0 B7R0.1 BrCCCCCCBr Amb2686735 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.1 C#CCCC#CCC Amb27777157 [0,0,0,0,0,0|1,0,3]=4 2 B7R0.1 C#CCCCC#CC Amb27454289 [0,0,0,0,0,0|1,0,3]=4 3 B7R0.1 C#CCCCCC#N Amb17593113 [0,0,0,0,0,0|1,0,3]=4 4 B7R0.1 C#CCCCCC=C Amb22367006 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.1 C#CCCCCCBr Amb26620641 [0,0,0,0,0,0|2,0,1]=3 6 B7R0.1 C#CCCCCCC Amb3940499 [0,0,0,0,0,0|1,0,1]=2 7 B7R0.1 C#CCCCCCCl Amb24586504 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.1 C#CCCCCCF Amb24538507 [0,0,0,0,0,0|2,0,1]=3 9 B7R0.1 C#CCCCCCN Amb33544857 [0,0,0,0,0,0|2,0,1]=3 10 B7R0.1 C#CCCCCCO Amb10603074 [0,0,0,0,0,0|2,0,1]=3 11 B7R0.1 C#CCCCCOC Amb25191860 [0,0,0,0,0,0|2,0,1]=3 12 B7R0.1 C#CCCCCSC Amb33197631 [0,0,0,0,0,0|2,0,1]=3 13 B7R0.1 C#CCCCNC=O Amb27838352 [0,0,0,0,0,0|1,0,2]=3 14 B7R0.1 C#CCCCSCC Amb25960035 [0,0,0,0,0,0|2,0,1]=3 15 B7R0.1 C#CCCNCC=C Amb28249670 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.1 C#CCCNOCC Amb27964390 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.1 C#CCCOCC=C Amb28247850 [0,0,0,0,0,0|2,0,2]=4 18 B7R0.1 C#CCCSCCC Amb27410296 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.1 C#CCCSCCN Amb6258722 [0,0,0,0,0,0|3,0,1]=4 20 B7R0.1 C#CCC\C=C\CC Amb33267869 [0,0,0,0,0,0|1,0,3]=4 21 B7R0.1 C#CCNCCC=C Amb27856078 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.1 C#CCNCCCN Amb27780787 [0,0,0,0,0,0|3,0,1]=4 23 B7R0.1 C#CCNCCCN Amb34157744 [0,0,0,0,0,0|3,0,1]=4 24 B7R0.1 C#CCNCCOC Amb6706432 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.1 C#CCOCCC=O Amb27877538 [0,0,0,0,0,0|1,0,2]=3 26 B7R0.1 C#CCOCCCO Amb26043047 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.1 C#CCOCCNC Amb19020586 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.1 C#CCOCCNC Amb20669278 [0,0,0,0,0,0|3,0,1]=4 29 B7R0.1 C#CCOCCOC Amb24524633 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.1 C#CCSCCCC Amb26066454 [0,0,0,0,0,0|2,0,1]=3 31 B7R0.1 C#CCSCCCN Amb17500721 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.1 C#CCSCCCO Amb17502862 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.1 C#CC\C=C\CCC Amb33424838 [0,0,0,0,0,0|1,0,3]=4 34 B7R0.1 C=C=CCCCC=O Amb28144035 [0,0,0,0,0,0|0,0,3]=3 35 B7R0.1 C=C=CCCCCCl Amb27986085 [0,0,0,0,0,0|2,0,2]=4 36 B7R0.1 C=C=CCCCCO Amb17593159 [0,0,0,0,0,0|2,0,2]=4 37 B7R0.1 C=C=CCOCC=O Amb28321808 [0,0,0,0,0,0|1,0,3]=4 38 B7R0.1 C=CC#CCCCC Amb17673844 [0,0,0,0,0,0|1,0,2]=3 39 B7R0.1 C=CC#CCCCCl Amb27654967 [0,0,0,0,0,0|2,0,2]=4 40 B7R0.1 C=CCC#CCCO Amb25889239 [0,0,0,0,0,0|2,0,2]=4 41 B7R0.1 C=CCCC#CC=O Amb27224253 [0,0,0,0,0,0|0,0,4]=4 42 B7R0.1 C=CCCCC#CC Amb28048990 [0,0,0,0,0,0|1,0,2]=3 43 B7R0.1 C=CCCCCC=O Amb9785164 [0,0,0,0,0,0|0,0,2]=2 44 B7R0.1 C=CCCCCCBr Amb16234121 [0,0,0,0,0,0|2,0,0]=2 45 B7R0.1 C=CCCCCCC Amb3940500 [0,0,0,0,0,0|1,0,0]=1 46 B7R0.1 C=CCCCCCCl Amb6298878 [0,0,0,0,0,0|2,0,0]=2 47 B7R0.1 C=CCCCCCI Amb24483139 [0,0,0,0,0,0|2,0,0]=2 48 B7R0.1 C=CCCCCCN Amb18641754 [0,0,0,0,0,0|2,0,0]=2 49 B7R0.1 C=CCCCCCO Amb4017321 [0,0,0,0,0,0|2,0,0]=2 50 B7R0.1 C=CCCCCNC Amb19886674 [0,0,0,0,0,0|2,0,0]=2 51 B7R0.1 C=CCCCCNC Amb22495849 [0,0,0,0,0,0|2,0,0]=2 52 B7R0.1 C=CCCCN=C=O Amb26567370 [0,0,0,0,0,0|1,0,3]=4 53 B7R0.1 C=CCCCN=C=S Amb10601691 [0,0,0,0,0,0|3,0,1]=4 54 B7R0.1 C=CCCCNC#N Amb28072825 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.1 C=CCCCNCC Amb28461005 [0,0,0,0,0,0|2,0,0]=2 56 B7R0.1 C=CCCCNCC Amb32988644 [0,0,0,0,0,0|2,0,0]=2 57 B7R0.1 C=CCCCOCBr Amb2696014 [0,0,0,0,0,0|3,0,0]=3 58 B7R0.1 C=CCCCOCCl Amb2694973 [0,0,0,0,0,0|3,0,0]=3 59 B7R0.1 C=CCCCSC#N Amb26948505 [0,0,0,0,0,0|3,0,1]=4 60 B7R0.1 C=CCCCSCC Amb27600986 [0,0,0,0,0,0|2,0,0]=2 61 B7R0.1 C=CCCC\C=C\C Amb24700388 [0,0,0,0,0,0|1,0,2]=3 62 B7R0.1 C=CCCNCC=C Amb18641672 [0,0,0,0,0,0|2,0,2]=4 63 B7R0.1 C=CCCNCCC Amb27796644 [0,0,0,0,0,0|2,0,0]=2 64 B7R0.1 C=CCCOCCBr Amb9208733 [0,0,0,0,0,0|3,0,0]=3 65 B7R0.1 C=CCCOCCN Amb22059113 [0,0,0,0,0,0|3,0,0]=3 66 B7R0.1 C=CCCOCCO Amb26613595 [0,0,0,0,0,0|3,0,0]=3 67 B7R0.1 C=CCCOCOC Amb27664092 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.1 C=CCCSCCC Amb27806215 [0,0,0,0,0,0|2,0,0]=2 69 B7R0.1 C=CCCSCCN Amb25889820 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.1 C=CCCSCCO Amb28283935 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.1 C=CCC\C=C\CO Amb27406831 [0,0,0,0,0,0|2,0,2]=4 72 B7R0.1 C=CCNCCC#N Amb19960051 [0,0,0,0,0,0|3,0,1]=4 73 B7R0.1 C=CCNCCC#N Amb8827851 [0,0,0,0,0,0|3,0,1]=4 74 B7R0.1 C=CCNCCCCl Amb27655586 [0,0,0,0,0,0|3,0,0]=3 75 B7R0.1 C=CCNCCCI Amb28256753 [0,0,0,0,0,0|3,0,0]=3 76 B7R0.1 C=CCNCCCN Amb17315274 [0,0,0,0,0,0|3,0,0]=3 77 B7R0.1 C=CCNCCCO Amb17308751 [0,0,0,0,0,0|3,0,0]=3 78 B7R0.1 C=CCNCCOC Amb6706505 [0,0,0,0,0,0|3,0,0]=3 79 B7R0.1 C=CCNC\C=C\C Amb18124233 [0,0,0,0,0,0|2,0,2]=4 80 B7R0.1 C=CCNOCCC Amb28077176 [0,0,0,0,0,0|3,0,0]=3 81 B7R0.1 C=CCOCCC#N Amb9208769 [0,0,0,0,0,0|3,0,1]=4 82 B7R0.1 C=CCOCCC=O Amb26516382 [0,0,0,0,0,0|1,0,2]=3 83 B7R0.1 C=CCOCCCBr Amb8828250 [0,0,0,0,0,0|3,0,0]=3 84 B7R0.1 C=CCOCCCC Amb3940494 [0,0,0,0,0,0|2,0,0]=2 85 B7R0.1 C=CCOCCCCl Amb9208730 [0,0,0,0,0,0|3,0,0]=3 86 B7R0.1 C=CCOCCCN Amb25190295 [0,0,0,0,0,0|3,0,0]=3 87 B7R0.1 C=CCOCCCO Amb25097051 [0,0,0,0,0,0|3,0,0]=3 88 B7R0.1 C=CCOCCSC Amb27983164 [0,0,0,0,0,0|3,0,0]=3 89 B7R0.1 C=CCSCC#CC Amb27780334 [0,0,0,0,0,0|2,0,2]=4 90 B7R0.1 C=CCSCCCBr Amb27228626 [0,0,0,0,0,0|3,0,0]=3 91 B7R0.1 C=CCSCCCN Amb17500693 [0,0,0,0,0,0|3,0,0]=3 92 B7R0.1 C=CCSCCCS Amb28293414 [0,0,0,0,0,0|3,0,0]=3 93 B7R0.1 C=CCSCCNC Amb27594788 [0,0,0,0,0,0|3,0,0]=3 94 B7R0.1 C=CCSCCOC Amb17799422 [0,0,0,0,0,0|3,0,0]=3 95 B7R0.1 C=CCSCCSC Amb27594231 [0,0,0,0,0,0|3,0,0]=3 96 B7R0.1 C=CCSSCCC Amb8393142 [0,0,0,0,0,0|3,0,0]=3 97 B7R0.1 C=CC\C=C\CCBr Amb27235562 [0,0,0,0,0,0|2,0,2]=4 98 B7R0.1 C=CC\C=C\CCC Amb4035888 [0,0,0,0,0,0|1,0,2]=3 99 B7R0.1 C=COCCCCO Amb8517109 [0,0,0,0,0,0|3,0,0]=3 100 B7R0.1 C=COCCCOC Amb28063047 [0,0,0,0,0,0|3,0,0]=3 101 B7R0.1 C=COCCSCC Amb25720739 [0,0,0,0,0,0|3,0,0]=3 102 B7R0.1 C=COCOCCCl Amb27874117 [0,0,0,0,0,0|4,0,0]=4 103 B7R0.1 C=CSCCCCC Amb27666051 [0,0,0,0,0,0|2,0,0]=2 104 B7R0.1 C=C\C=C\CCCC Amb22729011 [0,0,0,0,0,0|1,0,2]=3 105 B7R0.1 C=C\C=C\CCCCl Amb28132447 [0,0,0,0,0,0|2,0,2]=4 106 B7R0.1 C=C\C=C\CCNC Amb18641669 [0,0,0,0,0,0|2,0,2]=4 107 B7R0.1 CC#CCCCC=O Amb17593142 [0,0,0,0,0,0|0,0,2]=2 108 B7R0.1 CC#CCCCCBr Amb27459340 [0,0,0,0,0,0|1,0,3]=4 109 B7R0.1 CC#CCCCCC Amb9134714 [0,0,0,0,0,0|1,0,2]=3 110 B7R0.1 CC#CCCCCO Amb17593158 [0,0,0,0,0,0|0,0,4]=4 111 B7R0.1 CC=C=CCCCC Amb28284500 [0,0,0,0,0,0|1,0,2]=3 112 B7R0.1 CCC#CCCCBr Amb24443559 [0,0,0,0,0,0|1,0,3]=4 113 B7R0.1 CCC#CCCCC Amb4017968 [0,0,0,0,0,0|1,0,3]=4 114 B7R0.1 CCC#CCCCCl Amb28188357 [0,0,0,0,0,0|1,0,3]=4 115 B7R0.1 CCC#CCCCN Amb27838381 [0,0,0,0,0,0|1,0,3]=4 116 B7R0.1 CCC#CCCNC Amb27838421 [0,0,0,0,0,0|2,0,2]=4 117 B7R0.1 CCC#CC\C=C\Br Amb27444344 [0,0,0,0,0,0|1,0,3]=4 118 B7R0.1 CCCC#CCCC Amb8514642 [0,0,0,0,0,0|1,0,3]=4 119 B7R0.1 CCCC#CCCO Amb2721487 [0,0,0,0,0,0|0,0,4]=4 120 B7R0.1 CCCC#CCNC Amb27815061 [0,0,0,0,0,0|2,0,2]=4 121 B7R0.1 CCCCC#CC#N Amb17593112 [0,0,0,0,0,0|1,0,3]=4 122 B7R0.1 CCCCC#CC=O Amb17593134 [0,0,0,0,0,0|0,0,2]=2 123 B7R0.1 CCCCC#CCBr Amb17670640 [0,0,0,0,0,0|1,0,3]=4 124 B7R0.1 CCCCCC#CI Amb17940367 [0,0,0,0,0,0|1,0,2]=3 125 B7R0.1 CCCCCCC#N Amb7764659 [0,0,0,0,0,0|1,0,1]=2 126 B7R0.1 CCCCCCC=O Amb3939948 [0,0,0,0,0,0|0,0,0]=0 127 B7R0.1 CCCCCCCBr Amb3941482 [0,0,0,0,0,0|1,0,1]=2 128 B7R0.1 CCCCCCCC Amb8513274 [0,0,0,0,0,0|1,0,1]=2 129 B7R0.1 CCCCCCCCl Amb6608669 [0,0,0,0,0,0|1,0,1]=2 130 B7R0.1 CCCCCCCI Amb3940283 [0,0,0,0,0,0|1,0,1]=2 131 B7R0.1 CCCCCCCN Amb3940125 [0,0,0,0,0,0|1,0,1]=2 132 B7R0.1 CCCCCCCO Amb6608791 [0,0,0,0,0,0|0,0,2]=2 133 B7R0.1 CCCCCCC[Mg+] Amb22351260 [0,0,0,0,0,0|1,0,1]=2 134 B7R0.1 CCCCCCNC Amb4037010 [0,0,0,0,0,0|2,0,0]=2 135 B7R0.1 CCCCCCNN Amb7786617 [0,0,0,0,0,0|2,0,0]=2 136 B7R0.1 CCCCCCNO Amb24591654 [0,0,0,0,0,0|1,0,1]=2 137 B7R0.1 CCCCCCNO Amb32687464 [0,0,0,0,0,0|1,0,1]=2 138 B7R0.1 CCCCCCON Amb18641933 [0,0,0,0,0,0|2,0,0]=2 139 B7R0.1 CCCCCCSC Amb22359692 [0,0,0,0,0,0|2,0,0]=2 140 B7R0.1 CCCCCC[Mg]Br Amb22337740 [0,0,0,0,0,0|2,0,0]=2 141 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [0,0,0,0,0,0|2,0,0]=2 142 B7R0.1 CCCCCN=C=O Amb3939207 [0,0,0,0,0,0|1,0,1]=2 143 B7R0.1 CCCCCN=C=S Amb6565433 [0,0,0,0,0,0|1,1,1]=3 144 B7R0.1 CCCCCN=[N+]=[N-] Amb17939435 [0,0,0,0,0,0|3,0,0]=3 145 B7R0.1 CCCCCNC#N Amb28288523 [0,0,0,0,0,0|2,0,1]=3 146 B7R0.1 CCCCCNCC Amb6243353 [0,0,0,0,0,0|2,0,1]=3 147 B7R0.1 CCCCCNCN Amb28388761 [0,0,0,0,0,0|2,0,1]=3 148 B7R0.1 CCCCCNCO Amb28133981 [0,0,0,0,0,0|1,0,2]=3 149 B7R0.1 CCCCCOCC Amb22733705 [0,0,0,0,0,0|2,0,1]=3 150 B7R0.1 CCCCCON=O Amb17939401 [0,0,0,0,0,0|2,0,0]=2 151 B7R0.1 CCCCCSSC Amb25679654 [0,0,0,0,0,0|3,0,0]=3 152 B7R0.1 CCCCC\C=C\Br Amb27985859 [0,0,0,0,0,0|1,0,1]=2 153 B7R0.1 CCCCC\C=C\Cl Amb28384465 [0,0,0,0,0,0|1,0,1]=2 154 B7R0.1 CCCCC\C=C\I Amb22641605 [0,0,0,0,0,0|1,0,1]=2 155 B7R0.1 CCCCC\C=N\N Amb27837897 [0,0,0,0,0,0|2,0,1]=3 156 B7R0.1 CCCCC\C=N\O Amb27477089 [0,0,0,0,0,0|1,0,2]=3 157 B7R0.1 CCCCNCC#N Amb3997177 [0,0,0,0,0,0|2,0,1]=3 158 B7R0.1 CCCCNCCC Amb3939261 [0,0,0,0,0,0|2,0,1]=3 159 B7R0.1 CCCCNCCF Amb27597327 [0,0,0,0,0,0|2,0,1]=3 160 B7R0.1 CCCCNCCN Amb4020675 [0,0,0,0,0,0|2,0,1]=3 161 B7R0.1 CCCCNCCO Amb2685641 [0,0,0,0,0,0|1,0,2]=3 162 B7R0.1 CCCCNCCS Amb22232390 [0,0,0,0,0,0|1,1,1]=3 163 B7R0.1 CCCCOCC=O Amb26515709 [0,0,0,0,0,0|1,0,0]=1 164 B7R0.1 CCCCOCCBr Amb2720768 [0,0,0,0,0,0|2,0,1]=3 165 B7R0.1 CCCCOCCCl Amb8873731 [0,0,0,0,0,0|2,0,1]=3 166 B7R0.1 CCCCOCCI Amb24474438 [0,0,0,0,0,0|2,0,1]=3 167 B7R0.1 CCCCOCCN Amb8895131 [0,0,0,0,0,0|2,0,1]=3 168 B7R0.1 CCCCOCCO Amb3939290 [0,0,0,0,0,0|1,0,2]=3 169 B7R0.1 CCCCO\C=C/Cl Amb27777227 [0,0,0,0,0,0|2,0,1]=3 170 B7R0.1 CCCCO\C=C\Br Amb27858551 [0,0,0,0,0,0|2,0,1]=3 171 B7R0.1 CCCCPCCN Amb27831609 [0,0,0,0,0,0|2,0,1]=3 172 B7R0.1 CCCCSCC#N Amb6760935 [0,0,0,0,0,0|2,0,1]=3 173 B7R0.1 CCCCSCC=O Amb28189740 [0,0,0,0,0,0|1,0,0]=1 174 B7R0.1 CCCCSCCC Amb4017586 [0,0,0,0,0,0|2,0,1]=3 175 B7R0.1 CCCCSCCCl Amb9479748 [0,0,0,0,0,0|2,0,1]=3 176 B7R0.1 CCCCSCCN Amb2209242 [0,0,0,0,0,0|2,0,1]=3 177 B7R0.1 CCCCSCCO Amb1032995 [0,0,0,0,0,0|1,0,2]=3 178 B7R0.1 CCCCSSCC Amb26515761 [0,0,0,0,0,0|3,0,1]=4 179 B7R0.1 CCCCS\C=C/Cl Amb28048891 [0,0,0,0,0,0|2,0,1]=3 180 B7R0.1 CCCC\C=C\C#N Amb18641342 [0,0,0,0,0,0|1,0,3]=4 181 B7R0.1 CCCC\C=C\C=O Amb2720528 [0,0,0,0,0,0|0,0,2]=2 182 B7R0.1 CCCC\C=C\CN Amb25175053 [0,0,0,0,0,0|1,0,3]=4 183 B7R0.1 CCCC\C=C\CO Amb8514979 [0,0,0,0,0,0|0,0,4]=4 184 B7R0.1 CCCC\C=N\OC Amb27969362 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.1 CCCC\N=C\CCl Amb28141548 [0,0,0,0,0,0|2,0,2]=4 186 B7R0.1 CCCNCCC#N Amb2690405 [0,0,0,0,0,0|2,0,1]=3 187 B7R0.1 CCCNCCC=O Amb27838403 [0,0,0,0,0,0|1,0,0]=1 188 B7R0.1 CCCNCCCCl Amb27593175 [0,0,0,0,0,0|2,0,1]=3 189 B7R0.1 CCCNCCCN Amb8515464 [0,0,0,0,0,0|2,0,1]=3 190 B7R0.1 CCCNCCCO Amb6733725 [0,0,0,0,0,0|1,0,2]=3 191 B7R0.1 CCCNCCSC Amb27162672 [0,0,0,0,0,0|3,0,0]=3 192 B7R0.1 CCCNC\C=C\Cl Amb25340126 [0,0,0,0,0,0|2,0,1]=3 193 B7R0.1 CCCNNCCC Amb27818086 [0,0,0,0,0,0|3,0,1]=4 194 B7R0.1 CCCNOCCC Amb27792152 [0,0,0,0,0,0|3,0,1]=4 195 B7R0.1 CCCNOCCO Amb28139467 [0,0,0,0,0,0|2,0,2]=4 196 B7R0.1 CCCOCCCBr Amb8874784 [0,0,0,0,0,0|2,0,1]=3 197 B7R0.1 CCCOCCCCl Amb8874785 [0,0,0,0,0,0|2,0,1]=3 198 B7R0.1 CCCOCCCN Amb3940017 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.1 CCCOCCCO Amb19962968 [0,0,0,0,0,0|1,0,2]=3 200 B7R0.1 CCCOCCCS Amb27212962 [0,0,0,0,0,0|1,1,1]=3 201 B7R0.1 CCCOC\C=C/Cl Amb27839016 [0,0,0,0,0,0|2,0,1]=3 202 B7R0.1 CCCONCCN Amb27838359 [0,0,0,0,0,0|3,0,1]=4 203 B7R0.1 CCCONCCO Amb27455527 [0,0,0,0,0,0|2,0,2]=4 204 B7R0.1 CCCSCCC#N Amb6680722 [0,0,0,0,0,0|2,0,1]=3 205 B7R0.1 CCCSCCCN Amb6680225 [0,0,0,0,0,0|2,0,1]=3 206 B7R0.1 CCCSCCCO Amb9370793 [0,0,0,0,0,0|1,0,2]=3 207 B7R0.1 CCCSCCON Amb27262198 [0,0,0,0,0,0|3,0,0]=3 208 B7R0.1 CCCSCCSC Amb27837913 [0,0,0,0,0,0|3,0,0]=3 209 B7R0.1 CCCSSCCO Amb27185480 [0,0,0,0,0,0|2,0,2]=4 210 B7R0.1 CCC[SiH2]CCCCl Amb28208530 [0,0,0,0,0,0|1,1,1]=3 211 B7R0.1 CCC\C=C/CCC Amb27838401 [0,0,0,0,0,0|1,0,3]=4 212 B7R0.1 CCC\C=C/CCO Amb22052625 [0,0,0,0,0,0|0,0,4]=4 213 B7R0.1 CCC\C=C\C=C\Cl Amb27657659 [0,0,0,0,0,0|1,0,3]=4 214 B7R0.1 CCC\C=C\CC#N Amb33172503 [0,0,0,0,0,0|1,0,3]=4 215 B7R0.1 CCC\C=C\CC=O Amb32954538 [0,0,0,0,0,0|0,0,2]=2 216 B7R0.1 CCC\C=C\CCBr Amb33242599 [0,0,0,0,0,0|1,0,3]=4 217 B7R0.1 CCC\C=C\CCC Amb9134769 [0,0,0,0,0,0|1,0,3]=4 218 B7R0.1 CCC\C=C\CCCl Amb32686957 [0,0,0,0,0,0|1,0,3]=4 219 B7R0.1 CCC\C=C\CCN Amb25221747 [0,0,0,0,0,0|1,0,3]=4 220 B7R0.1 CCC\C=C\CCO Amb22730273 [0,0,0,0,0,0|0,0,4]=4 221 B7R0.1 CCC\C=C\CCS Amb33373718 [0,0,0,0,0,0|0,1,3]=4 222 B7R0.1 CCC\C=C\CNC Amb33172653 [0,0,0,0,0,0|2,0,2]=4 223 B7R0.1 CCC\C=C\CNN Amb33425693 [0,0,0,0,0,0|2,0,2]=4 224 B7R0.1 CCC\C=C\CNO Amb33327497 [0,0,0,0,0,0|1,0,3]=4 225 B7R0.1 CCC\C=C\CON Amb33424912 [0,0,0,0,0,0|2,0,2]=4 226 B7R0.1 CCC\C=C\N=C=O Amb25260726 [0,0,0,0,0,0|1,0,3]=4 227 B7R0.1 CCC\C=N\CCO Amb28207113 [0,0,0,0,0,0|1,0,3]=4 228 B7R0.1 CCNCCCCO Amb3940019 [0,0,0,0,0,0|1,0,2]=3 229 B7R0.1 CCNCCCOC Amb6730311 [0,0,0,0,0,0|3,0,0]=3 230 B7R0.1 CCNCCN=[N+]=[N-] Amb27478127 [0,0,0,0,0,0|4,0,0]=4 231 B7R0.1 CCNCCNCC Amb9885560 [0,0,0,0,0,0|3,0,1]=4 232 B7R0.1 CCNCCOCC Amb33529222 [0,0,0,0,0,0|3,0,1]=4 233 B7R0.1 CCNCC\C=C\Cl Amb27400178 [0,0,0,0,0,0|2,0,1]=3 234 B7R0.1 CCNOCCOC Amb28315578 [0,0,0,0,0,0|4,0,0]=4 235 B7R0.1 CCOCCCC#N Amb6260880 [0,0,0,0,0,0|2,0,1]=3 236 B7R0.1 CCOCCCC=O Amb27236777 [0,0,0,0,0,0|1,0,0]=1 237 B7R0.1 CCOCCCCBr Amb8855444 [0,0,0,0,0,0|2,0,1]=3 238 B7R0.1 CCOCCCCCl Amb20242741 [0,0,0,0,0,0|2,0,1]=3 239 B7R0.1 CCOCCCCN Amb6249686 [0,0,0,0,0,0|2,0,1]=3 240 B7R0.1 CCOCCCCO Amb19148112 [0,0,0,0,0,0|1,0,2]=3 241 B7R0.1 CCOCCCON Amb18061683 [0,0,0,0,0,0|3,0,0]=3 242 B7R0.1 CCOCCN=C=O Amb27628260 [0,0,0,0,0,0|2,0,1]=3 243 B7R0.1 CCOCCN=C=S Amb9454513 [0,0,0,0,0,0|2,1,1]=4 244 B7R0.1 CCOCCN=[N+]=[N-] Amb25367157 [0,0,0,0,0,0|4,0,0]=4 245 B7R0.1 CCOCCOCC Amb8517552 [0,0,0,0,0,0|3,0,1]=4 246 B7R0.1 CCOCC\C=N\N Amb27982628 [0,0,0,0,0,0|3,0,1]=4 247 B7R0.1 CCONCCC#N Amb27657635 [0,0,0,0,0,0|3,0,1]=4 248 B7R0.1 CCONCCCN Amb27244679 [0,0,0,0,0,0|3,0,1]=4 249 B7R0.1 CCONCCCO Amb28319900 [0,0,0,0,0,0|2,0,2]=4 250 B7R0.1 CCONC\C=C\Cl Amb27478565 [0,0,0,0,0,0|3,0,1]=4 251 B7R0.1 CCSCCCC#N Amb6680685 [0,0,0,0,0,0|2,0,1]=3 252 B7R0.1 CCSCCCC=O Amb33323662 [0,0,0,0,0,0|1,0,0]=1 253 B7R0.1 CCSCCCCBr Amb9304999 [0,0,0,0,0,0|2,0,1]=3 254 B7R0.1 CCSCCCCCl Amb18796695 [0,0,0,0,0,0|2,0,1]=3 255 B7R0.1 CCSCCCCN Amb9391471 [0,0,0,0,0,0|2,0,1]=3 256 B7R0.1 CCSCCCCO Amb9370799 [0,0,0,0,0,0|1,0,2]=3 257 B7R0.1 CCSCCCCS Amb27223548 [0,0,0,0,0,0|1,1,1]=3 258 B7R0.1 CCSCCCNC Amb25044529 [0,0,0,0,0,0|3,0,0]=3 259 B7R0.1 CCSCCCNO Amb27778147 [0,0,0,0,0,0|2,0,1]=3 260 B7R0.1 CCSCCCON Amb26975230 [0,0,0,0,0,0|3,0,0]=3 261 B7R0.1 CCSCCN=C=O Amb25110059 [0,0,0,0,0,0|2,0,1]=3 262 B7R0.1 CCSCCN=[N+]=[N-] Amb24388976 [0,0,0,0,0,0|4,0,0]=4 263 B7R0.1 CCSCCNC=O Amb27752341 [0,0,0,0,0,0|2,0,0]=2 264 B7R0.1 CCSCCSCC Amb4017493 [0,0,0,0,0,0|3,0,1]=4 265 B7R0.1 CCSCSCCCl Amb27645434 [0,0,0,0,0,0|3,0,1]=4 266 B7R0.1 CCSC\C=C\C=O Amb33323727 [0,0,0,0,0,0|1,0,2]=3 267 B7R0.1 CC\C=C/CCCO Amb22053865 [0,0,0,0,0,0|0,0,4]=4 268 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [0,0,0,0,0,0|0,0,4]=4 269 B7R0.1 CC\C=C\CCC#N Amb33172608 [0,0,0,0,0,0|1,0,3]=4 270 B7R0.1 CC\C=C\CCC=O Amb27390797 [0,0,0,0,0,0|0,0,2]=2 271 B7R0.1 CC\C=C\CCCBr Amb27232700 [0,0,0,0,0,0|1,0,3]=4 272 B7R0.1 CC\C=C\CCCC Amb19930202 [0,0,0,0,0,0|1,0,3]=4 273 B7R0.1 CC\C=C\CCCCl Amb28410595 [0,0,0,0,0,0|1,0,3]=4 274 B7R0.1 CC\C=C\CCCN Amb33474692 [0,0,0,0,0,0|1,0,3]=4 275 B7R0.1 CC\C=C\CCCO Amb33172698 [0,0,0,0,0,0|0,0,4]=4 276 B7R0.1 CC\C=C\CCCS Amb32882557 [0,0,0,0,0,0|0,1,3]=4 277 B7R0.1 CC\C=C\CCNC Amb32953435 [0,0,0,0,0,0|2,0,2]=4 278 B7R0.1 CC\C=C\CCNN Amb27435651 [0,0,0,0,0,0|2,0,2]=4 279 B7R0.1 CC\C=C\CCON Amb33268245 [0,0,0,0,0,0|2,0,2]=4 280 B7R0.1 CC\C=C\CCSC Amb27397344 [0,0,0,0,0,0|2,0,2]=4 281 B7R0.1 CC\C=C\CN=C=O Amb33449407 [0,0,0,0,0,0|1,0,3]=4 282 B7R0.1 CC\C=N\CCCC Amb27946052 [0,0,0,0,0,0|2,0,2]=4 283 B7R0.1 CNCCCCC#N Amb18307043 [0,0,0,0,0,0|2,0,1]=3 284 B7R0.1 CNCCCCCF Amb27595210 [0,0,0,0,0,0|2,0,1]=3 285 B7R0.1 CNCCCCCI Amb27953747 [0,0,0,0,0,0|2,0,1]=3 286 B7R0.1 CNCCCCCN Amb23448496 [0,0,0,0,0,0|2,0,1]=3 287 B7R0.1 CNCCCCCO Amb17334069 [0,0,0,0,0,0|1,0,2]=3 288 B7R0.1 CNCCCCCO Amb33551687 [0,0,0,0,0,0|1,0,2]=3 289 B7R0.1 CNCCCCNC Amb19374448 [0,0,0,0,0,0|3,0,0]=3 290 B7R0.1 CNCCCCOC Amb17569912 [0,0,0,0,0,0|3,0,0]=3 291 B7R0.1 CNCCCCSC Amb27433707 [0,0,0,0,0,0|3,0,0]=3 292 B7R0.1 CNCCNCCN Amb18641939 [0,0,0,0,0,0|3,0,1]=4 293 B7R0.1 CNCCNCCO Amb4020109 [0,0,0,0,0,0|2,0,2]=4 294 B7R0.1 CNCCNCCS Amb27424661 [0,0,0,0,0,0|2,1,1]=4 295 B7R0.1 CNCCOCCCl Amb25708208 [0,0,0,0,0,0|3,0,1]=4 296 B7R0.1 CNCCOCCCl Amb32659597 [0,0,0,0,0,0|3,0,1]=4 297 B7R0.1 CNCCOCCN Amb27246939 [0,0,0,0,0,0|3,0,1]=4 298 B7R0.1 CNCCOCCO Amb33536922 [0,0,0,0,0,0|2,0,2]=4 299 B7R0.1 CNCCSCC#N Amb27669176 [0,0,0,0,0,0|3,0,1]=4 300 B7R0.1 CNCCSCCO Amb27475549 [0,0,0,0,0,0|2,0,2]=4 301 B7R0.1 COCCCCC#N Amb13951615 [0,0,0,0,0,0|2,0,1]=3 302 B7R0.1 COCCCCC=O Amb27410175 [0,0,0,0,0,0|1,0,0]=1 303 B7R0.1 COCCCCCBr Amb18182548 [0,0,0,0,0,0|2,0,1]=3 304 B7R0.1 COCCCCCCl Amb9001649 [0,0,0,0,0,0|2,0,1]=3 305 B7R0.1 COCCCCCI Amb27603403 [0,0,0,0,0,0|2,0,1]=3 306 B7R0.1 COCCCCCN Amb13951647 [0,0,0,0,0,0|2,0,1]=3 307 B7R0.1 COCCCCCO Amb19374978 [0,0,0,0,0,0|1,0,2]=3 308 B7R0.1 COCCCCCS Amb25138209 [0,0,0,0,0,0|1,1,1]=3 309 B7R0.1 COCCCCNN Amb27753483 [0,0,0,0,0,0|3,0,0]=3 310 B7R0.1 COCCCCOC Amb6296783 [0,0,0,0,0,0|3,0,0]=3 311 B7R0.1 COCCCCON Amb25357703 [0,0,0,0,0,0|3,0,0]=3 312 B7R0.1 COCCCCSC Amb28193488 [0,0,0,0,0,0|3,0,0]=3 313 B7R0.1 COCCCN=C=O Amb5750716 [0,0,0,0,0,0|2,0,1]=3 314 B7R0.1 COCCCN=C=S Amb6366507 [0,0,0,0,0,0|2,1,1]=4 315 B7R0.1 COCCCN=[N+]=[N-] Amb26516803 [0,0,0,0,0,0|4,0,0]=4 316 B7R0.1 COCCCOCCl Amb28073904 [0,0,0,0,0,0|3,0,1]=4 317 B7R0.1 COCCCSCCl Amb27466078 [0,0,0,0,0,0|3,0,1]=4 318 B7R0.1 COCCC\C=N\N Amb28288582 [0,0,0,0,0,0|3,0,1]=4 319 B7R0.1 COCCNCC#N Amb6600494 [0,0,0,0,0,0|3,0,1]=4 320 B7R0.1 COCCNCCF Amb25677392 [0,0,0,0,0,0|3,0,1]=4 321 B7R0.1 COCCNCCF Amb33552357 [0,0,0,0,0,0|3,0,1]=4 322 B7R0.1 COCCNCCN Amb17091020 [0,0,0,0,0,0|3,0,1]=4 323 B7R0.1 COCCNCCN Amb30585091 [0,0,0,0,0,0|3,0,1]=4 324 B7R0.1 COCCNCCO Amb3939014 [0,0,0,0,0,0|2,0,2]=4 325 B7R0.1 COCCNCCS Amb27405418 [0,0,0,0,0,0|2,1,1]=4 326 B7R0.1 COCCOCC#N Amb6256277 [0,0,0,0,0,0|3,0,1]=4 327 B7R0.1 COCCOCC=O Amb26051823 [0,0,0,0,0,0|2,0,0]=2 328 B7R0.1 COCCOCCBr Amb3938999 [0,0,0,0,0,0|3,0,1]=4 329 B7R0.1 COCCOCCCl Amb9209785 [0,0,0,0,0,0|3,0,1]=4 330 B7R0.1 COCCOCCI Amb22497515 [0,0,0,0,0,0|3,0,1]=4 331 B7R0.1 COCCOCCN Amb6244884 [0,0,0,0,0,0|3,0,1]=4 332 B7R0.1 COCCOCCN Amb7969459 [0,0,0,0,0,0|3,0,1]=4 333 B7R0.1 COCCOCCO Amb4605829 [0,0,0,0,0,0|2,0,2]=4 334 B7R0.1 COCCOCCS Amb9787645 [0,0,0,0,0,0|2,1,1]=4 335 B7R0.1 COCCOCON Amb24421661 [0,0,0,0,0,0|4,0,0]=4 336 B7R0.1 COCCONC=O Amb28049001 [0,0,0,0,0,0|3,0,0]=3 337 B7R0.1 COCCSCCF Amb28142604 [0,0,0,0,0,0|3,0,1]=4 338 B7R0.1 COCCSCCO Amb9273918 [0,0,0,0,0,0|2,0,2]=4 339 B7R0.1 COCCSCOC Amb27883297 [0,0,0,0,0,0|4,0,0]=4 340 B7R0.1 COCC\C=C\C=O Amb33377482 [0,0,0,0,0,0|1,0,2]=3 341 B7R0.1 COCOCCC#N Amb25318078 [0,0,0,0,0,0|3,0,1]=4 342 B7R0.1 COCOCCC=O Amb25804170 [0,0,0,0,0,0|2,0,0]=2 343 B7R0.1 COCOCCCBr Amb28385749 [0,0,0,0,0,0|3,0,1]=4 344 B7R0.1 COCOCCCCl Amb27194584 [0,0,0,0,0,0|3,0,1]=4 345 B7R0.1 COCOCCCN Amb25989339 [0,0,0,0,0,0|3,0,1]=4 346 B7R0.1 COCOCCCO Amb23591016 [0,0,0,0,0,0|2,0,2]=4 347 B7R0.1 CONCCCC#N Amb28422207 [0,0,0,0,0,0|3,0,1]=4 348 B7R0.1 CONCCCCF Amb28401069 [0,0,0,0,0,0|3,0,1]=4 349 B7R0.1 CO\C=C\CCC=O Amb18641790 [0,0,0,0,0,0|1,0,2]=3 350 B7R0.1 CSCCCCC#N Amb27832899 [0,0,0,0,0,0|2,0,1]=3 351 B7R0.1 CSCCCCC=O Amb25760866 [0,0,0,0,0,0|1,0,0]=1 352 B7R0.1 CSCCCCCBr Amb25052398 [0,0,0,0,0,0|2,0,1]=3 353 B7R0.1 CSCCCCCCl Amb18179464 [0,0,0,0,0,0|2,0,1]=3 354 B7R0.1 CSCCCCCF Amb28049310 [0,0,0,0,0,0|2,0,1]=3 355 B7R0.1 CSCCCCCN Amb24271082 [0,0,0,0,0,0|2,0,1]=3 356 B7R0.1 CSCCCCCO Amb24271084 [0,0,0,0,0,0|1,0,2]=3 357 B7R0.1 CSCCCCCS Amb24633807 [0,0,0,0,0,0|1,1,1]=3 358 B7R0.1 CSCCCCON Amb33198301 [0,0,0,0,0,0|3,0,0]=3 359 B7R0.1 CSCCCN=C=O Amb26647796 [0,0,0,0,0,0|2,0,1]=3 360 B7R0.1 CSCCCN=C=S Amb6296851 [0,0,0,0,0,0|2,1,1]=4 361 B7R0.1 CSCCCN=[N+]=[N-] Amb28285204 [0,0,0,0,0,0|4,0,0]=4 362 B7R0.1 CSCCCNC#N Amb28047660 [0,0,0,0,0,0|3,0,1]=4 363 B7R0.1 CSCCNCC#N Amb27812181 [0,0,0,0,0,0|3,0,1]=4 364 B7R0.1 CSCCNCCBr Amb27833219 [0,0,0,0,0,0|3,0,1]=4 365 B7R0.1 CSCCNCCCl Amb27870606 [0,0,0,0,0,0|3,0,1]=4 366 B7R0.1 CSCCOCC#N Amb27823913 [0,0,0,0,0,0|3,0,1]=4 367 B7R0.1 CSCCOCCBr Amb28321116 [0,0,0,0,0,0|3,0,1]=4 368 B7R0.1 CSCCOCCN Amb17501991 [0,0,0,0,0,0|3,0,1]=4 369 B7R0.1 CSCCOCCO Amb28368979 [0,0,0,0,0,0|2,0,2]=4 370 B7R0.1 CSCC\C=C\C=O Amb32953448 [0,0,0,0,0,0|1,0,2]=3 371 B7R0.1 CSCOCCCBr Amb27477765 [0,0,0,0,0,0|3,0,1]=4 372 B7R0.1 CSSCCNC=O Amb27475220 [0,0,0,0,0,0|3,0,0]=3 373 B7R0.1 C\C=C/CCCCC Amb4035902 [0,0,0,0,0,0|1,0,1]=2 374 B7R0.1 C\C=C/CCCCO Amb4019856 [0,0,0,0,0,0|2,0,1]=3 375 B7R0.1 C\C=C\C=C\CCC Amb27493119 [0,0,0,0,0,0|1,0,3]=4 376 B7R0.1 C\C=C\CCCCC Amb8513437 [0,0,0,0,0,0|1,0,1]=2 377 B7R0.1 C\C=C\CCCCN Amb27209196 [0,0,0,0,0,0|2,0,1]=3 378 B7R0.1 C\C=C\CCNC=O Amb27874072 [0,0,0,0,0,0|1,0,2]=3 379 B7R0.1 C\C=C\CC\C=C\C Amb21520377 [0,0,0,0,0,0|1,0,3]=4 380 B7R0.1 C\C=C\CC\C=C\Cl Amb27433939 [0,0,0,0,0,0|1,0,3]=4 381 B7R0.1 C\C=C\CNCCC Amb28127654 [0,0,0,0,0,0|2,0,1]=3 382 B7R0.1 C\C=C\CNCCN Amb27983366 [0,0,0,0,0,0|3,0,1]=4 383 B7R0.1 C\C=C\CNOCC Amb28048936 [0,0,0,0,0,0|3,0,1]=4 384 B7R0.1 C\C=C\CSCCO Amb9362982 [0,0,0,0,0,0|3,0,1]=4 385 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [0,0,0,0,0,0|0,0,4]=4 386 B7R0.1 C\C=C\SSCCC Amb25865705 [0,0,0,0,0,0|3,0,1]=4 387 B7R0.1 C\C=N/CCCCN Amb27838890 [0,0,0,0,0,0|3,0,0]=3 388 B7R0.1 ClCCCCCCBr Amb10602445 [0,0,0,0,0,0|2,0,1]=3 389 B7R0.1 ClCCCCCCCl Amb8513108 [0,0,0,0,0,0|2,0,1]=3 390 B7R0.1 ClCCCCCCI Amb20670134 [0,0,0,0,0,0|2,0,1]=3 391 B7R0.1 ClCCCCC[Zn]Br Amb22000392 [0,0,0,0,0,0|3,0,0]=3 392 B7R0.1 ClCCCCOCCl Amb27628371 [0,0,0,0,0,0|3,0,1]=4 393 B7R0.1 ClCCCNCCCl Amb13952668 [0,0,0,0,0,0|3,0,1]=4 394 B7R0.1 ClCCCNCCCl Amb18125911 [0,0,0,0,0,0|3,0,1]=4 395 B7R0.1 ClCCCSCCCl Amb24426165 [0,0,0,0,0,0|3,0,1]=4 396 B7R0.1 ClCOCCCCBr Amb28195199 [0,0,0,0,0,0|3,0,1]=4 397 B7R0.1 Cl\C=C\CNCCBr Amb28048931 [0,0,0,0,0,0|3,0,1]=4 398 B7R0.1 Cl\C=C\CNCCI Amb27490693 [0,0,0,0,0,0|3,0,1]=4 399 B7R0.1 FCCCCCCCl Amb27817669 [0,0,0,0,0,0|2,0,1]=3 400 B7R0.1 FCCCCCCI Amb25080138 [0,0,0,0,0,0|2,0,1]=3 401 B7R0.1 FCCCCCCS Amb24569228 [0,0,0,0,0,0|1,1,1]=3 402 B7R0.1 FCCNCCCCl Amb27233248 [0,0,0,0,0,0|3,0,1]=4 403 B7R0.1 FCCNC\C=C\Cl Amb28401247 [0,0,0,0,0,0|3,0,1]=4 404 B7R0.1 FCCSCCCCl Amb27172909 [0,0,0,0,0,0|3,0,1]=4 405 B7R0.1 ICCCCCCI Amb8514815 [0,0,0,0,0,0|2,0,1]=3 406 B7R0.1 N#CCCCCC#N Amb7809240 [0,0,0,0,0,0|2,0,2]=4 407 B7R0.1 N#CCCCCC=O Amb17593149 [0,0,0,0,0,0|1,0,1]=2 408 B7R0.1 N#CCCCCCBr Amb2685266 [0,0,0,0,0,0|2,0,1]=3 409 B7R0.1 N#CCCCCCF Amb17593193 [0,0,0,0,0,0|2,0,1]=3 410 B7R0.1 N#CCCCCCN Amb2721249 [0,0,0,0,0,0|2,0,1]=3 411 B7R0.1 N#CCCCCCN Amb31031060 [0,0,0,0,0,0|2,0,1]=3 412 B7R0.1 N#CCCCCCO Amb27665577 [0,0,0,0,0,0|2,0,1]=3 413 B7R0.1 N#CCCCCCS Amb28144803 [0,0,0,0,0,0|2,0,1]=3 414 B7R0.1 N#CCCNCCO Amb9243302 [0,0,0,0,0,0|3,0,1]=4 415 B7R0.1 N#CCCNCCS Amb27838355 [0,0,0,0,0,0|3,0,1]=4 416 B7R0.1 N#CCCOCC=O Amb27613546 [0,0,0,0,0,0|2,0,1]=3 417 B7R0.1 N#CCCOCCCl Amb22170576 [0,0,0,0,0,0|3,0,1]=4 418 B7R0.1 N#CCCOCCI Amb28324157 [0,0,0,0,0,0|3,0,1]=4 419 B7R0.1 N#CCCSCCO Amb3939502 [0,0,0,0,0,0|3,0,1]=4 420 B7R0.1 N#CCNCCCF Amb28282075 [0,0,0,0,0,0|3,0,1]=4 421 B7R0.1 N#CCOCCCO Amb24720648 [0,0,0,0,0,0|3,0,1]=4 422 B7R0.1 N#CCSCCCCl Amb20623081 [0,0,0,0,0,0|3,0,1]=4 423 B7R0.1 N#CCSCCCN Amb17500697 [0,0,0,0,0,0|3,0,1]=4 424 B7R0.1 N#CNCCCCF Amb28411388 [0,0,0,0,0,0|3,0,1]=4 425 B7R0.1 N#CSCCCCBr Amb1626701 [0,0,0,0,0,0|3,0,1]=4 426 B7R0.1 NCCCCCCBr Amb18648322 [0,0,0,0,0,0|2,0,1]=3 427 B7R0.1 NCCCCCCCl Amb31030966 [0,0,0,0,0,0|2,0,1]=3 428 B7R0.1 NCCCCCCF Amb28314228 [0,0,0,0,0,0|2,0,1]=3 429 B7R0.1 NCCCCCCN Amb2573303 [0,0,0,0,0,0|2,0,1]=3 430 B7R0.1 NCCCCCCN Amb8516658 [0,0,0,0,0,0|2,0,1]=3 431 B7R0.1 NCCCCCCO Amb2720515 [0,0,0,0,0,0|1,0,2]=3 432 B7R0.1 NCCCCCCS Amb18642745 [0,0,0,0,0,0|1,1,1]=3 433 B7R0.1 NCCCCCCS Amb24099361 [0,0,0,0,0,0|1,1,1]=3 434 B7R0.1 NCCCCCNO Amb24381036 [0,0,0,0,0,0|2,0,1]=3 435 B7R0.1 NCCCCCNO Amb33483225 [0,0,0,0,0,0|2,0,1]=3 436 B7R0.1 NCCCCN=C=S Amb27839586 [0,0,0,0,0,0|2,1,1]=4 437 B7R0.1 NCCCCNC=O Amb18641902 [0,0,0,0,0,0|2,0,0]=2 438 B7R0.1 NCCCNCCBr Amb26319089 [0,0,0,0,0,0|3,0,1]=4 439 B7R0.1 NCCCNCCBr Amb8391138 [0,0,0,0,0,0|3,0,1]=4 440 B7R0.1 NCCCNCCF Amb28076267 [0,0,0,0,0,0|3,0,1]=4 441 B7R0.1 NCCCNCCN Amb2725582 [0,0,0,0,0,0|3,0,1]=4 442 B7R0.1 NCCCNCCO Amb4035734 [0,0,0,0,0,0|2,0,2]=4 443 B7R0.1 NCCCNCCS Amb17607860 [0,0,0,0,0,0|2,1,1]=4 444 B7R0.1 NCCCOCCCl Amb27199285 [0,0,0,0,0,0|3,0,1]=4 445 B7R0.1 NCCCOCCF Amb27169291 [0,0,0,0,0,0|3,0,1]=4 446 B7R0.1 NCCCOCCF Amb33299411 [0,0,0,0,0,0|3,0,1]=4 447 B7R0.1 NCCCOCCO Amb33534338 [0,0,0,0,0,0|2,0,2]=4 448 B7R0.1 NCCCSCCO Amb9481738 [0,0,0,0,0,0|2,0,2]=4 449 B7R0.1 NCCNCCCCl Amb27429827 [0,0,0,0,0,0|3,0,1]=4 450 B7R0.1 NCCNCCCO Amb22732348 [0,0,0,0,0,0|2,0,2]=4 451 B7R0.1 NCCOCCCBr Amb33804025 [0,0,0,0,0,0|3,0,1]=4 452 B7R0.1 NCCOCCCBr Amb33804759 [0,0,0,0,0,0|3,0,1]=4 453 B7R0.1 NCCOCCCCl Amb33803399 [0,0,0,0,0,0|3,0,1]=4 454 B7R0.1 NCCOCCCCl Amb33804230 [0,0,0,0,0,0|3,0,1]=4 455 B7R0.1 NCCOCCCO Amb33551903 [0,0,0,0,0,0|2,0,2]=4 456 B7R0.1 NCCOCCCO Amb9392883 [0,0,0,0,0,0|2,0,2]=4 457 B7R0.1 NCCSCCCF Amb28284467 [0,0,0,0,0,0|3,0,1]=4 458 B7R0.1 NCCSCCCO Amb8876329 [0,0,0,0,0,0|2,0,2]=4 459 B7R0.1 NCCSC\C=C\Cl Amb9720269 [0,0,0,0,0,0|3,0,1]=4 460 B7R0.1 NNCCOCCO Amb27389862 [0,0,0,0,0,0|4,0,0]=4 461 B7R0.1 NOCCCCON Amb26339321 [0,0,0,0,0,0|4,0,0]=4 462 B7R0.1 NOCCOCCO Amb25952759 [0,0,0,0,0,0|4,0,0]=4 463 B7R0.1 NOCCSCCO Amb27198425 [0,0,0,0,0,0|4,0,0]=4 464 B7R0.1 O=C=NCCCCCl Amb27595099 [0,0,0,0,0,0|2,0,1]=3 465 B7R0.1 O=C=NCCCCF Amb27625761 [0,0,0,0,0,0|2,0,1]=3 466 B7R0.1 O=C=NCCCCO Amb27758809 [0,0,0,0,0,0|2,0,1]=3 467 B7R0.1 O=CC#CCCCCl Amb27759532 [0,0,0,0,0,0|1,0,2]=3 468 B7R0.1 O=CCCCCC=O Amb17593185 [0,0,0,0,0,0|1,0,1]=2 469 B7R0.1 O=CCCCCCBr Amb18127461 [0,0,0,0,0,0|1,0,0]=1 470 B7R0.1 O=CCCCCCCl Amb16185781 [0,0,0,0,0,0|1,0,0]=1 471 B7R0.1 O=CCCCCCF Amb24533888 [0,0,0,0,0,0|1,0,0]=1 472 B7R0.1 O=CCCCCCO Amb18641885 [0,0,0,0,0,0|1,0,0]=1 473 B7R0.1 O=CCCOCCO Amb18641946 [0,0,0,0,0,0|2,0,0]=2 474 B7R0.1 O=CCSCCCO Amb27871143 [0,0,0,0,0,0|2,0,0]=2 475 B7R0.1 O=CCSSCC=O Amb27169089 [0,0,0,0,0,0|3,0,1]=4 476 B7R0.1 O=CC\C=C\CC=O Amb26402388 [0,0,0,0,0,0|1,0,3]=4 477 B7R0.1 O=CNCCCCF Amb27168251 [0,0,0,0,0,0|2,0,0]=2 478 B7R0.1 O=CNCCCCO Amb28187191 [0,0,0,0,0,0|2,0,0]=2 479 B7R0.1 O=CNCCNC=O Amb1043861 [0,0,0,0,0,0|3,0,1]=4 480 B7R0.1 O=COCCOC=O Amb2721136 [0,0,0,0,0,0|3,0,1]=4 481 B7R0.1 O=COCOCCCl Amb28326081 [0,0,0,0,0,0|3,0,0]=3 482 B7R0.1 O=C\C=C\CCC=O Amb18124241 [0,0,0,0,0,0|1,0,3]=4 483 B7R0.1 OCCCCCCBr Amb24063183 [0,0,0,0,0,0|1,0,2]=3 484 B7R0.1 OCCCCCCBr Amb8514955 [0,0,0,0,0,0|1,0,2]=3 485 B7R0.1 OCCCCCCCl Amb2686112 [0,0,0,0,0,0|1,0,2]=3 486 B7R0.1 OCCCCCCF Amb24428671 [0,0,0,0,0,0|1,0,2]=3 487 B7R0.1 OCCCCCCI Amb28048917 [0,0,0,0,0,0|1,0,2]=3 488 B7R0.1 OCCCCCCO Amb6869970 [0,0,0,0,0,0|1,0,2]=3 489 B7R0.1 OCCCCCCS Amb9786744 [0,0,0,0,0,0|1,0,2]=3 490 B7R0.1 OCCCC\C=N\O Amb22336271 [0,0,0,0,0,0|2,0,2]=4 491 B7R0.1 OCCCNCCCl Amb27599845 [0,0,0,0,0,0|2,0,2]=4 492 B7R0.1 OCCCNCCO Amb4034437 [0,0,0,0,0,0|2,0,2]=4 493 B7R0.1 OCCCOCCCl Amb28194887 [0,0,0,0,0,0|2,0,2]=4 494 B7R0.1 OCCCSCCO Amb33531539 [0,0,0,0,0,0|2,0,2]=4 495 B7R0.1 OCCNCCCCl Amb27655296 [0,0,0,0,0,0|2,0,2]=4 496 B7R0.1 OCCOCCCCl Amb28128414 [0,0,0,0,0,0|2,0,2]=4 497 B7R0.1 OCCOCCCF Amb22008105 [0,0,0,0,0,0|2,0,2]=4 498 B7R0.1 OCCOCCOCl Amb27423637 [0,0,0,0,0,0|4,0,0]=4 499 B7R0.1 S=C=NCCCCBr Amb27483862 [0,0,0,0,0,0|2,1,1]=4 500 B7R0.1 SCCCSCCS Amb27656809 [0,0,0,0,0,0|2,1,1]=4 501 B7R0.1 [*]OCCOCCN Amb32409718 [0,0,0,0,0,0|4,0,0]=4 502 B7R0.1 [C-]#[N+]CCCCCC Amb2235425 [0,0,0,0,0,0|2,0,0]=2 503 B7R0.1 [C-]#[N+]CCCCOC Amb33377812 [0,0,0,0,0,0|3,0,0]=3 504 B7R0.1 [C-]#[N+]CCCCSC Amb33198737 [0,0,0,0,0,0|3,0,0]=3 505 B7R0.1 [C-]#[N+]CCCC[N+]#[C-] Amb3973105 [0,0,0,0,0,0|3,0,1]=4 506 B7R0.1 [C-]#[N+]CCCOCC Amb3973110 [0,0,0,0,0,0|3,0,0]=3 507 B7R0.1 [C-]#[N+]CCCSCC Amb33324017 [0,0,0,0,0,0|3,0,0]=3 508 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [0,0,0,0,0,0|3,0,0]=3 509 B7R0.1 [C-]#[N+]CC\C=C\CC Amb33268261 [0,0,0,0,0,0|2,0,2]=4 510 B7R0.1 [C-]#[N+]C\C=C\CCC Amb33327126 [0,0,0,0,0,0|2,0,2]=4 511 B7R0.1 [N-]=[N+]=NCCCC=O Amb26993491 [0,0,0,0,0,0|3,0,0]=3 512 B7R0.1 [N-]=[N+]=NCCCCBr Amb24558289 [0,0,0,0,0,0|4,0,0]=4 513 B7R0.1 [N-]=[N+]=NCCCCF Amb24653481 [0,0,0,0,0,0|4,0,0]=4 514 B7R0.1 [N-]=[N+]=NCCCCI Amb32729741 [0,0,0,0,0,0|4,0,0]=4 515 B7R0.1 [N-]=[N+]=NCCCCN Amb10604507 [0,0,0,0,0,0|4,0,0]=4 516 B7R0.1 [N-]=[N+]=NCCCCN Amb33802255 [0,0,0,0,0,0|4,0,0]=4 517 B7R0.1 [N-]=[N+]=NCCCCO Amb20623556 [0,0,0,0,0,0|4,0,0]=4 518 B6R0.6 BrCCCCCBr Amb6608668 [1,0,0,0,0,0|2,0,0]=3 519 B6R0.6 BrCCNCCBr Amb19869481 [1,0,0,0,0,0|3,0,0]=4 520 B6R0.6 BrCCOCCBr Amb2684741 [1,0,0,0,0,0|3,0,0]=4 521 B6R0.6 BrCCSCCBr Amb28468000 [1,0,0,0,0,0|3,0,0]=4 522 B6R0.6 BrCC[NH2+]CCBr Amb22166796 [1,0,0,0,0,0|3,0,0]=4 523 B6R0.6 C#CCCCC=C Amb22227961 [1,0,0,0,0,0|0,0,3]=4 524 B6R0.6 C#CCCCC=O Amb17593060 [1,0,0,0,0,0|0,0,2]=3 525 B6R0.6 C#CCCCCC Amb6297206 [1,0,0,0,0,0|0,0,2]=3 526 B6R0.6 C#CCCCCCl Amb6336487 [1,0,0,0,0,0|1,0,2]=4 527 B6R0.6 C#CCCCCF Amb33196082 [1,0,0,0,0,0|1,0,2]=4 528 B6R0.6 C#CCCCCI Amb22752649 [1,0,0,0,0,0|1,0,2]=4 529 B6R0.6 C#CCCCCN Amb22059283 [1,0,0,0,0,0|1,0,2]=4 530 B6R0.6 C#CCCCCN Amb33549738 [1,0,0,0,0,0|1,0,2]=4 531 B6R0.6 C#CCCCCO Amb6336500 [1,0,0,0,0,0|0,0,3]=4 532 B6R0.6 C#CCCCNC Amb29083253 [1,0,0,0,0,0|1,0,2]=4 533 B6R0.6 C#CCCCOC Amb25694831 [1,0,0,0,0,0|1,0,2]=4 534 B6R0.6 C#CCCCSC Amb26996684 [1,0,0,0,0,0|1,0,2]=4 535 B6R0.6 C#CCCNC=O Amb27447032 [1,0,0,0,0,0|1,0,2]=4 536 B6R0.6 C#CCCOCC Amb33169090 [1,0,0,0,0,0|1,0,2]=4 537 B6R0.6 C#CCCSCC Amb24670860 [1,0,0,0,0,0|1,0,2]=4 538 B6R0.6 C#CCNCCC Amb10610181 [1,0,0,0,0,0|1,0,2]=4 539 B6R0.6 C#CCNCCC Amb5262802 [1,0,0,0,0,0|1,0,2]=4 540 B6R0.6 C=C=CCCC=O Amb28208489 [1,0,0,0,0,0|0,0,3]=4 541 B6R0.6 C=C=CCCCCl Amb17939722 [1,0,0,0,0,0|1,0,2]=4 542 B6R0.6 C=C=CCCCN Amb27222280 [1,0,0,0,0,0|1,0,2]=4 543 B6R0.6 C=C=CCCCO Amb10605300 [1,0,0,0,0,0|1,0,2]=4 544 B6R0.6 C=CC#CCCC Amb17673843 [1,0,0,0,0,0|0,0,3]=4 545 B6R0.6 C=CCC#CCC Amb22227956 [1,0,0,0,0,0|0,0,3]=4 546 B6R0.6 C=CCCC#CC Amb35680296 [1,0,0,0,0,0|0,0,3]=4 547 B6R0.6 C=CCCCC#N Amb6298890 [1,0,0,0,0,0|1,0,2]=4 548 B6R0.6 C=CCCCC=C Amb22227760 [1,0,0,0,0,0|0,0,3]=4 549 B6R0.6 C=CCCCC=O Amb13883672 [1,0,0,0,0,0|0,0,2]=3 550 B6R0.6 C=CCCCCBr Amb3940222 [1,0,0,0,0,0|1,0,1]=3 551 B6R0.6 C=CCCCCC Amb3940498 [1,0,0,0,0,0|0,0,1]=2 552 B6R0.6 C=CCCCCCl Amb2692039 [1,0,0,0,0,0|1,0,1]=3 553 B6R0.6 C=CCCCCF Amb24409527 [1,0,0,0,0,0|1,0,1]=3 554 B6R0.6 C=CCCCCI Amb26858458 [1,0,0,0,0,0|1,0,1]=3 555 B6R0.6 C=CCCCCN Amb18639514 [1,0,0,0,0,0|1,0,1]=3 556 B6R0.6 C=CCCCCO Amb3940341 [1,0,0,0,0,0|1,0,1]=3 557 B6R0.6 C=CCCCNC Amb18523846 [1,0,0,0,0,0|1,0,1]=3 558 B6R0.6 C=CCCCNC Amb32651835 [1,0,0,0,0,0|1,0,1]=3 559 B6R0.6 C=CCCCNO Amb27437399 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.6 C=CCCCOC Amb24432882 [1,0,0,0,0,0|1,0,1]=3 561 B6R0.6 C=CCCOCCl Amb2696084 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.6 C=CCCSCC Amb27213772 [1,0,0,0,0,0|1,0,1]=3 563 B6R0.6 C=CCC\C=C\C Amb22734684 [1,0,0,0,0,0|0,0,3]=4 564 B6R0.6 C=CCNCCC Amb22587187 [1,0,0,0,0,0|1,0,1]=3 565 B6R0.6 C=CCNCCC Amb6683949 [1,0,0,0,0,0|1,0,1]=3 566 B6R0.6 C=CCNCCCl Amb17334072 [1,0,0,0,0,0|2,0,1]=4 567 B6R0.6 C=CCNCCN Amb17091015 [1,0,0,0,0,0|2,0,1]=4 568 B6R0.6 C=CCNCCO Amb6706545 [1,0,0,0,0,0|2,0,1]=4 569 B6R0.6 C=CCNCOC Amb27973157 [1,0,0,0,0,0|2,0,1]=4 570 B6R0.6 C=CCOCC=O Amb27402231 [1,0,0,0,0,0|1,0,2]=4 571 B6R0.6 C=CCOCCBr Amb33531510 [1,0,0,0,0,0|2,0,1]=4 572 B6R0.6 C=CCOCCC Amb3940491 [1,0,0,0,0,0|1,0,1]=3 573 B6R0.6 C=CCOCCCl Amb2696085 [1,0,0,0,0,0|2,0,1]=4 574 B6R0.6 C=CCOCCI Amb24739964 [1,0,0,0,0,0|2,0,1]=4 575 B6R0.6 C=CCOCCN Amb32667523 [1,0,0,0,0,0|2,0,1]=4 576 B6R0.6 C=CCOCCN Amb33530047 [1,0,0,0,0,0|2,0,1]=4 577 B6R0.6 C=CCOCCO Amb3940609 [1,0,0,0,0,0|2,0,1]=4 578 B6R0.6 C=CCOCOC Amb24385255 [1,0,0,0,0,0|2,0,1]=4 579 B6R0.6 C=CCSCC=O Amb18641509 [1,0,0,0,0,0|1,0,2]=4 580 B6R0.6 C=CCSCCCl Amb28042684 [1,0,0,0,0,0|2,0,1]=4 581 B6R0.6 C=CCSCCN Amb13951462 [1,0,0,0,0,0|2,0,1]=4 582 B6R0.6 C=CCSCCN Amb6273787 [1,0,0,0,0,0|2,0,1]=4 583 B6R0.6 C=COCCCC Amb8513427 [1,0,0,0,0,0|1,0,1]=3 584 B6R0.6 C=COCCCCl Amb27613489 [1,0,0,0,0,0|2,0,1]=4 585 B6R0.6 C=COCCCF Amb22008255 [1,0,0,0,0,0|2,0,1]=4 586 B6R0.6 C=COCCCN Amb3997182 [1,0,0,0,0,0|2,0,1]=4 587 B6R0.6 C=COCCOC Amb21520356 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.6 C=CSCCCN Amb27800121 [1,0,0,0,0,0|2,0,1]=4 589 B6R0.6 C=C\C=C\CCC Amb33171502 [1,0,0,0,0,0|0,0,3]=4 590 B6R0.6 CC#CCCCBr Amb18791571 [1,0,0,0,0,0|1,0,2]=4 591 B6R0.6 CC#CCCCCl Amb27865837 [1,0,0,0,0,0|1,0,2]=4 592 B6R0.6 CC#CCCCO Amb20242139 [1,0,0,0,0,0|0,0,3]=4 593 B6R0.6 CCC#CCC=O Amb28396959 [1,0,0,0,0,0|0,0,2]=3 594 B6R0.6 CCC#CCCBr Amb24712364 [1,0,0,0,0,0|1,0,2]=4 595 B6R0.6 CCC#CCCC Amb9134713 [1,0,0,0,0,0|0,0,3]=4 596 B6R0.6 CCC#CCCCl Amb25147478 [1,0,0,0,0,0|1,0,2]=4 597 B6R0.6 CCC#CCCI Amb24636544 [1,0,0,0,0,0|1,0,2]=4 598 B6R0.6 CCC#CCCN Amb26415259 [1,0,0,0,0,0|1,0,2]=4 599 B6R0.6 CCC#CCCO Amb8514641 [1,0,0,0,0,0|0,0,3]=4 600 B6R0.6 CCC=C=CC=O Amb27237589 [1,0,0,0,0,0|0,0,3]=4 601 B6R0.6 CCCC#CC=O Amb27244852 [1,0,0,0,0,0|0,0,2]=3 602 B6R0.6 CCCC#CCBr Amb25061301 [1,0,0,0,0,0|1,0,2]=4 603 B6R0.6 CCCC#CCN Amb17593063 [1,0,0,0,0,0|1,0,2]=4 604 B6R0.6 CCCC=C=CBr Amb27477883 [1,0,0,0,0,0|1,0,2]=4 605 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|2,0,1]=4 606 B6R0.6 CCCCC#CI Amb27632377 [1,0,0,0,0,0|1,0,2]=4 607 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [1,0,0,0,0,0|2,0,1]=4 608 B6R0.6 CCCCCC#N Amb6250301 [1,0,0,0,0,0|1,0,1]=3 609 B6R0.6 CCCCCC=O Amb3939522 [1,0,0,0,0,0|0,0,0]=1 610 B6R0.6 CCCCCCBr Amb3940085 [1,0,0,0,0,0|1,0,0]=2 611 B6R0.6 CCCCCCC Amb8513177 [1,0,0,0,0,0|0,0,1]=2 612 B6R0.6 CCCCCCCl Amb7764628 [1,0,0,0,0,0|1,0,0]=2 613 B6R0.6 CCCCCCF Amb8516643 [1,0,0,0,0,0|1,0,0]=2 614 B6R0.6 CCCCCCI Amb6608700 [1,0,0,0,0,0|1,0,0]=2 615 B6R0.6 CCCCCCN Amb2721179 [1,0,0,0,0,0|1,0,0]=2 616 B6R0.6 CCCCCCN Amb3940465 [1,0,0,0,0,0|1,0,0]=2 617 B6R0.6 CCCCCCO Amb3941500 [1,0,0,0,0,0|0,0,1]=2 618 B6R0.6 CCCCCCS Amb8514502 [1,0,0,0,0,0|0,1,0]=2 619 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|0,1,0]=2 620 B6R0.6 CCCCCNC Amb3939381 [1,0,0,0,0,0|1,0,1]=3 621 B6R0.6 CCCCCNN Amb32693399 [1,0,0,0,0,0|2,0,0]=3 622 B6R0.6 CCCCCNN Amb6249376 [1,0,0,0,0,0|2,0,0]=3 623 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|1,0,1]=3 624 B6R0.6 CCCCCOC Amb9787609 [1,0,0,0,0,0|1,0,1]=3 625 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|2,0,0]=3 626 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|1,0,1]=3 627 B6R0.6 CCCCN=C=O Amb3939310 [1,0,0,0,0,0|1,0,1]=3 628 B6R0.6 CCCCN=C=S Amb6572520 [1,0,0,0,0,0|1,1,1]=4 629 B6R0.6 CCCCN=[N+]=N Amb34916661 [1,0,0,0,0,0|3,0,0]=4 630 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,0,0,0,0,0|3,0,0]=4 631 B6R0.6 CCCCN=[N+]=[N-] Amb33526892 [1,0,0,0,0,0|3,0,0]=4 632 B6R0.6 CCCCNC=O Amb4017838 [1,0,0,0,0,0|1,0,0]=2 633 B6R0.6 CCCCNCC Amb3939842 [1,0,0,0,0,0|1,0,1]=3 634 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|2,0,1]=4 635 B6R0.6 CCCCOB=O Amb26900238 [1,0,0,0,0,0|2,0,0]=3 636 B6R0.6 CCCCOC=O Amb6608882 [1,0,0,0,0,0|1,0,0]=2 637 B6R0.6 CCCCOCC Amb2685642 [1,0,0,0,0,0|1,0,1]=3 638 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|1,0,1]=3 639 B6R0.6 CCCCON=O Amb8515227 [1,0,0,0,0,0|2,0,0]=3 640 B6R0.6 CCCCSC#N Amb4035931 [1,0,0,0,0,0|2,0,1]=4 641 B6R0.6 CCCCSCC Amb9787545 [1,0,0,0,0,0|1,0,1]=3 642 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|2,0,0]=3 643 B6R0.6 CCCCSCO Amb27623932 [1,0,0,0,0,0|1,0,1]=3 644 B6R0.6 CCCC\C=C\I Amb25173925 [1,0,0,0,0,0|1,0,1]=3 645 B6R0.6 CCCNCC#N Amb6714443 [1,0,0,0,0,0|2,0,1]=4 646 B6R0.6 CCCNCCC Amb3939352 [1,0,0,0,0,0|1,0,1]=3 647 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,0]=3 648 B6R0.6 CCCNCCN Amb8515461 [1,0,0,0,0,0|2,0,0]=3 649 B6R0.6 CCCNCCO Amb3939869 [1,0,0,0,0,0|1,0,1]=3 650 B6R0.6 CCCNCOC Amb27830080 [1,0,0,0,0,0|2,0,1]=4 651 B6R0.6 CCCNNCC Amb27409240 [1,0,0,0,0,0|2,0,1]=4 652 B6R0.6 CCCOCC#N Amb8874819 [1,0,0,0,0,0|2,0,1]=4 653 B6R0.6 CCCOCCC Amb8513440 [1,0,0,0,0,0|1,0,1]=3 654 B6R0.6 CCCOCCCl Amb8514866 [1,0,0,0,0,0|2,0,0]=3 655 B6R0.6 CCCOCCI Amb27596856 [1,0,0,0,0,0|2,0,0]=3 656 B6R0.6 CCCOCCN Amb3939563 [1,0,0,0,0,0|2,0,0]=3 657 B6R0.6 CCCOCCO Amb3939227 [1,0,0,0,0,0|1,0,1]=3 658 B6R0.6 CCCSCC#N Amb6680723 [1,0,0,0,0,0|2,0,1]=4 659 B6R0.6 CCCSCCBr Amb9304990 [1,0,0,0,0,0|2,0,0]=3 660 B6R0.6 CCCSCCC Amb9787473 [1,0,0,0,0,0|1,0,1]=3 661 B6R0.6 CCCSCCCl Amb9304987 [1,0,0,0,0,0|2,0,0]=3 662 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|2,0,0]=3 663 B6R0.6 CCCSCCN Amb6268693 [1,0,0,0,0,0|2,0,0]=3 664 B6R0.6 CCCSCCS Amb28050075 [1,0,0,0,0,0|1,1,0]=3 665 B6R0.6 CCCSCNC Amb27879006 [1,0,0,0,0,0|2,0,1]=4 666 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|2,0,1]=4 667 B6R0.6 CCC\C=C/C=O Amb25885814 [1,0,0,0,0,0|0,0,2]=3 668 B6R0.6 CCC\C=C\C=O Amb3940431 [1,0,0,0,0,0|0,0,2]=3 669 B6R0.6 CCC\C=C\CCl Amb27482813 [1,0,0,0,0,0|1,0,2]=4 670 B6R0.6 CCC\C=C\CN Amb33475254 [1,0,0,0,0,0|1,0,2]=4 671 B6R0.6 CCC\C=C\CO Amb32660968 [1,0,0,0,0,0|0,0,3]=4 672 B6R0.6 CCC\C=C\CS Amb33373719 [1,0,0,0,0,0|0,1,2]=4 673 B6R0.6 CCNCCC#N Amb2720499 [1,0,0,0,0,0|2,0,1]=4 674 B6R0.6 CCNCCCBr Amb27265760 [1,0,0,0,0,0|2,0,0]=3 675 B6R0.6 CCNCCCF Amb28050218 [1,0,0,0,0,0|2,0,0]=3 676 B6R0.6 CCNCCCN Amb17315269 [1,0,0,0,0,0|2,0,0]=3 677 B6R0.6 CCNCCCO Amb6733726 [1,0,0,0,0,0|1,0,1]=3 678 B6R0.6 CCNCCOC Amb32653021 [1,0,0,0,0,0|2,0,1]=4 679 B6R0.6 CCNCCOC Amb3939818 [1,0,0,0,0,0|2,0,1]=4 680 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|2,0,1]=4 681 B6R0.6 CCNCCSC Amb28941534 [1,0,0,0,0,0|2,0,1]=4 682 B6R0.6 CCNCNC=O Amb27252409 [1,0,0,0,0,0|2,0,0]=3 683 B6R0.6 CCNCNCC Amb27174562 [1,0,0,0,0,0|2,0,1]=4 684 B6R0.6 CCNC\C=C/I Amb23539308 [1,0,0,0,0,0|2,0,1]=4 685 B6R0.6 CCNOCCO Amb28281707 [1,0,0,0,0,0|2,0,1]=4 686 B6R0.6 CCN\C=C/C=O Amb27793118 [1,0,0,0,0,0|1,0,2]=4 687 B6R0.6 CCOCCC#N Amb4019489 [1,0,0,0,0,0|2,0,1]=4 688 B6R0.6 CCOCCC=O Amb25688261 [1,0,0,0,0,0|1,0,0]=2 689 B6R0.6 CCOCCCBr Amb8828206 [1,0,0,0,0,0|2,0,0]=3 690 B6R0.6 CCOCCCCl Amb6255304 [1,0,0,0,0,0|2,0,0]=3 691 B6R0.6 CCOCCCN Amb3939347 [1,0,0,0,0,0|2,0,0]=3 692 B6R0.6 CCOCCCO Amb3939322 [1,0,0,0,0,0|1,0,1]=3 693 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|2,0,1]=4 694 B6R0.6 CCOCCNC Amb33529221 [1,0,0,0,0,0|2,0,1]=4 695 B6R0.6 CCOCCNN Amb22587352 [1,0,0,0,0,0|3,0,0]=4 696 B6R0.6 CCOCCNN Amb6744628 [1,0,0,0,0,0|3,0,0]=4 697 B6R0.6 CCOCCOC Amb22052684 [1,0,0,0,0,0|2,0,1]=4 698 B6R0.6 CCOCCON Amb18061689 [1,0,0,0,0,0|3,0,0]=4 699 B6R0.6 CCOCNC=O Amb28252363 [1,0,0,0,0,0|2,0,0]=3 700 B6R0.6 CCOCOCC Amb8515183 [1,0,0,0,0,0|2,0,1]=4 701 B6R0.6 CCOC\C=C\Br Amb28244732 [1,0,0,0,0,0|2,0,1]=4 702 B6R0.6 CCO\C=C/C=O Amb27423444 [1,0,0,0,0,0|1,0,2]=4 703 B6R0.6 CCO\C=C\C=O Amb18639560 [1,0,0,0,0,0|1,0,2]=4 704 B6R0.6 CCSCCC#N Amb6680683 [1,0,0,0,0,0|2,0,1]=4 705 B6R0.6 CCSCCC=O Amb27254551 [1,0,0,0,0,0|1,0,0]=2 706 B6R0.6 CCSCCCBr Amb9305000 [1,0,0,0,0,0|2,0,0]=3 707 B6R0.6 CCSCCCI Amb28461625 [1,0,0,0,0,0|2,0,0]=3 708 B6R0.6 CCSCCCN Amb6680223 [1,0,0,0,0,0|2,0,0]=3 709 B6R0.6 CCSCCCO Amb3939588 [1,0,0,0,0,0|1,0,1]=3 710 B6R0.6 CCSCCCS Amb26476929 [1,0,0,0,0,0|1,1,0]=3 711 B6R0.6 CCSCCNC Amb16186669 [1,0,0,0,0,0|2,0,1]=4 712 B6R0.6 CCSCCNN Amb27218047 [1,0,0,0,0,0|3,0,0]=4 713 B6R0.6 CCSCCNO Amb33324087 [1,0,0,0,0,0|2,0,1]=4 714 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|3,0,0]=4 715 B6R0.6 CCSCNC=O Amb28315587 [1,0,0,0,0,0|2,0,0]=3 716 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|2,0,1]=4 717 B6R0.6 CC\C=C/CC=O Amb18639157 [1,0,0,0,0,0|0,0,2]=3 718 B6R0.6 CC\C=C/CCC Amb26600858 [1,0,0,0,0,0|0,0,3]=4 719 B6R0.6 CC\C=C/CCCl Amb27815138 [1,0,0,0,0,0|1,0,2]=4 720 B6R0.6 CC\C=C/CCI Amb28399922 [1,0,0,0,0,0|1,0,2]=4 721 B6R0.6 CC\C=C/CCO Amb2720771 [1,0,0,0,0,0|0,0,3]=4 722 B6R0.6 CC\C=C\CCBr Amb17570067 [1,0,0,0,0,0|1,0,2]=4 723 B6R0.6 CC\C=C\CCC Amb19930065 [1,0,0,0,0,0|0,0,3]=4 724 B6R0.6 CC\C=C\CCCl Amb27452933 [1,0,0,0,0,0|1,0,2]=4 725 B6R0.6 CC\C=C\CCN Amb17569886 [1,0,0,0,0,0|1,0,2]=4 726 B6R0.6 CC\C=C\CCO Amb3940339 [1,0,0,0,0,0|0,0,3]=4 727 B6R0.6 CC\C=C\CCS Amb32882654 [1,0,0,0,0,0|0,1,2]=4 728 B6R0.6 CNCCCCCl Amb34916601 [1,0,0,0,0,0|2,0,0]=3 729 B6R0.6 CNCCCCF Amb27231439 [1,0,0,0,0,0|2,0,0]=3 730 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|2,0,0]=3 731 B6R0.6 CNCCCCN Amb2698063 [1,0,0,0,0,0|2,0,0]=3 732 B6R0.6 CNCCCCO Amb33539277 [1,0,0,0,0,0|1,0,1]=3 733 B6R0.6 CNCCCNC Amb3940467 [1,0,0,0,0,0|2,0,1]=4 734 B6R0.6 CNCCCOC Amb33801534 [1,0,0,0,0,0|2,0,1]=4 735 B6R0.6 CNCCCOC Amb9204018 [1,0,0,0,0,0|2,0,1]=4 736 B6R0.6 CNCCCON Amb27430260 [1,0,0,0,0,0|3,0,0]=4 737 B6R0.6 CNCCCSC Amb6718995 [1,0,0,0,0,0|2,0,1]=4 738 B6R0.6 CNCC\C=C\Cl Amb27605601 [1,0,0,0,0,0|2,0,1]=4 739 B6R0.6 COCCCC#N Amb6258835 [1,0,0,0,0,0|2,0,1]=4 740 B6R0.6 COCCCC=O Amb33530955 [1,0,0,0,0,0|1,0,0]=2 741 B6R0.6 COCCCCBr Amb8855443 [1,0,0,0,0,0|2,0,0]=3 742 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|2,0,0]=3 743 B6R0.6 COCCCCI Amb25933499 [1,0,0,0,0,0|2,0,0]=3 744 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|2,0,0]=3 745 B6R0.6 COCCCCN Amb6251056 [1,0,0,0,0,0|2,0,0]=3 746 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|1,0,1]=3 747 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|1,1,0]=3 748 B6R0.6 COCCCNN Amb25887940 [1,0,0,0,0,0|3,0,0]=4 749 B6R0.6 COCCCNN Amb33204509 [1,0,0,0,0,0|3,0,0]=4 750 B6R0.6 COCCCNN Amb33553392 [1,0,0,0,0,0|3,0,0]=4 751 B6R0.6 COCCCNO Amb33378127 [1,0,0,0,0,0|2,0,1]=4 752 B6R0.6 COCCCOC Amb22168275 [1,0,0,0,0,0|2,0,1]=4 753 B6R0.6 COCCCON Amb18559290 [1,0,0,0,0,0|3,0,0]=4 754 B6R0.6 COCCCSC Amb28139052 [1,0,0,0,0,0|2,0,1]=4 755 B6R0.6 COCCN=C=O Amb901883 [1,0,0,0,0,0|2,0,1]=4 756 B6R0.6 COCCNC=O Amb24334241 [1,0,0,0,0,0|2,0,0]=3 757 B6R0.6 COCCOCCl Amb6608984 [1,0,0,0,0,0|3,0,0]=4 758 B6R0.6 COCCOCO Amb28281708 [1,0,0,0,0,0|2,0,1]=4 759 B6R0.6 COCCSCCl Amb33545127 [1,0,0,0,0,0|3,0,0]=4 760 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|2,0,1]=4 761 B6R0.6 COCOCC=O Amb27409311 [1,0,0,0,0,0|2,0,0]=3 762 B6R0.6 COCOCCCl Amb22546806 [1,0,0,0,0,0|3,0,0]=4 763 B6R0.6 COCOCCI Amb26443893 [1,0,0,0,0,0|3,0,0]=4 764 B6R0.6 COCOCCN Amb25314793 [1,0,0,0,0,0|3,0,0]=4 765 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|2,0,1]=4 766 B6R0.6 COC\C=C\C=O Amb33473884 [1,0,0,0,0,0|1,0,2]=4 767 B6R0.6 CONCCCN Amb26953498 [1,0,0,0,0,0|3,0,0]=4 768 B6R0.6 CONCCCN Amb30584683 [1,0,0,0,0,0|3,0,0]=4 769 B6R0.6 CONCCCN Amb32666616 [1,0,0,0,0,0|3,0,0]=4 770 B6R0.6 CONCCCO Amb24479622 [1,0,0,0,0,0|2,0,1]=4 771 B6R0.6 CONCCCO Amb33456216 [1,0,0,0,0,0|2,0,1]=4 772 B6R0.6 CSCCCC#N Amb17504231 [1,0,0,0,0,0|2,0,1]=4 773 B6R0.6 CSCCCC=O Amb25992553 [1,0,0,0,0,0|1,0,0]=2 774 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|2,0,0]=3 775 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|2,0,0]=3 776 B6R0.6 CSCCCCF Amb27620229 [1,0,0,0,0,0|2,0,0]=3 777 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|2,0,0]=3 778 B6R0.6 CSCCCCO Amb9825911 [1,0,0,0,0,0|1,0,1]=3 779 B6R0.6 CSCCCCS Amb27461555 [1,0,0,0,0,0|1,1,0]=3 780 B6R0.6 CSCCCNN Amb24093854 [1,0,0,0,0,0|3,0,0]=4 781 B6R0.6 CSCCCNO Amb27948053 [1,0,0,0,0,0|2,0,1]=4 782 B6R0.6 CSCCCON Amb27947150 [1,0,0,0,0,0|3,0,0]=4 783 B6R0.6 CSCCCSC Amb22043311 [1,0,0,0,0,0|2,0,1]=4 784 B6R0.6 CSCCN=C=O Amb19889355 [1,0,0,0,0,0|2,0,1]=4 785 B6R0.6 CSCCNC=O Amb28437305 [1,0,0,0,0,0|2,0,0]=3 786 B6R0.6 CSC\C=C\C=O Amb33271737 [1,0,0,0,0,0|1,0,2]=4 787 B6R0.6 C\C=C/CCC=O Amb28202620 [1,0,0,0,0,0|0,0,2]=3 788 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|1,0,1]=3 789 B6R0.6 C\C=C/CCCN Amb27658374 [1,0,0,0,0,0|1,0,2]=4 790 B6R0.6 C\C=C/CCCO Amb17614951 [1,0,0,0,0,0|0,0,3]=4 791 B6R0.6 C\C=C\CCC=O Amb17593074 [1,0,0,0,0,0|0,0,2]=3 792 B6R0.6 C\C=C\CCCC Amb8515158 [1,0,0,0,0,0|1,0,1]=3 793 B6R0.6 C\C=C\CCCI Amb25837122 [1,0,0,0,0,0|1,0,2]=4 794 B6R0.6 C\C=C\CCCO Amb22347882 [1,0,0,0,0,0|0,0,3]=4 795 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|2,0,1]=4 796 B6R0.6 ClCCCCCBr Amb2724373 [1,0,0,0,0,0|2,0,0]=3 797 B6R0.6 ClCCCCCCl Amb6608828 [1,0,0,0,0,0|2,0,0]=3 798 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|2,0,0]=3 799 B6R0.6 ClCCCOCBr Amb28458531 [1,0,0,0,0,0|3,0,0]=4 800 B6R0.6 ClCCCOCCl Amb24479881 [1,0,0,0,0,0|3,0,0]=4 801 B6R0.6 ClCCNCCCl Amb2583221 [1,0,0,0,0,0|3,0,0]=4 802 B6R0.6 ClCCNCCCl Amb6366187 [1,0,0,0,0,0|3,0,0]=4 803 B6R0.6 ClCCOCCCl Amb2684745 [1,0,0,0,0,0|3,0,0]=4 804 B6R0.6 ClCCOCCI Amb24055322 [1,0,0,0,0,0|3,0,0]=4 805 B6R0.6 ClCCSCCBr Amb27838203 [1,0,0,0,0,0|3,0,0]=4 806 B6R0.6 ClCCSCCCl Amb22731869 [1,0,0,0,0,0|3,0,0]=4 807 B6R0.6 ClCOCCCBr Amb25889019 [1,0,0,0,0,0|3,0,0]=4 808 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|2,0,0]=3 809 B6R0.6 FCCCCCF Amb27397467 [1,0,0,0,0,0|2,0,0]=3 810 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|1,1,0]=3 811 B6R0.6 FCCNCCBr Amb28041488 [1,0,0,0,0,0|3,0,0]=4 812 B6R0.6 FCCNCCF Amb27627389 [1,0,0,0,0,0|3,0,0]=4 813 B6R0.6 FCCSCCCl Amb28423486 [1,0,0,0,0,0|3,0,0]=4 814 B6R0.6 ICCCCCI Amb8514835 [1,0,0,0,0,0|2,0,0]=3 815 B6R0.6 ICCOCCI Amb2694690 [1,0,0,0,0,0|3,0,0]=4 816 B6R0.6 N#CCCCC=O Amb18120556 [1,0,0,0,0,0|1,0,1]=3 817 B6R0.6 N#CCCCCBr Amb2685556 [1,0,0,0,0,0|2,0,1]=4 818 B6R0.6 N#CCCCCCl Amb3940299 [1,0,0,0,0,0|2,0,1]=4 819 B6R0.6 N#CCCCCF Amb26935678 [1,0,0,0,0,0|2,0,1]=4 820 B6R0.6 N#CCCCCI Amb27650166 [1,0,0,0,0,0|2,0,1]=4 821 B6R0.6 N#CCCCCN Amb30628578 [1,0,0,0,0,0|2,0,1]=4 822 B6R0.6 N#CCCCCN Amb33532899 [1,0,0,0,0,0|2,0,1]=4 823 B6R0.6 N#CCCCCO Amb33531864 [1,0,0,0,0,0|1,0,2]=4 824 B6R0.6 NCCCCC=O Amb26627836 [1,0,0,0,0,0|1,0,0]=2 825 B6R0.6 NCCCCCBr Amb26581378 [1,0,0,0,0,0|2,0,0]=3 826 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|2,0,0]=3 827 B6R0.6 NCCCCCF Amb28383861 [1,0,0,0,0,0|2,0,0]=3 828 B6R0.6 NCCCCCF Amb35747648 [1,0,0,0,0,0|2,0,0]=3 829 B6R0.6 NCCCCCI Amb27596855 [1,0,0,0,0,0|2,0,0]=3 830 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|2,0,0]=3 831 B6R0.6 NCCCCCN Amb8513099 [1,0,0,0,0,0|2,0,0]=3 832 B6R0.6 NCCCCCO Amb3939337 [1,0,0,0,0,0|1,0,1]=3 833 B6R0.6 NCCCCCS Amb33362345 [1,0,0,0,0,0|1,1,0]=3 834 B6R0.6 NCCCCCS Amb33527075 [1,0,0,0,0,0|1,1,0]=3 835 B6R0.6 NCCCCNO Amb24117989 [1,0,0,0,0,0|2,0,1]=4 836 B6R0.6 NCCCCNO Amb27668394 [1,0,0,0,0,0|2,0,1]=4 837 B6R0.6 NCCCCON Amb28188672 [1,0,0,0,0,0|3,0,0]=4 838 B6R0.6 NCCCNC=O Amb5723517 [1,0,0,0,0,0|2,0,0]=3 839 B6R0.6 NCCCOCF Amb33224234 [1,0,0,0,0,0|3,0,0]=4 840 B6R0.6 NCCC\C=C/I Amb28050291 [1,0,0,0,0,0|2,0,1]=4 841 B6R0.6 NCCNCCBr Amb27478238 [1,0,0,0,0,0|3,0,0]=4 842 B6R0.6 NCCNCCN Amb5722362 [1,0,0,0,0,0|3,0,0]=4 843 B6R0.6 NCCNCCO Amb6600573 [1,0,0,0,0,0|2,0,1]=4 844 B6R0.6 NCCNCCS Amb24763096 [1,0,0,0,0,0|2,1,0]=4 845 B6R0.6 NCCNCCS Amb33483741 [1,0,0,0,0,0|2,1,0]=4 846 B6R0.6 NCCOCCBr Amb25888513 [1,0,0,0,0,0|3,0,0]=4 847 B6R0.6 NCCOCCBr Amb35747990 [1,0,0,0,0,0|3,0,0]=4 848 B6R0.6 NCCOCCCl Amb22036609 [1,0,0,0,0,0|3,0,0]=4 849 B6R0.6 NCCOCCF Amb28320518 [1,0,0,0,0,0|3,0,0]=4 850 B6R0.6 NCCOCCF Amb33536623 [1,0,0,0,0,0|3,0,0]=4 851 B6R0.6 NCCOCCN Amb2583212 [1,0,0,0,0,0|3,0,0]=4 852 B6R0.6 NCCOCCN Amb8504888 [1,0,0,0,0,0|3,0,0]=4 853 B6R0.6 NCCOCCO Amb3939011 [1,0,0,0,0,0|2,0,1]=4 854 B6R0.6 NCCOCCS Amb17502015 [1,0,0,0,0,0|2,1,0]=4 855 B6R0.6 NCCOCCS Amb35789823 [1,0,0,0,0,0|2,1,0]=4 856 B6R0.6 NCCSCCN Amb32679817 [1,0,0,0,0,0|3,0,0]=4 857 B6R0.6 NCCSCCN Amb9695000 [1,0,0,0,0,0|3,0,0]=4 858 B6R0.6 NCCSCCO Amb2725559 [1,0,0,0,0,0|2,0,1]=4 859 B6R0.6 NNCCCCO Amb24692523 [1,0,0,0,0,0|2,0,1]=4 860 B6R0.6 NOCCCCF Amb27160797 [1,0,0,0,0,0|3,0,0]=4 861 B6R0.6 O=C=NCCCBr Amb27859638 [1,0,0,0,0,0|2,0,1]=4 862 B6R0.6 O=C=NCCCCl Amb3939153 [1,0,0,0,0,0|2,0,1]=4 863 B6R0.6 O=C=NCCCF Amb27838244 [1,0,0,0,0,0|2,0,1]=4 864 B6R0.6 O=CCCCC=O Amb6600455 [1,0,0,0,0,0|1,0,1]=3 865 B6R0.6 O=CCCCCBr Amb18126353 [1,0,0,0,0,0|1,0,0]=2 866 B6R0.6 O=CCCCCCl Amb18123550 [1,0,0,0,0,0|1,0,0]=2 867 B6R0.6 O=CCCCCO Amb10603837 [1,0,0,0,0,0|1,0,0]=2 868 B6R0.6 O=CCCCN=O Amb27838215 [1,0,0,0,0,0|2,0,0]=3 869 B6R0.6 O=CCC\C=C/Br Amb27838206 [1,0,0,0,0,0|1,0,2]=4 870 B6R0.6 O=CCC\C=C\Cl Amb27955198 [1,0,0,0,0,0|1,0,2]=4 871 B6R0.6 O=CNCCCO Amb27248821 [1,0,0,0,0,0|2,0,0]=3 872 B6R0.6 O=C\C=C/CCO Amb27235316 [1,0,0,0,0,0|1,0,2]=4 873 B6R0.6 O=C\C=C\CCF Amb33429802 [1,0,0,0,0,0|1,0,2]=4 874 B6R0.6 O=[PH2]OCCCO Amb27218913 [1,0,0,0,0,0|3,0,0]=4 875 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|1,0,1]=3 876 B6R0.6 OCCCCCCl Amb8386939 [1,0,0,0,0,0|1,0,1]=3 877 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|1,0,1]=3 878 B6R0.6 OCCCCCO Amb6296608 [1,0,0,0,0,0|1,0,1]=3 879 B6R0.6 OCCCCNO Amb27396013 [1,0,0,0,0,0|2,0,1]=4 880 B6R0.6 OCCC\C=C\Br Amb27483322 [1,0,0,0,0,0|2,0,1]=4 881 B6R0.6 OCCC\C=C\I Amb27879078 [1,0,0,0,0,0|2,0,1]=4 882 B6R0.6 OCCNCCF Amb27468539 [1,0,0,0,0,0|2,0,1]=4 883 B6R0.6 OCCNCCO Amb22035219 [1,0,0,0,0,0|2,0,1]=4 884 B6R0.6 OCCNCCO Amb3997179 [1,0,0,0,0,0|2,0,1]=4 885 B6R0.6 OCCNCCS Amb18522180 [1,0,0,0,0,0|2,0,1]=4 886 B6R0.6 OCCOCCBr Amb24057456 [1,0,0,0,0,0|2,0,1]=4 887 B6R0.6 OCCOCCCl Amb3940337 [1,0,0,0,0,0|2,0,1]=4 888 B6R0.6 OCCOCCF Amb17593119 [1,0,0,0,0,0|2,0,1]=4 889 B6R0.6 OCCOCCI Amb27602214 [1,0,0,0,0,0|2,0,1]=4 890 B6R0.6 OCCOCCO Amb32671216 [1,0,0,0,0,0|2,0,1]=4 891 B6R0.6 OCCOCCO Amb6608789 [1,0,0,0,0,0|2,0,1]=4 892 B6R0.6 OCCOCCS Amb22008751 [1,0,0,0,0,0|2,0,1]=4 893 B6R0.6 OCCPCCO Amb27185495 [1,0,0,0,0,0|2,0,1]=4 894 B6R0.6 OCCSCCCl Amb27413860 [1,0,0,0,0,0|2,0,1]=4 895 B6R0.6 OCCSCCO Amb6891967 [1,0,0,0,0,0|2,0,1]=4 896 B6R0.6 OCCSCCS Amb27829564 [1,0,0,0,0,0|2,0,1]=4 897 B6R0.6 SCCCCCS Amb8514611 [1,0,0,0,0,0|1,1,0]=3 898 B6R0.6 SCCOCCS Amb9786765 [1,0,0,0,0,0|2,1,0]=4 899 B6R0.6 SCCSCCS Amb9826816 [1,0,0,0,0,0|2,1,0]=4 900 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [1,0,0,0,0,0|1,0,1]=3 901 B6R0.6 [C-]#[N+]CCCCF Amb26005128 [1,0,0,0,0,0|2,0,1]=4 902 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,0,0,0,0,0|2,0,1]=4 903 B6R0.6 [C-]#[N+]CCCSC Amb33198739 [1,0,0,0,0,0|2,0,1]=4 904 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,0,0,0,0,0|2,0,1]=4 905 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [1,0,0,0,0,0|2,0,1]=4 906 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [1,0,0,0,0,0|3,0,0]=4 907 B8R0.1 C#CCC(=O)CCCC Amb8390126 [0,1,0,0,0,0|1,0,2]=4 908 B8R0.1 C#CCC(N)CCOC Amb24529100 [0,1,0,0,0,0|2,0,1]=4 909 B8R0.1 C#CCC(N)COCC Amb27765448 [0,1,0,0,0,0|2,0,1]=4 910 B8R0.1 C#CCC(O)CCCC Amb8390125 [0,1,0,0,0,0|1,0,1]=3 911 B8R0.1 C#CCCC(=O)CCC Amb8869650 [0,1,0,0,0,0|1,0,2]=4 912 B8R0.1 C#CCCC(C)CCC Amb33320827 [0,1,0,0,0,0|1,0,1]=3 913 B8R0.1 C#CCCC(C)OCC Amb33425001 [0,1,0,0,0,0|2,0,1]=4 914 B8R0.1 C#CCCC(Cl)CCC Amb28207451 [0,1,0,0,0,0|1,0,1]=3 915 B8R0.1 C#CCCC(N)CCC Amb27837513 [0,1,0,0,0,0|1,0,1]=3 916 B8R0.1 C#CCCC(O)CC=C Amb27404431 [0,1,0,0,0,0|1,0,2]=4 917 B8R0.1 C#CCCC(O)CCN Amb26477794 [0,1,0,0,0,0|2,0,1]=4 918 B8R0.1 C#CCCC(O)CCN Amb32652331 [0,1,0,0,0,0|2,0,1]=4 919 B8R0.1 C#CCCC(O)CNC Amb27218657 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.1 C#CCCC(O)COC Amb27257354 [0,1,0,0,0,0|2,0,1]=4 921 B8R0.1 C#CCC[C@H](O)CC=C Amb27856360 [0,1,0,0,0,0|1,0,2]=4 922 B8R0.1 C#CCN[C@@H](C)CCC Amb27796836 [0,1,0,0,0,0|2,0,1]=4 923 B8R0.1 C#CC[C@@H](C)CCC=O Amb28436169 [0,1,0,0,0,0|0,0,2]=3 924 B8R0.1 C=C(CCN)CCCC Amb25883662 [0,1,0,0,0,0|1,0,2]=4 925 B8R0.1 C=C(CCO)CCC=O Amb28367058 [0,1,0,0,0,0|1,0,1]=3 926 B8R0.1 C=C=CC(O)CCCC Amb28065816 [0,1,0,0,0,0|1,0,2]=4 927 B8R0.1 C=C=CCC(N)CCC Amb27881738 [0,1,0,0,0,0|1,0,2]=4 928 B8R0.1 C=C=C[C@@H](O)CCCC Amb28315458 [0,1,0,0,0,0|1,0,2]=4 929 B8R0.1 C=CCC(=C)CCCO Amb27213958 [0,1,0,0,0,0|2,0,1]=4 930 B8R0.1 C=CCC(=O)CCCBr Amb27401886 [0,1,0,0,0,0|2,0,1]=4 931 B8R0.1 C=CCC(=O)CCCC Amb10567269 [0,1,0,0,0,0|1,0,1]=3 932 B8R0.1 C=CCC(=O)CCCN Amb27252862 [0,1,0,0,0,0|2,0,1]=4 933 B8R0.1 C=CCC(=O)COCC Amb27402397 [0,1,0,0,0,0|2,0,1]=4 934 B8R0.1 C=CCC(=O)CSCC Amb27265833 [0,1,0,0,0,0|2,0,1]=4 935 B8R0.1 C=CCC(=O)NCCC Amb27437889 [0,1,0,0,0,0|2,0,1]=4 936 B8R0.1 C=CCC(C)CCNC Amb28456333 [0,1,0,0,0,0|2,0,0]=3 937 B8R0.1 C=CCC(C)NCCC Amb27398788 [0,1,0,0,0,0|2,0,0]=3 938 B8R0.1 C=CCC(C)NCCN Amb27956548 [0,1,0,0,0,0|3,0,0]=4 939 B8R0.1 C=CCC(N)CCOC Amb28195821 [0,1,0,0,0,0|2,0,0]=3 940 B8R0.1 C=CCC(N)CNCC Amb27246430 [0,1,0,0,0,0|2,0,0]=3 941 B8R0.1 C=CCC(O)CCCCl Amb27168820 [0,1,0,0,0,0|2,0,0]=3 942 B8R0.1 C=CCCC(=C)CCO Amb27218611 [0,1,0,0,0,0|2,0,1]=4 943 B8R0.1 C=CCCC(=O)CCC Amb9031599 [0,1,0,0,0,0|1,0,1]=3 944 B8R0.1 C=CCCC(=O)OCC Amb10601809 [0,1,0,0,0,0|2,0,1]=4 945 B8R0.1 C=CCCC(C)CCN Amb27424737 [0,1,0,0,0,0|2,0,0]=3 946 B8R0.1 C=CCCC(C)NC=O Amb27873904 [0,1,0,0,0,0|1,0,2]=4 947 B8R0.1 C=CCCC(Cl)CCC Amb27646258 [0,1,0,0,0,0|1,0,0]=2 948 B8R0.1 C=CCCC(N)CC=C Amb28346574 [0,1,0,0,0,0|1,0,2]=4 949 B8R0.1 C=CCCC(N)CCO Amb27595567 [0,1,0,0,0,0|2,0,0]=3 950 B8R0.1 C=CCCC(N)CNC Amb28186021 [0,1,0,0,0,0|2,0,0]=3 951 B8R0.1 C=CCCC(O)CCC Amb27837426 [0,1,0,0,0,0|1,0,0]=2 952 B8R0.1 C=CCCC(O)CCO Amb28049164 [0,1,0,0,0,0|2,0,0]=3 953 B8R0.1 C=CCCC(O)CSC Amb27974606 [0,1,0,0,0,0|2,0,0]=3 954 B8R0.1 C=CCCN(C)CCI Amb27837702 [0,1,0,0,0,0|3,0,0]=4 955 B8R0.1 C=CCCN(C)CCN Amb27255519 [0,1,0,0,0,0|3,0,0]=4 956 B8R0.1 C=CCC[C@@H](N)COC Amb27493979 [0,1,0,0,0,0|2,0,0]=3 957 B8R0.1 C=CCC[C@@H](O)CCBr Amb27401904 [0,1,0,0,0,0|2,0,0]=3 958 B8R0.1 C=CCC[C@@H](O)\C=C\C Amb27778787 [0,1,0,0,0,0|1,0,2]=4 959 B8R0.1 C=CCC[C@H](C)CC=O Amb27751376 [0,1,0,0,0,0|0,0,2]=3 960 B8R0.1 C=CCC[C@H](O)C#CC Amb28049266 [0,1,0,0,0,0|1,0,2]=4 961 B8R0.1 C=CCN(C)CCCF Amb27261191 [0,1,0,0,0,0|3,0,0]=4 962 B8R0.1 C=CCN(C)CCNC Amb27797234 [0,1,0,0,0,0|3,0,0]=4 963 B8R0.1 C=CCNC(=N)CCC Amb27602260 [0,1,0,0,0,0|2,0,1]=4 964 B8R0.1 C=CCNC(C)CCBr Amb28079479 [0,1,0,0,0,0|3,0,0]=4 965 B8R0.1 C=CCNC(C)CCCl Amb27971650 [0,1,0,0,0,0|3,0,0]=4 966 B8R0.1 C=CCNC(C)COC Amb26058590 [0,1,0,0,0,0|3,0,0]=4 967 B8R0.1 C=CCNC(C)COC Amb32666529 [0,1,0,0,0,0|3,0,0]=4 968 B8R0.1 C=CCOC(=O)CCC Amb3940492 [0,1,0,0,0,0|2,0,1]=4 969 B8R0.1 C=CCOC(C)CCO Amb28400858 [0,1,0,0,0,0|3,0,0]=4 970 B8R0.1 C=CCO[C@H](C)CCBr Amb27634910 [0,1,0,0,0,0|3,0,0]=4 971 B8R0.1 C=CCO[C@H](C)CCO Amb27752319 [0,1,0,0,0,0|3,0,0]=4 972 B8R0.1 C=CCSC(C)CCO Amb27812964 [0,1,0,0,0,0|3,0,0]=4 973 B8R0.1 C=CC[C@@H](O)CCCC Amb28139816 [0,1,0,0,0,0|1,0,0]=2 974 B8R0.1 CC#CCC(Cl)CCC Amb27617249 [0,1,0,0,0,0|1,0,2]=4 975 B8R0.1 CC#CC[C@@H](C)CC=O Amb27634469 [0,1,0,0,0,0|0,0,2]=3 976 B8R0.1 CC#CC[C@H](O)CCC Amb28049229 [0,1,0,0,0,0|1,0,2]=4 977 B8R0.1 CC(CC#N)CCC=O Amb27836842 [0,1,0,0,0,0|1,0,1]=3 978 B8R0.1 CC(CCBr)CCCO Amb27863912 [0,1,0,0,0,0|1,0,2]=4 979 B8R0.1 CC(CCC=O)NC=O Amb17593357 [0,1,0,0,0,0|2,0,1]=4 980 B8R0.1 CC(CCCCl)OC=O Amb28285247 [0,1,0,0,0,0|2,0,0]=3 981 B8R0.1 CC(CCCO)OC=O Amb27978395 [0,1,0,0,0,0|2,0,0]=3 982 B8R0.1 CC(CCO)CCCO Amb28189390 [0,1,0,0,0,0|1,0,2]=4 983 B8R0.1 CC(CCO)CNC=O Amb28207892 [0,1,0,0,0,0|2,0,0]=3 984 B8R0.1 CC(CCO)SCC=O Amb27951734 [0,1,0,0,0,0|2,0,0]=3 985 B8R0.1 CC=C=CC(O)CCC Amb28321362 [0,1,0,0,0,0|1,0,2]=4 986 B8R0.1 CCCC(=O)CCC=O Amb18642627 [0,1,0,0,0,0|0,0,1]=2 987 B8R0.1 CCCC(=O)CCCF Amb28182770 [0,1,0,0,0,0|1,0,2]=4 988 B8R0.1 CCCC(=O)CCCN Amb27866597 [0,1,0,0,0,0|1,0,2]=4 989 B8R0.1 CCCC(=O)NCC=O Amb17102055 [0,1,0,0,0,0|1,0,1]=3 990 B8R0.1 CCCC(=O)NNC=O Amb28070383 [0,1,0,0,0,0|2,0,1]=4 991 B8R0.1 CCCC(Br)CCCN Amb27645439 [0,1,0,0,0,0|1,0,1]=3 992 B8R0.1 CCCC(C)CCC#N Amb25104393 [0,1,0,0,0,0|1,0,1]=3 993 B8R0.1 CCCC(C)CCC=O Amb25032222 [0,1,0,0,0,0|0,0,0]=1 994 B8R0.1 CCCC(C)CCCBr Amb33533621 [0,1,0,0,0,0|1,0,1]=3 995 B8R0.1 CCCC(C)CCCCl Amb27859186 [0,1,0,0,0,0|1,0,1]=3 996 B8R0.1 CCCC(C)CCCN Amb27654811 [0,1,0,0,0,0|1,0,1]=3 997 B8R0.1 CCCC(C)CCCO Amb25135097 [0,1,0,0,0,0|0,0,2]=3 998 B8R0.1 CCCC(C)CCCS Amb33320795 [0,1,0,0,0,0|0,1,1]=3 999 B8R0.1 CCCC(C)CCNC Amb26948262 [0,1,0,0,0,0|2,0,0]=3 1000 B8R0.1 CCCC(C)CCON Amb33320572 [0,1,0,0,0,0|2,0,0]=3 1001 B8R0.1 CCCC(C)CN=C=O Amb25223002 [0,1,0,0,0,0|1,0,1]=3 1002 B8R0.1 CCCC(C)CN=[N+]=[N-] Amb26885538 [0,1,0,0,0,0|3,0,0]=4 1003 B8R0.1 CCCC(C)COC=O Amb24325312 [0,1,0,0,0,0|1,0,0]=2 1004 B8R0.1 CCCC(C)COCCl Amb27213174 [0,1,0,0,0,0|2,0,1]=4 1005 B8R0.1 CCCC(C)NCCCl Amb27801679 [0,1,0,0,0,0|2,0,1]=4 1006 B8R0.1 CCCC(C)NCCF Amb27838496 [0,1,0,0,0,0|2,0,1]=4 1007 B8R0.1 CCCC(C)NCCN Amb28049074 [0,1,0,0,0,0|2,0,1]=4 1008 B8R0.1 CCCC(C)OCCBr Amb27812220 [0,1,0,0,0,0|2,0,1]=4 1009 B8R0.1 CCCC(C)OCCCl Amb27663690 [0,1,0,0,0,0|2,0,1]=4 1010 B8R0.1 CCCC(C)OCCN Amb27267655 [0,1,0,0,0,0|2,0,1]=4 1011 B8R0.1 CCCC(C)OCCS Amb27812221 [0,1,0,0,0,0|1,1,1]=4 1012 B8R0.1 CCCC(C)\C=C\C=O Amb18642466 [0,1,0,0,0,0|0,0,2]=3 1013 B8R0.1 CCCC(F)CN=C=O Amb28077294 [0,1,0,0,0,0|1,0,1]=3 1014 B8R0.1 CCCC(N)CCCN Amb27255552 [0,1,0,0,0,0|1,0,1]=3 1015 B8R0.1 CCCC(N)CCNC Amb27196610 [0,1,0,0,0,0|2,0,0]=3 1016 B8R0.1 CCCC(O)CCCBr Amb27591160 [0,1,0,0,0,0|1,0,1]=3 1017 B8R0.1 CCCC(O)CCCO Amb4035231 [0,1,0,0,0,0|0,0,2]=3 1018 B8R0.1 CCCC(O)CCCS Amb25740546 [0,1,0,0,0,0|0,1,1]=3 1019 B8R0.1 CCCC(O)CCOC Amb28049045 [0,1,0,0,0,0|2,0,0]=3 1020 B8R0.1 CCCC(O)CN=[N+]=[N-] Amb28070955 [0,1,0,0,0,0|3,0,0]=4 1021 B8R0.1 CCCC(O)CNC=O Amb27751441 [0,1,0,0,0,0|1,0,0]=2 1022 B8R0.1 CCCC(O)CNCC Amb27175353 [0,1,0,0,0,0|2,0,1]=4 1023 B8R0.1 CCCC(O)\C=C\C=O Amb24513207 [0,1,0,0,0,0|0,0,2]=3 1024 B8R0.1 CCCCC(=O)CC#N Amb7768265 [0,1,0,0,0,0|1,0,2]=4 1025 B8R0.1 CCCCC(=O)CCC Amb3940685 [0,1,0,0,0,0|1,0,2]=4 1026 B8R0.1 CCCCC(=O)CCN Amb28186730 [0,1,0,0,0,0|1,0,2]=4 1027 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,1,0,0,0,0|2,0,1]=4 1028 B8R0.1 CCCCC(=O)COC Amb19374627 [0,1,0,0,0,0|2,0,1]=4 1029 B8R0.1 CCCCC(=O)CSC Amb27837495 [0,1,0,0,0,0|2,0,1]=4 1030 B8R0.1 CCCCC(=O)N=C=O Amb17231844 [0,1,0,0,0,0|1,0,2]=4 1031 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [0,1,0,0,0,0|1,0,2]=4 1032 B8R0.1 CCCCC(=O)\C=C\O Amb26515841 [0,1,0,0,0,0|0,0,3]=4 1033 B8R0.1 CCCCC(Br)CCC Amb13951105 [0,1,0,0,0,0|1,0,1]=3 1034 B8R0.1 CCCCC(C)CC#N Amb24703016 [0,1,0,0,0,0|1,0,1]=3 1035 B8R0.1 CCCCC(C)CC=O Amb18642676 [0,1,0,0,0,0|0,0,0]=1 1036 B8R0.1 CCCCC(C)CCBr Amb25809503 [0,1,0,0,0,0|1,0,1]=3 1037 B8R0.1 CCCCC(C)CCC Amb22229830 [0,1,0,0,0,0|1,0,1]=3 1038 B8R0.1 CCCCC(C)CCN Amb27817638 [0,1,0,0,0,0|1,0,1]=3 1039 B8R0.1 CCCCC(C)CCO Amb22229364 [0,1,0,0,0,0|0,0,2]=3 1040 B8R0.1 CCCCC(C)CON Amb33428412 [0,1,0,0,0,0|2,0,0]=3 1041 B8R0.1 CCCCC(C)N=C=O Amb24524293 [0,1,0,0,0,0|1,0,1]=3 1042 B8R0.1 CCCCC(C)N=C=S Amb2688718 [0,1,0,0,0,0|1,1,1]=4 1043 B8R0.1 CCCCC(C)N=[N+]=[N-] Amb27816141 [0,1,0,0,0,0|3,0,0]=4 1044 B8R0.1 CCCCC(C)NC#N Amb27837444 [0,1,0,0,0,0|2,0,1]=4 1045 B8R0.1 CCCCC(Cl)CCC Amb22229751 [0,1,0,0,0,0|1,0,1]=3 1046 B8R0.1 CCCCC(Cl)CCO Amb27791848 [0,1,0,0,0,0|0,0,2]=3 1047 B8R0.1 CCCCC(F)CCN Amb28383115 [0,1,0,0,0,0|1,0,1]=3 1048 B8R0.1 CCCCC(F)CCO Amb27664743 [0,1,0,0,0,0|0,0,2]=3 1049 B8R0.1 CCCCC(I)CCC Amb25314282 [0,1,0,0,0,0|1,0,1]=3 1050 B8R0.1 CCCCC(N)CCC Amb9031790 [0,1,0,0,0,0|1,0,1]=3 1051 B8R0.1 CCCCC(N)CCO Amb18642854 [0,1,0,0,0,0|0,0,2]=3 1052 B8R0.1 CCCCC(N)CCO Amb24117271 [0,1,0,0,0,0|0,0,2]=3 1053 B8R0.1 CCCCC(N)COC Amb19374470 [0,1,0,0,0,0|2,0,0]=3 1054 B8R0.1 CCCCC(O)CC#N Amb18642535 [0,1,0,0,0,0|1,0,1]=3 1055 B8R0.1 CCCCC(O)CCN Amb25784846 [0,1,0,0,0,0|1,0,1]=3 1056 B8R0.1 CCCCC(O)CNC Amb24351205 [0,1,0,0,0,0|2,0,0]=3 1057 B8R0.1 CCCCN(C)CC=O Amb27651977 [0,1,0,0,0,0|1,0,0]=2 1058 B8R0.1 CCCCN(C)CCF Amb28049439 [0,1,0,0,0,0|2,0,1]=4 1059 B8R0.1 CCCCN(C)CCN Amb5357834 [0,1,0,0,0,0|2,0,1]=4 1060 B8R0.1 CCCCN(C)CCO Amb3204758 [0,1,0,0,0,0|1,0,2]=4 1061 B8R0.1 CCCCN(N)CCO Amb28398931 [0,1,0,0,0,0|1,0,2]=4 1062 B8R0.1 CCCCS(=O)CCO Amb6752517 [0,1,0,0,0,0|1,0,2]=4 1063 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,1,0,0,0,0|0,0,2]=3 1064 B8R0.1 CCCC[C@@H](C)N=C=O Amb22042694 [0,1,0,0,0,0|1,0,1]=3 1065 B8R0.1 CCCC[C@@H](C)N=C=S Amb10807390 [0,1,0,0,0,0|1,1,1]=4 1066 B8R0.1 CCCC[C@@H](Cl)CCC Amb27185673 [0,1,0,0,0,0|1,0,1]=3 1067 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,1,0,0,0,0|0,0,2]=3 1068 B8R0.1 CCCC[C@@H](O)CCBr Amb28320766 [0,1,0,0,0,0|1,0,1]=3 1069 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,1,0,0,0,0|1,0,1]=3 1070 B8R0.1 CCCC[C@H](C)N=C=O Amb22042695 [0,1,0,0,0,0|1,0,1]=3 1071 B8R0.1 CCCC[C@H](C)N=C=S Amb22045294 [0,1,0,0,0,0|1,1,1]=4 1072 B8R0.1 CCCC[C@H](F)CCO Amb28049226 [0,1,0,0,0,0|0,0,2]=3 1073 B8R0.1 CCCC[C@H](N)CCO Amb27947953 [0,1,0,0,0,0|0,0,2]=3 1074 B8R0.1 CCCC[C@H](N)CNC Amb27853746 [0,1,0,0,0,0|2,0,0]=3 1075 B8R0.1 CCCC[C@H](O)CC#N Amb27208114 [0,1,0,0,0,0|1,0,1]=3 1076 B8R0.1 CCCC[C@H](O)CCBr Amb27483780 [0,1,0,0,0,0|1,0,1]=3 1077 B8R0.1 CCCC[C@H](O)CCN Amb26996017 [0,1,0,0,0,0|1,0,1]=3 1078 B8R0.1 CCCC\C(O)=C\C=O Amb27257932 [0,1,0,0,0,0|0,0,2]=3 1079 B8R0.1 CCCN(C)CCC#N Amb6670214 [0,1,0,0,0,0|2,0,1]=4 1080 B8R0.1 CCCN(C)CCCI Amb28318380 [0,1,0,0,0,0|2,0,1]=4 1081 B8R0.1 CCCN(C)CCCN Amb6670577 [0,1,0,0,0,0|2,0,1]=4 1082 B8R0.1 CCCN(C)CCON Amb27421002 [0,1,0,0,0,0|3,0,0]=4 1083 B8R0.1 CCCNC(C)CC#N Amb17334087 [0,1,0,0,0,0|2,0,1]=4 1084 B8R0.1 CCCNC(C)CCCl Amb28285307 [0,1,0,0,0,0|2,0,1]=4 1085 B8R0.1 CCCOC(C)CNC Amb28397738 [0,1,0,0,0,0|3,0,0]=4 1086 B8R0.1 CCCS(=O)CCC#N Amb27254579 [0,1,0,0,0,0|2,0,1]=4 1087 B8R0.1 CCCS(=O)CCCBr Amb27398529 [0,1,0,0,0,0|2,0,1]=4 1088 B8R0.1 CCCS(=O)CCON Amb27620820 [0,1,0,0,0,0|3,0,0]=4 1089 B8R0.1 CCCSC(C)COC Amb27837602 [0,1,0,0,0,0|3,0,0]=4 1090 B8R0.1 CCC[C@@H](C)CCCBr Amb27607669 [0,1,0,0,0,0|1,0,1]=3 1091 B8R0.1 CCC[C@@H](C)CCCN Amb27488815 [0,1,0,0,0,0|1,0,1]=3 1092 B8R0.1 CCC[C@@H](C)CCCO Amb28292905 [0,1,0,0,0,0|0,0,2]=3 1093 B8R0.1 CCC[C@@H](O)CCOC Amb27660393 [0,1,0,0,0,0|2,0,0]=3 1094 B8R0.1 CCC[C@H](C)CCCO Amb28065801 [0,1,0,0,0,0|0,0,2]=3 1095 B8R0.1 CCC[C@H](C)\C=C\C=O Amb27949653 [0,1,0,0,0,0|0,0,2]=3 1096 B8R0.1 CCC[C@H](N)CNCC Amb26957468 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.1 CCC[C@H](N)CSCC Amb28369366 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.1 CCC[C@H](O)CCCO Amb28049112 [0,1,0,0,0,0|0,0,2]=3 1099 B8R0.1 CCC\C(C)=C\NC=O Amb27626018 [0,1,0,0,0,0|1,0,2]=4 1100 B8R0.1 CCC\C(C)=N\NC=O Amb27604688 [0,1,0,0,0,0|2,0,1]=4 1101 B8R0.1 CCNC(=O)CCC=O Amb27665109 [0,1,0,0,0,0|1,0,1]=3 1102 B8R0.1 CCNC(C)CCOC Amb28049044 [0,1,0,0,0,0|3,0,0]=4 1103 B8R0.1 CCNC(C)CCSC Amb27780718 [0,1,0,0,0,0|3,0,0]=4 1104 B8R0.1 CCNCC(C)CCCl Amb27950091 [0,1,0,0,0,0|2,0,1]=4 1105 B8R0.1 CCNCC(N)COC Amb28056795 [0,1,0,0,0,0|3,0,0]=4 1106 B8R0.1 CCNCC(O)COC Amb9215222 [0,1,0,0,0,0|3,0,0]=4 1107 B8R0.1 CCOC(=O)CCC=O Amb17593369 [0,1,0,0,0,0|1,0,1]=3 1108 B8R0.1 CCOC(=O)CNC=O Amb16232466 [0,1,0,0,0,0|2,0,1]=4 1109 B8R0.1 CCOC(=S)SCC=O Amb27827809 [0,1,0,0,0,0|2,0,1]=4 1110 B8R0.1 CCOC(C)CCC#N Amb33372233 [0,1,0,0,0,0|2,0,1]=4 1111 B8R0.1 CCOC(C)CCC=O Amb33424979 [0,1,0,0,0,0|1,0,0]=2 1112 B8R0.1 CCOC(C)CCCBr Amb33006294 [0,1,0,0,0,0|2,0,1]=4 1113 B8R0.1 CCOC(C)CCCN Amb28049325 [0,1,0,0,0,0|2,0,1]=4 1114 B8R0.1 CCOC(C)CCCO Amb26454825 [0,1,0,0,0,0|1,0,2]=4 1115 B8R0.1 CCOC(C)CCCS Amb33424965 [0,1,0,0,0,0|1,1,1]=4 1116 B8R0.1 CCOC(C)CCNC Amb33425715 [0,1,0,0,0,0|3,0,0]=4 1117 B8R0.1 CCOC(C)CCON Amb33425325 [0,1,0,0,0,0|3,0,0]=4 1118 B8R0.1 CCOC(C)CN=C=O Amb25941274 [0,1,0,0,0,0|2,0,1]=4 1119 B8R0.1 CCOC(C)CNC=O Amb27637475 [0,1,0,0,0,0|2,0,0]=3 1120 B8R0.1 CCOC(C)OCC=O Amb28046272 [0,1,0,0,0,0|2,0,0]=3 1121 B8R0.1 CCOC(C)\C=C\C=O Amb33358531 [0,1,0,0,0,0|1,0,2]=4 1122 B8R0.1 CCOCC(C)CCBr Amb27632410 [0,1,0,0,0,0|2,0,1]=4 1123 B8R0.1 CCOCC(C)CCO Amb27662371 [0,1,0,0,0,0|1,0,2]=4 1124 B8R0.1 CCOCC(C)CNC Amb27636351 [0,1,0,0,0,0|3,0,0]=4 1125 B8R0.1 CCOCC(C)N=C=O Amb24683412 [0,1,0,0,0,0|2,0,1]=4 1126 B8R0.1 CCOCC(Cl)CCO Amb27983791 [0,1,0,0,0,0|1,0,2]=4 1127 B8R0.1 CCOCC(N)CCO Amb27955043 [0,1,0,0,0,0|1,0,2]=4 1128 B8R0.1 CCOCC(N)CSC Amb27411735 [0,1,0,0,0,0|3,0,0]=4 1129 B8R0.1 CCOCC(O)CC#N Amb27651999 [0,1,0,0,0,0|2,0,1]=4 1130 B8R0.1 CCOCC(O)CCN Amb26342443 [0,1,0,0,0,0|2,0,1]=4 1131 B8R0.1 CCOCC(O)CNN Amb28364245 [0,1,0,0,0,0|3,0,0]=4 1132 B8R0.1 CCOC[C@@H](O)CCN Amb32660151 [0,1,0,0,0,0|2,0,1]=4 1133 B8R0.1 CCOC[C@H](O)CCN Amb32660157 [0,1,0,0,0,0|2,0,1]=4 1134 B8R0.1 CCSC(=O)CNC=O Amb27873219 [0,1,0,0,0,0|2,0,1]=4 1135 B8R0.1 CCSCC(C)CCN Amb33324044 [0,1,0,0,0,0|2,0,1]=4 1136 B8R0.1 CCSCC(C)CON Amb33223927 [0,1,0,0,0,0|3,0,0]=4 1137 B8R0.1 CCSCC(C)N=C=O Amb24532873 [0,1,0,0,0,0|2,0,1]=4 1138 B8R0.1 CCSCC(Cl)CC#N Amb27985874 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.1 CCSCC(F)CCN Amb33323743 [0,1,0,0,0,0|2,0,1]=4 1140 B8R0.1 CCSCC(N)CCO Amb25336776 [0,1,0,0,0,0|1,0,2]=4 1141 B8R0.1 CCSCC(N)COC Amb28363572 [0,1,0,0,0,0|3,0,0]=4 1142 B8R0.1 CCSCC(O)CC#N Amb26958063 [0,1,0,0,0,0|2,0,1]=4 1143 B8R0.1 CCSCC(O)CCN Amb26613825 [0,1,0,0,0,0|2,0,1]=4 1144 B8R0.1 CCSCC(O)CNC Amb6680866 [0,1,0,0,0,0|3,0,0]=4 1145 B8R0.1 CCSC[C@@H](O)CCN Amb33321297 [0,1,0,0,0,0|2,0,1]=4 1146 B8R0.1 CCSC[C@H](O)CCN Amb33321513 [0,1,0,0,0,0|2,0,1]=4 1147 B8R0.1 CC\C=C\C(C)CC=O Amb27838607 [0,1,0,0,0,0|0,0,2]=3 1148 B8R0.1 CN(CC=O)CCCO Amb27404144 [0,1,0,0,0,0|2,0,0]=3 1149 B8R0.1 CN(CCO)CCC=O Amb27837419 [0,1,0,0,0,0|2,0,0]=3 1150 B8R0.1 CNCC(N)CCOC Amb28249308 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.1 CNCC(O)CCOC Amb25856658 [0,1,0,0,0,0|3,0,0]=4 1152 B8R0.1 CNCC(O)CCSC Amb27229884 [0,1,0,0,0,0|3,0,0]=4 1153 B8R0.1 CNCCC(C)CCBr Amb27867638 [0,1,0,0,0,0|2,0,1]=4 1154 B8R0.1 CNCCC(C)CCO Amb17569925 [0,1,0,0,0,0|1,0,2]=4 1155 B8R0.1 CNCCC(Cl)COC Amb28197772 [0,1,0,0,0,0|3,0,0]=4 1156 B8R0.1 CNCCC(O)COC Amb27180409 [0,1,0,0,0,0|3,0,0]=4 1157 B8R0.1 CNC[C@H](N)CCSC Amb27768459 [0,1,0,0,0,0|3,0,0]=4 1158 B8R0.1 COCC(=O)CCC=O Amb28343164 [0,1,0,0,0,0|1,0,1]=3 1159 B8R0.1 COCC(C)CCC=O Amb27783800 [0,1,0,0,0,0|1,0,0]=2 1160 B8R0.1 COCC(N)CCC=O Amb33036305 [0,1,0,0,0,0|1,0,0]=2 1161 B8R0.1 COCC(O)CCCCl Amb27838445 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.1 COCC(O)CCCO Amb27806873 [0,1,0,0,0,0|1,0,2]=4 1163 B8R0.1 COCC(S)CCCN Amb32788185 [0,1,0,0,0,0|2,0,1]=4 1164 B8R0.1 COCCC(C)CCBr Amb28121179 [0,1,0,0,0,0|2,0,1]=4 1165 B8R0.1 COCCC(C)CCCl Amb24524178 [0,1,0,0,0,0|2,0,1]=4 1166 B8R0.1 COCCC(C)CCN Amb17569943 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.1 COCCC(C)CON Amb33377799 [0,1,0,0,0,0|3,0,0]=4 1168 B8R0.1 COCCC(C)N=C=O Amb28120815 [0,1,0,0,0,0|2,0,1]=4 1169 B8R0.1 COCCC(F)CCN Amb33376830 [0,1,0,0,0,0|2,0,1]=4 1170 B8R0.1 COCCC(N)CCO Amb32946713 [0,1,0,0,0,0|1,0,2]=4 1171 B8R0.1 COCCC(N)COC Amb25101769 [0,1,0,0,0,0|3,0,0]=4 1172 B8R0.1 COCCC(O)CC#N Amb33224024 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.1 COCCC(O)CCN Amb27210699 [0,1,0,0,0,0|2,0,1]=4 1174 B8R0.1 COCCC(O)CCO Amb28189604 [0,1,0,0,0,0|1,0,2]=4 1175 B8R0.1 COCC[C@@H](O)CCN Amb33377802 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.1 COCC[C@H](O)CCN Amb33377803 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.1 COCOC(C)CC=O Amb28247070 [0,1,0,0,0,0|2,0,0]=3 1178 B8R0.1 COC[C@H](C)OCC=O Amb27222608 [0,1,0,0,0,0|2,0,0]=3 1179 B8R0.1 CONC(=O)CCC=O Amb27837664 [0,1,0,0,0,0|2,0,1]=4 1180 B8R0.1 CSCC(C)CN=C=O Amb28364808 [0,1,0,0,0,0|2,0,1]=4 1181 B8R0.1 CSCCC(C)CCN Amb28048195 [0,1,0,0,0,0|2,0,1]=4 1182 B8R0.1 CSCCC(C)CCS Amb27838577 [0,1,0,0,0,0|1,1,1]=4 1183 B8R0.1 CSCCC(C)CON Amb33198298 [0,1,0,0,0,0|3,0,0]=4 1184 B8R0.1 CSCCC(C)N=C=O Amb26074987 [0,1,0,0,0,0|2,0,1]=4 1185 B8R0.1 CSCCC(C)NC=O Amb27591673 [0,1,0,0,0,0|2,0,0]=3 1186 B8R0.1 CSCCC(F)CCN Amb33198730 [0,1,0,0,0,0|2,0,1]=4 1187 B8R0.1 CSCCC(N)CCO Amb27455675 [0,1,0,0,0,0|1,0,2]=4 1188 B8R0.1 CSCCC(N)NC=O Amb27875790 [0,1,0,0,0,0|2,0,0]=3 1189 B8R0.1 CSCCC(O)CC#N Amb25132556 [0,1,0,0,0,0|2,0,1]=4 1190 B8R0.1 CSCCC(O)CCN Amb25899755 [0,1,0,0,0,0|2,0,1]=4 1191 B8R0.1 CSCC[C@@H](N)CCO Amb27950118 [0,1,0,0,0,0|1,0,2]=4 1192 B8R0.1 CSCC[C@@H](O)CCN Amb33198731 [0,1,0,0,0,0|2,0,1]=4 1193 B8R0.1 CSCC[C@H](N)CCO Amb27236737 [0,1,0,0,0,0|1,0,2]=4 1194 B8R0.1 CSCC[C@H](O)CCN Amb33198732 [0,1,0,0,0,0|2,0,1]=4 1195 B8R0.1 CSCO[C@@H](C)CC=O Amb28387873 [0,1,0,0,0,0|2,0,0]=3 1196 B8R0.1 CSCO[C@H](C)CC=O Amb27268451 [0,1,0,0,0,0|2,0,0]=3 1197 B8R0.1 C[C@H](CC=O)CCC=O Amb28461250 [0,1,0,0,0,0|1,0,1]=3 1198 B8R0.1 C[C@H](CCBr)CCC=O Amb27454833 [0,1,0,0,0,0|1,0,0]=2 1199 B8R0.1 C\C(=C/CCl)CCC=O Amb27622941 [0,1,0,0,0,0|1,0,2]=4 1200 B8R0.1 C\C(=C/CO)CCC=O Amb27827380 [0,1,0,0,0,0|1,0,2]=4 1201 B8R0.1 C\C(=C\CCl)CCC=O Amb27865820 [0,1,0,0,0,0|1,0,2]=4 1202 B8R0.1 C\C=C\C(=O)CCC=O Amb24610089 [0,1,0,0,0,0|0,0,3]=4 1203 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [0,1,0,0,0,0|1,0,2]=4 1204 B8R0.1 C\C=C\C(C)CCC=O Amb26951561 [0,1,0,0,0,0|0,0,2]=3 1205 B8R0.1 C\C=C\C(O)CCCC Amb4605888 [0,1,0,0,0,0|1,0,1]=3 1206 B8R0.1 C\C=C\C(O)CCNC Amb25947011 [0,1,0,0,0,0|2,0,1]=4 1207 B8R0.1 C\C=C\CC(=O)CCC Amb26475319 [0,1,0,0,0,0|1,0,2]=4 1208 B8R0.1 C\C=C\C[C@H](O)CCC Amb27424856 [0,1,0,0,0,0|1,0,1]=3 1209 B8R0.1 C\C=C\[C@@H](C)CCC=O Amb28382111 [0,1,0,0,0,0|0,0,2]=3 1210 B8R0.1 NCCC(Cl)CCNO Amb27431500 [0,1,0,0,0,0|2,0,1]=4 1211 B8R0.1 NCCCC(N)CCN Amb25145974 [0,1,0,0,0,0|2,0,1]=4 1212 B8R0.1 NCCCC(N)CCO Amb28285147 [0,1,0,0,0,0|1,0,2]=4 1213 B8R0.1 OCCCC(Cl)CCCl Amb27409130 [0,1,0,0,0,0|1,0,2]=4 1214 B8R0.1 OCCCC(O)CCO Amb28366883 [0,1,0,0,0,0|1,0,2]=4 1215 B8R0.1 [C-]#[N+]CCC(C)CCC Amb33322329 [0,1,0,0,0,0|2,0,0]=3 1216 B8R0.1 [C-]#[N+]CCC(C)OCC Amb33425392 [0,1,0,0,0,0|3,0,0]=4 1217 B8R0.4 BrCCCCCCCBr Amb10069015 [0,1,0,0,0,0|1,0,1]=3 1218 B8R0.4 BrCCCOCCCBr Amb27206373 [0,1,0,0,0,0|2,0,1]=4 1219 B8R0.4 Br[Mg]CCCCC[Mg]Br Amb22338459 [0,1,0,0,0,0|3,0,0]=4 1220 B8R0.4 C#CCCCCCC#N Amb27421094 [0,1,0,0,0,0|1,0,2]=4 1221 B8R0.4 C#CCCCCCC=C Amb26535887 [0,1,0,0,0,0|1,0,1]=3 1222 B8R0.4 C#CCCCCCC=O Amb25779363 [0,1,0,0,0,0|0,0,1]=2 1223 B8R0.4 C#CCCCCCCBr Amb28119815 [0,1,0,0,0,0|1,0,1]=3 1224 B8R0.4 C#CCCCCCCC Amb3940501 [0,1,0,0,0,0|1,0,1]=3 1225 B8R0.4 C#CCCCCCCCl Amb24671901 [0,1,0,0,0,0|1,0,1]=3 1226 B8R0.4 C#CCCCCCCF Amb25702933 [0,1,0,0,0,0|1,0,1]=3 1227 B8R0.4 C#CCCCCCCO Amb16231466 [0,1,0,0,0,0|1,0,1]=3 1228 B8R0.4 C#CCCCCN=C=O Amb28140768 [0,1,0,0,0,0|0,0,3]=4 1229 B8R0.4 C#CCCCC\C=C/C Amb28291350 [0,1,0,0,0,0|1,0,2]=4 1230 B8R0.4 C#CCCCC\C=C\C Amb28077120 [0,1,0,0,0,0|1,0,2]=4 1231 B8R0.4 C#CCCCNOCC Amb27466905 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.4 C#CCCCOCCN Amb28061797 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.4 C#CCCCSCCN Amb27970230 [0,1,0,0,0,0|2,0,1]=4 1234 B8R0.4 C#CCCCSCCO Amb27242865 [0,1,0,0,0,0|2,0,1]=4 1235 B8R0.4 C#CCCNCCCN Amb27837512 [0,1,0,0,0,0|2,0,1]=4 1236 B8R0.4 C#CCCNCCCO Amb27837526 [0,1,0,0,0,0|2,0,1]=4 1237 B8R0.4 C#CCCNCCOC Amb27404296 [0,1,0,0,0,0|2,0,1]=4 1238 B8R0.4 C#CCCOCCCN Amb27463863 [0,1,0,0,0,0|2,0,1]=4 1239 B8R0.4 C#CCCOCCOC Amb33169102 [0,1,0,0,0,0|2,0,1]=4 1240 B8R0.4 C#CCCSCCC=C Amb28291662 [0,1,0,0,0,0|1,0,2]=4 1241 B8R0.4 C#CCCSCCCN Amb28422179 [0,1,0,0,0,0|2,0,1]=4 1242 B8R0.4 C#CCCSCCOC Amb27979692 [0,1,0,0,0,0|2,0,1]=4 1243 B8R0.4 C#CCC\C=C\CCC Amb33373746 [0,1,0,0,0,0|1,0,2]=4 1244 B8R0.4 C#CCNCCCC=C Amb27403941 [0,1,0,0,0,0|1,0,2]=4 1245 B8R0.4 C#CCNCCCCC Amb5262803 [0,1,0,0,0,0|1,0,1]=3 1246 B8R0.4 C#CCNCCCCN Amb27399534 [0,1,0,0,0,0|2,0,1]=4 1247 B8R0.4 C#CCNCCCOC Amb17308607 [0,1,0,0,0,0|2,0,1]=4 1248 B8R0.4 C#CCOCCCCN Amb27167146 [0,1,0,0,0,0|2,0,1]=4 1249 B8R0.4 C#CCOCCCCO Amb28292910 [0,1,0,0,0,0|2,0,1]=4 1250 B8R0.4 C#CCOCCNCC Amb27797913 [0,1,0,0,0,0|2,0,1]=4 1251 B8R0.4 C#CCSCCCCF Amb27487103 [0,1,0,0,0,0|2,0,1]=4 1252 B8R0.4 C#CCSCCCCN Amb17500974 [0,1,0,0,0,0|2,0,1]=4 1253 B8R0.4 C#C\C=C\CCNCC Amb27174739 [0,1,0,0,0,0|2,0,1]=4 1254 B8R0.4 C#C\C=C\NCCCC Amb27247245 [0,1,0,0,0,0|2,0,1]=4 1255 B8R0.4 C=C=CCCCCCN Amb28313150 [0,1,0,0,0,0|2,0,0]=3 1256 B8R0.4 C=C=CCCNCCC Amb27945550 [0,1,0,0,0,0|2,0,0]=3 1257 B8R0.4 C=C=CCNCCCC Amb28043104 [0,1,0,0,0,0|2,0,0]=3 1258 B8R0.4 C=CCC#CCCCC Amb22228000 [0,1,0,0,0,0|1,0,1]=3 1259 B8R0.4 C=CCCC#CCCO Amb27826982 [0,1,0,0,0,0|1,0,2]=4 1260 B8R0.4 C=CCCCC#CCN Amb28247946 [0,1,0,0,0,0|1,0,2]=4 1261 B8R0.4 C=CCCCC#CCO Amb27835887 [0,1,0,0,0,0|1,0,2]=4 1262 B8R0.4 C=CCCCCCC=O Amb26017982 [0,1,0,0,0,0|0,0,1]=2 1263 B8R0.4 C=CCCCCCCBr Amb3940223 [0,1,0,0,0,0|1,0,0]=2 1264 B8R0.4 C=CCCCCCCC Amb3940502 [0,1,0,0,0,0|1,0,0]=2 1265 B8R0.4 C=CCCCCCCCl Amb6298879 [0,1,0,0,0,0|1,0,0]=2 1266 B8R0.4 C=CCCCCCCI Amb26577493 [0,1,0,0,0,0|1,0,0]=2 1267 B8R0.4 C=CCCCCCCN Amb33543931 [0,1,0,0,0,0|1,0,0]=2 1268 B8R0.4 C=CCCCCCCO Amb22230162 [0,1,0,0,0,0|1,0,0]=2 1269 B8R0.4 C=CCCCCCNC Amb19335339 [0,1,0,0,0,0|1,0,0]=2 1270 B8R0.4 C=CCCCCCSC Amb27780646 [0,1,0,0,0,0|1,0,0]=2 1271 B8R0.4 C=CCCCCN=C=S Amb27600576 [0,1,0,0,0,0|2,0,1]=4 1272 B8R0.4 C=CCCCCNCC Amb27461423 [0,1,0,0,0,0|1,0,0]=2 1273 B8R0.4 C=CCCCNCC=C Amb28322916 [0,1,0,0,0,0|1,0,2]=4 1274 B8R0.4 C=CCCCOCCN Amb25760642 [0,1,0,0,0,0|2,0,0]=3 1275 B8R0.4 C=CCCCOCCN Amb33189185 [0,1,0,0,0,0|2,0,0]=3 1276 B8R0.4 C=CCCCOCCS Amb27833751 [0,1,0,0,0,0|2,0,0]=3 1277 B8R0.4 C=CCCCSCCO Amb28352314 [0,1,0,0,0,0|2,0,0]=3 1278 B8R0.4 C=CCCC\C=C\CBr Amb27477769 [0,1,0,0,0,0|1,0,2]=4 1279 B8R0.4 C=CCCC\C=C\CO Amb19930201 [0,1,0,0,0,0|1,0,2]=4 1280 B8R0.4 C=CCCNCCC=C Amb26442611 [0,1,0,0,0,0|1,0,2]=4 1281 B8R0.4 C=CCCNCCCF Amb27221526 [0,1,0,0,0,0|2,0,0]=3 1282 B8R0.4 C=CCCNCCCN Amb28129396 [0,1,0,0,0,0|2,0,0]=3 1283 B8R0.4 C=CCCNCCOC Amb22504625 [0,1,0,0,0,0|2,0,0]=3 1284 B8R0.4 C=CCCNC\C=C\C Amb26455080 [0,1,0,0,0,0|1,0,2]=4 1285 B8R0.4 C=CCCOCCC=O Amb28341311 [0,1,0,0,0,0|0,0,2]=3 1286 B8R0.4 C=CCCOCCCCl Amb9208734 [0,1,0,0,0,0|2,0,0]=3 1287 B8R0.4 C=CCCOCCCS Amb28206821 [0,1,0,0,0,0|2,0,0]=3 1288 B8R0.4 C=CCCSCCC=O Amb27424727 [0,1,0,0,0,0|0,0,2]=3 1289 B8R0.4 C=CCCSCCCC Amb28078650 [0,1,0,0,0,0|1,0,0]=2 1290 B8R0.4 C=CCC\C=C\CCCl Amb27967746 [0,1,0,0,0,0|1,0,2]=4 1291 B8R0.4 C=CCNCCCCC Amb6706493 [0,1,0,0,0,0|1,0,0]=2 1292 B8R0.4 C=CCNCCCCCl Amb27815966 [0,1,0,0,0,0|2,0,0]=3 1293 B8R0.4 C=CCNCCCCF Amb27798055 [0,1,0,0,0,0|2,0,0]=3 1294 B8R0.4 C=CCNCCCCI Amb27596400 [0,1,0,0,0,0|2,0,0]=3 1295 B8R0.4 C=CCNCCNCC Amb27185783 [0,1,0,0,0,0|2,0,0]=3 1296 B8R0.4 C=CCNCCSSC Amb27784384 [0,1,0,0,0,0|3,0,0]=4 1297 B8R0.4 C=CCNC\C=C\CC Amb27432892 [0,1,0,0,0,0|1,0,2]=4 1298 B8R0.4 C=CCN\N=C\CCC Amb28293809 [0,1,0,0,0,0|2,0,1]=4 1299 B8R0.4 C=CCOCCCC#N Amb9208774 [0,1,0,0,0,0|2,0,1]=4 1300 B8R0.4 C=CCOCCCC=O Amb26885457 [0,1,0,0,0,0|0,0,2]=3 1301 B8R0.4 C=CCOCCCCCl Amb28072994 [0,1,0,0,0,0|2,0,0]=3 1302 B8R0.4 C=CCOCCCCN Amb28345525 [0,1,0,0,0,0|2,0,0]=3 1303 B8R0.4 C=CCOCCCCO Amb26022466 [0,1,0,0,0,0|2,0,0]=3 1304 B8R0.4 C=CCOCCCCS Amb28068525 [0,1,0,0,0,0|2,0,0]=3 1305 B8R0.4 C=CCOCCCNC Amb27948343 [0,1,0,0,0,0|2,0,0]=3 1306 B8R0.4 C=CCOCCCSC Amb27868832 [0,1,0,0,0,0|2,0,0]=3 1307 B8R0.4 C=CCOCOCCO Amb28049259 [0,1,0,0,0,0|3,0,0]=4 1308 B8R0.4 C=CCONCCCC Amb27244013 [0,1,0,0,0,0|2,0,0]=3 1309 B8R0.4 C=CCONCCOC Amb27433219 [0,1,0,0,0,0|3,0,0]=4 1310 B8R0.4 C=CCSCCCCBr Amb27465812 [0,1,0,0,0,0|2,0,0]=3 1311 B8R0.4 C=CCSCCCCC Amb27837635 [0,1,0,0,0,0|1,0,0]=2 1312 B8R0.4 C=CCSCCCCCl Amb27795958 [0,1,0,0,0,0|2,0,0]=3 1313 B8R0.4 C=CCSCCCCF Amb28184818 [0,1,0,0,0,0|2,0,0]=3 1314 B8R0.4 C=CCSCCCCN Amb17500942 [0,1,0,0,0,0|2,0,0]=3 1315 B8R0.4 C=CCSCCCNC Amb27975525 [0,1,0,0,0,0|2,0,0]=3 1316 B8R0.4 C=CCSCCCSC Amb27628484 [0,1,0,0,0,0|2,0,0]=3 1317 B8R0.4 C=CCSCCNC=O Amb27395542 [0,1,0,0,0,0|1,0,2]=4 1318 B8R0.4 C=CC\C=C\CCNC Amb27813996 [0,1,0,0,0,0|1,0,2]=4 1319 B8R0.4 C=CNCCCCCC Amb27398596 [0,1,0,0,0,0|1,0,0]=2 1320 B8R0.4 C=COCCCCCC Amb24440550 [0,1,0,0,0,0|1,0,0]=2 1321 B8R0.4 C=COCCCNC=O Amb27461474 [0,1,0,0,0,0|1,0,2]=4 1322 B8R0.4 C=COCCCNCC Amb6735761 [0,1,0,0,0,0|2,0,0]=3 1323 B8R0.4 C=COCCOCCN Amb27248278 [0,1,0,0,0,0|3,0,0]=4 1324 B8R0.4 C=COCCOCCO Amb22230541 [0,1,0,0,0,0|3,0,0]=4 1325 B8R0.4 C=C\C=C\CCCCBr Amb32688174 [0,1,0,0,0,0|1,0,2]=4 1326 B8R0.4 C=C\C=C\CCCCC Amb22641683 [0,1,0,0,0,0|1,0,1]=3 1327 B8R0.4 C=C\C=C\CCCCCl Amb32688173 [0,1,0,0,0,0|1,0,2]=4 1328 B8R0.4 C=C\C=C\CCNCC Amb27873157 [0,1,0,0,0,0|1,0,2]=4 1329 B8R0.4 C=C\C=C\CNCCC Amb26967633 [0,1,0,0,0,0|1,0,2]=4 1330 B8R0.4 CC#CC#CCCC=O Amb27482763 [0,1,0,0,0,0|0,0,3]=4 1331 B8R0.4 CC#CCCCCC=O Amb27827379 [0,1,0,0,0,0|0,0,1]=2 1332 B8R0.4 CC#CCCCCCC Amb9134715 [0,1,0,0,0,0|1,0,1]=3 1333 B8R0.4 CC#CCCCCCO Amb27243915 [0,1,0,0,0,0|0,0,3]=4 1334 B8R0.4 CC#CCCCCNC Amb27442428 [0,1,0,0,0,0|1,0,2]=4 1335 B8R0.4 CC#CCCSCCC Amb27489037 [0,1,0,0,0,0|1,0,2]=4 1336 B8R0.4 CC#CCSCCCC Amb27206321 [0,1,0,0,0,0|1,0,2]=4 1337 B8R0.4 CCC#CCCCC#N Amb25727195 [0,1,0,0,0,0|1,0,2]=4 1338 B8R0.4 CCC#CCCCCC Amb9134716 [0,1,0,0,0,0|1,0,2]=4 1339 B8R0.4 CCC#CCCCCN Amb28049876 [0,1,0,0,0,0|1,0,2]=4 1340 B8R0.4 CCC#CCCCCO Amb26362942 [0,1,0,0,0,0|0,0,3]=4 1341 B8R0.4 CCC#CCC\C=C\O Amb28049153 [0,1,0,0,0,0|0,0,3]=4 1342 B8R0.4 CCCC#CCCCC Amb9134717 [0,1,0,0,0,0|1,0,2]=4 1343 B8R0.4 CCCC#C\C=C\C=O Amb25108334 [0,1,0,0,0,0|0,0,3]=4 1344 B8R0.4 CCCCBCCCC Amb27624537 [0,1,0,0,0,0|1,0,1]=3 1345 B8R0.4 CCCCC#CCC#N Amb17593239 [0,1,0,0,0,0|1,0,2]=4 1346 B8R0.4 CCCCC#CCCCl Amb28050989 [0,1,0,0,0,0|1,0,2]=4 1347 B8R0.4 CCCCC#CCCO Amb2721716 [0,1,0,0,0,0|0,0,3]=4 1348 B8R0.4 CCCCC#C\C=C/Cl Amb27849416 [0,1,0,0,0,0|1,0,2]=4 1349 B8R0.4 CCCCC#C\C=C\Cl Amb27803057 [0,1,0,0,0,0|1,0,2]=4 1350 B8R0.4 CCCCCC#CC#N Amb27768017 [0,1,0,0,0,0|1,0,2]=4 1351 B8R0.4 CCCCCC#CC=O Amb9825881 [0,1,0,0,0,0|0,0,1]=2 1352 B8R0.4 CCCCCC#CCBr Amb2685374 [0,1,0,0,0,0|1,0,2]=4 1353 B8R0.4 CCCCCCCC#N Amb7764637 [0,1,0,0,0,0|1,0,1]=3 1354 B8R0.4 CCCCCCCC=O Amb6891949 [0,1,0,0,0,0|0,0,0]=1 1355 B8R0.4 CCCCCCCCBr Amb2689971 [0,1,0,0,0,0|1,0,1]=3 1356 B8R0.4 CCCCCCCCC Amb8513269 [0,1,0,0,0,0|1,0,1]=3 1357 B8R0.4 CCCCCCCCCl Amb7757832 [0,1,0,0,0,0|1,0,1]=3 1358 B8R0.4 CCCCCCCCF Amb10840379 [0,1,0,0,0,0|1,0,1]=3 1359 B8R0.4 CCCCCCCCI Amb637144 [0,1,0,0,0,0|1,0,1]=3 1360 B8R0.4 CCCCCCCCN Amb2720240 [0,1,0,0,0,0|1,0,1]=3 1361 B8R0.4 CCCCCCCCN Amb3940466 [0,1,0,0,0,0|1,0,1]=3 1362 B8R0.4 CCCCCCCCO Amb6608788 [0,1,0,0,0,0|0,0,2]=3 1363 B8R0.4 CCCCCCCCS Amb8513530 [0,1,0,0,0,0|0,1,1]=3 1364 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [0,1,0,0,0,0|1,0,1]=3 1365 B8R0.4 CCCCCCCNC Amb7761453 [0,1,0,0,0,0|1,0,1]=3 1366 B8R0.4 CCCCCCCNN Amb7794376 [0,1,0,0,0,0|1,0,1]=3 1367 B8R0.4 CCCCCCCOC Amb24584912 [0,1,0,0,0,0|0,0,2]=3 1368 B8R0.4 CCCCCCCSC Amb22359861 [0,1,0,0,0,0|0,1,1]=3 1369 B8R0.4 CCCCCCN=C=O Amb8516659 [0,1,0,0,0,0|0,0,1]=2 1370 B8R0.4 CCCCCCN=C=S Amb6572524 [0,1,0,0,0,0|0,1,1]=3 1371 B8R0.4 CCCCCCN=[N+]=[N-] Amb17939436 [0,1,0,0,0,0|2,0,0]=3 1372 B8R0.4 CCCCCCNC=S Amb27880264 [0,1,0,0,0,0|0,1,0]=2 1373 B8R0.4 CCCCCCNCC Amb6730567 [0,1,0,0,0,0|1,0,1]=3 1374 B8R0.4 CCCCCCOCC Amb17672946 [0,1,0,0,0,0|1,0,1]=3 1375 B8R0.4 CCCCCCOCCl Amb27473208 [0,1,0,0,0,0|1,0,1]=3 1376 B8R0.4 CCCCCCON=O Amb17672945 [0,1,0,0,0,0|1,0,0]=2 1377 B8R0.4 CCCCCCSC#N Amb2691625 [0,1,0,0,0,0|1,0,1]=3 1378 B8R0.4 CCCCCC\C=C\Br Amb24677708 [0,1,0,0,0,0|1,0,0]=2 1379 B8R0.4 CCCCCC\C=C\I Amb24446897 [0,1,0,0,0,0|1,0,0]=2 1380 B8R0.4 CCCCCC\C=N\N Amb28049289 [0,1,0,0,0,0|1,0,0]=2 1381 B8R0.4 CCCCCNCCC Amb6688182 [0,1,0,0,0,0|1,0,1]=3 1382 B8R0.4 CCCCCNCCCl Amb17334288 [0,1,0,0,0,0|1,0,1]=3 1383 B8R0.4 CCCCCNCCI Amb27411190 [0,1,0,0,0,0|1,0,1]=3 1384 B8R0.4 CCCCCNCCN Amb17091049 [0,1,0,0,0,0|1,0,1]=3 1385 B8R0.4 CCCCCNCCO Amb3940022 [0,1,0,0,0,0|0,0,2]=3 1386 B8R0.4 CCCCCOCC=O Amb27230502 [0,1,0,0,0,0|0,0,0]=1 1387 B8R0.4 CCCCCOCCCl Amb8902963 [0,1,0,0,0,0|1,0,1]=3 1388 B8R0.4 CCCCCOCCO Amb22264988 [0,1,0,0,0,0|0,0,2]=3 1389 B8R0.4 CCCCCOCCS Amb27752940 [0,1,0,0,0,0|0,1,1]=3 1390 B8R0.4 CCCCCSCCCl Amb25887277 [0,1,0,0,0,0|1,0,1]=3 1391 B8R0.4 CCCCCSCCN Amb6275043 [0,1,0,0,0,0|1,0,1]=3 1392 B8R0.4 CCCCCSCCO Amb1032987 [0,1,0,0,0,0|0,0,2]=3 1393 B8R0.4 CCCCCSCOC Amb27771414 [0,1,0,0,0,0|2,0,0]=3 1394 B8R0.4 CCCCC\C=C\C#N Amb18642132 [0,1,0,0,0,0|1,0,1]=3 1395 B8R0.4 CCCCC\C=C\CBr Amb17666913 [0,1,0,0,0,0|1,0,1]=3 1396 B8R0.4 CCCCC\C=C\CO Amb33038088 [0,1,0,0,0,0|0,0,2]=3 1397 B8R0.4 CCCCC\C=N\OC Amb28204102 [0,1,0,0,0,0|1,0,2]=4 1398 B8R0.4 CCCCNCCC#N Amb2685599 [0,1,0,0,0,0|1,0,1]=3 1399 B8R0.4 CCCCNCCCBr Amb28399869 [0,1,0,0,0,0|1,0,1]=3 1400 B8R0.4 CCCCNCCCC Amb22348285 [0,1,0,0,0,0|1,0,1]=3 1401 B8R0.4 CCCCNCCCC Amb3939027 [0,1,0,0,0,0|1,0,1]=3 1402 B8R0.4 CCCCNCCCC Amb4017913 [0,1,0,0,0,0|1,0,1]=3 1403 B8R0.4 CCCCNCCCCl Amb24529030 [0,1,0,0,0,0|1,0,1]=3 1404 B8R0.4 CCCCNCCCCl Amb33164142 [0,1,0,0,0,0|1,0,1]=3 1405 B8R0.4 CCCCNCCCN Amb17315267 [0,1,0,0,0,0|1,0,1]=3 1406 B8R0.4 CCCCNCCCO Amb4304116 [0,1,0,0,0,0|0,0,2]=3 1407 B8R0.4 CCCCNCCOC Amb6685727 [0,1,0,0,0,0|2,0,0]=3 1408 B8R0.4 CCCCNC\C=C\Br Amb27631443 [0,1,0,0,0,0|1,0,1]=3 1409 B8R0.4 CCCCNC\C=C\Cl Amb27860069 [0,1,0,0,0,0|1,0,1]=3 1410 B8R0.4 CCCCNOCCO Amb27956595 [0,1,0,0,0,0|1,0,2]=4 1411 B8R0.4 CCCCN\N=C\C#N Amb27752721 [0,1,0,0,0,0|3,0,0]=4 1412 B8R0.4 CCCCOC#CC=O Amb27947485 [0,1,0,0,0,0|0,0,2]=3 1413 B8R0.4 CCCCOCCC#N Amb8873730 [0,1,0,0,0,0|1,0,1]=3 1414 B8R0.4 CCCCOCCC=O Amb27880111 [0,1,0,0,0,0|0,0,0]=1 1415 B8R0.4 CCCCOCCCBr Amb8895241 [0,1,0,0,0,0|1,0,1]=3 1416 B8R0.4 CCCCOCCCC Amb8513426 [0,1,0,0,0,0|1,0,1]=3 1417 B8R0.4 CCCCOCCCN Amb3939348 [0,1,0,0,0,0|1,0,1]=3 1418 B8R0.4 CCCCOCCNN Amb27979085 [0,1,0,0,0,0|2,0,0]=3 1419 B8R0.4 CCCCOCCOC Amb33847381 [0,1,0,0,0,0|2,0,0]=3 1420 B8R0.4 CCCCOCN=C=O Amb28077635 [0,1,0,0,0,0|1,0,1]=3 1421 B8R0.4 CCCCOCNC=O Amb27392745 [0,1,0,0,0,0|1,0,0]=2 1422 B8R0.4 CCCCPCCCC Amb22730293 [0,1,0,0,0,0|1,0,1]=3 1423 B8R0.4 CCCCPCCCN Amb27217298 [0,1,0,0,0,0|1,0,1]=3 1424 B8R0.4 CCCCSC=C=CCl Amb27202608 [0,1,0,0,0,0|1,0,2]=4 1425 B8R0.4 CCCCSCCC#N Amb9479932 [0,1,0,0,0,0|1,0,1]=3 1426 B8R0.4 CCCCSCCCF Amb27449027 [0,1,0,0,0,0|1,0,1]=3 1427 B8R0.4 CCCCSCCCN Amb9261123 [0,1,0,0,0,0|1,0,1]=3 1428 B8R0.4 CCCCSCCCS Amb28453845 [0,1,0,0,0,0|0,1,1]=3 1429 B8R0.4 CCCCSCCOC Amb27827301 [0,1,0,0,0,0|2,0,0]=3 1430 B8R0.4 CCCCSCNC=O Amb27656061 [0,1,0,0,0,0|1,0,0]=2 1431 B8R0.4 CCCCS\C=C\CO Amb27219509 [0,1,0,0,0,0|1,0,2]=4 1432 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [0,1,0,0,0,0|1,0,1]=3 1433 B8R0.4 CCCC[NH2+]CCCC Amb8516289 [0,1,0,0,0,0|1,0,1]=3 1434 B8R0.4 CCCC[SnH4+2]CCCC Amb22045422 [0,1,0,0,0,0|1,0,1]=3 1435 B8R0.4 CCCC[SnH4+2]CCCC Amb22045423 [0,1,0,0,0,0|1,0,1]=3 1436 B8R0.4 CCCC\C=C/CCO Amb26586236 [0,1,0,0,0,0|0,0,3]=4 1437 B8R0.4 CCCC\C=C\CCN Amb27788288 [0,1,0,0,0,0|1,0,2]=4 1438 B8R0.4 CCCC\C=C\CCO Amb9134733 [0,1,0,0,0,0|0,0,3]=4 1439 B8R0.4 CCCNCCCCI Amb28072729 [0,1,0,0,0,0|1,0,1]=3 1440 B8R0.4 CCCNCCCCN Amb17334115 [0,1,0,0,0,0|1,0,1]=3 1441 B8R0.4 CCCNCCCCS Amb28349265 [0,1,0,0,0,0|0,1,1]=3 1442 B8R0.4 CCCNCCCOC Amb6730309 [0,1,0,0,0,0|2,0,0]=3 1443 B8R0.4 CCCNCCOCC Amb8841458 [0,1,0,0,0,0|2,0,1]=4 1444 B8R0.4 CCCNCCSCC Amb27837542 [0,1,0,0,0,0|2,0,1]=4 1445 B8R0.4 CCCNCNCCC Amb28250874 [0,1,0,0,0,0|2,0,1]=4 1446 B8R0.4 CCCNCSCCC Amb27784117 [0,1,0,0,0,0|2,0,1]=4 1447 B8R0.4 CCCOCCCC#N Amb8874818 [0,1,0,0,0,0|1,0,1]=3 1448 B8R0.4 CCCOCCCC=O Amb27795367 [0,1,0,0,0,0|0,0,0]=1 1449 B8R0.4 CCCOCCCCBr Amb8874783 [0,1,0,0,0,0|1,0,1]=3 1450 B8R0.4 CCCOCCCCCl Amb18181651 [0,1,0,0,0,0|1,0,1]=3 1451 B8R0.4 CCCOCCCCO Amb27395455 [0,1,0,0,0,0|0,0,2]=3 1452 B8R0.4 CCCOCCCON Amb27420839 [0,1,0,0,0,0|2,0,0]=3 1453 B8R0.4 CCCOCCNCC Amb28146663 [0,1,0,0,0,0|2,0,1]=4 1454 B8R0.4 CCCOCCOCCl Amb28246338 [0,1,0,0,0,0|2,0,1]=4 1455 B8R0.4 CCCOCOCCC Amb22230733 [0,1,0,0,0,0|2,0,1]=4 1456 B8R0.4 CCCOC\C=C\CCl Amb27628817 [0,1,0,0,0,0|2,0,1]=4 1457 B8R0.4 CCCSCCCC#N Amb6680724 [0,1,0,0,0,0|1,0,1]=3 1458 B8R0.4 CCCSCCCCCl Amb18798739 [0,1,0,0,0,0|1,0,1]=3 1459 B8R0.4 CCCSCCCCN Amb9391521 [0,1,0,0,0,0|1,0,1]=3 1460 B8R0.4 CCCSCCCCO Amb9370795 [0,1,0,0,0,0|0,0,2]=3 1461 B8R0.4 CCCSCCCCS Amb27766901 [0,1,0,0,0,0|0,1,1]=3 1462 B8R0.4 CCCSCCCOC Amb27837637 [0,1,0,0,0,0|2,0,0]=3 1463 B8R0.4 CCCSCCNC=O Amb27630895 [0,1,0,0,0,0|1,0,0]=2 1464 B8R0.4 CCCSCCOCC Amb27970679 [0,1,0,0,0,0|2,0,1]=4 1465 B8R0.4 CCC\C=C/C=C/C=O Amb27643510 [0,1,0,0,0,0|0,0,3]=4 1466 B8R0.4 CCC\C=C/CCCC Amb26023943 [0,1,0,0,0,0|1,0,2]=4 1467 B8R0.4 CCC\C=C\C#CC=O Amb26026989 [0,1,0,0,0,0|0,0,3]=4 1468 B8R0.4 CCC\C=C\C=C\C=O Amb8392848 [0,1,0,0,0,0|0,0,3]=4 1469 B8R0.4 CCC\C=C\CCC#N Amb33226017 [0,1,0,0,0,0|1,0,2]=4 1470 B8R0.4 CCC\C=C\CCC=O Amb33172232 [0,1,0,0,0,0|0,0,1]=2 1471 B8R0.4 CCC\C=C\CCCBr Amb26574256 [0,1,0,0,0,0|1,0,2]=4 1472 B8R0.4 CCC\C=C\CCCC Amb2778543 [0,1,0,0,0,0|1,0,2]=4 1473 B8R0.4 CCC\C=C\CCCN Amb33327176 [0,1,0,0,0,0|1,0,2]=4 1474 B8R0.4 CCC\C=C\CCCS Amb33373717 [0,1,0,0,0,0|0,1,2]=4 1475 B8R0.4 CCC\C=C\CCNC Amb33429318 [0,1,0,0,0,0|2,0,1]=4 1476 B8R0.4 CCC\C=C\CCON Amb33424856 [0,1,0,0,0,0|2,0,1]=4 1477 B8R0.4 CCC\C=C\CCSC Amb27810331 [0,1,0,0,0,0|2,0,1]=4 1478 B8R0.4 CCC\C=C\CN=C=O Amb33172054 [0,1,0,0,0,0|0,0,3]=4 1479 B8R0.4 CCC\C=C\COC=O Amb22231662 [0,1,0,0,0,0|0,0,2]=3 1480 B8R0.4 CCC\C=N\CCCC Amb19375587 [0,1,0,0,0,0|1,0,2]=4 1481 B8R0.4 CCNCCCCC#N Amb27763344 [0,1,0,0,0,0|1,0,1]=3 1482 B8R0.4 CCNCCCCCF Amb27956469 [0,1,0,0,0,0|1,0,1]=3 1483 B8R0.4 CCNCCCCCI Amb27761837 [0,1,0,0,0,0|1,0,1]=3 1484 B8R0.4 CCNCCCCCN Amb27447573 [0,1,0,0,0,0|1,0,1]=3 1485 B8R0.4 CCNCCCCCO Amb17334130 [0,1,0,0,0,0|0,0,2]=3 1486 B8R0.4 CCNCCCCOC Amb27837458 [0,1,0,0,0,0|2,0,0]=3 1487 B8R0.4 CCNCCCCSC Amb27837487 [0,1,0,0,0,0|2,0,0]=3 1488 B8R0.4 CCNCCCNC=O Amb27220690 [0,1,0,0,0,0|1,0,0]=2 1489 B8R0.4 CCNCCCNCC Amb20171936 [0,1,0,0,0,0|2,0,1]=4 1490 B8R0.4 CCNCCCSCC Amb27647486 [0,1,0,0,0,0|2,0,1]=4 1491 B8R0.4 CCNCCNCCF Amb27768816 [0,1,0,0,0,0|2,0,1]=4 1492 B8R0.4 CCNCCNCCN Amb27411449 [0,1,0,0,0,0|2,0,1]=4 1493 B8R0.4 CCNCCOCCBr Amb27208133 [0,1,0,0,0,0|2,0,1]=4 1494 B8R0.4 CCNCCOCCN Amb25305457 [0,1,0,0,0,0|2,0,1]=4 1495 B8R0.4 CCNCCOCCO Amb6736237 [0,1,0,0,0,0|1,0,2]=4 1496 B8R0.4 CCOCCCCCBr Amb24502334 [0,1,0,0,0,0|1,0,1]=3 1497 B8R0.4 CCOCCCCCCl Amb9001650 [0,1,0,0,0,0|1,0,1]=3 1498 B8R0.4 CCOCCCCCS Amb27835597 [0,1,0,0,0,0|0,1,1]=3 1499 B8R0.4 CCOCCCCNC Amb28049603 [0,1,0,0,0,0|2,0,0]=3 1500 B8R0.4 CCOCCCN=C=O Amb2092862 [0,1,0,0,0,0|1,0,1]=3 1501 B8R0.4 CCOCCCN=C=S Amb1103406 [0,1,0,0,0,0|1,1,1]=4 1502 B8R0.4 CCOCCCNC#N Amb27837430 [0,1,0,0,0,0|2,0,1]=4 1503 B8R0.4 CCOCCNCCBr Amb27629210 [0,1,0,0,0,0|2,0,1]=4 1504 B8R0.4 CCOCCNCCCl Amb27801916 [0,1,0,0,0,0|2,0,1]=4 1505 B8R0.4 CCOCCNCCN Amb27603963 [0,1,0,0,0,0|2,0,1]=4 1506 B8R0.4 CCOCCNCCS Amb28048707 [0,1,0,0,0,0|1,1,1]=4 1507 B8R0.4 CCOCCOCC=O Amb33539619 [0,1,0,0,0,0|1,0,0]=2 1508 B8R0.4 CCOCCOCCCl Amb8828467 [0,1,0,0,0,0|2,0,1]=4 1509 B8R0.4 CCOCCOCCN Amb30585145 [0,1,0,0,0,0|2,0,1]=4 1510 B8R0.4 CCOCCOCCN Amb6243196 [0,1,0,0,0,0|2,0,1]=4 1511 B8R0.4 CCOCCOCCO Amb8513162 [0,1,0,0,0,0|1,0,2]=4 1512 B8R0.4 CCOCCSCCF Amb28122264 [0,1,0,0,0,0|2,0,1]=4 1513 B8R0.4 CCOCCSCSC Amb27179570 [0,1,0,0,0,0|3,0,0]=4 1514 B8R0.4 CCOCC\C=C\CCl Amb27470132 [0,1,0,0,0,0|2,0,1]=4 1515 B8R0.4 CCOCO\C=C\C=O Amb26393569 [0,1,0,0,0,0|1,0,2]=4 1516 B8R0.4 CCOCSCCCN Amb28143434 [0,1,0,0,0,0|2,0,1]=4 1517 B8R0.4 CCOCSCCCO Amb27842168 [0,1,0,0,0,0|1,0,2]=4 1518 B8R0.4 CCONCCCCO Amb28326276 [0,1,0,0,0,0|1,0,2]=4 1519 B8R0.4 CCSCCCCC=O Amb24690525 [0,1,0,0,0,0|0,0,0]=1 1520 B8R0.4 CCSCCCCCBr Amb25887441 [0,1,0,0,0,0|1,0,1]=3 1521 B8R0.4 CCSCCCCCCl Amb9304998 [0,1,0,0,0,0|1,0,1]=3 1522 B8R0.4 CCSCCCCCF Amb28207049 [0,1,0,0,0,0|1,0,1]=3 1523 B8R0.4 CCSCCCCCN Amb28049047 [0,1,0,0,0,0|1,0,1]=3 1524 B8R0.4 CCSCCCCNC Amb27837488 [0,1,0,0,0,0|2,0,0]=3 1525 B8R0.4 CCSCCCCOC Amb27651458 [0,1,0,0,0,0|2,0,0]=3 1526 B8R0.4 CCSCCCN=C=O Amb24710786 [0,1,0,0,0,0|1,0,1]=3 1527 B8R0.4 CCSCCCN=[N+]=[N-] Amb27225598 [0,1,0,0,0,0|3,0,0]=4 1528 B8R0.4 CCSCCCNC=O Amb27457130 [0,1,0,0,0,0|1,0,0]=2 1529 B8R0.4 CCSCCNCCF Amb27241603 [0,1,0,0,0,0|2,0,1]=4 1530 B8R0.4 CCSCCNCCO Amb27454287 [0,1,0,0,0,0|1,0,2]=4 1531 B8R0.4 CCSCCOCC#N Amb27944934 [0,1,0,0,0,0|2,0,1]=4 1532 B8R0.4 CCSCCOCCBr Amb27856710 [0,1,0,0,0,0|2,0,1]=4 1533 B8R0.4 CCSCCOCCCl Amb27978105 [0,1,0,0,0,0|2,0,1]=4 1534 B8R0.4 CCSCCOCCN Amb17501990 [0,1,0,0,0,0|2,0,1]=4 1535 B8R0.4 CCSCCSCC#N Amb27617252 [0,1,0,0,0,0|2,0,1]=4 1536 B8R0.4 CCSCCSCCF Amb27768840 [0,1,0,0,0,0|2,0,1]=4 1537 B8R0.4 CC\C=C/CCCCC Amb25258581 [0,1,0,0,0,0|1,0,1]=3 1538 B8R0.4 CC\C=C/CCCCN Amb28313712 [0,1,0,0,0,0|1,0,2]=4 1539 B8R0.4 CC\C=C/CCCCO Amb22052636 [0,1,0,0,0,0|0,0,3]=4 1540 B8R0.4 CC\C=C/CCOC=O Amb22230430 [0,1,0,0,0,0|0,0,2]=3 1541 B8R0.4 CC\C=C/C\C=C\C=O Amb28251042 [0,1,0,0,0,0|0,0,3]=4 1542 B8R0.4 CC\C=C\CCCC=O Amb33171685 [0,1,0,0,0,0|0,0,1]=2 1543 B8R0.4 CC\C=C\CCCCC Amb22347893 [0,1,0,0,0,0|1,0,1]=3 1544 B8R0.4 CC\C=C\CCCCN Amb33079175 [0,1,0,0,0,0|1,0,2]=4 1545 B8R0.4 CC\C=C\CCN=C=O Amb33359304 [0,1,0,0,0,0|0,0,3]=4 1546 B8R0.4 CC\C=C\CCNCC Amb27647277 [0,1,0,0,0,0|2,0,1]=4 1547 B8R0.4 CC\C=C\CCOC=O Amb25147211 [0,1,0,0,0,0|0,0,2]=3 1548 B8R0.4 CC\C=C\CCSCC Amb27260956 [0,1,0,0,0,0|2,0,1]=4 1549 B8R0.4 CC\C=C\CC\C=C\I Amb28071366 [0,1,0,0,0,0|1,0,2]=4 1550 B8R0.4 CNCCCCCC#N Amb27489366 [0,1,0,0,0,0|1,0,1]=3 1551 B8R0.4 CNCCCCCCF Amb28137350 [0,1,0,0,0,0|1,0,1]=3 1552 B8R0.4 CNCCCCCCN Amb22641938 [0,1,0,0,0,0|1,0,1]=3 1553 B8R0.4 CNCCCCCCN Amb32667312 [0,1,0,0,0,0|1,0,1]=3 1554 B8R0.4 CNCCCCCCO Amb2721293 [0,1,0,0,0,0|0,0,2]=3 1555 B8R0.4 CNCCCCCOC Amb17569940 [0,1,0,0,0,0|2,0,0]=3 1556 B8R0.4 CNCCCNCCF Amb27465811 [0,1,0,0,0,0|2,0,1]=4 1557 B8R0.4 CNCCCNCCS Amb25146120 [0,1,0,0,0,0|1,1,1]=4 1558 B8R0.4 CNCCCOCCO Amb27855882 [0,1,0,0,0,0|1,0,2]=4 1559 B8R0.4 CNCCNCCC#N Amb28313763 [0,1,0,0,0,0|2,0,1]=4 1560 B8R0.4 CNCCNCCCF Amb27768818 [0,1,0,0,0,0|2,0,1]=4 1561 B8R0.4 CNCCNCCNC Amb8480392 [0,1,0,0,0,0|3,0,0]=4 1562 B8R0.4 CNCCNCCSC Amb27639961 [0,1,0,0,0,0|3,0,0]=4 1563 B8R0.4 CNCCOCCC#N Amb27226784 [0,1,0,0,0,0|2,0,1]=4 1564 B8R0.4 CNCCOCCCF Amb27393733 [0,1,0,0,0,0|2,0,1]=4 1565 B8R0.4 CNCCOCCNC Amb2583286 [0,1,0,0,0,0|3,0,0]=4 1566 B8R0.4 CNCCOCCOC Amb25691167 [0,1,0,0,0,0|3,0,0]=4 1567 B8R0.4 CNCCSCCCN Amb27768770 [0,1,0,0,0,0|2,0,1]=4 1568 B8R0.4 CNCCSCCSC Amb27669026 [0,1,0,0,0,0|3,0,0]=4 1569 B8R0.4 CNCCSC\C=C\Cl Amb28250304 [0,1,0,0,0,0|2,0,1]=4 1570 B8R0.4 COCCCCCC=O Amb27467958 [0,1,0,0,0,0|0,0,0]=1 1571 B8R0.4 COCCCCCCBr Amb26928164 [0,1,0,0,0,0|1,0,1]=3 1572 B8R0.4 COCCCCCCCl Amb18180174 [0,1,0,0,0,0|1,0,1]=3 1573 B8R0.4 COCCCCCCN Amb27799019 [0,1,0,0,0,0|1,0,1]=3 1574 B8R0.4 COCCCCCCO Amb28189816 [0,1,0,0,0,0|0,0,2]=3 1575 B8R0.4 COCCCCCOC Amb22348093 [0,1,0,0,0,0|2,0,0]=3 1576 B8R0.4 COCCCCN=C=O Amb33536841 [0,1,0,0,0,0|1,0,1]=3 1577 B8R0.4 COCCCCN=C=S Amb27406238 [0,1,0,0,0,0|1,1,1]=4 1578 B8R0.4 COCCCCN=[N+]=[N-] Amb24694104 [0,1,0,0,0,0|3,0,0]=4 1579 B8R0.4 COCCCCNC#N Amb28144550 [0,1,0,0,0,0|2,0,1]=4 1580 B8R0.4 COCCCCNOC Amb27593039 [0,1,0,0,0,0|2,0,1]=4 1581 B8R0.4 COCCCNCCCl Amb17334317 [0,1,0,0,0,0|2,0,1]=4 1582 B8R0.4 COCCCNCCN Amb17091021 [0,1,0,0,0,0|2,0,1]=4 1583 B8R0.4 COCCCNCCO Amb9213213 [0,1,0,0,0,0|1,0,2]=4 1584 B8R0.4 COCCCOCC#N Amb27837408 [0,1,0,0,0,0|2,0,1]=4 1585 B8R0.4 COCCCOCCCl Amb18177244 [0,1,0,0,0,0|2,0,1]=4 1586 B8R0.4 COCCCOCCI Amb27253165 [0,1,0,0,0,0|2,0,1]=4 1587 B8R0.4 COCCCOCCN Amb27751129 [0,1,0,0,0,0|2,0,1]=4 1588 B8R0.4 COCCCOCCO Amb26344833 [0,1,0,0,0,0|1,0,2]=4 1589 B8R0.4 COCCCSCCBr Amb28049052 [0,1,0,0,0,0|2,0,1]=4 1590 B8R0.4 COCCCSCCCl Amb28411442 [0,1,0,0,0,0|2,0,1]=4 1591 B8R0.4 COCCCSCCS Amb27980898 [0,1,0,0,0,0|1,1,1]=4 1592 B8R0.4 COCCNCCC#N Amb8827847 [0,1,0,0,0,0|2,0,1]=4 1593 B8R0.4 COCCNCCCN Amb17315289 [0,1,0,0,0,0|2,0,1]=4 1594 B8R0.4 COCCNCCCO Amb9246587 [0,1,0,0,0,0|1,0,2]=4 1595 B8R0.4 COCCNCCOC Amb6608693 [0,1,0,0,0,0|3,0,0]=4 1596 B8R0.4 COCCNCCSC Amb27979037 [0,1,0,0,0,0|3,0,0]=4 1597 B8R0.4 COCCOCCC#N Amb6280034 [0,1,0,0,0,0|2,0,1]=4 1598 B8R0.4 COCCOCCC=O Amb26078964 [0,1,0,0,0,0|1,0,0]=2 1599 B8R0.4 COCCOCCCBr Amb9204139 [0,1,0,0,0,0|2,0,1]=4 1600 B8R0.4 COCCOCCCCl Amb6256006 [0,1,0,0,0,0|2,0,1]=4 1601 B8R0.4 COCCOCCCN Amb1154665 [0,1,0,0,0,0|2,0,1]=4 1602 B8R0.4 COCCOCCCO Amb26608683 [0,1,0,0,0,0|1,0,2]=4 1603 B8R0.4 COCCOCCCS Amb27981281 [0,1,0,0,0,0|1,1,1]=4 1604 B8R0.4 COCCOCCOC Amb6608783 [0,1,0,0,0,0|3,0,0]=4 1605 B8R0.4 COCCOCCON Amb25369730 [0,1,0,0,0,0|3,0,0]=4 1606 B8R0.4 COCCSCCC=O Amb27837422 [0,1,0,0,0,0|1,0,0]=2 1607 B8R0.4 COCCSCCCBr Amb9304977 [0,1,0,0,0,0|2,0,1]=4 1608 B8R0.4 COCCSCCCF Amb28293660 [0,1,0,0,0,0|2,0,1]=4 1609 B8R0.4 COCCSCCCS Amb27838576 [0,1,0,0,0,0|1,1,1]=4 1610 B8R0.4 COCCSCCON Amb28062817 [0,1,0,0,0,0|3,0,0]=4 1611 B8R0.4 COCOCCCC=O Amb27234488 [0,1,0,0,0,0|1,0,0]=2 1612 B8R0.4 COCOCCCCCl Amb22641569 [0,1,0,0,0,0|2,0,1]=4 1613 B8R0.4 COCSCCCC#N Amb18927650 [0,1,0,0,0,0|2,0,1]=4 1614 B8R0.4 COC\C=C\CCC=O Amb26931864 [0,1,0,0,0,0|0,0,2]=3 1615 B8R0.4 CONCCCCSC Amb27593538 [0,1,0,0,0,0|2,0,1]=4 1616 B8R0.4 CO\C=C\CCCCO Amb27448464 [0,1,0,0,0,0|1,0,2]=4 1617 B8R0.4 CO\N=C\CCCC=O Amb27408636 [0,1,0,0,0,0|1,0,1]=3 1618 B8R0.4 CSCCCCCC#N Amb26626575 [0,1,0,0,0,0|1,0,1]=3 1619 B8R0.4 CSCCCCCC=O Amb27981887 [0,1,0,0,0,0|0,0,0]=1 1620 B8R0.4 CSCCCCCCN Amb24532830 [0,1,0,0,0,0|1,0,1]=3 1621 B8R0.4 CSCCCCCCO Amb22367888 [0,1,0,0,0,0|0,0,2]=3 1622 B8R0.4 CSCCCCCCS Amb27801758 [0,1,0,0,0,0|0,1,1]=3 1623 B8R0.4 CSCCCCCSC Amb4020033 [0,1,0,0,0,0|2,0,0]=3 1624 B8R0.4 CSCCCCN=C=O Amb28320666 [0,1,0,0,0,0|1,0,1]=3 1625 B8R0.4 CSCCCCN=[N+]=[N-] Amb25758808 [0,1,0,0,0,0|3,0,0]=4 1626 B8R0.4 CSCCCCNC=O Amb28366040 [0,1,0,0,0,0|1,0,0]=2 1627 B8R0.4 CSCCCNCCBr Amb27217836 [0,1,0,0,0,0|2,0,1]=4 1628 B8R0.4 CSCCCNCCCl Amb27869237 [0,1,0,0,0,0|2,0,1]=4 1629 B8R0.4 CSCCCOCC=O Amb28286017 [0,1,0,0,0,0|1,0,0]=2 1630 B8R0.4 CSCCCOCCS Amb27257161 [0,1,0,0,0,0|1,1,1]=4 1631 B8R0.4 CSCCCSCCBr Amb28326052 [0,1,0,0,0,0|2,0,1]=4 1632 B8R0.4 CSCCCSCCS Amb27666422 [0,1,0,0,0,0|1,1,1]=4 1633 B8R0.4 CSCCNCCC#N Amb27235470 [0,1,0,0,0,0|2,0,1]=4 1634 B8R0.4 CSCCNCCCBr Amb28137679 [0,1,0,0,0,0|2,0,1]=4 1635 B8R0.4 CSCCNCCCCl Amb27599936 [0,1,0,0,0,0|2,0,1]=4 1636 B8R0.4 CSCCNCCCF Amb28136726 [0,1,0,0,0,0|2,0,1]=4 1637 B8R0.4 CSCCOCCC#N Amb28044446 [0,1,0,0,0,0|2,0,1]=4 1638 B8R0.4 CSCCOCCC=O Amb27823932 [0,1,0,0,0,0|1,0,0]=2 1639 B8R0.4 CSCCOCCCN Amb27146302 [0,1,0,0,0,0|2,0,1]=4 1640 B8R0.4 CSCCOCCSC Amb27170781 [0,1,0,0,0,0|3,0,0]=4 1641 B8R0.4 CSCCSCCC=O Amb27956184 [0,1,0,0,0,0|1,0,0]=2 1642 B8R0.4 C\C=C/CCCCC=O Amb26854801 [0,1,0,0,0,0|0,0,1]=2 1643 B8R0.4 C\C=C/CCCCCC Amb27478896 [0,1,0,0,0,0|1,0,0]=2 1644 B8R0.4 C\C=C/CCC\C=C/C Amb22230407 [0,1,0,0,0,0|1,0,2]=4 1645 B8R0.4 C\C=C/CCC\C=C\C Amb28142478 [0,1,0,0,0,0|1,0,2]=4 1646 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [0,1,0,0,0,0|1,0,2]=4 1647 B8R0.4 C\C=C\CCCCCC Amb19930200 [0,1,0,0,0,0|1,0,0]=2 1648 B8R0.4 C\C=C\CCCCCO Amb25247777 [0,1,0,0,0,0|1,0,1]=3 1649 B8R0.4 C\C=C\CCCCNO Amb27849039 [0,1,0,0,0,0|1,0,2]=4 1650 B8R0.4 C\C=C\CCC\C=C\C Amb27776888 [0,1,0,0,0,0|1,0,2]=4 1651 B8R0.4 C\C=C\CC\C=C\C=O Amb18642215 [0,1,0,0,0,0|0,0,3]=4 1652 B8R0.4 C\C=C\CNCCCI Amb27652349 [0,1,0,0,0,0|2,0,1]=4 1653 B8R0.4 C\C=C\CNCCCN Amb27175088 [0,1,0,0,0,0|2,0,1]=4 1654 B8R0.4 C\C=C\COCCCBr Amb27949261 [0,1,0,0,0,0|2,0,1]=4 1655 B8R0.4 C\C=C\COCCNC Amb27852522 [0,1,0,0,0,0|2,0,1]=4 1656 B8R0.4 C\C=C\CSCCOC Amb27766159 [0,1,0,0,0,0|2,0,1]=4 1657 B8R0.4 C\C=C\C\C=C\CC=O Amb27489085 [0,1,0,0,0,0|0,0,3]=4 1658 B8R0.4 C\C=C\OCCCCO Amb27486247 [0,1,0,0,0,0|2,0,1]=4 1659 B8R0.4 ClC#CCCCCCCl Amb27494049 [0,1,0,0,0,0|1,0,2]=4 1660 B8R0.4 ClCCCCCCCBr Amb24323576 [0,1,0,0,0,0|1,0,1]=3 1661 B8R0.4 ClCCCCCCCCl Amb22232563 [0,1,0,0,0,0|1,0,1]=3 1662 B8R0.4 ClCCCCCC[Zn]Br Amb22000406 [0,1,0,0,0,0|2,0,0]=3 1663 B8R0.4 ClCCCNCCCCl Amb25147083 [0,1,0,0,0,0|2,0,1]=4 1664 B8R0.4 ClCCCOCCCCl Amb2700587 [0,1,0,0,0,0|2,0,1]=4 1665 B8R0.4 ClCCCSCCCCl Amb27808763 [0,1,0,0,0,0|2,0,1]=4 1666 B8R0.4 Cl\C=C\CNCCCI Amb27628151 [0,1,0,0,0,0|2,0,1]=4 1667 B8R0.4 FCCCCNCCBr Amb28457765 [0,1,0,0,0,0|2,0,1]=4 1668 B8R0.4 FCCCCNCCCl Amb27255714 [0,1,0,0,0,0|2,0,1]=4 1669 B8R0.4 FCCCCNCCF Amb27799430 [0,1,0,0,0,0|2,0,1]=4 1670 B8R0.4 FCCCNCCCBr Amb27843825 [0,1,0,0,0,0|2,0,1]=4 1671 B8R0.4 FCCCNCCCCl Amb27838497 [0,1,0,0,0,0|2,0,1]=4 1672 B8R0.4 FCCCNC\C=C\Cl Amb27808989 [0,1,0,0,0,0|2,0,1]=4 1673 B8R0.4 FCCCSCCCCl Amb27243197 [0,1,0,0,0,0|2,0,1]=4 1674 B8R0.4 FCCCSCCCF Amb27977388 [0,1,0,0,0,0|2,0,1]=4 1675 B8R0.4 N#CCCCCCC#N Amb8396862 [0,1,0,0,0,0|1,0,2]=4 1676 B8R0.4 N#CCCCCCC=O Amb18642301 [0,1,0,0,0,0|0,0,1]=2 1677 B8R0.4 N#CCCCCCCBr Amb8515196 [0,1,0,0,0,0|1,0,1]=3 1678 B8R0.4 N#CCCCCCCCl Amb22045160 [0,1,0,0,0,0|1,0,1]=3 1679 B8R0.4 N#CCCCCCON Amb27431737 [0,1,0,0,0,0|2,0,1]=4 1680 B8R0.4 N#CCCCNCCF Amb28045226 [0,1,0,0,0,0|2,0,1]=4 1681 B8R0.4 N#CCCCNCCN Amb27837506 [0,1,0,0,0,0|2,0,1]=4 1682 B8R0.4 N#CCCCNCCO Amb9247394 [0,1,0,0,0,0|2,0,1]=4 1683 B8R0.4 N#CCCCOCCN Amb27475883 [0,1,0,0,0,0|2,0,1]=4 1684 B8R0.4 N#CCCNCCCN Amb27396494 [0,1,0,0,0,0|2,0,1]=4 1685 B8R0.4 N#CCCNCCCO Amb9243306 [0,1,0,0,0,0|2,0,1]=4 1686 B8R0.4 N#CCCSCCCO Amb17502405 [0,1,0,0,0,0|2,0,1]=4 1687 B8R0.4 N#CCSCCCCN Amb17500946 [0,1,0,0,0,0|2,0,1]=4 1688 B8R0.4 N#CSCCCCC=O Amb28436745 [0,1,0,0,0,0|1,0,1]=3 1689 B8R0.4 N#C\C=C\CCCC=O Amb18642109 [0,1,0,0,0,0|0,0,3]=4 1690 B8R0.4 N#C\C=C\CCCCBr Amb27965026 [0,1,0,0,0,0|2,0,1]=4 1691 B8R0.4 N#C\C=C\CCCCCl Amb27622521 [0,1,0,0,0,0|2,0,1]=4 1692 B8R0.4 NCCCCCCCBr Amb27817795 [0,1,0,0,0,0|1,0,1]=3 1693 B8R0.4 NCCCCCCCBr Amb33321489 [0,1,0,0,0,0|1,0,1]=3 1694 B8R0.4 NCCCCCCCF Amb25918508 [0,1,0,0,0,0|1,0,1]=3 1695 B8R0.4 NCCCCCCCN Amb3370862 [0,1,0,0,0,0|1,0,1]=3 1696 B8R0.4 NCCCCCCCO Amb24120448 [0,1,0,0,0,0|0,0,2]=3 1697 B8R0.4 NCCCCCCCO Amb33544521 [0,1,0,0,0,0|0,0,2]=3 1698 B8R0.4 NCCCCCCCS Amb25147209 [0,1,0,0,0,0|0,1,1]=3 1699 B8R0.4 NCCCCNCCBr Amb27865413 [0,1,0,0,0,0|2,0,1]=4 1700 B8R0.4 NCCCCNCCN Amb24117220 [0,1,0,0,0,0|2,0,1]=4 1701 B8R0.4 NCCCCNCCN Amb25378773 [0,1,0,0,0,0|2,0,1]=4 1702 B8R0.4 NCCCCNCCO Amb8394908 [0,1,0,0,0,0|1,0,2]=4 1703 B8R0.4 NCCCCOCCO Amb6681146 [0,1,0,0,0,0|1,0,2]=4 1704 B8R0.4 NCCCCSCCN Amb27872081 [0,1,0,0,0,0|2,0,1]=4 1705 B8R0.4 NCCCCSCCO Amb17500958 [0,1,0,0,0,0|1,0,2]=4 1706 B8R0.4 NCCCC\C=C\CO Amb24117507 [0,1,0,0,0,0|1,0,2]=4 1707 B8R0.4 NCCCC\C=C\CO Amb27780423 [0,1,0,0,0,0|1,0,2]=4 1708 B8R0.4 NCCCNCCCN Amb8513191 [0,1,0,0,0,0|2,0,1]=4 1709 B8R0.4 NCCCNCCCO Amb19959935 [0,1,0,0,0,0|1,0,2]=4 1710 B8R0.4 NCCCNC\C=C\Cl Amb27668568 [0,1,0,0,0,0|2,0,1]=4 1711 B8R0.4 NCCCOCCCF Amb27391202 [0,1,0,0,0,0|2,0,1]=4 1712 B8R0.4 NCCCOCCCN Amb17593392 [0,1,0,0,0,0|2,0,1]=4 1713 B8R0.4 NCCCOCCCO Amb35788244 [0,1,0,0,0,0|1,0,2]=4 1714 B8R0.4 NCCCOCCCO Amb9392882 [0,1,0,0,0,0|1,0,2]=4 1715 B8R0.4 NCCCSCCCO Amb17500713 [0,1,0,0,0,0|1,0,2]=4 1716 B8R0.4 NCCCSCCON Amb28319278 [0,1,0,0,0,0|3,0,0]=4 1717 B8R0.4 NCCSCCCCF Amb27830248 [0,1,0,0,0,0|2,0,1]=4 1718 B8R0.4 NCCSCCCCS Amb27878524 [0,1,0,0,0,0|1,1,1]=4 1719 B8R0.4 NOCCCSCCO Amb27420973 [0,1,0,0,0,0|3,0,0]=4 1720 B8R0.4 O=C=NCCCCCBr Amb27400093 [0,1,0,0,0,0|1,0,1]=3 1721 B8R0.4 O=C=NCCCCCCl Amb27961416 [0,1,0,0,0,0|1,0,1]=3 1722 B8R0.4 O=CCCC#CCCO Amb27164553 [0,1,0,0,0,0|0,0,2]=3 1723 B8R0.4 O=CCCCC#CCBr Amb27478060 [0,1,0,0,0,0|0,0,2]=3 1724 B8R0.4 O=CCCCCCCBr Amb22755463 [0,1,0,0,0,0|0,0,0]=1 1725 B8R0.4 O=CCCCCCCCl Amb27262031 [0,1,0,0,0,0|0,0,0]=1 1726 B8R0.4 O=CCCCCNC=O Amb27841683 [0,1,0,0,0,0|1,0,1]=3 1727 B8R0.4 O=CCCC\C=C\CO Amb27169480 [0,1,0,0,0,0|0,0,2]=3 1728 B8R0.4 O=CCCOCCCO Amb28428559 [0,1,0,0,0,0|1,0,0]=2 1729 B8R0.4 O=CCC\C=C\CCBr Amb25961650 [0,1,0,0,0,0|0,0,2]=3 1730 B8R0.4 O=CNCCOCCO Amb4034567 [0,1,0,0,0,0|2,0,0]=3 1731 B8R0.4 O=COCCOCCO Amb28049268 [0,1,0,0,0,0|2,0,0]=3 1732 B8R0.4 O=C\C=C/CCCC=O Amb28202061 [0,1,0,0,0,0|0,0,3]=4 1733 B8R0.4 O=NOCCOCCCl Amb27185721 [0,1,0,0,0,0|3,0,0]=4 1734 B8R0.4 OCCCCCCCBr Amb9787726 [0,1,0,0,0,0|0,0,2]=3 1735 B8R0.4 OCCCCCCCF Amb25381297 [0,1,0,0,0,0|0,0,2]=3 1736 B8R0.4 OCCCCCCCI Amb32411247 [0,1,0,0,0,0|0,0,2]=3 1737 B8R0.4 OCCCCCCCO Amb8513178 [0,1,0,0,0,0|0,0,2]=3 1738 B8R0.4 OCCCCNCCO Amb28049076 [0,1,0,0,0,0|1,0,2]=4 1739 B8R0.4 OCCCCOCCO Amb25185198 [0,1,0,0,0,0|1,0,2]=4 1740 B8R0.4 OCCCNCCCO Amb28984089 [0,1,0,0,0,0|1,0,2]=4 1741 B8R0.4 OCCCNCCCO Amb8393926 [0,1,0,0,0,0|1,0,2]=4 1742 B8R0.4 OCCCOCCCCl Amb28058754 [0,1,0,0,0,0|1,0,2]=4 1743 B8R0.4 OCCCOCCCO Amb24626114 [0,1,0,0,0,0|1,0,2]=4 1744 B8R0.4 OC\C=C\CCCCO Amb27642149 [0,1,0,0,0,0|1,0,2]=4 1745 B8R0.4 [C-]#[N+]CCCCCC=O Amb27424636 [0,1,0,0,0,0|0,0,1]=2 1746 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [0,1,0,0,0,0|1,0,1]=3 1747 B8R0.4 [C-]#[N+]CCCCC[N+]#[C-] Amb27424685 [0,1,0,0,0,0|2,0,1]=4 1748 B8R0.4 [C-]#[N+]CC\C=C\CCC Amb33424871 [0,1,0,0,0,0|2,0,1]=4 1749 B8R0.4 [N-]=[N+]=NCCCCCN Amb27640041 [0,1,0,0,0,0|3,0,0]=4 1750 B8R0.4 [N-]=[N+]=NCCCCCN Amb34912698 [0,1,0,0,0,0|3,0,0]=4 1751 B8R0.4 [N-]=[N+]=NCCCCCO Amb33529811 [0,1,0,0,0,0|3,0,0]=4 1752 B8R0.6 C#CC(=O)CCCCC Amb27844075 [0,1,0,0,0,0|1,0,2]=4 1753 B8R0.6 C#CC(C)NCCCC Amb25918608 [0,1,0,0,0,0|2,0,1]=4 1754 B8R0.6 C#CC(N)CCOCC Amb27815576 [0,1,0,0,0,0|2,0,1]=4 1755 B8R0.6 C#CC(O)CCCCC Amb2721717 [0,1,0,0,0,0|1,0,1]=3 1756 B8R0.6 C#CC(O)CCCCN Amb28341771 [0,1,0,0,0,0|2,0,1]=4 1757 B8R0.6 C#CC(O)CNCCC Amb28189676 [0,1,0,0,0,0|2,0,1]=4 1758 B8R0.6 C#CC(O)OCCCC Amb27432239 [0,1,0,0,0,0|2,0,1]=4 1759 B8R0.6 C#CCCCC(=O)CC Amb27837514 [0,1,0,0,0,0|1,0,2]=4 1760 B8R0.6 C#CCCCC(Br)CC Amb27601282 [0,1,0,0,0,0|1,0,1]=3 1761 B8R0.6 C#CCCCC(C)CO Amb27399800 [0,1,0,0,0,0|2,0,1]=4 1762 B8R0.6 C#CCCCC(N)CO Amb28061736 [0,1,0,0,0,0|2,0,1]=4 1763 B8R0.6 C#CCCCC(O)C=C Amb27613420 [0,1,0,0,0,0|1,0,2]=4 1764 B8R0.6 C#CCCCC(O)CCl Amb27650765 [0,1,0,0,0,0|2,0,1]=4 1765 B8R0.6 C#CCCC[C@@H](N)CO Amb32620213 [0,1,0,0,0,0|2,0,1]=4 1766 B8R0.6 C#CCCC[C@H](N)CO Amb32620183 [0,1,0,0,0,0|2,0,1]=4 1767 B8R0.6 C#CCCOC(Cl)CC Amb28239817 [0,1,0,0,0,0|2,0,1]=4 1768 B8R0.6 C#CCCSC(C)CC Amb27837528 [0,1,0,0,0,0|2,0,1]=4 1769 B8R0.6 C#CCSCC(C)CC Amb27662850 [0,1,0,0,0,0|2,0,1]=4 1770 B8R0.6 C#CCSCC(F)CC Amb27768839 [0,1,0,0,0,0|2,0,1]=4 1771 B8R0.6 C#C[C@@H](O)CCCCC Amb8516365 [0,1,0,0,0,0|1,0,1]=3 1772 B8R0.6 C#C[C@H](C)CCCCO Amb27766839 [0,1,0,0,0,0|2,0,1]=4 1773 B8R0.6 C#C[C@H](O)CCCCC Amb8516404 [0,1,0,0,0,0|1,0,1]=3 1774 B8R0.6 C=C(C=O)CCCCC Amb18642442 [0,1,0,0,0,0|0,0,1]=2 1775 B8R0.6 C=C(C=O)CCCCCl Amb27621755 [0,1,0,0,0,0|1,0,1]=3 1776 B8R0.6 C=C(CBr)CCCCC Amb27875113 [0,1,0,0,0,0|1,0,2]=4 1777 B8R0.6 C=C(CC)CCCCCl Amb27430621 [0,1,0,0,0,0|1,0,2]=4 1778 B8R0.6 C=C(CC)CCCCO Amb25057130 [0,1,0,0,0,0|0,0,3]=4 1779 B8R0.6 C=CC(=C)CCCC=O Amb18642214 [0,1,0,0,0,0|0,0,3]=4 1780 B8R0.6 C=CC(=O)CCCCC Amb20671146 [0,1,0,0,0,0|1,0,1]=3 1781 B8R0.6 C=CC(=O)CSCCC Amb28041993 [0,1,0,0,0,0|2,0,1]=4 1782 B8R0.6 C=CC(=O)NCCCC Amb9480528 [0,1,0,0,0,0|2,0,1]=4 1783 B8R0.6 C=CC(=O)OCCCC Amb3940493 [0,1,0,0,0,0|2,0,1]=4 1784 B8R0.6 C=CC(=O)OCCCC Amb3940920 [0,1,0,0,0,0|2,0,1]=4 1785 B8R0.6 C=CC(Br)CC\C=C\C Amb27478049 [0,1,0,0,0,0|1,0,2]=4 1786 B8R0.6 C=CC(Br)C\C=C/CC Amb27233567 [0,1,0,0,0,0|1,0,2]=4 1787 B8R0.6 C=CC(C)CCCCC Amb27963700 [0,1,0,0,0,0|1,0,0]=2 1788 B8R0.6 C=CC(C)OCCCC Amb27420990 [0,1,0,0,0,0|2,0,0]=3 1789 B8R0.6 C=CC(C)SCCCC Amb28190115 [0,1,0,0,0,0|2,0,0]=3 1790 B8R0.6 C=CC(C)SCCCO Amb28183146 [0,1,0,0,0,0|3,0,0]=4 1791 B8R0.6 C=CC(Cl)CCCOC Amb27965062 [0,1,0,0,0,0|2,0,0]=3 1792 B8R0.6 C=CC(Cl)CCOCC Amb27196600 [0,1,0,0,0,0|2,0,0]=3 1793 B8R0.6 C=CC(N)CCCOC Amb28124519 [0,1,0,0,0,0|2,0,0]=3 1794 B8R0.6 C=CC(O)CC#CCC Amb27833137 [0,1,0,0,0,0|1,0,2]=4 1795 B8R0.6 C=CC(O)CCCCBr Amb27666905 [0,1,0,0,0,0|2,0,0]=3 1796 B8R0.6 C=CC(O)CCCCC Amb3940384 [0,1,0,0,0,0|1,0,0]=2 1797 B8R0.6 C=CC(O)CCCCO Amb28193458 [0,1,0,0,0,0|2,0,0]=3 1798 B8R0.6 C=CC(O)CNCCCl Amb27444853 [0,1,0,0,0,0|3,0,0]=4 1799 B8R0.6 C=CC(O)CNCCO Amb27410210 [0,1,0,0,0,0|3,0,0]=4 1800 B8R0.6 C=CC(O)CSCCC Amb28200246 [0,1,0,0,0,0|2,0,0]=3 1801 B8R0.6 C=CC(O)\C=C\CCC Amb33474698 [0,1,0,0,0,0|1,0,2]=4 1802 B8R0.6 C=CCCCC(=C)C=O Amb27802486 [0,1,0,0,0,0|0,0,3]=4 1803 B8R0.6 C=CCCCC(=O)CBr Amb27966828 [0,1,0,0,0,0|2,0,1]=4 1804 B8R0.6 C=CCCCC(=O)CC Amb27249620 [0,1,0,0,0,0|1,0,1]=3 1805 B8R0.6 C=CCCCC(=O)OC Amb22730759 [0,1,0,0,0,0|2,0,1]=4 1806 B8R0.6 C=CCCCC(C)C=O Amb27984474 [0,1,0,0,0,0|0,0,2]=3 1807 B8R0.6 C=CCCCC(C)CBr Amb24478641 [0,1,0,0,0,0|2,0,0]=3 1808 B8R0.6 C=CCCCC(C)CCl Amb26455832 [0,1,0,0,0,0|2,0,0]=3 1809 B8R0.6 C=CCCCC(F)C=O Amb27623056 [0,1,0,0,0,0|0,0,2]=3 1810 B8R0.6 C=CCCCC(N)CC Amb27806538 [0,1,0,0,0,0|1,0,0]=2 1811 B8R0.6 C=CCCCC(N)CO Amb25147202 [0,1,0,0,0,0|2,0,0]=3 1812 B8R0.6 C=CCCCC(O)C=C Amb22354191 [0,1,0,0,0,0|1,0,2]=4 1813 B8R0.6 C=CCCCC(O)CC Amb27470890 [0,1,0,0,0,0|1,0,0]=2 1814 B8R0.6 C=CCCCC(O)CO Amb28049202 [0,1,0,0,0,0|2,0,0]=3 1815 B8R0.6 C=CCCCN(C)C=O Amb25209472 [0,1,0,0,0,0|1,0,2]=4 1816 B8R0.6 C=CCCCN(C)OC Amb27806445 [0,1,0,0,0,0|3,0,0]=4 1817 B8R0.6 C=CCCC[C@@H](C)C=O Amb27755054 [0,1,0,0,0,0|0,0,2]=3 1818 B8R0.6 C=CCCC[C@@H](O)C=C Amb27647926 [0,1,0,0,0,0|1,0,2]=4 1819 B8R0.6 C=CCCC[C@H](C)C=O Amb27876153 [0,1,0,0,0,0|0,0,2]=3 1820 B8R0.6 C=CCCC[C@H](O)C=C Amb27805375 [0,1,0,0,0,0|1,0,2]=4 1821 B8R0.6 C=CCCC[C@H](O)CC Amb27857959 [0,1,0,0,0,0|1,0,0]=2 1822 B8R0.6 C=CCCC[C@H](O)CCl Amb28123912 [0,1,0,0,0,0|2,0,0]=3 1823 B8R0.6 C=CCCC[C@H](O)CO Amb27594001 [0,1,0,0,0,0|2,0,0]=3 1824 B8R0.6 C=CCNCC(C)CN Amb27459827 [0,1,0,0,0,0|3,0,0]=4 1825 B8R0.6 C=CCNCC(C)CO Amb27750576 [0,1,0,0,0,0|3,0,0]=4 1826 B8R0.6 C=CCNCC(C)NC Amb28207623 [0,1,0,0,0,0|3,0,0]=4 1827 B8R0.6 C=CCNCC(O)CCl Amb28134567 [0,1,0,0,0,0|3,0,0]=4 1828 B8R0.6 C=CCNCC(O)CO Amb17308749 [0,1,0,0,0,0|3,0,0]=4 1829 B8R0.6 C=CCNC[C@H](O)CC Amb27979109 [0,1,0,0,0,0|2,0,0]=3 1830 B8R0.6 C=CCNC[C@H](O)CO Amb28139426 [0,1,0,0,0,0|3,0,0]=4 1831 B8R0.6 C=CCOCC(=O)CC Amb27181141 [0,1,0,0,0,0|2,0,1]=4 1832 B8R0.6 C=CCOCC(C)CBr Amb25918823 [0,1,0,0,0,0|3,0,0]=4 1833 B8R0.6 C=CCOCC(C)CCl Amb25887426 [0,1,0,0,0,0|3,0,0]=4 1834 B8R0.6 C=CCOCC(C)CN Amb27668488 [0,1,0,0,0,0|3,0,0]=4 1835 B8R0.6 C=CCOCC(N)CO Amb27597791 [0,1,0,0,0,0|3,0,0]=4 1836 B8R0.6 C=CCOCC(O)CBr Amb28076631 [0,1,0,0,0,0|3,0,0]=4 1837 B8R0.6 C=CCOCC(O)CCl Amb4017847 [0,1,0,0,0,0|3,0,0]=4 1838 B8R0.6 C=CCOCC(O)CN Amb5248323 [0,1,0,0,0,0|3,0,0]=4 1839 B8R0.6 C=CCOCC(O)CS Amb27485236 [0,1,0,0,0,0|3,0,0]=4 1840 B8R0.6 C=CCOC[C@@H](O)CO Amb27478722 [0,1,0,0,0,0|3,0,0]=4 1841 B8R0.6 C=CCOC[C@H](C)CO Amb27598546 [0,1,0,0,0,0|3,0,0]=4 1842 B8R0.6 C=CCOC[C@H](O)CC Amb27429584 [0,1,0,0,0,0|2,0,0]=3 1843 B8R0.6 C=CCOC[C@H](O)CO Amb26498763 [0,1,0,0,0,0|3,0,0]=4 1844 B8R0.6 C=CCSCC(=C)CC Amb27977764 [0,1,0,0,0,0|2,0,1]=4 1845 B8R0.6 C=CCSCC(=O)CC Amb27856651 [0,1,0,0,0,0|2,0,1]=4 1846 B8R0.6 C=CCSCC(C)CBr Amb27856656 [0,1,0,0,0,0|3,0,0]=4 1847 B8R0.6 C=CCSCC(C)CC Amb27760930 [0,1,0,0,0,0|2,0,0]=3 1848 B8R0.6 C=CCSCC(C)CCl Amb28281225 [0,1,0,0,0,0|3,0,0]=4 1849 B8R0.6 C=CCSCC(C)NC Amb27608037 [0,1,0,0,0,0|3,0,0]=4 1850 B8R0.6 C=CCSCC(F)CC Amb28124203 [0,1,0,0,0,0|2,0,0]=3 1851 B8R0.6 C=CCSCC(N)CO Amb27648831 [0,1,0,0,0,0|3,0,0]=4 1852 B8R0.6 C=CCSCC(O)CC Amb27805379 [0,1,0,0,0,0|2,0,0]=3 1853 B8R0.6 C=COCCC(C)SC Amb27243758 [0,1,0,0,0,0|3,0,0]=4 1854 B8R0.6 C=C[C@@H](O)CCCCC Amb8513277 [0,1,0,0,0,0|1,0,0]=2 1855 B8R0.6 C=C[C@@H](O)C\C=C\CC Amb28049222 [0,1,0,0,0,0|1,0,2]=4 1856 B8R0.6 C=C[C@H](Cl)CCCCC Amb27863541 [0,1,0,0,0,0|1,0,0]=2 1857 B8R0.6 C=C[C@H](O)CCCCC Amb8515093 [0,1,0,0,0,0|1,0,0]=2 1858 B8R0.6 CC#CCCC(Cl)CC Amb27254500 [0,1,0,0,0,0|1,0,2]=4 1859 B8R0.6 CC#CCCC(O)C=O Amb27219115 [0,1,0,0,0,0|0,0,2]=3 1860 B8R0.6 CC#CCC[C@H](O)CC Amb27981607 [0,1,0,0,0,0|1,0,2]=4 1861 B8R0.6 CC(C=O)CCCC=O Amb18642651 [0,1,0,0,0,0|1,0,1]=3 1862 B8R0.6 CC(C=O)COCCO Amb28313015 [0,1,0,0,0,0|2,0,0]=3 1863 B8R0.6 CC(CCCCF)NN Amb27446377 [0,1,0,0,0,0|3,0,0]=4 1864 B8R0.6 CC(CCCCN)NO Amb27956523 [0,1,0,0,0,0|2,0,1]=4 1865 B8R0.6 CC(CO)CCCCO Amb27751851 [0,1,0,0,0,0|1,0,2]=4 1866 B8R0.6 CCC(=O)CCCCO Amb27867195 [0,1,0,0,0,0|0,0,3]=4 1867 B8R0.6 CCC(=O)NCCC=O Amb17102166 [0,1,0,0,0,0|1,0,1]=3 1868 B8R0.6 CCC(C)CCCC#N Amb27480159 [0,1,0,0,0,0|1,0,1]=3 1869 B8R0.6 CCC(C)CCCC=O Amb18642680 [0,1,0,0,0,0|0,0,0]=1 1870 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|1,0,1]=3 1871 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|0,0,2]=3 1872 B8R0.6 CCC(C)CCN=C=O Amb26601869 [0,1,0,0,0,0|1,0,1]=3 1873 B8R0.6 CCC(C)CCN=[N+]=[N-] Amb25350357 [0,1,0,0,0,0|3,0,0]=4 1874 B8R0.6 CCC(C)CCNOC Amb28455879 [0,1,0,0,0,0|3,0,0]=4 1875 B8R0.6 CCC(C)CNCCO Amb3940071 [0,1,0,0,0,0|1,0,2]=4 1876 B8R0.6 CCC(C)COCCO Amb27198059 [0,1,0,0,0,0|1,0,2]=4 1877 B8R0.6 CCC(C)CSCCBr Amb27493953 [0,1,0,0,0,0|2,0,1]=4 1878 B8R0.6 CCC(C)CSCCF Amb27218787 [0,1,0,0,0,0|2,0,1]=4 1879 B8R0.6 CCC(C)CSCCN Amb27983415 [0,1,0,0,0,0|2,0,1]=4 1880 B8R0.6 CCC(C)CSCCS Amb27471047 [0,1,0,0,0,0|1,1,1]=4 1881 B8R0.6 CCC(C)CSCOC Amb27977816 [0,1,0,0,0,0|3,0,0]=4 1882 B8R0.6 CCC(C)NCCC#N Amb6736551 [0,1,0,0,0,0|2,0,1]=4 1883 B8R0.6 CCC(C)NCCCBr Amb27838582 [0,1,0,0,0,0|2,0,1]=4 1884 B8R0.6 CCC(C)NCCCF Amb27838485 [0,1,0,0,0,0|2,0,1]=4 1885 B8R0.6 CCC(C)NCCCN Amb17315265 [0,1,0,0,0,0|2,0,1]=4 1886 B8R0.6 CCC(C)NCCCO Amb6733732 [0,1,0,0,0,0|1,0,2]=4 1887 B8R0.6 CCC(C)NCCOC Amb6685733 [0,1,0,0,0,0|3,0,0]=4 1888 B8R0.6 CCC(C)OCCC=O Amb27866656 [0,1,0,0,0,0|1,0,0]=2 1889 B8R0.6 CCC(C)OCCCBr Amb18321256 [0,1,0,0,0,0|2,0,1]=4 1890 B8R0.6 CCC(C)OCCCCl Amb18176654 [0,1,0,0,0,0|2,0,1]=4 1891 B8R0.6 CCC(C)OCCCN Amb20076070 [0,1,0,0,0,0|2,0,1]=4 1892 B8R0.6 CCC(C)SCCC=O Amb28118733 [0,1,0,0,0,0|1,0,0]=2 1893 B8R0.6 CCC(C)SCCCO Amb9273773 [0,1,0,0,0,0|1,0,2]=4 1894 B8R0.6 CCC(C)SCCOC Amb27962134 [0,1,0,0,0,0|3,0,0]=4 1895 B8R0.6 CCC(Cl)CCCOC Amb18180141 [0,1,0,0,0,0|2,0,0]=3 1896 B8R0.6 CCC(F)CCN=C=O Amb27423402 [0,1,0,0,0,0|1,0,1]=3 1897 B8R0.6 CCC(F)CSCCO Amb27757051 [0,1,0,0,0,0|1,0,2]=4 1898 B8R0.6 CCC(N)CCCNC Amb27231954 [0,1,0,0,0,0|2,0,0]=3 1899 B8R0.6 CCC(N)CNCCO Amb33230048 [0,1,0,0,0,0|1,0,2]=4 1900 B8R0.6 CCC(N)COCC#N Amb18111716 [0,1,0,0,0,0|2,0,1]=4 1901 B8R0.6 CCC(N)CSCC#N Amb28397055 [0,1,0,0,0,0|2,0,1]=4 1902 B8R0.6 CCC(N)CSCCO Amb28285128 [0,1,0,0,0,0|1,0,2]=4 1903 B8R0.6 CCC(N)CSCOC Amb28141151 [0,1,0,0,0,0|3,0,0]=4 1904 B8R0.6 CCC(O)CCCCCl Amb27786918 [0,1,0,0,0,0|1,0,1]=3 1905 B8R0.6 CCC(O)CCCCO Amb27762946 [0,1,0,0,0,0|0,0,2]=3 1906 B8R0.6 CCC(O)CCCNC Amb27655789 [0,1,0,0,0,0|2,0,0]=3 1907 B8R0.6 CCC(O)CCCOC Amb28249167 [0,1,0,0,0,0|2,0,0]=3 1908 B8R0.6 CCCBCC(C)CCl Amb27771247 [0,1,0,0,0,0|2,0,1]=4 1909 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,1,0,0,0,0|1,0,2]=4 1910 B8R0.6 CCCCCC(=O)CO Amb27956467 [0,1,0,0,0,0|0,0,3]=4 1911 B8R0.6 CCCCCC(=O)CS Amb27750258 [0,1,0,0,0,0|0,1,2]=4 1912 B8R0.6 CCCCCC(=O)NN Amb6540616 [0,1,0,0,0,0|2,0,1]=4 1913 B8R0.6 CCCCCC(=O)NO Amb2720996 [0,1,0,0,0,0|1,0,2]=4 1914 B8R0.6 CCCCCC(=O)OC Amb6608968 [0,1,0,0,0,0|2,0,1]=4 1915 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|1,0,1]=3 1916 B8R0.6 CCCCCC(C)C#N Amb18642348 [0,1,0,0,0,0|1,0,1]=3 1917 B8R0.6 CCCCCC(C)CBr Amb26013045 [0,1,0,0,0,0|1,0,1]=3 1918 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|1,0,1]=3 1919 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|1,0,1]=3 1920 B8R0.6 CCCCCC(C)CN Amb27624450 [0,1,0,0,0,0|1,0,1]=3 1921 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|0,0,2]=3 1922 B8R0.6 CCCCCC(C)NC Amb3939451 [0,1,0,0,0,0|2,0,0]=3 1923 B8R0.6 CCCCCC(C)[Zn]Br Amb22000405 [0,1,0,0,0,0|2,0,0]=3 1924 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,1,0,0,0,0|0,0,0]=1 1925 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|1,0,1]=3 1926 B8R0.6 CCCCCC(Cl)CN Amb28410342 [0,1,0,0,0,0|1,0,1]=3 1927 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|1,0,1]=3 1928 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|0,0,2]=3 1929 B8R0.6 CCCCCC(O)C#N Amb9295066 [0,1,0,0,0,0|1,0,1]=3 1930 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,1,0,0,0,0|0,0,0]=1 1931 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|1,0,1]=3 1932 B8R0.6 CCCCCC(O)CN Amb8630208 [0,1,0,0,0,0|1,0,1]=3 1933 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|0,0,2]=3 1934 B8R0.6 CCCCCC(O)CS Amb27404970 [0,1,0,0,0,0|0,1,1]=3 1935 B8R0.6 CCCCCC(S)CN Amb27469627 [0,1,0,0,0,0|1,0,1]=3 1936 B8R0.6 CCCCCN(C)CC Amb27809466 [0,1,0,0,0,0|2,0,1]=4 1937 B8R0.6 CCCCCN(C)N=O Amb10070585 [0,1,0,0,0,0|2,0,0]=3 1938 B8R0.6 CCCCC[C@@H](C)C=O Amb28351479 [0,1,0,0,0,0|0,0,0]=1 1939 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [0,1,0,0,0,0|0,0,2]=3 1940 B8R0.6 CCCCC[C@@H](O)C#N Amb27593479 [0,1,0,0,0,0|1,0,1]=3 1941 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|1,0,1]=3 1942 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [0,1,0,0,0,0|0,0,2]=3 1943 B8R0.6 CCCCC[C@H](Cl)C=O Amb28400198 [0,1,0,0,0,0|0,0,0]=1 1944 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [0,1,0,0,0,0|0,0,0]=1 1945 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|1,0,1]=3 1946 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [0,1,0,0,0,0|0,0,2]=3 1947 B8R0.6 CCCCC\C(C)=C\Br Amb27831352 [0,1,0,0,0,0|1,0,1]=3 1948 B8R0.6 CCCCC\C(C)=N\N Amb28400606 [0,1,0,0,0,0|2,0,1]=4 1949 B8R0.6 CCCCC\C(C)=N\O Amb22338237 [0,1,0,0,0,0|1,0,2]=4 1950 B8R0.6 CCCCC\C(F)=C/Br Amb27983714 [0,1,0,0,0,0|1,0,1]=3 1951 B8R0.6 CCCCC\C(N)=N/N Amb2696449 [0,1,0,0,0,0|2,0,1]=4 1952 B8R0.6 CCCCNC(C)C#N Amb17044849 [0,1,0,0,0,0|2,0,1]=4 1953 B8R0.6 CCCCNC(C)CBr Amb27652350 [0,1,0,0,0,0|2,0,1]=4 1954 B8R0.6 CCCCNC(C)CC Amb6608873 [0,1,0,0,0,0|2,0,1]=4 1955 B8R0.6 CCCCN[C@@H](C)CN Amb27272617 [0,1,0,0,0,0|2,0,1]=4 1956 B8R0.6 CCCCN[C@H](C)CN Amb27236730 [0,1,0,0,0,0|2,0,1]=4 1957 B8R0.6 CCCCOC(=O)C=O Amb3941041 [0,1,0,0,0,0|1,0,1]=3 1958 B8R0.6 CCCCOC(C)C#N Amb28049084 [0,1,0,0,0,0|2,0,1]=4 1959 B8R0.6 CCCCOC(C)CBr Amb27985886 [0,1,0,0,0,0|2,0,1]=4 1960 B8R0.6 CCCCOC(C)CCl Amb27777639 [0,1,0,0,0,0|2,0,1]=4 1961 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|1,0,2]=4 1962 B8R0.6 CCCCOC(O)CC Amb28429916 [0,1,0,0,0,0|2,0,1]=4 1963 B8R0.6 CCCCO[C@@H](C)CBr Amb28285274 [0,1,0,0,0,0|2,0,1]=4 1964 B8R0.6 CCCCO[C@@H](C)CO Amb27631909 [0,1,0,0,0,0|1,0,2]=4 1965 B8R0.6 CCCCO\C(Cl)=C/Cl Amb27792254 [0,1,0,0,0,0|2,0,1]=4 1966 B8R0.6 CCCCSC(C)CC Amb4017931 [0,1,0,0,0,0|2,0,1]=4 1967 B8R0.6 CCCC\C=C(/Br)C=O Amb28130465 [0,1,0,0,0,0|0,0,2]=3 1968 B8R0.6 CCCC\C=C(/Cl)C=O Amb27949654 [0,1,0,0,0,0|0,0,2]=3 1969 B8R0.6 CCCC\C=C(\Br)C=O Amb28196734 [0,1,0,0,0,0|0,0,2]=3 1970 B8R0.6 CCCNCC(C)C#N Amb9024084 [0,1,0,0,0,0|2,0,1]=4 1971 B8R0.6 CCCNCC(C)CCl Amb27976521 [0,1,0,0,0,0|2,0,1]=4 1972 B8R0.6 CCCNCC(C)NC Amb27837459 [0,1,0,0,0,0|3,0,0]=4 1973 B8R0.6 CCCNCC(Cl)CC Amb27856521 [0,1,0,0,0,0|2,0,1]=4 1974 B8R0.6 CCCNCC(N)CC Amb25918794 [0,1,0,0,0,0|2,0,1]=4 1975 B8R0.6 CCCNCC(O)CCl Amb27267938 [0,1,0,0,0,0|2,0,1]=4 1976 B8R0.6 CCCNCC(O)CF Amb28254417 [0,1,0,0,0,0|2,0,1]=4 1977 B8R0.6 CCCNCC(O)CO Amb8854777 [0,1,0,0,0,0|1,0,2]=4 1978 B8R0.6 CCCNC[C@@H](O)CC Amb27662024 [0,1,0,0,0,0|2,0,1]=4 1979 B8R0.6 CCCNC[C@@H](O)CO Amb33041826 [0,1,0,0,0,0|1,0,2]=4 1980 B8R0.6 CCCNC\C(C)=C\Cl Amb27842024 [0,1,0,0,0,0|2,0,1]=4 1981 B8R0.6 CCCNC\C(Cl)=C\Cl Amb27795480 [0,1,0,0,0,0|2,0,1]=4 1982 B8R0.6 CCCOCC(Br)CCl Amb28367013 [0,1,0,0,0,0|2,0,1]=4 1983 B8R0.6 CCCOCC(C)C=O Amb28241425 [0,1,0,0,0,0|1,0,0]=2 1984 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,0,1]=4 1985 B8R0.6 CCCOCC(C)CCl Amb26053445 [0,1,0,0,0,0|2,0,1]=4 1986 B8R0.6 CCCOCC(C)CS Amb27834985 [0,1,0,0,0,0|1,1,1]=4 1987 B8R0.6 CCCOCC(C)NN Amb27648579 [0,1,0,0,0,0|3,0,0]=4 1988 B8R0.6 CCCOCC(Cl)CBr Amb27391140 [0,1,0,0,0,0|2,0,1]=4 1989 B8R0.6 CCCOCC(Cl)CCl Amb27657524 [0,1,0,0,0,0|2,0,1]=4 1990 B8R0.6 CCCOCC(N)CC Amb17485992 [0,1,0,0,0,0|2,0,1]=4 1991 B8R0.6 CCCOCC(N)CN Amb28312993 [0,1,0,0,0,0|2,0,1]=4 1992 B8R0.6 CCCOCC(O)CCl Amb28144574 [0,1,0,0,0,0|2,0,1]=4 1993 B8R0.6 CCCOCC(O)CO Amb10071476 [0,1,0,0,0,0|1,0,2]=4 1994 B8R0.6 CCCOC[C@@H](N)CC Amb27804406 [0,1,0,0,0,0|2,0,1]=4 1995 B8R0.6 CCCOC[C@H](N)CC Amb28139029 [0,1,0,0,0,0|2,0,1]=4 1996 B8R0.6 CCCOC[C@H](O)CO Amb28049195 [0,1,0,0,0,0|1,0,2]=4 1997 B8R0.6 CCCO\C=C(/Br)C=O Amb27224779 [0,1,0,0,0,0|1,0,2]=4 1998 B8R0.6 CCCO\C=C(\C)C=O Amb27789567 [0,1,0,0,0,0|1,0,2]=4 1999 B8R0.6 CCCSCC(C)CBr Amb28122637 [0,1,0,0,0,0|2,0,1]=4 2000 B8R0.6 CCCSCC(C)CS Amb27981763 [0,1,0,0,0,0|1,1,1]=4 2001 B8R0.6 CCCSCC(F)CC Amb28190116 [0,1,0,0,0,0|2,0,1]=4 2002 B8R0.6 CCCSCC(N)CC Amb17485961 [0,1,0,0,0,0|2,0,1]=4 2003 B8R0.6 CCCSCC(N)CO Amb28364274 [0,1,0,0,0,0|1,0,2]=4 2004 B8R0.6 CCCSCC(O)CC Amb28049075 [0,1,0,0,0,0|2,0,1]=4 2005 B8R0.6 CCCSCC(O)CO Amb27858570 [0,1,0,0,0,0|1,0,2]=4 2006 B8R0.6 CCCSC[C@@H](O)CC Amb27956460 [0,1,0,0,0,0|2,0,1]=4 2007 B8R0.6 CCCS\C=C(\C)C=O Amb27467800 [0,1,0,0,0,0|1,0,2]=4 2008 B8R0.6 CCC\C=C\C(C)C=O Amb33424834 [0,1,0,0,0,0|0,0,2]=3 2009 B8R0.6 CCN(C)CCCON Amb27421049 [0,1,0,0,0,0|3,0,0]=4 2010 B8R0.6 CCNCCC(O)CC Amb27483130 [0,1,0,0,0,0|2,0,1]=4 2011 B8R0.6 CCNCC\C(C)=C\Cl Amb27853590 [0,1,0,0,0,0|2,0,1]=4 2012 B8R0.6 CCOCCC(Br)CCl Amb27440196 [0,1,0,0,0,0|2,0,1]=4 2013 B8R0.6 CCOCCC(C)CBr Amb24552402 [0,1,0,0,0,0|2,0,1]=4 2014 B8R0.6 CCOCCC(C)CCl Amb24478711 [0,1,0,0,0,0|2,0,1]=4 2015 B8R0.6 CCOCCC(C)NN Amb27882631 [0,1,0,0,0,0|3,0,0]=4 2016 B8R0.6 CCOCCC(Cl)CBr Amb27262848 [0,1,0,0,0,0|2,0,1]=4 2017 B8R0.6 CCOCCC(Cl)CCl Amb28458365 [0,1,0,0,0,0|2,0,1]=4 2018 B8R0.6 CCOCCC(Cl)CO Amb28118931 [0,1,0,0,0,0|1,0,2]=4 2019 B8R0.6 CCOCCC(N)C#N Amb19036819 [0,1,0,0,0,0|2,0,1]=4 2020 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [0,1,0,0,0,0|1,0,2]=4 2021 B8R0.6 CCOCC[C@H](N)CS Amb28247584 [0,1,0,0,0,0|1,1,1]=4 2022 B8R0.6 CCSCCC(C)CBr Amb25112497 [0,1,0,0,0,0|2,0,1]=4 2023 B8R0.6 CCSCCC(C)CCl Amb25829491 [0,1,0,0,0,0|2,0,1]=4 2024 B8R0.6 CCSCCC(C)NC Amb19149279 [0,1,0,0,0,0|3,0,0]=4 2025 B8R0.6 CCSCCC(Cl)C#N Amb28384649 [0,1,0,0,0,0|2,0,1]=4 2026 B8R0.6 CCSCCC(N)C#N Amb19036835 [0,1,0,0,0,0|2,0,1]=4 2027 B8R0.6 CCSCCC(N)CN Amb27392673 [0,1,0,0,0,0|2,0,1]=4 2028 B8R0.6 CCSCCC(N)CO Amb25820753 [0,1,0,0,0,0|1,0,2]=4 2029 B8R0.6 CCSCCC(O)C#N Amb27985378 [0,1,0,0,0,0|2,0,1]=4 2030 B8R0.6 CCSCCC(O)CN Amb24581930 [0,1,0,0,0,0|2,0,1]=4 2031 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|0,0,2]=3 2032 B8R0.6 CC[C@@H](N)CCCOC Amb27180543 [0,1,0,0,0,0|2,0,0]=3 2033 B8R0.6 CC[C@@H](N)CNCCF Amb27187234 [0,1,0,0,0,0|2,0,1]=4 2034 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|0,0,2]=3 2035 B8R0.6 CC[C@H](C)OCCCBr Amb27477872 [0,1,0,0,0,0|2,0,1]=4 2036 B8R0.6 CC[C@H](C)OCCCO Amb28315453 [0,1,0,0,0,0|1,0,2]=4 2037 B8R0.6 CC\C(C)=C\CCC=O Amb28131737 [0,1,0,0,0,0|0,0,2]=3 2038 B8R0.6 CC\C=C/CC(Cl)C=O Amb27424637 [0,1,0,0,0,0|0,0,2]=3 2039 B8R0.6 CC\C=C/C[C@H](Br)C=O Amb28125055 [0,1,0,0,0,0|0,0,2]=3 2040 B8R0.6 CC\C=C\CC(C)C=O Amb27255568 [0,1,0,0,0,0|0,0,2]=3 2041 B8R0.6 CC\C=C\CC(Cl)C=O Amb26924259 [0,1,0,0,0,0|0,0,2]=3 2042 B8R0.6 CN(C=O)CCCCO Amb27434543 [0,1,0,0,0,0|2,0,0]=3 2043 B8R0.6 CN(CCCC=O)N=O Amb27966682 [0,1,0,0,0,0|3,0,0]=4 2044 B8R0.6 CN(CCCCO)N=O Amb25709435 [0,1,0,0,0,0|3,0,0]=4 2045 B8R0.6 CNC(=S)SCCC=O Amb27790916 [0,1,0,0,0,0|2,0,1]=4 2046 B8R0.6 CNC(C)CCCCBr Amb28072213 [0,1,0,0,0,0|2,0,1]=4 2047 B8R0.6 CNC(C)CCCCCl Amb28058471 [0,1,0,0,0,0|2,0,1]=4 2048 B8R0.6 CNC(C)CCCCO Amb17569927 [0,1,0,0,0,0|1,0,2]=4 2049 B8R0.6 CNC(C)CCCOC Amb17569939 [0,1,0,0,0,0|3,0,0]=4 2050 B8R0.6 CNC(C)CCCSC Amb28135937 [0,1,0,0,0,0|3,0,0]=4 2051 B8R0.6 CNCCCC(C)OC Amb17569936 [0,1,0,0,0,0|3,0,0]=4 2052 B8R0.6 COC(C)CCCC=O Amb28285296 [0,1,0,0,0,0|1,0,0]=2 2053 B8R0.6 COC(C)CCCCCl Amb27881913 [0,1,0,0,0,0|2,0,1]=4 2054 B8R0.6 COC(C)CCN=C=O Amb27616134 [0,1,0,0,0,0|2,0,1]=4 2055 B8R0.6 COC(C)C\C=C\C=O Amb27647018 [0,1,0,0,0,0|1,0,2]=4 2056 B8R0.6 COCCCC(C)C=O Amb28118341 [0,1,0,0,0,0|1,0,0]=2 2057 B8R0.6 COCCCC(C)CBr Amb24692425 [0,1,0,0,0,0|2,0,1]=4 2058 B8R0.6 COCCCC(C)CCl Amb24340257 [0,1,0,0,0,0|2,0,1]=4 2059 B8R0.6 COCCCC(C)CN Amb17569944 [0,1,0,0,0,0|2,0,1]=4 2060 B8R0.6 COCCCC(Cl)C=O Amb28146758 [0,1,0,0,0,0|1,0,0]=2 2061 B8R0.6 COCCCC(N)CO Amb26550641 [0,1,0,0,0,0|1,0,2]=4 2062 B8R0.6 COCCCC(O)CN Amb26323215 [0,1,0,0,0,0|2,0,1]=4 2063 B8R0.6 COCCCC(O)CO Amb27588922 [0,1,0,0,0,0|1,0,2]=4 2064 B8R0.6 COCOCC(C)C=O Amb27185793 [0,1,0,0,0,0|2,0,0]=3 2065 B8R0.6 CSCCCC(C)C=O Amb27973193 [0,1,0,0,0,0|1,0,0]=2 2066 B8R0.6 CSCCCC(C)CBr Amb25936940 [0,1,0,0,0,0|2,0,1]=4 2067 B8R0.6 CSCCCC(C)CCl Amb25333579 [0,1,0,0,0,0|2,0,1]=4 2068 B8R0.6 CSCCCC(C)CN Amb27863048 [0,1,0,0,0,0|2,0,1]=4 2069 B8R0.6 CSCCCC(N)C#N Amb27202675 [0,1,0,0,0,0|2,0,1]=4 2070 B8R0.6 CSCCCC(N)CO Amb25888586 [0,1,0,0,0,0|1,0,2]=4 2071 B8R0.6 CSCCCC(O)CN Amb25809175 [0,1,0,0,0,0|2,0,1]=4 2072 B8R0.6 CSCCOC(=O)C=O Amb27645544 [0,1,0,0,0,0|2,0,1]=4 2073 B8R0.6 C[C@H](C=O)CCCC=O Amb28388637 [0,1,0,0,0,0|1,0,1]=3 2074 B8R0.6 C[C@H](CO)CCCCO Amb27804560 [0,1,0,0,0,0|1,0,2]=4 2075 B8R0.6 C\C(=C/CCC=O)CO Amb28248122 [0,1,0,0,0,0|1,0,2]=4 2076 B8R0.6 C\C(=C\CCC=O)CO Amb18642621 [0,1,0,0,0,0|1,0,2]=4 2077 B8R0.6 C\C=C(/C)CCCCO Amb28385373 [0,1,0,0,0,0|2,0,1]=4 2078 B8R0.6 C\C=C(\C)CCCCBr Amb26877158 [0,1,0,0,0,0|2,0,1]=4 2079 B8R0.6 C\C=C/CCC(C)C=O Amb27798224 [0,1,0,0,0,0|0,0,2]=3 2080 B8R0.6 C\C=C\CCC(C)CO Amb27662361 [0,1,0,0,0,0|2,0,1]=4 2081 B8R0.6 C\C=C\CNC(C)CC Amb10608180 [0,1,0,0,0,0|2,0,1]=4 2082 B8R0.6 C\C=C\CNC(C)CC Amb22587168 [0,1,0,0,0,0|2,0,1]=4 2083 B8R0.6 C\C=C\CSC(C)CC Amb27615013 [0,1,0,0,0,0|2,0,1]=4 2084 B8R0.6 N#CC(N)CCCCN Amb24477887 [0,1,0,0,0,0|2,0,1]=4 2085 B8R0.6 N#CC(O)CCCCO Amb17593356 [0,1,0,0,0,0|2,0,1]=4 2086 B8R0.6 N#CCCCC(O)CBr Amb27653070 [0,1,0,0,0,0|2,0,1]=4 2087 B8R0.6 N#CCCC[C@H](O)CO Amb27805249 [0,1,0,0,0,0|2,0,1]=4 2088 B8R0.6 NCC(O)CCCCBr Amb27956026 [0,1,0,0,0,0|2,0,1]=4 2089 B8R0.6 NCCCCC(N)CN Amb27602480 [0,1,0,0,0,0|2,0,1]=4 2090 B8R0.6 NCCCCC(N)CO Amb27403112 [0,1,0,0,0,0|1,0,2]=4 2091 B8R0.6 NCCCCC(N)CS Amb27409203 [0,1,0,0,0,0|1,1,1]=4 2092 B8R0.6 NCCCC[C@H](N)C=O Amb27230236 [0,1,0,0,0,0|1,0,0]=2 2093 B8R0.6 NCCCC[C@H](N)CN Amb27173098 [0,1,0,0,0,0|2,0,1]=4 2094 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [0,1,0,0,0,0|1,0,2]=4 2095 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [0,1,0,0,0,0|1,0,2]=4 2096 B8R0.6 NC[C@H](O)CCCCBr Amb27165807 [0,1,0,0,0,0|2,0,1]=4 2097 B8R0.6 O=CCSCC(O)CO Amb27249896 [0,1,0,0,0,0|2,0,0]=3 2098 B8R0.6 O=C\C(F)=C\CCCCl Amb28429849 [0,1,0,0,0,0|1,0,2]=4 2099 B8R0.6 OC(CCl)CCCCCl Amb27490964 [0,1,0,0,0,0|2,0,1]=4 2100 B8R0.6 OC(CS)CCCCS Amb27487018 [0,1,0,0,0,0|1,1,1]=4 2101 B8R0.6 OCC(O)CCCCBr Amb27444663 [0,1,0,0,0,0|1,0,2]=4 2102 B8R0.6 OCCCCC(O)CBr Amb27219046 [0,1,0,0,0,0|1,0,2]=4 2103 B8R0.6 OCCCCC(O)CO Amb8513368 [0,1,0,0,0,0|1,0,2]=4 2104 B8R0.7 C#CCCCCC(=O)Cl Amb28312904 [0,1,0,0,0,0|0,0,2]=3 2105 B8R0.7 C#CCCCCC(=O)O Amb2721485 [0,1,0,0,0,0|0,0,2]=3 2106 B8R0.7 C#CCCCCC(C)C Amb24628581 [0,1,0,0,0,0|1,0,1]=3 2107 B8R0.7 C#CCCCCN(C)C Amb18116187 [0,1,0,0,0,0|2,0,1]=4 2108 B8R0.7 C#CCCCC[C@@H](C)O Amb27207329 [0,1,0,0,0,0|1,0,1]=3 2109 B8R0.7 C#CCCCC[C@H](C)O Amb28315512 [0,1,0,0,0,0|1,0,1]=3 2110 B8R0.7 C#CCCCNC(C)C Amb19025020 [0,1,0,0,0,0|2,0,1]=4 2111 B8R0.7 C#CCCCOC(C)C Amb33473565 [0,1,0,0,0,0|2,0,1]=4 2112 B8R0.7 C#CCCCSC(C)C Amb27219646 [0,1,0,0,0,0|2,0,1]=4 2113 B8R0.7 C#CCCNC[C@@H](C)O Amb27790440 [0,1,0,0,0,0|2,0,1]=4 2114 B8R0.7 C#CCCNC[C@H](C)O Amb27626433 [0,1,0,0,0,0|2,0,1]=4 2115 B8R0.7 C#CCCOCC(=O)O Amb28118359 [0,1,0,0,0,0|1,0,2]=4 2116 B8R0.7 C#CCCSCC(C)=O Amb27218867 [0,1,0,0,0,0|1,0,2]=4 2117 B8R0.7 C#CCCSCC(C)N Amb28183141 [0,1,0,0,0,0|2,0,1]=4 2118 B8R0.7 C#CCNCCC(C)C Amb6683588 [0,1,0,0,0,0|2,0,1]=4 2119 B8R0.7 C#CCOCCC(=O)O Amb9208654 [0,1,0,0,0,0|1,0,2]=4 2120 B8R0.7 C#CCOCCC(N)=O Amb27837665 [0,1,0,0,0,0|1,0,2]=4 2121 B8R0.7 C#CCSCCC(C)=O Amb27946691 [0,1,0,0,0,0|1,0,2]=4 2122 B8R0.7 C#CCSCCC(C)C Amb27493954 [0,1,0,0,0,0|2,0,1]=4 2123 B8R0.7 C#CCSCCC(N)=O Amb27856148 [0,1,0,0,0,0|1,0,2]=4 2124 B8R0.7 C=C(Br)CCCCC=O Amb28200066 [0,1,0,0,0,0|0,0,2]=3 2125 B8R0.7 C=C(Br)CCNCCO Amb27616621 [0,1,0,0,0,0|3,0,0]=4 2126 B8R0.7 C=C(Br)CNCCCF Amb27169577 [0,1,0,0,0,0|3,0,0]=4 2127 B8R0.7 C=C(Br)CNCCCN Amb18330318 [0,1,0,0,0,0|3,0,0]=4 2128 B8R0.7 C=C(Br)CNOCCC Amb27824492 [0,1,0,0,0,0|3,0,0]=4 2129 B8R0.7 C=C(Br)COCCCC Amb27956559 [0,1,0,0,0,0|2,0,0]=3 2130 B8R0.7 C=C(Br)COCCNC Amb18324681 [0,1,0,0,0,0|3,0,0]=4 2131 B8R0.7 C=C(Br)CSCCCF Amb27827023 [0,1,0,0,0,0|3,0,0]=4 2132 B8R0.7 C=C(C)C#CCCCC Amb27602312 [0,1,0,0,0,0|1,0,2]=4 2133 B8R0.7 C=C(C)CCCCC#N Amb6298906 [0,1,0,0,0,0|1,0,2]=4 2134 B8R0.7 C=C(C)CCCCC=O Amb27750320 [0,1,0,0,0,0|0,0,1]=2 2135 B8R0.7 C=C(C)CCCCCBr Amb28436917 [0,1,0,0,0,0|2,0,0]=3 2136 B8R0.7 C=C(C)CCCCCC Amb6298939 [0,1,0,0,0,0|1,0,0]=2 2137 B8R0.7 C=C(C)CCCCCO Amb27641867 [0,1,0,0,0,0|2,0,0]=3 2138 B8R0.7 C=C(C)CCNCCC Amb27813957 [0,1,0,0,0,0|2,0,0]=3 2139 B8R0.7 C=C(C)CCOCCBr Amb27242287 [0,1,0,0,0,0|3,0,0]=4 2140 B8R0.7 C=C(C)CCSCCN Amb28123809 [0,1,0,0,0,0|3,0,0]=4 2141 B8R0.7 C=C(C)CC\C=C\C=O Amb18642228 [0,1,0,0,0,0|0,0,3]=4 2142 B8R0.7 C=C(C)CNCCCC Amb17308646 [0,1,0,0,0,0|2,0,0]=3 2143 B8R0.7 C=C(C)CNCCCF Amb27494348 [0,1,0,0,0,0|3,0,0]=4 2144 B8R0.7 C=C(C)CNCCCN Amb28044366 [0,1,0,0,0,0|3,0,0]=4 2145 B8R0.7 C=C(C)CNCCCO Amb28285230 [0,1,0,0,0,0|3,0,0]=4 2146 B8R0.7 C=C(C)CNCCNC Amb28457188 [0,1,0,0,0,0|3,0,0]=4 2147 B8R0.7 C=C(C)COCCCC Amb22641495 [0,1,0,0,0,0|2,0,0]=3 2148 B8R0.7 C=C(C)COCCCN Amb28123400 [0,1,0,0,0,0|3,0,0]=4 2149 B8R0.7 C=C(C)COCCNC Amb27217708 [0,1,0,0,0,0|3,0,0]=4 2150 B8R0.7 C=C(C)CONCCC Amb28074460 [0,1,0,0,0,0|3,0,0]=4 2151 B8R0.7 C=C(C)CSCCCC Amb9787751 [0,1,0,0,0,0|2,0,0]=3 2152 B8R0.7 C=C(C)CSCCNC Amb28250295 [0,1,0,0,0,0|3,0,0]=4 2153 B8R0.7 C=C(Cl)CCCCC#N Amb6298896 [0,1,0,0,0,0|2,0,1]=4 2154 B8R0.7 C=C(Cl)CCCCCCl Amb6298881 [0,1,0,0,0,0|2,0,0]=3 2155 B8R0.7 C=C(Cl)CNCCCF Amb27835297 [0,1,0,0,0,0|3,0,0]=4 2156 B8R0.7 C=C(Cl)CNCCSC Amb27783779 [0,1,0,0,0,0|3,0,0]=4 2157 B8R0.7 C=C(Cl)COCCCN Amb28197915 [0,1,0,0,0,0|3,0,0]=4 2158 B8R0.7 C=C(Cl)CSCCCF Amb27783661 [0,1,0,0,0,0|3,0,0]=4 2159 B8R0.7 C=C(Cl)CSCCCS Amb27401749 [0,1,0,0,0,0|3,0,0]=4 2160 B8R0.7 C=C(Cl)CSCCNC Amb27421610 [0,1,0,0,0,0|3,0,0]=4 2161 B8R0.7 C=C(Cl)CSCCOC Amb28281528 [0,1,0,0,0,0|3,0,0]=4 2162 B8R0.7 C=C(F)CNCCOC Amb27632960 [0,1,0,0,0,0|3,0,0]=4 2163 B8R0.7 C=C=CCCCC(C)O Amb28315442 [0,1,0,0,0,0|1,0,2]=4 2164 B8R0.7 C=CCCC#CC(C)O Amb28205995 [0,1,0,0,0,0|1,0,2]=4 2165 B8R0.7 C=CCCCCB(O)O Amb20171333 [0,1,0,0,0,0|3,0,0]=4 2166 B8R0.7 C=CCCCCC(=O)O Amb6299578 [0,1,0,0,0,0|0,0,2]=3 2167 B8R0.7 C=CCCCCC(C)=O Amb24546961 [0,1,0,0,0,0|0,0,2]=3 2168 B8R0.7 C=CCCCCC(C)C Amb27180770 [0,1,0,0,0,0|1,0,0]=2 2169 B8R0.7 C=CCCCCC(C)N Amb22059559 [0,1,0,0,0,0|1,0,0]=2 2170 B8R0.7 C=CCCCCC(N)=O Amb27236725 [0,1,0,0,0,0|0,0,2]=3 2171 B8R0.7 C=CCCCCC(N)=S Amb27950014 [0,1,0,0,0,0|0,1,2]=4 2172 B8R0.7 C=CCCCCN(C)O Amb27626977 [0,1,0,0,0,0|2,0,0]=3 2173 B8R0.7 C=CCCCC[N+](=O)[O-] Amb9825999 [0,1,0,0,0,0|1,0,2]=4 2174 B8R0.7 C=CCCCOC(C)=O Amb6366589 [0,1,0,0,0,0|1,0,2]=4 2175 B8R0.7 C=CCCCSC(C)C Amb27588742 [0,1,0,0,0,0|2,0,0]=3 2176 B8R0.7 C=CCCNCC(=C)C Amb27602001 [0,1,0,0,0,0|2,0,1]=4 2177 B8R0.7 C=CCCNCC(F)F Amb27666485 [0,1,0,0,0,0|3,0,0]=4 2178 B8R0.7 C=CCCNCC(N)=O Amb33545653 [0,1,0,0,0,0|1,0,2]=4 2179 B8R0.7 C=CCCOCC(=O)O Amb7793843 [0,1,0,0,0,0|1,0,2]=4 2180 B8R0.7 C=CCCOCC(C)=O Amb27465238 [0,1,0,0,0,0|1,0,2]=4 2181 B8R0.7 C=CCCSCC(=O)O Amb27810806 [0,1,0,0,0,0|1,0,2]=4 2182 B8R0.7 C=CCCSCC(C)N Amb28060754 [0,1,0,0,0,0|2,0,0]=3 2183 B8R0.7 C=CCNCCC(=O)O Amb33527032 [0,1,0,0,0,0|1,0,2]=4 2184 B8R0.7 C=CCNCCC(=O)O Amb7755724 [0,1,0,0,0,0|1,0,2]=4 2185 B8R0.7 C=CCNCCC(N)=O Amb8841114 [0,1,0,0,0,0|1,0,2]=4 2186 B8R0.7 C=CCOCCC(N)=O Amb27844989 [0,1,0,0,0,0|1,0,2]=4 2187 B8R0.7 C=CCOCCN(C)C Amb27243517 [0,1,0,0,0,0|3,0,0]=4 2188 B8R0.7 C=CCONCC(C)C Amb27859587 [0,1,0,0,0,0|3,0,0]=4 2189 B8R0.7 C=CCONCC(C)O Amb27424413 [0,1,0,0,0,0|3,0,0]=4 2190 B8R0.7 C=CCONC[C@H](C)O Amb27244019 [0,1,0,0,0,0|3,0,0]=4 2191 B8R0.7 C=CCSCCC(=C)C Amb27208748 [0,1,0,0,0,0|2,0,1]=4 2192 B8R0.7 C=CCSCCC(C)O Amb28315462 [0,1,0,0,0,0|2,0,0]=3 2193 B8R0.7 C=CCSSCC(C)C Amb27782635 [0,1,0,0,0,0|3,0,0]=4 2194 B8R0.7 C=COCCCC(C)C Amb28325207 [0,1,0,0,0,0|2,0,0]=3 2195 B8R0.7 C=NCCCNC(C)=O Amb27950176 [0,1,0,0,0,0|2,0,1]=4 2196 B8R0.7 CC#CCCCC(=O)O Amb28046337 [0,1,0,0,0,0|0,0,2]=3 2197 B8R0.7 CC#CCCCC(N)=O Amb27853693 [0,1,0,0,0,0|0,0,2]=3 2198 B8R0.7 CC#CCCC[C@H](C)N Amb27596063 [0,1,0,0,0,0|1,0,2]=4 2199 B8R0.7 CC#CCNCC(=O)O Amb28410306 [0,1,0,0,0,0|1,0,2]=4 2200 B8R0.7 CC#CCOCC(C)=O Amb25112537 [0,1,0,0,0,0|1,0,2]=4 2201 B8R0.7 CC#CCSCC(C)=O Amb27411694 [0,1,0,0,0,0|1,0,2]=4 2202 B8R0.7 CC(=O)CCC#CCCl Amb28203937 [0,1,0,0,0,0|1,0,2]=4 2203 B8R0.7 CC(=O)CCC#CCO Amb27867270 [0,1,0,0,0,0|1,0,2]=4 2204 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,1,0,0,0,0|1,0,1]=3 2205 B8R0.7 CC(=O)CCCCCBr Amb27401578 [0,1,0,0,0,0|1,0,0]=2 2206 B8R0.7 CC(=O)CCCCCCl Amb26591097 [0,1,0,0,0,0|1,0,0]=2 2207 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,1,0,0,0,0|1,0,0]=2 2208 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,1,0,0,0,0|1,0,0]=2 2209 B8R0.7 CC(=O)CCCCCO Amb27237283 [0,1,0,0,0,0|1,0,0]=2 2210 B8R0.7 CC(=O)CCCN=[N+]=[N-] Amb28457742 [0,1,0,0,0,0|3,0,0]=4 2211 B8R0.7 CC(=O)CCCOC=O Amb1033032 [0,1,0,0,0,0|1,0,1]=3 2212 B8R0.7 CC(=O)CCCSC#N Amb26984900 [0,1,0,0,0,0|2,0,1]=4 2213 B8R0.7 CC(=O)CCC\C=C\Cl Amb26336040 [0,1,0,0,0,0|1,0,2]=4 2214 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,1,0,0,0,0|2,0,0]=3 2215 B8R0.7 CC(=O)CCOCCBr Amb32651831 [0,1,0,0,0,0|2,0,0]=3 2216 B8R0.7 CC(=O)CCOCCCl Amb27982282 [0,1,0,0,0,0|2,0,0]=3 2217 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,1,0,0,0,0|2,0,0]=3 2218 B8R0.7 CC(=O)CCSCC#N Amb18927970 [0,1,0,0,0,0|2,0,1]=4 2219 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [0,1,0,0,0,0|1,0,2]=4 2220 B8R0.7 CC(=O)CC\C=C\C=O Amb26875051 [0,1,0,0,0,0|0,0,3]=4 2221 B8R0.7 CC(=O)COCCCN Amb18630475 [0,1,0,0,0,0|2,0,0]=3 2222 B8R0.7 CC(=O)CSCCCF Amb28065634 [0,1,0,0,0,0|2,0,0]=3 2223 B8R0.7 CC(=O)C\C=C\CCCl Amb25729220 [0,1,0,0,0,0|1,0,2]=4 2224 B8R0.7 CC(=O)NCCCC#N Amb28049789 [0,1,0,0,0,0|2,0,1]=4 2225 B8R0.7 CC(=O)NCCCCCl Amb25883586 [0,1,0,0,0,0|2,0,0]=3 2226 B8R0.7 CC(=O)NCCCCF Amb27180576 [0,1,0,0,0,0|2,0,0]=3 2227 B8R0.7 CC(=O)NCCCCI Amb27768800 [0,1,0,0,0,0|2,0,0]=3 2228 B8R0.7 CC(=O)NCCCCN Amb17053700 [0,1,0,0,0,0|2,0,0]=3 2229 B8R0.7 CC(=O)NCCCCO Amb17102977 [0,1,0,0,0,0|2,0,0]=3 2230 B8R0.7 CC(=O)NCCCON Amb17138378 [0,1,0,0,0,0|3,0,0]=4 2231 B8R0.7 CC(=O)NCCCON Amb6308549 [0,1,0,0,0,0|3,0,0]=4 2232 B8R0.7 CC(=O)NOCCCF Amb28436015 [0,1,0,0,0,0|3,0,0]=4 2233 B8R0.7 CC(=O)NOCCCO Amb28205723 [0,1,0,0,0,0|3,0,0]=4 2234 B8R0.7 CC(=O)OCCCCBr Amb2725321 [0,1,0,0,0,0|2,0,0]=3 2235 B8R0.7 CC(=O)OCCCCCl Amb3940275 [0,1,0,0,0,0|2,0,0]=3 2236 B8R0.7 CC(=O)OCCCCI Amb2725257 [0,1,0,0,0,0|2,0,0]=3 2237 B8R0.7 CC(=O)OCCCCN Amb24657282 [0,1,0,0,0,0|2,0,0]=3 2238 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,1,0,0,0,0|2,0,0]=3 2239 B8R0.7 CC(=O)OCCNC=O Amb27212825 [0,1,0,0,0,0|2,0,1]=4 2240 B8R0.7 CC(=O)OCCOCBr Amb8395197 [0,1,0,0,0,0|3,0,0]=4 2241 B8R0.7 CC(=O)OCCSCCl Amb28122692 [0,1,0,0,0,0|3,0,0]=4 2242 B8R0.7 CC(=O)OCOCCBr Amb28458426 [0,1,0,0,0,0|3,0,0]=4 2243 B8R0.7 CC(=O)SCCCC#N Amb17607671 [0,1,0,0,0,0|2,0,1]=4 2244 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,1,0,0,0,0|1,0,1]=3 2245 B8R0.7 CC(=O)SCCCCBr Amb22641871 [0,1,0,0,0,0|2,0,0]=3 2246 B8R0.7 CC(=O)SCCCCN Amb24117263 [0,1,0,0,0,0|2,0,0]=3 2247 B8R0.7 CC(=O)SCCCCN Amb27429858 [0,1,0,0,0,0|2,0,0]=3 2248 B8R0.7 CC(Br)CCCCC#N Amb27831403 [0,1,0,0,0,0|1,0,1]=3 2249 B8R0.7 CC(C)=CCCCCBr Amb25933172 [0,1,0,0,0,0|2,0,1]=4 2250 B8R0.7 CC(C)=CCCCCCl Amb32688153 [0,1,0,0,0,0|2,0,1]=4 2251 B8R0.7 CC(C)=CCCCCN Amb28345726 [0,1,0,0,0,0|2,0,1]=4 2252 B8R0.7 CC(C)=CCCCCO Amb28315431 [0,1,0,0,0,0|2,0,1]=4 2253 B8R0.7 CC(C)=CCOCC=O Amb27643571 [0,1,0,0,0,0|1,0,2]=4 2254 B8R0.7 CC(C)=COCCC=O Amb18642665 [0,1,0,0,0,0|1,0,2]=4 2255 B8R0.7 CC(C)CCCCC#N Amb25079358 [0,1,0,0,0,0|1,0,1]=3 2256 B8R0.7 CC(C)CCCCC=O Amb18642674 [0,1,0,0,0,0|0,0,0]=1 2257 B8R0.7 CC(C)CCCCCBr Amb16231055 [0,1,0,0,0,0|1,0,1]=3 2258 B8R0.7 CC(C)CCCCCCl Amb27592473 [0,1,0,0,0,0|1,0,1]=3 2259 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|1,0,1]=3 2260 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|0,0,2]=3 2261 B8R0.7 CC(C)CCCN=C=O Amb27837447 [0,1,0,0,0,0|1,0,1]=3 2262 B8R0.7 CC(C)CCCN=[N+]=[N-] Amb24398841 [0,1,0,0,0,0|3,0,0]=4 2263 B8R0.7 CC(C)CCCNC#N Amb28324658 [0,1,0,0,0,0|2,0,1]=4 2264 B8R0.7 CC(C)CCNCC#N Amb6710514 [0,1,0,0,0,0|2,0,1]=4 2265 B8R0.7 CC(C)CCNCCBr Amb25721799 [0,1,0,0,0,0|2,0,1]=4 2266 B8R0.7 CC(C)CCNCCBr Amb32653537 [0,1,0,0,0,0|2,0,1]=4 2267 B8R0.7 CC(C)CCNCCI Amb28188514 [0,1,0,0,0,0|2,0,1]=4 2268 B8R0.7 CC(C)CCNCCO Amb4034535 [0,1,0,0,0,0|1,0,2]=4 2269 B8R0.7 CC(C)CCOCCBr Amb6255121 [0,1,0,0,0,0|2,0,1]=4 2270 B8R0.7 CC(C)CCOCCCl Amb9209784 [0,1,0,0,0,0|2,0,1]=4 2271 B8R0.7 CC(C)CCOCCI Amb27446465 [0,1,0,0,0,0|2,0,1]=4 2272 B8R0.7 CC(C)CCOCCN Amb6245091 [0,1,0,0,0,0|2,0,1]=4 2273 B8R0.7 CC(C)CCOCCO Amb10609610 [0,1,0,0,0,0|1,0,2]=4 2274 B8R0.7 CC(C)CCSCC=O Amb27215189 [0,1,0,0,0,0|1,0,0]=2 2275 B8R0.7 CC(C)CCSCCCl Amb24080319 [0,1,0,0,0,0|2,0,1]=4 2276 B8R0.7 CC(C)CCSCCN Amb6260831 [0,1,0,0,0,0|2,0,1]=4 2277 B8R0.7 CC(C)CNCCC#N Amb374806 [0,1,0,0,0,0|2,0,1]=4 2278 B8R0.7 CC(C)CNCCCBr Amb27401785 [0,1,0,0,0,0|2,0,1]=4 2279 B8R0.7 CC(C)CNCCCN Amb17315266 [0,1,0,0,0,0|2,0,1]=4 2280 B8R0.7 CC(C)CNCCCO Amb534463 [0,1,0,0,0,0|1,0,2]=4 2281 B8R0.7 CC(C)CN\C=C\C=O Amb27202960 [0,1,0,0,0,0|1,0,2]=4 2282 B8R0.7 CC(C)COCCC#N Amb6262948 [0,1,0,0,0,0|2,0,1]=4 2283 B8R0.7 CC(C)COCCC=O Amb28366423 [0,1,0,0,0,0|1,0,0]=2 2284 B8R0.7 CC(C)COCCCBr Amb8828212 [0,1,0,0,0,0|2,0,1]=4 2285 B8R0.7 CC(C)COCCCCl Amb6255740 [0,1,0,0,0,0|2,0,1]=4 2286 B8R0.7 CC(C)COCCCN Amb1154609 [0,1,0,0,0,0|2,0,1]=4 2287 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|1,0,2]=4 2288 B8R0.7 CC(C)COCCCS Amb27842108 [0,1,0,0,0,0|1,1,1]=4 2289 B8R0.7 CC(C)COCCON Amb28457759 [0,1,0,0,0,0|3,0,0]=4 2290 B8R0.7 CC(C)CO\C=C\C=O Amb18642618 [0,1,0,0,0,0|1,0,2]=4 2291 B8R0.7 CC(C)CSCCC=O Amb28043178 [0,1,0,0,0,0|1,0,0]=2 2292 B8R0.7 CC(C)CSCCCCl Amb9304955 [0,1,0,0,0,0|2,0,1]=4 2293 B8R0.7 CC(C)CSCCCN Amb9203029 [0,1,0,0,0,0|2,0,1]=4 2294 B8R0.7 CC(C)CSCCCO Amb9273779 [0,1,0,0,0,0|1,0,2]=4 2295 B8R0.7 CC(C)CSCCNN Amb27632086 [0,1,0,0,0,0|3,0,0]=4 2296 B8R0.7 CC(C)CSCCON Amb27421064 [0,1,0,0,0,0|3,0,0]=4 2297 B8R0.7 CC(C)NCCCCCl Amb27759406 [0,1,0,0,0,0|2,0,1]=4 2298 B8R0.7 CC(C)NCCCCF Amb27852540 [0,1,0,0,0,0|2,0,1]=4 2299 B8R0.7 CC(C)NCCCCN Amb17334116 [0,1,0,0,0,0|2,0,1]=4 2300 B8R0.7 CC(C)NCCCCO Amb17334129 [0,1,0,0,0,0|1,0,2]=4 2301 B8R0.7 CC(C)OCCCC#N Amb6267620 [0,1,0,0,0,0|2,0,1]=4 2302 B8R0.7 CC(C)OCCCC=O Amb26629850 [0,1,0,0,0,0|1,0,0]=2 2303 B8R0.7 CC(C)OCCCCBr Amb8855453 [0,1,0,0,0,0|2,0,1]=4 2304 B8R0.7 CC(C)OCCCCCl Amb18181677 [0,1,0,0,0,0|2,0,1]=4 2305 B8R0.7 CC(C)OCCCCN Amb6243226 [0,1,0,0,0,0|2,0,1]=4 2306 B8R0.7 CC(C)OCCCCO Amb24704996 [0,1,0,0,0,0|1,0,2]=4 2307 B8R0.7 CC(C)OCCCCS Amb27220452 [0,1,0,0,0,0|1,1,1]=4 2308 B8R0.7 CC(C)OCCCON Amb24725033 [0,1,0,0,0,0|3,0,0]=4 2309 B8R0.7 CC(C)OCCN=C=O Amb25888800 [0,1,0,0,0,0|2,0,1]=4 2310 B8R0.7 CC(C)OC\C=C\C=O Amb33274122 [0,1,0,0,0,0|1,0,2]=4 2311 B8R0.7 CC(C)SCCCC#N Amb17504230 [0,1,0,0,0,0|2,0,1]=4 2312 B8R0.7 CC(C)SCCCCBr Amb26443109 [0,1,0,0,0,0|2,0,1]=4 2313 B8R0.7 CC(C)SCCCCCl Amb18798740 [0,1,0,0,0,0|2,0,1]=4 2314 B8R0.7 CC(C)SCCCCN Amb17500947 [0,1,0,0,0,0|2,0,1]=4 2315 B8R0.7 CC(C)SCCCCO Amb28049080 [0,1,0,0,0,0|1,0,2]=4 2316 B8R0.7 CC(C)SCCCCS Amb27833171 [0,1,0,0,0,0|1,1,1]=4 2317 B8R0.7 CC(Cl)CCCCC=O Amb18643832 [0,1,0,0,0,0|0,0,0]=1 2318 B8R0.7 CC(Cl)CCCCCO Amb27656999 [0,1,0,0,0,0|0,0,2]=3 2319 B8R0.7 CC(Cl)CCOCCCl Amb27606700 [0,1,0,0,0,0|2,0,1]=4 2320 B8R0.7 CC(Cl)CNCCCCl Amb27637862 [0,1,0,0,0,0|2,0,1]=4 2321 B8R0.7 CC(Cl)CNC\C=C\Cl Amb27251205 [0,1,0,0,0,0|2,0,1]=4 2322 B8R0.7 CC(Cl)OCCCCCl Amb28383422 [0,1,0,0,0,0|2,0,1]=4 2323 B8R0.7 CC(F)CCCCCBr Amb27781575 [0,1,0,0,0,0|1,0,1]=3 2324 B8R0.7 CC(F)CCSCCN Amb27848652 [0,1,0,0,0,0|2,0,1]=4 2325 B8R0.7 CC(F)CSCCCN Amb27209900 [0,1,0,0,0,0|2,0,1]=4 2326 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|0,0,2]=3 2327 B8R0.7 CC(N)CCCN=[N+]=[N-] Amb27816471 [0,1,0,0,0,0|3,0,0]=4 2328 B8R0.7 CC(N)CNCCCF Amb27162848 [0,1,0,0,0,0|2,0,1]=4 2329 B8R0.7 CC(N)COCCCO Amb27635056 [0,1,0,0,0,0|1,0,2]=4 2330 B8R0.7 CC(N)CSCCCF Amb27223251 [0,1,0,0,0,0|2,0,1]=4 2331 B8R0.7 CC(O)CCCCCF Amb27660009 [0,1,0,0,0,0|1,0,1]=3 2332 B8R0.7 CC(O)CCCCCO Amb27464322 [0,1,0,0,0,0|0,0,2]=3 2333 B8R0.7 CC(O)CCCNC=O Amb28318284 [0,1,0,0,0,0|1,0,0]=2 2334 B8R0.7 CC(O)CCCOC=O Amb27946413 [0,1,0,0,0,0|1,0,0]=2 2335 B8R0.7 CC(O)CCNCCN Amb27768810 [0,1,0,0,0,0|2,0,1]=4 2336 B8R0.7 CC(O)CNCCC#N Amb9243318 [0,1,0,0,0,0|2,0,1]=4 2337 B8R0.7 CC(O)CNCCCF Amb27273615 [0,1,0,0,0,0|2,0,1]=4 2338 B8R0.7 CC(O)CNCCCO Amb17308669 [0,1,0,0,0,0|1,0,2]=4 2339 B8R0.7 CC(O)COCCCN Amb28318924 [0,1,0,0,0,0|2,0,1]=4 2340 B8R0.7 CC(O)CSCCCS Amb27956596 [0,1,0,0,0,0|1,1,1]=4 2341 B8R0.7 CC(O)\C=C\CCC=O Amb28134828 [0,1,0,0,0,0|0,0,2]=3 2342 B8R0.7 CC=C=CCCC(C)=O Amb27180942 [0,1,0,0,0,0|0,0,3]=4 2343 B8R0.7 CCC#CCCC(=O)O Amb28046178 [0,1,0,0,0,0|0,0,2]=3 2344 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,1,0,0,0,0|0,0,2]=3 2345 B8R0.7 CCCCC#CC(=O)O Amb2721486 [0,1,0,0,0,0|0,0,2]=3 2346 B8R0.7 CCCCC#CC(C)=O Amb17593278 [0,1,0,0,0,0|0,0,2]=3 2347 B8R0.7 CCCCC#CC(N)=O Amb27782976 [0,1,0,0,0,0|0,0,2]=3 2348 B8R0.7 CCCCCC=C(F)F Amb10840486 [0,1,0,0,0,0|1,0,1]=3 2349 B8R0.7 CCCCCCB(O)O Amb2722519 [0,1,0,0,0,0|1,0,1]=3 2350 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [0,1,0,0,0,0|0,0,0]=1 2351 B8R0.7 CCCCCCC(=O)O Amb34915914 [0,1,0,0,0,0|0,0,0]=1 2352 B8R0.7 CCCCCCC(=O)O Amb3499439 [0,1,0,0,0,0|0,0,0]=1 2353 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [0,1,0,0,0,0|0,0,0]=1 2354 B8R0.7 CCCCCCC(Br)Br Amb33299433 [0,1,0,0,0,0|1,0,1]=3 2355 B8R0.7 CCCCCCC(C)=O Amb6891961 [0,1,0,0,0,0|0,0,0]=1 2356 B8R0.7 CCCCCCC(C)Br Amb8387237 [0,1,0,0,0,0|1,0,1]=3 2357 B8R0.7 CCCCCCC(C)C Amb6366318 [0,1,0,0,0,0|1,0,1]=3 2358 B8R0.7 CCCCCCC(C)Cl Amb7795644 [0,1,0,0,0,0|1,0,1]=3 2359 B8R0.7 CCCCCCC(C)I Amb3940584 [0,1,0,0,0,0|1,0,1]=3 2360 B8R0.7 CCCCCCC(C)N Amb3940458 [0,1,0,0,0,0|1,0,1]=3 2361 B8R0.7 CCCCCCC(C)O Amb3940385 [0,1,0,0,0,0|0,0,2]=3 2362 B8R0.7 CCCCCCC(C)S Amb7795225 [0,1,0,0,0,0|0,1,1]=3 2363 B8R0.7 CCCCCCC(N)=O Amb8858816 [0,1,0,0,0,0|0,0,0]=1 2364 B8R0.7 CCCCCCC(O)O Amb27451028 [0,1,0,0,0,0|0,0,2]=3 2365 B8R0.7 CCCCCC[C@@H](C)Br Amb26563385 [0,1,0,0,0,0|1,0,1]=3 2366 B8R0.7 CCCCCC[C@@H](C)N Amb8516401 [0,1,0,0,0,0|1,0,1]=3 2367 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [0,1,0,0,0,0|0,0,2]=3 2368 B8R0.7 CCCCCC[C@H](C)Br Amb28401131 [0,1,0,0,0,0|1,0,1]=3 2369 B8R0.7 CCCCCC[C@H](C)N Amb8516350 [0,1,0,0,0,0|1,0,1]=3 2370 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,1,0,0,0,0|1,0,0]=2 2371 B8R0.7 CCCCCC[SiH](Cl)Cl Amb22733063 [0,1,0,0,0,0|1,1,0]=3 2372 B8R0.7 CCCCCNC(=N)N Amb28049568 [0,1,0,0,0,0|2,0,0]=3 2373 B8R0.7 CCCCCNC(C)=N Amb28127671 [0,1,0,0,0,0|2,0,0]=3 2374 B8R0.7 CCCCCNC(C)C Amb6250709 [0,1,0,0,0,0|2,0,1]=4 2375 B8R0.7 CCCCCNC(N)=O Amb6246936 [0,1,0,0,0,0|1,0,0]=2 2376 B8R0.7 CCCCCNC(N)=S Amb9212112 [0,1,0,0,0,0|1,1,0]=3 2377 B8R0.7 CCCCCOB(O)O Amb24716868 [0,1,0,0,0,0|2,0,1]=4 2378 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [0,1,0,0,0,0|1,0,0]=2 2379 B8R0.7 CCCCCOC(N)=O Amb27655610 [0,1,0,0,0,0|1,0,0]=2 2380 B8R0.7 CCCCCO[SiH](C)C Amb33512928 [0,1,0,0,0,0|2,1,0]=4 2381 B8R0.7 CCCCCSC(=N)N Amb20675976 [0,1,0,0,0,0|2,0,0]=3 2382 B8R0.7 CCCCCSC(=N)N Amb23590643 [0,1,0,0,0,0|2,0,0]=3 2383 B8R0.7 CCCCCSC(C)C Amb27197323 [0,1,0,0,0,0|2,0,1]=4 2384 B8R0.7 CCCCCSC(C)Cl Amb27477698 [0,1,0,0,0,0|2,0,1]=4 2385 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [0,1,0,0,0,0|1,0,0]=2 2386 B8R0.7 CCCCNCC(=O)O Amb7766471 [0,1,0,0,0,0|1,0,0]=2 2387 B8R0.7 CCCCNCC(C)C Amb6690984 [0,1,0,0,0,0|2,0,1]=4 2388 B8R0.7 CCCCNCC(C)O Amb9246458 [0,1,0,0,0,0|1,0,2]=4 2389 B8R0.7 CCCCNCC(N)=O Amb1126543 [0,1,0,0,0,0|1,0,0]=2 2390 B8R0.7 CCCCNCC(N)=O Amb7969721 [0,1,0,0,0,0|1,0,0]=2 2391 B8R0.7 CCCCNN=C(C)C Amb28049741 [0,1,0,0,0,0|3,0,0]=4 2392 B8R0.7 CCCCNNC(N)=S Amb23590674 [0,1,0,0,0,0|2,1,0]=4 2393 B8R0.7 CCCCOCC(=O)O Amb8514871 [0,1,0,0,0,0|1,0,0]=2 2394 B8R0.7 CCCCOCC(C)Br Amb27390173 [0,1,0,0,0,0|2,0,1]=4 2395 B8R0.7 CCCCOCC(C)C Amb26035939 [0,1,0,0,0,0|2,0,1]=4 2396 B8R0.7 CCCCOCC(C)O Amb4019960 [0,1,0,0,0,0|1,0,2]=4 2397 B8R0.7 CCCCOCC(N)=O Amb27855875 [0,1,0,0,0,0|1,0,0]=2 2398 B8R0.7 CCCCOC[C@@H](C)N Amb27838727 [0,1,0,0,0,0|2,0,1]=4 2399 B8R0.7 CCCCOC[C@H](C)N Amb28326216 [0,1,0,0,0,0|2,0,1]=4 2400 B8R0.7 CCCCONC(N)=O Amb2899789 [0,1,0,0,0,0|2,0,0]=3 2401 B8R0.7 CCCCSCC(=N)N Amb9479963 [0,1,0,0,0,0|2,0,0]=3 2402 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,1,0,0,0,0|1,0,0]=2 2403 B8R0.7 CCCCSCC(C)C Amb4017929 [0,1,0,0,0,0|2,0,1]=4 2404 B8R0.7 CCCCSCC(C)N Amb27772074 [0,1,0,0,0,0|2,0,1]=4 2405 B8R0.7 CCCCSCC(C)O Amb27768766 [0,1,0,0,0,0|1,0,2]=4 2406 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [0,1,0,0,0,0|0,0,2]=3 2407 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [0,1,0,0,0,0|0,0,2]=3 2408 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [0,1,0,0,0,0|0,0,2]=3 2409 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [0,1,0,0,0,0|0,0,2]=3 2410 B8R0.7 CCCNCCC(=O)O Amb18633174 [0,1,0,0,0,0|1,0,0]=2 2411 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,1,0,0,0,0|1,0,0]=2 2412 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,1,0,0,0,0|1,0,0]=2 2413 B8R0.7 CCCNCCC(C)C Amb6279764 [0,1,0,0,0,0|2,0,1]=4 2414 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|2,0,1]=4 2415 B8R0.7 CCCNCCC(F)F Amb26012789 [0,1,0,0,0,0|2,0,1]=4 2416 B8R0.7 CCCNCCC(N)=S Amb17232015 [0,1,0,0,0,0|1,1,0]=3 2417 B8R0.7 CCCNCCN(C)C Amb1131117 [0,1,0,0,0,0|3,0,0]=4 2418 B8R0.7 CCCNCCN(C)C Amb19515715 [0,1,0,0,0,0|3,0,0]=4 2419 B8R0.7 CCCNCC[C@@H](C)O Amb27251174 [0,1,0,0,0,0|1,0,2]=4 2420 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [0,1,0,0,0,0|2,0,0]=3 2421 B8R0.7 CCCOCCC(=O)O Amb8874502 [0,1,0,0,0,0|1,0,0]=2 2422 B8R0.7 CCCOCCC(C)=O Amb8874915 [0,1,0,0,0,0|1,0,0]=2 2423 B8R0.7 CCCOCCC(C)Cl Amb27768653 [0,1,0,0,0,0|2,0,1]=4 2424 B8R0.7 CCCOCCC(C)O Amb27438490 [0,1,0,0,0,0|1,0,2]=4 2425 B8R0.7 CCCONCC(=O)O Amb27401902 [0,1,0,0,0,0|2,0,0]=3 2426 B8R0.7 CCCO\C=C\C(N)=O Amb28198536 [0,1,0,0,0,0|1,0,2]=4 2427 B8R0.7 CCCSCCC(C)C Amb28400564 [0,1,0,0,0,0|2,0,1]=4 2428 B8R0.7 CCCSCCC(N)=S Amb17503250 [0,1,0,0,0,0|1,1,0]=3 2429 B8R0.7 CCCSCCN(C)C Amb27660717 [0,1,0,0,0,0|3,0,0]=4 2430 B8R0.7 CCCS\C=C/C(=O)O Amb18644291 [0,1,0,0,0,0|1,0,2]=4 2431 B8R0.7 CCCS\C=C/C(=O)[O-] Amb19816096 [0,1,0,0,0,0|1,0,2]=4 2432 B8R0.7 CCCS\C=C/C(=O)[O-] Amb6600550 [0,1,0,0,0,0|1,0,2]=4 2433 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [0,1,0,0,0,0|0,0,2]=3 2434 B8R0.7 CCC\C=C\CC(=N)N Amb33373714 [0,1,0,0,0,0|1,0,2]=4 2435 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [0,1,0,0,0,0|0,0,2]=3 2436 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [0,1,0,0,0,0|0,0,2]=3 2437 B8R0.7 CCC\C=C\CC(N)=S Amb33373713 [0,1,0,0,0,0|0,1,2]=4 2438 B8R0.7 CCC\C=N\NC(C)=O Amb27613902 [0,1,0,0,0,0|2,0,1]=4 2439 B8R0.7 CCC\C=N\NC(N)=O Amb25690939 [0,1,0,0,0,0|2,0,1]=4 2440 B8R0.7 CCNCC#CC(=O)O Amb33168956 [0,1,0,0,0,0|1,0,2]=4 2441 B8R0.7 CCNCCCC(=O)O Amb30585148 [0,1,0,0,0,0|1,0,0]=2 2442 B8R0.7 CCNCCCC(=O)O Amb6253896 [0,1,0,0,0,0|1,0,0]=2 2443 B8R0.7 CCNCCCC(C)Cl Amb27768830 [0,1,0,0,0,0|2,0,1]=4 2444 B8R0.7 CCNCCCC(N)=O Amb24709859 [0,1,0,0,0,0|1,0,0]=2 2445 B8R0.7 CCNCCCN(C)C Amb6699376 [0,1,0,0,0,0|3,0,0]=4 2446 B8R0.7 CCNCCCS(C)=O Amb27223315 [0,1,0,0,0,0|2,0,0]=3 2447 B8R0.7 CCNCCNC(C)=O Amb6732650 [0,1,0,0,0,0|2,0,0]=3 2448 B8R0.7 CCNCCSC(C)=O Amb27187142 [0,1,0,0,0,0|2,0,0]=3 2449 B8R0.7 CCOCC#CC(N)=O Amb33495806 [0,1,0,0,0,0|1,0,2]=4 2450 B8R0.7 CCOCCCC(=O)O Amb6257602 [0,1,0,0,0,0|1,0,0]=2 2451 B8R0.7 CCOCCCN(C)C Amb27642283 [0,1,0,0,0,0|3,0,0]=4 2452 B8R0.7 CCOCCCN(C)N Amb27433584 [0,1,0,0,0,0|3,0,0]=4 2453 B8R0.7 CCOCCNC(=N)N Amb28049323 [0,1,0,0,0,0|3,0,0]=4 2454 B8R0.7 CCOCCNC(C)=N Amb27789482 [0,1,0,0,0,0|3,0,0]=4 2455 B8R0.7 CCOCCNC(N)=O Amb9454688 [0,1,0,0,0,0|2,0,0]=3 2456 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [0,1,0,0,0,0|2,0,0]=3 2457 B8R0.7 CCOCCOC(C)=O Amb8383625 [0,1,0,0,0,0|2,0,0]=3 2458 B8R0.7 CCOCCOC(N)=O Amb27760038 [0,1,0,0,0,0|2,0,0]=3 2459 B8R0.7 CCOCCSC(=N)N Amb20675990 [0,1,0,0,0,0|3,0,0]=4 2460 B8R0.7 CCOC\C=C/C(=O)O Amb27807906 [0,1,0,0,0,0|1,0,2]=4 2461 B8R0.7 CCOC\C=C\C(=O)O Amb19020649 [0,1,0,0,0,0|1,0,2]=4 2462 B8R0.7 CCONCCS(C)=O Amb27247491 [0,1,0,0,0,0|3,0,0]=4 2463 B8R0.7 CCO\C=N\CC(=O)O Amb27440832 [0,1,0,0,0,0|2,0,1]=4 2464 B8R0.7 CCSCCCB(O)O Amb24351131 [0,1,0,0,0,0|2,0,1]=4 2465 B8R0.7 CCSCCCC(=N)N Amb28934927 [0,1,0,0,0,0|2,0,0]=3 2466 B8R0.7 CCSCCCC(=O)O Amb6680204 [0,1,0,0,0,0|1,0,0]=2 2467 B8R0.7 CCSCCCC(C)=O Amb9660283 [0,1,0,0,0,0|1,0,0]=2 2468 B8R0.7 CCSCCCC(C)C Amb27588655 [0,1,0,0,0,0|2,0,1]=4 2469 B8R0.7 CCSCCCC(C)N Amb26049335 [0,1,0,0,0,0|2,0,1]=4 2470 B8R0.7 CCSCCCC(C)O Amb26319707 [0,1,0,0,0,0|1,0,2]=4 2471 B8R0.7 CCSCCCC(N)=S Amb28285187 [0,1,0,0,0,0|1,1,0]=3 2472 B8R0.7 CCSCCC[C@@H](C)N Amb33323737 [0,1,0,0,0,0|2,0,1]=4 2473 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [0,1,0,0,0,0|1,0,2]=4 2474 B8R0.7 CCSCCC[C@H](C)N Amb33323735 [0,1,0,0,0,0|2,0,1]=4 2475 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [0,1,0,0,0,0|1,0,2]=4 2476 B8R0.7 CCSCCC[N+](=O)[O-] Amb33323726 [0,1,0,0,0,0|2,0,0]=3 2477 B8R0.7 CCSCCNC(=N)N Amb28183780 [0,1,0,0,0,0|3,0,0]=4 2478 B8R0.7 CCSCCNC(C)=O Amb27848944 [0,1,0,0,0,0|2,0,0]=3 2479 B8R0.7 CCSCCNC(N)=O Amb27639100 [0,1,0,0,0,0|2,0,0]=3 2480 B8R0.7 CCSCCSC(=N)N Amb583113 [0,1,0,0,0,0|3,0,0]=4 2481 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [0,1,0,0,0,0|1,0,2]=4 2482 B8R0.7 CCSC\C=C\C(C)=O Amb33323646 [0,1,0,0,0,0|1,0,2]=4 2483 B8R0.7 CCSSCCC(=O)O Amb27837279 [0,1,0,0,0,0|2,0,0]=3 2484 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [0,1,0,0,0,0|0,0,2]=3 2485 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,1,0,0,0,0|1,0,2]=4 2486 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [0,1,0,0,0,0|0,0,2]=3 2487 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,1,0,0,0,0|0,0,2]=3 2488 B8R0.7 CC\C=C\CCC(N)=O Amb27221048 [0,1,0,0,0,0|0,0,2]=3 2489 B8R0.7 CC\C=C\CC[N+](=O)[O-] Amb33267977 [0,1,0,0,0,0|1,0,2]=4 2490 B8R0.7 CC\C=C\CNC(C)=O Amb27828159 [0,1,0,0,0,0|1,0,2]=4 2491 B8R0.7 CC\C=C\COC(C)=O Amb27487199 [0,1,0,0,0,0|1,0,2]=4 2492 B8R0.7 CC\C=C\OCC(C)=O Amb25235223 [0,1,0,0,0,0|1,0,2]=4 2493 B8R0.7 CC\C=C\SCC(C)=O Amb28245395 [0,1,0,0,0,0|1,0,2]=4 2494 B8R0.7 CN(C)CCCCC#N Amb1089735 [0,1,0,0,0,0|2,0,1]=4 2495 B8R0.7 CN(C)CCCCC#N Amb2099818 [0,1,0,0,0,0|2,0,1]=4 2496 B8R0.7 CN(C)CCCCC=O Amb25276429 [0,1,0,0,0,0|1,0,0]=2 2497 B8R0.7 CN(C)CCCCCBr Amb26490317 [0,1,0,0,0,0|2,0,1]=4 2498 B8R0.7 CN(C)CCCCCN Amb2721306 [0,1,0,0,0,0|2,0,1]=4 2499 B8R0.7 CN(C)CCCCCN Amb31291017 [0,1,0,0,0,0|2,0,1]=4 2500 B8R0.7 CN(C)CCCCCN Amb33800157 [0,1,0,0,0,0|2,0,1]=4 2501 B8R0.7 CN(C)CCCCCO Amb17334131 [0,1,0,0,0,0|1,0,2]=4 2502 B8R0.7 CN(C)CCCCCS Amb25730651 [0,1,0,0,0,0|1,1,1]=4 2503 B8R0.7 CN(C)CCCCON Amb27862613 [0,1,0,0,0,0|3,0,0]=4 2504 B8R0.7 CN(C)CCCN=C=O Amb19649332 [0,1,0,0,0,0|2,0,1]=4 2505 B8R0.7 CN(C)CCC\C=C\Cl Amb27985850 [0,1,0,0,0,0|2,0,1]=4 2506 B8R0.7 CN(C)CC\C=C\C=O Amb33271980 [0,1,0,0,0,0|1,0,2]=4 2507 B8R0.7 CN(C)C\C=C/CC=O Amb27782459 [0,1,0,0,0,0|1,0,2]=4 2508 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,1,0,0,0,0|1,0,0]=2 2509 B8R0.7 CNCCCCC(=O)O Amb24340485 [0,1,0,0,0,0|1,0,0]=2 2510 B8R0.7 CNCCCCC(C)C Amb25769955 [0,1,0,0,0,0|2,0,0]=3 2511 B8R0.7 CNCCCCC(C)O Amb17569923 [0,1,0,0,0,0|2,0,0]=3 2512 B8R0.7 CNCCCCC(N)=O Amb27780478 [0,1,0,0,0,0|1,0,0]=2 2513 B8R0.7 CNCCCCN(C)C Amb19515495 [0,1,0,0,0,0|3,0,0]=4 2514 B8R0.7 CNCCCCN(C)C Amb32675733 [0,1,0,0,0,0|3,0,0]=4 2515 B8R0.7 CNCCCNC(=S)S Amb26390720 [0,1,0,0,0,0|2,1,0]=4 2516 B8R0.7 CNCCCNC(C)=O Amb33547919 [0,1,0,0,0,0|2,0,0]=3 2517 B8R0.7 CNCCCNC(C)=O Amb34913785 [0,1,0,0,0,0|2,0,0]=3 2518 B8R0.7 CNCCCNC(C)=O Amb9464418 [0,1,0,0,0,0|2,0,0]=3 2519 B8R0.7 CNCCCNS(C)=O Amb27186838 [0,1,0,0,0,0|3,0,0]=4 2520 B8R0.7 CNCCCOC(C)C Amb19374841 [0,1,0,0,0,0|3,0,0]=4 2521 B8R0.7 CNCCCOC(C)C Amb32661845 [0,1,0,0,0,0|3,0,0]=4 2522 B8R0.7 CNCCOCC(=O)O Amb18630741 [0,1,0,0,0,0|2,0,0]=3 2523 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,1,0,0,0,0|2,0,0]=3 2524 B8R0.7 CNCCOCC(C)C Amb28283736 [0,1,0,0,0,0|3,0,0]=4 2525 B8R0.7 CNCCOCC(N)=O Amb27447982 [0,1,0,0,0,0|2,0,0]=3 2526 B8R0.7 CNCCSCC(C)N Amb27248798 [0,1,0,0,0,0|3,0,0]=4 2527 B8R0.7 COCC#CCC(=O)O Amb27663198 [0,1,0,0,0,0|1,0,2]=4 2528 B8R0.7 COCCC#CC(=O)O Amb27392974 [0,1,0,0,0,0|1,0,2]=4 2529 B8R0.7 COCCCCB(O)O Amb27230891 [0,1,0,0,0,0|2,0,1]=4 2530 B8R0.7 COCCCCC(=O)O Amb9207785 [0,1,0,0,0,0|1,0,0]=2 2531 B8R0.7 COCCCCC(C)=O Amb9659801 [0,1,0,0,0,0|1,0,0]=2 2532 B8R0.7 COCCCCC(C)N Amb17569945 [0,1,0,0,0,0|2,0,0]=3 2533 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|2,0,0]=3 2534 B8R0.7 COCCCCN(C)N Amb27265160 [0,1,0,0,0,0|3,0,0]=4 2535 B8R0.7 COCCCCS(=O)Cl Amb32720517 [0,1,0,0,0,0|2,0,0]=3 2536 B8R0.7 COCCCCS(=O)[O-] Amb32754745 [0,1,0,0,0,0|2,0,0]=3 2537 B8R0.7 COCCCCS(N)=O Amb32720518 [0,1,0,0,0,0|2,0,0]=3 2538 B8R0.7 COCCCC[C@@H](C)N Amb33377489 [0,1,0,0,0,0|2,0,0]=3 2539 B8R0.7 COCCCC[C@@H](C)O Amb33377490 [0,1,0,0,0,0|2,0,0]=3 2540 B8R0.7 COCCCC[C@H](C)N Amb33377488 [0,1,0,0,0,0|2,0,0]=3 2541 B8R0.7 COCCCC[C@H](C)O Amb33377491 [0,1,0,0,0,0|2,0,0]=3 2542 B8R0.7 COCCCC[N+](=O)[O-] Amb33377457 [0,1,0,0,0,0|2,0,0]=3 2543 B8R0.7 COCCCNC(=N)N Amb22058724 [0,1,0,0,0,0|3,0,0]=4 2544 B8R0.7 COCCCNC(=N)N Amb33547912 [0,1,0,0,0,0|3,0,0]=4 2545 B8R0.7 COCCCNC(=O)Cl Amb27791959 [0,1,0,0,0,0|2,0,0]=3 2546 B8R0.7 COCCCNC(C)=N Amb28049783 [0,1,0,0,0,0|3,0,0]=4 2547 B8R0.7 COCCCNC(C)=O Amb3358083 [0,1,0,0,0,0|2,0,0]=3 2548 B8R0.7 COCCCNC(C)C Amb6730254 [0,1,0,0,0,0|3,0,0]=4 2549 B8R0.7 COCCCNC(N)=O Amb1105274 [0,1,0,0,0,0|2,0,0]=3 2550 B8R0.7 COCCCNC(N)=S Amb2777917 [0,1,0,0,0,0|2,1,0]=4 2551 B8R0.7 COCCCOC(C)=O Amb22732978 [0,1,0,0,0,0|2,0,0]=3 2552 B8R0.7 COCCNCC(=O)O Amb19514667 [0,1,0,0,0,0|2,0,0]=3 2553 B8R0.7 COCCNCC(=O)O Amb7766415 [0,1,0,0,0,0|2,0,0]=3 2554 B8R0.7 COCCNCC(C)C Amb6685598 [0,1,0,0,0,0|3,0,0]=4 2555 B8R0.7 COCCNCC(N)=O Amb13951972 [0,1,0,0,0,0|2,0,0]=3 2556 B8R0.7 COCCNCC(N)=O Amb6707121 [0,1,0,0,0,0|2,0,0]=3 2557 B8R0.7 COCCOCC(=O)O Amb2721259 [0,1,0,0,0,0|2,0,0]=3 2558 B8R0.7 COCCOCC(C)=O Amb9665444 [0,1,0,0,0,0|2,0,0]=3 2559 B8R0.7 COCCOCC(C)N Amb19375047 [0,1,0,0,0,0|3,0,0]=4 2560 B8R0.7 COCCOCC(C)N Amb6661949 [0,1,0,0,0,0|3,0,0]=4 2561 B8R0.7 COCCOCC(C)O Amb25939469 [0,1,0,0,0,0|3,0,0]=4 2562 B8R0.7 COCCOC[C@@H](C)N Amb27862644 [0,1,0,0,0,0|3,0,0]=4 2563 B8R0.7 COCCSCC(=O)O Amb6245777 [0,1,0,0,0,0|2,0,0]=3 2564 B8R0.7 COCCSCC(C)C Amb27837668 [0,1,0,0,0,0|3,0,0]=4 2565 B8R0.7 COCCSCC(C)O Amb18179365 [0,1,0,0,0,0|3,0,0]=4 2566 B8R0.7 COCCSC[C@H](C)O Amb27977734 [0,1,0,0,0,0|3,0,0]=4 2567 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [0,1,0,0,0,0|1,0,2]=4 2568 B8R0.7 COCC\C=C\C(C)=O Amb33377354 [0,1,0,0,0,0|1,0,2]=4 2569 B8R0.7 COCOCCC(=O)O Amb27784860 [0,1,0,0,0,0|2,0,0]=3 2570 B8R0.7 COCSCCC(=O)O Amb27263382 [0,1,0,0,0,0|2,0,0]=3 2571 B8R0.7 CS(=O)CCCCC#N Amb25711714 [0,1,0,0,0,0|2,0,1]=4 2572 B8R0.7 CS(=O)CCCCC=O Amb27856287 [0,1,0,0,0,0|1,0,0]=2 2573 B8R0.7 CS(=O)CCCCCCl Amb27173793 [0,1,0,0,0,0|2,0,0]=3 2574 B8R0.7 CS(=O)CCCN=C=O Amb27475732 [0,1,0,0,0,0|2,0,1]=4 2575 B8R0.7 CS(=O)CCNCCCl Amb27222833 [0,1,0,0,0,0|3,0,0]=4 2576 B8R0.7 CS(=O)CCNCCF Amb28138817 [0,1,0,0,0,0|3,0,0]=4 2577 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,1,0,0,0,0|1,0,0]=2 2578 B8R0.7 CSCCCCC(C)=O Amb27815140 [0,1,0,0,0,0|1,0,0]=2 2579 B8R0.7 CSCCCCC(C)N Amb27475432 [0,1,0,0,0,0|2,0,0]=3 2580 B8R0.7 CSCCCCC(C)O Amb27863049 [0,1,0,0,0,0|2,0,0]=3 2581 B8R0.7 CSCCCCC(N)=O Amb27662727 [0,1,0,0,0,0|1,0,0]=2 2582 B8R0.7 CSCCCC[C@@H](C)N Amb33198290 [0,1,0,0,0,0|2,0,0]=3 2583 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [0,1,0,0,0,0|2,0,0]=3 2584 B8R0.7 CSCCCC[C@H](C)N Amb33198289 [0,1,0,0,0,0|2,0,0]=3 2585 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [0,1,0,0,0,0|2,0,0]=3 2586 B8R0.7 CSCCCC[N+](=O)[O-] Amb33198277 [0,1,0,0,0,0|2,0,0]=3 2587 B8R0.7 CSCCCOC(C)=O Amb8392861 [0,1,0,0,0,0|2,0,0]=3 2588 B8R0.7 CSCCNCC(=O)O Amb24401934 [0,1,0,0,0,0|2,0,0]=3 2589 B8R0.7 CSCCNCC(=O)O Amb28934977 [0,1,0,0,0,0|2,0,0]=3 2590 B8R0.7 CSCCNCC(C)C Amb27452217 [0,1,0,0,0,0|3,0,0]=4 2591 B8R0.7 CSCCNCC(N)=O Amb27850987 [0,1,0,0,0,0|2,0,0]=3 2592 B8R0.7 CSCCNC[C@@H](C)O Amb27785175 [0,1,0,0,0,0|3,0,0]=4 2593 B8R0.7 CSCCOCC(=O)O Amb27392229 [0,1,0,0,0,0|2,0,0]=3 2594 B8R0.7 CSCCONC(C)=O Amb27247630 [0,1,0,0,0,0|3,0,0]=4 2595 B8R0.7 CSCCSCC(=O)O Amb27964765 [0,1,0,0,0,0|2,0,0]=3 2596 B8R0.7 CSCCSCC(C)C Amb28454546 [0,1,0,0,0,0|3,0,0]=4 2597 B8R0.7 CSCCSC[C@@H](C)N Amb27861407 [0,1,0,0,0,0|3,0,0]=4 2598 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [0,1,0,0,0,0|1,0,2]=4 2599 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [0,1,0,0,0,0|1,0,2]=4 2600 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [0,1,0,0,0,0|1,0,2]=4 2601 B8R0.7 CSSCCCC(=O)O Amb25269470 [0,1,0,0,0,0|2,0,0]=3 2602 B8R0.7 CSSCCNC(C)=O Amb27805193 [0,1,0,0,0,0|3,0,0]=4 2603 B8R0.7 C[C@@H](N)CNCCCF Amb27956501 [0,1,0,0,0,0|2,0,1]=4 2604 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [0,1,0,0,0,0|0,0,2]=3 2605 B8R0.7 C[C@H](O)CCCCC=O Amb27793108 [0,1,0,0,0,0|0,0,0]=1 2606 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,1,0,0,0,0|2,0,1]=4 2607 B8R0.7 C[SiH2]CCCCC(C)O Amb28049251 [0,1,0,0,0,0|1,1,0]=3 2608 B8R0.7 C\C(Cl)=C\CCCC=O Amb27252215 [0,1,0,0,0,0|0,0,2]=3 2609 B8R0.7 C\C(N)=N\CCCCO Amb28457978 [0,1,0,0,0,0|3,0,0]=4 2610 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [0,1,0,0,0,0|0,0,2]=3 2611 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,1,0,0,0,0|0,0,2]=3 2612 B8R0.7 C\C=C\CCCC(C)Br Amb27845432 [0,1,0,0,0,0|1,0,1]=3 2613 B8R0.7 C\C=C\CCNC(C)C Amb18312588 [0,1,0,0,0,0|2,0,1]=4 2614 B8R0.7 C\C=C\CCNC(N)=O Amb27845871 [0,1,0,0,0,0|1,0,2]=4 2615 B8R0.7 C\C=C\CNCC(C)Cl Amb27652348 [0,1,0,0,0,0|2,0,1]=4 2616 B8R0.7 C\C=C\CSCC(=O)O Amb9727556 [0,1,0,0,0,0|1,0,2]=4 2617 B8R0.7 C\C=C\CSCC(C)C Amb28461126 [0,1,0,0,0,0|2,0,1]=4 2618 B8R0.7 C\C=C\OCCC(C)=O Amb24631670 [0,1,0,0,0,0|1,0,2]=4 2619 B8R0.7 FC(F)=CCCCCBr Amb27863490 [0,1,0,0,0,0|2,0,1]=4 2620 B8R0.7 FC(F)CCCCCBr Amb24459890 [0,1,0,0,0,0|2,0,1]=4 2621 B8R0.7 FC(F)CCCCCCl Amb32688145 [0,1,0,0,0,0|2,0,1]=4 2622 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,1,0,0,0,0|1,0,1]=3 2623 B8R0.7 N#CCCCCC(N)=O Amb24108037 [0,1,0,0,0,0|1,0,1]=3 2624 B8R0.7 N#CCCCCC(N)N Amb28289543 [0,1,0,0,0,0|2,0,1]=4 2625 B8R0.7 N#CCCCCS(=O)Cl Amb32720347 [0,1,0,0,0,0|2,0,1]=4 2626 B8R0.7 N#CCCCCS(=O)[O-] Amb32754250 [0,1,0,0,0,0|2,0,1]=4 2627 B8R0.7 N#CCCCCS(N)=O Amb32720348 [0,1,0,0,0,0|2,0,1]=4 2628 B8R0.7 N#CCCCNC(N)=O Amb27644105 [0,1,0,0,0,0|2,0,1]=4 2629 B8R0.7 N#CCCNCC(=O)O Amb2720474 [0,1,0,0,0,0|2,0,1]=4 2630 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,1,0,0,0,0|2,0,1]=4 2631 B8R0.7 N#CCSCCC(=O)O Amb6277440 [0,1,0,0,0,0|2,0,1]=4 2632 B8R0.7 N#CCSCCC(N)=O Amb27430604 [0,1,0,0,0,0|2,0,1]=4 2633 B8R0.7 N=C(N)CCCCCO Amb27447678 [0,1,0,0,0,0|2,0,0]=3 2634 B8R0.7 N=C(N)CCOCCO Amb6681748 [0,1,0,0,0,0|3,0,0]=4 2635 B8R0.7 N=C(N)NCCCCN Amb19929571 [0,1,0,0,0,0|3,0,0]=4 2636 B8R0.7 N=C(N)NCCCCN Amb2781574 [0,1,0,0,0,0|3,0,0]=4 2637 B8R0.7 N=C(N)NCCCCN Amb3941521 [0,1,0,0,0,0|3,0,0]=4 2638 B8R0.7 N=C(N)SCCCCF Amb28457766 [0,1,0,0,0,0|3,0,0]=4 2639 B8R0.7 NC(=O)C#CCCCCl Amb28133803 [0,1,0,0,0,0|1,0,2]=4 2640 B8R0.7 NC(=O)CCCCCBr Amb2685265 [0,1,0,0,0,0|1,0,0]=2 2641 B8R0.7 NC(=O)CCCCCCl Amb27392074 [0,1,0,0,0,0|1,0,0]=2 2642 B8R0.7 NC(=O)CCCCCF Amb27837777 [0,1,0,0,0,0|1,0,0]=2 2643 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,1,0,0,0,0|1,0,0]=2 2644 B8R0.7 NC(=O)CCCN=C=S Amb19514658 [0,1,0,0,0,0|2,0,1]=4 2645 B8R0.7 NC(=O)CCNCCO Amb4303499 [0,1,0,0,0,0|2,0,0]=3 2646 B8R0.7 NC(=O)CCOCCO Amb28289325 [0,1,0,0,0,0|2,0,0]=3 2647 B8R0.7 NC(=O)CCSCCBr Amb28367265 [0,1,0,0,0,0|2,0,0]=3 2648 B8R0.7 NC(=O)CCSCCCl Amb27620677 [0,1,0,0,0,0|2,0,0]=3 2649 B8R0.7 NC(=O)CNCCCO Amb9246617 [0,1,0,0,0,0|2,0,0]=3 2650 B8R0.7 NC(=O)CSCCCCl Amb28397637 [0,1,0,0,0,0|2,0,0]=3 2651 B8R0.7 NC(=O)CSCCCO Amb27408312 [0,1,0,0,0,0|2,0,0]=3 2652 B8R0.7 NC(=O)CSCCCS Amb27965314 [0,1,0,0,0,0|2,0,0]=3 2653 B8R0.7 NC(=O)NCCCCBr Amb27614497 [0,1,0,0,0,0|2,0,0]=3 2654 B8R0.7 NC(=O)NCCCCF Amb27663218 [0,1,0,0,0,0|2,0,0]=3 2655 B8R0.7 NC(=O)NOCCCO Amb28189929 [0,1,0,0,0,0|3,0,0]=4 2656 B8R0.7 NC(=S)CCCCCF Amb27956470 [0,1,0,0,0,0|1,1,0]=3 2657 B8R0.7 NC(=S)CCOCCO Amb6681260 [0,1,0,0,0,0|2,1,0]=4 2658 B8R0.7 NC(=S)NCCCCF Amb27783801 [0,1,0,0,0,0|2,1,0]=4 2659 B8R0.7 NCCCC#CC(=O)O Amb33168806 [0,1,0,0,0,0|1,0,2]=4 2660 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,1,0,0,0,0|1,0,0]=2 2661 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,1,0,0,0,0|1,0,0]=2 2662 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,1,0,0,0,0|1,0,0]=2 2663 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [0,1,0,0,0,0|1,0,0]=2 2664 B8R0.7 NCCCCNC(=S)S Amb26625184 [0,1,0,0,0,0|2,1,0]=4 2665 B8R0.7 NCCCCNC(N)=O Amb19026975 [0,1,0,0,0,0|2,0,0]=3 2666 B8R0.7 NCCCCNC(N)=O Amb19374296 [0,1,0,0,0,0|2,0,0]=3 2667 B8R0.7 NCCCCNC(N)=S Amb28041776 [0,1,0,0,0,0|2,1,0]=4 2668 B8R0.7 NCCCOCC(=O)O Amb18111435 [0,1,0,0,0,0|2,0,0]=3 2669 B8R0.7 NCCCOCC(=O)O Amb31217489 [0,1,0,0,0,0|2,0,0]=3 2670 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,1,0,0,0,0|2,0,0]=3 2671 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [0,1,0,0,0,0|1,0,2]=4 2672 B8R0.7 NCCNCCC(=O)O Amb20668304 [0,1,0,0,0,0|2,0,0]=3 2673 B8R0.7 NCCNCCC(=O)O Amb22058790 [0,1,0,0,0,0|2,0,0]=3 2674 B8R0.7 NCCNCCC(N)=O Amb27436823 [0,1,0,0,0,0|2,0,0]=3 2675 B8R0.7 NCCNCC[SH](=O)=O Amb27816609 [0,1,0,0,0,0|3,0,0]=4 2676 B8R0.7 NCCOCCC(=O)O Amb18630461 [0,1,0,0,0,0|2,0,0]=3 2677 B8R0.7 NCCOCCC(=O)O Amb33330744 [0,1,0,0,0,0|2,0,0]=3 2678 B8R0.7 NCCOCCC(N)=O Amb27751130 [0,1,0,0,0,0|2,0,0]=3 2679 B8R0.7 NCCSCCC(=O)O Amb21988844 [0,1,0,0,0,0|2,0,0]=3 2680 B8R0.7 NCCSSCC(=O)O Amb27658690 [0,1,0,0,0,0|3,0,0]=4 2681 B8R0.7 NOCCCCC(=O)O Amb27596055 [0,1,0,0,0,0|2,0,0]=3 2682 B8R0.7 NS(=O)CCCCCBr Amb32720462 [0,1,0,0,0,0|2,0,0]=3 2683 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [0,1,0,0,0,0|1,0,0]=2 2684 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [0,1,0,0,0,0|1,0,0]=2 2685 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [0,1,0,0,0,0|1,0,0]=2 2686 B8R0.7 O=C(Cl)CCNCCCl Amb28121157 [0,1,0,0,0,0|2,0,0]=3 2687 B8R0.7 O=C(Cl)CCOCCCl Amb27966437 [0,1,0,0,0,0|2,0,0]=3 2688 B8R0.7 O=C(Cl)OCCCCCl Amb8515449 [0,1,0,0,0,0|2,0,0]=3 2689 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [0,1,0,0,0,0|1,0,2]=4 2690 B8R0.7 O=C(F)CCCCCCl Amb27173031 [0,1,0,0,0,0|1,0,0]=2 2691 B8R0.7 O=C(O)CCC#CCO Amb27949900 [0,1,0,0,0,0|1,0,2]=4 2692 B8R0.7 O=C(O)CCCCCBr Amb2081955 [0,1,0,0,0,0|1,0,0]=2 2693 B8R0.7 O=C(O)CCCCCCl Amb18796646 [0,1,0,0,0,0|1,0,0]=2 2694 B8R0.7 O=C(O)CCCCCF Amb26063796 [0,1,0,0,0,0|1,0,0]=2 2695 B8R0.7 O=C(O)CCCCCI Amb22736492 [0,1,0,0,0,0|1,0,0]=2 2696 B8R0.7 O=C(O)CCCCCO Amb8515991 [0,1,0,0,0,0|1,0,0]=2 2697 B8R0.7 O=C(O)CCCCNO Amb28410171 [0,1,0,0,0,0|2,0,0]=3 2698 B8R0.7 O=C(O)CCCN=C=S Amb26330552 [0,1,0,0,0,0|2,0,1]=4 2699 B8R0.7 O=C(O)CCNCCF Amb27954272 [0,1,0,0,0,0|2,0,0]=3 2700 B8R0.7 O=C(O)CCNCCO Amb1110010 [0,1,0,0,0,0|2,0,0]=3 2701 B8R0.7 O=C(O)CCNCCS Amb28285239 [0,1,0,0,0,0|2,0,0]=3 2702 B8R0.7 O=C(O)CCOCCBr Amb24057757 [0,1,0,0,0,0|2,0,0]=3 2703 B8R0.7 O=C(O)CCOCCF Amb27807548 [0,1,0,0,0,0|2,0,0]=3 2704 B8R0.7 O=C(O)CCOCCO Amb6680916 [0,1,0,0,0,0|2,0,0]=3 2705 B8R0.7 O=C(O)CCOCCS Amb27226892 [0,1,0,0,0,0|2,0,0]=3 2706 B8R0.7 O=C(O)CCSCCBr Amb27468126 [0,1,0,0,0,0|2,0,0]=3 2707 B8R0.7 O=C(O)CCSCCF Amb27172860 [0,1,0,0,0,0|2,0,0]=3 2708 B8R0.7 O=C(O)CCSCCS Amb18126456 [0,1,0,0,0,0|2,0,0]=3 2709 B8R0.7 O=C(O)CNCCCCl Amb28055692 [0,1,0,0,0,0|2,0,0]=3 2710 B8R0.7 O=C(O)CNCCCF Amb27649256 [0,1,0,0,0,0|2,0,0]=3 2711 B8R0.7 O=C(O)CNCCCO Amb9325805 [0,1,0,0,0,0|2,0,0]=3 2712 B8R0.7 O=C(O)COCCCO Amb28288633 [0,1,0,0,0,0|2,0,0]=3 2713 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [0,1,0,0,0,0|1,0,2]=4 2714 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [0,1,0,0,0,0|1,0,2]=4 2715 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [0,1,0,0,0,0|1,0,2]=4 2716 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [0,1,0,0,0,0|1,0,2]=4 2717 B8R0.7 O=C([O-])CCCCCO Amb22491268 [0,1,0,0,0,0|1,0,0]=2 2718 B8R0.7 O=C=NCCCC(=O)O Amb26014000 [0,1,0,0,0,0|2,0,1]=4 2719 B8R0.7 O=CCCCC=C(Cl)Cl Amb27870361 [0,1,0,0,0,0|1,0,2]=4 2720 B8R0.7 O=CCCCCC(=O)O Amb18642763 [0,1,0,0,0,0|1,0,1]=3 2721 B8R0.7 O=CCCCCC(O)O Amb28285175 [0,1,0,0,0,0|1,0,0]=2 2722 B8R0.7 O=CCCCO[N+](=O)[O-] Amb27864566 [0,1,0,0,0,0|3,0,0]=4 2723 B8R0.7 O=CCCOCC(F)F Amb25997333 [0,1,0,0,0,0|2,0,0]=3 2724 B8R0.7 O=CNCCCC(=O)O Amb18305404 [0,1,0,0,0,0|2,0,1]=4 2725 B8R0.7 O=COCCCC(=O)O Amb27217713 [0,1,0,0,0,0|2,0,1]=4 2726 B8R0.7 O=COCCOC(Cl)Cl Amb27454842 [0,1,0,0,0,0|3,0,0]=4 2727 B8R0.7 O=S(Cl)CCCCCBr Amb32720461 [0,1,0,0,0,0|2,0,0]=3 2728 B8R0.7 O=S([O-])CCCCCBr Amb32755703 [0,1,0,0,0,0|2,0,0]=3 2729 B8R0.7 O=S([O-])CCCCCO Amb27394866 [0,1,0,0,0,0|2,0,0]=3 2730 B8R0.7 O=[N+]([O-])CCCCCO Amb25911225 [0,1,0,0,0,0|2,0,0]=3 2731 B8R0.7 O=[N+]([O-])CCSCCO Amb28045665 [0,1,0,0,0,0|3,0,0]=4 2732 B8R0.7 O=[N+]([O-])OCCCCBr Amb25951247 [0,1,0,0,0,0|3,0,0]=4 2733 B8R0.7 O=[N+]([O-])OCCCCO Amb21929397 [0,1,0,0,0,0|3,0,0]=4 2734 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,1,0,0,0,0|2,0,1]=4 2735 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,1,0,0,0,0|2,0,1]=4 2736 B8R0.7 OCCCCC=C(F)F Amb27225930 [0,1,0,0,0,0|2,0,1]=4 2737 B8R0.7 OCCCCCB(O)O Amb27614305 [0,1,0,0,0,0|2,0,1]=4 2738 B8R0.7 OCCCCSC(=S)S Amb28315412 [0,1,0,0,0,0|2,1,0]=4 2739 B8R0.7 [C-]#[N+]CCCCC(C)C Amb27963247 [0,1,0,0,0,0|2,0,0]=3 2740 B8R0.7 [C-]#[N+]CCCCN(C)C Amb33272274 [0,1,0,0,0,0|3,0,0]=4 2741 B8R0.7 [C-]#[N+]CCCOC(C)C Amb3973112 [0,1,0,0,0,0|3,0,0]=4 2742 B8R0.7 [C-]#[N+]CCSCC(C)C Amb27460033 [0,1,0,0,0,0|3,0,0]=4 2743 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,1,0,0,0,0|3,0,0]=4 2744 B8R1.2 BrC=C1CCCCC1 Amb22337534 [0,0,0,1,0,0|1,0,1]=3 2745 B8R1.2 BrC=[N+]1CCOCC1 Amb24478838 [0,0,0,1,0,0|3,0,0]=4 2746 B8R1.2 BrCC1C=CCCC1 Amb25869978 [0,0,0,1,0,0|2,0,0]=3 2747 B8R1.2 BrCC1CC=CCC1 Amb26515715 [0,0,0,1,0,0|2,0,1]=4 2748 B8R1.2 BrCC1CCCCC1 Amb3940090 [0,0,0,1,0,0|1,0,1]=3 2749 B8R1.2 BrCC1CCCCN1 Amb18128036 [0,0,0,1,0,0|2,0,1]=4 2750 B8R1.2 BrCC1CCCCN1 Amb20171159 [0,0,0,1,0,0|2,0,1]=4 2751 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,0,0,1,0,0|1,0,2]=4 2752 B8R1.2 BrCC1CCCNC1 Amb22229216 [0,0,0,1,0,0|2,0,1]=4 2753 B8R1.2 BrCC1CCCNC1 Amb6316208 [0,0,0,1,0,0|2,0,1]=4 2754 B8R1.2 BrCC1CCCOC1 Amb18178619 [0,0,0,1,0,0|2,0,1]=4 2755 B8R1.2 BrCC1CCCSC1 Amb28206709 [0,0,0,1,0,0|2,0,1]=4 2756 B8R1.2 BrCC1CCNCC1 Amb17935872 [0,0,0,1,0,0|2,0,1]=4 2757 B8R1.2 BrCC1CCNCC1 Amb19516018 [0,0,0,1,0,0|2,0,1]=4 2758 B8R1.2 BrCC1CCNCC1 Amb8631527 [0,0,0,1,0,0|2,0,1]=4 2759 B8R1.2 BrCC1CCOCC1 Amb2684131 [0,0,0,1,0,0|2,0,1]=4 2760 B8R1.2 BrCC1CCSCC1 Amb22011704 [0,0,0,1,0,0|2,0,1]=4 2761 B8R1.2 BrCN1CCCCC1 Amb27831216 [0,0,0,1,0,0|2,0,1]=4 2762 B8R1.2 BrC[C@@H]1CCCCO1 Amb27793586 [0,0,0,1,0,0|1,0,2]=4 2763 B8R1.2 Br[Mg]C1CCCCC1 Amb19944556 [0,0,0,1,0,0|2,0,0]=3 2764 B8R1.2 Br[Mg]C1CCOCC1 Amb32643934 [0,0,0,1,0,0|3,0,0]=4 2765 B8R1.2 Br[Mg]C1CCSCC1 Amb32643926 [0,0,0,1,0,0|3,0,0]=4 2766 B8R1.2 Br\C=C1\CCCOC1 Amb32656912 [0,0,0,1,0,0|2,0,1]=4 2767 B8R1.2 C#CC1CCCCC1 Amb8517385 [0,0,0,1,0,0|1,0,1]=3 2768 B8R1.2 C#CC1CCCCN1 Amb22170138 [0,0,0,1,0,0|2,0,1]=4 2769 B8R1.2 C#CC1CCCCN1 Amb22228818 [0,0,0,1,0,0|2,0,1]=4 2770 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,0,0,1,0,0|2,0,1]=4 2771 B8R1.2 C#CC1CCCCS1 Amb33169139 [0,0,0,1,0,0|2,0,1]=4 2772 B8R1.2 C#CC1CCCNC1 Amb21856615 [0,0,0,1,0,0|2,0,1]=4 2773 B8R1.2 C#CC1CCCNC1 Amb22229305 [0,0,0,1,0,0|2,0,1]=4 2774 B8R1.2 C#CC1CCCOC1 Amb33547093 [0,0,0,1,0,0|2,0,1]=4 2775 B8R1.2 C#CC1CCCSC1 Amb33169131 [0,0,0,1,0,0|2,0,1]=4 2776 B8R1.2 C#CC1CCNCC1 Amb21858257 [0,0,0,1,0,0|2,0,1]=4 2777 B8R1.2 C#CC1CCNCC1 Amb33540070 [0,0,0,1,0,0|2,0,1]=4 2778 B8R1.2 C#CC1CCOCC1 Amb21960753 [0,0,0,1,0,0|2,0,1]=4 2779 B8R1.2 C#CC1CCSCC1 Amb27807476 [0,0,0,1,0,0|2,0,1]=4 2780 B8R1.2 C#C[C@H]1CCCCN1 Amb27445453 [0,0,0,1,0,0|2,0,1]=4 2781 B8R1.2 C=CC1=CCCCC1 Amb24387238 [0,0,0,1,0,0|1,0,2]=4 2782 B8R1.2 C=CC1CCCCC1 Amb8513441 [0,0,0,1,0,0|1,0,0]=2 2783 B8R1.2 C=CC1CCCCN1 Amb33551305 [0,0,0,1,0,0|2,0,0]=3 2784 B8R1.2 C=CC1CCCCN1 Amb6740273 [0,0,0,1,0,0|2,0,0]=3 2785 B8R1.2 C=CC1CCCCO1 Amb35672708 [0,0,0,1,0,0|2,0,0]=3 2786 B8R1.2 C=CC1CCCNC1 Amb30526956 [0,0,0,1,0,0|2,0,0]=3 2787 B8R1.2 C=CC1CCCNC1 Amb6740275 [0,0,0,1,0,0|2,0,0]=3 2788 B8R1.2 C=CC1CCCOC1 Amb25100920 [0,0,0,1,0,0|2,0,0]=3 2789 B8R1.2 C=CC1CCCSC1 Amb26633444 [0,0,0,1,0,0|2,0,0]=3 2790 B8R1.2 C=CC1CCNCC1 Amb19272298 [0,0,0,1,0,0|2,0,0]=3 2791 B8R1.2 C=CC1CCNCC1 Amb6740277 [0,0,0,1,0,0|2,0,0]=3 2792 B8R1.2 C=CC1CCOCC1 Amb26477017 [0,0,0,1,0,0|2,0,0]=3 2793 B8R1.2 C=CC1OCCCO1 Amb24725153 [0,0,0,1,0,0|3,0,0]=4 2794 B8R1.2 C=C[C@H]1COCCN1 Amb28315874 [0,0,0,1,0,0|3,0,0]=4 2795 B8R1.2 CC=C1CCCCC1 Amb8513433 [0,0,0,1,0,0|1,0,1]=3 2796 B8R1.2 CC=C1CCNCC1 Amb27188889 [0,0,0,1,0,0|2,0,1]=4 2797 B8R1.2 CC=C1CCOCC1 Amb27604314 [0,0,0,1,0,0|2,0,1]=4 2798 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,0,0,1,0,0|1,0,2]=4 2799 B8R1.2 CCC1=CNCCC1 Amb27404529 [0,0,0,1,0,0|2,0,1]=4 2800 B8R1.2 CCC1C=CCCC1 Amb27883191 [0,0,0,1,0,0|1,0,0]=2 2801 B8R1.2 CCC1CCCCC1 Amb6296025 [0,0,0,1,0,0|1,0,1]=3 2802 B8R1.2 CCC1CCCCN1 Amb10683459 [0,0,0,1,0,0|1,0,1]=3 2803 B8R1.2 CCC1CCCCN1 Amb5716839 [0,0,0,1,0,0|1,0,1]=3 2804 B8R1.2 CCC1CCCCO1 Amb2703732 [0,0,0,1,0,0|0,0,2]=3 2805 B8R1.2 CCC1CCCNC1 Amb19516506 [0,0,0,1,0,0|2,0,0]=3 2806 B8R1.2 CCC1CCCNC1 Amb7969496 [0,0,0,1,0,0|2,0,0]=3 2807 B8R1.2 CCC1CCNC=N1 Amb35656308 [0,0,0,1,0,0|2,0,0]=3 2808 B8R1.2 CCC1CCNCC1 Amb17760296 [0,0,0,1,0,0|2,0,1]=4 2809 B8R1.2 CCC1CCNCC1 Amb19272296 [0,0,0,1,0,0|2,0,1]=4 2810 B8R1.2 CCC1CNC=CS1 Amb27446999 [0,0,0,1,0,0|1,1,1]=4 2811 B8R1.2 CCC1CNCCN1 Amb10606910 [0,0,0,1,0,0|2,0,1]=4 2812 B8R1.2 CCC1CNCCN1 Amb20240995 [0,0,0,1,0,0|2,0,1]=4 2813 B8R1.2 CCC1CNCCN1 Amb6307247 [0,0,0,1,0,0|2,0,1]=4 2814 B8R1.2 CCC1CNCCO1 Amb13951287 [0,0,0,1,0,0|1,0,2]=4 2815 B8R1.2 CCC1CNCCO1 Amb6892218 [0,0,0,1,0,0|1,0,2]=4 2816 B8R1.2 CCC1CNCCS1 Amb19149092 [0,0,0,1,0,0|1,1,1]=4 2817 B8R1.2 CCC1COCCN1 Amb21864708 [0,0,0,1,0,0|2,0,1]=4 2818 B8R1.2 CCC1COCCN1 Amb22492291 [0,0,0,1,0,0|2,0,1]=4 2819 B8R1.2 CCC1COCCN1 Amb9028259 [0,0,0,1,0,0|2,0,1]=4 2820 B8R1.2 CCC1CSCCN1 Amb18124338 [0,0,0,1,0,0|2,0,1]=4 2821 B8R1.2 CCC1NCCCN1 Amb24445855 [0,0,0,1,0,0|2,0,1]=4 2822 B8R1.2 CCC1NCCCO1 Amb17506192 [0,0,0,1,0,0|1,0,2]=4 2823 B8R1.2 CCN1CCCCC1 Amb8387388 [0,0,0,1,0,0|2,0,1]=4 2824 B8R1.2 CCN1CCCCN1 Amb27473714 [0,0,0,1,0,0|2,0,1]=4 2825 B8R1.2 CCN1CCCNC1 Amb18641821 [0,0,0,1,0,0|3,0,0]=4 2826 B8R1.2 CC[C@@H]1CCCCN1 Amb22892832 [0,0,0,1,0,0|1,0,1]=3 2827 B8R1.2 CC[C@@H]1CCCNC1 Amb27166756 [0,0,0,1,0,0|2,0,0]=3 2828 B8R1.2 CC[C@@H]1CNCCN1 Amb15690747 [0,0,0,1,0,0|2,0,1]=4 2829 B8R1.2 CC[C@@H]1CNCCN1 Amb6307246 [0,0,0,1,0,0|2,0,1]=4 2830 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,0,0,1,0,0|1,0,2]=4 2831 B8R1.2 CC[C@@H]1CNCCO1 Amb34144519 [0,0,0,1,0,0|1,0,2]=4 2832 B8R1.2 CC[C@@H]1COCCN1 Amb20242298 [0,0,0,1,0,0|2,0,1]=4 2833 B8R1.2 CC[C@@H]1COCCN1 Amb20242895 [0,0,0,1,0,0|2,0,1]=4 2834 B8R1.2 CC[C@@H]1CSCCN1 Amb27201741 [0,0,0,1,0,0|2,0,1]=4 2835 B8R1.2 CC[C@H]1CCCCN1 Amb20241520 [0,0,0,1,0,0|1,0,1]=3 2836 B8R1.2 CC[C@H]1CCCNC1 Amb27872130 [0,0,0,1,0,0|2,0,0]=3 2837 B8R1.2 CC[C@H]1CNCCN1 Amb20671343 [0,0,0,1,0,0|2,0,1]=4 2838 B8R1.2 CC[C@H]1CNCCN1 Amb8384867 [0,0,0,1,0,0|2,0,1]=4 2839 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,0,0,1,0,0|1,0,2]=4 2840 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,0,0,1,0,0|1,0,2]=4 2841 B8R1.2 CC[C@H]1COCCN1 Amb19516643 [0,0,0,1,0,0|2,0,1]=4 2842 B8R1.2 CC[C@H]1COCCN1 Amb22226455 [0,0,0,1,0,0|2,0,1]=4 2843 B8R1.2 CC[C@H]1CSCCN1 Amb27861044 [0,0,0,1,0,0|2,0,1]=4 2844 B8R1.2 CN=C1CCCCC1 Amb27838980 [0,0,0,1,0,0|2,0,1]=4 2845 B8R1.2 CNC1CCCCC1 Amb2720339 [0,0,0,1,0,0|2,0,0]=3 2846 B8R1.2 CNC1CCCCO1 Amb26068497 [0,0,0,1,0,0|1,0,2]=4 2847 B8R1.2 CNC1CCCNC1 Amb18276901 [0,0,0,1,0,0|3,0,0]=4 2848 B8R1.2 CNC1CCCNC1 Amb8390243 [0,0,0,1,0,0|3,0,0]=4 2849 B8R1.2 CNC1CCCOC1 Amb18641845 [0,0,0,1,0,0|3,0,0]=4 2850 B8R1.2 CNC1CCCSC1 Amb18948508 [0,0,0,1,0,0|3,0,0]=4 2851 B8R1.2 CNC1CCCSC1 Amb24271087 [0,0,0,1,0,0|3,0,0]=4 2852 B8R1.2 CNC1CCNCC1 Amb21964652 [0,0,0,1,0,0|3,0,0]=4 2853 B8R1.2 CNC1CCNCC1 Amb8383867 [0,0,0,1,0,0|3,0,0]=4 2854 B8R1.2 CNC1CCOCC1 Amb33534408 [0,0,0,1,0,0|3,0,0]=4 2855 B8R1.2 CNC1CCOCC1 Amb5627438 [0,0,0,1,0,0|3,0,0]=4 2856 B8R1.2 CNC1CCSCC1 Amb21959663 [0,0,0,1,0,0|3,0,0]=4 2857 B8R1.2 CNC1CCSCC1 Amb22408761 [0,0,0,1,0,0|3,0,0]=4 2858 B8R1.2 CNC1CCSCC1 Amb9249050 [0,0,0,1,0,0|3,0,0]=4 2859 B8R1.2 CNN1CCCCC1 Amb33620841 [0,0,0,1,0,0|3,0,0]=4 2860 B8R1.2 CN[C@H]1CCCNC1 Amb24744577 [0,0,0,1,0,0|3,0,0]=4 2861 B8R1.2 CN[C@H]1CCCNC1 Amb32671254 [0,0,0,1,0,0|3,0,0]=4 2862 B8R1.2 CN[C@H]1CCCOC1 Amb26014588 [0,0,0,1,0,0|3,0,0]=4 2863 B8R1.2 COC1C=CCCC1 Amb9787273 [0,0,0,1,0,0|2,0,0]=3 2864 B8R1.2 COC1C=CCCO1 Amb27443733 [0,0,0,1,0,0|3,0,0]=4 2865 B8R1.2 COC1C=CCNC1 Amb35752374 [0,0,0,1,0,0|3,0,0]=4 2866 B8R1.2 COC1C=CCNC1 Amb35753077 [0,0,0,1,0,0|3,0,0]=4 2867 B8R1.2 COC1CCC=CO1 Amb8513795 [0,0,0,1,0,0|1,0,2]=4 2868 B8R1.2 COC1CCCCC1 Amb4035423 [0,0,0,1,0,0|2,0,0]=3 2869 B8R1.2 COC1CCCCN1 Amb24384593 [0,0,0,1,0,0|2,0,1]=4 2870 B8R1.2 COC1CCCCO1 Amb21955138 [0,0,0,1,0,0|1,0,2]=4 2871 B8R1.2 COC1CCCNC1 Amb22586710 [0,0,0,1,0,0|3,0,0]=4 2872 B8R1.2 COC1CCCNC1 Amb33528076 [0,0,0,1,0,0|3,0,0]=4 2873 B8R1.2 COC1CCCNC1 Amb9752773 [0,0,0,1,0,0|3,0,0]=4 2874 B8R1.2 COC1CCNCC1 Amb1157336 [0,0,0,1,0,0|3,0,0]=4 2875 B8R1.2 COC1CCNCC1 Amb8381764 [0,0,0,1,0,0|3,0,0]=4 2876 B8R1.2 CO[C@@H]1CCCNC1 Amb22225358 [0,0,0,1,0,0|3,0,0]=4 2877 B8R1.2 CO[C@@H]1CCCNC1 Amb31204718 [0,0,0,1,0,0|3,0,0]=4 2878 B8R1.2 CO[C@H]1CCCNC1 Amb22226700 [0,0,0,1,0,0|3,0,0]=4 2879 B8R1.2 CO[C@H]1CCCNC1 Amb22756499 [0,0,0,1,0,0|3,0,0]=4 2880 B8R1.2 CSC1CCCNC1 Amb33801787 [0,0,0,1,0,0|3,0,0]=4 2881 B8R1.2 CSC1CCNCC1 Amb17502175 [0,0,0,1,0,0|3,0,0]=4 2882 B8R1.2 CSC1CCNCC1 Amb19929547 [0,0,0,1,0,0|3,0,0]=4 2883 B8R1.2 CSC1CCOCC1 Amb24481407 [0,0,0,1,0,0|3,0,0]=4 2884 B8R1.2 C\C=C1/CCCNC1 Amb31161500 [0,0,0,1,0,0|2,0,1]=4 2885 B8R1.2 ClCC1C=CCCC1 Amb17672830 [0,0,0,1,0,0|2,0,0]=3 2886 B8R1.2 ClCC1CC=CCC1 Amb24481355 [0,0,0,1,0,0|2,0,1]=4 2887 B8R1.2 ClCC1CCCCC1 Amb6717235 [0,0,0,1,0,0|1,0,1]=3 2888 B8R1.2 ClCC1CCCCN1 Amb18124395 [0,0,0,1,0,0|2,0,1]=4 2889 B8R1.2 ClCC1CCCCN1 Amb4021742 [0,0,0,1,0,0|2,0,1]=4 2890 B8R1.2 ClCC1CCCCO1 Amb2723692 [0,0,0,1,0,0|1,0,2]=4 2891 B8R1.2 ClCC1CCCNC1 Amb20618020 [0,0,0,1,0,0|2,0,1]=4 2892 B8R1.2 ClCC1CCCNC1 Amb22229227 [0,0,0,1,0,0|2,0,1]=4 2893 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,0,0,1,0,0|2,0,1]=4 2894 B8R1.2 ClCC1CCCSC1 Amb33223993 [0,0,0,1,0,0|2,0,1]=4 2895 B8R1.2 ClCC1CCNCC1 Amb20618009 [0,0,0,1,0,0|2,0,1]=4 2896 B8R1.2 ClCC1CCNCC1 Amb22229730 [0,0,0,1,0,0|2,0,1]=4 2897 B8R1.2 ClCC1CCOCC1 Amb33530364 [0,0,0,1,0,0|2,0,1]=4 2898 B8R1.2 ClCC1CCSCC1 Amb35694770 [0,0,0,1,0,0|2,0,1]=4 2899 B8R1.2 ClC[C@H]1CCCCO1 Amb27879106 [0,0,0,1,0,0|1,0,2]=4 2900 B8R1.2 ClN=C1CCCCC1 Amb25069376 [0,0,0,1,0,0|2,0,1]=4 2901 B8R1.2 ClNC1CCCCC1 Amb28048682 [0,0,0,1,0,0|2,0,0]=3 2902 B8R1.2 Cl[Mg]C1CCOCC1 Amb28989744 [0,0,0,1,0,0|3,0,0]=4 2903 B8R1.2 FCC1CCCCN1 Amb13953138 [0,0,0,1,0,0|2,0,1]=4 2904 B8R1.2 FCC1CCCCN1 Amb21960708 [0,0,0,1,0,0|2,0,1]=4 2905 B8R1.2 FCC1CCCNC1 Amb13885420 [0,0,0,1,0,0|2,0,1]=4 2906 B8R1.2 FCC1CCCNC1 Amb13889108 [0,0,0,1,0,0|2,0,1]=4 2907 B8R1.2 FCC1CCNCC1 Amb13885415 [0,0,0,1,0,0|2,0,1]=4 2908 B8R1.2 FCC1CCNCC1 Amb21960845 [0,0,0,1,0,0|2,0,1]=4 2909 B8R1.2 FC[C@@H]1CCCCN1 Amb23439341 [0,0,0,1,0,0|2,0,1]=4 2910 B8R1.2 FC[C@H]1CCCCN1 Amb27225654 [0,0,0,1,0,0|2,0,1]=4 2911 B8R1.2 ICC1CC=CCC1 Amb30018639 [0,0,0,1,0,0|2,0,1]=4 2912 B8R1.2 ICC1CCCCC1 Amb22263046 [0,0,0,1,0,0|1,0,1]=3 2913 B8R1.2 ICC1CCCCN1 Amb22228857 [0,0,0,1,0,0|2,0,1]=4 2914 B8R1.2 ICC1CCCCO1 Amb24060887 [0,0,0,1,0,0|1,0,2]=4 2915 B8R1.2 ICC1CCNCC1 Amb21860434 [0,0,0,1,0,0|2,0,1]=4 2916 B8R1.2 ICC1CCNCC1 Amb22229802 [0,0,0,1,0,0|2,0,1]=4 2917 B8R1.2 ICC1CCNCC1 Amb33299469 [0,0,0,1,0,0|2,0,1]=4 2918 B8R1.2 ICC1CCOCC1 Amb2723455 [0,0,0,1,0,0|2,0,1]=4 2919 B8R1.2 I[Zn]C1CCOCC1 Amb22897891 [0,0,0,1,0,0|3,0,0]=4 2920 B8R1.2 N#CC1C=CCCC1 Amb17593115 [0,0,0,1,0,0|2,0,1]=4 2921 B8R1.2 N#CC1CCCCC1 Amb2721190 [0,0,0,1,0,0|1,0,1]=3 2922 B8R1.2 N#CC1CCCCC1 Amb33512936 [0,0,0,1,0,0|1,0,1]=3 2923 B8R1.2 N#CC1CCCCN1 Amb1160385 [0,0,0,1,0,0|2,0,1]=4 2924 B8R1.2 N#CC1CCCCN1 Amb21964343 [0,0,0,1,0,0|2,0,1]=4 2925 B8R1.2 N#CC1CCCCN1 Amb23439300 [0,0,0,1,0,0|2,0,1]=4 2926 B8R1.2 N#CC1CCCCO1 Amb26630839 [0,0,0,1,0,0|2,0,1]=4 2927 B8R1.2 N#CC1CCCCS1 Amb24483258 [0,0,0,1,0,0|2,0,1]=4 2928 B8R1.2 N#CC1CCCNC1 Amb33542504 [0,0,0,1,0,0|2,0,1]=4 2929 B8R1.2 N#CC1CCCNC1 Amb4304396 [0,0,0,1,0,0|2,0,1]=4 2930 B8R1.2 N#CC1CCCOC1 Amb19148306 [0,0,0,1,0,0|2,0,1]=4 2931 B8R1.2 N#CC1CCCSC1 Amb25702736 [0,0,0,1,0,0|2,0,1]=4 2932 B8R1.2 N#CC1CCNCC1 Amb13951696 [0,0,0,1,0,0|2,0,1]=4 2933 B8R1.2 N#CC1CCNCC1 Amb2691979 [0,0,0,1,0,0|2,0,1]=4 2934 B8R1.2 N#CC1CCOCC1 Amb6316183 [0,0,0,1,0,0|2,0,1]=4 2935 B8R1.2 N#CC1CCSCC1 Amb2724107 [0,0,0,1,0,0|2,0,1]=4 2936 B8R1.2 N#CN1CCCCC1 Amb6298785 [0,0,0,1,0,0|2,0,1]=4 2937 B8R1.2 N#C[C@@H]1CCCCN1 Amb23439301 [0,0,0,1,0,0|2,0,1]=4 2938 B8R1.2 N#C[C@@H]1CCCCN1 Amb31308044 [0,0,0,1,0,0|2,0,1]=4 2939 B8R1.2 N#C[C@@H]1CCCCN1 Amb8383547 [0,0,0,1,0,0|2,0,1]=4 2940 B8R1.2 N#C[C@@H]1CCCNC1 Amb25857552 [0,0,0,1,0,0|2,0,1]=4 2941 B8R1.2 N#C[C@@H]1CCCNC1 Amb30586518 [0,0,0,1,0,0|2,0,1]=4 2942 B8R1.2 N#C[C@@H]1CCCNC1 Amb34913316 [0,0,0,1,0,0|2,0,1]=4 2943 B8R1.2 N#C[C@H]1CCCCN1 Amb26582583 [0,0,0,1,0,0|2,0,1]=4 2944 B8R1.2 N#C[C@H]1CCCCN1 Amb33806066 [0,0,0,1,0,0|2,0,1]=4 2945 B8R1.2 N#C[C@H]1CCCNC1 Amb26015634 [0,0,0,1,0,0|2,0,1]=4 2946 B8R1.2 N#C[C@H]1CCCNC1 Amb28989940 [0,0,0,1,0,0|2,0,1]=4 2947 B8R1.2 NCC1C=CCCC1 Amb18641664 [0,0,0,1,0,0|2,0,0]=3 2948 B8R1.2 NCC1CC=CCC1 Amb17718909 [0,0,0,1,0,0|2,0,1]=4 2949 B8R1.2 NCC1CCC=CO1 Amb16233709 [0,0,0,1,0,0|1,0,2]=4 2950 B8R1.2 NCC1CCCCC1 Amb1158677 [0,0,0,1,0,0|1,0,1]=3 2951 B8R1.2 NCC1CCCCN1 Amb21964855 [0,0,0,1,0,0|2,0,1]=4 2952 B8R1.2 NCC1CCCCN1 Amb8385684 [0,0,0,1,0,0|2,0,1]=4 2953 B8R1.2 NCC1CCCCO1 Amb19372867 [0,0,0,1,0,0|1,0,2]=4 2954 B8R1.2 NCC1CCCCO1 Amb2723691 [0,0,0,1,0,0|1,0,2]=4 2955 B8R1.2 NCC1CCCCS1 Amb24443454 [0,0,0,1,0,0|1,1,1]=4 2956 B8R1.2 NCC1CCCNC1 Amb8393087 [0,0,0,1,0,0|2,0,1]=4 2957 B8R1.2 NCC1CCCNC1 Amb8631270 [0,0,0,1,0,0|2,0,1]=4 2958 B8R1.2 NCC1CCCOC1 Amb10603286 [0,0,0,1,0,0|2,0,1]=4 2959 B8R1.2 NCC1CCCOC1 Amb1092537 [0,0,0,1,0,0|2,0,1]=4 2960 B8R1.2 NCC1CCCOC1 Amb22492350 [0,0,0,1,0,0|2,0,1]=4 2961 B8R1.2 NCC1CCCSC1 Amb18831922 [0,0,0,1,0,0|2,0,1]=4 2962 B8R1.2 NCC1CCNCC1 Amb2684474 [0,0,0,1,0,0|2,0,1]=4 2963 B8R1.2 NCC1CCOCC1 Amb1099138 [0,0,0,1,0,0|2,0,1]=4 2964 B8R1.2 NCC1CCOCC1 Amb33534332 [0,0,0,1,0,0|2,0,1]=4 2965 B8R1.2 NCC1CCSCC1 Amb18279249 [0,0,0,1,0,0|2,0,1]=4 2966 B8R1.2 NCC1CCSCC1 Amb6572257 [0,0,0,1,0,0|2,0,1]=4 2967 B8R1.2 NCN1CCCCC1 Amb27170318 [0,0,0,1,0,0|2,0,1]=4 2968 B8R1.2 NC[C@@H]1CCCCN1 Amb24674195 [0,0,0,1,0,0|2,0,1]=4 2969 B8R1.2 NC[C@@H]1CCCCN1 Amb32660589 [0,0,0,1,0,0|2,0,1]=4 2970 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,0,0,1,0,0|1,0,2]=4 2971 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,0,0,1,0,0|1,0,2]=4 2972 B8R1.2 NC[C@@H]1CCCCS1 Amb27469696 [0,0,0,1,0,0|1,1,1]=4 2973 B8R1.2 NC[C@@H]1CCCNC1 Amb2699508 [0,0,0,1,0,0|2,0,1]=4 2974 B8R1.2 NC[C@@H]1CCCOC1 Amb25849361 [0,0,0,1,0,0|2,0,1]=4 2975 B8R1.2 NC[C@@H]1CCCOC1 Amb31028901 [0,0,0,1,0,0|2,0,1]=4 2976 B8R1.2 NC[C@H]1CCCCN1 Amb24434930 [0,0,0,1,0,0|2,0,1]=4 2977 B8R1.2 NC[C@H]1CCCCN1 Amb32657137 [0,0,0,1,0,0|2,0,1]=4 2978 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,0,0,1,0,0|1,0,2]=4 2979 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,0,0,1,0,0|1,0,2]=4 2980 B8R1.2 NC[C@H]1CCCNC1 Amb2699507 [0,0,0,1,0,0|2,0,1]=4 2981 B8R1.2 NC[C@H]1CCCNC1 Amb32660927 [0,0,0,1,0,0|2,0,1]=4 2982 B8R1.2 NC[C@H]1CCCOC1 Amb24483141 [0,0,0,1,0,0|2,0,1]=4 2983 B8R1.2 NC[C@H]1CCCOC1 Amb31028900 [0,0,0,1,0,0|2,0,1]=4 2984 B8R1.2 NN=C1CCCCC1 Amb26080931 [0,0,0,1,0,0|2,0,1]=4 2985 B8R1.2 NNC1CCCCC1 Amb10071075 [0,0,0,1,0,0|2,0,0]=3 2986 B8R1.2 NNC1CCCCC1 Amb10808130 [0,0,0,1,0,0|2,0,0]=3 2987 B8R1.2 NNC1CCCCC1 Amb6244749 [0,0,0,1,0,0|2,0,0]=3 2988 B8R1.2 NNC1CCCNC1 Amb27229132 [0,0,0,1,0,0|3,0,0]=4 2989 B8R1.2 NNC1CCCNC1 Amb28984107 [0,0,0,1,0,0|3,0,0]=4 2990 B8R1.2 NNC1CCCNC1 Amb28984222 [0,0,0,1,0,0|3,0,0]=4 2991 B8R1.2 NNC1CCCOC1 Amb23412249 [0,0,0,1,0,0|3,0,0]=4 2992 B8R1.2 NNC1CCCOC1 Amb23412255 [0,0,0,1,0,0|3,0,0]=4 2993 B8R1.2 NNC1CCCSC1 Amb27800675 [0,0,0,1,0,0|3,0,0]=4 2994 B8R1.2 NNC1CCCSC1 Amb32680286 [0,0,0,1,0,0|3,0,0]=4 2995 B8R1.2 NNC1CCNCC1 Amb19514828 [0,0,0,1,0,0|3,0,0]=4 2996 B8R1.2 NNC1CCNCC1 Amb6298595 [0,0,0,1,0,0|3,0,0]=4 2997 B8R1.2 NNC1CCNCC1 Amb6739995 [0,0,0,1,0,0|3,0,0]=4 2998 B8R1.2 NNC1CCOCC1 Amb16233527 [0,0,0,1,0,0|3,0,0]=4 2999 B8R1.2 NNC1CCOCC1 Amb19514662 [0,0,0,1,0,0|3,0,0]=4 3000 B8R1.2 NNC1CCOCC1 Amb9472763 [0,0,0,1,0,0|3,0,0]=4 3001 B8R1.2 NNC1CCSCC1 Amb23412250 [0,0,0,1,0,0|3,0,0]=4 3002 B8R1.2 NNC1CCSCC1 Amb23412251 [0,0,0,1,0,0|3,0,0]=4 3003 B8R1.2 NNC1CCSCC1 Amb24077369 [0,0,0,1,0,0|3,0,0]=4 3004 B8R1.2 NOC1CCCCC1 Amb18641839 [0,0,0,1,0,0|2,0,0]=3 3005 B8R1.2 NOC1CCCCO1 Amb10975936 [0,0,0,1,0,0|3,0,0]=4 3006 B8R1.2 NOC1CCCOC1 Amb28134643 [0,0,0,1,0,0|3,0,0]=4 3007 B8R1.2 NOC1CCOCC1 Amb24559897 [0,0,0,1,0,0|3,0,0]=4 3008 B8R1.2 O=CC1=CCCCC1 Amb33545149 [0,0,0,1,0,0|0,0,2]=3 3009 B8R1.2 O=CC1=CCCNC1 Amb27833007 [0,0,0,1,0,0|1,0,2]=4 3010 B8R1.2 O=CC1=CCCOC1 Amb1102766 [0,0,0,1,0,0|1,0,2]=4 3011 B8R1.2 O=CC1=CCCSC1 Amb18642670 [0,0,0,1,0,0|1,0,2]=4 3012 B8R1.2 O=CC1=CCOCC1 Amb18641683 [0,0,0,1,0,0|1,0,2]=4 3013 B8R1.2 O=CC1=COCCC1 Amb2433566 [0,0,0,1,0,0|1,0,2]=4 3014 B8R1.2 O=CC1=CSCCC1 Amb28316147 [0,0,0,1,0,0|1,0,2]=4 3015 B8R1.2 O=CC1C=CCCC1 Amb18641614 [0,0,0,1,0,0|0,0,2]=3 3016 B8R1.2 O=CC1CC=CCC1 Amb3372080 [0,0,0,1,0,0|0,0,2]=3 3017 B8R1.2 O=CC1CC=CSC1 Amb27434846 [0,0,0,1,0,0|1,0,2]=4 3018 B8R1.2 O=CC1CCC=CO1 Amb3939141 [0,0,0,1,0,0|1,0,2]=4 3019 B8R1.2 O=CC1CCCCC1 Amb3939850 [0,0,0,1,0,0|0,0,0]=1 3020 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,0,0,1,0,0|1,0,0]=2 3021 B8R1.2 O=CC1CCCCN1 Amb8384317 [0,0,0,1,0,0|1,0,0]=2 3022 B8R1.2 O=CC1CCCCO1 Amb8009759 [0,0,0,1,0,0|1,0,0]=2 3023 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,0,0,1,0,0|1,0,0]=2 3024 B8R1.2 O=CC1CCCNC1 Amb18833063 [0,0,0,1,0,0|1,0,0]=2 3025 B8R1.2 O=CC1CCCOC1 Amb8009553 [0,0,0,1,0,0|1,0,0]=2 3026 B8R1.2 O=CC1CCCSC1 Amb18642817 [0,0,0,1,0,0|1,0,0]=2 3027 B8R1.2 O=CC1CCNCC1 Amb16232416 [0,0,0,1,0,0|1,0,0]=2 3028 B8R1.2 O=CC1CCNCC1 Amb8630349 [0,0,0,1,0,0|1,0,0]=2 3029 B8R1.2 O=CC1CCOCC1 Amb2683355 [0,0,0,1,0,0|1,0,0]=2 3030 B8R1.2 O=CC1CCSCC1 Amb2683357 [0,0,0,1,0,0|1,0,0]=2 3031 B8R1.2 O=CC1CN=CNC1 Amb27849914 [0,0,0,1,0,0|2,0,1]=4 3032 B8R1.2 O=CC1COCCN1 Amb18833023 [0,0,0,1,0,0|2,0,0]=3 3033 B8R1.2 O=CC1COCCO1 Amb8011456 [0,0,0,1,0,0|2,0,0]=3 3034 B8R1.2 O=CN1C=CCCC1 Amb22371093 [0,0,0,1,0,0|1,0,2]=4 3035 B8R1.2 O=CN1CCCCC1 Amb2720341 [0,0,0,1,0,0|1,0,0]=2 3036 B8R1.2 O=CN1CCNCC1 Amb1663437 [0,0,0,1,0,0|2,0,0]=3 3037 B8R1.2 O=CN1CCOCC1 Amb2720735 [0,0,0,1,0,0|2,0,0]=3 3038 B8R1.2 O=CN1CCSCC1 Amb28254656 [0,0,0,1,0,0|2,0,0]=3 3039 B8R1.2 O=C[C@@H]1CC=CCC1 Amb27966684 [0,0,0,1,0,0|0,0,2]=3 3040 B8R1.2 O=C[C@@H]1CCC=CO1 Amb28284610 [0,0,0,1,0,0|1,0,2]=4 3041 B8R1.2 O=C[C@@H]1CCCCN1 Amb27468660 [0,0,0,1,0,0|1,0,0]=2 3042 B8R1.2 O=C[C@@H]1CCCOC1 Amb27843270 [0,0,0,1,0,0|1,0,0]=2 3043 B8R1.2 O=C[C@H]1CC=CCC1 Amb533150 [0,0,0,1,0,0|0,0,2]=3 3044 B8R1.2 O=C[C@H]1CCCCN1 Amb27203300 [0,0,0,1,0,0|1,0,0]=2 3045 B8R1.2 O=NN1CCCCC1 Amb10604043 [0,0,0,1,0,0|2,0,0]=3 3046 B8R1.2 O=NN1CCCCO1 Amb27472845 [0,0,0,1,0,0|3,0,0]=4 3047 B8R1.2 O=NN1CCCOC1 Amb26515732 [0,0,0,1,0,0|3,0,0]=4 3048 B8R1.2 O=NN1CCNCC1 Amb10976905 [0,0,0,1,0,0|3,0,0]=4 3049 B8R1.2 O=NN1CCOCC1 Amb8630843 [0,0,0,1,0,0|3,0,0]=4 3050 B8R1.2 O=NN1CCSCC1 Amb28340927 [0,0,0,1,0,0|3,0,0]=4 3051 B8R1.2 OCC1C=CCCC1 Amb17593156 [0,0,0,1,0,0|2,0,0]=3 3052 B8R1.2 OCC1C=CCCN1 Amb32683449 [0,0,0,1,0,0|3,0,0]=4 3053 B8R1.2 OCC1C=CCCO1 Amb27249902 [0,0,0,1,0,0|3,0,0]=4 3054 B8R1.2 OCC1C=CCOC1 Amb27755980 [0,0,0,1,0,0|3,0,0]=4 3055 B8R1.2 OCC1CC=CCC1 Amb3939071 [0,0,0,1,0,0|2,0,1]=4 3056 B8R1.2 OCC1CCC=CO1 Amb3939374 [0,0,0,1,0,0|1,0,2]=4 3057 B8R1.2 OCC1CCCCC1 Amb3939316 [0,0,0,1,0,0|0,0,2]=3 3058 B8R1.2 OCC1CCCCN1 Amb6768986 [0,0,0,1,0,0|1,0,2]=4 3059 B8R1.2 OCC1CCCCN1 Amb9703110 [0,0,0,1,0,0|1,0,2]=4 3060 B8R1.2 OCC1CCCCO1 Amb9703167 [0,0,0,1,0,0|1,0,2]=4 3061 B8R1.2 OCC1CCCCS1 Amb20669084 [0,0,0,1,0,0|1,0,2]=4 3062 B8R1.2 OCC1CCCNC1 Amb22001796 [0,0,0,1,0,0|1,0,2]=4 3063 B8R1.2 OCC1CCCNC1 Amb2695684 [0,0,0,1,0,0|1,0,2]=4 3064 B8R1.2 OCC1CCCOC1 Amb1093253 [0,0,0,1,0,0|1,0,2]=4 3065 B8R1.2 OCC1CCCSC1 Amb18202835 [0,0,0,1,0,0|1,0,2]=4 3066 B8R1.2 OCC1CCNCC1 Amb20242610 [0,0,0,1,0,0|1,0,2]=4 3067 B8R1.2 OCC1CCNCC1 Amb2695656 [0,0,0,1,0,0|1,0,2]=4 3068 B8R1.2 OCC1CCOCC1 Amb2684132 [0,0,0,1,0,0|1,0,2]=4 3069 B8R1.2 OCC1CCSCC1 Amb7990078 [0,0,0,1,0,0|1,0,2]=4 3070 B8R1.2 OCN1CCCCC1 Amb25949562 [0,0,0,1,0,0|1,0,2]=4 3071 B8R1.2 OC[C@@H]1C=CCOC1 Amb27398322 [0,0,0,1,0,0|3,0,0]=4 3072 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,0,0,1,0,0|1,0,2]=4 3073 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,0,0,1,0,0|1,0,2]=4 3074 B8R1.2 OC[C@@H]1CCCNC1 Amb10603201 [0,0,0,1,0,0|1,0,2]=4 3075 B8R1.2 OC[C@@H]1CCCNC1 Amb22504548 [0,0,0,1,0,0|1,0,2]=4 3076 B8R1.2 OC[C@@H]1CCCNN1 Amb28138668 [0,0,0,1,0,0|3,0,0]=4 3077 B8R1.2 OC[C@@H]1CCCOC1 Amb27236984 [0,0,0,1,0,0|1,0,2]=4 3078 B8R1.2 OC[C@H]1CCC=CO1 Amb27771482 [0,0,0,1,0,0|1,0,2]=4 3079 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,0,0,1,0,0|1,0,2]=4 3080 B8R1.2 OC[C@H]1CCCCO1 Amb25873825 [0,0,0,1,0,0|1,0,2]=4 3081 B8R1.2 OC[C@H]1CCCNC1 Amb10603243 [0,0,0,1,0,0|1,0,2]=4 3082 B8R1.2 OC[C@H]1CCCNC1 Amb22388477 [0,0,0,1,0,0|1,0,2]=4 3083 B8R1.2 OC[C@H]1CCCOC1 Amb24413844 [0,0,0,1,0,0|1,0,2]=4 3084 B8R1.2 ON=C1CCCCC1 Amb6364727 [0,0,0,1,0,0|1,0,2]=4 3085 B8R1.2 ONC1CCCCO1 Amb27428911 [0,0,0,1,0,0|2,0,1]=4 3086 B8R1.2 ONC1CCCNC1 Amb28048987 [0,0,0,1,0,0|2,0,1]=4 3087 B8R1.2 O[NH2+]C1CCCCC1 Amb9826874 [0,0,0,1,0,0|1,0,1]=3 3088 B8R1.2 SCC1CC=CCC1 Amb29866611 [0,0,0,1,0,0|2,0,1]=4 3089 B8R1.2 SCC1CCC=CO1 Amb32788204 [0,0,0,1,0,0|1,0,2]=4 3090 B8R1.2 SCC1CCCCC1 Amb6255606 [0,0,0,1,0,0|0,1,1]=3 3091 B8R1.2 SCC1CCCCN1 Amb26349710 [0,0,0,1,0,0|1,1,1]=4 3092 B8R1.2 SCC1CCCCO1 Amb23585661 [0,0,0,1,0,0|1,0,2]=4 3093 B8R1.2 SCC1CCCNC1 Amb17503130 [0,0,0,1,0,0|1,1,1]=4 3094 B8R1.2 SCC1CCCOC1 Amb26590340 [0,0,0,1,0,0|1,1,1]=4 3095 B8R1.2 SCC1CCCSC1 Amb32788278 [0,0,0,1,0,0|1,1,1]=4 3096 B8R1.2 SCC1CCNCC1 Amb17503031 [0,0,0,1,0,0|1,1,1]=4 3097 B8R1.2 SCC1CCOCC1 Amb25708148 [0,0,0,1,0,0|1,1,1]=4 3098 B8R1.2 [C-]#[N+]C1CCCCC1 Amb2235424 [0,0,0,1,0,0|2,0,0]=3 3099 B8R1.2 [C-]#[N+]C1CCCCN1 Amb28129502 [0,0,0,1,0,0|3,0,0]=4 3100 B8R1.2 [C-]#[N+]C1CCCCS1 Amb27872577 [0,0,0,1,0,0|3,0,0]=4 3101 B8R1.2 [C-]#[N+]C1CCCNC1 Amb28071481 [0,0,0,1,0,0|3,0,0]=4 3102 B8R1.2 [C-]#[N+]C1CCCOC1 Amb33323212 [0,0,0,1,0,0|3,0,0]=4 3103 B8R1.2 [C-]#[N+]C1CCCSC1 Amb32726266 [0,0,0,1,0,0|3,0,0]=4 3104 B8R1.2 [C-]#[N+]C1CCOCC1 Amb25189058 [0,0,0,1,0,0|3,0,0]=4 3105 B8R1.2 [CH2-]CC1CCCCC1 Amb24117227 [0,0,0,1,0,0|1,0,1]=3 3106 B8R1.5 BrC1=CCCCC1Br Amb25255682 [0,0,0,1,0,0|2,0,1]=4 3107 B8R1.5 BrC1CCCCC1Br Amb10563786 [0,0,0,1,0,0|2,0,1]=4 3108 B8R1.5 BrC1CCCC[C@H]1Br Amb30866922 [0,0,0,1,0,0|2,0,1]=4 3109 B8R1.5 Br[C@H]1CCCC[C@@H]1Br Amb27800706 [0,0,0,1,0,0|2,0,1]=4 3110 B8R1.5 Br[C@H]1CCCC[C@H]1Br Amb33827804 [0,0,0,1,0,0|2,0,1]=4 3111 B8R1.5 C=C1CCCCC1=C Amb8392110 [0,0,0,1,0,0|1,0,2]=4 3112 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,0,0,1,0,0|0,0,2]=3 3113 B8R1.5 C=C1CCCCC1C Amb25203919 [0,0,0,1,0,0|1,0,0]=2 3114 B8R1.5 C=C1CCCCC1Cl Amb27858823 [0,0,0,1,0,0|2,0,0]=3 3115 B8R1.5 C=C1CCCCC1O Amb28316215 [0,0,0,1,0,0|2,0,0]=3 3116 B8R1.5 C=C1CCCC[C@@H]1N Amb27252272 [0,0,0,1,0,0|2,0,0]=3 3117 B8R1.5 C=C1COCCC1=O Amb18063600 [0,0,0,1,0,0|1,0,2]=4 3118 B8R1.5 C=C1NCCCC1F Amb28384341 [0,0,0,1,0,0|3,0,0]=4 3119 B8R1.5 CC1=C(Br)CNCC1 Amb25046045 [0,0,0,1,0,0|2,0,1]=4 3120 B8R1.5 CC1=C(Br)CNCC1 Amb33473572 [0,0,0,1,0,0|2,0,1]=4 3121 B8R1.5 CC1=C(C)CCCC1 Amb4019565 [0,0,0,1,0,0|1,0,1]=3 3122 B8R1.5 CC1=C(C)CNCC1 Amb18641667 [0,0,0,1,0,0|2,0,1]=4 3123 B8R1.5 CC1=C(C)CNCC1 Amb28934860 [0,0,0,1,0,0|2,0,1]=4 3124 B8R1.5 CC1=C(C)NCCC1 Amb27489342 [0,0,0,1,0,0|2,0,1]=4 3125 B8R1.5 CC1=CCCCC1=O Amb15693479 [0,0,0,1,0,0|0,0,2]=3 3126 B8R1.5 CC1=CCCCC1Br Amb27856502 [0,0,0,1,0,0|2,0,1]=4 3127 B8R1.5 CC1=CCCCC1C Amb22489910 [0,0,0,1,0,0|1,0,1]=3 3128 B8R1.5 CC1=CCCCC1Cl Amb28207840 [0,0,0,1,0,0|2,0,1]=4 3129 B8R1.5 CC1=CCCCC1O Amb22365276 [0,0,0,1,0,0|2,0,1]=4 3130 B8R1.5 CC1=COCCC1=O Amb28048981 [0,0,0,1,0,0|1,0,2]=4 3131 B8R1.5 CC1=NCCCC1=O Amb27803670 [0,0,0,1,0,0|1,0,1]=3 3132 B8R1.5 CC1=NCCCN1C Amb1035887 [0,0,0,1,0,0|3,0,0]=4 3133 B8R1.5 CC1=NCCOC1=O Amb27623377 [0,0,0,1,0,0|2,0,1]=4 3134 B8R1.5 CC1CC=CCC1=O Amb17593140 [0,0,0,1,0,0|0,0,2]=3 3135 B8R1.5 CC1CC=NNC1=O Amb22752103 [0,0,0,1,0,0|2,0,1]=4 3136 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,0,0,1,0,0|0,0,2]=3 3137 B8R1.5 CC1CCCCC1=O Amb6608749 [0,0,0,1,0,0|0,0,0]=1 3138 B8R1.5 CC1CCCCC1Br Amb8835443 [0,0,0,1,0,0|1,0,1]=3 3139 B8R1.5 CC1CCCCC1C Amb8513143 [0,0,0,1,0,0|1,0,1]=3 3140 B8R1.5 CC1CCCCC1Cl Amb9205060 [0,0,0,1,0,0|1,0,1]=3 3141 B8R1.5 CC1CCCCC1N Amb9702773 [0,0,0,1,0,0|1,0,1]=3 3142 B8R1.5 CC1CCCCC1O Amb3940289 [0,0,0,1,0,0|0,0,2]=3 3143 B8R1.5 CC1CCCCC1S Amb9208050 [0,0,0,1,0,0|0,1,1]=3 3144 B8R1.5 CC1CCCCN1C Amb9787355 [0,0,0,1,0,0|2,0,0]=3 3145 B8R1.5 CC1CCCCN1N Amb17231818 [0,0,0,1,0,0|2,0,0]=3 3146 B8R1.5 CC1CCCCN1O Amb28121416 [0,0,0,1,0,0|1,0,1]=3 3147 B8R1.5 CC1CCCN=C1N Amb26551145 [0,0,0,1,0,0|2,0,0]=3 3148 B8R1.5 CC1CCCNC1=O Amb2778949 [0,0,0,1,0,0|1,0,0]=2 3149 B8R1.5 CC1CCCNC1C Amb1089738 [0,0,0,1,0,0|2,0,1]=4 3150 B8R1.5 CC1CCCNC1C Amb19338160 [0,0,0,1,0,0|2,0,1]=4 3151 B8R1.5 CC1CCCOC1=O Amb26933974 [0,0,0,1,0,0|1,0,0]=2 3152 B8R1.5 CC1CCCOC1O Amb28207170 [0,0,0,1,0,0|1,0,2]=4 3153 B8R1.5 CC1CCNCC1=O Amb28990014 [0,0,0,1,0,0|1,0,0]=2 3154 B8R1.5 CC1CCNCC1=O Amb8388554 [0,0,0,1,0,0|1,0,0]=2 3155 B8R1.5 CC1CCNCC1C Amb22059495 [0,0,0,1,0,0|2,0,1]=4 3156 B8R1.5 CC1CCNCC1F Amb27476489 [0,0,0,1,0,0|2,0,1]=4 3157 B8R1.5 CC1CCNCC1F Amb32941869 [0,0,0,1,0,0|2,0,1]=4 3158 B8R1.5 CC1CCNCC1N Amb19374853 [0,0,0,1,0,0|2,0,1]=4 3159 B8R1.5 CC1CCNCC1O Amb22406220 [0,0,0,1,0,0|1,0,2]=4 3160 B8R1.5 CC1CCNCC1O Amb23440259 [0,0,0,1,0,0|1,0,2]=4 3161 B8R1.5 CC1CCOCC1=O Amb25718285 [0,0,0,1,0,0|1,0,0]=2 3162 B8R1.5 CC1CNCCC1=O Amb19888361 [0,0,0,1,0,0|1,0,0]=2 3163 B8R1.5 CC1CNCCC1=O Amb8393082 [0,0,0,1,0,0|1,0,0]=2 3164 B8R1.5 CC1CNCCC1Br Amb25125494 [0,0,0,1,0,0|2,0,1]=4 3165 B8R1.5 CC1CNCCC1F Amb26572956 [0,0,0,1,0,0|2,0,1]=4 3166 B8R1.5 CC1CNCCC1N Amb23440690 [0,0,0,1,0,0|2,0,1]=4 3167 B8R1.5 CC1CNCCC1O Amb33544532 [0,0,0,1,0,0|1,0,2]=4 3168 B8R1.5 CC1CNCCC1O Amb4362742 [0,0,0,1,0,0|1,0,2]=4 3169 B8R1.5 CC1CNCCC1S Amb26641892 [0,0,0,1,0,0|1,1,1]=4 3170 B8R1.5 CC1CNCCN1C Amb19148798 [0,0,0,1,0,0|3,0,0]=4 3171 B8R1.5 CC1CNCCN1C Amb22586682 [0,0,0,1,0,0|3,0,0]=4 3172 B8R1.5 CC1CNCCN1C Amb2694471 [0,0,0,1,0,0|3,0,0]=4 3173 B8R1.5 CC1CNCCS1=O Amb19515549 [0,0,0,1,0,0|2,0,0]=3 3174 B8R1.5 CC1COC=CC1=O Amb28124249 [0,0,0,1,0,0|1,0,2]=4 3175 B8R1.5 CC1COCCC1=O Amb21856147 [0,0,0,1,0,0|1,0,0]=2 3176 B8R1.5 CC1COCCC1Br Amb27242904 [0,0,0,1,0,0|2,0,1]=4 3177 B8R1.5 CC1COCCC1N Amb18833016 [0,0,0,1,0,0|2,0,1]=4 3178 B8R1.5 CC1COCCC1N Amb28934837 [0,0,0,1,0,0|2,0,1]=4 3179 B8R1.5 CC1COCCC1O Amb22299437 [0,0,0,1,0,0|1,0,2]=4 3180 B8R1.5 CC1COCCC1S Amb22299438 [0,0,0,1,0,0|1,1,1]=4 3181 B8R1.5 CC1COCCN1N Amb18559532 [0,0,0,1,0,0|3,0,0]=4 3182 B8R1.5 CC1CSCCC1=O Amb26404796 [0,0,0,1,0,0|1,0,0]=2 3183 B8R1.5 CC1CSCCC1N Amb18202892 [0,0,0,1,0,0|2,0,1]=4 3184 B8R1.5 CC1CSCCC1O Amb26370414 [0,0,0,1,0,0|1,0,2]=4 3185 B8R1.5 CC1NCCCC1=O Amb26633057 [0,0,0,1,0,0|1,0,0]=2 3186 B8R1.5 CC1NCCCC1=O Amb32695440 [0,0,0,1,0,0|1,0,0]=2 3187 B8R1.5 CC1NCCCC1N Amb24715672 [0,0,0,1,0,0|2,0,1]=4 3188 B8R1.5 CC1NCCCC1O Amb27839609 [0,0,0,1,0,0|1,0,2]=4 3189 B8R1.5 CC1NCCCC1O Amb28934842 [0,0,0,1,0,0|1,0,2]=4 3190 B8R1.5 CC1NCCCC1S Amb32788772 [0,0,0,1,0,0|1,1,1]=4 3191 B8R1.5 CC1NCCNC1=O Amb5846691 [0,0,0,1,0,0|2,0,0]=3 3192 B8R1.5 CC1NCCNC1=O Amb9778910 [0,0,0,1,0,0|2,0,0]=3 3193 B8R1.5 CC1NCCSC1=O Amb27489291 [0,0,0,1,0,0|2,0,0]=3 3194 B8R1.5 CC1OCC=CC1=O Amb28316168 [0,0,0,1,0,0|1,0,2]=4 3195 B8R1.5 CC1OCCCC1=O Amb28048940 [0,0,0,1,0,0|1,0,0]=2 3196 B8R1.5 CC1OCCCC1Br Amb22500038 [0,0,0,1,0,0|2,0,1]=4 3197 B8R1.5 CC1OCCNC1=O Amb19517095 [0,0,0,1,0,0|2,0,0]=3 3198 B8R1.5 CC1SCCCC1=O Amb25989585 [0,0,0,1,0,0|1,0,0]=2 3199 B8R1.5 CC1SCCCC1Br Amb24483260 [0,0,0,1,0,0|2,0,1]=4 3200 B8R1.5 CC1SCCCC1N Amb24699153 [0,0,0,1,0,0|2,0,1]=4 3201 B8R1.5 CC1SCCCC1O Amb26865931 [0,0,0,1,0,0|1,0,2]=4 3202 B8R1.5 CC1SCCCC1S Amb24658420 [0,0,0,1,0,0|1,1,1]=4 3203 B8R1.5 CC1SCCNC1=O Amb4009235 [0,0,0,1,0,0|2,0,0]=3 3204 B8R1.5 CN1CCC=CC1=O Amb22500738 [0,0,0,1,0,0|1,0,2]=4 3205 B8R1.5 CN1CCCCC1Br Amb28318404 [0,0,0,1,0,0|2,0,1]=4 3206 B8R1.5 CN1CCCN=C1N Amb27838391 [0,0,0,1,0,0|3,0,0]=4 3207 B8R1.5 CN1CCCNC1=O Amb10608416 [0,0,0,1,0,0|2,0,0]=3 3208 B8R1.5 CN1CCCNC1=O Amb32665804 [0,0,0,1,0,0|2,0,0]=3 3209 B8R1.5 CN1CCCNC1=S Amb4012380 [0,0,0,1,0,0|2,1,0]=4 3210 B8R1.5 CN1CCC[NH+]=C1N Amb4006104 [0,0,0,1,0,0|3,0,0]=4 3211 B8R1.5 CN1CCNCC1=O Amb1834069 [0,0,0,1,0,0|2,0,0]=3 3212 B8R1.5 CN1CCNCC1=O Amb6540859 [0,0,0,1,0,0|2,0,0]=3 3213 B8R1.5 CN1CCOCC1=O Amb22301593 [0,0,0,1,0,0|2,0,0]=3 3214 B8R1.5 CN1CNCCC1=O Amb27409650 [0,0,0,1,0,0|2,0,0]=3 3215 B8R1.5 CN1NCCCC1=O Amb18559232 [0,0,0,1,0,0|2,0,0]=3 3216 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,0,0,1,0,0|0,0,2]=3 3217 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22746982 [0,0,0,1,0,0|1,0,1]=3 3218 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22899193 [0,0,0,1,0,0|1,0,1]=3 3219 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,0,0,1,0,0|0,0,2]=3 3220 B8R1.5 C[C@@H]1CCCC[C@H]1Br Amb27250883 [0,0,0,1,0,0|1,0,1]=3 3221 B8R1.5 C[C@@H]1CCCC[C@H]1C Amb22801359 [0,0,0,1,0,0|1,0,1]=3 3222 B8R1.5 C[C@@H]1CCCC[C@H]1N Amb8393225 [0,0,0,1,0,0|1,0,1]=3 3223 B8R1.5 C[C@@H]1CCCC[C@H]1O Amb2780856 [0,0,0,1,0,0|0,0,2]=3 3224 B8R1.5 C[C@@H]1CCCN[C@@H]1C Amb34912851 [0,0,0,1,0,0|2,0,1]=4 3225 B8R1.5 C[C@@H]1CCCO[C@@H]1O Amb27452063 [0,0,0,1,0,0|1,0,2]=4 3226 B8R1.5 C[C@@H]1CCNC[C@@H]1F Amb33338925 [0,0,0,1,0,0|2,0,1]=4 3227 B8R1.5 C[C@@H]1CCNC[C@@H]1F Amb33338926 [0,0,0,1,0,0|2,0,1]=4 3228 B8R1.5 C[C@@H]1CCNC[C@@H]1N Amb32667966 [0,0,0,1,0,0|2,0,1]=4 3229 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb22886317 [0,0,0,1,0,0|1,0,2]=4 3230 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb24694415 [0,0,0,1,0,0|1,0,2]=4 3231 B8R1.5 C[C@@H]1CCNC[C@H]1N Amb26959701 [0,0,0,1,0,0|2,0,1]=4 3232 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb22886316 [0,0,0,1,0,0|1,0,2]=4 3233 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb24553941 [0,0,0,1,0,0|1,0,2]=4 3234 B8R1.5 C[C@@H]1CCOC[C@H]1O Amb28345042 [0,0,0,1,0,0|1,0,2]=4 3235 B8R1.5 C[C@@H]1CNCCN1C Amb18833029 [0,0,0,1,0,0|3,0,0]=4 3236 B8R1.5 C[C@@H]1CNCCN1C Amb22745842 [0,0,0,1,0,0|3,0,0]=4 3237 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb22232040 [0,0,0,1,0,0|1,0,2]=4 3238 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb31291752 [0,0,0,1,0,0|1,0,2]=4 3239 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22270263 [0,0,0,1,0,0|1,0,2]=4 3240 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22757834 [0,0,0,1,0,0|1,0,2]=4 3241 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,0,0,1,0,0|2,0,1]=4 3242 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,0,0,1,0,0|2,0,1]=4 3243 B8R1.5 C[C@@H]1COCC[C@H]1N Amb25929881 [0,0,0,1,0,0|2,0,1]=4 3244 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb26431095 [0,0,0,1,0,0|1,0,2]=4 3245 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb32680789 [0,0,0,1,0,0|1,0,2]=4 3246 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,0,0,1,0,0|2,0,0]=3 3247 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [0,0,0,1,0,0|1,0,0]=2 3248 B8R1.5 C[C@@H]1OCCC[C@H]1Br Amb27444138 [0,0,0,1,0,0|2,0,1]=4 3249 B8R1.5 C[C@@H]1OCCC[C@H]1Cl Amb27453022 [0,0,0,1,0,0|2,0,1]=4 3250 B8R1.5 C[C@@H]1SCCNC1=O Amb34915743 [0,0,0,1,0,0|2,0,0]=3 3251 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,0,0,1,0,0|0,0,2]=3 3252 B8R1.5 C[C@H]1CCCC[C@@H]1C Amb6298314 [0,0,0,1,0,0|1,0,1]=3 3253 B8R1.5 C[C@H]1CCCC[C@@H]1Cl Amb27198993 [0,0,0,1,0,0|1,0,1]=3 3254 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,0,0,1,0,0|0,0,2]=3 3255 B8R1.5 C[C@H]1CCCC[C@H]1Br Amb27656872 [0,0,0,1,0,0|1,0,1]=3 3256 B8R1.5 C[C@H]1CCCC[C@H]1C Amb6298877 [0,0,0,1,0,0|1,0,1]=3 3257 B8R1.5 C[C@H]1CCCC[C@H]1N Amb25911858 [0,0,0,1,0,0|1,0,1]=3 3258 B8R1.5 C[C@H]1CCCC[C@H]1N Amb33620881 [0,0,0,1,0,0|1,0,1]=3 3259 B8R1.5 C[C@H]1CCCNC1=O Amb27648584 [0,0,0,1,0,0|1,0,0]=2 3260 B8R1.5 C[C@H]1CCCO[C@@H]1O Amb27452053 [0,0,0,1,0,0|1,0,2]=4 3261 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb26892110 [0,0,0,1,0,0|1,0,2]=4 3262 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb33726126 [0,0,0,1,0,0|1,0,2]=4 3263 B8R1.5 C[C@H]1CCNC[C@H]1O Amb25339261 [0,0,0,1,0,0|1,0,2]=4 3264 B8R1.5 C[C@H]1CCNC[C@H]1O Amb32409390 [0,0,0,1,0,0|1,0,2]=4 3265 B8R1.5 C[C@H]1CCOC[C@H]1O Amb27484771 [0,0,0,1,0,0|1,0,2]=4 3266 B8R1.5 C[C@H]1CNCCN1C Amb22587566 [0,0,0,1,0,0|3,0,0]=4 3267 B8R1.5 C[C@H]1CNCCN1C Amb33725445 [0,0,0,1,0,0|3,0,0]=4 3268 B8R1.5 C[C@H]1CNCC[C@@H]1O Amb24059398 [0,0,0,1,0,0|1,0,2]=4 3269 B8R1.5 C[C@H]1COCC[C@@H]1N Amb27440842 [0,0,0,1,0,0|2,0,1]=4 3270 B8R1.5 C[C@H]1COCC[C@@H]1N Amb33726124 [0,0,0,1,0,0|2,0,1]=4 3271 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,0,0,1,0,0|2,0,1]=4 3272 B8R1.5 C[C@H]1COCC[C@H]1N Amb32409393 [0,0,0,1,0,0|2,0,1]=4 3273 B8R1.5 C[C@H]1CSCC[C@@H]1O Amb28286731 [0,0,0,1,0,0|1,0,2]=4 3274 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,0,0,1,0,0|2,0,0]=3 3275 B8R1.5 C[C@H]1SCCNC1=O Amb27810802 [0,0,0,1,0,0|2,0,0]=3 3276 B8R1.5 ClC1CCCCC1Br Amb27477421 [0,0,0,1,0,0|2,0,1]=4 3277 B8R1.5 Cl[C@@H]1CCCC[C@H]1Br Amb24308900 [0,0,0,1,0,0|2,0,1]=4 3278 B8R1.5 Cl[C@@H]1CCCC[C@H]1Cl Amb8513105 [0,0,0,1,0,0|2,0,1]=4 3279 B8R1.5 Cl[C@H]1CCCC[C@@H]1Br Amb26073947 [0,0,0,1,0,0|2,0,1]=4 3280 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl Amb27800760 [0,0,0,1,0,0|2,0,1]=4 3281 B8R1.5 Cl[C@H]1CCCC[C@H]1Br Amb28068995 [0,0,0,1,0,0|2,0,1]=4 3282 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl Amb2720826 [0,0,0,1,0,0|2,0,1]=4 3283 B8R1.5 FC1=CCCCC1Br Amb28325638 [0,0,0,1,0,0|2,0,1]=4 3284 B8R1.5 FC1CCCCC1Br Amb10841597 [0,0,0,1,0,0|2,0,1]=4 3285 B8R1.5 FC1CCCCC1I Amb28320496 [0,0,0,1,0,0|2,0,1]=4 3286 B8R1.5 F[C@@H]1CCCC[C@H]1Br Amb27447303 [0,0,0,1,0,0|2,0,1]=4 3287 B8R1.5 F[C@H]1CCCC[C@@H]1Br Amb27440070 [0,0,0,1,0,0|2,0,1]=4 3288 B8R1.5 F[C@H]1CCCC[C@H]1Cl Amb27878815 [0,0,0,1,0,0|2,0,1]=4 3289 B8R1.5 NC1=NCCCC1=O Amb28399329 [0,0,0,1,0,0|2,0,1]=4 3290 B8R1.5 NC1=NCCCC1Cl Amb27391114 [0,0,0,1,0,0|3,0,0]=4 3291 B8R1.5 NC1=NCCCC1O Amb27985373 [0,0,0,1,0,0|3,0,0]=4 3292 B8R1.5 NC1CCCC=C1Br Amb27974263 [0,0,0,1,0,0|2,0,1]=4 3293 B8R1.5 NC1CCCC=C1Br Amb33338965 [0,0,0,1,0,0|2,0,1]=4 3294 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,0,0,1,0,0|2,0,1]=4 3295 B8R1.5 NC1CCCCC1=O Amb17939051 [0,0,0,1,0,0|1,0,0]=2 3296 B8R1.5 NC1CCCCC1=O Amb22001819 [0,0,0,1,0,0|1,0,0]=2 3297 B8R1.5 NC1CCCCC1Br Amb20622391 [0,0,0,1,0,0|2,0,1]=4 3298 B8R1.5 NC1CCCCC1Br Amb27267997 [0,0,0,1,0,0|2,0,1]=4 3299 B8R1.5 NC1CCCCC1Cl Amb20622338 [0,0,0,1,0,0|2,0,1]=4 3300 B8R1.5 NC1CCCCC1Cl Amb27776644 [0,0,0,1,0,0|2,0,1]=4 3301 B8R1.5 NC1CCCCC1F Amb22886179 [0,0,0,1,0,0|2,0,1]=4 3302 B8R1.5 NC1CCCCC1F Amb25831178 [0,0,0,1,0,0|2,0,1]=4 3303 B8R1.5 NC1CCCCC1F Amb32653040 [0,0,0,1,0,0|2,0,1]=4 3304 B8R1.5 NC1CCCCC1I Amb28194292 [0,0,0,1,0,0|2,0,1]=4 3305 B8R1.5 NC1CCCCC1N Amb32666334 [0,0,0,1,0,0|2,0,1]=4 3306 B8R1.5 NC1CCCCC1N Amb9703103 [0,0,0,1,0,0|2,0,1]=4 3307 B8R1.5 NC1CCCCC1O Amb22228578 [0,0,0,1,0,0|1,0,2]=4 3308 B8R1.5 NC1CCCCC1O Amb31302362 [0,0,0,1,0,0|1,0,2]=4 3309 B8R1.5 NC1CCCCC1O Amb3428551 [0,0,0,1,0,0|1,0,2]=4 3310 B8R1.5 NC1CCCCC1S Amb24117988 [0,0,0,1,0,0|1,1,1]=4 3311 B8R1.5 NC1CCCC[C@H]1N Amb9787721 [0,0,0,1,0,0|2,0,1]=4 3312 B8R1.5 NC1CCCNC1=O Amb1088746 [0,0,0,1,0,0|2,0,0]=3 3313 B8R1.5 NC1CCCNC1=O Amb8428208 [0,0,0,1,0,0|2,0,0]=3 3314 B8R1.5 NC1CCONC1=O Amb22295935 [0,0,0,1,0,0|3,0,0]=4 3315 B8R1.5 NC1CNCCC1=O Amb27635311 [0,0,0,1,0,0|2,0,0]=3 3316 B8R1.5 NC1COCCC1=O Amb18833021 [0,0,0,1,0,0|2,0,0]=3 3317 B8R1.5 NC1COCCC1=O Amb32670691 [0,0,0,1,0,0|2,0,0]=3 3318 B8R1.5 NC1CSCCC1=O Amb4296938 [0,0,0,1,0,0|2,0,0]=3 3319 B8R1.5 NN1CCCCC1=O Amb13952152 [0,0,0,1,0,0|2,0,0]=3 3320 B8R1.5 NN1CCCCC1=O Amb22275946 [0,0,0,1,0,0|2,0,0]=3 3321 B8R1.5 NN1CCCNC1=O Amb25343173 [0,0,0,1,0,0|3,0,0]=4 3322 B8R1.5 NN1CCCOC1=O Amb17608306 [0,0,0,1,0,0|3,0,0]=4 3323 B8R1.5 NN1CCOCC1=O Amb27238452 [0,0,0,1,0,0|3,0,0]=4 3324 B8R1.5 N[C@@H]1CCCC[C@@H]1Br Amb35750364 [0,0,0,1,0,0|2,0,1]=4 3325 B8R1.5 N[C@@H]1CCCC[C@@H]1Br Amb35752107 [0,0,0,1,0,0|2,0,1]=4 3326 B8R1.5 N[C@@H]1CCCC[C@@H]1F Amb26885648 [0,0,0,1,0,0|2,0,1]=4 3327 B8R1.5 N[C@@H]1CCCC[C@@H]1F Amb32660921 [0,0,0,1,0,0|2,0,1]=4 3328 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [0,0,0,1,0,0|1,0,2]=4 3329 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [0,0,0,1,0,0|1,0,2]=4 3330 B8R1.5 N[C@@H]1CCCC[C@H]1Br Amb27781093 [0,0,0,1,0,0|2,0,1]=4 3331 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb22831446 [0,0,0,1,0,0|2,0,1]=4 3332 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb22886180 [0,0,0,1,0,0|2,0,1]=4 3333 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb33379067 [0,0,0,1,0,0|2,0,1]=4 3334 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb32662723 [0,0,0,1,0,0|2,0,1]=4 3335 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb33523993 [0,0,0,1,0,0|2,0,1]=4 3336 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb6296933 [0,0,0,1,0,0|2,0,1]=4 3337 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [0,0,0,1,0,0|1,0,2]=4 3338 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [0,0,0,1,0,0|1,0,2]=4 3339 B8R1.5 N[C@@H]1CCCC[C@H]1S Amb28457242 [0,0,0,1,0,0|1,1,1]=4 3340 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,0,0,1,0,0|2,0,0]=3 3341 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,0,0,1,0,0|2,0,0]=3 3342 B8R1.5 N[C@H]1CCCC[C@@H]1N Amb8396717 [0,0,0,1,0,0|2,0,1]=4 3343 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [0,0,0,1,0,0|1,0,2]=4 3344 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb2612694 [0,0,0,1,0,0|1,0,2]=4 3345 B8R1.5 N[C@H]1CCCC[C@H]1F Amb24117513 [0,0,0,1,0,0|2,0,1]=4 3346 B8R1.5 N[C@H]1CCCC[C@H]1N Amb22745943 [0,0,0,1,0,0|2,0,1]=4 3347 B8R1.5 N[C@H]1CCCC[C@H]1N Amb8396716 [0,0,0,1,0,0|2,0,1]=4 3348 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [0,0,0,1,0,0|1,0,2]=4 3349 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [0,0,0,1,0,0|1,0,2]=4 3350 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,0,0,1,0,0|2,0,0]=3 3351 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,0,0,1,0,0|2,0,0]=3 3352 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,0,0,1,0,0|1,0,2]=4 3353 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,0,0,1,0,0|1,0,2]=4 3354 B8R1.5 O=C1CC=CCC1Cl Amb27471139 [0,0,0,1,0,0|1,0,2]=4 3355 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,0,0,1,0,0|1,0,2]=4 3356 B8R1.5 O=C1CCCC=C1F Amb28253992 [0,0,0,1,0,0|1,0,2]=4 3357 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,0,0,1,0,0|1,0,2]=4 3358 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,0,0,1,0,0|1,0,2]=4 3359 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,0,0,1,0,0|1,0,1]=3 3360 B8R1.5 O=C1CCCCC1Br Amb8394127 [0,0,0,1,0,0|1,0,0]=2 3361 B8R1.5 O=C1CCCCC1Cl Amb1154371 [0,0,0,1,0,0|1,0,0]=2 3362 B8R1.5 O=C1CCCCC1F Amb10605769 [0,0,0,1,0,0|1,0,0]=2 3363 B8R1.5 O=C1CCCCC1I Amb28239314 [0,0,0,1,0,0|1,0,0]=2 3364 B8R1.5 O=C1CCCCC1O Amb8390042 [0,0,0,1,0,0|1,0,0]=2 3365 B8R1.5 O=C1CCCCC1S Amb25839265 [0,0,0,1,0,0|1,0,0]=2 3366 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,0,0,1,0,0|1,0,0]=2 3367 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,0,0,1,0,0|1,0,0]=2 3368 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [0,0,0,1,0,0|1,0,0]=2 3369 B8R1.5 O=C1CCCNC1=O Amb2445649 [0,0,0,1,0,0|2,0,1]=4 3370 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,0,0,1,0,0|2,0,1]=4 3371 B8R1.5 O=C1CCCSC1Cl Amb26534671 [0,0,0,1,0,0|2,0,0]=3 3372 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,0,0,1,0,0|2,0,0]=3 3373 B8R1.5 O=C1CCNCC1F Amb13885958 [0,0,0,1,0,0|2,0,0]=3 3374 B8R1.5 O=C1CCNCC1F Amb22002662 [0,0,0,1,0,0|2,0,0]=3 3375 B8R1.5 O=C1CCNCC1O Amb24075970 [0,0,0,1,0,0|2,0,0]=3 3376 B8R1.5 O=C1CCNCC1O Amb27230548 [0,0,0,1,0,0|2,0,0]=3 3377 B8R1.5 O=C1CCNCN1O Amb24120639 [0,0,0,1,0,0|3,0,0]=4 3378 B8R1.5 O=C1CCNC[C@H]1F Amb27467922 [0,0,0,1,0,0|2,0,0]=3 3379 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,0,0,1,0,0|2,0,0]=3 3380 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,0,0,1,0,0|2,0,0]=3 3381 B8R1.5 O=C1CCOCC1F Amb19958536 [0,0,0,1,0,0|2,0,0]=3 3382 B8R1.5 O=C1CCOCC1O Amb26966688 [0,0,0,1,0,0|2,0,0]=3 3383 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,0,0,1,0,0|2,0,0]=3 3384 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,0,0,1,0,0|2,0,0]=3 3385 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,0,0,1,0,0|2,0,0]=3 3386 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,0,0,1,0,0|2,0,0]=3 3387 B8R1.5 O=C1CCSCC1O Amb27762936 [0,0,0,1,0,0|2,0,0]=3 3388 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,0,0,1,0,0|2,0,0]=3 3389 B8R1.5 O=C1COCCC1Br Amb24416092 [0,0,0,1,0,0|2,0,0]=3 3390 B8R1.5 O=C1COCCC1F Amb28048950 [0,0,0,1,0,0|2,0,0]=3 3391 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,0,0,1,0,0|2,0,0]=3 3392 B8R1.5 O=C1NCCCC1Br Amb33543864 [0,0,0,1,0,0|2,0,0]=3 3393 B8R1.5 O=C1NCCCC1F Amb13888988 [0,0,0,1,0,0|2,0,0]=3 3394 B8R1.5 O=C1NCCCC1O Amb10602315 [0,0,0,1,0,0|2,0,0]=3 3395 B8R1.5 O=C1NCCC[C@@H]1O Amb22226682 [0,0,0,1,0,0|2,0,0]=3 3396 B8R1.5 O=C1NCCC[C@H]1O Amb22225342 [0,0,0,1,0,0|2,0,0]=3 3397 B8R1.5 O=C1NCNCC1Br Amb28060398 [0,0,0,1,0,0|3,0,0]=4 3398 B8R1.5 O=C1NNCCC1Cl Amb26453975 [0,0,0,1,0,0|3,0,0]=4 3399 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,0,0,1,0,0|2,0,0]=3 3400 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,0,0,1,0,0|2,0,0]=3 3401 B8R1.5 O=C1OCCCC1O Amb19959000 [0,0,0,1,0,0|2,0,0]=3 3402 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,0,0,1,0,0|3,0,0]=4 3403 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,0,0,1,0,0|3,0,0]=4 3404 B8R1.5 O=S1CCCCC1Cl Amb27669604 [0,0,0,1,0,0|2,0,0]=3 3405 B8R1.5 O=S1CCCC[C@H]1Cl Amb28343131 [0,0,0,1,0,0|2,0,0]=3 3406 B8R1.5 OC1CCCC=C1Br Amb17594500 [0,0,0,1,0,0|2,0,1]=4 3407 B8R1.5 OC1CCCC=C1Cl Amb27970979 [0,0,0,1,0,0|2,0,1]=4 3408 B8R1.5 OC1CCCCC1Br Amb17594580 [0,0,0,1,0,0|1,0,2]=4 3409 B8R1.5 OC1CCCCC1F Amb28141588 [0,0,0,1,0,0|1,0,2]=4 3410 B8R1.5 OC1CCCCC1I Amb10601565 [0,0,0,1,0,0|1,0,2]=4 3411 B8R1.5 OC1CCCCC1O Amb534699 [0,0,0,1,0,0|1,0,2]=4 3412 B8R1.5 OC1CCCCC1S Amb28061858 [0,0,0,1,0,0|1,0,2]=4 3413 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,0,0,1,0,0|2,0,1]=4 3414 B8R1.5 O[C@@H]1CCCC=C1Cl Amb28067316 [0,0,0,1,0,0|2,0,1]=4 3415 B8R1.5 O[C@@H]1CCCC[C@@H]1Cl Amb8394050 [0,0,0,1,0,0|1,0,2]=4 3416 B8R1.5 O[C@@H]1CCCC[C@H]1Br Amb17940195 [0,0,0,1,0,0|1,0,2]=4 3417 B8R1.5 O[C@@H]1CCCC[C@H]1Cl Amb17844352 [0,0,0,1,0,0|1,0,2]=4 3418 B8R1.5 O[C@@H]1CCCC[C@H]1F Amb10606383 [0,0,0,1,0,0|1,0,2]=4 3419 B8R1.5 O[C@@H]1CCCC[C@H]1O Amb6754065 [0,0,0,1,0,0|1,0,2]=4 3420 B8R1.5 O[C@@H]1CCCC[C@H]1S Amb27205716 [0,0,0,1,0,0|1,0,2]=4 3421 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,0,0,1,0,0|2,0,1]=4 3422 B8R1.5 O[C@H]1CCCC[C@@H]1Cl Amb27420202 [0,0,0,1,0,0|1,0,2]=4 3423 B8R1.5 O[C@H]1CCCC[C@@H]1F Amb26565801 [0,0,0,1,0,0|1,0,2]=4 3424 B8R1.5 O[C@H]1CCCC[C@@H]1O Amb2778553 [0,0,0,1,0,0|1,0,2]=4 3425 B8R1.5 O[C@H]1CCCC[C@H]1Br Amb8394049 [0,0,0,1,0,0|1,0,2]=4 3426 B8R1.5 O[C@H]1CCCC[C@H]1Cl Amb27629800 [0,0,0,1,0,0|1,0,2]=4 3427 B8R1.5 O[C@H]1CCCC[C@H]1O Amb2720739 [0,0,0,1,0,0|1,0,2]=4 3428 B8R1.5 O[C@H]1CCCC[C@H]1S Amb28205526 [0,0,0,1,0,0|1,0,2]=4 3429 B8R1.5 SC1CCCCC1Cl Amb27875327 [0,0,0,1,0,0|1,1,1]=4 3430 B8R1.5 [NH-]C1CCCCC1[NH-] Amb20240925 [0,0,0,1,0,0|2,0,1]=4 3431 B8R1.5 [NH3+][C@@H]1CCCC[C@@H]1O Amb24112952 [0,0,0,1,0,0|1,0,2]=4 3432 B8R1.8 BrCCC1CCCC1 Amb18178329 [0,0,0,1,0,0|1,0,1]=3 3433 B8R1.8 BrCCC1CCCN1 Amb26066464 [0,0,0,1,0,0|2,0,1]=4 3434 B8R1.8 BrCCC1CCCN1 Amb32663240 [0,0,0,1,0,0|2,0,1]=4 3435 B8R1.8 BrCCC1CCCO1 Amb33547829 [0,0,0,1,0,0|1,0,2]=4 3436 B8R1.8 BrCCC1CCCS1 Amb33433092 [0,0,0,1,0,0|1,1,1]=4 3437 B8R1.8 BrCCC1CCNC1 Amb22274601 [0,0,0,1,0,0|2,0,1]=4 3438 B8R1.8 BrCCC1CCOC1 Amb15701388 [0,0,0,1,0,0|2,0,1]=4 3439 B8R1.8 BrCCC1CCSC1 Amb32688122 [0,0,0,1,0,0|2,0,1]=4 3440 B8R1.8 BrCCN1CCCC1 Amb8387808 [0,0,0,1,0,0|2,0,1]=4 3441 B8R1.8 BrCCN1CCCC1 Amb8387809 [0,0,0,1,0,0|2,0,1]=4 3442 B8R1.8 BrCCN1CCCC1 Amb8631544 [0,0,0,1,0,0|2,0,1]=4 3443 B8R1.8 Br\C=C/C1CCCC1 Amb26943608 [0,0,0,1,0,0|1,0,1]=3 3444 B8R1.8 Br\C=C\C1CCCC1 Amb33135109 [0,0,0,1,0,0|1,0,1]=3 3445 B8R1.8 Br\C=C\C1CCOC1 Amb33134957 [0,0,0,1,0,0|2,0,1]=4 3446 B8R1.8 Br\C=C\C1CCSC1 Amb33135487 [0,0,0,1,0,0|2,0,1]=4 3447 B8R1.8 C#CCC1CCCC1 Amb2721549 [0,0,0,1,0,0|1,0,1]=3 3448 B8R1.8 C#CCC1CCCO1 Amb33318708 [0,0,0,1,0,0|2,0,1]=4 3449 B8R1.8 C#CCC1CCCS1 Amb33415830 [0,0,0,1,0,0|2,0,1]=4 3450 B8R1.8 C#CCC1CCNC1 Amb27154338 [0,0,0,1,0,0|2,0,1]=4 3451 B8R1.8 C#CCC1CCNC1 Amb33542317 [0,0,0,1,0,0|2,0,1]=4 3452 B8R1.8 C#CCC1CCOC1 Amb33420738 [0,0,0,1,0,0|2,0,1]=4 3453 B8R1.8 C#CCC1CCSC1 Amb33345728 [0,0,0,1,0,0|2,0,1]=4 3454 B8R1.8 C#CCN1CCCC1 Amb17670646 [0,0,0,1,0,0|2,0,1]=4 3455 B8R1.8 C#CCN1CCCC1 Amb22085943 [0,0,0,1,0,0|2,0,1]=4 3456 B8R1.8 C#NCC1CCCC1 Amb31132340 [0,0,0,1,0,0|2,0,0]=3 3457 B8R1.8 C=CCC1=CCCC1 Amb27969624 [0,0,0,1,0,0|1,0,2]=4 3458 B8R1.8 C=CCC1C=CCC1 Amb27467489 [0,0,0,1,0,0|1,0,2]=4 3459 B8R1.8 C=CCC1CC=CC1 Amb35634519 [0,0,0,1,0,0|1,0,2]=4 3460 B8R1.8 C=CCC1CCCC1 Amb2721534 [0,0,0,1,0,0|1,0,0]=2 3461 B8R1.8 C=CCC1CCCN1 Amb18641666 [0,0,0,1,0,0|2,0,0]=3 3462 B8R1.8 C=CCC1CCCN1 Amb33483980 [0,0,0,1,0,0|2,0,0]=3 3463 B8R1.8 C=CCC1CCCO1 Amb33484168 [0,0,0,1,0,0|2,0,0]=3 3464 B8R1.8 C=CCC1CCNC1 Amb24379760 [0,0,0,1,0,0|2,0,0]=3 3465 B8R1.8 C=CCC1CCNC1 Amb32668290 [0,0,0,1,0,0|2,0,0]=3 3466 B8R1.8 C=CCC1CCOC1 Amb27622653 [0,0,0,1,0,0|2,0,0]=3 3467 B8R1.8 C=CCC1NCCS1 Amb27424663 [0,0,0,1,0,0|3,0,0]=4 3468 B8R1.8 C=CCN1CCCC1 Amb4018980 [0,0,0,1,0,0|2,0,0]=3 3469 B8R1.8 C=CC[C@@H]1CCCN1 Amb27655175 [0,0,0,1,0,0|2,0,0]=3 3470 B8R1.8 C=CC[C@@H]1CCOC1 Amb28315650 [0,0,0,1,0,0|2,0,0]=3 3471 B8R1.8 C=CC[C@@H]1CCSC1 Amb28315682 [0,0,0,1,0,0|2,0,0]=3 3472 B8R1.8 C=CC[C@H]1CCCN1 Amb28061965 [0,0,0,1,0,0|2,0,0]=3 3473 B8R1.8 C=CC[C@H]1CCSC1 Amb28044839 [0,0,0,1,0,0|2,0,0]=3 3474 B8R1.8 C=COC1CCOC1 Amb27466846 [0,0,0,1,0,0|3,0,0]=4 3475 B8R1.8 CCCC1C=CCC1 Amb4019564 [0,0,0,1,0,0|1,0,0]=2 3476 B8R1.8 CCCC1C=CCN1 Amb10608151 [0,0,0,1,0,0|2,0,0]=3 3477 B8R1.8 CCCC1CC=CC1 Amb35634520 [0,0,0,1,0,0|1,0,1]=3 3478 B8R1.8 CCCC1CC=NN1 Amb22264696 [0,0,0,1,0,0|2,0,1]=4 3479 B8R1.8 CCCC1CCCC1 Amb4019556 [0,0,0,1,0,0|1,0,1]=3 3480 B8R1.8 CCCC1CCCN1 Amb22587167 [0,0,0,1,0,0|1,0,1]=3 3481 B8R1.8 CCCC1CCCN1 Amb9714691 [0,0,0,1,0,0|1,0,1]=3 3482 B8R1.8 CCCC1CCNC1 Amb10607827 [0,0,0,1,0,0|2,0,0]=3 3483 B8R1.8 CCCC1CCNC1 Amb32414607 [0,0,0,1,0,0|2,0,0]=3 3484 B8R1.8 CCCC1CNC=N1 Amb30021062 [0,0,0,1,0,0|2,0,0]=3 3485 B8R1.8 CCCC1CNCO1 Amb27391630 [0,0,0,1,0,0|1,0,2]=4 3486 B8R1.8 CCCC1CNOC1 Amb27664156 [0,0,0,1,0,0|3,0,0]=4 3487 B8R1.8 CCCC1NCCS1 Amb19515280 [0,0,0,1,0,0|1,1,1]=4 3488 B8R1.8 CCCC1NCCS1 Amb22059065 [0,0,0,1,0,0|1,1,1]=4 3489 B8R1.8 CCCC1OCCS1 Amb9786141 [0,0,0,1,0,0|1,0,2]=4 3490 B8R1.8 CCCN1CCCO1 Amb27589395 [0,0,0,1,0,0|1,0,2]=4 3491 B8R1.8 CCNC1CCCC1 Amb6250623 [0,0,0,1,0,0|2,0,1]=4 3492 B8R1.8 CCNC1CCCC1 Amb8503448 [0,0,0,1,0,0|2,0,1]=4 3493 B8R1.8 CCNC1CCCN1 Amb28133387 [0,0,0,1,0,0|2,0,1]=4 3494 B8R1.8 CCNC1CCOC1 Amb22271139 [0,0,0,1,0,0|3,0,0]=4 3495 B8R1.8 CCNC1CCOC1 Amb30869350 [0,0,0,1,0,0|3,0,0]=4 3496 B8R1.8 CCNC1CCSC1 Amb6269125 [0,0,0,1,0,0|3,0,0]=4 3497 B8R1.8 CCN[C@@H]1CCNC1 Amb10067032 [0,0,0,1,0,0|3,0,0]=4 3498 B8R1.8 CCN[C@@H]1CCOC1 Amb27467906 [0,0,0,1,0,0|3,0,0]=4 3499 B8R1.8 CCN[C@H]1CCNC1 Amb10067033 [0,0,0,1,0,0|3,0,0]=4 3500 B8R1.8 CCN[C@H]1CCOC1 Amb27430348 [0,0,0,1,0,0|3,0,0]=4 3501 B8R1.8 CCOC1CCCO1 Amb22228805 [0,0,0,1,0,0|1,0,2]=4 3502 B8R1.8 CCOC1CCNC1 Amb17191401 [0,0,0,1,0,0|3,0,0]=4 3503 B8R1.8 CCOC1CCNC1 Amb21955015 [0,0,0,1,0,0|3,0,0]=4 3504 B8R1.8 CCOC1CCNC1 Amb22587372 [0,0,0,1,0,0|3,0,0]=4 3505 B8R1.8 CCOC1CCNC1 Amb22755953 [0,0,0,1,0,0|3,0,0]=4 3506 B8R1.8 CCO[C@@H]1CCNC1 Amb27602169 [0,0,0,1,0,0|3,0,0]=4 3507 B8R1.8 CCO[C@@H]1CCNC1 Amb33802509 [0,0,0,1,0,0|3,0,0]=4 3508 B8R1.8 CCO[C@H]1CCNC1 Amb22745971 [0,0,0,1,0,0|3,0,0]=4 3509 B8R1.8 CCO[C@H]1CCNC1 Amb22748789 [0,0,0,1,0,0|3,0,0]=4 3510 B8R1.8 CCSC1CCCC1 Amb27764393 [0,0,0,1,0,0|2,0,1]=4 3511 B8R1.8 CCSC1CCNC1 Amb18960216 [0,0,0,1,0,0|3,0,0]=4 3512 B8R1.8 CNCC1CCCC1 Amb13951600 [0,0,0,1,0,0|2,0,0]=3 3513 B8R1.8 CNCC1CCCC1 Amb8853677 [0,0,0,1,0,0|2,0,0]=3 3514 B8R1.8 CNCC1CCCN1 Amb17231816 [0,0,0,1,0,0|2,0,1]=4 3515 B8R1.8 CNCC1CCCN1 Amb32753028 [0,0,0,1,0,0|2,0,1]=4 3516 B8R1.8 CNCC1CCCO1 Amb33483486 [0,0,0,1,0,0|1,0,2]=4 3517 B8R1.8 CNCC1CCCO1 Amb9714028 [0,0,0,1,0,0|1,0,2]=4 3518 B8R1.8 CNCC1CCCS1 Amb27859030 [0,0,0,1,0,0|1,1,1]=4 3519 B8R1.8 CNCC1CCOC1 Amb1116768 [0,0,0,1,0,0|3,0,0]=4 3520 B8R1.8 CNCC1CCOC1 Amb30869458 [0,0,0,1,0,0|3,0,0]=4 3521 B8R1.8 CNC[C@@H]1CCCN1 Amb25189015 [0,0,0,1,0,0|2,0,1]=4 3522 B8R1.8 CNC[C@@H]1CCCN1 Amb32662530 [0,0,0,1,0,0|2,0,1]=4 3523 B8R1.8 CNC[C@@H]1CCCO1 Amb27153906 [0,0,0,1,0,0|1,0,2]=4 3524 B8R1.8 CNC[C@H]1CCCN1 Amb24763299 [0,0,0,1,0,0|2,0,1]=4 3525 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,0,0,1,0,0|1,0,2]=4 3526 B8R1.8 CNC[C@H]1CCNC1 Amb35743308 [0,0,0,1,0,0|3,0,0]=4 3527 B8R1.8 CNOC1CCCC1 Amb25899783 [0,0,0,1,0,0|3,0,0]=4 3528 B8R1.8 COCC1CC=CC1 Amb25983815 [0,0,0,1,0,0|2,0,1]=4 3529 B8R1.8 COCC1CCCC1 Amb25264349 [0,0,0,1,0,0|2,0,0]=3 3530 B8R1.8 COCC1CCCN1 Amb20622354 [0,0,0,1,0,0|2,0,1]=4 3531 B8R1.8 COCC1CCCN1 Amb2234472 [0,0,0,1,0,0|2,0,1]=4 3532 B8R1.8 COCC1CCNC1 Amb21955124 [0,0,0,1,0,0|3,0,0]=4 3533 B8R1.8 COCC1CCNC1 Amb8009598 [0,0,0,1,0,0|3,0,0]=4 3534 B8R1.8 COCC1CNC=N1 Amb30021016 [0,0,0,1,0,0|3,0,0]=4 3535 B8R1.8 COCN1CCCC1 Amb28281272 [0,0,0,1,0,0|3,0,0]=4 3536 B8R1.8 COC[C@@H]1CCCN1 Amb24182058 [0,0,0,1,0,0|2,0,1]=4 3537 B8R1.8 COC[C@@H]1CCCN1 Amb2713317 [0,0,0,1,0,0|2,0,1]=4 3538 B8R1.8 COC[C@@H]1CCNC1 Amb27838343 [0,0,0,1,0,0|3,0,0]=4 3539 B8R1.8 COC[C@@H]1CCNC1 Amb33801200 [0,0,0,1,0,0|3,0,0]=4 3540 B8R1.8 COC[C@H]1CCCN1 Amb22293917 [0,0,0,1,0,0|2,0,1]=4 3541 B8R1.8 COC[C@H]1CCCN1 Amb6298382 [0,0,0,1,0,0|2,0,1]=4 3542 B8R1.8 COC[C@H]1CCNC1 Amb22272118 [0,0,0,1,0,0|3,0,0]=4 3543 B8R1.8 COC[C@H]1CCNC1 Amb22755453 [0,0,0,1,0,0|3,0,0]=4 3544 B8R1.8 CONC1CCCC1 Amb32751169 [0,0,0,1,0,0|3,0,0]=4 3545 B8R1.8 CSCC1CCCN1 Amb2237163 [0,0,0,1,0,0|2,0,1]=4 3546 B8R1.8 CSCC1CCCO1 Amb26894759 [0,0,0,1,0,0|1,0,2]=4 3547 B8R1.8 CSCC1CCNC1 Amb18960328 [0,0,0,1,0,0|3,0,0]=4 3548 B8R1.8 CSCC1CCNC1 Amb33548445 [0,0,0,1,0,0|3,0,0]=4 3549 B8R1.8 CSCC1CCOC1 Amb28049306 [0,0,0,1,0,0|3,0,0]=4 3550 B8R1.8 CSC[C@@H]1CCCN1 Amb27230855 [0,0,0,1,0,0|2,0,1]=4 3551 B8R1.8 C\C=C\N1CCCC1 Amb26887224 [0,0,0,1,0,0|2,0,1]=4 3552 B8R1.8 ClCCC1CC=CC1 Amb27468735 [0,0,0,1,0,0|2,0,1]=4 3553 B8R1.8 ClCCC1CCCC1 Amb27452931 [0,0,0,1,0,0|1,0,1]=3 3554 B8R1.8 ClCCC1CCCO1 Amb25888267 [0,0,0,1,0,0|1,0,2]=4 3555 B8R1.8 ClCCC1CCOC1 Amb24532020 [0,0,0,1,0,0|2,0,1]=4 3556 B8R1.8 ClCCC1CCSC1 Amb32688121 [0,0,0,1,0,0|2,0,1]=4 3557 B8R1.8 ClCCN1CCCC1 Amb6608907 [0,0,0,1,0,0|2,0,1]=4 3558 B8R1.8 ClCCN1CCCC1 Amb8387807 [0,0,0,1,0,0|2,0,1]=4 3559 B8R1.8 ClCC[C@@H]1CCCN1 Amb27874071 [0,0,0,1,0,0|2,0,1]=4 3560 B8R1.8 ClCC[C@H]1CCNC1 Amb27788406 [0,0,0,1,0,0|2,0,1]=4 3561 B8R1.8 ClCC[NH+]1CCCC1 Amb24113840 [0,0,0,1,0,0|2,0,1]=4 3562 B8R1.8 ClCOC1CCCC1 Amb28435517 [0,0,0,1,0,0|2,0,1]=4 3563 B8R1.8 FCCC1CCCN1 Amb27798978 [0,0,0,1,0,0|2,0,1]=4 3564 B8R1.8 FCCC1CCNC1 Amb21959205 [0,0,0,1,0,0|2,0,1]=4 3565 B8R1.8 FCCN1CCCC1 Amb27837554 [0,0,0,1,0,0|2,0,1]=4 3566 B8R1.8 ICCC1CCCC1 Amb24383289 [0,0,0,1,0,0|1,0,1]=3 3567 B8R1.8 ICCC1CCCO1 Amb27860272 [0,0,0,1,0,0|1,0,2]=4 3568 B8R1.8 ICCC1CCNC1 Amb22296926 [0,0,0,1,0,0|2,0,1]=4 3569 B8R1.8 ICCN1CCCC1 Amb25057107 [0,0,0,1,0,0|2,0,1]=4 3570 B8R1.8 ICCN1CCCC1 Amb32669018 [0,0,0,1,0,0|2,0,1]=4 3571 B8R1.8 N#CCC1CCCC1 Amb17138362 [0,0,0,1,0,0|1,0,1]=3 3572 B8R1.8 N#CCC1CCCN1 Amb18124222 [0,0,0,1,0,0|2,0,1]=4 3573 B8R1.8 N#CCC1CCCO1 Amb9702955 [0,0,0,1,0,0|2,0,1]=4 3574 B8R1.8 N#CCC1CCCS1 Amb33416220 [0,0,0,1,0,0|2,0,1]=4 3575 B8R1.8 N#CCC1CCNC1 Amb25922225 [0,0,0,1,0,0|2,0,1]=4 3576 B8R1.8 N#CCC1CCNC1 Amb28934841 [0,0,0,1,0,0|2,0,1]=4 3577 B8R1.8 N#CCC1CCOC1 Amb15701355 [0,0,0,1,0,0|2,0,1]=4 3578 B8R1.8 N#CCC1CCSC1 Amb35680724 [0,0,0,1,0,0|2,0,1]=4 3579 B8R1.8 N#CCN1CCCC1 Amb4010746 [0,0,0,1,0,0|2,0,1]=4 3580 B8R1.8 N#CC[C@@H]1CCCN1 Amb27234591 [0,0,0,1,0,0|2,0,1]=4 3581 B8R1.8 N#CC[C@@H]1CCNC1 Amb27836282 [0,0,0,1,0,0|2,0,1]=4 3582 B8R1.8 N#CC[C@H]1CCCN1 Amb25189872 [0,0,0,1,0,0|2,0,1]=4 3583 B8R1.8 N#CC[C@H]1CCNC1 Amb27242905 [0,0,0,1,0,0|2,0,1]=4 3584 B8R1.8 N#CC[NH+]1CCCC1 Amb22728209 [0,0,0,1,0,0|2,0,1]=4 3585 B8R1.8 N#CSC1CCCC1 Amb10605775 [0,0,0,1,0,0|2,0,1]=4 3586 B8R1.8 NCCC1CC=CC1 Amb28068699 [0,0,0,1,0,0|2,0,1]=4 3587 B8R1.8 NCCC1CC=CC1 Amb30585106 [0,0,0,1,0,0|2,0,1]=4 3588 B8R1.8 NCCC1CCCC1 Amb1089736 [0,0,0,1,0,0|1,0,1]=3 3589 B8R1.8 NCCC1CCCC1 Amb2099819 [0,0,0,1,0,0|1,0,1]=3 3590 B8R1.8 NCCC1CCCC1 Amb7969704 [0,0,0,1,0,0|1,0,1]=3 3591 B8R1.8 NCCC1CCCN1 Amb18954128 [0,0,0,1,0,0|2,0,1]=4 3592 B8R1.8 NCCC1CCCN1 Amb32651929 [0,0,0,1,0,0|2,0,1]=4 3593 B8R1.8 NCCC1CCCO1 Amb13952618 [0,0,0,1,0,0|1,0,2]=4 3594 B8R1.8 NCCC1CCCO1 Amb9708331 [0,0,0,1,0,0|1,0,2]=4 3595 B8R1.8 NCCC1CCCS1 Amb32656287 [0,0,0,1,0,0|1,1,1]=4 3596 B8R1.8 NCCC1CCCS1 Amb32656288 [0,0,0,1,0,0|1,1,1]=4 3597 B8R1.8 NCCC1CCNC1 Amb18833027 [0,0,0,1,0,0|2,0,1]=4 3598 B8R1.8 NCCC1CCNC1 Amb32675662 [0,0,0,1,0,0|2,0,1]=4 3599 B8R1.8 NCCC1CCOC1 Amb15701360 [0,0,0,1,0,0|2,0,1]=4 3600 B8R1.8 NCCC1CCOC1 Amb22001860 [0,0,0,1,0,0|2,0,1]=4 3601 B8R1.8 NCCC1CCSC1 Amb18199484 [0,0,0,1,0,0|2,0,1]=4 3602 B8R1.8 NCCN1CCCC1 Amb10610085 [0,0,0,1,0,0|2,0,1]=4 3603 B8R1.8 NCCN1CCCC1 Amb2720335 [0,0,0,1,0,0|2,0,1]=4 3604 B8R1.8 NCC[C@@H]1CCCN1 Amb28341793 [0,0,0,1,0,0|2,0,1]=4 3605 B8R1.8 NCC[C@@H]1CN=CN1 Amb28348709 [0,0,0,1,0,0|3,0,0]=4 3606 B8R1.8 NCC[C@H]1CCCN1 Amb27984256 [0,0,0,1,0,0|2,0,1]=4 3607 B8R1.8 NCC[C@H]1CCCN1 Amb32651958 [0,0,0,1,0,0|2,0,1]=4 3608 B8R1.8 NCC[C@H]1CCCO1 Amb32664981 [0,0,0,1,0,0|1,0,2]=4 3609 B8R1.8 NCC[C@H]1CCCO1 Amb32670639 [0,0,0,1,0,0|1,0,2]=4 3610 B8R1.8 NCC[C@H]1CCNC1 Amb27633932 [0,0,0,1,0,0|2,0,1]=4 3611 B8R1.8 NCNC1CCCC1 Amb27869404 [0,0,0,1,0,0|2,0,1]=4 3612 B8R1.8 NNCC1CCCC1 Amb10608985 [0,0,0,1,0,0|2,0,0]=3 3613 B8R1.8 NNCC1CCCC1 Amb6249695 [0,0,0,1,0,0|2,0,0]=3 3614 B8R1.8 NNCC1CCCC1 Amb9677429 [0,0,0,1,0,0|2,0,0]=3 3615 B8R1.8 NNCC1CCCO1 Amb10610188 [0,0,0,1,0,0|3,0,0]=4 3616 B8R1.8 NNCC1CCCO1 Amb10610215 [0,0,0,1,0,0|3,0,0]=4 3617 B8R1.8 NNCC1CCCO1 Amb6250908 [0,0,0,1,0,0|3,0,0]=4 3618 B8R1.8 NNCC1CCCS1 Amb24575294 [0,0,0,1,0,0|3,0,0]=4 3619 B8R1.8 NNCC1CCOC1 Amb13951809 [0,0,0,1,0,0|3,0,0]=4 3620 B8R1.8 NNCC1CCOC1 Amb6662100 [0,0,0,1,0,0|3,0,0]=4 3621 B8R1.8 NNCC1CCOC1 Amb9677393 [0,0,0,1,0,0|3,0,0]=4 3622 B8R1.8 NNCC1CCSC1 Amb24113134 [0,0,0,1,0,0|3,0,0]=4 3623 B8R1.8 NNCC1CCSC1 Amb28437269 [0,0,0,1,0,0|3,0,0]=4 3624 B8R1.8 NNC[C@@H]1CCCO1 Amb28396855 [0,0,0,1,0,0|3,0,0]=4 3625 B8R1.8 NNC[C@H]1CCCO1 Amb28057953 [0,0,0,1,0,0|3,0,0]=4 3626 B8R1.8 NOCC1CCCC1 Amb21858976 [0,0,0,1,0,0|2,0,0]=3 3627 B8R1.8 NOCC1CCCC1 Amb25189022 [0,0,0,1,0,0|2,0,0]=3 3628 B8R1.8 NOCC1CCCN1 Amb27790661 [0,0,0,1,0,0|3,0,0]=4 3629 B8R1.8 NOCC1CCCO1 Amb17231830 [0,0,0,1,0,0|3,0,0]=4 3630 B8R1.8 NOCC1CCCS1 Amb33415857 [0,0,0,1,0,0|3,0,0]=4 3631 B8R1.8 NOCC1CCOC1 Amb26850354 [0,0,0,1,0,0|3,0,0]=4 3632 B8R1.8 NOCC1CCOC1 Amb33329366 [0,0,0,1,0,0|3,0,0]=4 3633 B8R1.8 NOCC1CCSC1 Amb33141890 [0,0,0,1,0,0|3,0,0]=4 3634 B8R1.8 O=C=CC1CCCC1 Amb27184572 [0,0,0,1,0,0|0,0,2]=3 3635 B8R1.8 O=C=NC1CCCC1 Amb901882 [0,0,0,1,0,0|1,0,1]=3 3636 B8R1.8 O=C=NC1CCCN1 Amb28126852 [0,0,0,1,0,0|2,0,1]=4 3637 B8R1.8 O=C=NC1CCCO1 Amb6257879 [0,0,0,1,0,0|2,0,1]=4 3638 B8R1.8 O=C=NC1CCOC1 Amb18944808 [0,0,0,1,0,0|2,0,1]=4 3639 B8R1.8 O=C=NC1CCSC1 Amb28315827 [0,0,0,1,0,0|2,0,1]=4 3640 B8R1.8 O=CCC1CC=CC1 Amb18641620 [0,0,0,1,0,0|0,0,2]=3 3641 B8R1.8 O=CCC1CCCC1 Amb17672924 [0,0,0,1,0,0|0,0,0]=1 3642 B8R1.8 O=CCC1CCCO1 Amb18641800 [0,0,0,1,0,0|1,0,0]=2 3643 B8R1.8 O=CCC1CCCS1 Amb25195330 [0,0,0,1,0,0|1,0,0]=2 3644 B8R1.8 O=CCC1CCNC1 Amb27201899 [0,0,0,1,0,0|1,0,0]=2 3645 B8R1.8 O=CCC1CCOC1 Amb22059267 [0,0,0,1,0,0|1,0,0]=2 3646 B8R1.8 O=CCC1CCSC1 Amb25924088 [0,0,0,1,0,0|1,0,0]=2 3647 B8R1.8 O=CCC1OCCO1 Amb18831794 [0,0,0,1,0,0|2,0,0]=3 3648 B8R1.8 O=CCN1CCCC1 Amb33801466 [0,0,0,1,0,0|1,0,0]=2 3649 B8R1.8 O=CCN1CCCO1 Amb28198674 [0,0,0,1,0,0|2,0,0]=3 3650 B8R1.8 O=CC[C@H]1CNCS1 Amb27218227 [0,0,0,1,0,0|2,0,0]=3 3651 B8R1.8 O=CNC1CCCC1 Amb26611065 [0,0,0,1,0,0|1,0,0]=2 3652 B8R1.8 O=C\C=C1\CCCO1 Amb26868026 [0,0,0,1,0,0|1,0,2]=4 3653 B8R1.8 OCCC1C=CCN1 Amb32950238 [0,0,0,1,0,0|3,0,0]=4 3654 B8R1.8 OCCC1CC=CC1 Amb24482557 [0,0,0,1,0,0|2,0,1]=4 3655 B8R1.8 OCCC1CCCC1 Amb2721230 [0,0,0,1,0,0|0,0,2]=3 3656 B8R1.8 OCCC1CCCN1 Amb22754588 [0,0,0,1,0,0|1,0,2]=4 3657 B8R1.8 OCCC1CCCN1 Amb8630850 [0,0,0,1,0,0|1,0,2]=4 3658 B8R1.8 OCCC1CCCO1 Amb20622383 [0,0,0,1,0,0|1,0,2]=4 3659 B8R1.8 OCCC1CCCS1 Amb25998759 [0,0,0,1,0,0|1,0,2]=4 3660 B8R1.8 OCCC1CCNC1 Amb22406195 [0,0,0,1,0,0|1,0,2]=4 3661 B8R1.8 OCCC1CCNC1 Amb9782130 [0,0,0,1,0,0|1,0,2]=4 3662 B8R1.8 OCCC1CCOC1 Amb33541612 [0,0,0,1,0,0|1,0,2]=4 3663 B8R1.8 OCCC1CCSC1 Amb18202827 [0,0,0,1,0,0|1,0,2]=4 3664 B8R1.8 OCCN1CCC=N1 Amb15701438 [0,0,0,1,0,0|3,0,0]=4 3665 B8R1.8 OCCN1CCCC1 Amb22002207 [0,0,0,1,0,0|1,0,2]=4 3666 B8R1.8 OCCN1CCCC1 Amb535402 [0,0,0,1,0,0|1,0,2]=4 3667 B8R1.8 OCC[C@@H]1C=CCO1 Amb27206175 [0,0,0,1,0,0|3,0,0]=4 3668 B8R1.8 OCC[C@@H]1CCCN1 Amb8630851 [0,0,0,1,0,0|1,0,2]=4 3669 B8R1.8 OCC[C@@H]1CCCO1 Amb27836253 [0,0,0,1,0,0|1,0,2]=4 3670 B8R1.8 OCC[C@@H]1CCNC1 Amb22299725 [0,0,0,1,0,0|1,0,2]=4 3671 B8R1.8 OCC[C@@H]1CCNC1 Amb24411426 [0,0,0,1,0,0|1,0,2]=4 3672 B8R1.8 OCC[C@H]1CCCO1 Amb27431469 [0,0,0,1,0,0|1,0,2]=4 3673 B8R1.8 OCC[C@H]1CCNC1 Amb22299669 [0,0,0,1,0,0|1,0,2]=4 3674 B8R1.8 OCC[C@H]1CCNC1 Amb27785890 [0,0,0,1,0,0|1,0,2]=4 3675 B8R1.8 ONCC1CCCC1 Amb25952639 [0,0,0,1,0,0|1,0,1]=3 3676 B8R1.8 ONCC1CCCO1 Amb25684501 [0,0,0,1,0,0|2,0,1]=4 3677 B8R1.8 ONCC1CCCS1 Amb33416564 [0,0,0,1,0,0|2,0,1]=4 3678 B8R1.8 ONCC1CCOC1 Amb25935174 [0,0,0,1,0,0|2,0,1]=4 3679 B8R1.8 ONCC1CCSC1 Amb27981633 [0,0,0,1,0,0|2,0,1]=4 3680 B8R1.8 O\N=C\C1CCCC1 Amb27424660 [0,0,0,1,0,0|1,0,2]=4 3681 B8R1.8 S=C=NC1CCCC1 Amb6565414 [0,0,0,1,0,0|1,1,1]=4 3682 B8R1.8 SCCC1CCCC1 Amb26475267 [0,0,0,1,0,0|0,1,1]=3 3683 B8R1.8 SCCC1CCCO1 Amb27220272 [0,0,0,1,0,0|1,0,2]=4 3684 B8R1.8 SCCC1CCCS1 Amb33415373 [0,0,0,1,0,0|1,1,1]=4 3685 B8R1.8 SCCC1CCNC1 Amb22298487 [0,0,0,1,0,0|1,1,1]=4 3686 B8R1.8 SCCC1CCOC1 Amb27783671 [0,0,0,1,0,0|1,1,1]=4 3687 B8R1.8 SCCC1CCSC1 Amb33141475 [0,0,0,1,0,0|1,1,1]=4 3688 B8R1.8 SCCN1CCCC1 Amb7776944 [0,0,0,1,0,0|1,1,1]=4 3689 B8R1.8 [C-]#[N+]CC1CCCC1 Amb33315796 [0,0,0,1,0,0|2,0,0]=3 3690 B8R1.8 [C-]#[N+]CC1CCCO1 Amb3973129 [0,0,0,1,0,0|3,0,0]=4 3691 B8R1.8 [C-]#[N+]CC1CCCS1 Amb33415865 [0,0,0,1,0,0|3,0,0]=4 3692 B8R1.8 [C-]#[N+]CC1CCOC1 Amb33420755 [0,0,0,1,0,0|3,0,0]=4 3693 B8R1.8 [C-]#[N+]CC1CCSC1 Amb33141314 [0,0,0,1,0,0|3,0,0]=4 3694 B8R1.8 [N-]=[N+]=NC1CCCC1 Amb20622484 [0,0,0,1,0,0|3,0,0]=4 3695 B8R1.9 C#CCCC1CC1C Amb33143874 [0,0,0,1,0,0|1,0,1]=3 3696 B8R1.9 C=C1CC1CCC=O Amb27256377 [0,0,0,1,0,0|0,0,2]=3 3697 B8R1.9 C=C1CC1CCCO Amb27801929 [0,0,0,1,0,0|2,0,0]=3 3698 B8R1.9 CC1CC1CCC#N Amb33146005 [0,0,0,1,0,0|1,0,1]=3 3699 B8R1.9 CC1CC1CCC=O Amb33143873 [0,0,0,1,0,0|0,0,0]=1 3700 B8R1.9 CC1CC1CCCBr Amb33431531 [0,0,0,1,0,0|1,0,1]=3 3701 B8R1.9 CC1CC1CCCN Amb33224007 [0,0,0,1,0,0|1,0,1]=3 3702 B8R1.9 CC1CC1CCCO Amb33213606 [0,0,0,1,0,0|0,0,2]=3 3703 B8R1.9 CC1CC1CCCS Amb33143845 [0,0,0,1,0,0|0,1,1]=3 3704 B8R1.9 CC1CC1CCON Amb33144254 [0,0,0,1,0,0|2,0,0]=3 3705 B8R1.9 CC1CC1CN=C=O Amb24595248 [0,0,0,1,0,0|1,0,1]=3 3706 B8R1.9 CC1CC1CN=C=S Amb27233790 [0,0,0,1,0,0|1,1,1]=4 3707 B8R1.9 CC1CC1CN=[N+]=[N-] Amb33144968 [0,0,0,1,0,0|3,0,0]=4 3708 B8R1.9 CC1CC1CNC#N Amb28421685 [0,0,0,1,0,0|2,0,1]=4 3709 B8R1.9 CC1CC1NCC#N Amb18285947 [0,0,0,1,0,0|2,0,1]=4 3710 B8R1.9 CC1CC1NCCF Amb27765088 [0,0,0,1,0,0|2,0,1]=4 3711 B8R1.9 CC1CC1NCCO Amb18298792 [0,0,0,1,0,0|1,0,2]=4 3712 B8R1.9 CC1CC1OCCN Amb33144888 [0,0,0,1,0,0|2,0,1]=4 3713 B8R1.9 CC1CC1\C=C\C=O Amb33474885 [0,0,0,1,0,0|0,0,2]=3 3714 B8R1.9 CC1OC1CCCBr Amb28383540 [0,0,0,1,0,0|2,0,1]=4 3715 B8R1.9 CC1OC1CCCO Amb28344681 [0,0,0,1,0,0|1,0,2]=4 3716 B8R1.9 CCCCC1CC1N Amb25989937 [0,0,0,1,0,0|1,0,1]=3 3717 B8R1.9 CCCCC1OC1O Amb27493204 [0,0,0,1,0,0|1,0,2]=4 3718 B8R1.9 CCCC[C@@H]1C[C@@H]1Cl Amb27857045 [0,0,0,1,0,0|1,0,1]=3 3719 B8R1.9 CCCC[C@@H]1C[C@H]1N Amb27188372 [0,0,0,1,0,0|1,0,1]=3 3720 B8R1.9 CCCO[C@@H]1C[C@H]1N Amb33347099 [0,0,0,1,0,0|2,0,1]=4 3721 B8R1.9 CCSCC1CC1N Amb33324026 [0,0,0,1,0,0|2,0,1]=4 3722 B8R1.9 CCSC[C@@H]1C[C@H]1N Amb33324037 [0,0,0,1,0,0|2,0,1]=4 3723 B8R1.9 CNCCC1CC1C Amb33359776 [0,0,0,1,0,0|2,0,0]=3 3724 B8R1.9 COCCC1CC1N Amb33377825 [0,0,0,1,0,0|2,0,1]=4 3725 B8R1.9 COCC[C@@H]1C[C@H]1N Amb33377826 [0,0,0,1,0,0|2,0,1]=4 3726 B8R1.9 CSCCC1CC1N Amb33198754 [0,0,0,1,0,0|2,0,1]=4 3727 B8R1.9 CSCC[C@@H]1C[C@H]1N Amb33198755 [0,0,0,1,0,0|2,0,1]=4 3728 B8R1.9 C[C@@H]1C[C@H]1NCCO Amb35750313 [0,0,0,1,0,0|1,0,2]=4 3729 B8R1.9 C[C@@H]1C[C@H]1OCCO Amb28430706 [0,0,0,1,0,0|1,0,2]=4 3730 B8R1.9 C[C@@H]1O[C@@H]1\C=C\C=O Amb27815227 [0,0,0,1,0,0|1,0,2]=4 3731 B8R1.9 C[C@H]1C[C@H]1OCCCl Amb27420175 [0,0,0,1,0,0|2,0,1]=4 3732 B8R1.9 C[C@H]1C[C@H]1\C=C\C=O Amb27631312 [0,0,0,1,0,0|0,0,2]=3 3733 B8R1.9 C[C@H]1O[C@@H]1CCCCl Amb27229206 [0,0,0,1,0,0|2,0,1]=4 3734 B8R1.9 C[C@H]1O[C@@H]1\C=C\C=O Amb27752034 [0,0,0,1,0,0|1,0,2]=4 3735 B8R1.9 C[C@H]1O[C@H]1CCCBr Amb27863536 [0,0,0,1,0,0|2,0,1]=4 3736 B8R1.9 C[C@H]1O[C@H]1\C=C\C=O Amb28068806 [0,0,0,1,0,0|1,0,2]=4 3737 B8R1.9 O[C@@H]1C[C@H]1CCCCl Amb27202822 [0,0,0,1,0,0|1,0,2]=4 3738 B8R1.9 O[C@H]1C[C@@H]1CCCCl Amb27428217 [0,0,0,1,0,0|1,0,2]=4 3739 B8R1.9 [C-]#[N+]CCC1CC1C Amb33144265 [0,0,0,1,0,0|2,0,0]=3 3740 B8R1.10 BrCCCC1CCC1 Amb25756718 [0,0,0,1,0,0|1,0,1]=3 3741 B8R1.10 BrCCCN1CCC1 Amb24412145 [0,0,0,1,0,0|2,0,1]=4 3742 B8R1.10 BrCCNC1CCC1 Amb27227343 [0,0,0,1,0,0|2,0,1]=4 3743 B8R1.10 BrCCOC1CCC1 Amb18796095 [0,0,0,1,0,0|2,0,1]=4 3744 B8R1.10 Br\C=C\CN1CCC1 Amb26569848 [0,0,0,1,0,0|2,0,1]=4 3745 B8R1.10 C#CCCC1CCC1 Amb33313828 [0,0,0,1,0,0|1,0,1]=3 3746 B8R1.10 C#CCNC1CCC1 Amb18957035 [0,0,0,1,0,0|2,0,1]=4 3747 B8R1.10 C#CCOC1CCC1 Amb23598916 [0,0,0,1,0,0|2,0,1]=4 3748 B8R1.10 C=CCCC1CCC1 Amb35680297 [0,0,0,1,0,0|1,0,0]=2 3749 B8R1.10 C=CCCC1CNC1 Amb28065051 [0,0,0,1,0,0|2,0,0]=3 3750 B8R1.10 C=CCCC1CSC1 Amb28059177 [0,0,0,1,0,0|2,0,0]=3 3751 B8R1.10 C=CCCN1CCC1 Amb27980244 [0,0,0,1,0,0|2,0,0]=3 3752 B8R1.10 C=CCNC1CCC1 Amb18291589 [0,0,0,1,0,0|2,0,0]=3 3753 B8R1.10 C=CCNC1CNC1 Amb27444545 [0,0,0,1,0,0|3,0,0]=4 3754 B8R1.10 C=CCNC1CSC1 Amb27661875 [0,0,0,1,0,0|3,0,0]=4 3755 B8R1.10 C=CCOC1CNC1 Amb21956109 [0,0,0,1,0,0|3,0,0]=4 3756 B8R1.10 C=CCOC1COC1 Amb22737293 [0,0,0,1,0,0|3,0,0]=4 3757 B8R1.10 CCCCC1CCN1 Amb25353385 [0,0,0,1,0,0|1,0,1]=3 3758 B8R1.10 CCCCC1CNC1 Amb27589087 [0,0,0,1,0,0|2,0,0]=3 3759 B8R1.10 CCCNC1CCC1 Amb18989245 [0,0,0,1,0,0|2,0,1]=4 3760 B8R1.10 CCCNC1CNC1 Amb24374352 [0,0,0,1,0,0|3,0,0]=4 3761 B8R1.10 CCCNC1COC1 Amb15693523 [0,0,0,1,0,0|3,0,0]=4 3762 B8R1.10 CCCOC1CNC1 Amb18301144 [0,0,0,1,0,0|3,0,0]=4 3763 B8R1.10 CCCOC1CNC1 Amb22489787 [0,0,0,1,0,0|3,0,0]=4 3764 B8R1.10 CCNCC1CCC1 Amb33545240 [0,0,0,1,0,0|2,0,1]=4 3765 B8R1.10 CCNCC1CCC1 Amb8853715 [0,0,0,1,0,0|2,0,1]=4 3766 B8R1.10 CCNCC1CCN1 Amb27228331 [0,0,0,1,0,0|2,0,1]=4 3767 B8R1.10 CCNCC1CNC1 Amb24392887 [0,0,0,1,0,0|3,0,0]=4 3768 B8R1.10 CCNCC1COC1 Amb35709505 [0,0,0,1,0,0|3,0,0]=4 3769 B8R1.10 CCNCC1CSC1 Amb30013259 [0,0,0,1,0,0|3,0,0]=4 3770 B8R1.10 CCOCC1CNC1 Amb21959282 [0,0,0,1,0,0|3,0,0]=4 3771 B8R1.10 CCSCC1CCC1 Amb27838037 [0,0,0,1,0,0|2,0,1]=4 3772 B8R1.10 CCSCC1CCN1 Amb33324020 [0,0,0,1,0,0|2,0,1]=4 3773 B8R1.10 CCSCC1CNC1 Amb25823863 [0,0,0,1,0,0|3,0,0]=4 3774 B8R1.10 CNCCC1CCC1 Amb23580285 [0,0,0,1,0,0|2,0,0]=3 3775 B8R1.10 CNCCC1CNC1 Amb28315980 [0,0,0,1,0,0|3,0,0]=4 3776 B8R1.10 CNCCN1CCC1 Amb26612442 [0,0,0,1,0,0|3,0,0]=4 3777 B8R1.10 CNOCC1CCC1 Amb30028809 [0,0,0,1,0,0|3,0,0]=4 3778 B8R1.10 COCCC1CCN1 Amb27613131 [0,0,0,1,0,0|2,0,1]=4 3779 B8R1.10 COCCC1CNC1 Amb25130070 [0,0,0,1,0,0|3,0,0]=4 3780 B8R1.10 COCCC1CNC1 Amb33379068 [0,0,0,1,0,0|3,0,0]=4 3781 B8R1.10 CSCCC1CCN1 Amb33198741 [0,0,0,1,0,0|2,0,1]=4 3782 B8R1.10 CSCCC1CNC1 Amb27622586 [0,0,0,1,0,0|3,0,0]=4 3783 B8R1.10 CSCOC1CCC1 Amb27956432 [0,0,0,1,0,0|3,0,0]=4 3784 B8R1.10 C\C=C\CN1CCC1 Amb27837892 [0,0,0,1,0,0|2,0,1]=4 3785 B8R1.10 ClCCCN1CCC1 Amb27220226 [0,0,0,1,0,0|2,0,1]=4 3786 B8R1.10 ClCCOC1CCC1 Amb25277094 [0,0,0,1,0,0|2,0,1]=4 3787 B8R1.10 Cl\C=C\CN1CCC1 Amb27810248 [0,0,0,1,0,0|2,0,1]=4 3788 B8R1.10 FCCCC1CNC1 Amb33196439 [0,0,0,1,0,0|2,0,1]=4 3789 B8R1.10 ICCCC1CCC1 Amb29849579 [0,0,0,1,0,0|1,0,1]=3 3790 B8R1.10 ICCOC1CCC1 Amb35626247 [0,0,0,1,0,0|2,0,1]=4 3791 B8R1.10 N#CCCC1CCC1 Amb26370301 [0,0,0,1,0,0|1,0,1]=3 3792 B8R1.10 N#CCCC1CNC1 Amb27662936 [0,0,0,1,0,0|2,0,1]=4 3793 B8R1.10 N#CCCN1CCC1 Amb26606371 [0,0,0,1,0,0|2,0,1]=4 3794 B8R1.10 N#CCOC1CCC1 Amb24435052 [0,0,0,1,0,0|2,0,1]=4 3795 B8R1.10 NCCCC1CCC1 Amb23570814 [0,0,0,1,0,0|1,0,1]=3 3796 B8R1.10 NCCCC1CCC1 Amb28934907 [0,0,0,1,0,0|1,0,1]=3 3797 B8R1.10 NCCCN1CCC1 Amb22039460 [0,0,0,1,0,0|2,0,1]=4 3798 B8R1.10 NCCNC1CCC1 Amb18989453 [0,0,0,1,0,0|2,0,1]=4 3799 B8R1.10 NCCOC1CCC1 Amb18993208 [0,0,0,1,0,0|2,0,1]=4 3800 B8R1.10 NCCOC1CCC1 Amb28990915 [0,0,0,1,0,0|2,0,1]=4 3801 B8R1.10 NCCSC1CCC1 Amb28049037 [0,0,0,1,0,0|2,0,1]=4 3802 B8R1.10 NNCCC1CCC1 Amb27855874 [0,0,0,1,0,0|2,0,0]=3 3803 B8R1.10 NNCCC1CCO1 Amb27209825 [0,0,0,1,0,0|3,0,0]=4 3804 B8R1.10 NNCCC1CCS1 Amb27849134 [0,0,0,1,0,0|3,0,0]=4 3805 B8R1.10 NNCCN1CCC1 Amb27412226 [0,0,0,1,0,0|3,0,0]=4 3806 B8R1.10 NOCCC1CCC1 Amb27779680 [0,0,0,1,0,0|2,0,0]=3 3807 B8R1.10 O=C=NCC1CCC1 Amb22058764 [0,0,0,1,0,0|1,0,1]=3 3808 B8R1.10 O=C=NCC1COC1 Amb23539048 [0,0,0,1,0,0|2,0,1]=4 3809 B8R1.10 O=C=NCC1CSC1 Amb35614809 [0,0,0,1,0,0|2,0,1]=4 3810 B8R1.10 O=CCCC1=CCC1 Amb28130448 [0,0,0,1,0,0|0,0,2]=3 3811 B8R1.10 O=CCCC1CCC1 Amb27244128 [0,0,0,1,0,0|0,0,0]=1 3812 B8R1.10 O=CCCC1CCO1 Amb28056173 [0,0,0,1,0,0|1,0,0]=2 3813 B8R1.10 O=CCNC1CSC1 Amb27634059 [0,0,0,1,0,0|2,0,0]=3 3814 B8R1.10 O=CCOC1COC1 Amb27775737 [0,0,0,1,0,0|2,0,0]=3 3815 B8R1.10 O=CNCC1CSC1 Amb35635236 [0,0,0,1,0,0|2,0,0]=3 3816 B8R1.10 O=C\C=C\C1CCC1 Amb33361629 [0,0,0,1,0,0|0,0,2]=3 3817 B8R1.10 OCCCC1CCC1 Amb23570813 [0,0,0,1,0,0|0,0,2]=3 3818 B8R1.10 OCCCC1CCN1 Amb27792141 [0,0,0,1,0,0|1,0,2]=4 3819 B8R1.10 OCCCC1CNC1 Amb22737371 [0,0,0,1,0,0|1,0,2]=4 3820 B8R1.10 OCCCN1CCC1 Amb22292344 [0,0,0,1,0,0|1,0,2]=4 3821 B8R1.10 OCCNC1CCC1 Amb18982433 [0,0,0,1,0,0|1,0,2]=4 3822 B8R1.10 OCCOC1CCC1 Amb20622528 [0,0,0,1,0,0|1,0,2]=4 3823 B8R1.10 OCCSC1CCC1 Amb27424672 [0,0,0,1,0,0|1,0,2]=4 3824 B8R1.10 OCNCC1CCC1 Amb27838337 [0,0,0,1,0,0|1,0,2]=4 3825 B8R1.10 S=C=NCC1CCC1 Amb8929542 [0,0,0,1,0,0|1,1,1]=4 3826 B8R1.10 SCCCC1CCC1 Amb33197136 [0,0,0,1,0,0|0,1,1]=3 3827 B8R1.10 SCCOC1CCC1 Amb27424228 [0,0,0,1,0,0|1,1,1]=4 3828 B8R1.10 [C-]#[N+]CCC1CCC1 Amb27636011 [0,0,0,1,0,0|2,0,0]=3 3829 B8R1.10 [N-]=[N+]=NCC1CCC1 Amb26017061 [0,0,0,1,0,0|3,0,0]=4 3830 B8R1.11 C#CC1CCCC1N Amb27429822 [0,0,0,1,0,0|2,0,1]=4 3831 B8R1.11 C#CC1CCCC1O Amb22496803 [0,0,0,1,0,0|2,0,1]=4 3832 B8R1.11 C#CC1CCCN1C Amb33169106 [0,0,0,1,0,0|2,0,1]=4 3833 B8R1.11 C#CC1CCCN1C Amb35750848 [0,0,0,1,0,0|2,0,1]=4 3834 B8R1.11 C#CC1CCNC1C Amb33169157 [0,0,0,1,0,0|2,0,1]=4 3835 B8R1.11 C#CC1CCOC1C Amb33169153 [0,0,0,1,0,0|2,0,1]=4 3836 B8R1.11 C#CC1NCCC1C Amb33169130 [0,0,0,1,0,0|2,0,1]=4 3837 B8R1.11 C#C[C@@H]1CCC[C@@H]1O Amb27186868 [0,0,0,1,0,0|2,0,1]=4 3838 B8R1.11 C#C[C@@H]1CCC[C@H]1O Amb25746628 [0,0,0,1,0,0|2,0,1]=4 3839 B8R1.11 C#C[C@H]1CCC[C@@H]1O Amb4019199 [0,0,0,1,0,0|2,0,1]=4 3840 B8R1.11 C=C1CCC[C@@H]1CO Amb27775869 [0,0,0,1,0,0|2,0,0]=3 3841 B8R1.11 C=C1CNCC1NC Amb27967218 [0,0,0,1,0,0|3,0,0]=4 3842 B8R1.11 C=C1CNC[C@H]1NC Amb28067689 [0,0,0,1,0,0|3,0,0]=4 3843 B8R1.11 C=C1COCC1CC Amb35646844 [0,0,0,1,0,0|2,0,0]=3 3844 B8R1.11 C=CC1CCCC1O Amb28460729 [0,0,0,1,0,0|2,0,0]=3 3845 B8R1.11 C=CC1CCNC1=O Amb27459841 [0,0,0,1,0,0|1,0,2]=4 3846 B8R1.11 C=CC1CCOC1C Amb33427133 [0,0,0,1,0,0|2,0,0]=3 3847 B8R1.11 C=CC1CNCC1O Amb25189891 [0,0,0,1,0,0|3,0,0]=4 3848 B8R1.11 C=CC1COCC1N Amb27596175 [0,0,0,1,0,0|3,0,0]=4 3849 B8R1.11 C=CC1COCC1O Amb25869017 [0,0,0,1,0,0|3,0,0]=4 3850 B8R1.11 C=CC1NCCC1=O Amb28073414 [0,0,0,1,0,0|1,0,2]=4 3851 B8R1.11 C=CC1OCCC1N Amb25080525 [0,0,0,1,0,0|3,0,0]=4 3852 B8R1.11 C=CC1OCCC1N Amb32661547 [0,0,0,1,0,0|3,0,0]=4 3853 B8R1.11 C=CN1CCCC1=O Amb15691738 [0,0,0,1,0,0|1,0,2]=4 3854 B8R1.11 C=CN1CCCC1=O Amb6608815 [0,0,0,1,0,0|1,0,2]=4 3855 B8R1.11 C=CN1CCCC1=O Amb8627756 [0,0,0,1,0,0|1,0,2]=4 3856 B8R1.11 C=C[C@@H]1CCC[C@@H]1N Amb28134242 [0,0,0,1,0,0|2,0,0]=3 3857 B8R1.11 C=C[C@@H]1CCC[C@H]1N Amb27805178 [0,0,0,1,0,0|2,0,0]=3 3858 B8R1.11 C=C[C@@H]1CCC[C@H]1O Amb22802079 [0,0,0,1,0,0|2,0,0]=3 3859 B8R1.11 C=C[C@@H]1CNC[C@H]1O Amb24561646 [0,0,0,1,0,0|3,0,0]=4 3860 B8R1.11 C=C[C@@H]1COC[C@H]1O Amb26438837 [0,0,0,1,0,0|3,0,0]=4 3861 B8R1.11 C=C[C@@H]1OCC[C@@H]1Cl Amb27959188 [0,0,0,1,0,0|3,0,0]=4 3862 B8R1.11 C=C[C@@H]1OCC[C@@H]1O Amb27215074 [0,0,0,1,0,0|3,0,0]=4 3863 B8R1.11 C=C[C@@H]1OCC[C@H]1N Amb27250501 [0,0,0,1,0,0|3,0,0]=4 3864 B8R1.11 C=C[C@@H]1OCC[C@H]1N Amb32661830 [0,0,0,1,0,0|3,0,0]=4 3865 B8R1.11 C=C[C@@H]1OCC[C@H]1O Amb28053797 [0,0,0,1,0,0|3,0,0]=4 3866 B8R1.11 C=C[C@H]1OCC[C@@H]1N Amb28283159 [0,0,0,1,0,0|3,0,0]=4 3867 B8R1.11 C=C[C@H]1OCC[C@H]1O Amb27210232 [0,0,0,1,0,0|3,0,0]=4 3868 B8R1.11 CC1=C(C=O)CCO1 Amb28320103 [0,0,0,1,0,0|1,0,2]=4 3869 B8R1.11 CC1=C(C=O)SCC1 Amb18642671 [0,0,0,1,0,0|1,0,2]=4 3870 B8R1.11 CC1CCCC1C#N Amb24415234 [0,0,0,1,0,0|1,0,1]=3 3871 B8R1.11 CC1CCCC1C=O Amb18124243 [0,0,0,1,0,0|0,0,0]=1 3872 B8R1.11 CC1CCCC1CBr Amb27484135 [0,0,0,1,0,0|1,0,1]=3 3873 B8R1.11 CC1CCCC1CN Amb28990978 [0,0,0,1,0,0|1,0,1]=3 3874 B8R1.11 CC1CCCC1CN Amb33527076 [0,0,0,1,0,0|1,0,1]=3 3875 B8R1.11 CC1CCCC1NN Amb27839227 [0,0,0,1,0,0|2,0,0]=3 3876 B8R1.11 CC1CCC\C1=N/N Amb27457539 [0,0,0,1,0,0|2,0,1]=4 3877 B8R1.11 CC1CCNC1CN Amb28256754 [0,0,0,1,0,0|2,0,1]=4 3878 B8R1.11 CC1CCNC1CO Amb23441154 [0,0,0,1,0,0|1,0,2]=4 3879 B8R1.11 CC1CCOC1C=O Amb28068828 [0,0,0,1,0,0|1,0,0]=2 3880 B8R1.11 CC1CCOC1CCl Amb27780309 [0,0,0,1,0,0|2,0,1]=4 3881 B8R1.11 CC1CCOC1CI Amb28287052 [0,0,0,1,0,0|2,0,1]=4 3882 B8R1.11 CC1CNCC1C#N Amb27451739 [0,0,0,1,0,0|2,0,1]=4 3883 B8R1.11 CC1CNCC1CCl Amb27467789 [0,0,0,1,0,0|2,0,1]=4 3884 B8R1.11 CC1CNCC1CN Amb2696276 [0,0,0,1,0,0|2,0,1]=4 3885 B8R1.11 CC1CNCC1CO Amb25739981 [0,0,0,1,0,0|1,0,2]=4 3886 B8R1.11 CC1CNCC1CO Amb29083427 [0,0,0,1,0,0|1,0,2]=4 3887 B8R1.11 CC1COCC1C#N Amb29849568 [0,0,0,1,0,0|2,0,1]=4 3888 B8R1.11 CC1COCC1C=O Amb29882774 [0,0,0,1,0,0|1,0,0]=2 3889 B8R1.11 CC1COCC1CBr Amb35616316 [0,0,0,1,0,0|2,0,1]=4 3890 B8R1.11 CC1COCC1CCl Amb25889386 [0,0,0,1,0,0|2,0,1]=4 3891 B8R1.11 CC1COCC1CO Amb23399676 [0,0,0,1,0,0|1,0,2]=4 3892 B8R1.11 CC1COCC1NN Amb35616344 [0,0,0,1,0,0|3,0,0]=4 3893 B8R1.11 CC1COCC1NO Amb35635908 [0,0,0,1,0,0|2,0,1]=4 3894 B8R1.11 CC1NCCC1CCl Amb27249431 [0,0,0,1,0,0|2,0,1]=4 3895 B8R1.11 CC1NCCC1CN Amb18203354 [0,0,0,1,0,0|2,0,1]=4 3896 B8R1.11 CC1NCCC1CO Amb26463701 [0,0,0,1,0,0|1,0,2]=4 3897 B8R1.11 CC1OCCC1C=O Amb18641773 [0,0,0,1,0,0|1,0,0]=2 3898 B8R1.11 CC1OCCC1CBr Amb33550567 [0,0,0,1,0,0|2,0,1]=4 3899 B8R1.11 CC1OCCC1CCl Amb25882789 [0,0,0,1,0,0|2,0,1]=4 3900 B8R1.11 CC1OCCC1CO Amb26515717 [0,0,0,1,0,0|1,0,2]=4 3901 B8R1.11 CC1OCCC1CS Amb33426771 [0,0,0,1,0,0|1,1,1]=4 3902 B8R1.11 CC1OCCC1NN Amb25696875 [0,0,0,1,0,0|3,0,0]=4 3903 B8R1.11 CC1OCCN1N=O Amb28343740 [0,0,0,1,0,0|3,0,0]=4 3904 B8R1.11 CC1SCCC1CN Amb27625343 [0,0,0,1,0,0|2,0,1]=4 3905 B8R1.11 CC1SCCC1NN Amb28397939 [0,0,0,1,0,0|3,0,0]=4 3906 B8R1.11 CC1SCCN1N=O Amb27391646 [0,0,0,1,0,0|3,0,0]=4 3907 B8R1.11 CCC1=C(C)CCC1 Amb22227944 [0,0,0,1,0,0|1,0,1]=3 3908 B8R1.11 CCC1=C(S)CCO1 Amb28253028 [0,0,0,1,0,0|1,1,1]=4 3909 B8R1.11 CCC1=CCCC1=O Amb17778667 [0,0,0,1,0,0|0,0,2]=3 3910 B8R1.11 CCC1=CCSC1=O Amb27967999 [0,0,0,1,0,0|1,0,2]=4 3911 B8R1.11 CCC1C=CNC1=O Amb27882600 [0,0,0,1,0,0|1,0,2]=4 3912 B8R1.11 CCC1CCCC1=O Amb16187019 [0,0,0,1,0,0|0,0,0]=1 3913 B8R1.11 CCC1CCCC1C Amb25788505 [0,0,0,1,0,0|1,0,1]=3 3914 B8R1.11 CCC1CCCC1N Amb9776220 [0,0,0,1,0,0|1,0,1]=3 3915 B8R1.11 CCC1CCCC1O Amb20621081 [0,0,0,1,0,0|0,0,2]=3 3916 B8R1.11 CCC1CCCC1S Amb24759652 [0,0,0,1,0,0|0,1,1]=3 3917 B8R1.11 CCC1CCCN1N Amb24354847 [0,0,0,1,0,0|2,0,0]=3 3918 B8R1.11 CCC1CCNC1=O Amb19516780 [0,0,0,1,0,0|1,0,0]=2 3919 B8R1.11 CCC1CCNC1C Amb28934809 [0,0,0,1,0,0|2,0,1]=4 3920 B8R1.11 CCC1CCOC1=O Amb23538353 [0,0,0,1,0,0|1,0,0]=2 3921 B8R1.11 CCC1CCSC1=O Amb27420755 [0,0,0,1,0,0|1,0,0]=2 3922 B8R1.11 CCC1CNCC1C Amb28346924 [0,0,0,1,0,0|2,0,1]=4 3923 B8R1.11 CCC1CNCC1F Amb27167810 [0,0,0,1,0,0|2,0,1]=4 3924 B8R1.11 CCC1CNCC1N Amb26993384 [0,0,0,1,0,0|2,0,1]=4 3925 B8R1.11 CCC1CNCC1O Amb28245846 [0,0,0,1,0,0|1,0,2]=4 3926 B8R1.11 CCC1COCC1=O Amb29866231 [0,0,0,1,0,0|1,0,0]=2 3927 B8R1.11 CCC1COCC1Br Amb35736875 [0,0,0,1,0,0|2,0,1]=4 3928 B8R1.11 CCC1COCC1Cl Amb35631935 [0,0,0,1,0,0|2,0,1]=4 3929 B8R1.11 CCC1COCC1N Amb29866237 [0,0,0,1,0,0|2,0,1]=4 3930 B8R1.11 CCC1COCC1O Amb24675632 [0,0,0,1,0,0|1,0,2]=4 3931 B8R1.11 CCC1COCC1S Amb32788757 [0,0,0,1,0,0|1,1,1]=4 3932 B8R1.11 CCC1CSCC1Cl Amb28316137 [0,0,0,1,0,0|2,0,1]=4 3933 B8R1.11 CCC1CSCC1N Amb18202902 [0,0,0,1,0,0|2,0,1]=4 3934 B8R1.11 CCC1CSCC1O Amb28316138 [0,0,0,1,0,0|1,0,2]=4 3935 B8R1.11 CCC1NCCC1=O Amb18833066 [0,0,0,1,0,0|1,0,0]=2 3936 B8R1.11 CCC1NCCC1C Amb28934808 [0,0,0,1,0,0|2,0,1]=4 3937 B8R1.11 CCC1NCCC1N Amb18203353 [0,0,0,1,0,0|2,0,1]=4 3938 B8R1.11 CCC1NCCC1O Amb18833009 [0,0,0,1,0,0|1,0,2]=4 3939 B8R1.11 CCC1NCCC1O Amb32411997 [0,0,0,1,0,0|1,0,2]=4 3940 B8R1.11 CCC1OC=CC1=O Amb27828824 [0,0,0,1,0,0|1,0,2]=4 3941 B8R1.11 CCC1OCCC1=O Amb28324362 [0,0,0,1,0,0|1,0,0]=2 3942 B8R1.11 CCC1OCCC1N Amb25702085 [0,0,0,1,0,0|2,0,1]=4 3943 B8R1.11 CCC1OCCC1O Amb27197541 [0,0,0,1,0,0|1,0,2]=4 3944 B8R1.11 CCC1SCCC1=O Amb27825839 [0,0,0,1,0,0|1,0,0]=2 3945 B8R1.11 CCC1SCCC1Br Amb28285217 [0,0,0,1,0,0|2,0,1]=4 3946 B8R1.11 CCC1SCCC1O Amb27409767 [0,0,0,1,0,0|1,0,2]=4 3947 B8R1.11 CCC1SCNC1=O Amb27838311 [0,0,0,1,0,0|2,0,0]=3 3948 B8R1.11 CCN1CCCC1=O Amb8390680 [0,0,0,1,0,0|1,0,0]=2 3949 B8R1.11 CCN1CCN=C1C Amb27228803 [0,0,0,1,0,0|3,0,0]=4 3950 B8R1.11 CCN1CCNC1=O Amb19333131 [0,0,0,1,0,0|2,0,0]=3 3951 B8R1.11 CCN1CCNC1=S Amb19886955 [0,0,0,1,0,0|2,1,0]=4 3952 B8R1.11 CCN1CNCC1=O Amb24391792 [0,0,0,1,0,0|2,0,0]=3 3953 B8R1.11 CCN1OCCC1=O Amb28197287 [0,0,0,1,0,0|2,0,0]=3 3954 B8R1.11 CC[C@@H]1CCCC1=O Amb27164677 [0,0,0,1,0,0|0,0,0]=1 3955 B8R1.11 CC[C@@H]1CCC[C@@H]1N Amb27786242 [0,0,0,1,0,0|1,0,1]=3 3956 B8R1.11 CC[C@@H]1CCC[C@H]1N Amb27786896 [0,0,0,1,0,0|1,0,1]=3 3957 B8R1.11 CC[C@@H]1CCC[C@H]1O Amb26421340 [0,0,0,1,0,0|0,0,2]=3 3958 B8R1.11 CC[C@@H]1CNC[C@@H]1N Amb25186818 [0,0,0,1,0,0|2,0,1]=4 3959 B8R1.11 CC[C@@H]1CNC[C@H]1N Amb27627282 [0,0,0,1,0,0|2,0,1]=4 3960 B8R1.11 CC[C@@H]1CNC[C@H]1O Amb24560816 [0,0,0,1,0,0|1,0,2]=4 3961 B8R1.11 CC[C@@H]1COC[C@H]1O Amb32944586 [0,0,0,1,0,0|1,0,2]=4 3962 B8R1.11 CC[C@@H]1NCC[C@H]1C Amb18833052 [0,0,0,1,0,0|2,0,1]=4 3963 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb25168928 [0,0,0,1,0,0|1,0,2]=4 3964 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb33379057 [0,0,0,1,0,0|1,0,2]=4 3965 B8R1.11 CC[C@@H]1OCC[C@H]1Br Amb27634877 [0,0,0,1,0,0|2,0,1]=4 3966 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,0,0,1,0,0|2,0,1]=4 3967 B8R1.11 CC[C@H]1CCCC1=O Amb27256510 [0,0,0,1,0,0|0,0,0]=1 3968 B8R1.11 CC[C@H]1CCC[C@@H]1C Amb26430749 [0,0,0,1,0,0|1,0,1]=3 3969 B8R1.11 CC[C@H]1CCC[C@H]1C Amb28194950 [0,0,0,1,0,0|1,0,1]=3 3970 B8R1.11 CC[C@H]1CNC[C@H]1O Amb27459736 [0,0,0,1,0,0|1,0,2]=4 3971 B8R1.11 CC[C@H]1OCC[C@H]1O Amb28435763 [0,0,0,1,0,0|1,0,2]=4 3972 B8R1.11 CC[C@H]1SCC[C@H]1O Amb27625677 [0,0,0,1,0,0|1,0,2]=4 3973 B8R1.11 CC[N+]1=C(C)SCC1 Amb3941665 [0,0,0,1,0,0|3,0,0]=4 3974 B8R1.11 CN1CCCC1C#N Amb18641625 [0,0,0,1,0,0|2,0,1]=4 3975 B8R1.11 CN1CCCC1CBr Amb19650986 [0,0,0,1,0,0|2,0,1]=4 3976 B8R1.11 CN1CCCC1CBr Amb33550876 [0,0,0,1,0,0|2,0,1]=4 3977 B8R1.11 CN1CCCC1CCl Amb15701611 [0,0,0,1,0,0|2,0,1]=4 3978 B8R1.11 CN1CCCC1CCl Amb22499600 [0,0,0,1,0,0|2,0,1]=4 3979 B8R1.11 CN1CCCC1CN Amb22587695 [0,0,0,1,0,0|2,0,1]=4 3980 B8R1.11 CN1CCCC1CN Amb9731098 [0,0,0,1,0,0|2,0,1]=4 3981 B8R1.11 CN1CCCC1CO Amb13951143 [0,0,0,1,0,0|1,0,2]=4 3982 B8R1.11 CN1CCCC1CS Amb28145111 [0,0,0,1,0,0|1,1,1]=4 3983 B8R1.11 CN1CCC[C@@H]1CBr Amb22756484 [0,0,0,1,0,0|2,0,1]=4 3984 B8R1.11 CN1CCC[C@@H]1CCl Amb27267910 [0,0,0,1,0,0|2,0,1]=4 3985 B8R1.11 CN1CCC[C@@H]1CCl Amb29752239 [0,0,0,1,0,0|2,0,1]=4 3986 B8R1.11 CN1CCC[C@@H]1CN Amb22406270 [0,0,0,1,0,0|2,0,1]=4 3987 B8R1.11 CN1CCC[C@@H]1CN Amb22751420 [0,0,0,1,0,0|2,0,1]=4 3988 B8R1.11 CN1CCC[C@@H]1CO Amb13887229 [0,0,0,1,0,0|1,0,2]=4 3989 B8R1.11 CN1CCC[C@H]1C=O Amb22225407 [0,0,0,1,0,0|1,0,0]=2 3990 B8R1.11 CN1CCC[C@H]1CBr Amb22225946 [0,0,0,1,0,0|2,0,1]=4 3991 B8R1.11 CN1CCC[C@H]1CCl Amb22226497 [0,0,0,1,0,0|2,0,1]=4 3992 B8R1.11 CN1CCC[C@H]1CN Amb10603238 [0,0,0,1,0,0|2,0,1]=4 3993 B8R1.11 CN1CCC[C@H]1CN Amb33801735 [0,0,0,1,0,0|2,0,1]=4 3994 B8R1.11 CN1CCC[C@H]1CO Amb3939162 [0,0,0,1,0,0|1,0,2]=4 3995 B8R1.11 CNC1=CCCC1=O Amb28457232 [0,0,0,1,0,0|1,0,2]=4 3996 B8R1.11 CNC1CCCC1C Amb18276776 [0,0,0,1,0,0|2,0,0]=3 3997 B8R1.11 CNC1CCCC1F Amb27461856 [0,0,0,1,0,0|2,0,1]=4 3998 B8R1.11 CNC1CCCC1O Amb17231821 [0,0,0,1,0,0|1,0,2]=4 3999 B8R1.11 CNC1CCNC1=O Amb22059501 [0,0,0,1,0,0|2,0,0]=3 4000 B8R1.11 CNC1CCNC1=O Amb28990981 [0,0,0,1,0,0|2,0,0]=3 4001 B8R1.11 CNC1CCSC1=O Amb27234396 [0,0,0,1,0,0|2,0,0]=3 4002 B8R1.11 CNC1CCSC1C Amb28048962 [0,0,0,1,0,0|3,0,0]=4 4003 B8R1.11 CNC1COCC1C Amb35632266 [0,0,0,1,0,0|3,0,0]=4 4004 B8R1.11 CNC1CSCC1C Amb27234038 [0,0,0,1,0,0|3,0,0]=4 4005 B8R1.11 CN[C@@H]1CCC[C@@H]1O Amb27240798 [0,0,0,1,0,0|1,0,2]=4 4006 B8R1.11 CN[C@@H]1CCC[C@H]1O Amb16230279 [0,0,0,1,0,0|1,0,2]=4 4007 B8R1.11 CN[C@@H]1CNC[C@H]1C Amb28388700 [0,0,0,1,0,0|3,0,0]=4 4008 B8R1.11 CN[C@H]1CCNC1=O Amb28042561 [0,0,0,1,0,0|2,0,0]=3 4009 B8R1.11 CN[C@H]1CCOC1=O Amb28288608 [0,0,0,1,0,0|2,0,0]=3 4010 B8R1.11 COC1=CCCC1=O Amb28316240 [0,0,0,1,0,0|1,0,2]=4 4011 B8R1.11 COC1CCCC1=O Amb24573567 [0,0,0,1,0,0|1,0,0]=2 4012 B8R1.11 COC1CCCC1Br Amb18796094 [0,0,0,1,0,0|2,0,1]=4 4013 B8R1.11 COC1CCCC1Cl Amb27877535 [0,0,0,1,0,0|2,0,1]=4 4014 B8R1.11 COC1CCCC1I Amb27766967 [0,0,0,1,0,0|2,0,1]=4 4015 B8R1.11 COC1CCCC1N Amb1141892 [0,0,0,1,0,0|2,0,1]=4 4016 B8R1.11 COC1CCCC1N Amb9677364 [0,0,0,1,0,0|2,0,1]=4 4017 B8R1.11 COC1CCCC1O Amb19515034 [0,0,0,1,0,0|1,0,2]=4 4018 B8R1.11 COC1CCCC1S Amb26589597 [0,0,0,1,0,0|1,1,1]=4 4019 B8R1.11 COC1CCNC1C Amb32409758 [0,0,0,1,0,0|3,0,0]=4 4020 B8R1.11 COC1CCOC1=O Amb28127714 [0,0,0,1,0,0|2,0,0]=3 4021 B8R1.11 CON1CCOC1=O Amb25769302 [0,0,0,1,0,0|3,0,0]=4 4022 B8R1.11 CO[C@@H]1CC=CC1=O Amb27260476 [0,0,0,1,0,0|1,0,2]=4 4023 B8R1.11 CO[C@@H]1CCC[C@@H]1N Amb25168975 [0,0,0,1,0,0|2,0,1]=4 4024 B8R1.11 CO[C@@H]1CCC[C@@H]1O Amb28400066 [0,0,0,1,0,0|1,0,2]=4 4025 B8R1.11 CO[C@@H]1CCC[C@H]1Br Amb27860439 [0,0,0,1,0,0|2,0,1]=4 4026 B8R1.11 CO[C@@H]1CCC[C@H]1N Amb19514596 [0,0,0,1,0,0|2,0,1]=4 4027 B8R1.11 CO[C@@H]1CCC[C@H]1N Amb19514597 [0,0,0,1,0,0|2,0,1]=4 4028 B8R1.11 CO[C@@H]1CCC[C@H]1O Amb19372843 [0,0,0,1,0,0|1,0,2]=4 4029 B8R1.11 CO[C@H]1CC=CC1=O Amb27262725 [0,0,0,1,0,0|1,0,2]=4 4030 B8R1.11 CO[C@H]1CCC[C@@H]1N Amb13951500 [0,0,0,1,0,0|2,0,1]=4 4031 B8R1.11 CO[C@H]1CCC[C@@H]1O Amb27245897 [0,0,0,1,0,0|1,0,2]=4 4032 B8R1.11 CSC1=CCCC1=O Amb28351431 [0,0,0,1,0,0|1,0,2]=4 4033 B8R1.11 CSC1CCCC1N Amb18642859 [0,0,0,1,0,0|2,0,1]=4 4034 B8R1.11 CSC1CCOC1C Amb25763217 [0,0,0,1,0,0|3,0,0]=4 4035 B8R1.11 CS[C@@H]1CCC[C@@H]1O Amb27853579 [0,0,0,1,0,0|1,0,2]=4 4036 B8R1.11 C[C@@H]1CCC[C@H]1C=O Amb28146820 [0,0,0,1,0,0|0,0,0]=1 4037 B8R1.11 C[C@@H]1CCC[C@H]1CBr Amb24603453 [0,0,0,1,0,0|1,0,1]=3 4038 B8R1.11 C[C@@H]1CCC[C@H]1CO Amb25258782 [0,0,0,1,0,0|0,0,2]=3 4039 B8R1.11 C[C@@H]1CCO[C@@H]1CBr Amb33328854 [0,0,0,1,0,0|2,0,1]=4 4040 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33329080 [0,0,0,1,0,0|2,0,1]=4 4041 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33331033 [0,0,0,1,0,0|2,0,1]=4 4042 B8R1.11 C[C@@H]1CCO[C@@H]1CO Amb33328615 [0,0,0,1,0,0|1,0,2]=4 4043 B8R1.11 C[C@@H]1CNC[C@H]1CN Amb28062618 [0,0,0,1,0,0|2,0,1]=4 4044 B8R1.11 C[C@@H]1CNC[C@H]1CO Amb13883444 [0,0,0,1,0,0|1,0,2]=4 4045 B8R1.11 C[C@@H]1COC[C@H]1CO Amb28346310 [0,0,0,1,0,0|1,0,2]=4 4046 B8R1.11 C[C@@H]1NCC[C@@H]1CO Amb26414508 [0,0,0,1,0,0|1,0,2]=4 4047 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb22886286 [0,0,0,1,0,0|2,0,1]=4 4048 B8R1.11 C[C@@H]1OCC[C@@H]1CO Amb22886851 [0,0,0,1,0,0|1,0,2]=4 4049 B8R1.11 C[C@H]1CCC=C1C=O Amb28251104 [0,0,0,1,0,0|0,0,2]=3 4050 B8R1.11 C[C@H]1CCC[C@@H]1CN Amb28423931 [0,0,0,1,0,0|1,0,1]=3 4051 B8R1.11 C[C@H]1CCN[C@@H]1CO Amb27631283 [0,0,0,1,0,0|1,0,2]=4 4052 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb22232058 [0,0,0,1,0,0|1,0,2]=4 4053 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb34159412 [0,0,0,1,0,0|1,0,2]=4 4054 B8R1.11 C[C@H]1CNC[C@H]1CN Amb32672061 [0,0,0,1,0,0|2,0,1]=4 4055 B8R1.11 C[C@H]1NCC[C@H]1CO Amb27629700 [0,0,0,1,0,0|1,0,2]=4 4056 B8R1.11 C[C@H]1OCC[C@@H]1CO Amb34915718 [0,0,0,1,0,0|1,0,2]=4 4057 B8R1.11 C[C@H]1OCC[C@H]1CO Amb25328798 [0,0,0,1,0,0|1,0,2]=4 4058 B8R1.11 C\C=C1\CCCC1=O Amb25205820 [0,0,0,1,0,0|0,0,2]=3 4059 B8R1.11 C\C=C1\CCCN1C Amb28133589 [0,0,0,1,0,0|2,0,1]=4 4060 B8R1.11 C\C=C1\CCNC1=O Amb28397116 [0,0,0,1,0,0|1,0,2]=4 4061 B8R1.11 ClCC1=C(Cl)CCC1 Amb27807649 [0,0,0,1,0,0|2,0,1]=4 4062 B8R1.11 N#CC1CCCC1=N Amb4036622 [0,0,0,1,0,0|2,0,1]=4 4063 B8R1.11 N#CC1CCCC1=O Amb9774970 [0,0,0,1,0,0|1,0,1]=3 4064 B8R1.11 N#CC1CCCC1Cl Amb28076518 [0,0,0,1,0,0|2,0,1]=4 4065 B8R1.11 N#CC1CCCC1F Amb27968263 [0,0,0,1,0,0|2,0,1]=4 4066 B8R1.11 N#CC1CCCC1N Amb18278185 [0,0,0,1,0,0|2,0,1]=4 4067 B8R1.11 N#CC1CCCC1O Amb8923607 [0,0,0,1,0,0|2,0,1]=4 4068 B8R1.11 N#CC1CCNC1=O Amb24053097 [0,0,0,1,0,0|2,0,1]=4 4069 B8R1.11 N#CC1CCOC1=O Amb6669560 [0,0,0,1,0,0|2,0,1]=4 4070 B8R1.11 N#CC1CCSC1=O Amb28206797 [0,0,0,1,0,0|2,0,1]=4 4071 B8R1.11 N#CC1CNCC1=O Amb22297522 [0,0,0,1,0,0|2,0,1]=4 4072 B8R1.11 N#CC1COCC1=O Amb24183529 [0,0,0,1,0,0|2,0,1]=4 4073 B8R1.11 N#CC1CSCC1=O Amb597776 [0,0,0,1,0,0|2,0,1]=4 4074 B8R1.11 N#CN1CCCC1=O Amb27784093 [0,0,0,1,0,0|2,0,1]=4 4075 B8R1.11 N#C[C@@H]1CCC[C@@H]1N Amb24571403 [0,0,0,1,0,0|2,0,1]=4 4076 B8R1.11 N#C[C@@H]1CCC[C@@H]1N Amb34156491 [0,0,0,1,0,0|2,0,1]=4 4077 B8R1.11 N#C[C@@H]1CCC[C@@H]1N Amb34156720 [0,0,0,1,0,0|2,0,1]=4 4078 B8R1.11 N#C[C@@H]1CCC[C@@H]1O Amb28285606 [0,0,0,1,0,0|2,0,1]=4 4079 B8R1.11 N#C[C@@H]1CCC[C@H]1O Amb19148606 [0,0,0,1,0,0|2,0,1]=4 4080 B8R1.11 N#C[C@H]1CCCC1=O Amb25979444 [0,0,0,1,0,0|1,0,1]=3 4081 B8R1.11 N#C[C@H]1CCC[C@@H]1N Amb28197947 [0,0,0,1,0,0|2,0,1]=4 4082 B8R1.11 N#C[C@H]1CCC[C@H]1N Amb19148271 [0,0,0,1,0,0|2,0,1]=4 4083 B8R1.11 N#C[C@H]1CCC[C@H]1N Amb23439685 [0,0,0,1,0,0|2,0,1]=4 4084 B8R1.11 NC1CCCC1CO Amb18641836 [0,0,0,1,0,0|1,0,2]=4 4085 B8R1.11 NC1CCCC1CO Amb32666151 [0,0,0,1,0,0|1,0,2]=4 4086 B8R1.11 NCC1CCCC1=O Amb18833069 [0,0,0,1,0,0|1,0,0]=2 4087 B8R1.11 NCC1CCCC1=O Amb28934823 [0,0,0,1,0,0|1,0,0]=2 4088 B8R1.11 NCC1CCCC1F Amb28282081 [0,0,0,1,0,0|2,0,1]=4 4089 B8R1.11 NCC1CCCC1N Amb9781735 [0,0,0,1,0,0|2,0,1]=4 4090 B8R1.11 NCC1CCCC1O Amb22756654 [0,0,0,1,0,0|1,0,2]=4 4091 B8R1.11 NCC1CCCC1O Amb9286702 [0,0,0,1,0,0|1,0,2]=4 4092 B8R1.11 NCC1CCCC1S Amb32788471 [0,0,0,1,0,0|1,1,1]=4 4093 B8R1.11 NCC1CCCS1=O Amb27872352 [0,0,0,1,0,0|2,0,0]=3 4094 B8R1.11 NCC1CCNC1=O Amb18833033 [0,0,0,1,0,0|2,0,0]=3 4095 B8R1.11 NCC1CCOC1=O Amb28398456 [0,0,0,1,0,0|2,0,0]=3 4096 B8R1.11 NCC1CCOC1=O Amb32653583 [0,0,0,1,0,0|2,0,0]=3 4097 B8R1.11 NCC1CSCC1=O Amb24529601 [0,0,0,1,0,0|2,0,0]=3 4098 B8R1.11 NC[C@@H]1CCC[C@@H]1N Amb24580548 [0,0,0,1,0,0|2,0,1]=4 4099 B8R1.11 NC[C@@H]1CCC[C@@H]1O Amb25983417 [0,0,0,1,0,0|1,0,2]=4 4100 B8R1.11 NC[C@@H]1CCC[C@@H]1O Amb33743299 [0,0,0,1,0,0|1,0,2]=4 4101 B8R1.11 NC[C@@H]1CCC[C@H]1F Amb22886328 [0,0,0,1,0,0|2,0,1]=4 4102 B8R1.11 NC[C@@H]1CCC[C@H]1O Amb26550059 [0,0,0,1,0,0|1,0,2]=4 4103 B8R1.11 NC[C@@H]1CCC[C@H]1O Amb32663131 [0,0,0,1,0,0|1,0,2]=4 4104 B8R1.11 NC[C@H]1CCC[C@@H]1O Amb26873019 [0,0,0,1,0,0|1,0,2]=4 4105 B8R1.11 NC[C@H]1CCC[C@@H]1O Amb32663080 [0,0,0,1,0,0|1,0,2]=4 4106 B8R1.11 NC[C@H]1CCC[C@H]1O Amb25218839 [0,0,0,1,0,0|1,0,2]=4 4107 B8R1.11 NC[C@H]1CCC[C@H]1O Amb33743876 [0,0,0,1,0,0|1,0,2]=4 4108 B8R1.11 NN1CCCC1CO Amb18641896 [0,0,0,1,0,0|3,0,0]=4 4109 B8R1.11 NN1CCC[C@@H]1CO Amb22757469 [0,0,0,1,0,0|3,0,0]=4 4110 B8R1.11 NNC1CCCC1O Amb13952358 [0,0,0,1,0,0|3,0,0]=4 4111 B8R1.11 NNC1CCCC1O Amb21979355 [0,0,0,1,0,0|3,0,0]=4 4112 B8R1.11 NN[C@@H]1CCC[C@@H]1O Amb34916202 [0,0,0,1,0,0|3,0,0]=4 4113 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb22397265 [0,0,0,1,0,0|3,0,0]=4 4114 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb32663884 [0,0,0,1,0,0|3,0,0]=4 4115 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb32724354 [0,0,0,1,0,0|3,0,0]=4 4116 B8R1.11 NOC1CCCC1N Amb27445322 [0,0,0,1,0,0|3,0,0]=4 4117 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb22746052 [0,0,0,1,0,0|1,0,2]=4 4118 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb24056609 [0,0,0,1,0,0|1,0,2]=4 4119 B8R1.11 N[C@@H]1CCC[C@H]1CO Amb22231643 [0,0,0,1,0,0|1,0,2]=4 4120 B8R1.11 N[C@H]1CCC[C@H]1CBr Amb27637665 [0,0,0,1,0,0|2,0,1]=4 4121 B8R1.11 N[C@H]1CCC[C@H]1CO Amb1994025 [0,0,0,1,0,0|1,0,2]=4 4122 B8R1.11 N\C=C1/CCCC1=O Amb28324124 [0,0,0,1,0,0|1,0,2]=4 4123 B8R1.11 O=C1C=CCC1CO Amb27802494 [0,0,0,1,0,0|1,0,2]=4 4124 B8R1.11 O=C1CCC=C1CBr Amb27232822 [0,0,0,1,0,0|1,0,2]=4 4125 B8R1.11 O=C1CCCC1CCl Amb25111572 [0,0,0,1,0,0|1,0,0]=2 4126 B8R1.11 O=C1CCCC1CO Amb22491993 [0,0,0,1,0,0|1,0,0]=2 4127 B8R1.11 O=C1CCCN1CBr Amb24082678 [0,0,0,1,0,0|2,0,0]=3 4128 B8R1.11 O=C1CCCN1CCl Amb2793504 [0,0,0,1,0,0|2,0,0]=3 4129 B8R1.11 O=C1CCCN1CO Amb33552754 [0,0,0,1,0,0|2,0,0]=3 4130 B8R1.11 O=C1CCC[C@@H]1CO Amb28049022 [0,0,0,1,0,0|1,0,0]=2 4131 B8R1.11 O=C1CCC\C1=C/[O-] Amb19515665 [0,0,0,1,0,0|1,0,2]=4 4132 B8R1.11 O=C1CCC\C1=C\O Amb32439040 [0,0,0,1,0,0|1,0,2]=4 4133 B8R1.11 O=C1CCSN1CCl Amb27197784 [0,0,0,1,0,0|3,0,0]=4 4134 B8R1.11 O=C1NCCC1CO Amb33531235 [0,0,0,1,0,0|2,0,0]=3 4135 B8R1.11 O=C1NCCN1CO Amb24761511 [0,0,0,1,0,0|3,0,0]=4 4136 B8R1.11 O=C1OCCC1CO Amb26431337 [0,0,0,1,0,0|2,0,0]=3 4137 B8R1.11 O=C1OCOC1CCl Amb28367648 [0,0,0,1,0,0|3,0,0]=4 4138 B8R1.11 O=C1SCCC1CO Amb17593391 [0,0,0,1,0,0|2,0,0]=3 4139 B8R1.11 O=C1SCCN1CO Amb25135741 [0,0,0,1,0,0|3,0,0]=4 4140 B8R1.11 O=CC1=C(Cl)CCC1 Amb17593382 [0,0,0,1,0,0|1,0,2]=4 4141 B8R1.11 O=CC1CCCC1=O Amb24480732 [0,0,0,1,0,0|1,0,1]=3 4142 B8R1.11 O=CC1CCCC1O Amb28048922 [0,0,0,1,0,0|1,0,0]=2 4143 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,0,0,1,0,0|2,0,1]=4 4144 B8R1.11 O=CC1COCC1=O Amb27165171 [0,0,0,1,0,0|2,0,1]=4 4145 B8R1.11 O=CN1CCCC1=O Amb28293371 [0,0,0,1,0,0|2,0,1]=4 4146 B8R1.11 O=CN1CCCC1O Amb27857600 [0,0,0,1,0,0|2,0,0]=3 4147 B8R1.11 O=C[C@H]1CC=C[C@H]1O Amb27237646 [0,0,0,1,0,0|1,0,2]=4 4148 B8R1.11 O=NN1CCCC1=O Amb27837848 [0,0,0,1,0,0|3,0,0]=4 4149 B8R1.11 OC1CCCC1CCl Amb24386443 [0,0,0,1,0,0|1,0,2]=4 4150 B8R1.11 OCC1=C(Br)CCC1 Amb28316143 [0,0,0,1,0,0|2,0,1]=4 4151 B8R1.11 OCC1=C(Cl)CCC1 Amb28138779 [0,0,0,1,0,0|2,0,1]=4 4152 B8R1.11 OCC1CCCC1F Amb28318750 [0,0,0,1,0,0|1,0,2]=4 4153 B8R1.11 OCC1CCCC1O Amb8504106 [0,0,0,1,0,0|1,0,2]=4 4154 B8R1.11 OC[C@@H]1CCCN1O Amb27756423 [0,0,0,1,0,0|2,0,1]=4 4155 B8R1.11 OC[C@@H]1CCC[C@H]1Cl Amb27454845 [0,0,0,1,0,0|1,0,2]=4 4156 B8R1.11 OC[C@@H]1CCC[C@H]1O Amb28077597 [0,0,0,1,0,0|1,0,2]=4 4157 B8R1.11 ONC1CCCC1Cl Amb27238541 [0,0,0,1,0,0|2,0,1]=4 4158 B8R1.11 [C-]#[N+]C1CCCC1F Amb27636012 [0,0,0,1,0,0|3,0,0]=4 4159 B8R1.11 [C-]#[N+]C1CCCN1C Amb28245868 [0,0,0,1,0,0|3,0,0]=4 4160 B8R1.11 [C-]#[N+]C1CCOC1C Amb33427242 [0,0,0,1,0,0|3,0,0]=4 4161 B8R1.12 C#CC1CCN1CC Amb33169172 [0,0,0,1,0,0|2,0,1]=4 4162 B8R1.12 CCC1C=CC1C=O Amb27599775 [0,0,0,1,0,0|0,0,2]=3 4163 B8R1.12 CCC1CCC1CBr Amb33512084 [0,0,0,1,0,0|1,0,1]=3 4164 B8R1.12 CCC1CCC1CN Amb24483083 [0,0,0,1,0,0|1,0,1]=3 4165 B8R1.12 CCC1CCC1NC Amb27247645 [0,0,0,1,0,0|2,0,0]=3 4166 B8R1.12 CCC1CCN1CC Amb27833239 [0,0,0,1,0,0|2,0,1]=4 4167 B8R1.12 CCC1COC1CO Amb25948271 [0,0,0,1,0,0|1,0,2]=4 4168 B8R1.12 CCN1CCC1CN Amb27631267 [0,0,0,1,0,0|2,0,1]=4 4169 B8R1.12 CCN1CCC1CO Amb32668190 [0,0,0,1,0,0|1,0,2]=4 4170 B8R1.12 CNC1CCC1CO Amb27657865 [0,0,0,1,0,0|1,0,2]=4 4171 B8R1.12 CNC1CCC1OC Amb32685299 [0,0,0,1,0,0|3,0,0]=4 4172 B8R1.12 CNC1CCC1OC Amb32685300 [0,0,0,1,0,0|3,0,0]=4 4173 B8R1.12 CN[C@@H]1CC[C@H]1CO Amb27785815 [0,0,0,1,0,0|1,0,2]=4 4174 B8R1.12 COC1CCC1CN Amb25877244 [0,0,0,1,0,0|2,0,1]=4 4175 B8R1.12 COC1CCC1CO Amb24473419 [0,0,0,1,0,0|1,0,2]=4 4176 B8R1.12 CO[C@@H]1CC[C@@H]1CO Amb34913167 [0,0,0,1,0,0|1,0,2]=4 4177 B8R1.12 CO[C@@H]1CC[C@H]1CO Amb28059364 [0,0,0,1,0,0|1,0,2]=4 4178 B8R1.12 N#CC1CCC1CO Amb27197414 [0,0,0,1,0,0|2,0,1]=4 4179 B8R1.12 N#C[C@@H]1CC[C@H]1CCl Amb28387704 [0,0,0,1,0,0|2,0,1]=4 4180 B8R1.12 NCC1CCC1CF Amb20668104 [0,0,0,1,0,0|2,0,1]=4 4181 B8R1.12 NCC1CCC1CN Amb25131632 [0,0,0,1,0,0|2,0,1]=4 4182 B8R1.12 NCC1CCC1CN Amb33512810 [0,0,0,1,0,0|2,0,1]=4 4183 B8R1.12 NC[C@@H]1CC[C@H]1CN Amb9786836 [0,0,0,1,0,0|2,0,1]=4 4184 B8R1.12 O=CC1CCC1CF Amb27636210 [0,0,0,1,0,0|1,0,0]=2 4185 B8R1.12 OCC1CCC1CF Amb27965576 [0,0,0,1,0,0|1,0,2]=4 4186 B8R1.12 OCC1CCC1CO Amb20248362 [0,0,0,1,0,0|1,0,2]=4 4187 B8R1.12 OC[C@@H]1CC[C@H]1CO Amb24725649 [0,0,0,1,0,0|1,0,2]=4 4188 B8R1.12 OC[C@H]1CC[C@H]1CO Amb26476284 [0,0,0,1,0,0|1,0,2]=4 4189 B8R1.13 C#CCC1CCC1O Amb32944354 [0,0,0,1,0,0|2,0,1]=4 4190 B8R1.13 C=CCC1CCC1=O Amb17593141 [0,0,0,1,0,0|0,0,2]=3 4191 B8R1.13 C=CCC1CCC1O Amb33213296 [0,0,0,1,0,0|2,0,0]=3 4192 B8R1.13 CC1CCC1CCN Amb28049312 [0,0,0,1,0,0|1,0,1]=3 4193 B8R1.13 CC1CCC1N=C=S Amb28455561 [0,0,0,1,0,0|1,1,1]=4 4194 B8R1.13 CC1CCC1NC#N Amb27837552 [0,0,0,1,0,0|2,0,1]=4 4195 B8R1.13 CCCC1CCC1O Amb24359183 [0,0,0,1,0,0|0,0,2]=3 4196 B8R1.13 CCCC1CNC1=O Amb27413136 [0,0,0,1,0,0|1,0,0]=2 4197 B8R1.13 CCCC1SCC1O Amb27803103 [0,0,0,1,0,0|1,0,2]=4 4198 B8R1.13 CCO[C@@H]1CC[C@@H]1N Amb33495620 [0,0,0,1,0,0|2,0,1]=4 4199 B8R1.13 CCO[C@@H]1CC[C@H]1O Amb33495613 [0,0,0,1,0,0|1,0,2]=4 4200 B8R1.13 CN1CCC1CCN Amb28436400 [0,0,0,1,0,0|2,0,1]=4 4201 B8R1.13 CNCC1CCC1F Amb33715806 [0,0,0,1,0,0|2,0,1]=4 4202 B8R1.13 CNCC1CCC1F Amb33719038 [0,0,0,1,0,0|2,0,1]=4 4203 B8R1.13 COCC1CCC1=O Amb28069700 [0,0,0,1,0,0|1,0,0]=2 4204 B8R1.13 COCC1CCC1N Amb24483084 [0,0,0,1,0,0|2,0,1]=4 4205 B8R1.13 COCC1CCC1N Amb32653541 [0,0,0,1,0,0|2,0,1]=4 4206 B8R1.13 COCC1CCC1O Amb32944318 [0,0,0,1,0,0|1,0,2]=4 4207 B8R1.13 COC[C@@H]1CC[C@@H]1N Amb25937527 [0,0,0,1,0,0|2,0,1]=4 4208 B8R1.13 COC[C@@H]1CC[C@@H]1N Amb32661045 [0,0,0,1,0,0|2,0,1]=4 4209 B8R1.13 COC[C@@H]1CC[C@H]1N Amb25237707 [0,0,0,1,0,0|2,0,1]=4 4210 B8R1.13 COC[C@@H]1CC[C@H]1N Amb32661046 [0,0,0,1,0,0|2,0,1]=4 4211 B8R1.13 COC[C@H]1CC[C@@H]1N Amb25175635 [0,0,0,1,0,0|2,0,1]=4 4212 B8R1.13 COC[C@H]1CC[C@H]1N Amb25175719 [0,0,0,1,0,0|2,0,1]=4 4213 B8R1.13 C\C=C\C1CCC1O Amb33212898 [0,0,0,1,0,0|2,0,1]=4 4214 B8R1.13 NCCN1CCC1=O Amb27445366 [0,0,0,1,0,0|2,0,0]=3 4215 B8R1.13 O=C1CCC1CCCl Amb27252476 [0,0,0,1,0,0|1,0,0]=2 4216 B8R1.13 O=C=NC1CCC1Br Amb27983701 [0,0,0,1,0,0|2,0,1]=4 4217 B8R1.13 O=COC1CCC1Cl Amb27482699 [0,0,0,1,0,0|2,0,0]=3 4218 B8R1.13 O=CO[C@H]1CC[C@@H]1Br Amb27658994 [0,0,0,1,0,0|2,0,0]=3 4219 B8R1.13 O=CO[C@H]1CC[C@@H]1Cl Amb28051992 [0,0,0,1,0,0|2,0,0]=3 4220 B8R1.17 C=CC1OC1CCBr Amb28240205 [0,0,0,1,0,0|3,0,0]=4 4221 B8R1.17 C=CCC1OC1CCl Amb27592474 [0,0,0,1,0,0|3,0,0]=4 4222 B8R1.17 C=CC[C@@H]1O[C@@H]1CO Amb27972324 [0,0,0,1,0,0|3,0,0]=4 4223 B8R1.17 C=C[C@H]1O[C@H]1CCO Amb27208168 [0,0,0,1,0,0|3,0,0]=4 4224 B8R1.17 CC#C[C@@H]1C[C@H]1C=O Amb27195762 [0,0,0,1,0,0|0,0,2]=3 4225 B8R1.17 CCC1CC1NC=O Amb27167468 [0,0,0,1,0,0|1,0,0]=2 4226 B8R1.17 CCC1C[C@H]1CCO Amb28429951 [0,0,0,1,0,0|0,0,2]=3 4227 B8R1.17 CCC1OC1CCO Amb25144428 [0,0,0,1,0,0|1,0,2]=4 4228 B8R1.17 CCCC1CC1CC Amb25784549 [0,0,0,1,0,0|1,0,1]=3 4229 B8R1.17 CCCC1CC1NC Amb28131197 [0,0,0,1,0,0|2,0,0]=3 4230 B8R1.17 CCCC1SC1CO Amb27751937 [0,0,0,1,0,0|1,0,2]=4 4231 B8R1.17 CCC[C@@H]1C[C@@H]1C=O Amb27841173 [0,0,0,1,0,0|0,0,0]=1 4232 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33209408 [0,0,0,1,0,0|1,0,1]=3 4233 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33465479 [0,0,0,1,0,0|1,0,1]=3 4234 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,0,0,1,0,0|0,0,2]=3 4235 B8R1.17 CCC[C@@H]1O[C@@H]1C=O Amb28142382 [0,0,0,1,0,0|1,0,0]=2 4236 B8R1.17 CCC[C@@H]1O[C@@H]1CO Amb26564240 [0,0,0,1,0,0|1,0,2]=4 4237 B8R1.17 CCC[C@@H]1O[C@H]1CBr Amb28319242 [0,0,0,1,0,0|2,0,1]=4 4238 B8R1.17 CCC[C@H]1C[C@H]1CO Amb28345377 [0,0,0,1,0,0|0,0,2]=3 4239 B8R1.17 CCC[C@H]1S[C@@H]1CO Amb27977865 [0,0,0,1,0,0|1,0,2]=4 4240 B8R1.17 CCOC1CC1C#N Amb35717515 [0,0,0,1,0,0|2,0,1]=4 4241 B8R1.17 CCOC1CC1C=O Amb35720826 [0,0,0,1,0,0|1,0,0]=2 4242 B8R1.17 CCOC1CC1CBr Amb35732117 [0,0,0,1,0,0|2,0,1]=4 4243 B8R1.17 CCOC1CC1CCl Amb35732115 [0,0,0,1,0,0|2,0,1]=4 4244 B8R1.17 CCOC1CC1CN Amb35713826 [0,0,0,1,0,0|2,0,1]=4 4245 B8R1.17 CCOC1CC1CO Amb28048916 [0,0,0,1,0,0|1,0,2]=4 4246 B8R1.17 CC[C@@H]1C[C@H]1CC#N Amb32697068 [0,0,0,1,0,0|1,0,1]=3 4247 B8R1.17 CC[C@@H]1C[C@H]1CCN Amb32697069 [0,0,0,1,0,0|1,0,1]=3 4248 B8R1.17 CC[C@@H]1O[C@H]1CC=O Amb27224841 [0,0,0,1,0,0|1,0,0]=2 4249 B8R1.17 CC[C@@H]1O[C@H]1CCCl Amb28436373 [0,0,0,1,0,0|2,0,1]=4 4250 B8R1.17 CC[C@@H]1O[C@H]1CCN Amb27810614 [0,0,0,1,0,0|2,0,1]=4 4251 B8R1.17 CC[C@H]1O[C@@H]1CCBr Amb28247992 [0,0,0,1,0,0|2,0,1]=4 4252 B8R1.17 CC[C@H]1O[C@@H]1CCN Amb28369654 [0,0,0,1,0,0|2,0,1]=4 4253 B8R1.17 CC[C@H]1O[C@H]1CCBr Amb27640561 [0,0,0,1,0,0|2,0,1]=4 4254 B8R1.17 CC[C@H]1O[C@H]1CCCl Amb27630507 [0,0,0,1,0,0|2,0,1]=4 4255 B8R1.17 CNCC1CC1CN Amb23538703 [0,0,0,1,0,0|2,0,1]=4 4256 B8R1.17 CNCC1CC1OC Amb35683741 [0,0,0,1,0,0|3,0,0]=4 4257 B8R1.17 COC1CC1CNN Amb35717471 [0,0,0,1,0,0|3,0,0]=4 4258 B8R1.17 COC1CC1N=C=O Amb35725290 [0,0,0,1,0,0|2,0,1]=4 4259 B8R1.17 COCC1CC1CN Amb33428667 [0,0,0,1,0,0|2,0,1]=4 4260 B8R1.17 COC[C@@H]1C[C@H]1CBr Amb27454431 [0,0,0,1,0,0|2,0,1]=4 4261 B8R1.17 COC[C@@H]1C[C@H]1CN Amb33428668 [0,0,0,1,0,0|2,0,1]=4 4262 B8R1.17 COC[C@@H]1C[C@H]1CO Amb27853195 [0,0,0,1,0,0|1,0,2]=4 4263 B8R1.17 CSCC1CC1CN Amb33271715 [0,0,0,1,0,0|2,0,1]=4 4264 B8R1.17 CSC[C@@H]1C[C@H]1CN Amb33271716 [0,0,0,1,0,0|2,0,1]=4 4265 B8R1.17 C\C=C\C1CC1CO Amb28069598 [0,0,0,1,0,0|2,0,1]=4 4266 B8R1.17 C\C=C\[C@@H]1C[C@@H]1CO Amb27219006 [0,0,0,1,0,0|2,0,1]=4 4267 B8R1.17 C\C=C\[C@@H]1C[C@H]1C=O Amb28287693 [0,0,0,1,0,0|0,0,2]=3 4268 B8R1.17 NCC1CC1CCF Amb33196092 [0,0,0,1,0,0|2,0,1]=4 4269 B8R1.17 NC[C@@H]1C[C@H]1CCF Amb33196093 [0,0,0,1,0,0|2,0,1]=4 4270 B8R1.17 O=CC1CC1CCBr Amb27791880 [0,0,0,1,0,0|1,0,0]=2 4271 B8R1.17 O=CC1OC1CCBr Amb27657238 [0,0,0,1,0,0|2,0,0]=3 4272 B8R1.17 OC[C@@H]1C[C@H]1CCBr Amb28193405 [0,0,0,1,0,0|1,0,2]=4 4273 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,0,0,1,0,0|1,0,1]=3 4274 B8R1.22 BrC1CCCCCC1 Amb3940357 [0,0,0,1,0,0|1,0,1]=3 4275 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,0,1]=4 4276 B8R1.22 BrC1CCCSCC1 Amb35627432 [0,0,0,1,0,0|2,0,1]=4 4277 B8R1.22 C=C1CCCNCC1 Amb30982578 [0,0,0,1,0,0|2,0,0]=3 4278 B8R1.22 C=C1CCCSCC1 Amb35674113 [0,0,0,1,0,0|2,0,0]=3 4279 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,0,0,1,0,0|3,0,0]=4 4280 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,0,0,1,0,0|1,0,1]=3 4281 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|1,0,1]=3 4282 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|1,0,1]=3 4283 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|0,0,2]=3 4284 B8R1.22 CC1CCCCNC1 Amb22886304 [0,0,0,1,0,0|2,0,0]=3 4285 B8R1.22 CC1CCCCNC1 Amb27202179 [0,0,0,1,0,0|2,0,0]=3 4286 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,1]=4 4287 B8R1.22 CC1CCCNCC1 Amb9316855 [0,0,0,1,0,0|2,0,1]=4 4288 B8R1.22 CC1CCCOCO1 Amb28046311 [0,0,0,1,0,0|1,0,2]=4 4289 B8R1.22 CC1CCNCCN1 Amb24053173 [0,0,0,1,0,0|2,0,1]=4 4290 B8R1.22 CC1CCNCCN1 Amb8630390 [0,0,0,1,0,0|2,0,1]=4 4291 B8R1.22 CC1CCNCCO1 Amb26412871 [0,0,0,1,0,0|1,0,2]=4 4292 B8R1.22 CC1CCNCCO1 Amb30585117 [0,0,0,1,0,0|1,0,2]=4 4293 B8R1.22 CC1CCNCCS1 Amb33530238 [0,0,0,1,0,0|1,1,1]=4 4294 B8R1.22 CC1CCOCCN1 Amb25108477 [0,0,0,1,0,0|2,0,1]=4 4295 B8R1.22 CC1CCOCCN1 Amb30585116 [0,0,0,1,0,0|2,0,1]=4 4296 B8R1.22 CC1CCSCCN1 Amb28934844 [0,0,0,1,0,0|2,0,1]=4 4297 B8R1.22 CC1CCSCCN1 Amb33540166 [0,0,0,1,0,0|2,0,1]=4 4298 B8R1.22 CC1CNCCCN1 Amb33544983 [0,0,0,1,0,0|2,0,1]=4 4299 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|1,0,2]=4 4300 B8R1.22 CC1CNCCCO1 Amb9358449 [0,0,0,1,0,0|1,0,2]=4 4301 B8R1.22 CC1CNCCCS1 Amb27238313 [0,0,0,1,0,0|1,1,1]=4 4302 B8R1.22 CC1CNCCNC1 Amb10608863 [0,0,0,1,0,0|3,0,0]=4 4303 B8R1.22 CC1CNCCNC1 Amb8630420 [0,0,0,1,0,0|3,0,0]=4 4304 B8R1.22 CC1CNCCOC1 Amb22886318 [0,0,0,1,0,0|3,0,0]=4 4305 B8R1.22 CC1CNCCOC1 Amb33545514 [0,0,0,1,0,0|3,0,0]=4 4306 B8R1.22 CC1CNCCSC1 Amb22642304 [0,0,0,1,0,0|3,0,0]=4 4307 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,0,1]=4 4308 B8R1.22 CC1CSCCCN1 Amb25870575 [0,0,0,1,0,0|2,0,1]=4 4309 B8R1.22 CC1CSCCCN1 Amb30585125 [0,0,0,1,0,0|2,0,1]=4 4310 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,1,0,0|1,0,2]=4 4311 B8R1.22 CN1CCCCCC1 Amb22729377 [0,0,0,1,0,0|2,0,0]=3 4312 B8R1.22 CN1CCCNCC1 Amb22167533 [0,0,0,1,0,0|3,0,0]=4 4313 B8R1.22 CN1CCCNCC1 Amb3939085 [0,0,0,1,0,0|3,0,0]=4 4314 B8R1.22 C[C@@H]1CCCCCN1 Amb27391648 [0,0,0,1,0,0|1,0,1]=3 4315 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,0,0,1,0,0|1,0,2]=4 4316 B8R1.22 C[C@@H]1CNCCCN1 Amb35825205 [0,0,0,1,0,0|2,0,1]=4 4317 B8R1.22 C[C@@H]1COCCCN1 Amb27881643 [0,0,0,1,0,0|2,0,1]=4 4318 B8R1.22 C[C@H]1CNCCCN1 Amb26461498 [0,0,0,1,0,0|2,0,1]=4 4319 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,0,0,1,0,0|1,0,2]=4 4320 B8R1.22 ClC1CCCCNC1 Amb28048243 [0,0,0,1,0,0|2,0,1]=4 4321 B8R1.22 ClC1CCCCOC1 Amb27409037 [0,0,0,1,0,0|2,0,1]=4 4322 B8R1.22 ClC1CCCOCC1 Amb27471515 [0,0,0,1,0,0|2,0,1]=4 4323 B8R1.22 ClC1CCCSCC1 Amb35650778 [0,0,0,1,0,0|2,0,1]=4 4324 B8R1.22 ClN1CCCOCC1 Amb27217968 [0,0,0,1,0,0|3,0,0]=4 4325 B8R1.22 FC1CCCCCC1 Amb28049012 [0,0,0,1,0,0|1,0,1]=3 4326 B8R1.22 FC1CCCCNC1 Amb13953139 [0,0,0,1,0,0|2,0,1]=4 4327 B8R1.22 FC1CCCCNC1 Amb22886275 [0,0,0,1,0,0|2,0,1]=4 4328 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|2,0,1]=4 4329 B8R1.22 FC1CCCNCC1 Amb27453588 [0,0,0,1,0,0|2,0,1]=4 4330 B8R1.22 IC1CCCOCC1 Amb26563301 [0,0,0,1,0,0|2,0,1]=4 4331 B8R1.22 NC1=NCCCCC1 Amb19514661 [0,0,0,1,0,0|2,0,0]=3 4332 B8R1.22 NC1=NCCCCC1 Amb4451463 [0,0,0,1,0,0|2,0,0]=3 4333 B8R1.22 NC1=NCCCCN1 Amb28119984 [0,0,0,1,0,0|3,0,0]=4 4334 B8R1.22 NC1=NCCCCS1 Amb27592425 [0,0,0,1,0,0|3,0,0]=4 4335 B8R1.22 NC1=NCCCSC1 Amb25688170 [0,0,0,1,0,0|3,0,0]=4 4336 B8R1.22 NC1C=CCCCC1 Amb24377373 [0,0,0,1,0,0|2,0,0]=3 4337 B8R1.22 NC1CC=CCCC1 Amb27408037 [0,0,0,1,0,0|2,0,1]=4 4338 B8R1.22 NC1CCCCCC1 Amb2720336 [0,0,0,1,0,0|1,0,1]=3 4339 B8R1.22 NC1CCCCNC1 Amb2684433 [0,0,0,1,0,0|2,0,1]=4 4340 B8R1.22 NC1CCCCNC1 Amb8631384 [0,0,0,1,0,0|2,0,1]=4 4341 B8R1.22 NC1CCCNCC1 Amb4296999 [0,0,0,1,0,0|2,0,1]=4 4342 B8R1.22 NC1CCCOCC1 Amb33547346 [0,0,0,1,0,0|2,0,1]=4 4343 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,0,1]=4 4344 B8R1.22 NC1CCCSCC1 Amb33328660 [0,0,0,1,0,0|2,0,1]=4 4345 B8R1.22 NN1CCCCCC1 Amb836794 [0,0,0,1,0,0|2,0,0]=3 4346 B8R1.22 N[C@@H]1CCCCNC1 Amb16185497 [0,0,0,1,0,0|2,0,1]=4 4347 B8R1.22 N[C@H]1CCCCNC1 Amb22744950 [0,0,0,1,0,0|2,0,1]=4 4348 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,0,0,1,0,0|0,0,2]=3 4349 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,1,0,0|1,0,2]=4 4350 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,0,0,1,0,0|0,0,2]=3 4351 B8R1.22 O=C1CC=CCCN1 Amb27830230 [0,0,0,1,0,0|1,0,2]=4 4352 B8R1.22 O=C1CC=COCC1 Amb27835241 [0,0,0,1,0,0|1,0,2]=4 4353 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,1,0,0|0,0,2]=3 4354 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,0,0,1,0,0|1,0,2]=4 4355 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,0,0,1,0,0|0,0,0]=1 4356 B8R1.22 O=C1CCCCCN1 Amb6364991 [0,0,0,1,0,0|1,0,0]=2 4357 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,0,0,1,0,0|1,0,0]=2 4358 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,0,0,1,0,0|1,0,0]=2 4359 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,0,0,1,0,0|1,0,0]=2 4360 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,0,0,1,0,0|1,0,0]=2 4361 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,0,0,1,0,0|1,0,0]=2 4362 B8R1.22 O=C1CCCNCC1 Amb8393630 [0,0,0,1,0,0|1,0,0]=2 4363 B8R1.22 O=C1CCCNCC1 Amb9174228 [0,0,0,1,0,0|1,0,0]=2 4364 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,0,0,1,0,0|1,0,0]=2 4365 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,1,0,0|1,0,0]=2 4366 B8R1.22 O=C1CCCSCN1 Amb27879423 [0,0,0,1,0,0|2,0,0]=3 4367 B8R1.22 O=C1CCNCCN1 Amb10069937 [0,0,0,1,0,0|2,0,0]=3 4368 B8R1.22 O=C1CCNCCN1 Amb1107713 [0,0,0,1,0,0|2,0,0]=3 4369 B8R1.22 O=C1CCNCCN1 Amb483265 [0,0,0,1,0,0|2,0,0]=3 4370 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,0,0,1,0,0|2,0,0]=3 4371 B8R1.22 O=C1CCNNCC1 Amb28421828 [0,0,0,1,0,0|2,0,0]=3 4372 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,0,0,1,0,0|2,0,0]=3 4373 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,0,0,1,0,0|2,0,0]=3 4374 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,0,0,1,0,0|2,0,0]=3 4375 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,0,0,1,0,0|2,0,0]=3 4376 B8R1.22 O=C1CNCCCN1 Amb6739889 [0,0,0,1,0,0|2,0,0]=3 4377 B8R1.22 O=C1CNCCNC1 Amb30867934 [0,0,0,1,0,0|2,0,0]=3 4378 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,1,0,0|2,0,0]=3 4379 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,1,0,0|2,0,0]=3 4380 B8R1.22 O=C1CSCCSC1 Amb8503291 [0,0,0,1,0,0|2,0,0]=3 4381 B8R1.22 O=C1NCCCCN1 Amb25960043 [0,0,0,1,0,0|2,0,0]=3 4382 B8R1.22 O=C1NCCCCO1 Amb27405440 [0,0,0,1,0,0|2,0,0]=3 4383 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,0,0,1,0,0|2,0,0]=3 4384 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,0,0,1,0,0|2,0,0]=3 4385 B8R1.22 O=S1OCCCCO1 Amb9787325 [0,0,0,1,0,0|3,0,0]=4 4386 B8R1.22 OC1C=CCCCC1 Amb26034783 [0,0,0,1,0,0|2,0,0]=3 4387 B8R1.22 OC1CCCCCC1 Amb3940358 [0,0,0,1,0,0|0,0,2]=3 4388 B8R1.22 OC1CCCCCO1 Amb4034492 [0,0,0,1,0,0|1,0,2]=4 4389 B8R1.22 OC1CCCCCS1 Amb17615898 [0,0,0,1,0,0|1,0,2]=4 4390 B8R1.22 OC1CCCCNC1 Amb22371121 [0,0,0,1,0,0|1,0,2]=4 4391 B8R1.22 OC1CCCCNC1 Amb22886250 [0,0,0,1,0,0|1,0,2]=4 4392 B8R1.22 OC1CCCCOC1 Amb27424901 [0,0,0,1,0,0|1,0,2]=4 4393 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|1,0,2]=4 4394 B8R1.22 OC1CCCNCC1 Amb2695607 [0,0,0,1,0,0|1,0,2]=4 4395 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|1,0,2]=4 4396 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|1,0,2]=4 4397 B8R1.22 O[C@@H]1C=CCCCC1 Amb28205998 [0,0,0,1,0,0|2,0,0]=3 4398 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,0,0,1,0,0|1,0,2]=4 4399 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,0,0,1,0,0|1,0,2]=4 4400 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,0,0,1,0,0|1,1,0]=3 4401 B8R1.22 S=C1NCCCCN1 Amb2724259 [0,0,0,1,0,0|2,1,0]=4 4402 B8R1.22 SC1CCCCCC1 Amb9208052 [0,0,0,1,0,0|0,1,1]=3 4403 B8R1.22 SC1CCCNCC1 Amb32788297 [0,0,0,1,0,0|1,1,1]=4 4404 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|1,1,1]=4 4405 B8R1.22 SC1CCCSCC1 Amb32788173 [0,0,0,1,0,0|1,1,1]=4 4406 B8R1.36 BrCCCCC1CC1 Amb27220703 [0,0,0,1,0,0|1,0,1]=3 4407 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,0,0,1,0,0|1,0,2]=4 4408 B8R1.36 BrCCOCC1CC1 Amb6681170 [0,0,0,1,0,0|2,0,1]=4 4409 B8R1.36 C#CCCCC1CC1 Amb33361008 [0,0,0,1,0,0|1,0,1]=3 4410 B8R1.36 C#CCCNC1CC1 Amb18299436 [0,0,0,1,0,0|2,0,1]=4 4411 B8R1.36 C#CCCNC1CC1 Amb31217476 [0,0,0,1,0,0|2,0,1]=4 4412 B8R1.36 C#CCNCC1CC1 Amb33550303 [0,0,0,1,0,0|2,0,1]=4 4413 B8R1.36 C#CCNCC1CC1 Amb9423017 [0,0,0,1,0,0|2,0,1]=4 4414 B8R1.36 C#CCOCC1CC1 Amb23598933 [0,0,0,1,0,0|2,0,1]=4 4415 B8R1.36 C#CCSCC1CC1 Amb28188282 [0,0,0,1,0,0|2,0,1]=4 4416 B8R1.36 C=CCCNC1CC1 Amb19025218 [0,0,0,1,0,0|2,0,0]=3 4417 B8R1.36 C=CCCOC1CC1 Amb27395678 [0,0,0,1,0,0|2,0,0]=3 4418 B8R1.36 C=CCNCC1CC1 Amb9423018 [0,0,0,1,0,0|2,0,0]=3 4419 B8R1.36 C=CCOCC1CC1 Amb25303107 [0,0,0,1,0,0|2,0,0]=3 4420 B8R1.36 C=CCSCC1CO1 Amb28185423 [0,0,0,1,0,0|3,0,0]=4 4421 B8R1.36 CCCCCC1CC1 Amb27203905 [0,0,0,1,0,0|1,0,1]=3 4422 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|0,0,2]=3 4423 B8R1.36 CCCCC[C@@H]1CO1 Amb27862379 [0,0,0,1,0,0|0,0,2]=3 4424 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,1]=4 4425 B8R1.36 CCCCNC1CC1 Amb6892806 [0,0,0,1,0,0|2,0,1]=4 4426 B8R1.36 CCCNCC1CC1 Amb3939845 [0,0,0,1,0,0|2,0,1]=4 4427 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|2,0,1]=4 4428 B8R1.36 CCOCCC1CO1 Amb25679046 [0,0,0,1,0,0|1,0,2]=4 4429 B8R1.36 CCSCCC1CO1 Amb26575735 [0,0,0,1,0,0|1,0,2]=4 4430 B8R1.36 CNCCCC1CC1 Amb26658568 [0,0,0,1,0,0|2,0,0]=3 4431 B8R1.36 CNCCNC1CC1 Amb2691995 [0,0,0,1,0,0|3,0,0]=4 4432 B8R1.36 CNCCOC1CC1 Amb25831972 [0,0,0,1,0,0|3,0,0]=4 4433 B8R1.36 COCCCC1CO1 Amb24676522 [0,0,0,1,0,0|1,0,2]=4 4434 B8R1.36 COCCNC1CC1 Amb24271078 [0,0,0,1,0,0|3,0,0]=4 4435 B8R1.36 COCCNC1CC1 Amb6247358 [0,0,0,1,0,0|3,0,0]=4 4436 B8R1.36 COCOCC1CC1 Amb27972311 [0,0,0,1,0,0|3,0,0]=4 4437 B8R1.36 CSCCCC1CO1 Amb24687956 [0,0,0,1,0,0|1,0,2]=4 4438 B8R1.36 C\C=C\CCC1CO1 Amb27662671 [0,0,0,1,0,0|2,0,1]=4 4439 B8R1.36 C\C=C\CC[C@H]1CO1 Amb27852839 [0,0,0,1,0,0|2,0,1]=4 4440 B8R1.36 C\C=C\CNC1CC1 Amb26587122 [0,0,0,1,0,0|2,0,1]=4 4441 B8R1.36 ClCCCCC1CC1 Amb27422896 [0,0,0,1,0,0|1,0,1]=3 4442 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,0,0,1,0,0|1,0,2]=4 4443 B8R1.36 ClCCOCC1CC1 Amb8828487 [0,0,0,1,0,0|2,0,1]=4 4444 B8R1.36 FCCNCC1CC1 Amb27829483 [0,0,0,1,0,0|2,0,1]=4 4445 B8R1.36 ICCNCC1CC1 Amb27801832 [0,0,0,1,0,0|2,0,1]=4 4446 B8R1.36 N#CCCCC1CC1 Amb33362400 [0,0,0,1,0,0|1,0,1]=3 4447 B8R1.36 N#CCCNC1CC1 Amb2686659 [0,0,0,1,0,0|2,0,1]=4 4448 B8R1.36 N#CCNCC1CC1 Amb6707442 [0,0,0,1,0,0|2,0,1]=4 4449 B8R1.36 N#CCOCC1CC1 Amb6681183 [0,0,0,1,0,0|2,0,1]=4 4450 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|1,0,1]=3 4451 B8R1.36 NCCCNC1CC1 Amb17315307 [0,0,0,1,0,0|2,0,1]=4 4452 B8R1.36 NCCCOC1CC1 Amb28436320 [0,0,0,1,0,0|2,0,1]=4 4453 B8R1.36 NCCNCC1CC1 Amb18523825 [0,0,0,1,0,0|2,0,1]=4 4454 B8R1.36 NCCNCC1CC1 Amb30585085 [0,0,0,1,0,0|2,0,1]=4 4455 B8R1.36 NCCOCC1CC1 Amb33545837 [0,0,0,1,0,0|2,0,1]=4 4456 B8R1.36 NCCOCC1CC1 Amb6681126 [0,0,0,1,0,0|2,0,1]=4 4457 B8R1.36 NCCSCC1CC1 Amb6760936 [0,0,0,1,0,0|2,0,1]=4 4458 B8R1.36 NNCCCC1CC1 Amb28316216 [0,0,0,1,0,0|2,0,0]=3 4459 B8R1.36 NOCCCC1CC1 Amb33362397 [0,0,0,1,0,0|2,0,0]=3 4460 B8R1.36 O=C=NCCC1CC1 Amb27204966 [0,0,0,1,0,0|1,0,1]=3 4461 B8R1.36 O=CCCCC1CC1 Amb27948530 [0,0,0,1,0,0|0,0,0]=1 4462 B8R1.36 O=CCCCC1CO1 Amb27643593 [0,0,0,1,0,0|1,0,0]=2 4463 B8R1.36 O=CCCC[C@H]1CO1 Amb28134306 [0,0,0,1,0,0|1,0,0]=2 4464 B8R1.36 O=CCOCC1CC1 Amb28401147 [0,0,0,1,0,0|1,0,0]=2 4465 B8R1.36 O=CNCCC1CC1 Amb27951184 [0,0,0,1,0,0|1,0,0]=2 4466 B8R1.36 O=CNOCC1CC1 Amb35636971 [0,0,0,1,0,0|2,0,0]=3 4467 B8R1.36 O=C\C=C\CC1CC1 Amb33474661 [0,0,0,1,0,0|0,0,2]=3 4468 B8R1.36 OCCCCC1CC1 Amb26059385 [0,0,0,1,0,0|0,0,2]=3 4469 B8R1.36 OCCCCC1CO1 Amb28410478 [0,0,0,1,0,0|1,0,2]=4 4470 B8R1.36 OCCCC[C@H]1CO1 Amb28206206 [0,0,0,1,0,0|1,0,2]=4 4471 B8R1.36 OCCCNC1CC1 Amb17317872 [0,0,0,1,0,0|1,0,2]=4 4472 B8R1.36 OCCCOC1CC1 Amb27260208 [0,0,0,1,0,0|1,0,2]=4 4473 B8R1.36 OCCCSC1CC1 Amb28284998 [0,0,0,1,0,0|1,0,2]=4 4474 B8R1.36 OCCNCC1CC1 Amb30640115 [0,0,0,1,0,0|1,0,2]=4 4475 B8R1.36 OCCNCC1CC1 Amb6707494 [0,0,0,1,0,0|1,0,2]=4 4476 B8R1.36 OCCOCC1CC1 Amb24729221 [0,0,0,1,0,0|1,0,2]=4 4477 B8R1.36 OCCSCC1CC1 Amb9423411 [0,0,0,1,0,0|1,0,2]=4 4478 B8R1.36 ONCCCC1CC1 Amb27427292 [0,0,0,1,0,0|1,0,1]=3 4479 B8R1.36 SCCCCC1CC1 Amb32788277 [0,0,0,1,0,0|0,1,1]=3 4480 B8R1.36 [C-]#[N+]CCCC1CC1 Amb33361456 [0,0,0,1,0,0|2,0,0]=3 4481 B8R1.36 [N-]=[N+]=NCCC1CC1 Amb25720625 [0,0,0,1,0,0|3,0,0]=4 4482 B8R1.49 C1=CCCC=CCC1 Amb20240928 [0,0,0,1,0,0|1,0,2]=4 4483 B8R1.49 C1=CCCC=CCC1 Amb21858295 [0,0,0,1,0,0|1,0,2]=4 4484 B8R1.49 C1=CCCC=CCC1 Amb21962105 [0,0,0,1,0,0|1,0,2]=4 4485 B8R1.49 C1=CCCC=CCC1 Amb22001947 [0,0,0,1,0,0|1,0,2]=4 4486 B8R1.49 C1=CCCC=CCC1 Amb22729533 [0,0,0,1,0,0|1,0,2]=4 4487 B8R1.49 C1=CCCC=CCC1 Amb32414658 [0,0,0,1,0,0|1,0,2]=4 4488 B8R1.49 C1=CCCC=CCC1 Amb34910796 [0,0,0,1,0,0|1,0,2]=4 4489 B8R1.49 C1=CCCC=CCC1 Amb35796422 [0,0,0,1,0,0|1,0,2]=4 4490 B8R1.49 C1=CCCC=CCC1 Amb35825507 [0,0,0,1,0,0|1,0,2]=4 4491 B8R1.49 C1=CCCC=CCC1 Amb8389257 [0,0,0,1,0,0|1,0,2]=4 4492 B8R1.49 C1=CCCC=CCC1 Amb8389289 [0,0,0,1,0,0|1,0,2]=4 4493 B8R1.49 C1=CCCC=CCC1 Amb8514435 [0,0,0,1,0,0|1,0,2]=4 4494 B8R1.49 C1=CCCC=CCC1 Amb8515194 [0,0,0,1,0,0|1,0,2]=4 4495 B8R1.49 C1=CCCC=CCC1 Amb8517196 [0,0,0,1,0,0|1,0,2]=4 4496 B8R1.49 C1=CCCC=CCC1 Amb8517269 [0,0,0,1,0,0|1,0,2]=4 4497 B8R1.49 C1=CCCCC=CC1 Amb27858879 [0,0,0,1,0,0|1,0,2]=4 4498 B8R1.49 C1=CCCCCC=C1 Amb4034451 [0,0,0,1,0,0|1,0,2]=4 4499 B8R1.49 C1=CCCCCCC1 Amb8513502 [0,0,0,1,0,0|1,0,0]=2 4500 B8R1.49 C1=CCCNCCC1 Amb28346195 [0,0,0,1,0,0|2,0,0]=3 4501 B8R1.49 C1=CCNCCCC1 Amb33038369 [0,0,0,1,0,0|2,0,0]=3 4502 B8R1.49 C1=CCNCCCC1 Amb33038370 [0,0,0,1,0,0|2,0,0]=3 4503 B8R1.49 C1CCCNCCC1 Amb3997183 [0,0,0,1,0,0|1,0,1]=3 4504 B8R1.49 C1CCNCCNC1 Amb24428659 [0,0,0,1,0,0|2,0,1]=4 4505 B8R1.49 C1CNCCCNC1 Amb6740292 [0,0,0,1,0,0|2,0,1]=4 4506 B8R1.49 C1CNCCCOC1 Amb26627441 [0,0,0,1,0,0|1,0,2]=4 4507 B5R0.2 BrCCCCBr Amb2686718 [2,0,0,0,0,0|2,0,0]=4 4508 B5R0.2 BrCCCCI Amb25861429 [2,0,0,0,0,0|2,0,0]=4 4509 B5R0.2 C#CCCC=O Amb28049678 [2,0,0,0,0,0|0,0,2]=4 4510 B5R0.2 C#CCCCC Amb4135448 [2,0,0,0,0,0|0,0,2]=4 4511 B5R0.2 C#NCCCC Amb31132446 [2,0,0,0,0,0|1,0,1]=4 4512 B5R0.2 C=CCCC=O Amb4358616 [2,0,0,0,0,0|0,0,2]=4 4513 B5R0.2 C=CCCCBr Amb3940219 [2,0,0,0,0,0|1,0,1]=4 4514 B5R0.2 C=CCCCC Amb3940497 [2,0,0,0,0,0|0,0,1]=3 4515 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|1,0,1]=4 4516 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|1,0,1]=4 4517 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|1,0,1]=4 4518 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|1,0,1]=4 4519 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|1,0,1]=4 4520 B5R0.2 C=CCCCO Amb8513439 [2,0,0,0,0,0|1,0,1]=4 4521 B5R0.2 C=CCCC[CH2-] Amb32644015 [2,0,0,0,0,0|0,0,2]=4 4522 B5R0.2 C=CCCNC Amb18993048 [2,0,0,0,0,0|1,0,1]=4 4523 B5R0.2 C=CCCNC Amb33553635 [2,0,0,0,0,0|1,0,1]=4 4524 B5R0.2 C=CCCOC Amb28065418 [2,0,0,0,0,0|1,0,1]=4 4525 B5R0.2 C=CCCSC Amb24431590 [2,0,0,0,0,0|1,0,1]=4 4526 B5R0.2 C=CCNCC Amb13951161 [2,0,0,0,0,0|1,0,1]=4 4527 B5R0.2 C=CCNCC Amb6683951 [2,0,0,0,0,0|1,0,1]=4 4528 B5R0.2 C=CCOCC Amb2684299 [2,0,0,0,0,0|1,0,1]=4 4529 B5R0.2 C=CCSCC Amb6366495 [2,0,0,0,0,0|1,0,1]=4 4530 B5R0.2 C=CNCCC Amb27461242 [2,0,0,0,0,0|1,0,1]=4 4531 B5R0.2 C=COCCC Amb17940706 [2,0,0,0,0,0|1,0,1]=4 4532 B5R0.2 C=NCCCCl Amb28346586 [2,0,0,0,0,0|2,0,0]=4 4533 B5R0.2 CC#CCC=O Amb27850282 [2,0,0,0,0,0|0,0,2]=4 4534 B5R0.2 CC#CCCC Amb8515369 [2,0,0,0,0,0|0,0,2]=4 4535 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 4536 B5R0.2 CCC#CCC Amb8515372 [2,0,0,0,0,0|0,0,2]=4 4537 B5R0.2 CCCCC#N Amb6662839 [2,0,0,0,0,0|1,0,1]=4 4538 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,0]=2 4539 B5R0.2 CCCCCBr Amb3940084 [2,0,0,0,0,0|1,0,0]=3 4540 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,0]=2 4541 B5R0.2 CCCCCCl Amb8514576 [2,0,0,0,0,0|1,0,0]=3 4542 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 4543 B5R0.2 CCCCCI Amb6891946 [2,0,0,0,0,0|1,0,0]=3 4544 B5R0.2 CCCCCN Amb3939830 [2,0,0,0,0,0|1,0,0]=3 4545 B5R0.2 CCCCCO Amb3939051 [2,0,0,0,0,0|0,0,1]=3 4546 B5R0.2 CCCCCS Amb8513287 [2,0,0,0,0,0|0,1,0]=3 4547 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|0,1,0]=3 4548 B5R0.2 CCCCNC Amb3939351 [2,0,0,0,0,0|1,0,0]=3 4549 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 4550 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 4551 B5R0.2 CCCCNN Amb33055062 [2,0,0,0,0,0|2,0,0]=4 4552 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,1]=4 4553 B5R0.2 CCCCNO Amb32687485 [2,0,0,0,0,0|1,0,1]=4 4554 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 4555 B5R0.2 CCCCON Amb6308542 [2,0,0,0,0,0|2,0,0]=4 4556 B5R0.2 CCCCSC Amb4036342 [2,0,0,0,0,0|1,0,0]=3 4557 B5R0.2 CCCN=C=O Amb3939331 [2,0,0,0,0,0|1,0,1]=4 4558 B5R0.2 CCCNC=S Amb27754027 [2,0,0,0,0,0|1,1,0]=4 4559 B5R0.2 CCCNCC Amb3939843 [2,0,0,0,0,0|1,0,0]=3 4560 B5R0.2 CCCNNC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 4561 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|2,0,0]=4 4562 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|1,0,0]=3 4563 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|2,0,0]=4 4564 B5R0.2 CCCSCC Amb22168047 [2,0,0,0,0,0|1,0,0]=3 4565 B5R0.2 CCCSCCl Amb28146719 [2,0,0,0,0,0|2,0,0]=4 4566 B5R0.2 CCC\C=C\Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 4567 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 4568 B5R0.2 CCC\C=C\N Amb27217273 [2,0,0,0,0,0|1,0,1]=4 4569 B5R0.2 CCNCCBr Amb27950012 [2,0,0,0,0,0|2,0,0]=4 4570 B5R0.2 CCNCCCl Amb17334050 [2,0,0,0,0,0|2,0,0]=4 4571 B5R0.2 CCNCCCl Amb33869917 [2,0,0,0,0,0|2,0,0]=4 4572 B5R0.2 CCNCCF Amb27858242 [2,0,0,0,0,0|2,0,0]=4 4573 B5R0.2 CCNCCI Amb27856942 [2,0,0,0,0,0|2,0,0]=4 4574 B5R0.2 CCNCCN Amb6297789 [2,0,0,0,0,0|2,0,0]=4 4575 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,1]=4 4576 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|1,0,1]=4 4577 B5R0.2 CCNCCP Amb27188285 [2,0,0,0,0,0|2,0,0]=4 4578 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 4579 B5R0.2 CCNOCC Amb26852166 [2,0,0,0,0,0|2,0,0]=4 4580 B5R0.2 CCNOCC Amb32655926 [2,0,0,0,0,0|2,0,0]=4 4581 B5R0.2 CCOCCBr Amb1158671 [2,0,0,0,0,0|2,0,0]=4 4582 B5R0.2 CCOCCCl Amb8390350 [2,0,0,0,0,0|2,0,0]=4 4583 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|2,0,0]=4 4584 B5R0.2 CCOCCN Amb1130918 [2,0,0,0,0,0|2,0,0]=4 4585 B5R0.2 CCOCCN Amb29844456 [2,0,0,0,0,0|2,0,0]=4 4586 B5R0.2 CCOCCO Amb3939142 [2,0,0,0,0,0|1,0,1]=4 4587 B5R0.2 CCOCCS Amb9316644 [2,0,0,0,0,0|1,1,0]=4 4588 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,0]=3 4589 B5R0.2 CCSCCBr Amb2685158 [2,0,0,0,0,0|2,0,0]=4 4590 B5R0.2 CCSCCCl Amb3940261 [2,0,0,0,0,0|2,0,0]=4 4591 B5R0.2 CCSCCN Amb2687948 [2,0,0,0,0,0|2,0,0]=4 4592 B5R0.2 CCSCCN Amb9825826 [2,0,0,0,0,0|2,0,0]=4 4593 B5R0.2 CCSCCO Amb1085958 [2,0,0,0,0,0|1,0,1]=4 4594 B5R0.2 CCSCCS Amb27167723 [2,0,0,0,0,0|1,1,0]=4 4595 B5R0.2 CCSSCC Amb8516624 [2,0,0,0,0,0|2,0,0]=4 4596 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|2,0,0]=4 4597 B5R0.2 CC\C=C/CC Amb8517211 [2,0,0,0,0,0|0,0,2]=4 4598 B5R0.2 CC\C=C\C=O Amb33986391 [2,0,0,0,0,0|0,0,2]=4 4599 B5R0.2 CC\C=C\CC Amb4016243 [2,0,0,0,0,0|0,0,2]=4 4600 B5R0.2 CC\N=N/CC Amb27851864 [2,0,0,0,0,0|2,0,0]=4 4601 B5R0.2 CC\N=N\CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 4602 B5R0.2 CNCCCBr Amb28291325 [2,0,0,0,0,0|2,0,0]=4 4603 B5R0.2 CNCCCBr Amb33473632 [2,0,0,0,0,0|2,0,0]=4 4604 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 4605 B5R0.2 CNCCCCl Amb3941419 [2,0,0,0,0,0|2,0,0]=4 4606 B5R0.2 CNCCCF Amb27405698 [2,0,0,0,0,0|2,0,0]=4 4607 B5R0.2 CNCCCN Amb2698065 [2,0,0,0,0,0|2,0,0]=4 4608 B5R0.2 CNCCCO Amb9246656 [2,0,0,0,0,0|1,0,1]=4 4609 B5R0.2 CNCCNC Amb4037059 [2,0,0,0,0,0|2,0,0]=4 4610 B5R0.2 CNCCOC Amb10609606 [2,0,0,0,0,0|2,0,0]=4 4611 B5R0.2 CNCCOC Amb2689126 [2,0,0,0,0,0|2,0,0]=4 4612 B5R0.2 CNCCSC Amb15701319 [2,0,0,0,0,0|2,0,0]=4 4613 B5R0.2 CNCCSC Amb20625111 [2,0,0,0,0,0|2,0,0]=4 4614 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,0]=3 4615 B5R0.2 COCCCBr Amb8828205 [2,0,0,0,0,0|2,0,0]=4 4616 B5R0.2 COCCCCl Amb6255994 [2,0,0,0,0,0|2,0,0]=4 4617 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|2,0,0]=4 4618 B5R0.2 COCCCI Amb33546474 [2,0,0,0,0,0|2,0,0]=4 4619 B5R0.2 COCCCN Amb3939346 [2,0,0,0,0,0|2,0,0]=4 4620 B5R0.2 COCCCO Amb8385593 [2,0,0,0,0,0|1,0,1]=4 4621 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|1,1,0]=4 4622 B5R0.2 COCCOC Amb6741456 [2,0,0,0,0,0|2,0,0]=4 4623 B5R0.2 COCCSC Amb4020919 [2,0,0,0,0,0|2,0,0]=4 4624 B5R0.2 COCNC=O Amb28049834 [2,0,0,0,0,0|2,0,0]=4 4625 B5R0.2 CSCCC=O Amb3939952 [2,0,0,0,0,0|1,0,0]=3 4626 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|2,0,0]=4 4627 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|2,0,0]=4 4628 B5R0.2 CSCCCN Amb33801570 [2,0,0,0,0,0|2,0,0]=4 4629 B5R0.2 CSCCCN Amb6718923 [2,0,0,0,0,0|2,0,0]=4 4630 B5R0.2 CSCCCO Amb3939523 [2,0,0,0,0,0|1,0,1]=4 4631 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|1,1,0]=4 4632 B5R0.2 CSCCSC Amb25101746 [2,0,0,0,0,0|2,0,0]=4 4633 B5R0.2 C[SiH2]CCCN Amb28049027 [2,0,0,0,0,0|1,1,0]=4 4634 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|0,0,2]=4 4635 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|0,0,2]=4 4636 B5R0.2 C\C=N\CCC Amb27954749 [2,0,0,0,0,0|1,0,1]=4 4637 B5R0.2 ClCCCCBr Amb8391065 [2,0,0,0,0,0|2,0,0]=4 4638 B5R0.2 ClCCCCCl Amb6608890 [2,0,0,0,0,0|2,0,0]=4 4639 B5R0.2 ClCCCCI Amb8517518 [2,0,0,0,0,0|2,0,0]=4 4640 B5R0.2 FCCCCBr Amb2685210 [2,0,0,0,0,0|2,0,0]=4 4641 B5R0.2 FCCCCCl Amb27655616 [2,0,0,0,0,0|2,0,0]=4 4642 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 4643 B5R0.2 FCCCCI Amb28283837 [2,0,0,0,0,0|2,0,0]=4 4644 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|1,1,0]=4 4645 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 4646 B5R0.2 N#CCCC=O Amb3941009 [2,0,0,0,0,0|1,0,1]=4 4647 B5R0.2 NCCCC=O Amb26851044 [2,0,0,0,0,0|1,0,0]=3 4648 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 4649 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 4650 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 4651 B5R0.2 NCCCCF Amb26017241 [2,0,0,0,0,0|2,0,0]=4 4652 B5R0.2 NCCCCF Amb28555328 [2,0,0,0,0,0|2,0,0]=4 4653 B5R0.2 NCCCCI Amb27837961 [2,0,0,0,0,0|2,0,0]=4 4654 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 4655 B5R0.2 NCCCCN Amb6608640 [2,0,0,0,0,0|2,0,0]=4 4656 B5R0.2 NCCCCN Amb8514498 [2,0,0,0,0,0|2,0,0]=4 4657 B5R0.2 NCCCCO Amb3939336 [2,0,0,0,0,0|1,0,1]=4 4658 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|1,1,0]=4 4659 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|1,1,0]=4 4660 B5R0.2 NCCCN=O Amb28049442 [2,0,0,0,0,0|2,0,0]=4 4661 B5R0.2 NCCOC=O Amb24612320 [2,0,0,0,0,0|2,0,0]=4 4662 B5R0.2 O=CCCC=O Amb8395090 [2,0,0,0,0,0|1,0,1]=4 4663 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|1,0,0]=3 4664 B5R0.2 O=CCCCCl Amb8395190 [2,0,0,0,0,0|1,0,0]=3 4665 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|1,0,0]=3 4666 B5R0.2 O=CCCCI Amb27249641 [2,0,0,0,0,0|1,0,0]=3 4667 B5R0.2 O=CCCCO Amb24589235 [2,0,0,0,0,0|1,0,0]=3 4668 B5R0.2 O=CCCSS Amb22524519 [2,0,0,0,0,0|2,0,0]=4 4669 B5R0.2 O=CNCCF Amb28205988 [2,0,0,0,0,0|2,0,0]=4 4670 B5R0.2 O=COCCBr Amb27816149 [2,0,0,0,0,0|2,0,0]=4 4671 B5R0.2 O=COCCO Amb26625741 [2,0,0,0,0,0|2,0,0]=4 4672 B5R0.2 OCCCCBr Amb8395353 [2,0,0,0,0,0|1,0,1]=4 4673 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,1]=4 4674 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,1]=4 4675 B5R0.2 OCCCCO Amb2793029 [2,0,0,0,0,0|1,0,1]=4 4676 B5R0.2 SCCCCS Amb8513069 [2,0,0,0,0,0|1,1,0]=4 4677 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|1,0,1]=4 4678 B7R0.3 C#CC(Br)CCCC Amb27483407 [1,1,0,0,0,0|0,0,2]=4 4679 B7R0.3 C#CC(C)CCCC Amb33169085 [1,1,0,0,0,0|0,0,2]=4 4680 B7R0.3 C#CC(N)CCCC Amb25798992 [1,1,0,0,0,0|0,0,2]=4 4681 B7R0.3 C#CCCC(C)C=O Amb28054858 [1,1,0,0,0,0|0,0,2]=4 4682 B7R0.3 C#CCCC(C)CC Amb33318457 [1,1,0,0,0,0|0,0,2]=4 4683 B7R0.3 C#CCCC(Cl)CC Amb28138763 [1,1,0,0,0,0|0,0,2]=4 4684 B7R0.3 C#CCCC(O)C=O Amb28246623 [1,1,0,0,0,0|0,0,2]=4 4685 B7R0.3 C#CCCC(O)CC Amb20669410 [1,1,0,0,0,0|0,0,2]=4 4686 B7R0.3 C#C[C@H](N)CCCC Amb27797061 [1,1,0,0,0,0|0,0,2]=4 4687 B7R0.3 C=C(C=O)CCCC Amb4025817 [1,1,0,0,0,0|0,0,1]=3 4688 B7R0.3 C=C(C=O)CCCO Amb28128165 [1,1,0,0,0,0|1,0,1]=4 4689 B7R0.3 C=C(C=O)CCOC Amb27948778 [1,1,0,0,0,0|1,0,1]=4 4690 B7R0.3 C=C(CBr)CCCC Amb25249105 [1,1,0,0,0,0|1,0,1]=4 4691 B7R0.3 C=C(CC)CCC=O Amb27233336 [1,1,0,0,0,0|0,0,1]=3 4692 B7R0.3 C=C(CC)CCCBr Amb27491082 [1,1,0,0,0,0|1,0,1]=4 4693 B7R0.3 C=C(CC)CCCC Amb9787281 [1,1,0,0,0,0|0,0,2]=4 4694 B7R0.3 C=C(CC)CCCCl Amb28397002 [1,1,0,0,0,0|1,0,1]=4 4695 B7R0.3 C=C(CC)CCCN Amb27631266 [1,1,0,0,0,0|1,0,1]=4 4696 B7R0.3 C=C(CC)CCCO Amb26032857 [1,1,0,0,0,0|0,0,2]=4 4697 B7R0.3 C=C(CCl)CCCC Amb25889368 [1,1,0,0,0,0|1,0,1]=4 4698 B7R0.3 C=C(CN)CCCC Amb27630595 [1,1,0,0,0,0|1,0,1]=4 4699 B7R0.3 C=C=CCC(O)CC Amb27766614 [1,1,0,0,0,0|0,0,2]=4 4700 B7R0.3 C=CC(=O)CCCC Amb25062494 [1,1,0,0,0,0|0,0,2]=4 4701 B7R0.3 C=CC(Br)CCCC Amb25758328 [1,1,0,0,0,0|0,0,1]=3 4702 B7R0.3 C=CC(C)CCCC Amb22641469 [1,1,0,0,0,0|0,0,1]=3 4703 B7R0.3 C=CC(C)CCCCl Amb27412986 [1,1,0,0,0,0|1,0,1]=4 4704 B7R0.3 C=CC(C)CCCO Amb22641468 [1,1,0,0,0,0|1,0,1]=4 4705 B7R0.3 C=CC(Cl)CCOC Amb25989152 [1,1,0,0,0,0|1,0,1]=4 4706 B7R0.3 C=CC(N)CCC=O Amb33036368 [1,1,0,0,0,0|0,0,2]=4 4707 B7R0.3 C=CC(N)CCSC Amb28316202 [1,1,0,0,0,0|1,0,1]=4 4708 B7R0.3 C=CC(N)COCC Amb27248147 [1,1,0,0,0,0|1,0,1]=4 4709 B7R0.3 C=CC(N)CSCC Amb27648478 [1,1,0,0,0,0|1,0,1]=4 4710 B7R0.3 C=CC(O)CCOC Amb27868318 [1,1,0,0,0,0|1,0,1]=4 4711 B7R0.3 C=CC(O)CCSC Amb28123529 [1,1,0,0,0,0|1,0,1]=4 4712 B7R0.3 C=CC(O)COCC Amb28316201 [1,1,0,0,0,0|1,0,1]=4 4713 B7R0.3 C=CC(O)CSCC Amb24543994 [1,1,0,0,0,0|1,0,1]=4 4714 B7R0.3 C=CCCC(=O)CC Amb9031676 [1,1,0,0,0,0|0,0,2]=4 4715 B7R0.3 C=CCCC(Br)CBr Amb17779511 [1,1,0,0,0,0|1,0,1]=4 4716 B7R0.3 C=CCCC(C)C=O Amb25100921 [1,1,0,0,0,0|0,0,2]=4 4717 B7R0.3 C=CCCC(C)CBr Amb26952992 [1,1,0,0,0,0|1,0,1]=4 4718 B7R0.3 C=CCCC(C)CC Amb26860723 [1,1,0,0,0,0|0,0,1]=3 4719 B7R0.3 C=CCCC(C)CCl Amb24481361 [1,1,0,0,0,0|1,0,1]=4 4720 B7R0.3 C=CCCC(C)CN Amb25189032 [1,1,0,0,0,0|1,0,1]=4 4721 B7R0.3 C=CCCC(C)CN Amb33611653 [1,1,0,0,0,0|1,0,1]=4 4722 B7R0.3 C=CCCC(C)CO Amb27760347 [1,1,0,0,0,0|1,0,1]=4 4723 B7R0.3 C=CCCC(C)NC Amb18641747 [1,1,0,0,0,0|1,0,1]=4 4724 B7R0.3 C=CCCC(C)SC Amb28049294 [1,1,0,0,0,0|1,0,1]=4 4725 B7R0.3 C=CCCC(Cl)CC Amb27394730 [1,1,0,0,0,0|0,0,1]=3 4726 B7R0.3 C=CCCC(N)CN Amb20667712 [1,1,0,0,0,0|1,0,1]=4 4727 B7R0.3 C=CCCC(N)CN Amb27267278 [1,1,0,0,0,0|1,0,1]=4 4728 B7R0.3 C=CCCC(N)CO Amb33532619 [1,1,0,0,0,0|1,0,1]=4 4729 B7R0.3 C=CCCC(O)C=O Amb27863605 [1,1,0,0,0,0|0,0,2]=4 4730 B7R0.3 C=CCCC(O)CC Amb22052608 [1,1,0,0,0,0|0,0,1]=3 4731 B7R0.3 C=CCCC(O)CN Amb8630191 [1,1,0,0,0,0|1,0,1]=4 4732 B7R0.3 C=CCCC(O)CO Amb10071251 [1,1,0,0,0,0|1,0,1]=4 4733 B7R0.3 C=CCC[C@@H](O)CO Amb27405919 [1,1,0,0,0,0|1,0,1]=4 4734 B7R0.3 C=CCC[C@H](C)C=O Amb27799770 [1,1,0,0,0,0|0,0,2]=4 4735 B7R0.3 C=CCC[C@H](N)CO Amb27390564 [1,1,0,0,0,0|1,0,1]=4 4736 B7R0.3 C=CCC[C@H](O)CC Amb27946057 [1,1,0,0,0,0|0,0,1]=3 4737 B7R0.3 C=CCNC(C)CC Amb6683957 [1,1,0,0,0,0|1,0,1]=4 4738 B7R0.3 C=CCSC(C)CC Amb3940675 [1,1,0,0,0,0|1,0,1]=4 4739 B7R0.3 C=COCC(N)CC Amb27413821 [1,1,0,0,0,0|1,0,1]=4 4740 B7R0.3 C=C[C@@H](C)CCC=O Amb25025116 [1,1,0,0,0,0|0,0,2]=4 4741 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [1,1,0,0,0,0|0,0,1]=3 4742 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [1,1,0,0,0,0|0,0,1]=3 4743 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [1,1,0,0,0,0|0,0,1]=3 4744 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [1,1,0,0,0,0|1,0,1]=4 4745 B7R0.3 CC(C=N)CCCN Amb27640100 [1,1,0,0,0,0|2,0,0]=4 4746 B7R0.3 CC(C=O)CCC#N Amb26607829 [1,1,0,0,0,0|1,0,1]=4 4747 B7R0.3 CC(C=O)CCCBr Amb26526795 [1,1,0,0,0,0|1,0,0]=3 4748 B7R0.3 CC(C=O)SCCO Amb27827864 [1,1,0,0,0,0|2,0,0]=4 4749 B7R0.3 CC(CCl)CCCN Amb27472589 [1,1,0,0,0,0|2,0,0]=4 4750 B7R0.3 CC(CCl)CCCO Amb27439284 [1,1,0,0,0,0|1,0,1]=4 4751 B7R0.3 CC(CN)CCC=N Amb27640087 [1,1,0,0,0,0|2,0,0]=4 4752 B7R0.3 CC(CN)CCCBr Amb28246470 [1,1,0,0,0,0|2,0,0]=4 4753 B7R0.3 CC(CN)CCCO Amb17569906 [1,1,0,0,0,0|1,0,1]=4 4754 B7R0.3 CC(CN)CCCO Amb28934846 [1,1,0,0,0,0|1,0,1]=4 4755 B7R0.3 CC(CO)CCCN Amb17569904 [1,1,0,0,0,0|1,0,1]=4 4756 B7R0.3 CC(CO)CCCN Amb32686956 [1,1,0,0,0,0|1,0,1]=4 4757 B7R0.3 CC(CO)CCCO Amb25098490 [1,1,0,0,0,0|1,0,1]=4 4758 B7R0.3 CC(CO)CNC=O Amb27482480 [1,1,0,0,0,0|2,0,0]=4 4759 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|1,0,1]=4 4760 B7R0.3 CCC(=O)CCCCl Amb17593423 [1,1,0,0,0,0|1,0,1]=4 4761 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|1,0,1]=4 4762 B7R0.3 CCC(=O)NCC=O Amb17102054 [1,1,0,0,0,0|1,0,1]=4 4763 B7R0.3 CCC(Br)CCC#N Amb27475650 [1,1,0,0,0,0|1,0,1]=4 4764 B7R0.3 CCC(C)C#CC=O Amb27828859 [1,1,0,0,0,0|0,0,2]=4 4765 B7R0.3 CCC(C)CCC#N Amb26382039 [1,1,0,0,0,0|1,0,1]=4 4766 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,0]=3 4767 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,0]=3 4768 B7R0.3 CCC(C)CCCN Amb17569898 [1,1,0,0,0,0|1,0,0]=3 4769 B7R0.3 CCC(C)CCCO Amb28070020 [1,1,0,0,0,0|0,0,1]=3 4770 B7R0.3 CCC(C)CCCS Amb33318441 [1,1,0,0,0,0|0,1,0]=3 4771 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|1,0,1]=4 4772 B7R0.3 CCC(C)CCNN Amb27852367 [1,1,0,0,0,0|2,0,0]=4 4773 B7R0.3 CCC(C)CCNO Amb27442658 [1,1,0,0,0,0|1,0,1]=4 4774 B7R0.3 CCC(C)CCON Amb33226956 [1,1,0,0,0,0|2,0,0]=4 4775 B7R0.3 CCC(C)CN=C=O Amb25783333 [1,1,0,0,0,0|1,0,1]=4 4776 B7R0.3 CCC(C)COCCl Amb27663126 [1,1,0,0,0,0|2,0,0]=4 4777 B7R0.3 CCC(C)NCCBr Amb27641912 [1,1,0,0,0,0|2,0,0]=4 4778 B7R0.3 CCC(C)NCCCl Amb17334146 [1,1,0,0,0,0|2,0,0]=4 4779 B7R0.3 CCC(C)NCCN Amb29844468 [1,1,0,0,0,0|2,0,0]=4 4780 B7R0.3 CCC(C)NCCN Amb4016515 [1,1,0,0,0,0|2,0,0]=4 4781 B7R0.3 CCC(C)NCCO Amb6707239 [1,1,0,0,0,0|1,0,1]=4 4782 B7R0.3 CCC(C)OCCN Amb18307952 [1,1,0,0,0,0|2,0,0]=4 4783 B7R0.3 CCC(C)OCCS Amb27228171 [1,1,0,0,0,0|1,1,0]=4 4784 B7R0.3 CCC(C)SCCN Amb6680221 [1,1,0,0,0,0|2,0,0]=4 4785 B7R0.3 CCC(C)SCCS Amb27424484 [1,1,0,0,0,0|1,1,0]=4 4786 B7R0.3 CCC(C)\C=C\C=O Amb32954899 [1,1,0,0,0,0|0,0,2]=4 4787 B7R0.3 CCC(Cl)CCC=O Amb27637733 [1,1,0,0,0,0|0,0,0]=2 4788 B7R0.3 CCC(Cl)CCCCl Amb19959959 [1,1,0,0,0,0|1,0,0]=3 4789 B7R0.3 CCC(Cl)CCNC Amb27197718 [1,1,0,0,0,0|1,0,1]=4 4790 B7R0.3 CCC(Cl)CCOC Amb27811831 [1,1,0,0,0,0|1,0,1]=4 4791 B7R0.3 CCC(Cl)OCCCl Amb27803657 [1,1,0,0,0,0|2,0,0]=4 4792 B7R0.3 CCC(N)CCC=O Amb33036216 [1,1,0,0,0,0|0,0,0]=2 4793 B7R0.3 CCC(N)CCCN Amb27392660 [1,1,0,0,0,0|1,0,0]=3 4794 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|0,0,1]=3 4795 B7R0.3 CCC(N)CCNC Amb28048985 [1,1,0,0,0,0|1,0,1]=4 4796 B7R0.3 CCC(N)CCOC Amb19016193 [1,1,0,0,0,0|1,0,1]=4 4797 B7R0.3 CCC(N)CCSC Amb28048993 [1,1,0,0,0,0|1,0,1]=4 4798 B7R0.3 CCC(N)C\C=C\Cl Amb35606913 [1,1,0,0,0,0|1,0,1]=4 4799 B7R0.3 CCC(N)NCCN Amb27438454 [1,1,0,0,0,0|2,0,0]=4 4800 B7R0.3 CCC(O)CCCN Amb18202667 [1,1,0,0,0,0|1,0,0]=3 4801 B7R0.3 CCC(O)CCCN Amb19374975 [1,1,0,0,0,0|1,0,0]=3 4802 B7R0.3 CCC(O)CCCO Amb17593216 [1,1,0,0,0,0|0,0,1]=3 4803 B7R0.3 CCC(O)CCOC Amb22058972 [1,1,0,0,0,0|1,0,1]=4 4804 B7R0.3 CCC(O)\C=C\C=O Amb16233610 [1,1,0,0,0,0|0,0,2]=4 4805 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|1,0,1]=4 4806 B7R0.3 CCCCC(=O)CC Amb4605999 [1,1,0,0,0,0|0,0,2]=4 4807 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|1,0,1]=4 4808 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|1,0,1]=4 4809 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,2]=4 4810 B7R0.3 CCCCC(Br)C=O Amb17594581 [1,1,0,0,0,0|0,0,0]=2 4811 B7R0.3 CCCCC(Br)CBr Amb8517633 [1,1,0,0,0,0|1,0,0]=3 4812 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|0,0,1]=3 4813 B7R0.3 CCCCC(Br)CF Amb28410717 [1,1,0,0,0,0|1,0,0]=3 4814 B7R0.3 CCCCC(C)C#N Amb18641663 [1,1,0,0,0,0|1,0,1]=4 4815 B7R0.3 CCCCC(C)C=O Amb17593191 [1,1,0,0,0,0|0,0,0]=2 4816 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,0]=3 4817 B7R0.3 CCCCC(C)CC Amb10071971 [1,1,0,0,0,0|0,0,1]=3 4818 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,0]=3 4819 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,0]=3 4820 B7R0.3 CCCCC(C)CO Amb17593205 [1,1,0,0,0,0|0,0,1]=3 4821 B7R0.3 CCCCC(C)NC Amb9620956 [1,1,0,0,0,0|1,0,1]=4 4822 B7R0.3 CCCCC(C)ON Amb33428411 [1,1,0,0,0,0|2,0,0]=4 4823 B7R0.3 CCCCC(Cl)C#N Amb26017572 [1,1,0,0,0,0|1,0,1]=4 4824 B7R0.3 CCCCC(Cl)CBr Amb27490970 [1,1,0,0,0,0|1,0,0]=3 4825 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|0,0,1]=3 4826 B7R0.3 CCCCC(Cl)CCl Amb9787250 [1,1,0,0,0,0|1,0,0]=3 4827 B7R0.3 CCCCC(Cl)CN Amb31030967 [1,1,0,0,0,0|1,0,0]=3 4828 B7R0.3 CCCCC(F)C=O Amb27838938 [1,1,0,0,0,0|0,0,0]=2 4829 B7R0.3 CCCCC(F)CBr Amb27758689 [1,1,0,0,0,0|1,0,0]=3 4830 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|1,0,0]=3 4831 B7R0.3 CCCCC(N)C#N Amb18975861 [1,1,0,0,0,0|1,0,1]=4 4832 B7R0.3 CCCCC(N)C=O Amb28422291 [1,1,0,0,0,0|0,0,0]=2 4833 B7R0.3 CCCCC(N)CC Amb33527796 [1,1,0,0,0,0|0,0,1]=3 4834 B7R0.3 CCCCC(N)CC Amb9031866 [1,1,0,0,0,0|0,0,1]=3 4835 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|1,0,0]=3 4836 B7R0.3 CCCCC(N)CO Amb3939373 [1,1,0,0,0,0|0,0,1]=3 4837 B7R0.3 CCCCC(N)CS Amb27961155 [1,1,0,0,0,0|0,1,0]=3 4838 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|1,0,0]=3 4839 B7R0.3 CCCCC(O)CC Amb10844720 [1,1,0,0,0,0|0,0,1]=3 4840 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|1,0,0]=3 4841 B7R0.3 CCCCC(O)CF Amb27807497 [1,1,0,0,0,0|1,0,0]=3 4842 B7R0.3 CCCCC(O)CN Amb8630130 [1,1,0,0,0,0|1,0,0]=3 4843 B7R0.3 CCCCC(O)CO Amb8390318 [1,1,0,0,0,0|0,0,1]=3 4844 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|0,0,1]=3 4845 B7R0.3 CCCCC(S)CN Amb27643759 [1,1,0,0,0,0|1,0,0]=3 4846 B7R0.3 CCCCN(C)C=O Amb26967032 [1,1,0,0,0,0|1,0,0]=3 4847 B7R0.3 CCCCN(C)N=O Amb22231185 [1,1,0,0,0,0|2,0,0]=4 4848 B7R0.3 CCCCN(N)CC Amb17593206 [1,1,0,0,0,0|1,0,1]=4 4849 B7R0.3 CCCCN(O)CC Amb27230146 [1,1,0,0,0,0|1,0,1]=4 4850 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,1,0,0,0,0|0,0,1]=3 4851 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [1,1,0,0,0,0|1,0,0]=3 4852 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,1,0,0,0,0|0,0,1]=3 4853 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,1,0,0,0,0|0,0,1]=3 4854 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [1,1,0,0,0,0|0,0,1]=3 4855 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,1,0,0,0,0|0,0,1]=3 4856 B7R0.3 CCCC[C@@H](O)C#N Amb27798698 [1,1,0,0,0,0|1,0,1]=4 4857 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,1,0,0,0,0|1,0,0]=3 4858 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [1,1,0,0,0,0|0,0,0]=2 4859 B7R0.3 CCCC[C@H](C)CN Amb25889982 [1,1,0,0,0,0|1,0,0]=3 4860 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,1,0,0,0,0|0,0,1]=3 4861 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,1,0,0,0,0|0,0,1]=3 4862 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,1,0,0,0,0|0,0,1]=3 4863 B7R0.3 CCCC[C@H](O)CF Amb27656199 [1,1,0,0,0,0|1,0,0]=3 4864 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,1,0,0,0,0|1,0,0]=3 4865 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,1,0,0,0,0|0,0,1]=3 4866 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [1,1,0,0,0,0|1,0,1]=4 4867 B7R0.3 CCCNC(C)CC Amb3939844 [1,1,0,0,0,0|1,0,1]=4 4868 B7R0.3 CCCNC(C)CO Amb9359690 [1,1,0,0,0,0|1,0,1]=4 4869 B7R0.3 CCCOC(=O)C=O Amb18641875 [1,1,0,0,0,0|1,0,1]=4 4870 B7R0.3 CCCOC(C)CC Amb27250865 [1,1,0,0,0,0|1,0,1]=4 4871 B7R0.3 CCCOC(C)CN Amb10608199 [1,1,0,0,0,0|2,0,0]=4 4872 B7R0.3 CCCOC(C)CN Amb21956046 [1,1,0,0,0,0|2,0,0]=4 4873 B7R0.3 CCCOC(C)CO Amb26370350 [1,1,0,0,0,0|1,0,1]=4 4874 B7R0.3 CCCSC(C)C=O Amb18124367 [1,1,0,0,0,0|1,0,0]=3 4875 B7R0.3 CCCSC(C)CC Amb4017932 [1,1,0,0,0,0|1,0,1]=4 4876 B7R0.3 CCCSC(C)CCl Amb27817405 [1,1,0,0,0,0|2,0,0]=4 4877 B7R0.3 CCCSC(C)CN Amb17485962 [1,1,0,0,0,0|2,0,0]=4 4878 B7R0.3 CCCSC(C)CO Amb27593226 [1,1,0,0,0,0|1,0,1]=4 4879 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [1,1,0,0,0,0|0,0,2]=4 4880 B7R0.3 CCN(C)CCCCl Amb10608259 [1,1,0,0,0,0|2,0,0]=4 4881 B7R0.3 CCN(C)CCCCl Amb22587199 [1,1,0,0,0,0|2,0,0]=4 4882 B7R0.3 CCN(C)CCCF Amb27837917 [1,1,0,0,0,0|2,0,0]=4 4883 B7R0.3 CCN(C)CCCN Amb6670583 [1,1,0,0,0,0|2,0,0]=4 4884 B7R0.3 CCN(C)CCCO Amb8428182 [1,1,0,0,0,0|1,0,1]=4 4885 B7R0.3 CCN(O)CCCN Amb27839388 [1,1,0,0,0,0|2,0,0]=4 4886 B7R0.3 CCNCC(C)CC Amb20623802 [1,1,0,0,0,0|1,0,1]=4 4887 B7R0.3 CCNCC(C)CC Amb6719189 [1,1,0,0,0,0|1,0,1]=4 4888 B7R0.3 CCNCC(C)CCl Amb28254657 [1,1,0,0,0,0|2,0,0]=4 4889 B7R0.3 CCNCC(C)CN Amb18314895 [1,1,0,0,0,0|2,0,0]=4 4890 B7R0.3 CCNCC(Cl)CC Amb28049008 [1,1,0,0,0,0|1,0,1]=4 4891 B7R0.3 CCNCC(N)CC Amb18304998 [1,1,0,0,0,0|1,0,1]=4 4892 B7R0.3 CCNCC(O)CC Amb9870468 [1,1,0,0,0,0|1,0,1]=4 4893 B7R0.3 CCNCC(O)CCl Amb18124503 [1,1,0,0,0,0|2,0,0]=4 4894 B7R0.3 CCNCC(O)CF Amb26895337 [1,1,0,0,0,0|2,0,0]=4 4895 B7R0.3 CCNCC(O)CN Amb18062380 [1,1,0,0,0,0|2,0,0]=4 4896 B7R0.3 CCNCC(O)CO Amb8856483 [1,1,0,0,0,0|1,0,1]=4 4897 B7R0.3 CCNC[C@@H](N)CC Amb27588708 [1,1,0,0,0,0|1,0,1]=4 4898 B7R0.3 CCNC[C@@H](O)CC Amb28129052 [1,1,0,0,0,0|1,0,1]=4 4899 B7R0.3 CCNC[C@H](O)CC Amb26984963 [1,1,0,0,0,0|1,0,1]=4 4900 B7R0.3 CCNC[C@H](O)CO Amb27830790 [1,1,0,0,0,0|1,0,1]=4 4901 B7R0.3 CCOCC(Br)CF Amb32863276 [1,1,0,0,0,0|2,0,0]=4 4902 B7R0.3 CCOCC(Br)CO Amb27791752 [1,1,0,0,0,0|1,0,1]=4 4903 B7R0.3 CCOCC(C)CBr Amb26847509 [1,1,0,0,0,0|2,0,0]=4 4904 B7R0.3 CCOCC(C)CCl Amb26887689 [1,1,0,0,0,0|2,0,0]=4 4905 B7R0.3 CCOCC(C)CN Amb8868817 [1,1,0,0,0,0|2,0,0]=4 4906 B7R0.3 CCOCC(C)CO Amb25823989 [1,1,0,0,0,0|1,0,1]=4 4907 B7R0.3 CCOCC(Cl)CCl Amb27644856 [1,1,0,0,0,0|2,0,0]=4 4908 B7R0.3 CCOCC(Cl)CO Amb27974227 [1,1,0,0,0,0|1,0,1]=4 4909 B7R0.3 CCOCC(N)CC Amb17485991 [1,1,0,0,0,0|1,0,1]=4 4910 B7R0.3 CCOCC(N)CO Amb25890491 [1,1,0,0,0,0|1,0,1]=4 4911 B7R0.3 CCOCC(N)CO Amb32666301 [1,1,0,0,0,0|1,0,1]=4 4912 B7R0.3 CCOCC(O)C=O Amb27883256 [1,1,0,0,0,0|1,0,0]=3 4913 B7R0.3 CCOCC(O)CF Amb28321363 [1,1,0,0,0,0|2,0,0]=4 4914 B7R0.3 CCOCC(O)CN Amb31202384 [1,1,0,0,0,0|2,0,0]=4 4915 B7R0.3 CCOCC(O)CN Amb9707991 [1,1,0,0,0,0|2,0,0]=4 4916 B7R0.3 CCOCC(O)CO Amb19148881 [1,1,0,0,0,0|1,0,1]=4 4917 B7R0.3 CCOCC(S)CN Amb32788187 [1,1,0,0,0,0|2,0,0]=4 4918 B7R0.3 CCOC[C@@H](C)CN Amb33748152 [1,1,0,0,0,0|2,0,0]=4 4919 B7R0.3 CCOC[C@@H](C)CO Amb33735552 [1,1,0,0,0,0|1,0,1]=4 4920 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [1,1,0,0,0,0|1,0,1]=4 4921 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [1,1,0,0,0,0|1,0,1]=4 4922 B7R0.3 CCOC[C@H](C)CN Amb33747417 [1,1,0,0,0,0|2,0,0]=4 4923 B7R0.3 CCOC[C@H](C)CO Amb25999202 [1,1,0,0,0,0|1,0,1]=4 4924 B7R0.3 CCOC[C@H](N)CC Amb28400800 [1,1,0,0,0,0|1,0,1]=4 4925 B7R0.3 CCOC[C@H](O)CN Amb27457943 [1,1,0,0,0,0|2,0,0]=4 4926 B7R0.3 CCS(=O)CCCCl Amb27188737 [1,1,0,0,0,0|2,0,0]=4 4927 B7R0.3 CCS(=O)CCCN Amb18306016 [1,1,0,0,0,0|2,0,0]=4 4928 B7R0.3 CCSCC(C)C=O Amb27592961 [1,1,0,0,0,0|1,0,0]=3 4929 B7R0.3 CCSCC(C)CBr Amb26852087 [1,1,0,0,0,0|2,0,0]=4 4930 B7R0.3 CCSCC(C)CC Amb27395876 [1,1,0,0,0,0|1,0,1]=4 4931 B7R0.3 CCSCC(C)CCl Amb27469104 [1,1,0,0,0,0|2,0,0]=4 4932 B7R0.3 CCSCC(C)CN Amb9391465 [1,1,0,0,0,0|2,0,0]=4 4933 B7R0.3 CCSCC(F)CN Amb33324013 [1,1,0,0,0,0|2,0,0]=4 4934 B7R0.3 CCSCC(N)CC Amb17485958 [1,1,0,0,0,0|1,0,1]=4 4935 B7R0.3 CCSCC(N)CO Amb18643038 [1,1,0,0,0,0|1,0,1]=4 4936 B7R0.3 CCSCC(O)CBr Amb26957421 [1,1,0,0,0,0|2,0,0]=4 4937 B7R0.3 CCSCC(O)CC Amb27827536 [1,1,0,0,0,0|1,0,1]=4 4938 B7R0.3 CCSCC(O)CCl Amb17593873 [1,1,0,0,0,0|2,0,0]=4 4939 B7R0.3 CCSCC(O)CF Amb28062913 [1,1,0,0,0,0|2,0,0]=4 4940 B7R0.3 CCSCC(O)CN Amb6680865 [1,1,0,0,0,0|2,0,0]=4 4941 B7R0.3 CCSCC(O)CO Amb4019001 [1,1,0,0,0,0|1,0,1]=4 4942 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [1,1,0,0,0,0|1,0,1]=4 4943 B7R0.3 CCSC[C@@H](O)CN Amb26370394 [1,1,0,0,0,0|2,0,0]=4 4944 B7R0.3 CCSC[C@H](N)CC Amb27987520 [1,1,0,0,0,0|1,0,1]=4 4945 B7R0.3 CCSC[C@H](N)CO Amb26564857 [1,1,0,0,0,0|1,0,1]=4 4946 B7R0.3 CCSC[C@H](O)CN Amb27213896 [1,1,0,0,0,0|2,0,0]=4 4947 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,1,0,0,0,0|0,0,0]=2 4948 B7R0.3 CC[C@@H](C)CCCCl Amb27166913 [1,1,0,0,0,0|1,0,0]=3 4949 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,1]=3 4950 B7R0.3 CC[C@@H](O)CCC#N Amb28455273 [1,1,0,0,0,0|1,0,1]=4 4951 B7R0.3 CC[C@H](C)CCCBr Amb27619630 [1,1,0,0,0,0|1,0,0]=3 4952 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,1]=3 4953 B7R0.3 CC[C@H](C)CN=C=O Amb27210806 [1,1,0,0,0,0|1,0,1]=4 4954 B7R0.3 CC[C@H](C)\C=C\C=O Amb27873518 [1,1,0,0,0,0|0,0,2]=4 4955 B7R0.3 CC[C@H](N)CCOC Amb28123823 [1,1,0,0,0,0|1,0,1]=4 4956 B7R0.3 CC[C@H](O)\C=C\C=O Amb28070938 [1,1,0,0,0,0|0,0,2]=4 4957 B7R0.3 CC\C=C\C(C)C=O Amb33474380 [1,1,0,0,0,0|0,0,2]=4 4958 B7R0.3 CC\C=C\C(F)C=O Amb26049149 [1,1,0,0,0,0|0,0,2]=4 4959 B7R0.3 CN(C=O)CCCCl Amb24589375 [1,1,0,0,0,0|2,0,0]=4 4960 B7R0.3 CN(C=O)CCCO Amb17593211 [1,1,0,0,0,0|2,0,0]=4 4961 B7R0.3 CNC(C)CCCO Amb17569902 [1,1,0,0,0,0|1,0,1]=4 4962 B7R0.3 CNCCC(C)CN Amb17334066 [1,1,0,0,0,0|2,0,0]=4 4963 B7R0.3 CNCCC(C)CO Amb17569900 [1,1,0,0,0,0|1,0,1]=4 4964 B7R0.3 CNCCC(O)CN Amb27881647 [1,1,0,0,0,0|2,0,0]=4 4965 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,1]=4 4966 B7R0.3 COC(C)CCC=O Amb25917630 [1,1,0,0,0,0|1,0,0]=3 4967 B7R0.3 COC(C)CCCBr Amb27198618 [1,1,0,0,0,0|2,0,0]=4 4968 B7R0.3 COC(C)CCCCl Amb28397922 [1,1,0,0,0,0|2,0,0]=4 4969 B7R0.3 COC(C)CCCN Amb17569913 [1,1,0,0,0,0|2,0,0]=4 4970 B7R0.3 COCCC(C)C=O Amb26896518 [1,1,0,0,0,0|1,0,0]=3 4971 B7R0.3 COCCC(C)CBr Amb27210700 [1,1,0,0,0,0|2,0,0]=4 4972 B7R0.3 COCCC(C)CCl Amb26887699 [1,1,0,0,0,0|2,0,0]=4 4973 B7R0.3 COCCC(C)CN Amb17569915 [1,1,0,0,0,0|2,0,0]=4 4974 B7R0.3 COCCC(Cl)CCl Amb28314216 [1,1,0,0,0,0|2,0,0]=4 4975 B7R0.3 COCCC(F)CN Amb33377810 [1,1,0,0,0,0|2,0,0]=4 4976 B7R0.3 COCCC(N)C=O Amb28397866 [1,1,0,0,0,0|1,0,0]=3 4977 B7R0.3 COCCC(N)CN Amb19023234 [1,1,0,0,0,0|2,0,0]=4 4978 B7R0.3 COCCC(N)CN Amb33309583 [1,1,0,0,0,0|2,0,0]=4 4979 B7R0.3 COCCC(N)CO Amb32952892 [1,1,0,0,0,0|1,0,1]=4 4980 B7R0.3 COCCC(N)CO Amb33532817 [1,1,0,0,0,0|1,0,1]=4 4981 B7R0.3 COCCC(O)CBr Amb33227254 [1,1,0,0,0,0|2,0,0]=4 4982 B7R0.3 COCCC(O)CCl Amb27457414 [1,1,0,0,0,0|2,0,0]=4 4983 B7R0.3 COCCC(O)CF Amb33377484 [1,1,0,0,0,0|2,0,0]=4 4984 B7R0.3 COCCC(O)CN Amb27966623 [1,1,0,0,0,0|2,0,0]=4 4985 B7R0.3 COCCC(O)CO Amb28128880 [1,1,0,0,0,0|1,0,1]=4 4986 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [1,1,0,0,0,0|1,0,0]=3 4987 B7R0.3 COCC[C@@H](N)CO Amb33377807 [1,1,0,0,0,0|1,0,1]=4 4988 B7R0.3 COCC[C@@H](O)CN Amb33377809 [1,1,0,0,0,0|2,0,0]=4 4989 B7R0.3 COCC[C@H](N)CO Amb25937729 [1,1,0,0,0,0|1,0,1]=4 4990 B7R0.3 COCC[C@H](O)CN Amb33377791 [1,1,0,0,0,0|2,0,0]=4 4991 B7R0.3 COCO[C@@H](C)C=O Amb28422010 [1,1,0,0,0,0|2,0,0]=4 4992 B7R0.3 CO[C@@H](C)CNC=O Amb35605354 [1,1,0,0,0,0|2,0,0]=4 4993 B7R0.3 CO[C@H](C)CNC=O Amb35605356 [1,1,0,0,0,0|2,0,0]=4 4994 B7R0.3 CSCCC(C)C=O Amb26624792 [1,1,0,0,0,0|1,0,0]=3 4995 B7R0.3 CSCCC(C)CBr Amb26508349 [1,1,0,0,0,0|2,0,0]=4 4996 B7R0.3 CSCCC(C)CCl Amb27870601 [1,1,0,0,0,0|2,0,0]=4 4997 B7R0.3 CSCCC(C)CN Amb28291178 [1,1,0,0,0,0|2,0,0]=4 4998 B7R0.3 CSCCC(F)CN Amb33198736 [1,1,0,0,0,0|2,0,0]=4 4999 B7R0.3 CSCCC(N)CN Amb19003937 [1,1,0,0,0,0|2,0,0]=4 5000 B7R0.3 CSCCC(N)CN Amb33291358 [1,1,0,0,0,0|2,0,0]=4 5001 B7R0.3 CSCCC(N)CO Amb4036829 [1,1,0,0,0,0|1,0,1]=4 5002 B7R0.3 CSCCC(O)CBr Amb25824128 [1,1,0,0,0,0|2,0,0]=4 5003 B7R0.3 CSCCC(O)CCl Amb25067893 [1,1,0,0,0,0|2,0,0]=4 5004 B7R0.3 CSCCC(O)CF Amb33198282 [1,1,0,0,0,0|2,0,0]=4 5005 B7R0.3 CSCCC(O)CN Amb25785761 [1,1,0,0,0,0|2,0,0]=4 5006 B7R0.3 CSCCC(O)CO Amb26019209 [1,1,0,0,0,0|1,0,1]=4 5007 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [1,1,0,0,0,0|1,0,1]=4 5008 B7R0.3 CSCC[C@@H](O)CN Amb26515632 [1,1,0,0,0,0|2,0,0]=4 5009 B7R0.3 CSCC[C@H](N)CN Amb26023438 [1,1,0,0,0,0|2,0,0]=4 5010 B7R0.3 CSCC[C@H](N)CO Amb2720562 [1,1,0,0,0,0|1,0,1]=4 5011 B7R0.3 CSCC[C@H](O)CN Amb33198735 [1,1,0,0,0,0|2,0,0]=4 5012 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [1,1,0,0,0,0|1,0,1]=4 5013 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [1,1,0,0,0,0|1,0,1]=4 5014 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [1,1,0,0,0,0|1,0,1]=4 5015 B7R0.3 C\C=C(/C)CCCC Amb22229367 [1,1,0,0,0,0|1,0,1]=4 5016 B7R0.3 C\C=C/CC(Cl)CC Amb27760501 [1,1,0,0,0,0|1,0,1]=4 5017 B7R0.3 C\C=C\CC(C)C=O Amb17593164 [1,1,0,0,0,0|0,0,2]=4 5018 B7R0.3 C\C=C\C[C@H](C)C=O Amb27403477 [1,1,0,0,0,0|0,0,2]=4 5019 B7R0.3 NC(CO)CCCF Amb28069002 [1,1,0,0,0,0|1,0,1]=4 5020 B7R0.3 NC(CO)CCCO Amb18641979 [1,1,0,0,0,0|1,0,1]=4 5021 B7R0.3 NCC(N)CCCCl Amb28421823 [1,1,0,0,0,0|2,0,0]=4 5022 B7R0.3 NCC(O)CCC=O Amb27855481 [1,1,0,0,0,0|1,0,0]=3 5023 B7R0.3 NCC(O)CCCF Amb33196094 [1,1,0,0,0,0|2,0,0]=4 5024 B7R0.3 NCCCC(N)CF Amb28410605 [1,1,0,0,0,0|2,0,0]=4 5025 B7R0.3 NCCCC(N)CN Amb26640553 [1,1,0,0,0,0|2,0,0]=4 5026 B7R0.3 NCCCC(N)CO Amb27665423 [1,1,0,0,0,0|1,0,1]=4 5027 B7R0.3 NCCCC(O)CO Amb27759884 [1,1,0,0,0,0|1,0,1]=4 5028 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [1,1,0,0,0,0|1,0,0]=3 5029 B7R0.3 NC[C@H](O)CCCO Amb27632965 [1,1,0,0,0,0|1,0,1]=4 5030 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [1,1,0,0,0,0|1,0,1]=4 5031 B7R0.3 N[C@H](CO)CCCO Amb24117047 [1,1,0,0,0,0|1,0,1]=4 5032 B7R0.3 N[C@H](CS)CCCS Amb27836721 [1,1,0,0,0,0|1,1,0]=4 5033 B7R0.3 O=CC(=O)CCCO Amb27751348 [1,1,0,0,0,0|1,0,1]=4 5034 B7R0.3 O=CC(Cl)CCCO Amb27831369 [1,1,0,0,0,0|1,0,0]=3 5035 B7R0.3 O=CCCC(=O)CO Amb27799816 [1,1,0,0,0,0|1,0,1]=4 5036 B7R0.3 O=CCCC(Cl)C=O Amb27232955 [1,1,0,0,0,0|1,0,1]=4 5037 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [1,1,0,0,0,0|1,0,0]=3 5038 B7R0.3 OC(CBr)CCCBr Amb27268592 [1,1,0,0,0,0|2,0,0]=4 5039 B7R0.3 OC(CCl)CCCCl Amb26019455 [1,1,0,0,0,0|2,0,0]=4 5040 B7R0.3 OCC(O)CCCCl Amb17593523 [1,1,0,0,0,0|1,0,1]=4 5041 B7R0.3 OCCCC(Cl)CCl Amb27203325 [1,1,0,0,0,0|1,0,1]=4 5042 B7R0.3 OCCCC(O)CO Amb17593225 [1,1,0,0,0,0|1,0,1]=4 5043 B7R0.3 OCCCC(S)CS Amb27185627 [1,1,0,0,0,0|1,0,1]=4 5044 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [1,1,0,0,0,0|1,0,1]=4 5045 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [1,1,0,0,0,0|1,0,1]=4 5046 B7R0.3 OC[C@@H](O)CCCCl Amb27235461 [1,1,0,0,0,0|1,0,1]=4 5047 B7R0.3 [C-]#[N+]C(C)CCCC Amb3973080 [1,1,0,0,0,0|1,0,1]=4 5048 B7R0.3 [C-]#[N+]CCC(C)CC Amb33373874 [1,1,0,0,0,0|1,0,1]=4 5049 B7R0.3 [NH3+]CCCC(F)C[NH3+] Amb24117175 [1,1,0,0,0,0|2,0,0]=4 5050 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [1,1,0,0,0,0|0,0,2]=4 5051 B7R0.4 C#CCCCC(=O)O Amb2721705 [1,1,0,0,0,0|0,0,2]=4 5052 B7R0.4 C#CCCCC(C)=O Amb18115312 [1,1,0,0,0,0|0,0,2]=4 5053 B7R0.4 C#CCCCC(C)C Amb18635315 [1,1,0,0,0,0|0,0,2]=4 5054 B7R0.4 C#CCCCC(C)O Amb24360348 [1,1,0,0,0,0|0,0,2]=4 5055 B7R0.4 C#CCCCC(N)=O Amb27590599 [1,1,0,0,0,0|0,0,2]=4 5056 B7R0.4 C#CCCC[C@@H](C)O Amb26936874 [1,1,0,0,0,0|0,0,2]=4 5057 B7R0.4 C#CCCC[C@H](C)O Amb27809722 [1,1,0,0,0,0|0,0,2]=4 5058 B7R0.4 C=C(Br)CCCCBr Amb4035450 [1,1,0,0,0,0|1,0,1]=4 5059 B7R0.4 C=C(C)CCCCC Amb6298938 [1,1,0,0,0,0|0,0,1]=3 5060 B7R0.4 C=C(C)CCCCO Amb26872404 [1,1,0,0,0,0|0,0,2]=4 5061 B7R0.4 C=C(C)CCNC=O Amb27228134 [1,1,0,0,0,0|1,0,1]=4 5062 B7R0.4 C=C(C)CNCCC Amb17308631 [1,1,0,0,0,0|1,0,1]=4 5063 B7R0.4 C=C(C)COCC=O Amb27949608 [1,1,0,0,0,0|1,0,1]=4 5064 B7R0.4 C=C(C)CSCCC Amb27449649 [1,1,0,0,0,0|1,0,1]=4 5065 B7R0.4 C=C(Cl)CCCC=O Amb27751311 [1,1,0,0,0,0|0,0,2]=4 5066 B7R0.4 C=C(Cl)CNCCC Amb19004838 [1,1,0,0,0,0|1,0,1]=4 5067 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|1,0,1]=4 5068 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [1,1,0,0,0,0|0,0,2]=4 5069 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,1,0,0,0,0|0,0,2]=4 5070 B7R0.4 C=CCCCC(C)=O Amb17593171 [1,1,0,0,0,0|0,0,2]=4 5071 B7R0.4 C=CCCCC(C)C Amb25127926 [1,1,0,0,0,0|0,0,1]=3 5072 B7R0.4 C=CCCCC(C)N Amb25880150 [1,1,0,0,0,0|0,0,1]=3 5073 B7R0.4 C=CCCCC(C)O Amb22059432 [1,1,0,0,0,0|0,0,1]=3 5074 B7R0.4 C=CCCNC(C)C Amb18312589 [1,1,0,0,0,0|1,0,1]=4 5075 B7R0.4 C=CCCOC(C)C Amb28184344 [1,1,0,0,0,0|1,0,1]=4 5076 B7R0.4 C=CCCSC(C)C Amb27802079 [1,1,0,0,0,0|1,0,1]=4 5077 B7R0.4 C=CCNCC(C)C Amb6683812 [1,1,0,0,0,0|1,0,1]=4 5078 B7R0.4 C=CCNCC(C)Cl Amb27658629 [1,1,0,0,0,0|1,0,1]=4 5079 B7R0.4 C=CCNCC(C)O Amb17138365 [1,1,0,0,0,0|1,0,1]=4 5080 B7R0.4 C=CCNC[C@H](C)O Amb27950182 [1,1,0,0,0,0|1,0,1]=4 5081 B7R0.4 C=CCOCC(C)O Amb22733640 [1,1,0,0,0,0|1,0,1]=4 5082 B7R0.4 C=CCOC[C@@H](C)O Amb27780603 [1,1,0,0,0,0|1,0,1]=4 5083 B7R0.4 C=CCSCC(C)C Amb28049003 [1,1,0,0,0,0|1,0,1]=4 5084 B7R0.4 C=CCSCC(C)O Amb28065376 [1,1,0,0,0,0|1,0,1]=4 5085 B7R0.4 C=CCSC[C@@H](C)N Amb28401212 [1,1,0,0,0,0|1,0,1]=4 5086 B7R0.4 C=CCSC[C@H](C)N Amb27752407 [1,1,0,0,0,0|1,0,1]=4 5087 B7R0.4 C=CCSC[C@H](C)O Amb27220310 [1,1,0,0,0,0|1,0,1]=4 5088 B7R0.4 C=COCCC(C)Br Amb28343139 [1,1,0,0,0,0|1,0,1]=4 5089 B7R0.4 CC#CCCC(=O)O Amb3987196 [1,1,0,0,0,0|0,0,2]=4 5090 B7R0.4 CC(=O)CCCC#N Amb17106756 [1,1,0,0,0,0|1,0,1]=4 5091 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,1,0,0,0,0|1,0,0]=3 5092 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,1,0,0,0,0|1,0,0]=3 5093 B7R0.4 CC(=O)CCCCF Amb27490855 [1,1,0,0,0,0|1,0,0]=3 5094 B7R0.4 CC(=O)CCCCN Amb27401218 [1,1,0,0,0,0|1,0,0]=3 5095 B7R0.4 CC(=O)CCCCO Amb10603864 [1,1,0,0,0,0|1,0,0]=3 5096 B7R0.4 CC(=O)COCCCl Amb25346574 [1,1,0,0,0,0|2,0,0]=4 5097 B7R0.4 CC(=O)COCCF Amb27463527 [1,1,0,0,0,0|2,0,0]=4 5098 B7R0.4 CC(=O)COCCO Amb28122841 [1,1,0,0,0,0|2,0,0]=4 5099 B7R0.4 CC(=O)CSCCF Amb24621173 [1,1,0,0,0,0|2,0,0]=4 5100 B7R0.4 CC(=O)CSCCN Amb17500454 [1,1,0,0,0,0|2,0,0]=4 5101 B7R0.4 CC(=O)CSCCO Amb4165952 [1,1,0,0,0,0|2,0,0]=4 5102 B7R0.4 CC(=O)NCCC=O Amb17102165 [1,1,0,0,0,0|1,0,1]=4 5103 B7R0.4 CC(=O)NCCCBr Amb8826231 [1,1,0,0,0,0|2,0,0]=4 5104 B7R0.4 CC(=O)NCCCCl Amb3886559 [1,1,0,0,0,0|2,0,0]=4 5105 B7R0.4 CC(=O)NCCCN Amb10610286 [1,1,0,0,0,0|2,0,0]=4 5106 B7R0.4 CC(=O)NCCCN Amb6664982 [1,1,0,0,0,0|2,0,0]=4 5107 B7R0.4 CC(=O)NCCCO Amb3429354 [1,1,0,0,0,0|2,0,0]=4 5108 B7R0.4 CC(=O)OCCCBr Amb26515737 [1,1,0,0,0,0|2,0,0]=4 5109 B7R0.4 CC(=O)OCCCCl Amb3940269 [1,1,0,0,0,0|2,0,0]=4 5110 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|2,0,0]=4 5111 B7R0.4 CC(=O)OCCCS Amb4018773 [1,1,0,0,0,0|2,0,0]=4 5112 B7R0.4 CC(=O)SCCC=O Amb25101351 [1,1,0,0,0,0|1,0,1]=4 5113 B7R0.4 CC(=O)SCCCBr Amb17610077 [1,1,0,0,0,0|2,0,0]=4 5114 B7R0.4 CC(=O)SCCCCl Amb3940270 [1,1,0,0,0,0|2,0,0]=4 5115 B7R0.4 CC(Br)CCCCCl Amb27858670 [1,1,0,0,0,0|1,0,0]=3 5116 B7R0.4 CC(C)=CCCC=O Amb17593168 [1,1,0,0,0,0|0,0,2]=4 5117 B7R0.4 CC(C)CCCC#N Amb21811944 [1,1,0,0,0,0|1,0,1]=4 5118 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,0]=2 5119 B7R0.4 CC(C)CCCCBr Amb2721514 [1,1,0,0,0,0|1,0,0]=3 5120 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|1,0,0]=3 5121 B7R0.4 CC(C)CCCCN Amb33548422 [1,1,0,0,0,0|1,0,0]=3 5122 B7R0.4 CC(C)CCCCN Amb9304907 [1,1,0,0,0,0|1,0,0]=3 5123 B7R0.4 CC(C)CCCCO Amb3939382 [1,1,0,0,0,0|0,0,1]=3 5124 B7R0.4 CC(C)CCCCS Amb32788388 [1,1,0,0,0,0|0,1,0]=3 5125 B7R0.4 CC(C)CCCON Amb28315398 [1,1,0,0,0,0|2,0,0]=4 5126 B7R0.4 CC(C)CCN=C=O Amb5750733 [1,1,0,0,0,0|1,0,1]=4 5127 B7R0.4 CC(C)CCNC=O Amb27460935 [1,1,0,0,0,0|1,0,0]=3 5128 B7R0.4 CC(C)CCNCN Amb27194901 [1,1,0,0,0,0|2,0,0]=4 5129 B7R0.4 CC(C)CCNCO Amb27403355 [1,1,0,0,0,0|1,0,1]=4 5130 B7R0.4 CC(C)CCON=O Amb7809245 [1,1,0,0,0,0|2,0,0]=4 5131 B7R0.4 CC(C)CNCCCl Amb17334145 [1,1,0,0,0,0|2,0,0]=4 5132 B7R0.4 CC(C)CNCCI Amb27801831 [1,1,0,0,0,0|2,0,0]=4 5133 B7R0.4 CC(C)CNCCN Amb17091016 [1,1,0,0,0,0|2,0,0]=4 5134 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|1,0,1]=4 5135 B7R0.4 CC(C)CNCCO Amb6707299 [1,1,0,0,0,0|1,0,1]=4 5136 B7R0.4 CC(C)CNCCS Amb24616771 [1,1,0,0,0,0|1,1,0]=4 5137 B7R0.4 CC(C)COCCBr Amb6255231 [1,1,0,0,0,0|2,0,0]=4 5138 B7R0.4 CC(C)COCCN Amb33548979 [1,1,0,0,0,0|2,0,0]=4 5139 B7R0.4 CC(C)COCCN Amb6247554 [1,1,0,0,0,0|2,0,0]=4 5140 B7R0.4 CC(C)COCCO Amb3939640 [1,1,0,0,0,0|1,0,1]=4 5141 B7R0.4 CC(C)COCCS Amb24589392 [1,1,0,0,0,0|1,1,0]=4 5142 B7R0.4 CC(C)CSCCCl Amb9304957 [1,1,0,0,0,0|2,0,0]=4 5143 B7R0.4 CC(C)CSCCN Amb28934790 [1,1,0,0,0,0|2,0,0]=4 5144 B7R0.4 CC(C)CSCCN Amb6274135 [1,1,0,0,0,0|2,0,0]=4 5145 B7R0.4 CC(C)C\C=C\C=O Amb33359709 [1,1,0,0,0,0|0,0,2]=4 5146 B7R0.4 CC(C)NCCCF Amb27753882 [1,1,0,0,0,0|2,0,0]=4 5147 B7R0.4 CC(C)NCCCN Amb8515462 [1,1,0,0,0,0|2,0,0]=4 5148 B7R0.4 CC(C)NCCCO Amb22492397 [1,1,0,0,0,0|1,0,1]=4 5149 B7R0.4 CC(C)NCCCO Amb4422880 [1,1,0,0,0,0|1,0,1]=4 5150 B7R0.4 CC(C)OCCC=O Amb26443003 [1,1,0,0,0,0|1,0,0]=3 5151 B7R0.4 CC(C)OCCCBr Amb8828214 [1,1,0,0,0,0|2,0,0]=4 5152 B7R0.4 CC(C)OCCCCl Amb6255095 [1,1,0,0,0,0|2,0,0]=4 5153 B7R0.4 CC(C)OCCCN Amb6608864 [1,1,0,0,0,0|2,0,0]=4 5154 B7R0.4 CC(C)OCCCN Amb6892638 [1,1,0,0,0,0|2,0,0]=4 5155 B7R0.4 CC(C)OCCCO Amb10608350 [1,1,0,0,0,0|1,0,1]=4 5156 B7R0.4 CC(C)OCCCS Amb24551906 [1,1,0,0,0,0|1,1,0]=4 5157 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|2,0,0]=4 5158 B7R0.4 CC(C)SCCCN Amb10075505 [1,1,0,0,0,0|2,0,0]=4 5159 B7R0.4 CC(C)SCCCO Amb17502841 [1,1,0,0,0,0|1,0,1]=4 5160 B7R0.4 CC(Cl)CCCC=O Amb27983674 [1,1,0,0,0,0|0,0,0]=2 5161 B7R0.4 CC(Cl)CNCCCl Amb24442200 [1,1,0,0,0,0|2,0,0]=4 5162 B7R0.4 CC(Cl)CNCCCl Amb32653331 [1,1,0,0,0,0|2,0,0]=4 5163 B7R0.4 CC(F)CCCCCl Amb27596141 [1,1,0,0,0,0|1,0,0]=3 5164 B7R0.4 CC(F)CSCCN Amb27782477 [1,1,0,0,0,0|2,0,0]=4 5165 B7R0.4 CC(N)CCCCBr Amb27814547 [1,1,0,0,0,0|1,0,0]=3 5166 B7R0.4 CC(N)CCCCCl Amb27867737 [1,1,0,0,0,0|1,0,0]=3 5167 B7R0.4 CC(N)CCCCF Amb25954668 [1,1,0,0,0,0|1,0,0]=3 5168 B7R0.4 CC(N)CCCCN Amb25214697 [1,1,0,0,0,0|1,0,0]=3 5169 B7R0.4 CC(N)CCCCN Amb33551364 [1,1,0,0,0,0|1,0,0]=3 5170 B7R0.4 CC(N)CCCCO Amb17569907 [1,1,0,0,0,0|0,0,1]=3 5171 B7R0.4 CC(N)CCCCO Amb28934868 [1,1,0,0,0,0|0,0,1]=3 5172 B7R0.4 CC(N)CNCCN Amb28198270 [1,1,0,0,0,0|2,0,0]=4 5173 B7R0.4 CC(N)CSCCF Amb27233247 [1,1,0,0,0,0|2,0,0]=4 5174 B7R0.4 CC(O)CCCC=O Amb18641887 [1,1,0,0,0,0|0,0,0]=2 5175 B7R0.4 CC(O)CCCCF Amb27486303 [1,1,0,0,0,0|1,0,0]=3 5176 B7R0.4 CC(O)CCCCN Amb17569903 [1,1,0,0,0,0|1,0,0]=3 5177 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|0,0,1]=3 5178 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [1,1,0,0,0,0|0,1,0]=3 5179 B7R0.4 CC(O)CCOP=O Amb27443310 [1,1,0,0,0,0|2,0,0]=4 5180 B7R0.4 CC(O)CCO[PH2]=O Amb27594830 [1,1,0,0,0,0|2,0,0]=4 5181 B7R0.4 CC(O)CC\C=C\Cl Amb27878569 [1,1,0,0,0,0|1,0,1]=4 5182 B7R0.4 CC(O)CNCCN Amb4034606 [1,1,0,0,0,0|2,0,0]=4 5183 B7R0.4 CC(O)CNCCO Amb4020001 [1,1,0,0,0,0|1,0,1]=4 5184 B7R0.4 CC(O)CNCCS Amb27838396 [1,1,0,0,0,0|1,1,0]=4 5185 B7R0.4 CC(O)COCCCl Amb27410199 [1,1,0,0,0,0|2,0,0]=4 5186 B7R0.4 CC(O)COCCN Amb27404532 [1,1,0,0,0,0|2,0,0]=4 5187 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|1,0,1]=4 5188 B7R0.4 CC(O)CSCCS Amb28074830 [1,1,0,0,0,0|1,1,0]=4 5189 B7R0.4 CC(S)CCCCN Amb32788406 [1,1,0,0,0,0|1,0,0]=3 5190 B7R0.4 CC(S)COCCN Amb32788415 [1,1,0,0,0,0|2,0,0]=4 5191 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,1,0,0,0,0|0,0,2]=4 5192 B7R0.4 CCC#CCC(C)=O Amb28040888 [1,1,0,0,0,0|0,0,2]=4 5193 B7R0.4 CCCC#CC(=O)O Amb2721706 [1,1,0,0,0,0|0,0,2]=4 5194 B7R0.4 CCCC#CC(C)=O Amb26844271 [1,1,0,0,0,0|0,0,2]=4 5195 B7R0.4 CCCC#CC(N)=O Amb27175227 [1,1,0,0,0,0|0,0,2]=4 5196 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|1,0,1]=4 5197 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,1]=4 5198 B7R0.4 CCCCCC(=N)N Amb19890171 [1,1,0,0,0,0|1,0,0]=3 5199 B7R0.4 CCCCCC(=N)N Amb2696574 [1,1,0,0,0,0|1,0,0]=3 5200 B7R0.4 CCCCCC(=N)N Amb35747068 [1,1,0,0,0,0|1,0,0]=3 5201 B7R0.4 CCCCCC(=O)F Amb26061517 [1,1,0,0,0,0|0,0,0]=2 5202 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|0,0,0]=2 5203 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [1,1,0,0,0,0|0,0,0]=2 5204 B7R0.4 CCCCCC(C)=O Amb6608885 [1,1,0,0,0,0|0,0,0]=2 5205 B7R0.4 CCCCCC(C)Br Amb3940202 [1,1,0,0,0,0|0,0,1]=3 5206 B7R0.4 CCCCCC(C)C Amb8513253 [1,1,0,0,0,0|0,0,1]=3 5207 B7R0.4 CCCCCC(C)Cl Amb22228752 [1,1,0,0,0,0|0,0,1]=3 5208 B7R0.4 CCCCCC(C)N Amb21962698 [1,1,0,0,0,0|0,0,1]=3 5209 B7R0.4 CCCCCC(C)N Amb3939364 [1,1,0,0,0,0|0,0,1]=3 5210 B7R0.4 CCCCCC(C)O Amb8383668 [1,1,0,0,0,0|0,0,1]=3 5211 B7R0.4 CCCCCC(C)S Amb17939452 [1,1,0,0,0,0|0,0,1]=3 5212 B7R0.4 CCCCCC(Cl)Cl Amb27206941 [1,1,0,0,0,0|1,0,0]=3 5213 B7R0.4 CCCCCC(F)Br Amb24641242 [1,1,0,0,0,0|1,0,0]=3 5214 B7R0.4 CCCCCC(N)=S Amb6246072 [1,1,0,0,0,0|0,1,0]=3 5215 B7R0.4 CCCCCC(O)Cl Amb27232933 [1,1,0,0,0,0|0,0,1]=3 5216 B7R0.4 CCCCCC(O)O Amb25921998 [1,1,0,0,0,0|0,0,1]=3 5217 B7R0.4 CCCCCN(C)O Amb33428427 [1,1,0,0,0,0|1,0,1]=4 5218 B7R0.4 CCCCCS(=O)Cl Amb32720370 [1,1,0,0,0,0|1,0,0]=3 5219 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [1,1,0,0,0,0|1,0,0]=3 5220 B7R0.4 CCCCCS(C)=O Amb27457494 [1,1,0,0,0,0|1,0,0]=3 5221 B7R0.4 CCCCCS(N)=O Amb32720371 [1,1,0,0,0,0|1,0,0]=3 5222 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [1,1,0,0,0,0|0,0,1]=3 5223 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|0,0,1]=3 5224 B7R0.4 CCCCC[C@H](C)N Amb8516349 [1,1,0,0,0,0|0,0,1]=3 5225 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,1,0,0,0,0|0,0,1]=3 5226 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [1,1,0,0,0,0|1,0,0]=3 5227 B7R0.4 CCCCNC(=N)N Amb19748357 [1,1,0,0,0,0|2,0,0]=4 5228 B7R0.4 CCCCNC(=N)N Amb32653258 [1,1,0,0,0,0|2,0,0]=4 5229 B7R0.4 CCCCNC(=O)Cl Amb24574309 [1,1,0,0,0,0|1,0,0]=3 5230 B7R0.4 CCCCNC(C)=N Amb27663050 [1,1,0,0,0,0|2,0,0]=4 5231 B7R0.4 CCCCNC(C)=O Amb5835711 [1,1,0,0,0,0|1,0,0]=3 5232 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|1,0,1]=4 5233 B7R0.4 CCCCNC(C)C Amb6251422 [1,1,0,0,0,0|1,0,1]=4 5234 B7R0.4 CCCCNC(N)=O Amb6663202 [1,1,0,0,0,0|1,0,0]=3 5235 B7R0.4 CCCCNC(N)=S Amb1152044 [1,1,0,0,0,0|1,1,0]=4 5236 B7R0.4 CCCCOC(=O)Cl Amb6608833 [1,1,0,0,0,0|1,0,0]=3 5237 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [1,1,0,0,0,0|1,1,0]=4 5238 B7R0.4 CCCCOC(C)=O Amb6608782 [1,1,0,0,0,0|1,0,0]=3 5239 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,1,0,0,0,0|1,0,1]=4 5240 B7R0.4 CCCCOC(C)O Amb26537694 [1,1,0,0,0,0|1,0,1]=4 5241 B7R0.4 CCCCOC(N)=O Amb4136361 [1,1,0,0,0,0|1,0,0]=3 5242 B7R0.4 CCCCO[PH](=O)O Amb26035392 [1,1,0,0,0,0|2,0,0]=4 5243 B7R0.4 CCCCSC(=N)N Amb10552525 [1,1,0,0,0,0|2,0,0]=4 5244 B7R0.4 CCCCSC(=N)N Amb4007584 [1,1,0,0,0,0|2,0,0]=4 5245 B7R0.4 CCCCSC(=O)Cl Amb22352826 [1,1,0,0,0,0|1,0,0]=3 5246 B7R0.4 CCCCSC(C)C Amb4020661 [1,1,0,0,0,0|1,0,1]=4 5247 B7R0.4 CCCCSC(C)O Amb27191967 [1,1,0,0,0,0|1,0,1]=4 5248 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|1,0,0]=3 5249 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|1,0,0]=3 5250 B7R0.4 CCCNCC(C)=O Amb26954588 [1,1,0,0,0,0|1,0,0]=3 5251 B7R0.4 CCCNCC(C)C Amb6258024 [1,1,0,0,0,0|1,0,1]=4 5252 B7R0.4 CCCNCC(C)O Amb9359420 [1,1,0,0,0,0|1,0,1]=4 5253 B7R0.4 CCCNCC(C)S Amb18124358 [1,1,0,0,0,0|1,0,1]=4 5254 B7R0.4 CCCNCC(Cl)Cl Amb28064059 [1,1,0,0,0,0|2,0,0]=4 5255 B7R0.4 CCCNCC(F)F Amb13951924 [1,1,0,0,0,0|2,0,0]=4 5256 B7R0.4 CCCNCC(F)F Amb8853727 [1,1,0,0,0,0|2,0,0]=4 5257 B7R0.4 CCCNCC(N)=O Amb1124632 [1,1,0,0,0,0|1,0,0]=3 5258 B7R0.4 CCCNCC(N)=O Amb28934788 [1,1,0,0,0,0|1,0,0]=3 5259 B7R0.4 CCCNC[C@@H](C)N Amb27835548 [1,1,0,0,0,0|1,0,1]=4 5260 B7R0.4 CCCNNC(N)=O Amb27405031 [1,1,0,0,0,0|2,0,0]=4 5261 B7R0.4 CCCOCC(=O)Cl Amb27260778 [1,1,0,0,0,0|1,0,0]=3 5262 B7R0.4 CCCOCC(=O)O Amb8874504 [1,1,0,0,0,0|1,0,0]=3 5263 B7R0.4 CCCOCC(N)=O Amb27844884 [1,1,0,0,0,0|1,0,0]=3 5264 B7R0.4 CCCOCC(N)=S Amb8874828 [1,1,0,0,0,0|1,1,0]=4 5265 B7R0.4 CCCOC[C@@H](C)N Amb28048953 [1,1,0,0,0,0|1,0,1]=4 5266 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [1,1,0,0,0,0|1,0,1]=4 5267 B7R0.4 CCCONC(C)=O Amb27764366 [1,1,0,0,0,0|2,0,0]=4 5268 B7R0.4 CCCONC(N)=O Amb2899788 [1,1,0,0,0,0|2,0,0]=4 5269 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|1,0,0]=3 5270 B7R0.4 CCCSCC(C)=O Amb9668676 [1,1,0,0,0,0|1,0,0]=3 5271 B7R0.4 CCCSCC(C)C Amb4017817 [1,1,0,0,0,0|1,0,1]=4 5272 B7R0.4 CCCSCC(C)O Amb27463818 [1,1,0,0,0,0|1,0,1]=4 5273 B7R0.4 CCCSCC(C)S Amb32788151 [1,1,0,0,0,0|1,0,1]=4 5274 B7R0.4 CCCSCC(N)=O Amb27424658 [1,1,0,0,0,0|1,0,0]=3 5275 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [1,1,0,0,0,0|1,0,1]=4 5276 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [1,1,0,0,0,0|0,0,2]=4 5277 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [1,1,0,0,0,0|0,0,2]=4 5278 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,1,0,0,0,0|0,0,2]=4 5279 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,1,0,0,0,0|0,0,2]=4 5280 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [1,1,0,0,0,0|0,0,2]=4 5281 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|1,0,0]=3 5282 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|1,0,0]=3 5283 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,0]=3 5284 B7R0.4 CCNCCC(C)C Amb6244455 [1,1,0,0,0,0|1,0,1]=4 5285 B7R0.4 CCNCCC(C)O Amb27239293 [1,1,0,0,0,0|1,0,1]=4 5286 B7R0.4 CCNCCC(N)=O Amb33533384 [1,1,0,0,0,0|1,0,0]=3 5287 B7R0.4 CCNCCC(N)=O Amb35749820 [1,1,0,0,0,0|1,0,0]=3 5288 B7R0.4 CCNCCC(N)=S Amb17231882 [1,1,0,0,0,0|1,1,0]=4 5289 B7R0.4 CCNNCC(=O)O Amb28326075 [1,1,0,0,0,0|2,0,0]=4 5290 B7R0.4 CCOCCC(=N)N Amb2696677 [1,1,0,0,0,0|2,0,0]=4 5291 B7R0.4 CCOCCC(=N)N Amb33551393 [1,1,0,0,0,0|2,0,0]=4 5292 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,1,0,0,0,0|1,0,0]=3 5293 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|1,0,0]=3 5294 B7R0.4 CCOCCC(C)=O Amb7764636 [1,1,0,0,0,0|1,0,0]=3 5295 B7R0.4 CCOCCC(C)Cl Amb28422675 [1,1,0,0,0,0|1,0,1]=4 5296 B7R0.4 CCOCCC(C)N Amb7772189 [1,1,0,0,0,0|1,0,1]=4 5297 B7R0.4 CCOCCC(C)O Amb27852957 [1,1,0,0,0,0|1,0,1]=4 5298 B7R0.4 CCOCCC(Cl)Cl Amb27984892 [1,1,0,0,0,0|2,0,0]=4 5299 B7R0.4 CCOCCC(N)=S Amb6263797 [1,1,0,0,0,0|1,1,0]=4 5300 B7R0.4 CCOCCS(=O)Cl Amb24625733 [1,1,0,0,0,0|2,0,0]=4 5301 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [1,1,0,0,0,0|2,0,0]=4 5302 B7R0.4 CCOCCS(N)=O Amb32720346 [1,1,0,0,0,0|2,0,0]=4 5303 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,1,0,0,0,0|1,0,1]=4 5304 B7R0.4 CCOCC[C@H](C)O Amb27946039 [1,1,0,0,0,0|1,0,1]=4 5305 B7R0.4 CCOCNC(N)=O Amb25765493 [1,1,0,0,0,0|2,0,0]=4 5306 B7R0.4 CCOCOC(=O)Cl Amb27623794 [1,1,0,0,0,0|2,0,0]=4 5307 B7R0.4 CCSCCC(=N)N Amb6680836 [1,1,0,0,0,0|2,0,0]=4 5308 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|1,0,0]=3 5309 B7R0.4 CCSCCC(C)=O Amb9655821 [1,1,0,0,0,0|1,0,0]=3 5310 B7R0.4 CCSCCC(C)Br Amb33435746 [1,1,0,0,0,0|1,0,1]=4 5311 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|1,0,1]=4 5312 B7R0.4 CCSCCC(C)Cl Amb28458510 [1,1,0,0,0,0|1,0,1]=4 5313 B7R0.4 CCSCCC(C)N Amb19149259 [1,1,0,0,0,0|1,0,1]=4 5314 B7R0.4 CCSCCC(C)O Amb28048927 [1,1,0,0,0,0|1,0,1]=4 5315 B7R0.4 CCSCCC(N)=O Amb27258252 [1,1,0,0,0,0|1,0,0]=3 5316 B7R0.4 CCSCCC(N)=S Amb17307560 [1,1,0,0,0,0|1,1,0]=4 5317 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [1,1,0,0,0,0|1,0,1]=4 5318 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [1,1,0,0,0,0|1,0,1]=4 5319 B7R0.4 CCSCC[C@H](C)N Amb33323728 [1,1,0,0,0,0|1,0,1]=4 5320 B7R0.4 CCSCC[C@H](C)O Amb33323733 [1,1,0,0,0,0|1,0,1]=4 5321 B7R0.4 CCSCC[N+](=O)[O-] Amb27838043 [1,1,0,0,0,0|2,0,0]=4 5322 B7R0.4 CCSSCC(C)=O Amb28316151 [1,1,0,0,0,0|2,0,0]=4 5323 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,1,0,0,0,0|0,0,2]=4 5324 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,1,0,0,0,0|0,0,2]=4 5325 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,1,0,0,0,0|0,0,2]=4 5326 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,1,0,0,0,0|0,0,2]=4 5327 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,1,0,0,0,0|0,0,2]=4 5328 B7R0.4 CN(C)CCCC=O Amb22753951 [1,1,0,0,0,0|1,0,0]=3 5329 B7R0.4 CN(C)CCCC=O Amb24117840 [1,1,0,0,0,0|1,0,0]=3 5330 B7R0.4 CN(C)CCCCBr Amb18178257 [1,1,0,0,0,0|2,0,0]=4 5331 B7R0.4 CN(C)CCCCBr Amb19148184 [1,1,0,0,0,0|2,0,0]=4 5332 B7R0.4 CN(C)CCCCCl Amb17334150 [1,1,0,0,0,0|2,0,0]=4 5333 B7R0.4 CN(C)CCCCCl Amb20668164 [1,1,0,0,0,0|2,0,0]=4 5334 B7R0.4 CN(C)CCCCN Amb2687444 [1,1,0,0,0,0|2,0,0]=4 5335 B7R0.4 CN(C)CCCCO Amb9273966 [1,1,0,0,0,0|1,0,1]=4 5336 B7R0.4 CN(C)CCCCS Amb26480331 [1,1,0,0,0,0|1,1,0]=4 5337 B7R0.4 CN(N)CCCCO Amb28133877 [1,1,0,0,0,0|1,0,1]=4 5338 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|1,0,0]=3 5339 B7R0.4 CNCCCC(=O)O Amb4521435 [1,1,0,0,0,0|1,0,0]=3 5340 B7R0.4 CNCCCC(C)=O Amb27838406 [1,1,0,0,0,0|1,0,0]=3 5341 B7R0.4 CNCCCC(C)C Amb32757651 [1,1,0,0,0,0|1,0,1]=4 5342 B7R0.4 CNCCCC(C)C Amb8853654 [1,1,0,0,0,0|1,0,1]=4 5343 B7R0.4 CNCCCC(C)O Amb17569899 [1,1,0,0,0,0|1,0,1]=4 5344 B7R0.4 CNCCCC(N)=O Amb18303611 [1,1,0,0,0,0|1,0,0]=3 5345 B7R0.4 CNCCCC(N)=O Amb31307731 [1,1,0,0,0,0|1,0,0]=3 5346 B7R0.4 CNCCCS(C)=O Amb27827686 [1,1,0,0,0,0|2,0,0]=4 5347 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [1,1,0,0,0,0|1,0,1]=4 5348 B7R0.4 CNCCNC(C)=O Amb28934797 [1,1,0,0,0,0|2,0,0]=4 5349 B7R0.4 CNCCNC(C)=O Amb9256137 [1,1,0,0,0,0|2,0,0]=4 5350 B7R0.4 CNCCNC(N)=O Amb18299975 [1,1,0,0,0,0|2,0,0]=4 5351 B7R0.4 CNCCOC(C)=O Amb18124262 [1,1,0,0,0,0|2,0,0]=4 5352 B7R0.4 CNCCOC(C)=O Amb33621071 [1,1,0,0,0,0|2,0,0]=4 5353 B7R0.4 CNCCOC(N)=O Amb25136928 [1,1,0,0,0,0|2,0,0]=4 5354 B7R0.4 CNCCOC(N)=O Amb32693459 [1,1,0,0,0,0|2,0,0]=4 5355 B7R0.4 COCCCC(=N)N Amb19269156 [1,1,0,0,0,0|2,0,0]=4 5356 B7R0.4 COCCCC(=N)N Amb6266770 [1,1,0,0,0,0|2,0,0]=4 5357 B7R0.4 COCCCC(=O)O Amb6275629 [1,1,0,0,0,0|1,0,0]=3 5358 B7R0.4 COCCCC(C)=O Amb9031556 [1,1,0,0,0,0|1,0,0]=3 5359 B7R0.4 COCCCC(C)Br Amb18185551 [1,1,0,0,0,0|1,0,1]=4 5360 B7R0.4 COCCCC(C)Cl Amb26489622 [1,1,0,0,0,0|1,0,1]=4 5361 B7R0.4 COCCCC(C)N Amb9031757 [1,1,0,0,0,0|1,0,1]=4 5362 B7R0.4 COCCCC(C)O Amb4020863 [1,1,0,0,0,0|1,0,1]=4 5363 B7R0.4 COCCCC(C)S Amb25810805 [1,1,0,0,0,0|1,0,1]=4 5364 B7R0.4 COCCCC(Cl)Cl Amb28396614 [1,1,0,0,0,0|2,0,0]=4 5365 B7R0.4 COCCCC(N)=S Amb6270649 [1,1,0,0,0,0|1,1,0]=4 5366 B7R0.4 COCCCS(=O)Cl Amb26013061 [1,1,0,0,0,0|2,0,0]=4 5367 B7R0.4 COCCCS(=O)[O-] Amb27974844 [1,1,0,0,0,0|2,0,0]=4 5368 B7R0.4 COCCCS(N)=O Amb32720360 [1,1,0,0,0,0|2,0,0]=4 5369 B7R0.4 COCCC[C@@H](C)Cl Amb27590769 [1,1,0,0,0,0|1,0,1]=4 5370 B7R0.4 COCCC[C@@H](C)N Amb24749054 [1,1,0,0,0,0|1,0,1]=4 5371 B7R0.4 COCCC[C@@H](C)O Amb33428680 [1,1,0,0,0,0|1,0,1]=4 5372 B7R0.4 COCCC[C@H](C)N Amb27164382 [1,1,0,0,0,0|1,0,1]=4 5373 B7R0.4 COCCC[C@H](C)O Amb27396064 [1,1,0,0,0,0|1,0,1]=4 5374 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [1,1,0,0,0,0|2,0,0]=4 5375 B7R0.4 COCCNC(C)=O Amb3358082 [1,1,0,0,0,0|2,0,0]=4 5376 B7R0.4 COCCNC(N)=O Amb1104938 [1,1,0,0,0,0|2,0,0]=4 5377 B7R0.4 COCCOC(=O)Cl Amb2689125 [1,1,0,0,0,0|2,0,0]=4 5378 B7R0.4 COCCOC(C)=O Amb4037074 [1,1,0,0,0,0|2,0,0]=4 5379 B7R0.4 COCCOC(N)=O Amb25054225 [1,1,0,0,0,0|2,0,0]=4 5380 B7R0.4 COCOCC(=O)O Amb28059312 [1,1,0,0,0,0|2,0,0]=4 5381 B7R0.4 COCSCC(=O)O Amb27466837 [1,1,0,0,0,0|2,0,0]=4 5382 B7R0.4 CS(=O)CCCCBr Amb27874454 [1,1,0,0,0,0|2,0,0]=4 5383 B7R0.4 CS(=O)CCCCCl Amb27253421 [1,1,0,0,0,0|2,0,0]=4 5384 B7R0.4 CS(=O)CCCCN Amb17617794 [1,1,0,0,0,0|2,0,0]=4 5385 B7R0.4 CSCCCC(=N)N Amb27829199 [1,1,0,0,0,0|2,0,0]=4 5386 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|1,0,0]=3 5387 B7R0.4 CSCCCC(C)=O Amb25122381 [1,1,0,0,0,0|1,0,0]=3 5388 B7R0.4 CSCCCC(C)Br Amb27798199 [1,1,0,0,0,0|1,0,1]=4 5389 B7R0.4 CSCCCC(C)C Amb28289938 [1,1,0,0,0,0|1,0,1]=4 5390 B7R0.4 CSCCCC(C)N Amb18124381 [1,1,0,0,0,0|1,0,1]=4 5391 B7R0.4 CSCCCC(C)O Amb25958947 [1,1,0,0,0,0|1,0,1]=4 5392 B7R0.4 CSCCCC(N)=S Amb28048945 [1,1,0,0,0,0|1,1,0]=4 5393 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [1,1,0,0,0,0|1,0,1]=4 5394 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [1,1,0,0,0,0|1,0,1]=4 5395 B7R0.4 CSCCC[C@H](C)N Amb33200176 [1,1,0,0,0,0|1,0,1]=4 5396 B7R0.4 CSCCC[C@H](C)O Amb33198288 [1,1,0,0,0,0|1,0,1]=4 5397 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [1,1,0,0,0,0|2,0,0]=4 5398 B7R0.4 CSCCNC(=O)Cl Amb29882959 [1,1,0,0,0,0|2,0,0]=4 5399 B7R0.4 CSCCNC(C)=O Amb8504699 [1,1,0,0,0,0|2,0,0]=4 5400 B7R0.4 CSCCNC(N)=O Amb27424586 [1,1,0,0,0,0|2,0,0]=4 5401 B7R0.4 CSCCSC(C)=O Amb27635033 [1,1,0,0,0,0|2,0,0]=4 5402 B7R0.4 CSCSCC(=O)O Amb27858824 [1,1,0,0,0,0|2,0,0]=4 5403 B7R0.4 CSSCCC(=O)O Amb26848465 [1,1,0,0,0,0|2,0,0]=4 5404 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [1,1,0,0,0,0|1,0,0]=3 5405 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [1,1,0,0,0,0|1,0,0]=3 5406 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [1,1,0,0,0,0|1,0,0]=3 5407 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [1,1,0,0,0,0|1,0,0]=3 5408 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,1,0,0,0,0|1,0,0]=3 5409 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [1,1,0,0,0,0|2,0,0]=4 5410 B7R0.4 C[C@H](F)CCCCO Amb27945000 [1,1,0,0,0,0|0,0,1]=3 5411 B7R0.4 C[C@H](N)CCCCF Amb33480694 [1,1,0,0,0,0|1,0,0]=3 5412 B7R0.4 C[C@H](N)CNCCF Amb27449099 [1,1,0,0,0,0|2,0,0]=4 5413 B7R0.4 C[C@H](O)CCCC#N Amb27979195 [1,1,0,0,0,0|1,0,1]=4 5414 B7R0.4 C[C@H](O)CCCCF Amb33196129 [1,1,0,0,0,0|1,0,0]=3 5415 B7R0.4 C[C@H](O)CCCCO Amb28381637 [1,1,0,0,0,0|0,0,1]=3 5416 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [1,1,0,0,0,0|0,0,2]=4 5417 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,1,0,0,0,0|0,0,2]=4 5418 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,1,0,0,0,0|0,0,2]=4 5419 B7R0.4 C\C=C\CCC(C)Br Amb25889216 [1,1,0,0,0,0|1,0,1]=4 5420 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,1]=4 5421 B7R0.4 C\C=C\CCC(C)N Amb27838292 [1,1,0,0,0,0|1,0,1]=4 5422 B7R0.4 C\C=C\CCC(C)O Amb32665057 [1,1,0,0,0,0|1,0,1]=4 5423 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [1,1,0,0,0,0|1,0,1]=4 5424 B7R0.4 N#CCCCC(=O)O Amb33542831 [1,1,0,0,0,0|1,0,1]=4 5425 B7R0.4 N=C(N)CCCCBr Amb4297024 [1,1,0,0,0,0|2,0,0]=4 5426 B7R0.4 N=C(N)CCCCCl Amb4297063 [1,1,0,0,0,0|2,0,0]=4 5427 B7R0.4 N=C(N)CCCCF Amb27486600 [1,1,0,0,0,0|2,0,0]=4 5428 B7R0.4 N=C(N)CCCCN Amb25714813 [1,1,0,0,0,0|2,0,0]=4 5429 B7R0.4 N=C(N)CCCCN Amb33299438 [1,1,0,0,0,0|2,0,0]=4 5430 B7R0.4 NC(=O)CCCCBr Amb27875083 [1,1,0,0,0,0|1,0,0]=3 5431 B7R0.4 NC(=O)CCCCCl Amb7782532 [1,1,0,0,0,0|1,0,0]=3 5432 B7R0.4 NC(=O)CCCCO Amb3939470 [1,1,0,0,0,0|1,0,0]=3 5433 B7R0.4 NC(=O)CCCCS Amb27839239 [1,1,0,0,0,0|1,0,0]=3 5434 B7R0.4 NC(=O)CCSCCl Amb27430706 [1,1,0,0,0,0|2,0,0]=4 5435 B7R0.4 NC(=O)CNCCO Amb6714605 [1,1,0,0,0,0|2,0,0]=4 5436 B7R0.4 NC(=O)COCCBr Amb25133475 [1,1,0,0,0,0|2,0,0]=4 5437 B7R0.4 NC(=O)COCCCl Amb5722397 [1,1,0,0,0,0|2,0,0]=4 5438 B7R0.4 NC(=O)CSCCBr Amb28193514 [1,1,0,0,0,0|2,0,0]=4 5439 B7R0.4 NC(=O)CSCCO Amb6754148 [1,1,0,0,0,0|2,0,0]=4 5440 B7R0.4 NC(=O)CSCCS Amb27651871 [1,1,0,0,0,0|2,0,0]=4 5441 B7R0.4 NC(=O)NCCCF Amb27396406 [1,1,0,0,0,0|2,0,0]=4 5442 B7R0.4 NC(=O)NCCCO Amb9248133 [1,1,0,0,0,0|2,0,0]=4 5443 B7R0.4 NC(=O)OCCCBr Amb28316236 [1,1,0,0,0,0|2,0,0]=4 5444 B7R0.4 NC(=S)CCCCBr Amb27622634 [1,1,0,0,0,0|1,1,0]=4 5445 B7R0.4 NC(=S)CCCCCl Amb25177620 [1,1,0,0,0,0|1,1,0]=4 5446 B7R0.4 NCCCCC(=O)Cl Amb26599615 [1,1,0,0,0,0|1,0,0]=3 5447 B7R0.4 NCCCCC(=O)O Amb2780021 [1,1,0,0,0,0|1,0,0]=3 5448 B7R0.4 NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|1,0,0]=3 5449 B7R0.4 NCCCCC(=O)O Amb9825855 [1,1,0,0,0,0|1,0,0]=3 5450 B7R0.4 NCCCCC(F)F Amb32812804 [1,1,0,0,0,0|2,0,0]=4 5451 B7R0.4 NCCCCC(N)=O Amb18641897 [1,1,0,0,0,0|1,0,0]=3 5452 B7R0.4 NCCCCC(N)=O Amb33552086 [1,1,0,0,0,0|1,0,0]=3 5453 B7R0.4 NCCCCS(=O)O Amb27882127 [1,1,0,0,0,0|2,0,0]=4 5454 B7R0.4 NCCCNC(=O)O Amb24093884 [1,1,0,0,0,0|2,0,0]=4 5455 B7R0.4 NCCCNC(=O)S Amb27839485 [1,1,0,0,0,0|2,0,0]=4 5456 B7R0.4 NCCCNC(N)=O Amb18296186 [1,1,0,0,0,0|2,0,0]=4 5457 B7R0.4 NCCCNC(N)=O Amb20622408 [1,1,0,0,0,0|2,0,0]=4 5458 B7R0.4 NCCCOC(N)=O Amb26334419 [1,1,0,0,0,0|2,0,0]=4 5459 B7R0.4 NCCCOC(N)=O Amb33299259 [1,1,0,0,0,0|2,0,0]=4 5460 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|2,0,0]=4 5461 B7R0.4 NCCNCC(=O)O Amb33339058 [1,1,0,0,0,0|2,0,0]=4 5462 B7R0.4 NCCNCC(N)=O Amb28388338 [1,1,0,0,0,0|2,0,0]=4 5463 B7R0.4 NCCOCC(=O)O Amb18630146 [1,1,0,0,0,0|2,0,0]=4 5464 B7R0.4 NCCOCC(=O)O Amb33550947 [1,1,0,0,0,0|2,0,0]=4 5465 B7R0.4 NCCOCC(N)=O Amb18523830 [1,1,0,0,0,0|2,0,0]=4 5466 B7R0.4 NCCOCC(N)=O Amb33549549 [1,1,0,0,0,0|2,0,0]=4 5467 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|2,0,0]=4 5468 B7R0.4 NCCSCC(=O)O Amb20622325 [1,1,0,0,0,0|2,0,0]=4 5469 B7R0.4 NCCSCC(N)=O Amb6266329 [1,1,0,0,0,0|2,0,0]=4 5470 B7R0.4 NOCCCC(=O)O Amb10975956 [1,1,0,0,0,0|2,0,0]=4 5471 B7R0.4 NOCCCC(=O)O Amb22011795 [1,1,0,0,0,0|2,0,0]=4 5472 B7R0.4 NOCCCC(=O)O Amb31283653 [1,1,0,0,0,0|2,0,0]=4 5473 B7R0.4 NS(=O)CCCCCl Amb32720307 [1,1,0,0,0,0|2,0,0]=4 5474 B7R0.4 NS(=O)CCCCF Amb32720393 [1,1,0,0,0,0|2,0,0]=4 5475 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [1,1,0,0,0,0|1,0,0]=3 5476 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [1,1,0,0,0,0|1,0,0]=3 5477 B7R0.4 O=C(Cl)COCCCl Amb17610887 [1,1,0,0,0,0|2,0,0]=4 5478 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [1,1,0,0,0,0|2,0,0]=4 5479 B7R0.4 O=C(Cl)NCCCF Amb35633310 [1,1,0,0,0,0|2,0,0]=4 5480 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [1,1,0,0,0,0|2,0,0]=4 5481 B7R0.4 O=C(Cl)OCCCF Amb26994902 [1,1,0,0,0,0|2,0,0]=4 5482 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,1,0,0,0,0|1,0,0]=3 5483 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,1,0,0,0,0|1,0,0]=3 5484 B7R0.4 O=C(O)CCCCF Amb26639920 [1,1,0,0,0,0|1,0,0]=3 5485 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|1,0,0]=3 5486 B7R0.4 O=C(O)CCCCS Amb17503767 [1,1,0,0,0,0|1,0,0]=3 5487 B7R0.4 O=C(O)CCCNCl Amb27173950 [1,1,0,0,0,0|2,0,0]=4 5488 B7R0.4 O=C(O)CNCCF Amb28076282 [1,1,0,0,0,0|2,0,0]=4 5489 B7R0.4 O=C(O)CNCCO Amb9325653 [1,1,0,0,0,0|2,0,0]=4 5490 B7R0.4 O=C(O)COCCCl Amb21857870 [1,1,0,0,0,0|2,0,0]=4 5491 B7R0.4 O=C(O)COCCF Amb27866609 [1,1,0,0,0,0|2,0,0]=4 5492 B7R0.4 O=C(O)COCCO Amb6680914 [1,1,0,0,0,0|2,0,0]=4 5493 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,1,0,0,0,0|2,0,0]=4 5494 B7R0.4 O=C([O-])CCCCF Amb33527827 [1,1,0,0,0,0|1,0,0]=3 5495 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,1,0,0,0,0|1,0,0]=3 5496 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,1,0,0,0,0|1,0,0]=3 5497 B7R0.4 O=C([O-])COCCO Amb33553026 [1,1,0,0,0,0|2,0,0]=4 5498 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,1,0,0,0,0|1,0,1]=4 5499 B7R0.4 O=CCCCC(F)F Amb25243487 [1,1,0,0,0,0|1,0,0]=3 5500 B7R0.4 O=CCCCC(O)O Amb25889261 [1,1,0,0,0,0|1,0,0]=3 5501 B7R0.4 O=S(Cl)CCCCCl Amb32720306 [1,1,0,0,0,0|2,0,0]=4 5502 B7R0.4 O=S(Cl)CCCCF Amb32720392 [1,1,0,0,0,0|2,0,0]=4 5503 B7R0.4 O=S([O-])CCCCCl Amb28400114 [1,1,0,0,0,0|2,0,0]=4 5504 B7R0.4 O=S([O-])CCCCF Amb32754733 [1,1,0,0,0,0|2,0,0]=4 5505 B7R0.4 O=S([O-])CCCCO Amb27181023 [1,1,0,0,0,0|2,0,0]=4 5506 B7R0.4 O=[N+]([O-])CCCCF Amb33171716 [1,1,0,0,0,0|2,0,0]=4 5507 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [1,1,0,0,0,0|2,0,0]=4 5508 B7R0.4 OC(Cl)CCCCCl Amb27410884 [1,1,0,0,0,0|1,0,1]=4 5509 B7R0.4 [C-]#[N+]CCCC(C)C Amb27792444 [1,1,0,0,0,0|1,0,1]=4 5510 B7R0.7 C#CCC(C)CCC Amb33321138 [1,1,0,0,0,0|0,0,2]=4 5511 B7R0.7 C#CC[C@H](O)CCC Amb27950875 [1,1,0,0,0,0|0,0,2]=4 5512 B7R0.7 C=C(CCC)CCC Amb25088297 [1,1,0,0,0,0|0,0,2]=4 5513 B7R0.7 C=C(CCC)CCN Amb33374808 [1,1,0,0,0,0|1,0,1]=4 5514 B7R0.7 C=C(CCC)CCO Amb27642086 [1,1,0,0,0,0|0,0,2]=4 5515 B7R0.7 C=CCC(C)CCBr Amb25211241 [1,1,0,0,0,0|1,0,1]=4 5516 B7R0.7 C=CCC(C)CCC Amb26958532 [1,1,0,0,0,0|0,0,1]=3 5517 B7R0.7 C=CCC(C)CCCl Amb32688175 [1,1,0,0,0,0|1,0,1]=4 5518 B7R0.7 C=CCC(C)CCN Amb27596627 [1,1,0,0,0,0|1,0,1]=4 5519 B7R0.7 C=CCC(C)CCO Amb27603507 [1,1,0,0,0,0|1,0,1]=4 5520 B7R0.7 C=CCC(N)COC Amb19018008 [1,1,0,0,0,0|1,0,1]=4 5521 B7R0.7 C=CCC(O)CCBr Amb27669769 [1,1,0,0,0,0|1,0,1]=4 5522 B7R0.7 C=CCC(O)CCC Amb4019981 [1,1,0,0,0,0|0,0,1]=3 5523 B7R0.7 C=CCC(O)CCN Amb27839044 [1,1,0,0,0,0|1,0,1]=4 5524 B7R0.7 C=CCC(O)CSC Amb27463975 [1,1,0,0,0,0|1,0,1]=4 5525 B7R0.7 C=CC[C@@H](N)CCO Amb27398150 [1,1,0,0,0,0|1,0,1]=4 5526 B7R0.7 C=CC[C@@H](N)COC Amb28128126 [1,1,0,0,0,0|1,0,1]=4 5527 B7R0.7 C=CC[C@@H](O)CCC Amb28315693 [1,1,0,0,0,0|0,0,1]=3 5528 B7R0.7 C=CC[C@H](N)COC Amb27851131 [1,1,0,0,0,0|1,0,1]=4 5529 B7R0.7 C=CC[C@H](O)CCC Amb27221895 [1,1,0,0,0,0|0,0,1]=3 5530 B7R0.7 C=COC(O)CCC Amb27222270 [1,1,0,0,0,0|1,0,1]=4 5531 B7R0.7 CC(CC=O)CC=O Amb17593183 [1,1,0,0,0,0|1,0,1]=4 5532 B7R0.7 CC(CCBr)CCBr Amb8515114 [1,1,0,0,0,0|2,0,0]=4 5533 B7R0.7 CC(CCCl)CCCl Amb26942744 [1,1,0,0,0,0|2,0,0]=4 5534 B7R0.7 CC(CCI)CCI Amb24483140 [1,1,0,0,0,0|2,0,0]=4 5535 B7R0.7 CC(CCN)CCBr Amb28122972 [1,1,0,0,0,0|2,0,0]=4 5536 B7R0.7 CC(CCN)CCF Amb33196462 [1,1,0,0,0,0|2,0,0]=4 5537 B7R0.7 CC(CCN)CCN Amb25138224 [1,1,0,0,0,0|2,0,0]=4 5538 B7R0.7 CC(CCN)CCO Amb17569905 [1,1,0,0,0,0|1,0,1]=4 5539 B7R0.7 CC(CCO)CCI Amb25262818 [1,1,0,0,0,0|1,0,1]=4 5540 B7R0.7 CC(CCO)CCO Amb17939001 [1,1,0,0,0,0|1,0,1]=4 5541 B7R0.7 CCCC(=O)CC=N Amb28049020 [1,1,0,0,0,0|1,0,1]=4 5542 B7R0.7 CCCC(=O)CCBr Amb27845324 [1,1,0,0,0,0|1,0,1]=4 5543 B7R0.7 CCCC(=O)CCC Amb6608653 [1,1,0,0,0,0|0,0,2]=4 5544 B7R0.7 CCCC(=O)CCCl Amb17593421 [1,1,0,0,0,0|1,0,1]=4 5545 B7R0.7 CCCC(=O)CCN Amb25104618 [1,1,0,0,0,0|1,0,1]=4 5546 B7R0.7 CCCC(Br)CCC Amb8968455 [1,1,0,0,0,0|0,0,1]=3 5547 B7R0.7 CCCC(Br)CCCl Amb27472207 [1,1,0,0,0,0|1,0,0]=3 5548 B7R0.7 CCCC(Br)N=C=O Amb27590951 [1,1,0,0,0,0|1,0,1]=4 5549 B7R0.7 CCCC(Br)\C=C\O Amb28458444 [1,1,0,0,0,0|0,0,2]=4 5550 B7R0.7 CCCC(C)CC#N Amb26515743 [1,1,0,0,0,0|1,0,1]=4 5551 B7R0.7 CCCC(C)CC=S Amb22168291 [1,1,0,0,0,0|0,1,0]=3 5552 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,0]=3 5553 B7R0.7 CCCC(C)CCC Amb22229829 [1,1,0,0,0,0|0,0,1]=3 5554 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,0]=3 5555 B7R0.7 CCCC(C)CCN Amb31145475 [1,1,0,0,0,0|1,0,0]=3 5556 B7R0.7 CCCC(C)CCN Amb839082 [1,1,0,0,0,0|1,0,0]=3 5557 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,1]=3 5558 B7R0.7 CCCC(C)CCS Amb33320804 [1,1,0,0,0,0|0,1,0]=3 5559 B7R0.7 CCCC(C)CNC Amb33330634 [1,1,0,0,0,0|1,0,1]=4 5560 B7R0.7 CCCC(C)CNC Amb6719001 [1,1,0,0,0,0|1,0,1]=4 5561 B7R0.7 CCCC(C)CNN Amb6744626 [1,1,0,0,0,0|2,0,0]=4 5562 B7R0.7 CCCC(C)CNO Amb26632405 [1,1,0,0,0,0|1,0,1]=4 5563 B7R0.7 CCCC(C)CON Amb27630051 [1,1,0,0,0,0|2,0,0]=4 5564 B7R0.7 CCCC(C)N=C=O Amb21961819 [1,1,0,0,0,0|1,0,1]=4 5565 B7R0.7 CCCC(C)NC=O Amb27236942 [1,1,0,0,0,0|1,0,0]=3 5566 B7R0.7 CCCC(C)NCC Amb22586730 [1,1,0,0,0,0|1,0,1]=4 5567 B7R0.7 CCCC(C)NCC Amb9726218 [1,1,0,0,0,0|1,0,1]=4 5568 B7R0.7 CCCC(C)OCC Amb22733741 [1,1,0,0,0,0|1,0,1]=4 5569 B7R0.7 CCCC(Cl)CSC Amb27966841 [1,1,0,0,0,0|1,0,1]=4 5570 B7R0.7 CCCC(F)CCN Amb25869704 [1,1,0,0,0,0|1,0,0]=3 5571 B7R0.7 CCCC(F)CCO Amb27662632 [1,1,0,0,0,0|0,0,1]=3 5572 B7R0.7 CCCC(N)CC#N Amb27960346 [1,1,0,0,0,0|1,0,1]=4 5573 B7R0.7 CCCC(N)CCC Amb1102706 [1,1,0,0,0,0|0,0,1]=3 5574 B7R0.7 CCCC(N)CCN Amb27838332 [1,1,0,0,0,0|1,0,0]=3 5575 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|0,0,1]=3 5576 B7R0.7 CCCC(N)CSC Amb18313615 [1,1,0,0,0,0|1,0,1]=4 5577 B7R0.7 CCCC(O)CCC Amb4035747 [1,1,0,0,0,0|0,0,1]=3 5578 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|1,0,0]=3 5579 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|0,0,1]=3 5580 B7R0.7 CCCC(O)CNC Amb18314672 [1,1,0,0,0,0|1,0,1]=4 5581 B7R0.7 CCCC(O)CNN Amb28316120 [1,1,0,0,0,0|2,0,0]=4 5582 B7R0.7 CCCC(O)COC Amb28347497 [1,1,0,0,0,0|1,0,1]=4 5583 B7R0.7 CCCC(O)\C=C\F Amb27981709 [1,1,0,0,0,0|1,0,1]=4 5584 B7R0.7 CCCC(S)CC=O Amb24481552 [1,1,0,0,0,0|0,0,0]=2 5585 B7R0.7 CCCC(S)CCC Amb7784733 [1,1,0,0,0,0|0,0,1]=3 5586 B7R0.7 CCCN(C)CCBr Amb18178281 [1,1,0,0,0,0|2,0,0]=4 5587 B7R0.7 CCCN(C)CCC Amb9787750 [1,1,0,0,0,0|1,0,1]=4 5588 B7R0.7 CCCN(C)CCCl Amb17334148 [1,1,0,0,0,0|2,0,0]=4 5589 B7R0.7 CCCN(C)CCF Amb27951092 [1,1,0,0,0,0|2,0,0]=4 5590 B7R0.7 CCCN(C)CCN Amb8898636 [1,1,0,0,0,0|2,0,0]=4 5591 B7R0.7 CCCN(C)CCO Amb3204757 [1,1,0,0,0,0|1,0,1]=4 5592 B7R0.7 CCCN(N)CCC Amb17593208 [1,1,0,0,0,0|1,0,1]=4 5593 B7R0.7 CCCN(N)CCO Amb27424310 [1,1,0,0,0,0|1,0,1]=4 5594 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|1,0,1]=4 5595 B7R0.7 CCCS(=O)CCC Amb6366329 [1,1,0,0,0,0|1,0,1]=4 5596 B7R0.7 CCC[C@@H](C)CC=O Amb27393066 [1,1,0,0,0,0|0,0,0]=2 5597 B7R0.7 CCC[C@@H](C)CCBr Amb28363763 [1,1,0,0,0,0|1,0,0]=3 5598 B7R0.7 CCC[C@@H](C)N=C=O Amb28128423 [1,1,0,0,0,0|1,0,1]=4 5599 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|0,0,1]=3 5600 B7R0.7 CCC[C@@H](N)CNC Amb27452197 [1,1,0,0,0,0|1,0,1]=4 5601 B7R0.7 CCC[C@@H](O)CCN Amb33204237 [1,1,0,0,0,0|1,0,0]=3 5602 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|0,0,1]=3 5603 B7R0.7 CCC[C@H](N)CC#N Amb28241461 [1,1,0,0,0,0|1,0,1]=4 5604 B7R0.7 CCC[C@H](N)CCO Amb25889377 [1,1,0,0,0,0|0,0,1]=3 5605 B7R0.7 CCC[C@H](N)CCO Amb32409602 [1,1,0,0,0,0|0,0,1]=3 5606 B7R0.7 CCC[C@H](N)COC Amb28316177 [1,1,0,0,0,0|1,0,1]=4 5607 B7R0.7 CCC[C@H](N)CSC Amb28206579 [1,1,0,0,0,0|1,0,1]=4 5608 B7R0.7 CCC[C@H](O)CCN Amb33204238 [1,1,0,0,0,0|1,0,0]=3 5609 B7R0.7 CCC[PH](=O)CCC Amb26366296 [1,1,0,0,0,0|1,0,1]=4 5610 B7R0.7 CCC\C(Br)=C/C=O Amb28252419 [1,1,0,0,0,0|0,0,2]=4 5611 B7R0.7 CCC\C(C)=C\C=O Amb27237056 [1,1,0,0,0,0|0,0,2]=4 5612 B7R0.7 CCNC(C)CCO Amb8428187 [1,1,0,0,0,0|1,0,1]=4 5613 B7R0.7 CCOC(=O)CC=O Amb8394868 [1,1,0,0,0,0|1,0,1]=4 5614 B7R0.7 CCOC(C)CC=O Amb25702447 [1,1,0,0,0,0|1,0,0]=3 5615 B7R0.7 CCOC(C)CCBr Amb28123922 [1,1,0,0,0,0|2,0,0]=4 5616 B7R0.7 CCOC(C)CCN Amb19022809 [1,1,0,0,0,0|2,0,0]=4 5617 B7R0.7 CCOC(C)CCO Amb4017406 [1,1,0,0,0,0|1,0,1]=4 5618 B7R0.7 CCOC(C)CCS Amb33424966 [1,1,0,0,0,0|1,1,0]=4 5619 B7R0.7 CCOC(C)NC=O Amb27391666 [1,1,0,0,0,0|2,0,0]=4 5620 B7R0.7 CCSC(C)CC=O Amb22232285 [1,1,0,0,0,0|1,0,0]=3 5621 B7R0.7 CCSC(C)CCCl Amb27880855 [1,1,0,0,0,0|2,0,0]=4 5622 B7R0.7 CCSC(C)CCO Amb26655908 [1,1,0,0,0,0|1,0,1]=4 5623 B7R0.7 CNCC(C)CCN Amb17334067 [1,1,0,0,0,0|2,0,0]=4 5624 B7R0.7 CNCC(C)CCO Amb17569901 [1,1,0,0,0,0|1,0,1]=4 5625 B7R0.7 CNCC(O)CCF Amb33196461 [1,1,0,0,0,0|2,0,0]=4 5626 B7R0.7 CNCC(O)CCN Amb18559793 [1,1,0,0,0,0|2,0,0]=4 5627 B7R0.7 CNCC(O)CCO Amb27593318 [1,1,0,0,0,0|1,0,1]=4 5628 B7R0.7 COCC(Br)CCN Amb27218920 [1,1,0,0,0,0|2,0,0]=4 5629 B7R0.7 COCC(C)CCBr Amb28187454 [1,1,0,0,0,0|2,0,0]=4 5630 B7R0.7 COCC(C)CCCl Amb26515746 [1,1,0,0,0,0|2,0,0]=4 5631 B7R0.7 COCC(C)CCN Amb17569914 [1,1,0,0,0,0|2,0,0]=4 5632 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|1,0,1]=4 5633 B7R0.7 COCC(C)NC=O Amb27838341 [1,1,0,0,0,0|2,0,0]=4 5634 B7R0.7 COCC(Cl)CCO Amb28454426 [1,1,0,0,0,0|1,0,1]=4 5635 B7R0.7 COCC(F)CCN Amb27397139 [1,1,0,0,0,0|2,0,0]=4 5636 B7R0.7 COCC(N)CCCl Amb28207136 [1,1,0,0,0,0|2,0,0]=4 5637 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|1,0,1]=4 5638 B7R0.7 COCC(O)CCN Amb18203347 [1,1,0,0,0,0|2,0,0]=4 5639 B7R0.7 COC[C@@H](N)CCO Amb27964057 [1,1,0,0,0,0|1,0,1]=4 5640 B7R0.7 COC[C@@H](O)CCN Amb24474146 [1,1,0,0,0,0|2,0,0]=4 5641 B7R0.7 COC[C@H](O)CCN Amb27650451 [1,1,0,0,0,0|2,0,0]=4 5642 B7R0.7 CSCC(C)CCN Amb33272059 [1,1,0,0,0,0|2,0,0]=4 5643 B7R0.7 CSCC(F)CCN Amb33225468 [1,1,0,0,0,0|2,0,0]=4 5644 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|1,0,1]=4 5645 B7R0.7 CSCC(O)CCN Amb25078322 [1,1,0,0,0,0|2,0,0]=4 5646 B7R0.7 CSC[C@@H](O)CCN Amb33271743 [1,1,0,0,0,0|2,0,0]=4 5647 B7R0.7 CSC[C@H](O)CCN Amb33271745 [1,1,0,0,0,0|2,0,0]=4 5648 B7R0.7 C\C=C\C(Br)CCC Amb17672603 [1,1,0,0,0,0|1,0,1]=4 5649 B7R0.7 C\C=C\C(C)CC=O Amb25366468 [1,1,0,0,0,0|0,0,2]=4 5650 B7R0.7 C\C=C\C(C)CCC Amb26633016 [1,1,0,0,0,0|1,0,1]=4 5651 B7R0.7 C\C=C\[C@@H](C)CC=O Amb27791915 [1,1,0,0,0,0|0,0,2]=4 5652 B7R0.7 ClC(CCBr)CCBr Amb27983162 [1,1,0,0,0,0|2,0,0]=4 5653 B7R0.7 NC(CCBr)CCBr Amb27953786 [1,1,0,0,0,0|2,0,0]=4 5654 B7R0.7 NC(CCCl)CCCl Amb17593888 [1,1,0,0,0,0|2,0,0]=4 5655 B7R0.7 NC(CCO)CCF Amb32946596 [1,1,0,0,0,0|1,0,1]=4 5656 B7R0.7 NC(CCO)CCO Amb25324048 [1,1,0,0,0,0|1,0,1]=4 5657 B7R0.7 NCCC(F)CCF Amb33196409 [1,1,0,0,0,0|2,0,0]=4 5658 B7R0.7 NCCC(N)CCN Amb18641937 [1,1,0,0,0,0|2,0,0]=4 5659 B7R0.7 NCCC(O)CCF Amb33196467 [1,1,0,0,0,0|2,0,0]=4 5660 B7R0.7 NCCC(O)CCN Amb25890416 [1,1,0,0,0,0|2,0,0]=4 5661 B7R0.7 NCCC(O)CCO Amb27876317 [1,1,0,0,0,0|1,0,1]=4 5662 B7R0.7 NCC[C@@H](O)CCF Amb33196425 [1,1,0,0,0,0|2,0,0]=4 5663 B7R0.7 NCC[C@@H](O)CCO Amb28187429 [1,1,0,0,0,0|1,0,1]=4 5664 B7R0.7 NCC[C@H](O)CCF Amb33196424 [1,1,0,0,0,0|2,0,0]=4 5665 B7R0.7 O=CCC(=O)CCO Amb28255739 [1,1,0,0,0,0|1,0,1]=4 5666 B7R0.7 OCCC(O)CCO Amb17593226 [1,1,0,0,0,0|1,0,1]=4 5667 B7R0.7 [C-]#[N+]CC(C)CCC Amb33322331 [1,1,0,0,0,0|1,0,1]=4 5668 B7R0.7 [C-]#[N+]CC(F)CCC Amb27421865 [1,1,0,0,0,0|1,0,1]=4 5669 B9R0.4 C#CCCC(O)CC(C)C Amb28060574 [0,2,0,0,0,0|1,0,1]=4 5670 B9R0.4 C#CCC[C@H](O)C[C@H](C)O Amb27241817 [0,2,0,0,0,0|1,0,1]=4 5671 B9R0.4 C=C(Br)CC(O)CCCO Amb27641988 [0,2,0,0,0,0|2,0,0]=4 5672 B9R0.4 C=C(Br)CN(C)CCCC Amb27831854 [0,2,0,0,0,0|2,0,0]=4 5673 B9R0.4 C=C(C)CC(N)CCSC Amb27779574 [0,2,0,0,0,0|2,0,0]=4 5674 B9R0.4 C=C(C)CC(O)CCCC Amb27221835 [0,2,0,0,0,0|1,0,0]=3 5675 B9R0.4 C=C(C)CC(O)CCCCl Amb27648663 [0,2,0,0,0,0|2,0,0]=4 5676 B9R0.4 C=C(C)CC(O)CCSC Amb27805568 [0,2,0,0,0,0|2,0,0]=4 5677 B9R0.4 C=C(C)CC(O)COCC Amb27960730 [0,2,0,0,0,0|2,0,0]=4 5678 B9R0.4 C=C(CCCC)CC(=O)O Amb18643896 [0,2,0,0,0,0|0,0,1]=3 5679 B9R0.4 C=CCCC(=O)CC(C)N Amb27391413 [0,2,0,0,0,0|1,0,1]=4 5680 B9R0.4 C=CCCC(C)CC(C)=O Amb24738371 [0,2,0,0,0,0|0,0,2]=4 5681 B9R0.4 C=CCCC(C)CC(C)Br Amb27979017 [0,2,0,0,0,0|1,0,0]=3 5682 B9R0.4 C=CCCC(C)CC(C)Cl Amb27405984 [0,2,0,0,0,0|1,0,0]=3 5683 B9R0.4 C=CCCC(C)CC(C)O Amb27196621 [0,2,0,0,0,0|1,0,0]=3 5684 B9R0.4 C=CCCC(N)CC(=O)O Amb22641959 [0,2,0,0,0,0|0,0,2]=4 5685 B9R0.4 C=CCCC(N)CC(=O)O Amb31307612 [0,2,0,0,0,0|0,0,2]=4 5686 B9R0.4 C=CCCC(N)CC(C)C Amb27252009 [0,2,0,0,0,0|1,0,0]=3 5687 B9R0.4 C=CCCC(N)CC(N)=O Amb25367476 [0,2,0,0,0,0|0,0,2]=4 5688 B9R0.4 C=CCCC(N)CN(C)C Amb27218034 [0,2,0,0,0,0|2,0,0]=4 5689 B9R0.4 C=CCCC(O)CN(C)C Amb27946208 [0,2,0,0,0,0|2,0,0]=4 5690 B9R0.4 C=CCCN(C)C[C@@H](C)N Amb27777732 [0,2,0,0,0,0|2,0,0]=4 5691 B9R0.4 C=CCC[C@@H](C)CC(=O)O Amb27390713 [0,2,0,0,0,0|0,0,2]=4 5692 B9R0.4 C=CCC[C@@H](O)CC(C)=O Amb28122093 [0,2,0,0,0,0|0,0,2]=4 5693 B9R0.4 C=CCC[C@H](N)CC(=O)O Amb10066917 [0,2,0,0,0,0|0,0,2]=4 5694 B9R0.4 C=CCC[C@H](O)C[C@H](C)O Amb27198026 [0,2,0,0,0,0|1,0,0]=3 5695 B9R0.4 C=CCNC(C)CC(C)Cl Amb27645028 [0,2,0,0,0,0|2,0,0]=4 5696 B9R0.4 C=CCOC(Cl)CC(C)C Amb27837875 [0,2,0,0,0,0|2,0,0]=4 5697 B9R0.4 CC#CCC(C)CC(C)=O Amb27839057 [0,2,0,0,0,0|0,0,2]=4 5698 B9R0.4 CC(=O)CC(C)CCC=O Amb27838122 [0,2,0,0,0,0|0,0,1]=3 5699 B9R0.4 CC(=O)C[C@@H](O)CCC#N Amb26599245 [0,2,0,0,0,0|1,0,1]=4 5700 B9R0.4 CC(=O)C[C@H](O)CCC#N Amb28314339 [0,2,0,0,0,0|1,0,1]=4 5701 B9R0.4 CC(=O)NC(C)CCCO Amb28120258 [0,2,0,0,0,0|2,0,0]=4 5702 B9R0.4 CC(C)CC(=O)CCC=O Amb18643908 [0,2,0,0,0,0|0,0,1]=3 5703 B9R0.4 CC(C)CC(=O)NCC=O Amb17102059 [0,2,0,0,0,0|1,0,1]=4 5704 B9R0.4 CC(C)CC(C)CCC#N Amb18643472 [0,2,0,0,0,0|1,0,1]=4 5705 B9R0.4 CC(C)CC(C)CCCBr Amb24064688 [0,2,0,0,0,0|1,0,1]=4 5706 B9R0.4 CC(C)CC(C)CCCCl Amb24432723 [0,2,0,0,0,0|1,0,1]=4 5707 B9R0.4 CC(C)CC(C)CCNN Amb27806390 [0,2,0,0,0,0|2,0,0]=4 5708 B9R0.4 CC(C)CC(C)OCC=O Amb27809027 [0,2,0,0,0,0|1,0,0]=3 5709 B9R0.4 CC(C)CC(F)CN=C=O Amb27816702 [0,2,0,0,0,0|1,0,1]=4 5710 B9R0.4 CC(C)CC(O)CCC#N Amb27761590 [0,2,0,0,0,0|1,0,1]=4 5711 B9R0.4 CC(C)CC(O)CCC=O Amb27436100 [0,2,0,0,0,0|0,0,0]=2 5712 B9R0.4 CC(C)CC(O)CCCF Amb27410874 [0,2,0,0,0,0|1,0,1]=4 5713 B9R0.4 CC(C)CC(O)CCCO Amb27791444 [0,2,0,0,0,0|0,0,2]=4 5714 B9R0.4 CC(C)C[C@H](C)CCC=O Amb28387940 [0,2,0,0,0,0|0,0,0]=2 5715 B9R0.4 CC(C)NC(=O)CCC=O Amb28454647 [0,2,0,0,0,0|1,0,1]=4 5716 B9R0.4 CC(C)OC(=O)CCC=O Amb25779080 [0,2,0,0,0,0|1,0,1]=4 5717 B9R0.4 CC(CC(=O)O)NCCF Amb28144859 [0,2,0,0,0,0|2,0,0]=4 5718 B9R0.4 CC(CC(=O)O)NCCO Amb9398895 [0,2,0,0,0,0|2,0,0]=4 5719 B9R0.4 CC(CC(=O)O)SCCN Amb18788220 [0,2,0,0,0,0|2,0,0]=4 5720 B9R0.4 CC(CC(=O)O)SCCO Amb9481722 [0,2,0,0,0,0|2,0,0]=4 5721 B9R0.4 CC(CCC=O)CC(=O)O Amb28251065 [0,2,0,0,0,0|1,0,1]=4 5722 B9R0.4 CC(CCCCl)CC(=O)O Amb18646190 [0,2,0,0,0,0|1,0,0]=3 5723 B9R0.4 CC(CCCO)CC(=O)O Amb28050163 [0,2,0,0,0,0|1,0,0]=3 5724 B9R0.4 CC(CCCS)CC(=O)O Amb27443015 [0,2,0,0,0,0|1,0,0]=3 5725 B9R0.4 CC(CNC=O)CN(C)C Amb28078206 [0,2,0,0,0,0|2,0,0]=4 5726 B9R0.4 CC(O)CC(C)CNC=O Amb27215027 [0,2,0,0,0,0|1,0,0]=3 5727 B9R0.4 CCC#CC(C)CC(=O)O Amb28050086 [0,2,0,0,0,0|0,0,2]=4 5728 B9R0.4 CCC#C[C@@H](C)CC(=O)O Amb27216422 [0,2,0,0,0,0|0,0,2]=4 5729 B9R0.4 CCC#C[C@H](C)CC(=O)O Amb27174782 [0,2,0,0,0,0|0,0,2]=4 5730 B9R0.4 CCCCC(=O)CC(C)=O Amb9775080 [0,2,0,0,0,0|0,0,1]=3 5731 B9R0.4 CCCCC(=O)CC(N)=S Amb27590363 [0,2,0,0,0,0|0,1,1]=4 5732 B9R0.4 CCCCC(=O)NC(N)=O Amb28050036 [0,2,0,0,0,0|1,0,1]=4 5733 B9R0.4 CCCCC(=O)OC(C)=O Amb34916560 [0,2,0,0,0,0|1,0,1]=4 5734 B9R0.4 CCCCC(=S)NC(C)=O Amb28341039 [0,2,0,0,0,0|1,0,1]=4 5735 B9R0.4 CCCCC(C)CC(=O)O Amb6740296 [0,2,0,0,0,0|0,0,0]=2 5736 B9R0.4 CCCCC(C)CC(C)Cl Amb27972096 [0,2,0,0,0,0|1,0,1]=4 5737 B9R0.4 CCCCC(C)CC(C)N Amb27618079 [0,2,0,0,0,0|1,0,1]=4 5738 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [0,2,0,0,0,0|0,0,2]=4 5739 B9R0.4 CCCCC(C)CC(Cl)Cl Amb28239773 [0,2,0,0,0,0|1,0,1]=4 5740 B9R0.4 CCCCC(C)CC(N)=O Amb24761512 [0,2,0,0,0,0|0,0,0]=2 5741 B9R0.4 CCCCC(C)NC(=N)N Amb27790523 [0,2,0,0,0,0|2,0,0]=4 5742 B9R0.4 CCCCC(C)NC(C)=O Amb27487886 [0,2,0,0,0,0|1,0,0]=3 5743 B9R0.4 CCCCC(C)OC(=O)Cl Amb32654980 [0,2,0,0,0,0|1,0,0]=3 5744 B9R0.4 CCCCC(C)OC(C)=O Amb27594424 [0,2,0,0,0,0|1,0,0]=3 5745 B9R0.4 CCCCC(C)OC(N)=O Amb28050035 [0,2,0,0,0,0|1,0,0]=3 5746 B9R0.4 CCCCC(Cl)CC(C)C Amb27758354 [0,2,0,0,0,0|1,0,1]=4 5747 B9R0.4 CCCCC(Cl)CC(Cl)Cl Amb28049950 [0,2,0,0,0,0|1,0,1]=4 5748 B9R0.4 CCCCC(N)C=C(C)C Amb27486513 [0,2,0,0,0,0|1,0,1]=4 5749 B9R0.4 CCCCC(N)CC(=O)O Amb1993866 [0,2,0,0,0,0|0,0,0]=2 5750 B9R0.4 CCCCC(N)CC(=O)O Amb31307613 [0,2,0,0,0,0|0,0,0]=2 5751 B9R0.4 CCCCC(N)CC(C)C Amb27168956 [0,2,0,0,0,0|1,0,1]=4 5752 B9R0.4 CCCCC(N)CC(N)=O Amb24638916 [0,2,0,0,0,0|0,0,0]=2 5753 B9R0.4 CCCCC(O)C=C(Cl)Cl Amb27394754 [0,2,0,0,0,0|1,0,1]=4 5754 B9R0.4 CCCCC(O)CC(=O)O Amb22388888 [0,2,0,0,0,0|0,0,0]=2 5755 B9R0.4 CCCCC(O)CC(C)=O Amb28325992 [0,2,0,0,0,0|0,0,0]=2 5756 B9R0.4 CCCCC(O)CC(C)C Amb22734801 [0,2,0,0,0,0|1,0,1]=4 5757 B9R0.4 CCCCN(C)CC(=O)Cl Amb17142904 [0,2,0,0,0,0|1,0,0]=3 5758 B9R0.4 CCCCN(C)CC(=O)O Amb5774355 [0,2,0,0,0,0|1,0,0]=3 5759 B9R0.4 CCCCN(C)CC(N)=S Amb6273896 [0,2,0,0,0,0|1,1,0]=4 5760 B9R0.4 CCCCN(C)C[N+](=O)[O-] Amb28064742 [0,2,0,0,0,0|2,0,0]=4 5761 B9R0.4 CCCCS(=O)CC(=O)O Amb18792577 [0,2,0,0,0,0|1,0,0]=3 5762 B9R0.4 CCCC[C@@H](C)CC(=O)O Amb25887593 [0,2,0,0,0,0|0,0,0]=2 5763 B9R0.4 CCCC[C@@H](C)CC(C)=O Amb27589814 [0,2,0,0,0,0|0,0,0]=2 5764 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb26612752 [0,2,0,0,0,0|0,0,0]=2 5765 B9R0.4 CCCC[C@@H](N)CC(=O)O Amb32663769 [0,2,0,0,0,0|0,0,0]=2 5766 B9R0.4 CCCC[C@@H](O)C=C(C)C Amb27650406 [0,2,0,0,0,0|1,0,1]=4 5767 B9R0.4 CCCC[C@@H](O)CC(=O)O Amb24350627 [0,2,0,0,0,0|0,0,0]=2 5768 B9R0.4 CCCC[C@@H](O)CC(C)C Amb27399625 [0,2,0,0,0,0|1,0,1]=4 5769 B9R0.4 CCCC[C@@H](O)C[C@@H](C)O Amb27394748 [0,2,0,0,0,0|0,0,2]=4 5770 B9R0.4 CCCC[C@H](C)CC(=O)O Amb27424971 [0,2,0,0,0,0|0,0,0]=2 5771 B9R0.4 CCCC[C@H](C)CC(C)=O Amb28253626 [0,2,0,0,0,0|0,0,0]=2 5772 B9R0.4 CCCC[C@H](C)CC(N)=O Amb28461273 [0,2,0,0,0,0|0,0,0]=2 5773 B9R0.4 CCCC[C@H](C)NC(C)=O Amb27173638 [0,2,0,0,0,0|1,0,0]=3 5774 B9R0.4 CCCC[C@H](N)CC(=O)O Amb27154618 [0,2,0,0,0,0|0,0,0]=2 5775 B9R0.4 CCCC[C@H](O)CC(C)C Amb28429013 [0,2,0,0,0,0|1,0,1]=4 5776 B9R0.4 CCCC[C@H](O)C[C@@H](C)O Amb27833061 [0,2,0,0,0,0|0,0,2]=4 5777 B9R0.4 CCCC[C@H](O)C[C@H](C)O Amb27594737 [0,2,0,0,0,0|0,0,2]=4 5778 B9R0.4 CCCC\C(Br)=C/C(=O)O Amb27622154 [0,2,0,0,0,0|0,0,2]=4 5779 B9R0.4 CCCC\C(C)=C\C(=O)O Amb25929028 [0,2,0,0,0,0|0,0,2]=4 5780 B9R0.4 CCCC\C(C)=N\C(N)=O Amb27645991 [0,2,0,0,0,0|1,0,1]=4 5781 B9R0.4 CCCC\C(O)=C/C(C)=O Amb28184671 [0,2,0,0,0,0|0,0,2]=4 5782 B9R0.4 CCCC\C(O)=C\C(C)=O Amb27432598 [0,2,0,0,0,0|0,0,2]=4 5783 B9R0.4 CCCNC(=O)CC(=O)O Amb17399888 [0,2,0,0,0,0|1,0,1]=4 5784 B9R0.4 CCCNC(=O)CC(C)=O Amb4025887 [0,2,0,0,0,0|1,0,1]=4 5785 B9R0.4 CCCNC(=S)CC(=O)[O-] Amb27797119 [0,2,0,0,0,0|1,0,1]=4 5786 B9R0.4 CCCOC(=O)CC(=O)O Amb27254303 [0,2,0,0,0,0|1,0,1]=4 5787 B9R0.4 CCCOC(=O)CC(C)=O Amb17593619 [0,2,0,0,0,0|1,0,1]=4 5788 B9R0.4 CCCOC(=O)CC(N)=O Amb28125596 [0,2,0,0,0,0|1,0,1]=4 5789 B9R0.4 CCCOC(=S)CC(C)=O Amb27617801 [0,2,0,0,0,0|1,0,1]=4 5790 B9R0.4 CCCOC(C)CC(C)=O Amb28344519 [0,2,0,0,0,0|1,0,0]=3 5791 B9R0.4 CCCSC(=O)CC(C)=O Amb28126646 [0,2,0,0,0,0|1,0,1]=4 5792 B9R0.4 CCC\C=C(\C)CC(=O)O Amb25947471 [0,2,0,0,0,0|0,0,2]=4 5793 B9R0.4 CCC\C=C(\C)CC(C)=O Amb28285885 [0,2,0,0,0,0|0,0,2]=4 5794 B9R0.4 CCNCC(C)CC(=O)O Amb27602707 [0,2,0,0,0,0|1,0,0]=3 5795 B9R0.4 CCOCC(C)CS(=O)Cl Amb32720535 [0,2,0,0,0,0|2,0,0]=4 5796 B9R0.4 CCOCC(C)CS(=O)[O-] Amb32754829 [0,2,0,0,0,0|2,0,0]=4 5797 B9R0.4 CCOCC(C)CS(N)=O Amb32720509 [0,2,0,0,0,0|2,0,0]=4 5798 B9R0.4 CCOCC(C)OC(=O)Cl Amb26020310 [0,2,0,0,0,0|2,0,0]=4 5799 B9R0.4 CCOCC(C)OC(C)=O Amb22732225 [0,2,0,0,0,0|2,0,0]=4 5800 B9R0.4 CCOCC(Cl)CC(N)=O Amb27878741 [0,2,0,0,0,0|1,0,0]=3 5801 B9R0.4 CCOCC(O)CC(=O)O Amb28340917 [0,2,0,0,0,0|1,0,0]=3 5802 B9R0.4 CCONC(C)CC(=O)O Amb28137486 [0,2,0,0,0,0|2,0,0]=4 5803 B9R0.4 CCSCC(C)CC(=O)O Amb33324046 [0,2,0,0,0,0|1,0,0]=3 5804 B9R0.4 CCSCC(Cl)OC(C)=O Amb17940617 [0,2,0,0,0,0|2,0,0]=4 5805 B9R0.4 CCSCC(N)CC(=O)O Amb27233388 [0,2,0,0,0,0|1,0,0]=3 5806 B9R0.4 CCSCC(O)CC(=O)O Amb26062529 [0,2,0,0,0,0|1,0,0]=3 5807 B9R0.4 CCSC[C@@H](O)CC(=O)O Amb33324012 [0,2,0,0,0,0|1,0,0]=3 5808 B9R0.4 CCSC[C@H](O)CC(=O)O Amb33324011 [0,2,0,0,0,0|1,0,0]=3 5809 B9R0.4 CC\C=C\C(C)CC(=O)O Amb32954891 [0,2,0,0,0,0|0,0,2]=4 5810 B9R0.4 CC\C=C\C(N)CC(=O)O Amb25843767 [0,2,0,0,0,0|0,0,2]=4 5811 B9R0.4 CC\C=C\C(O)CC(=O)O Amb33429309 [0,2,0,0,0,0|0,0,2]=4 5812 B9R0.4 CC\C=C\[C@@H](O)CC(=O)O Amb33268250 [0,2,0,0,0,0|0,0,2]=4 5813 B9R0.4 CC\C=C\[C@H](O)CC(=O)O Amb28340505 [0,2,0,0,0,0|0,0,2]=4 5814 B9R0.4 CN(CCCF)CC(N)=O Amb28282361 [0,2,0,0,0,0|2,0,0]=4 5815 B9R0.4 CNCCC(C)CC(C)C Amb27776032 [0,2,0,0,0,0|2,0,0]=4 5816 B9R0.4 CNCCN(C)CC(N)=O Amb27605675 [0,2,0,0,0,0|2,0,0]=4 5817 B9R0.4 CNCC[C@@H](N)CC(=O)O Amb24117036 [0,2,0,0,0,0|1,0,0]=3 5818 B9R0.4 CNCC[C@@H](N)CC(C)C Amb33163990 [0,2,0,0,0,0|2,0,0]=4 5819 B9R0.4 COCCC(=O)CC(C)=O Amb25760850 [0,2,0,0,0,0|1,0,1]=4 5820 B9R0.4 COCCC(C)CC(=O)O Amb27973352 [0,2,0,0,0,0|1,0,0]=3 5821 B9R0.4 COCCC(C)CC(C)N Amb27839042 [0,2,0,0,0,0|2,0,0]=4 5822 B9R0.4 COCCC(C)CC(C)O Amb27399300 [0,2,0,0,0,0|2,0,0]=4 5823 B9R0.4 COCCC(C)OC(=O)Cl Amb32656123 [0,2,0,0,0,0|2,0,0]=4 5824 B9R0.4 COCCC(N)CC(=O)O Amb32687893 [0,2,0,0,0,0|1,0,0]=3 5825 B9R0.4 COCCC(O)CC(=O)O Amb33377806 [0,2,0,0,0,0|1,0,0]=3 5826 B9R0.4 COCCN(C)CC(=O)O Amb22587006 [0,2,0,0,0,0|2,0,0]=4 5827 B9R0.4 COCCN(C)CC(=O)O Amb22587626 [0,2,0,0,0,0|2,0,0]=4 5828 B9R0.4 COCCN(C)CC(=O)O Amb9173718 [0,2,0,0,0,0|2,0,0]=4 5829 B9R0.4 COCCS(=O)CC(=O)O Amb18792760 [0,2,0,0,0,0|2,0,0]=4 5830 B9R0.4 COCCS(=O)CC(N)=O Amb28069973 [0,2,0,0,0,0|2,0,0]=4 5831 B9R0.4 COCC[C@@H](O)CC(=O)O Amb33377805 [0,2,0,0,0,0|1,0,0]=3 5832 B9R0.4 COCC[C@H](O)CC(=O)O Amb33377804 [0,2,0,0,0,0|1,0,0]=3 5833 B9R0.4 COCOC(C)CC(=O)O Amb28141098 [0,2,0,0,0,0|2,0,0]=4 5834 B9R0.4 COCO[C@@H](C)CC(C)=O Amb27783387 [0,2,0,0,0,0|2,0,0]=4 5835 B9R0.4 CONCC(O)CC(=O)O Amb28071252 [0,2,0,0,0,0|2,0,0]=4 5836 B9R0.4 CSCCC(C)CC(=O)O Amb26651819 [0,2,0,0,0,0|1,0,0]=3 5837 B9R0.4 CSCCC(C)CC(C)Cl Amb28187785 [0,2,0,0,0,0|2,0,0]=4 5838 B9R0.4 CSCCC(C)NC(C)=O Amb27868995 [0,2,0,0,0,0|2,0,0]=4 5839 B9R0.4 CSCCC(N)CC(=O)O Amb22353181 [0,2,0,0,0,0|1,0,0]=3 5840 B9R0.4 CSCCC(N)CC(=O)O Amb30666600 [0,2,0,0,0,0|1,0,0]=3 5841 B9R0.4 CSCCC(N)CC(N)=O Amb26023351 [0,2,0,0,0,0|1,0,0]=3 5842 B9R0.4 CSCCC(O)CC(=O)O Amb18798349 [0,2,0,0,0,0|1,0,0]=3 5843 B9R0.4 CSCCN(C)CC(=O)O Amb27448940 [0,2,0,0,0,0|2,0,0]=4 5844 B9R0.4 CSCCN(C)CC(C)=O Amb27880841 [0,2,0,0,0,0|2,0,0]=4 5845 B9R0.4 CSCCN(C)CC(N)=O Amb27944587 [0,2,0,0,0,0|2,0,0]=4 5846 B9R0.4 CSCC[C@@H](N)CC(=O)O Amb26930581 [0,2,0,0,0,0|1,0,0]=3 5847 B9R0.4 CSCC[C@@H](O)CC(=O)O Amb33198734 [0,2,0,0,0,0|1,0,0]=3 5848 B9R0.4 CSCC[C@H](N)CC(=O)O Amb16184019 [0,2,0,0,0,0|1,0,0]=3 5849 B9R0.4 CSCC[C@H](O)CC(=O)O Amb33198733 [0,2,0,0,0,0|1,0,0]=3 5850 B9R0.4 C[C@@H](CCC=O)CC(=O)O Amb27614920 [0,2,0,0,0,0|1,0,1]=4 5851 B9R0.4 C[C@@H](O)C[C@@H](O)CCC#N Amb27839213 [0,2,0,0,0,0|1,0,1]=4 5852 B9R0.4 C\C(=C/C(C)C)CCC=O Amb27229823 [0,2,0,0,0,0|0,0,2]=4 5853 B9R0.4 C\C=C/C[C@@H](O)CC(=O)O Amb28050083 [0,2,0,0,0,0|0,0,2]=4 5854 B9R0.4 NCCCC(N)CC(=O)O Amb18644278 [0,2,0,0,0,0|1,0,0]=3 5855 B9R0.4 NCCCC(N)CC(=O)O Amb32753541 [0,2,0,0,0,0|1,0,0]=3 5856 B9R0.4 NCCCS(=O)CC(=O)O Amb27965039 [0,2,0,0,0,0|2,0,0]=4 5857 B9R0.4 NCCCS(=O)CC(N)=O Amb28133954 [0,2,0,0,0,0|2,0,0]=4 5858 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117039 [0,2,0,0,0,0|1,0,0]=3 5859 B9R0.4 NCCC[C@@H](N)CC(=O)O Amb24117927 [0,2,0,0,0,0|1,0,0]=3 5860 B9R0.4 NCCC[C@H](N)CC(=O)O Amb25757485 [0,2,0,0,0,0|1,0,0]=3 5861 B9R0.4 NCCC[C@H](N)CC(=O)O Amb32684506 [0,2,0,0,0,0|1,0,0]=3 5862 B9R0.4 [C-]#[N+]CCC(F)CC(C)C Amb28435325 [0,2,0,0,0,0|2,0,0]=4 5863 B9R0.5 C#CCC(C)NCCCC Amb27647747 [0,2,0,0,0,0|1,0,1]=4 5864 B9R0.5 C#CCC(N)CCCOC Amb28130355 [0,2,0,0,0,0|1,0,1]=4 5865 B9R0.5 C#CCC(O)CCCNC Amb27838114 [0,2,0,0,0,0|1,0,1]=4 5866 B9R0.5 C#CCC(O)CCCOC Amb28282787 [0,2,0,0,0,0|1,0,1]=4 5867 B9R0.5 C#CCC(O)CNCCC Amb27835225 [0,2,0,0,0,0|1,0,1]=4 5868 B9R0.5 C#CCCCC(C)CCN Amb27841944 [0,2,0,0,0,0|1,0,1]=4 5869 B9R0.5 C#CCCCC(N)CCC Amb27839183 [0,2,0,0,0,0|1,0,1]=4 5870 B9R0.5 C#CCCCC(O)CCC Amb27403872 [0,2,0,0,0,0|1,0,1]=4 5871 B9R0.5 C#CCCNC(C)CCC Amb27754245 [0,2,0,0,0,0|1,0,1]=4 5872 B9R0.5 C#CC[C@H](O)CCCNC Amb27878521 [0,2,0,0,0,0|1,0,1]=4 5873 B9R0.5 C=C(CCC)CCCCCl Amb27835284 [0,2,0,0,0,0|1,0,1]=4 5874 B9R0.5 C=C=CCCC(O)CCO Amb28200103 [0,2,0,0,0,0|2,0,0]=4 5875 B9R0.5 C=C=C[C@@H](O)CCCCC Amb27427171 [0,2,0,0,0,0|1,0,0]=3 5876 B9R0.5 C=C=C[C@H](O)CCCCC Amb27839194 [0,2,0,0,0,0|1,0,0]=3 5877 B9R0.5 C=CCC#CC(O)CCC Amb28077740 [0,2,0,0,0,0|1,0,1]=4 5878 B9R0.5 C=CCC(=O)CCCCCl Amb27254167 [0,2,0,0,0,0|1,0,1]=4 5879 B9R0.5 C=CCC(=O)CCCCN Amb27251890 [0,2,0,0,0,0|1,0,1]=4 5880 B9R0.5 C=CCC(=O)CCCNC Amb27196074 [0,2,0,0,0,0|1,0,1]=4 5881 B9R0.5 C=CCC(=O)CNCCC Amb27190835 [0,2,0,0,0,0|1,0,1]=4 5882 B9R0.5 C=CCC(=O)COCCC Amb28457139 [0,2,0,0,0,0|1,0,1]=4 5883 B9R0.5 C=CCC(=O)OCCCC Amb28049467 [0,2,0,0,0,0|1,0,1]=4 5884 B9R0.5 C=CCC(C)NCCSC Amb27450763 [0,2,0,0,0,0|2,0,0]=4 5885 B9R0.5 C=CCC(Cl)CCOCC Amb27855969 [0,2,0,0,0,0|1,0,0]=3 5886 B9R0.5 C=CCC(N)CCCCF Amb28139176 [0,2,0,0,0,0|1,0,0]=3 5887 B9R0.5 C=CCC(N)CSCCC Amb27763084 [0,2,0,0,0,0|1,0,0]=3 5888 B9R0.5 C=CCC(O)C#CCCC Amb27662271 [0,2,0,0,0,0|1,0,1]=4 5889 B9R0.5 C=CCC(O)CCCCO Amb27839188 [0,2,0,0,0,0|1,0,0]=3 5890 B9R0.5 C=CCC(O)CCCOC Amb27653229 [0,2,0,0,0,0|1,0,0]=3 5891 B9R0.5 C=CCC(O)CCOCC Amb27756800 [0,2,0,0,0,0|1,0,0]=3 5892 B9R0.5 C=CCC(O)CNCCC Amb28049702 [0,2,0,0,0,0|1,0,0]=3 5893 B9R0.5 C=CCC(O)COCOC Amb28069507 [0,2,0,0,0,0|2,0,0]=4 5894 B9R0.5 C=CCCCC(=O)CCO Amb27262946 [0,2,0,0,0,0|1,0,1]=4 5895 B9R0.5 C=CCCCC(=O)CSC Amb28182451 [0,2,0,0,0,0|1,0,1]=4 5896 B9R0.5 C=CCCCC(C)CCN Amb28049508 [0,2,0,0,0,0|1,0,0]=3 5897 B9R0.5 C=CCCCC(C)CCO Amb28455077 [0,2,0,0,0,0|1,0,0]=3 5898 B9R0.5 C=CCCCC(C)CNC Amb27823564 [0,2,0,0,0,0|1,0,0]=3 5899 B9R0.5 C=CCCCC(C)NC=O Amb28195586 [0,2,0,0,0,0|0,0,2]=4 5900 B9R0.5 C=CCCCC(O)CCO Amb27598491 [0,2,0,0,0,0|1,0,0]=3 5901 B9R0.5 C=CCCCN(C)CCN Amb27945605 [0,2,0,0,0,0|2,0,0]=4 5902 B9R0.5 C=CCCC[C@H](C)CC=O Amb28049851 [0,2,0,0,0,0|0,0,1]=3 5903 B9R0.5 C=CCCNC(C)CCC Amb28056748 [0,2,0,0,0,0|1,0,0]=3 5904 B9R0.5 C=CCCNC(C)CNC Amb27478435 [0,2,0,0,0,0|2,0,0]=4 5905 B9R0.5 C=CCCNC(C)CSC Amb27425135 [0,2,0,0,0,0|2,0,0]=4 5906 B9R0.5 C=CCCSC(C)CCO Amb27878479 [0,2,0,0,0,0|2,0,0]=4 5907 B9R0.5 C=CCN(C)CCCCF Amb27970730 [0,2,0,0,0,0|2,0,0]=4 5908 B9R0.5 C=CCN(C)CCCNC Amb27169405 [0,2,0,0,0,0|2,0,0]=4 5909 B9R0.5 C=CCN(C)CCNCC Amb25354291 [0,2,0,0,0,0|2,0,0]=4 5910 B9R0.5 C=CCN(C)CCNCC Amb28895972 [0,2,0,0,0,0|2,0,0]=4 5911 B9R0.5 C=CCNCC(C)CCN Amb17334205 [0,2,0,0,0,0|2,0,0]=4 5912 B9R0.5 C=CCNCC(C)OCC Amb27492917 [0,2,0,0,0,0|2,0,0]=4 5913 B9R0.5 C=CCNCC(O)COC Amb27258640 [0,2,0,0,0,0|2,0,0]=4 5914 B9R0.5 C=CCNCC(S)COC Amb28368244 [0,2,0,0,0,0|2,0,0]=4 5915 B9R0.5 C=CCOCC(=O)CCC Amb27171042 [0,2,0,0,0,0|1,0,1]=4 5916 B9R0.5 C=CCOCC(C)CNC Amb27412659 [0,2,0,0,0,0|2,0,0]=4 5917 B9R0.5 C=CCOCC(O)CCC Amb28455074 [0,2,0,0,0,0|1,0,0]=3 5918 B9R0.5 C=CCOCC(O)COC Amb28321455 [0,2,0,0,0,0|2,0,0]=4 5919 B9R0.5 C=CCS(=O)CCCNC Amb27185646 [0,2,0,0,0,0|2,0,0]=4 5920 B9R0.5 C=CCSCC(C)NCC Amb27661806 [0,2,0,0,0,0|2,0,0]=4 5921 B9R0.5 C=CCSCC(N)CCC Amb28245689 [0,2,0,0,0,0|1,0,0]=3 5922 B9R0.5 C=CCSCC(N)COC Amb27775747 [0,2,0,0,0,0|2,0,0]=4 5923 B9R0.5 C=CC[C@@H](O)\C=C\CCC Amb27426691 [0,2,0,0,0,0|1,0,1]=4 5924 B9R0.5 C=CC[C@H](O)CCCCC Amb27839428 [0,2,0,0,0,0|1,0,0]=3 5925 B9R0.5 C=CC[C@H](O)CCCNC Amb27596136 [0,2,0,0,0,0|1,0,0]=3 5926 B9R0.5 C=CC[C@H](O)\C=C\CCC Amb28400908 [0,2,0,0,0,0|1,0,1]=4 5927 B9R0.5 C=COC(O)CCCCC Amb26392164 [0,2,0,0,0,0|1,0,0]=3 5928 B9R0.5 CC#CCCC(Cl)CCC Amb27463303 [0,2,0,0,0,0|1,0,1]=4 5929 B9R0.5 CC#CCCC(O)CCC Amb28247196 [0,2,0,0,0,0|1,0,1]=4 5930 B9R0.5 CC(CC=O)OCCCO Amb27392434 [0,2,0,0,0,0|1,0,0]=3 5931 B9R0.5 CC(CCO)CCNC=O Amb27220932 [0,2,0,0,0,0|1,0,0]=3 5932 B9R0.5 CCCC(=O)CCCCN Amb28058184 [0,2,0,0,0,0|1,0,1]=4 5933 B9R0.5 CCCC(=O)CCCSC Amb27758287 [0,2,0,0,0,0|2,0,0]=4 5934 B9R0.5 CCCC(=O)NCCC=O Amb17102167 [0,2,0,0,0,0|0,0,1]=3 5935 B9R0.5 CCCC(=O)OCCC=O Amb28049893 [0,2,0,0,0,0|0,0,1]=3 5936 B9R0.5 CCCC(Br)CCOCC Amb27392491 [0,2,0,0,0,0|1,0,1]=4 5937 B9R0.5 CCCC(C)CCCC=O Amb27425021 [0,2,0,0,0,0|0,0,0]=2 5938 B9R0.5 CCCC(C)CCCCCl Amb27626477 [0,2,0,0,0,0|1,0,1]=4 5939 B9R0.5 CCCC(C)CCCCN Amb25950864 [0,2,0,0,0,0|1,0,1]=4 5940 B9R0.5 CCCC(C)CCCCO Amb28046661 [0,2,0,0,0,0|0,0,2]=4 5941 B9R0.5 CCCC(C)CCN=C=O Amb33324203 [0,2,0,0,0,0|0,0,1]=3 5942 B9R0.5 CCCC(C)CCNCC Amb27615018 [0,2,0,0,0,0|1,0,1]=4 5943 B9R0.5 CCCC(C)CNCC#N Amb28207011 [0,2,0,0,0,0|1,0,1]=4 5944 B9R0.5 CCCC(C)CNCCCl Amb28140434 [0,2,0,0,0,0|1,0,1]=4 5945 B9R0.5 CCCC(C)COCCCl Amb27961291 [0,2,0,0,0,0|1,0,1]=4 5946 B9R0.5 CCCC(C)COCCN Amb27645084 [0,2,0,0,0,0|1,0,1]=4 5947 B9R0.5 CCCC(C)COCCO Amb26080123 [0,2,0,0,0,0|0,0,2]=4 5948 B9R0.5 CCCC(C)NCCCBr Amb27223537 [0,2,0,0,0,0|1,0,1]=4 5949 B9R0.5 CCCC(C)OCCC#N Amb27759100 [0,2,0,0,0,0|1,0,1]=4 5950 B9R0.5 CCCC(C)OCCCCl Amb27442914 [0,2,0,0,0,0|1,0,1]=4 5951 B9R0.5 CCCC(C)OCCCN Amb26057752 [0,2,0,0,0,0|1,0,1]=4 5952 B9R0.5 CCCC(C)OCCCS Amb27234480 [0,2,0,0,0,0|0,1,1]=4 5953 B9R0.5 CCCC(C)SCCCCl Amb27812508 [0,2,0,0,0,0|1,0,1]=4 5954 B9R0.5 CCCC(C)SCCOC Amb27827232 [0,2,0,0,0,0|2,0,0]=4 5955 B9R0.5 CCCC(Cl)CCCC#N Amb27591872 [0,2,0,0,0,0|1,0,1]=4 5956 B9R0.5 CCCC(Cl)CCCCCl Amb27823562 [0,2,0,0,0,0|1,0,1]=4 5957 B9R0.5 CCCC(F)CCCCO Amb27856506 [0,2,0,0,0,0|0,0,2]=4 5958 B9R0.5 CCCC(F)CCN=C=O Amb27958673 [0,2,0,0,0,0|0,0,1]=3 5959 B9R0.5 CCCC(N)CCOCC Amb27816889 [0,2,0,0,0,0|1,0,1]=4 5960 B9R0.5 CCCC(N)CCSCC Amb27480968 [0,2,0,0,0,0|1,0,1]=4 5961 B9R0.5 CCCC(N)CSCCO Amb27968788 [0,2,0,0,0,0|0,0,2]=4 5962 B9R0.5 CCCC(O)C#CCC=O Amb27615134 [0,2,0,0,0,0|0,0,1]=3 5963 B9R0.5 CCCC(O)CCCC#N Amb18643761 [0,2,0,0,0,0|1,0,1]=4 5964 B9R0.5 CCCC(O)CCNCC Amb28050120 [0,2,0,0,0,0|1,0,1]=4 5965 B9R0.5 CCCC(O)COCOC Amb28435648 [0,2,0,0,0,0|2,0,0]=4 5966 B9R0.5 CCCC(O)C\C=C\CO Amb27614990 [0,2,0,0,0,0|0,0,2]=4 5967 B9R0.5 CCCCCC(=O)CCC Amb2720457 [0,2,0,0,0,0|1,0,1]=4 5968 B9R0.5 CCCCCC(=O)CCO Amb27627789 [0,2,0,0,0,0|0,0,2]=4 5969 B9R0.5 CCCCCC(=O)COC Amb27171123 [0,2,0,0,0,0|2,0,0]=4 5970 B9R0.5 CCCCCC(=O)\C=C\Cl Amb26411947 [0,2,0,0,0,0|1,0,1]=4 5971 B9R0.5 CCCCCC(=O)\C=C\I Amb26013833 [0,2,0,0,0,0|1,0,1]=4 5972 B9R0.5 CCCCCC(Br)CCC Amb28318288 [0,2,0,0,0,0|1,0,1]=4 5973 B9R0.5 CCCCCC(Br)COC Amb27849558 [0,2,0,0,0,0|0,0,2]=4 5974 B9R0.5 CCCCCC(C)CC=O Amb21953169 [0,2,0,0,0,0|0,0,0]=2 5975 B9R0.5 CCCCCC(C)CCBr Amb26637488 [0,2,0,0,0,0|1,0,1]=4 5976 B9R0.5 CCCCCC(C)CCC Amb4035718 [0,2,0,0,0,0|1,0,1]=4 5977 B9R0.5 CCCCCC(C)CCCl Amb27392063 [0,2,0,0,0,0|1,0,1]=4 5978 B9R0.5 CCCCCC(C)CCN Amb24738346 [0,2,0,0,0,0|1,0,1]=4 5979 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|0,0,2]=4 5980 B9R0.5 CCCCCC(C)N=C=O Amb24476932 [0,2,0,0,0,0|0,0,1]=3 5981 B9R0.5 CCCCCC(C)N=C=S Amb839070 [0,2,0,0,0,0|0,1,1]=4 5982 B9R0.5 CCCCCC(C)NC=O Amb27615073 [0,2,0,0,0,0|0,0,0]=2 5983 B9R0.5 CCCCCC(Cl)CCCl Amb27831205 [0,2,0,0,0,0|1,0,1]=4 5984 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|0,0,2]=4 5985 B9R0.5 CCCCCC(N)CCC Amb8869705 [0,2,0,0,0,0|1,0,1]=4 5986 B9R0.5 CCCCCC(N)COC Amb27206898 [0,2,0,0,0,0|0,0,2]=4 5987 B9R0.5 CCCCCC(O)C#CCl Amb28189369 [0,2,0,0,0,0|1,0,1]=4 5988 B9R0.5 CCCCCC(O)CC#N Amb18643749 [0,2,0,0,0,0|1,0,1]=4 5989 B9R0.5 CCCCCC(O)CCN Amb24730197 [0,2,0,0,0,0|1,0,1]=4 5990 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|0,0,2]=4 5991 B9R0.5 CCCCCC(O)CNC Amb27973914 [0,2,0,0,0,0|1,0,1]=4 5992 B9R0.5 CCCCCC(O)N=[N+]=[N-] Amb27201555 [0,2,0,0,0,0|2,0,0]=4 5993 B9R0.5 CCCCCC(S)CC=O Amb27424790 [0,2,0,0,0,0|0,0,0]=2 5994 B9R0.5 CCCCCN(C)CCCl Amb17334595 [0,2,0,0,0,0|1,0,1]=4 5995 B9R0.5 CCCCCN(C)CCO Amb3204759 [0,2,0,0,0,0|0,0,2]=4 5996 B9R0.5 CCCCCN(C)CCS Amb27834912 [0,2,0,0,0,0|0,1,1]=4 5997 B9R0.5 CCCCCS(=O)CCN Amb27954729 [0,2,0,0,0,0|1,0,1]=4 5998 B9R0.5 CCCCC[C@@H](C)N=C=O Amb10807374 [0,2,0,0,0,0|0,0,1]=3 5999 B9R0.5 CCCCC[C@@H](C)N=C=S Amb10807444 [0,2,0,0,0,0|0,1,1]=4 6000 B9R0.5 CCCCC[C@@H](O)CCO Amb27946548 [0,2,0,0,0,0|0,0,2]=4 6001 B9R0.5 CCCCC[C@@H](O)\C=C\I Amb25970920 [0,2,0,0,0,0|1,0,0]=3 6002 B9R0.5 CCCCC[C@H](C)CCO Amb26861853 [0,2,0,0,0,0|0,0,2]=4 6003 B9R0.5 CCCCC[C@H](C)N=C=O Amb22053846 [0,2,0,0,0,0|0,0,1]=3 6004 B9R0.5 CCCCC[C@H](C)N=C=S Amb22045293 [0,2,0,0,0,0|0,1,1]=4 6005 B9R0.5 CCCCC[C@H](O)CCC Amb27652271 [0,2,0,0,0,0|1,0,1]=4 6006 B9R0.5 CCCCC[C@H](O)\C=C\I Amb24518537 [0,2,0,0,0,0|1,0,0]=3 6007 B9R0.5 CCCCC\C(C)=C\C#N Amb27476930 [0,2,0,0,0,0|1,0,1]=4 6008 B9R0.5 CCCCC\C(C)=C\C=O Amb27841277 [0,2,0,0,0,0|0,0,1]=3 6009 B9R0.5 CCCCC\C(Cl)=C\CCl Amb27749688 [0,2,0,0,0,0|1,0,1]=4 6010 B9R0.5 CCCCC\C(I)=C\CO Amb4017430 [0,2,0,0,0,0|0,0,2]=4 6011 B9R0.5 CCCCNC(C)CCBr Amb27403208 [0,2,0,0,0,0|1,0,1]=4 6012 B9R0.5 CCCCNC(C)CCO Amb27594265 [0,2,0,0,0,0|0,0,2]=4 6013 B9R0.5 CCCCOC(C)CC=O Amb27838097 [0,2,0,0,0,0|0,0,0]=2 6014 B9R0.5 CCCCOC(O)CCC Amb27839284 [0,2,0,0,0,0|1,0,1]=4 6015 B9R0.5 CCCCSC(C)CCCl Amb27848679 [0,2,0,0,0,0|1,0,1]=4 6016 B9R0.5 CCCCSC(C)CCN Amb9174079 [0,2,0,0,0,0|1,0,1]=4 6017 B9R0.5 CCCCSC(C)COC Amb28078829 [0,2,0,0,0,0|2,0,0]=4 6018 B9R0.5 CCCN(C)CCCCF Amb27946988 [0,2,0,0,0,0|1,0,1]=4 6019 B9R0.5 CCCN(C)CCCCS Amb28049591 [0,2,0,0,0,0|0,1,1]=4 6020 B9R0.5 CCCNCC(C)CCCl Amb27877425 [0,2,0,0,0,0|1,0,1]=4 6021 B9R0.5 CCCNCC(N)COC Amb28137479 [0,2,0,0,0,0|2,0,0]=4 6022 B9R0.5 CCCNCC(O)CCO Amb27453664 [0,2,0,0,0,0|0,0,2]=4 6023 B9R0.5 CCCNC[C@@H](N)CCC Amb27877347 [0,2,0,0,0,0|1,0,1]=4 6024 B9R0.5 CCCNC[C@H](O)COC Amb28126305 [0,2,0,0,0,0|2,0,0]=4 6025 B9R0.5 CCCOCC(C)N=C=O Amb27792954 [0,2,0,0,0,0|1,0,1]=4 6026 B9R0.5 CCCOCC(N)COC Amb27807201 [0,2,0,0,0,0|2,0,0]=4 6027 B9R0.5 CCCSCC(N)CCC Amb27218055 [0,2,0,0,0,0|1,0,1]=4 6028 B9R0.5 CCCSCC(O)CC#N Amb18645236 [0,2,0,0,0,0|1,0,1]=4 6029 B9R0.5 CCCSCC(O)COC Amb27620692 [0,2,0,0,0,0|2,0,0]=4 6030 B9R0.5 CCCSC[C@@H](N)CCC Amb27755000 [0,2,0,0,0,0|1,0,1]=4 6031 B9R0.5 CCC[C@@H](C)CCCCBr Amb27956034 [0,2,0,0,0,0|1,0,1]=4 6032 B9R0.5 CCC[C@@H](F)CCCCO Amb27617034 [0,2,0,0,0,0|0,0,2]=4 6033 B9R0.5 CCC[C@@H](N)CCCOC Amb27167802 [0,2,0,0,0,0|0,0,2]=4 6034 B9R0.5 CCC[C@@H](N)CCOCC Amb27839454 [0,2,0,0,0,0|1,0,1]=4 6035 B9R0.5 CCC[C@H](C)CCCCO Amb27972560 [0,2,0,0,0,0|0,0,2]=4 6036 B9R0.5 CCC[C@H](C)OCCCO Amb27839315 [0,2,0,0,0,0|0,0,2]=4 6037 B9R0.5 CCC[C@H](F)CCCCO Amb27835909 [0,2,0,0,0,0|0,0,2]=4 6038 B9R0.5 CCC[C@H](N)CCCCO Amb27799723 [0,2,0,0,0,0|0,0,2]=4 6039 B9R0.5 CCC[C@H](N)CCOCC Amb28239931 [0,2,0,0,0,0|1,0,1]=4 6040 B9R0.5 CCC[C@H](N)CNCCF Amb28397419 [0,2,0,0,0,0|1,0,1]=4 6041 B9R0.5 CCC[C@H](O)C\C=C\CO Amb27617048 [0,2,0,0,0,0|0,0,2]=4 6042 B9R0.5 CCC\C(C)=C\CCC=O Amb27224748 [0,2,0,0,0,0|0,0,1]=3 6043 B9R0.5 CCC\C=C\C(C)CC=O Amb27615137 [0,2,0,0,0,0|0,0,1]=3 6044 B9R0.5 CCNC(=O)CCNC=O Amb27255900 [0,2,0,0,0,0|1,0,1]=4 6045 B9R0.5 CCNC(C)CCCCBr Amb27867569 [0,2,0,0,0,0|1,0,1]=4 6046 B9R0.5 CCNC(C)CCCCN Amb28256279 [0,2,0,0,0,0|1,0,1]=4 6047 B9R0.5 CCNC(C)CCCCO Amb28280233 [0,2,0,0,0,0|0,0,2]=4 6048 B9R0.5 CCNC(C)CCCOC Amb28122940 [0,2,0,0,0,0|2,0,0]=4 6049 B9R0.5 CCNCCC(C)CCBr Amb28058060 [0,2,0,0,0,0|1,0,1]=4 6050 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [0,2,0,0,0,0|0,0,1]=3 6051 B9R0.5 CCOC(=O)OCCC=O Amb28287679 [0,2,0,0,0,0|1,0,1]=4 6052 B9R0.5 CCOC(C)CCCC=O Amb33424998 [0,2,0,0,0,0|0,0,0]=2 6053 B9R0.5 CCOC(C)CCCCN Amb26327066 [0,2,0,0,0,0|1,0,1]=4 6054 B9R0.5 CCOC(C)CCCCO Amb28050663 [0,2,0,0,0,0|0,0,2]=4 6055 B9R0.5 CCOC(C)CCCNC Amb27947246 [0,2,0,0,0,0|2,0,0]=4 6056 B9R0.5 CCOC(C)CCN=C=O Amb33425413 [0,2,0,0,0,0|1,0,1]=4 6057 B9R0.5 CCOCCC(Br)COC Amb28050030 [0,2,0,0,0,0|2,0,0]=4 6058 B9R0.5 CCOCCC(C)CCBr Amb27185579 [0,2,0,0,0,0|1,0,1]=4 6059 B9R0.5 CCOCCC(C)CCS Amb27649002 [0,2,0,0,0,0|0,1,1]=4 6060 B9R0.5 CCOCCC(O)CCO Amb27663664 [0,2,0,0,0,0|0,0,2]=4 6061 B9R0.5 CCO\C=C\C(C)CC=O Amb25701589 [0,2,0,0,0,0|0,0,2]=4 6062 B9R0.5 CCSCCC(C)N=C=O Amb27434959 [0,2,0,0,0,0|1,0,1]=4 6063 B9R0.5 CCSCCC(O)CCN Amb24607786 [0,2,0,0,0,0|1,0,1]=4 6064 B9R0.5 CC\C=C(/C)CCCCC Amb27666327 [0,2,0,0,0,0|1,0,1]=4 6065 B9R0.5 CC\C=C(\C)CCCC=O Amb27850024 [0,2,0,0,0,0|0,0,1]=3 6066 B9R0.5 CC\C=C\CC(Br)CCC Amb27488172 [0,2,0,0,0,0|1,0,1]=4 6067 B9R0.5 CN(CC=O)CCCCO Amb28191923 [0,2,0,0,0,0|1,0,0]=3 6068 B9R0.5 CNCC(O)CCCOC Amb27853280 [0,2,0,0,0,0|2,0,0]=4 6069 B9R0.5 CNCC(O)CCCSC Amb27395740 [0,2,0,0,0,0|2,0,0]=4 6070 B9R0.5 CNCCCC(C)COC Amb17569969 [0,2,0,0,0,0|2,0,0]=4 6071 B9R0.5 COCC(Cl)CCCSC Amb28341860 [0,2,0,0,0,0|2,0,0]=4 6072 B9R0.5 COCC(O)CCCCO Amb27760907 [0,2,0,0,0,0|0,0,2]=4 6073 B9R0.5 COCC(O)CCCSC Amb27956009 [0,2,0,0,0,0|2,0,0]=4 6074 B9R0.5 COCCCC(C)CCCl Amb27607417 [0,2,0,0,0,0|1,0,1]=4 6075 B9R0.5 COCCCC(C)CCN Amb27230132 [0,2,0,0,0,0|1,0,1]=4 6076 B9R0.5 COCCCC(Cl)COC Amb18798738 [0,2,0,0,0,0|2,0,0]=4 6077 B9R0.5 COCCCC(O)CCN Amb28126850 [0,2,0,0,0,0|1,0,1]=4 6078 B9R0.5 COCCCS(=O)CC=O Amb27830933 [0,2,0,0,0,0|1,0,0]=3 6079 B9R0.5 COCOC[C@@H](C)CC=O Amb27792883 [0,2,0,0,0,0|1,0,0]=3 6080 B9R0.5 CO\C=C(/C)CCCC=O Amb27199142 [0,2,0,0,0,0|0,0,2]=4 6081 B9R0.5 CSCCCC(O)CC#N Amb27589027 [0,2,0,0,0,0|1,0,1]=4 6082 B9R0.5 CSCCCC(O)CCN Amb27974794 [0,2,0,0,0,0|1,0,1]=4 6083 B9R0.5 C\C(=C/CO)CCCC=O Amb28287918 [0,2,0,0,0,0|0,0,2]=4 6084 B9R0.5 C\C=C/CCC(C)CC=O Amb27751342 [0,2,0,0,0,0|0,0,1]=3 6085 B9R0.5 C\C=C\C(=O)CCCC=O Amb25743030 [0,2,0,0,0,0|0,0,2]=4 6086 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [0,2,0,0,0,0|1,0,1]=4 6087 B9R0.5 C\C=C\C(O)CCCCC Amb28139884 [0,2,0,0,0,0|1,0,0]=3 6088 B9R0.5 C\C=C\CCC(C)CC=O Amb27849050 [0,2,0,0,0,0|0,0,1]=3 6089 B9R0.5 C\C=C\CCC(O)CCO Amb28350050 [0,2,0,0,0,0|1,0,1]=4 6090 B9R0.5 C\C=C\CCC(O)COC Amb27487822 [0,2,0,0,0,0|1,0,1]=4 6091 B9R0.5 C\C=C\OC[C@@H](C)CC=O Amb27849648 [0,2,0,0,0,0|0,0,2]=4 6092 B9R0.5 C\C=C\OC[C@H](C)CC=O Amb28050011 [0,2,0,0,0,0|0,0,2]=4 6093 B9R0.5 O=CCCOC(O)CCO Amb27169395 [0,2,0,0,0,0|1,0,0]=3 6094 B9R0.8 C#CC(O)C(F)CCCC Amb28075665 [0,2,0,0,0,0|1,0,1]=4 6095 B9R0.8 C#C[C@@H](Br)[C@H](O)CCCC Amb27797946 [0,2,0,0,0,0|1,0,1]=4 6096 B9R0.8 C=CC(=O)C(N)CCCC Amb28050432 [0,2,0,0,0,0|1,0,1]=4 6097 B9R0.8 C=CC(C)C(C)CCCC Amb27493593 [0,2,0,0,0,0|1,0,0]=3 6098 B9R0.8 C=CC(C)C(O)CCCC Amb17593607 [0,2,0,0,0,0|1,0,0]=3 6099 B9R0.8 C=CC(C)C(O)CCCO Amb27972038 [0,2,0,0,0,0|2,0,0]=4 6100 B9R0.8 C=CC(N)C(C)CCOC Amb27212527 [0,2,0,0,0,0|2,0,0]=4 6101 B9R0.8 C=CC(O)C(C)CCOC Amb27212551 [0,2,0,0,0,0|2,0,0]=4 6102 B9R0.8 C=CC(O)C(O)CCCBr Amb28342338 [0,2,0,0,0,0|2,0,0]=4 6103 B9R0.8 C=CCCC(C)C(O)CC Amb27945604 [0,2,0,0,0,0|1,0,0]=3 6104 B9R0.8 C=CCCC(C)N(C)CC Amb28453911 [0,2,0,0,0,0|2,0,0]=4 6105 B9R0.8 C=CCCC(N)C(C)CC Amb27793779 [0,2,0,0,0,0|1,0,0]=3 6106 B9R0.8 C=CCCC(O)C(C)CC Amb27839006 [0,2,0,0,0,0|1,0,0]=3 6107 B9R0.8 C=CCCC(O)C(C)CN Amb27776843 [0,2,0,0,0,0|2,0,0]=4 6108 B9R0.8 C=CCCC(O)C(O)CC Amb27963197 [0,2,0,0,0,0|1,0,0]=3 6109 B9R0.8 C=CCC[C@H](O)[C@@H](O)CO Amb28350154 [0,2,0,0,0,0|2,0,0]=4 6110 B9R0.8 C=CCNC(C)C(C)CC Amb6719300 [0,2,0,0,0,0|2,0,0]=4 6111 B9R0.8 C=C[C@@H](C)[C@@H](N)CCCC Amb27873896 [0,2,0,0,0,0|1,0,0]=3 6112 B9R0.8 C=C[C@@H](C)[C@H](O)CCCC Amb27857168 [0,2,0,0,0,0|1,0,0]=3 6113 B9R0.8 C=C[C@H](C)[C@H](N)CCCC Amb27424985 [0,2,0,0,0,0|1,0,0]=3 6114 B9R0.8 C=C[C@H](C)[C@H](O)CCCC Amb27198444 [0,2,0,0,0,0|1,0,0]=3 6115 B9R0.8 CC(C=O)C(C)CCC=O Amb27970143 [0,2,0,0,0,0|1,0,1]=4 6116 B9R0.8 CCC(C)C(C)CCCN Amb27408165 [0,2,0,0,0,0|1,0,1]=4 6117 B9R0.8 CCC(C)C(C)CCNC Amb27601841 [0,2,0,0,0,0|2,0,0]=4 6118 B9R0.8 CCC(C)C(N)CCOC Amb28287630 [0,2,0,0,0,0|2,0,0]=4 6119 B9R0.8 CCC(C)C(O)CCC=O Amb27247935 [0,2,0,0,0,0|0,0,0]=2 6120 B9R0.8 CCC(C)N(C)CCC=O Amb27248852 [0,2,0,0,0,0|1,0,0]=3 6121 B9R0.8 CCC(Cl)C(C)CCOC Amb27759069 [0,2,0,0,0,0|2,0,0]=4 6122 B9R0.8 CCC(Cl)C(Cl)CCCO Amb27758675 [0,2,0,0,0,0|0,0,2]=4 6123 B9R0.8 CCC(N)C(C)CCOC Amb27859605 [0,2,0,0,0,0|2,0,0]=4 6124 B9R0.8 CCCCC(C)C(C)NC Amb27605555 [0,2,0,0,0,0|2,0,0]=4 6125 B9R0.8 CCCCC(C)C(F)CO Amb27261654 [0,2,0,0,0,0|0,0,2]=4 6126 B9R0.8 CCCCC(C)N(C)C=O Amb28325442 [0,2,0,0,0,0|1,0,0]=3 6127 B9R0.8 CCCCC(Cl)C(Cl)CC Amb26948736 [0,2,0,0,0,0|1,0,1]=4 6128 B9R0.8 CCCCC(F)[C@@H](O)CO Amb24122595 [0,2,0,0,0,0|0,0,2]=4 6129 B9R0.8 CCCCC(O)C(C)CC Amb4020074 [0,2,0,0,0,0|1,0,1]=4 6130 B9R0.8 CCCCC(O)C(C)CN Amb26392245 [0,2,0,0,0,0|1,0,1]=4 6131 B9R0.8 CCCCC(O)C(C)NC Amb27252118 [0,2,0,0,0,0|2,0,0]=4 6132 B9R0.8 CCCCC(O)C(C)OC Amb28049582 [0,2,0,0,0,0|2,0,0]=4 6133 B9R0.8 CCCCC(O)C(N)CO Amb27862099 [0,2,0,0,0,0|0,0,2]=4 6134 B9R0.8 CCCCC(O)C(O)CO Amb8514775 [0,2,0,0,0,0|0,0,2]=4 6135 B9R0.8 CCCCC(O)\C(F)=C\F Amb28050743 [0,2,0,0,0,0|1,0,1]=4 6136 B9R0.8 CCCC[C@@H](C)[C@@H](O)CC Amb27981905 [0,2,0,0,0,0|1,0,1]=4 6137 B9R0.8 CCCC[C@@H](C)[C@H](O)CC Amb27980692 [0,2,0,0,0,0|1,0,1]=4 6138 B9R0.8 CCCC[C@@H](Cl)[C@H](C)CO Amb27843309 [0,2,0,0,0,0|0,0,2]=4 6139 B9R0.8 CCCC[C@@H](N)[C@@H](C)CC Amb27240864 [0,2,0,0,0,0|1,0,1]=4 6140 B9R0.8 CCCC[C@@H](O)[C@@H](C)CC Amb27839219 [0,2,0,0,0,0|1,0,1]=4 6141 B9R0.8 CCCC[C@@H](O)[C@@H](C)CO Amb28125795 [0,2,0,0,0,0|0,0,2]=4 6142 B9R0.8 CCCC[C@@H](O)[C@@H](N)CO Amb28313946 [0,2,0,0,0,0|0,0,2]=4 6143 B9R0.8 CCCC[C@@H](O)[C@H](C)CO Amb27756413 [0,2,0,0,0,0|0,0,2]=4 6144 B9R0.8 CCCC[C@H](O)[C@@H](C)C=O Amb27770429 [0,2,0,0,0,0|0,0,0]=2 6145 B9R0.8 CCCC[C@H](O)[C@@H](C)CO Amb27775544 [0,2,0,0,0,0|0,0,2]=4 6146 B9R0.8 CC[C@H](C)[C@H](O)CCOC Amb27829605 [0,2,0,0,0,0|2,0,0]=4 6147 B9R0.8 CC[C@H](O)[C@H](C)CCOC Amb27839337 [0,2,0,0,0,0|2,0,0]=4 6148 B9R0.8 COC(C)C(O)CCC=O Amb27261367 [0,2,0,0,0,0|1,0,0]=3 6149 B9R0.8 COCCC(C)C(O)C=O Amb27167029 [0,2,0,0,0,0|1,0,0]=3 6150 B9R0.8 COCO[C@@H](C)[C@@H](C)C=O Amb27789557 [0,2,0,0,0,0|2,0,0]=4 6151 B9R0.8 C\C=C(/C)C(O)CCCC Amb27946271 [0,2,0,0,0,0|1,0,1]=4 6152 B9R0.8 C\C=C(/Cl)C(O)CCCC Amb27455885 [0,2,0,0,0,0|1,0,1]=4 6153 B9R0.8 C\C=C\C[C@@H](C)[C@@H](O)CC Amb27397088 [0,2,0,0,0,0|1,0,1]=4 6154 B9R0.18 C#CCCC(C)CNCC Amb28422245 [0,2,0,0,0,0|1,0,1]=4 6155 B9R0.18 C#CCCC(N)CCCC Amb28189655 [0,2,0,0,0,0|1,0,1]=4 6156 B9R0.18 C#CCCC(N)CCSC Amb28050320 [0,2,0,0,0,0|1,0,1]=4 6157 B9R0.18 C#CCCC(O)CCCC Amb27606840 [0,2,0,0,0,0|1,0,1]=4 6158 B9R0.18 C#CCCN(C)CCCC Amb27447929 [0,2,0,0,0,0|1,0,1]=4 6159 B9R0.18 C#CCNC(C)CCCC Amb9621400 [0,2,0,0,0,0|1,0,1]=4 6160 B9R0.18 C#CCN[C@@H](C)CCCC Amb27667410 [0,2,0,0,0,0|1,0,1]=4 6161 B9R0.18 C=C(CCCC)CCCC Amb22641581 [0,2,0,0,0,0|1,0,1]=4 6162 B9R0.18 C=C(CCCC)CCCN Amb27168161 [0,2,0,0,0,0|1,0,1]=4 6163 B9R0.18 C=C(CCCC)CCCO Amb28318705 [0,2,0,0,0,0|0,0,2]=4 6164 B9R0.18 C=C=CCC(O)CCCC Amb27457142 [0,2,0,0,0,0|1,0,0]=3 6165 B9R0.18 C=CC#CC(O)CCCC Amb28189327 [0,2,0,0,0,0|1,0,1]=4 6166 B9R0.18 C=CCCC(=O)CCC=O Amb27792102 [0,2,0,0,0,0|0,0,2]=4 6167 B9R0.18 C=CCCC(=O)CCCO Amb28049909 [0,2,0,0,0,0|1,0,1]=4 6168 B9R0.18 C=CCCC(=O)CCOC Amb28126720 [0,2,0,0,0,0|1,0,1]=4 6169 B9R0.18 C=CCCC(C)CCNC Amb28049531 [0,2,0,0,0,0|1,0,0]=3 6170 B9R0.18 C=CCCC(C)NCCC Amb27615041 [0,2,0,0,0,0|1,0,0]=3 6171 B9R0.18 C=CCCC(C)NCCO Amb27600494 [0,2,0,0,0,0|2,0,0]=4 6172 B9R0.18 C=CCCC(C)NOCC Amb27617099 [0,2,0,0,0,0|2,0,0]=4 6173 B9R0.18 C=CCCC(O)C#CCC Amb24715856 [0,2,0,0,0,0|1,0,1]=4 6174 B9R0.18 C=CCCC(O)CCCCl Amb27794029 [0,2,0,0,0,0|1,0,0]=3 6175 B9R0.18 C=CCCC(O)CCOC Amb28124081 [0,2,0,0,0,0|1,0,0]=3 6176 B9R0.18 C=CCCC(O)CSCC Amb28187146 [0,2,0,0,0,0|1,0,0]=3 6177 B9R0.18 C=CCCC(O)\C=C\CC Amb28064086 [0,2,0,0,0,0|1,0,1]=4 6178 B9R0.18 C=CCCN(C)CCCI Amb27802256 [0,2,0,0,0,0|2,0,0]=4 6179 B9R0.18 C=CCC[C@@H](O)CC#CC Amb28189998 [0,2,0,0,0,0|1,0,1]=4 6180 B9R0.18 C=CCNC(C)CCCCl Amb27601724 [0,2,0,0,0,0|2,0,0]=4 6181 B9R0.18 C=CCNC(C)CCCO Amb27837763 [0,2,0,0,0,0|2,0,0]=4 6182 B9R0.18 C=CCNC(C)CCSC Amb28119555 [0,2,0,0,0,0|2,0,0]=4 6183 B9R0.18 C=CCOC(O)COCC Amb28044331 [0,2,0,0,0,0|2,0,0]=4 6184 B9R0.18 C=CCSC(C)CNCC Amb27657351 [0,2,0,0,0,0|2,0,0]=4 6185 B9R0.18 CC#CCC(N)CCCC Amb27978164 [0,2,0,0,0,0|1,0,1]=4 6186 B9R0.18 CC=C=CC(O)CCCC Amb27835036 [0,2,0,0,0,0|1,0,1]=4 6187 B9R0.18 CCCCB(O)CCCC Amb25797237 [0,2,0,0,0,0|1,0,1]=4 6188 B9R0.18 CCCCC(=O)CCCC Amb534166 [0,2,0,0,0,0|1,0,1]=4 6189 B9R0.18 CCCCC(=O)CCCCl Amb26353274 [0,2,0,0,0,0|1,0,1]=4 6190 B9R0.18 CCCCC(=O)CCCN Amb28050428 [0,2,0,0,0,0|1,0,1]=4 6191 B9R0.18 CCCCC(=O)CCCO Amb25146585 [0,2,0,0,0,0|0,0,2]=4 6192 B9R0.18 CCCCC(=O)CCNC Amb27771104 [0,2,0,0,0,0|2,0,0]=4 6193 B9R0.18 CCCCC(=O)NCC=O Amb17102058 [0,2,0,0,0,0|0,0,1]=3 6194 B9R0.18 CCCCC(=O)\C=C\C=O Amb27252353 [0,2,0,0,0,0|0,0,2]=4 6195 B9R0.18 CCCCC(C)CCCO Amb28256728 [0,2,0,0,0,0|0,0,2]=4 6196 B9R0.18 CCCCC(C)NCCF Amb27196528 [0,2,0,0,0,0|1,0,1]=4 6197 B9R0.18 CCCCC(C)NCCO Amb9640301 [0,2,0,0,0,0|0,0,2]=4 6198 B9R0.18 CCCCC(C)OCC#N Amb4019617 [0,2,0,0,0,0|1,0,1]=4 6199 B9R0.18 CCCCC(Cl)CCC#N Amb27615071 [0,2,0,0,0,0|1,0,1]=4 6200 B9R0.18 CCCCC(Cl)CCCC Amb26844527 [0,2,0,0,0,0|1,0,1]=4 6201 B9R0.18 CCCCC(Cl)CCCCl Amb28313997 [0,2,0,0,0,0|1,0,1]=4 6202 B9R0.18 CCCCC(Cl)CCCO Amb24482147 [0,2,0,0,0,0|0,0,2]=4 6203 B9R0.18 CCCCC(Cl)CN=C=O Amb27400408 [0,2,0,0,0,0|0,0,1]=3 6204 B9R0.18 CCCCC(F)CN=[N+]=[N-] Amb28397471 [0,2,0,0,0,0|2,0,0]=4 6205 B9R0.18 CCCCC(N)CCC=O Amb33036353 [0,2,0,0,0,0|0,0,0]=2 6206 B9R0.18 CCCCC(N)CCCC Amb22229936 [0,2,0,0,0,0|1,0,1]=4 6207 B9R0.18 CCCCC(N)CCSC Amb27466169 [0,2,0,0,0,0|0,1,1]=4 6208 B9R0.18 CCCCC(N)COCC Amb28138872 [0,2,0,0,0,0|1,0,1]=4 6209 B9R0.18 CCCCC(N)CSCC Amb27966627 [0,2,0,0,0,0|1,0,1]=4 6210 B9R0.18 CCCCC(O)CCC#N Amb27198555 [0,2,0,0,0,0|1,0,1]=4 6211 B9R0.18 CCCCC(O)CCC=O Amb27236595 [0,2,0,0,0,0|0,0,0]=2 6212 B9R0.18 CCCCC(O)CCCF Amb28345334 [0,2,0,0,0,0|1,0,1]=4 6213 B9R0.18 CCCCC(O)CCCO Amb27952639 [0,2,0,0,0,0|0,0,2]=4 6214 B9R0.18 CCCCC(O)CCCS Amb27431295 [0,2,0,0,0,0|0,1,1]=4 6215 B9R0.18 CCCCC(O)CCOC Amb27410357 [0,2,0,0,0,0|0,0,2]=4 6216 B9R0.18 CCCCC(O)CN=[N+]=[N-] Amb28245794 [0,2,0,0,0,0|2,0,0]=4 6217 B9R0.18 CCCCC(O)CSC#N Amb27839233 [0,2,0,0,0,0|1,0,1]=4 6218 B9R0.18 CCCCC(O)C\N=N\C Amb27944367 [0,2,0,0,0,0|2,0,0]=4 6219 B9R0.18 CCCCC(O)\C=C\C=O Amb18643941 [0,2,0,0,0,0|0,0,1]=3 6220 B9R0.18 CCCCC(O)\C=C\CO Amb28050649 [0,2,0,0,0,0|0,0,2]=4 6221 B9R0.18 CCCCN(C)CCCC Amb8515459 [0,2,0,0,0,0|1,0,1]=4 6222 B9R0.18 CCCCN(C)CCCCl Amb17334590 [0,2,0,0,0,0|1,0,1]=4 6223 B9R0.18 CCCCN(C)CCCN Amb1108729 [0,2,0,0,0,0|1,0,1]=4 6224 B9R0.18 CCCCN(C)CCNN Amb27444813 [0,2,0,0,0,0|2,0,0]=4 6225 B9R0.18 CCCCN(N)CCCC Amb836806 [0,2,0,0,0,0|1,0,1]=4 6226 B9R0.18 CCCCN(O)CCCC Amb28062392 [0,2,0,0,0,0|1,0,1]=4 6227 B9R0.18 CCCCP(Cl)CCCC Amb22353630 [0,2,0,0,0,0|1,0,1]=4 6228 B9R0.18 CCCCS(=O)CCC#N Amb27839078 [0,2,0,0,0,0|1,0,1]=4 6229 B9R0.18 CCCCS(=O)CCON Amb27855618 [0,2,0,0,0,0|2,0,0]=4 6230 B9R0.18 CCCC[C@@H](C)CCCO Amb27598602 [0,2,0,0,0,0|0,0,2]=4 6231 B9R0.18 CCCC[C@@H](C)\C=C\CO Amb28350350 [0,2,0,0,0,0|0,0,2]=4 6232 B9R0.18 CCCC[C@@H](O)CCC#N Amb27456652 [0,2,0,0,0,0|1,0,1]=4 6233 B9R0.18 CCCC[C@@H](O)\C=C\C#N Amb27770522 [0,2,0,0,0,0|1,0,1]=4 6234 B9R0.18 CCCC[C@H](C)CCCBr Amb27646432 [0,2,0,0,0,0|1,0,1]=4 6235 B9R0.18 CCCC[C@H](C)CCCO Amb27869929 [0,2,0,0,0,0|0,0,2]=4 6236 B9R0.18 CCCC[C@H](N)CNCC Amb27828439 [0,2,0,0,0,0|1,0,1]=4 6237 B9R0.18 CCCC[C@H](O)CCC#N Amb27605391 [0,2,0,0,0,0|1,0,1]=4 6238 B9R0.18 CCCC[C@H](O)CN=[N+]=[N-] Amb28135959 [0,2,0,0,0,0|2,0,0]=4 6239 B9R0.18 CCCC[C@H](O)\C=C\CO Amb27213889 [0,2,0,0,0,0|0,0,2]=4 6240 B9R0.18 CCCC[NH+](C)CCCC Amb33512914 [0,2,0,0,0,0|1,0,1]=4 6241 B9R0.18 CCCC[PH-](=O)CCCC Amb27230858 [0,2,0,0,0,0|1,0,1]=4 6242 B9R0.18 CCCC[PH](=O)CCCC Amb4297292 [0,2,0,0,0,0|1,0,1]=4 6243 B9R0.18 CCCC[Sn](=O)CCCC Amb8513797 [0,2,0,0,0,0|1,0,1]=4 6244 B9R0.18 CCCC\C(C)=N\NC=O Amb28125598 [0,2,0,0,0,0|1,0,1]=4 6245 B9R0.18 CCCNC(C)CCOC Amb27768598 [0,2,0,0,0,0|2,0,0]=4 6246 B9R0.18 CCCOC(=O)CCC=O Amb28049916 [0,2,0,0,0,0|0,0,1]=3 6247 B9R0.18 CCNCC(C)CCCBr Amb28074983 [0,2,0,0,0,0|1,0,1]=4 6248 B9R0.18 CCNCC(C)CCCO Amb27255822 [0,2,0,0,0,0|0,0,2]=4 6249 B9R0.18 CCNCC(O)CCCO Amb25952361 [0,2,0,0,0,0|0,0,2]=4 6250 B9R0.18 CCNC[C@@H](N)CCSC Amb27191520 [0,2,0,0,0,0|2,0,0]=4 6251 B9R0.18 CCOCC(Br)CCCO Amb27617162 [0,2,0,0,0,0|0,0,2]=4 6252 B9R0.18 CCOCC(N)CCOC Amb28204579 [0,2,0,0,0,0|2,0,0]=4 6253 B9R0.18 CCOCC(O)CCCBr Amb27481557 [0,2,0,0,0,0|1,0,1]=4 6254 B9R0.18 CCOCC(O)CCOC Amb27465405 [0,2,0,0,0,0|2,0,0]=4 6255 B9R0.18 CC\C=C\C(=O)CCC=O Amb18643586 [0,2,0,0,0,0|0,0,2]=4 6256 B9R0.18 CN(CCC#N)CCC=O Amb27162770 [0,2,0,0,0,0|1,0,1]=4 6257 B9R0.18 COCCC(Br)CCCO Amb27753938 [0,2,0,0,0,0|0,0,2]=4 6258 B9R0.18 COCCC(C)CCC=O Amb27798414 [0,2,0,0,0,0|0,0,0]=2 6259 B9R0.18 COCCC(C)CCCCl Amb27617182 [0,2,0,0,0,0|1,0,1]=4 6260 B9R0.18 COCCC(C)CCCN Amb27436126 [0,2,0,0,0,0|1,0,1]=4 6261 B9R0.18 COCCC(C)CCCO Amb27663082 [0,2,0,0,0,0|0,0,2]=4 6262 B9R0.18 COCC[C@H](C)CCCBr Amb28325897 [0,2,0,0,0,0|1,0,1]=4 6263 B9R0.18 COCC[C@H](C)CCCO Amb27216439 [0,2,0,0,0,0|0,0,2]=4 6264 B9R0.18 CO\C=C\[C@@H](C)CCC=O Amb27390146 [0,2,0,0,0,0|0,0,2]=4 6265 B9R0.18 C\C=C\CC(N)CCCC Amb26501784 [0,2,0,0,0,0|1,0,0]=3 6266 B9R0.18 C\C=C\CC(O)CCCC Amb28457872 [0,2,0,0,0,0|1,0,0]=3 6267 B9R0.18 C\C=C\CS(=O)CCCC Amb28126420 [0,2,0,0,0,0|1,0,1]=4 6268 B9R0.18 C\C=C\C[C@H](O)CCCC Amb28050754 [0,2,0,0,0,0|1,0,0]=3 6269 B9R0.18 NCCCC(N)CCCN Amb26548774 [0,2,0,0,0,0|1,0,1]=4 6270 B9R0.18 O=CCCS(=O)CCCS Amb27827415 [0,2,0,0,0,0|1,0,0]=3 6271 B9R0.18 O=COCC(O)CCCO Amb27603706 [0,2,0,0,0,0|1,0,0]=3 6272 B9R0.18 OCCCC(O)CCCCl Amb27873417 [0,2,0,0,0,0|0,0,2]=4 6273 B9R0.18 OCCC[C@@H](O)CCCCl Amb27391692 [0,2,0,0,0,0|0,0,2]=4 6274 B9R0.18 OCCC[C@H](O)CCCCl Amb27879294 [0,2,0,0,0,0|0,0,2]=4 6275 B9R0.34 C#CCC(N)CC(C)CC Amb28050563 [0,2,0,0,0,0|1,0,1]=4 6276 B9R0.34 C=CC(=O)CC(N)CCC Amb27842052 [0,2,0,0,0,0|1,0,1]=4 6277 B9R0.34 C=CC(C)CC(O)COC Amb27166980 [0,2,0,0,0,0|2,0,0]=4 6278 B9R0.34 C=CC(C)NC(C)CCC Amb27245822 [0,2,0,0,0,0|2,0,0]=4 6279 B9R0.34 C=CC(N)CC(C)COC Amb27639879 [0,2,0,0,0,0|2,0,0]=4 6280 B9R0.34 C=CC(O)CC(=O)CCC Amb27771610 [0,2,0,0,0,0|1,0,1]=4 6281 B9R0.34 C=CC(O)CC(O)CCC Amb27753023 [0,2,0,0,0,0|1,0,0]=3 6282 B9R0.34 C=CCC(=O)C[C@@H](O)CC Amb27950899 [0,2,0,0,0,0|1,0,1]=4 6283 B9R0.34 C=CCC(C)CC(C)CO Amb27835995 [0,2,0,0,0,0|2,0,0]=4 6284 B9R0.34 C=CCC(C)CC(C)NC Amb27839023 [0,2,0,0,0,0|2,0,0]=4 6285 B9R0.34 C=CCC(O)CC(=C)CC Amb28457011 [0,2,0,0,0,0|1,0,1]=4 6286 B9R0.34 C=CCN(C)C[C@@H](O)CC Amb27457217 [0,2,0,0,0,0|2,0,0]=4 6287 B9R0.34 C=CCN(C)C[C@H](O)CC Amb27771575 [0,2,0,0,0,0|2,0,0]=4 6288 B9R0.34 C=CC[C@@H](O)C[C@H](C)OC Amb27812718 [0,2,0,0,0,0|2,0,0]=4 6289 B9R0.34 C=CC[C@H](C)C[C@H](C)CO Amb28069682 [0,2,0,0,0,0|2,0,0]=4 6290 B9R0.34 C=CC[C@H](O)C[C@H](O)CO Amb28047825 [0,2,0,0,0,0|2,0,0]=4 6291 B9R0.34 CC(C=O)CC(C)CCO Amb27750291 [0,2,0,0,0,0|1,0,0]=3 6292 B9R0.34 CC(CCl)CC(C)CC=O Amb27770595 [0,2,0,0,0,0|1,0,0]=3 6293 B9R0.34 CCC(=O)OC(C)CC=O Amb27754101 [0,2,0,0,0,0|1,0,1]=4 6294 B9R0.34 CCC(C)CC(N)CCO Amb28399464 [0,2,0,0,0,0|0,0,2]=4 6295 B9R0.34 CCC(C)CC(N)COC Amb27780452 [0,2,0,0,0,0|2,0,0]=4 6296 B9R0.34 CCC(C)CC(O)CC#N Amb27849213 [0,2,0,0,0,0|1,0,1]=4 6297 B9R0.34 CCC(C)CC(O)CCN Amb25127021 [0,2,0,0,0,0|1,0,1]=4 6298 B9R0.34 CCC(C)CC(O)CNC Amb27254570 [0,2,0,0,0,0|2,0,0]=4 6299 B9R0.34 CCC(C)CC(O)CSC Amb18798164 [0,2,0,0,0,0|2,0,0]=4 6300 B9R0.34 CCC(N)CC(O)CCO Amb27866271 [0,2,0,0,0,0|0,0,2]=4 6301 B9R0.34 CCCC(=O)O[C@@H](C)C=O Amb28049892 [0,2,0,0,0,0|1,0,1]=4 6302 B9R0.34 CCCC(Br)CC(C)CC Amb28320357 [0,2,0,0,0,0|1,0,1]=4 6303 B9R0.34 CCCC(C)CC(C)CBr Amb26876493 [0,2,0,0,0,0|1,0,1]=4 6304 B9R0.34 CCCC(C)CC(C)CCl Amb25853124 [0,2,0,0,0,0|1,0,1]=4 6305 B9R0.34 CCCC(C)CC(C)CO Amb27869680 [0,2,0,0,0,0|0,0,2]=4 6306 B9R0.34 CCCC(C)CC(N)CO Amb27770369 [0,2,0,0,0,0|0,0,2]=4 6307 B9R0.34 CCCC(C)CC(O)CC Amb27946318 [0,2,0,0,0,0|1,0,1]=4 6308 B9R0.34 CCCC(C)CC(O)CN Amb24718688 [0,2,0,0,0,0|1,0,1]=4 6309 B9R0.34 CCCC(C)\C=C(/C)C=O Amb24381942 [0,2,0,0,0,0|0,0,2]=4 6310 B9R0.34 CCCC(Cl)CC(C)CC Amb27779055 [0,2,0,0,0,0|1,0,1]=4 6311 B9R0.34 CCCC(N)CC(C)CC Amb27667483 [0,2,0,0,0,0|1,0,1]=4 6312 B9R0.34 CCCC(O)CC(C)OC Amb27617002 [0,2,0,0,0,0|2,0,0]=4 6313 B9R0.34 CCCC(O)CC(O)CC Amb9134757 [0,2,0,0,0,0|1,0,1]=4 6314 B9R0.34 CCCC(O)C[C@@H](C)CC Amb27470864 [0,2,0,0,0,0|1,0,1]=4 6315 B9R0.34 CCC[C@@H](C)C[C@@H](C)CO Amb26920680 [0,2,0,0,0,0|0,0,2]=4 6316 B9R0.34 CCC[C@@H](C)C[C@H](C)CO Amb26632583 [0,2,0,0,0,0|0,0,2]=4 6317 B9R0.34 CCC[C@@H](N)CC(C)OC Amb27880809 [0,2,0,0,0,0|2,0,0]=4 6318 B9R0.34 CCC[C@@H](O)CN(C)N=O Amb27766549 [0,2,0,0,0,0|2,0,0]=4 6319 B9R0.34 CCOC(=O)CC(Br)C=O Amb18131015 [0,2,0,0,0,0|1,0,1]=4 6320 B9R0.34 CCOC(=O)C[C@H](C)C=O Amb28049963 [0,2,0,0,0,0|1,0,1]=4 6321 B9R0.34 CCOC(C)O[C@H](C)C=O Amb28123331 [0,2,0,0,0,0|2,0,0]=4 6322 B9R0.34 CC[C@H](C)CC(C)CCBr Amb27403512 [0,2,0,0,0,0|1,0,1]=4 6323 B9R0.34 CC[C@H](C)C[C@@H](C)CC=O Amb27645866 [0,2,0,0,0,0|0,0,0]=2 6324 B9R0.34 CC[C@H](C)C[C@@H](C)CCO Amb27197151 [0,2,0,0,0,0|0,0,2]=4 6325 B9R0.34 CC\C=C(/C)C[C@@H](C)C=O Amb27838144 [0,2,0,0,0,0|0,0,2]=4 6326 B9R0.34 COCC(C)CC(C)C=O Amb27765630 [0,2,0,0,0,0|1,0,0]=3 6327 B9R0.34 COCC(C)CN(C)C=O Amb28049825 [0,2,0,0,0,0|2,0,0]=4 6328 B9R0.34 C\C=C/[C@H](C)C[C@H](C)C=O Amb27166106 [0,2,0,0,0,0|0,0,2]=4 6329 B9R0.34 C\C=C\C(C)CC(Br)CC Amb28240373 [0,2,0,0,0,0|1,0,1]=4 6330 B9R0.34 N=CC(O)CC(O)CCO Amb27397082 [0,2,0,0,0,0|2,0,0]=4 6331 B9R0.34 O=CC[C@H](O)C[C@H](O)CCl Amb27860267 [0,2,0,0,0,0|1,0,0]=3 6332 B9R0.35 C=CCC(=O)C(N)CCC Amb27866592 [0,2,0,0,0,0|1,0,1]=4 6333 B9R0.35 C=CCC(C)C(O)CCO Amb27659653 [0,2,0,0,0,0|2,0,0]=4 6334 B9R0.35 C=CCC(N)C(C)CCC Amb28345096 [0,2,0,0,0,0|1,0,0]=3 6335 B9R0.35 C=CCC(N)C(O)CCC Amb27838078 [0,2,0,0,0,0|1,0,0]=3 6336 B9R0.35 C=CCC(O)C(C)CSC Amb27617017 [0,2,0,0,0,0|2,0,0]=4 6337 B9R0.35 C=CCC(O)C(O)CNC Amb27635815 [0,2,0,0,0,0|2,0,0]=4 6338 B9R0.35 C=CC[C@@H](C)[C@@H](C)CCO Amb27980447 [0,2,0,0,0,0|2,0,0]=4 6339 B9R0.35 C=CC[C@@H](C)[C@H](C)CCO Amb28455654 [0,2,0,0,0,0|2,0,0]=4 6340 B9R0.35 C=CC[C@@H](F)[C@H](O)CCC Amb28126547 [0,2,0,0,0,0|1,0,0]=3 6341 B9R0.35 C=CC[C@@H](O)[C@@H](O)CNC Amb28454503 [0,2,0,0,0,0|2,0,0]=4 6342 B9R0.35 C=CC[C@H](C)[C@@H](C)CCO Amb27221450 [0,2,0,0,0,0|2,0,0]=4 6343 B9R0.35 C=CC[C@H](N)[C@H](O)CCC Amb28120108 [0,2,0,0,0,0|1,0,0]=3 6344 B9R0.35 CCCC(=O)N(C)CC=O Amb17080670 [0,2,0,0,0,0|1,0,1]=4 6345 B9R0.35 CCCC(Br)C(C)COC Amb28292086 [0,2,0,0,0,0|2,0,0]=4 6346 B9R0.35 CCCC(C)C(Br)CCC Amb28049951 [0,2,0,0,0,0|1,0,1]=4 6347 B9R0.35 CCCC(C)C(C)CCC Amb10069377 [0,2,0,0,0,0|1,0,1]=4 6348 B9R0.35 CCCC(C)C(C)CCN Amb25070997 [0,2,0,0,0,0|1,0,1]=4 6349 B9R0.35 CCCC(C)C(C)CNC Amb28049529 [0,2,0,0,0,0|2,0,0]=4 6350 B9R0.35 CCCC(C)C(C)CON Amb33223688 [0,2,0,0,0,0|2,0,0]=4 6351 B9R0.35 CCCC(C)C(C)N=C=O Amb33322344 [0,2,0,0,0,0|1,0,1]=4 6352 B9R0.35 CCCC(C)C(F)CCN Amb27436975 [0,2,0,0,0,0|1,0,1]=4 6353 B9R0.35 CCCC(C)C(O)CC#N Amb26510059 [0,2,0,0,0,0|1,0,1]=4 6354 B9R0.35 CCCC(C)C(O)CCC Amb22229849 [0,2,0,0,0,0|1,0,1]=4 6355 B9R0.35 CCCC(C)C(O)CCN Amb26417455 [0,2,0,0,0,0|1,0,1]=4 6356 B9R0.35 CCCC(C)C(O)CNC Amb25272535 [0,2,0,0,0,0|2,0,0]=4 6357 B9R0.35 CCCC(C)[C@@H](O)CCN Amb33320627 [0,2,0,0,0,0|1,0,1]=4 6358 B9R0.35 CCCC(C)[C@H](O)CCN Amb33418205 [0,2,0,0,0,0|1,0,1]=4 6359 B9R0.35 CCCC(F)C(Br)CCC Amb27855476 [0,2,0,0,0,0|1,0,1]=4 6360 B9R0.35 CCCC(O)C(C)CC=O Amb27401195 [0,2,0,0,0,0|0,0,0]=2 6361 B9R0.35 CCCC(O)C(Cl)CCC Amb27454832 [0,2,0,0,0,0|1,0,1]=4 6362 B9R0.35 CCCC(O)C(O)COC Amb27832887 [0,2,0,0,0,0|2,0,0]=4 6363 B9R0.35 CCC[C@@H](C)[C@@H](O)CCO Amb27790262 [0,2,0,0,0,0|0,0,2]=4 6364 B9R0.35 CCC[C@@H](C)[C@H](O)CCC Amb28050718 [0,2,0,0,0,0|1,0,1]=4 6365 B9R0.35 CCC[C@@H](Cl)[C@H](Cl)CCC Amb28365860 [0,2,0,0,0,0|1,0,1]=4 6366 B9R0.35 CCC[C@H](C)[C@@H](O)CC#N Amb27839228 [0,2,0,0,0,0|1,0,1]=4 6367 B9R0.35 CCC[C@H](Cl)[C@H](Cl)CCC Amb27228458 [0,2,0,0,0,0|1,0,1]=4 6368 B9R0.35 CCC[C@H](N)[C@H](N)CCC Amb27617082 [0,2,0,0,0,0|1,0,1]=4 6369 B9R0.35 CCC[C@H](O)[C@H](Br)CCC Amb27439075 [0,2,0,0,0,0|1,0,1]=4 6370 B9R0.35 CCC[C@H](O)[C@H](O)CCC Amb28428987 [0,2,0,0,0,0|1,0,1]=4 6371 B9R0.35 CCOC(=O)[C@H](O)CC=O Amb28046282 [0,2,0,0,0,0|1,0,1]=4 6372 B9R0.35 COCC(C)C(O)CC=O Amb28050535 [0,2,0,0,0,0|1,0,0]=3 6373 B9R0.35 COCC(C)N(C)CC=O Amb27970654 [0,2,0,0,0,0|2,0,0]=4 6374 B9R0.35 COCC(O)C(O)CC=O Amb27599455 [0,2,0,0,0,0|1,0,0]=3 6375 B9R0.35 C\C=C\C(O)C(C)CC=O Amb26866887 [0,2,0,0,0,0|0,0,2]=4 6376 B9R0.35 C\C=C\[C@@H](C)[C@H](C)CC=O Amb27770450 [0,2,0,0,0,0|0,0,2]=4 6377 B9R0.40 C#CC(CC=C)NCCC Amb27650796 [0,2,0,0,0,0|2,0,0]=4 6378 B9R0.40 C#CC(CC=O)CCC=C Amb27599324 [0,2,0,0,0,0|0,0,2]=4 6379 B9R0.40 C#CCC(CCC=O)OC Amb27838016 [0,2,0,0,0,0|0,0,2]=4 6380 B9R0.40 C#CCC(CO)CCCC Amb27617209 [0,2,0,0,0,0|1,0,1]=4 6381 B9R0.40 C=CC(CCCC)CNC Amb27770600 [0,2,0,0,0,0|2,0,0]=4 6382 B9R0.40 C=CCC(C=O)CCCCl Amb27592487 [0,2,0,0,0,0|2,0,0]=4 6383 B9R0.40 C=CCC(C=O)CCOC Amb27851965 [0,2,0,0,0,0|2,0,0]=4 6384 B9R0.40 C=CCC(CBr)CCCC Amb27267257 [0,2,0,0,0,0|1,0,0]=3 6385 B9R0.40 C=CCC(CBr)CCOC Amb24553870 [0,2,0,0,0,0|2,0,0]=4 6386 B9R0.40 C=CCC(CBr)CCSC Amb26449421 [0,2,0,0,0,0|2,0,0]=4 6387 B9R0.40 C=CCC(CBr)COCC Amb26422429 [0,2,0,0,0,0|2,0,0]=4 6388 B9R0.40 C=CCC(CCCCl)NN Amb28047112 [0,2,0,0,0,0|2,0,0]=4 6389 B9R0.40 C=CCC(CCSC)NC Amb27950391 [0,2,0,0,0,0|2,0,0]=4 6390 B9R0.40 C=CCC(CCSC)NN Amb27171546 [0,2,0,0,0,0|2,0,0]=4 6391 B9R0.40 C=CCC(CCl)CCCC Amb27249760 [0,2,0,0,0,0|1,0,0]=3 6392 B9R0.40 C=CCC(CCl)CCOC Amb28145019 [0,2,0,0,0,0|2,0,0]=4 6393 B9R0.40 C=CCC(CCl)CCSC Amb27212890 [0,2,0,0,0,0|2,0,0]=4 6394 B9R0.40 C=CCC(CCl)COCC Amb26581015 [0,2,0,0,0,0|2,0,0]=4 6395 B9R0.40 C=CCC(CO)CCCO Amb27765655 [0,2,0,0,0,0|2,0,0]=4 6396 B9R0.40 C=CCC(CO)COCC Amb27267347 [0,2,0,0,0,0|2,0,0]=4 6397 B9R0.40 C=CCC(CSCC)NC Amb27464024 [0,2,0,0,0,0|2,0,0]=4 6398 B9R0.40 C=CCC(CSCC)NN Amb27663390 [0,2,0,0,0,0|2,0,0]=4 6399 B9R0.40 C=CCCC(CBr)CCC Amb32689736 [0,2,0,0,0,0|1,0,0]=3 6400 B9R0.40 C=CCCC(CCC)NC Amb28124080 [0,2,0,0,0,0|1,0,0]=3 6401 B9R0.40 C=CCCC(CCl)CCC Amb32689436 [0,2,0,0,0,0|1,0,0]=3 6402 B9R0.40 C=CCCC(COC)NN Amb28050381 [0,2,0,0,0,0|2,0,0]=4 6403 B9R0.40 C=CCCC(CSC)NN Amb27494465 [0,2,0,0,0,0|2,0,0]=4 6404 B9R0.40 C=CCNC(C#N)CCC Amb28040920 [0,2,0,0,0,0|2,0,0]=4 6405 B9R0.40 C=CCNC(CN)CCC Amb27843294 [0,2,0,0,0,0|2,0,0]=4 6406 B9R0.40 C=CCOC(C=O)CCC Amb27409278 [0,2,0,0,0,0|2,0,0]=4 6407 B9R0.40 C=CC[C@H](C=O)CCCC Amb27401115 [0,2,0,0,0,0|1,0,0]=3 6408 B9R0.40 CCC(CCO)CCC=O Amb28239464 [0,2,0,0,0,0|1,0,0]=3 6409 B9R0.40 CCC(CCO)CNC=O Amb27768657 [0,2,0,0,0,0|2,0,0]=4 6410 B9R0.40 CCCC(C=O)CCC#N Amb28049915 [0,2,0,0,0,0|1,0,1]=4 6411 B9R0.40 CCCC(CBr)CCOC Amb25796735 [0,2,0,0,0,0|2,0,0]=4 6412 B9R0.40 CCCC(CBr)CCSC Amb25216790 [0,2,0,0,0,0|2,0,0]=4 6413 B9R0.40 CCCC(CCCCl)NN Amb28208512 [0,2,0,0,0,0|1,0,1]=4 6414 B9R0.40 CCCC(CCNC)OC Amb27253172 [0,2,0,0,0,0|2,0,0]=4 6415 B9R0.40 CCCC(CCOC)NN Amb27601346 [0,2,0,0,0,0|2,0,0]=4 6416 B9R0.40 CCCC(CCSC)NN Amb28289041 [0,2,0,0,0,0|2,0,0]=4 6417 B9R0.40 CCCC(CCl)CCOC Amb26369527 [0,2,0,0,0,0|2,0,0]=4 6418 B9R0.40 CCCC(CCl)CCSC Amb24509339 [0,2,0,0,0,0|2,0,0]=4 6419 B9R0.40 CCCC(CN=C=O)OC Amb27861969 [0,2,0,0,0,0|1,0,1]=4 6420 B9R0.40 CCCC(CO)CCCO Amb27424905 [0,2,0,0,0,0|0,0,2]=4 6421 B9R0.40 CCCC(\C=C\C=O)CC Amb24478199 [0,2,0,0,0,0|0,0,2]=4 6422 B9R0.40 CCCCC(C#N)N=C=O Amb27860495 [0,2,0,0,0,0|1,0,1]=4 6423 B9R0.40 CCCCC(C#N)NC=O Amb27259085 [0,2,0,0,0,0|1,0,0]=3 6424 B9R0.40 CCCCC(C=O)CCC Amb27237029 [0,2,0,0,0,0|1,0,1]=4 6425 B9R0.40 CCCCC(CBr)CCC Amb26369676 [0,2,0,0,0,0|1,0,1]=4 6426 B9R0.40 CCCCC(CC)CC#N Amb4017615 [0,2,0,0,0,0|1,0,1]=4 6427 B9R0.40 CCCCC(CC)CC=O Amb22059367 [0,2,0,0,0,0|0,0,0]=2 6428 B9R0.40 CCCCC(CC)CCC Amb25335776 [0,2,0,0,0,0|1,0,1]=4 6429 B9R0.40 CCCCC(CC)CCN Amb28430735 [0,2,0,0,0,0|1,0,1]=4 6430 B9R0.40 CCCCC(CC)CCO Amb28293407 [0,2,0,0,0,0|0,0,2]=4 6431 B9R0.40 CCCCC(CC)CNC Amb9204013 [0,2,0,0,0,0|2,0,0]=4 6432 B9R0.40 CCCCC(CC)CON Amb27476658 [0,2,0,0,0,0|2,0,0]=4 6433 B9R0.40 CCCCC(CC)C[Mg]Br Amb22000562 [0,2,0,0,0,0|2,0,0]=4 6434 B9R0.40 CCCCC(CC)C[Zn]Br Amb22000364 [0,2,0,0,0,0|2,0,0]=4 6435 B9R0.40 CCCCC(CC)N=C=O Amb7786902 [0,2,0,0,0,0|1,0,1]=4 6436 B9R0.40 CCCCC(CCC)ON Amb28292987 [0,2,0,0,0,0|1,0,1]=4 6437 B9R0.40 CCCCC(CCCl)OC Amb28364152 [0,2,0,0,0,0|1,0,1]=4 6438 B9R0.40 CCCCC(CCl)CCC Amb25206828 [0,2,0,0,0,0|1,0,1]=4 6439 B9R0.40 CCCCC(CN)CCC Amb20632050 [0,2,0,0,0,0|1,0,1]=4 6440 B9R0.40 CCCCC(CNC)OC Amb28386262 [0,2,0,0,0,0|2,0,0]=4 6441 B9R0.40 CCCCC(CO)CCC Amb26011965 [0,2,0,0,0,0|1,0,1]=4 6442 B9R0.40 CCCCC(CO)CCO Amb27810571 [0,2,0,0,0,0|0,0,2]=4 6443 B9R0.40 CCCCC(COC)NN Amb28050347 [0,2,0,0,0,0|2,0,0]=4 6444 B9R0.40 CCCC[C@@H](CC)CCO Amb27829957 [0,2,0,0,0,0|0,0,2]=4 6445 B9R0.40 CCCC[C@@H](CO)CCO Amb27665485 [0,2,0,0,0,0|0,0,2]=4 6446 B9R0.40 CCCC\C(=C\C=O)CC Amb27467797 [0,2,0,0,0,0|0,0,2]=4 6447 B9R0.40 CCCN(CC)CCC=O Amb27464938 [0,2,0,0,0,0|1,0,0]=3 6448 B9R0.40 CCCOC(C=O)CC=O Amb27268515 [0,2,0,0,0,0|1,0,0]=3 6449 B9R0.40 CCN(CC=O)CCCO Amb27615154 [0,2,0,0,0,0|2,0,0]=4 6450 B9R0.40 CC\C=C(/CC)CCC=O Amb27877467 [0,2,0,0,0,0|0,0,2]=4 6451 B9R0.40 COCC(CNC=O)OC Amb27654743 [0,2,0,0,0,0|2,0,0]=4 6452 B9R0.40 COCCC(CO)NC=O Amb27433889 [0,2,0,0,0,0|2,0,0]=4 6453 B9R0.40 C\C=C\C(CO)CCCC Amb28050569 [0,2,0,0,0,0|1,0,1]=4 6454 B9R0.40 [C-]#[N+]CC(CC)CCCC Amb33730142 [0,2,0,0,0,0|2,0,0]=4 6455 B9R0.48 C=C(Br)CNC(C)CCC Amb27410926 [0,2,0,0,0,0|2,0,0]=4 6456 B9R0.48 C=C(C)CCC(O)CCC Amb27424964 [0,2,0,0,0,0|1,0,0]=3 6457 B9R0.48 C=C(C)CCC(O)COC Amb28043414 [0,2,0,0,0,0|2,0,0]=4 6458 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,2,0,0,0,0|0,0,1]=3 6459 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,2,0,0,0,0|0,0,2]=4 6460 B9R0.48 C=CCC(C)CNC(C)C Amb28322205 [0,2,0,0,0,0|2,0,0]=4 6461 B9R0.48 C=CCC(C)NC[C@H](C)O Amb27877205 [0,2,0,0,0,0|2,0,0]=4 6462 B9R0.48 C=CCC(N)CCC(=C)C Amb28056992 [0,2,0,0,0,0|1,0,1]=4 6463 B9R0.48 C=CCC(N)COC(C)C Amb27175442 [0,2,0,0,0,0|2,0,0]=4 6464 B9R0.48 C=CCC(N)CSC(C)C Amb27412132 [0,2,0,0,0,0|2,0,0]=4 6465 B9R0.48 C=CCC(O)CCC(C)=O Amb28194573 [0,2,0,0,0,0|0,0,2]=4 6466 B9R0.48 C=CCC(O)CCC(Cl)Cl Amb27802682 [0,2,0,0,0,0|2,0,0]=4 6467 B9R0.48 C=CCC(O)CCN(C)C Amb27855432 [0,2,0,0,0,0|2,0,0]=4 6468 B9R0.48 C=CCN(C)CCC(C)Br Amb27393969 [0,2,0,0,0,0|2,0,0]=4 6469 B9R0.48 C=CC[C@@H](O)CCC(C)=O Amb28386579 [0,2,0,0,0,0|0,0,2]=4 6470 B9R0.48 C=CC[C@@H](O)COC(C)C Amb27652051 [0,2,0,0,0,0|2,0,0]=4 6471 B9R0.48 CC(=O)CCC(C)CC=O Amb28199726 [0,2,0,0,0,0|0,0,1]=3 6472 B9R0.48 CC(=O)CCC(C)CCN Amb27426882 [0,2,0,0,0,0|1,0,0]=3 6473 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,2,0,0,0,0|1,0,1]=4 6474 B9R0.48 CC(=O)CC[C@@H](C)CCO Amb27944575 [0,2,0,0,0,0|1,0,0]=3 6475 B9R0.48 CC(=O)CC[C@H](C)CC=O Amb27255456 [0,2,0,0,0,0|0,0,1]=3 6476 B9R0.48 CC(=O)CSC(C)CCO Amb27875971 [0,2,0,0,0,0|2,0,0]=4 6477 B9R0.48 CC(=O)NCC(C)CCBr Amb27851099 [0,2,0,0,0,0|2,0,0]=4 6478 B9R0.48 CC(=O)NCC(C)CCCl Amb27162325 [0,2,0,0,0,0|2,0,0]=4 6479 B9R0.48 CC(=O)NCC(C)CCO Amb28364911 [0,2,0,0,0,0|2,0,0]=4 6480 B9R0.48 CC(=O)OCC(C)CC=O Amb18644137 [0,2,0,0,0,0|1,0,1]=4 6481 B9R0.48 CC(=O)OC[C@H](C)CCO Amb27753095 [0,2,0,0,0,0|2,0,0]=4 6482 B9R0.48 CC(C)=CCC(C)CC=O Amb18643637 [0,2,0,0,0,0|0,0,2]=4 6483 B9R0.48 CC(C)CCC(C)CNN Amb27666330 [0,2,0,0,0,0|2,0,0]=4 6484 B9R0.48 CC(C)CCC(C)N=C=O Amb27870889 [0,2,0,0,0,0|1,0,1]=4 6485 B9R0.48 CC(C)CCC(F)CCN Amb27436790 [0,2,0,0,0,0|1,0,1]=4 6486 B9R0.48 CC(C)CCC(O)CC#N Amb28320835 [0,2,0,0,0,0|1,0,1]=4 6487 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|1,0,1]=4 6488 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,2,0,0,0,0|1,0,1]=4 6489 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,2,0,0,0,0|1,0,0]=3 6490 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,2,0,0,0,0|1,0,0]=3 6491 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,2,0,0,0,0|1,0,0]=3 6492 B9R0.48 CC(CCN)CNC(N)=O Amb27455693 [0,2,0,0,0,0|2,0,0]=4 6493 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,2,0,0,0,0|2,0,0]=4 6494 B9R0.48 CC(CCN)SCC(N)=O Amb27234451 [0,2,0,0,0,0|2,0,0]=4 6495 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [0,2,0,0,0,0|2,0,0]=4 6496 B9R0.48 CC(CCO)NCC(N)=O Amb27857723 [0,2,0,0,0,0|2,0,0]=4 6497 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,2,0,0,0,0|1,0,0]=3 6498 B9R0.48 CC(O)CCC(C)OC=O Amb27614301 [0,2,0,0,0,0|1,0,0]=3 6499 B9R0.48 CCCC(=O)CCC(C)=O Amb2721037 [0,2,0,0,0,0|0,0,1]=3 6500 B9R0.48 CCCC(=O)COC(C)=O Amb28437151 [0,2,0,0,0,0|1,0,1]=4 6501 B9R0.48 CCCC(=O)NCC(=O)O Amb5741675 [0,2,0,0,0,0|1,0,1]=4 6502 B9R0.48 CCCC(=O)NCC(N)=O Amb17231980 [0,2,0,0,0,0|1,0,1]=4 6503 B9R0.48 CCCC(=O)OCC(=O)O Amb27655588 [0,2,0,0,0,0|1,0,1]=4 6504 B9R0.48 CCCC(=O)OCC(C)=O Amb28350457 [0,2,0,0,0,0|1,0,1]=4 6505 B9R0.48 CCCC(=O)SCC(=O)O Amb27400351 [0,2,0,0,0,0|1,0,1]=4 6506 B9R0.48 CCCC(Br)CCC(C)C Amb28063055 [0,2,0,0,0,0|1,0,1]=4 6507 B9R0.48 CCCC(Br)CNC(C)=O Amb28146730 [0,2,0,0,0,0|1,0,0]=3 6508 B9R0.48 CCCC(Br)\C=C\C(C)=O Amb27463361 [0,2,0,0,0,0|0,0,2]=4 6509 B9R0.48 CCCC(C)C#CC(=O)O Amb27981033 [0,2,0,0,0,0|0,0,2]=4 6510 B9R0.48 CCCC(C)CCB(O)O Amb25104756 [0,2,0,0,0,0|1,0,1]=4 6511 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,2,0,0,0,0|0,0,0]=2 6512 B9R0.48 CCCC(C)CCC(C)=O Amb10807385 [0,2,0,0,0,0|0,0,0]=2 6513 B9R0.48 CCCC(C)CCC(C)N Amb25775537 [0,2,0,0,0,0|1,0,1]=4 6514 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,2,0,0,0,0|0,0,2]=4 6515 B9R0.48 CCCC(C)CC[C@@H](C)N Amb33223658 [0,2,0,0,0,0|1,0,1]=4 6516 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,2,0,0,0,0|0,0,2]=4 6517 B9R0.48 CCCC(C)CC[C@H](C)N Amb33321143 [0,2,0,0,0,0|1,0,1]=4 6518 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,2,0,0,0,0|0,0,2]=4 6519 B9R0.48 CCCC(C)CC[N+](=O)[O-] Amb33321108 [0,2,0,0,0,0|1,0,0]=3 6520 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [0,2,0,0,0,0|1,0,0]=3 6521 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [0,2,0,0,0,0|1,0,0]=3 6522 B9R0.48 CCCC(C)OCC(C)=O Amb27444940 [0,2,0,0,0,0|1,0,0]=3 6523 B9R0.48 CCCC(C)SCC(C)=O Amb28280192 [0,2,0,0,0,0|1,0,0]=3 6524 B9R0.48 CCCC(C)\C=C\C(=O)O Amb33474963 [0,2,0,0,0,0|0,0,2]=4 6525 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [0,2,0,0,0,0|0,0,2]=4 6526 B9R0.48 CCCC(Cl)CCC(=O)Cl Amb27831367 [0,2,0,0,0,0|0,0,0]=2 6527 B9R0.48 CCCC(N)C#CC(=O)O Amb33168957 [0,2,0,0,0,0|0,0,2]=4 6528 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [0,2,0,0,0,0|0,0,0]=2 6529 B9R0.48 CCCC(N)CCN(C)C Amb18202388 [0,2,0,0,0,0|2,0,0]=4 6530 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [0,2,0,0,0,0|0,0,0]=2 6531 B9R0.48 CCCC(O)CCC(=O)[O-] Amb17778117 [0,2,0,0,0,0|0,0,0]=2 6532 B9R0.48 CCCC(O)CCC(=O)[O-] Amb2386295 [0,2,0,0,0,0|0,0,0]=2 6533 B9R0.48 CCCC(O)CCC(C)C Amb27971606 [0,2,0,0,0,0|1,0,1]=4 6534 B9R0.48 CCCC(O)CNS(C)=O Amb27257176 [0,2,0,0,0,0|2,0,0]=4 6535 B9R0.48 CCCC(O)COC(C)=O Amb27945320 [0,2,0,0,0,0|1,0,0]=3 6536 B9R0.48 CCCC(O)\C=C\C(=O)O Amb27790698 [0,2,0,0,0,0|0,0,2]=4 6537 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [0,2,0,0,0,0|1,0,0]=3 6538 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [0,2,0,0,0,0|1,0,0]=3 6539 B9R0.48 CCCN(C)CCC(N)=O Amb27454732 [0,2,0,0,0,0|1,0,0]=3 6540 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [0,2,0,0,0,0|1,0,0]=3 6541 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [0,2,0,0,0,0|1,0,0]=3 6542 B9R0.48 CCCS(=O)NCC(N)=O Amb27613567 [0,2,0,0,0,0|2,0,0]=4 6543 B9R0.48 CCC[C@@H](N)CCC(C)C Amb28050311 [0,2,0,0,0,0|1,0,1]=4 6544 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [0,2,0,0,0,0|0,0,0]=2 6545 B9R0.48 CCC[C@@H](O)\C=C\C(=O)O Amb27961045 [0,2,0,0,0,0|0,0,2]=4 6546 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,2,0,0,0,0|0,0,0]=2 6547 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [0,2,0,0,0,0|0,0,0]=2 6548 B9R0.48 CCC[C@H](O)CCC(N)=O Amb27765010 [0,2,0,0,0,0|0,0,0]=2 6549 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,2,0,0,0,0|1,0,1]=4 6550 B9R0.48 CCNC(=O)CCC(C)=O Amb17334212 [0,2,0,0,0,0|1,0,1]=4 6551 B9R0.48 CCNC(=O)CCC(N)=O Amb17142864 [0,2,0,0,0,0|1,0,1]=4 6552 B9R0.48 CCN[C@@H](C)CNC(C)=O Amb28137826 [0,2,0,0,0,0|2,0,0]=4 6553 B9R0.48 CCN[C@H](C)CNC(C)=O Amb27267319 [0,2,0,0,0,0|2,0,0]=4 6554 B9R0.48 CCOC(=O)CCC(=O)Cl Amb3939960 [0,2,0,0,0,0|1,0,1]=4 6555 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 6556 B9R0.48 CCOC(=O)CCC(C)=O Amb4605992 [0,2,0,0,0,0|1,0,1]=4 6557 B9R0.48 CCOC(=O)CCC(N)=O Amb8997750 [0,2,0,0,0,0|1,0,1]=4 6558 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,2,0,0,0,0|1,0,0]=3 6559 B9R0.48 CCOC(C)CCC(C)=O Amb27859467 [0,2,0,0,0,0|1,0,0]=3 6560 B9R0.48 CCOC(C)CC[N+](=O)[O-] Amb33425046 [0,2,0,0,0,0|2,0,0]=4 6561 B9R0.48 CCOC(C)CNC(C)=O Amb27174342 [0,2,0,0,0,0|2,0,0]=4 6562 B9R0.48 CCOC(C)COC(C)=O Amb25959518 [0,2,0,0,0,0|2,0,0]=4 6563 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,2,0,0,0,0|2,0,0]=4 6564 B9R0.48 CCSC(=O)CCC(C)=O Amb28253786 [0,2,0,0,0,0|1,0,1]=4 6565 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,2,0,0,0,0|0,0,2]=4 6566 B9R0.48 CC\C=C(/C)CCC(C)=O Amb27464326 [0,2,0,0,0,0|0,0,2]=4 6567 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,2,0,0,0,0|0,0,2]=4 6568 B9R0.48 CN(CCCl)CCC(=O)O Amb27949173 [0,2,0,0,0,0|2,0,0]=4 6569 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [0,2,0,0,0,0|2,0,0]=4 6570 B9R0.48 CN(CCO)CCC(=O)Cl Amb17142907 [0,2,0,0,0,0|2,0,0]=4 6571 B9R0.48 CN(CCO)CCC(=O)O Amb5774461 [0,2,0,0,0,0|2,0,0]=4 6572 B9R0.48 CN(CCO)CCC(N)=O Amb17142868 [0,2,0,0,0,0|2,0,0]=4 6573 B9R0.48 CNCC(C)CNC(N)=O Amb28049490 [0,2,0,0,0,0|2,0,0]=4 6574 B9R0.48 CNCC(O)CNC(C)=O Amb24577191 [0,2,0,0,0,0|2,0,0]=4 6575 B9R0.48 COCC(=O)CCC(=O)O Amb27797755 [0,2,0,0,0,0|1,0,1]=4 6576 B9R0.48 COCC(C)NCC(=O)O Amb33549979 [0,2,0,0,0,0|2,0,0]=4 6577 B9R0.48 COCC(C)NCC(=O)O Amb7766445 [0,2,0,0,0,0|2,0,0]=4 6578 B9R0.48 COCC(C)OCC(=O)O Amb27807862 [0,2,0,0,0,0|2,0,0]=4 6579 B9R0.48 COCC(C)OCC(C)=O Amb27632346 [0,2,0,0,0,0|2,0,0]=4 6580 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [0,2,0,0,0,0|1,0,0]=3 6581 B9R0.48 COCC(Cl)CNC(C)=O Amb28049466 [0,2,0,0,0,0|2,0,0]=4 6582 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [0,2,0,0,0,0|1,0,0]=3 6583 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [0,2,0,0,0,0|1,0,0]=3 6584 B9R0.48 COCC(O)CCC(C)C Amb27625588 [0,2,0,0,0,0|2,0,0]=4 6585 B9R0.48 COC[C@@H](O)CNC(C)=O Amb27663283 [0,2,0,0,0,0|2,0,0]=4 6586 B9R0.48 CSCC(C)NCC(N)=O Amb27865220 [0,2,0,0,0,0|2,0,0]=4 6587 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [0,2,0,0,0,0|1,0,0]=3 6588 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [0,2,0,0,0,0|1,0,0]=3 6589 B9R0.48 CSSC(C)CCC(=O)O Amb27843301 [0,2,0,0,0,0|2,0,0]=4 6590 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,2,0,0,0,0|1,0,1]=4 6591 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,2,0,0,0,0|1,0,0]=3 6592 B9R0.48 C\C(=C/C=O)CCC(C)C Amb27268552 [0,2,0,0,0,0|0,0,2]=4 6593 B9R0.48 C\C(=C\CC(C)C)CC=O Amb28247159 [0,2,0,0,0,0|0,0,2]=4 6594 B9R0.48 C\C=C/[C@@H](O)CCC(C)=O Amb25146706 [0,2,0,0,0,0|0,0,2]=4 6595 B9R0.48 C\C=C\C(Cl)CCC(C)C Amb25322121 [0,2,0,0,0,0|1,0,1]=4 6596 B9R0.48 C\C=C\C(O)CCC(C)=O Amb25142677 [0,2,0,0,0,0|0,0,2]=4 6597 B9R0.48 C\C=C\C(O)CCC(C)C Amb28125762 [0,2,0,0,0,0|1,0,1]=4 6598 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [0,2,0,0,0,0|1,0,0]=3 6599 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [0,2,0,0,0,0|1,0,0]=3 6600 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [0,2,0,0,0,0|1,0,0]=3 6601 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [0,2,0,0,0,0|1,0,0]=3 6602 B9R0.66 C#CCC(C)(O)CCCC Amb27784282 [0,2,0,0,0,0|1,0,1]=4 6603 B9R0.66 C#CCCC(C)(O)CC=O Amb27209691 [0,2,0,0,0,0|0,0,2]=4 6604 B9R0.66 C#CCCC(C)(O)CCC Amb27449316 [0,2,0,0,0,0|1,0,1]=4 6605 B9R0.66 C=CCC(C)(C)CCC=O Amb18643646 [0,2,0,0,0,0|0,0,2]=4 6606 B9R0.66 C=CCC(C)(C)CCCC Amb28250815 [0,2,0,0,0,0|1,0,0]=3 6607 B9R0.66 C=CCC(C)(C)CCCO Amb28064112 [0,2,0,0,0,0|2,0,0]=4 6608 B9R0.66 C=CCC(C)(O)CCCC Amb27658379 [0,2,0,0,0,0|1,0,0]=3 6609 B9R0.66 C=CCC(C)(O)CCCCl Amb27250627 [0,2,0,0,0,0|2,0,0]=4 6610 B9R0.66 C=CCC(C)(O)CCCN Amb28325419 [0,2,0,0,0,0|2,0,0]=4 6611 B9R0.66 C=CCCC(C)(O)CC=O Amb27200164 [0,2,0,0,0,0|0,0,2]=4 6612 B9R0.66 C=CCC[C@](C)(O)CCO Amb28206088 [0,2,0,0,0,0|2,0,0]=4 6613 B9R0.66 C=CCNC(C)(C)CCC Amb27879381 [0,2,0,0,0,0|2,0,0]=4 6614 B9R0.66 CC(C)(CCO)CNC=O Amb28325311 [0,2,0,0,0,0|2,0,0]=4 6615 B9R0.66 CCCCC(C)(C)CCC Amb22052712 [0,2,0,0,0,0|1,0,1]=4 6616 B9R0.66 CCCCC(C)(C)CCN Amb24746135 [0,2,0,0,0,0|1,0,1]=4 6617 B9R0.66 CCCCC(C)(C)CCO Amb27472532 [0,2,0,0,0,0|0,0,2]=4 6618 B9R0.66 CCCCC(C)(C)CON Amb33428414 [0,2,0,0,0,0|2,0,0]=4 6619 B9R0.66 CCCCC(C)(C)N=C=O Amb33428430 [0,2,0,0,0,0|1,0,1]=4 6620 B9R0.66 CCCCC(C)(C)NC=O Amb27615036 [0,2,0,0,0,0|1,0,0]=3 6621 B9R0.66 CCCCC(C)(Cl)CCC Amb25840834 [0,2,0,0,0,0|1,0,1]=4 6622 B9R0.66 CCCCC(C)(N)COC Amb27972381 [0,2,0,0,0,0|2,0,0]=4 6623 B9R0.66 CCCCC(C)(O)CC#N Amb27634973 [0,2,0,0,0,0|1,0,1]=4 6624 B9R0.66 CCCCC(C)(O)CCBr Amb28143708 [0,2,0,0,0,0|1,0,1]=4 6625 B9R0.66 CCCCC(C)(O)CCN Amb28193269 [0,2,0,0,0,0|1,0,1]=4 6626 B9R0.66 CCCCC(C)(O)COC Amb27855937 [0,2,0,0,0,0|2,0,0]=4 6627 B9R0.66 CCCCC(Cl)(Cl)CC=O Amb27760653 [0,2,0,0,0,0|0,0,0]=2 6628 B9R0.66 CCOCC(C)(C)NC=O Amb27983138 [0,2,0,0,0,0|2,0,0]=4 6629 B9R0.66 COCC(C)(C)CCC=O Amb27262879 [0,2,0,0,0,0|1,0,0]=3 6630 B9R0.66 COCC(C)(C)CNC=O Amb27868325 [0,2,0,0,0,0|2,0,0]=4 6631 B9R0.66 COCC(C)(O)CCC=O Amb28364219 [0,2,0,0,0,0|1,0,0]=3 6632 B9R0.66 COCC(C)(O)CNC=O Amb27198956 [0,2,0,0,0,0|2,0,0]=4 6633 B9R0.66 CSCC(C)(N)CCC=O Amb33036328 [0,2,0,0,0,0|1,0,0]=3 6634 B9R0.66 CSCC(C)(O)CNC=O Amb27850984 [0,2,0,0,0,0|2,0,0]=4 6635 B9R0.66 C\C=C\C(C)(C)CCC=O Amb27438313 [0,2,0,0,0,0|0,0,2]=4 6636 B9R0.2 C#CCCCCCC(=O)O Amb22232010 [0,2,0,0,0,0|0,0,1]=3 6637 B9R0.2 C#CCCCCCC(C)=O Amb28053988 [0,2,0,0,0,0|0,0,1]=3 6638 B9R0.2 C#CCCCCCC(N)=O Amb27596626 [0,2,0,0,0,0|0,0,1]=3 6639 B9R0.2 C#CCCCCNC(N)=O Amb28397135 [0,2,0,0,0,0|0,0,2]=4 6640 B9R0.2 C#CCCCNC[C@H](C)O Amb28207467 [0,2,0,0,0,0|1,0,1]=4 6641 B9R0.2 C#CCCCSCC(=O)O Amb27984745 [0,2,0,0,0,0|0,0,2]=4 6642 B9R0.2 C#CCCCSCC(C)=O Amb27484271 [0,2,0,0,0,0|0,0,2]=4 6643 B9R0.2 C#CCCCSCC(C)C Amb27770468 [0,2,0,0,0,0|1,0,1]=4 6644 B9R0.2 C#CCCNCCC(=O)O Amb9326411 [0,2,0,0,0,0|0,0,2]=4 6645 B9R0.2 C#CCCNCCC(C)C Amb27624980 [0,2,0,0,0,0|1,0,1]=4 6646 B9R0.2 C#CCCOCCC(=O)O Amb27406242 [0,2,0,0,0,0|0,0,2]=4 6647 B9R0.2 C#CCCSCCC(N)=O Amb27846787 [0,2,0,0,0,0|0,0,2]=4 6648 B9R0.2 C#CCOCCCC(=O)O Amb9208659 [0,2,0,0,0,0|0,0,2]=4 6649 B9R0.2 C#CCSCCCC(=O)O Amb17503626 [0,2,0,0,0,0|0,0,2]=4 6650 B9R0.2 C=C(Br)CNCCCCC Amb27641587 [0,2,0,0,0,0|1,0,0]=3 6651 B9R0.2 C=C(Br)CNCCCCO Amb27165495 [0,2,0,0,0,0|2,0,0]=4 6652 B9R0.2 C=C(Br)CNCCCSC Amb27443989 [0,2,0,0,0,0|2,0,0]=4 6653 B9R0.2 C=C(Br)COCCCOC Amb27778814 [0,2,0,0,0,0|2,0,0]=4 6654 B9R0.2 C=C(Br)COCCSCC Amb27643203 [0,2,0,0,0,0|2,0,0]=4 6655 B9R0.2 C=C(Br)CSCCCCC Amb27810009 [0,2,0,0,0,0|1,0,0]=3 6656 B9R0.2 C=C(Br)CSCCCOC Amb27831867 [0,2,0,0,0,0|2,0,0]=4 6657 B9R0.2 C=C(C)C#CCCCCC Amb27593421 [0,2,0,0,0,0|1,0,1]=4 6658 B9R0.2 C=C(C)CCCCCCC Amb6298940 [0,2,0,0,0,0|1,0,0]=3 6659 B9R0.2 C=C(C)CCCCCCCl Amb6298888 [0,2,0,0,0,0|1,0,0]=3 6660 B9R0.2 C=C(C)CCCCCNC Amb27489967 [0,2,0,0,0,0|1,0,0]=3 6661 B9R0.2 C=C(C)CCCOCC=O Amb27617165 [0,2,0,0,0,0|0,0,1]=3 6662 B9R0.2 C=C(C)CCC\C=C\C=O Amb18643313 [0,2,0,0,0,0|0,0,2]=4 6663 B9R0.2 C=C(C)CCNCCCN Amb27863043 [0,2,0,0,0,0|2,0,0]=4 6664 B9R0.2 C=C(C)CCOCCCN Amb27615177 [0,2,0,0,0,0|2,0,0]=4 6665 B9R0.2 C=C(C)CCSCCCC Amb27199306 [0,2,0,0,0,0|1,0,0]=3 6666 B9R0.2 C=C(C)CCSCCCN Amb27615176 [0,2,0,0,0,0|2,0,0]=4 6667 B9R0.2 C=C(C)CNCCCCC Amb17308711 [0,2,0,0,0,0|1,0,0]=3 6668 B9R0.2 C=C(C)CNCCOCC Amb28119481 [0,2,0,0,0,0|2,0,0]=4 6669 B9R0.2 C=C(C)COCCCCC Amb27862423 [0,2,0,0,0,0|1,0,0]=3 6670 B9R0.2 C=C(C)CSCCCCC Amb27977453 [0,2,0,0,0,0|1,0,0]=3 6671 B9R0.2 C=C(C)CSCCCCN Amb17500961 [0,2,0,0,0,0|2,0,0]=4 6672 B9R0.2 C=C(C)CSCCSCC Amb27970745 [0,2,0,0,0,0|2,0,0]=4 6673 B9R0.2 C=C(C)\C=C\CCCC=O Amb18643329 [0,2,0,0,0,0|0,0,2]=4 6674 B9R0.2 C=C(Cl)CCCCCCCl Amb6298882 [0,2,0,0,0,0|1,0,0]=3 6675 B9R0.2 C=C(Cl)CNCCCOC Amb18800731 [0,2,0,0,0,0|2,0,0]=4 6676 B9R0.2 C=C(Cl)CNCCCSC Amb27490426 [0,2,0,0,0,0|2,0,0]=4 6677 B9R0.2 C=C(Cl)CSCCCCF Amb27972129 [0,2,0,0,0,0|2,0,0]=4 6678 B9R0.2 C=C(Cl)CSCCSCC Amb27766351 [0,2,0,0,0,0|2,0,0]=4 6679 B9R0.2 C=CCCCC#CC(C)O Amb28069394 [0,2,0,0,0,0|1,0,1]=4 6680 B9R0.2 C=CCCCCCB(O)O Amb27630710 [0,2,0,0,0,0|2,0,0]=4 6681 B9R0.2 C=CCCCCCC(=O)O Amb6299579 [0,2,0,0,0,0|0,0,1]=3 6682 B9R0.2 C=CCCCCCC(C)=O Amb33544200 [0,2,0,0,0,0|0,0,1]=3 6683 B9R0.2 C=CCCCCCC(C)C Amb27205011 [0,2,0,0,0,0|1,0,0]=3 6684 B9R0.2 C=CCCCCCN(C)C Amb27462877 [0,2,0,0,0,0|1,0,0]=3 6685 B9R0.2 C=CCCCCC[C@@H](C)O Amb28318202 [0,2,0,0,0,0|1,0,0]=3 6686 B9R0.2 C=CCCCCNC(C)=O Amb27436512 [0,2,0,0,0,0|0,0,2]=4 6687 B9R0.2 C=CCCCCNC(C)C Amb26067882 [0,2,0,0,0,0|1,0,0]=3 6688 B9R0.2 C=CCCCCOC(C)=O Amb10842183 [0,2,0,0,0,0|0,0,2]=4 6689 B9R0.2 C=CCCCNCC(=O)O Amb28119977 [0,2,0,0,0,0|0,0,2]=4 6690 B9R0.2 C=CCCCNCC(F)F Amb27408117 [0,2,0,0,0,0|2,0,0]=4 6691 B9R0.2 C=CCCCNC[C@@H](C)O Amb28065922 [0,2,0,0,0,0|1,0,0]=3 6692 B9R0.2 C=CCCCNC[C@H](C)O Amb28456202 [0,2,0,0,0,0|1,0,0]=3 6693 B9R0.2 C=CCCCNOC(C)C Amb28381606 [0,2,0,0,0,0|2,0,0]=4 6694 B9R0.2 C=CCCCOCC(=O)O Amb27217276 [0,2,0,0,0,0|0,0,2]=4 6695 B9R0.2 C=CCCCOCC(C)=O Amb27474466 [0,2,0,0,0,0|0,0,2]=4 6696 B9R0.2 C=CCCCSCC(=O)O Amb27838988 [0,2,0,0,0,0|0,0,2]=4 6697 B9R0.2 C=CCCNCCC(=O)O Amb27839020 [0,2,0,0,0,0|0,0,2]=4 6698 B9R0.2 C=CCCNCCC(C)C Amb27458308 [0,2,0,0,0,0|1,0,0]=3 6699 B9R0.2 C=CCCNCCS(C)=O Amb27206219 [0,2,0,0,0,0|2,0,0]=4 6700 B9R0.2 C=CCCOCCC(N)=O Amb27394496 [0,2,0,0,0,0|0,0,2]=4 6701 B9R0.2 C=CCCSCCC(=O)O Amb28201215 [0,2,0,0,0,0|0,0,2]=4 6702 B9R0.2 C=CCNCCCC(C)O Amb27391681 [0,2,0,0,0,0|1,0,0]=3 6703 B9R0.2 C=CCNCCCS(C)=O Amb28240159 [0,2,0,0,0,0|2,0,0]=4 6704 B9R0.2 C=CCOCCCC(=O)O Amb33531507 [0,2,0,0,0,0|0,0,2]=4 6705 B9R0.2 C=CCOCCCC(C)=O Amb27590994 [0,2,0,0,0,0|0,0,2]=4 6706 B9R0.2 C=CCOCCCC(N)=O Amb27629257 [0,2,0,0,0,0|0,0,2]=4 6707 B9R0.2 C=CCOCCNC(C)C Amb27168988 [0,2,0,0,0,0|2,0,0]=4 6708 B9R0.2 C=CCOCSCC(C)Cl Amb26032294 [0,2,0,0,0,0|2,0,0]=4 6709 B9R0.2 C=CCONCCC(C)O Amb27424455 [0,2,0,0,0,0|2,0,0]=4 6710 B9R0.2 C=CCSCCCC(=O)O Amb27392354 [0,2,0,0,0,0|0,0,2]=4 6711 B9R0.2 C=CCSCCCC(C)C Amb28188032 [0,2,0,0,0,0|1,0,0]=3 6712 B9R0.2 C=CCSCCCC(C)O Amb27615003 [0,2,0,0,0,0|1,0,0]=3 6713 B9R0.2 C=CCSCCNC(C)C Amb27979448 [0,2,0,0,0,0|2,0,0]=4 6714 B9R0.2 C=C\C=C\CCCC(C)N Amb25228434 [0,2,0,0,0,0|1,0,1]=4 6715 B9R0.2 C=C\C=C\CCCC(C)O Amb27835919 [0,2,0,0,0,0|1,0,1]=4 6716 B9R0.2 CC#CCCCCC(C)Br Amb27949818 [0,2,0,0,0,0|1,0,1]=4 6717 B9R0.2 CC#CCCCCC(N)=O Amb27258980 [0,2,0,0,0,0|0,0,1]=3 6718 B9R0.2 CC#CCNCCC(=O)O Amb27594145 [0,2,0,0,0,0|0,0,2]=4 6719 B9R0.2 CC#CCNCCC(N)=O Amb28119482 [0,2,0,0,0,0|0,0,2]=4 6720 B9R0.2 CC(=O)CCCC#CCO Amb28201537 [0,2,0,0,0,0|0,0,2]=4 6721 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,2,0,0,0,0|0,0,0]=2 6722 B9R0.2 CC(=O)CCCCCCN Amb32663700 [0,2,0,0,0,0|0,0,0]=2 6723 B9R0.2 CC(=O)CCCCN=C=O Amb27838960 [0,2,0,0,0,0|0,0,2]=4 6724 B9R0.2 CC(=O)CCCCN=C=S Amb27945518 [0,2,0,0,0,0|1,0,1]=4 6725 B9R0.2 CC(=O)CCCSCCO Amb9660259 [0,2,0,0,0,0|1,0,0]=3 6726 B9R0.2 CC(=O)CNCCCC=O Amb24664343 [0,2,0,0,0,0|0,0,1]=3 6727 B9R0.2 CC(=O)CNCCCCN Amb33483477 [0,2,0,0,0,0|1,0,0]=3 6728 B9R0.2 CC(=O)CNCCCCN Amb33483478 [0,2,0,0,0,0|1,0,0]=3 6729 B9R0.2 CC(=O)CSCCCCF Amb27952719 [0,2,0,0,0,0|1,0,0]=3 6730 B9R0.2 CC(=O)CSCCCCN Amb17500952 [0,2,0,0,0,0|1,0,0]=3 6731 B9R0.2 CC(=O)NCCCCC=O Amb24524516 [0,2,0,0,0,0|0,0,1]=3 6732 B9R0.2 CC(=O)NCCCCCCl Amb25709577 [0,2,0,0,0,0|1,0,0]=3 6733 B9R0.2 CC(=O)NCCCCCN Amb18102716 [0,2,0,0,0,0|1,0,0]=3 6734 B9R0.2 CC(=O)NCCCNC=O Amb28197455 [0,2,0,0,0,0|1,0,1]=4 6735 B9R0.2 CC(=O)NCCNCCN Amb27596069 [0,2,0,0,0,0|2,0,0]=4 6736 B9R0.2 CC(=O)NCCOCCBr Amb33528182 [0,2,0,0,0,0|2,0,0]=4 6737 B9R0.2 CC(=O)NCCOCCCl Amb27461485 [0,2,0,0,0,0|2,0,0]=4 6738 B9R0.2 CC(=O)NCCOCCN Amb16233780 [0,2,0,0,0,0|2,0,0]=4 6739 B9R0.2 CC(=O)NCCOCCO Amb24477952 [0,2,0,0,0,0|2,0,0]=4 6740 B9R0.2 CC(=O)NCCSCCN Amb8876526 [0,2,0,0,0,0|2,0,0]=4 6741 B9R0.2 CC(=O)OCCCCC=O Amb26505388 [0,2,0,0,0,0|0,0,1]=3 6742 B9R0.2 CC(=O)OCCCCCBr Amb8516155 [0,2,0,0,0,0|1,0,0]=3 6743 B9R0.2 CC(=O)OCCCCCCl Amb2778974 [0,2,0,0,0,0|1,0,0]=3 6744 B9R0.2 CC(=O)OCCCC[Zn]Br Amb22000480 [0,2,0,0,0,0|2,0,0]=4 6745 B9R0.2 CC(=O)OCCNCCCl Amb28142296 [0,2,0,0,0,0|2,0,0]=4 6746 B9R0.2 CC(=O)OCCOCCCl Amb9787226 [0,2,0,0,0,0|2,0,0]=4 6747 B9R0.2 CC(=O)OCCOCCI Amb28050483 [0,2,0,0,0,0|2,0,0]=4 6748 B9R0.2 CC(=O)OCCSCCO Amb27825930 [0,2,0,0,0,0|2,0,0]=4 6749 B9R0.2 CC(=O)SCCCCC#N Amb28322815 [0,2,0,0,0,0|1,0,1]=4 6750 B9R0.2 CC(=O)SCCCCC=O Amb27432569 [0,2,0,0,0,0|0,0,1]=3 6751 B9R0.2 CC(=O)SCCOCCO Amb28050523 [0,2,0,0,0,0|2,0,0]=4 6752 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [0,2,0,0,0,0|0,0,2]=4 6753 B9R0.2 CC(=O)\C=C\CCCCCl Amb27599396 [0,2,0,0,0,0|0,0,2]=4 6754 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [0,2,0,0,0,0|0,0,2]=4 6755 B9R0.2 CC(=O)\N=C\CCCCO Amb27169910 [0,2,0,0,0,0|1,0,1]=4 6756 B9R0.2 CC(C)=CCCCCC=O Amb18643636 [0,2,0,0,0,0|0,0,1]=3 6757 B9R0.2 CC(C)=CCCCCCCl Amb27879457 [0,2,0,0,0,0|1,0,1]=4 6758 B9R0.2 CC(C)=CCCOCC=O Amb28290541 [0,2,0,0,0,0|0,0,2]=4 6759 B9R0.2 CC(C)CCCCCC#N Amb18643473 [0,2,0,0,0,0|1,0,1]=4 6760 B9R0.2 CC(C)CCCCCC=O Amb22233123 [0,2,0,0,0,0|0,0,0]=2 6761 B9R0.2 CC(C)CCCCCCBr Amb20240805 [0,2,0,0,0,0|1,0,1]=4 6762 B9R0.2 CC(C)CCCCCCN Amb6608741 [0,2,0,0,0,0|1,0,1]=4 6763 B9R0.2 CC(C)CCCCN=C=O Amb28135068 [0,2,0,0,0,0|0,0,1]=3 6764 B9R0.2 CC(C)CCCCN=C=S Amb28049369 [0,2,0,0,0,0|0,1,1]=4 6765 B9R0.2 CC(C)CCCCNC#N Amb28049370 [0,2,0,0,0,0|1,0,1]=4 6766 B9R0.2 CC(C)CCCNCC#N Amb27852693 [0,2,0,0,0,0|1,0,1]=4 6767 B9R0.2 CC(C)CCCNCCBr Amb28368030 [0,2,0,0,0,0|1,0,1]=4 6768 B9R0.2 CC(C)CCCNCCN Amb27950337 [0,2,0,0,0,0|1,0,1]=4 6769 B9R0.2 CC(C)CCCOCCS Amb27979122 [0,2,0,0,0,0|0,1,1]=4 6770 B9R0.2 CC(C)CCCSCC#N Amb28065415 [0,2,0,0,0,0|1,0,1]=4 6771 B9R0.2 CC(C)CCC\C=C/CBr Amb27258137 [0,2,0,0,0,0|1,0,1]=4 6772 B9R0.2 CC(C)CCC\C=C\CBr Amb27435416 [0,2,0,0,0,0|1,0,1]=4 6773 B9R0.2 CC(C)CCC\C=C\CN Amb24560072 [0,2,0,0,0,0|1,0,1]=4 6774 B9R0.2 CC(C)CCC\C=C\CO Amb27427814 [0,2,0,0,0,0|0,0,2]=4 6775 B9R0.2 CC(C)CCNCCC#N Amb6736407 [0,2,0,0,0,0|1,0,1]=4 6776 B9R0.2 CC(C)CCNCCCCl Amb27466095 [0,2,0,0,0,0|1,0,1]=4 6777 B9R0.2 CC(C)CCNCCCN Amb17315309 [0,2,0,0,0,0|1,0,1]=4 6778 B9R0.2 CC(C)CCNCCCO Amb6733599 [0,2,0,0,0,0|0,0,2]=4 6779 B9R0.2 CC(C)CCOCCC#N Amb6258407 [0,2,0,0,0,0|1,0,1]=4 6780 B9R0.2 CC(C)CCOCCCN Amb6248634 [0,2,0,0,0,0|1,0,1]=4 6781 B9R0.2 CC(C)CCOCCCS Amb27594404 [0,2,0,0,0,0|0,1,1]=4 6782 B9R0.2 CC(C)CCSCCC=O Amb27589044 [0,2,0,0,0,0|0,0,0]=2 6783 B9R0.2 CC(C)CCSCCCN Amb17500699 [0,2,0,0,0,0|1,0,1]=4 6784 B9R0.2 CC(C)CCSCCCO Amb17502843 [0,2,0,0,0,0|0,0,2]=4 6785 B9R0.2 CC(C)CCSCCON Amb28062828 [0,2,0,0,0,0|2,0,0]=4 6786 B9R0.2 CC(C)CNCCCC#N Amb6707255 [0,2,0,0,0,0|1,0,1]=4 6787 B9R0.2 CC(C)CNCCCCBr Amb27839561 [0,2,0,0,0,0|1,0,1]=4 6788 B9R0.2 CC(C)CNCCCCN Amb17334222 [0,2,0,0,0,0|1,0,1]=4 6789 B9R0.2 CC(C)CNCCCCO Amb17334252 [0,2,0,0,0,0|0,0,2]=4 6790 B9R0.2 CC(C)COCCCCBr Amb8855451 [0,2,0,0,0,0|1,0,1]=4 6791 B9R0.2 CC(C)COCCCCCl Amb18798375 [0,2,0,0,0,0|1,0,1]=4 6792 B9R0.2 CC(C)COCCCCO Amb27617219 [0,2,0,0,0,0|0,0,2]=4 6793 B9R0.2 CC(C)COCCCON Amb27420849 [0,2,0,0,0,0|2,0,0]=4 6794 B9R0.2 CC(C)CSCCCC#N Amb7764593 [0,2,0,0,0,0|1,0,1]=4 6795 B9R0.2 CC(C)CSCCCCN Amb9391257 [0,2,0,0,0,0|1,0,1]=4 6796 B9R0.2 CC(C)CSCCN=C=O Amb28067886 [0,2,0,0,0,0|1,0,1]=4 6797 B9R0.2 CC(C)CSCCNC=O Amb27447537 [0,2,0,0,0,0|1,0,0]=3 6798 B9R0.2 CC(C)NCCCCCCl Amb27257059 [0,2,0,0,0,0|1,0,1]=4 6799 B9R0.2 CC(C)NCCCCCF Amb27594142 [0,2,0,0,0,0|1,0,1]=4 6800 B9R0.2 CC(C)NCCCCCI Amb27619570 [0,2,0,0,0,0|1,0,1]=4 6801 B9R0.2 CC(C)NCCCCCN Amb21953734 [0,2,0,0,0,0|1,0,1]=4 6802 B9R0.2 CC(C)NCCCCCO Amb17334255 [0,2,0,0,0,0|0,0,2]=4 6803 B9R0.2 CC(C)N\N=C\CCC=O Amb28241380 [0,2,0,0,0,0|1,0,1]=4 6804 B9R0.2 CC(C)OCCCCC#N Amb27223079 [0,2,0,0,0,0|1,0,1]=4 6805 B9R0.2 CC(C)OCCCCC=O Amb33172005 [0,2,0,0,0,0|0,0,0]=2 6806 B9R0.2 CC(C)OCCCCCBr Amb25060878 [0,2,0,0,0,0|1,0,1]=4 6807 B9R0.2 CC(C)OCCCCCCl Amb9001658 [0,2,0,0,0,0|1,0,1]=4 6808 B9R0.2 CC(C)OCCCCCN Amb25049832 [0,2,0,0,0,0|1,0,1]=4 6809 B9R0.2 CC(C)OCCCN=C=O Amb5750729 [0,2,0,0,0,0|1,0,1]=4 6810 B9R0.2 CC(C)OCCCNC=O Amb28129481 [0,2,0,0,0,0|1,0,0]=3 6811 B9R0.2 CC(C)SCCCCC=O Amb28065431 [0,2,0,0,0,0|0,0,0]=2 6812 B9R0.2 CC(C)SCCCCCN Amb18792402 [0,2,0,0,0,0|1,0,1]=4 6813 B9R0.2 CC(C)SCCCCCS Amb27833893 [0,2,0,0,0,0|0,1,1]=4 6814 B9R0.2 CC(Cl)CCCCCCN Amb28137853 [0,2,0,0,0,0|1,0,1]=4 6815 B9R0.2 CC(Cl)CCNC\C=C\Cl Amb27245799 [0,2,0,0,0,0|1,0,1]=4 6816 B9R0.2 CC(N)CCSCCCN Amb27755582 [0,2,0,0,0,0|1,0,1]=4 6817 B9R0.2 CC(N)CSCCCC#N Amb27231289 [0,2,0,0,0,0|1,0,1]=4 6818 B9R0.2 CC(N)CSCCCCO Amb27801506 [0,2,0,0,0,0|0,0,2]=4 6819 B9R0.2 CC(O)CCCCCCO Amb27272851 [0,2,0,0,0,0|0,0,2]=4 6820 B9R0.2 CC(O)CCCCN=C=S Amb27805091 [0,2,0,0,0,0|0,1,1]=4 6821 B9R0.2 CC(O)CCCCN=[N+]=[N-] Amb27399168 [0,2,0,0,0,0|2,0,0]=4 6822 B9R0.2 CC(O)CCCNCCN Amb27253160 [0,2,0,0,0,0|1,0,1]=4 6823 B9R0.2 CC(O)CCCNCCO Amb28343143 [0,2,0,0,0,0|0,0,2]=4 6824 B9R0.2 CC(O)CCC\C=C\CCl Amb24502312 [0,2,0,0,0,0|1,0,1]=4 6825 B9R0.2 CC(O)CCC\C=C\CO Amb27604113 [0,2,0,0,0,0|0,0,2]=4 6826 B9R0.2 CC(O)CCNCCC#N Amb27754005 [0,2,0,0,0,0|1,0,1]=4 6827 B9R0.2 CC(O)CCNCCCF Amb27817504 [0,2,0,0,0,0|1,0,1]=4 6828 B9R0.2 CC(O)COCCCCN Amb28246831 [0,2,0,0,0,0|1,0,1]=4 6829 B9R0.2 CC=C=CCCCC(C)O Amb27465759 [0,2,0,0,0,0|1,0,1]=4 6830 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [0,2,0,0,0,0|0,0,1]=3 6831 B9R0.2 CCC#CCCCC(C)=O Amb27836855 [0,2,0,0,0,0|0,0,1]=3 6832 B9R0.2 CCC#CCCOC(C)=O Amb22641578 [0,2,0,0,0,0|0,0,2]=4 6833 B9R0.2 CCC#CCOCC(=O)O Amb27425006 [0,2,0,0,0,0|0,0,2]=4 6834 B9R0.2 CCCC#CCCC(=O)O Amb27663886 [0,2,0,0,0,0|0,0,1]=3 6835 B9R0.2 CCCC#CCCC(N)=O Amb28054810 [0,2,0,0,0,0|0,0,1]=3 6836 B9R0.2 CCCC=C=CCC(=O)O Amb27814505 [0,2,0,0,0,0|0,0,2]=4 6837 B9R0.2 CCCCC#CCC(=O)O Amb26327934 [0,2,0,0,0,0|0,0,1]=3 6838 B9R0.2 CCCCC=C=CC(=O)O Amb17593544 [0,2,0,0,0,0|0,0,2]=4 6839 B9R0.2 CCCCCC#CC(=O)Cl Amb27950037 [0,2,0,0,0,0|0,0,1]=3 6840 B9R0.2 CCCCCC#CC(=O)O Amb2778506 [0,2,0,0,0,0|0,0,1]=3 6841 B9R0.2 CCCCCCCB(O)O Amb13890611 [0,2,0,0,0,0|0,0,2]=4 6842 B9R0.2 CCCCCCCC(=O)Cl Amb3940245 [0,2,0,0,0,0|0,0,0]=2 6843 B9R0.2 CCCCCCCC(=O)O Amb3940371 [0,2,0,0,0,0|0,0,0]=2 6844 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,2,0,0,0,0|0,0,0]=2 6845 B9R0.2 CCCCCCCC(=O)[O-] Amb33756883 [0,2,0,0,0,0|0,0,0]=2 6846 B9R0.2 CCCCCCCC(=O)[O-] Amb8515835 [0,2,0,0,0,0|0,0,0]=2 6847 B9R0.2 CCCCCCCC(C)=O Amb6891951 [0,2,0,0,0,0|0,0,0]=2 6848 B9R0.2 CCCCCCCC(C)Br Amb3940567 [0,2,0,0,0,0|1,0,1]=4 6849 B9R0.2 CCCCCCCC(C)C Amb6366303 [0,2,0,0,0,0|1,0,1]=4 6850 B9R0.2 CCCCCCCC(C)S Amb7795228 [0,2,0,0,0,0|0,1,1]=4 6851 B9R0.2 CCCCCCCC(N)=O Amb8999028 [0,2,0,0,0,0|0,0,0]=2 6852 B9R0.2 CCCCCCCP(O)O Amb28042243 [0,2,0,0,0,0|0,0,2]=4 6853 B9R0.2 CCCCCCCS(=O)Cl Amb32720351 [0,2,0,0,0,0|0,0,1]=3 6854 B9R0.2 CCCCCCCS(=O)[O-] Amb32754186 [0,2,0,0,0,0|0,0,1]=3 6855 B9R0.2 CCCCCCCS(N)=O Amb32720352 [0,2,0,0,0,0|0,0,1]=3 6856 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [0,2,0,0,0,0|1,0,1]=4 6857 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [0,2,0,0,0,0|1,0,1]=4 6858 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|0,0,2]=4 6859 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [0,2,0,0,0,0|1,0,1]=4 6860 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|0,0,2]=4 6861 B9R0.2 CCCCCCC[N+](=O)[O-] Amb17672611 [0,2,0,0,0,0|0,0,1]=3 6862 B9R0.2 CCCCCCNC(C)=O Amb3368460 [0,2,0,0,0,0|0,0,0]=2 6863 B9R0.2 CCCCCCNC(N)=O Amb23569596 [0,2,0,0,0,0|0,0,0]=2 6864 B9R0.2 CCCCCCNC(N)=S Amb1152526 [0,2,0,0,0,0|0,1,0]=3 6865 B9R0.2 CCCCCCOC(=O)Cl Amb10070637 [0,2,0,0,0,0|0,0,0]=2 6866 B9R0.2 CCCCCCOC(=S)[S-] Amb594881 [0,2,0,0,0,0|0,1,0]=3 6867 B9R0.2 CCCCCCOC(C)=O Amb8513414 [0,2,0,0,0,0|0,0,0]=2 6868 B9R0.2 CCCCCCOC(C)C Amb28320041 [0,2,0,0,0,0|1,0,1]=4 6869 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [0,2,0,0,0,0|1,0,1]=4 6870 B9R0.2 CCCCCCOC(C)O Amb28347016 [0,2,0,0,0,0|0,0,2]=4 6871 B9R0.2 CCCCCCOC(N)=O Amb22495526 [0,2,0,0,0,0|0,0,0]=2 6872 B9R0.2 CCCCCCOP(Cl)Cl Amb27169941 [0,2,0,0,0,0|2,0,0]=4 6873 B9R0.2 CCCCCCO[N+](=O)[O-] Amb27233862 [0,2,0,0,0,0|1,0,0]=3 6874 B9R0.2 CCCCCCSC(=N)N Amb20676030 [0,2,0,0,0,0|1,0,0]=3 6875 B9R0.2 CCCCCCSC(=N)N Amb22487386 [0,2,0,0,0,0|1,0,0]=3 6876 B9R0.2 CCCCCCSC(=N)N Amb27811857 [0,2,0,0,0,0|1,0,0]=3 6877 B9R0.2 CCCCCCSC(=O)Cl Amb28421765 [0,2,0,0,0,0|0,0,0]=2 6878 B9R0.2 CCCCCCSC(C)=O Amb27837874 [0,2,0,0,0,0|0,0,0]=2 6879 B9R0.2 CCCCCCSC(C)C Amb28315852 [0,2,0,0,0,0|1,0,1]=4 6880 B9R0.2 CCCCCCSC(N)=S Amb28342219 [0,2,0,0,0,0|0,1,0]=3 6881 B9R0.2 CCCCCC\C=C(\C)I Amb28464058 [0,2,0,0,0,0|1,0,0]=3 6882 B9R0.2 CCCCCNCC(N)=O Amb6708061 [0,2,0,0,0,0|0,0,0]=2 6883 B9R0.2 CCCCCOCC(=O)O Amb8902706 [0,2,0,0,0,0|0,0,0]=2 6884 B9R0.2 CCCCCOCC(C)N Amb8902896 [0,2,0,0,0,0|1,0,1]=4 6885 B9R0.2 CCCCCOC[C@@H](C)N Amb27490460 [0,2,0,0,0,0|1,0,1]=4 6886 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [0,2,0,0,0,0|0,0,2]=4 6887 B9R0.2 CCCCCONC(N)=O Amb2899790 [0,2,0,0,0,0|1,0,0]=3 6888 B9R0.2 CCCCCSCC(=O)O Amb6249571 [0,2,0,0,0,0|0,0,0]=2 6889 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [0,2,0,0,0,0|1,0,1]=4 6890 B9R0.2 CCCCC\C=C\B(O)O Amb10068584 [0,2,0,0,0,0|0,0,2]=4 6891 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [0,2,0,0,0,0|1,0,1]=4 6892 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [0,2,0,0,0,0|0,0,2]=4 6893 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [0,2,0,0,0,0|0,0,2]=4 6894 B9R0.2 CCCCNCCC(=O)O Amb7755713 [0,2,0,0,0,0|0,0,0]=2 6895 B9R0.2 CCCCNCCC(C)=O Amb26381876 [0,2,0,0,0,0|0,0,0]=2 6896 B9R0.2 CCCCNCCC(C)O Amb27986026 [0,2,0,0,0,0|0,0,2]=4 6897 B9R0.2 CCCCNCCC(N)=O Amb8841106 [0,2,0,0,0,0|0,0,0]=2 6898 B9R0.2 CCCCNCCN(C)C Amb1124804 [0,2,0,0,0,0|2,0,0]=4 6899 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [0,2,0,0,0,0|0,0,2]=4 6900 B9R0.2 CCCCOCCC(Cl)Cl Amb27232855 [0,2,0,0,0,0|1,0,1]=4 6901 B9R0.2 CCCCOCCC(N)=O Amb27480748 [0,2,0,0,0,0|0,0,0]=2 6902 B9R0.2 CCCCOCCC(N)=S Amb8895295 [0,2,0,0,0,0|0,1,0]=3 6903 B9R0.2 CCCCOCCN(C)C Amb27192355 [0,2,0,0,0,0|2,0,0]=4 6904 B9R0.2 CCCCO\C=C\C(=O)Cl Amb27804268 [0,2,0,0,0,0|0,0,2]=4 6905 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,2,0,0,0,0|0,0,0]=2 6906 B9R0.2 CCCCSCCC(C)C Amb27651351 [0,2,0,0,0,0|1,0,1]=4 6907 B9R0.2 CCCCSCCC(C)N Amb28189560 [0,2,0,0,0,0|1,0,1]=4 6908 B9R0.2 CCCCSCCC(N)=S Amb17503251 [0,2,0,0,0,0|0,1,0]=3 6909 B9R0.2 CCCCS\C=C/C(C)=O Amb27945160 [0,2,0,0,0,0|0,0,2]=4 6910 B9R0.2 CCCCS\C=C\C(C)=O Amb26410917 [0,2,0,0,0,0|0,0,2]=4 6911 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [0,2,0,0,0,0|0,0,1]=3 6912 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [0,2,0,0,0,0|0,0,1]=3 6913 B9R0.2 CCCC\C=C\CC(N)=O Amb1815461 [0,2,0,0,0,0|0,0,1]=3 6914 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [0,2,0,0,0,0|0,0,2]=4 6915 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [0,2,0,0,0,0|0,0,2]=4 6916 B9R0.2 CCCC\C=N\NC(N)=O Amb28050098 [0,2,0,0,0,0|1,0,1]=4 6917 B9R0.2 CCCNCCC=C(C)C Amb27238155 [0,2,0,0,0,0|1,0,1]=4 6918 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,2,0,0,0,0|0,0,0]=2 6919 B9R0.2 CCCNCCCC(C)C Amb8853733 [0,2,0,0,0,0|1,0,1]=4 6920 B9R0.2 CCCNCCCC(C)N Amb27475709 [0,2,0,0,0,0|1,0,1]=4 6921 B9R0.2 CCCNCCCN(C)C Amb6699374 [0,2,0,0,0,0|2,0,0]=4 6922 B9R0.2 CCCNCCNS(C)=O Amb27265740 [0,2,0,0,0,0|2,0,0]=4 6923 B9R0.2 CCCNCCOC(N)=O Amb27828395 [0,2,0,0,0,0|1,0,0]=3 6924 B9R0.2 CCCOCC#CC(N)=O Amb33495811 [0,2,0,0,0,0|0,0,2]=4 6925 B9R0.2 CCCOCCCC(=N)N Amb8874875 [0,2,0,0,0,0|1,0,0]=3 6926 B9R0.2 CCCOCCCC(=O)O Amb8874517 [0,2,0,0,0,0|0,0,0]=2 6927 B9R0.2 CCCOCCCC(C)Cl Amb27795432 [0,2,0,0,0,0|1,0,1]=4 6928 B9R0.2 CCCOCCCC(N)=S Amb8874843 [0,2,0,0,0,0|0,1,0]=3 6929 B9R0.2 CCCOCCOC(=O)Cl Amb26963668 [0,2,0,0,0,0|1,0,0]=3 6930 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,2,0,0,0,0|1,0,0]=3 6931 B9R0.2 CCCOCCOC(N)=O Amb27265626 [0,2,0,0,0,0|1,0,0]=3 6932 B9R0.2 CCCOCCSC(=N)N Amb27837335 [0,2,0,0,0,0|2,0,0]=4 6933 B9R0.2 CCCONCCC(=O)O Amb27233908 [0,2,0,0,0,0|1,0,0]=3 6934 B9R0.2 CCCSCCCC(=O)O Amb6680215 [0,2,0,0,0,0|0,0,0]=2 6935 B9R0.2 CCCSCCCC(C)=O Amb9660304 [0,2,0,0,0,0|0,0,0]=2 6936 B9R0.2 CCCSCCCC(C)N Amb27838926 [0,2,0,0,0,0|1,0,1]=4 6937 B9R0.2 CCCSCCNC(N)=O Amb28345909 [0,2,0,0,0,0|1,0,0]=3 6938 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [0,2,0,0,0,0|0,0,1]=3 6939 B9R0.2 CCC\C=C/COC(N)=O Amb27413052 [0,2,0,0,0,0|0,0,2]=4 6940 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [0,2,0,0,0,0|0,0,1]=3 6941 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [0,2,0,0,0,0|0,0,1]=3 6942 B9R0.2 CCC\C=C\CCC(N)=O Amb27493443 [0,2,0,0,0,0|0,0,1]=3 6943 B9R0.2 CCC\C=C\CC[N+](=O)[O-] Amb33424827 [0,2,0,0,0,0|1,0,1]=4 6944 B9R0.2 CCC\C=C\COC(C)=O Amb8515402 [0,2,0,0,0,0|0,0,2]=4 6945 B9R0.2 CCC\C=N\NCC(=O)O Amb27432508 [0,2,0,0,0,0|1,0,1]=4 6946 B9R0.2 CCC\C=N\NCC(N)=O Amb27853075 [0,2,0,0,0,0|1,0,1]=4 6947 B9R0.2 CCC\C=N\OCC(N)=O Amb27255660 [0,2,0,0,0,0|1,0,1]=4 6948 B9R0.2 CCNCCCCC(=O)O Amb24385094 [0,2,0,0,0,0|0,0,0]=2 6949 B9R0.2 CCNCCCCC(=O)O Amb32686610 [0,2,0,0,0,0|0,0,0]=2 6950 B9R0.2 CCNCCCCC(C)=O Amb27951143 [0,2,0,0,0,0|0,0,0]=2 6951 B9R0.2 CCNCCCCC(N)=O Amb27964384 [0,2,0,0,0,0|0,0,0]=2 6952 B9R0.2 CCNCCCCN(C)C Amb27254437 [0,2,0,0,0,0|2,0,0]=4 6953 B9R0.2 CCNCCCNC(=N)N Amb27759465 [0,2,0,0,0,0|2,0,0]=4 6954 B9R0.2 CCNCCCNC(N)=O Amb9466113 [0,2,0,0,0,0|1,0,0]=3 6955 B9R0.2 CCOCCC#CC(=O)O Amb33168968 [0,2,0,0,0,0|0,0,2]=4 6956 B9R0.2 CCOCCCCC(=N)N Amb28352192 [0,2,0,0,0,0|1,0,0]=3 6957 B9R0.2 CCOCCCCC(=O)O Amb9207786 [0,2,0,0,0,0|0,0,0]=2 6958 B9R0.2 CCOCCCCC(C)=O Amb9659807 [0,2,0,0,0,0|0,0,0]=2 6959 B9R0.2 CCOCCCCC(N)=S Amb18180039 [0,2,0,0,0,0|0,1,0]=3 6960 B9R0.2 CCOCCCNC(C)=O Amb3886591 [0,2,0,0,0,0|1,0,0]=3 6961 B9R0.2 CCOCCCNC(N)=O Amb404787 [0,2,0,0,0,0|1,0,0]=3 6962 B9R0.2 CCOCCCNC(N)=S Amb446862 [0,2,0,0,0,0|1,1,0]=4 6963 B9R0.2 CCOCCCOC(C)=O Amb22733319 [0,2,0,0,0,0|1,0,0]=3 6964 B9R0.2 CCOCCCSC(=N)N Amb28204042 [0,2,0,0,0,0|2,0,0]=4 6965 B9R0.2 CCOCCOCC(=O)O Amb6258165 [0,2,0,0,0,0|1,0,0]=3 6966 B9R0.2 CCOCCOCC(N)=O Amb28203011 [0,2,0,0,0,0|1,0,0]=3 6967 B9R0.2 CCOCCONC(N)=O Amb27432448 [0,2,0,0,0,0|2,0,0]=4 6968 B9R0.2 CCOCSCCC(=O)O Amb27447358 [0,2,0,0,0,0|1,0,0]=3 6969 B9R0.2 CCONCCCC(=O)O Amb27839067 [0,2,0,0,0,0|1,0,0]=3 6970 B9R0.2 CCSCCCCC(=O)O Amb7782874 [0,2,0,0,0,0|0,0,0]=2 6971 B9R0.2 CCSCCCCC(C)Br Amb27867199 [0,2,0,0,0,0|1,0,1]=4 6972 B9R0.2 CCSCCCOC(C)=O Amb27605064 [0,2,0,0,0,0|1,0,0]=3 6973 B9R0.2 CCSCCONC(C)=O Amb28070443 [0,2,0,0,0,0|2,0,0]=4 6974 B9R0.2 CCSCCONC(N)=O Amb28185803 [0,2,0,0,0,0|2,0,0]=4 6975 B9R0.2 CCSCCSCC(=O)O Amb28126747 [0,2,0,0,0,0|1,0,0]=3 6976 B9R0.2 CCSCCSCC(N)=O Amb28293850 [0,2,0,0,0,0|1,0,0]=3 6977 B9R0.2 CC\C=C\CCCC(C)N Amb28247293 [0,2,0,0,0,0|1,0,1]=4 6978 B9R0.2 CC\C=C\CCOC(C)=O Amb9134795 [0,2,0,0,0,0|0,0,2]=4 6979 B9R0.2 CC\C=C\CNCC(=O)O Amb27422845 [0,2,0,0,0,0|0,0,2]=4 6980 B9R0.2 CN(C)CCCCCC#N Amb27234781 [0,2,0,0,0,0|1,0,1]=4 6981 B9R0.2 CN(C)CCCCCC=O Amb25743404 [0,2,0,0,0,0|0,0,0]=2 6982 B9R0.2 CN(C)CCCCCCBr Amb27759352 [0,2,0,0,0,0|1,0,1]=4 6983 B9R0.2 CN(C)CCCCCCCl Amb18800750 [0,2,0,0,0,0|1,0,1]=4 6984 B9R0.2 CN(C)CCCCCCN Amb2721296 [0,2,0,0,0,0|1,0,1]=4 6985 B9R0.2 CN(C)CCCCCCO Amb17613201 [0,2,0,0,0,0|0,0,2]=4 6986 B9R0.2 CN(C)CCCCN=C=O Amb26567743 [0,2,0,0,0,0|1,0,1]=4 6987 B9R0.2 CN(C)CCSCCC=O Amb27837824 [0,2,0,0,0,0|1,0,0]=3 6988 B9R0.2 CNCCCCCC(C)=O Amb25728176 [0,2,0,0,0,0|0,0,0]=2 6989 B9R0.2 CNCCCCCC(N)=O Amb27625362 [0,2,0,0,0,0|0,0,0]=2 6990 B9R0.2 CNCCCCOC(C)C Amb27668355 [0,2,0,0,0,0|2,0,0]=4 6991 B9R0.2 CNCCCNCC(C)C Amb28193252 [0,2,0,0,0,0|2,0,0]=4 6992 B9R0.2 CNCCCSCC(C)N Amb27815759 [0,2,0,0,0,0|2,0,0]=4 6993 B9R0.2 CNCCOCCC(=O)O Amb18111840 [0,2,0,0,0,0|1,0,0]=3 6994 B9R0.2 CNCCOCCC(C)=O Amb18630756 [0,2,0,0,0,0|1,0,0]=3 6995 B9R0.2 CNCCOCCC(N)=O Amb28122222 [0,2,0,0,0,0|1,0,0]=3 6996 B9R0.2 CNCCOCCS(C)=O Amb28197250 [0,2,0,0,0,0|2,0,0]=4 6997 B9R0.2 CNCCSCCC(=O)O Amb27442544 [0,2,0,0,0,0|1,0,0]=3 6998 B9R0.2 CNCCSCCC(C)N Amb27404073 [0,2,0,0,0,0|2,0,0]=4 6999 B9R0.2 CNCCSCCS(C)=O Amb27856345 [0,2,0,0,0,0|2,0,0]=4 7000 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,2,0,0,0,0|0,0,0]=2 7001 B9R0.2 COCCCCCC(C)=O Amb27227265 [0,2,0,0,0,0|0,0,0]=2 7002 B9R0.2 COCCCCCC(N)=S Amb27226780 [0,2,0,0,0,0|0,1,0]=3 7003 B9R0.2 COCCCCNC(C)=O Amb27170819 [0,2,0,0,0,0|1,0,0]=3 7004 B9R0.2 COCCCCOC(C)=O Amb24325176 [0,2,0,0,0,0|1,0,0]=3 7005 B9R0.2 COCCCNCC(C)C Amb6730181 [0,2,0,0,0,0|2,0,0]=4 7006 B9R0.2 COCCCNCC(C)N Amb28281327 [0,2,0,0,0,0|2,0,0]=4 7007 B9R0.2 COCCCNCC(C)O Amb17138417 [0,2,0,0,0,0|2,0,0]=4 7008 B9R0.2 COCCCOCC(=O)O Amb25304314 [0,2,0,0,0,0|1,0,0]=3 7009 B9R0.2 COCCCOCC(C)N Amb27837579 [0,2,0,0,0,0|2,0,0]=4 7010 B9R0.2 COCCCOCC(C)O Amb27600623 [0,2,0,0,0,0|2,0,0]=4 7011 B9R0.2 COCCCOCC(N)=S Amb18792509 [0,2,0,0,0,0|1,1,0]=4 7012 B9R0.2 COCCCOC[C@@H](C)N Amb28382568 [0,2,0,0,0,0|2,0,0]=4 7013 B9R0.2 COCCCSC[C@H](C)N Amb28344655 [0,2,0,0,0,0|2,0,0]=4 7014 B9R0.2 COCCNCCC(=O)O Amb33527038 [0,2,0,0,0,0|1,0,0]=3 7015 B9R0.2 COCCNCCC(=O)O Amb7755691 [0,2,0,0,0,0|1,0,0]=3 7016 B9R0.2 COCCNCCC(C)=O Amb24473587 [0,2,0,0,0,0|1,0,0]=3 7017 B9R0.2 COCCNCCC(C)Cl Amb28369525 [0,2,0,0,0,0|2,0,0]=4 7018 B9R0.2 COCCNCCC(N)=O Amb19960056 [0,2,0,0,0,0|1,0,0]=3 7019 B9R0.2 COCCNCCC(N)=O Amb8841099 [0,2,0,0,0,0|1,0,0]=3 7020 B9R0.2 COCCNCCS(C)=O Amb27220298 [0,2,0,0,0,0|2,0,0]=4 7021 B9R0.2 COCCOCCC(=O)O Amb6268336 [0,2,0,0,0,0|1,0,0]=3 7022 B9R0.2 COCCOCCC(N)=O Amb28428996 [0,2,0,0,0,0|1,0,0]=3 7023 B9R0.2 COCCOCCC(N)=S Amb6276300 [0,2,0,0,0,0|1,1,0]=4 7024 B9R0.2 COCCOCCS(=O)Cl Amb32720478 [0,2,0,0,0,0|2,0,0]=4 7025 B9R0.2 COCCOCCS(=O)[O-] Amb32754578 [0,2,0,0,0,0|2,0,0]=4 7026 B9R0.2 COCCOCCS(N)=O Amb32720479 [0,2,0,0,0,0|2,0,0]=4 7027 B9R0.2 COCCOCOC(C)=O Amb28126918 [0,2,0,0,0,0|2,0,0]=4 7028 B9R0.2 COCCSCCC(C)F Amb27457248 [0,2,0,0,0,0|2,0,0]=4 7029 B9R0.2 COCCSCCS(C)=O Amb28078807 [0,2,0,0,0,0|2,0,0]=4 7030 B9R0.2 COCNCCOC(N)=O Amb28384599 [0,2,0,0,0,0|2,0,0]=4 7031 B9R0.2 CO\N=C\CCCC(C)=O Amb27267149 [0,2,0,0,0,0|1,0,1]=4 7032 B9R0.2 CS(=O)CCCCCC#N Amb24326343 [0,2,0,0,0,0|1,0,1]=4 7033 B9R0.2 CS(=O)CCCCCCO Amb27771220 [0,2,0,0,0,0|1,0,0]=3 7034 B9R0.2 CS(=O)CCCCNC=O Amb27668912 [0,2,0,0,0,0|1,0,0]=3 7035 B9R0.2 CS(=O)CCCC\C=N\O Amb22055821 [0,2,0,0,0,0|1,0,1]=4 7036 B9R0.2 CS(=O)CCNCCCBr Amb27780009 [0,2,0,0,0,0|2,0,0]=4 7037 B9R0.2 CS(=O)CCNCCCCl Amb27786049 [0,2,0,0,0,0|2,0,0]=4 7038 B9R0.2 CS(=O)CCNCCCF Amb28063397 [0,2,0,0,0,0|2,0,0]=4 7039 B9R0.2 CS(=O)CCSCCCCl Amb27653763 [0,2,0,0,0,0|2,0,0]=4 7040 B9R0.2 CSCCCCCC(=O)O Amb27444761 [0,2,0,0,0,0|0,0,0]=2 7041 B9R0.2 CSCCCCNC(=N)N Amb27863143 [0,2,0,0,0,0|2,0,0]=4 7042 B9R0.2 CSCCCCNC(C)=O Amb28325257 [0,2,0,0,0,0|1,0,0]=3 7043 B9R0.2 CSCCCCNC(C)C Amb18798069 [0,2,0,0,0,0|2,0,0]=4 7044 B9R0.2 CSCCCCOC(C)=O Amb28041805 [0,2,0,0,0,0|1,0,0]=3 7045 B9R0.2 CSCCCNCC(=O)O Amb8827601 [0,2,0,0,0,0|1,0,0]=3 7046 B9R0.2 CSCCCNC[C@@H](C)O Amb27449650 [0,2,0,0,0,0|2,0,0]=4 7047 B9R0.2 CSCCCOCC(=O)O Amb28042679 [0,2,0,0,0,0|1,0,0]=3 7048 B9R0.2 CSCCCSCC(C)=O Amb28059012 [0,2,0,0,0,0|1,0,0]=3 7049 B9R0.2 CSCCCSCC(C)C Amb27253070 [0,2,0,0,0,0|2,0,0]=4 7050 B9R0.2 CSCCCSC[C@H](C)N Amb27482910 [0,2,0,0,0,0|2,0,0]=4 7051 B9R0.2 CSCCCSC[C@H](C)O Amb27875476 [0,2,0,0,0,0|2,0,0]=4 7052 B9R0.2 CSCCNCCC(=O)O Amb25055507 [0,2,0,0,0,0|1,0,0]=3 7053 B9R0.2 CSCCNCCC(C)C Amb18800588 [0,2,0,0,0,0|2,0,0]=4 7054 B9R0.2 CSCCNCCS(C)=O Amb27594101 [0,2,0,0,0,0|2,0,0]=4 7055 B9R0.2 CSCCNOCC(N)=O Amb27613925 [0,2,0,0,0,0|2,0,0]=4 7056 B9R0.2 CSCCOCCC(=N)N Amb27613566 [0,2,0,0,0,0|2,0,0]=4 7057 B9R0.2 CSSCCNCC(N)=O Amb27779657 [0,2,0,0,0,0|2,0,0]=4 7058 B9R0.2 CS\C=C\CCCC(C)=O Amb28054428 [0,2,0,0,0,0|0,0,2]=4 7059 B9R0.2 C[C@@H](O)CCCCCCO Amb27406493 [0,2,0,0,0,0|0,0,2]=4 7060 B9R0.2 C[C@@H](O)CNCCCCO Amb27235176 [0,2,0,0,0,0|0,0,2]=4 7061 B9R0.2 C[C@H](O)CCC\C=C\C=O Amb27261384 [0,2,0,0,0,0|0,0,1]=3 7062 B9R0.2 C[NH2+]CCCCCC(=O)O Amb9791271 [0,2,0,0,0,0|0,0,0]=2 7063 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [0,2,0,0,0,0|0,0,1]=3 7064 B9R0.2 C\C=C\CCCCC(C)=O Amb25252247 [0,2,0,0,0,0|0,0,1]=3 7065 B9R0.2 C\C=C\CCCNC(C)=O Amb24668710 [0,2,0,0,0,0|0,0,2]=4 7066 B9R0.2 C\C=C\CCNCC(C)O Amb27823058 [0,2,0,0,0,0|1,0,1]=4 7067 B9R0.2 C\C=C\CCOCC(=O)O Amb28340908 [0,2,0,0,0,0|0,0,2]=4 7068 B9R0.2 C\C=C\CNCCC(N)=O Amb27251437 [0,2,0,0,0,0|0,0,2]=4 7069 B9R0.2 N#CCCCCCC(=O)O Amb18643705 [0,2,0,0,0,0|0,0,1]=3 7070 B9R0.2 N#CCCCCNC(N)=O Amb27839109 [0,2,0,0,0,0|1,0,1]=4 7071 B9R0.2 N#CCCCCSC(N)=O Amb27617974 [0,2,0,0,0,0|1,0,1]=4 7072 B9R0.2 N#CCCCSCC(=O)O Amb1109771 [0,2,0,0,0,0|1,0,1]=4 7073 B9R0.2 N#CCCNCCC(=O)O Amb17315318 [0,2,0,0,0,0|1,0,1]=4 7074 B9R0.2 N#CCCSCCC(=O)O Amb18927741 [0,2,0,0,0,0|1,0,1]=4 7075 B9R0.2 N#CCCSCCC(N)=O Amb27655950 [0,2,0,0,0,0|1,0,1]=4 7076 B9R0.2 N#CCSCCCC(=O)O Amb17501766 [0,2,0,0,0,0|1,0,1]=4 7077 B9R0.2 N=C(N)CCSCCCO Amb28349035 [0,2,0,0,0,0|2,0,0]=4 7078 B9R0.2 N=C(N)NCCCCCN Amb25889016 [0,2,0,0,0,0|2,0,0]=4 7079 B9R0.2 N=C(N)NCCCCCO Amb19823705 [0,2,0,0,0,0|2,0,0]=4 7080 B9R0.2 N=C(N)OCCCCCN Amb27875240 [0,2,0,0,0,0|2,0,0]=4 7081 B9R0.2 N=C(N)SCCCCCF Amb27652003 [0,2,0,0,0,0|2,0,0]=4 7082 B9R0.2 NC(=O)CCCCCCBr Amb27654995 [0,2,0,0,0,0|0,0,0]=2 7083 B9R0.2 NC(=O)CCCCCCCl Amb27254212 [0,2,0,0,0,0|0,0,0]=2 7084 B9R0.2 NC(=O)CCCCNC=O Amb27232578 [0,2,0,0,0,0|1,0,1]=4 7085 B9R0.2 NC(=O)CCNCCCO Amb19959936 [0,2,0,0,0,0|1,0,0]=3 7086 B9R0.2 NC(=O)CCNCCCO Amb9243308 [0,2,0,0,0,0|1,0,0]=3 7087 B9R0.2 NC(=O)CCSCCCCl Amb27217057 [0,2,0,0,0,0|1,0,0]=3 7088 B9R0.2 NC(=O)CCSCCCF Amb27756832 [0,2,0,0,0,0|1,0,0]=3 7089 B9R0.2 NC(=O)CCSCCCO Amb27615089 [0,2,0,0,0,0|1,0,0]=3 7090 B9R0.2 NC(=O)CCSCCCS Amb27779781 [0,2,0,0,0,0|1,0,0]=3 7091 B9R0.2 NC(=O)COCCCCO Amb27195620 [0,2,0,0,0,0|1,0,0]=3 7092 B9R0.2 NC(=O)CONCCCO Amb27644309 [0,2,0,0,0,0|2,0,0]=4 7093 B9R0.2 NC(=O)CSCCCCCl Amb27806823 [0,2,0,0,0,0|1,0,0]=3 7094 B9R0.2 NC(=O)CSCCCCS Amb27776386 [0,2,0,0,0,0|1,0,0]=3 7095 B9R0.2 NC(=O)NCCNCCF Amb27646276 [0,2,0,0,0,0|2,0,0]=4 7096 B9R0.2 NC(=O)NCCOCCO Amb26350475 [0,2,0,0,0,0|2,0,0]=4 7097 B9R0.2 NC(=O)NOCCCCF Amb27946674 [0,2,0,0,0,0|2,0,0]=4 7098 B9R0.2 NCCCCCCB(O)O Amb28401029 [0,2,0,0,0,0|1,0,1]=4 7099 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,2,0,0,0,0|0,0,0]=2 7100 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,2,0,0,0,0|0,0,0]=2 7101 B9R0.2 NCCCCCCC(=O)[O-] Amb32663972 [0,2,0,0,0,0|0,0,0]=2 7102 B9R0.2 NCCCCCNC(=S)S Amb28076658 [0,2,0,0,0,0|1,1,0]=4 7103 B9R0.2 NCCCCCNC(N)=O Amb28120485 [0,2,0,0,0,0|1,0,0]=3 7104 B9R0.2 NCCCCNCC(=O)O Amb27800960 [0,2,0,0,0,0|1,0,0]=3 7105 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,2,0,0,0,0|1,0,0]=3 7106 B9R0.2 NCCCCSCC(N)=O Amb17500917 [0,2,0,0,0,0|1,0,0]=3 7107 B9R0.2 NCCCNCCC(=O)O Amb27959846 [0,2,0,0,0,0|1,0,0]=3 7108 B9R0.2 NCCCOCCC(=O)O Amb18111494 [0,2,0,0,0,0|1,0,0]=3 7109 B9R0.2 NCCCOCCC(N)=O Amb27412120 [0,2,0,0,0,0|1,0,0]=3 7110 B9R0.2 NCCCSCCC(=O)O Amb24496605 [0,2,0,0,0,0|1,0,0]=3 7111 B9R0.2 NCCCSCCC(N)=O Amb28077685 [0,2,0,0,0,0|1,0,0]=3 7112 B9R0.2 NCCNCCNC(=O)O Amb24069145 [0,2,0,0,0,0|2,0,0]=4 7113 B9R0.2 NCCNCCNC(N)=O Amb28122121 [0,2,0,0,0,0|2,0,0]=4 7114 B9R0.2 NCCOCCCC(=O)O Amb18111467 [0,2,0,0,0,0|1,0,0]=3 7115 B9R0.2 NCCOCCNC(N)=O Amb27758878 [0,2,0,0,0,0|2,0,0]=4 7116 B9R0.2 NCCSCCCC(=O)O Amb17500468 [0,2,0,0,0,0|1,0,0]=3 7117 B9R0.2 NCCSSCCC(=O)O Amb17608062 [0,2,0,0,0,0|2,0,0]=4 7118 B9R0.2 NOCCCCCC(=O)O Amb32708458 [0,2,0,0,0,0|1,0,0]=3 7119 B9R0.2 NOCCSCCC(N)=O Amb27475291 [0,2,0,0,0,0|2,0,0]=4 7120 B9R0.2 O=C(Cl)CCCSCCCl Amb27644536 [0,2,0,0,0,0|1,0,0]=3 7121 B9R0.2 O=C(Cl)\C=C\CCCCCl Amb25074569 [0,2,0,0,0,0|0,0,2]=4 7122 B9R0.2 O=C(F)OCCCCCCl Amb27391688 [0,2,0,0,0,0|1,0,0]=3 7123 B9R0.2 O=C(O)C#CCCCCO Amb28050129 [0,2,0,0,0,0|0,0,2]=4 7124 B9R0.2 O=C(O)CCCC#CCO Amb27391720 [0,2,0,0,0,0|0,0,2]=4 7125 B9R0.2 O=C(O)CCCCCCBr Amb10071514 [0,2,0,0,0,0|0,0,0]=2 7126 B9R0.2 O=C(O)CCCCCCCl Amb17594087 [0,2,0,0,0,0|0,0,0]=2 7127 B9R0.2 O=C(O)CCCCCCF Amb25132501 [0,2,0,0,0,0|0,0,0]=2 7128 B9R0.2 O=C(O)CCCCCCO Amb9787028 [0,2,0,0,0,0|0,0,0]=2 7129 B9R0.2 O=C(O)CCCCCCS Amb24710334 [0,2,0,0,0,0|0,0,0]=2 7130 B9R0.2 O=C(O)CCCCCNBr Amb28054088 [0,2,0,0,0,0|1,0,0]=3 7131 B9R0.2 O=C(O)CCCCN=C=S Amb25685363 [0,2,0,0,0,0|1,0,1]=4 7132 B9R0.2 O=C(O)CCCC\C=C\Br Amb26542054 [0,2,0,0,0,0|0,0,2]=4 7133 B9R0.2 O=C(O)CCCNCCO Amb9333522 [0,2,0,0,0,0|1,0,0]=3 7134 B9R0.2 O=C(O)CCCOCCO Amb6680919 [0,2,0,0,0,0|1,0,0]=3 7135 B9R0.2 O=C(O)CCCSCCF Amb27614997 [0,2,0,0,0,0|1,0,0]=3 7136 B9R0.2 O=C(O)CCCSCCO Amb9481728 [0,2,0,0,0,0|1,0,0]=3 7137 B9R0.2 O=C(O)CCC\C=C/CO Amb27425001 [0,2,0,0,0,0|0,0,2]=4 7138 B9R0.2 O=C(O)CCNCCCF Amb28049536 [0,2,0,0,0,0|1,0,0]=3 7139 B9R0.2 O=C(O)CCNCCCO Amb9239888 [0,2,0,0,0,0|1,0,0]=3 7140 B9R0.2 O=C(O)CCOCCCO Amb24476864 [0,2,0,0,0,0|1,0,0]=3 7141 B9R0.2 O=C(O)CCSCCCCl Amb26421708 [0,2,0,0,0,0|1,0,0]=3 7142 B9R0.2 O=C(O)CCSCCCF Amb27251653 [0,2,0,0,0,0|1,0,0]=3 7143 B9R0.2 O=C(O)CCSSCCO Amb17615366 [0,2,0,0,0,0|2,0,0]=4 7144 B9R0.2 O=C(O)CNCCCCO Amb28063278 [0,2,0,0,0,0|1,0,0]=3 7145 B9R0.2 O=C(O)COCCCCF Amb27770553 [0,2,0,0,0,0|1,0,0]=3 7146 B9R0.2 O=C(O)COCCCCO Amb27465121 [0,2,0,0,0,0|1,0,0]=3 7147 B9R0.2 O=C(O)CSCCCCCl Amb27165750 [0,2,0,0,0,0|1,0,0]=3 7148 B9R0.2 O=C(O)CSCCCCF Amb28062594 [0,2,0,0,0,0|1,0,0]=3 7149 B9R0.2 O=C(O)\C=C\CCCCCl Amb18645743 [0,2,0,0,0,0|0,0,2]=4 7150 B9R0.2 O=C=NCCCCC(=O)O Amb24505309 [0,2,0,0,0,0|1,0,1]=4 7151 B9R0.2 O=CCCCCCC(=O)O Amb26548890 [0,2,0,0,0,0|0,0,1]=3 7152 B9R0.2 O=S([O-])CCCCCCO Amb27485557 [0,2,0,0,0,0|1,0,0]=3 7153 B9R0.2 O=[N+]([O-])CCCCCCBr Amb27870042 [0,2,0,0,0,0|1,0,0]=3 7154 B9R0.2 O=[N+]([O-])CCCCCCF Amb27882997 [0,2,0,0,0,0|1,0,0]=3 7155 B9R0.2 OB(O)CCCCCCCl Amb27614247 [0,2,0,0,0,0|1,0,1]=4 7156 B9R0.2 [N-]=[N+]=NCCCCC(=O)O Amb19516609 [0,2,0,0,0,0|2,0,0]=4 7157 B9R0.2 [N-]=[N+]=NCCCCC(N)=O Amb28239589 [0,2,0,0,0,0|2,0,0]=4 7158 B9R0.45 BrCCCCCCCCBr Amb2725461 [0,2,0,0,0,0|1,0,1]=4 7159 B9R0.45 C#CCC#CCCCCC Amb2721548 [0,2,0,0,0,0|1,0,1]=4 7160 B9R0.45 C#CCCC#CCCCC Amb2721537 [0,2,0,0,0,0|1,0,1]=4 7161 B9R0.45 C#CCCCCCCC#C Amb2686672 [0,2,0,0,0,0|1,0,1]=4 7162 B9R0.45 C#CCCCCCCC=C Amb27268975 [0,2,0,0,0,0|1,0,0]=3 7163 B9R0.45 C#CCCCCCCCC Amb2721541 [0,2,0,0,0,0|1,0,1]=4 7164 B9R0.45 C#CCCCCCCCF Amb27845935 [0,2,0,0,0,0|1,0,1]=4 7165 B9R0.45 C#CCCCCCCCN Amb24117276 [0,2,0,0,0,0|1,0,1]=4 7166 B9R0.45 C#CCCCCCCCO Amb10563785 [0,2,0,0,0,0|0,0,2]=4 7167 B9R0.45 C#CCCCCCCNC Amb28204575 [0,2,0,0,0,0|1,0,1]=4 7168 B9R0.45 C#CCCCCCNC=O Amb27214635 [0,2,0,0,0,0|0,0,1]=3 7169 B9R0.45 C#CCCCCOCOC Amb22641579 [0,2,0,0,0,0|1,0,1]=4 7170 B9R0.45 C#CCCCNCCCC Amb27413122 [0,2,0,0,0,0|1,0,1]=4 7171 B9R0.45 C#CCCCNCCCN Amb28197867 [0,2,0,0,0,0|1,0,1]=4 7172 B9R0.45 C#CCCCOCCNC Amb27978621 [0,2,0,0,0,0|1,0,1]=4 7173 B9R0.45 C#CCCNCCCCC Amb27770336 [0,2,0,0,0,0|1,0,1]=4 7174 B9R0.45 C#CCCNCCCSC Amb27245095 [0,2,0,0,0,0|1,0,1]=4 7175 B9R0.45 C#CCCOCCNCC Amb27478327 [0,2,0,0,0,0|1,0,1]=4 7176 B9R0.45 C#CCCOCCOCC Amb27615179 [0,2,0,0,0,0|1,0,1]=4 7177 B9R0.45 C#CCCSCCCOC Amb27454502 [0,2,0,0,0,0|1,0,1]=4 7178 B9R0.45 C#CCC\C=C\CCCC Amb24505097 [0,2,0,0,0,0|1,0,1]=4 7179 B9R0.45 C#CCNCCCCCC Amb5262804 [0,2,0,0,0,0|1,0,1]=4 7180 B9R0.45 C#CCNCCSCCC Amb18182317 [0,2,0,0,0,0|1,0,1]=4 7181 B9R0.45 C#CCONCCCCC Amb27617050 [0,2,0,0,0,0|1,0,1]=4 7182 B9R0.45 C#CCSCCCCCC Amb28349721 [0,2,0,0,0,0|1,0,1]=4 7183 B9R0.45 C#CCSCCCCOC Amb28124630 [0,2,0,0,0,0|1,0,1]=4 7184 B9R0.45 C#C\C=C\CCCCCO Amb28050732 [0,2,0,0,0,0|1,0,1]=4 7185 B9R0.45 C=C=CCCCCCCN Amb28188554 [0,2,0,0,0,0|1,0,0]=3 7186 B9R0.45 C=C=CCCCCCCO Amb28050724 [0,2,0,0,0,0|1,0,0]=3 7187 B9R0.45 C=CCC#CCCCCO Amb28121719 [0,2,0,0,0,0|1,0,1]=4 7188 B9R0.45 C=CCCCC#CCCBr Amb27873232 [0,2,0,0,0,0|1,0,1]=4 7189 B9R0.45 C=CCCCCC#CCO Amb27972321 [0,2,0,0,0,0|1,0,1]=4 7190 B9R0.45 C=CCCCCCCC#N Amb6298893 [0,2,0,0,0,0|1,0,0]=3 7191 B9R0.45 C=CCCCCCCC=C Amb2721547 [0,2,0,0,0,0|1,0,0]=3 7192 B9R0.45 C=CCCCCCCC=O Amb28193259 [0,2,0,0,0,0|0,0,0]=2 7193 B9R0.45 C=CCCCCCCCBr Amb19895211 [0,2,0,0,0,0|1,0,0]=3 7194 B9R0.45 C=CCCCCCCCC Amb3940503 [0,2,0,0,0,0|1,0,0]=3 7195 B9R0.45 C=CCCCCCCCCl Amb6298880 [0,2,0,0,0,0|1,0,0]=3 7196 B9R0.45 C=CCCCCCCCN Amb24763980 [0,2,0,0,0,0|1,0,0]=3 7197 B9R0.45 C=CCCCCCCCN Amb32653343 [0,2,0,0,0,0|1,0,0]=3 7198 B9R0.45 C=CCCCCCCCO Amb22733549 [0,2,0,0,0,0|1,0,0]=3 7199 B9R0.45 C=CCCCCCCNC Amb28120535 [0,2,0,0,0,0|1,0,0]=3 7200 B9R0.45 C=CCCCCCSCC Amb27396740 [0,2,0,0,0,0|1,0,0]=3 7201 B9R0.45 C=CCCCCNCCC Amb26576689 [0,2,0,0,0,0|1,0,0]=3 7202 B9R0.45 C=CCCCC\C=C\C=O Amb17593510 [0,2,0,0,0,0|0,0,2]=4 7203 B9R0.45 C=CCCCC\C=C\CO Amb8389620 [0,2,0,0,0,0|1,0,1]=4 7204 B9R0.45 C=CCCCNCCC=C Amb28313958 [0,2,0,0,0,0|1,0,1]=4 7205 B9R0.45 C=CCCCNCCCC Amb27799206 [0,2,0,0,0,0|1,0,0]=3 7206 B9R0.45 C=CCCCNCCNC Amb27466769 [0,2,0,0,0,0|1,0,0]=3 7207 B9R0.45 C=CCCCOCCC#N Amb27171013 [0,2,0,0,0,0|1,0,1]=4 7208 B9R0.45 C=CCCCSCCOC Amb27424920 [0,2,0,0,0,0|1,0,0]=3 7209 B9R0.45 C=CCCCSC\C=C\C Amb28282443 [0,2,0,0,0,0|1,0,1]=4 7210 B9R0.45 C=CCCC\C=C\CCO Amb27835106 [0,2,0,0,0,0|1,0,1]=4 7211 B9R0.45 C=CCCNCCCCC Amb27838999 [0,2,0,0,0,0|1,0,0]=3 7212 B9R0.45 C=CCCNCCCCO Amb28141464 [0,2,0,0,0,0|1,0,0]=3 7213 B9R0.45 C=CCCNCCCOC Amb28126721 [0,2,0,0,0,0|1,0,0]=3 7214 B9R0.45 C=CCCNCCCSC Amb27838985 [0,2,0,0,0,0|1,0,0]=3 7215 B9R0.45 C=CCCNCCOCC Amb28126723 [0,2,0,0,0,0|1,0,0]=3 7216 B9R0.45 C=CCCOCCCNC Amb27768715 [0,2,0,0,0,0|1,0,0]=3 7217 B9R0.45 C=CCCSCCCOC Amb28280277 [0,2,0,0,0,0|1,0,0]=3 7218 B9R0.45 C=CCCSCCSCC Amb27197363 [0,2,0,0,0,0|1,0,0]=3 7219 B9R0.45 C=CCC\C=C\CCC=O Amb25770517 [0,2,0,0,0,0|0,0,2]=4 7220 B9R0.45 C=CCC\C=C\CCCO Amb27485402 [0,2,0,0,0,0|1,0,1]=4 7221 B9R0.45 C=CCNCCCCCC Amb7756950 [0,2,0,0,0,0|1,0,0]=3 7222 B9R0.45 C=CCNCCCCCF Amb27219940 [0,2,0,0,0,0|1,0,0]=3 7223 B9R0.45 C=CCNCCCCNC Amb27251520 [0,2,0,0,0,0|1,0,0]=3 7224 B9R0.45 C=CCOCCCCCC Amb17933923 [0,2,0,0,0,0|1,0,0]=3 7225 B9R0.45 C=CCOCCCSCC Amb28187852 [0,2,0,0,0,0|1,0,0]=3 7226 B9R0.45 C=CCOCCNCCC Amb27866133 [0,2,0,0,0,0|1,0,0]=3 7227 B9R0.45 C=CCOCCNCCN Amb28065791 [0,2,0,0,0,0|2,0,0]=4 7228 B9R0.45 C=CCOCCNCCO Amb28321523 [0,2,0,0,0,0|2,0,0]=4 7229 B9R0.45 C=CCOCCOCCCl Amb27615017 [0,2,0,0,0,0|2,0,0]=4 7230 B9R0.45 C=CCOCCOCCN Amb18111246 [0,2,0,0,0,0|2,0,0]=4 7231 B9R0.45 C=CCOCCOCCO Amb17933929 [0,2,0,0,0,0|2,0,0]=4 7232 B9R0.45 C=CCOCCOCCS Amb28049570 [0,2,0,0,0,0|2,0,0]=4 7233 B9R0.45 C=CCONCCOCC Amb27267386 [0,2,0,0,0,0|2,0,0]=4 7234 B9R0.45 C=CCONCCSCC Amb27266026 [0,2,0,0,0,0|2,0,0]=4 7235 B9R0.45 C=CCSCCCCC#N Amb27234394 [0,2,0,0,0,0|1,0,1]=4 7236 B9R0.45 C=CCSCCCCCBr Amb27985767 [0,2,0,0,0,0|1,0,0]=3 7237 B9R0.45 C=CCSCCCCCC Amb22733767 [0,2,0,0,0,0|1,0,0]=3 7238 B9R0.45 C=CCSCCCCCF Amb28315981 [0,2,0,0,0,0|1,0,0]=3 7239 B9R0.45 C=CCSCCCCCN Amb28435037 [0,2,0,0,0,0|1,0,0]=3 7240 B9R0.45 C=CCSCCCCCS Amb27828255 [0,2,0,0,0,0|1,0,0]=3 7241 B9R0.45 C=CCSCCCCNC Amb28397579 [0,2,0,0,0,0|1,0,0]=3 7242 B9R0.45 C=CCSCCCCOC Amb27599202 [0,2,0,0,0,0|1,0,0]=3 7243 B9R0.45 C=CCSCCNCCF Amb27207123 [0,2,0,0,0,0|2,0,0]=4 7244 B9R0.45 C=CCSCCNCCN Amb27192686 [0,2,0,0,0,0|2,0,0]=4 7245 B9R0.45 C=CCSCCOCCN Amb17501982 [0,2,0,0,0,0|2,0,0]=4 7246 B9R0.45 C=CCSCCOCCO Amb27595240 [0,2,0,0,0,0|2,0,0]=4 7247 B9R0.45 C=CC\C=C/CCCCC Amb27423727 [0,2,0,0,0,0|1,0,0]=3 7248 B9R0.45 C=CC\C=C\CCCCC Amb27629643 [0,2,0,0,0,0|1,0,0]=3 7249 B9R0.45 C=CC\C=C\CCCCO Amb28050717 [0,2,0,0,0,0|1,0,1]=4 7250 B9R0.45 C=CNCCCNCCCl Amb26446155 [0,2,0,0,0,0|2,0,0]=4 7251 B9R0.45 C=COCCCCCCO Amb26931083 [0,2,0,0,0,0|1,0,0]=3 7252 B9R0.45 C=COCCNCCCC Amb28364273 [0,2,0,0,0,0|1,0,0]=3 7253 B9R0.45 C=COCCOCCOC Amb27852644 [0,2,0,0,0,0|2,0,0]=4 7254 B9R0.45 C=COCCSCCOC Amb27486713 [0,2,0,0,0,0|2,0,0]=4 7255 B9R0.45 C=C\C=C/CCCCCC Amb22641680 [0,2,0,0,0,0|1,0,0]=3 7256 B9R0.45 C=C\C=C\CCCCCO Amb27242542 [0,2,0,0,0,0|1,0,1]=4 7257 B9R0.45 C=C\C=C\CCNCCC Amb28049583 [0,2,0,0,0,0|1,0,1]=4 7258 B9R0.45 CC#CCCCCCC=O Amb28198592 [0,2,0,0,0,0|0,0,0]=2 7259 B9R0.45 CC#CCCCCCCC Amb2721539 [0,2,0,0,0,0|1,0,1]=4 7260 B9R0.45 CC#CCCCCCCO Amb27478697 [0,2,0,0,0,0|0,0,2]=4 7261 B9R0.45 CCC#CCCCCCC Amb2721540 [0,2,0,0,0,0|1,0,1]=4 7262 B9R0.45 CCC#CCCCCCO Amb28050678 [0,2,0,0,0,0|0,0,2]=4 7263 B9R0.45 CCCC#CCCCCC Amb2721550 [0,2,0,0,0,0|1,0,1]=4 7264 B9R0.45 CCCCC#CC#CC=O Amb27225781 [0,2,0,0,0,0|0,0,2]=4 7265 B9R0.45 CCCCC#CCCC=O Amb27790685 [0,2,0,0,0,0|0,0,0]=2 7266 B9R0.45 CCCCC#CCCCC Amb2721554 [0,2,0,0,0,0|1,0,1]=4 7267 B9R0.45 CCCCC#CCCCCl Amb2721557 [0,2,0,0,0,0|1,0,1]=4 7268 B9R0.45 CCCCC#CCCCN Amb26348518 [0,2,0,0,0,0|1,0,1]=4 7269 B9R0.45 CCCCCC#CCCN Amb25146331 [0,2,0,0,0,0|1,0,1]=4 7270 B9R0.45 CCCCCC#CCCO Amb2721746 [0,2,0,0,0,0|0,0,2]=4 7271 B9R0.45 CCCCCC=C=CCCl Amb27211387 [0,2,0,0,0,0|1,0,1]=4 7272 B9R0.45 CCCCCCC#CCBr Amb26974428 [0,2,0,0,0,0|1,0,1]=4 7273 B9R0.45 CCCCCCC#CCN Amb28313948 [0,2,0,0,0,0|1,0,1]=4 7274 B9R0.45 CCCCCCC#CCO Amb2721748 [0,2,0,0,0,0|0,0,2]=4 7275 B9R0.45 CCCCCCCCC#N Amb7764626 [0,2,0,0,0,0|1,0,1]=4 7276 B9R0.45 CCCCCCCCCBr Amb3940224 [0,2,0,0,0,0|1,0,1]=4 7277 B9R0.45 CCCCCCCCCC Amb7757835 [0,2,0,0,0,0|1,0,1]=4 7278 B9R0.45 CCCCCCCCCCl Amb6652537 [0,2,0,0,0,0|1,0,1]=4 7279 B9R0.45 CCCCCCCCCF Amb8515361 [0,2,0,0,0,0|1,0,1]=4 7280 B9R0.45 CCCCCCCCCI Amb3940284 [0,2,0,0,0,0|1,0,1]=4 7281 B9R0.45 CCCCCCCCCN Amb3987584 [0,2,0,0,0,0|1,0,1]=4 7282 B9R0.45 CCCCCCCCCO Amb3940342 [0,2,0,0,0,0|0,0,2]=4 7283 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [0,2,0,0,0,0|1,0,1]=4 7284 B9R0.45 CCCCCCCCNC Amb7757640 [0,2,0,0,0,0|1,0,1]=4 7285 B9R0.45 CCCCCCCCNN Amb7786451 [0,2,0,0,0,0|1,0,1]=4 7286 B9R0.45 CCCCCCCCNO Amb28069968 [0,2,0,0,0,0|0,0,2]=4 7287 B9R0.45 CCCCCCCCON Amb2818885 [0,2,0,0,0,0|0,0,2]=4 7288 B9R0.45 CCCCCCCCSC Amb10553780 [0,2,0,0,0,0|0,1,1]=4 7289 B9R0.45 CCCCCCCN=C=O Amb3940866 [0,2,0,0,0,0|0,0,1]=3 7290 B9R0.45 CCCCCCCN=C=S Amb6860842 [0,2,0,0,0,0|0,1,1]=4 7291 B9R0.45 CCCCCCCN=[N+]=[N-] Amb17939437 [0,2,0,0,0,0|1,0,1]=4 7292 B9R0.45 CCCCCCCNC=O Amb27170738 [0,2,0,0,0,0|0,0,0]=2 7293 B9R0.45 CCCCCCCOC=O Amb9787223 [0,2,0,0,0,0|0,0,0]=2 7294 B9R0.45 CCCCCCCOCC Amb26332517 [0,2,0,0,0,0|0,0,2]=4 7295 B9R0.45 CCCCCCCSC#N Amb17939431 [0,2,0,0,0,0|0,1,1]=4 7296 B9R0.45 CCCCCCC\C=N\N Amb28193253 [0,2,0,0,0,0|1,0,0]=3 7297 B9R0.45 CCCCCCNCCC Amb6730565 [0,2,0,0,0,0|1,0,1]=4 7298 B9R0.45 CCCCCCNCCCl Amb27175028 [0,2,0,0,0,0|1,0,1]=4 7299 B9R0.45 CCCCCCNCCN Amb33611669 [0,2,0,0,0,0|1,0,1]=4 7300 B9R0.45 CCCCCCNCCN Amb9786764 [0,2,0,0,0,0|1,0,1]=4 7301 B9R0.45 CCCCCCNCCO Amb2720857 [0,2,0,0,0,0|0,0,2]=4 7302 B9R0.45 CCCCCCOCC#N Amb7792031 [0,2,0,0,0,0|1,0,1]=4 7303 B9R0.45 CCCCCCOCC=O Amb26624223 [0,2,0,0,0,0|0,0,0]=2 7304 B9R0.45 CCCCCCOCCC Amb27838831 [0,2,0,0,0,0|1,0,1]=4 7305 B9R0.45 CCCCCCOCCCl Amb8828502 [0,2,0,0,0,0|1,0,1]=4 7306 B9R0.45 CCCCCCOCCO Amb9787183 [0,2,0,0,0,0|0,0,2]=4 7307 B9R0.45 CCCCCCO\C=C/Cl Amb27984890 [0,2,0,0,0,0|1,0,0]=3 7308 B9R0.45 CCCCCCPCCN Amb28121064 [0,2,0,0,0,0|1,0,1]=4 7309 B9R0.45 CCCCCCSCCCl Amb22228746 [0,2,0,0,0,0|1,0,1]=4 7310 B9R0.45 CCCCCCSCCN Amb7794935 [0,2,0,0,0,0|1,0,1]=4 7311 B9R0.45 CCCCCC\C=C/CO Amb10807383 [0,2,0,0,0,0|0,0,1]=3 7312 B9R0.45 CCCCCC\C=C\C=O Amb24061310 [0,2,0,0,0,0|0,0,0]=2 7313 B9R0.45 CCCCCC\C=C\CO Amb22168300 [0,2,0,0,0,0|0,0,1]=3 7314 B9R0.45 CCCCCC\C=C\OC Amb30621739 [0,2,0,0,0,0|0,0,1]=3 7315 B9R0.45 CCCCCNCCC#N Amb2690074 [0,2,0,0,0,0|1,0,1]=4 7316 B9R0.45 CCCCCNCCCBr Amb27171159 [0,2,0,0,0,0|1,0,1]=4 7317 B9R0.45 CCCCCNCCCC Amb6688183 [0,2,0,0,0,0|1,0,1]=4 7318 B9R0.45 CCCCCNCCCF Amb27757655 [0,2,0,0,0,0|1,0,1]=4 7319 B9R0.45 CCCCCNCCCN Amb17315271 [0,2,0,0,0,0|1,0,1]=4 7320 B9R0.45 CCCCCNCCCO Amb6733807 [0,2,0,0,0,0|0,0,2]=4 7321 B9R0.45 CCCCCNCCNC Amb2691992 [0,2,0,0,0,0|1,0,1]=4 7322 B9R0.45 CCCCCNCCOC Amb6708081 [0,2,0,0,0,0|0,0,2]=4 7323 B9R0.45 CCCCCN\N=C\C#N Amb27395819 [0,2,0,0,0,0|2,0,0]=4 7324 B9R0.45 CCCCCOCCC=O Amb27628424 [0,2,0,0,0,0|0,0,0]=2 7325 B9R0.45 CCCCCSCCCF Amb28204722 [0,2,0,0,0,0|1,0,1]=4 7326 B9R0.45 CCCCCSCCCN Amb17500694 [0,2,0,0,0,0|1,0,1]=4 7327 B9R0.45 CCCCCSCCCO Amb17502837 [0,2,0,0,0,0|0,0,2]=4 7328 B9R0.45 CCCCCSCCSC Amb28282346 [0,2,0,0,0,0|0,1,1]=4 7329 B9R0.45 CCCCC\C=C/CCBr Amb27781314 [0,2,0,0,0,0|1,0,1]=4 7330 B9R0.45 CCCCC\C=C/CCO Amb9825885 [0,2,0,0,0,0|0,0,2]=4 7331 B9R0.45 CCCCC\C=C\CCBr Amb27864879 [0,2,0,0,0,0|1,0,1]=4 7332 B9R0.45 CCCCC\C=C\CCN Amb25123460 [0,2,0,0,0,0|1,0,1]=4 7333 B9R0.45 CCCCC\C=C\CCO Amb27953070 [0,2,0,0,0,0|0,0,2]=4 7334 B9R0.45 CCCCC\C=C\OCC Amb27590195 [0,2,0,0,0,0|0,0,2]=4 7335 B9R0.45 CCCCNCCCC#N Amb6709574 [0,2,0,0,0,0|1,0,1]=4 7336 B9R0.45 CCCCNCCCCBr Amb27403712 [0,2,0,0,0,0|1,0,1]=4 7337 B9R0.45 CCCCNCCCNC Amb24502382 [0,2,0,0,0,0|1,0,1]=4 7338 B9R0.45 CCCCNCCCOC Amb6730310 [0,2,0,0,0,0|0,0,2]=4 7339 B9R0.45 CCCCNCCOCC Amb9241010 [0,2,0,0,0,0|1,0,1]=4 7340 B9R0.45 CCCCNCCSSC Amb27975856 [0,2,0,0,0,0|1,1,0]=4 7341 B9R0.45 CCCCNC\C=C\CN Amb27391026 [0,2,0,0,0,0|1,0,1]=4 7342 B9R0.45 CCCCOCCCC#N Amb8895274 [0,2,0,0,0,0|1,0,1]=4 7343 B9R0.45 CCCCOCCCCBr Amb8895240 [0,2,0,0,0,0|1,0,1]=4 7344 B9R0.45 CCCCOCCCCCl Amb18798377 [0,2,0,0,0,0|1,0,1]=4 7345 B9R0.45 CCCCOCCCCO Amb19375051 [0,2,0,0,0,0|0,0,2]=4 7346 B9R0.45 CCCCOCCCON Amb27212384 [0,2,0,0,0,0|0,0,2]=4 7347 B9R0.45 CCCCOCCN=[N+]=[N-] Amb28077654 [0,2,0,0,0,0|2,0,0]=4 7348 B9R0.45 CCCCOCCNC#N Amb28193249 [0,2,0,0,0,0|1,0,1]=4 7349 B9R0.45 CCCCOCCOCC Amb25248413 [0,2,0,0,0,0|1,0,1]=4 7350 B9R0.45 CCCCOCCOCCl Amb28399346 [0,2,0,0,0,0|1,0,1]=4 7351 B9R0.45 CCCCOC\C=C/CBr Amb27798436 [0,2,0,0,0,0|1,0,1]=4 7352 B9R0.45 CCCCOC\C=C\CBr Amb28318470 [0,2,0,0,0,0|1,0,1]=4 7353 B9R0.45 CCCCOC\C=C\CN Amb27877410 [0,2,0,0,0,0|1,0,1]=4 7354 B9R0.45 CCCCOC\C=C\CO Amb28453524 [0,2,0,0,0,0|0,0,2]=4 7355 B9R0.45 CCCCOC\C=C\CS Amb27809829 [0,2,0,0,0,0|0,1,1]=4 7356 B9R0.45 CCCCSCCCCN Amb9480126 [0,2,0,0,0,0|1,0,1]=4 7357 B9R0.45 CCCCSCCCCS Amb28206440 [0,2,0,0,0,0|0,1,1]=4 7358 B9R0.45 CCCCSCCCOC Amb27651352 [0,2,0,0,0,0|0,0,2]=4 7359 B9R0.45 CCCCSCCOCC Amb10669603 [0,2,0,0,0,0|1,0,1]=4 7360 B9R0.45 CCCCSC\C=C\CO Amb28205928 [0,2,0,0,0,0|0,0,2]=4 7361 B9R0.45 CCCCSC\C=C\CS Amb27632116 [0,2,0,0,0,0|0,1,1]=4 7362 B9R0.45 CCCCSSCCCC Amb8513071 [0,2,0,0,0,0|1,0,1]=4 7363 B9R0.45 CCCC[Te][Te]CCCC Amb8515301 [0,2,0,0,0,0|1,0,1]=4 7364 B9R0.45 CCCC\C=C/CCCC Amb27196227 [0,2,0,0,0,0|1,0,1]=4 7365 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [0,2,0,0,0,0|0,0,0]=2 7366 B9R0.45 CCCC\C=C\CCCC Amb2721542 [0,2,0,0,0,0|1,0,1]=4 7367 B9R0.45 CCCNCCCCCBr Amb27614955 [0,2,0,0,0,0|1,0,1]=4 7368 B9R0.45 CCCNCCCCCO Amb17334254 [0,2,0,0,0,0|0,0,2]=4 7369 B9R0.45 CCCNCCCCSC Amb18798068 [0,2,0,0,0,0|0,1,1]=4 7370 B9R0.45 CCCNCCCSCC Amb18177748 [0,2,0,0,0,0|1,0,1]=4 7371 B9R0.45 CCCNCCNCCF Amb27945344 [0,2,0,0,0,0|1,0,1]=4 7372 B9R0.45 CCCNCCNCCO Amb24644910 [0,2,0,0,0,0|0,0,2]=4 7373 B9R0.45 CCCNCCOCC#N Amb28140114 [0,2,0,0,0,0|1,0,1]=4 7374 B9R0.45 CCCNCCOCCCl Amb27652262 [0,2,0,0,0,0|1,0,1]=4 7375 B9R0.45 CCCNCCOCCF Amb27794080 [0,2,0,0,0,0|1,0,1]=4 7376 B9R0.45 CCCNCCOCCO Amb6736235 [0,2,0,0,0,0|0,0,2]=4 7377 B9R0.45 CCCNCCSCCN Amb28192624 [0,2,0,0,0,0|1,0,1]=4 7378 B9R0.45 CCCOCCCCCBr Amb27494337 [0,2,0,0,0,0|1,0,1]=4 7379 B9R0.45 CCCOCCCCCN Amb27869443 [0,2,0,0,0,0|1,0,1]=4 7380 B9R0.45 CCCOCCCN=C=S Amb27425148 [0,2,0,0,0,0|0,1,1]=4 7381 B9R0.45 CCCOCCCNC=O Amb27453700 [0,2,0,0,0,0|0,0,0]=2 7382 B9R0.45 CCCOCCNCCBr Amb28281047 [0,2,0,0,0,0|1,0,1]=4 7383 B9R0.45 CCCOCCOCC#N Amb28429850 [0,2,0,0,0,0|1,0,1]=4 7384 B9R0.45 CCCOCCOCCC Amb27441214 [0,2,0,0,0,0|1,0,1]=4 7385 B9R0.45 CCCOCCOCCO Amb22351569 [0,2,0,0,0,0|0,0,2]=4 7386 B9R0.45 CCCSCCCCC#N Amb18178253 [0,2,0,0,0,0|1,0,1]=4 7387 B9R0.45 CCCSCCCCCBr Amb27603024 [0,2,0,0,0,0|1,0,1]=4 7388 B9R0.45 CCCSCCCCCCl Amb9304986 [0,2,0,0,0,0|1,0,1]=4 7389 B9R0.45 CCCSCCCCCS Amb27431515 [0,2,0,0,0,0|0,1,1]=4 7390 B9R0.45 CCCSCCNCC#N Amb27190636 [0,2,0,0,0,0|1,0,1]=4 7391 B9R0.45 CCCSCCNCCN Amb27400239 [0,2,0,0,0,0|1,0,1]=4 7392 B9R0.45 CCCSCCNCCO Amb27618844 [0,2,0,0,0,0|0,0,2]=4 7393 B9R0.45 CCCSCCOCCCl Amb27764394 [0,2,0,0,0,0|1,0,1]=4 7394 B9R0.45 CCCSCCOCCN Amb17501983 [0,2,0,0,0,0|1,0,1]=4 7395 B9R0.45 CCCSCCOCCS Amb27833892 [0,2,0,0,0,0|0,1,1]=4 7396 B9R0.45 CCCSCCSCCC Amb4019972 [0,2,0,0,0,0|1,0,1]=4 7397 B9R0.45 CCCSCCSCCCl Amb28076466 [0,2,0,0,0,0|1,0,1]=4 7398 B9R0.45 CCCSCCSCCO Amb27433297 [0,2,0,0,0,0|0,0,2]=4 7399 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [0,2,0,0,0,0|0,0,0]=2 7400 B9R0.45 CCC\C=C\CCCCC Amb22231673 [0,2,0,0,0,0|1,0,1]=4 7401 B9R0.45 CCC\C=C\CCCCN Amb33373745 [0,2,0,0,0,0|1,0,1]=4 7402 B9R0.45 CCC\C=C\CCN=C=O Amb33327158 [0,2,0,0,0,0|0,0,2]=4 7403 B9R0.45 CCC\C=C\C\C=C\C=O Amb27635823 [0,2,0,0,0,0|0,0,2]=4 7404 B9R0.45 CCNCCCCCCN Amb25855319 [0,2,0,0,0,0|1,0,1]=4 7405 B9R0.45 CCNCCCCCOC Amb28186272 [0,2,0,0,0,0|0,0,2]=4 7406 B9R0.45 CCNCCCCCSC Amb27167121 [0,2,0,0,0,0|0,1,1]=4 7407 B9R0.45 CCNCCCCNCC Amb20621746 [0,2,0,0,0,0|1,0,1]=4 7408 B9R0.45 CCNCCCNCCBr Amb27411819 [0,2,0,0,0,0|1,0,1]=4 7409 B9R0.45 CCNCCCNCCO Amb27770477 [0,2,0,0,0,0|0,0,2]=4 7410 B9R0.45 CCNCCCOCCCl Amb28068633 [0,2,0,0,0,0|1,0,1]=4 7411 B9R0.45 CCNCCOCCOC Amb24672932 [0,2,0,0,0,0|2,0,0]=4 7412 B9R0.45 CCNCCSCCOC Amb18788239 [0,2,0,0,0,0|2,0,0]=4 7413 B9R0.45 CCOCCCCCCS Amb27834959 [0,2,0,0,0,0|0,1,1]=4 7414 B9R0.45 CCOCCCCNC#N Amb28066994 [0,2,0,0,0,0|1,0,1]=4 7415 B9R0.45 CCOCCCCNC=O Amb27634560 [0,2,0,0,0,0|0,0,0]=2 7416 B9R0.45 CCOCCCCOCC Amb10807403 [0,2,0,0,0,0|1,0,1]=4 7417 B9R0.45 CCOCCCNCCBr Amb27822856 [0,2,0,0,0,0|1,0,1]=4 7418 B9R0.45 CCOCCCNCCI Amb27393933 [0,2,0,0,0,0|1,0,1]=4 7419 B9R0.45 CCOCCCNCCS Amb27412412 [0,2,0,0,0,0|0,1,1]=4 7420 B9R0.45 CCOCCCOCCN Amb27849613 [0,2,0,0,0,0|1,0,1]=4 7421 B9R0.45 CCOCCNCCCBr Amb28049448 [0,2,0,0,0,0|1,0,1]=4 7422 B9R0.45 CCOCCNCCCN Amb27391621 [0,2,0,0,0,0|1,0,1]=4 7423 B9R0.45 CCOCCNCCNC Amb28382584 [0,2,0,0,0,0|2,0,0]=4 7424 B9R0.45 CCOCCNCCSC Amb18183509 [0,2,0,0,0,0|2,0,0]=4 7425 B9R0.45 CCOCCNC\C=C\Cl Amb27477481 [0,2,0,0,0,0|1,0,1]=4 7426 B9R0.45 CCOCCOCCC=O Amb27167183 [0,2,0,0,0,0|0,0,0]=2 7427 B9R0.45 CCOCCOCCCBr Amb8828207 [0,2,0,0,0,0|1,0,1]=4 7428 B9R0.45 CCOCCOCCCN Amb6246853 [0,2,0,0,0,0|1,0,1]=4 7429 B9R0.45 CCOCCOCCNC Amb28049307 [0,2,0,0,0,0|2,0,0]=4 7430 B9R0.45 CCOCCOCCOC Amb8394637 [0,2,0,0,0,0|2,0,0]=4 7431 B9R0.45 CCOCCSCCCO Amb27830336 [0,2,0,0,0,0|0,0,2]=4 7432 B9R0.45 CCOCCSCCNC Amb28146212 [0,2,0,0,0,0|2,0,0]=4 7433 B9R0.45 CCOCOCCCCBr Amb28388750 [0,2,0,0,0,0|1,0,1]=4 7434 B9R0.45 CCONCCCCCO Amb28245082 [0,2,0,0,0,0|0,0,2]=4 7435 B9R0.45 CCSCCCCCCCl Amb18186755 [0,2,0,0,0,0|1,0,1]=4 7436 B9R0.45 CCSCCCCSCC Amb4017492 [0,2,0,0,0,0|1,0,1]=4 7437 B9R0.45 CCSCCCNCCBr Amb27442249 [0,2,0,0,0,0|1,0,1]=4 7438 B9R0.45 CCSCCCNCCCl Amb27982314 [0,2,0,0,0,0|1,0,1]=4 7439 B9R0.45 CCSCCCNCCN Amb27669366 [0,2,0,0,0,0|1,0,1]=4 7440 B9R0.45 CCSCCNCCCBr Amb27171099 [0,2,0,0,0,0|1,0,1]=4 7441 B9R0.45 CCSCCNCCCF Amb27165285 [0,2,0,0,0,0|1,0,1]=4 7442 B9R0.45 CCSCCNCCCO Amb27797112 [0,2,0,0,0,0|0,0,2]=4 7443 B9R0.45 CCSCCOCCCS Amb27971481 [0,2,0,0,0,0|0,1,1]=4 7444 B9R0.45 CCSCCSCCCO Amb27489348 [0,2,0,0,0,0|0,0,2]=4 7445 B9R0.45 CCSCCSCCSC Amb28062167 [0,2,0,0,0,0|2,0,0]=4 7446 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [0,2,0,0,0,0|0,0,1]=3 7447 B9R0.45 CC\C=C/CC\C=C\C=O Amb2720527 [0,2,0,0,0,0|0,0,2]=4 7448 B9R0.45 CC\C=C/C\C=C/CC=O Amb18643319 [0,2,0,0,0,0|0,0,2]=4 7449 B9R0.45 CC\C=C\C=C\CCC=O Amb27841138 [0,2,0,0,0,0|0,0,2]=4 7450 B9R0.45 CC\C=C\CCCCCC Amb22231672 [0,2,0,0,0,0|1,0,0]=3 7451 B9R0.45 CC\C=C\CC\C=C\C=O Amb18124509 [0,2,0,0,0,0|0,0,2]=4 7452 B9R0.45 CC\C=C\COCCCC Amb25912010 [0,2,0,0,0,0|1,0,1]=4 7453 B9R0.45 CC\C=C\C\C=C\CC=O Amb28255687 [0,2,0,0,0,0|0,0,2]=4 7454 B9R0.45 CC\N=N\CCCCCO Amb27631929 [0,2,0,0,0,0|0,0,2]=4 7455 B9R0.45 CNCCCCCCC#N Amb27192989 [0,2,0,0,0,0|1,0,1]=4 7456 B9R0.45 CNCCCCCCNC Amb9826092 [0,2,0,0,0,0|1,0,1]=4 7457 B9R0.45 CNCCCCNCCO Amb27630866 [0,2,0,0,0,0|0,0,2]=4 7458 B9R0.45 CNCCCNCCCN Amb27617090 [0,2,0,0,0,0|1,0,1]=4 7459 B9R0.45 CNCCCNCCOC Amb20171974 [0,2,0,0,0,0|2,0,0]=4 7460 B9R0.45 CNCCCOCCOC Amb27768848 [0,2,0,0,0,0|2,0,0]=4 7461 B9R0.45 CNCCCSCCSC Amb27165838 [0,2,0,0,0,0|2,0,0]=4 7462 B9R0.45 CNCCOCCCOC Amb21954035 [0,2,0,0,0,0|2,0,0]=4 7463 B9R0.45 CNCCOCCCSC Amb27650781 [0,2,0,0,0,0|2,0,0]=4 7464 B9R0.45 CNCCSCCCCO Amb28193864 [0,2,0,0,0,0|0,0,2]=4 7465 B9R0.45 COCCCCCCCCl Amb28066514 [0,2,0,0,0,0|0,0,2]=4 7466 B9R0.45 COCCCCCCOC Amb10807404 [0,2,0,0,0,0|0,0,2]=4 7467 B9R0.45 COCCCCNCCBr Amb27847371 [0,2,0,0,0,0|1,0,1]=4 7468 B9R0.45 COCCCCNCCO Amb28368980 [0,2,0,0,0,0|0,0,2]=4 7469 B9R0.45 COCCCCOCCN Amb28047109 [0,2,0,0,0,0|1,0,1]=4 7470 B9R0.45 COCCCCSCCN Amb27951686 [0,2,0,0,0,0|1,0,1]=4 7471 B9R0.45 COCCCNCCC#N Amb8841110 [0,2,0,0,0,0|1,0,1]=4 7472 B9R0.45 COCCCNCCCN Amb17315264 [0,2,0,0,0,0|1,0,1]=4 7473 B9R0.45 COCCCNCCCO Amb17308606 [0,2,0,0,0,0|0,0,2]=4 7474 B9R0.45 COCCCNCCOC Amb8841615 [0,2,0,0,0,0|2,0,0]=4 7475 B9R0.45 COCCCNCCSC Amb18800727 [0,2,0,0,0,0|2,0,0]=4 7476 B9R0.45 COCCCOCCC#N Amb28041771 [0,2,0,0,0,0|1,0,1]=4 7477 B9R0.45 COCCCOCCCN Amb28196278 [0,2,0,0,0,0|1,0,1]=4 7478 B9R0.45 COCCCOCCCO Amb20242414 [0,2,0,0,0,0|0,0,2]=4 7479 B9R0.45 COCCCOCCON Amb27817087 [0,2,0,0,0,0|2,0,0]=4 7480 B9R0.45 COCCCSCCC#N Amb28287619 [0,2,0,0,0,0|1,0,1]=4 7481 B9R0.45 COCCCSCCCCl Amb27393495 [0,2,0,0,0,0|1,0,1]=4 7482 B9R0.45 COCCCSCCCS Amb28058832 [0,2,0,0,0,0|0,1,1]=4 7483 B9R0.45 COCCCSCCOC Amb28064860 [0,2,0,0,0,0|2,0,0]=4 7484 B9R0.45 COCCNCCCSC Amb6719616 [0,2,0,0,0,0|2,0,0]=4 7485 B9R0.45 COCCNCC\C=C\Cl Amb27390979 [0,2,0,0,0,0|1,0,1]=4 7486 B9R0.45 COCCOCCCC#N Amb6278119 [0,2,0,0,0,0|1,0,1]=4 7487 B9R0.45 COCCOCCCCBr Amb8855450 [0,2,0,0,0,0|1,0,1]=4 7488 B9R0.45 COCCOCCCCCl Amb18798737 [0,2,0,0,0,0|1,0,1]=4 7489 B9R0.45 COCCOCCCCN Amb6250163 [0,2,0,0,0,0|1,0,1]=4 7490 B9R0.45 COCCOCCCNN Amb27244139 [0,2,0,0,0,0|2,0,0]=4 7491 B9R0.45 COCCOCCN=C=O Amb18559240 [0,2,0,0,0,0|1,0,1]=4 7492 B9R0.45 COCCSCCCC#N Amb9305283 [0,2,0,0,0,0|1,0,1]=4 7493 B9R0.45 COCCSCCCCF Amb28064856 [0,2,0,0,0,0|1,0,1]=4 7494 B9R0.45 COCCSCCCON Amb27199029 [0,2,0,0,0,0|2,0,0]=4 7495 B9R0.45 COCOCCC#CC=O Amb27838100 [0,2,0,0,0,0|0,0,2]=4 7496 B9R0.45 COCOCCCCCBr Amb27408460 [0,2,0,0,0,0|1,0,1]=4 7497 B9R0.45 COCOCCCCCN Amb28291853 [0,2,0,0,0,0|1,0,1]=4 7498 B9R0.45 COCOCCCCCO Amb27839456 [0,2,0,0,0,0|0,0,2]=4 7499 B9R0.45 CONCCCCCCO Amb27952629 [0,2,0,0,0,0|0,0,2]=4 7500 B9R0.45 CO\C=C\CCCNC=O Amb27223364 [0,2,0,0,0,0|0,0,2]=4 7501 B9R0.45 CO\N=C\CCCCC=O Amb27422978 [0,2,0,0,0,0|0,0,1]=3 7502 B9R0.45 CSCCCCCCCN Amb27860341 [0,2,0,0,0,0|0,1,1]=4 7503 B9R0.45 CSCCCCCCSC Amb6366244 [0,2,0,0,0,0|0,1,1]=4 7504 B9R0.45 CSCCCCCN=C=O Amb27658593 [0,2,0,0,0,0|0,0,1]=3 7505 B9R0.45 CSCCCCCN=[N+]=[N-] Amb27793004 [0,2,0,0,0,0|2,0,0]=4 7506 B9R0.45 CSCCCCCNC=O Amb27165514 [0,2,0,0,0,0|0,0,0]=2 7507 B9R0.45 CSCCCCNCCF Amb27591973 [0,2,0,0,0,0|1,0,1]=4 7508 B9R0.45 CSCCCCNCCN Amb27770492 [0,2,0,0,0,0|1,0,1]=4 7509 B9R0.45 CSCCCC\C=C\CO Amb27604531 [0,2,0,0,0,0|0,0,2]=4 7510 B9R0.45 CSCCCNCCCBr Amb27235561 [0,2,0,0,0,0|1,0,1]=4 7511 B9R0.45 CSCCCSCCCF Amb27171622 [0,2,0,0,0,0|1,0,1]=4 7512 B9R0.45 CSCCCSCCCO Amb28132547 [0,2,0,0,0,0|0,0,2]=4 7513 B9R0.45 CSCCCSCCON Amb27402152 [0,2,0,0,0,0|2,0,0]=4 7514 B9R0.45 CSCCOCCCC#N Amb27944940 [0,2,0,0,0,0|1,0,1]=4 7515 B9R0.45 CSCCOCCCCCl Amb28041418 [0,2,0,0,0,0|1,0,1]=4 7516 B9R0.45 CSCCOCCCCS Amb27834483 [0,2,0,0,0,0|0,1,1]=4 7517 B9R0.45 CSCCSCCCCBr Amb27758249 [0,2,0,0,0,0|1,0,1]=4 7518 B9R0.45 CSCCSCCCCS Amb28382933 [0,2,0,0,0,0|0,1,1]=4 7519 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [0,2,0,0,0,0|1,0,1]=4 7520 B9R0.45 C\C=C/CCCCCCC Amb26019969 [0,2,0,0,0,0|1,0,0]=3 7521 B9R0.45 C\C=C\CCCCCCO Amb27980554 [0,2,0,0,0,0|1,0,0]=3 7522 B9R0.45 C\C=C\CCCCCNC Amb26398871 [0,2,0,0,0,0|1,0,0]=3 7523 B9R0.45 C\C=C\CCNCCCC Amb27789929 [0,2,0,0,0,0|1,0,0]=3 7524 B9R0.45 C\C=C\CNCCCCCl Amb28047862 [0,2,0,0,0,0|1,0,1]=4 7525 B9R0.45 C\C=C\CNCCCOC Amb28254436 [0,2,0,0,0,0|1,0,1]=4 7526 B9R0.45 C\C=C\CNCCOCC Amb27823197 [0,2,0,0,0,0|1,0,1]=4 7527 B9R0.45 C\C=C\CNCCSCC Amb27652288 [0,2,0,0,0,0|1,0,1]=4 7528 B9R0.45 C\C=C\COCCCNC Amb27487855 [0,2,0,0,0,0|1,0,1]=4 7529 B9R0.45 C\C=C\C\C=C\CCC=O Amb27646624 [0,2,0,0,0,0|0,0,2]=4 7530 B9R0.45 C\C=C\OCCCCCO Amb28350349 [0,2,0,0,0,0|1,0,1]=4 7531 B9R0.45 ClCCCCCCCCCl Amb2721447 [0,2,0,0,0,0|1,0,1]=4 7532 B9R0.45 ClCCCCCCOCCl Amb28126752 [0,2,0,0,0,0|1,0,1]=4 7533 B9R0.45 Cl\C=C\CNCCCCBr Amb27614952 [0,2,0,0,0,0|1,0,1]=4 7534 B9R0.45 FCCCCCCCCBr Amb27265588 [0,2,0,0,0,0|1,0,1]=4 7535 B9R0.45 FCCCCCCCCCl Amb28067739 [0,2,0,0,0,0|1,0,1]=4 7536 B9R0.45 FCCCCCCCCF Amb22641491 [0,2,0,0,0,0|1,0,1]=4 7537 B9R0.45 FCCCCCNCCCl Amb28126872 [0,2,0,0,0,0|1,0,1]=4 7538 B9R0.45 FCCCCCNCCF Amb28069963 [0,2,0,0,0,0|1,0,1]=4 7539 B9R0.45 FCCCCCSCCCl Amb28063270 [0,2,0,0,0,0|1,0,1]=4 7540 B9R0.45 FCCCCNCCCBr Amb27263407 [0,2,0,0,0,0|1,0,1]=4 7541 B9R0.45 FCCCNCCCCBr Amb27199870 [0,2,0,0,0,0|1,0,1]=4 7542 B9R0.45 FCCNCCCCCBr Amb27664326 [0,2,0,0,0,0|1,0,1]=4 7543 B9R0.45 N#CCCCCCCC#N Amb8389354 [0,2,0,0,0,0|1,0,1]=4 7544 B9R0.45 N#CCCCCCCC=O Amb26516252 [0,2,0,0,0,0|0,0,0]=2 7545 B9R0.45 N#CCCCCCCCN Amb27867353 [0,2,0,0,0,0|1,0,1]=4 7546 B9R0.45 N#CCCCCNCCF Amb27858508 [0,2,0,0,0,0|1,0,1]=4 7547 B9R0.45 N#CCCCCNCCN Amb27976894 [0,2,0,0,0,0|1,0,1]=4 7548 B9R0.45 N#CCCCCSCCN Amb8876140 [0,2,0,0,0,0|1,0,1]=4 7549 B9R0.45 N#CCCCNCCCF Amb27974869 [0,2,0,0,0,0|1,0,1]=4 7550 B9R0.45 N#CCCCNCCCN Amb22008325 [0,2,0,0,0,0|1,0,1]=4 7551 B9R0.45 N#CSCCCCCCF Amb25368926 [0,2,0,0,0,0|1,0,1]=4 7552 B9R0.45 NCCCCCCCCN Amb8387247 [0,2,0,0,0,0|1,0,1]=4 7553 B9R0.45 NCCCCCCCCO Amb24116967 [0,2,0,0,0,0|0,0,2]=4 7554 B9R0.45 NCCCCCCNC=O Amb28251393 [0,2,0,0,0,0|0,0,0]=2 7555 B9R0.45 NCCCCCNCCCl Amb27804050 [0,2,0,0,0,0|1,0,1]=4 7556 B9R0.45 NCCCCCNCCO Amb8394909 [0,2,0,0,0,0|0,0,2]=4 7557 B9R0.45 NCCCCCOCCF Amb27242054 [0,2,0,0,0,0|1,0,1]=4 7558 B9R0.45 NCCCCNCCCCl Amb24117237 [0,2,0,0,0,0|1,0,1]=4 7559 B9R0.45 NCCCCNCCCCl Amb28067741 [0,2,0,0,0,0|1,0,1]=4 7560 B9R0.45 NCCCCNCCCF Amb26506888 [0,2,0,0,0,0|1,0,1]=4 7561 B9R0.45 NCCCCNCCCN Amb8514497 [0,2,0,0,0,0|1,0,1]=4 7562 B9R0.45 NCCCCNCCCO Amb27473423 [0,2,0,0,0,0|0,0,2]=4 7563 B9R0.45 NCCCCNCCON Amb28058839 [0,2,0,0,0,0|2,0,0]=4 7564 B9R0.45 NCCCCOC\C=C\Cl Amb27431761 [0,2,0,0,0,0|1,0,1]=4 7565 B9R0.45 NCCCCSCCCO Amb17500966 [0,2,0,0,0,0|0,0,2]=4 7566 B9R0.45 NCCCNCCCC=O Amb27489145 [0,2,0,0,0,0|0,0,0]=2 7567 B9R0.45 NCCCNCCCON Amb27629053 [0,2,0,0,0,0|2,0,0]=4 7568 B9R0.45 NCCCOCCCCO Amb28454517 [0,2,0,0,0,0|0,0,2]=4 7569 B9R0.45 NCCCSCCCCF Amb27770557 [0,2,0,0,0,0|1,0,1]=4 7570 B9R0.45 NCCCSCCCON Amb27857566 [0,2,0,0,0,0|2,0,0]=4 7571 B9R0.45 NCCNCCCCCF Amb27661429 [0,2,0,0,0,0|1,0,1]=4 7572 B9R0.45 NCCOCCCCCF Amb27660390 [0,2,0,0,0,0|1,0,1]=4 7573 B9R0.45 O=C=NCCCCCCO Amb27873254 [0,2,0,0,0,0|0,0,1]=3 7574 B9R0.45 O=CCCCCCCC=O Amb27836602 [0,2,0,0,0,0|0,0,0]=2 7575 B9R0.45 O=CCCCCCCCF Amb25075653 [0,2,0,0,0,0|0,0,0]=2 7576 B9R0.45 O=CCCCCCCCO Amb25765567 [0,2,0,0,0,0|0,0,0]=2 7577 B9R0.45 O=CCCCC\C=C\CF Amb27435440 [0,2,0,0,0,0|0,0,1]=3 7578 B9R0.45 O=CCC\C=C/CCC=O Amb27794668 [0,2,0,0,0,0|0,0,2]=4 7579 B9R0.45 O=CCC\C=C\CCC=O Amb25984364 [0,2,0,0,0,0|0,0,2]=4 7580 B9R0.45 O=CCOCCOCCO Amb26024891 [0,2,0,0,0,0|1,0,0]=3 7581 B9R0.45 O=CNCCCCNC=O Amb4018897 [0,2,0,0,0,0|1,0,1]=4 7582 B9R0.45 O=CNCCC\C=C\CO Amb26994607 [0,2,0,0,0,0|0,0,2]=4 7583 B9R0.45 O=C\C=C/CCCCC=O Amb27168965 [0,2,0,0,0,0|0,0,2]=4 7584 B9R0.45 OCCCCCCC#CI Amb32643987 [0,2,0,0,0,0|1,0,1]=4 7585 B9R0.45 OCCCCCCCCBr Amb4296902 [0,2,0,0,0,0|0,0,2]=4 7586 B9R0.45 OCCCCCCCCCl Amb6366711 [0,2,0,0,0,0|0,0,2]=4 7587 B9R0.45 OCCCCCCCCF Amb25330666 [0,2,0,0,0,0|0,0,2]=4 7588 B9R0.45 OCCCCCCCCI Amb32411246 [0,2,0,0,0,0|0,0,2]=4 7589 B9R0.45 OCCCCCCCCO Amb8383419 [0,2,0,0,0,0|0,0,2]=4 7590 B9R0.45 OCCCCCCCCS Amb28046913 [0,2,0,0,0,0|0,0,2]=4 7591 B9R0.45 OCCCCCOCCCl Amb28321747 [0,2,0,0,0,0|0,0,2]=4 7592 B9R0.45 OCCCCCOCCO Amb27847385 [0,2,0,0,0,0|0,0,2]=4 7593 B9R0.45 OCCCCCSCCO Amb18800854 [0,2,0,0,0,0|0,0,2]=4 7594 B9R0.45 OCCCCOCCCO Amb27218138 [0,2,0,0,0,0|0,0,2]=4 7595 B9R0.45 OCCCNCCCCF Amb27752581 [0,2,0,0,0,0|0,0,2]=4 7596 B9R0.45 OCCCSCCCCF Amb28204584 [0,2,0,0,0,0|0,0,2]=4 7597 B9R0.45 OCCCSCCCCS Amb27452872 [0,2,0,0,0,0|0,0,2]=4 7598 B9R0.45 OCCNCCCCCF Amb27805496 [0,2,0,0,0,0|0,0,2]=4 7599 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [0,2,0,0,0,0|0,0,2]=4 7600 B9R0.45 OC\C=C\CCCCCO Amb27204813 [0,2,0,0,0,0|0,0,2]=4 7601 B9R0.45 [C-]#[N+]CCCCCC[N+]#[C-] Amb3973107 [0,2,0,0,0,0|2,0,0]=4 7602 B9R0.45 [C-]#[N+]CCCOCCCC Amb3973111 [0,2,0,0,0,0|1,0,1]=4 7603 B9R0.45 [N-]=[N+]=NCCCCCCCl Amb28071015 [0,2,0,0,0,0|2,0,0]=4 7604 B9R0.45 [N-]=[N+]=NCCCCCCN Amb21960881 [0,2,0,0,0,0|2,0,0]=4 7605 B9R0.45 [N-]=[N+]=NCCCCCCN Amb33551012 [0,2,0,0,0,0|2,0,0]=4 7606 B9R0.45 [N-]=[N+]=NCCCCCCO Amb27759380 [0,2,0,0,0,0|2,0,0]=4 7607 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [0,2,0,0,0,0|1,0,1]=4 7608 B9R0.46 C#CC(=O)COCCOC Amb27227579 [0,2,0,0,0,0|2,0,0]=4 7609 B9R0.46 C#CC(=O)NCCCCN Amb27617081 [0,2,0,0,0,0|2,0,0]=4 7610 B9R0.46 C#CC(=O)NCCCOC Amb27243177 [0,2,0,0,0,0|2,0,0]=4 7611 B9R0.46 C#CC(Br)CCCCCC Amb17939781 [0,2,0,0,0,0|1,0,1]=4 7612 B9R0.46 C#CC(C)NCCCCC Amb26492885 [0,2,0,0,0,0|1,0,1]=4 7613 B9R0.46 C#CC(Cl)CCCCCC Amb28320596 [0,2,0,0,0,0|1,0,1]=4 7614 B9R0.46 C#CC(N)CCCOCC Amb27759644 [0,2,0,0,0,0|1,0,1]=4 7615 B9R0.46 C#CC(O)CCCCC=C Amb27410832 [0,2,0,0,0,0|1,0,1]=4 7616 B9R0.46 C#CC(O)CCCCCBr Amb22388470 [0,2,0,0,0,0|1,0,1]=4 7617 B9R0.46 C#CC(O)CCCCCC Amb27838900 [0,2,0,0,0,0|0,0,2]=4 7618 B9R0.46 C#CC(O)CCCCCCl Amb28126894 [0,2,0,0,0,0|1,0,1]=4 7619 B9R0.46 C#CC(O)CCCOCC Amb28401329 [0,2,0,0,0,0|1,0,1]=4 7620 B9R0.46 C#CCCCCC(=O)NC Amb27173831 [0,2,0,0,0,0|0,0,2]=4 7621 B9R0.46 C#CCCCCC(=O)NN Amb28342637 [0,2,0,0,0,0|0,0,2]=4 7622 B9R0.46 C#CCCCCC(=O)NO Amb28049733 [0,2,0,0,0,0|0,0,2]=4 7623 B9R0.46 C#CCCCCC(=O)OC Amb18636156 [0,2,0,0,0,0|0,0,2]=4 7624 B9R0.46 C#CCCCCC(Br)CC Amb28320070 [0,2,0,0,0,0|1,0,1]=4 7625 B9R0.46 C#CCCCCC(C)NC Amb27438827 [0,2,0,0,0,0|1,0,1]=4 7626 B9R0.46 C#CCCCCC(O)CC Amb27839167 [0,2,0,0,0,0|1,0,1]=4 7627 B9R0.46 C#CCCCC[C@@H](O)CC Amb27981324 [0,2,0,0,0,0|1,0,1]=4 7628 B9R0.46 C#CCCCC[C@H](O)CC Amb27981609 [0,2,0,0,0,0|1,0,1]=4 7629 B9R0.46 C#CCCCNC(C)CC Amb27487798 [0,2,0,0,0,0|1,0,1]=4 7630 B9R0.46 C#CCCNCC(O)CC Amb28079271 [0,2,0,0,0,0|1,0,1]=4 7631 B9R0.46 C#CCCNC[C@@H](O)CC Amb27248944 [0,2,0,0,0,0|1,0,1]=4 7632 B9R0.46 C#CCCSCC(C)CC Amb27766820 [0,2,0,0,0,0|1,0,1]=4 7633 B9R0.46 C#CCCSCC(N)CC Amb27607634 [0,2,0,0,0,0|1,0,1]=4 7634 B9R0.46 C#C[C@H](O)CCCCCC Amb27970533 [0,2,0,0,0,0|0,0,2]=4 7635 B9R0.46 C=C(C=O)CCCCC=O Amb28049873 [0,2,0,0,0,0|0,0,2]=4 7636 B9R0.46 C=C(C=O)CCCCCC Amb8392631 [0,2,0,0,0,0|0,0,0]=2 7637 B9R0.46 C=C(C=O)CCCCCCl Amb27815104 [0,2,0,0,0,0|0,0,1]=3 7638 B9R0.46 C=C(C=O)CC\C=C/CC Amb26462856 [0,2,0,0,0,0|0,0,2]=4 7639 B9R0.46 C=C(C=O)CC\C=C\CC Amb27422502 [0,2,0,0,0,0|0,0,2]=4 7640 B9R0.46 C=C(CC)CSCCCC Amb28370393 [0,2,0,0,0,0|2,0,0]=4 7641 B9R0.46 C=C(CNCCCC)SC Amb27597601 [0,2,0,0,0,0|1,1,0]=4 7642 B9R0.46 C=CC(=O)CCCCCC Amb27410225 [0,2,0,0,0,0|0,0,0]=2 7643 B9R0.46 C=CC(=O)CC\C=C/CC Amb27945136 [0,2,0,0,0,0|0,0,2]=4 7644 B9R0.46 C=CC(=O)CNCCOC Amb27468403 [0,2,0,0,0,0|2,0,0]=4 7645 B9R0.46 C=CC(=O)COCCOC Amb28322489 [0,2,0,0,0,0|2,0,0]=4 7646 B9R0.46 C=CC(=O)NCCCCN Amb27754638 [0,2,0,0,0,0|2,0,0]=4 7647 B9R0.46 C=CC(=O)NCCCCO Amb27839560 [0,2,0,0,0,0|2,0,0]=4 7648 B9R0.46 C=CC(=O)NCCCOC Amb9480633 [0,2,0,0,0,0|2,0,0]=4 7649 B9R0.46 C=CC(=O)NCCSCC Amb27770559 [0,2,0,0,0,0|2,0,0]=4 7650 B9R0.46 C=CC(=O)OCCCCC Amb17933944 [0,2,0,0,0,0|1,0,0]=3 7651 B9R0.46 C=CC(=O)OCCCCCl Amb25934163 [0,2,0,0,0,0|2,0,0]=4 7652 B9R0.46 C=CC(=O)OCCNCC Amb28119985 [0,2,0,0,0,0|2,0,0]=4 7653 B9R0.46 C=CC(=O)OCCOCC Amb15692678 [0,2,0,0,0,0|2,0,0]=4 7654 B9R0.46 C=CC(=O)OCCSCC Amb25934756 [0,2,0,0,0,0|2,0,0]=4 7655 B9R0.46 C=CC(=O)SCCCCO Amb27775857 [0,2,0,0,0,0|2,0,0]=4 7656 B9R0.46 C=CC(Br)CCCC#CC Amb28120539 [0,2,0,0,0,0|1,0,1]=4 7657 B9R0.46 C=CC(C)CNCCCC Amb27785858 [0,2,0,0,0,0|1,0,0]=3 7658 B9R0.46 C=CC(C)CNCCOC Amb27393750 [0,2,0,0,0,0|2,0,0]=4 7659 B9R0.46 C=CC(C)NCCCCC Amb27857647 [0,2,0,0,0,0|1,0,0]=3 7660 B9R0.46 C=CC(C)NCCOCC Amb27411595 [0,2,0,0,0,0|2,0,0]=4 7661 B9R0.46 C=CC(C)OCCNCC Amb27777855 [0,2,0,0,0,0|2,0,0]=4 7662 B9R0.46 C=CC(C)SCCOCC Amb27763743 [0,2,0,0,0,0|2,0,0]=4 7663 B9R0.46 C=CC(C)SCCSCC Amb28293898 [0,2,0,0,0,0|2,0,0]=4 7664 B9R0.46 C=CC(Cl)CCCCCC Amb26636765 [0,2,0,0,0,0|1,0,0]=3 7665 B9R0.46 C=CC(Cl)CCOCCCl Amb28384138 [0,2,0,0,0,0|2,0,0]=4 7666 B9R0.46 C=CC(F)CCCCCBr Amb28126790 [0,2,0,0,0,0|1,0,0]=3 7667 B9R0.46 C=CC(N)CCCOCC Amb27654779 [0,2,0,0,0,0|1,0,0]=3 7668 B9R0.46 C=CC(N)CCOCCC Amb28050316 [0,2,0,0,0,0|1,0,0]=3 7669 B9R0.46 C=CC(O)CCCCCC Amb8515213 [0,2,0,0,0,0|1,0,0]=3 7670 B9R0.46 C=CC(O)CCCCOC Amb27839199 [0,2,0,0,0,0|1,0,0]=3 7671 B9R0.46 C=CC(O)CCCOCC Amb27766080 [0,2,0,0,0,0|1,0,0]=3 7672 B9R0.46 C=CC(O)CNCCOC Amb27424788 [0,2,0,0,0,0|2,0,0]=4 7673 B9R0.46 C=CC(O)COCCCC Amb27839257 [0,2,0,0,0,0|1,0,0]=3 7674 B9R0.46 C=CCCC#CC(O)CC Amb27839203 [0,2,0,0,0,0|1,0,1]=4 7675 B9R0.46 C=CCCCCC(=C)C=O Amb27622105 [0,2,0,0,0,0|0,0,2]=4 7676 B9R0.46 C=CCCCCC(=O)OC Amb27617093 [0,2,0,0,0,0|0,0,2]=4 7677 B9R0.46 C=CCCCCC(Br)CO Amb28120546 [0,2,0,0,0,0|1,0,0]=3 7678 B9R0.46 C=CCCCCC(C)CCl Amb27838970 [0,2,0,0,0,0|1,0,0]=3 7679 B9R0.46 C=CCCCCC(Cl)C=O Amb27636303 [0,2,0,0,0,0|0,0,1]=3 7680 B9R0.46 C=CCCCCC(Cl)CC Amb28182453 [0,2,0,0,0,0|1,0,0]=3 7681 B9R0.46 C=CCCCCC(F)CO Amb28401074 [0,2,0,0,0,0|1,0,0]=3 7682 B9R0.46 C=CCCCCC(O)C#N Amb27833716 [0,2,0,0,0,0|1,0,1]=4 7683 B9R0.46 C=CCCCCC(O)CCl Amb28067790 [0,2,0,0,0,0|1,0,0]=3 7684 B9R0.46 C=CCCCCC(O)CN Amb8630133 [0,2,0,0,0,0|1,0,0]=3 7685 B9R0.46 C=CCCCCC(O)CO Amb3940525 [0,2,0,0,0,0|1,0,0]=3 7686 B9R0.46 C=CCCCC[C@H](O)CO Amb27839187 [0,2,0,0,0,0|1,0,0]=3 7687 B9R0.46 C=CCCCC[SiH](C)CCl Amb28046093 [0,2,0,0,0,0|1,1,0]=4 7688 B9R0.46 C=CCCCNC(=O)CC Amb27835179 [0,2,0,0,0,0|1,0,1]=4 7689 B9R0.46 C=CCCCNC(C)C=C Amb27837154 [0,2,0,0,0,0|2,0,0]=4 7690 B9R0.46 C=CCCCNC(C)CN Amb27478434 [0,2,0,0,0,0|2,0,0]=4 7691 B9R0.46 C=CCCCNC(C)CO Amb28186828 [0,2,0,0,0,0|2,0,0]=4 7692 B9R0.46 C=CCCCOC(C)C#N Amb27469906 [0,2,0,0,0,0|2,0,0]=4 7693 B9R0.46 C=CCCCSC(C)CN Amb27455662 [0,2,0,0,0,0|2,0,0]=4 7694 B9R0.46 C=CCCNCC(=C)CC Amb27836869 [0,2,0,0,0,0|1,0,1]=4 7695 B9R0.46 C=CCCNCC(C)SC Amb27606175 [0,2,0,0,0,0|2,0,0]=4 7696 B9R0.46 C=CCCNCC(O)CF Amb27862088 [0,2,0,0,0,0|2,0,0]=4 7697 B9R0.46 C=CCCNC[C@H](O)CO Amb27973220 [0,2,0,0,0,0|2,0,0]=4 7698 B9R0.46 C=CCCOCC(C)CBr Amb27458932 [0,2,0,0,0,0|2,0,0]=4 7699 B9R0.46 C=CCCOCC(N)CC Amb27406917 [0,2,0,0,0,0|1,0,0]=3 7700 B9R0.46 C=CCCOCC(O)CCl Amb28042360 [0,2,0,0,0,0|2,0,0]=4 7701 B9R0.46 C=CCCOC[C@@H](N)CO Amb28289961 [0,2,0,0,0,0|2,0,0]=4 7702 B9R0.46 C=CCCSCC(C)CC Amb28138309 [0,2,0,0,0,0|1,0,0]=3 7703 B9R0.46 C=CCCSCC(C)OC Amb27827168 [0,2,0,0,0,0|2,0,0]=4 7704 B9R0.46 C=CCCSCC(N)CC Amb27763096 [0,2,0,0,0,0|1,0,0]=3 7705 B9R0.46 C=CCCSCC(O)CO Amb27632520 [0,2,0,0,0,0|2,0,0]=4 7706 B9R0.46 C=CCNCCC(C)CC Amb27262645 [0,2,0,0,0,0|1,0,0]=3 7707 B9R0.46 C=CCNCCC(C)OC Amb28316016 [0,2,0,0,0,0|2,0,0]=4 7708 B9R0.46 C=CCNCCC(O)CC Amb27262211 [0,2,0,0,0,0|1,0,0]=3 7709 B9R0.46 C=CCOCCC(N)CO Amb27192039 [0,2,0,0,0,0|2,0,0]=4 7710 B9R0.46 C=CCOCCN(C)CC Amb27842961 [0,2,0,0,0,0|2,0,0]=4 7711 B9R0.46 C=CCOCC[C@@H](C)CO Amb27198011 [0,2,0,0,0,0|2,0,0]=4 7712 B9R0.46 C=C[C@@H](O)CCCCCC Amb27197186 [0,2,0,0,0,0|1,0,0]=3 7713 B9R0.46 C=C[C@H](C)CCCCCO Amb28138710 [0,2,0,0,0,0|1,0,0]=3 7714 B9R0.46 C=C[C@H](F)CCCCCBr Amb27787442 [0,2,0,0,0,0|1,0,0]=3 7715 B9R0.46 C=C\C(C)=C/CCCC=O Amb25887767 [0,2,0,0,0,0|0,0,2]=4 7716 B9R0.46 C=C\C(C)=C\CCCC=O Amb28287331 [0,2,0,0,0,0|0,0,2]=4 7717 B9R0.46 CC(C=O)CCCCC=O Amb27614225 [0,2,0,0,0,0|0,0,0]=2 7718 B9R0.46 CC(CO)CCCCC#N Amb27256801 [0,2,0,0,0,0|1,0,1]=4 7719 B9R0.46 CC(CO)CSCCC=O Amb28342703 [0,2,0,0,0,0|1,0,0]=3 7720 B9R0.46 CCC(=O)CCCCC#N Amb27170911 [0,2,0,0,0,0|1,0,1]=4 7721 B9R0.46 CCC(=O)CCCCCO Amb27627259 [0,2,0,0,0,0|1,0,0]=3 7722 B9R0.46 CCC(=O)NCCCCF Amb28313877 [0,2,0,0,0,0|2,0,0]=4 7723 B9R0.46 CCC(=O)NCCCCI Amb27839559 [0,2,0,0,0,0|2,0,0]=4 7724 B9R0.46 CCC(=O)NCCCCN Amb17053701 [0,2,0,0,0,0|2,0,0]=4 7725 B9R0.46 CCC(=O)NCCCNC Amb9464380 [0,2,0,0,0,0|2,0,0]=4 7726 B9R0.46 CCC(=O)NCCCOC Amb17775258 [0,2,0,0,0,0|2,0,0]=4 7727 B9R0.46 CCC(=O)NCCCSC Amb28201200 [0,2,0,0,0,0|2,0,0]=4 7728 B9R0.46 CCC(=O)NCCOC=O Amb27779565 [0,2,0,0,0,0|1,0,1]=4 7729 B9R0.46 CCC(=O)OCCCCBr Amb28120684 [0,2,0,0,0,0|2,0,0]=4 7730 B9R0.46 CCC(=O)OCCCCCl Amb27494048 [0,2,0,0,0,0|2,0,0]=4 7731 B9R0.46 CCC(=O)OCCCCO Amb26485117 [0,2,0,0,0,0|2,0,0]=4 7732 B9R0.46 CCC(=O)OCCCSC Amb28070380 [0,2,0,0,0,0|2,0,0]=4 7733 B9R0.46 CCC(Br)CCNCCF Amb27973194 [0,2,0,0,0,0|1,0,1]=4 7734 B9R0.46 CCC(C)CCCCC=O Amb28077640 [0,2,0,0,0,0|0,0,0]=2 7735 B9R0.46 CCC(C)CCCCCBr Amb28428516 [0,2,0,0,0,0|1,0,1]=4 7736 B9R0.46 CCC(C)CCCCCN Amb28385774 [0,2,0,0,0,0|1,0,1]=4 7737 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|0,0,2]=4 7738 B9R0.46 CCC(C)CCNCCO Amb28050561 [0,2,0,0,0,0|0,0,2]=4 7739 B9R0.46 CCC(C)CCOCCN Amb27618047 [0,2,0,0,0,0|1,0,1]=4 7740 B9R0.46 CCC(C)CNCCC#N Amb6736615 [0,2,0,0,0,0|1,0,1]=4 7741 B9R0.46 CCC(C)CNCCCBr Amb28049449 [0,2,0,0,0,0|1,0,1]=4 7742 B9R0.46 CCC(C)CNCCCCl Amb27763526 [0,2,0,0,0,0|1,0,1]=4 7743 B9R0.46 CCC(C)CNCCCF Amb27425077 [0,2,0,0,0,0|1,0,1]=4 7744 B9R0.46 CCC(C)COCCCBr Amb27875135 [0,2,0,0,0,0|1,0,1]=4 7745 B9R0.46 CCC(C)COCCCN Amb27768706 [0,2,0,0,0,0|1,0,1]=4 7746 B9R0.46 CCC(C)CSCCC=O Amb27809578 [0,2,0,0,0,0|0,0,0]=2 7747 B9R0.46 CCC(C)NCCCCF Amb27766784 [0,2,0,0,0,0|1,0,1]=4 7748 B9R0.46 CCC(C)NCCCOC Amb6730317 [0,2,0,0,0,0|2,0,0]=4 7749 B9R0.46 CCC(C)NCCCSC Amb6719664 [0,2,0,0,0,0|2,0,0]=4 7750 B9R0.46 CCC(C)OCCCCS Amb27588540 [0,2,0,0,0,0|0,1,1]=4 7751 B9R0.46 CCC(C)OCCCON Amb28062345 [0,2,0,0,0,0|2,0,0]=4 7752 B9R0.46 CCC(C)SCCCCN Amb9391446 [0,2,0,0,0,0|1,0,1]=4 7753 B9R0.46 CCC(C)SCCCCS Amb27801732 [0,2,0,0,0,0|0,1,1]=4 7754 B9R0.46 CCC(C)SCCCOC Amb28400490 [0,2,0,0,0,0|2,0,0]=4 7755 B9R0.46 CCC(C)SCCCON Amb28193724 [0,2,0,0,0,0|2,0,0]=4 7756 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|0,0,2]=4 7757 B9R0.46 CCC(N)CCCCC#N Amb28244686 [0,2,0,0,0,0|1,0,1]=4 7758 B9R0.46 CCC(N)CCCCCO Amb26865511 [0,2,0,0,0,0|0,0,2]=4 7759 B9R0.46 CCC(N)CNCCOC Amb25375423 [0,2,0,0,0,0|2,0,0]=4 7760 B9R0.46 CCC(N)COCCOC Amb27618093 [0,2,0,0,0,0|2,0,0]=4 7761 B9R0.46 CCC(N)CSCCCO Amb28344434 [0,2,0,0,0,0|0,0,2]=4 7762 B9R0.46 CCC(N)CSCCON Amb27843898 [0,2,0,0,0,0|2,0,0]=4 7763 B9R0.46 CCC(O)CCCCNC Amb28193277 [0,2,0,0,0,0|1,0,1]=4 7764 B9R0.46 CCC(O)CCCNC#N Amb28344018 [0,2,0,0,0,0|1,0,1]=4 7765 B9R0.46 CCC(O)CCCNC=O Amb27785123 [0,2,0,0,0,0|0,0,0]=2 7766 B9R0.46 CCC(O)CCNCCF Amb27458264 [0,2,0,0,0,0|1,0,1]=4 7767 B9R0.46 CCC(O)CNCCC#N Amb27656284 [0,2,0,0,0,0|1,0,1]=4 7768 B9R0.46 CCC(O)CNCCCS Amb27985489 [0,2,0,0,0,0|0,1,1]=4 7769 B9R0.46 CCC(O)COCCOC Amb26506871 [0,2,0,0,0,0|2,0,0]=4 7770 B9R0.46 CCC(O)CSCCCN Amb27615088 [0,2,0,0,0,0|1,0,1]=4 7771 B9R0.46 CCC(O)CSCCSC Amb27233915 [0,2,0,0,0,0|2,0,0]=4 7772 B9R0.46 CCCCC#CC(=O)OC Amb2721692 [0,2,0,0,0,0|0,0,2]=4 7773 B9R0.46 CCCCC=C=C(C)C=O Amb28074739 [0,2,0,0,0,0|0,0,2]=4 7774 B9R0.46 CCCCCCC(=N)NO Amb22733338 [0,2,0,0,0,0|0,0,1]=3 7775 B9R0.46 CCCCCCC(=O)C#N Amb22734561 [0,2,0,0,0,0|0,0,0]=2 7776 B9R0.46 CCCCCCC(=O)C=O Amb28422342 [0,2,0,0,0,0|0,0,0]=2 7777 B9R0.46 CCCCCCC(=O)CBr Amb24078361 [0,2,0,0,0,0|0,0,0]=2 7778 B9R0.46 CCCCCCC(=O)CC Amb2720775 [0,2,0,0,0,0|0,0,0]=2 7779 B9R0.46 CCCCCCC(=O)CF Amb27265611 [0,2,0,0,0,0|0,0,0]=2 7780 B9R0.46 CCCCCCC(=O)CO Amb28254622 [0,2,0,0,0,0|0,0,0]=2 7781 B9R0.46 CCCCCCC(=O)NN Amb2794470 [0,2,0,0,0,0|0,0,0]=2 7782 B9R0.46 CCCCCCC(=O)NN Amb31302345 [0,2,0,0,0,0|0,0,0]=2 7783 B9R0.46 CCCCCCC(=O)NO Amb25146254 [0,2,0,0,0,0|0,0,0]=2 7784 B9R0.46 CCCCCCC(=O)OC Amb9787230 [0,2,0,0,0,0|0,0,0]=2 7785 B9R0.46 CCCCCCC(Br)CBr Amb17845325 [0,2,0,0,0,0|1,0,1]=4 7786 B9R0.46 CCCCCCC(Br)CN Amb27626902 [0,2,0,0,0,0|1,0,1]=4 7787 B9R0.46 CCCCCCC(Br)CO Amb28126801 [0,2,0,0,0,0|0,0,2]=4 7788 B9R0.46 CCCCCCC(C)C#N Amb8950096 [0,2,0,0,0,0|1,0,1]=4 7789 B9R0.46 CCCCCCC(C)CBr Amb20240804 [0,2,0,0,0,0|1,0,1]=4 7790 B9R0.46 CCCCCCC(C)CC Amb6366304 [0,2,0,0,0,0|1,0,1]=4 7791 B9R0.46 CCCCCCC(C)CCl Amb26403332 [0,2,0,0,0,0|1,0,1]=4 7792 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|0,0,2]=4 7793 B9R0.46 CCCCCCC(C)NN Amb20623338 [0,2,0,0,0,0|1,0,1]=4 7794 B9R0.46 CCCCCCC(C)NN Amb7795640 [0,2,0,0,0,0|1,0,1]=4 7795 B9R0.46 CCCCCCC(Cl)C#N Amb18177676 [0,2,0,0,0,0|1,0,1]=4 7796 B9R0.46 CCCCCCC(Cl)C=O Amb26493540 [0,2,0,0,0,0|0,0,0]=2 7797 B9R0.46 CCCCCCC(Cl)CC Amb27872816 [0,2,0,0,0,0|1,0,1]=4 7798 B9R0.46 CCCCCCC(Cl)CCl Amb9787127 [0,2,0,0,0,0|1,0,1]=4 7799 B9R0.46 CCCCCCC(N)C#N Amb7795987 [0,2,0,0,0,0|1,0,1]=4 7800 B9R0.46 CCCCCCC(N)CBr Amb27614898 [0,2,0,0,0,0|1,0,1]=4 7801 B9R0.46 CCCCCCC(N)CO Amb27770563 [0,2,0,0,0,0|0,0,2]=4 7802 B9R0.46 CCCCCCC(O)CC Amb10068521 [0,2,0,0,0,0|0,0,2]=4 7803 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|0,0,2]=4 7804 B9R0.46 CCCCCCC(O)CO Amb8514191 [0,2,0,0,0,0|0,0,2]=4 7805 B9R0.46 CCCCCCC(O)CS Amb27823218 [0,2,0,0,0,0|0,0,2]=4 7806 B9R0.46 CCCCCCC(S)CS Amb16232249 [0,2,0,0,0,0|0,1,1]=4 7807 B9R0.46 CCCCCCN(C)C#N Amb27424944 [0,2,0,0,0,0|1,0,1]=4 7808 B9R0.46 CCCCCCN(C)N=O Amb24655838 [0,2,0,0,0,0|1,0,0]=3 7809 B9R0.46 CCCCCC[C@@H](C)CBr Amb27224123 [0,2,0,0,0,0|1,0,1]=4 7810 B9R0.46 CCCCCC[C@@H](Cl)C=O Amb27477830 [0,2,0,0,0,0|0,0,0]=2 7811 B9R0.46 CCCCCC[C@@H](Cl)CC Amb27185588 [0,2,0,0,0,0|1,0,1]=4 7812 B9R0.46 CCCCCC[C@@H](F)CBr Amb27872246 [0,2,0,0,0,0|1,0,1]=4 7813 B9R0.46 CCCCCC[C@@H](F)CO Amb27213919 [0,2,0,0,0,0|0,0,2]=4 7814 B9R0.46 CCCCCC[C@@H](N)CO Amb27812823 [0,2,0,0,0,0|0,0,2]=4 7815 B9R0.46 CCCCCC[C@@H](O)CBr Amb27214043 [0,2,0,0,0,0|0,0,2]=4 7816 B9R0.46 CCCCCC[C@@H](O)CCl Amb27630055 [0,2,0,0,0,0|0,0,2]=4 7817 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|0,0,2]=4 7818 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|0,0,2]=4 7819 B9R0.46 CCCCCC[C@H](N)CO Amb28126944 [0,2,0,0,0,0|0,0,2]=4 7820 B9R0.46 CCCCCC[C@H](O)C#N Amb28256387 [0,2,0,0,0,0|0,0,2]=4 7821 B9R0.46 CCCCCC[C@H](O)CF Amb27480605 [0,2,0,0,0,0|0,0,2]=4 7822 B9R0.46 CCCCCC[C@H](O)CN Amb27413021 [0,2,0,0,0,0|0,0,2]=4 7823 B9R0.46 CCCCCC\C(C)=C/Cl Amb28076526 [0,2,0,0,0,0|1,0,0]=3 7824 B9R0.46 CCCCCC\C(C)=N\N Amb27758039 [0,2,0,0,0,0|1,0,0]=3 7825 B9R0.46 CCCCCC\C(Cl)=C/Cl Amb28144709 [0,2,0,0,0,0|1,0,0]=3 7826 B9R0.46 CCCCCC\C(Cl)=C\Cl Amb27195843 [0,2,0,0,0,0|1,0,0]=3 7827 B9R0.46 CCCCCC\C(Cl)=N\O Amb27604397 [0,2,0,0,0,0|0,0,1]=3 7828 B9R0.46 CCCCCC\C(F)=C/Cl Amb27791805 [0,2,0,0,0,0|1,0,0]=3 7829 B9R0.46 CCCCCNC(=N)NN Amb22499249 [0,2,0,0,0,0|2,0,0]=4 7830 B9R0.46 CCCCCNC(=N)NN Amb8390921 [0,2,0,0,0,0|2,0,0]=4 7831 B9R0.46 CCCCCNC(=O)CBr Amb17331497 [0,2,0,0,0,0|1,0,0]=3 7832 B9R0.46 CCCCCNC(=O)CC Amb17736727 [0,2,0,0,0,0|1,0,0]=3 7833 B9R0.46 CCCCCNC(=O)CCl Amb1225540 [0,2,0,0,0,0|1,0,0]=3 7834 B9R0.46 CCCCCNC(=O)CN Amb5783142 [0,2,0,0,0,0|1,0,0]=3 7835 B9R0.46 CCCCCNC(=O)NN Amb8853866 [0,2,0,0,0,0|1,0,0]=3 7836 B9R0.46 CCCCCNC(=S)NC Amb4344700 [0,2,0,0,0,0|1,1,0]=4 7837 B9R0.46 CCCCCNC(=S)NN Amb1153021 [0,2,0,0,0,0|1,1,0]=4 7838 B9R0.46 CCCCCNC(C)CC Amb6688188 [0,2,0,0,0,0|1,0,1]=4 7839 B9R0.46 CCCCCNC(C)CCl Amb27805497 [0,2,0,0,0,0|1,0,1]=4 7840 B9R0.46 CCCCCN\C(N)=N\N Amb25251989 [0,2,0,0,0,0|2,0,0]=4 7841 B9R0.46 CCCCCOC(=O)C=O Amb26624671 [0,2,0,0,0,0|0,0,1]=3 7842 B9R0.46 CCCCCOC(=O)CBr Amb22036620 [0,2,0,0,0,0|1,0,0]=3 7843 B9R0.46 CCCCCOC(=O)CN Amb22277108 [0,2,0,0,0,0|1,0,0]=3 7844 B9R0.46 CCCCCOC(=O)CO Amb27839431 [0,2,0,0,0,0|1,0,0]=3 7845 B9R0.46 CCCCCOC(=O)NN Amb28421753 [0,2,0,0,0,0|1,0,0]=3 7846 B9R0.46 CCCCCOC(=O)OC Amb26480707 [0,2,0,0,0,0|1,0,0]=3 7847 B9R0.46 CCCCCOC(=S)S[Na] Amb27874690 [0,2,0,0,0,0|1,1,0]=4 7848 B9R0.46 CCCCCOC(C)CO Amb27857498 [0,2,0,0,0,0|0,0,2]=4 7849 B9R0.46 CCCCCO[C@@H](C)CO Amb27394892 [0,2,0,0,0,0|0,0,2]=4 7850 B9R0.46 CCCCCSC(=S)NN Amb27613114 [0,2,0,0,0,0|1,1,0]=4 7851 B9R0.46 CCCCCSC(=S)OC Amb27756971 [0,2,0,0,0,0|1,0,1]=4 7852 B9R0.46 CCCCCS\C(N)=N\N Amb27968815 [0,2,0,0,0,0|2,0,0]=4 7853 B9R0.46 CCCCC\C=C(/C)C=O Amb18643629 [0,2,0,0,0,0|0,0,1]=3 7854 B9R0.46 CCCCC\C=C(/Cl)C=O Amb27838082 [0,2,0,0,0,0|0,0,1]=3 7855 B9R0.46 CCCCC\C=C(\C)C=O Amb27489308 [0,2,0,0,0,0|0,0,1]=3 7856 B9R0.46 CCCCC\C=C(\C)CN Amb27249901 [0,2,0,0,0,0|1,0,1]=4 7857 B9R0.46 CCCCC\C=C(\Cl)CCl Amb27632425 [0,2,0,0,0,0|1,0,1]=4 7858 B9R0.46 CCCCC\C=C(\F)CO Amb27406000 [0,2,0,0,0,0|0,0,2]=4 7859 B9R0.46 CCCCNCC(=O)NN Amb28067634 [0,2,0,0,0,0|1,0,0]=3 7860 B9R0.46 CCCCNCC(C)CCl Amb27424764 [0,2,0,0,0,0|1,0,1]=4 7861 B9R0.46 CCCCNCC(Cl)CC Amb27242061 [0,2,0,0,0,0|1,0,1]=4 7862 B9R0.46 CCCCNCC(N)CC Amb27806280 [0,2,0,0,0,0|1,0,1]=4 7863 B9R0.46 CCCCNCC(O)CC Amb27591960 [0,2,0,0,0,0|1,0,1]=4 7864 B9R0.46 CCCCNCC(O)CO Amb17308645 [0,2,0,0,0,0|0,0,2]=4 7865 B9R0.46 CCCCNCC(S)CS Amb27487335 [0,2,0,0,0,0|0,1,1]=4 7866 B9R0.46 CCCCNC[C@H](O)CC Amb28144394 [0,2,0,0,0,0|1,0,1]=4 7867 B9R0.46 CCCCOCC(=O)CCl Amb27865684 [0,2,0,0,0,0|1,0,0]=3 7868 B9R0.46 CCCCOCC(C)CC Amb27803945 [0,2,0,0,0,0|1,0,1]=4 7869 B9R0.46 CCCCOCC(C)CCl Amb27228843 [0,2,0,0,0,0|1,0,1]=4 7870 B9R0.46 CCCCOCC(N)CC Amb17485997 [0,2,0,0,0,0|1,0,1]=4 7871 B9R0.46 CCCCOCC(N)CO Amb27839156 [0,2,0,0,0,0|0,0,2]=4 7872 B9R0.46 CCCCOCC(O)C=O Amb27646119 [0,2,0,0,0,0|0,0,0]=2 7873 B9R0.46 CCCCOCC(O)CCl Amb9787120 [0,2,0,0,0,0|1,0,1]=4 7874 B9R0.46 CCCCOCC(O)CN Amb8895238 [0,2,0,0,0,0|1,0,1]=4 7875 B9R0.46 CCCCOCC(O)CS Amb28050761 [0,2,0,0,0,0|0,1,1]=4 7876 B9R0.46 CCCCOC[C@@H](O)CC Amb27615814 [0,2,0,0,0,0|1,0,1]=4 7877 B9R0.46 CCCCOC[C@H](N)CO Amb28130815 [0,2,0,0,0,0|0,0,2]=4 7878 B9R0.46 CCCCSCC(=O)NN Amb5721976 [0,2,0,0,0,0|1,0,0]=3 7879 B9R0.46 CCCCSCC(=O)OC Amb9262932 [0,2,0,0,0,0|1,0,0]=3 7880 B9R0.46 CCCCSCC(C)C=O Amb27837938 [0,2,0,0,0,0|0,0,0]=2 7881 B9R0.46 CCCCSCC(Cl)C#N Amb27395189 [0,2,0,0,0,0|1,0,1]=4 7882 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|0,0,2]=4 7883 B9R0.46 CCCCSCC(O)CO Amb10669577 [0,2,0,0,0,0|0,0,2]=4 7884 B9R0.46 CCCCSC[C@H](O)CN Amb27221761 [0,2,0,0,0,0|1,0,1]=4 7885 B9R0.46 CCCCSC\C(C)=C\Cl Amb27397514 [0,2,0,0,0,0|1,0,1]=4 7886 B9R0.46 CCCC\C=C\C(=O)OC Amb25339041 [0,2,0,0,0,0|0,0,2]=4 7887 B9R0.46 CCCNCCC(=O)NO Amb28074897 [0,2,0,0,0,0|1,0,0]=3 7888 B9R0.46 CCCNCCC(C)CC Amb28124478 [0,2,0,0,0,0|1,0,1]=4 7889 B9R0.46 CCCNCCC(N)CC Amb28123553 [0,2,0,0,0,0|1,0,1]=4 7890 B9R0.46 CCCNCCC(O)CO Amb32645150 [0,2,0,0,0,0|0,0,2]=4 7891 B9R0.46 CCCNCC[C@H](O)CC Amb27770360 [0,2,0,0,0,0|1,0,1]=4 7892 B9R0.46 CCCNCC\C(N)=N/O Amb19981292 [0,2,0,0,0,0|1,0,1]=4 7893 B9R0.46 CCCOCCC(=O)CO Amb27616444 [0,2,0,0,0,0|1,0,0]=3 7894 B9R0.46 CCCOCCC(C)CBr Amb26369433 [0,2,0,0,0,0|1,0,1]=4 7895 B9R0.46 CCCOCCC(C)CCl Amb25921281 [0,2,0,0,0,0|1,0,1]=4 7896 B9R0.46 CCCOCCC(C)NC Amb28070797 [0,2,0,0,0,0|2,0,0]=4 7897 B9R0.46 CCCOCCC(C)NN Amb28288881 [0,2,0,0,0,0|2,0,0]=4 7898 B9R0.46 CCCOCCC(O)CN Amb27454686 [0,2,0,0,0,0|1,0,1]=4 7899 B9R0.46 CCCOCC\C(N)=N\N Amb27225679 [0,2,0,0,0,0|2,0,0]=4 7900 B9R0.46 CCCSCCC(N)CO Amb27839116 [0,2,0,0,0,0|0,0,2]=4 7901 B9R0.46 CCC\C=C\CC(=O)CC Amb26948943 [0,2,0,0,0,0|0,0,2]=4 7902 B9R0.46 CCC\C=C\CC(=O)OC Amb27452086 [0,2,0,0,0,0|0,0,2]=4 7903 B9R0.46 CCN(C)CCCCC#N Amb27768855 [0,2,0,0,0,0|1,0,1]=4 7904 B9R0.46 CCN(C)CCCCCCl Amb18788251 [0,2,0,0,0,0|1,0,1]=4 7905 B9R0.46 CCN(C)CCCCCF Amb27944768 [0,2,0,0,0,0|1,0,1]=4 7906 B9R0.46 CCN(C)CCCCCN Amb24700898 [0,2,0,0,0,0|1,0,1]=4 7907 B9R0.46 CCNCCCC(=O)NC Amb24691212 [0,2,0,0,0,0|1,0,0]=3 7908 B9R0.46 CCNCCCC(=O)OC Amb22886193 [0,2,0,0,0,0|1,0,0]=3 7909 B9R0.46 CCNCCCC(=O)OC Amb8951853 [0,2,0,0,0,0|1,0,0]=3 7910 B9R0.46 CCNCCCC(C)OC Amb25738781 [0,2,0,0,0,0|2,0,0]=4 7911 B9R0.46 CCNCCCC(O)CC Amb27618908 [0,2,0,0,0,0|1,0,1]=4 7912 B9R0.46 CCNCCCS(=O)CC Amb27838992 [0,2,0,0,0,0|2,0,0]=4 7913 B9R0.46 CCOCCCC(=O)CC Amb9316826 [0,2,0,0,0,0|1,0,0]=3 7914 B9R0.46 CCOCCCC(=O)OC Amb8961279 [0,2,0,0,0,0|1,0,0]=3 7915 B9R0.46 CCOCCCC(C)CBr Amb26392239 [0,2,0,0,0,0|1,0,1]=4 7916 B9R0.46 CCOCCCC(C)CCl Amb26981336 [0,2,0,0,0,0|1,0,1]=4 7917 B9R0.46 CCOCCCC(C)CN Amb27838971 [0,2,0,0,0,0|1,0,1]=4 7918 B9R0.46 CCOCCCC(O)CO Amb27813119 [0,2,0,0,0,0|0,0,2]=4 7919 B9R0.46 CCOCCC[C@H](N)CO Amb27175345 [0,2,0,0,0,0|0,0,2]=4 7920 B9R0.46 CCOCCC\C(N)=N\O Amb6262054 [0,2,0,0,0,0|1,0,1]=4 7921 B9R0.46 CCOCCNC(=O)CBr Amb17325304 [0,2,0,0,0,0|2,0,0]=4 7922 B9R0.46 CCOCCNC(=O)CCl Amb9454593 [0,2,0,0,0,0|2,0,0]=4 7923 B9R0.46 CCOCCNC(=O)NN Amb9455041 [0,2,0,0,0,0|2,0,0]=4 7924 B9R0.46 CCOCCOC(=O)CCl Amb18602724 [0,2,0,0,0,0|2,0,0]=4 7925 B9R0.46 CCOCCOC(=O)CO Amb28139347 [0,2,0,0,0,0|2,0,0]=4 7926 B9R0.46 CCOCCOC(=O)NC Amb28050097 [0,2,0,0,0,0|2,0,0]=4 7927 B9R0.46 CCOCCOC(C)C=O Amb27599434 [0,2,0,0,0,0|1,0,0]=3 7928 B9R0.46 CCOCSCC(=O)NC Amb27261229 [0,2,0,0,0,0|2,0,0]=4 7929 B9R0.46 CCS(=O)CCCCC#N Amb28318160 [0,2,0,0,0,0|1,0,1]=4 7930 B9R0.46 CCSCCCC(Br)CC Amb27652366 [0,2,0,0,0,0|1,0,1]=4 7931 B9R0.46 CCSCCCC(C)CBr Amb24509145 [0,2,0,0,0,0|1,0,1]=4 7932 B9R0.46 CCSCCCC(C)CCl Amb26362369 [0,2,0,0,0,0|1,0,1]=4 7933 B9R0.46 CCSCCCC(C)CO Amb27967129 [0,2,0,0,0,0|0,0,2]=4 7934 B9R0.46 CCSCCCC(C)NC Amb27979610 [0,2,0,0,0,0|2,0,0]=4 7935 B9R0.46 CCSCCCC(Cl)CC Amb28044995 [0,2,0,0,0,0|1,0,1]=4 7936 B9R0.46 CCSCCCC(N)CO Amb27779485 [0,2,0,0,0,0|0,0,2]=4 7937 B9R0.46 CCSCCCC(O)CN Amb28401101 [0,2,0,0,0,0|1,0,1]=4 7938 B9R0.46 CCSCCNC(=O)CBr Amb17323884 [0,2,0,0,0,0|2,0,0]=4 7939 B9R0.46 CCSCCNC(=O)CCl Amb17331758 [0,2,0,0,0,0|2,0,0]=4 7940 B9R0.46 CCSCCNC(=O)CN Amb27457077 [0,2,0,0,0,0|2,0,0]=4 7941 B9R0.46 CCSCCNC(=O)CS Amb27945387 [0,2,0,0,0,0|2,0,0]=4 7942 B9R0.46 CCSCCNC(=O)NN Amb27770546 [0,2,0,0,0,0|2,0,0]=4 7943 B9R0.46 CCSCCOC(=O)CCl Amb27656954 [0,2,0,0,0,0|2,0,0]=4 7944 B9R0.46 CCSCCOC(=O)CO Amb28078370 [0,2,0,0,0,0|2,0,0]=4 7945 B9R0.46 CC[C@@H](C)CCCCC=O Amb28247098 [0,2,0,0,0,0|0,0,0]=2 7946 B9R0.46 CC[C@@H](N)CNCCCF Amb27828441 [0,2,0,0,0,0|1,0,1]=4 7947 B9R0.46 CC[C@@H](O)CNCCCF Amb27212129 [0,2,0,0,0,0|1,0,1]=4 7948 B9R0.46 CC[C@@H](O)CNCCCN Amb27823263 [0,2,0,0,0,0|1,0,1]=4 7949 B9R0.46 CC[C@@H](O)CNCCCO Amb27256818 [0,2,0,0,0,0|0,0,2]=4 7950 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|0,0,2]=4 7951 B9R0.46 CC[C@H](C)CCCN=[N+]=[N-] Amb27804043 [0,2,0,0,0,0|2,0,0]=4 7952 B9R0.46 CC[C@H](C)CC\C=C\CO Amb27410556 [0,2,0,0,0,0|0,0,2]=4 7953 B9R0.46 CC[C@H](N)CNCCCF Amb27259964 [0,2,0,0,0,0|1,0,1]=4 7954 B9R0.46 CC[C@H](N)CNCCOC Amb27259962 [0,2,0,0,0,0|2,0,0]=4 7955 B9R0.46 CC[C@H](O)CCCCCF Amb27651955 [0,2,0,0,0,0|1,0,1]=4 7956 B9R0.46 CC[C@H](O)CSCCOC Amb27433227 [0,2,0,0,0,0|2,0,0]=4 7957 B9R0.46 CC\C=C/CCC(=O)CC Amb27192561 [0,2,0,0,0,0|0,0,2]=4 7958 B9R0.46 CC\C=C/CCC(C)C=O Amb27797306 [0,2,0,0,0,0|0,0,1]=3 7959 B9R0.46 CC\C=C/CCC(N)CC Amb27429546 [0,2,0,0,0,0|1,0,1]=4 7960 B9R0.46 CC\C=C/CC[C@@H](Cl)C=O Amb27268394 [0,2,0,0,0,0|0,0,1]=3 7961 B9R0.46 CC\C=C\CCC(=O)CC Amb28198289 [0,2,0,0,0,0|0,0,2]=4 7962 B9R0.46 CC\C=C\CCC(=O)NC Amb28133852 [0,2,0,0,0,0|0,0,2]=4 7963 B9R0.46 CC\C=C\CCC(=O)OC Amb25350136 [0,2,0,0,0,0|0,0,2]=4 7964 B9R0.46 CNC(=O)CCCCC=O Amb25339730 [0,2,0,0,0,0|0,0,1]=3 7965 B9R0.46 CNC(=O)CCCCCCl Amb27473380 [0,2,0,0,0,0|1,0,0]=3 7966 B9R0.46 CNC(=O)CCCCCO Amb27592471 [0,2,0,0,0,0|1,0,0]=3 7967 B9R0.46 CNC(=O)CCCNC=O Amb27959411 [0,2,0,0,0,0|1,0,1]=4 7968 B9R0.46 CNC(=O)CCCNOC Amb27838996 [0,2,0,0,0,0|2,0,0]=4 7969 B9R0.46 CNC(=O)CCOCCN Amb28249892 [0,2,0,0,0,0|2,0,0]=4 7970 B9R0.46 CNC(=O)CCSCCBr Amb27430701 [0,2,0,0,0,0|2,0,0]=4 7971 B9R0.46 CNC(=O)CCSCCS Amb27787141 [0,2,0,0,0,0|2,0,0]=4 7972 B9R0.46 CNC(=O)CNCCCF Amb27654911 [0,2,0,0,0,0|2,0,0]=4 7973 B9R0.46 CNC(=O)CNCCSC Amb27843263 [0,2,0,0,0,0|2,0,0]=4 7974 B9R0.46 CNC(=O)CSCCC=O Amb27602014 [0,2,0,0,0,0|1,0,1]=4 7975 B9R0.46 CNC(=O)CSCCCCl Amb27981112 [0,2,0,0,0,0|2,0,0]=4 7976 B9R0.46 CNC(=O)CSCCCF Amb27426687 [0,2,0,0,0,0|2,0,0]=4 7977 B9R0.46 CNC(=O)CSCCCN Amb17500712 [0,2,0,0,0,0|2,0,0]=4 7978 B9R0.46 CNC(=O)NCCCOC Amb2132785 [0,2,0,0,0,0|2,0,0]=4 7979 B9R0.46 CNC(=O)OCCCCCl Amb28073988 [0,2,0,0,0,0|2,0,0]=4 7980 B9R0.46 CNCCCCC(=O)OC Amb25725637 [0,2,0,0,0,0|1,0,0]=3 7981 B9R0.46 CNCCCCC(=O)OC Amb32676714 [0,2,0,0,0,0|1,0,0]=3 7982 B9R0.46 CNCCCCN(C)C=O Amb27813564 [0,2,0,0,0,0|1,0,0]=3 7983 B9R0.46 CNCCCC\C(N)=N\O Amb27442257 [0,2,0,0,0,0|1,0,1]=4 7984 B9R0.46 CNCCCNC(=O)CCl Amb27953669 [0,2,0,0,0,0|2,0,0]=4 7985 B9R0.46 CNCCOCC(=O)NC Amb19374954 [0,2,0,0,0,0|2,0,0]=4 7986 B9R0.46 CNCCOCC(=O)NC Amb27814093 [0,2,0,0,0,0|2,0,0]=4 7987 B9R0.46 CNCCOCC(=O)OC Amb27481250 [0,2,0,0,0,0|2,0,0]=4 7988 B9R0.46 CNCCSCC(=O)NC Amb28126889 [0,2,0,0,0,0|2,0,0]=4 7989 B9R0.46 CNCCSCC(=O)OC Amb18798231 [0,2,0,0,0,0|2,0,0]=4 7990 B9R0.46 COC(=O)CCCCC=O Amb16233585 [0,2,0,0,0,0|0,0,1]=3 7991 B9R0.46 COC(=O)CCCCCBr Amb4017062 [0,2,0,0,0,0|1,0,0]=3 7992 B9R0.46 COC(=O)CCCCCCl Amb25703167 [0,2,0,0,0,0|1,0,0]=3 7993 B9R0.46 COC(=O)CCCCCN Amb1152885 [0,2,0,0,0,0|1,0,0]=3 7994 B9R0.46 COC(=O)CCCCCN Amb1935045 [0,2,0,0,0,0|1,0,0]=3 7995 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,2,0,0,0,0|1,0,0]=3 7996 B9R0.46 COC(=O)CCCCCS Amb25934957 [0,2,0,0,0,0|1,0,0]=3 7997 B9R0.46 COC(=O)CCCNC=O Amb27615072 [0,2,0,0,0,0|1,0,1]=4 7998 B9R0.46 COC(=O)CCCSSC Amb32992714 [0,2,0,0,0,0|2,0,0]=4 7999 B9R0.46 COC(=O)CCNCCO Amb9243303 [0,2,0,0,0,0|2,0,0]=4 8000 B9R0.46 COC(=O)CCOCCN Amb26516683 [0,2,0,0,0,0|2,0,0]=4 8001 B9R0.46 COC(=O)CCOCCN Amb33330774 [0,2,0,0,0,0|2,0,0]=4 8002 B9R0.46 COC(=O)CCOCCO Amb33986072 [0,2,0,0,0,0|2,0,0]=4 8003 B9R0.46 COC(=O)CCSCCBr Amb26983185 [0,2,0,0,0,0|2,0,0]=4 8004 B9R0.46 COC(=O)CCSCCN Amb20623046 [0,2,0,0,0,0|2,0,0]=4 8005 B9R0.46 COC(=O)CCSCCN Amb20668423 [0,2,0,0,0,0|2,0,0]=4 8006 B9R0.46 COC(=O)CCSCCN Amb9482009 [0,2,0,0,0,0|2,0,0]=4 8007 B9R0.46 COC(=O)CNCCCO Amb9247002 [0,2,0,0,0,0|2,0,0]=4 8008 B9R0.46 COC(=O)CNCCSC Amb27244506 [0,2,0,0,0,0|2,0,0]=4 8009 B9R0.46 COC(=O)COCCCN Amb27597156 [0,2,0,0,0,0|2,0,0]=4 8010 B9R0.46 COC(=O)COCCSC Amb28256796 [0,2,0,0,0,0|2,0,0]=4 8011 B9R0.46 COC(=O)CSCCCCl Amb22524768 [0,2,0,0,0,0|2,0,0]=4 8012 B9R0.46 COC(=O)NCCCCBr Amb27817636 [0,2,0,0,0,0|2,0,0]=4 8013 B9R0.46 COC(=O)NCCCCN Amb27259183 [0,2,0,0,0,0|2,0,0]=4 8014 B9R0.46 COC(=O)NCCCCO Amb27251899 [0,2,0,0,0,0|2,0,0]=4 8015 B9R0.46 COC(=O)NCCCSC Amb28050553 [0,2,0,0,0,0|2,0,0]=4 8016 B9R0.46 COCCCCC(=O)CO Amb28254576 [0,2,0,0,0,0|1,0,0]=3 8017 B9R0.46 COCCCCC(C)CBr Amb27254567 [0,2,0,0,0,0|1,0,1]=4 8018 B9R0.46 COCCCCC(C)CCl Amb28248640 [0,2,0,0,0,0|1,0,1]=4 8019 B9R0.46 COCCCCC(O)CCl Amb27478160 [0,2,0,0,0,0|1,0,1]=4 8020 B9R0.46 COCCCCN(C)C=O Amb27459150 [0,2,0,0,0,0|1,0,0]=3 8021 B9R0.46 COCCCNC(=O)CBr Amb17323752 [0,2,0,0,0,0|2,0,0]=4 8022 B9R0.46 COCCCNC(=O)CCl Amb1150989 [0,2,0,0,0,0|2,0,0]=4 8023 B9R0.46 COCCCNC(=O)CI Amb27839141 [0,2,0,0,0,0|2,0,0]=4 8024 B9R0.46 COCCCNC(=O)CN Amb5783035 [0,2,0,0,0,0|2,0,0]=4 8025 B9R0.46 COCCCNC(=O)CO Amb9421653 [0,2,0,0,0,0|2,0,0]=4 8026 B9R0.46 COCCCNC(=O)CS Amb27203369 [0,2,0,0,0,0|2,0,0]=4 8027 B9R0.46 COCCCNC(=O)NN Amb33552025 [0,2,0,0,0,0|2,0,0]=4 8028 B9R0.46 COCCCOC(=O)CN Amb27848859 [0,2,0,0,0,0|2,0,0]=4 8029 B9R0.46 COCCCOC(=O)CO Amb27207808 [0,2,0,0,0,0|2,0,0]=4 8030 B9R0.46 COCCCOC(=O)CS Amb27648593 [0,2,0,0,0,0|2,0,0]=4 8031 B9R0.46 COCCC\C=C(/C)C=O Amb28320361 [0,2,0,0,0,0|0,0,2]=4 8032 B9R0.46 COCCNCC(=O)OC Amb6707178 [0,2,0,0,0,0|2,0,0]=4 8033 B9R0.46 COCCOCC(=O)NN Amb30666693 [0,2,0,0,0,0|2,0,0]=4 8034 B9R0.46 COCCOCC(=O)NN Amb8998710 [0,2,0,0,0,0|2,0,0]=4 8035 B9R0.46 COCCOCC(=O)OC Amb9206379 [0,2,0,0,0,0|2,0,0]=4 8036 B9R0.46 COCCSCC(=O)NN Amb8999118 [0,2,0,0,0,0|2,0,0]=4 8037 B9R0.46 COCCSCC(=O)OC Amb9238654 [0,2,0,0,0,0|2,0,0]=4 8038 B9R0.46 CONCCCC(=O)OC Amb27250548 [0,2,0,0,0,0|2,0,0]=4 8039 B9R0.46 CSC(=O)NCCCCO Amb27614137 [0,2,0,0,0,0|2,0,0]=4 8040 B9R0.46 CSCCCCC(=O)NN Amb28366127 [0,2,0,0,0,0|1,0,0]=3 8041 B9R0.46 CSCCCCC(C)CBr Amb27833849 [0,2,0,0,0,0|1,0,1]=4 8042 B9R0.46 CSCCCCC(C)CN Amb27857677 [0,2,0,0,0,0|1,0,1]=4 8043 B9R0.46 CSCCCNC(=O)CBr Amb28323524 [0,2,0,0,0,0|2,0,0]=4 8044 B9R0.46 CSCCCNC(=O)CCl Amb27843262 [0,2,0,0,0,0|2,0,0]=4 8045 B9R0.46 CSCCCOC(=O)CO Amb28285323 [0,2,0,0,0,0|2,0,0]=4 8046 B9R0.46 CSCCSCC(=O)NN Amb27402153 [0,2,0,0,0,0|2,0,0]=4 8047 B9R0.46 C[C@@H](CBr)CCCCC=O Amb27223928 [0,2,0,0,0,0|0,0,0]=2 8048 B9R0.46 C\C(C#N)=C\CCCC=O Amb27838121 [0,2,0,0,0,0|0,0,2]=4 8049 B9R0.46 C\C=C(/Br)CNCCCC Amb27236836 [0,2,0,0,0,0|1,0,1]=4 8050 B9R0.46 C\C=C\CCCC(=O)CC Amb26388423 [0,2,0,0,0,0|0,0,2]=4 8051 B9R0.46 C\C=C\CCCC(C)C=O Amb18643631 [0,2,0,0,0,0|0,0,1]=3 8052 B9R0.46 C\C=C\CCCC(O)CC Amb27969085 [0,2,0,0,0,0|1,0,0]=3 8053 B9R0.46 C\C=C\CNCC(C)CC Amb25723355 [0,2,0,0,0,0|1,0,1]=4 8054 B9R0.46 N#CC(O)CCCCCBr Amb27875174 [0,2,0,0,0,0|1,0,1]=4 8055 B9R0.46 N#CC(O)CCCCCO Amb27752315 [0,2,0,0,0,0|1,0,1]=4 8056 B9R0.46 N#CCCCCC(=O)CCl Amb25960754 [0,2,0,0,0,0|1,0,1]=4 8057 B9R0.46 N#C[C@H](O)CCCCCBr Amb27195572 [0,2,0,0,0,0|1,0,1]=4 8058 B9R0.46 NCC(=O)OCCCCO Amb27657505 [0,2,0,0,0,0|2,0,0]=4 8059 B9R0.46 NCCCCCC(=O)NO Amb32432421 [0,2,0,0,0,0|1,0,0]=3 8060 B9R0.46 NCCCCCC(N)CN Amb27210080 [0,2,0,0,0,0|1,0,1]=4 8061 B9R0.46 NCCCCC\C(N)=N\O Amb28199763 [0,2,0,0,0,0|1,0,1]=4 8062 B9R0.46 NCCCCNC(=O)CBr Amb26357219 [0,2,0,0,0,0|2,0,0]=4 8063 B9R0.46 NCCCCNC(=O)CBr Amb32670653 [0,2,0,0,0,0|2,0,0]=4 8064 B9R0.46 NCCCCNC(=O)CCl Amb18177807 [0,2,0,0,0,0|2,0,0]=4 8065 B9R0.46 NCCCCNC(=O)CCl Amb32681202 [0,2,0,0,0,0|2,0,0]=4 8066 B9R0.46 NCCCSCC(=O)NN Amb27408147 [0,2,0,0,0,0|2,0,0]=4 8067 B9R0.46 NCCOCCC(=O)NN Amb27164396 [0,2,0,0,0,0|2,0,0]=4 8068 B9R0.46 NCCOCCC(=O)NO Amb27970345 [0,2,0,0,0,0|2,0,0]=4 8069 B9R0.46 NC[C@H](O)CCCCCBr Amb27640190 [0,2,0,0,0,0|1,0,1]=4 8070 B9R0.46 NNC(=O)CCCCCO Amb6371427 [0,2,0,0,0,0|1,0,0]=3 8071 B9R0.46 NNC(=O)CCNCCS Amb28323608 [0,2,0,0,0,0|2,0,0]=4 8072 B9R0.46 NNC(=O)NCCCCF Amb27398770 [0,2,0,0,0,0|2,0,0]=4 8073 B9R0.46 NNC(=O)SCCCCS Amb28343270 [0,2,0,0,0,0|2,0,0]=4 8074 B9R0.46 N\C(CCCCCF)=N/O Amb27834441 [0,2,0,0,0,0|1,0,1]=4 8075 B9R0.46 O=C(CBr)NCCCCO Amb27839557 [0,2,0,0,0,0|2,0,0]=4 8076 B9R0.46 O=C(CBr)OCCCCBr Amb24598197 [0,2,0,0,0,0|2,0,0]=4 8077 B9R0.46 O=C(CBr)OCCCCO Amb28208349 [0,2,0,0,0,0|2,0,0]=4 8078 B9R0.46 O=C(CCl)CCCCCO Amb27799874 [0,2,0,0,0,0|1,0,0]=3 8079 B9R0.46 O=C(CF)CCCCCF Amb27869046 [0,2,0,0,0,0|1,0,0]=3 8080 B9R0.46 O=CCCCOC(=O)CBr Amb27841814 [0,2,0,0,0,0|1,0,1]=4 8081 B9R0.46 O=CCCCOC(=O)CCl Amb28072931 [0,2,0,0,0,0|1,0,1]=4 8082 B9R0.46 O=NC(=O)CCNCCO Amb27393447 [0,2,0,0,0,0|2,0,0]=4 8083 B9R0.46 OCC(O)CCCCCBr Amb27252942 [0,2,0,0,0,0|0,0,2]=4 8084 B9R0.46 OCCCCCC(Cl)CCl Amb28244982 [0,2,0,0,0,0|0,0,2]=4 8085 B9R0.46 OCCCCCC(O)CO Amb22731576 [0,2,0,0,0,0|0,0,2]=4 8086 B9R0.46 [C-]#[N+]C(C)CCCCCC Amb2688921 [0,2,0,0,0,0|1,0,1]=4 8087 B9R0.46 [C-]#[N+]CCCCC(=O)OC Amb2688987 [0,2,0,0,0,0|1,0,1]=4 8088 B9R0.1 C#CC(C)CCCC(=O)O Amb27273525 [0,2,0,0,0,0|0,0,2]=4 8089 B9R0.1 C#CC(C)CCCC(C)=O Amb26936323 [0,2,0,0,0,0|0,0,2]=4 8090 B9R0.1 C#CC(O)CCCC(C)O Amb27396939 [0,2,0,0,0,0|1,0,1]=4 8091 B9R0.1 C=C(Br)CNC[C@@H](O)CC Amb27770561 [0,2,0,0,0,0|2,0,0]=4 8092 B9R0.1 C=C(Br)CSCC(C)CC Amb27457594 [0,2,0,0,0,0|2,0,0]=4 8093 B9R0.1 C=C(C)CCCC(C)CCl Amb27761160 [0,2,0,0,0,0|2,0,0]=4 8094 B9R0.1 C=C(C)CCCC(C)CO Amb25888306 [0,2,0,0,0,0|2,0,0]=4 8095 B9R0.1 C=C(C)CCC[C@H](C)C=O Amb27230540 [0,2,0,0,0,0|0,0,1]=3 8096 B9R0.1 C=C(C)CCC[C@H](C)CO Amb28369841 [0,2,0,0,0,0|2,0,0]=4 8097 B9R0.1 C=C(C)CNCC(O)CC Amb27857305 [0,2,0,0,0,0|2,0,0]=4 8098 B9R0.1 C=C(C)COCC(N)CC Amb18111719 [0,2,0,0,0,0|2,0,0]=4 8099 B9R0.1 C=C(C)CSCC(F)CC Amb28126249 [0,2,0,0,0,0|2,0,0]=4 8100 B9R0.1 C=C(C)CSCC(N)CC Amb27210754 [0,2,0,0,0,0|2,0,0]=4 8101 B9R0.1 C=C(C=O)CCCC(C)=O Amb8392635 [0,2,0,0,0,0|0,0,2]=4 8102 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,2,0,0,0,0|1,0,1]=4 8103 B9R0.1 C=C(Cl)CNC[C@@H](O)CC Amb28323805 [0,2,0,0,0,0|2,0,0]=4 8104 B9R0.1 C=C(Cl)CSCC(F)CC Amb28126887 [0,2,0,0,0,0|2,0,0]=4 8105 B9R0.1 C=C(Cl)CSCC(N)CC Amb27221513 [0,2,0,0,0,0|2,0,0]=4 8106 B9R0.1 C=CC(C)CCCC(C)=O Amb27596967 [0,2,0,0,0,0|0,0,2]=4 8107 B9R0.1 C=CC(C)CCCC(C)C Amb22229110 [0,2,0,0,0,0|1,0,0]=3 8108 B9R0.1 C=CC(C)CCCC(C)O Amb27164172 [0,2,0,0,0,0|1,0,0]=3 8109 B9R0.1 C=CC(C)CNCC(C)C Amb27843194 [0,2,0,0,0,0|2,0,0]=4 8110 B9R0.1 C=CC(C)NCCC(C)C Amb27650914 [0,2,0,0,0,0|2,0,0]=4 8111 B9R0.1 C=CC(N)CSCC(C)C Amb27781423 [0,2,0,0,0,0|2,0,0]=4 8112 B9R0.1 C=CC(O)CCCC(=C)C Amb28069719 [0,2,0,0,0,0|1,0,1]=4 8113 B9R0.1 C=CC(O)CCCC(C)C Amb27785702 [0,2,0,0,0,0|1,0,0]=3 8114 B9R0.1 C=CC(O)CNCC(C)O Amb28363878 [0,2,0,0,0,0|2,0,0]=4 8115 B9R0.1 C=C[C@@H](C)CCCC(C)=O Amb24379305 [0,2,0,0,0,0|0,0,2]=4 8116 B9R0.1 CC(=O)CCCC(C)C#N Amb18124539 [0,2,0,0,0,0|1,0,1]=4 8117 B9R0.1 CC(=O)CCC[C@@H](C)CO Amb26391997 [0,2,0,0,0,0|1,0,0]=3 8118 B9R0.1 CC(=O)CCC[C@@H](Cl)C=O Amb28396498 [0,2,0,0,0,0|0,0,1]=3 8119 B9R0.1 CC(=O)CCNC(C)CO Amb32675833 [0,2,0,0,0,0|2,0,0]=4 8120 B9R0.1 CC(=O)CSCC(O)CO Amb28049681 [0,2,0,0,0,0|2,0,0]=4 8121 B9R0.1 CC(=O)NCCC(C)CO Amb28203991 [0,2,0,0,0,0|2,0,0]=4 8122 B9R0.1 CC(=O)NCCC(N)CN Amb27838083 [0,2,0,0,0,0|2,0,0]=4 8123 B9R0.1 CC(=O)NCCC(O)CO Amb32645132 [0,2,0,0,0,0|2,0,0]=4 8124 B9R0.1 CC(=O)NCC[C@@H](N)CN Amb28073891 [0,2,0,0,0,0|2,0,0]=4 8125 B9R0.1 CC(=O)OCCC(C)C=O Amb28387659 [0,2,0,0,0,0|1,0,1]=4 8126 B9R0.1 CC(=O)OCCC(C)CBr Amb27866079 [0,2,0,0,0,0|2,0,0]=4 8127 B9R0.1 CC(=O)OCCC(Cl)C=O Amb28050881 [0,2,0,0,0,0|1,0,1]=4 8128 B9R0.1 CC(=O)OCCC(O)CO Amb27171870 [0,2,0,0,0,0|2,0,0]=4 8129 B9R0.1 CC(=O)OCC[C@H](O)CO Amb27588999 [0,2,0,0,0,0|2,0,0]=4 8130 B9R0.1 CC(C#N)CCCC(=O)O Amb18643710 [0,2,0,0,0,0|1,0,1]=4 8131 B9R0.1 CC(C)=CCCC(C)C=O Amb3940426 [0,2,0,0,0,0|0,0,2]=4 8132 B9R0.1 CC(C)=CCC[C@H](C)C=O Amb27876463 [0,2,0,0,0,0|0,0,2]=4 8133 B9R0.1 CC(C)CCCC(C)CBr Amb27485270 [0,2,0,0,0,0|1,0,1]=4 8134 B9R0.1 CC(C)CCCC(C)CCl Amb25056436 [0,2,0,0,0,0|1,0,1]=4 8135 B9R0.1 CC(C)CCCC(C)CN Amb18644042 [0,2,0,0,0,0|1,0,1]=4 8136 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,2,0,0,0,0|0,0,2]=4 8137 B9R0.1 CC(C)CCCC(C)NN Amb27799223 [0,2,0,0,0,0|2,0,0]=4 8138 B9R0.1 CC(C)CCCC(F)CN Amb27489384 [0,2,0,0,0,0|1,0,1]=4 8139 B9R0.1 CC(C)CCCC(N)CO Amb27233021 [0,2,0,0,0,0|0,0,2]=4 8140 B9R0.1 CC(C)CCC[C@@H](C)CBr Amb28424339 [0,2,0,0,0,0|1,0,1]=4 8141 B9R0.1 CC(C)CCC[C@@H](C)CCl Amb28054799 [0,2,0,0,0,0|1,0,1]=4 8142 B9R0.1 CC(C)CCC[C@@H](C)CN Amb25147597 [0,2,0,0,0,0|1,0,1]=4 8143 B9R0.1 CC(C)CCC[C@@H](C)CO Amb26336716 [0,2,0,0,0,0|0,0,2]=4 8144 B9R0.1 CC(C)CCC[C@H](C)CN Amb28132685 [0,2,0,0,0,0|1,0,1]=4 8145 B9R0.1 CC(C)CCC[C@H](C)CO Amb33730882 [0,2,0,0,0,0|0,0,2]=4 8146 B9R0.1 CC(C)CCOC(=O)C=O Amb27762562 [0,2,0,0,0,0|1,0,1]=4 8147 B9R0.1 CC(C)C\C=C\[C@@H](C)C=O Amb27458412 [0,2,0,0,0,0|0,0,2]=4 8148 B9R0.1 CC(C)OCCN(C)C=O Amb28315774 [0,2,0,0,0,0|2,0,0]=4 8149 B9R0.1 CC(C=O)CCCC(=O)O Amb27173621 [0,2,0,0,0,0|1,0,1]=4 8150 B9R0.1 CC(C=O)CCCS(C)=O Amb28142475 [0,2,0,0,0,0|1,0,0]=3 8151 B9R0.1 CC(C=O)CCOC(C)C Amb27833048 [0,2,0,0,0,0|1,0,0]=3 8152 B9R0.1 CC(CBr)CCCS(C)=O Amb27879970 [0,2,0,0,0,0|2,0,0]=4 8153 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,2,0,0,0,0|1,0,0]=3 8154 B9R0.1 CC(CN)CCCS(C)=O Amb27815622 [0,2,0,0,0,0|2,0,0]=4 8155 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,2,0,0,0,0|2,0,0]=4 8156 B9R0.1 CC(CN)OCCC(=O)O Amb18629690 [0,2,0,0,0,0|2,0,0]=4 8157 B9R0.1 CC(CN)SCCC(=O)O Amb27425055 [0,2,0,0,0,0|2,0,0]=4 8158 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,2,0,0,0,0|2,0,0]=4 8159 B9R0.1 CC(CO)CNCC(N)=O Amb27463837 [0,2,0,0,0,0|2,0,0]=4 8160 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,2,0,0,0,0|2,0,0]=4 8161 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,2,0,0,0,0|2,0,0]=4 8162 B9R0.1 CC(CO)CSCC(N)=O Amb27649504 [0,2,0,0,0,0|2,0,0]=4 8163 B9R0.1 CC(N)CCCC(C)CN Amb28424147 [0,2,0,0,0,0|1,0,1]=4 8164 B9R0.1 CC(N)CCCC(C)CO Amb27226928 [0,2,0,0,0,0|0,0,2]=4 8165 B9R0.1 CCC(=N)NCCC(N)=O Amb27181001 [0,2,0,0,0,0|1,0,1]=4 8166 B9R0.1 CCC(=O)CCC[N+](=O)[O-] Amb27636062 [0,2,0,0,0,0|1,0,1]=4 8167 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,2,0,0,0,0|1,0,1]=4 8168 B9R0.1 CCC(=O)NCCC(C)=O Amb17102869 [0,2,0,0,0,0|1,0,1]=4 8169 B9R0.1 CCC(=O)NCCC(N)=O Amb17231982 [0,2,0,0,0,0|1,0,1]=4 8170 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,2,0,0,0,0|1,0,1]=4 8171 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,2,0,0,0,0|1,0,1]=4 8172 B9R0.1 CCC(Br)CCCS(C)=O Amb27653510 [0,2,0,0,0,0|1,0,0]=3 8173 B9R0.1 CCC(C)CC#CC(=O)O Amb24661749 [0,2,0,0,0,0|0,0,2]=4 8174 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [0,2,0,0,0,0|1,0,1]=4 8175 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,2,0,0,0,0|0,0,0]=2 8176 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,2,0,0,0,0|0,0,0]=2 8177 B9R0.1 CCC(C)CCCC(C)Br Amb28313037 [0,2,0,0,0,0|1,0,1]=4 8178 B9R0.1 CCC(C)CCCC(C)C Amb4036389 [0,2,0,0,0,0|1,0,1]=4 8179 B9R0.1 CCC(C)CCCC(C)N Amb26516233 [0,2,0,0,0,0|1,0,1]=4 8180 B9R0.1 CCC(C)CCC[C@@H](C)N Amb33731287 [0,2,0,0,0,0|1,0,1]=4 8181 B9R0.1 CCC(C)CCC[C@H](C)N Amb33729331 [0,2,0,0,0,0|1,0,1]=4 8182 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [0,2,0,0,0,0|1,0,0]=3 8183 B9R0.1 CCC(C)CNCC(N)=O Amb6718890 [0,2,0,0,0,0|1,0,0]=3 8184 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,2,0,0,0,0|1,0,0]=3 8185 B9R0.1 CCC(C)CONC(N)=O Amb27448732 [0,2,0,0,0,0|2,0,0]=4 8186 B9R0.1 CCC(C)CSCC(C)=O Amb27590937 [0,2,0,0,0,0|1,0,0]=3 8187 B9R0.1 CCC(C)NCCC(C)=O Amb28321451 [0,2,0,0,0,0|1,0,0]=3 8188 B9R0.1 CCC(C)NCCC(N)=O Amb19960042 [0,2,0,0,0,0|1,0,0]=3 8189 B9R0.1 CCC(C)NCCC(N)=O Amb8841100 [0,2,0,0,0,0|1,0,0]=3 8190 B9R0.1 CCC(C)NOCC(N)=O Amb28383310 [0,2,0,0,0,0|2,0,0]=4 8191 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [0,2,0,0,0,0|1,0,0]=3 8192 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,2,0,0,0,0|1,0,0]=3 8193 B9R0.1 CCC(C)OCCC(N)=O Amb27412703 [0,2,0,0,0,0|1,0,0]=3 8194 B9R0.1 CCC(C)OCCC(N)=S Amb18180036 [0,2,0,0,0,0|1,1,0]=4 8195 B9R0.1 CCC(Cl)CCCC(Cl)Cl Amb28042880 [0,2,0,0,0,0|1,0,1]=4 8196 B9R0.1 CCC(Cl)CCOC(C)=O Amb27984879 [0,2,0,0,0,0|1,0,0]=3 8197 B9R0.1 CCC(F)CSCC(C)=O Amb27804706 [0,2,0,0,0,0|1,0,0]=3 8198 B9R0.1 CCC(N)CCCN(C)C Amb18202383 [0,2,0,0,0,0|2,0,0]=4 8199 B9R0.1 CCC(N)CCNC(N)=O Amb27842050 [0,2,0,0,0,0|1,0,0]=3 8200 B9R0.1 CCC(O)CC#CC(=O)O Amb27461426 [0,2,0,0,0,0|0,0,2]=4 8201 B9R0.1 CCC(O)CCCB(O)O Amb26967521 [0,2,0,0,0,0|1,0,1]=4 8202 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [0,2,0,0,0,0|0,0,0]=2 8203 B9R0.1 CCC(O)CCNC(N)=O Amb27262212 [0,2,0,0,0,0|1,0,0]=3 8204 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [0,2,0,0,0,0|1,0,0]=3 8205 B9R0.1 CCN(C)CCCC(C)=O Amb9659156 [0,2,0,0,0,0|1,0,0]=3 8206 B9R0.1 CCN(O)CCCC(=O)O Amb27630754 [0,2,0,0,0,0|1,0,0]=3 8207 B9R0.1 CCS(=O)CCNC(C)=O Amb27616407 [0,2,0,0,0,0|2,0,0]=4 8208 B9R0.1 CCS(=O)CCNC(N)=O Amb27806812 [0,2,0,0,0,0|2,0,0]=4 8209 B9R0.1 CC[C@@H](O)CCC=C(C)C Amb27472423 [0,2,0,0,0,0|1,0,1]=4 8210 B9R0.1 CC[C@@H](O)CCCC(C)=O Amb27227255 [0,2,0,0,0,0|0,0,0]=2 8211 B9R0.1 CC[C@@H](O)CNCC(N)=O Amb27226499 [0,2,0,0,0,0|1,0,0]=3 8212 B9R0.1 CC[C@@H](O)CSCC(N)=O Amb28202586 [0,2,0,0,0,0|1,0,0]=3 8213 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,2,0,0,0,0|0,0,0]=2 8214 B9R0.1 CC[C@H](C)C\C=C/C(=O)O Amb27779551 [0,2,0,0,0,0|0,0,2]=4 8215 B9R0.1 CC[C@H](O)CCC=C(C)C Amb28050675 [0,2,0,0,0,0|1,0,1]=4 8216 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,2,0,0,0,0|0,0,2]=4 8217 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [0,2,0,0,0,0|0,0,2]=4 8218 B9R0.1 CNC(=O)CCCC(=O)[O-] Amb24271120 [0,2,0,0,0,0|1,0,1]=4 8219 B9R0.1 CNC(C)CCCC(C)C Amb25683551 [0,2,0,0,0,0|2,0,0]=4 8220 B9R0.1 CNC(C)CCNC(N)=O Amb28067069 [0,2,0,0,0,0|2,0,0]=4 8221 B9R0.1 COC(=O)CCCC(=O)Cl Amb3939328 [0,2,0,0,0,0|1,0,1]=4 8222 B9R0.1 COC(=O)CCCC(=O)O Amb2720900 [0,2,0,0,0,0|1,0,1]=4 8223 B9R0.1 COC(=O)CCCC(=O)[O-] Amb33948529 [0,2,0,0,0,0|1,0,1]=4 8224 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,2,0,0,0,0|1,0,1]=4 8225 B9R0.1 COC(=O)CCCC(N)=O Amb27882411 [0,2,0,0,0,0|1,0,1]=4 8226 B9R0.1 COC(C)CCCC(C)O Amb27833630 [0,2,0,0,0,0|2,0,0]=4 8227 B9R0.1 COC(C)CCNC(C)=O Amb27260083 [0,2,0,0,0,0|2,0,0]=4 8228 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,2,0,0,0,0|2,0,0]=4 8229 B9R0.1 COC(C)OCCC(C)=O Amb27267196 [0,2,0,0,0,0|2,0,0]=4 8230 B9R0.1 CON(C)CCCC(=O)O Amb28126925 [0,2,0,0,0,0|2,0,0]=4 8231 B9R0.1 CSC(C)CCNC(C)=O Amb27964419 [0,2,0,0,0,0|2,0,0]=4 8232 B9R0.1 CSC(C)CCOC(=O)Cl Amb28199680 [0,2,0,0,0,0|2,0,0]=4 8233 B9R0.1 C[C@@H](CF)NCCC(N)=O Amb28315929 [0,2,0,0,0,0|2,0,0]=4 8234 B9R0.1 C\C(C=O)=C/CCC(C)O Amb27598642 [0,2,0,0,0,0|0,0,2]=4 8235 B9R0.1 C\C(C=O)=C\CCC(C)O Amb27841297 [0,2,0,0,0,0|0,0,2]=4 8236 B9R0.1 C\C=C(\C)CCCC(C)O Amb28050786 [0,2,0,0,0,0|1,0,1]=4 8237 B9R0.1 NC(=O)CCC[C@H](N)CS Amb28251296 [0,2,0,0,0,0|1,0,0]=3 8238 B9R0.1 NC(=O)CNCC(O)CF Amb27859350 [0,2,0,0,0,0|2,0,0]=4 8239 B9R0.1 NC(=O)CSCC(O)CF Amb27249405 [0,2,0,0,0,0|2,0,0]=4 8240 B9R0.1 NC(=O)CSCC(O)CO Amb27593990 [0,2,0,0,0,0|2,0,0]=4 8241 B9R0.1 NC(CO)CCCC(=O)O Amb25889148 [0,2,0,0,0,0|1,0,0]=3 8242 B9R0.1 NCC(=O)CCCC(=O)O Amb22035333 [0,2,0,0,0,0|1,0,1]=4 8243 B9R0.1 NC[C@@H](N)CCCC(=O)O Amb33756779 [0,2,0,0,0,0|1,0,0]=3 8244 B9R0.1 N[C@H](CO)CCCC(=O)O Amb27751891 [0,2,0,0,0,0|1,0,0]=3 8245 B9R0.1 O=C(O)CCCC(=O)CO Amb27493969 [0,2,0,0,0,0|1,0,1]=4 8246 B9R0.1 O=C(O)CCCC(Cl)CCl Amb18649051 [0,2,0,0,0,0|1,0,0]=3 8247 B9R0.1 O=C(O)CSCC(O)CCl Amb27858669 [0,2,0,0,0,0|2,0,0]=4 8248 B9R0.1 [C-]#[N+]C(C)CCCC(C)C Amb19944628 [0,2,0,0,0,0|2,0,0]=4 8249 B9R0.20 C#CC(C)(O)CCCCC Amb2721696 [0,2,0,0,0,0|1,0,1]=4 8250 B9R0.20 C#CC(F)(F)CCCC=O Amb28049852 [0,2,0,0,0,0|0,0,2]=4 8251 B9R0.20 C#CCCCC(C)(C)C=O Amb27402048 [0,2,0,0,0,0|0,0,2]=4 8252 B9R0.20 C#CCCCC(C)(O)C=O Amb28204648 [0,2,0,0,0,0|0,0,2]=4 8253 B9R0.20 C=CC(C)(O)CCCCC Amb28049696 [0,2,0,0,0,0|1,0,0]=3 8254 B9R0.20 C=CC(C)(O)CCCCO Amb27839262 [0,2,0,0,0,0|2,0,0]=4 8255 B9R0.20 C=CCCCC(C)(C)CBr Amb32690405 [0,2,0,0,0,0|2,0,0]=4 8256 B9R0.20 C=CCCCC(C)(C)CCl Amb32690403 [0,2,0,0,0,0|2,0,0]=4 8257 B9R0.20 C=CCCCC(C)(C)CO Amb26071654 [0,2,0,0,0,0|2,0,0]=4 8258 B9R0.20 C=CCCCC(C)(Cl)CO Amb27197208 [0,2,0,0,0,0|2,0,0]=4 8259 B9R0.20 C=CCCCC(C)(O)CCl Amb27645228 [0,2,0,0,0,0|2,0,0]=4 8260 B9R0.20 C=CCCCC(F)(F)CO Amb28345271 [0,2,0,0,0,0|2,0,0]=4 8261 B9R0.20 C=CCCNC(C)(C)CC Amb27255575 [0,2,0,0,0,0|2,0,0]=4 8262 B9R0.20 C=CCNCC(C)(O)CC Amb27663702 [0,2,0,0,0,0|2,0,0]=4 8263 B9R0.20 CC#CCCC(C)(C)C=O Amb27455387 [0,2,0,0,0,0|0,0,2]=4 8264 B9R0.20 CC(C)(C#N)CCCC=O Amb27229992 [0,2,0,0,0,0|1,0,1]=4 8265 B9R0.20 CC(C)(C=O)CCCC#N Amb18643429 [0,2,0,0,0,0|1,0,1]=4 8266 B9R0.20 CC(C)(C=O)CCCCO Amb27650761 [0,2,0,0,0,0|1,0,0]=3 8267 B9R0.20 CC(C)(C=O)COCCCl Amb27596632 [0,2,0,0,0,0|2,0,0]=4 8268 B9R0.20 CC(C)(C=O)OCCCO Amb27659424 [0,2,0,0,0,0|2,0,0]=4 8269 B9R0.20 CC(C)(CO)CCCC=O Amb33197660 [0,2,0,0,0,0|1,0,0]=3 8270 B9R0.20 CC(C)(CO)SCCC=O Amb27412843 [0,2,0,0,0,0|2,0,0]=4 8271 B9R0.20 CCC#CCC(C)(C)C=O Amb27234010 [0,2,0,0,0,0|0,0,2]=4 8272 B9R0.20 CCC(C)(C)CCCC=O Amb33266955 [0,2,0,0,0,0|0,0,0]=2 8273 B9R0.20 CCC(C)(C)CCCCBr Amb32690602 [0,2,0,0,0,0|1,0,1]=4 8274 B9R0.20 CCC(C)(C)CCCCCl Amb32690601 [0,2,0,0,0,0|1,0,1]=4 8275 B9R0.20 CCC(C)(C)CCCCN Amb28191397 [0,2,0,0,0,0|1,0,1]=4 8276 B9R0.20 CCC(C)(C)CCN=C=O Amb32874365 [0,2,0,0,0,0|1,0,1]=4 8277 B9R0.20 CCC(C)(C)OCCC=O Amb27240477 [0,2,0,0,0,0|1,0,0]=3 8278 B9R0.20 CCC(C)(O)CCCC=O Amb27837952 [0,2,0,0,0,0|0,0,0]=2 8279 B9R0.20 CCC(C)(O)CCCOC Amb28043689 [0,2,0,0,0,0|2,0,0]=4 8280 B9R0.20 CCCCCC(C)(C)C#N Amb27494226 [0,2,0,0,0,0|1,0,1]=4 8281 B9R0.20 CCCCCC(C)(C)CBr Amb26353944 [0,2,0,0,0,0|1,0,1]=4 8282 B9R0.20 CCCCCC(C)(C)CC Amb22052710 [0,2,0,0,0,0|1,0,1]=4 8283 B9R0.20 CCCCCC(C)(C)CCl Amb25804367 [0,2,0,0,0,0|1,0,1]=4 8284 B9R0.20 CCCCCC(C)(C)CN Amb20632202 [0,2,0,0,0,0|1,0,1]=4 8285 B9R0.20 CCCCCC(C)(C)CO Amb26369679 [0,2,0,0,0,0|0,0,2]=4 8286 B9R0.20 CCCCCC(C)(C)NC Amb26958534 [0,2,0,0,0,0|2,0,0]=4 8287 B9R0.20 CCCCCC(C)(Cl)CC Amb22229257 [0,2,0,0,0,0|1,0,1]=4 8288 B9R0.20 CCCCCC(C)(N)CC Amb27799493 [0,2,0,0,0,0|1,0,1]=4 8289 B9R0.20 CCCCCC(C)(N)CO Amb28049699 [0,2,0,0,0,0|0,0,2]=4 8290 B9R0.20 CCCCCC(C)(O)C#N Amb28049694 [0,2,0,0,0,0|1,0,1]=4 8291 B9R0.20 CCCCCC(C)(O)CC Amb4017959 [0,2,0,0,0,0|1,0,1]=4 8292 B9R0.20 CCCCCC(C)(O)CCl Amb25084549 [0,2,0,0,0,0|1,0,1]=4 8293 B9R0.20 CCCCCC(Cl)(Cl)C=O Amb27838067 [0,2,0,0,0,0|0,0,0]=2 8294 B9R0.20 CCCCC[C@@](C)(O)C#N Amb26967574 [0,2,0,0,0,0|1,0,1]=4 8295 B9R0.20 CCCCOC(C)(C)C=O Amb27490093 [0,2,0,0,0,0|1,0,0]=3 8296 B9R0.20 CCCOCC(C)(O)C=O Amb27432311 [0,2,0,0,0,0|1,0,0]=3 8297 B9R0.20 CCC\C=C\C(C)(C)C=O Amb33327150 [0,2,0,0,0,0|0,0,2]=4 8298 B9R0.20 CCOCCC(C)(C)C=O Amb28048808 [0,2,0,0,0,0|1,0,0]=3 8299 B9R0.20 CCS(=O)(=O)CCCC=O Amb28141925 [0,2,0,0,0,0|1,0,0]=3 8300 B9R0.20 CC\C=C\CC(Cl)(Cl)C=O Amb27268557 [0,2,0,0,0,0|0,0,2]=4 8301 B9R0.20 COC(C)(C)CCCC=O Amb26450164 [0,2,0,0,0,0|1,0,0]=3 8302 B9R0.20 COCCCC(F)(F)C=O Amb27637877 [0,2,0,0,0,0|1,0,0]=3 8303 B9R0.20 O=CC(Cl)(Cl)CCCCCl Amb27881492 [0,2,0,0,0,0|1,0,0]=3 8304 B9R0.20 O=CC(Cl)(Cl)COCCCl Amb27759457 [0,2,0,0,0,0|2,0,0]=4 8305 B9R0.24 C=CC(=O)CCC(C)CC Amb27227030 [0,2,0,0,0,0|1,0,1]=4 8306 B9R0.24 C=CC(C)CCC(=O)CC Amb28141338 [0,2,0,0,0,0|1,0,1]=4 8307 B9R0.24 C=CC(C)SCC(N)CC Amb28205621 [0,2,0,0,0,0|2,0,0]=4 8308 B9R0.24 C=CC(N)CCC(C)OC Amb27435498 [0,2,0,0,0,0|2,0,0]=4 8309 B9R0.24 C=CC(N)CCC(N)CF Amb27167624 [0,2,0,0,0,0|2,0,0]=4 8310 B9R0.24 C=CC(O)CCC(C)OC Amb27167483 [0,2,0,0,0,0|2,0,0]=4 8311 B9R0.24 C=CC(O)CSC(C)CC Amb27228170 [0,2,0,0,0,0|2,0,0]=4 8312 B9R0.24 CCC(=O)CCC(C)C=O Amb27424839 [0,2,0,0,0,0|0,0,1]=3 8313 B9R0.24 CCC(C)CCC(C)CCl Amb27838951 [0,2,0,0,0,0|1,0,1]=4 8314 B9R0.24 CCC(C)CCC(C)CN Amb27838972 [0,2,0,0,0,0|1,0,1]=4 8315 B9R0.24 CCC(C)CCC(N)CC Amb27436682 [0,2,0,0,0,0|1,0,1]=4 8316 B9R0.24 CCC(C)CCC(O)CCl Amb27770538 [0,2,0,0,0,0|1,0,1]=4 8317 B9R0.24 CCC(C)C\C=C(\C)C=O Amb27493317 [0,2,0,0,0,0|0,0,2]=4 8318 B9R0.24 CCC(N)CCC(N)CC Amb28388809 [0,2,0,0,0,0|1,0,1]=4 8319 B9R0.24 CCC(O)CCC(O)CC Amb27218701 [0,2,0,0,0,0|1,0,1]=4 8320 B9R0.24 CC[C@@H](O)CC[C@H](O)CC Amb8516406 [0,2,0,0,0,0|1,0,1]=4 8321 B9R0.24 CC[C@H](O)CC[C@@H](O)CC Amb8516407 [0,2,0,0,0,0|1,0,1]=4 8322 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,2,0,0,0,0|1,0,1]=4 8323 B9R0.24 COC(=O)CCC(Cl)C=O Amb27760397 [0,2,0,0,0,0|1,0,1]=4 8324 B9R0.47 C#CCCCC(C)C(C)=O Amb25965398 [0,2,0,0,0,0|0,0,2]=4 8325 B9R0.47 C#CCCCC(C)C(C)O Amb26619041 [0,2,0,0,0,0|1,0,1]=4 8326 B9R0.47 C#CCCCC(Cl)C(C)C Amb27260631 [0,2,0,0,0,0|1,0,1]=4 8327 B9R0.47 C#CCCCC(N)C(=O)O Amb27947457 [0,2,0,0,0,0|0,0,2]=4 8328 B9R0.47 C#CCCCC(N)C(=O)O Amb33483976 [0,2,0,0,0,0|0,0,2]=4 8329 B9R0.47 C#CCCCC(N)C(N)=O Amb26967363 [0,2,0,0,0,0|0,0,2]=4 8330 B9R0.47 C#CCCCC(O)C(C)C Amb27238405 [0,2,0,0,0,0|1,0,1]=4 8331 B9R0.47 C#CCCCC(O)C(C)O Amb27979746 [0,2,0,0,0,0|1,0,1]=4 8332 B9R0.47 C#CCCC[C@@H](N)C(=O)O Amb24077358 [0,2,0,0,0,0|0,0,2]=4 8333 B9R0.47 C#CCCC[C@H](N)C(=O)O Amb24088878 [0,2,0,0,0,0|0,0,2]=4 8334 B9R0.47 C=C(C)C(C)OCCCC Amb27595789 [0,2,0,0,0,0|2,0,0]=4 8335 B9R0.47 C=C(C)C(N)CCCOC Amb28455830 [0,2,0,0,0,0|2,0,0]=4 8336 B9R0.47 C=C(C)C(O)CCCCO Amb27765710 [0,2,0,0,0,0|2,0,0]=4 8337 B9R0.47 C=C(C)C(O)CCCSC Amb27978956 [0,2,0,0,0,0|2,0,0]=4 8338 B9R0.47 C=C(C)[C@@H](O)CCCCC Amb28065257 [0,2,0,0,0,0|1,0,0]=3 8339 B9R0.47 C=C(CCCNC)C(=O)O Amb28050053 [0,2,0,0,0,0|1,0,1]=4 8340 B9R0.47 C=C(Cl)C(C)CCCCO Amb27260219 [0,2,0,0,0,0|2,0,0]=4 8341 B9R0.47 C=CCCCC(C)C(C)=O Amb27839019 [0,2,0,0,0,0|0,0,2]=4 8342 B9R0.47 C=CCCCC(C)C(C)N Amb28049689 [0,2,0,0,0,0|1,0,0]=3 8343 B9R0.47 C=CCCCC(C)C(C)O Amb26863625 [0,2,0,0,0,0|1,0,0]=3 8344 B9R0.47 C=CCCCC(Cl)C(=C)C Amb27478034 [0,2,0,0,0,0|1,0,1]=4 8345 B9R0.47 C=CCCCC(N)C(=O)O Amb22002149 [0,2,0,0,0,0|0,0,2]=4 8346 B9R0.47 C=CCCCC(N)C(=O)O Amb32752542 [0,2,0,0,0,0|0,0,2]=4 8347 B9R0.47 C=CCCCC(N)C(C)C Amb27413121 [0,2,0,0,0,0|1,0,0]=3 8348 B9R0.47 C=CCCCC(N)C(N)=O Amb25988690 [0,2,0,0,0,0|0,0,2]=4 8349 B9R0.47 C=CCCCC(O)C(C)O Amb27839544 [0,2,0,0,0,0|1,0,0]=3 8350 B9R0.47 C=CCCCC(O)C(F)F Amb27168745 [0,2,0,0,0,0|2,0,0]=4 8351 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb22831130 [0,2,0,0,0,0|0,0,2]=4 8352 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb32687472 [0,2,0,0,0,0|0,0,2]=4 8353 B9R0.47 C=CCCC[C@@H](O)C(C)=O Amb27453672 [0,2,0,0,0,0|0,0,2]=4 8354 B9R0.47 C=CCCC[C@H](N)C(=O)O Amb2699129 [0,2,0,0,0,0|0,0,2]=4 8355 B9R0.47 C=CCCNC(C)C(C)C Amb27839003 [0,2,0,0,0,0|2,0,0]=4 8356 B9R0.47 C=CCCNC(C)C(C)N Amb27754582 [0,2,0,0,0,0|2,0,0]=4 8357 B9R0.47 C=CCCSC(C)C(C)C Amb27661539 [0,2,0,0,0,0|2,0,0]=4 8358 B9R0.47 C=CCNCC(C)C(C)C Amb27838967 [0,2,0,0,0,0|2,0,0]=4 8359 B9R0.47 C=CCNCC(Cl)C(C)C Amb27223558 [0,2,0,0,0,0|2,0,0]=4 8360 B9R0.47 C=CCOC[C@@H](N)C(C)C Amb27402860 [0,2,0,0,0,0|2,0,0]=4 8361 B9R0.47 C=CCOC[C@H](N)C(C)C Amb27474127 [0,2,0,0,0,0|2,0,0]=4 8362 B9R0.47 C=CCSCC(O)C(C)C Amb27835592 [0,2,0,0,0,0|2,0,0]=4 8363 B9R0.47 CC#CCCC(C)C(=O)O Amb27412753 [0,2,0,0,0,0|0,0,2]=4 8364 B9R0.47 CC#CCCC(N)C(=O)O Amb28285646 [0,2,0,0,0,0|0,0,2]=4 8365 B9R0.47 CC#CCCC(N)C(N)=O Amb26893252 [0,2,0,0,0,0|0,0,2]=4 8366 B9R0.47 CC#CCCC(O)C(=O)O Amb27615159 [0,2,0,0,0,0|0,0,2]=4 8367 B9R0.47 CC#CCC[C@@H](N)C(=O)O Amb25835847 [0,2,0,0,0,0|0,0,2]=4 8368 B9R0.47 CC#CCC[C@H](N)C(=O)O Amb28368944 [0,2,0,0,0,0|0,0,2]=4 8369 B9R0.47 CC(=O)C(C)CCCCO Amb27787398 [0,2,0,0,0,0|1,0,0]=3 8370 B9R0.47 CC(=O)C(C)OCCCN Amb18111504 [0,2,0,0,0,0|2,0,0]=4 8371 B9R0.47 CC(=O)C(C)SCCCF Amb27424937 [0,2,0,0,0,0|2,0,0]=4 8372 B9R0.47 CC(=O)C(C)SCCCS Amb28200050 [0,2,0,0,0,0|2,0,0]=4 8373 B9R0.47 CC(=O)N(C)CCCCBr Amb27860570 [0,2,0,0,0,0|2,0,0]=4 8374 B9R0.47 CC(C)C(=O)CCCC=O Amb18643953 [0,2,0,0,0,0|0,0,1]=3 8375 B9R0.47 CC(C)C(=O)NCCC=O Amb17102168 [0,2,0,0,0,0|1,0,1]=4 8376 B9R0.47 CC(C)C(C)OCCC=O Amb27947695 [0,2,0,0,0,0|1,0,0]=3 8377 B9R0.47 CC(C)C(C)SCCC=O Amb27662620 [0,2,0,0,0,0|1,0,0]=3 8378 B9R0.47 CC(C)C(N)CCCCF Amb27218723 [0,2,0,0,0,0|1,0,1]=4 8379 B9R0.47 CC(C)C(O)CCCCF Amb27425079 [0,2,0,0,0,0|1,0,1]=4 8380 B9R0.47 CC(C)N(C)CCCC=O Amb33273376 [0,2,0,0,0,0|1,0,0]=3 8381 B9R0.47 CC(C)N(C)CCNC=O Amb27750916 [0,2,0,0,0,0|2,0,0]=4 8382 B9R0.47 CC(CCCCBr)C(=O)O Amb27790626 [0,2,0,0,0,0|1,0,0]=3 8383 B9R0.47 CC(CCCCF)C(=O)O Amb24370978 [0,2,0,0,0,0|1,0,0]=3 8384 B9R0.47 CC(CCCCN)C(=O)O Amb31031269 [0,2,0,0,0,0|1,0,0]=3 8385 B9R0.47 CC(CCCCO)C(=O)O Amb28040862 [0,2,0,0,0,0|1,0,0]=3 8386 B9R0.47 CC(CCNC=O)S(C)=O Amb27465730 [0,2,0,0,0,0|2,0,0]=4 8387 B9R0.47 CC(CNCCCl)C(=O)O Amb27974547 [0,2,0,0,0,0|2,0,0]=4 8388 B9R0.47 CC(CNCCN)C(=O)O Amb27398545 [0,2,0,0,0,0|2,0,0]=4 8389 B9R0.47 CC(CNCCO)C(N)=O Amb9358396 [0,2,0,0,0,0|2,0,0]=4 8390 B9R0.47 CC(CSCCN)C(=O)O Amb18788221 [0,2,0,0,0,0|2,0,0]=4 8391 B9R0.47 CC(CSCCN)C(=O)O Amb28555435 [0,2,0,0,0,0|2,0,0]=4 8392 B9R0.47 CC(NCCCF)C(N)=O Amb28136243 [0,2,0,0,0,0|2,0,0]=4 8393 B9R0.47 CC(NCCCO)C(N)=O Amb9246629 [0,2,0,0,0,0|2,0,0]=4 8394 B9R0.47 CC(O)C(C)SCCC=O Amb28347874 [0,2,0,0,0,0|1,0,0]=3 8395 B9R0.47 CC(OCCCN)C(=O)O Amb18111477 [0,2,0,0,0,0|2,0,0]=4 8396 B9R0.47 CC(SCCCF)C(=O)O Amb28049559 [0,2,0,0,0,0|2,0,0]=4 8397 B9R0.47 CC(SCCCN)C(=O)O Amb17500677 [0,2,0,0,0,0|2,0,0]=4 8398 B9R0.47 CC(SCCCS)C(=O)O Amb18648366 [0,2,0,0,0,0|2,0,0]=4 8399 B9R0.47 CCCCCC(=O)C(=O)Cl Amb24647840 [0,2,0,0,0,0|0,0,1]=3 8400 B9R0.47 CCCCCC(=O)C(=O)O Amb18644122 [0,2,0,0,0,0|0,0,1]=3 8401 B9R0.47 CCCCCC(Br)C(=O)O Amb18130346 [0,2,0,0,0,0|0,0,0]=2 8402 B9R0.47 CCCCCC(Br)C(C)=O Amb26057111 [0,2,0,0,0,0|0,0,0]=2 8403 B9R0.47 CCCCCC(Br)C(C)C Amb27877198 [0,2,0,0,0,0|1,0,1]=4 8404 B9R0.47 CCCCCC(Br)C(C)F Amb27947488 [0,2,0,0,0,0|1,0,1]=4 8405 B9R0.47 CCCCCC(Br)C(C)O Amb28049966 [0,2,0,0,0,0|0,0,2]=4 8406 B9R0.47 CCCCCC(C)=C(C)C Amb22228299 [0,2,0,0,0,0|1,0,1]=4 8407 B9R0.47 CCCCCC(C)C(=O)Cl Amb25127828 [0,2,0,0,0,0|0,0,0]=2 8408 B9R0.47 CCCCCC(C)C(C)C Amb10069375 [0,2,0,0,0,0|1,0,1]=4 8409 B9R0.47 CCCCCC(C)C(C)N Amb27155602 [0,2,0,0,0,0|1,0,1]=4 8410 B9R0.47 CCCCCC(C)[C@@H](C)N Amb33738432 [0,2,0,0,0,0|1,0,1]=4 8411 B9R0.47 CCCCCC(C)[C@H](C)N Amb33745259 [0,2,0,0,0,0|1,0,1]=4 8412 B9R0.47 CCCCCC(C)[N+](=O)[O-] Amb25059956 [0,2,0,0,0,0|1,0,0]=3 8413 B9R0.47 CCCCCC(Cl)C(=O)Cl Amb27845364 [0,2,0,0,0,0|0,0,0]=2 8414 B9R0.47 CCCCCC(F)C(=O)O Amb17593693 [0,2,0,0,0,0|0,0,0]=2 8415 B9R0.47 CCCCCC(F)C(C)O Amb27769908 [0,2,0,0,0,0|0,0,2]=4 8416 B9R0.47 CCCCCC(N)C(=O)O Amb4134810 [0,2,0,0,0,0|0,0,0]=2 8417 B9R0.47 CCCCCC(N)C(F)F Amb28135618 [0,2,0,0,0,0|1,0,1]=4 8418 B9R0.47 CCCCCC(N)C(N)=O Amb25843277 [0,2,0,0,0,0|0,0,0]=2 8419 B9R0.47 CCCCCC(N)[PH](=O)O Amb28421761 [0,2,0,0,0,0|1,0,0]=3 8420 B9R0.47 CCCCCC(O)C(=O)O Amb17778103 [0,2,0,0,0,0|0,0,0]=2 8421 B9R0.47 CCCCCC(O)C(C)=O Amb27658218 [0,2,0,0,0,0|0,0,0]=2 8422 B9R0.47 CCCCCC(O)C(C)C Amb4036433 [0,2,0,0,0,0|1,0,1]=4 8423 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [0,2,0,0,0,0|0,0,2]=4 8424 B9R0.47 CCCCCC(S)C(=O)O Amb27657706 [0,2,0,0,0,0|0,0,0]=2 8425 B9R0.47 CCCCCN(C)C(=N)N Amb8925796 [0,2,0,0,0,0|2,0,0]=4 8426 B9R0.47 CCCCCN(C)C(N)=S Amb8925607 [0,2,0,0,0,0|1,1,0]=4 8427 B9R0.47 CCCCCN(N)C(=N)N Amb29471652 [0,2,0,0,0,0|2,0,0]=4 8428 B9R0.47 CCCCC[C@@H](Br)C(=O)O Amb27234856 [0,2,0,0,0,0|0,0,0]=2 8429 B9R0.47 CCCCC[C@@H](C)C(C)=O Amb28202105 [0,2,0,0,0,0|0,0,0]=2 8430 B9R0.47 CCCCC[C@@H](N)C(=O)O Amb22745982 [0,2,0,0,0,0|0,0,0]=2 8431 B9R0.47 CCCCC[C@@H](O)C(=O)O Amb28050131 [0,2,0,0,0,0|0,0,0]=2 8432 B9R0.47 CCCCC[C@@H](O)C(C)=O Amb24480618 [0,2,0,0,0,0|0,0,0]=2 8433 B9R0.47 CCCCC[C@@H](O)[C@H](C)Br Amb28049949 [0,2,0,0,0,0|1,0,1]=4 8434 B9R0.47 CCCCC[C@H](Br)C(=O)O Amb28287684 [0,2,0,0,0,0|0,0,0]=2 8435 B9R0.47 CCCCC[C@H](Br)[C@H](C)O Amb27830165 [0,2,0,0,0,0|0,0,2]=4 8436 B9R0.47 CCCCC[C@H](C)C(=O)O Amb10844510 [0,2,0,0,0,0|0,0,0]=2 8437 B9R0.47 CCCCC[C@H](F)C(=O)O Amb27784296 [0,2,0,0,0,0|0,0,0]=2 8438 B9R0.47 CCCCC[C@H](N)C(=O)O Amb17943098 [0,2,0,0,0,0|0,0,0]=2 8439 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,2,0,0,0,0|0,0,2]=4 8440 B9R0.47 CCCCC[C@H](O)C(C)C Amb28064175 [0,2,0,0,0,0|1,0,1]=4 8441 B9R0.47 CCCCC[C@H](O)[C@@H](C)N Amb27488726 [0,2,0,0,0,0|1,0,1]=4 8442 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [0,2,0,0,0,0|0,0,2]=4 8443 B9R0.47 CCCCNC(=O)C(=O)O Amb9303865 [0,2,0,0,0,0|1,0,1]=4 8444 B9R0.47 CCCCNC(=O)C(C)=O Amb17399878 [0,2,0,0,0,0|1,0,1]=4 8445 B9R0.47 CCCCNC(=O)C(N)=O Amb28050037 [0,2,0,0,0,0|1,0,1]=4 8446 B9R0.47 CCCCNC(=S)C(=O)O Amb27657804 [0,2,0,0,0,0|1,0,1]=4 8447 B9R0.47 CCCCNC(C)C(=O)O Amb9326961 [0,2,0,0,0,0|1,0,0]=3 8448 B9R0.47 CCCCNC(C)C(N)=O Amb9203273 [0,2,0,0,0,0|1,0,0]=3 8449 B9R0.47 CCCCN[C@@H](C)C(=O)O Amb27192156 [0,2,0,0,0,0|1,0,0]=3 8450 B9R0.47 CCCCN[C@H](C)C(=O)O Amb27461559 [0,2,0,0,0,0|1,0,0]=3 8451 B9R0.47 CCCCOC(=O)C(=O)O Amb26367223 [0,2,0,0,0,0|1,0,1]=4 8452 B9R0.47 CCCCOC(C)C(=N)N Amb27393859 [0,2,0,0,0,0|2,0,0]=4 8453 B9R0.47 CCCCOC(C)C(=O)O Amb8894957 [0,2,0,0,0,0|1,0,0]=3 8454 B9R0.47 CCCCOC(C)C(N)=O Amb27852771 [0,2,0,0,0,0|1,0,0]=3 8455 B9R0.47 CCCCOC(C)C(N)=S Amb18798045 [0,2,0,0,0,0|1,1,0]=4 8456 B9R0.47 CCCCOC(F)C(=O)O Amb27174586 [0,2,0,0,0,0|1,0,0]=3 8457 B9R0.47 CCCCO[C@@H](C)C(=O)O Amb27216767 [0,2,0,0,0,0|1,0,0]=3 8458 B9R0.47 CCCCSC(C)C(=O)O Amb6273551 [0,2,0,0,0,0|1,0,0]=3 8459 B9R0.47 CCCCSC(F)C(=O)O Amb27850941 [0,2,0,0,0,0|1,0,0]=3 8460 B9R0.47 CCCCSC(N)C(=O)O Amb27760526 [0,2,0,0,0,0|1,0,0]=3 8461 B9R0.47 CCCCS[C@@H](C)C(=O)O Amb27408996 [0,2,0,0,0,0|1,0,0]=3 8462 B9R0.47 CCCC\C=C(/Br)C(=O)O Amb27615132 [0,2,0,0,0,0|0,0,2]=4 8463 B9R0.47 CCCC\C=C(/Cl)C(C)=O Amb27822638 [0,2,0,0,0,0|0,0,2]=4 8464 B9R0.47 CCCC\C=C(\C)C(=O)O Amb27637394 [0,2,0,0,0,0|0,0,2]=4 8465 B9R0.47 CCCC\C=C(\F)C(=O)O Amb28197633 [0,2,0,0,0,0|0,0,2]=4 8466 B9R0.47 CCCC\C=C(\N)C(N)=O Amb27473333 [0,2,0,0,0,0|0,0,2]=4 8467 B9R0.47 CCCC\N=C(/Cl)C(C)=O Amb27861098 [0,2,0,0,0,0|1,0,1]=4 8468 B9R0.47 CCCNCC(N)C(N)=O Amb27952357 [0,2,0,0,0,0|1,0,0]=3 8469 B9R0.47 CCCNCC(O)C(N)=O Amb27875874 [0,2,0,0,0,0|1,0,0]=3 8470 B9R0.47 CCCOCC(=O)C(=O)O Amb27787004 [0,2,0,0,0,0|1,0,1]=4 8471 B9R0.47 CCCOCC(Br)C(=O)O Amb27625667 [0,2,0,0,0,0|1,0,0]=3 8472 B9R0.47 CCCOCC(N)C(=O)O Amb24621740 [0,2,0,0,0,0|1,0,0]=3 8473 B9R0.47 CCCOCC(N)C(N)=O Amb27155900 [0,2,0,0,0,0|1,0,0]=3 8474 B9R0.47 CCCOC[C@@H](N)C(=O)O Amb27480715 [0,2,0,0,0,0|1,0,0]=3 8475 B9R0.47 CCCOC[C@H](N)C(=O)O Amb27223143 [0,2,0,0,0,0|1,0,0]=3 8476 B9R0.47 CCCSCC(C)C(C)=O Amb27262876 [0,2,0,0,0,0|1,0,0]=3 8477 B9R0.47 CCCSCC(N)C(=O)O Amb6265881 [0,2,0,0,0,0|1,0,0]=3 8478 B9R0.47 CCCSCC(N)C(=O)O Amb9176295 [0,2,0,0,0,0|1,0,0]=3 8479 B9R0.47 CCCSC[C@H](N)C(=O)O Amb27471340 [0,2,0,0,0,0|1,0,0]=3 8480 B9R0.47 CCC\C=C/C(N)C(N)=O Amb28249181 [0,2,0,0,0,0|0,0,2]=4 8481 B9R0.47 CCC\C=C\C(C)C(=O)O Amb33449140 [0,2,0,0,0,0|0,0,2]=4 8482 B9R0.47 CCC\C=C\C(O)C(=O)O Amb32668856 [0,2,0,0,0,0|0,0,2]=4 8483 B9R0.47 CCC\C=C\[C@@H](N)C(=O)O Amb27230868 [0,2,0,0,0,0|0,0,2]=4 8484 B9R0.47 CCC\C=C\[C@H](O)C(C)=O Amb28139306 [0,2,0,0,0,0|0,0,2]=4 8485 B9R0.47 CCNCCC(C)C(=O)O Amb27473572 [0,2,0,0,0,0|1,0,0]=3 8486 B9R0.47 CCNCCC(C)S(C)=O Amb27408727 [0,2,0,0,0,0|2,0,0]=4 8487 B9R0.47 CCNCCC(N)C(=O)O Amb932772 [0,2,0,0,0,0|1,0,0]=3 8488 B9R0.47 CCNCC[C@@H](N)C(=O)O Amb28520031 [0,2,0,0,0,0|1,0,0]=3 8489 B9R0.47 CCOCCC(=O)C(=O)Cl Amb24649864 [0,2,0,0,0,0|1,0,1]=4 8490 B9R0.47 CCOCCC(C)C(C)=O Amb27837597 [0,2,0,0,0,0|1,0,0]=3 8491 B9R0.47 CCOCCC(N)C(=O)O Amb32671298 [0,2,0,0,0,0|1,0,0]=3 8492 B9R0.47 CCOCCC(N)C(=O)O Amb9316664 [0,2,0,0,0,0|1,0,0]=3 8493 B9R0.47 CCOCCC(N)C(C)=O Amb28055992 [0,2,0,0,0,0|1,0,0]=3 8494 B9R0.47 CCOCCC(N)C(N)=O Amb25354003 [0,2,0,0,0,0|1,0,0]=3 8495 B9R0.47 CCOCCN(C)C(=O)Cl Amb27228674 [0,2,0,0,0,0|2,0,0]=4 8496 B9R0.47 CCOCCN(C)C(N)=O Amb28137478 [0,2,0,0,0,0|2,0,0]=4 8497 B9R0.47 CCOCC[C@@H](N)C(=O)O Amb28187742 [0,2,0,0,0,0|1,0,0]=3 8498 B9R0.47 CCOCC[C@H](N)C(=O)O Amb26612670 [0,2,0,0,0,0|1,0,0]=3 8499 B9R0.47 CCOCOC(C)C(=O)O Amb27426180 [0,2,0,0,0,0|2,0,0]=4 8500 B9R0.47 CCOCO[C@H](C)C(=O)O Amb27765041 [0,2,0,0,0,0|2,0,0]=4 8501 B9R0.47 CCONCC(C)C(=O)O Amb27265783 [0,2,0,0,0,0|2,0,0]=4 8502 B9R0.47 CCONCC(C)C(N)=O Amb28244659 [0,2,0,0,0,0|2,0,0]=4 8503 B9R0.47 CCONCC(N)C(N)=O Amb28045946 [0,2,0,0,0,0|2,0,0]=4 8504 B9R0.47 CCSCCC(=O)C(=O)O Amb26652044 [0,2,0,0,0,0|1,0,1]=4 8505 B9R0.47 CCSCCC(C)C(=O)O Amb10844082 [0,2,0,0,0,0|1,0,0]=3 8506 B9R0.47 CCSCCC(Cl)C(N)=O Amb27614970 [0,2,0,0,0,0|1,0,0]=3 8507 B9R0.47 CCSCCC(N)C(=O)O Amb2137050 [0,2,0,0,0,0|1,0,0]=3 8508 B9R0.47 CCSCCC(N)C(N)=O Amb18177774 [0,2,0,0,0,0|1,0,0]=3 8509 B9R0.47 CCSCCC(O)C(=O)O Amb24482157 [0,2,0,0,0,0|1,0,0]=3 8510 B9R0.47 CCSCCC(O)C(N)=O Amb26926790 [0,2,0,0,0,0|1,0,0]=3 8511 B9R0.47 CCSCC[C@@H](N)C(=O)O Amb17613843 [0,2,0,0,0,0|1,0,0]=3 8512 B9R0.47 CCSCC[C@H](N)C(=O)O Amb17613844 [0,2,0,0,0,0|1,0,0]=3 8513 B9R0.47 CCSSCC(N)C(N)=O Amb27201565 [0,2,0,0,0,0|2,0,0]=4 8514 B9R0.47 CC\C=C\CC(C)C(=O)O Amb27838058 [0,2,0,0,0,0|0,0,2]=4 8515 B9R0.47 CC\C=C\CC(N)C(=O)O Amb25255710 [0,2,0,0,0,0|0,0,2]=4 8516 B9R0.47 CC\C=C\CC(N)C(=O)O Amb30666656 [0,2,0,0,0,0|0,0,2]=4 8517 B9R0.47 CN(C)C(=O)CCCC=O Amb26480717 [0,2,0,0,0,0|1,0,1]=4 8518 B9R0.47 CN(CCCCCl)C(=O)Cl Amb22338609 [0,2,0,0,0,0|2,0,0]=4 8519 B9R0.47 CN(CCCCO)C(N)=O Amb27452604 [0,2,0,0,0,0|2,0,0]=4 8520 B9R0.47 CNCCCC(N)C(=O)O Amb18644279 [0,2,0,0,0,0|1,0,0]=3 8521 B9R0.47 CNCCCN(C)C(N)=O Amb27446493 [0,2,0,0,0,0|2,0,0]=4 8522 B9R0.47 CNCCOC(C)C(=O)O Amb18630742 [0,2,0,0,0,0|2,0,0]=4 8523 B9R0.47 CNCCOC(C)C(C)=O Amb18111841 [0,2,0,0,0,0|2,0,0]=4 8524 B9R0.47 CNOCC[C@H](N)C(=O)O Amb27405026 [0,2,0,0,0,0|2,0,0]=4 8525 B9R0.47 COCCCC(=O)C(=O)O Amb28050154 [0,2,0,0,0,0|1,0,1]=4 8526 B9R0.47 COCCCC(Br)C(C)C Amb27432345 [0,2,0,0,0,0|2,0,0]=4 8527 B9R0.47 COCCCC(C)C(=O)O Amb26653888 [0,2,0,0,0,0|1,0,0]=3 8528 B9R0.47 COCCCC(C)C(C)=O Amb27657482 [0,2,0,0,0,0|1,0,0]=3 8529 B9R0.47 COCCCC(C)C(N)=O Amb28190149 [0,2,0,0,0,0|1,0,0]=3 8530 B9R0.47 COCCCC(N)C(=O)O Amb22058809 [0,2,0,0,0,0|1,0,0]=3 8531 B9R0.47 COCCCC(N)C(=O)O Amb33549526 [0,2,0,0,0,0|1,0,0]=3 8532 B9R0.47 COCCCC(N)C(N)=O Amb26331697 [0,2,0,0,0,0|1,0,0]=3 8533 B9R0.47 COCCCC(O)C(=O)O Amb28050541 [0,2,0,0,0,0|1,0,0]=3 8534 B9R0.47 COCCCN(C)C(=O)Cl Amb27837819 [0,2,0,0,0,0|2,0,0]=4 8535 B9R0.47 COCCC[C@@H](N)C(=O)O Amb25081508 [0,2,0,0,0,0|1,0,0]=3 8536 B9R0.47 COCCC[C@H](N)C(=O)O Amb25378737 [0,2,0,0,0,0|1,0,0]=3 8537 B9R0.47 COCCNC(C)C(=O)O Amb33069032 [0,2,0,0,0,0|2,0,0]=4 8538 B9R0.47 COCCNC(C)C(=O)O Amb9326996 [0,2,0,0,0,0|2,0,0]=4 8539 B9R0.47 COCCNC(C)C(N)=O Amb19222868 [0,2,0,0,0,0|2,0,0]=4 8540 B9R0.47 COCCNC(C)C(N)=O Amb9203267 [0,2,0,0,0,0|2,0,0]=4 8541 B9R0.47 COCCN[C@@H](C)C(=O)O Amb27164971 [0,2,0,0,0,0|2,0,0]=4 8542 B9R0.47 COCCN[C@H](C)C(=O)O Amb27454332 [0,2,0,0,0,0|2,0,0]=4 8543 B9R0.47 COCCOC(C)C(=O)O Amb9719532 [0,2,0,0,0,0|2,0,0]=4 8544 B9R0.47 COCCO[C@H](C)C(=O)O Amb27783895 [0,2,0,0,0,0|2,0,0]=4 8545 B9R0.47 COCOCC(C)C(=O)O Amb27667113 [0,2,0,0,0,0|2,0,0]=4 8546 B9R0.47 COCSCC(C)C(=O)O Amb27474867 [0,2,0,0,0,0|2,0,0]=4 8547 B9R0.47 CONCC[C@H](N)C(=O)O Amb27623933 [0,2,0,0,0,0|2,0,0]=4 8548 B9R0.47 CSCCCC(=O)C(=O)O Amb27490899 [0,2,0,0,0,0|1,0,1]=4 8549 B9R0.47 CSCCCC(Br)C(C)C Amb27833845 [0,2,0,0,0,0|2,0,0]=4 8550 B9R0.47 CSCCCC(C)C(=O)O Amb25888073 [0,2,0,0,0,0|1,0,0]=3 8551 B9R0.47 CSCCCC(C)C(C)=O Amb27841950 [0,2,0,0,0,0|1,0,0]=3 8552 B9R0.47 CSCCCC(Cl)C(N)=O Amb27588927 [0,2,0,0,0,0|1,0,0]=3 8553 B9R0.47 CSCCCC(N)C(=O)O Amb17594057 [0,2,0,0,0,0|1,0,0]=3 8554 B9R0.47 CSCCCC(N)C(=O)O Amb35789017 [0,2,0,0,0,0|1,0,0]=3 8555 B9R0.47 CSCCCC(N)C(C)C Amb27494428 [0,2,0,0,0,0|2,0,0]=4 8556 B9R0.47 CSCCCC(N)C(N)=O Amb27770389 [0,2,0,0,0,0|1,0,0]=3 8557 B9R0.47 CSCCCC(O)C(=O)O Amb25169340 [0,2,0,0,0,0|1,0,0]=3 8558 B9R0.47 CSCCCC(O)C(N)=O Amb27197765 [0,2,0,0,0,0|1,0,0]=3 8559 B9R0.47 CSCCC[C@@H](N)C(=O)O Amb27233529 [0,2,0,0,0,0|1,0,0]=3 8560 B9R0.47 CSCCC[C@H](N)C(=O)O Amb27858783 [0,2,0,0,0,0|1,0,0]=3 8561 B9R0.47 CSCCNC(C)C(N)=O Amb27400757 [0,2,0,0,0,0|2,0,0]=4 8562 B9R0.47 CSCCOC(C)C(=O)O Amb24482366 [0,2,0,0,0,0|2,0,0]=4 8563 B9R0.47 CSCCO[C@H](C)C(=O)O Amb27865202 [0,2,0,0,0,0|2,0,0]=4 8564 B9R0.47 CSCCSC(C)C(=O)O Amb28291750 [0,2,0,0,0,0|2,0,0]=4 8565 B9R0.47 CSCSC[C@H](N)C(=O)O Amb26874540 [0,2,0,0,0,0|2,0,0]=4 8566 B9R0.47 CSSCCC(N)C(=O)O Amb28456103 [0,2,0,0,0,0|2,0,0]=4 8567 B9R0.47 C[C@@H](CCCCBr)C(=O)O Amb27794794 [0,2,0,0,0,0|1,0,0]=3 8568 B9R0.47 C[C@@H](NCCCN)C(=O)O Amb25710680 [0,2,0,0,0,0|2,0,0]=4 8569 B9R0.47 C[C@@H](OCCCN)C(=O)O Amb27465122 [0,2,0,0,0,0|2,0,0]=4 8570 B9R0.47 C[C@H](NCCCO)C(=O)O Amb27454333 [0,2,0,0,0,0|2,0,0]=4 8571 B9R0.47 C\C=C\CCC(C)C(=O)O Amb27461427 [0,2,0,0,0,0|0,0,2]=4 8572 B9R0.47 C\C=C\CCC(N)C(=O)O Amb27770583 [0,2,0,0,0,0|0,0,2]=4 8573 B9R0.47 N#CCCCC(Cl)C(=O)Cl Amb28396535 [0,2,0,0,0,0|1,0,1]=4 8574 B9R0.47 N#CCCCC(Cl)C(=O)O Amb17594023 [0,2,0,0,0,0|1,0,1]=4 8575 B9R0.47 N#CCCCC(N)C(=O)O Amb25242567 [0,2,0,0,0,0|1,0,1]=4 8576 B9R0.47 N#CCCCC(N)C(N)=O Amb33308858 [0,2,0,0,0,0|1,0,1]=4 8577 B9R0.47 N#CCCC[C@@H](N)C(=O)O Amb28349132 [0,2,0,0,0,0|1,0,1]=4 8578 B9R0.47 N#CCCC[C@H](N)C(=O)O Amb26043277 [0,2,0,0,0,0|1,0,1]=4 8579 B9R0.47 NC(=O)C(N)CCCCBr Amb28313246 [0,2,0,0,0,0|1,0,0]=3 8580 B9R0.47 NC(=O)C(N)CCCCF Amb27977425 [0,2,0,0,0,0|1,0,0]=3 8581 B9R0.47 NC(=O)C(N)CCCCO Amb33065912 [0,2,0,0,0,0|1,0,0]=3 8582 B9R0.47 NC(=O)C(O)CNCCF Amb28320057 [0,2,0,0,0,0|2,0,0]=4 8583 B9R0.47 NC(CCCCF)C(=O)O Amb28193271 [0,2,0,0,0,0|1,0,0]=3 8584 B9R0.47 NC(CCCCO)C(=O)O Amb2699159 [0,2,0,0,0,0|1,0,0]=3 8585 B9R0.47 NC(COCCCl)C(=O)O Amb18126477 [0,2,0,0,0,0|2,0,0]=4 8586 B9R0.47 NC(CSCCO)C(=O)O Amb6262852 [0,2,0,0,0,0|2,0,0]=4 8587 B9R0.47 NC(CSCCS)C(=O)O Amb27837996 [0,2,0,0,0,0|2,0,0]=4 8588 B9R0.47 NCCCCC(=O)C(=O)O Amb33756866 [0,2,0,0,0,0|1,0,1]=4 8589 B9R0.47 NCCCCC(N)C(=O)O Amb22349470 [0,2,0,0,0,0|1,0,0]=3 8590 B9R0.47 NCCCCC(N)C(=O)O Amb22489521 [0,2,0,0,0,0|1,0,0]=3 8591 B9R0.47 NCCCCC(N)C(=O)O Amb3940540 [0,2,0,0,0,0|1,0,0]=3 8592 B9R0.47 NCCCCC(N)C(=O)O Amb8516470 [0,2,0,0,0,0|1,0,0]=3 8593 B9R0.47 NCCCCC(N)C(=O)O Amb8516682 [0,2,0,0,0,0|1,0,0]=3 8594 B9R0.47 NCCCCC(N)C(N)=O Amb17593646 [0,2,0,0,0,0|1,0,0]=3 8595 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb22750565 [0,2,0,0,0,0|1,0,0]=3 8596 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb2720180 [0,2,0,0,0,0|1,0,0]=3 8597 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb30621835 [0,2,0,0,0,0|1,0,0]=3 8598 B9R0.47 NCCCC[C@@H](N)C(=O)O Amb3940874 [0,2,0,0,0,0|1,0,0]=3 8599 B9R0.47 NCCCC[C@@H](N)C(N)=O Amb27404620 [0,2,0,0,0,0|1,0,0]=3 8600 B9R0.47 NCCCC[C@H](N)C(=O)O Amb2720055 [0,2,0,0,0,0|1,0,0]=3 8601 B9R0.47 NCCCC[C@H](N)C(=O)O Amb3940762 [0,2,0,0,0,0|1,0,0]=3 8602 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8395455 [0,2,0,0,0,0|1,0,0]=3 8603 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8513720 [0,2,0,0,0,0|1,0,0]=3 8604 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628529 [0,2,0,0,0,0|1,0,0]=3 8605 B9R0.47 NCCCC[C@H](N)C(=O)O Amb8628598 [0,2,0,0,0,0|1,0,0]=3 8606 B9R0.47 NCCCC[C@H](N)C(N)=O Amb33757921 [0,2,0,0,0,0|1,0,0]=3 8607 B9R0.47 NCCCOC(N)C(=O)O Amb27838076 [0,2,0,0,0,0|2,0,0]=4 8608 B9R0.47 NCCCS[C@H](N)C(=O)O Amb27410557 [0,2,0,0,0,0|2,0,0]=4 8609 B9R0.47 NCCOCC(N)C(=O)O Amb27224745 [0,2,0,0,0,0|2,0,0]=4 8610 B9R0.47 NCCOC[C@H](N)C(=O)O Amb26844671 [0,2,0,0,0,0|2,0,0]=4 8611 B9R0.47 NCCSCC(O)C(=O)O Amb27789579 [0,2,0,0,0,0|2,0,0]=4 8612 B9R0.47 NCCSC[C@@H](N)C(=O)O Amb27945627 [0,2,0,0,0,0|2,0,0]=4 8613 B9R0.47 NCCSC[C@H](N)C(=O)O Amb22362775 [0,2,0,0,0,0|2,0,0]=4 8614 B9R0.47 NCCSC[C@H](N)C(=O)O Amb25887551 [0,2,0,0,0,0|2,0,0]=4 8615 B9R0.47 NCSCCC(N)C(=O)O Amb27468506 [0,2,0,0,0,0|2,0,0]=4 8616 B9R0.47 NCSCC[C@H](N)C(=O)O Amb27425090 [0,2,0,0,0,0|2,0,0]=4 8617 B9R0.47 NOCCCC(N)C(=O)O Amb24117962 [0,2,0,0,0,0|2,0,0]=4 8618 B9R0.47 NOCCCC(N)C(=O)O Amb27222313 [0,2,0,0,0,0|2,0,0]=4 8619 B9R0.47 NOCCC[C@H](N)C(=O)O Amb28397870 [0,2,0,0,0,0|2,0,0]=4 8620 B9R0.47 N[C@@H](CCCC=O)C(=O)O Amb2695588 [0,2,0,0,0,0|1,0,1]=4 8621 B9R0.47 N[C@@H](CCCCBr)C(=O)O Amb28208462 [0,2,0,0,0,0|1,0,0]=3 8622 B9R0.47 N[C@@H](CCCCCl)C(=O)O Amb27267870 [0,2,0,0,0,0|1,0,0]=3 8623 B9R0.47 N[C@@H](CCCCF)C(=O)O Amb27945388 [0,2,0,0,0,0|1,0,0]=3 8624 B9R0.47 N[C@@H](CCCCO)C(=O)O Amb2695139 [0,2,0,0,0,0|1,0,0]=3 8625 B9R0.47 N[C@@H](CCCCS)C(=O)O Amb25729289 [0,2,0,0,0,0|1,0,0]=3 8626 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb29083430 [0,2,0,0,0,0|2,0,0]=4 8627 B9R0.47 N[C@@H](CCCNO)C(=O)O Amb30666629 [0,2,0,0,0,0|2,0,0]=4 8628 B9R0.47 N[C@@H](CNCCO)C(=O)O Amb25146307 [0,2,0,0,0,0|2,0,0]=4 8629 B9R0.47 N[C@@H](COCCCl)C(=O)O Amb28134274 [0,2,0,0,0,0|2,0,0]=4 8630 B9R0.47 N[C@@H](CSCCCl)C(=O)O Amb25887675 [0,2,0,0,0,0|2,0,0]=4 8631 B9R0.47 N[C@@H](CSCCF)C(=O)O Amb27837852 [0,2,0,0,0,0|2,0,0]=4 8632 B9R0.47 N[C@@H](CSCCO)C(=O)O Amb2695551 [0,2,0,0,0,0|2,0,0]=4 8633 B9R0.47 N[C@H](CCCC=O)C(=O)O Amb27272621 [0,2,0,0,0,0|1,0,1]=4 8634 B9R0.47 N[C@H](CCCCF)C(=O)O Amb26370180 [0,2,0,0,0,0|1,0,0]=3 8635 B9R0.47 N[C@H](CCCCO)C(=O)O Amb26969244 [0,2,0,0,0,0|1,0,0]=3 8636 B9R0.47 N[C@H](CSCCO)C(=O)O Amb8629048 [0,2,0,0,0,0|2,0,0]=4 8637 B9R0.47 O=C(O)C(=O)CCCCBr Amb27654991 [0,2,0,0,0,0|1,0,1]=4 8638 B9R0.47 O=C(O)C(=O)CCCCO Amb27626027 [0,2,0,0,0,0|1,0,1]=4 8639 B9R0.47 O=C(O)C(Cl)CSCCCl Amb27949681 [0,2,0,0,0,0|2,0,0]=4 8640 B9R0.47 O=C(O)C(O)CCCCO Amb18644356 [0,2,0,0,0,0|1,0,0]=3 8641 B9R0.47 O=C(O)C(O)CNCCO Amb27456529 [0,2,0,0,0,0|2,0,0]=4 8642 B9R0.50 C#CC(CCCCC)NC Amb27440108 [0,2,0,0,0,0|1,0,1]=4 8643 B9R0.50 C#CC(CCCCC)NN Amb27222992 [0,2,0,0,0,0|1,0,1]=4 8644 B9R0.50 C#CCCCC(CC)NC Amb27245708 [0,2,0,0,0,0|1,0,1]=4 8645 B9R0.50 C=C=C(C=O)CCCCC Amb27268873 [0,2,0,0,0,0|0,0,1]=3 8646 B9R0.50 C=CC(C=C)CCCCO Amb27481061 [0,2,0,0,0,0|2,0,0]=4 8647 B9R0.50 C=CC(CBr)CCOCC Amb27440911 [0,2,0,0,0,0|2,0,0]=4 8648 B9R0.50 C=CC(CCCCC)NC Amb27652218 [0,2,0,0,0,0|1,0,0]=3 8649 B9R0.50 C=CC(CCCCC)NN Amb27952275 [0,2,0,0,0,0|1,0,0]=3 8650 B9R0.50 C=CC(CCOCC)NN Amb28047070 [0,2,0,0,0,0|2,0,0]=4 8651 B9R0.50 C=CC(CNCCC)OC Amb27949680 [0,2,0,0,0,0|2,0,0]=4 8652 B9R0.50 C=CC(CO)CCCCC Amb27977343 [0,2,0,0,0,0|1,0,0]=3 8653 B9R0.50 C=CC(CO)CCCCO Amb27664638 [0,2,0,0,0,0|2,0,0]=4 8654 B9R0.50 C=CC(COCCC)NN Amb28364533 [0,2,0,0,0,0|2,0,0]=4 8655 B9R0.50 C=CCCCC(C#N)CO Amb28401049 [0,2,0,0,0,0|2,0,0]=4 8656 B9R0.50 C=CCCCC(C=C)CO Amb27615184 [0,2,0,0,0,0|2,0,0]=4 8657 B9R0.50 C=CCCCC(CC)CBr Amb32690351 [0,2,0,0,0,0|1,0,0]=3 8658 B9R0.50 C=CCCCC(CC)CCl Amb32690354 [0,2,0,0,0,0|1,0,0]=3 8659 B9R0.50 C=CCCCN(CC)CC Amb27619103 [0,2,0,0,0,0|2,0,0]=4 8660 B9R0.50 C=CCCC[C@@H](C=O)OC Amb28049854 [0,2,0,0,0,0|0,0,2]=4 8661 B9R0.50 C=CCCC[C@@H](CO)OC Amb27448855 [0,2,0,0,0,0|2,0,0]=4 8662 B9R0.50 C=CCCNC(CC)CO Amb28126722 [0,2,0,0,0,0|2,0,0]=4 8663 B9R0.50 C=CCCN[C@H](CC)CN Amb27476581 [0,2,0,0,0,0|2,0,0]=4 8664 B9R0.50 C=CCCSC(CC)CC Amb27812821 [0,2,0,0,0,0|2,0,0]=4 8665 B9R0.50 C=CCNCC(CC)CC Amb6683816 [0,2,0,0,0,0|2,0,0]=4 8666 B9R0.50 C=CCOCC(CC)CBr Amb24524562 [0,2,0,0,0,0|2,0,0]=4 8667 B9R0.50 C=CCOCC(CC)CCl Amb32689852 [0,2,0,0,0,0|2,0,0]=4 8668 B9R0.50 C=CCOCC(CC)CS Amb27488013 [0,2,0,0,0,0|2,0,0]=4 8669 B9R0.50 C=CCSCC(CC)NC Amb27766989 [0,2,0,0,0,0|2,0,0]=4 8670 B9R0.50 CC#CCC[C@H](C=O)CC Amb27619210 [0,2,0,0,0,0|0,0,2]=4 8671 B9R0.50 CCC(=CCCC=O)CC Amb28123663 [0,2,0,0,0,0|0,0,2]=4 8672 B9R0.50 CCC(C=O)CCCC=O Amb27262880 [0,2,0,0,0,0|0,0,0]=2 8673 B9R0.50 CCC(CBr)CCCOC Amb27424787 [0,2,0,0,0,0|2,0,0]=4 8674 B9R0.50 CCC(CBr)CCCSC Amb24373300 [0,2,0,0,0,0|2,0,0]=4 8675 B9R0.50 CCC(CC)CCCC=O Amb26063318 [0,2,0,0,0,0|0,0,0]=2 8676 B9R0.50 CCC(CC)CCCCBr Amb27460595 [0,2,0,0,0,0|1,0,1]=4 8677 B9R0.50 CCC(CC)CCCCCl Amb27823192 [0,2,0,0,0,0|1,0,1]=4 8678 B9R0.50 CCC(CC)CCCCN Amb24373288 [0,2,0,0,0,0|1,0,1]=4 8679 B9R0.50 CCC(CC)CCCCO Amb26581149 [0,2,0,0,0,0|0,0,2]=4 8680 B9R0.50 CCC(CC)CCCNC Amb26964323 [0,2,0,0,0,0|2,0,0]=4 8681 B9R0.50 CCC(CC)CCCNC Amb28555603 [0,2,0,0,0,0|2,0,0]=4 8682 B9R0.50 CCC(CC)CCN=C=O Amb33313810 [0,2,0,0,0,0|1,0,1]=4 8683 B9R0.50 CCC(CCCC=O)OC Amb33325430 [0,2,0,0,0,0|0,0,0]=2 8684 B9R0.50 CCC(CCCCN)OC Amb25959007 [0,2,0,0,0,0|1,0,1]=4 8685 B9R0.50 CCC(CCCCO)OC Amb27617717 [0,2,0,0,0,0|0,0,2]=4 8686 B9R0.50 CCC(CCCOC)NN Amb28050380 [0,2,0,0,0,0|2,0,0]=4 8687 B9R0.50 CCC(CCN=C=O)OC Amb33320144 [0,2,0,0,0,0|1,0,1]=4 8688 B9R0.50 CCC(CCl)CCCOC Amb24509529 [0,2,0,0,0,0|2,0,0]=4 8689 B9R0.50 CCC(CCl)CCCSC Amb26363204 [0,2,0,0,0,0|2,0,0]=4 8690 B9R0.50 CCC(CO)CCCCO Amb27770514 [0,2,0,0,0,0|0,0,2]=4 8691 B9R0.50 CCCCC=C(C=O)C=O Amb18643579 [0,2,0,0,0,0|0,0,2]=4 8692 B9R0.50 CCCCCC(C#N)C#N Amb24714700 [0,2,0,0,0,0|1,0,1]=4 8693 B9R0.50 CCCCCC(C=O)CC Amb25883306 [0,2,0,0,0,0|0,0,0]=2 8694 B9R0.50 CCCCCC(C=O)SC Amb27841692 [0,2,0,0,0,0|0,0,0]=2 8695 B9R0.50 CCCCCC(CC)CBr Amb26369673 [0,2,0,0,0,0|1,0,1]=4 8696 B9R0.50 CCCCCC(CC)CC Amb22229275 [0,2,0,0,0,0|1,0,1]=4 8697 B9R0.50 CCCCCC(CC)CCl Amb26369462 [0,2,0,0,0,0|1,0,1]=4 8698 B9R0.50 CCCCCC(CC)CO Amb27831173 [0,2,0,0,0,0|0,0,2]=4 8699 B9R0.50 CCCCCC(CC)NN Amb28072731 [0,2,0,0,0,0|1,0,1]=4 8700 B9R0.50 CCCCCC(CC)OC Amb27425019 [0,2,0,0,0,0|1,0,1]=4 8701 B9R0.50 CCCCCC(CC)ON Amb28292988 [0,2,0,0,0,0|1,0,1]=4 8702 B9R0.50 CCCCCC(CN)CO Amb27465223 [0,2,0,0,0,0|0,0,2]=4 8703 B9R0.50 CCCCCC(CN)OC Amb25989930 [0,2,0,0,0,0|1,0,1]=4 8704 B9R0.50 CCCCCC(CN)SC Amb27249496 [0,2,0,0,0,0|1,0,1]=4 8705 B9R0.50 CCCCCC(CO)CS Amb27839186 [0,2,0,0,0,0|0,0,2]=4 8706 B9R0.50 CCCCCC(CO)SC Amb27457183 [0,2,0,0,0,0|0,0,2]=4 8707 B9R0.50 CCCCCC(OC)OC Amb8517638 [0,2,0,0,0,0|2,0,0]=4 8708 B9R0.50 CCCCC[C@@H](C=O)CC Amb27792864 [0,2,0,0,0,0|0,0,0]=2 8709 B9R0.50 CCCCC[C@@H](CC)CO Amb28050752 [0,2,0,0,0,0|0,0,2]=4 8710 B9R0.50 CCCCC\C(C#N)=C\N Amb27874067 [0,2,0,0,0,0|1,0,1]=4 8711 B9R0.50 CCCCC\C(C=O)=C/N Amb27591489 [0,2,0,0,0,0|0,0,1]=3 8712 B9R0.50 CCCCSC(C=O)CC Amb27799813 [0,2,0,0,0,0|1,0,0]=3 8713 B9R0.50 CCCC\C=C(/C=O)CCl Amb28319228 [0,2,0,0,0,0|0,0,2]=4 8714 B9R0.50 CCCC\C=C(/C=O)SC Amb25324111 [0,2,0,0,0,0|0,0,2]=4 8715 B9R0.50 CCNCCN(C=O)CC Amb18124697 [0,2,0,0,0,0|2,0,0]=4 8716 B9R0.50 CCOCCN(C=O)CC Amb28123303 [0,2,0,0,0,0|2,0,0]=4 8717 B9R0.50 COC(CCCC=O)OC Amb24117139 [0,2,0,0,0,0|1,0,0]=3 8718 B9R0.50 C\C=C(\C=O)CCCCC Amb27443056 [0,2,0,0,0,0|0,0,1]=3 8719 B9R0.50 C\C=C\CCC(C=O)CO Amb24721770 [0,2,0,0,0,0|0,0,2]=4 8720 B9R0.38 C=CCCCC[Si](C)(C)Cl Amb22733891 [0,2,0,0,0,0|1,1,0]=4 8721 B9R0.38 C=CCCCNC(C)(C)C Amb27208892 [0,2,0,0,0,0|2,0,0]=4 8722 B9R0.38 C=CCCNCC(C)(C)C Amb27425016 [0,2,0,0,0,0|2,0,0]=4 8723 B9R0.38 C=CCCSCC(C)(C)N Amb28422227 [0,2,0,0,0,0|2,0,0]=4 8724 B9R0.38 C=CCNCCC(C)(C)C Amb28288840 [0,2,0,0,0,0|2,0,0]=4 8725 B9R0.38 CC(C)(C)CCCCC=O Amb24614830 [0,2,0,0,0,0|0,0,0]=2 8726 B9R0.38 CC(C)(C)CCCCCBr Amb27153170 [0,2,0,0,0,0|1,0,1]=4 8727 B9R0.38 CC(C)(C)CCCCCCl Amb27247922 [0,2,0,0,0,0|1,0,1]=4 8728 B9R0.38 CC(C)(C)CCCCCN Amb28241232 [0,2,0,0,0,0|1,0,1]=4 8729 B9R0.38 CC(C)(C)CCCCCO Amb27880910 [0,2,0,0,0,0|0,0,2]=4 8730 B9R0.38 CC(C)(C)CCCN=C=O Amb26987736 [0,2,0,0,0,0|1,0,1]=4 8731 B9R0.38 CC(C)(C)CCCNC=O Amb27944691 [0,2,0,0,0,0|1,0,0]=3 8732 B9R0.38 CC(C)(C)OCCCC=O Amb25995379 [0,2,0,0,0,0|1,0,0]=3 8733 B9R0.38 CC(C)(C)OCCNC=O Amb27472341 [0,2,0,0,0,0|2,0,0]=4 8734 B9R0.38 CC(C)(C)SCCCC=O Amb27425102 [0,2,0,0,0,0|1,0,0]=3 8735 B9R0.38 CC(C)(C)SCCNC=O Amb27437605 [0,2,0,0,0,0|2,0,0]=4 8736 B9R0.38 CC(C)(F)CCCN=C=O Amb27777618 [0,2,0,0,0,0|1,0,1]=4 8737 B9R0.38 CC(C)(O)C#CCCC=O Amb27260499 [0,2,0,0,0,0|0,0,2]=4 8738 B9R0.38 CC(C)(O)CCCCC=O Amb28049929 [0,2,0,0,0,0|0,0,0]=2 8739 B9R0.38 CC(C)(O)CCCCCBr Amb25737898 [0,2,0,0,0,0|1,0,1]=4 8740 B9R0.38 CC(C)(O)CCCCCN Amb27593876 [0,2,0,0,0,0|1,0,1]=4 8741 B9R0.38 CC(C)(S)CCCCCO Amb27853563 [0,2,0,0,0,0|0,0,2]=4 8742 B9R0.38 CC(F)(F)CCCCCBr Amb25309673 [0,2,0,0,0,0|1,0,1]=4 8743 B9R0.38 CC(F)(F)CCCCCCl Amb32691350 [0,2,0,0,0,0|1,0,1]=4 8744 B9R0.38 CC(F)(F)CCCCCN Amb28045023 [0,2,0,0,0,0|1,0,1]=4 8745 B9R0.38 CC(F)(F)CCCCCO Amb27827320 [0,2,0,0,0,0|0,0,2]=4 8746 B9R0.38 CC(F)(F)CCCN=C=O Amb28399806 [0,2,0,0,0,0|1,0,1]=4 8747 B9R0.38 CC(F)(F)CCCNC=O Amb27435080 [0,2,0,0,0,0|1,0,0]=3 8748 B9R0.38 CCCCCCC(C)(C)C Amb10069374 [0,2,0,0,0,0|1,0,1]=4 8749 B9R0.38 CCCCCCC(C)(C)Cl Amb22228729 [0,2,0,0,0,0|1,0,1]=4 8750 B9R0.38 CCCCCCC(C)(C)N Amb26336797 [0,2,0,0,0,0|1,0,1]=4 8751 B9R0.38 CCCCCCC(C)(C)S Amb6366514 [0,2,0,0,0,0|0,1,1]=4 8752 B9R0.38 CCCCCCC(F)(Cl)Cl Amb10840161 [0,2,0,0,0,0|1,0,1]=4 8753 B9R0.38 CCCCCCC(F)(F)F Amb17672623 [0,2,0,0,0,0|1,0,1]=4 8754 B9R0.38 CCCCCCP(=O)(Cl)Cl Amb8516180 [0,2,0,0,0,0|1,0,0]=3 8755 B9R0.38 CCCCCCP(=O)(O)O Amb3371952 [0,2,0,0,0,0|1,0,0]=3 8756 B9R0.38 CCCCCCP(C)(C)=O Amb26515387 [0,2,0,0,0,0|1,0,0]=3 8757 B9R0.38 CCCCCCS(=O)(=O)Cl Amb2688722 [0,2,0,0,0,0|1,0,0]=3 8758 B9R0.38 CCCCCCS(=O)(=O)F Amb33352465 [0,2,0,0,0,0|1,0,0]=3 8759 B9R0.38 CCCCCCS(=O)(=O)O Amb25138206 [0,2,0,0,0,0|1,0,0]=3 8760 B9R0.38 CCCCCCS(=O)(=O)[O-] Amb6366783 [0,2,0,0,0,0|1,0,0]=3 8761 B9R0.38 CCCCCCS(=O)(=O)[O-] Amb8396881 [0,2,0,0,0,0|1,0,0]=3 8762 B9R0.38 CCCCCCS(N)(=O)=O Amb16191920 [0,2,0,0,0,0|1,0,0]=3 8763 B9R0.38 CCCCCC[B-](F)(F)F Amb22583784 [0,2,0,0,0,0|2,0,0]=4 8764 B9R0.38 CCCCCC[N+](C)(C)[O-] Amb9825627 [0,2,0,0,0,0|1,0,1]=4 8765 B9R0.38 CCCCCC[Si](C)(C)C Amb27211083 [0,2,0,0,0,0|1,1,0]=4 8766 B9R0.38 CCCCCC[Si](C)(C)Cl Amb8515717 [0,2,0,0,0,0|1,1,0]=4 8767 B9R0.38 CCCCCC[Si](C)(Cl)Cl Amb19893899 [0,2,0,0,0,0|1,1,0]=4 8768 B9R0.38 CCCCCC[Si](F)(F)F Amb22230754 [0,2,0,0,0,0|1,1,0]=4 8769 B9R0.38 CCCCCNS(C)(=O)=O Amb6559179 [0,2,0,0,0,0|2,0,0]=4 8770 B9R0.38 CCCCCOP(=O)(O)O Amb22168445 [0,2,0,0,0,0|2,0,0]=4 8771 B9R0.38 CCCCCOP(C)(=O)S Amb26900733 [0,2,0,0,0,0|2,0,0]=4 8772 B9R0.38 CCCCCOS(=O)(=O)[O-] Amb8517451 [0,2,0,0,0,0|2,0,0]=4 8773 B9R0.38 CCCCCOS(C)(=O)=O Amb22388766 [0,2,0,0,0,0|2,0,0]=4 8774 B9R0.38 CCCCCSS(C)(=O)=O Amb17619183 [0,2,0,0,0,0|2,0,0]=4 8775 B9R0.38 CCCCNCP(C)(=O)O Amb1776475 [0,2,0,0,0,0|2,0,0]=4 8776 B9R0.38 CCCNCCS(=O)(=O)F Amb33463759 [0,2,0,0,0,0|2,0,0]=4 8777 B9R0.38 CCCNCCS(=O)(=O)O Amb27866270 [0,2,0,0,0,0|2,0,0]=4 8778 B9R0.38 CCCNCCS(N)(=O)=O Amb9414108 [0,2,0,0,0,0|2,0,0]=4 8779 B9R0.38 CCCOCCS(=O)(=O)Cl Amb26986103 [0,2,0,0,0,0|2,0,0]=4 8780 B9R0.38 CCCOCCS(N)(=O)=O Amb25318135 [0,2,0,0,0,0|2,0,0]=4 8781 B9R0.38 CCNCCCS(=O)(=O)F Amb33463920 [0,2,0,0,0,0|2,0,0]=4 8782 B9R0.38 CCOCCCS(=O)(=O)Cl Amb25756682 [0,2,0,0,0,0|2,0,0]=4 8783 B9R0.38 CCOCCCS(=O)(=O)F Amb26951899 [0,2,0,0,0,0|2,0,0]=4 8784 B9R0.38 CCOCCCS(N)(=O)=O Amb24617117 [0,2,0,0,0,0|2,0,0]=4 8785 B9R0.38 CNCCCCC(C)(C)O Amb17569963 [0,2,0,0,0,0|2,0,0]=4 8786 B9R0.38 CNCCCCS(=O)(=O)F Amb33463937 [0,2,0,0,0,0|2,0,0]=4 8787 B9R0.38 CNCCCCS(N)(=O)=O Amb28126742 [0,2,0,0,0,0|2,0,0]=4 8788 B9R0.38 COCCCCC(C)(C)N Amb17569981 [0,2,0,0,0,0|2,0,0]=4 8789 B9R0.38 COCCCCS(=O)(=O)Cl Amb26447071 [0,2,0,0,0,0|2,0,0]=4 8790 B9R0.38 COCCCCS(=O)(=O)F Amb26421601 [0,2,0,0,0,0|2,0,0]=4 8791 B9R0.38 COCCCCS(N)(=O)=O Amb25810707 [0,2,0,0,0,0|2,0,0]=4 8792 B9R0.38 CS(=O)(=O)CCCCCBr Amb25091397 [0,2,0,0,0,0|2,0,0]=4 8793 B9R0.38 CS(=O)(=O)CCCCCCl Amb18319620 [0,2,0,0,0,0|2,0,0]=4 8794 B9R0.38 CS(=O)(=O)CCCCCN Amb28895974 [0,2,0,0,0,0|2,0,0]=4 8795 B9R0.38 CSCCCCC(C)(C)N Amb33198294 [0,2,0,0,0,0|2,0,0]=4 8796 B9R0.38 CSCCCCS(C)(=O)=O Amb28049770 [0,2,0,0,0,0|2,0,0]=4 8797 B9R0.38 NCCCCCS(=O)(=O)F Amb33463767 [0,2,0,0,0,0|2,0,0]=4 8798 B9R0.38 NCCCCCS(=O)(=O)O Amb28325598 [0,2,0,0,0,0|2,0,0]=4 8799 B9R0.38 NS(=O)(=O)CCCCCF Amb24593996 [0,2,0,0,0,0|2,0,0]=4 8800 B9R0.38 O=CCCCCS(=O)(=O)[O-] Amb27226993 [0,2,0,0,0,0|2,0,0]=4 8801 B9R0.38 O=CNCCCC(F)(F)F Amb27425025 [0,2,0,0,0,0|2,0,0]=4 8802 B9R0.38 O=S(=O)(Cl)CCCCCBr Amb24505264 [0,2,0,0,0,0|2,0,0]=4 8803 B9R0.38 O=S(=O)(Cl)CCCCCCl Amb18062652 [0,2,0,0,0,0|2,0,0]=4 8804 B9R0.38 O=S(=O)(Cl)CCCCCF Amb27154799 [0,2,0,0,0,0|2,0,0]=4 8805 B9R0.38 O=S(=O)(Cl)CCCCCO Amb28282606 [0,2,0,0,0,0|2,0,0]=4 8806 B9R0.38 O=S(=O)(F)CCCCCBr Amb32719031 [0,2,0,0,0,0|2,0,0]=4 8807 B9R0.55 C=C(Br)CCCCC(N)=O Amb27449194 [0,2,0,0,0,0|0,0,2]=4 8808 B9R0.55 C=C(Br)CSCCC(C)C Amb27254768 [0,2,0,0,0,0|2,0,0]=4 8809 B9R0.55 C=C(C)CCCCC(C)O Amb27590791 [0,2,0,0,0,0|1,0,0]=3 8810 B9R0.55 C=C(C)CCCNC(C)C Amb27806611 [0,2,0,0,0,0|2,0,0]=4 8811 B9R0.55 C=C(C)CCNCC(N)=O Amb27615175 [0,2,0,0,0,0|1,0,1]=4 8812 B9R0.55 C=C(C)CCNC[C@@H](C)O Amb27232911 [0,2,0,0,0,0|2,0,0]=4 8813 B9R0.55 C=C(C)CCOCC(C)=O Amb28318908 [0,2,0,0,0,0|1,0,1]=4 8814 B9R0.55 C=C(C)CCOCC(N)=O Amb28282201 [0,2,0,0,0,0|1,0,1]=4 8815 B9R0.55 C=C(C)CCSCC(C)=O Amb27469207 [0,2,0,0,0,0|1,0,1]=4 8816 B9R0.55 C=C(C)COCCC(=O)O Amb27882463 [0,2,0,0,0,0|1,0,1]=4 8817 B9R0.55 C=C(C)COCCC(C)O Amb28315218 [0,2,0,0,0,0|2,0,0]=4 8818 B9R0.55 C=C(Cl)CNCCC(C)C Amb18800600 [0,2,0,0,0,0|2,0,0]=4 8819 B9R0.55 C=C(F)CCCCC(=O)O Amb27949889 [0,2,0,0,0,0|0,0,2]=4 8820 B9R0.55 CC(=N)NCCCC(C)C Amb27260700 [0,2,0,0,0,0|2,0,0]=4 8821 B9R0.55 CC(=N)NCCCC(C)N Amb27252018 [0,2,0,0,0,0|2,0,0]=4 8822 B9R0.55 CC(=O)CCCC=C(C)C Amb28053965 [0,2,0,0,0,0|0,0,2]=4 8823 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [0,2,0,0,0,0|0,0,1]=3 8824 B9R0.55 CC(=O)CCCCC(C)=O Amb17593600 [0,2,0,0,0,0|0,0,1]=3 8825 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [0,2,0,0,0,0|0,0,0]=2 8826 B9R0.55 CC(=O)CCCCC(Cl)Cl Amb27392324 [0,2,0,0,0,0|1,0,0]=3 8827 B9R0.55 CC(=O)CCCCN(C)C Amb9659130 [0,2,0,0,0,0|1,0,0]=3 8828 B9R0.55 CC(=O)CCCCS(C)=O Amb27412643 [0,2,0,0,0,0|1,0,0]=3 8829 B9R0.55 CC(=O)CCCNC(C)=O Amb28194645 [0,2,0,0,0,0|1,0,1]=4 8830 B9R0.55 CC(=O)CCCNC(C)C Amb27856985 [0,2,0,0,0,0|1,0,0]=3 8831 B9R0.55 CC(=O)CCCNS(C)=O Amb27774835 [0,2,0,0,0,0|2,0,0]=4 8832 B9R0.55 CC(=O)CCCOC(C)=O Amb1033031 [0,2,0,0,0,0|1,0,1]=4 8833 B9R0.55 CC(=O)CCCOC(C)C Amb9659686 [0,2,0,0,0,0|1,0,0]=3 8834 B9R0.55 CC(=O)CCNCC(=O)O Amb32675828 [0,2,0,0,0,0|1,0,1]=4 8835 B9R0.55 CC(=O)CCNCC(C)C Amb26410166 [0,2,0,0,0,0|1,0,0]=3 8836 B9R0.55 CC(=O)CCOCC(=O)O Amb27241199 [0,2,0,0,0,0|1,0,1]=4 8837 B9R0.55 CC(=O)CCOCC(C)C Amb7764634 [0,2,0,0,0,0|1,0,0]=3 8838 B9R0.55 CC(=O)CCSCC(=O)O Amb24443138 [0,2,0,0,0,0|1,0,1]=4 8839 B9R0.55 CC(=O)CCSCC(C)C Amb9283499 [0,2,0,0,0,0|1,0,0]=3 8840 B9R0.55 CC(=O)CSCCC(C)C Amb27614926 [0,2,0,0,0,0|1,0,0]=3 8841 B9R0.55 CC(=O)CSCCC(F)F Amb27958686 [0,2,0,0,0,0|2,0,0]=4 8842 B9R0.55 CC(=O)CSCCN(C)C Amb27485248 [0,2,0,0,0,0|2,0,0]=4 8843 B9R0.55 CC(=O)NCCCC(=O)O Amb2778749 [0,2,0,0,0,0|1,0,1]=4 8844 B9R0.55 CC(=O)NCCCC(C)O Amb28076577 [0,2,0,0,0,0|1,0,0]=3 8845 B9R0.55 CC(=O)NCCCN(C)C Amb3358094 [0,2,0,0,0,0|2,0,0]=4 8846 B9R0.55 CC(=O)NCCCS(C)=O Amb27786571 [0,2,0,0,0,0|2,0,0]=4 8847 B9R0.55 CC(=O)NCCNC(C)C Amb6732592 [0,2,0,0,0,0|2,0,0]=4 8848 B9R0.55 CC(=O)NCOCC(C)C Amb28199237 [0,2,0,0,0,0|2,0,0]=4 8849 B9R0.55 CC(=O)OCCCC(=O)O Amb24480808 [0,2,0,0,0,0|1,0,1]=4 8850 B9R0.55 CC(=O)OCCCC(C)Br Amb27643403 [0,2,0,0,0,0|1,0,0]=3 8851 B9R0.55 CC(=O)OCCCC(C)Cl Amb27645429 [0,2,0,0,0,0|1,0,0]=3 8852 B9R0.55 CC(=O)OCCC[C@@H](C)O Amb27775430 [0,2,0,0,0,0|1,0,0]=3 8853 B9R0.55 CC(=O)OCCNC(C)C Amb28344226 [0,2,0,0,0,0|2,0,0]=4 8854 B9R0.55 CC(=O)OCCOC(C)C Amb25662885 [0,2,0,0,0,0|2,0,0]=4 8855 B9R0.55 CC(=O)OCCOC(C)Cl Amb27433920 [0,2,0,0,0,0|2,0,0]=4 8856 B9R0.55 CC(=O)SCCCC(=O)O Amb26356321 [0,2,0,0,0,0|1,0,1]=4 8857 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [0,2,0,0,0,0|0,0,2]=4 8858 B9R0.55 CC(Br)COCCC(=O)O Amb28255646 [0,2,0,0,0,0|1,0,0]=3 8859 B9R0.55 CC(C)=CCCCC(N)=O Amb27390535 [0,2,0,0,0,0|0,0,2]=4 8860 B9R0.55 CC(C)CC#CCC(=O)O Amb27754079 [0,2,0,0,0,0|0,0,2]=4 8861 B9R0.55 CC(C)CCC#CC(=O)O Amb27494024 [0,2,0,0,0,0|0,0,2]=4 8862 B9R0.55 CC(C)CCCCB(O)O Amb27615027 [0,2,0,0,0,0|1,0,1]=4 8863 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [0,2,0,0,0,0|0,0,0]=2 8864 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,2,0,0,0,0|0,0,0]=2 8865 B9R0.55 CC(C)CCCCC(C)C Amb22043289 [0,2,0,0,0,0|1,0,1]=4 8866 B9R0.55 CC(C)CCCCC(C)N Amb27830700 [0,2,0,0,0,0|1,0,1]=4 8867 B9R0.55 CC(C)CCCCC(N)=O Amb2613088 [0,2,0,0,0,0|0,0,0]=2 8868 B9R0.55 CC(C)CCCCC(O)O Amb27761556 [0,2,0,0,0,0|0,0,2]=4 8869 B9R0.55 CC(C)CCCC[C@@H](C)N Amb33731285 [0,2,0,0,0,0|1,0,1]=4 8870 B9R0.55 CC(C)CCCC[C@H](C)N Amb33729329 [0,2,0,0,0,0|1,0,1]=4 8871 B9R0.55 CC(C)CCCNC(=N)N Amb27784893 [0,2,0,0,0,0|2,0,0]=4 8872 B9R0.55 CC(C)CCCOC(=O)Cl Amb25885760 [0,2,0,0,0,0|1,0,0]=3 8873 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,2,0,0,0,0|1,0,0]=3 8874 B9R0.55 CC(C)CCNCC(N)=O Amb1112311 [0,2,0,0,0,0|1,0,0]=3 8875 B9R0.55 CC(C)CCOCC(=O)Cl Amb27441228 [0,2,0,0,0,0|1,0,0]=3 8876 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,2,0,0,0,0|1,0,0]=3 8877 B9R0.55 CC(C)CCOCC(N)=S Amb6262163 [0,2,0,0,0,0|1,1,0]=4 8878 B9R0.55 CC(C)CCONC(N)=O Amb2899786 [0,2,0,0,0,0|2,0,0]=4 8879 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,2,0,0,0,0|1,0,0]=3 8880 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [0,2,0,0,0,0|0,0,2]=4 8881 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,2,0,0,0,0|1,0,0]=3 8882 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,2,0,0,0,0|1,0,0]=3 8883 B9R0.55 CC(C)CNCCC(N)=S Amb17232337 [0,2,0,0,0,0|1,1,0]=4 8884 B9R0.55 CC(C)COCCC(=N)N Amb6267452 [0,2,0,0,0,0|2,0,0]=4 8885 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [0,2,0,0,0,0|1,0,0]=3 8886 B9R0.55 CC(C)COCCC(N)=O Amb27463674 [0,2,0,0,0,0|1,0,0]=3 8887 B9R0.55 CC(C)COCCC(N)=S Amb6265253 [0,2,0,0,0,0|1,1,0]=4 8888 B9R0.55 CC(C)CSCCC(=N)N Amb7787496 [0,2,0,0,0,0|2,0,0]=4 8889 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [0,2,0,0,0,0|1,0,0]=3 8890 B9R0.55 CC(C)CSCCC(N)=S Amb17503256 [0,2,0,0,0,0|1,1,0]=4 8891 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,2,0,0,0,0|2,0,0]=4 8892 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,2,0,0,0,0|1,0,0]=3 8893 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,2,0,0,0,0|1,0,0]=3 8894 B9R0.55 CC(C)OCCCC(=N)N Amb6270622 [0,2,0,0,0,0|2,0,0]=4 8895 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [0,2,0,0,0,0|1,0,0]=3 8896 B9R0.55 CC(C)OCCC[N+](=O)[O-] Amb33274120 [0,2,0,0,0,0|2,0,0]=4 8897 B9R0.55 CC(C)OCCOC(=O)Cl Amb24465716 [0,2,0,0,0,0|2,0,0]=4 8898 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,2,0,0,0,0|2,0,0]=4 8899 B9R0.55 CC(C)OCSCC(=O)O Amb28241661 [0,2,0,0,0,0|2,0,0]=4 8900 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [0,2,0,0,0,0|1,0,0]=3 8901 B9R0.55 CC(C)\C=N\CCC(=O)O Amb27759498 [0,2,0,0,0,0|1,0,1]=4 8902 B9R0.55 CC(Cl)CCCCS(C)=O Amb28142480 [0,2,0,0,0,0|1,0,0]=3 8903 B9R0.55 CC(Cl)CNCCS(C)=O Amb27776246 [0,2,0,0,0,0|2,0,0]=4 8904 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [0,2,0,0,0,0|1,0,0]=3 8905 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [0,2,0,0,0,0|1,0,0]=3 8906 B9R0.55 CC(N)CCC#CC(=O)O Amb33169012 [0,2,0,0,0,0|0,0,2]=4 8907 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [0,2,0,0,0,0|0,0,0]=2 8908 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [0,2,0,0,0,0|0,0,0]=2 8909 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [0,2,0,0,0,0|0,0,0]=2 8910 B9R0.55 CC(N)CCCCN(C)C Amb25978464 [0,2,0,0,0,0|2,0,0]=4 8911 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [0,2,0,0,0,0|1,0,0]=3 8912 B9R0.55 CC(O)CCCCC(C)O Amb27839243 [0,2,0,0,0,0|0,0,2]=4 8913 B9R0.55 CC(O)CCCCN(C)C Amb24271124 [0,2,0,0,0,0|2,0,0]=4 8914 B9R0.55 CC(O)CCCCS(C)=O Amb28197304 [0,2,0,0,0,0|1,0,0]=3 8915 B9R0.55 CC(O)CSCCC(=O)O Amb18792572 [0,2,0,0,0,0|1,0,0]=3 8916 B9R0.55 CC(O)CSCCC(N)=O Amb27976132 [0,2,0,0,0,0|1,0,0]=3 8917 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,2,0,0,0,0|0,0,2]=4 8918 B9R0.55 CN(C)CCCCC(=O)O Amb19275569 [0,2,0,0,0,0|1,0,0]=3 8919 B9R0.55 CN(C)CCCCC(=O)O Amb7783201 [0,2,0,0,0,0|1,0,0]=3 8920 B9R0.55 CN(C)CCCCS(=O)[O-] Amb32755795 [0,2,0,0,0,0|2,0,0]=4 8921 B9R0.55 CN(C)CCCC[N+](=O)[O-] Amb33271978 [0,2,0,0,0,0|2,0,0]=4 8922 B9R0.55 CN(C)CCCNC(=O)S Amb27823578 [0,2,0,0,0,0|2,0,0]=4 8923 B9R0.55 CN(C)CCCNC(N)=O Amb1125203 [0,2,0,0,0,0|2,0,0]=4 8924 B9R0.55 CN(C)CCCNC(N)=O Amb33552022 [0,2,0,0,0,0|2,0,0]=4 8925 B9R0.55 CN(C)CCNCC(=O)O Amb31292878 [0,2,0,0,0,0|2,0,0]=4 8926 B9R0.55 CN(C)CCOCC(=O)O Amb20667765 [0,2,0,0,0,0|2,0,0]=4 8927 B9R0.55 CN(C)CCOCC(=O)O Amb22059502 [0,2,0,0,0,0|2,0,0]=4 8928 B9R0.55 CN(C)CCSCC(=O)O Amb1138164 [0,2,0,0,0,0|2,0,0]=4 8929 B9R0.55 CN(C)CCSCC(=O)O Amb33329916 [0,2,0,0,0,0|2,0,0]=4 8930 B9R0.55 CS(=O)CCCCC(=O)O Amb18788305 [0,2,0,0,0,0|1,0,0]=3 8931 B9R0.55 CS(=O)CCNCC(N)=O Amb28140353 [0,2,0,0,0,0|2,0,0]=4 8932 B9R0.55 CS(=O)CCSCC(=O)O Amb27236300 [0,2,0,0,0,0|2,0,0]=4 8933 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [0,2,0,0,0,0|0,0,0]=2 8934 B9R0.55 C[C@@H](N)CCCCN(C)C Amb33272251 [0,2,0,0,0,0|2,0,0]=4 8935 B9R0.55 C[C@@H](O)CCCCN(C)C Amb33272253 [0,2,0,0,0,0|2,0,0]=4 8936 B9R0.55 C[C@@H](O)CSCCC(N)=O Amb27795743 [0,2,0,0,0,0|1,0,0]=3 8937 B9R0.55 C[C@H](N)CCCCN(C)C Amb33272250 [0,2,0,0,0,0|2,0,0]=4 8938 B9R0.55 C[C@H](N)CSCCC(N)=O Amb28367266 [0,2,0,0,0,0|1,0,0]=3 8939 B9R0.55 C[C@H](O)CCCCN(C)C Amb33272255 [0,2,0,0,0,0|2,0,0]=4 8940 B9R0.55 C[C@H](O)CNCCC(N)=O Amb27464472 [0,2,0,0,0,0|1,0,0]=3 8941 B9R0.55 C[C@H](O)CSCCC(N)=O Amb28195669 [0,2,0,0,0,0|1,0,0]=3 8942 B9R0.55 C\C(Br)=C/CCCC(=O)O Amb27798317 [0,2,0,0,0,0|0,0,2]=4 8943 B9R0.55 C\C(N)=N/CCCC(C)O Amb27399139 [0,2,0,0,0,0|2,0,0]=4 8944 B9R0.55 NC(=O)CCCCC(=O)O Amb9391119 [0,2,0,0,0,0|1,0,1]=4 8945 B9R0.55 NC(=O)CCCCC(N)=O Amb2793081 [0,2,0,0,0,0|1,0,1]=4 8946 B9R0.55 NC(=O)CNCCC(F)F Amb27255949 [0,2,0,0,0,0|2,0,0]=4 8947 B9R0.55 O=C(Cl)CCCCC(=O)Cl Amb3940243 [0,2,0,0,0,0|1,0,1]=4 8948 B9R0.55 O=C(O)CCCCC(=O)Cl Amb27614847 [0,2,0,0,0,0|1,0,1]=4 8949 B9R0.55 O=C(O)CCCCC(=O)O Amb22167453 [0,2,0,0,0,0|1,0,1]=4 8950 B9R0.55 O=C(O)CCCCC(=O)O Amb22336279 [0,2,0,0,0,0|1,0,1]=4 8951 B9R0.55 O=C(O)CCCCC(=O)O Amb2793031 [0,2,0,0,0,0|1,0,1]=4 8952 B9R0.55 O=C(O)CCCCC(O)O Amb28143854 [0,2,0,0,0,0|1,0,0]=3 8953 B9R0.55 O=C(O)CCCCN(F)F Amb27985922 [0,2,0,0,0,0|2,0,0]=4 8954 B9R0.55 O=C(O)CCCOC(F)F Amb27861059 [0,2,0,0,0,0|2,0,0]=4 8955 B9R0.55 O=C(O)CCOCC(F)F Amb26539468 [0,2,0,0,0,0|2,0,0]=4 8956 B9R0.55 O=C(O)COCCC(F)F Amb27848670 [0,2,0,0,0,0|2,0,0]=4 8957 B9R0.55 O=C([O-])CCCCC(=O)[O-] Amb22168121 [0,2,0,0,0,0|1,0,1]=4 8958 B7R1.1 BrC=C1CCCC1 Amb27592183 [1,0,0,1,0,0|1,0,1]=4 8959 B7R1.1 BrCC1=CCCC1 Amb23439168 [1,0,0,1,0,0|1,0,1]=4 8960 B7R1.1 BrCC1C=CCC1 Amb28385457 [1,0,0,1,0,0|1,0,1]=4 8961 B7R1.1 BrCC1CCCC1 Amb8631537 [1,0,0,1,0,0|1,0,0]=3 8962 B7R1.1 BrCC1CCCN1 Amb20618588 [1,0,0,1,0,0|2,0,0]=4 8963 B7R1.1 BrCC1CCCN1 Amb21962027 [1,0,0,1,0,0|2,0,0]=4 8964 B7R1.1 BrCC1CCCN1 Amb32411817 [1,0,0,1,0,0|2,0,0]=4 8965 B7R1.1 BrCC1CCCO1 Amb9703505 [1,0,0,1,0,0|1,0,1]=4 8966 B7R1.1 BrCC1CCCS1 Amb27832399 [1,0,0,1,0,0|1,1,0]=4 8967 B7R1.1 BrCC1CCNC1 Amb20618587 [1,0,0,1,0,0|2,0,0]=4 8968 B7R1.1 BrCC1CCNC1 Amb22229236 [1,0,0,1,0,0|2,0,0]=4 8969 B7R1.1 BrCC1CCNC1 Amb33483362 [1,0,0,1,0,0|2,0,0]=4 8970 B7R1.1 BrCC1CCOC1 Amb8835455 [1,0,0,1,0,0|2,0,0]=4 8971 B7R1.1 BrCC1CCSC1 Amb27630698 [1,0,0,1,0,0|2,0,0]=4 8972 B7R1.1 BrC[C@@H]1C=CCC1 Amb27233396 [1,0,0,1,0,0|1,0,1]=4 8973 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [1,0,0,1,0,0|2,0,0]=4 8974 B7R1.1 BrC[C@@H]1CCCN1 Amb32668728 [1,0,0,1,0,0|2,0,0]=4 8975 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [1,0,0,1,0,0|1,0,1]=4 8976 B7R1.1 BrC[C@H]1CCCO1 Amb26844489 [1,0,0,1,0,0|1,0,1]=4 8977 B7R1.1 C#CC1CCCC1 Amb8396063 [1,0,0,1,0,0|0,0,2]=4 8978 B7R1.1 C=CC1CCCC1 Amb17934190 [1,0,0,1,0,0|0,0,1]=3 8979 B7R1.1 C=CC1CCCN1 Amb23536605 [1,0,0,1,0,0|1,0,1]=4 8980 B7R1.1 C=CC1CCCN1 Amb24082686 [1,0,0,1,0,0|1,0,1]=4 8981 B7R1.1 C=CC1CCCO1 Amb28137321 [1,0,0,1,0,0|1,0,1]=4 8982 B7R1.1 C=CC1CCCS1 Amb33415623 [1,0,0,1,0,0|1,0,1]=4 8983 B7R1.1 C=CC1CCNC1 Amb22587509 [1,0,0,1,0,0|1,0,1]=4 8984 B7R1.1 C=CC1CCOC1 Amb24478877 [1,0,0,1,0,0|1,0,1]=4 8985 B7R1.1 C=CC1CCSC1 Amb28065280 [1,0,0,1,0,0|1,0,1]=4 8986 B7R1.1 C=CN1CCCC1 Amb25133406 [1,0,0,1,0,0|1,0,1]=4 8987 B7R1.1 CC=C1CCCC1 Amb4035880 [1,0,0,1,0,0|1,0,1]=4 8988 B7R1.1 CCC1=CCCC1 Amb4035875 [1,0,0,1,0,0|0,0,1]=3 8989 B7R1.1 CCC1=NCCC1 Amb22055207 [1,0,0,1,0,0|1,0,1]=4 8990 B7R1.1 CCC1C=CCC1 Amb4020582 [1,0,0,1,0,0|0,0,1]=3 8991 B7R1.1 CCC1C=CCN1 Amb10608188 [1,0,0,1,0,0|1,0,1]=4 8992 B7R1.1 CCC1C=CCN1 Amb22587170 [1,0,0,1,0,0|1,0,1]=4 8993 B7R1.1 CCC1C=NNC1 Amb27844457 [1,0,0,1,0,0|2,0,0]=4 8994 B7R1.1 CCC1CC=CC1 Amb30033009 [1,0,0,1,0,0|1,0,1]=4 8995 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|0,0,1]=3 8996 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,0]=3 8997 B7R1.1 CCC1CCCN1 Amb3788096 [1,0,0,1,0,0|1,0,0]=3 8998 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,1,0]=3 8999 B7R1.1 CCC1CCC[Cl+]1 Amb28076649 [1,0,0,1,0,0|1,0,0]=3 9000 B7R1.1 CCC1CCNC1 Amb18946548 [1,0,0,1,0,0|1,0,1]=4 9001 B7R1.1 CCC1CCNC1 Amb20630619 [1,0,0,1,0,0|1,0,1]=4 9002 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|1,0,1]=4 9003 B7R1.1 CCC1NCCO1 Amb17506183 [1,0,0,1,0,0|1,0,1]=4 9004 B7R1.1 CCC1OCCO1 Amb19892413 [1,0,0,1,0,0|1,0,1]=4 9005 B7R1.1 CCN1C=NCC1 Amb29888710 [1,0,0,1,0,0|2,0,0]=4 9006 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|1,0,1]=4 9007 B7R1.1 CCN1CCCN1 Amb27776139 [1,0,0,1,0,0|2,0,0]=4 9008 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,0]=3 9009 B7R1.1 CC[C@@H]1CCNC1 Amb33801216 [1,0,0,1,0,0|1,0,1]=4 9010 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,0]=3 9011 B7R1.1 CC[C@H]1CCNC1 Amb27458282 [1,0,0,1,0,0|1,0,1]=4 9012 B7R1.1 CC[C@H]1CCNC1 Amb30594227 [1,0,0,1,0,0|1,0,1]=4 9013 B7R1.1 CNC1CCCC1 Amb1223228 [1,0,0,1,0,0|1,0,1]=4 9014 B7R1.1 CNC1CCCC1 Amb9677383 [1,0,0,1,0,0|1,0,1]=4 9015 B7R1.1 CNC1CCCO1 Amb27254048 [1,0,0,1,0,0|1,0,1]=4 9016 B7R1.1 COC1C=CCC1 Amb4016570 [1,0,0,1,0,0|1,0,1]=4 9017 B7R1.1 COC1CCCC1 Amb8517656 [1,0,0,1,0,0|1,0,1]=4 9018 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|1,0,1]=4 9019 B7R1.1 CO[C@@H]1CCCN1 Amb27948785 [1,0,0,1,0,0|2,0,0]=4 9020 B7R1.1 CSC1C=NCC1 Amb27466721 [1,0,0,1,0,0|2,0,0]=4 9021 B7R1.1 CSC1CCCC1 Amb22230463 [1,0,0,1,0,0|1,0,1]=4 9022 B7R1.1 ClC=C1CCCC1 Amb28118913 [1,0,0,1,0,0|1,0,1]=4 9023 B7R1.1 ClCC1CCCC1 Amb9004338 [1,0,0,1,0,0|1,0,0]=3 9024 B7R1.1 ClCC1CCCN1 Amb1102532 [1,0,0,1,0,0|2,0,0]=4 9025 B7R1.1 ClCC1CCCN1 Amb22228750 [1,0,0,1,0,0|2,0,0]=4 9026 B7R1.1 ClCC1CCCO1 Amb5716848 [1,0,0,1,0,0|1,0,1]=4 9027 B7R1.1 ClCC1CCCS1 Amb25339278 [1,0,0,1,0,0|1,1,0]=4 9028 B7R1.1 ClCC1CCOC1 Amb9754529 [1,0,0,1,0,0|2,0,0]=4 9029 B7R1.1 ClCC1CCSC1 Amb28423424 [1,0,0,1,0,0|2,0,0]=4 9030 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [1,0,0,1,0,0|2,0,0]=4 9031 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [1,0,0,1,0,0|2,0,0]=4 9032 B7R1.1 ClC[C@@H]1CCNC1 Amb26551071 [1,0,0,1,0,0|2,0,0]=4 9033 B7R1.1 ClC[C@H]1CCCN1 Amb26577168 [1,0,0,1,0,0|2,0,0]=4 9034 B7R1.1 ClC[C@H]1CCNC1 Amb25064501 [1,0,0,1,0,0|2,0,0]=4 9035 B7R1.1 FCC1CCCN1 Amb13953136 [1,0,0,1,0,0|2,0,0]=4 9036 B7R1.1 FCC1CCCN1 Amb28827628 [1,0,0,1,0,0|2,0,0]=4 9037 B7R1.1 FCC1CCNC1 Amb24423478 [1,0,0,1,0,0|2,0,0]=4 9038 B7R1.1 FCC1CCNC1 Amb32676678 [1,0,0,1,0,0|2,0,0]=4 9039 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [1,0,0,1,0,0|2,0,0]=4 9040 B7R1.1 FC[C@@H]1CCCN1 Amb27973462 [1,0,0,1,0,0|2,0,0]=4 9041 B7R1.1 FC[C@@H]1CCNC1 Amb27246397 [1,0,0,1,0,0|2,0,0]=4 9042 B7R1.1 FC[C@@H]1CCNC1 Amb33874890 [1,0,0,1,0,0|2,0,0]=4 9043 B7R1.1 FC[C@H]1CCCN1 Amb27602129 [1,0,0,1,0,0|2,0,0]=4 9044 B7R1.1 FC[C@H]1CCCN1 Amb32409431 [1,0,0,1,0,0|2,0,0]=4 9045 B7R1.1 FC[C@H]1CCNC1 Amb24184002 [1,0,0,1,0,0|2,0,0]=4 9046 B7R1.1 FC[C@H]1CCNC1 Amb28435036 [1,0,0,1,0,0|2,0,0]=4 9047 B7R1.1 ICC1=CCCC1 Amb27838217 [1,0,0,1,0,0|1,0,1]=4 9048 B7R1.1 ICC1CCCC1 Amb8517132 [1,0,0,1,0,0|1,0,0]=3 9049 B7R1.1 ICC1CCCO1 Amb24060886 [1,0,0,1,0,0|1,0,1]=4 9050 B7R1.1 ICC1CCOC1 Amb23439064 [1,0,0,1,0,0|2,0,0]=4 9051 B7R1.1 N#CC1CCCC1 Amb2721544 [1,0,0,1,0,0|1,0,1]=4 9052 B7R1.1 NCC1=CCCC1 Amb18120760 [1,0,0,1,0,0|1,0,1]=4 9053 B7R1.1 NCC1C=CCC1 Amb18119742 [1,0,0,1,0,0|1,0,1]=4 9054 B7R1.1 NCC1C=CCC1 Amb30584689 [1,0,0,1,0,0|1,0,1]=4 9055 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|1,0,0]=3 9056 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|1,0,0]=3 9057 B7R1.1 NCC1CCCC1 Amb6892868 [1,0,0,1,0,0|1,0,0]=3 9058 B7R1.1 NCC1CCCN1 Amb19516137 [1,0,0,1,0,0|2,0,0]=4 9059 B7R1.1 NCC1CCCN1 Amb4418336 [1,0,0,1,0,0|2,0,0]=4 9060 B7R1.1 NCC1CCCO1 Amb2568046 [1,0,0,1,0,0|1,0,1]=4 9061 B7R1.1 NCC1CCCO1 Amb3903680 [1,0,0,1,0,0|1,0,1]=4 9062 B7R1.1 NCC1CCCS1 Amb20668756 [1,0,0,1,0,0|1,1,0]=4 9063 B7R1.1 NCC1CCOC1 Amb33536658 [1,0,0,1,0,0|2,0,0]=4 9064 B7R1.1 NCC1CCOC1 Amb7969615 [1,0,0,1,0,0|2,0,0]=4 9065 B7R1.1 NCC1CCSC1 Amb18198289 [1,0,0,1,0,0|2,0,0]=4 9066 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [1,0,0,1,0,0|2,0,0]=4 9067 B7R1.1 NC[C@@H]1CCCO1 Amb32661832 [1,0,0,1,0,0|1,0,1]=4 9068 B7R1.1 NC[C@@H]1CCCO1 Amb3940181 [1,0,0,1,0,0|1,0,1]=4 9069 B7R1.1 NC[C@@H]1CCOC1 Amb26870648 [1,0,0,1,0,0|2,0,0]=4 9070 B7R1.1 NC[C@@H]1CCOC1 Amb31204704 [1,0,0,1,0,0|2,0,0]=4 9071 B7R1.1 NC[C@H]1CCCN1 Amb2699509 [1,0,0,1,0,0|2,0,0]=4 9072 B7R1.1 NC[C@H]1CCCN1 Amb30584681 [1,0,0,1,0,0|2,0,0]=4 9073 B7R1.1 NC[C@H]1CCCO1 Amb33859030 [1,0,0,1,0,0|1,0,1]=4 9074 B7R1.1 NC[C@H]1CCCO1 Amb3940188 [1,0,0,1,0,0|1,0,1]=4 9075 B7R1.1 NC[C@H]1CCNC1 Amb25079280 [1,0,0,1,0,0|2,0,0]=4 9076 B7R1.1 NC[C@H]1CCOC1 Amb23439065 [1,0,0,1,0,0|2,0,0]=4 9077 B7R1.1 NC[C@H]1CCOC1 Amb23439174 [1,0,0,1,0,0|2,0,0]=4 9078 B7R1.1 NNC1CCCC1 Amb10071294 [1,0,0,1,0,0|2,0,0]=4 9079 B7R1.1 NNC1CCCC1 Amb2785873 [1,0,0,1,0,0|2,0,0]=4 9080 B7R1.1 NNC1CCCC1 Amb8371028 [1,0,0,1,0,0|2,0,0]=4 9081 B7R1.1 NOC1CCCC1 Amb17101093 [1,0,0,1,0,0|2,0,0]=4 9082 B7R1.1 O=C=C1CCCC1 Amb17673796 [1,0,0,1,0,0|0,0,2]=4 9083 B7R1.1 O=CC1=CCCC1 Amb17138358 [1,0,0,1,0,0|0,0,2]=4 9084 B7R1.1 O=CC1C=CCC1 Amb27229924 [1,0,0,1,0,0|0,0,2]=4 9085 B7R1.1 O=CC1CC=CC1 Amb18638871 [1,0,0,1,0,0|0,0,2]=4 9086 B7R1.1 O=CC1CCCC1 Amb31292855 [1,0,0,1,0,0|0,0,0]=2 9087 B7R1.1 O=CC1CCCC1 Amb4605847 [1,0,0,1,0,0|0,0,0]=2 9088 B7R1.1 O=CC1CCCC1 Amb6297186 [1,0,0,1,0,0|0,0,0]=2 9089 B7R1.1 O=CC1CCCO1 Amb3939388 [1,0,0,1,0,0|1,0,0]=3 9090 B7R1.1 O=CC1CCCS1 Amb27214645 [1,0,0,1,0,0|1,0,0]=3 9091 B7R1.1 O=CC1CCNC1 Amb18197564 [1,0,0,1,0,0|1,0,0]=3 9092 B7R1.1 O=CC1CCOC1 Amb6608994 [1,0,0,1,0,0|1,0,0]=3 9093 B7R1.1 O=CC1CCSC1 Amb18199140 [1,0,0,1,0,0|1,0,0]=3 9094 B7R1.1 O=CC1OCCO1 Amb27592967 [1,0,0,1,0,0|2,0,0]=4 9095 B7R1.1 O=CN1CCCC1 Amb2720947 [1,0,0,1,0,0|1,0,0]=3 9096 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [1,0,0,1,0,0|1,0,0]=3 9097 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [1,0,0,1,0,0|1,0,0]=3 9098 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [1,0,0,1,0,0|1,0,0]=3 9099 B7R1.1 O=NC1CCCN1 Amb27488681 [1,0,0,1,0,0|2,0,0]=4 9100 B7R1.1 O=NN1CCCC1 Amb9787681 [1,0,0,1,0,0|2,0,0]=4 9101 B7R1.1 OCC1=CCCC1 Amb24479891 [1,0,0,1,0,0|1,0,1]=4 9102 B7R1.1 OCC1C=CCC1 Amb23455253 [1,0,0,1,0,0|1,0,1]=4 9103 B7R1.1 OCC1CCCC1 Amb2721271 [1,0,0,1,0,0|0,0,1]=3 9104 B7R1.1 OCC1CCCN1 Amb2237182 [1,0,0,1,0,0|1,0,1]=4 9105 B7R1.1 OCC1CCCO1 Amb3939084 [1,0,0,1,0,0|1,0,1]=4 9106 B7R1.1 OCC1CCCS1 Amb33545363 [1,0,0,1,0,0|1,0,1]=4 9107 B7R1.1 OCC1CCNC1 Amb20240954 [1,0,0,1,0,0|1,0,1]=4 9108 B7R1.1 OCC1CCNC1 Amb21858960 [1,0,0,1,0,0|1,0,1]=4 9109 B7R1.1 OCC1CCNC1 Amb9782649 [1,0,0,1,0,0|1,0,1]=4 9110 B7R1.1 OCC1CCOC1 Amb9748290 [1,0,0,1,0,0|1,0,1]=4 9111 B7R1.1 OCC1CCSC1 Amb18203349 [1,0,0,1,0,0|1,0,1]=4 9112 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [1,0,0,1,0,0|1,0,1]=4 9113 B7R1.1 OC[C@@H]1CCCN1 Amb3938965 [1,0,0,1,0,0|1,0,1]=4 9114 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [1,0,0,1,0,0|1,0,1]=4 9115 B7R1.1 OC[C@@H]1CCNC1 Amb34916128 [1,0,0,1,0,0|1,0,1]=4 9116 B7R1.1 OC[C@@H]1CCNC1 Amb6893877 [1,0,0,1,0,0|1,0,1]=4 9117 B7R1.1 OC[C@@H]1CCNC1 Amb8630261 [1,0,0,1,0,0|1,0,1]=4 9118 B7R1.1 OC[C@@H]1CCOC1 Amb28189753 [1,0,0,1,0,0|1,0,1]=4 9119 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [1,0,0,1,0,0|1,0,1]=4 9120 B7R1.1 OC[C@H]1CCCN1 Amb30874072 [1,0,0,1,0,0|1,0,1]=4 9121 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [1,0,0,1,0,0|1,0,1]=4 9122 B7R1.1 OC[C@H]1CCNC1 Amb10067155 [1,0,0,1,0,0|1,0,1]=4 9123 B7R1.1 OC[C@H]1CCNC1 Amb6893876 [1,0,0,1,0,0|1,0,1]=4 9124 B7R1.1 OC[C@H]1CCOC1 Amb22746669 [1,0,0,1,0,0|1,0,1]=4 9125 B7R1.1 ONC1CCCC1 Amb27467457 [1,0,0,1,0,0|1,0,1]=4 9126 B7R1.1 ONC1CCCC1 Amb30625652 [1,0,0,1,0,0|1,0,1]=4 9127 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|0,1,0]=3 9128 B7R1.1 SCC1CCCN1 Amb25874415 [1,0,0,1,0,0|1,1,0]=4 9129 B7R1.1 SCC1CCCN1 Amb35752888 [1,0,0,1,0,0|1,1,0]=4 9130 B7R1.1 SCC1CCCO1 Amb33531279 [1,0,0,1,0,0|1,0,1]=4 9131 B7R1.1 SCC1CCCS1 Amb33416783 [1,0,0,1,0,0|1,1,0]=4 9132 B7R1.1 SCC1CCOC1 Amb26919281 [1,0,0,1,0,0|1,1,0]=4 9133 B7R1.1 SCC1CCSC1 Amb32788496 [1,0,0,1,0,0|1,1,0]=4 9134 B7R1.1 SC[C@H]1CCCN1 Amb29854514 [1,0,0,1,0,0|1,1,0]=4 9135 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [1,0,0,1,0,0|1,0,1]=4 9136 B7R1.3 BrC1=CCCCC1 Amb21856761 [1,0,0,1,0,0|1,0,1]=4 9137 B7R1.3 BrC1C=CCCC1 Amb2720845 [1,0,0,1,0,0|1,0,1]=4 9138 B7R1.3 BrC1C=NCCC1 Amb24322652 [1,0,0,1,0,0|2,0,0]=4 9139 B7R1.3 BrC1CCCCC1 Amb3940351 [1,0,0,1,0,0|1,0,0]=3 9140 B7R1.3 BrC1CCCCN1 Amb8629038 [1,0,0,1,0,0|2,0,0]=4 9141 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,1,0,0|1,0,1]=4 9142 B7R1.3 BrC1CCCNC1 Amb22497824 [1,0,0,1,0,0|2,0,0]=4 9143 B7R1.3 BrC1CCCNC1 Amb8629039 [1,0,0,1,0,0|2,0,0]=4 9144 B7R1.3 BrC1CCCOC1 Amb9173669 [1,0,0,1,0,0|2,0,0]=4 9145 B7R1.3 BrC1CCCSC1 Amb26545490 [1,0,0,1,0,0|2,0,0]=4 9146 B7R1.3 BrC1CCNCC1 Amb22229718 [1,0,0,1,0,0|2,0,0]=4 9147 B7R1.3 BrC1CCNCC1 Amb2778981 [1,0,0,1,0,0|2,0,0]=4 9148 B7R1.3 BrC1CCNCC1 Amb3941704 [1,0,0,1,0,0|2,0,0]=4 9149 B7R1.3 BrC1CCOCC1 Amb9472764 [1,0,0,1,0,0|2,0,0]=4 9150 B7R1.3 BrC1CCSCC1 Amb18181050 [1,0,0,1,0,0|2,0,0]=4 9151 B7R1.3 Br[C@H]1C=CCCC1 Amb27442441 [1,0,0,1,0,0|1,0,1]=4 9152 B7R1.3 C=C1CCCCC1 Amb8515603 [1,0,0,1,0,0|0,0,1]=3 9153 B7R1.3 C=C1CCCCN1 Amb27801038 [1,0,0,1,0,0|1,0,1]=4 9154 B7R1.3 C=C1CCCCO1 Amb28345156 [1,0,0,1,0,0|1,0,1]=4 9155 B7R1.3 C=C1CCCNC1 Amb19514641 [1,0,0,1,0,0|1,0,1]=4 9156 B7R1.3 C=C1CCCNC1 Amb22059305 [1,0,0,1,0,0|1,0,1]=4 9157 B7R1.3 C=C1CCCOC1 Amb27594580 [1,0,0,1,0,0|1,0,1]=4 9158 B7R1.3 C=C1CCCSC1 Amb22494848 [1,0,0,1,0,0|1,0,1]=4 9159 B7R1.3 C=C1CCNCC1 Amb19514763 [1,0,0,1,0,0|1,0,1]=4 9160 B7R1.3 C=C1CCNCC1 Amb24079604 [1,0,0,1,0,0|1,0,1]=4 9161 B7R1.3 C=C1CCNCC1 Amb33715165 [1,0,0,1,0,0|1,0,1]=4 9162 B7R1.3 C=C1CCOCC1 Amb22000865 [1,0,0,1,0,0|1,0,1]=4 9163 B7R1.3 CC1=CCCCC1 Amb8513524 [1,0,0,1,0,0|0,0,1]=3 9164 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|1,0,1]=4 9165 B7R1.3 CC1=CCCNC1 Amb23439963 [1,0,0,1,0,0|1,0,1]=4 9166 B7R1.3 CC1=CCCNC1 Amb25063349 [1,0,0,1,0,0|1,0,1]=4 9167 B7R1.3 CC1=CCNCC1 Amb18639053 [1,0,0,1,0,0|1,0,1]=4 9168 B7R1.3 CC1=CCNCC1 Amb21961140 [1,0,0,1,0,0|1,0,1]=4 9169 B7R1.3 CC1=CCOCC1 Amb24070517 [1,0,0,1,0,0|1,0,1]=4 9170 B7R1.3 CC1=NCCCC1 Amb27459940 [1,0,0,1,0,0|1,0,1]=4 9171 B7R1.3 CC1C=CCCC1 Amb8515346 [1,0,0,1,0,0|0,0,1]=3 9172 B7R1.3 CC1C=CCCN1 Amb27461298 [1,0,0,1,0,0|1,0,1]=4 9173 B7R1.3 CC1C=CCCO1 Amb33715160 [1,0,0,1,0,0|1,0,1]=4 9174 B7R1.3 CC1C=CCNC1 Amb27170704 [1,0,0,1,0,0|1,0,1]=4 9175 B7R1.3 CC1C=COCC1 Amb27985265 [1,0,0,1,0,0|1,0,1]=4 9176 B7R1.3 CC1CC=NCC1 Amb27453017 [1,0,0,1,0,0|2,0,0]=4 9177 B7R1.3 CC1CCCCN1 Amb2792828 [1,0,0,1,0,0|1,0,0]=3 9178 B7R1.3 CC1CCCCO1 Amb4035049 [1,0,0,1,0,0|0,0,1]=3 9179 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|0,1,0]=3 9180 B7R1.3 CC1CCCNC1 Amb22491688 [1,0,0,1,0,0|1,0,1]=4 9181 B7R1.3 CC1CCCNC1 Amb9703089 [1,0,0,1,0,0|1,0,1]=4 9182 B7R1.3 CC1CCCOC1 Amb22347806 [1,0,0,1,0,0|1,0,1]=4 9183 B7R1.3 CC1CCNCC1 Amb2689655 [1,0,0,1,0,0|1,0,1]=4 9184 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|1,0,1]=4 9185 B7R1.3 CC1CCOCN1 Amb32651825 [1,0,0,1,0,0|2,0,0]=4 9186 B7R1.3 CC1CCOCO1 Amb17776591 [1,0,0,1,0,0|1,0,1]=4 9187 B7R1.3 CC1CCSCC1 Amb27436849 [1,0,0,1,0,0|1,0,1]=4 9188 B7R1.3 CC1CNCCN1 Amb32666272 [1,0,0,1,0,0|2,0,0]=4 9189 B7R1.3 CC1CNCCN1 Amb9702774 [1,0,0,1,0,0|2,0,0]=4 9190 B7R1.3 CC1CNCCO1 Amb20621613 [1,0,0,1,0,0|1,0,1]=4 9191 B7R1.3 CC1CNCCO1 Amb32666325 [1,0,0,1,0,0|1,0,1]=4 9192 B7R1.3 CC1CNCCO1 Amb9703073 [1,0,0,1,0,0|1,0,1]=4 9193 B7R1.3 CC1CNCCS1 Amb32753223 [1,0,0,1,0,0|1,1,0]=4 9194 B7R1.3 CC1CNCCS1 Amb6683465 [1,0,0,1,0,0|1,1,0]=4 9195 B7R1.3 CC1COCCN1 Amb22728071 [1,0,0,1,0,0|2,0,0]=4 9196 B7R1.3 CC1COCCN1 Amb6740293 [1,0,0,1,0,0|2,0,0]=4 9197 B7R1.3 CC1CSCCN1 Amb9735876 [1,0,0,1,0,0|2,0,0]=4 9198 B7R1.3 CC1NCCCN1 Amb24381838 [1,0,0,1,0,0|2,0,0]=4 9199 B7R1.3 CC1NCCCO1 Amb17506191 [1,0,0,1,0,0|1,0,1]=4 9200 B7R1.3 CC1OCCCO1 Amb26557606 [1,0,0,1,0,0|1,0,1]=4 9201 B7R1.3 CC1SCCCS1 Amb10071965 [1,0,0,1,0,0|1,1,0]=4 9202 B7R1.3 CN1C=NCCC1 Amb30010877 [1,0,0,1,0,0|2,0,0]=4 9203 B7R1.3 CN1CCCCC1 Amb8387007 [1,0,0,1,0,0|1,0,1]=4 9204 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|1,0,0]=3 9205 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [1,0,0,1,0,0|1,0,0]=3 9206 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [1,0,0,1,0,0|1,0,1]=4 9207 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [1,0,0,1,0,0|1,0,1]=4 9208 B7R1.3 C[C@@H]1CNCCN1 Amb23399598 [1,0,0,1,0,0|2,0,0]=4 9209 B7R1.3 C[C@@H]1CNCCN1 Amb33716484 [1,0,0,1,0,0|2,0,0]=4 9210 B7R1.3 C[C@@H]1CNCCN1 Amb8396882 [1,0,0,1,0,0|2,0,0]=4 9211 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [1,0,0,1,0,0|1,0,1]=4 9212 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [1,0,0,1,0,0|1,0,1]=4 9213 B7R1.3 C[C@@H]1CNCCS1 Amb28423156 [1,0,0,1,0,0|1,1,0]=4 9214 B7R1.3 C[C@@H]1CNCCS1 Amb32671471 [1,0,0,1,0,0|1,1,0]=4 9215 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [1,0,0,1,0,0|2,0,0]=4 9216 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [1,0,0,1,0,0|2,0,0]=4 9217 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [1,0,0,1,0,0|2,0,0]=4 9218 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [1,0,0,1,0,0|1,0,0]=3 9219 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [1,0,0,1,0,0|1,0,1]=4 9220 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [1,0,0,1,0,0|1,0,1]=4 9221 B7R1.3 C[C@H]1CNCCN1 Amb6306665 [1,0,0,1,0,0|2,0,0]=4 9222 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [1,0,0,1,0,0|1,0,1]=4 9223 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [1,0,0,1,0,0|1,0,1]=4 9224 B7R1.3 C[C@H]1CNCCO1 Amb32661569 [1,0,0,1,0,0|1,0,1]=4 9225 B7R1.3 C[C@H]1CNCCO1 Amb34916143 [1,0,0,1,0,0|1,0,1]=4 9226 B7R1.3 C[C@H]1COCCN1 Amb10066947 [1,0,0,1,0,0|2,0,0]=4 9227 B7R1.3 C[C@H]1COCCN1 Amb19516190 [1,0,0,1,0,0|2,0,0]=4 9228 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [1,0,0,1,0,0|2,0,0]=4 9229 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [1,0,0,1,0,0|0,1,1]=4 9230 B7R1.3 ClC1=CCCCC1 Amb9785147 [1,0,0,1,0,0|1,0,1]=4 9231 B7R1.3 ClC1C=CCCC1 Amb22229267 [1,0,0,1,0,0|1,0,1]=4 9232 B7R1.3 ClC1CCCCC1 Amb3940352 [1,0,0,1,0,0|1,0,0]=3 9233 B7R1.3 ClC1CCCCN1 Amb20242688 [1,0,0,1,0,0|2,0,0]=4 9234 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,1,0,0|1,0,1]=4 9235 B7R1.3 ClC1CCCCS1 Amb28123985 [1,0,0,1,0,0|1,1,0]=4 9236 B7R1.3 ClC1CCCOC1 Amb20622589 [1,0,0,1,0,0|2,0,0]=4 9237 B7R1.3 ClC1CCNCC1 Amb8009567 [1,0,0,1,0,0|2,0,0]=4 9238 B7R1.3 ClC1CCNCC1 Amb8629021 [1,0,0,1,0,0|2,0,0]=4 9239 B7R1.3 ClC1CCOCC1 Amb6760778 [1,0,0,1,0,0|2,0,0]=4 9240 B7R1.3 ClN1CCCCC1 Amb25950915 [1,0,0,1,0,0|2,0,0]=4 9241 B7R1.3 FC1C=CCCC1 Amb27164038 [1,0,0,1,0,0|1,0,1]=4 9242 B7R1.3 FC1CCCCC1 Amb2688084 [1,0,0,1,0,0|1,0,0]=3 9243 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,1,0,0|1,0,1]=4 9244 B7R1.3 FC1CCCNC1 Amb13953137 [1,0,0,1,0,0|2,0,0]=4 9245 B7R1.3 FC1CCCNC1 Amb2688404 [1,0,0,1,0,0|2,0,0]=4 9246 B7R1.3 FC1CCCOC1 Amb24322825 [1,0,0,1,0,0|2,0,0]=4 9247 B7R1.3 FC1CCC[NH2+]C1 Amb22042691 [1,0,0,1,0,0|2,0,0]=4 9248 B7R1.3 FC1CCNCC1 Amb13885425 [1,0,0,1,0,0|2,0,0]=4 9249 B7R1.3 FC1CCNCC1 Amb2688405 [1,0,0,1,0,0|2,0,0]=4 9250 B7R1.3 FC1CCOCC1 Amb22296909 [1,0,0,1,0,0|2,0,0]=4 9251 B7R1.3 F[C@@H]1CCCNC1 Amb20242276 [1,0,0,1,0,0|2,0,0]=4 9252 B7R1.3 F[C@@H]1CCCNC1 Amb27619341 [1,0,0,1,0,0|2,0,0]=4 9253 B7R1.3 F[C@H]1CCCNC1 Amb20242275 [1,0,0,1,0,0|2,0,0]=4 9254 B7R1.3 IC1=CCCCC1 Amb27750996 [1,0,0,1,0,0|1,0,1]=4 9255 B7R1.3 IC1CCCCC1 Amb6608670 [1,0,0,1,0,0|1,0,0]=3 9256 B7R1.3 IC1CCCNC1 Amb22496356 [1,0,0,1,0,0|2,0,0]=4 9257 B7R1.3 IC1CCCOC1 Amb22831295 [1,0,0,1,0,0|2,0,0]=4 9258 B7R1.3 IC1CCOCC1 Amb2723453 [1,0,0,1,0,0|2,0,0]=4 9259 B7R1.3 IC1CCSCC1 Amb2724105 [1,0,0,1,0,0|2,0,0]=4 9260 B7R1.3 N=C1CCCCC1 Amb26924126 [1,0,0,1,0,0|1,0,0]=3 9261 B7R1.3 N=C1CCCCN1 Amb17616049 [1,0,0,1,0,0|2,0,0]=4 9262 B7R1.3 N=C1CCCCN1 Amb2780013 [1,0,0,1,0,0|2,0,0]=4 9263 B7R1.3 NC1=CCCCC1 Amb28456773 [1,0,0,1,0,0|1,0,1]=4 9264 B7R1.3 NC1=NCCCC1 Amb3997189 [1,0,0,1,0,0|2,0,0]=4 9265 B7R1.3 NC1C=CCCC1 Amb20668839 [1,0,0,1,0,0|1,0,1]=4 9266 B7R1.3 NC1C=CCCC1 Amb23385297 [1,0,0,1,0,0|1,0,1]=4 9267 B7R1.3 NC1CCCCC1 Amb2792843 [1,0,0,1,0,0|1,0,0]=3 9268 B7R1.3 NC1CCCCC1 Amb4035820 [1,0,0,1,0,0|1,0,0]=3 9269 B7R1.3 NC1CCCCC1 Amb6366094 [1,0,0,1,0,0|1,0,0]=3 9270 B7R1.3 NC1CCCCN1 Amb16233706 [1,0,0,1,0,0|2,0,0]=4 9271 B7R1.3 NC1CCCCS1 Amb28052869 [1,0,0,1,0,0|1,1,0]=4 9272 B7R1.3 NC1CCCNC1 Amb2694718 [1,0,0,1,0,0|2,0,0]=4 9273 B7R1.3 NC1CCCNC1 Amb2720311 [1,0,0,1,0,0|2,0,0]=4 9274 B7R1.3 NC1CCCNC1 Amb8385620 [1,0,0,1,0,0|2,0,0]=4 9275 B7R1.3 NC1CCCOC1 Amb1091859 [1,0,0,1,0,0|2,0,0]=4 9276 B7R1.3 NC1CCCOC1 Amb19889218 [1,0,0,1,0,0|2,0,0]=4 9277 B7R1.3 NC1CCCSC1 Amb13953228 [1,0,0,1,0,0|2,0,0]=4 9278 B7R1.3 NC1CCCSC1 Amb32660970 [1,0,0,1,0,0|2,0,0]=4 9279 B7R1.3 NC1CCNCC1 Amb17943826 [1,0,0,1,0,0|2,0,0]=4 9280 B7R1.3 NC1CCNCC1 Amb6270512 [1,0,0,1,0,0|2,0,0]=4 9281 B7R1.3 NC1CCOCC1 Amb1102242 [1,0,0,1,0,0|2,0,0]=4 9282 B7R1.3 NC1CCOCC1 Amb8503255 [1,0,0,1,0,0|2,0,0]=4 9283 B7R1.3 NC1CCSCC1 Amb13952147 [1,0,0,1,0,0|2,0,0]=4 9284 B7R1.3 NC1CCSCC1 Amb2724106 [1,0,0,1,0,0|2,0,0]=4 9285 B7R1.3 NN1CCCCC1 Amb535734 [1,0,0,1,0,0|2,0,0]=4 9286 B7R1.3 NN1CCCCC1 Amb6892706 [1,0,0,1,0,0|2,0,0]=4 9287 B7R1.3 N[C@@H]1C=CCCC1 Amb24640515 [1,0,0,1,0,0|1,0,1]=4 9288 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [1,0,0,1,0,0|2,0,0]=4 9289 B7R1.3 N[C@@H]1CCCNC1 Amb2695443 [1,0,0,1,0,0|2,0,0]=4 9290 B7R1.3 N[C@@H]1CCCOC1 Amb19516292 [1,0,0,1,0,0|2,0,0]=4 9291 B7R1.3 N[C@@H]1CCCOC1 Amb20241267 [1,0,0,1,0,0|2,0,0]=4 9292 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [1,0,0,1,0,0|1,0,1]=4 9293 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [1,0,0,1,0,0|2,0,0]=4 9294 B7R1.3 N[C@H]1CCCNC1 Amb2695444 [1,0,0,1,0,0|2,0,0]=4 9295 B7R1.3 N[C@H]1CCCOC1 Amb19516313 [1,0,0,1,0,0|2,0,0]=4 9296 B7R1.3 N[C@H]1CCCOC1 Amb20241266 [1,0,0,1,0,0|2,0,0]=4 9297 B7R1.3 N[C@H]1CCCOC1 Amb34916114 [1,0,0,1,0,0|2,0,0]=4 9298 B7R1.3 O=C1C=CCCC1 Amb17843126 [1,0,0,1,0,0|0,0,2]=4 9299 B7R1.3 O=C1CCCCC1 Amb2793026 [1,0,0,1,0,0|0,0,0]=2 9300 B7R1.3 O=C1CCCCN1 Amb6892006 [1,0,0,1,0,0|1,0,0]=3 9301 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|1,0,0]=3 9302 B7R1.3 O=C1CCCCS1 Amb25186924 [1,0,0,1,0,0|1,0,0]=3 9303 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,1,0,0|1,0,0]=3 9304 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,1,0,0|1,0,0]=3 9305 B7R1.3 O=C1CCCNC1 Amb19958010 [1,0,0,1,0,0|1,0,0]=3 9306 B7R1.3 O=C1CCCNN1 Amb18061622 [1,0,0,1,0,0|2,0,0]=4 9307 B7R1.3 O=C1CCCOC1 Amb19373430 [1,0,0,1,0,0|1,0,0]=3 9308 B7R1.3 O=C1CCCON1 Amb26560803 [1,0,0,1,0,0|2,0,0]=4 9309 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,1,0,0|1,0,0]=3 9310 B7R1.3 O=C1CCNCC1 Amb2690392 [1,0,0,1,0,0|1,0,0]=3 9311 B7R1.3 O=C1CCNCC1 Amb2793002 [1,0,0,1,0,0|1,0,0]=3 9312 B7R1.3 O=C1CCNCC1 Amb8394939 [1,0,0,1,0,0|1,0,0]=3 9313 B7R1.3 O=C1CCNCN1 Amb27458283 [1,0,0,1,0,0|2,0,0]=4 9314 B7R1.3 O=C1CCOCC1 Amb2725565 [1,0,0,1,0,0|1,0,0]=3 9315 B7R1.3 O=C1CCSCC1 Amb1154265 [1,0,0,1,0,0|1,0,0]=3 9316 B7R1.3 O=C1CNCCN1 Amb4138465 [1,0,0,1,0,0|2,0,0]=4 9317 B7R1.3 O=C1CNCCN1 Amb6334808 [1,0,0,1,0,0|2,0,0]=4 9318 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|2,0,0]=4 9319 B7R1.3 O=C1CNCCO1 Amb32410210 [1,0,0,1,0,0|2,0,0]=4 9320 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|2,0,0]=4 9321 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|2,0,0]=4 9322 B7R1.3 O=C1CSCCN1 Amb674722 [1,0,0,1,0,0|2,0,0]=4 9323 B7R1.3 O=C1CSCCO1 Amb28069740 [1,0,0,1,0,0|2,0,0]=4 9324 B7R1.3 O=C1CSCCS1 Amb24539369 [1,0,0,1,0,0|2,0,0]=4 9325 B7R1.3 O=C1CSCSC1 Amb19148039 [1,0,0,1,0,0|2,0,0]=4 9326 B7R1.3 O=C1NCCCN1 Amb4034594 [1,0,0,1,0,0|2,0,0]=4 9327 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|2,0,0]=4 9328 B7R1.3 O=C1NCCCS1 Amb24117134 [1,0,0,1,0,0|2,0,0]=4 9329 B7R1.3 O=C1OCCCO1 Amb4034896 [1,0,0,1,0,0|2,0,0]=4 9330 B7R1.3 O=S1CCCNC1 Amb27195521 [1,0,0,1,0,0|2,0,0]=4 9331 B7R1.3 O=S1CCNCC1 Amb18943760 [1,0,0,1,0,0|2,0,0]=4 9332 B7R1.3 O=S1CCNCC1 Amb6307179 [1,0,0,1,0,0|2,0,0]=4 9333 B7R1.3 O=S1CCOCC1 Amb26535052 [1,0,0,1,0,0|2,0,0]=4 9334 B7R1.3 O=S1CCSCC1 Amb25679286 [1,0,0,1,0,0|2,0,0]=4 9335 B7R1.3 OC1C=CCCC1 Amb4605824 [1,0,0,1,0,0|1,0,1]=4 9336 B7R1.3 OC1CCCCC1 Amb4605832 [1,0,0,1,0,0|0,0,1]=3 9337 B7R1.3 OC1CCCCN1 Amb8393085 [1,0,0,1,0,0|1,0,1]=4 9338 B7R1.3 OC1CCCCO1 Amb8517292 [1,0,0,1,0,0|1,0,1]=4 9339 B7R1.3 OC1CCCNC1 Amb3939221 [1,0,0,1,0,0|1,0,1]=4 9340 B7R1.3 OC1CCCNC1 Amb4036802 [1,0,0,1,0,0|1,0,1]=4 9341 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|1,0,1]=4 9342 B7R1.3 OC1CCCSC1 Amb4034626 [1,0,0,1,0,0|1,0,1]=4 9343 B7R1.3 OC1CCNCC1 Amb1152974 [1,0,0,1,0,0|1,0,1]=4 9344 B7R1.3 OC1CCNCC1 Amb2720309 [1,0,0,1,0,0|1,0,1]=4 9345 B7R1.3 OC1CCNCC1 Amb32679563 [1,0,0,1,0,0|1,0,1]=4 9346 B7R1.3 OC1CCOCC1 Amb2723454 [1,0,0,1,0,0|1,0,1]=4 9347 B7R1.3 OC1CCSCC1 Amb2610612 [1,0,0,1,0,0|1,0,1]=4 9348 B7R1.3 ON1CCCCC1 Amb6468702 [1,0,0,1,0,0|1,0,1]=4 9349 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [1,0,0,1,0,0|1,0,1]=4 9350 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [1,0,0,1,0,0|1,0,1]=4 9351 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|1,0,1]=4 9352 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [1,0,0,1,0,0|1,0,1]=4 9353 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [1,0,0,1,0,0|1,0,1]=4 9354 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [1,0,0,1,0,0|1,0,1]=4 9355 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [1,0,0,1,0,0|1,0,1]=4 9356 B7R1.3 S=C1CCCCN1 Amb5720520 [1,0,0,1,0,0|1,1,0]=4 9357 B7R1.3 S=C1CCNCC1 Amb27232690 [1,0,0,1,0,0|1,1,0]=4 9358 B7R1.3 SC1CCCCC1 Amb6608750 [1,0,0,1,0,0|0,1,0]=3 9359 B7R1.3 SC1CCCCN1 Amb27639704 [1,0,0,1,0,0|1,1,0]=4 9360 B7R1.3 SC1CCCNC1 Amb22371077 [1,0,0,1,0,0|1,1,0]=4 9361 B7R1.3 SC1CCCNC1 Amb27453630 [1,0,0,1,0,0|1,1,0]=4 9362 B7R1.3 SC1CCCOC1 Amb24066221 [1,0,0,1,0,0|1,1,0]=4 9363 B7R1.3 SC1CCCSC1 Amb27480711 [1,0,0,1,0,0|1,1,0]=4 9364 B7R1.3 SC1CCNCC1 Amb17502200 [1,0,0,1,0,0|1,1,0]=4 9365 B7R1.3 SC1CCNCC1 Amb22371055 [1,0,0,1,0,0|1,1,0]=4 9366 B7R1.3 SC1CCOCC1 Amb9472951 [1,0,0,1,0,0|1,1,0]=4 9367 B7R1.3 SC1CCSCC1 Amb26045860 [1,0,0,1,0,0|1,1,0]=4 9368 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|1,0,0]=3 9369 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [1,0,0,1,0,0|2,0,0]=4 9370 B7R1.4 BrC1CCCC1Br Amb9787330 [1,0,0,1,0,0|2,0,0]=4 9371 B7R1.4 Br[C@@H]1CCC[C@H]1Br Amb26627934 [1,0,0,1,0,0|2,0,0]=4 9372 B7R1.4 C=C1CCCC1=O Amb17593061 [1,0,0,1,0,0|0,0,2]=4 9373 B7R1.4 C=C1CNCC1C Amb28197991 [1,0,0,1,0,0|1,0,1]=4 9374 B7R1.4 CC1=C(Br)CCC1 Amb24479762 [1,0,0,1,0,0|1,0,1]=4 9375 B7R1.4 CC1=C(C)CCC1 Amb22227705 [1,0,0,1,0,0|1,0,1]=4 9376 B7R1.4 CC1=CCCC1=O Amb8514958 [1,0,0,1,0,0|0,0,2]=4 9377 B7R1.4 CC1=CCCC1C Amb24479857 [1,0,0,1,0,0|1,0,1]=4 9378 B7R1.4 CC1CCCC1=O Amb8514830 [1,0,0,1,0,0|0,0,0]=2 9379 B7R1.4 CC1CCCC1=S Amb27483022 [1,0,0,1,0,0|0,1,0]=3 9380 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|1,0,0]=3 9381 B7R1.4 CC1CCCC1C Amb4019559 [1,0,0,1,0,0|0,0,1]=3 9382 B7R1.4 CC1CCCC1Cl Amb27853965 [1,0,0,1,0,0|1,0,0]=3 9383 B7R1.4 CC1CCCC1N Amb33548666 [1,0,0,1,0,0|1,0,0]=3 9384 B7R1.4 CC1CCCC1N Amb9776219 [1,0,0,1,0,0|1,0,0]=3 9385 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|0,0,1]=3 9386 B7R1.4 CC1CCCC1S Amb26021537 [1,0,0,1,0,0|0,1,0]=3 9387 B7R1.4 CC1CCCN1N Amb25068361 [1,0,0,1,0,0|2,0,0]=4 9388 B7R1.4 CC1CCNC1=O Amb10603701 [1,0,0,1,0,0|1,0,0]=3 9389 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,1]=4 9390 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,1]=4 9391 B7R1.4 CC1CCOC1=O Amb16185414 [1,0,0,1,0,0|1,0,0]=3 9392 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|1,0,1]=4 9393 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|1,0,1]=4 9394 B7R1.4 CC1CNCC1F Amb27595797 [1,0,0,1,0,0|2,0,0]=4 9395 B7R1.4 CC1CNCC1N Amb24070522 [1,0,0,1,0,0|2,0,0]=4 9396 B7R1.4 CC1CNCC1N Amb32682475 [1,0,0,1,0,0|2,0,0]=4 9397 B7R1.4 CC1CNCC1O Amb22886911 [1,0,0,1,0,0|1,0,1]=4 9398 B7R1.4 CC1CNCC1O Amb25792196 [1,0,0,1,0,0|1,0,1]=4 9399 B7R1.4 CC1CNNC1=O Amb27228083 [1,0,0,1,0,0|2,0,0]=4 9400 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|1,0,0]=3 9401 B7R1.4 CC1COCC1Br Amb35736874 [1,0,0,1,0,0|2,0,0]=4 9402 B7R1.4 CC1COCC1Cl Amb35631934 [1,0,0,1,0,0|2,0,0]=4 9403 B7R1.4 CC1COCC1N Amb26929448 [1,0,0,1,0,0|2,0,0]=4 9404 B7R1.4 CC1COCC1O Amb26864629 [1,0,0,1,0,0|1,0,1]=4 9405 B7R1.4 CC1COCC1S Amb32788669 [1,0,0,1,0,0|1,1,0]=4 9406 B7R1.4 CC1CONC1=O Amb33714888 [1,0,0,1,0,0|2,0,0]=4 9407 B7R1.4 CC1CSCC1=O Amb21964769 [1,0,0,1,0,0|1,0,0]=3 9408 B7R1.4 CC1CSCC1Br Amb27252722 [1,0,0,1,0,0|2,0,0]=4 9409 B7R1.4 CC1CSCC1N Amb18202602 [1,0,0,1,0,0|2,0,0]=4 9410 B7R1.4 CC1CSCC1S Amb24386420 [1,0,0,1,0,0|1,1,0]=4 9411 B7R1.4 CC1NCCC1=O Amb26950680 [1,0,0,1,0,0|1,0,0]=3 9412 B7R1.4 CC1NCCC1=O Amb32410228 [1,0,0,1,0,0|1,0,0]=3 9413 B7R1.4 CC1NCCC1O Amb27838277 [1,0,0,1,0,0|1,0,1]=4 9414 B7R1.4 CC1NCCC1O Amb32882554 [1,0,0,1,0,0|1,0,1]=4 9415 B7R1.4 CC1OCCC1=O Amb2725497 [1,0,0,1,0,0|1,0,0]=3 9416 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,1,0,0|2,0,0]=4 9417 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,1,0,0|2,0,0]=4 9418 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|2,0,0]=4 9419 B7R1.4 CC1OCCC1N Amb32660981 [1,0,0,1,0,0|2,0,0]=4 9420 B7R1.4 CC1OCCC1O Amb25888399 [1,0,0,1,0,0|1,0,1]=4 9421 B7R1.4 CC1OCCC1S Amb8515792 [1,0,0,1,0,0|1,1,0]=4 9422 B7R1.4 CC1OCNC1=O Amb28046854 [1,0,0,1,0,0|2,0,0]=4 9423 B7R1.4 CC1SCCC1=O Amb8392845 [1,0,0,1,0,0|1,0,0]=3 9424 B7R1.4 CC1SCCC1=S Amb27792245 [1,0,0,1,0,0|1,1,0]=4 9425 B7R1.4 CC1SCCC1Cl Amb28144167 [1,0,0,1,0,0|2,0,0]=4 9426 B7R1.4 CC1SCCC1N Amb20623835 [1,0,0,1,0,0|2,0,0]=4 9427 B7R1.4 CC1SCCC1N Amb28827634 [1,0,0,1,0,0|2,0,0]=4 9428 B7R1.4 CC1SCCC1O Amb20623836 [1,0,0,1,0,0|1,0,1]=4 9429 B7R1.4 CC1SCCC1S Amb26335064 [1,0,0,1,0,0|1,1,0]=4 9430 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [1,0,0,1,0,0|1,0,1]=4 9431 B7R1.4 CC1SCC[C@H]1O Amb20623837 [1,0,0,1,0,0|1,0,1]=4 9432 B7R1.4 CC1SCNC1=O Amb27211661 [1,0,0,1,0,0|2,0,0]=4 9433 B7R1.4 CN1CCCC1=N Amb20669437 [1,0,0,1,0,0|2,0,0]=4 9434 B7R1.4 CN1CCCC1=O Amb22493780 [1,0,0,1,0,0|1,0,0]=3 9435 B7R1.4 CN1CCCC1=O Amb6608842 [1,0,0,1,0,0|1,0,0]=3 9436 B7R1.4 CN1CCCC1=S Amb10562641 [1,0,0,1,0,0|1,1,0]=4 9437 B7R1.4 CN1CCCC1N Amb27631265 [1,0,0,1,0,0|2,0,0]=4 9438 B7R1.4 CN1CCNC1=O Amb5718647 [1,0,0,1,0,0|2,0,0]=4 9439 B7R1.4 CN1CCOC1=O Amb22347786 [1,0,0,1,0,0|2,0,0]=4 9440 B7R1.4 CN1CNCC1=O Amb26582942 [1,0,0,1,0,0|2,0,0]=4 9441 B7R1.4 CN1CNCC1=O Amb28827643 [1,0,0,1,0,0|2,0,0]=4 9442 B7R1.4 CN1NCCC1=O Amb18559311 [1,0,0,1,0,0|2,0,0]=4 9443 B7R1.4 C[C@@H]1CCCN1N Amb26843100 [1,0,0,1,0,0|2,0,0]=4 9444 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|1,0,0]=3 9445 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|1,0,0]=3 9446 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|0,0,1]=3 9447 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|0,0,1]=3 9448 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [1,0,0,1,0,0|1,0,0]=3 9449 B7R1.4 C[C@@H]1CCC[C@H]1O Amb8513780 [1,0,0,1,0,0|0,0,1]=3 9450 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [1,0,0,1,0,0|1,0,0]=3 9451 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,1]=4 9452 B7R1.4 C[C@@H]1CCOC1O Amb28074771 [1,0,0,1,0,0|1,0,1]=4 9453 B7R1.4 C[C@@H]1CCO[C@H]1O Amb27857930 [1,0,0,1,0,0|1,0,1]=4 9454 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|1,0,1]=4 9455 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb22886189 [1,0,0,1,0,0|2,0,0]=4 9456 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb25947246 [1,0,0,1,0,0|2,0,0]=4 9457 B7R1.4 C[C@@H]1CNC[C@@H]1N Amb25988639 [1,0,0,1,0,0|2,0,0]=4 9458 B7R1.4 C[C@@H]1CNC[C@@H]1O Amb22886215 [1,0,0,1,0,0|1,0,1]=4 9459 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|1,0,1]=4 9460 B7R1.4 C[C@@H]1CNC[C@H]1O Amb22886846 [1,0,0,1,0,0|1,0,1]=4 9461 B7R1.4 C[C@@H]1CNC[C@H]1O Amb25110287 [1,0,0,1,0,0|1,0,1]=4 9462 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|1,0,1]=4 9463 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [1,0,0,1,0,0|2,0,0]=4 9464 B7R1.4 C[C@@H]1COC[C@H]1N Amb30869718 [1,0,0,1,0,0|2,0,0]=4 9465 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|1,0,1]=4 9466 B7R1.4 C[C@@H]1CSC[C@@H]1O Amb27422447 [1,0,0,1,0,0|1,0,1]=4 9467 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [1,0,0,1,0,0|1,0,0]=3 9468 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [1,0,0,1,0,0|2,0,0]=4 9469 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [1,0,0,1,0,0|1,0,1]=4 9470 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [1,0,0,1,0,0|1,0,1]=4 9471 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb32412686 [1,0,0,1,0,0|1,0,1]=4 9472 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [1,0,0,1,0,0|1,0,1]=4 9473 B7R1.4 C[C@@H]1NCC[C@H]1N Amb28250867 [1,0,0,1,0,0|2,0,0]=4 9474 B7R1.4 C[C@@H]1NCC[C@H]1O Amb26412930 [1,0,0,1,0,0|1,0,1]=4 9475 B7R1.4 C[C@@H]1NCC[C@H]1O Amb32412687 [1,0,0,1,0,0|1,0,1]=4 9476 B7R1.4 C[C@@H]1OCC[C@@H]1I Amb27962293 [1,0,0,1,0,0|2,0,0]=4 9477 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|2,0,0]=4 9478 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|2,0,0]=4 9479 B7R1.4 C[C@@H]1OCC[C@H]1I Amb27664288 [1,0,0,1,0,0|2,0,0]=4 9480 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [1,0,0,1,0,0|2,0,0]=4 9481 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [1,0,0,1,0,0|2,0,0]=4 9482 B7R1.4 C[C@@H]1SCC[C@@H]1O Amb28144028 [1,0,0,1,0,0|1,0,1]=4 9483 B7R1.4 C[C@@H]1SCC[C@H]1O Amb27853254 [1,0,0,1,0,0|1,0,1]=4 9484 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [1,0,0,1,0,0|0,0,0]=2 9485 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|0,0,1]=3 9486 B7R1.4 C[C@H]1CCC[C@@H]1O Amb10844719 [1,0,0,1,0,0|0,0,1]=3 9487 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [1,0,0,1,0,0|0,0,1]=3 9488 B7R1.4 C[C@H]1CCC[C@H]1I Amb28135188 [1,0,0,1,0,0|1,0,0]=3 9489 B7R1.4 C[C@H]1CCC[C@H]1O Amb26012367 [1,0,0,1,0,0|0,0,1]=3 9490 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [1,0,0,1,0,0|1,0,0]=3 9491 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [1,0,0,1,0,0|1,0,1]=4 9492 B7R1.4 C[C@H]1CCO[C@H]1Cl Amb27444980 [1,0,0,1,0,0|2,0,0]=4 9493 B7R1.4 C[C@H]1CCO[C@H]1O Amb27642053 [1,0,0,1,0,0|1,0,1]=4 9494 B7R1.4 C[C@H]1CNC[C@@H]1O Amb33805301 [1,0,0,1,0,0|1,0,1]=4 9495 B7R1.4 C[C@H]1CNC[C@H]1N Amb25174297 [1,0,0,1,0,0|2,0,0]=4 9496 B7R1.4 C[C@H]1CNC[C@H]1O Amb27203947 [1,0,0,1,0,0|1,0,1]=4 9497 B7R1.4 C[C@H]1CNC[C@H]1O Amb33871574 [1,0,0,1,0,0|1,0,1]=4 9498 B7R1.4 C[C@H]1COC[C@@H]1N Amb33805302 [1,0,0,1,0,0|2,0,0]=4 9499 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|1,0,1]=4 9500 B7R1.4 C[C@H]1COC[C@H]1N Amb27202968 [1,0,0,1,0,0|2,0,0]=4 9501 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [1,0,0,1,0,0|1,0,1]=4 9502 B7R1.4 C[C@H]1CSC[C@H]1N Amb27961505 [1,0,0,1,0,0|2,0,0]=4 9503 B7R1.4 C[C@H]1CSC[C@H]1O Amb27448475 [1,0,0,1,0,0|1,0,1]=4 9504 B7R1.4 C[C@H]1NCC[C@@H]1O Amb28322208 [1,0,0,1,0,0|1,0,1]=4 9505 B7R1.4 C[C@H]1OCC[C@@H]1O Amb28388631 [1,0,0,1,0,0|1,0,1]=4 9506 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|2,0,0]=4 9507 B7R1.4 C[C@H]1SCC[C@@H]1O Amb27441450 [1,0,0,1,0,0|1,0,1]=4 9508 B7R1.4 ClC1CCCC1Cl Amb9787196 [1,0,0,1,0,0|2,0,0]=4 9509 B7R1.4 Cl[C@@H]1CCC[C@@H]1Br Amb27658896 [1,0,0,1,0,0|2,0,0]=4 9510 B7R1.4 Cl[C@H]1CCC[C@@H]1Br Amb27227433 [1,0,0,1,0,0|2,0,0]=4 9511 B7R1.4 FC1CCCC1I Amb27236860 [1,0,0,1,0,0|2,0,0]=4 9512 B7R1.4 F[C@@H]1CCC[C@H]1I Amb27811995 [1,0,0,1,0,0|2,0,0]=4 9513 B7R1.4 NC1CCCC1=O Amb17939050 [1,0,0,1,0,0|1,0,0]=3 9514 B7R1.4 NC1CCCC1=O Amb28994832 [1,0,0,1,0,0|1,0,0]=3 9515 B7R1.4 NC1CCCC1Br Amb20667786 [1,0,0,1,0,0|2,0,0]=4 9516 B7R1.4 NC1CCCC1Br Amb24691577 [1,0,0,1,0,0|2,0,0]=4 9517 B7R1.4 NC1CCCC1Cl Amb3428719 [1,0,0,1,0,0|2,0,0]=4 9518 B7R1.4 NC1CCCC1Cl Amb4451124 [1,0,0,1,0,0|2,0,0]=4 9519 B7R1.4 NC1CCCC1F Amb23538754 [1,0,0,1,0,0|2,0,0]=4 9520 B7R1.4 NC1CCCC1F Amb32658048 [1,0,0,1,0,0|2,0,0]=4 9521 B7R1.4 NC1CCCC1N Amb18639642 [1,0,0,1,0,0|2,0,0]=4 9522 B7R1.4 NC1CCCC1N Amb31291256 [1,0,0,1,0,0|2,0,0]=4 9523 B7R1.4 NC1CCCC1O Amb13951342 [1,0,0,1,0,0|1,0,1]=4 9524 B7R1.4 NC1CCCC1O Amb8385206 [1,0,0,1,0,0|1,0,1]=4 9525 B7R1.4 NC1CCNC1=O Amb21955321 [1,0,0,1,0,0|2,0,0]=4 9526 B7R1.4 NC1CCNC1=O Amb6739903 [1,0,0,1,0,0|2,0,0]=4 9527 B7R1.4 NC1CCOC1=O Amb17614991 [1,0,0,1,0,0|2,0,0]=4 9528 B7R1.4 NC1CCOC1=O Amb6609049 [1,0,0,1,0,0|2,0,0]=4 9529 B7R1.4 NC1CCOC1=O Amb9761351 [1,0,0,1,0,0|2,0,0]=4 9530 B7R1.4 NC1CCSC1=O Amb1151877 [1,0,0,1,0,0|2,0,0]=4 9531 B7R1.4 NC1CCSC1=O Amb2720274 [1,0,0,1,0,0|2,0,0]=4 9532 B7R1.4 NC1COCC1=O Amb18202885 [1,0,0,1,0,0|2,0,0]=4 9533 B7R1.4 NC1COCC1=O Amb33328736 [1,0,0,1,0,0|2,0,0]=4 9534 B7R1.4 NC1CSCC1=O Amb18202693 [1,0,0,1,0,0|2,0,0]=4 9535 B7R1.4 NN1CCCC1=O Amb8496496 [1,0,0,1,0,0|2,0,0]=4 9536 B7R1.4 NN1CCCC1=O Amb9174227 [1,0,0,1,0,0|2,0,0]=4 9537 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650234 [1,0,0,1,0,0|2,0,0]=4 9538 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650235 [1,0,0,1,0,0|2,0,0]=4 9539 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb25174659 [1,0,0,1,0,0|2,0,0]=4 9540 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661555 [1,0,0,1,0,0|2,0,0]=4 9541 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661660 [1,0,0,1,0,0|2,0,0]=4 9542 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [1,0,0,1,0,0|1,0,1]=4 9543 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [1,0,0,1,0,0|1,0,1]=4 9544 B7R1.4 N[C@@H]1CCC[C@H]1Cl Amb27882439 [1,0,0,1,0,0|2,0,0]=4 9545 B7R1.4 N[C@@H]1CCC[C@H]1F Amb28429786 [1,0,0,1,0,0|2,0,0]=4 9546 B7R1.4 N[C@@H]1CCC[C@H]1F Amb31308557 [1,0,0,1,0,0|2,0,0]=4 9547 B7R1.4 N[C@@H]1CCC[C@H]1N Amb16231433 [1,0,0,1,0,0|2,0,0]=4 9548 B7R1.4 N[C@@H]1CCC[C@H]1N Amb22748826 [1,0,0,1,0,0|2,0,0]=4 9549 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [1,0,0,1,0,0|1,0,1]=4 9550 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [1,0,0,1,0,0|1,0,1]=4 9551 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [1,0,0,1,0,0|1,0,1]=4 9552 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [1,0,0,1,0,0|1,0,1]=4 9553 B7R1.4 N[C@@H]1CCC[C@H]1S Amb28345579 [1,0,0,1,0,0|1,1,0]=4 9554 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [1,0,0,1,0,0|2,0,0]=4 9555 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [1,0,0,1,0,0|2,0,0]=4 9556 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [1,0,0,1,0,0|2,0,0]=4 9557 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [1,0,0,1,0,0|2,0,0]=4 9558 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [1,0,0,1,0,0|2,0,0]=4 9559 B7R1.4 N[C@H]1CCC[C@@H]1Cl Amb27203393 [1,0,0,1,0,0|2,0,0]=4 9560 B7R1.4 N[C@H]1CCC[C@@H]1F Amb34916180 [1,0,0,1,0,0|2,0,0]=4 9561 B7R1.4 N[C@H]1CCC[C@@H]1N Amb16231434 [1,0,0,1,0,0|2,0,0]=4 9562 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [1,0,0,1,0,0|1,0,1]=4 9563 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [1,0,0,1,0,0|1,0,1]=4 9564 B7R1.4 N[C@H]1CCC[C@H]1F Amb27476530 [1,0,0,1,0,0|2,0,0]=4 9565 B7R1.4 N[C@H]1CCC[C@H]1F Amb34162936 [1,0,0,1,0,0|2,0,0]=4 9566 B7R1.4 N[C@H]1CCC[C@H]1N Amb28346940 [1,0,0,1,0,0|2,0,0]=4 9567 B7R1.4 N[C@H]1CCC[C@H]1N Amb30988009 [1,0,0,1,0,0|2,0,0]=4 9568 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [1,0,0,1,0,0|1,0,1]=4 9569 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [1,0,0,1,0,0|1,0,1]=4 9570 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [1,0,0,1,0,0|2,0,0]=4 9571 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [1,0,0,1,0,0|2,0,0]=4 9572 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [1,0,0,1,0,0|2,0,0]=4 9573 B7R1.4 N[C@H]1CCOC1=O Amb541960 [1,0,0,1,0,0|2,0,0]=4 9574 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [1,0,0,1,0,0|2,0,0]=4 9575 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [1,0,0,1,0,0|2,0,0]=4 9576 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [1,0,0,1,0,0|2,0,0]=4 9577 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [1,0,0,1,0,0|2,0,0]=4 9578 B7R1.4 O=C1CCCC1=O Amb24053064 [1,0,0,1,0,0|1,0,1]=4 9579 B7R1.4 O=C1CCCC1Br Amb16234114 [1,0,0,1,0,0|1,0,0]=3 9580 B7R1.4 O=C1CCCC1Cl Amb3939970 [1,0,0,1,0,0|1,0,0]=3 9581 B7R1.4 O=C1CCCC1F Amb28050533 [1,0,0,1,0,0|1,0,0]=3 9582 B7R1.4 O=C1CCCC1I Amb25756212 [1,0,0,1,0,0|1,0,0]=3 9583 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,0]=3 9584 B7R1.4 O=C1CCCC1S Amb27838260 [1,0,0,1,0,0|1,0,0]=3 9585 B7R1.4 O=C1CCCN1O Amb33484242 [1,0,0,1,0,0|2,0,0]=4 9586 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [1,0,0,1,0,0|1,0,0]=3 9587 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [1,0,0,1,0,0|1,0,0]=3 9588 B7R1.4 O=C1NCCC1Br Amb20623055 [1,0,0,1,0,0|2,0,0]=4 9589 B7R1.4 O=C1NCCC1Cl Amb28050511 [1,0,0,1,0,0|2,0,0]=4 9590 B7R1.4 O=C1NCCC1F Amb25838145 [1,0,0,1,0,0|2,0,0]=4 9591 B7R1.4 O=C1NCCC1O Amb10603089 [1,0,0,1,0,0|2,0,0]=4 9592 B7R1.4 O=C1NCCC1S Amb18202686 [1,0,0,1,0,0|2,0,0]=4 9593 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [1,0,0,1,0,0|2,0,0]=4 9594 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [1,0,0,1,0,0|2,0,0]=4 9595 B7R1.4 O=C1OCCC1Br Amb3940058 [1,0,0,1,0,0|2,0,0]=4 9596 B7R1.4 O=C1OCCC1F Amb27642041 [1,0,0,1,0,0|2,0,0]=4 9597 B7R1.4 O=C1OCCC1I Amb24418518 [1,0,0,1,0,0|2,0,0]=4 9598 B7R1.4 O=C1OCCC1O Amb5718058 [1,0,0,1,0,0|2,0,0]=4 9599 B7R1.4 O=C1OCCC1S Amb25146639 [1,0,0,1,0,0|2,0,0]=4 9600 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [1,0,0,1,0,0|2,0,0]=4 9601 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [1,0,0,1,0,0|2,0,0]=4 9602 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [1,0,0,1,0,0|2,0,0]=4 9603 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [1,0,0,1,0,0|2,0,0]=4 9604 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [1,0,0,1,0,0|2,0,0]=4 9605 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [1,0,0,1,0,0|2,0,0]=4 9606 B7R1.4 O=S1CCCC1Br Amb28046103 [1,0,0,1,0,0|2,0,0]=4 9607 B7R1.4 O=S1CCCC1Cl Amb27796334 [1,0,0,1,0,0|2,0,0]=4 9608 B7R1.4 OC1CCCC1Br Amb27201322 [1,0,0,1,0,0|1,0,1]=4 9609 B7R1.4 OC1CCCC1Cl Amb9787194 [1,0,0,1,0,0|1,0,1]=4 9610 B7R1.4 OC1CCCC1F Amb25746323 [1,0,0,1,0,0|1,0,1]=4 9611 B7R1.4 OC1CCCC1I Amb27478744 [1,0,0,1,0,0|1,0,1]=4 9612 B7R1.4 OC1CCCC1O Amb17935884 [1,0,0,1,0,0|1,0,1]=4 9613 B7R1.4 O[C@@H]1CCC[C@@H]1Br Amb24470331 [1,0,0,1,0,0|1,0,1]=4 9614 B7R1.4 O[C@@H]1CCC[C@@H]1F Amb34916184 [1,0,0,1,0,0|1,0,1]=4 9615 B7R1.4 O[C@@H]1CCC[C@H]1Br Amb26427919 [1,0,0,1,0,0|1,0,1]=4 9616 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb17938993 [1,0,0,1,0,0|1,0,1]=4 9617 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb30628647 [1,0,0,1,0,0|1,0,1]=4 9618 B7R1.4 O[C@@H]1CCC[C@H]1F Amb26891974 [1,0,0,1,0,0|1,0,1]=4 9619 B7R1.4 O[C@@H]1CCC[C@H]1O Amb33524011 [1,0,0,1,0,0|1,0,1]=4 9620 B7R1.4 O[C@H]1CCC[C@@H]1F Amb24612635 [1,0,0,1,0,0|1,0,1]=4 9621 B7R1.4 O[C@H]1CCC[C@@H]1I Amb27857258 [1,0,0,1,0,0|1,0,1]=4 9622 B7R1.4 O[C@H]1CCC[C@@H]1O Amb22350708 [1,0,0,1,0,0|1,0,1]=4 9623 B7R1.4 O[C@H]1CCC[C@H]1Br Amb8394047 [1,0,0,1,0,0|1,0,1]=4 9624 B7R1.4 O[C@H]1CCC[C@H]1Cl Amb8394048 [1,0,0,1,0,0|1,0,1]=4 9625 B7R1.4 O[C@H]1CCC[C@H]1O Amb2721263 [1,0,0,1,0,0|1,0,1]=4 9626 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [1,0,0,1,0,0|2,0,0]=4 9627 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [1,0,0,1,0,0|2,0,0]=4 9628 B7R1.5 C#CCC1CC1C Amb33144239 [1,0,0,1,0,0|0,0,2]=4 9629 B7R1.5 C=C1CC1CCI Amb27838218 [1,0,0,1,0,0|1,0,1]=4 9630 B7R1.5 C=C1CC1CCN Amb27850014 [1,0,0,1,0,0|1,0,1]=4 9631 B7R1.5 C=CCC1CC1O Amb26478050 [1,0,0,1,0,0|1,0,1]=4 9632 B7R1.5 C=CC[C@@H]1C[C@@H]1Cl Amb27983599 [1,0,0,1,0,0|1,0,1]=4 9633 B7R1.5 C=CC[C@@H]1C[C@@H]1O Amb28053769 [1,0,0,1,0,0|1,0,1]=4 9634 B7R1.5 CC1CC1CC#N Amb25888500 [1,0,0,1,0,0|1,0,1]=4 9635 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,0]=2 9636 B7R1.5 CC1CC1CCBr Amb26055211 [1,0,0,1,0,0|1,0,0]=3 9637 B7R1.5 CC1CC1CCN Amb27835415 [1,0,0,1,0,0|1,0,0]=3 9638 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,1]=3 9639 B7R1.5 CC1CC1CCS Amb33143846 [1,0,0,1,0,0|0,1,0]=3 9640 B7R1.5 CC1CC1CNN Amb10610283 [1,0,0,1,0,0|2,0,0]=4 9641 B7R1.5 CC1CC1CNN Amb6246477 [1,0,0,1,0,0|2,0,0]=4 9642 B7R1.5 CC1CC1CNO Amb32954149 [1,0,0,1,0,0|1,0,1]=4 9643 B7R1.5 CC1CC1CON Amb33144974 [1,0,0,1,0,0|2,0,0]=4 9644 B7R1.5 CC1CC1N=C=O Amb9730071 [1,0,0,1,0,0|1,0,1]=4 9645 B7R1.5 CC1CC1NC=O Amb28200843 [1,0,0,1,0,0|1,0,0]=3 9646 B7R1.5 CCCC1CC1Cl Amb28193341 [1,0,0,1,0,0|1,0,0]=3 9647 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|1,0,0]=3 9648 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|1,0,0]=3 9649 B7R1.5 CCC[C@@H]1C[C@@H]1N Amb34915319 [1,0,0,1,0,0|1,0,0]=3 9650 B7R1.5 CCC[C@@H]1C[C@H]1N Amb27488941 [1,0,0,1,0,0|1,0,0]=3 9651 B7R1.5 CCC[C@@H]1C[C@H]1N Amb33032253 [1,0,0,1,0,0|1,0,0]=3 9652 B7R1.5 CCOC1CC1Br Amb24650022 [1,0,0,1,0,0|2,0,0]=4 9653 B7R1.5 CCOC1CC1F Amb27969430 [1,0,0,1,0,0|2,0,0]=4 9654 B7R1.5 CCOC1CC1N Amb19515720 [1,0,0,1,0,0|2,0,0]=4 9655 B7R1.5 CCOC1CC1N Amb32718753 [1,0,0,1,0,0|2,0,0]=4 9656 B7R1.5 CCO[C@@H]1C[C@@H]1Br Amb27966858 [1,0,0,1,0,0|2,0,0]=4 9657 B7R1.5 CCO[C@@H]1C[C@H]1Br Amb25362288 [1,0,0,1,0,0|2,0,0]=4 9658 B7R1.5 CCO[C@@H]1C[C@H]1N Amb32992425 [1,0,0,1,0,0|2,0,0]=4 9659 B7R1.5 CCO[C@@H]1C[C@H]1N Amb32992585 [1,0,0,1,0,0|2,0,0]=4 9660 B7R1.5 CCO[C@H]1C[C@H]1Cl Amb28246620 [1,0,0,1,0,0|2,0,0]=4 9661 B7R1.5 CNCC1CC1C Amb35789304 [1,0,0,1,0,0|1,0,1]=4 9662 B7R1.5 CNCC1CC1C Amb8853678 [1,0,0,1,0,0|1,0,1]=4 9663 B7R1.5 CNC[C@@H]1C[C@H]1C Amb27214669 [1,0,0,1,0,0|1,0,1]=4 9664 B7R1.5 COCC1CC1N Amb26004208 [1,0,0,1,0,0|2,0,0]=4 9665 B7R1.5 COC[C@@H]1C[C@H]1N Amb33428856 [1,0,0,1,0,0|2,0,0]=4 9666 B7R1.5 CSCC1CC1N Amb33272055 [1,0,0,1,0,0|2,0,0]=4 9667 B7R1.5 CSC[C@@H]1C[C@H]1N Amb33272056 [1,0,0,1,0,0|2,0,0]=4 9668 B7R1.5 C[C@@H]1C[C@@H]1CCBr Amb27454257 [1,0,0,1,0,0|1,0,0]=3 9669 B7R1.5 C[C@@H]1C[C@@H]1CCO Amb26012892 [1,0,0,1,0,0|0,0,1]=3 9670 B7R1.5 C[C@@H]1O[C@H]1CCO Amb27184243 [1,0,0,1,0,0|1,0,1]=4 9671 B7R1.5 C[C@H]1C[C@H]1CCCl Amb27630412 [1,0,0,1,0,0|1,0,0]=3 9672 B7R1.5 C[C@H]1O[C@H]1CCBr Amb27454808 [1,0,0,1,0,0|2,0,0]=4 9673 B7R1.5 NC1CC1CCF Amb33480869 [1,0,0,1,0,0|2,0,0]=4 9674 B7R1.5 N[C@@H]1C[C@H]1CCF Amb33480870 [1,0,0,1,0,0|2,0,0]=4 9675 B7R1.5 N[C@@H]1C[C@H]1CCO Amb28074110 [1,0,0,1,0,0|1,0,1]=4 9676 B7R1.5 OCCC1CC1F Amb27238848 [1,0,0,1,0,0|1,0,1]=4 9677 B7R1.5 [C-]#[N+]CC1CC1C Amb33144641 [1,0,0,1,0,0|1,0,1]=4 9678 B7R1.6 BrCCC1CCC1 Amb25930029 [1,0,0,1,0,0|1,0,0]=3 9679 B7R1.6 BrCCC1CCN1 Amb27392177 [1,0,0,1,0,0|2,0,0]=4 9680 B7R1.6 BrCCC1COC1 Amb26331124 [1,0,0,1,0,0|2,0,0]=4 9681 B7R1.6 BrCCN1CCC1 Amb25830678 [1,0,0,1,0,0|2,0,0]=4 9682 B7R1.6 BrCCN1CCC1 Amb33456334 [1,0,0,1,0,0|2,0,0]=4 9683 B7R1.6 Br[Mg]CC1CCC1 Amb32643968 [1,0,0,1,0,0|2,0,0]=4 9684 B7R1.6 Br\C=C\C1CCC1 Amb33135163 [1,0,0,1,0,0|1,0,1]=4 9685 B7R1.6 C#CCC1CCC1 Amb33314111 [1,0,0,1,0,0|0,0,2]=4 9686 B7R1.6 C=CCC1CCC1 Amb27198597 [1,0,0,1,0,0|0,0,1]=3 9687 B7R1.6 C=CCC1CCN1 Amb25888401 [1,0,0,1,0,0|1,0,1]=4 9688 B7R1.6 C=CCC1CCN1 Amb32992120 [1,0,0,1,0,0|1,0,1]=4 9689 B7R1.6 C=CCC1CNC1 Amb23439504 [1,0,0,1,0,0|1,0,1]=4 9690 B7R1.6 C=CCN1CCC1 Amb26956297 [1,0,0,1,0,0|1,0,1]=4 9691 B7R1.6 CCCC1CCN1 Amb33543494 [1,0,0,1,0,0|1,0,0]=3 9692 B7R1.6 CCCC1CCS1 Amb26614197 [1,0,0,1,0,0|0,1,0]=3 9693 B7R1.6 CCCC1CNC1 Amb25297768 [1,0,0,1,0,0|1,0,1]=4 9694 B7R1.6 CCCC1CNC1 Amb33802188 [1,0,0,1,0,0|1,0,1]=4 9695 B7R1.6 CCCC1COC1 Amb27147877 [1,0,0,1,0,0|1,0,1]=4 9696 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|1,0,1]=4 9697 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|1,0,1]=4 9698 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|1,0,1]=4 9699 B7R1.6 CNCC1CCC1 Amb9214718 [1,0,0,1,0,0|1,0,1]=4 9700 B7R1.6 COCC1CCN1 Amb23439866 [1,0,0,1,0,0|2,0,0]=4 9701 B7R1.6 COCC1CCN1 Amb28827660 [1,0,0,1,0,0|2,0,0]=4 9702 B7R1.6 COC[C@@H]1CCN1 Amb22757160 [1,0,0,1,0,0|2,0,0]=4 9703 B7R1.6 COC[C@@H]1CCN1 Amb23440214 [1,0,0,1,0,0|2,0,0]=4 9704 B7R1.6 COC[C@H]1CCN1 Amb25808228 [1,0,0,1,0,0|2,0,0]=4 9705 B7R1.6 COC[C@H]1CCN1 Amb33805195 [1,0,0,1,0,0|2,0,0]=4 9706 B7R1.6 CSCC1CCN1 Amb33272485 [1,0,0,1,0,0|2,0,0]=4 9707 B7R1.6 ClCCC1CCC1 Amb27831996 [1,0,0,1,0,0|1,0,0]=3 9708 B7R1.6 ClCCC1CNC1 Amb27807375 [1,0,0,1,0,0|2,0,0]=4 9709 B7R1.6 ClCCN1CCC1 Amb10069966 [1,0,0,1,0,0|2,0,0]=4 9710 B7R1.6 ClCOC1CCC1 Amb28314243 [1,0,0,1,0,0|2,0,0]=4 9711 B7R1.6 FCCC1CCN1 Amb25377475 [1,0,0,1,0,0|2,0,0]=4 9712 B7R1.6 FCCC1CNC1 Amb28050421 [1,0,0,1,0,0|2,0,0]=4 9713 B7R1.6 FCCC1CNC1 Amb33743843 [1,0,0,1,0,0|2,0,0]=4 9714 B7R1.6 FCCC1CNC1 Amb34153675 [1,0,0,1,0,0|2,0,0]=4 9715 B7R1.6 FCCN1CCC1 Amb28280056 [1,0,0,1,0,0|2,0,0]=4 9716 B7R1.6 ICCC1COC1 Amb25207110 [1,0,0,1,0,0|2,0,0]=4 9717 B7R1.6 N#CCC1CCC1 Amb9870414 [1,0,0,1,0,0|1,0,1]=4 9718 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,0]=3 9719 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,0]=3 9720 B7R1.6 NCCC1CCO1 Amb27843371 [1,0,0,1,0,0|1,0,1]=4 9721 B7R1.6 NCCC1CNC1 Amb25997240 [1,0,0,1,0,0|2,0,0]=4 9722 B7R1.6 NCCC1COC1 Amb21864698 [1,0,0,1,0,0|2,0,0]=4 9723 B7R1.6 NCCC1CSC1 Amb27971340 [1,0,0,1,0,0|2,0,0]=4 9724 B7R1.6 NCCN1CCC1 Amb20622304 [1,0,0,1,0,0|2,0,0]=4 9725 B7R1.6 NCC[C@H]1CCO1 Amb25920109 [1,0,0,1,0,0|1,0,1]=4 9726 B7R1.6 NNCC1CCC1 Amb19893039 [1,0,0,1,0,0|2,0,0]=4 9727 B7R1.6 NNCC1CCC1 Amb6248618 [1,0,0,1,0,0|2,0,0]=4 9728 B7R1.6 NOCC1CCC1 Amb22896602 [1,0,0,1,0,0|2,0,0]=4 9729 B7R1.6 NOCC1CCC1 Amb32667096 [1,0,0,1,0,0|2,0,0]=4 9730 B7R1.6 O=C=NC1CCC1 Amb6267587 [1,0,0,1,0,0|1,0,1]=4 9731 B7R1.6 O=CC=C1CCC1 Amb27827363 [1,0,0,1,0,0|0,0,2]=4 9732 B7R1.6 O=CCC1CCC1 Amb22002603 [1,0,0,1,0,0|0,0,0]=2 9733 B7R1.6 O=CCC1CCO1 Amb26626501 [1,0,0,1,0,0|1,0,0]=3 9734 B7R1.6 O=CCC1COC1 Amb23440119 [1,0,0,1,0,0|1,0,0]=3 9735 B7R1.6 O=CCN1CCC1 Amb25831216 [1,0,0,1,0,0|1,0,0]=3 9736 B7R1.6 O=CNC1CNC1 Amb27798890 [1,0,0,1,0,0|2,0,0]=4 9737 B7R1.6 O=CNC1COC1 Amb28192194 [1,0,0,1,0,0|2,0,0]=4 9738 B7R1.6 OCCC1=CCC1 Amb28189596 [1,0,0,1,0,0|1,0,1]=4 9739 B7R1.6 OCCC1CCC1 Amb33543947 [1,0,0,1,0,0|0,0,1]=3 9740 B7R1.6 OCCC1CCN1 Amb25350591 [1,0,0,1,0,0|1,0,1]=4 9741 B7R1.6 OCCC1CCO1 Amb25780445 [1,0,0,1,0,0|1,0,1]=4 9742 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|1,0,1]=4 9743 B7R1.6 OCCC1CNC1 Amb30869764 [1,0,0,1,0,0|1,0,1]=4 9744 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|1,0,1]=4 9745 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|1,0,1]=4 9746 B7R1.6 OCCN1CCC1 Amb22002602 [1,0,0,1,0,0|1,0,1]=4 9747 B7R1.6 OCC[C@@H]1CCN1 Amb24479867 [1,0,0,1,0,0|1,0,1]=4 9748 B7R1.6 OCC[C@@H]1CCO1 Amb26009491 [1,0,0,1,0,0|1,0,1]=4 9749 B7R1.6 OCC[C@H]1CCO1 Amb25129832 [1,0,0,1,0,0|1,0,1]=4 9750 B7R1.6 ONCC1CCC1 Amb25888398 [1,0,0,1,0,0|1,0,1]=4 9751 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,0]=3 9752 B7R1.6 SCCC1CNC1 Amb29854367 [1,0,0,1,0,0|1,1,0]=4 9753 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|1,0,0]=3 9754 B7R1.7 BrCCCC1CO1 Amb27407723 [1,0,0,1,0,0|1,0,1]=4 9755 B7R1.7 BrCCOC1CC1 Amb32667448 [1,0,0,1,0,0|2,0,0]=4 9756 B7R1.7 C#CCCC1CC1 Amb33429088 [1,0,0,1,0,0|0,0,2]=4 9757 B7R1.7 C=CCCC1CO1 Amb3940512 [1,0,0,1,0,0|1,0,1]=4 9758 B7R1.7 C=CCC[C@@H]1CO1 Amb28050706 [1,0,0,1,0,0|1,0,1]=4 9759 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [1,0,0,1,0,0|1,0,1]=4 9760 B7R1.7 C=CCNC1CC1 Amb17309103 [1,0,0,1,0,0|1,0,1]=4 9761 B7R1.7 C=CCNC1CC1 Amb28555343 [1,0,0,1,0,0|1,0,1]=4 9762 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|0,0,1]=3 9763 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|0,0,1]=3 9764 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|0,0,1]=3 9765 B7R1.7 CCCNC1CC1 Amb1135100 [1,0,0,1,0,0|1,0,1]=4 9766 B7R1.7 CCCNC1CC1 Amb32644830 [1,0,0,1,0,0|1,0,1]=4 9767 B7R1.7 CCNCC1CC1 Amb30584675 [1,0,0,1,0,0|1,0,1]=4 9768 B7R1.7 CCNCC1CC1 Amb6686877 [1,0,0,1,0,0|1,0,1]=4 9769 B7R1.7 CCOCC1CO1 Amb9709641 [1,0,0,1,0,0|1,0,1]=4 9770 B7R1.7 CCOC[C@@H]1CO1 Amb25954691 [1,0,0,1,0,0|1,0,1]=4 9771 B7R1.7 CCOC[C@H]1CO1 Amb25888471 [1,0,0,1,0,0|1,0,1]=4 9772 B7R1.7 CCSCC1CC1 Amb27206075 [1,0,0,1,0,0|1,0,1]=4 9773 B7R1.7 CCSCC1CO1 Amb6680858 [1,0,0,1,0,0|1,0,1]=4 9774 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [1,0,0,1,0,0|1,0,1]=4 9775 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [1,0,0,1,0,0|1,0,1]=4 9776 B7R1.7 CNCCC1CC1 Amb18979588 [1,0,0,1,0,0|1,0,1]=4 9777 B7R1.7 CNCCC1CC1 Amb33550263 [1,0,0,1,0,0|1,0,1]=4 9778 B7R1.7 COCCC1CO1 Amb27984185 [1,0,0,1,0,0|1,0,1]=4 9779 B7R1.7 COCC[C@@H]1CO1 Amb33377003 [1,0,0,1,0,0|1,0,1]=4 9780 B7R1.7 COCC[C@H]1CO1 Amb33377005 [1,0,0,1,0,0|1,0,1]=4 9781 B7R1.7 CSCCC1CC1 Amb28079007 [1,0,0,1,0,0|1,0,1]=4 9782 B7R1.7 CSCCC1CO1 Amb25241000 [1,0,0,1,0,0|1,0,1]=4 9783 B7R1.7 CSCC[C@@H]1CO1 Amb33203333 [1,0,0,1,0,0|1,0,1]=4 9784 B7R1.7 CSCC[C@H]1CO1 Amb33203334 [1,0,0,1,0,0|1,0,1]=4 9785 B7R1.7 ClCCNC1CC1 Amb17334071 [1,0,0,1,0,0|2,0,0]=4 9786 B7R1.7 ClCCNC1CC1 Amb32664797 [1,0,0,1,0,0|2,0,0]=4 9787 B7R1.7 ClCCOC1CC1 Amb10603117 [1,0,0,1,0,0|2,0,0]=4 9788 B7R1.7 ClCOCC1CC1 Amb33545122 [1,0,0,1,0,0|2,0,0]=4 9789 B7R1.7 FCCCC1CO1 Amb33196122 [1,0,0,1,0,0|1,0,1]=4 9790 B7R1.7 FCCOC1CC1 Amb27436850 [1,0,0,1,0,0|2,0,0]=4 9791 B7R1.7 ICCCC1CC1 Amb35720662 [1,0,0,1,0,0|1,0,0]=3 9792 B7R1.7 ICCCC1CO1 Amb27838220 [1,0,0,1,0,0|1,0,1]=4 9793 B7R1.7 N#CCCC1CC1 Amb33548668 [1,0,0,1,0,0|1,0,1]=4 9794 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|1,0,0]=3 9795 B7R1.7 NCCCC1CC1 Amb33548306 [1,0,0,1,0,0|1,0,0]=3 9796 B7R1.7 NCCCC1CO1 Amb27816302 [1,0,0,1,0,0|1,0,1]=4 9797 B7R1.7 NCCNC1CC1 Amb13951961 [1,0,0,1,0,0|2,0,0]=4 9798 B7R1.7 NCCOC1CC1 Amb26943548 [1,0,0,1,0,0|2,0,0]=4 9799 B7R1.7 NCCOC1CC1 Amb30584692 [1,0,0,1,0,0|2,0,0]=4 9800 B7R1.7 NNCCC1CC1 Amb27806776 [1,0,0,1,0,0|2,0,0]=4 9801 B7R1.7 NOCCC1CC1 Amb28050766 [1,0,0,1,0,0|2,0,0]=4 9802 B7R1.7 NOCCC1CC1 Amb6308072 [1,0,0,1,0,0|2,0,0]=4 9803 B7R1.7 O=C=NCC1CC1 Amb18955466 [1,0,0,1,0,0|1,0,1]=4 9804 B7R1.7 O=CCC=C1CC1 Amb27799822 [1,0,0,1,0,0|0,0,2]=4 9805 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,0]=2 9806 B7R1.7 O=CNCC1CC1 Amb28322746 [1,0,0,1,0,0|1,0,0]=3 9807 B7R1.7 O=COCC1CO1 Amb24632689 [1,0,0,1,0,0|2,0,0]=4 9808 B7R1.7 O=C\C=C\C1CC1 Amb32664515 [1,0,0,1,0,0|0,0,2]=4 9809 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|0,0,1]=3 9810 B7R1.7 OCCCC1CO1 Amb28294234 [1,0,0,1,0,0|1,0,1]=4 9811 B7R1.7 OCCC[C@@H]1CO1 Amb27394788 [1,0,0,1,0,0|1,0,1]=4 9812 B7R1.7 OCCNC1CC1 Amb6251502 [1,0,0,1,0,0|1,0,1]=4 9813 B7R1.7 OCCOC1CC1 Amb26852318 [1,0,0,1,0,0|1,0,1]=4 9814 B7R1.7 ONCCC1CC1 Amb33361506 [1,0,0,1,0,0|1,0,1]=4 9815 B7R1.7 SCCCC1CC1 Amb28244922 [1,0,0,1,0,0|0,1,0]=3 9816 B7R1.7 SCCNC1CC1 Amb35639655 [1,0,0,1,0,0|1,1,0]=4 9817 B7R1.7 [C-]#[N+]CCC1CC1 Amb33428962 [1,0,0,1,0,0|1,0,1]=4 9818 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|1,0,1]=4 9819 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [1,0,0,1,0,0|1,0,1]=4 9820 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [1,0,0,1,0,0|1,0,1]=4 9821 B7R1.8 CC1CCC1CBr Amb28076923 [1,0,0,1,0,0|1,0,0]=3 9822 B7R1.8 CC1CCC1CCl Amb28436122 [1,0,0,1,0,0|1,0,0]=3 9823 B7R1.8 CC1CCC1CI Amb27792871 [1,0,0,1,0,0|1,0,0]=3 9824 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,0]=3 9825 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,1]=3 9826 B7R1.8 CC1CCC1NO Amb27425045 [1,0,0,1,0,0|1,0,1]=4 9827 B7R1.8 CCC1CCC1=O Amb28137082 [1,0,0,1,0,0|0,0,0]=2 9828 B7R1.8 CCC1CCC1N Amb28135225 [1,0,0,1,0,0|1,0,0]=3 9829 B7R1.8 CCC1CCC1O Amb27249737 [1,0,0,1,0,0|0,0,1]=3 9830 B7R1.8 CCC1NCC1F Amb27206479 [1,0,0,1,0,0|2,0,0]=4 9831 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|1,0,0]=3 9832 B7R1.8 CC[C@@H]1CC[C@@H]1O Amb27268529 [1,0,0,1,0,0|0,0,1]=3 9833 B7R1.8 CC[C@@H]1CC[C@H]1O Amb27798172 [1,0,0,1,0,0|0,0,1]=3 9834 B7R1.8 CC[C@@H]1NC[C@@H]1N Amb25102070 [1,0,0,1,0,0|2,0,0]=4 9835 B7R1.8 CN1CCC1C=O Amb27789055 [1,0,0,1,0,0|1,0,0]=3 9836 B7R1.8 CN1CCC1CI Amb27863746 [1,0,0,1,0,0|2,0,0]=4 9837 B7R1.8 CN1CCC1CN Amb25108789 [1,0,0,1,0,0|2,0,0]=4 9838 B7R1.8 CN1CCC1CN Amb30869354 [1,0,0,1,0,0|2,0,0]=4 9839 B7R1.8 CN1CCC1CO Amb27161390 [1,0,0,1,0,0|1,0,1]=4 9840 B7R1.8 CN1CC[C@@H]1CN Amb25701112 [1,0,0,1,0,0|2,0,0]=4 9841 B7R1.8 CN1CC[C@@H]1CN Amb30869360 [1,0,0,1,0,0|2,0,0]=4 9842 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|1,0,1]=4 9843 B7R1.8 CN1CC[C@H]1CN Amb25216747 [1,0,0,1,0,0|2,0,0]=4 9844 B7R1.8 CN1CC[C@H]1CN Amb33801125 [1,0,0,1,0,0|2,0,0]=4 9845 B7R1.8 CN1CC[C@H]1CO Amb28239653 [1,0,0,1,0,0|1,0,1]=4 9846 B7R1.8 COC1CCC1=O Amb22896543 [1,0,0,1,0,0|1,0,0]=3 9847 B7R1.8 COC1CCC1N Amb25880007 [1,0,0,1,0,0|2,0,0]=4 9848 B7R1.8 COC1CCC1N Amb32661633 [1,0,0,1,0,0|2,0,0]=4 9849 B7R1.8 COC1CCC1S Amb32788446 [1,0,0,1,0,0|1,1,0]=4 9850 B7R1.8 CO[C@@H]1CC[C@@H]1N Amb33495619 [1,0,0,1,0,0|2,0,0]=4 9851 B7R1.8 CO[C@@H]1CC[C@@H]1N Amb34154243 [1,0,0,1,0,0|2,0,0]=4 9852 B7R1.8 CO[C@@H]1CC[C@H]1Br Amb35752255 [1,0,0,1,0,0|2,0,0]=4 9853 B7R1.8 CO[C@@H]1CC[C@H]1N Amb25026007 [1,0,0,1,0,0|2,0,0]=4 9854 B7R1.8 CO[C@@H]1CC[C@H]1N Amb31245819 [1,0,0,1,0,0|2,0,0]=4 9855 B7R1.8 CO[C@@H]1CC[C@H]1O Amb33495612 [1,0,0,1,0,0|1,0,1]=4 9856 B7R1.8 CSC1CCC1=O Amb26054103 [1,0,0,1,0,0|1,0,0]=3 9857 B7R1.8 C[C@@H]1CC[C@@H]1CBr Amb27484113 [1,0,0,1,0,0|1,0,0]=3 9858 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [1,0,0,1,0,0|0,0,0]=2 9859 B7R1.8 C[C@@H]1CC[C@H]1CBr Amb27424101 [1,0,0,1,0,0|1,0,0]=3 9860 B7R1.8 C[C@H]1CC[C@H]1CBr Amb28429571 [1,0,0,1,0,0|1,0,0]=3 9861 B7R1.8 C[C@H]1CC[C@H]1CCl Amb28387678 [1,0,0,1,0,0|1,0,0]=3 9862 B7R1.8 C[C@H]1CC[C@H]1CO Amb27196739 [1,0,0,1,0,0|0,0,1]=3 9863 B7R1.8 C\C=C1\CCC1=O Amb24512730 [1,0,0,1,0,0|0,0,2]=4 9864 B7R1.8 FC1CCC1CBr Amb32943807 [1,0,0,1,0,0|2,0,0]=4 9865 B7R1.8 FC1CCC1CCl Amb32943728 [1,0,0,1,0,0|2,0,0]=4 9866 B7R1.8 NC1CCC1CS Amb27876457 [1,0,0,1,0,0|1,1,0]=4 9867 B7R1.8 NCC1CCC1F Amb32943628 [1,0,0,1,0,0|2,0,0]=4 9868 B7R1.8 NCC1CCC1F Amb33719051 [1,0,0,1,0,0|2,0,0]=4 9869 B7R1.8 NCC1CNC1=O Amb25888547 [1,0,0,1,0,0|2,0,0]=4 9870 B7R1.8 NC[C@@H]1CC[C@H]1S Amb28057745 [1,0,0,1,0,0|1,1,0]=4 9871 B7R1.8 N[C@@H]1CC[C@H]1CS Amb27629684 [1,0,0,1,0,0|1,1,0]=4 9872 B7R1.8 N[C@H]1CC[C@H]1CO Amb25327109 [1,0,0,1,0,0|1,0,1]=4 9873 B7R1.8 O=C1CCC1CBr Amb24633095 [1,0,0,1,0,0|1,0,0]=3 9874 B7R1.8 O=C1CCC1CCl Amb28197139 [1,0,0,1,0,0|1,0,0]=3 9875 B7R1.8 O=C1CCC1CO Amb24722181 [1,0,0,1,0,0|1,0,0]=3 9876 B7R1.8 O=C1CCN1CBr Amb28137960 [1,0,0,1,0,0|2,0,0]=4 9877 B7R1.8 O=C1CCN1CO Amb28207292 [1,0,0,1,0,0|2,0,0]=4 9878 B7R1.8 O=C1NCC1CO Amb28196532 [1,0,0,1,0,0|2,0,0]=4 9879 B7R1.8 O=CC1CCC1F Amb32943810 [1,0,0,1,0,0|1,0,0]=3 9880 B7R1.8 OCC1CCC1F Amb32943809 [1,0,0,1,0,0|1,0,1]=4 9881 B7R1.8 OCC1CCC1O Amb26956761 [1,0,0,1,0,0|1,0,1]=4 9882 B7R1.8 OC[C@@H]1CC[C@H]1O Amb34160319 [1,0,0,1,0,0|1,0,1]=4 9883 B7R1.8 OC[C@H]1CC[C@H]1O Amb25662759 [1,0,0,1,0,0|1,0,1]=4 9884 B7R1.9 C#C[C@@H]1C[C@H]1C=O Amb28131414 [1,0,0,1,0,0|0,0,2]=4 9885 B7R1.9 C=C[C@@H]1C[C@H]1CO Amb27481145 [1,0,0,1,0,0|1,0,1]=4 9886 B7R1.9 C=C[C@H]1C[C@H]1CBr Amb27424762 [1,0,0,1,0,0|1,0,1]=4 9887 B7R1.9 CCC1CC1C#N Amb28284190 [1,0,0,1,0,0|1,0,1]=4 9888 B7R1.9 CCC1CC1CBr Amb28050452 [1,0,0,1,0,0|1,0,0]=3 9889 B7R1.9 CCC1CC1CC Amb27445028 [1,0,0,1,0,0|0,0,1]=3 9890 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,0]=3 9891 B7R1.9 CCC1CC1CN Amb32662776 [1,0,0,1,0,0|1,0,0]=3 9892 B7R1.9 CCC1OC1CBr Amb28385701 [1,0,0,1,0,0|2,0,0]=4 9893 B7R1.9 CCC1OC1CC Amb27407235 [1,0,0,1,0,0|1,0,1]=4 9894 B7R1.9 CC[C@@H]1C[C@@H]1C=O Amb28142393 [1,0,0,1,0,0|0,0,0]=2 9895 B7R1.9 CC[C@@H]1C[C@@H]1CN Amb34916256 [1,0,0,1,0,0|1,0,0]=3 9896 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,1]=3 9897 B7R1.9 CC[C@@H]1C[C@H]1C#N Amb28284782 [1,0,0,1,0,0|1,0,1]=4 9898 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,0]=3 9899 B7R1.9 CC[C@@H]1C[C@H]1CCl Amb28284868 [1,0,0,1,0,0|1,0,0]=3 9900 B7R1.9 CC[C@@H]1C[C@H]1CN Amb26431153 [1,0,0,1,0,0|1,0,0]=3 9901 B7R1.9 CC[C@@H]1C[C@H]1CN Amb28920814 [1,0,0,1,0,0|1,0,0]=3 9902 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,1]=3 9903 B7R1.9 CC[C@@H]1O[C@@H]1C=O Amb27640580 [1,0,0,1,0,0|1,0,0]=3 9904 B7R1.9 CC[C@@H]1O[C@@H]1CO Amb28198173 [1,0,0,1,0,0|1,0,1]=4 9905 B7R1.9 CC[C@H]1C[C@H]1CC Amb27391419 [1,0,0,1,0,0|0,0,1]=3 9906 B7R1.9 CC[S+]1CC1CO Amb27970929 [1,0,0,1,0,0|1,0,1]=4 9907 B7R1.9 CNC1CC1CO Amb27838268 [1,0,0,1,0,0|1,0,1]=4 9908 B7R1.9 COC1CC1C=O Amb35720824 [1,0,0,1,0,0|1,0,0]=3 9909 B7R1.9 COC1CC1CBr Amb35732114 [1,0,0,1,0,0|2,0,0]=4 9910 B7R1.9 COC1CC1CCl Amb29849443 [1,0,0,1,0,0|2,0,0]=4 9911 B7R1.9 COC1CC1CN Amb35683740 [1,0,0,1,0,0|2,0,0]=4 9912 B7R1.9 COC1CC1CO Amb28137240 [1,0,0,1,0,0|1,0,1]=4 9913 B7R1.9 CO[C@H]1C[C@@H]1CO Amb27632061 [1,0,0,1,0,0|1,0,1]=4 9914 B7R1.9 ClC[C@@H]1C[C@H]1CCl Amb27216836 [1,0,0,1,0,0|2,0,0]=4 9915 B7R1.9 ClC[C@H]1C[C@H]1CCl Amb24117131 [1,0,0,1,0,0|2,0,0]=4 9916 B7R1.9 N#CC1CC1C=O Amb24378434 [1,0,0,1,0,0|1,0,1]=4 9917 B7R1.9 NCC1CC1CF Amb26602214 [1,0,0,1,0,0|2,0,0]=4 9918 B7R1.9 NCC1CC1CO Amb22499310 [1,0,0,1,0,0|1,0,1]=4 9919 B7R1.9 NC[C@@H]1C[C@@H]1CO Amb22746714 [1,0,0,1,0,0|1,0,1]=4 9920 B7R1.9 NC[C@@H]1C[C@H]1CO Amb22746972 [1,0,0,1,0,0|1,0,1]=4 9921 B7R1.9 NC[C@H]1C[C@@H]1CO Amb22224716 [1,0,0,1,0,0|1,0,1]=4 9922 B7R1.9 NC[C@H]1C[C@H]1CO Amb25217566 [1,0,0,1,0,0|1,0,1]=4 9923 B7R1.9 O=CC1CC1C=O Amb27166180 [1,0,0,1,0,0|1,0,1]=4 9924 B7R1.9 O=C[C@H]1C[C@@H]1C=O Amb28057483 [1,0,0,1,0,0|1,0,1]=4 9925 B7R1.9 OCC1CC1CBr Amb27831384 [1,0,0,1,0,0|1,0,1]=4 9926 B7R1.9 OCC1CC1CCl Amb27965811 [1,0,0,1,0,0|1,0,1]=4 9927 B7R1.9 OCC1CC1CO Amb27172961 [1,0,0,1,0,0|1,0,1]=4 9928 B7R1.9 OC[C@H]1C[C@H]1CO Amb28193489 [1,0,0,1,0,0|1,0,1]=4 9929 B7R1.24 C1=CCCCCC1 Amb8515344 [1,0,0,1,0,0|0,0,1]=3 9930 B7R1.24 C1=CCCNCC1 Amb22169408 [1,0,0,1,0,0|1,0,1]=4 9931 B7R1.24 C1=CCCNCC1 Amb24530335 [1,0,0,1,0,0|1,0,1]=4 9932 B7R1.24 C1=CCNCCC1 Amb25104535 [1,0,0,1,0,0|1,0,1]=4 9933 B7R1.24 C1=CCNCCC1 Amb33330391 [1,0,0,1,0,0|1,0,1]=4 9934 B7R1.24 C1=COCCCC1 Amb28254269 [1,0,0,1,0,0|0,0,2]=4 9935 B7R1.24 C1=NCCCCC1 Amb27445210 [1,0,0,1,0,0|1,0,0]=3 9936 B7R1.24 C1CCCNCC1 Amb2792842 [1,0,0,1,0,0|1,0,0]=3 9937 B7R1.24 C1CCCOCC1 Amb22045221 [1,0,0,1,0,0|0,0,1]=3 9938 B7R1.24 C1CCNNCC1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 9939 B7R1.24 C1CCNOCC1 Amb28769693 [1,0,0,1,0,0|1,0,1]=4 9940 B7R1.24 C1CCSCSC1 Amb22227736 [1,0,0,1,0,0|1,1,0]=4 9941 B7R1.24 C1CNCCNC1 Amb2688726 [1,0,0,1,0,0|2,0,0]=4 9942 B7R1.24 C1CNCCNC1 Amb29844598 [1,0,0,1,0,0|2,0,0]=4 9943 B7R1.24 C1CNCCOC1 Amb19889085 [1,0,0,1,0,0|1,0,1]=4 9944 B7R1.24 C1CNCCOC1 Amb7094907 [1,0,0,1,0,0|1,0,1]=4 9945 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|1,1,0]=4 9946 B7R1.24 C1CNCCSC1 Amb9176341 [1,0,0,1,0,0|1,1,0]=4 9947 B9R1.2 C#CC1CCCC(=O)C1 Amb26842390 [0,1,0,1,0,0|0,0,2]=4 9948 B9R1.2 C#CC1CCCC(=O)N1 Amb27211198 [0,1,0,1,0,0|0,0,2]=4 9949 B9R1.2 C#CC1CCCC(C)C1 Amb27440120 [0,1,0,1,0,0|1,0,1]=4 9950 B9R1.2 C#CC1CCCC(O)C1 Amb27977938 [0,1,0,1,0,0|1,0,1]=4 9951 B9R1.2 C#C[C@@H]1CCC[C@H](C)N1 Amb28056216 [0,1,0,1,0,0|1,0,1]=4 9952 B9R1.2 C#C[C@@H]1CCC[C@H](O)C1 Amb27422236 [0,1,0,1,0,0|1,0,1]=4 9953 B9R1.2 C#C[C@H]1CCCC(=O)N1 Amb27863767 [0,1,0,1,0,0|0,0,2]=4 9954 B9R1.2 C=C1CCCN(C=O)C1 Amb29883056 [0,1,0,1,0,0|1,0,1]=4 9955 B9R1.2 C=CC1CCCC(=O)C1 Amb28250679 [0,1,0,1,0,0|0,0,2]=4 9956 B9R1.2 C=CC1CCCC(=O)N1 Amb26036889 [0,1,0,1,0,0|0,0,2]=4 9957 B9R1.2 C=CC1CCCC(C)N1 Amb27630668 [0,1,0,1,0,0|1,0,0]=3 9958 B9R1.2 C=CC1CCCC(N)C1 Amb26996279 [0,1,0,1,0,0|1,0,0]=3 9959 B9R1.2 C=CC1CCCC(O)C1 Amb25846990 [0,1,0,1,0,0|1,0,0]=3 9960 B9R1.2 C=CC1CCCN(C)C1 Amb30526904 [0,1,0,1,0,0|2,0,0]=4 9961 B9R1.2 C=C[C@@H]1CCC[C@@H](N)C1 Amb27220130 [0,1,0,1,0,0|1,0,0]=3 9962 B9R1.2 C=C[C@@H]1CCC[C@@H](N)C1 Amb31251611 [0,1,0,1,0,0|1,0,0]=3 9963 B9R1.2 C=C[C@@H]1CCC[C@H](O)C1 Amb27631254 [0,1,0,1,0,0|1,0,0]=3 9964 B9R1.2 C=C[C@@H]1C[C@@H](N)CCO1 Amb33456873 [0,1,0,1,0,0|2,0,0]=4 9965 B9R1.2 C=C[C@H]1CCC[C@@H](O)C1 Amb25205028 [0,1,0,1,0,0|1,0,0]=3 9966 B9R1.2 C=C[C@H]1CCC[C@H](C)N1 Amb26419074 [0,1,0,1,0,0|1,0,0]=3 9967 B9R1.2 CC1=CCCC(C=O)O1 Amb27796530 [0,1,0,1,0,0|0,0,2]=4 9968 B9R1.2 CC1C=C(C=O)CCC1 Amb4035517 [0,1,0,1,0,0|0,0,1]=3 9969 B9R1.2 CC1CC(C=O)CCO1 Amb18642617 [0,1,0,1,0,0|1,0,0]=3 9970 B9R1.2 CC1CCCC(C#N)C1 Amb8950073 [0,1,0,1,0,0|1,0,1]=4 9971 B9R1.2 CC1CCCC(C#N)N1 Amb18642256 [0,1,0,1,0,0|1,0,1]=4 9972 B9R1.2 CC1CCCC(C=O)C1 Amb22059519 [0,1,0,1,0,0|0,0,0]=2 9973 B9R1.2 CC1CCCC(C=O)O1 Amb27956485 [0,1,0,1,0,0|0,0,0]=2 9974 B9R1.2 CC1CCCC(CBr)C1 Amb22059638 [0,1,0,1,0,0|1,0,1]=4 9975 B9R1.2 CC1CCCC(CBr)O1 Amb28341224 [0,1,0,1,0,0|1,0,1]=4 9976 B9R1.2 CC1CCCC(CCl)C1 Amb27664585 [0,1,0,1,0,0|1,0,1]=4 9977 B9R1.2 CC1CCCC(CI)C1 Amb28128033 [0,1,0,1,0,0|1,0,1]=4 9978 B9R1.2 CC1CCCC(CI)O1 Amb27236991 [0,1,0,1,0,0|1,0,1]=4 9979 B9R1.2 CC1CCCC(CN)C1 Amb8950171 [0,1,0,1,0,0|1,0,1]=4 9980 B9R1.2 CC1CCCC(CN)N1 Amb25930766 [0,1,0,1,0,0|1,0,1]=4 9981 B9R1.2 CC1CCCC(CN)O1 Amb25940618 [0,1,0,1,0,0|1,0,1]=4 9982 B9R1.2 CC1CCCC(CO)C1 Amb20248640 [0,1,0,1,0,0|0,0,2]=4 9983 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [0,1,0,1,0,0|0,0,2]=4 9984 B9R1.2 CC1CCCC(CS)C1 Amb26505263 [0,1,0,1,0,0|0,1,1]=4 9985 B9R1.2 CC1CCCC(NN)C1 Amb10610509 [0,1,0,1,0,0|2,0,0]=4 9986 B9R1.2 CC1CCCC(NN)C1 Amb28990931 [0,1,0,1,0,0|2,0,0]=4 9987 B9R1.2 CC1CCCC(NN)C1 Amb6246756 [0,1,0,1,0,0|2,0,0]=4 9988 B9R1.2 CC1CCCC(NO)C1 Amb27436769 [0,1,0,1,0,0|1,0,1]=4 9989 B9R1.2 CC1CCCN(N=O)C1 Amb27266128 [0,1,0,1,0,0|2,0,0]=4 9990 B9R1.2 CC1CCC\[N+](=C/Cl)C1 Amb27484106 [0,1,0,1,0,0|2,0,0]=4 9991 B9R1.2 CC1CCOC(C=O)C1 Amb25032291 [0,1,0,1,0,0|1,0,0]=3 9992 B9R1.2 CC1CN(C=O)CCN1 Amb27984457 [0,1,0,1,0,0|2,0,0]=4 9993 B9R1.2 CC1OCC[C@@H](C=O)O1 Amb27603449 [0,1,0,1,0,0|1,0,0]=3 9994 B9R1.2 CCC1=CC(=O)CCC1 Amb27599813 [0,1,0,1,0,0|0,0,1]=3 9995 B9R1.2 CCC1=CC(=O)CCN1 Amb27595544 [0,1,0,1,0,0|1,0,1]=4 9996 B9R1.2 CCC1=CC(=O)CSC1 Amb27838665 [0,1,0,1,0,0|1,0,1]=4 9997 B9R1.2 CCC1CC(=O)CCN1 Amb24589388 [0,1,0,1,0,0|1,0,0]=3 9998 B9R1.2 CCC1CC(=O)CCO1 Amb19373926 [0,1,0,1,0,0|1,0,0]=3 9999 B9R1.2 CCC1CC(=O)CCS1 Amb27838781 [0,1,0,1,0,0|1,0,0]=3 10000 B9R1.2 CCC1CC(C)CCN1 Amb27263401 [0,1,0,1,0,0|1,0,1]=4 10001 B9R1.2 CCC1CC(Cl)CCO1 Amb28458111 [0,1,0,1,0,0|0,0,2]=4 10002 B9R1.2 CCC1CC(N)CCN1 Amb25320367 [0,1,0,1,0,0|1,0,1]=4 10003 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|0,0,2]=4 10004 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|0,0,2]=4 10005 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|0,0,2]=4 10006 B9R1.2 CCC1CC=CC(=O)O1 Amb27480728 [0,1,0,1,0,0|0,0,2]=4 10007 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [0,1,0,1,0,0|0,0,0]=2 10008 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [0,1,0,1,0,0|0,0,0]=2 10009 B9R1.2 CCC1CCCC(=O)O1 Amb27242548 [0,1,0,1,0,0|0,0,0]=2 10010 B9R1.2 CCC1CCCC(C)C1 Amb27267046 [0,1,0,1,0,0|1,0,1]=4 10011 B9R1.2 CCC1CCCC(C)N1 Amb25146110 [0,1,0,1,0,0|1,0,1]=4 10012 B9R1.2 CCC1CCCC(N)=N1 Amb27407342 [0,1,0,1,0,0|1,0,0]=3 10013 B9R1.2 CCC1CCCC(N)C1 Amb19374220 [0,1,0,1,0,0|1,0,1]=4 10014 B9R1.2 CCC1CCCC(O)C1 Amb17593352 [0,1,0,1,0,0|0,0,2]=4 10015 B9R1.2 CCC1CCCC(S)C1 Amb25861249 [0,1,0,1,0,0|0,1,1]=4 10016 B9R1.2 CCC1CCCN(N)C1 Amb25974186 [0,1,0,1,0,0|2,0,0]=4 10017 B9R1.2 CCC1CCN=C(N)C1 Amb25779626 [0,1,0,1,0,0|2,0,0]=4 10018 B9R1.2 CCC1CCNC(=O)C1 Amb25791122 [0,1,0,1,0,0|1,0,0]=3 10019 B9R1.2 CCC1CCNC(C)=N1 Amb30021226 [0,1,0,1,0,0|2,0,0]=4 10020 B9R1.2 CCC1CCNC(O)=N1 Amb24481964 [0,1,0,1,0,0|1,0,1]=4 10021 B9R1.2 CCC1CNCC(=O)N1 Amb24427566 [0,1,0,1,0,0|1,0,0]=3 10022 B9R1.2 CCC1CNCC(C)C1 Amb24477764 [0,1,0,1,0,0|2,0,0]=4 10023 B9R1.2 CCC1CNCC(N)C1 Amb33275585 [0,1,0,1,0,0|2,0,0]=4 10024 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,1,0,0|1,0,0]=3 10025 B9R1.2 CCC1CS(=O)CCN1 Amb27424706 [0,1,0,1,0,0|2,0,0]=4 10026 B9R1.2 CCN1CCCC(=O)C1 Amb23440927 [0,1,0,1,0,0|1,0,0]=3 10027 B9R1.2 CCN1CCCC(=O)C1 Amb9825829 [0,1,0,1,0,0|1,0,0]=3 10028 B9R1.2 CCN1CCNC(=O)C1 Amb19516973 [0,1,0,1,0,0|2,0,0]=4 10029 B9R1.2 CCN1CCNC(=O)C1 Amb21961561 [0,1,0,1,0,0|2,0,0]=4 10030 B9R1.2 CC[C@@H]1CC=CC(=O)C1 Amb27828949 [0,1,0,1,0,0|0,0,2]=4 10031 B9R1.2 CC[C@@H]1CCC[C@@H](C)N1 Amb27216626 [0,1,0,1,0,0|1,0,1]=4 10032 B9R1.2 CC[C@@H]1CCC[C@@H](O)C1 Amb28319548 [0,1,0,1,0,0|0,0,2]=4 10033 B9R1.2 CC[C@@H]1CCC[C@H](C)N1 Amb24562231 [0,1,0,1,0,0|1,0,1]=4 10034 B9R1.2 CC[C@@H]1CCC[C@H](O)C1 Amb27491475 [0,1,0,1,0,0|0,0,2]=4 10035 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,1,0,0|1,0,0]=3 10036 B9R1.2 CC[C@@H]1C[C@@H](O)CCN1 Amb32434781 [0,1,0,1,0,0|1,0,1]=4 10037 B9R1.2 CC[C@@H]1C[C@H](N)CCO1 Amb27248320 [0,1,0,1,0,0|0,0,2]=4 10038 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb27460205 [0,1,0,1,0,0|1,0,1]=4 10039 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb32434779 [0,1,0,1,0,0|1,0,1]=4 10040 B9R1.2 CC[C@H]1CC=CC(=O)C1 Amb28461147 [0,1,0,1,0,0|0,0,2]=4 10041 B9R1.2 CC[C@H]1CCCC(=O)N1 Amb28049339 [0,1,0,1,0,0|0,0,0]=2 10042 B9R1.2 CC[C@H]1CCCC(O)O1 Amb27180648 [0,1,0,1,0,0|0,0,2]=4 10043 B9R1.2 CC[C@H]1CCC[C@@H](C)N1 Amb32667683 [0,1,0,1,0,0|1,0,1]=4 10044 B9R1.2 CC[C@H]1CCC[C@H](O)C1 Amb28207111 [0,1,0,1,0,0|0,0,2]=4 10045 B9R1.2 CC[C@H]1C[C@H](O)CCS1 Amb27451909 [0,1,0,1,0,0|0,1,1]=4 10046 B9R1.2 CN1CCCC(C=O)C1 Amb33532140 [0,1,0,1,0,0|1,0,0]=3 10047 B9R1.2 CN1CCOC(C=O)C1 Amb27593054 [0,1,0,1,0,0|2,0,0]=4 10048 B9R1.2 CNC1=CC(=O)CCC1 Amb2386653 [0,1,0,1,0,0|1,0,1]=4 10049 B9R1.2 CNC1CCCC(C)C1 Amb33526835 [0,1,0,1,0,0|2,0,0]=4 10050 B9R1.2 CNC1CCCC(C)C1 Amb6892926 [0,1,0,1,0,0|2,0,0]=4 10051 B9R1.2 CNC1CCCC(Cl)C1 Amb35740080 [0,1,0,1,0,0|2,0,0]=4 10052 B9R1.2 CNC1CCCC(O)C1 Amb18642723 [0,1,0,1,0,0|2,0,0]=4 10053 B9R1.2 CNC1CCC[C@@H](O)C1 Amb28051135 [0,1,0,1,0,0|2,0,0]=4 10054 B9R1.2 CN[C@@H]1CCCC(C)C1 Amb27947967 [0,1,0,1,0,0|2,0,0]=4 10055 B9R1.2 CN[C@@H]1CCC[C@@H](O)C1 Amb27463767 [0,1,0,1,0,0|2,0,0]=4 10056 B9R1.2 COC1=CC(=O)CCC1 Amb19930192 [0,1,0,1,0,0|1,0,1]=4 10057 B9R1.2 COC1CCCC(=O)C1 Amb20671002 [0,1,0,1,0,0|1,0,0]=3 10058 B9R1.2 COC1CCCC(=O)N1 Amb27594844 [0,1,0,1,0,0|1,0,0]=3 10059 B9R1.2 COC1CCCC(Br)C1 Amb24436237 [0,1,0,1,0,0|2,0,0]=4 10060 B9R1.2 COC1CCCC(C)C1 Amb6608954 [0,1,0,1,0,0|2,0,0]=4 10061 B9R1.2 COC1CCCC(I)C1 Amb33546465 [0,1,0,1,0,0|2,0,0]=4 10062 B9R1.2 COC1CCCC(N)C1 Amb33541880 [0,1,0,1,0,0|2,0,0]=4 10063 B9R1.2 COC1CCCC(O)C1 Amb13951102 [0,1,0,1,0,0|2,0,0]=4 10064 B9R1.2 COC1CCCC(S)C1 Amb27407675 [0,1,0,1,0,0|2,0,0]=4 10065 B9R1.2 COC1COCC(=O)N1 Amb28043309 [0,1,0,1,0,0|2,0,0]=4 10066 B9R1.2 CO[C@@H]1CCC[C@@H](N)C1 Amb34913074 [0,1,0,1,0,0|2,0,0]=4 10067 B9R1.2 CO[C@@H]1CCC[C@@H](O)C1 Amb27843394 [0,1,0,1,0,0|2,0,0]=4 10068 B9R1.2 CO[C@@H]1CCC[C@H](Br)C1 Amb28076634 [0,1,0,1,0,0|2,0,0]=4 10069 B9R1.2 CO[C@@H]1CCC[C@H](N)C1 Amb25834599 [0,1,0,1,0,0|2,0,0]=4 10070 B9R1.2 CO[C@@H]1CCC[C@H](O)C1 Amb26575107 [0,1,0,1,0,0|2,0,0]=4 10071 B9R1.2 CO[C@H]1CCC[C@@H](N)C1 Amb24539646 [0,1,0,1,0,0|2,0,0]=4 10072 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 Amb25271471 [0,1,0,1,0,0|2,0,0]=4 10073 B9R1.2 CO[C@H]1CCC[C@H](O)C1 Amb27969202 [0,1,0,1,0,0|2,0,0]=4 10074 B9R1.2 CSC1CCCC(=O)C1 Amb25328147 [0,1,0,1,0,0|1,0,0]=3 10075 B9R1.2 CSC1CCCC(C)C1 Amb28288627 [0,1,0,1,0,0|2,0,0]=4 10076 B9R1.2 CSC1CCCC(N)C1 Amb19335809 [0,1,0,1,0,0|2,0,0]=4 10077 B9R1.2 CSC1CCCC(O)C1 Amb28315413 [0,1,0,1,0,0|2,0,0]=4 10078 B9R1.2 C[C@@H]1CCCC(CO)N1 Amb27413400 [0,1,0,1,0,0|0,0,2]=4 10079 B9R1.2 C[C@@H]1CCC[C@@H](CO)O1 Amb27213296 [0,1,0,1,0,0|0,0,2]=4 10080 B9R1.2 C[C@@H]1CCC[C@H](CN)N1 Amb32675684 [0,1,0,1,0,0|1,0,1]=4 10081 B9R1.2 C[C@@H]1CCC[C@H](CN)N1 Amb35751635 [0,1,0,1,0,0|1,0,1]=4 10082 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [0,1,0,1,0,0|0,0,2]=4 10083 B9R1.2 C[C@@H]1C[C@@H](C=O)CCO1 Amb27966706 [0,1,0,1,0,0|1,0,0]=3 10084 B9R1.2 C[C@@H]1C[C@H](C=O)OCO1 Amb28287271 [0,1,0,1,0,0|2,0,0]=4 10085 B9R1.2 C[C@H]1CCC[C@@H](C#N)N1 Amb28058837 [0,1,0,1,0,0|1,0,1]=4 10086 B9R1.2 C[C@H]1CCC[C@@H](C=O)N1 Amb27866254 [0,1,0,1,0,0|0,0,0]=2 10087 B9R1.2 C[C@H]1CCOC(C=O)C1 Amb26406399 [0,1,0,1,0,0|1,0,0]=3 10088 B9R1.2 C[C@H]1CCO[C@H](C=O)C1 Amb25914480 [0,1,0,1,0,0|1,0,0]=3 10089 B9R1.2 C[C@H]1C[C@@H](C=O)CCO1 Amb27194769 [0,1,0,1,0,0|1,0,0]=3 10090 B9R1.2 C[C@H]1C[C@H](C=O)CCO1 Amb27629806 [0,1,0,1,0,0|1,0,0]=3 10091 B9R1.2 FC1CCCC(CBr)C1 Amb27879072 [0,1,0,1,0,0|1,0,1]=4 10092 B9R1.2 FC1CCCC(CCl)C1 Amb32943617 [0,1,0,1,0,0|1,0,1]=4 10093 B9R1.2 N#CC1CCCC(=O)C1 Amb18642100 [0,1,0,1,0,0|1,0,1]=4 10094 B9R1.2 N#CC1CCCC(Cl)C1 Amb27424701 [0,1,0,1,0,0|1,0,1]=4 10095 B9R1.2 N#CC1CCCC(O)C1 Amb22490479 [0,1,0,1,0,0|1,0,1]=4 10096 B9R1.2 N#C[C@@H]1CCC[C@@H](N)C1 Amb26958913 [0,1,0,1,0,0|1,0,1]=4 10097 B9R1.2 N#C[C@@H]1CCC[C@H](O)C1 Amb27205687 [0,1,0,1,0,0|1,0,1]=4 10098 B9R1.2 N#C[C@H]1CCCC(=O)C1 Amb27838628 [0,1,0,1,0,0|1,0,1]=4 10099 B9R1.2 N#C[C@H]1CCC[C@@H](N)C1 Amb28388977 [0,1,0,1,0,0|1,0,1]=4 10100 B9R1.2 N#C[C@H]1CCC[C@H](O)C1 Amb28287277 [0,1,0,1,0,0|1,0,1]=4 10101 B9R1.2 NC1CCCC(CO)C1 Amb33532803 [0,1,0,1,0,0|0,0,2]=4 10102 B9R1.2 NC1CCCC(NO)C1 Amb28046309 [0,1,0,1,0,0|1,0,1]=4 10103 B9R1.2 NCC1CCCC(=O)N1 Amb18832610 [0,1,0,1,0,0|1,0,0]=3 10104 B9R1.2 NCC1CCCC(=O)N1 Amb22754591 [0,1,0,1,0,0|1,0,0]=3 10105 B9R1.2 NCC1CCCC(=O)N1 Amb33313533 [0,1,0,1,0,0|1,0,0]=3 10106 B9R1.2 NCC1CCCC(Br)C1 Amb26472114 [0,1,0,1,0,0|1,0,1]=4 10107 B9R1.2 NCC1CCCC(Cl)C1 Amb27768829 [0,1,0,1,0,0|1,0,1]=4 10108 B9R1.2 NCC1CCCC(F)C1 Amb26613805 [0,1,0,1,0,0|1,0,1]=4 10109 B9R1.2 NCC1CCCC(F)C1 Amb28555389 [0,1,0,1,0,0|1,0,1]=4 10110 B9R1.2 NCC1CCCC(N)C1 Amb16233731 [0,1,0,1,0,0|1,0,1]=4 10111 B9R1.2 NCC1CCCC(O)C1 Amb9782617 [0,1,0,1,0,0|1,0,1]=4 10112 B9R1.2 NCC1CCCC(S)C1 Amb32788397 [0,1,0,1,0,0|1,0,1]=4 10113 B9R1.2 NCC1CCNC(=O)C1 Amb18832611 [0,1,0,1,0,0|2,0,0]=4 10114 B9R1.2 NCC1CCNC(=O)C1 Amb22405878 [0,1,0,1,0,0|2,0,0]=4 10115 B9R1.2 NCC1CCNC(=O)C1 Amb35747931 [0,1,0,1,0,0|2,0,0]=4 10116 B9R1.2 NCC1CNCC(=O)N1 Amb27793712 [0,1,0,1,0,0|2,0,0]=4 10117 B9R1.2 NCC1CSCC(=O)N1 Amb18251299 [0,1,0,1,0,0|2,0,0]=4 10118 B9R1.2 NC[C@@H]1CCC[C@@H](N)C1 Amb26921446 [0,1,0,1,0,0|1,0,1]=4 10119 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687113 [0,1,0,1,0,0|1,0,0]=3 10120 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687289 [0,1,0,1,0,0|1,0,0]=3 10121 B9R1.2 NNC1CCCC(N)C1 Amb27856347 [0,1,0,1,0,0|2,0,0]=4 10122 B9R1.2 NOC1CCCC(N)C1 Amb28254458 [0,1,0,1,0,0|2,0,0]=4 10123 B9R1.2 NO[C@@H]1CCC[C@H](N)C1 Amb27878914 [0,1,0,1,0,0|2,0,0]=4 10124 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 Amb25973785 [0,1,0,1,0,0|0,0,2]=4 10125 B9R1.2 N[C@@H]1CCC[C@H](CO)C1 Amb27791190 [0,1,0,1,0,0|0,0,2]=4 10126 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb23385323 [0,1,0,1,0,0|0,0,2]=4 10127 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb30526953 [0,1,0,1,0,0|0,0,2]=4 10128 B9R1.2 N[C@H]1CCC[C@H](CO)C1 Amb28399575 [0,1,0,1,0,0|0,0,2]=4 10129 B9R1.2 O=C1C=C(CCl)CCC1 Amb27882739 [0,1,0,1,0,0|1,0,1]=4 10130 B9R1.2 O=C1C=C(CO)CCC1 Amb27843949 [0,1,0,1,0,0|1,0,1]=4 10131 B9R1.2 O=C1CC(CBr)CCN1 Amb27980511 [0,1,0,1,0,0|2,0,0]=4 10132 B9R1.2 O=C1CC(CCl)CCO1 Amb27482669 [0,1,0,1,0,0|2,0,0]=4 10133 B9R1.2 O=C1CC(CO)CCN1 Amb21960758 [0,1,0,1,0,0|2,0,0]=4 10134 B9R1.2 O=C1CCCC(CBr)C1 Amb28396522 [0,1,0,1,0,0|1,0,0]=3 10135 B9R1.2 O=C1CCCC(CBr)O1 Amb28325542 [0,1,0,1,0,0|1,0,0]=3 10136 B9R1.2 O=C1CCCC(CCl)C1 Amb17593666 [0,1,0,1,0,0|1,0,0]=3 10137 B9R1.2 O=C1CCCC(CCl)N1 Amb19374373 [0,1,0,1,0,0|1,0,0]=3 10138 B9R1.2 O=C1CCCC(CI)N1 Amb28044882 [0,1,0,1,0,0|1,0,0]=3 10139 B9R1.2 O=C1CCCC(CO)C1 Amb16231079 [0,1,0,1,0,0|1,0,0]=3 10140 B9R1.2 O=C1CCCC(CO)N1 Amb13886257 [0,1,0,1,0,0|1,0,0]=3 10141 B9R1.2 O=C1CCCC(CO)O1 Amb27980552 [0,1,0,1,0,0|1,0,0]=3 10142 B9R1.2 O=C1CCC[C@@H](CO)C1 Amb26479307 [0,1,0,1,0,0|1,0,0]=3 10143 B9R1.2 O=C1CCC[C@H](CO)N1 Amb25187085 [0,1,0,1,0,0|1,0,0]=3 10144 B9R1.2 O=C1CNCC(CO)C1 Amb27621654 [0,1,0,1,0,0|2,0,0]=4 10145 B9R1.2 O=C1CNCC(CO)N1 Amb27834544 [0,1,0,1,0,0|2,0,0]=4 10146 B9R1.2 O=C1CNCC(CO)N1 Amb32665951 [0,1,0,1,0,0|2,0,0]=4 10147 B9R1.2 O=C1CNC[C@@H](CO)N1 Amb26994402 [0,1,0,1,0,0|2,0,0]=4 10148 B9R1.2 O=C1CNC[C@@H](CO)N1 Amb30526697 [0,1,0,1,0,0|2,0,0]=4 10149 B9R1.2 O=C1CNC[C@H](CO)N1 Amb27828103 [0,1,0,1,0,0|2,0,0]=4 10150 B9R1.2 O=C1COCC(CO)N1 Amb22236095 [0,1,0,1,0,0|2,0,0]=4 10151 B9R1.2 O=C1CSCC(CO)N1 Amb28388256 [0,1,0,1,0,0|2,0,0]=4 10152 B9R1.2 O=C1C[C@H](CCl)CCO1 Amb27656328 [0,1,0,1,0,0|2,0,0]=4 10153 B9R1.2 O=CC1CCCC(Cl)C1 Amb28456028 [0,1,0,1,0,0|0,0,0]=2 10154 B9R1.2 O=CC1CCCC(F)C1 Amb24541768 [0,1,0,1,0,0|0,0,0]=2 10155 B9R1.2 O=CC1CCCS(=O)C1 Amb27767985 [0,1,0,1,0,0|1,0,0]=3 10156 B9R1.2 O=CC1CCNC(Br)C1 Amb8629163 [0,1,0,1,0,0|1,0,0]=3 10157 B9R1.2 O=CN1CCCC(=O)C1 Amb27595139 [0,1,0,1,0,0|1,0,1]=4 10158 B9R1.2 O=CN1CCCC(F)C1 Amb29876084 [0,1,0,1,0,0|1,0,0]=3 10159 B9R1.2 O=CN1CCCC(O)C1 Amb27401500 [0,1,0,1,0,0|1,0,0]=3 10160 B9R1.2 O=C[C@@H]1CC=C[C@@H](O)C1 Amb28143998 [0,1,0,1,0,0|0,0,2]=4 10161 B9R1.2 O=C[C@@H]1CC=C[C@H](O)C1 Amb28130446 [0,1,0,1,0,0|0,0,2]=4 10162 B9R1.2 O=NN1CCCC(Cl)C1 Amb26865282 [0,1,0,1,0,0|2,0,0]=4 10163 B9R1.2 O=NN1CCCC(O)C1 Amb25829015 [0,1,0,1,0,0|2,0,0]=4 10164 B9R1.2 OC1CCCC(CBr)C1 Amb26885621 [0,1,0,1,0,0|1,0,1]=4 10165 B9R1.2 OC1CCCC(CCl)C1 Amb25342173 [0,1,0,1,0,0|1,0,1]=4 10166 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [0,1,0,1,0,0|0,0,2]=4 10167 B9R1.2 OC[C@@H]1CCC[C@@H](O)C1 Amb28076813 [0,1,0,1,0,0|0,0,2]=4 10168 B9R1.2 OC[C@@H]1CCC[C@H](O)C1 Amb28344623 [0,1,0,1,0,0|0,0,2]=4 10169 B9R1.2 OC[C@H]1CCC[C@@H](O)C1 Amb26435184 [0,1,0,1,0,0|0,0,2]=4 10170 B9R1.7 C#CCC1CCC(=O)N1 Amb25742847 [0,1,0,1,0,0|0,0,2]=4 10171 B9R1.7 C#CCC1CCC(Br)C1 Amb28285121 [0,1,0,1,0,0|1,0,1]=4 10172 B9R1.7 C#CCC1CCC(N)C1 Amb27397137 [0,1,0,1,0,0|1,0,1]=4 10173 B9R1.7 C#CCC1CCC(O)C1 Amb28069995 [0,1,0,1,0,0|1,0,1]=4 10174 B9R1.7 C#CCC1CC[C@@H](C)O1 Amb33448083 [0,1,0,1,0,0|1,0,1]=4 10175 B9R1.7 C=CCC1CC(O)CN1 Amb18642526 [0,1,0,1,0,0|2,0,0]=4 10176 B9R1.7 C=CCC1CC(O)CO1 Amb27650261 [0,1,0,1,0,0|2,0,0]=4 10177 B9R1.7 C=CCC1CCC(=O)C1 Amb26610303 [0,1,0,1,0,0|0,0,2]=4 10178 B9R1.7 C=CCC1CCC(Br)C1 Amb28350557 [0,1,0,1,0,0|1,0,0]=3 10179 B9R1.7 C=CCC1CCC(O)O1 Amb22752548 [0,1,0,1,0,0|2,0,0]=4 10180 B9R1.7 C=CCN1CCC(N)C1 Amb2383629 [0,1,0,1,0,0|2,0,0]=4 10181 B9R1.7 C=CCN1CC[C@@H](N)C1 Amb27776065 [0,1,0,1,0,0|2,0,0]=4 10182 B9R1.7 C=CC[C@@H]1CC[C@H](O)C1 Amb27455824 [0,1,0,1,0,0|1,0,0]=3 10183 B9R1.7 C=CC[C@@H]1C[C@H](O)CO1 Amb27198045 [0,1,0,1,0,0|2,0,0]=4 10184 B9R1.7 CC#CC1CCC(=O)N1 Amb27656036 [0,1,0,1,0,0|0,0,2]=4 10185 B9R1.7 CC1=CC(CC=O)CC1 Amb27644034 [0,1,0,1,0,0|0,0,1]=3 10186 B9R1.7 CC1CC(NC=O)CO1 Amb29858515 [0,1,0,1,0,0|2,0,0]=4 10187 B9R1.7 CC1CCC(CC#N)O1 Amb27630490 [0,1,0,1,0,0|1,0,1]=4 10188 B9R1.7 CC1CCC(CCBr)O1 Amb26943466 [0,1,0,1,0,0|1,0,1]=4 10189 B9R1.7 CC1CCC(CCN)C1 Amb25865066 [0,1,0,1,0,0|1,0,1]=4 10190 B9R1.7 CC1CCC(CCN)C1 Amb33482569 [0,1,0,1,0,0|1,0,1]=4 10191 B9R1.7 CC1CCC(CCN)N1 Amb23560219 [0,1,0,1,0,0|1,0,1]=4 10192 B9R1.7 CC1CCC(CCN)O1 Amb25107033 [0,1,0,1,0,0|1,0,1]=4 10193 B9R1.7 CC1CCC(CCO)C1 Amb28206116 [0,1,0,1,0,0|0,0,2]=4 10194 B9R1.7 CC1CCC(CCO)O1 Amb24420913 [0,1,0,1,0,0|0,0,2]=4 10195 B9R1.7 CC1CCC(CNN)C1 Amb27589331 [0,1,0,1,0,0|2,0,0]=4 10196 B9R1.7 CC1CCC(NC=O)C1 Amb28349441 [0,1,0,1,0,0|1,0,0]=3 10197 B9R1.7 CC1CCN(CC=O)C1 Amb28286986 [0,1,0,1,0,0|1,0,0]=3 10198 B9R1.7 CC1CC\C(=C/C=O)C1 Amb27618565 [0,1,0,1,0,0|0,0,2]=4 10199 B9R1.7 CCCC1=CC(=O)CC1 Amb25337676 [0,1,0,1,0,0|0,0,1]=3 10200 B9R1.7 CCCC1=CC(=O)CO1 Amb27797456 [0,1,0,1,0,0|1,0,1]=4 10201 B9R1.7 CCCC1C=CC(=O)N1 Amb27752029 [0,1,0,1,0,0|0,0,2]=4 10202 B9R1.7 CCCC1C=CC(=O)O1 Amb25793308 [0,1,0,1,0,0|0,0,2]=4 10203 B9R1.7 CCCC1CC(=O)CO1 Amb35722218 [0,1,0,1,0,0|1,0,0]=3 10204 B9R1.7 CCCC1CC(=O)CS1 Amb28132012 [0,1,0,1,0,0|1,0,0]=3 10205 B9R1.7 CCCC1CC(=O)NN1 Amb29862242 [0,1,0,1,0,0|2,0,0]=4 10206 B9R1.7 CCCC1CC(N)CO1 Amb35584876 [0,1,0,1,0,0|0,0,2]=4 10207 B9R1.7 CCCC1CC(O)CO1 Amb35584946 [0,1,0,1,0,0|0,0,2]=4 10208 B9R1.7 CCCC1CCC(=O)C1 Amb24087435 [0,1,0,1,0,0|0,0,0]=2 10209 B9R1.7 CCCC1CCC(=O)O1 Amb8517544 [0,1,0,1,0,0|0,0,0]=2 10210 B9R1.7 CCCC1CCC(Cl)C1 Amb28201166 [0,1,0,1,0,0|1,0,1]=4 10211 B9R1.7 CCCC1CCC(Cl)O1 Amb27424623 [0,1,0,1,0,0|0,0,2]=4 10212 B9R1.7 CCCC1CCC(N)C1 Amb26963448 [0,1,0,1,0,0|1,0,1]=4 10213 B9R1.7 CCCC1CCC(O)O1 Amb27589536 [0,1,0,1,0,0|0,0,2]=4 10214 B9R1.7 CCCC1CCN(N)C1 Amb25189011 [0,1,0,1,0,0|2,0,0]=4 10215 B9R1.7 CCCC1CNC(=O)C1 Amb16186658 [0,1,0,1,0,0|1,0,0]=3 10216 B9R1.7 CCCC1CNC(=O)O1 Amb26947821 [0,1,0,1,0,0|1,0,0]=3 10217 B9R1.7 CCCC1CNC(=S)O1 Amb28347971 [0,1,0,1,0,0|1,0,1]=4 10218 B9R1.7 CCCC1CNC(C)=N1 Amb30021231 [0,1,0,1,0,0|2,0,0]=4 10219 B9R1.7 CCCC1CNC(O)=N1 Amb26898870 [0,1,0,1,0,0|1,0,1]=4 10220 B9R1.7 CCCC1CNC(S)=N1 Amb26499131 [0,1,0,1,0,0|1,1,0]=4 10221 B9R1.7 CCCC1COC(=O)C1 Amb26560581 [0,1,0,1,0,0|1,0,0]=3 10222 B9R1.7 CCCC1COC(=O)N1 Amb26628895 [0,1,0,1,0,0|1,0,0]=3 10223 B9R1.7 CCCC1COC(O)C1 Amb28315446 [0,1,0,1,0,0|2,0,0]=4 10224 B9R1.7 CCC[C@@H]1C=CC(=O)N1 Amb27876443 [0,1,0,1,0,0|0,0,2]=4 10225 B9R1.7 CCC[C@@H]1CC[C@H](C)N1 Amb27473308 [0,1,0,1,0,0|1,0,1]=4 10226 B9R1.7 CCC[C@@H]1COC(=O)N1 Amb28133695 [0,1,0,1,0,0|1,0,0]=3 10227 B9R1.7 CCC[C@H]1CCC(=O)O1 Amb28397464 [0,1,0,1,0,0|0,0,0]=2 10228 B9R1.7 CCC[C@H]1CNC(=O)C1 Amb25146172 [0,1,0,1,0,0|1,0,0]=3 10229 B9R1.7 CCC[C@H]1COC(=O)C1 Amb33725639 [0,1,0,1,0,0|1,0,0]=3 10230 B9R1.7 CCC[C@H]1COC(=O)N1 Amb27484954 [0,1,0,1,0,0|1,0,0]=3 10231 B9R1.7 CCC[C@H]1COC(O)C1 Amb28315422 [0,1,0,1,0,0|2,0,0]=4 10232 B9R1.7 CCNC1CCC(=O)C1 Amb27972271 [0,1,0,1,0,0|1,0,0]=3 10233 B9R1.7 CCNC1CNC(=O)C1 Amb28049213 [0,1,0,1,0,0|2,0,0]=4 10234 B9R1.7 CCOC1=CC(=O)CC1 Amb21984008 [0,1,0,1,0,0|1,0,1]=4 10235 B9R1.7 CCOC1=NC(=O)CC1 Amb28385432 [0,1,0,1,0,0|1,0,1]=4 10236 B9R1.7 CCOC1C=CC(Cl)C1 Amb27392362 [0,1,0,1,0,0|2,0,0]=4 10237 B9R1.7 CCOC1CCC(=O)C1 Amb27953350 [0,1,0,1,0,0|1,0,0]=3 10238 B9R1.7 CCOC1CCC(=O)N1 Amb2612716 [0,1,0,1,0,0|1,0,0]=3 10239 B9R1.7 CCOC1CCC(=O)O1 Amb24117269 [0,1,0,1,0,0|1,0,0]=3 10240 B9R1.7 CCOC1COC(=O)N1 Amb27799203 [0,1,0,1,0,0|2,0,0]=4 10241 B9R1.7 CCOC1OC(=O)CS1 Amb24373299 [0,1,0,1,0,0|2,0,0]=4 10242 B9R1.7 CCSC1CCC(=O)C1 Amb27248280 [0,1,0,1,0,0|1,0,0]=3 10243 B9R1.7 CCSC1CCC(=O)N1 Amb28131675 [0,1,0,1,0,0|1,0,0]=3 10244 B9R1.7 CCSC1CNC(=O)O1 Amb27174206 [0,1,0,1,0,0|2,0,0]=4 10245 B9R1.7 CN1CCC(CC=O)C1 Amb28251212 [0,1,0,1,0,0|1,0,0]=3 10246 B9R1.7 CN1CCC(NC=O)C1 Amb28324739 [0,1,0,1,0,0|2,0,0]=4 10247 B9R1.7 CN1CC[C@@H](CC=O)C1 Amb27590369 [0,1,0,1,0,0|1,0,0]=3 10248 B9R1.7 CNCC1CCC(=O)N1 Amb2372617 [0,1,0,1,0,0|1,0,0]=3 10249 B9R1.7 CNCC1CCC(=O)O1 Amb28326084 [0,1,0,1,0,0|1,0,0]=3 10250 B9R1.7 CNCC1CCC(C)C1 Amb27405406 [0,1,0,1,0,0|2,0,0]=4 10251 B9R1.7 CNCC1CCC(C)O1 Amb18642726 [0,1,0,1,0,0|2,0,0]=4 10252 B9R1.7 CNCC1CCC(Cl)C1 Amb28061718 [0,1,0,1,0,0|2,0,0]=4 10253 B9R1.7 CNCC1CCC(N)C1 Amb27231577 [0,1,0,1,0,0|2,0,0]=4 10254 B9R1.7 CNCC1CCC(O)C1 Amb28049206 [0,1,0,1,0,0|2,0,0]=4 10255 B9R1.7 CNCC1CC[C@@H](C)O1 Amb33423401 [0,1,0,1,0,0|2,0,0]=4 10256 B9R1.7 CNCC1CNC(=O)C1 Amb8009793 [0,1,0,1,0,0|2,0,0]=4 10257 B9R1.7 CNCC1CNC(=O)O1 Amb17506101 [0,1,0,1,0,0|2,0,0]=4 10258 B9R1.7 CNCC1COC(=O)O1 Amb27619965 [0,1,0,1,0,0|2,0,0]=4 10259 B9R1.7 CNC[C@@H]1CCC(=O)N1 Amb32664378 [0,1,0,1,0,0|1,0,0]=3 10260 B9R1.7 CNC[C@@H]1CCC(=O)N1 Amb33032826 [0,1,0,1,0,0|1,0,0]=3 10261 B9R1.7 CNC[C@@H]1CCC(=O)O1 Amb27848226 [0,1,0,1,0,0|1,0,0]=3 10262 B9R1.7 CNC[C@@H]1CC[C@H](N)C1 Amb33071905 [0,1,0,1,0,0|2,0,0]=4 10263 B9R1.7 CNC[C@@H]1CNC(=O)O1 Amb27631362 [0,1,0,1,0,0|2,0,0]=4 10264 B9R1.7 COCC1=CC(=O)CC1 Amb27754476 [0,1,0,1,0,0|1,0,1]=4 10265 B9R1.7 COCC1C=CC(Cl)C1 Amb28342295 [0,1,0,1,0,0|2,0,0]=4 10266 B9R1.7 COCC1CC(=O)CO1 Amb35726675 [0,1,0,1,0,0|2,0,0]=4 10267 B9R1.7 COCC1CCC(=O)C1 Amb27842051 [0,1,0,1,0,0|1,0,0]=3 10268 B9R1.7 COCC1CCC(=O)O1 Amb26558471 [0,1,0,1,0,0|1,0,0]=3 10269 B9R1.7 COCC1CCC(Cl)C1 Amb27441623 [0,1,0,1,0,0|2,0,0]=4 10270 B9R1.7 COCC1CCC(N)C1 Amb25683802 [0,1,0,1,0,0|2,0,0]=4 10271 B9R1.7 COCC1CNC(=O)C1 Amb25693762 [0,1,0,1,0,0|2,0,0]=4 10272 B9R1.7 COCC1CNC(=O)O1 Amb27794676 [0,1,0,1,0,0|2,0,0]=4 10273 B9R1.7 COCC1COC(=O)N1 Amb26969707 [0,1,0,1,0,0|2,0,0]=4 10274 B9R1.7 COCC1COC(=O)O1 Amb26318830 [0,1,0,1,0,0|2,0,0]=4 10275 B9R1.7 COC[C@@H]1CNC(=O)O1 Amb22746095 [0,1,0,1,0,0|2,0,0]=4 10276 B9R1.7 COC[C@H]1CCC(N)=N1 Amb27954012 [0,1,0,1,0,0|2,0,0]=4 10277 B9R1.7 COC[C@H]1CNC(=O)O1 Amb22225377 [0,1,0,1,0,0|2,0,0]=4 10278 B9R1.7 COC[C@H]1COC(=O)O1 Amb22226690 [0,1,0,1,0,0|2,0,0]=4 10279 B9R1.7 CSCC1CCC(C)N1 Amb28397280 [0,1,0,1,0,0|2,0,0]=4 10280 B9R1.7 CSCC1CCC(N)C1 Amb27786081 [0,1,0,1,0,0|2,0,0]=4 10281 B9R1.7 CSCC1CNC(=O)C1 Amb25888802 [0,1,0,1,0,0|2,0,0]=4 10282 B9R1.7 CSCC1CNC(=O)O1 Amb28193245 [0,1,0,1,0,0|2,0,0]=4 10283 B9R1.7 CSCC1COC(=O)N1 Amb25304404 [0,1,0,1,0,0|2,0,0]=4 10284 B9R1.7 CSC[C@H]1COC(=O)N1 Amb27945522 [0,1,0,1,0,0|2,0,0]=4 10285 B9R1.7 C[C@@H]1CCC(CC#N)O1 Amb33423387 [0,1,0,1,0,0|1,0,1]=4 10286 B9R1.7 C[C@@H]1CCC(CC=O)O1 Amb33423667 [0,1,0,1,0,0|0,0,0]=2 10287 B9R1.7 C[C@@H]1CCC(CCBr)O1 Amb33331134 [0,1,0,1,0,0|1,0,1]=4 10288 B9R1.7 C[C@@H]1CCC(CCN)O1 Amb33423877 [0,1,0,1,0,0|1,0,1]=4 10289 B9R1.7 C[C@@H]1CCC(CCO)O1 Amb33423278 [0,1,0,1,0,0|0,0,2]=4 10290 B9R1.7 C[C@@H]1CCC(CCS)O1 Amb32730400 [0,1,0,1,0,0|0,1,1]=4 10291 B9R1.7 C[C@@H]1CCC(CNN)O1 Amb33448101 [0,1,0,1,0,0|2,0,0]=4 10292 B9R1.7 C[C@@H]1CCC(CNO)O1 Amb33226296 [0,1,0,1,0,0|1,0,1]=4 10293 B9R1.7 C[C@@H]1CCC(CON)O1 Amb33226117 [0,1,0,1,0,0|2,0,0]=4 10294 B9R1.7 C[C@@H]1CC[C@@H](CCO)N1 Amb27438106 [0,1,0,1,0,0|0,0,2]=4 10295 B9R1.7 C[C@@H]1CC[C@H](CCO)N1 Amb32946591 [0,1,0,1,0,0|0,0,2]=4 10296 B9R1.7 C[C@H]1CC[C@@H](CCO)N1 Amb27439132 [0,1,0,1,0,0|0,0,2]=4 10297 B9R1.7 C[NH2+]C[C@@H]1CCC(=O)O1 Amb28464027 [0,1,0,1,0,0|1,0,0]=3 10298 B9R1.7 C\C=C\C1CCC(=O)C1 Amb28065825 [0,1,0,1,0,0|0,0,2]=4 10299 B9R1.7 C\C=C\C1CCC(C)N1 Amb27214823 [0,1,0,1,0,0|1,0,1]=4 10300 B9R1.7 C\C=C\[C@@H]1CC[C@H](C)N1 Amb27655811 [0,1,0,1,0,0|1,0,1]=4 10301 B9R1.7 C\C=C\[C@H]1CCC(=O)C1 Amb27490903 [0,1,0,1,0,0|0,0,2]=4 10302 B9R1.7 N#CCC1CCC(=O)N1 Amb2372618 [0,1,0,1,0,0|1,0,1]=4 10303 B9R1.7 N#CCC1CCC(F)C1 Amb27424969 [0,1,0,1,0,0|1,0,1]=4 10304 B9R1.7 N#CCC1CCC(N)C1 Amb27259751 [0,1,0,1,0,0|1,0,1]=4 10305 B9R1.7 N#CCC1CCC(N)C1 Amb28935006 [0,1,0,1,0,0|1,0,1]=4 10306 B9R1.7 N#CC[C@@H]1CCC(=O)N1 Amb23385242 [0,1,0,1,0,0|1,0,1]=4 10307 B9R1.7 N#CC[C@@H]1CC[C@H](N)C1 Amb26551724 [0,1,0,1,0,0|1,0,1]=4 10308 B9R1.7 N#CC[C@@H]1CC[C@H](N)C1 Amb32661828 [0,1,0,1,0,0|1,0,1]=4 10309 B9R1.7 N#CC[C@H]1CCC(=O)N1 Amb23385279 [0,1,0,1,0,0|1,0,1]=4 10310 B9R1.7 NC1CCC(CCO)C1 Amb26889980 [0,1,0,1,0,0|0,0,2]=4 10311 B9R1.7 NCCC1CCC(=O)N1 Amb18832609 [0,1,0,1,0,0|1,0,0]=3 10312 B9R1.7 NCCC1CCC(=O)N1 Amb32652430 [0,1,0,1,0,0|1,0,0]=3 10313 B9R1.7 NCCC1CCC(F)C1 Amb28060508 [0,1,0,1,0,0|1,0,1]=4 10314 B9R1.7 NCCC1CCC(O)C1 Amb27790532 [0,1,0,1,0,0|1,0,1]=4 10315 B9R1.7 NCCC1CNC(=O)C1 Amb18832612 [0,1,0,1,0,0|2,0,0]=4 10316 B9R1.7 NCCC1CNC(=O)C1 Amb32666581 [0,1,0,1,0,0|2,0,0]=4 10317 B9R1.7 NCCC1CNC(=O)O1 Amb27628589 [0,1,0,1,0,0|2,0,0]=4 10318 B9R1.7 NCCC1COC(=O)N1 Amb24732121 [0,1,0,1,0,0|2,0,0]=4 10319 B9R1.7 NCCN1CCC(=O)C1 Amb27460887 [0,1,0,1,0,0|2,0,0]=4 10320 B9R1.7 NCC[C@@H]1CCC(=O)N1 Amb26588427 [0,1,0,1,0,0|1,0,0]=3 10321 B9R1.7 NCC[C@@H]1CCC(=O)N1 Amb32664350 [0,1,0,1,0,0|1,0,0]=3 10322 B9R1.7 NCC[C@@H]1CC[C@H](O)C1 Amb17933187 [0,1,0,1,0,0|1,0,1]=4 10323 B9R1.7 NOCC1CCC(N)C1 Amb25809403 [0,1,0,1,0,0|2,0,0]=4 10324 B9R1.7 NOC[C@@H]1CC[C@H](N)C1 Amb27829499 [0,1,0,1,0,0|2,0,0]=4 10325 B9R1.7 N[C@@H]1CC[C@H](CCO)C1 Amb33803500 [0,1,0,1,0,0|0,0,2]=4 10326 B9R1.7 N[C@H]1C=C[C@H](CCO)C1 Amb27204910 [0,1,0,1,0,0|2,0,0]=4 10327 B9R1.7 O=C1CC(CCF)CN1 Amb33196064 [0,1,0,1,0,0|2,0,0]=4 10328 B9R1.7 O=C1CC(CCO)CN1 Amb23598230 [0,1,0,1,0,0|2,0,0]=4 10329 B9R1.7 O=C1CCC(CCBr)C1 Amb27592180 [0,1,0,1,0,0|1,0,0]=3 10330 B9R1.7 O=C1CCC(CCBr)O1 Amb27657784 [0,1,0,1,0,0|1,0,0]=3 10331 B9R1.7 O=C1CCC(CCO)N1 Amb8392541 [0,1,0,1,0,0|1,0,0]=3 10332 B9R1.7 O=C1CCC(CCS)O1 Amb28285189 [0,1,0,1,0,0|1,0,0]=3 10333 B9R1.7 O=C1CC[C@@H](CCO)N1 Amb24761403 [0,1,0,1,0,0|1,0,0]=3 10334 B9R1.7 O=C1CC[C@H](CCBr)O1 Amb27791548 [0,1,0,1,0,0|1,0,0]=3 10335 B9R1.7 O=C1CC[C@H](CCO)N1 Amb26403176 [0,1,0,1,0,0|1,0,0]=3 10336 B9R1.7 O=C1NC(CCF)CO1 Amb33195803 [0,1,0,1,0,0|2,0,0]=4 10337 B9R1.7 O=C1NCC(CCF)O1 Amb33195802 [0,1,0,1,0,0|2,0,0]=4 10338 B9R1.7 O=C1NCC(CCO)N1 Amb26597295 [0,1,0,1,0,0|2,0,0]=4 10339 B9R1.7 O=C=NC1CCC(F)C1 Amb27186456 [0,1,0,1,0,0|1,0,1]=4 10340 B9R1.7 O=CCC1CCC(=O)C1 Amb18642410 [0,1,0,1,0,0|0,0,1]=3 10341 B9R1.7 O=CCC1CCC(=O)O1 Amb27873383 [0,1,0,1,0,0|1,0,1]=4 10342 B9R1.7 O=CCN1CCC(F)C1 Amb35591920 [0,1,0,1,0,0|1,0,0]=3 10343 B9R1.7 O=CC[C@H]1CCC(=O)C1 Amb27961372 [0,1,0,1,0,0|0,0,1]=3 10344 B9R1.7 OC1CCC(CCS)C1 Amb27835966 [0,1,0,1,0,0|0,1,1]=4 10345 B9R1.7 OCCC1C=CC(O)C1 Amb27486502 [0,1,0,1,0,0|2,0,0]=4 10346 B9R1.7 OCC[C@@H]1CC[C@H](O)C1 Amb28070933 [0,1,0,1,0,0|0,0,2]=4 10347 B9R1.7 [C-]#[N+]CC1CCC(F)C1 Amb27793611 [0,1,0,1,0,0|2,0,0]=4 10348 B9R1.7 [C-]#[N+]CC1CC[C@@H](C)O1 Amb33422992 [0,1,0,1,0,0|2,0,0]=4 10349 B9R1.8 BrC=C=C1CCCCC1 Amb27796378 [0,1,0,1,0,0|1,0,1]=4 10350 B9R1.8 BrCC=C1CCCCC1 Amb27841870 [0,1,0,1,0,0|1,0,1]=4 10351 B9R1.8 BrCCC1CC=CCC1 Amb24711406 [0,1,0,1,0,0|1,0,1]=4 10352 B9R1.8 BrCCC1CCCCC1 Amb3940145 [0,1,0,1,0,0|1,0,1]=4 10353 B9R1.8 BrCCC1CCCCN1 Amb1102639 [0,1,0,1,0,0|1,0,1]=4 10354 B9R1.8 BrCCC1CCCCN1 Amb22284142 [0,1,0,1,0,0|1,0,1]=4 10355 B9R1.8 BrCCC1CCCCO1 Amb24480305 [0,1,0,1,0,0|0,0,2]=4 10356 B9R1.8 BrCCC1CCCNC1 Amb22274545 [0,1,0,1,0,0|1,0,1]=4 10357 B9R1.8 BrCCC1CCCNC1 Amb32412708 [0,1,0,1,0,0|1,0,1]=4 10358 B9R1.8 BrCCC1CCCOC1 Amb33546512 [0,1,0,1,0,0|1,0,1]=4 10359 B9R1.8 BrCCC1CCCSC1 Amb33008117 [0,1,0,1,0,0|1,0,1]=4 10360 B9R1.8 BrCCC1CCNCC1 Amb18129678 [0,1,0,1,0,0|1,0,1]=4 10361 B9R1.8 BrCCC1CCOCC1 Amb6572392 [0,1,0,1,0,0|1,0,1]=4 10362 B9R1.8 BrCCN1CCCCC1 Amb10608903 [0,1,0,1,0,0|1,0,1]=4 10363 B9R1.8 BrCCN1CCCCC1 Amb19373647 [0,1,0,1,0,0|1,0,1]=4 10364 B9R1.8 BrCOC1CCCCC1 Amb28194039 [0,1,0,1,0,0|1,0,1]=4 10365 B9R1.8 Br[Mg]CC1CCCCC1 Amb22000557 [0,1,0,1,0,0|1,0,1]=4 10366 B9R1.8 Br\C=C\C1CCCCC1 Amb27666335 [0,1,0,1,0,0|1,0,0]=3 10367 B9R1.8 Br\C=C\C1CCCOC1 Amb33135176 [0,1,0,1,0,0|1,0,1]=4 10368 B9R1.8 Br\C=C\C1CCCSC1 Amb33135499 [0,1,0,1,0,0|1,0,1]=4 10369 B9R1.8 Br\C=C\C1CCOCC1 Amb33135151 [0,1,0,1,0,0|1,0,1]=4 10370 B9R1.8 Br\C=C\C1CCSCC1 Amb33135229 [0,1,0,1,0,0|1,0,1]=4 10371 B9R1.8 Br\C=C\N1CCCCC1 Amb27985247 [0,1,0,1,0,0|1,0,1]=4 10372 B9R1.8 C#CCC1CCCCC1 Amb2724661 [0,1,0,1,0,0|1,0,1]=4 10373 B9R1.8 C#CCC1CCCCN1 Amb18280972 [0,1,0,1,0,0|1,0,1]=4 10374 B9R1.8 C#CCC1CCCCN1 Amb31156147 [0,1,0,1,0,0|1,0,1]=4 10375 B9R1.8 C#CCC1CCCCO1 Amb33375591 [0,1,0,1,0,0|1,0,1]=4 10376 B9R1.8 C#CCC1CCCNC1 Amb26529268 [0,1,0,1,0,0|1,0,1]=4 10377 B9R1.8 C#CCC1CCCNC1 Amb33542286 [0,1,0,1,0,0|1,0,1]=4 10378 B9R1.8 C#CCC1CCCOC1 Amb33322143 [0,1,0,1,0,0|1,0,1]=4 10379 B9R1.8 C#CCC1CCCSC1 Amb32726226 [0,1,0,1,0,0|1,0,1]=4 10380 B9R1.8 C#CCC1CCNCC1 Amb25114369 [0,1,0,1,0,0|1,0,1]=4 10381 B9R1.8 C#CCC1CCNCC1 Amb31188146 [0,1,0,1,0,0|1,0,1]=4 10382 B9R1.8 C#CCC1CCOCC1 Amb27158430 [0,1,0,1,0,0|1,0,1]=4 10383 B9R1.8 C#CCN1CCCCC1 Amb4471406 [0,1,0,1,0,0|1,0,1]=4 10384 B9R1.8 C#CNC1CCCCC1 Amb27196165 [0,1,0,1,0,0|1,0,1]=4 10385 B9R1.8 C#NCC1CCCCC1 Amb31132457 [0,1,0,1,0,0|1,0,1]=4 10386 B9R1.8 C=C=CC1CCCCC1 Amb19930168 [0,1,0,1,0,0|1,0,0]=3 10387 B9R1.8 C=C=CN1CCCCC1 Amb27159312 [0,1,0,1,0,0|2,0,0]=4 10388 B9R1.8 C=CC=C1CCCCC1 Amb27945364 [0,1,0,1,0,0|1,0,1]=4 10389 B9R1.8 C=CCC1=CCCCC1 Amb26318373 [0,1,0,1,0,0|1,0,1]=4 10390 B9R1.8 C=CCC1CCCCC1 Amb3940551 [0,1,0,1,0,0|1,0,0]=3 10391 B9R1.8 C=CCC1CCCCN1 Amb18967413 [0,1,0,1,0,0|1,0,0]=3 10392 B9R1.8 C=CCC1CCCCO1 Amb33483361 [0,1,0,1,0,0|1,0,0]=3 10393 B9R1.8 C=CCC1CCCNC1 Amb25868474 [0,1,0,1,0,0|1,0,0]=3 10394 B9R1.8 C=CCC1CCNCC1 Amb24744402 [0,1,0,1,0,0|1,0,0]=3 10395 B9R1.8 C=CCC1CCOCC1 Amb27769214 [0,1,0,1,0,0|1,0,0]=3 10396 B9R1.8 C=CCC1CNCCN1 Amb27630659 [0,1,0,1,0,0|2,0,0]=4 10397 B9R1.8 C=CCC1COCCN1 Amb28049059 [0,1,0,1,0,0|2,0,0]=4 10398 B9R1.8 C=CCC1COCCO1 Amb25689792 [0,1,0,1,0,0|2,0,0]=4 10399 B9R1.8 C=CCN1CCCCC1 Amb13777311 [0,1,0,1,0,0|1,0,0]=3 10400 B9R1.8 C=CCN1CCNCC1 Amb1995321 [0,1,0,1,0,0|2,0,0]=4 10401 B9R1.8 C=CCN1CCNCC1 Amb20620194 [0,1,0,1,0,0|2,0,0]=4 10402 B9R1.8 C=CCN1CCOCC1 Amb17933926 [0,1,0,1,0,0|2,0,0]=4 10403 B9R1.8 C=CC[C@@H]1CCCCN1 Amb27175286 [0,1,0,1,0,0|1,0,0]=3 10404 B9R1.8 C=CC[C@@H]1CCCOC1 Amb27466472 [0,1,0,1,0,0|1,0,0]=3 10405 B9R1.8 C=CC[C@@H]1CCCSC1 Amb28285315 [0,1,0,1,0,0|1,0,0]=3 10406 B9R1.8 C=CC[C@H]1CCCCN1 Amb28341851 [0,1,0,1,0,0|1,0,0]=3 10407 B9R1.8 C=CC[C@H]1CCCOC1 Amb27248649 [0,1,0,1,0,0|1,0,0]=3 10408 B9R1.8 C=CC[C@H]1COCCN1 Amb27404577 [0,1,0,1,0,0|2,0,0]=4 10409 B9R1.8 C=COC1CCCCC1 Amb4017480 [0,1,0,1,0,0|1,0,0]=3 10410 B9R1.8 C=COC1CCCCO1 Amb22730655 [0,1,0,1,0,0|2,0,0]=4 10411 B9R1.8 C=COC1CCOCC1 Amb27591916 [0,1,0,1,0,0|2,0,0]=4 10412 B9R1.8 CC#CC1CCCCC1 Amb6336488 [0,1,0,1,0,0|1,0,1]=4 10413 B9R1.8 CCCC1=NCCCC1 Amb27266018 [0,1,0,1,0,0|1,0,1]=4 10414 B9R1.8 CCCC1C=CCCC1 Amb27644637 [0,1,0,1,0,0|1,0,0]=3 10415 B9R1.8 CCCC1CC=CCN1 Amb27195040 [0,1,0,1,0,0|1,0,1]=4 10416 B9R1.8 CCCC1CCC=CO1 Amb27423642 [0,1,0,1,0,0|0,0,1]=3 10417 B9R1.8 CCCC1CCCCC1 Amb22336542 [0,1,0,1,0,0|1,0,1]=4 10418 B9R1.8 CCCC1CCCCN1 Amb2235347 [0,1,0,1,0,0|1,0,1]=4 10419 B9R1.8 CCCC1CCCCN1 Amb33549801 [0,1,0,1,0,0|1,0,1]=4 10420 B9R1.8 CCCC1CCCNC1 Amb18285007 [0,1,0,1,0,0|1,0,1]=4 10421 B9R1.8 CCCC1CCCNC1 Amb33551237 [0,1,0,1,0,0|1,0,1]=4 10422 B9R1.8 CCCC1CCNCC1 Amb10553113 [0,1,0,1,0,0|1,0,1]=4 10423 B9R1.8 CCCC1CCNCC1 Amb33529751 [0,1,0,1,0,0|1,0,1]=4 10424 B9R1.8 CCCC1CNCCN1 Amb20667630 [0,1,0,1,0,0|1,0,1]=4 10425 B9R1.8 CCCC1CNCCO1 Amb22059500 [0,1,0,1,0,0|0,0,2]=4 10426 B9R1.8 CCCC1COCCN1 Amb10607878 [0,1,0,1,0,0|1,0,1]=4 10427 B9R1.8 CCCC1NCCCS1 Amb4032842 [0,1,0,1,0,0|0,1,1]=4 10428 B9R1.8 CCCN1CC=CCC1 Amb32455985 [0,1,0,1,0,0|1,0,1]=4 10429 B9R1.8 CCCN1CCCCN1 Amb27783473 [0,1,0,1,0,0|1,0,1]=4 10430 B9R1.8 CCCN1CCCOC1 Amb27628068 [0,1,0,1,0,0|2,0,0]=4 10431 B9R1.8 CCC[C@@H]1CNCCO1 Amb27974093 [0,1,0,1,0,0|0,0,2]=4 10432 B9R1.8 CCC[C@H]1CNCCN1 Amb28067104 [0,1,0,1,0,0|1,0,1]=4 10433 B9R1.8 CCC[C@H]1CNCCO1 Amb28385328 [0,1,0,1,0,0|0,0,2]=4 10434 B9R1.8 CCNC1CC=CCC1 Amb27648453 [0,1,0,1,0,0|1,0,1]=4 10435 B9R1.8 CCNC1CCCCC1 Amb3939154 [0,1,0,1,0,0|1,0,1]=4 10436 B9R1.8 CCNC1CCCCC1 Amb532241 [0,1,0,1,0,0|1,0,1]=4 10437 B9R1.8 CCNC1CCCOC1 Amb27837490 [0,1,0,1,0,0|2,0,0]=4 10438 B9R1.8 CCNC1CCCOC1 Amb28934972 [0,1,0,1,0,0|2,0,0]=4 10439 B9R1.8 CCN[C@@H]1CCCNC1 Amb27882911 [0,1,0,1,0,0|2,0,0]=4 10440 B9R1.8 CCOC1CCC=CO1 Amb6600548 [0,1,0,1,0,0|0,0,2]=4 10441 B9R1.8 CCOC1CCCCN1 Amb27765495 [0,1,0,1,0,0|1,0,1]=4 10442 B9R1.8 CCOC1CCCCO1 Amb4016388 [0,1,0,1,0,0|0,0,2]=4 10443 B9R1.8 CCOC1CCCNC1 Amb19889821 [0,1,0,1,0,0|2,0,0]=4 10444 B9R1.8 CCOC1CCCNC1 Amb9752811 [0,1,0,1,0,0|2,0,0]=4 10445 B9R1.8 CCO[C@@H]1CCCNC1 Amb24559280 [0,1,0,1,0,0|2,0,0]=4 10446 B9R1.8 CCO[C@H]1CCCNC1 Amb24478793 [0,1,0,1,0,0|2,0,0]=4 10447 B9R1.8 CCSC1CCCNC1 Amb18956223 [0,1,0,1,0,0|2,0,0]=4 10448 B9R1.8 CNCC1CC=CCC1 Amb6718986 [0,1,0,1,0,0|1,0,1]=4 10449 B9R1.8 CNCC1CCCCC1 Amb1117772 [0,1,0,1,0,0|1,0,1]=4 10450 B9R1.8 CNCC1CCCCC1 Amb2119455 [0,1,0,1,0,0|1,0,1]=4 10451 B9R1.8 CNCC1CCCCN1 Amb18281799 [0,1,0,1,0,0|1,0,1]=4 10452 B9R1.8 CNCC1CCCCN1 Amb32752949 [0,1,0,1,0,0|1,0,1]=4 10453 B9R1.8 CNCC1CCCCO1 Amb8503254 [0,1,0,1,0,0|0,0,2]=4 10454 B9R1.8 CNCC1CCCCO1 Amb9258705 [0,1,0,1,0,0|0,0,2]=4 10455 B9R1.8 CNCC1CCCCS1 Amb27826766 [0,1,0,1,0,0|0,1,1]=4 10456 B9R1.8 CNCC1CCCNC1 Amb16186636 [0,1,0,1,0,0|2,0,0]=4 10457 B9R1.8 CNCC1CCCNC1 Amb21959752 [0,1,0,1,0,0|2,0,0]=4 10458 B9R1.8 CNCC1CCCOC1 Amb18288267 [0,1,0,1,0,0|2,0,0]=4 10459 B9R1.8 CNCC1CCCOC1 Amb30869456 [0,1,0,1,0,0|2,0,0]=4 10460 B9R1.8 CNCC1CCCSC1 Amb27956471 [0,1,0,1,0,0|2,0,0]=4 10461 B9R1.8 CNCC1CCNCC1 Amb16186634 [0,1,0,1,0,0|2,0,0]=4 10462 B9R1.8 CNCC1CCNCC1 Amb32409615 [0,1,0,1,0,0|2,0,0]=4 10463 B9R1.8 CNCC1CCOCC1 Amb22886194 [0,1,0,1,0,0|2,0,0]=4 10464 B9R1.8 CNCC1CCOCC1 Amb3941338 [0,1,0,1,0,0|2,0,0]=4 10465 B9R1.8 CNCC1CCSCC1 Amb6572256 [0,1,0,1,0,0|2,0,0]=4 10466 B9R1.8 CNC[C@@H]1CCCCN1 Amb24477709 [0,1,0,1,0,0|1,0,1]=4 10467 B9R1.8 CNC[C@@H]1CCCCN1 Amb32660930 [0,1,0,1,0,0|1,0,1]=4 10468 B9R1.8 CNC[C@@H]1CCCNC1 Amb27425112 [0,1,0,1,0,0|2,0,0]=4 10469 B9R1.8 CNC[C@@H]1CCCNC1 Amb32659594 [0,1,0,1,0,0|2,0,0]=4 10470 B9R1.8 CNC[C@H]1CCCCN1 Amb25115403 [0,1,0,1,0,0|1,0,1]=4 10471 B9R1.8 CNC[C@H]1CCCCN1 Amb32671018 [0,1,0,1,0,0|1,0,1]=4 10472 B9R1.8 CNC[C@H]1CCCNC1 Amb27982338 [0,1,0,1,0,0|2,0,0]=4 10473 B9R1.8 CNC[C@H]1CCCNC1 Amb32656286 [0,1,0,1,0,0|2,0,0]=4 10474 B9R1.8 COCC1CCCCC1 Amb27858995 [0,1,0,1,0,0|0,0,2]=4 10475 B9R1.8 COCC1CCCCN1 Amb8503235 [0,1,0,1,0,0|1,0,1]=4 10476 B9R1.8 COCC1CCCCN1 Amb9722134 [0,1,0,1,0,0|1,0,1]=4 10477 B9R1.8 COCC1CCCNC1 Amb2140573 [0,1,0,1,0,0|2,0,0]=4 10478 B9R1.8 COCC1CCCNC1 Amb9719115 [0,1,0,1,0,0|2,0,0]=4 10479 B9R1.8 COCC1CCNCC1 Amb2235515 [0,1,0,1,0,0|2,0,0]=4 10480 B9R1.8 COCC1CCNCC1 Amb33528889 [0,1,0,1,0,0|2,0,0]=4 10481 B9R1.8 COC[C@@H]1CCCCN1 Amb22748820 [0,1,0,1,0,0|1,0,1]=4 10482 B9R1.8 COC[C@@H]1CCCNC1 Amb34158327 [0,1,0,1,0,0|2,0,0]=4 10483 B9R1.8 COC[C@H]1CCCCN1 Amb33871620 [0,1,0,1,0,0|1,0,1]=4 10484 B9R1.8 COC[C@H]1CCCNC1 Amb34155960 [0,1,0,1,0,0|2,0,0]=4 10485 B9R1.8 CSCC1CCCCN1 Amb2235851 [0,1,0,1,0,0|1,0,1]=4 10486 B9R1.8 CSCC1CCCCN1 Amb2237237 [0,1,0,1,0,0|1,0,1]=4 10487 B9R1.8 CSCC1CCCNC1 Amb17503123 [0,1,0,1,0,0|2,0,0]=4 10488 B9R1.8 CSCC1CCCNC1 Amb21959895 [0,1,0,1,0,0|2,0,0]=4 10489 B9R1.8 CSCC1CCNCC1 Amb17503024 [0,1,0,1,0,0|2,0,0]=4 10490 B9R1.8 CSCC1CCNCC1 Amb21959991 [0,1,0,1,0,0|2,0,0]=4 10491 B9R1.8 C\C=C/[C@@H]1CCCCN1 Amb27640688 [0,1,0,1,0,0|1,0,1]=4 10492 B9R1.8 C\C=C/[C@H]1CCCCN1 Amb27196218 [0,1,0,1,0,0|1,0,1]=4 10493 B9R1.8 C\C=C\C1CCCCC1 Amb34915057 [0,1,0,1,0,0|1,0,0]=3 10494 B9R1.8 C\C=C\C1CCCCN1 Amb28398073 [0,1,0,1,0,0|1,0,1]=4 10495 B9R1.8 C\C=C\[C@H]1CCCCN1 Amb28245384 [0,1,0,1,0,0|1,0,1]=4 10496 B9R1.8 C\C=N\C1CCCCC1 Amb24113142 [0,1,0,1,0,0|1,0,0]=3 10497 B9R1.8 C\N=C\C1CCCCC1 Amb27837565 [0,1,0,1,0,0|1,0,0]=3 10498 B9R1.8 ClCCC1C=CCCC1 Amb17672831 [0,1,0,1,0,0|1,0,0]=3 10499 B9R1.8 ClCCC1CCCCC1 Amb9004316 [0,1,0,1,0,0|1,0,1]=4 10500 B9R1.8 ClCCC1CCCCN1 Amb6740274 [0,1,0,1,0,0|1,0,1]=4 10501 B9R1.8 ClCCC1CCCCN1 Amb8629028 [0,1,0,1,0,0|1,0,1]=4 10502 B9R1.8 ClCCC1CCCCO1 Amb27168293 [0,1,0,1,0,0|0,0,2]=4 10503 B9R1.8 ClCCC1CCCNC1 Amb22299848 [0,1,0,1,0,0|1,0,1]=4 10504 B9R1.8 ClCCC1CCNCC1 Amb33813406 [0,1,0,1,0,0|1,0,1]=4 10505 B9R1.8 ClCCC1CCOCC1 Amb22299854 [0,1,0,1,0,0|1,0,1]=4 10506 B9R1.8 ClCCN1CCCCC1 Amb1154247 [0,1,0,1,0,0|1,0,1]=4 10507 B9R1.8 ClCCN1CCCCC1 Amb6298804 [0,1,0,1,0,0|1,0,1]=4 10508 B9R1.8 ClCNC1CCCCC1 Amb27469157 [0,1,0,1,0,0|1,0,1]=4 10509 B9R1.8 ClCOC1CCCCC1 Amb24323400 [0,1,0,1,0,0|1,0,1]=4 10510 B9R1.8 ClCSC1CCCCC1 Amb28200869 [0,1,0,1,0,0|1,0,1]=4 10511 B9R1.8 FCCC1CCCCN1 Amb26516169 [0,1,0,1,0,0|1,0,1]=4 10512 B9R1.8 FCCC1CCCNC1 Amb21959219 [0,1,0,1,0,0|1,0,1]=4 10513 B9R1.8 FCCC1CCCNC1 Amb32667207 [0,1,0,1,0,0|1,0,1]=4 10514 B9R1.8 FCCC1CCNCC1 Amb22274784 [0,1,0,1,0,0|1,0,1]=4 10515 B9R1.8 FCCC1CCNCC1 Amb24055930 [0,1,0,1,0,0|1,0,1]=4 10516 B9R1.8 FCCN1CCCCC1 Amb26567757 [0,1,0,1,0,0|1,0,1]=4 10517 B9R1.8 ICCC1CCCCC1 Amb25046814 [0,1,0,1,0,0|1,0,1]=4 10518 B9R1.8 ICCC1CCCCO1 Amb35655392 [0,1,0,1,0,0|0,0,2]=4 10519 B9R1.8 ICCC1CCNCC1 Amb22296927 [0,1,0,1,0,0|1,0,1]=4 10520 B9R1.8 ICCC1CCOCC1 Amb22296928 [0,1,0,1,0,0|1,0,1]=4 10521 B9R1.8 ICCN1CCCCC1 Amb25063410 [0,1,0,1,0,0|1,0,1]=4 10522 B9R1.8 ICCN1CCCCC1 Amb33620512 [0,1,0,1,0,0|1,0,1]=4 10523 B9R1.8 N#CC=C1CCCCC1 Amb16233597 [0,1,0,1,0,0|1,0,1]=4 10524 B9R1.8 N#CCC1C=CCCC1 Amb18642023 [0,1,0,1,0,0|1,0,1]=4 10525 B9R1.8 N#CCC1CCCCC1 Amb6260767 [0,1,0,1,0,0|1,0,1]=4 10526 B9R1.8 N#CCC1CCCCN1 Amb18642252 [0,1,0,1,0,0|1,0,1]=4 10527 B9R1.8 N#CCC1CCCCO1 Amb9455307 [0,1,0,1,0,0|1,0,1]=4 10528 B9R1.8 N#CCC1CCCNC1 Amb13885397 [0,1,0,1,0,0|1,0,1]=4 10529 B9R1.8 N#CCC1CCCNC1 Amb21960803 [0,1,0,1,0,0|1,0,1]=4 10530 B9R1.8 N#CCC1CCCNC1 Amb22587510 [0,1,0,1,0,0|1,0,1]=4 10531 B9R1.8 N#CCC1CCCOC1 Amb9753230 [0,1,0,1,0,0|1,0,1]=4 10532 B9R1.8 N#CCC1CCCSC1 Amb32726308 [0,1,0,1,0,0|1,0,1]=4 10533 B9R1.8 N#CCC1CCNCC1 Amb13885392 [0,1,0,1,0,0|1,0,1]=4 10534 B9R1.8 N#CCC1CCNCC1 Amb21912466 [0,1,0,1,0,0|1,0,1]=4 10535 B9R1.8 N#CCC1CCOCC1 Amb10071292 [0,1,0,1,0,0|1,0,1]=4 10536 B9R1.8 N#CCN1CCCCC1 Amb2690383 [0,1,0,1,0,0|1,0,1]=4 10537 B9R1.8 N#CNC1CCCCC1 Amb27837429 [0,1,0,1,0,0|1,0,1]=4 10538 B9R1.8 N=C=NC1CCCCC1 Amb27636019 [0,1,0,1,0,0|1,0,1]=4 10539 B9R1.8 NCC=C1CCCCC1 Amb17605580 [0,1,0,1,0,0|1,0,1]=4 10540 B9R1.8 NCCC1C=CCCC1 Amb25707655 [0,1,0,1,0,0|1,0,0]=3 10541 B9R1.8 NCCC1CC=CCC1 Amb26355165 [0,1,0,1,0,0|1,0,1]=4 10542 B9R1.8 NCCC1CC=CCC1 Amb32434790 [0,1,0,1,0,0|1,0,1]=4 10543 B9R1.8 NCCC1CCC=CO1 Amb25743698 [0,1,0,1,0,0|0,0,2]=4 10544 B9R1.8 NCCC1CCCCC1 Amb6565256 [0,1,0,1,0,0|1,0,1]=4 10545 B9R1.8 NCCC1CCCCC1 Amb839081 [0,1,0,1,0,0|1,0,1]=4 10546 B9R1.8 NCCC1CCCCN1 Amb16233732 [0,1,0,1,0,0|1,0,1]=4 10547 B9R1.8 NCCC1CCCCO1 Amb10067654 [0,1,0,1,0,0|0,0,2]=4 10548 B9R1.8 NCCC1CCCCO1 Amb2607669 [0,1,0,1,0,0|0,0,2]=4 10549 B9R1.8 NCCC1CCCNC1 Amb16186592 [0,1,0,1,0,0|1,0,1]=4 10550 B9R1.8 NCCC1CCCOC1 Amb10072965 [0,1,0,1,0,0|1,0,1]=4 10551 B9R1.8 NCCC1CCCSC1 Amb18199319 [0,1,0,1,0,0|1,0,1]=4 10552 B9R1.8 NCCC1CCNCC1 Amb2209234 [0,1,0,1,0,0|1,0,1]=4 10553 B9R1.8 NCCC1CCNCC1 Amb6761309 [0,1,0,1,0,0|1,0,1]=4 10554 B9R1.8 NCCC1CCNCC1 Amb844572 [0,1,0,1,0,0|1,0,1]=4 10555 B9R1.8 NCCC1CCOCC1 Amb10068548 [0,1,0,1,0,0|1,0,1]=4 10556 B9R1.8 NCCC1CCOCC1 Amb10068583 [0,1,0,1,0,0|1,0,1]=4 10557 B9R1.8 NCCC1CCSCC1 Amb18199237 [0,1,0,1,0,0|1,0,1]=4 10558 B9R1.8 NCCC1CCSCC1 Amb30585203 [0,1,0,1,0,0|1,0,1]=4 10559 B9R1.8 NCCN1CCCCC1 Amb1155423 [0,1,0,1,0,0|1,0,1]=4 10560 B9R1.8 NCCN1CCCCC1 Amb20171369 [0,1,0,1,0,0|1,0,1]=4 10561 B9R1.8 NCC[C@H]1CCCCN1 Amb25041454 [0,1,0,1,0,0|1,0,1]=4 10562 B9R1.8 NNCC1CCCCC1 Amb2691316 [0,1,0,1,0,0|1,0,1]=4 10563 B9R1.8 NNCC1CCCCC1 Amb6243006 [0,1,0,1,0,0|1,0,1]=4 10564 B9R1.8 NNCC1CCCCC1 Amb9677386 [0,1,0,1,0,0|1,0,1]=4 10565 B9R1.8 NNCC1CCCCO1 Amb13952745 [0,1,0,1,0,0|2,0,0]=4 10566 B9R1.8 NNCC1CCCCO1 Amb28990878 [0,1,0,1,0,0|2,0,0]=4 10567 B9R1.8 NNCC1CCCCO1 Amb9455279 [0,1,0,1,0,0|2,0,0]=4 10568 B9R1.8 NNCC1CCCCS1 Amb27779017 [0,1,0,1,0,0|2,0,0]=4 10569 B9R1.8 NNCC1CCCOC1 Amb26348570 [0,1,0,1,0,0|2,0,0]=4 10570 B9R1.8 NNCC1CCCOC1 Amb31291572 [0,1,0,1,0,0|2,0,0]=4 10571 B9R1.8 NNCC1CCCSC1 Amb26478878 [0,1,0,1,0,0|2,0,0]=4 10572 B9R1.8 NNCC1CCOCC1 Amb19515389 [0,1,0,1,0,0|2,0,0]=4 10573 B9R1.8 NNCC1CCOCC1 Amb22002230 [0,1,0,1,0,0|2,0,0]=4 10574 B9R1.8 NNCC1CCOCC1 Amb28990950 [0,1,0,1,0,0|2,0,0]=4 10575 B9R1.8 NNCC1CCSCC1 Amb27635332 [0,1,0,1,0,0|2,0,0]=4 10576 B9R1.8 NOCC1CCCCC1 Amb10976085 [0,1,0,1,0,0|0,0,2]=4 10577 B9R1.8 NOCC1CCCCO1 Amb24584902 [0,1,0,1,0,0|2,0,0]=4 10578 B9R1.8 NOCC1CCCOC1 Amb33079004 [0,1,0,1,0,0|2,0,0]=4 10579 B9R1.8 NOCC1CCCSC1 Amb33224513 [0,1,0,1,0,0|2,0,0]=4 10580 B9R1.8 NOCC1CCOCC1 Amb24477835 [0,1,0,1,0,0|2,0,0]=4 10581 B9R1.8 NOCC1CCSCC1 Amb27613139 [0,1,0,1,0,0|2,0,0]=4 10582 B9R1.8 N\C=N\C1CCCCC1 Amb27166482 [0,1,0,1,0,0|1,0,0]=3 10583 B9R1.8 N\N=C\C1CCCCC1 Amb27837653 [0,1,0,1,0,0|1,0,0]=3 10584 B9R1.8 N\N=C\C1CCCCO1 Amb35622338 [0,1,0,1,0,0|2,0,0]=4 10585 B9R1.8 O=C=NC1CCCCC1 Amb3939315 [0,1,0,1,0,0|0,0,1]=3 10586 B9R1.8 O=C=NC1CCCCN1 Amb27199827 [0,1,0,1,0,0|1,0,1]=4 10587 B9R1.8 O=C=NC1CCCCO1 Amb25790678 [0,1,0,1,0,0|1,0,1]=4 10588 B9R1.8 O=C=NC1CCCOC1 Amb18949056 [0,1,0,1,0,0|1,0,1]=4 10589 B9R1.8 O=C=NC1CCCSC1 Amb24476024 [0,1,0,1,0,0|1,0,1]=4 10590 B9R1.8 O=C=NC1CCOCC1 Amb17194097 [0,1,0,1,0,0|1,0,1]=4 10591 B9R1.8 O=C=N[C@@H]1CCCCO1 Amb27858949 [0,1,0,1,0,0|1,0,1]=4 10592 B9R1.8 O=CC=C1CCCCC1 Amb17593282 [0,1,0,1,0,0|0,0,1]=3 10593 B9R1.8 O=CC=C1CCSCC1 Amb27180593 [0,1,0,1,0,0|0,0,2]=4 10594 B9R1.8 O=CCC1=CCCCC1 Amb17593283 [0,1,0,1,0,0|0,0,1]=3 10595 B9R1.8 O=CCC1=COCCC1 Amb33414885 [0,1,0,1,0,0|0,0,2]=4 10596 B9R1.8 O=CCC1CC=CCC1 Amb18642222 [0,1,0,1,0,0|0,0,1]=3 10597 B9R1.8 O=CCC1CCCCC1 Amb10070777 [0,1,0,1,0,0|0,0,0]=2 10598 B9R1.8 O=CCC1CCCCN1 Amb18203260 [0,1,0,1,0,0|0,0,0]=2 10599 B9R1.8 O=CCC1CCCCO1 Amb25888588 [0,1,0,1,0,0|0,0,0]=2 10600 B9R1.8 O=CCC1CCCOC1 Amb22411365 [0,1,0,1,0,0|0,0,0]=2 10601 B9R1.8 O=CCC1CCCSC1 Amb27433487 [0,1,0,1,0,0|0,0,0]=2 10602 B9R1.8 O=CCC1CCOCC1 Amb33542150 [0,1,0,1,0,0|0,0,0]=2 10603 B9R1.8 O=CCC1CCSCC1 Amb2683358 [0,1,0,1,0,0|0,0,0]=2 10604 B9R1.8 O=CCC1CNCCO1 Amb27875480 [0,1,0,1,0,0|1,0,0]=3 10605 B9R1.8 O=CCC1OCCCO1 Amb27875172 [0,1,0,1,0,0|1,0,0]=3 10606 B9R1.8 O=CCN1CCCCC1 Amb20248700 [0,1,0,1,0,0|0,0,0]=2 10607 B9R1.8 O=CCN1CCCCC1 Amb32409629 [0,1,0,1,0,0|0,0,0]=2 10608 B9R1.8 O=CCN1CCNCC1 Amb18957932 [0,1,0,1,0,0|1,0,0]=3 10609 B9R1.8 O=CCN1CCOCC1 Amb2696304 [0,1,0,1,0,0|1,0,0]=3 10610 B9R1.8 O=CCN1CCOCC1 Amb33870488 [0,1,0,1,0,0|1,0,0]=3 10611 B9R1.8 O=CCN1CCSCC1 Amb27837482 [0,1,0,1,0,0|1,0,0]=3 10612 B9R1.8 O=CC[C@@H]1COCCO1 Amb27185723 [0,1,0,1,0,0|1,0,0]=3 10613 B9R1.8 O=CNC1=CCCCC1 Amb16192555 [0,1,0,1,0,0|0,0,2]=4 10614 B9R1.8 O=CNN1CCCCC1 Amb27985557 [0,1,0,1,0,0|1,0,0]=3 10615 B9R1.8 O=NOC1CCCCC1 Amb21858475 [0,1,0,1,0,0|1,0,0]=3 10616 B9R1.8 OCC=C1CCCCC1 Amb25783847 [0,1,0,1,0,0|0,0,2]=4 10617 B9R1.8 OCCC1C=CCCC1 Amb17593314 [0,1,0,1,0,0|1,0,0]=3 10618 B9R1.8 OCCC1CC=CCC1 Amb17593319 [0,1,0,1,0,0|1,0,1]=4 10619 B9R1.8 OCCC1CCC=CO1 Amb24481996 [0,1,0,1,0,0|0,0,2]=4 10620 B9R1.8 OCCC1CCCCC1 Amb3939314 [0,1,0,1,0,0|0,0,2]=4 10621 B9R1.8 OCCC1CCCCN1 Amb22492461 [0,1,0,1,0,0|0,0,2]=4 10622 B9R1.8 OCCC1CCCCN1 Amb9702818 [0,1,0,1,0,0|0,0,2]=4 10623 B9R1.8 OCCC1CCCCO1 Amb5846625 [0,1,0,1,0,0|0,0,2]=4 10624 B9R1.8 OCCC1CCCNC1 Amb19308093 [0,1,0,1,0,0|0,0,2]=4 10625 B9R1.8 OCCC1CCCNC1 Amb2694770 [0,1,0,1,0,0|0,0,2]=4 10626 B9R1.8 OCCC1CCCOC1 Amb33544109 [0,1,0,1,0,0|0,0,2]=4 10627 B9R1.8 OCCC1CCCSC1 Amb18202274 [0,1,0,1,0,0|0,0,2]=4 10628 B9R1.8 OCCC1CCNCC1 Amb22234816 [0,1,0,1,0,0|0,0,2]=4 10629 B9R1.8 OCCC1CCNCC1 Amb2690382 [0,1,0,1,0,0|0,0,2]=4 10630 B9R1.8 OCCC1CCOCC1 Amb6572393 [0,1,0,1,0,0|0,0,2]=4 10631 B9R1.8 OCCC1CCSCC1 Amb18831400 [0,1,0,1,0,0|0,0,2]=4 10632 B9R1.8 OCCN1CCCCC1 Amb2793063 [0,1,0,1,0,0|0,0,2]=4 10633 B9R1.8 OCC[C@@H]1CCCCN1 Amb22168885 [0,1,0,1,0,0|0,0,2]=4 10634 B9R1.8 OCC[C@@H]1CCCCN1 Amb8628480 [0,1,0,1,0,0|0,0,2]=4 10635 B9R1.8 OCC[C@H]1CCCCN1 Amb17619440 [0,1,0,1,0,0|0,0,2]=4 10636 B9R1.8 OCC[C@H]1CCCCN1 Amb33788981 [0,1,0,1,0,0|0,0,2]=4 10637 B9R1.8 OCC[C@H]1CCCNC1 Amb26629279 [0,1,0,1,0,0|0,0,2]=4 10638 B9R1.8 ONCC1CCCCC1 Amb25251761 [0,1,0,1,0,0|0,0,2]=4 10639 B9R1.8 ONCC1CCCCO1 Amb33378815 [0,1,0,1,0,0|1,0,1]=4 10640 B9R1.8 ONCC1CCCNC1 Amb27249317 [0,1,0,1,0,0|1,0,1]=4 10641 B9R1.8 ONCC1CCCOC1 Amb25084814 [0,1,0,1,0,0|1,0,1]=4 10642 B9R1.8 ONCC1CCCSC1 Amb26652449 [0,1,0,1,0,0|1,0,1]=4 10643 B9R1.8 ONCC1CCOCC1 Amb25736560 [0,1,0,1,0,0|1,0,1]=4 10644 B9R1.8 O\N=C\C1CCCCC1 Amb27771827 [0,1,0,1,0,0|0,0,1]=3 10645 B9R1.8 O\N=C\C1CCCCO1 Amb35743498 [0,1,0,1,0,0|1,0,1]=4 10646 B9R1.8 O\N=C\C1CCCSC1 Amb27956472 [0,1,0,1,0,0|1,0,1]=4 10647 B9R1.8 S=C=NC1CCCCC1 Amb1102131 [0,1,0,1,0,0|0,1,1]=4 10648 B9R1.8 S=CNC1CCCCC1 Amb1080578 [0,1,0,1,0,0|0,1,0]=3 10649 B9R1.8 SCCC1CC=CCC1 Amb33318637 [0,1,0,1,0,0|1,0,1]=4 10650 B9R1.8 SCCC1CCCCC1 Amb24368740 [0,1,0,1,0,0|0,1,1]=4 10651 B9R1.8 SCCC1CCCCN1 Amb17503520 [0,1,0,1,0,0|0,1,1]=4 10652 B9R1.8 SCCC1CCCCO1 Amb33377389 [0,1,0,1,0,0|0,0,2]=4 10653 B9R1.8 SCCC1CCCNC1 Amb22298478 [0,1,0,1,0,0|0,1,1]=4 10654 B9R1.8 SCCC1CCCOC1 Amb33321789 [0,1,0,1,0,0|0,1,1]=4 10655 B9R1.8 SCCC1CCCSC1 Amb33224506 [0,1,0,1,0,0|0,1,1]=4 10656 B9R1.8 SCCC1CCNCC1 Amb22297524 [0,1,0,1,0,0|0,1,1]=4 10657 B9R1.8 SCCC1CCOCC1 Amb22297642 [0,1,0,1,0,0|0,1,1]=4 10658 B9R1.8 SCCN1CCCCC1 Amb7776946 [0,1,0,1,0,0|0,1,1]=4 10659 B9R1.8 [C-]#[N+]CC1CCCCC1 Amb3973103 [0,1,0,1,0,0|1,0,1]=4 10660 B9R1.8 [C-]#[N+]CC1CCCCO1 Amb33375672 [0,1,0,1,0,0|2,0,0]=4 10661 B9R1.8 [C-]#[N+]CC1CCCOC1 Amb33322521 [0,1,0,1,0,0|2,0,0]=4 10662 B9R1.8 [C-]#[N+]CC1CCCSC1 Amb32726265 [0,1,0,1,0,0|2,0,0]=4 10663 B9R1.8 [C-]#[N+]CC1CCOCC1 Amb33419086 [0,1,0,1,0,0|2,0,0]=4 10664 B9R1.8 [N-]=[N+]=NC1CCCCC1 Amb9800287 [0,1,0,1,0,0|2,0,0]=4 10665 B9R1.9 C=CCCC1CC(=O)N1 Amb24524165 [0,1,0,1,0,0|0,0,2]=4 10666 B9R1.9 C=CCCN1CC(O)C1 Amb24647572 [0,1,0,1,0,0|2,0,0]=4 10667 B9R1.9 CC#CCC1CC(=O)N1 Amb27461472 [0,1,0,1,0,0|0,0,2]=4 10668 B9R1.9 CC1CC(CCCO)C1 Amb23456207 [0,1,0,1,0,0|0,0,2]=4 10669 B9R1.9 CC1CC(CN=C=O)C1 Amb29885117 [0,1,0,1,0,0|1,0,1]=4 10670 B9R1.9 CC1CC(CNC=O)C1 Amb30030901 [0,1,0,1,0,0|1,0,0]=3 10671 B9R1.9 CCCCC1=CC(=O)C1 Amb28199849 [0,1,0,1,0,0|0,0,1]=3 10672 B9R1.9 CCCCC1CC(O)C1 Amb27956599 [0,1,0,1,0,0|0,0,2]=4 10673 B9R1.9 CCCC[C@H]1CC(=O)N1 Amb27627588 [0,1,0,1,0,0|0,0,0]=2 10674 B9R1.9 CCCC[C@H]1C[C@H](Br)C1 Amb28121167 [0,1,0,1,0,0|1,0,1]=4 10675 B9R1.9 CCOCC1CC(=O)C1 Amb27830550 [0,1,0,1,0,0|1,0,0]=3 10676 B9R1.9 CN1CC(CNC=O)C1 Amb27490249 [0,1,0,1,0,0|2,0,0]=4 10677 B9R1.9 CNCCC1CC(C)C1 Amb27963211 [0,1,0,1,0,0|2,0,0]=4 10678 B9R1.9 COCCC1CC(=O)C1 Amb33457929 [0,1,0,1,0,0|1,0,0]=3 10679 B9R1.9 NCCCN1CC(=O)C1 Amb28313692 [0,1,0,1,0,0|2,0,0]=4 10680 B9R1.9 O=C1CC(OCCBr)N1 Amb27645730 [0,1,0,1,0,0|2,0,0]=4 10681 B9R1.9 O=C1CC(OCCCl)C1 Amb27632300 [0,1,0,1,0,0|2,0,0]=4 10682 B9R1.12 BrCCCC1CC=CC1 Amb32688152 [0,1,0,1,0,0|1,0,1]=4 10683 B9R1.12 BrCCCC1CCCC1 Amb19073227 [0,1,0,1,0,0|1,0,1]=4 10684 B9R1.12 BrCCCC1CCCO1 Amb18324625 [0,1,0,1,0,0|0,0,2]=4 10685 B9R1.12 BrCCCC1CCCS1 Amb32688088 [0,1,0,1,0,0|0,1,1]=4 10686 B9R1.12 BrCCCC1CCOC1 Amb26961533 [0,1,0,1,0,0|1,0,1]=4 10687 B9R1.12 BrCCCC1CCSC1 Amb33333809 [0,1,0,1,0,0|1,0,1]=4 10688 B9R1.12 BrCCCN1CCCC1 Amb8387805 [0,1,0,1,0,0|1,0,1]=4 10689 B9R1.12 BrCCCN1CCCC1 Amb8387806 [0,1,0,1,0,0|1,0,1]=4 10690 B9R1.12 BrCCC[C@@H]1CCCO1 Amb32688086 [0,1,0,1,0,0|0,0,2]=4 10691 B9R1.12 BrCCC[C@H]1CCCO1 Amb32688084 [0,1,0,1,0,0|0,0,2]=4 10692 B9R1.12 BrCCOC1CCCC1 Amb6255717 [0,1,0,1,0,0|1,0,1]=4 10693 B9R1.12 BrCCSC1CCCC1 Amb27219138 [0,1,0,1,0,0|1,0,1]=4 10694 B9R1.12 BrC\C=C\C1CCCC1 Amb28057257 [0,1,0,1,0,0|1,0,1]=4 10695 B9R1.12 C#CCCC1CCCC1 Amb28184950 [0,1,0,1,0,0|1,0,1]=4 10696 B9R1.12 C#CCCC1CCCO1 Amb33318295 [0,1,0,1,0,0|1,0,1]=4 10697 B9R1.12 C#CCCC1CCCS1 Amb33415383 [0,1,0,1,0,0|1,0,1]=4 10698 B9R1.12 C#CCCC1CCOC1 Amb33420699 [0,1,0,1,0,0|1,0,1]=4 10699 B9R1.12 C#CCCC1CCSC1 Amb33345425 [0,1,0,1,0,0|1,0,1]=4 10700 B9R1.12 C#CCCN1CCCC1 Amb23598313 [0,1,0,1,0,0|1,0,1]=4 10701 B9R1.12 C#CCCN1CCCC1 Amb34148599 [0,1,0,1,0,0|1,0,1]=4 10702 B9R1.12 C#CCC[C@@H]1CCCN1 Amb25759298 [0,1,0,1,0,0|1,0,1]=4 10703 B9R1.12 C#CCNC1CCCC1 Amb5262795 [0,1,0,1,0,0|1,0,1]=4 10704 B9R1.12 C#CCOC1CCCC1 Amb23598925 [0,1,0,1,0,0|1,0,1]=4 10705 B9R1.12 C=CCCC1=NCCC1 Amb28399369 [0,1,0,1,0,0|1,0,1]=4 10706 B9R1.12 C=CCCC1CC=CC1 Amb30031173 [0,1,0,1,0,0|1,0,1]=4 10707 B9R1.12 C=CCCC1CCCC1 Amb27838488 [0,1,0,1,0,0|1,0,0]=3 10708 B9R1.12 C=CCCC1CCCN1 Amb18642354 [0,1,0,1,0,0|1,0,0]=3 10709 B9R1.12 C=CCCC1CCNC1 Amb27231511 [0,1,0,1,0,0|1,0,0]=3 10710 B9R1.12 C=CCCN1CCCC1 Amb3940612 [0,1,0,1,0,0|1,0,0]=3 10711 B9R1.12 C=CCC[C@@H]1CCCN1 Amb27222217 [0,1,0,1,0,0|1,0,0]=3 10712 B9R1.12 C=CCC[C@@H]1CCOC1 Amb28366112 [0,1,0,1,0,0|1,0,0]=3 10713 B9R1.12 C=CCNC1CCCC1 Amb10609461 [0,1,0,1,0,0|1,0,0]=3 10714 B9R1.12 C=CCNC1CCCC1 Amb3940051 [0,1,0,1,0,0|1,0,0]=3 10715 B9R1.12 C=CCNC1CCNC1 Amb28070707 [0,1,0,1,0,0|2,0,0]=4 10716 B9R1.12 C=CCNC1CCOC1 Amb24457988 [0,1,0,1,0,0|2,0,0]=4 10717 B9R1.12 C=CCOC1CCNC1 Amb18989606 [0,1,0,1,0,0|2,0,0]=4 10718 B9R1.12 C=CCOC1CCNC1 Amb21954781 [0,1,0,1,0,0|2,0,0]=4 10719 B9R1.12 C=CCO[C@@H]1CCNC1 Amb33457281 [0,1,0,1,0,0|2,0,0]=4 10720 B9R1.12 C=CCO[C@@H]1CCNC1 Amb33457282 [0,1,0,1,0,0|2,0,0]=4 10721 B9R1.12 C=CCO[C@H]1CCNC1 Amb33217942 [0,1,0,1,0,0|2,0,0]=4 10722 B9R1.12 C=CCO[C@H]1CCNC1 Amb33217943 [0,1,0,1,0,0|2,0,0]=4 10723 B9R1.12 C=CCSC1CCNC1 Amb27477554 [0,1,0,1,0,0|2,0,0]=4 10724 B9R1.12 CCCCC1=CCCC1 Amb22227915 [0,1,0,1,0,0|1,0,1]=4 10725 B9R1.12 CCCCC1=NCCC1 Amb24053774 [0,1,0,1,0,0|1,0,1]=4 10726 B9R1.12 CCCCC1C=CCN1 Amb10608225 [0,1,0,1,0,0|1,0,0]=3 10727 B9R1.12 CCCCC1C=CCN1 Amb22587190 [0,1,0,1,0,0|1,0,0]=3 10728 B9R1.12 CCCCC1CC=CC1 Amb30032420 [0,1,0,1,0,0|1,0,0]=3 10729 B9R1.12 CCCCC1CCCC1 Amb22053873 [0,1,0,1,0,0|1,0,1]=4 10730 B9R1.12 CCCCC1CCCN1 Amb22587191 [0,1,0,1,0,0|1,0,1]=4 10731 B9R1.12 CCCCC1CCCN1 Amb9712880 [0,1,0,1,0,0|1,0,1]=4 10732 B9R1.12 CCCCC1CCCO1 Amb25238477 [0,1,0,1,0,0|0,0,2]=4 10733 B9R1.12 CCCCC1CCNC1 Amb2237160 [0,1,0,1,0,0|1,0,1]=4 10734 B9R1.12 CCCCC1OCCO1 Amb28364546 [0,1,0,1,0,0|0,0,2]=4 10735 B9R1.12 CCCCN1CCCC1 Amb8389335 [0,1,0,1,0,0|1,0,1]=4 10736 B9R1.12 CCCCN1CCCN1 Amb27778675 [0,1,0,1,0,0|1,0,1]=4 10737 B9R1.12 CCCCN1CCCO1 Amb28049539 [0,1,0,1,0,0|0,0,2]=4 10738 B9R1.12 CCCCN1CCOC1 Amb27838563 [0,1,0,1,0,0|2,0,0]=4 10739 B9R1.12 CCCCP1CCCC1 Amb28251357 [0,1,0,1,0,0|1,0,1]=4 10740 B9R1.12 CCCCP1CCNC1 Amb27872319 [0,1,0,1,0,0|2,0,0]=4 10741 B9R1.12 CCCC[C@H]1CNCN1 Amb28239669 [0,1,0,1,0,0|1,0,1]=4 10742 B9R1.12 CCCC[N+]1=CSCC1 Amb28315749 [0,1,0,1,0,0|2,0,0]=4 10743 B9R1.12 CCCNC1C=CCC1 Amb35672230 [0,1,0,1,0,0|1,0,0]=3 10744 B9R1.12 CCCNC1CCCC1 Amb2097979 [0,1,0,1,0,0|1,0,1]=4 10745 B9R1.12 CCCNC1CCCC1 Amb6259295 [0,1,0,1,0,0|1,0,1]=4 10746 B9R1.12 CCCN[C@H]1CCNC1 Amb29892385 [0,1,0,1,0,0|2,0,0]=4 10747 B9R1.12 CCCOC1CCNC1 Amb17191402 [0,1,0,1,0,0|2,0,0]=4 10748 B9R1.12 CCCOC1CCNC1 Amb33801509 [0,1,0,1,0,0|2,0,0]=4 10749 B9R1.12 CCCO[C@@H]1CCNC1 Amb26490598 [0,1,0,1,0,0|2,0,0]=4 10750 B9R1.12 CCCO[C@@H]1CCNC1 Amb34912491 [0,1,0,1,0,0|2,0,0]=4 10751 B9R1.12 CCCO[C@H]1CCNC1 Amb22752856 [0,1,0,1,0,0|2,0,0]=4 10752 B9R1.12 CCCO[C@H]1CCNC1 Amb34913934 [0,1,0,1,0,0|2,0,0]=4 10753 B9R1.12 CCCSC1CCNC1 Amb18292979 [0,1,0,1,0,0|2,0,0]=4 10754 B9R1.12 CCNCC1CCCC1 Amb8853714 [0,1,0,1,0,0|1,0,1]=4 10755 B9R1.12 CCNCC1CCCN1 Amb17231855 [0,1,0,1,0,0|1,0,1]=4 10756 B9R1.12 CCNCC1CCCO1 Amb10610065 [0,1,0,1,0,0|0,0,2]=4 10757 B9R1.12 CCNCC1CCCO1 Amb9712607 [0,1,0,1,0,0|0,0,2]=4 10758 B9R1.12 CCNCC1CCNC1 Amb8630763 [0,1,0,1,0,0|2,0,0]=4 10759 B9R1.12 CCNCC1CCOC1 Amb32410098 [0,1,0,1,0,0|2,0,0]=4 10760 B9R1.12 CCNCC1CCOC1 Amb9721559 [0,1,0,1,0,0|2,0,0]=4 10761 B9R1.12 CCNCC1CCSC1 Amb27167026 [0,1,0,1,0,0|2,0,0]=4 10762 B9R1.12 CCNC[C@@H]1CCCN1 Amb27446159 [0,1,0,1,0,0|1,0,1]=4 10763 B9R1.12 CCOCC1CCCN1 Amb10608177 [0,1,0,1,0,0|1,0,1]=4 10764 B9R1.12 CCOCC1CCCO1 Amb4034438 [0,1,0,1,0,0|0,0,2]=4 10765 B9R1.12 CCOCC1CCNC1 Amb18292273 [0,1,0,1,0,0|2,0,0]=4 10766 B9R1.12 CCOC[C@@H]1CCCN1 Amb17061648 [0,1,0,1,0,0|1,0,1]=4 10767 B9R1.12 CCSCC1CCCC1 Amb28285763 [0,1,0,1,0,0|1,0,1]=4 10768 B9R1.12 CCSCC1CCCN1 Amb18985026 [0,1,0,1,0,0|1,0,1]=4 10769 B9R1.12 CCSCC1CCCN1 Amb35745872 [0,1,0,1,0,0|1,0,1]=4 10770 B9R1.12 CCSCC1CCNC1 Amb18296506 [0,1,0,1,0,0|2,0,0]=4 10771 B9R1.12 CCSC[C@@H]1CCCN1 Amb27470265 [0,1,0,1,0,0|1,0,1]=4 10772 B9R1.12 CC\C=C\C1CCCC1 Amb27267419 [0,1,0,1,0,0|1,0,1]=4 10773 B9R1.12 CNCCC1CCCC1 Amb18523811 [0,1,0,1,0,0|1,0,1]=4 10774 B9R1.12 CNCCC1CCCC1 Amb34913786 [0,1,0,1,0,0|1,0,1]=4 10775 B9R1.12 CNCCC1CCCO1 Amb18300050 [0,1,0,1,0,0|0,0,2]=4 10776 B9R1.12 CNCCC1CCCO1 Amb33553009 [0,1,0,1,0,0|0,0,2]=4 10777 B9R1.12 CNCCC1CCCS1 Amb28198750 [0,1,0,1,0,0|0,1,1]=4 10778 B9R1.12 CNCCC1CCNC1 Amb22301381 [0,1,0,1,0,0|2,0,0]=4 10779 B9R1.12 CNCCC1CCOC1 Amb18993054 [0,1,0,1,0,0|2,0,0]=4 10780 B9R1.12 CNCCC1CCOC1 Amb32410667 [0,1,0,1,0,0|2,0,0]=4 10781 B9R1.12 CNCCC1CCSC1 Amb29852102 [0,1,0,1,0,0|2,0,0]=4 10782 B9R1.12 CNCCN1CCCC1 Amb19115418 [0,1,0,1,0,0|2,0,0]=4 10783 B9R1.12 CNCCN1CCCC1 Amb5493956 [0,1,0,1,0,0|2,0,0]=4 10784 B9R1.12 COCCC1C=CCN1 Amb27838554 [0,1,0,1,0,0|2,0,0]=4 10785 B9R1.12 COCCC1CC=CC1 Amb30031560 [0,1,0,1,0,0|1,0,1]=4 10786 B9R1.12 COCCC1CCCN1 Amb17436678 [0,1,0,1,0,0|1,0,1]=4 10787 B9R1.12 COCCC1CCNC1 Amb21959195 [0,1,0,1,0,0|2,0,0]=4 10788 B9R1.12 COCC[C@@H]1CCCN1 Amb26917553 [0,1,0,1,0,0|1,0,1]=4 10789 B9R1.12 CONCC1CCCC1 Amb27862092 [0,1,0,1,0,0|1,0,1]=4 10790 B9R1.12 CSCCC1CCCN1 Amb4134987 [0,1,0,1,0,0|1,0,1]=4 10791 B9R1.12 CSCCC1CCNC1 Amb27488602 [0,1,0,1,0,0|2,0,0]=4 10792 B9R1.12 CSCCN1CCCC1 Amb27222532 [0,1,0,1,0,0|2,0,0]=4 10793 B9R1.12 ClCCCC1CC=CC1 Amb32688151 [0,1,0,1,0,0|1,0,1]=4 10794 B9R1.12 ClCCCC1CCCC1 Amb9004331 [0,1,0,1,0,0|1,0,1]=4 10795 B9R1.12 ClCCCC1CCCO1 Amb27852668 [0,1,0,1,0,0|0,0,2]=4 10796 B9R1.12 ClCCCC1CCCS1 Amb32688087 [0,1,0,1,0,0|0,1,1]=4 10797 B9R1.12 ClCCCC1CCOC1 Amb27832511 [0,1,0,1,0,0|1,0,1]=4 10798 B9R1.12 ClCCCN1CCCC1 Amb31308048 [0,1,0,1,0,0|1,0,1]=4 10799 B9R1.12 ClCCCN1CCCC1 Amb8387803 [0,1,0,1,0,0|1,0,1]=4 10800 B9R1.12 ClCCCN1CCCC1 Amb8387804 [0,1,0,1,0,0|1,0,1]=4 10801 B9R1.12 ClCCC[C@@H]1CCCO1 Amb32688085 [0,1,0,1,0,0|0,0,2]=4 10802 B9R1.12 ClCCC[C@H]1CCCO1 Amb32688083 [0,1,0,1,0,0|0,0,2]=4 10803 B9R1.12 ClCCNC1CCCC1 Amb17334277 [0,1,0,1,0,0|1,0,1]=4 10804 B9R1.12 ClCCSC1CCCC1 Amb27837448 [0,1,0,1,0,0|1,0,1]=4 10805 B9R1.12 ClCSCC1CCCC1 Amb28042948 [0,1,0,1,0,0|1,0,1]=4 10806 B9R1.12 ClC\C=C\C1CCCC1 Amb27410192 [0,1,0,1,0,0|1,0,1]=4 10807 B9R1.12 FCCCC1CCCN1 Amb27778370 [0,1,0,1,0,0|1,0,1]=4 10808 B9R1.12 FCCCC1CCNC1 Amb22011551 [0,1,0,1,0,0|1,0,1]=4 10809 B9R1.12 FCCNC1C=CCC1 Amb35713401 [0,1,0,1,0,0|2,0,0]=4 10810 B9R1.12 FCCNC1CCCC1 Amb27489305 [0,1,0,1,0,0|1,0,1]=4 10811 B9R1.12 ICCCC1CCCC1 Amb27969560 [0,1,0,1,0,0|1,0,1]=4 10812 B9R1.12 ICCCC1CCOC1 Amb27172797 [0,1,0,1,0,0|1,0,1]=4 10813 B9R1.12 ICCCN1CCCC1 Amb25147182 [0,1,0,1,0,0|1,0,1]=4 10814 B9R1.12 ICCCN1CCCC1 Amb33734657 [0,1,0,1,0,0|1,0,1]=4 10815 B9R1.12 N#CCCC1CCCC1 Amb24502326 [0,1,0,1,0,0|1,0,1]=4 10816 B9R1.12 N#CCCC1CCCO1 Amb28287223 [0,1,0,1,0,0|1,0,1]=4 10817 B9R1.12 N#CCCC1CCCS1 Amb33416219 [0,1,0,1,0,0|1,0,1]=4 10818 B9R1.12 N#CCCC1CCOC1 Amb25825754 [0,1,0,1,0,0|1,0,1]=4 10819 B9R1.12 N#CCCC1CCSC1 Amb33141363 [0,1,0,1,0,0|1,0,1]=4 10820 B9R1.12 N#CCCN1CCCC1 Amb4010705 [0,1,0,1,0,0|1,0,1]=4 10821 B9R1.12 N#CCNC1CCCC1 Amb6707313 [0,1,0,1,0,0|1,0,1]=4 10822 B9R1.12 N#CCOC1CCCC1 Amb6271315 [0,1,0,1,0,0|1,0,1]=4 10823 B9R1.12 N#C\C=C\C1CCCC1 Amb13890295 [0,1,0,1,0,0|1,0,1]=4 10824 B9R1.12 NCCCC1C=CCC1 Amb26386566 [0,1,0,1,0,0|1,0,0]=3 10825 B9R1.12 NCCCC1CC=CC1 Amb30034364 [0,1,0,1,0,0|1,0,1]=4 10826 B9R1.12 NCCCC1CCCC1 Amb10609767 [0,1,0,1,0,0|1,0,1]=4 10827 B9R1.12 NCCCC1CCCC1 Amb6662634 [0,1,0,1,0,0|1,0,1]=4 10828 B9R1.12 NCCCC1CCCN1 Amb18642686 [0,1,0,1,0,0|1,0,1]=4 10829 B9R1.12 NCCCC1CCCO1 Amb18301442 [0,1,0,1,0,0|0,0,2]=4 10830 B9R1.12 NCCCC1CCCS1 Amb33416228 [0,1,0,1,0,0|0,1,1]=4 10831 B9R1.12 NCCCC1CCOC1 Amb1090895 [0,1,0,1,0,0|1,0,1]=4 10832 B9R1.12 NCCCC1CCOC1 Amb21954298 [0,1,0,1,0,0|1,0,1]=4 10833 B9R1.12 NCCCC1CCSC1 Amb33142528 [0,1,0,1,0,0|1,0,1]=4 10834 B9R1.12 NCCCN1CCCC1 Amb1154419 [0,1,0,1,0,0|1,0,1]=4 10835 B9R1.12 NCCC[C@@H]1CCCO1 Amb33620903 [0,1,0,1,0,0|0,0,2]=4 10836 B9R1.12 NCCC[C@@H]1CCCO1 Amb33747126 [0,1,0,1,0,0|0,0,2]=4 10837 B9R1.12 NCCC[C@H]1CCCO1 Amb33620902 [0,1,0,1,0,0|0,0,2]=4 10838 B9R1.12 NCCC[C@H]1CCCO1 Amb33736454 [0,1,0,1,0,0|0,0,2]=4 10839 B9R1.12 NCCNC1C=CCC1 Amb30008520 [0,1,0,1,0,0|2,0,0]=4 10840 B9R1.12 NCCNC1CCCC1 Amb17091017 [0,1,0,1,0,0|1,0,1]=4 10841 B9R1.12 NCCNC1CCCC1 Amb29844467 [0,1,0,1,0,0|1,0,1]=4 10842 B9R1.12 NCCOC1CCCC1 Amb1127307 [0,1,0,1,0,0|1,0,1]=4 10843 B9R1.12 NCCOC1CCCC1 Amb33548703 [0,1,0,1,0,0|1,0,1]=4 10844 B9R1.12 NCCSC1CCCC1 Amb19389681 [0,1,0,1,0,0|1,0,1]=4 10845 B9R1.12 NCCSC1CCCC1 Amb6267365 [0,1,0,1,0,0|1,0,1]=4 10846 B9R1.12 NC\C=C\C1CCCC1 Amb27869342 [0,1,0,1,0,0|1,0,1]=4 10847 B9R1.12 NNCCC1CCCC1 Amb6250554 [0,1,0,1,0,0|1,0,1]=4 10848 B9R1.12 NNCCC1CCCO1 Amb27490814 [0,1,0,1,0,0|2,0,0]=4 10849 B9R1.12 NNCCC1CCOC1 Amb27956551 [0,1,0,1,0,0|2,0,0]=4 10850 B9R1.12 NNCCN1CCCC1 Amb22489702 [0,1,0,1,0,0|2,0,0]=4 10851 B9R1.12 NN\C=N\C1CCCC1 Amb24400872 [0,1,0,1,0,0|2,0,0]=4 10852 B9R1.12 NOCCC1CCCC1 Amb27617248 [0,1,0,1,0,0|0,0,2]=4 10853 B9R1.12 NOCCC1CCCO1 Amb25269925 [0,1,0,1,0,0|2,0,0]=4 10854 B9R1.12 NOCCC1CCCS1 Amb33415856 [0,1,0,1,0,0|2,0,0]=4 10855 B9R1.12 NOCCC1CCOC1 Amb24538931 [0,1,0,1,0,0|2,0,0]=4 10856 B9R1.12 NOCCC1CCSC1 Amb33141529 [0,1,0,1,0,0|2,0,0]=4 10857 B9R1.12 NOCCN1CCCC1 Amb17104844 [0,1,0,1,0,0|2,0,0]=4 10858 B9R1.12 N\N=C\CC1CCOC1 Amb27194842 [0,1,0,1,0,0|2,0,0]=4 10859 B9R1.12 O=C=NCC1CCCC1 Amb6273027 [0,1,0,1,0,0|0,0,1]=3 10860 B9R1.12 O=C=NCC1CCCO1 Amb33541100 [0,1,0,1,0,0|1,0,1]=4 10861 B9R1.12 O=C=NCC1CCCS1 Amb26859893 [0,1,0,1,0,0|1,0,1]=4 10862 B9R1.12 O=C=NCC1CCNC1 Amb28053223 [0,1,0,1,0,0|1,0,1]=4 10863 B9R1.12 O=C=NCC1CCOC1 Amb19148060 [0,1,0,1,0,0|1,0,1]=4 10864 B9R1.12 O=C=NCC1CCSC1 Amb25265566 [0,1,0,1,0,0|1,0,1]=4 10865 B9R1.12 O=CCCC1CCCC1 Amb8009615 [0,1,0,1,0,0|0,0,0]=2 10866 B9R1.12 O=CCCC1CCCO1 Amb22489681 [0,1,0,1,0,0|0,0,0]=2 10867 B9R1.12 O=CCCC1CCCS1 Amb33415402 [0,1,0,1,0,0|0,0,0]=2 10868 B9R1.12 O=CCCC1CCOC1 Amb20247596 [0,1,0,1,0,0|0,0,0]=2 10869 B9R1.12 O=CCCC1CCSC1 Amb24666919 [0,1,0,1,0,0|0,0,0]=2 10870 B9R1.12 O=CCCC1OCCO1 Amb10567127 [0,1,0,1,0,0|1,0,0]=3 10871 B9R1.12 O=CCCN1CCCC1 Amb27837417 [0,1,0,1,0,0|0,0,0]=2 10872 B9R1.12 O=CCC[N+]1=CCCC1 Amb27401168 [0,1,0,1,0,0|0,0,1]=3 10873 B9R1.12 O=CCOC1CCCC1 Amb27169387 [0,1,0,1,0,0|0,0,0]=2 10874 B9R1.12 O=CCOC1CCCO1 Amb18203202 [0,1,0,1,0,0|1,0,0]=3 10875 B9R1.12 O=CNCC1CCCO1 Amb27470749 [0,1,0,1,0,0|1,0,0]=3 10876 B9R1.12 O=CNCC1CCSC1 Amb27395543 [0,1,0,1,0,0|1,0,0]=3 10877 B9R1.12 O=CNCC1SCCS1 Amb30025583 [0,1,0,1,0,0|2,0,0]=4 10878 B9R1.12 O=CNN=C1CCCC1 Amb361380 [0,1,0,1,0,0|1,0,1]=4 10879 B9R1.12 O=CNOC1CCCC1 Amb27787363 [0,1,0,1,0,0|1,0,0]=3 10880 B9R1.12 O=C\C=C\C1CCCC1 Amb33380761 [0,1,0,1,0,0|0,0,1]=3 10881 B9R1.12 O=C\C=C\C1CCCO1 Amb26992295 [0,1,0,1,0,0|0,0,2]=4 10882 B9R1.12 O=C\C=C\C1CCCS1 Amb33416822 [0,1,0,1,0,0|0,0,2]=4 10883 B9R1.12 O=C\C=C\C1CCOC1 Amb33079631 [0,1,0,1,0,0|0,0,2]=4 10884 B9R1.12 O=C\C=C\C1CCSC1 Amb27478226 [0,1,0,1,0,0|0,0,2]=4 10885 B9R1.12 OCCCC1CC=CC1 Amb28315438 [0,1,0,1,0,0|1,0,1]=4 10886 B9R1.12 OCCCC1CCCC1 Amb3939088 [0,1,0,1,0,0|0,0,2]=4 10887 B9R1.12 OCCCC1CCCN1 Amb8630848 [0,1,0,1,0,0|0,0,2]=4 10888 B9R1.12 OCCCC1CCCO1 Amb17939196 [0,1,0,1,0,0|0,0,2]=4 10889 B9R1.12 OCCCC1CCCS1 Amb33416795 [0,1,0,1,0,0|0,0,2]=4 10890 B9R1.12 OCCCC1CCNC1 Amb24674180 [0,1,0,1,0,0|0,0,2]=4 10891 B9R1.12 OCCCC1CCSC1 Amb33141523 [0,1,0,1,0,0|0,0,2]=4 10892 B9R1.12 OCCCC1CNC=N1 Amb28133730 [0,1,0,1,0,0|2,0,0]=4 10893 B9R1.12 OCCCN1CCCC1 Amb8387818 [0,1,0,1,0,0|0,0,2]=4 10894 B9R1.12 OCCC[C@@H]1CCCN1 Amb25145987 [0,1,0,1,0,0|0,0,2]=4 10895 B9R1.12 OCCC[C@@H]1CCCN1 Amb33309673 [0,1,0,1,0,0|0,0,2]=4 10896 B9R1.12 OCCC[C@@H]1CCCO1 Amb27631987 [0,1,0,1,0,0|0,0,2]=4 10897 B9R1.12 OCCC[C@H]1CCCN1 Amb27879933 [0,1,0,1,0,0|0,0,2]=4 10898 B9R1.12 OCCC[C@H]1CCCN1 Amb33309582 [0,1,0,1,0,0|0,0,2]=4 10899 B9R1.12 OCCC[C@H]1CCCO1 Amb27617649 [0,1,0,1,0,0|0,0,2]=4 10900 B9R1.12 OCCNC1CCCC1 Amb10609474 [0,1,0,1,0,0|0,0,2]=4 10901 B9R1.12 OCCNC1CCCC1 Amb6707359 [0,1,0,1,0,0|0,0,2]=4 10902 B9R1.12 OCCOC1CCCC1 Amb6893052 [0,1,0,1,0,0|0,0,2]=4 10903 B9R1.12 OCCSC1CCCC1 Amb9362979 [0,1,0,1,0,0|0,0,2]=4 10904 B9R1.12 OC\C=C\C1CCCC1 Amb33428704 [0,1,0,1,0,0|0,0,2]=4 10905 B9R1.12 ONCCC1CCCC1 Amb27785800 [0,1,0,1,0,0|0,0,2]=4 10906 B9R1.12 O\N=C\CC1CCCC1 Amb27618400 [0,1,0,1,0,0|0,0,1]=3 10907 B9R1.12 SCCCC1CCCC1 Amb27764782 [0,1,0,1,0,0|0,1,1]=4 10908 B9R1.12 SCCCC1CCCO1 Amb26321954 [0,1,0,1,0,0|0,0,2]=4 10909 B9R1.12 SCCCC1CCCS1 Amb33415368 [0,1,0,1,0,0|0,1,1]=4 10910 B9R1.12 SCCCC1CCOC1 Amb27221392 [0,1,0,1,0,0|0,1,1]=4 10911 B9R1.12 SCCCC1CCSC1 Amb33344976 [0,1,0,1,0,0|0,1,1]=4 10912 B9R1.12 SCCCN1CCCC1 Amb27197407 [0,1,0,1,0,0|0,1,1]=4 10913 B9R1.12 SCCNC1CCCC1 Amb28062002 [0,1,0,1,0,0|0,1,1]=4 10914 B9R1.12 SCCOC1CCCC1 Amb28454066 [0,1,0,1,0,0|0,1,1]=4 10915 B9R1.12 SCCSC1CCCC1 Amb27184805 [0,1,0,1,0,0|0,1,1]=4 10916 B9R1.12 [C-]#[N+]CCC1CCCC1 Amb33315795 [0,1,0,1,0,0|1,0,1]=4 10917 B9R1.12 [C-]#[N+]CCC1CCCO1 Amb33318739 [0,1,0,1,0,0|2,0,0]=4 10918 B9R1.12 [C-]#[N+]CCC1CCCS1 Amb33415871 [0,1,0,1,0,0|2,0,0]=4 10919 B9R1.12 [C-]#[N+]CCC1CCOC1 Amb27202090 [0,1,0,1,0,0|2,0,0]=4 10920 B9R1.12 [C-]#[N+]CCC1CCSC1 Amb33141312 [0,1,0,1,0,0|2,0,0]=4 10921 B9R1.12 [C-]#[N+]CCN1CCCC1 Amb1981099 [0,1,0,1,0,0|2,0,0]=4 10922 B9R1.12 [N-]=[N+]=NCC1CCCC1 Amb24529028 [0,1,0,1,0,0|2,0,0]=4 10923 B9R1.15 C#CC1CCCCC1C Amb24602567 [0,1,0,1,0,0|1,0,1]=4 10924 B9R1.15 C#CC1CCCCC1N Amb24117203 [0,1,0,1,0,0|1,0,1]=4 10925 B9R1.15 C#CC1CCCCC1O Amb27466451 [0,1,0,1,0,0|1,0,1]=4 10926 B9R1.15 C#CC1CCCCN1C Amb33169114 [0,1,0,1,0,0|1,0,1]=4 10927 B9R1.15 C#CC1CCNCC1C Amb33169121 [0,1,0,1,0,0|1,0,1]=4 10928 B9R1.15 C#CC1CNCCC1=O Amb27447254 [0,1,0,1,0,0|0,0,2]=4 10929 B9R1.15 C#C[C@@H]1CCCC[C@@H]1O Amb26892452 [0,1,0,1,0,0|1,0,1]=4 10930 B9R1.15 C#C[C@@H]1CCCC[C@H]1O Amb25990553 [0,1,0,1,0,0|1,0,1]=4 10931 B9R1.15 C#C[C@H]1CCCC[C@@H]1N Amb27626889 [0,1,0,1,0,0|1,0,1]=4 10932 B9R1.15 C=C1CCCCC1CC Amb27952112 [0,1,0,1,0,0|1,0,0]=3 10933 B9R1.15 C=C=C1CCCCC1O Amb27768375 [0,1,0,1,0,0|2,0,0]=4 10934 B9R1.15 C=CC1CCCCC1Br Amb27430278 [0,1,0,1,0,0|1,0,0]=3 10935 B9R1.15 C=CC1CCCCC1O Amb25706048 [0,1,0,1,0,0|1,0,0]=3 10936 B9R1.15 C=CC1CCCCN1C Amb25970302 [0,1,0,1,0,0|1,0,0]=3 10937 B9R1.15 C=CC1OCCCC1N Amb25175715 [0,1,0,1,0,0|2,0,0]=4 10938 B9R1.15 C=CC1OCCCC1N Amb32662671 [0,1,0,1,0,0|2,0,0]=4 10939 B9R1.15 C=CC1OCCCC1O Amb27972502 [0,1,0,1,0,0|2,0,0]=4 10940 B9R1.15 C=CN1CCCCC1=O Amb3568877 [0,1,0,1,0,0|0,0,2]=4 10941 B9R1.15 C=C[C@@H]1CCCC[C@@H]1O Amb27427803 [0,1,0,1,0,0|1,0,0]=3 10942 B9R1.15 C=C[C@@H]1CCCC[C@H]1O Amb22802080 [0,1,0,1,0,0|1,0,0]=3 10943 B9R1.15 C=C[C@@H]1COCC[C@@H]1O Amb28129747 [0,1,0,1,0,0|2,0,0]=4 10944 B9R1.15 C=C[C@@H]1OCCC[C@H]1Cl Amb27419913 [0,1,0,1,0,0|2,0,0]=4 10945 B9R1.15 C=C[C@@H]1OCCC[C@H]1N Amb25250863 [0,1,0,1,0,0|2,0,0]=4 10946 B9R1.15 C=C[C@@H]1OCCC[C@H]1N Amb32662701 [0,1,0,1,0,0|2,0,0]=4 10947 B9R1.15 C=C[C@@H]1OCCC[C@H]1O Amb27205666 [0,1,0,1,0,0|2,0,0]=4 10948 B9R1.15 C=C[C@H]1CCCC[C@@H]1O Amb28256773 [0,1,0,1,0,0|1,0,0]=3 10949 B9R1.15 C=C[C@H]1CCCC[C@H]1N Amb28428608 [0,1,0,1,0,0|1,0,0]=3 10950 B9R1.15 CC1=C(CO)CCCC1 Amb27969811 [0,1,0,1,0,0|0,0,2]=4 10951 B9R1.15 CC1CC=CCC1C=O Amb4034578 [0,1,0,1,0,0|0,0,1]=3 10952 B9R1.15 CC1CCCCC1C#N Amb8950075 [0,1,0,1,0,0|1,0,1]=4 10953 B9R1.15 CC1CCCCC1C=O Amb18642449 [0,1,0,1,0,0|0,0,0]=2 10954 B9R1.15 CC1CCCCC1CBr Amb28458445 [0,1,0,1,0,0|1,0,1]=4 10955 B9R1.15 CC1CCCCC1CN Amb10610368 [0,1,0,1,0,0|1,0,1]=4 10956 B9R1.15 CC1CCCCC1CN Amb8950173 [0,1,0,1,0,0|1,0,1]=4 10957 B9R1.15 CC1CCCCC1CO Amb25804856 [0,1,0,1,0,0|0,0,2]=4 10958 B9R1.15 CC1CCCCC1CS Amb27231870 [0,1,0,1,0,0|0,1,1]=4 10959 B9R1.15 CC1CCCCC1NN Amb10610508 [0,1,0,1,0,0|1,0,1]=4 10960 B9R1.15 CC1CCCCC1NN Amb28990939 [0,1,0,1,0,0|1,0,1]=4 10961 B9R1.15 CC1CCCCC1NN Amb6249151 [0,1,0,1,0,0|1,0,1]=4 10962 B9R1.15 CC1CCCC\C1=N/N Amb28063414 [0,1,0,1,0,0|1,0,0]=3 10963 B9R1.15 CC1CCCC\C1=N\O Amb19650930 [0,1,0,1,0,0|0,0,1]=3 10964 B9R1.15 CC1CCCC\[N+]1=C/Cl Amb28458486 [0,1,0,1,0,0|1,0,0]=3 10965 B9R1.15 CC1CCCNC1CN Amb24730245 [0,1,0,1,0,0|1,0,1]=4 10966 B9R1.15 CC1CCCNC1CO Amb22886363 [0,1,0,1,0,0|0,0,2]=4 10967 B9R1.15 CC1CCCNC1CO Amb32658045 [0,1,0,1,0,0|0,0,2]=4 10968 B9R1.15 CC1CCCOC1CN Amb28342443 [0,1,0,1,0,0|1,0,1]=4 10969 B9R1.15 CC1CCNCC1CO Amb24117064 [0,1,0,1,0,0|0,0,2]=4 10970 B9R1.15 CC1CCOCC1CN Amb27607222 [0,1,0,1,0,0|1,0,1]=4 10971 B9R1.15 CC1CNCCC1CN Amb28206827 [0,1,0,1,0,0|1,0,1]=4 10972 B9R1.15 CC1CNCCC1CO Amb27766043 [0,1,0,1,0,0|0,0,2]=4 10973 B9R1.15 CC1CNCCC1NN Amb26440696 [0,1,0,1,0,0|2,0,0]=4 10974 B9R1.15 CC1CNCCC1NO Amb28350547 [0,1,0,1,0,0|1,0,1]=4 10975 B9R1.15 CC1CNCCN1C=O Amb27404608 [0,1,0,1,0,0|1,0,0]=3 10976 B9R1.15 CC1COCCC1C#N Amb25977566 [0,1,0,1,0,0|1,0,1]=4 10977 B9R1.15 CC1COCCC1CN Amb25274303 [0,1,0,1,0,0|1,0,1]=4 10978 B9R1.15 CC1COCCC1CN Amb32652895 [0,1,0,1,0,0|1,0,1]=4 10979 B9R1.15 CC1COCC\C1=N/O Amb28070741 [0,1,0,1,0,0|1,0,1]=4 10980 B9R1.15 CC1CSCCN1C=O Amb24409208 [0,1,0,1,0,0|1,0,0]=3 10981 B9R1.15 CC1NCCCC1CN Amb26491562 [0,1,0,1,0,0|1,0,1]=4 10982 B9R1.15 CC1NCCCC1CO Amb22886280 [0,1,0,1,0,0|0,0,2]=4 10983 B9R1.15 CC1OCCCC1C=O Amb27872989 [0,1,0,1,0,0|0,0,0]=2 10984 B9R1.15 CC1SCCC\C1=N/O Amb27833170 [0,1,0,1,0,0|1,0,1]=4 10985 B9R1.15 CC1SCCSC1C=O Amb27956572 [0,1,0,1,0,0|1,0,0]=3 10986 B9R1.15 CCC1=C(C)CCNC1 Amb24556041 [0,1,0,1,0,0|1,0,1]=4 10987 B9R1.15 CCC1=CCCCC1=O Amb27838623 [0,1,0,1,0,0|0,0,1]=3 10988 B9R1.15 CCC1=[N+]([O-])CCCC1 Amb27201291 [0,1,0,1,0,0|1,0,1]=4 10989 B9R1.15 CCC1CC=CCC1N Amb27237513 [0,1,0,1,0,0|1,0,1]=4 10990 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,1,0,1,0,0|0,0,0]=2 10991 B9R1.15 CCC1CCCCC1Br Amb19076564 [0,1,0,1,0,0|1,0,1]=4 10992 B9R1.15 CCC1CCCCC1C Amb22232355 [0,1,0,1,0,0|1,0,1]=4 10993 B9R1.15 CCC1CCCCC1Cl Amb27751430 [0,1,0,1,0,0|1,0,1]=4 10994 B9R1.15 CCC1CCCCC1N Amb9776218 [0,1,0,1,0,0|1,0,1]=4 10995 B9R1.15 CCC1CCCCC1O Amb6608702 [0,1,0,1,0,0|0,0,2]=4 10996 B9R1.15 CCC1CCCCC1S Amb25360773 [0,1,0,1,0,0|0,1,1]=4 10997 B9R1.15 CCC1CCCCN1N Amb836844 [0,1,0,1,0,0|1,0,1]=4 10998 B9R1.15 CCC1CCCCN1O Amb27483076 [0,1,0,1,0,0|0,0,2]=4 10999 B9R1.15 CCC1CCCNC1=N Amb27252267 [0,1,0,1,0,0|1,0,0]=3 11000 B9R1.15 CCC1CCCNC1=O Amb22276357 [0,1,0,1,0,0|0,0,0]=2 11001 B9R1.15 CCC1CCCNC1C Amb25727319 [0,1,0,1,0,0|1,0,1]=4 11002 B9R1.15 CCC1CCNCC1C Amb28287502 [0,1,0,1,0,0|1,0,1]=4 11003 B9R1.15 CCC1CCNCC1N Amb26360377 [0,1,0,1,0,0|1,0,1]=4 11004 B9R1.15 CCC1CCOCC1=O Amb33295409 [0,1,0,1,0,0|0,0,0]=2 11005 B9R1.15 CCC1CNCCC1=O Amb18642532 [0,1,0,1,0,0|0,0,0]=2 11006 B9R1.15 CCC1CNCCC1=O Amb23400918 [0,1,0,1,0,0|0,0,0]=2 11007 B9R1.15 CCC1CNCCC1C Amb18642547 [0,1,0,1,0,0|1,0,1]=4 11008 B9R1.15 CCC1CNCCC1F Amb27634236 [0,1,0,1,0,0|1,0,1]=4 11009 B9R1.15 CCC1CNCCC1N Amb24101086 [0,1,0,1,0,0|1,0,1]=4 11010 B9R1.15 CCC1CNCCN1C Amb10607749 [0,1,0,1,0,0|2,0,0]=4 11011 B9R1.15 CCC1CNCCN1C Amb22587615 [0,1,0,1,0,0|2,0,0]=4 11012 B9R1.15 CCC1CNCCN1O Amb28049058 [0,1,0,1,0,0|1,0,1]=4 11013 B9R1.15 CCC1CNCCS1=O Amb27402984 [0,1,0,1,0,0|1,0,0]=3 11014 B9R1.15 CCC1COCCC1=O Amb25687037 [0,1,0,1,0,0|0,0,0]=2 11015 B9R1.15 CCC1NCCCC1=O Amb19888368 [0,1,0,1,0,0|0,0,0]=2 11016 B9R1.15 CCC1NCCCC1=O Amb28055859 [0,1,0,1,0,0|0,0,0]=2 11017 B9R1.15 CCC1NCCCC1C Amb6259877 [0,1,0,1,0,0|1,0,1]=4 11018 B9R1.15 CCC1NCCCC1N Amb33275583 [0,1,0,1,0,0|1,0,1]=4 11019 B9R1.15 CCC1NCCNC1=O Amb8503280 [0,1,0,1,0,0|1,0,0]=3 11020 B9R1.15 CCC1NCCNC1=O Amb9778903 [0,1,0,1,0,0|1,0,0]=3 11021 B9R1.15 CCC1OCCCC1Br Amb27490966 [0,1,0,1,0,0|0,0,2]=4 11022 B9R1.15 CCC1SCCNC1=O Amb2796294 [0,1,0,1,0,0|1,0,0]=3 11023 B9R1.15 CCN1CCCCC1=N Amb27242284 [0,1,0,1,0,0|1,0,0]=3 11024 B9R1.15 CCN1CCCNC1=O Amb15701510 [0,1,0,1,0,0|1,0,0]=3 11025 B9R1.15 CCN1CCNCC1=O Amb22227951 [0,1,0,1,0,0|1,0,0]=3 11026 B9R1.15 CCN1CCNCC1=O Amb9833685 [0,1,0,1,0,0|1,0,0]=3 11027 B9R1.15 CC[C@@H]1C=CCC[C@H]1O Amb27632001 [0,1,0,1,0,0|1,0,0]=3 11028 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,1,0,1,0,0|0,0,0]=2 11029 B9R1.15 CC[C@@H]1CCCC[C@@H]1N Amb27438938 [0,1,0,1,0,0|1,0,1]=4 11030 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [0,1,0,1,0,0|0,0,2]=4 11031 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [0,1,0,1,0,0|0,0,0]=2 11032 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [0,1,0,1,0,0|0,0,0]=2 11033 B9R1.15 CC[C@@H]1CNCCN1C Amb22587563 [0,1,0,1,0,0|2,0,0]=4 11034 B9R1.15 CC[C@@H]1CNCCN1C Amb23385293 [0,1,0,1,0,0|2,0,0]=4 11035 B9R1.15 CC[C@@H]1COCC[C@@H]1Br Amb27632469 [0,1,0,1,0,0|1,0,1]=4 11036 B9R1.15 CC[C@H]1CCCCC1N Amb27412189 [0,1,0,1,0,0|1,0,1]=4 11037 B9R1.15 CC[C@H]1CCCCN1Cl Amb27653574 [0,1,0,1,0,0|1,0,1]=4 11038 B9R1.15 CC[C@H]1CCCC[C@@H]1C Amb25911410 [0,1,0,1,0,0|1,0,1]=4 11039 B9R1.15 CC[C@H]1CCCC[C@@H]1O Amb27852810 [0,1,0,1,0,0|0,0,2]=4 11040 B9R1.15 CC[C@H]1CCCC[C@H]1C Amb25294655 [0,1,0,1,0,0|1,0,1]=4 11041 B9R1.15 CC[C@H]1CCCC[C@H]1N Amb27848812 [0,1,0,1,0,0|1,0,1]=4 11042 B9R1.15 CC[C@H]1CCCC[C@H]1O Amb28061782 [0,1,0,1,0,0|0,0,2]=4 11043 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,1,0,1,0,0|0,0,0]=2 11044 B9R1.15 CC[C@H]1CCNC[C@H]1N Amb28057730 [0,1,0,1,0,0|1,0,1]=4 11045 B9R1.15 CC[C@H]1CNCCN1C Amb23385284 [0,1,0,1,0,0|2,0,0]=4 11046 B9R1.15 CN1CCCCC1C#N Amb18642253 [0,1,0,1,0,0|1,0,1]=4 11047 B9R1.15 CN1CCCCC1CBr Amb21961477 [0,1,0,1,0,0|1,0,1]=4 11048 B9R1.15 CN1CCCCC1CBr Amb6316170 [0,1,0,1,0,0|1,0,1]=4 11049 B9R1.15 CN1CCCCC1CCl Amb10068244 [0,1,0,1,0,0|1,0,1]=4 11050 B9R1.15 CN1CCCCC1CCl Amb9174214 [0,1,0,1,0,0|1,0,1]=4 11051 B9R1.15 CN1CCCCC1CN Amb22727986 [0,1,0,1,0,0|1,0,1]=4 11052 B9R1.15 CN1CCCCC1CN Amb8503454 [0,1,0,1,0,0|1,0,1]=4 11053 B9R1.15 CN1CCCCC1CN Amb9731145 [0,1,0,1,0,0|1,0,1]=4 11054 B9R1.15 CN1CCCCC1CO Amb607577 [0,1,0,1,0,0|0,0,2]=4 11055 B9R1.15 CN1CCCCC1CS Amb27272821 [0,1,0,1,0,0|0,1,1]=4 11056 B9R1.15 CN1CCCC[C@@H]1CN Amb24411478 [0,1,0,1,0,0|1,0,1]=4 11057 B9R1.15 CN1CCCC[C@@H]1CO Amb22744972 [0,1,0,1,0,0|0,0,2]=4 11058 B9R1.15 CN1CCCC[C@H]1C=O Amb27798376 [0,1,0,1,0,0|0,0,0]=2 11059 B9R1.15 CN1CCCC[C@H]1CCl Amb27831756 [0,1,0,1,0,0|1,0,1]=4 11060 B9R1.15 CN1CCCC[C@H]1CN Amb27249510 [0,1,0,1,0,0|1,0,1]=4 11061 B9R1.15 CN1CCCC[C@H]1CO Amb26917816 [0,1,0,1,0,0|0,0,2]=4 11062 B9R1.15 CN1CCOCC1C=O Amb35666648 [0,1,0,1,0,0|1,0,0]=3 11063 B9R1.15 CNC1=CCCCC1=O Amb25743372 [0,1,0,1,0,0|0,0,2]=4 11064 B9R1.15 CNC1C=CCCC1O Amb27954422 [0,1,0,1,0,0|2,0,0]=4 11065 B9R1.15 CNC1CCCC=C1C Amb27663676 [0,1,0,1,0,0|1,0,1]=4 11066 B9R1.15 CNC1CCCCC1=O Amb28984230 [0,1,0,1,0,0|0,0,0]=2 11067 B9R1.15 CNC1CCCCC1=O Amb3644506 [0,1,0,1,0,0|0,0,0]=2 11068 B9R1.15 CNC1CCCCC1C Amb1116060 [0,1,0,1,0,0|1,0,1]=4 11069 B9R1.15 CNC1CCCCC1C Amb6239354 [0,1,0,1,0,0|1,0,1]=4 11070 B9R1.15 CNC1CCCCC1F Amb23443827 [0,1,0,1,0,0|1,0,1]=4 11071 B9R1.15 CNC1CCCCC1O Amb2607700 [0,1,0,1,0,0|0,0,2]=4 11072 B9R1.15 CNC1CCCCC1S Amb18644222 [0,1,0,1,0,0|0,1,1]=4 11073 B9R1.15 CNC1CCCNC1=O Amb28934961 [0,1,0,1,0,0|1,0,0]=3 11074 B9R1.15 CNC1CCCNC1C Amb27881891 [0,1,0,1,0,0|2,0,0]=4 11075 B9R1.15 CNC1CCNCC1C Amb24376691 [0,1,0,1,0,0|2,0,0]=4 11076 B9R1.15 CNC1CCOCC1C Amb22301329 [0,1,0,1,0,0|2,0,0]=4 11077 B9R1.15 CNC1CCSCC1C Amb27792108 [0,1,0,1,0,0|2,0,0]=4 11078 B9R1.15 CNC1OCCCC1C Amb27605762 [0,1,0,1,0,0|2,0,0]=4 11079 B9R1.15 CN[C@@H]1CCCC[C@@H]1C Amb25742534 [0,1,0,1,0,0|1,0,1]=4 11080 B9R1.15 CN[C@@H]1CCCC[C@@H]1O Amb1993808 [0,1,0,1,0,0|0,0,2]=4 11081 B9R1.15 CN[C@@H]1CCCC[C@@H]1S Amb27249842 [0,1,0,1,0,0|0,1,1]=4 11082 B9R1.15 CN[C@@H]1CCCC[C@H]1N Amb27467467 [0,1,0,1,0,0|1,0,1]=4 11083 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993807 [0,1,0,1,0,0|0,0,2]=4 11084 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993918 [0,1,0,1,0,0|0,0,2]=4 11085 B9R1.15 CN[C@@H]1CCCC[C@H]1S Amb27188343 [0,1,0,1,0,0|0,1,1]=4 11086 B9R1.15 CN[C@@H]1CNCC[C@@H]1C Amb27645757 [0,1,0,1,0,0|2,0,0]=4 11087 B9R1.15 CN[C@H]1CCCC[C@@H]1C Amb27195019 [0,1,0,1,0,0|1,0,1]=4 11088 B9R1.15 CN[C@H]1CCCC[C@@H]1O Amb5562396 [0,1,0,1,0,0|0,0,2]=4 11089 B9R1.15 CN[C@H]1CCCC[C@H]1O Amb2786031 [0,1,0,1,0,0|0,0,2]=4 11090 B9R1.15 CN[C@H]1CNCC[C@H]1C Amb26564267 [0,1,0,1,0,0|2,0,0]=4 11091 B9R1.15 COC1=CCCCC1=O Amb22755964 [0,1,0,1,0,0|0,0,2]=4 11092 B9R1.15 COC1C=CCCC1O Amb27632601 [0,1,0,1,0,0|2,0,0]=4 11093 B9R1.15 COC1CC=CCC1=O Amb27256455 [0,1,0,1,0,0|0,0,2]=4 11094 B9R1.15 COC1CCCC=C1Br Amb26495485 [0,1,0,1,0,0|1,0,1]=4 11095 B9R1.15 COC1CCCCC1=O Amb4606000 [0,1,0,1,0,0|0,0,0]=2 11096 B9R1.15 COC1CCCCC1Br Amb18321009 [0,1,0,1,0,0|1,0,1]=4 11097 B9R1.15 COC1CCCCC1I Amb25189979 [0,1,0,1,0,0|1,0,1]=4 11098 B9R1.15 COC1CCCCC1N Amb23438872 [0,1,0,1,0,0|1,0,1]=4 11099 B9R1.15 COC1CCCCC1N Amb6660864 [0,1,0,1,0,0|1,0,1]=4 11100 B9R1.15 COC1CCCCC1O Amb9283578 [0,1,0,1,0,0|0,0,2]=4 11101 B9R1.15 COC1CCCCC1S Amb25868109 [0,1,0,1,0,0|0,1,1]=4 11102 B9R1.15 COC1CCCC[C@H]1N Amb27430189 [0,1,0,1,0,0|1,0,1]=4 11103 B9R1.15 COC1CCCNC1=O Amb16231349 [0,1,0,1,0,0|1,0,0]=3 11104 B9R1.15 COC1CCNCC1C Amb22755833 [0,1,0,1,0,0|2,0,0]=4 11105 B9R1.15 COC1CCNCC1C Amb28934978 [0,1,0,1,0,0|2,0,0]=4 11106 B9R1.15 COC1CNCCC1=O Amb25147144 [0,1,0,1,0,0|1,0,0]=3 11107 B9R1.15 COC1CNCCC1C Amb25889761 [0,1,0,1,0,0|2,0,0]=4 11108 B9R1.15 COC1CNCCC1C Amb32758728 [0,1,0,1,0,0|2,0,0]=4 11109 B9R1.15 COC1COCCC1=O Amb20241319 [0,1,0,1,0,0|1,0,0]=3 11110 B9R1.15 COC1OCCCC1=O Amb27838671 [0,1,0,1,0,0|1,0,0]=3 11111 B9R1.15 CON1CCCCC1=O Amb27669022 [0,1,0,1,0,0|1,0,0]=3 11112 B9R1.15 CO[C@@H]1CCCCC1=O Amb22799901 [0,1,0,1,0,0|0,0,0]=2 11113 B9R1.15 CO[C@@H]1CCCC[C@@H]1Br Amb27777572 [0,1,0,1,0,0|1,0,1]=4 11114 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Amb25026218 [0,1,0,1,0,0|1,0,1]=4 11115 B9R1.15 CO[C@@H]1CCCC[C@@H]1O Amb24671865 [0,1,0,1,0,0|0,0,2]=4 11116 B9R1.15 CO[C@@H]1CCCC[C@H]1Br Amb25968817 [0,1,0,1,0,0|1,0,1]=4 11117 B9R1.15 CO[C@@H]1CCCC[C@H]1I Amb33733603 [0,1,0,1,0,0|1,0,1]=4 11118 B9R1.15 CO[C@@H]1CCCC[C@H]1N Amb26887845 [0,1,0,1,0,0|1,0,1]=4 11119 B9R1.15 CO[C@@H]1CCCC[C@H]1O Amb17940177 [0,1,0,1,0,0|0,0,2]=4 11120 B9R1.15 CO[C@@H]1CCCN[C@@H]1C Amb33744863 [0,1,0,1,0,0|2,0,0]=4 11121 B9R1.15 CO[C@@H]1CNCC[C@H]1C Amb33456121 [0,1,0,1,0,0|2,0,0]=4 11122 B9R1.15 CO[C@@H]1CNCC[C@H]1C Amb33621064 [0,1,0,1,0,0|2,0,0]=4 11123 B9R1.15 CO[C@@H]1COCCC1=O Amb22232585 [0,1,0,1,0,0|1,0,0]=3 11124 B9R1.15 CO[C@H]1CCCCC1=O Amb8386937 [0,1,0,1,0,0|0,0,0]=2 11125 B9R1.15 CO[C@H]1CCCC[C@@H]1Br Amb28193934 [0,1,0,1,0,0|1,0,1]=4 11126 B9R1.15 CO[C@H]1CCCC[C@@H]1N Amb28383875 [0,1,0,1,0,0|1,0,1]=4 11127 B9R1.15 CO[C@H]1CCCC[C@@H]1O Amb22047253 [0,1,0,1,0,0|0,0,2]=4 11128 B9R1.15 CO[C@H]1CCCC[C@H]1Br Amb27444168 [0,1,0,1,0,0|1,0,1]=4 11129 B9R1.15 CO[C@H]1CCCC[C@H]1N Amb27961504 [0,1,0,1,0,0|1,0,1]=4 11130 B9R1.15 CO[C@H]1CCCN[C@H]1C Amb33621063 [0,1,0,1,0,0|2,0,0]=4 11131 B9R1.15 CO[C@H]1COCCC1=O Amb27777522 [0,1,0,1,0,0|1,0,0]=3 11132 B9R1.15 CSC1=CCCCC1=O Amb27255244 [0,1,0,1,0,0|0,0,2]=4 11133 B9R1.15 CSC1CCC=CC1=O Amb28074788 [0,1,0,1,0,0|0,0,2]=4 11134 B9R1.15 CSC1CCCCC1=O Amb19267090 [0,1,0,1,0,0|0,0,0]=2 11135 B9R1.15 CSC1CCCCC1Br Amb28381116 [0,1,0,1,0,0|1,0,1]=4 11136 B9R1.15 CSC1CCCCC1F Amb24382198 [0,1,0,1,0,0|1,0,1]=4 11137 B9R1.15 CSC1CCCCC1N Amb18644219 [0,1,0,1,0,0|1,0,1]=4 11138 B9R1.15 CSC1CCCCC1N Amb32665004 [0,1,0,1,0,0|1,0,1]=4 11139 B9R1.15 CSC1CCCCC1O Amb27810883 [0,1,0,1,0,0|0,0,2]=4 11140 B9R1.15 CS[C@@H]1CCCC[C@H]1F Amb26564270 [0,1,0,1,0,0|1,0,1]=4 11141 B9R1.15 CS[C@@H]1CCCC[C@H]1N Amb26952114 [0,1,0,1,0,0|1,0,1]=4 11142 B9R1.15 CS[C@@H]1CCCC[C@H]1N Amb32661030 [0,1,0,1,0,0|1,0,1]=4 11143 B9R1.15 CS[C@@H]1CCCC[C@H]1O Amb27822799 [0,1,0,1,0,0|0,0,2]=4 11144 B9R1.15 CS[C@H]1CCCC[C@@H]1N Amb28901399 [0,1,0,1,0,0|1,0,1]=4 11145 B9R1.15 CS[C@H]1CCCC[C@@H]1O Amb24424734 [0,1,0,1,0,0|0,0,2]=4 11146 B9R1.15 C[C@@H]1C=CCC[C@H]1C=O Amb28246398 [0,1,0,1,0,0|0,0,1]=3 11147 B9R1.15 C[C@@H]1CCCC[C@H]1C=O Amb28248314 [0,1,0,1,0,0|0,0,0]=2 11148 B9R1.15 C[C@@H]1CCCC[C@H]1CO Amb27205665 [0,1,0,1,0,0|0,0,2]=4 11149 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb28247947 [0,1,0,1,0,0|0,0,2]=4 11150 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb32658745 [0,1,0,1,0,0|0,0,2]=4 11151 B9R1.15 C[C@@H]1CCCN[C@H]1CO Amb28456652 [0,1,0,1,0,0|0,0,2]=4 11152 B9R1.15 C[C@@H]1CCCO[C@H]1C=O Amb28255632 [0,1,0,1,0,0|0,0,0]=2 11153 B9R1.15 C[C@@H]1CCCO[C@H]1CN Amb27626025 [0,1,0,1,0,0|1,0,1]=4 11154 B9R1.15 C[C@@H]1NCCC[C@H]1C#N Amb27880575 [0,1,0,1,0,0|1,0,1]=4 11155 B9R1.15 C[C@@H]1NCCC[C@H]1C#N Amb31291676 [0,1,0,1,0,0|1,0,1]=4 11156 B9R1.15 C[C@@H]1NCCC[C@H]1CN Amb18832593 [0,1,0,1,0,0|1,0,1]=4 11157 B9R1.15 C[C@H]1CC=CC[C@H]1C=O Amb27467799 [0,1,0,1,0,0|0,0,1]=3 11158 B9R1.15 C[C@H]1CCCC[C@H]1CO Amb28250858 [0,1,0,1,0,0|0,0,2]=4 11159 B9R1.15 C[C@H]1CCCN[C@@H]1CO Amb34915744 [0,1,0,1,0,0|0,0,2]=4 11160 B9R1.15 C[C@H]1COCCN1C=O Amb35654354 [0,1,0,1,0,0|1,0,0]=3 11161 B9R1.15 C[C@H]1COCC[C@@H]1CN Amb27784540 [0,1,0,1,0,0|1,0,1]=4 11162 B9R1.15 C[C@H]1NCCC[C@@H]1C#N Amb22736677 [0,1,0,1,0,0|1,0,1]=4 11163 B9R1.15 C\C=C1/CCCCC1=O Amb10558348 [0,1,0,1,0,0|0,0,1]=3 11164 B9R1.15 C\C=C1/CCCC[C@H]1N Amb26977852 [0,1,0,1,0,0|1,0,1]=4 11165 B9R1.15 C\C=C1\CCCCC1=O Amb24571944 [0,1,0,1,0,0|0,0,1]=3 11166 B9R1.15 C\C=C1\CCCCC1N Amb27237317 [0,1,0,1,0,0|1,0,1]=4 11167 B9R1.15 C\C=C1\CCCNC1C Amb27846828 [0,1,0,1,0,0|1,0,1]=4 11168 B9R1.15 C\C=C1\CNCCC1=O Amb32649111 [0,1,0,1,0,0|0,0,2]=4 11169 B9R1.15 C\C=C1\COCCC1=O Amb27750956 [0,1,0,1,0,0|0,0,2]=4 11170 B9R1.15 C\C=C1\CSCCC1=O Amb32649112 [0,1,0,1,0,0|0,0,2]=4 11171 B9R1.15 C\N=C1/CCCCC1Cl Amb27974171 [0,1,0,1,0,0|2,0,0]=4 11172 B9R1.15 C\N=C1/CCCCN1C Amb26572926 [0,1,0,1,0,0|2,0,0]=4 11173 B9R1.15 C\N=C1\CCCCN1C Amb27227761 [0,1,0,1,0,0|2,0,0]=4 11174 B9R1.15 ClCC1=C(Cl)CCCC1 Amb27595204 [0,1,0,1,0,0|1,0,1]=4 11175 B9R1.15 ClCC1CCCCC1Cl Amb27626557 [0,1,0,1,0,0|1,0,1]=4 11176 B9R1.15 ClSC1CCCCC1Cl Amb27477308 [0,1,0,1,0,0|2,0,0]=4 11177 B9R1.15 Cl\C=C1/CCCCC1Cl Amb27777158 [0,1,0,1,0,0|1,0,1]=4 11178 B9R1.15 Cl\C=C1\CCCCC1Cl Amb27858735 [0,1,0,1,0,0|1,0,1]=4 11179 B9R1.15 FC1CCCCC1CBr Amb26529385 [0,1,0,1,0,0|1,0,1]=4 11180 B9R1.15 FC1CCCCC1CCl Amb32943716 [0,1,0,1,0,0|1,0,1]=4 11181 B9R1.15 N#CC1CCCCC1=O Amb2691377 [0,1,0,1,0,0|0,0,1]=3 11182 B9R1.15 N#CC1CCCCC1Br Amb18129711 [0,1,0,1,0,0|1,0,1]=4 11183 B9R1.15 N#CC1CCCCC1Cl Amb18644048 [0,1,0,1,0,0|1,0,1]=4 11184 B9R1.15 N#CC1CCCCC1F Amb28319551 [0,1,0,1,0,0|1,0,1]=4 11185 B9R1.15 N#CC1CCCCC1N Amb18942041 [0,1,0,1,0,0|1,0,1]=4 11186 B9R1.15 N#CC1CCCCC1O Amb8904047 [0,1,0,1,0,0|1,0,1]=4 11187 B9R1.15 N#CC1CCNCC1=O Amb27966755 [0,1,0,1,0,0|1,0,1]=4 11188 B9R1.15 N#CC1CCOCC1=O Amb18832849 [0,1,0,1,0,0|1,0,1]=4 11189 B9R1.15 N#CC1CNCCC1=O Amb10552622 [0,1,0,1,0,0|1,0,1]=4 11190 B9R1.15 N#CC1CNCCC1=O Amb19958011 [0,1,0,1,0,0|1,0,1]=4 11191 B9R1.15 N#CC1COCCC1=O Amb18832847 [0,1,0,1,0,0|1,0,1]=4 11192 B9R1.15 N#CC1CSCCC1=O Amb18831716 [0,1,0,1,0,0|1,0,1]=4 11193 B9R1.15 N#CC1OCCCC1=O Amb18832848 [0,1,0,1,0,0|1,0,1]=4 11194 B9R1.15 N#C[C@@H]1CCCC[C@@H]1Cl Amb27419897 [0,1,0,1,0,0|1,0,1]=4 11195 B9R1.15 N#C[C@@H]1CCCC[C@@H]1O Amb27663158 [0,1,0,1,0,0|1,0,1]=4 11196 B9R1.15 N#C[C@@H]1CCCC[C@H]1O Amb1993741 [0,1,0,1,0,0|1,0,1]=4 11197 B9R1.15 N#C[C@H]1CCCC[C@@H]1N Amb28348897 [0,1,0,1,0,0|1,0,1]=4 11198 B9R1.15 N#C[C@H]1CCCC[C@@H]1O Amb27832404 [0,1,0,1,0,0|1,0,1]=4 11199 B9R1.15 N#C[C@H]1CCCC[C@H]1N Amb19148365 [0,1,0,1,0,0|1,0,1]=4 11200 B9R1.15 NC1CCCCC1C=O Amb27607940 [0,1,0,1,0,0|0,0,0]=2 11201 B9R1.15 NC1CCCCC1CF Amb27183294 [0,1,0,1,0,0|1,0,1]=4 11202 B9R1.15 NC1CCCCC1CO Amb19515684 [0,1,0,1,0,0|0,0,2]=4 11203 B9R1.15 NC1CCCCC1CO Amb29083407 [0,1,0,1,0,0|0,0,2]=4 11204 B9R1.15 NCC1=C(Cl)CCCC1 Amb18251295 [0,1,0,1,0,0|1,0,1]=4 11205 B9R1.15 NCC1CCCCC1=O Amb18203259 [0,1,0,1,0,0|0,0,0]=2 11206 B9R1.15 NCC1CCCCC1Br Amb28319467 [0,1,0,1,0,0|1,0,1]=4 11207 B9R1.15 NCC1CCCCC1Cl Amb25146158 [0,1,0,1,0,0|1,0,1]=4 11208 B9R1.15 NCC1CCCCC1Cl Amb32652036 [0,1,0,1,0,0|1,0,1]=4 11209 B9R1.15 NCC1CCCCC1F Amb27171602 [0,1,0,1,0,0|1,0,1]=4 11210 B9R1.15 NCC1CCCCC1F Amb32652716 [0,1,0,1,0,0|1,0,1]=4 11211 B9R1.15 NCC1CCCCC1N Amb32663901 [0,1,0,1,0,0|1,0,1]=4 11212 B9R1.15 NCC1CCCCC1N Amb33527303 [0,1,0,1,0,0|1,0,1]=4 11213 B9R1.15 NCC1CCCCC1O Amb22228582 [0,1,0,1,0,0|0,0,2]=4 11214 B9R1.15 NCC1CCCCC1O Amb9277099 [0,1,0,1,0,0|0,0,2]=4 11215 B9R1.15 NCC1CCCCC1S Amb32788231 [0,1,0,1,0,0|0,1,1]=4 11216 B9R1.15 NCC1CCCNC1=O Amb19514595 [0,1,0,1,0,0|1,0,0]=3 11217 B9R1.15 NCC1CCCNC1=O Amb23586199 [0,1,0,1,0,0|1,0,0]=3 11218 B9R1.15 NCC1OCCNC1=O Amb32684680 [0,1,0,1,0,0|2,0,0]=4 11219 B9R1.15 NC[C@@H]1CCCCC1O Amb28120033 [0,1,0,1,0,0|0,0,2]=4 11220 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Amb1993771 [0,1,0,1,0,0|0,0,2]=4 11221 B9R1.15 NC[C@@H]1CCCC[C@H]1N Amb1993785 [0,1,0,1,0,0|1,0,1]=4 11222 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb1993738 [0,1,0,1,0,0|0,0,2]=4 11223 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb32662843 [0,1,0,1,0,0|0,0,2]=4 11224 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb27267791 [0,1,0,1,0,0|0,0,2]=4 11225 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb32662911 [0,1,0,1,0,0|0,0,2]=4 11226 B9R1.15 NC[C@H]1CCCC[C@H]1N Amb19374536 [0,1,0,1,0,0|1,0,1]=4 11227 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb28134233 [0,1,0,1,0,0|0,0,2]=4 11228 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb33774712 [0,1,0,1,0,0|0,0,2]=4 11229 B9R1.15 NN1CCCC[C@@H]1CO Amb28048290 [0,1,0,1,0,0|2,0,0]=4 11230 B9R1.15 NNC1CCCCC1O Amb26054322 [0,1,0,1,0,0|2,0,0]=4 11231 B9R1.15 NN[C@@H]1CCCC[C@@H]1O Amb27204799 [0,1,0,1,0,0|2,0,0]=4 11232 B9R1.15 NN[C@@H]1CCCC[C@H]1N Amb26896096 [0,1,0,1,0,0|2,0,0]=4 11233 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb10608261 [0,1,0,1,0,0|2,0,0]=4 11234 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb22754030 [0,1,0,1,0,0|2,0,0]=4 11235 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb32992354 [0,1,0,1,0,0|2,0,0]=4 11236 B9R1.15 NN[C@H]1CCCC[C@@H]1O Amb27208426 [0,1,0,1,0,0|2,0,0]=4 11237 B9R1.15 N[C@@H]1CCCC[C@@H]1CO Amb26867016 [0,1,0,1,0,0|0,0,2]=4 11238 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993740 [0,1,0,1,0,0|0,0,2]=4 11239 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993773 [0,1,0,1,0,0|0,0,2]=4 11240 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb30640024 [0,1,0,1,0,0|0,0,2]=4 11241 B9R1.15 N[C@H]1CCCC[C@H]1CBr Amb28285726 [0,1,0,1,0,0|1,0,1]=4 11242 B9R1.15 N[C@H]1CCCC[C@H]1CO Amb1993772 [0,1,0,1,0,0|0,0,2]=4 11243 B9R1.15 N\C=C1/CCCCC1=O Amb28054309 [0,1,0,1,0,0|0,0,2]=4 11244 B9R1.15 N\C=C1\CCCCC1=O Amb25146068 [0,1,0,1,0,0|0,0,2]=4 11245 B9R1.15 O=C1CCCC=C1CBr Amb27180223 [0,1,0,1,0,0|0,0,2]=4 11246 B9R1.15 O=C1CCCC=C1CCl Amb27424688 [0,1,0,1,0,0|0,0,2]=4 11247 B9R1.15 O=C1CCCC=C1CO Amb24453147 [0,1,0,1,0,0|0,0,2]=4 11248 B9R1.15 O=C1CCCCC1CO Amb16231080 [0,1,0,1,0,0|0,0,0]=2 11249 B9R1.15 O=C1CCCCC1CS Amb27838753 [0,1,0,1,0,0|0,0,0]=2 11250 B9R1.15 O=C1CCCCN1CCl Amb2798048 [0,1,0,1,0,0|1,0,0]=3 11251 B9R1.15 O=C1CCCC[C@@H]1CO Amb27750239 [0,1,0,1,0,0|0,0,0]=2 11252 B9R1.15 O=C1CCCC[C@H]1CO Amb27956173 [0,1,0,1,0,0|0,0,0]=2 11253 B9R1.15 O=C1CCCC\C1=C/O Amb33109815 [0,1,0,1,0,0|0,0,2]=4 11254 B9R1.15 O=C1CCCC\C1=C/[O-] Amb33541795 [0,1,0,1,0,0|0,0,2]=4 11255 B9R1.15 O=C1CCCC\C1=C\Br Amb27492896 [0,1,0,1,0,0|0,0,2]=4 11256 B9R1.15 O=C1CCCC\C1=C\Cl Amb27200151 [0,1,0,1,0,0|0,0,2]=4 11257 B9R1.15 O=C1CCCC\C1=C\O Amb20001480 [0,1,0,1,0,0|0,0,2]=4 11258 B9R1.15 O=C1CCCC\C1=C\[O-] Amb27247843 [0,1,0,1,0,0|0,0,2]=4 11259 B9R1.15 O=C1CCCC\C1=N\O Amb27780978 [0,1,0,1,0,0|1,0,1]=4 11260 B9R1.15 O=C1CCOCC1CF Amb27623327 [0,1,0,1,0,0|1,0,0]=3 11261 B9R1.15 O=C1NCCCC1CO Amb27814971 [0,1,0,1,0,0|1,0,0]=3 11262 B9R1.15 O=C1NCCCC1CS Amb27473272 [0,1,0,1,0,0|1,0,0]=3 11263 B9R1.15 O=C1NCCNC1CO Amb8010659 [0,1,0,1,0,0|2,0,0]=4 11264 B9R1.15 O=C1NCCN[C@H]1CO Amb27391825 [0,1,0,1,0,0|2,0,0]=4 11265 B9R1.15 O=C1NCCOC1CBr Amb32992407 [0,1,0,1,0,0|2,0,0]=4 11266 B9R1.15 O=C1NCCOC1CCl Amb33329105 [0,1,0,1,0,0|2,0,0]=4 11267 B9R1.15 O=C1NCCOC1CO Amb25235028 [0,1,0,1,0,0|2,0,0]=4 11268 B9R1.15 O=CC1=C(Br)CCCC1 Amb18522186 [0,1,0,1,0,0|0,0,2]=4 11269 B9R1.15 O=CC1=C(Cl)CCCC1 Amb2797788 [0,1,0,1,0,0|0,0,2]=4 11270 B9R1.15 O=CC1=C(S)CCCC1 Amb28074713 [0,1,0,1,0,0|0,0,2]=4 11271 B9R1.15 O=CC1CCCCC1=O Amb19651323 [0,1,0,1,0,0|0,0,1]=3 11272 B9R1.15 O=CC1CCCCC1F Amb24554787 [0,1,0,1,0,0|0,0,0]=2 11273 B9R1.15 O=CC1CCCCC1O Amb25350532 [0,1,0,1,0,0|0,0,0]=2 11274 B9R1.15 O=CC1CNCCC1=O Amb27179726 [0,1,0,1,0,0|1,0,1]=4 11275 B9R1.15 O=CC1CSCCC1O Amb27255110 [0,1,0,1,0,0|1,0,0]=3 11276 B9R1.15 O=CN1CCCCC1=O Amb27861937 [0,1,0,1,0,0|1,0,1]=4 11277 B9R1.15 O=C[C@H]1CCC=C[C@H]1O Amb27854577 [0,1,0,1,0,0|0,0,2]=4 11278 B9R1.15 O=N[C@@H]1CCCC[C@H]1Cl Amb27491097 [0,1,0,1,0,0|1,0,0]=3 11279 B9R1.15 O=S1CCCS[C@H]1CO Amb28315427 [0,1,0,1,0,0|2,0,0]=4 11280 B9R1.15 OC1CCCCC1CBr Amb26848173 [0,1,0,1,0,0|0,0,2]=4 11281 B9R1.15 OCC1=C(Cl)CCCC1 Amb28061885 [0,1,0,1,0,0|1,0,1]=4 11282 B9R1.15 OCC1CCCCC1Br Amb25320883 [0,1,0,1,0,0|0,0,2]=4 11283 B9R1.15 OCC1CCCCC1Cl Amb26054589 [0,1,0,1,0,0|0,0,2]=4 11284 B9R1.15 OCC1CCCCC1F Amb25216302 [0,1,0,1,0,0|0,0,2]=4 11285 B9R1.15 OCC1CCCCC1O Amb2695584 [0,1,0,1,0,0|0,0,2]=4 11286 B9R1.15 OCC1CCCCC1S Amb28186091 [0,1,0,1,0,0|0,0,2]=4 11287 B9R1.15 OC[C@@H]1CCCC[C@@H]1O Amb27428210 [0,1,0,1,0,0|0,0,2]=4 11288 B9R1.15 OC[C@H]1CCCC[C@@H]1Cl Amb28429613 [0,1,0,1,0,0|0,0,2]=4 11289 B9R1.15 OC[C@H]1CCCC[C@@H]1O Amb28384576 [0,1,0,1,0,0|0,0,2]=4 11290 B9R1.15 OC[C@H]1CCCC[C@@H]1S Amb27652987 [0,1,0,1,0,0|0,0,2]=4 11291 B9R1.15 OC[C@H]1CCCC[C@H]1O Amb28430751 [0,1,0,1,0,0|0,0,2]=4 11292 B9R1.15 O[C@@H]1CCCC[C@H]1CCl Amb27420171 [0,1,0,1,0,0|0,0,2]=4 11293 B9R1.15 O[C@@H]1CCCC[C@H]1CS Amb27962214 [0,1,0,1,0,0|0,0,2]=4 11294 B9R1.15 O[C@H]1CCCC[C@H]1CCl Amb27962958 [0,1,0,1,0,0|0,0,2]=4 11295 B9R1.15 SCC1CCCCC1Br Amb28241921 [0,1,0,1,0,0|0,1,1]=4 11296 B9R1.15 [C-]#[N+]C1CCCCC1C Amb5456293 [0,1,0,1,0,0|1,0,1]=4 11297 B9R1.15 [C-]#[N+]C1CCCCC1F Amb28384846 [0,1,0,1,0,0|2,0,0]=4 11298 B9R1.15 [N-]=[N+]=C1CCCCC1=O Amb25074525 [0,1,0,1,0,0|1,0,1]=4 11299 B9R1.18 CCCC1CC1NCC Amb28367904 [0,1,0,1,0,0|1,0,1]=4 11300 B9R1.18 CCCC1OC1CCO Amb28455016 [0,1,0,1,0,0|0,0,2]=4 11301 B9R1.18 CCC[C@H]1O[C@H]1CCO Amb27667122 [0,1,0,1,0,0|0,0,2]=4 11302 B9R1.18 CCOC1CC1N=C=O Amb35725291 [0,1,0,1,0,0|1,0,1]=4 11303 B9R1.18 ClCCC1CC1CCCl Amb27964536 [0,1,0,1,0,0|1,0,1]=4 11304 B9R1.18 NCCC1CC1CCN Amb27872158 [0,1,0,1,0,0|1,0,1]=4 11305 B9R1.18 NCC[C@@H]1C[C@@H]1CCN Amb28423347 [0,1,0,1,0,0|1,0,1]=4 11306 B9R1.18 OCCC1CC1CCO Amb27807200 [0,1,0,1,0,0|0,0,2]=4 11307 B9R1.18 OCC[C@@H]1C[C@H]1CCO Amb27851514 [0,1,0,1,0,0|0,0,2]=4 11308 B9R1.20 C=CC1OC1CCC=O Amb27838722 [0,1,0,1,0,0|0,0,2]=4 11309 B9R1.20 C=CC1OC1CCCO Amb27833659 [0,1,0,1,0,0|2,0,0]=4 11310 B9R1.20 C=CCC[C@@H]1C[C@@H]1CO Amb28401103 [0,1,0,1,0,0|1,0,0]=3 11311 B9R1.20 C=CCC[C@@H]1C[C@H]1CO Amb27198068 [0,1,0,1,0,0|1,0,0]=3 11312 B9R1.20 C=CCC[C@@H]1O[C@@H]1CO Amb27446219 [0,1,0,1,0,0|2,0,0]=4 11313 B9R1.20 C=CCNC1CC1CC Amb27185676 [0,1,0,1,0,0|1,0,0]=3 11314 B9R1.20 C=C[C@@H]1O[C@H]1CCCBr Amb27983790 [0,1,0,1,0,0|2,0,0]=4 11315 B9R1.20 C=C[C@@H]1O[C@H]1CCCO Amb28411200 [0,1,0,1,0,0|2,0,0]=4 11316 B9R1.20 CCC1CC1CCCO Amb32951059 [0,1,0,1,0,0|0,0,2]=4 11317 B9R1.20 CCC1CC1CN=C=O Amb27615569 [0,1,0,1,0,0|0,0,1]=3 11318 B9R1.20 CCC1CC1CN=C=S Amb27476589 [0,1,0,1,0,0|0,1,1]=4 11319 B9R1.20 CCC1CC1NCCN Amb27402730 [0,1,0,1,0,0|1,0,1]=4 11320 B9R1.20 CCC1OC1CCOC Amb27433793 [0,1,0,1,0,0|2,0,0]=4 11321 B9R1.20 CCCCC1CC1CN Amb33428098 [0,1,0,1,0,0|1,0,1]=4 11322 B9R1.20 CCCCC1OC1C=O Amb26852359 [0,1,0,1,0,0|0,0,0]=2 11323 B9R1.20 CCCCC1OC1CBr Amb24480230 [0,1,0,1,0,0|1,0,1]=4 11324 B9R1.20 CCCCC1OC1CCl Amb27755023 [0,1,0,1,0,0|1,0,1]=4 11325 B9R1.20 CCCCC1OC1CO Amb28069435 [0,1,0,1,0,0|0,0,2]=4 11326 B9R1.20 CCCC[C@@H]1C[C@H]1C=O Amb27971394 [0,1,0,1,0,0|0,0,0]=2 11327 B9R1.20 CCCC[C@@H]1C[C@H]1CN Amb33428099 [0,1,0,1,0,0|1,0,1]=4 11328 B9R1.20 CCCC[C@@H]1C[C@H]1CO Amb27857307 [0,1,0,1,0,0|0,0,2]=4 11329 B9R1.20 CCCC[C@@H]1O[C@H]1CN Amb28428722 [0,1,0,1,0,0|1,0,1]=4 11330 B9R1.20 CCCC[C@H]1C[C@@H]1CO Amb27457988 [0,1,0,1,0,0|0,0,2]=4 11331 B9R1.20 CCCC[C@H]1O[C@@H]1CO Amb27446723 [0,1,0,1,0,0|0,0,2]=4 11332 B9R1.20 CCCC[C@H]1O[C@H]1CCl Amb27975821 [0,1,0,1,0,0|1,0,1]=4 11333 B9R1.20 CCNCC1CC1CC Amb18523852 [0,1,0,1,0,0|1,0,1]=4 11334 B9R1.20 CCSCC1CC1CN Amb33323704 [0,1,0,1,0,0|1,0,1]=4 11335 B9R1.20 CCSC[C@@H]1C[C@H]1CN Amb33323705 [0,1,0,1,0,0|1,0,1]=4 11336 B9R1.20 CC[C@@H]1C[C@H]1CCCO Amb33213083 [0,1,0,1,0,0|0,0,2]=4 11337 B9R1.20 CC[C@@H]1C[C@H]1CN=[N+]=[N-] Amb32697067 [0,1,0,1,0,0|2,0,0]=4 11338 B9R1.20 CC\C=C\C1OC1C=O Amb28194116 [0,1,0,1,0,0|0,0,2]=4 11339 B9R1.20 COCCC1CC1CN Amb33377366 [0,1,0,1,0,0|1,0,1]=4 11340 B9R1.20 COCC[C@@H]1C[C@H]1CN Amb33377367 [0,1,0,1,0,0|1,0,1]=4 11341 B9R1.20 CSCCC1CC1CN Amb33197628 [0,1,0,1,0,0|1,0,1]=4 11342 B9R1.20 CSCC[C@@H]1C[C@H]1CN Amb33197637 [0,1,0,1,0,0|1,0,1]=4 11343 B9R1.20 C\C=C\CC1OC1C=O Amb28324398 [0,1,0,1,0,0|0,0,2]=4 11344 B9R1.20 O=C[C@@H]1O[C@H]1CCCBr Amb28320749 [0,1,0,1,0,0|1,0,0]=3 11345 B9R1.20 O=C[C@H]1C[C@H]1CCCBr Amb27202574 [0,1,0,1,0,0|0,0,0]=2 11346 B9R1.22 C=C1CC(C)N(C=O)C1 Amb27424694 [0,1,0,1,0,0|1,0,1]=4 11347 B9R1.22 CC1=C(C=O)C[C@H](C)C1 Amb27265755 [0,1,0,1,0,0|0,0,2]=4 11348 B9R1.22 CC1CC(=O)C(C=O)C1 Amb27234402 [0,1,0,1,0,0|1,0,1]=4 11349 B9R1.22 CC1CC(C=O)C(C)O1 Amb27859589 [0,1,0,1,0,0|1,0,0]=3 11350 B9R1.22 CC1CC(O)CN1C=O Amb27266299 [0,1,0,1,0,0|1,0,0]=3 11351 B9R1.22 CC1CN(C=O)C(C)O1 Amb26397153 [0,1,0,1,0,0|2,0,0]=4 11352 B9R1.22 CCC1=C(C)CC(O)C1 Amb28049098 [0,1,0,1,0,0|1,0,1]=4 11353 B9R1.22 CCC1=CC(C)CC1=O Amb28285166 [0,1,0,1,0,0|0,0,2]=4 11354 B9R1.22 CCC1=CC(O)CC1=O Amb27954205 [0,1,0,1,0,0|0,0,2]=4 11355 B9R1.22 CCC1CC(=O)NC1=O Amb24117084 [0,1,0,1,0,0|1,0,1]=4 11356 B9R1.22 CCC1CC(=O)OC1=O Amb24571652 [0,1,0,1,0,0|1,0,1]=4 11357 B9R1.22 CCC1CC(C)CN1N Amb27874317 [0,1,0,1,0,0|2,0,0]=4 11358 B9R1.22 CCC1CN(C)CC1=O Amb27589818 [0,1,0,1,0,0|1,0,0]=3 11359 B9R1.22 CCC1NC(=O)CC1=O Amb18203277 [0,1,0,1,0,0|1,0,1]=4 11360 B9R1.22 CCC1OC(=O)CC1=O Amb27249611 [0,1,0,1,0,0|1,0,1]=4 11361 B9R1.22 CCC1SC(N)NC1=O Amb27409696 [0,1,0,1,0,0|2,0,0]=4 11362 B9R1.22 CCN1CC(N)CC1=O Amb22586938 [0,1,0,1,0,0|1,0,0]=3 11363 B9R1.22 CCN1CC(N)CC1=O Amb8010272 [0,1,0,1,0,0|1,0,0]=3 11364 B9R1.22 CCN1CC(O)CC1=O Amb22059452 [0,1,0,1,0,0|1,0,0]=3 11365 B9R1.22 CCN1CN(C)CC1=O Amb27837656 [0,1,0,1,0,0|2,0,0]=4 11366 B9R1.22 CN1CC(F)CC1C=O Amb28288494 [0,1,0,1,0,0|1,0,0]=3 11367 B9R1.22 CO[C@@H]1C[C@@H](C)CC1=O Amb27802508 [0,1,0,1,0,0|1,0,0]=3 11368 B9R1.22 C[C@H]1C[C@@H](C)CC1CO Amb28319916 [0,1,0,1,0,0|0,0,2]=4 11369 B9R1.27 C=C1CCC(C)C1CBr Amb27442986 [0,1,0,1,0,0|2,0,0]=4 11370 B9R1.27 CC1CCC(=O)N1CN Amb27849847 [0,1,0,1,0,0|2,0,0]=4 11371 B9R1.27 CC1CCC(C)C1CN Amb27239112 [0,1,0,1,0,0|1,0,1]=4 11372 B9R1.27 CC1CCC(F)C1CN Amb20623959 [0,1,0,1,0,0|1,0,1]=4 11373 B9R1.27 CC1CCC(N)C1CF Amb20623960 [0,1,0,1,0,0|1,0,1]=4 11374 B9R1.27 CC1CCC(N)C1CN Amb20622976 [0,1,0,1,0,0|1,0,1]=4 11375 B9R1.27 CC1CCC(N)C1CO Amb20623115 [0,1,0,1,0,0|0,0,2]=4 11376 B9R1.27 CC1CCC(O)C1CN Amb20623190 [0,1,0,1,0,0|1,0,1]=4 11377 B9R1.27 CC1CCC(O)C1CO Amb27617054 [0,1,0,1,0,0|0,0,2]=4 11378 B9R1.27 CCC1=C(Cl)CCC1=O Amb27836883 [0,1,0,1,0,0|0,0,2]=4 11379 B9R1.27 CCC1=C(O)CCC1=O Amb27838731 [0,1,0,1,0,0|0,0,2]=4 11380 B9R1.27 CCC1C(=O)C=CC1C Amb28199783 [0,1,0,1,0,0|0,0,2]=4 11381 B9R1.27 CCC1C(=O)CCC1=O Amb8513847 [0,1,0,1,0,0|0,0,1]=3 11382 B9R1.27 CCC1C(=O)COC1C Amb30013811 [0,1,0,1,0,0|1,0,0]=3 11383 B9R1.27 CCC1C(O)CCC1O Amb28049245 [0,1,0,1,0,0|0,0,2]=4 11384 B9R1.27 CCN1C(=O)CCC1=O Amb2967303 [0,1,0,1,0,0|1,0,1]=4 11385 B9R1.27 CCN1C(=O)CCC1O Amb26435226 [0,1,0,1,0,0|1,0,0]=3 11386 B9R1.27 CCN1C(=O)CNC1C Amb25217470 [0,1,0,1,0,0|2,0,0]=4 11387 B9R1.27 CCN1C(=O)OCC1O Amb28134794 [0,1,0,1,0,0|2,0,0]=4 11388 B9R1.27 CC[C@@H]1C(=O)C=C[C@@H]1C Amb28052276 [0,1,0,1,0,0|0,0,2]=4 11389 B9R1.27 CC[C@@H]1C(=O)CC[C@H]1C Amb27256164 [0,1,0,1,0,0|0,0,0]=2 11390 B9R1.27 CC[C@@H]1C(=O)OC[C@H]1O Amb27456703 [0,1,0,1,0,0|1,0,0]=3 11391 B9R1.27 CC[C@H]1C(Br)=CC[C@@H]1C Amb25175093 [0,1,0,1,0,0|1,0,1]=4 11392 B9R1.27 CN1CCC(=O)C1CCl Amb27788146 [0,1,0,1,0,0|2,0,0]=4 11393 B9R1.27 COC1C(=O)OCC1O Amb27237829 [0,1,0,1,0,0|2,0,0]=4 11394 B9R1.27 C[C@@H]1CCC(=O)N1CCl Amb26612804 [0,1,0,1,0,0|2,0,0]=4 11395 B9R1.27 C[C@@H]1CCC(=O)[C@@H]1CO Amb27802556 [0,1,0,1,0,0|1,0,0]=3 11396 B9R1.27 C[C@H]1CCC(=O)N1CO Amb28138780 [0,1,0,1,0,0|2,0,0]=4 11397 B9R1.27 O=C1OCC(O)C1CO Amb27456568 [0,1,0,1,0,0|2,0,0]=4 11398 B9R1.27 O=C1OC[C@@H](O)[C@@H]1CO Amb27484769 [0,1,0,1,0,0|2,0,0]=4 11399 B9R1.33 C#CCC1CCCC1O Amb24720084 [0,1,0,1,0,0|1,0,1]=4 11400 B9R1.33 C#CCC1CCCN1C Amb33320722 [0,1,0,1,0,0|1,0,1]=4 11401 B9R1.33 C#CCC1CCOC1C Amb33425977 [0,1,0,1,0,0|1,0,1]=4 11402 B9R1.33 C#CCC1COCC1=O Amb35635975 [0,1,0,1,0,0|0,0,2]=4 11403 B9R1.33 C#CCC1CSCC1=O Amb28347873 [0,1,0,1,0,0|0,0,2]=4 11404 B9R1.33 C#CCN1CCCC1=O Amb8391272 [0,1,0,1,0,0|0,0,2]=4 11405 B9R1.33 C#CCN1CCCC1C Amb27410071 [0,1,0,1,0,0|1,0,1]=4 11406 B9R1.33 C#CC[C@@H]1CCC[C@H]1O Amb32944967 [0,1,0,1,0,0|1,0,1]=4 11407 B9R1.33 C=C1COCC1CC=O Amb18642400 [0,1,0,1,0,0|0,0,2]=4 11408 B9R1.33 C=C1COCC1CCC Amb35646841 [0,1,0,1,0,0|1,0,0]=3 11409 B9R1.33 C=CCC1CCCC1=O Amb27254600 [0,1,0,1,0,0|0,0,1]=3 11410 B9R1.33 C=CCC1CCCC1N Amb18962682 [0,1,0,1,0,0|1,0,0]=3 11411 B9R1.33 C=CCC1CCCC1O Amb26866231 [0,1,0,1,0,0|1,0,0]=3 11412 B9R1.33 C=CCC1CCCN1C Amb25888684 [0,1,0,1,0,0|1,0,0]=3 11413 B9R1.33 C=CCC1CCNC1=O Amb24384112 [0,1,0,1,0,0|0,0,2]=4 11414 B9R1.33 C=CCC1CCOC1=O Amb26353280 [0,1,0,1,0,0|0,0,2]=4 11415 B9R1.33 C=CCC1CCOC1O Amb27478723 [0,1,0,1,0,0|2,0,0]=4 11416 B9R1.33 C=CCC1CNCC1O Amb25888807 [0,1,0,1,0,0|2,0,0]=4 11417 B9R1.33 C=CCC1COCC1=O Amb27235559 [0,1,0,1,0,0|0,0,2]=4 11418 B9R1.33 C=CCC1COCC1Br Amb35736877 [0,1,0,1,0,0|2,0,0]=4 11419 B9R1.33 C=CCC1COCC1Cl Amb35736783 [0,1,0,1,0,0|2,0,0]=4 11420 B9R1.33 C=CCC1COCC1O Amb25802917 [0,1,0,1,0,0|2,0,0]=4 11421 B9R1.33 C=CCC1CSCC1=O Amb27172516 [0,1,0,1,0,0|0,0,2]=4 11422 B9R1.33 C=CCC1OCCC1=O Amb27838795 [0,1,0,1,0,0|0,0,2]=4 11423 B9R1.33 C=CCC1OCCC1Cl Amb28343089 [0,1,0,1,0,0|2,0,0]=4 11424 B9R1.33 C=CCN1CCCC1=O Amb3318633 [0,1,0,1,0,0|0,0,2]=4 11425 B9R1.33 C=CCN1CCCC1C Amb28208182 [0,1,0,1,0,0|1,0,0]=3 11426 B9R1.33 C=CC[C@@H]1CCCC1=O Amb27227506 [0,1,0,1,0,0|0,0,1]=3 11427 B9R1.33 C=CC[C@@H]1CCCN1C Amb25129424 [0,1,0,1,0,0|1,0,0]=3 11428 B9R1.33 C=CC[C@@H]1CCC[C@H]1N Amb24443339 [0,1,0,1,0,0|1,0,0]=3 11429 B9R1.33 C=CC[C@@H]1CCC[C@H]1O Amb25215733 [0,1,0,1,0,0|1,0,0]=3 11430 B9R1.33 C=CC[C@@H]1CNC[C@H]1O Amb25956350 [0,1,0,1,0,0|2,0,0]=4 11431 B9R1.33 C=CC[C@@H]1COC[C@H]1N Amb27254139 [0,1,0,1,0,0|2,0,0]=4 11432 B9R1.33 C=CC[C@@H]1COC[C@H]1O Amb27665455 [0,1,0,1,0,0|2,0,0]=4 11433 B9R1.33 C=CC[C@H]1CCC[C@@H]1N Amb27852520 [0,1,0,1,0,0|1,0,0]=3 11434 B9R1.33 C=CC[C@H]1CCC[C@@H]1O Amb27970558 [0,1,0,1,0,0|1,0,0]=3 11435 B9R1.33 C=CC[C@H]1CCC[C@H]1N Amb27206042 [0,1,0,1,0,0|1,0,0]=3 11436 B9R1.33 C=CC[C@H]1CNC[C@H]1O Amb27203917 [0,1,0,1,0,0|2,0,0]=4 11437 B9R1.33 CC1CCCC1CNN Amb27481090 [0,1,0,1,0,0|1,0,1]=4 11438 B9R1.33 CC1CCCC1N=C=O Amb27447200 [0,1,0,1,0,0|0,0,1]=3 11439 B9R1.33 CC1CCCC1N=C=S Amb27881407 [0,1,0,1,0,0|0,1,1]=4 11440 B9R1.33 CC1CCCC1NC=O Amb28430376 [0,1,0,1,0,0|0,0,0]=2 11441 B9R1.33 CC1CCCC1NCO Amb28429256 [0,1,0,1,0,0|0,0,2]=4 11442 B9R1.33 CC1CCCN1CCBr Amb18317658 [0,1,0,1,0,0|1,0,1]=4 11443 B9R1.33 CC1CCCN1CCBr Amb33804314 [0,1,0,1,0,0|1,0,1]=4 11444 B9R1.33 CC1CCCN1CCI Amb27806349 [0,1,0,1,0,0|1,0,1]=4 11445 B9R1.33 CC1CCCN1CCN Amb18962426 [0,1,0,1,0,0|1,0,1]=4 11446 B9R1.33 CC1CCCN1CCS Amb27834962 [0,1,0,1,0,0|0,1,1]=4 11447 B9R1.33 CC1CCC\C1=C/CN Amb27185789 [0,1,0,1,0,0|1,0,1]=4 11448 B9R1.33 CC1CCNC1CCO Amb25865855 [0,1,0,1,0,0|0,0,2]=4 11449 B9R1.33 CC1CCOC1CCBr Amb33742803 [0,1,0,1,0,0|1,0,1]=4 11450 B9R1.33 CC1CCOC1CCN Amb33329020 [0,1,0,1,0,0|1,0,1]=4 11451 B9R1.33 CC1CCOC1CCO Amb33741891 [0,1,0,1,0,0|0,0,2]=4 11452 B9R1.33 CC1COCC1CCN Amb35635553 [0,1,0,1,0,0|1,0,1]=4 11453 B9R1.33 CC1COCC1N=C=O Amb35616490 [0,1,0,1,0,0|1,0,1]=4 11454 B9R1.33 CC1COCC1NC=O Amb35633027 [0,1,0,1,0,0|1,0,0]=3 11455 B9R1.33 CC1OCCC1CC#N Amb33310473 [0,1,0,1,0,0|1,0,1]=4 11456 B9R1.33 CC1OCCC1CC=O Amb33427195 [0,1,0,1,0,0|0,0,0]=2 11457 B9R1.33 CC1OCCC1CCBr Amb33333670 [0,1,0,1,0,0|1,0,1]=4 11458 B9R1.33 CC1OCCC1CCN Amb25769636 [0,1,0,1,0,0|1,0,1]=4 11459 B9R1.33 CC1OCCC1CCO Amb33427650 [0,1,0,1,0,0|0,0,2]=4 11460 B9R1.33 CC1OCCC1CCS Amb33426770 [0,1,0,1,0,0|0,1,1]=4 11461 B9R1.33 CC1OCCC1CNN Amb26458199 [0,1,0,1,0,0|2,0,0]=4 11462 B9R1.33 CC1OCCC1CNO Amb33428024 [0,1,0,1,0,0|1,0,1]=4 11463 B9R1.33 CC1OCCC1CON Amb33427223 [0,1,0,1,0,0|2,0,0]=4 11464 B9R1.33 CC1OCCC1N=C=O Amb28251745 [0,1,0,1,0,0|1,0,1]=4 11465 B9R1.33 CC1SCCC1CC=O Amb28286972 [0,1,0,1,0,0|0,0,0]=2 11466 B9R1.33 CCCC1CC=CC1=O Amb27838711 [0,1,0,1,0,0|0,0,1]=3 11467 B9R1.33 CCCC1CCCC1=O Amb8503562 [0,1,0,1,0,0|0,0,0]=2 11468 B9R1.33 CCCC1CCCC1N Amb18954322 [0,1,0,1,0,0|1,0,1]=4 11469 B9R1.33 CCCC1CCCC1O Amb26922499 [0,1,0,1,0,0|0,0,2]=4 11470 B9R1.33 CCCC1CCCN1N Amb25700027 [0,1,0,1,0,0|1,0,1]=4 11471 B9R1.33 CCCC1CCNC1C Amb18961055 [0,1,0,1,0,0|1,0,1]=4 11472 B9R1.33 CCCC1CCOS1=O Amb27408512 [0,1,0,1,0,0|1,0,0]=3 11473 B9R1.33 CCCC1CNCC1C Amb27856203 [0,1,0,1,0,0|1,0,1]=4 11474 B9R1.33 CCCC1CNCC1O Amb27407775 [0,1,0,1,0,0|0,0,2]=4 11475 B9R1.33 CCCC1COCC1=O Amb35639022 [0,1,0,1,0,0|0,0,0]=2 11476 B9R1.33 CCCC1COCC1Br Amb35736880 [0,1,0,1,0,0|1,0,1]=4 11477 B9R1.33 CCCC1COCC1Cl Amb35736785 [0,1,0,1,0,0|1,0,1]=4 11478 B9R1.33 CCCC1COCC1N Amb29877503 [0,1,0,1,0,0|1,0,1]=4 11479 B9R1.33 CCCC1COCC1O Amb33213638 [0,1,0,1,0,0|0,0,2]=4 11480 B9R1.33 CCCC1COCC1S Amb32788392 [0,1,0,1,0,0|0,1,1]=4 11481 B9R1.33 CCCC1CSCC1Br Amb27656182 [0,1,0,1,0,0|1,0,1]=4 11482 B9R1.33 CCCC1NCCC1F Amb28053585 [0,1,0,1,0,0|1,0,1]=4 11483 B9R1.33 CCCC1OCCC1Cl Amb28320772 [0,1,0,1,0,0|0,0,2]=4 11484 B9R1.33 CCCC1SCCC1O Amb27171321 [0,1,0,1,0,0|0,0,2]=4 11485 B9R1.33 CCCN1C=CCC1=O Amb27792230 [0,1,0,1,0,0|0,0,2]=4 11486 B9R1.33 CCCN1CCCC1=O Amb15691721 [0,1,0,1,0,0|0,0,0]=2 11487 B9R1.33 CCCN1CCN=C1N Amb28067757 [0,1,0,1,0,0|2,0,0]=4 11488 B9R1.33 CCCN1CCNC1=S Amb4035798 [0,1,0,1,0,0|1,1,0]=4 11489 B9R1.33 CCCN1CNCC1=O Amb24481722 [0,1,0,1,0,0|1,0,0]=3 11490 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [0,1,0,1,0,0|0,0,0]=2 11491 B9R1.33 CCC[C@@H]1CCC[C@H]1O Amb24519919 [0,1,0,1,0,0|0,0,2]=4 11492 B9R1.33 CCC[C@@H]1CNC[C@@H]1N Amb32709349 [0,1,0,1,0,0|1,0,1]=4 11493 B9R1.33 CCC[C@@H]1CNC[C@H]1O Amb27639284 [0,1,0,1,0,0|0,0,2]=4 11494 B9R1.33 CCC[C@@H]1COC[C@H]1O Amb32950257 [0,1,0,1,0,0|0,0,2]=4 11495 B9R1.33 CCC[C@@H]1OCC[C@H]1Cl Amb27626973 [0,1,0,1,0,0|0,0,2]=4 11496 B9R1.33 CCC[C@@H]1SCC[C@@H]1O Amb27443600 [0,1,0,1,0,0|0,0,2]=4 11497 B9R1.33 CCC[C@@H]1SCC[C@H]1O Amb28206535 [0,1,0,1,0,0|0,0,2]=4 11498 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [0,1,0,1,0,0|0,0,0]=2 11499 B9R1.33 CCNC1CCNC1=O Amb28249830 [0,1,0,1,0,0|1,0,0]=3 11500 B9R1.33 CCNC1CCNC1=O Amb28960288 [0,1,0,1,0,0|1,0,0]=3 11501 B9R1.33 CCNC1CCSC1=O Amb25706233 [0,1,0,1,0,0|1,0,0]=3 11502 B9R1.33 CCN[C@H]1CCOC1=O Amb28249000 [0,1,0,1,0,0|1,0,0]=3 11503 B9R1.33 CCOC1=CCCC1=O Amb27256367 [0,1,0,1,0,0|0,0,2]=4 11504 B9R1.33 CCOC1CCCC1=O Amb25147133 [0,1,0,1,0,0|0,0,0]=2 11505 B9R1.33 CCOC1CCCC1Br Amb18321006 [0,1,0,1,0,0|1,0,1]=4 11506 B9R1.33 CCOC1CCCC1I Amb26333595 [0,1,0,1,0,0|1,0,1]=4 11507 B9R1.33 CCOC1CCCC1N Amb1138244 [0,1,0,1,0,0|1,0,1]=4 11508 B9R1.33 CCOC1CCCC1O Amb27837436 [0,1,0,1,0,0|0,0,2]=4 11509 B9R1.33 CCO[C@@H]1CCC[C@H]1Br Amb27657762 [0,1,0,1,0,0|1,0,1]=4 11510 B9R1.33 CCO[C@@H]1CCC[C@H]1N Amb26570508 [0,1,0,1,0,0|1,0,1]=4 11511 B9R1.33 CCO[C@@H]1CCC[C@H]1O Amb24595865 [0,1,0,1,0,0|0,0,2]=4 11512 B9R1.33 CCSC1=CCCC1=O Amb27861411 [0,1,0,1,0,0|0,0,2]=4 11513 B9R1.33 CCSC1CCCC1N Amb20623771 [0,1,0,1,0,0|1,0,1]=4 11514 B9R1.33 CCSC1CCNC1=O Amb27837709 [0,1,0,1,0,0|1,0,0]=3 11515 B9R1.33 CCSC1CCOC1=O Amb27975642 [0,1,0,1,0,0|1,0,0]=3 11516 B9R1.33 CCS[C@@H]1CCC[C@H]1Cl Amb28051667 [0,1,0,1,0,0|1,0,1]=4 11517 B9R1.33 CC\C=C1/CCCC1=O Amb27235548 [0,1,0,1,0,0|0,0,1]=3 11518 B9R1.33 CC\C=C1\CCCC1=O Amb26408836 [0,1,0,1,0,0|0,0,1]=3 11519 B9R1.33 CC\C=C1\CCOC1=O Amb25225082 [0,1,0,1,0,0|0,0,2]=4 11520 B9R1.33 CN1CCCC1CCBr Amb20668048 [0,1,0,1,0,0|1,0,1]=4 11521 B9R1.33 CN1CCCC1CCBr Amb24478647 [0,1,0,1,0,0|1,0,1]=4 11522 B9R1.33 CN1CCCC1CCCl Amb3940532 [0,1,0,1,0,0|1,0,1]=4 11523 B9R1.33 CN1CCCC1CCCl Amb8387380 [0,1,0,1,0,0|1,0,1]=4 11524 B9R1.33 CN1CCCC1CCN Amb3939814 [0,1,0,1,0,0|1,0,1]=4 11525 B9R1.33 CN1CCCC1CCO Amb3939053 [0,1,0,1,0,0|0,0,2]=4 11526 B9R1.33 CN1CCCC1CCS Amb33449384 [0,1,0,1,0,0|0,1,1]=4 11527 B9R1.33 CN1CCCC1CNN Amb24340166 [0,1,0,1,0,0|2,0,0]=4 11528 B9R1.33 CN1CCCC1N=C=O Amb28053080 [0,1,0,1,0,0|1,0,1]=4 11529 B9R1.33 CN1CCC[C@@H]1CCN Amb22386854 [0,1,0,1,0,0|1,0,1]=4 11530 B9R1.33 CN1CCC[C@@H]1CCN Amb31307961 [0,1,0,1,0,0|1,0,1]=4 11531 B9R1.33 CN1CCC[C@@H]1CCO Amb22755468 [0,1,0,1,0,0|0,0,2]=4 11532 B9R1.33 CN1CCC[C@H]1CCN Amb20241159 [0,1,0,1,0,0|1,0,1]=4 11533 B9R1.33 CN1CCC[C@H]1CCN Amb33801604 [0,1,0,1,0,0|1,0,1]=4 11534 B9R1.33 CN1CCC[C@H]1CCO Amb28366574 [0,1,0,1,0,0|0,0,2]=4 11535 B9R1.33 CN1CCC[C@H]1CNN Amb28346597 [0,1,0,1,0,0|2,0,0]=4 11536 B9R1.33 CN1CCC\C1=C/C=O Amb27480456 [0,1,0,1,0,0|0,0,2]=4 11537 B9R1.33 CNCC1CCCC1=O Amb27202013 [0,1,0,1,0,0|0,0,0]=2 11538 B9R1.33 CNCC1CCCC1O Amb18642712 [0,1,0,1,0,0|0,0,2]=4 11539 B9R1.33 CNCC1CCCN1C Amb30869455 [0,1,0,1,0,0|2,0,0]=4 11540 B9R1.33 CNCC1CCCN1C Amb33539060 [0,1,0,1,0,0|2,0,0]=4 11541 B9R1.33 CNCC1CCCN1C Amb8503453 [0,1,0,1,0,0|2,0,0]=4 11542 B9R1.33 CNCC1CCOC1C Amb25888856 [0,1,0,1,0,0|2,0,0]=4 11543 B9R1.33 CNCC1CNCC1C Amb27946471 [0,1,0,1,0,0|2,0,0]=4 11544 B9R1.33 CNCC1COCC1C Amb35635594 [0,1,0,1,0,0|2,0,0]=4 11545 B9R1.33 CNC[C@@H]1CCC[C@@H]1N Amb35663444 [0,1,0,1,0,0|1,0,1]=4 11546 B9R1.33 CNC[C@H]1CCCN1C Amb24477725 [0,1,0,1,0,0|2,0,0]=4 11547 B9R1.33 CN\C=C1\CCCC1=O Amb24477752 [0,1,0,1,0,0|0,0,2]=4 11548 B9R1.33 COCC1CCCC1=O Amb25766356 [0,1,0,1,0,0|0,0,0]=2 11549 B9R1.33 COCC1CCCC1Br Amb27765324 [0,1,0,1,0,0|1,0,1]=4 11550 B9R1.33 COCC1CCCC1O Amb25223631 [0,1,0,1,0,0|0,0,2]=4 11551 B9R1.33 COCC1CCCN1N Amb18559529 [0,1,0,1,0,0|2,0,0]=4 11552 B9R1.33 COCC1CCNC1=S Amb27460760 [0,1,0,1,0,0|1,1,0]=4 11553 B9R1.33 COCC1CNCC1C Amb29083431 [0,1,0,1,0,0|2,0,0]=4 11554 B9R1.33 COCC1COCC1=O Amb35639023 [0,1,0,1,0,0|1,0,0]=3 11555 B9R1.33 COCC1SCCC1=O Amb28324277 [0,1,0,1,0,0|1,0,0]=3 11556 B9R1.33 COC[C@@H]1CCCN1N Amb6754072 [0,1,0,1,0,0|2,0,0]=4 11557 B9R1.33 COC[C@@H]1CCC[C@@H]1N Amb22748722 [0,1,0,1,0,0|1,0,1]=4 11558 B9R1.33 COC[C@@H]1CCC[C@H]1O Amb32950893 [0,1,0,1,0,0|0,0,2]=4 11559 B9R1.33 COC[C@H]1C=CC[C@@H]1O Amb27652492 [0,1,0,1,0,0|2,0,0]=4 11560 B9R1.33 COC[C@H]1CCCN1N Amb6754071 [0,1,0,1,0,0|2,0,0]=4 11561 B9R1.33 COC[C@H]1CCC[C@@H]1N Amb34916663 [0,1,0,1,0,0|1,0,1]=4 11562 B9R1.33 COC[C@H]1CCC[C@H]1N Amb10607714 [0,1,0,1,0,0|1,0,1]=4 11563 B9R1.33 CONC1CCOC1=O Amb28128618 [0,1,0,1,0,0|2,0,0]=4 11564 B9R1.33 CO\C=C1\CCCC1=O Amb27640557 [0,1,0,1,0,0|0,0,2]=4 11565 B9R1.33 CSCC1CCCC1=O Amb27838797 [0,1,0,1,0,0|0,0,0]=2 11566 B9R1.33 CSC[C@@H]1NCC[C@@H]1C Amb27216180 [0,1,0,1,0,0|2,0,0]=4 11567 B9R1.33 CSC[C@@H]1NCC[C@H]1C Amb28423462 [0,1,0,1,0,0|2,0,0]=4 11568 B9R1.33 CS\C=C1/CCCC1=O Amb27185670 [0,1,0,1,0,0|0,0,2]=4 11569 B9R1.33 C[C@@H]1CCCN1CCN Amb27469487 [0,1,0,1,0,0|1,0,1]=4 11570 B9R1.33 C[C@@H]1CCC[C@H]1CCO Amb27207721 [0,1,0,1,0,0|0,0,2]=4 11571 B9R1.33 C[C@@H]1CCO[C@@H]1CCN Amb33483077 [0,1,0,1,0,0|1,0,1]=4 11572 B9R1.33 C[C@H]1CCCN1CCN Amb27389681 [0,1,0,1,0,0|1,0,1]=4 11573 B9R1.33 C[C@H]1CCC[C@H]1N=[N+]=[N-] Amb28287893 [0,1,0,1,0,0|2,0,0]=4 11574 B9R1.33 C[C@H]1NCC[C@@H]1CCO Amb27632925 [0,1,0,1,0,0|0,0,2]=4 11575 B9R1.33 C\C=C/C1CCCC1=O Amb27594741 [0,1,0,1,0,0|0,0,1]=3 11576 B9R1.33 C\C=C\C1CCCC1O Amb32944936 [0,1,0,1,0,0|1,0,1]=4 11577 B9R1.33 C\C=C\N1CCCC1=O Amb27767943 [0,1,0,1,0,0|0,0,2]=4 11578 B9R1.33 C\C=C\[C@@H]1CCC[C@@H]1O Amb28069459 [0,1,0,1,0,0|1,0,1]=4 11579 B9R1.33 C\C=C\[C@@H]1CCC[C@H]1O Amb27196803 [0,1,0,1,0,0|1,0,1]=4 11580 B9R1.33 N#CCC1CCCC1O Amb18642327 [0,1,0,1,0,0|1,0,1]=4 11581 B9R1.33 N#CCN1CCCC1=O Amb6276072 [0,1,0,1,0,0|1,0,1]=4 11582 B9R1.33 N#CC[C@H]1CCC[C@@H]1O Amb28195204 [0,1,0,1,0,0|1,0,1]=4 11583 B9R1.33 N#CSC1CCCC1=O Amb17593573 [0,1,0,1,0,0|1,0,1]=4 11584 B9R1.33 N=C1CCCN1CCF Amb28256068 [0,1,0,1,0,0|2,0,0]=4 11585 B9R1.33 NC1CCCC1CCBr Amb27875577 [0,1,0,1,0,0|1,0,1]=4 11586 B9R1.33 NC1CCCC1CCO Amb25888622 [0,1,0,1,0,0|0,0,2]=4 11587 B9R1.33 NCCC1CCCC1=O Amb18832679 [0,1,0,1,0,0|0,0,0]=2 11588 B9R1.33 NCCC1CCCC1F Amb27222607 [0,1,0,1,0,0|1,0,1]=4 11589 B9R1.33 NCCC1CCCC1N Amb29868675 [0,1,0,1,0,0|1,0,1]=4 11590 B9R1.33 NCCC1CCCC1O Amb18832551 [0,1,0,1,0,0|0,0,2]=4 11591 B9R1.33 NCCC1CCNC1=O Amb18832608 [0,1,0,1,0,0|1,0,0]=3 11592 B9R1.33 NCCN1CCCC1=O Amb1127713 [0,1,0,1,0,0|1,0,0]=3 11593 B9R1.33 NCCN1CCCC1=O Amb21954145 [0,1,0,1,0,0|1,0,0]=3 11594 B9R1.33 NCCN1CCCC1=O Amb22586789 [0,1,0,1,0,0|1,0,0]=3 11595 B9R1.33 NCCN1CCNC1=O Amb2691301 [0,1,0,1,0,0|2,0,0]=4 11596 B9R1.33 NCCN1CCOC1=O Amb22491260 [0,1,0,1,0,0|2,0,0]=4 11597 B9R1.33 NCCN1CCOC1=O Amb6673432 [0,1,0,1,0,0|2,0,0]=4 11598 B9R1.33 NCC[C@@H]1CCC[C@H]1N Amb29867730 [0,1,0,1,0,0|1,0,1]=4 11599 B9R1.33 NCC[C@@H]1CCC[C@H]1O Amb33209494 [0,1,0,1,0,0|0,0,2]=4 11600 B9R1.33 NCC[C@@H]1CCC[C@H]1O Amb33482662 [0,1,0,1,0,0|0,0,2]=4 11601 B9R1.33 NN1CCCC1CCO Amb27809143 [0,1,0,1,0,0|2,0,0]=4 11602 B9R1.33 O=C1C=CCC1CCO Amb27260839 [0,1,0,1,0,0|0,0,2]=4 11603 B9R1.33 O=C1CCCC1CCBr Amb20623655 [0,1,0,1,0,0|0,0,0]=2 11604 B9R1.33 O=C1CCCC1CCF Amb33551119 [0,1,0,1,0,0|0,0,0]=2 11605 B9R1.33 O=C1CCCC1CCO Amb27221111 [0,1,0,1,0,0|0,0,0]=2 11606 B9R1.33 O=C1CCCN1CCBr Amb6255009 [0,1,0,1,0,0|1,0,0]=3 11607 B9R1.33 O=C1CCCN1CCCl Amb2721825 [0,1,0,1,0,0|1,0,0]=3 11608 B9R1.33 O=C1CCCN1CCO Amb3939173 [0,1,0,1,0,0|1,0,0]=3 11609 B9R1.33 O=C1CCOC1CCO Amb27838611 [0,1,0,1,0,0|1,0,0]=3 11610 B9R1.33 O=C1NCCC1CCBr Amb27956490 [0,1,0,1,0,0|1,0,0]=3 11611 B9R1.33 O=C1NCCC1CCCl Amb25946315 [0,1,0,1,0,0|1,0,0]=3 11612 B9R1.33 O=C1NCCC1CCO Amb33531266 [0,1,0,1,0,0|1,0,0]=3 11613 B9R1.33 O=C1NCCN1CCBr Amb22886708 [0,1,0,1,0,0|2,0,0]=4 11614 B9R1.33 O=C1NCCN1CCCl Amb8388069 [0,1,0,1,0,0|2,0,0]=4 11615 B9R1.33 O=C1NCCN1CCO Amb2721114 [0,1,0,1,0,0|2,0,0]=4 11616 B9R1.33 O=C1NCCN1CCS Amb28139089 [0,1,0,1,0,0|2,0,0]=4 11617 B9R1.33 O=C1NCC[C@@H]1CCO Amb27593854 [0,1,0,1,0,0|1,0,0]=3 11618 B9R1.33 O=C1OCCC1CCBr Amb20667717 [0,1,0,1,0,0|1,0,0]=3 11619 B9R1.33 O=C1OCCC1CCCl Amb27201250 [0,1,0,1,0,0|1,0,0]=3 11620 B9R1.33 O=C1OCCC1CCO Amb25293532 [0,1,0,1,0,0|1,0,0]=3 11621 B9R1.33 O=C1OCCN1CCBr Amb33533050 [0,1,0,1,0,0|2,0,0]=4 11622 B9R1.33 O=C1OCCN1CCCl Amb33527230 [0,1,0,1,0,0|2,0,0]=4 11623 B9R1.33 O=C1OCCN1CCI Amb35703773 [0,1,0,1,0,0|2,0,0]=4 11624 B9R1.33 O=C1OCCN1CCO Amb2720764 [0,1,0,1,0,0|2,0,0]=4 11625 B9R1.33 O=C1OCCN1CCS Amb27838578 [0,1,0,1,0,0|2,0,0]=4 11626 B9R1.33 O=C=N[C@@H]1CCC[C@@H]1Br Amb27984852 [0,1,0,1,0,0|1,0,1]=4 11627 B9R1.33 O=C=N[C@@H]1CCC[C@H]1Br Amb26425854 [0,1,0,1,0,0|1,0,1]=4 11628 B9R1.33 O=C=N[C@H]1CCC[C@@H]1Br Amb27454053 [0,1,0,1,0,0|1,0,1]=4 11629 B9R1.33 O=CCC1C=CCC1O Amb28061425 [0,1,0,1,0,0|0,0,2]=4 11630 B9R1.33 O=CC[C@@H]1CC=C[C@H]1O Amb27210535 [0,1,0,1,0,0|0,0,2]=4 11631 B9R1.33 O=CC[C@H]1C=CC[C@H]1O Amb28287670 [0,1,0,1,0,0|0,0,2]=4 11632 B9R1.33 O=CNC1CCCC1O Amb27245097 [0,1,0,1,0,0|1,0,0]=3 11633 B9R1.33 O=COC1CCCC1=O Amb27844040 [0,1,0,1,0,0|1,0,1]=4 11634 B9R1.33 O=COC1COCC1Cl Amb27243303 [0,1,0,1,0,0|2,0,0]=4 11635 B9R1.33 O=CO[C@@H]1CCC[C@H]1O Amb27852507 [0,1,0,1,0,0|1,0,0]=3 11636 B9R1.33 OC1CCCC1CCF Amb27838511 [0,1,0,1,0,0|0,0,2]=4 11637 B9R1.33 OCCC1=C(Br)CCC1 Amb27826576 [0,1,0,1,0,0|1,0,1]=4 11638 B9R1.33 OCCC1C=CCC1O Amb27642147 [0,1,0,1,0,0|2,0,0]=4 11639 B9R1.33 OCCC1CCCC1F Amb27224301 [0,1,0,1,0,0|0,0,2]=4 11640 B9R1.33 OCCC1CCCC1O Amb25888928 [0,1,0,1,0,0|0,0,2]=4 11641 B9R1.33 OCCC1CCNC1=S Amb27783161 [0,1,0,1,0,0|1,1,0]=4 11642 B9R1.33 OCC[C@@H]1C=CC[C@@H]1O Amb27207047 [0,1,0,1,0,0|2,0,0]=4 11643 B9R1.33 OCC[C@@H]1CCC[C@@H]1O Amb27843176 [0,1,0,1,0,0|0,0,2]=4 11644 B9R1.33 OCC[C@@H]1CCC[C@H]1O Amb28292507 [0,1,0,1,0,0|0,0,2]=4 11645 B9R1.33 O[C@@H]1CCC[C@H]1\C=C/Cl Amb27191904 [0,1,0,1,0,0|1,0,1]=4 11646 B9R1.33 S=C1CCCN1CCS Amb27196457 [0,1,0,1,0,0|1,1,0]=4 11647 B9R1.33 [C-]#[N+]CC1CCCC1C Amb27793797 [0,1,0,1,0,0|1,0,1]=4 11648 B9R1.33 [C-]#[N+]CC1CCCC1F Amb28053221 [0,1,0,1,0,0|2,0,0]=4 11649 B9R1.33 [C-]#[N+]CC1CCCN1C Amb33320723 [0,1,0,1,0,0|2,0,0]=4 11650 B9R1.33 [C-]#[N+]CC1CCOC1C Amb33427241 [0,1,0,1,0,0|2,0,0]=4 11651 B9R1.33 [N-]=[N+]=NC1CCCC1=O Amb28058852 [0,1,0,1,0,0|2,0,0]=4 11652 B9R1.48 C=C1CCOC[C@H](O)C1 Amb27406726 [0,1,0,1,0,0|2,0,0]=4 11653 B9R1.48 CC1=CC(=O)CCCC1 Amb17593284 [0,1,0,1,0,0|0,0,1]=3 11654 B9R1.48 CC1=CC(Cl)CCCC1 Amb27469441 [0,1,0,1,0,0|1,0,1]=4 11655 B9R1.48 CC1=CC(N)CCCC1 Amb28040829 [0,1,0,1,0,0|1,0,1]=4 11656 B9R1.48 CC1CC(=O)NCCN1 Amb18832620 [0,1,0,1,0,0|2,0,0]=4 11657 B9R1.48 CC1CC(=O)NCCO1 Amb27244386 [0,1,0,1,0,0|2,0,0]=4 11658 B9R1.48 CC1CC(=O)NCCS1 Amb22642277 [0,1,0,1,0,0|2,0,0]=4 11659 B9R1.48 CC1CCC=CC(=O)C1 Amb28460736 [0,1,0,1,0,0|0,0,2]=4 11660 B9R1.48 CC1CCC=CC(O)C1 Amb28400665 [0,1,0,1,0,0|2,0,0]=4 11661 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|0,0,0]=2 11662 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,1,0,1,0,0|0,0,0]=2 11663 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [0,1,0,1,0,0|0,0,0]=2 11664 B9R1.48 CC1CCCCC(Br)C1 Amb27640824 [0,1,0,1,0,0|1,0,1]=4 11665 B9R1.48 CC1CCCCC(C)N1 Amb27859477 [0,1,0,1,0,0|1,0,1]=4 11666 B9R1.48 CC1CCCCC(O)C1 Amb28051128 [0,1,0,1,0,0|0,0,2]=4 11667 B9R1.48 CC1CCCCN(C)C1 Amb27211471 [0,1,0,1,0,0|2,0,0]=4 11668 B9R1.48 CC1CCCNC(=O)C1 Amb28364919 [0,1,0,1,0,0|1,0,0]=3 11669 B9R1.48 CC1CCCSC(N)=N1 Amb27950002 [0,1,0,1,0,0|2,0,0]=4 11670 B9R1.48 CC1CCNCC(C)C1 Amb20622727 [0,1,0,1,0,0|2,0,0]=4 11671 B9R1.48 CC1CNCCC(=O)N1 Amb27838526 [0,1,0,1,0,0|1,0,0]=3 11672 B9R1.48 CC1CNCCS(=O)C1 Amb26610537 [0,1,0,1,0,0|2,0,0]=4 11673 B9R1.48 CC1CNCCS(=O)C1 Amb28555360 [0,1,0,1,0,0|2,0,0]=4 11674 B9R1.48 CC1COCCC(=O)N1 Amb28123242 [0,1,0,1,0,0|1,0,0]=3 11675 B9R1.48 CC1CSCCC(=O)N1 Amb27253792 [0,1,0,1,0,0|1,0,0]=3 11676 B9R1.48 CN1CCCCC(N)C1 Amb19516791 [0,1,0,1,0,0|2,0,0]=4 11677 B9R1.48 CN1CCCNC(=O)C1 Amb28282218 [0,1,0,1,0,0|2,0,0]=4 11678 B9R1.48 C[C@@H]1CC(=O)NCCN1 Amb26457829 [0,1,0,1,0,0|2,0,0]=4 11679 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [0,1,0,1,0,0|0,0,0]=2 11680 B9R1.48 C[C@@H]1CCCNC(=O)C1 Amb28241573 [0,1,0,1,0,0|1,0,0]=3 11681 B9R1.48 C[C@@H]1CCNC[C@H](C)C1 Amb35746843 [0,1,0,1,0,0|2,0,0]=4 11682 B9R1.48 C[C@H]1CCCNC(=O)C1 Amb27174761 [0,1,0,1,0,0|1,0,0]=3 11683 B9R1.48 NC1CCCCC(F)C1 Amb24454709 [0,1,0,1,0,0|1,0,1]=4 11684 B9R1.48 N[C@@H]1CCCC[C@H](O)C1 Amb27188377 [0,1,0,1,0,0|0,0,2]=4 11685 B9R1.48 O=C1C=CCC[C@H](O)C1 Amb27838758 [0,1,0,1,0,0|0,0,2]=4 11686 B9R1.48 O=C1CCCCC(=O)C1 Amb10603368 [0,1,0,1,0,0|0,0,1]=3 11687 B9R1.48 O=C1CCCCC(=O)N1 Amb8439258 [0,1,0,1,0,0|1,0,1]=4 11688 B9R1.48 O=C1CCCCC(=O)O1 Amb8487366 [0,1,0,1,0,0|1,0,1]=4 11689 B9R1.48 O=C1CCCCC(=S)N1 Amb24374795 [0,1,0,1,0,0|1,0,1]=4 11690 B9R1.48 O=C1CCCCC(O)C1 Amb27838745 [0,1,0,1,0,0|0,0,0]=2 11691 B9R1.48 O=C1CCCCC(O)O1 Amb27424648 [0,1,0,1,0,0|1,0,0]=3 11692 B9R1.48 O=C1CCCC[C@H](O)C1 Amb27618242 [0,1,0,1,0,0|0,0,0]=2 11693 B9R1.48 O=C1CCCNC(=O)C1 Amb18832700 [0,1,0,1,0,0|1,0,1]=4 11694 B9R1.48 OC1C=C(Br)CCCC1 Amb28455049 [0,1,0,1,0,0|1,0,1]=4 11695 B9R1.49 C=C1CCCC(=O)NC1 Amb27252961 [0,1,0,1,0,0|1,0,1]=4 11696 B9R1.49 C=C1CCCC(C)CC1 Amb22364866 [0,1,0,1,0,0|1,0,0]=3 11697 B9R1.49 CC1=CCC(=O)CCC1 Amb27838790 [0,1,0,1,0,0|0,0,2]=4 11698 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,1,0,1,0,0|0,0,2]=4 11699 B9R1.49 CC1C=CC(Cl)CCC1 Amb27179881 [0,1,0,1,0,0|1,0,0]=3 11700 B9R1.49 CC1C=CC(O)CCC1 Amb27599988 [0,1,0,1,0,0|1,0,0]=3 11701 B9R1.49 CC1CC=CC(=O)CC1 Amb27838660 [0,1,0,1,0,0|0,0,2]=4 11702 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,1,0,1,0,0|0,0,0]=2 11703 B9R1.49 CC1CCCC(C)NC1 Amb19148123 [0,1,0,1,0,0|1,0,1]=4 11704 B9R1.49 CC1CCCC(Cl)CC1 Amb27860130 [0,1,0,1,0,0|1,0,1]=4 11705 B9R1.49 CC1CCCC(N)CC1 Amb25178098 [0,1,0,1,0,0|1,0,1]=4 11706 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|0,0,2]=4 11707 B9R1.49 CC1CCCC(S)CC1 Amb26326403 [0,1,0,1,0,0|0,1,1]=4 11708 B9R1.49 CC1CCCN(C)CC1 Amb27837612 [0,1,0,1,0,0|2,0,0]=4 11709 B9R1.49 CC1CCCN(N)CC1 Amb27424632 [0,1,0,1,0,0|2,0,0]=4 11710 B9R1.49 CC1CCNC(=O)CC1 Amb9316850 [0,1,0,1,0,0|1,0,0]=3 11711 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,1,0,0|1,0,0]=3 11712 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,1,0,1,0,0|2,0,0]=4 11713 B9R1.49 CC1CCS(=O)CCN1 Amb28555361 [0,1,0,1,0,0|2,0,0]=4 11714 B9R1.49 CC1CNC(=O)CCN1 Amb10607813 [0,1,0,1,0,0|2,0,0]=4 11715 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,1,0,1,0,0|2,0,0]=4 11716 B9R1.49 CN1CCCC(=O)CC1 Amb8383587 [0,1,0,1,0,0|1,0,0]=3 11717 B9R1.49 CN1CCCC(=O)CC1 Amb8394679 [0,1,0,1,0,0|1,0,0]=3 11718 B9R1.49 CN1CCCC(Br)CC1 Amb27945185 [0,1,0,1,0,0|2,0,0]=4 11719 B9R1.49 CN1CCCC(Cl)CC1 Amb2610602 [0,1,0,1,0,0|2,0,0]=4 11720 B9R1.49 CN1CCCC(N)CC1 Amb18832600 [0,1,0,1,0,0|2,0,0]=4 11721 B9R1.49 CN1CCCC(N)CC1 Amb30585204 [0,1,0,1,0,0|2,0,0]=4 11722 B9R1.49 CN1CCCC(O)CC1 Amb18832552 [0,1,0,1,0,0|2,0,0]=4 11723 B9R1.49 CN1CCCC(O)CC1 Amb22751622 [0,1,0,1,0,0|2,0,0]=4 11724 B9R1.49 CN1CCCC(S)CC1 Amb26936316 [0,1,0,1,0,0|2,0,0]=4 11725 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,1,0,1,0,0|2,0,0]=4 11726 B9R1.49 CN1CCNC(=O)CC1 Amb8393772 [0,1,0,1,0,0|2,0,0]=4 11727 B9R1.49 C[C@@H]1C=C[C@@H](O)CCC1 Amb27220561 [0,1,0,1,0,0|1,0,0]=3 11728 B9R1.49 C[C@@H]1CC=C[C@@H](Cl)CC1 Amb27472012 [0,1,0,1,0,0|1,0,1]=4 11729 B9R1.49 C[C@@H]1CC=C[C@H](Cl)CC1 Amb27232720 [0,1,0,1,0,0|1,0,1]=4 11730 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,1,0,1,0,0|0,0,0]=2 11731 B9R1.49 C[C@@H]1CCCC(=O)NC1 Amb27814970 [0,1,0,1,0,0|1,0,0]=3 11732 B9R1.49 C[C@H]1C=C[C@H](Cl)CCC1 Amb27629772 [0,1,0,1,0,0|1,0,0]=3 11733 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,1,0,1,0,0|0,0,0]=2 11734 B9R1.49 C[C@H]1CCC[C@@H](O)CC1 Amb27661374 [0,1,0,1,0,0|0,0,2]=4 11735 B9R1.49 C[C@H]1CCC[C@H](O)CC1 Amb27220545 [0,1,0,1,0,0|0,0,2]=4 11736 B9R1.49 ClC1CCCC(Cl)CC1 Amb22364836 [0,1,0,1,0,0|1,0,1]=4 11737 B9R1.49 Cl[C@H]1CCC[C@H](Cl)CC1 Amb28399791 [0,1,0,1,0,0|1,0,1]=4 11738 B9R1.49 NC1CCCC(=O)NC1 Amb22230053 [0,1,0,1,0,0|1,0,0]=3 11739 B9R1.49 NC1CCCC(=O)NC1 Amb27867752 [0,1,0,1,0,0|1,0,0]=3 11740 B9R1.49 NC1CCCC(F)CC1 Amb28289169 [0,1,0,1,0,0|1,0,1]=4 11741 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,1,0,1,0,0|1,0,0]=3 11742 B9R1.49 NC1CCNC(=O)CC1 Amb32663578 [0,1,0,1,0,0|1,0,0]=3 11743 B9R1.49 NC1CCNC(=O)CC1 Amb32663872 [0,1,0,1,0,0|1,0,0]=3 11744 B9R1.49 N[C@@H]1CCC[C@@H](Cl)CC1 Amb27447260 [0,1,0,1,0,0|1,0,1]=4 11745 B9R1.49 N[C@@H]1CCC[C@H](O)CC1 Amb27221049 [0,1,0,1,0,0|0,0,2]=4 11746 B9R1.49 O=C1CCC(=O)COC1 Amb2707216 [0,1,0,1,0,0|1,0,1]=4 11747 B9R1.49 O=C1CCC(Cl)CCN1 Amb27768772 [0,1,0,1,0,0|1,0,0]=3 11748 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,1,0,1,0,0|1,0,0]=3 11749 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,1,0,1,0,0|1,0,0]=3 11750 B9R1.49 O=C1CCCC(O)CN1 Amb22491274 [0,1,0,1,0,0|1,0,0]=3 11751 B9R1.49 O=C1CCCC(O)CO1 Amb28138759 [0,1,0,1,0,0|1,0,0]=3 11752 B9R1.49 O=C1CCCS(=O)CC1 Amb26476534 [0,1,0,1,0,0|1,0,0]=3 11753 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,1,0,1,0,0|0,0,0]=2 11754 B9R1.49 O=C1CCNC(=O)CC1 Amb22490261 [0,1,0,1,0,0|1,0,1]=4 11755 B9R1.49 O=C1CCS(=O)CCN1 Amb26480169 [0,1,0,1,0,0|2,0,0]=4 11756 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,1,0,1,0,0|1,0,0]=3 11757 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,1,0,1,0,0|1,0,0]=3 11758 B9R1.49 O=C1CNCC(O)CN1 Amb27838571 [0,1,0,1,0,0|2,0,0]=4 11759 B9R1.49 O[C@@H]1CCC[C@@H](O)CC1 Amb27647850 [0,1,0,1,0,0|0,0,2]=4 11760 B9R1.50 BrC1=CCCCCCC1 Amb23590920 [0,1,0,1,0,0|1,0,0]=3 11761 B9R1.50 BrC1C=CCCCCC1 Amb24480205 [0,1,0,1,0,0|1,0,0]=3 11762 B9R1.50 BrC1CCC=CCCC1 Amb24355370 [0,1,0,1,0,0|1,0,0]=3 11763 B9R1.50 BrC1CCCCCCC1 Amb6366088 [0,1,0,1,0,0|1,0,1]=4 11764 B9R1.50 CC1C=CCCC=CC1 Amb22347896 [0,1,0,1,0,0|1,0,1]=4 11765 B9R1.50 CC1CCCCCCC1 Amb22230834 [0,1,0,1,0,0|1,0,1]=4 11766 B9R1.50 CC1CCCCCCN1 Amb26579162 [0,1,0,1,0,0|1,0,1]=4 11767 B9R1.50 CC1CCNCCCN1 Amb18832588 [0,1,0,1,0,0|1,0,1]=4 11768 B9R1.50 CC1CNCCCCN1 Amb28067733 [0,1,0,1,0,0|1,0,1]=4 11769 B9R1.50 CC1OCCCCCO1 Amb28367128 [0,1,0,1,0,0|0,0,2]=4 11770 B9R1.50 CN1CCCCCCC1 Amb26406289 [0,1,0,1,0,0|1,0,1]=4 11771 B9R1.50 CN1CCCNCCC1 Amb18276963 [0,1,0,1,0,0|2,0,0]=4 11772 B9R1.50 CN1CCCNCCC1 Amb33483191 [0,1,0,1,0,0|2,0,0]=4 11773 B9R1.50 ClC1C=CCCCCC1 Amb27484094 [0,1,0,1,0,0|1,0,0]=3 11774 B9R1.50 ClC1CCC=CCCC1 Amb28118846 [0,1,0,1,0,0|1,0,0]=3 11775 B9R1.50 ClC1CCCCCCC1 Amb4018627 [0,1,0,1,0,0|1,0,1]=4 11776 B9R1.50 ClC1CCCCOCC1 Amb27984820 [0,1,0,1,0,0|0,0,2]=4 11777 B9R1.50 NC1C=CCCCCC1 Amb22410845 [0,1,0,1,0,0|1,0,0]=3 11778 B9R1.50 NC1C=CCCCCC1 Amb32652668 [0,1,0,1,0,0|1,0,0]=3 11779 B9R1.50 NC1CCC=CCCC1 Amb27814669 [0,1,0,1,0,0|1,0,0]=3 11780 B9R1.50 NC1CCC=CCCC1 Amb33307000 [0,1,0,1,0,0|1,0,0]=3 11781 B9R1.50 NC1CCCCCCC1 Amb2720323 [0,1,0,1,0,0|1,0,1]=4 11782 B9R1.50 NC1CCCCCNC1 Amb24447204 [0,1,0,1,0,0|1,0,1]=4 11783 B9R1.50 NC1CCCCCNC1 Amb32686531 [0,1,0,1,0,0|1,0,1]=4 11784 B9R1.50 NN1CCCCCCC1 Amb27203446 [0,1,0,1,0,0|1,0,1]=4 11785 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [0,1,0,1,0,0|1,0,0]=3 11786 B9R1.50 O=C1C=CCCCCC1 Amb3987503 [0,1,0,1,0,0|0,0,1]=3 11787 B9R1.50 O=C1C=CCCCCN1 Amb24469221 [0,1,0,1,0,0|0,0,2]=4 11788 B9R1.50 O=C1C=CCCOCC1 Amb27838783 [0,1,0,1,0,0|0,0,2]=4 11789 B9R1.50 O=C1CC=CCCOC1 Amb22364797 [0,1,0,1,0,0|0,0,2]=4 11790 B9R1.50 O=C1CCCCCCC1 Amb2721546 [0,1,0,1,0,0|0,0,0]=2 11791 B9R1.50 O=C1CCCCCCN1 Amb2780498 [0,1,0,1,0,0|0,0,0]=2 11792 B9R1.50 O=C1CCCCCCO1 Amb27468239 [0,1,0,1,0,0|0,0,0]=2 11793 B9R1.50 O=C1CCCNCCN1 Amb27165283 [0,1,0,1,0,0|1,0,0]=3 11794 B9R1.50 O=C1CCCSCCC1 Amb17593637 [0,1,0,1,0,0|0,0,0]=2 11795 B9R1.50 O=C1CCNCCCN1 Amb22263665 [0,1,0,1,0,0|1,0,0]=3 11796 B9R1.50 O=C1CCNCCCN1 Amb23403551 [0,1,0,1,0,0|1,0,0]=3 11797 B9R1.50 O=C1CNCCCNC1 Amb30867936 [0,1,0,1,0,0|1,0,0]=3 11798 B9R1.50 O=C1NCCCCCN1 Amb25146134 [0,1,0,1,0,0|1,0,0]=3 11799 B9R1.50 OC1C=CCCCCC1 Amb22364937 [0,1,0,1,0,0|1,0,0]=3 11800 B9R1.50 OC1C=CCCCOC1 Amb27452486 [0,1,0,1,0,0|2,0,0]=4 11801 B9R1.50 OC1CC#CCCCC1 Amb27956638 [0,1,0,1,0,0|1,0,1]=4 11802 B9R1.50 OC1CC=CCCOC1 Amb22364794 [0,1,0,1,0,0|2,0,0]=4 11803 B9R1.50 OC1CCC=CCCC1 Amb21858009 [0,1,0,1,0,0|1,0,0]=3 11804 B9R1.50 OC1CCCCCCC1 Amb6608643 [0,1,0,1,0,0|0,0,2]=4 11805 B9R1.50 OC1CCCCCCO1 Amb27970488 [0,1,0,1,0,0|0,0,2]=4 11806 B9R1.50 OC1CCCCCOC1 Amb22364795 [0,1,0,1,0,0|0,0,2]=4 11807 B9R1.50 OC1CCCCSCC1 Amb28315547 [0,1,0,1,0,0|0,0,2]=4 11808 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [0,1,0,1,0,0|1,0,0]=3 11809 B9R1.50 O[C@@H]1CCC=CCCC1 Amb25781269 [0,1,0,1,0,0|1,0,0]=3 11810 B9R1.50 O[C@H]1CCC=CCCC1 Amb24481888 [0,1,0,1,0,0|1,0,0]=3 11811 B9R1.50 SC1CCCCCCC1 Amb7784772 [0,1,0,1,0,0|0,1,1]=4 11812 B9R1.57 CCCC1C(Cl)C1CO Amb27764896 [0,1,0,1,0,0|0,0,2]=4 11813 B9R1.57 CCCC1C(F)C1CO Amb27651625 [0,1,0,1,0,0|0,0,2]=4 11814 B9R1.57 C\C=C/[C@H]1[C@H](C)[C@@H]1C=O Amb27782373 [0,1,0,1,0,0|0,0,2]=4 11815 B9R1.57 C\C=C\C1C(C)C1C=O Amb25979273 [0,1,0,1,0,0|0,0,2]=4 11816 B9R1.57 C\C=C\[C@H]1[C@@H](C)[C@H]1C=O Amb27210842 [0,1,0,1,0,0|0,0,2]=4 11817 B9R1.57 C\C=C\[C@H]1[C@H](C)[C@@H]1C=O Amb27447475 [0,1,0,1,0,0|0,0,2]=4 11818 B9R1.58 CCC1CC(CC=O)C1 Amb27782138 [0,1,0,1,0,0|0,0,0]=2 11819 B9R1.58 CCC1CC(CCN)C1 Amb27962846 [0,1,0,1,0,0|1,0,1]=4 11820 B9R1.58 CCC1CC(CNC)C1 Amb27197281 [0,1,0,1,0,0|2,0,0]=4 11821 B9R1.58 CCC1CN(CC=O)C1 Amb35664465 [0,1,0,1,0,0|1,0,0]=3 11822 B9R1.58 CCCC1CC(CN)C1 Amb26537008 [0,1,0,1,0,0|1,0,1]=4 11823 B9R1.58 CCOC1CC(C=O)C1 Amb24470388 [0,1,0,1,0,0|1,0,0]=3 11824 B9R1.58 COC1CC(CC=O)C1 Amb27441194 [0,1,0,1,0,0|1,0,0]=3 11825 B9R1.58 COC1CC(NC=O)C1 Amb27225623 [0,1,0,1,0,0|2,0,0]=4 11826 B9R1.58 O=CNC1CC(CO)C1 Amb35603318 [0,1,0,1,0,0|2,0,0]=4 11827 B9R1.69 C=C1CC(O)CCC1C Amb28401292 [0,1,0,1,0,0|1,0,0]=3 11828 B9R1.69 C=C1CCC(C)CC1O Amb28049090 [0,1,0,1,0,0|2,0,0]=4 11829 B9R1.69 C=C1C[C@@H](O)CC[C@H]1C Amb27650219 [0,1,0,1,0,0|1,0,0]=3 11830 B9R1.69 CC1=C(C)CC(C)CC1 Amb26603643 [0,1,0,1,0,0|1,0,1]=4 11831 B9R1.69 CC1=C(C)CC(Cl)CC1 Amb27233566 [0,1,0,1,0,0|1,0,1]=4 11832 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [0,1,0,1,0,0|0,0,2]=4 11833 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [0,1,0,1,0,0|0,0,2]=4 11834 B9R1.69 CC1=CC(O)CCC1=O Amb27838743 [0,1,0,1,0,0|0,0,2]=4 11835 B9R1.69 CC1=CC(O)CCC1C Amb27218950 [0,1,0,1,0,0|1,0,1]=4 11836 B9R1.69 CC1=CC(O)CC[C@H]1C Amb28350322 [0,1,0,1,0,0|1,0,1]=4 11837 B9R1.69 CC1=CC[C@@H](O)C[C@H]1C Amb27970535 [0,1,0,1,0,0|1,0,1]=4 11838 B9R1.69 CC1=CC[C@H](O)C[C@@H]1C Amb27446679 [0,1,0,1,0,0|1,0,1]=4 11839 B9R1.69 CC1C=CC(=O)C(C)C1 Amb27433057 [0,1,0,1,0,0|0,0,2]=4 11840 B9R1.69 CC1CC(=O)C(C)CN1 Amb32757537 [0,1,0,1,0,0|1,0,0]=3 11841 B9R1.69 CC1CC(=O)C(C)CN1 Amb792443 [0,1,0,1,0,0|1,0,0]=3 11842 B9R1.69 CC1CC(=O)C(C)CS1 Amb4399940 [0,1,0,1,0,0|1,0,0]=3 11843 B9R1.69 CC1CC(=O)CCS1=O Amb28461149 [0,1,0,1,0,0|1,0,1]=4 11844 B9R1.69 CC1CC(Br)CCC1=O Amb28396505 [0,1,0,1,0,0|0,0,0]=2 11845 B9R1.69 CC1CC(Br)CCN1C Amb25336308 [0,1,0,1,0,0|2,0,0]=4 11846 B9R1.69 CC1CC(N)CCC1N Amb27440794 [0,1,0,1,0,0|1,0,1]=4 11847 B9R1.69 CC1CC(N)CCC1O Amb24624100 [0,1,0,1,0,0|0,0,2]=4 11848 B9R1.69 CC1CC(N)CCN1C Amb18943774 [0,1,0,1,0,0|2,0,0]=4 11849 B9R1.69 CC1CC(O)CCC1O Amb24726092 [0,1,0,1,0,0|0,0,2]=4 11850 B9R1.69 CC1CC(O)CCN1C Amb25943765 [0,1,0,1,0,0|2,0,0]=4 11851 B9R1.69 CC1CC(S)CCN1C Amb24585678 [0,1,0,1,0,0|2,0,0]=4 11852 B9R1.69 CC1CCC(=O)C(Br)C1 Amb18325312 [0,1,0,1,0,0|1,0,0]=3 11853 B9R1.69 CC1CCC(=O)C(C)C1 Amb27945615 [0,1,0,1,0,0|0,0,0]=2 11854 B9R1.69 CC1CCC(=O)C(F)C1 Amb27947951 [0,1,0,1,0,0|1,0,0]=3 11855 B9R1.69 CC1CCC(=O)C(O)C1 Amb25333970 [0,1,0,1,0,0|1,0,0]=3 11856 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|0,0,1]=3 11857 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,1,0,1,0,0|1,0,1]=4 11858 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,1,0,1,0,0|1,0,1]=4 11859 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [0,1,0,1,0,0|1,0,0]=3 11860 B9R1.69 CC1CCC(Br)C(C)C1 Amb18329561 [0,1,0,1,0,0|1,0,1]=4 11861 B9R1.69 CC1CCC(Br)CC1C Amb25838066 [0,1,0,1,0,0|1,0,1]=4 11862 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [0,1,0,1,0,0|0,0,0]=2 11863 B9R1.69 CC1CCC(C)C(=O)N1 Amb25692572 [0,1,0,1,0,0|1,0,0]=3 11864 B9R1.69 CC1CCC(C)C(C)C1 Amb4017852 [0,1,0,1,0,0|1,0,1]=4 11865 B9R1.69 CC1CCC(C)C(N)C1 Amb6374323 [0,1,0,1,0,0|1,0,1]=4 11866 B9R1.69 CC1CCC(C)C(O)C1 Amb3941490 [0,1,0,1,0,0|0,0,2]=4 11867 B9R1.69 CC1CCC(C)C(S)C1 Amb25296681 [0,1,0,1,0,0|0,1,1]=4 11868 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [0,1,0,1,0,0|1,0,0]=3 11869 B9R1.69 CC1CCC(Cl)C(C)C1 Amb27837439 [0,1,0,1,0,0|1,0,1]=4 11870 B9R1.69 CC1CCC(Cl)CC1C Amb26562244 [0,1,0,1,0,0|1,0,1]=4 11871 B9R1.69 CC1CCC(Cl)CN1C Amb27626131 [0,1,0,1,0,0|2,0,0]=4 11872 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [0,1,0,1,0,0|1,0,0]=3 11873 B9R1.69 CC1CCC(N)C(=O)N1 Amb26015847 [0,1,0,1,0,0|2,0,0]=4 11874 B9R1.69 CC1CCC(N)C(C)C1 Amb19515132 [0,1,0,1,0,0|1,0,1]=4 11875 B9R1.69 CC1CCC(N)CC1C Amb33543352 [0,1,0,1,0,0|1,0,1]=4 11876 B9R1.69 CC1CCC(N)CC1N Amb25321520 [0,1,0,1,0,0|1,0,1]=4 11877 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,1,0,1,0,0|0,0,2]=4 11878 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [0,1,0,1,0,0|2,0,0]=4 11879 B9R1.69 CC1CCC(O)C(C)C1 Amb4034595 [0,1,0,1,0,0|0,0,2]=4 11880 B9R1.69 CC1CCC(O)CC1C Amb10844787 [0,1,0,1,0,0|1,0,1]=4 11881 B9R1.69 CC1CCC(O)CC1N Amb32867259 [0,1,0,1,0,0|1,0,1]=4 11882 B9R1.69 CC1CCC(S)C(C)C1 Amb26043135 [0,1,0,1,0,0|0,1,1]=4 11883 B9R1.69 CC1CCC(S)CC1C Amb27589824 [0,1,0,1,0,0|1,0,1]=4 11884 B9R1.69 CC1CCN(C)CC1=O Amb27861305 [0,1,0,1,0,0|1,0,0]=3 11885 B9R1.69 CC1CCN(N)C(C)C1 Amb27768780 [0,1,0,1,0,0|2,0,0]=4 11886 B9R1.69 CC1CN(C)C(=O)CN1 Amb22227754 [0,1,0,1,0,0|2,0,0]=4 11887 B9R1.69 CC1CN(C)CCC1=O Amb9783387 [0,1,0,1,0,0|1,0,0]=3 11888 B9R1.69 CC1CN=C(N)C(C)C1 Amb26951260 [0,1,0,1,0,0|2,0,0]=4 11889 B9R1.69 CC1CNC(=O)C(C)C1 Amb20670731 [0,1,0,1,0,0|1,0,0]=3 11890 B9R1.69 CC1CNC(=O)C(C)N1 Amb25255409 [0,1,0,1,0,0|2,0,0]=4 11891 B9R1.69 CC1CNC(=O)C(C)O1 Amb25831184 [0,1,0,1,0,0|2,0,0]=4 11892 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,1,0,0|1,0,1]=4 11893 B9R1.69 CC1CNC(=O)N(C)C1 Amb15701562 [0,1,0,1,0,0|2,0,0]=4 11894 B9R1.69 CC1CNC(=O)[C@H](C)N1 Amb18832613 [0,1,0,1,0,0|2,0,0]=4 11895 B9R1.69 CC1CNC(C)C(=O)N1 Amb18642668 [0,1,0,1,0,0|2,0,0]=4 11896 B9R1.69 CC1NC(=O)CCC1=O Amb27874094 [0,1,0,1,0,0|1,0,1]=4 11897 B9R1.69 CC1OCC(=O)CC1=O Amb27838792 [0,1,0,1,0,0|1,0,1]=4 11898 B9R1.69 CC1SCC(=O)CC1=O Amb27838733 [0,1,0,1,0,0|1,0,1]=4 11899 B9R1.69 CN1CC(=O)CCC1=O Amb23555663 [0,1,0,1,0,0|1,0,1]=4 11900 B9R1.69 CN1CC(N)CCC1=O Amb15701238 [0,1,0,1,0,0|1,0,0]=3 11901 B9R1.69 CN1CC(N)CCC1=O Amb22405964 [0,1,0,1,0,0|1,0,0]=3 11902 B9R1.69 CN1CC(N)CCC1=O Amb22586977 [0,1,0,1,0,0|1,0,0]=3 11903 B9R1.69 CN1CC(N)CNC1=O Amb26035453 [0,1,0,1,0,0|2,0,0]=4 11904 B9R1.69 CN1CC(O)CCC1=O Amb22304825 [0,1,0,1,0,0|1,0,0]=3 11905 B9R1.69 CN1CCC(=O)C(N)C1 Amb18832618 [0,1,0,1,0,0|2,0,0]=4 11906 B9R1.69 CN1CCC(=O)C(O)C1 Amb32649088 [0,1,0,1,0,0|2,0,0]=4 11907 B9R1.69 CN1CCC(=O)CC1=O Amb27154977 [0,1,0,1,0,0|1,0,1]=4 11908 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [0,1,0,1,0,0|1,0,0]=3 11909 B9R1.69 CN1CCC(N)CC1=O Amb28895935 [0,1,0,1,0,0|1,0,0]=3 11910 B9R1.69 CN1CCC(N)CC1=O Amb8010833 [0,1,0,1,0,0|1,0,0]=3 11911 B9R1.69 CN1C[C@@H](N)CCC1=O Amb27473199 [0,1,0,1,0,0|1,0,0]=3 11912 B9R1.69 CN1C[C@@H](N)CNC1=O Amb27970053 [0,1,0,1,0,0|2,0,0]=4 11913 B9R1.69 C[C@@H]1CC(=O)[C@H](C)CN1 Amb27188273 [0,1,0,1,0,0|1,0,0]=3 11914 B9R1.69 C[C@@H]1CCC(=O)C(O)C1 Amb27838716 [0,1,0,1,0,0|1,0,0]=3 11915 B9R1.69 C[C@@H]1CCC(=O)[C@@H](Cl)C1 Amb28457297 [0,1,0,1,0,0|1,0,0]=3 11916 B9R1.69 C[C@@H]1CCC(=O)[C@H](O)C1 Amb27434293 [0,1,0,1,0,0|1,0,0]=3 11917 B9R1.69 C[C@@H]1CCC(O)C[C@H]1C Amb27445019 [0,1,0,1,0,0|1,0,1]=4 11918 B9R1.69 C[C@@H]1CC[C@@H](C)[C@@H](N)C1 Amb28055512 [0,1,0,1,0,0|1,0,1]=4 11919 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](C)C1 Amb28061313 [0,1,0,1,0,0|1,0,1]=4 11920 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27184906 [0,1,0,1,0,0|0,0,2]=4 11921 B9R1.69 C[C@@H]1CC[C@@H](N)CN1C Amb33716029 [0,1,0,1,0,0|2,0,0]=4 11922 B9R1.69 C[C@@H]1CC[C@@H](N)C[C@H]1N Amb27630676 [0,1,0,1,0,0|1,0,1]=4 11923 B9R1.69 C[C@@H]1CC[C@@H](O)CN1C Amb26591207 [0,1,0,1,0,0|2,0,0]=4 11924 B9R1.69 C[C@@H]1CC[C@@H](O)CN1N Amb30011334 [0,1,0,1,0,0|2,0,0]=4 11925 B9R1.69 C[C@@H]1CC[C@@H](O)C[C@H]1C Amb28053499 [0,1,0,1,0,0|1,0,1]=4 11926 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [0,1,0,1,0,0|1,0,0]=3 11927 B9R1.69 C[C@@H]1CC[C@H](N)CN1C Amb33716030 [0,1,0,1,0,0|2,0,0]=4 11928 B9R1.69 C[C@@H]1CC[C@H](N)C[C@H]1N Amb28133899 [0,1,0,1,0,0|1,0,1]=4 11929 B9R1.69 C[C@@H]1CC[C@H](N)[C@H](C)C1 Amb28055517 [0,1,0,1,0,0|1,0,1]=4 11930 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 Amb22225141 [0,1,0,1,0,0|2,0,0]=4 11931 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 Amb24184039 [0,1,0,1,0,0|2,0,0]=4 11932 B9R1.69 C[C@@H]1CNC(=O)[C@@H](C)N1 Amb28254593 [0,1,0,1,0,0|2,0,0]=4 11933 B9R1.69 C[C@@H]1CNC(=O)[C@@H](C)O1 Amb28287913 [0,1,0,1,0,0|2,0,0]=4 11934 B9R1.69 C[C@@H]1CN[C@H](C)C(=O)N1 Amb23385259 [0,1,0,1,0,0|2,0,0]=4 11935 B9R1.69 C[C@@H]1C[C@@H](N)CCN1C Amb30526923 [0,1,0,1,0,0|2,0,0]=4 11936 B9R1.69 C[C@@H]1C[C@H](N)CCN1C Amb30526912 [0,1,0,1,0,0|2,0,0]=4 11937 B9R1.69 C[C@@H]1C[C@H](N)CC[C@@H]1O Amb27968631 [0,1,0,1,0,0|0,0,2]=4 11938 B9R1.69 C[C@@H]1C[C@H](N)CC[C@H]1O Amb28346268 [0,1,0,1,0,0|0,0,2]=4 11939 B9R1.69 C[C@@H]1NC[C@@H](C)NC1=O Amb22587597 [0,1,0,1,0,0|2,0,0]=4 11940 B9R1.69 C[C@@H]1OC(O)CCC1=O Amb28351368 [0,1,0,1,0,0|1,0,0]=3 11941 B9R1.69 C[C@@H]1OC[C@@H](C)NC1=O Amb27216673 [0,1,0,1,0,0|2,0,0]=4 11942 B9R1.69 C[C@@H]1O[C@H](C)CNC1=O Amb24561641 [0,1,0,1,0,0|2,0,0]=4 11943 B9R1.69 C[C@H]1CCC(=O)[C@H](Cl)C1 Amb27778268 [0,1,0,1,0,0|1,0,0]=3 11944 B9R1.69 C[C@H]1CC[C@@H](C)C[C@@H]1O Amb27221189 [0,1,0,1,0,0|0,0,2]=4 11945 B9R1.69 C[C@H]1CC[C@@H](C)C[C@H]1O Amb27848128 [0,1,0,1,0,0|0,0,2]=4 11946 B9R1.69 C[C@H]1CC[C@@H](O)CC1=O Amb27427823 [0,1,0,1,0,0|0,0,0]=2 11947 B9R1.69 C[C@H]1CC[C@@H](O)C[C@@H]1C Amb27452456 [0,1,0,1,0,0|1,0,1]=4 11948 B9R1.69 C[C@H]1CC[C@@H](O)C[C@H]1C Amb28247082 [0,1,0,1,0,0|1,0,1]=4 11949 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [0,1,0,1,0,0|1,0,0]=3 11950 B9R1.69 C[C@H]1CC[C@H](C)[C@@H](O)C1 Amb27849642 [0,1,0,1,0,0|0,0,2]=4 11951 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [0,1,0,1,0,0|1,0,0]=3 11952 B9R1.69 C[C@H]1CC[C@H](O)CN1C Amb27214298 [0,1,0,1,0,0|2,0,0]=4 11953 B9R1.69 C[C@H]1CC[C@H](O)C[C@H]1C Amb28134680 [0,1,0,1,0,0|1,0,1]=4 11954 B9R1.69 C[C@H]1CN(C)C(=O)CN1 Amb20670247 [0,1,0,1,0,0|2,0,0]=4 11955 B9R1.69 C[C@H]1CN(C)C(=O)CN1 Amb22225454 [0,1,0,1,0,0|2,0,0]=4 11956 B9R1.69 C[C@H]1CN(C)CCC1=O Amb24472489 [0,1,0,1,0,0|1,0,0]=3 11957 B9R1.69 C[C@H]1CNC(=O)[C@H](C)N1 Amb24602366 [0,1,0,1,0,0|2,0,0]=4 11958 B9R1.69 C[C@H]1CNC(=O)[C@H](C)O1 Amb24629269 [0,1,0,1,0,0|2,0,0]=4 11959 B9R1.69 C[C@H]1CN[C@@H](C)C(=O)N1 Amb23385307 [0,1,0,1,0,0|2,0,0]=4 11960 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb22587547 [0,1,0,1,0,0|2,0,0]=4 11961 B9R1.69 C[C@H]1CN[C@H](C)C(=O)N1 Amb23385266 [0,1,0,1,0,0|2,0,0]=4 11962 B9R1.69 C[C@H]1CO[C@@H](C)C(=O)N1 Amb26975581 [0,1,0,1,0,0|2,0,0]=4 11963 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,1,0,1,0,0|1,0,0]=3 11964 B9R1.69 C[C@H]1C[C@@H](N)CCN1C Amb24579620 [0,1,0,1,0,0|2,0,0]=4 11965 B9R1.69 C[C@H]1C[C@@H](O)CCC1=O Amb28253634 [0,1,0,1,0,0|0,0,0]=2 11966 B9R1.69 C[C@H]1C[C@@H](O)CCS1=O Amb28321337 [0,1,0,1,0,0|1,0,0]=3 11967 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1C Amb27978914 [0,1,0,1,0,0|1,0,1]=4 11968 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1C Amb26026793 [0,1,0,1,0,0|1,0,1]=4 11969 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1N Amb28055532 [0,1,0,1,0,0|1,0,1]=4 11970 B9R1.69 C[C@H]1C[C@H](O)C=CC1=O Amb27434201 [0,1,0,1,0,0|0,0,2]=4 11971 B9R1.69 C[C@H]1C[C@H](O)CCN1C Amb27207792 [0,1,0,1,0,0|2,0,0]=4 11972 B9R1.69 NC1CC(O)CCC1=O Amb28430066 [0,1,0,1,0,0|1,0,0]=3 11973 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,1,0,1,0,0|2,0,0]=4 11974 B9R1.69 NC1CCC(=O)N(P)C1 Amb25303528 [0,1,0,1,0,0|2,0,0]=4 11975 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,1,0,1,0,0|2,0,0]=4 11976 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,1,0,1,0,0|2,0,0]=4 11977 B9R1.69 N[C@H]1CCC(O)NC1=O Amb26317903 [0,1,0,1,0,0|2,0,0]=4 11978 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,1,0,1,0,0|2,0,0]=4 11979 B9R1.69 O=C1CCC(=O)C(Br)C1 Amb25775016 [0,1,0,1,0,0|1,0,1]=4 11980 B9R1.69 O=C1CCC(=O)C(Cl)C1 Amb24452362 [0,1,0,1,0,0|1,0,1]=4 11981 B9R1.69 O=C1CCC(Cl)CC1Cl Amb27237551 [0,1,0,1,0,0|1,0,0]=3 11982 B9R1.69 O=C1CCC(O)C(=O)C1 Amb27409551 [0,1,0,1,0,0|1,0,1]=4 11983 B9R1.69 O=C1CCC(O)CC1O Amb27494789 [0,1,0,1,0,0|1,0,0]=3 11984 B9R1.69 O=C1CCS(=O)CC1O Amb29847922 [0,1,0,1,0,0|2,0,0]=4 11985 B9R1.69 O=C1CC[C@H](Br)C[C@H]1Cl Amb27622141 [0,1,0,1,0,0|1,0,0]=3 11986 B9R1.69 O=C1CC[C@H](Cl)C[C@@H]1Cl Amb27799562 [0,1,0,1,0,0|1,0,0]=3 11987 B9R1.69 O=C1CC[C@H](Cl)C[C@H]1Br Amb27229463 [0,1,0,1,0,0|1,0,0]=3 11988 B9R1.69 O=C1CC[C@H](Cl)C[C@H]1Cl Amb27789880 [0,1,0,1,0,0|1,0,0]=3 11989 B9R1.69 O=C1NCC(O)CC1O Amb28247470 [0,1,0,1,0,0|2,0,0]=4 11990 B9R1.69 O=C1NC[C@H](O)C[C@H]1O Amb27460866 [0,1,0,1,0,0|2,0,0]=4 11991 B9R1.69 O=S1CC[C@@H](O)C[C@@H]1Cl Amb28128771 [0,1,0,1,0,0|2,0,0]=4 11992 B9R1.69 O=S1CC[C@H](Cl)C[C@@H]1Cl Amb27968183 [0,1,0,1,0,0|2,0,0]=4 11993 B9R1.73 BrCCC(Br)C1CCC1 Amb23455638 [0,1,0,1,0,0|1,0,1]=4 11994 B9R1.73 C=CCC(N)C1CSC1 Amb35697084 [0,1,0,1,0,0|2,0,0]=4 11995 B9R1.73 C=CCC(O)C1CNC1 Amb35583110 [0,1,0,1,0,0|2,0,0]=4 11996 B9R1.73 C=CCC(O)C1CSC1 Amb29864663 [0,1,0,1,0,0|2,0,0]=4 11997 B9R1.73 C=CC[C@H](N)C1CCC1 Amb28120078 [0,1,0,1,0,0|1,0,0]=3 11998 B9R1.73 CC(CC=O)C1CCC1 Amb27960519 [0,1,0,1,0,0|0,0,0]=2 11999 B9R1.73 CC(CCCl)C1CCC1 Amb28345996 [0,1,0,1,0,0|1,0,1]=4 12000 B9R1.73 CC(CCN)C1CCC1 Amb26018136 [0,1,0,1,0,0|1,0,1]=4 12001 B9R1.73 CC(CON)C1CCC1 Amb27437715 [0,1,0,1,0,0|2,0,0]=4 12002 B9R1.73 CC(N=C=O)C1CCC1 Amb26072179 [0,1,0,1,0,0|1,0,1]=4 12003 B9R1.73 CCCC(Br)C1CCC1 Amb27669631 [0,1,0,1,0,0|1,0,1]=4 12004 B9R1.73 CCCC(Br)C1COC1 Amb30033305 [0,1,0,1,0,0|2,0,0]=4 12005 B9R1.73 CCCC(C)C1CCN1 Amb27883257 [0,1,0,1,0,0|1,0,1]=4 12006 B9R1.73 CCCC(C)C1CNC1 Amb26412200 [0,1,0,1,0,0|2,0,0]=4 12007 B9R1.73 CCCC(Cl)C1COC1 Amb30033716 [0,1,0,1,0,0|2,0,0]=4 12008 B9R1.73 CCCC(N)C1CCC1 Amb25374014 [0,1,0,1,0,0|1,0,1]=4 12009 B9R1.73 CCCC(N)C1COC1 Amb35737160 [0,1,0,1,0,0|2,0,0]=4 12010 B9R1.73 CCCC(N)C1CSC1 Amb35697085 [0,1,0,1,0,0|2,0,0]=4 12011 B9R1.73 CCCC(O)C1CCC1 Amb27202614 [0,1,0,1,0,0|1,0,1]=4 12012 B9R1.73 CCCC(O)C1COC1 Amb35604437 [0,1,0,1,0,0|2,0,0]=4 12013 B9R1.73 CCCC(O)C1CSC1 Amb29864919 [0,1,0,1,0,0|2,0,0]=4 12014 B9R1.73 CCCC(S)C1CCC1 Amb27954339 [0,1,0,1,0,0|1,0,1]=4 12015 B9R1.73 CCC[C@@H](N)C1CSC1 Amb35717412 [0,1,0,1,0,0|2,0,0]=4 12016 B9R1.73 CCC[C@H](N)C1CSC1 Amb35717411 [0,1,0,1,0,0|2,0,0]=4 12017 B9R1.73 CNCC(C)C1CCC1 Amb27808990 [0,1,0,1,0,0|2,0,0]=4 12018 B9R1.73 CNCC(Cl)C1CCC1 Amb28326047 [0,1,0,1,0,0|2,0,0]=4 12019 B9R1.73 CNCC(O)C1CCC1 Amb24599968 [0,1,0,1,0,0|2,0,0]=4 12020 B9R1.73 COCC(N)C1CCC1 Amb27780934 [0,1,0,1,0,0|2,0,0]=4 12021 B9R1.73 CSCC(O)C1CCC1 Amb27436903 [0,1,0,1,0,0|2,0,0]=4 12022 B9R1.73 N#CCC(N)C1CCC1 Amb27249569 [0,1,0,1,0,0|1,0,1]=4 12023 B9R1.73 N#CC[C@@H](N)C1CCC1 Amb28137211 [0,1,0,1,0,0|1,0,1]=4 12024 B9R1.73 NC(CCO)C1CCC1 Amb27974903 [0,1,0,1,0,0|0,0,2]=4 12025 B9R1.73 NC(CCO)C1CCC1 Amb33482936 [0,1,0,1,0,0|0,0,2]=4 12026 B9R1.73 NCCC(F)C1CCC1 Amb25300576 [0,1,0,1,0,0|1,0,1]=4 12027 B9R1.73 NCCC(O)C1CCC1 Amb22642025 [0,1,0,1,0,0|1,0,1]=4 12028 B9R1.73 NCC[C@@H](O)C1CCC1 Amb33314119 [0,1,0,1,0,0|1,0,1]=4 12029 B9R1.73 NCC[C@H](O)C1CCC1 Amb33195479 [0,1,0,1,0,0|1,0,1]=4 12030 B9R1.73 N[C@@H](CCO)C1CCC1 Amb28072891 [0,1,0,1,0,0|0,0,2]=4 12031 B9R1.73 O=CCC(=O)C1CCC1 Amb26344601 [0,1,0,1,0,0|0,0,1]=3 12032 B9R1.73 OCCC(O)C1CCC1 Amb23512730 [0,1,0,1,0,0|0,0,2]=4 12033 B9R1.75 C#CCC(N)CC1CC1 Amb28314411 [0,1,0,1,0,0|1,0,1]=4 12034 B9R1.75 C=CC[C@@H](O)C[C@H]1CO1 Amb27853196 [0,1,0,1,0,0|2,0,0]=4 12035 B9R1.75 CC(CC1CC1)N=C=O Amb25330330 [0,1,0,1,0,0|1,0,1]=4 12036 B9R1.75 CC(CC1CC1)NC=O Amb27860131 [0,1,0,1,0,0|1,0,0]=3 12037 B9R1.75 CC(CCN)CC1CC1 Amb25188986 [0,1,0,1,0,0|1,0,1]=4 12038 B9R1.75 CC(CON)CC1CC1 Amb33361226 [0,1,0,1,0,0|2,0,0]=4 12039 B9R1.75 CCCC(C)CC1CO1 Amb25769573 [0,1,0,1,0,0|0,0,2]=4 12040 B9R1.75 CCC[C@@H](N)CC1CC1 Amb27657336 [0,1,0,1,0,0|1,0,1]=4 12041 B9R1.75 CN(CC=O)CC1CC1 Amb27837428 [0,1,0,1,0,0|1,0,0]=3 12042 B9R1.75 CNCC(C)CC1CC1 Amb28285264 [0,1,0,1,0,0|2,0,0]=4 12043 B9R1.75 CNCC(N)CC1CC1 Amb27956493 [0,1,0,1,0,0|2,0,0]=4 12044 B9R1.75 CNCC(O)CC1CC1 Amb33362401 [0,1,0,1,0,0|2,0,0]=4 12045 B9R1.75 CNC[C@@H](N)CC1CC1 Amb27835245 [0,1,0,1,0,0|2,0,0]=4 12046 B9R1.75 N#CCC(O)CC1CC1 Amb33361891 [0,1,0,1,0,0|1,0,1]=4 12047 B9R1.75 NC(CCO)CC1CC1 Amb24358108 [0,1,0,1,0,0|0,0,2]=4 12048 B9R1.75 NCCC(F)CC1CC1 Amb33361463 [0,1,0,1,0,0|1,0,1]=4 12049 B9R1.75 NCC[C@@H](O)CC1CC1 Amb33361465 [0,1,0,1,0,0|1,0,1]=4 12050 B9R1.75 NCC[C@H](O)CC1CC1 Amb33361464 [0,1,0,1,0,0|1,0,1]=4 12051 B9R1.75 OCCC(O)CC1CC1 Amb27664147 [0,1,0,1,0,0|0,0,2]=4 12052 B9R1.100 C#CCCC(C)C1CC1 Amb32728598 [0,1,0,1,0,0|1,0,1]=4 12053 B9R1.100 C=C(CCC=O)C1CC1 Amb28241372 [0,1,0,1,0,0|0,0,1]=3 12054 B9R1.100 C=CCCC(=O)C1CC1 Amb22059249 [0,1,0,1,0,0|1,0,1]=4 12055 B9R1.100 C=CCCC(O)C1CC1 Amb22059250 [0,1,0,1,0,0|1,0,0]=3 12056 B9R1.100 C=CCC[C@H](O)[C@H]1CO1 Amb28249104 [0,1,0,1,0,0|2,0,0]=4 12057 B9R1.100 C=CCNC(C)C1CC1 Amb6683867 [0,1,0,1,0,0|2,0,0]=4 12058 B9R1.100 CC(CCC#N)C1CC1 Amb26896229 [0,1,0,1,0,0|1,0,1]=4 12059 B9R1.100 CC(CCC=O)C1CC1 Amb27623422 [0,1,0,1,0,0|0,0,0]=2 12060 B9R1.100 CC(CCCBr)C1CC1 Amb33009154 [0,1,0,1,0,0|1,0,1]=4 12061 B9R1.100 CC(CCCN)C1CC1 Amb26594384 [0,1,0,1,0,0|1,0,1]=4 12062 B9R1.100 CC(CCCO)C1CC1 Amb26614838 [0,1,0,1,0,0|0,0,2]=4 12063 B9R1.100 CC(CCCS)C1CC1 Amb32735003 [0,1,0,1,0,0|0,1,1]=4 12064 B9R1.100 CC(CCNN)C1CC1 Amb32728590 [0,1,0,1,0,0|2,0,0]=4 12065 B9R1.100 CC(CCNO)C1CC1 Amb32728853 [0,1,0,1,0,0|1,0,1]=4 12066 B9R1.100 CC(CCON)C1CC1 Amb32728625 [0,1,0,1,0,0|2,0,0]=4 12067 B9R1.100 CC(CN=C=O)C1CC1 Amb25701266 [0,1,0,1,0,0|1,0,1]=4 12068 B9R1.100 CCCCC(Br)C1CC1 Amb27826788 [0,1,0,1,0,0|1,0,1]=4 12069 B9R1.100 CCCCC(C)C1CC1 Amb25286937 [0,1,0,1,0,0|1,0,1]=4 12070 B9R1.100 CCCCC(Cl)C1CC1 Amb27837489 [0,1,0,1,0,0|1,0,1]=4 12071 B9R1.100 CCCCC(N)C1CC1 Amb3788101 [0,1,0,1,0,0|1,0,1]=4 12072 B9R1.100 CCCCC(O)C1CC1 Amb27837486 [0,1,0,1,0,0|1,0,1]=4 12073 B9R1.100 CCCCC(O)C1CO1 Amb28048180 [0,1,0,1,0,0|0,0,2]=4 12074 B9R1.100 CCCC[C@@H](O)[C@@H]1CO1 Amb27186933 [0,1,0,1,0,0|0,0,2]=4 12075 B9R1.100 CCCC[C@@H](O)[C@H]1CO1 Amb27219813 [0,1,0,1,0,0|0,0,2]=4 12076 B9R1.100 CCCC[C@H](N)C1CC1 Amb28388893 [0,1,0,1,0,0|1,0,1]=4 12077 B9R1.100 CCCC[C@H](O)[C@H]1CO1 Amb27197461 [0,1,0,1,0,0|0,0,2]=4 12078 B9R1.100 CN(CCC=O)C1CC1 Amb27837418 [0,1,0,1,0,0|1,0,0]=3 12079 B9R1.100 CNCCC(C)C1CC1 Amb26067890 [0,1,0,1,0,0|2,0,0]=4 12080 B9R1.100 COCCC(O)C1CC1 Amb28435910 [0,1,0,1,0,0|2,0,0]=4 12081 B9R1.100 C\C=C\CC(O)C1CC1 Amb28315554 [0,1,0,1,0,0|1,0,1]=4 12082 B9R1.100 NCCCC(O)C1CC1 Amb18203226 [0,1,0,1,0,0|1,0,1]=4 12083 B9R1.100 O=C=NCC(F)C1CC1 Amb27635504 [0,1,0,1,0,0|1,0,1]=4 12084 B9R1.100 O=CCCC(=O)N1CC1 Amb27837638 [0,1,0,1,0,0|1,0,1]=4 12085 B9R1.100 O=CCNC(=O)C1CC1 Amb17102057 [0,1,0,1,0,0|1,0,1]=4 12086 B9R1.100 OC(CCCCl)C1CC1 Amb27481224 [0,1,0,1,0,0|1,0,1]=4 12087 B9R1.100 [C-]#[N+]CCC(C)C1CC1 Amb32728727 [0,1,0,1,0,0|2,0,0]=4 12088 B9R1.117 C#CCCC1(N)CCC1 Amb35642713 [0,1,0,1,0,0|1,0,1]=4 12089 B9R1.117 C=CCCC1(N)CCC1 Amb35649460 [0,1,0,1,0,0|1,0,0]=3 12090 B9R1.117 C=CCCC1(O)COC1 Amb35659187 [0,1,0,1,0,0|2,0,0]=4 12091 B9R1.117 C=CCCC1(O)CSC1 Amb27462961 [0,1,0,1,0,0|2,0,0]=4 12092 B9R1.117 CC1(CCC=O)COC1 Amb26583791 [0,1,0,1,0,0|1,0,0]=3 12093 B9R1.117 CC1(CN=C=O)CCC1 Amb27412141 [0,1,0,1,0,0|1,0,1]=4 12094 B9R1.117 CCCCC1(C)CCN1 Amb27472398 [0,1,0,1,0,0|1,0,1]=4 12095 B9R1.117 CCCCC1(N)CCC1 Amb24420313 [0,1,0,1,0,0|1,0,1]=4 12096 B9R1.117 CCCCC1(O)CCC1 Amb28400142 [0,1,0,1,0,0|1,0,1]=4 12097 B9R1.117 CCCCC1(O)CNC1 Amb26619325 [0,1,0,1,0,0|2,0,0]=4 12098 B9R1.117 CCCCC1(O)COC1 Amb35659044 [0,1,0,1,0,0|2,0,0]=4 12099 B9R1.117 CNCCC1(N)CCC1 Amb27493621 [0,1,0,1,0,0|2,0,0]=4 12100 B9R1.117 COCCC1(N)CCC1 Amb25759806 [0,1,0,1,0,0|2,0,0]=4 12101 B9R1.117 COCCC1(N)CCC1 Amb28555347 [0,1,0,1,0,0|2,0,0]=4 12102 B9R1.117 COCCC1(O)CCC1 Amb34156023 [0,1,0,1,0,0|2,0,0]=4 12103 B9R1.117 CSCCC1(N)CCC1 Amb24518039 [0,1,0,1,0,0|2,0,0]=4 12104 B9R1.117 C\C=C\CC1(N)CCC1 Amb35653979 [0,1,0,1,0,0|1,0,1]=4 12105 B9R1.117 N#CCCC1(O)CCC1 Amb27165192 [0,1,0,1,0,0|1,0,1]=4 12106 B9R1.117 NC1(CCC=O)COC1 Amb33036296 [0,1,0,1,0,0|1,0,0]=3 12107 B9R1.117 NC1(CCC=O)CSC1 Amb33036329 [0,1,0,1,0,0|1,0,0]=3 12108 B9R1.117 NC1(CCCO)CCC1 Amb30030884 [0,1,0,1,0,0|0,0,2]=4 12109 B9R1.117 NC1(C\C=C\Cl)CCC1 Amb35657863 [0,1,0,1,0,0|1,0,1]=4 12110 B9R1.117 NCCCC1(O)CCC1 Amb25199996 [0,1,0,1,0,0|1,0,1]=4 12111 B9R1.117 O=CCCC1(O)COC1 Amb30024225 [0,1,0,1,0,0|1,0,0]=3 12112 B9R1.117 O=CNCC1(O)CCC1 Amb27812866 [0,1,0,1,0,0|1,0,0]=3 12113 B9R1.117 OCCCC1(F)CCC1 Amb25285193 [0,1,0,1,0,0|0,0,2]=4 12114 B9R1.117 OCCCC1(O)CCC1 Amb25032198 [0,1,0,1,0,0|0,0,2]=4 12115 B9R1.134 C#CCC1(N)CCCC1 Amb35678343 [0,1,0,1,0,0|1,0,1]=4 12116 B9R1.134 C#CCC1(O)CCCC1 Amb836169 [0,1,0,1,0,0|1,0,1]=4 12117 B9R1.134 C=CCC1(C)CCCO1 Amb28041994 [0,1,0,1,0,0|2,0,0]=4 12118 B9R1.134 C=CCC1(F)CCNC1 Amb27768808 [0,1,0,1,0,0|2,0,0]=4 12119 B9R1.134 C=CCC1(N)CCCC1 Amb27985996 [0,1,0,1,0,0|1,0,0]=3 12120 B9R1.134 C=CCC1(O)CCCC1 Amb26477813 [0,1,0,1,0,0|1,0,0]=3 12121 B9R1.134 C=CCC1(O)CCOC1 Amb25684329 [0,1,0,1,0,0|2,0,0]=4 12122 B9R1.134 C=CC[C@]1(C)CCCN1 Amb28398079 [0,1,0,1,0,0|2,0,0]=4 12123 B9R1.134 CC1(CC#N)CCCC1 Amb26923372 [0,1,0,1,0,0|1,0,1]=4 12124 B9R1.134 CC1(CC=O)C=CCC1 Amb28434598 [0,1,0,1,0,0|0,0,2]=4 12125 B9R1.134 CC1(CC=O)CC=CC1 Amb27607885 [0,1,0,1,0,0|0,0,2]=4 12126 B9R1.134 CC1(CC=O)OCCO1 Amb18203200 [0,1,0,1,0,0|2,0,0]=4 12127 B9R1.134 CC1(CCN)CCCC1 Amb18251115 [0,1,0,1,0,0|1,0,1]=4 12128 B9R1.134 CC1(CCO)C=CCC1 Amb27978216 [0,1,0,1,0,0|2,0,0]=4 12129 B9R1.134 CC1(CCO)CCCC1 Amb27472477 [0,1,0,1,0,0|0,0,2]=4 12130 B9R1.134 CC1(CNN)CCCC1 Amb25888900 [0,1,0,1,0,0|2,0,0]=4 12131 B9R1.134 CC1(CNN)CCCC1 Amb32660938 [0,1,0,1,0,0|2,0,0]=4 12132 B9R1.134 CC1(N=C=O)CCCC1 Amb27237308 [0,1,0,1,0,0|1,0,1]=4 12133 B9R1.134 CC1(NC=O)CCOC1 Amb27768625 [0,1,0,1,0,0|2,0,0]=4 12134 B9R1.134 CCCC1(C)CCCN1 Amb27950524 [0,1,0,1,0,0|1,0,1]=4 12135 B9R1.134 CCCC1(C)CCNC1 Amb18961120 [0,1,0,1,0,0|2,0,0]=4 12136 B9R1.134 CCCC1(N)CC=CC1 Amb35684052 [0,1,0,1,0,0|1,0,1]=4 12137 B9R1.134 CCCC1(N)CCOC1 Amb25147047 [0,1,0,1,0,0|2,0,0]=4 12138 B9R1.134 CCCC1(O)CCCC1 Amb4017707 [0,1,0,1,0,0|1,0,1]=4 12139 B9R1.134 CCCC1(O)CCOC1 Amb27947398 [0,1,0,1,0,0|2,0,0]=4 12140 B9R1.134 CCC[C@]1(C)CCNC1 Amb27170716 [0,1,0,1,0,0|2,0,0]=4 12141 B9R1.134 CNCC1(O)CCCC1 Amb17077484 [0,1,0,1,0,0|2,0,0]=4 12142 B9R1.134 COCC1(N)CCCC1 Amb21955856 [0,1,0,1,0,0|2,0,0]=4 12143 B9R1.134 COCC1(N)CCCC1 Amb9902153 [0,1,0,1,0,0|2,0,0]=4 12144 B9R1.134 CSCC1(N)CCCC1 Amb26509649 [0,1,0,1,0,0|2,0,0]=4 12145 B9R1.134 FC1(CCI)CCCC1 Amb27631766 [0,1,0,1,0,0|1,0,1]=4 12146 B9R1.134 N#CCC1(N)CCCC1 Amb24393293 [0,1,0,1,0,0|1,0,1]=4 12147 B9R1.134 N#CCC1(N)CCCC1 Amb30874107 [0,1,0,1,0,0|1,0,1]=4 12148 B9R1.134 N#CCC1(O)CCCC1 Amb27179949 [0,1,0,1,0,0|1,0,1]=4 12149 B9R1.134 NC1(CCF)CCCC1 Amb27266099 [0,1,0,1,0,0|1,0,1]=4 12150 B9R1.134 NC1(CCO)CCCC1 Amb27865768 [0,1,0,1,0,0|0,0,2]=4 12151 B9R1.134 NCCC1(N)CCCC1 Amb27949695 [0,1,0,1,0,0|1,0,1]=4 12152 B9R1.134 NCCC1(O)CCCC1 Amb32882428 [0,1,0,1,0,0|1,0,1]=4 12153 B9R1.134 NCCC1(O)CCCC1 Amb7088884 [0,1,0,1,0,0|1,0,1]=4 12154 B9R1.134 OC1(CCBr)CCCC1 Amb33097438 [0,1,0,1,0,0|1,0,1]=4 12155 B9R1.134 OC1(CCCl)CCCC1 Amb24385368 [0,1,0,1,0,0|1,0,1]=4 12156 B9R1.134 OCCC1(O)CCCC1 Amb21961004 [0,1,0,1,0,0|0,0,2]=4 12157 B9R1.154 C=CCC1C(N)CC1O Amb35752120 [0,1,0,1,0,0|2,0,0]=4 12158 B9R1.154 CCCC1C(=O)CC1C Amb27838721 [0,1,0,1,0,0|0,0,0]=2 12159 B9R1.154 CCC[C@@H]1C(=O)C[C@H]1C Amb27261959 [0,1,0,1,0,0|0,0,0]=2 12160 B9R1.154 CCOC1C(=O)CC1C Amb27838667 [0,1,0,1,0,0|1,0,0]=3 12161 B9R1.173 C#CCC1(O)CCC1C Amb27768815 [0,1,0,1,0,0|1,0,1]=4 12162 B9R1.173 C=CCC1(O)CCC1C Amb28251516 [0,1,0,1,0,0|1,0,0]=3 12163 B9R1.173 CC1(CCO)CCC1=O Amb27802777 [0,1,0,1,0,0|1,0,0]=3 12164 B9R1.173 CC1CCC1(O)CCN Amb25728613 [0,1,0,1,0,0|1,0,1]=4 12165 B9R1.173 COCC1(O)CCC1C Amb27813820 [0,1,0,1,0,0|2,0,0]=4 12166 B9R1.173 C\C=C\C1(C)CCC1=O Amb26002907 [0,1,0,1,0,0|0,0,2]=4 12167 B9R1.178 CCCC1(O)CC1CC Amb27664514 [0,1,0,1,0,0|1,0,1]=4 12168 B9R1.178 C\C=C\C1(N)CC1CC Amb27482167 [0,1,0,1,0,0|1,0,1]=4 12169 B9R1.183 C=C1C[C@H]1[C@H](O)CCC Amb27213137 [0,1,0,1,0,0|1,0,0]=3 12170 B9R1.183 C=CCC(=O)C1CC1C Amb27246039 [0,1,0,1,0,0|1,0,1]=4 12171 B9R1.183 C=CCC(O)C1OC1C Amb28049162 [0,1,0,1,0,0|2,0,0]=4 12172 B9R1.183 C=CC[C@@H](O)[C@H]1O[C@@H]1C Amb27881519 [0,1,0,1,0,0|2,0,0]=4 12173 B9R1.183 CC(CCN)C1CC1C Amb26949800 [0,1,0,1,0,0|1,0,1]=4 12174 B9R1.183 CC(CON)C1CC1C Amb33142801 [0,1,0,1,0,0|2,0,0]=4 12175 B9R1.183 CC1CC1C(=O)CC=O Amb25762285 [0,1,0,1,0,0|0,0,1]=3 12176 B9R1.183 CC1CC1C(C)N=C=O Amb33227122 [0,1,0,1,0,0|1,0,1]=4 12177 B9R1.183 CC1CC1C(F)CCN Amb33144901 [0,1,0,1,0,0|1,0,1]=4 12178 B9R1.183 CC1CC1C(N)CCO Amb27862891 [0,1,0,1,0,0|0,0,2]=4 12179 B9R1.183 CC1CC1C(O)CC#N Amb33227130 [0,1,0,1,0,0|1,0,1]=4 12180 B9R1.183 CC1CC1C(O)CCN Amb25147103 [0,1,0,1,0,0|1,0,1]=4 12181 B9R1.183 CC1CC1[C@@H](O)CCN Amb33144255 [0,1,0,1,0,0|1,0,1]=4 12182 B9R1.183 CC1CC1[C@H](O)CCN Amb33144256 [0,1,0,1,0,0|1,0,1]=4 12183 B9R1.183 CCCC(C)C1CC1N Amb25983395 [0,1,0,1,0,0|1,0,1]=4 12184 B9R1.183 CCCC(C)[C@@H]1C[C@H]1N Amb33322342 [0,1,0,1,0,0|1,0,1]=4 12185 B9R1.183 CCCC(O)C1CC1C Amb27494272 [0,1,0,1,0,0|1,0,1]=4 12186 B9R1.183 CCCC(O)[C@@H]1C[C@H]1C Amb27423183 [0,1,0,1,0,0|1,0,1]=4 12187 B9R1.183 CCC[C@@H](O)C1CC1C Amb27658419 [0,1,0,1,0,0|1,0,1]=4 12188 B9R1.183 CNCC(O)C1CC1C Amb33449538 [0,1,0,1,0,0|2,0,0]=4 12189 B9R1.191 C=C1CC1(C)CCC=O Amb27802487 [0,1,0,1,0,0|0,0,2]=4 12190 B9R1.191 CC1CC1(N)CCCS Amb27638527 [0,1,0,1,0,0|0,1,1]=4 12191 B9R1.191 COCCC1(N)CC1C Amb28124470 [0,1,0,1,0,0|2,0,0]=4 12192 B9R1.4 C=CCC1CCC1CN Amb27252658 [0,1,0,1,0,0|1,0,0]=3 12193 B9R1.4 C=CCC1CNC1CO Amb27212386 [0,1,0,1,0,0|2,0,0]=4 12194 B9R1.4 C=CCN1CCC1CC Amb27837684 [0,1,0,1,0,0|1,0,0]=3 12195 B9R1.4 C=CCN1CCC1CN Amb33251936 [0,1,0,1,0,0|2,0,0]=4 12196 B9R1.4 CCC1CCN1CCO Amb27973516 [0,1,0,1,0,0|0,0,2]=4 12197 B9R1.4 CCCC1CCC1CBr Amb33512086 [0,1,0,1,0,0|1,0,1]=4 12198 B9R1.4 CCCC1CCC1CN Amb27252657 [0,1,0,1,0,0|1,0,1]=4 12199 B9R1.4 CCCN1CCC1CN Amb33251947 [0,1,0,1,0,0|1,0,1]=4 12200 B9R1.4 CCC[C@H]1CN[C@@H]1CO Amb27194660 [0,1,0,1,0,0|0,0,2]=4 12201 B9R1.4 CCN1CCC1CNC Amb35629859 [0,1,0,1,0,0|2,0,0]=4 12202 B9R1.4 CCOC1CCC1CO Amb27456621 [0,1,0,1,0,0|0,0,2]=4 12203 B9R1.4 CC[C@@H]1CC[C@H]1CCO Amb27981762 [0,1,0,1,0,0|0,0,2]=4 12204 B9R1.4 CC[C@H]1CC[C@H]1CCO Amb27632068 [0,1,0,1,0,0|0,0,2]=4 12205 B9R1.4 COCC1CCC1CN Amb27424736 [0,1,0,1,0,0|1,0,1]=4 12206 B9R1.5 BrC1CCCCCC1Br Amb17669998 [0,1,0,1,0,0|1,0,1]=4 12207 B9R1.5 Br[C@@H]1CCCCC[C@H]1Br Amb25952818 [0,1,0,1,0,0|1,0,1]=4 12208 B9R1.5 Br[C@H]1CCCCC[C@H]1Br Amb24425642 [0,1,0,1,0,0|1,0,1]=4 12209 B9R1.5 C=C1CCCCCC1C Amb35681188 [0,1,0,1,0,0|1,0,0]=3 12210 B9R1.5 C=C1CCCCC[C@@H]1O Amb27456695 [0,1,0,1,0,0|1,0,0]=3 12211 B9R1.5 CC1=CCCCCC1O Amb27184844 [0,1,0,1,0,0|1,0,1]=4 12212 B9R1.5 CC1C=CCCCC1=O Amb27600759 [0,1,0,1,0,0|0,0,1]=3 12213 B9R1.5 CC1CCCC=CC1=O Amb27838624 [0,1,0,1,0,0|0,0,1]=3 12214 B9R1.5 CC1CCCCCC1=O Amb26348270 [0,1,0,1,0,0|0,0,0]=2 12215 B9R1.5 CC1CCCCCC1Br Amb18329569 [0,1,0,1,0,0|1,0,1]=4 12216 B9R1.5 CC1CCCCCC1Cl Amb27164800 [0,1,0,1,0,0|1,0,1]=4 12217 B9R1.5 CC1CCCCCC1N Amb33539533 [0,1,0,1,0,0|1,0,1]=4 12218 B9R1.5 CC1CCCCCC1O Amb27243169 [0,1,0,1,0,0|0,0,2]=4 12219 B9R1.5 CC1CCCCCC1S Amb32788094 [0,1,0,1,0,0|0,1,1]=4 12220 B9R1.5 CC1CCCNCC1C Amb22886370 [0,1,0,1,0,0|1,0,1]=4 12221 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,1,0,1,0,0|0,0,0]=2 12222 B9R1.5 CC1CCNCCC1O Amb22886251 [0,1,0,1,0,0|0,0,2]=4 12223 B9R1.5 CC1CCNCCC1O Amb27430480 [0,1,0,1,0,0|0,0,2]=4 12224 B9R1.5 CC1CCNCCN1C Amb17578107 [0,1,0,1,0,0|2,0,0]=4 12225 B9R1.5 CC1CCNCCS1=O Amb25948110 [0,1,0,1,0,0|1,0,0]=3 12226 B9R1.5 CC1CCNCCS1=O Amb28555359 [0,1,0,1,0,0|1,0,0]=3 12227 B9R1.5 CC1CNCCCC1O Amb22886276 [0,1,0,1,0,0|0,0,2]=4 12228 B9R1.5 CC1CNCCCC1O Amb25959907 [0,1,0,1,0,0|0,0,2]=4 12229 B9R1.5 CC1CNCCCN1C Amb17578105 [0,1,0,1,0,0|2,0,0]=4 12230 B9R1.5 CC1CNCCNC1=O Amb27228560 [0,1,0,1,0,0|1,0,0]=3 12231 B9R1.5 CC1CSCCNC1=N Amb27595632 [0,1,0,1,0,0|2,0,0]=4 12232 B9R1.5 CC1NCCCNC1=O Amb33545017 [0,1,0,1,0,0|1,0,0]=3 12233 B9R1.5 CC1SCCCCC1=O Amb28048147 [0,1,0,1,0,0|0,0,0]=2 12234 B9R1.5 CN1CCCCCC1=O Amb2779825 [0,1,0,1,0,0|0,0,0]=2 12235 B9R1.5 CN1CCCCNC1=S Amb28346274 [0,1,0,1,0,0|1,1,0]=4 12236 B9R1.5 CN1CCCNCC1=O Amb15690772 [0,1,0,1,0,0|1,0,0]=3 12237 B9R1.5 CN1CCCNCC1=O Amb21960817 [0,1,0,1,0,0|1,0,0]=3 12238 B9R1.5 CN1CCNCCC1=O Amb16231373 [0,1,0,1,0,0|1,0,0]=3 12239 B9R1.5 CN1CCNCCC1=O Amb21959037 [0,1,0,1,0,0|1,0,0]=3 12240 B9R1.5 CN1CCNCCC1=O Amb28934999 [0,1,0,1,0,0|1,0,0]=3 12241 B9R1.5 C[C@@H]1CCCCC[C@@H]1N Amb28346949 [0,1,0,1,0,0|1,0,1]=4 12242 B9R1.5 C[C@@H]1CCCCC[C@H]1O Amb28248774 [0,1,0,1,0,0|0,0,2]=4 12243 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [0,1,0,1,0,0|0,0,0]=2 12244 B9R1.5 C[C@@H]1CNCCCN1C Amb27231500 [0,1,0,1,0,0|2,0,0]=4 12245 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,1,0,1,0,0|1,0,0]=3 12246 B9R1.5 C[C@H]1C=CCCC[C@@H]1O Amb27852529 [0,1,0,1,0,0|1,0,0]=3 12247 B9R1.5 C[C@H]1CCCCC[C@@H]1O Amb27844354 [0,1,0,1,0,0|0,0,2]=4 12248 B9R1.5 C[C@H]1CCCCC[C@H]1Br Amb28428934 [0,1,0,1,0,0|1,0,1]=4 12249 B9R1.5 C[C@H]1CCCCC[C@H]1N Amb28388330 [0,1,0,1,0,0|1,0,1]=4 12250 B9R1.5 C[C@H]1CCCCC[C@H]1O Amb28139666 [0,1,0,1,0,0|0,0,2]=4 12251 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,1,0,1,0,0|1,0,0]=3 12252 B9R1.5 ClC1CCCCCC1Cl Amb17669999 [0,1,0,1,0,0|1,0,1]=4 12253 B9R1.5 Cl[C@@H]1CCCCC[C@H]1Br Amb28287349 [0,1,0,1,0,0|1,0,1]=4 12254 B9R1.5 NC1CCCC=CC1O Amb27209173 [0,1,0,1,0,0|2,0,0]=4 12255 B9R1.5 NC1CCCCC=C1Br Amb27747172 [0,1,0,1,0,0|1,0,1]=4 12256 B9R1.5 NC1CCCCCC1=O Amb18276126 [0,1,0,1,0,0|0,0,0]=2 12257 B9R1.5 NC1CCCCCC1=O Amb28934932 [0,1,0,1,0,0|0,0,0]=2 12258 B9R1.5 NC1CCCCCC1Cl Amb27447248 [0,1,0,1,0,0|1,0,1]=4 12259 B9R1.5 NC1CCCCCC1F Amb27838500 [0,1,0,1,0,0|1,0,1]=4 12260 B9R1.5 NC1CCCCCC1F Amb35788792 [0,1,0,1,0,0|1,0,1]=4 12261 B9R1.5 NC1CCCCCC1N Amb18832604 [0,1,0,1,0,0|1,0,1]=4 12262 B9R1.5 NC1CCCCCC1N Amb32666380 [0,1,0,1,0,0|1,0,1]=4 12263 B9R1.5 NC1CCCCCC1O Amb8855257 [0,1,0,1,0,0|0,0,2]=4 12264 B9R1.5 NC1CCCCNC1=O Amb19958477 [0,1,0,1,0,0|1,0,0]=3 12265 B9R1.5 NC1CCCCNC1=O Amb9721937 [0,1,0,1,0,0|1,0,0]=3 12266 B9R1.5 NC1CSCCNC1=O Amb25336468 [0,1,0,1,0,0|2,0,0]=4 12267 B9R1.5 NC1CSCCNC1=O Amb32412582 [0,1,0,1,0,0|2,0,0]=4 12268 B9R1.5 NN1CCCCCC1=O Amb22495331 [0,1,0,1,0,0|1,0,0]=3 12269 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,1,0,1,0,0|0,0,2]=4 12270 B9R1.5 N[C@@H]1CCCCC[C@H]1Br Amb28057796 [0,1,0,1,0,0|1,0,1]=4 12271 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb24546493 [0,1,0,1,0,0|1,0,1]=4 12272 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb32656071 [0,1,0,1,0,0|1,0,1]=4 12273 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,1,0,1,0,0|0,0,2]=4 12274 B9R1.5 N[C@@H]1CCCCC[C@H]1S Amb27246750 [0,1,0,1,0,0|0,1,1]=4 12275 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [0,1,0,1,0,0|1,0,0]=3 12276 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [0,1,0,1,0,0|1,0,0]=3 12277 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [0,1,0,1,0,0|2,0,0]=4 12278 B9R1.5 N[C@@H]1CSCCNC1=O Amb32414615 [0,1,0,1,0,0|2,0,0]=4 12279 B9R1.5 N[C@H]1CCCCC[C@@H]1N Amb25790654 [0,1,0,1,0,0|1,0,1]=4 12280 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [0,1,0,1,0,0|0,0,2]=4 12281 B9R1.5 N[C@H]1CCCCC[C@H]1N Amb24659857 [0,1,0,1,0,0|1,0,1]=4 12282 B9R1.5 N[C@H]1CCCCC[C@H]1N Amb30585192 [0,1,0,1,0,0|1,0,1]=4 12283 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [0,1,0,1,0,0|1,0,0]=3 12284 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [0,1,0,1,0,0|1,0,0]=3 12285 B9R1.5 N[C@H]1COCCNC1=O Amb27234381 [0,1,0,1,0,0|2,0,0]=4 12286 B9R1.5 N[C@H]1CSCCNC1=O Amb10067826 [0,1,0,1,0,0|2,0,0]=4 12287 B9R1.5 O=C1C=CCCCC1O Amb27838742 [0,1,0,1,0,0|0,0,2]=4 12288 B9R1.5 O=C1CCCCC=C1Br Amb27482990 [0,1,0,1,0,0|0,0,2]=4 12289 B9R1.5 O=C1CCCCC=C1F Amb27835100 [0,1,0,1,0,0|0,0,2]=4 12290 B9R1.5 O=C1CCCCCC1=O Amb17593310 [0,1,0,1,0,0|0,0,1]=3 12291 B9R1.5 O=C1CCCCCC1Br Amb18325296 [0,1,0,1,0,0|0,0,0]=2 12292 B9R1.5 O=C1CCCCCC1Cl Amb6892055 [0,1,0,1,0,0|0,0,0]=2 12293 B9R1.5 O=C1CCCCCC1F Amb21965071 [0,1,0,1,0,0|0,0,0]=2 12294 B9R1.5 O=C1CCCCCC1O Amb25284997 [0,1,0,1,0,0|0,0,0]=2 12295 B9R1.5 O=C1CCCCCC1S Amb28199868 [0,1,0,1,0,0|0,0,0]=2 12296 B9R1.5 O=C1CCCCCN1Br Amb9786551 [0,1,0,1,0,0|1,0,0]=3 12297 B9R1.5 O=C1CCCCCN1Cl Amb10572732 [0,1,0,1,0,0|1,0,0]=3 12298 B9R1.5 O=C1CCCCOC1=O Amb27227093 [0,1,0,1,0,0|1,0,1]=4 12299 B9R1.5 O=C1CCCNCC1F Amb22886244 [0,1,0,1,0,0|1,0,0]=3 12300 B9R1.5 O=C1CCNCCC1=O Amb32415899 [0,1,0,1,0,0|1,0,1]=4 12301 B9R1.5 O=C1CCNCCC1Br Amb27201712 [0,1,0,1,0,0|1,0,0]=3 12302 B9R1.5 O=C1CCNCCC1Br Amb33621267 [0,1,0,1,0,0|1,0,0]=3 12303 B9R1.5 O=C1CCNCCC1F Amb22886247 [0,1,0,1,0,0|1,0,0]=3 12304 B9R1.5 O=C1CCOCCC1=O Amb32642050 [0,1,0,1,0,0|1,0,1]=4 12305 B9R1.5 O=C1CCSCCC1=O Amb32642055 [0,1,0,1,0,0|1,0,1]=4 12306 B9R1.5 O=C1CNCCCC1F Amb22886238 [0,1,0,1,0,0|1,0,0]=3 12307 B9R1.5 O=C1NCCCCC1Br Amb9781677 [0,1,0,1,0,0|1,0,0]=3 12308 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [0,1,0,1,0,0|1,0,0]=3 12309 B9R1.5 O=C1NCCCCC1I Amb35751097 [0,1,0,1,0,0|1,0,0]=3 12310 B9R1.5 OC1CCCCC=C1Br Amb27604372 [0,1,0,1,0,0|1,0,1]=4 12311 B9R1.5 OC1CCCCC=C1Cl Amb28185035 [0,1,0,1,0,0|1,0,1]=4 12312 B9R1.5 OC1CCCCCC1Br Amb24480058 [0,1,0,1,0,0|0,0,2]=4 12313 B9R1.5 OC1CCCCCC1Cl Amb27974196 [0,1,0,1,0,0|0,0,2]=4 12314 B9R1.5 OC1CCCCCC1I Amb27640772 [0,1,0,1,0,0|0,0,2]=4 12315 B9R1.5 OC1CCCCCC1O Amb2196454 [0,1,0,1,0,0|0,0,2]=4 12316 B9R1.5 O[C@@H]1C=CCCC[C@H]1O Amb27184263 [0,1,0,1,0,0|2,0,0]=4 12317 B9R1.5 O[C@@H]1CCCCC[C@H]1F Amb27853128 [0,1,0,1,0,0|0,0,2]=4 12318 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [0,1,0,1,0,0|0,0,2]=4 12319 B9R1.5 O[C@H]1C=CCCC[C@@H]1O Amb28428672 [0,1,0,1,0,0|2,0,0]=4 12320 B9R1.5 O[C@H]1CCCCC[C@@H]1Cl Amb27440550 [0,1,0,1,0,0|0,0,2]=4 12321 B9R1.5 O[C@H]1CCCCC[C@@H]1F Amb28344995 [0,1,0,1,0,0|0,0,2]=4 12322 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [0,1,0,1,0,0|0,0,2]=4 12323 B9R1.5 O[C@H]1CCCCC[C@H]1Br Amb28051852 [0,1,0,1,0,0|0,0,2]=4 12324 B9R1.5 O[C@H]1CCCCC[C@H]1Cl Amb27657604 [0,1,0,1,0,0|0,0,2]=4 12325 B9R1.14 C#CC1CCNC1CC Amb33169165 [0,1,0,1,0,0|1,0,1]=4 12326 B9R1.14 C=CC1OCCC1CN Amb25381398 [0,1,0,1,0,0|2,0,0]=4 12327 B9R1.14 C=C[C@@H]1CCC[C@@H]1C=O Amb28346572 [0,1,0,1,0,0|0,0,1]=3 12328 B9R1.14 C=C[C@@H]1CCC[C@H]1CO Amb28131037 [0,1,0,1,0,0|1,0,0]=3 12329 B9R1.14 C=C[C@@H]1CCO[C@H]1CO Amb27208120 [0,1,0,1,0,0|2,0,0]=4 12330 B9R1.14 C=C[C@@H]1OCC[C@H]1CN Amb24548005 [0,1,0,1,0,0|2,0,0]=4 12331 B9R1.14 C=C[C@H]1CCO[C@H]1C=O Amb28130427 [0,1,0,1,0,0|0,0,2]=4 12332 B9R1.14 CCC1=C(CO)CCC1 Amb27978212 [0,1,0,1,0,0|0,0,2]=4 12333 B9R1.14 CCC1CCC=C1CO Amb28049264 [0,1,0,1,0,0|0,0,2]=4 12334 B9R1.14 CCC1CCCC1CBr Amb27955021 [0,1,0,1,0,0|1,0,1]=4 12335 B9R1.14 CCC1CCCC1CC Amb27236275 [0,1,0,1,0,0|1,0,1]=4 12336 B9R1.14 CCC1CCCC1CN Amb25145993 [0,1,0,1,0,0|1,0,1]=4 12337 B9R1.14 CCC1CCCC1CN Amb32662607 [0,1,0,1,0,0|1,0,1]=4 12338 B9R1.14 CCC1CCCC1NC Amb18282856 [0,1,0,1,0,0|1,0,1]=4 12339 B9R1.14 CCC1CCNC1CC Amb3788100 [0,1,0,1,0,0|1,0,1]=4 12340 B9R1.14 CCC1CNCC1CC Amb22371139 [0,1,0,1,0,0|1,0,1]=4 12341 B9R1.14 CCC1CNCC1CN Amb26003960 [0,1,0,1,0,0|1,0,1]=4 12342 B9R1.14 CCC1CNCC1CO Amb27441323 [0,1,0,1,0,0|0,0,2]=4 12343 B9R1.14 CCC1CNCC1OC Amb27246480 [0,1,0,1,0,0|2,0,0]=4 12344 B9R1.14 CCC1COCC1C#N Amb35635838 [0,1,0,1,0,0|1,0,1]=4 12345 B9R1.14 CCC1COCC1C=O Amb29882927 [0,1,0,1,0,0|0,0,0]=2 12346 B9R1.14 CCC1COCC1CBr Amb35632077 [0,1,0,1,0,0|1,0,1]=4 12347 B9R1.14 CCC1COCC1CCl Amb35632076 [0,1,0,1,0,0|1,0,1]=4 12348 B9R1.14 CCC1COCC1CO Amb35651599 [0,1,0,1,0,0|0,0,2]=4 12349 B9R1.14 CCC1COCC1NC Amb35632267 [0,1,0,1,0,0|2,0,0]=4 12350 B9R1.14 CCC1COCC1NN Amb35616349 [0,1,0,1,0,0|2,0,0]=4 12351 B9R1.14 CCC1COCC1NO Amb35612699 [0,1,0,1,0,0|1,0,1]=4 12352 B9R1.14 CCC1COC\C1=N/N Amb35616343 [0,1,0,1,0,0|2,0,0]=4 12353 B9R1.14 CCC1COC\C1=N/O Amb29878963 [0,1,0,1,0,0|1,0,1]=4 12354 B9R1.14 CCC1CSCC1CN Amb28456030 [0,1,0,1,0,0|1,0,1]=4 12355 B9R1.14 CCC1NCCC1CN Amb18832605 [0,1,0,1,0,0|1,0,1]=4 12356 B9R1.14 CCC1NCCC1CO Amb26643148 [0,1,0,1,0,0|0,0,2]=4 12357 B9R1.14 CCC1OCCC1CBr Amb28387646 [0,1,0,1,0,0|1,0,1]=4 12358 B9R1.14 CCC1OCCC1CCl Amb27869227 [0,1,0,1,0,0|1,0,1]=4 12359 B9R1.14 CCC1OCCC1CO Amb27975537 [0,1,0,1,0,0|0,0,2]=4 12360 B9R1.14 CCN1CCCC1CBr Amb16186922 [0,1,0,1,0,0|1,0,1]=4 12361 B9R1.14 CCN1CCCC1CCl Amb19516950 [0,1,0,1,0,0|1,0,1]=4 12362 B9R1.14 CCN1CCCC1CCl Amb22587445 [0,1,0,1,0,0|1,0,1]=4 12363 B9R1.14 CCN1CCCC1CN Amb9702821 [0,1,0,1,0,0|1,0,1]=4 12364 B9R1.14 CCN1CCCC1CO Amb6537970 [0,1,0,1,0,0|0,0,2]=4 12365 B9R1.14 CCN1CCCC1CO Amb6537973 [0,1,0,1,0,0|0,0,2]=4 12366 B9R1.14 CCN1CCC[C@@H]1CBr Amb29886792 [0,1,0,1,0,0|1,0,1]=4 12367 B9R1.14 CCN1CCC[C@@H]1CCl Amb22757842 [0,1,0,1,0,0|1,0,1]=4 12368 B9R1.14 CCN1CCC[C@@H]1CN Amb23399734 [0,1,0,1,0,0|1,0,1]=4 12369 B9R1.14 CCN1CCC[C@@H]1CN Amb3939663 [0,1,0,1,0,0|1,0,1]=4 12370 B9R1.14 CCN1CCC[C@@H]1CO Amb24678478 [0,1,0,1,0,0|0,0,2]=4 12371 B9R1.14 CCN1CCC[C@H]1CBr Amb29886839 [0,1,0,1,0,0|1,0,1]=4 12372 B9R1.14 CCN1CCC[C@H]1CN Amb3939841 [0,1,0,1,0,0|1,0,1]=4 12373 B9R1.14 CCN1CCC[C@H]1CN Amb8631329 [0,1,0,1,0,0|1,0,1]=4 12374 B9R1.14 CCN1CCC[C@H]1CO Amb19517075 [0,1,0,1,0,0|0,0,2]=4 12375 B9R1.14 CCN1CCN=C1C=O Amb20248622 [0,1,0,1,0,0|1,0,1]=4 12376 B9R1.14 CC[C@@H]1CCC[C@H]1CC Amb22231650 [0,1,0,1,0,0|1,0,1]=4 12377 B9R1.14 CC[C@@H]1CNC[C@H]1CN Amb32672062 [0,1,0,1,0,0|1,0,1]=4 12378 B9R1.14 CC[C@@H]1NCC[C@@H]1CO Amb27800143 [0,1,0,1,0,0|0,0,2]=4 12379 B9R1.14 CC[C@H]1CNC[C@@H]1CO Amb33871489 [0,1,0,1,0,0|0,0,2]=4 12380 B9R1.14 CNC1CCCC1C#N Amb18945885 [0,1,0,1,0,0|1,0,1]=4 12381 B9R1.14 CNC1CCCC1CN Amb24478693 [0,1,0,1,0,0|1,0,1]=4 12382 B9R1.14 CNC1CCCC1SC Amb19149246 [0,1,0,1,0,0|2,0,0]=4 12383 B9R1.14 CN[C@@H]1CCC[C@H]1OC Amb27944979 [0,1,0,1,0,0|2,0,0]=4 12384 B9R1.14 COC1CCCC1CN Amb9286522 [0,1,0,1,0,0|1,0,1]=4 12385 B9R1.14 COC1CCCC1CO Amb27977996 [0,1,0,1,0,0|0,0,2]=4 12386 B9R1.14 COC1CCCC1ON Amb27750455 [0,1,0,1,0,0|2,0,0]=4 12387 B9R1.14 COC1CCCN1C=O Amb24078378 [0,1,0,1,0,0|1,0,0]=3 12388 B9R1.14 CO[C@@H]1CCC[C@@H]1C=O Amb28057513 [0,1,0,1,0,0|0,0,0]=2 12389 B9R1.14 CO[C@@H]1CCC[C@@H]1CO Amb27420276 [0,1,0,1,0,0|0,0,2]=4 12390 B9R1.14 CO[C@H]1CCC[C@@H]1C=O Amb27230343 [0,1,0,1,0,0|0,0,0]=2 12391 B9R1.14 CSC1CCCC1CN Amb18951039 [0,1,0,1,0,0|1,0,1]=4 12392 B9R1.14 ClC[C@H]1CCC[C@@H]1CCl Amb27252321 [0,1,0,1,0,0|1,0,1]=4 12393 B9R1.14 N#CC1CCCC1CO Amb27808797 [0,1,0,1,0,0|1,0,1]=4 12394 B9R1.14 N#C[C@@H]1CCC[C@H]1C=O Amb27440385 [0,1,0,1,0,0|0,0,1]=3 12395 B9R1.14 NCC1CCCC1CF Amb20668101 [0,1,0,1,0,0|1,0,1]=4 12396 B9R1.14 NCC1CCCC1CF Amb33330465 [0,1,0,1,0,0|1,0,1]=4 12397 B9R1.14 NCC1CCCC1NO Amb27630274 [0,1,0,1,0,0|1,0,1]=4 12398 B9R1.14 NCC1CCCN1C=O Amb18908290 [0,1,0,1,0,0|1,0,0]=3 12399 B9R1.14 O=CC1CCCC1C=O Amb28053995 [0,1,0,1,0,0|0,0,1]=3 12400 B9R1.14 O=CC1COCC1C=O Amb23454676 [0,1,0,1,0,0|1,0,1]=4 12401 B9R1.14 O=CN1CCC[C@@H]1CO Amb25796504 [0,1,0,1,0,0|1,0,0]=3 12402 B9R1.14 O=CN1CCC[C@H]1CO Amb24362992 [0,1,0,1,0,0|1,0,0]=3 12403 B9R1.14 O=NN1CCCC1CO Amb17593373 [0,1,0,1,0,0|2,0,0]=4 12404 B9R1.14 OCC1CCCC1CF Amb27185976 [0,1,0,1,0,0|0,0,2]=4 12405 B9R1.14 OCC1CCCC1CO Amb27484587 [0,1,0,1,0,0|0,0,2]=4 12406 B9R1.14 OC[C@@H]1CCC[C@H]1CO Amb28053551 [0,1,0,1,0,0|0,0,2]=4 12407 B9R1.14 OC[C@H]1CCC[C@@H]1CO Amb27783101 [0,1,0,1,0,0|0,0,2]=4 12408 B9R1.14 OC[C@H]1CCC[C@H]1CCl Amb27196244 [0,1,0,1,0,0|0,0,2]=4 12409 B9R1.14 OC[C@H]1CCC[C@H]1CO Amb28187775 [0,1,0,1,0,0|0,0,2]=4 12410 B9R1.16 C#CCCCC1CC1O Amb27166599 [0,1,0,1,0,0|1,0,1]=4 12411 B9R1.16 C#CCCC[C@@H]1C[C@H]1O Amb25255526 [0,1,0,1,0,0|1,0,1]=4 12412 B9R1.16 C#CCNCC1CC1C Amb27216008 [0,1,0,1,0,0|1,0,1]=4 12413 B9R1.16 C=CCCC[C@@H]1C[C@H]1O Amb26927916 [0,1,0,1,0,0|1,0,0]=3 12414 B9R1.16 C=CCNCC1CC1C Amb23447162 [0,1,0,1,0,0|1,0,0]=3 12415 B9R1.16 CC1CC1CCCC=O Amb33143871 [0,1,0,1,0,0|0,0,0]=2 12416 B9R1.16 CC1CC1CCCCN Amb33143911 [0,1,0,1,0,0|1,0,1]=4 12417 B9R1.16 CC1CC1CCN=C=O Amb33144661 [0,1,0,1,0,0|0,0,1]=3 12418 B9R1.16 CC1CC1CCN=[N+]=[N-] Amb33143844 [0,1,0,1,0,0|2,0,0]=4 12419 B9R1.16 CC1CC1CNCCO Amb27948476 [0,1,0,1,0,0|0,0,2]=4 12420 B9R1.16 CC1CC1NCCCN Amb19022472 [0,1,0,1,0,0|1,0,1]=4 12421 B9R1.16 CC1CC1NCCCO Amb19022443 [0,1,0,1,0,0|0,0,2]=4 12422 B9R1.16 CC1CC1OCCCN Amb33144883 [0,1,0,1,0,0|1,0,1]=4 12423 B9R1.16 CCCCCC1CC1Br Amb27408601 [0,1,0,1,0,0|1,0,1]=4 12424 B9R1.16 CCCCCC1CC1Cl Amb27477799 [0,1,0,1,0,0|1,0,1]=4 12425 B9R1.16 CCCCCC1CC1N Amb27872129 [0,1,0,1,0,0|1,0,1]=4 12426 B9R1.16 CCCCCC1OC1C Amb25888870 [0,1,0,1,0,0|0,0,2]=4 12427 B9R1.16 CCCCC[C@@H]1C[C@H]1F Amb27849384 [0,1,0,1,0,0|1,0,1]=4 12428 B9R1.16 CCCCC[C@H]1C[C@H]1O Amb28292777 [0,1,0,1,0,0|0,0,2]=4 12429 B9R1.16 CCCCNC1CC1C Amb19022375 [0,1,0,1,0,0|1,0,1]=4 12430 B9R1.16 CCCCO[C@@H]1C[C@@H]1Cl Amb27243377 [0,1,0,1,0,0|1,0,1]=4 12431 B9R1.16 CCCCO[C@@H]1C[C@H]1N Amb25366599 [0,1,0,1,0,0|1,0,1]=4 12432 B9R1.16 CCCCO[C@H]1C[C@H]1Cl Amb28384496 [0,1,0,1,0,0|1,0,1]=4 12433 B9R1.16 CCCNCC1CC1C Amb8853760 [0,1,0,1,0,0|1,0,1]=4 12434 B9R1.16 CNCCNC1CC1C Amb19022475 [0,1,0,1,0,0|2,0,0]=4 12435 B9R1.16 COCCNC1CC1C Amb19022449 [0,1,0,1,0,0|2,0,0]=4 12436 B9R1.16 CSCCNC1CC1C Amb27246063 [0,1,0,1,0,0|2,0,0]=4 12437 B9R1.16 C\C=C\CCC1OC1C Amb27791225 [0,1,0,1,0,0|1,0,1]=4 12438 B9R1.17 BrCCCCN1CCC1 Amb27870431 [0,1,0,1,0,0|1,0,1]=4 12439 B9R1.17 BrCCCOC1CCC1 Amb18321012 [0,1,0,1,0,0|1,0,1]=4 12440 B9R1.17 BrCCOCC1CCC1 Amb28121364 [0,1,0,1,0,0|1,0,1]=4 12441 B9R1.17 C#CCCNC1CCC1 Amb26024525 [0,1,0,1,0,0|1,0,1]=4 12442 B9R1.17 C#CCSCC1CCC1 Amb28188126 [0,1,0,1,0,0|1,0,1]=4 12443 B9R1.17 C=CCCCC1COC1 Amb27494756 [0,1,0,1,0,0|1,0,0]=3 12444 B9R1.17 C=CCCOC1CNC1 Amb24626068 [0,1,0,1,0,0|2,0,0]=4 12445 B9R1.17 C=CCOCC1CCN1 Amb27463492 [0,1,0,1,0,0|2,0,0]=4 12446 B9R1.17 C=CCSCC1CNC1 Amb28363761 [0,1,0,1,0,0|2,0,0]=4 12447 B9R1.17 C=COCCC1CCC1 Amb27628623 [0,1,0,1,0,0|1,0,0]=3 12448 B9R1.17 CCCCCC1CCN1 Amb28387630 [0,1,0,1,0,0|1,0,1]=4 12449 B9R1.17 CCCCCC1CNC1 Amb27599832 [0,1,0,1,0,0|1,0,1]=4 12450 B9R1.17 CCCCCC1CNC1 Amb33141041 [0,1,0,1,0,0|1,0,1]=4 12451 B9R1.17 CCCCOC1CNC1 Amb19031045 [0,1,0,1,0,0|2,0,0]=4 12452 B9R1.17 CCCNCC1CNC1 Amb27265692 [0,1,0,1,0,0|2,0,0]=4 12453 B9R1.17 CCCSCC1CCC1 Amb28134469 [0,1,0,1,0,0|1,0,1]=4 12454 B9R1.17 CCOCCC1CNC1 Amb27981140 [0,1,0,1,0,0|2,0,0]=4 12455 B9R1.17 CCSCCC1CNC1 Amb28285198 [0,1,0,1,0,0|2,0,0]=4 12456 B9R1.17 CNCCCC1CNC1 Amb27613088 [0,1,0,1,0,0|2,0,0]=4 12457 B9R1.17 CNCCCC1COC1 Amb27612966 [0,1,0,1,0,0|2,0,0]=4 12458 B9R1.17 CNCCNC1CCC1 Amb19022298 [0,1,0,1,0,0|2,0,0]=4 12459 B9R1.17 CNCCOC1CCC1 Amb19024861 [0,1,0,1,0,0|2,0,0]=4 12460 B9R1.17 CNCCSC1CCC1 Amb27669181 [0,1,0,1,0,0|2,0,0]=4 12461 B9R1.17 COCCCC1CNC1 Amb26562458 [0,1,0,1,0,0|2,0,0]=4 12462 B9R1.17 COCCNC1CCC1 Amb23597827 [0,1,0,1,0,0|2,0,0]=4 12463 B9R1.17 CONCCC1CCC1 Amb27969309 [0,1,0,1,0,0|1,0,1]=4 12464 B9R1.17 CSCCCC1CNC1 Amb25185106 [0,1,0,1,0,0|2,0,0]=4 12465 B9R1.17 ClCCCCN1CCC1 Amb27790623 [0,1,0,1,0,0|1,0,1]=4 12466 B9R1.17 Cl\C=C\CNC1CCC1 Amb27414180 [0,1,0,1,0,0|1,0,1]=4 12467 B9R1.17 FCCCCN1CCC1 Amb28381307 [0,1,0,1,0,0|1,0,1]=4 12468 B9R1.17 FCCNCC1CCC1 Amb27433714 [0,1,0,1,0,0|1,0,1]=4 12469 B9R1.17 ICCNCC1CCC1 Amb28047556 [0,1,0,1,0,0|1,0,1]=4 12470 B9R1.17 N#CCCCC1CCC1 Amb35656784 [0,1,0,1,0,0|1,0,1]=4 12471 B9R1.17 N#CCCOC1CCC1 Amb27837521 [0,1,0,1,0,0|1,0,1]=4 12472 B9R1.17 N#CCNCC1CCC1 Amb8929506 [0,1,0,1,0,0|1,0,1]=4 12473 B9R1.17 NCCCCC1CCC1 Amb25888956 [0,1,0,1,0,0|1,0,1]=4 12474 B9R1.17 NCCCCC1CSC1 Amb27463448 [0,1,0,1,0,0|1,0,1]=4 12475 B9R1.17 NCCCCN1CCC1 Amb27838494 [0,1,0,1,0,0|1,0,1]=4 12476 B9R1.17 NCCCNC1CCC1 Amb19021296 [0,1,0,1,0,0|1,0,1]=4 12477 B9R1.17 NCCCOC1CCC1 Amb26878582 [0,1,0,1,0,0|1,0,1]=4 12478 B9R1.17 NCCNCC1CCC1 Amb26617200 [0,1,0,1,0,0|1,0,1]=4 12479 B9R1.17 NCCOCC1CCC1 Amb32664098 [0,1,0,1,0,0|1,0,1]=4 12480 B9R1.17 NCCOCC1CCC1 Amb33548531 [0,1,0,1,0,0|1,0,1]=4 12481 B9R1.17 NNCCCC1CCC1 Amb27779786 [0,1,0,1,0,0|1,0,1]=4 12482 B9R1.17 NOCCOC1CCC1 Amb27421034 [0,1,0,1,0,0|2,0,0]=4 12483 B9R1.17 O=C=NCCC1CCC1 Amb25241025 [0,1,0,1,0,0|0,0,1]=3 12484 B9R1.17 O=C=NCCN1CCC1 Amb28053257 [0,1,0,1,0,0|1,0,1]=4 12485 B9R1.17 O=CCCCC1CCC1 Amb33197139 [0,1,0,1,0,0|0,0,0]=2 12486 B9R1.17 O=CCCSC1COC1 Amb27844941 [0,1,0,1,0,0|1,0,0]=3 12487 B9R1.17 O=CNCCC1CCN1 Amb28286866 [0,1,0,1,0,0|1,0,0]=3 12488 B9R1.17 O=CNCCN1CCC1 Amb29872198 [0,1,0,1,0,0|1,0,0]=3 12489 B9R1.17 O=CNOCC1CCC1 Amb35636972 [0,1,0,1,0,0|1,0,0]=3 12490 B9R1.17 OCCCCC1CCC1 Amb32945992 [0,1,0,1,0,0|0,0,2]=4 12491 B9R1.17 OCCCCC1CCN1 Amb27186139 [0,1,0,1,0,0|0,0,2]=4 12492 B9R1.17 OCCCCC1CCO1 Amb27486325 [0,1,0,1,0,0|0,0,2]=4 12493 B9R1.17 OCCCCC1CNC1 Amb27186138 [0,1,0,1,0,0|0,0,2]=4 12494 B9R1.17 OCCCCC1COC1 Amb25187833 [0,1,0,1,0,0|0,0,2]=4 12495 B9R1.17 OCCCC[C@H]1CCO1 Amb27807122 [0,1,0,1,0,0|0,0,2]=4 12496 B9R1.17 OCCCNC1CCC1 Amb22229279 [0,1,0,1,0,0|0,0,2]=4 12497 B9R1.17 OCCCOC1CCC1 Amb27948159 [0,1,0,1,0,0|0,0,2]=4 12498 B9R1.17 OCCNCC1CCC1 Amb8929462 [0,1,0,1,0,0|0,0,2]=4 12499 B9R1.17 OCCOCC1CCC1 Amb27246167 [0,1,0,1,0,0|0,0,2]=4 12500 B9R1.17 [N-]=[N+]=NCCC1CCC1 Amb24585503 [0,1,0,1,0,0|2,0,0]=4 12501 B9R1.39 C#CCCC1CCC1O Amb32945257 [0,1,0,1,0,0|1,0,1]=4 12502 B9R1.39 C=CCCC1CCC1O Amb28346351 [0,1,0,1,0,0|1,0,0]=3 12503 B9R1.39 C=CCCC1CNC1=O Amb28314166 [0,1,0,1,0,0|0,0,2]=4 12504 B9R1.39 C=CCNC1CCC1C Amb27973342 [0,1,0,1,0,0|1,0,0]=3 12505 B9R1.39 C=CCOC1CCC1=O Amb22896545 [0,1,0,1,0,0|0,0,2]=4 12506 B9R1.39 CCCCC1CCC1N Amb27193785 [0,1,0,1,0,0|1,0,1]=4 12507 B9R1.39 CCCCC1CCC1O Amb32950020 [0,1,0,1,0,0|0,0,2]=4 12508 B9R1.39 CCCNC1CCC1C Amb28188610 [0,1,0,1,0,0|1,0,1]=4 12509 B9R1.39 CCCO[C@@H]1CC[C@@H]1N Amb33495617 [0,1,0,1,0,0|1,0,1]=4 12510 B9R1.39 CCCO[C@@H]1CC[C@H]1O Amb33495605 [0,1,0,1,0,0|0,0,2]=4 12511 B9R1.39 CCC\C=C1/CNC1=O Amb27655996 [0,1,0,1,0,0|0,0,2]=4 12512 B9R1.39 CCNCC1CCC1C Amb23512036 [0,1,0,1,0,0|1,0,1]=4 12513 B9R1.39 CCNCC1CCN1C Amb29852922 [0,1,0,1,0,0|2,0,0]=4 12514 B9R1.39 CCOCC1CCC1O Amb33213410 [0,1,0,1,0,0|0,0,2]=4 12515 B9R1.39 CN1CCC1CCCN Amb27670158 [0,1,0,1,0,0|1,0,1]=4 12516 B9R1.39 NCCCC1CCC1O Amb25784142 [0,1,0,1,0,0|0,0,2]=4 12517 B9R1.39 NCCCN1CCC1=O Amb27209792 [0,1,0,1,0,0|1,0,0]=3 12518 B9R1.39 O=C1CCC1CCCCl Amb32684692 [0,1,0,1,0,0|0,0,0]=2 12519 B9R1.39 OCCCC1CCC1O Amb28138520 [0,1,0,1,0,0|0,0,2]=4 12520 B9R1.83 BrCCCCCC1CC1 Amb32992758 [0,1,0,1,0,0|1,0,1]=4 12521 B9R1.83 BrCCCNCC1CC1 Amb27971427 [0,1,0,1,0,0|1,0,1]=4 12522 B9R1.83 BrCCCOCC1CC1 Amb9209737 [0,1,0,1,0,0|1,0,1]=4 12523 B9R1.83 C#CCCCNC1CC1 Amb19025219 [0,1,0,1,0,0|1,0,1]=4 12524 B9R1.83 C=CCCCCC1CO1 Amb8515843 [0,1,0,1,0,0|1,0,0]=3 12525 B9R1.83 C=CCCNCC1CC1 Amb27833864 [0,1,0,1,0,0|1,0,0]=3 12526 B9R1.83 C=CCCSCC1CC1 Amb27956578 [0,1,0,1,0,0|1,0,0]=3 12527 B9R1.83 C=CCNCCC1CC1 Amb27443426 [0,1,0,1,0,0|1,0,0]=3 12528 B9R1.83 C=CCONCC1CC1 Amb28324550 [0,1,0,1,0,0|2,0,0]=4 12529 B9R1.83 CCCCCCC1=CC1 Amb27793496 [0,1,0,1,0,0|1,0,0]=3 12530 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|0,0,2]=4 12531 B9R1.83 CCCCCCC1CS1 Amb27873363 [0,1,0,1,0,0|0,1,1]=4 12532 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|0,0,2]=4 12533 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|0,0,2]=4 12534 B9R1.83 CCCCCC[C@H]1CS1 Amb22367053 [0,1,0,1,0,0|0,1,1]=4 12535 B9R1.83 CCCCCNC1CC1 Amb6248403 [0,1,0,1,0,0|1,0,1]=4 12536 B9R1.83 CCCCNCC1CC1 Amb6686876 [0,1,0,1,0,0|1,0,1]=4 12537 B9R1.83 CCCCNCC1CO1 Amb27950731 [0,1,0,1,0,0|0,0,2]=4 12538 B9R1.83 CCCCOCC1CO1 Amb534220 [0,1,0,1,0,0|0,0,2]=4 12539 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|0,0,2]=4 12540 B9R1.83 CCCCOC[C@H]1CO1 Amb26926784 [0,1,0,1,0,0|0,0,2]=4 12541 B9R1.83 CCCCSC[C@H]1CO1 Amb27753323 [0,1,0,1,0,0|0,0,2]=4 12542 B9R1.83 CCCNCCC1CC1 Amb25921074 [0,1,0,1,0,0|1,0,1]=4 12543 B9R1.83 CCCSCCC1CC1 Amb28349579 [0,1,0,1,0,0|1,0,1]=4 12544 B9R1.83 CCCSCCC1CO1 Amb27256622 [0,1,0,1,0,0|0,0,2]=4 12545 B9R1.83 CCNCCCC1CC1 Amb25147174 [0,1,0,1,0,0|1,0,1]=4 12546 B9R1.83 CNCCOCC1CC1 Amb20622213 [0,1,0,1,0,0|2,0,0]=4 12547 B9R1.83 COCCCNC1CC1 Amb17231857 [0,1,0,1,0,0|2,0,0]=4 12548 B9R1.83 COCCNCC1CC1 Amb6707453 [0,1,0,1,0,0|2,0,0]=4 12549 B9R1.83 CONCCCC1CC1 Amb28194130 [0,1,0,1,0,0|1,0,1]=4 12550 B9R1.83 C\C=C\CSCC1CC1 Amb27837621 [0,1,0,1,0,0|1,0,1]=4 12551 B9R1.83 ClCCCOCC1CC1 Amb6681169 [0,1,0,1,0,0|1,0,1]=4 12552 B9R1.83 ClCCCSCC1CC1 Amb27826511 [0,1,0,1,0,0|1,0,1]=4 12553 B9R1.83 ClCCOCCC1CC1 Amb27240396 [0,1,0,1,0,0|1,0,1]=4 12554 B9R1.83 Cl\C=C\CSCC1CC1 Amb27843136 [0,1,0,1,0,0|1,0,1]=4 12555 B9R1.83 FCCCCNC1CC1 Amb27641511 [0,1,0,1,0,0|1,0,1]=4 12556 B9R1.83 FCCCNCC1CC1 Amb27838486 [0,1,0,1,0,0|1,0,1]=4 12557 B9R1.83 ICCCNCC1CC1 Amb27242288 [0,1,0,1,0,0|1,0,1]=4 12558 B9R1.83 ICCNCCC1CC1 Amb27451222 [0,1,0,1,0,0|1,0,1]=4 12559 B9R1.83 N#CCCNCC1CC1 Amb8829023 [0,1,0,1,0,0|1,0,1]=4 12560 B9R1.83 N#CCCOCC1CC1 Amb6681190 [0,1,0,1,0,0|1,0,1]=4 12561 B9R1.83 N#CCNCCC1CC1 Amb28255670 [0,1,0,1,0,0|1,0,1]=4 12562 B9R1.83 N#CNCCCC1CC1 Amb27478179 [0,1,0,1,0,0|1,0,1]=4 12563 B9R1.83 NCCCCCC1CC1 Amb18832667 [0,1,0,1,0,0|1,0,1]=4 12564 B9R1.83 NCCCCCN1CC1 Amb24078338 [0,1,0,1,0,0|1,0,1]=4 12565 B9R1.83 NCCCCNC1CC1 Amb17334101 [0,1,0,1,0,0|1,0,1]=4 12566 B9R1.83 NCCCCSC1CC1 Amb27259066 [0,1,0,1,0,0|1,0,1]=4 12567 B9R1.83 NCCCNCC1CC1 Amb27465877 [0,1,0,1,0,0|1,0,1]=4 12568 B9R1.83 NCCCOCC1CC1 Amb1216862 [0,1,0,1,0,0|1,0,1]=4 12569 B9R1.83 NCCCSCC1CC1 Amb28422208 [0,1,0,1,0,0|1,0,1]=4 12570 B9R1.83 NCCNCCC1CC1 Amb23513067 [0,1,0,1,0,0|1,0,1]=4 12571 B9R1.83 NCCOCCC1CC1 Amb25841330 [0,1,0,1,0,0|1,0,1]=4 12572 B9R1.83 NCCOCCC1CC1 Amb35788577 [0,1,0,1,0,0|1,0,1]=4 12573 B9R1.83 O=C=NCCCC1CC1 Amb26563336 [0,1,0,1,0,0|0,0,1]=3 12574 B9R1.83 O=CCCCC=C1CC1 Amb27636935 [0,1,0,1,0,0|0,0,1]=3 12575 B9R1.83 O=CCCCCC1CC1 Amb33361884 [0,1,0,1,0,0|0,0,0]=2 12576 B9R1.83 O=CCCOCC1CC1 Amb26982387 [0,1,0,1,0,0|0,0,0]=2 12577 B9R1.83 O=CCC\C=C\C1CC1 Amb26067487 [0,1,0,1,0,0|0,0,1]=3 12578 B9R1.83 O=CCOCCC1CC1 Amb28049211 [0,1,0,1,0,0|0,0,0]=2 12579 B9R1.83 OCCCCCC1CO1 Amb28189365 [0,1,0,1,0,0|0,0,2]=4 12580 B9R1.83 OCCCCNC1CC1 Amb17334108 [0,1,0,1,0,0|0,0,2]=4 12581 B9R1.83 OCCCNCC1CC1 Amb9423145 [0,1,0,1,0,0|0,0,2]=4 12582 B9R1.83 OCCCOCC1CC1 Amb27622883 [0,1,0,1,0,0|0,0,2]=4 12583 B9R1.83 OCCCSCC1CC1 Amb24478768 [0,1,0,1,0,0|0,0,2]=4 12584 B9R1.83 OCCOCCC1CC1 Amb28049210 [0,1,0,1,0,0|0,0,2]=4 12585 B9R1.83 SCCCOCC1CC1 Amb27761385 [0,1,0,1,0,0|0,1,1]=4 12586 B9R1.83 [N-]=[N+]=NCCCC1CC1 Amb33362223 [0,1,0,1,0,0|2,0,0]=4 12587 B9R1.89 BrCC1C=CCCCC1 Amb33329273 [0,1,0,1,0,0|1,0,0]=3 12588 B9R1.89 BrCC1CCCCCC1 Amb19073228 [0,1,0,1,0,0|1,0,1]=4 12589 B9R1.89 BrCC1CCCCNC1 Amb29854399 [0,1,0,1,0,0|1,0,1]=4 12590 B9R1.89 BrCC1CCCSCC1 Amb30031350 [0,1,0,1,0,0|1,0,1]=4 12591 B9R1.89 C#CC1=CCCCCC1 Amb17689256 [0,1,0,1,0,0|1,0,1]=4 12592 B9R1.89 C#CC1CCCCCC1 Amb25277452 [0,1,0,1,0,0|1,0,1]=4 12593 B9R1.89 C#CC1CCCCCN1 Amb24604907 [0,1,0,1,0,0|1,0,1]=4 12594 B9R1.89 C#CC1CCCCNC1 Amb32675141 [0,1,0,1,0,0|1,0,1]=4 12595 B9R1.89 C#CC1CCCCNC1 Amb32676736 [0,1,0,1,0,0|1,0,1]=4 12596 B9R1.89 C#CC1CCCNCC1 Amb24622456 [0,1,0,1,0,0|1,0,1]=4 12597 B9R1.89 C#CC1CCCNCC1 Amb30585226 [0,1,0,1,0,0|1,0,1]=4 12598 B9R1.89 C#C[C@H]1CCCCCN1 Amb27850038 [0,1,0,1,0,0|1,0,1]=4 12599 B9R1.89 C=CC1=CCCCCC1 Amb28245546 [0,1,0,1,0,0|1,0,1]=4 12600 B9R1.89 C=CC1CCCCCC1 Amb25068667 [0,1,0,1,0,0|1,0,0]=3 12601 B9R1.89 C=NN1CCCCCC1 Amb27495411 [0,1,0,1,0,0|2,0,0]=4 12602 B9R1.89 CCC1CCCCCC1 Amb26390826 [0,1,0,1,0,0|1,0,1]=4 12603 B9R1.89 CCC1CCCCCN1 Amb3788103 [0,1,0,1,0,0|1,0,1]=4 12604 B9R1.89 CCC1CCCNCC1 Amb9316856 [0,1,0,1,0,0|1,0,1]=4 12605 B9R1.89 CCC1CCNCCO1 Amb25367816 [0,1,0,1,0,0|0,0,2]=4 12606 B9R1.89 CCC1CCNCCO1 Amb33482722 [0,1,0,1,0,0|0,0,2]=4 12607 B9R1.89 CCC1CCOCCN1 Amb26348068 [0,1,0,1,0,0|1,0,1]=4 12608 B9R1.89 CCC1CCOCCN1 Amb33482721 [0,1,0,1,0,0|1,0,1]=4 12609 B9R1.89 CCC1CNCCCN1 Amb27194045 [0,1,0,1,0,0|1,0,1]=4 12610 B9R1.89 CCC1CNCCCO1 Amb9358448 [0,1,0,1,0,0|0,0,2]=4 12611 B9R1.89 CCC1CNCCOC1 Amb28400754 [0,1,0,1,0,0|2,0,0]=4 12612 B9R1.89 CCC1COCCCN1 Amb18106727 [0,1,0,1,0,0|1,0,1]=4 12613 B9R1.89 CCN1CCCCCC1 Amb16231374 [0,1,0,1,0,0|1,0,1]=4 12614 B9R1.89 CC[C@@H]1CCCCCN1 Amb28136573 [0,1,0,1,0,0|1,0,1]=4 12615 B9R1.89 CC[C@H]1CCCCCN1 Amb27459025 [0,1,0,1,0,0|1,0,1]=4 12616 B9R1.89 CC[C@H]1CNCCCN1 Amb33620812 [0,1,0,1,0,0|1,0,1]=4 12617 B9R1.89 CNC1=NCCCCC1 Amb4136374 [0,1,0,1,0,0|2,0,0]=4 12618 B9R1.89 CNC1CCCCCC1 Amb1106215 [0,1,0,1,0,0|1,0,1]=4 12619 B9R1.89 CNC1CCCCCC1 Amb22587117 [0,1,0,1,0,0|1,0,1]=4 12620 B9R1.89 CNC1CCCCNC1 Amb10576552 [0,1,0,1,0,0|2,0,0]=4 12621 B9R1.89 CNC1CCCNCC1 Amb22059341 [0,1,0,1,0,0|2,0,0]=4 12622 B9R1.89 CNC1CCCSCC1 Amb35692797 [0,1,0,1,0,0|2,0,0]=4 12623 B9R1.89 CNN1CCCCCC1 Amb27241215 [0,1,0,1,0,0|2,0,0]=4 12624 B9R1.89 CN[C@@H]1CCCCNC1 Amb27630678 [0,1,0,1,0,0|2,0,0]=4 12625 B9R1.89 COC1=CCCCCC1 Amb26014503 [0,1,0,1,0,0|0,0,2]=4 12626 B9R1.89 COC1=NCCCCC1 Amb2726213 [0,1,0,1,0,0|1,0,1]=4 12627 B9R1.89 COC1CCCCCN1 Amb33128038 [0,1,0,1,0,0|1,0,1]=4 12628 B9R1.89 COC1CCCNCC1 Amb22405875 [0,1,0,1,0,0|2,0,0]=4 12629 B9R1.89 COC1CCCNCC1 Amb22405876 [0,1,0,1,0,0|2,0,0]=4 12630 B9R1.89 CSC1=NCCCCC1 Amb24514736 [0,1,0,1,0,0|1,1,0]=4 12631 B9R1.89 CSC1CCCCNC1 Amb20668460 [0,1,0,1,0,0|2,0,0]=4 12632 B9R1.89 CSC1CCCNCC1 Amb24457994 [0,1,0,1,0,0|2,0,0]=4 12633 B9R1.89 ClCC1CCCCCC1 Amb26317790 [0,1,0,1,0,0|1,0,1]=4 12634 B9R1.89 ClCC1CCCCCN1 Amb26567233 [0,1,0,1,0,0|1,0,1]=4 12635 B9R1.89 ClCC1CCCCCN1 Amb32665018 [0,1,0,1,0,0|1,0,1]=4 12636 B9R1.89 ClCC1CCCCNC1 Amb29854216 [0,1,0,1,0,0|1,0,1]=4 12637 B9R1.89 ClCC1CCCSCC1 Amb30031349 [0,1,0,1,0,0|1,0,1]=4 12638 B9R1.89 Cl\N=C1/CCCCCN1 Amb26909444 [0,1,0,1,0,0|2,0,0]=4 12639 B9R1.89 FCC1CCCCCN1 Amb28129640 [0,1,0,1,0,0|1,0,1]=4 12640 B9R1.89 FCC1CCCCNC1 Amb29849262 [0,1,0,1,0,0|1,0,1]=4 12641 B9R1.89 ICC1CCCCCC1 Amb27596090 [0,1,0,1,0,0|1,0,1]=4 12642 B9R1.89 ICC1CCCCCO1 Amb22489614 [0,1,0,1,0,0|0,0,2]=4 12643 B9R1.89 N#CC1=CCCCCC1 Amb4016990 [0,1,0,1,0,0|1,0,1]=4 12644 B9R1.89 N#CC1CCCCCC1 Amb2721571 [0,1,0,1,0,0|1,0,1]=4 12645 B9R1.89 N#CC1CCCCCN1 Amb27253796 [0,1,0,1,0,0|1,0,1]=4 12646 B9R1.89 N#CC1CCCNCC1 Amb22728383 [0,1,0,1,0,0|1,0,1]=4 12647 B9R1.89 N#CC1CCCNCC1 Amb24053192 [0,1,0,1,0,0|1,0,1]=4 12648 B9R1.89 N#CC1CCCOCC1 Amb27857643 [0,1,0,1,0,0|1,0,1]=4 12649 B9R1.89 N#CC1CCCSCC1 Amb29860973 [0,1,0,1,0,0|1,0,1]=4 12650 B9R1.89 N#CN1CCCCCC1 Amb26484170 [0,1,0,1,0,0|1,0,1]=4 12651 B9R1.89 N=CN1CCCCCC1 Amb27491659 [0,1,0,1,0,0|1,0,0]=3 12652 B9R1.89 NCC1=CCCCCC1 Amb27403312 [0,1,0,1,0,0|1,0,1]=4 12653 B9R1.89 NCC1C=CCCCC1 Amb28184480 [0,1,0,1,0,0|1,0,0]=3 12654 B9R1.89 NCC1C=CCCCC1 Amb33744094 [0,1,0,1,0,0|1,0,0]=3 12655 B9R1.89 NCC1CCCCCC1 Amb22001955 [0,1,0,1,0,0|1,0,1]=4 12656 B9R1.89 NCC1CCCCCC1 Amb8943673 [0,1,0,1,0,0|1,0,1]=4 12657 B9R1.89 NCC1CCCCCN1 Amb26045142 [0,1,0,1,0,0|1,0,1]=4 12658 B9R1.89 NCC1CCCCNC1 Amb28314020 [0,1,0,1,0,0|1,0,1]=4 12659 B9R1.89 NCC1CCCCNC1 Amb32653390 [0,1,0,1,0,0|1,0,1]=4 12660 B9R1.89 NCC1CCCOCC1 Amb18203218 [0,1,0,1,0,0|1,0,1]=4 12661 B9R1.89 NCC1CCCSCC1 Amb18198731 [0,1,0,1,0,0|1,0,1]=4 12662 B9R1.89 NCC1CCCSCC1 Amb31156302 [0,1,0,1,0,0|1,0,1]=4 12663 B9R1.89 NN=C1CCCCCC1 Amb28193088 [0,1,0,1,0,0|1,0,0]=3 12664 B9R1.89 NNC1=NCCCCC1 Amb17593334 [0,1,0,1,0,0|2,0,0]=4 12665 B9R1.89 NNC1CCCCCC1 Amb19373178 [0,1,0,1,0,0|1,0,1]=4 12666 B9R1.89 NNC1CCCCCC1 Amb22227928 [0,1,0,1,0,0|1,0,1]=4 12667 B9R1.89 NNC1CCCCCC1 Amb6251286 [0,1,0,1,0,0|1,0,1]=4 12668 B9R1.89 NNC1CCCOCC1 Amb24707598 [0,1,0,1,0,0|2,0,0]=4 12669 B9R1.89 NNC1CCCSCC1 Amb27843720 [0,1,0,1,0,0|2,0,0]=4 12670 B9R1.89 N\N=C1/CCCOCC1 Amb27196684 [0,1,0,1,0,0|2,0,0]=4 12671 B9R1.89 N\N=C1/CCCSCC1 Amb35712537 [0,1,0,1,0,0|2,0,0]=4 12672 B9R1.89 O=CC1=CCCCCC1 Amb9790320 [0,1,0,1,0,0|0,0,1]=3 12673 B9R1.89 O=CC1CCCCCC1 Amb9786985 [0,1,0,1,0,0|0,0,0]=2 12674 B9R1.89 O=CC1CCCOCC1 Amb18832626 [0,1,0,1,0,0|0,0,0]=2 12675 B9R1.89 O=CC1CCCSCC1 Amb18202390 [0,1,0,1,0,0|0,0,0]=2 12676 B9R1.89 O=CN1CCCNCC1 Amb1155085 [0,1,0,1,0,0|1,0,0]=3 12677 B9R1.89 O=CN1CCSSCC1 Amb27410344 [0,1,0,1,0,0|2,0,0]=4 12678 B9R1.89 O=NN1CCCCCC1 Amb22230749 [0,1,0,1,0,0|1,0,0]=3 12679 B9R1.89 O=S=C1CCCCCN1 Amb28313706 [0,1,0,1,0,0|1,0,0]=3 12680 B9R1.89 OCC1=CCCCCC1 Amb27424682 [0,1,0,1,0,0|0,0,2]=4 12681 B9R1.89 OCC1C=CCCCC1 Amb27662352 [0,1,0,1,0,0|1,0,0]=3 12682 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|0,0,2]=4 12683 B9R1.89 OCC1CCCCCC1 Amb34916703 [0,1,0,1,0,0|0,0,2]=4 12684 B9R1.89 OCC1CCCCCN1 Amb33551226 [0,1,0,1,0,0|0,0,2]=4 12685 B9R1.89 OCC1CCCCCN1 Amb8009310 [0,1,0,1,0,0|0,0,2]=4 12686 B9R1.89 OCC1CCCCCO1 Amb25687959 [0,1,0,1,0,0|0,0,2]=4 12687 B9R1.89 OCC1CCCCNC1 Amb19149352 [0,1,0,1,0,0|0,0,2]=4 12688 B9R1.89 OCC1CCCCNC1 Amb8630389 [0,1,0,1,0,0|0,0,2]=4 12689 B9R1.89 OCC1CCCNCC1 Amb22886282 [0,1,0,1,0,0|0,0,2]=4 12690 B9R1.89 OCC1CCCNCC1 Amb33545032 [0,1,0,1,0,0|0,0,2]=4 12691 B9R1.89 OCC1CCCOCC1 Amb18203196 [0,1,0,1,0,0|0,0,2]=4 12692 B9R1.89 OCC1CCCSCC1 Amb18202263 [0,1,0,1,0,0|0,0,2]=4 12693 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [0,1,0,1,0,0|0,0,2]=4 12694 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [0,1,0,1,0,0|0,0,2]=4 12695 B9R1.89 ON=C1CCCCCC1 Amb7969725 [0,1,0,1,0,0|0,0,1]=3 12696 B9R1.89 ONC1CCCSCC1 Amb35692798 [0,1,0,1,0,0|1,0,1]=4 12697 B9R1.89 O\N=C1/CCCCCN1 Amb19894798 [0,1,0,1,0,0|1,0,1]=4 12698 B9R1.89 O\N=C1/CCCNCC1 Amb20243362 [0,1,0,1,0,0|1,0,1]=4 12699 B9R1.89 O\N=C1/CCCOCC1 Amb25147029 [0,1,0,1,0,0|1,0,1]=4 12700 B9R1.89 O\N=C1/CCCSCC1 Amb35692766 [0,1,0,1,0,0|1,0,1]=4 12701 B9R1.89 O\N=C1\CCCCCN1 Amb1107240 [0,1,0,1,0,0|1,0,1]=4 12702 B9R1.89 SCC1CCCCCC1 Amb25960657 [0,1,0,1,0,0|0,1,1]=4 12703 B9R1.89 SCC1CCCCNC1 Amb35611336 [0,1,0,1,0,0|0,1,1]=4 12704 B9R1.89 SCN1CCCCCC1 Amb26499104 [0,1,0,1,0,0|0,1,1]=4 12705 B9R1.89 [C-]#[N+]C1CCCCCC1 Amb1981029 [0,1,0,1,0,0|1,0,1]=4 12706 B9R1.103 C1=CCOCCCCC1 Amb29838311 [0,1,0,1,0,0|1,0,0]=3 12707 B9R1.103 C1CCCCNCCC1 Amb21963016 [0,1,0,1,0,0|1,0,1]=4 12708 B9R1.103 C1CCCCNCCC1 Amb32662942 [0,1,0,1,0,0|1,0,1]=4 12709 B9R1.103 C1CCNCCNCC1 Amb28046834 [0,1,0,1,0,0|1,0,1]=4 12710 B9R1.1 BOC1CCC(Br)CC1 Amb27210785 [0,1,0,1,0,0|2,0,0]=4 12711 B9R1.1 BO[C@H]1CC[C@H](Br)CC1 Amb27657728 [0,1,0,1,0,0|2,0,0]=4 12712 B9R1.1 C#CC1CCC(C)CC1 Amb26610166 [0,1,0,1,0,0|1,0,1]=4 12713 B9R1.1 C#CC1CCC(N)CC1 Amb27441616 [0,1,0,1,0,0|1,0,1]=4 12714 B9R1.1 C#CC1CCC(N)CC1 Amb32651933 [0,1,0,1,0,0|1,0,1]=4 12715 B9R1.1 C#C[C@H]1CC[C@@H](N)CC1 Amb34912788 [0,1,0,1,0,0|1,0,1]=4 12716 B9R1.1 C#C[C@H]1CC[C@H](N)CC1 Amb27775210 [0,1,0,1,0,0|1,0,1]=4 12717 B9R1.1 C#C[C@H]1CC[C@H](N)CC1 Amb32675093 [0,1,0,1,0,0|1,0,1]=4 12718 B9R1.1 C#C[C@H]1CC[C@H](O)CC1 Amb25314158 [0,1,0,1,0,0|1,0,1]=4 12719 B9R1.1 C=CC1CCC(C)CC1 Amb26849223 [0,1,0,1,0,0|1,0,0]=3 12720 B9R1.1 C=CC1CCC(N)CC1 Amb27239285 [0,1,0,1,0,0|1,0,0]=3 12721 B9R1.1 C=CC1CCN(C)CC1 Amb31295149 [0,1,0,1,0,0|2,0,0]=4 12722 B9R1.1 CC1=CCC(C=O)CC1 Amb614508 [0,1,0,1,0,0|0,0,2]=4 12723 B9R1.1 CC1CCC(=CBr)CC1 Amb22227652 [0,1,0,1,0,0|1,0,1]=4 12724 B9R1.1 CC1CCC(=CCl)CC1 Amb27858789 [0,1,0,1,0,0|1,0,1]=4 12725 B9R1.1 CC1CCC(C#N)CC1 Amb8950085 [0,1,0,1,0,0|1,0,1]=4 12726 B9R1.1 CC1CCC(C=O)CC1 Amb18642467 [0,1,0,1,0,0|0,0,0]=2 12727 B9R1.1 CC1CCC(C=O)CO1 Amb35732769 [0,1,0,1,0,0|1,0,0]=3 12728 B9R1.1 CC1CCC(C=O)OC1 Amb27827433 [0,1,0,1,0,0|1,0,0]=3 12729 B9R1.1 CC1CCC(CBr)CC1 Amb22886696 [0,1,0,1,0,0|1,0,1]=4 12730 B9R1.1 CC1CCC(CCl)CC1 Amb26498565 [0,1,0,1,0,0|1,0,1]=4 12731 B9R1.1 CC1CCC(CN)CC1 Amb8950179 [0,1,0,1,0,0|1,0,1]=4 12732 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [0,1,0,1,0,0|0,0,2]=4 12733 B9R1.1 CC1CCC(CS)CC1 Amb25188956 [0,1,0,1,0,0|0,1,1]=4 12734 B9R1.1 CC1CCC(NN)CC1 Amb20622555 [0,1,0,1,0,0|2,0,0]=4 12735 B9R1.1 CC1CCC(NN)CC1 Amb33552387 [0,1,0,1,0,0|2,0,0]=4 12736 B9R1.1 CC1CCC(NN)CC1 Amb6246744 [0,1,0,1,0,0|2,0,0]=4 12737 B9R1.1 CC1CCN(N=O)CC1 Amb24601452 [0,1,0,1,0,0|2,0,0]=4 12738 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [0,1,0,1,0,0|1,0,1]=4 12739 B9R1.1 CCC1CCC(Br)CC1 Amb8835445 [0,1,0,1,0,0|1,0,1]=4 12740 B9R1.1 CCC1CCC(C)CC1 Amb22227949 [0,1,0,1,0,0|1,0,1]=4 12741 B9R1.1 CCC1CCC(C)CN1 Amb27668440 [0,1,0,1,0,0|1,0,1]=4 12742 B9R1.1 CCC1CCC(C)NC1 Amb2782904 [0,1,0,1,0,0|2,0,0]=4 12743 B9R1.1 CCC1CCC(C)NC1 Amb28934993 [0,1,0,1,0,0|2,0,0]=4 12744 B9R1.1 CCC1CCC(N)CC1 Amb1117745 [0,1,0,1,0,0|1,0,1]=4 12745 B9R1.1 CCC1CCC(N)CC1 Amb32661500 [0,1,0,1,0,0|1,0,1]=4 12746 B9R1.1 CCC1CCC(N)CN1 Amb33275542 [0,1,0,1,0,0|1,0,1]=4 12747 B9R1.1 CCC1CCC(S)CC1 Amb9208051 [0,1,0,1,0,0|1,0,1]=4 12748 B9R1.1 CC[C@@H]1C=C[C@H](O)CC1 Amb27443552 [0,1,0,1,0,0|1,0,0]=3 12749 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb32665354 [0,1,0,1,0,0|2,0,0]=4 12750 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb33484385 [0,1,0,1,0,0|2,0,0]=4 12751 B9R1.1 CC[C@@H]1CC[C@H](C)NC1 Amb26423925 [0,1,0,1,0,0|2,0,0]=4 12752 B9R1.1 CC[C@H]1CCC(C)NC1 Amb28196699 [0,1,0,1,0,0|2,0,0]=4 12753 B9R1.1 CC[C@H]1CC[C@@H](C)CC1 Amb22230416 [0,1,0,1,0,0|1,0,1]=4 12754 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb26528612 [0,1,0,1,0,0|2,0,0]=4 12755 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb32652730 [0,1,0,1,0,0|2,0,0]=4 12756 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb27759922 [0,1,0,1,0,0|1,0,1]=4 12757 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb28935024 [0,1,0,1,0,0|1,0,1]=4 12758 B9R1.1 CC[C@H]1CC[C@H](O)CC1 Amb22231677 [0,1,0,1,0,0|1,0,1]=4 12759 B9R1.1 CN1CCC(C=O)CC1 Amb22394884 [0,1,0,1,0,0|1,0,0]=3 12760 B9R1.1 CN1CCC(C=O)CC1 Amb22587018 [0,1,0,1,0,0|1,0,0]=3 12761 B9R1.1 CN1CCC(C=O)CC1 Amb7808814 [0,1,0,1,0,0|1,0,0]=3 12762 B9R1.1 CN1CCN(C=O)CC1 Amb4017667 [0,1,0,1,0,0|2,0,0]=4 12763 B9R1.1 CNC1CCC(C)CC1 Amb33334646 [0,1,0,1,0,0|2,0,0]=4 12764 B9R1.1 CNC1CCC(C)CC1 Amb426857 [0,1,0,1,0,0|2,0,0]=4 12765 B9R1.1 CNC1CCC(N)CC1 Amb22728585 [0,1,0,1,0,0|2,0,0]=4 12766 B9R1.1 CNC1CCC(O)CC1 Amb18642719 [0,1,0,1,0,0|2,0,0]=4 12767 B9R1.1 CNC1CCC(O)CC1 Amb32729406 [0,1,0,1,0,0|2,0,0]=4 12768 B9R1.1 CN[C@H]1CC[C@@H](F)CC1 Amb34912787 [0,1,0,1,0,0|2,0,0]=4 12769 B9R1.1 CN[C@H]1CC[C@@H](O)CC1 Amb22744978 [0,1,0,1,0,0|2,0,0]=4 12770 B9R1.1 CN[C@H]1CC[C@@H](O)CC1 Amb22747298 [0,1,0,1,0,0|2,0,0]=4 12771 B9R1.1 CN[C@H]1CC[C@H](C)CC1 Amb24745527 [0,1,0,1,0,0|2,0,0]=4 12772 B9R1.1 CN[C@H]1CC[C@H](N)CC1 Amb25316801 [0,1,0,1,0,0|2,0,0]=4 12773 B9R1.1 CN[C@H]1CC[C@H](N)CC1 Amb30592989 [0,1,0,1,0,0|2,0,0]=4 12774 B9R1.1 CN[C@H]1CC[C@H](O)CC1 Amb22745615 [0,1,0,1,0,0|2,0,0]=4 12775 B9R1.1 CN[C@H]1CC[C@H](O)CC1 Amb30634178 [0,1,0,1,0,0|2,0,0]=4 12776 B9R1.1 COC1C=CC(Cl)CC1 Amb28285275 [0,1,0,1,0,0|2,0,0]=4 12777 B9R1.1 COC1C=CC(O)CC1 Amb27790233 [0,1,0,1,0,0|2,0,0]=4 12778 B9R1.1 COC1CCC(Br)CC1 Amb27214278 [0,1,0,1,0,0|2,0,0]=4 12779 B9R1.1 COC1CCC(C)CC1 Amb24323754 [0,1,0,1,0,0|2,0,0]=4 12780 B9R1.1 COC1CCC(I)CC1 Amb28288955 [0,1,0,1,0,0|2,0,0]=4 12781 B9R1.1 COC1CCC(N)CC1 Amb13894887 [0,1,0,1,0,0|2,0,0]=4 12782 B9R1.1 COC1CCC(N)CC1 Amb22728706 [0,1,0,1,0,0|2,0,0]=4 12783 B9R1.1 COC1CCC(O)CC1 Amb17593378 [0,1,0,1,0,0|2,0,0]=4 12784 B9R1.1 COC1CCC(S)CC1 Amb26857085 [0,1,0,1,0,0|2,0,0]=4 12785 B9R1.1 CO[C@@H]1C=C[C@H](O)CC1 Amb28077905 [0,1,0,1,0,0|2,0,0]=4 12786 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 Amb22748802 [0,1,0,1,0,0|2,0,0]=4 12787 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 Amb31291595 [0,1,0,1,0,0|2,0,0]=4 12788 B9R1.1 CO[C@H]1CC[C@@H](O)CC1 Amb24502360 [0,1,0,1,0,0|2,0,0]=4 12789 B9R1.1 CO[C@H]1CC[C@H](N)CC1 Amb22748743 [0,1,0,1,0,0|2,0,0]=4 12790 B9R1.1 CO[C@H]1CC[C@H](N)CC1 Amb22757189 [0,1,0,1,0,0|2,0,0]=4 12791 B9R1.1 CSC1C=CC(F)CC1 Amb25888675 [0,1,0,1,0,0|2,0,0]=4 12792 B9R1.1 CSC1CCC(N)CC1 Amb18948303 [0,1,0,1,0,0|2,0,0]=4 12793 B9R1.1 CS[C@H]1C=C[C@@H](F)CC1 Amb28239990 [0,1,0,1,0,0|2,0,0]=4 12794 B9R1.1 CS[C@H]1CC[C@@H](O)CC1 Amb15693040 [0,1,0,1,0,0|2,0,0]=4 12795 B9R1.1 C[C@H]1CC[C@@H](C=O)CC1 Amb27614173 [0,1,0,1,0,0|0,0,0]=2 12796 B9R1.1 C[C@H]1CC[C@@H](CBr)CC1 Amb27185733 [0,1,0,1,0,0|1,0,1]=4 12797 B9R1.1 C[C@H]1CC[C@@H](CO)CC1 Amb26407994 [0,1,0,1,0,0|0,0,2]=4 12798 B9R1.1 C[C@H]1CC[C@H](C=O)CC1 Amb25075627 [0,1,0,1,0,0|0,0,0]=2 12799 B9R1.1 C[C@H]1CC[C@H](CBr)CC1 Amb28458303 [0,1,0,1,0,0|1,0,1]=4 12800 B9R1.1 C[C@H]1CC[C@H](CN)CC1 Amb27393144 [0,1,0,1,0,0|1,0,1]=4 12801 B9R1.1 C[C@H]1CC[C@H](CO)CC1 Amb22886817 [0,1,0,1,0,0|0,0,2]=4 12802 B9R1.1 FC1CCC(CBr)CC1 Amb25970700 [0,1,0,1,0,0|1,0,1]=4 12803 B9R1.1 FC1CCC(CCl)CC1 Amb32943804 [0,1,0,1,0,0|1,0,1]=4 12804 B9R1.1 N#CC1CCC(N)CC1 Amb18832874 [0,1,0,1,0,0|1,0,1]=4 12805 B9R1.1 N#CC1CCC(N)CC1 Amb22899454 [0,1,0,1,0,0|1,0,1]=4 12806 B9R1.1 N#CC1CCC(O)CC1 Amb18642313 [0,1,0,1,0,0|1,0,1]=4 12807 B9R1.1 N#C[C@H]1CC[C@@H](N)CC1 Amb28988598 [0,1,0,1,0,0|1,0,1]=4 12808 B9R1.1 N#C[C@H]1CC[C@H](N)CC1 Amb27438875 [0,1,0,1,0,0|1,0,1]=4 12809 B9R1.1 N#C[C@H]1CC[C@H](N)CC1 Amb28988583 [0,1,0,1,0,0|1,0,1]=4 12810 B9R1.1 NC1CCC(=CF)CC1 Amb33330725 [0,1,0,1,0,0|1,0,1]=4 12811 B9R1.1 NC1CCC(CBr)CC1 Amb27877753 [0,1,0,1,0,0|1,0,1]=4 12812 B9R1.1 NC1CCC(CO)CC1 Amb6740014 [0,1,0,1,0,0|0,0,2]=4 12813 B9R1.1 NCC1CCC(Br)CC1 Amb28126926 [0,1,0,1,0,0|1,0,1]=4 12814 B9R1.1 NCC1CCC(Cl)CC1 Amb27466808 [0,1,0,1,0,0|1,0,1]=4 12815 B9R1.1 NCC1CCC(F)CC1 Amb24122686 [0,1,0,1,0,0|1,0,1]=4 12816 B9R1.1 NCC1CCC(F)CC1 Amb25727264 [0,1,0,1,0,0|1,0,1]=4 12817 B9R1.1 NCC1CCC(N)CC1 Amb16233730 [0,1,0,1,0,0|1,0,1]=4 12818 B9R1.1 NCC1CCC(N)CC1 Amb22491656 [0,1,0,1,0,0|1,0,1]=4 12819 B9R1.1 NCC1CCC(O)CC1 Amb20669423 [0,1,0,1,0,0|1,0,1]=4 12820 B9R1.1 NCC1CCC(O)CC1 Amb25930193 [0,1,0,1,0,0|1,0,1]=4 12821 B9R1.1 NC[C@H]1CC[C@@H](F)CC1 Amb34913163 [0,1,0,1,0,0|1,0,1]=4 12822 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb24183403 [0,1,0,1,0,0|1,0,1]=4 12823 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb25323044 [0,1,0,1,0,0|1,0,1]=4 12824 B9R1.1 NC[C@H]1CC[C@H](F)CC1 Amb34913161 [0,1,0,1,0,0|1,0,1]=4 12825 B9R1.1 NC[C@H]1CC[C@H](O)CC1 Amb23439293 [0,1,0,1,0,0|1,0,1]=4 12826 B9R1.1 NC[C@H]1CC[C@H](O)CC1 Amb25075878 [0,1,0,1,0,0|1,0,1]=4 12827 B9R1.1 NOC1CCC(N)CC1 Amb25124078 [0,1,0,1,0,0|2,0,0]=4 12828 B9R1.1 NO[C@H]1CC[C@@H](N)CC1 Amb28290724 [0,1,0,1,0,0|2,0,0]=4 12829 B9R1.1 NO[C@H]1CC[C@H](N)CC1 Amb27789319 [0,1,0,1,0,0|2,0,0]=4 12830 B9R1.1 N[C@@H]1C=C[C@H](CO)CC1 Amb24649717 [0,1,0,1,0,0|2,0,0]=4 12831 B9R1.1 N[C@H]1C=C[C@@H](CO)CC1 Amb24443345 [0,1,0,1,0,0|2,0,0]=4 12832 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb20668772 [0,1,0,1,0,0|0,0,2]=4 12833 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb22899692 [0,1,0,1,0,0|0,0,2]=4 12834 B9R1.1 N[C@H]1CC[C@H](CCl)CC1 Amb28341749 [0,1,0,1,0,0|1,0,1]=4 12835 B9R1.1 N[C@H]1CC[C@H](CF)CC1 Amb34913064 [0,1,0,1,0,0|1,0,1]=4 12836 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb17607961 [0,1,0,1,0,0|0,0,2]=4 12837 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb22747955 [0,1,0,1,0,0|0,0,2]=4 12838 B9R1.1 O=CC1CC=C(Cl)CC1 Amb18124712 [0,1,0,1,0,0|0,0,2]=4 12839 B9R1.1 O=CC1CCC(=O)CC1 Amb8385725 [0,1,0,1,0,0|0,0,1]=3 12840 B9R1.1 O=CC1CCC(F)CC1 Amb27795353 [0,1,0,1,0,0|0,0,0]=2 12841 B9R1.1 O=CC1CCC(O)CC1 Amb26974592 [0,1,0,1,0,0|0,0,0]=2 12842 B9R1.1 O=CC1CCS(=O)CC1 Amb28285176 [0,1,0,1,0,0|1,0,0]=3 12843 B9R1.1 O=CN1CCC(=O)CC1 Amb33545539 [0,1,0,1,0,0|1,0,1]=4 12844 B9R1.1 O=CN1CCC(F)CC1 Amb29876085 [0,1,0,1,0,0|1,0,0]=3 12845 B9R1.1 O=CN1CCC(O)CC1 Amb7172607 [0,1,0,1,0,0|1,0,0]=3 12846 B9R1.1 O=CN1CCC(S)CC1 Amb25806120 [0,1,0,1,0,0|1,0,0]=3 12847 B9R1.1 O=CN1CCN(O)CC1 Amb25887460 [0,1,0,1,0,0|2,0,0]=4 12848 B9R1.1 O=C[C@H]1CC[C@H](O)CC1 Amb27799758 [0,1,0,1,0,0|0,0,0]=2 12849 B9R1.1 OC1CCC(=CBr)CC1 Amb27766273 [0,1,0,1,0,0|1,0,1]=4 12850 B9R1.1 OC1CCC(CCl)CC1 Amb24480360 [0,1,0,1,0,0|1,0,1]=4 12851 B9R1.1 OC1CCC(CI)CC1 Amb25728551 [0,1,0,1,0,0|1,0,1]=4 12852 B9R1.1 OC1CCN(C=S)CC1 Amb28435800 [0,1,0,1,0,0|1,1,0]=4 12853 B9R1.1 OCC1CCC(F)CC1 Amb24122685 [0,1,0,1,0,0|0,0,2]=4 12854 B9R1.1 OCC1CCC(O)CC1 Amb13883568 [0,1,0,1,0,0|0,0,2]=4 12855 B9R1.1 OC[C@H]1CC[C@@H](F)CC1 Amb34163407 [0,1,0,1,0,0|0,0,2]=4 12856 B9R1.1 OC[C@H]1CC[C@@H](O)CC1 Amb26345146 [0,1,0,1,0,0|0,0,2]=4 12857 B9R1.1 OC[C@H]1CC[C@H](F)CC1 Amb34165509 [0,1,0,1,0,0|0,0,2]=4 12858 B9R1.1 OC[C@H]1CC[C@H](O)CC1 Amb25320791 [0,1,0,1,0,0|0,0,2]=4 12859 B9R1.1 [C-]#[N+]C1CCC(C)CC1 Amb32732134 [0,1,0,1,0,0|2,0,0]=4 12860 B9R1.1 [C-]#[N+]C1CCC(O)CC1 Amb28077888 [0,1,0,1,0,0|2,0,0]=4 12861 B9R1.1 [C-]#[N+][C@H]1CC[C@H](C)CC1 Amb33747258 [0,1,0,1,0,0|2,0,0]=4 12862 B9R1.3 C=C1C(=O)CCC[C@@H]1C Amb27838735 [0,1,0,1,0,0|0,0,2]=4 12863 B9R1.3 C=C1CCCC(C)C1C Amb27262099 [0,1,0,1,0,0|1,0,0]=3 12864 B9R1.3 C=C1CCCC(C)C1O Amb27207403 [0,1,0,1,0,0|2,0,0]=4 12865 B9R1.3 C=C1CCCN(C)C1=O Amb522206 [0,1,0,1,0,0|1,0,1]=4 12866 B9R1.3 C=C1[C@@H](C)CCC[C@H]1C Amb22230413 [0,1,0,1,0,0|1,0,0]=3 12867 B9R1.3 C=C1[C@H](C)CCC[C@H]1C Amb24499561 [0,1,0,1,0,0|1,0,0]=3 12868 B9R1.3 CC1=C(Br)C(O)CCC1 Amb25811521 [0,1,0,1,0,0|1,0,1]=4 12869 B9R1.3 CC1=C(Br)[C@H](O)CCC1 Amb27772139 [0,1,0,1,0,0|1,0,1]=4 12870 B9R1.3 CC1=C(C)C(=O)CCC1 Amb17593288 [0,1,0,1,0,0|0,0,2]=4 12871 B9R1.3 CC1=C(C)C(Br)CCC1 Amb27862157 [0,1,0,1,0,0|1,0,1]=4 12872 B9R1.3 CC1=C(C)C(O)CCC1 Amb27450753 [0,1,0,1,0,0|1,0,1]=4 12873 B9R1.3 CC1=C(C)[C@H](O)CCC1 Amb27399340 [0,1,0,1,0,0|1,0,1]=4 12874 B9R1.3 CC1=C(Cl)CCCC1=O Amb4036614 [0,1,0,1,0,0|0,0,2]=4 12875 B9R1.3 CC1=C(Cl)CCCC1O Amb10552852 [0,1,0,1,0,0|1,0,1]=4 12876 B9R1.3 CC1=C(N)CCCC1=O Amb27798039 [0,1,0,1,0,0|0,0,2]=4 12877 B9R1.3 CC1=C(O)CCCC1=O Amb25147218 [0,1,0,1,0,0|0,0,2]=4 12878 B9R1.3 CC1=CCCC(C)C1=O Amb17593286 [0,1,0,1,0,0|0,0,2]=4 12879 B9R1.3 CC1C(=O)CCCC1=O Amb3993683 [0,1,0,1,0,0|0,0,1]=3 12880 B9R1.3 CC1C(=O)CCCN1C Amb28253362 [0,1,0,1,0,0|1,0,0]=3 12881 B9R1.3 CC1C(=O)CCC[C@H]1C Amb27951545 [0,1,0,1,0,0|0,0,0]=2 12882 B9R1.3 CC1C(=O)CCNC1=O Amb25220145 [0,1,0,1,0,0|1,0,1]=4 12883 B9R1.3 CC1C(=O)CSCC1=O Amb27199104 [0,1,0,1,0,0|1,0,1]=4 12884 B9R1.3 CC1C(=O)NCCC1O Amb27836723 [0,1,0,1,0,0|1,0,0]=3 12885 B9R1.3 CC1C(=O)NCCN1C Amb19723393 [0,1,0,1,0,0|2,0,0]=4 12886 B9R1.3 CC1C(N)CCCC1N Amb27180055 [0,1,0,1,0,0|1,0,1]=4 12887 B9R1.3 CC1C(N)CCCN1C Amb18203236 [0,1,0,1,0,0|2,0,0]=4 12888 B9R1.3 CC1C(O)CCCN1C Amb27481456 [0,1,0,1,0,0|2,0,0]=4 12889 B9R1.3 CC1C=CCC(=O)C1C Amb28245024 [0,1,0,1,0,0|0,0,2]=4 12890 B9R1.3 CC1CC=CC(=O)C1C Amb27838646 [0,1,0,1,0,0|0,0,2]=4 12891 B9R1.3 CC1CCCC(=O)C1Br Amb24355950 [0,1,0,1,0,0|1,0,0]=3 12892 B9R1.3 CC1CCCC(=O)C1C Amb27593439 [0,1,0,1,0,0|0,0,0]=2 12893 B9R1.3 CC1CCCC(=O)C1F Amb28381160 [0,1,0,1,0,0|1,0,0]=3 12894 B9R1.3 CC1CCCC(=O)C1O Amb27838796 [0,1,0,1,0,0|1,0,0]=3 12895 B9R1.3 CC1CCCC(Br)C1O Amb24601208 [0,1,0,1,0,0|0,0,2]=4 12896 B9R1.3 CC1CCCC(C)C1=O Amb9702826 [0,1,0,1,0,0|0,0,0]=2 12897 B9R1.3 CC1CCCC(C)C1Br Amb8835441 [0,1,0,1,0,0|1,0,1]=4 12898 B9R1.3 CC1CCCC(C)C1C Amb22227691 [0,1,0,1,0,0|1,0,1]=4 12899 B9R1.3 CC1CCCC(C)C1N Amb6892747 [0,1,0,1,0,0|1,0,1]=4 12900 B9R1.3 CC1CCCC(C)C1N Amb9705390 [0,1,0,1,0,0|1,0,1]=4 12901 B9R1.3 CC1CCCC(C)C1O Amb2227580 [0,1,0,1,0,0|0,0,2]=4 12902 B9R1.3 CC1CCCC(C)C1S Amb9208048 [0,1,0,1,0,0|0,1,1]=4 12903 B9R1.3 CC1CCCC(C)N1N Amb9703083 [0,1,0,1,0,0|2,0,0]=4 12904 B9R1.3 CC1CCCC(Cl)C1O Amb24539273 [0,1,0,1,0,0|0,0,2]=4 12905 B9R1.3 CC1CCCC(F)C1=O Amb24400707 [0,1,0,1,0,0|0,0,0]=2 12906 B9R1.3 CC1CCCC(F)C1N Amb24650619 [0,1,0,1,0,0|1,0,1]=4 12907 B9R1.3 CC1CCCC(N)C1C Amb3939985 [0,1,0,1,0,0|1,0,1]=4 12908 B9R1.3 CC1CCCC(O)C1C Amb9825841 [0,1,0,1,0,0|0,0,2]=4 12909 B9R1.3 CC1CCCC(S)C1C Amb25731166 [0,1,0,1,0,0|0,1,1]=4 12910 B9R1.3 CC1CCC[C@@H](C)C1=O Amb27262957 [0,1,0,1,0,0|0,0,0]=2 12911 B9R1.3 CC1CCC[C@@H](O)[C@@H]1N Amb27636307 [0,1,0,1,0,0|1,0,1]=4 12912 B9R1.3 CC1CCC[C@@H](O)[C@@H]1O Amb28318183 [0,1,0,1,0,0|0,0,2]=4 12913 B9R1.3 CC1CCC[C@H](Cl)C1=O Amb28388615 [0,1,0,1,0,0|0,0,0]=2 12914 B9R1.3 CC1CCC[C@H](O)[C@@H]1O Amb27844355 [0,1,0,1,0,0|0,0,2]=4 12915 B9R1.3 CC1CCNC(=O)C1Br Amb27658951 [0,1,0,1,0,0|2,0,0]=4 12916 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,1,0,0|2,0,0]=4 12917 B9R1.3 CC1CNCC(=O)N1C Amb25840155 [0,1,0,1,0,0|2,0,0]=4 12918 B9R1.3 CC1CNCC(=O)N1C Amb33527005 [0,1,0,1,0,0|2,0,0]=4 12919 B9R1.3 CC1CNCC(C)C1=O Amb24351098 [0,1,0,1,0,0|1,0,0]=3 12920 B9R1.3 CC1CNCC(C)C1=O Amb32666719 [0,1,0,1,0,0|1,0,0]=3 12921 B9R1.3 CC1CNCC(C)S1=O Amb27185798 [0,1,0,1,0,0|2,0,0]=4 12922 B9R1.3 CC1CNCC(C)S1=O Amb28555358 [0,1,0,1,0,0|2,0,0]=4 12923 B9R1.3 CC1COCC(C)C1=O Amb22299425 [0,1,0,1,0,0|1,0,0]=3 12924 B9R1.3 CC1CSCC(C)C1=O Amb28321902 [0,1,0,1,0,0|1,0,0]=3 12925 B9R1.3 CC1NCCC(=O)C1C Amb18642528 [0,1,0,1,0,0|1,0,0]=3 12926 B9R1.3 CC1NCCN(C)C1=O Amb10607449 [0,1,0,1,0,0|2,0,0]=4 12927 B9R1.3 CC1NCCN(C)C1=O Amb22499042 [0,1,0,1,0,0|2,0,0]=4 12928 B9R1.3 CC1NCCS(=O)C1C Amb19514961 [0,1,0,1,0,0|2,0,0]=4 12929 B9R1.3 CC1NCCS(=O)C1C Amb33379115 [0,1,0,1,0,0|2,0,0]=4 12930 B9R1.3 CC1OCCC(=O)C1C Amb33715158 [0,1,0,1,0,0|1,0,0]=3 12931 B9R1.3 CC1[C@H](C)CCC[C@H]1C Amb27493255 [0,1,0,1,0,0|1,0,1]=4 12932 B9R1.3 CN1C(=O)CCCC1=O Amb22757472 [0,1,0,1,0,0|1,0,1]=4 12933 B9R1.3 CN1C(=O)CCCC1N Amb28285249 [0,1,0,1,0,0|1,0,0]=3 12934 B9R1.3 CN1CCCC(=O)C1=O Amb33547367 [0,1,0,1,0,0|1,0,1]=4 12935 B9R1.3 CN1CCCC(Br)C1=O Amb25924539 [0,1,0,1,0,0|1,0,0]=3 12936 B9R1.3 CN1CCCC(N)C1=O Amb23440176 [0,1,0,1,0,0|1,0,0]=3 12937 B9R1.3 CN1CCCC(N)C1=O Amb33536522 [0,1,0,1,0,0|1,0,0]=3 12938 B9R1.3 CN1CCCC(O)C1=O Amb17593360 [0,1,0,1,0,0|1,0,0]=3 12939 B9R1.3 CN1CCCN(C)C1=O Amb24054545 [0,1,0,1,0,0|2,0,0]=4 12940 B9R1.3 CN1CCCN(C)C1=O Amb32674663 [0,1,0,1,0,0|2,0,0]=4 12941 B9R1.3 CN1CCCN(C)C1=O Amb8514675 [0,1,0,1,0,0|2,0,0]=4 12942 B9R1.3 CN1CCCN(N)C1=O Amb28249480 [0,1,0,1,0,0|2,0,0]=4 12943 B9R1.3 CN1CCC[C@@H](N)C1=O Amb22745485 [0,1,0,1,0,0|1,0,0]=3 12944 B9R1.3 CN1CCC[C@@H](N)C1=O Amb25709654 [0,1,0,1,0,0|1,0,0]=3 12945 B9R1.3 CN1CCC[C@@H](O)C1=O Amb27250591 [0,1,0,1,0,0|1,0,0]=3 12946 B9R1.3 CN1CCC[C@H](N)C1=O Amb26503808 [0,1,0,1,0,0|1,0,0]=3 12947 B9R1.3 CN1CCC[C@H](N)C1=O Amb33801269 [0,1,0,1,0,0|1,0,0]=3 12948 B9R1.3 CN1CCOC(O)C1=O Amb28315417 [0,1,0,1,0,0|2,0,0]=4 12949 B9R1.3 CN1OCCC(Br)C1=O Amb28458375 [0,1,0,1,0,0|2,0,0]=4 12950 B9R1.3 C[C@@H]1C(=O)C=CC[C@H]1C Amb28054028 [0,1,0,1,0,0|0,0,2]=4 12951 B9R1.3 C[C@@H]1C(=O)CCC[C@@H]1N Amb27818101 [0,1,0,1,0,0|0,0,0]=2 12952 B9R1.3 C[C@@H]1C(O)CCC[C@H]1C Amb27451971 [0,1,0,1,0,0|0,0,2]=4 12953 B9R1.3 C[C@@H]1CCCC(=O)C1F Amb27802756 [0,1,0,1,0,0|1,0,0]=3 12954 B9R1.3 C[C@@H]1CCCC(=O)[C@H]1F Amb28324355 [0,1,0,1,0,0|1,0,0]=3 12955 B9R1.3 C[C@@H]1CCCC(O)[C@@H]1C Amb27664284 [0,1,0,1,0,0|0,0,2]=4 12956 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1C Amb27876256 [0,1,0,1,0,0|0,0,2]=4 12957 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1O Amb28320895 [0,1,0,1,0,0|0,0,2]=4 12958 B9R1.3 C[C@@H]1CCC[C@H](N)[C@@H]1C Amb28055489 [0,1,0,1,0,0|1,0,1]=4 12959 B9R1.3 C[C@@H]1CCC[C@H](O)C1O Amb27198139 [0,1,0,1,0,0|0,0,2]=4 12960 B9R1.3 C[C@@H]1CCOC(=O)[C@H]1O Amb27197166 [0,1,0,1,0,0|2,0,0]=4 12961 B9R1.3 C[C@@H]1CNCC(=O)N1C Amb23385273 [0,1,0,1,0,0|2,0,0]=4 12962 B9R1.3 C[C@@H]1CNCC(=O)N1C Amb27838533 [0,1,0,1,0,0|2,0,0]=4 12963 B9R1.3 C[C@@H]1CNC[C@@H](C)C1=O Amb32666988 [0,1,0,1,0,0|1,0,0]=3 12964 B9R1.3 C[C@@H]1CNC[C@@H](C)C1=O Amb32666990 [0,1,0,1,0,0|1,0,0]=3 12965 B9R1.3 C[C@@H]1NCCC(=O)[C@H]1C Amb27967343 [0,1,0,1,0,0|1,0,0]=3 12966 B9R1.3 C[C@@H]1NCCN(C)C1=O Amb26991383 [0,1,0,1,0,0|2,0,0]=4 12967 B9R1.3 C[C@@H]1NCCN(C)C1=O Amb33716075 [0,1,0,1,0,0|2,0,0]=4 12968 B9R1.3 C[C@@H]1[C@@H](O)CCC[C@H]1O Amb27805899 [0,1,0,1,0,0|0,0,2]=4 12969 B9R1.3 C[C@H]1C=CCC(=O)[C@H]1C Amb27441703 [0,1,0,1,0,0|0,0,2]=4 12970 B9R1.3 C[C@H]1CC=CC(=O)[C@H]1C Amb27441720 [0,1,0,1,0,0|0,0,2]=4 12971 B9R1.3 C[C@H]1CCCC(=O)[C@@H]1C Amb27432624 [0,1,0,1,0,0|0,0,0]=2 12972 B9R1.3 C[C@H]1CCC[C@@H](Br)C1=O Amb28132271 [0,1,0,1,0,0|0,0,0]=2 12973 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1C Amb25245256 [0,1,0,1,0,0|1,0,1]=4 12974 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1O Amb28350332 [0,1,0,1,0,0|0,0,2]=4 12975 B9R1.3 C[C@H]1CCC[C@@H](F)[C@@H]1N Amb27778713 [0,1,0,1,0,0|1,0,1]=4 12976 B9R1.3 C[C@H]1CCC[C@@H](N)[C@@H]1O Amb28252463 [0,1,0,1,0,0|0,0,2]=4 12977 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1C Amb27253637 [0,1,0,1,0,0|1,0,1]=4 12978 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1N Amb27215993 [0,1,0,1,0,0|1,0,1]=4 12979 B9R1.3 C[C@H]1CCC[C@@H](O)[C@@H]1O Amb27186925 [0,1,0,1,0,0|0,0,2]=4 12980 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1C Amb27980719 [0,1,0,1,0,0|0,0,2]=4 12981 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1O Amb27647956 [0,1,0,1,0,0|0,0,2]=4 12982 B9R1.3 C[C@H]1CCC[C@H](C)C1N Amb27860934 [0,1,0,1,0,0|1,0,1]=4 12983 B9R1.3 C[C@H]1CCC[C@H](C)C1O Amb27196772 [0,1,0,1,0,0|0,0,2]=4 12984 B9R1.3 C[C@H]1CCC[C@H](F)C1=O Amb28202070 [0,1,0,1,0,0|0,0,0]=2 12985 B9R1.3 C[C@H]1CCC[C@H](O)[C@@H]1O Amb27844257 [0,1,0,1,0,0|0,0,2]=4 12986 B9R1.3 C[C@H]1CCOC(=O)[C@@H]1O Amb27196773 [0,1,0,1,0,0|2,0,0]=4 12987 B9R1.3 C[C@H]1CNCC(=O)N1C Amb23385254 [0,1,0,1,0,0|2,0,0]=4 12988 B9R1.3 C[C@H]1CNC[C@@H](C)C1=O Amb27784954 [0,1,0,1,0,0|1,0,0]=3 12989 B9R1.3 C[C@H]1NCCN(C)C1=O Amb26503872 [0,1,0,1,0,0|2,0,0]=4 12990 B9R1.3 C[C@H]1NCCN(C)C1=O Amb28993779 [0,1,0,1,0,0|2,0,0]=4 12991 B9R1.3 C[C@H]1[C@@H](O)CCC[C@H]1O Amb27665271 [0,1,0,1,0,0|0,0,2]=4 12992 B9R1.3 C[C@H]1[C@H](C)CCC[C@H]1N Amb28055501 [0,1,0,1,0,0|1,0,1]=4 12993 B9R1.3 C[C@H]1[C@H](O)CCCN1C Amb27197524 [0,1,0,1,0,0|2,0,0]=4 12994 B9R1.3 NC1CCCC(=O)C1=O Amb28042602 [0,1,0,1,0,0|1,0,1]=4 12995 B9R1.3 NC1CCCN(O)C1=O Amb25062670 [0,1,0,1,0,0|2,0,0]=4 12996 B9R1.3 NC1CCNC(N)C1=O Amb27644630 [0,1,0,1,0,0|2,0,0]=4 12997 B9R1.3 N[C@@H]1CCCN(O)C1=O Amb28254924 [0,1,0,1,0,0|2,0,0]=4 12998 B9R1.3 N[C@H]1CCCN(O)C1=O Amb27759969 [0,1,0,1,0,0|2,0,0]=4 12999 B9R1.3 O=C1C(Cl)CCCC1Cl Amb24480185 [0,1,0,1,0,0|1,0,0]=3 13000 B9R1.3 O=C1C(F)CCCC1Cl Amb28285276 [0,1,0,1,0,0|1,0,0]=3 13001 B9R1.3 O=C1C(O)CCCC1Br Amb27483787 [0,1,0,1,0,0|1,0,0]=3 13002 B9R1.3 O=C1C(O)COCC1O Amb27221993 [0,1,0,1,0,0|2,0,0]=4 13003 B9R1.3 O=C1CCCC(=O)C1Br Amb33527290 [0,1,0,1,0,0|1,0,1]=4 13004 B9R1.3 O=C1CCCC(=O)C1Cl Amb25726716 [0,1,0,1,0,0|1,0,1]=4 13005 B9R1.3 O=C1CCCC(Br)C1=O Amb27866033 [0,1,0,1,0,0|1,0,1]=4 13006 B9R1.3 O=C1CCCC(Br)C1O Amb27858762 [0,1,0,1,0,0|1,0,0]=3 13007 B9R1.3 O=C1CCCC(Cl)C1Br Amb26624735 [0,1,0,1,0,0|1,0,0]=3 13008 B9R1.3 O=C1CCCC(F)C1Br Amb25840986 [0,1,0,1,0,0|1,0,0]=3 13009 B9R1.3 O=C1CCC[C@H](Br)[C@@H]1O Amb27974655 [0,1,0,1,0,0|1,0,0]=3 13010 B9R1.3 O=C1NCC[C@@H](O)[C@@H]1O Amb28057700 [0,1,0,1,0,0|2,0,0]=4 13011 B9R1.3 O=C1NCC[C@H](O)[C@@H]1O Amb27202725 [0,1,0,1,0,0|2,0,0]=4 13012 B9R1.3 O=C1[C@@H](Cl)CCC[C@H]1Cl Amb27771094 [0,1,0,1,0,0|1,0,0]=3 13013 B9R1.3 O=C1[C@@H](F)CCC[C@H]1Br Amb27253622 [0,1,0,1,0,0|1,0,0]=3 13014 B9R1.3 O=C1[C@@H](F)CCC[C@H]1F Amb27836851 [0,1,0,1,0,0|1,0,0]=3 13015 B9R1.3 O=C1[C@H](Cl)CCC[C@H]1Br Amb27630665 [0,1,0,1,0,0|1,0,0]=3 13016 B9R1.3 O=C1[C@H](F)CCC[C@H]1F Amb27489318 [0,1,0,1,0,0|1,0,0]=3 13017 B9R1.3 O=C1[C@H](O)CCC[C@H]1O Amb28052305 [0,1,0,1,0,0|1,0,0]=3 13018 B9R1.3 O=S1C(Cl)CCCC1Cl Amb28396504 [0,1,0,1,0,0|2,0,0]=4 13019 B9R1.11 C#CC(C)C1CCCC1 Amb33169161 [0,1,0,1,0,0|1,0,1]=4 13020 B9R1.11 C#C[C@H](O)C1CCCC1 Amb28071761 [0,1,0,1,0,0|1,0,1]=4 13021 B9R1.11 C=CC(=O)C1CCCC1 Amb25180831 [0,1,0,1,0,0|1,0,1]=4 13022 B9R1.11 C=CC(C)C1CCNC1 Amb27268076 [0,1,0,1,0,0|2,0,0]=4 13023 B9R1.11 C=CC(N)C1CCCS1 Amb27424734 [0,1,0,1,0,0|2,0,0]=4 13024 B9R1.11 C=CC(O)C1CCCC1 Amb20620887 [0,1,0,1,0,0|1,0,0]=3 13025 B9R1.11 C=CC(O)C1CCCO1 Amb25880178 [0,1,0,1,0,0|2,0,0]=4 13026 B9R1.11 C=CC(O)C1CCCS1 Amb24429242 [0,1,0,1,0,0|2,0,0]=4 13027 B9R1.11 C=CC(O)C1CCNC1 Amb35583664 [0,1,0,1,0,0|2,0,0]=4 13028 B9R1.11 C=CC(O)C1CCOC1 Amb27401047 [0,1,0,1,0,0|2,0,0]=4 13029 B9R1.11 C=CC(O)C1CCSC1 Amb26321763 [0,1,0,1,0,0|2,0,0]=4 13030 B9R1.11 C=CC(O)[C@@H]1CCNC1 Amb30039165 [0,1,0,1,0,0|2,0,0]=4 13031 B9R1.11 C=CC(O)[C@H]1CCCN1 Amb30039307 [0,1,0,1,0,0|2,0,0]=4 13032 B9R1.11 C=CC(O)[C@H]1CCNC1 Amb35662319 [0,1,0,1,0,0|2,0,0]=4 13033 B9R1.11 CC(C#N)C1CCCC1 Amb25714069 [0,1,0,1,0,0|1,0,1]=4 13034 B9R1.11 CC(C=O)C1CCCC1 Amb20668888 [0,1,0,1,0,0|0,0,0]=2 13035 B9R1.11 CC(C=O)C1CCCO1 Amb18642610 [0,1,0,1,0,0|1,0,0]=3 13036 B9R1.11 CC(C=O)C1CCCS1 Amb33415663 [0,1,0,1,0,0|1,0,0]=3 13037 B9R1.11 CC(C=O)C1CCOC1 Amb24429348 [0,1,0,1,0,0|1,0,0]=3 13038 B9R1.11 CC(C=O)C1CCSC1 Amb27637383 [0,1,0,1,0,0|1,0,0]=3 13039 B9R1.11 CC(C=O)C1OCCO1 Amb27268508 [0,1,0,1,0,0|2,0,0]=4 13040 B9R1.11 CC(CBr)C1CCCC1 Amb24478814 [0,1,0,1,0,0|1,0,1]=4 13041 B9R1.11 CC(CCl)C1CCCC1 Amb25327474 [0,1,0,1,0,0|1,0,1]=4 13042 B9R1.11 CC(CN)C1CCCC1 Amb17087397 [0,1,0,1,0,0|1,0,1]=4 13043 B9R1.11 CC(CO)C1CCCC1 Amb25997168 [0,1,0,1,0,0|0,0,2]=4 13044 B9R1.11 CC(NN)C1CCCC1 Amb25303294 [0,1,0,1,0,0|2,0,0]=4 13045 B9R1.11 CC(ON)C1CCCC1 Amb33315755 [0,1,0,1,0,0|2,0,0]=4 13046 B9R1.11 CCC(Br)C1CCOC1 Amb27218082 [0,1,0,1,0,0|2,0,0]=4 13047 B9R1.11 CCC(C)C1C=CCN1 Amb27830943 [0,1,0,1,0,0|2,0,0]=4 13048 B9R1.11 CCC(C)C1CCCC1 Amb17689395 [0,1,0,1,0,0|1,0,1]=4 13049 B9R1.11 CCC(C)C1CCCN1 Amb35789368 [0,1,0,1,0,0|1,0,1]=4 13050 B9R1.11 CCC(C)C1CCCN1 Amb9714968 [0,1,0,1,0,0|1,0,1]=4 13051 B9R1.11 CCC(C)C1CCNC1 Amb18960091 [0,1,0,1,0,0|2,0,0]=4 13052 B9R1.11 CCC(F)C1CCNC1 Amb28323474 [0,1,0,1,0,0|2,0,0]=4 13053 B9R1.11 CCC(N)C1CCCC1 Amb18281187 [0,1,0,1,0,0|1,0,1]=4 13054 B9R1.11 CCC(N)C1CCCN1 Amb26918433 [0,1,0,1,0,0|1,0,1]=4 13055 B9R1.11 CCC(N)C1CCCO1 Amb22059669 [0,1,0,1,0,0|0,0,2]=4 13056 B9R1.11 CCC(N)C1CCCS1 Amb27202616 [0,1,0,1,0,0|0,1,1]=4 13057 B9R1.11 CCC(N)C1CCOC1 Amb19148914 [0,1,0,1,0,0|2,0,0]=4 13058 B9R1.11 CCC(O)C1CCCN1 Amb17231861 [0,1,0,1,0,0|1,0,1]=4 13059 B9R1.11 CCC(O)C1CCOC1 Amb25189066 [0,1,0,1,0,0|2,0,0]=4 13060 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb28340949 [0,1,0,1,0,0|1,0,1]=4 13061 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb33734033 [0,1,0,1,0,0|1,0,1]=4 13062 B9R1.11 CCC(O)[C@@H]1CCNC1 Amb35659567 [0,1,0,1,0,0|2,0,0]=4 13063 B9R1.11 CCC(O)[C@H]1CCCN1 Amb29891705 [0,1,0,1,0,0|1,0,1]=4 13064 B9R1.11 CCC(O)[C@H]1CCCN1 Amb33734032 [0,1,0,1,0,0|1,0,1]=4 13065 B9R1.11 CCC(O)[C@H]1CCCO1 Amb28435654 [0,1,0,1,0,0|0,0,2]=4 13066 B9R1.11 CCC(O)[C@H]1CCNC1 Amb35662398 [0,1,0,1,0,0|2,0,0]=4 13067 B9R1.11 CCC(S)C1CCCC1 Amb25984964 [0,1,0,1,0,0|1,0,1]=4 13068 B9R1.11 CCC(S)C1CCOC1 Amb27241602 [0,1,0,1,0,0|2,0,0]=4 13069 B9R1.11 CC[C@@H](N)C1CCCO1 Amb27838765 [0,1,0,1,0,0|0,0,2]=4 13070 B9R1.11 CC[C@@H](N)C1CCSC1 Amb29863040 [0,1,0,1,0,0|2,0,0]=4 13071 B9R1.11 CC[C@@H](O)C1CCOC1 Amb26318285 [0,1,0,1,0,0|2,0,0]=4 13072 B9R1.11 CC[C@@H](O)[C@@H]1CCCO1 Amb27463124 [0,1,0,1,0,0|0,0,2]=4 13073 B9R1.11 CC[C@@H](O)[C@H]1CCCO1 Amb27980675 [0,1,0,1,0,0|0,0,2]=4 13074 B9R1.11 CC[C@H](N)C1CCCC1 Amb27436954 [0,1,0,1,0,0|1,0,1]=4 13075 B9R1.11 CC[C@H](N)C1CCSC1 Amb35717414 [0,1,0,1,0,0|2,0,0]=4 13076 B9R1.11 CC[C@H](O)C1CCCC1 Amb27758989 [0,1,0,1,0,0|1,0,1]=4 13077 B9R1.11 CC[C@H](O)C1CCCO1 Amb27815999 [0,1,0,1,0,0|0,0,2]=4 13078 B9R1.11 CC[C@H](O)C1CCOC1 Amb27645117 [0,1,0,1,0,0|2,0,0]=4 13079 B9R1.11 CC[C@H](O)[C@H]1CCCO1 Amb27432283 [0,1,0,1,0,0|0,0,2]=4 13080 B9R1.11 CN(C=O)C1CCCC1 Amb17939454 [0,1,0,1,0,0|1,0,0]=3 13081 B9R1.11 CN[C@@H](C)C1CCCC1 Amb27806619 [0,1,0,1,0,0|2,0,0]=4 13082 B9R1.11 CN[C@H](C)C1CCCC1 Amb27838543 [0,1,0,1,0,0|2,0,0]=4 13083 B9R1.11 CSC(C)C1CCCC1 Amb27854119 [0,1,0,1,0,0|2,0,0]=4 13084 B9R1.11 C[C@@H](CN)C1CCCC1 Amb33731705 [0,1,0,1,0,0|1,0,1]=4 13085 B9R1.11 C[C@@H](CO)C1CCCC1 Amb33741046 [0,1,0,1,0,0|0,0,2]=4 13086 B9R1.11 C[C@H](CN)C1CCCC1 Amb33736881 [0,1,0,1,0,0|1,0,1]=4 13087 B9R1.11 C[C@H](CO)C1CCCC1 Amb33748466 [0,1,0,1,0,0|0,0,2]=4 13088 B9R1.11 N#CC(Br)C1CCCC1 Amb26629104 [0,1,0,1,0,0|1,0,1]=4 13089 B9R1.11 N#CC(N)C1CCCC1 Amb18946553 [0,1,0,1,0,0|1,0,1]=4 13090 B9R1.11 N#CC(N)C1CCCC1 Amb20623978 [0,1,0,1,0,0|1,0,1]=4 13091 B9R1.11 N#CC(O)C1CCCC1 Amb20622608 [0,1,0,1,0,0|1,0,1]=4 13092 B9R1.11 NC(CCl)C1CCCC1 Amb28324505 [0,1,0,1,0,0|1,0,1]=4 13093 B9R1.11 NC(CF)C1CCCC1 Amb27182144 [0,1,0,1,0,0|1,0,1]=4 13094 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [0,1,0,1,0,0|0,0,2]=4 13095 B9R1.11 NCC(F)C1CCCC1 Amb28120476 [0,1,0,1,0,0|1,0,1]=4 13096 B9R1.11 NCC(F)C1CCCC1 Amb31291557 [0,1,0,1,0,0|1,0,1]=4 13097 B9R1.11 NCC(N)C1CCCC1 Amb18284364 [0,1,0,1,0,0|1,0,1]=4 13098 B9R1.11 NCC(O)C1CCCC1 Amb18959867 [0,1,0,1,0,0|1,0,1]=4 13099 B9R1.11 NCC(O)C1CCCC1 Amb19515470 [0,1,0,1,0,0|1,0,1]=4 13100 B9R1.11 NC[C@@H](O)C1CCCC1 Amb25921175 [0,1,0,1,0,0|1,0,1]=4 13101 B9R1.11 NC[C@H](N)C1CCCC1 Amb27204572 [0,1,0,1,0,0|1,0,1]=4 13102 B9R1.11 NC[C@H](O)C1CCCC1 Amb25889800 [0,1,0,1,0,0|1,0,1]=4 13103 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [0,1,0,1,0,0|0,0,2]=4 13104 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [0,1,0,1,0,0|0,0,2]=4 13105 B9R1.11 N[C@H](CO)C1CCCC1 Amb33872225 [0,1,0,1,0,0|0,0,2]=4 13106 B9R1.11 O=CC(=O)C1CCCO1 Amb27817025 [0,1,0,1,0,0|1,0,1]=4 13107 B9R1.11 O=CC(=O)C1CCOC1 Amb27658678 [0,1,0,1,0,0|1,0,1]=4 13108 B9R1.11 O=CC(O)C1CCOC1 Amb27657016 [0,1,0,1,0,0|1,0,0]=3 13109 B9R1.11 OC(CBr)C1CCCC1 Amb25889801 [0,1,0,1,0,0|1,0,1]=4 13110 B9R1.11 OC(CCl)C1CCCC1 Amb28140979 [0,1,0,1,0,0|1,0,1]=4 13111 B9R1.11 OC(CF)C1CCCC1 Amb27872595 [0,1,0,1,0,0|1,0,1]=4 13112 B9R1.11 OCC(O)C1CCCC1 Amb26463836 [0,1,0,1,0,0|0,0,2]=4 13113 B9R1.11 OC[C@H](O)C1CCCC1 Amb28049189 [0,1,0,1,0,0|0,0,2]=4 13114 B9R1.11 O[C@@H](CCl)C1CCCC1 Amb28121560 [0,1,0,1,0,0|1,0,1]=4 13115 B9R1.11 [C-]#[N+]C(C)C1CCCC1 Amb3973459 [0,1,0,1,0,0|2,0,0]=4 13116 B9R1.21 C#CC1CCC(CC)N1 Amb33169168 [0,1,0,1,0,0|1,0,1]=4 13117 B9R1.21 C=CC1CCC(CC)N1 Amb27953583 [0,1,0,1,0,0|1,0,0]=3 13118 B9R1.21 C=CC1CCC(CO)O1 Amb28134067 [0,1,0,1,0,0|2,0,0]=4 13119 B9R1.21 C=C[C@@H]1CC[C@H](CC)N1 Amb27852500 [0,1,0,1,0,0|1,0,0]=3 13120 B9R1.21 C=C[C@H]1CC[C@@H](CO)C1 Amb27665525 [0,1,0,1,0,0|2,0,0]=4 13121 B9R1.21 C=C[C@H]1CC[C@@H](CO)N1 Amb27464653 [0,1,0,1,0,0|2,0,0]=4 13122 B9R1.21 CCC1CC(C=O)CO1 Amb29870829 [0,1,0,1,0,0|1,0,0]=3 13123 B9R1.21 CCC1CCC(C#N)N1 Amb28053130 [0,1,0,1,0,0|1,0,1]=4 13124 B9R1.21 CCC1CCC(C=O)C1 Amb25312233 [0,1,0,1,0,0|0,0,0]=2 13125 B9R1.21 CCC1CCC(CBr)C1 Amb26006974 [0,1,0,1,0,0|1,0,1]=4 13126 B9R1.21 CCC1CCC(CC)N1 Amb26430315 [0,1,0,1,0,0|1,0,1]=4 13127 B9R1.21 CCC1CCC(CC)O1 Amb17672310 [0,1,0,1,0,0|1,0,1]=4 13128 B9R1.21 CCC1CCC(CN)C1 Amb27869330 [0,1,0,1,0,0|1,0,1]=4 13129 B9R1.21 CCC1CCC(CO)C1 Amb26929311 [0,1,0,1,0,0|0,0,2]=4 13130 B9R1.21 CCC1CCC(NN)C1 Amb27479809 [0,1,0,1,0,0|2,0,0]=4 13131 B9R1.21 CCN1CCC(C=O)C1 Amb23449544 [0,1,0,1,0,0|1,0,0]=3 13132 B9R1.21 CC[C@@H]1CC[C@@H](CCl)O1 Amb27879821 [0,1,0,1,0,0|1,0,1]=4 13133 B9R1.21 CC[C@@H]1CC[C@H](CO)N1 Amb27641256 [0,1,0,1,0,0|0,0,2]=4 13134 B9R1.21 COC1CCN(C=O)C1 Amb28188409 [0,1,0,1,0,0|2,0,0]=4 13135 B9R1.21 CO[C@H]1C[C@H](C=O)CO1 Amb28057458 [0,1,0,1,0,0|2,0,0]=4 13136 B9R1.21 CSC1CCN(C=O)C1 Amb27432869 [0,1,0,1,0,0|2,0,0]=4 13137 B9R1.21 N#CC1CCC(C=O)C1 Amb25147099 [0,1,0,1,0,0|1,0,1]=4 13138 B9R1.21 N#C[C@@H]1CC[C@@H](C=O)S1 Amb25066874 [0,1,0,1,0,0|1,0,1]=4 13139 B9R1.21 O=CC1CCC(C=O)C1 Amb18642420 [0,1,0,1,0,0|1,0,1]=4 13140 B9R1.21 O=CC1CCC(C=O)O1 Amb23455522 [0,1,0,1,0,0|1,0,1]=4 13141 B9R1.21 O=CC1CCC(CO)C1 Amb26516032 [0,1,0,1,0,0|1,0,0]=3 13142 B9R1.21 O=CC1CCC(CO)O1 Amb18642773 [0,1,0,1,0,0|1,0,0]=3 13143 B9R1.60 CCC1(C)CC1N=C=O Amb27774358 [0,1,0,1,0,0|1,0,1]=4 13144 B9R1.60 CCC1(C)CC1NC=O Amb27788737 [0,1,0,1,0,0|1,0,0]=3 13145 B9R1.60 CCCC1CC1(N)CC Amb27442943 [0,1,0,1,0,0|1,0,1]=4 13146 B9R1.60 COC1(C)CC1NC=O Amb30026754 [0,1,0,1,0,0|2,0,0]=4 13147 B9R1.60 CO[C@@]1(C)C[C@H]1NC=O Amb30026775 [0,1,0,1,0,0|2,0,0]=4 13148 B9R1.78 CC1CC1CC(N)CO Amb33144903 [0,1,0,1,0,0|0,0,2]=4 13149 B9R1.78 CC1CC1CC(O)CN Amb33144859 [0,1,0,1,0,0|1,0,1]=4 13150 B9R1.79 C#CC(N)CC1CCC1 Amb25032322 [0,1,0,1,0,0|1,0,1]=4 13151 B9R1.79 C#CC(N)CC1CCC1 Amb33483977 [0,1,0,1,0,0|1,0,1]=4 13152 B9R1.79 C#CC(O)CC1CCC1 Amb28424402 [0,1,0,1,0,0|1,0,1]=4 13153 B9R1.79 C=CC(C)NC1CCC1 Amb28285311 [0,1,0,1,0,0|2,0,0]=4 13154 B9R1.79 C=CC(N)CC1CCC1 Amb28046589 [0,1,0,1,0,0|1,0,0]=3 13155 B9R1.79 C=CC(N)CN1CCC1 Amb27965369 [0,1,0,1,0,0|2,0,0]=4 13156 B9R1.79 C=CC(O)CC1CNC1 Amb35622686 [0,1,0,1,0,0|2,0,0]=4 13157 B9R1.79 CC(C=O)CC1CCC1 Amb27600503 [0,1,0,1,0,0|0,0,0]=2 13158 B9R1.79 CC(C=O)OC1CCC1 Amb30020607 [0,1,0,1,0,0|1,0,0]=3 13159 B9R1.79 CC(C=O)OC1COC1 Amb30020586 [0,1,0,1,0,0|2,0,0]=4 13160 B9R1.79 CC(C=O)SC1COC1 Amb30036849 [0,1,0,1,0,0|2,0,0]=4 13161 B9R1.79 CC(CBr)CC1CCC1 Amb27867129 [0,1,0,1,0,0|1,0,1]=4 13162 B9R1.79 CC(CN)CC1CCC1 Amb26074727 [0,1,0,1,0,0|1,0,1]=4 13163 B9R1.79 CC(CO)CC1CCC1 Amb24402725 [0,1,0,1,0,0|0,0,2]=4 13164 B9R1.79 CCC(C)CC1CCN1 Amb27843783 [0,1,0,1,0,0|1,0,1]=4 13165 B9R1.79 CCC(C)CC1CNC1 Amb18988311 [0,1,0,1,0,0|2,0,0]=4 13166 B9R1.79 CCC(O)CC1CNC1 Amb35622519 [0,1,0,1,0,0|2,0,0]=4 13167 B9R1.79 CNC(C)CC1CCC1 Amb27261514 [0,1,0,1,0,0|2,0,0]=4 13168 B9R1.79 C[C@@H](CN)CC1CCC1 Amb33728845 [0,1,0,1,0,0|1,0,1]=4 13169 B9R1.79 C[C@@H](CO)CC1CCC1 Amb33743097 [0,1,0,1,0,0|0,0,2]=4 13170 B9R1.79 C[C@H](CN)CC1CCC1 Amb33726997 [0,1,0,1,0,0|1,0,1]=4 13171 B9R1.79 C[C@H](CO)CC1CCC1 Amb33738446 [0,1,0,1,0,0|0,0,2]=4 13172 B9R1.79 C\C(C=O)=C/C1CCC1 Amb27589239 [0,1,0,1,0,0|0,0,2]=4 13173 B9R1.79 N#CC(N)CC1CCC1 Amb23536853 [0,1,0,1,0,0|1,0,1]=4 13174 B9R1.79 NC(CO)CC1CCC1 Amb32660961 [0,1,0,1,0,0|0,0,2]=4 13175 B9R1.79 NC(CO)CC1CCC1 Amb33548648 [0,1,0,1,0,0|0,0,2]=4 13176 B9R1.79 NCC(F)CC1CCC1 Amb31291552 [0,1,0,1,0,0|1,0,1]=4 13177 B9R1.79 NCC(O)CC1CCC1 Amb33195517 [0,1,0,1,0,0|1,0,1]=4 13178 B9R1.79 N[C@@H](CO)CC1CCC1 Amb28199933 [0,1,0,1,0,0|0,0,2]=4 13179 B9R1.79 N[C@H](CO)CC1CCC1 Amb26547301 [0,1,0,1,0,0|0,0,2]=4 13180 B9R1.80 C=CC(=O)CCC1CC1 Amb28241113 [0,1,0,1,0,0|1,0,1]=4 13181 B9R1.80 C=CC(C)NCC1CC1 Amb28140339 [0,1,0,1,0,0|2,0,0]=4 13182 B9R1.80 C=CC(C)OCC1CC1 Amb33512625 [0,1,0,1,0,0|2,0,0]=4 13183 B9R1.80 C=CC(O)CNC1CC1 Amb27430594 [0,1,0,1,0,0|2,0,0]=4 13184 B9R1.80 CC(CN)CCC1CC1 Amb24481956 [0,1,0,1,0,0|1,0,1]=4 13185 B9R1.80 CC(CO)CCC1CC1 Amb33749212 [0,1,0,1,0,0|0,0,2]=4 13186 B9R1.80 CCC(Br)CCC1CC1 Amb27448483 [0,1,0,1,0,0|1,0,1]=4 13187 B9R1.80 CCC(Cl)CCC1CC1 Amb27807280 [0,1,0,1,0,0|1,0,1]=4 13188 B9R1.80 CC[C@H](O)CCC1CC1 Amb27192177 [0,1,0,1,0,0|1,0,1]=4 13189 B9R1.80 CN(C=O)CCC1CC1 Amb27772099 [0,1,0,1,0,0|1,0,0]=3 13190 B9R1.80 C[C@@H](CN)CCC1CC1 Amb33744963 [0,1,0,1,0,0|1,0,1]=4 13191 B9R1.80 C[C@@H](CO)CCC1CC1 Amb33747154 [0,1,0,1,0,0|0,0,2]=4 13192 B9R1.80 C[C@H](CN)CCC1CC1 Amb33748019 [0,1,0,1,0,0|1,0,1]=4 13193 B9R1.80 C[C@H](CO)CCC1CC1 Amb33748163 [0,1,0,1,0,0|0,0,2]=4 13194 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|0,0,2]=4 13195 B9R1.80 NCC(N)CCC1CC1 Amb27848173 [0,1,0,1,0,0|1,0,1]=4 13196 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|1,0,1]=4 13197 B9R1.80 OCC(O)CCC1CC1 Amb27444259 [0,1,0,1,0,0|0,0,2]=4 13198 B9R1.81 CC1CCC1C(O)CN Amb33512108 [0,1,0,1,0,0|1,0,1]=4 13199 B9R1.81 CCC(=O)N1CCC1=O Amb25190242 [0,1,0,1,0,0|1,0,1]=4 13200 B9R1.81 CCC(C)C1CCC1O Amb32945398 [0,1,0,1,0,0|0,0,2]=4 13201 B9R1.81 CCC(Cl)C1CCC1C Amb28201338 [0,1,0,1,0,0|1,0,1]=4 13202 B9R1.81 CCC(N)C1CCN1C Amb27442086 [0,1,0,1,0,0|2,0,0]=4 13203 B9R1.81 COC(=O)C1CCC1=O Amb26937068 [0,1,0,1,0,0|1,0,1]=4 13204 B9R1.81 O=C1NCC1C(O)CF Amb27760296 [0,1,0,1,0,0|2,0,0]=4 13205 B9R1.81 O=C1NC[C@H]1[C@H](O)CF Amb27205323 [0,1,0,1,0,0|2,0,0]=4 13206 B9R1.81 O=C[C@@H](O)[C@@H]1SC[C@@H]1O Amb28129425 [0,1,0,1,0,0|2,0,0]=4 13207 B9R1.88 C#CC(N)C1CC1CC Amb27640391 [0,1,0,1,0,0|1,0,1]=4 13208 B9R1.88 C#CC(O)C1CC1CC Amb27629538 [0,1,0,1,0,0|1,0,1]=4 13209 B9R1.88 C#CC(O)[C@@H]1C[C@H]1CC Amb27197403 [0,1,0,1,0,0|1,0,1]=4 13210 B9R1.88 C=CC(N)C1CC1CO Amb28140754 [0,1,0,1,0,0|2,0,0]=4 13211 B9R1.88 C=CC(N)C1CC1OC Amb29867356 [0,1,0,1,0,0|2,0,0]=4 13212 B9R1.88 C=CC(O)C1CC1CO Amb28068287 [0,1,0,1,0,0|2,0,0]=4 13213 B9R1.88 C=CC(O)C1CC1OC Amb29857520 [0,1,0,1,0,0|2,0,0]=4 13214 B9R1.88 C=CC(O)C1OC1CC Amb25916377 [0,1,0,1,0,0|2,0,0]=4 13215 B9R1.88 C=C[C@H]1C[C@H]1C(C)C=O Amb27841167 [0,1,0,1,0,0|0,0,2]=4 13216 B9R1.88 CCC(C)C1CC1C=O Amb32669250 [0,1,0,1,0,0|0,0,0]=2 13217 B9R1.88 CCC(C)C1CC1CN Amb27837494 [0,1,0,1,0,0|1,0,1]=4 13218 B9R1.88 CCC(C)C1CC1CO Amb27838522 [0,1,0,1,0,0|0,0,2]=4 13219 B9R1.88 CCC(C)[C@@H]1C[C@H]1CN Amb33318465 [0,1,0,1,0,0|1,0,1]=4 13220 B9R1.88 CCC(N)C1CC1OC Amb29867635 [0,1,0,1,0,0|2,0,0]=4 13221 B9R1.88 CCC(O)C1CC1CO Amb27770342 [0,1,0,1,0,0|0,0,2]=4 13222 B9R1.88 CCC(O)[C@@H]1C[C@H]1OC Amb27970206 [0,1,0,1,0,0|2,0,0]=4 13223 B9R1.88 CCC(O)[C@H]1C[C@H]1CO Amb27981681 [0,1,0,1,0,0|0,0,2]=4 13224 B9R1.88 CCC1CC1C(C)NC Amb28056518 [0,1,0,1,0,0|2,0,0]=4 13225 B9R1.88 CC[C@@H]1C[C@H]1C(C)NC Amb27976291 [0,1,0,1,0,0|2,0,0]=4 13226 B9R1.88 COC(=O)C1CC1C=O Amb24480363 [0,1,0,1,0,0|1,0,1]=4 13227 B9R1.88 COC(=O)[C@@H]1C[C@H]1C=O Amb27489067 [0,1,0,1,0,0|1,0,1]=4 13228 B9R1.88 COC(=O)[C@H]1C[C@H]1C=O Amb27265977 [0,1,0,1,0,0|1,0,1]=4 13229 B9R1.97 CCC1CCC1(C)CO Amb27947036 [0,1,0,1,0,0|0,0,2]=4 13230 B9R1.99 C#CCCCC1(N)CC1 Amb35657737 [0,1,0,1,0,0|1,0,1]=4 13231 B9R1.99 C=CCNCC1(C)CC1 Amb27486930 [0,1,0,1,0,0|2,0,0]=4 13232 B9R1.99 CC1(CCCC#N)CC1 Amb32993715 [0,1,0,1,0,0|1,0,1]=4 13233 B9R1.99 CC1(CCCC=O)CC1 Amb33314309 [0,1,0,1,0,0|0,0,0]=2 13234 B9R1.99 CC1(CCCCN)CC1 Amb32993716 [0,1,0,1,0,0|1,0,1]=4 13235 B9R1.99 CC1(CCN=C=O)CC1 Amb33197182 [0,1,0,1,0,0|1,0,1]=4 13236 B9R1.99 CC1(CCNC=O)CC1 Amb30035883 [0,1,0,1,0,0|1,0,0]=3 13237 B9R1.99 CCCCCC1(C)CO1 Amb27760064 [0,1,0,1,0,0|0,0,2]=4 13238 B9R1.99 CCCCCC1(N)CC1 Amb24623686 [0,1,0,1,0,0|1,0,1]=4 13239 B9R1.99 CCCCCC1(O)CC1 Amb27218085 [0,1,0,1,0,0|1,0,1]=4 13240 B9R1.99 CNCCCC1(F)CC1 Amb27423403 [0,1,0,1,0,0|2,0,0]=4 13241 B9R1.99 COCCCC1(N)CC1 Amb28189758 [0,1,0,1,0,0|2,0,0]=4 13242 B9R1.99 COCCCC1(O)CC1 Amb25777583 [0,1,0,1,0,0|2,0,0]=4 13243 B9R1.99 CSCCCC1(N)CC1 Amb25074982 [0,1,0,1,0,0|2,0,0]=4 13244 B9R1.99 CSCCCC1(O)CC1 Amb33314572 [0,1,0,1,0,0|2,0,0]=4 13245 B9R1.99 NC1(CCCCF)CC1 Amb26924900 [0,1,0,1,0,0|1,0,1]=4 13246 B9R1.99 NC1(CCCCO)CC1 Amb27185968 [0,1,0,1,0,0|0,0,2]=4 13247 B9R1.99 OC1(CCCCCl)CC1 Amb27838539 [0,1,0,1,0,0|1,0,1]=4 13248 B9R1.99 OC1(CCCCF)CC1 Amb33196075 [0,1,0,1,0,0|1,0,1]=4 13249 B9R1.118 C#CC1(C)CCCCC1 Amb21963029 [0,1,0,1,0,0|1,0,1]=4 13250 B9R1.118 C#CC1(Cl)CCCCC1 Amb1101957 [0,1,0,1,0,0|1,0,1]=4 13251 B9R1.118 C#CC1(N)CCCCC1 Amb1093946 [0,1,0,1,0,0|1,0,1]=4 13252 B9R1.118 C#CC1(N)CCCCC1 Amb22283986 [0,1,0,1,0,0|1,0,1]=4 13253 B9R1.118 C#CC1(O)CCCCC1 Amb2721510 [0,1,0,1,0,0|1,0,1]=4 13254 B9R1.118 C=CC1(C)CCCCC1 Amb24376596 [0,1,0,1,0,0|1,0,0]=3 13255 B9R1.118 C=CC1(C)CCOCC1 Amb33415493 [0,1,0,1,0,0|2,0,0]=4 13256 B9R1.118 C=CC1(N)CCCCC1 Amb18642344 [0,1,0,1,0,0|1,0,0]=3 13257 B9R1.118 C=CC1(N)CCOCC1 Amb31256593 [0,1,0,1,0,0|2,0,0]=4 13258 B9R1.118 C=CC1(N)CCOCC1 Amb32645663 [0,1,0,1,0,0|2,0,0]=4 13259 B9R1.118 C=CC1(O)CCCCC1 Amb17593328 [0,1,0,1,0,0|1,0,0]=3 13260 B9R1.118 C=CC1(O)CCCSC1 Amb29857707 [0,1,0,1,0,0|2,0,0]=4 13261 B9R1.118 C=CC1(O)CCNCC1 Amb28046091 [0,1,0,1,0,0|2,0,0]=4 13262 B9R1.118 C=CC1(O)CCOCC1 Amb24479932 [0,1,0,1,0,0|2,0,0]=4 13263 B9R1.118 C=CC1(O)CCSCC1 Amb35696362 [0,1,0,1,0,0|2,0,0]=4 13264 B9R1.118 CC1(C#N)CCCCC1 Amb18642140 [0,1,0,1,0,0|1,0,1]=4 13265 B9R1.118 CC1(C=O)CC=CCC1 Amb18642238 [0,1,0,1,0,0|0,0,2]=4 13266 B9R1.118 CC1(C=O)CCCCC1 Amb10070781 [0,1,0,1,0,0|0,0,0]=2 13267 B9R1.118 CC1(C=O)CCCCO1 Amb24627620 [0,1,0,1,0,0|1,0,0]=3 13268 B9R1.118 CC1(C=O)CCCOC1 Amb25082506 [0,1,0,1,0,0|1,0,0]=3 13269 B9R1.118 CC1(C=O)CCOCC1 Amb19516695 [0,1,0,1,0,0|1,0,0]=3 13270 B9R1.118 CC1(C=O)CCSCC1 Amb25108539 [0,1,0,1,0,0|1,0,0]=3 13271 B9R1.118 CC1(C=O)SCCCS1 Amb28422256 [0,1,0,1,0,0|2,0,0]=4 13272 B9R1.118 CC1(CBr)CCCCC1 Amb8630706 [0,1,0,1,0,0|1,0,1]=4 13273 B9R1.118 CC1(CCl)CCCCC1 Amb8630740 [0,1,0,1,0,0|1,0,1]=4 13274 B9R1.118 CC1(CN)C=CCCC1 Amb31157065 [0,1,0,1,0,0|2,0,0]=4 13275 B9R1.118 CC1(CN)C=CCCC1 Amb33309478 [0,1,0,1,0,0|2,0,0]=4 13276 B9R1.118 CC1(CN)CCCCC1 Amb20632204 [0,1,0,1,0,0|1,0,1]=4 13277 B9R1.118 CC1(CN)CCCCC1 Amb8630346 [0,1,0,1,0,0|1,0,1]=4 13278 B9R1.118 CC1(CO)C=CCCC1 Amb28049165 [0,1,0,1,0,0|2,0,0]=4 13279 B9R1.118 CC1(CO)CCCCC1 Amb2694689 [0,1,0,1,0,0|0,0,2]=4 13280 B9R1.118 CC1(CS)CCCCC1 Amb24572456 [0,1,0,1,0,0|0,1,1]=4 13281 B9R1.118 CC1(NN)CCCCC1 Amb25068508 [0,1,0,1,0,0|2,0,0]=4 13282 B9R1.118 CCC1(C)CCCCC1 Amb22227942 [0,1,0,1,0,0|1,0,1]=4 13283 B9R1.118 CCC1(C)CCCCN1 Amb26346096 [0,1,0,1,0,0|1,0,1]=4 13284 B9R1.118 CCC1(C)CCCNC1 Amb17622028 [0,1,0,1,0,0|2,0,0]=4 13285 B9R1.118 CCC1(C)CCCNC1 Amb22587423 [0,1,0,1,0,0|2,0,0]=4 13286 B9R1.118 CCC1(Cl)CCCCC1 Amb4017937 [0,1,0,1,0,0|1,0,1]=4 13287 B9R1.118 CCC1(N)CCCCC1 Amb33552085 [0,1,0,1,0,0|1,0,1]=4 13288 B9R1.118 CCC1(N)CCCCC1 Amb9676113 [0,1,0,1,0,0|1,0,1]=4 13289 B9R1.118 CCC1(N)CCCOC1 Amb24524297 [0,1,0,1,0,0|2,0,0]=4 13290 B9R1.118 CCC1(O)C=CCCC1 Amb27652373 [0,1,0,1,0,0|1,0,0]=3 13291 B9R1.118 CCC1(O)CCCCC1 Amb1019962 [0,1,0,1,0,0|1,0,1]=4 13292 B9R1.118 CCC1(O)CCCNC1 Amb10607740 [0,1,0,1,0,0|2,0,0]=4 13293 B9R1.118 CCC1(O)CCCNC1 Amb22491665 [0,1,0,1,0,0|2,0,0]=4 13294 B9R1.118 CCC1(O)CCCOC1 Amb25872686 [0,1,0,1,0,0|2,0,0]=4 13295 B9R1.118 CCC1(O)CCCSC1 Amb29857708 [0,1,0,1,0,0|2,0,0]=4 13296 B9R1.118 CC[C@]1(C)CCCNC1 Amb22757832 [0,1,0,1,0,0|2,0,0]=4 13297 B9R1.118 CNC1(C)CCCCC1 Amb18946302 [0,1,0,1,0,0|2,0,0]=4 13298 B9R1.118 FC1(CBr)CCCCC1 Amb26022122 [0,1,0,1,0,0|1,0,1]=4 13299 B9R1.118 N#CC1(Br)CCCCC1 Amb25097145 [0,1,0,1,0,0|1,0,1]=4 13300 B9R1.118 N#CC1(Cl)CCCCC1 Amb33539905 [0,1,0,1,0,0|1,0,1]=4 13301 B9R1.118 N#CC1(N)CCCCC1 Amb22227843 [0,1,0,1,0,0|1,0,1]=4 13302 B9R1.118 N#CC1(N)CCCCC1 Amb399531 [0,1,0,1,0,0|1,0,1]=4 13303 B9R1.118 N#CC1(O)CCCCC1 Amb3940107 [0,1,0,1,0,0|1,0,1]=4 13304 B9R1.118 NC1(C=O)CCOCC1 Amb35735160 [0,1,0,1,0,0|1,0,0]=3 13305 B9R1.118 NC1(CF)CCCCC1 Amb25951307 [0,1,0,1,0,0|1,0,1]=4 13306 B9R1.118 NC1(CO)CCCCC1 Amb10608249 [0,1,0,1,0,0|0,0,2]=4 13307 B9R1.118 NC1(CO)CCCCC1 Amb8631827 [0,1,0,1,0,0|0,0,2]=4 13308 B9R1.118 NCC1(Br)CCCCC1 Amb26994516 [0,1,0,1,0,0|1,0,1]=4 13309 B9R1.118 NCC1(Br)CCCCC1 Amb31217494 [0,1,0,1,0,0|1,0,1]=4 13310 B9R1.118 NCC1(Cl)CCCCC1 Amb26892840 [0,1,0,1,0,0|1,0,1]=4 13311 B9R1.118 NCC1(Cl)CCCCC1 Amb32651842 [0,1,0,1,0,0|1,0,1]=4 13312 B9R1.118 NCC1(F)CCCCC1 Amb22174148 [0,1,0,1,0,0|1,0,1]=4 13313 B9R1.118 NCC1(F)CCCCC1 Amb22887010 [0,1,0,1,0,0|1,0,1]=4 13314 B9R1.118 NCC1(N)CCCCC1 Amb2371826 [0,1,0,1,0,0|1,0,1]=4 13315 B9R1.118 NCC1(N)CCCCC1 Amb520873 [0,1,0,1,0,0|1,0,1]=4 13316 B9R1.118 NCC1(O)C=CCCC1 Amb27851870 [0,1,0,1,0,0|2,0,0]=4 13317 B9R1.118 NCC1(O)CCCCC1 Amb1108364 [0,1,0,1,0,0|1,0,1]=4 13318 B9R1.118 NCC1(O)CCCCC1 Amb2720241 [0,1,0,1,0,0|1,0,1]=4 13319 B9R1.118 NCC1(O)CCCCC1 Amb33513047 [0,1,0,1,0,0|1,0,1]=4 13320 B9R1.118 NCC1(S)CCCCC1 Amb27842428 [0,1,0,1,0,0|1,0,1]=4 13321 B9R1.118 O=CC1(Br)CCCCC1 Amb17594982 [0,1,0,1,0,0|0,0,0]=2 13322 B9R1.118 O=CC1(Br)CCOCC1 Amb24603025 [0,1,0,1,0,0|1,0,0]=3 13323 B9R1.118 O=CC1(Cl)CC=CCC1 Amb27224727 [0,1,0,1,0,0|0,0,2]=4 13324 B9R1.118 O=CC1(Cl)CCCCC1 Amb17593665 [0,1,0,1,0,0|0,0,0]=2 13325 B9R1.118 O=CC1(Cl)CCOCC1 Amb26062149 [0,1,0,1,0,0|1,0,0]=3 13326 B9R1.118 O=CC1(F)CCOCC1 Amb21964778 [0,1,0,1,0,0|1,0,0]=3 13327 B9R1.118 O=CC1(O)CCOCC1 Amb24481954 [0,1,0,1,0,0|1,0,0]=3 13328 B9R1.118 O=C[C@@]1(Br)CC=CCC1 Amb28350499 [0,1,0,1,0,0|0,0,2]=4 13329 B9R1.118 O=C[C@]1(Br)CC=CCC1 Amb28186624 [0,1,0,1,0,0|0,0,2]=4 13330 B9R1.118 O=NC1(Cl)CCCCC1 Amb26047709 [0,1,0,1,0,0|1,0,0]=3 13331 B9R1.118 OC1(CBr)CCCCC1 Amb23597825 [0,1,0,1,0,0|1,0,1]=4 13332 B9R1.118 OC1(CI)CCCCC1 Amb27628298 [0,1,0,1,0,0|1,0,1]=4 13333 B9R1.118 OCC1(Cl)CCCCC1 Amb27804982 [0,1,0,1,0,0|0,0,2]=4 13334 B9R1.118 OCC1(F)CCCCC1 Amb10603424 [0,1,0,1,0,0|0,0,2]=4 13335 B9R1.118 OCC1(O)CCCCC1 Amb10552888 [0,1,0,1,0,0|0,0,2]=4 13336 B9R1.118 OCC1(S)CCCCC1 Amb25084707 [0,1,0,1,0,0|0,0,2]=4 13337 B9R1.118 [C-]#[N+]C1(C)CCCCC1 Amb33318912 [0,1,0,1,0,0|2,0,0]=4 13338 B9R1.132 C=C1CCN(CC)C1=O Amb27645161 [0,1,0,1,0,0|1,0,1]=4 13339 B9R1.132 C=CC1CCC(=O)C1C Amb28253911 [0,1,0,1,0,0|1,0,1]=4 13340 B9R1.132 C=C[C@@H]1CCC(=O)[C@H]1C Amb27880593 [0,1,0,1,0,0|1,0,1]=4 13341 B9R1.132 CC1C(O)CCC1C#N Amb27458046 [0,1,0,1,0,0|1,0,1]=4 13342 B9R1.132 CC1C(O)CCC1CN Amb25258217 [0,1,0,1,0,0|1,0,1]=4 13343 B9R1.132 CC1C(O)CCC1CN Amb33362355 [0,1,0,1,0,0|1,0,1]=4 13344 B9R1.132 CC1CCC(C#N)C1=O Amb25714272 [0,1,0,1,0,0|1,0,1]=4 13345 B9R1.132 CC1CCC(CO)C1=O Amb27486136 [0,1,0,1,0,0|1,0,0]=3 13346 B9R1.132 CC1OCC(C=O)C1C Amb35732633 [0,1,0,1,0,0|1,0,0]=3 13347 B9R1.132 CC1[C@@H](C#N)CC[C@H]1O Amb27457008 [0,1,0,1,0,0|1,0,1]=4 13348 B9R1.132 CCC1CCC(C)N1C Amb27604766 [0,1,0,1,0,0|2,0,0]=4 13349 B9R1.132 CCC1CCC(Cl)C1C Amb27656345 [0,1,0,1,0,0|1,0,1]=4 13350 B9R1.132 CCC1CCC(N)C1C Amb27654008 [0,1,0,1,0,0|1,0,1]=4 13351 B9R1.132 CCN1CCC(Br)C1=O Amb22749189 [0,1,0,1,0,0|1,0,0]=3 13352 B9R1.132 CCN1CCC(N)C1=O Amb18945418 [0,1,0,1,0,0|1,0,0]=3 13353 B9R1.132 CCN1CCC(N)C1=O Amb32655994 [0,1,0,1,0,0|1,0,0]=3 13354 B9R1.132 CCN1CCN(N)C1=O Amb27237090 [0,1,0,1,0,0|2,0,0]=4 13355 B9R1.132 CCN1CNC(C)C1=O Amb27799848 [0,1,0,1,0,0|2,0,0]=4 13356 B9R1.132 CCN1OCC(Br)C1=O Amb25032274 [0,1,0,1,0,0|2,0,0]=4 13357 B9R1.132 CCN1OCC(N)C1=O Amb25887354 [0,1,0,1,0,0|2,0,0]=4 13358 B9R1.132 CCN1OCC(N)C1=O Amb33309535 [0,1,0,1,0,0|2,0,0]=4 13359 B9R1.132 CCN1OCC(O)C1=O Amb35789273 [0,1,0,1,0,0|2,0,0]=4 13360 B9R1.132 CCN1OC[C@@H](N)C1=O Amb33719167 [0,1,0,1,0,0|2,0,0]=4 13361 B9R1.132 CC[C@@H]1CC[C@H](C)C1=O Amb28052450 [0,1,0,1,0,0|0,0,0]=2 13362 B9R1.132 CN1C(=O)CCC1C=O Amb24725330 [0,1,0,1,0,0|1,0,1]=4 13363 B9R1.132 CN1CCC(CBr)C1=O Amb28318638 [0,1,0,1,0,0|2,0,0]=4 13364 B9R1.132 CN1CCC(CI)C1=O Amb35723927 [0,1,0,1,0,0|2,0,0]=4 13365 B9R1.132 CN1CCC(CN)C1=O Amb30982588 [0,1,0,1,0,0|2,0,0]=4 13366 B9R1.132 CN1CCC(CN)C1=O Amb33550142 [0,1,0,1,0,0|2,0,0]=4 13367 B9R1.132 CN1CCC(CO)C1=O Amb22236004 [0,1,0,1,0,0|2,0,0]=4 13368 B9R1.132 CN1CCC(CS)C1=O Amb35686181 [0,1,0,1,0,0|2,0,0]=4 13369 B9R1.132 CNC1CCC(C)C1C Amb27780076 [0,1,0,1,0,0|2,0,0]=4 13370 B9R1.132 CNC1CCN(C)C1=O Amb18945539 [0,1,0,1,0,0|2,0,0]=4 13371 B9R1.132 CNC1CCN(C)C1=O Amb33550373 [0,1,0,1,0,0|2,0,0]=4 13372 B9R1.132 CON1CCC(Br)C1=O Amb22749188 [0,1,0,1,0,0|2,0,0]=4 13373 B9R1.132 CSC1CCC(N)C1C Amb27833250 [0,1,0,1,0,0|2,0,0]=4 13374 B9R1.132 C[C@H]1CC=C(C=O)[C@@H]1C Amb27859291 [0,1,0,1,0,0|0,0,2]=4 13375 B9R1.132 O=CC1OCC(O)C1O Amb27256563 [0,1,0,1,0,0|2,0,0]=4 13376 B9R1.132 O=C[C@@H]1OC[C@@H](O)[C@H]1O Amb27629808 [0,1,0,1,0,0|2,0,0]=4 13377 B9R1.132 O=C[C@@H]1OC[C@H](O)[C@@H]1O Amb28457584 [0,1,0,1,0,0|2,0,0]=4 13378 B9R1.135 CC1CC(CCN)C1C Amb27951859 [0,1,0,1,0,0|1,0,1]=4 13379 B9R1.135 CNCC1CC(C)C1C Amb27410281 [0,1,0,1,0,0|2,0,0]=4 13380 B9R1.135 NC1CN(CCO)C1=O Amb27180505 [0,1,0,1,0,0|2,0,0]=4 13381 B9R1.202 C#CC1(O)CCCC1=O Amb27432609 [0,1,0,1,0,0|0,0,2]=4 13382 B9R1.202 C#CC1(O)CCCC1C Amb26341764 [0,1,0,1,0,0|1,0,1]=4 13383 B9R1.202 C=C1CCCC1(C)CO Amb27603129 [0,1,0,1,0,0|2,0,0]=4 13384 B9R1.202 C=C1CCCC1(O)CO Amb28064122 [0,1,0,1,0,0|2,0,0]=4 13385 B9R1.202 C=CC1(O)CCCC1=O Amb27802144 [0,1,0,1,0,0|0,0,2]=4 13386 B9R1.202 C=CC1(O)CCOC1C Amb27453223 [0,1,0,1,0,0|2,0,0]=4 13387 B9R1.202 C=CC1(O)COCC1C Amb35608133 [0,1,0,1,0,0|2,0,0]=4 13388 B9R1.202 C=CC1(O)CSCC1C Amb27974300 [0,1,0,1,0,0|2,0,0]=4 13389 B9R1.202 C=C[C@]1(C)CCCC1=O Amb27838817 [0,1,0,1,0,0|0,0,2]=4 13390 B9R1.202 C=C[C@]1(O)CCCC1=O Amb28364622 [0,1,0,1,0,0|0,0,2]=4 13391 B9R1.202 CC1(C=O)CCCC1=O Amb28286041 [0,1,0,1,0,0|1,0,1]=4 13392 B9R1.202 CC1(CBr)CCNC1=O Amb35601686 [0,1,0,1,0,0|2,0,0]=4 13393 B9R1.202 CC1(CCl)CCCC1=O Amb25823650 [0,1,0,1,0,0|1,0,0]=3 13394 B9R1.202 CC1(CI)CCNC1=O Amb35601688 [0,1,0,1,0,0|2,0,0]=4 13395 B9R1.202 CC1(CN)CCNC1=O Amb24105417 [0,1,0,1,0,0|2,0,0]=4 13396 B9R1.202 CC1(CO)CCNC1=O Amb27242492 [0,1,0,1,0,0|2,0,0]=4 13397 B9R1.202 CC1(CO)CCOC1=O Amb28207139 [0,1,0,1,0,0|2,0,0]=4 13398 B9R1.202 CC1(CO)CCSC1=O Amb28049176 [0,1,0,1,0,0|2,0,0]=4 13399 B9R1.202 CC1CCCC1(Br)C#N Amb28285192 [0,1,0,1,0,0|1,0,1]=4 13400 B9R1.202 CC1CCCC1(C)C=O Amb25860085 [0,1,0,1,0,0|0,0,0]=2 13401 B9R1.202 CC1CCCC1(C)CN Amb24615536 [0,1,0,1,0,0|1,0,1]=4 13402 B9R1.202 CC1CCCC1(N)C#N Amb28203931 [0,1,0,1,0,0|1,0,1]=4 13403 B9R1.202 CC1CCCC1(O)C#N Amb27255755 [0,1,0,1,0,0|1,0,1]=4 13404 B9R1.202 CC1CCCC1(O)CN Amb25146157 [0,1,0,1,0,0|1,0,1]=4 13405 B9R1.202 CCC1(C)CCCC1=O Amb24553563 [0,1,0,1,0,0|0,0,0]=2 13406 B9R1.202 CCC1(C)CCCC1N Amb33494054 [0,1,0,1,0,0|1,0,1]=4 13407 B9R1.202 CCC1(C)CCCC1O Amb27956477 [0,1,0,1,0,0|0,0,2]=4 13408 B9R1.202 CCC1(C)CCNC1=O Amb24118004 [0,1,0,1,0,0|1,0,0]=3 13409 B9R1.202 CCC1(C)CCOC1=S Amb28245545 [0,1,0,1,0,0|1,1,0]=4 13410 B9R1.202 CCC1(C)CCSC1=O Amb27792358 [0,1,0,1,0,0|1,0,0]=3 13411 B9R1.202 CCC1(C)NCCC1=O Amb27849220 [0,1,0,1,0,0|1,0,0]=3 13412 B9R1.202 CCC1(N)CCCC1=O Amb27866573 [0,1,0,1,0,0|0,0,0]=2 13413 B9R1.202 CCC1(O)CCCC1C Amb24474369 [0,1,0,1,0,0|1,0,1]=4 13414 B9R1.202 CCC1(O)CCCC1N Amb25274889 [0,1,0,1,0,0|1,0,1]=4 13415 B9R1.202 CC[C@]1(C)CCC[C@@H]1O Amb28138775 [0,1,0,1,0,0|0,0,2]=4 13416 B9R1.202 CC[C@]1(O)CCC[C@@H]1N Amb27627836 [0,1,0,1,0,0|1,0,1]=4 13417 B9R1.202 CC[C@]1(O)CCC[C@@H]1O Amb27255135 [0,1,0,1,0,0|0,0,2]=4 13418 B9R1.202 CN[C@]1(C)CCC[C@@H]1C Amb27779229 [0,1,0,1,0,0|2,0,0]=4 13419 B9R1.202 C[C@@H]1CCC[C@]1(O)CO Amb27630888 [0,1,0,1,0,0|0,0,2]=4 13420 B9R1.202 C[C@@]1(CO)CCCC1=O Amb27628598 [0,1,0,1,0,0|1,0,0]=3 13421 B9R1.202 C[C@]1(CO)CCCC1=O Amb24415276 [0,1,0,1,0,0|1,0,0]=3 13422 B9R1.202 NC1(CO)CCNC1=O Amb27658842 [0,1,0,1,0,0|2,0,0]=4 13423 B9R1.202 O=C1CCC[C@]1(O)CO Amb27854576 [0,1,0,1,0,0|1,0,0]=3 13424 B9R1.202 O=C1OCCC1(O)CO Amb25225921 [0,1,0,1,0,0|2,0,0]=4 13425 B9R1.6 C=C(Br)C1CCCCC1 Amb27812306 [0,1,0,1,0,0|1,0,0]=3 13426 B9R1.6 C=C(C)C1CCCCC1 Amb24478631 [0,1,0,1,0,0|1,0,0]=3 13427 B9R1.6 C=C(C)C1CCCCN1 Amb23536631 [0,1,0,1,0,0|2,0,0]=4 13428 B9R1.6 C=C(C)C1CCCNC1 Amb23536695 [0,1,0,1,0,0|2,0,0]=4 13429 B9R1.6 C=C(C)C1CCNCC1 Amb23536711 [0,1,0,1,0,0|2,0,0]=4 13430 B9R1.6 CC(=N)N1CCCCC1 Amb27985971 [0,1,0,1,0,0|2,0,0]=4 13431 B9R1.6 CC(=O)C1=CCCCC1 Amb8513050 [0,1,0,1,0,0|0,0,2]=4 13432 B9R1.6 CC(=O)C1C=CCCC1 Amb17593287 [0,1,0,1,0,0|0,0,2]=4 13433 B9R1.6 CC(=O)C1CC=CCC1 Amb27643727 [0,1,0,1,0,0|0,0,2]=4 13434 B9R1.6 CC(=O)C1CCC=NC1 Amb25073951 [0,1,0,1,0,0|1,0,1]=4 13435 B9R1.6 CC(=O)C1CCCCC1 Amb4037310 [0,1,0,1,0,0|0,0,0]=2 13436 B9R1.6 CC(=O)C1CCCCN1 Amb21962174 [0,1,0,1,0,0|1,0,0]=3 13437 B9R1.6 CC(=O)C1CCCCN1 Amb2700057 [0,1,0,1,0,0|1,0,0]=3 13438 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [0,1,0,1,0,0|1,0,0]=3 13439 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [0,1,0,1,0,0|1,0,0]=3 13440 B9R1.6 CC(=O)C1CCCNC1 Amb22496258 [0,1,0,1,0,0|1,0,0]=3 13441 B9R1.6 CC(=O)C1CCCNC1 Amb3941186 [0,1,0,1,0,0|1,0,0]=3 13442 B9R1.6 CC(=O)C1CCCOC1 Amb26932950 [0,1,0,1,0,0|1,0,0]=3 13443 B9R1.6 CC(=O)C1CCNCC1 Amb10603454 [0,1,0,1,0,0|1,0,0]=3 13444 B9R1.6 CC(=O)C1CCNCC1 Amb19958038 [0,1,0,1,0,0|1,0,0]=3 13445 B9R1.6 CC(=O)C1CCOCC1 Amb16231304 [0,1,0,1,0,0|1,0,0]=3 13446 B9R1.6 CC(=O)C1CCSCC1 Amb24748894 [0,1,0,1,0,0|1,0,0]=3 13447 B9R1.6 CC(=O)C1CNCCO1 Amb25147230 [0,1,0,1,0,0|2,0,0]=4 13448 B9R1.6 CC(=O)C1CNCCS1 Amb24105963 [0,1,0,1,0,0|2,0,0]=4 13449 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,1,0,1,0,0|2,0,0]=4 13450 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,1,0,1,0,0|2,0,0]=4 13451 B9R1.6 CC(=O)C1COCOC1 Amb27838787 [0,1,0,1,0,0|2,0,0]=4 13452 B9R1.6 CC(=O)C1CSCCN1 Amb25305093 [0,1,0,1,0,0|2,0,0]=4 13453 B9R1.6 CC(=O)C1OCCCS1 Amb28350938 [0,1,0,1,0,0|2,0,0]=4 13454 B9R1.6 CC(=O)C1SCCCS1 Amb17594050 [0,1,0,1,0,0|2,0,0]=4 13455 B9R1.6 CC(=O)N1CCCCC1 Amb2694530 [0,1,0,1,0,0|1,0,0]=3 13456 B9R1.6 CC(=O)N1CCNCC1 Amb4424006 [0,1,0,1,0,0|2,0,0]=4 13457 B9R1.6 CC(=O)N1CCNCC1 Amb535516 [0,1,0,1,0,0|2,0,0]=4 13458 B9R1.6 CC(=O)N1CCOCC1 Amb3886545 [0,1,0,1,0,0|2,0,0]=4 13459 B9R1.6 CC(=O)[C@@H]1C=CCCC1 Amb25683968 [0,1,0,1,0,0|0,0,2]=4 13460 B9R1.6 CC(=O)[C@@H]1CC=CCC1 Amb26643097 [0,1,0,1,0,0|0,0,2]=4 13461 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb26891406 [0,1,0,1,0,0|1,0,0]=3 13462 B9R1.6 CC(=O)[C@@H]1CCCCN1 Amb28555630 [0,1,0,1,0,0|1,0,0]=3 13463 B9R1.6 CC(=O)[C@@H]1CCCNC1 Amb33131879 [0,1,0,1,0,0|1,0,0]=3 13464 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb25072730 [0,1,0,1,0,0|1,0,0]=3 13465 B9R1.6 CC(=O)[C@H]1CCCCN1 Amb28935031 [0,1,0,1,0,0|1,0,0]=3 13466 B9R1.6 CC(=O)[C@H]1CCCNC1 Amb33131684 [0,1,0,1,0,0|1,0,0]=3 13467 B9R1.6 CC(Br)C1CCCCC1 Amb9672122 [0,1,0,1,0,0|1,0,1]=4 13468 B9R1.6 CC(C)C1CCCCN1 Amb2235858 [0,1,0,1,0,0|1,0,1]=4 13469 B9R1.6 CC(C)C1CCCCN1 Amb2237211 [0,1,0,1,0,0|1,0,1]=4 13470 B9R1.6 CC(C)C1CCCNC1 Amb10607741 [0,1,0,1,0,0|2,0,0]=4 13471 B9R1.6 CC(C)C1CCCNC1 Amb29083221 [0,1,0,1,0,0|2,0,0]=4 13472 B9R1.6 CC(N)C1CC=CCC1 Amb33316363 [0,1,0,1,0,0|1,0,1]=4 13473 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [0,1,0,1,0,0|1,0,1]=4 13474 B9R1.6 CC(N)C1CCCCC1 Amb9283568 [0,1,0,1,0,0|1,0,1]=4 13475 B9R1.6 CC(N)C1CCCCN1 Amb9901744 [0,1,0,1,0,0|1,0,1]=4 13476 B9R1.6 CC(N)C1CCCCO1 Amb27596555 [0,1,0,1,0,0|0,0,2]=4 13477 B9R1.6 CC(N)C1CCCCO1 Amb32666314 [0,1,0,1,0,0|0,0,2]=4 13478 B9R1.6 CC(N)C1CCCCS1 Amb27880783 [0,1,0,1,0,0|0,1,1]=4 13479 B9R1.6 CC(N)C1CCCNC1 Amb18832598 [0,1,0,1,0,0|2,0,0]=4 13480 B9R1.6 CC(N)C1CCCOC1 Amb18832549 [0,1,0,1,0,0|2,0,0]=4 13481 B9R1.6 CC(N)C1CCCOC1 Amb32789650 [0,1,0,1,0,0|2,0,0]=4 13482 B9R1.6 CC(N)C1CCCSC1 Amb18825995 [0,1,0,1,0,0|2,0,0]=4 13483 B9R1.6 CC(O)C1C=CCCC1 Amb22365214 [0,1,0,1,0,0|1,0,0]=3 13484 B9R1.6 CC(O)C1C=CCCN1 Amb18642531 [0,1,0,1,0,0|2,0,0]=4 13485 B9R1.6 CC(O)C1CC=CCC1 Amb26633109 [0,1,0,1,0,0|1,0,1]=4 13486 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [0,1,0,1,0,0|0,0,2]=4 13487 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,1,0,1,0,0|1,0,1]=4 13488 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|0,0,2]=4 13489 B9R1.6 CC(O)C1CCCNC1 Amb17593363 [0,1,0,1,0,0|2,0,0]=4 13490 B9R1.6 CC(O)C1CCCNC1 Amb32412170 [0,1,0,1,0,0|2,0,0]=4 13491 B9R1.6 CC(O)[C@@H]1CCCCN1 Amb35737461 [0,1,0,1,0,0|1,0,1]=4 13492 B9R1.6 CC(O)[C@@H]1CCCNC1 Amb35588431 [0,1,0,1,0,0|2,0,0]=4 13493 B9R1.6 CC(O)[C@H]1CCCCN1 Amb35617462 [0,1,0,1,0,0|1,0,1]=4 13494 B9R1.6 CC(O)[C@H]1CCCNC1 Amb35617453 [0,1,0,1,0,0|2,0,0]=4 13495 B9R1.6 CC(S)C1CCCCC1 Amb9672127 [0,1,0,1,0,0|0,1,1]=4 13496 B9R1.6 CC(S)C1CCCCN1 Amb25707556 [0,1,0,1,0,0|1,0,1]=4 13497 B9R1.6 CC(S)C1CCCCO1 Amb32788899 [0,1,0,1,0,0|0,0,2]=4 13498 B9R1.6 CC(S)C1CCCNC1 Amb32788620 [0,1,0,1,0,0|2,0,0]=4 13499 B9R1.6 CC(S)C1CCCSC1 Amb32788181 [0,1,0,1,0,0|2,0,0]=4 13500 B9R1.6 CN(C)C1CCCCC1 Amb8516598 [0,1,0,1,0,0|2,0,0]=4 13501 B9R1.6 CN(N)C1CCCCC1 Amb27979124 [0,1,0,1,0,0|2,0,0]=4 13502 B9R1.6 CS(=O)C1CCCNC1 Amb27750943 [0,1,0,1,0,0|2,0,0]=4 13503 B9R1.6 C[C@@H](N)C1CC=CCC1 Amb33314944 [0,1,0,1,0,0|1,0,1]=4 13504 B9R1.6 C[C@@H](N)C1CCCCC1 Amb3940038 [0,1,0,1,0,0|1,0,1]=4 13505 B9R1.6 C[C@@H](N)C1CCCCO1 Amb26000516 [0,1,0,1,0,0|0,0,2]=4 13506 B9R1.6 C[C@@H](N)C1CCCCO1 Amb31291420 [0,1,0,1,0,0|0,0,2]=4 13507 B9R1.6 C[C@@H](N)C1CCCCS1 Amb27174884 [0,1,0,1,0,0|0,1,1]=4 13508 B9R1.6 C[C@@H](N)C1CCCOC1 Amb25705770 [0,1,0,1,0,0|2,0,0]=4 13509 B9R1.6 C[C@@H](N)C1CCCSC1 Amb32726293 [0,1,0,1,0,0|2,0,0]=4 13510 B9R1.6 C[C@@H](O)C1CC=CCC1 Amb33314942 [0,1,0,1,0,0|1,0,1]=4 13511 B9R1.6 C[C@@H](O)C1CCCCO1 Amb33375690 [0,1,0,1,0,0|0,0,2]=4 13512 B9R1.6 C[C@@H](O)C1CCCOC1 Amb26634197 [0,1,0,1,0,0|2,0,0]=4 13513 B9R1.6 C[C@@H](O)C1CCCSC1 Amb32726246 [0,1,0,1,0,0|2,0,0]=4 13514 B9R1.6 C[C@H](N)C1CC=CCC1 Amb33314943 [0,1,0,1,0,0|1,0,1]=4 13515 B9R1.6 C[C@H](N)C1CCCCC1 Amb3939178 [0,1,0,1,0,0|1,0,1]=4 13516 B9R1.6 C[C@H](N)C1CCCCO1 Amb33171840 [0,1,0,1,0,0|0,0,2]=4 13517 B9R1.6 C[C@H](N)C1CCCOC1 Amb25147114 [0,1,0,1,0,0|2,0,0]=4 13518 B9R1.6 C[C@H](N)C1CCCSC1 Amb32726275 [0,1,0,1,0,0|2,0,0]=4 13519 B9R1.6 C[C@H](O)C1CC=CCC1 Amb33314845 [0,1,0,1,0,0|1,0,1]=4 13520 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [0,1,0,1,0,0|0,0,2]=4 13521 B9R1.6 C[C@H](O)C1CCCCO1 Amb33375689 [0,1,0,1,0,0|0,0,2]=4 13522 B9R1.6 C[C@H](O)C1CCCOC1 Amb26324174 [0,1,0,1,0,0|2,0,0]=4 13523 B9R1.6 C[C@H](O)C1CCCSC1 Amb32726302 [0,1,0,1,0,0|2,0,0]=4 13524 B9R1.6 C[SiH](C)C1CCCCC1 Amb22336516 [0,1,0,1,0,0|1,1,0]=4 13525 B9R1.6 FC(Br)=C1CCCCC1 Amb32993478 [0,1,0,1,0,0|1,0,1]=4 13526 B9R1.6 FN(F)C1CCCCC1 Amb28424313 [0,1,0,1,0,0|2,0,0]=4 13527 B9R1.6 N=C(N)C1CCCCC1 Amb2695062 [0,1,0,1,0,0|1,0,0]=3 13528 B9R1.6 N=C(N)C1CCCCC1 Amb8630087 [0,1,0,1,0,0|1,0,0]=3 13529 B9R1.6 N=C(N)C1CCCCN1 Amb24659758 [0,1,0,1,0,0|2,0,0]=4 13530 B9R1.6 N=C(N)C1CCCCN1 Amb8630661 [0,1,0,1,0,0|2,0,0]=4 13531 B9R1.6 N=C(N)C1CCCCO1 Amb25212338 [0,1,0,1,0,0|2,0,0]=4 13532 B9R1.6 N=C(N)C1CCCSC1 Amb32726091 [0,1,0,1,0,0|2,0,0]=4 13533 B9R1.6 N=C(N)C1CCNCC1 Amb2700045 [0,1,0,1,0,0|2,0,0]=4 13534 B9R1.6 N=C(N)C1CCOCC1 Amb22059100 [0,1,0,1,0,0|2,0,0]=4 13535 B9R1.6 N=C(N)C1CCOCC1 Amb7990054 [0,1,0,1,0,0|2,0,0]=4 13536 B9R1.6 N=C(N)C1CCSCC1 Amb25992613 [0,1,0,1,0,0|2,0,0]=4 13537 B9R1.6 N=C(N)N1CCCCC1 Amb10066939 [0,1,0,1,0,0|2,0,0]=4 13538 B9R1.6 N=C(N)N1CCCCC1 Amb16231331 [0,1,0,1,0,0|2,0,0]=4 13539 B9R1.6 N=C(N)N1CCCCC1 Amb1885874 [0,1,0,1,0,0|2,0,0]=4 13540 B9R1.6 N=C(N)N1CCCCC1 Amb2724255 [0,1,0,1,0,0|2,0,0]=4 13541 B9R1.6 N=C(N)N1CCCCC1 Amb2724396 [0,1,0,1,0,0|2,0,0]=4 13542 B9R1.6 N=C(N)N1CCCCC1 Amb33551652 [0,1,0,1,0,0|2,0,0]=4 13543 B9R1.6 NC(=O)C1=CCCCC1 Amb27878423 [0,1,0,1,0,0|0,0,2]=4 13544 B9R1.6 NC(=O)C1CC=CCC1 Amb16231370 [0,1,0,1,0,0|0,0,2]=4 13545 B9R1.6 NC(=O)C1CCCCC1 Amb6335833 [0,1,0,1,0,0|0,0,0]=2 13546 B9R1.6 NC(=O)C1CCCCN1 Amb2370929 [0,1,0,1,0,0|1,0,0]=3 13547 B9R1.6 NC(=O)C1CCCCN1 Amb433771 [0,1,0,1,0,0|1,0,0]=3 13548 B9R1.6 NC(=O)C1CCCCS1 Amb26316109 [0,1,0,1,0,0|1,0,0]=3 13549 B9R1.6 NC(=O)C1CCCNC1 Amb33527502 [0,1,0,1,0,0|1,0,0]=3 13550 B9R1.6 NC(=O)C1CCCNC1 Amb9702850 [0,1,0,1,0,0|1,0,0]=3 13551 B9R1.6 NC(=O)C1CCCOC1 Amb9173672 [0,1,0,1,0,0|1,0,0]=3 13552 B9R1.6 NC(=O)C1CCNCC1 Amb21957241 [0,1,0,1,0,0|1,0,0]=3 13553 B9R1.6 NC(=O)C1CCNCC1 Amb2720321 [0,1,0,1,0,0|1,0,0]=3 13554 B9R1.6 NC(=O)C1CCOCC1 Amb7990052 [0,1,0,1,0,0|1,0,0]=3 13555 B9R1.6 NC(=O)C1CCSCC1 Amb27252383 [0,1,0,1,0,0|1,0,0]=3 13556 B9R1.6 NC(=O)C1CNCCN1 Amb1158016 [0,1,0,1,0,0|2,0,0]=4 13557 B9R1.6 NC(=O)C1CNCCO1 Amb13951857 [0,1,0,1,0,0|2,0,0]=4 13558 B9R1.6 NC(=O)C1CNCCO1 Amb22587273 [0,1,0,1,0,0|2,0,0]=4 13559 B9R1.6 NC(=O)C1COCCN1 Amb22059486 [0,1,0,1,0,0|2,0,0]=4 13560 B9R1.6 NC(=O)C1COCCN1 Amb31308018 [0,1,0,1,0,0|2,0,0]=4 13561 B9R1.6 NC(=O)C1CSCCN1 Amb4004499 [0,1,0,1,0,0|2,0,0]=4 13562 B9R1.6 NC(=O)N1CCCCC1 Amb1151731 [0,1,0,1,0,0|1,0,0]=3 13563 B9R1.6 NC(=O)N1CCCOC1 Amb27428822 [0,1,0,1,0,0|2,0,0]=4 13564 B9R1.6 NC(=O)N1CCNCC1 Amb1118360 [0,1,0,1,0,0|2,0,0]=4 13565 B9R1.6 NC(=O)N1CCNCC1 Amb33550497 [0,1,0,1,0,0|2,0,0]=4 13566 B9R1.6 NC(=O)N1CCOCC1 Amb6373065 [0,1,0,1,0,0|2,0,0]=4 13567 B9R1.6 NC(=O)[C@@H]1CC=CCC1 Amb24182044 [0,1,0,1,0,0|0,0,2]=4 13568 B9R1.6 NC(=O)[C@@H]1CCCCN1 Amb25315367 [0,1,0,1,0,0|1,0,0]=3 13569 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb25757310 [0,1,0,1,0,0|1,0,0]=3 13570 B9R1.6 NC(=O)[C@@H]1CCCNC1 Amb31204722 [0,1,0,1,0,0|1,0,0]=3 13571 B9R1.6 NC(=O)[C@@H]1CNCCN1 Amb24183728 [0,1,0,1,0,0|2,0,0]=4 13572 B9R1.6 NC(=O)[C@@H]1CNCCO1 Amb28049786 [0,1,0,1,0,0|2,0,0]=4 13573 B9R1.6 NC(=O)[C@@H]1CSCCN1 Amb27950510 [0,1,0,1,0,0|2,0,0]=4 13574 B9R1.6 NC(=O)[C@H]1CCCCN1 Amb27490731 [0,1,0,1,0,0|1,0,0]=3 13575 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23401436 [0,1,0,1,0,0|1,0,0]=3 13576 B9R1.6 NC(=O)[C@H]1CCCNC1 Amb23439159 [0,1,0,1,0,0|1,0,0]=3 13577 B9R1.6 NC(=O)[C@H]1CCSCN1 Amb27613173 [0,1,0,1,0,0|2,0,0]=4 13578 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb27355135 [0,1,0,1,0,0|2,0,0]=4 13579 B9R1.6 NC(=O)[C@H]1CNCCN1 Amb8420820 [0,1,0,1,0,0|2,0,0]=4 13580 B9R1.6 NC(=O)[C@H]1CNCCO1 Amb27758345 [0,1,0,1,0,0|2,0,0]=4 13581 B9R1.6 NC(=O)[C@H]1CNCCO1 Amb28555661 [0,1,0,1,0,0|2,0,0]=4 13582 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27591943 [0,1,0,1,0,0|2,0,0]=4 13583 B9R1.6 NC(=O)[C@H]1COCCN1 Amb27838503 [0,1,0,1,0,0|2,0,0]=4 13584 B9R1.6 NC(=S)C1CCCCC1 Amb6373985 [0,1,0,1,0,0|0,1,0]=3 13585 B9R1.6 NC(=S)C1CCCCN1 Amb19148045 [0,1,0,1,0,0|1,1,0]=4 13586 B9R1.6 NC(=S)C1CCCCO1 Amb33377342 [0,1,0,1,0,0|1,1,0]=4 13587 B9R1.6 NC(=S)C1CCCCS1 Amb28185396 [0,1,0,1,0,0|1,1,0]=4 13588 B9R1.6 NC(=S)C1CCCNC1 Amb27423220 [0,1,0,1,0,0|1,1,0]=4 13589 B9R1.6 NC(=S)C1CCCOC1 Amb20668228 [0,1,0,1,0,0|1,1,0]=4 13590 B9R1.6 NC(=S)C1CCCSC1 Amb33224504 [0,1,0,1,0,0|1,1,0]=4 13591 B9R1.6 NC(=S)C1CCNCC1 Amb10607493 [0,1,0,1,0,0|1,1,0]=4 13592 B9R1.6 NC(=S)C1CCOCC1 Amb33530376 [0,1,0,1,0,0|1,1,0]=4 13593 B9R1.6 NC(=S)N1CCCCC1 Amb6358189 [0,1,0,1,0,0|1,1,0]=4 13594 B9R1.6 NC(=[NH2+])N1CCCCC1 Amb22269904 [0,1,0,1,0,0|2,0,0]=4 13595 B9R1.6 NS(=O)C1CCCCC1 Amb26389954 [0,1,0,1,0,0|1,0,0]=3 13596 B9R1.6 NS(=O)C1CCCOC1 Amb32720486 [0,1,0,1,0,0|2,0,0]=4 13597 B9R1.6 NS(=O)C1CCOCC1 Amb32720339 [0,1,0,1,0,0|2,0,0]=4 13598 B9R1.6 O=C(Cl)C1=CCCCC1 Amb21961756 [0,1,0,1,0,0|0,0,2]=4 13599 B9R1.6 O=C(Cl)C1CC=CCC1 Amb10844648 [0,1,0,1,0,0|0,0,2]=4 13600 B9R1.6 O=C(Cl)C1CCCCC1 Amb2792904 [0,1,0,1,0,0|0,0,0]=2 13601 B9R1.6 O=C(Cl)C1CCCCO1 Amb2723690 [0,1,0,1,0,0|1,0,0]=3 13602 B9R1.6 O=C(Cl)C1CCCCS1 Amb27658766 [0,1,0,1,0,0|1,0,0]=3 13603 B9R1.6 O=C(Cl)C1CCCOC1 Amb18280558 [0,1,0,1,0,0|1,0,0]=3 13604 B9R1.6 O=C(Cl)C1CCOCC1 Amb2723452 [0,1,0,1,0,0|1,0,0]=3 13605 B9R1.6 O=C(Cl)C1CCSCC1 Amb6572254 [0,1,0,1,0,0|1,0,0]=3 13606 B9R1.6 O=C(Cl)N1CCCCC1 Amb17563099 [0,1,0,1,0,0|1,0,0]=3 13607 B9R1.6 O=C(Cl)N1CCOCC1 Amb6608771 [0,1,0,1,0,0|2,0,0]=4 13608 B9R1.6 O=C(Cl)N1CCSCC1 Amb25328755 [0,1,0,1,0,0|2,0,0]=4 13609 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [0,1,0,1,0,0|1,0,0]=3 13610 B9R1.6 O=C(O)C1=CCCCC1 Amb2720517 [0,1,0,1,0,0|0,0,2]=4 13611 B9R1.6 O=C(O)C1=NCCCC1 Amb24597785 [0,1,0,1,0,0|1,0,1]=4 13612 B9R1.6 O=C(O)C1C=CCCC1 Amb18642396 [0,1,0,1,0,0|0,0,2]=4 13613 B9R1.6 O=C(O)C1CC=CCC1 Amb2695197 [0,1,0,1,0,0|0,0,2]=4 13614 B9R1.6 O=C(O)C1CCCCC1 Amb2721294 [0,1,0,1,0,0|0,0,0]=2 13615 B9R1.6 O=C(O)C1CCCCN1 Amb6754083 [0,1,0,1,0,0|1,0,0]=3 13616 B9R1.6 O=C(O)C1CCCCN1 Amb9703161 [0,1,0,1,0,0|1,0,0]=3 13617 B9R1.6 O=C(O)C1CCCCO1 Amb2723689 [0,1,0,1,0,0|1,0,0]=3 13618 B9R1.6 O=C(O)C1CCCCS1 Amb18202314 [0,1,0,1,0,0|1,0,0]=3 13619 B9R1.6 O=C(O)C1CCCNC1 Amb6239367 [0,1,0,1,0,0|1,0,0]=3 13620 B9R1.6 O=C(O)C1CCCNC1 Amb9703145 [0,1,0,1,0,0|1,0,0]=3 13621 B9R1.6 O=C(O)C1CCCOC1 Amb1102367 [0,1,0,1,0,0|1,0,0]=3 13622 B9R1.6 O=C(O)C1CCCSC1 Amb33545067 [0,1,0,1,0,0|1,0,0]=3 13623 B9R1.6 O=C(O)C1CCCSS1 Amb24480090 [0,1,0,1,0,0|2,0,0]=4 13624 B9R1.6 O=C(O)C1CCNCC1 Amb2720245 [0,1,0,1,0,0|1,0,0]=3 13625 B9R1.6 O=C(O)C1CCNCC1 Amb932842 [0,1,0,1,0,0|1,0,0]=3 13626 B9R1.6 O=C(O)C1CCOCC1 Amb426862 [0,1,0,1,0,0|1,0,0]=3 13627 B9R1.6 O=C(O)C1CCOCN1 Amb28042897 [0,1,0,1,0,0|2,0,0]=4 13628 B9R1.6 O=C(O)C1CCSCC1 Amb6572253 [0,1,0,1,0,0|1,0,0]=3 13629 B9R1.6 O=C(O)C1CCSCN1 Amb1102215 [0,1,0,1,0,0|2,0,0]=4 13630 B9R1.6 O=C(O)C1CCSCN1 Amb22284134 [0,1,0,1,0,0|2,0,0]=4 13631 B9R1.6 O=C(O)C1CCSSC1 Amb26422767 [0,1,0,1,0,0|2,0,0]=4 13632 B9R1.6 O=C(O)C1CNCCN1 Amb22490977 [0,1,0,1,0,0|2,0,0]=4 13633 B9R1.6 O=C(O)C1CNCCN1 Amb2690349 [0,1,0,1,0,0|2,0,0]=4 13634 B9R1.6 O=C(O)C1CNCCN1 Amb2720318 [0,1,0,1,0,0|2,0,0]=4 13635 B9R1.6 O=C(O)C1CNCCO1 Amb16232076 [0,1,0,1,0,0|2,0,0]=4 13636 B9R1.6 O=C(O)C1CNCCO1 Amb2696640 [0,1,0,1,0,0|2,0,0]=4 13637 B9R1.6 O=C(O)C1CNCCS1 Amb8631056 [0,1,0,1,0,0|2,0,0]=4 13638 B9R1.6 O=C(O)C1COCCN1 Amb10607157 [0,1,0,1,0,0|2,0,0]=4 13639 B9R1.6 O=C(O)C1COCCN1 Amb2694767 [0,1,0,1,0,0|2,0,0]=4 13640 B9R1.6 O=C(O)C1COCCO1 Amb5399760 [0,1,0,1,0,0|2,0,0]=4 13641 B9R1.6 O=C(O)C1CSCCN1 Amb19888398 [0,1,0,1,0,0|2,0,0]=4 13642 B9R1.6 O=C(O)C1CSCCN1 Amb2695006 [0,1,0,1,0,0|2,0,0]=4 13643 B9R1.6 O=C(O)C1CSCCS1 Amb20622962 [0,1,0,1,0,0|2,0,0]=4 13644 B9R1.6 O=C(O)C1C[NH2+]CC[NH2+]1 Amb5722241 [0,1,0,1,0,0|2,0,0]=4 13645 B9R1.6 O=C(O)C1NCCCN1 Amb27473323 [0,1,0,1,0,0|2,0,0]=4 13646 B9R1.6 O=C(O)C1NCCCO1 Amb33193117 [0,1,0,1,0,0|2,0,0]=4 13647 B9R1.6 O=C(O)C1NCCCS1 Amb22899084 [0,1,0,1,0,0|2,0,0]=4 13648 B9R1.6 O=C(O)C1OCCCO1 Amb24715581 [0,1,0,1,0,0|2,0,0]=4 13649 B9R1.6 O=C(O)C1SCCCS1 Amb22167283 [0,1,0,1,0,0|2,0,0]=4 13650 B9R1.6 O=C(O)N1CCCCC1 Amb20242677 [0,1,0,1,0,0|1,0,0]=3 13651 B9R1.6 O=C(O)N1CCCCC1 Amb35825557 [0,1,0,1,0,0|1,0,0]=3 13652 B9R1.6 O=C(O)N1CCSCC1 Amb24099831 [0,1,0,1,0,0|2,0,0]=4 13653 B9R1.6 O=C(O)[C@@H]1CC=CCC1 Amb19131346 [0,1,0,1,0,0|0,0,2]=4 13654 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb2690345 [0,1,0,1,0,0|1,0,0]=3 13655 B9R1.6 O=C(O)[C@@H]1CCCCN1 Amb8384272 [0,1,0,1,0,0|1,0,0]=3 13656 B9R1.6 O=C(O)[C@@H]1CCCCO1 Amb22746821 [0,1,0,1,0,0|1,0,0]=3 13657 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb16232354 [0,1,0,1,0,0|1,0,0]=3 13658 B9R1.6 O=C(O)[C@@H]1CCCNC1 Amb8628966 [0,1,0,1,0,0|1,0,0]=3 13659 B9R1.6 O=C(O)[C@@H]1CCCNN1 Amb30666630 [0,1,0,1,0,0|2,0,0]=4 13660 B9R1.6 O=C(O)[C@@H]1CCCOC1 Amb26885613 [0,1,0,1,0,0|1,0,0]=3 13661 B9R1.6 O=C(O)[C@@H]1CCCSC1 Amb27826589 [0,1,0,1,0,0|1,0,0]=3 13662 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307277 [0,1,0,1,0,0|2,0,0]=4 13663 B9R1.6 O=C(O)[C@@H]1CNCCN1 Amb6307319 [0,1,0,1,0,0|2,0,0]=4 13664 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb22737231 [0,1,0,1,0,0|2,0,0]=4 13665 B9R1.6 O=C(O)[C@@H]1CNCCO1 Amb8631069 [0,1,0,1,0,0|2,0,0]=4 13666 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb10576585 [0,1,0,1,0,0|2,0,0]=4 13667 B9R1.6 O=C(O)[C@@H]1COCCN1 Amb2696709 [0,1,0,1,0,0|2,0,0]=4 13668 B9R1.6 O=C(O)[C@@H]1COCCO1 Amb23438856 [0,1,0,1,0,0|2,0,0]=4 13669 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb22386830 [0,1,0,1,0,0|2,0,0]=4 13670 B9R1.6 O=C(O)[C@@H]1CSCCN1 Amb8630483 [0,1,0,1,0,0|2,0,0]=4 13671 B9R1.6 O=C(O)[C@H]1CC=CCC1 Amb17611453 [0,1,0,1,0,0|0,0,2]=4 13672 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb2700060 [0,1,0,1,0,0|1,0,0]=3 13673 B9R1.6 O=C(O)[C@H]1CCCCN1 Amb8515100 [0,1,0,1,0,0|1,0,0]=3 13674 B9R1.6 O=C(O)[C@H]1CCCCO1 Amb26865454 [0,1,0,1,0,0|1,0,0]=3 13675 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8384271 [0,1,0,1,0,0|1,0,0]=3 13676 B9R1.6 O=C(O)[C@H]1CCCNC1 Amb8389307 [0,1,0,1,0,0|1,0,0]=3 13677 B9R1.6 O=C(O)[C@H]1CCCNN1 Amb27154761 [0,1,0,1,0,0|2,0,0]=4 13678 B9R1.6 O=C(O)[C@H]1CCCSC1 Amb27809148 [0,1,0,1,0,0|1,0,0]=3 13679 B9R1.6 O=C(O)[C@H]1CCSCN1 Amb25773953 [0,1,0,1,0,0|2,0,0]=4 13680 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb20241207 [0,1,0,1,0,0|2,0,0]=4 13681 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb2694998 [0,1,0,1,0,0|2,0,0]=4 13682 B9R1.6 O=C(O)[C@H]1CNCCN1 Amb8628465 [0,1,0,1,0,0|2,0,0]=4 13683 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb10067023 [0,1,0,1,0,0|2,0,0]=4 13684 B9R1.6 O=C(O)[C@H]1CNCCO1 Amb22737232 [0,1,0,1,0,0|2,0,0]=4 13685 B9R1.6 O=C(O)[C@H]1COCCN1 Amb16232575 [0,1,0,1,0,0|2,0,0]=4 13686 B9R1.6 O=C(O)[C@H]1COCCN1 Amb2696766 [0,1,0,1,0,0|2,0,0]=4 13687 B9R1.6 O=C(O)[C@H]1COCCO1 Amb26430807 [0,1,0,1,0,0|2,0,0]=4 13688 B9R1.6 O=C(O)[C@H]1CSCCN1 Amb2700568 [0,1,0,1,0,0|2,0,0]=4 13689 B9R1.6 O=S(Cl)C1CCCCC1 Amb25305792 [0,1,0,1,0,0|1,0,0]=3 13690 B9R1.6 O=S(Cl)C1CCCOC1 Amb32720485 [0,1,0,1,0,0|2,0,0]=4 13691 B9R1.6 O=S(Cl)C1CCOCC1 Amb25993855 [0,1,0,1,0,0|2,0,0]=4 13692 B9R1.6 O=S(O)C1CCCCC1 Amb24603074 [0,1,0,1,0,0|1,0,0]=3 13693 B9R1.6 O=S([O-])C1CCCCC1 Amb19893330 [0,1,0,1,0,0|1,0,0]=3 13694 B9R1.6 O=S([O-])C1CCCNC1 Amb32755644 [0,1,0,1,0,0|2,0,0]=4 13695 B9R1.6 O=S([O-])C1CCCOC1 Amb28281775 [0,1,0,1,0,0|2,0,0]=4 13696 B9R1.6 O=S([O-])C1CCOCC1 Amb33549506 [0,1,0,1,0,0|2,0,0]=4 13697 B9R1.6 O=[N+]([O-])C1CCCCC1 Amb10604036 [0,1,0,1,0,0|1,0,0]=3 13698 B9R1.6 O=[N+]([O-])C1CCCOC1 Amb33298985 [0,1,0,1,0,0|2,0,0]=4 13699 B9R1.6 O=[N+]([O-])C1CCCSC1 Amb33299017 [0,1,0,1,0,0|2,0,0]=4 13700 B9R1.6 O=[N+]([O-])C1CCNCC1 Amb22330560 [0,1,0,1,0,0|2,0,0]=4 13701 B9R1.6 O=[N+]([O-])C1CCOCC1 Amb21960815 [0,1,0,1,0,0|2,0,0]=4 13702 B9R1.6 O=[N+]([O-])C1CCSCC1 Amb33299033 [0,1,0,1,0,0|2,0,0]=4 13703 B9R1.6 O=[N+]([O-])N1CCCCC1 Amb28283539 [0,1,0,1,0,0|2,0,0]=4 13704 B9R1.6 O=[PH](O)C1CCCCN1 Amb28131021 [0,1,0,1,0,0|2,0,0]=4 13705 B9R1.6 OB(O)C1CCCCC1 Amb1630358 [0,1,0,1,0,0|1,0,1]=4 13706 B9R1.6 S=C([S-])N1CCCCC1 Amb19748283 [0,1,0,1,0,0|1,1,0]=4 13707 B9R1.6 S=C([S-])N1CCCCC1 Amb4263090 [0,1,0,1,0,0|1,1,0]=4 13708 B9R1.6 S=C([S-])N1CCCCC1 Amb534229 [0,1,0,1,0,0|1,1,0]=4 13709 B9R1.6 [O-]C(=S)C1CCCCO1 Amb27262534 [0,1,0,1,0,0|1,0,1]=4 13710 B9R1.13 BrC(Br)=CC1CCCC1 Amb27162089 [0,1,0,1,0,0|1,0,1]=4 13711 B9R1.13 C=C(Br)CN1CCCC1 Amb4161094 [0,1,0,1,0,0|2,0,0]=4 13712 B9R1.13 C=C(C)CC1CCCC1 Amb22052678 [0,1,0,1,0,0|1,0,0]=3 13713 B9R1.13 C=C(C)CC1CCCN1 Amb25162820 [0,1,0,1,0,0|2,0,0]=4 13714 B9R1.13 C=C(C)CC1CCCO1 Amb29857297 [0,1,0,1,0,0|2,0,0]=4 13715 B9R1.13 C=C(C)CC1CCNC1 Amb27866319 [0,1,0,1,0,0|2,0,0]=4 13716 B9R1.13 C=C(C)CC1CCOC1 Amb29857298 [0,1,0,1,0,0|2,0,0]=4 13717 B9R1.13 CC(=O)C=C1CCCC1 Amb2699510 [0,1,0,1,0,0|0,0,2]=4 13718 B9R1.13 CC(=O)CC1C=CCC1 Amb2721318 [0,1,0,1,0,0|0,0,2]=4 13719 B9R1.13 CC(=O)CC1CCCC1 Amb2721149 [0,1,0,1,0,0|0,0,0]=2 13720 B9R1.13 CC(=O)CC1CCCN1 Amb24064067 [0,1,0,1,0,0|1,0,0]=3 13721 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [0,1,0,1,0,0|1,0,0]=3 13722 B9R1.13 CC(=O)CC1CCCS1 Amb33416251 [0,1,0,1,0,0|1,0,0]=3 13723 B9R1.13 CC(=O)CC1CCNC1 Amb26624949 [0,1,0,1,0,0|1,0,0]=3 13724 B9R1.13 CC(=O)CC1CCOC1 Amb20622791 [0,1,0,1,0,0|1,0,0]=3 13725 B9R1.13 CC(=O)CC1CCSC1 Amb33141833 [0,1,0,1,0,0|1,0,0]=3 13726 B9R1.13 CC(=O)CC1OCCO1 Amb22359800 [0,1,0,1,0,0|2,0,0]=4 13727 B9R1.13 CC(=O)C[C@H]1CCCN1 Amb25887375 [0,1,0,1,0,0|1,0,0]=3 13728 B9R1.13 CC(=O)NC1CCCC1 Amb3367351 [0,1,0,1,0,0|1,0,0]=3 13729 B9R1.13 CC(=O)NC1CCCN1 Amb28400896 [0,1,0,1,0,0|2,0,0]=4 13730 B9R1.13 CC(=O)NC1CCNC1 Amb32412611 [0,1,0,1,0,0|2,0,0]=4 13731 B9R1.13 CC(=O)NC1CCNC1 Amb33531966 [0,1,0,1,0,0|2,0,0]=4 13732 B9R1.13 CC(=O)N[C@@H]1CCNC1 Amb10067002 [0,1,0,1,0,0|2,0,0]=4 13733 B9R1.13 CC(=O)N[C@H]1CCNC1 Amb22744974 [0,1,0,1,0,0|2,0,0]=4 13734 B9R1.13 CC(=O)N[C@H]1CCNC1 Amb8631248 [0,1,0,1,0,0|2,0,0]=4 13735 B9R1.13 CC(=O)OC1CCCO1 Amb22270198 [0,1,0,1,0,0|2,0,0]=4 13736 B9R1.13 CC(=O)OC1CCNC1 Amb22011811 [0,1,0,1,0,0|2,0,0]=4 13737 B9R1.13 CC(=O)O[C@H]1CCNC1 Amb27592400 [0,1,0,1,0,0|2,0,0]=4 13738 B9R1.13 CC(=O)O[C@H]1CCOC1 Amb27254860 [0,1,0,1,0,0|2,0,0]=4 13739 B9R1.13 CC(=O)SC1CCCC1 Amb22337902 [0,1,0,1,0,0|1,0,0]=3 13740 B9R1.13 CC(=O)SC1CCOC1 Amb13892074 [0,1,0,1,0,0|2,0,0]=4 13741 B9R1.13 CC(Br)CC1CCCC1 Amb24693833 [0,1,0,1,0,0|1,0,1]=4 13742 B9R1.13 CC(Br)CC1CCCO1 Amb29857136 [0,1,0,1,0,0|0,0,2]=4 13743 B9R1.13 CC(Br)CC1CCCS1 Amb33433064 [0,1,0,1,0,0|0,1,1]=4 13744 B9R1.13 CC(Br)CC1CCOC1 Amb29857307 [0,1,0,1,0,0|2,0,0]=4 13745 B9R1.13 CC(Br)CC1CCSC1 Amb33333801 [0,1,0,1,0,0|2,0,0]=4 13746 B9R1.13 CC(C)CC1CC=CC1 Amb30031996 [0,1,0,1,0,0|1,0,1]=4 13747 B9R1.13 CC(C)CC1CCCC1 Amb22230763 [0,1,0,1,0,0|1,0,1]=4 13748 B9R1.13 CC(C)CC1CCCN1 Amb10068751 [0,1,0,1,0,0|1,0,1]=4 13749 B9R1.13 CC(C)CC1CCCN1 Amb17659147 [0,1,0,1,0,0|1,0,1]=4 13750 B9R1.13 CC(C)CC1CCNC1 Amb10607826 [0,1,0,1,0,0|2,0,0]=4 13751 B9R1.13 CC(C)CC1CCNC1 Amb32411737 [0,1,0,1,0,0|2,0,0]=4 13752 B9R1.13 CC(C)CC1CNC=N1 Amb35737130 [0,1,0,1,0,0|2,0,0]=4 13753 B9R1.13 CC(C)CC1N=CCS1 Amb27423568 [0,1,0,1,0,0|2,0,0]=4 13754 B9R1.13 CC(C)C[C@@H]1CCCN1 Amb25338158 [0,1,0,1,0,0|1,0,1]=4 13755 B9R1.13 CC(C)C[C@H]1CCCN1 Amb25757364 [0,1,0,1,0,0|1,0,1]=4 13756 B9R1.13 CC(Cl)CC1CC=CC1 Amb35629124 [0,1,0,1,0,0|1,0,1]=4 13757 B9R1.13 CC(Cl)CC1CCCO1 Amb29857074 [0,1,0,1,0,0|0,0,2]=4 13758 B9R1.13 CC(Cl)CC1CCOC1 Amb29857271 [0,1,0,1,0,0|2,0,0]=4 13759 B9R1.13 CC(Cl)CC1CCSC1 Amb35688984 [0,1,0,1,0,0|2,0,0]=4 13760 B9R1.13 CC(F)CC1CCNC1 Amb27967975 [0,1,0,1,0,0|2,0,0]=4 13761 B9R1.13 CC(N)CC1CC=CC1 Amb30032897 [0,1,0,1,0,0|1,0,1]=4 13762 B9R1.13 CC(N)CC1CCCC1 Amb18962767 [0,1,0,1,0,0|1,0,1]=4 13763 B9R1.13 CC(N)CC1CCCO1 Amb13952622 [0,1,0,1,0,0|0,0,2]=4 13764 B9R1.13 CC(N)CC1CCOC1 Amb18959070 [0,1,0,1,0,0|2,0,0]=4 13765 B9R1.13 CC(N)CC1CCSC1 Amb29857282 [0,1,0,1,0,0|2,0,0]=4 13766 B9R1.13 CC(O)CC1C=CCO1 Amb27191727 [0,1,0,1,0,0|2,0,0]=4 13767 B9R1.13 CC(O)CC1CC=CC1 Amb30032965 [0,1,0,1,0,0|1,0,1]=4 13768 B9R1.13 CC(O)CC1CCCC1 Amb26484484 [0,1,0,1,0,0|0,0,2]=4 13769 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|1,0,1]=4 13770 B9R1.13 CC(O)CC1CCCO1 Amb27979742 [0,1,0,1,0,0|0,0,2]=4 13771 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|0,1,1]=4 13772 B9R1.13 CC(O)CC1CCNC1 Amb27258166 [0,1,0,1,0,0|2,0,0]=4 13773 B9R1.13 CC(O)CC1CCOC1 Amb25888927 [0,1,0,1,0,0|2,0,0]=4 13774 B9R1.13 CC(O)CC1CCSC1 Amb33345807 [0,1,0,1,0,0|2,0,0]=4 13775 B9R1.13 CC(S)CC1CCCC1 Amb29857286 [0,1,0,1,0,0|0,1,1]=4 13776 B9R1.13 CC(S)CC1CCCN1 Amb32788357 [0,1,0,1,0,0|1,0,1]=4 13777 B9R1.13 CC(S)CC1CCCO1 Amb29857287 [0,1,0,1,0,0|0,0,2]=4 13778 B9R1.13 CC(S)CC1CCOC1 Amb29857288 [0,1,0,1,0,0|2,0,0]=4 13779 B9R1.13 CN(C)CC1CCCC1 Amb17231852 [0,1,0,1,0,0|2,0,0]=4 13780 B9R1.13 CN(O)CC1CCCC1 Amb33378902 [0,1,0,1,0,0|1,0,1]=4 13781 B9R1.13 CS(=O)NC1CCCC1 Amb27191965 [0,1,0,1,0,0|2,0,0]=4 13782 B9R1.13 C[C@@H](N)CC1CCCC1 Amb28423841 [0,1,0,1,0,0|1,0,1]=4 13783 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|0,0,2]=4 13784 B9R1.13 C[C@@H](N)CC1CCCS1 Amb33416796 [0,1,0,1,0,0|0,1,1]=4 13785 B9R1.13 C[C@@H](N)CC1CCOC1 Amb25720103 [0,1,0,1,0,0|2,0,0]=4 13786 B9R1.13 C[C@@H](N)CC1CCSC1 Amb33141507 [0,1,0,1,0,0|2,0,0]=4 13787 B9R1.13 C[C@@H](O)CC1CCCC1 Amb33315749 [0,1,0,1,0,0|0,0,2]=4 13788 B9R1.13 C[C@@H](O)CC1CCCO1 Amb33318696 [0,1,0,1,0,0|0,0,2]=4 13789 B9R1.13 C[C@@H](O)CC1CCCS1 Amb33415844 [0,1,0,1,0,0|0,1,1]=4 13790 B9R1.13 C[C@@H](O)CC1CCOC1 Amb33420739 [0,1,0,1,0,0|2,0,0]=4 13791 B9R1.13 C[C@@H](O)CC1CCSC1 Amb33141518 [0,1,0,1,0,0|2,0,0]=4 13792 B9R1.13 C[C@@H](O)C[C@@H]1C=CCO1 Amb28346422 [0,1,0,1,0,0|2,0,0]=4 13793 B9R1.13 C[C@@H](O)C[C@@H]1CCCO1 Amb27196849 [0,1,0,1,0,0|0,0,2]=4 13794 B9R1.13 C[C@H](N)CC1CCCC1 Amb27949784 [0,1,0,1,0,0|1,0,1]=4 13795 B9R1.13 C[C@H](N)CC1CCCO1 Amb27804405 [0,1,0,1,0,0|0,0,2]=4 13796 B9R1.13 C[C@H](N)CC1CCCS1 Amb33416790 [0,1,0,1,0,0|0,1,1]=4 13797 B9R1.13 C[C@H](N)CC1CCOC1 Amb26933577 [0,1,0,1,0,0|2,0,0]=4 13798 B9R1.13 C[C@H](N)CC1CCSC1 Amb33141501 [0,1,0,1,0,0|2,0,0]=4 13799 B9R1.13 C[C@H](O)CC1CCCC1 Amb33315750 [0,1,0,1,0,0|0,0,2]=4 13800 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|0,0,2]=4 13801 B9R1.13 C[C@H](O)CC1CCCS1 Amb33415845 [0,1,0,1,0,0|0,1,1]=4 13802 B9R1.13 C[C@H](O)CC1CCOC1 Amb33420740 [0,1,0,1,0,0|2,0,0]=4 13803 B9R1.13 C[C@H](O)CC1CCSC1 Amb33141519 [0,1,0,1,0,0|2,0,0]=4 13804 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [0,1,0,1,0,0|1,0,1]=4 13805 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [0,1,0,1,0,0|1,0,1]=4 13806 B9R1.13 C[C@H](O)C[C@H]1CCCO1 Amb28206139 [0,1,0,1,0,0|0,0,2]=4 13807 B9R1.13 N=C(N)CC1CCCC1 Amb28381044 [0,1,0,1,0,0|1,0,0]=3 13808 B9R1.13 N=C(N)CC1CCCC1 Amb28934951 [0,1,0,1,0,0|1,0,0]=3 13809 B9R1.13 N=C(N)CC1CCCS1 Amb33416788 [0,1,0,1,0,0|2,0,0]=4 13810 B9R1.13 N=C(N)CC1CCOC1 Amb25132816 [0,1,0,1,0,0|2,0,0]=4 13811 B9R1.13 N=C(N)CC1CCSC1 Amb32672202 [0,1,0,1,0,0|2,0,0]=4 13812 B9R1.13 N=C(N)CN1CCCC1 Amb33548937 [0,1,0,1,0,0|2,0,0]=4 13813 B9R1.13 N=C(N)CN1CCCC1 Amb6258627 [0,1,0,1,0,0|2,0,0]=4 13814 B9R1.13 N=C(N)NC1CCCC1 Amb17773433 [0,1,0,1,0,0|2,0,0]=4 13815 B9R1.13 N=C(N)NC1CCCC1 Amb22828136 [0,1,0,1,0,0|2,0,0]=4 13816 B9R1.13 N=C(N)NC1CCCC1 Amb6419484 [0,1,0,1,0,0|2,0,0]=4 13817 B9R1.13 N=C(N)SC1CCCC1 Amb27461692 [0,1,0,1,0,0|2,0,0]=4 13818 B9R1.13 NC(=O)C=C1CCCC1 Amb20622621 [0,1,0,1,0,0|0,0,2]=4 13819 B9R1.13 NC(=O)CC1C=CCC1 Amb16233726 [0,1,0,1,0,0|0,0,2]=4 13820 B9R1.13 NC(=O)CC1CC=CC1 Amb27837715 [0,1,0,1,0,0|0,0,2]=4 13821 B9R1.13 NC(=O)CC1CCCC1 Amb6892422 [0,1,0,1,0,0|0,0,0]=2 13822 B9R1.13 NC(=O)CC1CCCN1 Amb18282785 [0,1,0,1,0,0|1,0,0]=3 13823 B9R1.13 NC(=O)CC1CCCN1 Amb28934952 [0,1,0,1,0,0|1,0,0]=3 13824 B9R1.13 NC(=O)CC1CCNC1 Amb27169655 [0,1,0,1,0,0|1,0,0]=3 13825 B9R1.13 NC(=O)CC1CCNC1 Amb32653198 [0,1,0,1,0,0|1,0,0]=3 13826 B9R1.13 NC(=O)CC1CCNC1 Amb32667283 [0,1,0,1,0,0|1,0,0]=3 13827 B9R1.13 NC(=O)CC1CCSC1 Amb32672204 [0,1,0,1,0,0|1,0,0]=3 13828 B9R1.13 NC(=O)CC1CCSS1 Amb27814178 [0,1,0,1,0,0|2,0,0]=4 13829 B9R1.13 NC(=O)CC1OCCO1 Amb27837657 [0,1,0,1,0,0|2,0,0]=4 13830 B9R1.13 NC(=O)CN1CCCO1 Amb27170000 [0,1,0,1,0,0|2,0,0]=4 13831 B9R1.13 NC(=O)CN1CCSC1 Amb27759902 [0,1,0,1,0,0|2,0,0]=4 13832 B9R1.13 NC(=O)C[C@@H]1CCNC1 Amb35688629 [0,1,0,1,0,0|1,0,0]=3 13833 B9R1.13 NC(=O)C[C@H]1CCNC1 Amb35674876 [0,1,0,1,0,0|1,0,0]=3 13834 B9R1.13 NC(=O)C[C@H]1CCOC1 Amb27837647 [0,1,0,1,0,0|1,0,0]=3 13835 B9R1.13 NC(=O)NC1CCCC1 Amb1151267 [0,1,0,1,0,0|1,0,0]=3 13836 B9R1.13 NC(=O)NC1CCNC1 Amb28934939 [0,1,0,1,0,0|2,0,0]=4 13837 B9R1.13 NC(=O)NC1CCNC1 Amb9467923 [0,1,0,1,0,0|2,0,0]=4 13838 B9R1.13 NC(=O)NC1CCOC1 Amb28046693 [0,1,0,1,0,0|2,0,0]=4 13839 B9R1.13 NC(=O)N[C@H]1CCNC1 Amb27838506 [0,1,0,1,0,0|2,0,0]=4 13840 B9R1.13 NC(=O)OC1CCCC1 Amb2617542 [0,1,0,1,0,0|1,0,0]=3 13841 B9R1.13 NC(=S)CC1CCCC1 Amb26475206 [0,1,0,1,0,0|0,1,0]=3 13842 B9R1.13 NC(=S)CC1CCCO1 Amb6242594 [0,1,0,1,0,0|1,1,0]=4 13843 B9R1.13 NC(=S)CC1CCCS1 Amb33416787 [0,1,0,1,0,0|1,1,0]=4 13844 B9R1.13 NC(=S)CC1CCOC1 Amb27971678 [0,1,0,1,0,0|1,1,0]=4 13845 B9R1.13 NC(=S)CC1CCSC1 Amb32672203 [0,1,0,1,0,0|1,1,0]=4 13846 B9R1.13 NC(=S)CN1CCCC1 Amb6268794 [0,1,0,1,0,0|1,1,0]=4 13847 B9R1.13 NC(=S)NC1CCCC1 Amb1105651 [0,1,0,1,0,0|1,1,0]=4 13848 B9R1.13 NC(N)=NC1CCCC1 Amb19338139 [0,1,0,1,0,0|2,0,0]=4 13849 B9R1.13 NC(N)=NC1CCCC1 Amb33527554 [0,1,0,1,0,0|2,0,0]=4 13850 B9R1.13 NS(=O)CC1CCCC1 Amb32720316 [0,1,0,1,0,0|1,0,0]=3 13851 B9R1.13 NS(=O)CC1CCCO1 Amb32720353 [0,1,0,1,0,0|2,0,0]=4 13852 B9R1.13 NS(=O)CC1CCOC1 Amb32720367 [0,1,0,1,0,0|2,0,0]=4 13853 B9R1.13 O=C(Cl)CC1CCCC1 Amb3939570 [0,1,0,1,0,0|0,0,0]=2 13854 B9R1.13 O=C(Cl)CC1CCCN1 Amb27792098 [0,1,0,1,0,0|1,0,0]=3 13855 B9R1.13 O=C(Cl)CC1CCCO1 Amb25921099 [0,1,0,1,0,0|1,0,0]=3 13856 B9R1.13 O=C(Cl)CC1CCOC1 Amb22642272 [0,1,0,1,0,0|1,0,0]=3 13857 B9R1.13 O=C(Cl)CN1CCCC1 Amb17142871 [0,1,0,1,0,0|1,0,0]=3 13858 B9R1.13 O=C(Cl)NC1CCCC1 Amb35637068 [0,1,0,1,0,0|1,0,0]=3 13859 B9R1.13 O=C(Cl)NC1CCOC1 Amb35625931 [0,1,0,1,0,0|2,0,0]=4 13860 B9R1.13 O=C(Cl)NC1CCSC1 Amb35633199 [0,1,0,1,0,0|2,0,0]=4 13861 B9R1.13 O=C(Cl)OC1CCCC1 Amb10070029 [0,1,0,1,0,0|1,0,0]=3 13862 B9R1.13 O=C(Cl)OC1CCOC1 Amb33533648 [0,1,0,1,0,0|2,0,0]=4 13863 B9R1.13 O=C(Cl)OC1CCSC1 Amb28051650 [0,1,0,1,0,0|2,0,0]=4 13864 B9R1.13 O=C(Cl)O[C@@H]1CCOC1 Amb33297310 [0,1,0,1,0,0|2,0,0]=4 13865 B9R1.13 O=C(Cl)O[C@H]1CCOC1 Amb33297142 [0,1,0,1,0,0|2,0,0]=4 13866 B9R1.13 O=C(O)C=C1CCCC1 Amb4036043 [0,1,0,1,0,0|0,0,2]=4 13867 B9R1.13 O=C(O)CC1=CCCC1 Amb18642404 [0,1,0,1,0,0|0,0,2]=4 13868 B9R1.13 O=C(O)CC1C=CCC1 Amb9703199 [0,1,0,1,0,0|0,0,2]=4 13869 B9R1.13 O=C(O)CC1CC=CC1 Amb25673915 [0,1,0,1,0,0|0,0,2]=4 13870 B9R1.13 O=C(O)CC1CCCC1 Amb16192937 [0,1,0,1,0,0|0,0,0]=2 13871 B9R1.13 O=C(O)CC1CCCC1 Amb3939847 [0,1,0,1,0,0|0,0,0]=2 13872 B9R1.13 O=C(O)CC1CCCN1 Amb20668514 [0,1,0,1,0,0|1,0,0]=3 13873 B9R1.13 O=C(O)CC1CCCN1 Amb8387921 [0,1,0,1,0,0|1,0,0]=3 13874 B9R1.13 O=C(O)CC1CCCO1 Amb9713389 [0,1,0,1,0,0|1,0,0]=3 13875 B9R1.13 O=C(O)CC1CCNC1 Amb2695002 [0,1,0,1,0,0|1,0,0]=3 13876 B9R1.13 O=C(O)CC1CCNC1 Amb33549788 [0,1,0,1,0,0|1,0,0]=3 13877 B9R1.13 O=C(O)CC1CCOC1 Amb2696440 [0,1,0,1,0,0|1,0,0]=3 13878 B9R1.13 O=C(O)CC1CCSC1 Amb18202318 [0,1,0,1,0,0|1,0,0]=3 13879 B9R1.13 O=C(O)CC1CCSS1 Amb8388096 [0,1,0,1,0,0|2,0,0]=4 13880 B9R1.13 O=C(O)CC1CSCN1 Amb32990250 [0,1,0,1,0,0|2,0,0]=4 13881 B9R1.13 O=C(O)CC1NCCS1 Amb18644340 [0,1,0,1,0,0|2,0,0]=4 13882 B9R1.13 O=C(O)CC1OCCO1 Amb22740193 [0,1,0,1,0,0|2,0,0]=4 13883 B9R1.13 O=C(O)CN1CCCC1 Amb535912 [0,1,0,1,0,0|1,0,0]=3 13884 B9R1.13 O=C(O)CN1CCCC1 Amb9677391 [0,1,0,1,0,0|1,0,0]=3 13885 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb13891876 [0,1,0,1,0,0|1,0,0]=3 13886 B9R1.13 O=C(O)C[C@@H]1CCCN1 Amb8630792 [0,1,0,1,0,0|1,0,0]=3 13887 B9R1.13 O=C(O)C[C@@H]1CCCO1 Amb24271115 [0,1,0,1,0,0|1,0,0]=3 13888 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb10067024 [0,1,0,1,0,0|1,0,0]=3 13889 B9R1.13 O=C(O)C[C@@H]1CCNC1 Amb26948232 [0,1,0,1,0,0|1,0,0]=3 13890 B9R1.13 O=C(O)C[C@@H]1CCOC1 Amb25887272 [0,1,0,1,0,0|1,0,0]=3 13891 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb16184011 [0,1,0,1,0,0|1,0,0]=3 13892 B9R1.13 O=C(O)C[C@H]1CCCN1 Amb33295230 [0,1,0,1,0,0|1,0,0]=3 13893 B9R1.13 O=C(O)C[C@H]1CCCO1 Amb24271109 [0,1,0,1,0,0|1,0,0]=3 13894 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb2696648 [0,1,0,1,0,0|1,0,0]=3 13895 B9R1.13 O=C(O)C[C@H]1CCNC1 Amb8384306 [0,1,0,1,0,0|1,0,0]=3 13896 B9R1.13 O=C(O)C[C@H]1CCOC1 Amb23401495 [0,1,0,1,0,0|1,0,0]=3 13897 B9R1.13 O=S(Cl)CC1CCCC1 Amb32720315 [0,1,0,1,0,0|1,0,0]=3 13898 B9R1.13 O=S(Cl)CC1CCCO1 Amb26405116 [0,1,0,1,0,0|2,0,0]=4 13899 B9R1.13 O=S(Cl)CC1CCOC1 Amb32720366 [0,1,0,1,0,0|2,0,0]=4 13900 B9R1.13 O=S([O-])CC1CCCC1 Amb27635722 [0,1,0,1,0,0|1,0,0]=3 13901 B9R1.13 O=S([O-])CC1CCCO1 Amb27665315 [0,1,0,1,0,0|2,0,0]=4 13902 B9R1.13 O=S([O-])CC1CCNC1 Amb32755771 [0,1,0,1,0,0|2,0,0]=4 13903 B9R1.13 O=S([O-])CC1CCOC1 Amb32754269 [0,1,0,1,0,0|2,0,0]=4 13904 B9R1.13 O=[N+]([O-])CC1CCCC1 Amb33315744 [0,1,0,1,0,0|1,0,0]=3 13905 B9R1.13 O=[N+]([O-])CC1CCCO1 Amb33318663 [0,1,0,1,0,0|2,0,0]=4 13906 B9R1.13 O=[N+]([O-])CC1CCCS1 Amb33414420 [0,1,0,1,0,0|2,0,0]=4 13907 B9R1.13 O=[N+]([O-])CC1CCNC1 Amb18203199 [0,1,0,1,0,0|2,0,0]=4 13908 B9R1.13 O=[N+]([O-])CC1CCOC1 Amb32675285 [0,1,0,1,0,0|2,0,0]=4 13909 B9R1.13 O=[N+]([O-])CC1CCSC1 Amb33141506 [0,1,0,1,0,0|2,0,0]=4 13910 B9R1.13 OB(O)CC1CCCC1 Amb25320686 [0,1,0,1,0,0|1,0,1]=4 13911 B9R1.13 S=C(S)NC1CCCC1 Amb28185894 [0,1,0,1,0,0|1,1,0]=4 13912 B9R1.24 C#CC1CCCC1(C)C Amb33169138 [0,1,0,1,0,0|1,0,1]=4 13913 B9R1.24 C=CC1CCSC1(C)C Amb33339525 [0,1,0,1,0,0|2,0,0]=4 13914 B9R1.24 CC1(C)CCCC1C#N Amb28342141 [0,1,0,1,0,0|1,0,1]=4 13915 B9R1.24 CC1(C)CCCC1CBr Amb28347469 [0,1,0,1,0,0|1,0,1]=4 13916 B9R1.24 CC1(C)CCCC1CCl Amb25934181 [0,1,0,1,0,0|1,0,1]=4 13917 B9R1.24 CC1(C)CCCC1CN Amb8496596 [0,1,0,1,0,0|1,0,1]=4 13918 B9R1.24 CC1(C)CCCC1CO Amb25698070 [0,1,0,1,0,0|0,0,2]=4 13919 B9R1.24 CC1(C)CCCC1NN Amb33531478 [0,1,0,1,0,0|2,0,0]=4 13920 B9R1.24 CC1(C)CCOC1C=O Amb21961947 [0,1,0,1,0,0|1,0,0]=3 13921 B9R1.24 CC1(C)OCCC1C=O Amb18642605 [0,1,0,1,0,0|1,0,0]=3 13922 B9R1.24 CC1(C)SCCC1C=O Amb18124698 [0,1,0,1,0,0|1,0,0]=3 13923 B9R1.24 CC1(F)CCCC1CN Amb28326209 [0,1,0,1,0,0|1,0,1]=4 13924 B9R1.24 CC1(O)CCC=C1C=O Amb27598645 [0,1,0,1,0,0|0,0,2]=4 13925 B9R1.24 CC1(O)CCCC1CO Amb28315472 [0,1,0,1,0,0|0,0,2]=4 13926 B9R1.24 CCC1CCCC1(C)N Amb32654937 [0,1,0,1,0,0|1,0,1]=4 13927 B9R1.24 CCC1CCCC1(C)N Amb32676685 [0,1,0,1,0,0|1,0,1]=4 13928 B9R1.24 CCC1CCCC1(F)F Amb32654528 [0,1,0,1,0,0|1,0,1]=4 13929 B9R1.24 CCC1CCNS1(=O)=O Amb33298957 [0,1,0,1,0,0|2,0,0]=4 13930 B9R1.24 CCC1CCOS1(=O)=O Amb27246498 [0,1,0,1,0,0|2,0,0]=4 13931 B9R1.24 CCN1CCCS1(=O)=O Amb20075620 [0,1,0,1,0,0|2,0,0]=4 13932 B9R1.24 CO[C@@H]1CCC[C@@]1(C)Br Amb27624708 [0,1,0,1,0,0|2,0,0]=4 13933 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [0,1,0,1,0,0|0,0,2]=4 13934 B9R1.24 C[C@@]1(N)CCC[C@H]1CO Amb28055666 [0,1,0,1,0,0|0,0,2]=4 13935 B9R1.24 C[C@]1(N)CCC[C@H]1CO Amb1993801 [0,1,0,1,0,0|0,0,2]=4 13936 B9R1.24 NCC1CCCS1(=O)=O Amb17063302 [0,1,0,1,0,0|2,0,0]=4 13937 B9R1.24 NCC1CCCS1(=O)=O Amb32662917 [0,1,0,1,0,0|2,0,0]=4 13938 B9R1.24 O=CC1CCCC1(F)F Amb24457997 [0,1,0,1,0,0|1,0,0]=3 13939 B9R1.24 O=CC1CCCS1(=O)=O Amb27827893 [0,1,0,1,0,0|2,0,0]=4 13940 B9R1.24 O=S1(=O)CCCC1CCl Amb25808547 [0,1,0,1,0,0|2,0,0]=4 13941 B9R1.24 O=S1(=O)CCCC1CI Amb35732753 [0,1,0,1,0,0|2,0,0]=4 13942 B9R1.24 O=S1(=O)CCCC1CO Amb26400526 [0,1,0,1,0,0|2,0,0]=4 13943 B9R1.24 O=S1(=O)CCCC1CS Amb35673162 [0,1,0,1,0,0|2,0,0]=4 13944 B9R1.40 C=C1CCNCC1(C)C Amb27956586 [0,1,0,1,0,0|2,0,0]=4 13945 B9R1.40 CC1(Br)CCCCC1=O Amb17594983 [0,1,0,1,0,0|0,0,0]=2 13946 B9R1.40 CC1(Br)CCCCC1O Amb28064001 [0,1,0,1,0,0|0,0,2]=4 13947 B9R1.40 CC1(C)C=CCCC1=O Amb27838775 [0,1,0,1,0,0|0,0,2]=4 13948 B9R1.40 CC1(C)CCC=CC1=O Amb22356996 [0,1,0,1,0,0|0,0,2]=4 13949 B9R1.40 CC1(C)CCCCC1=O Amb17673753 [0,1,0,1,0,0|0,0,0]=2 13950 B9R1.40 CC1(C)CCCCC1N Amb18642545 [0,1,0,1,0,0|1,0,1]=4 13951 B9R1.40 CC1(C)CCCCC1O Amb22748701 [0,1,0,1,0,0|0,0,2]=4 13952 B9R1.40 CC1(C)CCCCC1S Amb27447161 [0,1,0,1,0,0|0,1,1]=4 13953 B9R1.40 CC1(C)CCCC[C@@H]1N Amb27242528 [0,1,0,1,0,0|1,0,1]=4 13954 B9R1.40 CC1(C)CCCC[C@@H]1O Amb28318455 [0,1,0,1,0,0|0,0,2]=4 13955 B9R1.40 CC1(C)CCCC[C@H]1O Amb28256801 [0,1,0,1,0,0|0,0,2]=4 13956 B9R1.40 CC1(C)CCCNC1=O Amb15701290 [0,1,0,1,0,0|1,0,0]=3 13957 B9R1.40 CC1(C)CCCOC1=O Amb19888333 [0,1,0,1,0,0|1,0,0]=3 13958 B9R1.40 CC1(C)CCOCC1=O Amb28386611 [0,1,0,1,0,0|1,0,0]=3 13959 B9R1.40 CC1(C)CCSCC1=O Amb27256830 [0,1,0,1,0,0|1,0,0]=3 13960 B9R1.40 CC1(C)CNCCC1=O Amb18832675 [0,1,0,1,0,0|1,0,0]=3 13961 B9R1.40 CC1(C)CNCCC1=O Amb22406218 [0,1,0,1,0,0|1,0,0]=3 13962 B9R1.40 CC1(C)CNCCS1=O Amb20667962 [0,1,0,1,0,0|2,0,0]=4 13963 B9R1.40 CC1(C)COCCC1=O Amb18832625 [0,1,0,1,0,0|1,0,0]=3 13964 B9R1.40 CC1(C)CSCCC1=O Amb26625951 [0,1,0,1,0,0|1,0,0]=3 13965 B9R1.40 CC1(C)NCCNC1=O Amb2721804 [0,1,0,1,0,0|2,0,0]=4 13966 B9R1.40 CC1(C)NCCOC1=O Amb33534593 [0,1,0,1,0,0|2,0,0]=4 13967 B9R1.40 CC1(C)NCCOC1=O Amb5781639 [0,1,0,1,0,0|2,0,0]=4 13968 B9R1.40 CC1(C)OCCCC1=O Amb28253367 [0,1,0,1,0,0|1,0,0]=3 13969 B9R1.40 CC1(C)OCCNC1=O Amb28348411 [0,1,0,1,0,0|2,0,0]=4 13970 B9R1.40 CC1(C)OCCOC1=O Amb32666170 [0,1,0,1,0,0|2,0,0]=4 13971 B9R1.40 CC1(C)SCCNC1=O Amb22261440 [0,1,0,1,0,0|2,0,0]=4 13972 B9R1.40 CC1(Cl)CCCC=C1Cl Amb27638119 [0,1,0,1,0,0|1,0,1]=4 13973 B9R1.40 CC1(Cl)CCCCC1=O Amb15693404 [0,1,0,1,0,0|0,0,0]=2 13974 B9R1.40 CC1(Cl)CCCCC1O Amb28315439 [0,1,0,1,0,0|0,0,2]=4 13975 B9R1.40 CC1(F)CCCCC1=O Amb27838805 [0,1,0,1,0,0|0,0,0]=2 13976 B9R1.40 CC1(N)CCCCC1F Amb28434786 [0,1,0,1,0,0|1,0,1]=4 13977 B9R1.40 CC1(N)CCCCC1I Amb27260255 [0,1,0,1,0,0|1,0,1]=4 13978 B9R1.40 CC1(N)CCCCC1O Amb28436950 [0,1,0,1,0,0|0,0,2]=4 13979 B9R1.40 CC1(N)CCCNC1=O Amb32410904 [0,1,0,1,0,0|1,0,0]=3 13980 B9R1.40 CC1(O)CCCCC1Br Amb24480133 [0,1,0,1,0,0|1,0,1]=4 13981 B9R1.40 CC1(O)CCCCC1I Amb35665704 [0,1,0,1,0,0|1,0,1]=4 13982 B9R1.40 CC1(O)CCCCC1N Amb25709525 [0,1,0,1,0,0|1,0,1]=4 13983 B9R1.40 CC1(O)COCCC1=O Amb24737493 [0,1,0,1,0,0|1,0,0]=3 13984 B9R1.40 CC1=CCCCC1(C)C Amb25705834 [0,1,0,1,0,0|1,0,1]=4 13985 B9R1.40 CC1CCCCC1(C)C Amb22227673 [0,1,0,1,0,0|1,0,1]=4 13986 B9R1.40 CC1CCCCC1(C)Cl Amb27789616 [0,1,0,1,0,0|1,0,1]=4 13987 B9R1.40 CC1CCCCC1(C)N Amb9676158 [0,1,0,1,0,0|1,0,1]=4 13988 B9R1.40 CC1CCCCC1(C)O Amb9675954 [0,1,0,1,0,0|0,0,2]=4 13989 B9R1.40 CC1CCCCC1(F)F Amb20670617 [0,1,0,1,0,0|1,0,1]=4 13990 B9R1.40 CC1CCCNS1(=O)=O Amb33164009 [0,1,0,1,0,0|2,0,0]=4 13991 B9R1.40 CC1CCCOS1(=O)=O Amb33742471 [0,1,0,1,0,0|2,0,0]=4 13992 B9R1.40 CC1CNCCS1(=O)=O Amb19374621 [0,1,0,1,0,0|2,0,0]=4 13993 B9R1.40 CC1CNCCS1(=O)=O Amb28895934 [0,1,0,1,0,0|2,0,0]=4 13994 B9R1.40 CN1CCCCS1(=O)=O Amb31217495 [0,1,0,1,0,0|2,0,0]=4 13995 B9R1.40 C[C@@H]1CCCC[C@@]1(C)O Amb32945290 [0,1,0,1,0,0|0,0,2]=4 13996 B9R1.40 C[C@@H]1CNCCS1(=O)=O Amb32660291 [0,1,0,1,0,0|2,0,0]=4 13997 B9R1.40 C[C@@H]1CNCCS1(=O)=O Amb32660508 [0,1,0,1,0,0|2,0,0]=4 13998 B9R1.40 C[C@@]1(Br)CCCC[C@@H]1O Amb27978301 [0,1,0,1,0,0|0,0,2]=4 13999 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1Cl Amb27845490 [0,1,0,1,0,0|1,0,1]=4 14000 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [0,1,0,1,0,0|0,0,2]=4 14001 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1O Amb27463688 [0,1,0,1,0,0|0,0,2]=4 14002 B9R1.40 C[C@@]1(F)CCCC[C@H]1Br Amb27631449 [0,1,0,1,0,0|1,0,1]=4 14003 B9R1.40 C[C@@]1(F)CCCC[C@H]1O Amb28205454 [0,1,0,1,0,0|0,0,2]=4 14004 B9R1.40 C[C@@]1(N)CCCC[C@H]1I Amb27212307 [0,1,0,1,0,0|1,0,1]=4 14005 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [0,1,0,1,0,0|0,0,2]=4 14006 B9R1.40 C[C@@]1(N)CCONC1=O Amb27449489 [0,1,0,1,0,0|2,0,0]=4 14007 B9R1.40 C[C@@]1(O)CCCC[C@@H]1Br Amb27848102 [0,1,0,1,0,0|1,0,1]=4 14008 B9R1.40 C[C@@]1(O)CCCC[C@@H]1N Amb28134269 [0,1,0,1,0,0|1,0,1]=4 14009 B9R1.40 C[C@@]1(O)CCCC[C@H]1Br Amb26027155 [0,1,0,1,0,0|1,0,1]=4 14010 B9R1.40 C[C@@]1(O)CCCC[C@H]1I Amb35665703 [0,1,0,1,0,0|1,0,1]=4 14011 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [0,1,0,1,0,0|1,0,1]=4 14012 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [0,1,0,1,0,0|0,0,2]=4 14013 B9R1.40 C[C@H]1CNCCS1(=O)=O Amb32655856 [0,1,0,1,0,0|2,0,0]=4 14014 B9R1.40 C[C@H]1CNCCS1(=O)=O Amb32655857 [0,1,0,1,0,0|2,0,0]=4 14015 B9R1.40 C[C@]1(N)CCCC[C@H]1O Amb28061920 [0,1,0,1,0,0|0,0,2]=4 14016 B9R1.40 C[C@]1(N)CCCNC1=O Amb28285706 [0,1,0,1,0,0|1,0,0]=3 14017 B9R1.40 C[C@]1(O)CCCC[C@@H]1Cl Amb27966527 [0,1,0,1,0,0|1,0,1]=4 14018 B9R1.40 C[C@]1(O)CCCC[C@@H]1O Amb27427705 [0,1,0,1,0,0|0,0,2]=4 14019 B9R1.40 O=C1CCCCC1(Cl)Cl Amb26936585 [0,1,0,1,0,0|1,0,0]=3 14020 B9R1.40 O=C1CCCCC1(F)Cl Amb27838680 [0,1,0,1,0,0|1,0,0]=3 14021 B9R1.40 O=C1CCCCC1(F)F Amb24117922 [0,1,0,1,0,0|1,0,0]=3 14022 B9R1.40 O=C1CCNCC1(F)F Amb22406219 [0,1,0,1,0,0|2,0,0]=4 14023 B9R1.40 O=C1CCNCC1(F)F Amb24707344 [0,1,0,1,0,0|2,0,0]=4 14024 B9R1.40 O=C1NCCCC1(Br)Br Amb22434360 [0,1,0,1,0,0|2,0,0]=4 14025 B9R1.40 O=C1NCCCC1(F)F Amb22899413 [0,1,0,1,0,0|2,0,0]=4 14026 B9R1.40 O=S1(=O)CCCCC1Cl Amb6382933 [0,1,0,1,0,0|2,0,0]=4 14027 B9R1.41 C=C(C)C1CCCC1O Amb26956818 [0,1,0,1,0,0|2,0,0]=4 14028 B9R1.41 C=C(C)[C@@H]1CCC[C@H]1O Amb33212935 [0,1,0,1,0,0|2,0,0]=4 14029 B9R1.41 C=C(C)[C@H]1CCC[C@@H]1O Amb27618794 [0,1,0,1,0,0|2,0,0]=4 14030 B9R1.41 C=C(C)[C@H]1CNC[C@H]1C Amb28423409 [0,1,0,1,0,0|2,0,0]=4 14031 B9R1.41 C=C1CCCC1C(C)=O Amb27164651 [0,1,0,1,0,0|0,0,2]=4 14032 B9R1.41 C=C1COCC1C(C)C Amb35646843 [0,1,0,1,0,0|2,0,0]=4 14033 B9R1.41 CC(=O)C1=C(C)CCC1 Amb27602304 [0,1,0,1,0,0|0,0,2]=4 14034 B9R1.41 CC(=O)C1=CCC[C@@H]1C Amb27668819 [0,1,0,1,0,0|0,0,2]=4 14035 B9R1.41 CC(=O)C1CCC=C1C Amb26053403 [0,1,0,1,0,0|0,0,2]=4 14036 B9R1.41 CC(=O)C1CCCC1=O Amb6600481 [0,1,0,1,0,0|0,0,1]=3 14037 B9R1.41 CC(=O)C1CCCC1N Amb26959185 [0,1,0,1,0,0|1,0,0]=3 14038 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|1,0,0]=3 14039 B9R1.41 CC(=O)C1CCCN1C Amb25295317 [0,1,0,1,0,0|1,0,0]=3 14040 B9R1.41 CC(=O)C1CCNC1=O Amb9782651 [0,1,0,1,0,0|1,0,1]=4 14041 B9R1.41 CC(=O)C1CCNC1C Amb24393053 [0,1,0,1,0,0|1,0,0]=3 14042 B9R1.41 CC(=O)C1CCOC1=O Amb2404781 [0,1,0,1,0,0|1,0,1]=4 14043 B9R1.41 CC(=O)C1CCOC1C Amb25882003 [0,1,0,1,0,0|1,0,0]=3 14044 B9R1.41 CC(=O)C1CNCC1C Amb28346154 [0,1,0,1,0,0|1,0,0]=3 14045 B9R1.41 CC(=O)C1CNCC1O Amb33213407 [0,1,0,1,0,0|2,0,0]=4 14046 B9R1.41 CC(=O)C1COCC1N Amb25918760 [0,1,0,1,0,0|2,0,0]=4 14047 B9R1.41 CC(=O)C1COCC1O Amb32951053 [0,1,0,1,0,0|2,0,0]=4 14048 B9R1.41 CC(=O)C1CSCC1=O Amb27838737 [0,1,0,1,0,0|1,0,1]=4 14049 B9R1.41 CC(=O)C1CSCC1C Amb32988245 [0,1,0,1,0,0|1,0,0]=3 14050 B9R1.41 CC(=O)C1OCCC1N Amb33307372 [0,1,0,1,0,0|2,0,0]=4 14051 B9R1.41 CC(=O)N1CCCC1=O Amb2720885 [0,1,0,1,0,0|1,0,1]=4 14052 B9R1.41 CC(=O)N1CCCC1C Amb26494370 [0,1,0,1,0,0|1,0,0]=3 14053 B9R1.41 CC(=O)[C@@H]1CCCN1N Amb26968682 [0,1,0,1,0,0|2,0,0]=4 14054 B9R1.41 CC(=O)[C@@H]1CCC[C@@H]1N Amb33132196 [0,1,0,1,0,0|1,0,0]=3 14055 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1C Amb24692616 [0,1,0,1,0,0|0,0,0]=2 14056 B9R1.41 CC(=O)[C@@H]1CCC[C@H]1O Amb27440450 [0,1,0,1,0,0|1,0,0]=3 14057 B9R1.41 CC(=O)[C@@H]1CNC[C@H]1O Amb32945575 [0,1,0,1,0,0|2,0,0]=4 14058 B9R1.41 CC(=O)[C@@H]1COC[C@H]1O Amb32951076 [0,1,0,1,0,0|2,0,0]=4 14059 B9R1.41 CC(=O)[C@@H]1OCC[C@@H]1N Amb33307350 [0,1,0,1,0,0|2,0,0]=4 14060 B9R1.41 CC(=O)[C@H]1CCC[C@H]1C Amb27428390 [0,1,0,1,0,0|0,0,0]=2 14061 B9R1.41 CC(=O)[C@H]1CCOC1=O Amb27453388 [0,1,0,1,0,0|1,0,1]=4 14062 B9R1.41 CC(=S)C1CCCC1=O Amb27947166 [0,1,0,1,0,0|0,0,1]=3 14063 B9R1.41 CC(C)C1CCCC1=O Amb22059120 [0,1,0,1,0,0|0,0,0]=2 14064 B9R1.41 CC(C)C1CCCC1N Amb18947760 [0,1,0,1,0,0|1,0,1]=4 14065 B9R1.41 CC(C)C1CCCC1N Amb33339176 [0,1,0,1,0,0|1,0,1]=4 14066 B9R1.41 CC(C)C1CCCC1O Amb25749420 [0,1,0,1,0,0|0,0,2]=4 14067 B9R1.41 CC(C)C1CCCN1N Amb26386428 [0,1,0,1,0,0|2,0,0]=4 14068 B9R1.41 CC(C)C1CCNC1=O Amb27179731 [0,1,0,1,0,0|1,0,0]=3 14069 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,1,0,1,0,0|1,0,0]=3 14070 B9R1.41 CC(C)C1SCCC1=O Amb27838779 [0,1,0,1,0,0|1,0,0]=3 14071 B9R1.41 CC(C)N1CCCC1=O Amb22731565 [0,1,0,1,0,0|1,0,0]=3 14072 B9R1.41 CC(C)N1CCNC1=O Amb15701628 [0,1,0,1,0,0|2,0,0]=4 14073 B9R1.41 CC(C)N1CNCC1=O Amb26357563 [0,1,0,1,0,0|2,0,0]=4 14074 B9R1.41 CC(C)[C@@H]1CCC[C@H]1O Amb25998901 [0,1,0,1,0,0|0,0,2]=4 14075 B9R1.41 CC(C)[C@@H]1NCCC1=O Amb18832683 [0,1,0,1,0,0|1,0,0]=3 14076 B9R1.41 CC(C)[C@H]1CCC[C@@H]1O Amb27238582 [0,1,0,1,0,0|0,0,2]=4 14077 B9R1.41 CC(C)[C@H]1CCC[C@H]1N Amb27259812 [0,1,0,1,0,0|1,0,1]=4 14078 B9R1.41 CC(C)[C@H]1CCC[C@H]1O Amb28053553 [0,1,0,1,0,0|0,0,2]=4 14079 B9R1.41 CC(Cl)C1=C(Cl)CCC1 Amb27658919 [0,1,0,1,0,0|1,0,1]=4 14080 B9R1.41 CC(Cl)N1CCCC1=O Amb28366454 [0,1,0,1,0,0|1,0,0]=3 14081 B9R1.41 CC(N)C1CCCC1C Amb28287560 [0,1,0,1,0,0|1,0,1]=4 14082 B9R1.41 CC(N)C1CCCN1C Amb26457555 [0,1,0,1,0,0|2,0,0]=4 14083 B9R1.41 CC(N)C1CCOC1=O Amb28240358 [0,1,0,1,0,0|1,0,0]=3 14084 B9R1.41 CC(N)[C@@H]1CCC[C@@H]1O Amb27654093 [0,1,0,1,0,0|0,0,2]=4 14085 B9R1.41 CC(O)C1=C(Cl)CCC1 Amb27237179 [0,1,0,1,0,0|1,0,1]=4 14086 B9R1.41 CC(O)C1CCCC1=O Amb27762504 [0,1,0,1,0,0|0,0,0]=2 14087 B9R1.41 CC(O)C1CCCC1N Amb18203228 [0,1,0,1,0,0|1,0,1]=4 14088 B9R1.41 CC(O)C1CCCN1C Amb27491503 [0,1,0,1,0,0|2,0,0]=4 14089 B9R1.41 CC(O)C1CCOC1=O Amb27755525 [0,1,0,1,0,0|1,0,0]=3 14090 B9R1.41 CC(O)N1CCNC1=O Amb24534530 [0,1,0,1,0,0|2,0,0]=4 14091 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [0,1,0,1,0,0|2,0,0]=4 14092 B9R1.41 CC(O)[C@@H]1CCC[C@@H]1N Amb30039509 [0,1,0,1,0,0|1,0,1]=4 14093 B9R1.41 CC1=C(C(=O)O)CCC1 Amb4021851 [0,1,0,1,0,0|0,0,2]=4 14094 B9R1.41 CC1=C([C@@H](C)O)CCC1 Amb28455066 [0,1,0,1,0,0|1,0,1]=4 14095 B9R1.41 CC1CCCC1B(Cl)Cl Amb27179886 [0,1,0,1,0,0|2,0,0]=4 14096 B9R1.41 CC1CCCC1B(O)O Amb27244083 [0,1,0,1,0,0|1,0,1]=4 14097 B9R1.41 CC1CCCC1C(=N)N Amb28286052 [0,1,0,1,0,0|1,0,0]=3 14098 B9R1.41 CC1CCCC1C(=O)Cl Amb26447682 [0,1,0,1,0,0|0,0,0]=2 14099 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [0,1,0,1,0,0|0,0,0]=2 14100 B9R1.41 CC1CCCC1N(C)N Amb35718433 [0,1,0,1,0,0|2,0,0]=4 14101 B9R1.41 CC1CCCC1[C@@H](C)N Amb26925525 [0,1,0,1,0,0|1,0,1]=4 14102 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [0,1,0,1,0,0|0,0,2]=4 14103 B9R1.41 CC1CCCC1[C@H](C)N Amb27777943 [0,1,0,1,0,0|1,0,1]=4 14104 B9R1.41 CC1CCCN1C(=N)N Amb27837409 [0,1,0,1,0,0|2,0,0]=4 14105 B9R1.41 CC1CCCN1C(=O)Cl Amb25131803 [0,1,0,1,0,0|1,0,0]=3 14106 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [0,1,0,1,0,0|1,0,0]=3 14107 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [0,1,0,1,0,0|1,0,0]=3 14108 B9R1.41 CC1CCNC1C(N)=O Amb26893292 [0,1,0,1,0,0|1,0,0]=3 14109 B9R1.41 CC1CCNC1C(N)=O Amb33307145 [0,1,0,1,0,0|1,0,0]=3 14110 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [0,1,0,1,0,0|1,0,0]=3 14111 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [0,1,0,1,0,0|1,0,0]=3 14112 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [0,1,0,1,0,0|1,0,0]=3 14113 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [0,1,0,1,0,0|1,0,0]=3 14114 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [0,1,0,1,0,0|1,0,0]=3 14115 B9R1.41 CC1CNCC1C(N)=O Amb26454427 [0,1,0,1,0,0|1,0,0]=3 14116 B9R1.41 CC1CNCC1C(N)=O Amb32663022 [0,1,0,1,0,0|1,0,0]=3 14117 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [0,1,0,1,0,0|1,0,0]=3 14118 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [0,1,0,1,0,0|1,0,0]=3 14119 B9R1.41 CC1OCCC1C(=N)N Amb33373407 [0,1,0,1,0,0|2,0,0]=4 14120 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [0,1,0,1,0,0|1,0,0]=3 14121 B9R1.41 CC1OCCC1C(N)=S Amb33426764 [0,1,0,1,0,0|1,1,0]=4 14122 B9R1.41 CC1OCCC1S(=O)Cl Amb32720567 [0,1,0,1,0,0|2,0,0]=4 14123 B9R1.41 CC1OCCC1S(=O)[O-] Amb32754408 [0,1,0,1,0,0|2,0,0]=4 14124 B9R1.41 CC1OCCC1S(C)=O Amb27608130 [0,1,0,1,0,0|2,0,0]=4 14125 B9R1.41 CC1OCCC1S(N)=O Amb32720592 [0,1,0,1,0,0|2,0,0]=4 14126 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [0,1,0,1,0,0|2,0,0]=4 14127 B9R1.41 CC1SCCC1[N+](=O)[O-] Amb33298248 [0,1,0,1,0,0|2,0,0]=4 14128 B9R1.41 CC1SCNC1C(=O)O Amb27591597 [0,1,0,1,0,0|2,0,0]=4 14129 B9R1.41 CN(C)C1CCCC1=O Amb33527404 [0,1,0,1,0,0|1,0,0]=3 14130 B9R1.41 CN(C)C1CCCC1=O Amb9661087 [0,1,0,1,0,0|1,0,0]=3 14131 B9R1.41 CN(C)C1CCNC1=O Amb33456306 [0,1,0,1,0,0|2,0,0]=4 14132 B9R1.41 CN(C)C1CCOC1=O Amb27837705 [0,1,0,1,0,0|2,0,0]=4 14133 B9R1.41 CN1CCCC1C(=N)N Amb26563327 [0,1,0,1,0,0|2,0,0]=4 14134 B9R1.41 CN1CCCC1C(=N)N Amb33457486 [0,1,0,1,0,0|2,0,0]=4 14135 B9R1.41 CN1CCCC1C(=O)Cl Amb25250467 [0,1,0,1,0,0|1,0,0]=3 14136 B9R1.41 CN1CCCC1C(=O)O Amb33545070 [0,1,0,1,0,0|1,0,0]=3 14137 B9R1.41 CN1CCCC1C(=O)O Amb8559038 [0,1,0,1,0,0|1,0,0]=3 14138 B9R1.41 CN1CCCC1C(N)=O Amb22371060 [0,1,0,1,0,0|1,0,0]=3 14139 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb17935722 [0,1,0,1,0,0|1,0,0]=3 14140 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb18559228 [0,1,0,1,0,0|1,0,0]=3 14141 B9R1.41 CN1CCC[C@@H]1C(=O)O Amb22748316 [0,1,0,1,0,0|1,0,0]=3 14142 B9R1.41 CN1CCC[C@H]1C(=O)O Amb10604041 [0,1,0,1,0,0|1,0,0]=3 14143 B9R1.41 CN1CCC[C@H]1C(=O)O Amb22587172 [0,1,0,1,0,0|1,0,0]=3 14144 B9R1.41 CN1CCC[C@H]1C(=O)O Amb9825903 [0,1,0,1,0,0|1,0,0]=3 14145 B9R1.41 CN1CCC[C@H]1C(N)=O Amb28059484 [0,1,0,1,0,0|1,0,0]=3 14146 B9R1.41 CN1CSCC1C(=O)O Amb19650934 [0,1,0,1,0,0|2,0,0]=4 14147 B9R1.41 CN1CSCC1C(=O)O Amb21959971 [0,1,0,1,0,0|2,0,0]=4 14148 B9R1.41 CN1CSC[C@@H]1C(=O)O Amb27157377 [0,1,0,1,0,0|2,0,0]=4 14149 B9R1.41 CN1CSC[C@H]1C(=O)O Amb10608462 [0,1,0,1,0,0|2,0,0]=4 14150 B9R1.41 CN1CSC[C@H]1C(=O)O Amb22587250 [0,1,0,1,0,0|2,0,0]=4 14151 B9R1.41 CS(=O)C1CCCC1N Amb27862371 [0,1,0,1,0,0|2,0,0]=4 14152 B9R1.41 C[C@@H](N)C1CCCN1C Amb35598163 [0,1,0,1,0,0|2,0,0]=4 14153 B9R1.41 C[C@@H](N)[C@@H]1CCC[C@@H]1O Amb35752723 [0,1,0,1,0,0|0,0,2]=4 14154 B9R1.41 C[C@@H](N)[C@H]1CCC[C@H]1O Amb28072273 [0,1,0,1,0,0|0,0,2]=4 14155 B9R1.41 C[C@@H](O)[C@@H]1CCOC1=O Amb27488640 [0,1,0,1,0,0|1,0,0]=3 14156 B9R1.41 C[C@@H](O)[C@H]1CC=CC1=O Amb27854025 [0,1,0,1,0,0|0,0,2]=4 14157 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [0,1,0,1,0,0|0,0,0]=2 14158 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|0,0,0]=2 14159 B9R1.41 C[C@@H]1CCC[C@H]1B(Cl)Cl Amb27829489 [0,1,0,1,0,0|2,0,0]=4 14160 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|0,0,0]=2 14161 B9R1.41 C[C@@H]1CCN[C@@H]1C(N)=O Amb27446302 [0,1,0,1,0,0|1,0,0]=3 14162 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [0,1,0,1,0,0|1,0,0]=3 14163 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [0,1,0,1,0,0|1,0,0]=3 14164 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [0,1,0,1,0,0|1,0,0]=3 14165 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [0,1,0,1,0,0|1,0,0]=3 14166 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [0,1,0,1,0,0|1,0,0]=3 14167 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [0,1,0,1,0,0|1,0,0]=3 14168 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb25319543 [0,1,0,1,0,0|1,0,0]=3 14169 B9R1.41 C[C@@H]1CNC[C@H]1C(N)=O Amb26066427 [0,1,0,1,0,0|1,0,0]=3 14170 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [0,1,0,1,0,0|1,0,0]=3 14171 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [0,1,0,1,0,0|1,0,0]=3 14172 B9R1.41 C[C@@H]1NCC[C@@H]1C(N)=O Amb27851822 [0,1,0,1,0,0|1,0,0]=3 14173 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [0,1,0,1,0,0|1,0,0]=3 14174 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [0,1,0,1,0,0|1,0,0]=3 14175 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [0,1,0,1,0,0|1,0,0]=3 14176 B9R1.41 C[C@H](N)C1CCCN1C Amb35598167 [0,1,0,1,0,0|2,0,0]=4 14177 B9R1.41 C[C@H](O)[C@H]1CCOC1=O Amb27618909 [0,1,0,1,0,0|1,0,0]=3 14178 B9R1.41 C[C@H]1CCC[C@@H]1B(Cl)Cl Amb28199035 [0,1,0,1,0,0|2,0,0]=4 14179 B9R1.41 C[C@H]1CCC[C@@H]1B(O)O Amb24566352 [0,1,0,1,0,0|1,0,1]=4 14180 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|0,0,0]=2 14181 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|0,0,0]=2 14182 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [0,1,0,1,0,0|1,0,0]=3 14183 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [0,1,0,1,0,0|1,0,0]=3 14184 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [0,1,0,1,0,0|1,0,0]=3 14185 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [0,1,0,1,0,0|1,0,0]=3 14186 B9R1.41 C[C@H]1OCNC1C(=O)O Amb28057581 [0,1,0,1,0,0|2,0,0]=4 14187 B9R1.41 C[C@H]1OCN[C@@H]1C(=O)O Amb27782646 [0,1,0,1,0,0|2,0,0]=4 14188 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [0,1,0,1,0,0|2,0,0]=4 14189 B9R1.41 C\C(N)=C1\CCCC1=O Amb28381161 [0,1,0,1,0,0|0,0,2]=4 14190 B9R1.41 N=C(N)C1CCCC1N Amb28124603 [0,1,0,1,0,0|2,0,0]=4 14191 B9R1.41 N=C(N)C1CCCC1N Amb33038277 [0,1,0,1,0,0|2,0,0]=4 14192 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [0,1,0,1,0,0|1,0,1]=4 14193 B9R1.41 NC(=O)C1CCCC1N Amb19148786 [0,1,0,1,0,0|1,0,0]=3 14194 B9R1.41 NC(=O)C1CCCC1N Amb32644747 [0,1,0,1,0,0|1,0,0]=3 14195 B9R1.41 NC(=O)C1CCCC1N Amb32662680 [0,1,0,1,0,0|1,0,0]=3 14196 B9R1.41 NC(=O)C1CCCC1O Amb25310986 [0,1,0,1,0,0|1,0,0]=3 14197 B9R1.41 NC(=O)C1CCCN1O Amb27607865 [0,1,0,1,0,0|2,0,0]=4 14198 B9R1.41 NC(=O)C1NCCC1O Amb24709283 [0,1,0,1,0,0|2,0,0]=4 14199 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N Amb8515831 [0,1,0,1,0,0|1,0,0]=3 14200 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O Amb8515027 [0,1,0,1,0,0|1,0,0]=3 14201 B9R1.41 NC(=O)[C@@H]1NCC[C@@H]1O Amb27779452 [0,1,0,1,0,0|2,0,0]=4 14202 B9R1.41 NC(=O)[C@@H]1NCC[C@H]1O Amb22744802 [0,1,0,1,0,0|2,0,0]=4 14203 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb26432403 [0,1,0,1,0,0|1,0,0]=3 14204 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662604 [0,1,0,1,0,0|1,0,0]=3 14205 B9R1.41 NC(=O)[C@H]1CCC[C@H]1N Amb32662606 [0,1,0,1,0,0|1,0,0]=3 14206 B9R1.41 NC(=O)[C@H]1CCC[C@H]1O Amb26630221 [0,1,0,1,0,0|1,0,0]=3 14207 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O Amb25194866 [0,1,0,1,0,0|2,0,0]=4 14208 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O Amb27630066 [0,1,0,1,0,0|2,0,0]=4 14209 B9R1.41 NC(=S)C1CCCC1O Amb27668651 [0,1,0,1,0,0|1,1,0]=4 14210 B9R1.41 NC1CCCC1C(=O)O Amb2697364 [0,1,0,1,0,0|1,0,0]=3 14211 B9R1.41 NC1CCCC1C(=O)O Amb8630257 [0,1,0,1,0,0|1,0,0]=3 14212 B9R1.41 NC1CCCC1C(O)=[ClH] Amb27883058 [0,1,0,1,0,0|1,0,1]=4 14213 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [0,1,0,1,0,0|2,0,0]=4 14214 B9R1.41 NC1CCOC1C(=O)O Amb26642919 [0,1,0,1,0,0|2,0,0]=4 14215 B9R1.41 NC1CNCC1C(=O)O Amb8630131 [0,1,0,1,0,0|2,0,0]=4 14216 B9R1.41 NC1COCC1C(=O)O Amb24709230 [0,1,0,1,0,0|2,0,0]=4 14217 B9R1.41 NC1CSCC1C(=O)O Amb24457278 [0,1,0,1,0,0|2,0,0]=4 14218 B9R1.41 NN1CCCC1C(=O)O Amb18642792 [0,1,0,1,0,0|2,0,0]=4 14219 B9R1.41 NN1CCC[C@H]1C(=O)O Amb25887284 [0,1,0,1,0,0|2,0,0]=4 14220 B9R1.41 NS(=O)C1CCCC1F Amb32720764 [0,1,0,1,0,0|2,0,0]=4 14221 B9R1.41 NS(=O)[C@@H]1CCC[C@H]1O Amb32720921 [0,1,0,1,0,0|2,0,0]=4 14222 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8387462 [0,1,0,1,0,0|1,0,0]=3 14223 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Amb8516030 [0,1,0,1,0,0|1,0,0]=3 14224 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb20241297 [0,1,0,1,0,0|1,0,0]=3 14225 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Amb33524005 [0,1,0,1,0,0|1,0,0]=3 14226 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [0,1,0,1,0,0|2,0,0]=4 14227 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [0,1,0,1,0,0|2,0,0]=4 14228 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb31264036 [0,1,0,1,0,0|2,0,0]=4 14229 B9R1.41 N[C@@H]1CCO[C@@H]1C(=O)O Amb32666901 [0,1,0,1,0,0|2,0,0]=4 14230 B9R1.41 N[C@@H]1CNC[C@H]1C(=O)O Amb27207888 [0,1,0,1,0,0|2,0,0]=4 14231 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [0,1,0,1,0,0|2,0,0]=4 14232 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [0,1,0,1,0,0|2,0,0]=4 14233 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb20241298 [0,1,0,1,0,0|1,0,0]=3 14234 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O Amb22224860 [0,1,0,1,0,0|1,0,0]=3 14235 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993719 [0,1,0,1,0,0|1,0,0]=3 14236 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Amb1993764 [0,1,0,1,0,0|1,0,0]=3 14237 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [0,1,0,1,0,0|2,0,0]=4 14238 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [0,1,0,1,0,0|2,0,0]=4 14239 B9R1.41 N[C@H]1CNC[C@@H]1C(=O)O Amb27880509 [0,1,0,1,0,0|2,0,0]=4 14240 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [0,1,0,1,0,0|2,0,0]=4 14241 B9R1.41 N[C@H]1CSC[C@H]1C(=O)O Amb25980819 [0,1,0,1,0,0|2,0,0]=4 14242 B9R1.41 O=C(Cl)C1CCCC1=O Amb21961757 [0,1,0,1,0,0|1,0,1]=4 14243 B9R1.41 O=C(Cl)C1CCCC1O Amb24524192 [0,1,0,1,0,0|1,0,0]=3 14244 B9R1.41 O=C(Cl)[C@@H]1CCC[C@@H]1O Amb27475951 [0,1,0,1,0,0|1,0,0]=3 14245 B9R1.41 O=C(O)C1CCCC1=O Amb18642571 [0,1,0,1,0,0|1,0,1]=4 14246 B9R1.41 O=C(O)C1CCCC1O Amb19148040 [0,1,0,1,0,0|1,0,0]=3 14247 B9R1.41 O=C(O)C1CCCC1S Amb18280971 [0,1,0,1,0,0|1,0,0]=3 14248 B9R1.41 O=C(O)C1CNCC1F Amb26864070 [0,1,0,1,0,0|2,0,0]=4 14249 B9R1.41 O=C(O)C1CNCC1F Amb33496211 [0,1,0,1,0,0|2,0,0]=4 14250 B9R1.41 O=C(O)C1CNCC1O Amb22886381 [0,1,0,1,0,0|2,0,0]=4 14251 B9R1.41 O=C(O)C1CNCC1O Amb26026738 [0,1,0,1,0,0|2,0,0]=4 14252 B9R1.41 O=C(O)C1COCC1O Amb27270738 [0,1,0,1,0,0|2,0,0]=4 14253 B9R1.41 O=C(O)C1CSCC1O Amb18831363 [0,1,0,1,0,0|2,0,0]=4 14254 B9R1.41 O=C(O)C1NCCC1F Amb25772909 [0,1,0,1,0,0|2,0,0]=4 14255 B9R1.41 O=C(O)C1NCCC1O Amb22387784 [0,1,0,1,0,0|2,0,0]=4 14256 B9R1.41 O=C(O)C1NCC[C@@H]1O Amb34913313 [0,1,0,1,0,0|2,0,0]=4 14257 B9R1.41 O=C(O)C1SCCC1F Amb27201981 [0,1,0,1,0,0|2,0,0]=4 14258 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O Amb27186915 [0,1,0,1,0,0|2,0,0]=4 14259 B9R1.41 O=C(O)[C@@H]1CNC[C@H]1O Amb24120417 [0,1,0,1,0,0|2,0,0]=4 14260 B9R1.41 O=C(O)[C@@H]1NCCC1F Amb30988050 [0,1,0,1,0,0|2,0,0]=4 14261 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Amb26904377 [0,1,0,1,0,0|2,0,0]=4 14262 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb22230426 [0,1,0,1,0,0|2,0,0]=4 14263 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801217 [0,1,0,1,0,0|2,0,0]=4 14264 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O Amb33801367 [0,1,0,1,0,0|2,0,0]=4 14265 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb26891987 [0,1,0,1,0,0|2,0,0]=4 14266 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Amb30988051 [0,1,0,1,0,0|2,0,0]=4 14267 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb22746713 [0,1,0,1,0,0|2,0,0]=4 14268 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Amb24183557 [0,1,0,1,0,0|2,0,0]=4 14269 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Amb27437088 [0,1,0,1,0,0|1,0,0]=3 14270 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Amb22747315 [0,1,0,1,0,0|1,0,0]=3 14271 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O Amb27421639 [0,1,0,1,0,0|2,0,0]=4 14272 B9R1.41 O=C(O)[C@H]1CNC[C@H]1O Amb27818119 [0,1,0,1,0,0|2,0,0]=4 14273 B9R1.41 O=C(O)[C@H]1NCCC1O Amb10604192 [0,1,0,1,0,0|2,0,0]=4 14274 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1Cl Amb27618755 [0,1,0,1,0,0|2,0,0]=4 14275 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb24055327 [0,1,0,1,0,0|2,0,0]=4 14276 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb34154004 [0,1,0,1,0,0|2,0,0]=4 14277 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O Amb8515204 [0,1,0,1,0,0|2,0,0]=4 14278 B9R1.41 O=C(O)[C@H]1NCC[C@H]1Br Amb27232994 [0,1,0,1,0,0|2,0,0]=4 14279 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb22746928 [0,1,0,1,0,0|2,0,0]=4 14280 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb23439285 [0,1,0,1,0,0|2,0,0]=4 14281 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O Amb24183503 [0,1,0,1,0,0|2,0,0]=4 14282 B9R1.41 O=C(O)[C@H]1NCC[C@H]1S Amb27421961 [0,1,0,1,0,0|2,0,0]=4 14283 B9R1.41 O=C1CCCC1C(F)F Amb27633471 [0,1,0,1,0,0|1,0,0]=3 14284 B9R1.41 O=C1CCCC1[N+](=O)[O-] Amb18832578 [0,1,0,1,0,0|2,0,0]=4 14285 B9R1.41 O=S(Cl)C1CCCC1F Amb32720763 [0,1,0,1,0,0|2,0,0]=4 14286 B9R1.41 O=S(Cl)[C@@H]1CCC[C@H]1O Amb32720922 [0,1,0,1,0,0|2,0,0]=4 14287 B9R1.41 O=S([O-])C1CCCC1F Amb32755063 [0,1,0,1,0,0|2,0,0]=4 14288 B9R1.41 O=S([O-])[C@@H]1CCC[C@H]1O Amb32755416 [0,1,0,1,0,0|2,0,0]=4 14289 B9R1.41 O=[N+]([O-])C1CCCC1O Amb18203186 [0,1,0,1,0,0|2,0,0]=4 14290 B9R1.46 CC(=O)CCC1CC1C Amb25873753 [0,1,0,1,0,0|0,0,0]=2 14291 B9R1.46 CC(=O)CCC1OC1C Amb28194562 [0,1,0,1,0,0|1,0,0]=3 14292 B9R1.46 CC(=O)OCC1CC1C Amb27836351 [0,1,0,1,0,0|1,0,0]=3 14293 B9R1.46 CC(=O)SCC1CC1C Amb27965313 [0,1,0,1,0,0|1,0,0]=3 14294 B9R1.46 CC(=O)\C=C\C1CC1C Amb33143910 [0,1,0,1,0,0|0,0,2]=4 14295 B9R1.46 CC(N)CCC1CC1C Amb33448587 [0,1,0,1,0,0|1,0,1]=4 14296 B9R1.46 CC(O)CCC1CC1C Amb33172627 [0,1,0,1,0,0|0,0,2]=4 14297 B9R1.46 CC1CC1C#CC(=O)O Amb24390173 [0,1,0,1,0,0|0,0,2]=4 14298 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,1,0,1,0,0|0,0,0]=2 14299 B9R1.46 CC1CC1CC[C@@H](C)N Amb33144244 [0,1,0,1,0,0|1,0,1]=4 14300 B9R1.46 CC1CC1CC[C@@H](C)O Amb33144245 [0,1,0,1,0,0|0,0,2]=4 14301 B9R1.46 CC1CC1CC[C@H](C)N Amb33144243 [0,1,0,1,0,0|1,0,1]=4 14302 B9R1.46 CC1CC1CC[C@H](C)O Amb33144246 [0,1,0,1,0,0|0,0,2]=4 14303 B9R1.46 CC1CC1CC[N+](=O)[O-] Amb33144228 [0,1,0,1,0,0|1,0,0]=3 14304 B9R1.46 CC1CC1CNC(=O)Cl Amb35625728 [0,1,0,1,0,0|1,0,0]=3 14305 B9R1.46 CC1CC1COC(=O)Cl Amb33296958 [0,1,0,1,0,0|1,0,0]=3 14306 B9R1.46 CC1CC1NCC(N)=O Amb18990531 [0,1,0,1,0,0|1,0,0]=3 14307 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [0,1,0,1,0,0|1,0,0]=3 14308 B9R1.46 CC1CC1\C=C\C(=O)O Amb33226425 [0,1,0,1,0,0|0,0,2]=4 14309 B9R1.56 CC1(C)CCC1CCO Amb27953782 [0,1,0,1,0,0|0,0,2]=4 14310 B9R1.56 CC1(C)CCC1N=C=O Amb27844784 [0,1,0,1,0,0|1,0,1]=4 14311 B9R1.56 CC1(C)SCC1NC=O Amb27983970 [0,1,0,1,0,0|2,0,0]=4 14312 B9R1.59 C=C(C)C1CC1CCO Amb28400433 [0,1,0,1,0,0|2,0,0]=4 14313 B9R1.59 C=CCC1OC1C(C)O Amb28318270 [0,1,0,1,0,0|2,0,0]=4 14314 B9R1.59 C=CC[C@@H]1O[C@H]1[C@H](C)O Amb27451928 [0,1,0,1,0,0|2,0,0]=4 14315 B9R1.59 C=CC[C@H]1O[C@@H]1[C@@H](C)O Amb28052867 [0,1,0,1,0,0|2,0,0]=4 14316 B9R1.59 CC#CC1CC1C(=O)O Amb27406350 [0,1,0,1,0,0|0,0,2]=4 14317 B9R1.59 CC#C[C@@H]1C[C@H]1C(=O)O Amb27789635 [0,1,0,1,0,0|0,0,2]=4 14318 B9R1.59 CC(=O)C1CC1CC=O Amb28058511 [0,1,0,1,0,0|0,0,1]=3 14319 B9R1.59 CC(=O)[C@@H]1C[C@@H]1CC=O Amb27229169 [0,1,0,1,0,0|0,0,1]=3 14320 B9R1.59 CC(C)C1CC1CCN Amb27849221 [0,1,0,1,0,0|1,0,1]=4 14321 B9R1.59 CC(C)C1CC1N=C=O Amb27788905 [0,1,0,1,0,0|1,0,1]=4 14322 B9R1.59 CC(C)[C@H]1C[C@H]1CCO Amb27429554 [0,1,0,1,0,0|0,0,2]=4 14323 B9R1.59 CCCC1CC1C(=O)O Amb19001459 [0,1,0,1,0,0|0,0,0]=2 14324 B9R1.59 CCCC1OC1C(=O)O Amb24561183 [0,1,0,1,0,0|1,0,0]=3 14325 B9R1.59 CCCC1OC1C(C)=O Amb25888683 [0,1,0,1,0,0|1,0,0]=3 14326 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O Amb9901777 [0,1,0,1,0,0|0,0,0]=2 14327 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O Amb25368727 [0,1,0,1,0,0|0,0,0]=2 14328 B9R1.59 CCC[C@@H]1C[C@H]1C(N)=O Amb27837259 [0,1,0,1,0,0|0,0,0]=2 14329 B9R1.59 CCC[C@@H]1O[C@H]1C(=O)O Amb27422047 [0,1,0,1,0,0|1,0,0]=3 14330 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,1,0,1,0,0|1,0,0]=3 14331 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O Amb27782329 [0,1,0,1,0,0|0,0,0]=2 14332 B9R1.59 CCC[C@H]1O[C@@H]1C(=O)O Amb27625884 [0,1,0,1,0,0|1,0,0]=3 14333 B9R1.59 CCC[C@H]1O[C@@H]1C(C)=O Amb28325243 [0,1,0,1,0,0|1,0,0]=3 14334 B9R1.59 CCOC1CC1C(=O)Cl Amb35717348 [0,1,0,1,0,0|1,0,0]=3 14335 B9R1.59 CCOC1CC1C(=O)O Amb9677563 [0,1,0,1,0,0|1,0,0]=3 14336 B9R1.59 CCOC1CC1C(C)=O Amb27838755 [0,1,0,1,0,0|1,0,0]=3 14337 B9R1.59 CCO[C@@H]1C[C@@H]1C(=O)O Amb27818165 [0,1,0,1,0,0|1,0,0]=3 14338 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O Amb25959626 [0,1,0,1,0,0|1,0,0]=3 14339 B9R1.59 CNCC1CC1C(C)C Amb18995730 [0,1,0,1,0,0|2,0,0]=4 14340 B9R1.59 COCC1CC1C(=O)O Amb27404704 [0,1,0,1,0,0|1,0,0]=3 14341 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O Amb33098418 [0,1,0,1,0,0|1,0,0]=3 14342 B9R1.59 COC[C@H]1C[C@H]1C(=O)O Amb33098416 [0,1,0,1,0,0|1,0,0]=3 14343 B9R1.59 CSCC1CC1C(=O)O Amb33272939 [0,1,0,1,0,0|1,0,0]=3 14344 B9R1.59 CSC[C@@H]1C[C@H]1C(=O)O Amb33272937 [0,1,0,1,0,0|1,0,0]=3 14345 B9R1.59 C\C=C\C1CC1C(=O)O Amb27169581 [0,1,0,1,0,0|0,0,2]=4 14346 B9R1.59 C\C=C\C1CC1C(C)O Amb27956457 [0,1,0,1,0,0|1,0,1]=4 14347 B9R1.59 C\C=C\[C@@H]1C[C@H]1C(=O)O Amb27771439 [0,1,0,1,0,0|0,0,2]=4 14348 B9R1.59 C\C=C\[C@@H]1C[C@H]1[C@@H](C)O Amb28345383 [0,1,0,1,0,0|1,0,1]=4 14349 B9R1.59 O=C(O)C1CC1CCF Amb33196442 [0,1,0,1,0,0|1,0,0]=3 14350 B9R1.59 O=C(O)[C@@H]1C[C@H]1CCF Amb33196453 [0,1,0,1,0,0|1,0,0]=3 14351 B9R1.67 C=C(C)CC1CCC1O Amb32945786 [0,1,0,1,0,0|2,0,0]=4 14352 B9R1.67 C=C(C)CN1CCC1=O Amb27161514 [0,1,0,1,0,0|1,0,1]=4 14353 B9R1.67 C=C(Cl)CC1CCC1O Amb32945357 [0,1,0,1,0,0|2,0,0]=4 14354 B9R1.67 C=C1CCC1CN(C)C Amb28075158 [0,1,0,1,0,0|2,0,0]=4 14355 B9R1.67 CC(=N)NC1CCC1C Amb27599537 [0,1,0,1,0,0|2,0,0]=4 14356 B9R1.67 CC(=O)CC1CCC1F Amb27597070 [0,1,0,1,0,0|1,0,0]=3 14357 B9R1.67 CC(=O)OC1CCC1O Amb25740537 [0,1,0,1,0,0|2,0,0]=4 14358 B9R1.67 CC(=O)O[C@@H]1CC[C@H]1Br Amb33328971 [0,1,0,1,0,0|2,0,0]=4 14359 B9R1.67 CC(=O)\C=C1/CCC1C Amb28251863 [0,1,0,1,0,0|0,0,2]=4 14360 B9R1.67 CC(C)=CC1CCC1=O Amb27948578 [0,1,0,1,0,0|0,0,2]=4 14361 B9R1.67 CC(C)CC1CCC1=O Amb28285165 [0,1,0,1,0,0|0,0,0]=2 14362 B9R1.67 CC(C)CC1CCC1O Amb33213816 [0,1,0,1,0,0|0,0,2]=4 14363 B9R1.67 CC(C)\C=C1\CCC1=O Amb35752264 [0,1,0,1,0,0|0,0,2]=4 14364 B9R1.67 CC(O)CN1CCC1=O Amb27963094 [0,1,0,1,0,0|1,0,0]=3 14365 B9R1.67 CC1CCC1NC(=O)Cl Amb35633330 [0,1,0,1,0,0|1,0,0]=3 14366 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,0]=3 14367 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,0]=3 14368 B9R1.67 CN(C)CC1CCC1=O Amb28429154 [0,1,0,1,0,0|1,0,0]=3 14369 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [0,1,0,1,0,0|1,0,0]=3 14370 B9R1.77 C=CCNC1CC1(C)C Amb18295655 [0,1,0,1,0,0|2,0,0]=4 14371 B9R1.77 CC1(C)CC1CCCBr Amb27174355 [0,1,0,1,0,0|1,0,1]=4 14372 B9R1.77 CC1(C)CC1CCCCl Amb33228609 [0,1,0,1,0,0|1,0,1]=4 14373 B9R1.77 CC1(C)CC1CCCN Amb32992297 [0,1,0,1,0,0|1,0,1]=4 14374 B9R1.77 CC1(C)CC1CCCO Amb24675490 [0,1,0,1,0,0|0,0,2]=4 14375 B9R1.77 CC1(C)CC1CN=C=O Amb27412142 [0,1,0,1,0,0|1,0,1]=4 14376 B9R1.77 CC1(C)CC1CNC=O Amb27225661 [0,1,0,1,0,0|1,0,0]=3 14377 B9R1.77 CC1(C)NN1CCC=O Amb28342629 [0,1,0,1,0,0|2,0,0]=4 14378 B9R1.77 CC1(C)OC1CCC=O Amb27816000 [0,1,0,1,0,0|1,0,0]=3 14379 B9R1.77 CC1(C)O[C@@H]1CCC=O Amb28130472 [0,1,0,1,0,0|1,0,0]=3 14380 B9R1.77 O=CCCC1CC1(F)F Amb29849536 [0,1,0,1,0,0|1,0,0]=3 14381 B9R1.77 O=CCOC1CC1(F)F Amb35656690 [0,1,0,1,0,0|2,0,0]=4 14382 B9R1.84 C=C(C)CNC1CCC1 Amb18298086 [0,1,0,1,0,0|2,0,0]=4 14383 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [0,1,0,1,0,0|0,0,0]=2 14384 B9R1.84 CC(=O)CCC1CNC1 Amb33307594 [0,1,0,1,0,0|1,0,0]=3 14385 B9R1.84 CC(=O)CCC1COC1 Amb27670151 [0,1,0,1,0,0|1,0,0]=3 14386 B9R1.84 CC(=O)COC1CNC1 Amb27634342 [0,1,0,1,0,0|2,0,0]=4 14387 B9R1.84 CC(=O)NCC1CNC1 Amb28289479 [0,1,0,1,0,0|2,0,0]=4 14388 B9R1.84 CC(=O)NCC1CNC1 Amb33839583 [0,1,0,1,0,0|2,0,0]=4 14389 B9R1.84 CC(=O)NCC1CSC1 Amb35635237 [0,1,0,1,0,0|2,0,0]=4 14390 B9R1.84 CC(=O)NOC1CCC1 Amb27211499 [0,1,0,1,0,0|2,0,0]=4 14391 B9R1.84 CC(=O)OCC1CCC1 Amb27980327 [0,1,0,1,0,0|1,0,0]=3 14392 B9R1.84 CC(=O)\C=C\C1CCC1 Amb33448508 [0,1,0,1,0,0|0,0,2]=4 14393 B9R1.84 CC(Br)CCC1CCC1 Amb28143174 [0,1,0,1,0,0|1,0,1]=4 14394 B9R1.84 CC(C)CCC1CCN1 Amb27965282 [0,1,0,1,0,0|1,0,1]=4 14395 B9R1.84 CC(C)CCC1CNC1 Amb25115363 [0,1,0,1,0,0|2,0,0]=4 14396 B9R1.84 CC(N)CCC1CCC1 Amb25888957 [0,1,0,1,0,0|1,0,1]=4 14397 B9R1.84 CC(N)CCC1CCN1 Amb28195406 [0,1,0,1,0,0|1,0,1]=4 14398 B9R1.84 CC(O)CCC1CCC1 Amb27146306 [0,1,0,1,0,0|0,0,2]=4 14399 B9R1.84 CC(O)CCC1COC1 Amb27795130 [0,1,0,1,0,0|2,0,0]=4 14400 B9R1.84 CN(N)CCC1CCC1 Amb35625937 [0,1,0,1,0,0|2,0,0]=4 14401 B9R1.84 C[C@@H](N)CCC1CCC1 Amb33314113 [0,1,0,1,0,0|1,0,1]=4 14402 B9R1.84 C[C@@H](O)CCC1CCC1 Amb33314114 [0,1,0,1,0,0|0,0,2]=4 14403 B9R1.84 C[C@H](N)CCC1CCC1 Amb33314112 [0,1,0,1,0,0|1,0,1]=4 14404 B9R1.84 C[C@H](O)CCC1CCC1 Amb33195478 [0,1,0,1,0,0|0,0,2]=4 14405 B9R1.84 NC(=O)C#CC1CCC1 Amb27783420 [0,1,0,1,0,0|0,0,2]=4 14406 B9R1.84 NC(=O)CCC1CCC1 Amb27196680 [0,1,0,1,0,0|0,0,0]=2 14407 B9R1.84 NC(=O)CNC1CCC1 Amb18989288 [0,1,0,1,0,0|1,0,0]=3 14408 B9R1.84 NC(=O)CNC1CNC1 Amb27394146 [0,1,0,1,0,0|2,0,0]=4 14409 B9R1.84 NC(=O)CNC1COC1 Amb27837511 [0,1,0,1,0,0|2,0,0]=4 14410 B9R1.84 NC(=O)CNC1CSC1 Amb27837658 [0,1,0,1,0,0|2,0,0]=4 14411 B9R1.84 NC(=O)COC1CNC1 Amb20623915 [0,1,0,1,0,0|2,0,0]=4 14412 B9R1.84 NC(=O)COC1CNC1 Amb22059197 [0,1,0,1,0,0|2,0,0]=4 14413 B9R1.84 NC(=O)COC1CNC1 Amb30585161 [0,1,0,1,0,0|2,0,0]=4 14414 B9R1.84 NC(=O)NCC1CCN1 Amb28052840 [0,1,0,1,0,0|2,0,0]=4 14415 B9R1.84 NC(=O)NCC1CSC1 Amb30037012 [0,1,0,1,0,0|2,0,0]=4 14416 B9R1.84 NC(=O)\C=C\C1CCC1 Amb27615014 [0,1,0,1,0,0|0,0,2]=4 14417 B9R1.84 NC(=S)NCC1CCC1 Amb8929531 [0,1,0,1,0,0|1,1,0]=4 14418 B9R1.84 NS(=O)CCC1CCC1 Amb32720704 [0,1,0,1,0,0|1,0,0]=3 14419 B9R1.84 O=C(Cl)NCC1CCC1 Amb35625731 [0,1,0,1,0,0|1,0,0]=3 14420 B9R1.84 O=C(Cl)NCC1CSC1 Amb35633440 [0,1,0,1,0,0|2,0,0]=4 14421 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [0,1,0,1,0,0|1,0,0]=3 14422 B9R1.84 O=C(Cl)OCC1COC1 Amb33297065 [0,1,0,1,0,0|2,0,0]=4 14423 B9R1.84 O=C(O)C#CC1CCC1 Amb26413119 [0,1,0,1,0,0|0,0,2]=4 14424 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,1,0,1,0,0|0,0,0]=2 14425 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,1,0,1,0,0|1,0,0]=3 14426 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [0,1,0,1,0,0|1,0,0]=3 14427 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,1,0,1,0,0|1,0,0]=3 14428 B9R1.84 O=C(O)CN=C1CCC1 Amb28121224 [0,1,0,1,0,0|1,0,1]=4 14429 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,0]=3 14430 B9R1.84 O=C(O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|2,0,0]=4 14431 B9R1.84 O=C(O)CNC1CSC1 Amb27186145 [0,1,0,1,0,0|2,0,0]=4 14432 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,0]=3 14433 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|2,0,0]=4 14434 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,1,0,1,0,0|2,0,0]=4 14435 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,1,0,1,0,0|2,0,0]=4 14436 B9R1.84 O=C(O)COC1COC1 Amb24539538 [0,1,0,1,0,0|2,0,0]=4 14437 B9R1.84 O=C(O)CSC1COC1 Amb27589904 [0,1,0,1,0,0|2,0,0]=4 14438 B9R1.84 O=C(O)\C=C\C1CCC1 Amb20624021 [0,1,0,1,0,0|0,0,2]=4 14439 B9R1.84 O=C([O-])CCC1CCO1 Amb32663662 [0,1,0,1,0,0|1,0,0]=3 14440 B9R1.84 O=C([O-])COC1COC1 Amb33744117 [0,1,0,1,0,0|2,0,0]=4 14441 B9R1.84 O=S(Cl)CCC1CCC1 Amb25179912 [0,1,0,1,0,0|1,0,0]=3 14442 B9R1.84 O=S([O-])CCC1CCC1 Amb26425804 [0,1,0,1,0,0|1,0,0]=3 14443 B9R1.84 O=[N+]([O-])CCC1CCC1 Amb15692934 [0,1,0,1,0,0|1,0,0]=3 14444 B9R1.85 C=C(C)CSCC1CC1 Amb28133272 [0,1,0,1,0,0|2,0,0]=4 14445 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [0,1,0,1,0,0|0,0,0]=2 14446 B9R1.85 CC(=O)CCNC1CC1 Amb24377194 [0,1,0,1,0,0|1,0,0]=3 14447 B9R1.85 CC(=O)CNCC1CC1 Amb27251858 [0,1,0,1,0,0|1,0,0]=3 14448 B9R1.85 CC(=O)\C=C\CC1CC1 Amb33361179 [0,1,0,1,0,0|0,0,2]=4 14449 B9R1.85 CC(Br)CCCC1CC1 Amb33167096 [0,1,0,1,0,0|1,0,1]=4 14450 B9R1.85 CC(C)=CCCC1CC1 Amb30023883 [0,1,0,1,0,0|1,0,1]=4 14451 B9R1.85 CC(C)CCCC1CO1 Amb27232305 [0,1,0,1,0,0|0,0,2]=4 14452 B9R1.85 CC(N)CCCC1CC1 Amb32675321 [0,1,0,1,0,0|1,0,1]=4 14453 B9R1.85 CC(O)CCCC1CC1 Amb27780444 [0,1,0,1,0,0|0,0,2]=4 14454 B9R1.85 C[C@@H](N)CCCC1CC1 Amb33361296 [0,1,0,1,0,0|1,0,1]=4 14455 B9R1.85 C[C@@H](O)CCCC1CC1 Amb33361223 [0,1,0,1,0,0|0,0,2]=4 14456 B9R1.85 C[C@H](N)CCCC1CC1 Amb33361291 [0,1,0,1,0,0|1,0,1]=4 14457 B9R1.85 C[C@H](O)CCCC1CC1 Amb33224926 [0,1,0,1,0,0|0,0,2]=4 14458 B9R1.85 N=C(N)CCNC1CC1 Amb28289053 [0,1,0,1,0,0|2,0,0]=4 14459 B9R1.85 N=C(N)SCCC1CC1 Amb27180708 [0,1,0,1,0,0|2,0,0]=4 14460 B9R1.85 NC(=O)CCCC1CC1 Amb28193047 [0,1,0,1,0,0|0,0,0]=2 14461 B9R1.85 NC(=O)CCNC1CC1 Amb8841117 [0,1,0,1,0,0|1,0,0]=3 14462 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,1,0,1,0,0|1,0,0]=3 14463 B9R1.85 NC(=S)COCC1CC1 Amb6681251 [0,1,0,1,0,0|1,1,0]=4 14464 B9R1.85 NC(=S)NCCC1CC1 Amb24495275 [0,1,0,1,0,0|1,1,0]=4 14465 B9R1.85 NS(=O)CCCC1CC1 Amb32720967 [0,1,0,1,0,0|1,0,0]=3 14466 B9R1.85 O=C(Cl)NCCC1CC1 Amb35633396 [0,1,0,1,0,0|1,0,0]=3 14467 B9R1.85 O=C(Cl)OCCC1CC1 Amb27162058 [0,1,0,1,0,0|1,0,0]=3 14468 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,1,0,1,0,0|0,0,0]=2 14469 B9R1.85 O=C(O)CCCC1CO1 Amb28453878 [0,1,0,1,0,0|1,0,0]=3 14470 B9R1.85 O=C(O)CCC[C@@H]1CO1 Amb27257665 [0,1,0,1,0,0|1,0,0]=3 14471 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [0,1,0,1,0,0|1,0,0]=3 14472 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [0,1,0,1,0,0|1,0,0]=3 14473 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [0,1,0,1,0,0|1,0,0]=3 14474 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,1,0,1,0,0|1,0,0]=3 14475 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,1,0,1,0,0|1,0,0]=3 14476 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,1,0,1,0,0|1,0,0]=3 14477 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,1,0,1,0,0|1,0,0]=3 14478 B9R1.85 O=C(O)\C=C\CC1CC1 Amb33362399 [0,1,0,1,0,0|0,0,2]=4 14479 B9R1.85 O=S(Cl)CCCC1CC1 Amb32720966 [0,1,0,1,0,0|1,0,0]=3 14480 B9R1.85 O=S([O-])CCCC1CC1 Amb32755669 [0,1,0,1,0,0|1,0,0]=3 14481 B9R1.85 O=[N+]([O-])CCCC1CC1 Amb33361218 [0,1,0,1,0,0|1,0,0]=3 14482 B9R1.86 C=CC1CC1CC(C)O Amb27956511 [0,1,0,1,0,0|1,0,0]=3 14483 B9R1.86 C=C[C@@H]1C[C@H]1C[C@H](C)O Amb27184171 [0,1,0,1,0,0|1,0,0]=3 14484 B9R1.86 C=C[C@@H]1O[C@H]1C[C@@H](C)O Amb28455099 [0,1,0,1,0,0|2,0,0]=4 14485 B9R1.86 C=C[C@H]1C[C@@H]1C[C@H](C)O Amb28400694 [0,1,0,1,0,0|1,0,0]=3 14486 B9R1.86 C=C[C@H]1O[C@@H]1C[C@H](C)O Amb28400682 [0,1,0,1,0,0|2,0,0]=4 14487 B9R1.86 C=C[C@H]1O[C@H]1C[C@@H](C)O Amb28197642 [0,1,0,1,0,0|2,0,0]=4 14488 B9R1.86 CC(C)=CC1CC1C=O Amb27169456 [0,1,0,1,0,0|0,0,2]=4 14489 B9R1.86 CC(C)=C[C@@H]1C[C@@H]1C=O Amb28411163 [0,1,0,1,0,0|0,0,2]=4 14490 B9R1.86 CC(C)=C[C@@H]1C[C@H]1C=O Amb28130990 [0,1,0,1,0,0|0,0,2]=4 14491 B9R1.86 CC(C)CC1CC1CCl Amb27838523 [0,1,0,1,0,0|1,0,1]=4 14492 B9R1.86 CC(C)CC1OC1C=O Amb27838606 [0,1,0,1,0,0|1,0,0]=3 14493 B9R1.86 CC(C)C[C@@H]1C[C@H]1C#N Amb28066864 [0,1,0,1,0,0|1,0,1]=4 14494 B9R1.86 CC(C)C[C@@H]1C[C@H]1CBr Amb27213690 [0,1,0,1,0,0|1,0,1]=4 14495 B9R1.86 CC(C)C[C@@H]1C[C@H]1CN Amb26895733 [0,1,0,1,0,0|1,0,1]=4 14496 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,1,0,1,0,0|0,0,0]=2 14497 B9R1.86 CCC1CC1NC(=O)Cl Amb35633240 [0,1,0,1,0,0|1,0,0]=3 14498 B9R1.86 CC[C@@H]1C[C@H]1NC(C)=O Amb28190147 [0,1,0,1,0,0|1,0,0]=3 14499 B9R1.86 CC[C@@H]1C[C@H]1NC(N)=O Amb28455899 [0,1,0,1,0,0|1,0,0]=3 14500 B9R1.86 CC[C@@H]1C[C@H]1\N=C(/C)N Amb27483213 [0,1,0,1,0,0|2,0,0]=4 14501 B9R1.86 CNC1CC1CC(C)C Amb27965447 [0,1,0,1,0,0|2,0,0]=4 14502 B9R1.86 NC(=O)NC1CC1CO Amb27424914 [0,1,0,1,0,0|2,0,0]=4 14503 B9R1.86 NC(=O)N[C@@H]1C[C@H]1CO Amb27231937 [0,1,0,1,0,0|2,0,0]=4 14504 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,1,0,1,0,0|1,0,0]=3 14505 B9R1.96 C=C[C@H]1CC[C@H]1[C@@H](C)O Amb27457841 [0,1,0,1,0,0|1,0,0]=3 14506 B9R1.96 C=C[C@H]1CC[C@H]1[C@H](C)O Amb27452394 [0,1,0,1,0,0|1,0,0]=3 14507 B9R1.96 CC(=O)N1CCC1CN Amb27963054 [0,1,0,1,0,0|2,0,0]=4 14508 B9R1.96 CC(=O)N1CCC1CO Amb32685105 [0,1,0,1,0,0|2,0,0]=4 14509 B9R1.96 CC(=O)N1CC[C@@H]1CO Amb34138406 [0,1,0,1,0,0|2,0,0]=4 14510 B9R1.96 CC(=O)N1CC[C@H]1CO Amb34144357 [0,1,0,1,0,0|2,0,0]=4 14511 B9R1.96 CC(C)N1CCC1C=O Amb28202644 [0,1,0,1,0,0|1,0,0]=3 14512 B9R1.96 CC(O)[C@H]1CC[C@@H]1C#N Amb27452469 [0,1,0,1,0,0|1,0,1]=4 14513 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [0,1,0,1,0,0|0,0,0]=2 14514 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [0,1,0,1,0,0|1,0,0]=3 14515 B9R1.96 CCN1CCC1C(=O)O Amb22011877 [0,1,0,1,0,0|1,0,0]=3 14516 B9R1.96 CCN1CC[C@@H]1C(=O)O Amb24634744 [0,1,0,1,0,0|1,0,0]=3 14517 B9R1.96 CCN1CC[C@H]1C(=O)O Amb25347394 [0,1,0,1,0,0|1,0,0]=3 14518 B9R1.96 COC1CCC1C(=O)O Amb26516125 [0,1,0,1,0,0|1,0,0]=3 14519 B9R1.96 COC1CCC1C(N)=O Amb27645560 [0,1,0,1,0,0|1,0,0]=3 14520 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [0,1,0,1,0,0|1,0,0]=3 14521 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [0,1,0,1,0,0|1,0,0]=3 14522 B9R1.96 C[C@H](O)[C@H]1CC[C@H]1C#N Amb27484793 [0,1,0,1,0,0|1,0,1]=4 14523 B9R1.96 N#CC1CCC1C(=O)O Amb26949285 [0,1,0,1,0,0|1,0,1]=4 14524 B9R1.96 N#CC1CCC1C(N)=O Amb28285146 [0,1,0,1,0,0|1,0,1]=4 14525 B9R1.96 NC(=O)N1CCC1CO Amb27463478 [0,1,0,1,0,0|2,0,0]=4 14526 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [0,1,0,1,0,0|1,0,0]=3 14527 B9R1.96 NC[C@H]1CC[C@@H]1C(N)=O Amb27966233 [0,1,0,1,0,0|1,0,0]=3 14528 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|1,0,0]=3 14529 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [0,1,0,1,0,0|1,0,0]=3 14530 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [0,1,0,1,0,0|2,0,0]=4 14531 B9R1.96 O=CC1CCC1C(F)F Amb27186471 [0,1,0,1,0,0|1,0,0]=3 14532 B9R1.148 CC1(C)CCCCCN1 Amb18832660 [0,1,0,1,0,0|1,0,1]=4 14533 B9R1.148 CC1(C)CCCCNC1 Amb24611736 [0,1,0,1,0,0|2,0,0]=4 14534 B9R1.148 CC1(F)CCCCNC1 Amb22886308 [0,1,0,1,0,0|2,0,0]=4 14535 B9R1.148 CC1(F)CCCCNC1 Amb24672176 [0,1,0,1,0,0|2,0,0]=4 14536 B9R1.148 CC1(N)CCCCCC1 Amb13952349 [0,1,0,1,0,0|1,0,1]=4 14537 B9R1.148 CC1(N)CCCCCC1 Amb9676104 [0,1,0,1,0,0|1,0,1]=4 14538 B9R1.148 CC1(O)CCCCCC1 Amb4017691 [0,1,0,1,0,0|0,0,2]=4 14539 B9R1.148 CC1(O)CCCCNC1 Amb22886278 [0,1,0,1,0,0|2,0,0]=4 14540 B9R1.148 FC1(F)CCCCCC1 Amb26917791 [0,1,0,1,0,0|1,0,1]=4 14541 B9R1.148 N=S1(=O)CCCCCC1 Amb33210095 [0,1,0,1,0,0|1,0,0]=3 14542 B9R1.148 N=S1(=O)CCCCCC1 Amb33483926 [0,1,0,1,0,0|1,0,0]=3 14543 B9R1.148 N=S1(=O)CCCNCC1 Amb32757512 [0,1,0,1,0,0|2,0,0]=4 14544 B9R1.148 O=S1(=O)CCCCCN1 Amb35789267 [0,1,0,1,0,0|2,0,0]=4 14545 B9R1.148 O=S1(=O)CCCNCC1 Amb10610583 [0,1,0,1,0,0|2,0,0]=4 14546 B9R1.148 O=S1(=O)CCCNCC1 Amb19299932 [0,1,0,1,0,0|2,0,0]=4 14547 B9R1.148 O=S1(=O)CCCNCC1 Amb21960984 [0,1,0,1,0,0|2,0,0]=4 14548 B9R2.24 BrC1C2C=CC1CC2 Amb8517215 [0,0,0,2,0,0|2,0,0]=4 14549 B9R2.24 BrC1C2CCC1CC2 Amb16231050 [0,0,0,2,0,0|1,0,1]=4 14550 B9R2.24 Br[C@@H]1[C@@H]2C=C[C@H]1CC2 Amb16231049 [0,0,0,2,0,0|2,0,0]=4 14551 B9R2.24 Br[C@H]1[C@@H]2C=C[C@H]1CC2 Amb28458271 [0,0,0,2,0,0|2,0,0]=4 14552 B9R2.24 CC1C2CCC1NC2 Amb28255827 [0,0,0,2,0,0|1,0,1]=4 14553 B9R2.24 NC1C2CCC1CC2 Amb18641658 [0,0,0,2,0,0|1,0,1]=4 14554 B9R2.24 N[C@H]1[C@@H]2C=C[C@H]1CC2 Amb27473422 [0,0,0,2,0,0|2,0,0]=4 14555 B9R2.24 O=C1C2C=CC1CC2 Amb17593121 [0,0,0,2,0,0|0,0,2]=4 14556 B9R2.24 O=C1C2CCC1CC2 Amb26031495 [0,0,0,2,0,0|0,0,0]=2 14557 B9R2.24 O=C1[C@@H]2C=C[C@H]1CC2 Amb24690194 [0,0,0,2,0,0|0,0,2]=4 14558 B9R2.24 O=C1[C@H]2C=C[C@H]1CC2 Amb27254614 [0,0,0,2,0,0|0,0,2]=4 14559 B9R2.24 OC1C2C=CC1CC2 Amb24745608 [0,0,0,2,0,0|2,0,0]=4 14560 B9R2.24 OC1C2CCC1CC2 Amb28292506 [0,0,0,2,0,0|0,0,2]=4 14561 B9R2.47 BrCC1CC2CC2C1 Amb25968747 [0,0,0,2,0,0|1,0,1]=4 14562 B9R2.47 BrCC1C[C@@H]2C[C@@H]2C1 Amb25711595 [0,0,0,2,0,0|1,0,1]=4 14563 B9R2.47 BrC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741740 [0,0,0,2,0,0|1,0,1]=4 14564 B9R2.47 C#CC1CC2CC2C1 Amb32670575 [0,0,0,2,0,0|1,0,1]=4 14565 B9R2.47 C=CC1CC2CC2C1 Amb35668763 [0,0,0,2,0,0|1,0,0]=3 14566 B9R2.47 CCC1CC2CC2N1 Amb27411817 [0,0,0,2,0,0|1,0,1]=4 14567 B9R2.47 CC[C@H]1C[C@@H]2C[C@@H]2N1 Amb27446310 [0,0,0,2,0,0|1,0,1]=4 14568 B9R2.47 CNC1CC2CC2C1 Amb27851732 [0,0,0,2,0,0|2,0,0]=4 14569 B9R2.47 ClCC1CC2CC2C1 Amb27413244 [0,0,0,2,0,0|1,0,1]=4 14570 B9R2.47 ClC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb27494544 [0,0,0,2,0,0|1,0,1]=4 14571 B9R2.47 ICC1CC2CC2C1 Amb35617884 [0,0,0,2,0,0|1,0,1]=4 14572 B9R2.47 N#CC1CC2CC2C1 Amb24401252 [0,0,0,2,0,0|1,0,1]=4 14573 B9R2.47 N#C[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35742005 [0,0,0,2,0,0|1,0,1]=4 14574 B9R2.47 NCC1CC2CC2C1 Amb26959092 [0,0,0,2,0,0|1,0,1]=4 14575 B9R2.47 NCC1CC2CC2C1 Amb32665069 [0,0,0,2,0,0|1,0,1]=4 14576 B9R2.47 NC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741986 [0,0,0,2,0,0|1,0,1]=4 14577 B9R2.47 O=CC1CC2CC2C1 Amb26505519 [0,0,0,2,0,0|0,0,0]=2 14578 B9R2.47 O=C[C@@H]1C[C@@H]2C[C@@H]2C1 Amb35741732 [0,0,0,2,0,0|0,0,0]=2 14579 B9R2.47 OCC1CC2CC2C1 Amb25809340 [0,0,0,2,0,0|0,0,2]=4 14580 B9R2.47 OCC1C[C@@H]2C[C@@H]2C1 Amb34915367 [0,0,0,2,0,0|0,0,2]=4 14581 B9R2.47 OC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb28454137 [0,0,0,2,0,0|0,0,2]=4 14582 B9R2.47 SCC1CC2CC2C1 Amb29849578 [0,0,0,2,0,0|0,1,1]=4 14583 B9R2.49 C1=CC2CCC1CN2 Amb18641334 [0,0,0,2,0,0|2,0,0]=4 14584 B9R2.49 C1CC2CCC1CN2 Amb22728599 [0,0,0,2,0,0|1,0,1]=4 14585 B9R2.49 C1CC2CCC1CN2 Amb27798997 [0,0,0,2,0,0|1,0,1]=4 14586 B9R2.49 C1CC2CCC1N=N2 Amb17844445 [0,0,0,2,0,0|2,0,0]=4 14587 B9R2.49 C1CC2CCC1NN2 Amb28324043 [0,0,0,2,0,0|2,0,0]=4 14588 B9R2.49 C1CC2CCC1NN2 Amb28920693 [0,0,0,2,0,0|2,0,0]=4 14589 B9R2.49 C1CC2CCC1NO2 Amb32660466 [0,0,0,2,0,0|1,0,1]=4 14590 B9R2.49 C1CC2CCC1NO2 Amb32668911 [0,0,0,2,0,0|1,0,1]=4 14591 B9R2.50 C1=CC[C@H]2NC[C@H]2C1 Amb33804561 [0,0,0,2,0,0|2,0,0]=4 14592 B9R2.50 C1CC2CCC2CN1 Amb27487622 [0,0,0,2,0,0|1,0,1]=4 14593 B9R2.50 C1CCC2NCC2C1 Amb7808805 [0,0,0,2,0,0|1,0,1]=4 14594 B9R2.50 C1CC[C@@H]2CN[C@H]2C1 Amb27880010 [0,0,0,2,0,0|1,0,1]=4 14595 B9R2.50 C1CC[C@H]2NC[C@H]2C1 Amb25168918 [0,0,0,2,0,0|1,0,1]=4 14596 B9R2.50 C1CNC2CCC2C1 Amb25976807 [0,0,0,2,0,0|1,0,1]=4 14597 B9R2.50 C1CNC2CCC2C1 Amb33457500 [0,0,0,2,0,0|1,0,1]=4 14598 B9R2.50 C1CN[C@@H]2CC[C@@H]2C1 Amb33457600 [0,0,0,2,0,0|1,0,1]=4 14599 B9R2.50 C1CN[C@H]2CC[C@H]2C1 Amb35745819 [0,0,0,2,0,0|1,0,1]=4 14600 B9R2.50 C1C[C@H]2CC[C@H]2CN1 Amb27661803 [0,0,0,2,0,0|1,0,1]=4 14601 B9R2.53 O=C1C2CCCC1C2 Amb28048997 [0,0,0,2,0,0|0,0,0]=2 14602 B9R2.53 O=C1C2CNCC1C2 Amb23448333 [0,0,0,2,0,0|1,0,0]=3 14603 B9R2.53 O=C1C2CNCC1C2 Amb30588638 [0,0,0,2,0,0|1,0,0]=3 14604 B9R2.56 BrCC12CCCC1C2 Amb27779920 [0,0,0,2,0,0|1,0,1]=4 14605 B9R2.56 CCC12CNCC1C2 Amb30526863 [0,0,0,2,0,0|2,0,0]=4 14606 B9R2.56 CC[C@@]12CNC[C@@H]1C2 Amb30526978 [0,0,0,2,0,0|2,0,0]=4 14607 B9R2.56 CC[C@@]12CNC[C@@H]1C2 Amb35788721 [0,0,0,2,0,0|2,0,0]=4 14608 B9R2.56 CNC12CCCC1C2 Amb35724499 [0,0,0,2,0,0|2,0,0]=4 14609 B9R2.56 ClCC12CCCC1C2 Amb30017462 [0,0,0,2,0,0|1,0,1]=4 14610 B9R2.56 NCC12CCCC1C2 Amb35701821 [0,0,0,2,0,0|1,0,1]=4 14611 B9R2.56 NC[C@@]12CCC[C@@H]1C2 Amb35745880 [0,0,0,2,0,0|1,0,1]=4 14612 B9R2.56 NC[C@]12CCC[C@H]1C2 Amb32681937 [0,0,0,2,0,0|1,0,1]=4 14613 B9R2.56 O=CC12COCC1C2 Amb35606775 [0,0,0,2,0,0|1,0,0]=3 14614 B9R2.56 OCC12CCCC1C2 Amb28077781 [0,0,0,2,0,0|0,0,2]=4 14615 B9R2.56 OC[C@]12CCC[C@H]1C2 Amb32679249 [0,0,0,2,0,0|0,0,2]=4 14616 B9R2.57 O=CC12CCC1CC2 Amb27797507 [0,0,0,2,0,0|0,0,0]=2 14617 B9R2.65 BrCC1C2CCCC12 Amb25060211 [0,0,0,2,0,0|1,0,1]=4 14618 B9R2.65 CNC1C2CCCC21 Amb27881819 [0,0,0,2,0,0|2,0,0]=4 14619 B9R2.65 CNC1C2CCCC21 Amb33456944 [0,0,0,2,0,0|2,0,0]=4 14620 B9R2.65 NCC1C2CCCC12 Amb26047449 [0,0,0,2,0,0|1,0,1]=4 14621 B9R2.65 NCC1C2CCCC12 Amb35750971 [0,0,0,2,0,0|1,0,1]=4 14622 B9R2.65 O=CC1C2CCCC12 Amb24483106 [0,0,0,2,0,0|0,0,0]=2 14623 B9R2.65 O=CC1C2CCNC12 Amb27210545 [0,0,0,2,0,0|1,0,0]=3 14624 B9R2.65 O=CC1C2CCOC12 Amb25294313 [0,0,0,2,0,0|1,0,0]=3 14625 B9R2.65 O=CC1C2CCSC12 Amb27216474 [0,0,0,2,0,0|1,0,0]=3 14626 B9R2.65 O=CC1C2COCC12 Amb25981549 [0,0,0,2,0,0|1,0,0]=3 14627 B9R2.65 O=CC1[C@H]2CCN[C@@H]12 Amb28287444 [0,0,0,2,0,0|1,0,0]=3 14628 B9R2.65 O=CC1[C@H]2CCS[C@@H]12 Amb27239791 [0,0,0,2,0,0|1,0,0]=3 14629 B9R2.65 O=C[C@@H]1[C@H]2COC[C@H]21 Amb25881533 [0,0,0,2,0,0|1,0,0]=3 14630 B9R2.65 O=C[C@H]1[C@@H]2C=CC[C@@H]21 Amb27818200 [0,0,0,2,0,0|0,0,2]=4 14631 B9R2.65 O=C[C@H]1[C@H]2C=CC[C@@H]12 Amb28131428 [0,0,0,2,0,0|0,0,2]=4 14632 B9R2.65 O=C[C@H]1[C@H]2COC[C@@H]12 Amb25225328 [0,0,0,2,0,0|1,0,0]=3 14633 B9R2.65 OCC1C2CCCC12 Amb26542427 [0,0,0,2,0,0|0,0,2]=4 14634 B9R2.65 OC[C@H]1[C@H]2CCC[C@@H]12 Amb27753115 [0,0,0,2,0,0|0,0,2]=4 14635 B9R2.68 C1=CC2CC(C1)CN2 Amb35789168 [0,0,0,2,0,0|2,0,0]=4 14636 B9R2.68 C1=CC2CC(C1)CN2 Amb35789832 [0,0,0,2,0,0|2,0,0]=4 14637 B9R2.68 C1=CC2CCC(C1)N2 Amb18123991 [0,0,0,2,0,0|2,0,0]=4 14638 B9R2.68 C1=CC2CCC(C1)N2 Amb28934858 [0,0,0,2,0,0|2,0,0]=4 14639 B9R2.68 C1=CC2CCCC1N2 Amb27838404 [0,0,0,2,0,0|2,0,0]=4 14640 B9R2.68 C1=C[C@H]2CC[C@@H](C1)C2 Amb26925899 [0,0,0,2,0,0|1,0,0]=3 14641 B9R2.68 C1CC2CCC(C1)N2 Amb10610725 [0,0,0,2,0,0|1,0,1]=4 14642 B9R2.68 C1CC2CCC(C1)N2 Amb19374849 [0,0,0,2,0,0|1,0,1]=4 14643 B9R2.68 C1CC2CCC(C1)O2 Amb22364980 [0,0,0,2,0,0|0,0,2]=4 14644 B9R2.68 C1CC2CCC(C2)N1 Amb18641674 [0,0,0,2,0,0|1,0,1]=4 14645 B9R2.68 C1CC2CCC(C2)N1 Amb35789676 [0,0,0,2,0,0|1,0,1]=4 14646 B9R2.68 C1CC2CCN(C1)C2 Amb27872310 [0,0,0,2,0,0|2,0,0]=4 14647 B9R2.68 C1CC2CNC(C1)C2 Amb3941214 [0,0,0,2,0,0|1,0,1]=4 14648 B9R2.68 C1CC2CNCC1C2 Amb10608778 [0,0,0,2,0,0|2,0,0]=4 14649 B9R2.68 C1CC2CNCC1C2 Amb18124234 [0,0,0,2,0,0|2,0,0]=4 14650 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 Amb22405871 [0,0,0,2,0,0|1,0,1]=4 14651 B9R2.68 C1C[C@@H]2CN[C@H](C1)C2 Amb34915801 [0,0,0,2,0,0|1,0,1]=4 14652 B9R2.68 C1C[C@H]2CC[C@@H](C1)N2 Amb33523610 [0,0,0,2,0,0|1,0,1]=4 14653 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 Amb22757909 [0,0,0,2,0,0|2,0,0]=4 14654 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 Amb24392297 [0,0,0,2,0,0|2,0,0]=4 14655 B9R2.68 C1C[C@H]2C[C@@H](C1)CN2 Amb23385228 [0,0,0,2,0,0|1,0,1]=4 14656 B9R2.70 NCC1CCC2CC12 Amb27431890 [0,0,0,2,0,0|1,0,1]=4 14657 B9R2.70 NCC1CCC2CC12 Amb32683368 [0,0,0,2,0,0|1,0,1]=4 14658 B9R2.70 NCC1CC[C@@H]2C[C@H]12 Amb32719896 [0,0,0,2,0,0|1,0,1]=4 14659 B9R2.70 NNC1CCC2CC21 Amb27597836 [0,0,0,2,0,0|2,0,0]=4 14660 B9R2.70 O=CC1=CCC2CC12 Amb27949600 [0,0,0,2,0,0|0,0,2]=4 14661 B9R2.70 OCC1CCC2CC12 Amb27606531 [0,0,0,2,0,0|0,0,2]=4 14662 B9R2.70 OC[C@@H]1CC[C@@H]2C[C@H]12 Amb27665513 [0,0,0,2,0,0|0,0,2]=4 14663 B9R2.123 BrC1[C@H]2CCC=C[C@@H]12 Amb27488925 [0,0,0,2,0,0|2,0,0]=4 14664 B9R2.123 Br[C@@H]1[C@H]2CCCC[C@H]21 Amb25279388 [0,0,0,2,0,0|1,0,1]=4 14665 B9R2.123 CC1C2CC=CCC12 Amb22356563 [0,0,0,2,0,0|1,0,1]=4 14666 B9R2.123 CC1C2CCCCC12 Amb22365158 [0,0,0,2,0,0|1,0,1]=4 14667 B9R2.123 CC1C2CCNCC12 Amb27797303 [0,0,0,2,0,0|2,0,0]=4 14668 B9R2.123 CN1C2CCCCC21 Amb22167171 [0,0,0,2,0,0|2,0,0]=4 14669 B9R2.123 ClC1C2CCCCC12 Amb25337704 [0,0,0,2,0,0|1,0,1]=4 14670 B9R2.123 Cl[C@H]1[C@H]2CCC=C[C@@H]12 Amb27433961 [0,0,0,2,0,0|2,0,0]=4 14671 B9R2.123 NC1C2CCCCC12 Amb20623881 [0,0,0,2,0,0|1,0,1]=4 14672 B9R2.123 NC1C2CCCCC12 Amb33528684 [0,0,0,2,0,0|1,0,1]=4 14673 B9R2.123 NC1[C@H]2CCCC[C@@H]12 Amb28252466 [0,0,0,2,0,0|1,0,1]=4 14674 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb25113495 [0,0,0,2,0,0|1,0,1]=4 14675 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb32651659 [0,0,0,2,0,0|1,0,1]=4 14676 B9R2.123 OC1C2CCCCC12 Amb17593167 [0,0,0,2,0,0|0,0,2]=4 14677 B9R2.174 C1=CCC2(CC1)CC2 Amb22365309 [0,0,0,2,0,0|1,0,1]=4 14678 B9R2.174 C1CCC2(CC1)CC2 Amb22231454 [0,0,0,2,0,0|1,0,1]=4 14679 B9R2.174 C1CCC2(CC1)CN2 Amb24117848 [0,0,0,2,0,0|1,0,1]=4 14680 B9R2.174 C1CCC2(CC1)CO2 Amb6892810 [0,0,0,2,0,0|0,0,2]=4 14681 B9R2.174 C1CCC2(CC1)CS2 Amb28061897 [0,0,0,2,0,0|0,1,1]=4 14682 B9R2.174 C1CCC2(CC1)NN2 Amb1078115 [0,0,0,2,0,0|2,0,0]=4 14683 B9R2.174 C1CCC2(CC2)NC1 Amb10607947 [0,0,0,2,0,0|1,0,1]=4 14684 B9R2.174 C1CCC2(CC2)NC1 Amb22586669 [0,0,0,2,0,0|1,0,1]=4 14685 B9R2.174 C1CNCC2(C1)CC2 Amb18833098 [0,0,0,2,0,0|2,0,0]=4 14686 B9R2.174 C1CNCC2(C1)CC2 Amb22754138 [0,0,0,2,0,0|2,0,0]=4 14687 B9R2.6 CC12CC1CCCN2 Amb27173752 [0,0,0,2,0,0|1,0,1]=4 14688 B9R2.6 CC12CCCCC1O2 Amb17939278 [0,0,0,2,0,0|0,0,2]=4 14689 B9R2.6 NC12CCCCC1C2 Amb25137276 [0,0,0,2,0,0|1,0,1]=4 14690 B9R2.6 NC12CCCCC1C2 Amb30585131 [0,0,0,2,0,0|1,0,1]=4 14691 B9R2.6 N[C@]12CCCC[C@H]1C2 Amb27975720 [0,0,0,2,0,0|1,0,1]=4 14692 B9R2.17 CC12CC1CCC2O Amb28285220 [0,0,0,2,0,0|0,0,2]=4 14693 B9R2.17 C[C@@]12C[C@@H]1CCC2=O Amb27972913 [0,0,0,2,0,0|0,0,0]=2 14694 B9R2.17 C[C@@]12C[C@@H]1CC[C@@H]2O Amb28321277 [0,0,0,2,0,0|0,0,2]=4 14695 B9R2.17 N[C@]12C[C@H]1COC2=O Amb27420696 [0,0,0,2,0,0|2,0,0]=4 14696 B9R2.17 O=C1CCC2CC12Br Amb28048970 [0,0,0,2,0,0|1,0,0]=3 14697 B9R2.17 O=C1CCC2CC12O Amb28285228 [0,0,0,2,0,0|1,0,0]=3 14698 B9R2.17 O=C1CC[C@@H]2C[C@]12Br Amb28285888 [0,0,0,2,0,0|1,0,0]=3 14699 B9R2.19 NC1CCC2CC1C2 Amb27630778 [0,0,0,2,0,0|1,0,1]=4 14700 B9R2.19 NC1CCC2CC1C2 Amb33330100 [0,0,0,2,0,0|1,0,1]=4 14701 B9R2.19 O=C1CCC2CC1C2 Amb33547757 [0,0,0,2,0,0|0,0,0]=2 14702 B9R2.19 O=C1CCC2CC1O2 Amb22364973 [0,0,0,2,0,0|1,0,0]=3 14703 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,0,0,2,0,0|1,0,0]=3 14704 B9R2.19 O=C1NCC2CC1N2 Amb27801865 [0,0,0,2,0,0|2,0,0]=4 14705 B9R2.19 O=C1NC[C@H]2C[C@@H]1O2 Amb27841075 [0,0,0,2,0,0|2,0,0]=4 14706 B9R2.19 OC1CCC2CC1C2 Amb27423100 [0,0,0,2,0,0|0,0,2]=4 14707 B9R2.19 O[C@@H]1CCC2CC1C2 Amb27461153 [0,0,0,2,0,0|0,0,2]=4 14708 B9R2.37 CC1C(=O)CC2OC21 Amb28316166 [0,0,0,2,0,0|1,0,0]=3 14709 B9R2.37 CC1CC2CC2C1=O Amb28048952 [0,0,0,2,0,0|0,0,0]=2 14710 B9R2.37 C[C@@H]1C(=O)C[C@@H]2C[C@@H]21 Amb28351384 [0,0,0,2,0,0|0,0,0]=2 14711 B9R2.37 O=C1[C@H](F)C[C@H]2C[C@@H]12 Amb33804306 [0,0,0,2,0,0|1,0,0]=3 14712 B9R2.39 BrC1=C[C@H]2CC[C@@H]1C2 Amb28058988 [0,0,0,2,0,0|1,0,1]=4 14713 B9R2.39 BrC1CC2C=CC1C2 Amb27243334 [0,0,0,2,0,0|2,0,0]=4 14714 B9R2.39 BrC1CC2CCC1C2 Amb6365773 [0,0,0,2,0,0|1,0,1]=4 14715 B9R2.39 Br[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27880716 [0,0,0,2,0,0|1,0,1]=4 14716 B9R2.39 Br[C@@H]1C[C@@H]2CC[C@H]1C2 Amb25934082 [0,0,0,2,0,0|1,0,1]=4 14717 B9R2.39 Br[C@@H]1C[C@H]2CC[C@@H]1C2 Amb26528019 [0,0,0,2,0,0|1,0,1]=4 14718 B9R2.39 Br[C@H]1C[C@@H]2CC[C@H]1C2 Amb25378969 [0,0,0,2,0,0|1,0,1]=4 14719 B9R2.39 Br[C@H]1C[C@H]2CC[C@H]1C2 Amb27215665 [0,0,0,2,0,0|1,0,1]=4 14720 B9R2.39 C=C1CC2CCC1C2 Amb4019165 [0,0,0,2,0,0|1,0,0]=3 14721 B9R2.39 CC1=CC2CCC1C2 Amb25246974 [0,0,0,2,0,0|1,0,1]=4 14722 B9R2.39 CC1=C[C@H]2CC[C@@H]1C2 Amb28320492 [0,0,0,2,0,0|1,0,1]=4 14723 B9R2.39 CC1CC2CCC1O2 Amb27202757 [0,0,0,2,0,0|0,0,2]=4 14724 B9R2.39 CC1C[C@H]2CN[C@@H]1C2 Amb27862456 [0,0,0,2,0,0|2,0,0]=4 14725 B9R2.39 CN1C[C@H]2CC[C@@H]1C2 Amb27627840 [0,0,0,2,0,0|2,0,0]=4 14726 B9R2.39 ClC1CC2CCC1C2 Amb22360712 [0,0,0,2,0,0|1,0,1]=4 14727 B9R2.39 ClC1C[C@@H]2C=C[C@H]1C2 Amb27477159 [0,0,0,2,0,0|2,0,0]=4 14728 B9R2.39 ClC1C[C@@H]2CC[C@H]1C2 Amb27203372 [0,0,0,2,0,0|1,0,1]=4 14729 B9R2.39 Cl[C@H]1C[C@@H]2C=C[C@H]1C2 Amb28286185 [0,0,0,2,0,0|2,0,0]=4 14730 B9R2.39 Cl[C@H]1C[C@H]2C=C[C@H]1C2 Amb28073803 [0,0,0,2,0,0|2,0,0]=4 14731 B9R2.39 Cl[C@H]1C[C@H]2CC[C@@H]1C2 Amb27436694 [0,0,0,2,0,0|1,0,1]=4 14732 B9R2.39 NC1CC2C=CC1C2 Amb22546323 [0,0,0,2,0,0|2,0,0]=4 14733 B9R2.39 NC1CC2C=CC1C2 Amb23592193 [0,0,0,2,0,0|2,0,0]=4 14734 B9R2.39 NC1CC2CCC1C2 Amb19374620 [0,0,0,2,0,0|1,0,1]=4 14735 B9R2.39 NC1CC2CCC1C2 Amb3371573 [0,0,0,2,0,0|1,0,1]=4 14736 B9R2.39 NC1C[C@H]2CC[C@@H]1C2 Amb27420147 [0,0,0,2,0,0|1,0,1]=4 14737 B9R2.39 NN1CC2CCC1C2 Amb18641715 [0,0,0,2,0,0|2,0,0]=4 14738 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 Amb22745923 [0,0,0,2,0,0|1,0,1]=4 14739 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 Amb22757963 [0,0,0,2,0,0|1,0,1]=4 14740 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 Amb24181889 [0,0,0,2,0,0|1,0,1]=4 14741 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 Amb3941691 [0,0,0,2,0,0|1,0,1]=4 14742 B9R2.39 N[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27799274 [0,0,0,2,0,0|2,0,0]=4 14743 B9R2.39 N[C@H]1C[C@@H]2CCC1C2 Amb6753692 [0,0,0,2,0,0|1,0,1]=4 14744 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 Amb33871470 [0,0,0,2,0,0|1,0,1]=4 14745 B9R2.39 N[C@H]1C[C@H]2CC[C@@H]1C2 Amb27420218 [0,0,0,2,0,0|1,0,1]=4 14746 B9R2.39 O=C1CC2C=CC1C2 Amb4477237 [0,0,0,2,0,0|0,0,2]=4 14747 B9R2.39 O=C1CC2CC1CN2 Amb34912723 [0,0,0,2,0,0|1,0,0]=3 14748 B9R2.39 O=C1CC2CC1CO2 Amb28048948 [0,0,0,2,0,0|1,0,0]=3 14749 B9R2.39 O=C1CC2CC1CS2 Amb27199157 [0,0,0,2,0,0|1,0,0]=3 14750 B9R2.39 O=C1CC2CCC1C2 Amb6608983 [0,0,0,2,0,0|0,0,0]=2 14751 B9R2.39 O=C1CC2CCC1N2 Amb26502233 [0,0,0,2,0,0|1,0,0]=3 14752 B9R2.39 O=C1CC2CCC1O2 Amb25322815 [0,0,0,2,0,0|1,0,0]=3 14753 B9R2.39 O=C1CC2CNC1C2 Amb26860988 [0,0,0,2,0,0|1,0,0]=3 14754 B9R2.39 O=C1CC2COC1C2 Amb24734169 [0,0,0,2,0,0|1,0,0]=3 14755 B9R2.39 O=C1CC2CSC1C2 Amb28321970 [0,0,0,2,0,0|1,0,0]=3 14756 B9R2.39 O=C1CN2CCC1C2 Amb10067112 [0,0,0,2,0,0|1,0,0]=3 14757 B9R2.39 O=C1CN2CCC1C2 Amb20171539 [0,0,0,2,0,0|1,0,0]=3 14758 B9R2.39 O=C1CN2CC[C@@H]1C2 Amb26480461 [0,0,0,2,0,0|1,0,0]=3 14759 B9R2.39 O=C1C[C@@H]2C=C[C@H]1C2 Amb28385475 [0,0,0,2,0,0|0,0,2]=4 14760 B9R2.39 O=C1C[C@@H]2CC[C@@H]1C2 Amb27622753 [0,0,0,2,0,0|0,0,0]=2 14761 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 Amb4605941 [0,0,0,2,0,0|0,0,0]=2 14762 B9R2.39 O=C1C[C@@H]2C[C@H]1CN2 Amb26578211 [0,0,0,2,0,0|1,0,0]=3 14763 B9R2.39 O=C1C[C@@H]2C[C@H]1CN2 Amb33715684 [0,0,0,2,0,0|1,0,0]=3 14764 B9R2.39 O=C1C[C@H]2C=C[C@@H]1C2 Amb25061616 [0,0,0,2,0,0|0,0,2]=4 14765 B9R2.39 O=C1C[C@H]2CC[C@@H]1N2 Amb27421729 [0,0,0,2,0,0|1,0,0]=3 14766 B9R2.39 O=C1C[C@H]2CC[C@@H]1O2 Amb27195774 [0,0,0,2,0,0|1,0,0]=3 14767 B9R2.39 O=C1C[C@H]2CS[C@@H]1C2 Amb28428954 [0,0,0,2,0,0|1,0,0]=3 14768 B9R2.39 O=C1NC2CCC1C2 Amb20623082 [0,0,0,2,0,0|1,0,0]=3 14769 B9R2.39 O=C1NC2CNC1C2 Amb18641690 [0,0,0,2,0,0|2,0,0]=4 14770 B9R2.39 O=C1N[C@@H]2CC[C@H]1C2 Amb25174368 [0,0,0,2,0,0|1,0,0]=3 14771 B9R2.39 O=C1N[C@@H]2CN[C@H]1C2 Amb22587593 [0,0,0,2,0,0|2,0,0]=4 14772 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 Amb8516352 [0,0,0,2,0,0|1,0,0]=3 14773 B9R2.39 O=C1OC2CCC1C2 Amb31379084 [0,0,0,2,0,0|1,0,0]=3 14774 B9R2.39 O=C1OC2CNC1C2 Amb15692521 [0,0,0,2,0,0|2,0,0]=4 14775 B9R2.39 O=C1OC2CNC1C2 Amb28934913 [0,0,0,2,0,0|2,0,0]=4 14776 B9R2.39 O=C1OC2CN[C@H]1C2 Amb27637868 [0,0,0,2,0,0|2,0,0]=4 14777 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb19516242 [0,0,0,2,0,0|2,0,0]=4 14778 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 Amb27779719 [0,0,0,2,0,0|2,0,0]=4 14779 B9R2.39 O=S1CC2CC1CN2 Amb25806028 [0,0,0,2,0,0|2,0,0]=4 14780 B9R2.39 O=S1CC2CC1CN2 Amb32665001 [0,0,0,2,0,0|2,0,0]=4 14781 B9R2.39 O=S1C[C@@H]2C[C@@H]1CN2 Amb34914992 [0,0,0,2,0,0|2,0,0]=4 14782 B9R2.39 O=S1C[C@@H]2C[C@H]1CN2 Amb24560813 [0,0,0,2,0,0|2,0,0]=4 14783 B9R2.39 O=S1C[C@@H]2C[C@H]1CN2 Amb32664645 [0,0,0,2,0,0|2,0,0]=4 14784 B9R2.39 OC1CC2C=CC1C2 Amb19958337 [0,0,0,2,0,0|2,0,0]=4 14785 B9R2.39 OC1CC2CCC1C2 Amb2780727 [0,0,0,2,0,0|0,0,2]=4 14786 B9R2.39 OC1CC2CC[C@H]1C2 Amb28079100 [0,0,0,2,0,0|0,0,2]=4 14787 B9R2.39 OC1C[C@@H]2C=C[C@H]1C2 Amb26920676 [0,0,0,2,0,0|2,0,0]=4 14788 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 Amb27962782 [0,0,0,2,0,0|0,0,2]=4 14789 B9R2.39 OC1C[C@H]2C=C[C@@H]1C2 Amb33524064 [0,0,0,2,0,0|2,0,0]=4 14790 B9R2.39 OC1C[C@H]2C=C[C@H]1C2 Amb28428493 [0,0,0,2,0,0|2,0,0]=4 14791 B9R2.39 ON1C[C@@H]2CC[C@H]1C2 Amb25912114 [0,0,0,2,0,0|1,0,1]=4 14792 B9R2.39 O[C@@H]1CC2C=C[C@@H]1C2 Amb28069705 [0,0,0,2,0,0|2,0,0]=4 14793 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27481081 [0,0,0,2,0,0|0,0,2]=4 14794 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb28369855 [0,0,0,2,0,0|2,0,0]=4 14795 B9R2.39 O[C@@H]1C[C@H]2C=C[C@H]1C2 Amb28053800 [0,0,0,2,0,0|2,0,0]=4 14796 B9R2.39 O[C@@H]1C[C@H]2CCC1C2 Amb28455166 [0,0,0,2,0,0|0,0,2]=4 14797 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 Amb10844941 [0,0,0,2,0,0|0,0,2]=4 14798 B9R2.39 O[C@H]1CC2CC[C@@H]1C2 Amb27853961 [0,0,0,2,0,0|0,0,2]=4 14799 B9R2.39 O[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27428377 [0,0,0,2,0,0|2,0,0]=4 14800 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1C2 Amb24567063 [0,0,0,2,0,0|0,0,2]=4 14801 B9R2.39 O[C@H]1C[C@H]2C=C[C@@H]1C2 Amb27635724 [0,0,0,2,0,0|2,0,0]=4 14802 B9R2.39 O[C@H]1C[C@H]2CC[C@@H]1C2 Amb3940163 [0,0,0,2,0,0|0,0,2]=4 14803 B9R2.39 SC1CC2C=CC1C2 Amb32788481 [0,0,0,2,0,0|2,0,0]=4 14804 B9R2.39 SC1CC2CCC1C2 Amb25359572 [0,0,0,2,0,0|0,1,1]=4 14805 B9R2.39 SC1C[C@H]2C=C[C@@H]1C2 Amb32788701 [0,0,0,2,0,0|2,0,0]=4 14806 B9R2.90 O=C1[C@H](Cl)[C@H]2CC[C@@H]12 Amb27643745 [0,0,0,2,0,0|1,0,0]=3 14807 B9R2.109 NC1CCCC2CC12 Amb19375082 [0,0,0,2,0,0|1,0,1]=4 14808 B9R2.109 NC1CCCC2CC12 Amb32681181 [0,0,0,2,0,0|1,0,1]=4 14809 B9R2.109 NC1CCC[C@@H]2C[C@H]12 Amb27250144 [0,0,0,2,0,0|1,0,1]=4 14810 B9R2.109 NC1CCC[C@@H]2C[C@H]12 Amb32663452 [0,0,0,2,0,0|1,0,1]=4 14811 B9R2.109 NC1CCC[C@H]2C[C@@H]12 Amb27815166 [0,0,0,2,0,0|1,0,1]=4 14812 B9R2.109 NC1CCC[C@H]2C[C@@H]12 Amb32652158 [0,0,0,2,0,0|1,0,1]=4 14813 B9R2.109 O=C1C=CCC2CC12 Amb27261956 [0,0,0,2,0,0|0,0,2]=4 14814 B9R2.109 O=C1C=CC[C@H]2C[C@@H]12 Amb27199136 [0,0,0,2,0,0|0,0,2]=4 14815 B9R2.109 O=C1CCCC2CC12 Amb17593139 [0,0,0,2,0,0|0,0,0]=2 14816 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,2,0,0|1,0,0]=3 14817 B9R2.109 O=C1CCC[C@@H]2C[C@@H]12 Amb24512517 [0,0,0,2,0,0|0,0,0]=2 14818 B9R2.109 O=C1CCC[C@@H]2C[C@H]12 Amb25934279 [0,0,0,2,0,0|0,0,0]=2 14819 B9R2.109 O=C1CCC[C@H]2C[C@@H]12 Amb24723004 [0,0,0,2,0,0|0,0,0]=2 14820 B9R2.109 O=C1CCC[C@H]2C[C@H]12 Amb27640590 [0,0,0,2,0,0|0,0,0]=2 14821 B9R2.109 O=C1CCNC2CC12 Amb27239180 [0,0,0,2,0,0|1,0,0]=3 14822 B9R2.109 O=C1NCC[C@@H]2O[C@H]12 Amb27446837 [0,0,0,2,0,0|2,0,0]=4 14823 B9R2.109 O=C1NNCC2CC12 Amb27797433 [0,0,0,2,0,0|2,0,0]=4 14824 B9R2.109 OC1CCCC2CC12 Amb26963531 [0,0,0,2,0,0|0,0,2]=4 14825 B9R2.109 OC1CCC[C@@H]2C[C@H]12 Amb27659888 [0,0,0,2,0,0|0,0,2]=4 14826 B9R2.109 O[C@@H]1C=CC[C@H]2C[C@@H]12 Amb27790188 [0,0,0,2,0,0|2,0,0]=4 14827 B9R2.109 O[C@@H]1CCC[C@H]2C[C@H]21 Amb27432134 [0,0,0,2,0,0|0,0,2]=4 14828 B9R2.109 O[C@H]1C=CC[C@H]2C[C@H]21 Amb27219001 [0,0,0,2,0,0|2,0,0]=4 14829 B9R2.109 O[C@H]1CCC[C@@H]2C[C@H]12 Amb27261725 [0,0,0,2,0,0|0,0,2]=4 14830 B9R2.109 O[C@H]1CCC[C@H]2C[C@@H]12 Amb27805079 [0,0,0,2,0,0|0,0,2]=4 14831 B9R2.109 SC1CCCC2CC12 Amb26316463 [0,0,0,2,0,0|0,1,1]=4 14832 B9R2.109 SC1CCC[C@@H]2C[C@H]12 Amb32788238 [0,0,0,2,0,0|0,1,1]=4 14833 B9R2.1 BrC1CC12CCCC2 Amb32649170 [0,0,0,2,0,0|1,0,1]=4 14834 B9R2.1 CC1CC12CCNC2 Amb33070934 [0,0,0,2,0,0|2,0,0]=4 14835 B9R2.1 NC1CC12CCCC2 Amb17605510 [0,0,0,2,0,0|1,0,1]=4 14836 B9R2.1 NC1CC12CCCC2 Amb28934811 [0,0,0,2,0,0|1,0,1]=4 14837 B9R2.2 C1=NC(C2CC2)CN1 Amb35656304 [0,0,0,2,0,0|2,0,0]=4 14838 B9R2.2 C1CC(C2CC2)CN1 Amb33529969 [0,0,0,2,0,0|2,0,0]=4 14839 B9R2.2 C1CCC(C2CO2)C1 Amb27655529 [0,0,0,2,0,0|0,0,2]=4 14840 B9R2.2 C1CCC([C@@H]2CO2)C1 Amb33315082 [0,0,0,2,0,0|0,0,2]=4 14841 B9R2.2 C1CCC([C@H]2CO2)C1 Amb33315083 [0,0,0,2,0,0|0,0,2]=4 14842 B9R2.2 C1CNC(C2CC2)C1 Amb19372940 [0,0,0,2,0,0|1,0,1]=4 14843 B9R2.2 C1CNC(C2CC2)C1 Amb9716012 [0,0,0,2,0,0|1,0,1]=4 14844 B9R2.2 C1CN[C@@H](C2CC2)C1 Amb27170744 [0,0,0,2,0,0|1,0,1]=4 14845 B9R2.2 C1CN[C@@H](C2CC2)C1 Amb35752734 [0,0,0,2,0,0|1,0,1]=4 14846 B9R2.2 C1CN[C@H](C2CC2)C1 Amb26515751 [0,0,0,2,0,0|1,0,1]=4 14847 B9R2.2 C1C[C@@H](C2CC2)CN1 Amb28247083 [0,0,0,2,0,0|2,0,0]=4 14848 B9R2.3 C1=C2CNCC2CC1 Amb35788406 [0,0,0,2,0,0|2,0,0]=4 14849 B9R2.3 C1=C2CNCC2CC1 Amb35789050 [0,0,0,2,0,0|2,0,0]=4 14850 B9R2.3 C1=NC2CCCC2N1 Amb35656303 [0,0,0,2,0,0|2,0,0]=4 14851 B9R2.3 C1=NCC2CCCC12 Amb25957455 [0,0,0,2,0,0|1,0,0]=3 14852 B9R2.3 C1CC2=NCCN2C1 Amb26059972 [0,0,0,2,0,0|2,0,0]=4 14853 B9R2.3 C1CC2CCCN2C1 Amb22371122 [0,0,0,2,0,0|1,0,1]=4 14854 B9R2.3 C1CC2CCNC2C1 Amb18641673 [0,0,0,2,0,0|1,0,1]=4 14855 B9R2.3 C1CC2CCNC2C1 Amb32651656 [0,0,0,2,0,0|1,0,1]=4 14856 B9R2.3 C1CC2CNCC2C1 Amb10604048 [0,0,0,2,0,0|1,0,1]=4 14857 B9R2.3 C1CC2CNCC2C1 Amb8387764 [0,0,0,2,0,0|1,0,1]=4 14858 B9R2.3 C1CC2CNOC2C1 Amb23512675 [0,0,0,2,0,0|1,0,1]=4 14859 B9R2.3 C1CC2NCC[C@H]2C1 Amb27489269 [0,0,0,2,0,0|1,0,1]=4 14860 B9R2.3 C1C[C@@H]2CCN[C@@H]2C1 Amb25230592 [0,0,0,2,0,0|1,0,1]=4 14861 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 Amb22745958 [0,0,0,2,0,0|1,0,1]=4 14862 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 Amb28985813 [0,0,0,2,0,0|1,0,1]=4 14863 B9R2.3 C1C[C@@H]2NCC[C@H]2C1 Amb18203381 [0,0,0,2,0,0|1,0,1]=4 14864 B9R2.3 C1C[C@H]2CCN[C@H]2C1 Amb25978362 [0,0,0,2,0,0|1,0,1]=4 14865 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 Amb26442837 [0,0,0,2,0,0|1,0,1]=4 14866 B9R2.7 NC1CC2CCCC12 Amb27834589 [0,0,0,2,0,0|1,0,1]=4 14867 B9R2.7 NC1CC2CCCC12 Amb30585129 [0,0,0,2,0,0|1,0,1]=4 14868 B9R2.7 NC1C[C@H]2CCC[C@@H]12 Amb27438793 [0,0,0,2,0,0|1,0,1]=4 14869 B9R2.7 N[C@@H]1C[C@H]2CCC[C@@H]12 Amb28131512 [0,0,0,2,0,0|1,0,1]=4 14870 B9R2.7 O=C1CC2C=CCC12 Amb8631505 [0,0,0,2,0,0|0,0,2]=4 14871 B9R2.7 O=C1CC2CC=CC12 Amb6608765 [0,0,0,2,0,0|0,0,2]=4 14872 B9R2.7 O=C1CC2CCOC12 Amb27593836 [0,0,0,2,0,0|1,0,0]=3 14873 B9R2.7 O=C1CC2CNCC12 Amb26370314 [0,0,0,2,0,0|1,0,0]=3 14874 B9R2.7 O=C1C[C@@H]2C=CC[C@H]12 Amb22735988 [0,0,0,2,0,0|0,0,2]=4 14875 B9R2.7 O=C1C[C@@H]2CCC[C@H]12 Amb27427660 [0,0,0,2,0,0|0,0,0]=2 14876 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [0,0,0,2,0,0|1,0,0]=3 14877 B9R2.7 O=C1C[C@@H]2COC[C@H]12 Amb26920071 [0,0,0,2,0,0|1,0,0]=3 14878 B9R2.7 O=C1C[C@H]2C=CC[C@H]12 Amb25962489 [0,0,0,2,0,0|0,0,2]=4 14879 B9R2.7 O=C1NC2CCCC12 Amb2694983 [0,0,0,2,0,0|1,0,0]=3 14880 B9R2.7 O=C1NC2OCCC12 Amb24481565 [0,0,0,2,0,0|2,0,0]=4 14881 B9R2.7 O=C1N[C@@H]2CCC[C@H]12 Amb25278653 [0,0,0,2,0,0|1,0,0]=3 14882 B9R2.7 O=C1N[C@@H]2CCN[C@H]12 Amb27796913 [0,0,0,2,0,0|2,0,0]=4 14883 B9R2.7 O=C1N[C@@H]2OCC[C@H]12 Amb33192983 [0,0,0,2,0,0|2,0,0]=4 14884 B9R2.7 O=C1N[C@H]2CCC[C@@H]12 Amb6366178 [0,0,0,2,0,0|1,0,0]=3 14885 B9R2.7 O=C1N[C@H]2OCC[C@@H]12 Amb27785542 [0,0,0,2,0,0|2,0,0]=4 14886 B9R2.7 OC1C[C@H]2C=CC[C@@H]12 Amb27652871 [0,0,0,2,0,0|2,0,0]=4 14887 B9R2.7 O[C@@H]1C[C@H]2C=CC[C@H]21 Amb27488639 [0,0,0,2,0,0|2,0,0]=4 14888 B9R2.7 O[C@@H]1C[C@H]2CCC[C@@H]12 Amb27184164 [0,0,0,2,0,0|0,0,2]=4 14889 B9R2.7 O[C@H]1C[C@H]2C=CC[C@@H]12 Amb28065322 [0,0,0,2,0,0|2,0,0]=4 14890 B9R2.7 O[C@H]1C[C@H]2CCC[C@@H]12 Amb27652942 [0,0,0,2,0,0|0,0,2]=4 14891 B9R2.7 SC1CC2CCCC12 Amb32788559 [0,0,0,2,0,0|0,1,1]=4 14892 B9R2.7 SC1C[C@@H]2CCC[C@H]12 Amb32788104 [0,0,0,2,0,0|0,1,1]=4 14893 B9R2.80 O=C[C@H]1[C@H]2CC[C@@H]1C2 Amb28198863 [0,0,0,2,0,0|0,0,0]=2 14894 B9R2.173 C1=CC2(CCC2)NC1 Amb32667430 [0,0,0,2,0,0|2,0,0]=4 14895 B9R2.173 C1=NC2(CCC2)CN1 Amb35656302 [0,0,0,2,0,0|2,0,0]=4 14896 B9R2.173 C1CC2(C1)CCNC2 Amb19943938 [0,0,0,2,0,0|2,0,0]=4 14897 B9R2.173 C1CC2(C1)CCNC2 Amb22230054 [0,0,0,2,0,0|2,0,0]=4 14898 B9R2.173 C1CC2(C1)CCNC2 Amb23439939 [0,0,0,2,0,0|2,0,0]=4 14899 B9R2.173 C1CC2(C1)CCNC2 Amb31308447 [0,0,0,2,0,0|2,0,0]=4 14900 B9R2.173 C1CCC2(C1)CCC2 Amb6296982 [0,0,0,2,0,0|1,0,1]=4 14901 B9R2.173 C1CCC2(C1)CCN2 Amb21964937 [0,0,0,2,0,0|1,0,1]=4 14902 B9R2.173 C1CCC2(C1)CCN2 Amb32410097 [0,0,0,2,0,0|1,0,1]=4 14903 B9R2.173 C1CCC2(C1)CNC2 Amb23439938 [0,0,0,2,0,0|2,0,0]=4 14904 B9R2.173 C1CCC2(C1)CNC2 Amb31291156 [0,0,0,2,0,0|2,0,0]=4 14905 B9R2.173 C1CCC2(C1)CNC2 Amb7764635 [0,0,0,2,0,0|2,0,0]=4 14906 B9R2.173 C1CCC2(C1)COC2 Amb27241649 [0,0,0,2,0,0|2,0,0]=4 14907 B9R2.173 C1CNC2(C1)CCC2 Amb22229939 [0,0,0,2,0,0|1,0,1]=4 14908 B9R2.173 C1CNC2(C1)CCC2 Amb22406280 [0,0,0,2,0,0|1,0,1]=4 14909 B9R2.173 C1CNC2(C1)CCC2 Amb28934834 [0,0,0,2,0,0|1,0,1]=4 14910 B9R2.173 C1CNC2(C1)CCC2 Amb31307805 [0,0,0,2,0,0|1,0,1]=4 14911 B9R2.173 C1CNC2(C1)CCC2 Amb32683385 [0,0,0,2,0,0|1,0,1]=4 14912 B9R2.11 CC1CC1C2CC2N Amb32674637 [0,0,0,2,0,0|1,0,1]=4 14913 B9R2.11 CC1CC1C2CC2N Amb32682424 [0,0,0,2,0,0|1,0,1]=4 14914 B9R2.11 CC1CC1[C@@H]2C[C@H]2N Amb33144657 [0,0,0,2,0,0|1,0,1]=4 14915 B9R2.11 C[C@@H]1C[C@H]1[C@@H]2C[C@H]2N Amb32682468 [0,0,0,2,0,0|1,0,1]=4 14916 B9R2.11 C[C@@H]1C[C@H]1[C@@H]2C[C@H]2N Amb32682469 [0,0,0,2,0,0|1,0,1]=4 14917 B9R2.12 CC1CC1CC2CO2 Amb33144969 [0,0,0,2,0,0|0,0,2]=4 14918 B9R2.12 NC1CC1CC2CC2 Amb33361459 [0,0,0,2,0,0|1,0,1]=4 14919 B9R2.12 N[C@@H]1C[C@H]1CC2CC2 Amb33361500 [0,0,0,2,0,0|1,0,1]=4 14920 B9R2.18 C=C1C2CCC(=O)C12 Amb27749879 [0,0,0,2,0,0|0,0,2]=4 14921 B9R2.18 C=C1C2CCC(O)C12 Amb27598579 [0,0,0,2,0,0|2,0,0]=4 14922 B9R2.18 CC1C2CCC(=O)C12 Amb27803582 [0,0,0,2,0,0|0,0,0]=2 14923 B9R2.18 CC1[C@@H]2CC[C@H](O)[C@H]12 Amb28052862 [0,0,0,2,0,0|0,0,2]=4 14924 B9R2.18 C[C@@H]1[C@@H]2CCC(=O)[C@@H]21 Amb27433144 [0,0,0,2,0,0|0,0,0]=2 14925 B9R2.18 C[C@H]1[C@@H]2CCC(=O)[C@H]12 Amb27433145 [0,0,0,2,0,0|0,0,0]=2 14926 B9R2.18 C[C@H]1[C@@H]2CC[C@@H](O)[C@H]12 Amb28345451 [0,0,0,2,0,0|0,0,2]=4 14927 B9R2.18 O=C1CC[C@H]2C(Br)[C@@H]12 Amb27630445 [0,0,0,2,0,0|1,0,0]=3 14928 B9R2.18 O=C1CC[C@H]2[C@@H](Br)[C@@H]12 Amb27644076 [0,0,0,2,0,0|1,0,0]=3 14929 B9R2.21 ClC1CCC2CC2C1 Amb27233015 [0,0,0,2,0,0|1,0,1]=4 14930 B9R2.21 NC1CCC2CC2C1 Amb26367227 [0,0,0,2,0,0|1,0,1]=4 14931 B9R2.21 NC1CCC2CC2C1 Amb32664396 [0,0,0,2,0,0|1,0,1]=4 14932 B9R2.21 NC1CC[C@H]2C[C@H]2C1 Amb33191737 [0,0,0,2,0,0|1,0,1]=4 14933 B9R2.21 NN1CCC2CC2C1 Amb29882027 [0,0,0,2,0,0|2,0,0]=4 14934 B9R2.21 N[C@@H]1CC[C@@H]2C[C@@H]2C1 Amb28423376 [0,0,0,2,0,0|1,0,1]=4 14935 B9R2.21 O=C1C=CC2CC2C1 Amb28284686 [0,0,0,2,0,0|0,0,2]=4 14936 B9R2.21 O=C1CC2CC2CN1 Amb33716335 [0,0,0,2,0,0|1,0,0]=3 14937 B9R2.21 O=C1CCC2CC2C1 Amb28316224 [0,0,0,2,0,0|0,0,0]=2 14938 B9R2.21 O=C1CCC2CC2N1 Amb27636987 [0,0,0,2,0,0|1,0,0]=3 14939 B9R2.21 O=C1CCC2CC2O1 Amb27422131 [0,0,0,2,0,0|1,0,0]=3 14940 B9R2.21 O=C1NC2CC2CO1 Amb28247932 [0,0,0,2,0,0|2,0,0]=4 14941 B9R2.21 OC1C=C[C@@H]2C[C@@H]2C1 Amb27197544 [0,0,0,2,0,0|2,0,0]=4 14942 B9R2.21 OC1CC[C@@H]2C[C@@H]2C1 Amb27857686 [0,0,0,2,0,0|0,0,2]=4 14943 B9R2.21 O[C@@H]1C=C[C@H]2C[C@H]2C1 Amb28202543 [0,0,0,2,0,0|2,0,0]=4 14944 B9R2.21 O[C@H]1CC[C@H]2C[C@H]2C1 Amb27978320 [0,0,0,2,0,0|0,0,2]=4 14945 B9R2.44 C=C1CC12CC2CO Amb27652980 [0,0,0,2,0,0|2,0,0]=4 14946 B9R2.44 C=C1C[C@@]12C[C@@H]2CBr Amb28429542 [0,0,0,2,0,0|2,0,0]=4 14947 B9R2.44 C=C1C[C@@]12C[C@@H]2CO Amb27208142 [0,0,0,2,0,0|2,0,0]=4 14948 B9R2.44 C[C@@H]1C[C@@]12CC2CO Amb27202583 [0,0,0,2,0,0|0,0,2]=4 14949 B9R2.44 C[C@H]1C[C@@]12C[C@@H]2CO Amb28206047 [0,0,0,2,0,0|0,0,2]=4 14950 B9R2.44 C[C@H]1C[C@@]12C[C@H]2CO Amb27422318 [0,0,0,2,0,0|0,0,2]=4 14951 B9R2.52 C1CC2CC2CCN1 Amb18203386 [0,0,0,2,0,0|1,0,1]=4 14952 B9R2.52 C1CCC2CC2NC1 Amb18203388 [0,0,0,2,0,0|1,0,1]=4 14953 B9R2.52 C1CCC2NC2CC1 Amb10609123 [0,0,0,2,0,0|1,0,1]=4 14954 B9R2.52 C1CCC2OC2CC1 Amb9708770 [0,0,0,2,0,0|0,0,2]=4 14955 B9R2.52 C1CNCC2CC2C1 Amb18203387 [0,0,0,2,0,0|1,0,1]=4 14956 B9R2.108 CC1CC1C2CCN2 Amb33429790 [0,0,0,2,0,0|1,0,1]=4 14957 B9R2.108 CC1CC1C2CNC2 Amb33144904 [0,0,0,2,0,0|2,0,0]=4 14958 B9R2.108 NC1CC1C2CCC2 Amb24483254 [0,0,0,2,0,0|1,0,1]=4 14959 B9R2.108 NC1CC1C2CCC2 Amb32663894 [0,0,0,2,0,0|1,0,1]=4 14960 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb24581403 [0,0,0,2,0,0|1,0,1]=4 14961 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb32663923 [0,0,0,2,0,0|1,0,1]=4 14962 B9R2.20 ClC1C=CC2CCC12 Amb27267998 [0,0,0,2,0,0|2,0,0]=4 14963 B9R2.20 Cl[C@@H]1CC[C@@H]2CC[C@@H]21 Amb27777148 [0,0,0,2,0,0|1,0,1]=4 14964 B9R2.20 Cl[C@H]1CC[C@@H]2CC[C@H]12 Amb27212344 [0,0,0,2,0,0|1,0,1]=4 14965 B9R2.20 NC1=NCC2CCC12 Amb27602052 [0,0,0,2,0,0|2,0,0]=4 14966 B9R2.20 NC1CCC2CCC12 Amb26043876 [0,0,0,2,0,0|1,0,1]=4 14967 B9R2.20 O=C1C=CC2CCC12 Amb22365116 [0,0,0,2,0,0|0,0,2]=4 14968 B9R2.20 O=C1CCC2CCC12 Amb26556513 [0,0,0,2,0,0|0,0,0]=2 14969 B9R2.20 O=C1CC[C@@H]2C=C[C@H]12 Amb27782001 [0,0,0,2,0,0|0,0,2]=4 14970 B9R2.20 O=C1CC[C@@H]2CC[C@H]12 Amb27214199 [0,0,0,2,0,0|0,0,0]=2 14971 B9R2.20 O=C1NCC2CCC12 Amb24121240 [0,0,0,2,0,0|1,0,0]=3 14972 B9R2.20 O=C1NC[C@@H]2CC[C@H]12 Amb28131123 [0,0,0,2,0,0|1,0,0]=3 14973 B9R2.20 O[C@@H]1C=C[C@@H]2CC[C@H]12 Amb25252536 [0,0,0,2,0,0|2,0,0]=4 14974 B9R2.20 O[C@@H]1CC[C@@H]2C=C[C@H]12 Amb28435644 [0,0,0,2,0,0|2,0,0]=4 14975 B9R2.20 O[C@@H]1CC[C@H]2CC[C@@H]12 Amb27420440 [0,0,0,2,0,0|0,0,2]=4 14976 B9R2.20 O[C@H]1C=CC2CCC21 Amb26641999 [0,0,0,2,0,0|2,0,0]=4 14977 B9R2.20 O[C@H]1C=C[C@@H]2CC[C@@H]21 Amb24648863 [0,0,0,2,0,0|2,0,0]=4 14978 B9R2.20 O[C@H]1CC[C@@H]2CC[C@H]12 Amb28256395 [0,0,0,2,0,0|0,0,2]=4 14979 B9R2.20 O[C@H]1CC[C@H]2CC[C@@H]12 Amb27653200 [0,0,0,2,0,0|0,0,2]=4 14980 B9R2.20 SC1CCC2CCC12 Amb32788214 [0,0,0,2,0,0|0,1,1]=4 14981 B9R2.20 SC1CC[C@@H]2CC[C@H]12 Amb32788780 [0,0,0,2,0,0|0,1,1]=4 14982 B9R2.51 C1CC2CC(CN1)C2 Amb27224402 [0,0,0,2,0,0|2,0,0]=4 14983 B9R2.91 C1CC(C2CCC2)C1 Amb27213025 [0,0,0,2,0,0|1,0,1]=4 14984 B9R2.91 C1CC(C2CCN2)C1 Amb27216687 [0,0,0,2,0,0|1,0,1]=4 14985 B9R2.91 C1CC(C2CCN2)C1 Amb33306998 [0,0,0,2,0,0|1,0,1]=4 14986 B9R2.91 C1CC(C2CNC2)C1 Amb30586554 [0,0,0,2,0,0|2,0,0]=4 14987 B9R2.91 C1CC([C@@H]2CCN2)C1 Amb28119940 [0,0,0,2,0,0|1,0,1]=4 14988 B9R2.140 CC1CCC12CNC2 Amb27628091 [0,0,0,2,0,0|2,0,0]=4 14989 B9R2.140 CC1CCC12CNC2 Amb33610426 [0,0,0,2,0,0|2,0,0]=4 14990 B9R2.140 NC1CCC12CCC2 Amb33620891 [0,0,0,2,0,0|1,0,1]=4 14991 B9R2.140 NC1CCC12CCC2 Amb8009831 [0,0,0,2,0,0|1,0,1]=4 14992 B9R2.140 O=C1CCC12CCC2 Amb22497347 [0,0,0,2,0,0|0,0,0]=2 14993 B9R2.140 O=C1COC12CCC2 Amb26079298 [0,0,0,2,0,0|1,0,0]=3 14994 B9R2.140 O=C1NCC12CCC2 Amb27856332 [0,0,0,2,0,0|1,0,0]=3 14995 B9R2.140 OC1CCC12CCC2 Amb26539171 [0,0,0,2,0,0|0,0,2]=4 14996 B9R2.153 BrCC1CC12CCC2 Amb28285214 [0,0,0,2,0,0|1,0,1]=4 14997 B9R2.153 C#CC1CC12CCC2 Amb33169089 [0,0,0,2,0,0|1,0,1]=4 14998 B9R2.153 CNC1CC12CCC2 Amb27230173 [0,0,0,2,0,0|2,0,0]=4 14999 B9R2.153 ClCC1CC12CCC2 Amb27833213 [0,0,0,2,0,0|1,0,1]=4 15000 B9R2.153 NCC1CC12CCC2 Amb26411035 [0,0,0,2,0,0|1,0,1]=4 15001 B9R2.153 O=CC1CC12CSC2 Amb27962980 [0,0,0,2,0,0|1,0,0]=3 15002 B9R2.153 OCC1CC12CCC2 Amb26942513 [0,0,0,2,0,0|0,0,2]=4 15003 B9R2.157 C1CC(CC2CC2)N1 Amb33230094 [0,0,0,2,0,0|1,0,1]=4 15004 B9R2.157 C1CC(CC2CO2)C1 Amb26390615 [0,0,0,2,0,0|0,0,2]=4 15005 B9R2.157 C1CC1CC2CNC2 Amb18285131 [0,0,0,2,0,0|2,0,0]=4 15006 B9R2.157 C1CC1CC2CNC2 Amb32668144 [0,0,0,2,0,0|2,0,0]=4 15007 B9R2.5 C=C1CNCC12CC2 Amb27873956 [0,0,0,2,0,0|2,0,0]=4 15008 B9R2.5 CC1CCCC12CO2 Amb24533573 [0,0,0,2,0,0|0,0,2]=4 15009 B9R2.5 NC1CCCC12CC2 Amb18833097 [0,0,0,2,0,0|1,0,1]=4 15010 B9R2.5 NC1CCCC12CC2 Amb30585109 [0,0,0,2,0,0|1,0,1]=4 15011 B9R2.5 O=C1C=CCC12CC2 Amb28126582 [0,0,0,2,0,0|0,0,2]=4 15012 B9R2.5 O=C1CCCC12CC2 Amb18561391 [0,0,0,2,0,0|0,0,0]=2 15013 B9R2.5 O=C1CCNC12CC2 Amb27410454 [0,0,0,2,0,0|1,0,0]=3 15014 B9R2.5 O=C1CCOC12CC2 Amb28200008 [0,0,0,2,0,0|1,0,0]=3 15015 B9R2.5 O=C1NCCC12CC2 Amb24053126 [0,0,0,2,0,0|1,0,0]=3 15016 B9R2.5 O=C1OCCC12CC2 Amb25712350 [0,0,0,2,0,0|1,0,0]=3 15017 B9R2.5 O=C1OCCC12CO2 Amb33496163 [0,0,0,2,0,0|2,0,0]=4 15018 B9R2.5 OC1CCCC12CC2 Amb27484590 [0,0,0,2,0,0|0,0,2]=4 15019 B9R2.5 SC1CCCC12CC2 Amb32788509 [0,0,0,2,0,0|0,1,1]=4 15020 B9R2.14 CC12CCC1CNC2 Amb26391628 [0,0,0,2,0,0|2,0,0]=4 15021 B9R2.14 CC12CCCC1CN2 Amb32658553 [0,0,0,2,0,0|1,0,1]=4 15022 B9R2.14 C[C@]12CC[C@H]1CCN2 Amb33734026 [0,0,0,2,0,0|1,0,1]=4 15023 B9R2.14 C[C@]12CC[C@H]1CCN2 Amb33742275 [0,0,0,2,0,0|1,0,1]=4 15024 B9R2.31 CC1C2CC(=O)C1C2 Amb28193471 [0,0,0,2,0,0|0,0,0]=2 15025 B9R2.31 C[C@@H]1[C@@H]2C[C@H](O)[C@H]1C2 Amb27190682 [0,0,0,2,0,0|0,0,2]=4 15026 B9R2.31 C[C@@H]1[C@H]2CC(=O)[C@@H]1C2 Amb28320366 [0,0,0,2,0,0|0,0,0]=2 15027 B9R2.31 NC1C2CC1C(=O)N2 Amb27481752 [0,0,0,2,0,0|2,0,0]=4 15028 B9R2.31 NC1[C@@H]2C[C@H]1NC2=O Amb28131384 [0,0,0,2,0,0|2,0,0]=4 15029 B9R2.31 O=C1C[C@@H]2C[C@H]1[C@@H]2Cl Amb28195039 [0,0,0,2,0,0|1,0,0]=3 15030 B9R2.33 ClC1CC2CCC2C1 Amb27974247 [0,0,0,2,0,0|1,0,1]=4 15031 B9R2.33 NC1CC2CCC2C1 Amb24696800 [0,0,0,2,0,0|1,0,1]=4 15032 B9R2.33 NN1CC2CCC2C1 Amb30028011 [0,0,0,2,0,0|2,0,0]=4 15033 B9R2.33 O=C1CC2C=CC2C1 Amb28059971 [0,0,0,2,0,0|0,0,2]=4 15034 B9R2.33 O=C1CC2CCC2C1 Amb28316189 [0,0,0,2,0,0|0,0,0]=2 15035 B9R2.33 O=C1CC2CCC2N1 Amb28398052 [0,0,0,2,0,0|1,0,0]=3 15036 B9R2.33 O=C1CC2CC[C@H]2C1 Amb28048983 [0,0,0,2,0,0|0,0,0]=2 15037 B9R2.33 O=C1C[C@@H]2CC[C@@H]2C1 Amb26937805 [0,0,0,2,0,0|0,0,0]=2 15038 B9R2.33 O=C1C[C@@H]2CC[C@@H]2N1 Amb27420727 [0,0,0,2,0,0|1,0,0]=3 15039 B9R2.33 O=C1NC2CCC2N1 Amb27804174 [0,0,0,2,0,0|2,0,0]=4 15040 B9R2.33 O=C1NC2CCC2O1 Amb26067754 [0,0,0,2,0,0|2,0,0]=4 15041 B9R2.33 OC1CC2CCC2C1 Amb28292645 [0,0,0,2,0,0|0,0,2]=4 15042 B9R2.33 OC1C[C@H]2CC[C@@H]2C1 Amb27208215 [0,0,0,2,0,0|0,0,2]=4 15043 B9R2.33 O[C@H]1C[C@@H]2CC[C@@H]2C1 Amb27836254 [0,0,0,2,0,0|0,0,2]=4 15044 B9R2.33 SC1CC2CCC2C1 Amb32788881 [0,0,0,2,0,0|0,1,1]=4 15045 B9R2.35 O=C1NC2C(O)CC12 Amb28368878 [0,0,0,2,0,0|2,0,0]=4 15046 B9R2.36 NC1CCC1C2CC2 Amb24553955 [0,0,0,2,0,0|1,0,1]=4 15047 B9R2.36 NC1CCC1C2CC2 Amb28934908 [0,0,0,2,0,0|1,0,1]=4 15048 B9R2.36 O=C1CCC1C2CC2 Amb25059391 [0,0,0,2,0,0|0,0,0]=2 15049 B9R2.36 OC1CCC1C2CC2 Amb24711940 [0,0,0,2,0,0|0,0,2]=4 15050 B9R2.28 NNCC1CC12CC2 Amb35612034 [0,0,0,2,0,0|2,0,0]=4 15051 B9R2.28 OCCC1CC12CC2 Amb22727912 [0,0,0,2,0,0|0,0,2]=4 15052 B9R2.75 O=CC1C2C(C=O)C12 Amb27818072 [0,0,0,2,0,0|1,0,1]=4 15053 B9R2.79 N#CC1CC1C2CC2 Amb35598339 [0,0,0,2,0,0|1,0,1]=4 15054 B9R2.79 NCC1CC1C2CC2 Amb18963619 [0,0,0,2,0,0|1,0,1]=4 15055 B9R2.79 NCC1CC1C2CC2 Amb20632198 [0,0,0,2,0,0|1,0,1]=4 15056 B9R2.79 NC[C@@H]1C[C@H]1C2CC2 Amb26894585 [0,0,0,2,0,0|1,0,1]=4 15057 B9R2.79 NC[C@@H]1C[C@H]1C2CC2 Amb32661471 [0,0,0,2,0,0|1,0,1]=4 15058 B9R2.79 O=CC1CC1C2CC2 Amb25982284 [0,0,0,2,0,0|0,0,0]=2 15059 B9R2.79 OCC1CC1C2CC2 Amb28124151 [0,0,0,2,0,0|0,0,2]=4 15060 B9R2.79 OC[C@@H]1C[C@H]1C2CC2 Amb32657995 [0,0,0,2,0,0|0,0,2]=4 15061 B9R2.69 C1CC1CCC2CO2 Amb27427391 [0,0,0,2,0,0|0,0,2]=4