,0,0|2,0,0]=4 8577 B7R1.8 C#CC1CCC1O Amb33213272 [1,0,0,1,0,0|0,0,2]=4 8578 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|0,0,2]=4 8579 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [1,0,0,1,0,0|0,0,2]=4 8580 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [1,0,0,1,0,0|0,0,2]=4 8581 B7R1.8 CC1CCC1CBr Amb28076923 [1,0,0,1,0,0|1,0,0]=3 8582 B7R1.8 CC1CCC1CCl Amb28436122 [1,0,0,1,0,0|1,0,0]=3 8583 B7R1.8 CC1CCC1CI Amb27792871 [1,0,0,1,0,0|1,0,0]=3 8584 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,0]=3 8585 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,0]=2 8586 B7R1.8 CC1CCC1NO Amb27425045 [1,0,0,1,0,0|1,0,0]=3 8587 B7R1.8 CCC1CCC1=O Amb28137082 [1,0,0,1,0,0|0,0,2]=4 8588 B7R1.8 CCC1CCC1N Amb28135225 [1,0,0,1,0,0|1,0,0]=3 8589 B7R1.8 CCC1CCC1O Amb27249737 [1,0,0,1,0,0|0,0,0]=2 8590 B7R1.8 CCC1NCC1F Amb27206479 [1,0,0,1,0,0|2,0,0]=4 8591 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|0,0,2]=4 8592 B7R1.8 CC[C@@H]1CC[C@@H]1O Amb27268529 [1,0,0,1,0,0|0,0,0]=2 8593 B7R1.8 CC[C@@H]1CC[C@H]1O Amb27798172 [1,0,0,1,0,0|0,0,0]=2 8594 B7R1.8 CC[C@@H]1NC[C@@H]1N Amb25102070 [1,0,0,1,0,0|2,0,0]=4 8595 B7R1.8 CN1CCC1CI Amb27863746 [1,0,0,1,0,0|2,0,0]=4 8596 B7R1.8 CN1CCC1CN Amb25108789 [1,0,0,1,0,0|2,0,0]=4 8597 B7R1.8 CN1CCC1CN Amb30869354 [1,0,0,1,0,0|2,0,0]=4 8598 B7R1.8 CN1CCC1CO Amb27161390 [1,0,0,1,0,0|1,0,0]=3 8599 B7R1.8 CN1CC[C@@H]1CN Amb25701112 [1,0,0,1,0,0|2,0,0]=4 8600 B7R1.8 CN1CC[C@@H]1CN Amb30869360 [1,0,0,1,0,0|2,0,0]=4 8601 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|1,0,0]=3 8602 B7R1.8 CN1CC[C@H]1CN Amb25216747 [1,0,0,1,0,0|2,0,0]=4 8603 B7R1.8 CN1CC[C@H]1CN Amb33801125 [1,0,0,1,0,0|2,0,0]=4 8604 B7R1.8 CN1CC[C@H]1CO Amb28239653 [1,0,0,1,0,0|1,0,0]=3 8605 B7R1.8 CNC1CNC1C Amb27838267 [1,0,0,1,0,0|2,0,0]=4 8606 B7R1.8 COC1CCC1N Amb25880007 [1,0,0,1,0,0|2,0,0]=4 8607 B7R1.8 COC1CCC1N Amb32661633 [1,0,0,1,0,0|2,0,0]=4 8608 B7R1.8 COC1CCC1S Amb32788446 [1,0,0,1,0,0|1,1,0]=4 8609 B7R1.8 CO[C@@H]1CC[C@@H]1N Amb33495619 [1,0,0,1,0,0|2,0,0]=4 8610 B7R1.8 CO[C@@H]1CC[C@@H]1N Amb34154243 [1,0,0,1,0,0|2,0,0]=4 8611 B7R1.8 CO[C@@H]1CC[C@H]1Br Amb35752255 [1,0,0,1,0,0|2,0,0]=4 8612 B7R1.8 CO[C@@H]1CC[C@H]1N Amb25026007 [1,0,0,1,0,0|2,0,0]=4 8613 B7R1.8 CO[C@@H]1CC[C@H]1N Amb31245819 [1,0,0,1,0,0|2,0,0]=4 8614 B7R1.8 CO[C@@H]1CC[C@H]1O Amb33495612 [1,0,0,1,0,0|1,0,0]=3 8615 B7R1.8 C[C@@H]1CC[C@@H]1CBr Amb27484113 [1,0,0,1,0,0|1,0,0]=3 8616 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [1,0,0,1,0,0|0,0,2]=4 8617 B7R1.8 C[C@@H]1CC[C@H]1CBr Amb27424101 [1,0,0,1,0,0|1,0,0]=3 8618 B7R1.8 C[C@H]1CC[C@H]1CBr Amb28429571 [1,0,0,1,0,0|1,0,0]=3 8619 B7R1.8 C[C@H]1CC[C@H]1CCl Amb28387678 [1,0,0,1,0,0|1,0,0]=3 8620 B7R1.8 C[C@H]1CC[C@H]1CO Amb27196739 [1,0,0,1,0,0|0,0,0]=2 8621 B7R1.8 C\C=C1\CCC1O Amb27595035 [1,0,0,1,0,0|0,0,2]=4 8622 B7R1.8 FC1CCC1CBr Amb32943807 [1,0,0,1,0,0|2,0,0]=4 8623 B7R1.8 FC1CCC1CCl Amb32943728 [1,0,0,1,0,0|2,0,0]=4 8624 B7R1.8 NC1CCC1CS Amb27876457 [1,0,0,1,0,0|1,1,0]=4 8625 B7R1.8 NCC1CCC1F Amb32943628 [1,0,0,1,0,0|2,0,0]=4 8626 B7R1.8 NCC1CCC1F Amb33719051 [1,0,0,1,0,0|2,0,0]=4 8627 B7R1.8 NC[C@@H]1CC[C@H]1S Amb28057745 [1,0,0,1,0,0|1,1,0]=4 8628 B7R1.8 NNC1CCC1O Amb33231703 [1,0,0,1,0,0|2,0,0]=4 8629 B7R1.8 N[C@@H]1CC[C@H]1CS Amb27629684 [1,0,0,1,0,0|1,1,0]=4 8630 B7R1.8 N[C@H]1CC[C@H]1CO Amb25327109 [1,0,0,1,0,0|1,0,0]=3 8631 B7R1.8 O=C1CCC1CO Amb24722181 [1,0,0,1,0,0|1,0,1]=4 8632 B7R1.8 OCC1CCC1F Amb32943809 [1,0,0,1,0,0|1,0,0]=3 8633 B7R1.8 OCC1CCC1O Amb26956761 [1,0,0,1,0,0|1,0,0]=3 8634 B7R1.8 OCC1NC[C@@H]1O Amb27265630 [1,0,0,1,0,0|2,0,0]=4 8635 B7R1.8 OC[C@@H]1CC[C@H]1O Amb34160319 [1,0,0,1,0,0|1,0,0]=3 8636 B7R1.8 OC[C@H]1CC[C@H]1O Amb25662759 [1,0,0,1,0,0|1,0,0]=3 8637 B7R1.8 OC[C@H]1NC[C@H]1O Amb28383856 [1,0,0,1,0,0|2,0,0]=4 8638 B7R1.8 OC[C@H]1SC[C@@H]1O Amb28136441 [1,0,0,1,0,0|1,1,0]=4 8639 B7R1.8 OC[C@H]1SC[C@H]1O Amb27195387 [1,0,0,1,0,0|1,1,0]=4 8640 B7R1.9 C#CC1CC1CO Amb26398150 [1,0,0,1,0,0|0,0,2]=4 8641 B7R1.9 C#C[C@@H]1C[C@@H]1CO Amb32663598 [1,0,0,1,0,0|0,0,2]=4 8642 B7R1.9 C#C[C@@H]1C[C@H]1CO Amb27782579 [1,0,0,1,0,0|0,0,2]=4 8643 B7R1.9 C#C[C@H]1C[C@H]1CO Amb25875636 [1,0,0,1,0,0|0,0,2]=4 8644 B7R1.9 C=C[C@@H]1C[C@H]1CO Amb27481145 [1,0,0,1,0,0|0,0,2]=4 8645 B7R1.9 C=C[C@@H]1O[C@H]1CO Amb27255222 [1,0,0,1,0,0|0,0,2]=4 8646 B7R1.9 C=C[C@H]1O[C@@H]1CO Amb27202389 [1,0,0,1,0,0|0,0,2]=4 8647 B7R1.9 C=C[C@H]1O[C@H]1CO Amb28061903 [1,0,0,1,0,0|0,0,2]=4 8648 B7R1.9 CCC1=C(CO)C1 Amb28365928 [1,0,0,1,0,0|0,0,2]=4 8649 B7R1.9 CCC1CC1C#N Amb28284190 [1,0,0,1,0,0|1,0,1]=4 8650 B7R1.9 CCC1CC1CBr Amb28050452 [1,0,0,1,0,0|1,0,0]=3 8651 B7R1.9 CCC1CC1CC Amb27445028 [1,0,0,1,0,0|1,0,0]=3 8652 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,0]=3 8653 B7R1.9 CCC1CC1CN Amb32662776 [1,0,0,1,0,0|1,0,0]=3 8654 B7R1.9 CCC1OC1CBr Amb28385701 [1,0,0,1,0,0|1,0,0]=3 8655 B7R1.9 CCC1OC1CC Amb27407235 [1,0,0,1,0,0|1,0,0]=3 8656 B7R1.9 CCN1CN1CC Amb27228092 [1,0,0,1,0,0|2,0,0]=4 8657 B7R1.9 CC[C@@H]1C[C@@H]1C=O Amb28142393 [1,0,0,1,0,0|0,0,2]=4 8658 B7R1.9 CC[C@@H]1C[C@@H]1CN Amb34916256 [1,0,0,1,0,0|1,0,0]=3 8659 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,0]=2 8660 B7R1.9 CC[C@@H]1C[C@H]1C#N Amb28284782 [1,0,0,1,0,0|1,0,1]=4 8661 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,0]=3 8662 B7R1.9 CC[C@@H]1C[C@H]1CCl Amb28284868 [1,0,0,1,0,0|1,0,0]=3 8663 B7R1.9 CC[C@@H]1C[C@H]1CN Amb26431153 [1,0,0,1,0,0|1,0,0]=3 8664 B7R1.9 CC[C@@H]1C[C@H]1CN Amb28920814 [1,0,0,1,0,0|1,0,0]=3 8665 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,0]=2 8666 B7R1.9 CC[C@@H]1O[C@@H]1C=O Amb27640580 [1,0,0,1,0,0|0,0,2]=4 8667 B7R1.9 CC[C@@H]1O[C@@H]1CO Amb28198173 [1,0,0,1,0,0|0,0,0]=2 8668 B7R1.9 CC[C@H]1C[C@H]1CC Amb27391419 [1,0,0,1,0,0|1,0,0]=3 8669 B7R1.9 CC[S+]1CC1CO Amb27970929 [1,0,0,1,0,0|1,0,0]=3 8670 B7R1.9 CNC1CC1CO Amb27838268 [1,0,0,1,0,0|1,0,0]=3 8671 B7R1.9 COC1CC1CBr Amb35732114 [1,0,0,1,0,0|2,0,0]=4 8672 B7R1.9 COC1CC1CCl Amb29849443 [1,0,0,1,0,0|2,0,0]=4 8673 B7R1.9 COC1CC1CN Amb35683740 [1,0,0,1,0,0|2,0,0]=4 8674 B7R1.9 COC1CC1CO Amb28137240 [1,0,0,1,0,0|1,0,0]=3 8675 B7R1.9 CO[C@H]1C[C@@H]1CO Amb27632061 [1,0,0,1,0,0|1,0,0]=3 8676 B7R1.9 ClCC1OC1CCl Amb24349733 [1,0,0,1,0,0|2,0,0]=4 8677 B7R1.9 ClC[C@@H]1C[C@H]1CCl Amb27216836 [1,0,0,1,0,0|2,0,0]=4 8678 B7R1.9 ClC[C@H]1C[C@H]1CCl Amb24117131 [1,0,0,1,0,0|2,0,0]=4 8679 B7R1.9 ClC[C@H]1O[C@@H]1CCl Amb27629678 [1,0,0,1,0,0|2,0,0]=4 8680 B7R1.9 ClC[C@H]1O[C@H]1CCl Amb27602221 [1,0,0,1,0,0|2,0,0]=4 8681 B7R1.9 N#CC1CC1CO Amb22755200 [1,0,0,1,0,0|1,0,1]=4 8682 B7R1.9 N#C[C@@H]1C[C@H]1CO Amb26406188 [1,0,0,1,0,0|1,0,1]=4 8683 B7R1.9 N#C[C@@H]1O[C@H]1CO Amb27213791 [1,0,0,1,0,0|1,0,1]=4 8684 B7R1.9 N#C[C@H]1CC1CO Amb28194155 [1,0,0,1,0,0|1,0,1]=4 8685 B7R1.9 N#C[C@H]1C[C@H]1CO Amb28059819 [1,0,0,1,0,0|1,0,1]=4 8686 B7R1.9 NCC1CC1CF Amb26602214 [1,0,0,1,0,0|2,0,0]=4 8687 B7R1.9 NCC1CC1CO Amb22499310 [1,0,0,1,0,0|1,0,0]=3 8688 B7R1.9 NC[C@@H]1C[C@@H]1CO Amb22746714 [1,0,0,1,0,0|1,0,0]=3 8689 B7R1.9 NC[C@@H]1C[C@H]1CO Amb22746972 [1,0,0,1,0,0|1,0,0]=3 8690 B7R1.9 NC[C@H]1C[C@@H]1CO Amb22224716 [1,0,0,1,0,0|1,0,0]=3 8691 B7R1.9 NC[C@H]1C[C@H]1CO Amb25217566 [1,0,0,1,0,0|1,0,0]=3 8692 B7R1.9 OCC1CC1CBr Amb27831384 [1,0,0,1,0,0|1,0,0]=3 8693 B7R1.9 OCC1CC1CCl Amb27965811 [1,0,0,1,0,0|1,0,0]=3 8694 B7R1.9 OCC1CC1CO Amb27172961 [1,0,0,1,0,0|1,0,0]=3 8695 B7R1.9 OCC1OC1CCl Amb27838280 [1,0,0,1,0,0|1,0,0]=3 8696 B7R1.9 OCC1OC1CO Amb27397134 [1,0,0,1,0,0|1,0,0]=3 8697 B7R1.9 OC[C@@H]1O[C@H]1CO Amb27853304 [1,0,0,1,0,0|1,0,0]=3 8698 B7R1.9 OC[C@H]1C[C@H]1CO Amb28193489 [1,0,0,1,0,0|1,0,0]=3 8699 B7R1.24 C1=CCCCCC1 Amb8515344 [1,0,0,1,0,0|1,0,1]=4 8700 B7R1.24 C1=CCOCOC1 Amb6600543 [1,0,0,1,0,0|0,0,2]=4 8701 B7R1.24 C1=COCCCC1 Amb28254269 [1,0,0,1,0,0|0,0,2]=4 8702 B7R1.24 C1=NCCCCC1 Amb27445210 [1,0,0,1,0,0|1,0,1]=4 8703 B7R1.24 C1CCCNCC1 Amb2792842 [1,0,0,1,0,0|1,0,0]=3 8704 B7R1.24 C1CCCOCC1 Amb22045221 [1,0,0,1,0,0|0,0,0]=2 8705 B7R1.24 C1CCNNCC1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 8706 B7R1.24 C1CCNOCC1 Amb28769693 [1,0,0,1,0,0|1,0,0]=3 8707 B7R1.24 C1CCSCSC1 Amb22227736 [1,0,0,1,0,0|0,2,0]=4 8708 B7R1.24 C1CNCCNC1 Amb2688726 [1,0,0,1,0,0|2,0,0]=4 8709 B7R1.24 C1CNCCNC1 Amb29844598 [1,0,0,1,0,0|2,0,0]=4 8710 B7R1.24 C1CNCCOC1 Amb19889085 [1,0,0,1,0,0|1,0,0]=3 8711 B7R1.24 C1CNCCOC1 Amb7094907 [1,0,0,1,0,0|1,0,0]=3 8712 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|1,1,0]=4 8713 B7R1.24 C1CNCCSC1 Amb9176341 [1,0,0,1,0,0|1,1,0]=4 8714 B7R1.24 C1COCCNN1 Amb18559514 [1,0,0,1,0,0|2,0,0]=4 8715 B7R1.24 C1COCCNN1 Amb22728775 [1,0,0,1,0,0|2,0,0]=4 8716 B7R1.24 C1COCCNN1 Amb22739942 [1,0,0,1,0,0|2,0,0]=4 8717 B7R1.24 C1COCCON1 Amb28071736 [1,0,0,1,0,0|1,0,0]=3 8718 B7R1.24 C1COCCON1 Amb32650187 [1,0,0,1,0,0|1,0,0]=3 8719 B7R1.24 C1CSSCCO1 Amb10565588 [1,0,0,1,0,0|1,1,0]=4 8720 B9R1.2 C#C[C@@H]1OCC[C@H](C)O1 Amb25248581 [0,1,0,1,0,0|1,0,1]=4 8721 B9R1.2 C=C[C@@H]1C[C@@H](N)CCO1 Amb33456873 [0,1,0,1,0,0|1,0,1]=4 8722 B9R1.2 CC1=CCO[C@H](CO)C1 Amb27980482 [0,1,0,1,0,0|0,0,2]=4 8723 B9R1.2 CC1CC(CO)CCN1 Amb25921106 [0,1,0,1,0,0|2,0,0]=4 8724 B9R1.2 CC1CC(CO)CCN1 Amb32653256 [0,1,0,1,0,0|2,0,0]=4 8725 B9R1.2 CC1CC(CO)CCO1 Amb24679585 [0,1,0,1,0,0|2,0,0]=4 8726 B9R1.2 CC1CCCC(C=O)O1 Amb27956485 [0,1,0,1,0,0|0,0,2]=4 8727 B9R1.2 CC1CCCC(CBr)C1 Amb22059638 [0,1,0,1,0,0|2,0,0]=4 8728 B9R1.2 CC1CCCC(CBr)O1 Amb28341224 [0,1,0,1,0,0|1,0,0]=3 8729 B9R1.2 CC1CCCC(CCl)C1 Amb27664585 [0,1,0,1,0,0|2,0,0]=4 8730 B9R1.2 CC1CCCC(CI)C1 Amb28128033 [0,1,0,1,0,0|2,0,0]=4 8731 B9R1.2 CC1CCCC(CI)O1 Amb27236991 [0,1,0,1,0,0|1,0,0]=3 8732 B9R1.2 CC1CCCC(CN)C1 Amb8950171 [0,1,0,1,0,0|2,0,0]=4 8733 B9R1.2 CC1CCCC(CN)N1 Amb25930766 [0,1,0,1,0,0|2,0,0]=4 8734 B9R1.2 CC1CCCC(CN)O1 Amb25940618 [0,1,0,1,0,0|1,0,0]=3 8735 B9R1.2 CC1CCCC(CO)C1 Amb20248640 [0,1,0,1,0,0|1,0,0]=3 8736 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [0,1,0,1,0,0|1,0,0]=3 8737 B9R1.2 CC1CCCC(CS)C1 Amb26505263 [0,1,0,1,0,0|1,1,0]=4 8738 B9R1.2 CC1CCCC(NO)C1 Amb27436769 [0,1,0,1,0,0|2,0,0]=4 8739 B9R1.2 CC1CCNC(CN)C1 Amb25851909 [0,1,0,1,0,0|2,0,0]=4 8740 B9R1.2 CC1CCNC(CO)=N1 Amb27246454 [0,1,0,1,0,0|1,0,1]=4 8741 B9R1.2 CC1CCNC(CO)C1 Amb24571948 [0,1,0,1,0,0|1,0,0]=3 8742 B9R1.2 CC1CCNC(CO)C1 Amb32668395 [0,1,0,1,0,0|1,0,0]=3 8743 B9R1.2 CC1CCOC(C=O)C1 Amb25032291 [0,1,0,1,0,0|0,0,2]=4 8744 B9R1.2 CC1CCOC(CBr)O1 Amb25684844 [0,1,0,1,0,0|1,0,0]=3 8745 B9R1.2 CC1CCOC(CCl)O1 Amb27751472 [0,1,0,1,0,0|1,0,0]=3 8746 B9R1.2 CC1CNCC(CF)O1 Amb32655180 [0,1,0,1,0,0|2,0,0]=4 8747 B9R1.2 CC1CNCC(CO)C1 Amb24554370 [0,1,0,1,0,0|2,0,0]=4 8748 B9R1.2 CC1CNCC(CO)O1 Amb25139435 [0,1,0,1,0,0|1,0,0]=3 8749 B9R1.2 CC1COCC(CI)O1 Amb32945859 [0,1,0,1,0,0|1,0,0]=3 8750 B9R1.2 CC1COCC(CN)O1 Amb32945895 [0,1,0,1,0,0|1,0,0]=3 8751 B9R1.2 CC1COCC(CS)N1 Amb24523149 [0,1,0,1,0,0|2,0,0]=4 8752 B9R1.2 CC1CSCC(CO)O1 Amb27969010 [0,1,0,1,0,0|1,0,0]=3 8753 B9R1.2 CCC1=CC(O)CNC1 Amb32989172 [0,1,0,1,0,0|1,0,1]=4 8754 B9R1.2 CCC1=C[C@H](O)CCC1 Amb28064187 [0,1,0,1,0,0|1,0,1]=4 8755 B9R1.2 CCC1CC(=O)CCN1 Amb24589388 [0,1,0,1,0,0|2,0,0]=4 8756 B9R1.2 CCC1CC(=O)CCO1 Amb19373926 [0,1,0,1,0,0|1,0,0]=3 8757 B9R1.2 CCC1CC(=O)CCS1 Amb27838781 [0,1,0,1,0,0|1,1,0]=4 8758 B9R1.2 CCC1CC(C)CCN1 Amb27263401 [0,1,0,1,0,0|2,0,0]=4 8759 B9R1.2 CCC1CC(Cl)CCO1 Amb28458111 [0,1,0,1,0,0|1,0,0]=3 8760 B9R1.2 CCC1CC(N)CCN1 Amb25320367 [0,1,0,1,0,0|2,0,0]=4 8761 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|1,0,0]=3 8762 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|1,0,0]=3 8763 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|1,0,0]=3 8764 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [0,1,0,1,0,0|2,0,0]=4 8765 B9R1.2 CCC1CCCC(=O)O1 Amb27242548 [0,1,0,1,0,0|1,0,1]=4 8766 B9R1.2 CCC1CCCC(C)C1 Amb27267046 [0,1,0,1,0,0|2,0,0]=4 8767 B9R1.2 CCC1CCCC(C)N1 Amb25146110 [0,1,0,1,0,0|2,0,0]=4 8768 B9R1.2 CCC1CCCC(N)C1 Amb19374220 [0,1,0,1,0,0|2,0,0]=4 8769 B9R1.2 CCC1CCCC(O)C1 Amb17593352 [0,1,0,1,0,0|1,0,0]=3 8770 B9R1.2 CCC1CCCC(S)C1 Amb25861249 [0,1,0,1,0,0|1,1,0]=4 8771 B9R1.2 CCC1CCCN(N)C1 Amb25974186 [0,1,0,1,0,0|2,0,0]=4 8772 B9R1.2 CCC1CCNC(C)O1 Amb33193375 [0,1,0,1,0,0|2,0,0]=4 8773 B9R1.2 CCC1CCOC(O)C1 Amb28049146 [0,1,0,1,0,0|2,0,0]=4 8774 B9R1.2 CCC1CN(C)CCN1 Amb18832590 [0,1,0,1,0,0|2,0,0]=4 8775 B9R1.2 CCC1CN(N)CCO1 Amb28345010 [0,1,0,1,0,0|1,0,0]=3 8776 B9R1.2 CCC1CNCC(C)C1 Amb24477764 [0,1,0,1,0,0|2,0,0]=4 8777 B9R1.2 CCC1CNCC(C)N1 Amb26512115 [0,1,0,1,0,0|2,0,0]=4 8778 B9R1.2 CCC1CNCC(C)O1 Amb9028109 [0,1,0,1,0,0|1,0,0]=3 8779 B9R1.2 CCC1CNCC(C)S1 Amb26033062 [0,1,0,1,0,0|1,1,0]=4 8780 B9R1.2 CCC1CNCC(N)C1 Amb33275585 [0,1,0,1,0,0|2,0,0]=4 8781 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,1,0,0|0,0,2]=4 8782 B9R1.2 CCC1COCC(C)N1 Amb18063152 [0,1,0,1,0,0|1,0,0]=3 8783 B9R1.2 CCC1COCC(O)O1 Amb27845038 [0,1,0,1,0,0|0,0,0]=2 8784 B9R1.2 CCC1CS(=O)CCN1 Amb27424706 [0,1,0,1,0,0|1,1,0]=4 8785 B9R1.2 CCC1NC(C)CCO1 Amb33194316 [0,1,0,1,0,0|1,0,0]=3 8786 B9R1.2 CCC1NCCC(C)O1 Amb33193306 [0,1,0,1,0,0|2,0,0]=4 8787 B9R1.2 CCC1NCCC(C)S1 Amb27792488 [0,1,0,1,0,0|2,0,0]=4 8788 B9R1.2 CCN1CCCC(O)C1 Amb9703152 [0,1,0,1,0,0|2,0,0]=4 8789 B9R1.2 CCN1CCC[C@@H](O)C1 Amb27949660 [0,1,0,1,0,0|2,0,0]=4 8790 B9R1.2 CCN1CCC[C@H](O)C1 Amb28049184 [0,1,0,1,0,0|2,0,0]=4 8791 B9R1.2 CC[C@@H]1CCC[C@@H](C)N1 Amb27216626 [0,1,0,1,0,0|2,0,0]=4 8792 B9R1.2 CC[C@@H]1CCC[C@@H](O)C1 Amb28319548 [0,1,0,1,0,0|1,0,0]=3 8793 B9R1.2 CC[C@@H]1CCC[C@H](C)N1 Amb24562231 [0,1,0,1,0,0|2,0,0]=4 8794 B9R1.2 CC[C@@H]1CCC[C@H](O)C1 Amb27491475 [0,1,0,1,0,0|1,0,0]=3 8795 B9R1.2 CC[C@@H]1CNC[C@H](C)N1 Amb28904227 [0,1,0,1,0,0|2,0,0]=4 8796 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,1,0,0|0,0,2]=4 8797 B9R1.2 CC[C@@H]1C[C@@H](O)CCN1 Amb32434781 [0,1,0,1,0,0|2,0,0]=4 8798 B9R1.2 CC[C@@H]1C[C@H](N)CCO1 Amb27248320 [0,1,0,1,0,0|1,0,0]=3 8799 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb27460205 [0,1,0,1,0,0|2,0,0]=4 8800 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb32434779 [0,1,0,1,0,0|2,0,0]=4 8801 B9R1.2 CC[C@H]1CCCC(O)O1 Amb27180648 [0,1,0,1,0,0|1,0,0]=3 8802 B9R1.2 CC[C@H]1CCC[C@@H](C)N1 Amb32667683 [0,1,0,1,0,0|2,0,0]=4 8803 B9R1.2 CC[C@H]1CCC[C@H](O)C1 Amb28207111 [0,1,0,1,0,0|1,0,0]=3 8804 B9R1.2 CC[C@H]1COC[C@H](C)N1 Amb27781190 [0,1,0,1,0,0|1,0,0]=3 8805 B9R1.2 CC[C@H]1C[C@H](O)CCS1 Amb27451909 [0,1,0,1,0,0|1,1,0]=4 8806 B9R1.2 CN1CCCC(CO)C1 Amb615876 [0,1,0,1,0,0|2,0,0]=4 8807 B9R1.2 CN1CCC[C@@H](CO)C1 Amb10068404 [0,1,0,1,0,0|2,0,0]=4 8808 B9R1.2 CN1CCC[C@H](CO)C1 Amb10068405 [0,1,0,1,0,0|2,0,0]=4 8809 B9R1.2 CN1CCNC(CO)C1 Amb15701335 [0,1,0,1,0,0|2,0,0]=4 8810 B9R1.2 CN1CCNC(CO)C1 Amb34160885 [0,1,0,1,0,0|2,0,0]=4 8811 B9R1.2 CN1CCN[C@H](CO)C1 Amb26439454 [0,1,0,1,0,0|2,0,0]=4 8812 B9R1.2 CN1CCOC(CBr)C1 Amb23450046 [0,1,0,1,0,0|2,0,0]=4 8813 B9R1.2 CN1CCOC(CBr)C1 Amb33069673 [0,1,0,1,0,0|2,0,0]=4 8814 B9R1.2 CN1CCOC(CCl)C1 Amb13952422 [0,1,0,1,0,0|2,0,0]=4 8815 B9R1.2 CN1CCOC(CF)C1 Amb32655177 [0,1,0,1,0,0|2,0,0]=4 8816 B9R1.2 CN1CCOC(CN)C1 Amb1080933 [0,1,0,1,0,0|2,0,0]=4 8817 B9R1.2 CN1CCOC(CN)C1 Amb22587154 [0,1,0,1,0,0|2,0,0]=4 8818 B9R1.2 CN1CCOC(CN)C1 Amb22886187 [0,1,0,1,0,0|2,0,0]=4 8819 B9R1.2 CN1CCOC(CO)C1 Amb15692185 [0,1,0,1,0,0|1,0,0]=3 8820 B9R1.2 CN1CCOC(CS)C1 Amb24478675 [0,1,0,1,0,0|1,1,0]=4 8821 B9R1.2 CN1CCO[C@@H](CN)C1 Amb25721466 [0,1,0,1,0,0|2,0,0]=4 8822 B9R1.2 CN1CCO[C@@H](CO)C1 Amb27607243 [0,1,0,1,0,0|1,0,0]=3 8823 B9R1.2 CN1CCO[C@H](CN)C1 Amb22747950 [0,1,0,1,0,0|2,0,0]=4 8824 B9R1.2 CN1CCO[C@H](CO)C1 Amb27827671 [0,1,0,1,0,0|1,0,0]=3 8825 B9R1.2 CNC1CCCC(O)C1 Amb18642723 [0,1,0,1,0,0|2,0,0]=4 8826 B9R1.2 CNC1CCC[C@@H](O)C1 Amb28051135 [0,1,0,1,0,0|2,0,0]=4 8827 B9R1.2 CNC1CN(C)CCO1 Amb24477845 [0,1,0,1,0,0|2,0,0]=4 8828 B9R1.2 CN[C@@H]1CCC[C@@H](O)C1 Amb27463767 [0,1,0,1,0,0|2,0,0]=4 8829 B9R1.2 CN[C@@H]1C[C@H](C)CCO1 Amb27964629 [0,1,0,1,0,0|2,0,0]=4 8830 B9R1.2 COC1CCCC(O)C1 Amb13951102 [0,1,0,1,0,0|2,0,0]=4 8831 B9R1.2 COC1CCCC(O)O1 Amb27613906 [0,1,0,1,0,0|2,0,0]=4 8832 B9R1.2 COC1CNCC(O)C1 Amb35746222 [0,1,0,1,0,0|2,0,0]=4 8833 B9R1.2 COC1CNCC(O)C1 Amb35750373 [0,1,0,1,0,0|2,0,0]=4 8834 B9R1.2 CO[C@@H]1CCC[C@@H](O)C1 Amb27843394 [0,1,0,1,0,0|2,0,0]=4 8835 B9R1.2 CO[C@@H]1CCC[C@H](O)C1 Amb26575107 [0,1,0,1,0,0|2,0,0]=4 8836 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 Amb25271471 [0,1,0,1,0,0|2,0,0]=4 8837 B9R1.2 CO[C@H]1CCC[C@H](O)C1 Amb27969202 [0,1,0,1,0,0|2,0,0]=4 8838 B9R1.2 CO[C@H]1CNC[C@H](O)C1 Amb35752798 [0,1,0,1,0,0|2,0,0]=4 8839 B9R1.2 CO[C@H]1CNC[C@H](O)C1 Amb35753121 [0,1,0,1,0,0|2,0,0]=4 8840 B9R1.2 CO[C@H]1C[C@@H](O)CCO1 Amb28196888 [0,1,0,1,0,0|2,0,0]=4 8841 B9R1.2 CSC1CCCC(O)C1 Amb28315413 [0,1,0,1,0,0|2,0,0]=4 8842 B9R1.2 C[C@@H]1CCCC(CO)N1 Amb27413400 [0,1,0,1,0,0|1,0,0]=3 8843 B9R1.2 C[C@@H]1CCC[C@@H](CO)O1 Amb27213296 [0,1,0,1,0,0|0,0,0]=2 8844 B9R1.2 C[C@@H]1CCC[C@H](CN)N1 Amb32675684 [0,1,0,1,0,0|2,0,0]=4 8845 B9R1.2 C[C@@H]1CCC[C@H](CN)N1 Amb35751635 [0,1,0,1,0,0|2,0,0]=4 8846 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [0,1,0,1,0,0|1,0,0]=3 8847 B9R1.2 C[C@@H]1CCN[C@H](CN)C1 Amb29858262 [0,1,0,1,0,0|2,0,0]=4 8848 B9R1.2 C[C@@H]1CCO[C@@H](CBr)O1 Amb27444652 [0,1,0,1,0,0|1,0,0]=3 8849 B9R1.2 C[C@@H]1CCO[C@@H](CO)C1 Amb28142359 [0,1,0,1,0,0|0,0,0]=2 8850 B9R1.2 C[C@@H]1CCO[C@H](CBr)O1 Amb27794280 [0,1,0,1,0,0|1,0,0]=3 8851 B9R1.2 C[C@@H]1CNC[C@@H](CO)O1 Amb24682877 [0,1,0,1,0,0|1,0,0]=3 8852 B9R1.2 C[C@@H]1CNC[C@@H](CO)O1 Amb33677246 [0,1,0,1,0,0|1,0,0]=3 8853 B9R1.2 C[C@@H]1CNC[C@H](CO)O1 Amb33677245 [0,1,0,1,0,0|1,0,0]=3 8854 B9R1.2 C[C@@H]1COCC(CS)N1 Amb24582979 [0,1,0,1,0,0|2,0,0]=4 8855 B9R1.2 C[C@@H]1COC[C@H](CO)O1 Amb27853934 [0,1,0,1,0,0|1,0,0]=3 8856 B9R1.2 C[C@@H]1C[C@@H](CO)CCO1 Amb33484246 [0,1,0,1,0,0|2,0,0]=4 8857 B9R1.2 C[C@@H]1C[C@H](CO)CCN1 Amb26849936 [0,1,0,1,0,0|2,0,0]=4 8858 B9R1.2 C[C@@H]1C[C@H](CO)CCN1 Amb32653271 [0,1,0,1,0,0|2,0,0]=4 8859 B9R1.2 C[C@@H]1C[C@H](CO)OCO1 Amb27420526 [0,1,0,1,0,0|1,0,0]=3 8860 B9R1.2 C[C@@H]1OCC[C@H](CO)O1 Amb27448605 [0,1,0,1,0,0|1,0,0]=3 8861 B9R1.2 C[C@H]1CCN[C@@H](CN)C1 Amb32665434 [0,1,0,1,0,0|2,0,0]=4 8862 B9R1.2 C[C@H]1CCN[C@@H](CO)C1 Amb28429761 [0,1,0,1,0,0|1,0,0]=3 8863 B9R1.2 C[C@H]1CCN[C@@H](CO)C1 Amb32668515 [0,1,0,1,0,0|1,0,0]=3 8864 B9R1.2 C[C@H]1CCOC(C=O)C1 Amb26406399 [0,1,0,1,0,0|0,0,2]=4 8865 B9R1.2 C[C@H]1CCO[C@H](C=O)C1 Amb25914480 [0,1,0,1,0,0|0,0,2]=4 8866 B9R1.2 C[C@H]1CNC[C@@H](CO)O1 Amb24549804 [0,1,0,1,0,0|1,0,0]=3 8867 B9R1.2 C[C@H]1CNC[C@@H](CO)O1 Amb33299353 [0,1,0,1,0,0|1,0,0]=3 8868 B9R1.2 C[C@H]1CSC[C@@H](CO)O1 Amb27775963 [0,1,0,1,0,0|1,0,0]=3 8869 B9R1.2 C[C@H]1C[C@@H](CO)CCN1 Amb24558717 [0,1,0,1,0,0|2,0,0]=4 8870 B9R1.2 C[C@H]1C[C@@H](CO)CCN1 Amb28577880 [0,1,0,1,0,0|2,0,0]=4 8871 B9R1.2 FC1CCCC(CBr)C1 Amb27879072 [0,1,0,1,0,0|2,0,0]=4 8872 B9R1.2 FC1CCCC(CCl)C1 Amb32943617 [0,1,0,1,0,0|2,0,0]=4 8873 B9R1.2 NC1CCCC(CO)C1 Amb33532803 [0,1,0,1,0,0|1,0,0]=3 8874 B9R1.2 NC1CCCC(NO)C1 Amb28046309 [0,1,0,1,0,0|2,0,0]=4 8875 B9R1.2 NC1CCOC(CO)C1 Amb25953682 [0,1,0,1,0,0|0,0,0]=2 8876 B9R1.2 NCC1CCCC(Br)C1 Amb26472114 [0,1,0,1,0,0|2,0,0]=4 8877 B9R1.2 NCC1CCCC(Cl)C1 Amb27768829 [0,1,0,1,0,0|2,0,0]=4 8878 B9R1.2 NCC1CCCC(F)C1 Amb26613805 [0,1,0,1,0,0|2,0,0]=4 8879 B9R1.2 NCC1CCCC(F)C1 Amb28555389 [0,1,0,1,0,0|2,0,0]=4 8880 B9R1.2 NCC1CCCC(N)C1 Amb16233731 [0,1,0,1,0,0|2,0,0]=4 8881 B9R1.2 NCC1CCCC(O)C1 Amb9782617 [0,1,0,1,0,0|2,0,0]=4 8882 B9R1.2 NCC1CCCC(S)C1 Amb32788397 [0,1,0,1,0,0|2,0,0]=4 8883 B9R1.2 NCC1CNCC(O)C1 Amb32685179 [0,1,0,1,0,0|2,0,0]=4 8884 B9R1.2 NC[C@@H]1CCC[C@@H](N)C1 Amb26921446 [0,1,0,1,0,0|2,0,0]=4 8885 B9R1.2 NC[C@@H]1C[C@H](O)CCO1 Amb32904240 [0,1,0,1,0,0|1,0,0]=3 8886 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 Amb25973785 [0,1,0,1,0,0|1,0,0]=3 8887 B9R1.2 N[C@@H]1CCC[C@H](CO)C1 Amb27791190 [0,1,0,1,0,0|1,0,0]=3 8888 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb23385323 [0,1,0,1,0,0|1,0,0]=3 8889 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb30526953 [0,1,0,1,0,0|1,0,0]=3 8890 B9R1.2 N[C@H]1CCC[C@H](CO)C1 Amb28399575 [0,1,0,1,0,0|1,0,0]=3 8891 B9R1.2 N[C@H]1CCO[C@@H](CO)C1 Amb25912608 [0,1,0,1,0,0|0,0,0]=2 8892 B9R1.2 N[C@H]1CSC[C@@H](CO)C1 Amb27787680 [0,1,0,1,0,0|2,0,0]=4 8893 B9R1.2 O=C1CCCC(CBr)O1 Amb28325542 [0,1,0,1,0,0|1,0,1]=4 8894 B9R1.2 O=C1CCCC(CO)C1 Amb16231079 [0,1,0,1,0,0|1,0,1]=4 8895 B9R1.2 O=C1CCCC(CO)N1 Amb13886257 [0,1,0,1,0,0|1,0,1]=4 8896 B9R1.2 O=C1CCCC(CO)O1 Amb27980552 [0,1,0,1,0,0|0,0,1]=3 8897 B9R1.2 O=C1CCC[C@@H](CO)C1 Amb26479307 [0,1,0,1,0,0|1,0,1]=4 8898 B9R1.2 O=C1CCC[C@H](CO)N1 Amb25187085 [0,1,0,1,0,0|1,0,1]=4 8899 B9R1.2 OC1CCCC(CBr)C1 Amb26885621 [0,1,0,1,0,0|2,0,0]=4 8900 B9R1.2 OC1CCCC(CCl)C1 Amb25342173 [0,1,0,1,0,0|2,0,0]=4 8901 B9R1.2 OCC1=CC(O)CCC1 Amb28315569 [0,1,0,1,0,0|1,0,1]=4 8902 B9R1.2 OCC1CC(O)C=CO1 Amb27185678 [0,1,0,1,0,0|0,0,2]=4 8903 B9R1.2 OCC1CC(O)CCO1 Amb28197542 [0,1,0,1,0,0|0,0,0]=2 8904 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [0,1,0,1,0,0|1,0,0]=3 8905 B9R1.2 OCC1CCCC(O)O1 Amb27835913 [0,1,0,1,0,0|0,0,0]=2 8906 B9R1.2 OCC1CNCC(F)C1 Amb13889103 [0,1,0,1,0,0|2,0,0]=4 8907 B9R1.2 OCC1CNCC(F)C1 Amb22886258 [0,1,0,1,0,0|2,0,0]=4 8908 B9R1.2 OCC1CNCC(O)C1 Amb27199658 [0,1,0,1,0,0|2,0,0]=4 8909 B9R1.2 OC[C@@H]1CCC[C@@H](O)C1 Amb28076813 [0,1,0,1,0,0|1,0,0]=3 8910 B9R1.2 OC[C@@H]1CCC[C@@H](O)O1 Amb27978435 [0,1,0,1,0,0|0,0,0]=2 8911 B9R1.2 OC[C@@H]1CCC[C@H](O)C1 Amb28344623 [0,1,0,1,0,0|1,0,0]=3 8912 B9R1.2 OC[C@@H]1C[C@@H](O)C=CO1 Amb27969105 [0,1,0,1,0,0|0,0,2]=4 8913 B9R1.2 OC[C@@H]1C[C@H](O)CCN1 Amb25911166 [0,1,0,1,0,0|1,0,0]=3 8914 B9R1.2 OC[C@H]1CCCC(O)O1 Amb28187704 [0,1,0,1,0,0|0,0,0]=2 8915 B9R1.2 OC[C@H]1CCC[C@@H](O)C1 Amb26435184 [0,1,0,1,0,0|1,0,0]=3 8916 B9R1.2 OC[C@H]1CCC[C@@H](O)O1 Amb27854201 [0,1,0,1,0,0|0,0,0]=2 8917 B9R1.7 C=CCC1CC(O)CO1 Amb27650261 [0,1,0,1,0,0|0,0,2]=4 8918 B9R1.7 C=CC[C@@H]1C[C@H](O)CO1 Amb27198045 [0,1,0,1,0,0|0,0,2]=4 8919 B9R1.7 CC1CC(CCO)CN1 Amb27607763 [0,1,0,1,0,0|2,0,0]=4 8920 B9R1.7 CC1CCC(CCBr)O1 Amb26943466 [0,1,0,1,0,0|2,0,0]=4 8921 B9R1.7 CC1CCC(CCN)C1 Amb25865066 [0,1,0,1,0,0|2,0,0]=4 8922 B9R1.7 CC1CCC(CCN)C1 Amb33482569 [0,1,0,1,0,0|2,0,0]=4 8923 B9R1.7 CC1CCC(CCN)N1 Amb23560219 [0,1,0,1,0,0|2,0,0]=4 8924 B9R1.7 CC1CCC(CCN)O1 Amb25107033 [0,1,0,1,0,0|2,0,0]=4 8925 B9R1.7 CC1CCC(CCO)C1 Amb28206116 [0,1,0,1,0,0|1,0,0]=3 8926 B9R1.7 CC1CCC(CCO)O1 Amb24420913 [0,1,0,1,0,0|1,0,0]=3 8927 B9R1.7 CC1CCN(CCBr)C1 Amb20667700 [0,1,0,1,0,0|2,0,0]=4 8928 B9R1.7 CC1CCN(CCCl)C1 Amb27438909 [0,1,0,1,0,0|2,0,0]=4 8929 B9R1.7 CC1CCN(CCN)C1 Amb18523740 [0,1,0,1,0,0|2,0,0]=4 8930 B9R1.7 CC1CCN(CCO)C1 Amb20668415 [0,1,0,1,0,0|1,0,0]=3 8931 B9R1.7 CC1CC\C(=C/CO)C1 Amb27204469 [0,1,0,1,0,0|1,0,1]=4 8932 B9R1.7 CC1NC(CCO)CS1 Amb32946459 [0,1,0,1,0,0|2,0,0]=4 8933 B9R1.7 CC1OC[C@H](CCO)O1 Amb27978209 [0,1,0,1,0,0|2,0,0]=4 8934 B9R1.7 CCCC1=CCC(O)C1 Amb28453475 [0,1,0,1,0,0|1,0,1]=4 8935 B9R1.7 CCCC1=C[C@@H](O)CC1 Amb27424842 [0,1,0,1,0,0|1,0,1]=4 8936 B9R1.7 CCCC1CC(=O)CO1 Amb35722218 [0,1,0,1,0,0|0,0,2]=4 8937 B9R1.7 CCCC1CC(N)CO1 Amb35584876 [0,1,0,1,0,0|1,0,0]=3 8938 B9R1.7 CCCC1CC(O)CO1 Amb35584946 [0,1,0,1,0,0|0,0,0]=2 8939 B9R1.7 CCCC1CCC(=O)O1 Amb8517544 [0,1,0,1,0,0|1,0,1]=4 8940 B9R1.7 CCCC1CCC(Cl)C1 Amb28201166 [0,1,0,1,0,0|2,0,0]=4 8941 B9R1.7 CCCC1CCC(Cl)O1 Amb27424623 [0,1,0,1,0,0|1,0,0]=3 8942 B9R1.7 CCCC1CCC(N)C1 Amb26963448 [0,1,0,1,0,0|2,0,0]=4 8943 B9R1.7 CCCC1CCC(O)O1 Amb27589536 [0,1,0,1,0,0|1,0,0]=3 8944 B9R1.7 CCCC1COC(O)C1 Amb28315446 [0,1,0,1,0,0|2,0,0]=4 8945 B9R1.7 CCCC1OCC(C)O1 Amb4017566 [0,1,0,1,0,0|0,0,0]=2 8946 B9R1.7 CCCN1CCC(N)C1 Amb32412600 [0,1,0,1,0,0|2,0,0]=4 8947 B9R1.7 CCCN1CCC(N)C1 Amb8948567 [0,1,0,1,0,0|2,0,0]=4 8948 B9R1.7 CCCN1CCC(S)C1 Amb27251142 [0,1,0,1,0,0|2,0,0]=4 8949 B9R1.7 CCCN1CC[C@@H](N)C1 Amb27838584 [0,1,0,1,0,0|2,0,0]=4 8950 B9R1.7 CCCN1CC[C@H](N)C1 Amb27596602 [0,1,0,1,0,0|2,0,0]=4 8951 B9R1.7 CCC[C@@H]1CC[C@H](C)N1 Amb27473308 [0,1,0,1,0,0|2,0,0]=4 8952 B9R1.7 CCC[C@H]1CCC(=O)O1 Amb28397464 [0,1,0,1,0,0|1,0,1]=4 8953 B9R1.7 CCC[C@H]1COC(O)C1 Amb28315422 [0,1,0,1,0,0|2,0,0]=4 8954 B9R1.7 CN1CCC(CCO)C1 Amb22585688 [0,1,0,1,0,0|2,0,0]=4 8955 B9R1.7 CN1CCC(CCO)C1 Amb32665383 [0,1,0,1,0,0|2,0,0]=4 8956 B9R1.7 CNCC1CC(O)CN1 Amb25885673 [0,1,0,1,0,0|2,0,0]=4 8957 B9R1.7 CNCC1CC(O)CN1 Amb32666419 [0,1,0,1,0,0|2,0,0]=4 8958 B9R1.7 CNCC1CCC(C)O1 Amb18642726 [0,1,0,1,0,0|2,0,0]=4 8959 B9R1.7 CNCC1CCC(O)C1 Amb28049206 [0,1,0,1,0,0|2,0,0]=4 8960 B9R1.7 CNCC1CC[C@@H](C)O1 Amb33423401 [0,1,0,1,0,0|2,0,0]=4 8961 B9R1.7 CNC[C@@H]1C[C@@H](O)CN1 Amb25950829 [0,1,0,1,0,0|2,0,0]=4 8962 B9R1.7 CNC[C@@H]1C[C@@H](O)CN1 Amb28921071 [0,1,0,1,0,0|2,0,0]=4 8963 B9R1.7 COCC1CC(O)CN1 Amb25102542 [0,1,0,1,0,0|2,0,0]=4 8964 B9R1.7 COCC1CC(O)CN1 Amb32663501 [0,1,0,1,0,0|2,0,0]=4 8965 B9R1.7 COC[C@@H]1C[C@@H](O)CN1 Amb27221570 [0,1,0,1,0,0|2,0,0]=4 8966 B9R1.7 COC[C@@H]1C[C@@H](O)CN1 Amb32664596 [0,1,0,1,0,0|2,0,0]=4 8967 B9R1.7 COC[C@@H]1C[C@H](N)CO1 Amb27881800 [0,1,0,1,0,0|2,0,0]=4 8968 B9R1.7 COC[C@@H]1C[C@H](O)CN1 Amb25841067 [0,1,0,1,0,0|2,0,0]=4 8969 B9R1.7 COC[C@@H]1C[C@H](O)CN1 Amb28644471 [0,1,0,1,0,0|2,0,0]=4 8970 B9R1.7 COC[C@H]1C[C@@H](O)CN1 Amb32664687 [0,1,0,1,0,0|2,0,0]=4 8971 B9R1.7 COC[C@H]1C[C@@H](O)CN1 Amb32664688 [0,1,0,1,0,0|2,0,0]=4 8972 B9R1.7 C[C@@H]1CCC(CCBr)O1 Amb33331134 [0,1,0,1,0,0|2,0,0]=4 8973 B9R1.7 C[C@@H]1CCC(CCN)O1 Amb33423877 [0,1,0,1,0,0|2,0,0]=4 8974 B9R1.7 C[C@@H]1CCC(CCO)O1 Amb33423278 [0,1,0,1,0,0|1,0,0]=3 8975 B9R1.7 C[C@@H]1CCC(CCS)O1 Amb32730400 [0,1,0,1,0,0|1,1,0]=4 8976 B9R1.7 C[C@@H]1CCC(CNO)O1 Amb33226296 [0,1,0,1,0,0|2,0,0]=4 8977 B9R1.7 C[C@@H]1CCN(CCO)C1 Amb25683829 [0,1,0,1,0,0|1,0,0]=3 8978 B9R1.7 C[C@@H]1CC[C@@H](CCO)N1 Amb27438106 [0,1,0,1,0,0|1,0,0]=3 8979 B9R1.7 C[C@@H]1CC[C@H](CCO)N1 Amb32946591 [0,1,0,1,0,0|1,0,0]=3 8980 B9R1.7 C[C@H]1CC[C@@H](CCO)N1 Amb27439132 [0,1,0,1,0,0|1,0,0]=3 8981 B9R1.7 FC1CCN(CCBr)C1 Amb35605432 [0,1,0,1,0,0|2,0,0]=4 8982 B9R1.7 FC1CCN(CCS)C1 Amb35591956 [0,1,0,1,0,0|1,1,0]=4 8983 B9R1.7 FCCN1CCC(Br)C1 Amb27838517 [0,1,0,1,0,0|2,0,0]=4 8984 B9R1.7 NC1CCC(CCO)C1 Amb26889980 [0,1,0,1,0,0|1,0,0]=3 8985 B9R1.7 NC1CCN(CCF)C1 Amb26952159 [0,1,0,1,0,0|2,0,0]=4 8986 B9R1.7 NC1CCN(CCF)C1 Amb33484397 [0,1,0,1,0,0|2,0,0]=4 8987 B9R1.7 NC1CCN(CCO)C1 Amb17134545 [0,1,0,1,0,0|1,0,0]=3 8988 B9R1.7 NC1CCN(CCS)C1 Amb28436540 [0,1,0,1,0,0|1,1,0]=4 8989 B9R1.7 NCCC1CCC(F)C1 Amb28060508 [0,1,0,1,0,0|2,0,0]=4 8990 B9R1.7 NCCC1CCC(O)C1 Amb27790532 [0,1,0,1,0,0|2,0,0]=4 8991 B9R1.7 NCCN1CCC(F)C1 Amb27781120 [0,1,0,1,0,0|2,0,0]=4 8992 B9R1.7 NCCN1CCC(O)C1 Amb18965717 [0,1,0,1,0,0|2,0,0]=4 8993 B9R1.7 NCCN1CC[C@@H](N)C1 Amb28043265 [0,1,0,1,0,0|2,0,0]=4 8994 B9R1.7 NCCN1CC[C@@H](O)C1 Amb2695993 [0,1,0,1,0,0|2,0,0]=4 8995 B9R1.7 NCCN1CC[C@H](O)C1 Amb2695823 [0,1,0,1,0,0|2,0,0]=4 8996 B9R1.7 NCC[C@@H]1CC[C@H](O)C1 Amb17933187 [0,1,0,1,0,0|2,0,0]=4 8997 B9R1.7 N[C@@H]1CC[C@H](CCO)C1 Amb33803500 [0,1,0,1,0,0|1,0,0]=3 8998 B9R1.7 N[C@H]1CCN(CCF)C1 Amb27978833 [0,1,0,1,0,0|2,0,0]=4 8999 B9R1.7 OC1CCC(CCS)C1 Amb27835966 [0,1,0,1,0,0|1,1,0]=4 9000 B9R1.7 OC1CCN(CCBr)C1 Amb18316435 [0,1,0,1,0,0|2,0,0]=4 9001 B9R1.7 OC1CCN(CCCl)C1 Amb27954823 [0,1,0,1,0,0|2,0,0]=4 9002 B9R1.7 OC1CCN(CCF)C1 Amb26927228 [0,1,0,1,0,0|2,0,0]=4 9003 B9R1.7 OC1CCN(CCS)C1 Amb28067364 [0,1,0,1,0,0|1,1,0]=4 9004 B9R1.7 OC1COC(CCCl)C1 Amb27424693 [0,1,0,1,0,0|1,0,0]=3 9005 B9R1.7 OC1CON(CCF)C1 Amb27956533 [0,1,0,1,0,0|2,0,0]=4 9006 B9R1.7 OCCN1CC[C@H](F)C1 Amb28351456 [0,1,0,1,0,0|1,0,0]=3 9007 B9R1.7 OCCN1C[C@@H](O)CO1 Amb28364692 [0,1,0,1,0,0|2,0,0]=4 9008 B9R1.7 OCC[C@@H]1CC[C@H](O)C1 Amb28070933 [0,1,0,1,0,0|1,0,0]=3 9009 B9R1.7 O[C@@H]1CCN(CCCl)C1 Amb26611670 [0,1,0,1,0,0|2,0,0]=4 9010 B9R1.7 O[C@@H]1CCN(CCF)C1 Amb27461934 [0,1,0,1,0,0|2,0,0]=4 9011 B9R1.7 O[C@@H]1CON(CCF)C1 Amb27462891 [0,1,0,1,0,0|2,0,0]=4 9012 B9R1.7 O[C@H]1CCN(CCCl)C1 Amb25874303 [0,1,0,1,0,0|2,0,0]=4 9013 B9R1.7 O[C@H]1CCN(CCCl)C1 Amb33624653 [0,1,0,1,0,0|2,0,0]=4 9014 B9R1.7 O[C@H]1CCN(CCF)C1 Amb27470514 [0,1,0,1,0,0|2,0,0]=4 9015 B9R1.7 O[C@H]1CCN(CCI)C1 Amb27804597 [0,1,0,1,0,0|2,0,0]=4 9016 B9R1.8 BrCCC1=CCCCC1 Amb26032382 [0,1,0,1,0,0|2,0,0]=4 9017 B9R1.8 BrCCC1CCCCC1 Amb3940145 [0,1,0,1,0,0|2,0,0]=4 9018 B9R1.8 BrCCC1CCCCN1 Amb1102639 [0,1,0,1,0,0|2,0,0]=4 9019 B9R1.8 BrCCC1CCCCN1 Amb22284142 [0,1,0,1,0,0|2,0,0]=4 9020 B9R1.8 BrCCC1CCCCO1 Amb24480305 [0,1,0,1,0,0|1,0,0]=3 9021 B9R1.8 BrCCC1CCCNC1 Amb22274545 [0,1,0,1,0,0|2,0,0]=4 9022 B9R1.8 BrCCC1CCCNC1 Amb32412708 [0,1,0,1,0,0|2,0,0]=4 9023 B9R1.8 BrCCC1CCCOC1 Amb33546512 [0,1,0,1,0,0|1,0,0]=3 9024 B9R1.8 BrCCC1CCCSC1 Amb33008117 [0,1,0,1,0,0|1,1,0]=4 9025 B9R1.8 BrCCC1CCNCC1 Amb18129678 [0,1,0,1,0,0|2,0,0]=4 9026 B9R1.8 BrCCC1CCOCC1 Amb6572392 [0,1,0,1,0,0|2,0,0]=4 9027 B9R1.8 BrCCC1COCCN1 Amb35742286 [0,1,0,1,0,0|1,0,0]=3 9028 B9R1.8 BrCCC1COCCO1 Amb26845021 [0,1,0,1,0,0|0,0,0]=2 9029 B9R1.8 BrCCC1OCCCO1 Amb3940418 [0,1,0,1,0,0|1,0,0]=3 9030 B9R1.8 BrCCN1CCCCC1 Amb10608903 [0,1,0,1,0,0|2,0,0]=4 9031 B9R1.8 BrCCN1CCCCC1 Amb19373647 [0,1,0,1,0,0|2,0,0]=4 9032 B9R1.8 BrCCN1CCNCC1 Amb2704850 [0,1,0,1,0,0|2,0,0]=4 9033 B9R1.8 BrCCN1CCNCC1 Amb6374272 [0,1,0,1,0,0|2,0,0]=4 9034 B9R1.8 BrCCN1CCNCC1 Amb6825617 [0,1,0,1,0,0|2,0,0]=4 9035 B9R1.8 BrCCN1CCOCC1 Amb10066882 [0,1,0,1,0,0|2,0,0]=4 9036 B9R1.8 BrCCN1CCOCC1 Amb19373542 [0,1,0,1,0,0|2,0,0]=4 9037 B9R1.8 BrCCN1CCOCC1 Amb2695025 [0,1,0,1,0,0|2,0,0]=4 9038 B9R1.8 BrCOC1CCCCC1 Amb28194039 [0,1,0,1,0,0|2,0,0]=4 9039 B9R1.8 BrCOC1CCCCO1 Amb27771112 [0,1,0,1,0,0|1,0,0]=3 9040 B9R1.8 Br[Mg]CC1CCCCC1 Amb22000557 [0,1,0,1,0,0|2,0,0]=4 9041 B9R1.8 C#CCC1CCCCC1 Amb2724661 [0,1,0,1,0,0|2,0,0]=4 9042 B9R1.8 C#CCC1CCCCN1 Amb18280972 [0,1,0,1,0,0|2,0,0]=4 9043 B9R1.8 C#CCC1CCCCN1 Amb31156147 [0,1,0,1,0,0|2,0,0]=4 9044 B9R1.8 C#CCC1CCCCO1 Amb33375591 [0,1,0,1,0,0|1,0,0]=3 9045 B9R1.8 C#CCC1CCCOC1 Amb33322143 [0,1,0,1,0,0|1,0,1]=4 9046 B9R1.8 C#NCC1CCCCC1 Amb31132457 [0,1,0,1,0,0|2,0,0]=4 9047 B9R1.8 C=CCC1CCCCC1 Amb3940551 [0,1,0,1,0,0|2,0,0]=4 9048 B9R1.8 C=CCC1CCCCN1 Amb18967413 [0,1,0,1,0,0|2,0,0]=4 9049 B9R1.8 C=CCC1CCCCO1 Amb33483361 [0,1,0,1,0,0|1,0,0]=3 9050 B9R1.8 C=CCC1COCCN1 Amb28049059 [0,1,0,1,0,0|1,0,1]=4 9051 B9R1.8 C=CCC1COCCO1 Amb25689792 [0,1,0,1,0,0|0,0,1]=3 9052 B9R1.8 C=CC[C@@H]1CCCCN1 Amb27175286 [0,1,0,1,0,0|2,0,0]=4 9053 B9R1.8 C=CC[C@@H]1CCCOC1 Amb27466472 [0,1,0,1,0,0|1,0,1]=4 9054 B9R1.8 C=CC[C@H]1CCCCN1 Amb28341851 [0,1,0,1,0,0|2,0,0]=4 9055 B9R1.8 C=CC[C@H]1CCCOC1 Amb27248649 [0,1,0,1,0,0|1,0,1]=4 9056 B9R1.8 C=CC[C@H]1COCCN1 Amb27404577 [0,1,0,1,0,0|1,0,1]=4 9057 B9R1.8 C=COC1CCCCO1 Amb22730655 [0,1,0,1,0,0|1,0,1]=4 9058 B9R1.8 CC#CC1OCCCO1 Amb28045843 [0,1,0,1,0,0|0,0,2]=4 9059 B9R1.8 CCCC1=NCCCC1 Amb27266018 [0,1,0,1,0,0|2,0,0]=4 9060 B9R1.8 CCCC1C=CCCC1 Amb27644637 [0,1,0,1,0,0|2,0,0]=4 9061 B9R1.8 CCCC1CCC=CO1 Amb27423642 [0,1,0,1,0,0|1,0,1]=4 9062 B9R1.8 CCCC1CCCCC1 Amb22336542 [0,1,0,1,0,0|2,0,0]=4 9063 B9R1.8 CCCC1CCCCN1 Amb2235347 [0,1,0,1,0,0|2,0,0]=4 9064 B9R1.8 CCCC1CCCCN1 Amb33549801 [0,1,0,1,0,0|2,0,0]=4 9065 B9R1.8 CCCC1CCCNC1 Amb18285007 [0,1,0,1,0,0|2,0,0]=4 9066 B9R1.8 CCCC1CCCNC1 Amb33551237 [0,1,0,1,0,0|2,0,0]=4 9067 B9R1.8 CCCC1CCNCC1 Amb10553113 [0,1,0,1,0,0|2,0,0]=4 9068 B9R1.8 CCCC1CCNCC1 Amb33529751 [0,1,0,1,0,0|2,0,0]=4 9069 B9R1.8 CCCC1CNCCN1 Amb20667630 [0,1,0,1,0,0|2,0,0]=4 9070 B9R1.8 CCCC1CNCCO1 Amb22059500 [0,1,0,1,0,0|1,0,0]=3 9071 B9R1.8 CCCC1COCCN1 Amb10607878 [0,1,0,1,0,0|1,0,0]=3 9072 B9R1.8 CCCC1NCCCS1 Amb4032842 [0,1,0,1,0,0|1,1,0]=4 9073 B9R1.8 CCCN1CCCCN1 Amb27783473 [0,1,0,1,0,0|2,0,0]=4 9074 B9R1.8 CCCN1CCCOC1 Amb27628068 [0,1,0,1,0,0|1,0,0]=3 9075 B9R1.8 CCCN1CCNCC1 Amb1995335 [0,1,0,1,0,0|2,0,0]=4 9076 B9R1.8 CCCN1CCNCC1 Amb32427978 [0,1,0,1,0,0|2,0,0]=4 9077 B9R1.8 CCCN1CCNCC1 Amb6366065 [0,1,0,1,0,0|2,0,0]=4 9078 B9R1.8 CCCN1CCNCC1 Amb6609051 [0,1,0,1,0,0|2,0,0]=4 9079 B9R1.8 CCCN1CCOCC1 Amb9787481 [0,1,0,1,0,0|2,0,0]=4 9080 B9R1.8 CCC[C@@H]1CNCCO1 Amb27974093 [0,1,0,1,0,0|1,0,0]=3 9081 B9R1.8 CCC[C@H]1CNCCN1 Amb28067104 [0,1,0,1,0,0|2,0,0]=4 9082 B9R1.8 CCC[C@H]1CNCCO1 Amb28385328 [0,1,0,1,0,0|1,0,0]=3 9083 B9R1.8 CCNC1CCCCC1 Amb3939154 [0,1,0,1,0,0|2,0,0]=4 9084 B9R1.8 CCNC1CCCCC1 Amb532241 [0,1,0,1,0,0|2,0,0]=4 9085 B9R1.8 CCNC1CCCOC1 Amb27837490 [0,1,0,1,0,0|1,0,0]=3 9086 B9R1.8 CCNC1CCCOC1 Amb28934972 [0,1,0,1,0,0|1,0,0]=3 9087 B9R1.8 CCN[C@@H]1CCCNC1 Amb27882911 [0,1,0,1,0,0|2,0,0]=4 9088 B9R1.8 CCOC1=COCCO1 Amb27827629 [0,1,0,1,0,0|0,0,2]=4 9089 B9R1.8 CCOC1CCCCN1 Amb27765495 [0,1,0,1,0,0|2,0,0]=4 9090 B9R1.8 CCOC1CCCCO1 Amb4016388 [0,1,0,1,0,0|1,0,0]=3 9091 B9R1.8 CCOC1CCCNC1 Amb19889821 [0,1,0,1,0,0|2,0,0]=4 9092 B9R1.8 CCOC1CCCNC1 Amb9752811 [0,1,0,1,0,0|2,0,0]=4 9093 B9R1.8 CCOC1CNCCO1 Amb25146119 [0,1,0,1,0,0|1,0,0]=3 9094 B9R1.8 CCO[C@@H]1CCCNC1 Amb24559280 [0,1,0,1,0,0|2,0,0]=4 9095 B9R1.8 CCO[C@H]1CCCNC1 Amb24478793 [0,1,0,1,0,0|2,0,0]=4 9096 B9R1.8 CCSC1CCCNC1 Amb18956223 [0,1,0,1,0,0|2,0,0]=4 9097 B9R1.8 CNCC1=CCCOC1 Amb24329063 [0,1,0,1,0,0|1,0,1]=4 9098 B9R1.8 CNCC1=COCCO1 Amb29866239 [0,1,0,1,0,0|0,0,2]=4 9099 B9R1.8 CNCC1CCCCC1 Amb1117772 [0,1,0,1,0,0|2,0,0]=4 9100 B9R1.8 CNCC1CCCCC1 Amb2119455 [0,1,0,1,0,0|2,0,0]=4 9101 B9R1.8 CNCC1CCCCN1 Amb18281799 [0,1,0,1,0,0|2,0,0]=4 9102 B9R1.8 CNCC1CCCCN1 Amb32752949 [0,1,0,1,0,0|2,0,0]=4 9103 B9R1.8 CNCC1CCCCO1 Amb8503254 [0,1,0,1,0,0|1,0,0]=3 9104 B9R1.8 CNCC1CCCCO1 Amb9258705 [0,1,0,1,0,0|1,0,0]=3 9105 B9R1.8 CNCC1CCCCS1 Amb27826766 [0,1,0,1,0,0|1,1,0]=4 9106 B9R1.8 CNCC1CCCNC1 Amb16186636 [0,1,0,1,0,0|2,0,0]=4 9107 B9R1.8 CNCC1CCCNC1 Amb21959752 [0,1,0,1,0,0|2,0,0]=4 9108 B9R1.8 CNCC1CCCOC1 Amb18288267 [0,1,0,1,0,0|1,0,0]=3 9109 B9R1.8 CNCC1CCCOC1 Amb30869456 [0,1,0,1,0,0|1,0,0]=3 9110 B9R1.8 CNCC1CCCSC1 Amb27956471 [0,1,0,1,0,0|1,1,0]=4 9111 B9R1.8 CNCC1CCOCO1 Amb27475487 [0,1,0,1,0,0|2,0,0]=4 9112 B9R1.8 CNCC1CNCCO1 Amb3376134 [0,1,0,1,0,0|1,0,0]=3 9113 B9R1.8 CNCC1COCCO1 Amb1102054 [0,1,0,1,0,0|0,0,0]=2 9114 B9R1.8 CNCC1COCCO1 Amb22587651 [0,1,0,1,0,0|0,0,0]=2 9115 B9R1.8 CNCC1CSCCO1 Amb27394771 [0,1,0,1,0,0|0,1,0]=3 9116 B9R1.8 CNCC1CSCCS1 Amb28352315 [0,1,0,1,0,0|0,2,0]=4 9117 B9R1.8 CNCC1OCCCO1 Amb18663858 [0,1,0,1,0,0|1,0,0]=3 9118 B9R1.8 CNC[C@@H]1CCCCN1 Amb24477709 [0,1,0,1,0,0|2,0,0]=4 9119 B9R1.8 CNC[C@@H]1CCCCN1 Amb32660930 [0,1,0,1,0,0|2,0,0]=4 9120 B9R1.8 CNC[C@@H]1CCCNC1 Amb27425112 [0,1,0,1,0,0|2,0,0]=4 9121 B9R1.8 CNC[C@@H]1CCCNC1 Amb32659594 [0,1,0,1,0,0|2,0,0]=4 9122 B9R1.8 CNC[C@@H]1COCCO1 Amb25087223 [0,1,0,1,0,0|0,0,0]=2 9123 B9R1.8 CNC[C@@H]1COCCO1 Amb33623109 [0,1,0,1,0,0|0,0,0]=2 9124 B9R1.8 CNC[C@H]1CCCCN1 Amb25115403 [0,1,0,1,0,0|2,0,0]=4 9125 B9R1.8 CNC[C@H]1CCCCN1 Amb32671018 [0,1,0,1,0,0|2,0,0]=4 9126 B9R1.8 CNC[C@H]1CCCNC1 Amb27982338 [0,1,0,1,0,0|2,0,0]=4 9127 B9R1.8 CNC[C@H]1CCCNC1 Amb32656286 [0,1,0,1,0,0|2,0,0]=4 9128 B9R1.8 CNC[C@H]1CNCCO1 Amb27241214 [0,1,0,1,0,0|1,0,0]=3 9129 B9R1.8 CNC[C@H]1COCCO1 Amb33623103 [0,1,0,1,0,0|0,0,0]=2 9130 B9R1.8 COCC1CCCCC1 Amb27858995 [0,1,0,1,0,0|1,0,0]=3 9131 B9R1.8 COCC1CCCCN1 Amb8503235 [0,1,0,1,0,0|1,0,0]=3 9132 B9R1.8 COCC1CCCCN1 Amb9722134 [0,1,0,1,0,0|1,0,0]=3 9133 B9R1.8 COCC1CCCNC1 Amb2140573 [0,1,0,1,0,0|2,0,0]=4 9134 B9R1.8 COCC1CCCNC1 Amb9719115 [0,1,0,1,0,0|2,0,0]=4 9135 B9R1.8 COCC1CCNCC1 Amb2235515 [0,1,0,1,0,0|2,0,0]=4 9136 B9R1.8 COCC1CCNCC1 Amb33528889 [0,1,0,1,0,0|2,0,0]=4 9137 B9R1.8 COCC1CNCCO1 Amb19333126 [0,1,0,1,0,0|1,0,0]=3 9138 B9R1.8 COCC1CNCCO1 Amb22234267 [0,1,0,1,0,0|1,0,0]=3 9139 B9R1.8 COCC1CNCCS1 Amb27224153 [0,1,0,1,0,0|1,1,0]=4 9140 B9R1.8 COCC1COCCN1 Amb21858859 [0,1,0,1,0,0|1,0,0]=3 9141 B9R1.8 COCC1COCCN1 Amb26612834 [0,1,0,1,0,0|1,0,0]=3 9142 B9R1.8 COC[C@@H]1CCCCN1 Amb22748820 [0,1,0,1,0,0|1,0,0]=3 9143 B9R1.8 COC[C@@H]1CCCNC1 Amb34158327 [0,1,0,1,0,0|2,0,0]=4 9144 B9R1.8 COC[C@@H]1CNCCO1 Amb22745244 [0,1,0,1,0,0|1,0,0]=3 9145 B9R1.8 COC[C@@H]1CNCCO1 Amb22745940 [0,1,0,1,0,0|1,0,0]=3 9146 B9R1.8 COC[C@@H]1COCCN1 Amb22737235 [0,1,0,1,0,0|1,0,0]=3 9147 B9R1.8 COC[C@@H]1COCCN1 Amb25062753 [0,1,0,1,0,0|1,0,0]=3 9148 B9R1.8 COC[C@H]1CCCCN1 Amb33871620 [0,1,0,1,0,0|1,0,0]=3 9149 B9R1.8 COC[C@H]1CCCNC1 Amb34155960 [0,1,0,1,0,0|2,0,0]=4 9150 B9R1.8 COC[C@H]1CNCCN1 Amb28043148 [0,1,0,1,0,0|2,0,0]=4 9151 B9R1.8 COC[C@H]1CNCCO1 Amb25145666 [0,1,0,1,0,0|1,0,0]=3 9152 B9R1.8 COC[C@H]1CNCCO1 Amb33801351 [0,1,0,1,0,0|1,0,0]=3 9153 B9R1.8 COC[C@H]1COCCN1 Amb22736700 [0,1,0,1,0,0|1,0,0]=3 9154 B9R1.8 COC[C@H]1COCCN1 Amb27786480 [0,1,0,1,0,0|1,0,0]=3 9155 B9R1.8 CSCC1CCCCN1 Amb2235851 [0,1,0,1,0,0|1,1,0]=4 9156 B9R1.8 CSCC1CCCCN1 Amb2237237 [0,1,0,1,0,0|1,1,0]=4 9157 B9R1.8 CSCC1CCCNC1 Amb17503123 [0,1,0,1,0,0|2,0,0]=4 9158 B9R1.8 CSCC1CCCNC1 Amb21959895 [0,1,0,1,0,0|2,0,0]=4 9159 B9R1.8 CSCC1CNCCN1 Amb25865428 [0,1,0,1,0,0|2,0,0]=4 9160 B9R1.8 CSCC1CNCCO1 Amb25093056 [0,1,0,1,0,0|1,0,0]=3 9161 B9R1.8 CSCC1COCCN1 Amb27872718 [0,1,0,1,0,0|1,0,0]=3 9162 B9R1.8 CSC[C@@H]1CNCCN1 Amb27630672 [0,1,0,1,0,0|2,0,0]=4 9163 B9R1.8 CSC[C@H]1CNCCN1 Amb27424684 [0,1,0,1,0,0|2,0,0]=4 9164 B9R1.8 C\C=C\C1OCCCO1 Amb17334099 [0,1,0,1,0,0|0,0,2]=4 9165 B9R1.8 ClCCC1CCCCC1 Amb9004316 [0,1,0,1,0,0|2,0,0]=4 9166 B9R1.8 ClCCC1CCCCN1 Amb6740274 [0,1,0,1,0,0|2,0,0]=4 9167 B9R1.8 ClCCC1CCCCN1 Amb8629028 [0,1,0,1,0,0|2,0,0]=4 9168 B9R1.8 ClCCC1CCCCO1 Amb27168293 [0,1,0,1,0,0|1,0,0]=3 9169 B9R1.8 ClCCC1CCCNC1 Amb22299848 [0,1,0,1,0,0|2,0,0]=4 9170 B9R1.8 ClCCC1CCNCC1 Amb33813406 [0,1,0,1,0,0|2,0,0]=4 9171 B9R1.8 ClCCC1CCOCC1 Amb22299854 [0,1,0,1,0,0|2,0,0]=4 9172 B9R1.8 ClCCC1CNCCN1 Amb24104481 [0,1,0,1,0,0|2,0,0]=4 9173 B9R1.8 ClCCC1CNCCN1 Amb24120381 [0,1,0,1,0,0|2,0,0]=4 9174 B9R1.8 ClCCC1OCCCO1 Amb26613554 [0,1,0,1,0,0|1,0,0]=3 9175 B9R1.8 ClCCN1CCCCC1 Amb1154247 [0,1,0,1,0,0|2,0,0]=4 9176 B9R1.8 ClCCN1CCCCC1 Amb6298804 [0,1,0,1,0,0|2,0,0]=4 9177 B9R1.8 ClCCN1CCNCC1 Amb21959787 [0,1,0,1,0,0|2,0,0]=4 9178 B9R1.8 ClCCN1CCNCC1 Amb5261018 [0,1,0,1,0,0|2,0,0]=4 9179 B9R1.8 ClCCN1CCOCC1 Amb1935070 [0,1,0,1,0,0|2,0,0]=4 9180 B9R1.8 ClCCN1CCOCC1 Amb6366522 [0,1,0,1,0,0|2,0,0]=4 9181 B9R1.8 ClCCN1CCSCC1 Amb20622476 [0,1,0,1,0,0|2,0,0]=4 9182 B9R1.8 ClCC[NH+]1CCOCC1 Amb24122602 [0,1,0,1,0,0|2,0,0]=4 9183 B9R1.8 ClCNC1CCCCC1 Amb27469157 [0,1,0,1,0,0|2,0,0]=4 9184 B9R1.8 ClCOC1CCCCC1 Amb24323400 [0,1,0,1,0,0|2,0,0]=4 9185 B9R1.8 ClCOC1CCCOC1 Amb25082924 [0,1,0,1,0,0|2,0,0]=4 9186 B9R1.8 ClCSC1CCCCC1 Amb28200869 [0,1,0,1,0,0|2,0,0]=4 9187 B9R1.8 FCCC1CCCCN1 Amb26516169 [0,1,0,1,0,0|2,0,0]=4 9188 B9R1.8 FCCC1CCCNC1 Amb21959219 [0,1,0,1,0,0|2,0,0]=4 9189 B9R1.8 FCCC1CCCNC1 Amb32667207 [0,1,0,1,0,0|2,0,0]=4 9190 B9R1.8 FCCC1CCNCC1 Amb22274784 [0,1,0,1,0,0|2,0,0]=4 9191 B9R1.8 FCCC1CCNCC1 Amb24055930 [0,1,0,1,0,0|2,0,0]=4 9192 B9R1.8 FCCC1CNCCN1 Amb27642025 [0,1,0,1,0,0|2,0,0]=4 9193 B9R1.8 FCCC1CNCCO1 Amb26479875 [0,1,0,1,0,0|1,0,0]=3 9194 B9R1.8 FCCC1CNCCS1 Amb28135752 [0,1,0,1,0,0|1,1,0]=4 9195 B9R1.8 FCCC1COCCN1 Amb27193770 [0,1,0,1,0,0|1,0,0]=3 9196 B9R1.8 FCCN1CCCCC1 Amb26567757 [0,1,0,1,0,0|2,0,0]=4 9197 B9R1.8 FCCN1CCCCN1 Amb27785932 [0,1,0,1,0,0|2,0,0]=4 9198 B9R1.8 FCCN1CCNCC1 Amb22234059 [0,1,0,1,0,0|2,0,0]=4 9199 B9R1.8 FCCN1CCNCC1 Amb22263131 [0,1,0,1,0,0|2,0,0]=4 9200 B9R1.8 FCCN1CCNCC1 Amb33531094 [0,1,0,1,0,0|2,0,0]=4 9201 B9R1.8 FCCN1CCOCC1 Amb26055885 [0,1,0,1,0,0|2,0,0]=4 9202 B9R1.8 FCCN1CCSCC1 Amb27451554 [0,1,0,1,0,0|2,0,0]=4 9203 B9R1.8 ICCC1CCCCC1 Amb25046814 [0,1,0,1,0,0|2,0,0]=4 9204 B9R1.8 ICCC1CCCCO1 Amb35655392 [0,1,0,1,0,0|1,0,0]=3 9205 B9R1.8 ICCC1CCNCC1 Amb22296927 [0,1,0,1,0,0|2,0,0]=4 9206 B9R1.8 ICCC1CCOCC1 Amb22296928 [0,1,0,1,0,0|2,0,0]=4 9207 B9R1.8 ICCN1CCCCC1 Amb25063410 [0,1,0,1,0,0|2,0,0]=4 9208 B9R1.8 ICCN1CCCCC1 Amb33620512 [0,1,0,1,0,0|2,0,0]=4 9209 B9R1.8 ICCN1CCOCC1 Amb25733746 [0,1,0,1,0,0|2,0,0]=4 9210 B9R1.8 ICCN1CCOCC1 Amb32670654 [0,1,0,1,0,0|2,0,0]=4 9211 B9R1.8 ICOC1CCCOC1 Amb27805464 [0,1,0,1,0,0|2,0,0]=4 9212 B9R1.8 N#CCC1CCCCC1 Amb6260767 [0,1,0,1,0,0|2,0,0]=4 9213 B9R1.8 N#CCC1CCCCN1 Amb18642252 [0,1,0,1,0,0|2,0,0]=4 9214 B9R1.8 N#CCC1CCCCO1 Amb9455307 [0,1,0,1,0,0|1,0,0]=3 9215 B9R1.8 N#CCC1CCCOC1 Amb9753230 [0,1,0,1,0,0|1,0,1]=4 9216 B9R1.8 N#CCC1COCCN1 Amb18832758 [0,1,0,1,0,0|1,0,1]=4 9217 B9R1.8 N#CCC1COCCO1 Amb27259013 [0,1,0,1,0,0|0,0,1]=3 9218 B9R1.8 N#CCC1OCCCO1 Amb17334093 [0,1,0,1,0,0|1,0,1]=4 9219 B9R1.8 NCCC1=CCCCC1 Amb3939984 [0,1,0,1,0,0|2,0,0]=4 9220 B9R1.8 NCCC1=CCCOC1 Amb27873995 [0,1,0,1,0,0|1,0,1]=4 9221 B9R1.8 NCCC1CCCCC1 Amb6565256 [0,1,0,1,0,0|2,0,0]=4 9222 B9R1.8 NCCC1CCCCC1 Amb839081 [0,1,0,1,0,0|2,0,0]=4 9223 B9R1.8 NCCC1CCCCN1 Amb16233732 [0,1,0,1,0,0|2,0,0]=4 9224 B9R1.8 NCCC1CCCCO1 Amb10067654 [0,1,0,1,0,0|1,0,0]=3 9225 B9R1.8 NCCC1CCCCO1 Amb2607669 [0,1,0,1,0,0|1,0,0]=3 9226 B9R1.8 NCCC1CCCNC1 Amb16186592 [0,1,0,1,0,0|2,0,0]=4 9227 B9R1.8 NCCC1CCCOC1 Amb10072965 [0,1,0,1,0,0|1,0,0]=3 9228 B9R1.8 NCCC1CCCSC1 Amb18199319 [0,1,0,1,0,0|1,1,0]=4 9229 B9R1.8 NCCC1CCNCC1 Amb2209234 [0,1,0,1,0,0|2,0,0]=4 9230 B9R1.8 NCCC1CCNCC1 Amb6761309 [0,1,0,1,0,0|2,0,0]=4 9231 B9R1.8 NCCC1CCNCC1 Amb844572 [0,1,0,1,0,0|2,0,0]=4 9232 B9R1.8 NCCC1CCOCC1 Amb10068548 [0,1,0,1,0,0|2,0,0]=4 9233 B9R1.8 NCCC1CCOCC1 Amb10068583 [0,1,0,1,0,0|2,0,0]=4 9234 B9R1.8 NCCC1CCSCC1 Amb18199237 [0,1,0,1,0,0|2,0,0]=4 9235 B9R1.8 NCCC1CCSCC1 Amb30585203 [0,1,0,1,0,0|2,0,0]=4 9236 B9R1.8 NCCC1CNCCO1 Amb2695418 [0,1,0,1,0,0|1,0,0]=3 9237 B9R1.8 NCCC1CNCCO1 Amb33552534 [0,1,0,1,0,0|1,0,0]=3 9238 B9R1.8 NCCC1COCCN1 Amb34913367 [0,1,0,1,0,0|1,0,0]=3 9239 B9R1.8 NCCC1COCCN1 Amb8630783 [0,1,0,1,0,0|1,0,0]=3 9240 B9R1.8 NCCC1COCCO1 Amb17507065 [0,1,0,1,0,0|0,0,0]=2 9241 B9R1.8 NCCC1CSCCN1 Amb18559611 [0,1,0,1,0,0|1,1,0]=4 9242 B9R1.8 NCCC1OCCCO1 Amb17226715 [0,1,0,1,0,0|1,0,0]=3 9243 B9R1.8 NCCN1CCCCC1 Amb1155423 [0,1,0,1,0,0|2,0,0]=4 9244 B9R1.8 NCCN1CCCCC1 Amb20171369 [0,1,0,1,0,0|2,0,0]=4 9245 B9R1.8 NCCN1CCCCO1 Amb22886181 [0,1,0,1,0,0|1,0,0]=3 9246 B9R1.8 NCCN1CCCCO1 Amb8010469 [0,1,0,1,0,0|1,0,0]=3 9247 B9R1.8 NCCN1CCNCC1 Amb2720320 [0,1,0,1,0,0|2,0,0]=4 9248 B9R1.8 NCCN1CCOCC1 Amb2696303 [0,1,0,1,0,0|2,0,0]=4 9249 B9R1.8 NCCN1CCSCC1 Amb6307187 [0,1,0,1,0,0|2,0,0]=4 9250 B9R1.8 NCC[C@H]1CCCCN1 Amb25041454 [0,1,0,1,0,0|2,0,0]=4 9251 B9R1.8 NNCC1CCCCC1 Amb2691316 [0,1,0,1,0,0|2,0,0]=4 9252 B9R1.8 NNCC1CCCCC1 Amb6243006 [0,1,0,1,0,0|2,0,0]=4 9253 B9R1.8 NNCC1CCCCC1 Amb9677386 [0,1,0,1,0,0|2,0,0]=4 9254 B9R1.8 NNCC1CCCCO1 Amb13952745 [0,1,0,1,0,0|1,0,0]=3 9255 B9R1.8 NNCC1CCCCO1 Amb28990878 [0,1,0,1,0,0|1,0,0]=3 9256 B9R1.8 NNCC1CCCCO1 Amb9455279 [0,1,0,1,0,0|1,0,0]=3 9257 B9R1.8 NNCC1CCCCS1 Amb27779017 [0,1,0,1,0,0|1,1,0]=4 9258 B9R1.8 NNCC1CCCOC1 Amb26348570 [0,1,0,1,0,0|2,0,0]=4 9259 B9R1.8 NNCC1CCCOC1 Amb31291572 [0,1,0,1,0,0|2,0,0]=4 9260 B9R1.8 NNCC1COCCO1 Amb19516843 [0,1,0,1,0,0|1,0,0]=3 9261 B9R1.8 NNCC1COCCO1 Amb22587354 [0,1,0,1,0,0|1,0,0]=3 9262 B9R1.8 NOCC1CCCCC1 Amb10976085 [0,1,0,1,0,0|1,0,0]=3 9263 B9R1.8 NOCC1CCCCO1 Amb24584902 [0,1,0,1,0,0|0,0,0]=2 9264 B9R1.8 NOCC1CCCOC1 Amb33079004 [0,1,0,1,0,0|2,0,0]=4 9265 B9R1.8 NOCC1CCCSC1 Amb33224513 [0,1,0,1,0,0|2,0,0]=4 9266 B9R1.8 NOCC1CCOCC1 Amb24477835 [0,1,0,1,0,0|2,0,0]=4 9267 B9R1.8 NOCC1CCSCC1 Amb27613139 [0,1,0,1,0,0|2,0,0]=4 9268 B9R1.8 N\N=C\C1CCCCO1 Amb35622338 [0,1,0,1,0,0|1,0,1]=4 9269 B9R1.8 O=C=NC1CCCCO1 Amb25790678 [0,1,0,1,0,0|0,0,2]=4 9270 B9R1.8 O=C=NC1COCCO1 Amb27837533 [0,1,0,1,0,0|1,0,1]=4 9271 B9R1.8 O=C=N[C@@H]1CCCCO1 Amb27858949 [0,1,0,1,0,0|0,0,2]=4 9272 B9R1.8 O=CCC1CCCCC1 Amb10070777 [0,1,0,1,0,0|1,0,1]=4 9273 B9R1.8 O=CCC1CCCCN1 Amb18203260 [0,1,0,1,0,0|1,0,1]=4 9274 B9R1.8 O=CCC1CCCCO1 Amb25888588 [0,1,0,1,0,0|0,0,1]=3 9275 B9R1.8 O=CCC1CCCOC1 Amb22411365 [0,1,0,1,0,0|1,0,1]=4 9276 B9R1.8 O=CCC1CNCCO1 Amb27875480 [0,1,0,1,0,0|1,0,1]=4 9277 B9R1.8 O=CCC1OCCCO1 Amb27875172 [0,1,0,1,0,0|1,0,1]=4 9278 B9R1.8 O=CC[C@@H]1COCCO1 Amb27185723 [0,1,0,1,0,0|0,0,1]=3 9279 B9R1.8 OCC=C1CCCCC1 Amb25783847 [0,1,0,1,0,0|1,0,1]=4 9280 B9R1.8 OCC=C1CCNCC1 Amb33465522 [0,1,0,1,0,0|1,0,1]=4 9281 B9R1.8 OCC=C1CCNCC1 Amb33465523 [0,1,0,1,0,0|1,0,1]=4 9282 B9R1.8 OCC=C1CCOCC1 Amb25994306 [0,1,0,1,0,0|1,0,1]=4 9283 B9R1.8 OCCC1=CCCCC1 Amb17593322 [0,1,0,1,0,0|1,0,0]=3 9284 B9R1.8 OCCC1=CCCCO1 Amb25266822 [0,1,0,1,0,0|0,0,1]=3 9285 B9R1.8 OCCC1=CCOCC1 Amb26022368 [0,1,0,1,0,0|1,0,1]=4 9286 B9R1.8 OCCC1=COCCC1 Amb32944531 [0,1,0,1,0,0|1,0,1]=4 9287 B9R1.8 OCCC1=NCCCN1 Amb28240607 [0,1,0,1,0,0|2,0,0]=4 9288 B9R1.8 OCCC1C=CCCC1 Amb17593314 [0,1,0,1,0,0|1,0,1]=4 9289 B9R1.8 OCCC1CC=CCC1 Amb17593319 [0,1,0,1,0,0|1,0,1]=4 9290 B9R1.8 OCCC1CCC=CO1 Amb24481996 [0,1,0,1,0,0|0,0,2]=4 9291 B9R1.8 OCCC1CCCCC1 Amb3939314 [0,1,0,1,0,0|1,0,0]=3 9292 B9R1.8 OCCC1CCCCN1 Amb22492461 [0,1,0,1,0,0|1,0,0]=3 9293 B9R1.8 OCCC1CCCCN1 Amb9702818 [0,1,0,1,0,0|1,0,0]=3 9294 B9R1.8 OCCC1CCCCO1 Amb5846625 [0,1,0,1,0,0|0,0,0]=2 9295 B9R1.8 OCCC1CCCNC1 Amb19308093 [0,1,0,1,0,0|1,0,0]=3 9296 B9R1.8 OCCC1CCCNC1 Amb2694770 [0,1,0,1,0,0|1,0,0]=3 9297 B9R1.8 OCCC1CCCOC1 Amb33544109 [0,1,0,1,0,0|1,0,0]=3 9298 B9R1.8 OCCC1CCCSC1 Amb18202274 [0,1,0,1,0,0|1,0,0]=3 9299 B9R1.8 OCCC1CCNCC1 Amb22234816 [0,1,0,1,0,0|1,0,0]=3 9300 B9R1.8 OCCC1CCNCC1 Amb2690382 [0,1,0,1,0,0|1,0,0]=3 9301 B9R1.8 OCCC1CCOCC1 Amb6572393 [0,1,0,1,0,0|1,0,0]=3 9302 B9R1.8 OCCC1CCOCO1 Amb28429878 [0,1,0,1,0,0|1,0,0]=3 9303 B9R1.8 OCCC1CCSCC1 Amb18831400 [0,1,0,1,0,0|1,0,0]=3 9304 B9R1.8 OCCC1CNCCN1 Amb20241013 [0,1,0,1,0,0|2,0,0]=4 9305 B9R1.8 OCCC1CNCCN1 Amb2696390 [0,1,0,1,0,0|2,0,0]=4 9306 B9R1.8 OCCC1CNCCN1 Amb33321526 [0,1,0,1,0,0|2,0,0]=4 9307 B9R1.8 OCCC1CNCCO1 Amb22228173 [0,1,0,1,0,0|1,0,0]=3 9308 B9R1.8 OCCC1CNCCO1 Amb8630774 [0,1,0,1,0,0|1,0,0]=3 9309 B9R1.8 OCCC1COCCN1 Amb21858855 [0,1,0,1,0,0|1,0,0]=3 9310 B9R1.8 OCCC1COCCN1 Amb22276154 [0,1,0,1,0,0|1,0,0]=3 9311 B9R1.8 OCCC1COCCO1 Amb25328496 [0,1,0,1,0,0|0,0,0]=2 9312 B9R1.8 OCCC1CSCCN1 Amb20667793 [0,1,0,1,0,0|1,1,0]=4 9313 B9R1.8 OCCC1NCCCS1 Amb27185552 [0,1,0,1,0,0|1,1,0]=4 9314 B9R1.8 OCCN1CCCCC1 Amb2793063 [0,1,0,1,0,0|1,0,0]=3 9315 B9R1.8 OCCN1CCCCO1 Amb22886802 [0,1,0,1,0,0|0,0,0]=2 9316 B9R1.8 OCCN1CCNCC1 Amb932811 [0,1,0,1,0,0|1,0,0]=3 9317 B9R1.8 OCCN1CCOCC1 Amb535388 [0,1,0,1,0,0|1,0,0]=3 9318 B9R1.8 OCCN1CCSCC1 Amb6307185 [0,1,0,1,0,0|1,0,0]=3 9319 B9R1.8 OCCN1COCSC1 Amb28315532 [0,1,0,1,0,0|2,0,0]=4 9320 B9R1.8 OCC[C@@H]1CCCCN1 Amb22168885 [0,1,0,1,0,0|1,0,0]=3 9321 B9R1.8 OCC[C@@H]1CCCCN1 Amb8628480 [0,1,0,1,0,0|1,0,0]=3 9322 B9R1.8 OCC[C@@H]1CNCCN1 Amb22288654 [0,1,0,1,0,0|2,0,0]=4 9323 B9R1.8 OCC[C@@H]1CNCCN1 Amb27776309 [0,1,0,1,0,0|2,0,0]=4 9324 B9R1.8 OCC[C@@H]1COCCN1 Amb20242174 [0,1,0,1,0,0|1,0,0]=3 9325 B9R1.8 OCC[C@H]1CCCCN1 Amb17619440 [0,1,0,1,0,0|1,0,0]=3 9326 B9R1.8 OCC[C@H]1CCCCN1 Amb33788981 [0,1,0,1,0,0|1,0,0]=3 9327 B9R1.8 OCC[C@H]1CCCNC1 Amb26629279 [0,1,0,1,0,0|1,0,0]=3 9328 B9R1.8 OCC[C@H]1CNCCN1 Amb15692003 [0,1,0,1,0,0|2,0,0]=4 9329 B9R1.8 OCC[C@H]1CNCCN1 Amb22265555 [0,1,0,1,0,0|2,0,0]=4 9330 B9R1.8 OCC[C@H]1COCCN1 Amb20242185 [0,1,0,1,0,0|1,0,0]=3 9331 B9R1.8 OCC[C@H]1COCCN1 Amb20242980 [0,1,0,1,0,0|1,0,0]=3 9332 B9R1.8 OCOC1CCCCO1 Amb27180822 [0,1,0,1,0,0|0,0,0]=2 9333 B9R1.8 ONCC1CCCCC1 Amb25251761 [0,1,0,1,0,0|1,0,0]=3 9334 B9R1.8 ONCC1CCCCO1 Amb33378815 [0,1,0,1,0,0|0,0,0]=2 9335 B9R1.8 ONCC1CCCNC1 Amb27249317 [0,1,0,1,0,0|2,0,0]=4 9336 B9R1.8 ONCC1CCCOC1 Amb25084814 [0,1,0,1,0,0|2,0,0]=4 9337 B9R1.8 ONCC1CCCSC1 Amb26652449 [0,1,0,1,0,0|2,0,0]=4 9338 B9R1.8 ONCC1CCOCC1 Amb25736560 [0,1,0,1,0,0|2,0,0]=4 9339 B9R1.8 O\N=C\C1CCCCC1 Amb27771827 [0,1,0,1,0,0|1,0,1]=4 9340 B9R1.8 O\N=C\C1CCCCO1 Amb35743498 [0,1,0,1,0,0|0,0,1]=3 9341 B9R1.8 SCCC1CCCCC1 Amb24368740 [0,1,0,1,0,0|1,1,0]=4 9342 B9R1.8 SCCC1CCCCN1 Amb17503520 [0,1,0,1,0,0|1,1,0]=4 9343 B9R1.8 SCCC1CCCCO1 Amb33377389 [0,1,0,1,0,0|0,1,0]=3 9344 B9R1.8 SCCC1CCCNC1 Amb22298478 [0,1,0,1,0,0|1,1,0]=4 9345 B9R1.8 SCCC1CCCOC1 Amb33321789 [0,1,0,1,0,0|1,0,0]=3 9346 B9R1.8 SCCC1CCCSC1 Amb33224506 [0,1,0,1,0,0|1,1,0]=4 9347 B9R1.8 SCCC1CCNCC1 Amb22297524 [0,1,0,1,0,0|1,1,0]=4 9348 B9R1.8 SCCC1CCOCC1 Amb22297642 [0,1,0,1,0,0|1,1,0]=4 9349 B9R1.8 SCCC1OCCCO1 Amb27200333 [0,1,0,1,0,0|1,0,0]=3 9350 B9R1.8 SCCN1CCCCC1 Amb7776946 [0,1,0,1,0,0|1,1,0]=4 9351 B9R1.8 SCCN1CCOCC1 Amb499389 [0,1,0,1,0,0|1,1,0]=4 9352 B9R1.8 [C-]#[N+]CC1CCCCC1 Amb3973103 [0,1,0,1,0,0|2,0,0]=4 9353 B9R1.8 [C-]#[N+]CC1CCCCO1 Amb33375672 [0,1,0,1,0,0|1,0,0]=3 9354 B9R1.8 [C-]#[N+]CC1CCCOC1 Amb33322521 [0,1,0,1,0,0|1,0,1]=4 9355 B9R1.8 [NH3+]CC[NH+]1CCSCC1 Amb33512927 [0,1,0,1,0,0|2,0,0]=4 9356 B9R1.9 CC1CC(CCCO)C1 Amb23456207 [0,1,0,1,0,0|1,0,0]=3 9357 B9R1.9 CCCCC1CC(O)C1 Amb27956599 [0,1,0,1,0,0|1,0,0]=3 9358 B9R1.9 CCCCN1CC(O)C1 Amb27837475 [0,1,0,1,0,0|1,0,0]=3 9359 B9R1.9 CCCC[C@H]1C[C@H](Br)C1 Amb28121167 [0,1,0,1,0,0|2,0,0]=4 9360 B9R1.9 CCCSC1CC(O)C1 Amb32753276 [0,1,0,1,0,0|1,1,0]=4 9361 B9R1.9 CCCS[C@H]1C[C@@H](O)C1 Amb32674541 [0,1,0,1,0,0|1,1,0]=4 9362 B9R1.9 CCNCC1CC(O)C1 Amb27423766 [0,1,0,1,0,0|2,0,0]=4 9363 B9R1.9 CN1CC(OCCN)C1 Amb27209252 [0,1,0,1,0,0|2,0,0]=4 9364 B9R1.9 CN1CC(OCCO)C1 Amb27778095 [0,1,0,1,0,0|1,0,0]=3 9365 B9R1.9 CNCCN1CC(O)C1 Amb27193844 [0,1,0,1,0,0|2,0,0]=4 9366 B9R1.9 COCCN1CC(O)C1 Amb27394102 [0,1,0,1,0,0|2,0,0]=4 9367 B9R1.9 COCOC1CC(N)C1 Amb28144248 [0,1,0,1,0,0|2,0,0]=4 9368 B9R1.9 NC1CC(OCCF)C1 Amb27476651 [0,1,0,1,0,0|1,0,0]=3 9369 B9R1.9 NCCCN1CC(O)C1 Amb21959303 [0,1,0,1,0,0|2,0,0]=4 9370 B9R1.9 NCCNC1CC(N)C1 Amb28187952 [0,1,0,1,0,0|2,0,0]=4 9371 B9R1.9 O=C1CC(OCCCl)C1 Amb27632300 [0,1,0,1,0,0|1,0,1]=4 9372 B9R1.9 OC1CC(NCCF)C1 Amb27806871 [0,1,0,1,0,0|2,0,0]=4 9373 B9R1.9 OC1CN(CCCCl)C1 Amb28285125 [0,1,0,1,0,0|2,0,0]=4 9374 B9R1.9 OC1CN(CCCF)C1 Amb27424738 [0,1,0,1,0,0|2,0,0]=4 9375 B9R1.9 OCCCN1CC(O)C1 Amb27837478 [0,1,0,1,0,0|2,0,0]=4 9376 B9R1.12 BrCCCC1CCCC1 Amb19073227 [0,1,0,1,0,0|2,0,0]=4 9377 B9R1.12 BrCCCC1CCCO1 Amb18324625 [0,1,0,1,0,0|1,0,0]=3 9378 B9R1.12 BrCCCC1CCCS1 Amb32688088 [0,1,0,1,0,0|1,1,0]=4 9379 B9R1.12 BrCCCC1CCOC1 Amb26961533 [0,1,0,1,0,0|2,0,0]=4 9380 B9R1.12 BrCCCC1CCSC1 Amb33333809 [0,1,0,1,0,0|2,0,0]=4 9381 B9R1.12 BrCCCC1OCCO1 Amb17226721 [0,1,0,1,0,0|0,0,0]=2 9382 B9R1.12 BrCCCN1CCCC1 Amb8387805 [0,1,0,1,0,0|2,0,0]=4 9383 B9R1.12 BrCCCN1CCCC1 Amb8387806 [0,1,0,1,0,0|2,0,0]=4 9384 B9R1.12 BrCCC[C@@H]1CCCO1 Amb32688086 [0,1,0,1,0,0|1,0,0]=3 9385 B9R1.12 BrCCC[C@H]1CCCO1 Amb32688084 [0,1,0,1,0,0|1,0,0]=3 9386 B9R1.12 BrCCOC1CCCC1 Amb6255717 [0,1,0,1,0,0|1,0,0]=3 9387 B9R1.12 BrCCOC1CCOC1 Amb27837502 [0,1,0,1,0,0|1,0,0]=3 9388 B9R1.12 BrCCSC1CCCC1 Amb27219138 [0,1,0,1,0,0|1,1,0]=4 9389 B9R1.12 C#CCCC1CCCC1 Amb28184950 [0,1,0,1,0,0|2,0,0]=4 9390 B9R1.12 C#CCCC1CCCO1 Amb33318295 [0,1,0,1,0,0|1,0,1]=4 9391 B9R1.12 C#CCCN1CCCC1 Amb23598313 [0,1,0,1,0,0|2,0,0]=4 9392 B9R1.12 C#CCCN1CCCC1 Amb34148599 [0,1,0,1,0,0|2,0,0]=4 9393 B9R1.12 C#CCOC1CCCC1 Amb23598925 [0,1,0,1,0,0|1,0,1]=4 9394 B9R1.12 C=CCCC1CCCC1 Amb27838488 [0,1,0,1,0,0|2,0,0]=4 9395 B9R1.12 C=CCCN1CCCC1 Amb3940612 [0,1,0,1,0,0|2,0,0]=4 9396 B9R1.12 C=CCOC1CCNC1 Amb18989606 [0,1,0,1,0,0|1,0,1]=4 9397 B9R1.12 C=CCOC1CCNC1 Amb21954781 [0,1,0,1,0,0|1,0,1]=4 9398 B9R1.12 C=CCO[C@@H]1CCNC1 Amb33457281 [0,1,0,1,0,0|1,0,1]=4 9399 B9R1.12 C=CCO[C@@H]1CCNC1 Amb33457282 [0,1,0,1,0,0|1,0,1]=4 9400 B9R1.12 C=CCO[C@H]1CCNC1 Amb33217942 [0,1,0,1,0,0|1,0,1]=4 9401 B9R1.12 C=CCO[C@H]1CCNC1 Amb33217943 [0,1,0,1,0,0|1,0,1]=4 9402 B9R1.12 CCC#CC1OCCO1 Amb24741178 [0,1,0,1,0,0|0,0,1]=3 9403 B9R1.12 CCCCC1=CCCC1 Amb22227915 [0,1,0,1,0,0|2,0,0]=4 9404 B9R1.12 CCCCC1=NCCC1 Amb24053774 [0,1,0,1,0,0|2,0,0]=4 9405 B9R1.12 CCCCC1=NCCN1 Amb27639210 [0,1,0,1,0,0|2,0,0]=4 9406 B9R1.12 CCCCC1=NCCO1 Amb27244810 [0,1,0,1,0,0|1,0,0]=3 9407 B9R1.12 CCCCC1=NCCS1 Amb26872627 [0,1,0,1,0,0|1,1,0]=4 9408 B9R1.12 CCCCC1CCCC1 Amb22053873 [0,1,0,1,0,0|2,0,0]=4 9409 B9R1.12 CCCCC1CCCN1 Amb22587191 [0,1,0,1,0,0|2,0,0]=4 9410 B9R1.12 CCCCC1CCCN1 Amb9712880 [0,1,0,1,0,0|2,0,0]=4 9411 B9R1.12 CCCCC1CCCO1 Amb25238477 [0,1,0,1,0,0|1,0,0]=3 9412 B9R1.12 CCCCC1CCNC1 Amb2237160 [0,1,0,1,0,0|2,0,0]=4 9413 B9R1.12 CCCCC1OCCO1 Amb28364546 [0,1,0,1,0,0|0,0,0]=2 9414 B9R1.12 CCCCN1CCCC1 Amb8389335 [0,1,0,1,0,0|2,0,0]=4 9415 B9R1.12 CCCCN1CCCN1 Amb27778675 [0,1,0,1,0,0|2,0,0]=4 9416 B9R1.12 CCCCN1CCCO1 Amb28049539 [0,1,0,1,0,0|1,0,0]=3 9417 B9R1.12 CCCCN1CCOC1 Amb27838563 [0,1,0,1,0,0|1,0,0]=3 9418 B9R1.12 CCCCP1CCCC1 Amb28251357 [0,1,0,1,0,0|2,0,0]=4 9419 B9R1.12 CCCCP1CCNC1 Amb27872319 [0,1,0,1,0,0|2,0,0]=4 9420 B9R1.12 CCCC[C@H]1CNCN1 Amb28239669 [0,1,0,1,0,0|2,0,0]=4 9421 B9R1.12 CCCC[N+]1=CSCC1 Amb28315749 [0,1,0,1,0,0|1,1,0]=4 9422 B9R1.12 CCCNC1CCCC1 Amb2097979 [0,1,0,1,0,0|2,0,0]=4 9423 B9R1.12 CCCNC1CCCC1 Amb6259295 [0,1,0,1,0,0|2,0,0]=4 9424 B9R1.12 CCCN[C@H]1CCNC1 Amb29892385 [0,1,0,1,0,0|2,0,0]=4 9425 B9R1.12 CCCOC1CCNC1 Amb17191402 [0,1,0,1,0,0|1,0,0]=3 9426 B9R1.12 CCCOC1CCNC1 Amb33801509 [0,1,0,1,0,0|1,0,0]=3 9427 B9R1.12 CCCO[C@@H]1CCNC1 Amb26490598 [0,1,0,1,0,0|1,0,0]=3 9428 B9R1.12 CCCO[C@@H]1CCNC1 Amb34912491 [0,1,0,1,0,0|1,0,0]=3 9429 B9R1.12 CCCO[C@H]1CCNC1 Amb22752856 [0,1,0,1,0,0|1,0,0]=3 9430 B9R1.12 CCCO[C@H]1CCNC1 Amb34913934 [0,1,0,1,0,0|1,0,0]=3 9431 B9R1.12 CCCSC1CCNC1 Amb18292979 [0,1,0,1,0,0|1,1,0]=4 9432 B9R1.12 CCNCC1=COCC1 Amb28073542 [0,1,0,1,0,0|2,0,0]=4 9433 B9R1.12 CCNCC1CCCC1 Amb8853714 [0,1,0,1,0,0|2,0,0]=4 9434 B9R1.12 CCNCC1CCCN1 Amb17231855 [0,1,0,1,0,0|2,0,0]=4 9435 B9R1.12 CCNCC1CCCO1 Amb10610065 [0,1,0,1,0,0|1,0,0]=3 9436 B9R1.12 CCNCC1CCCO1 Amb9712607 [0,1,0,1,0,0|1,0,0]=3 9437 B9R1.12 CCNCC1CCOC1 Amb32410098 [0,1,0,1,0,0|2,0,0]=4 9438 B9R1.12 CCNCC1CCOC1 Amb9721559 [0,1,0,1,0,0|2,0,0]=4 9439 B9R1.12 CCNCC1OCCO1 Amb28322917 [0,1,0,1,0,0|0,0,0]=2 9440 B9R1.12 CCNCC1SCCS1 Amb35659030 [0,1,0,1,0,0|0,2,0]=4 9441 B9R1.12 CCNCN1CCCC1 Amb28250778 [0,1,0,1,0,0|2,0,0]=4 9442 B9R1.12 CCNC[C@@H]1CCCN1 Amb27446159 [0,1,0,1,0,0|2,0,0]=4 9443 B9R1.12 CCNOC1CCCC1 Amb28285317 [0,1,0,1,0,0|2,0,0]=4 9444 B9R1.12 CCOCC1CCCN1 Amb10608177 [0,1,0,1,0,0|2,0,0]=4 9445 B9R1.12 CCOCC1CCCO1 Amb4034438 [0,1,0,1,0,0|1,0,0]=3 9446 B9R1.12 CCOCC1OCCO1 Amb27830509 [0,1,0,1,0,0|0,0,0]=2 9447 B9R1.12 CCOC[C@@H]1CCCN1 Amb17061648 [0,1,0,1,0,0|2,0,0]=4 9448 B9R1.12 CCSCC1CCCC1 Amb28285763 [0,1,0,1,0,0|2,0,0]=4 9449 B9R1.12 CCSCC1CCCN1 Amb18985026 [0,1,0,1,0,0|2,0,0]=4 9450 B9R1.12 CCSCC1CCCN1 Amb35745872 [0,1,0,1,0,0|2,0,0]=4 9451 B9R1.12 CCSC[C@@H]1CCCN1 Amb27470265 [0,1,0,1,0,0|2,0,0]=4 9452 B9R1.12 CC\C=C\C1OCCO1 Amb24359824 [0,1,0,1,0,0|0,0,1]=3 9453 B9R1.12 CNCCC1CCCC1 Amb18523811 [0,1,0,1,0,0|2,0,0]=4 9454 B9R1.12 CNCCC1CCCC1 Amb34913786 [0,1,0,1,0,0|2,0,0]=4 9455 B9R1.12 CNCCC1CCCO1 Amb18300050 [0,1,0,1,0,0|1,0,0]=3 9456 B9R1.12 CNCCC1CCCO1 Amb33553009 [0,1,0,1,0,0|1,0,0]=3 9457 B9R1.12 CNCCC1CCCS1 Amb28198750 [0,1,0,1,0,0|1,1,0]=4 9458 B9R1.12 CNCCC1CCOC1 Amb18993054 [0,1,0,1,0,0|2,0,0]=4 9459 B9R1.12 CNCCC1CCOC1 Amb32410667 [0,1,0,1,0,0|2,0,0]=4 9460 B9R1.12 CNCCC1OCCO1 Amb3940020 [0,1,0,1,0,0|0,0,0]=2 9461 B9R1.12 CNCCC1SCCS1 Amb30025858 [0,1,0,1,0,0|0,2,0]=4 9462 B9R1.12 CNCCN1CCCC1 Amb19115418 [0,1,0,1,0,0|2,0,0]=4 9463 B9R1.12 CNCCN1CCCC1 Amb5493956 [0,1,0,1,0,0|2,0,0]=4 9464 B9R1.12 COCCC1CCCN1 Amb17436678 [0,1,0,1,0,0|2,0,0]=4 9465 B9R1.12 COCCC1CCNC1 Amb21959195 [0,1,0,1,0,0|2,0,0]=4 9466 B9R1.12 COCCC1SCCS1 Amb27243135 [0,1,0,1,0,0|0,2,0]=4 9467 B9R1.12 COCC[C@@H]1CCCN1 Amb26917553 [0,1,0,1,0,0|2,0,0]=4 9468 B9R1.12 COCOC1CCCN1 Amb28397279 [0,1,0,1,0,0|2,0,0]=4 9469 B9R1.12 COCOC1CCNC1 Amb28240633 [0,1,0,1,0,0|2,0,0]=4 9470 B9R1.12 COCO[C@H]1CCCN1 Amb27181178 [0,1,0,1,0,0|2,0,0]=4 9471 B9R1.12 CONCC1CCCC1 Amb27862092 [0,1,0,1,0,0|2,0,0]=4 9472 B9R1.12 CSCCC1CCCN1 Amb4134987 [0,1,0,1,0,0|2,0,0]=4 9473 B9R1.12 CSCCC1NCCS1 Amb18792524 [0,1,0,1,0,0|1,1,0]=4 9474 B9R1.12 CSCCN1CCCC1 Amb27222532 [0,1,0,1,0,0|1,1,0]=4 9475 B9R1.12 ClCCCC1CCCC1 Amb9004331 [0,1,0,1,0,0|2,0,0]=4 9476 B9R1.12 ClCCCC1CCCO1 Amb27852668 [0,1,0,1,0,0|1,0,0]=3 9477 B9R1.12 ClCCCC1CCCS1 Amb32688087 [0,1,0,1,0,0|1,1,0]=4 9478 B9R1.12 ClCCCC1CCOC1 Amb27832511 [0,1,0,1,0,0|2,0,0]=4 9479 B9R1.12 ClCCCC1OCCO1 Amb16185417 [0,1,0,1,0,0|0,0,0]=2 9480 B9R1.12 ClCCCN1CCCC1 Amb31308048 [0,1,0,1,0,0|2,0,0]=4 9481 B9R1.12 ClCCCN1CCCC1 Amb8387803 [0,1,0,1,0,0|2,0,0]=4 9482 B9R1.12 ClCCCN1CCCC1 Amb8387804 [0,1,0,1,0,0|2,0,0]=4 9483 B9R1.12 ClCCC[C@@H]1CCCO1 Amb32688085 [0,1,0,1,0,0|1,0,0]=3 9484 B9R1.12 ClCCC[C@H]1CCCO1 Amb32688083 [0,1,0,1,0,0|1,0,0]=3 9485 B9R1.12 ClCCNC1CCCC1 Amb17334277 [0,1,0,1,0,0|2,0,0]=4 9486 B9R1.12 ClCCNC1CCSC1 Amb35697019 [0,1,0,1,0,0|2,0,0]=4 9487 B9R1.12 ClCCOC1CCOC1 Amb27654193 [0,1,0,1,0,0|1,0,0]=3 9488 B9R1.12 ClCCOC1COCO1 Amb25808402 [0,1,0,1,0,0|2,0,0]=4 9489 B9R1.12 ClCCSC1CCCC1 Amb27837448 [0,1,0,1,0,0|1,1,0]=4 9490 B9R1.12 ClCCSC1CCOC1 Amb28370409 [0,1,0,1,0,0|1,1,0]=4 9491 B9R1.12 ClCCSC1CCSC1 Amb35688975 [0,1,0,1,0,0|1,1,0]=4 9492 B9R1.12 ClCOCC1CCCO1 Amb27882672 [0,1,0,1,0,0|2,0,0]=4 9493 B9R1.12 ClCSCC1CCCC1 Amb28042948 [0,1,0,1,0,0|2,0,0]=4 9494 B9R1.12 FCCCC1CCCN1 Amb27778370 [0,1,0,1,0,0|2,0,0]=4 9495 B9R1.12 FCCCC1CCNC1 Amb22011551 [0,1,0,1,0,0|2,0,0]=4 9496 B9R1.12 FCCNC1CCCC1 Amb27489305 [0,1,0,1,0,0|2,0,0]=4 9497 B9R1.12 FCCOC1CCNC1 Amb23571354 [0,1,0,1,0,0|1,0,0]=3 9498 B9R1.12 ICCCC1CCCC1 Amb27969560 [0,1,0,1,0,0|2,0,0]=4 9499 B9R1.12 ICCCC1CCOC1 Amb27172797 [0,1,0,1,0,0|2,0,0]=4 9500 B9R1.12 ICCCN1CCCC1 Amb25147182 [0,1,0,1,0,0|2,0,0]=4 9501 B9R1.12 ICCCN1CCCC1 Amb33734657 [0,1,0,1,0,0|2,0,0]=4 9502 B9R1.12 ICCNC1CCSC1 Amb35697020 [0,1,0,1,0,0|2,0,0]=4 9503 B9R1.12 N#CCCC1CCCC1 Amb24502326 [0,1,0,1,0,0|2,0,0]=4 9504 B9R1.12 N#CCCC1CCCO1 Amb28287223 [0,1,0,1,0,0|1,0,1]=4 9505 B9R1.12 N#CCCC1OCCO1 Amb17334092 [0,1,0,1,0,0|0,0,1]=3 9506 B9R1.12 N#CCCN1CCCC1 Amb4010705 [0,1,0,1,0,0|2,0,0]=4 9507 B9R1.12 N#CCOC1CCCC1 Amb6271315 [0,1,0,1,0,0|1,0,1]=4 9508 B9R1.12 N#CCOC1CCOC1 Amb27751428 [0,1,0,1,0,0|1,0,1]=4 9509 B9R1.12 NCCC=C1CCCC1 Amb27248131 [0,1,0,1,0,0|2,0,0]=4 9510 B9R1.12 NCCCC1CCCC1 Amb10609767 [0,1,0,1,0,0|2,0,0]=4 9511 B9R1.12 NCCCC1CCCC1 Amb6662634 [0,1,0,1,0,0|2,0,0]=4 9512 B9R1.12 NCCCC1CCCN1 Amb18642686 [0,1,0,1,0,0|2,0,0]=4 9513 B9R1.12 NCCCC1CCCO1 Amb18301442 [0,1,0,1,0,0|1,0,0]=3 9514 B9R1.12 NCCCC1CCCS1 Amb33416228 [0,1,0,1,0,0|1,1,0]=4 9515 B9R1.12 NCCCC1CCOC1 Amb1090895 [0,1,0,1,0,0|2,0,0]=4 9516 B9R1.12 NCCCC1CCOC1 Amb21954298 [0,1,0,1,0,0|2,0,0]=4 9517 B9R1.12 NCCCC1CCSC1 Amb33142528 [0,1,0,1,0,0|2,0,0]=4 9518 B9R1.12 NCCCC1OCCO1 Amb17087679 [0,1,0,1,0,0|0,0,0]=2 9519 B9R1.12 NCCCC1SCCS1 Amb27637636 [0,1,0,1,0,0|0,2,0]=4 9520 B9R1.12 NCCCN1CCCC1 Amb1154419 [0,1,0,1,0,0|2,0,0]=4 9521 B9R1.12 NCCC[C@@H]1CCCO1 Amb33620903 [0,1,0,1,0,0|1,0,0]=3 9522 B9R1.12 NCCC[C@@H]1CCCO1 Amb33747126 [0,1,0,1,0,0|1,0,0]=3 9523 B9R1.12 NCCC[C@H]1CCCO1 Amb33620902 [0,1,0,1,0,0|1,0,0]=3 9524 B9R1.12 NCCC[C@H]1CCCO1 Amb33736454 [0,1,0,1,0,0|1,0,0]=3 9525 B9R1.12 NCCNC1CCCC1 Amb17091017 [0,1,0,1,0,0|2,0,0]=4 9526 B9R1.12 NCCNC1CCCC1 Amb29844467 [0,1,0,1,0,0|2,0,0]=4 9527 B9R1.12 NCCNC1CCOC1 Amb27633124 [0,1,0,1,0,0|2,0,0]=4 9528 B9R1.12 NCCNN1CCCC1 Amb18062203 [0,1,0,1,0,0|2,0,0]=4 9529 B9R1.12 NCCOB1CCCO1 Amb27597284 [0,1,0,1,0,0|2,0,0]=4 9530 B9R1.12 NCCOC1CCCC1 Amb1127307 [0,1,0,1,0,0|1,0,0]=3 9531 B9R1.12 NCCOC1CCCC1 Amb33548703 [0,1,0,1,0,0|1,0,0]=3 9532 B9R1.12 NCCOC1CCCO1 Amb18203179 [0,1,0,1,0,0|1,0,0]=3 9533 B9R1.12 NCCOC1CCOC1 Amb26905849 [0,1,0,1,0,0|1,0,0]=3 9534 B9R1.12 NCCOC1CCSC1 Amb24740561 [0,1,0,1,0,0|1,0,0]=3 9535 B9R1.12 NCCOP1OCCO1 Amb28386015 [0,1,0,1,0,0|2,0,0]=4 9536 B9R1.12 NCCSC1CCCC1 Amb19389681 [0,1,0,1,0,0|1,1,0]=4 9537 B9R1.12 NCCSC1CCCC1 Amb6267365 [0,1,0,1,0,0|1,1,0]=4 9538 B9R1.12 NCCSC1CCSC1 Amb29863178 [0,1,0,1,0,0|1,1,0]=4 9539 B9R1.12 NNCCC1CCCC1 Amb6250554 [0,1,0,1,0,0|2,0,0]=4 9540 B9R1.12 NNCCC1CCCO1 Amb27490814 [0,1,0,1,0,0|2,0,0]=4 9541 B9R1.12 NNCCN1CCCC1 Amb22489702 [0,1,0,1,0,0|2,0,0]=4 9542 B9R1.12 NOCCC1CCCC1 Amb27617248 [0,1,0,1,0,0|1,0,0]=3 9543 B9R1.12 NOCCC1CCCO1 Amb25269925 [0,1,0,1,0,0|2,0,0]=4 9544 B9R1.12 NOCCC1CCCS1 Amb33415856 [0,1,0,1,0,0|2,0,0]=4 9545 B9R1.12 NOCCC1CCOC1 Amb24538931 [0,1,0,1,0,0|2,0,0]=4 9546 B9R1.12 NOCCC1CCSC1 Amb33141529 [0,1,0,1,0,0|2,0,0]=4 9547 B9R1.12 NOCCN1CCCC1 Amb17104844 [0,1,0,1,0,0|1,0,0]=3 9548 B9R1.12 NOCOC1CCOC1 Amb28070227 [0,1,0,1,0,0|2,0,0]=4 9549 B9R1.12 O=CCCC1CCCC1 Amb8009615 [0,1,0,1,0,0|1,0,1]=4 9550 B9R1.12 O=CCCC1CCCO1 Amb22489681 [0,1,0,1,0,0|1,0,1]=4 9551 B9R1.12 O=CCCC1OCCO1 Amb10567127 [0,1,0,1,0,0|0,0,1]=3 9552 B9R1.12 O=CCCN1CCCC1 Amb27837417 [0,1,0,1,0,0|1,0,1]=4 9553 B9R1.12 O=CCOC1CCCC1 Amb27169387 [0,1,0,1,0,0|0,0,2]=4 9554 B9R1.12 O=CCOC1CCCO1 Amb18203202 [0,1,0,1,0,0|0,0,2]=4 9555 B9R1.12 OCC#CC1OCCO1 Amb25346874 [0,1,0,1,0,0|0,0,2]=4 9556 B9R1.12 OCCCC1=CCCC1 Amb24457013 [0,1,0,1,0,0|1,0,1]=4 9557 B9R1.12 OCCCC1=NCCC1 Amb24558706 [0,1,0,1,0,0|1,0,1]=4 9558 B9R1.12 OCCCC1CC=CC1 Amb28315438 [0,1,0,1,0,0|1,0,1]=4 9559 B9R1.12 OCCCC1CCCC1 Amb3939088 [0,1,0,1,0,0|1,0,0]=3 9560 B9R1.12 OCCCC1CCCN1 Amb8630848 [0,1,0,1,0,0|1,0,0]=3 9561 B9R1.12 OCCCC1CCCO1 Amb17939196 [0,1,0,1,0,0|1,0,0]=3 9562 B9R1.12 OCCCC1CCCS1 Amb33416795 [0,1,0,1,0,0|1,0,0]=3 9563 B9R1.12 OCCCC1CCNC1 Amb24674180 [0,1,0,1,0,0|1,0,0]=3 9564 B9R1.12 OCCCC1CCSC1 Amb33141523 [0,1,0,1,0,0|1,0,0]=3 9565 B9R1.12 OCCCC1OCCO1 Amb26873836 [0,1,0,1,0,0|0,0,0]=2 9566 B9R1.12 OCCCN1CCCC1 Amb8387818 [0,1,0,1,0,0|1,0,0]=3 9567 B9R1.12 OCCC[C@@H]1CCCN1 Amb25145987 [0,1,0,1,0,0|1,0,0]=3 9568 B9R1.12 OCCC[C@@H]1CCCN1 Amb33309673 [0,1,0,1,0,0|1,0,0]=3 9569 B9R1.12 OCCC[C@@H]1CCCO1 Amb27631987 [0,1,0,1,0,0|1,0,0]=3 9570 B9R1.12 OCCC[C@H]1CCCN1 Amb27879933 [0,1,0,1,0,0|1,0,0]=3 9571 B9R1.12 OCCC[C@H]1CCCN1 Amb33309582 [0,1,0,1,0,0|1,0,0]=3 9572 B9R1.12 OCCC[C@H]1CCCO1 Amb27617649 [0,1,0,1,0,0|1,0,0]=3 9573 B9R1.12 OCCNC1=NCCC1 Amb10976567 [0,1,0,1,0,0|1,0,1]=4 9574 B9R1.12 OCCNC1CCCC1 Amb10609474 [0,1,0,1,0,0|1,0,0]=3 9575 B9R1.12 OCCNC1CCCC1 Amb6707359 [0,1,0,1,0,0|1,0,0]=3 9576 B9R1.12 OCCN[C@@H]1CCNC1 Amb28325934 [0,1,0,1,0,0|1,0,0]=3 9577 B9R1.12 OCCN[C@H]1CCNC1 Amb29892386 [0,1,0,1,0,0|1,0,0]=3 9578 B9R1.12 OCCOC1CCCC1 Amb6893052 [0,1,0,1,0,0|0,0,0]=2 9579 B9R1.12 OCCOC1CCCO1 Amb28315545 [0,1,0,1,0,0|0,0,0]=2 9580 B9R1.12 OCCOC1CCNC1 Amb23570376 [0,1,0,1,0,0|0,0,0]=2 9581 B9R1.12 OCCOC1CCNC1 Amb35753116 [0,1,0,1,0,0|0,0,0]=2 9582 B9R1.12 OCCOC1CCOC1 Amb25338417 [0,1,0,1,0,0|0,0,0]=2 9583 B9R1.12 OCCOP1OCCO1 Amb26516185 [0,1,0,1,0,0|2,0,0]=4 9584 B9R1.12 OCCSC1CCCC1 Amb9362979 [0,1,0,1,0,0|0,1,0]=3 9585 B9R1.12 OCCSC1CCNC1 Amb18988573 [0,1,0,1,0,0|0,1,0]=3 9586 B9R1.12 OCCSC1CCSC1 Amb29863338 [0,1,0,1,0,0|0,1,0]=3 9587 B9R1.12 OCOCN1CCOC1 Amb25917527 [0,1,0,1,0,0|2,0,0]=4 9588 B9R1.12 OC\C=C\C1CCCC1 Amb33428704 [0,1,0,1,0,0|1,0,1]=4 9589 B9R1.12 OC\C=C\C1CCCO1 Amb33226990 [0,1,0,1,0,0|1,0,1]=4 9590 B9R1.12 OC\C=C\C1CCCS1 Amb33414579 [0,1,0,1,0,0|1,0,1]=4 9591 B9R1.12 OC\C=C\C1CCOC1 Amb33359633 [0,1,0,1,0,0|1,0,1]=4 9592 B9R1.12 OC\C=C\C1CCSC1 Amb32953834 [0,1,0,1,0,0|1,0,1]=4 9593 B9R1.12 OC\C=C\C1OCCO1 Amb27484833 [0,1,0,1,0,0|0,0,2]=4 9594 B9R1.12 ONCCC1CCCC1 Amb27785800 [0,1,0,1,0,0|1,0,0]=3 9595 B9R1.12 O\N=C\CC1CCCC1 Amb27618400 [0,1,0,1,0,0|1,0,1]=4 9596 B9R1.12 SCCCC1CCCC1 Amb27764782 [0,1,0,1,0,0|1,1,0]=4 9597 B9R1.12 SCCCC1CCCO1 Amb26321954 [0,1,0,1,0,0|1,0,0]=3 9598 B9R1.12 SCCCC1CCCS1 Amb33415368 [0,1,0,1,0,0|1,1,0]=4 9599 B9R1.12 SCCCC1CCOC1 Amb27221392 [0,1,0,1,0,0|1,1,0]=4 9600 B9R1.12 SCCCC1CCSC1 Amb33344976 [0,1,0,1,0,0|1,1,0]=4 9601 B9R1.12 SCCCN1CCCC1 Amb27197407 [0,1,0,1,0,0|1,1,0]=4 9602 B9R1.12 SCCNC1CCCC1 Amb28062002 [0,1,0,1,0,0|1,1,0]=4 9603 B9R1.12 SCCNC1CCSC1 Amb27765065 [0,1,0,1,0,0|1,1,0]=4 9604 B9R1.12 SCCOC1CCCC1 Amb28454066 [0,1,0,1,0,0|0,1,0]=3 9605 B9R1.12 SCCSC1CCCC1 Amb27184805 [0,1,0,1,0,0|0,2,0]=4 9606 B9R1.12 [C-]#[N+]CCC1CCCC1 Amb33315795 [0,1,0,1,0,0|2,0,0]=4 9607 B9R1.12 [C-]#[N+]CCC1CCCO1 Amb33318739 [0,1,0,1,0,0|1,0,1]=4 9608 B9R1.12 [C-]#[N+]CCN1CCCC1 Amb1981099 [0,1,0,1,0,0|2,0,0]=4 9609 B9R1.15 C#CC1CCCCC1C Amb24602567 [0,1,0,1,0,0|2,0,0]=4 9610 B9R1.15 C#CC1CCCCC1O Amb27466451 [0,1,0,1,0,0|1,0,1]=4 9611 B9R1.15 C#CC1COCCN1C Amb33169128 [0,1,0,1,0,0|2,0,0]=4 9612 B9R1.15 C#CC1OCCCC1Cl Amb28342692 [0,1,0,1,0,0|1,0,1]=4 9613 B9R1.15 C#CC1OCCCC1O Amb28069517 [0,1,0,1,0,0|1,0,1]=4 9614 B9R1.15 C#C[C@@H]1CCCC[C@@H]1O Amb26892452 [0,1,0,1,0,0|1,0,1]=4 9615 B9R1.15 C#C[C@@H]1CCCC[C@H]1O Amb25990553 [0,1,0,1,0,0|1,0,1]=4 9616 B9R1.15 C#C[C@@H]1OCCC[C@H]1O Amb28292172 [0,1,0,1,0,0|1,0,1]=4 9617 B9R1.15 C=C1CCCCC1CC Amb27952112 [0,1,0,1,0,0|2,0,0]=4 9618 B9R1.15 C=CC1CCCCC1O Amb25706048 [0,1,0,1,0,0|1,0,1]=4 9619 B9R1.15 C=CC1OCCCC1N Amb25175715 [0,1,0,1,0,0|1,0,1]=4 9620 B9R1.15 C=CC1OCCCC1N Amb32662671 [0,1,0,1,0,0|1,0,1]=4 9621 B9R1.15 C=CC1OCCCC1O Amb27972502 [0,1,0,1,0,0|1,0,1]=4 9622 B9R1.15 C=C[C@@H]1CCCC[C@@H]1O Amb27427803 [0,1,0,1,0,0|1,0,1]=4 9623 B9R1.15 C=C[C@@H]1CCCC[C@H]1O Amb22802080 [0,1,0,1,0,0|1,0,1]=4 9624 B9R1.15 C=C[C@@H]1COCC[C@@H]1O Amb28129747 [0,1,0,1,0,0|0,0,2]=4 9625 B9R1.15 C=C[C@@H]1OCCC[C@H]1Cl Amb27419913 [0,1,0,1,0,0|1,0,1]=4 9626 B9R1.15 C=C[C@@H]1OCCC[C@H]1N Amb25250863 [0,1,0,1,0,0|1,0,1]=4 9627 B9R1.15 C=C[C@@H]1OCCC[C@H]1N Amb32662701 [0,1,0,1,0,0|1,0,1]=4 9628 B9R1.15 C=C[C@@H]1OCCC[C@H]1O Amb27205666 [0,1,0,1,0,0|1,0,1]=4 9629 B9R1.15 C=C[C@H]1CCCC[C@@H]1O Amb28256773 [0,1,0,1,0,0|1,0,1]=4 9630 B9R1.15 CC1=C(CO)CCCC1 Amb27969811 [0,1,0,1,0,0|1,0,1]=4 9631 B9R1.15 CC1CC=CCC1CO Amb3939090 [0,1,0,1,0,0|1,0,1]=4 9632 B9R1.15 CC1CCCCC1C#N Amb8950075 [0,1,0,1,0,0|2,0,0]=4 9633 B9R1.15 CC1CCCCC1C=O Amb18642449 [0,1,0,1,0,0|1,0,1]=4 9634 B9R1.15 CC1CCCCC1CBr Amb28458445 [0,1,0,1,0,0|2,0,0]=4 9635 B9R1.15 CC1CCCCC1CN Amb10610368 [0,1,0,1,0,0|2,0,0]=4 9636 B9R1.15 CC1CCCCC1CN Amb8950173 [0,1,0,1,0,0|2,0,0]=4 9637 B9R1.15 CC1CCCCC1CO Amb25804856 [0,1,0,1,0,0|1,0,0]=3 9638 B9R1.15 CC1CCCCC1CS Amb27231870 [0,1,0,1,0,0|1,1,0]=4 9639 B9R1.15 CC1CCCCC1NN Amb10610508 [0,1,0,1,0,0|2,0,0]=4 9640 B9R1.15 CC1CCCCC1NN Amb28990939 [0,1,0,1,0,0|2,0,0]=4 9641 B9R1.15 CC1CCCCC1NN Amb6249151 [0,1,0,1,0,0|2,0,0]=4 9642 B9R1.15 CC1CCCC\C1=N\O Amb19650930 [0,1,0,1,0,0|1,0,1]=4 9643 B9R1.15 CC1CCCNC1CN Amb24730245 [0,1,0,1,0,0|2,0,0]=4 9644 B9R1.15 CC1CCCNC1CO Amb22886363 [0,1,0,1,0,0|1,0,0]=3 9645 B9R1.15 CC1CCCNC1CO Amb32658045 [0,1,0,1,0,0|1,0,0]=3 9646 B9R1.15 CC1CCCOC1CN Amb28342443 [0,1,0,1,0,0|1,0,0]=3 9647 B9R1.15 CC1CCNCC1CO Amb24117064 [0,1,0,1,0,0|1,0,0]=3 9648 B9R1.15 CC1CCOCC1CN Amb27607222 [0,1,0,1,0,0|1,0,0]=3 9649 B9R1.15 CC1CNCCC1CN Amb28206827 [0,1,0,1,0,0|2,0,0]=4 9650 B9R1.15 CC1CNCCC1CO Amb27766043 [0,1,0,1,0,0|1,0,0]=3 9651 B9R1.15 CC1CNCCC1NO Amb28350547 [0,1,0,1,0,0|2,0,0]=4 9652 B9R1.15 CC1COCCC1C#N Amb25977566 [0,1,0,1,0,0|1,0,1]=4 9653 B9R1.15 CC1COCCC1CN Amb25274303 [0,1,0,1,0,0|1,0,0]=3 9654 B9R1.15 CC1COCCC1CN Amb32652895 [0,1,0,1,0,0|1,0,0]=3 9655 B9R1.15 CC1NCCCC1CN Amb26491562 [0,1,0,1,0,0|2,0,0]=4 9656 B9R1.15 CC1NCCCC1CO Amb22886280 [0,1,0,1,0,0|1,0,0]=3 9657 B9R1.15 CC1NCCNC1CO Amb32669056 [0,1,0,1,0,0|1,0,0]=3 9658 B9R1.15 CC1OCCNC1CO Amb24693650 [0,1,0,1,0,0|1,0,0]=3 9659 B9R1.15 CC1OCCSC1CN Amb28052761 [0,1,0,1,0,0|1,1,0]=4 9660 B9R1.15 CCC1=CCCCC1O Amb27808543 [0,1,0,1,0,0|1,0,1]=4 9661 B9R1.15 CCC1CC=CCC1N Amb27237513 [0,1,0,1,0,0|2,0,0]=4 9662 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,1,0,1,0,0|1,0,1]=4 9663 B9R1.15 CCC1CCCCC1Br Amb19076564 [0,1,0,1,0,0|2,0,0]=4 9664 B9R1.15 CCC1CCCCC1C Amb22232355 [0,1,0,1,0,0|2,0,0]=4 9665 B9R1.15 CCC1CCCCC1Cl Amb27751430 [0,1,0,1,0,0|2,0,0]=4 9666 B9R1.15 CCC1CCCCC1N Amb9776218 [0,1,0,1,0,0|2,0,0]=4 9667 B9R1.15 CCC1CCCCC1O Amb6608702 [0,1,0,1,0,0|1,0,0]=3 9668 B9R1.15 CCC1CCCCC1S Amb25360773 [0,1,0,1,0,0|1,1,0]=4 9669 B9R1.15 CCC1CCCCN1N Amb836844 [0,1,0,1,0,0|2,0,0]=4 9670 B9R1.15 CCC1CCCCN1O Amb27483076 [0,1,0,1,0,0|1,0,0]=3 9671 B9R1.15 CCC1CCCNC1C Amb25727319 [0,1,0,1,0,0|2,0,0]=4 9672 B9R1.15 CCC1CCNCC1C Amb28287502 [0,1,0,1,0,0|2,0,0]=4 9673 B9R1.15 CCC1CCNCC1N Amb26360377 [0,1,0,1,0,0|2,0,0]=4 9674 B9R1.15 CCC1CCOCC1=O Amb33295409 [0,1,0,1,0,0|0,0,2]=4 9675 B9R1.15 CCC1CNCCC1=O Amb18642532 [0,1,0,1,0,0|1,0,1]=4 9676 B9R1.15 CCC1CNCCC1=O Amb23400918 [0,1,0,1,0,0|1,0,1]=4 9677 B9R1.15 CCC1CNCCC1C Amb18642547 [0,1,0,1,0,0|2,0,0]=4 9678 B9R1.15 CCC1CNCCC1F Amb27634236 [0,1,0,1,0,0|2,0,0]=4 9679 B9R1.15 CCC1CNCCC1N Amb24101086 [0,1,0,1,0,0|2,0,0]=4 9680 B9R1.15 CCC1CNCCN1C Amb10607749 [0,1,0,1,0,0|2,0,0]=4 9681 B9R1.15 CCC1CNCCN1C Amb22587615 [0,1,0,1,0,0|2,0,0]=4 9682 B9R1.15 CCC1CNCCN1O Amb28049058 [0,1,0,1,0,0|1,0,0]=3 9683 B9R1.15 CCC1CNCCS1=O Amb27402984 [0,1,0,1,0,0|1,0,1]=4 9684 B9R1.15 CCC1COCCC1=O Amb25687037 [0,1,0,1,0,0|0,0,1]=3 9685 B9R1.15 CCC1NCCCC1C Amb6259877 [0,1,0,1,0,0|2,0,0]=4 9686 B9R1.15 CCC1NCCCC1N Amb33275583 [0,1,0,1,0,0|2,0,0]=4 9687 B9R1.15 CCC1NCCNC1C Amb27607606 [0,1,0,1,0,0|2,0,0]=4 9688 B9R1.15 CCC1OCCCC1Br Amb27490966 [0,1,0,1,0,0|1,0,0]=3 9689 B9R1.15 CCC1OCCNC1C Amb9004253 [0,1,0,1,0,0|1,0,0]=3 9690 B9R1.15 CCN1CCNCC1C Amb2694472 [0,1,0,1,0,0|2,0,0]=4 9691 B9R1.15 CCN1CCNC[C@@H]1C Amb25774363 [0,1,0,1,0,0|2,0,0]=4 9692 B9R1.15 CCN1CCNC[C@H]1C Amb26491936 [0,1,0,1,0,0|2,0,0]=4 9693 B9R1.15 CCN1CCNC[C@H]1C Amb34912507 [0,1,0,1,0,0|2,0,0]=4 9694 B9R1.15 CC[C@@H]1C=CCC[C@H]1O Amb27632001 [0,1,0,1,0,0|1,0,1]=4 9695 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,1,0,1,0,0|1,0,1]=4 9696 B9R1.15 CC[C@@H]1CCCC[C@@H]1N Amb27438938 [0,1,0,1,0,0|2,0,0]=4 9697 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [0,1,0,1,0,0|1,0,0]=3 9698 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [0,1,0,1,0,0|1,0,1]=4 9699 B9R1.15 CC[C@@H]1CNCCN1C Amb22587563 [0,1,0,1,0,0|2,0,0]=4 9700 B9R1.15 CC[C@@H]1CNCCN1C Amb23385293 [0,1,0,1,0,0|2,0,0]=4 9701 B9R1.15 CC[C@@H]1COCC[C@@H]1Br Amb27632469 [0,1,0,1,0,0|1,0,0]=3 9702 B9R1.15 CC[C@@H]1COCOC1O Amb28065311 [0,1,0,1,0,0|0,0,0]=2 9703 B9R1.15 CC[C@H]1CCCCC1N Amb27412189 [0,1,0,1,0,0|2,0,0]=4 9704 B9R1.15 CC[C@H]1CCCCN1Cl Amb27653574 [0,1,0,1,0,0|2,0,0]=4 9705 B9R1.15 CC[C@H]1CCCC[C@@H]1C Amb25911410 [0,1,0,1,0,0|2,0,0]=4 9706 B9R1.15 CC[C@H]1CCCC[C@@H]1O Amb27852810 [0,1,0,1,0,0|1,0,0]=3 9707 B9R1.15 CC[C@H]1CCCC[C@H]1C Amb25294655 [0,1,0,1,0,0|2,0,0]=4 9708 B9R1.15 CC[C@H]1CCCC[C@H]1N Amb27848812 [0,1,0,1,0,0|2,0,0]=4 9709 B9R1.15 CC[C@H]1CCCC[C@H]1O Amb28061782 [0,1,0,1,0,0|1,0,0]=3 9710 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,1,0,1,0,0|1,0,1]=4 9711 B9R1.15 CC[C@H]1CCNC[C@H]1N Amb28057730 [0,1,0,1,0,0|2,0,0]=4 9712 B9R1.15 CC[C@H]1CNCCN1C Amb23385284 [0,1,0,1,0,0|2,0,0]=4 9713 B9R1.15 CC[C@H]1COCOC1O Amb27853900 [0,1,0,1,0,0|0,0,0]=2 9714 B9R1.15 CN1CCCCC1CBr Amb21961477 [0,1,0,1,0,0|2,0,0]=4 9715 B9R1.15 CN1CCCCC1CBr Amb6316170 [0,1,0,1,0,0|2,0,0]=4 9716 B9R1.15 CN1CCCCC1CCl Amb10068244 [0,1,0,1,0,0|2,0,0]=4 9717 B9R1.15 CN1CCCCC1CCl Amb9174214 [0,1,0,1,0,0|2,0,0]=4 9718 B9R1.15 CN1CCCCC1CN Amb22727986 [0,1,0,1,0,0|2,0,0]=4 9719 B9R1.15 CN1CCCCC1CN Amb8503454 [0,1,0,1,0,0|2,0,0]=4 9720 B9R1.15 CN1CCCCC1CN Amb9731145 [0,1,0,1,0,0|2,0,0]=4 9721 B9R1.15 CN1CCCCC1CO Amb607577 [0,1,0,1,0,0|1,0,0]=3 9722 B9R1.15 CN1CCCCC1CS Amb27272821 [0,1,0,1,0,0|1,1,0]=4 9723 B9R1.15 CN1CCCC[C@@H]1CN Amb24411478 [0,1,0,1,0,0|2,0,0]=4 9724 B9R1.15 CN1CCCC[C@@H]1CO Amb22744972 [0,1,0,1,0,0|1,0,0]=3 9725 B9R1.15 CN1CCCC[C@H]1CCl Amb27831756 [0,1,0,1,0,0|2,0,0]=4 9726 B9R1.15 CN1CCCC[C@H]1CN Amb27249510 [0,1,0,1,0,0|2,0,0]=4 9727 B9R1.15 CN1CCCC[C@H]1CO Amb26917816 [0,1,0,1,0,0|1,0,0]=3 9728 B9R1.15 CN1CCNCC1CO Amb17578109 [0,1,0,1,0,0|2,0,0]=4 9729 B9R1.15 CN1CCNCC1CO Amb22587293 [0,1,0,1,0,0|2,0,0]=4 9730 B9R1.15 CN1CCOCC1C#N Amb19888951 [0,1,0,1,0,0|2,0,0]=4 9731 B9R1.15 CN1CCOCC1C=O Amb35666648 [0,1,0,1,0,0|1,0,1]=4 9732 B9R1.15 CN1CCOCC1CBr Amb26040246 [0,1,0,1,0,0|2,0,0]=4 9733 B9R1.15 CN1CCOCC1CCl Amb27656293 [0,1,0,1,0,0|2,0,0]=4 9734 B9R1.15 CN1CCOCC1CN Amb18560558 [0,1,0,1,0,0|2,0,0]=4 9735 B9R1.15 CN1CCOCC1CO Amb27664360 [0,1,0,1,0,0|1,0,0]=3 9736 B9R1.15 CN1CCOCC1CO Amb30867931 [0,1,0,1,0,0|1,0,0]=3 9737 B9R1.15 CN1CCOC[C@@H]1CN Amb28201363 [0,1,0,1,0,0|2,0,0]=4 9738 B9R1.15 CN1CCOC[C@@H]1CN Amb31291628 [0,1,0,1,0,0|2,0,0]=4 9739 B9R1.15 CN1CCOC[C@@H]1CO Amb26026394 [0,1,0,1,0,0|1,0,0]=3 9740 B9R1.15 CN1CCOC[C@@H]1CO Amb34916358 [0,1,0,1,0,0|1,0,0]=3 9741 B9R1.15 CN1CCOC[C@H]1CN Amb24556108 [0,1,0,1,0,0|2,0,0]=4 9742 B9R1.15 CN1CCOC[C@H]1CN Amb33801268 [0,1,0,1,0,0|2,0,0]=4 9743 B9R1.15 CN1CCOC[C@H]1CO Amb28429680 [0,1,0,1,0,0|1,0,0]=3 9744 B9R1.15 CN1CCOC[C@H]1CO Amb33743375 [0,1,0,1,0,0|1,0,0]=3 9745 B9R1.15 CNC1CCCCC1C Amb1116060 [0,1,0,1,0,0|2,0,0]=4 9746 B9R1.15 CNC1CCCCC1C Amb6239354 [0,1,0,1,0,0|2,0,0]=4 9747 B9R1.15 CNC1CCCCC1F Amb23443827 [0,1,0,1,0,0|2,0,0]=4 9748 B9R1.15 CNC1CCCCC1O Amb2607700 [0,1,0,1,0,0|1,0,0]=3 9749 B9R1.15 CNC1CCCCC1S Amb18644222 [0,1,0,1,0,0|1,1,0]=4 9750 B9R1.15 CNC1CCNCC1C Amb24376691 [0,1,0,1,0,0|2,0,0]=4 9751 B9R1.15 CNC1CCOCC1C Amb22301329 [0,1,0,1,0,0|1,0,0]=3 9752 B9R1.15 CNC1CCSCC1C Amb27792108 [0,1,0,1,0,0|1,1,0]=4 9753 B9R1.15 CNC1CNCCC1O Amb32753118 [0,1,0,1,0,0|2,0,0]=4 9754 B9R1.15 CNC1OCCCC1C Amb27605762 [0,1,0,1,0,0|2,0,0]=4 9755 B9R1.15 CN[C@@H]1CCCC[C@@H]1C Amb25742534 [0,1,0,1,0,0|2,0,0]=4 9756 B9R1.15 CN[C@@H]1CCCC[C@@H]1O Amb1993808 [0,1,0,1,0,0|1,0,0]=3 9757 B9R1.15 CN[C@@H]1CCCC[C@@H]1S Amb27249842 [0,1,0,1,0,0|1,1,0]=4 9758 B9R1.15 CN[C@@H]1CCCC[C@H]1N Amb27467467 [0,1,0,1,0,0|2,0,0]=4 9759 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993807 [0,1,0,1,0,0|1,0,0]=3 9760 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993918 [0,1,0,1,0,0|1,0,0]=3 9761 B9R1.15 CN[C@@H]1CCCC[C@H]1S Amb27188343 [0,1,0,1,0,0|1,1,0]=4 9762 B9R1.15 CN[C@@H]1CNCC[C@@H]1C Amb27645757 [0,1,0,1,0,0|2,0,0]=4 9763 B9R1.15 CN[C@H]1CCCC[C@@H]1C Amb27195019 [0,1,0,1,0,0|2,0,0]=4 9764 B9R1.15 CN[C@H]1CCCC[C@@H]1O Amb5562396 [0,1,0,1,0,0|1,0,0]=3 9765 B9R1.15 CN[C@H]1CCCC[C@H]1O Amb2786031 [0,1,0,1,0,0|1,0,0]=3 9766 B9R1.15 CN[C@H]1CNCC[C@@H]1O Amb32657883 [0,1,0,1,0,0|2,0,0]=4 9767 B9R1.15 CN[C@H]1CNCC[C@H]1C Amb26564267 [0,1,0,1,0,0|2,0,0]=4 9768 B9R1.15 COC1CCCCC1Br Amb18321009 [0,1,0,1,0,0|2,0,0]=4 9769 B9R1.15 COC1CCCCC1I Amb25189979 [0,1,0,1,0,0|2,0,0]=4 9770 B9R1.15 COC1CCCCC1N Amb23438872 [0,1,0,1,0,0|2,0,0]=4 9771 B9R1.15 COC1CCCCC1N Amb6660864 [0,1,0,1,0,0|2,0,0]=4 9772 B9R1.15 COC1CCCCC1O Amb9283578 [0,1,0,1,0,0|1,0,0]=3 9773 B9R1.15 COC1CCCCC1S Amb25868109 [0,1,0,1,0,0|1,1,0]=4 9774 B9R1.15 COC1CCCC[C@H]1N Amb27430189 [0,1,0,1,0,0|2,0,0]=4 9775 B9R1.15 COC1CCCOC1O Amb27196451 [0,1,0,1,0,0|2,0,0]=4 9776 B9R1.15 COC1CCNCC1C Amb22755833 [0,1,0,1,0,0|2,0,0]=4 9777 B9R1.15 COC1CCNCC1C Amb28934978 [0,1,0,1,0,0|2,0,0]=4 9778 B9R1.15 COC1CCNCC1F Amb25286219 [0,1,0,1,0,0|2,0,0]=4 9779 B9R1.15 COC1CCNCC1N Amb25845660 [0,1,0,1,0,0|2,0,0]=4 9780 B9R1.15 COC1CCNCC1N Amb33457644 [0,1,0,1,0,0|2,0,0]=4 9781 B9R1.15 COC1CCOCC1N Amb18203181 [0,1,0,1,0,0|1,0,0]=3 9782 B9R1.15 COC1CCOCC1O Amb27838564 [0,1,0,1,0,0|0,0,0]=2 9783 B9R1.15 COC1CNCCC1C Amb25889761 [0,1,0,1,0,0|1,0,0]=3 9784 B9R1.15 COC1CNCCC1C Amb32758728 [0,1,0,1,0,0|1,0,0]=3 9785 B9R1.15 COC1CNCCC1N Amb18642809 [0,1,0,1,0,0|2,0,0]=4 9786 B9R1.15 COC1CNCCC1N Amb24078985 [0,1,0,1,0,0|2,0,0]=4 9787 B9R1.15 COC1CNCCC1O Amb24624663 [0,1,0,1,0,0|2,0,0]=4 9788 B9R1.15 COC1COCCC1=O Amb20241319 [0,1,0,1,0,0|1,0,1]=4 9789 B9R1.15 COC1COCCC1Br Amb27402348 [0,1,0,1,0,0|1,0,0]=3 9790 B9R1.15 COC1COCCC1N Amb9472872 [0,1,0,1,0,0|1,0,0]=3 9791 B9R1.15 COC1COCCC1O Amb25733031 [0,1,0,1,0,0|1,0,0]=3 9792 B9R1.15 COC1COCCC1S Amb25937048 [0,1,0,1,0,0|1,0,0]=3 9793 B9R1.15 COC1OCCCC1N Amb18203180 [0,1,0,1,0,0|2,0,0]=4 9794 B9R1.15 COC1OCCCC1O Amb25284546 [0,1,0,1,0,0|2,0,0]=4 9795 B9R1.15 COC1OCCOC1O Amb27766796 [0,1,0,1,0,0|1,0,0]=3 9796 B9R1.15 CO[C@@H]1CCCC[C@@H]1Br Amb27777572 [0,1,0,1,0,0|2,0,0]=4 9797 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Amb25026218 [0,1,0,1,0,0|2,0,0]=4 9798 B9R1.15 CO[C@@H]1CCCC[C@@H]1O Amb24671865 [0,1,0,1,0,0|1,0,0]=3 9799 B9R1.15 CO[C@@H]1CCCC[C@H]1Br Amb25968817 [0,1,0,1,0,0|2,0,0]=4 9800 B9R1.15 CO[C@@H]1CCCC[C@H]1I Amb33733603 [0,1,0,1,0,0|2,0,0]=4 9801 B9R1.15 CO[C@@H]1CCCC[C@H]1N Amb26887845 [0,1,0,1,0,0|2,0,0]=4 9802 B9R1.15 CO[C@@H]1CCCC[C@H]1O Amb17940177 [0,1,0,1,0,0|1,0,0]=3 9803 B9R1.15 CO[C@@H]1CCCN[C@@H]1C Amb33744863 [0,1,0,1,0,0|2,0,0]=4 9804 B9R1.15 CO[C@@H]1CCNC[C@@H]1F Amb32645845 [0,1,0,1,0,0|2,0,0]=4 9805 B9R1.15 CO[C@@H]1CCNC[C@@H]1F Amb32645846 [0,1,0,1,0,0|2,0,0]=4 9806 B9R1.15 CO[C@@H]1CCNC[C@@H]1O Amb25691574 [0,1,0,1,0,0|1,0,0]=3 9807 B9R1.15 CO[C@@H]1CCNC[C@@H]1O Amb30594247 [0,1,0,1,0,0|1,0,0]=3 9808 B9R1.15 CO[C@@H]1CCNC[C@H]1O Amb23439820 [0,1,0,1,0,0|1,0,0]=3 9809 B9R1.15 CO[C@@H]1CCNC[C@H]1O Amb31028944 [0,1,0,1,0,0|1,0,0]=3 9810 B9R1.15 CO[C@@H]1CCOC[C@@H]1N Amb23385325 [0,1,0,1,0,0|1,0,0]=3 9811 B9R1.15 CO[C@@H]1CCOC[C@@H]1N Amb27203024 [0,1,0,1,0,0|1,0,0]=3 9812 B9R1.15 CO[C@@H]1CCOC[C@H]1N Amb23385321 [0,1,0,1,0,0|1,0,0]=3 9813 B9R1.15 CO[C@@H]1CCOC[C@H]1N Amb25987643 [0,1,0,1,0,0|1,0,0]=3 9814 B9R1.15 CO[C@@H]1CCOC[C@H]1O Amb27202827 [0,1,0,1,0,0|0,0,0]=2 9815 B9R1.15 CO[C@@H]1CNCC[C@H]1C Amb33456121 [0,1,0,1,0,0|1,0,0]=3 9816 B9R1.15 CO[C@@H]1CNCC[C@H]1C Amb33621064 [0,1,0,1,0,0|1,0,0]=3 9817 B9R1.15 CO[C@@H]1CNCC[C@H]1F Amb33339126 [0,1,0,1,0,0|2,0,0]=4 9818 B9R1.15 CO[C@@H]1CNCC[C@H]1F Amb33339127 [0,1,0,1,0,0|2,0,0]=4 9819 B9R1.15 CO[C@@H]1COCCC1=O Amb22232585 [0,1,0,1,0,0|1,0,1]=4 9820 B9R1.15 CO[C@@H]1COCC[C@@H]1N Amb23385243 [0,1,0,1,0,0|1,0,0]=3 9821 B9R1.15 CO[C@@H]1COCC[C@@H]1N Amb25274460 [0,1,0,1,0,0|1,0,0]=3 9822 B9R1.15 CO[C@@H]1COCC[C@H]1N Amb22405971 [0,1,0,1,0,0|1,0,0]=3 9823 B9R1.15 CO[C@@H]1COCC[C@H]1N Amb23385335 [0,1,0,1,0,0|1,0,0]=3 9824 B9R1.15 CO[C@@H]1CSSC[C@H]1O Amb27446137 [0,1,0,1,0,0|1,1,0]=4 9825 B9R1.15 CO[C@@H]1OCCC[C@@H]1O Amb27844176 [0,1,0,1,0,0|2,0,0]=4 9826 B9R1.15 CO[C@H]1CCCC[C@@H]1Br Amb28193934 [0,1,0,1,0,0|2,0,0]=4 9827 B9R1.15 CO[C@H]1CCCC[C@@H]1N Amb28383875 [0,1,0,1,0,0|2,0,0]=4 9828 B9R1.15 CO[C@H]1CCCC[C@@H]1O Amb22047253 [0,1,0,1,0,0|1,0,0]=3 9829 B9R1.15 CO[C@H]1CCCC[C@H]1Br Amb27444168 [0,1,0,1,0,0|2,0,0]=4 9830 B9R1.15 CO[C@H]1CCCC[C@H]1N Amb27961504 [0,1,0,1,0,0|2,0,0]=4 9831 B9R1.15 CO[C@H]1CCCN[C@H]1C Amb33621063 [0,1,0,1,0,0|2,0,0]=4 9832 B9R1.15 CO[C@H]1CCNC[C@@H]1O Amb25973383 [0,1,0,1,0,0|1,0,0]=3 9833 B9R1.15 CO[C@H]1CCNC[C@@H]1O Amb33806366 [0,1,0,1,0,0|1,0,0]=3 9834 B9R1.15 CO[C@H]1CNCC[C@@H]1O Amb34913075 [0,1,0,1,0,0|2,0,0]=4 9835 B9R1.15 CO[C@H]1CNCC[C@H]1N Amb27817805 [0,1,0,1,0,0|2,0,0]=4 9836 B9R1.15 CO[C@H]1CNCC[C@H]1O Amb34912825 [0,1,0,1,0,0|2,0,0]=4 9837 B9R1.15 CO[C@H]1COCCC1=O Amb27777522 [0,1,0,1,0,0|1,0,1]=4 9838 B9R1.15 CO[C@H]1COCC[C@@H]1N Amb22405973 [0,1,0,1,0,0|1,0,0]=3 9839 B9R1.15 CO[C@H]1COCC[C@H]1N Amb22405969 [0,1,0,1,0,0|1,0,0]=3 9840 B9R1.15 CO[C@H]1COCC[C@H]1N Amb33801110 [0,1,0,1,0,0|1,0,0]=3 9841 B9R1.15 CO[C@H]1OCCC[C@@H]1O Amb27221641 [0,1,0,1,0,0|2,0,0]=4 9842 B9R1.15 CO[C@H]1OCCC[C@H]1Br Amb27794264 [0,1,0,1,0,0|2,0,0]=4 9843 B9R1.15 CSC1CCCCC1Br Amb28381116 [0,1,0,1,0,0|2,0,0]=4 9844 B9R1.15 CSC1CCCCC1F Amb24382198 [0,1,0,1,0,0|2,0,0]=4 9845 B9R1.15 CSC1CCCCC1N Amb18644219 [0,1,0,1,0,0|2,0,0]=4 9846 B9R1.15 CSC1CCCCC1N Amb32665004 [0,1,0,1,0,0|2,0,0]=4 9847 B9R1.15 CSC1CCCCC1O Amb27810883 [0,1,0,1,0,0|1,0,0]=3 9848 B9R1.15 CSC1COCCC1N Amb28255648 [0,1,0,1,0,0|1,1,0]=4 9849 B9R1.15 CS[C@@H]1CCCC[C@H]1F Amb26564270 [0,1,0,1,0,0|2,0,0]=4 9850 B9R1.15 CS[C@@H]1CCCC[C@H]1N Amb26952114 [0,1,0,1,0,0|2,0,0]=4 9851 B9R1.15 CS[C@@H]1CCCC[C@H]1N Amb32661030 [0,1,0,1,0,0|2,0,0]=4 9852 B9R1.15 CS[C@@H]1CCCC[C@H]1O Amb27822799 [0,1,0,1,0,0|1,0,0]=3 9853 B9R1.15 CS[C@H]1CCCC[C@@H]1N Amb28901399 [0,1,0,1,0,0|2,0,0]=4 9854 B9R1.15 CS[C@H]1CCCC[C@@H]1O Amb24424734 [0,1,0,1,0,0|1,0,0]=3 9855 B9R1.15 C[C@@H]1CC=CO[C@@H]1CO Amb27215397 [0,1,0,1,0,0|0,0,1]=3 9856 B9R1.15 C[C@@H]1CCCC[C@H]1C=O Amb28248314 [0,1,0,1,0,0|1,0,1]=4 9857 B9R1.15 C[C@@H]1CCCC[C@H]1CO Amb27205665 [0,1,0,1,0,0|1,0,0]=3 9858 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb28247947 [0,1,0,1,0,0|1,0,0]=3 9859 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb32658745 [0,1,0,1,0,0|1,0,0]=3 9860 B9R1.15 C[C@@H]1CCCN[C@H]1CO Amb28456652 [0,1,0,1,0,0|1,0,0]=3 9861 B9R1.15 C[C@@H]1CCCO[C@H]1C=O Amb28255632 [0,1,0,1,0,0|0,0,2]=4 9862 B9R1.15 C[C@@H]1CCCO[C@H]1CN Amb27626025 [0,1,0,1,0,0|1,0,0]=3 9863 B9R1.15 C[C@@H]1NCCC[C@H]1CN Amb18832593 [0,1,0,1,0,0|2,0,0]=4 9864 B9R1.15 C[C@H]1CC=CC[C@@H]1CO Amb27853895 [0,1,0,1,0,0|1,0,1]=4 9865 B9R1.15 C[C@H]1CC=CC[C@H]1CO Amb27422301 [0,1,0,1,0,0|1,0,1]=4 9866 B9R1.15 C[C@H]1CCCC[C@H]1CO Amb28250858 [0,1,0,1,0,0|1,0,0]=3 9867 B9R1.15 C[C@H]1CCCN[C@@H]1CO Amb34915744 [0,1,0,1,0,0|1,0,0]=3 9868 B9R1.15 C[C@H]1COCC[C@@H]1CN Amb27784540 [0,1,0,1,0,0|1,0,0]=3 9869 B9R1.15 C[C@H]1OCCN[C@@H]1CO Amb26894037 [0,1,0,1,0,0|1,0,0]=3 9870 B9R1.15 ClCC1CCCCC1Cl Amb27626557 [0,1,0,1,0,0|2,0,0]=4 9871 B9R1.15 ClCC1OCCCC1Cl Amb27256698 [0,1,0,1,0,0|1,0,0]=3 9872 B9R1.15 FC1CCCCC1CBr Amb26529385 [0,1,0,1,0,0|2,0,0]=4 9873 B9R1.15 FC1CCCCC1CCl Amb32943716 [0,1,0,1,0,0|2,0,0]=4 9874 B9R1.15 N#CC1CCCCC1O Amb8904047 [0,1,0,1,0,0|1,0,1]=4 9875 B9R1.15 N#CC1CCOCC1Cl Amb28190365 [0,1,0,1,0,0|1,0,1]=4 9876 B9R1.15 N#CC1COCCC1N Amb32657382 [0,1,0,1,0,0|2,0,0]=4 9877 B9R1.15 N#CC1COCCC1O Amb27602687 [0,1,0,1,0,0|1,0,1]=4 9878 B9R1.15 N#CC1OCCCC1O Amb28185178 [0,1,0,1,0,0|1,0,1]=4 9879 B9R1.15 N#C[C@@H]1CCCC[C@@H]1O Amb27663158 [0,1,0,1,0,0|1,0,1]=4 9880 B9R1.15 N#C[C@@H]1CCCC[C@H]1O Amb1993741 [0,1,0,1,0,0|1,0,1]=4 9881 B9R1.15 N#C[C@@H]1COCC[C@@H]1O Amb32668891 [0,1,0,1,0,0|1,0,1]=4 9882 B9R1.15 N#C[C@@H]1COCC[C@H]1O Amb24585140 [0,1,0,1,0,0|1,0,1]=4 9883 B9R1.15 N#C[C@@H]1OCCC[C@H]1O Amb27220612 [0,1,0,1,0,0|1,0,1]=4 9884 B9R1.15 N#C[C@H]1CCCC[C@@H]1O Amb27832404 [0,1,0,1,0,0|1,0,1]=4 9885 B9R1.15 NC1CCCCC1CF Amb27183294 [0,1,0,1,0,0|2,0,0]=4 9886 B9R1.15 NC1CCCCC1CO Amb19515684 [0,1,0,1,0,0|1,0,0]=3 9887 B9R1.15 NC1CCCCC1CO Amb29083407 [0,1,0,1,0,0|1,0,0]=3 9888 B9R1.15 NC1CCOCC1CO Amb22491259 [0,1,0,1,0,0|1,0,0]=3 9889 B9R1.15 NCC1CCCCC1=O Amb18203259 [0,1,0,1,0,0|2,0,0]=4 9890 B9R1.15 NCC1CCCCC1Br Amb28319467 [0,1,0,1,0,0|2,0,0]=4 9891 B9R1.15 NCC1CCCCC1Cl Amb25146158 [0,1,0,1,0,0|2,0,0]=4 9892 B9R1.15 NCC1CCCCC1Cl Amb32652036 [0,1,0,1,0,0|2,0,0]=4 9893 B9R1.15 NCC1CCCCC1F Amb27171602 [0,1,0,1,0,0|2,0,0]=4 9894 B9R1.15 NCC1CCCCC1F Amb32652716 [0,1,0,1,0,0|2,0,0]=4 9895 B9R1.15 NCC1CCCCC1N Amb32663901 [0,1,0,1,0,0|2,0,0]=4 9896 B9R1.15 NCC1CCCCC1N Amb33527303 [0,1,0,1,0,0|2,0,0]=4 9897 B9R1.15 NCC1CCCCC1O Amb22228582 [0,1,0,1,0,0|1,0,0]=3 9898 B9R1.15 NCC1CCCCC1O Amb9277099 [0,1,0,1,0,0|1,0,0]=3 9899 B9R1.15 NCC1CCCCC1S Amb32788231 [0,1,0,1,0,0|1,1,0]=4 9900 B9R1.15 NCC1CCNCC1O Amb26316732 [0,1,0,1,0,0|1,0,0]=3 9901 B9R1.15 NCC1CCOCC1Br Amb26975819 [0,1,0,1,0,0|1,0,0]=3 9902 B9R1.15 NCC1CCOCC1O Amb18203182 [0,1,0,1,0,0|0,0,0]=2 9903 B9R1.15 NCC1CNCCC1O Amb33166212 [0,1,0,1,0,0|2,0,0]=4 9904 B9R1.15 NCC1COCCC1N Amb19515155 [0,1,0,1,0,0|2,0,0]=4 9905 B9R1.15 NCC1COCCC1O Amb18561401 [0,1,0,1,0,0|1,0,0]=3 9906 B9R1.15 NCC1CSCCC1O Amb18202213 [0,1,0,1,0,0|1,1,0]=4 9907 B9R1.15 NCC1OCCCC1O Amb18203183 [0,1,0,1,0,0|1,0,0]=3 9908 B9R1.15 NC[C@@H]1CCCCC1O Amb28120033 [0,1,0,1,0,0|1,0,0]=3 9909 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Amb1993771 [0,1,0,1,0,0|1,0,0]=3 9910 B9R1.15 NC[C@@H]1CCCC[C@H]1N Amb1993785 [0,1,0,1,0,0|2,0,0]=4 9911 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb1993738 [0,1,0,1,0,0|1,0,0]=3 9912 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb32662843 [0,1,0,1,0,0|1,0,0]=3 9913 B9R1.15 NC[C@@H]1CCNC[C@@H]1O Amb24425962 [0,1,0,1,0,0|1,0,0]=3 9914 B9R1.15 NC[C@@H]1CCNC[C@@H]1O Amb31291969 [0,1,0,1,0,0|1,0,0]=3 9915 B9R1.15 NC[C@@H]1CCNC[C@H]1O Amb25756301 [0,1,0,1,0,0|1,0,0]=3 9916 B9R1.15 NC[C@@H]1CCNC[C@H]1O Amb30869480 [0,1,0,1,0,0|1,0,0]=3 9917 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb27267791 [0,1,0,1,0,0|1,0,0]=3 9918 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb32662911 [0,1,0,1,0,0|1,0,0]=3 9919 B9R1.15 NC[C@H]1CCCC[C@H]1N Amb19374536 [0,1,0,1,0,0|2,0,0]=4 9920 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb28134233 [0,1,0,1,0,0|1,0,0]=3 9921 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb33774712 [0,1,0,1,0,0|1,0,0]=3 9922 B9R1.15 NN1CCCC[C@@H]1CO Amb28048290 [0,1,0,1,0,0|1,0,0]=3 9923 B9R1.15 NN1CCCOC1CCl Amb27833858 [0,1,0,1,0,0|2,0,0]=4 9924 B9R1.15 NNC1CCCCC1O Amb26054322 [0,1,0,1,0,0|2,0,0]=4 9925 B9R1.15 NNC1COCCC1O Amb27826521 [0,1,0,1,0,0|2,0,0]=4 9926 B9R1.15 NN[C@@H]1CCCC[C@@H]1O Amb27204799 [0,1,0,1,0,0|2,0,0]=4 9927 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb10608261 [0,1,0,1,0,0|2,0,0]=4 9928 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb22754030 [0,1,0,1,0,0|2,0,0]=4 9929 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb32992354 [0,1,0,1,0,0|2,0,0]=4 9930 B9R1.15 NN[C@H]1CCCC[C@@H]1O Amb27208426 [0,1,0,1,0,0|2,0,0]=4 9931 B9R1.15 N[C@@H]1CCCC[C@@H]1CO Amb26867016 [0,1,0,1,0,0|1,0,0]=3 9932 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993740 [0,1,0,1,0,0|1,0,0]=3 9933 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993773 [0,1,0,1,0,0|1,0,0]=3 9934 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb30640024 [0,1,0,1,0,0|1,0,0]=3 9935 B9R1.15 N[C@@H]1COCN[C@@H]1CO Amb27231412 [0,1,0,1,0,0|2,0,0]=4 9936 B9R1.15 N[C@H]1CCCC[C@H]1CBr Amb28285726 [0,1,0,1,0,0|2,0,0]=4 9937 B9R1.15 N[C@H]1CCCC[C@H]1CO Amb1993772 [0,1,0,1,0,0|1,0,0]=3 9938 B9R1.15 O=C1CCCCC1CO Amb16231080 [0,1,0,1,0,0|1,0,0]=3 9939 B9R1.15 O=C1CCCCC1CS Amb27838753 [0,1,0,1,0,0|1,1,0]=4 9940 B9R1.15 O=C1CCCC[C@@H]1CO Amb27750239 [0,1,0,1,0,0|1,0,0]=3 9941 B9R1.15 O=C1CCCC[C@H]1CO Amb27956173 [0,1,0,1,0,0|1,0,0]=3 9942 B9R1.15 O=C1CCOCC1CF Amb27623327 [0,1,0,1,0,0|1,0,1]=4 9943 B9R1.15 O=C1NCCCC1CO Amb27814971 [0,1,0,1,0,0|2,0,0]=4 9944 B9R1.15 O=C1NCCOC1CO Amb25235028 [0,1,0,1,0,0|1,0,1]=4 9945 B9R1.15 O=CC1CCCCC1O Amb25350532 [0,1,0,1,0,0|1,0,1]=4 9946 B9R1.15 O=NN1CCOCC1O Amb8391990 [0,1,0,1,0,0|2,0,0]=4 9947 B9R1.15 O=S1CCCS[C@H]1CO Amb28315427 [0,1,0,1,0,0|1,1,0]=4 9948 B9R1.15 OC1CCCCC1CBr Amb26848173 [0,1,0,1,0,0|1,0,0]=3 9949 B9R1.15 OC1CCNCC1CF Amb27853580 [0,1,0,1,0,0|2,0,0]=4 9950 B9R1.15 OC1CCSCC1CBr Amb28133902 [0,1,0,1,0,0|1,1,0]=4 9951 B9R1.15 OCC1=C(Cl)CCCC1 Amb28061885 [0,1,0,1,0,0|1,0,1]=4 9952 B9R1.15 OCC1CCCCC1Br Amb25320883 [0,1,0,1,0,0|1,0,0]=3 9953 B9R1.15 OCC1CCCCC1Cl Amb26054589 [0,1,0,1,0,0|1,0,0]=3 9954 B9R1.15 OCC1CCCCC1F Amb25216302 [0,1,0,1,0,0|1,0,0]=3 9955 B9R1.15 OCC1CCCCC1O Amb2695584 [0,1,0,1,0,0|1,0,0]=3 9956 B9R1.15 OCC1CCCCC1S Amb28186091 [0,1,0,1,0,0|1,0,0]=3 9957 B9R1.15 OCC1CCCOC1O Amb28315461 [0,1,0,1,0,0|2,0,0]=4 9958 B9R1.15 OCC1CCNCC1O Amb22298269 [0,1,0,1,0,0|1,0,0]=3 9959 B9R1.15 OCC1CCNCC1O Amb22886290 [0,1,0,1,0,0|1,0,0]=3 9960 B9R1.15 OCC1CCOCC1F Amb27789057 [0,1,0,1,0,0|1,0,0]=3 9961 B9R1.15 OCC1CCOCC1O Amb4358572 [0,1,0,1,0,0|0,0,0]=2 9962 B9R1.15 OCC1CNCCC1F Amb27147945 [0,1,0,1,0,0|2,0,0]=4 9963 B9R1.15 OCC1CNCCC1O Amb22727975 [0,1,0,1,0,0|2,0,0]=4 9964 B9R1.15 OCC1CNCCC1O Amb8630932 [0,1,0,1,0,0|2,0,0]=4 9965 B9R1.15 OCC1COCCC1O Amb26859481 [0,1,0,1,0,0|1,0,0]=3 9966 B9R1.15 OCC1CSCC[C@@H]1O Amb27806578 [0,1,0,1,0,0|1,1,0]=4 9967 B9R1.15 OCC1OCOCC1O Amb27451893 [0,1,0,1,0,0|1,0,0]=3 9968 B9R1.15 OC[C@@H]1CC=CC[C@H]1O Amb27857923 [0,1,0,1,0,0|1,0,1]=4 9969 B9R1.15 OC[C@@H]1CCC=C[C@@H]1O Amb27215271 [0,1,0,1,0,0|1,0,1]=4 9970 B9R1.15 OC[C@@H]1CCCC[C@@H]1O Amb27428210 [0,1,0,1,0,0|1,0,0]=3 9971 B9R1.15 OC[C@@H]1CCNC[C@@H]1F Amb23439393 [0,1,0,1,0,0|2,0,0]=4 9972 B9R1.15 OC[C@@H]1CCNC[C@@H]1F Amb24077308 [0,1,0,1,0,0|2,0,0]=4 9973 B9R1.15 OC[C@@H]1CCNC[C@@H]1O Amb26015650 [0,1,0,1,0,0|1,0,0]=3 9974 B9R1.15 OC[C@@H]1CCNC[C@@H]1O Amb33871492 [0,1,0,1,0,0|1,0,0]=3 9975 B9R1.15 OC[C@@H]1CCNC[C@H]1O Amb22757887 [0,1,0,1,0,0|1,0,0]=3 9976 B9R1.15 OC[C@@H]1CCNC[C@H]1O Amb22757970 [0,1,0,1,0,0|1,0,0]=3 9977 B9R1.15 OC[C@@H]1NCCC[C@@H]1O Amb25960753 [0,1,0,1,0,0|1,0,0]=3 9978 B9R1.15 OC[C@@H]1OCC=C[C@H]1O Amb27632773 [0,1,0,1,0,0|0,0,2]=4 9979 B9R1.15 OC[C@@H]1OCOC[C@@H]1O Amb27442129 [0,1,0,1,0,0|1,0,0]=3 9980 B9R1.15 OC[C@@H]1OCOC[C@H]1O Amb27255150 [0,1,0,1,0,0|1,0,0]=3 9981 B9R1.15 OC[C@H]1CCC=C[C@H]1O Amb27218905 [0,1,0,1,0,0|1,0,1]=4 9982 B9R1.15 OC[C@H]1CCCC[C@@H]1Cl Amb28429613 [0,1,0,1,0,0|1,0,0]=3 9983 B9R1.15 OC[C@H]1CCCC[C@@H]1O Amb28384576 [0,1,0,1,0,0|1,0,0]=3 9984 B9R1.15 OC[C@H]1CCCC[C@@H]1S Amb27652987 [0,1,0,1,0,0|1,0,0]=3 9985 B9R1.15 OC[C@H]1CCCC[C@H]1O Amb28430751 [0,1,0,1,0,0|1,0,0]=3 9986 B9R1.15 OC[C@H]1CCNC[C@@H]1F Amb34915606 [0,1,0,1,0,0|2,0,0]=4 9987 B9R1.15 OC[C@H]1CCNC[C@@H]1O Amb26594171 [0,1,0,1,0,0|1,0,0]=3 9988 B9R1.15 OC[C@H]1CCNC[C@@H]1O Amb33813228 [0,1,0,1,0,0|1,0,0]=3 9989 B9R1.15 OC[C@H]1CCNC[C@H]1F Amb26561651 [0,1,0,1,0,0|2,0,0]=4 9990 B9R1.15 OC[C@H]1CCNC[C@H]1F Amb33801718 [0,1,0,1,0,0|2,0,0]=4 9991 B9R1.15 OC[C@H]1CCNC[C@H]1O Amb22750649 [0,1,0,1,0,0|1,0,0]=3 9992 B9R1.15 OC[C@H]1CCNC[C@H]1O Amb22757875 [0,1,0,1,0,0|1,0,0]=3 9993 B9R1.15 OC[C@H]1CNCC[C@@H]1O Amb27195007 [0,1,0,1,0,0|2,0,0]=4 9994 B9R1.15 OC[C@H]1OCC=C[C@@H]1O Amb28318872 [0,1,0,1,0,0|0,0,2]=4 9995 B9R1.15 OC[C@H]1OCCCC1O Amb27768573 [0,1,0,1,0,0|0,0,0]=2 9996 B9R1.15 OC[C@H]1OCCC[C@H]1O Amb27445056 [0,1,0,1,0,0|0,0,0]=2 9997 B9R1.15 O[C@@H]1CCCC[C@H]1CCl Amb27420171 [0,1,0,1,0,0|1,0,0]=3 9998 B9R1.15 O[C@@H]1CCCC[C@H]1CS Amb27962214 [0,1,0,1,0,0|1,0,0]=3 9999 B9R1.15 O[C@H]1CCCC[C@H]1CCl Amb27962958 [0,1,0,1,0,0|1,0,0]=3 10000 B9R1.15 SCC1CCCCC1Br Amb28241921 [0,1,0,1,0,0|1,1,0]=4 10001 B9R1.15 [C-]#[N+]C1CCCCC1C Amb5456293 [0,1,0,1,0,0|2,0,0]=4 10002 B9R1.18 CCCC1CC1NCC Amb28367904 [0,1,0,1,0,0|2,0,0]=4 10003 B9R1.18 CCCC1OC1CCO Amb28455016 [0,1,0,1,0,0|0,0,0]=2 10004 B9R1.18 CCC[C@H]1O[C@H]1CCO Amb27667122 [0,1,0,1,0,0|0,0,0]=2 10005 B9R1.18 CNCC1OC1CNC Amb28314118 [0,1,0,1,0,0|2,0,0]=4 10006 B9R1.18 ClCCC1CC1CCCl Amb27964536 [0,1,0,1,0,0|2,0,0]=4 10007 B9R1.18 NCCC1CC1CCN Amb27872158 [0,1,0,1,0,0|2,0,0]=4 10008 B9R1.18 NCC[C@@H]1C[C@@H]1CCN Amb28423347 [0,1,0,1,0,0|2,0,0]=4 10009 B9R1.18 OCCC1CC1CCO Amb27807200 [0,1,0,1,0,0|1,0,0]=3 10010 B9R1.18 OCC[C@@H]1C[C@H]1CCO Amb27851514 [0,1,0,1,0,0|1,0,0]=3 10011 B9R1.20 C#CC1CC1OCCCl Amb27403665 [0,1,0,1,0,0|1,0,1]=4 10012 B9R1.20 C#CC1OC1CCCO Amb26943149 [0,1,0,1,0,0|1,0,1]=4 10013 B9R1.20 C#CCCC1OC1CO Amb28068989 [0,1,0,1,0,0|0,0,1]=3 10014 B9R1.20 C#C[C@@H]1O[C@@H]1CCCO Amb27857964 [0,1,0,1,0,0|1,0,1]=4 10015 B9R1.20 C#C[C@@H]1O[C@H]1CCCO Amb28319926 [0,1,0,1,0,0|1,0,1]=4 10016 B9R1.20 C#C[C@H]1C[C@H]1OCCCl Amb27622455 [0,1,0,1,0,0|1,0,1]=4 10017 B9R1.20 C#C[C@H]1O[C@@H]1CCCO Amb28252632 [0,1,0,1,0,0|1,0,1]=4 10018 B9R1.20 C=CC1OC1CCCO Amb27833659 [0,1,0,1,0,0|1,0,1]=4 10019 B9R1.20 C=CCC[C@@H]1C[C@@H]1CO Amb28401103 [0,1,0,1,0,0|1,0,1]=4 10020 B9R1.20 C=CCC[C@@H]1C[C@H]1CO Amb27198068 [0,1,0,1,0,0|1,0,1]=4 10021 B9R1.20 C=CCC[C@@H]1O[C@@H]1CO Amb27446219 [0,1,0,1,0,0|0,0,1]=3 10022 B9R1.20 C=COCC1OC1CO Amb26553039 [0,1,0,1,0,0|0,0,2]=4 10023 B9R1.20 C=C[C@@H]1O[C@H]1CCCBr Amb27983790 [0,1,0,1,0,0|1,0,1]=4 10024 B9R1.20 C=C[C@@H]1O[C@H]1CCCO Amb28411200 [0,1,0,1,0,0|1,0,1]=4 10025 B9R1.20 CC#CC[C@H]1O[C@H]1CO Amb27640702 [0,1,0,1,0,0|0,0,1]=3 10026 B9R1.20 CCC1CC1CCCO Amb32951059 [0,1,0,1,0,0|1,0,0]=3 10027 B9R1.20 CCC1CC1NCCN Amb27402730 [0,1,0,1,0,0|2,0,0]=4 10028 B9R1.20 CCC1OC1CCOC Amb27433793 [0,1,0,1,0,0|1,0,0]=3 10029 B9R1.20 CCCCC1CC1CN Amb33428098 [0,1,0,1,0,0|2,0,0]=4 10030 B9R1.20 CCCCC1OC1C=O Amb26852359 [0,1,0,1,0,0|0,0,2]=4 10031 B9R1.20 CCCCC1OC1CBr Amb24480230 [0,1,0,1,0,0|1,0,0]=3 10032 B9R1.20 CCCCC1OC1CCl Amb27755023 [0,1,0,1,0,0|1,0,0]=3 10033 B9R1.20 CCCCC1OC1CO Amb28069435 [0,1,0,1,0,0|0,0,0]=2 10034 B9R1.20 CCCC[C@@H]1C[C@H]1C=O Amb27971394 [0,1,0,1,0,0|1,0,1]=4 10035 B9R1.20 CCCC[C@@H]1C[C@H]1CN Amb33428099 [0,1,0,1,0,0|2,0,0]=4 10036 B9R1.20 CCCC[C@@H]1C[C@H]1CO Amb27857307 [0,1,0,1,0,0|1,0,0]=3 10037 B9R1.20 CCCC[C@@H]1O[C@H]1CN Amb28428722 [0,1,0,1,0,0|1,0,0]=3 10038 B9R1.20 CCCC[C@H]1C[C@@H]1CO Amb27457988 [0,1,0,1,0,0|1,0,0]=3 10039 B9R1.20 CCCC[C@H]1O[C@@H]1CO Amb27446723 [0,1,0,1,0,0|0,0,0]=2 10040 B9R1.20 CCCC[C@H]1O[C@H]1CCl Amb27975821 [0,1,0,1,0,0|1,0,0]=3 10041 B9R1.20 CCC\C=C1\CC1CO Amb27858002 [0,1,0,1,0,0|1,0,1]=4 10042 B9R1.20 CCNCC1CC1CC Amb18523852 [0,1,0,1,0,0|2,0,0]=4 10043 B9R1.20 CCSCC1CC1CN Amb33323704 [0,1,0,1,0,0|2,0,0]=4 10044 B9R1.20 CCSC[C@@H]1C[C@H]1CN Amb33323705 [0,1,0,1,0,0|2,0,0]=4 10045 B9R1.20 CC[C@@H]1C[C@H]1CCCO Amb33213083 [0,1,0,1,0,0|1,0,0]=3 10046 B9R1.20 CC\C=C\C1OC1CO Amb27207668 [0,1,0,1,0,0|0,0,1]=3 10047 B9R1.20 CC\C=C\[C@H]1O[C@@H]1CO Amb27207853 [0,1,0,1,0,0|0,0,1]=3 10048 B9R1.20 COCCC1CC1CN Amb33377366 [0,1,0,1,0,0|2,0,0]=4 10049 B9R1.20 COCC[C@@H]1C[C@H]1CN Amb33377367 [0,1,0,1,0,0|2,0,0]=4 10050 B9R1.20 CSCCC1CC1CN Amb33197628 [0,1,0,1,0,0|2,0,0]=4 10051 B9R1.20 CSCC[C@@H]1C[C@H]1CN Amb33197637 [0,1,0,1,0,0|2,0,0]=4 10052 B9R1.20 C\C=C\C[C@@H]1O[C@@H]1CO Amb27452017 [0,1,0,1,0,0|0,0,1]=3 10053 B9R1.20 C\C=C\C[C@@H]1O[C@H]1CO Amb27205917 [0,1,0,1,0,0|0,0,1]=3 10054 B9R1.20 O=C[C@@H]1O[C@H]1CCCBr Amb28320749 [0,1,0,1,0,0|0,0,2]=4 10055 B9R1.20 OCC1OC1CCCBr Amb27666884 [0,1,0,1,0,0|0,0,0]=2 10056 B9R1.20 [N-]=[N+]=NCC1OC1CO Amb27233819 [0,1,0,1,0,0|2,0,0]=4 10057 B9R1.22 CC1CC(=O)OC1CO Amb28049216 [0,1,0,1,0,0|0,0,1]=3 10058 B9R1.22 CC1CC(=O)O[C@@H]1CO Amb27956619 [0,1,0,1,0,0|0,0,1]=3 10059 B9R1.22 CC1CN(C)CC1CO Amb27875887 [0,1,0,1,0,0|2,0,0]=4 10060 B9R1.22 CC1NC(=O)OC1CO Amb27438567 [0,1,0,1,0,0|1,0,1]=4 10061 B9R1.22 CC1OC(=O)OC1CO Amb28315510 [0,1,0,1,0,0|1,0,1]=4 10062 B9R1.22 CCC1CC(=O)OC1O Amb27956540 [0,1,0,1,0,0|2,0,0]=4 10063 B9R1.22 CCC1CN(C)CC1Br Amb27867755 [0,1,0,1,0,0|2,0,0]=4 10064 B9R1.22 CCC1CN(C)CC1Cl Amb27852145 [0,1,0,1,0,0|2,0,0]=4 10065 B9R1.22 CCC1CN(C)CC1N Amb18203238 [0,1,0,1,0,0|2,0,0]=4 10066 B9R1.22 CCC1CN(C)CC1N Amb32941898 [0,1,0,1,0,0|2,0,0]=4 10067 B9R1.22 CCC1CN(N)CC1O Amb27783511 [0,1,0,1,0,0|1,0,0]=3 10068 B9R1.22 CCC1NC(=O)CC1O Amb28367696 [0,1,0,1,0,0|2,0,0]=4 10069 B9R1.22 CCC1OC(O)CC1C Amb27792433 [0,1,0,1,0,0|1,0,0]=3 10070 B9R1.22 CC[C@@H]1CN(C)C[C@@H]1N Amb27963762 [0,1,0,1,0,0|2,0,0]=4 10071 B9R1.22 CC[C@@H]1CN(C)C[C@H]1N Amb28134020 [0,1,0,1,0,0|2,0,0]=4 10072 B9R1.22 CC[C@@H]1OC(=O)C[C@@H]1O Amb28207149 [0,1,0,1,0,0|2,0,0]=4 10073 B9R1.22 CC[C@H]1OC(=O)C[C@H]1O Amb28292165 [0,1,0,1,0,0|2,0,0]=4 10074 B9R1.22 CC[C@H]1OC(O)C[C@@H]1C Amb27775528 [0,1,0,1,0,0|1,0,0]=3 10075 B9R1.22 CC[C@H]1OC(O)C[C@@H]1O Amb27853549 [0,1,0,1,0,0|2,0,0]=4 10076 B9R1.22 CN1CC(N)CC1CO Amb27469649 [0,1,0,1,0,0|2,0,0]=4 10077 B9R1.22 CN1CC(O)C[C@@H]1CO Amb27780484 [0,1,0,1,0,0|2,0,0]=4 10078 B9R1.22 CN1C[C@@H](F)C[C@H]1CO Amb28436055 [0,1,0,1,0,0|2,0,0]=4 10079 B9R1.22 CN1C[C@@H](N)C[C@H]1CO Amb23385232 [0,1,0,1,0,0|2,0,0]=4 10080 B9R1.22 CN1C[C@@H](O)C[C@H]1CO Amb27211716 [0,1,0,1,0,0|2,0,0]=4 10081 B9R1.22 CN1C[C@@H](S)C[C@H]1CO Amb27230463 [0,1,0,1,0,0|2,0,0]=4 10082 B9R1.22 CN1C[C@H](N)C[C@@H]1CO Amb34916490 [0,1,0,1,0,0|2,0,0]=4 10083 B9R1.22 CN1C[C@H](N)C[C@H]1CO Amb15701329 [0,1,0,1,0,0|2,0,0]=4 10084 B9R1.22 CN1C[C@H](O)C[C@H]1CO Amb13883425 [0,1,0,1,0,0|2,0,0]=4 10085 B9R1.22 CNC1CN(C)CC1O Amb32410215 [0,1,0,1,0,0|2,0,0]=4 10086 B9R1.22 CN[C@@H]1CN(C)C[C@H]1O Amb22748756 [0,1,0,1,0,0|2,0,0]=4 10087 B9R1.22 CN[C@@H]1CN(C)C[C@H]1O Amb30526942 [0,1,0,1,0,0|2,0,0]=4 10088 B9R1.22 CN[C@H]1CN(C)C[C@@H]1O Amb10608283 [0,1,0,1,0,0|2,0,0]=4 10089 B9R1.22 C[C@@H]1CC(=O)C[C@@H]1CO Amb27260485 [0,1,0,1,0,0|1,0,1]=4 10090 B9R1.22 C[C@@H]1CC(=O)O[C@H]1CCl Amb27976633 [0,1,0,1,0,0|1,0,1]=4 10091 B9R1.22 C[C@@H]1CC(=O)O[C@H]1CO Amb28053667 [0,1,0,1,0,0|0,0,1]=3 10092 B9R1.22 C[C@@H]1OC(=O)O[C@H]1CO Amb27204022 [0,1,0,1,0,0|1,0,1]=4 10093 B9R1.22 C[C@H]1CC(=O)O[C@@H]1CO Amb27450606 [0,1,0,1,0,0|0,0,1]=3 10094 B9R1.22 C[C@H]1C[C@@H](C)C=C1CO Amb27488142 [0,1,0,1,0,0|1,0,1]=4 10095 B9R1.22 C[C@H]1C[C@@H](C)CC1CO Amb28319916 [0,1,0,1,0,0|1,0,0]=3 10096 B9R1.22 C[C@H]1C[C@H](O)[C@H](CBr)O1 Amb27204861 [0,1,0,1,0,0|2,0,0]=4 10097 B9R1.22 N[C@@H]1C[C@@H](O)[C@@H](CO)C1 Amb33717207 [0,1,0,1,0,0|2,0,0]=4 10098 B9R1.22 N[C@H]1C[C@@H](CO)[C@H](F)C1 Amb27881739 [0,1,0,1,0,0|2,0,0]=4 10099 B9R1.22 N[C@H]1C[C@@H](CO)[C@H](O)C1 Amb27630683 [0,1,0,1,0,0|2,0,0]=4 10100 B9R1.22 N[C@H]1C[C@@H](O)[C@@H](CO)C1 Amb27627837 [0,1,0,1,0,0|2,0,0]=4 10101 B9R1.22 N[C@H]1C[C@H](O)[C@@H](CO)C1 Amb28367676 [0,1,0,1,0,0|2,0,0]=4 10102 B9R1.22 O=C1C[C@@H](O)[C@@H](CO)O1 Amb24515317 [0,1,0,1,0,0|1,0,1]=4 10103 B9R1.22 O=C1C[C@@H](O)[C@H](CO)O1 Amb22748461 [0,1,0,1,0,0|1,0,1]=4 10104 B9R1.22 O=C1C[C@H](O)[C@@H](CO)O1 Amb20242107 [0,1,0,1,0,0|1,0,1]=4 10105 B9R1.22 O=C1C[C@H](O)[C@H](CO)O1 Amb26419790 [0,1,0,1,0,0|1,0,1]=4 10106 B9R1.22 OC1CC(O)C(CCl)O1 Amb27607863 [0,1,0,1,0,0|2,0,0]=4 10107 B9R1.22 OC1C[C@H](O)[C@@H](CF)O1 Amb27665488 [0,1,0,1,0,0|2,0,0]=4 10108 B9R1.22 OCC1CC(O)CC1O Amb27857703 [0,1,0,1,0,0|2,0,0]=4 10109 B9R1.22 OCC1OC(Cl)CC1O Amb27965773 [0,1,0,1,0,0|1,0,0]=3 10110 B9R1.22 OCC1OC(O)CC1O Amb25288402 [0,1,0,1,0,0|1,0,0]=3 10111 B9R1.22 OC[C@@H]1C[C@@H](O)C[C@@H]1O Amb26418412 [0,1,0,1,0,0|2,0,0]=4 10112 B9R1.22 OC[C@@H]1OC(O)C[C@@H]1O Amb26641729 [0,1,0,1,0,0|1,0,0]=3 10113 B9R1.22 OC[C@@H]1OC(O)C[C@H]1O Amb8628749 [0,1,0,1,0,0|1,0,0]=3 10114 B9R1.22 OC[C@@H]1O[C@@H](O)C[C@H]1O Amb25174943 [0,1,0,1,0,0|1,0,0]=3 10115 B9R1.22 OC[C@@H]1O[C@H](O)C[C@H]1O Amb25174953 [0,1,0,1,0,0|1,0,0]=3 10116 B9R1.22 OC[C@H]1OC(Cl)C[C@@H]1O Amb27212982 [0,1,0,1,0,0|1,0,0]=3 10117 B9R1.22 OC[C@H]1OC(O)C[C@@H]1O Amb8631764 [0,1,0,1,0,0|1,0,0]=3 10118 B9R1.22 OC[C@H]1OC(O)C[C@H]1O Amb24553841 [0,1,0,1,0,0|1,0,0]=3 10119 B9R1.22 OC[C@H]1O[C@H](O)C[C@@H]1O Amb8390659 [0,1,0,1,0,0|1,0,0]=3 10120 B9R1.27 C=C1CCC(C)C1CBr Amb27442986 [0,1,0,1,0,0|2,0,0]=4 10121 B9R1.27 CC1=C(CO)[C@H](C)CC1 Amb27806087 [0,1,0,1,0,0|1,0,1]=4 10122 B9R1.27 CC1CCC(C)C1CN Amb27239112 [0,1,0,1,0,0|2,0,0]=4 10123 B9R1.27 CC1CCC(F)C1CN Amb20623959 [0,1,0,1,0,0|2,0,0]=4 10124 B9R1.27 CC1CCC(N)C1CF Amb20623960 [0,1,0,1,0,0|2,0,0]=4 10125 B9R1.27 CC1CCC(N)C1CN Amb20622976 [0,1,0,1,0,0|2,0,0]=4 10126 B9R1.27 CC1CCC(N)C1CO Amb20623115 [0,1,0,1,0,0|1,0,0]=3 10127 B9R1.27 CC1CCC(O)C1CN Amb20623190 [0,1,0,1,0,0|2,0,0]=4 10128 B9R1.27 CC1CCC(O)C1CO Amb27617054 [0,1,0,1,0,0|1,0,0]=3 10129 B9R1.27 CC1CCN(C)C1CBr Amb28324436 [0,1,0,1,0,0|2,0,0]=4 10130 B9R1.27 CCC1C(=O)COC1C Amb30013811 [0,1,0,1,0,0|0,0,2]=4 10131 B9R1.27 CCC1C(Br)COC1C Amb35699458 [0,1,0,1,0,0|1,0,0]=3 10132 B9R1.27 CCC1C(C)CNC1C Amb4016498 [0,1,0,1,0,0|2,0,0]=4 10133 B9R1.27 CCC1C(Cl)COC1C Amb35690015 [0,1,0,1,0,0|1,0,0]=3 10134 B9R1.27 CCC1C(N)COC1C Amb29864298 [0,1,0,1,0,0|1,0,0]=3 10135 B9R1.27 CCC1C(O)CCC1O Amb28049245 [0,1,0,1,0,0|1,0,0]=3 10136 B9R1.27 CCC1C(O)COC1C Amb29849331 [0,1,0,1,0,0|0,0,0]=2 10137 B9R1.27 CCN1C(=O)OCC1O Amb28134794 [0,1,0,1,0,0|1,0,1]=4 10138 B9R1.27 CC[C@@H]1C(=O)CC[C@H]1C Amb27256164 [0,1,0,1,0,0|2,0,0]=4 10139 B9R1.27 CC[C@@H]1C(=O)OC[C@H]1O Amb27456703 [0,1,0,1,0,0|0,0,1]=3 10140 B9R1.27 COC1C(=O)OCC1O Amb27237829 [0,1,0,1,0,0|1,0,1]=4 10141 B9R1.27 COC1C(C)COC1O Amb27649700 [0,1,0,1,0,0|2,0,0]=4 10142 B9R1.27 COC1C(O)COC1O Amb27969042 [0,1,0,1,0,0|1,0,0]=3 10143 B9R1.27 CO[C@@H]1[C@@H](O)CO[C@@H]1O Amb28207230 [0,1,0,1,0,0|1,0,0]=3 10144 B9R1.27 CO[C@@H]1[C@@H](O)CO[C@H]1O Amb27427707 [0,1,0,1,0,0|1,0,0]=3 10145 B9R1.27 CO[C@H]1[C@@H](O)OC[C@H]1O Amb27775934 [0,1,0,1,0,0|1,0,0]=3 10146 B9R1.27 C[C@@H]1CCC(=O)[C@@H]1CO Amb27802556 [0,1,0,1,0,0|1,0,0]=3 10147 B9R1.27 C[C@H]1CCC(=O)N1CO Amb28138780 [0,1,0,1,0,0|2,0,0]=4 10148 B9R1.27 C[C@H]1CCN(C)[C@@H]1CN Amb27469739 [0,1,0,1,0,0|2,0,0]=4 10149 B9R1.27 O=C1OCC(O)C1CO Amb27456568 [0,1,0,1,0,0|1,0,1]=4 10150 B9R1.27 O=C1OC[C@@H](O)[C@@H]1CO Amb27484769 [0,1,0,1,0,0|1,0,1]=4 10151 B9R1.33 C#CCC1CCCC1O Amb24720084 [0,1,0,1,0,0|1,0,1]=4 10152 B9R1.33 C#CCC1CNCC1O Amb32944727 [0,1,0,1,0,0|1,0,1]=4 10153 B9R1.33 C#CCC1COCC1Br Amb35736876 [0,1,0,1,0,0|1,0,1]=4 10154 B9R1.33 C#CCC1COCC1Cl Amb35736781 [0,1,0,1,0,0|1,0,1]=4 10155 B9R1.33 C#CCC1COCC1N Amb29877501 [0,1,0,1,0,0|1,0,1]=4 10156 B9R1.33 C#CCC1COCC1O Amb32950735 [0,1,0,1,0,0|0,0,1]=3 10157 B9R1.33 C#CC[C@@H]1CCC[C@H]1O Amb32944967 [0,1,0,1,0,0|1,0,1]=4 10158 B9R1.33 C#CC[C@@H]1CNC[C@H]1O Amb32944519 [0,1,0,1,0,0|1,0,1]=4 10159 B9R1.33 C#CC[C@@H]1COC[C@H]1O Amb32951021 [0,1,0,1,0,0|0,0,1]=3 10160 B9R1.33 C=C1COCC1CCC Amb35646841 [0,1,0,1,0,0|1,0,1]=4 10161 B9R1.33 C=CCC1CCCC1O Amb26866231 [0,1,0,1,0,0|1,0,1]=4 10162 B9R1.33 C=CCC1CNCC1O Amb25888807 [0,1,0,1,0,0|1,0,1]=4 10163 B9R1.33 C=CCC1COCC1Br Amb35736877 [0,1,0,1,0,0|1,0,1]=4 10164 B9R1.33 C=CCC1COCC1Cl Amb35736783 [0,1,0,1,0,0|1,0,1]=4 10165 B9R1.33 C=CCC1COCC1O Amb25802917 [0,1,0,1,0,0|0,0,1]=3 10166 B9R1.33 C=CCC1OCCC1Cl Amb28343089 [0,1,0,1,0,0|2,0,0]=4 10167 B9R1.33 C=CC[C@@H]1CCC[C@H]1O Amb25215733 [0,1,0,1,0,0|1,0,1]=4 10168 B9R1.33 C=CC[C@@H]1CNC[C@H]1O Amb25956350 [0,1,0,1,0,0|1,0,1]=4 10169 B9R1.33 C=CC[C@@H]1COC[C@H]1N Amb27254139 [0,1,0,1,0,0|1,0,1]=4 10170 B9R1.33 C=CC[C@@H]1COC[C@H]1O Amb27665455 [0,1,0,1,0,0|0,0,1]=3 10171 B9R1.33 C=CC[C@H]1CCC[C@@H]1O Amb27970558 [0,1,0,1,0,0|1,0,1]=4 10172 B9R1.33 C=CC[C@H]1CNC[C@H]1O Amb27203917 [0,1,0,1,0,0|1,0,1]=4 10173 B9R1.33 CC#CC1CCCC1O Amb25781551 [0,1,0,1,0,0|1,0,1]=4 10174 B9R1.33 CC#CC1CNCC1O Amb32950318 [0,1,0,1,0,0|1,0,1]=4 10175 B9R1.33 CC#CC1COCC1O Amb32944860 [0,1,0,1,0,0|0,0,1]=3 10176 B9R1.33 CC#C[C@@H]1CCC[C@H]1O Amb25277131 [0,1,0,1,0,0|1,0,1]=4 10177 B9R1.33 CC#C[C@@H]1CNC[C@H]1O Amb32950915 [0,1,0,1,0,0|1,0,1]=4 10178 B9R1.33 CC#C[C@@H]1COC[C@H]1O Amb33213091 [0,1,0,1,0,0|0,0,1]=3 10179 B9R1.33 CC1CC=NN1CCO Amb27662434 [0,1,0,1,0,0|1,0,1]=4 10180 B9R1.33 CC1CCCC1CNN Amb27481090 [0,1,0,1,0,0|2,0,0]=4 10181 B9R1.33 CC1CCCC1NCO Amb28429256 [0,1,0,1,0,0|1,0,0]=3 10182 B9R1.33 CC1CCCN1CCBr Amb18317658 [0,1,0,1,0,0|2,0,0]=4 10183 B9R1.33 CC1CCCN1CCBr Amb33804314 [0,1,0,1,0,0|2,0,0]=4 10184 B9R1.33 CC1CCCN1CCI Amb27806349 [0,1,0,1,0,0|2,0,0]=4 10185 B9R1.33 CC1CCCN1CCN Amb18962426 [0,1,0,1,0,0|2,0,0]=4 10186 B9R1.33 CC1CCCN1CCS Amb27834962 [0,1,0,1,0,0|1,1,0]=4 10187 B9R1.33 CC1CCNC1CCO Amb25865855 [0,1,0,1,0,0|1,0,0]=3 10188 B9R1.33 CC1CCOC1CCBr Amb33742803 [0,1,0,1,0,0|1,0,0]=3 10189 B9R1.33 CC1CCOC1CCN Amb33329020 [0,1,0,1,0,0|1,0,0]=3 10190 B9R1.33 CC1CCOC1CCO Amb33741891 [0,1,0,1,0,0|0,0,0]=2 10191 B9R1.33 CC1COCC1CCN Amb35635553 [0,1,0,1,0,0|1,0,0]=3 10192 B9R1.33 CC1NCSC1CCO Amb27185591 [0,1,0,1,0,0|1,1,0]=4 10193 B9R1.33 CC1OCCC1CCBr Amb33333670 [0,1,0,1,0,0|2,0,0]=4 10194 B9R1.33 CC1OCCC1CCN Amb25769636 [0,1,0,1,0,0|2,0,0]=4 10195 B9R1.33 CC1OCCC1CCO Amb33427650 [0,1,0,1,0,0|1,0,0]=3 10196 B9R1.33 CC1OCCC1CCS Amb33426770 [0,1,0,1,0,0|1,1,0]=4 10197 B9R1.33 CC1OCCC1CNO Amb33428024 [0,1,0,1,0,0|2,0,0]=4 10198 B9R1.33 CC1OCCC1CON Amb33427223 [0,1,0,1,0,0|2,0,0]=4 10199 B9R1.33 CCCC1CCCC1=O Amb8503562 [0,1,0,1,0,0|1,0,1]=4 10200 B9R1.33 CCCC1CCCC1N Amb18954322 [0,1,0,1,0,0|2,0,0]=4 10201 B9R1.33 CCCC1CCCC1O Amb26922499 [0,1,0,1,0,0|1,0,0]=3 10202 B9R1.33 CCCC1CCCN1N Amb25700027 [0,1,0,1,0,0|2,0,0]=4 10203 B9R1.33 CCCC1CCNC1C Amb18961055 [0,1,0,1,0,0|2,0,0]=4 10204 B9R1.33 CCCC1CNCC1C Amb27856203 [0,1,0,1,0,0|2,0,0]=4 10205 B9R1.33 CCCC1CNCC1O Amb27407775 [0,1,0,1,0,0|1,0,0]=3 10206 B9R1.33 CCCC1COCC1=O Amb35639022 [0,1,0,1,0,0|0,0,2]=4 10207 B9R1.33 CCCC1COCC1Br Amb35736880 [0,1,0,1,0,0|1,0,0]=3 10208 B9R1.33 CCCC1COCC1Cl Amb35736785 [0,1,0,1,0,0|1,0,0]=3 10209 B9R1.33 CCCC1COCC1N Amb29877503 [0,1,0,1,0,0|1,0,0]=3 10210 B9R1.33 CCCC1COCC1O Amb33213638 [0,1,0,1,0,0|0,0,0]=2 10211 B9R1.33 CCCC1COCC1S Amb32788392 [0,1,0,1,0,0|0,1,0]=3 10212 B9R1.33 CCCC1CSCC1Br Amb27656182 [0,1,0,1,0,0|1,1,0]=4 10213 B9R1.33 CCCC1NCCC1F Amb28053585 [0,1,0,1,0,0|2,0,0]=4 10214 B9R1.33 CCCC1OCCC1Cl Amb28320772 [0,1,0,1,0,0|1,0,0]=3 10215 B9R1.33 CCCC1SCCC1O Amb27171321 [0,1,0,1,0,0|0,1,0]=3 10216 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [0,1,0,1,0,0|1,0,1]=4 10217 B9R1.33 CCC[C@@H]1CCC[C@H]1O Amb24519919 [0,1,0,1,0,0|1,0,0]=3 10218 B9R1.33 CCC[C@@H]1CNC[C@@H]1N Amb32709349 [0,1,0,1,0,0|2,0,0]=4 10219 B9R1.33 CCC[C@@H]1CNC[C@H]1O Amb27639284 [0,1,0,1,0,0|1,0,0]=3 10220 B9R1.33 CCC[C@@H]1COC[C@H]1O Amb32950257 [0,1,0,1,0,0|0,0,0]=2 10221 B9R1.33 CCC[C@@H]1OCC[C@H]1Cl Amb27626973 [0,1,0,1,0,0|1,0,0]=3 10222 B9R1.33 CCC[C@@H]1SCC[C@@H]1O Amb27443600 [0,1,0,1,0,0|0,1,0]=3 10223 B9R1.33 CCC[C@@H]1SCC[C@H]1O Amb28206535 [0,1,0,1,0,0|0,1,0]=3 10224 B9R1.33 CCNC1COCC1C Amb35632011 [0,1,0,1,0,0|1,0,0]=3 10225 B9R1.33 CCNC1COCC1O Amb18281482 [0,1,0,1,0,0|0,0,0]=2 10226 B9R1.33 CCN[C@@H]1COC[C@H]1O Amb22748740 [0,1,0,1,0,0|0,0,0]=2 10227 B9R1.33 CCN[C@H]1COC[C@@H]1O Amb10608161 [0,1,0,1,0,0|0,0,0]=2 10228 B9R1.33 CCN[C@H]1COC[C@H]1O Amb34916488 [0,1,0,1,0,0|0,0,0]=2 10229 B9R1.33 CCOC1CCCC1Br Amb18321006 [0,1,0,1,0,0|2,0,0]=4 10230 B9R1.33 CCOC1CCCC1I Amb26333595 [0,1,0,1,0,0|2,0,0]=4 10231 B9R1.33 CCOC1CCCC1N Amb1138244 [0,1,0,1,0,0|2,0,0]=4 10232 B9R1.33 CCOC1CCCC1O Amb27837436 [0,1,0,1,0,0|1,0,0]=3 10233 B9R1.33 CCOC1CCOC1O Amb28315494 [0,1,0,1,0,0|2,0,0]=4 10234 B9R1.33 CCOC1COCC1Br Amb24481875 [0,1,0,1,0,0|1,0,0]=3 10235 B9R1.33 CCOC1COCC1I Amb25989873 [0,1,0,1,0,0|1,0,0]=3 10236 B9R1.33 CCOC1COCC1N Amb25888731 [0,1,0,1,0,0|1,0,0]=3 10237 B9R1.33 CCO[C@@H]1CCC[C@H]1Br Amb27657762 [0,1,0,1,0,0|2,0,0]=4 10238 B9R1.33 CCO[C@@H]1CCC[C@H]1N Amb26570508 [0,1,0,1,0,0|2,0,0]=4 10239 B9R1.33 CCO[C@@H]1CCC[C@H]1O Amb24595865 [0,1,0,1,0,0|1,0,0]=3 10240 B9R1.33 CCO[C@@H]1COC[C@H]1N Amb22748739 [0,1,0,1,0,0|1,0,0]=3 10241 B9R1.33 CCO[C@@H]1COC[C@H]1N Amb22757836 [0,1,0,1,0,0|1,0,0]=3 10242 B9R1.33 CCO[C@@H]1COC[C@H]1O Amb28350070 [0,1,0,1,0,0|0,0,0]=2 10243 B9R1.33 CCO[C@H]1COC[C@@H]1N Amb10608157 [0,1,0,1,0,0|1,0,0]=3 10244 B9R1.33 CCSC1CCCC1N Amb20623771 [0,1,0,1,0,0|2,0,0]=4 10245 B9R1.33 CCS[C@@H]1CCC[C@H]1Cl Amb28051667 [0,1,0,1,0,0|2,0,0]=4 10246 B9R1.33 CCS[C@@H]1COC[C@H]1O Amb35632202 [0,1,0,1,0,0|0,0,0]=2 10247 B9R1.33 CN1CCCC1CCBr Amb20668048 [0,1,0,1,0,0|2,0,0]=4 10248 B9R1.33 CN1CCCC1CCBr Amb24478647 [0,1,0,1,0,0|2,0,0]=4 10249 B9R1.33 CN1CCCC1CCCl Amb3940532 [0,1,0,1,0,0|2,0,0]=4 10250 B9R1.33 CN1CCCC1CCCl Amb8387380 [0,1,0,1,0,0|2,0,0]=4 10251 B9R1.33 CN1CCCC1CCN Amb3939814 [0,1,0,1,0,0|2,0,0]=4 10252 B9R1.33 CN1CCCC1CCO Amb3939053 [0,1,0,1,0,0|1,0,0]=3 10253 B9R1.33 CN1CCCC1CCS Amb33449384 [0,1,0,1,0,0|1,1,0]=4 10254 B9R1.33 CN1CCCN1CCN Amb28364791 [0,1,0,1,0,0|2,0,0]=4 10255 B9R1.33 CN1CCCN1CCO Amb28315540 [0,1,0,1,0,0|1,0,0]=3 10256 B9R1.33 CN1CCC[C@@H]1CCN Amb22386854 [0,1,0,1,0,0|2,0,0]=4 10257 B9R1.33 CN1CCC[C@@H]1CCN Amb31307961 [0,1,0,1,0,0|2,0,0]=4 10258 B9R1.33 CN1CCC[C@@H]1CCO Amb22755468 [0,1,0,1,0,0|1,0,0]=3 10259 B9R1.33 CN1CCC[C@H]1CCN Amb20241159 [0,1,0,1,0,0|2,0,0]=4 10260 B9R1.33 CN1CCC[C@H]1CCN Amb33801604 [0,1,0,1,0,0|2,0,0]=4 10261 B9R1.33 CN1CCC[C@H]1CCO Amb28366574 [0,1,0,1,0,0|1,0,0]=3 10262 B9R1.33 CNCC1CCCC1O Amb18642712 [0,1,0,1,0,0|1,0,0]=3 10263 B9R1.33 CNCC1CNCC1C Amb27946471 [0,1,0,1,0,0|2,0,0]=4 10264 B9R1.33 CNCC1COCC1C Amb35635594 [0,1,0,1,0,0|1,0,0]=3 10265 B9R1.33 CNC[C@@H]1CCC[C@@H]1N Amb35663444 [0,1,0,1,0,0|2,0,0]=4 10266 B9R1.33 COCC1CCCC1Br Amb27765324 [0,1,0,1,0,0|2,0,0]=4 10267 B9R1.33 COCC1CCCC1O Amb25223631 [0,1,0,1,0,0|1,0,0]=3 10268 B9R1.33 COCC1CNCC1C Amb29083431 [0,1,0,1,0,0|2,0,0]=4 10269 B9R1.33 COCC1CNCC1O Amb25835045 [0,1,0,1,0,0|1,0,0]=3 10270 B9R1.33 COCC1COCC1=O Amb35639023 [0,1,0,1,0,0|0,0,2]=4 10271 B9R1.33 COCC1COCC1Br Amb35736882 [0,1,0,1,0,0|1,0,0]=3 10272 B9R1.33 COCC1COCC1Cl Amb35736788 [0,1,0,1,0,0|1,0,0]=3 10273 B9R1.33 COCC1COCC1N Amb29877287 [0,1,0,1,0,0|1,0,0]=3 10274 B9R1.33 COCC1COCC1O Amb33212832 [0,1,0,1,0,0|0,0,0]=2 10275 B9R1.33 COCC1OCCC1N Amb28245566 [0,1,0,1,0,0|1,0,0]=3 10276 B9R1.33 COC[C@@H]1CCC[C@@H]1N Amb22748722 [0,1,0,1,0,0|2,0,0]=4 10277 B9R1.33 COC[C@@H]1CCC[C@H]1O Amb32950893 [0,1,0,1,0,0|1,0,0]=3 10278 B9R1.33 COC[C@@H]1CNC[C@H]1O Amb32945366 [0,1,0,1,0,0|1,0,0]=3 10279 B9R1.33 COC[C@@H]1COC[C@H]1O Amb32945988 [0,1,0,1,0,0|0,0,0]=2 10280 B9R1.33 COC[C@H]1C=CC[C@@H]1O Amb27652492 [0,1,0,1,0,0|1,0,1]=4 10281 B9R1.33 COC[C@H]1CCC[C@@H]1N Amb34916663 [0,1,0,1,0,0|2,0,0]=4 10282 B9R1.33 COC[C@H]1CCC[C@H]1N Amb10607714 [0,1,0,1,0,0|2,0,0]=4 10283 B9R1.33 CONC1COCC1C Amb35635909 [0,1,0,1,0,0|2,0,0]=4 10284 B9R1.33 CON[C@@H]1CCC[C@H]1O Amb27862229 [0,1,0,1,0,0|2,0,0]=4 10285 B9R1.33 CON[C@@H]1COC[C@H]1O Amb35608351 [0,1,0,1,0,0|1,0,0]=3 10286 B9R1.33 CSCC1CNCC1O Amb27970651 [0,1,0,1,0,0|1,0,0]=3 10287 B9R1.33 CSC[C@@H]1NCC[C@@H]1C Amb27216180 [0,1,0,1,0,0|1,1,0]=4 10288 B9R1.33 CSC[C@@H]1NCC[C@H]1C Amb28423462 [0,1,0,1,0,0|1,1,0]=4 10289 B9R1.33 CSC[C@H]1CNC[C@@H]1O Amb25174892 [0,1,0,1,0,0|1,0,0]=3 10290 B9R1.33 C[C@@H]1CCCN1CCN Amb27469487 [0,1,0,1,0,0|2,0,0]=4 10291 B9R1.33 C[C@@H]1CCC[C@H]1CCO Amb27207721 [0,1,0,1,0,0|1,0,0]=3 10292 B9R1.33 C[C@@H]1CCO[C@@H]1CCN Amb33483077 [0,1,0,1,0,0|1,0,0]=3 10293 B9R1.33 C[C@H]1CCCN1CCN Amb27389681 [0,1,0,1,0,0|2,0,0]=4 10294 B9R1.33 C[C@H]1NCC[C@@H]1CCO Amb27632925 [0,1,0,1,0,0|1,0,0]=3 10295 B9R1.33 C\C=C\C1CCCC1O Amb32944936 [0,1,0,1,0,0|1,0,1]=4 10296 B9R1.33 C\C=C\C1CNCC1O Amb32944799 [0,1,0,1,0,0|1,0,1]=4 10297 B9R1.33 C\C=C\C1COCC1O Amb33213646 [0,1,0,1,0,0|0,0,1]=3 10298 B9R1.33 C\C=C\[C@@H]1CCC[C@@H]1O Amb28069459 [0,1,0,1,0,0|1,0,1]=4 10299 B9R1.33 C\C=C\[C@@H]1CCC[C@H]1O Amb27196803 [0,1,0,1,0,0|1,0,1]=4 10300 B9R1.33 C\C=C\[C@@H]1CNC[C@H]1O Amb33212922 [0,1,0,1,0,0|1,0,1]=4 10301 B9R1.33 C\C=C\[C@@H]1COC[C@H]1O Amb32944441 [0,1,0,1,0,0|0,0,1]=3 10302 B9R1.33 ClCOC1OCCC1Cl Amb27477813 [0,1,0,1,0,0|2,0,0]=4 10303 B9R1.33 N#CCC1CCCC1O Amb18642327 [0,1,0,1,0,0|1,0,1]=4 10304 B9R1.33 N#CCC1CNCC1O Amb27842315 [0,1,0,1,0,0|1,0,1]=4 10305 B9R1.33 N#CC[C@@H]1CNC[C@H]1O Amb33208919 [0,1,0,1,0,0|1,0,1]=4 10306 B9R1.33 N#CC[C@@H]1CNC[C@H]1O Amb33330731 [0,1,0,1,0,0|1,0,1]=4 10307 B9R1.33 N#CC[C@H]1CCC[C@@H]1O Amb28195204 [0,1,0,1,0,0|1,0,1]=4 10308 B9R1.33 N#CN[C@@H]1COC[C@H]1O Amb28142109 [0,1,0,1,0,0|1,0,1]=4 10309 B9R1.33 N#CSC1COCC1O Amb27829901 [0,1,0,1,0,0|1,0,1]=4 10310 B9R1.33 NC1CCCC1CCBr Amb27875577 [0,1,0,1,0,0|2,0,0]=4 10311 B9R1.33 NC1CCCC1CCO Amb25888622 [0,1,0,1,0,0|1,0,0]=3 10312 B9R1.33 NCCC1CCCC1F Amb27222607 [0,1,0,1,0,0|2,0,0]=4 10313 B9R1.33 NCCC1CCCC1N Amb29868675 [0,1,0,1,0,0|2,0,0]=4 10314 B9R1.33 NCCC1CCCC1O Amb18832551 [0,1,0,1,0,0|1,0,0]=3 10315 B9R1.33 NCC[C@@H]1CCC[C@H]1N Amb29867730 [0,1,0,1,0,0|2,0,0]=4 10316 B9R1.33 NCC[C@@H]1CCC[C@H]1O Amb33209494 [0,1,0,1,0,0|1,0,0]=3 10317 B9R1.33 NCC[C@@H]1CCC[C@H]1O Amb33482662 [0,1,0,1,0,0|1,0,0]=3 10318 B9R1.33 NCC[C@@H]1COC[C@H]1O Amb35750594 [0,1,0,1,0,0|0,0,0]=2 10319 B9R1.33 NN1CCCC1CCO Amb27809143 [0,1,0,1,0,0|2,0,0]=4 10320 B9R1.33 N[C@@H]1CNC[C@@H]1CCF Amb32709362 [0,1,0,1,0,0|2,0,0]=4 10321 B9R1.33 N[C@H]1CCO[C@@H]1CCO Amb27215516 [0,1,0,1,0,0|1,0,0]=3 10322 B9R1.33 O=C1CCCC1CCO Amb27221111 [0,1,0,1,0,0|1,0,1]=4 10323 B9R1.33 O=C1CCCN1CCO Amb3939173 [0,1,0,1,0,0|1,0,1]=4 10324 B9R1.33 O=C1CCOC1CCO Amb27838611 [0,1,0,1,0,0|1,0,1]=4 10325 B9R1.33 O=NOC1COCC1O Amb27207674 [0,1,0,1,0,0|2,0,0]=4 10326 B9R1.33 OC1CCCC1CCF Amb27838511 [0,1,0,1,0,0|1,0,0]=3 10327 B9R1.33 OCCC1=C(Br)CCC1 Amb27826576 [0,1,0,1,0,0|1,0,1]=4 10328 B9R1.33 OCCC1C=CCC1O Amb27642147 [0,1,0,1,0,0|1,0,1]=4 10329 B9R1.33 OCCC1CCCC1F Amb27224301 [0,1,0,1,0,0|1,0,0]=3 10330 B9R1.33 OCCC1CCCC1O Amb25888928 [0,1,0,1,0,0|1,0,0]=3 10331 B9R1.33 OCCC1CSCC1O Amb27663939 [0,1,0,1,0,0|0,1,0]=3 10332 B9R1.33 OCC[C@@H]1C=CC[C@@H]1O Amb27207047 [0,1,0,1,0,0|1,0,1]=4 10333 B9R1.33 OCC[C@@H]1CCC[C@@H]1O Amb27843176 [0,1,0,1,0,0|1,0,0]=3 10334 B9R1.33 OCC[C@@H]1CCC[C@H]1O Amb28292507 [0,1,0,1,0,0|1,0,0]=3 10335 B9R1.33 OCC[C@H]1CC=C[C@H]1O Amb27218968 [0,1,0,1,0,0|1,0,1]=4 10336 B9R1.33 O[C@@H]1CNC[C@H]1CCF Amb32709331 [0,1,0,1,0,0|1,0,0]=3 10337 B9R1.33 [C-]#[N+]CC1CCCC1C Amb27793797 [0,1,0,1,0,0|2,0,0]=4 10338 B9R1.33 [N-]=[N+]=N[C@@H]1COC[C@H]1O Amb27849741 [0,1,0,1,0,0|2,0,0]=4 10339 B9R1.33 [N-]=[N+]=N[C@H]1COC[C@@H]1O Amb27633985 [0,1,0,1,0,0|2,0,0]=4 10340 B9R1.33 [N-]=[N+]=N[C@H]1COC[C@H]1O Amb28195167 [0,1,0,1,0,0|2,0,0]=4 10341 B9R1.48 C=C1CCOC[C@H](O)C1 Amb27406726 [0,1,0,1,0,0|0,0,1]=3 10342 B9R1.48 CC1CC(=O)NCCO1 Amb27244386 [0,1,0,1,0,0|1,0,1]=4 10343 B9R1.48 CC1CC(C)NCCN1 Amb18832587 [0,1,0,1,0,0|2,0,0]=4 10344 B9R1.48 CC1CCC=CC(O)C1 Amb28400665 [0,1,0,1,0,0|1,0,1]=4 10345 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|2,0,0]=4 10346 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [0,1,0,1,0,0|1,0,1]=4 10347 B9R1.48 CC1CCCCC(Br)C1 Amb27640824 [0,1,0,1,0,0|2,0,0]=4 10348 B9R1.48 CC1CCCCC(C)N1 Amb27859477 [0,1,0,1,0,0|2,0,0]=4 10349 B9R1.48 CC1CCCCC(O)C1 Amb28051128 [0,1,0,1,0,0|1,0,0]=3 10350 B9R1.48 CC1CCCCN(C)C1 Amb27211471 [0,1,0,1,0,0|2,0,0]=4 10351 B9R1.48 CC1CCNCC(C)C1 Amb20622727 [0,1,0,1,0,0|2,0,0]=4 10352 B9R1.48 CC1CCNCC(C)O1 Amb32666605 [0,1,0,1,0,0|1,0,0]=3 10353 B9R1.48 CC1CCOCC(C)N1 Amb27812547 [0,1,0,1,0,0|1,0,0]=3 10354 B9R1.48 CC1CCSCC(C)N1 Amb28124099 [0,1,0,1,0,0|1,1,0]=4 10355 B9R1.48 CC1COCCC(O)O1 Amb27771498 [0,1,0,1,0,0|1,0,0]=3 10356 B9R1.48 CC1COCCN(N)C1 Amb27435797 [0,1,0,1,0,0|2,0,0]=4 10357 B9R1.48 CN1CCCCC(N)C1 Amb19516791 [0,1,0,1,0,0|2,0,0]=4 10358 B9R1.48 CN1CCOCC(Br)C1 Amb28346110 [0,1,0,1,0,0|2,0,0]=4 10359 B9R1.48 CN1CCOCC(N)C1 Amb16233734 [0,1,0,1,0,0|2,0,0]=4 10360 B9R1.48 CN1CCOCC(O)C1 Amb32412171 [0,1,0,1,0,0|1,0,0]=3 10361 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [0,1,0,1,0,0|2,0,0]=4 10362 B9R1.48 C[C@@H]1CCNC[C@H](C)C1 Amb35746843 [0,1,0,1,0,0|2,0,0]=4 10363 B9R1.48 C[C@H]1CCNC[C@@H](C)O1 Amb32667163 [0,1,0,1,0,0|1,0,0]=3 10364 B9R1.48 C[C@H]1C[C@@H](C)NCCN1 Amb27424902 [0,1,0,1,0,0|2,0,0]=4 10365 B9R1.48 NC1CCCCC(F)C1 Amb24454709 [0,1,0,1,0,0|2,0,0]=4 10366 B9R1.48 N[C@@H]1CCCC[C@H](O)C1 Amb27188377 [0,1,0,1,0,0|1,0,0]=3 10367 B9R1.48 O=C1CCCCC(O)C1 Amb27838745 [0,1,0,1,0,0|1,0,0]=3 10368 B9R1.48 O=C1CCCCC(O)O1 Amb27424648 [0,1,0,1,0,0|2,0,0]=4 10369 B9R1.48 O=C1CCCC[C@H](O)C1 Amb27618242 [0,1,0,1,0,0|1,0,0]=3 10370 B9R1.48 OC1C=C(Br)CCCC1 Amb28455049 [0,1,0,1,0,0|1,0,1]=4 10371 B9R1.49 C=C1CCCC(C)CC1 Amb22364866 [0,1,0,1,0,0|2,0,0]=4 10372 B9R1.49 CC1C=CC(O)CCC1 Amb27599988 [0,1,0,1,0,0|1,0,1]=4 10373 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,1,0,1,0,0|2,0,0]=4 10374 B9R1.49 CC1CCCC(C)NC1 Amb19148123 [0,1,0,1,0,0|2,0,0]=4 10375 B9R1.49 CC1CCCC(Cl)CC1 Amb27860130 [0,1,0,1,0,0|2,0,0]=4 10376 B9R1.49 CC1CCCC(N)CC1 Amb25178098 [0,1,0,1,0,0|2,0,0]=4 10377 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|1,0,0]=3 10378 B9R1.49 CC1CCCC(S)CC1 Amb26326403 [0,1,0,1,0,0|1,1,0]=4 10379 B9R1.49 CC1CCCN(C)CC1 Amb27837612 [0,1,0,1,0,0|2,0,0]=4 10380 B9R1.49 CC1CCCN(N)CC1 Amb27424632 [0,1,0,1,0,0|2,0,0]=4 10381 B9R1.49 CC1CCN(C)CCN1 Amb18943772 [0,1,0,1,0,0|2,0,0]=4 10382 B9R1.49 CC1CCNC(C)CN1 Amb28123868 [0,1,0,1,0,0|2,0,0]=4 10383 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,1,0,0|1,0,1]=4 10384 B9R1.49 CC1CCOC(C)CN1 Amb27641711 [0,1,0,1,0,0|1,0,0]=3 10385 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,1,0,1,0,0|1,1,0]=4 10386 B9R1.49 CC1CCS(=O)CCN1 Amb28555361 [0,1,0,1,0,0|1,1,0]=4 10387 B9R1.49 CC1CNCC(O)CN1 Amb27629773 [0,1,0,1,0,0|2,0,0]=4 10388 B9R1.49 CN1CCCC(O)CC1 Amb18832552 [0,1,0,1,0,0|2,0,0]=4 10389 B9R1.49 CN1CCCC(O)CC1 Amb22751622 [0,1,0,1,0,0|2,0,0]=4 10390 B9R1.49 C[C@@H]1C=C[C@@H](O)CCC1 Amb27220561 [0,1,0,1,0,0|1,0,1]=4 10391 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,1,0,1,0,0|2,0,0]=4 10392 B9R1.49 C[C@@H]1CCO[C@H](C)CN1 Amb31156635 [0,1,0,1,0,0|1,0,0]=3 10393 B9R1.49 C[C@@H]1CCO[C@H](C)CN1 Amb33276620 [0,1,0,1,0,0|1,0,0]=3 10394 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,1,0,1,0,0|2,0,0]=4 10395 B9R1.49 C[C@H]1CCC[C@@H](O)CC1 Amb27661374 [0,1,0,1,0,0|1,0,0]=3 10396 B9R1.49 C[C@H]1CCC[C@H](O)CC1 Amb27220545 [0,1,0,1,0,0|1,0,0]=3 10397 B9R1.49 ClC1CCCC(Cl)CC1 Amb22364836 [0,1,0,1,0,0|2,0,0]=4 10398 B9R1.49 Cl[C@H]1CCC[C@H](Cl)CC1 Amb28399791 [0,1,0,1,0,0|2,0,0]=4 10399 B9R1.49 NC1CCCC(F)CC1 Amb28289169 [0,1,0,1,0,0|2,0,0]=4 10400 B9R1.49 N[C@@H]1CCC[C@@H](Cl)CC1 Amb27447260 [0,1,0,1,0,0|2,0,0]=4 10401 B9R1.49 N[C@@H]1CCC[C@H](O)CC1 Amb27221049 [0,1,0,1,0,0|1,0,0]=3 10402 B9R1.49 O=C1CCCC(O)CN1 Amb22491274 [0,1,0,1,0,0|1,0,1]=4 10403 B9R1.49 O=C1CCCC(O)CO1 Amb28138759 [0,1,0,1,0,0|0,0,1]=3 10404 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,1,0,1,0,0|1,0,1]=4 10405 B9R1.49 OC1CCC(O)CSC1 Amb25316350 [0,1,0,1,0,0|0,1,0]=3 10406 B9R1.49 O[C@@H]1CCC[C@@H](O)CC1 Amb27647850 [0,1,0,1,0,0|1,0,0]=3 10407 B9R1.49 O[C@H]1CC[C@H](O)CSC1 Amb27220536 [0,1,0,1,0,0|0,1,0]=3 10408 B9R1.50 BrC1CCCCCCC1 Amb6366088 [0,1,0,1,0,0|2,0,0]=4 10409 B9R1.50 CC1CCCCCCC1 Amb22230834 [0,1,0,1,0,0|2,0,0]=4 10410 B9R1.50 CC1CCCCCCN1 Amb26579162 [0,1,0,1,0,0|2,0,0]=4 10411 B9R1.50 CC1CCNCCCN1 Amb18832588 [0,1,0,1,0,0|2,0,0]=4 10412 B9R1.50 CC1CNCCCCN1 Amb28067733 [0,1,0,1,0,0|2,0,0]=4 10413 B9R1.50 CC1OCCCCCO1 Amb28367128 [0,1,0,1,0,0|1,0,0]=3 10414 B9R1.50 CN1CCCCCCC1 Amb26406289 [0,1,0,1,0,0|2,0,0]=4 10415 B9R1.50 CN1CCCNCCC1 Amb18276963 [0,1,0,1,0,0|2,0,0]=4 10416 B9R1.50 CN1CCCNCCC1 Amb33483191 [0,1,0,1,0,0|2,0,0]=4 10417 B9R1.50 ClC1CCCCCCC1 Amb4018627 [0,1,0,1,0,0|2,0,0]=4 10418 B9R1.50 ClC1CCCCOCC1 Amb27984820 [0,1,0,1,0,0|1,0,0]=3 10419 B9R1.50 FC1CNCCCNC1 Amb27637869 [0,1,0,1,0,0|2,0,0]=4 10420 B9R1.50 NC1CCCCCCC1 Amb2720323 [0,1,0,1,0,0|2,0,0]=4 10421 B9R1.50 NC1CCCCCNC1 Amb24447204 [0,1,0,1,0,0|2,0,0]=4 10422 B9R1.50 NC1CCCCCNC1 Amb32686531 [0,1,0,1,0,0|2,0,0]=4 10423 B9R1.50 NN1CCCCCCC1 Amb27203446 [0,1,0,1,0,0|2,0,0]=4 10424 B9R1.50 O=C1CCCCCCC1 Amb2721546 [0,1,0,1,0,0|1,0,1]=4 10425 B9R1.50 O=C1CCCCCCO1 Amb27468239 [0,1,0,1,0,0|1,0,1]=4 10426 B9R1.50 OC1C=CCCCCC1 Amb22364937 [0,1,0,1,0,0|1,0,1]=4 10427 B9R1.50 OC1C=CCCCOC1 Amb27452486 [0,1,0,1,0,0|0,0,1]=3 10428 B9R1.50 OC1CC#CCCCC1 Amb27956638 [0,1,0,1,0,0|1,0,0]=3 10429 B9R1.50 OC1CC=CCCOC1 Amb22364794 [0,1,0,1,0,0|0,0,1]=3 10430 B9R1.50 OC1CCC=CCCC1 Amb21858009 [0,1,0,1,0,0|1,0,1]=4 10431 B9R1.50 OC1CCCCCCC1 Amb6608643 [0,1,0,1,0,0|1,0,0]=3 10432 B9R1.50 OC1CCCCCCO1 Amb27970488 [0,1,0,1,0,0|1,0,0]=3 10433 B9R1.50 OC1CCCCCOC1 Amb22364795 [0,1,0,1,0,0|0,0,0]=2 10434 B9R1.50 OC1CCCCSCC1 Amb28315547 [0,1,0,1,0,0|0,1,0]=3 10435 B9R1.50 OC1CCCOCOC1 Amb27598449 [0,1,0,1,0,0|0,0,0]=2 10436 B9R1.50 OC1CNCCCNC1 Amb30867935 [0,1,0,1,0,0|1,0,0]=3 10437 B9R1.50 OC1CSCCCSC1 Amb9799330 [0,1,0,1,0,0|0,1,0]=3 10438 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [0,1,0,1,0,0|1,0,1]=4 10439 B9R1.50 O[C@@H]1CCC=CCCC1 Amb25781269 [0,1,0,1,0,0|1,0,1]=4 10440 B9R1.50 O[C@@H]1CCCOCOC1 Amb27481202 [0,1,0,1,0,0|0,0,0]=2 10441 B9R1.50 O[C@H]1CCC=CCCC1 Amb24481888 [0,1,0,1,0,0|1,0,1]=4 10442 B9R1.50 SC1CCCCCCC1 Amb7784772 [0,1,0,1,0,0|1,1,0]=4 10443 B9R1.57 CCCC1C(CO)S1=O Amb27605367 [0,1,0,1,0,0|0,1,0]=3 10444 B9R1.57 CCCC1C(Cl)C1CO Amb27764896 [0,1,0,1,0,0|1,0,0]=3 10445 B9R1.57 CCCC1C(F)C1CO Amb27651625 [0,1,0,1,0,0|1,0,0]=3 10446 B9R1.57 CCC[C@@H]1[C@H](CO)S1=O Amb27440847 [0,1,0,1,0,0|0,1,0]=3 10447 B9R1.58 CCC1CC(CCN)C1 Amb27962846 [0,1,0,1,0,0|2,0,0]=4 10448 B9R1.58 CCC1CN(CCBr)C1 Amb35587568 [0,1,0,1,0,0|2,0,0]=4 10449 B9R1.58 CCC1CN(CCCl)C1 Amb35587567 [0,1,0,1,0,0|2,0,0]=4 10450 B9R1.58 CCC1CN(CCO)C1 Amb24402628 [0,1,0,1,0,0|1,0,0]=3 10451 B9R1.58 CCC1CN(CCS)C1 Amb29892069 [0,1,0,1,0,0|1,1,0]=4 10452 B9R1.58 CCCC1CC(CN)C1 Amb26537008 [0,1,0,1,0,0|2,0,0]=4 10453 B9R1.58 CCOC1CC(CO)C1 Amb28077103 [0,1,0,1,0,0|2,0,0]=4 10454 B9R1.58 COC1CN(CCO)C1 Amb27198419 [0,1,0,1,0,0|2,0,0]=4 10455 B9R1.58 OCCN1CC(CF)C1 Amb33618456 [0,1,0,1,0,0|2,0,0]=4 10456 B9R1.58 OCCN1CC(CF)C1 Amb33714664 [0,1,0,1,0,0|2,0,0]=4 10457 B9R1.69 C=C1CC[C@H](C)[C@H](O)C1 Amb28133380 [0,1,0,1,0,0|1,0,0]=3 10458 B9R1.69 C=C1C[C@@H](O)OC[C@H]1O Amb27662357 [0,1,0,1,0,0|0,0,2]=4 10459 B9R1.69 CC1=CC(O)[C@H](C)CC1 Amb28049248 [0,1,0,1,0,0|1,0,1]=4 10460 B9R1.69 CC1=CCC(O)C(C)C1 Amb27977995 [0,1,0,1,0,0|1,0,1]=4 10461 B9R1.69 CC1=CC[C@@H](O)C(C)C1 Amb27956617 [0,1,0,1,0,0|1,0,1]=4 10462 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|1,0,1]=4 10463 B9R1.69 CC1CC(=O)CC[C@H]1C Amb28141697 [0,1,0,1,0,0|2,0,0]=4 10464 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,1,0,1,0,0|1,0,1]=4 10465 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,1,0,1,0,0|0,0,1]=3 10466 B9R1.69 CC1CC(C)C(C)CN1 Amb33328513 [0,1,0,1,0,0|2,0,0]=4 10467 B9R1.69 CC1CC(C)C(N)CN1 Amb33500870 [0,1,0,1,0,0|2,0,0]=4 10468 B9R1.69 CC1CC(N)CCC1N Amb27440794 [0,1,0,1,0,0|2,0,0]=4 10469 B9R1.69 CC1CC(N)CCC1O Amb24624100 [0,1,0,1,0,0|1,0,0]=3 10470 B9R1.69 CC1CC(O)C(C)CN1 Amb21867988 [0,1,0,1,0,0|2,0,0]=4 10471 B9R1.69 CC1CC(O)C(C)CN1 Amb596542 [0,1,0,1,0,0|2,0,0]=4 10472 B9R1.69 CC1CC(O)C=CC1O Amb27978689 [0,1,0,1,0,0|1,0,1]=4 10473 B9R1.69 CC1CC(O)CCC1O Amb24726092 [0,1,0,1,0,0|1,0,0]=3 10474 B9R1.69 CC1CCC(=O)CC1C Amb22732216 [0,1,0,1,0,0|2,0,0]=4 10475 B9R1.69 CC1CCC(=O)CC1Cl Amb27872191 [0,1,0,1,0,0|2,0,0]=4 10476 B9R1.69 CC1CCC(=O)CC1I Amb32867595 [0,1,0,1,0,0|2,0,0]=4 10477 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,1,0,1,0,0|2,0,0]=4 10478 B9R1.69 CC1CCC(=O)CC1O Amb27180113 [0,1,0,1,0,0|1,0,0]=3 10479 B9R1.69 CC1CCC(Br)C(C)C1 Amb18329561 [0,1,0,1,0,0|2,0,0]=4 10480 B9R1.69 CC1CCC(Br)CC1C Amb25838066 [0,1,0,1,0,0|2,0,0]=4 10481 B9R1.69 CC1CCC(C)C(C)C1 Amb4017852 [0,1,0,1,0,0|2,0,0]=4 10482 B9R1.69 CC1CCC(C)C(N)C1 Amb6374323 [0,1,0,1,0,0|2,0,0]=4 10483 B9R1.69 CC1CCC(C)C(O)C1 Amb3941490 [0,1,0,1,0,0|1,0,0]=3 10484 B9R1.69 CC1CCC(C)C(S)C1 Amb25296681 [0,1,0,1,0,0|1,1,0]=4 10485 B9R1.69 CC1CCC(Cl)C(C)C1 Amb27837439 [0,1,0,1,0,0|2,0,0]=4 10486 B9R1.69 CC1CCC(Cl)C(O)C1 Amb27965032 [0,1,0,1,0,0|2,0,0]=4 10487 B9R1.69 CC1CCC(Cl)CC1C Amb26562244 [0,1,0,1,0,0|2,0,0]=4 10488 B9R1.69 CC1CCC(N)C(C)C1 Amb19515132 [0,1,0,1,0,0|2,0,0]=4 10489 B9R1.69 CC1CCC(N)CC1C Amb33543352 [0,1,0,1,0,0|2,0,0]=4 10490 B9R1.69 CC1CCC(N)CC1N Amb25321520 [0,1,0,1,0,0|2,0,0]=4 10491 B9R1.69 CC1CCC(O)C(C)C1 Amb4034595 [0,1,0,1,0,0|1,0,0]=3 10492 B9R1.69 CC1CCC(O)C(Cl)C1 Amb28291502 [0,1,0,1,0,0|2,0,0]=4 10493 B9R1.69 CC1CCC(O)C(F)C1 Amb33229936 [0,1,0,1,0,0|2,0,0]=4 10494 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [0,1,0,1,0,0|2,0,0]=4 10495 B9R1.69 CC1CCC(O)C(S)C1 Amb27495493 [0,1,0,1,0,0|2,0,0]=4 10496 B9R1.69 CC1CCC(O)CC1C Amb10844787 [0,1,0,1,0,0|2,0,0]=4 10497 B9R1.69 CC1CCC(O)CC1N Amb32867259 [0,1,0,1,0,0|2,0,0]=4 10498 B9R1.69 CC1CCC(S)C(C)C1 Amb26043135 [0,1,0,1,0,0|1,1,0]=4 10499 B9R1.69 CC1CCC(S)CC1C Amb27589824 [0,1,0,1,0,0|2,0,0]=4 10500 B9R1.69 CC1CCN(C)CC1F Amb27404980 [0,1,0,1,0,0|2,0,0]=4 10501 B9R1.69 CC1CC[C@@H](O)[C@H](N)C1 Amb25912139 [0,1,0,1,0,0|2,0,0]=4 10502 B9R1.69 CC1CN(C)CCC1O Amb4362743 [0,1,0,1,0,0|2,0,0]=4 10503 B9R1.69 CC1CNC(=O)CC1O Amb27816242 [0,1,0,1,0,0|2,0,0]=4 10504 B9R1.69 CC1OCC(N)C(C)O1 Amb27883486 [0,1,0,1,0,0|2,0,0]=4 10505 B9R1.69 CC1OCC(O)C(C)O1 Amb27164355 [0,1,0,1,0,0|1,0,0]=3 10506 B9R1.69 CN1CCC(N)C(O)C1 Amb18832535 [0,1,0,1,0,0|2,0,0]=4 10507 B9R1.69 CN1CCC(O)C(O)C1 Amb27768822 [0,1,0,1,0,0|2,0,0]=4 10508 B9R1.69 CN1CC[C@@H](N)[C@H](O)C1 Amb27422334 [0,1,0,1,0,0|2,0,0]=4 10509 B9R1.69 CN1CC[C@@H](O)[C@H](O)C1 Amb26922695 [0,1,0,1,0,0|2,0,0]=4 10510 B9R1.69 CN1CC[C@H](O)[C@H](O)C1 Amb27963323 [0,1,0,1,0,0|2,0,0]=4 10511 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1O Amb34913315 [0,1,0,1,0,0|1,0,1]=4 10512 B9R1.69 C[C@@H]1CCC(O)C[C@H]1C Amb27445019 [0,1,0,1,0,0|2,0,0]=4 10513 B9R1.69 C[C@@H]1CCN(C)C[C@@H]1O Amb27767895 [0,1,0,1,0,0|1,0,0]=3 10514 B9R1.69 C[C@@H]1CCN(C)C[C@H]1N Amb27264813 [0,1,0,1,0,0|2,0,0]=4 10515 B9R1.69 C[C@@H]1CCN(C)C[C@H]1O Amb27196487 [0,1,0,1,0,0|1,0,0]=3 10516 B9R1.69 C[C@@H]1CC[C@@H](C)[C@@H](N)C1 Amb28055512 [0,1,0,1,0,0|2,0,0]=4 10517 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](C)C1 Amb28061313 [0,1,0,1,0,0|2,0,0]=4 10518 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27184906 [0,1,0,1,0,0|1,0,0]=3 10519 B9R1.69 C[C@@H]1CC[C@@H](N)C[C@H]1N Amb27630676 [0,1,0,1,0,0|2,0,0]=4 10520 B9R1.69 C[C@@H]1CC[C@@H](O)C[C@H]1C Amb28053499 [0,1,0,1,0,0|2,0,0]=4 10521 B9R1.69 C[C@@H]1CC[C@H](N)C[C@H]1N Amb28133899 [0,1,0,1,0,0|2,0,0]=4 10522 B9R1.69 C[C@@H]1CC[C@H](N)[C@H](C)C1 Amb28055517 [0,1,0,1,0,0|2,0,0]=4 10523 B9R1.69 C[C@@H]1CC[C@H](O)[C@H](O)C1 Amb28204040 [0,1,0,1,0,0|2,0,0]=4 10524 B9R1.69 C[C@@H]1CN(C)CC[C@@H]1O Amb27962392 [0,1,0,1,0,0|2,0,0]=4 10525 B9R1.69 C[C@@H]1CN(C)CC[C@H]1O Amb27218249 [0,1,0,1,0,0|2,0,0]=4 10526 B9R1.69 C[C@@H]1COC(O)[C@H](C)C1 Amb28429550 [0,1,0,1,0,0|2,0,0]=4 10527 B9R1.69 C[C@@H]1C[C@@H](O)C(Br)CO1 Amb27880659 [0,1,0,1,0,0|2,0,0]=4 10528 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](O)CN1 Amb27629275 [0,1,0,1,0,0|2,0,0]=4 10529 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](C)CN1 Amb27817873 [0,1,0,1,0,0|2,0,0]=4 10530 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](O)CN1 Amb28349062 [0,1,0,1,0,0|2,0,0]=4 10531 B9R1.69 C[C@@H]1C[C@H](N)CC[C@@H]1O Amb27968631 [0,1,0,1,0,0|1,0,0]=3 10532 B9R1.69 C[C@@H]1C[C@H](N)CC[C@H]1O Amb28346268 [0,1,0,1,0,0|1,0,0]=3 10533 B9R1.69 C[C@@H]1C[C@H](O)[C@H](O)CO1 Amb28065939 [0,1,0,1,0,0|1,0,0]=3 10534 B9R1.69 C[C@@H]1OC(O)CC[C@@H]1O Amb27441416 [0,1,0,1,0,0|2,0,0]=4 10535 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|2,0,0]=4 10536 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,1,0,1,0,0|1,0,1]=4 10537 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1C Amb26440377 [0,1,0,1,0,0|2,0,0]=4 10538 B9R1.69 C[C@H]1CCC(=O)C[C@H]1C Amb26910681 [0,1,0,1,0,0|2,0,0]=4 10539 B9R1.69 C[C@H]1CC[C@@H](C)C[C@@H]1O Amb27221189 [0,1,0,1,0,0|1,0,0]=3 10540 B9R1.69 C[C@H]1CC[C@@H](C)C[C@H]1O Amb27848128 [0,1,0,1,0,0|1,0,0]=3 10541 B9R1.69 C[C@H]1CC[C@@H](O)C[C@@H]1C Amb27452456 [0,1,0,1,0,0|2,0,0]=4 10542 B9R1.69 C[C@H]1CC[C@@H](O)C[C@H]1C Amb28247082 [0,1,0,1,0,0|2,0,0]=4 10543 B9R1.69 C[C@H]1CC[C@H](C)[C@@H](O)C1 Amb27849642 [0,1,0,1,0,0|1,0,0]=3 10544 B9R1.69 C[C@H]1CC[C@H](O)C[C@H]1C Amb28134680 [0,1,0,1,0,0|2,0,0]=4 10545 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,1,0,1,0,0|2,0,0]=4 10546 B9R1.69 C[C@H]1C[C@@H](C)COC1O Amb27441083 [0,1,0,1,0,0|2,0,0]=4 10547 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1C Amb27978914 [0,1,0,1,0,0|2,0,0]=4 10548 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1C Amb26026793 [0,1,0,1,0,0|2,0,0]=4 10549 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1N Amb28055532 [0,1,0,1,0,0|2,0,0]=4 10550 B9R1.69 NC1CCC(O)C(N)C1 Amb26491613 [0,1,0,1,0,0|2,0,0]=4 10551 B9R1.69 NC1CC[C@@H](O)[C@@H](O)C1 Amb35746868 [0,1,0,1,0,0|2,0,0]=4 10552 B9R1.69 NC1CC[C@H](O)[C@H](O)C1 Amb32680333 [0,1,0,1,0,0|2,0,0]=4 10553 B9R1.69 N[C@@H]1CC[C@@H](O)[C@@H](O)C1 Amb28131188 [0,1,0,1,0,0|2,0,0]=4 10554 B9R1.69 N[C@@H]1CC[C@H](O)[C@H](N)C1 Amb27461450 [0,1,0,1,0,0|2,0,0]=4 10555 B9R1.69 OC1CC(O)C(O)CO1 Amb8479713 [0,1,0,1,0,0|1,0,0]=3 10556 B9R1.69 OC1CCC(O)C(O)C1 Amb27960811 [0,1,0,1,0,0|2,0,0]=4 10557 B9R1.69 OC1CC[C@H](O)[C@H](O)C1 Amb27260232 [0,1,0,1,0,0|2,0,0]=4 10558 B9R1.69 OC1C[C@@H](O)[C@H](O)CO1 Amb16183698 [0,1,0,1,0,0|1,0,0]=3 10559 B9R1.69 OC1C[C@H](O)[C@@H](O)CO1 Amb27217967 [0,1,0,1,0,0|1,0,0]=3 10560 B9R1.69 OC1C[C@H](O)[C@H](O)CO1 Amb20240603 [0,1,0,1,0,0|1,0,0]=3 10561 B9R1.69 O[C@@H]1CC[C@@H](O)[C@H](O)C1 Amb28428412 [0,1,0,1,0,0|2,0,0]=4 10562 B9R1.69 O[C@@H]1C[C@@H](O)[C@@H](O)CO1 Amb8394973 [0,1,0,1,0,0|1,0,0]=3 10563 B9R1.69 O[C@H]1CC[C@H](O)[C@H](O)C1 Amb27219495 [0,1,0,1,0,0|2,0,0]=4 10564 B9R1.69 O[C@H]1CO[C@@H](O)C[C@H]1O Amb10072157 [0,1,0,1,0,0|1,0,0]=3 10565 B9R1.69 O[C@H]1C[C@H](O)OC[C@H]1O Amb26584544 [0,1,0,1,0,0|1,0,0]=3 10566 B9R1.73 BrCCC(Br)C1CCC1 Amb23455638 [0,1,0,1,0,0|2,0,0]=4 10567 B9R1.73 C=C(CCN)C1CCC1 Amb33313838 [0,1,0,1,0,0|2,0,0]=4 10568 B9R1.73 CC(CCCl)C1CCC1 Amb28345996 [0,1,0,1,0,0|2,0,0]=4 10569 B9R1.73 CC(CCN)C1CCC1 Amb26018136 [0,1,0,1,0,0|2,0,0]=4 10570 B9R1.73 CC(CCO)C1CCS1 Amb28202624 [0,1,0,1,0,0|2,0,0]=4 10571 B9R1.73 CC(CCO)C1COC1 Amb27851696 [0,1,0,1,0,0|2,0,0]=4 10572 B9R1.73 CCCC(=O)C1CCC1 Amb24390209 [0,1,0,1,0,0|2,0,0]=4 10573 B9R1.73 CCCC(Br)C1CCC1 Amb27669631 [0,1,0,1,0,0|2,0,0]=4 10574 B9R1.73 CCCC(C)C1CCN1 Amb27883257 [0,1,0,1,0,0|2,0,0]=4 10575 B9R1.73 CCCC(N)C1CCC1 Amb25374014 [0,1,0,1,0,0|2,0,0]=4 10576 B9R1.73 CCCC(O)C1CCC1 Amb27202614 [0,1,0,1,0,0|2,0,0]=4 10577 B9R1.73 CCCC(S)C1CCC1 Amb27954339 [0,1,0,1,0,0|2,0,0]=4 10578 B9R1.73 CN(CCI)C1CCC1 Amb28193136 [0,1,0,1,0,0|2,0,0]=4 10579 B9R1.73 CN(CCN)C1CCC1 Amb28124352 [0,1,0,1,0,0|2,0,0]=4 10580 B9R1.73 CN(CCO)C1CCC1 Amb25127350 [0,1,0,1,0,0|1,0,0]=3 10581 B9R1.73 CN(CCS)C1CCC1 Amb27172102 [0,1,0,1,0,0|1,1,0]=4 10582 B9R1.73 CNCC(C)C1CCO1 Amb27797474 [0,1,0,1,0,0|2,0,0]=4 10583 B9R1.73 NC(CCO)C1CCC1 Amb27974903 [0,1,0,1,0,0|1,0,0]=3 10584 B9R1.73 NC(CCO)C1CCC1 Amb33482936 [0,1,0,1,0,0|1,0,0]=3 10585 B9R1.73 NC(CCO)C1CNC1 Amb22296982 [0,1,0,1,0,0|2,0,0]=4 10586 B9R1.73 NCCC(=O)C1CCC1 Amb26627796 [0,1,0,1,0,0|2,0,0]=4 10587 B9R1.73 NCCC(F)C1CCC1 Amb25300576 [0,1,0,1,0,0|2,0,0]=4 10588 B9R1.73 NCCC(O)C1CCC1 Amb22642025 [0,1,0,1,0,0|2,0,0]=4 10589 B9R1.73 NCC[C@@H](O)C1CCC1 Amb33314119 [0,1,0,1,0,0|2,0,0]=4 10590 B9R1.73 NCC[C@H](O)C1CCC1 Amb33195479 [0,1,0,1,0,0|2,0,0]=4 10591 B9R1.73 N[C@@H](CCO)C1CCC1 Amb28072891 [0,1,0,1,0,0|1,0,0]=3 10592 B9R1.73 O=C(CCCl)C1CCC1 Amb27591060 [0,1,0,1,0,0|2,0,0]=4 10593 B9R1.73 OCCC(O)C1CCC1 Amb23512730 [0,1,0,1,0,0|1,0,0]=3 10594 B9R1.73 OCCC(O)C1CNC1 Amb22298370 [0,1,0,1,0,0|2,0,0]=4 10595 B9R1.75 C=C(CCN)CC1CC1 Amb33361176 [0,1,0,1,0,0|2,0,0]=4 10596 B9R1.75 CC(CCN)CC1CC1 Amb25188986 [0,1,0,1,0,0|2,0,0]=4 10597 B9R1.75 CCCC(=O)CC1CC1 Amb28285122 [0,1,0,1,0,0|2,0,0]=4 10598 B9R1.75 CCCC(C)CC1CO1 Amb25769573 [0,1,0,1,0,0|1,0,0]=3 10599 B9R1.75 CCCC(C)NC1CC1 Amb6249427 [0,1,0,1,0,0|2,0,0]=4 10600 B9R1.75 CCCN(C)C[C@@H]1CO1 Amb27656674 [0,1,0,1,0,0|2,0,0]=4 10601 B9R1.75 CCCN(C)C[C@H]1CO1 Amb27175073 [0,1,0,1,0,0|2,0,0]=4 10602 B9R1.75 CCCN(N)CC1CC1 Amb27806119 [0,1,0,1,0,0|2,0,0]=4 10603 B9R1.75 CCCS(=O)CC1CO1 Amb27838502 [0,1,0,1,0,0|2,0,0]=4 10604 B9R1.75 CCCS(=O)C[C@H]1CO1 Amb27872919 [0,1,0,1,0,0|2,0,0]=4 10605 B9R1.75 CCC[C@@H](N)CC1CC1 Amb27657336 [0,1,0,1,0,0|2,0,0]=4 10606 B9R1.75 CCOC(C)CC1CO1 Amb33225078 [0,1,0,1,0,0|2,0,0]=4 10607 B9R1.75 CN(CCF)CC1CC1 Amb27780427 [0,1,0,1,0,0|2,0,0]=4 10608 B9R1.75 CN(CCI)CC1CC1 Amb27790158 [0,1,0,1,0,0|2,0,0]=4 10609 B9R1.75 NC(CCO)CC1CC1 Amb24358108 [0,1,0,1,0,0|1,0,0]=3 10610 B9R1.75 NCCC(=O)CC1CC1 Amb25113049 [0,1,0,1,0,0|2,0,0]=4 10611 B9R1.75 NCCC(F)CC1CC1 Amb33361463 [0,1,0,1,0,0|2,0,0]=4 10612 B9R1.75 NCCS(=O)CC1CC1 Amb27627731 [0,1,0,1,0,0|1,1,0]=4 10613 B9R1.75 NCC[C@@H](O)CC1CC1 Amb33361465 [0,1,0,1,0,0|2,0,0]=4 10614 B9R1.75 NCC[C@H](O)CC1CC1 Amb33361464 [0,1,0,1,0,0|2,0,0]=4 10615 B9R1.75 O=C(CCO)NC1CC1 Amb17334105 [0,1,0,1,0,0|2,0,0]=4 10616 B9R1.75 OCCC(O)CC1CC1 Amb27664147 [0,1,0,1,0,0|1,0,0]=3 10617 B9R1.75 OCCC(O)CC1CO1 Amb28077959 [0,1,0,1,0,0|2,0,0]=4 10618 B9R1.75 OCCC(O)C[C@H]1CO1 Amb28049270 [0,1,0,1,0,0|2,0,0]=4 10619 B9R1.90 CCC1C(=O)NC1CO Amb27445041 [0,1,0,1,0,0|1,0,1]=4 10620 B9R1.90 CC[C@H]1C(=O)N[C@H]1CO Amb27222345 [0,1,0,1,0,0|1,0,1]=4 10621 B9R1.90 N[C@H]1C[C@@H](CO)[C@@H]1CO Amb28132661 [0,1,0,1,0,0|2,0,0]=4 10622 B9R1.90 O=C1CC(CO)C1CO Amb28200044 [0,1,0,1,0,0|2,0,0]=4 10623 B9R1.90 O=C1C[C@H](CO)[C@H]1CO Amb25328887 [0,1,0,1,0,0|2,0,0]=4 10624 B9R1.90 OC[C@H]1C[C@@H](O)[C@@H]1CO Amb28455078 [0,1,0,1,0,0|2,0,0]=4 10625 B9R1.100 CC(CCCBr)C1CC1 Amb33009154 [0,1,0,1,0,0|2,0,0]=4 10626 B9R1.100 CC(CCCN)C1CC1 Amb26594384 [0,1,0,1,0,0|2,0,0]=4 10627 B9R1.100 CC(CCCO)C1CC1 Amb26614838 [0,1,0,1,0,0|1,0,0]=3 10628 B9R1.100 CC(CCCS)C1CC1 Amb32735003 [0,1,0,1,0,0|1,1,0]=4 10629 B9R1.100 CC(CCNO)C1CC1 Amb32728853 [0,1,0,1,0,0|2,0,0]=4 10630 B9R1.100 CC(NCCO)C1CC1 Amb7809192 [0,1,0,1,0,0|1,0,0]=3 10631 B9R1.100 CCCCC(=O)[C@H]1CO1 Amb27470803 [0,1,0,1,0,0|1,0,0]=3 10632 B9R1.100 CCCCC(Br)C1CC1 Amb27826788 [0,1,0,1,0,0|2,0,0]=4 10633 B9R1.100 CCCCC(C)C1CC1 Amb25286937 [0,1,0,1,0,0|2,0,0]=4 10634 B9R1.100 CCCCC(Cl)C1CC1 Amb27837489 [0,1,0,1,0,0|2,0,0]=4 10635 B9R1.100 CCCCC(N)C1CC1 Amb3788101 [0,1,0,1,0,0|2,0,0]=4 10636 B9R1.100 CCCCC(O)C1CC1 Amb27837486 [0,1,0,1,0,0|2,0,0]=4 10637 B9R1.100 CCCCC(O)C1CO1 Amb28048180 [0,1,0,1,0,0|1,0,0]=3 10638 B9R1.100 CCCCN(N)C1CC1 Amb27838595 [0,1,0,1,0,0|2,0,0]=4 10639 B9R1.100 CCCC[C@@H](O)[C@@H]1CO1 Amb27186933 [0,1,0,1,0,0|1,0,0]=3 10640 B9R1.100 CCCC[C@@H](O)[C@H]1CO1 Amb27219813 [0,1,0,1,0,0|1,0,0]=3 10641 B9R1.100 CCCC[C@H](N)C1CC1 Amb28388893 [0,1,0,1,0,0|2,0,0]=4 10642 B9R1.100 CCCC[C@H](O)[C@H]1CO1 Amb27197461 [0,1,0,1,0,0|1,0,0]=3 10643 B9R1.100 CN(CCCO)C1CC1 Amb9370243 [0,1,0,1,0,0|2,0,0]=4 10644 B9R1.100 NCCCC(O)C1CC1 Amb18203226 [0,1,0,1,0,0|2,0,0]=4 10645 B9R1.100 NCCOC(=O)C1CC1 Amb25944220 [0,1,0,1,0,0|1,0,1]=4 10646 B9R1.100 NCCOC(=O)C1CC1 Amb28555398 [0,1,0,1,0,0|1,0,1]=4 10647 B9R1.100 O=C(NCCO)C1CC1 Amb6537762 [0,1,0,1,0,0|1,0,1]=4 10648 B9R1.100 O=C(OCCBr)C1CC1 Amb26848569 [0,1,0,1,0,0|1,0,1]=4 10649 B9R1.100 O=C(OCCO)C1CC1 Amb28256582 [0,1,0,1,0,0|0,0,1]=3 10650 B9R1.100 OC(CCCCl)C1CC1 Amb27481224 [0,1,0,1,0,0|2,0,0]=4 10651 B9R1.117 CC1(CCCO)COC1 Amb27397108 [0,1,0,1,0,0|2,0,0]=4 10652 B9R1.117 CC1(NCCO)CCC1 Amb28366137 [0,1,0,1,0,0|1,0,0]=3 10653 B9R1.117 CC1(OCCF)CNC1 Amb26555917 [0,1,0,1,0,0|2,0,0]=4 10654 B9R1.117 CC1(OCCN)CCC1 Amb24458133 [0,1,0,1,0,0|1,0,0]=3 10655 B9R1.117 CC1(OCCN)CCC1 Amb27491707 [0,1,0,1,0,0|1,0,0]=3 10656 B9R1.117 CC1(OCCN)COC1 Amb33318581 [0,1,0,1,0,0|2,0,0]=4 10657 B9R1.117 CCCCC1(C)CCN1 Amb27472398 [0,1,0,1,0,0|2,0,0]=4 10658 B9R1.117 CCCCC1(N)CCC1 Amb24420313 [0,1,0,1,0,0|2,0,0]=4 10659 B9R1.117 CCCCC1(O)CCC1 Amb28400142 [0,1,0,1,0,0|2,0,0]=4 10660 B9R1.117 CCCOC1(C)CNC1 Amb25889807 [0,1,0,1,0,0|2,0,0]=4 10661 B9R1.117 NC1(CCCO)CCC1 Amb30030884 [0,1,0,1,0,0|1,0,0]=3 10662 B9R1.117 NC1(CCCO)COC1 Amb22737299 [0,1,0,1,0,0|2,0,0]=4 10663 B9R1.117 NCCCC1(O)CCC1 Amb25199996 [0,1,0,1,0,0|2,0,0]=4 10664 B9R1.117 OCC#CC1(O)CCC1 Amb26927044 [0,1,0,1,0,0|1,0,1]=4 10665 B9R1.117 OCCCC1(F)CCC1 Amb25285193 [0,1,0,1,0,0|1,0,0]=3 10666 B9R1.117 OCCCC1(F)COC1 Amb27594648 [0,1,0,1,0,0|2,0,0]=4 10667 B9R1.117 OCCCC1(O)CCC1 Amb25032198 [0,1,0,1,0,0|1,0,0]=3 10668 B9R1.117 OCCCC1(O)CNC1 Amb27399887 [0,1,0,1,0,0|2,0,0]=4 10669 B9R1.134 CC1(CC#N)OCCO1 Amb1068377 [0,1,0,1,0,0|1,0,1]=4 10670 B9R1.134 CC1(CC=O)OCCO1 Amb18203200 [0,1,0,1,0,0|1,0,1]=4 10671 B9R1.134 CC1(CCBr)OCCO1 Amb17226719 [0,1,0,1,0,0|1,0,0]=3 10672 B9R1.134 CC1(CCCl)OCCO1 Amb27441787 [0,1,0,1,0,0|1,0,0]=3 10673 B9R1.134 CC1(CCI)OCCO1 Amb24520560 [0,1,0,1,0,0|1,0,0]=3 10674 B9R1.134 CC1(CCN)CCCC1 Amb18251115 [0,1,0,1,0,0|2,0,0]=4 10675 B9R1.134 CC1(CCN)OCCO1 Amb17101121 [0,1,0,1,0,0|1,0,0]=3 10676 B9R1.134 CC1(CCO)CCCC1 Amb27472477 [0,1,0,1,0,0|1,0,0]=3 10677 B9R1.134 CC1(CCO)CCCN1 Amb32946718 [0,1,0,1,0,0|2,0,0]=4 10678 B9R1.134 CC1(CCO)OCCO1 Amb17399825 [0,1,0,1,0,0|1,0,0]=3 10679 B9R1.134 CC1(CCS)OCCS1 Amb28061191 [0,1,0,1,0,0|1,1,0]=4 10680 B9R1.134 CCCC1(C)CCCN1 Amb27950524 [0,1,0,1,0,0|2,0,0]=4 10681 B9R1.134 CCCC1(C)NCCN1 Amb27390563 [0,1,0,1,0,0|2,0,0]=4 10682 B9R1.134 CCCC1(O)CCCC1 Amb4017707 [0,1,0,1,0,0|2,0,0]=4 10683 B9R1.134 CCC[N+]1(C)CCCC1 Amb28066652 [0,1,0,1,0,0|2,0,0]=4 10684 B9R1.134 CNCC1(C)CCCO1 Amb17506325 [0,1,0,1,0,0|2,0,0]=4 10685 B9R1.134 CNCC1(C)CCCO1 Amb35747073 [0,1,0,1,0,0|2,0,0]=4 10686 B9R1.134 CNC[C@@]1(C)CCCO1 Amb27468477 [0,1,0,1,0,0|2,0,0]=4 10687 B9R1.134 C[N+]1(CCO)CCCC1 Amb27650492 [0,1,0,1,0,0|1,0,0]=3 10688 B9R1.134 C[P+]1(CCO)CCCC1 Amb27853206 [0,1,0,1,0,0|1,0,0]=3 10689 B9R1.134 FC1(CCI)CCCC1 Amb27631766 [0,1,0,1,0,0|2,0,0]=4 10690 B9R1.134 NC1(CCF)CCCC1 Amb27266099 [0,1,0,1,0,0|2,0,0]=4 10691 B9R1.134 NC1(CCO)CCCC1 Amb27865768 [0,1,0,1,0,0|1,0,0]=3 10692 B9R1.134 NC1(CCO)CCOC1 Amb25349777 [0,1,0,1,0,0|2,0,0]=4 10693 B9R1.134 NC1(CCO)CCSC1 Amb26896245 [0,1,0,1,0,0|2,0,0]=4 10694 B9R1.134 NCCC1(N)CCCC1 Amb27949695 [0,1,0,1,0,0|2,0,0]=4 10695 B9R1.134 NCCC1(O)CCCC1 Amb32882428 [0,1,0,1,0,0|2,0,0]=4 10696 B9R1.134 NCCC1(O)CCCC1 Amb7088884 [0,1,0,1,0,0|2,0,0]=4 10697 B9R1.134 OC1(CCBr)CCCC1 Amb33097438 [0,1,0,1,0,0|2,0,0]=4 10698 B9R1.134 OC1(CCCl)CCCC1 Amb24385368 [0,1,0,1,0,0|2,0,0]=4 10699 B9R1.134 OCCC1(O)CCCC1 Amb21961004 [0,1,0,1,0,0|1,0,0]=3 10700 B9R1.154 CCCC1C(=O)CC1C Amb27838721 [0,1,0,1,0,0|2,0,0]=4 10701 B9R1.154 CCCN1C(C)CC1C Amb27651261 [0,1,0,1,0,0|2,0,0]=4 10702 B9R1.154 CCC[C@@H]1C(=O)C[C@H]1C Amb27261959 [0,1,0,1,0,0|2,0,0]=4 10703 B9R1.173 CC1CCC1(O)CCN Amb25728613 [0,1,0,1,0,0|2,0,0]=4 10704 B9R1.178 CC#CC1(C)OC1CO Amb26591572 [0,1,0,1,0,0|0,0,2]=4 10705 B9R1.178 CCCC1(C)OC1C#N Amb25125741 [0,1,0,1,0,0|1,0,1]=4 10706 B9R1.178 CCCC1(O)CC1CC Amb27664514 [0,1,0,1,0,0|2,0,0]=4 10707 B9R1.183 C=C(CCN)C1CC1C Amb33143866 [0,1,0,1,0,0|2,0,0]=4 10708 B9R1.183 CC(CCN)C1CC1C Amb26949800 [0,1,0,1,0,0|2,0,0]=4 10709 B9R1.183 CC1CC1C(=O)CCN Amb33145139 [0,1,0,1,0,0|2,0,0]=4 10710 B9R1.183 CC1CC1C(F)CCN Amb33144901 [0,1,0,1,0,0|2,0,0]=4 10711 B9R1.183 CC1CC1C(N)CCO Amb27862891 [0,1,0,1,0,0|1,0,0]=3 10712 B9R1.183 CC1CC1C(O)CCN Amb25147103 [0,1,0,1,0,0|2,0,0]=4 10713 B9R1.183 CC1CC1[C@@H](O)CCN Amb33144255 [0,1,0,1,0,0|2,0,0]=4 10714 B9R1.183 CC1CC1[C@H](O)CCN Amb33144256 [0,1,0,1,0,0|2,0,0]=4 10715 B9R1.183 CCCC(C)C1CC1N Amb25983395 [0,1,0,1,0,0|2,0,0]=4 10716 B9R1.183 CCCC(C)[C@@H]1C[C@H]1N Amb33322342 [0,1,0,1,0,0|2,0,0]=4 10717 B9R1.183 CCCC(O)C1CC1C Amb27494272 [0,1,0,1,0,0|2,0,0]=4 10718 B9R1.183 CCCC(O)[C@@H]1C[C@H]1C Amb27423183 [0,1,0,1,0,0|2,0,0]=4 10719 B9R1.183 CCC[C@@H](O)C1CC1C Amb27658419 [0,1,0,1,0,0|2,0,0]=4 10720 B9R1.191 CC1CC1(N)CCCS Amb27638527 [0,1,0,1,0,0|1,1,0]=4 10721 B9R1.191 CCCOC1(C)OC1C Amb24443329 [0,1,0,1,0,0|2,0,0]=4 10722 B9R1.4 C=CCC1CNC1CO Amb27212386 [0,1,0,1,0,0|1,0,1]=4 10723 B9R1.4 CCC1CCN1CCO Amb27973516 [0,1,0,1,0,0|1,0,0]=3 10724 B9R1.4 CCCC1CCC1CBr Amb33512086 [0,1,0,1,0,0|2,0,0]=4 10725 B9R1.4 CCCC1CCC1CN Amb27252657 [0,1,0,1,0,0|2,0,0]=4 10726 B9R1.4 CCCN1CCC1CN Amb33251947 [0,1,0,1,0,0|2,0,0]=4 10727 B9R1.4 CCC[C@H]1CN[C@@H]1CO Amb27194660 [0,1,0,1,0,0|1,0,0]=3 10728 B9R1.4 CCOC1CCC1CO Amb27456621 [0,1,0,1,0,0|1,0,0]=3 10729 B9R1.4 CC[C@@H]1CC[C@H]1CCO Amb27981762 [0,1,0,1,0,0|1,0,0]=3 10730 B9R1.4 CC[C@H]1CC[C@H]1CCO Amb27632068 [0,1,0,1,0,0|1,0,0]=3 10731 B9R1.4 COCC1CCC1CN Amb27424736 [0,1,0,1,0,0|2,0,0]=4 10732 B9R1.4 NCC1CCN1CCF Amb33251953 [0,1,0,1,0,0|2,0,0]=4 10733 B9R1.4 NCC1CCN1CCS Amb27441246 [0,1,0,1,0,0|1,1,0]=4 10734 B9R1.5 BrC1CCCCCC1Br Amb17669998 [0,1,0,1,0,0|2,0,0]=4 10735 B9R1.5 Br[C@@H]1CCCCC[C@H]1Br Amb25952818 [0,1,0,1,0,0|2,0,0]=4 10736 B9R1.5 Br[C@H]1CCCCC[C@H]1Br Amb24425642 [0,1,0,1,0,0|2,0,0]=4 10737 B9R1.5 C=C1CCCCCC1C Amb35681188 [0,1,0,1,0,0|2,0,0]=4 10738 B9R1.5 C=C1CCCCC[C@@H]1O Amb27456695 [0,1,0,1,0,0|1,0,1]=4 10739 B9R1.5 CC1=CCCCCC1O Amb27184844 [0,1,0,1,0,0|1,0,1]=4 10740 B9R1.5 CC1CCCCCC1=O Amb26348270 [0,1,0,1,0,0|1,0,1]=4 10741 B9R1.5 CC1CCCCCC1Br Amb18329569 [0,1,0,1,0,0|2,0,0]=4 10742 B9R1.5 CC1CCCCCC1Cl Amb27164800 [0,1,0,1,0,0|2,0,0]=4 10743 B9R1.5 CC1CCCCCC1N Amb33539533 [0,1,0,1,0,0|2,0,0]=4 10744 B9R1.5 CC1CCCCCC1O Amb27243169 [0,1,0,1,0,0|1,0,0]=3 10745 B9R1.5 CC1CCCCCC1S Amb32788094 [0,1,0,1,0,0|1,1,0]=4 10746 B9R1.5 CC1CCCNCC1C Amb22886370 [0,1,0,1,0,0|2,0,0]=4 10747 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,1,0,1,0,0|1,0,1]=4 10748 B9R1.5 CC1CCNCCC1O Amb22886251 [0,1,0,1,0,0|1,0,0]=3 10749 B9R1.5 CC1CCNCCC1O Amb27430480 [0,1,0,1,0,0|1,0,0]=3 10750 B9R1.5 CC1CCNCCN1C Amb17578107 [0,1,0,1,0,0|2,0,0]=4 10751 B9R1.5 CC1CCNCCS1=O Amb25948110 [0,1,0,1,0,0|1,0,1]=4 10752 B9R1.5 CC1CCNCCS1=O Amb28555359 [0,1,0,1,0,0|1,0,1]=4 10753 B9R1.5 CC1CNCCCC1O Amb22886276 [0,1,0,1,0,0|1,0,0]=3 10754 B9R1.5 CC1CNCCCC1O Amb25959907 [0,1,0,1,0,0|1,0,0]=3 10755 B9R1.5 CC1CNCCCN1C Amb17578105 [0,1,0,1,0,0|2,0,0]=4 10756 B9R1.5 CC1CNCCOC1C Amb32679918 [0,1,0,1,0,0|1,0,0]=3 10757 B9R1.5 CC1OCCNCC1F Amb32679921 [0,1,0,1,0,0|1,0,0]=3 10758 B9R1.5 C[C@@H]1CCCCC[C@@H]1N Amb28346949 [0,1,0,1,0,0|2,0,0]=4 10759 B9R1.5 C[C@@H]1CCCCC[C@H]1O Amb28248774 [0,1,0,1,0,0|1,0,0]=3 10760 B9R1.5 C[C@@H]1CNCCCN1C Amb27231500 [0,1,0,1,0,0|2,0,0]=4 10761 B9R1.5 C[C@H]1C=CCCC[C@@H]1O Amb27852529 [0,1,0,1,0,0|1,0,1]=4 10762 B9R1.5 C[C@H]1CCCCC[C@@H]1O Amb27844354 [0,1,0,1,0,0|1,0,0]=3 10763 B9R1.5 C[C@H]1CCCCC[C@H]1Br Amb28428934 [0,1,0,1,0,0|2,0,0]=4 10764 B9R1.5 C[C@H]1CCCCC[C@H]1N Amb28388330 [0,1,0,1,0,0|2,0,0]=4 10765 B9R1.5 C[C@H]1CCCCC[C@H]1O Amb28139666 [0,1,0,1,0,0|1,0,0]=3 10766 B9R1.5 ClC1CCCCCC1Cl Amb17669999 [0,1,0,1,0,0|2,0,0]=4 10767 B9R1.5 Cl[C@@H]1CCCCC[C@H]1Br Amb28287349 [0,1,0,1,0,0|2,0,0]=4 10768 B9R1.5 NC1CCCC=CC1O Amb27209173 [0,1,0,1,0,0|1,0,1]=4 10769 B9R1.5 NC1CCCCCC1Cl Amb27447248 [0,1,0,1,0,0|2,0,0]=4 10770 B9R1.5 NC1CCCCCC1F Amb27838500 [0,1,0,1,0,0|2,0,0]=4 10771 B9R1.5 NC1CCCCCC1F Amb35788792 [0,1,0,1,0,0|2,0,0]=4 10772 B9R1.5 NC1CCCCCC1N Amb18832604 [0,1,0,1,0,0|2,0,0]=4 10773 B9R1.5 NC1CCCCCC1N Amb32666380 [0,1,0,1,0,0|2,0,0]=4 10774 B9R1.5 NC1CCCCCC1O Amb8855257 [0,1,0,1,0,0|1,0,0]=3 10775 B9R1.5 NC1CCCNCC1O Amb28324783 [0,1,0,1,0,0|1,0,0]=3 10776 B9R1.5 NC1CNCCCC1O Amb25230992 [0,1,0,1,0,0|2,0,0]=4 10777 B9R1.5 NC1COCOCC1O Amb25888904 [0,1,0,1,0,0|1,0,0]=3 10778 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,1,0,1,0,0|1,0,0]=3 10779 B9R1.5 N[C@@H]1CCCCC[C@H]1Br Amb28057796 [0,1,0,1,0,0|2,0,0]=4 10780 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb24546493 [0,1,0,1,0,0|2,0,0]=4 10781 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb32656071 [0,1,0,1,0,0|2,0,0]=4 10782 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,1,0,1,0,0|1,0,0]=3 10783 B9R1.5 N[C@@H]1CCCCC[C@H]1S Amb27246750 [0,1,0,1,0,0|1,1,0]=4 10784 B9R1.5 N[C@@H]1COCOC[C@H]1O Amb27203219 [0,1,0,1,0,0|1,0,0]=3 10785 B9R1.5 N[C@@H]1CSCCC[C@H]1O Amb27231398 [0,1,0,1,0,0|1,1,0]=4 10786 B9R1.5 N[C@H]1CCCCC[C@@H]1N Amb25790654 [0,1,0,1,0,0|2,0,0]=4 10787 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [0,1,0,1,0,0|1,0,0]=3 10788 B9R1.5 N[C@H]1CCCCC[C@H]1N Amb24659857 [0,1,0,1,0,0|2,0,0]=4 10789 B9R1.5 N[C@H]1CCCCC[C@H]1N Amb30585192 [0,1,0,1,0,0|2,0,0]=4 10790 B9R1.5 N[C@H]1COCOC[C@@H]1N Amb27188411 [0,1,0,1,0,0|2,0,0]=4 10791 B9R1.5 O=C1CCCCCC1O Amb25284997 [0,1,0,1,0,0|1,0,1]=4 10792 B9R1.5 OC1CCCCC=C1Br Amb27604372 [0,1,0,1,0,0|1,0,1]=4 10793 B9R1.5 OC1CCCCC=C1Cl Amb28185035 [0,1,0,1,0,0|1,0,1]=4 10794 B9R1.5 OC1CCCCCC1Br Amb24480058 [0,1,0,1,0,0|1,0,0]=3 10795 B9R1.5 OC1CCCCCC1Cl Amb27974196 [0,1,0,1,0,0|1,0,0]=3 10796 B9R1.5 OC1CCCCCC1I Amb27640772 [0,1,0,1,0,0|1,0,0]=3 10797 B9R1.5 OC1CCCCCC1O Amb2196454 [0,1,0,1,0,0|1,0,0]=3 10798 B9R1.5 OC1CCNCCC1F Amb22886248 [0,1,0,1,0,0|2,0,0]=4 10799 B9R1.5 OC1CCOCCC1O Amb28249062 [0,1,0,1,0,0|1,0,0]=3 10800 B9R1.5 OC1CNCCCC1F Amb22886240 [0,1,0,1,0,0|1,0,0]=3 10801 B9R1.5 OC1CNCCCC1F Amb25932983 [0,1,0,1,0,0|1,0,0]=3 10802 B9R1.5 O[C@@H]1C=CCCC[C@H]1O Amb27184263 [0,1,0,1,0,0|1,0,1]=4 10803 B9R1.5 O[C@@H]1CC=CCC[C@H]1O Amb27873382 [0,1,0,1,0,0|1,0,1]=4 10804 B9R1.5 O[C@@H]1CCCCC[C@H]1F Amb27853128 [0,1,0,1,0,0|1,0,0]=3 10805 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [0,1,0,1,0,0|1,0,0]=3 10806 B9R1.5 O[C@@H]1CCNCC[C@H]1O Amb27796106 [0,1,0,1,0,0|2,0,0]=4 10807 B9R1.5 O[C@H]1C=CCCC[C@@H]1O Amb28428672 [0,1,0,1,0,0|1,0,1]=4 10808 B9R1.5 O[C@H]1CCCCC[C@@H]1Cl Amb27440550 [0,1,0,1,0,0|1,0,0]=3 10809 B9R1.5 O[C@H]1CCCCC[C@@H]1F Amb28344995 [0,1,0,1,0,0|1,0,0]=3 10810 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [0,1,0,1,0,0|1,0,0]=3 10811 B9R1.5 O[C@H]1CCCCC[C@H]1Br Amb28051852 [0,1,0,1,0,0|1,0,0]=3 10812 B9R1.5 O[C@H]1CCCCC[C@H]1Cl Amb27657604 [0,1,0,1,0,0|1,0,0]=3 10813 B9R1.5 O[C@H]1CCCNC[C@@H]1O Amb27231520 [0,1,0,1,0,0|1,0,0]=3 10814 B9R1.5 O[C@H]1CCCNC[C@H]1O Amb28059995 [0,1,0,1,0,0|1,0,0]=3 10815 B9R1.14 C=CC1OCCC1CN Amb25381398 [0,1,0,1,0,0|1,0,1]=4 10816 B9R1.14 C=C[C@@H]1CCC[C@H]1CO Amb28131037 [0,1,0,1,0,0|1,0,1]=4 10817 B9R1.14 C=C[C@@H]1CCO[C@H]1CO Amb27208120 [0,1,0,1,0,0|0,0,1]=3 10818 B9R1.14 C=C[C@@H]1OCC[C@H]1CN Amb24548005 [0,1,0,1,0,0|1,0,1]=4 10819 B9R1.14 CCC1=C(CO)CCC1 Amb27978212 [0,1,0,1,0,0|1,0,1]=4 10820 B9R1.14 CCC1CCC=C1CO Amb28049264 [0,1,0,1,0,0|1,0,1]=4 10821 B9R1.14 CCC1CCCC1CBr Amb27955021 [0,1,0,1,0,0|2,0,0]=4 10822 B9R1.14 CCC1CCCC1CC Amb27236275 [0,1,0,1,0,0|2,0,0]=4 10823 B9R1.14 CCC1CCCC1CN Amb25145993 [0,1,0,1,0,0|2,0,0]=4 10824 B9R1.14 CCC1CCCC1CN Amb32662607 [0,1,0,1,0,0|2,0,0]=4 10825 B9R1.14 CCC1CCCC1NC Amb18282856 [0,1,0,1,0,0|2,0,0]=4 10826 B9R1.14 CCC1CCNC1CC Amb3788100 [0,1,0,1,0,0|2,0,0]=4 10827 B9R1.14 CCC1CNCC1CC Amb22371139 [0,1,0,1,0,0|2,0,0]=4 10828 B9R1.14 CCC1CNCC1CN Amb26003960 [0,1,0,1,0,0|2,0,0]=4 10829 B9R1.14 CCC1CNCC1CO Amb27441323 [0,1,0,1,0,0|1,0,0]=3 10830 B9R1.14 CCC1CNCC1OC Amb27246480 [0,1,0,1,0,0|1,0,0]=3 10831 B9R1.14 CCC1COCC1C#N Amb35635838 [0,1,0,1,0,0|1,0,0]=3 10832 B9R1.14 CCC1COCC1C=O Amb29882927 [0,1,0,1,0,0|0,0,1]=3 10833 B9R1.14 CCC1COCC1CBr Amb35632077 [0,1,0,1,0,0|1,0,0]=3 10834 B9R1.14 CCC1COCC1CCl Amb35632076 [0,1,0,1,0,0|1,0,0]=3 10835 B9R1.14 CCC1COCC1CO Amb35651599 [0,1,0,1,0,0|0,0,0]=2 10836 B9R1.14 CCC1COCC1NC Amb35632267 [0,1,0,1,0,0|1,0,0]=3 10837 B9R1.14 CCC1COCC1NN Amb35616349 [0,1,0,1,0,0|1,0,0]=3 10838 B9R1.14 CCC1COCC1NO Amb35612699 [0,1,0,1,0,0|0,0,0]=2 10839 B9R1.14 CCC1COC\C1=N/N Amb35616343 [0,1,0,1,0,0|1,0,1]=4 10840 B9R1.14 CCC1COC\C1=N/O Amb29878963 [0,1,0,1,0,0|0,0,1]=3 10841 B9R1.14 CCC1CSCC1CN Amb28456030 [0,1,0,1,0,0|1,1,0]=4 10842 B9R1.14 CCC1NCCC1CN Amb18832605 [0,1,0,1,0,0|2,0,0]=4 10843 B9R1.14 CCC1NCCC1CO Amb26643148 [0,1,0,1,0,0|1,0,0]=3 10844 B9R1.14 CCC1OCCC1CBr Amb28387646 [0,1,0,1,0,0|1,0,0]=3 10845 B9R1.14 CCC1OCCC1CCl Amb27869227 [0,1,0,1,0,0|1,0,0]=3 10846 B9R1.14 CCC1OCCC1CO Amb27975537 [0,1,0,1,0,0|1,0,0]=3 10847 B9R1.14 CCN1CCCC1CBr Amb16186922 [0,1,0,1,0,0|2,0,0]=4 10848 B9R1.14 CCN1CCCC1CCl Amb19516950 [0,1,0,1,0,0|2,0,0]=4 10849 B9R1.14 CCN1CCCC1CCl Amb22587445 [0,1,0,1,0,0|2,0,0]=4 10850 B9R1.14 CCN1CCCC1CN Amb9702821 [0,1,0,1,0,0|2,0,0]=4 10851 B9R1.14 CCN1CCCC1CO Amb6537970 [0,1,0,1,0,0|1,0,0]=3 10852 B9R1.14 CCN1CCCC1CO Amb6537973 [0,1,0,1,0,0|1,0,0]=3 10853 B9R1.14 CCN1CCC[C@@H]1CBr Amb29886792 [0,1,0,1,0,0|2,0,0]=4 10854 B9R1.14 CCN1CCC[C@@H]1CCl Amb22757842 [0,1,0,1,0,0|2,0,0]=4 10855 B9R1.14 CCN1CCC[C@@H]1CN Amb23399734 [0,1,0,1,0,0|2,0,0]=4 10856 B9R1.14 CCN1CCC[C@@H]1CN Amb3939663 [0,1,0,1,0,0|2,0,0]=4 10857 B9R1.14 CCN1CCC[C@@H]1CO Amb24678478 [0,1,0,1,0,0|1,0,0]=3 10858 B9R1.14 CCN1CCC[C@H]1CBr Amb29886839 [0,1,0,1,0,0|2,0,0]=4 10859 B9R1.14 CCN1CCC[C@H]1CN Amb3939841 [0,1,0,1,0,0|2,0,0]=4 10860 B9R1.14 CCN1CCC[C@H]1CN Amb8631329 [0,1,0,1,0,0|2,0,0]=4 10861 B9R1.14 CCN1CCC[C@H]1CO Amb19517075 [0,1,0,1,0,0|1,0,0]=3 10862 B9R1.14 CC[C@@H]1CCC[C@H]1CC Amb22231650 [0,1,0,1,0,0|2,0,0]=4 10863 B9R1.14 CC[C@@H]1CNC[C@H]1CN Amb32672062 [0,1,0,1,0,0|2,0,0]=4 10864 B9R1.14 CC[C@@H]1NCC[C@@H]1CO Amb27800143 [0,1,0,1,0,0|1,0,0]=3 10865 B9R1.14 CC[C@H]1CNC[C@@H]1CO Amb33871489 [0,1,0,1,0,0|1,0,0]=3 10866 B9R1.14 CNC1CCCC1CN Amb24478693 [0,1,0,1,0,0|2,0,0]=4 10867 B9R1.14 CNC1CNCC1CO Amb27229840 [0,1,0,1,0,0|2,0,0]=4 10868 B9R1.14 CNC1CNCC1OC Amb24391983 [0,1,0,1,0,0|2,0,0]=4 10869 B9R1.14 CN[C@@H]1CCC[C@H]1OC Amb27944979 [0,1,0,1,0,0|2,0,0]=4 10870 B9R1.14 CN[C@@H]1CNC[C@@H]1OC Amb25912014 [0,1,0,1,0,0|2,0,0]=4 10871 B9R1.14 CN[C@@H]1CNC[C@H]1OC Amb22899611 [0,1,0,1,0,0|2,0,0]=4 10872 B9R1.14 CN[C@H]1CNC[C@@H]1OC Amb27658623 [0,1,0,1,0,0|2,0,0]=4 10873 B9R1.14 COC1C=COC1CO Amb27755993 [0,1,0,1,0,0|0,0,2]=4 10874 B9R1.14 COC1CCCC1CN Amb9286522 [0,1,0,1,0,0|2,0,0]=4 10875 B9R1.14 COC1CCCC1CO Amb27977996 [0,1,0,1,0,0|1,0,0]=3 10876 B9R1.14 COC1CCCC1ON Amb27750455 [0,1,0,1,0,0|2,0,0]=4 10877 B9R1.14 COC1CNCC1CN Amb27231548 [0,1,0,1,0,0|2,0,0]=4 10878 B9R1.14 COC1CNCC1CO Amb27440384 [0,1,0,1,0,0|2,0,0]=4 10879 B9R1.14 COC1CNCC1OC Amb26349860 [0,1,0,1,0,0|2,0,0]=4 10880 B9R1.14 COC1C[NH2+]CC1OC Amb28935000 [0,1,0,1,0,0|2,0,0]=4 10881 B9R1.14 CO[C@@H]1CCC[C@@H]1CO Amb27420276 [0,1,0,1,0,0|1,0,0]=3 10882 B9R1.14 CO[C@@H]1CNC[C@H]1OC Amb25302319 [0,1,0,1,0,0|2,0,0]=4 10883 B9R1.14 CO[C@@H]1CNC[C@H]1OC Amb30594232 [0,1,0,1,0,0|2,0,0]=4 10884 B9R1.14 CO[C@H]1CNC[C@@H]1OC Amb27188326 [0,1,0,1,0,0|2,0,0]=4 10885 B9R1.14 CO[C@H]1CNC[C@@H]1OC Amb33806370 [0,1,0,1,0,0|2,0,0]=4 10886 B9R1.14 CO[C@H]1CNC[C@H]1OC Amb22886348 [0,1,0,1,0,0|2,0,0]=4 10887 B9R1.14 CO[C@H]1CNC[C@H]1OC Amb24749498 [0,1,0,1,0,0|2,0,0]=4 10888 B9R1.14 CSC1CCCC1CN Amb18951039 [0,1,0,1,0,0|2,0,0]=4 10889 B9R1.14 ClCC1OCOC1CCl Amb28385694 [0,1,0,1,0,0|2,0,0]=4 10890 B9R1.14 ClC[C@H]1CCC[C@@H]1CCl Amb27252321 [0,1,0,1,0,0|2,0,0]=4 10891 B9R1.14 N#CC1CCCC1CO Amb27808797 [0,1,0,1,0,0|1,0,1]=4 10892 B9R1.14 NCC1CCCC1CF Amb20668101 [0,1,0,1,0,0|2,0,0]=4 10893 B9R1.14 NCC1CCCC1CF Amb33330465 [0,1,0,1,0,0|2,0,0]=4 10894 B9R1.14 NCC1CCCC1NO Amb27630274 [0,1,0,1,0,0|2,0,0]=4 10895 B9R1.14 OCC1CCCC1CF Amb27185976 [0,1,0,1,0,0|1,0,0]=3 10896 B9R1.14 OCC1CCCC1CO Amb27484587 [0,1,0,1,0,0|1,0,0]=3 10897 B9R1.14 OCC1CCNC1CO Amb24617756 [0,1,0,1,0,0|1,0,0]=3 10898 B9R1.14 OCC1CNCC1CO Amb27191993 [0,1,0,1,0,0|2,0,0]=4 10899 B9R1.14 OCC1CNCC1CO Amb32752685 [0,1,0,1,0,0|2,0,0]=4 10900 B9R1.14 OC[C@@H]1CCC[C@H]1CO Amb28053551 [0,1,0,1,0,0|1,0,0]=3 10901 B9R1.14 OC[C@@H]1CNC[C@@H]1CO Amb13883446 [0,1,0,1,0,0|2,0,0]=4 10902 B9R1.14 OC[C@@H]1CNC[C@@H]1CO Amb22230441 [0,1,0,1,0,0|2,0,0]=4 10903 B9R1.14 OC[C@@H]1CNC[C@H]1CO Amb17621969 [0,1,0,1,0,0|2,0,0]=4 10904 B9R1.14 OC[C@@H]1CNC[C@H]1CO Amb22757866 [0,1,0,1,0,0|2,0,0]=4 10905 B9R1.14 OC[C@H]1C=CC[C@@H]1CO Amb27206819 [0,1,0,1,0,0|1,0,1]=4 10906 B9R1.14 OC[C@H]1CCC[C@@H]1CO Amb27783101 [0,1,0,1,0,0|1,0,0]=3 10907 B9R1.14 OC[C@H]1CCC[C@H]1CCl Amb27196244 [0,1,0,1,0,0|1,0,0]=3 10908 B9R1.14 OC[C@H]1CCC[C@H]1CO Amb28187775 [0,1,0,1,0,0|1,0,0]=3 10909 B9R1.14 OC[C@H]1CCN[C@H]1CO Amb25180858 [0,1,0,1,0,0|1,0,0]=3 10910 B9R1.16 C#CCCCC1CC1O Amb27166599 [0,1,0,1,0,0|1,0,1]=4 10911 B9R1.16 C#CCCC[C@@H]1C[C@H]1O Amb25255526 [0,1,0,1,0,0|1,0,1]=4 10912 B9R1.16 C=CCCC[C@@H]1C[C@H]1O Amb26927916 [0,1,0,1,0,0|1,0,1]=4 10913 B9R1.16 CC1CC1CCCC=O Amb33143871 [0,1,0,1,0,0|1,0,1]=4 10914 B9R1.16 CC1CC1CCCCN Amb33143911 [0,1,0,1,0,0|2,0,0]=4 10915 B9R1.16 CC1CC1CNCCO Amb27948476 [0,1,0,1,0,0|1,0,0]=3 10916 B9R1.16 CC1CC1NCCCN Amb19022472 [0,1,0,1,0,0|2,0,0]=4 10917 B9R1.16 CC1CC1NCCCO Amb19022443 [0,1,0,1,0,0|1,0,0]=3 10918 B9R1.16 CC1CC1OCCCN Amb33144883 [0,1,0,1,0,0|1,0,0]=3 10919 B9R1.16 CCCCCC1CC1Br Amb27408601 [0,1,0,1,0,0|2,0,0]=4 10920 B9R1.16 CCCCCC1CC1Cl Amb27477799 [0,1,0,1,0,0|2,0,0]=4 10921 B9R1.16 CCCCCC1CC1N Amb27872129 [0,1,0,1,0,0|2,0,0]=4 10922 B9R1.16 CCCCCC1OC1C Amb25888870 [0,1,0,1,0,0|1,0,0]=3 10923 B9R1.16 CCCCC[C@@H]1C[C@H]1F Amb27849384 [0,1,0,1,0,0|2,0,0]=4 10924 B9R1.16 CCCCC[C@H]1C[C@H]1O Amb28292777 [0,1,0,1,0,0|1,0,0]=3 10925 B9R1.16 CCCCNC1CC1C Amb19022375 [0,1,0,1,0,0|2,0,0]=4 10926 B9R1.16 CCCCO[C@@H]1C[C@@H]1Cl Amb27243377 [0,1,0,1,0,0|1,0,0]=3 10927 B9R1.16 CCCCO[C@@H]1C[C@H]1N Amb25366599 [0,1,0,1,0,0|1,0,0]=3 10928 B9R1.16 CCCCO[C@H]1C[C@H]1Cl Amb28384496 [0,1,0,1,0,0|1,0,0]=3 10929 B9R1.16 CCCC\C=C1/CC1Br Amb27232659 [0,1,0,1,0,0|2,0,0]=4 10930 B9R1.16 CCCNCC1CC1C Amb8853760 [0,1,0,1,0,0|2,0,0]=4 10931 B9R1.16 CNCCNC1CC1C Amb19022475 [0,1,0,1,0,0|2,0,0]=4 10932 B9R1.16 COCCNC1CC1C Amb19022449 [0,1,0,1,0,0|1,0,0]=3 10933 B9R1.16 COCCO[C@@H]1C[C@H]1N Amb33347105 [0,1,0,1,0,0|1,0,0]=3 10934 B9R1.16 CSCCNC1CC1C Amb27246063 [0,1,0,1,0,0|1,1,0]=4 10935 B9R1.17 BrCCCCN1CCC1 Amb27870431 [0,1,0,1,0,0|2,0,0]=4 10936 B9R1.17 BrCCCOC1CCC1 Amb18321012 [0,1,0,1,0,0|1,0,0]=3 10937 B9R1.17 BrCCOCC1CCC1 Amb28121364 [0,1,0,1,0,0|1,0,0]=3 10938 B9R1.17 C#CCCNC1CCC1 Amb26024525 [0,1,0,1,0,0|2,0,0]=4 10939 B9R1.17 C#CCCOC1CNC1 Amb24618212 [0,1,0,1,0,0|2,0,0]=4 10940 B9R1.17 C#CCONC1CCC1 Amb28187862 [0,1,0,1,0,0|1,0,1]=4 10941 B9R1.17 C=CCCOC1CNC1 Amb24626068 [0,1,0,1,0,0|2,0,0]=4 10942 B9R1.17 C=CCOCC1CCN1 Amb27463492 [0,1,0,1,0,0|1,0,1]=4 10943 B9R1.17 CCCCCC1CCN1 Amb28387630 [0,1,0,1,0,0|2,0,0]=4 10944 B9R1.17 CCCCCC1CNC1 Amb27599832 [0,1,0,1,0,0|2,0,0]=4 10945 B9R1.17 CCCCCC1CNC1 Amb33141041 [0,1,0,1,0,0|2,0,0]=4 10946 B9R1.17 CCCCOC1CNC1 Amb19031045 [0,1,0,1,0,0|1,0,0]=3 10947 B9R1.17 CCCNCC1CNC1 Amb27265692 [0,1,0,1,0,0|2,0,0]=4 10948 B9R1.17 CCCONC1COC1 Amb27793965 [0,1,0,1,0,0|2,0,0]=4 10949 B9R1.17 CCCSCC1CCC1 Amb28134469 [0,1,0,1,0,0|1,1,0]=4 10950 B9R1.17 CCOCOC1CNC1 Amb25889620 [0,1,0,1,0,0|2,0,0]=4 10951 B9R1.17 CNCCCC1COC1 Amb27612966 [0,1,0,1,0,0|2,0,0]=4 10952 B9R1.17 CNCCNC1CCC1 Amb19022298 [0,1,0,1,0,0|2,0,0]=4 10953 B9R1.17 CNCCOC1CCC1 Amb19024861 [0,1,0,1,0,0|1,0,0]=3 10954 B9R1.17 CNCCSC1CCC1 Amb27669181 [0,1,0,1,0,0|1,1,0]=4 10955 B9R1.17 CNCCSC1COC1 Amb27443701 [0,1,0,1,0,0|1,1,0]=4 10956 B9R1.17 COCCCC1CNC1 Amb26562458 [0,1,0,1,0,0|2,0,0]=4 10957 B9R1.17 COCCNC1CCC1 Amb23597827 [0,1,0,1,0,0|1,0,0]=3 10958 B9R1.17 COCCOC1CNC1 Amb19031040 [0,1,0,1,0,0|1,0,0]=3 10959 B9R1.17 COCCOC1CNC1 Amb33551250 [0,1,0,1,0,0|1,0,0]=3 10960 B9R1.17 COCCSC1CNC1 Amb28241396 [0,1,0,1,0,0|1,1,0]=4 10961 B9R1.17 CONCCC1CCC1 Amb27969309 [0,1,0,1,0,0|2,0,0]=4 10962 B9R1.17 CSCCOC1CNC1 Amb25862448 [0,1,0,1,0,0|1,1,0]=4 10963 B9R1.17 ClCCCCN1CCC1 Amb27790623 [0,1,0,1,0,0|2,0,0]=4 10964 B9R1.17 FCCCCN1CCC1 Amb28381307 [0,1,0,1,0,0|2,0,0]=4 10965 B9R1.17 FCCCOC1CNC1 Amb27838483 [0,1,0,1,0,0|2,0,0]=4 10966 B9R1.17 FCCNCC1CCC1 Amb27433714 [0,1,0,1,0,0|2,0,0]=4 10967 B9R1.17 ICCNCC1CCC1 Amb28047556 [0,1,0,1,0,0|2,0,0]=4 10968 B9R1.17 N#CCCCC1CCC1 Amb35656784 [0,1,0,1,0,0|2,0,0]=4 10969 B9R1.17 N#CCCOC1CCC1 Amb27837521 [0,1,0,1,0,0|1,0,0]=3 10970 B9R1.17 NCCCCC1CCC1 Amb25888956 [0,1,0,1,0,0|2,0,0]=4 10971 B9R1.17 NCCCCC1CSC1 Amb27463448 [0,1,0,1,0,0|2,0,0]=4 10972 B9R1.17 NCCCCN1CCC1 Amb27838494 [0,1,0,1,0,0|2,0,0]=4 10973 B9R1.17 NCCCNC1CCC1 Amb19021296 [0,1,0,1,0,0|2,0,0]=4 10974 B9R1.17 NCCCOC1CCC1 Amb26878582 [0,1,0,1,0,0|1,0,0]=3 10975 B9R1.17 NCCNCC1CCC1 Amb26617200 [0,1,0,1,0,0|2,0,0]=4 10976 B9R1.17 NCCOCC1CCC1 Amb32664098 [0,1,0,1,0,0|1,0,0]=3 10977 B9R1.17 NCCOCC1CCC1 Amb33548531 [0,1,0,1,0,0|1,0,0]=3 10978 B9R1.17 NCCOCC1CSC1 Amb27633364 [0,1,0,1,0,0|1,0,0]=3 10979 B9R1.17 NNCCCC1CCC1 Amb27779786 [0,1,0,1,0,0|2,0,0]=4 10980 B9R1.17 NOCCOC1CCC1 Amb27421034 [0,1,0,1,0,0|0,0,0]=2 10981 B9R1.17 NOCCSC1COC1 Amb27861854 [0,1,0,1,0,0|1,1,0]=4 10982 B9R1.17 O=CCCCC1CCC1 Amb33197139 [0,1,0,1,0,0|1,0,1]=4 10983 B9R1.17 OCC#CCN1CCC1 Amb26470813 [0,1,0,1,0,0|1,0,1]=4 10984 B9R1.17 OCCCCC1CCC1 Amb32945992 [0,1,0,1,0,0|1,0,0]=3 10985 B9R1.17 OCCCCC1CCN1 Amb27186139 [0,1,0,1,0,0|1,0,0]=3 10986 B9R1.17 OCCCCC1CCO1 Amb27486325 [0,1,0,1,0,0|1,0,0]=3 10987 B9R1.17 OCCCCC1CNC1 Amb27186138 [0,1,0,1,0,0|1,0,0]=3 10988 B9R1.17 OCCCCC1COC1 Amb25187833 [0,1,0,1,0,0|1,0,0]=3 10989 B9R1.17 OCCCC[C@H]1CCO1 Amb27807122 [0,1,0,1,0,0|1,0,0]=3 10990 B9R1.17 OCCCNC1CCC1 Amb22229279 [0,1,0,1,0,0|1,0,0]=3 10991 B9R1.17 OCCCNC1COC1 Amb25265104 [0,1,0,1,0,0|2,0,0]=4 10992 B9R1.17 OCCCOC1CCC1 Amb27948159 [0,1,0,1,0,0|0,0,0]=2 10993 B9R1.17 OCCCOC1CNC1 Amb26934686 [0,1,0,1,0,0|1,0,0]=3 10994 B9R1.17 OCCCOC1COC1 Amb25889519 [0,1,0,1,0,0|1,0,0]=3 10995 B9R1.17 OCCCSC1COC1 Amb27982347 [0,1,0,1,0,0|1,1,0]=4 10996 B9R1.17 OCCNCC1CCC1 Amb8929462 [0,1,0,1,0,0|1,0,0]=3 10997 B9R1.17 OCCNCC1CNC1 Amb28049964 [0,1,0,1,0,0|1,0,0]=3 10998 B9R1.17 OCCNCC1COC1 Amb27623515 [0,1,0,1,0,0|1,0,0]=3 10999 B9R1.17 OCCOCC1CCC1 Amb27246167 [0,1,0,1,0,0|0,0,0]=2 11000 B9R1.17 OCCON=C1CCC1 Amb27455920 [0,1,0,1,0,0|0,0,1]=3 11001 B9R1.17 SCCCOC1COC1 Amb27166185 [0,1,0,1,0,0|1,0,0]=3 11002 B9R1.17 SCCNCC1CCN1 Amb27843718 [0,1,0,1,0,0|1,1,0]=4 11003 B9R1.17 SCCNCC1CNC1 Amb27792856 [0,1,0,1,0,0|1,1,0]=4 11004 B9R1.39 C#CCCC1CCC1O Amb32945257 [0,1,0,1,0,0|1,0,1]=4 11005 B9R1.39 C=CCCC1CCC1O Amb28346351 [0,1,0,1,0,0|1,0,1]=4 11006 B9R1.39 CC#CCC1CCC1O Amb32950451 [0,1,0,1,0,0|1,0,1]=4 11007 B9R1.39 CCCCC1CCC1N Amb27193785 [0,1,0,1,0,0|2,0,0]=4 11008 B9R1.39 CCCCC1CCC1O Amb32950020 [0,1,0,1,0,0|1,0,0]=3 11009 B9R1.39 CCCNC1CCC1C Amb28188610 [0,1,0,1,0,0|2,0,0]=4 11010 B9R1.39 CCCO[C@@H]1CC[C@@H]1N Amb33495617 [0,1,0,1,0,0|1,0,0]=3 11011 B9R1.39 CCCO[C@@H]1CC[C@H]1O Amb33495605 [0,1,0,1,0,0|1,0,0]=3 11012 B9R1.39 CCNCC1CCC1C Amb23512036 [0,1,0,1,0,0|2,0,0]=4 11013 B9R1.39 CCOCC1CCC1O Amb33213410 [0,1,0,1,0,0|1,0,0]=3 11014 B9R1.39 CN1CCC1CCCN Amb27670158 [0,1,0,1,0,0|2,0,0]=4 11015 B9R1.39 NCCCC1CCC1O Amb25784142 [0,1,0,1,0,0|1,0,0]=3 11016 B9R1.39 OCCCC1CCC1O Amb28138520 [0,1,0,1,0,0|1,0,0]=3 11017 B9R1.83 BrCCCCCC1CC1 Amb32992758 [0,1,0,1,0,0|2,0,0]=4 11018 B9R1.83 BrCCCNCC1CC1 Amb27971427 [0,1,0,1,0,0|2,0,0]=4 11019 B9R1.83 BrCCCOCC1CC1 Amb9209737 [0,1,0,1,0,0|1,0,0]=3 11020 B9R1.83 C=CCCCCC1CO1 Amb8515843 [0,1,0,1,0,0|1,0,1]=4 11021 B9R1.83 C=CCCNCC1CC1 Amb27833864 [0,1,0,1,0,0|2,0,0]=4 11022 B9R1.83 C=CCCSCC1CC1 Amb27956578 [0,1,0,1,0,0|1,1,0]=4 11023 B9R1.83 C=CCONCC1CC1 Amb28324550 [0,1,0,1,0,0|1,0,1]=4 11024 B9R1.83 CCCCCCC1=CC1 Amb27793496 [0,1,0,1,0,0|2,0,0]=4 11025 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|1,0,0]=3 11026 B9R1.83 CCCCCCC1CS1 Amb27873363 [0,1,0,1,0,0|1,1,0]=4 11027 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|1,0,0]=3 11028 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|1,0,0]=3 11029 B9R1.83 CCCCCC[C@H]1CS1 Amb22367053 [0,1,0,1,0,0|1,1,0]=4 11030 B9R1.83 CCCCCNC1CC1 Amb6248403 [0,1,0,1,0,0|2,0,0]=4 11031 B9R1.83 CCCCNCC1CC1 Amb6686876 [0,1,0,1,0,0|2,0,0]=4 11032 B9R1.83 CCCCNCC1CO1 Amb27950731 [0,1,0,1,0,0|1,0,0]=3 11033 B9R1.83 CCCCOCC1CO1 Amb534220 [0,1,0,1,0,0|0,0,0]=2 11034 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|0,0,0]=2 11035 B9R1.83 CCCCOC[C@H]1CO1 Amb26926784 [0,1,0,1,0,0|0,0,0]=2 11036 B9R1.83 CCCCSC[C@H]1CO1 Amb27753323 [0,1,0,1,0,0|0,1,0]=3 11037 B9R1.83 CCCNCCC1CC1 Amb25921074 [0,1,0,1,0,0|2,0,0]=4 11038 B9R1.83 CCCSCCC1CC1 Amb28349579 [0,1,0,1,0,0|1,1,0]=4 11039 B9R1.83 CCCSCCC1CO1 Amb27256622 [0,1,0,1,0,0|1,0,0]=3 11040 B9R1.83 CCC\C=C\CC1CO1 Amb33424832 [0,1,0,1,0,0|1,0,1]=4 11041 B9R1.83 CCNCCCC1CC1 Amb25147174 [0,1,0,1,0,0|2,0,0]=4 11042 B9R1.83 CNCCOCC1CC1 Amb20622213 [0,1,0,1,0,0|1,0,0]=3 11043 B9R1.83 COCCCNC1CC1 Amb17231857 [0,1,0,1,0,0|2,0,0]=4 11044 B9R1.83 COCCNCC1CC1 Amb6707453 [0,1,0,1,0,0|1,0,0]=3 11045 B9R1.83 COCCOCC1CO1 Amb6243026 [0,1,0,1,0,0|1,0,0]=3 11046 B9R1.83 COCC\C=C\C1CC1 Amb22365293 [0,1,0,1,0,0|1,0,1]=4 11047 B9R1.83 CONCCCC1CC1 Amb28194130 [0,1,0,1,0,0|2,0,0]=4 11048 B9R1.83 ClCCCOCC1CC1 Amb6681169 [0,1,0,1,0,0|1,0,0]=3 11049 B9R1.83 ClCCCOCC1CO1 Amb27254191 [0,1,0,1,0,0|1,0,0]=3 11050 B9R1.83 ClCCCSCC1CC1 Amb27826511 [0,1,0,1,0,0|1,1,0]=4 11051 B9R1.83 ClCCOCCC1CC1 Amb27240396 [0,1,0,1,0,0|1,0,0]=3 11052 B9R1.83 ClCC\C=C\CC1CC1 Amb27606139 [0,1,0,1,0,0|2,0,0]=4 11053 B9R1.83 FCCCCNC1CC1 Amb27641511 [0,1,0,1,0,0|2,0,0]=4 11054 B9R1.83 FCCCNCC1CC1 Amb27838486 [0,1,0,1,0,0|2,0,0]=4 11055 B9R1.83 ICCCNCC1CC1 Amb27242288 [0,1,0,1,0,0|2,0,0]=4 11056 B9R1.83 ICCNCCC1CC1 Amb27451222 [0,1,0,1,0,0|2,0,0]=4 11057 B9R1.83 N#CCCNCC1CC1 Amb8829023 [0,1,0,1,0,0|2,0,0]=4 11058 B9R1.83 N#CCCOCC1CC1 Amb6681190 [0,1,0,1,0,0|1,0,0]=3 11059 B9R1.83 NCCCCCC1CC1 Amb18832667 [0,1,0,1,0,0|2,0,0]=4 11060 B9R1.83 NCCCCCN1CC1 Amb24078338 [0,1,0,1,0,0|2,0,0]=4 11061 B9R1.83 NCCCCNC1CC1 Amb17334101 [0,1,0,1,0,0|2,0,0]=4 11062 B9R1.83 NCCCCSC1CC1 Amb27259066 [0,1,0,1,0,0|1,1,0]=4 11063 B9R1.83 NCCCNCC1CC1 Amb27465877 [0,1,0,1,0,0|2,0,0]=4 11064 B9R1.83 NCCCOCC1CC1 Amb1216862 [0,1,0,1,0,0|1,0,0]=3 11065 B9R1.83 NCCCSCC1CC1 Amb28422208 [0,1,0,1,0,0|1,1,0]=4 11066 B9R1.83 NCCNCCC1CC1 Amb23513067 [0,1,0,1,0,0|2,0,0]=4 11067 B9R1.83 NCCOCCC1CC1 Amb25841330 [0,1,0,1,0,0|1,0,0]=3 11068 B9R1.83 NCCOCCC1CC1 Amb35788577 [0,1,0,1,0,0|1,0,0]=3 11069 B9R1.83 O=CCCCCC1CC1 Amb33361884 [0,1,0,1,0,0|1,0,1]=4 11070 B9R1.83 O=CCCOCC1CC1 Amb26982387 [0,1,0,1,0,0|0,0,1]=3 11071 B9R1.83 O=CCOCCC1CC1 Amb28049211 [0,1,0,1,0,0|0,0,2]=4 11072 B9R1.83 OCCCC#CC1CC1 Amb32950253 [0,1,0,1,0,0|1,0,1]=4 11073 B9R1.83 OCCCCC=C1CC1 Amb25889566 [0,1,0,1,0,0|1,0,1]=4 11074 B9R1.83 OCCCCCC1CO1 Amb28189365 [0,1,0,1,0,0|1,0,0]=3 11075 B9R1.83 OCCCCNC1CC1 Amb17334108 [0,1,0,1,0,0|1,0,0]=3 11076 B9R1.83 OCCCNCC1CC1 Amb9423145 [0,1,0,1,0,0|1,0,0]=3 11077 B9R1.83 OCCCOCC1CC1 Amb27622883 [0,1,0,1,0,0|0,0,0]=2 11078 B9R1.83 OCCCSCC1CC1 Amb24478768 [0,1,0,1,0,0|0,1,0]=3 11079 B9R1.83 OCCOCCC1CC1 Amb28049210 [0,1,0,1,0,0|0,0,0]=2 11080 B9R1.83 SCCCOCC1CC1 Amb27761385 [0,1,0,1,0,0|0,1,0]=3 11081 B9R1.89 BrCC1C=CCCCC1 Amb33329273 [0,1,0,1,0,0|2,0,0]=4 11082 B9R1.89 BrCC1CCCCCC1 Amb19073228 [0,1,0,1,0,0|2,0,0]=4 11083 B9R1.89 BrCC1CCCCNC1 Amb29854399 [0,1,0,1,0,0|2,0,0]=4 11084 B9R1.89 BrCC1CCCSCC1 Amb30031350 [0,1,0,1,0,0|1,1,0]=4 11085 B9R1.89 BrCC1COCCCO1 Amb28400157 [0,1,0,1,0,0|1,0,0]=3 11086 B9R1.89 BrCC1COCCOC1 Amb24383404 [0,1,0,1,0,0|1,0,0]=3 11087 B9R1.89 BrCC1OCCCCO1 Amb534476 [0,1,0,1,0,0|1,0,0]=3 11088 B9R1.89 C#CC1CCCCCC1 Amb25277452 [0,1,0,1,0,0|2,0,0]=4 11089 B9R1.89 C#CC1CCCCNC1 Amb32675141 [0,1,0,1,0,0|2,0,0]=4 11090 B9R1.89 C#CC1CCCCNC1 Amb32676736 [0,1,0,1,0,0|2,0,0]=4 11091 B9R1.89 C=CC1CCCCCC1 Amb25068667 [0,1,0,1,0,0|2,0,0]=4 11092 B9R1.89 CCC1CCCCCC1 Amb26390826 [0,1,0,1,0,0|2,0,0]=4 11093 B9R1.89 CCC1CCCCCN1 Amb3788103 [0,1,0,1,0,0|2,0,0]=4 11094 B9R1.89 CCC1CCCNCC1 Amb9316856 [0,1,0,1,0,0|2,0,0]=4 11095 B9R1.89 CCC1CCNCCO1 Amb25367816 [0,1,0,1,0,0|1,0,0]=3 11096 B9R1.89 CCC1CCNCCO1 Amb33482722 [0,1,0,1,0,0|1,0,0]=3 11097 B9R1.89 CCC1CCOCCN1 Amb26348068 [0,1,0,1,0,0|1,0,0]=3 11098 B9R1.89 CCC1CCOCCN1 Amb33482721 [0,1,0,1,0,0|1,0,0]=3 11099 B9R1.89 CCC1CNCCCN1 Amb27194045 [0,1,0,1,0,0|2,0,0]=4 11100 B9R1.89 CCC1CNCCCO1 Amb9358448 [0,1,0,1,0,0|1,0,0]=3 11101 B9R1.89 CCC1CNCCOC1 Amb28400754 [0,1,0,1,0,0|1,0,0]=3 11102 B9R1.89 CCC1COCCCN1 Amb18106727 [0,1,0,1,0,0|1,0,0]=3 11103 B9R1.89 CCN1CCCCCC1 Amb16231374 [0,1,0,1,0,0|2,0,0]=4 11104 B9R1.89 CCN1CCCNCC1 Amb1139329 [0,1,0,1,0,0|2,0,0]=4 11105 B9R1.89 CCN1CCCNCC1 Amb22586917 [0,1,0,1,0,0|2,0,0]=4 11106 B9R1.89 CC[C@@H]1CCCCCN1 Amb28136573 [0,1,0,1,0,0|2,0,0]=4 11107 B9R1.89 CC[C@H]1CCCCCN1 Amb27459025 [0,1,0,1,0,0|2,0,0]=4 11108 B9R1.89 CC[C@H]1CNCCCN1 Amb33620812 [0,1,0,1,0,0|2,0,0]=4 11109 B9R1.89 CNC1CCCCCC1 Amb1106215 [0,1,0,1,0,0|2,0,0]=4 11110 B9R1.89 CNC1CCCCCC1 Amb22587117 [0,1,0,1,0,0|2,0,0]=4 11111 B9R1.89 CNC1CCCCNC1 Amb10576552 [0,1,0,1,0,0|2,0,0]=4 11112 B9R1.89 CNC1CCCNCC1 Amb22059341 [0,1,0,1,0,0|2,0,0]=4 11113 B9R1.89 CNC1CCCSCC1 Amb35692797 [0,1,0,1,0,0|1,1,0]=4 11114 B9R1.89 CN[C@@H]1CCCCNC1 Amb27630678 [0,1,0,1,0,0|2,0,0]=4 11115 B9R1.89 COC1=NCCOCC1 Amb32666999 [0,1,0,1,0,0|1,0,1]=4 11116 B9R1.89 COC1CCCCCN1 Amb33128038 [0,1,0,1,0,0|2,0,0]=4 11117 B9R1.89 COC1CCCNCC1 Amb22405875 [0,1,0,1,0,0|2,0,0]=4 11118 B9R1.89 COC1CCCNCC1 Amb22405876 [0,1,0,1,0,0|2,0,0]=4 11119 B9R1.89 CSC1CCCCNC1 Amb20668460 [0,1,0,1,0,0|1,1,0]=4 11120 B9R1.89 CSC1CCCNCC1 Amb24457994 [0,1,0,1,0,0|2,0,0]=4 11121 B9R1.89 ClCC1CCCCCC1 Amb26317790 [0,1,0,1,0,0|2,0,0]=4 11122 B9R1.89 ClCC1CCCCCN1 Amb26567233 [0,1,0,1,0,0|2,0,0]=4 11123 B9R1.89 ClCC1CCCCCN1 Amb32665018 [0,1,0,1,0,0|2,0,0]=4 11124 B9R1.89 ClCC1CCCCNC1 Amb29854216 [0,1,0,1,0,0|2,0,0]=4 11125 B9R1.89 ClCC1CCCSCC1 Amb30031349 [0,1,0,1,0,0|1,1,0]=4 11126 B9R1.89 ClCC1CSCCCS1 Amb27760500 [0,1,0,1,0,0|1,1,0]=4 11127 B9R1.89 ClCC1SCCCCS1 Amb22265160 [0,1,0,1,0,0|1,1,0]=4 11128 B9R1.89 FCC1CCCCCN1 Amb28129640 [0,1,0,1,0,0|2,0,0]=4 11129 B9R1.89 FCC1CCCCNC1 Amb29849262 [0,1,0,1,0,0|2,0,0]=4 11130 B9R1.89 FCC1CCOCCN1 Amb27186261 [0,1,0,1,0,0|1,0,0]=3 11131 B9R1.89 FCC1CNCCCO1 Amb26864262 [0,1,0,1,0,0|1,0,0]=3 11132 B9R1.89 FCC1CNCCCO1 Amb28920737 [0,1,0,1,0,0|1,0,0]=3 11133 B9R1.89 ICC1CCCCCC1 Amb27596090 [0,1,0,1,0,0|2,0,0]=4 11134 B9R1.89 ICC1CCCCCO1 Amb22489614 [0,1,0,1,0,0|1,0,0]=3 11135 B9R1.89 N#CC1CCCCCC1 Amb2721571 [0,1,0,1,0,0|2,0,0]=4 11136 B9R1.89 N#CC1CCCOCC1 Amb27857643 [0,1,0,1,0,0|1,0,1]=4 11137 B9R1.89 N#CC1COCCCN1 Amb28198913 [0,1,0,1,0,0|2,0,0]=4 11138 B9R1.89 N#CC1COCCOC1 Amb27967791 [0,1,0,1,0,0|1,0,1]=4 11139 B9R1.89 NCC1C=CCCCC1 Amb28184480 [0,1,0,1,0,0|2,0,0]=4 11140 B9R1.89 NCC1C=CCCCC1 Amb33744094 [0,1,0,1,0,0|2,0,0]=4 11141 B9R1.89 NCC1CCCCCC1 Amb22001955 [0,1,0,1,0,0|2,0,0]=4 11142 B9R1.89 NCC1CCCCCC1 Amb8943673 [0,1,0,1,0,0|2,0,0]=4 11143 B9R1.89 NCC1CCCCCN1 Amb26045142 [0,1,0,1,0,0|2,0,0]=4 11144 B9R1.89 NCC1CCCCNC1 Amb28314020 [0,1,0,1,0,0|2,0,0]=4 11145 B9R1.89 NCC1CCCCNC1 Amb32653390 [0,1,0,1,0,0|2,0,0]=4 11146 B9R1.89 NCC1CCCOCC1 Amb18203218 [0,1,0,1,0,0|1,0,0]=3 11147 B9R1.89 NCC1CCCSCC1 Amb18198731 [0,1,0,1,0,0|1,1,0]=4 11148 B9R1.89 NCC1CCCSCC1 Amb31156302 [0,1,0,1,0,0|1,1,0]=4 11149 B9R1.89 NCC1CNCCCN1 Amb27186429 [0,1,0,1,0,0|2,0,0]=4 11150 B9R1.89 NCC1COCCCN1 Amb27768797 [0,1,0,1,0,0|2,0,0]=4 11151 B9R1.89 NNC1CCCCCC1 Amb19373178 [0,1,0,1,0,0|2,0,0]=4 11152 B9R1.89 NNC1CCCCCC1 Amb22227928 [0,1,0,1,0,0|2,0,0]=4 11153 B9R1.89 NNC1CCCCCC1 Amb6251286 [0,1,0,1,0,0|2,0,0]=4 11154 B9R1.89 NNC1CCCOCC1 Amb24707598 [0,1,0,1,0,0|2,0,0]=4 11155 B9R1.89 O=CC1CCCCCC1 Amb9786985 [0,1,0,1,0,0|1,0,1]=4 11156 B9R1.89 O=CC1CCCOCC1 Amb18832626 [0,1,0,1,0,0|1,0,1]=4 11157 B9R1.89 OCC1=CCCCCC1 Amb27424682 [0,1,0,1,0,0|1,0,1]=4 11158 B9R1.89 OCC1=NCCCCN1 Amb27866719 [0,1,0,1,0,0|1,0,1]=4 11159 B9R1.89 OCC1C=CCCCC1 Amb27662352 [0,1,0,1,0,0|1,0,0]=3 11160 B9R1.89 OCC1CCC=CCC1 Amb25100187 [0,1,0,1,0,0|1,0,1]=4 11161 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|1,0,0]=3 11162 B9R1.89 OCC1CCCCCC1 Amb34916703 [0,1,0,1,0,0|1,0,0]=3 11163 B9R1.89 OCC1CCCCCN1 Amb33551226 [0,1,0,1,0,0|1,0,0]=3 11164 B9R1.89 OCC1CCCCCN1 Amb8009310 [0,1,0,1,0,0|1,0,0]=3 11165 B9R1.89 OCC1CCCCCO1 Amb25687959 [0,1,0,1,0,0|0,0,0]=2 11166 B9R1.89 OCC1CCCCNC1 Amb19149352 [0,1,0,1,0,0|1,0,0]=3 11167 B9R1.89 OCC1CCCCNC1 Amb8630389 [0,1,0,1,0,0|1,0,0]=3 11168 B9R1.89 OCC1CCCNCC1 Amb22886282 [0,1,0,1,0,0|1,0,0]=3 11169 B9R1.89 OCC1CCCNCC1 Amb33545032 [0,1,0,1,0,0|1,0,0]=3 11170 B9R1.89 OCC1CCCOCC1 Amb18203196 [0,1,0,1,0,0|1,0,0]=3 11171 B9R1.89 OCC1CCCSCC1 Amb18202263 [0,1,0,1,0,0|1,0,0]=3 11172 B9R1.89 OCC1CCNCCN1 Amb27413110 [0,1,0,1,0,0|1,0,0]=3 11173 B9R1.89 OCC1CCNCCO1 Amb26354139 [0,1,0,1,0,0|0,0,0]=2 11174 B9R1.89 OCC1CCNCCO1 Amb33482558 [0,1,0,1,0,0|0,0,0]=2 11175 B9R1.89 OCC1CCOCCN1 Amb26354772 [0,1,0,1,0,0|1,0,0]=3 11176 B9R1.89 OCC1CCOCCN1 Amb33744058 [0,1,0,1,0,0|1,0,0]=3 11177 B9R1.89 OCC1CCOCCO1 Amb27838550 [0,1,0,1,0,0|0,0,0]=2 11178 B9R1.89 OCC1CCSCCN1 Amb27778584 [0,1,0,1,0,0|1,0,0]=3 11179 B9R1.89 OCC1CNCCCO1 Amb17935876 [0,1,0,1,0,0|0,0,0]=2 11180 B9R1.89 OCC1CNCCCO1 Amb22497000 [0,1,0,1,0,0|0,0,0]=2 11181 B9R1.89 OCC1CNCCNC1 Amb22224806 [0,1,0,1,0,0|2,0,0]=4 11182 B9R1.89 OCC1CNCCOC1 Amb24481995 [0,1,0,1,0,0|1,0,0]=3 11183 B9R1.89 OCC1CNCCOC1 Amb33483671 [0,1,0,1,0,0|1,0,0]=3 11184 B9R1.89 OCC1COCCCO1 Amb25229839 [0,1,0,1,0,0|0,0,0]=2 11185 B9R1.89 OCC1COCCOC1 Amb27253103 [0,1,0,1,0,0|1,0,0]=3 11186 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [0,1,0,1,0,0|1,0,0]=3 11187 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [0,1,0,1,0,0|1,0,0]=3 11188 B9R1.89 ON=C1CCCCCC1 Amb7969725 [0,1,0,1,0,0|1,0,1]=4 11189 B9R1.89 ON=C1COCCOC1 Amb27393852 [0,1,0,1,0,0|1,0,1]=4 11190 B9R1.89 ONC1CCCSCC1 Amb35692798 [0,1,0,1,0,0|2,0,0]=4 11191 B9R1.89 SCC1CCCCCC1 Amb25960657 [0,1,0,1,0,0|1,1,0]=4 11192 B9R1.89 SCC1CCCCNC1 Amb35611336 [0,1,0,1,0,0|1,1,0]=4 11193 B9R1.89 SCN1CCCCCC1 Amb26499104 [0,1,0,1,0,0|1,1,0]=4 11194 B9R1.89 [C-]#[N+]C1CCCCCC1 Amb1981029 [0,1,0,1,0,0|2,0,0]=4 11195 B9R1.103 C1=CCOCCCCC1 Amb29838311 [0,1,0,1,0,0|1,0,1]=4 11196 B9R1.103 C1CCCCNCCC1 Amb21963016 [0,1,0,1,0,0|2,0,0]=4 11197 B9R1.103 C1CCCCNCCC1 Amb32662942 [0,1,0,1,0,0|2,0,0]=4 11198 B9R1.103 C1CCNCCNCC1 Amb28046834 [0,1,0,1,0,0|2,0,0]=4 11199 B9R1.103 C1CNCCNCCN1 Amb20203706 [0,1,0,1,0,0|2,0,0]=4 11200 B9R1.103 C1CNCCNCCN1 Amb21953158 [0,1,0,1,0,0|2,0,0]=4 11201 B9R1.103 C1CNCCNCCN1 Amb8515156 [0,1,0,1,0,0|2,0,0]=4 11202 B9R1.103 C1CNCCSCCN1 Amb21953151 [0,1,0,1,0,0|1,1,0]=4 11203 B9R1.103 C1CNCCSCCN1 Amb21953197 [0,1,0,1,0,0|1,1,0]=4 11204 B9R1.103 C1COCCOCCN1 Amb26437554 [0,1,0,1,0,0|0,0,0]=2 11205 B9R1.103 C1COCCOCCN1 Amb33743596 [0,1,0,1,0,0|0,0,0]=2 11206 B9R1.103 C1CSCCSCCN1 Amb27200295 [0,1,0,1,0,0|0,2,0]=4 11207 B9R1.103 C1CSCCSCCO1 Amb24647700 [0,1,0,1,0,0|0,1,0]=3 11208 B9R1.103 C1CSCCSCCS1 Amb9825898 [0,1,0,1,0,0|0,2,0]=4 11209 B9R1.1 C=C1CCC(CO)CC1 Amb10975464 [0,1,0,1,0,0|1,0,1]=4 11210 B9R1.1 CC1=NOC(CO)CC1 Amb27192019 [0,1,0,1,0,0|1,0,1]=4 11211 B9R1.1 CC1CCC(C=O)OC1 Amb27827433 [0,1,0,1,0,0|0,0,2]=4 11212 B9R1.1 CC1CCC(CBr)CC1 Amb22886696 [0,1,0,1,0,0|2,0,0]=4 11213 B9R1.1 CC1CCC(CBr)CO1 Amb35679306 [0,1,0,1,0,0|2,0,0]=4 11214 B9R1.1 CC1CCC(CBr)OC1 Amb35788523 [0,1,0,1,0,0|1,0,0]=3 11215 B9R1.1 CC1CCC(CCl)CC1 Amb26498565 [0,1,0,1,0,0|2,0,0]=4 11216 B9R1.1 CC1CCC(CCl)CO1 Amb35679305 [0,1,0,1,0,0|2,0,0]=4 11217 B9R1.1 CC1CCC(CN)CC1 Amb8950179 [0,1,0,1,0,0|2,0,0]=4 11218 B9R1.1 CC1CCC(CN)CO1 Amb29860382 [0,1,0,1,0,0|2,0,0]=4 11219 B9R1.1 CC1CCC(CN)NC1 Amb25379312 [0,1,0,1,0,0|2,0,0]=4 11220 B9R1.1 CC1CCC(CN)NC1 Amb35749606 [0,1,0,1,0,0|2,0,0]=4 11221 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [0,1,0,1,0,0|1,0,0]=3 11222 B9R1.1 CC1CCC(CO)CN1 Amb22886321 [0,1,0,1,0,0|2,0,0]=4 11223 B9R1.1 CC1CCC(CO)CO1 Amb35678925 [0,1,0,1,0,0|2,0,0]=4 11224 B9R1.1 CC1CCC(CO)NC1 Amb22886337 [0,1,0,1,0,0|1,0,0]=3 11225 B9R1.1 CC1CCC(CO)OC1 Amb27833600 [0,1,0,1,0,0|0,0,0]=2 11226 B9R1.1 CC1CCC(CS)CC1 Amb25188956 [0,1,0,1,0,0|1,1,0]=4 11227 B9R1.1 CC1CNC(CO)CN1 Amb17578108 [0,1,0,1,0,0|2,0,0]=4 11228 B9R1.1 CC1CNC(CO)CS1 Amb27424676 [0,1,0,1,0,0|2,0,0]=4 11229 B9R1.1 CC1COC(CBr)OC1 Amb27637729 [0,1,0,1,0,0|2,0,0]=4 11230 B9R1.1 CC1COC(CO)CN1 Amb20669470 [0,1,0,1,0,0|1,0,0]=3 11231 B9R1.1 CC1CSC(CO)CN1 Amb28318729 [0,1,0,1,0,0|1,1,0]=4 11232 B9R1.1 CCC1CCC(Br)CC1 Amb8835445 [0,1,0,1,0,0|2,0,0]=4 11233 B9R1.1 CCC1CCC(C)CC1 Amb22227949 [0,1,0,1,0,0|2,0,0]=4 11234 B9R1.1 CCC1CCC(C)CN1 Amb27668440 [0,1,0,1,0,0|2,0,0]=4 11235 B9R1.1 CCC1CCC(C)NC1 Amb2782904 [0,1,0,1,0,0|2,0,0]=4 11236 B9R1.1 CCC1CCC(C)NC1 Amb28934993 [0,1,0,1,0,0|2,0,0]=4 11237 B9R1.1 CCC1CCC(N)CC1 Amb1117745 [0,1,0,1,0,0|2,0,0]=4 11238 B9R1.1 CCC1CCC(N)CC1 Amb32661500 [0,1,0,1,0,0|2,0,0]=4 11239 B9R1.1 CCC1CCC(N)CN1 Amb33275542 [0,1,0,1,0,0|2,0,0]=4 11240 B9R1.1 CCC1CCC(S)CC1 Amb9208051 [0,1,0,1,0,0|2,0,0]=4 11241 B9R1.1 CCC1CNC(=O)CO1 Amb27427622 [0,1,0,1,0,0|1,0,1]=4 11242 B9R1.1 CCC1CNC(C)CN1 Amb22739936 [0,1,0,1,0,0|2,0,0]=4 11243 B9R1.1 CCC1CNC(C)CO1 Amb8868503 [0,1,0,1,0,0|1,0,0]=3 11244 B9R1.1 CCC1COC(=O)CN1 Amb27179683 [0,1,0,1,0,0|1,0,1]=4 11245 B9R1.1 CCC1COC(C)CN1 Amb9702470 [0,1,0,1,0,0|1,0,0]=3 11246 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb32665354 [0,1,0,1,0,0|2,0,0]=4 11247 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb33484385 [0,1,0,1,0,0|2,0,0]=4 11248 B9R1.1 CC[C@@H]1CC[C@H](C)NC1 Amb26423925 [0,1,0,1,0,0|2,0,0]=4 11249 B9R1.1 CC[C@H]1CCC(C)NC1 Amb28196699 [0,1,0,1,0,0|2,0,0]=4 11250 B9R1.1 CC[C@H]1CC[C@@H](C)CC1 Amb22230416 [0,1,0,1,0,0|2,0,0]=4 11251 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb26528612 [0,1,0,1,0,0|2,0,0]=4 11252 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb32652730 [0,1,0,1,0,0|2,0,0]=4 11253 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb27759922 [0,1,0,1,0,0|2,0,0]=4 11254 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb28935024 [0,1,0,1,0,0|2,0,0]=4 11255 B9R1.1 CC[C@H]1CC[C@H](O)CC1 Amb22231677 [0,1,0,1,0,0|2,0,0]=4 11256 B9R1.1 CN1CCC(CO)CC1 Amb1099350 [0,1,0,1,0,0|2,0,0]=4 11257 B9R1.1 CN1CCC(CO)CC1 Amb32410101 [0,1,0,1,0,0|2,0,0]=4 11258 B9R1.1 CNC1CCC(C)OC1 Amb35703065 [0,1,0,1,0,0|2,0,0]=4 11259 B9R1.1 COC1CCC(Cl)CO1 Amb28144992 [0,1,0,1,0,0|2,0,0]=4 11260 B9R1.1 COC1CCC(O)CO1 Amb27956620 [0,1,0,1,0,0|2,0,0]=4 11261 B9R1.1 COC1CCC(O)OC1 Amb27805680 [0,1,0,1,0,0|2,0,0]=4 11262 B9R1.1 CO[C@H]1CC[C@@H](O)OC1 Amb28344966 [0,1,0,1,0,0|2,0,0]=4 11263 B9R1.1 C[C@@H]1CCC(CO)CN1 Amb27424728 [0,1,0,1,0,0|2,0,0]=4 11264 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35788826 [0,1,0,1,0,0|1,0,0]=3 11265 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35789057 [0,1,0,1,0,0|1,0,0]=3 11266 B9R1.1 C[C@@H]1CC[C@@H](CO)CN1 Amb24062957 [0,1,0,1,0,0|2,0,0]=4 11267 B9R1.1 C[C@@H]1CC[C@@H](CO)CN1 Amb24515133 [0,1,0,1,0,0|2,0,0]=4 11268 B9R1.1 C[C@@H]1CC[C@@H](CO)NC1 Amb26027160 [0,1,0,1,0,0|1,0,0]=3 11269 B9R1.1 C[C@@H]1CC[C@@H](CO)NC1 Amb35750775 [0,1,0,1,0,0|1,0,0]=3 11270 B9R1.1 C[C@@H]1CC[C@H](CO)CN1 Amb27986119 [0,1,0,1,0,0|2,0,0]=4 11271 B9R1.1 C[C@@H]1CC[C@H](CO)CN1 Amb30869370 [0,1,0,1,0,0|2,0,0]=4 11272 B9R1.1 C[C@@H]1CN[C@@H](CO)CN1 Amb30868000 [0,1,0,1,0,0|2,0,0]=4 11273 B9R1.1 C[C@@H]1CO[C@H](CO)CN1 Amb27259238 [0,1,0,1,0,0|1,0,0]=3 11274 B9R1.1 C[C@H]1CC[C@@H](CBr)CC1 Amb27185733 [0,1,0,1,0,0|2,0,0]=4 11275 B9R1.1 C[C@H]1CC[C@@H](CO)CC1 Amb26407994 [0,1,0,1,0,0|1,0,0]=3 11276 B9R1.1 C[C@H]1CC[C@@H](CO)CN1 Amb33801087 [0,1,0,1,0,0|2,0,0]=4 11277 B9R1.1 C[C@H]1CC[C@@H](CO)NC1 Amb27630533 [0,1,0,1,0,0|1,0,0]=3 11278 B9R1.1 C[C@H]1CC[C@H](CBr)CC1 Amb28458303 [0,1,0,1,0,0|2,0,0]=4 11279 B9R1.1 C[C@H]1CC[C@H](CN)CC1 Amb27393144 [0,1,0,1,0,0|2,0,0]=4 11280 B9R1.1 C[C@H]1CC[C@H](CO)CC1 Amb22886817 [0,1,0,1,0,0|1,0,0]=3 11281 B9R1.1 C[C@H]1CO[C@@H](CBr)OC1 Amb27862812 [0,1,0,1,0,0|2,0,0]=4 11282 B9R1.1 ClCC1CCC(Cl)CS1 Amb27454127 [0,1,0,1,0,0|1,1,0]=4 11283 B9R1.1 ClC[C@@H]1CC[C@H](Cl)CS1 Amb27659299 [0,1,0,1,0,0|1,1,0]=4 11284 B9R1.1 FC1CCC(CBr)CC1 Amb25970700 [0,1,0,1,0,0|2,0,0]=4 11285 B9R1.1 FC1CCC(CCl)CC1 Amb32943804 [0,1,0,1,0,0|2,0,0]=4 11286 B9R1.1 NC1CCC(CBr)CC1 Amb27877753 [0,1,0,1,0,0|2,0,0]=4 11287 B9R1.1 NC1CCC(CO)CC1 Amb6740014 [0,1,0,1,0,0|1,0,0]=3 11288 B9R1.1 NCC1CCC(Br)CC1 Amb28126926 [0,1,0,1,0,0|2,0,0]=4 11289 B9R1.1 NCC1CCC(Cl)CC1 Amb27466808 [0,1,0,1,0,0|2,0,0]=4 11290 B9R1.1 NCC1CCC(F)CC1 Amb24122686 [0,1,0,1,0,0|2,0,0]=4 11291 B9R1.1 NCC1CCC(F)CC1 Amb25727264 [0,1,0,1,0,0|2,0,0]=4 11292 B9R1.1 NCC1CCC(N)CC1 Amb16233730 [0,1,0,1,0,0|2,0,0]=4 11293 B9R1.1 NCC1CCC(N)CC1 Amb22491656 [0,1,0,1,0,0|2,0,0]=4 11294 B9R1.1 NCC1CCC(O)CC1 Amb20669423 [0,1,0,1,0,0|2,0,0]=4 11295 B9R1.1 NCC1CCC(O)CC1 Amb25930193 [0,1,0,1,0,0|2,0,0]=4 11296 B9R1.1 NCC1CCC(O)CO1 Amb32640405 [0,1,0,1,0,0|1,0,0]=3 11297 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,1,0,1,0,0|1,0,1]=4 11298 B9R1.1 NC[C@H]1CC[C@@H](F)CC1 Amb34913163 [0,1,0,1,0,0|2,0,0]=4 11299 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb24183403 [0,1,0,1,0,0|2,0,0]=4 11300 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb25323044 [0,1,0,1,0,0|2,0,0]=4 11301 B9R1.1 NC[C@H]1CC[C@H](F)CC1 Amb34913161 [0,1,0,1,0,0|2,0,0]=4 11302 B9R1.1 NC[C@H]1CC[C@H](O)CC1 Amb23439293 [0,1,0,1,0,0|2,0,0]=4 11303 B9R1.1 NC[C@H]1CC[C@H](O)CC1 Amb25075878 [0,1,0,1,0,0|2,0,0]=4 11304 B9R1.1 NN1CCC(CO)CC1 Amb27476119 [0,1,0,1,0,0|2,0,0]=4 11305 B9R1.1 N[C@@H]1C=C[C@H](CO)CC1 Amb24649717 [0,1,0,1,0,0|1,0,1]=4 11306 B9R1.1 N[C@@H]1CC[C@@H](CO)OC1 Amb28204004 [0,1,0,1,0,0|0,0,0]=2 11307 B9R1.1 N[C@H]1C=C[C@@H](CO)CC1 Amb24443345 [0,1,0,1,0,0|1,0,1]=4 11308 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb20668772 [0,1,0,1,0,0|1,0,0]=3 11309 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb22899692 [0,1,0,1,0,0|1,0,0]=3 11310 B9R1.1 N[C@H]1CC[C@H](CCl)CC1 Amb28341749 [0,1,0,1,0,0|2,0,0]=4 11311 B9R1.1 N[C@H]1CC[C@H](CF)CC1 Amb34913064 [0,1,0,1,0,0|2,0,0]=4 11312 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb17607961 [0,1,0,1,0,0|1,0,0]=3 11313 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb22747955 [0,1,0,1,0,0|1,0,0]=3 11314 B9R1.1 O=C1CCC(CO)CC1 Amb10071596 [0,1,0,1,0,0|1,0,1]=4 11315 B9R1.1 O=C1COC(CCl)CO1 Amb33734959 [0,1,0,1,0,0|1,0,1]=4 11316 B9R1.1 O=C1COC(CO)CN1 Amb22236094 [0,1,0,1,0,0|1,0,1]=4 11317 B9R1.1 O=C1COC(CO)CO1 Amb28315509 [0,1,0,1,0,0|1,0,1]=4 11318 B9R1.1 O=C1CO[C@H](CO)CN1 Amb10067153 [0,1,0,1,0,0|1,0,1]=4 11319 B9R1.1 OC1CCC(CBr)CO1 Amb28285273 [0,1,0,1,0,0|2,0,0]=4 11320 B9R1.1 OC1CCC(CCl)CC1 Amb24480360 [0,1,0,1,0,0|2,0,0]=4 11321 B9R1.1 OC1CCC(CI)CC1 Amb25728551 [0,1,0,1,0,0|2,0,0]=4 11322 B9R1.1 OC1COC(CBr)OC1 Amb27863415 [0,1,0,1,0,0|2,0,0]=4 11323 B9R1.1 OC1COC(CCl)OC1 Amb17593814 [0,1,0,1,0,0|2,0,0]=4 11324 B9R1.1 OCC1=CCC(O)CC1 Amb28206504 [0,1,0,1,0,0|1,0,1]=4 11325 B9R1.1 OCC1CCC(F)CC1 Amb24122685 [0,1,0,1,0,0|1,0,0]=3 11326 B9R1.1 OCC1CCC(O)CC1 Amb13883568 [0,1,0,1,0,0|1,0,0]=3 11327 B9R1.1 OCC1CCC(O)CN1 Amb5720009 [0,1,0,1,0,0|1,0,0]=3 11328 B9R1.1 OCC1CCC(O)CO1 Amb28312865 [0,1,0,1,0,0|0,0,0]=2 11329 B9R1.1 OC[C@@H]1CC[C@@H](O)CN1 Amb27249840 [0,1,0,1,0,0|1,0,0]=3 11330 B9R1.1 OC[C@@H]1CC[C@H](O)CO1 Amb27457666 [0,1,0,1,0,0|0,0,0]=2 11331 B9R1.1 OC[C@H]1CC[C@@H](F)CC1 Amb34163407 [0,1,0,1,0,0|1,0,0]=3 11332 B9R1.1 OC[C@H]1CC[C@@H](O)CC1 Amb26345146 [0,1,0,1,0,0|1,0,0]=3 11333 B9R1.1 OC[C@H]1CC[C@H](F)CC1 Amb34165509 [0,1,0,1,0,0|1,0,0]=3 11334 B9R1.1 OC[C@H]1CC[C@H](O)CC1 Amb25320791 [0,1,0,1,0,0|1,0,0]=3 11335 B9R1.1 OC[C@H]1OC[C@@H](O)CO1 Amb27457959 [0,1,0,1,0,0|1,0,0]=3 11336 B9R1.3 C=C1CCCC(C)C1O Amb27207403 [0,1,0,1,0,0|1,0,1]=4 11337 B9R1.3 CC1C(N)CCCC1N Amb27180055 [0,1,0,1,0,0|2,0,0]=4 11338 B9R1.3 CC1C(O)CCCN1C Amb27481456 [0,1,0,1,0,0|2,0,0]=4 11339 B9R1.3 CC1CC=CC(O)C1O Amb27466712 [0,1,0,1,0,0|1,0,1]=4 11340 B9R1.3 CC1CCCC(=O)C1O Amb27838796 [0,1,0,1,0,0|1,0,1]=4 11341 B9R1.3 CC1CCCC(Br)C1O Amb24601208 [0,1,0,1,0,0|1,0,0]=3 11342 B9R1.3 CC1CCCC(C)C1Br Amb8835441 [0,1,0,1,0,0|2,0,0]=4 11343 B9R1.3 CC1CCCC(C)C1C Amb22227691 [0,1,0,1,0,0|2,0,0]=4 11344 B9R1.3 CC1CCCC(C)C1N Amb6892747 [0,1,0,1,0,0|2,0,0]=4 11345 B9R1.3 CC1CCCC(C)C1N Amb9705390 [0,1,0,1,0,0|2,0,0]=4 11346 B9R1.3 CC1CCCC(C)C1O Amb2227580 [0,1,0,1,0,0|1,0,0]=3 11347 B9R1.3 CC1CCCC(C)C1S Amb9208048 [0,1,0,1,0,0|1,1,0]=4 11348 B9R1.3 CC1CCCC(Cl)C1O Amb24539273 [0,1,0,1,0,0|1,0,0]=3 11349 B9R1.3 CC1CCCC(F)C1N Amb24650619 [0,1,0,1,0,0|2,0,0]=4 11350 B9R1.3 CC1CCCC(N)C1C Amb3939985 [0,1,0,1,0,0|2,0,0]=4 11351 B9R1.3 CC1CCCC(O)C1C Amb9825841 [0,1,0,1,0,0|1,0,0]=3 11352 B9R1.3 CC1CCCC(S)C1C Amb25731166 [0,1,0,1,0,0|1,1,0]=4 11353 B9R1.3 CC1CCC[C@@H](O)[C@@H]1N Amb27636307 [0,1,0,1,0,0|2,0,0]=4 11354 B9R1.3 CC1CCC[C@@H](O)[C@@H]1O Amb28318183 [0,1,0,1,0,0|1,0,0]=3 11355 B9R1.3 CC1CCC[C@H](O)[C@@H]1O Amb27844355 [0,1,0,1,0,0|1,0,0]=3 11356 B9R1.3 CC1CCNC(C)C1Br Amb10602249 [0,1,0,1,0,0|2,0,0]=4 11357 B9R1.3 CC1CCNC(C)C1N Amb24529075 [0,1,0,1,0,0|2,0,0]=4 11358 B9R1.3 CC1CNCC(C)C1O Amb22299424 [0,1,0,1,0,0|2,0,0]=4 11359 B9R1.3 CC1CNCC(C)C1O Amb28555619 [0,1,0,1,0,0|2,0,0]=4 11360 B9R1.3 CC1CNCC(N)C1O Amb27651624 [0,1,0,1,0,0|2,0,0]=4 11361 B9R1.3 CC1CNC[C@@H](O)[C@@H]1O Amb27810800 [0,1,0,1,0,0|2,0,0]=4 11362 B9R1.3 CC1CNC[C@H](O)[C@H]1O Amb28128453 [0,1,0,1,0,0|2,0,0]=4 11363 B9R1.3 CC1COCC(C)C1O Amb22299419 [0,1,0,1,0,0|2,0,0]=4 11364 B9R1.3 CC1CSCC(O)C1O Amb28069518 [0,1,0,1,0,0|1,1,0]=4 11365 B9R1.3 CC1OCCC(N)C1O Amb27623875 [0,1,0,1,0,0|1,0,0]=3 11366 B9R1.3 CC1OCCC(O)C1Br Amb27408388 [0,1,0,1,0,0|2,0,0]=4 11367 B9R1.3 CC1OCCC(O)C1O Amb25147154 [0,1,0,1,0,0|1,0,0]=3 11368 B9R1.3 CC1ONCC(O)C1O Amb28400716 [0,1,0,1,0,0|2,0,0]=4 11369 B9R1.3 CC1[C@H](C)CCC[C@H]1C Amb27493255 [0,1,0,1,0,0|2,0,0]=4 11370 B9R1.3 C[C@@H]1C(O)CCC[C@H]1C Amb27451971 [0,1,0,1,0,0|1,0,0]=3 11371 B9R1.3 C[C@@H]1CCCC(O)[C@@H]1C Amb27664284 [0,1,0,1,0,0|1,0,0]=3 11372 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1C Amb27876256 [0,1,0,1,0,0|1,0,0]=3 11373 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1O Amb28320895 [0,1,0,1,0,0|1,0,0]=3 11374 B9R1.3 C[C@@H]1CCC[C@H](N)[C@@H]1C Amb28055489 [0,1,0,1,0,0|2,0,0]=4 11375 B9R1.3 C[C@@H]1CCC[C@H](O)C1O Amb27198139 [0,1,0,1,0,0|1,0,0]=3 11376 B9R1.3 C[C@@H]1CCOC(=O)[C@H]1O Amb27197166 [0,1,0,1,0,0|0,0,1]=3 11377 B9R1.3 C[C@@H]1CNC[C@@H](N)[C@H]1O Amb27422127 [0,1,0,1,0,0|2,0,0]=4 11378 B9R1.3 C[C@@H]1CNC[C@@H](O)[C@H]1O Amb32410906 [0,1,0,1,0,0|2,0,0]=4 11379 B9R1.3 C[C@@H]1CNC[C@H](O)[C@@H]1O Amb32410907 [0,1,0,1,0,0|2,0,0]=4 11380 B9R1.3 C[C@@H]1CSC[C@H](O)[C@@H]1O Amb27662365 [0,1,0,1,0,0|1,1,0]=4 11381 B9R1.3 C[C@@H]1OCC[C@H](O)[C@H]1O Amb27422278 [0,1,0,1,0,0|1,0,0]=3 11382 B9R1.3 C[C@@H]1[C@@H](O)CCC[C@H]1O Amb27805899 [0,1,0,1,0,0|1,0,0]=3 11383 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1C Amb25245256 [0,1,0,1,0,0|2,0,0]=4 11384 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1O Amb28350332 [0,1,0,1,0,0|1,0,0]=3 11385 B9R1.3 C[C@H]1CCC[C@@H](F)[C@@H]1N Amb27778713 [0,1,0,1,0,0|2,0,0]=4 11386 B9R1.3 C[C@H]1CCC[C@@H](N)[C@@H]1O Amb28252463 [0,1,0,1,0,0|1,0,0]=3 11387 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1C Amb27253637 [0,1,0,1,0,0|2,0,0]=4 11388 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1N Amb27215993 [0,1,0,1,0,0|2,0,0]=4 11389 B9R1.3 C[C@H]1CCC[C@@H](O)[C@@H]1O Amb27186925 [0,1,0,1,0,0|1,0,0]=3 11390 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1C Amb27980719 [0,1,0,1,0,0|1,0,0]=3 11391 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1O Amb27647956 [0,1,0,1,0,0|1,0,0]=3 11392 B9R1.3 C[C@H]1CCC[C@H](C)C1N Amb27860934 [0,1,0,1,0,0|2,0,0]=4 11393 B9R1.3 C[C@H]1CCC[C@H](C)C1O Amb27196772 [0,1,0,1,0,0|1,0,0]=3 11394 B9R1.3 C[C@H]1CCC[C@H](O)[C@@H]1O Amb27844257 [0,1,0,1,0,0|1,0,0]=3 11395 B9R1.3 C[C@H]1CCOC(=O)[C@@H]1O Amb27196773 [0,1,0,1,0,0|0,0,1]=3 11396 B9R1.3 C[C@H]1CNC[C@@H](N)[C@@H]1O Amb27422190 [0,1,0,1,0,0|2,0,0]=4 11397 B9R1.3 C[C@H]1CNC[C@H](O)[C@@H]1O Amb28411321 [0,1,0,1,0,0|2,0,0]=4 11398 B9R1.3 C[C@H]1OCC[C@@H](O)[C@@H]1O Amb27969001 [0,1,0,1,0,0|1,0,0]=3 11399 B9R1.3 C[C@H]1OCC[C@H](O)[C@H]1Br Amb28051782 [0,1,0,1,0,0|2,0,0]=4 11400 B9R1.3 C[C@H]1OCC[C@H](O)[C@H]1O Amb27471300 [0,1,0,1,0,0|1,0,0]=3 11401 B9R1.3 C[C@H]1[C@@H](O)CCC[C@H]1O Amb27665271 [0,1,0,1,0,0|1,0,0]=3 11402 B9R1.3 C[C@H]1[C@H](C)CCC[C@H]1N Amb28055501 [0,1,0,1,0,0|2,0,0]=4 11403 B9R1.3 C[C@H]1[C@H](O)CCCN1C Amb27197524 [0,1,0,1,0,0|2,0,0]=4 11404 B9R1.3 NC1C(O)CCCC1O Amb18642840 [0,1,0,1,0,0|2,0,0]=4 11405 B9R1.3 NC1CNCC(O)C1O Amb26026478 [0,1,0,1,0,0|2,0,0]=4 11406 B9R1.3 N[C@@H]1CCC[C@@H](N)C1O Amb28429791 [0,1,0,1,0,0|2,0,0]=4 11407 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1O Amb24117833 [0,1,0,1,0,0|2,0,0]=4 11408 B9R1.3 N[C@@H]1CCC[C@H](O)[C@@H]1O Amb27777923 [0,1,0,1,0,0|2,0,0]=4 11409 B9R1.3 N[C@@H]1CCC[C@H](O)[C@H]1O Amb27467411 [0,1,0,1,0,0|2,0,0]=4 11410 B9R1.3 N[C@@H]1CCO[C@H](O)[C@@H]1O Amb27461447 [0,1,0,1,0,0|1,0,0]=3 11411 B9R1.3 N[C@@H]1CNC[C@H](O)[C@H]1O Amb28289576 [0,1,0,1,0,0|2,0,0]=4 11412 B9R1.3 N[C@@H]1[C@@H](O)CCC[C@H]1O Amb27230391 [0,1,0,1,0,0|2,0,0]=4 11413 B9R1.3 N[C@H]1CCC[C@H](O)[C@@H]1O Amb27787410 [0,1,0,1,0,0|2,0,0]=4 11414 B9R1.3 N[C@H]1CCO[C@H](O)[C@@H]1O Amb27194850 [0,1,0,1,0,0|1,0,0]=3 11415 B9R1.3 N[C@H]1[C@@H](O)CCC[C@H]1O Amb27469070 [0,1,0,1,0,0|2,0,0]=4 11416 B9R1.3 O=C1C(O)COCC1O Amb27221993 [0,1,0,1,0,0|1,0,1]=4 11417 B9R1.3 OC1C(Cl)CCCC1Cl Amb27454874 [0,1,0,1,0,0|2,0,0]=4 11418 B9R1.3 OC1C(F)CCCC1Br Amb27659405 [0,1,0,1,0,0|2,0,0]=4 11419 B9R1.3 OC1CCCC(Cl)C1Cl Amb28342440 [0,1,0,1,0,0|2,0,0]=4 11420 B9R1.3 OC1CCCC(F)C1O Amb27486501 [0,1,0,1,0,0|2,0,0]=4 11421 B9R1.3 OC1CCCC(O)C1Br Amb28342321 [0,1,0,1,0,0|2,0,0]=4 11422 B9R1.3 OC1CCCC(O)C1O Amb22227693 [0,1,0,1,0,0|2,0,0]=4 11423 B9R1.3 OC1CNCC(O)C1O Amb22489592 [0,1,0,1,0,0|2,0,0]=4 11424 B9R1.3 OC1CNCC(O)C1O Amb32752605 [0,1,0,1,0,0|2,0,0]=4 11425 B9R1.3 OC1CNC[C@@H](O)C1O Amb28189454 [0,1,0,1,0,0|2,0,0]=4 11426 B9R1.3 OC1COCC(O)C1O Amb27220601 [0,1,0,1,0,0|1,0,0]=3 11427 B9R1.3 OC1COC[C@@H](O)C1F Amb27264911 [0,1,0,1,0,0|1,0,0]=3 11428 B9R1.3 OC1COC[C@@H](O)C1O Amb27487724 [0,1,0,1,0,0|1,0,0]=3 11429 B9R1.3 OC1[C@H](O)CNC[C@H]1O Amb27461791 [0,1,0,1,0,0|2,0,0]=4 11430 B9R1.3 O[C@@H]1CSC[C@H](O)[C@@H]1O Amb27769946 [0,1,0,1,0,0|1,1,0]=4 11431 B9R1.3 O[C@H]1CCC[C@H](Br)[C@@H]1O Amb28385510 [0,1,0,1,0,0|2,0,0]=4 11432 B9R1.3 O[C@H]1CCO[C@@H](O)[C@@H]1O Amb28194179 [0,1,0,1,0,0|1,0,0]=3 11433 B9R1.3 O[C@H]1CNC[C@@H](O)[C@H]1O Amb26957797 [0,1,0,1,0,0|2,0,0]=4 11434 B9R1.3 O[C@H]1CNC[C@@H](O)[C@H]1O Amb32667088 [0,1,0,1,0,0|2,0,0]=4 11435 B9R1.3 O[C@H]1COC[C@@H](O)[C@H]1O Amb28280956 [0,1,0,1,0,0|1,0,0]=3 11436 B9R1.11 C=C(CO)C1CCCC1 Amb27751861 [0,1,0,1,0,0|1,0,1]=4 11437 B9R1.11 CC(C=O)C1OCCO1 Amb27268508 [0,1,0,1,0,0|1,0,1]=4 11438 B9R1.11 CC(CBr)C1CCCC1 Amb24478814 [0,1,0,1,0,0|2,0,0]=4 11439 B9R1.11 CC(CBr)C1CCCO1 Amb27877680 [0,1,0,1,0,0|2,0,0]=4 11440 B9R1.11 CC(CBr)C1OCCO1 Amb17336913 [0,1,0,1,0,0|1,0,0]=3 11441 B9R1.11 CC(CBr)N1CCCC1 Amb27755444 [0,1,0,1,0,0|2,0,0]=4 11442 B9R1.11 CC(CCl)C1CCCC1 Amb25327474 [0,1,0,1,0,0|2,0,0]=4 11443 B9R1.11 CC(CCl)C1CCCO1 Amb25764692 [0,1,0,1,0,0|2,0,0]=4 11444 B9R1.11 CC(CCl)C1OCCO1 Amb25270916 [0,1,0,1,0,0|1,0,0]=3 11445 B9R1.11 CC(CCl)N1CCCC1 Amb21955715 [0,1,0,1,0,0|2,0,0]=4 11446 B9R1.11 CC(CCl)N1CCCC1 Amb9173714 [0,1,0,1,0,0|2,0,0]=4 11447 B9R1.11 CC(CN)C1CCCC1 Amb17087397 [0,1,0,1,0,0|2,0,0]=4 11448 B9R1.11 CC(CN)C1CCCO1 Amb28245972 [0,1,0,1,0,0|2,0,0]=4 11449 B9R1.11 CC(CN)C1OCCO1 Amb17334126 [0,1,0,1,0,0|1,0,0]=3 11450 B9R1.11 CC(CN)N1CCCC1 Amb1124431 [0,1,0,1,0,0|2,0,0]=4 11451 B9R1.11 CC(CN)N1CCCC1 Amb30982613 [0,1,0,1,0,0|2,0,0]=4 11452 B9R1.11 CC(CO)C1CCCC1 Amb25997168 [0,1,0,1,0,0|1,0,0]=3 11453 B9R1.11 CC(CO)C1CCCO1 Amb27397022 [0,1,0,1,0,0|2,0,0]=4 11454 B9R1.11 CC(CO)C1CCOC1 Amb26637248 [0,1,0,1,0,0|2,0,0]=4 11455 B9R1.11 CC(CO)N1CCCC1 Amb9173717 [0,1,0,1,0,0|1,0,0]=3 11456 B9R1.11 CC(CO)N1CCCN1 Amb27969463 [0,1,0,1,0,0|2,0,0]=4 11457 B9R1.11 CCC(C)C1CCCC1 Amb17689395 [0,1,0,1,0,0|2,0,0]=4 11458 B9R1.11 CCC(C)C1CCCN1 Amb35789368 [0,1,0,1,0,0|2,0,0]=4 11459 B9R1.11 CCC(C)C1CCCN1 Amb9714968 [0,1,0,1,0,0|2,0,0]=4 11460 B9R1.11 CCC(C)C1OCCO1 Amb27153862 [0,1,0,1,0,0|0,0,0]=2 11461 B9R1.11 CCC(N)C1CCCC1 Amb18281187 [0,1,0,1,0,0|2,0,0]=4 11462 B9R1.11 CCC(N)C1CCCN1 Amb26918433 [0,1,0,1,0,0|2,0,0]=4 11463 B9R1.11 CCC(N)C1CCCO1 Amb22059669 [0,1,0,1,0,0|1,0,0]=3 11464 B9R1.11 CCC(N)C1CCCS1 Amb27202616 [0,1,0,1,0,0|1,1,0]=4 11465 B9R1.11 CCC(O)C1CCCN1 Amb17231861 [0,1,0,1,0,0|2,0,0]=4 11466 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb28340949 [0,1,0,1,0,0|2,0,0]=4 11467 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb33734033 [0,1,0,1,0,0|2,0,0]=4 11468 B9R1.11 CCC(O)[C@H]1CCCN1 Amb29891705 [0,1,0,1,0,0|2,0,0]=4 11469 B9R1.11 CCC(O)[C@H]1CCCN1 Amb33734032 [0,1,0,1,0,0|2,0,0]=4 11470 B9R1.11 CCC(O)[C@H]1CCCO1 Amb28435654 [0,1,0,1,0,0|1,0,0]=3 11471 B9R1.11 CCC(S)C1CCCC1 Amb25984964 [0,1,0,1,0,0|2,0,0]=4 11472 B9R1.11 CC[C@@H](N)C1CCCO1 Amb27838765 [0,1,0,1,0,0|1,0,0]=3 11473 B9R1.11 CC[C@@H](O)[C@@H]1CCCO1 Amb27463124 [0,1,0,1,0,0|1,0,0]=3 11474 B9R1.11 CC[C@@H](O)[C@H]1CCCO1 Amb27980675 [0,1,0,1,0,0|1,0,0]=3 11475 B9R1.11 CC[C@H](N)C1CCCC1 Amb27436954 [0,1,0,1,0,0|2,0,0]=4 11476 B9R1.11 CC[C@H](O)C1CCCC1 Amb27758989 [0,1,0,1,0,0|2,0,0]=4 11477 B9R1.11 CC[C@H](O)C1CCCO1 Amb27815999 [0,1,0,1,0,0|1,0,0]=3 11478 B9R1.11 CC[C@H](O)[C@H]1CCCO1 Amb27432283 [0,1,0,1,0,0|1,0,0]=3 11479 B9R1.11 CNC(C)C1CCCO1 Amb33531766 [0,1,0,1,0,0|2,0,0]=4 11480 B9R1.11 C[C@@H](CCl)N1CCCC1 Amb27259305 [0,1,0,1,0,0|2,0,0]=4 11481 B9R1.11 C[C@@H](CN)C1CCCC1 Amb33731705 [0,1,0,1,0,0|2,0,0]=4 11482 B9R1.11 C[C@@H](CN)C1CCCO1 Amb33744397 [0,1,0,1,0,0|2,0,0]=4 11483 B9R1.11 C[C@@H](CO)C1CCCC1 Amb33741046 [0,1,0,1,0,0|1,0,0]=3 11484 B9R1.11 C[C@@H](CO)C1CCCO1 Amb33743091 [0,1,0,1,0,0|2,0,0]=4 11485 B9R1.11 C[C@@H](CO)C1CCOC1 Amb33735554 [0,1,0,1,0,0|2,0,0]=4 11486 B9R1.11 C[C@H](CN)C1CCCC1 Amb33736881 [0,1,0,1,0,0|2,0,0]=4 11487 B9R1.11 C[C@H](CN)C1CCCO1 Amb33747420 [0,1,0,1,0,0|2,0,0]=4 11488 B9R1.11 C[C@H](CO)C1CCCC1 Amb33748466 [0,1,0,1,0,0|1,0,0]=3 11489 B9R1.11 C[C@H](CO)C1CCCO1 Amb33738163 [0,1,0,1,0,0|2,0,0]=4 11490 B9R1.11 C[C@H](CO)C1CCOC1 Amb33730457 [0,1,0,1,0,0|2,0,0]=4 11491 B9R1.11 C[C@H](CO)N1CCCC1 Amb26479447 [0,1,0,1,0,0|1,0,0]=3 11492 B9R1.11 C\C=C(\C)C1OCCO1 Amb27843500 [0,1,0,1,0,0|0,0,2]=4 11493 B9R1.11 NC(CCl)C1CCCC1 Amb28324505 [0,1,0,1,0,0|2,0,0]=4 11494 B9R1.11 NC(CF)C1CCCC1 Amb27182144 [0,1,0,1,0,0|2,0,0]=4 11495 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [0,1,0,1,0,0|1,0,0]=3 11496 B9R1.11 NC(CO)C1CCCN1 Amb27631593 [0,1,0,1,0,0|2,0,0]=4 11497 B9R1.11 NC(CO)C1CCCO1 Amb24480307 [0,1,0,1,0,0|2,0,0]=4 11498 B9R1.11 NC(CO)C1CCCS1 Amb27185967 [0,1,0,1,0,0|2,0,0]=4 11499 B9R1.11 NC(CO)C1CCOC1 Amb20628792 [0,1,0,1,0,0|2,0,0]=4 11500 B9R1.11 NC(CO)C1CCOC1 Amb2683375 [0,1,0,1,0,0|2,0,0]=4 11501 B9R1.11 NC(CO)C1CCSC1 Amb28049181 [0,1,0,1,0,0|2,0,0]=4 11502 B9R1.11 NCC(F)C1CCCC1 Amb28120476 [0,1,0,1,0,0|2,0,0]=4 11503 B9R1.11 NCC(F)C1CCCC1 Amb31291557 [0,1,0,1,0,0|2,0,0]=4 11504 B9R1.11 NCC(F)C1CCCO1 Amb33318737 [0,1,0,1,0,0|2,0,0]=4 11505 B9R1.11 NCC(N)C1CCCC1 Amb18284364 [0,1,0,1,0,0|2,0,0]=4 11506 B9R1.11 NCC(N)C1CCCO1 Amb28285291 [0,1,0,1,0,0|2,0,0]=4 11507 B9R1.11 NCC(O)C1CCCC1 Amb18959867 [0,1,0,1,0,0|2,0,0]=4 11508 B9R1.11 NCC(O)C1CCCC1 Amb19515470 [0,1,0,1,0,0|2,0,0]=4 11509 B9R1.11 NCC(O)C1CCCO1 Amb25662050 [0,1,0,1,0,0|2,0,0]=4 11510 B9R1.11 NC[C@@H](O)C1CCCC1 Amb25921175 [0,1,0,1,0,0|2,0,0]=4 11511 B9R1.11 NC[C@@H](O)C1CCCO1 Amb26850154 [0,1,0,1,0,0|2,0,0]=4 11512 B9R1.11 NC[C@H](N)C1CCCC1 Amb27204572 [0,1,0,1,0,0|2,0,0]=4 11513 B9R1.11 NC[C@H](O)C1CCCC1 Amb25889800 [0,1,0,1,0,0|2,0,0]=4 11514 B9R1.11 NC[C@H](O)C1CCCO1 Amb26593835 [0,1,0,1,0,0|2,0,0]=4 11515 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [0,1,0,1,0,0|1,0,0]=3 11516 B9R1.11 N[C@@H](CO)C1CCCO1 Amb33318723 [0,1,0,1,0,0|2,0,0]=4 11517 B9R1.11 N[C@@H](CO)C1CCCS1 Amb33416835 [0,1,0,1,0,0|2,0,0]=4 11518 B9R1.11 N[C@@H](CO)C1CCOC1 Amb33420758 [0,1,0,1,0,0|2,0,0]=4 11519 B9R1.11 N[C@@H](CO)C1CCSC1 Amb33141543 [0,1,0,1,0,0|2,0,0]=4 11520 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [0,1,0,1,0,0|1,0,0]=3 11521 B9R1.11 N[C@H](CO)C1CCCC1 Amb33872225 [0,1,0,1,0,0|1,0,0]=3 11522 B9R1.11 N[C@H](CO)C1CCCO1 Amb33318724 [0,1,0,1,0,0|2,0,0]=4 11523 B9R1.11 N[C@H](CO)C1CCCS1 Amb33416836 [0,1,0,1,0,0|2,0,0]=4 11524 B9R1.11 N[C@H](CO)C1CCOC1 Amb33420759 [0,1,0,1,0,0|2,0,0]=4 11525 B9R1.11 N[C@H](CO)C1CCSC1 Amb33141544 [0,1,0,1,0,0|2,0,0]=4 11526 B9R1.11 O=C(CO)C1CCCC1 Amb28194788 [0,1,0,1,0,0|1,0,1]=4 11527 B9R1.11 O=C(CO)N1CCCC1 Amb5798098 [0,1,0,1,0,0|1,0,1]=4 11528 B9R1.11 OC(CBr)C1CCCC1 Amb25889801 [0,1,0,1,0,0|2,0,0]=4 11529 B9R1.11 OC(CBr)C1CCCO1 Amb27956482 [0,1,0,1,0,0|2,0,0]=4 11530 B9R1.11 OC(CCl)C1CCCC1 Amb28140979 [0,1,0,1,0,0|2,0,0]=4 11531 B9R1.11 OC(CCl)C1CCCO1 Amb25118314 [0,1,0,1,0,0|2,0,0]=4 11532 B9R1.11 OC(CF)C1CCCC1 Amb27872595 [0,1,0,1,0,0|2,0,0]=4 11533 B9R1.11 OC(CF)C1CCCO1 Amb33318706 [0,1,0,1,0,0|2,0,0]=4 11534 B9R1.11 OCC(Cl)C1OCCO1 Amb17593816 [0,1,0,1,0,0|1,0,0]=3 11535 B9R1.11 OCC(F)=C1CCCC1 Amb27852389 [0,1,0,1,0,0|1,0,1]=4 11536 B9R1.11 OCC(O)C1=CCCC1 Amb28206820 [0,1,0,1,0,0|1,0,1]=4 11537 B9R1.11 OCC(O)C1CCCC1 Amb26463836 [0,1,0,1,0,0|1,0,0]=3 11538 B9R1.11 OCC(O)C1CCCO1 Amb26943467 [0,1,0,1,0,0|2,0,0]=4 11539 B9R1.11 OCC(O)C1CCCS1 Amb33415617 [0,1,0,1,0,0|2,0,0]=4 11540 B9R1.11 OCC(O)C1CCOC1 Amb24379358 [0,1,0,1,0,0|2,0,0]=4 11541 B9R1.11 OCC(O)C1CCSC1 Amb28078057 [0,1,0,1,0,0|2,0,0]=4 11542 B9R1.11 OCC(O)C1OCCO1 Amb17593408 [0,1,0,1,0,0|1,0,0]=3 11543 B9R1.11 OC[C@@H](O)C1OCCO1 Amb27396454 [0,1,0,1,0,0|1,0,0]=3 11544 B9R1.11 OC[C@H](O)C1CCCC1 Amb28049189 [0,1,0,1,0,0|1,0,0]=3 11545 B9R1.11 OC[C@H](O)[C@@H]1CCNC1 Amb27489715 [0,1,0,1,0,0|2,0,0]=4 11546 B9R1.11 O[C@@H](CCl)C1CCCC1 Amb28121560 [0,1,0,1,0,0|2,0,0]=4 11547 B9R1.21 CCC1=COC(CO)C1 Amb27660962 [0,1,0,1,0,0|0,0,2]=4 11548 B9R1.21 CCC1=NOC(CO)C1 Amb28340543 [0,1,0,1,0,0|1,0,1]=4 11549 B9R1.21 CCC1CC(CBr)CO1 Amb29883068 [0,1,0,1,0,0|2,0,0]=4 11550 B9R1.21 CCC1CC(CCl)CO1 Amb29883067 [0,1,0,1,0,0|2,0,0]=4 11551 B9R1.21 CCC1CC(CN)CO1 Amb35626392 [0,1,0,1,0,0|2,0,0]=4 11552 B9R1.21 CCC1CC(CO)CN1 Amb27621656 [0,1,0,1,0,0|2,0,0]=4 11553 B9R1.21 CCC1CC(CO)CO1 Amb29882990 [0,1,0,1,0,0|2,0,0]=4 11554 B9R1.21 CCC1CC(NC)CO1 Amb35734268 [0,1,0,1,0,0|2,0,0]=4 11555 B9R1.21 CCC1CCC(CBr)C1 Amb26006974 [0,1,0,1,0,0|2,0,0]=4 11556 B9R1.21 CCC1CCC(CC)N1 Amb26430315 [0,1,0,1,0,0|2,0,0]=4 11557 B9R1.21 CCC1CCC(CC)O1 Amb17672310 [0,1,0,1,0,0|2,0,0]=4 11558 B9R1.21 CCC1CCC(CN)C1 Amb27869330 [0,1,0,1,0,0|2,0,0]=4 11559 B9R1.21 CCC1CCC(CO)C1 Amb26929311 [0,1,0,1,0,0|1,0,0]=3 11560 B9R1.21 CCC1CNC(CO)C1 Amb27876349 [0,1,0,1,0,0|1,0,0]=3 11561 B9R1.21 CCC1COC(CBr)C1 Amb32660773 [0,1,0,1,0,0|1,0,0]=3 11562 B9R1.21 CCC1COC(CCl)O1 Amb27596702 [0,1,0,1,0,0|1,0,0]=3 11563 B9R1.21 CCC1COC(CI)C1 Amb32660826 [0,1,0,1,0,0|1,0,0]=3 11564 B9R1.21 CCC1COC(CN)C1 Amb32660887 [0,1,0,1,0,0|1,0,0]=3 11565 B9R1.21 CCC1COC(CO)C1 Amb28315434 [0,1,0,1,0,0|0,0,0]=2 11566 B9R1.21 CCC1NC(CO)CS1 Amb28071194 [0,1,0,1,0,0|2,0,0]=4 11567 B9R1.21 CCC1OCC(CCl)O1 Amb25141024 [0,1,0,1,0,0|2,0,0]=4 11568 B9R1.21 CCN1CCC(CO)C1 Amb5494202 [0,1,0,1,0,0|2,0,0]=4 11569 B9R1.21 CC[C@@H]1CC[C@@H](CCl)O1 Amb27879821 [0,1,0,1,0,0|2,0,0]=4 11570 B9R1.21 CC[C@@H]1CC[C@H](CO)N1 Amb27641256 [0,1,0,1,0,0|1,0,0]=3 11571 B9R1.21 CC[C@@H]1COC(CCl)=N1 Amb27401855 [0,1,0,1,0,0|1,0,1]=4 11572 B9R1.21 CC[C@@H]1OC[C@@H](CCl)O1 Amb27489073 [0,1,0,1,0,0|2,0,0]=4 11573 B9R1.21 CN[C@@H]1CN[C@@H](CO)C1 Amb28051812 [0,1,0,1,0,0|2,0,0]=4 11574 B9R1.21 COC1CCC(CO)O1 Amb27977932 [0,1,0,1,0,0|2,0,0]=4 11575 B9R1.21 COC1CC[C@@H](CO)O1 Amb27206011 [0,1,0,1,0,0|2,0,0]=4 11576 B9R1.21 COC1CNC(CO)C1 Amb26864113 [0,1,0,1,0,0|2,0,0]=4 11577 B9R1.21 COC1CNC(CO)C1 Amb32663020 [0,1,0,1,0,0|2,0,0]=4 11578 B9R1.21 COC1COC(CN)C1 Amb27257458 [0,1,0,1,0,0|2,0,0]=4 11579 B9R1.21 COC1CS[C@H](CO)O1 Amb26054390 [0,1,0,1,0,0|1,1,0]=4 11580 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Amb26528627 [0,1,0,1,0,0|2,0,0]=4 11581 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Amb32662679 [0,1,0,1,0,0|2,0,0]=4 11582 B9R1.21 CO[C@H]1CN[C@@H](CO)C1 Amb28057437 [0,1,0,1,0,0|2,0,0]=4 11583 B9R1.21 CO[C@H]1CN[C@H](CO)C1 Amb27436445 [0,1,0,1,0,0|2,0,0]=4 11584 B9R1.21 ClCC1CO[C@@H](CCl)O1 Amb27472039 [0,1,0,1,0,0|2,0,0]=4 11585 B9R1.21 ClCC1OCC(CBr)O1 Amb27759482 [0,1,0,1,0,0|2,0,0]=4 11586 B9R1.21 NCC1CC(CO)CO1 Amb33734449 [0,1,0,1,0,0|2,0,0]=4 11587 B9R1.21 NCC1CC(CO)CO1 Amb33742076 [0,1,0,1,0,0|2,0,0]=4 11588 B9R1.21 NCC1CCC(CO)C1 Amb27859685 [0,1,0,1,0,0|2,0,0]=4 11589 B9R1.21 NCC1CCC(CO)O1 Amb27796782 [0,1,0,1,0,0|2,0,0]=4 11590 B9R1.21 NC[C@@H]1CC[C@H](CO)O1 Amb26065766 [0,1,0,1,0,0|2,0,0]=4 11591 B9R1.21 NC[C@H]1CC[C@@H](CO)C1 Amb27631261 [0,1,0,1,0,0|2,0,0]=4 11592 B9R1.21 NC[C@H]1CC[C@@H](CO)O1 Amb25367672 [0,1,0,1,0,0|2,0,0]=4 11593 B9R1.21 OCC1CCC(CF)C1 Amb28435218 [0,1,0,1,0,0|2,0,0]=4 11594 B9R1.21 OCC1CCC(CO)C1 Amb27975602 [0,1,0,1,0,0|2,0,0]=4 11595 B9R1.21 OCC1CCC(CO)N1 Amb22728597 [0,1,0,1,0,0|2,0,0]=4 11596 B9R1.21 OCC1CCC(CO)N1 Amb32665489 [0,1,0,1,0,0|2,0,0]=4 11597 B9R1.21 OCC1CCC(CO)O1 Amb15691966 [0,1,0,1,0,0|2,0,0]=4 11598 B9R1.21 OCC1CCC(CO)S1 Amb5719225 [0,1,0,1,0,0|2,0,0]=4 11599 B9R1.21 OCC1CNC(CO)C1 Amb33042677 [0,1,0,1,0,0|2,0,0]=4 11600 B9R1.21 OCC1CNC(CO)C1 Amb33042748 [0,1,0,1,0,0|2,0,0]=4 11601 B9R1.21 OCC1COC(CI)C1 Amb33620384 [0,1,0,1,0,0|2,0,0]=4 11602 B9R1.21 OCC1COC(CI)O1 Amb25684134 [0,1,0,1,0,0|2,0,0]=4 11603 B9R1.21 OC[C@@H]1CC[C@@H](CO)C1 Amb28138723 [0,1,0,1,0,0|2,0,0]=4 11604 B9R1.21 OC[C@@H]1CC[C@@H](CO)N1 Amb24375528 [0,1,0,1,0,0|2,0,0]=4 11605 B9R1.21 OC[C@@H]1CC[C@@H](CO)N1 Amb32652831 [0,1,0,1,0,0|2,0,0]=4 11606 B9R1.21 OC[C@@H]1CC[C@H](CO)N1 Amb24117031 [0,1,0,1,0,0|2,0,0]=4 11607 B9R1.21 OC[C@@H]1CC[C@H](CO)O1 Amb8631495 [0,1,0,1,0,0|2,0,0]=4 11608 B9R1.21 OC[C@@H]1CO[C@@H](CBr)C1 Amb27777060 [0,1,0,1,0,0|2,0,0]=4 11609 B9R1.21 OC[C@@H]1CO[C@@H](CI)O1 Amb27409345 [0,1,0,1,0,0|2,0,0]=4 11610 B9R1.21 OC[C@@H]1CO[C@H](CCl)O1 Amb27422012 [0,1,0,1,0,0|2,0,0]=4 11611 B9R1.21 OC[C@@H]1CO[C@H](CI)O1 Amb26033660 [0,1,0,1,0,0|2,0,0]=4 11612 B9R1.21 OC[C@H]1CC[C@H](CO)N1 Amb24539840 [0,1,0,1,0,0|2,0,0]=4 11613 B9R1.21 OC[C@H]1CC[C@H](CO)N1 Amb28877924 [0,1,0,1,0,0|2,0,0]=4 11614 B9R1.21 OC[C@H]1CO[C@@H](CBr)C1 Amb27813955 [0,1,0,1,0,0|2,0,0]=4 11615 B9R1.21 OC[C@H]1CO[C@@H](CBr)O1 Amb27984854 [0,1,0,1,0,0|2,0,0]=4 11616 B9R1.60 CCC1(C)NN1CCO Amb27956642 [0,1,0,1,0,0|2,0,0]=4 11617 B9R1.60 CCCC1CC1(N)CC Amb27442943 [0,1,0,1,0,0|2,0,0]=4 11618 B9R1.60 CCC[C@@H]1O[C@]1(C)CO Amb27850456 [0,1,0,1,0,0|0,0,0]=2 11619 B9R1.76 CC1C(C)C1OCCO Amb27604270 [0,1,0,1,0,0|0,0,0]=2 11620 B9R1.76 C[C@@H]1[C@H](OCCCl)[C@@H]1C Amb28072452 [0,1,0,1,0,0|1,0,0]=3 11621 B9R1.78 CC(CO)NC1CC1C Amb27435850 [0,1,0,1,0,0|1,0,0]=3 11622 B9R1.78 CC1CC1CC(N)CO Amb33144903 [0,1,0,1,0,0|1,0,0]=3 11623 B9R1.78 CC1CC1CC(O)CN Amb33144859 [0,1,0,1,0,0|2,0,0]=4 11624 B9R1.78 C[C@@H]1C[C@H]1NC(=O)CO Amb27944646 [0,1,0,1,0,0|1,0,1]=4 11625 B9R1.79 CC(C#N)OC1CCC1 Amb27768768 [0,1,0,1,0,0|1,0,1]=4 11626 B9R1.79 CC(C=O)OC1CCC1 Amb30020607 [0,1,0,1,0,0|0,0,2]=4 11627 B9R1.79 CC(CBr)CC1CCC1 Amb27867129 [0,1,0,1,0,0|2,0,0]=4 11628 B9R1.79 CC(CF)NC1CCC1 Amb27829669 [0,1,0,1,0,0|2,0,0]=4 11629 B9R1.79 CC(CN)CC1CCC1 Amb26074727 [0,1,0,1,0,0|2,0,0]=4 11630 B9R1.79 CC(CN)CC1CCO1 Amb33736875 [0,1,0,1,0,0|2,0,0]=4 11631 B9R1.79 CC(CN)OC1CNC1 Amb28135758 [0,1,0,1,0,0|2,0,0]=4 11632 B9R1.79 CC(CN)OC1CSC1 Amb27440864 [0,1,0,1,0,0|2,0,0]=4 11633 B9R1.79 CC(CO)CC1CCC1 Amb24402725 [0,1,0,1,0,0|1,0,0]=3 11634 B9R1.79 CC(CO)CC1CCO1 Amb33740150 [0,1,0,1,0,0|2,0,0]=4 11635 B9R1.79 CC(CO)NC1CCC1 Amb18982439 [0,1,0,1,0,0|1,0,0]=3 11636 B9R1.79 CC(CO)NC1COC1 Amb28401588 [0,1,0,1,0,0|2,0,0]=4 11637 B9R1.79 CC(CO)OC1CCC1 Amb29878548 [0,1,0,1,0,0|0,0,0]=2 11638 B9R1.79 CC(CO)OC1CNC1 Amb27219580 [0,1,0,1,0,0|1,0,0]=3 11639 B9R1.79 CC(CO)OC1COC1 Amb29878573 [0,1,0,1,0,0|1,0,0]=3 11640 B9R1.79 CC(CO)SC1CCC1 Amb27964125 [0,1,0,1,0,0|0,1,0]=3 11641 B9R1.79 CCC(C)CC1CCN1 Amb27843783 [0,1,0,1,0,0|2,0,0]=4 11642 B9R1.79 CCC(C)OC1CNC1 Amb27655476 [0,1,0,1,0,0|2,0,0]=4 11643 B9R1.79 CCC(F)CN1CCC1 Amb28293777 [0,1,0,1,0,0|2,0,0]=4 11644 B9R1.79 CCC(O)CN1CCC1 Amb28255802 [0,1,0,1,0,0|2,0,0]=4 11645 B9R1.79 CC[C@@H](N)CN1CCC1 Amb27637451 [0,1,0,1,0,0|2,0,0]=4 11646 B9R1.79 CC[C@H](N)CN1CCC1 Amb27793891 [0,1,0,1,0,0|2,0,0]=4 11647 B9R1.79 C[C@@H](CN)CC1CCC1 Amb33728845 [0,1,0,1,0,0|2,0,0]=4 11648 B9R1.79 C[C@@H](CN)CC1CCO1 Amb33748937 [0,1,0,1,0,0|2,0,0]=4 11649 B9R1.79 C[C@@H](CO)CC1CCC1 Amb33743097 [0,1,0,1,0,0|1,0,0]=3 11650 B9R1.79 C[C@@H](CO)CC1CCO1 Amb33748029 [0,1,0,1,0,0|2,0,0]=4 11651 B9R1.79 C[C@@H](CO)NC1COC1 Amb28455230 [0,1,0,1,0,0|2,0,0]=4 11652 B9R1.79 C[C@@H](CO)NC1CSC1 Amb27837604 [0,1,0,1,0,0|2,0,0]=4 11653 B9R1.79 C[C@H](CN)CC1CCC1 Amb33726997 [0,1,0,1,0,0|2,0,0]=4 11654 B9R1.79 C[C@H](CN)CC1CCO1 Amb33728470 [0,1,0,1,0,0|2,0,0]=4 11655 B9R1.79 C[C@H](CO)CC1CCC1 Amb33738446 [0,1,0,1,0,0|1,0,0]=3 11656 B9R1.79 C[C@H](CO)CC1CCO1 Amb33730585 [0,1,0,1,0,0|2,0,0]=4 11657 B9R1.79 C[C@H](CO)NC1CSC1 Amb26323966 [0,1,0,1,0,0|2,0,0]=4 11658 B9R1.79 C\C(=C/C1CCC1)CO Amb27838424 [0,1,0,1,0,0|1,0,1]=4 11659 B9R1.79 NC(CO)CC1CCC1 Amb32660961 [0,1,0,1,0,0|1,0,0]=3 11660 B9R1.79 NC(CO)CC1CCC1 Amb33548648 [0,1,0,1,0,0|1,0,0]=3 11661 B9R1.79 NC(CO)CN1CCC1 Amb27849096 [0,1,0,1,0,0|2,0,0]=4 11662 B9R1.79 NCC(=O)OC1CCC1 Amb18295938 [0,1,0,1,0,0|1,0,1]=4 11663 B9R1.79 NCC(F)CC1CCC1 Amb31291552 [0,1,0,1,0,0|2,0,0]=4 11664 B9R1.79 NCC(O)CC1CCC1 Amb33195517 [0,1,0,1,0,0|2,0,0]=4 11665 B9R1.79 N[C@@H](CO)CC1CCC1 Amb28199933 [0,1,0,1,0,0|1,0,0]=3 11666 B9R1.79 N[C@H](CO)CC1CCC1 Amb26547301 [0,1,0,1,0,0|1,0,0]=3 11667 B9R1.79 O=C(CBr)OC1CCC1 Amb28146076 [0,1,0,1,0,0|1,0,1]=4 11668 B9R1.79 O=C(CO)OC1CCC1 Amb25802506 [0,1,0,1,0,0|0,0,1]=3 11669 B9R1.79 O=C(CS)OC1CCC1 Amb28381311 [0,1,0,1,0,0|0,1,1]=4 11670 B9R1.80 C=CC(C)OCC1CC1 Amb33512625 [0,1,0,1,0,0|1,0,1]=4 11671 B9R1.80 CC(C#N)OCC1CC1 Amb27462675 [0,1,0,1,0,0|1,0,1]=4 11672 B9R1.80 CC(CBr)CCC1CO1 Amb32688135 [0,1,0,1,0,0|2,0,0]=4 11673 B9R1.80 CC(CCl)CCC1CO1 Amb32688089 [0,1,0,1,0,0|2,0,0]=4 11674 B9R1.80 CC(CCl)SCC1CC1 Amb28248818 [0,1,0,1,0,0|1,1,0]=4 11675 B9R1.80 CC(CF)NCC1CC1 Amb27946915 [0,1,0,1,0,0|2,0,0]=4 11676 B9R1.80 CC(CN)CCC1CC1 Amb24481956 [0,1,0,1,0,0|2,0,0]=4 11677 B9R1.80 CC(CO)CCC1CC1 Amb33749212 [0,1,0,1,0,0|1,0,0]=3 11678 B9R1.80 CC(CO)CNC1CC1 Amb27164376 [0,1,0,1,0,0|2,0,0]=4 11679 B9R1.80 CC(CO)CSC1CC1 Amb27825875 [0,1,0,1,0,0|2,0,0]=4 11680 B9R1.80 CC(CO)NCC1CC1 Amb9423144 [0,1,0,1,0,0|1,0,0]=3 11681 B9R1.80 CCC(Br)CCC1CC1 Amb27448483 [0,1,0,1,0,0|2,0,0]=4 11682 B9R1.80 CCC(C)CNC1CC1 Amb32414501 [0,1,0,1,0,0|2,0,0]=4 11683 B9R1.80 CCC(C)NCC1CC1 Amb6686885 [0,1,0,1,0,0|2,0,0]=4 11684 B9R1.80 CCC(C)NCC1CO1 Amb27162537 [0,1,0,1,0,0|2,0,0]=4 11685 B9R1.80 CCC(C)OC[C@H]1CO1 Amb27956616 [0,1,0,1,0,0|2,0,0]=4 11686 B9R1.80 CCC(C)SCC1CO1 Amb6680857 [0,1,0,1,0,0|2,0,0]=4 11687 B9R1.80 CCC(C)SC[C@H]1CO1 Amb27801672 [0,1,0,1,0,0|2,0,0]=4 11688 B9R1.80 CCC(Cl)CCC1CC1 Amb27807280 [0,1,0,1,0,0|2,0,0]=4 11689 B9R1.80 CCC(N)CNC1CC1 Amb18303276 [0,1,0,1,0,0|2,0,0]=4 11690 B9R1.80 CCC(O)CNC1CC1 Amb18304015 [0,1,0,1,0,0|2,0,0]=4 11691 B9R1.80 CCS(=O)CCC1CO1 Amb27956481 [0,1,0,1,0,0|2,0,0]=4 11692 B9R1.80 CC[C@@H](N)CNC1CC1 Amb27657028 [0,1,0,1,0,0|2,0,0]=4 11693 B9R1.80 CC[C@H](O)CCC1CC1 Amb27192177 [0,1,0,1,0,0|2,0,0]=4 11694 B9R1.80 C[C@@H](CN)CCC1CC1 Amb33744963 [0,1,0,1,0,0|2,0,0]=4 11695 B9R1.80 C[C@@H](CO)CCC1CC1 Amb33747154 [0,1,0,1,0,0|1,0,0]=3 11696 B9R1.80 C[C@@H](CO)NCC1CC1 Amb27837614 [0,1,0,1,0,0|1,0,0]=3 11697 B9R1.80 C[C@H](CN)CCC1CC1 Amb33748019 [0,1,0,1,0,0|2,0,0]=4 11698 B9R1.80 C[C@H](CN)NCC1CC1 Amb27969764 [0,1,0,1,0,0|2,0,0]=4 11699 B9R1.80 C[C@H](CN)OCC1CC1 Amb27614284 [0,1,0,1,0,0|1,0,0]=3 11700 B9R1.80 C[C@H](CO)CCC1CC1 Amb33748163 [0,1,0,1,0,0|1,0,0]=3 11701 B9R1.80 FCC(Br)COC1CC1 Amb32863280 [0,1,0,1,0,0|2,0,0]=4 11702 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|1,0,0]=3 11703 B9R1.80 NCC(=O)OCC1CC1 Amb13952550 [0,1,0,1,0,0|1,0,1]=4 11704 B9R1.80 NCC(=O)OCC1CC1 Amb18305119 [0,1,0,1,0,0|1,0,1]=4 11705 B9R1.80 NCC(N)CCC1CC1 Amb27848173 [0,1,0,1,0,0|2,0,0]=4 11706 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|2,0,0]=4 11707 B9R1.80 O=C(CCl)OCC1CC1 Amb32416286 [0,1,0,1,0,0|1,0,1]=4 11708 B9R1.80 O=C(CO)OCC1CC1 Amb27806245 [0,1,0,1,0,0|0,0,1]=3 11709 B9R1.80 O=C(CS)OCC1CC1 Amb28457833 [0,1,0,1,0,0|0,1,1]=4 11710 B9R1.80 OCC(O)CCC1CC1 Amb27444259 [0,1,0,1,0,0|1,0,0]=3 11711 B9R1.80 OCC(O)CNC1CC1 Amb8854825 [0,1,0,1,0,0|2,0,0]=4 11712 B9R1.80 OCC(O)COC1CC1 Amb27467067 [0,1,0,1,0,0|2,0,0]=4 11713 B9R1.80 OCC(O)COC1CO1 Amb27261350 [0,1,0,1,0,0|1,0,0]=3 11714 B9R1.80 OCC(O)CSC1CC1 Amb27593987 [0,1,0,1,0,0|2,0,0]=4 11715 B9R1.81 CC(CN)N1CCC1C Amb28239635 [0,1,0,1,0,0|2,0,0]=4 11716 B9R1.81 CC(CO)C1CCN1C Amb27636243 [0,1,0,1,0,0|2,0,0]=4 11717 B9R1.81 CC(CO)N1CCC1C Amb28197280 [0,1,0,1,0,0|1,0,0]=3 11718 B9R1.81 CC1CCC1C(O)CN Amb33512108 [0,1,0,1,0,0|2,0,0]=4 11719 B9R1.81 CC1CCN1[C@H](C)CO Amb27447923 [0,1,0,1,0,0|1,0,0]=3 11720 B9R1.81 CCC(C)C1CCC1O Amb32945398 [0,1,0,1,0,0|1,0,0]=3 11721 B9R1.81 CCC(Cl)C1CCC1C Amb28201338 [0,1,0,1,0,0|2,0,0]=4 11722 B9R1.81 OC[C@H](O)[C@H]1NC[C@H]1O Amb27216406 [0,1,0,1,0,0|2,0,0]=4 11723 B9R1.88 C=C[C@H](C)[C@@H]1O[C@H]1CO Amb27853220 [0,1,0,1,0,0|0,0,2]=4 11724 B9R1.88 CCC(C)C1CC1CN Amb27837494 [0,1,0,1,0,0|2,0,0]=4 11725 B9R1.88 CCC(C)C1CC1CO Amb27838522 [0,1,0,1,0,0|1,0,0]=3 11726 B9R1.88 CCC(C)[C@@H]1C[C@H]1CN Amb33318465 [0,1,0,1,0,0|2,0,0]=4 11727 B9R1.88 CCC(O)C1CC1CO Amb27770342 [0,1,0,1,0,0|1,0,0]=3 11728 B9R1.88 CCC(O)C1OC1CC Amb27956541 [0,1,0,1,0,0|1,0,0]=3 11729 B9R1.88 CCC(O)[C@H]1C[C@H]1CO Amb27981681 [0,1,0,1,0,0|1,0,0]=3 11730 B9R1.88 CCN(C)C1CC1CO Amb27826274 [0,1,0,1,0,0|2,0,0]=4 11731 B9R1.88 COC(=O)[C@H]1O[C@@H]1CO Amb8628624 [0,1,0,1,0,0|1,0,1]=4 11732 B9R1.97 CCC1CCC1(C)CO Amb27947036 [0,1,0,1,0,0|1,0,0]=3 11733 B9R1.99 CC1(CCCCN)CC1 Amb32993716 [0,1,0,1,0,0|2,0,0]=4 11734 B9R1.99 CC1(CNCCF)CC1 Amb27857665 [0,1,0,1,0,0|2,0,0]=4 11735 B9R1.99 CC1(OCCCN)CC1 Amb33312235 [0,1,0,1,0,0|2,0,0]=4 11736 B9R1.99 CCCCCC1(C)CO1 Amb27760064 [0,1,0,1,0,0|1,0,0]=3 11737 B9R1.99 CCCCCC1(N)CC1 Amb24623686 [0,1,0,1,0,0|2,0,0]=4 11738 B9R1.99 CCCCCC1(O)CC1 Amb27218085 [0,1,0,1,0,0|2,0,0]=4 11739 B9R1.99 CCCCNC1(C)CC1 Amb27475801 [0,1,0,1,0,0|2,0,0]=4 11740 B9R1.99 CCCNCC1(N)CC1 Amb27847328 [0,1,0,1,0,0|2,0,0]=4 11741 B9R1.99 CCCSCC1(C)CO1 Amb28399684 [0,1,0,1,0,0|2,0,0]=4 11742 B9R1.99 CCC\C=C\C1(C)CO1 Amb33424825 [0,1,0,1,0,0|1,0,1]=4 11743 B9R1.99 COCCCC1(C)CO1 Amb27848205 [0,1,0,1,0,0|2,0,0]=4 11744 B9R1.99 NC1(CCCCF)CC1 Amb26924900 [0,1,0,1,0,0|2,0,0]=4 11745 B9R1.99 NC1(CCCCO)CC1 Amb27185968 [0,1,0,1,0,0|1,0,0]=3 11746 B9R1.99 NCCNCC1(O)CC1 Amb27847021 [0,1,0,1,0,0|2,0,0]=4 11747 B9R1.99 OC1(CCCCCl)CC1 Amb27838539 [0,1,0,1,0,0|2,0,0]=4 11748 B9R1.99 OC1(CCCCF)CC1 Amb33196075 [0,1,0,1,0,0|2,0,0]=4 11749 B9R1.99 OCCC#CC1(O)CC1 Amb28292196 [0,1,0,1,0,0|1,0,1]=4 11750 B9R1.118 CC1(C#N)CCCCO1 Amb24700167 [0,1,0,1,0,0|1,0,1]=4 11751 B9R1.118 CC1(C=O)CCCCO1 Amb24627620 [0,1,0,1,0,0|0,0,2]=4 11752 B9R1.118 CC1(CBr)CCCCC1 Amb8630706 [0,1,0,1,0,0|2,0,0]=4 11753 B9R1.118 CC1(CBr)CCCCO1 Amb25031393 [0,1,0,1,0,0|1,0,0]=3 11754 B9R1.118 CC1(CBr)CCCOC1 Amb25851591 [0,1,0,1,0,0|2,0,0]=4 11755 B9R1.118 CC1(CBr)COCCO1 Amb34925787 [0,1,0,1,0,0|1,0,0]=3 11756 B9R1.118 CC1(CCl)CCCCC1 Amb8630740 [0,1,0,1,0,0|2,0,0]=4 11757 B9R1.118 CC1(CCl)CCCCO1 Amb27402096 [0,1,0,1,0,0|1,0,0]=3 11758 B9R1.118 CC1(CCl)CCCOC1 Amb28292139 [0,1,0,1,0,0|2,0,0]=4 11759 B9R1.118 CC1(CF)CCCCN1 Amb28198878 [0,1,0,1,0,0|2,0,0]=4 11760 B9R1.118 CC1(CI)COCCO1 Amb32992312 [0,1,0,1,0,0|1,0,0]=3 11761 B9R1.118 CC1(CN)CCCCC1 Amb20632204 [0,1,0,1,0,0|2,0,0]=4 11762 B9R1.118 CC1(CN)CCCCC1 Amb8630346 [0,1,0,1,0,0|2,0,0]=4 11763 B9R1.118 CC1(CN)CCCCN1 Amb28251002 [0,1,0,1,0,0|2,0,0]=4 11764 B9R1.118 CC1(CN)CCCCO1 Amb27448256 [0,1,0,1,0,0|1,0,0]=3 11765 B9R1.118 CC1(CN)CCCOC1 Amb18949053 [0,1,0,1,0,0|2,0,0]=4 11766 B9R1.118 CC1(CN)COCCO1 Amb25174403 [0,1,0,1,0,0|1,0,0]=3 11767 B9R1.118 CC1(CN)COCCO1 Amb32645964 [0,1,0,1,0,0|1,0,0]=3 11768 B9R1.118 CC1(CN)OCCCO1 Amb17226712 [0,1,0,1,0,0|2,0,0]=4 11769 B9R1.118 CC1(CO)C=CCCC1 Amb28049165 [0,1,0,1,0,0|1,0,1]=4 11770 B9R1.118 CC1(CO)C=CCCO1 Amb28281863 [0,1,0,1,0,0|0,0,2]=4 11771 B9R1.118 CC1(CO)CCCCC1 Amb2694689 [0,1,0,1,0,0|1,0,0]=3 11772 B9R1.118 CC1(CO)CCCCN1 Amb19516855 [0,1,0,1,0,0|1,0,0]=3 11773 B9R1.118 CC1(CO)CCCCN1 Amb22587374 [0,1,0,1,0,0|1,0,0]=3 11774 B9R1.118 CC1(CO)CCCCO1 Amb24353049 [0,1,0,1,0,0|0,0,0]=2 11775 B9R1.118 CC1(CO)CCCNC1 Amb10607790 [0,1,0,1,0,0|2,0,0]=4 11776 B9R1.118 CC1(CO)CCCNC1 Amb22406108 [0,1,0,1,0,0|2,0,0]=4 11777 B9R1.118 CC1(CO)CCCOC1 Amb25325793 [0,1,0,1,0,0|2,0,0]=4 11778 B9R1.118 CC1(CO)CCNCC1 Amb33543968 [0,1,0,1,0,0|2,0,0]=4 11779 B9R1.118 CC1(CO)CCNCC1 Amb33552165 [0,1,0,1,0,0|2,0,0]=4 11780 B9R1.118 CC1(CO)CCOCC1 Amb33547495 [0,1,0,1,0,0|2,0,0]=4 11781 B9R1.118 CC1(CO)CCSCC1 Amb28324287 [0,1,0,1,0,0|2,0,0]=4 11782 B9R1.118 CC1(CO)CNCCN1 Amb28341264 [0,1,0,1,0,0|2,0,0]=4 11783 B9R1.118 CC1(CO)COCCN1 Amb25836752 [0,1,0,1,0,0|2,0,0]=4 11784 B9R1.118 CC1(CO)COCCN1 Amb32789691 [0,1,0,1,0,0|2,0,0]=4 11785 B9R1.118 CC1(CO)COCCO1 Amb33811879 [0,1,0,1,0,0|1,0,0]=3 11786 B9R1.118 CC1(CS)CCCCC1 Amb24572456 [0,1,0,1,0,0|1,1,0]=4 11787 B9R1.118 CC1(CS)CCCCO1 Amb32788202 [0,1,0,1,0,0|0,1,0]=3 11788 B9R1.118 CCC1(C)CCCCC1 Amb22227942 [0,1,0,1,0,0|2,0,0]=4 11789 B9R1.118 CCC1(C)CCCCN1 Amb26346096 [0,1,0,1,0,0|2,0,0]=4 11790 B9R1.118 CCC1(C)CCCNC1 Amb17622028 [0,1,0,1,0,0|2,0,0]=4 11791 B9R1.118 CCC1(C)CCCNC1 Amb22587423 [0,1,0,1,0,0|2,0,0]=4 11792 B9R1.118 CCC1(C)CNCCO1 Amb13953189 [0,1,0,1,0,0|1,0,0]=3 11793 B9R1.118 CCC1(C)COCCN1 Amb5781712 [0,1,0,1,0,0|1,0,0]=3 11794 B9R1.118 CCC1(Cl)CCCCC1 Amb4017937 [0,1,0,1,0,0|2,0,0]=4 11795 B9R1.118 CCC1(N)CCCCC1 Amb33552085 [0,1,0,1,0,0|2,0,0]=4 11796 B9R1.118 CCC1(N)CCCCC1 Amb9676113 [0,1,0,1,0,0|2,0,0]=4 11797 B9R1.118 CCC1(N)CCCOC1 Amb24524297 [0,1,0,1,0,0|1,0,0]=3 11798 B9R1.118 CCC1(O)CCCCC1 Amb1019962 [0,1,0,1,0,0|2,0,0]=4 11799 B9R1.118 CCC1(O)CCCNC1 Amb10607740 [0,1,0,1,0,0|2,0,0]=4 11800 B9R1.118 CCC1(O)CCCNC1 Amb22491665 [0,1,0,1,0,0|2,0,0]=4 11801 B9R1.118 CCC1(O)CCCOC1 Amb25872686 [0,1,0,1,0,0|1,0,0]=3 11802 B9R1.118 CCC1(O)CCCSC1 Amb29857708 [0,1,0,1,0,0|1,1,0]=4 11803 B9R1.118 CC[C@]1(C)CCCNC1 Amb22757832 [0,1,0,1,0,0|2,0,0]=4 11804 B9R1.118 CNC1(C)CCCCO1 Amb28424238 [0,1,0,1,0,0|2,0,0]=4 11805 B9R1.118 C[C@@]1(CO)C=CCCO1 Amb28315426 [0,1,0,1,0,0|0,0,2]=4 11806 B9R1.118 C[C@@]1(CO)CCCOC1 Amb27981643 [0,1,0,1,0,0|2,0,0]=4 11807 B9R1.118 FC1(CBr)CCCCC1 Amb26022122 [0,1,0,1,0,0|2,0,0]=4 11808 B9R1.118 NC1(CF)CCCCC1 Amb25951307 [0,1,0,1,0,0|2,0,0]=4 11809 B9R1.118 NC1(CF)CCCOC1 Amb28245490 [0,1,0,1,0,0|2,0,0]=4 11810 B9R1.118 NC1(CO)CCCCC1 Amb10608249 [0,1,0,1,0,0|1,0,0]=3 11811 B9R1.118 NC1(CO)CCCCC1 Amb8631827 [0,1,0,1,0,0|1,0,0]=3 11812 B9R1.118 NC1(CO)CCCOC1 Amb24476680 [0,1,0,1,0,0|2,0,0]=4 11813 B9R1.118 NC1(CO)CCNCC1 Amb18944649 [0,1,0,1,0,0|2,0,0]=4 11814 B9R1.118 NC1(CO)CCNCC1 Amb20623937 [0,1,0,1,0,0|2,0,0]=4 11815 B9R1.118 NC1(CO)CCOCC1 Amb23440142 [0,1,0,1,0,0|2,0,0]=4 11816 B9R1.118 NC1(CO)CCOCC1 Amb2683366 [0,1,0,1,0,0|2,0,0]=4 11817 B9R1.118 NC1(CO)CCSCC1 Amb2683367 [0,1,0,1,0,0|2,0,0]=4 11818 B9R1.118 NC1(CO)CCSCC1 Amb28934950 [0,1,0,1,0,0|2,0,0]=4 11819 B9R1.118 NCC1(Br)CCCCC1 Amb26994516 [0,1,0,1,0,0|2,0,0]=4 11820 B9R1.118 NCC1(Br)CCCCC1 Amb31217494 [0,1,0,1,0,0|2,0,0]=4 11821 B9R1.118 NCC1(Cl)CCCCC1 Amb26892840 [0,1,0,1,0,0|2,0,0]=4 11822 B9R1.118 NCC1(Cl)CCCCC1 Amb32651842 [0,1,0,1,0,0|2,0,0]=4 11823 B9R1.118 NCC1(F)CCCCC1 Amb22174148 [0,1,0,1,0,0|2,0,0]=4 11824 B9R1.118 NCC1(F)CCCCC1 Amb22887010 [0,1,0,1,0,0|2,0,0]=4 11825 B9R1.118 NCC1(N)CCCCC1 Amb2371826 [0,1,0,1,0,0|2,0,0]=4 11826 B9R1.118 NCC1(N)CCCCC1 Amb520873 [0,1,0,1,0,0|2,0,0]=4 11827 B9R1.118 NCC1(O)CCCCC1 Amb1108364 [0,1,0,1,0,0|2,0,0]=4 11828 B9R1.118 NCC1(O)CCCCC1 Amb2720241 [0,1,0,1,0,0|2,0,0]=4 11829 B9R1.118 NCC1(O)CCCCC1 Amb33513047 [0,1,0,1,0,0|2,0,0]=4 11830 B9R1.118 NCC1(O)CCCOC1 Amb25070087 [0,1,0,1,0,0|2,0,0]=4 11831 B9R1.118 NCC1(S)CCCCC1 Amb27842428 [0,1,0,1,0,0|2,0,0]=4 11832 B9R1.118 OC1(CBr)CCCCC1 Amb23597825 [0,1,0,1,0,0|2,0,0]=4 11833 B9R1.118 OC1(CI)CCCCC1 Amb27628298 [0,1,0,1,0,0|2,0,0]=4 11834 B9R1.118 OCC1(Cl)CCCCC1 Amb27804982 [0,1,0,1,0,0|1,0,0]=3 11835 B9R1.118 OCC1(Cl)CCCOC1 Amb27616460 [0,1,0,1,0,0|2,0,0]=4 11836 B9R1.118 OCC1(Cl)CCOCC1 Amb27404896 [0,1,0,1,0,0|2,0,0]=4 11837 B9R1.118 OCC1(F)CCCCC1 Amb10603424 [0,1,0,1,0,0|1,0,0]=3 11838 B9R1.118 OCC1(F)CCCNC1 Amb26429182 [0,1,0,1,0,0|2,0,0]=4 11839 B9R1.118 OCC1(F)CCCNC1 Amb30647438 [0,1,0,1,0,0|2,0,0]=4 11840 B9R1.118 OCC1(F)CCCOC1 Amb25953959 [0,1,0,1,0,0|2,0,0]=4 11841 B9R1.118 OCC1(F)CCNCC1 Amb22001985 [0,1,0,1,0,0|2,0,0]=4 11842 B9R1.118 OCC1(F)CCNCC1 Amb22234785 [0,1,0,1,0,0|2,0,0]=4 11843 B9R1.118 OCC1(F)CCOCC1 Amb22500945 [0,1,0,1,0,0|2,0,0]=4 11844 B9R1.118 OCC1(O)CCCCC1 Amb10552888 [0,1,0,1,0,0|1,0,0]=3 11845 B9R1.118 OCC1(O)CCCNC1 Amb19516807 [0,1,0,1,0,0|2,0,0]=4 11846 B9R1.118 OCC1(O)CCCNC1 Amb22406180 [0,1,0,1,0,0|2,0,0]=4 11847 B9R1.118 OCC1(O)CCNCC1 Amb15701357 [0,1,0,1,0,0|2,0,0]=4 11848 B9R1.118 OCC1(O)CCNCC1 Amb22405951 [0,1,0,1,0,0|2,0,0]=4 11849 B9R1.118 OCC1(O)CCOCC1 Amb24116825 [0,1,0,1,0,0|2,0,0]=4 11850 B9R1.118 OCC1(O)CCSCC1 Amb24116829 [0,1,0,1,0,0|2,0,0]=4 11851 B9R1.118 OCC1(S)CCCCC1 Amb25084707 [0,1,0,1,0,0|1,0,0]=3 11852 B9R1.132 C=CC1COC(C)C1O Amb27456549 [0,1,0,1,0,0|0,0,2]=4 11853 B9R1.132 C=C[C@@H]1CO[C@H](C)[C@H]1O Amb27261735 [0,1,0,1,0,0|0,0,2]=4 11854 B9R1.132 CC1C(=O)CNC1CO Amb27629033 [0,1,0,1,0,0|1,0,1]=4 11855 B9R1.132 CC1C(Br)=NOC1CO Amb27198105 [0,1,0,1,0,0|1,0,1]=4 11856 B9R1.132 CC1C(CO)CCN1C Amb32752568 [0,1,0,1,0,0|2,0,0]=4 11857 B9R1.132 CC1C(O)CCC1CN Amb25258217 [0,1,0,1,0,0|2,0,0]=4 11858 B9R1.132 CC1C(O)CCC1CN Amb33362355 [0,1,0,1,0,0|2,0,0]=4 11859 B9R1.132 CC1COC(CO)C1O Amb27482925 [0,1,0,1,0,0|1,0,0]=3 11860 B9R1.132 CC1NCC(CO)C1C Amb27403724 [0,1,0,1,0,0|2,0,0]=4 11861 B9R1.132 CC1OCC(CBr)C1C Amb35716482 [0,1,0,1,0,0|2,0,0]=4 11862 B9R1.132 CC1OCC(CCl)C1C Amb35716483 [0,1,0,1,0,0|2,0,0]=4 11863 B9R1.132 CC1OCC(CO)C1C Amb35732623 [0,1,0,1,0,0|2,0,0]=4 11864 B9R1.132 CCC1CCC(Cl)C1C Amb27656345 [0,1,0,1,0,0|2,0,0]=4 11865 B9R1.132 CCC1CCC(N)C1C Amb27654008 [0,1,0,1,0,0|2,0,0]=4 11866 B9R1.132 CCC1CNC(C)C1C Amb27949665 [0,1,0,1,0,0|2,0,0]=4 11867 B9R1.132 CCC1COC(=O)C1N Amb28285145 [0,1,0,1,0,0|1,0,1]=4 11868 B9R1.132 CCC1NCC(C)C1C Amb28056287 [0,1,0,1,0,0|2,0,0]=4 11869 B9R1.132 CC[C@@H]1COC(=O)[C@H]1N Amb28345688 [0,1,0,1,0,0|1,0,1]=4 11870 B9R1.132 CC[C@@H]1NC[C@@H](O)[C@H]1O Amb27621501 [0,1,0,1,0,0|2,0,0]=4 11871 B9R1.132 CC[C@@H]1OCC(O)[C@H]1N Amb27229240 [0,1,0,1,0,0|2,0,0]=4 11872 B9R1.132 CNC1COC(C)C1C Amb35719764 [0,1,0,1,0,0|2,0,0]=4 11873 B9R1.132 CN[C@@H]1CC[C@@H](O)[C@@H]1O Amb30530996 [0,1,0,1,0,0|2,0,0]=4 11874 B9R1.132 CO[C@@H]1CC[C@@H](N)[C@H]1O Amb30530997 [0,1,0,1,0,0|2,0,0]=4 11875 B9R1.132 CO[C@@H]1CC[C@H](Cl)[C@H]1O Amb27419907 [0,1,0,1,0,0|2,0,0]=4 11876 B9R1.132 CO[C@H]1COC(=O)[C@@H]1O Amb27432154 [0,1,0,1,0,0|1,0,1]=4 11877 B9R1.132 C[C@@H]1[C@H](CO)CCN1C Amb28722267 [0,1,0,1,0,0|2,0,0]=4 11878 B9R1.132 C[C@H]1CC[C@@H](CO)N1C Amb27421578 [0,1,0,1,0,0|2,0,0]=4 11879 B9R1.132 C[C@H]1[C@H](CO)CCN1C Amb27981620 [0,1,0,1,0,0|2,0,0]=4 11880 B9R1.132 NCC1OCC(O)C1O Amb27875806 [0,1,0,1,0,0|2,0,0]=4 11881 B9R1.132 NC[C@H]1OC[C@@H](O)[C@H]1O Amb27637680 [0,1,0,1,0,0|2,0,0]=4 11882 B9R1.132 N[C@H]1CO[C@@H](CO)[C@@H]1O Amb28365995 [0,1,0,1,0,0|1,0,0]=3 11883 B9R1.132 O=C1OCC(CO)C1O Amb27197070 [0,1,0,1,0,0|1,0,1]=4 11884 B9R1.132 OC1C(Cl)COC1CCl Amb28397323 [0,1,0,1,0,0|2,0,0]=4 11885 B9R1.132 OC1COC(CBr)C1O Amb28245798 [0,1,0,1,0,0|2,0,0]=4 11886 B9R1.132 OCC1NCC(O)C1O Amb25348005 [0,1,0,1,0,0|2,0,0]=4 11887 B9R1.132 OCC1NC[C@@H](O)[C@H]1O Amb27815201 [0,1,0,1,0,0|2,0,0]=4 11888 B9R1.132 OCC1OCC(O)C1O Amb26636536 [0,1,0,1,0,0|1,0,0]=3 11889 B9R1.132 OCC1SCC(O)C1O Amb26976977 [0,1,0,1,0,0|1,1,0]=4 11890 B9R1.132 OC[C@@H]1NC[C@@H](O)[C@@H]1O Amb27655914 [0,1,0,1,0,0|2,0,0]=4 11891 B9R1.132 OC[C@@H]1OC[C@@H](O)[C@@H]1O Amb22747091 [0,1,0,1,0,0|1,0,0]=3 11892 B9R1.132 OC[C@@H]1OC[C@@H](O)[C@H]1O Amb27788292 [0,1,0,1,0,0|1,0,0]=3 11893 B9R1.132 OC[C@@H]1SC[C@@H](O)[C@@H]1O Amb27186502 [0,1,0,1,0,0|1,1,0]=4 11894 B9R1.132 OC[C@H]1NC[C@@H](Cl)[C@@H]1O Amb27489135 [0,1,0,1,0,0|2,0,0]=4 11895 B9R1.132 OC[C@H]1NC[C@@H](O)C1O Amb28206172 [0,1,0,1,0,0|2,0,0]=4 11896 B9R1.132 OC[C@H]1NC[C@@H](O)[C@@H]1O Amb25231751 [0,1,0,1,0,0|2,0,0]=4 11897 B9R1.132 OC[C@H]1NC[C@H](O)[C@@H]1O Amb27851435 [0,1,0,1,0,0|2,0,0]=4 11898 B9R1.132 OC[C@H]1OCC(O)C1O Amb27624028 [0,1,0,1,0,0|1,0,0]=3 11899 B9R1.132 OC[C@H]1OC[C@H](O)[C@@H]1O Amb22233163 [0,1,0,1,0,0|1,0,0]=3 11900 B9R1.132 OC[C@H]1OC[C@H](O)[C@H]1O Amb24572863 [0,1,0,1,0,0|1,0,0]=3 11901 B9R1.132 OC[C@H]1SC[C@H](O)[C@@H]1O Amb28133423 [0,1,0,1,0,0|1,1,0]=4 11902 B9R1.135 CC1CC(CCN)C1C Amb27951859 [0,1,0,1,0,0|2,0,0]=4 11903 B9R1.202 CC1(CCl)CCCC1O Amb28254585 [0,1,0,1,0,0|2,0,0]=4 11904 B9R1.202 CC1(CN)CCCC1O Amb28241741 [0,1,0,1,0,0|2,0,0]=4 11905 B9R1.202 CC1(CO)CCCC1N Amb19337610 [0,1,0,1,0,0|2,0,0]=4 11906 B9R1.202 CC1(CO)COCC1N Amb24590914 [0,1,0,1,0,0|2,0,0]=4 11907 B9R1.202 CC1CCCC1(C)CN Amb24615536 [0,1,0,1,0,0|2,0,0]=4 11908 B9R1.202 CC1CCCC1(O)CN Amb25146157 [0,1,0,1,0,0|2,0,0]=4 11909 B9R1.202 CC1CNCC1(C)CO Amb27862293 [0,1,0,1,0,0|2,0,0]=4 11910 B9R1.202 CC1CNCC1(C)CO Amb32667607 [0,1,0,1,0,0|2,0,0]=4 11911 B9R1.202 CC1COCC1(N)CN Amb35612727 [0,1,0,1,0,0|2,0,0]=4 11912 B9R1.202 CC1COCC1(N)CO Amb35636179 [0,1,0,1,0,0|2,0,0]=4 11913 B9R1.202 CC1COCC1(O)CN Amb35635590 [0,1,0,1,0,0|2,0,0]=4 11914 B9R1.202 CC1COCC1(O)CO Amb35608147 [0,1,0,1,0,0|2,0,0]=4 11915 B9R1.202 CC1CSCC1(N)CO Amb27492811 [0,1,0,1,0,0|2,0,0]=4 11916 B9R1.202 CC1SCCC1(N)CO Amb27164786 [0,1,0,1,0,0|2,0,0]=4 11917 B9R1.202 CCC1(C)CCCC1N Amb33494054 [0,1,0,1,0,0|2,0,0]=4 11918 B9R1.202 CCC1(C)CCCC1O Amb27956477 [0,1,0,1,0,0|1,0,0]=3 11919 B9R1.202 CCC1(O)CCCC1C Amb24474369 [0,1,0,1,0,0|2,0,0]=4 11920 B9R1.202 CCC1(O)CCCC1N Amb25274889 [0,1,0,1,0,0|2,0,0]=4 11921 B9R1.202 CCC1(O)COCC1C Amb35608135 [0,1,0,1,0,0|1,0,0]=3 11922 B9R1.202 CCC1(O)CSCC1C Amb27666206 [0,1,0,1,0,0|1,1,0]=4 11923 B9R1.202 CC[C@]1(C)CCC[C@@H]1O Amb28138775 [0,1,0,1,0,0|1,0,0]=3 11924 B9R1.202 CC[C@]1(C)OCC[C@@H]1Cl Amb28385446 [0,1,0,1,0,0|2,0,0]=4 11925 B9R1.202 CC[C@]1(O)CCC[C@@H]1N Amb27627836 [0,1,0,1,0,0|2,0,0]=4 11926 B9R1.202 CC[C@]1(O)CCC[C@@H]1O Amb27255135 [0,1,0,1,0,0|1,0,0]=3 11927 B9R1.202 CO[C@]1(C)CCC[C@H]1O Amb27422354 [0,1,0,1,0,0|2,0,0]=4 11928 B9R1.202 C[C@@H]1CCC[C@]1(O)CO Amb27630888 [0,1,0,1,0,0|1,0,0]=3 11929 B9R1.202 C[C@@]1(CO)CCC[C@H]1N Amb33483675 [0,1,0,1,0,0|2,0,0]=4 11930 B9R1.202 C[C@H]1CNC[C@]1(C)CO Amb27221497 [0,1,0,1,0,0|2,0,0]=4 11931 B9R1.202 OCC1(F)CCCC1F Amb27187629 [0,1,0,1,0,0|2,0,0]=4 11932 B9R1.202 OCC1(F)CNCC1O Amb27792097 [0,1,0,1,0,0|2,0,0]=4 11933 B9R1.202 OCC1(O)OCCC1O Amb27207405 [0,1,0,1,0,0|1,0,0]=3 11934 B9R1.202 OC[C@@]1(O)OCC[C@@H]1O Amb27197975 [0,1,0,1,0,0|1,0,0]=3 11935 B9R1.202 OC[C@]1(O)OCC[C@H]1O Amb27879433 [0,1,0,1,0,0|1,0,0]=3 11936 B9R1.6 C=C(C)C1CNCCO1 Amb30036474 [0,1,0,1,0,0|1,0,1]=4 11937 B9R1.6 C=C(C)C1COCCN1 Amb33199954 [0,1,0,1,0,0|1,0,1]=4 11938 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [0,1,0,1,0,0|0,0,2]=4 11939 B9R1.6 CC(=O)C1CCCOC1 Amb26932950 [0,1,0,1,0,0|1,0,1]=4 11940 B9R1.6 CC(=O)C1CNCCO1 Amb25147230 [0,1,0,1,0,0|1,0,1]=4 11941 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,1,0,1,0,0|1,0,1]=4 11942 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,1,0,1,0,0|0,0,1]=3 11943 B9R1.6 CC(Br)C1CCCCC1 Amb9672122 [0,1,0,1,0,0|2,0,0]=4 11944 B9R1.6 CC(Br)C1OCCCO1 Amb25045267 [0,1,0,1,0,0|2,0,0]=4 11945 B9R1.6 CC(C)C1CCCCN1 Amb2235858 [0,1,0,1,0,0|2,0,0]=4 11946 B9R1.6 CC(C)C1CCCCN1 Amb2237211 [0,1,0,1,0,0|2,0,0]=4 11947 B9R1.6 CC(C)C1CCCNC1 Amb10607741 [0,1,0,1,0,0|2,0,0]=4 11948 B9R1.6 CC(C)C1CCCNC1 Amb29083221 [0,1,0,1,0,0|2,0,0]=4 11949 B9R1.6 CC(C)C1CNCCN1 Amb10068388 [0,1,0,1,0,0|2,0,0]=4 11950 B9R1.6 CC(C)C1CNCCN1 Amb20241001 [0,1,0,1,0,0|2,0,0]=4 11951 B9R1.6 CC(C)C1CNCCO1 Amb17470366 [0,1,0,1,0,0|1,0,0]=3 11952 B9R1.6 CC(C)C1CNCCO1 Amb33551370 [0,1,0,1,0,0|1,0,0]=3 11953 B9R1.6 CC(C)C1CNCCS1 Amb19149205 [0,1,0,1,0,0|1,1,0]=4 11954 B9R1.6 CC(C)C1COCCN1 Amb17231859 [0,1,0,1,0,0|1,0,0]=3 11955 B9R1.6 CC(C)C1NCCCO1 Amb17506193 [0,1,0,1,0,0|2,0,0]=4 11956 B9R1.6 CC(C)[C@@H]1CNCCN1 Amb15690738 [0,1,0,1,0,0|2,0,0]=4 11957 B9R1.6 CC(C)[C@@H]1CNCCN1 Amb8393308 [0,1,0,1,0,0|2,0,0]=4 11958 B9R1.6 CC(C)[C@@H]1CNCCO1 Amb20242065 [0,1,0,1,0,0|1,0,0]=3 11959 B9R1.6 CC(C)[C@@H]1COCCN1 Amb20242983 [0,1,0,1,0,0|1,0,0]=3 11960 B9R1.6 CC(C)[C@@H]1COCCN1 Amb22232226 [0,1,0,1,0,0|1,0,0]=3 11961 B9R1.6 CC(C)[C@@H]1CSCCN1 Amb25269723 [0,1,0,1,0,0|1,1,0]=4 11962 B9R1.6 CC(C)[C@H]1CNCCN1 Amb15690737 [0,1,0,1,0,0|2,0,0]=4 11963 B9R1.6 CC(C)[C@H]1CNCCN1 Amb22735784 [0,1,0,1,0,0|2,0,0]=4 11964 B9R1.6 CC(C)[C@H]1CNCCO1 Amb20241789 [0,1,0,1,0,0|1,0,0]=3 11965 B9R1.6 CC(C)[C@H]1COCCN1 Amb20242984 [0,1,0,1,0,0|1,0,0]=3 11966 B9R1.6 CC(C)[C@H]1COCCN1 Amb33622452 [0,1,0,1,0,0|1,0,0]=3 11967 B9R1.6 CC(F)C1COCCN1 Amb27180655 [0,1,0,1,0,0|1,0,0]=3 11968 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [0,1,0,1,0,0|2,0,0]=4 11969 B9R1.6 CC(N)C1CCCCC1 Amb9283568 [0,1,0,1,0,0|2,0,0]=4 11970 B9R1.6 CC(N)C1CCCCN1 Amb9901744 [0,1,0,1,0,0|2,0,0]=4 11971 B9R1.6 CC(N)C1CCCCO1 Amb27596555 [0,1,0,1,0,0|1,0,0]=3 11972 B9R1.6 CC(N)C1CCCCO1 Amb32666314 [0,1,0,1,0,0|1,0,0]=3 11973 B9R1.6 CC(N)C1CCCCS1 Amb27880783 [0,1,0,1,0,0|1,1,0]=4 11974 B9R1.6 CC(N)C1CCCNC1 Amb18832598 [0,1,0,1,0,0|2,0,0]=4 11975 B9R1.6 CC(N)C1CCCOC1 Amb18832549 [0,1,0,1,0,0|1,0,0]=3 11976 B9R1.6 CC(N)C1CCCOC1 Amb32789650 [0,1,0,1,0,0|1,0,0]=3 11977 B9R1.6 CC(N)C1CCCSC1 Amb18825995 [0,1,0,1,0,0|1,1,0]=4 11978 B9R1.6 CC(N)C1CNCCO1 Amb27391011 [0,1,0,1,0,0|1,0,0]=3 11979 B9R1.6 CC(N)C1COCCO1 Amb26977926 [0,1,0,1,0,0|0,0,0]=2 11980 B9R1.6 CC(N)C1COCCO1 Amb33803285 [0,1,0,1,0,0|0,0,0]=2 11981 B9R1.6 CC(N)C1OCCCO1 Amb33748303 [0,1,0,1,0,0|2,0,0]=4 11982 B9R1.6 CC(O)C1=CCCCC1 Amb25747240 [0,1,0,1,0,0|1,0,1]=4 11983 B9R1.6 CC(O)C1=CCCCO1 Amb25349292 [0,1,0,1,0,0|0,0,2]=4 11984 B9R1.6 CC(O)C1C=CCCC1 Amb22365214 [0,1,0,1,0,0|1,0,1]=4 11985 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [0,1,0,1,0,0|1,0,0]=3 11986 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,1,0,1,0,0|1,0,0]=3 11987 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|0,0,0]=2 11988 B9R1.6 CC(O)C1CCCNC1 Amb17593363 [0,1,0,1,0,0|2,0,0]=4 11989 B9R1.6 CC(O)C1CCCNC1 Amb32412170 [0,1,0,1,0,0|2,0,0]=4 11990 B9R1.6 CC(O)C1CCNCC1 Amb21955698 [0,1,0,1,0,0|2,0,0]=4 11991 B9R1.6 CC(O)C1CCNCC1 Amb22587101 [0,1,0,1,0,0|2,0,0]=4 11992 B9R1.6 CC(O)C1CCNCC1 Amb22899459 [0,1,0,1,0,0|2,0,0]=4 11993 B9R1.6 CC(O)C1CCNCC1 Amb9173665 [0,1,0,1,0,0|2,0,0]=4 11994 B9R1.6 CC(O)C1CCOCC1 Amb20667854 [0,1,0,1,0,0|2,0,0]=4 11995 B9R1.6 CC(O)C1CCSCC1 Amb35698333 [0,1,0,1,0,0|2,0,0]=4 11996 B9R1.6 CC(O)C1CNCCO1 Amb27175311 [0,1,0,1,0,0|1,0,0]=3 11997 B9R1.6 CC(O)C1CNCCS1 Amb35599592 [0,1,0,1,0,0|1,1,0]=4 11998 B9R1.6 CC(O)C1COCCN1 Amb35740516 [0,1,0,1,0,0|1,0,0]=3 11999 B9R1.6 CC(O)C1COCCO1 Amb27423368 [0,1,0,1,0,0|0,0,0]=2 12000 B9R1.6 CC(O)C1CSCCN1 Amb35583306 [0,1,0,1,0,0|1,1,0]=4 12001 B9R1.6 CC(O)C1CSCCO1 Amb27838575 [0,1,0,1,0,0|0,1,0]=3 12002 B9R1.6 CC(O)C1OCCCS1 Amb27589005 [0,1,0,1,0,0|1,0,0]=3 12003 B9R1.6 CC(O)[C@@H]1CCCCN1 Amb35737461 [0,1,0,1,0,0|1,0,0]=3 12004 B9R1.6 CC(O)[C@@H]1CCCNC1 Amb35588431 [0,1,0,1,0,0|2,0,0]=4 12005 B9R1.6 CC(O)[C@H]1CCCCN1 Amb35617462 [0,1,0,1,0,0|1,0,0]=3 12006 B9R1.6 CC(O)[C@H]1CCCNC1 Amb35617453 [0,1,0,1,0,0|2,0,0]=4 12007 B9R1.6 CC(S)C1CCCCC1 Amb9672127 [0,1,0,1,0,0|1,1,0]=4 12008 B9R1.6 CC(S)C1CCCCN1 Amb25707556 [0,1,0,1,0,0|1,1,0]=4 12009 B9R1.6 CC(S)C1CCCCO1 Amb32788899 [0,1,0,1,0,0|0,1,0]=3 12010 B9R1.6 CC(S)C1CCCNC1 Amb32788620 [0,1,0,1,0,0|2,0,0]=4 12011 B9R1.6 CC(S)C1CCCSC1 Amb32788181 [0,1,0,1,0,0|1,1,0]=4 12012 B9R1.6 CC(S)C1CNCCO1 Amb32788671 [0,1,0,1,0,0|1,0,0]=3 12013 B9R1.6 CN(C)C1CCCCO1 Amb22523025 [0,1,0,1,0,0|2,0,0]=4 12014 B9R1.6 CN(C)C1COCCO1 Amb28055752 [0,1,0,1,0,0|1,0,0]=3 12015 B9R1.6 CN(N)C1CCCOC1 Amb35713974 [0,1,0,1,0,0|2,0,0]=4 12016 B9R1.6 C[C@@H](N)C1CCCCC1 Amb3940038 [0,1,0,1,0,0|2,0,0]=4 12017 B9R1.6 C[C@@H](N)C1CCCCO1 Amb26000516 [0,1,0,1,0,0|1,0,0]=3 12018 B9R1.6 C[C@@H](N)C1CCCCO1 Amb31291420 [0,1,0,1,0,0|1,0,0]=3 12019 B9R1.6 C[C@@H](N)C1CCCCS1 Amb27174884 [0,1,0,1,0,0|1,1,0]=4 12020 B9R1.6 C[C@@H](N)C1CCCOC1 Amb25705770 [0,1,0,1,0,0|1,0,0]=3 12021 B9R1.6 C[C@@H](N)C1CCCSC1 Amb32726293 [0,1,0,1,0,0|1,1,0]=4 12022 B9R1.6 C[C@@H](N)C1OCCCO1 Amb33743259 [0,1,0,1,0,0|2,0,0]=4 12023 B9R1.6 C[C@@H](O)C1CCCCO1 Amb33375690 [0,1,0,1,0,0|0,0,0]=2 12024 B9R1.6 C[C@@H](O)C1CCCOC1 Amb26634197 [0,1,0,1,0,0|1,0,0]=3 12025 B9R1.6 C[C@@H](O)C1CCCSC1 Amb32726246 [0,1,0,1,0,0|1,1,0]=4 12026 B9R1.6 C[C@@H](O)C1CCNCC1 Amb27392755 [0,1,0,1,0,0|2,0,0]=4 12027 B9R1.6 C[C@@H](O)C1CCNCC1 Amb32671192 [0,1,0,1,0,0|2,0,0]=4 12028 B9R1.6 C[C@@H](O)C1CCOCC1 Amb25121022 [0,1,0,1,0,0|2,0,0]=4 12029 B9R1.6 C[C@@H](O)C1CNCCO1 Amb33329921 [0,1,0,1,0,0|1,0,0]=3 12030 B9R1.6 C[C@@H](O)C1CNCCO1 Amb33329922 [0,1,0,1,0,0|1,0,0]=3 12031 B9R1.6 C[C@@H](O)C1OCCCO1 Amb27396190 [0,1,0,1,0,0|1,0,0]=3 12032 B9R1.6 C[C@@H](O)C1SCCCS1 Amb28072973 [0,1,0,1,0,0|1,1,0]=4 12033 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 Amb30633889 [0,1,0,1,0,0|2,0,0]=4 12034 B9R1.6 C[C@H](N)C1CCCCC1 Amb3939178 [0,1,0,1,0,0|2,0,0]=4 12035 B9R1.6 C[C@H](N)C1CCCCO1 Amb33171840 [0,1,0,1,0,0|1,0,0]=3 12036 B9R1.6 C[C@H](N)C1CCCOC1 Amb25147114 [0,1,0,1,0,0|1,0,0]=3 12037 B9R1.6 C[C@H](N)C1CCCSC1 Amb32726275 [0,1,0,1,0,0|1,1,0]=4 12038 B9R1.6 C[C@H](N)C1OCCCO1 Amb33745262 [0,1,0,1,0,0|2,0,0]=4 12039 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [0,1,0,1,0,0|1,0,0]=3 12040 B9R1.6 C[C@H](O)C1CCCCO1 Amb33375689 [0,1,0,1,0,0|0,0,0]=2 12041 B9R1.6 C[C@H](O)C1CCCOC1 Amb26324174 [0,1,0,1,0,0|1,0,0]=3 12042 B9R1.6 C[C@H](O)C1CCCSC1 Amb32726302 [0,1,0,1,0,0|1,1,0]=4 12043 B9R1.6 C[C@H](O)C1CCNCC1 Amb25951129 [0,1,0,1,0,0|2,0,0]=4 12044 B9R1.6 C[C@H](O)C1CCNCC1 Amb32671190 [0,1,0,1,0,0|2,0,0]=4 12045 B9R1.6 C[C@H](O)C1CCOCC1 Amb25077475 [0,1,0,1,0,0|2,0,0]=4 12046 B9R1.6 C[C@H](O)C1CNCCO1 Amb33329958 [0,1,0,1,0,0|1,0,0]=3 12047 B9R1.6 C[C@H](O)C1CNCCO1 Amb33329959 [0,1,0,1,0,0|1,0,0]=3 12048 B9R1.6 ClC(Cl)C1COCCO1 Amb27858770 [0,1,0,1,0,0|1,0,0]=3 12049 B9R1.6 FC(F)C1CCCCN1 Amb23585655 [0,1,0,1,0,0|2,0,0]=4 12050 B9R1.6 FC(F)C1CCCCN1 Amb28895948 [0,1,0,1,0,0|2,0,0]=4 12051 B9R1.6 FC(F)C1CNCCO1 Amb24382465 [0,1,0,1,0,0|2,0,0]=4 12052 B9R1.6 FC(F)C1CNCCO1 Amb32674704 [0,1,0,1,0,0|2,0,0]=4 12053 B9R1.6 FC(F)C1COCCN1 Amb26014429 [0,1,0,1,0,0|2,0,0]=4 12054 B9R1.6 FC(F)[C@@H]1COCCN1 Amb28184715 [0,1,0,1,0,0|2,0,0]=4 12055 B9R1.6 N=C(N)C1CCCCO1 Amb25212338 [0,1,0,1,0,0|1,0,1]=4 12056 B9R1.6 NC(=S)C1CCCCO1 Amb33377342 [0,1,0,1,0,0|0,1,1]=4 12057 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [0,1,0,1,0,0|0,0,2]=4 12058 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [0,1,0,1,0,0|0,0,2]=4 12059 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [0,1,0,1,0,0|1,0,1]=4 12060 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [0,1,0,1,0,0|1,0,1]=4 12061 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [0,1,0,1,0,0|1,0,1]=4 12062 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [0,1,0,1,0,0|0,0,1]=3 12063 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [0,1,0,1,0,0|0,1,1]=4 12064 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [0,1,0,1,0,0|1,0,1]=4 12065 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [0,1,0,1,0,0|1,0,1]=4 12066 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [0,1,0,1,0,0|1,0,1]=4 12067 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [0,1,0,1,0,0|1,0,1]=4 12068 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [0,1,0,1,0,0|1,0,1]=4 12069 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [0,1,0,1,0,0|1,0,1]=4 12070 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [0,1,0,1,0,0|1,0,1]=4 12071 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [0,1,0,1,0,0|0,0,1]=3 12072 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [0,1,0,1,0,0|1,0,1]=4 12073 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [0,1,0,1,0,0|1,0,1]=4 12074 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [0,1,0,1,0,0|1,0,1]=4 12075 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [0,1,0,1,0,0|1,0,1]=4 12076 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [0,1,0,1,0,0|1,0,1]=4 12077 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [0,1,0,1,0,0|0,0,1]=3 12078 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [0,1,0,1,0,0|1,0,1]=4 12079 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [0,1,0,1,0,0|1,0,1]=4 12080 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [0,1,0,1,0,0|1,0,1]=4 12081 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [0,1,0,1,0,0|2,0,0]=4 12082 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [0,1,0,1,0,0|2,0,0]=4 12083 B9R1.6 OB(O)C1CCCCC1 Amb1630358 [0,1,0,1,0,0|2,0,0]=4 12084 B9R1.6 OB(O)C1CNCCO1 Amb24314284 [0,1,0,1,0,0|2,0,0]=4 12085 B9R1.6 OB(O)C1COCCO1 Amb24314285 [0,1,0,1,0,0|2,0,0]=4 12086 B9R1.6 [O-]C(=S)C1CCCCO1 Amb27262534 [0,1,0,1,0,0|0,0,2]=4 12087 B9R1.13 C=C(C)CC1CCCO1 Amb29857297 [0,1,0,1,0,0|1,0,1]=4 12088 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [0,1,0,1,0,0|1,0,1]=4 12089 B9R1.13 CC(=O)CC1OCCO1 Amb22359800 [0,1,0,1,0,0|0,0,1]=3 12090 B9R1.13 CC(Br)CB1OCCO1 Amb28436913 [0,1,0,1,0,0|1,0,0]=3 12091 B9R1.13 CC(Br)CC1CCCC1 Amb24693833 [0,1,0,1,0,0|2,0,0]=4 12092 B9R1.13 CC(Br)CC1CCCO1 Amb29857136 [0,1,0,1,0,0|1,0,0]=3 12093 B9R1.13 CC(Br)CC1CCCS1 Amb33433064 [0,1,0,1,0,0|1,1,0]=4 12094 B9R1.13 CC(Br)CC1OCCO1 Amb17336914 [0,1,0,1,0,0|0,0,0]=2 12095 B9R1.13 CC(C)=CC1OCCO1 Amb24668230 [0,1,0,1,0,0|0,0,2]=4 12096 B9R1.13 CC(C)CC1CCCC1 Amb22230763 [0,1,0,1,0,0|2,0,0]=4 12097 B9R1.13 CC(C)CC1CCCN1 Amb10068751 [0,1,0,1,0,0|2,0,0]=4 12098 B9R1.13 CC(C)CC1CCCN1 Amb17659147 [0,1,0,1,0,0|2,0,0]=4 12099 B9R1.13 CC(C)CC1NCCO1 Amb17506169 [0,1,0,1,0,0|1,0,0]=3 12100 B9R1.13 CC(C)CC1OCCO1 Amb27624315 [0,1,0,1,0,0|0,0,0]=2 12101 B9R1.13 CC(C)CN1CCCC1 Amb17231850 [0,1,0,1,0,0|2,0,0]=4 12102 B9R1.13 CC(C)C[C@@H]1CCCN1 Amb25338158 [0,1,0,1,0,0|2,0,0]=4 12103 B9R1.13 CC(C)C[C@H]1CCCN1 Amb25757364 [0,1,0,1,0,0|2,0,0]=4 12104 B9R1.13 CC(Cl)CC1CCCO1 Amb29857074 [0,1,0,1,0,0|1,0,0]=3 12105 B9R1.13 CC(Cl)CN1CCCC1 Amb27165761 [0,1,0,1,0,0|2,0,0]=4 12106 B9R1.13 CC(N)CC1=NCCO1 Amb27438596 [0,1,0,1,0,0|1,0,1]=4 12107 B9R1.13 CC(N)CC1CCCC1 Amb18962767 [0,1,0,1,0,0|2,0,0]=4 12108 B9R1.13 CC(N)CC1CCCO1 Amb13952622 [0,1,0,1,0,0|1,0,0]=3 12109 B9R1.13 CC(N)CC1OCCO1 Amb17334127 [0,1,0,1,0,0|0,0,0]=2 12110 B9R1.13 CC(N)CC1OCCO1 Amb33141020 [0,1,0,1,0,0|0,0,0]=2 12111 B9R1.13 CC(N)CN1CCCC1 Amb33801437 [0,1,0,1,0,0|2,0,0]=4 12112 B9R1.13 CC(N)CN1CCCC1 Amb9710549 [0,1,0,1,0,0|2,0,0]=4 12113 B9R1.13 CC(N)CN1CCCO1 Amb28188827 [0,1,0,1,0,0|2,0,0]=4 12114 B9R1.13 CC(O)CC1=CCCC1 Amb28345352 [0,1,0,1,0,0|1,0,1]=4 12115 B9R1.13 CC(O)CC1=NCCC1 Amb27244692 [0,1,0,1,0,0|2,0,0]=4 12116 B9R1.13 CC(O)CC1C=CCO1 Amb27191727 [0,1,0,1,0,0|1,0,1]=4 12117 B9R1.13 CC(O)CC1CCCC1 Amb26484484 [0,1,0,1,0,0|1,0,0]=3 12118 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|2,0,0]=4 12119 B9R1.13 CC(O)CC1CCCO1 Amb27979742 [0,1,0,1,0,0|1,0,0]=3 12120 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|1,1,0]=4 12121 B9R1.13 CC(O)CC1CCNC1 Amb27258166 [0,1,0,1,0,0|2,0,0]=4 12122 B9R1.13 CC(O)CC1CCOC1 Amb25888927 [0,1,0,1,0,0|2,0,0]=4 12123 B9R1.13 CC(O)CC1CCSC1 Amb33345807 [0,1,0,1,0,0|2,0,0]=4 12124 B9R1.13 CC(O)CN1CCCC1 Amb32665261 [0,1,0,1,0,0|1,0,0]=3 12125 B9R1.13 CC(O)CN1CCCC1 Amb4017595 [0,1,0,1,0,0|1,0,0]=3 12126 B9R1.13 CC(S)CC1CCCC1 Amb29857286 [0,1,0,1,0,0|1,1,0]=4 12127 B9R1.13 CC(S)CC1CCCN1 Amb32788357 [0,1,0,1,0,0|2,0,0]=4 12128 B9R1.13 CC(S)CC1CCCO1 Amb29857287 [0,1,0,1,0,0|1,0,0]=3 12129 B9R1.13 CN(C)CC1CCCO1 Amb25075157 [0,1,0,1,0,0|2,0,0]=4 12130 B9R1.13 CN(O)CC1CCCC1 Amb33378902 [0,1,0,1,0,0|2,0,0]=4 12131 B9R1.13 CN(O)CC1CCCO1 Amb33318754 [0,1,0,1,0,0|2,0,0]=4 12132 B9R1.13 C[C@@H](N)CC1CCCC1 Amb28423841 [0,1,0,1,0,0|2,0,0]=4 12133 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|1,0,0]=3 12134 B9R1.13 C[C@@H](N)CC1CCCS1 Amb33416796 [0,1,0,1,0,0|1,1,0]=4 12135 B9R1.13 C[C@@H](N)CN1CCCC1 Amb25921110 [0,1,0,1,0,0|2,0,0]=4 12136 B9R1.13 C[C@@H](O)CC1=CCCC1 Amb28315475 [0,1,0,1,0,0|1,0,1]=4 12137 B9R1.13 C[C@@H](O)CC1CCCC1 Amb33315749 [0,1,0,1,0,0|1,0,0]=3 12138 B9R1.13 C[C@@H](O)CC1CCCO1 Amb33318696 [0,1,0,1,0,0|1,0,0]=3 12139 B9R1.13 C[C@@H](O)CC1CCCS1 Amb33415844 [0,1,0,1,0,0|1,1,0]=4 12140 B9R1.13 C[C@@H](O)CC1CCOC1 Amb33420739 [0,1,0,1,0,0|2,0,0]=4 12141 B9R1.13 C[C@@H](O)CC1CCSC1 Amb33141518 [0,1,0,1,0,0|2,0,0]=4 12142 B9R1.13 C[C@@H](O)CC1SCCS1 Amb28049093 [0,1,0,1,0,0|0,2,0]=4 12143 B9R1.13 C[C@@H](O)CN1CCCC1 Amb26069529 [0,1,0,1,0,0|1,0,0]=3 12144 B9R1.13 C[C@@H](O)CN1CCCN1 Amb28060242 [0,1,0,1,0,0|2,0,0]=4 12145 B9R1.13 C[C@@H](O)C[C@@H]1C=CCO1 Amb28346422 [0,1,0,1,0,0|1,0,1]=4 12146 B9R1.13 C[C@@H](O)C[C@@H]1CCCO1 Amb27196849 [0,1,0,1,0,0|1,0,0]=3 12147 B9R1.13 C[C@H](N)CC1CCCC1 Amb27949784 [0,1,0,1,0,0|2,0,0]=4 12148 B9R1.13 C[C@H](N)CC1CCCO1 Amb27804405 [0,1,0,1,0,0|1,0,0]=3 12149 B9R1.13 C[C@H](N)CC1CCCS1 Amb33416790 [0,1,0,1,0,0|1,1,0]=4 12150 B9R1.13 C[C@H](N)CN1CCCC1 Amb27867537 [0,1,0,1,0,0|2,0,0]=4 12151 B9R1.13 C[C@H](O)CC1CCCC1 Amb33315750 [0,1,0,1,0,0|1,0,0]=3 12152 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|1,0,0]=3 12153 B9R1.13 C[C@H](O)CC1CCCS1 Amb33415845 [0,1,0,1,0,0|1,1,0]=4 12154 B9R1.13 C[C@H](O)CC1CCOC1 Amb33420740 [0,1,0,1,0,0|2,0,0]=4 12155 B9R1.13 C[C@H](O)CC1CCSC1 Amb33141519 [0,1,0,1,0,0|2,0,0]=4 12156 B9R1.13 C[C@H](O)CN1CCCC1 Amb26477879 [0,1,0,1,0,0|1,0,0]=3 12157 B9R1.13 C[C@H](O)CN1CCCN1 Amb27202924 [0,1,0,1,0,0|2,0,0]=4 12158 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [0,1,0,1,0,0|2,0,0]=4 12159 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [0,1,0,1,0,0|2,0,0]=4 12160 B9R1.13 C[C@H](O)C[C@H]1CCCO1 Amb28206139 [0,1,0,1,0,0|1,0,0]=3 12161 B9R1.13 C\C(Br)=C\C1OCCO1 Amb30621793 [0,1,0,1,0,0|0,0,2]=4 12162 B9R1.13 NC(=O)CC1OCCO1 Amb27837657 [0,1,0,1,0,0|1,0,1]=4 12163 B9R1.13 O=C(O)CC1CCCC1 Amb16192937 [0,1,0,1,0,0|1,0,1]=4 12164 B9R1.13 O=C(O)CC1CCCC1 Amb3939847 [0,1,0,1,0,0|1,0,1]=4 12165 B9R1.13 O=C(O)CC1OCCO1 Amb22740193 [0,1,0,1,0,0|1,0,1]=4 12166 B9R1.13 O=C(O)CN1CCCC1 Amb535912 [0,1,0,1,0,0|1,0,1]=4 12167 B9R1.13 O=C(O)CN1CCCC1 Amb9677391 [0,1,0,1,0,0|1,0,1]=4 12168 B9R1.13 OB(O)CC1CCCC1 Amb25320686 [0,1,0,1,0,0|2,0,0]=4 12169 B9R1.13 OB(O)CN1CCCC1 Amb28188370 [0,1,0,1,0,0|2,0,0]=4 12170 B9R1.24 CC1(C)CCCC1CBr Amb28347469 [0,1,0,1,0,0|2,0,0]=4 12171 B9R1.24 CC1(C)CCCC1CCl Amb25934181 [0,1,0,1,0,0|2,0,0]=4 12172 B9R1.24 CC1(C)CCCC1CN Amb8496596 [0,1,0,1,0,0|2,0,0]=4 12173 B9R1.24 CC1(C)CCCC1CO Amb25698070 [0,1,0,1,0,0|1,0,0]=3 12174 B9R1.24 CC1(C)CCOC1C=O Amb21961947 [0,1,0,1,0,0|0,0,2]=4 12175 B9R1.24 CC1(C)CCOC1CI Amb33277128 [0,1,0,1,0,0|1,0,0]=3 12176 B9R1.24 CC1(C)CCOC1CN Amb33276867 [0,1,0,1,0,0|1,0,0]=3 12177 B9R1.24 CC1(C)NCCC1CO Amb31260961 [0,1,0,1,0,0|2,0,0]=4 12178 B9R1.24 CC1(C)OCCC1CO Amb25823110 [0,1,0,1,0,0|2,0,0]=4 12179 B9R1.24 CC1(C)SCCC1CO Amb27978375 [0,1,0,1,0,0|2,0,0]=4 12180 B9R1.24 CC1(F)CCCC1CN Amb28326209 [0,1,0,1,0,0|2,0,0]=4 12181 B9R1.24 CC1(O)CCCC1CO Amb28315472 [0,1,0,1,0,0|1,0,0]=3 12182 B9R1.24 CCC1CCCC1(C)N Amb32654937 [0,1,0,1,0,0|2,0,0]=4 12183 B9R1.24 CCC1CCCC1(C)N Amb32676685 [0,1,0,1,0,0|2,0,0]=4 12184 B9R1.24 CCC1CCCC1(F)F Amb32654528 [0,1,0,1,0,0|2,0,0]=4 12185 B9R1.24 CCC1CNCC1(C)O Amb18642714 [0,1,0,1,0,0|1,0,0]=3 12186 B9R1.24 CCC1COCC1(C)O Amb35612446 [0,1,0,1,0,0|0,0,0]=2 12187 B9R1.24 CNC1COCC1(C)C Amb27944431 [0,1,0,1,0,0|2,0,0]=4 12188 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [0,1,0,1,0,0|1,0,0]=3 12189 B9R1.24 C[C@@]1(N)CCC[C@H]1CO Amb28055666 [0,1,0,1,0,0|1,0,0]=3 12190 B9R1.24 C[C@]1(N)CCC[C@H]1CO Amb1993801 [0,1,0,1,0,0|1,0,0]=3 12191 B9R1.24 NCC1COCC1(F)F Amb27797786 [0,1,0,1,0,0|2,0,0]=4 12192 B9R1.24 OCC1CCCC1(F)F Amb25852586 [0,1,0,1,0,0|2,0,0]=4 12193 B9R1.24 OCC1NCCC1(F)F Amb25064333 [0,1,0,1,0,0|2,0,0]=4 12194 B9R1.24 OCC1NCCC1(F)F Amb34913472 [0,1,0,1,0,0|2,0,0]=4 12195 B9R1.40 CC1(Br)CCCCC1O Amb28064001 [0,1,0,1,0,0|1,0,0]=3 12196 B9R1.40 CC1(C)CCC=C[C@@H]1O Amb28454457 [0,1,0,1,0,0|1,0,1]=4 12197 B9R1.40 CC1(C)CCCCC1N Amb18642545 [0,1,0,1,0,0|2,0,0]=4 12198 B9R1.40 CC1(C)CCCCC1O Amb22748701 [0,1,0,1,0,0|1,0,0]=3 12199 B9R1.40 CC1(C)CCCCC1S Amb27447161 [0,1,0,1,0,0|1,1,0]=4 12200 B9R1.40 CC1(C)CCCC[C@@H]1N Amb27242528 [0,1,0,1,0,0|2,0,0]=4 12201 B9R1.40 CC1(C)CCCC[C@@H]1O Amb28318455 [0,1,0,1,0,0|1,0,0]=3 12202 B9R1.40 CC1(C)CCCC[C@H]1O Amb28256801 [0,1,0,1,0,0|1,0,0]=3 12203 B9R1.40 CC1(C)CCNCC1F Amb27185875 [0,1,0,1,0,0|2,0,0]=4 12204 B9R1.40 CC1(C)CCOCC1=O Amb28386611 [0,1,0,1,0,0|0,0,2]=4 12205 B9R1.40 CC1(C)CCOCC1O Amb27652843 [0,1,0,1,0,0|0,0,0]=2 12206 B9R1.40 CC1(C)CCSCC1N Amb27588490 [0,1,0,1,0,0|1,1,0]=4 12207 B9R1.40 CC1(C)CCSCC1O Amb27838561 [0,1,0,1,0,0|0,1,0]=3 12208 B9R1.40 CC1(C)CCSCC1S Amb24448173 [0,1,0,1,0,0|0,2,0]=4 12209 B9R1.40 CC1(C)CNCCC1O Amb10602172 [0,1,0,1,0,0|2,0,0]=4 12210 B9R1.40 CC1(C)COCCC1Br Amb33509713 [0,1,0,1,0,0|2,0,0]=4 12211 B9R1.40 CC1(C)COCCC1Cl Amb33509253 [0,1,0,1,0,0|2,0,0]=4 12212 B9R1.40 CC1(C)COCCC1N Amb23439967 [0,1,0,1,0,0|2,0,0]=4 12213 B9R1.40 CC1(C)COCCC1N Amb24120412 [0,1,0,1,0,0|2,0,0]=4 12214 B9R1.40 CC1(C)COCCC1O Amb33496010 [0,1,0,1,0,0|2,0,0]=4 12215 B9R1.40 CC1(C)NCCCC1O Amb27849638 [0,1,0,1,0,0|2,0,0]=4 12216 B9R1.40 CC1(C)OCOCC1Cl Amb27845385 [0,1,0,1,0,0|2,0,0]=4 12217 B9R1.40 CC1(C)OCOCC1O Amb27829887 [0,1,0,1,0,0|1,0,0]=3 12218 B9R1.40 CC1(Cl)CCCCC1O Amb28315439 [0,1,0,1,0,0|1,0,0]=3 12219 B9R1.40 CC1(Cl)CCCOC1O Amb28422552 [0,1,0,1,0,0|2,0,0]=4 12220 B9R1.40 CC1(N)CCCCC1F Amb28434786 [0,1,0,1,0,0|2,0,0]=4 12221 B9R1.40 CC1(N)CCCCC1I Amb27260255 [0,1,0,1,0,0|2,0,0]=4 12222 B9R1.40 CC1(N)CCCCC1O Amb28436950 [0,1,0,1,0,0|1,0,0]=3 12223 B9R1.40 CC1(O)CCCCC1Br Amb24480133 [0,1,0,1,0,0|2,0,0]=4 12224 B9R1.40 CC1(O)CCCCC1I Amb35665704 [0,1,0,1,0,0|2,0,0]=4 12225 B9R1.40 CC1(O)CCCCC1N Amb25709525 [0,1,0,1,0,0|2,0,0]=4 12226 B9R1.40 CC1(O)CCNCC1F Amb28071459 [0,1,0,1,0,0|2,0,0]=4 12227 B9R1.40 CC1(O)CCNCC1S Amb35672844 [0,1,0,1,0,0|1,1,0]=4 12228 B9R1.40 CC1(O)CCOCC1N Amb24478329 [0,1,0,1,0,0|1,0,0]=3 12229 B9R1.40 CC1(O)CCSCC1N Amb32944498 [0,1,0,1,0,0|1,1,0]=4 12230 B9R1.40 CC1(O)COCCC1=O Amb24737493 [0,1,0,1,0,0|1,0,1]=4 12231 B9R1.40 CC1(O)OCCCC1O Amb27946770 [0,1,0,1,0,0|2,0,0]=4 12232 B9R1.40 CC1CCCCC1(C)C Amb22227673 [0,1,0,1,0,0|2,0,0]=4 12233 B9R1.40 CC1CCCCC1(C)Cl Amb27789616 [0,1,0,1,0,0|2,0,0]=4 12234 B9R1.40 CC1CCCCC1(C)N Amb9676158 [0,1,0,1,0,0|2,0,0]=4 12235 B9R1.40 CC1CCCCC1(C)O Amb9675954 [0,1,0,1,0,0|1,0,0]=3 12236 B9R1.40 CC1CCCCC1(F)F Amb20670617 [0,1,0,1,0,0|2,0,0]=4 12237 B9R1.40 CC1CCNCC1(C)C Amb25091675 [0,1,0,1,0,0|2,0,0]=4 12238 B9R1.40 CC1CCNCC1(C)O Amb27618808 [0,1,0,1,0,0|1,0,0]=3 12239 B9R1.40 CC1CCNCC1(F)F Amb22886349 [0,1,0,1,0,0|2,0,0]=4 12240 B9R1.40 CC1CCNCC1(F)F Amb27258827 [0,1,0,1,0,0|2,0,0]=4 12241 B9R1.40 CC1CNCCC1(C)F Amb27761977 [0,1,0,1,0,0|2,0,0]=4 12242 B9R1.40 CC1CNCCC1(C)O Amb22886361 [0,1,0,1,0,0|2,0,0]=4 12243 B9R1.40 CC1SCCCC1(C)O Amb27978912 [0,1,0,1,0,0|2,0,0]=4 12244 B9R1.40 C[C@@H]1CCCC[C@@]1(C)O Amb32945290 [0,1,0,1,0,0|1,0,0]=3 12245 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O Amb22886386 [0,1,0,1,0,0|1,0,0]=3 12246 B9R1.40 C[C@@]1(Br)CCCC[C@@H]1O Amb27978301 [0,1,0,1,0,0|1,0,0]=3 12247 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1Cl Amb27845490 [0,1,0,1,0,0|2,0,0]=4 12248 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [0,1,0,1,0,0|1,0,0]=3 12249 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1O Amb27463688 [0,1,0,1,0,0|1,0,0]=3 12250 B9R1.40 C[C@@]1(Cl)CCCO[C@H]1O Amb27184161 [0,1,0,1,0,0|2,0,0]=4 12251 B9R1.40 C[C@@]1(F)CCCC[C@H]1Br Amb27631449 [0,1,0,1,0,0|2,0,0]=4 12252 B9R1.40 C[C@@]1(F)CCCC[C@H]1O Amb28205454 [0,1,0,1,0,0|1,0,0]=3 12253 B9R1.40 C[C@@]1(N)CCCC[C@H]1I Amb27212307 [0,1,0,1,0,0|2,0,0]=4 12254 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [0,1,0,1,0,0|1,0,0]=3 12255 B9R1.40 C[C@@]1(O)CCCC[C@@H]1Br Amb27848102 [0,1,0,1,0,0|2,0,0]=4 12256 B9R1.40 C[C@@]1(O)CCCC[C@@H]1N Amb28134269 [0,1,0,1,0,0|2,0,0]=4 12257 B9R1.40 C[C@@]1(O)CCCC[C@H]1Br Amb26027155 [0,1,0,1,0,0|2,0,0]=4 12258 B9R1.40 C[C@@]1(O)CCCC[C@H]1I Amb35665703 [0,1,0,1,0,0|2,0,0]=4 12259 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [0,1,0,1,0,0|2,0,0]=4 12260 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [0,1,0,1,0,0|1,0,0]=3 12261 B9R1.40 C[C@@]1(O)CCOC[C@@H]1O Amb22757723 [0,1,0,1,0,0|0,0,0]=2 12262 B9R1.40 C[C@@]1(O)CNCC[C@@H]1O Amb34913312 [0,1,0,1,0,0|2,0,0]=4 12263 B9R1.40 C[C@@]1(O)CNCC[C@H]1O Amb34913314 [0,1,0,1,0,0|2,0,0]=4 12264 B9R1.40 C[C@]1(N)CCCC[C@H]1O Amb28061920 [0,1,0,1,0,0|1,0,0]=3 12265 B9R1.40 C[C@]1(O)CCCC[C@@H]1Cl Amb27966527 [0,1,0,1,0,0|2,0,0]=4 12266 B9R1.40 C[C@]1(O)CCCC[C@@H]1O Amb27427705 [0,1,0,1,0,0|1,0,0]=3 12267 B9R1.40 C[C@]1(O)CCNC[C@@H]1F Amb28255746 [0,1,0,1,0,0|2,0,0]=4 12268 B9R1.40 C[C@]1(O)CCNC[C@H]1O Amb27785358 [0,1,0,1,0,0|1,0,0]=3 12269 B9R1.40 C[C@]1(O)CCOC[C@H]1O Amb532958 [0,1,0,1,0,0|0,0,0]=2 12270 B9R1.40 C[C@]1(O)COCC[C@@H]1N Amb27627376 [0,1,0,1,0,0|1,0,0]=3 12271 B9R1.40 C[Si]1(C)CCCCC1O Amb27981646 [0,1,0,1,0,0|1,1,0]=4 12272 B9R1.40 NC1COCCC1(F)F Amb22490260 [0,1,0,1,0,0|2,0,0]=4 12273 B9R1.40 NC1COCCC1(F)F Amb22899786 [0,1,0,1,0,0|2,0,0]=4 12274 B9R1.40 OC1(O)CCOCC1F Amb23439962 [0,1,0,1,0,0|2,0,0]=4 12275 B9R1.40 OC1CCCCC1(Cl)Cl Amb28207294 [0,1,0,1,0,0|2,0,0]=4 12276 B9R1.40 OC1CCCCC1(F)F Amb25981612 [0,1,0,1,0,0|2,0,0]=4 12277 B9R1.40 OC1CNCCC1(F)F Amb23439334 [0,1,0,1,0,0|2,0,0]=4 12278 B9R1.40 OC1CNCCC1(F)F Amb26512872 [0,1,0,1,0,0|2,0,0]=4 12279 B9R1.40 OC1COCCC1(F)F Amb35753167 [0,1,0,1,0,0|1,0,0]=3 12280 B9R1.41 C=C(C)C1CCCC1O Amb26956818 [0,1,0,1,0,0|1,0,1]=4 12281 B9R1.41 C=C(C)C1CNCC1O Amb24568954 [0,1,0,1,0,0|1,0,1]=4 12282 B9R1.41 C=C(C)C1COCC1O Amb33213980 [0,1,0,1,0,0|0,0,1]=3 12283 B9R1.41 C=C(C)[C@@H]1CCC[C@H]1O Amb33212935 [0,1,0,1,0,0|1,0,1]=4 12284 B9R1.41 C=C(C)[C@@H]1CNC[C@H]1O Amb32944875 [0,1,0,1,0,0|1,0,1]=4 12285 B9R1.41 C=C(C)[C@@H]1COC[C@H]1O Amb32945151 [0,1,0,1,0,0|0,0,1]=3 12286 B9R1.41 C=C(C)[C@H]1CCC[C@@H]1O Amb27618794 [0,1,0,1,0,0|1,0,1]=4 12287 B9R1.41 C=C1COCC1C(C)C Amb35646843 [0,1,0,1,0,0|1,0,1]=4 12288 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|1,0,1]=4 12289 B9R1.41 CC(=O)C1CNCC1O Amb33213407 [0,1,0,1,0,0|1,0,1]=4 12290 B9R1.41 CC(=O)C1COCC1N Amb25918760 [0,1,0,1,0,0|1,0,1]=4 12291 B9R1.41 CC(=O)C1COCC1O Amb32951053 [0,1,0,1,0,0|0,0,1]=3 12292 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [0,1,0,1,0,0|1,0,1]=4 12293 B9R1.41 CC(=O)[C@@H]1CNC[C@H]1O Amb32945575 [0,1,0,1,0,0|1,0,1]=4 12294 B9R1.41 CC(=O)[C@@H]1COC[C@H]1O Amb32951076 [0,1,0,1,0,0|0,0,1]=3 12295 B9R1.41 CC(Br)C1COCC1C Amb35632052 [0,1,0,1,0,0|1,0,0]=3 12296 B9R1.41 CC(C)C1CCCC1N Amb18947760 [0,1,0,1,0,0|2,0,0]=4 12297 B9R1.41 CC(C)C1CCCC1N Amb33339176 [0,1,0,1,0,0|2,0,0]=4 12298 B9R1.41 CC(C)C1CCCC1O Amb25749420 [0,1,0,1,0,0|1,0,0]=3 12299 B9R1.41 CC(C)C1CNCC1N Amb32756032 [0,1,0,1,0,0|2,0,0]=4 12300 B9R1.41 CC(C)C1CNCC1O Amb32945129 [0,1,0,1,0,0|1,0,0]=3 12301 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,1,0,1,0,0|0,0,2]=4 12302 B9R1.41 CC(C)C1COCC1Br Amb35736881 [0,1,0,1,0,0|1,0,0]=3 12303 B9R1.41 CC(C)C1COCC1Cl Amb35736786 [0,1,0,1,0,0|1,0,0]=3 12304 B9R1.41 CC(C)C1COCC1N Amb29877502 [0,1,0,1,0,0|1,0,0]=3 12305 B9R1.41 CC(C)C1COCC1O Amb24386874 [0,1,0,1,0,0|0,0,0]=2 12306 B9R1.41 CC(C)C1COCC1S Amb32788519 [0,1,0,1,0,0|0,1,0]=3 12307 B9R1.41 CC(C)C1NCCC1O Amb25888819 [0,1,0,1,0,0|2,0,0]=4 12308 B9R1.41 CC(C)C1NCCC1O Amb32411998 [0,1,0,1,0,0|2,0,0]=4 12309 B9R1.41 CC(C)C1OCCN1C Amb27607912 [0,1,0,1,0,0|2,0,0]=4 12310 B9R1.41 CC(C)[C@@H]1CCC[C@H]1O Amb25998901 [0,1,0,1,0,0|1,0,0]=3 12311 B9R1.41 CC(C)[C@@H]1CNC[C@@H]1N Amb32709345 [0,1,0,1,0,0|2,0,0]=4 12312 B9R1.41 CC(C)[C@@H]1CNC[C@H]1O Amb32709321 [0,1,0,1,0,0|1,0,0]=3 12313 B9R1.41 CC(C)[C@@H]1COC[C@H]1O Amb32944774 [0,1,0,1,0,0|0,0,0]=2 12314 B9R1.41 CC(C)[C@@H]1NCCC1O Amb18832556 [0,1,0,1,0,0|2,0,0]=4 12315 B9R1.41 CC(C)[C@@H]1NCC[C@@H]1O Amb32664266 [0,1,0,1,0,0|2,0,0]=4 12316 B9R1.41 CC(C)[C@@H]1NCC[C@H]1C Amb18832663 [0,1,0,1,0,0|2,0,0]=4 12317 B9R1.41 CC(C)[C@@H]1NCC[C@H]1O Amb24366323 [0,1,0,1,0,0|2,0,0]=4 12318 B9R1.41 CC(C)[C@@H]1NCC[C@H]1O Amb33379055 [0,1,0,1,0,0|2,0,0]=4 12319 B9R1.41 CC(C)[C@@H]1OCCN1C Amb26926991 [0,1,0,1,0,0|2,0,0]=4 12320 B9R1.41 CC(C)[C@H]1CCC[C@@H]1O Amb27238582 [0,1,0,1,0,0|1,0,0]=3 12321 B9R1.41 CC(C)[C@H]1CCC[C@H]1N Amb27259812 [0,1,0,1,0,0|2,0,0]=4 12322 B9R1.41 CC(C)[C@H]1CCC[C@H]1O Amb28053553 [0,1,0,1,0,0|1,0,0]=3 12323 B9R1.41 CC(C)[C@H]1SCC[C@H]1O Amb28350076 [0,1,0,1,0,0|2,0,0]=4 12324 B9R1.41 CC(Cl)C1COCC1C Amb35632051 [0,1,0,1,0,0|1,0,0]=3 12325 B9R1.41 CC(N)C1CCCC1C Amb28287560 [0,1,0,1,0,0|2,0,0]=4 12326 B9R1.41 CC(N)C1COCC1C Amb35635621 [0,1,0,1,0,0|1,0,0]=3 12327 B9R1.41 CC(N)C1COCC1O Amb29870209 [0,1,0,1,0,0|0,0,0]=2 12328 B9R1.41 CC(N)C1OCCC1O Amb28240319 [0,1,0,1,0,0|2,0,0]=4 12329 B9R1.41 CC(N)[C@@H]1CCC[C@@H]1O Amb27654093 [0,1,0,1,0,0|1,0,0]=3 12330 B9R1.41 CC(O)C1CCCC1N Amb18203228 [0,1,0,1,0,0|2,0,0]=4 12331 B9R1.41 CC(O)C1CCCN1C Amb27491503 [0,1,0,1,0,0|2,0,0]=4 12332 B9R1.41 CC(O)C1CCNC1C Amb35584409 [0,1,0,1,0,0|2,0,0]=4 12333 B9R1.41 CC(O)C1CNCC1C Amb29849500 [0,1,0,1,0,0|2,0,0]=4 12334 B9R1.41 CC(O)C1COCC1C Amb35651587 [0,1,0,1,0,0|1,0,0]=3 12335 B9R1.41 CC(O)C1COCC1N Amb35625432 [0,1,0,1,0,0|1,0,0]=3 12336 B9R1.41 CC(O)C1OCCC1O Amb27757203 [0,1,0,1,0,0|1,0,0]=3 12337 B9R1.41 CC(O)C1OCOC1C Amb27424646 [0,1,0,1,0,0|1,0,0]=3 12338 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [0,1,0,1,0,0|2,0,0]=4 12339 B9R1.41 CC(O)[C@@H]1CCC[C@@H]1N Amb30039509 [0,1,0,1,0,0|2,0,0]=4 12340 B9R1.41 CC1CCCC1B(O)O Amb27244083 [0,1,0,1,0,0|2,0,0]=4 12341 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [0,1,0,1,0,0|1,0,1]=4 12342 B9R1.41 CC1CCCC1[C@@H](C)N Amb26925525 [0,1,0,1,0,0|2,0,0]=4 12343 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [0,1,0,1,0,0|1,0,0]=3 12344 B9R1.41 CC1CCCC1[C@H](C)N Amb27777943 [0,1,0,1,0,0|2,0,0]=4 12345 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [0,1,0,1,0,0|1,0,1]=4 12346 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [0,1,0,1,0,0|1,0,1]=4 12347 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [0,1,0,1,0,0|1,0,1]=4 12348 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [0,1,0,1,0,0|0,0,1]=3 12349 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [0,1,0,1,0,0|0,1,1]=4 12350 B9R1.41 CC1COCC1N(C)N Amb35652375 [0,1,0,1,0,0|2,0,0]=4 12351 B9R1.41 CC1OCCC1[C@@H](C)O Amb33427681 [0,1,0,1,0,0|2,0,0]=4 12352 B9R1.41 CC1OCCC1[C@H](C)O Amb33225339 [0,1,0,1,0,0|2,0,0]=4 12353 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [0,1,0,1,0,0|1,0,1]=4 12354 B9R1.41 CN(C)C1CCCC1O Amb19650708 [0,1,0,1,0,0|2,0,0]=4 12355 B9R1.41 CN(C)C1CNCC1O Amb25283476 [0,1,0,1,0,0|2,0,0]=4 12356 B9R1.41 CN(C)C1CNCC1O Amb32661147 [0,1,0,1,0,0|2,0,0]=4 12357 B9R1.41 CN(C)C1COCC1Br Amb33483044 [0,1,0,1,0,0|2,0,0]=4 12358 B9R1.41 CN(C)C1COCC1Cl Amb27454695 [0,1,0,1,0,0|2,0,0]=4 12359 B9R1.41 CN(C)C1COCC1N Amb27455826 [0,1,0,1,0,0|2,0,0]=4 12360 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1O Amb22899696 [0,1,0,1,0,0|2,0,0]=4 12361 B9R1.41 CN(C)[C@@H]1CCC[C@H]1O Amb16230278 [0,1,0,1,0,0|2,0,0]=4 12362 B9R1.41 CN(C)[C@@H]1CNC[C@@H]1O Amb23385263 [0,1,0,1,0,0|2,0,0]=4 12363 B9R1.41 CN(C)[C@@H]1CNC[C@H]1O Amb22748751 [0,1,0,1,0,0|2,0,0]=4 12364 B9R1.41 CN(C)[C@@H]1CNC[C@H]1O Amb30526938 [0,1,0,1,0,0|2,0,0]=4 12365 B9R1.41 CN(C)[C@@H]1COC[C@@H]1N Amb33482843 [0,1,0,1,0,0|2,0,0]=4 12366 B9R1.41 CN(C)[C@@H]1COC[C@@H]1O Amb22746864 [0,1,0,1,0,0|1,0,0]=3 12367 B9R1.41 CN(C)[C@@H]1COC[C@H]1Br Amb33483702 [0,1,0,1,0,0|2,0,0]=4 12368 B9R1.41 CN(C)[C@@H]1COC[C@H]1N Amb26931803 [0,1,0,1,0,0|2,0,0]=4 12369 B9R1.41 CN(C)[C@@H]1COC[C@H]1O Amb26578900 [0,1,0,1,0,0|1,0,0]=3 12370 B9R1.41 CN(C)[C@H]1CCC[C@H]1O Amb27185740 [0,1,0,1,0,0|2,0,0]=4 12371 B9R1.41 CN(C)[C@H]1CNC[C@@H]1O Amb10608226 [0,1,0,1,0,0|2,0,0]=4 12372 B9R1.41 CN(C)[C@H]1CNC[C@H]1O Amb28133969 [0,1,0,1,0,0|2,0,0]=4 12373 B9R1.41 CN(N)[C@H]1CCC[C@@H]1O Amb27420294 [0,1,0,1,0,0|2,0,0]=4 12374 B9R1.41 CN(N)[C@H]1CCC[C@H]1O Amb28064055 [0,1,0,1,0,0|2,0,0]=4 12375 B9R1.41 C[C@@H](N)[C@@H]1CCC[C@@H]1O Amb35752723 [0,1,0,1,0,0|1,0,0]=3 12376 B9R1.41 C[C@@H](N)[C@H]1CCC[C@H]1O Amb28072273 [0,1,0,1,0,0|1,0,0]=3 12377 B9R1.41 C[C@@H](O)[C@H]1OCC[C@H]1O Amb27185774 [0,1,0,1,0,0|1,0,0]=3 12378 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [0,1,0,1,0,0|1,0,1]=4 12379 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|1,0,1]=4 12380 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|1,0,1]=4 12381 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [0,1,0,1,0,0|1,0,1]=4 12382 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [0,1,0,1,0,0|0,0,1]=3 12383 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [0,1,0,1,0,0|0,0,1]=3 12384 B9R1.41 C[C@H]1CCC[C@@H]1B(O)O Amb24566352 [0,1,0,1,0,0|2,0,0]=4 12385 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|1,0,1]=4 12386 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|1,0,1]=4 12387 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [0,1,0,1,0,0|1,0,1]=4 12388 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [0,1,0,1,0,0|1,0,1]=4 12389 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [0,1,0,1,0,0|1,0,1]=4 12390 B9R1.41 NS(=O)[C@@H]1COC[C@H]1O Amb32720960 [0,1,0,1,0,0|2,0,0]=4 12391 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [0,1,0,1,0,0|1,0,1]=4 12392 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [0,1,0,1,0,0|1,0,1]=4 12393 B9R1.41 O=C(O)C1COCC1O Amb27270738 [0,1,0,1,0,0|1,0,1]=4 12394 B9R1.41 O=S(Cl)[C@@H]1COC[C@H]1O Amb32720961 [0,1,0,1,0,0|2,0,0]=4 12395 B9R1.41 O=S([O-])[C@@H]1COC[C@H]1O Amb32755781 [0,1,0,1,0,0|2,0,0]=4 12396 B9R1.41 OB(O)C1COCC1O Amb24314286 [0,1,0,1,0,0|2,0,0]=4 12397 B9R1.41 OC(O)C1OCCC1O Amb27457909 [0,1,0,1,0,0|1,0,0]=3 12398 B9R1.41 OC1CCCC1C(F)F Amb24738925 [0,1,0,1,0,0|2,0,0]=4 12399 B9R1.41 OC1CNCC1C(F)F Amb33213534 [0,1,0,1,0,0|2,0,0]=4 12400 B9R1.41 OC1COCC1C(F)F Amb32950391 [0,1,0,1,0,0|1,0,0]=3 12401 B9R1.41 O[C@@H]1CCC[C@H]1C(F)F Amb32945112 [0,1,0,1,0,0|2,0,0]=4 12402 B9R1.41 O[C@@H]1CNC[C@H]1C(F)F Amb32944761 [0,1,0,1,0,0|2,0,0]=4 12403 B9R1.41 O[C@@H]1COC[C@H]1C(F)F Amb32944982 [0,1,0,1,0,0|1,0,0]=3 12404 B9R1.46 CC(C)CN[C@@H]1C[C@H]1C Amb28349879 [0,1,0,1,0,0|2,0,0]=4 12405 B9R1.46 CC(C)CO[C@@H]1C[C@H]1N Amb33347103 [0,1,0,1,0,0|2,0,0]=4 12406 B9R1.46 CC(N)CCC1CC1C Amb33448587 [0,1,0,1,0,0|2,0,0]=4 12407 B9R1.46 CC(O)CCC1CC1C Amb33172627 [0,1,0,1,0,0|1,0,0]=3 12408 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,1,0,1,0,0|1,0,1]=4 12409 B9R1.46 CC1CC1CC[C@@H](C)N Amb33144244 [0,1,0,1,0,0|2,0,0]=4 12410 B9R1.46 CC1CC1CC[C@@H](C)O Amb33144245 [0,1,0,1,0,0|1,0,0]=3 12411 B9R1.46 CC1CC1CC[C@H](C)N Amb33144243 [0,1,0,1,0,0|2,0,0]=4 12412 B9R1.46 CC1CC1CC[C@H](C)O Amb33144246 [0,1,0,1,0,0|1,0,0]=3 12413 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [0,1,0,1,0,0|0,0,1]=3 12414 B9R1.56 CC1(C)CCC1CCO Amb27953782 [0,1,0,1,0,0|1,0,0]=3 12415 B9R1.56 CC1(C)CCN1CCF Amb27834920 [0,1,0,1,0,0|2,0,0]=4 12416 B9R1.56 CC1(C)CCN1CCI Amb27853467 [0,1,0,1,0,0|2,0,0]=4 12417 B9R1.56 CC1(C)CNC1CCO Amb32946704 [0,1,0,1,0,0|2,0,0]=4 12418 B9R1.59 C=C(C)C1CC1CCO Amb28400433 [0,1,0,1,0,0|1,0,1]=4 12419 B9R1.59 C=CCC1OC1C(C)O Amb28318270 [0,1,0,1,0,0|0,0,2]=4 12420 B9R1.59 C=CC[C@@H]1O[C@H]1[C@H](C)O Amb27451928 [0,1,0,1,0,0|0,0,2]=4 12421 B9R1.59 C=CC[C@H]1O[C@@H]1[C@@H](C)O Amb28052867 [0,1,0,1,0,0|0,0,2]=4 12422 B9R1.59 CC(C)C1CC1CCN Amb27849221 [0,1,0,1,0,0|2,0,0]=4 12423 B9R1.59 CC(C)[C@H]1C[C@H]1CCO Amb27429554 [0,1,0,1,0,0|1,0,0]=3 12424 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [0,1,0,1,0,0|1,0,1]=4 12425 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [0,1,0,1,0,0|0,0,1]=3 12426 B9R1.59 CCCC1OC1C(C)=O Amb25888683 [0,1,0,1,0,0|0,0,2]=4 12427 B9R1.59 CCCC1OC1C(C)O Amb26924649 [0,1,0,1,0,0|0,0,0]=2 12428 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [0,1,0,1,0,0|1,0,1]=4 12429 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [0,1,0,1,0,0|1,0,1]=4 12430 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [0,1,0,1,0,0|0,0,1]=3 12431 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,1,0,1,0,0|0,0,2]=4 12432 B9R1.59 CCC[C@@H]1O[C@H]1[C@@H](C)O Amb27255265 [0,1,0,1,0,0|0,0,0]=2 12433 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [0,1,0,1,0,0|1,0,1]=4 12434 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [0,1,0,1,0,0|0,0,1]=3 12435 B9R1.59 CCC[C@H]1O[C@@H]1C(C)=O Amb28325243 [0,1,0,1,0,0|0,0,2]=4 12436 B9R1.59 CCOC1CC1C(C)O Amb28049260 [0,1,0,1,0,0|2,0,0]=4 12437 B9R1.59 OCCC1CC1C(F)F Amb33228356 [0,1,0,1,0,0|2,0,0]=4 12438 B9R1.67 C=C(C)CC1CCC1O Amb32945786 [0,1,0,1,0,0|1,0,1]=4 12439 B9R1.67 C=C(C)C[C@H]1SC[C@@H]1O Amb27207731 [0,1,0,1,0,0|0,1,1]=4 12440 B9R1.67 CC(C)CC1CCC1O Amb33213816 [0,1,0,1,0,0|1,0,0]=3 12441 B9R1.67 CC(C)O[C@@H]1CC[C@H]1O Amb33495614 [0,1,0,1,0,0|2,0,0]=4 12442 B9R1.67 CC(O)CN1CCC1C Amb27406013 [0,1,0,1,0,0|1,0,0]=3 12443 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,1]=4 12444 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,1]=4 12445 B9R1.77 CC1(C)CC1CCCBr Amb27174355 [0,1,0,1,0,0|2,0,0]=4 12446 B9R1.77 CC1(C)CC1CCCCl Amb33228609 [0,1,0,1,0,0|2,0,0]=4 12447 B9R1.77 CC1(C)CC1CCCN Amb32992297 [0,1,0,1,0,0|2,0,0]=4 12448 B9R1.77 CC1(C)CC1CCCO Amb24675490 [0,1,0,1,0,0|1,0,0]=3 12449 B9R1.77 CC1(C)CC1\C=C\CO Amb27165277 [0,1,0,1,0,0|1,0,1]=4 12450 B9R1.77 CC1(C)C[C@@H]1\C=C\CO Amb27195119 [0,1,0,1,0,0|1,0,1]=4 12451 B9R1.77 CC1(C)C\C1=C/CCO Amb28194214 [0,1,0,1,0,0|1,0,1]=4 12452 B9R1.77 FC1(F)CC1OCCBr Amb30022581 [0,1,0,1,0,0|2,0,0]=4 12453 B9R1.77 FC1(F)CC1OCCI Amb35626248 [0,1,0,1,0,0|2,0,0]=4 12454 B9R1.77 FC1(F)CC1OCCS Amb30021791 [0,1,0,1,0,0|1,1,0]=4 12455 B9R1.77 NCCOC1CC1(F)F Amb32665400 [0,1,0,1,0,0|2,0,0]=4 12456 B9R1.77 OCCCC1CC1(F)F Amb28049150 [0,1,0,1,0,0|2,0,0]=4 12457 B9R1.77 OCCOC1CC1(F)F Amb32665458 [0,1,0,1,0,0|1,0,0]=3 12458 B9R1.84 CC(Br)CCC1CCC1 Amb28143174 [0,1,0,1,0,0|2,0,0]=4 12459 B9R1.84 CC(C)CCC1CCN1 Amb27965282 [0,1,0,1,0,0|2,0,0]=4 12460 B9R1.84 CC(C)CCN1CCC1 Amb27805290 [0,1,0,1,0,0|2,0,0]=4 12461 B9R1.84 CC(C)COC1CNC1 Amb18997211 [0,1,0,1,0,0|2,0,0]=4 12462 B9R1.84 CC(C)COC1CNC1 Amb20623614 [0,1,0,1,0,0|2,0,0]=4 12463 B9R1.84 CC(C)CSC1CCC1 Amb27837695 [0,1,0,1,0,0|1,1,0]=4 12464 B9R1.84 CC(F)CNC1CCC1 Amb28133092 [0,1,0,1,0,0|2,0,0]=4 12465 B9R1.84 CC(N)CCC1CCC1 Amb25888957 [0,1,0,1,0,0|2,0,0]=4 12466 B9R1.84 CC(N)CCC1CCN1 Amb28195406 [0,1,0,1,0,0|2,0,0]=4 12467 B9R1.84 CC(N)CCN1CCC1 Amb27404116 [0,1,0,1,0,0|2,0,0]=4 12468 B9R1.84 CC(N)CNC1CCC1 Amb18990486 [0,1,0,1,0,0|2,0,0]=4 12469 B9R1.84 CC(O)CCC1CCC1 Amb27146306 [0,1,0,1,0,0|1,0,0]=3 12470 B9R1.84 CC(O)CCC1COC1 Amb27795130 [0,1,0,1,0,0|2,0,0]=4 12471 B9R1.84 CC(O)CNC1CCC1 Amb18989413 [0,1,0,1,0,0|1,0,0]=3 12472 B9R1.84 CC(O)CNC1COC1 Amb28136130 [0,1,0,1,0,0|2,0,0]=4 12473 B9R1.84 CC(O)CNC1CSC1 Amb24524244 [0,1,0,1,0,0|2,0,0]=4 12474 B9R1.84 CC(O)COC1CNC1 Amb24688760 [0,1,0,1,0,0|1,0,0]=3 12475 B9R1.84 CC(O)COC1CNC1 Amb33733597 [0,1,0,1,0,0|1,0,0]=3 12476 B9R1.84 CC(O)CSC1COC1 Amb28285156 [0,1,0,1,0,0|1,1,0]=4 12477 B9R1.84 CC(O)\C=C\C1CCC1 Amb27645263 [0,1,0,1,0,0|1,0,1]=4 12478 B9R1.84 C[C@@H](N)CCC1CCC1 Amb33314113 [0,1,0,1,0,0|2,0,0]=4 12479 B9R1.84 C[C@@H](O)CCC1CCC1 Amb33314114 [0,1,0,1,0,0|1,0,0]=3 12480 B9R1.84 C[C@@H](O)CNC1COC1 Amb27180242 [0,1,0,1,0,0|2,0,0]=4 12481 B9R1.84 C[C@@H](O)COC1CCC1 Amb27607585 [0,1,0,1,0,0|0,0,0]=2 12482 B9R1.84 C[C@@H](O)COC1COC1 Amb27644347 [0,1,0,1,0,0|1,0,0]=3 12483 B9R1.84 C[C@H](N)CCC1CCC1 Amb33314112 [0,1,0,1,0,0|2,0,0]=4 12484 B9R1.84 C[C@H](O)CCC1CCC1 Amb33195478 [0,1,0,1,0,0|1,0,0]=3 12485 B9R1.84 C[C@H](O)CNC1CNC1 Amb27241163 [0,1,0,1,0,0|2,0,0]=4 12486 B9R1.84 C[C@H](O)CNC1COC1 Amb27758034 [0,1,0,1,0,0|2,0,0]=4 12487 B9R1.84 C[C@H](O)CSC1COC1 Amb28139851 [0,1,0,1,0,0|1,1,0]=4 12488 B9R1.84 FC(F)CNC1CCC1 Amb20667985 [0,1,0,1,0,0|2,0,0]=4 12489 B9R1.84 FC(F)CNC1CCC1 Amb25686986 [0,1,0,1,0,0|2,0,0]=4 12490 B9R1.84 FC(F)COC1CNC1 Amb20623759 [0,1,0,1,0,0|2,0,0]=4 12491 B9R1.84 FC(F)COC1CNC1 Amb22059193 [0,1,0,1,0,0|2,0,0]=4 12492 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,1,0,1,0,0|1,0,1]=4 12493 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,1]=4 12494 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|0,0,1]=3 12495 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|1,0,1]=4 12496 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,1,0,1,0,0|1,0,1]=4 12497 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,1,0,1,0,0|1,0,1]=4 12498 B9R1.84 O=C(O)COC1COC1 Amb24539538 [0,1,0,1,0,0|1,0,1]=4 12499 B9R1.85 CC(Br)CCCC1CC1 Amb33167096 [0,1,0,1,0,0|2,0,0]=4 12500 B9R1.85 CC(C)CCCC1CO1 Amb27232305 [0,1,0,1,0,0|1,0,0]=3 12501 B9R1.85 CC(C)CCNC1CC1 Amb1113142 [0,1,0,1,0,0|2,0,0]=4 12502 B9R1.85 CC(C)CCNC1CC1 Amb6239358 [0,1,0,1,0,0|2,0,0]=4 12503 B9R1.85 CC(C)CNCC1CC1 Amb6686738 [0,1,0,1,0,0|2,0,0]=4 12504 B9R1.85 CC(C)COCC1CO1 Amb6600577 [0,1,0,1,0,0|2,0,0]=4 12505 B9R1.85 CC(C)COC[C@H]1CO1 Amb27833842 [0,1,0,1,0,0|2,0,0]=4 12506 B9R1.85 CC(C)CSCC1CC1 Amb28319700 [0,1,0,1,0,0|1,1,0]=4 12507 B9R1.85 CC(C)CSC[C@@H]1CO1 Amb27956612 [0,1,0,1,0,0|2,0,0]=4 12508 B9R1.85 CC(C)OCCC1CO1 Amb25138542 [0,1,0,1,0,0|2,0,0]=4 12509 B9R1.85 CC(C)SCCC1CO1 Amb27981259 [0,1,0,1,0,0|2,0,0]=4 12510 B9R1.85 CC(F)CCNC1CC1 Amb27200076 [0,1,0,1,0,0|2,0,0]=4 12511 B9R1.85 CC(N)CCCC1CC1 Amb32675321 [0,1,0,1,0,0|2,0,0]=4 12512 B9R1.85 CC(N)CCNC1CC1 Amb19007235 [0,1,0,1,0,0|2,0,0]=4 12513 B9R1.85 CC(N)CCSC1CC1 Amb28125928 [0,1,0,1,0,0|1,1,0]=4 12514 B9R1.85 CC(N)CNCC1CC1 Amb19009744 [0,1,0,1,0,0|2,0,0]=4 12515 B9R1.85 CC(N)COCC1CC1 Amb6749895 [0,1,0,1,0,0|1,0,0]=3 12516 B9R1.85 CC(N)CSCC1CC1 Amb28204055 [0,1,0,1,0,0|1,1,0]=4 12517 B9R1.85 CC(O)CCCC1CC1 Amb27780444 [0,1,0,1,0,0|1,0,0]=3 12518 B9R1.85 CC(O)CNCC1CC1 Amb9423143 [0,1,0,1,0,0|1,0,0]=3 12519 B9R1.85 CC(O)COCC1CC1 Amb27835307 [0,1,0,1,0,0|0,0,0]=2 12520 B9R1.85 CN(C)CCCC1CO1 Amb26858852 [0,1,0,1,0,0|2,0,0]=4 12521 B9R1.85 C[C@@H](N)CCCC1CC1 Amb33361296 [0,1,0,1,0,0|2,0,0]=4 12522 B9R1.85 C[C@@H](O)CCCC1CC1 Amb33361223 [0,1,0,1,0,0|1,0,0]=3 12523 B9R1.85 C[C@@H](O)CNCC1CC1 Amb28285299 [0,1,0,1,0,0|1,0,0]=3 12524 B9R1.85 C[C@H](N)CCCC1CC1 Amb33361291 [0,1,0,1,0,0|2,0,0]=4 12525 B9R1.85 C[C@H](N)CNCC1CC1 Amb27956499 [0,1,0,1,0,0|2,0,0]=4 12526 B9R1.85 C[C@H](O)CCCC1CC1 Amb33224926 [0,1,0,1,0,0|1,0,0]=3 12527 B9R1.85 C[C@H](O)COCC1CC1 Amb28397570 [0,1,0,1,0,0|0,0,0]=2 12528 B9R1.85 FC(F)CNCC1CC1 Amb20622636 [0,1,0,1,0,0|2,0,0]=4 12529 B9R1.85 FC(F)CNCC1CC1 Amb27412430 [0,1,0,1,0,0|2,0,0]=4 12530 B9R1.85 FC(F)COC[C@@H]1CO1 Amb28251816 [0,1,0,1,0,0|2,0,0]=4 12531 B9R1.85 FC(F)COC[C@H]1CO1 Amb27454281 [0,1,0,1,0,0|2,0,0]=4 12532 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,1,0,1,0,0|0,0,2]=4 12533 B9R1.85 NC(=S)COCC1CC1 Amb6681251 [0,1,0,1,0,0|0,1,1]=4 12534 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,1,0,1,0,0|1,0,1]=4 12535 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,1,0,1,0,0|1,0,1]=4 12536 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,1,0,1,0,0|1,0,1]=4 12537 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,1,0,1,0,0|0,0,1]=3 12538 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,1,0,1,0,0|0,1,1]=4 12539 B9R1.86 C=C(C)C[C@@H]1O[C@@H]1CCl Amb27422052 [0,1,0,1,0,0|1,0,1]=4 12540 B9R1.86 C=C(C)C[C@@H]1O[C@@H]1CO Amb28345314 [0,1,0,1,0,0|0,0,1]=3 12541 B9R1.86 C=C(C)C[C@H]1O[C@@H]1CO Amb27257205 [0,1,0,1,0,0|0,0,1]=3 12542 B9R1.86 C=C[C@@H]1O[C@H]1C[C@@H](C)O Amb28455099 [0,1,0,1,0,0|1,0,1]=4 12543 B9R1.86 C=C[C@H]1O[C@@H]1C[C@H](C)O Amb28400682 [0,1,0,1,0,0|1,0,1]=4 12544 B9R1.86 C=C[C@H]1O[C@H]1C[C@@H](C)O Amb28197642 [0,1,0,1,0,0|1,0,1]=4 12545 B9R1.86 CC(C)CC1CC1CCl Amb27838523 [0,1,0,1,0,0|2,0,0]=4 12546 B9R1.86 CC(C)CC1OC1C=O Amb27838606 [0,1,0,1,0,0|0,0,2]=4 12547 B9R1.86 CC(C)CC1OC1CO Amb25885601 [0,1,0,1,0,0|0,0,0]=2 12548 B9R1.86 CC(C)C[C@@H]1C[C@H]1CBr Amb27213690 [0,1,0,1,0,0|2,0,0]=4 12549 B9R1.86 CC(C)C[C@@H]1C[C@H]1CN Amb26895733 [0,1,0,1,0,0|2,0,0]=4 12550 B9R1.86 CC(C)C[C@@H]1O[C@@H]1CO Amb27651703 [0,1,0,1,0,0|0,0,0]=2 12551 B9R1.86 CC(C)NC1CC1CO Amb28063375 [0,1,0,1,0,0|2,0,0]=4 12552 B9R1.86 CC(C)N[C@@H]1C[C@H]1CO Amb27978182 [0,1,0,1,0,0|2,0,0]=4 12553 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,1,0,1,0,0|1,0,1]=4 12554 B9R1.86 CCC1OC1CC(C)O Amb28285301 [0,1,0,1,0,0|1,0,0]=3 12555 B9R1.86 CCC1OC1CC(O)O Amb27980594 [0,1,0,1,0,0|2,0,0]=4 12556 B9R1.86 CC[C@H]1O[C@H]1C[C@@H](C)O Amb27196630 [0,1,0,1,0,0|1,0,0]=3 12557 B9R1.86 CC[C@H]1O[C@H]1C[C@H](C)O Amb28430621 [0,1,0,1,0,0|1,0,0]=3 12558 B9R1.86 C[C@@H](O)C[C@@H]1O[C@@H]1CO Amb27451436 [0,1,0,1,0,0|0,0,0]=2 12559 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [0,1,0,1,0,0|1,0,1]=4 12560 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [0,1,0,1,0,0|1,0,1]=4 12561 B9R1.96 CCC1NCC1C(C)C Amb27249802 [0,1,0,1,0,0|2,0,0]=4 12562 B9R1.96 CN(C)C1CCC1CO Amb25783398 [0,1,0,1,0,0|2,0,0]=4 12563 B9R1.96 CN(C)[C@@H]1CC[C@@H]1CO Amb26970256 [0,1,0,1,0,0|2,0,0]=4 12564 B9R1.96 CN(C)[C@@H]1CC[C@H]1CO Amb27856834 [0,1,0,1,0,0|2,0,0]=4 12565 B9R1.96 CN(C)[C@H]1CC[C@H]1CO Amb34912849 [0,1,0,1,0,0|2,0,0]=4 12566 B9R1.96 C[C@@H](O)[C@@H]1C=C[C@@H]1CO Amb27660278 [0,1,0,1,0,0|1,0,1]=4 12567 B9R1.148 CC1(C)C=COCCO1 Amb30621781 [0,1,0,1,0,0|0,0,2]=4 12568 B9R1.148 CC1(C)CCCCCN1 Amb18832660 [0,1,0,1,0,0|2,0,0]=4 12569 B9R1.148 CC1(C)CCCCNC1 Amb24611736 [0,1,0,1,0,0|2,0,0]=4 12570 B9R1.148 CC1(C)CCCNCC1 Amb18832664 [0,1,0,1,0,0|2,0,0]=4 12571 B9R1.148 CC1(C)CCCNCC1 Amb33715839 [0,1,0,1,0,0|2,0,0]=4 12572 B9R1.148 CC1(C)CCNCCO1 Amb23585285 [0,1,0,1,0,0|1,0,0]=3 12573 B9R1.148 CC1(C)CCNCCO1 Amb31156505 [0,1,0,1,0,0|1,0,0]=3 12574 B9R1.148 CC1(C)CCNCCS1 Amb22642029 [0,1,0,1,0,0|1,1,0]=4 12575 B9R1.148 CC1(C)CNCCCO1 Amb33547983 [0,1,0,1,0,0|2,0,0]=4 12576 B9R1.148 CC1(C)CNCCCO1 Amb9455116 [0,1,0,1,0,0|2,0,0]=4 12577 B9R1.148 CC1(C)CNCCOC1 Amb28400043 [0,1,0,1,0,0|2,0,0]=4 12578 B9R1.148 CC1(C)CNCCOC1 Amb30585220 [0,1,0,1,0,0|2,0,0]=4 12579 B9R1.148 CC1(C)COCCCN1 Amb32412055 [0,1,0,1,0,0|2,0,0]=4 12580 B9R1.148 CC1(F)CCCCNC1 Amb22886308 [0,1,0,1,0,0|2,0,0]=4 12581 B9R1.148 CC1(F)CCCCNC1 Amb24672176 [0,1,0,1,0,0|2,0,0]=4 12582 B9R1.148 CC1(F)CCCNCC1 Amb22886292 [0,1,0,1,0,0|2,0,0]=4 12583 B9R1.148 CC1(F)CNCCOC1 Amb22886366 [0,1,0,1,0,0|2,0,0]=4 12584 B9R1.148 CC1(F)CNCCOC1 Amb27966187 [0,1,0,1,0,0|2,0,0]=4 12585 B9R1.148 CC1(N)CCCCCC1 Amb13952349 [0,1,0,1,0,0|2,0,0]=4 12586 B9R1.148 CC1(N)CCCCCC1 Amb9676104 [0,1,0,1,0,0|2,0,0]=4 12587 B9R1.148 CC1(O)CCCCCC1 Amb4017691 [0,1,0,1,0,0|1,0,0]=3 12588 B9R1.148 CC1(O)CCCCNC1 Amb22886278 [0,1,0,1,0,0|1,0,0]=3 12589 B9R1.148 CC1(O)CCCNCC1 Amb19516809 [0,1,0,1,0,0|2,0,0]=4 12590 B9R1.148 CC1(O)CCCNCC1 Amb22886914 [0,1,0,1,0,0|2,0,0]=4 12591 B9R1.148 CC1(O)CCCNCC1 Amb32409389 [0,1,0,1,0,0|2,0,0]=4 12592 B9R1.148 CC1(O)CCCOCC1 Amb20669018 [0,1,0,1,0,0|1,0,0]=3 12593 B9R1.148 CC1(O)CCCSCC1 Amb35692681 [0,1,0,1,0,0|1,1,0]=4 12594 B9R1.148 CC1(O)CNCCNC1 Amb26415500 [0,1,0,1,0,0|2,0,0]=4 12595 B9R1.148 CC1(O)CNCCNC1 Amb35753060 [0,1,0,1,0,0|2,0,0]=4 12596 B9R1.148 CC1(O)CNCCOC1 Amb22886368 [0,1,0,1,0,0|1,0,0]=3 12597 B9R1.148 CC1(O)CNCCOC1 Amb28052933 [0,1,0,1,0,0|1,0,0]=3 12598 B9R1.148 CC1(O)COCCOC1 Amb27816113 [0,1,0,1,0,0|1,0,0]=3 12599 B9R1.148 FC1(F)CCCCCC1 Amb26917791 [0,1,0,1,0,0|2,0,0]=4 12600 B9R1.148 FC1(F)CCCCNC1 Amb22886425 [0,1,0,1,0,0|2,0,0]=4 12601 B9R1.148 FC1(F)CCCCNC1 Amb27175157 [0,1,0,1,0,0|2,0,0]=4 12602 B9R1.148 FC1(F)CNCCOC1 Amb22886689 [0,1,0,1,0,0|2,0,0]=4 12603 B9R1.148 FC1(F)CNCCOC1 Amb26994377 [0,1,0,1,0,0|2,0,0]=4 12604 B9R2.24 BrC1C2CCC1CC2 Amb16231050 [0,0,0,2,0,0|2,0,0]=4 12605 B9R2.24 BrC1C2CCC1NC2 Amb2696783 [0,0,0,2,0,0|2,0,0]=4 12606 B9R2.24 CC1C2CCC1NC2 Amb28255827 [0,0,0,2,0,0|2,0,0]=4 12607 B9R2.24 FC1[C@@H]2CO[C@H]1CN2 Amb33715741 [0,0,0,2,0,0|2,0,0]=4 12608 B9R2.24 NC1C2CCC1CC2 Amb18641658 [0,0,0,2,0,0|2,0,0]=4 12609 B9R2.24 NC1C2CCC1NC2 Amb27234458 [0,0,0,2,0,0|2,0,0]=4 12610 B9R2.24 OC1C2C=CC1CC2 Amb24745608 [0,0,0,2,0,0|1,0,1]=4 12611 B9R2.24 OC1C2CCC1CC2 Amb28292506 [0,0,0,2,0,0|1,0,0]=3 12612 B9R2.24 OC1C2CCC1NC2 Amb32412678 [0,0,0,2,0,0|1,0,0]=3 12613 B9R2.24 OC1C2COC1CN2 Amb25933713 [0,0,0,2,0,0|1,0,0]=3 12614 B9R2.24 OC1[C@@H]2CC[C@H]1NC2 Amb28131683 [0,0,0,2,0,0|1,0,0]=3 12615 B9R2.24 OC1[C@@H]2CO[C@H]1CN2 Amb33715745 [0,0,0,2,0,0|1,0,0]=3 12616 B9R2.24 O[C@@H]1[C@@H]2CO[C@H]1CN2 Amb27959361 [0,0,0,2,0,0|1,0,0]=3 12617 B9R2.24 O[C@@H]1[C@@H]2CO[C@H]1CN2 Amb33620309 [0,0,0,2,0,0|1,0,0]=3 12618 B9R2.24 O[C@H]1[C@H]2CO[C@@H]1CN2 Amb25970869 [0,0,0,2,0,0|1,0,0]=3 12619 B9R2.24 O[C@H]1[C@H]2CO[C@@H]1CN2 Amb33742927 [0,0,0,2,0,0|1,0,0]=3 12620 B9R2.47 BrCC1CC2CC2C1 Amb25968747 [0,0,0,2,0,0|2,0,0]=4 12621 B9R2.47 BrCC1C[C@@H]2C[C@@H]2C1 Amb25711595 [0,0,0,2,0,0|2,0,0]=4 12622 B9R2.47 BrC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741740 [0,0,0,2,0,0|2,0,0]=4 12623 B9R2.47 CCC1CC2CC2N1 Amb27411817 [0,0,0,2,0,0|2,0,0]=4 12624 B9R2.47 CC[C@H]1C[C@@H]2C[C@@H]2N1 Amb27446310 [0,0,0,2,0,0|2,0,0]=4 12625 B9R2.47 ClCC1CC2CC2C1 Amb27413244 [0,0,0,2,0,0|2,0,0]=4 12626 B9R2.47 ClC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb27494544 [0,0,0,2,0,0|2,0,0]=4 12627 B9R2.47 ICC1CC2CC2C1 Amb35617884 [0,0,0,2,0,0|2,0,0]=4 12628 B9R2.47 NCC1CC2CC2C1 Amb26959092 [0,0,0,2,0,0|2,0,0]=4 12629 B9R2.47 NCC1CC2CC2C1 Amb32665069 [0,0,0,2,0,0|2,0,0]=4 12630 B9R2.47 NC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741986 [0,0,0,2,0,0|2,0,0]=4 12631 B9R2.47 OCC1CC2CC2C1 Amb25809340 [0,0,0,2,0,0|1,0,0]=3 12632 B9R2.47 OCC1C[C@@H]2C[C@@H]2C1 Amb34915367 [0,0,0,2,0,0|1,0,0]=3 12633 B9R2.47 OC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb28454137 [0,0,0,2,0,0|1,0,0]=3 12634 B9R2.47 OC[C@@H]1C[C@@H]2O[C@@H]2C1 Amb25854390 [0,0,0,2,0,0|2,0,0]=4 12635 B9R2.47 OC[C@H]1C[C@@H]2O[C@@H]2C1 Amb28120562 [0,0,0,2,0,0|2,0,0]=4 12636 B9R2.47 SCC1CC2CC2C1 Amb29849578 [0,0,0,2,0,0|1,1,0]=4 12637 B9R2.49 C1CC2CCC1CN2 Amb22728599 [0,0,0,2,0,0|2,0,0]=4 12638 B9R2.49 C1CC2CCC1CN2 Amb27798997 [0,0,0,2,0,0|2,0,0]=4 12639 B9R2.49 C1CC2CCC1NO2 Amb32660466 [0,0,0,2,0,0|2,0,0]=4 12640 B9R2.49 C1CC2CCC1NO2 Amb32668911 [0,0,0,2,0,0|2,0,0]=4 12641 B9R2.49 C1CC2CNC1CN2 Amb22749474 [0,0,0,2,0,0|2,0,0]=4 12642 B9R2.49 C1CC2CNC1CN2 Amb32663559 [0,0,0,2,0,0|2,0,0]=4 12643 B9R2.49 C1CC2CNC1CN2 Amb5719825 [0,0,0,2,0,0|2,0,0]=4 12644 B9R2.49 C1CC2CNC1CO2 Amb22886459 [0,0,0,2,0,0|1,0,0]=3 12645 B9R2.49 C1CC2CNC1CO2 Amb23440292 [0,0,0,2,0,0|1,0,0]=3 12646 B9R2.49 C1CC2CNC1CO2 Amb24120395 [0,0,0,2,0,0|1,0,0]=3 12647 B9R2.49 C1C[C@@H]2CN[C@H]1CN2 Amb25912133 [0,0,0,2,0,0|2,0,0]=4 12648 B9R2.49 C1C[C@@H]2CN[C@H]1CO2 Amb31204611 [0,0,0,2,0,0|1,0,0]=3 12649 B9R2.49 C1C[C@H]2CN[C@@H]1CN2 Amb10601644 [0,0,0,2,0,0|2,0,0]=4 12650 B9R2.49 C1C[C@H]2CN[C@@H]1CN2 Amb25912134 [0,0,0,2,0,0|2,0,0]=4 12651 B9R2.50 C1CC2CCC2CN1 Amb27487622 [0,0,0,2,0,0|2,0,0]=4 12652 B9R2.50 C1CC2CNC2CN1 Amb23555780 [0,0,0,2,0,0|2,0,0]=4 12653 B9R2.50 C1CC2COC2CN1 Amb23597837 [0,0,0,2,0,0|1,0,0]=3 12654 B9R2.50 C1CC2NCC2CO1 Amb27838366 [0,0,0,2,0,0|2,0,0]=4 12655 B9R2.50 C1CC2OCC2CN1 Amb23597836 [0,0,0,2,0,0|2,0,0]=4 12656 B9R2.50 C1CCC2NCC2C1 Amb7808805 [0,0,0,2,0,0|2,0,0]=4 12657 B9R2.50 C1CC[C@@H]2CN[C@H]2C1 Amb27880010 [0,0,0,2,0,0|2,0,0]=4 12658 B9R2.50 C1CC[C@H]2NC[C@H]2C1 Amb25168918 [0,0,0,2,0,0|2,0,0]=4 12659 B9R2.50 C1CN2CCC2CN1 Amb22011778 [0,0,0,2,0,0|2,0,0]=4 12660 B9R2.50 C1CNC2CCC2C1 Amb25976807 [0,0,0,2,0,0|2,0,0]=4 12661 B9R2.50 C1CNC2CCC2C1 Amb33457500 [0,0,0,2,0,0|2,0,0]=4 12662 B9R2.50 C1CNC2CCC2N1 Amb28071587 [0,0,0,2,0,0|2,0,0]=4 12663 B9R2.50 C1CNC2CCC2N1 Amb35789224 [0,0,0,2,0,0|2,0,0]=4 12664 B9R2.50 C1CNC2CNC2C1 Amb28198250 [0,0,0,2,0,0|2,0,0]=4 12665 B9R2.50 C1CN[C@@H]2CC[C@@H]2C1 Amb33457600 [0,0,0,2,0,0|2,0,0]=4 12666 B9R2.50 C1CN[C@@H]2CN[C@@H]2C1 Amb33097362 [0,0,0,2,0,0|2,0,0]=4 12667 B9R2.50 C1CN[C@H]2CC[C@H]2C1 Amb35745819 [0,0,0,2,0,0|2,0,0]=4 12668 B9R2.50 C1CSC2CCC2N1 Amb28645063 [0,0,0,2,0,0|1,1,0]=4 12669 B9R2.50 C1CSC2CCC2N1 Amb32667276 [0,0,0,2,0,0|1,1,0]=4 12670 B9R2.50 C1C[C@@H]2CO[C@@H]2CN1 Amb32667389 [0,0,0,2,0,0|1,0,0]=3 12671 B9R2.50 C1C[C@@H]2OC[C@@H]2CN1 Amb25938204 [0,0,0,2,0,0|2,0,0]=4 12672 B9R2.50 C1C[C@H]2CC[C@H]2CN1 Amb27661803 [0,0,0,2,0,0|2,0,0]=4 12673 B9R2.50 C1C[C@H]2CO[C@H]2CN1 Amb27445082 [0,0,0,2,0,0|1,0,0]=3 12674 B9R2.53 OC1C2CNCC1C2 Amb19148665 [0,0,0,2,0,0|2,0,0]=4 12675 B9R2.53 OC1C2CNCC1C2 Amb22899728 [0,0,0,2,0,0|2,0,0]=4 12676 B9R2.56 BrCC12CCCC1C2 Amb27779920 [0,0,0,2,0,0|2,0,0]=4 12677 B9R2.56 BrCC12COCC1C2 Amb29889426 [0,0,0,2,0,0|2,0,0]=4 12678 B9R2.56 CCC12CNCC1C2 Amb30526863 [0,0,0,2,0,0|2,0,0]=4 12679 B9R2.56 CC[C@@]12CNC[C@@H]1C2 Amb30526978 [0,0,0,2,0,0|2,0,0]=4 12680 B9R2.56 CC[C@@]12CNC[C@@H]1C2 Amb35788721 [0,0,0,2,0,0|2,0,0]=4 12681 B9R2.56 ClCC12CCCC1C2 Amb30017462 [0,0,0,2,0,0|2,0,0]=4 12682 B9R2.56 ClCC12COCC1C2 Amb35657637 [0,0,0,2,0,0|2,0,0]=4 12683 B9R2.56 NCC12CCCC1C2 Amb35701821 [0,0,0,2,0,0|2,0,0]=4 12684 B9R2.56 NCC12COCC1C2 Amb24555663 [0,0,0,2,0,0|2,0,0]=4 12685 B9R2.56 NC[C@@]12CCC[C@@H]1C2 Amb35745880 [0,0,0,2,0,0|2,0,0]=4 12686 B9R2.56 NC[C@@]12COC[C@@H]1C2 Amb32680446 [0,0,0,2,0,0|2,0,0]=4 12687 B9R2.56 NC[C@]12CCC[C@H]1C2 Amb32681937 [0,0,0,2,0,0|2,0,0]=4 12688 B9R2.56 OCC12CC1CCN2 Amb18278269 [0,0,0,2,0,0|1,0,0]=3 12689 B9R2.56 OCC12CC1CCO2 Amb27399219 [0,0,0,2,0,0|0,0,0]=2 12690 B9R2.56 OCC12CCCC1C2 Amb28077781 [0,0,0,2,0,0|1,0,0]=3 12691 B9R2.56 OCC12CCCC1O2 Amb28185076 [0,0,0,2,0,0|0,0,0]=2 12692 B9R2.56 OCC12CNCC1C2 Amb23440140 [0,0,0,2,0,0|2,0,0]=4 12693 B9R2.56 OCC12CNCC1C2 Amb23440141 [0,0,0,2,0,0|2,0,0]=4 12694 B9R2.56 OCC12COCC1C2 Amb25847035 [0,0,0,2,0,0|2,0,0]=4 12695 B9R2.56 OC[C@@]12CCC[C@@H]1O2 Amb27852748 [0,0,0,2,0,0|0,0,0]=2 12696 B9R2.56 OC[C@@]12CNC[C@@H]1C2 Amb22757897 [0,0,0,2,0,0|2,0,0]=4 12697 B9R2.56 OC[C@@]12C[C@@H]1CCO2 Amb28207361 [0,0,0,2,0,0|0,0,0]=2 12698 B9R2.56 OC[C@]12CCC[C@H]1C2 Amb32679249 [0,0,0,2,0,0|1,0,0]=3 12699 B9R2.56 OC[C@]12CNC[C@H]1C2 Amb27631383 [0,0,0,2,0,0|2,0,0]=4 12700 B9R2.56 OC[C@]12COC[C@H]1C2 Amb25954636 [0,0,0,2,0,0|2,0,0]=4 12701 B9R2.56 OC[C@]12C[C@@H]1CCN2 Amb6893191 [0,0,0,2,0,0|1,0,0]=3 12702 B9R2.65 BrCC1C2CCCC12 Amb25060211 [0,0,0,2,0,0|2,0,0]=4 12703 B9R2.65 CNC1C2CCOC21 Amb27437374 [0,0,0,2,0,0|2,0,0]=4 12704 B9R2.65 NCC1C2CCCC12 Amb26047449 [0,0,0,2,0,0|2,0,0]=4 12705 B9R2.65 NCC1C2CCCC12 Amb35750971 [0,0,0,2,0,0|2,0,0]=4 12706 B9R2.65 NCC1C2CCOC12 Amb23449251 [0,0,0,2,0,0|2,0,0]=4 12707 B9R2.65 OCC1C2CCCC12 Amb26542427 [0,0,0,2,0,0|1,0,0]=3 12708 B9R2.65 OCC1C2CCSC12 Amb28122980 [0,0,0,2,0,0|2,0,0]=4 12709 B9R2.65 OCC1C2CNCC12 Amb24112955 [0,0,0,2,0,0|2,0,0]=4 12710 B9R2.65 OCC1C2COCC12 Amb26564535 [0,0,0,2,0,0|2,0,0]=4 12711 B9R2.65 OCC1C2CSCC12 Amb27782205 [0,0,0,2,0,0|2,0,0]=4 12712 B9R2.65 OCC1[C@@H]2COC[C@@H]12 Amb33715904 [0,0,0,2,0,0|2,0,0]=4 12713 B9R2.65 OCC1[C@@H]2COC[C@H]12 Amb26398320 [0,0,0,2,0,0|2,0,0]=4 12714 B9R2.65 OCC1[C@H]2CNC[C@@H]12 Amb22745856 [0,0,0,2,0,0|2,0,0]=4 12715 B9R2.65 OCC1[C@H]2CNC[C@H]12 Amb34915265 [0,0,0,2,0,0|2,0,0]=4 12716 B9R2.65 OCC1[C@H]2COC[C@H]12 Amb25981071 [0,0,0,2,0,0|2,0,0]=4 12717 B9R2.65 OC[C@@H]1[C@@H]2COC[C@@H]21 Amb23439355 [0,0,0,2,0,0|2,0,0]=4 12718 B9R2.65 OC[C@@H]1[C@H]2CNC[C@H]21 Amb7970109 [0,0,0,2,0,0|2,0,0]=4 12719 B9R2.65 OC[C@H]1[C@@H]2COC[C@H]12 Amb27980393 [0,0,0,2,0,0|2,0,0]=4 12720 B9R2.65 OC[C@H]1[C@H]2CCC[C@@H]12 Amb27753115 [0,0,0,2,0,0|1,0,0]=3 12721 B9R2.65 OC[C@H]1[C@H]2CNC[C@@H]12 Amb25976432 [0,0,0,2,0,0|2,0,0]=4 12722 B9R2.65 OC[C@H]1[C@H]2CNC[C@@H]12 Amb32643979 [0,0,0,2,0,0|2,0,0]=4 12723 B9R2.68 C1CC2CC(CN2)N1 Amb34148837 [0,0,0,2,0,0|2,0,0]=4 12724 B9R2.68 C1CC2CC(CO2)N1 Amb32679437 [0,0,0,2,0,0|1,0,0]=3 12725 B9R2.68 C1CC2CC(CO2)N1 Amb33088016 [0,0,0,2,0,0|1,0,0]=3 12726 B9R2.68 C1CC2CCC(C1)N2 Amb10610725 [0,0,0,2,0,0|2,0,0]=4 12727 B9R2.68 C1CC2CCC(C1)N2 Amb19374849 [0,0,0,2,0,0|2,0,0]=4 12728 B9R2.68 C1CC2CCC(C1)O2 Amb22364980 [0,0,0,2,0,0|1,0,0]=3 12729 B9R2.68 C1CC2CCC(C2)N1 Amb18641674 [0,0,0,2,0,0|2,0,0]=4 12730 B9R2.68 C1CC2CCC(C2)N1 Amb35789676 [0,0,0,2,0,0|2,0,0]=4 12731 B9R2.68 C1CC2CCN(C1)C2 Amb27872310 [0,0,0,2,0,0|2,0,0]=4 12732 B9R2.68 C1CC2CNC(C1)C2 Amb3941214 [0,0,0,2,0,0|2,0,0]=4 12733 B9R2.68 C1CC2CNCC1C2 Amb10608778 [0,0,0,2,0,0|2,0,0]=4 12734 B9R2.68 C1CC2CNCC1C2 Amb18124234 [0,0,0,2,0,0|2,0,0]=4 12735 B9R2.68 C1CC2CNCC1N2 Amb18641717 [0,0,0,2,0,0|2,0,0]=4 12736 B9R2.68 C1CC2CNCC1N2 Amb20171180 [0,0,0,2,0,0|2,0,0]=4 12737 B9R2.68 C1CC2CNCC1O2 Amb16231394 [0,0,0,2,0,0|1,0,0]=3 12738 B9R2.68 C1CC2CNCC1O2 Amb5719203 [0,0,0,2,0,0|1,0,0]=3 12739 B9R2.68 C1CC2CNCC1S2 Amb27838955 [0,0,0,2,0,0|1,1,0]=4 12740 B9R2.68 C1CC2COCC1N2 Amb13783963 [0,0,0,2,0,0|1,0,0]=3 12741 B9R2.68 C1CC2COCC1N2 Amb19516231 [0,0,0,2,0,0|1,0,0]=3 12742 B9R2.68 C1CC2CSCC1N2 Amb28048978 [0,0,0,2,0,0|1,1,0]=4 12743 B9R2.68 C1CC2CSCC1N2 Amb33465453 [0,0,0,2,0,0|1,1,0]=4 12744 B9R2.68 C1CN2CCC(C2)N1 Amb22586692 [0,0,0,2,0,0|2,0,0]=4 12745 B9R2.68 C1CN2CCC(C2)N1 Amb8009768 [0,0,0,2,0,0|2,0,0]=4 12746 B9R2.68 C1CN2CC[C@@H](C2)N1 Amb24575184 [0,0,0,2,0,0|2,0,0]=4 12747 B9R2.68 C1CN2CC[C@@H](C2)N1 Amb28990018 [0,0,0,2,0,0|2,0,0]=4 12748 B9R2.68 C1CN2CC[C@@H](C2)N1 Amb32409386 [0,0,0,2,0,0|2,0,0]=4 12749 B9R2.68 C1CN2CC[C@H](C2)N1 Amb22432488 [0,0,0,2,0,0|2,0,0]=4 12750 B9R2.68 C1CN2CC[C@H](C2)N1 Amb33726131 [0,0,0,2,0,0|2,0,0]=4 12751 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 Amb22405871 [0,0,0,2,0,0|2,0,0]=4 12752 B9R2.68 C1C[C@@H]2CNC[C@H]1O2 Amb13783695 [0,0,0,2,0,0|1,0,0]=3 12753 B9R2.68 C1C[C@@H]2CNC[C@H]1O2 Amb24477891 [0,0,0,2,0,0|1,0,0]=3 12754 B9R2.68 C1C[C@@H]2CN[C@H](C1)C2 Amb34915801 [0,0,0,2,0,0|2,0,0]=4 12755 B9R2.68 C1C[C@@H]2COC[C@H]1N2 Amb22224855 [0,0,0,2,0,0|1,0,0]=3 12756 B9R2.68 C1C[C@@H]2COC[C@H]1N2 Amb33524050 [0,0,0,2,0,0|1,0,0]=3 12757 B9R2.68 C1C[C@H]2CC[C@@H](C1)N2 Amb33523610 [0,0,0,2,0,0|2,0,0]=4 12758 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 Amb22757909 [0,0,0,2,0,0|2,0,0]=4 12759 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 Amb24392297 [0,0,0,2,0,0|2,0,0]=4 12760 B9R2.68 C1C[C@H]2CON(C1)C2 Amb27435263 [0,0,0,2,0,0|2,0,0]=4 12761 B9R2.68 C1C[C@H]2C[C@@H](C1)CN2 Amb23385228 [0,0,0,2,0,0|2,0,0]=4 12762 B9R2.68 C1NCC2CC1CO2 Amb19515653 [0,0,0,2,0,0|2,0,0]=4 12763 B9R2.68 C1NCC2CC1CO2 Amb28934885 [0,0,0,2,0,0|2,0,0]=4 12764 B9R2.68 C1NCC2OCC1O2 Amb27430335 [0,0,0,2,0,0|1,0,0]=3 12765 B9R2.70 NCC1CCC2CC12 Amb27431890 [0,0,0,2,0,0|2,0,0]=4 12766 B9R2.70 NCC1CCC2CC12 Amb32683368 [0,0,0,2,0,0|2,0,0]=4 12767 B9R2.70 NCC1CC[C@@H]2C[C@H]12 Amb32719896 [0,0,0,2,0,0|2,0,0]=4 12768 B9R2.70 NCC1NCC2CC21 Amb27600647 [0,0,0,2,0,0|2,0,0]=4 12769 B9R2.70 OCC1CCC2CC12 Amb27606531 [0,0,0,2,0,0|1,0,0]=3 12770 B9R2.70 OCC1NCC2CC21 Amb26896317 [0,0,0,2,0,0|1,0,0]=3 12771 B9R2.70 OCC1OCC2OC12 Amb26472451 [0,0,0,2,0,0|1,0,0]=3 12772 B9R2.70 OC[C@@H]1CC[C@@H]2C[C@H]12 Amb27665513 [0,0,0,2,0,0|1,0,0]=3 12773 B9R2.70 OC[C@@H]1NC[C@@H]2C[C@@H]21 Amb13886216 [0,0,0,2,0,0|1,0,0]=3 12774 B9R2.70 OC[C@@H]1NC[C@@H]2C[C@@H]21 Amb23439459 [0,0,0,2,0,0|1,0,0]=3 12775 B9R2.70 OC[C@@H]1NC[C@H]2C[C@H]21 Amb25235945 [0,0,0,2,0,0|1,0,0]=3 12776 B9R2.70 OC[C@@H]1NC[C@H]2C[C@H]21 Amb31291327 [0,0,0,2,0,0|1,0,0]=3 12777 B9R2.70 OC[C@@H]1OC[C@@H]2C[C@@H]21 Amb27213848 [0,0,0,2,0,0|0,0,0]=2 12778 B9R2.70 OC[C@@H]1OC[C@@H]2O[C@H]12 Amb27775958 [0,0,0,2,0,0|1,0,0]=3 12779 B9R2.70 OC[C@H]1NC[C@@H]2C[C@H]12 Amb27841081 [0,0,0,2,0,0|1,0,0]=3 12780 B9R2.70 OC[C@H]1NC[C@@H]2C[C@H]12 Amb33801198 [0,0,0,2,0,0|1,0,0]=3 12781 B9R2.70 OC[C@H]1NC[C@H]2C[C@@H]21 Amb34915144 [0,0,0,2,0,0|1,0,0]=3 12782 B9R2.70 OC[C@H]1NC[C@H]2C[C@H]21 Amb24519421 [0,0,0,2,0,0|1,0,0]=3 12783 B9R2.70 OC[C@H]1NC[C@H]2C[C@H]21 Amb33801096 [0,0,0,2,0,0|1,0,0]=3 12784 B9R2.70 OC[C@H]1OC[C@H]2O[C@@H]12 Amb27440859 [0,0,0,2,0,0|1,0,0]=3 12785 B9R2.123 BrC1C2CCCOC12 Amb26397309 [0,0,0,2,0,0|1,0,0]=3 12786 B9R2.123 Br[C@@H]1[C@H]2CCCC[C@H]21 Amb25279388 [0,0,0,2,0,0|2,0,0]=4 12787 B9R2.123 Br[C@@H]1[C@H]2CCCN[C@H]21 Amb35789074 [0,0,0,2,0,0|2,0,0]=4 12788 B9R2.123 Br[C@@H]1[C@H]2CCCN[C@H]21 Amb35789602 [0,0,0,2,0,0|2,0,0]=4 12789 B9R2.123 CC1C2CCCCC12 Amb22365158 [0,0,0,2,0,0|2,0,0]=4 12790 B9R2.123 CC1C2CCNCC12 Amb27797303 [0,0,0,2,0,0|2,0,0]=4 12791 B9R2.123 ClC1C2CCCCC12 Amb25337704 [0,0,0,2,0,0|2,0,0]=4 12792 B9R2.123 Cl[C@@H]1[C@H]2OCCO[C@H]21 Amb27409789 [0,0,0,2,0,0|1,0,0]=3 12793 B9R2.123 NC1C2CCCCC12 Amb20623881 [0,0,0,2,0,0|2,0,0]=4 12794 B9R2.123 NC1C2CCCCC12 Amb33528684 [0,0,0,2,0,0|2,0,0]=4 12795 B9R2.123 NC1C2CCCNC12 Amb18833089 [0,0,0,2,0,0|2,0,0]=4 12796 B9R2.123 NC1C2CCCOC12 Amb19372862 [0,0,0,2,0,0|1,0,0]=3 12797 B9R2.123 NC1C2CCCOC12 Amb32652682 [0,0,0,2,0,0|1,0,0]=3 12798 B9R2.123 NC1C2CCOCC12 Amb23538735 [0,0,0,2,0,0|2,0,0]=4 12799 B9R2.123 NC1C2CCOCC12 Amb31188260 [0,0,0,2,0,0|2,0,0]=4 12800 B9R2.123 NC1[C@H]2CCCC[C@@H]12 Amb28252466 [0,0,0,2,0,0|2,0,0]=4 12801 B9R2.123 NC1[C@H]2CCCN[C@@H]12 Amb27800094 [0,0,0,2,0,0|2,0,0]=4 12802 B9R2.123 NC1[C@H]2CCCO[C@@H]12 Amb27627430 [0,0,0,2,0,0|1,0,0]=3 12803 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb25113495 [0,0,0,2,0,0|2,0,0]=4 12804 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb32651659 [0,0,0,2,0,0|2,0,0]=4 12805 B9R2.123 N[C@H]1[C@@H]2CCCO[C@H]12 Amb32651663 [0,0,0,2,0,0|1,0,0]=3 12806 B9R2.123 N[C@H]1[C@@H]2CCCO[C@H]12 Amb32651664 [0,0,0,2,0,0|1,0,0]=3 12807 B9R2.123 OC1C2CCCCC12 Amb17593167 [0,0,0,2,0,0|1,0,0]=3 12808 B9R2.174 C1CC2(CCO1)CO2 Amb10976057 [0,0,0,2,0,0|2,0,0]=4 12809 B9R2.174 C1CC2(CCS1)CO2 Amb22896493 [0,0,0,2,0,0|2,0,0]=4 12810 B9R2.174 C1CCC2(CC1)CC2 Amb22231454 [0,0,0,2,0,0|2,0,0]=4 12811 B9R2.174 C1CCC2(CC1)CN2 Amb24117848 [0,0,0,2,0,0|2,0,0]=4 12812 B9R2.174 C1CCC2(CC1)CO2 Amb6892810 [0,0,0,2,0,0|1,0,0]=3 12813 B9R2.174 C1CCC2(CC1)CS2 Amb28061897 [0,0,0,2,0,0|1,1,0]=4 12814 B9R2.174 C1CCC2(CC2)NC1 Amb10607947 [0,0,0,2,0,0|2,0,0]=4 12815 B9R2.174 C1CCC2(CC2)NC1 Amb22586669 [0,0,0,2,0,0|2,0,0]=4 12816 B9R2.174 C1CNC2(CC2)CN1 Amb18203373 [0,0,0,2,0,0|2,0,0]=4 12817 B9R2.174 C1CNC2(CC2)CN1 Amb21962062 [0,0,0,2,0,0|2,0,0]=4 12818 B9R2.174 C1CNC2(CC2)CN1 Amb22406081 [0,0,0,2,0,0|2,0,0]=4 12819 B9R2.174 C1CNCC2(C1)CC2 Amb18833098 [0,0,0,2,0,0|2,0,0]=4 12820 B9R2.174 C1CNCC2(C1)CC2 Amb22754138 [0,0,0,2,0,0|2,0,0]=4 12821 B9R2.174 C1COC2(CC2)CN1 Amb22233784 [0,0,0,2,0,0|1,0,0]=3 12822 B9R2.174 C1COC2(CC2)CN1 Amb22284759 [0,0,0,2,0,0|1,0,0]=3 12823 B9R2.174 C1COCC2(C1)CO2 Amb27630068 [0,0,0,2,0,0|2,0,0]=4 12824 B9R2.174 C1COCC2(CC2)N1 Amb22752817 [0,0,0,2,0,0|1,0,0]=3 12825 B9R2.174 C1COCC2(CC2)N1 Amb23598562 [0,0,0,2,0,0|1,0,0]=3 12826 B9R2.174 C1CSCC2(CC2)N1 Amb27445929 [0,0,0,2,0,0|1,1,0]=4 12827 B9R2.174 C1NCC2(CC2)CO1 Amb27466559 [0,0,0,2,0,0|2,0,0]=4 12828 B9R2.6 CC12CC1CCCN2 Amb27173752 [0,0,0,2,0,0|2,0,0]=4 12829 B9R2.6 CC12CC=CCC1O2 Amb22365024 [0,0,0,2,0,0|1,0,1]=4 12830 B9R2.6 CC12CCCCC1O2 Amb17939278 [0,0,0,2,0,0|1,0,0]=3 12831 B9R2.6 CC12CCNCC1C2 Amb24183542 [0,0,0,2,0,0|2,0,0]=4 12832 B9R2.6 CC12CCNCC1C2 Amb25338129 [0,0,0,2,0,0|2,0,0]=4 12833 B9R2.6 CC12CCOCC1O2 Amb27872318 [0,0,0,2,0,0|0,0,0]=2 12834 B9R2.6 NC12CCCCC1C2 Amb25137276 [0,0,0,2,0,0|2,0,0]=4 12835 B9R2.6 NC12CCCCC1C2 Amb30585131 [0,0,0,2,0,0|2,0,0]=4 12836 B9R2.6 NC12CNCCC1C2 Amb33716340 [0,0,0,2,0,0|2,0,0]=4 12837 B9R2.6 N[C@]12CCCC[C@H]1C2 Amb27975720 [0,0,0,2,0,0|2,0,0]=4 12838 B9R2.6 OC12CCCCC1O2 Amb28077099 [0,0,0,2,0,0|2,0,0]=4 12839 B9R2.6 OC12CCNCC1C2 Amb19149081 [0,0,0,2,0,0|2,0,0]=4 12840 B9R2.6 OC12CCNCC1C2 Amb32662017 [0,0,0,2,0,0|2,0,0]=4 12841 B9R2.6 OC12CNCCC1C2 Amb19148517 [0,0,0,2,0,0|1,0,0]=3 12842 B9R2.6 OC12CNCCC1C2 Amb20669515 [0,0,0,2,0,0|1,0,0]=3 12843 B9R2.6 O[C@@]12CNCC[C@@H]1C2 Amb24550647 [0,0,0,2,0,0|1,0,0]=3 12844 B9R2.6 O[C@@]12CNCC[C@@H]1C2 Amb33249822 [0,0,0,2,0,0|1,0,0]=3 12845 B9R2.6 O[C@]12CCNC[C@H]1C2 Amb32667224 [0,0,0,2,0,0|2,0,0]=4 12846 B9R2.6 O[C@]12CCNC[C@H]1C2 Amb32667225 [0,0,0,2,0,0|2,0,0]=4 12847 B9R2.17 CC12CC1CCC2O Amb28285220 [0,0,0,2,0,0|1,0,0]=3 12848 B9R2.17 CC12OC1CCC2O Amb28043386 [0,0,0,2,0,0|2,0,0]=4 12849 B9R2.17 C[C@@]12C[C@@H]1CC[C@@H]2O Amb28321277 [0,0,0,2,0,0|1,0,0]=3 12850 B9R2.17 C[C@@]12O[C@@H]1CC[C@@H]2O Amb28061892 [0,0,0,2,0,0|2,0,0]=4 12851 B9R2.17 OC1CCC2CC12Br Amb27594739 [0,0,0,2,0,0|2,0,0]=4 12852 B9R2.17 OC1CC[C@H]2C[C@@]12Br Amb27216592 [0,0,0,2,0,0|2,0,0]=4 12853 B9R2.19 NC1CCC2CC1C2 Amb27630778 [0,0,0,2,0,0|2,0,0]=4 12854 B9R2.19 NC1CCC2CC1C2 Amb33330100 [0,0,0,2,0,0|2,0,0]=4 12855 B9R2.19 OC1C=CC2CC1C2 Amb28207135 [0,0,0,2,0,0|1,0,1]=4 12856 B9R2.19 OC1CCC2CC1C2 Amb27423100 [0,0,0,2,0,0|1,0,0]=3 12857 B9R2.19 O[C@@H]1CCC2CC1C2 Amb27461153 [0,0,0,2,0,0|1,0,0]=3 12858 B9R2.37 C[C@H]1[C@@H](O)C[C@H]2O[C@@H]12 Amb27234395 [0,0,0,2,0,0|2,0,0]=4 12859 B9R2.37 NC1C(O)CC2CC21 Amb27422789 [0,0,0,2,0,0|2,0,0]=4 12860 B9R2.37 OC1C(Br)CC2OC21 Amb27234453 [0,0,0,2,0,0|1,0,0]=3 12861 B9R2.37 O[C@@H]1[C@@H](Br)C[C@@H]2O[C@@H]21 Amb28245050 [0,0,0,2,0,0|1,0,0]=3 12862 B9R2.37 O[C@H]1C[C@H]2O[C@H]2[C@H]1O Amb27799762 [0,0,0,2,0,0|1,0,0]=3 12863 B9R2.39 BrC1CC2CCC1C2 Amb6365773 [0,0,0,2,0,0|2,0,0]=4 12864 B9R2.39 BrC1CC2CCC1O2 Amb25685922 [0,0,0,2,0,0|2,0,0]=4 12865 B9R2.39 Br[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27880716 [0,0,0,2,0,0|2,0,0]=4 12866 B9R2.39 Br[C@@H]1C[C@@H]2CC[C@H]1C2 Amb25934082 [0,0,0,2,0,0|2,0,0]=4 12867 B9R2.39 Br[C@@H]1C[C@H]2CC[C@@H]1C2 Amb26528019 [0,0,0,2,0,0|2,0,0]=4 12868 B9R2.39 Br[C@H]1C[C@@H]2CC[C@H]1C2 Amb25378969 [0,0,0,2,0,0|2,0,0]=4 12869 B9R2.39 Br[C@H]1C[C@H]2CC[C@H]1C2 Amb27215665 [0,0,0,2,0,0|2,0,0]=4 12870 B9R2.39 CC1CC2CCC1O2 Amb27202757 [0,0,0,2,0,0|1,0,0]=3 12871 B9R2.39 ClC1CC2CCC1C2 Amb22360712 [0,0,0,2,0,0|2,0,0]=4 12872 B9R2.39 ClC1C[C@@H]2CC[C@H]1C2 Amb27203372 [0,0,0,2,0,0|2,0,0]=4 12873 B9R2.39 Cl[C@H]1C[C@H]2CC[C@@H]1C2 Amb27436694 [0,0,0,2,0,0|2,0,0]=4 12874 B9R2.39 FC1CN2CCC1C2 Amb27406883 [0,0,0,2,0,0|2,0,0]=4 12875 B9R2.39 NC1CC2CCC1C2 Amb19374620 [0,0,0,2,0,0|2,0,0]=4 12876 B9R2.39 NC1CC2CCC1C2 Amb3371573 [0,0,0,2,0,0|2,0,0]=4 12877 B9R2.39 NC1CC2CCC1O2 Amb18833071 [0,0,0,2,0,0|2,0,0]=4 12878 B9R2.39 NC1CN2CCC1C2 Amb22831595 [0,0,0,2,0,0|2,0,0]=4 12879 B9R2.39 NC1CN2CCC1C2 Amb33804179 [0,0,0,2,0,0|2,0,0]=4 12880 B9R2.39 NC1CN2CC[C@@H]1C2 Amb27214143 [0,0,0,2,0,0|2,0,0]=4 12881 B9R2.39 NC1C[C@@H]2CC[C@H]1O2 Amb33191747 [0,0,0,2,0,0|2,0,0]=4 12882 B9R2.39 NC1C[C@H]2CC[C@@H]1C2 Amb27420147 [0,0,0,2,0,0|2,0,0]=4 12883 B9R2.39 N[C@@H]1CC2CCC1O2 Amb27154810 [0,0,0,2,0,0|2,0,0]=4 12884 B9R2.39 N[C@@H]1CN2CCC1C2 Amb20623302 [0,0,0,2,0,0|2,0,0]=4 12885 B9R2.39 N[C@@H]1CN2CC[C@@H]1C2 Amb22747500 [0,0,0,2,0,0|2,0,0]=4 12886 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 Amb22745923 [0,0,0,2,0,0|2,0,0]=4 12887 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 Amb22757963 [0,0,0,2,0,0|2,0,0]=4 12888 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1O2 Amb26892150 [0,0,0,2,0,0|2,0,0]=4 12889 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1O2 Amb30526895 [0,0,0,2,0,0|2,0,0]=4 12890 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24181889 [0,0,0,2,0,0|2,0,0]=4 12891 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 Amb3941691 [0,0,0,2,0,0|2,0,0]=4 12892 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1O2 Amb19515250 [0,0,0,2,0,0|2,0,0]=4 12893 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1O2 Amb30526909 [0,0,0,2,0,0|2,0,0]=4 12894 B9R2.39 N[C@H]1CC2CCC1O2 Amb19149282 [0,0,0,2,0,0|2,0,0]=4 12895 B9R2.39 N[C@H]1CN2CC[C@H]1C2 Amb24604315 [0,0,0,2,0,0|2,0,0]=4 12896 B9R2.39 N[C@H]1C[C@@H]2CCC1C2 Amb6753692 [0,0,0,2,0,0|2,0,0]=4 12897 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 Amb33871470 [0,0,0,2,0,0|2,0,0]=4 12898 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1O2 Amb26418078 [0,0,0,2,0,0|2,0,0]=4 12899 B9R2.39 N[C@H]1C[C@H]2CC[C@@H]1C2 Amb27420218 [0,0,0,2,0,0|2,0,0]=4 12900 B9R2.39 OC1CC2CC1CN2 Amb27461305 [0,0,0,2,0,0|2,0,0]=4 12901 B9R2.39 OC1CC2CC1CN2 Amb30633713 [0,0,0,2,0,0|2,0,0]=4 12902 B9R2.39 OC1CC2CCC1C2 Amb2780727 [0,0,0,2,0,0|1,0,0]=3 12903 B9R2.39 OC1CC2CCC1N2 Amb24482057 [0,0,0,2,0,0|2,0,0]=4 12904 B9R2.39 OC1CC2CCC1O2 Amb3428664 [0,0,0,2,0,0|2,0,0]=4 12905 B9R2.39 OC1CC2CC[C@H]1C2 Amb28079100 [0,0,0,2,0,0|1,0,0]=3 12906 B9R2.39 OC1CC2CNC1C2 Amb27229775 [0,0,0,2,0,0|2,0,0]=4 12907 B9R2.39 OC1CC2CNC1C2 Amb30869322 [0,0,0,2,0,0|2,0,0]=4 12908 B9R2.39 OC1CN2CCC1C2 Amb20623296 [0,0,0,2,0,0|1,0,0]=3 12909 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 Amb27962782 [0,0,0,2,0,0|1,0,0]=3 12910 B9R2.39 OC1C[C@H]2CC[C@@H]1O2 Amb27197696 [0,0,0,2,0,0|2,0,0]=4 12911 B9R2.39 OC1C[C@H]2C[C@@H]1CN2 Amb27790833 [0,0,0,2,0,0|2,0,0]=4 12912 B9R2.39 ON1C[C@@H]2CC[C@H]1C2 Amb25912114 [0,0,0,2,0,0|2,0,0]=4 12913 B9R2.39 O[C@@H]1CN2CCC1C2 Amb20623303 [0,0,0,2,0,0|1,0,0]=3 12914 B9R2.39 O[C@@H]1CN2CC[C@@H]1C2 Amb24553840 [0,0,0,2,0,0|1,0,0]=3 12915 B9R2.39 O[C@@H]1CN2CC[C@H]1C2 Amb25025128 [0,0,0,2,0,0|1,0,0]=3 12916 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27481081 [0,0,0,2,0,0|1,0,0]=3 12917 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb25222600 [0,0,0,2,0,0|2,0,0]=4 12918 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb34915143 [0,0,0,2,0,0|2,0,0]=4 12919 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23439253 [0,0,0,2,0,0|2,0,0]=4 12920 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb31291918 [0,0,0,2,0,0|2,0,0]=4 12921 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1O2 Amb33328659 [0,0,0,2,0,0|2,0,0]=4 12922 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 Amb24682880 [0,0,0,2,0,0|2,0,0]=4 12923 B9R2.39 O[C@@H]1C[C@H]2CCC1C2 Amb28455166 [0,0,0,2,0,0|1,0,0]=3 12924 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 Amb10844941 [0,0,0,2,0,0|1,0,0]=3 12925 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23439252 [0,0,0,2,0,0|2,0,0]=4 12926 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb25970068 [0,0,0,2,0,0|2,0,0]=4 12927 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1O2 Amb26972146 [0,0,0,2,0,0|2,0,0]=4 12928 B9R2.39 O[C@@H]1C[C@H]2CC[C@H]1N2 Amb26918517 [0,0,0,2,0,0|2,0,0]=4 12929 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Amb27850501 [0,0,0,2,0,0|2,0,0]=4 12930 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Amb33210366 [0,0,0,2,0,0|2,0,0]=4 12931 B9R2.39 O[C@H]1CC2CC[C@@H]1C2 Amb27853961 [0,0,0,2,0,0|1,0,0]=3 12932 B9R2.39 O[C@H]1CN2CC[C@H]1C2 Amb27970543 [0,0,0,2,0,0|1,0,0]=3 12933 B9R2.39 O[C@H]1C[C@@H]2CC[C@@H]1N2 Amb27201459 [0,0,0,2,0,0|2,0,0]=4 12934 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1C2 Amb24567063 [0,0,0,2,0,0|1,0,0]=3 12935 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 Amb27626546 [0,0,0,2,0,0|2,0,0]=4 12936 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 Amb33801109 [0,0,0,2,0,0|2,0,0]=4 12937 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1O2 Amb25332128 [0,0,0,2,0,0|2,0,0]=4 12938 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 Amb26892014 [0,0,0,2,0,0|2,0,0]=4 12939 B9R2.39 O[C@H]1C[C@@H]2CO[C@H]1C2 Amb27650456 [0,0,0,2,0,0|2,0,0]=4 12940 B9R2.39 O[C@H]1C[C@@H]2CS[C@@H]1C2 Amb27472437 [0,0,0,2,0,0|2,0,0]=4 12941 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 Amb27194950 [0,0,0,2,0,0|2,0,0]=4 12942 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CO2 Amb28064083 [0,0,0,2,0,0|2,0,0]=4 12943 B9R2.39 O[C@H]1C[C@H]2CC[C@@H]1C2 Amb3940163 [0,0,0,2,0,0|1,0,0]=3 12944 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 Amb27447299 [0,0,0,2,0,0|2,0,0]=4 12945 B9R2.39 O[C@H]1C[C@H]2CO[C@@H]1C2 Amb27805102 [0,0,0,2,0,0|2,0,0]=4 12946 B9R2.39 O[C@H]1C[C@H]2CO[C@H]1C2 Amb27221642 [0,0,0,2,0,0|2,0,0]=4 12947 B9R2.39 SC1CC2CCC1C2 Amb25359572 [0,0,0,2,0,0|1,1,0]=4 12948 B9R2.39 SC1CC2CCC1O2 Amb32874058 [0,0,0,2,0,0|2,0,0]=4 12949 B9R2.109 FC1CNCC2CC12 Amb25326678 [0,0,0,2,0,0|2,0,0]=4 12950 B9R2.109 F[C@H]1CNC[C@@H]2C[C@H]12 Amb27402176 [0,0,0,2,0,0|2,0,0]=4 12951 B9R2.109 NC1CCCC2CC12 Amb19375082 [0,0,0,2,0,0|2,0,0]=4 12952 B9R2.109 NC1CCCC2CC12 Amb32681181 [0,0,0,2,0,0|2,0,0]=4 12953 B9R2.109 NC1CCC[C@@H]2C[C@H]12 Amb27250144 [0,0,0,2,0,0|2,0,0]=4 12954 B9R2.109 NC1CCC[C@@H]2C[C@H]12 Amb32663452 [0,0,0,2,0,0|2,0,0]=4 12955 B9R2.109 NC1CCC[C@H]2C[C@@H]12 Amb27815166 [0,0,0,2,0,0|2,0,0]=4 12956 B9R2.109 NC1CCC[C@H]2C[C@@H]12 Amb32652158 [0,0,0,2,0,0|2,0,0]=4 12957 B9R2.109 N[C@H]1CCC[C@H]2O[C@@H]12 Amb27229997 [0,0,0,2,0,0|1,0,0]=3 12958 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,2,0,0|0,0,2]=4 12959 B9R2.109 OC1CCCC2CC12 Amb26963531 [0,0,0,2,0,0|1,0,0]=3 12960 B9R2.109 OC1CCCC2OC12 Amb28048992 [0,0,0,2,0,0|0,0,0]=2 12961 B9R2.109 OC1CCC[C@@H]2C[C@H]12 Amb27659888 [0,0,0,2,0,0|1,0,0]=3 12962 B9R2.109 OC1OCCC2OC12 Amb27245058 [0,0,0,2,0,0|1,0,0]=3 12963 B9R2.109 O[C@@H]1C=CC[C@H]2C[C@@H]12 Amb27790188 [0,0,0,2,0,0|1,0,1]=4 12964 B9R2.109 O[C@@H]1C=CC[C@H]2O[C@@H]12 Amb27422316 [0,0,0,2,0,0|0,0,2]=4 12965 B9R2.109 O[C@@H]1CCC[C@@H]2OC21 Amb28345140 [0,0,0,2,0,0|0,0,0]=2 12966 B9R2.109 O[C@@H]1CCC[C@@H]2O[C@@H]21 Amb27422297 [0,0,0,2,0,0|0,0,0]=2 12967 B9R2.109 O[C@@H]1CCC[C@H]2C[C@H]21 Amb27432134 [0,0,0,2,0,0|1,0,0]=3 12968 B9R2.109 O[C@@H]1CCC[C@H]2O[C@@H]12 Amb28318472 [0,0,0,2,0,0|0,0,0]=2 12969 B9R2.109 O[C@H]1C=CC[C@H]2C[C@H]21 Amb27219001 [0,0,0,2,0,0|1,0,1]=4 12970 B9R2.109 O[C@H]1CCCC2O[C@H]21 Amb27202508 [0,0,0,2,0,0|0,0,0]=2 12971 B9R2.109 O[C@H]1CCC[C@@H]2C[C@H]12 Amb27261725 [0,0,0,2,0,0|1,0,0]=3 12972 B9R2.109 O[C@H]1CCC[C@@H]2OC12 Amb28429404 [0,0,0,2,0,0|0,0,0]=2 12973 B9R2.109 O[C@H]1CCC[C@H]2C[C@@H]12 Amb27805079 [0,0,0,2,0,0|1,0,0]=3 12974 B9R2.109 O[C@H]1CCC[C@H]2O[C@@H]12 Amb27777251 [0,0,0,2,0,0|0,0,0]=2 12975 B9R2.109 SC1CCCC2CC12 Amb26316463 [0,0,0,2,0,0|1,1,0]=4 12976 B9R2.109 SC1CCC[C@@H]2C[C@H]12 Amb32788238 [0,0,0,2,0,0|1,1,0]=4 12977 B9R2.1 BrC1CC12CCCC2 Amb32649170 [0,0,0,2,0,0|2,0,0]=4 12978 B9R2.1 NC1CC12CCCC2 Amb17605510 [0,0,0,2,0,0|2,0,0]=4 12979 B9R2.1 NC1CC12CCCC2 Amb28934811 [0,0,0,2,0,0|2,0,0]=4 12980 B9R2.2 C1CC(C2CO2)CO1 Amb22757940 [0,0,0,2,0,0|2,0,0]=4 12981 B9R2.2 C1CC(C2CO2)CS1 Amb33141333 [0,0,0,2,0,0|2,0,0]=4 12982 B9R2.2 C1CC([C@@H]2CO2)CO1 Amb33420427 [0,0,0,2,0,0|2,0,0]=4 12983 B9R2.2 C1CC([C@@H]2CO2)CS1 Amb33344951 [0,0,0,2,0,0|2,0,0]=4 12984 B9R2.2 C1CC([C@H]2CO2)CO1 Amb33420409 [0,0,0,2,0,0|2,0,0]=4 12985 B9R2.2 C1CC([C@H]2CO2)CS1 Amb33344952 [0,0,0,2,0,0|2,0,0]=4 12986 B9R2.2 C1CCC(C2CO2)C1 Amb27655529 [0,0,0,2,0,0|1,0,0]=3 12987 B9R2.2 C1CCC([C@@H]2CO2)C1 Amb33315082 [0,0,0,2,0,0|1,0,0]=3 12988 B9R2.2 C1CCC([C@H]2CO2)C1 Amb33315083 [0,0,0,2,0,0|1,0,0]=3 12989 B9R2.2 C1CNC(C2CC2)C1 Amb19372940 [0,0,0,2,0,0|2,0,0]=4 12990 B9R2.2 C1CNC(C2CC2)C1 Amb9716012 [0,0,0,2,0,0|2,0,0]=4 12991 B9R2.2 C1CN[C@@H](C2CC2)C1 Amb27170744 [0,0,0,2,0,0|2,0,0]=4 12992 B9R2.2 C1CN[C@@H](C2CC2)C1 Amb35752734 [0,0,0,2,0,0|2,0,0]=4 12993 B9R2.2 C1CN[C@H](C2CC2)C1 Amb26515751 [0,0,0,2,0,0|2,0,0]=4 12994 B9R2.2 C1COC(C2CC2)O1 Amb24377650 [0,0,0,2,0,0|0,0,0]=2 12995 B9R2.2 C1COC(C2CO2)C1 Amb28346667 [0,0,0,2,0,0|2,0,0]=4 12996 B9R2.2 C1COC([C@@H]2CO2)C1 Amb33317957 [0,0,0,2,0,0|2,0,0]=4 12997 B9R2.2 C1COC([C@H]2CO2)C1 Amb33317995 [0,0,0,2,0,0|2,0,0]=4 12998 B9R2.2 C1CSC(C2CC2)N1 Amb28383188 [0,0,0,2,0,0|1,1,0]=4 12999 B9R2.2 C1CSC(C2CO2)C1 Amb33416209 [0,0,0,2,0,0|2,0,0]=4 13000 B9R2.2 C1CSC([C@@H]2CO2)C1 Amb33415035 [0,0,0,2,0,0|2,0,0]=4 13001 B9R2.2 C1CSC([C@H]2CO2)C1 Amb33415036 [0,0,0,2,0,0|2,0,0]=4 13002 B9R2.3 C1CC2CCCN2C1 Amb22371122 [0,0,0,2,0,0|2,0,0]=4 13003 B9R2.3 C1CC2CCNC2C1 Amb18641673 [0,0,0,2,0,0|2,0,0]=4 13004 B9R2.3 C1CC2CCNC2C1 Amb32651656 [0,0,0,2,0,0|2,0,0]=4 13005 B9R2.3 C1CC2CNCC2C1 Amb10604048 [0,0,0,2,0,0|2,0,0]=4 13006 B9R2.3 C1CC2CNCC2C1 Amb8387764 [0,0,0,2,0,0|2,0,0]=4 13007 B9R2.3 C1CC2CNCC2N1 Amb22235619 [0,0,0,2,0,0|2,0,0]=4 13008 B9R2.3 C1CC2CNCC2N1 Amb22490645 [0,0,0,2,0,0|2,0,0]=4 13009 B9R2.3 C1CC2CNCC2O1 Amb25743923 [0,0,0,2,0,0|1,0,0]=3 13010 B9R2.3 C1CC2CNCC2O1 Amb32661473 [0,0,0,2,0,0|1,0,0]=3 13011 B9R2.3 C1CC2CNOC2C1 Amb23512675 [0,0,0,2,0,0|2,0,0]=4 13012 B9R2.3 C1CC2COCC2N1 Amb22295819 [0,0,0,2,0,0|1,0,0]=3 13013 B9R2.3 C1CC2NCC[C@H]2C1 Amb27489269 [0,0,0,2,0,0|2,0,0]=4 13014 B9R2.3 C1CC2OCCC2N1 Amb24411464 [0,0,0,2,0,0|2,0,0]=4 13015 B9R2.3 C1CC2OCCC2O1 Amb28204365 [0,0,0,2,0,0|2,0,0]=4 13016 B9R2.3 C1CN2CCOC2O1 Amb4011646 [0,0,0,2,0,0|2,0,0]=4 13017 B9R2.3 C1C[C@@H]2CCN[C@@H]2C1 Amb25230592 [0,0,0,2,0,0|2,0,0]=4 13018 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 Amb22745958 [0,0,0,2,0,0|2,0,0]=4 13019 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 Amb28985813 [0,0,0,2,0,0|2,0,0]=4 13020 B9R2.3 C1C[C@@H]2CNC[C@@H]2N1 Amb27433017 [0,0,0,2,0,0|2,0,0]=4 13021 B9R2.3 C1C[C@@H]2CNC[C@@H]2O1 Amb22757949 [0,0,0,2,0,0|1,0,0]=3 13022 B9R2.3 C1C[C@@H]2CNC[C@@H]2O1 Amb25168863 [0,0,0,2,0,0|1,0,0]=3 13023 B9R2.3 C1C[C@@H]2CNC[C@H]2N1 Amb27646869 [0,0,0,2,0,0|2,0,0]=4 13024 B9R2.3 C1C[C@@H]2COC[C@H]2N1 Amb27871467 [0,0,0,2,0,0|1,0,0]=3 13025 B9R2.3 C1C[C@@H]2NCC[C@H]2C1 Amb18203381 [0,0,0,2,0,0|2,0,0]=4 13026 B9R2.3 C1C[C@@H]2OCC[C@@H]2N1 Amb22757961 [0,0,0,2,0,0|2,0,0]=4 13027 B9R2.3 C1C[C@@H]2OCC[C@@H]2N1 Amb26603053 [0,0,0,2,0,0|2,0,0]=4 13028 B9R2.3 C1C[C@H]2CCN[C@H]2C1 Amb25978362 [0,0,0,2,0,0|2,0,0]=4 13029 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 Amb26442837 [0,0,0,2,0,0|2,0,0]=4 13030 B9R2.3 C1C[C@H]2CNC[C@@H]2N1 Amb18833088 [0,0,0,2,0,0|2,0,0]=4 13031 B9R2.3 C1C[C@H]2COC[C@@H]2N1 Amb18833060 [0,0,0,2,0,0|1,0,0]=3 13032 B9R2.3 C1C[C@H]2CSC[C@@H]2N1 Amb18832543 [0,0,0,2,0,0|1,1,0]=4 13033 B9R2.3 C1C[C@H]2OCC[C@H]2N1 Amb27630968 [0,0,0,2,0,0|2,0,0]=4 13034 B9R2.3 C1C[C@H]2OCC[C@H]2N1 Amb33715419 [0,0,0,2,0,0|2,0,0]=4 13035 B9R2.3 C1NCC2COCC12 Amb18833061 [0,0,0,2,0,0|2,0,0]=4 13036 B9R2.3 C1NCC2COCC12 Amb22493837 [0,0,0,2,0,0|2,0,0]=4 13037 B9R2.3 C1NCC2ONCC12 Amb33719099 [0,0,0,2,0,0|2,0,0]=4 13038 B9R2.3 C1NC[C@@H]2COC[C@@H]12 Amb31308558 [0,0,0,2,0,0|2,0,0]=4 13039 B9R2.3 C1NC[C@@H]2COC[C@H]12 Amb22746773 [0,0,0,2,0,0|2,0,0]=4 13040 B9R2.3 C1NC[C@@H]2COC[C@H]12 Amb22747277 [0,0,0,2,0,0|2,0,0]=4 13041 B9R2.3 C1NO[C@@H]2COC[C@H]12 Amb33098626 [0,0,0,2,0,0|1,0,0]=3 13042 B9R2.3 C1OC2CNCC2O1 Amb27390498 [0,0,0,2,0,0|2,0,0]=4 13043 B9R2.3 C1OC2CNCC2O1 Amb28985746 [0,0,0,2,0,0|2,0,0]=4 13044 B9R2.3 C1O[C@H]2CNC[C@H]2O1 Amb27625723 [0,0,0,2,0,0|2,0,0]=4 13045 B9R2.3 C1O[C@H]2CNC[C@H]2O1 Amb33330566 [0,0,0,2,0,0|2,0,0]=4 13046 B9R2.7 NC1CC2CCCC12 Amb27834589 [0,0,0,2,0,0|2,0,0]=4 13047 B9R2.7 NC1CC2CCCC12 Amb30585129 [0,0,0,2,0,0|2,0,0]=4 13048 B9R2.7 NC1CC2CCOC12 Amb28128251 [0,0,0,2,0,0|1,0,0]=3 13049 B9R2.7 NC1CC2COCC12 Amb24483071 [0,0,0,2,0,0|2,0,0]=4 13050 B9R2.7 NC1C[C@H]2CCC[C@@H]12 Amb27438793 [0,0,0,2,0,0|2,0,0]=4 13051 B9R2.7 NC1C[C@H]2OCC[C@H]12 Amb27623147 [0,0,0,2,0,0|2,0,0]=4 13052 B9R2.7 N[C@@H]1C[C@@H]2COC[C@@H]21 Amb27963687 [0,0,0,2,0,0|2,0,0]=4 13053 B9R2.7 N[C@@H]1C[C@@H]2COC[C@@H]21 Amb32645873 [0,0,0,2,0,0|2,0,0]=4 13054 B9R2.7 N[C@@H]1C[C@@H]2OCC[C@@H]21 Amb22757948 [0,0,0,2,0,0|2,0,0]=4 13055 B9R2.7 N[C@@H]1C[C@H]2CCC[C@@H]12 Amb28131512 [0,0,0,2,0,0|2,0,0]=4 13056 B9R2.7 N[C@@H]1C[C@H]2OCC[C@@H]12 Amb22757936 [0,0,0,2,0,0|2,0,0]=4 13057 B9R2.7 N[C@@H]1C[C@H]2OCC[C@@H]12 Amb25207095 [0,0,0,2,0,0|2,0,0]=4 13058 B9R2.7 N[C@H]1C[C@@H]2CCO[C@H]12 Amb24579472 [0,0,0,2,0,0|1,0,0]=3 13059 B9R2.7 N[C@H]1C[C@H]2CCO[C@H]12 Amb24609864 [0,0,0,2,0,0|1,0,0]=3 13060 B9R2.7 N[C@H]1C[C@H]2OCC[C@@H]12 Amb26939926 [0,0,0,2,0,0|2,0,0]=4 13061 B9R2.7 O=C1CC2CCOC12 Amb27593836 [0,0,0,2,0,0|0,0,2]=4 13062 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [0,0,0,2,0,0|0,0,2]=4 13063 B9R2.7 OC1CC2=C1CCC2 Amb27481033 [0,0,0,2,0,0|1,0,1]=4 13064 B9R2.7 OC1CC2CCOC12 Amb27404596 [0,0,0,2,0,0|0,0,0]=2 13065 B9R2.7 OC1CC2CNCC12 Amb25376641 [0,0,0,2,0,0|2,0,0]=4 13066 B9R2.7 OC1CC2NCCC12 Amb27837982 [0,0,0,2,0,0|2,0,0]=4 13067 B9R2.7 OC1CC2OCCC12 Amb27830109 [0,0,0,2,0,0|2,0,0]=4 13068 B9R2.7 OC1C[C@@H]2CCO[C@H]12 Amb27970982 [0,0,0,2,0,0|0,0,0]=2 13069 B9R2.7 O[C@@H]1C[C@@H]2CCO[C@@H]21 Amb27194431 [0,0,0,2,0,0|0,0,0]=2 13070 B9R2.7 O[C@@H]1C[C@@H]2CNC[C@@H]21 Amb30526947 [0,0,0,2,0,0|2,0,0]=4 13071 B9R2.7 O[C@@H]1C[C@@H]2NCC[C@@H]21 Amb30526945 [0,0,0,2,0,0|2,0,0]=4 13072 B9R2.7 O[C@@H]1C[C@H]2CCC[C@@H]12 Amb27184164 [0,0,0,2,0,0|1,0,0]=3 13073 B9R2.7 O[C@@H]1C[C@H]2CNC[C@@H]12 Amb30526948 [0,0,0,2,0,0|2,0,0]=4 13074 B9R2.7 O[C@@H]1C[C@H]2NCC[C@@H]12 Amb27632497 [0,0,0,2,0,0|2,0,0]=4 13075 B9R2.7 O[C@@H]1C[C@H]2NCC[C@@H]12 Amb30526946 [0,0,0,2,0,0|2,0,0]=4 13076 B9R2.7 O[C@H]1C[C@H]2CC=C[C@@H]12 Amb27205200 [0,0,0,2,0,0|1,0,1]=4 13077 B9R2.7 O[C@H]1C[C@H]2CCC[C@@H]12 Amb27652942 [0,0,0,2,0,0|1,0,0]=3 13078 B9R2.7 SC1CC2CCCC12 Amb32788559 [0,0,0,2,0,0|1,1,0]=4 13079 B9R2.7 SC1CC2COCC12 Amb32788839 [0,0,0,2,0,0|2,0,0]=4 13080 B9R2.7 SC1CC2OCCC12 Amb32788792 [0,0,0,2,0,0|2,0,0]=4 13081 B9R2.7 SC1C[C@@H]2CCC[C@H]12 Amb32788104 [0,0,0,2,0,0|1,1,0]=4 13082 B9R2.7 SC1C[C@@H]2COC[C@H]12 Amb32788371 [0,0,0,2,0,0|2,0,0]=4 13083 B9R2.7 SC1C[C@@H]2OCC[C@H]12 Amb32788822 [0,0,0,2,0,0|2,0,0]=4 13084 B9R2.80 NCC1C2COC1C2 Amb27411832 [0,0,0,2,0,0|2,0,0]=4 13085 B9R2.80 OCC1C2CNC1C2 Amb27759371 [0,0,0,2,0,0|2,0,0]=4 13086 B9R2.173 C1CC2(C1)NCCO2 Amb32719247 [0,0,0,2,0,0|1,0,0]=3 13087 B9R2.173 C1CC2(C1)NCCS2 Amb27413243 [0,0,0,2,0,0|1,1,0]=4 13088 B9R2.173 C1CC2(C1)OCCO2 Amb27642084 [0,0,0,2,0,0|0,0,0]=2 13089 B9R2.173 C1CC2(CCO2)CN1 Amb21856698 [0,0,0,2,0,0|2,0,0]=4 13090 B9R2.173 C1CC2(CCO2)CN1 Amb22406281 [0,0,0,2,0,0|2,0,0]=4 13091 B9R2.173 C1CC2(CCO2)CN1 Amb28989531 [0,0,0,2,0,0|2,0,0]=4 13092 B9R2.173 C1CC2(CCO2)CN1 Amb32409426 [0,0,0,2,0,0|2,0,0]=4 13093 B9R2.173 C1CC2(CCO2)CN1 Amb33329470 [0,0,0,2,0,0|2,0,0]=4 13094 B9R2.173 C1CCC2(C1)CCC2 Amb6296982 [0,0,0,2,0,0|2,0,0]=4 13095 B9R2.173 C1CCC2(C1)CCN2 Amb21964937 [0,0,0,2,0,0|2,0,0]=4 13096 B9R2.173 C1CCC2(C1)CCN2 Amb32410097 [0,0,0,2,0,0|2,0,0]=4 13097 B9R2.173 C1CC[N+]2(C1)CCC2 Amb30666593 [0,0,0,2,0,0|2,0,0]=4 13098 B9R2.173 C1CNC2(C1)CCC2 Amb22229939 [0,0,0,2,0,0|2,0,0]=4 13099 B9R2.173 C1CNC2(C1)CCC2 Amb22406280 [0,0,0,2,0,0|2,0,0]=4 13100 B9R2.173 C1CNC2(C1)CCC2 Amb28934834 [0,0,0,2,0,0|2,0,0]=4 13101 B9R2.173 C1CNC2(C1)CCC2 Amb31307805 [0,0,0,2,0,0|2,0,0]=4 13102 B9R2.173 C1CNC2(C1)CCC2 Amb32683385 [0,0,0,2,0,0|2,0,0]=4 13103 B9R2.173 C1COC2(C1)CNC2 Amb22406130 [0,0,0,2,0,0|2,0,0]=4 13104 B9R2.173 C1COC2(C1)CNC2 Amb22736820 [0,0,0,2,0,0|2,0,0]=4 13105 B9R2.173 C1COC2(C1)CNC2 Amb22737537 [0,0,0,2,0,0|2,0,0]=4 13106 B9R2.173 C1COC2(C1)CNC2 Amb22757395 [0,0,0,2,0,0|2,0,0]=4 13107 B9R2.173 C1COC2(CNC2)O1 Amb33922080 [0,0,0,2,0,0|1,0,0]=3 13108 B9R2.173 C1COC2(COC2)N1 Amb33218288 [0,0,0,2,0,0|2,0,0]=4 13109 B9R2.173 C1CSC2(CNC2)O1 Amb27430350 [0,0,0,2,0,0|1,1,0]=4 13110 B9R2.11 CC1CC1C2CC2N Amb32674637 [0,0,0,2,0,0|2,0,0]=4 13111 B9R2.11 CC1CC1C2CC2N Amb32682424 [0,0,0,2,0,0|2,0,0]=4 13112 B9R2.11 CC1CC1[C@@H]2C[C@H]2N Amb33144657 [0,0,0,2,0,0|2,0,0]=4 13113 B9R2.11 C[C@@H]1C[C@H]1[C@@H]2C[C@H]2N Amb32682468 [0,0,0,2,0,0|2,0,0]=4 13114 B9R2.11 C[C@@H]1C[C@H]1[C@@H]2C[C@H]2N Amb32682469 [0,0,0,2,0,0|2,0,0]=4 13115 B9R2.12 CC1CC1CC2CO2 Amb33144969 [0,0,0,2,0,0|1,0,0]=3 13116 B9R2.12 NC1CC1CC2CC2 Amb33361459 [0,0,0,2,0,0|2,0,0]=4 13117 B9R2.12 N[C@@H]1C[C@H]1CC2CC2 Amb33361500 [0,0,0,2,0,0|2,0,0]=4 13118 B9R2.18 CC1C2COC(O)C12 Amb27634415 [0,0,0,2,0,0|2,0,0]=4 13119 B9R2.18 CC1[C@@H]2CC[C@H](O)[C@H]12 Amb28052862 [0,0,0,2,0,0|1,0,0]=3 13120 B9R2.18 C[C@@H]1[C@@H]2CO[C@@H](O)[C@@H]21 Amb27435976 [0,0,0,2,0,0|2,0,0]=4 13121 B9R2.18 C[C@H]1[C@@H]2CC[C@@H](O)[C@H]12 Amb28345451 [0,0,0,2,0,0|1,0,0]=3 13122 B9R2.21 CC1CCC2OC2C1 Amb1141335 [0,0,0,2,0,0|1,0,0]=3 13123 B9R2.21 ClC1CCC2CC2C1 Amb27233015 [0,0,0,2,0,0|2,0,0]=4 13124 B9R2.21 NC1CCC2CC2C1 Amb26367227 [0,0,0,2,0,0|2,0,0]=4 13125 B9R2.21 NC1CCC2CC2C1 Amb32664396 [0,0,0,2,0,0|2,0,0]=4 13126 B9R2.21 NC1CC[C@H]2C[C@H]2C1 Amb33191737 [0,0,0,2,0,0|2,0,0]=4 13127 B9R2.21 N[C@@H]1CC[C@@H]2C[C@@H]2C1 Amb28423376 [0,0,0,2,0,0|2,0,0]=4 13128 B9R2.21 OC1C=C[C@@H]2C[C@@H]2C1 Amb27197544 [0,0,0,2,0,0|1,0,1]=4 13129 B9R2.21 OC1CC2CC2CO1 Amb28065974 [0,0,0,2,0,0|2,0,0]=4 13130 B9R2.21 OC1CC[C@@H]2C[C@@H]2C1 Amb27857686 [0,0,0,2,0,0|1,0,0]=3 13131 B9R2.21 OC1CC[C@@H]2O[C@@H]2C1 Amb27775498 [0,0,0,2,0,0|2,0,0]=4 13132 B9R2.21 OC1CC[C@@H]2O[C@H]2C1 Amb27422479 [0,0,0,2,0,0|2,0,0]=4 13133 B9R2.21 O[C@@H]1C=C[C@H]2C[C@H]2C1 Amb28202543 [0,0,0,2,0,0|1,0,1]=4 13134 B9R2.21 O[C@@H]1CC[C@@H]2O[C@@H]2C1 Amb27448393 [0,0,0,2,0,0|2,0,0]=4 13135 B9R2.21 O[C@H]1CC[C@H]2C[C@H]2C1 Amb27978320 [0,0,0,2,0,0|1,0,0]=3 13136 B9R2.44 C[C@@H]1C[C@@]12CC2CO Amb27202583 [0,0,0,2,0,0|1,0,0]=3 13137 B9R2.44 C[C@H]1C[C@@]12C[C@@H]2CO Amb28206047 [0,0,0,2,0,0|1,0,0]=3 13138 B9R2.44 C[C@H]1C[C@@]12C[C@H]2CO Amb27422318 [0,0,0,2,0,0|1,0,0]=3 13139 B9R2.44 NC1CC12CC2CO Amb33756809 [0,0,0,2,0,0|2,0,0]=4 13140 B9R2.44 N[C@H]1C[C@@]12C[C@H]2CO Amb27880703 [0,0,0,2,0,0|2,0,0]=4 13141 B9R2.44 OC[C@H]1C[C@@]12C[C@H]2Br Amb27195042 [0,0,0,2,0,0|2,0,0]=4 13142 B9R2.52 C1CC2CC2CCN1 Amb18203386 [0,0,0,2,0,0|2,0,0]=4 13143 B9R2.52 C1CCC2CC2NC1 Amb18203388 [0,0,0,2,0,0|2,0,0]=4 13144 B9R2.52 C1CCC2NC2CC1 Amb10609123 [0,0,0,2,0,0|2,0,0]=4 13145 B9R2.52 C1CCC2OC2CC1 Amb9708770 [0,0,0,2,0,0|1,0,0]=3 13146 B9R2.52 C1CNCC2CC2C1 Amb18203387 [0,0,0,2,0,0|2,0,0]=4 13147 B9R2.52 C1OCC2OC2CO1 Amb25286617 [0,0,0,2,0,0|1,0,0]=3 13148 B9R2.108 CC1CC1C2CCN2 Amb33429790 [0,0,0,2,0,0|2,0,0]=4 13149 B9R2.108 NC1CC1C2CCC2 Amb24483254 [0,0,0,2,0,0|2,0,0]=4 13150 B9R2.108 NC1CC1C2CCC2 Amb32663894 [0,0,0,2,0,0|2,0,0]=4 13151 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb24581403 [0,0,0,2,0,0|2,0,0]=4 13152 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb32663923 [0,0,0,2,0,0|2,0,0]=4 13153 B9R2.20 Cl[C@@H]1CC[C@@H]2CC[C@@H]21 Amb27777148 [0,0,0,2,0,0|2,0,0]=4 13154 B9R2.20 Cl[C@H]1CC[C@@H]2CC[C@H]12 Amb27212344 [0,0,0,2,0,0|2,0,0]=4 13155 B9R2.20 NC1CCC2CCC12 Amb26043876 [0,0,0,2,0,0|2,0,0]=4 13156 B9R2.20 OC1OC[C@H]2CC[C@@H]12 Amb27213973 [0,0,0,2,0,0|2,0,0]=4 13157 B9R2.20 O[C@@H]1C=C[C@@H]2CC[C@H]12 Amb25252536 [0,0,0,2,0,0|1,0,1]=4 13158 B9R2.20 O[C@@H]1CC[C@@H]2C=C[C@H]12 Amb28435644 [0,0,0,2,0,0|1,0,1]=4 13159 B9R2.20 O[C@@H]1CC[C@H]2CC[C@@H]12 Amb27420440 [0,0,0,2,0,0|1,0,0]=3 13160 B9R2.20 O[C@H]1C=CC2CCC21 Amb26641999 [0,0,0,2,0,0|1,0,1]=4 13161 B9R2.20 O[C@H]1C=C[C@@H]2CC[C@@H]21 Amb24648863 [0,0,0,2,0,0|1,0,1]=4 13162 B9R2.20 O[C@H]1CC[C@@H]2CC[C@H]12 Amb28256395 [0,0,0,2,0,0|1,0,0]=3 13163 B9R2.20 O[C@H]1CC[C@H]2CC[C@@H]12 Amb27653200 [0,0,0,2,0,0|1,0,0]=3 13164 B9R2.20 SC1CCC2CCC12 Amb32788214 [0,0,0,2,0,0|1,1,0]=4 13165 B9R2.20 SC1CC[C@@H]2CC[C@H]12 Amb32788780 [0,0,0,2,0,0|1,1,0]=4 13166 B9R2.51 C1CC2CC(CN1)C2 Amb27224402 [0,0,0,2,0,0|2,0,0]=4 13167 B9R2.51 C1COC2CC(C2)N1 Amb32410253 [0,0,0,2,0,0|1,0,0]=3 13168 B9R2.91 C1CC(C2CCC2)C1 Amb27213025 [0,0,0,2,0,0|2,0,0]=4 13169 B9R2.91 C1CC(C2CCN2)C1 Amb27216687 [0,0,0,2,0,0|2,0,0]=4 13170 B9R2.91 C1CC(C2CCN2)C1 Amb33306998 [0,0,0,2,0,0|2,0,0]=4 13171 B9R2.91 C1CC(N2CCC2)C1 Amb28316009 [0,0,0,2,0,0|2,0,0]=4 13172 B9R2.91 C1CC([C@@H]2CCN2)C1 Amb28119940 [0,0,0,2,0,0|2,0,0]=4 13173 B9R2.140 NC1CCC12CCC2 Amb33620891 [0,0,0,2,0,0|2,0,0]=4 13174 B9R2.140 NC1CCC12CCC2 Amb8009831 [0,0,0,2,0,0|2,0,0]=4 13175 B9R2.140 O=C1COC12CCC2 Amb26079298 [0,0,0,2,0,0|0,0,2]=4 13176 B9R2.140 OC1CCC12CCC2 Amb26539171 [0,0,0,2,0,0|1,0,0]=3 13177 B9R2.140 OC1CCC12CNC2 Amb24564765 [0,0,0,2,0,0|2,0,0]=4 13178 B9R2.140 OC1CCC12CNC2 Amb31307904 [0,0,0,2,0,0|2,0,0]=4 13179 B9R2.140 OC1CCC12COC2 Amb25278821 [0,0,0,2,0,0|2,0,0]=4 13180 B9R2.153 BrCC1CC12CCC2 Amb28285214 [0,0,0,2,0,0|2,0,0]=4 13181 B9R2.153 ClCC1CC12CCC2 Amb27833213 [0,0,0,2,0,0|2,0,0]=4 13182 B9R2.153 N#CC1OC12CCC2 Amb27213312 [0,0,0,2,0,0|1,0,1]=4 13183 B9R2.153 NCC1CC12CCC2 Amb26411035 [0,0,0,2,0,0|2,0,0]=4 13184 B9R2.153 OCC1CC12CCC2 Amb26942513 [0,0,0,2,0,0|1,0,0]=3 13185 B9R2.153 OCC1CC12CSC2 Amb28436257 [0,0,0,2,0,0|2,0,0]=4 13186 B9R2.157 C1CC(CC2CC2)N1 Amb33230094 [0,0,0,2,0,0|2,0,0]=4 13187 B9R2.157 C1CC(CC2CO2)C1 Amb26390615 [0,0,0,2,0,0|1,0,0]=3 13188 B9R2.157 C1CC(NC2CC2)C1 Amb16230427 [0,0,0,2,0,0|2,0,0]=4 13189 B9R2.157 C1CC(NC2CC2)C1 Amb30585089 [0,0,0,2,0,0|2,0,0]=4 13190 B9R2.157 C1CC(OC2CC2)C1 Amb28316196 [0,0,0,2,0,0|1,0,0]=3 13191 B9R2.157 C1CC1OC2CNC2 Amb22642542 [0,0,0,2,0,0|2,0,0]=4 13192 B9R2.5 CC1CCCC12CO2 Amb24533573 [0,0,0,2,0,0|1,0,0]=3 13193 B9R2.5 CC1COCC12CO2 Amb29882957 [0,0,0,2,0,0|2,0,0]=4 13194 B9R2.5 CC1CSCC12CO2 Amb33731417 [0,0,0,2,0,0|2,0,0]=4 13195 B9R2.5 CC1OCCC12CO2 Amb25946071 [0,0,0,2,0,0|2,0,0]=4 13196 B9R2.5 CC1SCCC12CO2 Amb33745268 [0,0,0,2,0,0|2,0,0]=4 13197 B9R2.5 FC1CNCC12CC2 Amb33801066 [0,0,0,2,0,0|2,0,0]=4 13198 B9R2.5 F[C@@H]1CCC[C@@]12CO2 Amb33803677 [0,0,0,2,0,0|2,0,0]=4 13199 B9R2.5 NC1CCCC12CC2 Amb18833097 [0,0,0,2,0,0|2,0,0]=4 13200 B9R2.5 NC1CCCC12CC2 Amb30585109 [0,0,0,2,0,0|2,0,0]=4 13201 B9R2.5 NC1CNCC12CC2 Amb27797060 [0,0,0,2,0,0|2,0,0]=4 13202 B9R2.5 N[C@@H]1CNCC12CC2 Amb27838305 [0,0,0,2,0,0|2,0,0]=4 13203 B9R2.5 OC1CCCC12CC2 Amb27484590 [0,0,0,2,0,0|1,0,0]=3 13204 B9R2.5 OC1CCNC12CC2 Amb26026452 [0,0,0,2,0,0|2,0,0]=4 13205 B9R2.5 OC1CCNC12CC2 Amb35751154 [0,0,0,2,0,0|2,0,0]=4 13206 B9R2.5 OC1CNCC12CC2 Amb24113078 [0,0,0,2,0,0|1,0,0]=3 13207 B9R2.5 OC1CNCC12CC2 Amb33545300 [0,0,0,2,0,0|1,0,0]=3 13208 B9R2.5 SC1CCCC12CC2 Amb32788509 [0,0,0,2,0,0|1,1,0]=4 13209 B9R2.14 CC12CCC1CNC2 Amb26391628 [0,0,0,2,0,0|2,0,0]=4 13210 B9R2.14 CC12CCCC1CN2 Amb32658553 [0,0,0,2,0,0|2,0,0]=4 13211 B9R2.14 C[C@]12CC[C@H]1CCN2 Amb33734026 [0,0,0,2,0,0|2,0,0]=4 13212 B9R2.14 C[C@]12CC[C@H]1CCN2 Amb33742275 [0,0,0,2,0,0|2,0,0]=4 13213 B9R2.14 FC12CCC1CNC2 Amb34148996 [0,0,0,2,0,0|2,0,0]=4 13214 B9R2.14 N[C@]12CC[C@H]1CNC2 Amb33041799 [0,0,0,2,0,0|2,0,0]=4 13215 B9R2.23 OC1C2CNC1C2F Amb27981029 [0,0,0,2,0,0|2,0,0]=4 13216 B9R2.31 C[C@@H]1[C@@H]2C[C@H](O)[C@H]1C2 Amb27190682 [0,0,0,2,0,0|1,0,0]=3 13217 B9R2.31 N[C@H]1[C@H]2C[C@H](O)[C@@H]1C2 Amb27435593 [0,0,0,2,0,0|2,0,0]=4 13218 B9R2.48 OC[C@H]1NCC12CC2 Amb27441654 [0,0,0,2,0,0|1,0,0]=3 13219 B9R2.33 ClC1CC2CCC2C1 Amb27974247 [0,0,0,2,0,0|2,0,0]=4 13220 B9R2.33 NC1CC2CCC2C1 Amb24696800 [0,0,0,2,0,0|2,0,0]=4 13221 B9R2.33 OC1CC2CCC2C1 Amb28292645 [0,0,0,2,0,0|1,0,0]=3 13222 B9R2.33 OC1C[C@H]2CC[C@@H]2C1 Amb27208215 [0,0,0,2,0,0|1,0,0]=3 13223 B9R2.33 O[C@H]1C[C@@H]2CC[C@@H]2C1 Amb27836254 [0,0,0,2,0,0|1,0,0]=3 13224 B9R2.33 SC1CC2CCC2C1 Amb32788881 [0,0,0,2,0,0|1,1,0]=4 13225 B9R2.36 NC1CCC1C2CC2 Amb24553955 [0,0,0,2,0,0|2,0,0]=4 13226 B9R2.36 NC1CCC1C2CC2 Amb28934908 [0,0,0,2,0,0|2,0,0]=4 13227 B9R2.36 OC1CCC1C2CC2 Amb24711940 [0,0,0,2,0,0|1,0,0]=3 13228 B9R2.28 OCCC1CC12CC2 Amb22727912 [0,0,0,2,0,0|1,0,0]=3 13229 B9R2.28 OC\C=C1\CC12CC2 Amb28065337 [0,0,0,2,0,0|1,0,1]=4 13230 B9R2.75 OCC1C2C(CO)C12 Amb27981830 [0,0,0,2,0,0|2,0,0]=4 13231 B9R2.79 NCC1CC1C2CC2 Amb18963619 [0,0,0,2,0,0|2,0,0]=4 13232 B9R2.79 NCC1CC1C2CC2 Amb20632198 [0,0,0,2,0,0|2,0,0]=4 13233 B9R2.79 NC[C@@H]1C[C@H]1C2CC2 Amb26894585 [0,0,0,2,0,0|2,0,0]=4 13234 B9R2.79 NC[C@@H]1C[C@H]1C2CC2 Amb32661471 [0,0,0,2,0,0|2,0,0]=4 13235 B9R2.79 OCC1CC1C2CC2 Amb28124151 [0,0,0,2,0,0|1,0,0]=3 13236 B9R2.79 OC[C@@H]1C[C@H]1C2CC2 Amb32657995 [0,0,0,2,0,0|1,0,0]=3 13237 B9R2.69 C(CC1CO1)C2CO2 Amb8517133 [0,0,0,2,0,0|2,0,0]=4 13238 B9R2.69 C1CC1CCC2CO2 Amb27427391 [0,0,0,2,0,0|1,0,0]=3 13239 B9R2.69 C1CC1CNC2CC2 Amb33309482 [0,0,0,2,0,0|2,0,0]=4 13240 B9R2.69 C1CC1CNC2CC2 Amb8853840 [0,0,0,2,0,0|2,0,0]=4