0 B7R0.1 BrCCCCCC=C Amb16234121 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.1 BrCC\C=C\CCBr Amb17612549 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.1 C#CCCCCCCl Amb24586504 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.1 C#CCCCCCF Amb24538507 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.1 C#CCCCCCN Amb24481464 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.1 C#CCCNCCF Amb24709905 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.1 C#CCCNCCO Amb25244372 [0,0,0,0,0,0|1,0,2]=3 7 B7R0.1 C#CCCOCC=O Amb22896801 [0,0,0,0,0,0|0,0,4]=4 8 B7R0.1 C#CCCOCCBr Amb25232583 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.1 C#CCCOCCN Amb19020761 [0,0,0,0,0,0|1,0,2]=3 10 B7R0.1 C#CCCOCCO Amb24733286 [0,0,0,0,0,0|0,0,2]=2 11 B7R0.1 C#CCC\C=C\CO Amb25699014 [0,0,0,0,0,0|1,0,3]=4 12 B7R0.1 C#CCNCCCF Amb25347891 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.1 C#CCNCCCO Amb18315309 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.1 C#CCOCCC#C Amb21960123 [0,0,0,0,0,0|1,0,3]=4 15 B7R0.1 C#CCOCCCN Amb24511108 [0,0,0,0,0,0|2,0,1]=3 16 B7R0.1 C#CCONCCO Amb24597927 [0,0,0,0,0,0|2,0,2]=4 17 B7R0.1 C#CCSCCCF Amb24573845 [0,0,0,0,0,0|2,1,1]=4 18 B7R0.1 C#CC\C=C\CCO Amb24706248 [0,0,0,0,0,0|1,0,3]=4 19 B7R0.1 C=CCCC#CCO Amb24643779 [0,0,0,0,0,0|1,0,3]=4 20 B7R0.1 C=CCCCCCI Amb24483139 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.1 C=CCCCCCN Amb18641754 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.1 C=CCCNCCCl Amb24529620 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.1 C=CCCNCCF Amb25811610 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.1 C=CCCNCCN Amb25699590 [0,0,0,0,0,0|2,0,2]=4 25 B7R0.1 C=CCCOCCN Amb22059113 [0,0,0,0,0,0|1,0,2]=3 26 B7R0.1 C=CCNCCCBr Amb25811711 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.1 C=CCNCCCF Amb25830367 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.1 C=CCNCCCS Amb25792575 [0,0,0,0,0,0|3,0,1]=4 29 B7R0.1 C=CCOCCCF Amb22008259 [0,0,0,0,0,0|2,0,1]=3 30 B7R0.1 C=CCOCCCN Amb25190295 [0,0,0,0,0,0|2,0,1]=3 31 B7R0.1 C=CCOCCCO Amb25097051 [0,0,0,0,0,0|2,0,1]=3 32 B7R0.1 C=CCOCCCS Amb25809864 [0,0,0,0,0,0|2,0,1]=3 33 B7R0.1 C=CCOCCON Amb25200990 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.1 C=CCONCCF Amb24571239 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.1 C=CCONCCN Amb24620507 [0,0,0,0,0,0|3,0,1]=4 36 B7R0.1 C=CCSCCCF Amb24476606 [0,0,0,0,0,0|2,1,1]=4 37 B7R0.1 CC#CCC#CCO Amb24456905 [0,0,0,0,0,0|1,0,3]=4 38 B7R0.1 CC#CCCCCN Amb24529557 [0,0,0,0,0,0|2,0,2]=4 39 B7R0.1 CC#CCNCCC Amb24543429 [0,0,0,0,0,0|2,0,2]=4 40 B7R0.1 CC#CCOCCN Amb19020785 [0,0,0,0,0,0|1,0,2]=3 41 B7R0.1 CC#CCOCCO Amb25781636 [0,0,0,0,0,0|0,0,2]=2 42 B7R0.1 CC#CCSCCO Amb25244898 [0,0,0,0,0,0|0,1,2]=3 43 B7R0.1 CC=NCCCCN Amb25746482 [0,0,0,0,0,0|3,0,1]=4 44 B7R0.1 CCC#CC=CCO Amb17779113 [0,0,0,0,0,0|1,0,3]=4 45 B7R0.1 CCC#CCCCBr Amb24443559 [0,0,0,0,0,0|2,0,2]=4 46 B7R0.1 CCC#CCCCO Amb24730835 [0,0,0,0,0,0|1,0,2]=3 47 B7R0.1 CCC=NOCCBr Amb24365939 [0,0,0,0,0,0|2,0,1]=3 48 B7R0.1 CCCC#CCC=C Amb22227987 [0,0,0,0,0,0|2,0,2]=4 49 B7R0.1 CCCC#CCCCl Amb25124931 [0,0,0,0,0,0|2,0,1]=3 50 B7R0.1 CCCC=C=CCO Amb24748543 [0,0,0,0,0,0|1,0,2]=3 51 B7R0.1 CCCC=COCC Amb22227927 [0,0,0,0,0,0|3,0,1]=4 52 B7R0.1 CCCCC#CC#N Amb17593112 [0,0,0,0,0,0|2,0,2]=4 53 B7R0.1 CCCCC#CC=C Amb17673844 [0,0,0,0,0,0|2,0,2]=4 54 B7R0.1 CCCCC#CC=O Amb17593134 [0,0,0,0,0,0|1,0,3]=4 55 B7R0.1 CCCCC#CCBr Amb17670640 [0,0,0,0,0,0|2,0,1]=3 56 B7R0.1 CCCCC=C=CBr Amb24650210 [0,0,0,0,0,0|2,0,2]=4 57 B7R0.1 CCCCCC#CI Amb17940367 [0,0,0,0,0,0|2,0,2]=4 58 B7R0.1 CCCCCCC=N Amb24634610 [0,0,0,0,0,0|2,0,1]=3 59 B7R0.1 CCCCCCCF Amb10840026 [0,0,0,0,0,0|2,0,0]=2 60 B7R0.1 CCCCCCCP Amb25824639 [0,0,0,0,0,0|2,0,0]=2 61 B7R0.1 CCCCCCC[Mg+] Amb22351260 [0,0,0,0,0,0|2,0,0]=2 62 B7R0.1 CCCCCCC[Sn+3] Amb17620886 [0,0,0,0,0,0|2,0,0]=2 63 B7R0.1 CCCCCCC[Zn+] Amb22336241 [0,0,0,0,0,0|2,0,0]=2 64 B7R0.1 CCCCCCNO Amb24591654 [0,0,0,0,0,0|2,0,0]=2 65 B7R0.1 CCCCCCOC Amb2582536 [0,0,0,0,0,0|3,0,0]=3 66 B7R0.1 CCCCCCON Amb18641933 [0,0,0,0,0,0|3,0,0]=3 67 B7R0.1 CCCCCCSC Amb22359692 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.1 CCCCCC[14CH2]O Amb22350258 [0,0,0,0,0,0|1,0,0]=1 69 B7R0.1 CCCCCC[Hg]Cl Amb22359873 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.1 CCCCCC[Mg]Br Amb22337740 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [0,0,0,0,0,0|3,0,0]=3 72 B7R0.1 CCCCCC[N+]#[C-] Amb2235425 [0,0,0,0,0,0|3,0,0]=3 73 B7R0.1 CCCCCC[Zn]Br Amb22000389 [0,0,0,0,0,0|3,0,0]=3 74 B7R0.1 CCCCCN=[N+]=[N-] Amb17939435 [0,0,0,0,0,0|4,0,0]=4 75 B7R0.1 CCCCCNC=O Amb22360637 [0,0,0,0,0,0|2,0,2]=4 76 B7R0.1 CCCCCNOC Amb24566046 [0,0,0,0,0,0|4,0,0]=4 77 B7R0.1 CCCCCOCC Amb22733705 [0,0,0,0,0,0|3,0,0]=3 78 B7R0.1 CCCCCOCCl Amb24603055 [0,0,0,0,0,0|3,0,0]=3 79 B7R0.1 CCCCCON=O Amb17939401 [0,0,0,0,0,0|3,0,1]=4 80 B7R0.1 CCCCCSCC Amb22730787 [0,0,0,0,0,0|3,0,0]=3 81 B7R0.1 CCCCCSCO Amb24703606 [0,0,0,0,0,0|2,0,0]=2 82 B7R0.1 CCCCC\C=C\I Amb22641605 [0,0,0,0,0,0|2,0,2]=4 83 B7R0.1 CCCCNC=NC Amb24481322 [0,0,0,0,0,0|3,0,1]=4 84 B7R0.1 CCCCNCCBr Amb25092365 [0,0,0,0,0,0|2,0,0]=2 85 B7R0.1 CCCCNCCCl Amb17334144 [0,0,0,0,0,0|2,0,0]=2 86 B7R0.1 CCCCNCCI Amb25065614 [0,0,0,0,0,0|2,0,0]=2 87 B7R0.1 CCCCNCCS Amb22232390 [0,0,0,0,0,0|1,1,0]=2 88 B7R0.1 CCCCNCSC Amb24427497 [0,0,0,0,0,0|3,0,0]=3 89 B7R0.1 CCCCNOCC Amb25695162 [0,0,0,0,0,0|3,0,0]=3 90 B7R0.1 CCCCO/C=C/Cl Amb17689420 [0,0,0,0,0,0|1,0,2]=3 91 B7R0.1 CCCCOCCI Amb24474438 [0,0,0,0,0,0|1,0,0]=1 92 B7R0.1 CCCCOCCN Amb21959654 [0,0,0,0,0,0|1,0,0]=1 93 B7R0.1 CCCCSCCN Amb2182886 [0,0,0,0,0,0|1,1,0]=2 94 B7R0.1 CCCCSCCN Amb2209242 [0,0,0,0,0,0|1,1,0]=2 95 B7R0.1 CCCCSCCO Amb1032995 [0,0,0,0,0,0|0,1,0]=1 96 B7R0.1 CCCC\C=C/C=O Amb25278292 [0,0,0,0,0,0|1,0,3]=4 97 B7R0.1 CCCC\C=C\C#N Amb18641342 [0,0,0,0,0,0|2,0,2]=4 98 B7R0.1 CCCC\C=C\C=C Amb22729011 [0,0,0,0,0,0|2,0,2]=4 99 B7R0.1 CCCC\C=C\CBr Amb24507687 [0,0,0,0,0,0|2,0,1]=3 100 B7R0.1 CCCC\C=C\CCl Amb24483085 [0,0,0,0,0,0|2,0,1]=3 101 B7R0.1 CCCC\C=C\CN Amb25175053 [0,0,0,0,0,0|2,0,1]=3 102 B7R0.1 CCCC\C=C\OC Amb25810618 [0,0,0,0,0,0|3,0,1]=4 103 B7R0.1 CCCNCCC#C Amb18312420 [0,0,0,0,0,0|2,0,2]=4 104 B7R0.1 CCCNCCCI Amb25180012 [0,0,0,0,0,0|3,0,0]=3 105 B7R0.1 CCCNCCCN Amb22292470 [0,0,0,0,0,0|3,0,0]=3 106 B7R0.1 CCCNCCCO Amb22292465 [0,0,0,0,0,0|2,0,0]=2 107 B7R0.1 CCCNCCCS Amb24627837 [0,0,0,0,0,0|2,1,0]=3 108 B7R0.1 CCCNCCN=O Amb22231337 [0,0,0,0,0,0|3,0,1]=4 109 B7R0.1 CCCNNCCC Amb22641920 [0,0,0,0,0,0|3,0,0]=3 110 B7R0.1 CCCOCCC=C Amb25733577 [0,0,0,0,0,0|1,0,2]=3 111 B7R0.1 CCCOCCCO Amb19962968 [0,0,0,0,0,0|2,0,0]=2 112 B7R0.1 CCCOCCNN Amb25758309 [0,0,0,0,0,0|3,0,0]=3 113 B7R0.1 CCCOCCON Amb24456928 [0,0,0,0,0,0|3,0,0]=3 114 B7R0.1 CCCOCN=C=O Amb25286687 [0,0,0,0,0,0|3,0,1]=4 115 B7R0.1 CCCOC\C=C\Br Amb25075093 [0,0,0,0,0,0|2,0,2]=4 116 B7R0.1 CCCONCC#C Amb25685520 [0,0,0,0,0,0|2,0,2]=4 117 B7R0.1 CCCONCC#N Amb25031189 [0,0,0,0,0,0|3,0,1]=4 118 B7R0.1 CCCSCCCF Amb25741227 [0,0,0,0,0,0|2,1,0]=3 119 B7R0.1 CCCSCCOC Amb25058036 [0,0,0,0,0,0|2,1,0]=3 120 B7R0.1 CCCS\C=C\CO Amb25092280 [0,0,0,0,0,0|2,0,1]=3 121 B7R0.1 CCC\C=C/CC=O Amb24481514 [0,0,0,0,0,0|1,0,3]=4 122 B7R0.1 CCC\C=C/CCO Amb22052625 [0,0,0,0,0,0|1,0,1]=2 123 B7R0.1 CCC\C=C\CC#N Amb18124072 [0,0,0,0,0,0|2,0,2]=4 124 B7R0.1 CCC\C=C\CC=O Amb24356718 [0,0,0,0,0,0|1,0,3]=4 125 B7R0.1 CCC\C=C\CCBr Amb24423831 [0,0,0,0,0,0|2,0,1]=3 126 B7R0.1 CCC\C=C\CCC Amb16192905 [0,0,0,0,0,0|2,0,1]=3 127 B7R0.1 CCC\C=C\CCCl Amb25342979 [0,0,0,0,0,0|2,0,1]=3 128 B7R0.1 CCC\C=C\CCN Amb25221747 [0,0,0,0,0,0|2,0,1]=3 129 B7R0.1 CCC\C=C\CCO Amb22730273 [0,0,0,0,0,0|1,0,1]=2 130 B7R0.1 CCC\C=C\CNC Amb25849352 [0,0,0,0,0,0|3,0,1]=4 131 B7R0.1 CCC\C=C\COC Amb25839741 [0,0,0,0,0,0|3,0,1]=4 132 B7R0.1 CCC\C=C\OCC Amb25074036 [0,0,0,0,0,0|3,0,1]=4 133 B7R0.1 CCNCC#CCC Amb25131761 [0,0,0,0,0,0|3,0,1]=4 134 B7R0.1 CCNCC#CCO Amb25068490 [0,0,0,0,0,0|2,0,1]=3 135 B7R0.1 CCNCCCC#C Amb18311079 [0,0,0,0,0,0|3,0,1]=4 136 B7R0.1 CCNCCCC=O Amb24481334 [0,0,0,0,0,0|2,0,2]=4 137 B7R0.1 CCNCCCCBr Amb25250968 [0,0,0,0,0,0|3,0,0]=3 138 B7R0.1 CCNCCCCCl Amb25042682 [0,0,0,0,0,0|3,0,0]=3 139 B7R0.1 CCNCCCCF Amb25129606 [0,0,0,0,0,0|3,0,0]=3 140 B7R0.1 CCNCCCN=O Amb22274434 [0,0,0,0,0,0|3,0,1]=4 141 B7R0.1 CCNC\C=C\CO Amb24605921 [0,0,0,0,0,0|2,0,1]=3 142 B7R0.1 CCOC#CCCO Amb24644186 [0,0,0,0,0,0|2,0,1]=3 143 B7R0.1 CCOCC#CCBr Amb25765670 [0,0,0,0,0,0|3,0,1]=4 144 B7R0.1 CCOCC#CCC Amb24066446 [0,0,0,0,0,0|3,0,1]=4 145 B7R0.1 CCOCC#CCO Amb25851542 [0,0,0,0,0,0|2,0,1]=3 146 B7R0.1 CCOCCCC#C Amb25700120 [0,0,0,0,0,0|3,0,1]=4 147 B7R0.1 CCOCCCCCl Amb20242741 [0,0,0,0,0,0|3,0,0]=3 148 B7R0.1 CCOCCCCI Amb25097177 [0,0,0,0,0,0|3,0,0]=3 149 B7R0.1 CCOCCCCO Amb19148112 [0,0,0,0,0,0|2,0,0]=2 150 B7R0.1 CCOCCCCS Amb25129585 [0,0,0,0,0,0|2,1,0]=3 151 B7R0.1 CCOCCCON Amb18061683 [0,0,0,0,0,0|4,0,0]=4 152 B7R0.1 CCOCCCSC Amb25143651 [0,0,0,0,0,0|4,0,0]=4 153 B7R0.1 CCOCCOCCl Amb24410742 [0,0,0,0,0,0|4,0,0]=4 154 B7R0.1 CCOCOCCBr Amb24712601 [0,0,0,0,0,0|2,0,0]=2 155 B7R0.1 CCOCOCCCl Amb24409563 [0,0,0,0,0,0|2,0,0]=2 156 B7R0.1 CCOCOCCO Amb24675006 [0,0,0,0,0,0|1,0,0]=1 157 B7R0.1 CCOCSCCN Amb25043152 [0,0,0,0,0,0|2,1,0]=3 158 B7R0.1 CCOCSCCO Amb24526593 [0,0,0,0,0,0|1,1,0]=2 159 B7R0.1 CCOC\C=C\CCl Amb24665371 [0,0,0,0,0,0|3,0,1]=4 160 B7R0.1 CCOC\C=C\CN Amb24366343 [0,0,0,0,0,0|3,0,1]=4 161 B7R0.1 CCOC\C=C\CO Amb25221278 [0,0,0,0,0,0|2,0,1]=3 162 B7R0.1 CCONCCSC Amb25726212 [0,0,0,0,0,0|4,0,0]=4 163 B7R0.1 CCO[SiH2]CCCN Amb24580670 [0,0,0,0,0,0|3,1,0]=4 164 B7R0.1 CCPCCNCC Amb25185102 [0,0,0,0,0,0|4,0,0]=4 165 B7R0.1 CCSCC#CCCl Amb25746970 [0,0,0,0,0,0|3,0,1]=4 166 B7R0.1 CCSCCCCCl Amb18796695 [0,0,0,0,0,0|3,0,0]=3 167 B7R0.1 CCSCCCCF Amb25104763 [0,0,0,0,0,0|3,0,0]=3 168 B7R0.1 CCSCCCNC Amb25044529 [0,0,0,0,0,0|4,0,0]=4 169 B7R0.1 CCSCCCOC Amb24421462 [0,0,0,0,0,0|4,0,0]=4 170 B7R0.1 CCSCCOCC Amb25821568 [0,0,0,0,0,0|4,0,0]=4 171 B7R0.1 CCSCCOCCl Amb25697750 [0,0,0,0,0,0|4,0,0]=4 172 B7R0.1 CCSC\C=C\CCl Amb24695245 [0,0,0,0,0,0|3,0,1]=4 173 B7R0.1 CCSC\C=C\CN Amb25241426 [0,0,0,0,0,0|3,0,1]=4 174 B7R0.1 CCSC\C=C\CO Amb24734797 [0,0,0,0,0,0|2,0,1]=3 175 B7R0.1 CCSC\C=C\CS Amb25107944 [0,0,0,0,0,0|2,1,1]=4 176 B7R0.1 CC\C=C/CCCN Amb25809455 [0,0,0,0,0,0|2,0,2]=4 177 B7R0.1 CC\C=C/CCCO Amb22053865 [0,0,0,0,0,0|1,0,2]=3 178 B7R0.1 CC\C=C\C=C\CO Amb17614885 [0,0,0,0,0,0|1,0,3]=4 179 B7R0.1 CC\C=C\CCCC Amb19930202 [0,0,0,0,0,0|2,0,1]=3 180 B7R0.1 CC\C=C\CCCN Amb24576334 [0,0,0,0,0,0|2,0,2]=4 181 B7R0.1 CC\C=C\CCCO Amb25287379 [0,0,0,0,0,0|1,0,2]=3 182 B7R0.1 CC\C=C\CCNC Amb18641744 [0,0,0,0,0,0|3,0,1]=4 183 B7R0.1 CN=NCNCCC Amb25326841 [0,0,0,0,0,0|4,0,0]=4 184 B7R0.1 CNCCC#CCN Amb25229885 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.1 CNCCCCC#C Amb24438101 [0,0,0,0,0,0|3,0,1]=4 186 B7R0.1 CNCCCCC#N Amb18307043 [0,0,0,0,0,0|3,0,1]=4 187 B7R0.1 CNCCCCC=C Amb19886674 [0,0,0,0,0,0|3,0,1]=4 188 B7R0.1 CNCCCCC=C Amb22495849 [0,0,0,0,0,0|3,0,1]=4 189 B7R0.1 CNCCCCCBr Amb25681456 [0,0,0,0,0,0|3,0,0]=3 190 B7R0.1 CNCCCCCN Amb23448496 [0,0,0,0,0,0|3,0,0]=3 191 B7R0.1 CNCCCCNC Amb19374448 [0,0,0,0,0,0|4,0,0]=4 192 B7R0.1 CNCCCCOC Amb17569912 [0,0,0,0,0,0|4,0,0]=4 193 B7R0.1 CNCCNCC#C Amb18312399 [0,0,0,0,0,0|3,0,1]=4 194 B7R0.1 CNCCNCC=C Amb24582376 [0,0,0,0,0,0|3,0,1]=4 195 B7R0.1 CNCCNCCBr Amb24483284 [0,0,0,0,0,0|3,0,0]=3 196 B7R0.1 CNCCNCCN Amb18641939 [0,0,0,0,0,0|3,0,0]=3 197 B7R0.1 CNCCOCC#C Amb19020586 [0,0,0,0,0,0|2,0,1]=3 198 B7R0.1 CNCCOCC#C Amb20669278 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.1 CNCCOCC#N Amb19020587 [0,0,0,0,0,0|2,0,1]=3 200 B7R0.1 CNCCOCC=C Amb25764665 [0,0,0,0,0,0|2,0,1]=3 201 B7R0.1 CNCCOCCCl Amb25708208 [0,0,0,0,0,0|2,0,0]=2 202 B7R0.1 CNCCOCCO Amb24444485 [0,0,0,0,0,0|1,0,0]=1 203 B7R0.1 CNCCSCC#C Amb25071187 [0,0,0,0,0,0|2,1,1]=4 204 B7R0.1 CNCCSCOC Amb25304713 [0,0,0,0,0,0|3,1,0]=4 205 B7R0.1 COCCCCC#C Amb25191860 [0,0,0,0,0,0|3,0,1]=4 206 B7R0.1 COCCCCC#N Amb13951615 [0,0,0,0,0,0|3,0,1]=4 207 B7R0.1 COCCCCCBr Amb18182548 [0,0,0,0,0,0|3,0,0]=3 208 B7R0.1 COCCCCCO Amb19374978 [0,0,0,0,0,0|2,0,0]=2 209 B7R0.1 COCCCCCS Amb25138209 [0,0,0,0,0,0|2,1,0]=3 210 B7R0.1 COCCCCON Amb25357703 [0,0,0,0,0,0|4,0,0]=4 211 B7R0.1 COCCNCCCl Amb17334160 [0,0,0,0,0,0|3,0,0]=3 212 B7R0.1 COCCNCCF Amb25677392 [0,0,0,0,0,0|3,0,0]=3 213 B7R0.1 COCCNCCI Amb24407745 [0,0,0,0,0,0|3,0,0]=3 214 B7R0.1 COCCNCCN Amb17091020 [0,0,0,0,0,0|3,0,0]=3 215 B7R0.1 COCCOCC#C Amb24524633 [0,0,0,0,0,0|2,0,1]=3 216 B7R0.1 COCCOCC=C Amb21858464 [0,0,0,0,0,0|2,0,1]=3 217 B7R0.1 COCCOCCI Amb22497515 [0,0,0,0,0,0|2,0,0]=2 218 B7R0.1 COCCOCON Amb24421661 [0,0,0,0,0,0|3,0,0]=3 219 B7R0.1 COCCSCC=C Amb17799422 [0,0,0,0,0,0|2,1,1]=4 220 B7R0.1 COCCSCC=O Amb24464910 [0,0,0,0,0,0|1,1,2]=4 221 B7R0.1 COCCSCCS Amb24406761 [0,0,0,0,0,0|1,2,0]=3 222 B7R0.1 COCC\C=C\CCl Amb10844762 [0,0,0,0,0,0|3,0,1]=4 223 B7R0.1 COCC\C=C\CN Amb25746444 [0,0,0,0,0,0|3,0,1]=4 224 B7R0.1 COCC\C=C\CO Amb25084911 [0,0,0,0,0,0|2,0,1]=3 225 B7R0.1 COCOCCC#N Amb25318078 [0,0,0,0,0,0|3,0,1]=4 226 B7R0.1 COCOCCC=O Amb25804170 [0,0,0,0,0,0|3,0,1]=4 227 B7R0.1 COCOCCCO Amb23591016 [0,0,0,0,0,0|3,0,0]=3 228 B7R0.1 COCOCCNC Amb25369852 [0,0,0,0,0,0|3,0,0]=3 229 B7R0.1 COCSCCCN Amb24641251 [0,0,0,0,0,0|3,1,0]=4 230 B7R0.1 COCSCCCO Amb25209905 [0,0,0,0,0,0|3,0,0]=3 231 B7R0.1 COC\C=C\CCBr Amb25255929 [0,0,0,0,0,0|3,0,1]=4 232 B7R0.1 COC\C=C\CCCl Amb25173846 [0,0,0,0,0,0|3,0,1]=4 233 B7R0.1 COC\C=C\CCN Amb24483159 [0,0,0,0,0,0|3,0,1]=4 234 B7R0.1 CONCCCCO Amb24481428 [0,0,0,0,0,0|3,0,0]=3 235 B7R0.1 CSCCCCC=O Amb25760866 [0,0,0,0,0,0|2,0,2]=4 236 B7R0.1 CSCCCCCBr Amb25052398 [0,0,0,0,0,0|3,0,0]=3 237 B7R0.1 CSCCCCCCl Amb18179464 [0,0,0,0,0,0|3,0,0]=3 238 B7R0.1 CSCCCCCN Amb24271082 [0,0,0,0,0,0|3,0,0]=3 239 B7R0.1 CSCCCCCO Amb24271084 [0,0,0,0,0,0|2,0,0]=2 240 B7R0.1 CSCCCCCS Amb24633807 [0,0,0,0,0,0|2,1,0]=3 241 B7R0.1 CSCCCCNO Amb25763086 [0,0,0,0,0,0|3,0,0]=3 242 B7R0.1 CSCCCOCCl Amb24725065 [0,0,0,0,0,0|4,0,0]=4 243 B7R0.1 CSCCCSCC Amb24721149 [0,0,0,0,0,0|4,0,0]=4 244 B7R0.1 CSCCCSCCl Amb24504417 [0,0,0,0,0,0|4,0,0]=4 245 B7R0.1 CSCCNCC#C Amb19024607 [0,0,0,0,0,0|3,0,1]=4 246 B7R0.1 CSCCNCC=C Amb25360313 [0,0,0,0,0,0|3,0,1]=4 247 B7R0.1 CSCCNCCF Amb24332620 [0,0,0,0,0,0|3,0,0]=3 248 B7R0.1 CSCCNCCN Amb25726571 [0,0,0,0,0,0|3,0,0]=3 249 B7R0.1 CSCCNCCO Amb24529583 [0,0,0,0,0,0|2,0,0]=2 250 B7R0.1 CSCCOCC=O Amb24692371 [0,0,0,0,0,0|1,0,2]=3 251 B7R0.1 CSCCOCCCl Amb24471259 [0,0,0,0,0,0|2,0,0]=2 252 B7R0.1 CSCCOCCN Amb17501991 [0,0,0,0,0,0|2,0,0]=2 253 B7R0.1 CSCCSCC#C Amb24504391 [0,0,0,0,0,0|2,1,1]=4 254 B7R0.1 CSCCSCC#N Amb24694362 [0,0,0,0,0,0|2,1,1]=4 255 B7R0.1 CSCCSCC=O Amb24504422 [0,0,0,0,0,0|1,1,2]=4 256 B7R0.1 CSCCSCCBr Amb24504429 [0,0,0,0,0,0|2,1,0]=3 257 B7R0.1 CSCCSCCCl Amb25821438 [0,0,0,0,0,0|2,1,0]=3 258 B7R0.1 CSCCSCCO Amb25031503 [0,0,0,0,0,0|1,1,0]=2 259 B7R0.1 CSCOCCC#N Amb24059354 [0,0,0,0,0,0|3,0,1]=4 260 B7R0.1 CSCOCCCO Amb25187331 [0,0,0,0,0,0|3,0,0]=3 261 B7R0.1 CSCSCCCC Amb24661862 [0,0,0,0,0,0|2,1,0]=3 262 B7R0.1 CSCSCCOC Amb25768891 [0,0,0,0,0,0|3,1,0]=4 263 B7R0.1 CSSCCCCC Amb25679654 [0,0,0,0,0,0|4,0,0]=4 264 B7R0.1 CS\C=C\CCCO Amb25796405 [0,0,0,0,0,0|2,0,2]=4 265 B7R0.1 C\C=C\CC#CCO Amb25144342 [0,0,0,0,0,0|1,0,3]=4 266 B7R0.1 C\C=C\CCCCBr Amb25053891 [0,0,0,0,0,0|2,0,2]=4 267 B7R0.1 C\C=C\CCCCO Amb24634714 [0,0,0,0,0,0|1,0,2]=3 268 B7R0.1 C\C=C\CCCNO Amb25252150 [0,0,0,0,0,0|2,0,2]=4 269 B7R0.1 C\C=C\CNCCBr Amb25257774 [0,0,0,0,0,0|2,0,2]=4 270 B7R0.1 C\C=C\CNCCF Amb24353820 [0,0,0,0,0,0|2,0,2]=4 271 B7R0.1 C\C=C\CNCCO Amb23592253 [0,0,0,0,0,0|1,0,2]=3 272 B7R0.1 C\C=C\COCC#N Amb25337116 [0,0,0,0,0,0|1,0,3]=4 273 B7R0.1 C\C=C\COCC=O Amb24579425 [0,0,0,0,0,0|0,0,4]=4 274 B7R0.1 C\C=C\COCCN Amb18523861 [0,0,0,0,0,0|1,0,2]=3 275 B7R0.1 C\C=C\COCCO Amb24593801 [0,0,0,0,0,0|0,0,2]=2 276 B7R0.1 C\C=C\CSCCCl Amb24469908 [0,0,0,0,0,0|1,1,2]=4 277 B7R0.1 C\C=C\NCCCC Amb25259223 [0,0,0,0,0,0|2,0,2]=4 278 B7R0.1 ClCC#CCCCCl Amb24377479 [0,0,0,0,0,0|3,0,1]=4 279 B7R0.1 ClCCCC#CCBr Amb24712181 [0,0,0,0,0,0|3,0,1]=4 280 B7R0.1 ClCCCCCC=O Amb16185781 [0,0,0,0,0,0|2,0,2]=4 281 B7R0.1 ClCCCCCCBr Amb10602445 [0,0,0,0,0,0|3,0,0]=3 282 B7R0.1 ClCCCCCCI Amb20670134 [0,0,0,0,0,0|3,0,0]=3 283 B7R0.1 ClCCCCC[Zn]Br Amb22000392 [0,0,0,0,0,0|4,0,0]=4 284 B7R0.1 ClCCC\C=C\CBr Amb25209980 [0,0,0,0,0,0|3,0,1]=4 285 B7R0.1 ClCCNCCCCl Amb13952668 [0,0,0,0,0,0|3,0,0]=3 286 B7R0.1 ClCCNCCCCl Amb18125911 [0,0,0,0,0,0|3,0,0]=3 287 B7R0.1 ClCCOCCCCl Amb24524257 [0,0,0,0,0,0|2,0,0]=2 288 B7R0.1 ClCCSCCCCl Amb24426165 [0,0,0,0,0,0|2,1,0]=3 289 B7R0.1 ClCC\C=C\CCCl Amb24481434 [0,0,0,0,0,0|3,0,1]=4 290 B7R0.1 FCCCCCC#N Amb17593193 [0,0,0,0,0,0|3,0,1]=4 291 B7R0.1 FCCCCCCBr Amb24063182 [0,0,0,0,0,0|3,0,0]=3 292 B7R0.1 FCCCCCCI Amb25080138 [0,0,0,0,0,0|3,0,0]=3 293 B7R0.1 FCCCCCCS Amb24569228 [0,0,0,0,0,0|2,1,0]=3 294 B7R0.1 FCCCNCCBr Amb25051664 [0,0,0,0,0,0|3,0,0]=3 295 B7R0.1 FCCCNCCI Amb25358108 [0,0,0,0,0,0|3,0,0]=3 296 B7R0.1 FCCCOCCCl Amb22008153 [0,0,0,0,0,0|2,0,0]=2 297 B7R0.1 FCCNCCCBr Amb24637481 [0,0,0,0,0,0|3,0,0]=3 298 B7R0.1 FCCNCCCF Amb25235767 [0,0,0,0,0,0|3,0,0]=3 299 B7R0.1 N#CCCCCCCl Amb21936053 [0,0,0,0,0,0|3,0,1]=4 300 B7R0.1 N#CCCNCCBr Amb24483249 [0,0,0,0,0,0|3,0,1]=4 301 B7R0.1 N#CCCNCCCl Amb25791536 [0,0,0,0,0,0|3,0,1]=4 302 B7R0.1 N#CCCNCCO Amb24273088 [0,0,0,0,0,0|2,0,1]=3 303 B7R0.1 N#CCCOCCCl Amb22170576 [0,0,0,0,0,0|2,0,1]=3 304 B7R0.1 N#CCCOCCS Amb24735930 [0,0,0,0,0,0|1,1,1]=3 305 B7R0.1 N#CCNCCCCl Amb18124374 [0,0,0,0,0,0|3,0,1]=4 306 B7R0.1 N#CCOCCCO Amb24720648 [0,0,0,0,0,0|2,0,1]=3 307 B7R0.1 N#CCSCCCCl Amb20623081 [0,0,0,0,0,0|2,1,1]=4 308 B7R0.1 N#CCSCCCF Amb24615020 [0,0,0,0,0,0|2,1,1]=4 309 B7R0.1 N#CC\C=C\CCO Amb25333754 [0,0,0,0,0,0|2,0,2]=4 310 B7R0.1 NCC#CCCCCl Amb24435711 [0,0,0,0,0,0|3,0,1]=4 311 B7R0.1 NCCC#CCCN Amb25791203 [0,0,0,0,0,0|3,0,1]=4 312 B7R0.1 NCCCCCC=O Amb25680164 [0,0,0,0,0,0|2,0,2]=4 313 B7R0.1 NCCCCCCBr Amb17610010 [0,0,0,0,0,0|3,0,0]=3 314 B7R0.1 NCCCCCCBr Amb18648322 [0,0,0,0,0,0|3,0,0]=3 315 B7R0.1 NCCCCCCBr Amb22831848 [0,0,0,0,0,0|3,0,0]=3 316 B7R0.1 NCCCCCCCl Amb22831847 [0,0,0,0,0,0|3,0,0]=3 317 B7R0.1 NCCCCCCI Amb25088255 [0,0,0,0,0,0|3,0,0]=3 318 B7R0.1 NCCCCCCN Amb22347970 [0,0,0,0,0,0|3,0,0]=3 319 B7R0.1 NCCCCCCN Amb2553272 [0,0,0,0,0,0|3,0,0]=3 320 B7R0.1 NCCCCCCN Amb2573303 [0,0,0,0,0,0|3,0,0]=3 321 B7R0.1 NCCCCCCS Amb18642745 [0,0,0,0,0,0|2,1,0]=3 322 B7R0.1 NCCCCCCS Amb24099361 [0,0,0,0,0,0|2,1,0]=3 323 B7R0.1 NCCCCCNO Amb24381036 [0,0,0,0,0,0|3,0,0]=3 324 B7R0.1 NCCCCCOC Amb13951647 [0,0,0,0,0,0|3,0,0]=3 325 B7R0.1 NCCCCNCC Amb17334065 [0,0,0,0,0,0|3,0,0]=3 326 B7R0.1 NCCCNCC=C Amb17315274 [0,0,0,0,0,0|3,0,1]=4 327 B7R0.1 NCCCNCCCl Amb24657249 [0,0,0,0,0,0|3,0,0]=3 328 B7R0.1 NCCCNCCS Amb17607860 [0,0,0,0,0,0|2,1,0]=3 329 B7R0.1 NCCCOCC#N Amb18523831 [0,0,0,0,0,0|2,0,1]=3 330 B7R0.1 NCCCOCCBr Amb25071799 [0,0,0,0,0,0|2,0,0]=2 331 B7R0.1 NCCCSCC#C Amb17500721 [0,0,0,0,0,0|2,1,1]=4 332 B7R0.1 NCCCSCC#N Amb17500697 [0,0,0,0,0,0|2,1,1]=4 333 B7R0.1 NCCCSCC=C Amb17500693 [0,0,0,0,0,0|2,1,1]=4 334 B7R0.1 NCCCSCCF Amb25321747 [0,0,0,0,0,0|2,1,0]=3 335 B7R0.1 NCCC\C=C\CO Amb24117506 [0,0,0,0,0,0|2,0,1]=3 336 B7R0.1 NCCNCCCO Amb22732348 [0,0,0,0,0,0|3,0,0]=3 337 B7R0.1 NCCNOCCO Amb25791459 [0,0,0,0,0,0|2,0,0]=2 338 B7R0.1 NCCOCCCF Amb25286984 [0,0,0,0,0,0|2,0,0]=2 339 B7R0.1 NCCOCCCN Amb24382364 [0,0,0,0,0,0|2,0,0]=2 340 B7R0.1 NCCOC\C=C\Cl Amb19020762 [0,0,0,0,0,0|2,0,2]=4 341 B7R0.1 NCCSCCC#N Amb25757903 [0,0,0,0,0,0|2,1,1]=4 342 B7R0.1 NCCSSCCN Amb22347974 [0,0,0,0,0,0|3,1,0]=4 343 B7R0.1 NCCSSCCN Amb22492440 [0,0,0,0,0,0|3,1,0]=4 344 B7R0.1 NCC[Se][Se]CCN Amb22352364 [0,0,0,0,0,0|3,1,0]=4 345 B7R0.1 NCC\C=C\CCN Amb25075316 [0,0,0,0,0,0|3,0,1]=4 346 B7R0.1 NNCCCCCO Amb24660104 [0,0,0,0,0,0|3,0,0]=3 347 B7R0.1 NNCCNCCO Amb18124269 [0,0,0,0,0,0|3,0,0]=3 348 B7R0.1 NOCCCCCF Amb24501720 [0,0,0,0,0,0|4,0,0]=4 349 B7R0.1 NOCCOCCN Amb25319793 [0,0,0,0,0,0|3,0,0]=3 350 B7R0.1 N[13CH2]CCCC[13CH2]N Amb22336714 [0,0,0,0,0,0|3,0,0]=3 351 B7R0.1 O=CCCCCCBr Amb18127461 [0,0,0,0,0,0|2,0,2]=4 352 B7R0.1 O=CCCCCCF Amb24533888 [0,0,0,0,0,0|2,0,2]=4 353 B7R0.1 O=CCCOCCBr Amb24693863 [0,0,0,0,0,0|2,0,1]=3 354 B7R0.1 O=CCCOCCCl Amb24472908 [0,0,0,0,0,0|2,0,1]=3 355 B7R0.1 OC#CCCCCO Amb24431789 [0,0,0,0,0,0|2,0,2]=4 356 B7R0.1 OCC#CCCCBr Amb24590233 [0,0,0,0,0,0|2,0,1]=3 357 B7R0.1 OCC#CCCCCl Amb25220285 [0,0,0,0,0,0|2,0,1]=3 358 B7R0.1 OCC#CCCCO Amb22365275 [0,0,0,0,0,0|2,0,1]=3 359 B7R0.1 OCCC#C\C=C\C Amb15695309 [0,0,0,0,0,0|1,0,3]=4 360 B7R0.1 OCCCCC#CBr Amb24333774 [0,0,0,0,0,0|2,0,2]=4 361 B7R0.1 OCCCCC#CC Amb17593158 [0,0,0,0,0,0|1,0,2]=3 362 B7R0.1 OCCCCC=C=C Amb17593159 [0,0,0,0,0,0|1,0,3]=4 363 B7R0.1 OCCCCC=NO Amb22229987 [0,0,0,0,0,0|3,0,1]=4 364 B7R0.1 OCCCCCC#C Amb10603074 [0,0,0,0,0,0|1,0,2]=3 365 B7R0.1 OCCCCCC=O Amb18641885 [0,0,0,0,0,0|2,0,1]=3 366 B7R0.1 OCCCCCCBr Amb24063183 [0,0,0,0,0,0|2,0,0]=2 367 B7R0.1 OCCCCCCCl Amb24063192 [0,0,0,0,0,0|2,0,0]=2 368 B7R0.1 OCCCCCCF Amb24428671 [0,0,0,0,0,0|2,0,0]=2 369 B7R0.1 OCCCCCCO Amb22336515 [0,0,0,0,0,0|2,0,0]=2 370 B7R0.1 OCCCCCCO Amb22338595 [0,0,0,0,0,0|2,0,0]=2 371 B7R0.1 OCCCCCCO Amb22338770 [0,0,0,0,0,0|2,0,0]=2 372 B7R0.1 OCCCCCNC Amb17334069 [0,0,0,0,0,0|2,0,0]=2 373 B7R0.1 OCCCCN=C=S Amb24466258 [0,0,0,0,0,0|3,0,1]=4 374 B7R0.1 OCCCCOC=O Amb25244169 [0,0,0,0,0,0|3,0,1]=4 375 B7R0.1 OCCCCOCO Amb25043698 [0,0,0,0,0,0|3,0,0]=3 376 B7R0.1 OCCCC\C=C\Cl Amb25725026 [0,0,0,0,0,0|2,0,2]=4 377 B7R0.1 OCCCC\C=N\O Amb22336271 [0,0,0,0,0,0|3,0,1]=4 378 B7R0.1 OCCCNCC=C Amb17308751 [0,0,0,0,0,0|2,0,2]=4 379 B7R0.1 OCCCNCCCl Amb22054691 [0,0,0,0,0,0|3,0,0]=3 380 B7R0.1 OCCCNCCF Amb25746807 [0,0,0,0,0,0|3,0,0]=3 381 B7R0.1 OCCCSCC#C Amb17502862 [0,0,0,0,0,0|2,0,2]=4 382 B7R0.1 OCCCSCC#N Amb17502840 [0,0,0,0,0,0|2,1,1]=4 383 B7R0.1 OCCCSCC=C Amb17502836 [0,0,0,0,0,0|2,0,2]=4 384 B7R0.1 OCCCSCCF Amb25073692 [0,0,0,0,0,0|2,1,0]=3 385 B7R0.1 OCCC\C=C\CCl Amb24617361 [0,0,0,0,0,0|2,0,2]=4 386 B7R0.1 OCCN=NCCO Amb24675145 [0,0,0,0,0,0|3,0,0]=3 387 B7R0.1 OCCNCCCBr Amb25258348 [0,0,0,0,0,0|2,0,0]=2 388 B7R0.1 OCCNCCCF Amb24483086 [0,0,0,0,0,0|2,0,0]=2 389 B7R0.1 OCCNC\C=C\Cl Amb25241064 [0,0,0,0,0,0|2,0,2]=4 390 B7R0.1 OCCNNCCO Amb22002327 [0,0,0,0,0,0|3,0,0]=3 391 B7R0.1 OCCOCCC=O Amb18641946 [0,0,0,0,0,0|1,0,1]=2 392 B7R0.1 OCCOCCCF Amb22008105 [0,0,0,0,0,0|1,0,0]=1 393 B7R0.1 OCCSCCC=O Amb25077144 [0,0,0,0,0,0|1,1,1]=3 394 B7R0.1 OCCSCCCCl Amb24586100 [0,0,0,0,0,0|1,1,0]=2 395 B7R0.1 OCCSCCCF Amb25830346 [0,0,0,0,0,0|1,1,0]=2 396 B7R0.1 OCC\C=C\CCBr Amb24651958 [0,0,0,0,0,0|2,0,1]=3 397 B7R0.1 OCC\C=C\CCCl Amb25302330 [0,0,0,0,0,0|2,0,1]=3 398 B7R0.1 OCC\C=C\CCO Amb17614949 [0,0,0,0,0,0|2,0,1]=3 399 B7R0.1 OCC\C=C\CCS Amb24719765 [0,0,0,0,0,0|2,0,1]=3 400 B7R0.1 OCOCCOCO Amb24609373 [0,0,0,0,0,0|4,0,0]=4 401 B7R0.1 OC\C=C/CCC=O Amb25827491 [0,0,0,0,0,0|2,0,2]=4 402 B7R0.1 OC\C=C\CCCCl Amb25174931 [0,0,0,0,0,0|2,0,1]=3 403 B7R0.1 [15NH2]CCCCCC[15NH2] Amb22353416 [0,0,0,0,0,0|3,0,0]=3 404 B7R0.1 [C-]#[N+]CCCCCO Amb24354421 [0,0,0,0,0,0|2,0,1]=3 405 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [0,0,0,0,0,0|2,0,1]=3 406 B7R0.1 [N-]=[N+]=NCCCCO Amb20623556 [0,0,0,0,0,0|4,0,0]=4 407 B6R0.6 BrCCCCC#C Amb17673315 [1,0,0,0,0,0|1,0,2]=4 408 B6R0.6 BrCCNCCBr Amb19869481 [1,0,0,0,0,0|3,0,0]=4 409 B6R0.6 BrCCNCCBr Amb19958024 [1,0,0,0,0,0|3,0,0]=4 410 B6R0.6 BrCCOCC[*] Amb24270968 [1,0,0,0,0,0|2,0,0]=3 411 B6R0.6 BrCC[NH2+]CCBr Amb22166796 [1,0,0,0,0,0|3,0,0]=4 412 B6R0.6 BrCC[NH2+]CCBr Amb22387810 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.6 BrCC\C=C\CC Amb17570067 [1,0,0,0,0,0|1,0,2]=4 414 B6R0.6 C#CCCCCI Amb22752649 [1,0,0,0,0,0|1,0,2]=4 415 B6R0.6 C#CCCCCN Amb20668925 [1,0,0,0,0,0|1,0,2]=4 416 B6R0.6 C#CCCCCN Amb22059283 [1,0,0,0,0,0|1,0,2]=4 417 B6R0.6 C#CCCCCS Amb24120444 [1,0,0,0,0,0|0,1,2]=4 418 B6R0.6 C#CCCOCCl Amb24530262 [1,0,0,0,0,0|1,0,2]=4 419 B6R0.6 C#CCNCCO Amb19148766 [1,0,0,0,0,0|1,0,2]=4 420 B6R0.6 C#CCOCCN Amb18976416 [1,0,0,0,0,0|1,0,2]=4 421 B6R0.6 C=C=COCCO Amb25721997 [1,0,0,0,0,0|0,0,3]=4 422 B6R0.6 C=CCCCCF Amb24409527 [1,0,0,0,0,0|1,0,2]=4 423 B6R0.6 C=CCCCCN Amb18639514 [1,0,0,0,0,0|1,0,2]=4 424 B6R0.6 C=CCCCCN Amb22899138 [1,0,0,0,0,0|1,0,2]=4 425 B6R0.6 C=CCCOCO Amb22338634 [1,0,0,0,0,0|0,0,2]=3 426 B6R0.6 C=CCOCCI Amb24739964 [1,0,0,0,0,0|1,0,2]=4 427 B6R0.6 C=CCOCCN Amb19033754 [1,0,0,0,0,0|1,0,2]=4 428 B6R0.6 C=CCOCCS Amb24333486 [1,0,0,0,0,0|0,1,2]=4 429 B6R0.6 C=COCCCBr Amb25811206 [1,0,0,0,0,0|1,0,2]=4 430 B6R0.6 C=COCCCF Amb22008255 [1,0,0,0,0,0|1,0,2]=4 431 B6R0.6 C=CSCCCO Amb25026486 [1,0,0,0,0,0|1,0,2]=4 432 B6R0.6 CC#CCCCBr Amb18791571 [1,0,0,0,0,0|1,0,2]=4 433 B6R0.6 CC#CCCCI Amb24648366 [1,0,0,0,0,0|1,0,2]=4 434 B6R0.6 CC#CCCCN Amb18993494 [1,0,0,0,0,0|1,0,2]=4 435 B6R0.6 CC#CCCCO Amb20242139 [1,0,0,0,0,0|0,0,2]=3 436 B6R0.6 CC#CCCNC Amb18299523 [1,0,0,0,0,0|2,0,1]=4 437 B6R0.6 CC#CCCOC Amb25286924 [1,0,0,0,0,0|2,0,1]=4 438 B6R0.6 CC#CCNCC Amb18296250 [1,0,0,0,0,0|1,0,2]=4 439 B6R0.6 CC#CCOCC Amb24332856 [1,0,0,0,0,0|0,0,2]=3 440 B6R0.6 CC#CCOCCl Amb24479643 [1,0,0,0,0,0|1,0,2]=4 441 B6R0.6 CC#CCSCC Amb25343689 [1,0,0,0,0,0|0,1,2]=4 442 B6R0.6 CCC#CCCBr Amb24712364 [1,0,0,0,0,0|1,0,2]=4 443 B6R0.6 CCC#CCCCl Amb25147478 [1,0,0,0,0,0|1,0,2]=4 444 B6R0.6 CCC#CCCI Amb24636544 [1,0,0,0,0,0|1,0,2]=4 445 B6R0.6 CCCC#CCBr Amb25061301 [1,0,0,0,0,0|1,0,2]=4 446 B6R0.6 CCCC#CCCl Amb25722319 [1,0,0,0,0,0|1,0,2]=4 447 B6R0.6 CCCC#CCI Amb25346993 [1,0,0,0,0,0|1,0,2]=4 448 B6R0.6 CCCC#CCN Amb17593063 [1,0,0,0,0,0|1,0,2]=4 449 B6R0.6 CCCC/C=C/Br Amb17940862 [1,0,0,0,0,0|1,0,2]=4 450 B6R0.6 CCCC=NOC Amb24507605 [1,0,0,0,0,0|2,0,1]=4 451 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|2,0,0]=3 452 B6R0.6 CCCCC=C=C Amb17670592 [1,0,0,0,0,0|1,0,2]=4 453 B6R0.6 CCCCC=NN Amb25344632 [1,0,0,0,0,0|2,0,1]=4 454 B6R0.6 CCCCCC[13CH3] Amb22337896 [1,0,0,0,0,0|1,0,0]=2 455 B6R0.6 CCCCCC[15NH2] Amb22336214 [1,0,0,0,0,0|1,0,0]=2 456 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|1,0,0]=2 457 B6R0.6 CCCCCNN Amb22231340 [1,0,0,0,0,0|2,0,0]=3 458 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|1,0,0]=2 459 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|2,0,0]=3 460 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|2,0,0]=3 461 B6R0.6 CCCCC[Mg]Br Amb17938645 [1,0,0,0,0,0|2,0,0]=3 462 B6R0.6 CCCCC[Mg]Cl Amb22369733 [1,0,0,0,0,0|2,0,0]=3 463 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,0,0,0,0,0|3,0,0]=4 464 B6R0.6 CCCCNC#N Amb24479826 [1,0,0,0,0,0|2,0,1]=4 465 B6R0.6 CCCCNC=C Amb25822786 [1,0,0,0,0,0|1,0,2]=4 466 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|2,0,0]=3 467 B6R0.6 CCCCOC#C Amb24453550 [1,0,0,0,0,0|0,0,2]=3 468 B6R0.6 CCCCOCCl Amb22168152 [1,0,0,0,0,0|1,0,0]=2 469 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|0,0,0]=1 470 B6R0.6 CCCCOP=O Amb24354901 [1,0,0,0,0,0|1,0,1]=3 471 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|1,1,0]=3 472 B6R0.6 CCCC[SiH2]CBr Amb25101548 [1,0,0,0,0,0|1,1,0]=3 473 B6R0.6 CCCC\C=C\Cl Amb25306532 [1,0,0,0,0,0|1,0,2]=4 474 B6R0.6 CCCC\C=C\I Amb25173925 [1,0,0,0,0,0|1,0,2]=4 475 B6R0.6 CCCNCC#C Amb10610181 [1,0,0,0,0,0|2,0,1]=4 476 B6R0.6 CCCNCC=C Amb22587187 [1,0,0,0,0,0|2,0,1]=4 477 B6R0.6 CCCNCCBr Amb24360522 [1,0,0,0,0,0|2,0,0]=3 478 B6R0.6 CCCNCCC Amb22350702 [1,0,0,0,0,0|2,0,0]=3 479 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,0]=3 480 B6R0.6 CCCNCCF Amb24567579 [1,0,0,0,0,0|2,0,0]=3 481 B6R0.6 CCCNCCI Amb25315312 [1,0,0,0,0,0|2,0,0]=3 482 B6R0.6 CCCNCCN Amb22353438 [1,0,0,0,0,0|2,0,0]=3 483 B6R0.6 CCCNCCS Amb18640722 [1,0,0,0,0,0|1,1,0]=3 484 B6R0.6 CCCNCSC Amb25305097 [1,0,0,0,0,0|3,0,0]=4 485 B6R0.6 CCCNNCC Amb24057118 [1,0,0,0,0,0|2,0,0]=3 486 B6R0.6 CCCOCC=O Amb24421025 [1,0,0,0,0,0|0,0,2]=3 487 B6R0.6 CCCOCNN Amb25856438 [1,0,0,0,0,0|2,0,0]=3 488 B6R0.6 CCCONC=O Amb24374223 [1,0,0,0,0,0|1,0,2]=4 489 B6R0.6 CCCSCC#C Amb25196546 [1,0,0,0,0,0|1,1,1]=4 490 B6R0.6 CCCSCC=O Amb24479810 [1,0,0,0,0,0|0,1,2]=4 491 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|1,1,0]=3 492 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|1,1,0]=3 493 B6R0.6 CCC[Hg]CCC Amb22732575 [1,0,0,0,0,0|2,0,0]=3 494 B6R0.6 CCC[Sn+2]CCC Amb22728829 [1,0,0,0,0,0|2,0,0]=3 495 B6R0.6 CCC\C=C/CC Amb22734071 [1,0,0,0,0,0|1,0,1]=3 496 B6R0.6 CCC\C=C\CBr Amb25293717 [1,0,0,0,0,0|1,0,2]=4 497 B6R0.6 CCC\C=C\CC Amb19930065 [1,0,0,0,0,0|1,0,1]=3 498 B6R0.6 CCC\C=C\CI Amb24558601 [1,0,0,0,0,0|1,0,2]=4 499 B6R0.6 CCC\C=C\CN Amb18639526 [1,0,0,0,0,0|1,0,2]=4 500 B6R0.6 CCNCCC#C Amb18299437 [1,0,0,0,0,0|1,0,2]=4 501 B6R0.6 CCNCCC=C Amb19025187 [1,0,0,0,0,0|1,0,2]=4 502 B6R0.6 CCNCCC=O Amb25712349 [1,0,0,0,0,0|1,0,2]=4 503 B6R0.6 CCNCCCI Amb25342283 [1,0,0,0,0,0|2,0,0]=3 504 B6R0.6 CCNCCCS Amb18122695 [1,0,0,0,0,0|1,1,0]=3 505 B6R0.6 CCNCCNN Amb24479853 [1,0,0,0,0,0|3,0,0]=4 506 B6R0.6 CCNCCOC Amb22284536 [1,0,0,0,0,0|2,0,0]=3 507 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|2,0,0]=3 508 B6R0.6 CCNNCCO Amb25261700 [1,0,0,0,0,0|2,0,0]=3 509 B6R0.6 CCNOCC#C Amb25686275 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.6 CCNOCC=C Amb24543090 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.6 CCNOCCC Amb24423538 [1,0,0,0,0,0|2,0,0]=3 512 B6R0.6 CCNSCCO Amb25744782 [1,0,0,0,0,0|1,1,0]=3 513 B6R0.6 CCN\C=N\CC Amb10559547 [1,0,0,0,0,0|2,0,1]=4 514 B6R0.6 CCN\N=N\CC Amb25745032 [1,0,0,0,0,0|3,0,0]=4 515 B6R0.6 CCO/C=C/CC Amb17674081 [1,0,0,0,0,0|0,0,2]=3 516 B6R0.6 CCOCCC=C Amb25210333 [1,0,0,0,0,0|0,0,2]=3 517 B6R0.6 CCOCCC=O Amb25688261 [1,0,0,0,0,0|1,0,1]=3 518 B6R0.6 CCOCCCS Amb24479268 [1,0,0,0,0,0|1,0,0]=2 519 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|1,0,0]=2 520 B6R0.6 CCOCCNN Amb22587352 [1,0,0,0,0,0|2,0,0]=3 521 B6R0.6 CCOCCON Amb18061689 [1,0,0,0,0,0|2,0,0]=3 522 B6R0.6 CCOCCSC Amb24396764 [1,0,0,0,0,0|1,0,0]=2 523 B6R0.6 CCOCC[Hg]Cl Amb22359817 [1,0,0,0,0,0|2,0,0]=3 524 B6R0.6 CCOC\C=C\Cl Amb24676600 [1,0,0,0,0,0|1,0,2]=4 525 B6R0.6 CCONCC#C Amb25267027 [1,0,0,0,0,0|1,0,2]=4 526 B6R0.6 CCONCC#N Amb24751527 [1,0,0,0,0,0|2,0,1]=4 527 B6R0.6 CCONCCC Amb24416002 [1,0,0,0,0,0|1,0,0]=2 528 B6R0.6 CCONCCF Amb24333737 [1,0,0,0,0,0|2,0,0]=3 529 B6R0.6 CCONCCN Amb24431426 [1,0,0,0,0,0|2,0,0]=3 530 B6R0.6 CCONCCO Amb25107790 [1,0,0,0,0,0|2,0,0]=3 531 B6R0.6 CCO[Cu]OCC Amb19930220 [1,0,0,0,0,0|2,0,0]=3 532 B6R0.6 CCO[Mg]OCC Amb17939310 [1,0,0,0,0,0|2,0,0]=3 533 B6R0.6 CCO[Sn]OCC Amb19894340 [1,0,0,0,0,0|2,0,0]=3 534 B6R0.6 CCSC#CCO Amb25740596 [1,0,0,0,0,0|1,0,2]=4 535 B6R0.6 CCSCCC#C Amb24670860 [1,0,0,0,0,0|0,1,2]=4 536 B6R0.6 CCSCCCF Amb25846157 [1,0,0,0,0,0|1,1,0]=3 537 B6R0.6 CCSCCOC Amb24333360 [1,0,0,0,0,0|1,1,0]=3 538 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|2,1,0]=4 539 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|1,1,0]=3 540 B6R0.6 CCSSSCC Amb22168293 [1,0,0,0,0,0|2,1,0]=4 541 B6R0.6 CCS[Pb]SCC Amb22359753 [1,0,0,0,0,0|2,1,0]=4 542 B6R0.6 CC[SiH2]CCCCl Amb24620188 [1,0,0,0,0,0|1,1,0]=3 543 B6R0.6 CNCCCC#C Amb18993049 [1,0,0,0,0,0|2,0,1]=4 544 B6R0.6 CNCCCC=C Amb18523846 [1,0,0,0,0,0|2,0,1]=4 545 B6R0.6 CNCCCC=O Amb25026193 [1,0,0,0,0,0|1,0,2]=4 546 B6R0.6 CNCCCCBr Amb22490953 [1,0,0,0,0,0|2,0,0]=3 547 B6R0.6 CNCCCCBr Amb22491228 [1,0,0,0,0,0|2,0,0]=3 548 B6R0.6 CNCCCCCl Amb25106571 [1,0,0,0,0,0|2,0,0]=3 549 B6R0.6 CNCCCCI Amb25275194 [1,0,0,0,0,0|2,0,0]=3 550 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|2,0,0]=3 551 B6R0.6 CNCCCCO Amb17334049 [1,0,0,0,0,0|1,0,0]=2 552 B6R0.6 CNCCCCS Amb24479785 [1,0,0,0,0,0|1,1,0]=3 553 B6R0.6 CNCCNNC Amb24386099 [1,0,0,0,0,0|3,0,0]=4 554 B6R0.6 CNCCOC=C Amb18639709 [1,0,0,0,0,0|1,0,2]=4 555 B6R0.6 CNCCONC Amb24744491 [1,0,0,0,0,0|2,0,0]=3 556 B6R0.6 CNCCSCC Amb16186669 [1,0,0,0,0,0|1,1,0]=3 557 B6R0.6 CNCCSCC Amb19889162 [1,0,0,0,0,0|1,1,0]=3 558 B6R0.6 CNC\C=C/CO Amb24479692 [1,0,0,0,0,0|1,0,2]=4 559 B6R0.6 COCC#CCO Amb25675713 [1,0,0,0,0,0|1,0,2]=4 560 B6R0.6 COCCCC#C Amb25694831 [1,0,0,0,0,0|2,0,1]=4 561 B6R0.6 COCCCC=C Amb24432882 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|2,0,0]=3 563 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|2,0,0]=3 564 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|1,0,0]=2 565 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|1,1,0]=3 566 B6R0.6 COCCCOC Amb22168275 [1,0,0,0,0,0|3,0,0]=4 567 B6R0.6 COCCCON Amb18559290 [1,0,0,0,0,0|3,0,0]=4 568 B6R0.6 COCCC[Mg]Cl Amb22897395 [1,0,0,0,0,0|3,0,0]=4 569 B6R0.6 COCCC[Zn]Cl Amb22897901 [1,0,0,0,0,0|3,0,0]=4 570 B6R0.6 COCCOC=C Amb21520356 [1,0,0,0,0,0|1,0,2]=4 571 B6R0.6 COCCOCBr Amb24414243 [1,0,0,0,0,0|2,0,0]=3 572 B6R0.6 COCCOCC Amb22052684 [1,0,0,0,0,0|1,0,0]=2 573 B6R0.6 COCCOCI Amb24480989 [1,0,0,0,0,0|2,0,0]=3 574 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|2,0,0]=3 575 B6R0.6 COCOCC=C Amb24385255 [1,0,0,0,0,0|2,0,1]=4 576 B6R0.6 COCOCCBr Amb22336766 [1,0,0,0,0,0|2,0,0]=3 577 B6R0.6 COCOCCCl Amb22546806 [1,0,0,0,0,0|2,0,0]=3 578 B6R0.6 COCOCCN Amb25314793 [1,0,0,0,0,0|2,0,0]=3 579 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|1,0,0]=2 580 B6R0.6 COCOCOC Amb22728050 [1,0,0,0,0,0|3,0,0]=4 581 B6R0.6 COCSCCN Amb24672416 [1,0,0,0,0,0|2,1,0]=4 582 B6R0.6 COCSCCO Amb24701888 [1,0,0,0,0,0|1,1,0]=3 583 B6R0.6 COC\C=C\CO Amb25662350 [1,0,0,0,0,0|1,0,2]=4 584 B6R0.6 CONCCCI Amb25846019 [1,0,0,0,0,0|3,0,0]=4 585 B6R0.6 CONCCCO Amb24479622 [1,0,0,0,0,0|2,0,0]=3 586 B6R0.6 CO\C=C\CCO Amb24661187 [1,0,0,0,0,0|1,0,2]=4 587 B6R0.6 CSC#CCCO Amb17593203 [1,0,0,0,0,0|1,0,2]=4 588 B6R0.6 CSCCCC#N Amb17504231 [1,0,0,0,0,0|2,0,1]=4 589 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|2,0,0]=3 590 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|2,0,0]=3 591 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|2,0,0]=3 592 B6R0.6 CSCCCNN Amb24093854 [1,0,0,0,0,0|3,0,0]=4 593 B6R0.6 CSCCCSC Amb22043311 [1,0,0,0,0,0|3,0,0]=4 594 B6R0.6 CSCCOC=C Amb25801320 [1,0,0,0,0,0|1,0,2]=4 595 B6R0.6 CSCCOCCl Amb25132478 [1,0,0,0,0,0|2,0,0]=3 596 B6R0.6 CSCCSCCl Amb24504428 [1,0,0,0,0,0|2,1,0]=4 597 B6R0.6 CSC\C=C\CO Amb24387294 [1,0,0,0,0,0|1,0,2]=4 598 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|1,0,1]=3 599 B6R0.6 C\C=C/CCCCl Amb22732552 [1,0,0,0,0,0|1,0,2]=4 600 B6R0.6 C\C=C/CCCO Amb17614951 [1,0,0,0,0,0|0,0,2]=3 601 B6R0.6 C\C=C\CCCBr Amb24525194 [1,0,0,0,0,0|1,0,2]=4 602 B6R0.6 C\C=C\CCCI Amb25837122 [1,0,0,0,0,0|1,0,2]=4 603 B6R0.6 C\C=C\CCCN Amb25288441 [1,0,0,0,0,0|1,0,2]=4 604 B6R0.6 C\C=C\CCCO Amb22347882 [1,0,0,0,0,0|0,0,2]=3 605 B6R0.6 C\C=C\CCNC Amb18993047 [1,0,0,0,0,0|2,0,1]=4 606 B6R0.6 C\C=C\CCNO Amb25245372 [1,0,0,0,0,0|1,0,2]=4 607 B6R0.6 C\C=C\CNCC Amb24370243 [1,0,0,0,0,0|1,0,2]=4 608 B6R0.6 C\C=C\COCCl Amb24353241 [1,0,0,0,0,0|1,0,2]=4 609 B6R0.6 C\C=C\NCCC Amb25113340 [1,0,0,0,0,0|2,0,1]=4 610 B6R0.6 C\C=C\OCCCl Amb25076175 [1,0,0,0,0,0|1,0,2]=4 611 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|2,0,1]=4 612 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|2,0,0]=3 613 B6R0.6 ClCCCOCCl Amb24479881 [1,0,0,0,0,0|2,0,0]=3 614 B6R0.6 ClCCCSCCl Amb24547930 [1,0,0,0,0,0|2,1,0]=4 615 B6R0.6 ClCCNCCCl Amb2583221 [1,0,0,0,0,0|3,0,0]=4 616 B6R0.6 ClCCOCCBr Amb25810803 [1,0,0,0,0,0|2,0,0]=3 617 B6R0.6 ClCCOCCI Amb24055322 [1,0,0,0,0,0|2,0,0]=3 618 B6R0.6 ClCCSCCCl Amb22731869 [1,0,0,0,0,0|2,1,0]=4 619 B6R0.6 ClCOCOCCl Amb22330563 [1,0,0,0,0,0|3,0,0]=4 620 B6R0.6 Cl[13CH2][13CH2]N[13CH2][13CH2]Cl Amb22367273 [1,0,0,0,0,0|3,0,0]=4 621 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|2,0,0]=3 622 B6R0.6 FCCCCCCl Amb24479767 [1,0,0,0,0,0|2,0,0]=3 623 B6R0.6 FCCCCCI Amb25690320 [1,0,0,0,0,0|2,0,0]=3 624 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|1,1,0]=3 625 B6R0.6 FCCCC[Mg]Br Amb22897418 [1,0,0,0,0,0|3,0,0]=4 626 B6R0.6 FCCCC[Zn]Br Amb22897529 [1,0,0,0,0,0|3,0,0]=4 627 B6R0.6 FCCNCCCl Amb25083641 [1,0,0,0,0,0|3,0,0]=4 628 B6R0.6 FCCNCCI Amb25091022 [1,0,0,0,0,0|3,0,0]=4 629 B6R0.6 N#CCCOCCl Amb25084621 [1,0,0,0,0,0|2,0,1]=4 630 B6R0.6 N#CCOCCCl Amb22002338 [1,0,0,0,0,0|2,0,1]=4 631 B6R0.6 N=CCOCCO Amb24407453 [1,0,0,0,0,0|1,0,1]=3 632 B6R0.6 NCCCCC#N Amb18301883 [1,0,0,0,0,0|2,0,1]=4 633 B6R0.6 NCCCCCBr Amb17610058 [1,0,0,0,0,0|2,0,0]=3 634 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|2,0,0]=3 635 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|2,0,0]=3 636 B6R0.6 NCCCCCN Amb22337298 [1,0,0,0,0,0|2,0,0]=3 637 B6R0.6 NCCCCNCl Amb25228620 [1,0,0,0,0,0|3,0,0]=4 638 B6R0.6 NCCCCNO Amb24117989 [1,0,0,0,0,0|2,0,0]=3 639 B6R0.6 NCCCNCC Amb17315269 [1,0,0,0,0,0|2,0,0]=3 640 B6R0.6 NCCNCCBr Amb24079705 [1,0,0,0,0,0|3,0,0]=4 641 B6R0.6 NCCNCCCl Amb21864973 [1,0,0,0,0,0|3,0,0]=4 642 B6R0.6 NCCNCCCl Amb24479877 [1,0,0,0,0,0|3,0,0]=4 643 B6R0.6 NCCNCCF Amb25076474 [1,0,0,0,0,0|3,0,0]=4 644 B6R0.6 NCCNCCS Amb24763096 [1,0,0,0,0,0|2,1,0]=4 645 B6R0.6 NCCOCC#N Amb18976432 [1,0,0,0,0,0|2,0,1]=4 646 B6R0.6 NCCOCCCl Amb22036609 [1,0,0,0,0,0|2,0,0]=3 647 B6R0.6 NCCOCCCl Amb25849262 [1,0,0,0,0,0|2,0,0]=3 648 B6R0.6 NCCOCCN Amb22347968 [1,0,0,0,0,0|2,0,0]=3 649 B6R0.6 NCCOCCN Amb2583212 [1,0,0,0,0,0|2,0,0]=3 650 B6R0.6 NCCOCCS Amb17502015 [1,0,0,0,0,0|1,1,0]=3 651 B6R0.6 NCCOCC[*] Amb24270966 [1,0,0,0,0,0|2,0,0]=3 652 B6R0.6 NCCSCCCl Amb18124545 [1,0,0,0,0,0|2,1,0]=4 653 B6R0.6 NCCSCCS Amb18124501 [1,0,0,0,0,0|1,2,0]=4 654 B6R0.6 NCC\C=C\CC Amb17569886 [1,0,0,0,0,0|1,0,2]=4 655 B6R0.6 NNCCCCCl Amb24674957 [1,0,0,0,0,0|3,0,0]=4 656 B6R0.6 NNCCCCO Amb24692523 [1,0,0,0,0,0|2,0,0]=3 657 B6R0.6 NOCCCCF Amb22896553 [1,0,0,0,0,0|3,0,0]=4 658 B6R0.6 NOCCCCO Amb25756966 [1,0,0,0,0,0|2,0,0]=3 659 B6R0.6 N[14CH2]CCC[14CH2]N Amb22350129 [1,0,0,0,0,0|2,0,0]=3 660 B6R0.6 O=CCCCCBr Amb18126353 [1,0,0,0,0,0|1,0,2]=4 661 B6R0.6 O=CCCCCCl Amb18123550 [1,0,0,0,0,0|1,0,2]=4 662 B6R0.6 O=CCCCCF Amb25725976 [1,0,0,0,0,0|1,0,2]=4 663 B6R0.6 O=CCCCCI Amb24707459 [1,0,0,0,0,0|1,0,2]=4 664 B6R0.6 O=CCOCCCl Amb24665263 [1,0,0,0,0,0|1,0,2]=4 665 B6R0.6 O=COCCCBr Amb25725047 [1,0,0,0,0,0|1,0,2]=4 666 B6R0.6 O=COCCCCl Amb24427057 [1,0,0,0,0,0|1,0,2]=4 667 B6R0.6 O=COCCCF Amb22008204 [1,0,0,0,0,0|1,0,2]=4 668 B6R0.6 O=COCCCI Amb25839622 [1,0,0,0,0,0|1,0,2]=4 669 B6R0.6 OCC=NCCO Amb24507433 [1,0,0,0,0,0|2,0,1]=4 670 B6R0.6 OCCC#CCO Amb24403282 [1,0,0,0,0,0|1,0,2]=4 671 B6R0.6 OCCCC=C=C Amb10605300 [1,0,0,0,0,0|0,0,3]=4 672 B6R0.6 OCCCCC=O Amb10603837 [1,0,0,0,0,0|1,0,1]=3 673 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|1,0,0]=2 674 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|1,0,0]=2 675 B6R0.6 OCCCCCI Amb25025520 [1,0,0,0,0,0|1,0,0]=2 676 B6R0.6 OCCCCSCl Amb24619715 [1,0,0,0,0,0|2,0,0]=3 677 B6R0.6 OCCCOC=O Amb24733886 [1,0,0,0,0,0|1,0,2]=4 678 B6R0.6 OCCNCCCl Amb18642158 [1,0,0,0,0,0|2,0,0]=3 679 B6R0.6 OCCNCCCl Amb22641891 [1,0,0,0,0,0|2,0,0]=3 680 B6R0.6 OCCNCCO Amb22035219 [1,0,0,0,0,0|2,0,0]=3 681 B6R0.6 OCCNCCS Amb18522180 [1,0,0,0,0,0|2,0,0]=3 682 B6R0.6 OCCOCC#C Amb16232584 [1,0,0,0,0,0|0,0,2]=3 683 B6R0.6 OCCOCC=O Amb24060822 [1,0,0,0,0,0|1,0,1]=3 684 B6R0.6 OCCOCCBr Amb24057456 [1,0,0,0,0,0|1,0,0]=2 685 B6R0.6 OCCOCCF Amb17593119 [1,0,0,0,0,0|1,0,0]=2 686 B6R0.6 OCCOCCO Amb19515789 [1,0,0,0,0,0|1,0,0]=2 687 B6R0.6 OCCOCCO Amb22232249 [1,0,0,0,0,0|1,0,0]=2 688 B6R0.6 OCCOCCS Amb22008751 [1,0,0,0,0,0|1,0,0]=2 689 B6R0.6 OCCSCC=O Amb24525990 [1,0,0,0,0,0|1,1,1]=4 690 B6R0.6 OCCSCCF Amb25261470 [1,0,0,0,0,0|1,1,0]=3 691 B6R0.6 OCC\C=C\CBr Amb24608445 [1,0,0,0,0,0|1,0,2]=4 692 B6R0.6 OCOCOCO Amb25084369 [1,0,0,0,0,0|2,0,0]=3 693 B6R0.6 OCOCSCS Amb25800804 [1,0,0,0,0,0|2,0,0]=3 694 B6R0.6 OC\C=C\CCBr Amb24720101 [1,0,0,0,0,0|1,0,2]=4 695 B6R0.6 O\C=C\CCCO Amb24480597 [1,0,0,0,0,0|1,0,2]=4 696 B6R0.6 O\N=C/CCCCl Amb25295218 [1,0,0,0,0,0|2,0,1]=4 697 B6R0.6 SCCCCCBr Amb25775029 [1,0,0,0,0,0|1,1,0]=3 698 B6R0.6 SCCNCCS Amb18124500 [1,0,0,0,0,0|2,1,0]=4 699 B6R0.6 SCCOCCCl Amb25347461 [1,0,0,0,0,0|1,1,0]=3 700 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]Br Amb22367407 [1,0,0,0,0,0|1,0,0]=2 701 B6R0.6 [13CH3][13CH2][13CH2][13CH2][13CH2][13CH2]O Amb22367427 [1,0,0,0,0,0|0,0,0]=1 702 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,0,0,0,0,0|3,0,0]=4 703 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,0,0,0,0,0|1,0,1]=3 704 B6R0.6 [CH2]CCNCCN Amb24323465 [1,0,0,0,0,0|2,0,1]=4 705 B6R0.6 [N-]=[N+]=NCCCO Amb20623004 [1,0,0,0,0,0|3,0,0]=4 706 B8R0.1 C#CCC(Cl)CCCO Amb24592384 [0,1,0,0,0,0|1,0,2]=4 707 B8R0.1 C#CCCC(=O)CCO Amb24384003 [0,1,0,0,0,0|1,0,2]=4 708 B8R0.1 C=CCC(O)CCCO Amb25070476 [0,1,0,0,0,0|1,0,2]=4 709 B8R0.1 CC#CC(C)OCCBr Amb25702785 [0,1,0,0,0,0|1,0,2]=4 710 B8R0.1 CC#CCC(C)CCO Amb25097714 [0,1,0,0,0,0|1,0,2]=4 711 B8R0.1 CC#CCN(C)CCO Amb24368002 [0,1,0,0,0,0|1,0,2]=4 712 B8R0.1 CC(CC#N)NCCO Amb18304430 [0,1,0,0,0,0|2,0,1]=4 713 B8R0.1 CC(CC=C)OCCO Amb25675450 [0,1,0,0,0,0|0,0,2]=3 714 B8R0.1 CC(CC=O)OCCO Amb25827511 [0,1,0,0,0,0|1,0,1]=3 715 B8R0.1 CC(CC=O)SCCO Amb25718969 [0,1,0,0,0,0|1,1,1]=4 716 B8R0.1 CC(CCBr)NCCF Amb24481669 [0,1,0,0,0,0|3,0,0]=4 717 B8R0.1 CC(CCC)CCCC Amb22229830 [0,1,0,0,0,0|2,0,0]=3 718 B8R0.1 CC(CCCO)=CCO Amb24475813 [0,1,0,0,0,0|2,0,1]=4 719 B8R0.1 CC(CCCl)NCCF Amb24481670 [0,1,0,0,0,0|3,0,0]=4 720 B8R0.1 CC(CCCl)SCCF Amb24439874 [0,1,0,0,0,0|2,1,0]=4 721 B8R0.1 CC(CCN)CCCN Amb25698315 [0,1,0,0,0,0|3,0,0]=4 722 B8R0.1 CC(CCN)NCCO Amb20090523 [0,1,0,0,0,0|2,0,0]=3 723 B8R0.1 CC(CCN)SCCN Amb24682236 [0,1,0,0,0,0|2,1,0]=4 724 B8R0.1 CC(CCO)=CCCO Amb25731016 [0,1,0,0,0,0|2,0,1]=4 725 B8R0.1 CC(CCO)CCC#C Amb24362694 [0,1,0,0,0,0|1,0,2]=4 726 B8R0.1 CC(CCO)CCCBr Amb24339783 [0,1,0,0,0,0|2,0,0]=3 727 B8R0.1 CC(CCO)NCCF Amb25079348 [0,1,0,0,0,0|3,0,0]=4 728 B8R0.1 CC(CCO)SCCN Amb25276422 [0,1,0,0,0,0|2,1,0]=4 729 B8R0.1 CC(CCO)SCCO Amb24478757 [0,1,0,0,0,0|1,1,0]=3 730 B8R0.1 CCC#CC(C)CCC Amb25211324 [0,1,0,0,0,0|2,0,1]=4 731 B8R0.1 CCCC(=O)CCCCl Amb24410674 [0,1,0,0,0,0|2,0,1]=4 732 B8R0.1 CCCC(=O)CCNC Amb24605263 [0,1,0,0,0,0|3,0,0]=4 733 B8R0.1 CCCC(=O)CCOC Amb25163114 [0,1,0,0,0,0|3,0,0]=4 734 B8R0.1 CCCC(=O)CNCC Amb25142247 [0,1,0,0,0,0|3,0,0]=4 735 B8R0.1 CCCC(=O)COCC Amb25823475 [0,1,0,0,0,0|3,0,0]=4 736 B8R0.1 CCCC(=O)CSCC Amb25236661 [0,1,0,0,0,0|3,0,0]=4 737 B8R0.1 CCCC(=O)NCCCl Amb17103189 [0,1,0,0,0,0|2,0,1]=4 738 B8R0.1 CCCC(=O)NCCF Amb24456106 [0,1,0,0,0,0|2,0,1]=4 739 B8R0.1 CCCC(=O)NCCS Amb24655047 [0,1,0,0,0,0|1,1,1]=4 740 B8R0.1 CCCC(=O)OCCBr Amb25087679 [0,1,0,0,0,0|1,0,1]=3 741 B8R0.1 CCCC(=O)SCCN Amb25836346 [0,1,0,0,0,0|1,1,1]=4 742 B8R0.1 CCCC(Br)CCC#N Amb25262021 [0,1,0,0,0,0|2,0,1]=4 743 B8R0.1 CCCC(C)=C=CCO Amb25713223 [0,1,0,0,0,0|1,0,2]=4 744 B8R0.1 CCCC(C)=CCCBr Amb24480252 [0,1,0,0,0,0|2,0,1]=4 745 B8R0.1 CCCC(C)=CCCN Amb24477832 [0,1,0,0,0,0|2,0,1]=4 746 B8R0.1 CCCC(C)CCC#N Amb25104393 [0,1,0,0,0,0|2,0,1]=4 747 B8R0.1 CCCC(C)CCC=C Amb24532824 [0,1,0,0,0,0|2,0,1]=4 748 B8R0.1 CCCC(C)CCC=O Amb25032222 [0,1,0,0,0,0|1,0,2]=4 749 B8R0.1 CCCC(C)CCCBr Amb18321781 [0,1,0,0,0,0|2,0,0]=3 750 B8R0.1 CCCC(C)CCCO Amb25135097 [0,1,0,0,0,0|1,0,0]=2 751 B8R0.1 CCCC(C)CCNN Amb24447378 [0,1,0,0,0,0|3,0,0]=4 752 B8R0.1 CCCC(C)NCCI Amb25332519 [0,1,0,0,0,0|2,0,0]=3 753 B8R0.1 CCCC(C)OCC#N Amb24524106 [0,1,0,0,0,0|1,0,1]=3 754 B8R0.1 CCCC(C)SCCCl Amb25057172 [0,1,0,0,0,0|1,1,0]=3 755 B8R0.1 CCCC(C)SCCN Amb25106980 [0,1,0,0,0,0|1,1,0]=3 756 B8R0.1 CCCC(C)SCCO Amb25032319 [0,1,0,0,0,0|0,1,0]=2 757 B8R0.1 CCCC(C)\C=C\CCl Amb24532383 [0,1,0,0,0,0|2,0,1]=4 758 B8R0.1 CCCC(C)\C=C\CO Amb25662127 [0,1,0,0,0,0|1,0,1]=3 759 B8R0.1 CCCC(Cl)CCCC Amb22229751 [0,1,0,0,0,0|2,0,0]=3 760 B8R0.1 CCCC(Cl)OCCCl Amb25188937 [0,1,0,0,0,0|1,0,0]=2 761 B8R0.1 CCCC(I)CCCC Amb25314282 [0,1,0,0,0,0|2,0,0]=3 762 B8R0.1 CCCC(N)CCC=C Amb25858769 [0,1,0,0,0,0|2,0,1]=4 763 B8R0.1 CCCC(N)CCCO Amb18203174 [0,1,0,0,0,0|1,0,0]=2 764 B8R0.1 CCCC(N)CNCC Amb25185354 [0,1,0,0,0,0|3,0,0]=4 765 B8R0.1 CCCC(N)COCC Amb25677257 [0,1,0,0,0,0|3,0,0]=4 766 B8R0.1 CCCC(N)CSCC Amb25342082 [0,1,0,0,0,0|3,0,0]=4 767 B8R0.1 CCCC(O)C#CCBr Amb24480108 [0,1,0,0,0,0|2,0,1]=4 768 B8R0.1 CCCC(O)C#CCO Amb24464701 [0,1,0,0,0,0|1,0,1]=3 769 B8R0.1 CCCC(O)CCC#N Amb18642534 [0,1,0,0,0,0|2,0,1]=4 770 B8R0.1 CCCC(O)CCCCl Amb25094734 [0,1,0,0,0,0|2,0,0]=3 771 B8R0.1 CCCC(O)CCCN Amb25365972 [0,1,0,0,0,0|2,0,0]=3 772 B8R0.1 CCCC(O)CCCS Amb25740546 [0,1,0,0,0,0|1,1,0]=3 773 B8R0.1 CCCC(O)CSCC Amb25793484 [0,1,0,0,0,0|3,0,0]=4 774 B8R0.1 CCCCC(=C)CCBr Amb24480099 [0,1,0,0,0,0|2,0,0]=3 775 B8R0.1 CCCCC(=N)NCC Amb24478689 [0,1,0,0,0,0|3,0,0]=4 776 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,1,0,0,0,0|3,0,0]=4 777 B8R0.1 CCCCC(=O)CC=C Amb10567269 [0,1,0,0,0,0|2,0,1]=4 778 B8R0.1 CCCCC(=O)CCCl Amb25705250 [0,1,0,0,0,0|2,0,0]=3 779 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,1,0,0,0,0|3,0,0]=4 780 B8R0.1 CCCCC(=O)COC Amb19374627 [0,1,0,0,0,0|3,0,0]=4 781 B8R0.1 CCCCC(=O)NCC Amb17787354 [0,1,0,0,0,0|3,0,0]=4 782 B8R0.1 CCCCC(Br)=CCO Amb25163358 [0,1,0,0,0,0|1,0,1]=3 783 B8R0.1 CCCCC(Br)CC=C Amb25065733 [0,1,0,0,0,0|2,0,1]=4 784 B8R0.1 CCCCC(Br)CCBr Amb23456165 [0,1,0,0,0,0|2,0,0]=3 785 B8R0.1 CCCCC(Br)COC Amb19062466 [0,1,0,0,0,0|3,0,0]=4 786 B8R0.1 CCCCC(C)=CCCl Amb24359596 [0,1,0,0,0,0|2,0,1]=4 787 B8R0.1 CCCCC(C)CC#N Amb24703016 [0,1,0,0,0,0|2,0,1]=4 788 B8R0.1 CCCCC(C)CC=O Amb18642676 [0,1,0,0,0,0|1,0,2]=4 789 B8R0.1 CCCCC(C)CCBr Amb25809503 [0,1,0,0,0,0|2,0,0]=3 790 B8R0.1 CCCCC(C)CCCl Amb24657256 [0,1,0,0,0,0|2,0,0]=3 791 B8R0.1 CCCCC(C)CCO Amb22229364 [0,1,0,0,0,0|1,0,0]=2 792 B8R0.1 CCCCC(C)CNC Amb24743121 [0,1,0,0,0,0|3,0,0]=4 793 B8R0.1 CCCCC(C)CNN Amb25284805 [0,1,0,0,0,0|3,0,0]=4 794 B8R0.1 CCCCC(C)OCO Amb24386900 [0,1,0,0,0,0|2,0,0]=3 795 B8R0.1 CCCCC(C)\C=C\O Amb25747407 [0,1,0,0,0,0|1,0,2]=4 796 B8R0.1 CCCCC(CCC)Br Amb13951105 [0,1,0,0,0,0|2,0,0]=3 797 B8R0.1 CCCCC(Cl)CC#N Amb24373742 [0,1,0,0,0,0|2,0,1]=4 798 B8R0.1 CCCCC(Cl)CCBr Amb25067959 [0,1,0,0,0,0|2,0,0]=3 799 B8R0.1 CCCCC(Cl)COC Amb18791840 [0,1,0,0,0,0|3,0,0]=4 800 B8R0.1 CCCCC(Cl)CSC Amb24374601 [0,1,0,0,0,0|3,0,0]=4 801 B8R0.1 CCCCC(Cl)OCC Amb25141240 [0,1,0,0,0,0|3,0,0]=4 802 B8R0.1 CCCCC(N)CC#C Amb25682959 [0,1,0,0,0,0|2,0,1]=4 803 B8R0.1 CCCCC(N)CC=C Amb25082468 [0,1,0,0,0,0|2,0,1]=4 804 B8R0.1 CCCCC(N)CCO Amb18642854 [0,1,0,0,0,0|1,0,0]=2 805 B8R0.1 CCCCC(N)CCO Amb24117271 [0,1,0,0,0,0|1,0,0]=2 806 B8R0.1 CCCCC(N)COC Amb19374470 [0,1,0,0,0,0|3,0,0]=4 807 B8R0.1 CCCCC(N)CSC Amb24439844 [0,1,0,0,0,0|3,0,0]=4 808 B8R0.1 CCCCC(O)CC#N Amb18642535 [0,1,0,0,0,0|2,0,1]=4 809 B8R0.1 CCCCC(O)CC=C Amb22052681 [0,1,0,0,0,0|2,0,1]=4 810 B8R0.1 CCCCC(O)CCN Amb25784846 [0,1,0,0,0,0|2,0,0]=3 811 B8R0.1 CCCCC(O)CCO Amb23456144 [0,1,0,0,0,0|1,0,0]=2 812 B8R0.1 CCCCC(O)CNC Amb24351205 [0,1,0,0,0,0|3,0,0]=4 813 B8R0.1 CCCCC(O)CNN Amb24735459 [0,1,0,0,0,0|3,0,0]=4 814 B8R0.1 CCCCC(O)CSC Amb25790834 [0,1,0,0,0,0|3,0,0]=4 815 B8R0.1 CCCCN(C)CC=C Amb25097532 [0,1,0,0,0,0|2,0,1]=4 816 B8R0.1 CCCCN(C)CCBr Amb19037647 [0,1,0,0,0,0|2,0,0]=3 817 B8R0.1 CCCCN(C)CCCl Amb21953733 [0,1,0,0,0,0|2,0,0]=3 818 B8R0.1 CCCCN(C)CCI Amb25331463 [0,1,0,0,0,0|2,0,0]=3 819 B8R0.1 CCCCN(CCCl)C Amb17334289 [0,1,0,0,0,0|2,0,0]=3 820 B8R0.1 CCCCN(N)CCN Amb24597657 [0,1,0,0,0,0|2,0,0]=3 821 B8R0.1 CCCCP(O)OCC Amb25675671 [0,1,0,0,0,0|3,0,0]=4 822 B8R0.1 CCCCS(=O)CCCl Amb25809038 [0,1,0,0,0,0|1,1,0]=3 823 B8R0.1 CCCCS(=O)CCN Amb24416134 [0,1,0,0,0,0|1,1,0]=3 824 B8R0.1 CCCC[C@@H](C)CCBr Amb24710268 [0,1,0,0,0,0|2,0,0]=3 825 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,1,0,0,0,0|1,0,0]=2 826 B8R0.1 CCCC[C@@H](N)CC=C Amb25118429 [0,1,0,0,0,0|2,0,1]=4 827 B8R0.1 CCCC[C@@H](N)CCO Amb22745144 [0,1,0,0,0,0|1,0,0]=2 828 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,1,0,0,0,0|1,0,0]=2 829 B8R0.1 CCCC[C@@H](O)CC=C Amb25698967 [0,1,0,0,0,0|2,0,1]=4 830 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,1,0,0,0,0|2,0,0]=3 831 B8R0.1 CCCC[C@@H](O)CCO Amb25185200 [0,1,0,0,0,0|1,0,0]=2 832 B8R0.1 CCCC[C@@H](O)COC Amb24672476 [0,1,0,0,0,0|3,0,0]=4 833 B8R0.1 CCCC[C@H](C)CC#N Amb25222691 [0,1,0,0,0,0|2,0,1]=4 834 B8R0.1 CCCC[C@H](C)CC=O Amb25269517 [0,1,0,0,0,0|1,0,2]=4 835 B8R0.1 CCCC[C@H](C)CCN Amb24427024 [0,1,0,0,0,0|2,0,0]=3 836 B8R0.1 CCCC[C@H](N)CC=C Amb24524170 [0,1,0,0,0,0|2,0,1]=4 837 B8R0.1 CCCC[C@H](O)CCO Amb25329636 [0,1,0,0,0,0|1,0,0]=2 838 B8R0.1 CCCC[C@H](O)COC Amb25099350 [0,1,0,0,0,0|3,0,0]=4 839 B8R0.1 CCCC\C(\C)=C\CN Amb25722291 [0,1,0,0,0,0|2,0,1]=4 840 B8R0.1 CCCN(C)CCCBr Amb18316483 [0,1,0,0,0,0|3,0,0]=4 841 B8R0.1 CCCN(CCCCl)C Amb17334290 [0,1,0,0,0,0|3,0,0]=4 842 B8R0.1 CCCN=[N+]([O-])CCC Amb25254630 [0,1,0,0,0,0|3,0,0]=4 843 B8R0.1 CCCNC(=O)CCBr Amb17333407 [0,1,0,0,0,0|3,0,0]=4 844 B8R0.1 CCCNC(=O)CCCl Amb1128924 [0,1,0,0,0,0|3,0,0]=4 845 B8R0.1 CCCNC(=O)CCN Amb1133966 [0,1,0,0,0,0|3,0,0]=4 846 B8R0.1 CCCNC(=O)CCN Amb21957303 [0,1,0,0,0,0|3,0,0]=4 847 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,1,0,0,0,0|2,0,0]=3 848 B8R0.1 CCCNC(=O)CNO Amb24454974 [0,1,0,0,0,0|3,0,0]=4 849 B8R0.1 CCCNC(C)CCBr Amb24703028 [0,1,0,0,0,0|3,0,0]=4 850 B8R0.1 CCCNC(C)CCN Amb20090505 [0,1,0,0,0,0|3,0,0]=4 851 B8R0.1 CCCNC(C)CCO Amb24416135 [0,1,0,0,0,0|2,0,0]=3 852 B8R0.1 CCCNC(C)CSC Amb25848624 [0,1,0,0,0,0|3,0,0]=4 853 B8R0.1 CCCN[C@@H](C)COC Amb24477769 [0,1,0,0,0,0|3,0,0]=4 854 B8R0.1 CCCOC(=N)CCBr Amb25711691 [0,1,0,0,0,0|2,0,1]=4 855 B8R0.1 CCCOC(=O)CCBr Amb25361170 [0,1,0,0,0,0|2,0,1]=4 856 B8R0.1 CCCOC(=O)CCN Amb19409653 [0,1,0,0,0,0|2,0,1]=4 857 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,1,0,0,0,0|2,0,0]=3 858 B8R0.1 CCCOC(=O)CCS Amb22053845 [0,1,0,0,0,0|2,0,1]=4 859 B8R0.1 CCCOC(=O)CSC Amb24471191 [0,1,0,0,0,0|2,0,1]=4 860 B8R0.1 CCCOC(=O)NCO Amb25082749 [0,1,0,0,0,0|3,0,0]=4 861 B8R0.1 CCCOC(C)CC=O Amb18642800 [0,1,0,0,0,0|2,0,1]=4 862 B8R0.1 CCCOP(=O)CCBr Amb24654719 [0,1,0,0,0,0|3,0,0]=4 863 B8R0.1 CCCS(=O)CCCC Amb25173878 [0,1,0,0,0,0|1,1,0]=3 864 B8R0.1 CCCS(=O)CCCN Amb25711712 [0,1,0,0,0,0|2,1,0]=4 865 B8R0.1 CCCS(=O)CCNC Amb24478642 [0,1,0,0,0,0|2,1,0]=4 866 B8R0.1 CCCS(=O)NCCN Amb24738271 [0,1,0,0,0,0|3,0,0]=4 867 B8R0.1 CCCSC(C)CCCl Amb24481652 [0,1,0,0,0,0|2,1,0]=4 868 B8R0.1 CCCSC(C)CCO Amb25305005 [0,1,0,0,0,0|2,0,0]=3 869 B8R0.1 CCC[C@@H](Br)CCCC Amb25111263 [0,1,0,0,0,0|2,0,0]=3 870 B8R0.1 CCC[C@@H](C)NCC#C Amb25297467 [0,1,0,0,0,0|2,0,1]=4 871 B8R0.1 CCC[C@@H](N)CCCC Amb24481835 [0,1,0,0,0,0|2,0,0]=3 872 B8R0.1 CCC[C@@H](N)CCOC Amb24481834 [0,1,0,0,0,0|3,0,0]=4 873 B8R0.1 CCC[C@@H](N)CNCC Amb25215966 [0,1,0,0,0,0|3,0,0]=4 874 B8R0.1 CCC[C@@H](N)COCC Amb25120349 [0,1,0,0,0,0|3,0,0]=4 875 B8R0.1 CCC[C@@H](O)CCCC Amb25266395 [0,1,0,0,0,0|2,0,0]=3 876 B8R0.1 CCC[C@@H](O)CCCO Amb25852254 [0,1,0,0,0,0|1,0,0]=2 877 B8R0.1 CCC[C@H](C)CCCBr Amb24480144 [0,1,0,0,0,0|2,0,0]=3 878 B8R0.1 CCC[C@H](C)NCC#N Amb25312790 [0,1,0,0,0,0|2,0,1]=4 879 B8R0.1 CCC[C@H](N)CCCC Amb25146174 [0,1,0,0,0,0|2,0,0]=3 880 B8R0.1 CCC[C@H](N)CCOC Amb25050187 [0,1,0,0,0,0|3,0,0]=4 881 B8R0.1 CCC[C@H](N)COCC Amb25189008 [0,1,0,0,0,0|3,0,0]=4 882 B8R0.1 CCC[C@H](O)CCOC Amb25177499 [0,1,0,0,0,0|3,0,0]=4 883 B8R0.1 CCC\C=C(\C)/CCO Amb25681461 [0,1,0,0,0,0|1,0,1]=3 884 B8R0.1 CCNC(=O)OCCF Amb25184766 [0,1,0,0,0,0|2,0,1]=4 885 B8R0.1 CCNCC(C)CCO Amb24477796 [0,1,0,0,0,0|2,0,0]=3 886 B8R0.1 CCNCC(O)CCN Amb18062760 [0,1,0,0,0,0|3,0,0]=4 887 B8R0.1 CCNCC(O)CCO Amb25040408 [0,1,0,0,0,0|2,0,0]=3 888 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,1,0,0,0,0|2,0,1]=4 889 B8R0.1 CCOC(=O)OCCBr Amb24480075 [0,1,0,0,0,0|2,0,1]=4 890 B8R0.1 CCOC(=O)OCCCl Amb25369671 [0,1,0,0,0,0|2,0,1]=4 891 B8R0.1 CCOC(=O)OCCN Amb25280455 [0,1,0,0,0,0|2,0,1]=4 892 B8R0.1 CCOC(=S)NCCO Amb25314414 [0,1,0,0,0,0|2,0,1]=4 893 B8R0.1 CCOCC(Br)CCO Amb25108149 [0,1,0,0,0,0|2,0,0]=3 894 B8R0.1 CCOCC(C)=CCO Amb25145312 [0,1,0,0,0,0|2,0,1]=4 895 B8R0.1 CCONC(C)CCC Amb25273703 [0,1,0,0,0,0|3,0,0]=4 896 B8R0.1 CCOP(=O)OCCBr Amb24628567 [0,1,0,0,0,0|3,0,0]=4 897 B8R0.1 CCOP(=O)OCCCl Amb25237473 [0,1,0,0,0,0|3,0,0]=4 898 B8R0.1 CCOP(=O)OCCN Amb25055137 [0,1,0,0,0,0|3,0,0]=4 899 B8R0.1 CCSC(=O)OCCCl Amb24382607 [0,1,0,0,0,0|2,0,1]=4 900 B8R0.1 CCSC(C)SCCO Amb25226408 [0,1,0,0,0,0|1,1,0]=3 901 B8R0.1 CCSCC(C)=CCO Amb24396606 [0,1,0,0,0,0|2,0,1]=4 902 B8R0.1 CCSCC(Cl)=CCO Amb25284515 [0,1,0,0,0,0|2,0,1]=4 903 B8R0.1 CCSCC(N)CCO Amb25336776 [0,1,0,0,0,0|2,0,0]=3 904 B8R0.1 CC\C=C\[C@H](O)CCC Amb24557141 [0,1,0,0,0,0|2,0,1]=4 905 B8R0.1 CN(CCBr)CCCF Amb25265837 [0,1,0,0,0,0|3,0,0]=4 906 B8R0.1 CN(CCCl)CCCCl Amb25251600 [0,1,0,0,0,0|3,0,0]=4 907 B8R0.1 CN(CCCl)CCCF Amb24659732 [0,1,0,0,0,0|3,0,0]=4 908 B8R0.1 CN(CCCl)CCCN Amb24407280 [0,1,0,0,0,0|3,0,0]=4 909 B8R0.1 CN(CCCl)OCCO Amb25378338 [0,1,0,0,0,0|2,0,0]=3 910 B8R0.1 CN(CCF)CCCCl Amb25228271 [0,1,0,0,0,0|3,0,0]=4 911 B8R0.1 CN(CCF)CCCN Amb24379348 [0,1,0,0,0,0|3,0,0]=4 912 B8R0.1 CN(CCF)CCCO Amb24559571 [0,1,0,0,0,0|3,0,0]=4 913 B8R0.1 CN(CCI)CCCO Amb24644919 [0,1,0,0,0,0|3,0,0]=4 914 B8R0.1 CN(CCN)CCCF Amb24453478 [0,1,0,0,0,0|3,0,0]=4 915 B8R0.1 CN(CCN)CCCO Amb25735966 [0,1,0,0,0,0|3,0,0]=4 916 B8R0.1 CN(CCO)CCC#C Amb24106849 [0,1,0,0,0,0|1,0,2]=4 917 B8R0.1 CN(CCO)CCC=C Amb25335445 [0,1,0,0,0,0|1,0,2]=4 918 B8R0.1 CN(CCO)CCCBr Amb18318021 [0,1,0,0,0,0|2,0,0]=3 919 B8R0.1 CN(CCO)CCCCl Amb18776449 [0,1,0,0,0,0|2,0,0]=3 920 B8R0.1 CN(CCO)CCCI Amb24459071 [0,1,0,0,0,0|2,0,0]=3 921 B8R0.1 CN(CCO)CCCS Amb24106928 [0,1,0,0,0,0|2,0,0]=3 922 B8R0.1 CNCC(=O)NCCO Amb21958725 [0,1,0,0,0,0|2,0,1]=4 923 B8R0.1 CNCC(C)CCCBr Amb24536381 [0,1,0,0,0,0|3,0,0]=4 924 B8R0.1 CNCC(C)CCCCl Amb24694264 [0,1,0,0,0,0|3,0,0]=4 925 B8R0.1 CNCC(C)OCC#C Amb18308378 [0,1,0,0,0,0|2,0,1]=4 926 B8R0.1 CNCC(C)OCC#N Amb18308382 [0,1,0,0,0,0|2,0,1]=4 927 B8R0.1 CNCC(C)OCCF Amb24379347 [0,1,0,0,0,0|2,0,0]=3 928 B8R0.1 CNCC(C)OCCO Amb25792621 [0,1,0,0,0,0|1,0,0]=2 929 B8R0.1 CNCC(CCCO)C Amb17569926 [0,1,0,0,0,0|2,0,0]=3 930 B8R0.1 CNCCC(C)CCCl Amb24587947 [0,1,0,0,0,0|3,0,0]=4 931 B8R0.1 CNCCC(C)CCN Amb24552654 [0,1,0,0,0,0|3,0,0]=4 932 B8R0.1 CNCCC(CCO)C Amb17569925 [0,1,0,0,0,0|2,0,0]=3 933 B8R0.1 CNCCN(C)CCF Amb24751018 [0,1,0,0,0,0|3,0,0]=4 934 B8R0.1 CNCCN(C)CCN Amb24477889 [0,1,0,0,0,0|3,0,0]=4 935 B8R0.1 CNNC(=O)OCCO Amb24733287 [0,1,0,0,0,0|2,0,1]=4 936 B8R0.1 COCC(=O)NCCO Amb25828239 [0,1,0,0,0,0|2,0,1]=4 937 B8R0.1 COCC(=O)OCCC Amb20622000 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.1 COCC(=O)OCCF Amb25204548 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.1 COCC(Br)CCCO Amb25279361 [0,1,0,0,0,0|2,0,0]=3 940 B8R0.1 COCC(C)CCCBr Amb25738991 [0,1,0,0,0,0|3,0,0]=4 941 B8R0.1 COCC(C)CCCCl Amb25843435 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.1 COCC(C)NCCBr Amb25775337 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.1 COCC(C)NCCCl Amb24481593 [0,1,0,0,0,0|3,0,0]=4 944 B8R0.1 COCC(C)NCCI Amb25716610 [0,1,0,0,0,0|3,0,0]=4 945 B8R0.1 COCC(C)NCCN Amb24461777 [0,1,0,0,0,0|3,0,0]=4 946 B8R0.1 COCC(C)OCC#N Amb24702871 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.1 COCC(C)OCCBr Amb24684238 [0,1,0,0,0,0|2,0,0]=3 948 B8R0.1 COCC(C)OCCCl Amb24477848 [0,1,0,0,0,0|2,0,0]=3 949 B8R0.1 COCC(C)SCCCl Amb24712120 [0,1,0,0,0,0|2,1,0]=4 950 B8R0.1 COCC(C)SCCN Amb24618252 [0,1,0,0,0,0|2,1,0]=4 951 B8R0.1 COCC(C)\C=C\CO Amb25212436 [0,1,0,0,0,0|2,0,1]=4 952 B8R0.1 COCC(CCCN)C Amb17569942 [0,1,0,0,0,0|3,0,0]=4 953 B8R0.1 COCC(Cl)OCCC Amb25702149 [0,1,0,0,0,0|2,0,0]=3 954 B8R0.1 COCC(N)CCCN Amb25711548 [0,1,0,0,0,0|3,0,0]=4 955 B8R0.1 COCC(O)CCCBr Amb25211201 [0,1,0,0,0,0|3,0,0]=4 956 B8R0.1 COCC(O)CCCN Amb18203122 [0,1,0,0,0,0|3,0,0]=4 957 B8R0.1 COCCC(=O)CCCl Amb25077222 [0,1,0,0,0,0|3,0,0]=4 958 B8R0.1 COCCC(C)CCCl Amb24524178 [0,1,0,0,0,0|3,0,0]=4 959 B8R0.1 COCCC(C)CCS Amb25741164 [0,1,0,0,0,0|2,1,0]=4 960 B8R0.1 COCCC(CCN)C Amb17569943 [0,1,0,0,0,0|3,0,0]=4 961 B8R0.1 COCCN(C)CCBr Amb18321374 [0,1,0,0,0,0|3,0,0]=4 962 B8R0.1 COCCN(C)CCI Amb25295601 [0,1,0,0,0,0|3,0,0]=4 963 B8R0.1 COCCN(C)CCS Amb25345898 [0,1,0,0,0,0|2,1,0]=4 964 B8R0.1 COCCN(CCCl)C Amb17334318 [0,1,0,0,0,0|3,0,0]=4 965 B8R0.1 COCCN(CCO)C Amb17334138 [0,1,0,0,0,0|2,0,0]=3 966 B8R0.1 COCCS(=O)CCN Amb18787431 [0,1,0,0,0,0|2,1,0]=4 967 B8R0.1 COCOC(=O)CCC Amb24333372 [0,1,0,0,0,0|2,0,1]=4 968 B8R0.1 COCOC(C)CNC Amb25093211 [0,1,0,0,0,0|3,0,0]=4 969 B8R0.1 COCO[C@@H](C)CCO Amb25221423 [0,1,0,0,0,0|3,0,0]=4 970 B8R0.1 COC[C@@H](C)OCC=O Amb25732604 [0,1,0,0,0,0|1,0,2]=4 971 B8R0.1 CSCC(=O)OCCF Amb25260578 [0,1,0,0,0,0|2,0,1]=4 972 B8R0.1 CSCCC(C)CCBr Amb25804494 [0,1,0,0,0,0|3,0,0]=4 973 B8R0.1 CSCCC(C)CCCl Amb24696103 [0,1,0,0,0,0|3,0,0]=4 974 B8R0.1 CSCCN(C)CCBr Amb24368837 [0,1,0,0,0,0|3,0,0]=4 975 B8R0.1 CSCCN(C)CCCl Amb24523015 [0,1,0,0,0,0|3,0,0]=4 976 B8R0.1 CSCCN(C)CCS Amb24659739 [0,1,0,0,0,0|2,1,0]=4 977 B8R0.1 C[C@@H](CCO)CCC=C Amb24429700 [0,1,0,0,0,0|1,0,2]=4 978 B8R0.1 C[C@H](CCO)CCC#C Amb25285581 [0,1,0,0,0,0|1,0,2]=4 979 B8R0.1 C[C@H](CCO)CCC=C Amb25854371 [0,1,0,0,0,0|1,0,2]=4 980 B8R0.1 C\C=C\C(=O)OCCO Amb25332335 [0,1,0,0,0,0|0,0,3]=4 981 B8R0.1 C\C=C\C(C)OCCCl Amb24586075 [0,1,0,0,0,0|1,0,2]=4 982 B8R0.1 C\C=C\CC(Cl)CCO Amb25858125 [0,1,0,0,0,0|1,0,2]=4 983 B8R0.1 ClCCOC(OCC)C Amb10075209 [0,1,0,0,0,0|2,0,0]=3 984 B8R0.1 NC(CCN)CCCN Amb25145974 [0,1,0,0,0,0|3,0,0]=4 985 B8R0.1 NCCC(=O)NCCO Amb21958422 [0,1,0,0,0,0|2,0,1]=4 986 B8R0.1 NCCC(CNCC)C Amb17334119 [0,1,0,0,0,0|3,0,0]=4 987 B8R0.1 NCCC[C@H](N)CCO Amb25733249 [0,1,0,0,0,0|2,0,0]=3 988 B8R0.1 NCCS(=O)CCCO Amb25118035 [0,1,0,0,0,0|2,1,0]=4 989 B8R0.1 NN(CCO)CCC#N Amb18642709 [0,1,0,0,0,0|2,0,1]=4 990 B8R0.1 O=C(CCBr)CCCCl Amb24434557 [0,1,0,0,0,0|3,0,0]=4 991 B8R0.1 OCCC(=O)NCCCl Amb25757022 [0,1,0,0,0,0|3,0,0]=4 992 B8R0.1 OCCC(=O)NCCS Amb25756935 [0,1,0,0,0,0|3,0,0]=4 993 B8R0.1 OCCC(O)CCCBr Amb25101933 [0,1,0,0,0,0|2,0,0]=3 994 B8R0.1 OCCC(O)CCCCl Amb24340183 [0,1,0,0,0,0|2,0,0]=3 995 B8R0.1 OCCC(S)CCCO Amb25787367 [0,1,0,0,0,0|2,0,0]=3 996 B8R0.1 OCCCC(=O)NCC Amb17231872 [0,1,0,0,0,0|2,0,1]=4 997 B8R0.1 OCCNC(=O)CCBr Amb17325574 [0,1,0,0,0,0|2,0,1]=4 998 B8R0.1 OCCNC(=O)CCCl Amb17326981 [0,1,0,0,0,0|2,0,1]=4 999 B8R0.1 OCCNC(=O)CCS Amb24417502 [0,1,0,0,0,0|2,0,1]=4 1000 B8R0.1 OCCSS(=O)CCO Amb24431319 [0,1,0,0,0,0|2,1,0]=4 1001 B8R0.1 OCC[C@@H](O)CCCCl Amb24419218 [0,1,0,0,0,0|2,0,0]=3 1002 B8R0.1 OC\C=C\[C@H](O)CCBr Amb25337720 [0,1,0,0,0,0|2,0,1]=4 1003 B8R0.1 O[C@@H](CCO)CCCO Amb25688554 [0,1,0,0,0,0|2,0,0]=3 1004 B8R0.1 O[C@H](CCO)CCCO Amb25235639 [0,1,0,0,0,0|2,0,0]=3 1005 B8R0.1 [C-]#[N+]CCC(F)CCC Amb24754068 [0,1,0,0,0,0|3,0,0]=4 1006 B8R0.4 BrCCCCCCCBr Amb10069015 [0,1,0,0,0,0|2,0,0]=3 1007 B8R0.4 Br[13CH2][13CH2]CCC[13CH2][13CH2]Br Amb22338937 [0,1,0,0,0,0|2,0,0]=3 1008 B8R0.4 C#CCCCC#CCO Amb24675455 [0,1,0,0,0,0|1,0,2]=4 1009 B8R0.4 C#CCCCCCCCl Amb24671901 [0,1,0,0,0,0|2,0,1]=4 1010 B8R0.4 C#CCCCCCCF Amb25702933 [0,1,0,0,0,0|2,0,1]=4 1011 B8R0.4 C#CCCCNCCF Amb24658448 [0,1,0,0,0,0|2,0,1]=4 1012 B8R0.4 C#CCCNCCCF Amb25849743 [0,1,0,0,0,0|3,0,0]=4 1013 B8R0.4 C#CCCSCCCF Amb24614339 [0,1,0,0,0,0|2,1,0]=4 1014 B8R0.4 C#CCCSCCCO Amb25288000 [0,1,0,0,0,0|0,1,2]=4 1015 B8R0.4 C#CCNCCCCF Amb25810034 [0,1,0,0,0,0|2,0,1]=4 1016 B8R0.4 C#CCNCCCCO Amb25074216 [0,1,0,0,0,0|1,0,2]=4 1017 B8R0.4 C#CCOCCCC=O Amb24456714 [0,1,0,0,0,0|1,0,2]=4 1018 B8R0.4 C#CCOCOCCBr Amb25300271 [0,1,0,0,0,0|1,0,2]=4 1019 B8R0.4 C#CCONCCCF Amb24534719 [0,1,0,0,0,0|2,0,1]=4 1020 B8R0.4 C#CCONCCCO Amb24557041 [0,1,0,0,0,0|2,0,1]=4 1021 B8R0.4 C=CC#CCOCCO Amb25135961 [0,1,0,0,0,0|0,0,3]=4 1022 B8R0.4 C=CCCCCCCN Amb24624098 [0,1,0,0,0,0|2,0,1]=4 1023 B8R0.4 C=CCCCCCCO Amb22230162 [0,1,0,0,0,0|1,0,1]=3 1024 B8R0.4 C=CCCCCCON Amb25297704 [0,1,0,0,0,0|1,0,2]=4 1025 B8R0.4 C=CCCCNCCF Amb25315418 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.4 C=CCCCNCCO Amb25829268 [0,1,0,0,0,0|1,0,1]=3 1027 B8R0.4 C=CCCCOCC#N Amb24700737 [0,1,0,0,0,0|1,0,2]=4 1028 B8R0.4 C=CCCCOCC=O Amb25090845 [0,1,0,0,0,0|0,0,3]=4 1029 B8R0.4 C=CCCCOCCBr Amb25139885 [0,1,0,0,0,0|1,0,1]=3 1030 B8R0.4 C=CCCCOCCCl Amb25303557 [0,1,0,0,0,0|1,0,1]=3 1031 B8R0.4 C=CCCCOCCN Amb25760642 [0,1,0,0,0,0|1,0,1]=3 1032 B8R0.4 C=CCCC\C=C/CO Amb22730735 [0,1,0,0,0,0|1,0,2]=4 1033 B8R0.4 C=CCCC\C=C\CO Amb19930201 [0,1,0,0,0,0|1,0,2]=4 1034 B8R0.4 C=CCCNCCCO Amb24539359 [0,1,0,0,0,0|1,0,2]=4 1035 B8R0.4 C=CCCOCCCN Amb24524292 [0,1,0,0,0,0|2,0,0]=3 1036 B8R0.4 C=CCCSCCCN Amb25695163 [0,1,0,0,0,0|2,1,0]=4 1037 B8R0.4 C=CCCSCCCO Amb24729883 [0,1,0,0,0,0|0,1,2]=4 1038 B8R0.4 C=CCNCCCCBr Amb24585821 [0,1,0,0,0,0|2,0,1]=4 1039 B8R0.4 C=CCONCCCF Amb24557505 [0,1,0,0,0,0|2,0,1]=4 1040 B8R0.4 C=CCSCCCCO Amb25115168 [0,1,0,0,0,0|1,0,2]=4 1041 B8R0.4 C=CCSCCCCS Amb24502217 [0,1,0,0,0,0|1,1,1]=4 1042 B8R0.4 C=COCCCCCO Amb24420140 [0,1,0,0,0,0|1,0,2]=4 1043 B8R0.4 C=COCCNCCO Amb25074856 [0,1,0,0,0,0|1,0,2]=4 1044 B8R0.4 C=COCCOCCBr Amb24588010 [0,1,0,0,0,0|1,0,2]=4 1045 B8R0.4 C=COCCOCCCl Amb24683149 [0,1,0,0,0,0|1,0,2]=4 1046 B8R0.4 C=COCCOCCO Amb22230541 [0,1,0,0,0,0|0,0,2]=3 1047 B8R0.4 C=CSCCOCCCl Amb25145952 [0,1,0,0,0,0|1,0,2]=4 1048 B8R0.4 CC#CCCCCCBr Amb24627162 [0,1,0,0,0,0|2,0,1]=4 1049 B8R0.4 CC#CCCCCCCl Amb25107849 [0,1,0,0,0,0|2,0,1]=4 1050 B8R0.4 CC#CCCNCCC Amb25300934 [0,1,0,0,0,0|2,0,1]=4 1051 B8R0.4 CC#CCCNCCF Amb25286920 [0,1,0,0,0,0|2,0,1]=4 1052 B8R0.4 CC#CCCOCCN Amb24384058 [0,1,0,0,0,0|1,0,1]=3 1053 B8R0.4 CC#CCNCCCC Amb21953812 [0,1,0,0,0,0|2,0,1]=4 1054 B8R0.4 CC#CCNCCCO Amb25195879 [0,1,0,0,0,0|1,0,2]=4 1055 B8R0.4 CC#CCNCCOC Amb25700873 [0,1,0,0,0,0|1,0,2]=4 1056 B8R0.4 CC#CCNOCCC Amb25300543 [0,1,0,0,0,0|1,0,2]=4 1057 B8R0.4 CC=C=CCCCCO Amb25334666 [0,1,0,0,0,0|1,0,2]=4 1058 B8R0.4 CCC#CCCCCBr Amb25779174 [0,1,0,0,0,0|2,0,1]=4 1059 B8R0.4 CCC#CC\C=C\CO Amb24617242 [0,1,0,0,0,0|1,0,2]=4 1060 B8R0.4 CCCC#CCCC=O Amb25218856 [0,1,0,0,0,0|1,0,2]=4 1061 B8R0.4 CCCC#CCCCCl Amb22227925 [0,1,0,0,0,0|2,0,1]=4 1062 B8R0.4 CCCC#CCCCO Amb24411272 [0,1,0,0,0,0|1,0,1]=3 1063 B8R0.4 CCCC#C\C=C/CO Amb10563780 [0,1,0,0,0,0|1,0,2]=4 1064 B8R0.4 CCCC#C\C=C\CO Amb25358310 [0,1,0,0,0,0|1,0,2]=4 1065 B8R0.4 CCCC/C=C/OCC Amb17674075 [0,1,0,0,0,0|2,0,1]=4 1066 B8R0.4 CCCC=C=CCCO Amb17593316 [0,1,0,0,0,0|1,0,1]=3 1067 B8R0.4 CCCC=NCCCC Amb19375587 [0,1,0,0,0,0|2,0,0]=3 1068 B8R0.4 CCCC=NNCCC Amb25662299 [0,1,0,0,0,0|2,0,1]=4 1069 B8R0.4 CCCC=NNCCO Amb25129041 [0,1,0,0,0,0|1,0,1]=3 1070 B8R0.4 CCCC=NOCCO Amb24577318 [0,1,0,0,0,0|0,0,1]=2 1071 B8R0.4 CCCCC#CCC#C Amb17670550 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.4 CCCCC#CCC#N Amb17593239 [0,1,0,0,0,0|2,0,1]=4 1073 B8R0.4 CCCCC#CCC=C Amb22228000 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.4 CCCCC#CCC=O Amb25347288 [0,1,0,0,0,0|1,0,2]=4 1075 B8R0.4 CCCCC#CCCBr Amb25279523 [0,1,0,0,0,0|2,0,0]=3 1076 B8R0.4 CCCCC#CCNC Amb24653768 [0,1,0,0,0,0|2,0,1]=4 1077 B8R0.4 CCCCC/C=C/CBr Amb17666913 [0,1,0,0,0,0|2,0,1]=4 1078 B8R0.4 CCCCC=C=CCN Amb25800377 [0,1,0,0,0,0|2,0,1]=4 1079 B8R0.4 CCCCC=NCCO Amb24617415 [0,1,0,0,0,0|1,0,0]=2 1080 B8R0.4 CCCCCC#CCN Amb25733384 [0,1,0,0,0,0|2,0,1]=4 1081 B8R0.4 CCCCCC/C=N/O Amb17672299 [0,1,0,0,0,0|1,0,1]=3 1082 B8R0.4 CCCCCCC=NO Amb25278553 [0,1,0,0,0,0|1,0,1]=3 1083 B8R0.4 CCCCCCCCF Amb10840379 [0,1,0,0,0,0|2,0,0]=3 1084 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [0,1,0,0,0,0|2,0,0]=3 1085 B8R0.4 CCCCCCCOC Amb24584912 [0,1,0,0,0,0|1,0,0]=2 1086 B8R0.4 CCCCCCCSC Amb22359861 [0,1,0,0,0,0|1,1,0]=3 1087 B8R0.4 CCCCCCC[13CH2]O Amb22367456 [0,1,0,0,0,0|1,0,0]=2 1088 B8R0.4 CCCCCCC[Hg]Cl Amb22359872 [0,1,0,0,0,0|2,0,0]=3 1089 B8R0.4 CCCCCCC[Zn]Br Amb22000462 [0,1,0,0,0,0|2,0,0]=3 1090 B8R0.4 CCCCCCN=[N+]=[N-] Amb17939436 [0,1,0,0,0,0|3,0,0]=4 1091 B8R0.4 CCCCCCNC#N Amb25146030 [0,1,0,0,0,0|2,0,1]=4 1092 B8R0.4 CCCCCCOC=C Amb24440550 [0,1,0,0,0,0|2,0,1]=4 1093 B8R0.4 CCCCCCOCC Amb17672946 [0,1,0,0,0,0|2,0,0]=3 1094 B8R0.4 CCCCCCON=O Amb17672945 [0,1,0,0,0,0|2,0,1]=4 1095 B8R0.4 CCCCCCSCCl Amb24340125 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.4 CCCCCCSN=O Amb24596500 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.4 CCCCCC\C=C\Br Amb24677708 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.4 CCCCCC\C=C\Cl Amb24697939 [0,1,0,0,0,0|2,0,1]=4 1099 B8R0.4 CCCCCC\C=C\I Amb24446897 [0,1,0,0,0,0|2,0,1]=4 1100 B8R0.4 CCCCCNCCBr Amb25704979 [0,1,0,0,0,0|2,0,0]=3 1101 B8R0.4 CCCCCNCCCl Amb17334288 [0,1,0,0,0,0|2,0,0]=3 1102 B8R0.4 CCCCCNCCF Amb25823944 [0,1,0,0,0,0|2,0,0]=3 1103 B8R0.4 CCCCCNCCN Amb17091049 [0,1,0,0,0,0|2,0,0]=3 1104 B8R0.4 CCCCCOCC=C Amb22230169 [0,1,0,0,0,0|1,0,1]=3 1105 B8R0.4 CCCCCOCCO Amb22264988 [0,1,0,0,0,0|0,0,0]=1 1106 B8R0.4 CCCCCSCC#N Amb17501740 [0,1,0,0,0,0|1,1,1]=4 1107 B8R0.4 CCCCCSCC=O Amb25113339 [0,1,0,0,0,0|0,1,2]=4 1108 B8R0.4 CCCCCSCCBr Amb24585826 [0,1,0,0,0,0|1,1,0]=3 1109 B8R0.4 CCCCCSCCF Amb25855641 [0,1,0,0,0,0|1,1,0]=3 1110 B8R0.4 CCCCCSCCO Amb1032987 [0,1,0,0,0,0|0,1,0]=2 1111 B8R0.4 CCCCCSCCS Amb25073889 [0,1,0,0,0,0|0,2,0]=3 1112 B8R0.4 CCCCC\C=C/CC Amb22730456 [0,1,0,0,0,0|2,0,1]=4 1113 B8R0.4 CCCCC\C=C\CCl Amb24597697 [0,1,0,0,0,0|2,0,1]=4 1114 B8R0.4 CCCCC\C=C\CN Amb18642556 [0,1,0,0,0,0|2,0,1]=4 1115 B8R0.4 CCCCNCCC=C Amb25227693 [0,1,0,0,0,0|2,0,0]=3 1116 B8R0.4 CCCCNCCCC Amb22345928 [0,1,0,0,0,0|2,0,0]=3 1117 B8R0.4 CCCCNCCCC Amb22348285 [0,1,0,0,0,0|2,0,0]=3 1118 B8R0.4 CCCCNCCCC Amb22359463 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.4 CCCCNCCCC Amb22492441 [0,1,0,0,0,0|2,0,0]=3 1120 B8R0.4 CCCCNCCCCl Amb24529030 [0,1,0,0,0,0|2,0,0]=3 1121 B8R0.4 CCCCNCCCF Amb24731196 [0,1,0,0,0,0|2,0,0]=3 1122 B8R0.4 CCCCNCCCI Amb24437378 [0,1,0,0,0,0|2,0,0]=3 1123 B8R0.4 CCCCNCCCN Amb17315267 [0,1,0,0,0,0|2,0,0]=3 1124 B8R0.4 CCCCNCCCS Amb24495088 [0,1,0,0,0,0|1,1,0]=3 1125 B8R0.4 CCCCNCCSC Amb25136494 [0,1,0,0,0,0|1,1,0]=3 1126 B8R0.4 CCCCNCNC=O Amb25728066 [0,1,0,0,0,0|1,0,2]=4 1127 B8R0.4 CCCCNC\C=C/Br Amb24677760 [0,1,0,0,0,0|2,0,1]=4 1128 B8R0.4 CCCCNOCC#C Amb25682719 [0,1,0,0,0,0|1,0,1]=3 1129 B8R0.4 CCCCOC#CCO Amb24412999 [0,1,0,0,0,0|0,0,1]=2 1130 B8R0.4 CCCCOCCCC Amb22336200 [0,1,0,0,0,0|1,0,0]=2 1131 B8R0.4 CCCCOCCCO Amb20076068 [0,1,0,0,0,0|0,0,0]=1 1132 B8R0.4 CCCCOCCNC Amb24576762 [0,1,0,0,0,0|1,0,0]=2 1133 B8R0.4 CCCCOC\C=C\Cl Amb24480196 [0,1,0,0,0,0|1,0,1]=3 1134 B8R0.4 CCCCO\C=C\C=O Amb24480362 [0,1,0,0,0,0|0,0,3]=4 1135 B8R0.4 CCCCPCCCC Amb22730293 [0,1,0,0,0,0|2,0,0]=3 1136 B8R0.4 CCCCSCCC#C Amb24439845 [0,1,0,0,0,0|1,1,0]=3 1137 B8R0.4 CCCCSCCC=O Amb24729974 [0,1,0,0,0,0|0,1,1]=3 1138 B8R0.4 CCCCSCCNC Amb25773539 [0,1,0,0,0,0|1,1,0]=3 1139 B8R0.4 CCCCSC\C=C\Cl Amb25765695 [0,1,0,0,0,0|1,1,1]=4 1140 B8R0.4 CCCCSSCCN Amb25684685 [0,1,0,0,0,0|1,1,0]=3 1141 B8R0.4 CCCC[GeH2]CCCC Amb19930254 [0,1,0,0,0,0|2,0,0]=3 1142 B8R0.4 CCCC[Hg]CCCC Amb22732587 [0,1,0,0,0,0|2,0,0]=3 1143 B8R0.4 CCCC[NH2+]CCCC Amb21618855 [0,1,0,0,0,0|2,0,0]=3 1144 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [0,1,0,0,0,0|2,0,0]=3 1145 B8R0.4 CCCC[NH2+]CCCC Amb24635697 [0,1,0,0,0,0|2,0,0]=3 1146 B8R0.4 CCCC[Sn+2]CCCC Amb19883848 [0,1,0,0,0,0|2,0,0]=3 1147 B8R0.4 CCCC[Sn+2]CCCC Amb22045422 [0,1,0,0,0,0|2,0,0]=3 1148 B8R0.4 CCCC[Sn+2]CCCC Amb22045423 [0,1,0,0,0,0|2,0,0]=3 1149 B8R0.4 CCCC[Sn+2]CCCC Amb22045571 [0,1,0,0,0,0|2,0,0]=3 1150 B8R0.4 CCCC[Sn+2]CCCC Amb22057358 [0,1,0,0,0,0|2,0,0]=3 1151 B8R0.4 CCCC[Sn+2]CCCC Amb22057359 [0,1,0,0,0,0|2,0,0]=3 1152 B8R0.4 CCCC[Sn+2]CCCC Amb22167917 [0,1,0,0,0,0|2,0,0]=3 1153 B8R0.4 CCCC[Sn+2]CCCC Amb22461722 [0,1,0,0,0,0|2,0,0]=3 1154 B8R0.4 CCCC[Sn+2]CCCC Amb22730053 [0,1,0,0,0,0|2,0,0]=3 1155 B8R0.4 CCCC[Sn+2]CCCC Amb22730674 [0,1,0,0,0,0|2,0,0]=3 1156 B8R0.4 CCCC[Te]CCCC Amb22731634 [0,1,0,0,0,0|1,1,0]=3 1157 B8R0.4 CCCC[Zn]CCCC Amb22230526 [0,1,0,0,0,0|2,0,0]=3 1158 B8R0.4 CCCC\C=C\CC=O Amb18642464 [0,1,0,0,0,0|1,0,2]=4 1159 B8R0.4 CCCC\C=C\CCBr Amb24657192 [0,1,0,0,0,0|2,0,0]=3 1160 B8R0.4 CCCC\C=C\CCCl Amb25219336 [0,1,0,0,0,0|2,0,0]=3 1161 B8R0.4 CCCNC=NCCC Amb25146185 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.4 CCCNCCC#CO Amb24762142 [0,1,0,0,0,0|1,0,2]=4 1163 B8R0.4 CCCNCCCC=C Amb24415921 [0,1,0,0,0,0|2,0,1]=4 1164 B8R0.4 CCCNCCCCBr Amb24680860 [0,1,0,0,0,0|2,0,0]=3 1165 B8R0.4 CCCNCCCCCl Amb24716486 [0,1,0,0,0,0|2,0,0]=3 1166 B8R0.4 CCCNCCCCN Amb17334115 [0,1,0,0,0,0|2,0,0]=3 1167 B8R0.4 CCCNCCCCN Amb22292473 [0,1,0,0,0,0|2,0,0]=3 1168 B8R0.4 CCCNCCCCO Amb17334128 [0,1,0,0,0,0|1,0,0]=2 1169 B8R0.4 CCCNC\C=C\CCl Amb25337395 [0,1,0,0,0,0|2,0,1]=4 1170 B8R0.4 CCCNC\C=C\CN Amb22346358 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.4 CCCOCCCCCl Amb18181651 [0,1,0,0,0,0|1,0,0]=2 1172 B8R0.4 CCCOCCCCS Amb24576349 [0,1,0,0,0,0|1,0,0]=2 1173 B8R0.4 CCCOCCCNC Amb20076071 [0,1,0,0,0,0|1,0,0]=2 1174 B8R0.4 CCCOCCN=C=O Amb24694071 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.4 CCCOCCN=[N+]=[N-] Amb24598878 [0,1,0,0,0,0|3,0,0]=4 1176 B8R0.4 CCCOCCOC=C Amb25032267 [0,1,0,0,0,0|1,0,2]=4 1177 B8R0.4 CCCOCOCCC Amb22230733 [0,1,0,0,0,0|1,0,0]=2 1178 B8R0.4 CCCOC\C=C\CN Amb24523082 [0,1,0,0,0,0|1,0,2]=4 1179 B8R0.4 CCCONCCC#C Amb25834641 [0,1,0,0,0,0|1,0,2]=4 1180 B8R0.4 CCCONCCC#N Amb25031190 [0,1,0,0,0,0|2,0,1]=4 1181 B8R0.4 CCCONCCCF Amb25290116 [0,1,0,0,0,0|2,0,0]=3 1182 B8R0.4 CCCONCCCN Amb25045018 [0,1,0,0,0,0|2,0,0]=3 1183 B8R0.4 CCCONCCCO Amb25765340 [0,1,0,0,0,0|2,0,0]=3 1184 B8R0.4 CCCONCCSC Amb25275455 [0,1,0,0,0,0|2,0,0]=3 1185 B8R0.4 CCCO[CH+]OCCC Amb24498860 [0,1,0,0,0,0|1,0,1]=3 1186 B8R0.4 CCCSCCCCC Amb24414704 [0,1,0,0,0,0|1,1,0]=3 1187 B8R0.4 CCCSCCCCCl Amb18798739 [0,1,0,0,0,0|1,1,0]=3 1188 B8R0.4 CCCSCCCCF Amb24544284 [0,1,0,0,0,0|1,1,0]=3 1189 B8R0.4 CCCSCCCNC Amb25247739 [0,1,0,0,0,0|1,1,0]=3 1190 B8R0.4 CCCSCCNCC Amb25301078 [0,1,0,0,0,0|1,1,0]=3 1191 B8R0.4 CCCSC\C=C\CCl Amb25355163 [0,1,0,0,0,0|2,0,1]=4 1192 B8R0.4 CCCSC\C=C\CO Amb24397965 [0,1,0,0,0,0|1,0,1]=3 1193 B8R0.4 CCCSC\C=C\CS Amb24475880 [0,1,0,0,0,0|1,1,1]=4 1194 B8R0.4 CCCSSSCCC Amb22002286 [0,1,0,0,0,0|2,1,0]=4 1195 B8R0.4 CCC\C=C/CCC=O Amb18642474 [0,1,0,0,0,0|1,0,2]=4 1196 B8R0.4 CCC\C=C\C=CCO Amb24539762 [0,1,0,0,0,0|1,0,2]=4 1197 B8R0.4 CCC\C=C\C=C\CO Amb22053869 [0,1,0,0,0,0|1,0,2]=4 1198 B8R0.4 CCC\C=C\CCC=O Amb24557533 [0,1,0,0,0,0|1,0,2]=4 1199 B8R0.4 CCC\C=C\CCCCl Amb24524162 [0,1,0,0,0,0|2,0,1]=4 1200 B8R0.4 CCC\C=C\COCCl Amb24703636 [0,1,0,0,0,0|2,0,1]=4 1201 B8R0.4 CCNCCCCC#C Amb25300073 [0,1,0,0,0,0|2,0,1]=4 1202 B8R0.4 CCNCCCCCBr Amb24481816 [0,1,0,0,0,0|2,0,0]=3 1203 B8R0.4 CCNCCCCCCl Amb25763601 [0,1,0,0,0,0|2,0,0]=3 1204 B8R0.4 CCNCCCNCC Amb20171936 [0,1,0,0,0,0|3,0,0]=4 1205 B8R0.4 CCNCCNCC#C Amb24620209 [0,1,0,0,0,0|2,0,1]=4 1206 B8R0.4 CCNCCNCCO Amb24655245 [0,1,0,0,0,0|1,0,0]=2 1207 B8R0.4 CCNCCOCC#N Amb24701735 [0,1,0,0,0,0|1,0,1]=3 1208 B8R0.4 CCNCCOCC=C Amb25237110 [0,1,0,0,0,0|1,0,1]=3 1209 B8R0.4 CCNCCOCCCl Amb25147049 [0,1,0,0,0,0|1,0,0]=2 1210 B8R0.4 CCNCCOCCF Amb24417405 [0,1,0,0,0,0|1,0,0]=2 1211 B8R0.4 CCNCCOCCN Amb25305457 [0,1,0,0,0,0|1,0,0]=2 1212 B8R0.4 CCNCCSCC=C Amb24619294 [0,1,0,0,0,0|1,1,1]=4 1213 B8R0.4 CCOCC#CCCO Amb25761802 [0,1,0,0,0,0|1,0,1]=3 1214 B8R0.4 CCOCCC#CCO Amb24466176 [0,1,0,0,0,0|1,0,1]=3 1215 B8R0.4 CCOCCCCC#N Amb25180565 [0,1,0,0,0,0|2,0,1]=4 1216 B8R0.4 CCOCCCCCBr Amb24502334 [0,1,0,0,0,0|2,0,0]=3 1217 B8R0.4 CCOCCCCCN Amb24554979 [0,1,0,0,0,0|2,0,0]=3 1218 B8R0.4 CCOCCCCCO Amb25147185 [0,1,0,0,0,0|1,0,0]=2 1219 B8R0.4 CCOCCCOCC Amb25833519 [0,1,0,0,0,0|3,0,0]=4 1220 B8R0.4 CCOCCCOCCl Amb25202595 [0,1,0,0,0,0|3,0,0]=4 1221 B8R0.4 CCOCCNCCF Amb24529056 [0,1,0,0,0,0|2,0,0]=3 1222 B8R0.4 CCOCCNCCI Amb25246079 [0,1,0,0,0,0|2,0,0]=3 1223 B8R0.4 CCOCCOCC=O Amb24052109 [0,1,0,0,0,0|0,0,2]=3 1224 B8R0.4 CCOCCOCCS Amb24532882 [0,1,0,0,0,0|0,1,0]=2 1225 B8R0.4 CCOCCSCC#N Amb24721389 [0,1,0,0,0,0|1,1,1]=4 1226 B8R0.4 CCOCCSCCCl Amb24560923 [0,1,0,0,0,0|1,1,0]=3 1227 B8R0.4 CCOCOCCCN Amb24633755 [0,1,0,0,0,0|2,0,0]=3 1228 B8R0.4 CCOCOCCCO Amb24657482 [0,1,0,0,0,0|1,0,0]=2 1229 B8R0.4 CCOCOCCNC Amb24614346 [0,1,0,0,0,0|2,0,0]=3 1230 B8R0.4 CCOC\C=C\CCCl Amb25351362 [0,1,0,0,0,0|2,0,1]=4 1231 B8R0.4 CCOC\C=C\CCN Amb25351322 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.4 CCON=CCCCO Amb25108391 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.4 CCSC#CSCCO Amb25206495 [0,1,0,0,0,0|0,1,2]=4 1234 B8R0.4 CCSCC#CCOC Amb24631784 [0,1,0,0,0,0|2,0,1]=4 1235 B8R0.4 CCSCCCCC#N Amb25121746 [0,1,0,0,0,0|2,0,1]=4 1236 B8R0.4 CCSCCCCC=O Amb24690525 [0,1,0,0,0,0|1,0,2]=4 1237 B8R0.4 CCSCCCCCO Amb24501753 [0,1,0,0,0,0|1,0,0]=2 1238 B8R0.4 CCSCCCNOC Amb24448478 [0,1,0,0,0,0|3,0,0]=4 1239 B8R0.4 CCSCCNCC#C Amb25046580 [0,1,0,0,0,0|2,0,1]=4 1240 B8R0.4 CCSCCNCC=C Amb25690607 [0,1,0,0,0,0|2,0,1]=4 1241 B8R0.4 CCSCCNCCCl Amb24643441 [0,1,0,0,0,0|2,0,0]=3 1242 B8R0.4 CCSCCNCCI Amb24554305 [0,1,0,0,0,0|2,0,0]=3 1243 B8R0.4 CCSCCNCCN Amb25718208 [0,1,0,0,0,0|2,0,0]=3 1244 B8R0.4 CCSCCNCCS Amb25080999 [0,1,0,0,0,0|1,1,0]=3 1245 B8R0.4 CCSCCNOCC Amb25369831 [0,1,0,0,0,0|3,0,0]=4 1246 B8R0.4 CCSCCSCC=C Amb25318354 [0,1,0,0,0,0|1,1,1]=4 1247 B8R0.4 CCSCCSCC=O Amb25733396 [0,1,0,0,0,0|0,1,2]=4 1248 B8R0.4 CCSCCSCCC Amb25317114 [0,1,0,0,0,0|1,1,0]=3 1249 B8R0.4 CCSCCSCCCl Amb25701531 [0,1,0,0,0,0|1,1,0]=3 1250 B8R0.4 CCSCCSCOC Amb25358527 [0,1,0,0,0,0|2,1,0]=4 1251 B8R0.4 CC\C=C/CCCCBr Amb24480222 [0,1,0,0,0,0|2,0,1]=4 1252 B8R0.4 CC\C=C/CCCCC Amb25258581 [0,1,0,0,0,0|2,0,1]=4 1253 B8R0.4 CC\C=C/CCCCCl Amb24361654 [0,1,0,0,0,0|2,0,1]=4 1254 B8R0.4 CC\C=C/CCCCO Amb22052636 [0,1,0,0,0,0|1,0,1]=3 1255 B8R0.4 CC\C=C\C=CCCO Amb24576345 [0,1,0,0,0,0|1,0,2]=4 1256 B8R0.4 CC\C=C\CC=CCO Amb24332902 [0,1,0,0,0,0|1,0,2]=4 1257 B8R0.4 CC\C=C\CCCCC Amb22347893 [0,1,0,0,0,0|2,0,1]=4 1258 B8R0.4 CC\C=C\CCCCN Amb25274450 [0,1,0,0,0,0|2,0,1]=4 1259 B8R0.4 CC\C=C\COCC=O Amb24729316 [0,1,0,0,0,0|0,0,3]=4 1260 B8R0.4 CC\C=C\COCCBr Amb24693864 [0,1,0,0,0,0|1,0,1]=3 1261 B8R0.4 CC\C=C\COCCO Amb25741444 [0,1,0,0,0,0|0,0,1]=2 1262 B8R0.4 CN=NCCCCCO Amb24386957 [0,1,0,0,0,0|2,0,0]=3 1263 B8R0.4 CNCC#CCCCO Amb24624881 [0,1,0,0,0,0|1,0,2]=4 1264 B8R0.4 CNCCCCCC#C Amb25235215 [0,1,0,0,0,0|2,0,1]=4 1265 B8R0.4 CNCCCCCC=C Amb19335339 [0,1,0,0,0,0|2,0,1]=4 1266 B8R0.4 CNCCCCCCBr Amb22490952 [0,1,0,0,0,0|2,0,0]=3 1267 B8R0.4 CNCCCCCCCl Amb25268862 [0,1,0,0,0,0|2,0,0]=3 1268 B8R0.4 CNCCCCCCI Amb24589544 [0,1,0,0,0,0|2,0,0]=3 1269 B8R0.4 CNCCCCCCN Amb22641938 [0,1,0,0,0,0|2,0,0]=3 1270 B8R0.4 CNCCCCCNC Amb24532836 [0,1,0,0,0,0|3,0,0]=4 1271 B8R0.4 CNCCCCCOC Amb17569940 [0,1,0,0,0,0|2,0,0]=3 1272 B8R0.4 CNCCCCCSC Amb24726675 [0,1,0,0,0,0|2,1,0]=4 1273 B8R0.4 CNCCCCNCC Amb25749667 [0,1,0,0,0,0|3,0,0]=4 1274 B8R0.4 CNCCCNCCBr Amb25101516 [0,1,0,0,0,0|2,0,0]=3 1275 B8R0.4 CNCCCNCCC Amb20171971 [0,1,0,0,0,0|2,0,0]=3 1276 B8R0.4 CNCCCNCCC Amb22292472 [0,1,0,0,0,0|2,0,0]=3 1277 B8R0.4 CNCCCNCCS Amb25146120 [0,1,0,0,0,0|1,1,0]=3 1278 B8R0.4 CNCCCOCCCl Amb25715021 [0,1,0,0,0,0|1,0,0]=2 1279 B8R0.4 CNCCCSCCN Amb25676093 [0,1,0,0,0,0|1,1,0]=3 1280 B8R0.4 CNCCCSCCO Amb24460307 [0,1,0,0,0,0|0,1,0]=2 1281 B8R0.4 CNCCNCCC=C Amb24481594 [0,1,0,0,0,0|3,0,0]=4 1282 B8R0.4 CNCCNCCCN Amb25745595 [0,1,0,0,0,0|3,0,0]=4 1283 B8R0.4 CNCCNCCOC Amb19966131 [0,1,0,0,0,0|2,0,0]=3 1284 B8R0.4 CNCCOCCC#C Amb24702872 [0,1,0,0,0,0|2,0,0]=3 1285 B8R0.4 CNCCOCCCO Amb24423409 [0,1,0,0,0,0|1,0,0]=2 1286 B8R0.4 CNCCOCCNC Amb2583286 [0,1,0,0,0,0|2,0,0]=3 1287 B8R0.4 CNCCOCCSC Amb24700675 [0,1,0,0,0,0|1,1,0]=3 1288 B8R0.4 CNCCOC\C=C\Cl Amb24471837 [0,1,0,0,0,0|2,0,1]=4 1289 B8R0.4 CNCCSCCC#N Amb25309982 [0,1,0,0,0,0|2,1,0]=4 1290 B8R0.4 CNCCSCCC=C Amb25337782 [0,1,0,0,0,0|2,1,0]=4 1291 B8R0.4 CNCCSCCCO Amb24423733 [0,1,0,0,0,0|1,1,0]=3 1292 B8R0.4 CNCCSCCNC Amb25810328 [0,1,0,0,0,0|2,1,0]=4 1293 B8R0.4 CNCCSCCON Amb25180197 [0,1,0,0,0,0|1,1,0]=3 1294 B8R0.4 CNN=CCCCCO Amb25713247 [0,1,0,0,0,0|2,0,1]=4 1295 B8R0.4 CNOCCOCCO Amb25792320 [0,1,0,0,0,0|1,0,0]=2 1296 B8R0.4 COCCCC#CCO Amb24644611 [0,1,0,0,0,0|1,0,1]=3 1297 B8R0.4 COCCCCCCCl Amb18180174 [0,1,0,0,0,0|2,0,0]=3 1298 B8R0.4 COCCCCCCS Amb25024968 [0,1,0,0,0,0|1,1,0]=3 1299 B8R0.4 COCCCCCOC Amb22348093 [0,1,0,0,0,0|2,0,0]=3 1300 B8R0.4 COCCCCCSC Amb24476453 [0,1,0,0,0,0|2,0,0]=3 1301 B8R0.4 COCCCNCC#C Amb17308607 [0,1,0,0,0,0|2,0,1]=4 1302 B8R0.4 COCCCNCC=C Amb17231858 [0,1,0,0,0,0|2,0,1]=4 1303 B8R0.4 COCCCNCCBr Amb24481808 [0,1,0,0,0,0|2,0,0]=3 1304 B8R0.4 COCCCNCCCl Amb17334317 [0,1,0,0,0,0|2,0,0]=3 1305 B8R0.4 COCCCNCCI Amb25688858 [0,1,0,0,0,0|2,0,0]=3 1306 B8R0.4 COCCCNCCN Amb17091021 [0,1,0,0,0,0|2,0,0]=3 1307 B8R0.4 COCCCNCCS Amb24600648 [0,1,0,0,0,0|1,1,0]=3 1308 B8R0.4 COCCCOCCBr Amb19053952 [0,1,0,0,0,0|1,0,0]=2 1309 B8R0.4 COCCCOCCCl Amb18177244 [0,1,0,0,0,0|1,0,0]=2 1310 B8R0.4 COCCCOCCS Amb25832827 [0,1,0,0,0,0|0,1,0]=2 1311 B8R0.4 COCCCSCC#C Amb24618122 [0,1,0,0,0,0|1,1,1]=4 1312 B8R0.4 COCCCSCC=C Amb25845823 [0,1,0,0,0,0|1,1,1]=4 1313 B8R0.4 COCCCSCCO Amb18179362 [0,1,0,0,0,0|0,1,0]=2 1314 B8R0.4 COCCC\C=C\CCl Amb24746059 [0,1,0,0,0,0|2,0,1]=4 1315 B8R0.4 COCCNCCC#N Amb19960058 [0,1,0,0,0,0|2,0,1]=4 1316 B8R0.4 COCCNCCC=C Amb22504625 [0,1,0,0,0,0|1,0,2]=4 1317 B8R0.4 COCCNCCCBr Amb24590028 [0,1,0,0,0,0|2,0,0]=3 1318 B8R0.4 COCCNCCCCl Amb24676185 [0,1,0,0,0,0|2,0,0]=3 1319 B8R0.4 COCCNOCC#C Amb25355418 [0,1,0,0,0,0|2,0,1]=4 1320 B8R0.4 COCCNOCCC Amb25349547 [0,1,0,0,0,0|2,0,0]=3 1321 B8R0.4 COCCOCCCI Amb25662267 [0,1,0,0,0,0|1,0,0]=2 1322 B8R0.4 COCCOCCNC Amb25691167 [0,1,0,0,0,0|1,0,0]=2 1323 B8R0.4 COCCOCCNN Amb24458000 [0,1,0,0,0,0|2,0,0]=3 1324 B8R0.4 COCCOCCNO Amb24481939 [0,1,0,0,0,0|1,0,0]=2 1325 B8R0.4 COCCOCCOC Amb22338385 [0,1,0,0,0,0|1,0,0]=2 1326 B8R0.4 COCCOCCON Amb25369730 [0,1,0,0,0,0|1,0,0]=2 1327 B8R0.4 COCCOCCS=O Amb25366417 [0,1,0,0,0,0|1,0,1]=3 1328 B8R0.4 COCCOCN=C=O Amb25330276 [0,1,0,0,0,0|1,0,2]=4 1329 B8R0.4 COCCOCOCCl Amb25844560 [0,1,0,0,0,0|2,0,0]=3 1330 B8R0.4 COCCONCCC Amb25346861 [0,1,0,0,0,0|1,0,0]=2 1331 B8R0.4 COCCONCCN Amb24561578 [0,1,0,0,0,0|2,0,0]=3 1332 B8R0.4 COCCSCCC=C Amb25795287 [0,1,0,0,0,0|0,1,2]=4 1333 B8R0.4 COCCSCCNN Amb23538349 [0,1,0,0,0,0|2,1,0]=4 1334 B8R0.4 COCCSCCOC Amb25763432 [0,1,0,0,0,0|1,1,0]=3 1335 B8R0.4 COCOCC#CCO Amb25221111 [0,1,0,0,0,0|2,0,1]=4 1336 B8R0.4 COCOCCCCBr Amb25111196 [0,1,0,0,0,0|2,0,0]=3 1337 B8R0.4 COCOCCCCCl Amb22641569 [0,1,0,0,0,0|2,0,0]=3 1338 B8R0.4 COCOCCCCN Amb25233925 [0,1,0,0,0,0|2,0,0]=3 1339 B8R0.4 COCOCCNCC Amb24634849 [0,1,0,0,0,0|2,0,0]=3 1340 B8R0.4 COCOCOCOC Amb22728072 [0,1,0,0,0,0|3,0,0]=4 1341 B8R0.4 COCOC\C=C\CO Amb24671466 [0,1,0,0,0,0|2,0,1]=4 1342 B8R0.4 COCSCCOCC Amb25143113 [0,1,0,0,0,0|2,1,0]=4 1343 B8R0.4 COC\C=C\CCCO Amb25080571 [0,1,0,0,0,0|1,0,2]=4 1344 B8R0.4 CON=CCNCCO Amb25216495 [0,1,0,0,0,0|2,0,1]=4 1345 B8R0.4 CONCCCCCF Amb24710549 [0,1,0,0,0,0|3,0,0]=4 1346 B8R0.4 CONCCCOCC Amb25837325 [0,1,0,0,0,0|3,0,0]=4 1347 B8R0.4 CPCCNCCPC Amb25301318 [0,1,0,0,0,0|3,0,0]=4 1348 B8R0.4 CSCCCCCCCl Amb18805477 [0,1,0,0,0,0|2,0,0]=3 1349 B8R0.4 CSCCCCCCN Amb24532830 [0,1,0,0,0,0|2,0,0]=3 1350 B8R0.4 CSCCCCCCO Amb22367888 [0,1,0,0,0,0|1,0,0]=2 1351 B8R0.4 CSCCCNCC#N Amb25141749 [0,1,0,0,0,0|2,0,1]=4 1352 B8R0.4 CSCCCNCCS Amb24476749 [0,1,0,0,0,0|1,1,0]=3 1353 B8R0.4 CSCCCOCCBr Amb24572507 [0,1,0,0,0,0|1,0,0]=2 1354 B8R0.4 CSCCCOCCN Amb25691931 [0,1,0,0,0,0|1,0,0]=2 1355 B8R0.4 CSCCCSCC#C Amb24504342 [0,1,0,0,0,0|1,1,1]=4 1356 B8R0.4 CSCCCSCC#N Amb24476752 [0,1,0,0,0,0|1,1,1]=4 1357 B8R0.4 CSCCCSCC=O Amb25755822 [0,1,0,0,0,0|0,1,2]=4 1358 B8R0.4 CSCCCSCCC Amb25686129 [0,1,0,0,0,0|1,1,0]=3 1359 B8R0.4 CSCCCSCCCl Amb24481653 [0,1,0,0,0,0|1,1,0]=3 1360 B8R0.4 CSCCCSCCN Amb25720598 [0,1,0,0,0,0|1,1,0]=3 1361 B8R0.4 CSCCCSCCO Amb25372237 [0,1,0,0,0,0|0,1,0]=2 1362 B8R0.4 CSCCNCCC=C Amb25061058 [0,1,0,0,0,0|3,0,0]=4 1363 B8R0.4 CSCCNCCCI Amb24543869 [0,1,0,0,0,0|2,1,0]=4 1364 B8R0.4 CSCCNCCCO Amb25084958 [0,1,0,0,0,0|2,0,0]=3 1365 B8R0.4 CSCCNCCSC Amb25108113 [0,1,0,0,0,0|2,1,0]=4 1366 B8R0.4 CSCCNOCC#C Amb25345753 [0,1,0,0,0,0|2,0,1]=4 1367 B8R0.4 CSCCOCCCBr Amb25250512 [0,1,0,0,0,0|1,1,0]=3 1368 B8R0.4 CSCCOCCCCl Amb25173441 [0,1,0,0,0,0|1,1,0]=3 1369 B8R0.4 CSCCSCCC#C Amb25274504 [0,1,0,0,0,0|2,1,0]=4 1370 B8R0.4 CSCCSCCC#N Amb25685519 [0,1,0,0,0,0|2,1,0]=4 1371 B8R0.4 CSCCSCCCBr Amb25834703 [0,1,0,0,0,0|1,2,0]=4 1372 B8R0.4 CSCCSCCCC Amb25680413 [0,1,0,0,0,0|0,2,0]=3 1373 B8R0.4 CSCCSCCCCl Amb24481654 [0,1,0,0,0,0|1,2,0]=4 1374 B8R0.4 CSCCSCCCF Amb24495676 [0,1,0,0,0,0|1,2,0]=4 1375 B8R0.4 CSCCSCCCN Amb25219826 [0,1,0,0,0,0|1,2,0]=4 1376 B8R0.4 CSCCSCCCS Amb24381031 [0,1,0,0,0,0|1,2,0]=4 1377 B8R0.4 CSCCSCCON Amb25773197 [0,1,0,0,0,0|1,1,0]=3 1378 B8R0.4 CSCOCC#CCO Amb25343895 [0,1,0,0,0,0|2,0,1]=4 1379 B8R0.4 CSSCCNCCC Amb24581351 [0,1,0,0,0,0|3,0,0]=4 1380 B8R0.4 CSSCCNCCN Amb24548373 [0,1,0,0,0,0|3,0,0]=4 1381 B8R0.4 CSSCCNCCO Amb24746096 [0,1,0,0,0,0|2,0,0]=3 1382 B8R0.4 CS\C=C\CCCCO Amb25070629 [0,1,0,0,0,0|1,0,2]=4 1383 B8R0.4 C\C=C/CCCCCC Amb22730637 [0,1,0,0,0,0|2,0,1]=4 1384 B8R0.4 C\C=C\C=NOCCO Amb25206534 [0,1,0,0,0,0|0,0,3]=4 1385 B8R0.4 C\C=C\CC#CCCO Amb24379986 [0,1,0,0,0,0|1,0,2]=4 1386 B8R0.4 C\C=C\CCCCCBr Amb24519144 [0,1,0,0,0,0|2,0,1]=4 1387 B8R0.4 C\C=C\CCCCCC Amb19930200 [0,1,0,0,0,0|2,0,1]=4 1388 B8R0.4 C\C=C\CCCCCO Amb25247777 [0,1,0,0,0,0|1,0,1]=3 1389 B8R0.4 C\C=C\CCNCCC Amb25375567 [0,1,0,0,0,0|2,0,1]=4 1390 B8R0.4 C\C=C\CCNCCF Amb24409974 [0,1,0,0,0,0|2,0,1]=4 1391 B8R0.4 C\C=C\CCNCCO Amb25064029 [0,1,0,0,0,0|1,0,1]=3 1392 B8R0.4 C\C=C\CNCCCC Amb18642548 [0,1,0,0,0,0|2,0,1]=4 1393 B8R0.4 C\C=C\CNCCCO Amb24363131 [0,1,0,0,0,0|1,0,2]=4 1394 B8R0.4 C\C=C\CNOCCC Amb25031195 [0,1,0,0,0,0|1,0,2]=4 1395 B8R0.4 C\C=C\COCCC=O Amb25709831 [0,1,0,0,0,0|0,0,3]=4 1396 B8R0.4 C\C=C\COCCCCl Amb25733307 [0,1,0,0,0,0|1,0,2]=4 1397 B8R0.4 C\C=C\COCCCN Amb24657112 [0,1,0,0,0,0|1,0,2]=4 1398 B8R0.4 C\C=C\COCCCS Amb24675119 [0,1,0,0,0,0|0,1,2]=4 1399 B8R0.4 C\C=N\CCCCCN Amb24454286 [0,1,0,0,0,0|2,0,1]=4 1400 B8R0.4 ClCCCCCCCBr Amb24323576 [0,1,0,0,0,0|2,0,0]=3 1401 B8R0.4 ClCCCCCCCCl Amb22232563 [0,1,0,0,0,0|2,0,0]=3 1402 B8R0.4 ClCCCCCCCI Amb25329531 [0,1,0,0,0,0|2,0,0]=3 1403 B8R0.4 ClCCCCCC[Zn]Br Amb22000406 [0,1,0,0,0,0|3,0,0]=4 1404 B8R0.4 ClCCCCCOCCl Amb24479943 [0,1,0,0,0,0|3,0,0]=4 1405 B8R0.4 ClCCCCOCCBr Amb24394461 [0,1,0,0,0,0|1,0,0]=2 1406 B8R0.4 ClCCCNCCCCl Amb25147083 [0,1,0,0,0,0|3,0,0]=4 1407 B8R0.4 ClCCCOCCCCl Amb24079183 [0,1,0,0,0,0|2,0,0]=3 1408 B8R0.4 ClCCSCSCCCl Amb25789893 [0,1,0,0,0,0|2,1,0]=4 1409 B8R0.4 ClCOCCOCCCl Amb25700922 [0,1,0,0,0,0|2,0,0]=3 1410 B8R0.4 ClCOCOCOCCl Amb25232556 [0,1,0,0,0,0|3,0,0]=4 1411 B8R0.4 FCCCCCCCBr Amb24524186 [0,1,0,0,0,0|2,0,0]=3 1412 B8R0.4 FCCCCCCCF Amb24450264 [0,1,0,0,0,0|2,0,0]=3 1413 B8R0.4 FCCCNCCCF Amb24396518 [0,1,0,0,0,0|3,0,0]=4 1414 B8R0.4 FCCCOCCCF Amb22008118 [0,1,0,0,0,0|2,0,0]=3 1415 B8R0.4 FCCNCCCCBr Amb25349601 [0,1,0,0,0,0|2,0,0]=3 1416 B8R0.4 FCCOCOCCCl Amb25806146 [0,1,0,0,0,0|2,0,0]=3 1417 B8R0.4 ICCCCCCCI Amb24597013 [0,1,0,0,0,0|2,0,0]=3 1418 B8R0.4 N#CCCCCCCCl Amb22045160 [0,1,0,0,0,0|2,0,1]=4 1419 B8R0.4 N#CCCCCCCO Amb18642527 [0,1,0,0,0,0|1,0,1]=3 1420 B8R0.4 N#CCCC\C=C\CO Amb25271968 [0,1,0,0,0,0|1,0,2]=4 1421 B8R0.4 N#CCCNCCCCl Amb25755946 [0,1,0,0,0,0|3,0,0]=4 1422 B8R0.4 N#CCCOCCCF Amb22008449 [0,1,0,0,0,0|2,0,0]=3 1423 B8R0.4 N#CCCSCCCCl Amb24629397 [0,1,0,0,0,0|2,1,0]=4 1424 B8R0.4 N#CCNCCCCF Amb24454416 [0,1,0,0,0,0|2,0,1]=4 1425 B8R0.4 N#CCNCCCCO Amb25810887 [0,1,0,0,0,0|2,0,1]=4 1426 B8R0.4 N#CNCCCCCO Amb24607877 [0,1,0,0,0,0|2,0,1]=4 1427 B8R0.4 N#CSCCOCCBr Amb25281163 [0,1,0,0,0,0|2,0,1]=4 1428 B8R0.4 NCC#CCCCCCl Amb25334425 [0,1,0,0,0,0|2,0,1]=4 1429 B8R0.4 NCCC#CCCCN Amb25786012 [0,1,0,0,0,0|2,0,1]=4 1430 B8R0.4 NCCCCCCCCl Amb17593720 [0,1,0,0,0,0|2,0,0]=3 1431 B8R0.4 NCCCCCCCO Amb24120448 [0,1,0,0,0,0|1,0,0]=2 1432 B8R0.4 NCCCCCCCS Amb25147209 [0,1,0,0,0,0|1,1,0]=3 1433 B8R0.4 NCCCCCCNN Amb25677803 [0,1,0,0,0,0|3,0,0]=4 1434 B8R0.4 NCCCCCCON Amb25063312 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.4 NCCCCNCC=C Amb17334102 [0,1,0,0,0,0|2,0,1]=4 1436 B8R0.4 NCCCCNCCF Amb25146189 [0,1,0,0,0,0|2,0,0]=3 1437 B8R0.4 NCCCCNCCS Amb25105350 [0,1,0,0,0,0|1,1,0]=3 1438 B8R0.4 NCCCCOCC#N Amb25272369 [0,1,0,0,0,0|1,0,1]=3 1439 B8R0.4 NCCCCOCCF Amb25279148 [0,1,0,0,0,0|1,0,0]=2 1440 B8R0.4 NCCCCSCC#C Amb17500974 [0,1,0,0,0,0|1,1,1]=4 1441 B8R0.4 NCCCCSCC#N Amb17500946 [0,1,0,0,0,0|1,1,1]=4 1442 B8R0.4 NCCCCSCC=C Amb17500942 [0,1,0,0,0,0|1,1,1]=4 1443 B8R0.4 NCCCCSCCO Amb17500958 [0,1,0,0,0,0|0,1,0]=2 1444 B8R0.4 NCCCC\C=C\CO Amb24117507 [0,1,0,0,0,0|1,0,1]=3 1445 B8R0.4 NCCCNCCCBr Amb25286545 [0,1,0,0,0,0|3,0,0]=4 1446 B8R0.4 NCCCNCCCF Amb25710819 [0,1,0,0,0,0|3,0,0]=4 1447 B8R0.4 NCCCNCCCO Amb19959935 [0,1,0,0,0,0|2,0,0]=3 1448 B8R0.4 NCCCNCCOC Amb17315289 [0,1,0,0,0,0|2,0,0]=3 1449 B8R0.4 NCCCNCCON Amb25338779 [0,1,0,0,0,0|2,0,0]=3 1450 B8R0.4 NCCCOCCCN Amb17593392 [0,1,0,0,0,0|2,0,0]=3 1451 B8R0.4 NCCCOCCCN Amb22227742 [0,1,0,0,0,0|2,0,0]=3 1452 B8R0.4 NCCCOCCOC Amb1154665 [0,1,0,0,0,0|1,0,0]=2 1453 B8R0.4 NCCCOC\C=C\Cl Amb25323843 [0,1,0,0,0,0|2,0,1]=4 1454 B8R0.4 NCCCPCCCN Amb24468572 [0,1,0,0,0,0|3,0,0]=4 1455 B8R0.4 NCCCSCCCF Amb24732308 [0,1,0,0,0,0|2,1,0]=4 1456 B8R0.4 NCCCSCCCO Amb17500713 [0,1,0,0,0,0|1,1,0]=3 1457 B8R0.4 NCCNCCCCF Amb24553596 [0,1,0,0,0,0|2,0,0]=3 1458 B8R0.4 NCCNCCCCN Amb24117220 [0,1,0,0,0,0|2,0,0]=3 1459 B8R0.4 NCCNCCCCN Amb25378773 [0,1,0,0,0,0|2,0,0]=3 1460 B8R0.4 NCCOCCCCBr Amb25708475 [0,1,0,0,0,0|1,0,0]=2 1461 B8R0.4 NCCOCCCCF Amb25365991 [0,1,0,0,0,0|1,0,0]=2 1462 B8R0.4 NCCOCCSCC Amb17501990 [0,1,0,0,0,0|1,0,0]=2 1463 B8R0.4 NCCSCSCCN Amb25100916 [0,1,0,0,0,0|2,1,0]=4 1464 B8R0.4 NCC\C=C\CCCN Amb25146053 [0,1,0,0,0,0|2,0,1]=4 1465 B8R0.4 NC\C=C/CCCCN Amb25328456 [0,1,0,0,0,0|2,0,1]=4 1466 B8R0.4 NC\C=C\CCCCN Amb24699111 [0,1,0,0,0,0|2,0,1]=4 1467 B8R0.4 NNCCCCCCO Amb24725609 [0,1,0,0,0,0|2,0,0]=3 1468 B8R0.4 NOCCCCCCCl Amb25197967 [0,1,0,0,0,0|2,0,0]=3 1469 B8R0.4 NOCCCCCCO Amb25073489 [0,1,0,0,0,0|2,0,0]=3 1470 B8R0.4 NOCCCCCON Amb24586675 [0,1,0,0,0,0|3,0,0]=4 1471 B8R0.4 NOCCOCCON Amb25118127 [0,1,0,0,0,0|2,0,0]=3 1472 B8R0.4 O=C=NCCOCCF Amb25767560 [0,1,0,0,0,0|2,0,1]=4 1473 B8R0.4 O=CCCCCCCBr Amb22755463 [0,1,0,0,0,0|1,0,2]=4 1474 B8R0.4 O=CCCCCCCF Amb24682783 [0,1,0,0,0,0|1,0,2]=4 1475 B8R0.4 O=CCCCCCO[SiH3] Amb24608657 [0,1,0,0,0,0|2,0,1]=4 1476 B8R0.4 O=COCCOCCCl Amb24715636 [0,1,0,0,0,0|2,0,1]=4 1477 B8R0.4 OCC#CCCCCCl Amb25744317 [0,1,0,0,0,0|1,0,1]=3 1478 B8R0.4 OCCC#CC#CCC Amb17593246 [0,1,0,0,0,0|1,0,2]=4 1479 B8R0.4 OCCC#CCCCO Amb24718410 [0,1,0,0,0,0|1,0,1]=3 1480 B8R0.4 OCCCCC#CCBr Amb25299442 [0,1,0,0,0,0|1,0,2]=4 1481 B8R0.4 OCCCCCC=NO Amb25343910 [0,1,0,0,0,0|2,0,1]=4 1482 B8R0.4 OCCCCCCC#C Amb16231466 [0,1,0,0,0,0|1,0,1]=3 1483 B8R0.4 OCCCCCCC=O Amb24711951 [0,1,0,0,0,0|1,0,1]=3 1484 B8R0.4 OCCCCCCCCl Amb24063216 [0,1,0,0,0,0|1,0,0]=2 1485 B8R0.4 OCCCCCCCF Amb25381297 [0,1,0,0,0,0|1,0,0]=2 1486 B8R0.4 OCCCCCCNO Amb24481664 [0,1,0,0,0,0|2,0,0]=3 1487 B8R0.4 OCCCCCNC=O Amb24752050 [0,1,0,0,0,0|2,0,1]=4 1488 B8R0.4 OCCCCCNCC Amb17334130 [0,1,0,0,0,0|1,0,0]=2 1489 B8R0.4 OCCCCNCC=C Amb17334109 [0,1,0,0,0,0|1,0,2]=4 1490 B8R0.4 OCCCCNCCF Amb24523034 [0,1,0,0,0,0|2,0,0]=3 1491 B8R0.4 OCCCCNCCS Amb25758432 [0,1,0,0,0,0|1,1,0]=3 1492 B8R0.4 OCCCNCCCF Amb24717070 [0,1,0,0,0,0|2,0,0]=3 1493 B8R0.4 OCCCOCCCO Amb24626114 [0,1,0,0,0,0|1,0,0]=2 1494 B8R0.4 OCCCSCCC#N Amb17502405 [0,1,0,0,0,0|1,1,1]=4 1495 B8R0.4 OCCCSCCC=O Amb24375002 [0,1,0,0,0,0|1,1,1]=4 1496 B8R0.4 OCCCSCCCF Amb25676967 [0,1,0,0,0,0|1,1,0]=3 1497 B8R0.4 OCCC\C=C/CCI Amb22364703 [0,1,0,0,0,0|1,0,2]=4 1498 B8R0.4 OCCC\C=C\CCI Amb22364705 [0,1,0,0,0,0|1,0,2]=4 1499 B8R0.4 OCCNC=NCCO Amb25199841 [0,1,0,0,0,0|2,0,1]=4 1500 B8R0.4 OCCNCCCCF Amb24728535 [0,1,0,0,0,0|1,0,0]=2 1501 B8R0.4 OCCNCNCCO Amb10790096 [0,1,0,0,0,0|2,0,0]=3 1502 B8R0.4 OCCOCCCCBr Amb25274278 [0,1,0,0,0,0|0,0,0]=1 1503 B8R0.4 OCCOCCCCO Amb25185198 [0,1,0,0,0,0|0,0,0]=1 1504 B8R0.4 OCCOCOCCCl Amb25378822 [0,1,0,0,0,0|1,0,0]=2 1505 B8R0.4 OCCSCSCCO Amb15691667 [0,1,0,0,0,0|1,1,0]=3 1506 B8R0.4 OCC\C=C\CCCO Amb25275374 [0,1,0,0,0,0|1,0,1]=3 1507 B8R0.4 OC\C=C/CC#CCC Amb17593279 [0,1,0,0,0,0|1,0,2]=4 1508 B8R0.4 OC\C=C/CCCC=O Amb24496297 [0,1,0,0,0,0|1,0,2]=4 1509 B8R0.4 OC\C=C\CSCCO Amb25739839 [0,1,0,0,0,0|0,1,2]=4 1510 B8R0.4 SCCCNCCCS Amb24635322 [0,1,0,0,0,0|2,1,0]=4 1511 B8R0.4 [2H]OCCOCCCC Amb22353272 [0,1,0,0,0,0|0,0,0]=1 1512 B8R0.4 [2H]OCCOCCO[2H] Amb22367101 [0,1,0,0,0,0|2,0,0]=3 1513 B8R0.4 [N-]=[N+]=NCCOCCN Amb21982547 [0,1,0,0,0,0|3,0,0]=4 1514 B8R0.4 [N-]=[N+]=NCCOCCO Amb10576102 [0,1,0,0,0,0|2,0,0]=3 1515 B8R0.6 C#CC(F)CCCCO Amb24705849 [0,1,0,0,0,0|1,0,2]=4 1516 B8R0.6 C#CCCC[C@H](N)CO Amb24550563 [0,1,0,0,0,0|1,0,2]=4 1517 B8R0.6 C#CCOCC(N)CO Amb24400058 [0,1,0,0,0,0|2,0,1]=4 1518 B8R0.6 C#CCOC[C@@H](N)CO Amb24525497 [0,1,0,0,0,0|2,0,1]=4 1519 B8R0.6 C=C(CO)CCCCBr Amb24339522 [0,1,0,0,0,0|2,0,1]=4 1520 B8R0.6 C=CC(O)COCCCl Amb24674184 [0,1,0,0,0,0|1,0,2]=4 1521 B8R0.6 C=CC(O)CSCCO Amb24581768 [0,1,0,0,0,0|0,1,2]=4 1522 B8R0.6 C=CCCCC(N)CO Amb25147202 [0,1,0,0,0,0|1,0,2]=4 1523 B8R0.6 C=CCCC[C@@H](O)CO Amb25219775 [0,1,0,0,0,0|1,0,2]=4 1524 B8R0.6 C=CCOCC(Br)CO Amb25298187 [0,1,0,0,0,0|2,0,1]=4 1525 B8R0.6 C=CCOCC(F)CO Amb24412116 [0,1,0,0,0,0|2,0,1]=4 1526 B8R0.6 C=CCOCC(O)CO Amb22353410 [0,1,0,0,0,0|2,0,1]=4 1527 B8R0.6 C=CCOCC(S)CN Amb24477814 [0,1,0,0,0,0|2,0,1]=4 1528 B8R0.6 CC#CCCC(C)CO Amb25303568 [0,1,0,0,0,0|1,0,2]=4 1529 B8R0.6 CC#CCCC(N)CO Amb25229584 [0,1,0,0,0,0|1,0,2]=4 1530 B8R0.6 CC#CCNC(C)CO Amb25290156 [0,1,0,0,0,0|1,0,2]=4 1531 B8R0.6 CC#CCOC(=O)CO Amb25296198 [0,1,0,0,0,0|0,0,3]=4 1532 B8R0.6 CC#CCSC(C)CO Amb24481647 [0,1,0,0,0,0|0,1,2]=4 1533 B8R0.6 CC(C#N)NCCCC Amb17044849 [0,1,0,0,0,0|2,0,1]=4 1534 B8R0.6 CC(C#N)OCCCN Amb19020793 [0,1,0,0,0,0|2,0,1]=4 1535 B8R0.6 CC(C=C)OCCCN Amb25326104 [0,1,0,0,0,0|2,0,1]=4 1536 B8R0.6 CC(CCCCO)C=O Amb25072654 [0,1,0,0,0,0|2,0,1]=4 1537 B8R0.6 CC(CCNCC)CC Amb25327121 [0,1,0,0,0,0|3,0,0]=4 1538 B8R0.6 CC(CCl)COCCO Amb25129406 [0,1,0,0,0,0|1,0,0]=2 1539 B8R0.6 CC(CCl)NCCCF Amb25775317 [0,1,0,0,0,0|3,0,0]=4 1540 B8R0.6 CC(CCl)SCCCF Amb24556592 [0,1,0,0,0,0|2,1,0]=4 1541 B8R0.6 CC(CN)CSCCO Amb25308410 [0,1,0,0,0,0|1,1,0]=3 1542 B8R0.6 CC(CN)NCCCO Amb25147011 [0,1,0,0,0,0|3,0,0]=4 1543 B8R0.6 CC(CN)SCCCN Amb24478764 [0,1,0,0,0,0|2,1,0]=4 1544 B8R0.6 CC(CN)SCCCO Amb25690519 [0,1,0,0,0,0|2,1,0]=4 1545 B8R0.6 CC(CNCCN)CN Amb25145991 [0,1,0,0,0,0|3,0,0]=4 1546 B8R0.6 CC(CNCCO)CO Amb24645558 [0,1,0,0,0,0|2,0,0]=3 1547 B8R0.6 CC(CNOCC)CC Amb25714174 [0,1,0,0,0,0|3,0,0]=4 1548 B8R0.6 CC(CO)CCCC#N Amb24353119 [0,1,0,0,0,0|2,0,1]=4 1549 B8R0.6 CC(CO)CCCC=C Amb24716758 [0,1,0,0,0,0|1,0,2]=4 1550 B8R0.6 CC(CO)CCCC=O Amb24532890 [0,1,0,0,0,0|2,0,1]=4 1551 B8R0.6 CC(CO)CCCCBr Amb24649978 [0,1,0,0,0,0|2,0,0]=3 1552 B8R0.6 CC(CO)CNCCF Amb25294896 [0,1,0,0,0,0|3,0,0]=4 1553 B8R0.6 CC(CO)CNCCN Amb24481852 [0,1,0,0,0,0|3,0,0]=4 1554 B8R0.6 CC(CO)COCCN Amb24524218 [0,1,0,0,0,0|2,0,0]=3 1555 B8R0.6 CC(CO)CSCCN Amb25188927 [0,1,0,0,0,0|2,1,0]=4 1556 B8R0.6 CC(CO)NCCC#C Amb25068088 [0,1,0,0,0,0|1,0,2]=4 1557 B8R0.6 CC(CO)NCCCF Amb24659807 [0,1,0,0,0,0|2,0,0]=3 1558 B8R0.6 CC(CO)OCCC=C Amb24474226 [0,1,0,0,0,0|0,0,2]=3 1559 B8R0.6 CC(CO)OCCCN Amb25083614 [0,1,0,0,0,0|1,0,0]=2 1560 B8R0.6 CC(CO)OCOCO Amb25215520 [0,1,0,0,0,0|2,0,0]=3 1561 B8R0.6 CC(CO)SCCCF Amb24481649 [0,1,0,0,0,0|1,1,0]=3 1562 B8R0.6 CC(CO)SCCCO Amb24481645 [0,1,0,0,0,0|1,1,0]=3 1563 B8R0.6 CC(COCCO)=C=C Amb25794822 [0,1,0,0,0,0|0,0,3]=4 1564 B8R0.6 CC(CS)COCC=C Amb25806522 [0,1,0,0,0,0|2,0,1]=4 1565 B8R0.6 CC(CSCCN)CN Amb25211229 [0,1,0,0,0,0|2,1,0]=4 1566 B8R0.6 CCC#CCC(C)CO Amb25762522 [0,1,0,0,0,0|1,0,2]=4 1567 B8R0.6 CCC#CCC(CC)O Amb10975934 [0,1,0,0,0,0|2,0,1]=4 1568 B8R0.6 CCC#CCC(O)CO Amb24642439 [0,1,0,0,0,0|1,0,2]=4 1569 B8R0.6 CCC#CC[C@H](C)CO Amb25343737 [0,1,0,0,0,0|1,0,2]=4 1570 B8R0.6 CCC(=C)C#CCCO Amb24748372 [0,1,0,0,0,0|1,0,2]=4 1571 B8R0.6 CCC(=C)CCCCO Amb25057130 [0,1,0,0,0,0|1,0,1]=3 1572 B8R0.6 CCC(=C)CNCCN Amb25762491 [0,1,0,0,0,0|2,0,1]=4 1573 B8R0.6 CCC(=C)CNCCO Amb24615526 [0,1,0,0,0,0|1,0,1]=3 1574 B8R0.6 CCC(=C)COCCN Amb24478736 [0,1,0,0,0,0|1,0,1]=3 1575 B8R0.6 CCC(=O)CCCCF Amb25842980 [0,1,0,0,0,0|2,0,1]=4 1576 B8R0.6 CCC(=O)CCCCN Amb25757344 [0,1,0,0,0,0|2,0,1]=4 1577 B8R0.6 CCC(=O)COCCCl Amb25091814 [0,1,0,0,0,0|1,0,1]=3 1578 B8R0.6 CCC(=O)NOCCC Amb25031184 [0,1,0,0,0,0|2,0,1]=4 1579 B8R0.6 CCC(=O)OCCCCl Amb25707031 [0,1,0,0,0,0|2,0,1]=4 1580 B8R0.6 CCC(=O)OCCCF Amb25345816 [0,1,0,0,0,0|2,0,1]=4 1581 B8R0.6 CCC(=O)OCCCI Amb25856256 [0,1,0,0,0,0|2,0,1]=4 1582 B8R0.6 CCC(=O)OCCCN Amb24652701 [0,1,0,0,0,0|2,0,1]=4 1583 B8R0.6 CCC(Br)CCCCBr Amb25375320 [0,1,0,0,0,0|2,0,0]=3 1584 B8R0.6 CCC(Br)CCCOC Amb18329558 [0,1,0,0,0,0|3,0,0]=4 1585 B8R0.6 CCC(Br)CCNCC Amb25796689 [0,1,0,0,0,0|3,0,0]=4 1586 B8R0.6 CCC(Br)CCOCC Amb24590489 [0,1,0,0,0,0|3,0,0]=4 1587 B8R0.6 CCC(Br)COCCCl Amb25163377 [0,1,0,0,0,0|1,0,0]=2 1588 B8R0.6 CCC(C)=CCCCO Amb24371214 [0,1,0,0,0,0|1,0,2]=4 1589 B8R0.6 CCC(C)CC#CCC Amb25095737 [0,1,0,0,0,0|2,0,1]=4 1590 B8R0.6 CCC(C)CC#CCO Amb24617569 [0,1,0,0,0,0|1,0,1]=3 1591 B8R0.6 CCC(C)CCCC=O Amb18642680 [0,1,0,0,0,0|1,0,2]=4 1592 B8R0.6 CCC(C)CCCCBr Amb24410922 [0,1,0,0,0,0|2,0,0]=3 1593 B8R0.6 CCC(C)CCCCCl Amb25809492 [0,1,0,0,0,0|2,0,0]=3 1594 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|2,0,0]=3 1595 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|1,0,0]=2 1596 B8R0.6 CCC(C)CCCNN Amb18642820 [0,1,0,0,0,0|3,0,0]=4 1597 B8R0.6 CCC(C)CNCC#N Amb19028759 [0,1,0,0,0,0|2,0,1]=4 1598 B8R0.6 CCC(C)CNCCBr Amb24369359 [0,1,0,0,0,0|2,0,0]=3 1599 B8R0.6 CCC(C)CNCCI Amb24463408 [0,1,0,0,0,0|2,0,0]=3 1600 B8R0.6 CCC(C)CNCCN Amb24584182 [0,1,0,0,0,0|2,0,0]=3 1601 B8R0.6 CCC(C)COCCCl Amb25339593 [0,1,0,0,0,0|1,0,0]=2 1602 B8R0.6 CCC(C)COCCN Amb24383614 [0,1,0,0,0,0|1,0,0]=2 1603 B8R0.6 CCC(C)CSCC#N Amb24524216 [0,1,0,0,0,0|1,1,1]=4 1604 B8R0.6 CCC(C)CSCCCl Amb25676451 [0,1,0,0,0,0|1,1,0]=3 1605 B8R0.6 CCC(C)CSCCO Amb25310894 [0,1,0,0,0,0|0,1,0]=2 1606 B8R0.6 CCC(C)C\C=C\CO Amb25051829 [0,1,0,0,0,0|1,0,1]=3 1607 B8R0.6 CCC(C)NCCCI Amb24455808 [0,1,0,0,0,0|3,0,0]=4 1608 B8R0.6 CCC(C)NCCSC Amb25358028 [0,1,0,0,0,0|3,0,0]=4 1609 B8R0.6 CCC(C)NOCC#C Amb24353921 [0,1,0,0,0,0|2,0,1]=4 1610 B8R0.6 CCC(C)NOCC=C Amb25360071 [0,1,0,0,0,0|2,0,1]=4 1611 B8R0.6 CCC(C)NOCCC Amb24423511 [0,1,0,0,0,0|2,0,0]=3 1612 B8R0.6 CCC(C)OCCC#N Amb19980956 [0,1,0,0,0,0|2,0,1]=4 1613 B8R0.6 CCC(C)OCCCBr Amb18321256 [0,1,0,0,0,0|2,0,0]=3 1614 B8R0.6 CCC(C)OCCCCl Amb18176654 [0,1,0,0,0,0|2,0,0]=3 1615 B8R0.6 CCC(C)OCCCN Amb20076070 [0,1,0,0,0,0|2,0,0]=3 1616 B8R0.6 CCC(C)OCCCO Amb20076069 [0,1,0,0,0,0|2,0,0]=3 1617 B8R0.6 CCC(C)OCCCS Amb25788581 [0,1,0,0,0,0|2,0,0]=3 1618 B8R0.6 CCC(C)SCCCS Amb25256845 [0,1,0,0,0,0|2,1,0]=4 1619 B8R0.6 CCC(C)\C=C\CCCl Amb25742701 [0,1,0,0,0,0|2,0,1]=4 1620 B8R0.6 CCC(C)\C=C\CCN Amb25133293 [0,1,0,0,0,0|2,0,1]=4 1621 B8R0.6 CCC(C)\C=C\CCO Amb25662565 [0,1,0,0,0,0|1,0,1]=3 1622 B8R0.6 CCC(Cl)CCCC#C Amb25130730 [0,1,0,0,0,0|2,0,1]=4 1623 B8R0.6 CCC(Cl)CCCC#N Amb25065292 [0,1,0,0,0,0|2,0,1]=4 1624 B8R0.6 CCC(Cl)CCCCCl Amb24545870 [0,1,0,0,0,0|2,0,0]=3 1625 B8R0.6 CCC(Cl)CCCCO Amb24479989 [0,1,0,0,0,0|1,0,0]=2 1626 B8R0.6 CCC(Cl)CCCNC Amb24587627 [0,1,0,0,0,0|3,0,0]=4 1627 B8R0.6 CCC(Cl)CCCOC Amb18180141 [0,1,0,0,0,0|3,0,0]=4 1628 B8R0.6 CCC(Cl)CCCSC Amb25687319 [0,1,0,0,0,0|3,0,0]=4 1629 B8R0.6 CCC(Cl)CCNCC Amb24481777 [0,1,0,0,0,0|3,0,0]=4 1630 B8R0.6 CCC(Cl)CNCC=C Amb24383721 [0,1,0,0,0,0|2,0,1]=4 1631 B8R0.6 CCC(Cl)CNCCCl Amb24710336 [0,1,0,0,0,0|2,0,0]=3 1632 B8R0.6 CCC(Cl)COCCCl Amb25138691 [0,1,0,0,0,0|1,0,0]=2 1633 B8R0.6 CCC(Cl)CSCCCl Amb24480124 [0,1,0,0,0,0|1,1,0]=3 1634 B8R0.6 CCC(F)CNOCC Amb25358594 [0,1,0,0,0,0|3,0,0]=4 1635 B8R0.6 CCC(N)=NOCCC Amb25331450 [0,1,0,0,0,0|2,0,1]=4 1636 B8R0.6 CCC(N)CCCCF Amb24482006 [0,1,0,0,0,0|2,0,0]=3 1637 B8R0.6 CCC(N)CCCSC Amb24709842 [0,1,0,0,0,0|3,0,0]=4 1638 B8R0.6 CCC(N)CCOCC Amb25756792 [0,1,0,0,0,0|3,0,0]=4 1639 B8R0.6 CCC(N)CCSCC Amb24518047 [0,1,0,0,0,0|3,0,0]=4 1640 B8R0.6 CCC(N)CNCCF Amb24361445 [0,1,0,0,0,0|2,0,0]=3 1641 B8R0.6 CCC(N)CNCCS Amb24477800 [0,1,0,0,0,0|1,1,0]=3 1642 B8R0.6 CCC(N)COCC#C Amb18111728 [0,1,0,0,0,0|1,0,1]=3 1643 B8R0.6 CCC(N)COCC#N Amb18111716 [0,1,0,0,0,0|1,0,1]=3 1644 B8R0.6 CCC(N)COCC=C Amb18630623 [0,1,0,0,0,0|1,0,1]=3 1645 B8R0.6 CCC(N)CSCC#C Amb25136905 [0,1,0,0,0,0|1,1,1]=4 1646 B8R0.6 CCC(N)CSCCN Amb25828304 [0,1,0,0,0,0|1,1,0]=3 1647 B8R0.6 CCC(N)C\C=C\CC Amb24477864 [0,1,0,0,0,0|2,0,1]=4 1648 B8R0.6 CCC(O)CCCC=O Amb25290333 [0,1,0,0,0,0|1,0,2]=4 1649 B8R0.6 CCC(O)CCCCBr Amb25146987 [0,1,0,0,0,0|2,0,0]=3 1650 B8R0.6 CCC(O)CCCCF Amb25710820 [0,1,0,0,0,0|2,0,0]=3 1651 B8R0.6 CCC(O)CCCCN Amb24411425 [0,1,0,0,0,0|2,0,0]=3 1652 B8R0.6 CCC(O)CCSCC Amb24711817 [0,1,0,0,0,0|3,0,0]=4 1653 B8R0.6 CCC(O)CNCC#C Amb18304017 [0,1,0,0,0,0|2,0,1]=4 1654 B8R0.6 CCC(O)CNCC#N Amb25251106 [0,1,0,0,0,0|2,0,1]=4 1655 B8R0.6 CCC(O)CNCCF Amb24445602 [0,1,0,0,0,0|2,0,0]=3 1656 B8R0.6 CCC(O)CNCCN Amb25331757 [0,1,0,0,0,0|2,0,0]=3 1657 B8R0.6 CCC(O)CNCCS Amb24064066 [0,1,0,0,0,0|1,1,0]=3 1658 B8R0.6 CCC(O)CNCCS Amb25146014 [0,1,0,0,0,0|1,1,0]=3 1659 B8R0.6 CCC(O)COCCCl Amb24407831 [0,1,0,0,0,0|1,0,0]=2 1660 B8R0.6 CCC(O)COCCN Amb24422049 [0,1,0,0,0,0|1,0,0]=2 1661 B8R0.6 CCC(O)COCCO Amb25761377 [0,1,0,0,0,0|0,0,0]=1 1662 B8R0.6 CCC(O)CSCCN Amb25117286 [0,1,0,0,0,0|1,1,0]=3 1663 B8R0.6 CCC(O)CSCCO Amb18791468 [0,1,0,0,0,0|0,1,0]=2 1664 B8R0.6 CCC(O)C\C=C\CO Amb25284545 [0,1,0,0,0,0|1,0,1]=3 1665 B8R0.6 CCC=C=CC(C)CO Amb25357332 [0,1,0,0,0,0|1,0,2]=4 1666 B8R0.6 CCC=C=C[C@@H](C)CO Amb24379945 [0,1,0,0,0,0|1,0,2]=4 1667 B8R0.6 CCCC#CC(O)CC Amb24333440 [0,1,0,0,0,0|2,0,1]=4 1668 B8R0.6 CCCC#C[C@H](O)CC Amb24608071 [0,1,0,0,0,0|2,0,1]=4 1669 B8R0.6 CCCC=C=C(C)CO Amb25381424 [0,1,0,0,0,0|1,0,2]=4 1670 B8R0.6 CCCCCC(=C)CCl Amb24703635 [0,1,0,0,0,0|2,0,1]=4 1671 B8R0.6 CCCCCC(=C)CO Amb24556289 [0,1,0,0,0,0|1,0,1]=3 1672 B8R0.6 CCCCCC(=O)CBr Amb22276985 [0,1,0,0,0,0|2,0,1]=4 1673 B8R0.6 CCCCCC(=O)CCl Amb17593704 [0,1,0,0,0,0|2,0,1]=4 1674 B8R0.6 CCCCCC(=O)CI Amb22276984 [0,1,0,0,0,0|2,0,1]=4 1675 B8R0.6 CCCCCC(=O)CN Amb18642725 [0,1,0,0,0,0|2,0,1]=4 1676 B8R0.6 CCCCCC(Br)C#N Amb18129814 [0,1,0,0,0,0|2,0,1]=4 1677 B8R0.6 CCCCCC(Br)C=C Amb17666912 [0,1,0,0,0,0|2,0,1]=4 1678 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|2,0,0]=3 1679 B8R0.6 CCCCCC(Br)CF Amb24480174 [0,1,0,0,0,0|2,0,0]=3 1680 B8R0.6 CCCCCC(C)=NO Amb22232375 [0,1,0,0,0,0|2,0,1]=4 1681 B8R0.6 CCCCCC(C)C#N Amb18642348 [0,1,0,0,0,0|2,0,1]=4 1682 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|2,0,0]=3 1683 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|2,0,0]=3 1684 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|1,0,0]=2 1685 B8R0.6 CCCCCC(C)NN Amb25327848 [0,1,0,0,0,0|3,0,0]=4 1686 B8R0.6 CCCCCC(C)ON Amb25717019 [0,1,0,0,0,0|3,0,0]=4 1687 B8R0.6 CCCCCC(C)[Mg]Br Amb22897307 [0,1,0,0,0,0|3,0,0]=4 1688 B8R0.6 CCCCCC(C)[Zn]Br Amb22000405 [0,1,0,0,0,0|3,0,0]=4 1689 B8R0.6 CCCCCC(C=O)Br Amb17595055 [0,1,0,0,0,0|1,0,2]=4 1690 B8R0.6 CCCCCC(C=O)C Amb17593349 [0,1,0,0,0,0|1,0,2]=4 1691 B8R0.6 CCCCCC(Cl)=NO Amb25287496 [0,1,0,0,0,0|2,0,1]=4 1692 B8R0.6 CCCCCC(Cl)C#C Amb24480102 [0,1,0,0,0,0|2,0,1]=4 1693 B8R0.6 CCCCCC(Cl)C#N Amb25696257 [0,1,0,0,0,0|2,0,1]=4 1694 B8R0.6 CCCCCC(Cl)C=C Amb24340311 [0,1,0,0,0,0|2,0,1]=4 1695 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,1,0,0,0,0|1,0,2]=4 1696 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|2,0,0]=3 1697 B8R0.6 CCCCCC(Cl)OC Amb24340104 [0,1,0,0,0,0|3,0,0]=4 1698 B8R0.6 CCCCCC(F)CBr Amb24480152 [0,1,0,0,0,0|2,0,0]=3 1699 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|2,0,0]=3 1700 B8R0.6 CCCCCC(F)CO Amb24724495 [0,1,0,0,0,0|1,0,0]=2 1701 B8R0.6 CCCCCC(N)C=C Amb18642554 [0,1,0,0,0,0|2,0,1]=4 1702 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|1,0,0]=2 1703 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,1,0,0,0,0|1,0,2]=4 1704 B8R0.6 CCCCCC(O)CCl Amb21962884 [0,1,0,0,0,0|2,0,0]=3 1705 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|2,0,0]=3 1706 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|1,0,0]=2 1707 B8R0.6 CCCCCC(O)OC Amb25796374 [0,1,0,0,0,0|3,0,0]=4 1708 B8R0.6 CCCCC[C@@H](C)CN Amb25213957 [0,1,0,0,0,0|2,0,0]=3 1709 B8R0.6 CCCCC[C@@H](Cl)C#C Amb24390924 [0,1,0,0,0,0|2,0,1]=4 1710 B8R0.6 CCCCC[C@@H](N)CO Amb24473164 [0,1,0,0,0,0|1,0,0]=2 1711 B8R0.6 CCCCC[C@@H](O)C=O Amb24653719 [0,1,0,0,0,0|1,0,2]=4 1712 B8R0.6 CCCCC[C@@H](O)CBr Amb24524540 [0,1,0,0,0,0|2,0,0]=3 1713 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|2,0,0]=3 1714 B8R0.6 CCCCC[C@@H](O)CCl Amb22736717 [0,1,0,0,0,0|2,0,0]=3 1715 B8R0.6 CCCCC[C@@H](O)CN Amb24476655 [0,1,0,0,0,0|2,0,0]=3 1716 B8R0.6 CCCCC[C@@H](O)CS Amb24735025 [0,1,0,0,0,0|1,1,0]=3 1717 B8R0.6 CCCCC[C@H](Br)CC Amb25272761 [0,1,0,0,0,0|2,0,0]=3 1718 B8R0.6 CCCCC[C@H](C)C=O Amb25717736 [0,1,0,0,0,0|1,0,2]=4 1719 B8R0.6 CCCCC[C@H](Cl)C#C Amb24373197 [0,1,0,0,0,0|2,0,1]=4 1720 B8R0.6 CCCCC[C@H](F)CO Amb25222193 [0,1,0,0,0,0|1,0,0]=2 1721 B8R0.6 CCCCC[C@H](N)C#C Amb25742849 [0,1,0,0,0,0|2,0,1]=4 1722 B8R0.6 CCCCC[C@H](O)C#N Amb24532826 [0,1,0,0,0,0|2,0,1]=4 1723 B8R0.6 CCCCC[C@H](O)CBr Amb24652638 [0,1,0,0,0,0|2,0,0]=3 1724 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|2,0,0]=3 1725 B8R0.6 CCCCC[C@H](O)CCl Amb22736718 [0,1,0,0,0,0|2,0,0]=3 1726 B8R0.6 CCCCC[C@H](O)CS Amb24748459 [0,1,0,0,0,0|1,1,0]=3 1727 B8R0.6 CCCCC\C(\C)=N\O Amb22338237 [0,1,0,0,0,0|2,0,1]=4 1728 B8R0.6 CCCCNC(=N)CCl Amb24477805 [0,1,0,0,0,0|2,0,1]=4 1729 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,1,0,0,0,0|2,0,1]=4 1730 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,1,0,0,0,0|2,0,1]=4 1731 B8R0.6 CCCCNC(=O)CF Amb24585704 [0,1,0,0,0,0|2,0,1]=4 1732 B8R0.6 CCCCNC(=O)CI Amb23447330 [0,1,0,0,0,0|2,0,1]=4 1733 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,1,0,0,0,0|2,0,1]=4 1734 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,1,0,0,0,0|2,0,1]=4 1735 B8R0.6 CCCCNC(C)C=C Amb25127953 [0,1,0,0,0,0|2,0,1]=4 1736 B8R0.6 CCCCNC(C)CCl Amb25323246 [0,1,0,0,0,0|2,0,0]=3 1737 B8R0.6 CCCCNC(C)CN Amb24481793 [0,1,0,0,0,0|2,0,0]=3 1738 B8R0.6 CCCCNC(C)CS Amb24340092 [0,1,0,0,0,0|1,1,0]=3 1739 B8R0.6 CCCCNC(N)=NO Amb24735707 [0,1,0,0,0,0|2,0,1]=4 1740 B8R0.6 CCCCNC(O)CC Amb25749396 [0,1,0,0,0,0|2,0,0]=3 1741 B8R0.6 CCCCN[C@@H](C)CC Amb24118022 [0,1,0,0,0,0|2,0,0]=3 1742 B8R0.6 CCCCOC(=C)C=O Amb18642623 [0,1,0,0,0,0|0,0,3]=4 1743 B8R0.6 CCCCOC(=C)CCl Amb25032095 [0,1,0,0,0,0|1,0,1]=3 1744 B8R0.6 CCCCOC(=N)C#N Amb24748600 [0,1,0,0,0,0|1,0,2]=4 1745 B8R0.6 CCCCOC(=O)C#C Amb25839203 [0,1,0,0,0,0|1,0,2]=4 1746 B8R0.6 CCCCOC(=O)C#N Amb25676361 [0,1,0,0,0,0|1,0,2]=4 1747 B8R0.6 CCCCOC(=O)C=C Amb22351622 [0,1,0,0,0,0|1,0,2]=4 1748 B8R0.6 CCCCOC(=O)CBr Amb10601879 [0,1,0,0,0,0|1,0,1]=3 1749 B8R0.6 CCCCOC(=O)CF Amb10838878 [0,1,0,0,0,0|1,0,1]=3 1750 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,1,0,0,0,0|1,0,1]=3 1751 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,1,0,0,0,0|1,0,1]=3 1752 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,1,0,0,0,0|2,0,1]=4 1753 B8R0.6 CCCCOC(=O)NN Amb25321437 [0,1,0,0,0,0|2,0,1]=4 1754 B8R0.6 CCCCOC(=S)NN Amb24710633 [0,1,0,0,0,0|2,0,1]=4 1755 B8R0.6 CCCCOC(C)C=O Amb18642805 [0,1,0,0,0,0|0,0,2]=3 1756 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|0,0,0]=1 1757 B8R0.6 CCCCOC(C)ON Amb25375946 [0,1,0,0,0,0|2,0,0]=3 1758 B8R0.6 CCCCOC(CN)C Amb17485998 [0,1,0,0,0,0|1,0,0]=2 1759 B8R0.6 CCCCOC(Cl)=CCl Amb25178995 [0,1,0,0,0,0|1,0,2]=4 1760 B8R0.6 CCCCOC(Cl)CCl Amb17940716 [0,1,0,0,0,0|1,0,0]=2 1761 B8R0.6 CCCCOC(N)=NO Amb24555551 [0,1,0,0,0,0|1,0,1]=3 1762 B8R0.6 CCCCOC(O)CO Amb25144479 [0,1,0,0,0,0|0,0,0]=1 1763 B8R0.6 CCCCO[C@H](C)CO Amb24439158 [0,1,0,0,0,0|0,0,0]=1 1764 B8R0.6 CCCCSC(=C)CO Amb25716344 [0,1,0,0,0,0|0,1,1]=3 1765 B8R0.6 CCCCSC(C)C=O Amb18644295 [0,1,0,0,0,0|0,1,2]=4 1766 B8R0.6 CCCCSC(C)CN Amb24382073 [0,1,0,0,0,0|1,1,0]=3 1767 B8R0.6 CCCCSC(C)CO Amb24481648 [0,1,0,0,0,0|0,1,0]=2 1768 B8R0.6 CCCC\C=C(/Cl)\CCl Amb25292215 [0,1,0,0,0,0|2,0,1]=4 1769 B8R0.6 CCCC\C=C(\Br)/CO Amb24371336 [0,1,0,0,0,0|1,0,1]=3 1770 B8R0.6 CCCC\C=C(\C)/CCl Amb25317209 [0,1,0,0,0,0|2,0,1]=4 1771 B8R0.6 CCCC\C=C(\C)/CO Amb24556106 [0,1,0,0,0,0|1,0,1]=3 1772 B8R0.6 CCCC\C=C(\F)/CCl Amb24528616 [0,1,0,0,0,0|2,0,1]=4 1773 B8R0.6 CCCNCC(=O)CC Amb24715612 [0,1,0,0,0,0|2,0,1]=4 1774 B8R0.6 CCCNCC(C)CO Amb24388936 [0,1,0,0,0,0|2,0,0]=3 1775 B8R0.6 CCCNC[C@@H](N)CC Amb25319142 [0,1,0,0,0,0|2,0,0]=3 1776 B8R0.6 CCCNC[C@H](O)CC Amb25146113 [0,1,0,0,0,0|2,0,0]=3 1777 B8R0.6 CCCOCC(=N)NC Amb24340084 [0,1,0,0,0,0|2,0,1]=4 1778 B8R0.6 CCCOCC(=O)CO Amb24416729 [0,1,0,0,0,0|2,0,1]=4 1779 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,0,0]=3 1780 B8R0.6 CCCOCC(C)NC Amb24618931 [0,1,0,0,0,0|2,0,0]=3 1781 B8R0.6 CCCOCC(CC)N Amb17485992 [0,1,0,0,0,0|1,0,0]=2 1782 B8R0.6 CCCOCC(CO)O Amb10071476 [0,1,0,0,0,0|2,0,0]=3 1783 B8R0.6 CCCOCC(Cl)C#N Amb24481791 [0,1,0,0,0,0|2,0,1]=4 1784 B8R0.6 CCCOCC(Cl)CC Amb25192529 [0,1,0,0,0,0|1,0,0]=2 1785 B8R0.6 CCCOCC(F)CN Amb24611651 [0,1,0,0,0,0|2,0,0]=3 1786 B8R0.6 CCCOCC(N)C#C Amb24686921 [0,1,0,0,0,0|1,0,2]=4 1787 B8R0.6 CCCOCC(N)C#N Amb24696155 [0,1,0,0,0,0|2,0,1]=4 1788 B8R0.6 CCCOCC(N)C=C Amb24478664 [0,1,0,0,0,0|1,0,2]=4 1789 B8R0.6 CCCOCC(N)CO Amb24681930 [0,1,0,0,0,0|2,0,0]=3 1790 B8R0.6 CCCOCC(O)C#C Amb24591414 [0,1,0,0,0,0|1,0,2]=4 1791 B8R0.6 CCCOCC(O)C=O Amb25217476 [0,1,0,0,0,0|2,0,1]=4 1792 B8R0.6 CCCOC[C@@H](N)CO Amb25363717 [0,1,0,0,0,0|2,0,0]=3 1793 B8R0.6 CCCOC[C@@H](O)CN Amb24596176 [0,1,0,0,0,0|2,0,0]=3 1794 B8R0.6 CCCOC[C@@H](O)CO Amb25144456 [0,1,0,0,0,0|2,0,0]=3 1795 B8R0.6 CCCOC[C@H](O)CN Amb25032338 [0,1,0,0,0,0|2,0,0]=3 1796 B8R0.6 CCCONC(C)CN Amb24373493 [0,1,0,0,0,0|3,0,0]=4 1797 B8R0.6 CCCSCC(=C)CC Amb25331591 [0,1,0,0,0,0|1,1,1]=4 1798 B8R0.6 CCCSCC(C)CC Amb24430672 [0,1,0,0,0,0|1,1,0]=3 1799 B8R0.6 CCCSCC(C)OC Amb25344458 [0,1,0,0,0,0|2,1,0]=4 1800 B8R0.6 CCCSCC(CC)N Amb17485961 [0,1,0,0,0,0|1,1,0]=3 1801 B8R0.6 CCCSCC(O)CBr Amb24610498 [0,1,0,0,0,0|2,1,0]=4 1802 B8R0.6 CCCSCC(O)CCl Amb24709373 [0,1,0,0,0,0|2,1,0]=4 1803 B8R0.6 CCCSCC(O)CF Amb24573949 [0,1,0,0,0,0|2,1,0]=4 1804 B8R0.6 CCCSC[C@H](N)CC Amb24481830 [0,1,0,0,0,0|1,1,0]=3 1805 B8R0.6 CCCSC[C@H](O)CC Amb25344752 [0,1,0,0,0,0|1,1,0]=3 1806 B8R0.6 CCCSC[C@H](O)CN Amb24431306 [0,1,0,0,0,0|2,1,0]=4 1807 B8R0.6 CCCSSC(Cl)CC Amb24739456 [0,1,0,0,0,0|2,1,0]=4 1808 B8R0.6 CCC\C=C\C(C)CO Amb24420726 [0,1,0,0,0,0|1,0,1]=3 1809 B8R0.6 CCC\C=C\C(O)CN Amb24565967 [0,1,0,0,0,0|2,0,1]=4 1810 B8R0.6 CCC\C=C\[C@@H](N)CO Amb25331878 [0,1,0,0,0,0|1,0,1]=3 1811 B8R0.6 CCC\C=C\[C@H](O)CC Amb24657492 [0,1,0,0,0,0|2,0,1]=4 1812 B8R0.6 CCN(C)CCCCBr Amb19037649 [0,1,0,0,0,0|3,0,0]=4 1813 B8R0.6 CCN(C)CCCCCl Amb24532820 [0,1,0,0,0,0|3,0,0]=4 1814 B8R0.6 CCN(C)CCCCF Amb24457662 [0,1,0,0,0,0|3,0,0]=4 1815 B8R0.6 CCN(C)CCCCS Amb24340203 [0,1,0,0,0,0|2,1,0]=4 1816 B8R0.6 CCNCCC(C)CO Amb24697609 [0,1,0,0,0,0|2,0,0]=3 1817 B8R0.6 CCNCCC(CN)C Amb17334117 [0,1,0,0,0,0|3,0,0]=4 1818 B8R0.6 CCNCCC(O)CO Amb24424060 [0,1,0,0,0,0|2,0,0]=3 1819 B8R0.6 CCNCC[C@H](O)CO Amb24478395 [0,1,0,0,0,0|2,0,0]=3 1820 B8R0.6 CCOCCC(=O)CO Amb24478622 [0,1,0,0,0,0|2,0,1]=4 1821 B8R0.6 CCOCCC(C)CBr Amb24552402 [0,1,0,0,0,0|3,0,0]=4 1822 B8R0.6 CCOCCC(C)CCl Amb24478711 [0,1,0,0,0,0|3,0,0]=4 1823 B8R0.6 CCOCCC(C)CN Amb25765458 [0,1,0,0,0,0|3,0,0]=4 1824 B8R0.6 CCOCCC(C)CO Amb25303340 [0,1,0,0,0,0|2,0,0]=3 1825 B8R0.6 CCOCCC(N)CO Amb24388796 [0,1,0,0,0,0|2,0,0]=3 1826 B8R0.6 CCOCCC(O)CN Amb25147160 [0,1,0,0,0,0|3,0,0]=4 1827 B8R0.6 CCOCO[C@@H](C)CCl Amb24648795 [0,1,0,0,0,0|2,0,0]=3 1828 B8R0.6 CCOCSC(C)CO Amb24481646 [0,1,0,0,0,0|1,1,0]=3 1829 B8R0.6 CCONCC(O)CO Amb25715328 [0,1,0,0,0,0|3,0,0]=4 1830 B8R0.6 CCONC[C@H](O)CO Amb24391205 [0,1,0,0,0,0|3,0,0]=4 1831 B8R0.6 CCS(=O)CCCCO Amb24354490 [0,1,0,0,0,0|2,0,0]=3 1832 B8R0.6 CCSC#CC(C)CO Amb24688642 [0,1,0,0,0,0|2,0,1]=4 1833 B8R0.6 CCSCCC(C)CBr Amb25112497 [0,1,0,0,0,0|3,0,0]=4 1834 B8R0.6 CCSCCC(C)CCl Amb25829491 [0,1,0,0,0,0|3,0,0]=4 1835 B8R0.6 CCSCCC(C)CN Amb24476172 [0,1,0,0,0,0|3,0,0]=4 1836 B8R0.6 CCSCCC(N)CF Amb25233183 [0,1,0,0,0,0|3,0,0]=4 1837 B8R0.6 CCSCCC(N)CO Amb25820753 [0,1,0,0,0,0|2,0,0]=3 1838 B8R0.6 CCSCCC(O)CN Amb24581930 [0,1,0,0,0,0|3,0,0]=4 1839 B8R0.6 CCSCCC(O)CO Amb24470380 [0,1,0,0,0,0|2,0,0]=3 1840 B8R0.6 CCSC\C=C(\C)/CO Amb24529088 [0,1,0,0,0,0|2,0,1]=4 1841 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|1,0,0]=2 1842 B8R0.6 CC[C@@H](F)CCCCO Amb24454648 [0,1,0,0,0,0|1,0,0]=2 1843 B8R0.6 CC[C@@H](O)CNCC#C Amb25728290 [0,1,0,0,0,0|2,0,1]=4 1844 B8R0.6 CC[C@@H](O)CNOCC Amb24576355 [0,1,0,0,0,0|3,0,0]=4 1845 B8R0.6 CC[C@@H](O)CSCC=C Amb24588193 [0,1,0,0,0,0|1,1,1]=4 1846 B8R0.6 CC[C@@H](O)CSCCO Amb25792210 [0,1,0,0,0,0|0,1,0]=2 1847 B8R0.6 CC[C@H](C)CCCCBr Amb24623524 [0,1,0,0,0,0|2,0,0]=3 1848 B8R0.6 CC[C@H](C)CCCCN Amb24466420 [0,1,0,0,0,0|2,0,0]=3 1849 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|1,0,0]=2 1850 B8R0.6 CC[C@H](C)C\C=C\CBr Amb24480018 [0,1,0,0,0,0|2,0,1]=4 1851 B8R0.6 CC[C@H](N)CCCOC Amb24520752 [0,1,0,0,0,0|3,0,0]=4 1852 B8R0.6 CC[C@H](N)CCOCC Amb25074395 [0,1,0,0,0,0|3,0,0]=4 1853 B8R0.6 CC[C@H](N)CNCCF Amb25092345 [0,1,0,0,0,0|2,0,0]=3 1854 B8R0.6 CC[C@H](O)CNCC#C Amb24393645 [0,1,0,0,0,0|2,0,1]=4 1855 B8R0.6 CC[C@H](O)CNCC=C Amb24660761 [0,1,0,0,0,0|2,0,1]=4 1856 B8R0.6 CC[C@H](O)CNCCN Amb24466127 [0,1,0,0,0,0|2,0,0]=3 1857 B8R0.6 CC[C@H](O)CNCCO Amb25703084 [0,1,0,0,0,0|1,0,0]=2 1858 B8R0.6 CC[C@H](O)CNOCC Amb24528394 [0,1,0,0,0,0|3,0,0]=4 1859 B8R0.6 CC[C@H](O)CSCC=C Amb24475269 [0,1,0,0,0,0|1,1,1]=4 1860 B8R0.6 CC[C@H](O)CSCCO Amb25686957 [0,1,0,0,0,0|0,1,0]=2 1861 B8R0.6 CC[C@H](O)C\C=C\CC Amb25145390 [0,1,0,0,0,0|2,0,1]=4 1862 B8R0.6 CC\C=C\C[C@@H](O)CO Amb25234851 [0,1,0,0,0,0|1,0,2]=4 1863 B8R0.6 CNC(=O)COCCCl Amb25844524 [0,1,0,0,0,0|2,0,1]=4 1864 B8R0.6 CNC(=O)COCCN Amb19016737 [0,1,0,0,0,0|2,0,1]=4 1865 B8R0.6 CNC(=O)COCCN Amb24271094 [0,1,0,0,0,0|2,0,1]=4 1866 B8R0.6 CNC(C)CCCCF Amb24500284 [0,1,0,0,0,0|3,0,0]=4 1867 B8R0.6 CNC(C)CCCCN Amb25709671 [0,1,0,0,0,0|3,0,0]=4 1868 B8R0.6 CNC(C)CNCCF Amb24543609 [0,1,0,0,0,0|3,0,0]=4 1869 B8R0.6 CNCCCC(C)CCl Amb25691992 [0,1,0,0,0,0|3,0,0]=4 1870 B8R0.6 CNCCCC(C)CN Amb25776699 [0,1,0,0,0,0|3,0,0]=4 1871 B8R0.6 CNCCCC(CO)C Amb17569924 [0,1,0,0,0,0|2,0,0]=3 1872 B8R0.6 CNCCCC(O)CO Amb25185204 [0,1,0,0,0,0|2,0,0]=3 1873 B8R0.6 CNCCC[C@@H](O)CO Amb24745507 [0,1,0,0,0,0|2,0,0]=3 1874 B8R0.6 CNCCC[C@H](O)CO Amb25747324 [0,1,0,0,0,0|2,0,0]=3 1875 B8R0.6 CNCCOC(C)C#N Amb19020589 [0,1,0,0,0,0|2,0,1]=4 1876 B8R0.6 CNCCOC(C)CO Amb25705477 [0,1,0,0,0,0|1,0,0]=2 1877 B8R0.6 CNCCSC(C)CN Amb24398870 [0,1,0,0,0,0|2,1,0]=4 1878 B8R0.6 CN[C@@H](C)CNCCC Amb25351170 [0,1,0,0,0,0|3,0,0]=4 1879 B8R0.6 COC(=N)COCCC Amb25783562 [0,1,0,0,0,0|2,0,1]=4 1880 B8R0.6 COC(=O)CCCCO Amb22641583 [0,1,0,0,0,0|2,0,1]=4 1881 B8R0.6 COC(=O)COCCN Amb24401799 [0,1,0,0,0,0|2,0,1]=4 1882 B8R0.6 COC(=O)COCCO Amb24113538 [0,1,0,0,0,0|1,0,1]=3 1883 B8R0.6 COC(=O)NOCCO Amb24570213 [0,1,0,0,0,0|2,0,1]=4 1884 B8R0.6 COC(C)CCCCO Amb25835593 [0,1,0,0,0,0|2,0,0]=3 1885 B8R0.6 COC(C)CNCCF Amb25771458 [0,1,0,0,0,0|3,0,0]=4 1886 B8R0.6 COC(C)CNCCI Amb24445996 [0,1,0,0,0,0|3,0,0]=4 1887 B8R0.6 COC(C)CNCCN Amb24422649 [0,1,0,0,0,0|3,0,0]=4 1888 B8R0.6 COC(C)CNCCO Amb24481699 [0,1,0,0,0,0|2,0,0]=3 1889 B8R0.6 COC(C)COCCCl Amb25737254 [0,1,0,0,0,0|2,0,0]=3 1890 B8R0.6 COC(C)COCCN Amb24422648 [0,1,0,0,0,0|2,0,0]=3 1891 B8R0.6 COC(C)CSCCN Amb25768094 [0,1,0,0,0,0|2,1,0]=4 1892 B8R0.6 COC(C)OCCCBr Amb25146224 [0,1,0,0,0,0|3,0,0]=4 1893 B8R0.6 COC(C)OCCCO Amb25852902 [0,1,0,0,0,0|3,0,0]=4 1894 B8R0.6 COC(C)\C=C\CCO Amb24534640 [0,1,0,0,0,0|2,0,1]=4 1895 B8R0.6 COC(Cl)COCCO Amb24403148 [0,1,0,0,0,0|1,0,0]=2 1896 B8R0.6 COCCCC(C)CBr Amb24692425 [0,1,0,0,0,0|3,0,0]=4 1897 B8R0.6 COCCCC(C)CCl Amb24340257 [0,1,0,0,0,0|3,0,0]=4 1898 B8R0.6 COCCCC(C)CO Amb24478636 [0,1,0,0,0,0|2,0,0]=3 1899 B8R0.6 COCCCC(C)NO Amb24739871 [0,1,0,0,0,0|3,0,0]=4 1900 B8R0.6 COCCCC(CN)C Amb17569944 [0,1,0,0,0,0|3,0,0]=4 1901 B8R0.6 COCCCC(Cl)CCl Amb25765569 [0,1,0,0,0,0|3,0,0]=4 1902 B8R0.6 COCCCC(O)CCl Amb24594734 [0,1,0,0,0,0|3,0,0]=4 1903 B8R0.6 COCCNC(C)CN Amb25375025 [0,1,0,0,0,0|3,0,0]=4 1904 B8R0.6 COCCN[C@@H](C)CN Amb25304316 [0,1,0,0,0,0|3,0,0]=4 1905 B8R0.6 COCCOC(=O)CBr Amb18602737 [0,1,0,0,0,0|2,0,1]=4 1906 B8R0.6 COCCOC(=O)CCl Amb18090807 [0,1,0,0,0,0|2,0,1]=4 1907 B8R0.6 COCCOC(O)CC Amb25681799 [0,1,0,0,0,0|2,0,0]=3 1908 B8R0.6 COCCO\C(\N)=N/O Amb24476699 [0,1,0,0,0,0|2,0,1]=4 1909 B8R0.6 COCCSC(C)CCl Amb24439861 [0,1,0,0,0,0|2,1,0]=4 1910 B8R0.6 COCOCC(=O)CC Amb24588919 [0,1,0,0,0,0|2,0,1]=4 1911 B8R0.6 COCOCC(C)CO Amb25275100 [0,1,0,0,0,0|3,0,0]=4 1912 B8R0.6 COCOC[C@@H](C)CBr Amb24479984 [0,1,0,0,0,0|3,0,0]=4 1913 B8R0.6 COCOC[C@@H](C)CO Amb24478614 [0,1,0,0,0,0|3,0,0]=4 1914 B8R0.6 COCOC[C@@H](N)CO Amb25800330 [0,1,0,0,0,0|3,0,0]=4 1915 B8R0.6 COCSCC(C)CO Amb24729873 [0,1,0,0,0,0|3,0,0]=4 1916 B8R0.6 CO[C@H](C)C\C=C\CO Amb24581800 [0,1,0,0,0,0|2,0,1]=4 1917 B8R0.6 CSC(C)\C=C\CCO Amb24371234 [0,1,0,0,0,0|2,0,1]=4 1918 B8R0.6 CSCCCC(C)CCl Amb25333579 [0,1,0,0,0,0|3,0,0]=4 1919 B8R0.6 CSCCCC(N)CN Amb24670821 [0,1,0,0,0,0|3,0,0]=4 1920 B8R0.6 CSCCCC(O)CN Amb25809175 [0,1,0,0,0,0|3,0,0]=4 1921 B8R0.6 CSCCNC(C)CCl Amb24413564 [0,1,0,0,0,0|3,0,0]=4 1922 B8R0.6 CSCCN[C@@H](C)CN Amb25141704 [0,1,0,0,0,0|3,0,0]=4 1923 B8R0.6 CSCCOC(=O)CBr Amb24480366 [0,1,0,0,0,0|2,0,1]=4 1924 B8R0.6 CSCCOC(=O)CN Amb24386088 [0,1,0,0,0,0|2,0,1]=4 1925 B8R0.6 CSCCSC(C)CCl Amb25830173 [0,1,0,0,0,0|2,1,0]=4 1926 B8R0.6 CSCCSC(C)CN Amb25307914 [0,1,0,0,0,0|2,1,0]=4 1927 B8R0.6 CSCCSC(C)CO Amb25681739 [0,1,0,0,0,0|1,1,0]=3 1928 B8R0.6 CSCSCC(C)CC Amb25728646 [0,1,0,0,0,0|2,1,0]=4 1929 B8R0.6 CSCSCC(N)CO Amb25147057 [0,1,0,0,0,0|3,0,0]=4 1930 B8R0.6 CSCSC[C@@H](N)CO Amb24390968 [0,1,0,0,0,0|3,0,0]=4 1931 B8R0.6 CSCSC[C@H](N)CO Amb25147126 [0,1,0,0,0,0|3,0,0]=4 1932 B8R0.6 C[C@@H](CO)CCCC=C Amb24752506 [0,1,0,0,0,0|1,0,2]=4 1933 B8R0.6 C[C@H](CCCCO)CO Amb24407518 [0,1,0,0,0,0|2,0,0]=3 1934 B8R0.6 C[C@H](CO)CCCC=C Amb25147216 [0,1,0,0,0,0|1,0,2]=4 1935 B8R0.6 C\C(\CO)=C/CCCN Amb24555629 [0,1,0,0,0,0|2,0,1]=4 1936 B8R0.6 C\C(\CO)=C\CCCBr Amb25288077 [0,1,0,0,0,0|2,0,1]=4 1937 B8R0.6 C\C=C\CNC(C)CO Amb24674772 [0,1,0,0,0,0|1,0,2]=4 1938 B8R0.6 C\C=C\COC(C)CN Amb19025025 [0,1,0,0,0,0|1,0,2]=4 1939 B8R0.6 ClCC(Cl)CCCCBr Amb24063181 [0,1,0,0,0,0|3,0,0]=4 1940 B8R0.6 ClCCCCC(Cl)CCl Amb24429183 [0,1,0,0,0,0|3,0,0]=4 1941 B8R0.6 ClCCSCC(Cl)CCl Amb24453176 [0,1,0,0,0,0|2,1,0]=4 1942 B8R0.6 N#CC(Cl)COCCCl Amb25105485 [0,1,0,0,0,0|2,0,1]=4 1943 B8R0.6 N#CC(Cl)CSCCO Amb25823980 [0,1,0,0,0,0|1,1,1]=4 1944 B8R0.6 N#CCCCC(O)CO Amb18642704 [0,1,0,0,0,0|2,0,1]=4 1945 B8R0.6 NC(CO)CCCCF Amb24689590 [0,1,0,0,0,0|2,0,0]=3 1946 B8R0.6 NC(CO)COCC#N Amb25055043 [0,1,0,0,0,0|2,0,1]=4 1947 B8R0.6 NC(CO)COCCF Amb25732255 [0,1,0,0,0,0|2,0,0]=3 1948 B8R0.6 NCC(O)CNCCO Amb25111564 [0,1,0,0,0,0|2,0,0]=3 1949 B8R0.6 NCC(O)CNCCS Amb25690972 [0,1,0,0,0,0|2,1,0]=4 1950 B8R0.6 NCC(O)CSCCO Amb24651274 [0,1,0,0,0,0|1,1,0]=3 1951 B8R0.6 NCCCCC(N)CBr Amb24480286 [0,1,0,0,0,0|3,0,0]=4 1952 B8R0.6 NCCCCC(N)CF Amb24746288 [0,1,0,0,0,0|3,0,0]=4 1953 B8R0.6 NCCCCC(O)CN Amb25237523 [0,1,0,0,0,0|3,0,0]=4 1954 B8R0.6 NCCCCC(O)CO Amb25146035 [0,1,0,0,0,0|2,0,0]=3 1955 B8R0.6 NCCCCC(OC)C Amb17569941 [0,1,0,0,0,0|3,0,0]=4 1956 B8R0.6 NCCCC[C@@H](N)CO Amb22745902 [0,1,0,0,0,0|2,0,0]=3 1957 B8R0.6 NCCCC[C@@H](N)CO Amb22899644 [0,1,0,0,0,0|2,0,0]=3 1958 B8R0.6 NCCCC[C@@H](N)CO Amb22899645 [0,1,0,0,0,0|2,0,0]=3 1959 B8R0.6 NCCCC[C@@H](N)CS Amb25303104 [0,1,0,0,0,0|2,1,0]=4 1960 B8R0.6 NCCCC[C@H](N)CBr Amb24557770 [0,1,0,0,0,0|3,0,0]=4 1961 B8R0.6 NCCCNC(CC)C Amb17315265 [0,1,0,0,0,0|3,0,0]=4 1962 B8R0.6 NCCNCC(O)CF Amb25026537 [0,1,0,0,0,0|3,0,0]=4 1963 B8R0.6 NCCNCC(O)CN Amb24392521 [0,1,0,0,0,0|3,0,0]=4 1964 B8R0.6 NCCOCC(O)CN Amb25826033 [0,1,0,0,0,0|2,0,0]=3 1965 B8R0.6 NCCOCC(O)CO Amb25707105 [0,1,0,0,0,0|2,0,0]=3 1966 B8R0.6 NCCSCC(O)CF Amb25263910 [0,1,0,0,0,0|2,1,0]=4 1967 B8R0.6 NCCSCC(O)CO Amb21978836 [0,1,0,0,0,0|2,1,0]=4 1968 B8R0.6 NNC(=O)COCCO Amb24674170 [0,1,0,0,0,0|2,0,1]=4 1969 B8R0.6 N[C@@H](CCCCO)CO Amb25146173 [0,1,0,0,0,0|2,0,0]=3 1970 B8R0.6 N[C@@H](CO)COCCF Amb24666126 [0,1,0,0,0,0|2,0,0]=3 1971 B8R0.6 N[C@H](COCCO)CO Amb24451328 [0,1,0,0,0,0|1,0,0]=2 1972 B8R0.6 O=C(CBr)OCCCCl Amb25117915 [0,1,0,0,0,0|2,0,1]=4 1973 B8R0.6 O=CC(Cl)COCCCl Amb24480060 [0,1,0,0,0,0|2,0,1]=4 1974 B8R0.6 OC(CO)COCC#C Amb16232583 [0,1,0,0,0,0|2,0,1]=4 1975 B8R0.6 OCC(F)CCCCCl Amb24480364 [0,1,0,0,0,0|2,0,0]=3 1976 B8R0.6 OCC(O)CC#CCO Amb25266438 [0,1,0,0,0,0|2,0,1]=4 1977 B8R0.6 OCC(O)CCCC=O Amb25253900 [0,1,0,0,0,0|2,0,1]=4 1978 B8R0.6 OCC(O)C\C=C\CO Amb25852753 [0,1,0,0,0,0|2,0,1]=4 1979 B8R0.6 OCCCCC(=O)NC Amb17231874 [0,1,0,0,0,0|2,0,1]=4 1980 B8R0.6 OCCCCC(C#N)O Amb17593356 [0,1,0,0,0,0|2,0,1]=4 1981 B8R0.6 OCCCCC(CO)N Amb17593402 [0,1,0,0,0,0|2,0,0]=3 1982 B8R0.6 OCCCCC(Cl)CCl Amb24443036 [0,1,0,0,0,0|2,0,0]=3 1983 B8R0.6 OCCCCC(F)CBr Amb25708352 [0,1,0,0,0,0|2,0,0]=3 1984 B8R0.6 OCCCCC(NC)C Amb17569927 [0,1,0,0,0,0|2,0,0]=3 1985 B8R0.6 OCCCC[C@@H](O)CO Amb25800817 [0,1,0,0,0,0|2,0,0]=3 1986 B8R0.6 OCCCOC(=O)CBr Amb25300340 [0,1,0,0,0,0|2,0,1]=4 1987 B8R0.6 OCCNCC(O)CCl Amb25683825 [0,1,0,0,0,0|2,0,0]=3 1988 B8R0.6 OCCNCC(O)CF Amb24571143 [0,1,0,0,0,0|2,0,0]=3 1989 B8R0.6 OCCNCC(O)CO Amb25288018 [0,1,0,0,0,0|2,0,0]=3 1990 B8R0.6 OCCOCC(=O)CO Amb25357331 [0,1,0,0,0,0|1,0,1]=3 1991 B8R0.6 OCCOCC(Br)=CBr Amb24093576 [0,1,0,0,0,0|1,0,2]=4 1992 B8R0.6 OCCOCC(Cl)CCl Amb24479982 [0,1,0,0,0,0|1,0,0]=2 1993 B8R0.6 OCCOCC(O)CO Amb24094023 [0,1,0,0,0,0|1,0,0]=2 1994 B8R0.6 OCCOCC(S)CS Amb25145386 [0,1,0,0,0,0|1,0,0]=2 1995 B8R0.6 OC[C@@H](F)CCCCCl Amb25068378 [0,1,0,0,0,0|2,0,0]=3 1996 B8R0.6 OC[C@H](O)C\C=C\CO Amb25783452 [0,1,0,0,0,0|2,0,1]=4 1997 B8R0.6 O[C@@H](COCCCl)CCl Amb24524181 [0,1,0,0,0,0|2,0,0]=3 1998 B8R0.6 O[C@H](COCCCl)CCl Amb24753582 [0,1,0,0,0,0|2,0,0]=3 1999 B8R0.7 BrCCCCCC(=O)O Amb2081955 [0,1,0,0,0,0|2,0,1]=4 2000 B8R0.7 BrCCCCCC(C)C Amb16231055 [0,1,0,0,0,0|2,0,0]=3 2001 B8R0.7 C=C(Br)COCCCN Amb18324685 [0,1,0,0,0,0|2,0,1]=4 2002 B8R0.7 C=C(Br)COCCCO Amb24534702 [0,1,0,0,0,0|2,0,1]=4 2003 B8R0.7 C=C(Cl)COCCCO Amb25240270 [0,1,0,0,0,0|2,0,1]=4 2004 B8R0.7 CC#CCCCC(C)O Amb25280700 [0,1,0,0,0,0|1,0,2]=4 2005 B8R0.7 CC#CCCC[C@H](C)O Amb25794779 [0,1,0,0,0,0|1,0,2]=4 2006 B8R0.7 CC#CCNC[C@H](C)O Amb24644246 [0,1,0,0,0,0|1,0,2]=4 2007 B8R0.7 CC(=C)CC#CCCO Amb24642389 [0,1,0,0,0,0|1,0,2]=4 2008 B8R0.7 CC(=C)CCCCCN Amb24481805 [0,1,0,0,0,0|2,0,1]=4 2009 B8R0.7 CC(=C)CCNCCF Amb25315419 [0,1,0,0,0,0|2,0,1]=4 2010 B8R0.7 CC(=C)CCNCCN Amb24481806 [0,1,0,0,0,0|2,0,1]=4 2011 B8R0.7 CC(=C)CCNCCO Amb25189006 [0,1,0,0,0,0|1,0,1]=3 2012 B8R0.7 CC(=C)CCOCC#N Amb25304924 [0,1,0,0,0,0|1,0,2]=4 2013 B8R0.7 CC(=C)CCOCC=O Amb25275299 [0,1,0,0,0,0|0,0,3]=4 2014 B8R0.7 CC(=C)CCOCCCl Amb24684688 [0,1,0,0,0,0|1,0,1]=3 2015 B8R0.7 CC(=C)CCOCCS Amb25331620 [0,1,0,0,0,0|0,1,1]=3 2016 B8R0.7 CC(=C)CC\C=C\CO Amb25245055 [0,1,0,0,0,0|1,0,2]=4 2017 B8R0.7 CC(=C)COCCCO Amb25185310 [0,1,0,0,0,0|2,0,1]=4 2018 B8R0.7 CC(=O)CCCCCF Amb25373197 [0,1,0,0,0,0|2,0,1]=4 2019 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,1,0,0,0,0|2,0,1]=4 2020 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,1,0,0,0,0|2,0,1]=4 2021 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,1,0,0,0,0|1,0,1]=3 2022 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,1,0,0,0,0|1,0,1]=3 2023 B8R0.7 CC(=O)CCOCCO Amb24691100 [0,1,0,0,0,0|0,0,1]=2 2024 B8R0.7 CC(=O)CC\C=C\CO Amb24614693 [0,1,0,0,0,0|1,0,2]=4 2025 B8R0.7 CC(=O)COCCCF Amb24696366 [0,1,0,0,0,0|1,0,2]=4 2026 B8R0.7 CC(=O)COCCCN Amb18630475 [0,1,0,0,0,0|1,0,2]=4 2027 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,1,0,0,0,0|2,0,1]=4 2028 B8R0.7 CC(=O)OCOCCCl Amb25145955 [0,1,0,0,0,0|2,0,1]=4 2029 B8R0.7 CC(=O)OCSCCO Amb24733466 [0,1,0,0,0,0|1,1,1]=4 2030 B8R0.7 CC(=O)SCCCCO Amb25049205 [0,1,0,0,0,0|2,0,1]=4 2031 B8R0.7 CC(=O)\C=C\OCCO Amb25318892 [0,1,0,0,0,0|0,0,3]=4 2032 B8R0.7 CC(Br)=CCCCCO Amb24592453 [0,1,0,0,0,0|1,0,2]=4 2033 B8R0.7 CC(C)=CCOCCN Amb19020763 [0,1,0,0,0,0|1,0,2]=4 2034 B8R0.7 CC(C)=CCOCCO Amb24718314 [0,1,0,0,0,0|0,0,2]=3 2035 B8R0.7 CC(C)C=C=CCCO Amb24642388 [0,1,0,0,0,0|1,0,2]=4 2036 B8R0.7 CC(C)C=NNCCO Amb24644241 [0,1,0,0,0,0|2,0,1]=4 2037 B8R0.7 CC(C)CC=NCCO Amb24464832 [0,1,0,0,0,0|1,0,1]=3 2038 B8R0.7 CC(C)CCCCC#C Amb24628581 [0,1,0,0,0,0|2,0,1]=4 2039 B8R0.7 CC(C)CCCCC#N Amb25079358 [0,1,0,0,0,0|2,0,1]=4 2040 B8R0.7 CC(C)CCCCC=O Amb18642674 [0,1,0,0,0,0|1,0,2]=4 2041 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|2,0,0]=3 2042 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|1,0,0]=2 2043 B8R0.7 CC(C)CCCCCS Amb25809917 [0,1,0,0,0,0|1,1,0]=3 2044 B8R0.7 CC(C)CCCC[Zn]Cl Amb22897836 [0,1,0,0,0,0|3,0,0]=4 2045 B8R0.7 CC(C)CCNCCBr Amb25721799 [0,1,0,0,0,0|2,0,0]=3 2046 B8R0.7 CC(C)CCNCCS Amb24481915 [0,1,0,0,0,0|1,1,0]=3 2047 B8R0.7 CC(C)CCSCC=C Amb24481924 [0,1,0,0,0,0|1,1,1]=4 2048 B8R0.7 CC(C)CCSCCCl Amb24080319 [0,1,0,0,0,0|1,1,0]=3 2049 B8R0.7 CC(C)CCSCCS Amb25360167 [0,1,0,0,0,0|0,2,0]=3 2050 B8R0.7 CC(C)CC\C=C\CBr Amb24711376 [0,1,0,0,0,0|2,0,1]=4 2051 B8R0.7 CC(C)CNCCCF Amb25808343 [0,1,0,0,0,0|3,0,0]=4 2052 B8R0.7 CC(C)CNCCCI Amb25071160 [0,1,0,0,0,0|3,0,0]=4 2053 B8R0.7 CC(C)CNOCC=O Amb25839254 [0,1,0,0,0,0|1,0,2]=4 2054 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|2,0,0]=3 2055 B8R0.7 CC(C)COCCNN Amb25237286 [0,1,0,0,0,0|3,0,0]=4 2056 B8R0.7 CC(C)CONCCN Amb25115524 [0,1,0,0,0,0|3,0,0]=4 2057 B8R0.7 CC(C)CONCCO Amb25100547 [0,1,0,0,0,0|2,0,0]=3 2058 B8R0.7 CC(C)CSCCCF Amb25720971 [0,1,0,0,0,0|2,1,0]=4 2059 B8R0.7 CC(C)C\C=C\CCBr Amb24677703 [0,1,0,0,0,0|2,0,1]=4 2060 B8R0.7 CC(C)C\C=C\CCN Amb24663963 [0,1,0,0,0,0|2,0,1]=4 2061 B8R0.7 CC(C)C\C=C\CCO Amb24340184 [0,1,0,0,0,0|1,0,1]=3 2062 B8R0.7 CC(C)NCCCCBr Amb18130023 [0,1,0,0,0,0|3,0,0]=4 2063 B8R0.7 CC(C)NCCCCI Amb24374889 [0,1,0,0,0,0|3,0,0]=4 2064 B8R0.7 CC(C)OCCCCCl Amb18181677 [0,1,0,0,0,0|3,0,0]=4 2065 B8R0.7 CC(C)OCCCCO Amb24704996 [0,1,0,0,0,0|2,0,0]=3 2066 B8R0.7 CC(C)OCOCCO Amb25720108 [0,1,0,0,0,0|1,0,0]=2 2067 B8R0.7 CC(C)OCSCCO Amb25207888 [0,1,0,0,0,0|1,1,0]=3 2068 B8R0.7 CC(C)OC\C=C\CO Amb24353069 [0,1,0,0,0,0|2,0,1]=4 2069 B8R0.7 CC(C)ONCCCO Amb25272673 [0,1,0,0,0,0|3,0,0]=4 2070 B8R0.7 CC(C)SCCCCCl Amb18798740 [0,1,0,0,0,0|3,0,0]=4 2071 B8R0.7 CC(C)SSSCCO Amb25781208 [0,1,0,0,0,0|2,1,0]=4 2072 B8R0.7 CC(C)\C=C\OCCO Amb24387717 [0,1,0,0,0,0|0,0,2]=3 2073 B8R0.7 CC(Cl)CCCCC=O Amb18643832 [0,1,0,0,0,0|1,0,2]=4 2074 B8R0.7 CC(Cl)CCCCCBr Amb25677474 [0,1,0,0,0,0|2,0,0]=3 2075 B8R0.7 CC(Cl)CCNCCF Amb24391977 [0,1,0,0,0,0|2,0,0]=3 2076 B8R0.7 CC(Cl)CCOCCBr Amb24350524 [0,1,0,0,0,0|1,0,0]=2 2077 B8R0.7 CC(Cl)CSSCCCl Amb25789892 [0,1,0,0,0,0|2,1,0]=4 2078 B8R0.7 CC(F)CCOCCN Amb25178805 [0,1,0,0,0,0|1,0,0]=2 2079 B8R0.7 CC(F)CCSCCO Amb24475537 [0,1,0,0,0,0|0,1,0]=2 2080 B8R0.7 CC(F)COCCCN Amb24574356 [0,1,0,0,0,0|2,0,0]=3 2081 B8R0.7 CC(N)CCCCC#C Amb25147187 [0,1,0,0,0,0|2,0,1]=4 2082 B8R0.7 CC(N)CCCCC=C Amb22059559 [0,1,0,0,0,0|2,0,1]=4 2083 B8R0.7 CC(N)CCCCCBr Amb24419034 [0,1,0,0,0,0|2,0,0]=3 2084 B8R0.7 CC(N)CCCCCN Amb24401531 [0,1,0,0,0,0|2,0,0]=3 2085 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|1,0,0]=2 2086 B8R0.7 CC(N)CCNCCF Amb25260664 [0,1,0,0,0,0|2,0,0]=3 2087 B8R0.7 CC(N)CCNCCN Amb25757439 [0,1,0,0,0,0|2,0,0]=3 2088 B8R0.7 CC(N)CCSCC=C Amb24595713 [0,1,0,0,0,0|1,1,1]=4 2089 B8R0.7 CC(N)CCSCCN Amb25707301 [0,1,0,0,0,0|1,1,0]=3 2090 B8R0.7 CC(N)CNCCCN Amb25052107 [0,1,0,0,0,0|3,0,0]=4 2091 B8R0.7 CC(O)C=NOCCO Amb25769348 [0,1,0,0,0,0|1,0,1]=3 2092 B8R0.7 CC(O)CC#CCCO Amb24450974 [0,1,0,0,0,0|1,0,1]=3 2093 B8R0.7 CC(O)CCCCC=C Amb25724721 [0,1,0,0,0,0|1,0,2]=4 2094 B8R0.7 CC(O)CCCCC=O Amb25366189 [0,1,0,0,0,0|1,0,2]=4 2095 B8R0.7 CC(O)CCCCCN Amb24761457 [0,1,0,0,0,0|2,0,0]=3 2096 B8R0.7 CC(O)CCNCC#C Amb24692421 [0,1,0,0,0,0|2,0,1]=4 2097 B8R0.7 CC(O)CCNCC#N Amb24382411 [0,1,0,0,0,0|2,0,1]=4 2098 B8R0.7 CC(O)CCNCC=C Amb24478583 [0,1,0,0,0,0|2,0,1]=4 2099 B8R0.7 CC(O)CCNCCO Amb25274565 [0,1,0,0,0,0|1,0,0]=2 2100 B8R0.7 CC(O)CCSCCN Amb25347026 [0,1,0,0,0,0|1,1,0]=3 2101 B8R0.7 CC(O)CC\C=C\CO Amb25332486 [0,1,0,0,0,0|1,0,1]=3 2102 B8R0.7 CC(O)CNCCC#C Amb25361889 [0,1,0,0,0,0|1,0,2]=4 2103 B8R0.7 CC(O)CNCCCS Amb24524151 [0,1,0,0,0,0|2,0,0]=3 2104 B8R0.7 CC(O)COCCC=O Amb18642881 [0,1,0,0,0,0|1,0,1]=3 2105 B8R0.7 CC(O)COCCCO Amb25266204 [0,1,0,0,0,0|1,0,0]=2 2106 B8R0.7 CC(O)CSCCCN Amb25188929 [0,1,0,0,0,0|1,1,0]=3 2107 B8R0.7 CC(O)CSCCCO Amb25188928 [0,1,0,0,0,0|1,1,0]=3 2108 B8R0.7 CC(O)\C=C\CCCO Amb24481909 [0,1,0,0,0,0|1,0,2]=4 2109 B8R0.7 CC(S)CNCCCN Amb25146055 [0,1,0,0,0,0|2,1,0]=4 2110 B8R0.7 CC(S)CSCCCO Amb24532907 [0,1,0,0,0,0|2,0,0]=3 2111 B8R0.7 CCC#CCCC(C)C Amb22230156 [0,1,0,0,0,0|2,0,1]=4 2112 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,1,0,0,0,0|1,0,2]=4 2113 B8R0.7 CCCC/C=C/C(O)=O Amb17778752 [0,1,0,0,0,0|1,0,2]=4 2114 B8R0.7 CCCCC#CC(C)Cl Amb25065847 [0,1,0,0,0,0|2,0,1]=4 2115 B8R0.7 CCCCC#CC(O)O Amb24372063 [0,1,0,0,0,0|1,0,1]=3 2116 B8R0.7 CCCCC#C[C@H](C)O Amb25333630 [0,1,0,0,0,0|1,0,1]=3 2117 B8R0.7 CCCCCCB(F)F Amb24621934 [0,1,0,0,0,0|3,0,0]=4 2118 B8R0.7 CCCCCCC(Cl)Cl Amb17672867 [0,1,0,0,0,0|2,0,0]=3 2119 B8R0.7 CCCCCCC(N)O Amb25368398 [0,1,0,0,0,0|1,0,0]=2 2120 B8R0.7 CCCCCCC([O-])=O Amb22729026 [0,1,0,0,0,0|1,0,2]=4 2121 B8R0.7 CCCCCCP(Cl)Cl Amb23595443 [0,1,0,0,0,0|3,0,0]=4 2122 B8R0.7 CCCCCCS(O)=O Amb25213753 [0,1,0,0,0,0|2,0,0]=3 2123 B8R0.7 CCCCCC[C@@H](C)Cl Amb25322077 [0,1,0,0,0,0|2,0,0]=3 2124 B8R0.7 CCCCCC[C@H](C)Cl Amb25691447 [0,1,0,0,0,0|2,0,0]=3 2125 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,1,0,0,0,0|2,0,1]=4 2126 B8R0.7 CCCCCC[SiH](C)C Amb19893898 [0,1,0,0,0,0|2,1,0]=4 2127 B8R0.7 CCCCCC[SiH](Cl)Cl Amb22733063 [0,1,0,0,0,0|2,1,0]=4 2128 B8R0.7 CCCCCOB(O)O Amb24716868 [0,1,0,0,0,0|3,0,0]=4 2129 B8R0.7 CCCCCOC(C)Cl Amb25074170 [0,1,0,0,0,0|3,0,0]=4 2130 B8R0.7 CCCCCOS(O)=O Amb22730504 [0,1,0,0,0,0|3,0,0]=4 2131 B8R0.7 CCCCN=CC(C)Cl Amb25731865 [0,1,0,0,0,0|2,0,1]=4 2132 B8R0.7 CCCCNCC(=C)Br Amb1772531 [0,1,0,0,0,0|2,0,1]=4 2133 B8R0.7 CCCCNCC(=C)Br Amb18320824 [0,1,0,0,0,0|2,0,1]=4 2134 B8R0.7 CCCCNCC(=C)C Amb17308646 [0,1,0,0,0,0|2,0,1]=4 2135 B8R0.7 CCCCNCC(=C)Cl Amb25717833 [0,1,0,0,0,0|2,0,1]=4 2136 B8R0.7 CCCCNCC(=O)N Amb1126543 [0,1,0,0,0,0|1,0,2]=4 2137 B8R0.7 CCCCNCC(C)Cl Amb24631280 [0,1,0,0,0,0|2,0,0]=3 2138 B8R0.7 CCCCNCC(C)S Amb18644348 [0,1,0,0,0,0|1,1,0]=3 2139 B8R0.7 CCCCNCC(Cl)Cl Amb25285881 [0,1,0,0,0,0|2,0,0]=3 2140 B8R0.7 CCCCNC[C@@H](C)N Amb25369720 [0,1,0,0,0,0|2,0,0]=3 2141 B8R0.7 CCCCNC[C@@H](C)O Amb25330080 [0,1,0,0,0,0|1,0,0]=2 2142 B8R0.7 CCCCNC[C@H](C)N Amb25334125 [0,1,0,0,0,0|2,0,0]=3 2143 B8R0.7 CCCCNOC(C)C Amb24578023 [0,1,0,0,0,0|3,0,0]=4 2144 B8R0.7 CCCCOCC(=O)Cl Amb25806749 [0,1,0,0,0,0|0,0,2]=3 2145 B8R0.7 CCCCOCC(C)=C Amb22641495 [0,1,0,0,0,0|1,0,1]=3 2146 B8R0.7 CCCCOCN(C)C Amb25798484 [0,1,0,0,0,0|2,0,0]=3 2147 B8R0.7 CCCCOC[C@H](C)O Amb25780304 [0,1,0,0,0,0|0,0,0]=1 2148 B8R0.7 CCCCONC(C)=O Amb25057412 [0,1,0,0,0,0|1,0,2]=4 2149 B8R0.7 CCCCONC(N)=N Amb25041461 [0,1,0,0,0,0|2,0,1]=4 2150 B8R0.7 CCCCSCC(=C)Br Amb25804377 [0,1,0,0,0,0|1,1,1]=4 2151 B8R0.7 CCCCSCC(=C)Cl Amb24403543 [0,1,0,0,0,0|1,1,1]=4 2152 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,1,0,0,0,0|0,1,1]=3 2153 B8R0.7 CCCCSC[C@@H](C)N Amb24711042 [0,1,0,0,0,0|1,1,0]=3 2154 B8R0.7 CCCCSC[C@@H](C)O Amb24644245 [0,1,0,0,0,0|0,1,0]=2 2155 B8R0.7 CCCCSC[C@H](C)O Amb25283172 [0,1,0,0,0,0|0,1,0]=2 2156 B8R0.7 CCCC\C=C/B(O)O Amb25727222 [0,1,0,0,0,0|2,0,1]=4 2157 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [0,1,0,0,0,0|2,0,1]=4 2158 B8R0.7 CCCC\C=C\C(C)C Amb24614606 [0,1,0,0,0,0|2,0,1]=4 2159 B8R0.7 CCCC\C=C\C(C)O Amb22052697 [0,1,0,0,0,0|1,0,1]=3 2160 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,1,0,0,0,0|2,0,1]=4 2161 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,1,0,0,0,0|2,0,1]=4 2162 B8R0.7 CCCNCCC(C)N Amb25778705 [0,1,0,0,0,0|2,0,0]=3 2163 B8R0.7 CCCNCCC(C)O Amb25361918 [0,1,0,0,0,0|2,0,0]=3 2164 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|3,0,0]=4 2165 B8R0.7 CCCNCCC(O)=O Amb18633174 [0,1,0,0,0,0|2,0,1]=4 2166 B8R0.7 CCCNCCN(C)C Amb1131117 [0,1,0,0,0,0|3,0,0]=4 2167 B8R0.7 CCCNCCN(C)C Amb19515715 [0,1,0,0,0,0|3,0,0]=4 2168 B8R0.7 CCCNCCN(C)C Amb22292471 [0,1,0,0,0,0|3,0,0]=4 2169 B8R0.7 CCCNOCC(N)=O Amb25694035 [0,1,0,0,0,0|1,0,2]=4 2170 B8R0.7 CCCOCCC(Cl)Cl Amb25299432 [0,1,0,0,0,0|2,0,0]=3 2171 B8R0.7 CCCOCCN(C)C Amb24457325 [0,1,0,0,0,0|2,0,0]=3 2172 B8R0.7 CCCONCC(C)=C Amb25708080 [0,1,0,0,0,0|2,0,1]=4 2173 B8R0.7 CCCONCC(C)O Amb24711848 [0,1,0,0,0,0|2,0,0]=3 2174 B8R0.7 CCCONC[C@@H](C)O Amb25349543 [0,1,0,0,0,0|2,0,0]=3 2175 B8R0.7 CCCONC[C@H](C)O Amb25749182 [0,1,0,0,0,0|2,0,0]=3 2176 B8R0.7 CCCSCCC(C)=C Amb25780872 [0,1,0,0,0,0|1,1,1]=4 2177 B8R0.7 CCCSCCC(C)O Amb25773881 [0,1,0,0,0,0|1,1,0]=3 2178 B8R0.7 CCCSCNC(C)C Amb25146129 [0,1,0,0,0,0|2,1,0]=4 2179 B8R0.7 CCCSSCC(O)=O Amb25209982 [0,1,0,0,0,0|1,1,1]=4 2180 B8R0.7 CCC\C=C\CC(C)N Amb25113454 [0,1,0,0,0,0|2,0,1]=4 2181 B8R0.7 CCC\C=C\CC(O)=O Amb18642602 [0,1,0,0,0,0|1,0,2]=4 2182 B8R0.7 CCC\C=C\C[C@H](C)O Amb24458574 [0,1,0,0,0,0|1,0,1]=3 2183 B8R0.7 CCOCCCB(O)O Amb25286037 [0,1,0,0,0,0|3,0,0]=4 2184 B8R0.7 CCOCCCC(C)Br Amb18329738 [0,1,0,0,0,0|3,0,0]=4 2185 B8R0.7 CCOCCCC(C)Cl Amb18792891 [0,1,0,0,0,0|3,0,0]=4 2186 B8R0.7 CCOCCCC(C)O Amb24414472 [0,1,0,0,0,0|2,0,0]=3 2187 B8R0.7 CCOCOCC(O)=O Amb25682215 [0,1,0,0,0,0|1,0,1]=3 2188 B8R0.7 CCOCOC[C@H](C)O Amb25810260 [0,1,0,0,0,0|1,0,0]=2 2189 B8R0.7 CCOCSCC(C)C Amb25681578 [0,1,0,0,0,0|2,1,0]=4 2190 B8R0.7 CCOCSCC(C)N Amb24402491 [0,1,0,0,0,0|2,1,0]=4 2191 B8R0.7 CCOCSCC(O)=O Amb25147004 [0,1,0,0,0,0|1,1,1]=4 2192 B8R0.7 CCONCCC(C)O Amb24687129 [0,1,0,0,0,0|3,0,0]=4 2193 B8R0.7 CCO\C=C\CC(C)O Amb24576636 [0,1,0,0,0,0|2,0,1]=4 2194 B8R0.7 CCSCCCB(O)O Amb24351131 [0,1,0,0,0,0|3,0,0]=4 2195 B8R0.7 CCSCCCC(C)Br Amb24360988 [0,1,0,0,0,0|3,0,0]=4 2196 B8R0.7 CCSCCCC(C)Cl Amb25307915 [0,1,0,0,0,0|3,0,0]=4 2197 B8R0.7 CCSCSCC(C)C Amb24632276 [0,1,0,0,0,0|2,1,0]=4 2198 B8R0.7 CCSC\C=C\C(C)O Amb24688230 [0,1,0,0,0,0|2,0,1]=4 2199 B8R0.7 CC\C=C/CCC(C)N Amb24447019 [0,1,0,0,0,0|2,0,1]=4 2200 B8R0.7 CC\C=C/CCC(O)Cl Amb24740597 [0,1,0,0,0,0|1,0,2]=4 2201 B8R0.7 CC\C=C\CCC(C)C Amb25811237 [0,1,0,0,0,0|2,0,1]=4 2202 B8R0.7 CC\C=C\CCC(C)O Amb22055975 [0,1,0,0,0,0|1,0,2]=4 2203 B8R0.7 CN(C)CCC#CCO Amb25236466 [0,1,0,0,0,0|2,0,1]=4 2204 B8R0.7 CN(C)CCCCCCl Amb25842969 [0,1,0,0,0,0|3,0,0]=4 2205 B8R0.7 CN(C)CCCCCS Amb25730651 [0,1,0,0,0,0|2,1,0]=4 2206 B8R0.7 CN(C)CCNCCBr Amb21893203 [0,1,0,0,0,0|3,0,0]=4 2207 B8R0.7 CN(C)CCNCCF Amb24428465 [0,1,0,0,0,0|3,0,0]=4 2208 B8R0.7 CN(C)CCNCCI Amb25042285 [0,1,0,0,0,0|3,0,0]=4 2209 B8R0.7 CN(C)CCNCCO Amb22282365 [0,1,0,0,0,0|2,0,0]=3 2210 B8R0.7 CN(C)CCNCCS Amb25824145 [0,1,0,0,0,0|2,1,0]=4 2211 B8R0.7 CN(C)CCOCCBr Amb25855974 [0,1,0,0,0,0|2,0,0]=3 2212 B8R0.7 CN(C)CCOCCCl Amb20668192 [0,1,0,0,0,0|2,0,0]=3 2213 B8R0.7 CN(C)CCOCCCl Amb22059291 [0,1,0,0,0,0|2,0,0]=3 2214 B8R0.7 CN(C)CCOCCN Amb22371058 [0,1,0,0,0,0|2,0,0]=3 2215 B8R0.7 CN(C)CCOCCS Amb24576341 [0,1,0,0,0,0|1,1,0]=3 2216 B8R0.7 CN(C)CCSCCS Amb25188951 [0,1,0,0,0,0|1,2,0]=4 2217 B8R0.7 CN(N)CCNCCO Amb25090381 [0,1,0,0,0,0|2,0,0]=3 2218 B8R0.7 CN(N)CCOCCO Amb25680974 [0,1,0,0,0,0|1,0,0]=2 2219 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,1,0,0,0,0|2,0,1]=4 2220 B8R0.7 CNCCCCC(C)C Amb25769955 [0,1,0,0,0,0|3,0,0]=4 2221 B8R0.7 CNCCCCC(C)N Amb24360546 [0,1,0,0,0,0|3,0,0]=4 2222 B8R0.7 CNCCCCC(O)=O Amb24340485 [0,1,0,0,0,0|2,0,1]=4 2223 B8R0.7 CNCCCCC(O)C Amb17569923 [0,1,0,0,0,0|2,0,0]=3 2224 B8R0.7 CNCCNCC(Cl)Cl Amb25838241 [0,1,0,0,0,0|3,0,0]=4 2225 B8R0.7 CNCCNCC(O)=O Amb25211792 [0,1,0,0,0,0|2,0,1]=4 2226 B8R0.7 CNCCOCC(=C)Br Amb18324681 [0,1,0,0,0,0|2,0,1]=4 2227 B8R0.7 CNCCOCC(=C)Cl Amb25716286 [0,1,0,0,0,0|2,0,1]=4 2228 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,1,0,0,0,0|1,0,2]=4 2229 B8R0.7 CNCCOCC(C)O Amb25822559 [0,1,0,0,0,0|1,0,0]=2 2230 B8R0.7 CNCCOCC(F)F Amb24731254 [0,1,0,0,0,0|2,0,0]=3 2231 B8R0.7 CNCCOCC(O)=O Amb18630741 [0,1,0,0,0,0|1,0,1]=3 2232 B8R0.7 CNCCSCC(C)C Amb25267324 [0,1,0,0,0,0|2,1,0]=4 2233 B8R0.7 CNCCSCC(F)F Amb25663220 [0,1,0,0,0,0|2,1,0]=4 2234 B8R0.7 COCCCCC(C)Br Amb18329732 [0,1,0,0,0,0|3,0,0]=4 2235 B8R0.7 COCCCCC(C)Cl Amb18180118 [0,1,0,0,0,0|3,0,0]=4 2236 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|2,0,0]=3 2237 B8R0.7 COCCCCC(Cl)Cl Amb24480116 [0,1,0,0,0,0|3,0,0]=4 2238 B8R0.7 COCCCCC(N)C Amb17569945 [0,1,0,0,0,0|3,0,0]=4 2239 B8R0.7 COCCNCC(C)Cl Amb25134320 [0,1,0,0,0,0|3,0,0]=4 2240 B8R0.7 COCCNCC(C)N Amb24645044 [0,1,0,0,0,0|3,0,0]=4 2241 B8R0.7 COCCNCC(F)F Amb13952502 [0,1,0,0,0,0|3,0,0]=4 2242 B8R0.7 COCCNCC(F)F Amb16229893 [0,1,0,0,0,0|3,0,0]=4 2243 B8R0.7 COCCNCC(O)=O Amb19514667 [0,1,0,0,0,0|2,0,1]=4 2244 B8R0.7 COCCNC[C@@H](C)O Amb25330006 [0,1,0,0,0,0|2,0,0]=3 2245 B8R0.7 COCCOCC(C)N Amb19375047 [0,1,0,0,0,0|2,0,0]=3 2246 B8R0.7 COCCOC[C@H](C)N Amb25124172 [0,1,0,0,0,0|2,0,0]=3 2247 B8R0.7 COCCONC(C)C Amb25724077 [0,1,0,0,0,0|3,0,0]=4 2248 B8R0.7 COCCSCC(C)N Amb24478624 [0,1,0,0,0,0|2,1,0]=4 2249 B8R0.7 COCCSCC(C)O Amb18179365 [0,1,0,0,0,0|1,1,0]=3 2250 B8R0.7 COCOCCC(C)=O Amb25809981 [0,1,0,0,0,0|2,0,1]=4 2251 B8R0.7 COCOCCC(C)O Amb25265793 [0,1,0,0,0,0|2,0,0]=3 2252 B8R0.7 COCSCCC(C)N Amb24366533 [0,1,0,0,0,0|2,1,0]=4 2253 B8R0.7 CONCCCC(C)O Amb24361285 [0,1,0,0,0,0|3,0,0]=4 2254 B8R0.7 CS(=O)CCCCCN Amb25133466 [0,1,0,0,0,0|3,0,0]=4 2255 B8R0.7 CS(=O)CCCCCO Amb25243806 [0,1,0,0,0,0|2,0,0]=3 2256 B8R0.7 CS(=O)CCNCCBr Amb24538846 [0,1,0,0,0,0|3,0,0]=4 2257 B8R0.7 CS(=O)CCNCCI Amb24538847 [0,1,0,0,0,0|3,0,0]=4 2258 B8R0.7 CS(=O)CCNCCN Amb25140378 [0,1,0,0,0,0|3,0,0]=4 2259 B8R0.7 CS(=O)CCSCCCl Amb24538537 [0,1,0,0,0,0|2,1,0]=4 2260 B8R0.7 CS(=O)CCSCCO Amb24538899 [0,1,0,0,0,0|1,1,0]=3 2261 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,1,0,0,0,0|2,0,1]=4 2262 B8R0.7 CSCCCCC(C)Cl Amb25767186 [0,1,0,0,0,0|3,0,0]=4 2263 B8R0.7 CSCCNCC(C)Cl Amb25810148 [0,1,0,0,0,0|3,0,0]=4 2264 B8R0.7 CSCCNCC(C)O Amb25681928 [0,1,0,0,0,0|2,0,0]=3 2265 B8R0.7 CSCCNCC(F)F Amb24367534 [0,1,0,0,0,0|3,0,0]=4 2266 B8R0.7 CSCCNCC(O)=O Amb24401934 [0,1,0,0,0,0|2,0,1]=4 2267 B8R0.7 CSCCNC[C@H](C)O Amb25758316 [0,1,0,0,0,0|2,0,0]=3 2268 B8R0.7 CSCCOCC(=C)Br Amb25095072 [0,1,0,0,0,0|2,0,1]=4 2269 B8R0.7 CSCCOCC(C)=O Amb24333557 [0,1,0,0,0,0|1,0,2]=4 2270 B8R0.7 CSCCOCC(N)=O Amb24730448 [0,1,0,0,0,0|1,0,2]=4 2271 B8R0.7 CSCCSCC(C)N Amb24518046 [0,1,0,0,0,0|2,1,0]=4 2272 B8R0.7 CSCCSCC(C)O Amb24504419 [0,1,0,0,0,0|1,1,0]=3 2273 B8R0.7 CSCCSC[C@@H](C)O Amb25110231 [0,1,0,0,0,0|1,1,0]=3 2274 B8R0.7 CSCCSC[C@H](C)N Amb25110125 [0,1,0,0,0,0|2,1,0]=4 2275 B8R0.7 C[C@@H](N)COCCCO Amb24569226 [0,1,0,0,0,0|2,0,0]=3 2276 B8R0.7 C[C@@H](N)CSCCCO Amb25349579 [0,1,0,0,0,0|2,0,0]=3 2277 B8R0.7 C[C@@H](O)CCCCC#N Amb24642619 [0,1,0,0,0,0|2,0,1]=4 2278 B8R0.7 C[C@@H](O)CCCCC=O Amb22896766 [0,1,0,0,0,0|1,0,2]=4 2279 B8R0.7 C[C@@H](O)CNCCCO Amb25031240 [0,1,0,0,0,0|2,0,0]=3 2280 B8R0.7 C[C@@H](O)CNOCC#C Amb25317008 [0,1,0,0,0,0|2,0,1]=4 2281 B8R0.7 C[C@@H](O)CNOCC=C Amb24608735 [0,1,0,0,0,0|2,0,1]=4 2282 B8R0.7 C[C@H](N)CSCCCO Amb24481867 [0,1,0,0,0,0|2,0,0]=3 2283 B8R0.7 C[C@H](O)CCCCC#N Amb24592518 [0,1,0,0,0,0|2,0,1]=4 2284 B8R0.7 C[C@H](O)CNCCCO Amb25352476 [0,1,0,0,0,0|2,0,0]=3 2285 B8R0.7 C[C@H](O)CNOCC#C Amb24703778 [0,1,0,0,0,0|2,0,1]=4 2286 B8R0.7 C[C@H](O)CSCCCO Amb24672393 [0,1,0,0,0,0|1,1,0]=3 2287 B8R0.7 C[C@H](O)\C=C\CCCO Amb25842182 [0,1,0,0,0,0|1,0,2]=4 2288 B8R0.7 C\C=C\CNCC(C)O Amb25729753 [0,1,0,0,0,0|1,0,2]=4 2289 B8R0.7 C\C=C\CNC[C@@H](C)O Amb24608388 [0,1,0,0,0,0|1,0,2]=4 2290 B8R0.7 ClCCNCCC(C)C Amb17334287 [0,1,0,0,0,0|2,0,0]=3 2291 B8R0.7 ClCCNCCN(C)C Amb17334305 [0,1,0,0,0,0|3,0,0]=4 2292 B8R0.7 FC(F)CCCCCBr Amb24459890 [0,1,0,0,0,0|3,0,0]=4 2293 B8R0.7 FC(F)COCCCBr Amb24472987 [0,1,0,0,0,0|2,0,0]=3 2294 B8R0.7 FC(F)COCCCCl Amb24446030 [0,1,0,0,0,0|2,0,0]=3 2295 B8R0.7 FC(F)CSCCCCl Amb24406324 [0,1,0,0,0,0|2,1,0]=4 2296 B8R0.7 N#CCCOCC(F)F Amb22008448 [0,1,0,0,0,0|2,0,1]=4 2297 B8R0.7 N#CCSCCC(C)C Amb17501745 [0,1,0,0,0,0|1,1,1]=4 2298 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,1,0,0,0,0|2,0,1]=4 2299 B8R0.7 NC(=O)CCNCCO Amb19960060 [0,1,0,0,0,0|2,0,1]=4 2300 B8R0.7 NC(=S)CCCCCO Amb24562810 [0,1,0,0,0,0|2,0,1]=4 2301 B8R0.7 NCCCCCB(O)O Amb25049233 [0,1,0,0,0,0|3,0,0]=4 2302 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,1,0,0,0,0|2,0,1]=4 2303 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,1,0,0,0,0|2,0,1]=4 2304 B8R0.7 NCCCCCC(Cl)Cl Amb25188938 [0,1,0,0,0,0|3,0,0]=4 2305 B8R0.7 NCCCCNC(C)C Amb17334116 [0,1,0,0,0,0|3,0,0]=4 2306 B8R0.7 NCCCCSC(C)C Amb17500947 [0,1,0,0,0,0|3,0,0]=4 2307 B8R0.7 NCCCNCC(C)C Amb17315266 [0,1,0,0,0,0|3,0,0]=4 2308 B8R0.7 NCCCNCC(O)=O Amb22733138 [0,1,0,0,0,0|2,0,1]=4 2309 B8R0.7 NCCCNCC(O)=O Amb25848815 [0,1,0,0,0,0|2,0,1]=4 2310 B8R0.7 NCCCOCC(C)C Amb1154609 [0,1,0,0,0,0|2,0,0]=3 2311 B8R0.7 NCCCOCC(F)F Amb20669153 [0,1,0,0,0,0|2,0,0]=3 2312 B8R0.7 NCCCOCC(F)F Amb25855538 [0,1,0,0,0,0|2,0,0]=3 2313 B8R0.7 NCCCOCC(N)=O Amb24433775 [0,1,0,0,0,0|1,0,2]=4 2314 B8R0.7 NCCCOCC(O)=O Amb18111435 [0,1,0,0,0,0|1,0,1]=3 2315 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,1,0,0,0,0|1,1,1]=4 2316 B8R0.7 NCCCSCC(F)F Amb25703752 [0,1,0,0,0,0|2,1,0]=4 2317 B8R0.7 NCCNCCC(C)C Amb17091048 [0,1,0,0,0,0|2,0,0]=3 2318 B8R0.7 NCCNCCC(F)F Amb24388158 [0,1,0,0,0,0|3,0,0]=4 2319 B8R0.7 NCCOCCC(O)=O Amb18630461 [0,1,0,0,0,0|2,0,1]=4 2320 B8R0.7 NOCCOCC(F)F Amb25263198 [0,1,0,0,0,0|3,0,0]=4 2321 B8R0.7 O=C(Cl)COCCCCl Amb25059159 [0,1,0,0,0,0|1,0,2]=4 2322 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,1,0,0,0,0|3,0,0]=4 2323 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,1,0,0,0,0|3,0,0]=4 2324 B8R0.7 OC(=O)CCCCCCl Amb18796646 [0,1,0,0,0,0|2,0,1]=4 2325 B8R0.7 OC(=O)CCCCCI Amb22736492 [0,1,0,0,0,0|2,0,1]=4 2326 B8R0.7 OC(=O)CCCCCS Amb18644374 [0,1,0,0,0,0|2,0,1]=4 2327 B8R0.7 OC(=O)CCOCCBr Amb24057757 [0,1,0,0,0,0|2,0,1]=4 2328 B8R0.7 OC(=O)CNCCCBr Amb25765814 [0,1,0,0,0,0|2,0,1]=4 2329 B8R0.7 OC(=O)CNCCCS Amb25268354 [0,1,0,0,0,0|2,0,1]=4 2330 B8R0.7 OC(=O)COCCCBr Amb24594816 [0,1,0,0,0,0|1,0,1]=3 2331 B8R0.7 OC(=O)COCCCF Amb24481828 [0,1,0,0,0,0|1,0,1]=3 2332 B8R0.7 OC(=O)CSCCCBr Amb25771711 [0,1,0,0,0,0|1,1,1]=4 2333 B8R0.7 OC(=O)CSCCCCl Amb18126548 [0,1,0,0,0,0|1,1,1]=4 2334 B8R0.7 OC(=O)CSCCCF Amb25676986 [0,1,0,0,0,0|1,1,1]=4 2335 B8R0.7 OCCCCCC(Cl)Cl Amb25684810 [0,1,0,0,0,0|2,0,0]=3 2336 B8R0.7 OCCCCCN(C)C Amb17334131 [0,1,0,0,0,0|2,0,0]=3 2337 B8R0.7 OCCCCNC(=O)C Amb17102977 [0,1,0,0,0,0|2,0,1]=4 2338 B8R0.7 OCCCCNC(C)C Amb17334129 [0,1,0,0,0,0|2,0,0]=3 2339 B8R0.7 OCCCNCC(O)C Amb17308669 [0,1,0,0,0,0|2,0,0]=3 2340 B8R0.7 OCCCSCC(=C)C Amb17502851 [0,1,0,0,0,0|2,0,1]=4 2341 B8R0.7 OCCCSCC(=O)C Amb17502845 [0,1,0,0,0,0|2,0,1]=4 2342 B8R0.7 OCCNCCC(=O)O Amb1110010 [0,1,0,0,0,0|2,0,1]=4 2343 B8R0.7 OCCNCCC(F)F Amb24607986 [0,1,0,0,0,0|2,0,0]=3 2344 B8R0.7 OCCNCCN(C)C Amb1017223 [0,1,0,0,0,0|2,0,0]=3 2345 B8R0.7 OCCOCCC(C)C Amb10609610 [0,1,0,0,0,0|0,0,0]=1 2346 B8R0.7 [O-]C(=O)CCCCCO Amb22491268 [0,1,0,0,0,0|2,0,1]=4 2347 B8R0.7 [O-]P(=O)CCOCCCl Amb25232545 [0,1,0,0,0,0|3,0,0]=4 2348 B8R1.2 BrCC1CCCCN1 Amb18128036 [0,0,0,1,0,0|2,0,0]=3 2349 B8R1.2 BrCC1CCCCN1 Amb20171159 [0,0,0,1,0,0|2,0,0]=3 2350 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,0,0,1,0,0|1,0,0]=2 2351 B8R1.2 BrCC1CCCCS1 Amb25684791 [0,0,0,1,0,0|1,1,0]=3 2352 B8R1.2 BrCC1CCNCC1 Amb17935872 [0,0,0,1,0,0|3,0,0]=4 2353 B8R1.2 BrCC1CCNCC1 Amb19516018 [0,0,0,1,0,0|3,0,0]=4 2354 B8R1.2 BrCC1CCSCC1 Amb22011704 [0,0,0,1,0,0|3,0,0]=4 2355 B8R1.2 BrCC1CNCCC1 Amb21955699 [0,0,0,1,0,0|3,0,0]=4 2356 B8R1.2 BrCC1CNCCC1 Amb22229216 [0,0,0,1,0,0|3,0,0]=4 2357 B8R1.2 BrCC1CNCCN1 Amb22228149 [0,0,0,1,0,0|3,0,0]=4 2358 B8R1.2 BrCC1COCCC1 Amb18178619 [0,0,0,1,0,0|2,0,0]=3 2359 B8R1.2 BrCC1COCCO1 Amb18796390 [0,0,0,1,0,0|1,0,0]=2 2360 B8R1.2 BrCC1COCOC1 Amb25701384 [0,0,0,1,0,0|3,0,0]=4 2361 B8R1.2 BrCC1CSCCN1 Amb24389263 [0,0,0,1,0,0|2,1,0]=4 2362 B8R1.2 BrCC1OCCCO1 Amb10576216 [0,0,0,1,0,0|2,0,0]=3 2363 B8R1.2 BrCC=1CCCCC1 Amb23439167 [0,0,0,1,0,0|2,0,1]=4 2364 B8R1.2 Br[Mg]C1CCCCC1 Amb19944556 [0,0,0,1,0,0|3,0,0]=4 2365 B8R1.2 C#CC1CCCCN1 Amb22170138 [0,0,0,1,0,0|2,0,1]=4 2366 B8R1.2 C#CC1CCCCN1 Amb22228818 [0,0,0,1,0,0|2,0,1]=4 2367 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,0,0,1,0,0|1,0,1]=3 2368 B8R1.2 C#CC1COCCC1 Amb22229303 [0,0,0,1,0,0|1,0,2]=4 2369 B8R1.2 C#CC1COCCN1 Amb24692089 [0,0,0,1,0,0|1,0,2]=4 2370 B8R1.2 C#CC1COCCO1 Amb25834164 [0,0,0,1,0,0|0,0,2]=3 2371 B8R1.2 C1NCCOC1C#N Amb10604011 [0,0,0,1,0,0|2,0,1]=4 2372 B8R1.2 C=CC1CNCCO1 Amb22235956 [0,0,0,1,0,0|1,0,2]=4 2373 B8R1.2 C=CC1COCCC1 Amb25100920 [0,0,0,1,0,0|1,0,2]=4 2374 B8R1.2 C=CC1COCCN1 Amb22236008 [0,0,0,1,0,0|1,0,2]=4 2375 B8R1.2 C=CC1OCCCO1 Amb24725153 [0,0,0,1,0,0|2,0,1]=4 2376 B8R1.2 C=C[C@@H]1COCCN1 Amb25798783 [0,0,0,1,0,0|1,0,2]=4 2377 B8R1.2 CCC1CC=CCC1 Amb24079172 [0,0,0,1,0,0|2,0,1]=4 2378 B8R1.2 CCC1CCCCN1 Amb10683459 [0,0,0,1,0,0|2,0,0]=3 2379 B8R1.2 CCC1CCNCC1 Amb17760296 [0,0,0,1,0,0|3,0,0]=4 2380 B8R1.2 CCC1CCNCC1 Amb19272296 [0,0,0,1,0,0|3,0,0]=4 2381 B8R1.2 CCC1CNCC=C1 Amb25127994 [0,0,0,1,0,0|2,0,1]=4 2382 B8R1.2 CCC1CNCCC1 Amb19516506 [0,0,0,1,0,0|2,0,0]=3 2383 B8R1.2 CCC1CNCCN1 Amb10606910 [0,0,0,1,0,0|2,0,0]=3 2384 B8R1.2 CCC1CNCCN1 Amb20240995 [0,0,0,1,0,0|2,0,0]=3 2385 B8R1.2 CCC1CNCCN1 Amb20670267 [0,0,0,1,0,0|2,0,0]=3 2386 B8R1.2 CCC1CNCCO1 Amb13951287 [0,0,0,1,0,0|1,0,0]=2 2387 B8R1.2 CCC1CNCCS1 Amb19149092 [0,0,0,1,0,0|1,1,0]=3 2388 B8R1.2 CCC1COCCN1 Amb21864708 [0,0,0,1,0,0|1,0,0]=2 2389 B8R1.2 CCC1COCCN1 Amb22492291 [0,0,0,1,0,0|1,0,0]=2 2390 B8R1.2 CCC1CSCCN1 Amb18124338 [0,0,0,1,0,0|1,1,0]=3 2391 B8R1.2 CCC1NCCCN1 Amb24445855 [0,0,0,1,0,0|3,0,0]=4 2392 B8R1.2 CCC1NCCCO1 Amb17506192 [0,0,0,1,0,0|2,0,0]=3 2393 B8R1.2 CCC=1CCCCC1 Amb25337001 [0,0,0,1,0,0|2,0,1]=4 2394 B8R1.2 CCC=1CCCCN1 Amb24481485 [0,0,0,1,0,0|2,0,1]=4 2395 B8R1.2 CCC=1CNCCC1 Amb24526370 [0,0,0,1,0,0|2,0,1]=4 2396 B8R1.2 CCN1CCCCC1 Amb10603420 [0,0,0,1,0,0|3,0,0]=4 2397 B8R1.2 CCN1CCCCC1 Amb22347793 [0,0,0,1,0,0|3,0,0]=4 2398 B8R1.2 CCN1CNCCC1 Amb18641821 [0,0,0,1,0,0|3,0,0]=4 2399 B8R1.2 CC[C@@H]1CCCCN1 Amb20241516 [0,0,0,1,0,0|2,0,0]=3 2400 B8R1.2 CC[C@@H]1CCCCN1 Amb22892832 [0,0,0,1,0,0|2,0,0]=3 2401 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,0,0,1,0,0|1,0,0]=2 2402 B8R1.2 CC[C@@H]1COCCN1 Amb20242298 [0,0,0,1,0,0|1,0,0]=2 2403 B8R1.2 CC[C@@H]1COCCN1 Amb20242895 [0,0,0,1,0,0|1,0,0]=2 2404 B8R1.2 CC[C@H]1CCCCN1 Amb20241520 [0,0,0,1,0,0|2,0,0]=3 2405 B8R1.2 CC[C@H]1CNCCN1 Amb20671343 [0,0,0,1,0,0|2,0,0]=3 2406 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,0,0,1,0,0|1,0,0]=2 2407 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,0,0,1,0,0|1,0,0]=2 2408 B8R1.2 CC[C@H]1COCCN1 Amb19516643 [0,0,0,1,0,0|1,0,0]=2 2409 B8R1.2 CC[C@H]1COCCN1 Amb22226455 [0,0,0,1,0,0|1,0,0]=2 2410 B8R1.2 CC[C@H]1NCCNC1 Amb15690747 [0,0,0,1,0,0|2,0,0]=3 2411 B8R1.2 CNC1CNCCC1 Amb18276901 [0,0,0,1,0,0|3,0,0]=4 2412 B8R1.2 CNC1CNCCC1 Amb22751307 [0,0,0,1,0,0|3,0,0]=4 2413 B8R1.2 CNC1CNCCO1 Amb25804554 [0,0,0,1,0,0|2,0,0]=3 2414 B8R1.2 CNC1COCCC1 Amb18641845 [0,0,0,1,0,0|2,0,0]=3 2415 B8R1.2 CNC1COCCC1 Amb22231331 [0,0,0,1,0,0|2,0,0]=3 2416 B8R1.2 CNC1CSCCC1 Amb18948508 [0,0,0,1,0,0|2,1,0]=4 2417 B8R1.2 CNC1CSCCC1 Amb24271087 [0,0,0,1,0,0|2,1,0]=4 2418 B8R1.2 CN[C@@H]1CCCCO1 Amb24606835 [0,0,0,1,0,0|2,0,0]=3 2419 B8R1.2 CN[C@@H]1CNCCC1 Amb22756471 [0,0,0,1,0,0|3,0,0]=4 2420 B8R1.2 CN[C@@H]1CNCCC1 Amb24744577 [0,0,0,1,0,0|3,0,0]=4 2421 B8R1.2 CN[C@H]1CCCCO1 Amb24634478 [0,0,0,1,0,0|2,0,0]=3 2422 B8R1.2 CN[C@H]1COCCC1 Amb24742629 [0,0,0,1,0,0|2,0,0]=3 2423 B8R1.2 COC1CCCCN1 Amb24384593 [0,0,0,1,0,0|3,0,0]=4 2424 B8R1.2 COC1CCCCO1 Amb21955138 [0,0,0,1,0,0|2,0,0]=3 2425 B8R1.2 COC1CNCCC1 Amb19887238 [0,0,0,1,0,0|3,0,0]=4 2426 B8R1.2 COC1CNCCC1 Amb22586710 [0,0,0,1,0,0|3,0,0]=4 2427 B8R1.2 COC1CNCCO1 Amb20669241 [0,0,0,1,0,0|2,0,0]=3 2428 B8R1.2 COC=1COCCN1 Amb25304653 [0,0,0,1,0,0|2,0,1]=4 2429 B8R1.2 CO[C@@H]1CNCCC1 Amb22226700 [0,0,0,1,0,0|3,0,0]=4 2430 B8R1.2 CO[C@@H]1CNCCC1 Amb22756499 [0,0,0,1,0,0|3,0,0]=4 2431 B8R1.2 CO[C@H]1CNCCC1 Amb22225358 [0,0,0,1,0,0|3,0,0]=4 2432 B8R1.2 CSC1CCCCC1 Amb17672781 [0,0,0,1,0,0|3,0,0]=4 2433 B8R1.2 CSC1CCCCN1 Amb24550466 [0,0,0,1,0,0|3,0,0]=4 2434 B8R1.2 CSC1CCCCO1 Amb24649762 [0,0,0,1,0,0|2,0,0]=3 2435 B8R1.2 CSC1CNCCC1 Amb18945987 [0,0,0,1,0,0|3,0,0]=4 2436 B8R1.2 CSC1COCCC1 Amb24447961 [0,0,0,1,0,0|2,0,0]=3 2437 B8R1.2 CSC=1COCCN1 Amb25071651 [0,0,0,1,0,0|2,0,1]=4 2438 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,0,0,1,0,0|1,0,2]=4 2439 B8R1.2 ClCC1CCCC=C1 Amb17672830 [0,0,0,1,0,0|2,0,1]=4 2440 B8R1.2 ClCC1CCCCN1 Amb18124395 [0,0,0,1,0,0|2,0,0]=3 2441 B8R1.2 ClCC1CCCCS1 Amb24374141 [0,0,0,1,0,0|1,1,0]=3 2442 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,0,0,1,0,0|2,0,0]=3 2443 B8R1.2 ClCC1CCN=CO1 Amb25189031 [0,0,0,1,0,0|2,0,1]=4 2444 B8R1.2 ClCC1CCNCC1 Amb20618009 [0,0,0,1,0,0|3,0,0]=4 2445 B8R1.2 ClCC1CCNCC1 Amb22229730 [0,0,0,1,0,0|3,0,0]=4 2446 B8R1.2 ClCC1CCOCC1 Amb22059101 [0,0,0,1,0,0|3,0,0]=4 2447 B8R1.2 ClCC1CNCCC1 Amb20618020 [0,0,0,1,0,0|3,0,0]=4 2448 B8R1.2 ClCC1CNCCC1 Amb22229227 [0,0,0,1,0,0|3,0,0]=4 2449 B8R1.2 ClCC1CNCCO1 Amb20668892 [0,0,0,1,0,0|2,0,0]=3 2450 B8R1.2 ClCC=1CCCCC1 Amb25173836 [0,0,0,1,0,0|2,0,1]=4 2451 B8R1.2 ClC[C@@H]1CCCCO1 Amb24596063 [0,0,0,1,0,0|1,0,0]=2 2452 B8R1.2 ClC[C@@H]1CNCCO1 Amb25048095 [0,0,0,1,0,0|2,0,0]=3 2453 B8R1.2 Cl[Mg]C1CCCCC1 Amb17689221 [0,0,0,1,0,0|3,0,0]=4 2454 B8R1.2 FCC1CCCCN1 Amb13953138 [0,0,0,1,0,0|2,0,0]=3 2455 B8R1.2 FCC1CCCCN1 Amb21960708 [0,0,0,1,0,0|2,0,0]=3 2456 B8R1.2 FCC1CCCNC1 Amb13885420 [0,0,0,1,0,0|3,0,0]=4 2457 B8R1.2 FCC1CCCNC1 Amb13889108 [0,0,0,1,0,0|3,0,0]=4 2458 B8R1.2 FCC1CCNCC1 Amb13885415 [0,0,0,1,0,0|3,0,0]=4 2459 B8R1.2 FCC1CCNCC1 Amb21960845 [0,0,0,1,0,0|3,0,0]=4 2460 B8R1.2 FCC1CSCCN1 Amb24628296 [0,0,0,1,0,0|2,1,0]=4 2461 B8R1.2 FCN1CCCCC1 Amb25337498 [0,0,0,1,0,0|3,0,0]=4 2462 B8R1.2 FC[C@@H]1CCCCN1 Amb23439341 [0,0,0,1,0,0|2,0,0]=3 2463 B8R1.2 FC[C@@H]1CNCCN1 Amb19889818 [0,0,0,1,0,0|3,0,0]=4 2464 B8R1.2 ICC1CCCCC1 Amb22263046 [0,0,0,1,0,0|2,0,0]=3 2465 B8R1.2 ICC1CCCCN1 Amb21860432 [0,0,0,1,0,0|2,0,0]=3 2466 B8R1.2 ICC1CCCCN1 Amb22228857 [0,0,0,1,0,0|2,0,0]=3 2467 B8R1.2 ICC1CCCCO1 Amb24060887 [0,0,0,1,0,0|1,0,0]=2 2468 B8R1.2 ICC1CCNCC1 Amb21860434 [0,0,0,1,0,0|3,0,0]=4 2469 B8R1.2 ICC1CCNCC1 Amb22229802 [0,0,0,1,0,0|3,0,0]=4 2470 B8R1.2 ICC1CCOCO1 Amb19373646 [0,0,0,1,0,0|2,0,0]=3 2471 B8R1.2 ICC1CNCCC1 Amb21860433 [0,0,0,1,0,0|3,0,0]=4 2472 B8R1.2 ICC1CNCCC1 Amb22229330 [0,0,0,1,0,0|3,0,0]=4 2473 B8R1.2 ICC1COCCO1 Amb24061260 [0,0,0,1,0,0|1,0,0]=2 2474 B8R1.2 ICC1COCOC1 Amb24534001 [0,0,0,1,0,0|3,0,0]=4 2475 B8R1.2 ICN1CCCCC1 Amb24060244 [0,0,0,1,0,0|3,0,0]=4 2476 B8R1.2 N#CC1CCCCN1 Amb1160385 [0,0,0,1,0,0|2,0,1]=4 2477 B8R1.2 N#CC1CCCCN1 Amb21964343 [0,0,0,1,0,0|2,0,1]=4 2478 B8R1.2 N#CC1CCCCN1 Amb22406020 [0,0,0,1,0,0|2,0,1]=4 2479 B8R1.2 N#CC1CCCCN1 Amb23439300 [0,0,0,1,0,0|2,0,1]=4 2480 B8R1.2 N#CC1CCCCN1 Amb24093642 [0,0,0,1,0,0|2,0,1]=4 2481 B8R1.2 N#CC1CCCCS1 Amb24483258 [0,0,0,1,0,0|1,1,1]=4 2482 B8R1.2 N#CC1CNCCO1 Amb19373292 [0,0,0,1,0,0|2,0,1]=4 2483 B8R1.2 N#CC1COCCC1 Amb19148306 [0,0,0,1,0,0|2,0,1]=4 2484 B8R1.2 N#CC1COCCN1 Amb18124242 [0,0,0,1,0,0|2,0,1]=4 2485 B8R1.2 N#CC1COCCN1 Amb22899996 [0,0,0,1,0,0|2,0,1]=4 2486 B8R1.2 N#CC1COCCO1 Amb22002145 [0,0,0,1,0,0|1,0,1]=3 2487 B8R1.2 N#CC1CSCCO1 Amb20622840 [0,0,0,1,0,0|1,1,1]=4 2488 B8R1.2 N#C[C@@H]1CCCCN1 Amb23439301 [0,0,0,1,0,0|2,0,1]=4 2489 B8R1.2 N#[13C]C1CCCCN1 Amb22054792 [0,0,0,1,0,0|2,0,1]=4 2490 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,0,0,1,0,0|2,0,1]=4 2491 B8R1.2 NCC1CCC=CO1 Amb16233709 [0,0,0,1,0,0|1,0,2]=4 2492 B8R1.2 NCC1CCCC=C1 Amb18641664 [0,0,0,1,0,0|2,0,1]=4 2493 B8R1.2 NCC1CCCCC1 Amb1158677 [0,0,0,1,0,0|2,0,0]=3 2494 B8R1.2 NCC1CCCCN1 Amb21964855 [0,0,0,1,0,0|2,0,0]=3 2495 B8R1.2 NCC1CCCCO1 Amb19372867 [0,0,0,1,0,0|1,0,0]=2 2496 B8R1.2 NCC1CCCCS1 Amb24443454 [0,0,0,1,0,0|1,1,0]=3 2497 B8R1.2 NCC1CCCOC1 Amb10603286 [0,0,0,1,0,0|2,0,0]=3 2498 B8R1.2 NCC1CCCOC1 Amb1092537 [0,0,0,1,0,0|2,0,0]=3 2499 B8R1.2 NCC1CCNCC1 Amb19887259 [0,0,0,1,0,0|3,0,0]=4 2500 B8R1.2 NCC1CCNCC1 Amb20620268 [0,0,0,1,0,0|3,0,0]=4 2501 B8R1.2 NCC1CCOCC1 Amb1099138 [0,0,0,1,0,0|3,0,0]=4 2502 B8R1.2 NCC1CCOCO1 Amb20669541 [0,0,0,1,0,0|2,0,0]=3 2503 B8R1.2 NCC1CCOCO1 Amb22157235 [0,0,0,1,0,0|2,0,0]=3 2504 B8R1.2 NCC1CCSCC1 Amb18279249 [0,0,0,1,0,0|3,0,0]=4 2505 B8R1.2 NCC1CNCCC1 Amb20620288 [0,0,0,1,0,0|3,0,0]=4 2506 B8R1.2 NCC1CNCCN1 Amb22489613 [0,0,0,1,0,0|3,0,0]=4 2507 B8R1.2 NCC1CNCCO1 Amb22490153 [0,0,0,1,0,0|2,0,0]=3 2508 B8R1.2 NCC1CNCCO1 Amb2369955 [0,0,0,1,0,0|2,0,0]=3 2509 B8R1.2 NCC1CNCCS1 Amb25211886 [0,0,0,1,0,0|2,1,0]=4 2510 B8R1.2 NCC1COCCC1 Amb22492350 [0,0,0,1,0,0|2,0,0]=3 2511 B8R1.2 NCC1COCCN1 Amb20670555 [0,0,0,1,0,0|2,0,0]=3 2512 B8R1.2 NCC1COCCN1 Amb22898761 [0,0,0,1,0,0|2,0,0]=3 2513 B8R1.2 NCC1COCCO1 Amb1087841 [0,0,0,1,0,0|1,0,0]=2 2514 B8R1.2 NCC1CSCCC1 Amb18831922 [0,0,0,1,0,0|2,1,0]=4 2515 B8R1.2 NCC1CSCCN1 Amb18559475 [0,0,0,1,0,0|2,1,0]=4 2516 B8R1.2 NCC1CSCCS1 Amb20667611 [0,0,0,1,0,0|1,2,0]=4 2517 B8R1.2 NCC1OCCCO1 Amb17226711 [0,0,0,1,0,0|2,0,0]=3 2518 B8R1.2 NCC=1CCCCC1 Amb22587029 [0,0,0,1,0,0|2,0,1]=4 2519 B8R1.2 NCC=1COCCC1 Amb24329061 [0,0,0,1,0,0|2,0,1]=4 2520 B8R1.2 NC[C@@H]1CCC=CO1 Amb25309281 [0,0,0,1,0,0|1,0,2]=4 2521 B8R1.2 NC[C@@H]1CCCCN1 Amb24674195 [0,0,0,1,0,0|2,0,0]=3 2522 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,0,0,1,0,0|1,0,0]=2 2523 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,0,0,1,0,0|1,0,0]=2 2524 B8R1.2 NC[C@@H]1CNCCO1 Amb22748803 [0,0,0,1,0,0|2,0,0]=3 2525 B8R1.2 NC[C@@H]1COCCC1 Amb24483141 [0,0,0,1,0,0|2,0,0]=3 2526 B8R1.2 NC[C@@H]1COCCN1 Amb25272823 [0,0,0,1,0,0|2,0,0]=3 2527 B8R1.2 NC[C@@H]1COCCO1 Amb22406261 [0,0,0,1,0,0|1,0,0]=2 2528 B8R1.2 NC[C@@H]1COCCO1 Amb24704288 [0,0,0,1,0,0|1,0,0]=2 2529 B8R1.2 NC[C@H]1CCC=CO1 Amb24585156 [0,0,0,1,0,0|1,0,2]=4 2530 B8R1.2 NC[C@H]1CCCCN1 Amb24434930 [0,0,0,1,0,0|2,0,0]=3 2531 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,0,0,1,0,0|1,0,0]=2 2532 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,0,0,1,0,0|1,0,0]=2 2533 B8R1.2 NC[C@H]1CNCCO1 Amb25197821 [0,0,0,1,0,0|2,0,0]=3 2534 B8R1.2 NC[C@H]1COCCC1 Amb25849361 [0,0,0,1,0,0|2,0,0]=3 2535 B8R1.2 NC[C@H]1COCCO1 Amb22406262 [0,0,0,1,0,0|1,0,0]=2 2536 B8R1.2 NC[C@H]1COCCO1 Amb24686998 [0,0,0,1,0,0|1,0,0]=2 2537 B8R1.2 NNC1CCCCC1 Amb10071075 [0,0,0,1,0,0|3,0,0]=4 2538 B8R1.2 NNC1CCCCC1 Amb10808130 [0,0,0,1,0,0|3,0,0]=4 2539 B8R1.2 NNC1CCCCC1 Amb22347451 [0,0,0,1,0,0|3,0,0]=4 2540 B8R1.2 NNC1CCCCO1 Amb25322400 [0,0,0,1,0,0|2,0,0]=3 2541 B8R1.2 NNC1COCCC1 Amb23412249 [0,0,0,1,0,0|3,0,0]=4 2542 B8R1.2 NNC1COCCC1 Amb23412254 [0,0,0,1,0,0|3,0,0]=4 2543 B8R1.2 NNC1COCCC1 Amb23412255 [0,0,0,1,0,0|3,0,0]=4 2544 B8R1.2 NOC1CCCCC1 Amb18641839 [0,0,0,1,0,0|3,0,0]=4 2545 B8R1.2 NOC1CCCCO1 Amb10975936 [0,0,0,1,0,0|2,0,0]=3 2546 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,0,0,1,0,0|1,0,2]=4 2547 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,0,0,1,0,0|0,1,2]=4 2548 B8R1.2 O=CC1COCCN1 Amb18833023 [0,0,0,1,0,0|2,0,1]=4 2549 B8R1.2 O=CC1CSCCO1 Amb25328255 [0,0,0,1,0,0|1,0,2]=4 2550 B8R1.2 O=CC1OCCCO1 Amb25756192 [0,0,0,1,0,0|1,0,2]=4 2551 B8R1.2 O=CN1CCCCO1 Amb24332705 [0,0,0,1,0,0|1,0,2]=4 2552 B8R1.2 O=C[C@@H]1CCCCO1 Amb25731797 [0,0,0,1,0,0|0,0,2]=3 2553 B8R1.2 O=C[C@@H]1CCOCO1 Amb25839349 [0,0,0,1,0,0|1,0,2]=4 2554 B8R1.2 O=C[C@@H]1COCCC1 Amb24332628 [0,0,0,1,0,0|2,0,1]=4 2555 B8R1.2 O=C[C@H]1CCCCO1 Amb25811086 [0,0,0,1,0,0|0,0,2]=3 2556 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,0,0,1,0,0|0,0,2]=3 2557 B8R1.2 OCC1=COCCO1 Amb19319714 [0,0,0,1,0,0|1,0,2]=4 2558 B8R1.2 OCC1CC=CCO1 Amb25316226 [0,0,0,1,0,0|0,0,2]=3 2559 B8R1.2 OCC1CCC=NN1 Amb25808191 [0,0,0,1,0,0|2,0,1]=4 2560 B8R1.2 OCC1CCCC=C1 Amb17593156 [0,0,0,1,0,0|1,0,1]=3 2561 B8R1.2 OCC1CCCCN1 Amb1803268 [0,0,0,1,0,0|1,0,0]=2 2562 B8R1.2 OCC1CCCCS1 Amb20669084 [0,0,0,1,0,0|0,1,0]=2 2563 B8R1.2 OCC1CCCNN1 Amb25266711 [0,0,0,1,0,0|2,0,0]=3 2564 B8R1.2 OCC1CCCNO1 Amb24552317 [0,0,0,1,0,0|1,0,0]=2 2565 B8R1.2 OCC1CCCOC1 Amb1093253 [0,0,0,1,0,0|2,0,0]=3 2566 B8R1.2 OCC1CCNCC1 Amb20242610 [0,0,0,1,0,0|2,0,0]=3 2567 B8R1.2 OCC1CNCCC1 Amb22001796 [0,0,0,1,0,0|2,0,0]=3 2568 B8R1.2 OCC1CNCCN1 Amb20240990 [0,0,0,1,0,0|2,0,0]=3 2569 B8R1.2 OCC1CNCCO1 Amb19957720 [0,0,0,1,0,0|1,0,0]=2 2570 B8R1.2 OCC1CNCCO1 Amb22490666 [0,0,0,1,0,0|1,0,0]=2 2571 B8R1.2 OCC1CNCCS1 Amb25246196 [0,0,0,1,0,0|1,1,0]=3 2572 B8R1.2 OCC1CNNCC1 Amb25197079 [0,0,0,1,0,0|3,0,0]=4 2573 B8R1.2 OCC1COCCN1 Amb10067154 [0,0,0,1,0,0|2,0,0]=3 2574 B8R1.2 OCC1COCCN1 Amb19516092 [0,0,0,1,0,0|2,0,0]=3 2575 B8R1.2 OCC1COCCO1 Amb10607696 [0,0,0,1,0,0|1,0,0]=2 2576 B8R1.2 OCC1COCOC1 Amb25757105 [0,0,0,1,0,0|3,0,0]=4 2577 B8R1.2 OCC1CSCCC1 Amb18202835 [0,0,0,1,0,0|2,0,0]=3 2578 B8R1.2 OCC1CSCCS1 Amb24375467 [0,0,0,1,0,0|1,1,0]=3 2579 B8R1.2 OCC1SCCCS1 Amb25761606 [0,0,0,1,0,0|1,1,0]=3 2580 B8R1.2 OCC=1CCCCC1 Amb24122911 [0,0,0,1,0,0|1,0,1]=3 2581 B8R1.2 OCC=1CCCOC1 Amb24426430 [0,0,0,1,0,0|2,0,1]=4 2582 B8R1.2 OCC=1CCCON1 Amb25675358 [0,0,0,1,0,0|2,0,1]=4 2583 B8R1.2 OCC=1CCNCC1 Amb24105368 [0,0,0,1,0,0|2,0,1]=4 2584 B8R1.2 OCC=1CNCCC1 Amb25189014 [0,0,0,1,0,0|2,0,1]=4 2585 B8R1.2 OCC=1COCCC1 Amb24329074 [0,0,0,1,0,0|2,0,1]=4 2586 B8R1.2 OCN1CCNCC1 Amb22231021 [0,0,0,1,0,0|3,0,0]=4 2587 B8R1.2 OCN1CCOCC1 Amb24381928 [0,0,0,1,0,0|3,0,0]=4 2588 B8R1.2 OC[C@@H]1C=CCCO1 Amb25284318 [0,0,0,1,0,0|0,0,2]=3 2589 B8R1.2 OC[C@@H]1CC=CCC1 Amb25143197 [0,0,0,1,0,0|1,0,2]=4 2590 B8R1.2 OC[C@@H]1CC=CCO1 Amb25106053 [0,0,0,1,0,0|0,0,2]=3 2591 B8R1.2 OC[C@@H]1CCC=CO1 Amb24361884 [0,0,0,1,0,0|0,0,2]=3 2592 B8R1.2 OC[C@@H]1CCCC=C1 Amb25682189 [0,0,0,1,0,0|1,0,1]=3 2593 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,0,0,1,0,0|1,0,0]=2 2594 B8R1.2 OC[C@@H]1CCCCN1 Amb22504549 [0,0,0,1,0,0|1,0,0]=2 2595 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,0,0,1,0,0|0,0,0]=1 2596 B8R1.2 OC[C@@H]1CCCNC1 Amb10603201 [0,0,0,1,0,0|2,0,0]=3 2597 B8R1.2 OC[C@@H]1CNCCC1 Amb22388477 [0,0,0,1,0,0|2,0,0]=3 2598 B8R1.2 OC[C@@H]1CNCCN1 Amb22746109 [0,0,0,1,0,0|2,0,0]=3 2599 B8R1.2 OC[C@@H]1CNCCO1 Amb10067152 [0,0,0,1,0,0|1,0,0]=2 2600 B8R1.2 OC[C@@H]1CNCCO1 Amb17933818 [0,0,0,1,0,0|1,0,0]=2 2601 B8R1.2 OC[C@@H]1CNCCO1 Amb22748210 [0,0,0,1,0,0|1,0,0]=2 2602 B8R1.2 OC[C@@H]1COCCC1 Amb24413844 [0,0,0,1,0,0|2,0,0]=3 2603 B8R1.2 OC[C@@H]1COCCO1 Amb22752848 [0,0,0,1,0,0|1,0,0]=2 2604 B8R1.2 OC[C@@H]1CSCCC1 Amb25085112 [0,0,0,1,0,0|2,0,0]=3 2605 B8R1.2 OC[C@@H]1CSCCN1 Amb24089426 [0,0,0,1,0,0|2,0,0]=3 2606 B8R1.2 OC[C@H]1C=CCCO1 Amb24545780 [0,0,0,1,0,0|0,0,2]=3 2607 B8R1.2 OC[C@H]1CCC=NN1 Amb24332138 [0,0,0,1,0,0|2,0,1]=4 2608 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,0,0,1,0,0|1,0,0]=2 2609 B8R1.2 OC[C@H]1CCCCN1 Amb22504550 [0,0,0,1,0,0|1,0,0]=2 2610 B8R1.2 OC[C@H]1CCCNC1 Amb10603243 [0,0,0,1,0,0|2,0,0]=3 2611 B8R1.2 OC[C@H]1CCSCN1 Amb24518949 [0,0,0,1,0,0|2,0,0]=3 2612 B8R1.2 OC[C@H]1CNCCC1 Amb22504548 [0,0,0,1,0,0|2,0,0]=3 2613 B8R1.2 OC[C@H]1CNCCN1 Amb22288655 [0,0,0,1,0,0|2,0,0]=3 2614 B8R1.2 OC[C@H]1CNCCN1 Amb24444183 [0,0,0,1,0,0|2,0,0]=3 2615 B8R1.2 OC[C@H]1CNCCO1 Amb10067151 [0,0,0,1,0,0|1,0,0]=2 2616 B8R1.2 OC[C@H]1COCCN1 Amb15691976 [0,0,0,1,0,0|2,0,0]=3 2617 B8R1.2 OC[C@H]1COCCO1 Amb25724377 [0,0,0,1,0,0|1,0,0]=2 2618 B8R1.2 OC[C@H]1CSCCN1 Amb24089435 [0,0,0,1,0,0|2,0,0]=3 2619 B8R1.2 OC[C@H]1NCCNC1 Amb15690750 [0,0,0,1,0,0|2,0,0]=3 2620 B8R1.2 ONC1CCCCC1 Amb22233686 [0,0,0,1,0,0|2,0,0]=3 2621 B8R1.2 ONC1CCNCC1 Amb24449786 [0,0,0,1,0,0|3,0,0]=4 2622 B8R1.2 ONC1CCOCC1 Amb24554358 [0,0,0,1,0,0|3,0,0]=4 2623 B8R1.2 ONC1CCSCC1 Amb25716598 [0,0,0,1,0,0|3,0,0]=4 2624 B8R1.2 ONC1COCCC1 Amb25127355 [0,0,0,1,0,0|3,0,0]=4 2625 B8R1.2 ON[C@H]1CNCCC1 Amb25199886 [0,0,0,1,0,0|3,0,0]=4 2626 B8R1.2 SCC1CCCCO1 Amb23585661 [0,0,0,1,0,0|0,1,0]=2 2627 B8R1.2 SCC1CCCNC1 Amb17503130 [0,0,0,1,0,0|2,1,0]=4 2628 B8R1.2 SCC1CCNCC1 Amb17503031 [0,0,0,1,0,0|2,1,0]=4 2629 B8R1.2 SCC1CCOCC1 Amb25708148 [0,0,0,1,0,0|2,1,0]=4 2630 B8R1.2 SCC1CNCCN1 Amb24678031 [0,0,0,1,0,0|2,1,0]=4 2631 B8R1.2 SCN1CCCCC1 Amb20093487 [0,0,0,1,0,0|2,1,0]=4 2632 B8R1.2 SC[C@@H]1COCCN1 Amb25337523 [0,0,0,1,0,0|2,0,0]=3 2633 B8R1.2 SC[C@H]1COCCN1 Amb24524252 [0,0,0,1,0,0|2,0,0]=3 2634 B8R1.2 [2H]OC1CCCCC1 Amb22354031 [0,0,0,1,0,0|3,0,0]=4 2635 B8R1.2 [C-]#[N+]C1CCCCC1 Amb2235424 [0,0,0,1,0,0|3,0,0]=4 2636 B8R1.2 [C-]#[N+]C1CCCCO1 Amb25252978 [0,0,0,1,0,0|2,0,0]=3 2637 B8R1.2 [CH2-]CC1CCCCC1 Amb24117227 [0,0,0,1,0,0|2,0,0]=3 2638 B8R1.2 [SiH3]OC1CNCCO1 Amb24745607 [0,0,0,1,0,0|2,1,0]=4 2639 B8R1.5 BrC1CCCCC1Br Amb10563786 [0,0,0,1,0,0|3,0,0]=4 2640 B8R1.5 C=C1CCCC[C@@H]1O Amb25220251 [0,0,0,1,0,0|1,0,2]=4 2641 B8R1.5 C=C1CCOCC1O Amb24363585 [0,0,0,1,0,0|0,0,2]=3 2642 B8R1.5 CC1=CCCCC1O Amb22365276 [0,0,0,1,0,0|1,0,2]=4 2643 B8R1.5 CC1=CCCC[C@H]1O Amb25699989 [0,0,0,1,0,0|1,0,2]=4 2644 B8R1.5 CC1C=CCCC1O Amb24334275 [0,0,0,1,0,0|1,0,2]=4 2645 B8R1.5 CC1CC=CCC1C Amb22364352 [0,0,0,1,0,0|2,0,1]=4 2646 B8R1.5 CC1CC=CCC1O Amb24688055 [0,0,0,1,0,0|1,0,1]=3 2647 B8R1.5 CC1CCC=CC1Br Amb25090219 [0,0,0,1,0,0|2,0,1]=4 2648 B8R1.5 CC1CCC=CC1N Amb18641660 [0,0,0,1,0,0|2,0,1]=4 2649 B8R1.5 CC1CCC=CC1O Amb24414123 [0,0,0,1,0,0|1,0,1]=3 2650 B8R1.5 CC1CCCCC1=C Amb25203919 [0,0,0,1,0,0|2,0,1]=4 2651 B8R1.5 CC1CCCCC1O Amb24061297 [0,0,0,1,0,0|1,0,0]=2 2652 B8R1.5 CC1CCCCN1N Amb17231818 [0,0,0,1,0,0|3,0,0]=4 2653 B8R1.5 CC1CCCNC1C Amb19338160 [0,0,0,1,0,0|3,0,0]=4 2654 B8R1.5 CC1CCNCC1Br Amb25852781 [0,0,0,1,0,0|2,0,0]=3 2655 B8R1.5 CC1CCNCC1N Amb19374853 [0,0,0,1,0,0|2,0,0]=3 2656 B8R1.5 CC1CCNCC1O Amb22406220 [0,0,0,1,0,0|1,0,0]=2 2657 B8R1.5 CC1CCNCC1O Amb23440259 [0,0,0,1,0,0|1,0,0]=2 2658 B8R1.5 CC1CCOCC1=O Amb25718285 [0,0,0,1,0,0|0,0,2]=3 2659 B8R1.5 CC1CNCCC1Br Amb25125494 [0,0,0,1,0,0|3,0,0]=4 2660 B8R1.5 CC1CNCCC1C Amb22059495 [0,0,0,1,0,0|2,0,0]=3 2661 B8R1.5 CC1CNCCC1Cl Amb25336958 [0,0,0,1,0,0|3,0,0]=4 2662 B8R1.5 CC1CNCCC1N Amb23440690 [0,0,0,1,0,0|3,0,0]=4 2663 B8R1.5 CC1CNCCC1O Amb21955441 [0,0,0,1,0,0|2,0,0]=3 2664 B8R1.5 CC1CNCCN1C Amb19148798 [0,0,0,1,0,0|3,0,0]=4 2665 B8R1.5 CC1CNCCN1C Amb22585549 [0,0,0,1,0,0|3,0,0]=4 2666 B8R1.5 CC1CNCCN1C Amb22586682 [0,0,0,1,0,0|3,0,0]=4 2667 B8R1.5 CC1COCCC1=O Amb21856147 [0,0,0,1,0,0|2,0,1]=4 2668 B8R1.5 CC1COCCC1Cl Amb24557250 [0,0,0,1,0,0|2,0,0]=3 2669 B8R1.5 CC1COCCC1N Amb18833016 [0,0,0,1,0,0|2,0,0]=3 2670 B8R1.5 CC1COCCC1O Amb22299437 [0,0,0,1,0,0|2,0,0]=3 2671 B8R1.5 CC1COCCC1S Amb22299438 [0,0,0,1,0,0|2,0,0]=3 2672 B8R1.5 CC1COCCN1N Amb18559532 [0,0,0,1,0,0|3,0,0]=4 2673 B8R1.5 CC1COCOC1C Amb25829514 [0,0,0,1,0,0|2,0,0]=3 2674 B8R1.5 CC1COCOC1O Amb24582065 [0,0,0,1,0,0|3,0,0]=4 2675 B8R1.5 CC1CSCCC1N Amb18202892 [0,0,0,1,0,0|2,1,0]=4 2676 B8R1.5 CC1NCCCC1C Amb1089738 [0,0,0,1,0,0|3,0,0]=4 2677 B8R1.5 CC1NCCCC1C Amb2137203 [0,0,0,1,0,0|3,0,0]=4 2678 B8R1.5 CC1NCCCC1Cl Amb24578059 [0,0,0,1,0,0|3,0,0]=4 2679 B8R1.5 CC1NCCCC1N Amb24715672 [0,0,0,1,0,0|3,0,0]=4 2680 B8R1.5 CC1NCCOC1O Amb25031508 [0,0,0,1,0,0|3,0,0]=4 2681 B8R1.5 CC1OCCCC1Br Amb22500038 [0,0,0,1,0,0|3,0,0]=4 2682 B8R1.5 CC1OCCCC1Cl Amb25772379 [0,0,0,1,0,0|3,0,0]=4 2683 B8R1.5 CC1OCCCC1N Amb18833013 [0,0,0,1,0,0|3,0,0]=4 2684 B8R1.5 CC1SCCCC1Br Amb24483260 [0,0,0,1,0,0|3,0,0]=4 2685 B8R1.5 CC1SCCCC1N Amb24699153 [0,0,0,1,0,0|3,0,0]=4 2686 B8R1.5 CC1SCCCC1S Amb24658420 [0,0,0,1,0,0|2,1,0]=4 2687 B8R1.5 CN1CCCCC1N Amb24433870 [0,0,0,1,0,0|3,0,0]=4 2688 B8R1.5 CN1CCOCC1=O Amb22301593 [0,0,0,1,0,0|1,0,2]=4 2689 B8R1.5 C[C@@H]1CC=CC[C@@H]1C Amb25785772 [0,0,0,1,0,0|2,0,1]=4 2690 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb24568280 [0,0,0,1,0,0|2,0,1]=4 2691 B8R1.5 C[C@@H]1CCC=C[C@@H]1N Amb24628630 [0,0,0,1,0,0|2,0,1]=4 2692 B8R1.5 C[C@@H]1CCCCC1=O Amb25693013 [0,0,0,1,0,0|1,0,2]=4 2693 B8R1.5 C[C@@H]1CCCCC1N Amb24423534 [0,0,0,1,0,0|2,0,0]=3 2694 B8R1.5 C[C@@H]1CCCCC1O Amb25135464 [0,0,0,1,0,0|1,0,0]=2 2695 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22746982 [0,0,0,1,0,0|2,0,0]=3 2696 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22899193 [0,0,0,1,0,0|2,0,0]=3 2697 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,0,0,1,0,0|1,0,0]=2 2698 B8R1.5 C[C@@H]1CCCC[C@H]1C Amb22801359 [0,0,0,1,0,0|2,0,0]=3 2699 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb22886317 [0,0,0,1,0,0|1,0,0]=2 2700 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb24694415 [0,0,0,1,0,0|1,0,0]=2 2701 B8R1.5 C[C@@H]1CCNC[C@H]1F Amb22886341 [0,0,0,1,0,0|2,0,0]=3 2702 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb22886316 [0,0,0,1,0,0|1,0,0]=2 2703 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb24553941 [0,0,0,1,0,0|1,0,0]=2 2704 B8R1.5 C[C@@H]1CNCCN1C Amb18833029 [0,0,0,1,0,0|3,0,0]=4 2705 B8R1.5 C[C@@H]1CNCCN1C Amb22745842 [0,0,0,1,0,0|3,0,0]=4 2706 B8R1.5 C[C@@H]1CNCC[C@@H]1C Amb24561640 [0,0,0,1,0,0|2,0,0]=3 2707 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb22232040 [0,0,0,1,0,0|2,0,0]=3 2708 B8R1.5 C[C@@H]1CNCC[C@H]1C Amb24584988 [0,0,0,1,0,0|2,0,0]=3 2709 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22270263 [0,0,0,1,0,0|2,0,0]=3 2710 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22757834 [0,0,0,1,0,0|2,0,0]=3 2711 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,0,0,1,0,0|2,0,0]=3 2712 B8R1.5 C[C@@H]1COCC[C@@H]1O Amb25272016 [0,0,0,1,0,0|2,0,0]=3 2713 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,0,0,1,0,0|2,0,0]=3 2714 B8R1.5 C[C@@H]1CSCC[C@@H]1O Amb25235689 [0,0,0,1,0,0|2,0,0]=3 2715 B8R1.5 C[C@@H]1OC=CC[C@@H]1O Amb24687710 [0,0,0,1,0,0|2,0,1]=4 2716 B8R1.5 C[C@@H]1OCC=C[C@@H]1O Amb25176980 [0,0,0,1,0,0|2,0,1]=4 2717 B8R1.5 C[C@@H]1OCC=C[C@H]1O Amb25221478 [0,0,0,1,0,0|2,0,1]=4 2718 B8R1.5 C[C@@H]1OCCC[C@@H]1Br Amb25336533 [0,0,0,1,0,0|3,0,0]=4 2719 B8R1.5 C[C@@H]1OCCC[C@@H]1Cl Amb24625287 [0,0,0,1,0,0|3,0,0]=4 2720 B8R1.5 C[C@@H]1OCCC[C@@H]1O Amb24618653 [0,0,0,1,0,0|2,0,0]=3 2721 B8R1.5 C[C@@H]1OCCC[C@H]1O Amb25176726 [0,0,0,1,0,0|2,0,0]=3 2722 B8R1.5 C[C@@H]1OCOC[C@@H]1O Amb24581749 [0,0,0,1,0,0|1,0,0]=2 2723 B8R1.5 C[C@H]1C=CCC[C@H]1O Amb25176065 [0,0,0,1,0,0|1,0,2]=4 2724 B8R1.5 C[C@H]1CC=CC[C@@H]1N Amb24604369 [0,0,0,1,0,0|2,0,1]=4 2725 B8R1.5 C[C@H]1CC=CC[C@H]1O Amb24514439 [0,0,0,1,0,0|1,0,1]=3 2726 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,0,0,1,0,0|1,0,0]=2 2727 B8R1.5 C[C@H]1CCCN[C@H]1C Amb24671217 [0,0,0,1,0,0|3,0,0]=4 2728 B8R1.5 C[C@H]1CCNC[C@H]1O Amb25339261 [0,0,0,1,0,0|1,0,0]=2 2729 B8R1.5 C[C@H]1CNCCN1C Amb22587566 [0,0,0,1,0,0|3,0,0]=4 2730 B8R1.5 C[C@H]1CNCC[C@@H]1O Amb24059398 [0,0,0,1,0,0|2,0,0]=3 2731 B8R1.5 C[C@H]1CNCC[C@H]1C Amb24752229 [0,0,0,1,0,0|2,0,0]=3 2732 B8R1.5 C[C@H]1CNCC[C@H]1N Amb24597622 [0,0,0,1,0,0|3,0,0]=4 2733 B8R1.5 C[C@H]1COCC[C@H]1Cl Amb25249095 [0,0,0,1,0,0|2,0,0]=3 2734 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,0,0,1,0,0|2,0,0]=3 2735 B8R1.5 C[C@H]1CSCC[C@H]1O Amb24548314 [0,0,0,1,0,0|2,0,0]=3 2736 B8R1.5 C[C@H]1NCCC[C@@H]1O Amb24685123 [0,0,0,1,0,0|2,0,0]=3 2737 B8R1.5 C[C@H]1NCCC[C@H]1O Amb24550583 [0,0,0,1,0,0|2,0,0]=3 2738 B8R1.5 C[C@H]1OC=CC[C@@H]1O Amb24733126 [0,0,0,1,0,0|2,0,1]=4 2739 B8R1.5 C[C@H]1SCCC[C@@H]1O Amb24735109 [0,0,0,1,0,0|2,0,0]=3 2740 B8R1.5 Cl[C@@H]1CCCC[C@H]1Br Amb24308900 [0,0,0,1,0,0|3,0,0]=4 2741 B8R1.5 FC1CCCCC1Br Amb10841597 [0,0,0,1,0,0|3,0,0]=4 2742 B8R1.5 FC1CCCCC1Cl Amb25123462 [0,0,0,1,0,0|3,0,0]=4 2743 B8R1.5 FC1CCCC[C@H]1Br Amb24366045 [0,0,0,1,0,0|3,0,0]=4 2744 B8R1.5 FC1CNCCC1F Amb25227141 [0,0,0,1,0,0|3,0,0]=4 2745 B8R1.5 F[C@@H]1CNCC[C@@H]1F Amb23440304 [0,0,0,1,0,0|3,0,0]=4 2746 B8R1.5 F[C@@H]1CNCC[C@H]1F Amb23440303 [0,0,0,1,0,0|3,0,0]=4 2747 B8R1.5 F[C@H]1CCCC[C@@H]1Cl Amb24531854 [0,0,0,1,0,0|3,0,0]=4 2748 B8R1.5 NC1CC=CCC1O Amb18641727 [0,0,0,1,0,0|2,0,1]=4 2749 B8R1.5 NC1CCCCC1Br Amb20622391 [0,0,0,1,0,0|3,0,0]=4 2750 B8R1.5 NC1CCCCC1Cl Amb20622338 [0,0,0,1,0,0|3,0,0]=4 2751 B8R1.5 NC1CCCCC1F Amb22886179 [0,0,0,1,0,0|3,0,0]=4 2752 B8R1.5 NC1CCCCC1F Amb25831178 [0,0,0,1,0,0|3,0,0]=4 2753 B8R1.5 NC1CCCCC1N Amb22491413 [0,0,0,1,0,0|3,0,0]=4 2754 B8R1.5 NC1CCCCC1O Amb22228578 [0,0,0,1,0,0|2,0,0]=3 2755 B8R1.5 NC1CCCCC1S Amb18642860 [0,0,0,1,0,0|2,1,0]=4 2756 B8R1.5 NC1CCCCC1S Amb24117988 [0,0,0,1,0,0|2,1,0]=4 2757 B8R1.5 NC1CCNCC1O Amb22388661 [0,0,0,1,0,0|2,0,0]=3 2758 B8R1.5 NC1CCOCC1F Amb22436824 [0,0,0,1,0,0|2,0,0]=3 2759 B8R1.5 NC1CCOCC1O Amb18198453 [0,0,0,1,0,0|1,0,0]=2 2760 B8R1.5 NC1CCSCC1F Amb25178806 [0,0,0,1,0,0|2,1,0]=4 2761 B8R1.5 NC1CCSCC1O Amb18203162 [0,0,0,1,0,0|1,1,0]=3 2762 B8R1.5 NC1COCCC1=O Amb18833021 [0,0,0,1,0,0|2,0,1]=4 2763 B8R1.5 NC1COCCC1Cl Amb24550562 [0,0,0,1,0,0|2,0,0]=3 2764 B8R1.5 NC1COCCC1F Amb22490372 [0,0,0,1,0,0|2,0,0]=3 2765 B8R1.5 NC1COCCC1N Amb18202752 [0,0,0,1,0,0|2,0,0]=3 2766 B8R1.5 NC1COCCC1O Amb18198755 [0,0,0,1,0,0|2,0,0]=3 2767 B8R1.5 N[C@@H]1CCC=C[C@@H]1O Amb25230617 [0,0,0,1,0,0|2,0,1]=4 2768 B8R1.5 N[C@@H]1CCCCC1O Amb24401932 [0,0,0,1,0,0|2,0,0]=3 2769 B8R1.5 N[C@@H]1CCCC[C@@H]1N Amb22745943 [0,0,0,1,0,0|3,0,0]=4 2770 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [0,0,0,1,0,0|2,0,0]=3 2771 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [0,0,0,1,0,0|2,0,0]=3 2772 B8R1.5 N[C@@H]1CCCC[C@H]1Br Amb10552684 [0,0,0,1,0,0|3,0,0]=4 2773 B8R1.5 N[C@@H]1CCCC[C@H]1Cl Amb24671186 [0,0,0,1,0,0|3,0,0]=4 2774 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb22831446 [0,0,0,1,0,0|3,0,0]=4 2775 B8R1.5 N[C@@H]1CCCC[C@H]1F Amb22886180 [0,0,0,1,0,0|3,0,0]=4 2776 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb17612451 [0,0,0,1,0,0|3,0,0]=4 2777 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb17618929 [0,0,0,1,0,0|3,0,0]=4 2778 B8R1.5 N[C@@H]1CCCC[C@H]1N Amb19883956 [0,0,0,1,0,0|3,0,0]=4 2779 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [0,0,0,1,0,0|2,0,0]=3 2780 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [0,0,0,1,0,0|2,0,0]=3 2781 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb23439434 [0,0,0,1,0,0|2,0,0]=3 2782 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb25780287 [0,0,0,1,0,0|2,0,0]=3 2783 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,0,0,1,0,0|1,0,0]=2 2784 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,0,0,1,0,0|1,0,0]=2 2785 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb23439433 [0,0,0,1,0,0|2,0,0]=3 2786 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb25168837 [0,0,0,1,0,0|2,0,0]=3 2787 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,0,0,1,0,0|1,0,0]=2 2788 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,0,0,1,0,0|1,0,0]=2 2789 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,0,0,1,0,0|2,0,0]=3 2790 B8R1.5 N[C@@H]1COCC[C@H]1N Amb24120364 [0,0,0,1,0,0|2,0,0]=3 2791 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,0,0,1,0,0|2,0,0]=3 2792 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,0,0,1,0,0|2,0,0]=3 2793 B8R1.5 N[C@H]1CC=CC[C@H]1O Amb24515141 [0,0,0,1,0,0|2,0,1]=4 2794 B8R1.5 N[C@H]1CCCCC1N Amb24409556 [0,0,0,1,0,0|3,0,0]=4 2795 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [0,0,0,1,0,0|2,0,0]=3 2796 B8R1.5 N[C@H]1CCCC[C@H]1F Amb24117513 [0,0,0,1,0,0|3,0,0]=4 2797 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [0,0,0,1,0,0|2,0,0]=3 2798 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [0,0,0,1,0,0|2,0,0]=3 2799 B8R1.5 N[C@H]1CCCC[C@H]1S Amb25304665 [0,0,0,1,0,0|2,1,0]=4 2800 B8R1.5 N[C@H]1CCSC[C@H]1O Amb24599503 [0,0,0,1,0,0|1,1,0]=3 2801 B8R1.5 N[C@H]1CNCC[C@@H]1O Amb25175388 [0,0,0,1,0,0|3,0,0]=4 2802 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,0,0,1,0,0|2,0,0]=3 2803 B8R1.5 N[C@H]1COCC[C@H]1N Amb25231209 [0,0,0,1,0,0|2,0,0]=3 2804 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,0,0,1,0,0|2,0,0]=3 2805 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,0,0,1,0,0|2,0,1]=4 2806 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,0,0,1,0,0|2,0,1]=4 2807 B8R1.5 O=C1CCOCC1F Amb19958536 [0,0,0,1,0,0|2,0,1]=4 2808 B8R1.5 O=C1CCOC[C@@H]1Cl Amb24723222 [0,0,0,1,0,0|2,0,1]=4 2809 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,0,0,1,0,0|2,0,1]=4 2810 B8R1.5 O=C1COCCC1Br Amb24416092 [0,0,0,1,0,0|1,0,2]=4 2811 B8R1.5 OC1C=COCC1O Amb24390405 [0,0,0,1,0,0|1,0,2]=4 2812 B8R1.5 OC1C=NOCC1O Amb24421036 [0,0,0,1,0,0|2,0,1]=4 2813 B8R1.5 OC1CC=CCC1Cl Amb25758585 [0,0,0,1,0,0|2,0,1]=4 2814 B8R1.5 OC1CC=CCC1O Amb25317233 [0,0,0,1,0,0|2,0,1]=4 2815 B8R1.5 OC1CCCCC1Br Amb17594580 [0,0,0,1,0,0|2,0,0]=3 2816 B8R1.5 OC1CCCCC1I Amb10601565 [0,0,0,1,0,0|2,0,0]=3 2817 B8R1.5 OC1CCCCC1P Amb24524365 [0,0,0,1,0,0|2,0,0]=3 2818 B8R1.5 OC1CCCCN1O Amb24675112 [0,0,0,1,0,0|3,0,0]=4 2819 B8R1.5 OC1CCNCC1F Amb23401846 [0,0,0,1,0,0|3,0,0]=4 2820 B8R1.5 OC1CCNCC1F Amb23401853 [0,0,0,1,0,0|3,0,0]=4 2821 B8R1.5 OC1CCOCC1Br Amb25122777 [0,0,0,1,0,0|2,0,0]=3 2822 B8R1.5 OC1CCOC[C@H]1Cl Amb25772762 [0,0,0,1,0,0|2,0,0]=3 2823 B8R1.5 OC1CCSCC1Br Amb25804154 [0,0,0,1,0,0|2,1,0]=4 2824 B8R1.5 OC1CCSSC1O Amb24060616 [0,0,0,1,0,0|2,1,0]=4 2825 B8R1.5 OC1CNCCC1=O Amb24075970 [0,0,0,1,0,0|2,0,1]=4 2826 B8R1.5 OC1CNCCC1Cl Amb25246675 [0,0,0,1,0,0|2,0,0]=3 2827 B8R1.5 OC1CNCCC1F Amb22886287 [0,0,0,1,0,0|2,0,0]=3 2828 B8R1.5 OC1CNCCC1O Amb22493773 [0,0,0,1,0,0|2,0,0]=3 2829 B8R1.5 OC1COCCC1O Amb23454159 [0,0,0,1,0,0|1,0,0]=2 2830 B8R1.5 OC1COCOC1O Amb24476260 [0,0,0,1,0,0|2,0,0]=3 2831 B8R1.5 OC1OCCCC1Br Amb24634011 [0,0,0,1,0,0|3,0,0]=4 2832 B8R1.5 OC1OCCC[C@H]1Br Amb24710193 [0,0,0,1,0,0|3,0,0]=4 2833 B8R1.5 O[C@@H]1CC=CC[C@@H]1O Amb24555496 [0,0,0,1,0,0|2,0,1]=4 2834 B8R1.5 O[C@@H]1CCC=C[C@H]1O Amb24645773 [0,0,0,1,0,0|2,0,1]=4 2835 B8R1.5 O[C@@H]1CCCCC1O Amb25687852 [0,0,0,1,0,0|2,0,0]=3 2836 B8R1.5 O[C@@H]1CCCC[C@@H]1Br Amb24546000 [0,0,0,1,0,0|2,0,0]=3 2837 B8R1.5 O[C@@H]1CCCC[C@H]1Br Amb17940195 [0,0,0,1,0,0|2,0,0]=3 2838 B8R1.5 O[C@@H]1CCCC[C@H]1Cl Amb17844352 [0,0,0,1,0,0|2,0,0]=3 2839 B8R1.5 O[C@@H]1CCCC[C@H]1F Amb10606383 [0,0,0,1,0,0|2,0,0]=3 2840 B8R1.5 O[C@@H]1CCCOC1O Amb24704773 [0,0,0,1,0,0|3,0,0]=4 2841 B8R1.5 O[C@@H]1CCNC[C@@H]1F Amb22886301 [0,0,0,1,0,0|3,0,0]=4 2842 B8R1.5 O[C@@H]1CCNC[C@@H]1F Amb23439240 [0,0,0,1,0,0|3,0,0]=4 2843 B8R1.5 O[C@@H]1CCNC[C@H]1F Amb22886315 [0,0,0,1,0,0|3,0,0]=4 2844 B8R1.5 O[C@@H]1CCNC[C@H]1F Amb23439239 [0,0,0,1,0,0|3,0,0]=4 2845 B8R1.5 O[C@@H]1CCOC[C@H]1Cl Amb25258051 [0,0,0,1,0,0|2,0,0]=3 2846 B8R1.5 O[C@@H]1CCOC[C@H]1F Amb25054496 [0,0,0,1,0,0|2,0,0]=3 2847 B8R1.5 O[C@@H]1CNCC[C@@H]1O Amb15701275 [0,0,0,1,0,0|2,0,0]=3 2848 B8R1.5 O[C@@H]1CNCC[C@@H]1O Amb22754314 [0,0,0,1,0,0|2,0,0]=3 2849 B8R1.5 O[C@@H]1CNCC[C@H]1Br Amb25285584 [0,0,0,1,0,0|2,0,0]=3 2850 B8R1.5 O[C@@H]1CNCC[C@H]1F Amb22739017 [0,0,0,1,0,0|2,0,0]=3 2851 B8R1.5 O[C@@H]1CNCC[C@H]1F Amb23439238 [0,0,0,1,0,0|2,0,0]=3 2852 B8R1.5 O[C@@H]1CNCC[C@H]1O Amb22746225 [0,0,0,1,0,0|2,0,0]=3 2853 B8R1.5 O[C@@H]1CNCC[C@H]1O Amb22748912 [0,0,0,1,0,0|2,0,0]=3 2854 B8R1.5 O[C@@H]1CNNC[C@@H]1O Amb25045719 [0,0,0,1,0,0|3,0,0]=4 2855 B8R1.5 O[C@@H]1COCCC1=O Amb25086646 [0,0,0,1,0,0|1,0,1]=3 2856 B8R1.5 O[C@@H]1CSSC[C@@H]1O Amb17621830 [0,0,0,1,0,0|2,1,0]=4 2857 B8R1.5 O[C@@H]1OCCC[C@H]1Cl Amb25360183 [0,0,0,1,0,0|3,0,0]=4 2858 B8R1.5 O[C@H]1C=COC[C@@H]1O Amb25333549 [0,0,0,1,0,0|1,0,2]=4 2859 B8R1.5 O[C@H]1C=COC[C@H]1O Amb24675340 [0,0,0,1,0,0|1,0,2]=4 2860 B8R1.5 O[C@H]1C=NOC[C@H]1O Amb25221495 [0,0,0,1,0,0|2,0,1]=4 2861 B8R1.5 O[C@H]1CC=CC[C@@H]1Br Amb24519154 [0,0,0,1,0,0|2,0,1]=4 2862 B8R1.5 O[C@H]1CC=CC[C@@H]1Cl Amb24606262 [0,0,0,1,0,0|2,0,1]=4 2863 B8R1.5 O[C@H]1CC=CC[C@@H]1O Amb24718350 [0,0,0,1,0,0|2,0,1]=4 2864 B8R1.5 O[C@H]1CCC=C[C@@H]1O Amb25746823 [0,0,0,1,0,0|2,0,1]=4 2865 B8R1.5 O[C@H]1CCCC[C@@H]1Br Amb24629284 [0,0,0,1,0,0|2,0,0]=3 2866 B8R1.5 O[C@H]1CCCC[C@@H]1I Amb10601566 [0,0,0,1,0,0|2,0,0]=3 2867 B8R1.5 O[C@H]1CCNC[C@H]1F Amb25242620 [0,0,0,1,0,0|3,0,0]=4 2868 B8R1.5 O[C@H]1CCSC[C@H]1Br Amb25328824 [0,0,0,1,0,0|2,1,0]=4 2869 B8R1.5 O[C@H]1CNCC[C@H]1F Amb25858361 [0,0,0,1,0,0|2,0,0]=3 2870 B8R1.5 O[C@H]1CNCC[C@H]1O Amb22406028 [0,0,0,1,0,0|2,0,0]=3 2871 B8R1.5 O[C@H]1COCC[C@@H]1Br Amb24595192 [0,0,0,1,0,0|1,0,0]=2 2872 B8R1.5 O[C@H]1COCC[C@@H]1O Amb24640365 [0,0,0,1,0,0|1,0,0]=2 2873 B8R1.5 O[C@H]1OCCC[C@@H]1Cl Amb24558218 [0,0,0,1,0,0|3,0,0]=4 2874 B8R1.5 SC1CCCCC1Br Amb25765591 [0,0,0,1,0,0|2,1,0]=4 2875 B8R1.5 [NH-]C1CCCCC1[NH-] Amb20240925 [0,0,0,1,0,0|3,0,0]=4 2876 B8R1.5 [NH3+][C@@H]1CCCC[C@@H]1O Amb24112952 [0,0,0,1,0,0|2,0,0]=3 2877 B8R1.8 BrCCC1=NCCO1 Amb24740753 [0,0,0,1,0,0|2,0,1]=4 2878 B8R1.8 BrCCC1CCCC1 Amb18178329 [0,0,0,1,0,0|2,0,0]=3 2879 B8R1.8 BrCCC1CNCC1 Amb22274601 [0,0,0,1,0,0|3,0,0]=4 2880 B8R1.8 BrCCC1CNCC1 Amb24105414 [0,0,0,1,0,0|3,0,0]=4 2881 B8R1.8 BrCCC1COCC1 Amb15701388 [0,0,0,1,0,0|3,0,0]=4 2882 B8R1.8 BrCCC1COCO1 Amb24650011 [0,0,0,1,0,0|3,0,0]=4 2883 B8R1.8 BrCCC1OC=CO1 Amb25185124 [0,0,0,1,0,0|1,0,2]=4 2884 B8R1.8 BrCCC1SCCS1 Amb25758690 [0,0,0,1,0,0|1,2,0]=4 2885 B8R1.8 BrCCC=1CCCC1 Amb25685270 [0,0,0,1,0,0|2,0,1]=4 2886 B8R1.8 BrCC[C@@H]1CCCN1 Amb25210834 [0,0,0,1,0,0|3,0,0]=4 2887 B8R1.8 BrCC[C@@H]1CNCC1 Amb22271892 [0,0,0,1,0,0|3,0,0]=4 2888 B8R1.8 BrCC[C@@H]1CNCC1 Amb24558715 [0,0,0,1,0,0|3,0,0]=4 2889 B8R1.8 BrCC[C@H]1CNCC1 Amb22271891 [0,0,0,1,0,0|3,0,0]=4 2890 B8R1.8 BrCC[C@H]1CNCC1 Amb25026182 [0,0,0,1,0,0|3,0,0]=4 2891 B8R1.8 BrCC[C@H]1COCC1 Amb24533973 [0,0,0,1,0,0|3,0,0]=4 2892 B8R1.8 BrCOC1CCCC1 Amb25215361 [0,0,0,1,0,0|3,0,0]=4 2893 B8R1.8 Br[Mg]CC1OCCO1 Amb16226924 [0,0,0,1,0,0|2,0,0]=3 2894 B8R1.8 Br[Zn]CC1OCCO1 Amb22000494 [0,0,0,1,0,0|2,0,0]=3 2895 B8R1.8 C#CCN1CCCC1 Amb17670646 [0,0,0,1,0,0|2,0,1]=4 2896 B8R1.8 C#CCN1CCCC1 Amb22085943 [0,0,0,1,0,0|2,0,1]=4 2897 B8R1.8 CCCC1CCCN1 Amb2237161 [0,0,0,1,0,0|2,0,0]=3 2898 B8R1.8 CCCC1CCCN1 Amb22587167 [0,0,0,1,0,0|2,0,0]=3 2899 B8R1.8 CCCC1CCCO1 Amb25662993 [0,0,0,1,0,0|1,0,0]=2 2900 B8R1.8 CCCC1CNCC1 Amb10607827 [0,0,0,1,0,0|3,0,0]=4 2901 B8R1.8 CCCC1NCC=C1 Amb10608151 [0,0,0,1,0,0|2,0,1]=4 2902 B8R1.8 CCCC1NCCS1 Amb19515280 [0,0,0,1,0,0|1,1,0]=3 2903 B8R1.8 CCCC1NCCS1 Amb22059065 [0,0,0,1,0,0|1,1,0]=3 2904 B8R1.8 CCCC=1NCCN1 Amb19944693 [0,0,0,1,0,0|2,0,1]=4 2905 B8R1.8 CCCN1CCCC1 Amb20620401 [0,0,0,1,0,0|2,0,0]=3 2906 B8R1.8 CCC[C@H]1CCCN1 Amb24637488 [0,0,0,1,0,0|2,0,0]=3 2907 B8R1.8 CCC[C@H]1CNCC1 Amb24630601 [0,0,0,1,0,0|3,0,0]=4 2908 B8R1.8 CCNN1CCCC1 Amb22411591 [0,0,0,1,0,0|3,0,0]=4 2909 B8R1.8 CCOC1=NCCO1 Amb24595914 [0,0,0,1,0,0|2,0,1]=4 2910 B8R1.8 CCOC1CCCN1 Amb24428113 [0,0,0,1,0,0|3,0,0]=4 2911 B8R1.8 CCOC1CCCO1 Amb22228805 [0,0,0,1,0,0|2,0,0]=3 2912 B8R1.8 CCOC1OCCO1 Amb10569618 [0,0,0,1,0,0|1,0,0]=2 2913 B8R1.8 CCOC1OCCS1 Amb10569619 [0,0,0,1,0,0|1,1,0]=3 2914 B8R1.8 CCSC1NCCS1 Amb25727309 [0,0,0,1,0,0|2,1,0]=4 2915 B8R1.8 CNCC1CCCC1 Amb13951600 [0,0,0,1,0,0|3,0,0]=4 2916 B8R1.8 CNCC1CCCN1 Amb17231816 [0,0,0,1,0,0|3,0,0]=4 2917 B8R1.8 CNCN1CCCC1 Amb25076684 [0,0,0,1,0,0|3,0,0]=4 2918 B8R1.8 CNC[C@@H]1CCCN1 Amb25189015 [0,0,0,1,0,0|3,0,0]=4 2919 B8R1.8 CNC[C@H]1CCCN1 Amb24763299 [0,0,0,1,0,0|3,0,0]=4 2920 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,0,0,1,0,0|2,0,0]=3 2921 B8R1.8 COCC1CCCC1 Amb25264349 [0,0,0,1,0,0|3,0,0]=4 2922 B8R1.8 COCC1CCCN1 Amb17659151 [0,0,0,1,0,0|3,0,0]=4 2923 B8R1.8 COCC1CCCN1 Amb20622354 [0,0,0,1,0,0|3,0,0]=4 2924 B8R1.8 COCC1COCO1 Amb25260839 [0,0,0,1,0,0|3,0,0]=4 2925 B8R1.8 COCC1NCCS1 Amb24432877 [0,0,0,1,0,0|2,1,0]=4 2926 B8R1.8 COC[C@@H]1CCCN1 Amb24182058 [0,0,0,1,0,0|3,0,0]=4 2927 B8R1.8 COC[C@H]1CCCN1 Amb22293917 [0,0,0,1,0,0|3,0,0]=4 2928 B8R1.8 CSCC1CCCC1 Amb25206908 [0,0,0,1,0,0|3,0,0]=4 2929 B8R1.8 CSCC1CCCN1 Amb2237163 [0,0,0,1,0,0|3,0,0]=4 2930 B8R1.8 C\C=C\C1OCCO1 Amb17334061 [0,0,0,1,0,0|0,0,2]=3 2931 B8R1.8 ClCC=C1CCCC1 Amb24481221 [0,0,0,1,0,0|2,0,1]=4 2932 B8R1.8 ClCCC1CCCN1 Amb18124396 [0,0,0,1,0,0|3,0,0]=4 2933 B8R1.8 ClCCC1CCCN1 Amb24089606 [0,0,0,1,0,0|3,0,0]=4 2934 B8R1.8 ClCCC1CNCC1 Amb22299853 [0,0,0,1,0,0|3,0,0]=4 2935 B8R1.8 ClCCC1COCC1 Amb24532020 [0,0,0,1,0,0|3,0,0]=4 2936 B8R1.8 ClCCC1OCCO1 Amb16234111 [0,0,0,1,0,0|1,0,0]=2 2937 B8R1.8 ClCCC=1CCCC1 Amb24643026 [0,0,0,1,0,0|2,0,1]=4 2938 B8R1.8 ClCC[C@@H]1CNCC1 Amb22272043 [0,0,0,1,0,0|3,0,0]=4 2939 B8R1.8 ClCC[C@H]1CNCC1 Amb22292824 [0,0,0,1,0,0|3,0,0]=4 2940 B8R1.8 ClCC[NH+]1CCCC1 Amb10603307 [0,0,0,1,0,0|2,0,0]=3 2941 B8R1.8 ClCC[NH+]1CCCC1 Amb24113840 [0,0,0,1,0,0|2,0,0]=3 2942 B8R1.8 ClCOC1CCCO1 Amb25793433 [0,0,0,1,0,0|3,0,0]=4 2943 B8R1.8 ClCSC1CCCC1 Amb25343994 [0,0,0,1,0,0|3,0,0]=4 2944 B8R1.8 FCCC1CNCC1 Amb21959205 [0,0,0,1,0,0|3,0,0]=4 2945 B8R1.8 ICCC1CCCC1 Amb24383289 [0,0,0,1,0,0|2,0,0]=3 2946 B8R1.8 ICCC1CNCC1 Amb22296926 [0,0,0,1,0,0|3,0,0]=4 2947 B8R1.8 ICCN1CCCC1 Amb25057107 [0,0,0,1,0,0|2,0,0]=3 2948 B8R1.8 ICC[C@@H]1CNCC1 Amb22294283 [0,0,0,1,0,0|3,0,0]=4 2949 B8R1.8 ICC[C@H]1CNCC1 Amb22294282 [0,0,0,1,0,0|3,0,0]=4 2950 B8R1.8 ICOC1CCCC1 Amb24541599 [0,0,0,1,0,0|3,0,0]=4 2951 B8R1.8 N#CCC1CCCC1 Amb17138362 [0,0,0,1,0,0|2,0,1]=4 2952 B8R1.8 N#CCC1CCCO1 Amb1102605 [0,0,0,1,0,0|2,0,1]=4 2953 B8R1.8 N#CCC1OCCO1 Amb17334055 [0,0,0,1,0,0|1,0,1]=3 2954 B8R1.8 N#CC[NH+]1CCCC1 Amb22728209 [0,0,0,1,0,0|2,0,1]=4 2955 B8R1.8 NCCC1CCCC1 Amb1089736 [0,0,0,1,0,0|2,0,0]=3 2956 B8R1.8 NCCC1CCCC1 Amb2099819 [0,0,0,1,0,0|2,0,0]=3 2957 B8R1.8 NCCC1CCCN1 Amb18954128 [0,0,0,1,0,0|3,0,0]=4 2958 B8R1.8 NCCC1CCCO1 Amb1102677 [0,0,0,1,0,0|2,0,0]=3 2959 B8R1.8 NCCC1CCCO1 Amb13952618 [0,0,0,1,0,0|2,0,0]=3 2960 B8R1.8 NCCC1CNCC1 Amb18833027 [0,0,0,1,0,0|3,0,0]=4 2961 B8R1.8 NCCC1COCC1 Amb15701360 [0,0,0,1,0,0|3,0,0]=4 2962 B8R1.8 NCCC1COCC1 Amb22001860 [0,0,0,1,0,0|3,0,0]=4 2963 B8R1.8 NCCC1CSCC1 Amb18199484 [0,0,0,1,0,0|3,0,0]=4 2964 B8R1.8 NCCC1SCCS1 Amb25317389 [0,0,0,1,0,0|1,2,0]=4 2965 B8R1.8 NCCC=1CCCC1 Amb18641665 [0,0,0,1,0,0|2,0,1]=4 2966 B8R1.8 NCCN1CCCC1 Amb10610085 [0,0,0,1,0,0|2,0,0]=3 2967 B8R1.8 NCCN1CCCC1 Amb22728111 [0,0,0,1,0,0|2,0,0]=3 2968 B8R1.8 NCCN1CNCC1 Amb18641856 [0,0,0,1,0,0|3,0,0]=4 2969 B8R1.8 NCC[C@@H]1C=CCO1 Amb25717373 [0,0,0,1,0,0|2,0,1]=4 2970 B8R1.8 NCC[C@@H]1CNCC1 Amb22294750 [0,0,0,1,0,0|3,0,0]=4 2971 B8R1.8 NCC[C@H]1CNCC1 Amb22265240 [0,0,0,1,0,0|3,0,0]=4 2972 B8R1.8 NCC[C@H]1CNCC1 Amb24634720 [0,0,0,1,0,0|3,0,0]=4 2973 B8R1.8 NNCC1CCCC1 Amb10608985 [0,0,0,1,0,0|3,0,0]=4 2974 B8R1.8 NNCC1CCCO1 Amb10610188 [0,0,0,1,0,0|3,0,0]=4 2975 B8R1.8 NNCC1CCCO1 Amb10610215 [0,0,0,1,0,0|3,0,0]=4 2976 B8R1.8 NOCC1CCCC1 Amb21858976 [0,0,0,1,0,0|3,0,0]=4 2977 B8R1.8 NOCC1CCCC1 Amb25189022 [0,0,0,1,0,0|3,0,0]=4 2978 B8R1.8 NOCC1CCCO1 Amb17231830 [0,0,0,1,0,0|3,0,0]=4 2979 B8R1.8 NOC[C@@H]1CCCO1 Amb25823965 [0,0,0,1,0,0|3,0,0]=4 2980 B8R1.8 O=CCC1CCCC1 Amb17672924 [0,0,0,1,0,0|1,0,2]=4 2981 B8R1.8 O=CCC1CCCO1 Amb18641800 [0,0,0,1,0,0|2,0,1]=4 2982 B8R1.8 O=CCC1OCCO1 Amb18831794 [0,0,0,1,0,0|1,0,1]=3 2983 B8R1.8 OCC=C1CCCC1 Amb25083481 [0,0,0,1,0,0|1,0,1]=3 2984 B8R1.8 OCCC1C=CCO1 Amb24553966 [0,0,0,1,0,0|2,0,1]=4 2985 B8R1.8 OCCC1CC=CC1 Amb24482557 [0,0,0,1,0,0|1,0,2]=4 2986 B8R1.8 OCCC1CCCN1 Amb22754588 [0,0,0,1,0,0|2,0,0]=3 2987 B8R1.8 OCCC1CCCO1 Amb20622383 [0,0,0,1,0,0|2,0,0]=3 2988 B8R1.8 OCCC1CCON1 Amb22897219 [0,0,0,1,0,0|3,0,0]=4 2989 B8R1.8 OCCC1CNCC1 Amb22406195 [0,0,0,1,0,0|2,0,0]=3 2990 B8R1.8 OCCC1COCC1 Amb15701367 [0,0,0,1,0,0|2,0,0]=3 2991 B8R1.8 OCCC1CSCC1 Amb18202827 [0,0,0,1,0,0|2,0,0]=3 2992 B8R1.8 OCCC1NCCO1 Amb24386107 [0,0,0,1,0,0|2,0,0]=3 2993 B8R1.8 OCCC1NCCS1 Amb24446611 [0,0,0,1,0,0|2,1,0]=4 2994 B8R1.8 OCCC1OCCO1 Amb22264778 [0,0,0,1,0,0|1,0,0]=2 2995 B8R1.8 OCCC1SCCS1 Amb24704768 [0,0,0,1,0,0|1,2,0]=4 2996 B8R1.8 OCCC=1CCCC1 Amb25333041 [0,0,0,1,0,0|1,0,1]=3 2997 B8R1.8 OCCC=1CNCC1 Amb24656485 [0,0,0,1,0,0|2,0,1]=4 2998 B8R1.8 OCCC=1NCCN1 Amb24613979 [0,0,0,1,0,0|3,0,0]=4 2999 B8R1.8 OCCN1CCC=N1 Amb15701438 [0,0,0,1,0,0|2,0,1]=4 3000 B8R1.8 OCCN1CCCC1 Amb22002207 [0,0,0,1,0,0|1,0,0]=2 3001 B8R1.8 OCCN1CCCN1 Amb24562645 [0,0,0,1,0,0|2,0,0]=3 3002 B8R1.8 OCCN1CCCO1 Amb25094269 [0,0,0,1,0,0|2,0,0]=3 3003 B8R1.8 OCCN1CCN=C1 Amb25711229 [0,0,0,1,0,0|2,0,1]=4 3004 B8R1.8 OCC[C@@H]1CCC=C1 Amb25810186 [0,0,0,1,0,0|1,0,2]=4 3005 B8R1.8 OCC[C@@H]1CNCC1 Amb22299669 [0,0,0,1,0,0|2,0,0]=3 3006 B8R1.8 OCC[C@H]1CCC=C1 Amb25220996 [0,0,0,1,0,0|1,0,2]=4 3007 B8R1.8 OCC[C@H]1CNCC1 Amb22299725 [0,0,0,1,0,0|2,0,0]=3 3008 B8R1.8 OCC[C@H]1CNCC1 Amb24411426 [0,0,0,1,0,0|2,0,0]=3 3009 B8R1.8 OCC[C@H]1COCC1 Amb25803012 [0,0,0,1,0,0|2,0,0]=3 3010 B8R1.8 ONCC1CCCO1 Amb25684501 [0,0,0,1,0,0|3,0,0]=4 3011 B8R1.8 SCCC1CNCC1 Amb22298487 [0,0,0,1,0,0|2,1,0]=4 3012 B8R1.8 SCCN1CSCC1 Amb22230991 [0,0,0,1,0,0|2,1,0]=4 3013 B8R1.8 SCC[C@@H]1CNCC1 Amb22299729 [0,0,0,1,0,0|2,1,0]=4 3014 B8R1.8 SCC[C@@H]1CNCC1 Amb24552684 [0,0,0,1,0,0|2,1,0]=4 3015 B8R1.8 SCC[C@H]1CNCC1 Amb22299728 [0,0,0,1,0,0|2,1,0]=4 3016 B8R1.8 SCC[C@H]1CNCC1 Amb25197867 [0,0,0,1,0,0|2,1,0]=4 3017 B8R1.9 CC1CC1C#CCO Amb25043719 [0,0,0,1,0,0|1,0,1]=3 3018 B8R1.9 CC1CC1NCC#C Amb18285942 [0,0,0,1,0,0|2,0,1]=4 3019 B8R1.9 CC1CC1NCC#N Amb18285947 [0,0,0,1,0,0|2,0,1]=4 3020 B8R1.9 CC1CC1NCC=C Amb18990736 [0,0,0,1,0,0|2,0,1]=4 3021 B8R1.9 CC1CC1NCCC Amb18990709 [0,0,0,1,0,0|2,0,0]=3 3022 B8R1.9 CC1CC1NCCN Amb18298245 [0,0,0,1,0,0|2,0,0]=3 3023 B8R1.9 CC1CC1NCCO Amb18298792 [0,0,0,1,0,0|1,0,0]=2 3024 B8R1.9 CC1CC1OCCCl Amb24481227 [0,0,0,1,0,0|1,0,0]=2 3025 B8R1.9 CC1CC1OCCO Amb25143294 [0,0,0,1,0,0|0,0,0]=1 3026 B8R1.9 CC1OC1CCCCl Amb24524265 [0,0,0,1,0,0|3,0,0]=4 3027 B8R1.9 CC1OC1\C=C\CO Amb24421623 [0,0,0,1,0,0|2,0,1]=4 3028 B8R1.9 CCCCC1CC1Br Amb25296467 [0,0,0,1,0,0|2,0,0]=3 3029 B8R1.9 CCCCC1CC1Cl Amb25778308 [0,0,0,1,0,0|2,0,0]=3 3030 B8R1.9 CCCCC1OC1Cl Amb25266992 [0,0,0,1,0,0|3,0,0]=4 3031 B8R1.9 CCCC[C@@H]1C[C@H]1F Amb24549096 [0,0,0,1,0,0|2,0,0]=3 3032 B8R1.9 CCCC[C@@H]1C[C@H]1O Amb24598213 [0,0,0,1,0,0|1,0,0]=2 3033 B8R1.9 CCCC[C@@H]1O[C@@H]1Cl Amb25339622 [0,0,0,1,0,0|3,0,0]=4 3034 B8R1.9 C[C@@H]1C[C@H]1OCCCl Amb24617852 [0,0,0,1,0,0|1,0,0]=2 3035 B8R1.9 C[C@@H]1O[C@@H]1CCCBr Amb25173062 [0,0,0,1,0,0|3,0,0]=4 3036 B8R1.9 C[C@@H]1O[C@@H]1CCCCl Amb24515089 [0,0,0,1,0,0|3,0,0]=4 3037 B8R1.9 C[C@@H]1O[C@@H]1CCCO Amb25176894 [0,0,0,1,0,0|2,0,0]=3 3038 B8R1.9 C[C@H]1O[C@@H]1\C=C\CO Amb25215235 [0,0,0,1,0,0|2,0,1]=4 3039 B8R1.9 C[C@H]1O[C@H]1CCCO Amb25332332 [0,0,0,1,0,0|2,0,0]=3 3040 B8R1.9 O[C@H]1CC1CCCCl Amb25283482 [0,0,0,1,0,0|2,0,0]=3 3041 B8R1.10 BrCCCC1CCC1 Amb25756718 [0,0,0,1,0,0|2,0,0]=3 3042 B8R1.10 BrCCCN1CCC1 Amb24412145 [0,0,0,1,0,0|3,0,0]=4 3043 B8R1.10 BrCCOC1CCC1 Amb18796095 [0,0,0,1,0,0|1,0,0]=2 3044 B8R1.10 C#CCNC1CCC1 Amb18957035 [0,0,0,1,0,0|2,0,1]=4 3045 B8R1.10 C#CCOC1CCC1 Amb23598916 [0,0,0,1,0,0|1,0,1]=3 3046 B8R1.10 C#CCOC1CNC1 Amb21956108 [0,0,0,1,0,0|2,0,1]=4 3047 B8R1.10 C#CCOC1CNC1 Amb22011668 [0,0,0,1,0,0|2,0,1]=4 3048 B8R1.10 C=CCNC1CCC1 Amb18291589 [0,0,0,1,0,0|2,0,1]=4 3049 B8R1.10 C=CCOC1CCC1 Amb25787166 [0,0,0,1,0,0|1,0,1]=3 3050 B8R1.10 C=CCOC1CNC1 Amb21956109 [0,0,0,1,0,0|2,0,1]=4 3051 B8R1.10 C=CCOC1COC1 Amb22737293 [0,0,0,1,0,0|2,0,1]=4 3052 B8R1.10 C=CCOC1C[NH2+]C1 Amb22896707 [0,0,0,1,0,0|2,0,1]=4 3053 B8R1.10 CCCCC1CCN1 Amb25353385 [0,0,0,1,0,0|2,0,0]=3 3054 B8R1.10 CCCCC1CNC1 Amb24082818 [0,0,0,1,0,0|3,0,0]=4 3055 B8R1.10 CCCNC1CCC1 Amb18989245 [0,0,0,1,0,0|2,0,0]=3 3056 B8R1.10 CCCNC1CNC1 Amb24374352 [0,0,0,1,0,0|3,0,0]=4 3057 B8R1.10 CCCNC1COC1 Amb15693523 [0,0,0,1,0,0|3,0,0]=4 3058 B8R1.10 CCCOC1CNC1 Amb18301144 [0,0,0,1,0,0|2,0,0]=3 3059 B8R1.10 CCCOC1CNC1 Amb22489787 [0,0,0,1,0,0|2,0,0]=3 3060 B8R1.10 CCCSC1CNC1 Amb24524572 [0,0,0,1,0,0|2,1,0]=4 3061 B8R1.10 CCOCC1CCN1 Amb21959286 [0,0,0,1,0,0|3,0,0]=4 3062 B8R1.10 CCONC1CCC1 Amb24601737 [0,0,0,1,0,0|3,0,0]=4 3063 B8R1.10 CNCCC1CCC1 Amb23580285 [0,0,0,1,0,0|3,0,0]=4 3064 B8R1.10 ClCCNC1CCC1 Amb25190032 [0,0,0,1,0,0|2,0,0]=3 3065 B8R1.10 ClCCOC1CCC1 Amb25277094 [0,0,0,1,0,0|1,0,0]=2 3066 B8R1.10 ClC\C=C\C1CCC1 Amb24474472 [0,0,0,1,0,0|2,0,1]=4 3067 B8R1.10 FCCCN1CCC1 Amb25183215 [0,0,0,1,0,0|3,0,0]=4 3068 B8R1.10 FCCNC1CCC1 Amb24710850 [0,0,0,1,0,0|2,0,0]=3 3069 B8R1.10 FCCNC1COC1 Amb24483268 [0,0,0,1,0,0|3,0,0]=4 3070 B8R1.10 FCCNC1CSC1 Amb25344376 [0,0,0,1,0,0|3,0,0]=4 3071 B8R1.10 FCCOC1CNC1 Amb21956400 [0,0,0,1,0,0|2,0,0]=3 3072 B8R1.10 FCCOC1CNC1 Amb22011644 [0,0,0,1,0,0|2,0,0]=3 3073 B8R1.10 FCCOC1CNC1 Amb22898973 [0,0,0,1,0,0|2,0,0]=3 3074 B8R1.10 ICCCN1CCC1 Amb24476605 [0,0,0,1,0,0|3,0,0]=4 3075 B8R1.10 N#CCNC1CCC1 Amb18961377 [0,0,0,1,0,0|2,0,1]=4 3076 B8R1.10 N#CCOC1CCC1 Amb24435052 [0,0,0,1,0,0|1,0,1]=3 3077 B8R1.10 NCCC=C1CCC1 Amb25051676 [0,0,0,1,0,0|2,0,1]=4 3078 B8R1.10 NCCCC1CCC1 Amb23570814 [0,0,0,1,0,0|2,0,0]=3 3079 B8R1.10 NCCCN1CCC1 Amb22039460 [0,0,0,1,0,0|3,0,0]=4 3080 B8R1.10 NCCNC1CCC1 Amb18989453 [0,0,0,1,0,0|2,0,0]=3 3081 B8R1.10 NCCNC1COC1 Amb22736604 [0,0,0,1,0,0|3,0,0]=4 3082 B8R1.10 NCCNC1CSC1 Amb24514558 [0,0,0,1,0,0|3,0,0]=4 3083 B8R1.10 NCCOC1CCC1 Amb18993208 [0,0,0,1,0,0|1,0,0]=2 3084 B8R1.10 NCCOC1CNC1 Amb25238878 [0,0,0,1,0,0|2,0,0]=3 3085 B8R1.10 NCCOC1COC1 Amb23512834 [0,0,0,1,0,0|2,0,0]=3 3086 B8R1.10 NC\C=C\C1CCC1 Amb24483253 [0,0,0,1,0,0|2,0,1]=4 3087 B8R1.10 OCC#CC1CNC1 Amb25830612 [0,0,0,1,0,0|2,0,1]=4 3088 B8R1.10 OCCCC1CC=C1 Amb25092021 [0,0,0,1,0,0|1,0,2]=4 3089 B8R1.10 OCCCC1CCC1 Amb23570813 [0,0,0,1,0,0|1,0,0]=2 3090 B8R1.10 OCCCC1CNC1 Amb19516465 [0,0,0,1,0,0|2,0,0]=3 3091 B8R1.10 OCCCC1CNC1 Amb22737371 [0,0,0,1,0,0|2,0,0]=3 3092 B8R1.10 OCCCC1COC1 Amb21856769 [0,0,0,1,0,0|2,0,0]=3 3093 B8R1.10 OCCCC1CSC1 Amb25178566 [0,0,0,1,0,0|2,0,0]=3 3094 B8R1.10 OCCCN1CCC1 Amb22292344 [0,0,0,1,0,0|2,0,0]=3 3095 B8R1.10 OCCNC1CCC1 Amb18982433 [0,0,0,1,0,0|1,0,0]=2 3096 B8R1.10 OCCNC1COC1 Amb22737363 [0,0,0,1,0,0|2,0,0]=3 3097 B8R1.10 OCCOC1CCC1 Amb20622528 [0,0,0,1,0,0|0,0,0]=1 3098 B8R1.10 OCCOC1CNC1 Amb25262576 [0,0,0,1,0,0|1,0,0]=2 3099 B8R1.10 OCCSC1CNC1 Amb25679018 [0,0,0,1,0,0|1,1,0]=3 3100 B8R1.10 OCCSC1COC1 Amb25110424 [0,0,0,1,0,0|1,1,0]=3 3101 B8R1.10 OCCSC1CSC1 Amb24386967 [0,0,0,1,0,0|1,1,0]=3 3102 B8R1.10 OC\C=C\C1CCC1 Amb24404063 [0,0,0,1,0,0|1,0,1]=3 3103 B8R1.10 SCCCN1CCC1 Amb25763937 [0,0,0,1,0,0|2,1,0]=4 3104 B8R1.10 SCCOC1COC1 Amb25045394 [0,0,0,1,0,0|1,1,0]=3 3105 B8R1.11 C#CC1CCCC1O Amb22496803 [0,0,0,1,0,0|1,0,2]=4 3106 B8R1.11 C#C[C@@H]1CCC[C@H]1O Amb25746628 [0,0,0,1,0,0|1,0,2]=4 3107 B8R1.11 C#C[C@@H]1OCC[C@@H]1Cl Amb24520205 [0,0,0,1,0,0|2,0,1]=4 3108 B8R1.11 C#C[C@H]1OCC[C@H]1Cl Amb24624692 [0,0,0,1,0,0|2,0,1]=4 3109 B8R1.11 C=C1CCCC1CO Amb25065044 [0,0,0,1,0,0|1,0,2]=4 3110 B8R1.11 C=C1CCC[C@H]1CO Amb24642386 [0,0,0,1,0,0|1,0,2]=4 3111 B8R1.11 C=CC1CNCC1O Amb25189891 [0,0,0,1,0,0|1,0,2]=4 3112 B8R1.11 C=CC1OCCC1N Amb25080525 [0,0,0,1,0,0|2,0,1]=4 3113 B8R1.11 C=CC1OCCC1O Amb25105995 [0,0,0,1,0,0|2,0,1]=4 3114 B8R1.11 C=C[C@@H]1CCC[C@H]1O Amb22802079 [0,0,0,1,0,0|1,0,2]=4 3115 B8R1.11 C=C[C@@H]1CNC[C@H]1O Amb24561646 [0,0,0,1,0,0|1,0,2]=4 3116 B8R1.11 C=C[C@@H]1OCC[C@H]1Cl Amb24531903 [0,0,0,1,0,0|2,0,1]=4 3117 B8R1.11 CC1=CCCC1CO Amb25804911 [0,0,0,1,0,0|1,0,2]=4 3118 B8R1.11 CC1C=CCC1CO Amb25169524 [0,0,0,1,0,0|1,0,2]=4 3119 B8R1.11 CC1CCC=C1CBr Amb24650933 [0,0,0,1,0,0|2,0,1]=4 3120 B8R1.11 CC1CCCC1=NO Amb24469856 [0,0,0,1,0,0|2,0,1]=4 3121 B8R1.11 CC1CCCC1C#N Amb24415234 [0,0,0,1,0,0|2,0,1]=4 3122 B8R1.11 CC1CCCC1C=O Amb18124243 [0,0,0,1,0,0|1,0,2]=4 3123 B8R1.11 CC1CCCC1CC Amb25788505 [0,0,0,1,0,0|2,0,0]=3 3124 B8R1.11 CC1CCCC1CCl Amb25104890 [0,0,0,1,0,0|2,0,0]=3 3125 B8R1.11 CC1CCCC1CO Amb22886834 [0,0,0,1,0,0|1,0,0]=2 3126 B8R1.11 CC1CCCC1NC Amb18276776 [0,0,0,1,0,0|3,0,0]=4 3127 B8R1.11 CC1CCCC1NO Amb25331618 [0,0,0,1,0,0|2,0,0]=3 3128 B8R1.11 CC1CCNC1CO Amb23441154 [0,0,0,1,0,0|1,0,0]=2 3129 B8R1.11 CC1CCOC1CBr Amb25043116 [0,0,0,1,0,0|1,0,0]=2 3130 B8R1.11 CC1CCOC1CO Amb25358374 [0,0,0,1,0,0|0,0,0]=1 3131 B8R1.11 CC1CNCC1CO Amb25739981 [0,0,0,1,0,0|2,0,0]=3 3132 B8R1.11 CC1CNCC1NC Amb25072559 [0,0,0,1,0,0|3,0,0]=4 3133 B8R1.11 CC1CNCC1OC Amb25246771 [0,0,0,1,0,0|3,0,0]=4 3134 B8R1.11 CC1COCC1CO Amb23399676 [0,0,0,1,0,0|2,0,0]=3 3135 B8R1.11 CC1CSCC1CN Amb24564573 [0,0,0,1,0,0|2,1,0]=4 3136 B8R1.11 CC1NCCC1CC Amb18947130 [0,0,0,1,0,0|3,0,0]=4 3137 B8R1.11 CC1NCCC1CF Amb24754413 [0,0,0,1,0,0|3,0,0]=4 3138 B8R1.11 CC1NCCC1CN Amb18203354 [0,0,0,1,0,0|3,0,0]=4 3139 B8R1.11 CC1OCCC1CN Amb24398461 [0,0,0,1,0,0|3,0,0]=4 3140 B8R1.11 CC1OCOC1CCl Amb24481325 [0,0,0,1,0,0|2,0,0]=3 3141 B8R1.11 CC1SCCC1NO Amb24469909 [0,0,0,1,0,0|3,0,0]=4 3142 B8R1.11 CCC1CCCC1=C Amb24759653 [0,0,0,1,0,0|2,0,1]=4 3143 B8R1.11 CCC1CCCC1=O Amb16187019 [0,0,0,1,0,0|1,0,2]=4 3144 B8R1.11 CCC1CCCC1Br Amb18182562 [0,0,0,1,0,0|2,0,0]=3 3145 B8R1.11 CCC1CCCC1Cl Amb25080381 [0,0,0,1,0,0|2,0,0]=3 3146 B8R1.11 CCC1CCCC1O Amb20621081 [0,0,0,1,0,0|1,0,0]=2 3147 B8R1.11 CCC1CCCC1S Amb24759652 [0,0,0,1,0,0|1,1,0]=3 3148 B8R1.11 CCC1CCCN1N Amb24354847 [0,0,0,1,0,0|3,0,0]=4 3149 B8R1.11 CCC1CCOC1Br Amb24333881 [0,0,0,1,0,0|3,0,0]=4 3150 B8R1.11 CCC1CCOC1O Amb24475406 [0,0,0,1,0,0|2,0,0]=3 3151 B8R1.11 CCC1CNCC1Br Amb24568611 [0,0,0,1,0,0|2,0,0]=3 3152 B8R1.11 CCC1COCC1O Amb24675632 [0,0,0,1,0,0|0,0,0]=1 3153 B8R1.11 CCC1CSCC1=O Amb25143445 [0,0,0,1,0,0|0,1,2]=4 3154 B8R1.11 CCC1CSCC1Br Amb25173597 [0,0,0,1,0,0|1,1,0]=3 3155 B8R1.11 CCC1CSCC1N Amb18202902 [0,0,0,1,0,0|1,1,0]=3 3156 B8R1.11 CCC1NCCC1F Amb24727332 [0,0,0,1,0,0|3,0,0]=4 3157 B8R1.11 CCC1NCCC1N Amb18203353 [0,0,0,1,0,0|3,0,0]=4 3158 B8R1.11 CCC1NCCC1O Amb18833009 [0,0,0,1,0,0|2,0,0]=3 3159 B8R1.11 CCC1OCCC1Br Amb24333011 [0,0,0,1,0,0|2,0,0]=3 3160 B8R1.11 CCC1OCCC1Cl Amb24374611 [0,0,0,1,0,0|2,0,0]=3 3161 B8R1.11 CCC1OCCC1N Amb25702085 [0,0,0,1,0,0|2,0,0]=3 3162 B8R1.11 CCC1OCCN1C Amb24334291 [0,0,0,1,0,0|2,0,0]=3 3163 B8R1.11 CCN1CCCC1N Amb25229786 [0,0,0,1,0,0|3,0,0]=4 3164 B8R1.11 CCN1CCCC1O Amb25746117 [0,0,0,1,0,0|2,0,0]=3 3165 B8R1.11 CC[C@@H]1C=CC[C@@H]1O Amb24592523 [0,0,0,1,0,0|1,0,1]=3 3166 B8R1.11 CC[C@@H]1CCC[C@@H]1O Amb24519918 [0,0,0,1,0,0|1,0,0]=2 3167 B8R1.11 CC[C@@H]1CCC[C@H]1Br Amb25320892 [0,0,0,1,0,0|2,0,0]=3 3168 B8R1.11 CC[C@@H]1CNC[C@@H]1N Amb25186818 [0,0,0,1,0,0|2,0,0]=3 3169 B8R1.11 CC[C@@H]1CNC[C@H]1O Amb24560816 [0,0,0,1,0,0|1,0,0]=2 3170 B8R1.11 CC[C@@H]1NCC[C@@H]1O Amb24364901 [0,0,0,1,0,0|2,0,0]=3 3171 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb25168928 [0,0,0,1,0,0|2,0,0]=3 3172 B8R1.11 CC[C@@H]1OCC[C@@H]1Br Amb25233391 [0,0,0,1,0,0|2,0,0]=3 3173 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,0,0,1,0,0|2,0,0]=3 3174 B8R1.11 CC[C@@H]1OCC[C@H]1O Amb25246272 [0,0,0,1,0,0|2,0,0]=3 3175 B8R1.11 CC[C@H]1CCC[C@@H]1O Amb25215696 [0,0,0,1,0,0|1,0,0]=2 3176 B8R1.11 CC[C@H]1CCC[C@H]1O Amb25240213 [0,0,0,1,0,0|1,0,0]=2 3177 B8R1.11 CC[C@H]1OCC[C@@H]1O Amb25357528 [0,0,0,1,0,0|2,0,0]=3 3178 B8R1.11 CN1CCCC1CBr Amb19650986 [0,0,0,1,0,0|3,0,0]=4 3179 B8R1.11 CN1CCCC1CBr Amb21960005 [0,0,0,1,0,0|3,0,0]=4 3180 B8R1.11 CN1CCCC1CCl Amb22499600 [0,0,0,1,0,0|3,0,0]=4 3181 B8R1.11 CN1CCCC1CF Amb25242132 [0,0,0,1,0,0|3,0,0]=4 3182 B8R1.11 CN1CCCC1CI Amb21861059 [0,0,0,1,0,0|3,0,0]=4 3183 B8R1.11 CN1CCCC1CN Amb22587695 [0,0,0,1,0,0|3,0,0]=4 3184 B8R1.11 CN1CCCC1CN Amb22757322 [0,0,0,1,0,0|3,0,0]=4 3185 B8R1.11 CN1CCC[C@@H]1CBr Amb22756484 [0,0,0,1,0,0|3,0,0]=4 3186 B8R1.11 CN1CCC[C@@H]1CN Amb22406270 [0,0,0,1,0,0|3,0,0]=4 3187 B8R1.11 CN1CCC[C@@H]1CN Amb22751420 [0,0,0,1,0,0|3,0,0]=4 3188 B8R1.11 CN1CCC[C@@H]1CN Amb22751424 [0,0,0,1,0,0|3,0,0]=4 3189 B8R1.11 CN1CCC[C@H]1CBr Amb22225946 [0,0,0,1,0,0|3,0,0]=4 3190 B8R1.11 CN1CCC[C@H]1CCl Amb22226497 [0,0,0,1,0,0|3,0,0]=4 3191 B8R1.11 CN1CCC[C@H]1CI Amb22226205 [0,0,0,1,0,0|3,0,0]=4 3192 B8R1.11 CNC1CCCC1N Amb23590779 [0,0,0,1,0,0|3,0,0]=4 3193 B8R1.11 CNC1CCCC1O Amb17231821 [0,0,0,1,0,0|2,0,0]=3 3194 B8R1.11 CNC1CNCC1O Amb25138092 [0,0,0,1,0,0|2,0,0]=3 3195 B8R1.11 CNC1COCC1Cl Amb24508695 [0,0,0,1,0,0|2,0,0]=3 3196 B8R1.11 CNC1COCC1O Amb18944293 [0,0,0,1,0,0|1,0,0]=2 3197 B8R1.11 CN[C@@H]1CCC[C@H]1O Amb16230279 [0,0,0,1,0,0|2,0,0]=3 3198 B8R1.11 CN[C@@H]1COC[C@@H]1O Amb24700231 [0,0,0,1,0,0|1,0,0]=2 3199 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22748628 [0,0,0,1,0,0|1,0,0]=2 3200 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22757852 [0,0,0,1,0,0|1,0,0]=2 3201 B8R1.11 CN[C@H]1CNC[C@@H]1O Amb24627693 [0,0,0,1,0,0|2,0,0]=3 3202 B8R1.11 CN[C@H]1CNC[C@H]1O Amb24552363 [0,0,0,1,0,0|2,0,0]=3 3203 B8R1.11 CN[C@H]1COC[C@@H]1O Amb10608328 [0,0,0,1,0,0|1,0,0]=2 3204 B8R1.11 CN[C@H]1COC[C@H]1O Amb22230434 [0,0,0,1,0,0|1,0,0]=2 3205 B8R1.11 COC1CCCC1Br Amb18796094 [0,0,0,1,0,0|3,0,0]=4 3206 B8R1.11 COC1CCCC1N Amb1141892 [0,0,0,1,0,0|3,0,0]=4 3207 B8R1.11 COC1CCCC1O Amb19515034 [0,0,0,1,0,0|2,0,0]=3 3208 B8R1.11 COC1CCOC1O Amb24364851 [0,0,0,1,0,0|3,0,0]=4 3209 B8R1.11 COC1CNCC1F Amb24745837 [0,0,0,1,0,0|3,0,0]=4 3210 B8R1.11 COC1CNCC1N Amb24558991 [0,0,0,1,0,0|3,0,0]=4 3211 B8R1.11 COC1CNCC1O Amb25209957 [0,0,0,1,0,0|2,0,0]=3 3212 B8R1.11 COC1COCC1N Amb17606146 [0,0,0,1,0,0|2,0,0]=3 3213 B8R1.11 COC1COCC1O Amb25048493 [0,0,0,1,0,0|1,0,0]=2 3214 B8R1.11 CO[C@@H]1CCC[C@@H]1Br Amb25242456 [0,0,0,1,0,0|3,0,0]=4 3215 B8R1.11 CO[C@@H]1CCC[C@@H]1N Amb25168975 [0,0,0,1,0,0|3,0,0]=4 3216 B8R1.11 CO[C@@H]1CCC[C@H]1N Amb19514596 [0,0,0,1,0,0|3,0,0]=4 3217 B8R1.11 CO[C@@H]1CCC[C@H]1N Amb19514597 [0,0,0,1,0,0|3,0,0]=4 3218 B8R1.11 CO[C@@H]1CCC[C@H]1O Amb19372843 [0,0,0,1,0,0|2,0,0]=3 3219 B8R1.11 CO[C@@H]1CNC[C@@H]1F Amb22886227 [0,0,0,1,0,0|3,0,0]=4 3220 B8R1.11 CO[C@@H]1CNC[C@@H]1F Amb24700253 [0,0,0,1,0,0|3,0,0]=4 3221 B8R1.11 CO[C@@H]1CNC[C@@H]1N Amb25823639 [0,0,0,1,0,0|3,0,0]=4 3222 B8R1.11 CO[C@@H]1CNC[C@@H]1O Amb24183504 [0,0,0,1,0,0|2,0,0]=3 3223 B8R1.11 CO[C@@H]1CNC[C@@H]1O Amb24441103 [0,0,0,1,0,0|2,0,0]=3 3224 B8R1.11 CO[C@@H]1CNC[C@H]1F Amb22406200 [0,0,0,1,0,0|3,0,0]=4 3225 B8R1.11 CO[C@@H]1CNC[C@H]1N Amb24612402 [0,0,0,1,0,0|3,0,0]=4 3226 B8R1.11 CO[C@@H]1CNC[C@H]1O Amb22748758 [0,0,0,1,0,0|2,0,0]=3 3227 B8R1.11 CO[C@@H]1CNC[C@H]1O Amb23440213 [0,0,0,1,0,0|2,0,0]=3 3228 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb22757962 [0,0,0,1,0,0|2,0,0]=3 3229 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb24539352 [0,0,0,1,0,0|2,0,0]=3 3230 B8R1.11 CO[C@@H]1COC[C@H]1N Amb22757840 [0,0,0,1,0,0|2,0,0]=3 3231 B8R1.11 CO[C@@H]1COC[C@H]1N Amb23438206 [0,0,0,1,0,0|2,0,0]=3 3232 B8R1.11 CO[C@@H]1OCC[C@@H]1O Amb24613572 [0,0,0,1,0,0|3,0,0]=4 3233 B8R1.11 CO[C@@H]1OCC[C@H]1Cl Amb25227813 [0,0,0,1,0,0|3,0,0]=4 3234 B8R1.11 CO[C@H]1CCC[C@@H]1N Amb13951499 [0,0,0,1,0,0|3,0,0]=4 3235 B8R1.11 CO[C@H]1CCC[C@@H]1N Amb13951500 [0,0,0,1,0,0|3,0,0]=4 3236 B8R1.11 CO[C@H]1CCOC1O Amb25344965 [0,0,0,1,0,0|3,0,0]=4 3237 B8R1.11 CO[C@H]1CNC[C@@H]1F Amb25289625 [0,0,0,1,0,0|3,0,0]=4 3238 B8R1.11 CO[C@H]1CNC[C@@H]1N Amb25026691 [0,0,0,1,0,0|3,0,0]=4 3239 B8R1.11 CO[C@H]1CNC[C@@H]1O Amb10608287 [0,0,0,1,0,0|2,0,0]=3 3240 B8R1.11 CO[C@H]1CNC[C@H]1F Amb24381039 [0,0,0,1,0,0|3,0,0]=4 3241 B8R1.11 CO[C@H]1COC[C@@H]1N Amb10608202 [0,0,0,1,0,0|2,0,0]=3 3242 B8R1.11 CO[C@H]1COC[C@@H]1O Amb24661140 [0,0,0,1,0,0|1,0,0]=2 3243 B8R1.11 CO[C@H]1COC[C@H]1N Amb25683516 [0,0,0,1,0,0|2,0,0]=3 3244 B8R1.11 CSC1CCCC1Cl Amb24739096 [0,0,0,1,0,0|3,0,0]=4 3245 B8R1.11 CSC1CCCC1N Amb18642859 [0,0,0,1,0,0|3,0,0]=4 3246 B8R1.11 CSC1COCC1Cl Amb24655904 [0,0,0,1,0,0|2,0,0]=3 3247 B8R1.11 CSC1COCC1N Amb22504265 [0,0,0,1,0,0|2,0,0]=3 3248 B8R1.11 CS[C@@H]1CCC[C@H]1N Amb24599827 [0,0,0,1,0,0|3,0,0]=4 3249 B8R1.11 CS[C@@H]1CCC[C@H]1O Amb24351885 [0,0,0,1,0,0|2,0,0]=3 3250 B8R1.11 CS[C@@H]1CNC[C@H]1O Amb24724293 [0,0,0,1,0,0|2,0,0]=3 3251 B8R1.11 CS[C@@H]1COC[C@H]1Cl Amb24514029 [0,0,0,1,0,0|2,0,0]=3 3252 B8R1.11 CS[C@@H]1COC[C@H]1N Amb24513923 [0,0,0,1,0,0|2,0,0]=3 3253 B8R1.11 C[C@@H]1CCC[C@@H]1CO Amb25175399 [0,0,0,1,0,0|1,0,0]=2 3254 B8R1.11 C[C@@H]1CCC[C@H]1CBr Amb24603453 [0,0,0,1,0,0|2,0,0]=3 3255 B8R1.11 C[C@@H]1CCC[C@H]1CC Amb25697221 [0,0,0,1,0,0|2,0,0]=3 3256 B8R1.11 C[C@@H]1CCC[C@H]1CCl Amb24550126 [0,0,0,1,0,0|2,0,0]=3 3257 B8R1.11 C[C@@H]1CCC[C@H]1CO Amb25258782 [0,0,0,1,0,0|1,0,0]=2 3258 B8R1.11 C[C@@H]1CCN[C@H]1CC Amb18833052 [0,0,0,1,0,0|2,0,0]=3 3259 B8R1.11 C[C@@H]1CNC[C@H]1CO Amb13883444 [0,0,0,1,0,0|2,0,0]=3 3260 B8R1.11 C[C@@H]1NCC[C@@H]1CO Amb22886266 [0,0,0,1,0,0|2,0,0]=3 3261 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb22886286 [0,0,0,1,0,0|3,0,0]=4 3262 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb24540367 [0,0,0,1,0,0|3,0,0]=4 3263 B8R1.11 C[C@@H]1OCC[C@@H]1CO Amb22886851 [0,0,0,1,0,0|2,0,0]=3 3264 B8R1.11 C[C@H]1C=CC[C@H]1CO Amb25235760 [0,0,0,1,0,0|1,0,2]=4 3265 B8R1.11 C[C@H]1CCC[C@@H]1C=O Amb24757729 [0,0,0,1,0,0|1,0,2]=4 3266 B8R1.11 C[C@H]1CCC[C@H]1CCl Amb25313169 [0,0,0,1,0,0|2,0,0]=3 3267 B8R1.11 C[C@H]1CCN[C@@H]1CC Amb25314092 [0,0,0,1,0,0|2,0,0]=3 3268 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb22232058 [0,0,0,1,0,0|2,0,0]=3 3269 B8R1.11 C[C@H]1COC[C@H]1CO Amb24597660 [0,0,0,1,0,0|2,0,0]=3 3270 B8R1.11 C[C@H]1OCC[C@H]1CO Amb25328798 [0,0,0,1,0,0|2,0,0]=3 3271 B8R1.11 C\C=C/1\CCC[C@@H]1O Amb25369446 [0,0,0,1,0,0|1,0,2]=4 3272 B8R1.11 C\C=C/1\CCC[C@H]1O Amb24457783 [0,0,0,1,0,0|1,0,2]=4 3273 B8R1.11 ClCC1CCCN1C Amb15701611 [0,0,0,1,0,0|3,0,0]=4 3274 B8R1.11 F[C@@H]1CCO[C@H]1CBr Amb24610248 [0,0,0,1,0,0|2,0,0]=3 3275 B8R1.11 N#CC1COCC1O Amb23448392 [0,0,0,1,0,0|1,0,1]=3 3276 B8R1.11 N#CC1OCCC1Br Amb24726325 [0,0,0,1,0,0|2,0,1]=4 3277 B8R1.11 N#CC1OCCC1Cl Amb25801062 [0,0,0,1,0,0|2,0,1]=4 3278 B8R1.11 N#C[C@@H]1CCC[C@H]1O Amb19148606 [0,0,0,1,0,0|2,0,1]=4 3279 B8R1.11 N#C[C@@H]1CNC[C@H]1O Amb25256347 [0,0,0,1,0,0|2,0,1]=4 3280 B8R1.11 NC1CCCC1CBr Amb25258706 [0,0,0,1,0,0|3,0,0]=4 3281 B8R1.11 NC1CCCC1CO Amb18641836 [0,0,0,1,0,0|2,0,0]=3 3282 B8R1.11 NC1CCNC1CO Amb25249726 [0,0,0,1,0,0|2,0,0]=3 3283 B8R1.11 NC1CNCC1CF Amb24561673 [0,0,0,1,0,0|3,0,0]=4 3284 B8R1.11 NC1CNCC1CN Amb25210408 [0,0,0,1,0,0|3,0,0]=4 3285 B8R1.11 NC1CNCC1CO Amb24657198 [0,0,0,1,0,0|3,0,0]=4 3286 B8R1.11 NC1COCC1CO Amb24581733 [0,0,0,1,0,0|2,0,0]=3 3287 B8R1.11 NCC1CCCC1Br Amb24397095 [0,0,0,1,0,0|3,0,0]=4 3288 B8R1.11 NCC1CCCC1O Amb22756654 [0,0,0,1,0,0|2,0,0]=3 3289 B8R1.11 NCC1CNCC1O Amb22284842 [0,0,0,1,0,0|2,0,0]=3 3290 B8R1.11 NCC1COCC1F Amb24636960 [0,0,0,1,0,0|2,0,0]=3 3291 B8R1.11 NCC1COCC1O Amb25728184 [0,0,0,1,0,0|1,0,0]=2 3292 B8R1.11 NCC1CSCC1O Amb18203161 [0,0,0,1,0,0|1,1,0]=3 3293 B8R1.11 NC[C@@H]1CCCN1C Amb10603238 [0,0,0,1,0,0|3,0,0]=4 3294 B8R1.11 NC[C@@H]1CCC[C@H]1F Amb22886328 [0,0,0,1,0,0|3,0,0]=4 3295 B8R1.11 NC[C@@H]1CCC[C@H]1F Amb25366547 [0,0,0,1,0,0|3,0,0]=4 3296 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb23439671 [0,0,0,1,0,0|1,0,0]=2 3297 B8R1.11 NC[C@@H]1COC[C@H]1O Amb23439670 [0,0,0,1,0,0|1,0,0]=2 3298 B8R1.11 NC[C@@H]1COC[C@H]1O Amb25277795 [0,0,0,1,0,0|1,0,0]=2 3299 B8R1.11 NC[C@H]1CCC[C@H]1O Amb25218839 [0,0,0,1,0,0|2,0,0]=3 3300 B8R1.11 NC[C@H]1COC[C@H]1O Amb25351472 [0,0,0,1,0,0|1,0,0]=2 3301 B8R1.11 NC[C@H]1OCC[C@H]1S Amb24550200 [0,0,0,1,0,0|2,0,0]=3 3302 B8R1.11 NN1CCCC1CO Amb18641896 [0,0,0,1,0,0|3,0,0]=4 3303 B8R1.11 NN1CCC[C@@H]1CO Amb22757469 [0,0,0,1,0,0|3,0,0]=4 3304 B8R1.11 NNC1CCCC1O Amb13952358 [0,0,0,1,0,0|3,0,0]=4 3305 B8R1.11 NNC1CCCC1O Amb21979355 [0,0,0,1,0,0|3,0,0]=4 3306 B8R1.11 NNC1COCC1O Amb24706024 [0,0,0,1,0,0|2,0,0]=3 3307 B8R1.11 NN[C@@H]1CCC[C@H]1O Amb22397265 [0,0,0,1,0,0|3,0,0]=4 3308 B8R1.11 NN[C@@H]1COC[C@H]1O Amb24567848 [0,0,0,1,0,0|2,0,0]=3 3309 B8R1.11 NOC1CCCC1O Amb25042626 [0,0,0,1,0,0|3,0,0]=4 3310 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb22746052 [0,0,0,1,0,0|2,0,0]=3 3311 B8R1.11 N[C@@H]1CCC[C@H]1CN Amb24630659 [0,0,0,1,0,0|3,0,0]=4 3312 B8R1.11 N[C@@H]1CCC[C@H]1CO Amb22231643 [0,0,0,1,0,0|2,0,0]=3 3313 B8R1.11 N[C@H]1CCC[C@@H]1CO Amb25328410 [0,0,0,1,0,0|2,0,0]=3 3314 B8R1.11 N[C@H]1CCC[C@H]1CN Amb24580548 [0,0,0,1,0,0|3,0,0]=4 3315 B8R1.11 OC1C=COC1CO Amb24390406 [0,0,0,1,0,0|1,0,2]=4 3316 B8R1.11 OC1CC=CC1CO Amb24738079 [0,0,0,1,0,0|2,0,1]=4 3317 B8R1.11 OC1CCCC1CCl Amb24386443 [0,0,0,1,0,0|2,0,0]=3 3318 B8R1.11 OC1CCNC1CO Amb18641923 [0,0,0,1,0,0|2,0,0]=3 3319 B8R1.11 OC1CCNC1CO Amb24117910 [0,0,0,1,0,0|2,0,0]=3 3320 B8R1.11 OC1CCSC1CBr Amb25246671 [0,0,0,1,0,0|2,1,0]=4 3321 B8R1.11 OC1CNCC1CO Amb22587601 [0,0,0,1,0,0|2,0,0]=3 3322 B8R1.11 OC1CNNC1CO Amb24711850 [0,0,0,1,0,0|3,0,0]=4 3323 B8R1.11 OC1CSSC1CO Amb24332948 [0,0,0,1,0,0|2,1,0]=4 3324 B8R1.11 OCC1=CCCC1O Amb25226276 [0,0,0,1,0,0|2,0,1]=4 3325 B8R1.11 OCC1CCCC1=O Amb22491993 [0,0,0,1,0,0|2,0,1]=4 3326 B8R1.11 OCC1CCCN1C Amb13951143 [0,0,0,1,0,0|2,0,0]=3 3327 B8R1.11 OCC1CCCN1O Amb25337229 [0,0,0,1,0,0|3,0,0]=4 3328 B8R1.11 OCC1CNCC1F Amb24708309 [0,0,0,1,0,0|3,0,0]=4 3329 B8R1.11 OCC1NCCC1=O Amb25189929 [0,0,0,1,0,0|2,0,1]=4 3330 B8R1.11 OCC1NCCC1F Amb25693929 [0,0,0,1,0,0|2,0,0]=3 3331 B8R1.11 OCC1OCCC1F Amb25808078 [0,0,0,1,0,0|1,0,0]=2 3332 B8R1.11 OC[C@@H]1CCC[C@@H]1Cl Amb25238303 [0,0,0,1,0,0|2,0,0]=3 3333 B8R1.11 OC[C@@H]1CCC[C@@H]1N Amb1994025 [0,0,0,1,0,0|2,0,0]=3 3334 B8R1.11 OC[C@@H]1CCC[C@H]1F Amb22886850 [0,0,0,1,0,0|2,0,0]=3 3335 B8R1.11 OC[C@@H]1NCCC1=O Amb25202333 [0,0,0,1,0,0|2,0,1]=4 3336 B8R1.11 OC[C@H]1CCCN1C Amb13887229 [0,0,0,1,0,0|2,0,0]=3 3337 B8R1.11 OC[C@H]1CCC[C@@H]1Cl Amb25219136 [0,0,0,1,0,0|2,0,0]=3 3338 B8R1.11 O[C@@H]1C=CC[C@@H]1CO Amb24514501 [0,0,0,1,0,0|2,0,1]=4 3339 B8R1.11 O[C@@H]1C=CO[C@H]1CO Amb25376799 [0,0,0,1,0,0|1,0,2]=4 3340 B8R1.11 O[C@@H]1CC=C[C@@H]1CO Amb25224455 [0,0,0,1,0,0|2,0,1]=4 3341 B8R1.11 O[C@@H]1CCN[C@H]1CO Amb25327371 [0,0,0,1,0,0|2,0,0]=3 3342 B8R1.11 O[C@@H]1CCO[C@H]1CO Amb25246270 [0,0,0,1,0,0|1,0,0]=2 3343 B8R1.11 O[C@@H]1CNC[C@@H]1CO Amb22757874 [0,0,0,1,0,0|2,0,0]=3 3344 B8R1.11 O[C@@H]1CNC[C@H]1CO Amb22757877 [0,0,0,1,0,0|2,0,0]=3 3345 B8R1.11 O[C@@H]1CNC[C@H]1CO Amb24573013 [0,0,0,1,0,0|2,0,0]=3 3346 B8R1.11 O[C@@H]1CSS[C@@H]1CO Amb24520374 [0,0,0,1,0,0|2,1,0]=4 3347 B8R1.11 O[C@H]1C=CC[C@@H]1CO Amb24748605 [0,0,0,1,0,0|2,0,1]=4 3348 B8R1.11 O[C@H]1C=CC[C@H]1CO Amb22233136 [0,0,0,1,0,0|2,0,1]=4 3349 B8R1.11 O[C@H]1CCCC1CO Amb25145329 [0,0,0,1,0,0|2,0,0]=3 3350 B8R1.11 O[C@H]1CCO[C@H]1CO Amb24575535 [0,0,0,1,0,0|1,0,0]=2 3351 B8R1.11 O[C@H]1CCS[C@H]1CBr Amb25173082 [0,0,0,1,0,0|2,1,0]=4 3352 B8R1.11 O[C@H]1CNC[C@H]1CO Amb24697864 [0,0,0,1,0,0|2,0,0]=3 3353 B8R1.11 O[C@H]1CNN[C@@H]1CO Amb24550596 [0,0,0,1,0,0|3,0,0]=4 3354 B8R1.11 [C-]#[N+]C1CCCC1O Amb25246572 [0,0,0,1,0,0|2,0,1]=4 3355 B8R1.12 C=CC1OCC1CO Amb24705655 [0,0,0,1,0,0|2,0,1]=4 3356 B8R1.12 CCC1CCC1C=O Amb24481524 [0,0,0,1,0,0|1,0,2]=4 3357 B8R1.12 CCC1CCC1CN Amb24483083 [0,0,0,1,0,0|2,0,0]=3 3358 B8R1.12 CCC1NCC1OC Amb25240965 [0,0,0,1,0,0|3,0,0]=4 3359 B8R1.12 CC[C@@H]1CN[C@@H]1CO Amb24737007 [0,0,0,1,0,0|1,0,0]=2 3360 B8R1.12 CN[C@@H]1CC[C@@H]1CO Amb24617901 [0,0,0,1,0,0|2,0,0]=3 3361 B8R1.12 COC1CCC1CO Amb24473419 [0,0,0,1,0,0|2,0,0]=3 3362 B8R1.12 ClCC1CCC1CCl Amb24481575 [0,0,0,1,0,0|3,0,0]=4 3363 B8R1.12 ClC[C@@H]1CC[C@@H]1CCl Amb24538670 [0,0,0,1,0,0|3,0,0]=4 3364 B8R1.12 NCC1CCC1CF Amb20668104 [0,0,0,1,0,0|3,0,0]=4 3365 B8R1.12 NCC1CCC1CN Amb25131632 [0,0,0,1,0,0|3,0,0]=4 3366 B8R1.12 OCC1CCC1CO Amb20248362 [0,0,0,1,0,0|2,0,0]=3 3367 B8R1.12 OC[C@@H]1CC[C@H]1CO Amb24725649 [0,0,0,1,0,0|2,0,0]=3 3368 B8R1.12 OC[C@H]1C=C[C@@H]1CO Amb25176846 [0,0,0,1,0,0|2,0,1]=4 3369 B8R1.12 OC[C@H]1CC[C@@H]1CO Amb25253522 [0,0,0,1,0,0|2,0,0]=3 3370 B8R1.13 CC1CCC1CNC Amb23512779 [0,0,0,1,0,0|3,0,0]=4 3371 B8R1.13 CC1CCN1CCN Amb24533925 [0,0,0,1,0,0|2,0,0]=3 3372 B8R1.13 CCCC1CCC1N Amb24737330 [0,0,0,1,0,0|2,0,0]=3 3373 B8R1.13 CCCC1CCC1O Amb24359183 [0,0,0,1,0,0|1,0,0]=2 3374 B8R1.13 CCC[C@@H]1SC[C@H]1O Amb25271389 [0,0,0,1,0,0|0,1,0]=2 3375 B8R1.13 COCC1CCC1N Amb24483084 [0,0,0,1,0,0|3,0,0]=4 3376 B8R1.13 COC[C@@H]1CC[C@H]1N Amb25237707 [0,0,0,1,0,0|3,0,0]=4 3377 B8R1.13 COC[C@H]1CC[C@@H]1N Amb25175635 [0,0,0,1,0,0|3,0,0]=4 3378 B8R1.13 COC[C@H]1CC[C@H]1N Amb25175719 [0,0,0,1,0,0|3,0,0]=4 3379 B8R1.13 CSCC1CCC1N Amb25144894 [0,0,0,1,0,0|3,0,0]=4 3380 B8R1.17 C#CC1OC1CCBr Amb25233038 [0,0,0,1,0,0|2,0,1]=4 3381 B8R1.17 C#CC1OC1CCO Amb25808192 [0,0,0,1,0,0|2,0,1]=4 3382 B8R1.17 C=CC[C@H]1O[C@@H]1CO Amb25222474 [0,0,0,1,0,0|0,0,2]=3 3383 B8R1.17 C=CC[C@H]1O[C@H]1CO Amb24620521 [0,0,0,1,0,0|0,0,2]=3 3384 B8R1.17 C=C[C@@H]1O[C@H]1CCO Amb25175248 [0,0,0,1,0,0|2,0,1]=4 3385 B8R1.17 CC#C[C@@H]1O[C@H]1CO Amb24733196 [0,0,0,1,0,0|0,0,2]=3 3386 B8R1.17 CCC1CC1CCC Amb25784549 [0,0,0,1,0,0|2,0,0]=3 3387 B8R1.17 CCC1CC1CNC Amb18523801 [0,0,0,1,0,0|3,0,0]=4 3388 B8R1.17 CCC1OC1CCO Amb25144428 [0,0,0,1,0,0|2,0,0]=3 3389 B8R1.17 CCCC1CC1CBr Amb25852991 [0,0,0,1,0,0|2,0,0]=3 3390 B8R1.17 CCCC1CC1CCl Amb25136536 [0,0,0,1,0,0|2,0,0]=3 3391 B8R1.17 CCCC1CC1CN Amb18523810 [0,0,0,1,0,0|2,0,0]=3 3392 B8R1.17 CCCC1OC1CCl Amb25779218 [0,0,0,1,0,0|1,0,0]=2 3393 B8R1.17 CCCC1OC1CO Amb25772063 [0,0,0,1,0,0|0,0,0]=1 3394 B8R1.17 CCCC1O[C@H]1CO Amb25107872 [0,0,0,1,0,0|0,0,0]=1 3395 B8R1.17 CCC[C@@H]1C[C@@H]1CO Amb24520124 [0,0,0,1,0,0|1,0,0]=2 3396 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,0,0,1,0,0|1,0,0]=2 3397 B8R1.17 CCC[C@@H]1O[C@@H]1CBr Amb25173138 [0,0,0,1,0,0|1,0,0]=2 3398 B8R1.17 CCC[C@@H]1O[C@H]1CO Amb24655946 [0,0,0,1,0,0|0,0,0]=1 3399 B8R1.17 CCC[C@@H]1S[C@@H]1CO Amb25317475 [0,0,0,1,0,0|0,1,0]=2 3400 B8R1.17 CCC[C@@H]1S[C@H]1CO Amb24611192 [0,0,0,1,0,0|0,1,0]=2 3401 B8R1.17 CCC[C@H]1C[C@@H]1CO Amb24580060 [0,0,0,1,0,0|1,0,0]=2 3402 B8R1.17 CCC[C@H]1O[C@@H]1C=O Amb24566218 [0,0,0,1,0,0|0,0,2]=3 3403 B8R1.17 CCC[C@H]1O[C@@H]1CBr Amb25238290 [0,0,0,1,0,0|1,0,0]=2 3404 B8R1.17 CCC[C@H]1O[C@@H]1CCl Amb25026210 [0,0,0,1,0,0|1,0,0]=2 3405 B8R1.17 CC[C@@H]1C[C@@H]1CCO Amb24745867 [0,0,0,1,0,0|1,0,0]=2 3406 B8R1.17 CC[C@@H]1O[C@H]1CCBr Amb24540791 [0,0,0,1,0,0|2,0,0]=3 3407 B8R1.17 CC[C@H]1O[C@@H]1CCCl Amb24562559 [0,0,0,1,0,0|2,0,0]=3 3408 B8R1.17 CC[C@H]1O[C@H]1CC=O Amb24513084 [0,0,0,1,0,0|2,0,1]=4 3409 B8R1.17 CC[C@H]1O[C@H]1CCN Amb24562829 [0,0,0,1,0,0|2,0,0]=3 3410 B8R1.17 CNCC1CC1CN Amb23538703 [0,0,0,1,0,0|3,0,0]=4 3411 B8R1.17 COCC1CC1CBr Amb24678714 [0,0,0,1,0,0|3,0,0]=4 3412 B8R1.17 COC[C@H]1C[C@@H]1CO Amb25206619 [0,0,0,1,0,0|2,0,0]=3 3413 B8R1.17 C\C=C\C1OC1CO Amb25135839 [0,0,0,1,0,0|0,0,2]=3 3414 B8R1.17 C\C=C\[C@@H]1C[C@H]1CO Amb24546953 [0,0,0,1,0,0|1,0,2]=4 3415 B8R1.17 NOCC1CC1CO Amb25105951 [0,0,0,1,0,0|3,0,0]=4 3416 B8R1.17 O=C[C@@H]1O[C@H]1CCBr Amb25172900 [0,0,0,1,0,0|1,0,2]=4 3417 B8R1.17 OCC1OC1C#CBr Amb24355144 [0,0,0,1,0,0|1,0,2]=4 3418 B8R1.17 OCC1OC1CCBr Amb25095291 [0,0,0,1,0,0|1,0,0]=2 3419 B8R1.17 OC[C@H]1C[C@H]1CCBr Amb25242429 [0,0,0,1,0,0|2,0,0]=3 3420 B8R1.17 OC[C@H]1O[C@H]1C#CBr Amb25332294 [0,0,0,1,0,0|1,0,2]=4 3421 B8R1.22 BrC1CC=CCCC1 Amb25690547 [0,0,0,1,0,0|2,0,1]=4 3422 B8R1.22 BrC1CCCNCC1 Amb24466862 [0,0,0,1,0,0|3,0,0]=4 3423 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,0,0]=3 3424 B8R1.22 BrC1COCCOC1 Amb24421656 [0,0,0,1,0,0|2,0,0]=3 3425 B8R1.22 C=C1CCCCCC1 Amb25325282 [0,0,0,1,0,0|2,0,1]=4 3426 B8R1.22 C=C1CNCCCC1 Amb24624045 [0,0,0,1,0,0|2,0,1]=4 3427 B8R1.22 CC1CCCCCC1 Amb22230865 [0,0,0,1,0,0|2,0,0]=3 3428 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|2,0,0]=3 3429 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|2,0,0]=3 3430 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|1,0,0]=2 3431 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,0]=3 3432 B8R1.22 CC1CCNCCN1 Amb24053173 [0,0,0,1,0,0|2,0,0]=3 3433 B8R1.22 CC1CCNCCS1 Amb22642273 [0,0,0,1,0,0|1,1,0]=3 3434 B8R1.22 CC1CCOCCN1 Amb25108477 [0,0,0,1,0,0|1,0,0]=2 3435 B8R1.22 CC1CCSCCN1 Amb24681013 [0,0,0,1,0,0|1,1,0]=3 3436 B8R1.22 CC1CNCCCC1 Amb22886304 [0,0,0,1,0,0|2,0,0]=3 3437 B8R1.22 CC1CNCCCN1 Amb17578102 [0,0,0,1,0,0|3,0,0]=4 3438 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|2,0,0]=3 3439 B8R1.22 CC1CNCCNC1 Amb10608863 [0,0,0,1,0,0|3,0,0]=4 3440 B8R1.22 CC1CNCCOC1 Amb18112853 [0,0,0,1,0,0|2,0,0]=3 3441 B8R1.22 CC1CNCCOC1 Amb22886318 [0,0,0,1,0,0|2,0,0]=3 3442 B8R1.22 CC1CNCCSC1 Amb22642304 [0,0,0,1,0,0|2,1,0]=4 3443 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,0,0]=3 3444 B8R1.22 CC1OCC=CCO1 Amb25097141 [0,0,0,1,0,0|2,0,1]=4 3445 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,1,0,0|2,0,0]=3 3446 B8R1.22 CC=1CCCCCC1 Amb22227978 [0,0,0,1,0,0|2,0,1]=4 3447 B8R1.22 CC=1CCNCCN1 Amb25784814 [0,0,0,1,0,0|2,0,1]=4 3448 B8R1.22 CN1CCCCCC1 Amb22729377 [0,0,0,1,0,0|3,0,0]=4 3449 B8R1.22 CN1CCCNCC1 Amb22167533 [0,0,0,1,0,0|3,0,0]=4 3450 B8R1.22 ClC1CC=CCCC1 Amb25362266 [0,0,0,1,0,0|2,0,1]=4 3451 B8R1.22 ClC1CCCCCS1 Amb24652277 [0,0,0,1,0,0|2,1,0]=4 3452 B8R1.22 ClC1COCCOC1 Amb25712357 [0,0,0,1,0,0|2,0,0]=3 3453 B8R1.22 ClN1CCCCCC1 Amb22497474 [0,0,0,1,0,0|3,0,0]=4 3454 B8R1.22 FC1CCCCNC1 Amb13953139 [0,0,0,1,0,0|2,0,0]=3 3455 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|3,0,0]=4 3456 B8R1.22 FC1CNCCCC1 Amb22886275 [0,0,0,1,0,0|2,0,0]=3 3457 B8R1.22 FC1CNCCNC1 Amb22496406 [0,0,0,1,0,0|3,0,0]=4 3458 B8R1.22 FC1CNCCOC1 Amb24481255 [0,0,0,1,0,0|2,0,0]=3 3459 B8R1.22 FC1CNCCSC1 Amb25216344 [0,0,0,1,0,0|2,1,0]=4 3460 B8R1.22 N=C1COCCCN1 Amb25223773 [0,0,0,1,0,0|2,0,1]=4 3461 B8R1.22 NC1CCCCC=C1 Amb24377373 [0,0,0,1,0,0|2,0,1]=4 3462 B8R1.22 NC1CCCOCC1 Amb18832507 [0,0,0,1,0,0|2,0,0]=3 3463 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,1,0]=4 3464 B8R1.22 NC1CNCCCC1 Amb22388535 [0,0,0,1,0,0|2,0,0]=3 3465 B8R1.22 NC1COCCOC1 Amb20669196 [0,0,0,1,0,0|2,0,0]=3 3466 B8R1.22 NC1COCCOC1 Amb24452281 [0,0,0,1,0,0|2,0,0]=3 3467 B8R1.22 NN1CCCOCC1 Amb25681314 [0,0,0,1,0,0|3,0,0]=4 3468 B8R1.22 N[C@@H]1CCCCC=C1 Amb25173829 [0,0,0,1,0,0|2,0,1]=4 3469 B8R1.22 N[C@@H]1CCCCNC1 Amb16185497 [0,0,0,1,0,0|2,0,0]=3 3470 B8R1.22 N[C@@H]1CCCOCC1 Amb24476582 [0,0,0,1,0,0|2,0,0]=3 3471 B8R1.22 N[C@@H]1CNCCCC1 Amb22744950 [0,0,0,1,0,0|2,0,0]=3 3472 B8R1.22 N[C@H]1CCCCC=C1 Amb24375976 [0,0,0,1,0,0|2,0,1]=4 3473 B8R1.22 O=C1CCCCSC1 Amb10071767 [0,0,0,1,0,0|0,1,2]=4 3474 B8R1.22 O=C1CCOCCO1 Amb24060726 [0,0,0,1,0,0|1,0,1]=3 3475 B8R1.22 O=C1CNCCCC1 Amb22000936 [0,0,0,1,0,0|1,0,2]=4 3476 B8R1.22 O=C1COCCCC1 Amb25143067 [0,0,0,1,0,0|0,0,2]=3 3477 B8R1.22 O=C1COCCCN1 Amb22371065 [0,0,0,1,0,0|1,0,2]=4 3478 B8R1.22 O=C1COCCCO1 Amb24558825 [0,0,0,1,0,0|1,0,2]=4 3479 B8R1.22 O=C1COCCOC1 Amb22284314 [0,0,0,1,0,0|1,0,2]=4 3480 B8R1.22 O=C1NCCOCC1 Amb13951193 [0,0,0,1,0,0|2,0,1]=4 3481 B8R1.22 OC1CC=CCCC1 Amb24387236 [0,0,0,1,0,0|1,0,1]=3 3482 B8R1.22 OC1CCC=CCC1 Amb22504559 [0,0,0,1,0,0|1,0,2]=4 3483 B8R1.22 OC1CCCCCS1 Amb17615898 [0,0,0,1,0,0|2,0,0]=3 3484 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|2,0,0]=3 3485 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|2,0,0]=3 3486 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|2,0,0]=3 3487 B8R1.22 OC1CCOCCO1 Amb25687903 [0,0,0,1,0,0|1,0,0]=2 3488 B8R1.22 OC1CNCCCC1 Amb22371121 [0,0,0,1,0,0|1,0,0]=2 3489 B8R1.22 OC1CNCCCC1 Amb22886250 [0,0,0,1,0,0|1,0,0]=2 3490 B8R1.22 OC1CNCCNC1 Amb10067082 [0,0,0,1,0,0|2,0,0]=3 3491 B8R1.22 OC1CNCCOC1 Amb22886365 [0,0,0,1,0,0|1,0,0]=2 3492 B8R1.22 OC1CNOCCC1 Amb24748295 [0,0,0,1,0,0|2,0,0]=3 3493 B8R1.22 OC1COC=CCC1 Amb25381427 [0,0,0,1,0,0|0,0,2]=3 3494 B8R1.22 OC1COCOCC1 Amb24429998 [0,0,0,1,0,0|1,0,0]=2 3495 B8R1.22 O[C@@H]1CC=CCCC1 Amb24529095 [0,0,0,1,0,0|1,0,1]=3 3496 B8R1.22 O[C@@H]1CCCCC=C1 Amb24720019 [0,0,0,1,0,0|1,0,1]=3 3497 B8R1.22 O[C@@H]1CNCCOC1 Amb22325588 [0,0,0,1,0,0|1,0,0]=2 3498 B8R1.22 O[C@@H]1COCOCC1 Amb25828912 [0,0,0,1,0,0|1,0,0]=2 3499 B8R1.22 O[C@H]1CC=CCCC1 Amb24531344 [0,0,0,1,0,0|1,0,1]=3 3500 B8R1.22 O[C@H]1CNCCCC1 Amb24630787 [0,0,0,1,0,0|1,0,0]=2 3501 B8R1.22 S=C1CCOCCN1 Amb25836331 [0,0,0,1,0,0|2,0,1]=4 3502 B8R1.22 S=C1COCCCN1 Amb25808992 [0,0,0,1,0,0|1,1,1]=4 3503 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|2,0,0]=3 3504 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,0,0,1,0,0|2,0,0]=3 3505 B8R1.36 BrCCNCC1CC1 Amb24387774 [0,0,0,1,0,0|2,0,0]=3 3506 B8R1.36 BrCC\C=C\C1CC1 Amb25232593 [0,0,0,1,0,0|2,0,1]=4 3507 B8R1.36 C#CCOCC1CC1 Amb23598933 [0,0,0,1,0,0|1,0,1]=3 3508 B8R1.36 C#CCONC1CC1 Amb25121384 [0,0,0,1,0,0|2,0,1]=4 3509 B8R1.36 C=CCOCC1CC1 Amb25303107 [0,0,0,1,0,0|1,0,1]=3 3510 B8R1.36 C=CCSCC1CC1 Amb24476593 [0,0,0,1,0,0|1,1,1]=4 3511 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|1,0,0]=2 3512 B8R1.36 CCCCC[C@H]1CO1 Amb10982594 [0,0,0,1,0,0|1,0,0]=2 3513 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,0]=3 3514 B8R1.36 CCCONC1CC1 Amb25031182 [0,0,0,1,0,0|2,0,0]=3 3515 B8R1.36 CCCSCC1CC1 Amb25285284 [0,0,0,1,0,0|1,1,0]=3 3516 B8R1.36 CCCSC[C@@H]1CO1 Amb24733152 [0,0,0,1,0,0|2,0,0]=3 3517 B8R1.36 CCCSC[C@H]1CO1 Amb24385827 [0,0,0,1,0,0|2,0,0]=3 3518 B8R1.36 CCC\C=C\C1CO1 Amb24612052 [0,0,0,1,0,0|1,0,1]=3 3519 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|3,0,0]=4 3520 B8R1.36 CCOCCC1CO1 Amb25679046 [0,0,0,1,0,0|2,0,0]=3 3521 B8R1.36 CCONCC1CC1 Amb24481284 [0,0,0,1,0,0|3,0,0]=4 3522 B8R1.36 CNCCOC1CC1 Amb25831972 [0,0,0,1,0,0|2,0,0]=3 3523 B8R1.36 COCCCC1CO1 Amb24676522 [0,0,0,1,0,0|2,0,0]=3 3524 B8R1.36 COCCNC1CC1 Amb24271078 [0,0,0,1,0,0|3,0,0]=4 3525 B8R1.36 COCSCC1CC1 Amb24401742 [0,0,0,1,0,0|2,1,0]=4 3526 B8R1.36 CSCCCC1CO1 Amb24687956 [0,0,0,1,0,0|2,0,0]=3 3527 B8R1.36 CSCCNC1CC1 Amb19033479 [0,0,0,1,0,0|3,0,0]=4 3528 B8R1.36 C\C=C\CC[C@@H]1CO1 Amb25083480 [0,0,0,1,0,0|1,0,2]=4 3529 B8R1.36 ClCCC#CC1CC1 Amb25701920 [0,0,0,1,0,0|2,0,1]=4 3530 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,0,0,1,0,0|2,0,0]=3 3531 B8R1.36 ClCCNCC1CC1 Amb25724706 [0,0,0,1,0,0|2,0,0]=3 3532 B8R1.36 ClCCOCC1CO1 Amb25834619 [0,0,0,1,0,0|2,0,0]=3 3533 B8R1.36 ClCCSCC1CC1 Amb24446385 [0,0,0,1,0,0|1,1,0]=3 3534 B8R1.36 ClCC\C=C\C1CC1 Amb24744500 [0,0,0,1,0,0|2,0,1]=4 3535 B8R1.36 ClCOCCC1CC1 Amb25257038 [0,0,0,1,0,0|3,0,0]=4 3536 B8R1.36 N#CCSCC1CC1 Amb24397623 [0,0,0,1,0,0|1,1,1]=4 3537 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|2,0,0]=3 3538 B8R1.36 NCCCCC1CO1 Amb25843740 [0,0,0,1,0,0|2,0,0]=3 3539 B8R1.36 NCCCNC1CC1 Amb17315307 [0,0,0,1,0,0|3,0,0]=4 3540 B8R1.36 NCCCSC1CC1 Amb25101657 [0,0,0,1,0,0|2,1,0]=4 3541 B8R1.36 NCCNCC1CC1 Amb18523825 [0,0,0,1,0,0|2,0,0]=3 3542 B8R1.36 NCCOCC1CC1 Amb19514946 [0,0,0,1,0,0|1,0,0]=2 3543 B8R1.36 NCCSCC1CO1 Amb21978809 [0,0,0,1,0,0|2,1,0]=4 3544 B8R1.36 NCC\C=C\C1CC1 Amb25043869 [0,0,0,1,0,0|2,0,1]=4 3545 B8R1.36 NOCOCC1CC1 Amb25266097 [0,0,0,1,0,0|2,0,0]=3 3546 B8R1.36 OCCC#CC1CC1 Amb24646225 [0,0,0,1,0,0|1,0,1]=3 3547 B8R1.36 OCCCCC1CN1 Amb24056761 [0,0,0,1,0,0|2,0,0]=3 3548 B8R1.36 OCCCCC=1CC1 Amb25344996 [0,0,0,1,0,0|1,0,2]=4 3549 B8R1.36 OCCCC[C@@H]1CO1 Amb25832754 [0,0,0,1,0,0|2,0,0]=3 3550 B8R1.36 OCCCNC1CC1 Amb17317872 [0,0,0,1,0,0|2,0,0]=3 3551 B8R1.36 OCCNCC1CO1 Amb24358047 [0,0,0,1,0,0|2,0,0]=3 3552 B8R1.36 OCCOCC1CC1 Amb24729221 [0,0,0,1,0,0|0,0,0]=1 3553 B8R1.36 OCC\C=C\C1CC1 Amb25320402 [0,0,0,1,0,0|1,0,1]=3 3554 B8R1.49 C1C=CCCCCO1 Amb22365096 [0,0,0,1,0,0|1,0,1]=3 3555 B8R1.49 C1CNCCCCN1 Amb24428659 [0,0,0,1,0,0|2,0,0]=3 3556 B8R1.49 C1COCCCCN1 Amb23441949 [0,0,0,1,0,0|1,0,0]=2 3557 B8R1.49 C1CSCCCCN1 Amb23596972 [0,0,0,1,0,0|1,1,0]=3 3558 B8R1.49 C1OCCNCCO1 Amb20669185 [0,0,0,1,0,0|2,0,0]=3 3559 B8R1.49 C1OCCOCCO1 Amb22227715 [0,0,0,1,0,0|1,0,0]=2 3560 B5R0.2 BCCCCN Amb24745748 [2,0,0,0,0,0|2,0,0]=4 3561 B5R0.2 BSCCCC Amb25339480 [2,0,0,0,0,0|1,1,0]=4 3562 B5R0.2 BrCCOCC Amb1158671 [2,0,0,0,0,0|1,0,0]=3 3563 B5R0.2 BrCOCCBr Amb25846664 [2,0,0,0,0,0|2,0,0]=4 3564 B5R0.2 C=CCOCO Amb25115933 [2,0,0,0,0,0|0,0,2]=4 3565 B5R0.2 C=NOCCO Amb25246977 [2,0,0,0,0,0|1,0,1]=4 3566 B5R0.2 CC/N=N/CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 3567 B5R0.2 CCCCC=C Amb22338530 [2,0,0,0,0,0|0,0,2]=4 3568 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,0]=2 3569 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 3570 B5R0.2 CCCCC[13CH3] Amb22353529 [2,0,0,0,0,0|0,0,0]=2 3571 B5R0.2 CCCCC[Mg+] Amb22045757 [2,0,0,0,0,0|1,0,0]=3 3572 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|0,1,0]=3 3573 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 3574 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 3575 B5R0.2 CCCCNN Amb22732372 [2,0,0,0,0,0|2,0,0]=4 3576 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,0]=3 3577 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|1,0,0]=3 3578 B5R0.2 CCCCO[2H] Amb16185547 [2,0,0,0,0,0|1,0,0]=3 3579 B5R0.2 CCCCS[Na] Amb22360783 [2,0,0,0,0,0|1,1,0]=4 3580 B5R0.2 CCCC[Hg]Cl Amb22366548 [2,0,0,0,0,0|2,0,0]=4 3581 B5R0.2 CCCC[Mg]Br Amb17666637 [2,0,0,0,0,0|2,0,0]=4 3582 B5R0.2 CCCC[Zn]Br Amb22000415 [2,0,0,0,0,0|2,0,0]=4 3583 B5R0.2 CCCNCO Amb25746089 [2,0,0,0,0,0|1,0,0]=3 3584 B5R0.2 CCCOC=C Amb17940706 [2,0,0,0,0,0|0,0,2]=4 3585 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|1,0,0]=3 3586 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|0,0,0]=2 3587 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|1,0,0]=3 3588 B5R0.2 CCCON=O Amb22732190 [2,0,0,0,0,0|1,0,1]=4 3589 B5R0.2 CCCONC Amb25109607 [2,0,0,0,0,0|1,0,0]=3 3590 B5R0.2 CCCSCO Amb24466323 [2,0,0,0,0,0|0,1,0]=3 3591 B5R0.2 CCN=NCC Amb25224763 [2,0,0,0,0,0|2,0,0]=4 3592 B5R0.2 CCN=NCO Amb25146368 [2,0,0,0,0,0|2,0,0]=4 3593 B5R0.2 CCNCCN Amb22284539 [2,0,0,0,0,0|2,0,0]=4 3594 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,0]=3 3595 B5R0.2 CCNCCO Amb22284537 [2,0,0,0,0,0|1,0,0]=3 3596 B5R0.2 CCNCCS Amb18640505 [2,0,0,0,0,0|1,1,0]=4 3597 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 3598 B5R0.2 CCNNCC Amb22347978 [2,0,0,0,0,0|2,0,0]=4 3599 B5R0.2 CCOC#CC Amb17673840 [2,0,0,0,0,0|0,0,2]=4 3600 B5R0.2 CCOCC#C Amb17673317 [2,0,0,0,0,0|0,0,2]=4 3601 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|1,0,0]=3 3602 B5R0.2 CCOCCN Amb21954038 [2,0,0,0,0,0|1,0,0]=3 3603 B5R0.2 CCO[SiH2]CN Amb25142743 [2,0,0,0,0,0|1,1,0]=4 3604 B5R0.2 CCPCCN Amb24560329 [2,0,0,0,0,0|2,0,0]=4 3605 B5R0.2 CCSCCC Amb22168047 [2,0,0,0,0,0|0,1,0]=3 3606 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|1,1,0]=4 3607 B5R0.2 CC\C=C/CO Amb10975881 [2,0,0,0,0,0|0,0,2]=4 3608 B5R0.2 CC\C=C\CC Amb22734067 [2,0,0,0,0,0|0,0,2]=4 3609 B5R0.2 CC\C=C\CO Amb22347892 [2,0,0,0,0,0|0,0,2]=4 3610 B5R0.2 CC\C=C\OC Amb25310346 [2,0,0,0,0,0|0,0,2]=4 3611 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 3612 B5R0.2 CNCCCS Amb18121219 [2,0,0,0,0,0|1,1,0]=4 3613 B5R0.2 CNCCOC Amb10609606 [2,0,0,0,0,0|1,0,0]=3 3614 B5R0.2 CNCCON Amb24460312 [2,0,0,0,0,0|2,0,0]=4 3615 B5R0.2 CNCCSC Amb15701319 [2,0,0,0,0,0|1,1,0]=4 3616 B5R0.2 CNCCSC Amb20625111 [2,0,0,0,0,0|1,1,0]=4 3617 B5R0.2 CNNCCC Amb24057117 [2,0,0,0,0,0|2,0,0]=4 3618 B5R0.2 CNNCCC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 3619 B5R0.2 CNOCCN Amb22411501 [2,0,0,0,0,0|2,0,0]=4 3620 B5R0.2 CNOCCN Amb22490915 [2,0,0,0,0,0|2,0,0]=4 3621 B5R0.2 COCCC#C Amb18117254 [2,0,0,0,0,0|0,0,2]=4 3622 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,1]=4 3623 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|1,0,0]=3 3624 B5R0.2 COCCCI Amb22755452 [2,0,0,0,0,0|1,0,0]=3 3625 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|1,0,0]=3 3626 B5R0.2 COCCNN Amb10609107 [2,0,0,0,0,0|2,0,0]=4 3627 B5R0.2 COCCNN Amb19374182 [2,0,0,0,0,0|2,0,0]=4 3628 B5R0.2 COCCNN Amb22233534 [2,0,0,0,0,0|2,0,0]=4 3629 B5R0.2 COCCNN Amb22587527 [2,0,0,0,0,0|2,0,0]=4 3630 B5R0.2 COCCNO Amb25284480 [2,0,0,0,0,0|2,0,0]=4 3631 B5R0.2 COCCOC Amb22338452 [2,0,0,0,0,0|1,0,0]=3 3632 B5R0.2 COCCOC Amb22729734 [2,0,0,0,0,0|1,0,0]=3 3633 B5R0.2 COCCOC Amb22733818 [2,0,0,0,0,0|1,0,0]=3 3634 B5R0.2 COCCON Amb17194148 [2,0,0,0,0,0|2,0,0]=4 3635 B5R0.2 COCCON Amb20623946 [2,0,0,0,0,0|2,0,0]=4 3636 B5R0.2 COCOCCl Amb25335675 [2,0,0,0,0,0|2,0,0]=4 3637 B5R0.2 CONCCN Amb25733738 [2,0,0,0,0,0|2,0,0]=4 3638 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|1,1,0]=4 3639 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|1,1,0]=4 3640 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|1,1,0]=4 3641 B5R0.2 CSCCON Amb25806571 [2,0,0,0,0,0|2,0,0]=4 3642 B5R0.2 CSCCSC Amb25101746 [2,0,0,0,0,0|1,1,0]=4 3643 B5R0.2 CSCSCC Amb24619526 [2,0,0,0,0,0|1,1,0]=4 3644 B5R0.2 C[SiH2]CCCCl Amb24594928 [2,0,0,0,0,0|1,1,0]=4 3645 B5R0.2 C[SiH2]CCCI Amb24673429 [2,0,0,0,0,0|1,1,0]=4 3646 B5R0.2 C[SiH2]CC[SiH2]C Amb22227708 [2,0,0,0,0,0|0,2,0]=4 3647 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|0,0,2]=4 3648 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|0,0,2]=4 3649 B5R0.2 ClCCCOCl Amb24333124 [2,0,0,0,0,0|2,0,0]=4 3650 B5R0.2 ClCCNCC Amb17334050 [2,0,0,0,0,0|2,0,0]=4 3651 B5R0.2 ClCCOCBr Amb25240611 [2,0,0,0,0,0|2,0,0]=4 3652 B5R0.2 ClCOCCCl Amb22000864 [2,0,0,0,0,0|2,0,0]=4 3653 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 3654 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|1,1,0]=4 3655 B5R0.2 FCCOCCl Amb24709276 [2,0,0,0,0,0|2,0,0]=4 3656 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 3657 B5R0.2 NCCCCBr Amb18644498 [2,0,0,0,0,0|2,0,0]=4 3658 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 3659 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 3660 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 3661 B5R0.2 NCCCCN Amb22352431 [2,0,0,0,0,0|2,0,0]=4 3662 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 3663 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|1,1,0]=4 3664 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|1,1,0]=4 3665 B5R0.2 NCCOCC Amb1130918 [2,0,0,0,0,0|1,0,0]=3 3666 B5R0.2 NCOCCO Amb25851211 [2,0,0,0,0,0|1,0,0]=3 3667 B5R0.2 NNCCCO Amb19514839 [2,0,0,0,0,0|2,0,0]=4 3668 B5R0.2 NNCCCO Amb22058994 [2,0,0,0,0,0|2,0,0]=4 3669 B5R0.2 NOCCCF Amb22896552 [2,0,0,0,0,0|2,0,0]=4 3670 B5R0.2 NOCCCF Amb24632017 [2,0,0,0,0,0|2,0,0]=4 3671 B5R0.2 NOCCCO Amb18061671 [2,0,0,0,0,0|2,0,0]=4 3672 B5R0.2 NOCCCS Amb17608230 [2,0,0,0,0,0|2,0,0]=4 3673 B5R0.2 N[13CH2]CC[13CH2]N Amb22367523 [2,0,0,0,0,0|2,0,0]=4 3674 B5R0.2 N[13CH2][13CH2][13CH2][13CH2]N Amb22336801 [2,0,0,0,0,0|2,0,0]=4 3675 B5R0.2 O=CCOCC Amb24052108 [2,0,0,0,0,0|0,0,2]=4 3676 B5R0.2 OCCCC#C Amb1219893 [2,0,0,0,0,0|0,0,2]=4 3677 B5R0.2 OCCCC=O Amb24589235 [2,0,0,0,0,0|1,0,1]=4 3678 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,0]=3 3679 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,0]=3 3680 B5R0.2 OCCCCI Amb25689806 [2,0,0,0,0,0|1,0,0]=3 3681 B5R0.2 OCCCCS Amb22229807 [2,0,0,0,0,0|1,0,0]=3 3682 B5R0.2 OCCCNCl Amb25146306 [2,0,0,0,0,0|2,0,0]=4 3683 B5R0.2 OCCCNO Amb24719785 [2,0,0,0,0,0|2,0,0]=4 3684 B5R0.2 OCCOC=C Amb17674184 [2,0,0,0,0,0|0,0,2]=4 3685 B5R0.2 OCCOCCl Amb24673634 [2,0,0,0,0,0|1,0,0]=3 3686 B5R0.2 OCCON=O Amb22363071 [2,0,0,0,0,0|2,0,0]=4 3687 B5R0.2 OCCSCC Amb1085958 [2,0,0,0,0,0|0,1,0]=3 3688 B5R0.2 OCNCCO Amb22228429 [2,0,0,0,0,0|2,0,0]=4 3689 B5R0.2 OCOCCCl Amb25335353 [2,0,0,0,0,0|1,0,0]=3 3690 B5R0.2 OCOCCO Amb22228906 [2,0,0,0,0,0|1,0,0]=3 3691 B5R0.2 SCCCCCl Amb24665692 [2,0,0,0,0,0|1,1,0]=4 3692 B5R0.2 [15NH2]CCCC[15NH2] Amb22353369 [2,0,0,0,0,0|2,0,0]=4 3693 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|1,0,1]=4 3694 B5R0.2 [C-]#[N+]CCOC Amb1981032 [2,0,0,0,0,0|1,0,1]=4 3695 B7R0.3 C#CCCC(N)CO Amb24730391 [1,1,0,0,0,0|0,0,2]=4 3696 B7R0.3 C#CCCC(O)CO Amb18115814 [1,1,0,0,0,0|0,0,2]=4 3697 B7R0.3 C#CCC[C@@H](N)CO Amb24117821 [1,1,0,0,0,0|0,0,2]=4 3698 B7R0.3 C=C(CO)CCCN Amb25747319 [1,1,0,0,0,0|1,0,1]=4 3699 B7R0.3 C=CC(Br)CCCO Amb25200996 [1,1,0,0,0,0|0,0,2]=4 3700 B7R0.3 C=CC(Cl)CCCO Amb24443069 [1,1,0,0,0,0|0,0,2]=4 3701 B7R0.3 C=CC(O)CCCO Amb24747215 [1,1,0,0,0,0|0,0,2]=4 3702 B7R0.3 C=CCCC(Cl)CO Amb24425971 [1,1,0,0,0,0|0,0,2]=4 3703 B7R0.3 C=CCCC(F)CO Amb25127775 [1,1,0,0,0,0|0,0,2]=4 3704 B7R0.3 C=CCCC(N)CO Amb25083009 [1,1,0,0,0,0|0,0,2]=4 3705 B7R0.3 C=CCC[C@H](O)CO Amb25847350 [1,1,0,0,0,0|0,0,2]=4 3706 B7R0.3 C=C[C@@H](O)CCCO Amb25314923 [1,1,0,0,0,0|0,0,2]=4 3707 B7R0.3 CC#CCC(C)CO Amb25781231 [1,1,0,0,0,0|0,0,2]=4 3708 B7R0.3 CC#CCC(N)CC Amb18988280 [1,1,0,0,0,0|1,0,1]=4 3709 B7R0.3 CC#CCC(O)CO Amb25852856 [1,1,0,0,0,0|0,0,2]=4 3710 B7R0.3 CC#CC[C@@H](C)CO Amb25719795 [1,1,0,0,0,0|0,0,2]=4 3711 B7R0.3 CC#CC[C@H](C)CO Amb25740641 [1,1,0,0,0,0|0,0,2]=4 3712 B7R0.3 CC(C=O)CCCC Amb17593191 [1,1,0,0,0,0|0,0,2]=4 3713 B7R0.3 CC(C=O)OCCO Amb25046189 [1,1,0,0,0,0|1,0,1]=4 3714 B7R0.3 CC(CBr)CCCN Amb25851758 [1,1,0,0,0,0|2,0,0]=4 3715 B7R0.3 CC(CBr)OCCCl Amb24376254 [1,1,0,0,0,0|2,0,0]=4 3716 B7R0.3 CC(CC)=NOCC Amb24749369 [1,1,0,0,0,0|1,0,1]=4 3717 B7R0.3 CC(CC)\C=C/CC Amb22733598 [1,1,0,0,0,0|1,0,1]=4 3718 B7R0.3 CC(CCCN)NO Amb25339843 [1,1,0,0,0,0|2,0,0]=4 3719 B7R0.3 CC(CCCO)C=C Amb22641468 [1,1,0,0,0,0|0,0,2]=4 3720 B7R0.3 CC(CCCO)C=O Amb24690170 [1,1,0,0,0,0|1,0,1]=4 3721 B7R0.3 CC(CCCO)CO Amb25098490 [1,1,0,0,0,0|1,0,0]=3 3722 B7R0.3 CC(CCCO)NN Amb24462745 [1,1,0,0,0,0|2,0,0]=4 3723 B7R0.3 CC(CI)OCCI Amb25693988 [1,1,0,0,0,0|2,0,0]=4 3724 B7R0.3 CC(CN)CCCCl Amb25338606 [1,1,0,0,0,0|2,0,0]=4 3725 B7R0.3 CC(CN)CCNC Amb17334066 [1,1,0,0,0,0|2,0,0]=4 3726 B7R0.3 CC(CN)CCOC Amb17569915 [1,1,0,0,0,0|2,0,0]=4 3727 B7R0.3 CC(CN)NCCO Amb24738477 [1,1,0,0,0,0|2,0,0]=4 3728 B7R0.3 CC(CN)OCCF Amb24404606 [1,1,0,0,0,0|2,0,0]=4 3729 B7R0.3 CC(CN)SCCO Amb25104065 [1,1,0,0,0,0|1,1,0]=4 3730 B7R0.3 CC(CNCC)CC Amb20623802 [1,1,0,0,0,0|1,0,0]=3 3731 B7R0.3 CC(CO)CCC#C Amb24481197 [1,1,0,0,0,0|0,0,2]=4 3732 B7R0.3 CC(CO)CCC=O Amb25693017 [1,1,0,0,0,0|1,0,1]=4 3733 B7R0.3 CC(CO)CCCBr Amb25173843 [1,1,0,0,0,0|1,0,0]=3 3734 B7R0.3 CC(CO)CCNC Amb17569900 [1,1,0,0,0,0|1,0,0]=3 3735 B7R0.3 CC(CO)NCCCl Amb24482645 [1,1,0,0,0,0|2,0,0]=4 3736 B7R0.3 CC(CO)NCCF Amb24483267 [1,1,0,0,0,0|2,0,0]=4 3737 B7R0.3 CC(CO)OCC#C Amb22168840 [1,1,0,0,0,0|0,0,2]=4 3738 B7R0.3 CC(CO)SCCF Amb24505185 [1,1,0,0,0,0|1,1,0]=4 3739 B7R0.3 CC(CO)SCCN Amb25062633 [1,1,0,0,0,0|1,1,0]=4 3740 B7R0.3 CC(C\C=C\C)CC Amb22730660 [1,1,0,0,0,0|1,0,1]=4 3741 B7R0.3 CC(NC)CCCO Amb17569902 [1,1,0,0,0,0|1,0,0]=3 3742 B7R0.3 CC(OC)CCCN Amb17569913 [1,1,0,0,0,0|2,0,0]=4 3743 B7R0.3 CCC#CC(C)CO Amb24332914 [1,1,0,0,0,0|0,0,2]=4 3744 B7R0.3 CCC(=N)NCCO Amb25808996 [1,1,0,0,0,0|1,0,1]=4 3745 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|1,0,1]=4 3746 B7R0.3 CCC(=O)CCCF Amb25101437 [1,1,0,0,0,0|1,0,1]=4 3747 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|1,0,1]=4 3748 B7R0.3 CCC(=O)CCCO Amb24629709 [1,1,0,0,0,0|0,0,1]=3 3749 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|2,0,0]=4 3750 B7R0.3 CCC(=O)CNCC Amb25032080 [1,1,0,0,0,0|1,0,1]=4 3751 B7R0.3 CCC(=O)CSCC Amb24715230 [1,1,0,0,0,0|0,1,1]=4 3752 B7R0.3 CCC(=O)NOCC Amb24481448 [1,1,0,0,0,0|1,0,1]=4 3753 B7R0.3 CCC(=S)NCCC Amb25848578 [1,1,0,0,0,0|2,0,0]=4 3754 B7R0.3 CCC(Br)CCCCl Amb24540196 [1,1,0,0,0,0|1,0,0]=3 3755 B7R0.3 CCC(Br)CCCN Amb25024401 [1,1,0,0,0,0|1,0,0]=3 3756 B7R0.3 CCC(Br)CCCO Amb24627076 [1,1,0,0,0,0|0,0,0]=2 3757 B7R0.3 CCC(Br)CCNC Amb24703764 [1,1,0,0,0,0|2,0,0]=4 3758 B7R0.3 CCC(C)=NCCO Amb25332989 [1,1,0,0,0,0|1,0,1]=4 3759 B7R0.3 CCC(C)C#CCO Amb25052244 [1,1,0,0,0,0|0,0,2]=4 3760 B7R0.3 CCC(C)CCC=O Amb25125664 [1,1,0,0,0,0|0,0,2]=4 3761 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,0]=3 3762 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,0]=3 3763 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|2,0,0]=4 3764 B7R0.3 CCC(C)CNOC Amb25039681 [1,1,0,0,0,0|2,0,0]=4 3765 B7R0.3 CCC(C)COCBr Amb25697189 [1,1,0,0,0,0|1,0,0]=3 3766 B7R0.3 CCC(C)NCCF Amb24557964 [1,1,0,0,0,0|2,0,0]=4 3767 B7R0.3 CCC(C)OCC#N Amb25189020 [1,1,0,0,0,0|1,0,1]=4 3768 B7R0.3 CCC(C)OCC=O Amb25169598 [1,1,0,0,0,0|0,0,2]=4 3769 B7R0.3 CCC(C)OCCBr Amb18181117 [1,1,0,0,0,0|1,0,0]=3 3770 B7R0.3 CCC(C)OCCN Amb18307952 [1,1,0,0,0,0|1,0,0]=3 3771 B7R0.3 CCC(C)OCCO Amb19516036 [1,1,0,0,0,0|0,0,0]=2 3772 B7R0.3 CCC(C)PCCN Amb25224337 [1,1,0,0,0,0|2,0,0]=4 3773 B7R0.3 CCC(Cl)CCCCl Amb19959959 [1,1,0,0,0,0|1,0,0]=3 3774 B7R0.3 CCC(Cl)CCCO Amb24526635 [1,1,0,0,0,0|0,0,0]=2 3775 B7R0.3 CCC(Cl)COC=O Amb24483209 [1,1,0,0,0,0|0,0,2]=4 3776 B7R0.3 CCC(Cl)COCC Amb24527943 [1,1,0,0,0,0|0,0,0]=2 3777 B7R0.3 CCC(Cl)OCC=C Amb24482355 [1,1,0,0,0,0|1,0,1]=4 3778 B7R0.3 CCC(Cl)OCCC Amb24693898 [1,1,0,0,0,0|1,0,0]=3 3779 B7R0.3 CCC(Cl)SCCC Amb25252754 [1,1,0,0,0,0|1,1,0]=4 3780 B7R0.3 CCC(Cl)\C=C\CC Amb24610169 [1,1,0,0,0,0|1,0,1]=4 3781 B7R0.3 CCC(F)CCCCl Amb25744403 [1,1,0,0,0,0|1,0,0]=3 3782 B7R0.3 CCC(F)CNOC Amb25134366 [1,1,0,0,0,0|2,0,0]=4 3783 B7R0.3 CCC(N)=NOCC Amb24721104 [1,1,0,0,0,0|1,0,1]=4 3784 B7R0.3 CCC(N)C#CCC Amb24087691 [1,1,0,0,0,0|1,0,1]=4 3785 B7R0.3 CCC(N)CCC=C Amb24434717 [1,1,0,0,0,0|1,0,1]=4 3786 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|0,0,0]=2 3787 B7R0.3 CCC(N)CCOC Amb19016193 [1,1,0,0,0,0|2,0,0]=4 3788 B7R0.3 CCC(N)CNCC Amb18304998 [1,1,0,0,0,0|1,0,0]=3 3789 B7R0.3 CCC(N)COCC Amb21954039 [1,1,0,0,0,0|0,0,0]=2 3790 B7R0.3 CCC(N)NCCS Amb25082927 [1,1,0,0,0,0|1,1,0]=4 3791 B7R0.3 CCC(O)C#CCO Amb24672497 [1,1,0,0,0,0|0,0,2]=4 3792 B7R0.3 CCC(O)CCC#C Amb20669410 [1,1,0,0,0,0|1,0,1]=4 3793 B7R0.3 CCC(O)CCC#N Amb18641733 [1,1,0,0,0,0|1,0,1]=4 3794 B7R0.3 CCC(O)CCC=C Amb22052608 [1,1,0,0,0,0|1,0,1]=4 3795 B7R0.3 CCC(O)CCCCl Amb24481301 [1,1,0,0,0,0|1,0,0]=3 3796 B7R0.3 CCC(O)CCCF Amb25321731 [1,1,0,0,0,0|1,0,0]=3 3797 B7R0.3 CCC(O)CCCN Amb18202667 [1,1,0,0,0,0|1,0,0]=3 3798 B7R0.3 CCC(O)CCCN Amb19374975 [1,1,0,0,0,0|1,0,0]=3 3799 B7R0.3 CCC(O)CCCS Amb24579615 [1,1,0,0,0,0|0,1,0]=3 3800 B7R0.3 CCC(O)CCNC Amb25215952 [1,1,0,0,0,0|2,0,0]=4 3801 B7R0.3 CCC(O)CCOC Amb22058972 [1,1,0,0,0,0|2,0,0]=4 3802 B7R0.3 CCC(O)CCSC Amb25114884 [1,1,0,0,0,0|2,0,0]=4 3803 B7R0.3 CCC(O)COC=O Amb24642387 [1,1,0,0,0,0|0,0,2]=4 3804 B7R0.3 CCC(O)OCC=C Amb22230223 [1,1,0,0,0,0|1,0,1]=4 3805 B7R0.3 CCC(O)OCCC Amb25358083 [1,1,0,0,0,0|1,0,0]=3 3806 B7R0.3 CCC(O)OCCO Amb24407420 [1,1,0,0,0,0|0,0,0]=2 3807 B7R0.3 CCC(S)CCCO Amb24534037 [1,1,0,0,0,0|0,0,0]=2 3808 B7R0.3 CCC=NC(C)CO Amb25854399 [1,1,0,0,0,0|1,0,1]=4 3809 B7R0.3 CCCCC(=C)CBr Amb25249105 [1,1,0,0,0,0|1,0,1]=4 3810 B7R0.3 CCCCC(=C)CO Amb25079813 [1,1,0,0,0,0|0,0,1]=3 3811 B7R0.3 CCCCC(=N)NC Amb24377157 [1,1,0,0,0,0|2,0,0]=4 3812 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|2,0,0]=4 3813 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|2,0,0]=4 3814 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|1,0,1]=4 3815 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|1,0,1]=4 3816 B7R0.3 CCCCC(=O)CF Amb24483296 [1,1,0,0,0,0|1,0,1]=4 3817 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|1,0,1]=4 3818 B7R0.3 CCCCC(=O)SC Amb25225724 [1,1,0,0,0,0|2,0,0]=4 3819 B7R0.3 CCCCC(Br)C#N Amb18127554 [1,1,0,0,0,0|1,0,1]=4 3820 B7R0.3 CCCCC(Br)C=C Amb25758328 [1,1,0,0,0,0|1,0,1]=4 3821 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|1,0,0]=3 3822 B7R0.3 CCCCC(Br)CN Amb25287843 [1,1,0,0,0,0|1,0,0]=3 3823 B7R0.3 CCCCC(C)=CC Amb22229367 [1,1,0,0,0,0|1,0,1]=4 3824 B7R0.3 CCCCC(C)=NO Amb19515982 [1,1,0,0,0,0|1,0,1]=4 3825 B7R0.3 CCCCC(C)C#N Amb18641663 [1,1,0,0,0,0|1,0,1]=4 3826 B7R0.3 CCCCC(C)C=C Amb22641469 [1,1,0,0,0,0|1,0,1]=4 3827 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,0]=3 3828 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,0]=3 3829 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,0]=3 3830 B7R0.3 CCCCC(C)[Mg]Br Amb22897309 [1,1,0,0,0,0|2,0,0]=4 3831 B7R0.3 CCCCC(C)[Zn]Br Amb22000400 [1,1,0,0,0,0|2,0,0]=4 3832 B7R0.3 CCCCC(C=O)Br Amb17594581 [1,1,0,0,0,0|0,0,2]=4 3833 B7R0.3 CCCCC(CC)C Amb10071971 [1,1,0,0,0,0|1,0,0]=3 3834 B7R0.3 CCCCC(CC)O Amb10844720 [1,1,0,0,0,0|1,0,0]=3 3835 B7R0.3 CCCCC(CO)C Amb17593205 [1,1,0,0,0,0|0,0,0]=2 3836 B7R0.3 CCCCC(CO)N Amb2236185 [1,1,0,0,0,0|0,0,0]=2 3837 B7R0.3 CCCCC(Cl)C#C Amb25701395 [1,1,0,0,0,0|1,0,1]=4 3838 B7R0.3 CCCCC(Cl)C=C Amb24647663 [1,1,0,0,0,0|1,0,1]=4 3839 B7R0.3 CCCCC(Cl)C=O Amb18642973 [1,1,0,0,0,0|0,0,2]=4 3840 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|1,0,0]=3 3841 B7R0.3 CCCCC(Cl)CN Amb24550911 [1,1,0,0,0,0|1,0,0]=3 3842 B7R0.3 CCCCC(Cl)CO Amb25760827 [1,1,0,0,0,0|0,0,0]=2 3843 B7R0.3 CCCCC(Cl)OC Amb24433133 [1,1,0,0,0,0|2,0,0]=4 3844 B7R0.3 CCCCC(F)CCl Amb25091588 [1,1,0,0,0,0|1,0,0]=3 3845 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|1,0,0]=3 3846 B7R0.3 CCCCC(F)CO Amb25134893 [1,1,0,0,0,0|0,0,0]=2 3847 B7R0.3 CCCCC(N)C#C Amb25798992 [1,1,0,0,0,0|1,0,1]=4 3848 B7R0.3 CCCCC(N)C#N Amb18975861 [1,1,0,0,0,0|1,0,1]=4 3849 B7R0.3 CCCCC(N)C=C Amb24677154 [1,1,0,0,0,0|1,0,1]=4 3850 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|1,0,0]=3 3851 B7R0.3 CCCCC(O)C#N Amb23454545 [1,1,0,0,0,0|1,0,1]=4 3852 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|1,0,0]=3 3853 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|1,0,0]=3 3854 B7R0.3 CCCCC(O)CS Amb24554468 [1,1,0,0,0,0|0,1,0]=3 3855 B7R0.3 CCCCC(O)OC Amb24448002 [1,1,0,0,0,0|2,0,0]=4 3856 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|1,0,0]=3 3857 B7R0.3 CCCCN(C)OC Amb24354551 [1,1,0,0,0,0|2,0,0]=4 3858 B7R0.3 CCCCN(CC)N Amb17593206 [1,1,0,0,0,0|1,0,0]=3 3859 B7R0.3 CCCC[C@@H](Br)CC Amb25273533 [1,1,0,0,0,0|1,0,0]=3 3860 B7R0.3 CCCC[C@@H](C)CBr Amb25322055 [1,1,0,0,0,0|1,0,0]=3 3861 B7R0.3 CCCC[C@@H](Cl)CC Amb24546428 [1,1,0,0,0,0|1,0,0]=3 3862 B7R0.3 CCCC[C@@H](N)C=C Amb25710927 [1,1,0,0,0,0|1,0,1]=4 3863 B7R0.3 CCCC[C@@H](N)CO Amb23440322 [1,1,0,0,0,0|0,0,0]=2 3864 B7R0.3 CCCC[C@@H](O)C=C Amb24731913 [1,1,0,0,0,0|1,0,1]=4 3865 B7R0.3 CCCC[C@@H](O)C=O Amb24481527 [1,1,0,0,0,0|0,0,2]=4 3866 B7R0.3 CCCC[C@@H](O)CC Amb25675670 [1,1,0,0,0,0|1,0,0]=3 3867 B7R0.3 CCCC[C@@H](O)CO Amb25315976 [1,1,0,0,0,0|0,0,0]=2 3868 B7R0.3 CCCC[C@H](Br)CC Amb25765583 [1,1,0,0,0,0|1,0,0]=3 3869 B7R0.3 CCCC[C@H](C)NC Amb25745887 [1,1,0,0,0,0|2,0,0]=4 3870 B7R0.3 CCCC[C@H](F)C=O Amb25143375 [1,1,0,0,0,0|0,0,2]=4 3871 B7R0.3 CCCC[C@H](N)CN Amb25725218 [1,1,0,0,0,0|1,0,0]=3 3872 B7R0.3 CCCC[C@H](O)C=C Amb24591765 [1,1,0,0,0,0|1,0,1]=4 3873 B7R0.3 CCCC[C@H](O)CCl Amb24561798 [1,1,0,0,0,0|1,0,0]=3 3874 B7R0.3 CCCC\C(\C)=N\O Amb21520448 [1,1,0,0,0,0|1,0,1]=4 3875 B7R0.3 CCCNC(=N)CO Amb23514974 [1,1,0,0,0,0|1,0,1]=4 3876 B7R0.3 CCCNC(C)CN Amb25337040 [1,1,0,0,0,0|2,0,0]=4 3877 B7R0.3 CCCNC(C)CO Amb22292469 [1,1,0,0,0,0|1,0,0]=3 3878 B7R0.3 CCCN[C@@H](C)CN Amb25270790 [1,1,0,0,0,0|2,0,0]=4 3879 B7R0.3 CCCOC(=O)NO Amb24630559 [1,1,0,0,0,0|1,0,1]=4 3880 B7R0.3 CCCOC(C)CBr Amb25295492 [1,1,0,0,0,0|1,0,0]=3 3881 B7R0.3 CCCOC(C)CN Amb21956046 [1,1,0,0,0,0|1,0,0]=3 3882 B7R0.3 CCCOC(CN)C Amb10608199 [1,1,0,0,0,0|1,0,0]=3 3883 B7R0.3 CCCOC(Cl)CCl Amb25724355 [1,1,0,0,0,0|1,0,0]=3 3884 B7R0.3 CCCOC(N)=NO Amb24358642 [1,1,0,0,0,0|1,0,1]=4 3885 B7R0.3 CCCO[C@@H](C)CO Amb25257045 [1,1,0,0,0,0|0,0,0]=2 3886 B7R0.3 CCCSC(=C)CO Amb25694154 [1,1,0,0,0,0|0,1,1]=4 3887 B7R0.3 CCCSC(CN)C Amb17485962 [1,1,0,0,0,0|1,1,0]=4 3888 B7R0.3 CCC\C=C(\Br)/CO Amb25306515 [1,1,0,0,0,0|0,0,2]=4 3889 B7R0.3 CCC\C=C(\C)/CO Amb25206584 [1,1,0,0,0,0|0,0,2]=4 3890 B7R0.3 CCC\C=C(\F)/CO Amb25093759 [1,1,0,0,0,0|0,0,2]=4 3891 B7R0.3 CCN(C)CCCBr Amb18178264 [1,1,0,0,0,0|2,0,0]=4 3892 B7R0.3 CCN(C)CCCCl Amb22587199 [1,1,0,0,0,0|2,0,0]=4 3893 B7R0.3 CCN(N)CCCO Amb25708671 [1,1,0,0,0,0|1,0,0]=3 3894 B7R0.3 CCNCC(C)CN Amb18314895 [1,1,0,0,0,0|2,0,0]=4 3895 B7R0.3 CCNCC(C)CO Amb25806225 [1,1,0,0,0,0|1,0,0]=3 3896 B7R0.3 CCNCC(C)OC Amb19025030 [1,1,0,0,0,0|2,0,0]=4 3897 B7R0.3 CCNCC(C)SC Amb19025520 [1,1,0,0,0,0|2,0,0]=4 3898 B7R0.3 CCNCC(O)CCl Amb18124503 [1,1,0,0,0,0|2,0,0]=4 3899 B7R0.3 CCNCC(O)CN Amb18062380 [1,1,0,0,0,0|2,0,0]=4 3900 B7R0.3 CCNCC(S)CS Amb24427736 [1,1,0,0,0,0|1,1,0]=4 3901 B7R0.3 CCNC[C@H](C)CO Amb24474559 [1,1,0,0,0,0|1,0,0]=3 3902 B7R0.3 CCOCC(=C)CCl Amb24682763 [1,1,0,0,0,0|1,0,1]=4 3903 B7R0.3 CCOCC(=C)CO Amb25222257 [1,1,0,0,0,0|1,0,1]=4 3904 B7R0.3 CCOCC(=N)NC Amb24591387 [1,1,0,0,0,0|1,0,1]=4 3905 B7R0.3 CCOCC(=O)CBr Amb25261639 [1,1,0,0,0,0|1,0,1]=4 3906 B7R0.3 CCOCC(=O)CCl Amb25087764 [1,1,0,0,0,0|1,0,1]=4 3907 B7R0.3 CCOCC(=O)CS Amb24406072 [1,1,0,0,0,0|1,0,1]=4 3908 B7R0.3 CCOCC(Br)CCl Amb24482698 [1,1,0,0,0,0|1,0,0]=3 3909 B7R0.3 CCOCC(Br)CN Amb24349480 [1,1,0,0,0,0|1,0,0]=3 3910 B7R0.3 CCOCC(C)CO Amb25823989 [1,1,0,0,0,0|1,0,0]=3 3911 B7R0.3 CCOCC(CC)N Amb17485991 [1,1,0,0,0,0|0,0,0]=2 3912 B7R0.3 CCOCC(CN)O Amb1127575 [1,1,0,0,0,0|1,0,0]=3 3913 B7R0.3 CCOCC(Cl)C#N Amb18642938 [1,1,0,0,0,0|1,0,1]=4 3914 B7R0.3 CCOCC(Cl)CBr Amb25173427 [1,1,0,0,0,0|1,0,0]=3 3915 B7R0.3 CCOCC(N)C#C Amb25710145 [1,1,0,0,0,0|0,0,2]=4 3916 B7R0.3 CCOCC(N)C#N Amb18984300 [1,1,0,0,0,0|1,0,1]=4 3917 B7R0.3 CCOCC(N)CS Amb25744739 [1,1,0,0,0,0|1,0,0]=3 3918 B7R0.3 CCOCC(O)C#C Amb24717652 [1,1,0,0,0,0|0,0,2]=4 3919 B7R0.3 CCOCC(O)CBr Amb24533547 [1,1,0,0,0,0|1,0,0]=3 3920 B7R0.3 CCOCC(O)CCl Amb19888638 [1,1,0,0,0,0|1,0,0]=3 3921 B7R0.3 CCOCC(O)CI Amb24757378 [1,1,0,0,0,0|1,0,0]=3 3922 B7R0.3 CCOCC(O)CO Amb19148881 [1,1,0,0,0,0|1,0,0]=3 3923 B7R0.3 CCOCC(O)CS Amb25098647 [1,1,0,0,0,0|1,0,0]=3 3924 B7R0.3 CCOC[C@@H](O)CCl Amb24665745 [1,1,0,0,0,0|1,0,0]=3 3925 B7R0.3 CCOC[C@@H](O)CN Amb25256632 [1,1,0,0,0,0|1,0,0]=3 3926 B7R0.3 CCOC[C@H](O)CCl Amb25106854 [1,1,0,0,0,0|1,0,0]=3 3927 B7R0.3 CCOC[C@H](O)CO Amb24583044 [1,1,0,0,0,0|1,0,0]=3 3928 B7R0.3 CCONC(C)CO Amb25854876 [1,1,0,0,0,0|2,0,0]=4 3929 B7R0.3 CCP(=O)OCCCl Amb25139676 [1,1,0,0,0,0|2,0,0]=4 3930 B7R0.3 CCS(=O)CCCN Amb18306016 [1,1,0,0,0,0|1,1,0]=4 3931 B7R0.3 CCS(=O)CCCO Amb25226262 [1,1,0,0,0,0|1,0,0]=3 3932 B7R0.3 CCS(=O)CCNC Amb21984659 [1,1,0,0,0,0|1,1,0]=4 3933 B7R0.3 CCS(=O)NOCC Amb25177208 [1,1,0,0,0,0|2,0,0]=4 3934 B7R0.3 CCSCC(=O)CO Amb25686953 [1,1,0,0,0,0|1,0,1]=4 3935 B7R0.3 CCSCC(C)CO Amb25726669 [1,1,0,0,0,0|1,0,0]=3 3936 B7R0.3 CCSCC(C)CS Amb25852175 [1,1,0,0,0,0|1,1,0]=4 3937 B7R0.3 CCSCC(C)NC Amb19149257 [1,1,0,0,0,0|1,1,0]=4 3938 B7R0.3 CCSCC(CC)N Amb17485958 [1,1,0,0,0,0|0,1,0]=3 3939 B7R0.3 CCSCC(CCl)O Amb17593873 [1,1,0,0,0,0|1,1,0]=4 3940 B7R0.3 CCSCC(N)CO Amb18643038 [1,1,0,0,0,0|1,0,0]=3 3941 B7R0.3 CC[C@@H](C)CCCBr Amb24740782 [1,1,0,0,0,0|1,0,0]=3 3942 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,0]=2 3943 B7R0.3 CC[C@H](C)CCC=O Amb25102725 [1,1,0,0,0,0|0,0,2]=4 3944 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,0]=2 3945 B7R0.3 CC[C@H](C)COCCl Amb24560924 [1,1,0,0,0,0|1,0,0]=3 3946 B7R0.3 CC[C@H](C)\C=C\CO Amb25142932 [1,1,0,0,0,0|0,0,2]=4 3947 B7R0.3 CC[C@H](N)COCC Amb24730374 [1,1,0,0,0,0|0,0,0]=2 3948 B7R0.3 CC[C@H](N)CSCC Amb25065624 [1,1,0,0,0,0|0,1,0]=3 3949 B7R0.3 CC[C@H](O)CCC#N Amb24661266 [1,1,0,0,0,0|1,0,1]=4 3950 B7R0.3 CC[C@H](O)CCCCl Amb25328557 [1,1,0,0,0,0|1,0,0]=3 3951 B7R0.3 CC[C@H](O)CSCC Amb24388051 [1,1,0,0,0,0|0,1,0]=3 3952 B7R0.3 CC[C@H](O)\C=C\CO Amb25185222 [1,1,0,0,0,0|0,0,2]=4 3953 B7R0.3 CC\C(\C)=C/CCC Amb25227654 [1,1,0,0,0,0|1,0,1]=4 3954 B7R0.3 CC\C(\C)=C/CCO Amb25264354 [1,1,0,0,0,0|0,0,2]=4 3955 B7R0.3 CC\C(\C)=C\CCC Amb25260956 [1,1,0,0,0,0|1,0,1]=4 3956 B7R0.3 CC\C=C\[C@@H](O)CO Amb25721479 [1,1,0,0,0,0|0,0,2]=4 3957 B7R0.3 CC\C=C\[C@H](O)CO Amb24353158 [1,1,0,0,0,0|0,0,2]=4 3958 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|1,0,1]=4 3959 B7R0.3 CNC(C)CCCCl Amb25340216 [1,1,0,0,0,0|2,0,0]=4 3960 B7R0.3 CNC(C)CCCS Amb24548498 [1,1,0,0,0,0|1,1,0]=4 3961 B7R0.3 CNC(C)CNCC Amb18311104 [1,1,0,0,0,0|2,0,0]=4 3962 B7R0.3 CN[C@@H](C)CCCN Amb25746510 [1,1,0,0,0,0|2,0,0]=4 3963 B7R0.3 COC(=N)COCC Amb25315918 [1,1,0,0,0,0|1,0,1]=4 3964 B7R0.3 COC(C)OCCBr Amb24553060 [1,1,0,0,0,0|2,0,0]=4 3965 B7R0.3 COC(C)OCCCl Amb24481386 [1,1,0,0,0,0|2,0,0]=4 3966 B7R0.3 COC(C)OCCN Amb24746310 [1,1,0,0,0,0|2,0,0]=4 3967 B7R0.3 COC(C)OCCO Amb25823344 [1,1,0,0,0,0|1,0,0]=3 3968 B7R0.3 COC(Cl)CCCCl Amb25055624 [1,1,0,0,0,0|2,0,0]=4 3969 B7R0.3 COC(O)CCCO Amb24619181 [1,1,0,0,0,0|1,0,0]=3 3970 B7R0.3 COCCC(=O)CO Amb25049164 [1,1,0,0,0,0|1,0,1]=4 3971 B7R0.3 COCCC(Br)CCl Amb24549860 [1,1,0,0,0,0|2,0,0]=4 3972 B7R0.3 COCCC(C)NO Amb25127365 [1,1,0,0,0,0|2,0,0]=4 3973 B7R0.3 COCCC(Cl)CO Amb25725023 [1,1,0,0,0,0|1,0,0]=3 3974 B7R0.3 COCCC(N)CN Amb19023234 [1,1,0,0,0,0|2,0,0]=4 3975 B7R0.3 COCCC(N)CS Amb25199860 [1,1,0,0,0,0|1,1,0]=4 3976 B7R0.3 COCC[C@@H](C)CO Amb24412889 [1,1,0,0,0,0|1,0,0]=3 3977 B7R0.3 COCC[C@H](C)CO Amb25333737 [1,1,0,0,0,0|1,0,0]=3 3978 B7R0.3 COCC[C@H](N)CS Amb25251388 [1,1,0,0,0,0|1,1,0]=4 3979 B7R0.3 COCOC(C)CO Amb25274363 [1,1,0,0,0,0|1,0,0]=3 3980 B7R0.3 COCO[C@@H](C)CBr Amb24677719 [1,1,0,0,0,0|2,0,0]=4 3981 B7R0.3 COCO[C@@H](C)CO Amb22169783 [1,1,0,0,0,0|1,0,0]=3 3982 B7R0.3 CONCC(O)CO Amb25274226 [1,1,0,0,0,0|2,0,0]=4 3983 B7R0.3 COP(=O)OCCO Amb24534031 [1,1,0,0,0,0|2,0,0]=4 3984 B7R0.3 CO[C@@H](C)CCCCl Amb25323981 [1,1,0,0,0,0|2,0,0]=4 3985 B7R0.3 CO[C@@H](C)CCCO Amb25306514 [1,1,0,0,0,0|1,0,0]=3 3986 B7R0.3 CO[C@@H](C)OCCO Amb24386800 [1,1,0,0,0,0|1,0,0]=3 3987 B7R0.3 CSC(C)CCCN Amb18642560 [1,1,0,0,0,0|2,0,0]=4 3988 B7R0.3 CSCCC(C)CO Amb25338794 [1,1,0,0,0,0|1,0,0]=3 3989 B7R0.3 CSCCC(N)CN Amb19003937 [1,1,0,0,0,0|2,0,0]=4 3990 B7R0.3 CSCCC(O)CBr Amb25824128 [1,1,0,0,0,0|2,0,0]=4 3991 B7R0.3 CSCCC(O)CCl Amb25067893 [1,1,0,0,0,0|2,0,0]=4 3992 B7R0.3 CSCCC(O)CN Amb25785761 [1,1,0,0,0,0|2,0,0]=4 3993 B7R0.3 CSCC[C@@H](N)CN Amb24362961 [1,1,0,0,0,0|2,0,0]=4 3994 B7R0.3 CSCC[C@@H](N)CO Amb22753875 [1,1,0,0,0,0|1,0,0]=3 3995 B7R0.3 CSCC[C@H](N)CS Amb24381781 [1,1,0,0,0,0|1,1,0]=4 3996 B7R0.3 CSCOC(C)CO Amb25374195 [1,1,0,0,0,0|1,0,0]=3 3997 B7R0.3 CSCO[C@@H](C)CO Amb25293637 [1,1,0,0,0,0|1,0,0]=3 3998 B7R0.3 CSCSC(C)CO Amb25128815 [1,1,0,0,0,0|1,1,0]=4 3999 B7R0.3 CSSCC(O)CO Amb24350869 [1,1,0,0,0,0|2,0,0]=4 4000 B7R0.3 C[C@@H](CCCO)CO Amb24475366 [1,1,0,0,0,0|1,0,0]=3 4001 B7R0.3 C[C@@H](CN)NCCO Amb25099589 [1,1,0,0,0,0|2,0,0]=4 4002 B7R0.3 C[C@@H](CO)CCC=C Amb25700125 [1,1,0,0,0,0|0,0,2]=4 4003 B7R0.3 C[C@@H](CO)CCC=O Amb24602985 [1,1,0,0,0,0|1,0,1]=4 4004 B7R0.3 C[C@@H](CO)NCCCl Amb24481379 [1,1,0,0,0,0|2,0,0]=4 4005 B7R0.3 C[C@@H](CO)OCC=C Amb25228448 [1,1,0,0,0,0|0,0,2]=4 4006 B7R0.3 C[C@H](CCCO)C=C Amb25675669 [1,1,0,0,0,0|0,0,2]=4 4007 B7R0.3 C[C@H](CN)CCCO Amb24426785 [1,1,0,0,0,0|1,0,0]=3 4008 B7R0.3 C[C@H](CO)CCC#C Amb25306457 [1,1,0,0,0,0|0,0,2]=4 4009 B7R0.3 C[C@H](CO)CCCBr Amb24632762 [1,1,0,0,0,0|1,0,0]=3 4010 B7R0.3 C\C(\CC)=C/CCC Amb22732739 [1,1,0,0,0,0|1,0,1]=4 4011 B7R0.3 C\C(\CCCC)=C/C Amb22731328 [1,1,0,0,0,0|1,0,1]=4 4012 B7R0.3 C\C=C(\C)/CCCO Amb25080181 [1,1,0,0,0,0|0,0,2]=4 4013 B7R0.3 C\C=C(\Cl)/CCCO Amb25344045 [1,1,0,0,0,0|0,0,2]=4 4014 B7R0.3 C\C=C\CC(Cl)CC Amb24519441 [1,1,0,0,0,0|1,0,1]=4 4015 B7R0.3 C\C=C\CC(N)CO Amb24625761 [1,1,0,0,0,0|0,0,2]=4 4016 B7R0.3 C\C=C\CC(O)CC Amb25781191 [1,1,0,0,0,0|1,0,1]=4 4017 B7R0.3 C\C=C\C[C@@H](N)CO Amb24579420 [1,1,0,0,0,0|0,0,2]=4 4018 B7R0.3 ClCC(Cl)OCCCl Amb24483193 [1,1,0,0,0,0|2,0,0]=4 4019 B7R0.3 ClCCCC(=O)CC Amb17593423 [1,1,0,0,0,0|1,0,1]=4 4020 B7R0.3 ClCCCC(CN)Cl Amb10068528 [1,1,0,0,0,0|2,0,0]=4 4021 B7R0.3 ClCCCC(CO)O Amb17593523 [1,1,0,0,0,0|1,0,0]=3 4022 B7R0.3 ClCCCN(CC)C Amb10608259 [1,1,0,0,0,0|2,0,0]=4 4023 B7R0.3 ClCCNC(CC)C Amb17334146 [1,1,0,0,0,0|2,0,0]=4 4024 B7R0.3 N#CC(O)CCCO Amb24661252 [1,1,0,0,0,0|1,0,1]=4 4025 B7R0.3 NC(CCCO)CO Amb18641979 [1,1,0,0,0,0|1,0,0]=3 4026 B7R0.3 NC(CCCS)CS Amb25240775 [1,1,0,0,0,0|1,1,0]=4 4027 B7R0.3 NCC(=O)CCCO Amb24471240 [1,1,0,0,0,0|1,0,1]=4 4028 B7R0.3 NCC(O)CCCO Amb18124267 [1,1,0,0,0,0|1,0,0]=3 4029 B7R0.3 NCCCC(Br)CN Amb24373248 [1,1,0,0,0,0|2,0,0]=4 4030 B7R0.3 NCCCC(CC)C Amb17569898 [1,1,0,0,0,0|1,0,0]=3 4031 B7R0.3 NCCCC(CO)C Amb17569904 [1,1,0,0,0,0|1,0,0]=3 4032 B7R0.3 NCCCC(O)CN Amb24460595 [1,1,0,0,0,0|2,0,0]=4 4033 B7R0.3 NCCC[C@H](O)CBr Amb24334519 [1,1,0,0,0,0|2,0,0]=4 4034 B7R0.3 NCCC[C@H](O)CN Amb24527869 [1,1,0,0,0,0|2,0,0]=4 4035 B7R0.3 NOCCC(N)CO Amb24531346 [1,1,0,0,0,0|2,0,0]=4 4036 B7R0.3 N[C@@H](CCCO)CO Amb24117047 [1,1,0,0,0,0|1,0,0]=3 4037 B7R0.3 N[C@H](CCCS)CS Amb25732700 [1,1,0,0,0,0|1,1,0]=4 4038 B7R0.3 N[C@H](CO)CCCF Amb25198873 [1,1,0,0,0,0|1,0,0]=3 4039 B7R0.3 OC(CO)CCC=C Amb10071251 [1,1,0,0,0,0|0,0,2]=4 4040 B7R0.3 OCC(=O)CCCCl Amb24481374 [1,1,0,0,0,0|1,0,1]=4 4041 B7R0.3 OCC(CCSC)N Amb2236184 [1,1,0,0,0,0|1,0,0]=3 4042 B7R0.3 OCC(O)CCC=O Amb24669095 [1,1,0,0,0,0|1,0,1]=4 4043 B7R0.3 OCC(O)OCC=O Amb25046498 [1,1,0,0,0,0|1,0,1]=4 4044 B7R0.3 OCC(S)CCCS Amb25106055 [1,1,0,0,0,0|1,0,0]=3 4045 B7R0.3 OCCCC(Br)C=O Amb25765431 [1,1,0,0,0,0|1,0,1]=4 4046 B7R0.3 OCCCC(CC)O Amb17593216 [1,1,0,0,0,0|0,0,0]=2 4047 B7R0.3 OCCCC(CN)C Amb17569906 [1,1,0,0,0,0|1,0,0]=3 4048 B7R0.3 OCCCC(CO)O Amb17593225 [1,1,0,0,0,0|1,0,0]=3 4049 B7R0.3 OCCCC(Cl)CO Amb25275096 [1,1,0,0,0,0|1,0,0]=3 4050 B7R0.3 OCCCC(F)C=O Amb24553890 [1,1,0,0,0,0|1,0,1]=4 4051 B7R0.3 OCCCC(F)CO Amb25051440 [1,1,0,0,0,0|1,0,0]=3 4052 B7R0.3 OCCCC(O)C=O Amb18641948 [1,1,0,0,0,0|1,0,1]=4 4053 B7R0.3 OCCCC(O)CBr Amb24533940 [1,1,0,0,0,0|1,0,0]=3 4054 B7R0.3 OCCCC(O)CCl Amb24725283 [1,1,0,0,0,0|1,0,0]=3 4055 B7R0.3 OCCC[C@H](O)C=O Amb24570447 [1,1,0,0,0,0|1,0,1]=4 4056 B7R0.3 OCCC[C@H](O)CO Amb24687288 [1,1,0,0,0,0|1,0,0]=3 4057 B7R0.3 OCCOC(=O)CCl Amb25173827 [1,1,0,0,0,0|1,0,1]=4 4058 B7R0.3 OC[C@@H](O)CCC=O Amb24482301 [1,1,0,0,0,0|1,0,1]=4 4059 B7R0.3 OC[C@H](O)CCC=O Amb25123219 [1,1,0,0,0,0|1,0,1]=4 4060 B7R0.3 [NH3+]CCCC(F)C[NH3+] Amb24117175 [1,1,0,0,0,0|2,0,0]=4 4061 B7R0.4 BrCCCCC(=O)C Amb16234126 [1,1,0,0,0,0|1,0,1]=4 4062 B7R0.4 C=C(Br)CCCCO Amb25381428 [1,1,0,0,0,0|0,0,2]=4 4063 B7R0.4 C=C(Cl)CCCCO Amb25064782 [1,1,0,0,0,0|0,0,2]=4 4064 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|0,0,2]=4 4065 B7R0.4 CC#CCCC(C)Br Amb25045853 [1,1,0,0,0,0|1,0,1]=4 4066 B7R0.4 CC#CCCC(C)C Amb22052677 [1,1,0,0,0,0|1,0,1]=4 4067 B7R0.4 CC#CCCC(C)N Amb25101063 [1,1,0,0,0,0|1,0,1]=4 4068 B7R0.4 CC#CCC[C@@H](C)O Amb22896361 [1,1,0,0,0,0|0,0,2]=4 4069 B7R0.4 CC#CCC[C@H](C)O Amb24734021 [1,1,0,0,0,0|0,0,2]=4 4070 B7R0.4 CC(=C)CCCCBr Amb25129478 [1,1,0,0,0,0|1,0,1]=4 4071 B7R0.4 CC(=C)CCCCCl Amb24481468 [1,1,0,0,0,0|1,0,1]=4 4072 B7R0.4 CC(=C)CCCCN Amb25142976 [1,1,0,0,0,0|1,0,1]=4 4073 B7R0.4 CC(=C)CNCCO Amb24591963 [1,1,0,0,0,0|1,0,1]=4 4074 B7R0.4 CC(=C)COCCN Amb19020764 [1,1,0,0,0,0|1,0,1]=4 4075 B7R0.4 CC(=C)COCCN Amb20631068 [1,1,0,0,0,0|1,0,1]=4 4076 B7R0.4 CC(=C)OCCCBr Amb25337400 [1,1,0,0,0,0|1,0,1]=4 4077 B7R0.4 CC(=C)OCCCO Amb24581723 [1,1,0,0,0,0|1,0,1]=4 4078 B7R0.4 CC(=N)CCCCN Amb25076530 [1,1,0,0,0,0|1,0,1]=4 4079 B7R0.4 CC(=O)CNCCO Amb18108527 [1,1,0,0,0,0|1,0,1]=4 4080 B7R0.4 CC(=O)COCCCl Amb25346574 [1,1,0,0,0,0|1,0,1]=4 4081 B7R0.4 CC(=O)COCCN Amb18630459 [1,1,0,0,0,0|1,0,1]=4 4082 B7R0.4 CC(=O)OCCCF Amb22008199 [1,1,0,0,0,0|1,0,1]=4 4083 B7R0.4 CC(=O)OCCCI Amb24532815 [1,1,0,0,0,0|1,0,1]=4 4084 B7R0.4 CC(=O)OCCCN Amb18641920 [1,1,0,0,0,0|1,0,1]=4 4085 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|1,0,1]=4 4086 B7R0.4 CC(=S)OCCCCl Amb22232259 [1,1,0,0,0,0|1,0,1]=4 4087 B7R0.4 CC(Br)CCCC#C Amb25067289 [1,1,0,0,0,0|1,0,1]=4 4088 B7R0.4 CC(Br)CCCCO Amb25859232 [1,1,0,0,0,0|0,0,0]=2 4089 B7R0.4 CC(Br)CCOC=O Amb25109882 [1,1,0,0,0,0|0,0,2]=4 4090 B7R0.4 CC(Br)COCCCl Amb24654744 [1,1,0,0,0,0|1,0,0]=3 4091 B7R0.4 CC(C)C=NCCO Amb25205175 [1,1,0,0,0,0|1,0,1]=4 4092 B7R0.4 CC(C)CCC=NO Amb24531460 [1,1,0,0,0,0|1,0,1]=4 4093 B7R0.4 CC(C)CCCC#C Amb18635315 [1,1,0,0,0,0|1,0,1]=4 4094 B7R0.4 CC(C)CCCC#N Amb21811944 [1,1,0,0,0,0|1,0,1]=4 4095 B7R0.4 CC(C)CCCC=C Amb25127926 [1,1,0,0,0,0|1,0,1]=4 4096 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,2]=4 4097 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|1,0,0]=3 4098 B7R0.4 CC(C)CCCCN Amb19374781 [1,1,0,0,0,0|1,0,0]=3 4099 B7R0.4 CC(C)CCCNO Amb25232356 [1,1,0,0,0,0|1,0,0]=3 4100 B7R0.4 CC(C)CCC[Mg]Br Amb22897339 [1,1,0,0,0,0|2,0,0]=4 4101 B7R0.4 CC(C)CCC[Zn]Br Amb22897392 [1,1,0,0,0,0|2,0,0]=4 4102 B7R0.4 CC(C)CCOC=C Amb17940027 [1,1,0,0,0,0|0,0,2]=4 4103 B7R0.4 CC(C)CCO[15N]=O Amb22351359 [1,1,0,0,0,0|1,0,1]=4 4104 B7R0.4 CC(C)CCSCCl Amb24481232 [1,1,0,0,0,0|1,1,0]=4 4105 B7R0.4 CC(C)CCSCO Amb24450091 [1,1,0,0,0,0|0,1,0]=3 4106 B7R0.4 CC(C)CNCCBr Amb25801102 [1,1,0,0,0,0|2,0,0]=4 4107 B7R0.4 CC(C)CNCCF Amb24366225 [1,1,0,0,0,0|2,0,0]=4 4108 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|1,0,0]=3 4109 B7R0.4 CC(C)CNCCS Amb24616771 [1,1,0,0,0,0|1,1,0]=4 4110 B7R0.4 CC(C)COCCS Amb24589392 [1,1,0,0,0,0|0,1,0]=3 4111 B7R0.4 CC(C)C\C=C\CO Amb25851501 [1,1,0,0,0,0|0,0,2]=4 4112 B7R0.4 CC(C)NCCCBr Amb24483135 [1,1,0,0,0,0|2,0,0]=4 4113 B7R0.4 CC(C)NCCCCl Amb18124442 [1,1,0,0,0,0|2,0,0]=4 4114 B7R0.4 CC(C)NCCCI Amb24733808 [1,1,0,0,0,0|2,0,0]=4 4115 B7R0.4 CC(C)NCCCO Amb22492397 [1,1,0,0,0,0|1,0,0]=3 4116 B7R0.4 CC(C)NNCCO Amb25740609 [1,1,0,0,0,0|2,0,0]=4 4117 B7R0.4 CC(C)OCCCS Amb24551906 [1,1,0,0,0,0|1,0,0]=3 4118 B7R0.4 CC(C)OCCON Amb25113499 [1,1,0,0,0,0|2,0,0]=4 4119 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|1,1,0]=4 4120 B7R0.4 CC(C)SCCCCl Amb18179463 [1,1,0,0,0,0|1,1,0]=4 4121 B7R0.4 CC(C)SCCCS Amb24483199 [1,1,0,0,0,0|1,1,0]=4 4122 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,2]=4 4123 B7R0.4 CC(Cl)CCCC#C Amb25209433 [1,1,0,0,0,0|1,0,1]=4 4124 B7R0.4 CC(Cl)CCCC#N Amb24524251 [1,1,0,0,0,0|1,0,1]=4 4125 B7R0.4 CC(Cl)CCCCO Amb24532074 [1,1,0,0,0,0|0,0,0]=2 4126 B7R0.4 CC(Cl)CNCCCl Amb24442200 [1,1,0,0,0,0|2,0,0]=4 4127 B7R0.4 CC(Cl)CNCCF Amb25300193 [1,1,0,0,0,0|2,0,0]=4 4128 B7R0.4 CC(Cl)COCC=C Amb24739587 [1,1,0,0,0,0|1,0,1]=4 4129 B7R0.4 CC(Cl)CSCCCl Amb25101009 [1,1,0,0,0,0|1,1,0]=4 4130 B7R0.4 CC(F)CCCCBr Amb24440754 [1,1,0,0,0,0|1,0,0]=3 4131 B7R0.4 CC(F)CCCCO Amb24414878 [1,1,0,0,0,0|0,0,0]=2 4132 B7R0.4 CC(F)CNCCO Amb24518852 [1,1,0,0,0,0|1,0,0]=3 4133 B7R0.4 CC(N)CCCC#C Amb24418743 [1,1,0,0,0,0|1,0,1]=4 4134 B7R0.4 CC(N)CCCCN Amb25214697 [1,1,0,0,0,0|1,0,0]=3 4135 B7R0.4 CC(N)CNCCO Amb24668970 [1,1,0,0,0,0|1,0,0]=3 4136 B7R0.4 CC(N)CSCCO Amb25101466 [1,1,0,0,0,0|0,1,0]=3 4137 B7R0.4 CC(O)CCCC#C Amb24360348 [1,1,0,0,0,0|0,0,2]=4 4138 B7R0.4 CC(O)CCCC#N Amb24354435 [1,1,0,0,0,0|1,0,1]=4 4139 B7R0.4 CC(O)CCCC=C Amb22059432 [1,1,0,0,0,0|0,0,2]=4 4140 B7R0.4 CC(O)CCCC=O Amb18641887 [1,1,0,0,0,0|0,0,2]=4 4141 B7R0.4 CC(O)CCCCBr Amb24552945 [1,1,0,0,0,0|1,0,0]=3 4142 B7R0.4 CC(O)CCCCCl Amb24462574 [1,1,0,0,0,0|1,0,0]=3 4143 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|0,0,0]=2 4144 B7R0.4 CC(O)CCCON Amb24412992 [1,1,0,0,0,0|2,0,0]=4 4145 B7R0.4 CC(O)CCOC=C Amb25739848 [1,1,0,0,0,0|0,0,2]=4 4146 B7R0.4 CC(O)COCC=C Amb22733640 [1,1,0,0,0,0|0,0,2]=4 4147 B7R0.4 CC(O)COCCO Amb24590103 [1,1,0,0,0,0|0,0,0]=2 4148 B7R0.4 CC(O)CSCCN Amb18304010 [1,1,0,0,0,0|1,1,0]=4 4149 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|0,1,0]=3 4150 B7R0.4 CC(OCC[N+]#[C-])C Amb1981101 [1,1,0,0,0,0|1,0,1]=4 4151 B7R0.4 CC(S)CSCCO Amb24476156 [1,1,0,0,0,0|0,1,0]=3 4152 B7R0.4 CCC#CCC(C)O Amb22045231 [1,1,0,0,0,0|0,0,2]=4 4153 B7R0.4 CCC#CC[C@H](C)O Amb25851544 [1,1,0,0,0,0|0,0,2]=4 4154 B7R0.4 CCCC#CC(C)N Amb25261362 [1,1,0,0,0,0|1,0,1]=4 4155 B7R0.4 CCCC#CC(C)O Amb24273363 [1,1,0,0,0,0|0,0,2]=4 4156 B7R0.4 CCCC#C[C@H](C)O Amb25283222 [1,1,0,0,0,0|0,0,2]=4 4157 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|1,0,1]=4 4158 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,0]=3 4159 B7R0.4 CCCCCC(C)Cl Amb22228752 [1,1,0,0,0,0|1,0,0]=3 4160 B7R0.4 CCCCCC(C)N Amb21962698 [1,1,0,0,0,0|1,0,0]=3 4161 B7R0.4 CCCCCC(C)S Amb17939452 [1,1,0,0,0,0|0,1,0]=3 4162 B7R0.4 CCCCCC(Cl)Br Amb25061271 [1,1,0,0,0,0|1,0,0]=3 4163 B7R0.4 CCCCCC(F)Br Amb24641242 [1,1,0,0,0,0|1,0,0]=3 4164 B7R0.4 CCCCCC(N)=N Amb19890171 [1,1,0,0,0,0|1,0,1]=4 4165 B7R0.4 CCCCCC(N)C Amb10843721 [1,1,0,0,0,0|1,0,0]=3 4166 B7R0.4 CCCCCC(N)O Amb24673933 [1,1,0,0,0,0|0,0,0]=2 4167 B7R0.4 CCCCCC([O-])=O Amb22337624 [1,1,0,0,0,0|0,0,2]=4 4168 B7R0.4 CCCCCC([O-])=O Amb22525161 [1,1,0,0,0,0|0,0,2]=4 4169 B7R0.4 CCCCCC([O-])=O Amb22730527 [1,1,0,0,0,0|0,0,2]=4 4170 B7R0.4 CCCCCC([O-])=O Amb22731343 [1,1,0,0,0,0|0,0,2]=4 4171 B7R0.4 CCCCCN(C)C Amb10560438 [1,1,0,0,0,0|2,0,0]=4 4172 B7R0.4 CCCCCN(C)N Amb24354275 [1,1,0,0,0,0|2,0,0]=4 4173 B7R0.4 CCCCC[13C](O)=O Amb22353417 [1,1,0,0,0,0|0,0,1]=3 4174 B7R0.4 CCCCC[C@@H](C)Br Amb24692738 [1,1,0,0,0,0|1,0,0]=3 4175 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|0,0,0]=2 4176 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [1,1,0,0,0,0|1,0,1]=4 4177 B7R0.4 CCCCC[SiH](C)C Amb25173961 [1,1,0,0,0,0|1,1,0]=4 4178 B7R0.4 CCCCNC(C)=C Amb25291695 [1,1,0,0,0,0|1,0,1]=4 4179 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|1,0,0]=3 4180 B7R0.4 CCCCNC(C)O Amb24715795 [1,1,0,0,0,0|1,0,0]=3 4181 B7R0.4 CCCCOB(O)O Amb25687500 [1,1,0,0,0,0|1,0,0]=3 4182 B7R0.4 CCCCOC(=O)F Amb24710483 [1,1,0,0,0,0|0,0,2]=4 4183 B7R0.4 CCCCOC(C)=S Amb22230357 [1,1,0,0,0,0|0,0,1]=3 4184 B7R0.4 CCCCOC(C)Br Amb17689407 [1,1,0,0,0,0|0,0,0]=2 4185 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,1,0,0,0,0|0,0,0]=2 4186 B7R0.4 CCCCOC(N)=N Amb24579254 [1,1,0,0,0,0|1,0,1]=4 4187 B7R0.4 CCCCOC(N)=S Amb24761515 [1,1,0,0,0,0|0,1,1]=4 4188 B7R0.4 CCCCSC(=O)C Amb10552685 [1,1,0,0,0,0|0,1,1]=4 4189 B7R0.4 CCCCSC(Cl)Cl Amb24635698 [1,1,0,0,0,0|1,1,0]=4 4190 B7R0.4 CCCCSC(F)F Amb24354543 [1,1,0,0,0,0|1,1,0]=4 4191 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [1,1,0,0,0,0|0,0,1]=3 4192 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|1,0,1]=4 4193 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|1,0,1]=4 4194 B7R0.4 CCCNCC(C)Cl Amb25074390 [1,1,0,0,0,0|2,0,0]=4 4195 B7R0.4 CCCNCC(C)N Amb19024658 [1,1,0,0,0,0|2,0,0]=4 4196 B7R0.4 CCCNCC(C)O Amb22292467 [1,1,0,0,0,0|1,0,0]=3 4197 B7R0.4 CCCNCC(C)S Amb18124358 [1,1,0,0,0,0|1,1,0]=4 4198 B7R0.4 CCCNCC(F)F Amb13951924 [1,1,0,0,0,0|2,0,0]=4 4199 B7R0.4 CCCNC[C@@H](C)O Amb25042630 [1,1,0,0,0,0|1,0,0]=3 4200 B7R0.4 CCCNC[C@H](C)N Amb25730636 [1,1,0,0,0,0|2,0,0]=4 4201 B7R0.4 CCCNC[C@H](C)O Amb24473274 [1,1,0,0,0,0|1,0,0]=3 4202 B7R0.4 CCCOCC(C)Br Amb24563738 [1,1,0,0,0,0|1,0,0]=3 4203 B7R0.4 CCCOC[C@H](C)O Amb24575974 [1,1,0,0,0,0|0,0,0]=2 4204 B7R0.4 CCCONC(C)C Amb25799117 [1,1,0,0,0,0|2,0,0]=4 4205 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,1,1]=4 4206 B7R0.4 CCCSCC(C)N Amb25101048 [1,1,0,0,0,0|1,1,0]=4 4207 B7R0.4 CCCSC[C@@H](C)N Amb25839433 [1,1,0,0,0,0|1,1,0]=4 4208 B7R0.4 CCCSC[C@H](C)N Amb24409083 [1,1,0,0,0,0|1,1,0]=4 4209 B7R0.4 CCCSC[C@H](C)O Amb24526704 [1,1,0,0,0,0|0,1,0]=3 4210 B7R0.4 CCC\C=C/C(C)C Amb25747213 [1,1,0,0,0,0|1,0,1]=4 4211 B7R0.4 CCC\C=C\C(C)O Amb25083446 [1,1,0,0,0,0|0,0,2]=4 4212 B7R0.4 CCNCCC(C)=C Amb18312576 [1,1,0,0,0,0|1,0,1]=4 4213 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,1]=4 4214 B7R0.4 CCNCCC(C)Br Amb25697002 [1,1,0,0,0,0|1,0,0]=3 4215 B7R0.4 CCNCCC(C)F Amb25250453 [1,1,0,0,0,0|1,0,0]=3 4216 B7R0.4 CCNCCC(C)N Amb18305008 [1,1,0,0,0,0|1,0,0]=3 4217 B7R0.4 CCNCCC(F)F Amb25307874 [1,1,0,0,0,0|2,0,0]=4 4218 B7R0.4 CCNCCN(C)C Amb1128271 [1,1,0,0,0,0|2,0,0]=4 4219 B7R0.4 CCNCCN(C)N Amb18641934 [1,1,0,0,0,0|2,0,0]=4 4220 B7R0.4 CCNCC[C@H](C)O Amb25757479 [1,1,0,0,0,0|1,0,0]=3 4221 B7R0.4 CCOCC=C(C)C Amb25320552 [1,1,0,0,0,0|0,0,2]=4 4222 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,1,0,0,0,0|1,0,1]=4 4223 B7R0.4 CCOCCN(C)C Amb24676540 [1,1,0,0,0,0|1,0,0]=3 4224 B7R0.4 CCOCCN(C)N Amb24690005 [1,1,0,0,0,0|1,0,0]=3 4225 B7R0.4 CCOCCS(=O)Cl Amb24625733 [1,1,0,0,0,0|2,0,0]=4 4226 B7R0.4 CCOCCS(C)=O Amb25206909 [1,1,0,0,0,0|1,0,0]=3 4227 B7R0.4 CCOCC[C@@H](C)N Amb25744371 [1,1,0,0,0,0|0,0,0]=2 4228 B7R0.4 CCOCC[C@@H](C)O Amb24524285 [1,1,0,0,0,0|0,0,0]=2 4229 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,1,0,0,0,0|0,0,0]=2 4230 B7R0.4 CCOCNC(C)=O Amb24334070 [1,1,0,0,0,0|1,0,1]=4 4231 B7R0.4 CCOCOC(C)=O Amb25191864 [1,1,0,0,0,0|1,0,1]=4 4232 B7R0.4 CCON=CC(C)C Amb25833263 [1,1,0,0,0,0|1,0,1]=4 4233 B7R0.4 CCON=CC(C)O Amb24694308 [1,1,0,0,0,0|1,0,1]=4 4234 B7R0.4 CCONCC(C)C Amb25265636 [1,1,0,0,0,0|1,0,0]=3 4235 B7R0.4 CCONCC(F)F Amb24428484 [1,1,0,0,0,0|2,0,0]=4 4236 B7R0.4 CCONC[C@@H](C)O Amb24526714 [1,1,0,0,0,0|1,0,0]=3 4237 B7R0.4 CCO[SiH2]CN(C)C Amb22733279 [1,1,0,0,0,0|1,1,0]=4 4238 B7R0.4 CCO\C=C\C(C)C Amb22261439 [1,1,0,0,0,0|0,0,2]=4 4239 B7R0.4 CCO\N=C/C(C)O Amb24738508 [1,1,0,0,0,0|1,0,1]=4 4240 B7R0.4 CCSCCC(C)=C Amb25236682 [1,1,0,0,0,0|0,1,1]=4 4241 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|0,1,0]=3 4242 B7R0.4 CCSCCC(C)N Amb19149259 [1,1,0,0,0,0|0,1,0]=3 4243 B7R0.4 CCSSCC(C)C Amb25376742 [1,1,0,0,0,0|1,1,0]=4 4244 B7R0.4 CCSSCC(C)O Amb24412221 [1,1,0,0,0,0|1,1,0]=4 4245 B7R0.4 CC\C=C\CC(C)N Amb25357984 [1,1,0,0,0,0|1,0,1]=4 4246 B7R0.4 CC\C=C\CC(O)O Amb24353159 [1,1,0,0,0,0|0,0,2]=4 4247 B7R0.4 CC\C=C\C[C@@H](C)O Amb24352295 [1,1,0,0,0,0|0,0,2]=4 4248 B7R0.4 CN(C)CCCCBr Amb18178257 [1,1,0,0,0,0|2,0,0]=4 4249 B7R0.4 CN(C)CCCCBr Amb19148184 [1,1,0,0,0,0|2,0,0]=4 4250 B7R0.4 CN(C)CCCCCl Amb20668164 [1,1,0,0,0,0|2,0,0]=4 4251 B7R0.4 CN(C)CCCCF Amb24527895 [1,1,0,0,0,0|2,0,0]=4 4252 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|1,0,1]=4 4253 B7R0.4 CNCCCC(C)Cl Amb24706205 [1,1,0,0,0,0|2,0,0]=4 4254 B7R0.4 CNCCCC(O)C Amb17569899 [1,1,0,0,0,0|1,0,0]=3 4255 B7R0.4 CNCCCS(O)=O Amb24656214 [1,1,0,0,0,0|2,0,0]=4 4256 B7R0.4 CNCCOC(C)=O Amb18124262 [1,1,0,0,0,0|1,0,1]=4 4257 B7R0.4 CNCCOC(C)C Amb19024604 [1,1,0,0,0,0|1,0,0]=3 4258 B7R0.4 CNCCOP(O)O Amb25131324 [1,1,0,0,0,0|2,0,0]=4 4259 B7R0.4 CNCCSC(C)C Amb19024679 [1,1,0,0,0,0|1,1,0]=4 4260 B7R0.4 CNOCCN(C)C Amb24625525 [1,1,0,0,0,0|2,0,0]=4 4261 B7R0.4 COCCCC(C)Br Amb18185551 [1,1,0,0,0,0|2,0,0]=4 4262 B7R0.4 COCCCC(C)S Amb25810805 [1,1,0,0,0,0|1,1,0]=4 4263 B7R0.4 COCCC[C@@H](C)N Amb24749054 [1,1,0,0,0,0|2,0,0]=4 4264 B7R0.4 COCCOC(C)Br Amb25810790 [1,1,0,0,0,0|1,0,0]=3 4265 B7R0.4 COCCOC(Cl)Cl Amb24635425 [1,1,0,0,0,0|2,0,0]=4 4266 B7R0.4 COCCSC(C)C Amb24333320 [1,1,0,0,0,0|1,1,0]=4 4267 B7R0.4 COCNCC(C)O Amb25216574 [1,1,0,0,0,0|2,0,0]=4 4268 B7R0.4 CONCCC(C)C Amb20669574 [1,1,0,0,0,0|2,0,0]=4 4269 B7R0.4 CONCCC(C)C Amb22058740 [1,1,0,0,0,0|2,0,0]=4 4270 B7R0.4 CS(=O)NCCCO Amb25233860 [1,1,0,0,0,0|2,0,0]=4 4271 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|1,0,1]=4 4272 B7R0.4 CSCCCC(C)N Amb18124381 [1,1,0,0,0,0|2,0,0]=4 4273 B7R0.4 CSCCNC(C)C Amb18523836 [1,1,0,0,0,0|2,0,0]=4 4274 B7R0.4 CSCCSC(C)C Amb25041305 [1,1,0,0,0,0|1,1,0]=4 4275 B7R0.4 C[C@@H](N)CNCCF Amb24534041 [1,1,0,0,0,0|2,0,0]=4 4276 B7R0.4 C[C@@H](O)CCCC#N Amb24556435 [1,1,0,0,0,0|1,0,1]=4 4277 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [1,1,0,0,0,0|0,0,2]=4 4278 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [1,1,0,0,0,0|1,0,0]=3 4279 B7R0.4 C[C@@H](O)CNCCN Amb25689140 [1,1,0,0,0,0|2,0,0]=4 4280 B7R0.4 C[C@@H](O)CSCCO Amb24643786 [1,1,0,0,0,0|0,1,0]=3 4281 B7R0.4 C[C@@H](O)C\C=C\CO Amb25852295 [1,1,0,0,0,0|0,0,2]=4 4282 B7R0.4 C[C@H](N)CSCCO Amb24434353 [1,1,0,0,0,0|0,1,0]=3 4283 B7R0.4 C[C@H](O)CCCC=C Amb24704360 [1,1,0,0,0,0|0,0,2]=4 4284 B7R0.4 C[C@H](O)CCCCCl Amb25715881 [1,1,0,0,0,0|1,0,0]=3 4285 B7R0.4 C[C@H](O)CNCCN Amb25777107 [1,1,0,0,0,0|2,0,0]=4 4286 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [1,1,0,0,0,0|1,0,1]=4 4287 B7R0.4 C\C=C/CC[C@H](C)N Amb24617340 [1,1,0,0,0,0|1,0,1]=4 4288 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,1]=4 4289 B7R0.4 C\C=C\OCC(C)O Amb24475190 [1,1,0,0,0,0|0,0,2]=4 4290 B7R0.4 ClC(Cl)CCCCBr Amb24567653 [1,1,0,0,0,0|2,0,0]=4 4291 B7R0.4 ClCCCCC(Cl)Cl Amb25238318 [1,1,0,0,0,0|2,0,0]=4 4292 B7R0.4 ClCCCCN(C)C Amb17334150 [1,1,0,0,0,0|2,0,0]=4 4293 B7R0.4 ClCCNCC(C)C Amb17334145 [1,1,0,0,0,0|2,0,0]=4 4294 B7R0.4 FC(F)CCCCBr Amb24693913 [1,1,0,0,0,0|2,0,0]=4 4295 B7R0.4 FC(F)COCCCl Amb22008152 [1,1,0,0,0,0|2,0,0]=4 4296 B7R0.4 NCCCCC(N)O Amb24333310 [1,1,0,0,0,0|1,0,0]=3 4297 B7R0.4 NCCCCC(O)C Amb17569903 [1,1,0,0,0,0|1,0,0]=3 4298 B7R0.4 NCCCCP(O)=O Amb24520720 [1,1,0,0,0,0|2,0,0]=4 4299 B7R0.4 NCCCCS(=O)C Amb17617794 [1,1,0,0,0,0|2,0,0]=4 4300 B7R0.4 NCCCOP(O)O Amb24745951 [1,1,0,0,0,0|2,0,0]=4 4301 B7R0.4 NCCCSC(C)C Amb10075505 [1,1,0,0,0,0|1,1,0]=4 4302 B7R0.4 NCCNCC(C)C Amb17091016 [1,1,0,0,0,0|2,0,0]=4 4303 B7R0.4 NCCOCC(C)C Amb10609251 [1,1,0,0,0,0|1,0,0]=3 4304 B7R0.4 NCCOCC(F)F Amb25805499 [1,1,0,0,0,0|2,0,0]=4 4305 B7R0.4 NCCOCC(O)=O Amb18630146 [1,1,0,0,0,0|1,0,1]=4 4306 B7R0.4 NCCOCC(O)=O Amb22751540 [1,1,0,0,0,0|1,0,1]=4 4307 B7R0.4 OB(O)CCCCBr Amb20171450 [1,1,0,0,0,0|2,0,0]=4 4308 B7R0.4 OB(O)CCCCCl Amb25184744 [1,1,0,0,0,0|2,0,0]=4 4309 B7R0.4 OC(=O)COCCBr Amb24057760 [1,1,0,0,0,0|1,0,1]=4 4310 B7R0.4 OC(=O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,1]=4 4311 B7R0.4 OCCCCB(O)O Amb25351122 [1,1,0,0,0,0|2,0,0]=4 4312 B7R0.4 OCCCCC(=O)C Amb10603864 [1,1,0,0,0,0|0,0,1]=3 4313 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [1,1,0,0,0,0|1,0,1]=4 4314 B7R0.4 OCCCCC(N)C Amb17569907 [1,1,0,0,0,0|0,0,0]=2 4315 B7R0.4 OCCCCC(O)=O Amb22351244 [1,1,0,0,0,0|1,0,1]=4 4316 B7R0.4 OCCCCC(O)O Amb25204642 [1,1,0,0,0,0|1,0,0]=3 4317 B7R0.4 OCCCCN(Cl)Cl Amb25071515 [1,1,0,0,0,0|2,0,0]=4 4318 B7R0.4 OCCCC[C@H](O)C Amb10605245 [1,1,0,0,0,0|0,0,0]=2 4319 B7R0.4 OCCCOC(C)C Amb10608350 [1,1,0,0,0,0|1,0,0]=3 4320 B7R0.4 OCCCOP(O)O Amb24643367 [1,1,0,0,0,0|2,0,0]=4 4321 B7R0.4 OCCCSC(C)C Amb17502841 [1,1,0,0,0,0|1,0,0]=3 4322 B7R0.4 OCCNCC(F)F Amb24398313 [1,1,0,0,0,0|2,0,0]=4 4323 B7R0.4 OCCOCC(F)F Amb22008072 [1,1,0,0,0,0|1,0,0]=3 4324 B7R0.4 OCCOCC(O)O Amb24412995 [1,1,0,0,0,0|1,0,0]=3 4325 B7R0.4 OCCSCC(F)F Amb24758258 [1,1,0,0,0,0|1,1,0]=4 4326 B7R0.4 OP(=O)OCCCCl Amb24562481 [1,1,0,0,0,0|2,0,0]=4 4327 B7R0.4 SCCCCC(=O)O Amb17503767 [1,1,0,0,0,0|1,0,1]=4 4328 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [1,1,0,0,0,0|1,0,1]=4 4329 B7R0.4 [O-][N+](=O)CCCCO Amb25739830 [1,1,0,0,0,0|2,0,0]=4 4330 B7R0.4 [O-][N+](=O)OCCCC Amb17610378 [1,1,0,0,0,0|1,0,1]=4 4331 B7R0.4 [S-]C(=S)OCCCC Amb16186572 [1,1,0,0,0,0|0,1,1]=4 4332 B7R0.7 BrC(CCBr)CCBr Amb24564763 [1,1,0,0,0,0|2,0,0]=4 4333 B7R0.7 C=C(CCO)CCO Amb25371349 [1,1,0,0,0,0|1,0,1]=4 4334 B7R0.7 C=CCC(O)CCO Amb24379908 [1,1,0,0,0,0|0,0,2]=4 4335 B7R0.7 C=CC[C@@H](O)CCO Amb25762096 [1,1,0,0,0,0|0,0,2]=4 4336 B7R0.7 C=CC[C@H](N)CCO Amb25138355 [1,1,0,0,0,0|0,0,2]=4 4337 B7R0.7 C=CC[C@H](O)CCO Amb25219225 [1,1,0,0,0,0|0,0,2]=4 4338 B7R0.7 CC#CC(O)CCC Amb24397090 [1,1,0,0,0,0|1,0,1]=4 4339 B7R0.7 CC(CCC)CCC Amb22229829 [1,1,0,0,0,0|1,0,0]=3 4340 B7R0.7 CC(CCI)CCI Amb24483140 [1,1,0,0,0,0|2,0,0]=4 4341 B7R0.7 CC(CCN)CCCl Amb25024312 [1,1,0,0,0,0|2,0,0]=4 4342 B7R0.7 CC(CCN)CCN Amb25138224 [1,1,0,0,0,0|2,0,0]=4 4343 B7R0.7 CC(CCO)CCBr Amb25108054 [1,1,0,0,0,0|1,0,0]=3 4344 B7R0.7 CC(CCO)CCCl Amb24481342 [1,1,0,0,0,0|1,0,0]=3 4345 B7R0.7 CC(CCO)CCI Amb25262818 [1,1,0,0,0,0|1,0,0]=3 4346 B7R0.7 CC(CCO)CCO Amb17939001 [1,1,0,0,0,0|1,0,0]=3 4347 B7R0.7 CCCC(=C)CCC Amb25088297 [1,1,0,0,0,0|1,0,1]=4 4348 B7R0.7 CCCC(=O)CCCl Amb17593421 [1,1,0,0,0,0|1,0,1]=4 4349 B7R0.7 CCCC(=O)CCN Amb25104618 [1,1,0,0,0,0|1,0,1]=4 4350 B7R0.7 CCCC(=O)CCO Amb24482374 [1,1,0,0,0,0|0,0,1]=3 4351 B7R0.7 CCCC(=O)NCO Amb25093050 [1,1,0,0,0,0|1,0,1]=4 4352 B7R0.7 CCCC(=O)OCI Amb24395963 [1,1,0,0,0,0|1,0,1]=4 4353 B7R0.7 CCCC(=O)OCN Amb24426649 [1,1,0,0,0,0|1,0,1]=4 4354 B7R0.7 CCCC(Br)/C=C/C Amb17672603 [1,1,0,0,0,0|1,0,1]=4 4355 B7R0.7 CCCC(Br)CC=C Amb24483087 [1,1,0,0,0,0|1,0,1]=4 4356 B7R0.7 CCCC(Br)CCBr Amb23455635 [1,1,0,0,0,0|1,0,0]=3 4357 B7R0.7 CCCC(Br)COC Amb18184675 [1,1,0,0,0,0|2,0,0]=4 4358 B7R0.7 CCCC(C)CC=O Amb18641815 [1,1,0,0,0,0|0,0,2]=4 4359 B7R0.7 CCCC(C)CC=S Amb22168291 [1,1,0,0,0,0|0,1,1]=4 4360 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,0]=3 4361 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,0]=3 4362 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,0]=2 4363 B7R0.7 CCCC(C)C[Mg]Cl Amb22897342 [1,1,0,0,0,0|2,0,0]=4 4364 B7R0.7 CCCC(C)C[Zn]Cl Amb22897377 [1,1,0,0,0,0|2,0,0]=4 4365 B7R0.7 CCCC(C)NOC Amb25299098 [1,1,0,0,0,0|2,0,0]=4 4366 B7R0.7 CCCC(C)OC=C Amb25069569 [1,1,0,0,0,0|0,0,2]=4 4367 B7R0.7 CCCC(C)OCCl Amb24648760 [1,1,0,0,0,0|1,0,0]=3 4368 B7R0.7 CCCC(C)\C=N\O Amb25335725 [1,1,0,0,0,0|1,0,1]=4 4369 B7R0.7 CCCC(CCC)N Amb1102706 [1,1,0,0,0,0|1,0,0]=3 4370 B7R0.7 CCCC(Cl)CC#C Amb24398029 [1,1,0,0,0,0|1,0,1]=4 4371 B7R0.7 CCCC(Cl)CCCl Amb24481328 [1,1,0,0,0,0|1,0,0]=3 4372 B7R0.7 CCCC(Cl)COC Amb24444031 [1,1,0,0,0,0|2,0,0]=4 4373 B7R0.7 CCCC(F)CCCl Amb25744393 [1,1,0,0,0,0|1,0,0]=3 4374 B7R0.7 CCCC(N)CC#C Amb18296097 [1,1,0,0,0,0|1,0,1]=4 4375 B7R0.7 CCCC(N)CC=C Amb19015526 [1,1,0,0,0,0|1,0,1]=4 4376 B7R0.7 CCCC(N)CCBr Amb24739585 [1,1,0,0,0,0|1,0,0]=3 4377 B7R0.7 CCCC(N)CCCl Amb25290129 [1,1,0,0,0,0|1,0,0]=3 4378 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|0,0,0]=2 4379 B7R0.7 CCCC(N)CCS Amb25084085 [1,1,0,0,0,0|0,1,0]=3 4380 B7R0.7 CCCC(N)CNC Amb19009733 [1,1,0,0,0,0|2,0,0]=4 4381 B7R0.7 CCCC(N)COC Amb18311156 [1,1,0,0,0,0|2,0,0]=4 4382 B7R0.7 CCCC(N)CSC Amb18313615 [1,1,0,0,0,0|2,0,0]=4 4383 B7R0.7 CCCC(O)CC#C Amb17940358 [1,1,0,0,0,0|1,0,1]=4 4384 B7R0.7 CCCC(O)CC#N Amb18641730 [1,1,0,0,0,0|1,0,1]=4 4385 B7R0.7 CCCC(O)CC=O Amb18641890 [1,1,0,0,0,0|0,0,2]=4 4386 B7R0.7 CCCC(O)CCBr Amb24483148 [1,1,0,0,0,0|1,0,0]=3 4387 B7R0.7 CCCC(O)CCCl Amb24481417 [1,1,0,0,0,0|1,0,0]=3 4388 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|1,0,0]=3 4389 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|0,0,0]=2 4390 B7R0.7 CCCC(O)CNC Amb18314672 [1,1,0,0,0,0|2,0,0]=4 4391 B7R0.7 CCCC(O)CSC Amb24729041 [1,1,0,0,0,0|2,0,0]=4 4392 B7R0.7 CCCC(S)CC=O Amb24481552 [1,1,0,0,0,0|0,0,2]=4 4393 B7R0.7 CCCN(C)CCBr Amb18178281 [1,1,0,0,0,0|2,0,0]=4 4394 B7R0.7 CCCN(CCC)N Amb17593208 [1,1,0,0,0,0|2,0,0]=4 4395 B7R0.7 CCCN(CCCl)C Amb17334148 [1,1,0,0,0,0|2,0,0]=4 4396 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|2,0,0]=4 4397 B7R0.7 CCCS(=O)CCN Amb18306029 [1,1,0,0,0,0|1,1,0]=4 4398 B7R0.7 CCC[C@@H](C)CCO Amb24351627 [1,1,0,0,0,0|0,0,0]=2 4399 B7R0.7 CCC[C@@H](N)CC#N Amb24481561 [1,1,0,0,0,0|1,0,1]=4 4400 B7R0.7 CCC[C@@H](N)CC=C Amb25324586 [1,1,0,0,0,0|1,0,1]=4 4401 B7R0.7 CCC[C@@H](N)CCBr Amb24651964 [1,1,0,0,0,0|1,0,0]=3 4402 B7R0.7 CCC[C@@H](N)CCCl Amb25287301 [1,1,0,0,0,0|1,0,0]=3 4403 B7R0.7 CCC[C@@H](N)CCO Amb22745145 [1,1,0,0,0,0|0,0,0]=2 4404 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|0,0,0]=2 4405 B7R0.7 CCC[C@@H](N)CSC Amb25051682 [1,1,0,0,0,0|2,0,0]=4 4406 B7R0.7 CCC[C@@H](O)CC=O Amb25290213 [1,1,0,0,0,0|0,0,2]=4 4407 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|0,0,0]=2 4408 B7R0.7 CCC[C@@H](S)CCO Amb25676566 [1,1,0,0,0,0|0,0,0]=2 4409 B7R0.7 CCC[C@H](C)CC=O Amb24696396 [1,1,0,0,0,0|0,0,2]=4 4410 B7R0.7 CCC[C@H](C)CCCl Amb24481438 [1,1,0,0,0,0|1,0,0]=3 4411 B7R0.7 CCC[C@H](C)CCN Amb25836227 [1,1,0,0,0,0|1,0,0]=3 4412 B7R0.7 CCC[C@H](N)CCBr Amb25724940 [1,1,0,0,0,0|1,0,0]=3 4413 B7R0.7 CCC[C@H](O)CC#N Amb25346246 [1,1,0,0,0,0|1,0,1]=4 4414 B7R0.7 CCC[C@H](O)CCO Amb25058562 [1,1,0,0,0,0|0,0,0]=2 4415 B7R0.7 CCNC(C)CCBr Amb24694482 [1,1,0,0,0,0|2,0,0]=4 4416 B7R0.7 CCNC(C)CCC Amb22586730 [1,1,0,0,0,0|1,0,0]=3 4417 B7R0.7 CCNC(C)CCCl Amb25046377 [1,1,0,0,0,0|2,0,0]=4 4418 B7R0.7 CCNC(C)CCN Amb19030961 [1,1,0,0,0,0|2,0,0]=4 4419 B7R0.7 CCNC(C)CSC Amb18313762 [1,1,0,0,0,0|2,0,0]=4 4420 B7R0.7 CCN[C@@H](C)CCO Amb24333122 [1,1,0,0,0,0|1,0,0]=3 4421 B7R0.7 CCOC(=C)CNC Amb23585493 [1,1,0,0,0,0|1,0,1]=4 4422 B7R0.7 CCOC(=C)OCC Amb10604188 [1,1,0,0,0,0|1,0,1]=4 4423 B7R0.7 CCOC(=N)CCBr Amb20672901 [1,1,0,0,0,0|1,0,1]=4 4424 B7R0.7 CCOC(=N)CCBr Amb25798516 [1,1,0,0,0,0|1,0,1]=4 4425 B7R0.7 CCOC(=N)CCC Amb20672875 [1,1,0,0,0,0|0,0,1]=3 4426 B7R0.7 CCOC(=N)CCC Amb25070806 [1,1,0,0,0,0|0,0,1]=3 4427 B7R0.7 CCOC(=N)CCN Amb25340067 [1,1,0,0,0,0|1,0,1]=4 4428 B7R0.7 CCOC(=N)CNC Amb24529172 [1,1,0,0,0,0|1,0,1]=4 4429 B7R0.7 CCOC(=N)CSC Amb24549720 [1,1,0,0,0,0|1,0,1]=4 4430 B7R0.7 CCOC(=O)CCF Amb22492835 [1,1,0,0,0,0|1,0,1]=4 4431 B7R0.7 CCOC(=O)CCI Amb19957952 [1,1,0,0,0,0|1,0,1]=4 4432 B7R0.7 CCOC(=O)CCS Amb20620159 [1,1,0,0,0,0|1,0,1]=4 4433 B7R0.7 CCOC(=O)CC[NH3+] Amb24113699 [1,1,0,0,0,0|1,0,1]=4 4434 B7R0.7 CCOC(=S)CCC Amb22168045 [1,1,0,0,0,0|0,0,1]=3 4435 B7R0.7 CCOC(=S)NCC Amb24697709 [1,1,0,0,0,0|1,0,1]=4 4436 B7R0.7 CCOC(=S)SCC Amb17939407 [1,1,0,0,0,0|1,0,1]=4 4437 B7R0.7 CCOC(C)CC=O Amb25702447 [1,1,0,0,0,0|1,0,1]=4 4438 B7R0.7 CCOC(C)CCC Amb22733741 [1,1,0,0,0,0|0,0,0]=2 4439 B7R0.7 CCOC(C)CCCl Amb24472887 [1,1,0,0,0,0|1,0,0]=3 4440 B7R0.7 CCOC(C)CNN Amb24436336 [1,1,0,0,0,0|2,0,0]=4 4441 B7R0.7 CCOC(Cl)CCC Amb24334118 [1,1,0,0,0,0|0,0,0]=2 4442 B7R0.7 CCOC(Cl)CCCl Amb25834723 [1,1,0,0,0,0|1,0,0]=3 4443 B7R0.7 CCOC(Cl)CSC Amb25321920 [1,1,0,0,0,0|1,0,0]=3 4444 B7R0.7 CCOC(O)CNC Amb24693762 [1,1,0,0,0,0|1,0,0]=3 4445 B7R0.7 CCOP(=O)CCBr Amb25680012 [1,1,0,0,0,0|2,0,0]=4 4446 B7R0.7 CCOP(O)OCC Amb17938598 [1,1,0,0,0,0|2,0,0]=4 4447 B7R0.7 CCOP([O-])OCC Amb22230549 [1,1,0,0,0,0|2,0,0]=4 4448 B7R0.7 CCOS(=O)CCBr Amb24713641 [1,1,0,0,0,0|2,0,0]=4 4449 B7R0.7 CCO[C@@H](C)CCO Amb24619159 [1,1,0,0,0,0|1,0,0]=3 4450 B7R0.7 CCO[C@H](C)CCO Amb25065482 [1,1,0,0,0,0|1,0,0]=3 4451 B7R0.7 CCSC(C)CCN Amb18306010 [1,1,0,0,0,0|1,1,0]=4 4452 B7R0.7 CCSC(C)CNC Amb19025498 [1,1,0,0,0,0|1,1,0]=4 4453 B7R0.7 CCSC(C)COC Amb25805617 [1,1,0,0,0,0|1,1,0]=4 4454 B7R0.7 CCSC(Cl)CCC Amb25107901 [1,1,0,0,0,0|0,1,0]=3 4455 B7R0.7 CCSC(Cl)SCC Amb25779875 [1,1,0,0,0,0|1,1,0]=4 4456 B7R0.7 CC\C=C(/C)\CCC Amb22641686 [1,1,0,0,0,0|1,0,1]=4 4457 B7R0.7 CN(CCO)CCBr Amb18179238 [1,1,0,0,0,0|2,0,0]=4 4458 B7R0.7 CN(CCO)CCCl Amb24101948 [1,1,0,0,0,0|2,0,0]=4 4459 B7R0.7 CNCC(C)CCCl Amb25359085 [1,1,0,0,0,0|2,0,0]=4 4460 B7R0.7 CNCC(C)NCC Amb19022873 [1,1,0,0,0,0|2,0,0]=4 4461 B7R0.7 CNCC(CCN)C Amb17334067 [1,1,0,0,0,0|2,0,0]=4 4462 B7R0.7 CNCC(CCO)C Amb17569901 [1,1,0,0,0,0|1,0,0]=3 4463 B7R0.7 CNCC(O)CCN Amb18559793 [1,1,0,0,0,0|2,0,0]=4 4464 B7R0.7 CNCC(OCC)C Amb10608191 [1,1,0,0,0,0|1,0,0]=3 4465 B7R0.7 COCC(=N)OCC Amb23504134 [1,1,0,0,0,0|1,0,1]=4 4466 B7R0.7 COCC(Br)CCBr Amb23456164 [1,1,0,0,0,0|2,0,0]=4 4467 B7R0.7 COCC(Br)CCO Amb25286452 [1,1,0,0,0,0|1,0,0]=3 4468 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|1,0,0]=3 4469 B7R0.7 COCC(CCN)C Amb17569914 [1,1,0,0,0,0|2,0,0]=4 4470 B7R0.7 COCC(Cl)CCCl Amb24392625 [1,1,0,0,0,0|2,0,0]=4 4471 B7R0.7 COCC(N)CCBr Amb24706241 [1,1,0,0,0,0|2,0,0]=4 4472 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|1,0,0]=3 4473 B7R0.7 COCC(O)CCCl Amb25314601 [1,1,0,0,0,0|2,0,0]=4 4474 B7R0.7 COCC(O)CCN Amb18203347 [1,1,0,0,0,0|2,0,0]=4 4475 B7R0.7 COCC(O)CCO Amb23512858 [1,1,0,0,0,0|1,0,0]=3 4476 B7R0.7 COC[C@@H](O)CCN Amb24474146 [1,1,0,0,0,0|2,0,0]=4 4477 B7R0.7 COC[C@@H](O)CCO Amb25086103 [1,1,0,0,0,0|1,0,0]=3 4478 B7R0.7 CP(CCC)CCC Amb22731330 [1,1,0,0,0,0|2,0,0]=4 4479 B7R0.7 CSCC(N)CCN Amb25738000 [1,1,0,0,0,0|2,0,0]=4 4480 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|1,0,0]=3 4481 B7R0.7 CSCC(O)CCN Amb25078322 [1,1,0,0,0,0|2,0,0]=4 4482 B7R0.7 CSC[C@H](N)CCN Amb25214681 [1,1,0,0,0,0|2,0,0]=4 4483 B7R0.7 C[C+](OCC)OCC Amb25365007 [1,1,0,0,0,0|1,0,1]=4 4484 B7R0.7 C[C@@H](CCO)CC#C Amb25788479 [1,1,0,0,0,0|0,0,2]=4 4485 B7R0.7 C[C@@H](CCO)CC=C Amb25332119 [1,1,0,0,0,0|0,0,2]=4 4486 B7R0.7 C[C@@H](CCO)CCBr Amb24662335 [1,1,0,0,0,0|1,0,0]=3 4487 B7R0.7 C[C@H](CCO)CC=C Amb24575596 [1,1,0,0,0,0|0,0,2]=4 4488 B7R0.7 C\C=C/C(C)CCC Amb22359470 [1,1,0,0,0,0|1,0,1]=4 4489 B7R0.7 C\C=C\C(Cl)OCC Amb25662994 [1,1,0,0,0,0|0,0,2]=4 4490 B7R0.7 C\C=C\[C@@H](Cl)CCC Amb24736621 [1,1,0,0,0,0|1,0,1]=4 4491 B7R0.7 C\C=C\[C@@H](O)CCC Amb25145389 [1,1,0,0,0,0|1,0,1]=4 4492 B7R0.7 C\C=C\[C@H](Cl)CCC Amb24483246 [1,1,0,0,0,0|1,0,1]=4 4493 B7R0.7 C\C=C\[C@H](O)CCC Amb25045794 [1,1,0,0,0,0|1,0,1]=4 4494 B7R0.7 ClCCC(CCCl)N Amb17593888 [1,1,0,0,0,0|2,0,0]=4 4495 B7R0.7 N#CCC(O)CCO Amb25260090 [1,1,0,0,0,0|1,0,1]=4 4496 B7R0.7 N=S(CCO)CCO Amb25206594 [1,1,0,0,0,0|1,1,0]=4 4497 B7R0.7 NC(CCN)CCN Amb18641937 [1,1,0,0,0,0|2,0,0]=4 4498 B7R0.7 NC(CCO)CCO Amb22491262 [1,1,0,0,0,0|1,0,0]=3 4499 B7R0.7 NC(CCO)CCO Amb25324048 [1,1,0,0,0,0|1,0,0]=3 4500 B7R0.7 NCCC(CCO)C Amb17569905 [1,1,0,0,0,0|1,0,0]=3 4501 B7R0.7 NCCC(F)CCN Amb24550687 [1,1,0,0,0,0|2,0,0]=4 4502 B7R0.7 NCCC(S)CCN Amb24565907 [1,1,0,0,0,0|2,0,0]=4 4503 B7R0.7 NCCN(CCO)C Amb10608118 [1,1,0,0,0,0|2,0,0]=4 4504 B7R0.7 OC(CCCl)CCCl Amb24481496 [1,1,0,0,0,0|2,0,0]=4 4505 B7R0.7 OCCC(=O)CCCl Amb24410034 [1,1,0,0,0,0|1,0,1]=4 4506 B7R0.7 OCCC(=O)CCO Amb22002370 [1,1,0,0,0,0|1,0,1]=4 4507 B7R0.7 OCCC(=O)NCC Amb17334068 [1,1,0,0,0,0|1,0,1]=4 4508 B7R0.7 OCCC(CCO)O Amb17593226 [1,1,0,0,0,0|1,0,0]=3 4509 B7R0.7 OCCN(CCO)N Amb17593230 [1,1,0,0,0,0|2,0,0]=4 4510 B7R0.7 OCCN(Cl)CCO Amb25085296 [1,1,0,0,0,0|2,0,0]=4 4511 B7R0.7 OCCS(=O)CCCl Amb25104843 [1,1,0,0,0,0|1,1,0]=4 4512 B7R0.7 OCCS(=O)CCO Amb1039000 [1,1,0,0,0,0|1,1,0]=4 4513 B7R0.7 [13CH3][13CH2]O[13C](=O)O[13CH2][13CH3] Amb22354006 [1,1,0,0,0,0|1,0,1]=4 4514 B9R0.4 CC(=C)CC(O)CCCO Amb25825831 [0,2,0,0,0,0|1,0,1]=4 4515 B9R0.4 CC(=C)C[C@@H](O)CCCO Amb25306276 [0,2,0,0,0,0|1,0,1]=4 4516 B9R0.4 CC(=O)CC(=O)OCCO Amb24620465 [0,2,0,0,0,0|0,0,2]=4 4517 B9R0.4 CC(C)CC(=O)OCCCl Amb24065568 [0,2,0,0,0,0|1,0,1]=4 4518 B9R0.4 CC(C)CC(=O)OCCF Amb25346397 [0,2,0,0,0,0|1,0,1]=4 4519 B9R0.4 CC(C)CC(Br)CCCC Amb24678300 [0,2,0,0,0,0|2,0,0]=4 4520 B9R0.4 CC(C)CC(C)=CCCO Amb24684269 [0,2,0,0,0,0|1,0,1]=4 4521 B9R0.4 CC(C)CC(C)=NCCO Amb25846281 [0,2,0,0,0,0|1,0,1]=4 4522 B9R0.4 CC(C)CC(C)CCCBr Amb24064688 [0,2,0,0,0,0|2,0,0]=4 4523 B9R0.4 CC(C)CC(C)CCCCl Amb24432723 [0,2,0,0,0,0|2,0,0]=4 4524 B9R0.4 CC(C)CC(C)CCCO Amb22641875 [0,2,0,0,0,0|1,0,0]=3 4525 B9R0.4 CC(C)CC(C)NCCBr Amb24692300 [0,2,0,0,0,0|2,0,0]=4 4526 B9R0.4 CC(C)CC(C)OCCO Amb25060341 [0,2,0,0,0,0|0,0,0]=2 4527 B9R0.4 CC(C)CC(C)OCCS Amb24523158 [0,2,0,0,0,0|0,1,0]=3 4528 B9R0.4 CC(C)CC(C)SCCCl Amb24571605 [0,2,0,0,0,0|1,1,0]=4 4529 B9R0.4 CC(C)CC(C)SCCO Amb25185336 [0,2,0,0,0,0|0,1,0]=3 4530 B9R0.4 CC(C)CC(C)\C=C\CO Amb24479364 [0,2,0,0,0,0|1,0,1]=4 4531 B9R0.4 CC(C)CC(N)\C=C\CO Amb24515057 [0,2,0,0,0,0|1,0,1]=4 4532 B9R0.4 CC(C)CC(O)CCCC Amb22734801 [0,2,0,0,0,0|2,0,0]=4 4533 B9R0.4 CC(C)CC(O)\C=C\CO Amb25129762 [0,2,0,0,0,0|1,0,1]=4 4534 B9R0.4 CC(C)C[C@H](N)CCCC Amb24543788 [0,2,0,0,0,0|2,0,0]=4 4535 B9R0.4 CC(C)C[C@H](N)\C=C\CO Amb25147523 [0,2,0,0,0,0|1,0,1]=4 4536 B9R0.4 CC(C)NC(C)CCCO Amb25337469 [0,2,0,0,0,0|2,0,0]=4 4537 B9R0.4 CC(C)OC(=O)OCCO Amb24481292 [0,2,0,0,0,0|1,0,1]=4 4538 B9R0.4 CC(C)OC(C)OCCCl Amb25808584 [0,2,0,0,0,0|2,0,0]=4 4539 B9R0.4 CC(C=C(C)C)OCCO Amb24623772 [0,2,0,0,0,0|0,0,2]=4 4540 B9R0.4 CC(CC(C)=O)SCCO Amb25777590 [0,2,0,0,0,0|0,1,1]=4 4541 B9R0.4 CC(CC(C)N)SCCO Amb25699801 [0,2,0,0,0,0|0,1,0]=3 4542 B9R0.4 CC(CC(C)O)NCCN Amb25361586 [0,2,0,0,0,0|2,0,0]=4 4543 B9R0.4 CC(CC(C)O)OCC=C Amb25072425 [0,2,0,0,0,0|1,0,1]=4 4544 B9R0.4 CC(CCSC)CC(C)O Amb25662534 [0,2,0,0,0,0|2,0,0]=4 4545 B9R0.4 CC(CN(C)C)OCCN Amb24580531 [0,2,0,0,0,0|2,0,0]=4 4546 B9R0.4 CC(CS(C)=O)NCCO Amb24524661 [0,2,0,0,0,0|2,0,0]=4 4547 B9R0.4 CC(Cl)CC(Cl)OCCC Amb24482260 [0,2,0,0,0,0|1,0,0]=3 4548 B9R0.4 CC(N)CC(=O)NCCO Amb19004136 [0,2,0,0,0,0|1,0,1]=4 4549 B9R0.4 CC(N)CN(C)CCCO Amb24476800 [0,2,0,0,0,0|2,0,0]=4 4550 B9R0.4 CC(N)CS(=O)CCCO Amb25273062 [0,2,0,0,0,0|2,0,0]=4 4551 B9R0.4 CC(O)CC(=O)NCCO Amb25840879 [0,2,0,0,0,0|1,0,1]=4 4552 B9R0.4 CC(O)CC(N)CCOC Amb25718482 [0,2,0,0,0,0|2,0,0]=4 4553 B9R0.4 CC(O)CN(C)CCCCl Amb18798508 [0,2,0,0,0,0|2,0,0]=4 4554 B9R0.4 CC(O)CN(C)CCCI Amb25135973 [0,2,0,0,0,0|2,0,0]=4 4555 B9R0.4 CC(O)CN(C)CCCO Amb25854472 [0,2,0,0,0,0|2,0,0]=4 4556 B9R0.4 CC(O)CN(C)CCCS Amb24404531 [0,2,0,0,0,0|2,0,0]=4 4557 B9R0.4 CCCCC(=C)CC(O)=O Amb18643896 [0,2,0,0,0,0|1,0,1]=4 4558 B9R0.4 CCCCC(=O)CC(C)C Amb10807381 [0,2,0,0,0,0|2,0,0]=4 4559 B9R0.4 CCCCC(=O)C[C@@H](C)O Amb24752471 [0,2,0,0,0,0|1,0,0]=3 4560 B9R0.4 CCCCC(=O)C[C@H](C)O Amb24582786 [0,2,0,0,0,0|1,0,0]=3 4561 B9R0.4 CCCCC(CC(=O)O)N Amb1993866 [0,2,0,0,0,0|1,0,1]=4 4562 B9R0.4 CCCCC(O)CC(Cl)Cl Amb25765816 [0,2,0,0,0,0|2,0,0]=4 4563 B9R0.4 CCCCC(O)CC(O)=O Amb22388888 [0,2,0,0,0,0|1,0,1]=4 4564 B9R0.4 CCCCN(C)CC(C)Cl Amb24387172 [0,2,0,0,0,0|2,0,0]=4 4565 B9R0.4 CCCCN(C)C[C@@H](C)N Amb18014373 [0,2,0,0,0,0|2,0,0]=4 4566 B9R0.4 CCCCN(C)C[C@@H](C)O Amb25678015 [0,2,0,0,0,0|1,0,0]=3 4567 B9R0.4 CCCCN(CC(O)C)C Amb17138401 [0,2,0,0,0,0|1,0,0]=3 4568 B9R0.4 CCCCS(=O)CC(C)O Amb25717943 [0,2,0,0,0,0|0,1,0]=3 4569 B9R0.4 CCCCS(=O)CC(O)=O Amb18792577 [0,2,0,0,0,0|0,1,1]=4 4570 B9R0.4 CCCC[C@@H](O)CC(O)=O Amb24350627 [0,2,0,0,0,0|1,0,1]=4 4571 B9R0.4 CCCNC(C)CC(C)Cl Amb24441849 [0,2,0,0,0,0|2,0,0]=4 4572 B9R0.4 CCCNC(C)CC(C)O Amb24365066 [0,2,0,0,0,0|2,0,0]=4 4573 B9R0.4 CCCOC(=O)CC(C)O Amb24733872 [0,2,0,0,0,0|1,0,1]=4 4574 B9R0.4 CCCOC(=O)C[C@@H](C)O Amb25334676 [0,2,0,0,0,0|1,0,1]=4 4575 B9R0.4 CCCOC(C)CC(C)N Amb25206456 [0,2,0,0,0,0|1,0,0]=3 4576 B9R0.4 CCCOC(C)CC(C)O Amb24423186 [0,2,0,0,0,0|1,0,0]=3 4577 B9R0.4 CCCSC(C)CC(C)N Amb24734389 [0,2,0,0,0,0|1,1,0]=4 4578 B9R0.4 CN(C)CC(O)CCCO Amb24466217 [0,2,0,0,0,0|2,0,0]=4 4579 B9R0.4 CNCCN(C)CC(C)O Amb24470451 [0,2,0,0,0,0|2,0,0]=4 4580 B9R0.4 COCCN(C)C[C@H](C)O Amb25320453 [0,2,0,0,0,0|2,0,0]=4 4581 B9R0.4 COCCN(CC(O)C)C Amb17334274 [0,2,0,0,0,0|2,0,0]=4 4582 B9R0.4 COCOC(C)CC(C)O Amb25721585 [0,2,0,0,0,0|2,0,0]=4 4583 B9R0.4 C[C@@H](O)CN(C)CCCF Amb25133880 [0,2,0,0,0,0|2,0,0]=4 4584 B9R0.4 C[C@@H](O)CN(C)CCCO Amb25169391 [0,2,0,0,0,0|2,0,0]=4 4585 B9R0.4 C[C@@H](O)C[C@@H](N)CCCC Amb25234742 [0,2,0,0,0,0|1,0,0]=3 4586 B9R0.4 C[C@H](CC(O)=O)OCCO Amb24713383 [0,2,0,0,0,0|1,0,1]=4 4587 B9R0.4 C[C@H](C[C@@H](C)O)OCC=C Amb24475147 [0,2,0,0,0,0|1,0,1]=4 4588 B9R0.4 C[C@H](O)CN(C)CCCF Amb24509210 [0,2,0,0,0,0|2,0,0]=4 4589 B9R0.4 C[C@H](O)C[C@H](O)CCCC Amb25284375 [0,2,0,0,0,0|1,0,0]=3 4590 B9R0.4 NCCOC(OC(C)C)C Amb17593675 [0,2,0,0,0,0|2,0,0]=4 4591 B9R0.5 C=C(CCO)CCCC=O Amb25134080 [0,2,0,0,0,0|1,0,1]=4 4592 B9R0.5 C=CCC(N)CCCCO Amb24409650 [0,2,0,0,0,0|1,0,1]=4 4593 B9R0.5 C=CCCC[C@@H](O)CCO Amb25332179 [0,2,0,0,0,0|1,0,1]=4 4594 B9R0.5 C=CCCC[C@H](O)CCO Amb25344991 [0,2,0,0,0,0|1,0,1]=4 4595 B9R0.5 C=CC[C@@H](N)CCCCO Amb24674311 [0,2,0,0,0,0|1,0,1]=4 4596 B9R0.5 C=CC[C@H](O)CCCCO Amb25294886 [0,2,0,0,0,0|1,0,1]=4 4597 B9R0.5 CC#CCCC(C)CCO Amb25802046 [0,2,0,0,0,0|1,0,1]=4 4598 B9R0.5 CC#CCCN(C)CCO Amb24418599 [0,2,0,0,0,0|1,0,1]=4 4599 B9R0.5 CC#CCC[C@H](C)CCO Amb25308270 [0,2,0,0,0,0|1,0,1]=4 4600 B9R0.5 CC(CC#N)NOCCO Amb25822888 [0,2,0,0,0,0|1,0,1]=4 4601 B9R0.5 CC(CCC)NOCCC Amb24648723 [0,2,0,0,0,0|1,0,0]=3 4602 B9R0.5 CC(CCCCO)CC#C Amb24748469 [0,2,0,0,0,0|1,0,1]=4 4603 B9R0.5 CC(CCN)CCCCN Amb25298607 [0,2,0,0,0,0|2,0,0]=4 4604 B9R0.5 CC(CCN)CNCCF Amb25796658 [0,2,0,0,0,0|2,0,0]=4 4605 B9R0.5 CC(CCN)SCCCO Amb24369139 [0,2,0,0,0,0|1,1,0]=4 4606 B9R0.5 CC(CCO)CCCC#N Amb25221418 [0,2,0,0,0,0|1,0,1]=4 4607 B9R0.5 CC(CCO)CCCCN Amb24375720 [0,2,0,0,0,0|1,0,0]=3 4608 B9R0.5 CC(CCO)CCCCO Amb24576535 [0,2,0,0,0,0|1,0,0]=3 4609 B9R0.5 CC(CCO)CNCCF Amb25825678 [0,2,0,0,0,0|2,0,0]=4 4610 B9R0.5 CC(CCO)SCCCF Amb25117794 [0,2,0,0,0,0|1,1,0]=4 4611 B9R0.5 CC(CNCCC)NCC Amb25687318 [0,2,0,0,0,0|2,0,0]=4 4612 B9R0.5 CC(COC)SCCOC Amb24482767 [0,2,0,0,0,0|1,1,0]=4 4613 B9R0.5 CCCC(=N)NCCCC Amb25821725 [0,2,0,0,0,0|2,0,0]=4 4614 B9R0.5 CCCC(=N)NCCOC Amb24627660 [0,2,0,0,0,0|1,0,1]=4 4615 B9R0.5 CCCC(=O)CCCCBr Amb25844585 [0,2,0,0,0,0|2,0,0]=4 4616 B9R0.5 CCCC(=O)CCCCCl Amb25777036 [0,2,0,0,0,0|2,0,0]=4 4617 B9R0.5 CCCC(=O)CCCCF Amb24462311 [0,2,0,0,0,0|2,0,0]=4 4618 B9R0.5 CCCC(=O)CCCNC Amb24400968 [0,2,0,0,0,0|2,0,0]=4 4619 B9R0.5 CCCC(=O)CCNCC Amb24568186 [0,2,0,0,0,0|2,0,0]=4 4620 B9R0.5 CCCC(=O)CCOCC Amb25203937 [0,2,0,0,0,0|2,0,0]=4 4621 B9R0.5 CCCC(=O)CSCCN Amb24525398 [0,2,0,0,0,0|1,1,0]=4 4622 B9R0.5 CCCC(=O)CSCCO Amb18800667 [0,2,0,0,0,0|0,1,0]=3 4623 B9R0.5 CCCC(=O)NCCOC Amb17738051 [0,2,0,0,0,0|1,0,1]=4 4624 B9R0.5 CCCC(=O)NCCON Amb17138407 [0,2,0,0,0,0|1,0,1]=4 4625 B9R0.5 CCCC(=O)OCCC#N Amb18643713 [0,2,0,0,0,0|1,0,1]=4 4626 B9R0.5 CCCC(=O)OCCC=C Amb25783096 [0,2,0,0,0,0|1,0,1]=4 4627 B9R0.5 CCCC(=O)OCCCCl Amb24411552 [0,2,0,0,0,0|1,0,1]=4 4628 B9R0.5 CCCC(=O)OCCCF Amb22008203 [0,2,0,0,0,0|1,0,1]=4 4629 B9R0.5 CCCC(=O)OCCSC Amb24719191 [0,2,0,0,0,0|0,1,1]=4 4630 B9R0.5 CCCC(Br)CCCC=C Amb25353402 [0,2,0,0,0,0|2,0,0]=4 4631 B9R0.5 CCCC(Br)CCCSC Amb24353192 [0,2,0,0,0,0|1,1,0]=4 4632 B9R0.5 CCCC(C)=NNCCO Amb25318594 [0,2,0,0,0,0|1,0,1]=4 4633 B9R0.5 CCCC(C)CCCNC Amb24443912 [0,2,0,0,0,0|2,0,0]=4 4634 B9R0.5 CCCC(C)CNCCF Amb25316596 [0,2,0,0,0,0|2,0,0]=4 4635 B9R0.5 CCCC(C)CNCCI Amb25041205 [0,2,0,0,0,0|2,0,0]=4 4636 B9R0.5 CCCC(C)COCC#N Amb25133192 [0,2,0,0,0,0|1,0,1]=4 4637 B9R0.5 CCCC(C)COCC=O Amb24385363 [0,2,0,0,0,0|0,0,2]=4 4638 B9R0.5 CCCC(C)COCCS Amb24731934 [0,2,0,0,0,0|0,1,0]=3 4639 B9R0.5 CCCC(C)CSCCN Amb18800593 [0,2,0,0,0,0|1,1,0]=4 4640 B9R0.5 CCCC(C)CSCCO Amb18800677 [0,2,0,0,0,0|0,1,0]=3 4641 B9R0.5 CCCC(C)NCCCCl Amb25089510 [0,2,0,0,0,0|2,0,0]=4 4642 B9R0.5 CCCC(C)NCCCI Amb24389058 [0,2,0,0,0,0|2,0,0]=4 4643 B9R0.5 CCCC(C)NCCCN Amb25114564 [0,2,0,0,0,0|2,0,0]=4 4644 B9R0.5 CCCC(C)NCCSC Amb18800591 [0,2,0,0,0,0|1,1,0]=4 4645 B9R0.5 CCCC(C)NOCC=C Amb24648954 [0,2,0,0,0,0|1,0,1]=4 4646 B9R0.5 CCCC(C)OCCC=O Amb25350992 [0,2,0,0,0,0|0,0,1]=3 4647 B9R0.5 CCCC(C)OCCCO Amb24481041 [0,2,0,0,0,0|0,0,0]=2 4648 B9R0.5 CCCC(C)OCCNC Amb24479700 [0,2,0,0,0,0|1,0,0]=3 4649 B9R0.5 CCCC(C)SCCCN Amb24642940 [0,2,0,0,0,0|1,1,0]=4 4650 B9R0.5 CCCC(C)SCCCO Amb24642524 [0,2,0,0,0,0|0,1,0]=3 4651 B9R0.5 CCCC(C)\C=C\CCCl Amb24388182 [0,2,0,0,0,0|2,0,0]=4 4652 B9R0.5 CCCC(Cl)CCCC#C Amb25343031 [0,2,0,0,0,0|2,0,0]=4 4653 B9R0.5 CCCC(Cl)CCCC=C Amb25825730 [0,2,0,0,0,0|2,0,0]=4 4654 B9R0.5 CCCC(Cl)CCCCO Amb24650906 [0,2,0,0,0,0|1,0,0]=3 4655 B9R0.5 CCCC(Cl)CCCOC Amb18800865 [0,2,0,0,0,0|1,0,0]=3 4656 B9R0.5 CCCC(Cl)CCCSC Amb25146903 [0,2,0,0,0,0|1,1,0]=4 4657 B9R0.5 CCCC(Cl)CNCCF Amb25780392 [0,2,0,0,0,0|2,0,0]=4 4658 B9R0.5 CCCC(Cl)OCCCC Amb24693889 [0,2,0,0,0,0|1,0,0]=3 4659 B9R0.5 CCCC(N)=NOCCO Amb25108359 [0,2,0,0,0,0|0,0,1]=3 4660 B9R0.5 CCCC(N)CCCCO Amb24479142 [0,2,0,0,0,0|1,0,0]=3 4661 B9R0.5 CCCC(N)CCNCC Amb25826848 [0,2,0,0,0,0|2,0,0]=4 4662 B9R0.5 CCCC(O)CCCC#N Amb18643761 [0,2,0,0,0,0|2,0,0]=4 4663 B9R0.5 CCCC(O)CCCC=C Amb25702466 [0,2,0,0,0,0|2,0,0]=4 4664 B9R0.5 CCCC(O)CCCCCl Amb25256825 [0,2,0,0,0,0|2,0,0]=4 4665 B9R0.5 CCCC(O)CCCOC Amb17939244 [0,2,0,0,0,0|1,0,0]=3 4666 B9R0.5 CCCC(O)CCSCC Amb24389386 [0,2,0,0,0,0|2,0,0]=4 4667 B9R0.5 CCCC(O)CNCCF Amb24419715 [0,2,0,0,0,0|2,0,0]=4 4668 B9R0.5 CCCC(O)CNCCN Amb25252461 [0,2,0,0,0,0|2,0,0]=4 4669 B9R0.5 CCCC(O)CNCCO Amb25328361 [0,2,0,0,0,0|1,0,0]=3 4670 B9R0.5 CCCC(O)COCCCl Amb24415283 [0,2,0,0,0,0|1,0,0]=3 4671 B9R0.5 CCCCCC(=C)CCO Amb25802346 [0,2,0,0,0,0|1,0,0]=3 4672 B9R0.5 CCCCCC(=O)CCN Amb25061132 [0,2,0,0,0,0|2,0,0]=4 4673 B9R0.5 CCCCCC(=O)NCO Amb24478944 [0,2,0,0,0,0|1,0,1]=4 4674 B9R0.5 CCCCCC(C)=CCO Amb24704431 [0,2,0,0,0,0|1,0,1]=4 4675 B9R0.5 CCCCCC(C)CC=C Amb25744101 [0,2,0,0,0,0|2,0,0]=4 4676 B9R0.5 CCCCCC(C)CC=O Amb21953169 [0,2,0,0,0,0|1,0,1]=4 4677 B9R0.5 CCCCCC(C)CCN Amb24738346 [0,2,0,0,0,0|2,0,0]=4 4678 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|1,0,0]=3 4679 B9R0.5 CCCCCC(C)CNC Amb24477939 [0,2,0,0,0,0|2,0,0]=4 4680 B9R0.5 CCCCCC(C)C[Mg]Br Amb22897331 [0,2,0,0,0,0|2,0,0]=4 4681 B9R0.5 CCCCCC(C)C[Zn]Br Amb22897834 [0,2,0,0,0,0|2,0,0]=4 4682 B9R0.5 CCCCCC(C)NOC Amb24636619 [0,2,0,0,0,0|2,0,0]=4 4683 B9R0.5 CCCCCC(Cl)C=NO Amb25361059 [0,2,0,0,0,0|1,0,1]=4 4684 B9R0.5 CCCCCC(Cl)CC#N Amb24429181 [0,2,0,0,0,0|2,0,0]=4 4685 B9R0.5 CCCCCC(Cl)CCS Amb24390339 [0,2,0,0,0,0|1,1,0]=4 4686 B9R0.5 CCCCCC(Cl)CN=O Amb25835529 [0,2,0,0,0,0|1,0,1]=4 4687 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|1,0,0]=3 4688 B9R0.5 CCCCCC(Cl)OCC Amb25298178 [0,2,0,0,0,0|2,0,0]=4 4689 B9R0.5 CCCCCC(F)CCN Amb24384525 [0,2,0,0,0,0|2,0,0]=4 4690 B9R0.5 CCCCCC(N)CC#C Amb25689901 [0,2,0,0,0,0|2,0,0]=4 4691 B9R0.5 CCCCCC(N)CC=C Amb24480685 [0,2,0,0,0,0|2,0,0]=4 4692 B9R0.5 CCCCCC(N)CSC Amb18798072 [0,2,0,0,0,0|1,1,0]=4 4693 B9R0.5 CCCCCC(O)C=NO Amb24473413 [0,2,0,0,0,0|1,0,1]=4 4694 B9R0.5 CCCCCC(O)CC#C Amb25233899 [0,2,0,0,0,0|2,0,0]=4 4695 B9R0.5 CCCCCC(O)CC#N Amb18643749 [0,2,0,0,0,0|2,0,0]=4 4696 B9R0.5 CCCCCC(O)CCBr Amb24350551 [0,2,0,0,0,0|2,0,0]=4 4697 B9R0.5 CCCCCC(O)CCCl Amb24674167 [0,2,0,0,0,0|2,0,0]=4 4698 B9R0.5 CCCCCC(O)CCN Amb24730197 [0,2,0,0,0,0|2,0,0]=4 4699 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|1,0,0]=3 4700 B9R0.5 CCCCCC(O)COC Amb24442432 [0,2,0,0,0,0|1,0,0]=3 4701 B9R0.5 CCCCCC(O)CSC Amb18798165 [0,2,0,0,0,0|1,1,0]=4 4702 B9R0.5 CCCCCC(S)CCO Amb24466226 [0,2,0,0,0,0|1,0,0]=3 4703 B9R0.5 CCCCCN(C)CCBr Amb24478090 [0,2,0,0,0,0|2,0,0]=4 4704 B9R0.5 CCCCCN(CCCl)C Amb17334595 [0,2,0,0,0,0|2,0,0]=4 4705 B9R0.5 CCCCCS(=O)CCO Amb25071794 [0,2,0,0,0,0|0,1,0]=3 4706 B9R0.5 CCCCC[C@@H](C)CCO Amb25283200 [0,2,0,0,0,0|1,0,0]=3 4707 B9R0.5 CCCCC[C@@H](N)CCO Amb25147424 [0,2,0,0,0,0|1,0,0]=3 4708 B9R0.5 CCCCC[C@@H](O)CC#N Amb25357522 [0,2,0,0,0,0|2,0,0]=4 4709 B9R0.5 CCCCC[C@@H](O)CC=O Amb24680284 [0,2,0,0,0,0|1,0,1]=4 4710 B9R0.5 CCCCC[C@@H](O)COC Amb24379950 [0,2,0,0,0,0|1,0,0]=3 4711 B9R0.5 CCCCC[C@H](C)CCN Amb25147639 [0,2,0,0,0,0|2,0,0]=4 4712 B9R0.5 CCCCC[C@H](O)CC#C Amb25044619 [0,2,0,0,0,0|2,0,0]=4 4713 B9R0.5 CCCCC[C@H](O)CCO Amb25028003 [0,2,0,0,0,0|1,0,0]=3 4714 B9R0.5 CCCCC[C@H](O)COC Amb25801365 [0,2,0,0,0,0|1,0,0]=3 4715 B9R0.5 CCCCNC(=O)CCBr Amb17330970 [0,2,0,0,0,0|2,0,0]=4 4716 B9R0.5 CCCCNC(=O)CCN Amb21958196 [0,2,0,0,0,0|2,0,0]=4 4717 B9R0.5 CCCCNC(=O)CCO Amb17334238 [0,2,0,0,0,0|1,0,0]=3 4718 B9R0.5 CCCCNC(=O)CCS Amb24354823 [0,2,0,0,0,0|1,1,0]=4 4719 B9R0.5 CCCCNC(=O)COC Amb23247497 [0,2,0,0,0,0|1,0,1]=4 4720 B9R0.5 CCCCNC(=O)CON Amb25683647 [0,2,0,0,0,0|1,0,1]=4 4721 B9R0.5 CCCCNC(C)CC=C Amb24392479 [0,2,0,0,0,0|2,0,0]=4 4722 B9R0.5 CCCCNC(C)CCCl Amb25223010 [0,2,0,0,0,0|2,0,0]=4 4723 B9R0.5 CCCCNC(C)CCN Amb20090513 [0,2,0,0,0,0|2,0,0]=4 4724 B9R0.5 CCCCNC(CC#N)C Amb17334181 [0,2,0,0,0,0|2,0,0]=4 4725 B9R0.5 CCCCOC(=N)CCBr Amb24640981 [0,2,0,0,0,0|1,0,0]=3 4726 B9R0.5 CCCCOC(=O)CC=O Amb24722099 [0,2,0,0,0,0|0,0,2]=4 4727 B9R0.5 CCCCOC(=O)CCBr Amb25301954 [0,2,0,0,0,0|1,0,0]=3 4728 B9R0.5 CCCCOC(=O)CON Amb25691107 [0,2,0,0,0,0|0,0,1]=3 4729 B9R0.5 CCCCOC(=O)CSC Amb18798147 [0,2,0,0,0,0|0,1,1]=4 4730 B9R0.5 CCCCOC(=O)NCCl Amb25831087 [0,2,0,0,0,0|1,0,1]=4 4731 B9R0.5 CCCCOC(=S)SCCl Amb25363150 [0,2,0,0,0,0|1,0,1]=4 4732 B9R0.5 CCCCOC(C)CCO Amb25722742 [0,2,0,0,0,0|0,0,0]=2 4733 B9R0.5 CCCCOC(C)CNC Amb24591958 [0,2,0,0,0,0|1,0,0]=3 4734 B9R0.5 CCCCOC(C)N=C=O Amb24477302 [0,2,0,0,0,0|0,0,2]=4 4735 B9R0.5 CCCCOS(=O)CCCl Amb24415401 [0,2,0,0,0,0|1,0,0]=3 4736 B9R0.5 CCCCSC(C)CC#N Amb18178144 [0,2,0,0,0,0|1,1,0]=4 4737 B9R0.5 CCCCSC(C)CC=O Amb25233529 [0,2,0,0,0,0|0,1,1]=4 4738 B9R0.5 CCCCSC(C)CNC Amb18798062 [0,2,0,0,0,0|1,1,0]=4 4739 B9R0.5 CCCN(C)CCCCBr Amb24478089 [0,2,0,0,0,0|2,0,0]=4 4740 B9R0.5 CCCN(C)CCCCCl Amb18798265 [0,2,0,0,0,0|2,0,0]=4 4741 B9R0.5 CCCN(C)CCCNC Amb24400269 [0,2,0,0,0,0|2,0,0]=4 4742 B9R0.5 CCCN(C)CCNCC Amb24668638 [0,2,0,0,0,0|2,0,0]=4 4743 B9R0.5 CCCNCC(=O)CCC Amb25041554 [0,2,0,0,0,0|2,0,0]=4 4744 B9R0.5 CCCNCC(C)CCO Amb24334159 [0,2,0,0,0,0|1,0,0]=3 4745 B9R0.5 CCCNCC(C)CSC Amb25146384 [0,2,0,0,0,0|2,0,0]=4 4746 B9R0.5 CCCNCC(C)SCC Amb18798054 [0,2,0,0,0,0|2,0,0]=4 4747 B9R0.5 CCCNCC(CCN)C Amb17334227 [0,2,0,0,0,0|2,0,0]=4 4748 B9R0.5 CCCNCC(Cl)CCC Amb25685716 [0,2,0,0,0,0|2,0,0]=4 4749 B9R0.5 CCCNCC(N)CCC Amb25794741 [0,2,0,0,0,0|2,0,0]=4 4750 B9R0.5 CCCNCC(O)CCC Amb25130720 [0,2,0,0,0,0|2,0,0]=4 4751 B9R0.5 CCCNCC(O)CSC Amb18792521 [0,2,0,0,0,0|2,0,0]=4 4752 B9R0.5 CCCNC[C@@H](O)COC Amb25098169 [0,2,0,0,0,0|2,0,0]=4 4753 B9R0.5 CCCNC[C@H](N)CCC Amb25826587 [0,2,0,0,0,0|2,0,0]=4 4754 B9R0.5 CCCOCC(=O)CCC Amb25331735 [0,2,0,0,0,0|1,0,0]=3 4755 B9R0.5 CCCOCC(=O)NCC Amb25336196 [0,2,0,0,0,0|1,0,1]=4 4756 B9R0.5 CCCOCC(C)CNC Amb25288841 [0,2,0,0,0,0|1,0,0]=3 4757 B9R0.5 CCCOCC(C)NCC Amb24653370 [0,2,0,0,0,0|1,0,0]=3 4758 B9R0.5 CCCOCC(Cl)CCC Amb25125051 [0,2,0,0,0,0|1,0,0]=3 4759 B9R0.5 CCCOCC(F)CCN Amb24422977 [0,2,0,0,0,0|1,0,0]=3 4760 B9R0.5 CCCOCC(N)CC#C Amb24478113 [0,2,0,0,0,0|1,0,1]=4 4761 B9R0.5 CCCOCC(N)CC=C Amb24502259 [0,2,0,0,0,0|1,0,1]=4 4762 B9R0.5 CCCOCC(N)CCO Amb25730523 [0,2,0,0,0,0|1,0,0]=3 4763 B9R0.5 CCCOCC(O)CC#C Amb25321155 [0,2,0,0,0,0|1,0,1]=4 4764 B9R0.5 CCCOCC(O)CC=C Amb24478083 [0,2,0,0,0,0|1,0,1]=4 4765 B9R0.5 CCCOCC(O)CCC Amb24591662 [0,2,0,0,0,0|1,0,0]=3 4766 B9R0.5 CCCOCC(O)CCN Amb24395595 [0,2,0,0,0,0|1,0,0]=3 4767 B9R0.5 CCCOC[C@@H](N)CCC Amb25764811 [0,2,0,0,0,0|1,0,0]=3 4768 B9R0.5 CCCOC[C@H](N)CCC Amb24426397 [0,2,0,0,0,0|1,0,0]=3 4769 B9R0.5 CCCON=C(N)CCC Amb25720228 [0,2,0,0,0,0|1,0,1]=4 4770 B9R0.5 CCCON=C(N)CCO Amb24457698 [0,2,0,0,0,0|2,0,0]=4 4771 B9R0.5 CCCONC(=O)CCC Amb25031185 [0,2,0,0,0,0|1,0,1]=4 4772 B9R0.5 CCCS(=O)CCCCN Amb25325886 [0,2,0,0,0,0|1,1,0]=4 4773 B9R0.5 CCCS(=O)CCCNC Amb25081219 [0,2,0,0,0,0|1,1,0]=4 4774 B9R0.5 CCCS(=O)CCCON Amb25273792 [0,2,0,0,0,0|2,0,0]=4 4775 B9R0.5 CCCS(=O)CCNCC Amb24363698 [0,2,0,0,0,0|1,1,0]=4 4776 B9R0.5 CCCS(=O)NCCCO Amb24571126 [0,2,0,0,0,0|2,0,0]=4 4777 B9R0.5 CCCS(=O)NCCOC Amb24589176 [0,2,0,0,0,0|2,0,0]=4 4778 B9R0.5 CCCSCC(=O)CCC Amb18800477 [0,2,0,0,0,0|1,1,0]=4 4779 B9R0.5 CCCSCC(N)CCO Amb25319047 [0,2,0,0,0,0|1,0,0]=3 4780 B9R0.5 CCC[C@@H](O)CCCCO Amb25788194 [0,2,0,0,0,0|1,0,0]=3 4781 B9R0.5 CCC[C@H](N)CCCC=C Amb25804705 [0,2,0,0,0,0|2,0,0]=4 4782 B9R0.5 CCC[C@H](N)CCCCC Amb25376691 [0,2,0,0,0,0|2,0,0]=4 4783 B9R0.5 CCC[C@H](O)CCCCC Amb24555119 [0,2,0,0,0,0|2,0,0]=4 4784 B9R0.5 CCC[C@H](O)CCCCO Amb25686179 [0,2,0,0,0,0|1,0,0]=3 4785 B9R0.5 CCC\C=C\C(C)CCO Amb24735117 [0,2,0,0,0,0|1,0,1]=4 4786 B9R0.5 CCNC(=O)COCCCl Amb25228753 [0,2,0,0,0,0|1,0,1]=4 4787 B9R0.5 CCNC(C)CSCCO Amb25252647 [0,2,0,0,0,0|0,1,0]=3 4788 B9R0.5 CCNCCC(C)CCO Amb24538556 [0,2,0,0,0,0|1,0,0]=3 4789 B9R0.5 CCNCCC(C)COC Amb24739123 [0,2,0,0,0,0|2,0,0]=4 4790 B9R0.5 CCNCCC(O)COC Amb25046099 [0,2,0,0,0,0|2,0,0]=4 4791 B9R0.5 CCNCCN(C)CCF Amb25692635 [0,2,0,0,0,0|2,0,0]=4 4792 B9R0.5 CCOC(=O)COCCCl Amb19958740 [0,2,0,0,0,0|1,0,1]=4 4793 B9R0.5 CCOC(=O)COCCN Amb25850783 [0,2,0,0,0,0|1,0,1]=4 4794 B9R0.5 CCOC(=O)COCCO Amb24113532 [0,2,0,0,0,0|0,0,1]=3 4795 B9R0.5 CCOC(C)CNCCF Amb25317863 [0,2,0,0,0,0|2,0,0]=4 4796 B9R0.5 CCOC(C)CNCCN Amb25257239 [0,2,0,0,0,0|2,0,0]=4 4797 B9R0.5 CCOC(C)CNCCO Amb24693511 [0,2,0,0,0,0|1,0,0]=3 4798 B9R0.5 CCOC(C)C\C=C\CO Amb24620831 [0,2,0,0,0,0|1,0,1]=4 4799 B9R0.5 CCOC(C)OCCC#C Amb22229432 [0,2,0,0,0,0|2,0,0]=4 4800 B9R0.5 CCOC(C)OCCC=O Amb24478219 [0,2,0,0,0,0|1,0,1]=4 4801 B9R0.5 CCOC(C)OCCCBr Amb22357028 [0,2,0,0,0,0|2,0,0]=4 4802 B9R0.5 CCOC(C)OCCCCl Amb24480578 [0,2,0,0,0,0|2,0,0]=4 4803 B9R0.5 CCOCCC(C)=CCO Amb25066662 [0,2,0,0,0,0|1,0,1]=4 4804 B9R0.5 CCOCCC(O)CCN Amb25290021 [0,2,0,0,0,0|2,0,0]=4 4805 B9R0.5 CCOCCN(C)CCCl Amb24753509 [0,2,0,0,0,0|2,0,0]=4 4806 B9R0.5 CCOCCN(C)CCI Amb25833424 [0,2,0,0,0,0|2,0,0]=4 4807 B9R0.5 CCOCCN(C)CCS Amb24502185 [0,2,0,0,0,0|1,1,0]=4 4808 B9R0.5 CCOCCS(=O)CCN Amb25055972 [0,2,0,0,0,0|1,1,0]=4 4809 B9R0.5 CCOCCS(=O)CCO Amb25315983 [0,2,0,0,0,0|0,1,0]=3 4810 B9R0.5 CCOCOC(C)CCO Amb25306475 [0,2,0,0,0,0|1,0,0]=3 4811 B9R0.5 CCOCOC(C)CNC Amb24334301 [0,2,0,0,0,0|2,0,0]=4 4812 B9R0.5 CCOCSC(C)CCO Amb24602005 [0,2,0,0,0,0|1,1,0]=4 4813 B9R0.5 CCSC(=O)CCCCO Amb25806700 [0,2,0,0,0,0|1,0,1]=4 4814 B9R0.5 CCSCCC(C)CCN Amb25146904 [0,2,0,0,0,0|2,0,0]=4 4815 B9R0.5 CCSCCC(C)CCS Amb25272096 [0,2,0,0,0,0|1,1,0]=4 4816 B9R0.5 CCSCCC(O)CCN Amb24607786 [0,2,0,0,0,0|2,0,0]=4 4817 B9R0.5 CCSCCN(C)CCN Amb24632675 [0,2,0,0,0,0|2,0,0]=4 4818 B9R0.5 CCSCSC(C)CCO Amb24723800 [0,2,0,0,0,0|1,1,0]=4 4819 B9R0.5 CC\C=C(\C)/CCCCO Amb25271959 [0,2,0,0,0,0|1,0,1]=4 4820 B9R0.5 CC\C=C(\C)/COCCN Amb24698995 [0,2,0,0,0,0|1,0,1]=4 4821 B9R0.5 CC\C=C\C[C@@H](O)CCO Amb25847808 [0,2,0,0,0,0|1,0,1]=4 4822 B9R0.5 CN(CCBr)CCCCO Amb25269010 [0,2,0,0,0,0|2,0,0]=4 4823 B9R0.5 CN(CCCl)CCCCO Amb25264221 [0,2,0,0,0,0|2,0,0]=4 4824 B9R0.5 CN(CCF)CCCCCl Amb24626209 [0,2,0,0,0,0|2,0,0]=4 4825 B9R0.5 CN(CCF)CCCCO Amb25085857 [0,2,0,0,0,0|2,0,0]=4 4826 B9R0.5 CN(CCO)CCCC#N Amb25211478 [0,2,0,0,0,0|1,0,1]=4 4827 B9R0.5 CN(CCO)CCCCCl Amb18798507 [0,2,0,0,0,0|1,0,0]=3 4828 B9R0.5 CN(CCO)CCCCF Amb24410831 [0,2,0,0,0,0|1,0,0]=3 4829 B9R0.5 CNCC(C)NCCCC Amb25369772 [0,2,0,0,0,0|2,0,0]=4 4830 B9R0.5 CNCC(C)OCCC=C Amb24476904 [0,2,0,0,0,0|2,0,0]=4 4831 B9R0.5 CNCC(C)OCCCF Amb24353223 [0,2,0,0,0,0|2,0,0]=4 4832 B9R0.5 CNCC(C)OCCCO Amb25335032 [0,2,0,0,0,0|1,0,0]=3 4833 B9R0.5 CNCC(C)OCCSC Amb24651162 [0,2,0,0,0,0|1,1,0]=4 4834 B9R0.5 CNCC(C)SCCOC Amb18798249 [0,2,0,0,0,0|1,1,0]=4 4835 B9R0.5 CNCC(CCCOC)C Amb17569971 [0,2,0,0,0,0|2,0,0]=4 4836 B9R0.5 CNCC(N)CCCOC Amb25361695 [0,2,0,0,0,0|2,0,0]=4 4837 B9R0.5 CNCC(O)COCCN Amb24479061 [0,2,0,0,0,0|1,0,0]=3 4838 B9R0.5 CNCCCC(C)CCN Amb24406722 [0,2,0,0,0,0|2,0,0]=4 4839 B9R0.5 CNCCCC(COC)C Amb17569969 [0,2,0,0,0,0|2,0,0]=4 4840 B9R0.5 CNCCNC(C)COC Amb24476788 [0,2,0,0,0,0|2,0,0]=4 4841 B9R0.5 COCC(=O)CCCCO Amb25709925 [0,2,0,0,0,0|1,0,1]=4 4842 B9R0.5 COCC(=O)COCCC Amb24482505 [0,2,0,0,0,0|1,0,1]=4 4843 B9R0.5 COCC(=O)OCCCBr Amb25072625 [0,2,0,0,0,0|1,0,1]=4 4844 B9R0.5 COCC(=O)OCCCC Amb20620642 [0,2,0,0,0,0|0,0,1]=3 4845 B9R0.5 COCC(=O)OCCCF Amb24482959 [0,2,0,0,0,0|1,0,1]=4 4846 B9R0.5 COCC(=O)OCCCI Amb24719300 [0,2,0,0,0,0|1,0,1]=4 4847 B9R0.5 COCC(=O)OCCOC Amb25845981 [0,2,0,0,0,0|1,0,1]=4 4848 B9R0.5 COCC(=O)OCCSC Amb25787825 [0,2,0,0,0,0|1,0,1]=4 4849 B9R0.5 COCC(Br)CCCOC Amb25301818 [0,2,0,0,0,0|2,0,0]=4 4850 B9R0.5 COCC(C)CNCCO Amb25763199 [0,2,0,0,0,0|1,0,0]=3 4851 B9R0.5 COCC(C)NCCCBr Amb25107434 [0,2,0,0,0,0|2,0,0]=4 4852 B9R0.5 COCC(C)NCCCCl Amb24621188 [0,2,0,0,0,0|2,0,0]=4 4853 B9R0.5 COCC(C)NCCCF Amb24745233 [0,2,0,0,0,0|2,0,0]=4 4854 B9R0.5 COCC(C)NCCCI Amb24457929 [0,2,0,0,0,0|2,0,0]=4 4855 B9R0.5 COCC(C)NCCCN Amb25702918 [0,2,0,0,0,0|2,0,0]=4 4856 B9R0.5 COCC(C)NCCSC Amb18800728 [0,2,0,0,0,0|2,0,0]=4 4857 B9R0.5 COCC(C)NOCCC Amb24470362 [0,2,0,0,0,0|2,0,0]=4 4858 B9R0.5 COCC(C)OCCC=O Amb24623476 [0,2,0,0,0,0|1,0,1]=4 4859 B9R0.5 COCC(C)OCCCBr Amb25338783 [0,2,0,0,0,0|1,0,0]=3 4860 B9R0.5 COCC(C)OCCCCl Amb25708783 [0,2,0,0,0,0|1,0,0]=3 4861 B9R0.5 COCC(C)OCCCN Amb25841979 [0,2,0,0,0,0|1,0,0]=3 4862 B9R0.5 COCC(C)SCCCCl Amb24703521 [0,2,0,0,0,0|1,1,0]=4 4863 B9R0.5 COCC(C)SCCCF Amb24397720 [0,2,0,0,0,0|1,1,0]=4 4864 B9R0.5 COCC(C)SCCCO Amb24659045 [0,2,0,0,0,0|1,1,0]=4 4865 B9R0.5 COCC(Cl)CCCOC Amb18798738 [0,2,0,0,0,0|2,0,0]=4 4866 B9R0.5 COCC(Cl)CCOCC Amb24652441 [0,2,0,0,0,0|2,0,0]=4 4867 B9R0.5 COCC(N)CCCOC Amb25288690 [0,2,0,0,0,0|2,0,0]=4 4868 B9R0.5 COCC(N)CCCSC Amb24709969 [0,2,0,0,0,0|2,0,0]=4 4869 B9R0.5 COCC(O)CCCCF Amb25088657 [0,2,0,0,0,0|2,0,0]=4 4870 B9R0.5 COCC(O)CCCOC Amb24704908 [0,2,0,0,0,0|2,0,0]=4 4871 B9R0.5 COCC(O)CCOCC Amb24685719 [0,2,0,0,0,0|2,0,0]=4 4872 B9R0.5 COCC(O)CNCCN Amb25047835 [0,2,0,0,0,0|2,0,0]=4 4873 B9R0.5 COCC(O)COCCC Amb25800291 [0,2,0,0,0,0|1,0,0]=3 4874 B9R0.5 COCC(O)COCCCl Amb25267062 [0,2,0,0,0,0|1,0,0]=3 4875 B9R0.5 COCC(O)COCCN Amb25201733 [0,2,0,0,0,0|1,0,0]=3 4876 B9R0.5 COCC(O)CSCCO Amb25720501 [0,2,0,0,0,0|0,1,0]=3 4877 B9R0.5 COCCCC(N)CSC Amb18798250 [0,2,0,0,0,0|2,0,0]=4 4878 B9R0.5 COCCCC(O)CSC Amb18182617 [0,2,0,0,0,0|2,0,0]=4 4879 B9R0.5 COCCCN(CCCl)C Amb17334659 [0,2,0,0,0,0|2,0,0]=4 4880 B9R0.5 COCCCN(CCN)C Amb17334263 [0,2,0,0,0,0|2,0,0]=4 4881 B9R0.5 COCCCN(CCO)C Amb17334276 [0,2,0,0,0,0|1,0,0]=3 4882 B9R0.5 COCCNC(=N)CCO Amb24353897 [0,2,0,0,0,0|2,0,0]=4 4883 B9R0.5 COCCNC(=O)CCO Amb17334264 [0,2,0,0,0,0|2,0,0]=4 4884 B9R0.5 COCCNC(C)CCCl Amb24479316 [0,2,0,0,0,0|2,0,0]=4 4885 B9R0.5 COCCNC(C)CCN Amb20090506 [0,2,0,0,0,0|2,0,0]=4 4886 B9R0.5 COCCNC(C)CSC Amb25361941 [0,2,0,0,0,0|2,0,0]=4 4887 B9R0.5 COCCOC(=O)CCC Amb24450506 [0,2,0,0,0,0|0,0,1]=3 4888 B9R0.5 COCCOC(=O)CCN Amb24468624 [0,2,0,0,0,0|1,0,1]=4 4889 B9R0.5 COCCOC(=O)CON Amb25691096 [0,2,0,0,0,0|1,0,1]=4 4890 B9R0.5 COCCOC(C)CC=O Amb25293421 [0,2,0,0,0,0|1,0,1]=4 4891 B9R0.5 COCCSC(C)CCCl Amb25289434 [0,2,0,0,0,0|1,1,0]=4 4892 B9R0.5 COCCSC(C)CCN Amb18792519 [0,2,0,0,0,0|1,1,0]=4 4893 B9R0.5 COCCSC(C)CCO Amb24565851 [0,2,0,0,0,0|1,1,0]=4 4894 B9R0.5 COC[C@H](O)CNCCO Amb24396559 [0,2,0,0,0,0|1,0,0]=3 4895 B9R0.5 CONC(=O)COCCO Amb24482795 [0,2,0,0,0,0|1,0,1]=4 4896 B9R0.5 CONC(C)COCCN Amb24582790 [0,2,0,0,0,0|2,0,0]=4 4897 B9R0.5 CSCC(=O)NOCCO Amb24720960 [0,2,0,0,0,0|1,0,1]=4 4898 B9R0.5 CSCC(C)CNCCF Amb24658491 [0,2,0,0,0,0|2,0,0]=4 4899 B9R0.5 CSCC(N)CCCCF Amb24371319 [0,2,0,0,0,0|2,0,0]=4 4900 B9R0.5 CSCC(O)CCCCF Amb24457995 [0,2,0,0,0,0|2,0,0]=4 4901 B9R0.5 CSCC(O)CNCCO Amb24476380 [0,2,0,0,0,0|1,0,0]=3 4902 B9R0.5 CSCCCC(C)CCN Amb24732188 [0,2,0,0,0,0|2,0,0]=4 4903 B9R0.5 CSCCCN(C)CCBr Amb24413655 [0,2,0,0,0,0|2,0,0]=4 4904 B9R0.5 CSCCCN(C)CCF Amb25049594 [0,2,0,0,0,0|2,0,0]=4 4905 B9R0.5 CSCCCN(C)CCN Amb18798168 [0,2,0,0,0,0|2,0,0]=4 4906 B9R0.5 CSCCCN(C)CCS Amb24717043 [0,2,0,0,0,0|1,1,0]=4 4907 B9R0.5 C[C@@H](CCO)\C=C\CCO Amb24582077 [0,2,0,0,0,0|1,0,1]=4 4908 B9R0.5 C[C@H](CCO)CCCC#N Amb24431055 [0,2,0,0,0,0|1,0,1]=4 4909 B9R0.5 C\C=C\C(O)CCCCO Amb25057724 [0,2,0,0,0,0|1,0,1]=4 4910 B9R0.5 C\C=C\CCC(C)CCO Amb25792404 [0,2,0,0,0,0|1,0,1]=4 4911 B9R0.5 C\C=C\CCC(N)CCO Amb25174976 [0,2,0,0,0,0|1,0,1]=4 4912 B9R0.5 N#CCCCS(=O)CCO Amb25072059 [0,2,0,0,0,0|0,1,1]=4 4913 B9R0.5 NCCCCC(=O)NCO Amb24715839 [0,2,0,0,0,0|2,0,0]=4 4914 B9R0.5 NCCCCN(CCO)C Amb17505304 [0,2,0,0,0,0|1,0,0]=3 4915 B9R0.5 NCCCNC(=O)CCO Amb24568840 [0,2,0,0,0,0|2,0,0]=4 4916 B9R0.5 NCCS(=O)CCCCF Amb25069235 [0,2,0,0,0,0|1,1,0]=4 4917 B9R0.5 OCCC(Cl)COCCCl Amb24652513 [0,2,0,0,0,0|1,0,0]=3 4918 B9R0.5 OCCCCC(=O)CCCl Amb25292236 [0,2,0,0,0,0|1,0,1]=4 4919 B9R0.5 OCCCCC(=O)NCC Amb17231999 [0,2,0,0,0,0|1,0,1]=4 4920 B9R0.5 OCCCCC(=O)OCC Amb17593658 [0,2,0,0,0,0|1,0,1]=4 4921 B9R0.8 CC(CC)C(N)CCCC Amb24428005 [0,2,0,0,0,0|2,0,0]=4 4922 B9R0.8 CC(CC)C(O)CCCO Amb24431358 [0,2,0,0,0,0|1,0,0]=3 4923 B9R0.8 CC(CCCC)C(O)CC Amb24529236 [0,2,0,0,0,0|2,0,0]=4 4924 B9R0.8 CC(CCCC)C(O)CN Amb25756288 [0,2,0,0,0,0|2,0,0]=4 4925 B9R0.8 CC(CCCC)C(O)CO Amb25787235 [0,2,0,0,0,0|1,0,0]=3 4926 B9R0.8 CC(CCCC)C(O)CS Amb24481288 [0,2,0,0,0,0|1,1,0]=4 4927 B9R0.8 CC(CCCO)C(O)CC Amb24446171 [0,2,0,0,0,0|1,0,0]=3 4928 B9R0.8 CC(CCOC)C(N)CO Amb25704025 [0,2,0,0,0,0|2,0,0]=4 4929 B9R0.8 CC(CO)C(Cl)CCCC Amb25046785 [0,2,0,0,0,0|1,0,0]=3 4930 B9R0.8 CC(CO)C(O)CCCC Amb25856352 [0,2,0,0,0,0|1,0,0]=3 4931 B9R0.8 CC(CO)N(C)CCCBr Amb24556327 [0,2,0,0,0,0|2,0,0]=4 4932 B9R0.8 CC(CO)N(C)CCCCl Amb24429241 [0,2,0,0,0,0|2,0,0]=4 4933 B9R0.8 CC(CO)N(C)CCCF Amb25842565 [0,2,0,0,0,0|2,0,0]=4 4934 B9R0.8 CC(CO)N(C)CCCI Amb24475592 [0,2,0,0,0,0|2,0,0]=4 4935 B9R0.8 CC(CO)N(C)CCCO Amb24359422 [0,2,0,0,0,0|2,0,0]=4 4936 B9R0.8 CC(CO)N(C)CCCS Amb25125008 [0,2,0,0,0,0|2,0,0]=4 4937 B9R0.8 CC(CO)[C@@H](O)CCCC Amb24698674 [0,2,0,0,0,0|1,0,0]=3 4938 B9R0.8 CC(NCCF)C(O)CC Amb25662849 [0,2,0,0,0,0|2,0,0]=4 4939 B9R0.8 CC(NCCO)C(C)CO Amb25147744 [0,2,0,0,0,0|2,0,0]=4 4940 B9R0.8 CC(OCCC)C(O)CC Amb24700847 [0,2,0,0,0,0|1,0,0]=3 4941 B9R0.8 CC(SCCC)C(N)CC Amb25297120 [0,2,0,0,0,0|1,1,0]=4 4942 B9R0.8 CCC(=O)C(C)OCCC Amb24569608 [0,2,0,0,0,0|1,0,1]=4 4943 B9R0.8 CCC(=O)C(C)OCCCl Amb25111587 [0,2,0,0,0,0|1,0,1]=4 4944 B9R0.8 CCC(=O)C(C)SCCO Amb25052539 [0,2,0,0,0,0|0,1,1]=4 4945 B9R0.8 CCC(=O)[C@@H](C)OCCC Amb25723352 [0,2,0,0,0,0|1,0,1]=4 4946 B9R0.8 CCC(Br)C(=O)NCCO Amb24477925 [0,2,0,0,0,0|1,0,1]=4 4947 B9R0.8 CCC(Br)C(=O)OCCC Amb18090817 [0,2,0,0,0,0|1,0,1]=4 4948 B9R0.8 CCC(Br)C(=O)OCCCl Amb24065571 [0,2,0,0,0,0|1,0,1]=4 4949 B9R0.8 CCC(C)C(=O)CCCO Amb24353328 [0,2,0,0,0,0|1,0,1]=4 4950 B9R0.8 CCC(C)C(=O)OCCO Amb25677455 [0,2,0,0,0,0|0,0,1]=3 4951 B9R0.8 CCC(C)C(C)CCCCl Amb24678078 [0,2,0,0,0,0|2,0,0]=4 4952 B9R0.8 CCC(C)C(C)CCCO Amb24373378 [0,2,0,0,0,0|1,0,0]=3 4953 B9R0.8 CCC(C)C(C)NCCCl Amb25352779 [0,2,0,0,0,0|2,0,0]=4 4954 B9R0.8 CCC(C)C(C)NCCN Amb25696730 [0,2,0,0,0,0|2,0,0]=4 4955 B9R0.8 CCC(C)C(C)OCCN Amb24501729 [0,2,0,0,0,0|1,0,0]=3 4956 B9R0.8 CCC(C)C(C)SCCCl Amb25274366 [0,2,0,0,0,0|1,1,0]=4 4957 B9R0.8 CCC(N)C(O)CCCC Amb24609875 [0,2,0,0,0,0|2,0,0]=4 4958 B9R0.8 CCC(O)C(=O)OCCCl Amb24505283 [0,2,0,0,0,0|1,0,1]=4 4959 B9R0.8 CCC(O)C(=O)OCCO Amb25845992 [0,2,0,0,0,0|0,0,1]=3 4960 B9R0.8 CCC(O)C(Cl)CCCC Amb25758728 [0,2,0,0,0,0|2,0,0]=4 4961 B9R0.8 CCC(S)C(=O)OCCC Amb25680878 [0,2,0,0,0,0|1,0,1]=4 4962 B9R0.8 CCCCC(=C)[C@H](O)CC Amb25792459 [0,2,0,0,0,0|2,0,0]=4 4963 B9R0.8 CCCCC(=O)C(C)CBr Amb24477160 [0,2,0,0,0,0|2,0,0]=4 4964 B9R0.8 CCCCC(=O)C(C)CN Amb25062866 [0,2,0,0,0,0|2,0,0]=4 4965 B9R0.8 CCCCC(=O)C(C)CO Amb25184703 [0,2,0,0,0,0|1,0,0]=3 4966 B9R0.8 CCCCC(=O)C(Cl)CC Amb24479205 [0,2,0,0,0,0|2,0,0]=4 4967 B9R0.8 CCCCC(=O)C(F)CC Amb25793058 [0,2,0,0,0,0|2,0,0]=4 4968 B9R0.8 CCCCC(=O)C(F)CCl Amb24410306 [0,2,0,0,0,0|2,0,0]=4 4969 B9R0.8 CCCCC(=O)C(O)CC Amb25792568 [0,2,0,0,0,0|2,0,0]=4 4970 B9R0.8 CCCCC(=O)[C@H](C)CO Amb25763179 [0,2,0,0,0,0|1,0,0]=3 4971 B9R0.8 CCCCC(C)=C(C)CO Amb24747676 [0,2,0,0,0,0|1,0,1]=4 4972 B9R0.8 CCCCC(C)C(C)CN Amb24715368 [0,2,0,0,0,0|2,0,0]=4 4973 B9R0.8 CCCCC(C)C(C)CO Amb25782737 [0,2,0,0,0,0|1,0,0]=3 4974 B9R0.8 CCCCC(F)[C@@H](O)CO Amb24122595 [0,2,0,0,0,0|1,0,0]=3 4975 B9R0.8 CCCCC(O)C(Cl)CC Amb24711915 [0,2,0,0,0,0|2,0,0]=4 4976 B9R0.8 CCCCC(O)C(Cl)CCl Amb25088315 [0,2,0,0,0,0|2,0,0]=4 4977 B9R0.8 CCCCC(O)C(O)CBr Amb24452745 [0,2,0,0,0,0|2,0,0]=4 4978 B9R0.8 CCCCC(O)C(O)CCl Amb24480473 [0,2,0,0,0,0|2,0,0]=4 4979 B9R0.8 CCCCN(C(=O)CO)C Amb17334237 [0,2,0,0,0,0|1,0,1]=4 4980 B9R0.8 CCCCN(C)C(C)CBr Amb24406256 [0,2,0,0,0,0|2,0,0]=4 4981 B9R0.8 CCCCN(C)C(C)CC Amb25057447 [0,2,0,0,0,0|2,0,0]=4 4982 B9R0.8 CCCCN(C)[C@@H](C)CO Amb24482834 [0,2,0,0,0,0|1,0,0]=3 4983 B9R0.8 CCCCN(C)[C@H](C)CO Amb25331564 [0,2,0,0,0,0|1,0,0]=3 4984 B9R0.8 CCCCN(N)C(C)CC Amb24422538 [0,2,0,0,0,0|2,0,0]=4 4985 B9R0.8 CCCC[C@@H](O)C(=C)CO Amb25687846 [0,2,0,0,0,0|1,0,1]=4 4986 B9R0.8 CCCC[C@@H](O)[C@@H](Cl)CC Amb24482152 [0,2,0,0,0,0|2,0,0]=4 4987 B9R0.8 CCCC[C@@H](O)[C@@H](O)CCl Amb25837344 [0,2,0,0,0,0|2,0,0]=4 4988 B9R0.8 CCCC[C@@H](O)[C@@H](O)CO Amb25796335 [0,2,0,0,0,0|1,0,0]=3 4989 B9R0.8 CCCC[C@@H](O)[C@H](Cl)CC Amb25279533 [0,2,0,0,0,0|2,0,0]=4 4990 B9R0.8 CCCC[C@H](O)C(=C)CO Amb24642396 [0,2,0,0,0,0|1,0,1]=4 4991 B9R0.8 CCCC[C@H](O)C(=O)CO Amb24524634 [0,2,0,0,0,0|1,0,1]=4 4992 B9R0.8 CCCC[C@H](O)[C@@H](O)CCl Amb25707846 [0,2,0,0,0,0|2,0,0]=4 4993 B9R0.8 CCCC[C@H](O)[C@H](O)CCl Amb25837345 [0,2,0,0,0,0|2,0,0]=4 4994 B9R0.8 CCCNC(=O)C(N)CO Amb25133683 [0,2,0,0,0,0|2,0,0]=4 4995 B9R0.8 CCCNC(C)C(C)CO Amb25045170 [0,2,0,0,0,0|2,0,0]=4 4996 B9R0.8 CCCOC(=O)C(O)CO Amb24509365 [0,2,0,0,0,0|2,0,0]=4 4997 B9R0.8 CCN(C)C(C)CCCO Amb25769082 [0,2,0,0,0,0|2,0,0]=4 4998 B9R0.8 CCN(O)C(=O)OCCO Amb25247252 [0,2,0,0,0,0|1,0,1]=4 4999 B9R0.8 CC[C@@H](Cl)[C@H](Cl)CCCC Amb25045113 [0,2,0,0,0,0|2,0,0]=4 5000 B9R0.8 CC[C@@H](N)C(=O)OCCC Amb25361501 [0,2,0,0,0,0|1,0,1]=4 5001 B9R0.8 CC[C@@H](O)[C@@H](O)CCCC Amb25077940 [0,2,0,0,0,0|2,0,0]=4 5002 B9R0.8 CC[C@@H](O)[C@@H](O)CCCO Amb25285323 [0,2,0,0,0,0|1,0,0]=3 5003 B9R0.8 CC[C@@H](O)[C@H](Cl)CCCC Amb25232978 [0,2,0,0,0,0|2,0,0]=4 5004 B9R0.8 CC[C@@H](O)[C@H](O)CCCC Amb24509373 [0,2,0,0,0,0|2,0,0]=4 5005 B9R0.8 CC[C@H](Cl)[C@H](Cl)CCCC Amb25232571 [0,2,0,0,0,0|2,0,0]=4 5006 B9R0.8 CC[C@H](N)C(=O)OCCC Amb24371588 [0,2,0,0,0,0|1,0,1]=4 5007 B9R0.8 CC[C@H](O)[C@@H](Cl)CCCC Amb25101617 [0,2,0,0,0,0|2,0,0]=4 5008 B9R0.8 CC[C@H](O)[C@H](Cl)CCCC Amb24482168 [0,2,0,0,0,0|2,0,0]=4 5009 B9R0.8 CC[C@H](O)[C@H](O)CCCO Amb24642487 [0,2,0,0,0,0|1,0,0]=3 5010 B9R0.8 COCCN(C)[C@H](C)CO Amb25796188 [0,2,0,0,0,0|2,0,0]=4 5011 B9R0.8 COCC[C@H](O)[C@H](O)CO Amb20242865 [0,2,0,0,0,0|2,0,0]=4 5012 B9R0.8 CSCCC(O)C(N)CO Amb25839854 [0,2,0,0,0,0|2,0,0]=4 5013 B9R0.8 CSCCN(C)C(C)CO Amb25145539 [0,2,0,0,0,0|2,0,0]=4 5014 B9R0.8 C[C@@H](CC)[C@@H](N)CCCC Amb24657197 [0,2,0,0,0,0|2,0,0]=4 5015 B9R0.8 C[C@@H](CC)[C@@H](O)CCCC Amb25316121 [0,2,0,0,0,0|2,0,0]=4 5016 B9R0.8 C[C@@H](CC)[C@H](O)\C=C\CO Amb25144362 [0,2,0,0,0,0|1,0,1]=4 5017 B9R0.8 C[C@@H](CCCC)[C@H](O)CO Amb25058489 [0,2,0,0,0,0|1,0,0]=3 5018 B9R0.8 C[C@@H](CCCO)[C@H](O)CC Amb25831920 [0,2,0,0,0,0|1,0,0]=3 5019 B9R0.8 C[C@@H](CO)N(C)CCCI Amb24421435 [0,2,0,0,0,0|2,0,0]=4 5020 B9R0.8 C[C@@H](CO)[C@H](Cl)CCCC Amb24373114 [0,2,0,0,0,0|1,0,0]=3 5021 B9R0.8 C[C@@H](\C=C\CO)[C@@H](O)CC Amb25192370 [0,2,0,0,0,0|1,0,1]=4 5022 B9R0.8 C[C@H](CC)[C@@H](N)CCCC Amb25848922 [0,2,0,0,0,0|2,0,0]=4 5023 B9R0.8 C[C@H](CC)[C@@H](O)CCCC Amb24481271 [0,2,0,0,0,0|2,0,0]=4 5024 B9R0.8 C[C@H](CC)[C@H](O)CCCC Amb25681479 [0,2,0,0,0,0|2,0,0]=4 5025 B9R0.8 C[C@H](CCCC)[C@@H](O)CO Amb25848502 [0,2,0,0,0,0|1,0,0]=3 5026 B9R0.8 C[C@H](CCCC)[C@H](F)CO Amb24388891 [0,2,0,0,0,0|1,0,0]=3 5027 B9R0.8 C[C@H](CO)[C@@H](O)CCCC Amb25357919 [0,2,0,0,0,0|1,0,0]=3 5028 B9R0.8 C[C@H](\C=C\CO)[C@H](O)CC Amb25206353 [0,2,0,0,0,0|1,0,1]=4 5029 B9R0.8 NC(CS)C(=O)OCCO Amb24640498 [0,2,0,0,0,0|1,0,1]=4 5030 B9R0.8 NCCCC(=O)C(N)CO Amb24697914 [0,2,0,0,0,0|2,0,0]=4 5031 B9R0.18 C#CCCC(O)CCCO Amb25677046 [0,2,0,0,0,0|1,0,1]=4 5032 B9R0.18 C=CCCC(O)CCCO Amb25721005 [0,2,0,0,0,0|1,0,1]=4 5033 B9R0.18 CC(CCC=C)OCCO Amb25740624 [0,2,0,0,0,0|0,0,1]=3 5034 B9R0.18 CC(CCCC)CCCC Amb22230000 [0,2,0,0,0,0|2,0,0]=4 5035 B9R0.18 CC(CCCN)CCCN Amb25147442 [0,2,0,0,0,0|2,0,0]=4 5036 B9R0.18 CC(CCCN)NCCN Amb25766690 [0,2,0,0,0,0|2,0,0]=4 5037 B9R0.18 CC(OCCC)OCCC Amb22729236 [0,2,0,0,0,0|1,0,0]=3 5038 B9R0.18 CCC#CC(C)OCCO Amb25343831 [0,2,0,0,0,0|0,0,1]=3 5039 B9R0.18 CCCCB(Cl)CCCN Amb24594888 [0,2,0,0,0,0|2,0,0]=4 5040 B9R0.18 CCCCB(O)CCCC Amb25797237 [0,2,0,0,0,0|2,0,0]=4 5041 B9R0.18 CCCCC(=C)CCCBr Amb24477103 [0,2,0,0,0,0|2,0,0]=4 5042 B9R0.18 CCCCC(=C)CCCC Amb22641581 [0,2,0,0,0,0|2,0,0]=4 5043 B9R0.18 CCCCC(=C)CCCCl Amb24409581 [0,2,0,0,0,0|2,0,0]=4 5044 B9R0.18 CCCCC(=O)CCC#C Amb25715132 [0,2,0,0,0,0|2,0,0]=4 5045 B9R0.18 CCCCC(=O)CCC#N Amb18643440 [0,2,0,0,0,0|2,0,0]=4 5046 B9R0.18 CCCCC(=O)CCC=O Amb24440961 [0,2,0,0,0,0|1,0,1]=4 5047 B9R0.18 CCCCC(=O)CCCO Amb25146585 [0,2,0,0,0,0|1,0,0]=3 5048 B9R0.18 CCCCC(=O)CCSC Amb24731683 [0,2,0,0,0,0|1,1,0]=4 5049 B9R0.18 CCCCC(=O)CNCC Amb25789708 [0,2,0,0,0,0|2,0,0]=4 5050 B9R0.18 CCCCC(=O)NCCCl Amb17103192 [0,2,0,0,0,0|2,0,0]=4 5051 B9R0.18 CCCCC(=O)NCCI Amb24428497 [0,2,0,0,0,0|2,0,0]=4 5052 B9R0.18 CCCCC(=O)NCCS Amb25366038 [0,2,0,0,0,0|1,1,0]=4 5053 B9R0.18 CCCCC(=O)NCOC Amb24479090 [0,2,0,0,0,0|2,0,0]=4 5054 B9R0.18 CCCCC(=O)OCC#N Amb25168860 [0,2,0,0,0,0|1,0,1]=4 5055 B9R0.18 CCCCC(=O)OCC=C Amb22732606 [0,2,0,0,0,0|1,0,1]=4 5056 B9R0.18 CCCCC(=O)OCC=O Amb25729160 [0,2,0,0,0,0|0,0,2]=4 5057 B9R0.18 CCCCC(=O)OCCBr Amb24709719 [0,2,0,0,0,0|1,0,0]=3 5058 B9R0.18 CCCCC(=O)OCCCl Amb25292212 [0,2,0,0,0,0|1,0,0]=3 5059 B9R0.18 CCCCC(=O)OCCF Amb24447526 [0,2,0,0,0,0|1,0,0]=3 5060 B9R0.18 CCCCC(=O)\C=C\CO Amb25735097 [0,2,0,0,0,0|1,0,1]=4 5061 B9R0.18 CCCCC(Br)CCC=C Amb25365643 [0,2,0,0,0,0|2,0,0]=4 5062 B9R0.18 CCCCC(C)C#CCO Amb25823098 [0,2,0,0,0,0|1,0,1]=4 5063 B9R0.18 CCCCC(C)CCC=O Amb22270225 [0,2,0,0,0,0|1,0,1]=4 5064 B9R0.18 CCCCC(C)CCCBr Amb24573042 [0,2,0,0,0,0|2,0,0]=4 5065 B9R0.18 CCCCC(C)CCNC Amb25733233 [0,2,0,0,0,0|2,0,0]=4 5066 B9R0.18 CCCCC(C)CNCC Amb24654467 [0,2,0,0,0,0|2,0,0]=4 5067 B9R0.18 CCCCC(C)NCCN Amb24739444 [0,2,0,0,0,0|2,0,0]=4 5068 B9R0.18 CCCCC(C)OCCO Amb25306013 [0,2,0,0,0,0|0,0,0]=2 5069 B9R0.18 CCCCC(CCCC)Br Amb10553775 [0,2,0,0,0,0|2,0,0]=4 5070 B9R0.18 CCCCC(CCCC)O Amb10068522 [0,2,0,0,0,0|2,0,0]=4 5071 B9R0.18 CCCCC(Cl)CCCO Amb24482147 [0,2,0,0,0,0|1,0,0]=3 5072 B9R0.18 CCCCC(Cl)CCOC Amb17666907 [0,2,0,0,0,0|1,0,0]=3 5073 B9R0.18 CCCCC(F)=CCCO Amb24481203 [0,2,0,0,0,0|1,0,0]=3 5074 B9R0.18 CCCCC(N)CCC=C Amb25825777 [0,2,0,0,0,0|2,0,0]=4 5075 B9R0.18 CCCCC(N)CCCBr Amb24375272 [0,2,0,0,0,0|2,0,0]=4 5076 B9R0.18 CCCCC(N)CCCC Amb22229936 [0,2,0,0,0,0|2,0,0]=4 5077 B9R0.18 CCCCC(N)CCCN Amb25147271 [0,2,0,0,0,0|2,0,0]=4 5078 B9R0.18 CCCCC(N)CCOC Amb25835738 [0,2,0,0,0,0|1,0,0]=3 5079 B9R0.18 CCCCC(N)CNCC Amb25309735 [0,2,0,0,0,0|2,0,0]=4 5080 B9R0.18 CCCCC(N)\C=C\CO Amb24656547 [0,2,0,0,0,0|1,0,1]=4 5081 B9R0.18 CCCCC(O)CCC=C Amb25682147 [0,2,0,0,0,0|2,0,0]=4 5082 B9R0.18 CCCCC(O)CCCC Amb24062984 [0,2,0,0,0,0|2,0,0]=4 5083 B9R0.18 CCCCC(O)CCCCl Amb25378855 [0,2,0,0,0,0|2,0,0]=4 5084 B9R0.18 CCCCC(O)CNCC Amb25789231 [0,2,0,0,0,0|2,0,0]=4 5085 B9R0.18 CCCCC(O)COCC Amb24386046 [0,2,0,0,0,0|2,0,0]=4 5086 B9R0.18 CCCCN(C)CCC=O Amb25662113 [0,2,0,0,0,0|1,0,1]=4 5087 B9R0.18 CCCCN(C)CCCS Amb25252815 [0,2,0,0,0,0|1,1,0]=4 5088 B9R0.18 CCCCN(CCCC)Cl Amb15693424 [0,2,0,0,0,0|2,0,0]=4 5089 B9R0.18 CCCCN(CCCCl)C Amb17334590 [0,2,0,0,0,0|2,0,0]=4 5090 B9R0.18 CCCCN(CCCN)C Amb1108729 [0,2,0,0,0,0|2,0,0]=4 5091 B9R0.18 CCCCP(=O)OCCCl Amb25101524 [0,2,0,0,0,0|1,0,0]=3 5092 B9R0.18 CCCCP(Cl)CCCC Amb22353630 [0,2,0,0,0,0|2,0,0]=4 5093 B9R0.18 CCCCS(=O)CCCN Amb18788237 [0,2,0,0,0,0|1,1,0]=4 5094 B9R0.18 CCCCS(=O)CCOC Amb24397730 [0,2,0,0,0,0|0,1,0]=3 5095 B9R0.18 CCCC[C@@H](O)CCC=C Amb25129816 [0,2,0,0,0,0|2,0,0]=4 5096 B9R0.18 CCCC[C@H](C)CCC=O Amb24389359 [0,2,0,0,0,0|1,0,1]=4 5097 B9R0.18 CCCC[C@H](C)CCCN Amb24598449 [0,2,0,0,0,0|2,0,0]=4 5098 B9R0.18 CCCC[C@H](O)CCOC Amb25226419 [0,2,0,0,0,0|1,0,0]=3 5099 B9R0.18 CCCC[Sn](=S)CCCC Amb19894306 [0,2,0,0,0,0|2,0,0]=4 5100 B9R0.18 CCCC\C(\C)=C\CCCl Amb25132140 [0,2,0,0,0,0|2,0,0]=4 5101 B9R0.18 CCCNC(=N)CCOC Amb25323157 [0,2,0,0,0,0|2,0,0]=4 5102 B9R0.18 CCCNC(=O)CCCO Amb17231997 [0,2,0,0,0,0|1,0,1]=4 5103 B9R0.18 CCCNC(=O)CCOC Amb24480776 [0,2,0,0,0,0|2,0,0]=4 5104 B9R0.18 CCCNC(=O)OCCBr Amb25741764 [0,2,0,0,0,0|1,0,1]=4 5105 B9R0.18 CCCNC(=O)OCCC Amb24460257 [0,2,0,0,0,0|1,0,1]=4 5106 B9R0.18 CCCNC(=O)OCCCl Amb25084565 [0,2,0,0,0,0|1,0,1]=4 5107 B9R0.18 CCCNC(=O)OCCI Amb25169397 [0,2,0,0,0,0|1,0,1]=4 5108 B9R0.18 CCCNC(C)CCCCl Amb25760621 [0,2,0,0,0,0|2,0,0]=4 5109 B9R0.18 CCCOC(=N)OCCC Amb24698422 [0,2,0,0,0,0|1,0,1]=4 5110 B9R0.18 CCCOC(=O)CCCCl Amb19960299 [0,2,0,0,0,0|1,0,1]=4 5111 B9R0.18 CCCOC(=O)CNCC Amb24358825 [0,2,0,0,0,0|1,0,1]=4 5112 B9R0.18 CCCOC(=O)OCCC Amb22336422 [0,2,0,0,0,0|1,0,1]=4 5113 B9R0.18 CCCOC(=O)OCCCl Amb24593589 [0,2,0,0,0,0|1,0,1]=4 5114 B9R0.18 CCCOC(=O)OCCN Amb25126346 [0,2,0,0,0,0|1,0,1]=4 5115 B9R0.18 CCCOC(C)CCCO Amb24686860 [0,2,0,0,0,0|1,0,0]=3 5116 B9R0.18 CCCOC(C)\C=C\CO Amb25320645 [0,2,0,0,0,0|1,0,1]=4 5117 B9R0.18 CCCOP(OCCC)O Amb10606107 [0,2,0,0,0,0|2,0,0]=4 5118 B9R0.18 CCCOS(=O)OCCC Amb10807470 [0,2,0,0,0,0|2,0,0]=4 5119 B9R0.18 CCCO[C@@H](C)\C=C\CO Amb25823115 [0,2,0,0,0,0|1,0,1]=4 5120 B9R0.18 CCCO[C@H](C)CCCO Amb24431801 [0,2,0,0,0,0|1,0,0]=3 5121 B9R0.18 CCCSC(C)CNCC Amb18798058 [0,2,0,0,0,0|1,1,0]=4 5122 B9R0.18 CCNCC(=O)NCCO Amb25777506 [0,2,0,0,0,0|1,0,1]=4 5123 B9R0.18 CCNCC(C)CCOC Amb24477950 [0,2,0,0,0,0|2,0,0]=4 5124 B9R0.18 CCNCC(C)OCCO Amb25161995 [0,2,0,0,0,0|0,0,0]=2 5125 B9R0.18 CCNCC(N)CCOC Amb24357594 [0,2,0,0,0,0|2,0,0]=4 5126 B9R0.18 CCNCC(O)CCOC Amb25794272 [0,2,0,0,0,0|2,0,0]=4 5127 B9R0.18 CCOCC(=O)OCCF Amb25807294 [0,2,0,0,0,0|1,0,1]=4 5128 B9R0.18 CCOCC(C)OCC#N Amb24566893 [0,2,0,0,0,0|1,0,1]=4 5129 B9R0.18 CCOCC(C)OCC=O Amb25125726 [0,2,0,0,0,0|0,0,2]=4 5130 B9R0.18 CCOCC(C)OCCBr Amb25840219 [0,2,0,0,0,0|1,0,0]=3 5131 B9R0.18 CCONC(=O)OCCO Amb25682794 [0,2,0,0,0,0|1,0,1]=4 5132 B9R0.18 CCSCC(C)NCCN Amb24372439 [0,2,0,0,0,0|2,0,0]=4 5133 B9R0.18 CC\C=C\C(=O)OCCO Amb25080636 [0,2,0,0,0,0|0,0,2]=4 5134 B9R0.18 CN(CCCO)CCCF Amb25052445 [0,2,0,0,0,0|2,0,0]=4 5135 B9R0.18 CN(CCOC)CCOC Amb24120427 [0,2,0,0,0,0|2,0,0]=4 5136 B9R0.18 CNCCC(CCOC)C Amb17569970 [0,2,0,0,0,0|2,0,0]=4 5137 B9R0.18 COCCC(=O)CCSC Amb24438990 [0,2,0,0,0,0|2,0,0]=4 5138 B9R0.18 COCCC(=O)COCC Amb24660012 [0,2,0,0,0,0|2,0,0]=4 5139 B9R0.18 COCCC(=O)OCCC Amb25219323 [0,2,0,0,0,0|1,0,1]=4 5140 B9R0.18 COCCC(=O)OCCO Amb25845430 [0,2,0,0,0,0|0,0,1]=3 5141 B9R0.18 COCCC(C)CCCBr Amb25122733 [0,2,0,0,0,0|2,0,0]=4 5142 B9R0.18 COCCC(C)NCCBr Amb24664984 [0,2,0,0,0,0|2,0,0]=4 5143 B9R0.18 COCCC(C)NCCCl Amb25353289 [0,2,0,0,0,0|2,0,0]=4 5144 B9R0.18 COCCC(C)NCCO Amb24505219 [0,2,0,0,0,0|1,0,0]=3 5145 B9R0.18 COCCC(C)OCCN Amb25112467 [0,2,0,0,0,0|1,0,0]=3 5146 B9R0.18 COCCC(C)SCCCl Amb24410002 [0,2,0,0,0,0|1,1,0]=4 5147 B9R0.18 COCCC(C)SCCO Amb25783257 [0,2,0,0,0,0|0,1,0]=3 5148 B9R0.18 COCCC(C)\C=C\CO Amb24658332 [0,2,0,0,0,0|1,0,1]=4 5149 B9R0.18 COCCC(O)CCCBr Amb24477348 [0,2,0,0,0,0|2,0,0]=4 5150 B9R0.18 COCCN(C)CCCBr Amb24396805 [0,2,0,0,0,0|2,0,0]=4 5151 B9R0.18 COCCN(C)CCCI Amb24450831 [0,2,0,0,0,0|2,0,0]=4 5152 B9R0.18 COCCN(C)CCON Amb24578153 [0,2,0,0,0,0|2,0,0]=4 5153 B9R0.18 COCCS(=O)CCCN Amb18177811 [0,2,0,0,0,0|1,1,0]=4 5154 B9R0.18 COCCS(=O)CCOC Amb24430778 [0,2,0,0,0,0|1,1,0]=4 5155 B9R0.18 COCC[C@@H](C)\C=C\CO Amb24481130 [0,2,0,0,0,0|1,0,1]=4 5156 B9R0.18 CSCCC(C)NCCN Amb25052624 [0,2,0,0,0,0|2,0,0]=4 5157 B9R0.18 CSCCN(C)CCCO Amb25244691 [0,2,0,0,0,0|2,0,0]=4 5158 B9R0.18 C[SiH](CCCC)CCCC Amb25330995 [0,2,0,0,0,0|2,0,0]=4 5159 B9R0.18 C\C=C\CC(O)CCCO Amb25333410 [0,2,0,0,0,0|1,0,1]=4 5160 B9R0.18 ClC(CCCCl)CCCCl Amb25097007 [0,2,0,0,0,0|2,0,0]=4 5161 B9R0.18 ClCCCN(CCOC)C Amb17334658 [0,2,0,0,0,0|2,0,0]=4 5162 B9R0.18 NC(CCCO)CCCO Amb24120396 [0,2,0,0,0,0|1,0,0]=3 5163 B9R0.18 NCCCC(N)CCCO Amb25084558 [0,2,0,0,0,0|1,0,0]=3 5164 B9R0.18 NCCNC(=O)OCCO Amb24426799 [0,2,0,0,0,0|1,0,1]=4 5165 B9R0.18 O=C(CCCF)OCCCl Amb25299277 [0,2,0,0,0,0|1,0,1]=4 5166 B9R0.18 OC(CCCCl)CCCCl Amb24482036 [0,2,0,0,0,0|2,0,0]=4 5167 B9R0.18 OC(CCCO)CCCO Amb24509343 [0,2,0,0,0,0|1,0,0]=3 5168 B9R0.18 OCCCC(F)CCCO Amb25191883 [0,2,0,0,0,0|1,0,0]=3 5169 B9R0.18 OCCCC(O)\C=C\CO Amb25056371 [0,2,0,0,0,0|1,0,1]=4 5170 B9R0.18 OCCCN(CCOC)C Amb17334275 [0,2,0,0,0,0|2,0,0]=4 5171 B9R0.18 OCCCS(=O)CCCO Amb25356372 [0,2,0,0,0,0|1,1,0]=4 5172 B9R0.18 OCCNC(=O)CCCCl Amb17323360 [0,2,0,0,0,0|1,0,1]=4 5173 B9R0.18 OCCNC(=O)CCCO Amb25147346 [0,2,0,0,0,0|1,0,1]=4 5174 B9R0.18 OCCNC(=O)OCCO Amb24661614 [0,2,0,0,0,0|1,0,1]=4 5175 B9R0.18 OCCOC(=O)NCCCl Amb24480499 [0,2,0,0,0,0|1,0,1]=4 5176 B9R0.18 OCCOC(=O)OCCO Amb24475868 [0,2,0,0,0,0|1,0,1]=4 5177 B9R0.18 OCCOP(=O)OCCCl Amb24739772 [0,2,0,0,0,0|2,0,0]=4 5178 B9R0.18 ON(CCCO)CCCO Amb25675475 [0,2,0,0,0,0|2,0,0]=4 5179 B9R0.34 CC(CC(F)CCN)CC Amb24396651 [0,2,0,0,0,0|2,0,0]=4 5180 B9R0.34 CC(CC(O)CCC)CO Amb24529165 [0,2,0,0,0,0|1,0,0]=3 5181 B9R0.34 CC(CC(O)CCN)CC Amb25127021 [0,2,0,0,0,0|2,0,0]=4 5182 B9R0.34 CC(CC(O)CO)CCO Amb25739814 [0,2,0,0,0,0|2,0,0]=4 5183 B9R0.34 CC(CC(O)COC)CO Amb25722680 [0,2,0,0,0,0|2,0,0]=4 5184 B9R0.34 CC(CCC)CC(C)CC Amb22229086 [0,2,0,0,0,0|2,0,0]=4 5185 B9R0.34 CC(CCC)CC(N)CC Amb25309654 [0,2,0,0,0,0|2,0,0]=4 5186 B9R0.34 CC(CCC)CC(O)CCl Amb24418324 [0,2,0,0,0,0|2,0,0]=4 5187 B9R0.34 CC(CCC)CC(O)CN Amb24718688 [0,2,0,0,0,0|2,0,0]=4 5188 B9R0.34 CC(CN)CS(=O)CCO Amb24690012 [0,2,0,0,0,0|1,1,0]=4 5189 B9R0.34 CC(CO)NC(C)COC Amb25768870 [0,2,0,0,0,0|2,0,0]=4 5190 B9R0.34 CC(CO)SC(C)CCO Amb24701877 [0,2,0,0,0,0|1,1,0]=4 5191 B9R0.34 CC(CS)CN(C)CCO Amb24363381 [0,2,0,0,0,0|2,0,0]=4 5192 B9R0.34 CCC(=O)CC(O)CCO Amb24662474 [0,2,0,0,0,0|1,0,1]=4 5193 B9R0.34 CCC(=O)OC(C)CCC Amb25044387 [0,2,0,0,0,0|1,0,1]=4 5194 B9R0.34 CCC(C)CC(=O)CCO Amb24676908 [0,2,0,0,0,0|1,0,0]=3 5195 B9R0.34 CCC(C)CC(C)CCBr Amb25276063 [0,2,0,0,0,0|2,0,0]=4 5196 B9R0.34 CCC(C)CC(C)CCO Amb24082763 [0,2,0,0,0,0|1,0,0]=3 5197 B9R0.34 CCC(C)CN(C)CCBr Amb24502386 [0,2,0,0,0,0|2,0,0]=4 5198 B9R0.34 CCC(C)CN(C)CCCl Amb18788257 [0,2,0,0,0,0|2,0,0]=4 5199 B9R0.34 CCC(C)NC(C)CCO Amb24721842 [0,2,0,0,0,0|2,0,0]=4 5200 B9R0.34 CCC(C)N[C@@H](C)CCO Amb25296023 [0,2,0,0,0,0|2,0,0]=4 5201 B9R0.34 CCC(C)N[C@H](C)CCO Amb24747999 [0,2,0,0,0,0|2,0,0]=4 5202 B9R0.34 CCC(C)OC(=O)CCC Amb22732903 [0,2,0,0,0,0|1,0,1]=4 5203 B9R0.34 CCC(C)SC(C)CCO Amb24440337 [0,2,0,0,0,0|2,0,0]=4 5204 B9R0.34 CCC(F)CN(C)CCO Amb24353958 [0,2,0,0,0,0|1,0,0]=3 5205 B9R0.34 CCCC(=O)CC(C)CC Amb25806879 [0,2,0,0,0,0|2,0,0]=4 5206 B9R0.34 CCCC(=O)N[C@H](C)CO Amb24460959 [0,2,0,0,0,0|1,0,1]=4 5207 B9R0.34 CCCC(=O)O[C@H](C)CCl Amb24658262 [0,2,0,0,0,0|1,0,1]=4 5208 B9R0.34 CCCC(C)CC(C)CCl Amb25853124 [0,2,0,0,0,0|2,0,0]=4 5209 B9R0.34 CCCC(C)CC(C)CN Amb24394211 [0,2,0,0,0,0|2,0,0]=4 5210 B9R0.34 CCCC(C)C[C@@H](C)CBr Amb24477136 [0,2,0,0,0,0|2,0,0]=4 5211 B9R0.34 CCCC(C)C[C@@H](C)CO Amb24588411 [0,2,0,0,0,0|1,0,0]=3 5212 B9R0.34 CCCC(C)NC(C)CCl Amb25282271 [0,2,0,0,0,0|2,0,0]=4 5213 B9R0.34 CCCC(C)NC(C)CF Amb25192414 [0,2,0,0,0,0|2,0,0]=4 5214 B9R0.34 CCCC(C)NC(C)CN Amb24381715 [0,2,0,0,0,0|2,0,0]=4 5215 B9R0.34 CCCC(C)OC(=O)CS Amb25710936 [0,2,0,0,0,0|0,1,1]=4 5216 B9R0.34 CCCC(C)OC(C)CN Amb24559051 [0,2,0,0,0,0|1,0,0]=3 5217 B9R0.34 CCCC(C)SC(C)CCl Amb24479695 [0,2,0,0,0,0|1,1,0]=4 5218 B9R0.34 CCCC(C)SC(C)CN Amb24479699 [0,2,0,0,0,0|1,1,0]=4 5219 B9R0.34 CCCC(C)SC(C)CO Amb25172867 [0,2,0,0,0,0|0,1,0]=3 5220 B9R0.34 CCCN(C)CC(C)CO Amb25677584 [0,2,0,0,0,0|2,0,0]=4 5221 B9R0.34 CCCN(C)CC(O)CC Amb24607822 [0,2,0,0,0,0|2,0,0]=4 5222 B9R0.34 CCCN(C)C[C@@H](O)CC Amb25094494 [0,2,0,0,0,0|2,0,0]=4 5223 B9R0.34 CCCN(C)C[C@H](N)CC Amb25096271 [0,2,0,0,0,0|2,0,0]=4 5224 B9R0.34 CCCN(C)C[C@H](O)CO Amb24471327 [0,2,0,0,0,0|2,0,0]=4 5225 B9R0.34 CCCS(=O)CC(N)CC Amb24524539 [0,2,0,0,0,0|1,1,0]=4 5226 B9R0.34 CCC[C@@H](C)C[C@@H](C)CBr Amb25756729 [0,2,0,0,0,0|2,0,0]=4 5227 B9R0.34 CCC[C@@H](C)C[C@H](C)CBr Amb24477137 [0,2,0,0,0,0|2,0,0]=4 5228 B9R0.34 CCC[C@@H](C)\C=C(\C)/CO Amb25762036 [0,2,0,0,0,0|1,0,1]=4 5229 B9R0.34 CCC[C@H](C)C[C@H](C)CO Amb25781733 [0,2,0,0,0,0|1,0,0]=3 5230 B9R0.34 CCOC(=O)O[C@H](C)CO Amb24625151 [0,2,0,0,0,0|1,0,1]=4 5231 B9R0.34 CCOC(C)O[C@@H](C)CO Amb25084384 [0,2,0,0,0,0|1,0,0]=3 5232 B9R0.34 CCOC(C)O[C@H](C)CO Amb22363059 [0,2,0,0,0,0|1,0,0]=3 5233 B9R0.34 CCS(=O)CC(N)CCO Amb24555006 [0,2,0,0,0,0|2,0,0]=4 5234 B9R0.34 CC[C@@H](O)CN(C)CCO Amb24583208 [0,2,0,0,0,0|1,0,0]=3 5235 B9R0.34 CC[C@@H](O)C[C@H](O)CCC Amb25092750 [0,2,0,0,0,0|2,0,0]=4 5236 B9R0.34 CC[C@H](O)CN(C)CCO Amb25729834 [0,2,0,0,0,0|1,0,0]=3 5237 B9R0.34 CN(CCO)CC(O)CF Amb24551624 [0,2,0,0,0,0|2,0,0]=4 5238 B9R0.34 CN(CCO)CC(O)CN Amb23443706 [0,2,0,0,0,0|2,0,0]=4 5239 B9R0.34 CN(CCO)C[C@H](O)CO Amb24721351 [0,2,0,0,0,0|2,0,0]=4 5240 B9R0.34 COC(C)CN(C)CCO Amb25138284 [0,2,0,0,0,0|2,0,0]=4 5241 B9R0.34 COCC(C)OC(=O)CO Amb24632862 [0,2,0,0,0,0|1,0,1]=4 5242 B9R0.34 C[C@@H](CO)NC(C)CCO Amb25145288 [0,2,0,0,0,0|2,0,0]=4 5243 B9R0.34 C[C@H](CC(Br)CCC)CC Amb25827553 [0,2,0,0,0,0|2,0,0]=4 5244 B9R0.34 C[C@H](CCO)C[C@@H](C)CO Amb24397963 [0,2,0,0,0,0|2,0,0]=4 5245 B9R0.34 C[C@H](CO)NC(C)CCO Amb25742141 [0,2,0,0,0,0|2,0,0]=4 5246 B9R0.34 OCCC(=O)NC(CC)C Amb17334240 [0,2,0,0,0,0|2,0,0]=4 5247 B9R0.34 OCCN(CC(CC)N)C Amb17505313 [0,2,0,0,0,0|1,0,0]=3 5248 B9R0.35 CC(CCC)C(=C)CCC Amb25174237 [0,2,0,0,0,0|2,0,0]=4 5249 B9R0.35 CC(CCC)C(=O)CCC Amb22230010 [0,2,0,0,0,0|2,0,0]=4 5250 B9R0.35 CC(CCC)C(Cl)CCC Amb24363883 [0,2,0,0,0,0|2,0,0]=4 5251 B9R0.35 CC(CCC)C(N)CCC Amb24524666 [0,2,0,0,0,0|2,0,0]=4 5252 B9R0.35 CC(CCC)C(O)CCC Amb22229849 [0,2,0,0,0,0|2,0,0]=4 5253 B9R0.35 CC(CCC)C(O)CCO Amb24403783 [0,2,0,0,0,0|1,0,0]=3 5254 B9R0.35 CC(CCN)S(=O)CCO Amb24662714 [0,2,0,0,0,0|1,1,0]=4 5255 B9R0.35 CC(CCO)C(C)CCO Amb24430126 [0,2,0,0,0,0|2,0,0]=4 5256 B9R0.35 CC(CCO)C(O)CCC Amb25801501 [0,2,0,0,0,0|1,0,0]=3 5257 B9R0.35 CC(CCO)C(O)CCO Amb25727747 [0,2,0,0,0,0|2,0,0]=4 5258 B9R0.35 CCCC(Br)C(=O)CCC Amb25732978 [0,2,0,0,0,0|2,0,0]=4 5259 B9R0.35 CCCC(Br)C(O)CCC Amb24640305 [0,2,0,0,0,0|2,0,0]=4 5260 B9R0.35 CCCC(C(CCC)C)C Amb10069377 [0,2,0,0,0,0|2,0,0]=4 5261 B9R0.35 CCCC(C)C(C)CCN Amb25070997 [0,2,0,0,0,0|2,0,0]=4 5262 B9R0.35 CCCC(C)N(C)CCBr Amb24394585 [0,2,0,0,0,0|2,0,0]=4 5263 B9R0.35 CCCC(C)N(C)CCCl Amb18788258 [0,2,0,0,0,0|2,0,0]=4 5264 B9R0.35 CCCC(C)N(C)CCF Amb25740786 [0,2,0,0,0,0|2,0,0]=4 5265 B9R0.35 CCCC(C)S(=O)CCN Amb25172865 [0,2,0,0,0,0|1,1,0]=4 5266 B9R0.35 CCCC(Cl)C(Cl)CCC Amb25853530 [0,2,0,0,0,0|2,0,0]=4 5267 B9R0.35 CCCC(N)C(=O)CCC Amb25340172 [0,2,0,0,0,0|2,0,0]=4 5268 B9R0.35 CCCC(N)C(N)CCC Amb18124701 [0,2,0,0,0,0|2,0,0]=4 5269 B9R0.35 CCCC(O)C(O)CCC Amb24571201 [0,2,0,0,0,0|2,0,0]=4 5270 B9R0.35 CCC[C@@H](Br)[C@@H](F)CCC Amb24579459 [0,2,0,0,0,0|2,0,0]=4 5271 B9R0.35 CCC[C@@H](Br)[C@H](O)CCC Amb25278222 [0,2,0,0,0,0|2,0,0]=4 5272 B9R0.35 CCC[C@@H](Cl)[C@@H](O)CCC Amb24482377 [0,2,0,0,0,0|2,0,0]=4 5273 B9R0.35 CCC[C@@H](N)[C@H](N)CCC Amb25789985 [0,2,0,0,0,0|2,0,0]=4 5274 B9R0.35 CCC[C@@H](O)C(=O)CCC Amb24686539 [0,2,0,0,0,0|2,0,0]=4 5275 B9R0.35 CCC[C@@H](O)[C@@H](N)CCC Amb25337173 [0,2,0,0,0,0|2,0,0]=4 5276 B9R0.35 CCC[C@H](Cl)[C@H](O)CCC Amb24634205 [0,2,0,0,0,0|2,0,0]=4 5277 B9R0.35 CCC[C@H](N)[C@@H](N)CCC Amb25698275 [0,2,0,0,0,0|2,0,0]=4 5278 B9R0.35 COCC(C)N(C)CCO Amb25062131 [0,2,0,0,0,0|2,0,0]=4 5279 B9R0.35 C[C@@H](CCC)[C@@H](O)CCC Amb25801955 [0,2,0,0,0,0|2,0,0]=4 5280 B9R0.35 C[C@@H](CCC)[C@@H](O)CCO Amb24482528 [0,2,0,0,0,0|1,0,0]=3 5281 B9R0.35 C[C@@H](CCC)[C@H](O)CCC Amb25200289 [0,2,0,0,0,0|2,0,0]=4 5282 B9R0.35 C[C@@H](CCO)[C@@H](O)CCO Amb24481135 [0,2,0,0,0,0|2,0,0]=4 5283 B9R0.35 C[C@@H](CCO)[C@H](O)CCO Amb24361454 [0,2,0,0,0,0|2,0,0]=4 5284 B9R0.35 C[C@H](CCC)C(=O)CCC Amb25027946 [0,2,0,0,0,0|2,0,0]=4 5285 B9R0.35 C[C@H](CCC)[C@@H](O)CCC Amb25769367 [0,2,0,0,0,0|2,0,0]=4 5286 B9R0.35 C[C@H](CCO)[C@H](O)CCO Amb24748550 [0,2,0,0,0,0|2,0,0]=4 5287 B9R0.35 O[C@H](CCO)[C@H](O)CCO Amb24674710 [0,2,0,0,0,0|2,0,0]=4 5288 B9R0.40 C#CC(CCO)CCCO Amb25343789 [0,2,0,0,0,0|2,0,0]=4 5289 B9R0.40 C=C=C(CCO)CCCO Amb25356394 [0,2,0,0,0,0|2,0,0]=4 5290 B9R0.40 CCC(CCC)CCCC Amb25335776 [0,2,0,0,0,0|2,0,0]=4 5291 B9R0.40 CCC(CCC)NCCN Amb24716644 [0,2,0,0,0,0|2,0,0]=4 5292 B9R0.40 CCC(CCC)OCCO Amb25714490 [0,2,0,0,0,0|0,0,0]=2 5293 B9R0.40 CCC(CCC)SCCC Amb25169398 [0,2,0,0,0,0|1,1,0]=4 5294 B9R0.40 CCC(CCN)CCCO Amb24647618 [0,2,0,0,0,0|2,0,0]=4 5295 B9R0.40 CCC(CCO)CCCO Amb24524428 [0,2,0,0,0,0|2,0,0]=4 5296 B9R0.40 CCC(CCO)NCCC Amb25092100 [0,2,0,0,0,0|2,0,0]=4 5297 B9R0.40 CCC(CCO)NCCO Amb25794700 [0,2,0,0,0,0|2,0,0]=4 5298 B9R0.40 CCC(COC)NCCO Amb24407189 [0,2,0,0,0,0|2,0,0]=4 5299 B9R0.40 CCC(OCCO)OCC Amb25332336 [0,2,0,0,0,0|1,0,0]=3 5300 B9R0.40 CCCC(C#C)NCCN Amb24401961 [0,2,0,0,0,0|2,0,0]=4 5301 B9R0.40 CCCC(C#N)NCCO Amb24476789 [0,2,0,0,0,0|1,0,0]=3 5302 B9R0.40 CCCC(C=O)OCCO Amb24710505 [0,2,0,0,0,0|0,0,0]=2 5303 B9R0.40 CCCC(CCCBr)OC Amb23538200 [0,2,0,0,0,0|2,0,0]=4 5304 B9R0.40 CCCC(CCCC)NN Amb25275529 [0,2,0,0,0,0|2,0,0]=4 5305 B9R0.40 CCCC(CCCC)[Mg]Br Amb22897347 [0,2,0,0,0,0|2,0,0]=4 5306 B9R0.40 CCCC(CCCC)[Zn]Br Amb22897859 [0,2,0,0,0,0|2,0,0]=4 5307 B9R0.40 CCCC(CCCCl)OC Amb23538334 [0,2,0,0,0,0|2,0,0]=4 5308 B9R0.40 CCCC(CCCN)OC Amb23538352 [0,2,0,0,0,0|2,0,0]=4 5309 B9R0.40 CCCC(CCCO)OC Amb23538341 [0,2,0,0,0,0|1,0,0]=3 5310 B9R0.40 CCCC(CCl)CCCC Amb25206828 [0,2,0,0,0,0|2,0,0]=4 5311 B9R0.40 CCCC(CN)CCCC Amb20632050 [0,2,0,0,0,0|2,0,0]=4 5312 B9R0.40 CCCC(CN)CCCCl Amb24585144 [0,2,0,0,0,0|2,0,0]=4 5313 B9R0.40 CCCC(CN)OCC=C Amb25262023 [0,2,0,0,0,0|1,0,1]=4 5314 B9R0.40 CCCC(CN)OCCO Amb25769435 [0,2,0,0,0,0|0,0,0]=2 5315 B9R0.40 CCCC(CO)C#CCO Amb24362865 [0,2,0,0,0,0|1,0,1]=4 5316 B9R0.40 CCCC(CO)NCCO Amb24712560 [0,2,0,0,0,0|1,0,0]=3 5317 B9R0.40 CCCC(CO)NCCS Amb25771931 [0,2,0,0,0,0|1,1,0]=4 5318 B9R0.40 CCCC(\C=C\CO)OC Amb25796422 [0,2,0,0,0,0|1,0,1]=4 5319 B9R0.40 CCCCC(=CCO)OC Amb24533542 [0,2,0,0,0,0|1,0,1]=4 5320 B9R0.40 CCCCC(CCBr)C=C Amb24392849 [0,2,0,0,0,0|2,0,0]=4 5321 B9R0.40 CCCCC(CCBr)CC Amb25351555 [0,2,0,0,0,0|2,0,0]=4 5322 B9R0.40 CCCCC(CCN)CN Amb24761458 [0,2,0,0,0,0|2,0,0]=4 5323 B9R0.40 CCCCC(CCO)C#C Amb25676720 [0,2,0,0,0,0|1,0,0]=3 5324 B9R0.40 CCCCC(CCO)NC Amb24351408 [0,2,0,0,0,0|1,0,0]=3 5325 B9R0.40 CCCCN(CCBr)C#N Amb17674262 [0,2,0,0,0,0|2,0,0]=4 5326 B9R0.40 CCCCN(CCBr)CC Amb24660437 [0,2,0,0,0,0|2,0,0]=4 5327 B9R0.40 CCCCN(CCCl)CC Amb18788261 [0,2,0,0,0,0|2,0,0]=4 5328 B9R0.40 CCCCN(CCO)N=O Amb25083958 [0,2,0,0,0,0|1,0,0]=3 5329 B9R0.40 CCCCN(CCO)OC Amb25078906 [0,2,0,0,0,0|1,0,0]=3 5330 B9R0.40 CCCC[C@@H](CCBr)CC Amb24477313 [0,2,0,0,0,0|2,0,0]=4 5331 B9R0.40 CCCNC(CCC)C=C Amb24715546 [0,2,0,0,0,0|2,0,0]=4 5332 B9R0.40 CCCNC(CO)CCC Amb25116956 [0,2,0,0,0,0|2,0,0]=4 5333 B9R0.40 CCCN[C@H](CN)CCC Amb25344103 [0,2,0,0,0,0|2,0,0]=4 5334 B9R0.40 CCCOC(CBr)CCC Amb25834935 [0,2,0,0,0,0|1,0,0]=3 5335 B9R0.40 CCCOC(CN)CCC Amb24372582 [0,2,0,0,0,0|1,0,0]=3 5336 B9R0.40 CCC[C@@H](C#N)SCCO Amb25801269 [0,2,0,0,0,0|0,1,0]=3 5337 B9R0.40 CCC[C@@H](C=O)OCC=C Amb24645367 [0,2,0,0,0,0|1,0,1]=4 5338 B9R0.40 CCC[C@@H](CCCO)CO Amb25713598 [0,2,0,0,0,0|1,0,0]=3 5339 B9R0.40 CCC[C@@H](CN)NCCO Amb25137658 [0,2,0,0,0,0|1,0,0]=3 5340 B9R0.40 CCC[C@@H](CO)CCCC Amb24583777 [0,2,0,0,0,0|2,0,0]=4 5341 B9R0.40 CCC[C@H](CCCO)CO Amb25677516 [0,2,0,0,0,0|1,0,0]=3 5342 B9R0.40 CCC[C@H](CO)CCCC Amb25080333 [0,2,0,0,0,0|2,0,0]=4 5343 B9R0.40 CCN(CCO)CCCCl Amb18788422 [0,2,0,0,0,0|2,0,0]=4 5344 B9R0.40 CCN(CCO)CCCI Amb24482684 [0,2,0,0,0,0|2,0,0]=4 5345 B9R0.40 CCN(CCO)CCCS Amb25059029 [0,2,0,0,0,0|2,0,0]=4 5346 B9R0.40 CCN(CCO)CCNC Amb24679784 [0,2,0,0,0,0|2,0,0]=4 5347 B9R0.40 CCN(CCO)CCOC Amb24713284 [0,2,0,0,0,0|2,0,0]=4 5348 B9R0.40 CCOC(C#C)OCCCl Amb25118653 [0,2,0,0,0,0|2,0,0]=4 5349 B9R0.40 CCOC(CCl)OCCCl Amb25774628 [0,2,0,0,0,0|2,0,0]=4 5350 B9R0.40 COCC(CN)SCCO Amb25302513 [0,2,0,0,0,0|1,1,0]=4 5351 B9R0.40 COCC(CO)OCCN Amb24550673 [0,2,0,0,0,0|2,0,0]=4 5352 B9R0.40 COCOC(CCC)C=O Amb24478222 [0,2,0,0,0,0|2,0,0]=4 5353 B9R0.40 CON(CCO)CCCF Amb25305916 [0,2,0,0,0,0|2,0,0]=4 5354 B9R0.40 CON(CCO)CCSC Amb24482862 [0,2,0,0,0,0|2,0,0]=4 5355 B9R0.40 CO[C@H](CCO)CCCO Amb25740662 [0,2,0,0,0,0|2,0,0]=4 5356 B9R0.40 CSC(CCC)CCCC Amb24450538 [0,2,0,0,0,0|2,0,0]=4 5357 B9R0.40 N#CN(CCO)CCCO Amb24546461 [0,2,0,0,0,0|2,0,0]=4 5358 B9R0.40 OCC(CCO)CCCO Amb25145340 [0,2,0,0,0,0|2,0,0]=4 5359 B9R0.40 OCC(CCO)OCCO Amb25271385 [0,2,0,0,0,0|1,0,0]=3 5360 B9R0.40 OCCC(CCCO)C=O Amb25040037 [0,2,0,0,0,0|2,0,0]=4 5361 B9R0.48 CC(=C)CCC(O)CCO Amb24475141 [0,2,0,0,0,0|1,0,1]=4 5362 B9R0.48 CC(Br)CCN(C)CCF Amb25323654 [0,2,0,0,0,0|2,0,0]=4 5363 B9R0.48 CC(C)CCC(Br)CCBr Amb23456166 [0,2,0,0,0,0|2,0,0]=4 5364 B9R0.48 CC(C)CCC(C)CCN Amb24477979 [0,2,0,0,0,0|2,0,0]=4 5365 B9R0.48 CC(C)CCC(Cl)=CCO Amb25126989 [0,2,0,0,0,0|1,0,1]=4 5366 B9R0.48 CC(C)CCC(Cl)CCC Amb25080274 [0,2,0,0,0,0|2,0,0]=4 5367 B9R0.48 CC(C)CCC(N)CCO Amb18831259 [0,2,0,0,0,0|1,0,0]=3 5368 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|2,0,0]=4 5369 B9R0.48 CC(C)CCC(O)CCO Amb23456160 [0,2,0,0,0,0|1,0,0]=3 5370 B9R0.48 CC(C)CCN(C)CCBr Amb24478051 [0,2,0,0,0,0|2,0,0]=4 5371 B9R0.48 CC(C)CCN(C)CCI Amb25285392 [0,2,0,0,0,0|2,0,0]=4 5372 B9R0.48 CC(C)CC[C@H](C)CCO Amb24719731 [0,2,0,0,0,0|1,0,0]=3 5373 B9R0.48 CC(C)CNC(C)CCO Amb24362258 [0,2,0,0,0,0|2,0,0]=4 5374 B9R0.48 CC(C)COC(=O)CCO Amb24378616 [0,2,0,0,0,0|2,0,0]=4 5375 B9R0.48 CC(C)COC(Cl)CCCl Amb24482262 [0,2,0,0,0,0|2,0,0]=4 5376 B9R0.48 CC(C)CSC(C)CCO Amb25138921 [0,2,0,0,0,0|2,0,0]=4 5377 B9R0.48 CC(C)NCC(C)CCO Amb25726962 [0,2,0,0,0,0|2,0,0]=4 5378 B9R0.48 CC(C)OCC(Br)CCO Amb25103622 [0,2,0,0,0,0|2,0,0]=4 5379 B9R0.48 CC(CCC(C)O)COC Amb25378257 [0,2,0,0,0,0|2,0,0]=4 5380 B9R0.48 CC(CCC)NCC(F)F Amb18177866 [0,2,0,0,0,0|2,0,0]=4 5381 B9R0.48 CC(CCN)NCC(C)O Amb20090514 [0,2,0,0,0,0|2,0,0]=4 5382 B9R0.48 CC(CCN)SCC(C)O Amb24701880 [0,2,0,0,0,0|1,1,0]=4 5383 B9R0.48 CC(CCO)SCC(C)N Amb25088005 [0,2,0,0,0,0|2,0,0]=4 5384 B9R0.48 CC(CNC)OCC(C)O Amb24644350 [0,2,0,0,0,0|1,0,0]=3 5385 B9R0.48 CC(CNC)OCC(F)F Amb18796699 [0,2,0,0,0,0|2,0,0]=4 5386 B9R0.48 CC(CSC)NC[C@H](C)O Amb24663678 [0,2,0,0,0,0|2,0,0]=4 5387 B9R0.48 CC(N)CCN(C)CCN Amb24359889 [0,2,0,0,0,0|2,0,0]=4 5388 B9R0.48 CC(N)CCS(=O)CCF Amb24572970 [0,2,0,0,0,0|1,1,0]=4 5389 B9R0.48 CC(O)C#CC(O)CCC Amb25204473 [0,2,0,0,0,0|1,0,1]=4 5390 B9R0.48 CC(O)CCC(O)COC Amb24529314 [0,2,0,0,0,0|2,0,0]=4 5391 B9R0.48 CC(O)CCN(C)CCF Amb24665047 [0,2,0,0,0,0|2,0,0]=4 5392 B9R0.48 CC(O)CCN(C)CCI Amb25204861 [0,2,0,0,0,0|2,0,0]=4 5393 B9R0.48 CC(O)CNC(C)CCO Amb25048906 [0,2,0,0,0,0|2,0,0]=4 5394 B9R0.48 CC(O)CSC(C)CCO Amb24373349 [0,2,0,0,0,0|1,1,0]=4 5395 B9R0.48 CCCC(=O)NC[C@@H](C)O Amb24524667 [0,2,0,0,0,0|1,0,1]=4 5396 B9R0.48 CCCC(=O)OCC(F)F Amb22008230 [0,2,0,0,0,0|1,0,1]=4 5397 B9R0.48 CCCC(=O)OC[C@@H](C)O Amb24481127 [0,2,0,0,0,0|0,0,1]=3 5398 B9R0.48 CCCC(=O)OC[C@H](C)O Amb25105938 [0,2,0,0,0,0|0,0,1]=3 5399 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [0,2,0,0,0,0|1,0,1]=4 5400 B9R0.48 CCCC(C)CCB(O)O Amb25104756 [0,2,0,0,0,0|2,0,0]=4 5401 B9R0.48 CCCC(C)CCC(C)Br Amb25805955 [0,2,0,0,0,0|2,0,0]=4 5402 B9R0.48 CCCC(C)CCC(C)N Amb25775537 [0,2,0,0,0,0|2,0,0]=4 5403 B9R0.48 CCCC(C)NCC(C)Cl Amb25341725 [0,2,0,0,0,0|2,0,0]=4 5404 B9R0.48 CCCC(C)OCC(=C)Br Amb25698155 [0,2,0,0,0,0|1,0,1]=4 5405 B9R0.48 CCCC(C)OCC(C)O Amb24504646 [0,2,0,0,0,0|0,0,0]=2 5406 B9R0.48 CCCC(C)OCC(N)=N Amb24481038 [0,2,0,0,0,0|1,0,1]=4 5407 B9R0.48 CCCC(C)OCC(N)=O Amb25227310 [0,2,0,0,0,0|0,0,2]=4 5408 B9R0.48 CCCC(C)OCC(O)=O Amb18124782 [0,2,0,0,0,0|0,0,1]=3 5409 B9R0.48 CCCC(C)OC[C@@H](C)O Amb24441315 [0,2,0,0,0,0|0,0,0]=2 5410 B9R0.48 CCCC(C)SCC(C)N Amb24703352 [0,2,0,0,0,0|1,1,0]=4 5411 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [0,2,0,0,0,0|1,0,1]=4 5412 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [0,2,0,0,0,0|1,0,1]=4 5413 B9R0.48 CCCC(O)CCC(F)F Amb24735275 [0,2,0,0,0,0|2,0,0]=4 5414 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [0,2,0,0,0,0|1,0,1]=4 5415 B9R0.48 CCCN(C)CCC(C)O Amb25304938 [0,2,0,0,0,0|2,0,0]=4 5416 B9R0.48 CCCS(=O)NC[C@H](C)O Amb24565197 [0,2,0,0,0,0|2,0,0]=4 5417 B9R0.48 CCC[C@@H](C)CCC(C)O Amb25806670 [0,2,0,0,0,0|1,0,0]=3 5418 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [0,2,0,0,0,0|1,0,1]=4 5419 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [0,2,0,0,0,0|1,0,1]=4 5420 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [0,2,0,0,0,0|1,0,1]=4 5421 B9R0.48 CCOC(=O)OC[C@@H](C)O Amb24583968 [0,2,0,0,0,0|1,0,1]=4 5422 B9R0.48 CN(CCO)CCS(C)=O Amb24548435 [0,2,0,0,0,0|2,0,0]=4 5423 B9R0.48 COCC(=O)OCC(C)O Amb24482899 [0,2,0,0,0,0|1,0,1]=4 5424 B9R0.48 COCC(C)OCC(C)Br Amb25365204 [0,2,0,0,0,0|2,0,0]=4 5425 B9R0.48 COCC(C)OCC(C)N Amb24428299 [0,2,0,0,0,0|2,0,0]=4 5426 B9R0.48 COCC(C)OCC(C)O Amb24064024 [0,2,0,0,0,0|1,0,0]=3 5427 B9R0.48 COCC(C)OC[C@@H](C)N Amb25073888 [0,2,0,0,0,0|2,0,0]=4 5428 B9R0.48 COCC(C)OC[C@@H](C)O Amb25145657 [0,2,0,0,0,0|1,0,0]=3 5429 B9R0.48 COCC(C)OC[C@H](C)O Amb24465390 [0,2,0,0,0,0|1,0,0]=3 5430 B9R0.48 C[C@H](CCO)CCC(C)=O Amb25319945 [0,2,0,0,0,0|1,0,1]=4 5431 B9R0.48 C[C@H](O)CSC(C)CCO Amb25137385 [0,2,0,0,0,0|1,1,0]=4 5432 B9R0.48 ClCCN(CCC(C)C)C Amb17334594 [0,2,0,0,0,0|2,0,0]=4 5433 B9R0.48 OCCC(=O)NCC(C)C Amb17334239 [0,2,0,0,0,0|2,0,0]=4 5434 B9R0.66 CC(C)(CC#C)OCCO Amb25087183 [0,2,0,0,0,0|0,0,2]=4 5435 B9R0.66 CC(C)(CCC)CCCC Amb22052712 [0,2,0,0,0,0|2,0,0]=4 5436 B9R0.66 CC(C)(CCC)NCCC Amb25663375 [0,2,0,0,0,0|2,0,0]=4 5437 B9R0.66 CC(C)(CCO)NCCO Amb24363765 [0,2,0,0,0,0|2,0,0]=4 5438 B9R0.66 CC(Cl)(CCC)CCCC Amb25840834 [0,2,0,0,0,0|2,0,0]=4 5439 B9R0.66 CCCC(C)(C)CCCO Amb25333396 [0,2,0,0,0,0|1,0,0]=3 5440 B9R0.66 CCCC(C)(C)NCCF Amb25711125 [0,2,0,0,0,0|2,0,0]=4 5441 B9R0.66 CCCC(C)(C)NCCN Amb24363082 [0,2,0,0,0,0|2,0,0]=4 5442 B9R0.66 CCCC(C)(C)NCCO Amb24427747 [0,2,0,0,0,0|1,0,0]=3 5443 B9R0.66 CCCC(C)(N)CCCO Amb25147361 [0,2,0,0,0,0|1,0,0]=3 5444 B9R0.66 CCCCC(C)(C)CCN Amb24746135 [0,2,0,0,0,0|2,0,0]=4 5445 B9R0.66 CCCCC(C)(N)CCO Amb25090342 [0,2,0,0,0,0|1,0,0]=3 5446 B9R0.66 CCCCC(Cl)(Cl)CCN Amb24661149 [0,2,0,0,0,0|2,0,0]=4 5447 B9R0.66 CCCCS(=O)(=O)CCBr Amb10669586 [0,2,0,0,0,0|1,1,0]=4 5448 B9R0.66 CCCCS(=O)(=O)CCF Amb25686355 [0,2,0,0,0,0|1,1,0]=4 5449 B9R0.66 CCCCS(=O)(=O)CCO Amb10669567 [0,2,0,0,0,0|0,1,0]=3 5450 B9R0.66 CCCC[N+](C)(C)CCO Amb25296296 [0,2,0,0,0,0|1,0,0]=3 5451 B9R0.66 CCCC[Si](Cl)(Cl)CCCl Amb25039970 [0,2,0,0,0,0|2,0,0]=4 5452 B9R0.66 CCCS(=O)(=O)CCCC Amb24482926 [0,2,0,0,0,0|1,1,0]=4 5453 B9R0.66 CCCS(=O)(=O)CCCO Amb17138615 [0,2,0,0,0,0|2,0,0]=4 5454 B9R0.66 CCCS(=O)(=O)OCCO Amb25796414 [0,2,0,0,0,0|1,0,0]=3 5455 B9R0.66 CCCS(=O)(=O)SCCO Amb25357614 [0,2,0,0,0,0|1,1,0]=4 5456 B9R0.66 CCC[Si](C)(C)OCCCl Amb24482289 [0,2,0,0,0,0|1,1,0]=4 5457 B9R0.66 CCNCC(C)(C)CCO Amb25192047 [0,2,0,0,0,0|2,0,0]=4 5458 B9R0.66 CCOP(N)(=O)OCCO Amb25041837 [0,2,0,0,0,0|2,0,0]=4 5459 B9R0.66 CCOP(O)(=O)OCCO Amb24733898 [0,2,0,0,0,0|2,0,0]=4 5460 B9R0.66 CNCC(CCCO)(C)C Amb17569966 [0,2,0,0,0,0|2,0,0]=4 5461 B9R0.66 CNCCC(CCO)(C)C Amb17569965 [0,2,0,0,0,0|2,0,0]=4 5462 B9R0.66 CNCCS(=O)(=O)CCO Amb24545848 [0,2,0,0,0,0|1,1,0]=4 5463 B9R0.66 COCC(C)(C)NCCO Amb25687046 [0,2,0,0,0,0|2,0,0]=4 5464 B9R0.66 CSCC[N+](C)(C)CCO Amb25846248 [0,2,0,0,0,0|2,0,0]=4 5465 B9R0.66 C[N+](C)(CCO)CCC[*] Amb19131980 [0,2,0,0,0,0|2,0,0]=4 5466 B9R0.66 NCCCS(=O)(=O)CCO Amb17500832 [0,2,0,0,0,0|1,1,0]=4 5467 B9R0.66 OCCCS(=O)(=O)CCO Amb17502969 [0,2,0,0,0,0|1,1,0]=4 5468 B9R0.2 BrCCCCCCC(=O)O Amb10071514 [0,2,0,0,0,0|1,0,1]=4 5469 B9R0.2 CC#CCCCCC(C)O Amb25146924 [0,2,0,0,0,0|1,0,1]=4 5470 B9R0.2 CC#CCOCCC(O)=O Amb24393140 [0,2,0,0,0,0|0,0,2]=4 5471 B9R0.2 CC(=C)CCCC#CCO Amb25848587 [0,2,0,0,0,0|1,0,1]=4 5472 B9R0.2 CC(=C)CCC\C=C\CO Amb24464660 [0,2,0,0,0,0|1,0,1]=4 5473 B9R0.2 CC(=C)CCOCCC#N Amb24524414 [0,2,0,0,0,0|1,0,1]=4 5474 B9R0.2 CC(=C)CCOCCC=O Amb24354701 [0,2,0,0,0,0|0,0,2]=4 5475 B9R0.2 CC(=C)CCOCCCBr Amb25098731 [0,2,0,0,0,0|1,0,1]=4 5476 B9R0.2 CC(=C)CCOCCCCl Amb25822519 [0,2,0,0,0,0|1,0,1]=4 5477 B9R0.2 CC(=C)CCOCCCS Amb25058112 [0,2,0,0,0,0|0,1,1]=4 5478 B9R0.2 CC(=C)CC\C=C\CCO Amb24422820 [0,2,0,0,0,0|1,0,1]=4 5479 B9R0.2 CC(=C)CNCCCCO Amb24377753 [0,2,0,0,0,0|1,0,1]=4 5480 B9R0.2 CC(=O)CCC#CCCO Amb25096345 [0,2,0,0,0,0|1,0,1]=4 5481 B9R0.2 CC(=O)CCCCCCBr Amb24436166 [0,2,0,0,0,0|2,0,0]=4 5482 B9R0.2 CC(=O)CCCCCCF Amb25050277 [0,2,0,0,0,0|2,0,0]=4 5483 B9R0.2 CC(=O)CCCCCCN Amb25147578 [0,2,0,0,0,0|2,0,0]=4 5484 B9R0.2 CC(=O)CCCCCCO Amb25728037 [0,2,0,0,0,0|1,0,0]=3 5485 B9R0.2 CC(=O)CCCOCC#C Amb25146553 [0,2,0,0,0,0|1,0,1]=4 5486 B9R0.2 CC(=O)CCCOCCO Amb25265612 [0,2,0,0,0,0|0,0,0]=2 5487 B9R0.2 CC(=O)CCC\C=C/CO Amb25146607 [0,2,0,0,0,0|1,0,1]=4 5488 B9R0.2 CC(=O)CCC\C=C\CO Amb25297110 [0,2,0,0,0,0|1,0,1]=4 5489 B9R0.2 CC(=O)CCNCCCO Amb24704454 [0,2,0,0,0,0|1,0,1]=4 5490 B9R0.2 CC(=O)CCOCCCBr Amb25274435 [0,2,0,0,0,0|1,0,1]=4 5491 B9R0.2 CC(=O)CCOCCCN Amb18111574 [0,2,0,0,0,0|1,0,1]=4 5492 B9R0.2 CC(=O)CCOCCCO Amb25094277 [0,2,0,0,0,0|0,0,1]=3 5493 B9R0.2 CC(=O)CCONCCC Amb22369235 [0,2,0,0,0,0|1,0,1]=4 5494 B9R0.2 CC(=O)CC\C=C\CCO Amb24587265 [0,2,0,0,0,0|1,0,1]=4 5495 B9R0.2 CC(=O)CSCCCCO Amb24504843 [0,2,0,0,0,0|1,0,1]=4 5496 B9R0.2 CC(=O)NCCOCCN Amb16233780 [0,2,0,0,0,0|1,0,1]=4 5497 B9R0.2 CC(=O)NCCOCCO Amb24477952 [0,2,0,0,0,0|0,0,1]=3 5498 B9R0.2 CC(=O)OCCOCCO Amb22728942 [0,2,0,0,0,0|0,0,1]=3 5499 B9R0.2 CC(Br)CCCCCC#C Amb25136440 [0,2,0,0,0,0|2,0,0]=4 5500 B9R0.2 CC(C)=CCCNCCO Amb24547984 [0,2,0,0,0,0|1,0,1]=4 5501 B9R0.2 CC(C)=CCOCCCO Amb25697595 [0,2,0,0,0,0|0,0,2]=4 5502 B9R0.2 CC(C)CCCC#CCO Amb25052255 [0,2,0,0,0,0|1,0,1]=4 5503 B9R0.2 CC(C)CCCCCC#N Amb18643473 [0,2,0,0,0,0|2,0,0]=4 5504 B9R0.2 CC(C)CCCCCC=O Amb22233123 [0,2,0,0,0,0|1,0,1]=4 5505 B9R0.2 CC(C)CCCCCCBr Amb20240805 [0,2,0,0,0,0|2,0,0]=4 5506 B9R0.2 CC(C)CCCCCCCl Amb24425622 [0,2,0,0,0,0|2,0,0]=4 5507 B9R0.2 CC(C)CCCNCCCl Amb25112681 [0,2,0,0,0,0|2,0,0]=4 5508 B9R0.2 CC(C)CCCNCCI Amb24400137 [0,2,0,0,0,0|2,0,0]=4 5509 B9R0.2 CC(C)CCCNCCO Amb24476742 [0,2,0,0,0,0|1,0,0]=3 5510 B9R0.2 CC(C)CCCOCC=O Amb24478019 [0,2,0,0,0,0|0,0,2]=4 5511 B9R0.2 CC(C)CCCOCCO Amb25349307 [0,2,0,0,0,0|0,0,0]=2 5512 B9R0.2 CC(C)CCCSCCCl Amb25776374 [0,2,0,0,0,0|1,1,0]=4 5513 B9R0.2 CC(C)CCNCCCBr Amb24340144 [0,2,0,0,0,0|2,0,0]=4 5514 B9R0.2 CC(C)CCNCCCF Amb24760970 [0,2,0,0,0,0|2,0,0]=4 5515 B9R0.2 CC(C)CCOCCC=O Amb24476862 [0,2,0,0,0,0|0,0,1]=3 5516 B9R0.2 CC(C)CCSCCC#C Amb24479645 [0,2,0,0,0,0|1,1,0]=4 5517 B9R0.2 CC(C)CCSCCC#N Amb18261673 [0,2,0,0,0,0|1,1,0]=4 5518 B9R0.2 CC(C)CCSCCC=C Amb24482401 [0,2,0,0,0,0|1,1,0]=4 5519 B9R0.2 CC(C)CCSCCCBr Amb25358052 [0,2,0,0,0,0|1,1,0]=4 5520 B9R0.2 CC(C)CCSCCCS Amb25055353 [0,2,0,0,0,0|0,2,0]=4 5521 B9R0.2 CC(C)CNCCCCF Amb25256367 [0,2,0,0,0,0|2,0,0]=4 5522 B9R0.2 CC(C)CNCCCCI Amb24570093 [0,2,0,0,0,0|2,0,0]=4 5523 B9R0.2 CC(C)COCCCCCl Amb18798375 [0,2,0,0,0,0|1,0,0]=3 5524 B9R0.2 CC(C)COCCCCS Amb25058327 [0,2,0,0,0,0|1,0,0]=3 5525 B9R0.2 CC(C)COCCOCCl Amb25245998 [0,2,0,0,0,0|2,0,0]=4 5526 B9R0.2 CC(C)COCOCCCl Amb24401491 [0,2,0,0,0,0|1,0,0]=3 5527 B9R0.2 CC(C)COCOCCO Amb25795108 [0,2,0,0,0,0|0,0,0]=2 5528 B9R0.2 CC(C)CONCCCO Amb24434254 [0,2,0,0,0,0|2,0,0]=4 5529 B9R0.2 CC(C)CSCCCCCl Amb18184970 [0,2,0,0,0,0|1,1,0]=4 5530 B9R0.2 CC(C)CSCCCCS Amb24748171 [0,2,0,0,0,0|1,1,0]=4 5531 B9R0.2 CC(C)CSCCCON Amb24608485 [0,2,0,0,0,0|2,0,0]=4 5532 B9R0.2 CC(C)C\C=C\CCCO Amb25802012 [0,2,0,0,0,0|1,0,1]=4 5533 B9R0.2 CC(C)NCCCCCBr Amb24694234 [0,2,0,0,0,0|2,0,0]=4 5534 B9R0.2 CC(C)NCCCCCN Amb21953734 [0,2,0,0,0,0|2,0,0]=4 5535 B9R0.2 CC(C)NCCNCCO Amb24669217 [0,2,0,0,0,0|1,0,0]=3 5536 B9R0.2 CC(C)NCCOCC#C Amb24476714 [0,2,0,0,0,0|1,0,1]=4 5537 B9R0.2 CC(C)NCCOCC=O Amb24480799 [0,2,0,0,0,0|0,0,2]=4 5538 B9R0.2 CC(C)NCCOCCBr Amb24549060 [0,2,0,0,0,0|1,0,0]=3 5539 B9R0.2 CC(C)NCCSCCN Amb18798167 [0,2,0,0,0,0|1,1,0]=4 5540 B9R0.2 CC(C)NCCSCCO Amb18798246 [0,2,0,0,0,0|0,1,0]=3 5541 B9R0.2 CC(C)OCCCCCBr Amb25060878 [0,2,0,0,0,0|2,0,0]=4 5542 B9R0.2 CC(C)OCCCCCN Amb25049832 [0,2,0,0,0,0|2,0,0]=4 5543 B9R0.2 CC(C)OCCCCCS Amb25788551 [0,2,0,0,0,0|1,1,0]=4 5544 B9R0.2 CC(C)OCCNCCI Amb25040652 [0,2,0,0,0,0|2,0,0]=4 5545 B9R0.2 CC(C)OCCNCCO Amb24478048 [0,2,0,0,0,0|1,0,0]=3 5546 B9R0.2 CC(C)OCCOCC=O Amb25266853 [0,2,0,0,0,0|0,0,2]=4 5547 B9R0.2 CC(C)OCCSCCCl Amb24734053 [0,2,0,0,0,0|1,1,0]=4 5548 B9R0.2 CC(C)OCCSCCN Amb18792523 [0,2,0,0,0,0|1,1,0]=4 5549 B9R0.2 CC(C)OCCSCCO Amb18800853 [0,2,0,0,0,0|0,1,0]=3 5550 B9R0.2 CC(C)OCSCCCO Amb24435574 [0,2,0,0,0,0|1,1,0]=4 5551 B9R0.2 CC(C)SCCCCCCl Amb18796389 [0,2,0,0,0,0|2,0,0]=4 5552 B9R0.2 CC(C)SCCCCCF Amb24393727 [0,2,0,0,0,0|2,0,0]=4 5553 B9R0.2 CC(C)SCCCCCN Amb18792402 [0,2,0,0,0,0|2,0,0]=4 5554 B9R0.2 CC(C)SCCCCCO Amb18800676 [0,2,0,0,0,0|1,0,0]=3 5555 B9R0.2 CC(C)SCCNCCBr Amb24423597 [0,2,0,0,0,0|2,0,0]=4 5556 B9R0.2 CC(C)SCCNCCF Amb24458234 [0,2,0,0,0,0|2,0,0]=4 5557 B9R0.2 CC(C)SCCNCCI Amb24423744 [0,2,0,0,0,0|2,0,0]=4 5558 B9R0.2 CC(C)SCCOCCO Amb18180082 [0,2,0,0,0,0|0,0,0]=2 5559 B9R0.2 CC(C)SCCSCCN Amb24734458 [0,2,0,0,0,0|1,1,0]=4 5560 B9R0.2 CC(C)\C=C\CCCCO Amb25127444 [0,2,0,0,0,0|1,0,1]=4 5561 B9R0.2 CC(Cl)CCCCCCO Amb25210096 [0,2,0,0,0,0|1,0,0]=3 5562 B9R0.2 CC(Cl)CCCNCCF Amb25053831 [0,2,0,0,0,0|2,0,0]=4 5563 B9R0.2 CC(Cl)COCOCC=C Amb25177574 [0,2,0,0,0,0|1,0,1]=4 5564 B9R0.2 CC(Cl)COCOCCCl Amb25706289 [0,2,0,0,0,0|1,0,0]=3 5565 B9R0.2 CC(Cl)CSCOCCCl Amb24477401 [0,2,0,0,0,0|1,0,0]=3 5566 B9R0.2 CC(Cl)SOCCCCCl Amb25082507 [0,2,0,0,0,0|2,0,0]=4 5567 B9R0.2 CC(N)=NCCCCCO Amb25761933 [0,2,0,0,0,0|1,0,1]=4 5568 B9R0.2 CC(N)=NCCOCCO Amb24396802 [0,2,0,0,0,0|0,0,1]=3 5569 B9R0.2 CC(N)CCCCCC#C Amb25060631 [0,2,0,0,0,0|2,0,0]=4 5570 B9R0.2 CC(N)CCCNCCF Amb24448171 [0,2,0,0,0,0|2,0,0]=4 5571 B9R0.2 CC(N)CCSCCC#C Amb25774125 [0,2,0,0,0,0|1,1,0]=4 5572 B9R0.2 CC(N)CCSCCCF Amb24617430 [0,2,0,0,0,0|1,1,0]=4 5573 B9R0.2 CC(N)CCSCCCO Amb25074083 [0,2,0,0,0,0|0,1,0]=3 5574 B9R0.2 CC(N)CNCCCCF Amb24364143 [0,2,0,0,0,0|2,0,0]=4 5575 B9R0.2 CC(N)CSCCCCF Amb24660427 [0,2,0,0,0,0|1,1,0]=4 5576 B9R0.2 CC(N)CSCCCON Amb24588767 [0,2,0,0,0,0|2,0,0]=4 5577 B9R0.2 CC(O)C#CCCCCBr Amb24477409 [0,2,0,0,0,0|1,0,1]=4 5578 B9R0.2 CC(O)CCCCCC#C Amb25147698 [0,2,0,0,0,0|1,0,1]=4 5579 B9R0.2 CC(O)CCCCCC=O Amb24611207 [0,2,0,0,0,0|1,0,1]=4 5580 B9R0.2 CC(O)CCCCCCF Amb24685025 [0,2,0,0,0,0|1,0,0]=3 5581 B9R0.2 CC(O)CCCNCCF Amb24481149 [0,2,0,0,0,0|2,0,0]=4 5582 B9R0.2 CC(O)CCCOCCO Amb25682125 [0,2,0,0,0,0|0,0,0]=2 5583 B9R0.2 CC(O)CCCSCCN Amb25676264 [0,2,0,0,0,0|1,1,0]=4 5584 B9R0.2 CC(O)CCCSCCO Amb25848714 [0,2,0,0,0,0|0,1,0]=3 5585 B9R0.2 CC(O)CCNCCC=C Amb24538063 [0,2,0,0,0,0|2,0,0]=4 5586 B9R0.2 CC(O)CCNCCCN Amb25111706 [0,2,0,0,0,0|2,0,0]=4 5587 B9R0.2 CC(O)CCNCCCO Amb25201402 [0,2,0,0,0,0|1,0,0]=3 5588 B9R0.2 CC(O)CCNOCC#C Amb25101427 [0,2,0,0,0,0|1,0,1]=4 5589 B9R0.2 CC(O)CCOCCCN Amb24630914 [0,2,0,0,0,0|1,0,0]=3 5590 B9R0.2 CC(O)CCSCCCN Amb25108386 [0,2,0,0,0,0|1,1,0]=4 5591 B9R0.2 CC(O)CNCCCC=C Amb24665037 [0,2,0,0,0,0|1,0,1]=4 5592 B9R0.2 CC(O)CNCCCCF Amb25705721 [0,2,0,0,0,0|1,0,0]=3 5593 B9R0.2 CC(O)CNCCCCS Amb25805139 [0,2,0,0,0,0|1,0,0]=3 5594 B9R0.2 CC(O)NCCNCCN Amb24480708 [0,2,0,0,0,0|2,0,0]=4 5595 B9R0.2 CC(O)OCCOCCN Amb25802009 [0,2,0,0,0,0|1,0,0]=3 5596 B9R0.2 CC(O)\C=C\CCCCN Amb25346064 [0,2,0,0,0,0|1,0,1]=4 5597 B9R0.2 CCCC#CCCC(C)O Amb25099377 [0,2,0,0,0,0|1,0,1]=4 5598 B9R0.2 CCCC=NNCC(C)O Amb25297964 [0,2,0,0,0,0|1,0,1]=4 5599 B9R0.2 CCCCCC#C[C@H](C)O Amb25762969 [0,2,0,0,0,0|1,0,1]=4 5600 B9R0.2 CCCCCCCB(O)O Amb13890611 [0,2,0,0,0,0|1,0,0]=3 5601 B9R0.2 CCCCCCCC(=O)S Amb10561702 [0,2,0,0,0,0|1,0,1]=4 5602 B9R0.2 CCCCCCCC(O)=O Amb22352272 [0,2,0,0,0,0|1,0,0]=3 5603 B9R0.2 CCCCCCCC(O)=O Amb22353407 [0,2,0,0,0,0|1,0,0]=3 5604 B9R0.2 CCCCCCCC([O-])=O Amb22045472 [0,2,0,0,0,0|1,0,1]=4 5605 B9R0.2 CCCCCCCC([O-])=O Amb22731641 [0,2,0,0,0,0|1,0,1]=4 5606 B9R0.2 CCCCCCCC([O-])=O Amb22732291 [0,2,0,0,0,0|1,0,1]=4 5607 B9R0.2 CCCCCCCC([O-])=O Amb22732747 [0,2,0,0,0,0|1,0,1]=4 5608 B9R0.2 CCCCCCC[13C](O)=O Amb20243497 [0,2,0,0,0,0|1,0,0]=3 5609 B9R0.2 CCCCCCC[13C]([O-])=O Amb22366893 [0,2,0,0,0,0|1,0,1]=4 5610 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [0,2,0,0,0,0|2,0,0]=4 5611 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|1,0,0]=3 5612 B9R0.2 CCCCCCC[C@H](C)Br Amb25277237 [0,2,0,0,0,0|2,0,0]=4 5613 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [0,2,0,0,0,0|2,0,0]=4 5614 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|1,0,0]=3 5615 B9R0.2 CCCCCCC[N+]([O-])=O Amb17672611 [0,2,0,0,0,0|1,0,1]=4 5616 B9R0.2 CCCCCCNC(O)=S Amb24375451 [0,2,0,0,0,0|1,0,1]=4 5617 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [0,2,0,0,0,0|2,0,0]=4 5618 B9R0.2 CCCCCCOC(Cl)Cl Amb24355342 [0,2,0,0,0,0|2,0,0]=4 5619 B9R0.2 CCCCCC[13CH2]C(O)=O Amb22367410 [0,2,0,0,0,0|1,0,0]=3 5620 B9R0.2 CCCCCC[13CH2][13C](O)=O Amb22367490 [0,2,0,0,0,0|1,0,0]=3 5621 B9R0.2 CCCCCNCC(F)F Amb18791477 [0,2,0,0,0,0|2,0,0]=4 5622 B9R0.2 CCCCCOCC(=C)Br Amb25261580 [0,2,0,0,0,0|1,0,1]=4 5623 B9R0.2 CCCCCOCC(N)=O Amb25770302 [0,2,0,0,0,0|0,0,2]=4 5624 B9R0.2 CCCCCSCC(C)N Amb25857333 [0,2,0,0,0,0|1,1,0]=4 5625 B9R0.2 CCCCCSCC(C)O Amb24675808 [0,2,0,0,0,0|0,1,0]=3 5626 B9R0.2 CCCCCSCC(F)F Amb25739976 [0,2,0,0,0,0|1,1,0]=4 5627 B9R0.2 CCCCCSC[C@@H](C)N Amb24479642 [0,2,0,0,0,0|1,1,0]=4 5628 B9R0.2 CCCCCSC[C@@H](C)O Amb24581873 [0,2,0,0,0,0|0,1,0]=3 5629 B9R0.2 CCCCCSC[C@H](C)O Amb25796591 [0,2,0,0,0,0|0,1,0]=3 5630 B9R0.2 CCCCC\C=C\[C@@H](C)O Amb25795409 [0,2,0,0,0,0|1,0,1]=4 5631 B9R0.2 CCCCNCCC(C)=C Amb24652080 [0,2,0,0,0,0|2,0,0]=4 5632 B9R0.2 CCCCNCCC(C)N Amb24477984 [0,2,0,0,0,0|2,0,0]=4 5633 B9R0.2 CCCCNCCN(C)C Amb1124804 [0,2,0,0,0,0|2,0,0]=4 5634 B9R0.2 CCCCNCCS(C)=O Amb24397424 [0,2,0,0,0,0|1,0,1]=4 5635 B9R0.2 CCCCNCC[C@@H](C)O Amb24568301 [0,2,0,0,0,0|1,0,0]=3 5636 B9R0.2 CCCCNOCC(C)C Amb24717271 [0,2,0,0,0,0|1,0,0]=3 5637 B9R0.2 CCCCNOCC(N)=O Amb24561497 [0,2,0,0,0,0|0,0,2]=4 5638 B9R0.2 CCCCOCCC(C)Br Amb25103284 [0,2,0,0,0,0|1,0,0]=3 5639 B9R0.2 CCCCOCCC(C)O Amb24455174 [0,2,0,0,0,0|0,0,0]=2 5640 B9R0.2 CCCCOCSC(N)=N Amb24635825 [0,2,0,0,0,0|1,0,1]=4 5641 B9R0.2 CCCCO\C=C\C(O)=O Amb18644130 [0,2,0,0,0,0|0,0,2]=4 5642 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,2,0,0,0,0|0,1,0]=3 5643 B9R0.2 CCCCSCCC(=S)N Amb17503251 [0,2,0,0,0,0|0,2,0]=4 5644 B9R0.2 CCCCSCCC(C)O Amb25108387 [0,2,0,0,0,0|0,1,0]=3 5645 B9R0.2 CCCCSCCC(N)=O Amb18798040 [0,2,0,0,0,0|0,1,1]=4 5646 B9R0.2 CCCCSCCN(C)C Amb24482729 [0,2,0,0,0,0|1,1,0]=4 5647 B9R0.2 CCCCSCC[C@@H](C)O Amb25092039 [0,2,0,0,0,0|0,1,0]=3 5648 B9R0.2 CCCCSCC[C@H](C)O Amb24355162 [0,2,0,0,0,0|0,1,0]=3 5649 B9R0.2 CCCCSCC[N+]([O-])=O Amb24482730 [0,2,0,0,0,0|0,1,1]=4 5650 B9R0.2 CCCC[13CH2][13CH2][13CH2][13C](O)=O Amb22351826 [0,2,0,0,0,0|1,0,0]=3 5651 B9R0.2 CCCC\C=C\CC(C)N Amb24744361 [0,2,0,0,0,0|2,0,0]=4 5652 B9R0.2 CCCC\C=C\C[C@@H](C)O Amb25041963 [0,2,0,0,0,0|1,0,0]=3 5653 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,2,0,0,0,0|1,0,1]=4 5654 B9R0.2 CCCNCCCC(C)=C Amb25724747 [0,2,0,0,0,0|2,0,0]=4 5655 B9R0.2 CCCNCCCC(C)Br Amb24639117 [0,2,0,0,0,0|2,0,0]=4 5656 B9R0.2 CCCNCCCC(C)Cl Amb24481144 [0,2,0,0,0,0|2,0,0]=4 5657 B9R0.2 CCCNCCCC(C)O Amb24478896 [0,2,0,0,0,0|1,0,0]=3 5658 B9R0.2 CCCNCCNC(C)C Amb20077354 [0,2,0,0,0,0|2,0,0]=4 5659 B9R0.2 CCCNCCOC(C)C Amb24419645 [0,2,0,0,0,0|2,0,0]=4 5660 B9R0.2 CCCNCCSC(C)C Amb18177759 [0,2,0,0,0,0|2,0,0]=4 5661 B9R0.2 CCCNOCCC(C)=O Amb24580378 [0,2,0,0,0,0|1,0,1]=4 5662 B9R0.2 CCCOCCCC(C)N Amb25776191 [0,2,0,0,0,0|1,0,0]=3 5663 B9R0.2 CCCOCCNC(C)C Amb24476713 [0,2,0,0,0,0|1,0,0]=3 5664 B9R0.2 CCCOCCOC(C)=O Amb25354004 [0,2,0,0,0,0|1,0,1]=4 5665 B9R0.2 CCCONCCC(C)=C Amb25376802 [0,2,0,0,0,0|1,0,1]=4 5666 B9R0.2 CCCSCCCC(C)C Amb25761075 [0,2,0,0,0,0|1,1,0]=4 5667 B9R0.2 CCCSCCCC(C)O Amb24430166 [0,2,0,0,0,0|1,0,0]=3 5668 B9R0.2 CCCSCCNC(C)C Amb18177755 [0,2,0,0,0,0|1,1,0]=4 5669 B9R0.2 CCCSCCOC(C)C Amb25783108 [0,2,0,0,0,0|1,1,0]=4 5670 B9R0.2 CCCSCCSC(C)C Amb24719190 [0,2,0,0,0,0|1,1,0]=4 5671 B9R0.2 CCC\C=C\CCC(O)=O Amb25378821 [0,2,0,0,0,0|1,0,1]=4 5672 B9R0.2 CCNCCCCC(C)C Amb25185215 [0,2,0,0,0,0|2,0,0]=4 5673 B9R0.2 CCNCCCCC(O)=O Amb24385094 [0,2,0,0,0,0|1,0,1]=4 5674 B9R0.2 CCNCCNCC(F)F Amb24373603 [0,2,0,0,0,0|2,0,0]=4 5675 B9R0.2 CCNCCNCC(O)=O Amb24568313 [0,2,0,0,0,0|1,0,1]=4 5676 B9R0.2 CCNCCOCC(=C)Cl Amb18798259 [0,2,0,0,0,0|1,0,1]=4 5677 B9R0.2 CCNCCOCC(C)=O Amb18111808 [0,2,0,0,0,0|0,0,2]=4 5678 B9R0.2 CCNCCOCC(F)F Amb18796700 [0,2,0,0,0,0|1,0,0]=3 5679 B9R0.2 CCNCCOCC(O)=O Amb18111801 [0,2,0,0,0,0|0,0,1]=3 5680 B9R0.2 CCNCCSCC(C)C Amb18177751 [0,2,0,0,0,0|1,1,0]=4 5681 B9R0.2 CCOCCCCC(C)N Amb25304977 [0,2,0,0,0,0|2,0,0]=4 5682 B9R0.2 CCOCCNCC(F)F Amb18178134 [0,2,0,0,0,0|2,0,0]=4 5683 B9R0.2 CCOCCNC[C@@H](C)O Amb25127396 [0,2,0,0,0,0|1,0,0]=3 5684 B9R0.2 CCOCCNC[C@H](C)O Amb25703768 [0,2,0,0,0,0|1,0,0]=3 5685 B9R0.2 CCOCCOCC(=C)Br Amb25822824 [0,2,0,0,0,0|1,0,1]=4 5686 B9R0.2 CCOCCOC[C@H](C)N Amb25088047 [0,2,0,0,0,0|1,0,0]=3 5687 B9R0.2 CCOCCSCC(F)F Amb24752179 [0,2,0,0,0,0|1,1,0]=4 5688 B9R0.2 CCOCOCCC(C)O Amb24475090 [0,2,0,0,0,0|1,0,0]=3 5689 B9R0.2 CCONCCCC(C)O Amb25762384 [0,2,0,0,0,0|2,0,0]=4 5690 B9R0.2 CCSCCCCC(C)Cl Amb24683400 [0,2,0,0,0,0|2,0,0]=4 5691 B9R0.2 CCSCCCCC(C)N Amb24685694 [0,2,0,0,0,0|2,0,0]=4 5692 B9R0.2 CCSCCNCC(C)C Amb18798056 [0,2,0,0,0,0|2,0,0]=4 5693 B9R0.2 CCSCCNCC(C)O Amb25829716 [0,2,0,0,0,0|1,0,0]=3 5694 B9R0.2 CCSCCNCC(Cl)Cl Amb25297247 [0,2,0,0,0,0|2,0,0]=4 5695 B9R0.2 CCSCCNCC(O)=O Amb24652163 [0,2,0,0,0,0|1,0,1]=4 5696 B9R0.2 CCSCCNC[C@@H](C)O Amb24516507 [0,2,0,0,0,0|1,0,0]=3 5697 B9R0.2 CCSCCOCC(C)=O Amb25693909 [0,2,0,0,0,0|0,0,2]=4 5698 B9R0.2 CCSCCOCC(C)C Amb24482936 [0,2,0,0,0,0|1,0,0]=3 5699 B9R0.2 CCSCCOCC(O)=O Amb24716269 [0,2,0,0,0,0|0,0,1]=3 5700 B9R0.2 CCSCCSCC(C)C Amb24446033 [0,2,0,0,0,0|1,1,0]=4 5701 B9R0.2 CCSCCSCC(C)N Amb24389919 [0,2,0,0,0,0|1,1,0]=4 5702 B9R0.2 CCSCCSCC(C)O Amb24450768 [0,2,0,0,0,0|0,1,0]=3 5703 B9R0.2 CC\C=C\CCCC(C)O Amb24472555 [0,2,0,0,0,0|1,0,1]=4 5704 B9R0.2 CC\C=C\CCC[C@H](C)O Amb25855838 [0,2,0,0,0,0|1,0,1]=4 5705 B9R0.2 CC\C=C\CNC[C@H](C)O Amb25810709 [0,2,0,0,0,0|1,0,1]=4 5706 B9R0.2 CN(C)CCC#CCCO Amb24684153 [0,2,0,0,0,0|1,0,1]=4 5707 B9R0.2 CN(C)CCCCCCCl Amb18800750 [0,2,0,0,0,0|2,0,0]=4 5708 B9R0.2 CN(C)CCCNCCBr Amb24376299 [0,2,0,0,0,0|2,0,0]=4 5709 B9R0.2 CN(C)CCCNCCF Amb24744137 [0,2,0,0,0,0|2,0,0]=4 5710 B9R0.2 CN(C)CCCNCCI Amb25117086 [0,2,0,0,0,0|2,0,0]=4 5711 B9R0.2 CN(C)CCCOCCO Amb25244990 [0,2,0,0,0,0|0,0,0]=2 5712 B9R0.2 CN(C)CCCSCCBr Amb25024315 [0,2,0,0,0,0|1,1,0]=4 5713 B9R0.2 CN(C)CCCSCCCl Amb25771568 [0,2,0,0,0,0|1,1,0]=4 5714 B9R0.2 CN(C)CCCSCCS Amb24539048 [0,2,0,0,0,0|0,2,0]=4 5715 B9R0.2 CN(C)CCOCCC#N Amb18643955 [0,2,0,0,0,0|2,0,0]=4 5716 B9R0.2 CN(C)CCOCCCN Amb23308391 [0,2,0,0,0,0|2,0,0]=4 5717 B9R0.2 CN(C)CCSCCCO Amb24628477 [0,2,0,0,0,0|1,1,0]=4 5718 B9R0.2 CN(C)CCSCCON Amb24646345 [0,2,0,0,0,0|1,1,0]=4 5719 B9R0.2 CN(C)NCCCCCO Amb24504968 [0,2,0,0,0,0|2,0,0]=4 5720 B9R0.2 CNCCCCCC(C)C Amb24505305 [0,2,0,0,0,0|2,0,0]=4 5721 B9R0.2 CNCCCCCC(O)=O Amb25704769 [0,2,0,0,0,0|1,0,1]=4 5722 B9R0.2 CNCCCNCC(Cl)Cl Amb24729253 [0,2,0,0,0,0|2,0,0]=4 5723 B9R0.2 CNCCCNCC(F)F Amb24652255 [0,2,0,0,0,0|2,0,0]=4 5724 B9R0.2 CNCCCNCC(O)=O Amb25292252 [0,2,0,0,0,0|1,0,1]=4 5725 B9R0.2 CNCCCOCC(C)C Amb20076075 [0,2,0,0,0,0|1,0,0]=3 5726 B9R0.2 CNCCCOCC(F)F Amb24440726 [0,2,0,0,0,0|1,0,0]=3 5727 B9R0.2 CNCCCSCC(C)C Amb18177742 [0,2,0,0,0,0|1,1,0]=4 5728 B9R0.2 CNCCNCCC(C)C Amb25187362 [0,2,0,0,0,0|2,0,0]=4 5729 B9R0.2 CNCCOCCC(C)=C Amb25805038 [0,2,0,0,0,0|1,0,1]=4 5730 B9R0.2 CNCCOCCC(C)=O Amb18630756 [0,2,0,0,0,0|1,0,1]=4 5731 B9R0.2 CNCCOCCC(C)C Amb25696260 [0,2,0,0,0,0|1,0,0]=3 5732 B9R0.2 CNCCOCCC(C)O Amb24703694 [0,2,0,0,0,0|1,0,0]=3 5733 B9R0.2 CNCCOCCC(O)=O Amb18111840 [0,2,0,0,0,0|1,0,0]=3 5734 B9R0.2 CNCCOCCN(C)C Amb24406265 [0,2,0,0,0,0|2,0,0]=4 5735 B9R0.2 CNCCOCOC(C)C Amb24604956 [0,2,0,0,0,0|2,0,0]=4 5736 B9R0.2 COCC#CCCC(C)O Amb24529147 [0,2,0,0,0,0|1,0,1]=4 5737 B9R0.2 COCCC#CCC(C)O Amb25052158 [0,2,0,0,0,0|1,0,1]=4 5738 B9R0.2 COCCC#CC[C@H](C)O Amb24481176 [0,2,0,0,0,0|1,0,1]=4 5739 B9R0.2 COCCCCCC(=O)O Amb10607872 [0,2,0,0,0,0|1,0,1]=4 5740 B9R0.2 COCCCCCC(C)O Amb24669996 [0,2,0,0,0,0|1,0,0]=3 5741 B9R0.2 COCCCCNC(C)C Amb25363772 [0,2,0,0,0,0|2,0,0]=4 5742 B9R0.2 COCCCCSC(C)C Amb24509206 [0,2,0,0,0,0|2,0,0]=4 5743 B9R0.2 COCCCNCC(F)F Amb18791536 [0,2,0,0,0,0|2,0,0]=4 5744 B9R0.2 COCCCNCC(O)C Amb17138417 [0,2,0,0,0,0|1,0,0]=3 5745 B9R0.2 COCCCOCC(C)=O Amb25056055 [0,2,0,0,0,0|0,0,2]=4 5746 B9R0.2 COCCCOCC(N)=S Amb18792509 [0,2,0,0,0,0|0,1,1]=4 5747 B9R0.2 COCCCOCC(O)=O Amb25304314 [0,2,0,0,0,0|0,0,1]=3 5748 B9R0.2 COCCCOC[C@@H](C)O Amb25145652 [0,2,0,0,0,0|0,0,0]=2 5749 B9R0.2 COCCCSCC(C)C Amb25135967 [0,2,0,0,0,0|1,1,0]=4 5750 B9R0.2 COCCCSCC(C)N Amb25762953 [0,2,0,0,0,0|1,1,0]=4 5751 B9R0.2 COCCCSCC(C)O Amb25146302 [0,2,0,0,0,0|0,1,0]=3 5752 B9R0.2 COCCCSCC(O)=O Amb18798347 [0,2,0,0,0,0|0,1,1]=4 5753 B9R0.2 COCCCSC[C@@H](C)N Amb25027991 [0,2,0,0,0,0|1,1,0]=4 5754 B9R0.2 COCCCSC[C@@H](C)O Amb24663658 [0,2,0,0,0,0|0,1,0]=3 5755 B9R0.2 COCCNCCC(C)=C Amb25760884 [0,2,0,0,0,0|1,0,1]=4 5756 B9R0.2 COCCNCCC(C)=O Amb24473587 [0,2,0,0,0,0|1,0,1]=4 5757 B9R0.2 COCCNCCC(C)O Amb24361046 [0,2,0,0,0,0|1,0,0]=3 5758 B9R0.2 COCCNCCC(F)F Amb18796701 [0,2,0,0,0,0|2,0,0]=4 5759 B9R0.2 COCCNCCC(F)F Amb20667926 [0,2,0,0,0,0|2,0,0]=4 5760 B9R0.2 COCCNCC[C@H](C)N Amb24609848 [0,2,0,0,0,0|1,0,0]=3 5761 B9R0.2 COCCOCCN(C)N Amb25703621 [0,2,0,0,0,0|1,0,0]=3 5762 B9R0.2 COCCOCC[C@@H](C)N Amb25340758 [0,2,0,0,0,0|0,0,0]=2 5763 B9R0.2 COCCOCC[C@H](C)N Amb24411878 [0,2,0,0,0,0|0,0,0]=2 5764 B9R0.2 COCCONCC(C)=C Amb24707536 [0,2,0,0,0,0|1,0,1]=4 5765 B9R0.2 COCCONCC(C)C Amb25101355 [0,2,0,0,0,0|1,0,0]=3 5766 B9R0.2 COCCONC[C@H](C)O Amb25138102 [0,2,0,0,0,0|1,0,0]=3 5767 B9R0.2 COCCSCCC(C)=C Amb24413530 [0,2,0,0,0,0|0,1,1]=4 5768 B9R0.2 COCCSCCC(C)C Amb25028048 [0,2,0,0,0,0|0,1,0]=3 5769 B9R0.2 COCCSCCN(C)C Amb25135436 [0,2,0,0,0,0|1,1,0]=4 5770 B9R0.2 COCC\C=C\CC(C)O Amb24735123 [0,2,0,0,0,0|1,0,1]=4 5771 B9R0.2 COCOCCCC(C)=O Amb25724503 [0,2,0,0,0,0|2,0,0]=4 5772 B9R0.2 COCOCCNC(C)C Amb25236320 [0,2,0,0,0,0|2,0,0]=4 5773 B9R0.2 COCSCCCC(C)C Amb25078936 [0,2,0,0,0,0|2,0,0]=4 5774 B9R0.2 CONCCOCC(F)F Amb24350058 [0,2,0,0,0,0|2,0,0]=4 5775 B9R0.2 CS(=O)CCCCCCCl Amb24365969 [0,2,0,0,0,0|2,0,0]=4 5776 B9R0.2 CS(=O)CCCNCCN Amb25788907 [0,2,0,0,0,0|2,0,0]=4 5777 B9R0.2 CS(=O)CCCNCCO Amb25147738 [0,2,0,0,0,0|1,0,0]=3 5778 B9R0.2 CS(=O)CCNCCCO Amb24701015 [0,2,0,0,0,0|2,0,0]=4 5779 B9R0.2 CS(=O)CCOCCCN Amb25346823 [0,2,0,0,0,0|1,0,1]=4 5780 B9R0.2 CS(=O)CCSCCCO Amb24538900 [0,2,0,0,0,0|1,1,0]=4 5781 B9R0.2 CS(=O)NCCOCCO Amb25177301 [0,2,0,0,0,0|1,0,0]=3 5782 B9R0.2 CSCCCCCC(C)Br Amb24674793 [0,2,0,0,0,0|1,1,0]=4 5783 B9R0.2 CSCCCCCC(C)Cl Amb25229910 [0,2,0,0,0,0|1,1,0]=4 5784 B9R0.2 CSCCCCCC(C)N Amb24387980 [0,2,0,0,0,0|1,1,0]=4 5785 B9R0.2 CSCCCNC[C@H](C)O Amb25091074 [0,2,0,0,0,0|1,0,0]=3 5786 B9R0.2 CSCCCSCC(C)O Amb24425891 [0,2,0,0,0,0|0,1,0]=3 5787 B9R0.2 CSCCNCCC(C)C Amb18800588 [0,2,0,0,0,0|1,1,0]=4 5788 B9R0.2 CSCCNCCC(C)Cl Amb24738945 [0,2,0,0,0,0|1,1,0]=4 5789 B9R0.2 CSCCNCCC(C)O Amb25304485 [0,2,0,0,0,0|1,1,0]=4 5790 B9R0.2 CSCCNCCC(O)=O Amb25055507 [0,2,0,0,0,0|2,0,0]=4 5791 B9R0.2 CSCCOCCC(C)=O Amb25810170 [0,2,0,0,0,0|0,1,1]=4 5792 B9R0.2 CSCCOCCC(O)=O Amb25173504 [0,2,0,0,0,0|1,0,0]=3 5793 B9R0.2 CSCCSCCC(O)=O Amb25798868 [0,2,0,0,0,0|1,1,0]=4 5794 B9R0.2 CSSCCNC[C@@H](C)O Amb24747031 [0,2,0,0,0,0|2,0,0]=4 5795 B9R0.2 C[13CH2]CCCCCC(O)=O Amb22367488 [0,2,0,0,0,0|1,0,0]=3 5796 B9R0.2 C[C@@H](N)CCCCCC#C Amb24427659 [0,2,0,0,0,0|2,0,0]=4 5797 B9R0.2 C[C@@H](N)CNCCCCF Amb25789392 [0,2,0,0,0,0|2,0,0]=4 5798 B9R0.2 C[C@@H](O)C#CCCCCBr Amb24477410 [0,2,0,0,0,0|1,0,1]=4 5799 B9R0.2 C[C@@H](O)CCCCCCF Amb24448007 [0,2,0,0,0,0|1,0,0]=3 5800 B9R0.2 C[C@@H](O)CNCCCC#C Amb25115220 [0,2,0,0,0,0|1,0,1]=4 5801 B9R0.2 C[C@@H](O)CNCCCCF Amb25172363 [0,2,0,0,0,0|1,0,0]=3 5802 B9R0.2 C[C@@H](O)C\C=C\CCCO Amb24466199 [0,2,0,0,0,0|1,0,1]=4 5803 B9R0.2 C[C@H](N)CCCCCCN Amb24738393 [0,2,0,0,0,0|2,0,0]=4 5804 B9R0.2 C[C@H](N)CNCCCCF Amb25076887 [0,2,0,0,0,0|2,0,0]=4 5805 B9R0.2 C[C@H](O)CCCCCC=C Amb24384728 [0,2,0,0,0,0|1,0,1]=4 5806 B9R0.2 C[C@H](O)CCCCCCN Amb25045097 [0,2,0,0,0,0|1,0,0]=3 5807 B9R0.2 C[C@H](O)CNCCCCF Amb25287098 [0,2,0,0,0,0|1,0,0]=3 5808 B9R0.2 C[C@H](O)CNCCCCO Amb25070079 [0,2,0,0,0,0|1,0,0]=3 5809 B9R0.2 C\C=C/COCCC(O)=O Amb24377336 [0,2,0,0,0,0|0,0,2]=4 5810 B9R0.2 C\C=C\CCNC[C@@H](C)O Amb25055179 [0,2,0,0,0,0|1,0,1]=4 5811 B9R0.2 C\C=C\COCCC(O)=O Amb24478110 [0,2,0,0,0,0|0,0,2]=4 5812 B9R0.2 ClCCCCCCC(=O)O Amb17594087 [0,2,0,0,0,0|1,0,1]=4 5813 B9R0.2 ClCCCCCCC(Cl)Cl Amb24424337 [0,2,0,0,0,0|2,0,0]=4 5814 B9R0.2 ClCCNCCCN(C)C Amb17334624 [0,2,0,0,0,0|2,0,0]=4 5815 B9R0.2 FC(F)CCCCCCBr Amb25361725 [0,2,0,0,0,0|2,0,0]=4 5816 B9R0.2 FC(F)CNCCCCCl Amb25838076 [0,2,0,0,0,0|2,0,0]=4 5817 B9R0.2 FC(F)COCCCCS Amb25258646 [0,2,0,0,0,0|1,0,0]=3 5818 B9R0.2 N#CCCCOCC(F)F Amb25772693 [0,2,0,0,0,0|1,0,1]=4 5819 B9R0.2 N#CCCOCCC(O)=O Amb24409319 [0,2,0,0,0,0|1,0,1]=4 5820 B9R0.2 NC(=O)CCCNCCO Amb24432464 [0,2,0,0,0,0|1,0,1]=4 5821 B9R0.2 NC(=S)CCCCCCO Amb25330374 [0,2,0,0,0,0|1,0,1]=4 5822 B9R0.2 NCCCCCCC(=O)O Amb1151254 [0,2,0,0,0,0|1,0,1]=4 5823 B9R0.2 NCCCCCCC(=O)O Amb16232099 [0,2,0,0,0,0|1,0,1]=4 5824 B9R0.2 NCCCCNCC(C)C Amb17334222 [0,2,0,0,0,0|2,0,0]=4 5825 B9R0.2 NCCCCOCC(N)=O Amb24515943 [0,2,0,0,0,0|0,0,2]=4 5826 B9R0.2 NCCCCSCC(=O)O Amb17500919 [0,2,0,0,0,0|0,1,1]=4 5827 B9R0.2 NCCCNCCC(C)C Amb17315309 [0,2,0,0,0,0|2,0,0]=4 5828 B9R0.2 NCCCOCCC(O)=O Amb18111494 [0,2,0,0,0,0|1,0,0]=3 5829 B9R0.2 NCCCSCCC(C)C Amb17500699 [0,2,0,0,0,0|1,1,0]=4 5830 B9R0.2 NCCCSCCC(O)=O Amb24496605 [0,2,0,0,0,0|1,1,0]=4 5831 B9R0.2 NCCOCCCC(N)=O Amb24554840 [0,2,0,0,0,0|1,0,1]=4 5832 B9R0.2 NCCOCCCC(O)=O Amb18111467 [0,2,0,0,0,0|1,0,1]=4 5833 B9R0.2 NCCOCCSC(C)C Amb17501989 [0,2,0,0,0,0|1,0,0]=3 5834 B9R0.2 NNCCCOCC(F)F Amb25764880 [0,2,0,0,0,0|2,0,0]=4 5835 B9R0.2 OB(O)CCCCCCBr Amb19959675 [0,2,0,0,0,0|2,0,0]=4 5836 B9R0.2 OC(=O)CCCCCCF Amb25132501 [0,2,0,0,0,0|1,0,1]=4 5837 B9R0.2 OC(=O)CCCCCCS Amb24710334 [0,2,0,0,0,0|1,0,1]=4 5838 B9R0.2 OC(=O)CCOCCCBr Amb25207601 [0,2,0,0,0,0|1,0,0]=3 5839 B9R0.2 OC(=O)CCOCCCF Amb25794478 [0,2,0,0,0,0|1,0,0]=3 5840 B9R0.2 OC(=O)CNCCCCCl Amb24505281 [0,2,0,0,0,0|1,0,1]=4 5841 B9R0.2 OC(=O)CNCCCCF Amb24588093 [0,2,0,0,0,0|1,0,1]=4 5842 B9R0.2 OCC#CCOCC(O)C Amb16232582 [0,2,0,0,0,0|0,0,2]=4 5843 B9R0.2 OCCCCCCC(C)C Amb17617666 [0,2,0,0,0,0|1,0,0]=3 5844 B9R0.2 OCCCCCCN(C)C Amb17613201 [0,2,0,0,0,0|1,0,0]=3 5845 B9R0.2 OCCCCCNC(=O)C Amb15769972 [0,2,0,0,0,0|1,0,1]=4 5846 B9R0.2 OCCCCCNC(C)C Amb17334255 [0,2,0,0,0,0|1,0,0]=3 5847 B9R0.2 OCCCCNCC(C)C Amb17334252 [0,2,0,0,0,0|1,0,0]=3 5848 B9R0.2 OCCCCSCC(O)=O Amb18798269 [0,2,0,0,0,0|0,1,1]=4 5849 B9R0.2 OCCCNCCC(F)F Amb24621459 [0,2,0,0,0,0|2,0,0]=4 5850 B9R0.2 OCCCOCCC(O)=O Amb24476864 [0,2,0,0,0,0|1,0,0]=3 5851 B9R0.2 OCCCSCCC(C)C Amb17502843 [0,2,0,0,0,0|0,1,0]=3 5852 B9R0.2 OCCNCCOC(F)F Amb25214803 [0,2,0,0,0,0|2,0,0]=4 5853 B9R0.2 [13CH3]CCCCCCC(O)=O Amb22367137 [0,2,0,0,0,0|1,0,0]=3 5854 B9R0.2 [13CH3][13CH2]CCCCCC(O)=O Amb22367489 [0,2,0,0,0,0|1,0,0]=3 5855 B9R0.2 [C-]#[N+]CCSCCC(C)C Amb25048385 [0,2,0,0,0,0|1,1,0]=4 5856 B9R0.45 BrCCOCCOCCBr Amb16184320 [0,2,0,0,0,0|1,0,0]=3 5857 B9R0.45 C#CCCCCC#CCO Amb24456887 [0,2,0,0,0,0|1,0,1]=4 5858 B9R0.45 C#CCCCCCCCN Amb24117276 [0,2,0,0,0,0|2,0,0]=4 5859 B9R0.45 C#CCCCCCCCN Amb25147483 [0,2,0,0,0,0|2,0,0]=4 5860 B9R0.45 C#CCCCC\C=C\CO Amb25042928 [0,2,0,0,0,0|1,0,1]=4 5861 B9R0.45 C#CCCCOCCCN Amb25147693 [0,2,0,0,0,0|1,0,1]=4 5862 B9R0.45 C#CCCCSCCCO Amb25055604 [0,2,0,0,0,0|0,1,1]=4 5863 B9R0.45 C#CCCNCCCCO Amb25056153 [0,2,0,0,0,0|1,0,1]=4 5864 B9R0.45 C#CCCOCCCCN Amb24738166 [0,2,0,0,0,0|1,0,0]=3 5865 B9R0.45 C#CCOCCCCCN Amb18111693 [0,2,0,0,0,0|1,0,1]=4 5866 B9R0.45 C#CCOCCCCCO Amb24733699 [0,2,0,0,0,0|1,0,1]=4 5867 B9R0.45 C#CCOCCOCCCl Amb24479173 [0,2,0,0,0,0|1,0,1]=4 5868 B9R0.45 C#CCOCCOCCN Amb18521910 [0,2,0,0,0,0|1,0,1]=4 5869 B9R0.45 C#CCOCOCCCO Amb25720021 [0,2,0,0,0,0|0,0,2]=4 5870 B9R0.45 C#CCONCCCCO Amb25687363 [0,2,0,0,0,0|1,0,1]=4 5871 B9R0.45 C#COCCCCCCCl Amb24480545 [0,2,0,0,0,0|2,0,0]=4 5872 B9R0.45 C=CCCCC#CCCO Amb25761992 [0,2,0,0,0,0|1,0,1]=4 5873 B9R0.45 C=CCCCCCCCBr Amb19895211 [0,2,0,0,0,0|2,0,0]=4 5874 B9R0.45 C=CCCCCCCCN Amb24763980 [0,2,0,0,0,0|2,0,0]=4 5875 B9R0.45 C=CCCCCCCCO Amb22733549 [0,2,0,0,0,0|1,0,0]=3 5876 B9R0.45 C=CCCCCNCCN Amb25821120 [0,2,0,0,0,0|2,0,0]=4 5877 B9R0.45 C=CCCCCNCCO Amb24478970 [0,2,0,0,0,0|1,0,0]=3 5878 B9R0.45 C=CCCCOCCC=O Amb24731422 [0,2,0,0,0,0|0,0,2]=4 5879 B9R0.45 C=CCCCOCCCBr Amb25842130 [0,2,0,0,0,0|1,0,1]=4 5880 B9R0.45 C=CCCCOCCCCl Amb24701986 [0,2,0,0,0,0|1,0,1]=4 5881 B9R0.45 C=CCCCSCCCO Amb25325049 [0,2,0,0,0,0|0,1,1]=4 5882 B9R0.45 C=CCCNCCCCF Amb25818131 [0,2,0,0,0,0|2,0,0]=4 5883 B9R0.45 C=CCCOCCCC=O Amb24598274 [0,2,0,0,0,0|1,0,1]=4 5884 B9R0.45 C=CCCOCCCCCl Amb18798172 [0,2,0,0,0,0|1,0,0]=3 5885 B9R0.45 C=CCCOCCCCS Amb24673342 [0,2,0,0,0,0|1,0,0]=3 5886 B9R0.45 C=CCCOC\C=C\CO Amb24613540 [0,2,0,0,0,0|0,0,2]=4 5887 B9R0.45 C=CCOCCCCC=O Amb25105437 [0,2,0,0,0,0|1,0,1]=4 5888 B9R0.45 C=CCOCCCCCBr Amb25141774 [0,2,0,0,0,0|1,0,1]=4 5889 B9R0.45 C=CCOCCCCCO Amb25792274 [0,2,0,0,0,0|1,0,1]=4 5890 B9R0.45 C=CCOCCCCCS Amb25136655 [0,2,0,0,0,0|1,0,1]=4 5891 B9R0.45 C=CCOCCNCCF Amb25236520 [0,2,0,0,0,0|1,0,1]=4 5892 B9R0.45 C=CCOCCOCCBr Amb25101176 [0,2,0,0,0,0|1,0,1]=4 5893 B9R0.45 C=CCOCCOCCN Amb18111246 [0,2,0,0,0,0|1,0,1]=4 5894 B9R0.45 C=CCOCCOCCO Amb17933929 [0,2,0,0,0,0|0,0,1]=3 5895 B9R0.45 C=CCOCCSCCO Amb25177352 [0,2,0,0,0,0|0,1,1]=4 5896 B9R0.45 C=COCCCCCCBr Amb25804472 [0,2,0,0,0,0|2,0,0]=4 5897 B9R0.45 C=COCCCCCCCl Amb25340486 [0,2,0,0,0,0|2,0,0]=4 5898 B9R0.45 CC#CCCC#CCCO Amb24660748 [0,2,0,0,0,0|1,0,1]=4 5899 B9R0.45 CC#CCCCC#CCO Amb24421582 [0,2,0,0,0,0|1,0,1]=4 5900 B9R0.45 CC#CCCCCCCBr Amb24394493 [0,2,0,0,0,0|2,0,0]=4 5901 B9R0.45 CC#CCCCNCCC Amb24523159 [0,2,0,0,0,0|2,0,0]=4 5902 B9R0.45 CC#CCCNCCCO Amb24390490 [0,2,0,0,0,0|1,0,1]=4 5903 B9R0.45 CC#CCCOCCNC Amb25227296 [0,2,0,0,0,0|1,0,1]=4 5904 B9R0.45 CC#CCCSCCCC Amb24688838 [0,2,0,0,0,0|1,1,0]=4 5905 B9R0.45 CC#CCOCC#CCO Amb24371146 [0,2,0,0,0,0|0,0,2]=4 5906 B9R0.45 CC#CCOCCCCN Amb24570678 [0,2,0,0,0,0|1,0,1]=4 5907 B9R0.45 CCC#CCCCCCCl Amb24505002 [0,2,0,0,0,0|2,0,0]=4 5908 B9R0.45 CCCC#CC#CCCO Amb24355234 [0,2,0,0,0,0|1,0,1]=4 5909 B9R0.45 CCCC#CCCCCBr Amb24477308 [0,2,0,0,0,0|2,0,0]=4 5910 B9R0.45 CCCC=NNCCCC Amb24529204 [0,2,0,0,0,0|2,0,0]=4 5911 B9R0.45 CCCC=NNCCOC Amb25072349 [0,2,0,0,0,0|1,0,1]=4 5912 B9R0.45 CCCCC#CC#CCO Amb17593456 [0,2,0,0,0,0|1,0,1]=4 5913 B9R0.45 CCCCC#CCCCBr Amb25361745 [0,2,0,0,0,0|2,0,0]=4 5914 B9R0.45 CCCCC#CCCCO Amb21962548 [0,2,0,0,0,0|1,0,0]=3 5915 B9R0.45 CCCCC=CC=CCO Amb22228348 [0,2,0,0,0,0|1,0,1]=4 5916 B9R0.45 CCCCC=NCCCO Amb24735221 [0,2,0,0,0,0|1,0,0]=3 5917 B9R0.45 CCCCC=NNCCO Amb25318595 [0,2,0,0,0,0|1,0,0]=3 5918 B9R0.45 CCCCC=NOCC#C Amb24529199 [0,2,0,0,0,0|1,0,1]=4 5919 B9R0.45 CCCCCC#CCCBr Amb24724719 [0,2,0,0,0,0|2,0,0]=4 5920 B9R0.45 CCCCCC#CCCCl Amb25132120 [0,2,0,0,0,0|2,0,0]=4 5921 B9R0.45 CCCCCC#CCCN Amb25146331 [0,2,0,0,0,0|2,0,0]=4 5922 B9R0.45 CCCCCC#CCON Amb22896677 [0,2,0,0,0,0|1,0,1]=4 5923 B9R0.45 CCCCCC#CCON Amb25212008 [0,2,0,0,0,0|1,0,1]=4 5924 B9R0.45 CCCCCC=C=CCO Amb25357386 [0,2,0,0,0,0|1,0,1]=4 5925 B9R0.45 CCCCCC=NCCO Amb25769358 [0,2,0,0,0,0|1,0,0]=3 5926 B9R0.45 CCCCCCC#CCCl Amb25228778 [0,2,0,0,0,0|2,0,0]=4 5927 B9R0.45 CCCCCCCC=NO Amb25207893 [0,2,0,0,0,0|1,0,0]=3 5928 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [0,2,0,0,0,0|2,0,0]=4 5929 B9R0.45 CCCCCCCCNN Amb22552570 [0,2,0,0,0,0|2,0,0]=4 5930 B9R0.45 CCCCCCCCSC Amb10553780 [0,2,0,0,0,0|1,1,0]=4 5931 B9R0.45 CCCCCCCCSCl Amb25226772 [0,2,0,0,0,0|1,1,0]=4 5932 B9R0.45 CCCCCCCCS[Au] Amb22354036 [0,2,0,0,0,0|1,1,0]=4 5933 B9R0.45 CCCCCCCC[13C]#[13CH] Amb22338942 [0,2,0,0,0,0|2,0,0]=4 5934 B9R0.45 CCCCCCCC[Hg]Cl Amb22359875 [0,2,0,0,0,0|2,0,0]=4 5935 B9R0.45 CCCCCCCC[Mg]Br Amb22363181 [0,2,0,0,0,0|2,0,0]=4 5936 B9R0.45 CCCCCCCC[Mg]Cl Amb22349193 [0,2,0,0,0,0|2,0,0]=4 5937 B9R0.45 CCCCCCCN=[N+]=[N-] Amb17939437 [0,2,0,0,0,0|2,0,0]=4 5938 B9R0.45 CCCCCCCNC#N Amb24680287 [0,2,0,0,0,0|2,0,0]=4 5939 B9R0.45 CCCCCCCNOC Amb25335283 [0,2,0,0,0,0|1,0,0]=3 5940 B9R0.45 CCCCCCCOC=C Amb25817973 [0,2,0,0,0,0|1,0,0]=3 5941 B9R0.45 CCCCCCCOCCl Amb25709280 [0,2,0,0,0,0|1,0,0]=3 5942 B9R0.45 CCCCCCCSC#N Amb17939431 [0,2,0,0,0,0|1,1,0]=4 5943 B9R0.45 CCCCCCC\C=C\Cl Amb25322197 [0,2,0,0,0,0|2,0,0]=4 5944 B9R0.45 CCCCCCC\C=C\I Amb24708038 [0,2,0,0,0,0|2,0,0]=4 5945 B9R0.45 CCCCCCNC=NO Amb25123252 [0,2,0,0,0,0|1,0,1]=4 5946 B9R0.45 CCCCCCNCC#N Amb25147350 [0,2,0,0,0,0|2,0,0]=4 5947 B9R0.45 CCCCCCNCCF Amb25676977 [0,2,0,0,0,0|2,0,0]=4 5948 B9R0.45 CCCCCCNCCS Amb24692640 [0,2,0,0,0,0|1,1,0]=4 5949 B9R0.45 CCCCCCNOCC Amb24415602 [0,2,0,0,0,0|2,0,0]=4 5950 B9R0.45 CCCCCCOCC=C Amb17933923 [0,2,0,0,0,0|1,0,1]=4 5951 B9R0.45 CCCCCCSCC#N Amb17501741 [0,2,0,0,0,0|2,0,0]=4 5952 B9R0.45 CCCCCCSCC=C Amb22733767 [0,2,0,0,0,0|2,0,0]=4 5953 B9R0.45 CCCCCCSCCCl Amb22228746 [0,2,0,0,0,0|1,1,0]=4 5954 B9R0.45 CCCCCC\C=C/CO Amb10807383 [0,2,0,0,0,0|1,0,0]=3 5955 B9R0.45 CCCCCC\C=C\CBr Amb25046739 [0,2,0,0,0,0|2,0,0]=4 5956 B9R0.45 CCCCCC\C=C\CCl Amb25728404 [0,2,0,0,0,0|2,0,0]=4 5957 B9R0.45 CCCCCC\C=C\CO Amb22168300 [0,2,0,0,0,0|1,0,0]=3 5958 B9R0.45 CCCCCNCCCCl Amb24733861 [0,2,0,0,0,0|2,0,0]=4 5959 B9R0.45 CCCCCNCCCI Amb24747725 [0,2,0,0,0,0|2,0,0]=4 5960 B9R0.45 CCCCCNCCCN Amb17315271 [0,2,0,0,0,0|2,0,0]=4 5961 B9R0.45 CCCCCNCCSC Amb18800589 [0,2,0,0,0,0|1,1,0]=4 5962 B9R0.45 CCCCCNOCC=C Amb25359199 [0,2,0,0,0,0|1,0,1]=4 5963 B9R0.45 CCCCCOCCCS Amb25730351 [0,2,0,0,0,0|0,1,0]=3 5964 B9R0.45 CCCCCOCCNC Amb24390412 [0,2,0,0,0,0|1,0,0]=3 5965 B9R0.45 CCCCCOCCNN Amb24440436 [0,2,0,0,0,0|1,0,0]=3 5966 B9R0.45 CCCCCOCCON Amb24588751 [0,2,0,0,0,0|0,0,0]=2 5967 B9R0.45 CCCCCSC#CCO Amb25801380 [0,2,0,0,0,0|0,1,1]=4 5968 B9R0.45 CCCCCSCCC#C Amb24415965 [0,2,0,0,0,0|1,1,0]=4 5969 B9R0.45 CCCCCSCCC#N Amb17502386 [0,2,0,0,0,0|1,1,0]=4 5970 B9R0.45 CCCCCSCCC=C Amb25120497 [0,2,0,0,0,0|1,1,0]=4 5971 B9R0.45 CCCCCSCCCBr Amb24675807 [0,2,0,0,0,0|1,1,0]=4 5972 B9R0.45 CCCCCSCCCC Amb25119856 [0,2,0,0,0,0|1,1,0]=4 5973 B9R0.45 CCCCCSCCCN Amb17500694 [0,2,0,0,0,0|1,1,0]=4 5974 B9R0.45 CCCCCSCCCO Amb17502837 [0,2,0,0,0,0|0,1,0]=3 5975 B9R0.45 CCCCCSCCOC Amb24747268 [0,2,0,0,0,0|0,1,0]=3 5976 B9R0.45 CCCCCSCCON Amb24625610 [0,2,0,0,0,0|0,1,0]=3 5977 B9R0.45 CCCCCSCOCC Amb25143190 [0,2,0,0,0,0|1,1,0]=4 5978 B9R0.45 CCCCCS\C=C\CO Amb24414212 [0,2,0,0,0,0|0,1,1]=4 5979 B9R0.45 CCCCC\C=C\CCN Amb25123460 [0,2,0,0,0,0|2,0,0]=4 5980 B9R0.45 CCCCNCCCCCl Amb25349351 [0,2,0,0,0,0|2,0,0]=4 5981 B9R0.45 CCCCNCCCCN Amb17334221 [0,2,0,0,0,0|2,0,0]=4 5982 B9R0.45 CCCCNCCN=[N+]=[N-] Amb24559158 [0,2,0,0,0,0|2,0,0]=4 5983 B9R0.45 CCCCNCCSCC Amb18798052 [0,2,0,0,0,0|1,1,0]=4 5984 B9R0.45 CCCCOCC#CCCl Amb25840528 [0,2,0,0,0,0|1,0,0]=3 5985 B9R0.45 CCCCOCCCC=C Amb25662912 [0,2,0,0,0,0|1,0,0]=3 5986 B9R0.45 CCCCOCCCCCl Amb18798377 [0,2,0,0,0,0|1,0,0]=3 5987 B9R0.45 CCCCOCCCCO Amb19375051 [0,2,0,0,0,0|0,0,0]=2 5988 B9R0.45 CCCCOCCCNC Amb20076072 [0,2,0,0,0,0|1,0,0]=3 5989 B9R0.45 CCCCOCCN=C=S Amb18800188 [0,2,0,0,0,0|0,1,0]=3 5990 B9R0.45 CCCCOCCNCC Amb24640236 [0,2,0,0,0,0|1,0,0]=3 5991 B9R0.45 CCCCOCCOC=C Amb22363292 [0,2,0,0,0,0|0,0,0]=2 5992 B9R0.45 CCCCOCOCCCl Amb24446436 [0,2,0,0,0,0|1,0,0]=3 5993 B9R0.45 CCCCOCOCCO Amb24414113 [0,2,0,0,0,0|0,0,0]=2 5994 B9R0.45 CCCCSCC#CCCl Amb25701734 [0,2,0,0,0,0|1,1,0]=4 5995 B9R0.45 CCCCSCCCC#C Amb24751360 [0,2,0,0,0,0|1,1,0]=4 5996 B9R0.45 CCCCSCCCC=C Amb24482054 [0,2,0,0,0,0|1,1,0]=4 5997 B9R0.45 CCCCSCCCCCl Amb18184911 [0,2,0,0,0,0|1,1,0]=4 5998 B9R0.45 CCCCSCCCNC Amb18177749 [0,2,0,0,0,0|1,1,0]=4 5999 B9R0.45 CCCCSCCCON Amb25175981 [0,2,0,0,0,0|0,1,0]=3 6000 B9R0.45 CCCCSCCN=[N+]=[N-] Amb18787910 [0,2,0,0,0,0|1,1,0]=4 6001 B9R0.45 CCCCSCCNCC Amb18177758 [0,2,0,0,0,0|1,1,0]=4 6002 B9R0.45 CCCCSCCOCC Amb10669603 [0,2,0,0,0,0|0,1,0]=3 6003 B9R0.45 CCCCSC\C=C\CCl Amb25858141 [0,2,0,0,0,0|1,1,0]=4 6004 B9R0.45 CCCCS\C=C\CCO Amb24379996 [0,2,0,0,0,0|0,1,0]=3 6005 B9R0.45 CCCC[SnH2]CCCCN Amb22504059 [0,2,0,0,0,0|2,0,0]=4 6006 B9R0.45 CCCC\C=C/CCC=O Amb24477003 [0,2,0,0,0,0|1,0,1]=4 6007 B9R0.45 CCCC\C=C\C=C\CO Amb22732540 [0,2,0,0,0,0|1,0,1]=4 6008 B9R0.45 CCCC\C=C\CCC#C Amb24505097 [0,2,0,0,0,0|2,0,0]=4 6009 B9R0.45 CCCC\C=C\CCCBr Amb24651141 [0,2,0,0,0,0|2,0,0]=4 6010 B9R0.45 CCCC\C=C\CCCCl Amb24480546 [0,2,0,0,0,0|2,0,0]=4 6011 B9R0.45 CCCNCCCCC#C Amb24380233 [0,2,0,0,0,0|2,0,0]=4 6012 B9R0.45 CCCNCCCCC#N Amb24502256 [0,2,0,0,0,0|2,0,0]=4 6013 B9R0.45 CCCNCCCCCCl Amb24472566 [0,2,0,0,0,0|2,0,0]=4 6014 B9R0.45 CCCNCCCCCO Amb17334254 [0,2,0,0,0,0|1,0,0]=3 6015 B9R0.45 CCCNCCCCOC Amb24478093 [0,2,0,0,0,0|1,0,0]=3 6016 B9R0.45 CCCNCCCCSC Amb18798068 [0,2,0,0,0,0|1,1,0]=4 6017 B9R0.45 CCCNCCCNOC Amb25182470 [0,2,0,0,0,0|2,0,0]=4 6018 B9R0.45 CCCNCCCSCC Amb18177748 [0,2,0,0,0,0|2,0,0]=4 6019 B9R0.45 CCCNCCNCCN Amb22292474 [0,2,0,0,0,0|2,0,0]=4 6020 B9R0.45 CCCNCCNCCN Amb22338428 [0,2,0,0,0,0|2,0,0]=4 6021 B9R0.45 CCCNCCNCCO Amb24644910 [0,2,0,0,0,0|1,0,0]=3 6022 B9R0.45 CCCNCCOCCC Amb24653369 [0,2,0,0,0,0|1,0,0]=3 6023 B9R0.45 CCCNCCSCCC Amb18177754 [0,2,0,0,0,0|1,1,0]=4 6024 B9R0.45 CCCNN=CCCCC Amb24466025 [0,2,0,0,0,0|2,0,0]=4 6025 B9R0.45 CCCOCCCCC#N Amb25692820 [0,2,0,0,0,0|1,0,0]=3 6026 B9R0.45 CCCOCCCCCS Amb24475512 [0,2,0,0,0,0|1,0,0]=3 6027 B9R0.45 CCCOCCCCNC Amb24332221 [0,2,0,0,0,0|1,0,0]=3 6028 B9R0.45 CCCOCCCCNN Amb25246952 [0,2,0,0,0,0|1,0,0]=3 6029 B9R0.45 CCCOCCCNCC Amb20171773 [0,2,0,0,0,0|1,0,0]=3 6030 B9R0.45 CCCOCCNCCCl Amb24644512 [0,2,0,0,0,0|1,0,0]=3 6031 B9R0.45 CCCOCCNCCF Amb25359981 [0,2,0,0,0,0|1,0,0]=3 6032 B9R0.45 CCCOCCOCCBr Amb24476764 [0,2,0,0,0,0|1,0,0]=3 6033 B9R0.45 CCCOCCOCCN Amb18111250 [0,2,0,0,0,0|1,0,0]=3 6034 B9R0.45 CCCOCCOCCO Amb22351569 [0,2,0,0,0,0|0,0,0]=2 6035 B9R0.45 CCCOCCSCCCl Amb25053914 [0,2,0,0,0,0|1,0,0]=3 6036 B9R0.45 CCCOCCSCCN Amb25682853 [0,2,0,0,0,0|1,0,0]=3 6037 B9R0.45 CCCOC\C=C\CCCl Amb25104140 [0,2,0,0,0,0|1,0,1]=4 6038 B9R0.45 CCCONCCCC#C Amb24398867 [0,2,0,0,0,0|1,0,1]=4 6039 B9R0.45 CCCONCCCC#N Amb25275471 [0,2,0,0,0,0|1,0,1]=4 6040 B9R0.45 CCCONCCCC=C Amb25707203 [0,2,0,0,0,0|1,0,1]=4 6041 B9R0.45 CCCONCCCCC Amb25074780 [0,2,0,0,0,0|1,0,0]=3 6042 B9R0.45 CCCONCCCCF Amb25031193 [0,2,0,0,0,0|1,0,0]=3 6043 B9R0.45 CCCONCCCCO Amb24398863 [0,2,0,0,0,0|1,0,0]=3 6044 B9R0.45 CCCONCCOCC Amb25322474 [0,2,0,0,0,0|1,0,0]=3 6045 B9R0.45 CCCONCCSCC Amb25045046 [0,2,0,0,0,0|1,0,0]=3 6046 B9R0.45 CCCSC#CSCCO Amb25346447 [0,2,0,0,0,0|0,1,1]=4 6047 B9R0.45 CCCSCC#CCOC Amb25057319 [0,2,0,0,0,0|1,0,1]=4 6048 B9R0.45 CCCSCCCCC#N Amb18178253 [0,2,0,0,0,0|1,1,0]=4 6049 B9R0.45 CCCSCCCCCN Amb18792401 [0,2,0,0,0,0|1,1,0]=4 6050 B9R0.45 CCCSCCCCCO Amb18800675 [0,2,0,0,0,0|1,0,0]=3 6051 B9R0.45 CCCSCCCCNC Amb18798059 [0,2,0,0,0,0|1,1,0]=4 6052 B9R0.45 CCCSCCCCOC Amb25106252 [0,2,0,0,0,0|1,0,0]=3 6053 B9R0.45 CCCSCCCNCC Amb18177744 [0,2,0,0,0,0|1,1,0]=4 6054 B9R0.45 CCCSCCCOCC Amb24482731 [0,2,0,0,0,0|1,1,0]=4 6055 B9R0.45 CCCSCCOCCN Amb17501983 [0,2,0,0,0,0|1,0,0]=3 6056 B9R0.45 CCCSCCOCCO Amb18792609 [0,2,0,0,0,0|0,0,0]=2 6057 B9R0.45 CCC\C=C/CCCCC Amb22230436 [0,2,0,0,0,0|2,0,0]=4 6058 B9R0.45 CCC\C=C/CCCCCl Amb25727693 [0,2,0,0,0,0|2,0,0]=4 6059 B9R0.45 CCC\C=C/COCCBr Amb25136939 [0,2,0,0,0,0|1,0,0]=3 6060 B9R0.45 CCC\C=C\C=CCCO Amb25333071 [0,2,0,0,0,0|1,0,1]=4 6061 B9R0.45 CCC\C=C\CCCCBr Amb25298401 [0,2,0,0,0,0|2,0,0]=4 6062 B9R0.45 CCC\C=C\CCCCC Amb22231673 [0,2,0,0,0,0|2,0,0]=4 6063 B9R0.45 CCC\C=C\CCCCCl Amb24540817 [0,2,0,0,0,0|2,0,0]=4 6064 B9R0.45 CCC\C=C\CCNCC Amb25032115 [0,2,0,0,0,0|2,0,0]=4 6065 B9R0.45 CCC\C=C\CNCCS Amb24519317 [0,2,0,0,0,0|1,1,0]=4 6066 B9R0.45 CCC\C=C\COCCO Amb24398033 [0,2,0,0,0,0|0,0,0]=2 6067 B9R0.45 CCC\C=N\CCCCC Amb18090835 [0,2,0,0,0,0|2,0,0]=4 6068 B9R0.45 CCNCCCCCC#C Amb25292934 [0,2,0,0,0,0|2,0,0]=4 6069 B9R0.45 CCNCCCCCCCl Amb24613632 [0,2,0,0,0,0|2,0,0]=4 6070 B9R0.45 CCNCCCCCCF Amb25686439 [0,2,0,0,0,0|2,0,0]=4 6071 B9R0.45 CCNCCCCCCI Amb24481103 [0,2,0,0,0,0|2,0,0]=4 6072 B9R0.45 CCNCCCCCCN Amb25855319 [0,2,0,0,0,0|2,0,0]=4 6073 B9R0.45 CCNCCCCCCO Amb24683613 [0,2,0,0,0,0|1,0,0]=3 6074 B9R0.45 CCNCCCCNCC Amb20621746 [0,2,0,0,0,0|2,0,0]=4 6075 B9R0.45 CCNCCCNCCC Amb20171972 [0,2,0,0,0,0|2,0,0]=4 6076 B9R0.45 CCNCCCOCC=C Amb24441883 [0,2,0,0,0,0|1,0,1]=4 6077 B9R0.45 CCNCCCOCCO Amb25687058 [0,2,0,0,0,0|0,0,0]=2 6078 B9R0.45 CCNCCNCCCC Amb20214616 [0,2,0,0,0,0|2,0,0]=4 6079 B9R0.45 CCNCCNCCCF Amb25722682 [0,2,0,0,0,0|2,0,0]=4 6080 B9R0.45 CCNCCNCCOC Amb19966137 [0,2,0,0,0,0|1,0,0]=3 6081 B9R0.45 CCNCCOCCC=C Amb25365870 [0,2,0,0,0,0|1,0,0]=3 6082 B9R0.45 CCNCCOCCCF Amb25024453 [0,2,0,0,0,0|1,0,0]=3 6083 B9R0.45 CCNCCOCCCO Amb25320517 [0,2,0,0,0,0|0,0,0]=2 6084 B9R0.45 CCNCCOCCSC Amb25211119 [0,2,0,0,0,0|0,1,0]=3 6085 B9R0.45 CCNCCOC\C=C\Cl Amb24537555 [0,2,0,0,0,0|1,0,1]=4 6086 B9R0.45 CCNCCSCCCN Amb25794391 [0,2,0,0,0,0|1,1,0]=4 6087 B9R0.45 CCNCCSCCCO Amb25046236 [0,2,0,0,0,0|0,1,0]=3 6088 B9R0.45 CCNCCSCCOC Amb18788239 [0,2,0,0,0,0|0,1,0]=3 6089 B9R0.45 CCNCC\C=C\COC Amb25771490 [0,2,0,0,0,0|1,0,1]=4 6090 B9R0.45 CCOCCCCCC=O Amb25724799 [0,2,0,0,0,0|1,0,1]=4 6091 B9R0.45 CCOCCCCCCBr Amb25299496 [0,2,0,0,0,0|2,0,0]=4 6092 B9R0.45 CCOCCCCCCCl Amb18800872 [0,2,0,0,0,0|2,0,0]=4 6093 B9R0.45 CCOCCCCCCI Amb25085906 [0,2,0,0,0,0|2,0,0]=4 6094 B9R0.45 CCOCCCCCCN Amb24388111 [0,2,0,0,0,0|2,0,0]=4 6095 B9R0.45 CCOCCCCCCO Amb25074993 [0,2,0,0,0,0|1,0,0]=3 6096 B9R0.45 CCOCCCCNCC Amb24476926 [0,2,0,0,0,0|2,0,0]=4 6097 B9R0.45 CCOCCCCOCC Amb10807403 [0,2,0,0,0,0|2,0,0]=4 6098 B9R0.45 CCOCCCNCCCl Amb25138512 [0,2,0,0,0,0|2,0,0]=4 6099 B9R0.45 CCOCCCNCCF Amb25772119 [0,2,0,0,0,0|2,0,0]=4 6100 B9R0.45 CCOCCCSCCCl Amb24462406 [0,2,0,0,0,0|1,1,0]=4 6101 B9R0.45 CCOCCNCCC#C Amb24371413 [0,2,0,0,0,0|2,0,0]=4 6102 B9R0.45 CCOCCNCCCCl Amb24334726 [0,2,0,0,0,0|2,0,0]=4 6103 B9R0.45 CCOCCNCCCI Amb25705724 [0,2,0,0,0,0|2,0,0]=4 6104 B9R0.45 CCOCCNCCSC Amb18183509 [0,2,0,0,0,0|1,1,0]=4 6105 B9R0.45 CCOCCOCCCC Amb25248413 [0,2,0,0,0,0|0,0,0]=2 6106 B9R0.45 CCOCCOCCCS Amb25792198 [0,2,0,0,0,0|0,1,0]=3 6107 B9R0.45 CCOCCOCCON Amb25175977 [0,2,0,0,0,0|0,0,0]=2 6108 B9R0.45 CCOCCOCNC=O Amb25111494 [0,2,0,0,0,0|0,0,2]=4 6109 B9R0.45 CCOCCSCCC#C Amb25066190 [0,2,0,0,0,0|1,1,0]=4 6110 B9R0.45 CCOCCSCCCCl Amb25146976 [0,2,0,0,0,0|1,1,0]=4 6111 B9R0.45 CCOCCSCCCN Amb25719789 [0,2,0,0,0,0|1,1,0]=4 6112 B9R0.45 CCOCCSCOCC Amb24582381 [0,2,0,0,0,0|1,1,0]=4 6113 B9R0.45 CCOCOCC#CCCl Amb24480548 [0,2,0,0,0,0|2,0,0]=4 6114 B9R0.45 CCOCOCCCCCl Amb24505003 [0,2,0,0,0,0|1,0,0]=3 6115 B9R0.45 CCOCOCCCCN Amb24515944 [0,2,0,0,0,0|1,0,0]=3 6116 B9R0.45 CCON=CCCCCO Amb24686396 [0,2,0,0,0,0|1,0,1]=4 6117 B9R0.45 CCONCCOCC=C Amb25272738 [0,2,0,0,0,0|1,0,1]=4 6118 B9R0.45 CCSCC=NNCCO Amb25319306 [0,2,0,0,0,0|1,0,1]=4 6119 B9R0.45 CCSCCCCCC#N Amb24592669 [0,2,0,0,0,0|2,0,0]=4 6120 B9R0.45 CCSCCCCCC=O Amb25205442 [0,2,0,0,0,0|1,0,1]=4 6121 B9R0.45 CCSCCCCCCBr Amb25822578 [0,2,0,0,0,0|2,0,0]=4 6122 B9R0.45 CCSCCCCCCCl Amb18186755 [0,2,0,0,0,0|2,0,0]=4 6123 B9R0.45 CCSCCCCCCN Amb24482109 [0,2,0,0,0,0|2,0,0]=4 6124 B9R0.45 CCSCCCCCNC Amb25110066 [0,2,0,0,0,0|2,0,0]=4 6125 B9R0.45 CCSCCCCCOC Amb24482935 [0,2,0,0,0,0|1,0,0]=3 6126 B9R0.45 CCSCCCCNCC Amb18798057 [0,2,0,0,0,0|2,0,0]=4 6127 B9R0.45 CCSCCCNCCF Amb24457928 [0,2,0,0,0,0|2,0,0]=4 6128 B9R0.45 CCSCCCNCCO Amb24380672 [0,2,0,0,0,0|1,0,0]=3 6129 B9R0.45 CCSCCCSCCN Amb25697202 [0,2,0,0,0,0|1,1,0]=4 6130 B9R0.45 CCSCCCSCCO Amb24376336 [0,2,0,0,0,0|0,1,0]=3 6131 B9R0.45 CCSCCNCCC#C Amb24458010 [0,2,0,0,0,0|2,0,0]=4 6132 B9R0.45 CCSCCNCCCCl Amb25838042 [0,2,0,0,0,0|2,0,0]=4 6133 B9R0.45 CCSCCNCCCI Amb24353270 [0,2,0,0,0,0|2,0,0]=4 6134 B9R0.45 CCSCCNCCOC Amb18798248 [0,2,0,0,0,0|1,0,0]=3 6135 B9R0.45 CCSCCNOCC#C Amb25724665 [0,2,0,0,0,0|1,0,1]=4 6136 B9R0.45 CCSCCOCCC#N Amb25716094 [0,2,0,0,0,0|1,0,0]=3 6137 B9R0.45 CCSCCOCCC=O Amb24526413 [0,2,0,0,0,0|0,0,1]=3 6138 B9R0.45 CCSCCOCCCCl Amb25697735 [0,2,0,0,0,0|1,0,0]=3 6139 B9R0.45 CCSCCOCCNC Amb24425703 [0,2,0,0,0,0|1,0,0]=3 6140 B9R0.45 CCSCCSCCCC Amb25279629 [0,2,0,0,0,0|0,2,0]=4 6141 B9R0.45 CCSCCSCCCCl Amb24509147 [0,2,0,0,0,0|1,1,0]=4 6142 B9R0.45 CCSCCSCCCF Amb25786806 [0,2,0,0,0,0|1,1,0]=4 6143 B9R0.45 CCSCCSCCNC Amb25180159 [0,2,0,0,0,0|1,1,0]=4 6144 B9R0.45 CCSCCSCCOC Amb24354167 [0,2,0,0,0,0|0,1,0]=3 6145 B9R0.45 CCSCCSCSCC Amb24543085 [0,2,0,0,0,0|1,1,0]=4 6146 B9R0.45 CC\C=C/CCCCCC Amb22230427 [0,2,0,0,0,0|2,0,0]=4 6147 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [0,2,0,0,0,0|0,0,2]=4 6148 B9R0.45 CC\C=C/C\C=C/CCO Amb22226805 [0,2,0,0,0,0|1,0,1]=4 6149 B9R0.45 CC\C=C/C\C=C\CCO Amb22231646 [0,2,0,0,0,0|1,0,1]=4 6150 B9R0.45 CC\C=C\CCCCCBr Amb25224953 [0,2,0,0,0,0|2,0,0]=4 6151 B9R0.45 CC\C=C\CCCCCC Amb22231672 [0,2,0,0,0,0|2,0,0]=4 6152 B9R0.45 CC\C=C\CCNCCC Amb25066619 [0,2,0,0,0,0|2,0,0]=4 6153 B9R0.45 CC\C=C\CCOCC=O Amb25258193 [0,2,0,0,0,0|0,0,2]=4 6154 B9R0.45 CC\C=C\CC\C=C\CO Amb10807373 [0,2,0,0,0,0|1,0,1]=4 6155 B9R0.45 CC\C=C\CNCCCO Amb24614610 [0,2,0,0,0,0|1,0,1]=4 6156 B9R0.45 CC\C=C\C\C=C\CCO Amb22735100 [0,2,0,0,0,0|1,0,1]=4 6157 B9R0.45 CNCC#CCCCCO Amb24441655 [0,2,0,0,0,0|1,0,1]=4 6158 B9R0.45 CNCCCCCCCCl Amb25809475 [0,2,0,0,0,0|2,0,0]=4 6159 B9R0.45 CNCCCCCCOC Amb25699667 [0,2,0,0,0,0|1,0,0]=3 6160 B9R0.45 CNCCCCNCCF Amb24553163 [0,2,0,0,0,0|2,0,0]=4 6161 B9R0.45 CNCCCCOCC=C Amb24476920 [0,2,0,0,0,0|1,0,1]=4 6162 B9R0.45 CNCCCNCCC=C Amb25739865 [0,2,0,0,0,0|2,0,0]=4 6163 B9R0.45 CNCCCNCCCC Amb24502382 [0,2,0,0,0,0|2,0,0]=4 6164 B9R0.45 CNCCCNCCCF Amb25688299 [0,2,0,0,0,0|2,0,0]=4 6165 B9R0.45 CNCCCNCCCO Amb20171918 [0,2,0,0,0,0|1,0,0]=3 6166 B9R0.45 CNCCCNCCCS Amb24578833 [0,2,0,0,0,0|1,1,0]=4 6167 B9R0.45 CNCCCNCCOC Amb20171974 [0,2,0,0,0,0|1,0,0]=3 6168 B9R0.45 CNCCCOCCSC Amb24757320 [0,2,0,0,0,0|0,1,0]=3 6169 B9R0.45 CNCCCSCCCO Amb25110847 [0,2,0,0,0,0|0,1,0]=3 6170 B9R0.45 CNCCCSCCNC Amb24636070 [0,2,0,0,0,0|1,1,0]=4 6171 B9R0.45 CNCCCSCCOC Amb18788238 [0,2,0,0,0,0|0,1,0]=3 6172 B9R0.45 CNCCNCCCCO Amb25785280 [0,2,0,0,0,0|1,0,0]=3 6173 B9R0.45 CNCCNCCCOC Amb19966336 [0,2,0,0,0,0|2,0,0]=4 6174 B9R0.45 CNCCNCCCSC Amb25323758 [0,2,0,0,0,0|2,0,0]=4 6175 B9R0.45 CNCCOCCCC#N Amb24399562 [0,2,0,0,0,0|1,0,1]=4 6176 B9R0.45 CNCCOCCCCBr Amb25211726 [0,2,0,0,0,0|1,0,0]=3 6177 B9R0.45 CNCCOCCCCF Amb24743131 [0,2,0,0,0,0|1,0,0]=3 6178 B9R0.45 CNCCOCCN=[N+]=[N-] Amb25281090 [0,2,0,0,0,0|2,0,0]=4 6179 B9R0.45 CNCCOCCNCC Amb24396616 [0,2,0,0,0,0|1,0,0]=3 6180 B9R0.45 CNCCSCCCCF Amb24588997 [0,2,0,0,0,0|1,1,0]=4 6181 B9R0.45 CNCCSCCCOC Amb24653179 [0,2,0,0,0,0|1,1,0]=4 6182 B9R0.45 CNCCSCCCON Amb25257491 [0,2,0,0,0,0|1,1,0]=4 6183 B9R0.45 COCC#CCCCCCl Amb24505278 [0,2,0,0,0,0|1,0,1]=4 6184 B9R0.45 COCCCCCCCBr Amb25122735 [0,2,0,0,0,0|1,0,0]=3 6185 B9R0.45 COCCCCCCCO Amb25315004 [0,2,0,0,0,0|1,0,0]=3 6186 B9R0.45 COCCCCCCNN Amb25253032 [0,2,0,0,0,0|2,0,0]=4 6187 B9R0.45 COCCCCCCOC Amb10807404 [0,2,0,0,0,0|1,0,0]=3 6188 B9R0.45 COCCCCCNOC Amb24351787 [0,2,0,0,0,0|2,0,0]=4 6189 B9R0.45 COCCCCNCCF Amb25251868 [0,2,0,0,0,0|2,0,0]=4 6190 B9R0.45 COCCCCNCCI Amb25055470 [0,2,0,0,0,0|2,0,0]=4 6191 B9R0.45 COCCCCNCCN Amb24434670 [0,2,0,0,0,0|2,0,0]=4 6192 B9R0.45 COCCCCSCCO Amb25841523 [0,2,0,0,0,0|0,1,0]=3 6193 B9R0.45 COCCCNCCCBr Amb25132670 [0,2,0,0,0,0|2,0,0]=4 6194 B9R0.45 COCCCNCCCF Amb25078265 [0,2,0,0,0,0|2,0,0]=4 6195 B9R0.45 COCCCNCCCI Amb25214527 [0,2,0,0,0,0|2,0,0]=4 6196 B9R0.45 COCCCNCCCN Amb17315264 [0,2,0,0,0,0|2,0,0]=4 6197 B9R0.45 COCCCNCCCO Amb17308606 [0,2,0,0,0,0|1,0,0]=3 6198 B9R0.45 COCCCNCCSC Amb18800727 [0,2,0,0,0,0|1,1,0]=4 6199 B9R0.45 COCCCNOCCC Amb25685457 [0,2,0,0,0,0|1,0,0]=3 6200 B9R0.45 COCCCOCCC=O Amb25742389 [0,2,0,0,0,0|0,0,1]=3 6201 B9R0.45 COCCCOCCCCl Amb18180119 [0,2,0,0,0,0|1,0,0]=3 6202 B9R0.45 COCCCOCCCO Amb20242414 [0,2,0,0,0,0|0,0,0]=2 6203 B9R0.45 COCCCOCCCS Amb24720024 [0,2,0,0,0,0|0,1,0]=3 6204 B9R0.45 COCCCOCCNC Amb21954035 [0,2,0,0,0,0|1,0,0]=3 6205 B9R0.45 COCCCOCCNN Amb24479636 [0,2,0,0,0,0|1,0,0]=3 6206 B9R0.45 COCCCSCCCBr Amb25055596 [0,2,0,0,0,0|1,1,0]=4 6207 B9R0.45 COCCCSCCCF Amb25721830 [0,2,0,0,0,0|1,1,0]=4 6208 B9R0.45 COCCCSCCCN Amb24505092 [0,2,0,0,0,0|1,1,0]=4 6209 B9R0.45 COCCCSCCCO Amb25041322 [0,2,0,0,0,0|0,1,0]=3 6210 B9R0.45 COCCNCCCCBr Amb25806898 [0,2,0,0,0,0|1,0,0]=3 6211 B9R0.45 COCCNCCCCCl Amb25823398 [0,2,0,0,0,0|1,0,0]=3 6212 B9R0.45 COCCNCCCCF Amb24452983 [0,2,0,0,0,0|1,0,0]=3 6213 B9R0.45 COCCNCCCCN Amb17334262 [0,2,0,0,0,0|1,0,0]=3 6214 B9R0.45 COCCNCCCCO Amb17334271 [0,2,0,0,0,0|1,0,0]=3 6215 B9R0.45 COCCOCCCCCl Amb18798737 [0,2,0,0,0,0|0,0,0]=2 6216 B9R0.45 COCCOCCCCS Amb24513869 [0,2,0,0,0,0|0,0,0]=2 6217 B9R0.45 COCCOCCCON Amb24357503 [0,2,0,0,0,0|1,0,0]=3 6218 B9R0.45 COCCOCCC[Mg]Br Amb22897314 [0,2,0,0,0,0|1,0,0]=3 6219 B9R0.45 COCCOCCC[Zn]Br Amb22897816 [0,2,0,0,0,0|1,0,0]=3 6220 B9R0.45 COCCOCCN=C=O Amb18559240 [0,2,0,0,0,0|1,0,1]=4 6221 B9R0.45 COCCOCCN=C=S Amb18800530 [0,2,0,0,0,0|1,0,1]=4 6222 B9R0.45 COCCOCCN=[N+]=[N-] Amb24057924 [0,2,0,0,0,0|2,0,0]=4 6223 B9R0.45 COCCOCCNC=O Amb25369826 [0,2,0,0,0,0|1,0,1]=4 6224 B9R0.45 COCCOCCNCC Amb24672932 [0,2,0,0,0,0|0,0,0]=2 6225 B9R0.45 COCCOCCOCCl Amb24447031 [0,2,0,0,0,0|1,0,0]=3 6226 B9R0.45 COCCOCOCC=O Amb25104820 [0,2,0,0,0,0|0,0,2]=4 6227 B9R0.45 COCCOCSCCN Amb25845631 [0,2,0,0,0,0|1,0,0]=3 6228 B9R0.45 COCCON=CCCC Amb24482924 [0,2,0,0,0,0|0,0,1]=3 6229 B9R0.45 COCCONCCC#C Amb24709784 [0,2,0,0,0,0|0,0,2]=4 6230 B9R0.45 COCCONCCC#N Amb25116879 [0,2,0,0,0,0|1,0,1]=4 6231 B9R0.45 COCCONCCC=C Amb24390666 [0,2,0,0,0,0|0,0,2]=4 6232 B9R0.45 COCCONC\C=C\C Amb24649635 [0,2,0,0,0,0|0,0,2]=4 6233 B9R0.45 COCCSCCCC#C Amb25769578 [0,2,0,0,0,0|0,1,1]=4 6234 B9R0.45 COCCSCCCCCl Amb18325214 [0,2,0,0,0,0|0,1,0]=3 6235 B9R0.45 COCCSCCCCS Amb25856278 [0,2,0,0,0,0|0,1,0]=3 6236 B9R0.45 COCCSCCOCC Amb25318407 [0,2,0,0,0,0|0,1,0]=3 6237 B9R0.45 COCOCCC#CCO Amb25780995 [0,2,0,0,0,0|1,0,1]=4 6238 B9R0.45 COCOCCCCC#C Amb22641579 [0,2,0,0,0,0|2,0,0]=4 6239 B9R0.45 COCOCCCCC=O Amb24333716 [0,2,0,0,0,0|2,0,0]=4 6240 B9R0.45 COCOCC\C=C\CO Amb25677675 [0,2,0,0,0,0|1,0,1]=4 6241 B9R0.45 COCOCOCOCO Amb25856489 [0,2,0,0,0,0|1,0,0]=3 6242 B9R0.45 COCOC\C=C\CCO Amb25762947 [0,2,0,0,0,0|1,0,1]=4 6243 B9R0.45 COCSCCSCCO Amb25057471 [0,2,0,0,0,0|0,1,0]=3 6244 B9R0.45 COC\C=C\CCCCO Amb25125960 [0,2,0,0,0,0|1,0,1]=4 6245 B9R0.45 CONCCOCCC#N Amb25162063 [0,2,0,0,0,0|1,0,1]=4 6246 B9R0.45 CSCCCCCCCCl Amb25032475 [0,2,0,0,0,0|1,1,0]=4 6247 B9R0.45 CSCCCCCCCO Amb24378634 [0,2,0,0,0,0|1,0,0]=3 6248 B9R0.45 CSCCCCNCCO Amb24423555 [0,2,0,0,0,0|1,0,0]=3 6249 B9R0.45 CSCCCNCCCF Amb25131361 [0,2,0,0,0,0|2,0,0]=4 6250 B9R0.45 CSCCCNCCCN Amb18792456 [0,2,0,0,0,0|2,0,0]=4 6251 B9R0.45 CSCCCNCCSC Amb25798696 [0,2,0,0,0,0|1,1,0]=4 6252 B9R0.45 CSCCCNOCC=C Amb25360066 [0,2,0,0,0,0|1,0,1]=4 6253 B9R0.45 CSCCCOCCC#N Amb24601324 [0,2,0,0,0,0|1,0,0]=3 6254 B9R0.45 CSCCCOCCCBr Amb24608522 [0,2,0,0,0,0|1,0,0]=3 6255 B9R0.45 CSCCCOCCCCl Amb24557322 [0,2,0,0,0,0|1,0,0]=3 6256 B9R0.45 CSCCCSCCC#C Amb24504379 [0,2,0,0,0,0|1,1,0]=4 6257 B9R0.45 CSCCCSCCC#N Amb25287440 [0,2,0,0,0,0|1,1,0]=4 6258 B9R0.45 CSCCCSCCC=C Amb25169431 [0,2,0,0,0,0|1,1,0]=4 6259 B9R0.45 CSCCCSCCC=O Amb24441129 [0,2,0,0,0,0|0,1,1]=4 6260 B9R0.45 CSCCCSCCCBr Amb24504412 [0,2,0,0,0,0|1,1,0]=4 6261 B9R0.45 CSCCCSCCCC Amb24482722 [0,2,0,0,0,0|0,2,0]=4 6262 B9R0.45 CSCCCSCCCCl Amb24365388 [0,2,0,0,0,0|1,1,0]=4 6263 B9R0.45 CSCCCSCCCS Amb24504444 [0,2,0,0,0,0|0,2,0]=4 6264 B9R0.45 CSCCCSCCOC Amb24689044 [0,2,0,0,0,0|0,1,0]=3 6265 B9R0.45 CSCCNCCCCBr Amb25837561 [0,2,0,0,0,0|1,1,0]=4 6266 B9R0.45 CSCCNCCCCCl Amb25334134 [0,2,0,0,0,0|1,1,0]=4 6267 B9R0.45 CSCCNCCCCF Amb24468064 [0,2,0,0,0,0|1,1,0]=4 6268 B9R0.45 CSCCNCCCCO Amb25703017 [0,2,0,0,0,0|1,0,0]=3 6269 B9R0.45 CSCCNCCSCC Amb25136460 [0,2,0,0,0,0|1,1,0]=4 6270 B9R0.45 CSCCOCCCCBr Amb25308647 [0,2,0,0,0,0|0,1,0]=3 6271 B9R0.45 CSCCSCCCCF Amb25282053 [0,2,0,0,0,0|0,2,0]=4 6272 B9R0.45 CSCCSCCCCO Amb24356155 [0,2,0,0,0,0|1,0,0]=3 6273 B9R0.45 CSCCSCCCON Amb25109593 [0,2,0,0,0,0|1,1,0]=4 6274 B9R0.45 CSCCSCCNCC Amb25773477 [0,2,0,0,0,0|0,2,0]=4 6275 B9R0.45 CSCCSCCOCC Amb25318308 [0,2,0,0,0,0|0,2,0]=4 6276 B9R0.45 CSCSCCSCCO Amb25180033 [0,2,0,0,0,0|0,1,0]=3 6277 B9R0.45 CSSCCCCCCN Amb25201705 [0,2,0,0,0,0|2,0,0]=4 6278 B9R0.45 C\C=C\CCCCCCC Amb22730483 [0,2,0,0,0,0|2,0,0]=4 6279 B9R0.45 C\C=C\CCCNCCC Amb24359820 [0,2,0,0,0,0|2,0,0]=4 6280 B9R0.45 C\C=C\CCOCCCC Amb25695148 [0,2,0,0,0,0|1,0,0]=3 6281 B9R0.45 C\C=C\COCC#CCO Amb24360959 [0,2,0,0,0,0|0,0,2]=4 6282 B9R0.45 C\C=C\COCCCCBr Amb24763729 [0,2,0,0,0,0|1,0,1]=4 6283 B9R0.45 C\C=C\COCCCCS Amb25106495 [0,2,0,0,0,0|1,0,1]=4 6284 B9R0.45 C\C=C\COCCNCC Amb24644651 [0,2,0,0,0,0|1,0,1]=4 6285 B9R0.45 ClCCOCSOCCCl Amb25702059 [0,2,0,0,0,0|2,0,0]=4 6286 B9R0.45 Cl\C=C\COCCCCCl Amb24711394 [0,2,0,0,0,0|1,0,1]=4 6287 B9R0.45 FCCCCCCCCF Amb22641491 [0,2,0,0,0,0|2,0,0]=4 6288 B9R0.45 FCCCCNCCCCl Amb24504860 [0,2,0,0,0,0|2,0,0]=4 6289 B9R0.45 FCCCCNCCCF Amb24685388 [0,2,0,0,0,0|2,0,0]=4 6290 B9R0.45 FCCCCNCCCI Amb25081584 [0,2,0,0,0,0|2,0,0]=4 6291 B9R0.45 FCCCCSCCCCl Amb25238106 [0,2,0,0,0,0|1,1,0]=4 6292 B9R0.45 FCCCCSCCCF Amb25122423 [0,2,0,0,0,0|1,1,0]=4 6293 B9R0.45 FCCOCCCCCBr Amb24477252 [0,2,0,0,0,0|1,0,0]=3 6294 B9R0.45 FCCOCCOCCCl Amb24739608 [0,2,0,0,0,0|1,0,0]=3 6295 B9R0.45 FCCOCCOCCF Amb24560246 [0,2,0,0,0,0|1,0,0]=3 6296 B9R0.45 ICCCCCCCCI Amb20242379 [0,2,0,0,0,0|2,0,0]=4 6297 B9R0.45 N#CCCCC#CCCO Amb25722997 [0,2,0,0,0,0|1,0,1]=4 6298 B9R0.45 N#CCCCCCCCBr Amb21936054 [0,2,0,0,0,0|2,0,0]=4 6299 B9R0.45 N#CCCCCCCCCl Amb25806080 [0,2,0,0,0,0|2,0,0]=4 6300 B9R0.45 N#CCCCCOCCO Amb24431725 [0,2,0,0,0,0|0,0,0]=2 6301 B9R0.45 N#CCCNCCCCF Amb25346812 [0,2,0,0,0,0|2,0,0]=4 6302 B9R0.45 N#CCCNCCCCO Amb24479008 [0,2,0,0,0,0|1,0,1]=4 6303 B9R0.45 N#CCCOC\C=C\CO Amb25180294 [0,2,0,0,0,0|1,0,1]=4 6304 B9R0.45 N#CCNCCCCCO Amb24449081 [0,2,0,0,0,0|1,0,1]=4 6305 B9R0.45 N#CCNCCOCCO Amb24420093 [0,2,0,0,0,0|0,0,1]=3 6306 B9R0.45 N#CCSCCSCCO Amb25316815 [0,2,0,0,0,0|0,1,1]=4 6307 B9R0.45 N#CNCCCCCCO Amb24480829 [0,2,0,0,0,0|1,0,1]=4 6308 B9R0.45 N#CSCCCCCCO Amb25317234 [0,2,0,0,0,0|1,0,1]=4 6309 B9R0.45 NCCCCCCCCBr Amb24744173 [0,2,0,0,0,0|2,0,0]=4 6310 B9R0.45 NCCCCCCCCCl Amb25147234 [0,2,0,0,0,0|2,0,0]=4 6311 B9R0.45 NCCCCCCCCF Amb25063266 [0,2,0,0,0,0|2,0,0]=4 6312 B9R0.45 NCCCCCCCCO Amb24116967 [0,2,0,0,0,0|1,0,0]=3 6313 B9R0.45 NCCCCCCCCS Amb25757074 [0,2,0,0,0,0|1,1,0]=4 6314 B9R0.45 NCCCCCNCCBr Amb25803610 [0,2,0,0,0,0|2,0,0]=4 6315 B9R0.45 NCCCCCNCCF Amb24456763 [0,2,0,0,0,0|2,0,0]=4 6316 B9R0.45 NCCCCCOCC#N Amb18630587 [0,2,0,0,0,0|1,0,1]=4 6317 B9R0.45 NCCCCCOCCO Amb24456752 [0,2,0,0,0,0|0,0,0]=2 6318 B9R0.45 NCCCCNCCC#N Amb22232909 [0,2,0,0,0,0|2,0,0]=4 6319 B9R0.45 NCCCCNCCCBr Amb24477346 [0,2,0,0,0,0|2,0,0]=4 6320 B9R0.45 NCCCCNCCCCl Amb24117237 [0,2,0,0,0,0|2,0,0]=4 6321 B9R0.45 NCCCCNCCCN Amb22348191 [0,2,0,0,0,0|2,0,0]=4 6322 B9R0.45 NCCCCNCCCN Amb24325393 [0,2,0,0,0,0|2,0,0]=4 6323 B9R0.45 NCCCCOCCCF Amb24515888 [0,2,0,0,0,0|1,0,0]=3 6324 B9R0.45 NCCCCSCCCO Amb17500966 [0,2,0,0,0,0|0,1,0]=3 6325 B9R0.45 NCCCNCCCCBr Amb25113186 [0,2,0,0,0,0|2,0,0]=4 6326 B9R0.45 NCCCNCCCCF Amb25799717 [0,2,0,0,0,0|2,0,0]=4 6327 B9R0.45 NCCCNCCCCO Amb24561165 [0,2,0,0,0,0|1,0,0]=3 6328 B9R0.45 NCCCOCCCCF Amb25095558 [0,2,0,0,0,0|1,0,0]=3 6329 B9R0.45 NCCCONCCCN Amb25368395 [0,2,0,0,0,0|2,0,0]=4 6330 B9R0.45 NCCCSCCCCO Amb24546562 [0,2,0,0,0,0|1,0,0]=3 6331 B9R0.45 NCCNCCCOCC Amb17091042 [0,2,0,0,0,0|2,0,0]=4 6332 B9R0.45 NCCNCCNCCN Amb22348038 [0,2,0,0,0,0|2,0,0]=4 6333 B9R0.45 NCCNCCNCCN Amb22351880 [0,2,0,0,0,0|2,0,0]=4 6334 B9R0.45 NCCNCCNCCO Amb17593677 [0,2,0,0,0,0|1,0,0]=3 6335 B9R0.45 NCCNCCNCCS Amb24425493 [0,2,0,0,0,0|1,1,0]=4 6336 B9R0.45 NCCNCCOCCO Amb24376947 [0,2,0,0,0,0|0,0,0]=2 6337 B9R0.45 NCCNCCSCCS Amb25684741 [0,2,0,0,0,0|0,2,0]=4 6338 B9R0.45 NCCOCCCCC#N Amb24538013 [0,2,0,0,0,0|1,0,0]=3 6339 B9R0.45 NCCOCCCCCO Amb24433692 [0,2,0,0,0,0|1,0,0]=3 6340 B9R0.45 NCCOCCNCCO Amb25147638 [0,2,0,0,0,0|1,0,0]=3 6341 B9R0.45 NCCOCCOCC#N Amb18630543 [0,2,0,0,0,0|1,0,1]=4 6342 B9R0.45 NCCOCCOCCN Amb2583233 [0,2,0,0,0,0|1,0,0]=3 6343 B9R0.45 NCCOCCOCCO Amb10604950 [0,2,0,0,0,0|0,0,0]=2 6344 B9R0.45 NCCOCCOCCO Amb22898774 [0,2,0,0,0,0|0,0,0]=2 6345 B9R0.45 NCCOCCOCCS Amb16184350 [0,2,0,0,0,0|0,1,0]=3 6346 B9R0.45 NCCOCCSCC#C Amb17502013 [0,2,0,0,0,0|1,0,1]=4 6347 B9R0.45 NCCOCCSCC#N Amb17501988 [0,2,0,0,0,0|1,0,1]=4 6348 B9R0.45 NCCOCCSCC=C Amb17501982 [0,2,0,0,0,0|1,0,1]=4 6349 B9R0.45 NCCOCCSCCN Amb24739562 [0,2,0,0,0,0|1,0,0]=3 6350 B9R0.45 NCCOCCSCCO Amb17501998 [0,2,0,0,0,0|0,1,0]=3 6351 B9R0.45 NCCONCCCCN Amb24479078 [0,2,0,0,0,0|1,0,0]=3 6352 B9R0.45 NCCSCCCCCO Amb18183510 [0,2,0,0,0,0|1,0,0]=3 6353 B9R0.45 NCCSCCCCCS Amb24606842 [0,2,0,0,0,0|1,1,0]=4 6354 B9R0.45 NCCSCCNCCF Amb24525388 [0,2,0,0,0,0|1,1,0]=4 6355 B9R0.45 NCCSCCOCCCl Amb24426236 [0,2,0,0,0,0|1,0,0]=3 6356 B9R0.45 NCCSCCOCCO Amb18792709 [0,2,0,0,0,0|0,0,0]=2 6357 B9R0.45 NOCCCCCCON Amb25259240 [0,2,0,0,0,0|2,0,0]=4 6358 B9R0.45 O=CCCCCCCCF Amb25075653 [0,2,0,0,0,0|1,0,1]=4 6359 B9R0.45 O=CCOCCOCCCl Amb25320713 [0,2,0,0,0,0|0,0,2]=4 6360 B9R0.45 O=COCCCCCCBr Amb25074988 [0,2,0,0,0,0|2,0,0]=4 6361 B9R0.45 OCC#CCCCCCCl Amb24568326 [0,2,0,0,0,0|1,0,1]=4 6362 B9R0.45 OCCC#CCCCCCl Amb25378857 [0,2,0,0,0,0|1,0,0]=3 6363 B9R0.45 OCCC#CCCCCO Amb24735154 [0,2,0,0,0,0|1,0,0]=3 6364 B9R0.45 OCCCCCCCC#C Amb10563785 [0,2,0,0,0,0|1,0,0]=3 6365 B9R0.45 OCCCCCCCC=O Amb25765567 [0,2,0,0,0,0|1,0,0]=3 6366 B9R0.45 OCCCCCCCCF Amb25330666 [0,2,0,0,0,0|1,0,0]=3 6367 B9R0.45 OCCCCCCN=C=S Amb24402487 [0,2,0,0,0,0|1,0,1]=4 6368 B9R0.45 OCCCCCCNC=O Amb24452880 [0,2,0,0,0,0|1,0,1]=4 6369 B9R0.45 OCCCCCNCC=C Amb17334217 [0,2,0,0,0,0|1,0,1]=4 6370 B9R0.45 OCCCCCNCCF Amb25697650 [0,2,0,0,0,0|1,0,0]=3 6371 B9R0.45 OCCCCCSCCS Amb25682475 [0,2,0,0,0,0|1,0,0]=3 6372 B9R0.45 OCCCCC\C=C/CC Amb10807384 [0,2,0,0,0,0|1,0,0]=3 6373 B9R0.45 OCCCCC\C=C\CCl Amb24573026 [0,2,0,0,0,0|1,0,1]=4 6374 B9R0.45 OCCCCC\C=C\CF Amb24748585 [0,2,0,0,0,0|1,0,1]=4 6375 B9R0.45 OCCCCNCCCF Amb25065751 [0,2,0,0,0,0|1,0,0]=3 6376 B9R0.45 OCCCCOCC=NO Amb24698671 [0,2,0,0,0,0|0,0,1]=3 6377 B9R0.45 OCCCC\C=C\CCI Amb22364697 [0,2,0,0,0,0|1,0,1]=4 6378 B9R0.45 OCCCSCCCC#N Amb17504247 [0,2,0,0,0,0|0,1,1]=4 6379 B9R0.45 OCCCSSCCCO Amb24573663 [0,2,0,0,0,0|1,1,0]=4 6380 B9R0.45 OCCC\C=C\CCCCl Amb25366573 [0,2,0,0,0,0|1,0,1]=4 6381 B9R0.45 OCCN=CCCCCO Amb25766301 [0,2,0,0,0,0|1,0,0]=3 6382 B9R0.45 OCCNCCCCCO Amb25771811 [0,2,0,0,0,0|1,0,0]=3 6383 B9R0.45 OCCOCCCCCCl Amb25368354 [0,2,0,0,0,0|0,0,0]=2 6384 B9R0.45 OCCOCCNCCF Amb25715702 [0,2,0,0,0,0|0,0,0]=2 6385 B9R0.45 OCCOCCOCCBr Amb24057506 [0,2,0,0,0,0|0,0,0]=2 6386 B9R0.45 OCCOCCOCCF Amb24082372 [0,2,0,0,0,0|0,0,0]=2 6387 B9R0.45 OCCOCCOCCI Amb22497537 [0,2,0,0,0,0|0,0,0]=2 6388 B9R0.45 OCCOCCOCCS Amb17613418 [0,2,0,0,0,0|0,0,0]=2 6389 B9R0.45 OCCOCCSCCO Amb18180098 [0,2,0,0,0,0|0,0,0]=2 6390 B9R0.45 OCCSCCCCCF Amb25800644 [0,2,0,0,0,0|0,1,0]=3 6391 B9R0.45 OCCSCCCCCO Amb18800854 [0,2,0,0,0,0|0,1,0]=3 6392 B9R0.45 OCCSCCCN=C=O Amb24419879 [0,2,0,0,0,0|0,1,1]=4 6393 B9R0.45 OCCSCCCNC=O Amb25362098 [0,2,0,0,0,0|0,1,1]=4 6394 B9R0.45 OCCSCCSCCF Amb24429793 [0,2,0,0,0,0|0,1,0]=3 6395 B9R0.45 OCCSCCSCCO Amb1200412 [0,2,0,0,0,0|0,1,0]=3 6396 B9R0.45 OCOCCCCOCO Amb24674378 [0,2,0,0,0,0|2,0,0]=4 6397 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [0,2,0,0,0,0|1,0,1]=4 6398 B9R0.45 OC\C=C\CCCCCCl Amb24604808 [0,2,0,0,0,0|1,0,1]=4 6399 B9R0.45 SCCOCCOCCCl Amb24711325 [0,2,0,0,0,0|0,1,0]=3 6400 B9R0.45 [N-]=[N+]=NCCCSCCO Amb18788085 [0,2,0,0,0,0|1,1,0]=4 6401 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [0,2,0,0,0,0|2,0,0]=4 6402 B9R0.46 C#CC(O)CCCCCBr Amb22388470 [0,2,0,0,0,0|2,0,0]=4 6403 B9R0.46 C#CCCOC[C@@H](N)CO Amb25682701 [0,2,0,0,0,0|0,0,2]=4 6404 B9R0.46 C=CCCCCC(Cl)CO Amb24482375 [0,2,0,0,0,0|1,0,1]=4 6405 B9R0.46 C=CCCCC[C@@H](O)CO Amb25045635 [0,2,0,0,0,0|1,0,1]=4 6406 B9R0.46 C=CCCOCC(N)CO Amb24359218 [0,2,0,0,0,0|0,0,2]=4 6407 B9R0.46 CC#CCCCC(C)CO Amb24418598 [0,2,0,0,0,0|1,0,1]=4 6408 B9R0.46 CC#CCCC[C@H](C)CO Amb25097822 [0,2,0,0,0,0|1,0,1]=4 6409 B9R0.46 CC#CCCNC(C)CO Amb25072911 [0,2,0,0,0,0|1,0,1]=4 6410 B9R0.46 CC#CCOCC(N)CO Amb25056285 [0,2,0,0,0,0|0,0,2]=4 6411 B9R0.46 CC#CCOCC(O)CCl Amb24480406 [0,2,0,0,0,0|0,0,2]=4 6412 B9R0.46 CC#CCOC[C@@H](N)CO Amb25682691 [0,2,0,0,0,0|0,0,2]=4 6413 B9R0.46 CC(C#N)OCCCCN Amb25272862 [0,2,0,0,0,0|1,0,1]=4 6414 B9R0.46 CC(C=C)NCCCCO Amb25739959 [0,2,0,0,0,0|2,0,0]=4 6415 B9R0.46 CC(C=C)OCCCCN Amb24515942 [0,2,0,0,0,0|1,0,1]=4 6416 B9R0.46 CC(CC)NCCSCC Amb18798053 [0,2,0,0,0,0|2,0,0]=4 6417 B9R0.46 CC(CC)OCCNCC Amb25858511 [0,2,0,0,0,0|1,0,0]=3 6418 B9R0.46 CC(CC)SCCNCC Amb18177756 [0,2,0,0,0,0|1,1,0]=4 6419 B9R0.46 CC(CC)SCCOCC Amb25807293 [0,2,0,0,0,0|1,1,0]=4 6420 B9R0.46 CC(CCCCCN)CN Amb24440497 [0,2,0,0,0,0|2,0,0]=4 6421 B9R0.46 CC(CCCNCC)CC Amb24452952 [0,2,0,0,0,0|2,0,0]=4 6422 B9R0.46 CC(CCOCC=C)C=O Amb24608648 [0,2,0,0,0,0|1,0,1]=4 6423 B9R0.46 CC(CCl)COCCC=C Amb25044835 [0,2,0,0,0,0|2,0,0]=4 6424 B9R0.46 CC(CCl)NCCCCF Amb25254702 [0,2,0,0,0,0|2,0,0]=4 6425 B9R0.46 CC(CCl)OCCCCCl Amb24538065 [0,2,0,0,0,0|1,0,0]=3 6426 B9R0.46 CC(CN)COCCC=C Amb24476923 [0,2,0,0,0,0|2,0,0]=4 6427 B9R0.46 CC(CN)CSCCCO Amb25209405 [0,2,0,0,0,0|1,1,0]=4 6428 B9R0.46 CC(CN)NCCCCF Amb25116077 [0,2,0,0,0,0|2,0,0]=4 6429 B9R0.46 CC(CN)NCCCCO Amb24690014 [0,2,0,0,0,0|2,0,0]=4 6430 B9R0.46 CC(CN)SCCCCF Amb25769529 [0,2,0,0,0,0|1,1,0]=4 6431 B9R0.46 CC(CN)SCCCCO Amb25291417 [0,2,0,0,0,0|1,1,0]=4 6432 B9R0.46 CC(CO)=CCCCCO Amb24719754 [0,2,0,0,0,0|1,0,1]=4 6433 B9R0.46 CC(CO)CCCCC#C Amb24353323 [0,2,0,0,0,0|1,0,1]=4 6434 B9R0.46 CC(CO)CCCCC=C Amb25207695 [0,2,0,0,0,0|1,0,1]=4 6435 B9R0.46 CC(CO)COCCCN Amb24466356 [0,2,0,0,0,0|1,0,0]=3 6436 B9R0.46 CC(CO)CSCCCF Amb24606085 [0,2,0,0,0,0|1,1,0]=4 6437 B9R0.46 CC(CO)CSCCON Amb24621387 [0,2,0,0,0,0|1,1,0]=4 6438 B9R0.46 CC(CO)NCCCC#C Amb25276934 [0,2,0,0,0,0|1,0,1]=4 6439 B9R0.46 CC(CO)NCCCCO Amb24447231 [0,2,0,0,0,0|1,0,0]=3 6440 B9R0.46 CC(CO)OCCCCO Amb25831896 [0,2,0,0,0,0|0,0,0]=2 6441 B9R0.46 CC(CO)SCCCC#N Amb24450326 [0,2,0,0,0,0|0,1,1]=4 6442 B9R0.46 CC(CO)SCCCCF Amb24674715 [0,2,0,0,0,0|0,1,0]=3 6443 B9R0.46 CC(CO)SCCCCO Amb25076423 [0,2,0,0,0,0|0,1,0]=3 6444 B9R0.46 CC(CO)SCCCON Amb24615108 [0,2,0,0,0,0|1,1,0]=4 6445 B9R0.46 CC(COCCCO)C=O Amb25105169 [0,2,0,0,0,0|1,0,1]=4 6446 B9R0.46 CC(CS)COCCC=C Amb24638534 [0,2,0,0,0,0|2,0,0]=4 6447 B9R0.46 CC(CSCCCO)C#N Amb25362730 [0,2,0,0,0,0|2,0,0]=4 6448 B9R0.46 CC(CSCCON)CN Amb24706685 [0,2,0,0,0,0|1,1,0]=4 6449 B9R0.46 CC(CSCSCC)CC Amb24647092 [0,2,0,0,0,0|1,1,0]=4 6450 B9R0.46 CCC(=C)CNCCCO Amb25729045 [0,2,0,0,0,0|1,0,1]=4 6451 B9R0.46 CCC(=C)CSCCOC Amb24414732 [0,2,0,0,0,0|0,1,1]=4 6452 B9R0.46 CCC(=O)CCCCCBr Amb25276919 [0,2,0,0,0,0|2,0,0]=4 6453 B9R0.46 CCC(=O)CCCCCCl Amb24538039 [0,2,0,0,0,0|2,0,0]=4 6454 B9R0.46 CCC(=O)CCCCCF Amb24596312 [0,2,0,0,0,0|2,0,0]=4 6455 B9R0.46 CCC(=O)CCCCOC Amb25797343 [0,2,0,0,0,0|1,0,1]=4 6456 B9R0.46 CCC(=O)CNCCOC Amb24601446 [0,2,0,0,0,0|1,0,1]=4 6457 B9R0.46 CCC(=O)COCCC=C Amb25783572 [0,2,0,0,0,0|1,0,1]=4 6458 B9R0.46 CCC(=O)COCCSC Amb25776675 [0,2,0,0,0,0|0,1,1]=4 6459 B9R0.46 CCC(=O)CSCCOC Amb18800666 [0,2,0,0,0,0|0,1,1]=4 6460 B9R0.46 CCC(=O)OCCCCF Amb25769054 [0,2,0,0,0,0|1,0,1]=4 6461 B9R0.46 CCC(Br)CCCCC=C Amb25730004 [0,2,0,0,0,0|2,0,0]=4 6462 B9R0.46 CCC(Br)CCCCOC Amb24478058 [0,2,0,0,0,0|1,0,0]=3 6463 B9R0.46 CCC(Br)CCCCSC Amb24378596 [0,2,0,0,0,0|1,1,0]=4 6464 B9R0.46 CCC(Br)CCCOCC Amb25306806 [0,2,0,0,0,0|2,0,0]=4 6465 B9R0.46 CCC(C)=CCCCCO Amb25257108 [0,2,0,0,0,0|1,0,1]=4 6466 B9R0.46 CCC(C)C=NNCCO Amb24553240 [0,2,0,0,0,0|1,0,1]=4 6467 B9R0.46 CCC(C)CCCCC#C Amb25062549 [0,2,0,0,0,0|2,0,0]=4 6468 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|1,0,0]=3 6469 B9R0.46 CCC(C)CCCCNC Amb25112487 [0,2,0,0,0,0|2,0,0]=4 6470 B9R0.46 CCC(C)CCNCCN Amb24408652 [0,2,0,0,0,0|2,0,0]=4 6471 B9R0.46 CCC(C)CNCCC#C Amb24477930 [0,2,0,0,0,0|2,0,0]=4 6472 B9R0.46 CCC(C)CNCCC=C Amb25324631 [0,2,0,0,0,0|2,0,0]=4 6473 B9R0.46 CCC(C)CNCCCI Amb24354678 [0,2,0,0,0,0|2,0,0]=4 6474 B9R0.46 CCC(C)CNCCCN Amb25362821 [0,2,0,0,0,0|2,0,0]=4 6475 B9R0.46 CCC(C)CNOCC#C Amb25271228 [0,2,0,0,0,0|1,0,1]=4 6476 B9R0.46 CCC(C)CNOCC=C Amb24564953 [0,2,0,0,0,0|1,0,1]=4 6477 B9R0.46 CCC(C)COCCCO Amb25796282 [0,2,0,0,0,0|0,0,0]=2 6478 B9R0.46 CCC(C)COCCNC Amb25280432 [0,2,0,0,0,0|1,0,0]=3 6479 B9R0.46 CCC(C)CSCCCBr Amb25788393 [0,2,0,0,0,0|1,1,0]=4 6480 B9R0.46 CCC(C)CSCCCN Amb25110467 [0,2,0,0,0,0|1,1,0]=4 6481 B9R0.46 CCC(C)CSCCCO Amb24385529 [0,2,0,0,0,0|0,1,0]=3 6482 B9R0.46 CCC(C)CSCCCS Amb24666140 [0,2,0,0,0,0|0,2,0]=4 6483 B9R0.46 CCC(C)CSCCNC Amb25823239 [0,2,0,0,0,0|1,1,0]=4 6484 B9R0.46 CCC(C)CSCCOC Amb25345600 [0,2,0,0,0,0|0,1,0]=3 6485 B9R0.46 CCC(C)CSCCON Amb25298309 [0,2,0,0,0,0|0,1,0]=3 6486 B9R0.46 CCC(C)NCCCCBr Amb25258875 [0,2,0,0,0,0|2,0,0]=4 6487 B9R0.46 CCC(C)NCCCCCl Amb24751721 [0,2,0,0,0,0|2,0,0]=4 6488 B9R0.46 CCC(C)OCCCC#N Amb25774344 [0,2,0,0,0,0|1,0,1]=4 6489 B9R0.46 CCC(C)OCCCCCl Amb18798378 [0,2,0,0,0,0|1,0,0]=3 6490 B9R0.46 CCC(C)OCCCCN Amb25362392 [0,2,0,0,0,0|1,0,0]=3 6491 B9R0.46 CCC(C)OCCCNC Amb20076073 [0,2,0,0,0,0|1,0,0]=3 6492 B9R0.46 CCC(C)OCSCCN Amb24674436 [0,2,0,0,0,0|1,1,0]=4 6493 B9R0.46 CCC(C)OCSCCO Amb24725754 [0,2,0,0,0,0|0,1,0]=3 6494 B9R0.46 CCC(C)SCCCCCl Amb18184972 [0,2,0,0,0,0|1,1,0]=4 6495 B9R0.46 CCC(C)SCCCNC Amb18177746 [0,2,0,0,0,0|1,1,0]=4 6496 B9R0.46 CCC(C)\C=C\CCCO Amb24588272 [0,2,0,0,0,0|1,0,1]=4 6497 B9R0.46 CCC(C)\C=C\OCCO Amb25213769 [0,2,0,0,0,0|0,0,1]=3 6498 B9R0.46 CCC(Cl)CCCCC#C Amb25711690 [0,2,0,0,0,0|2,0,0]=4 6499 B9R0.46 CCC(Cl)CCCCCCl Amb24447475 [0,2,0,0,0,0|2,0,0]=4 6500 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|1,0,0]=3 6501 B9R0.46 CCC(Cl)CCCNCC Amb24585507 [0,2,0,0,0,0|2,0,0]=4 6502 B9R0.46 CCC(Cl)CCCOCC Amb18800867 [0,2,0,0,0,0|2,0,0]=4 6503 B9R0.46 CCC(Cl)CCOCCCl Amb25227814 [0,2,0,0,0,0|1,0,0]=3 6504 B9R0.46 CCC(F)CSCCC#C Amb24482807 [0,2,0,0,0,0|1,1,0]=4 6505 B9R0.46 CCC(F)CSCCC=C Amb25266636 [0,2,0,0,0,0|1,1,0]=4 6506 B9R0.46 CCC(F)CSCCCF Amb25072144 [0,2,0,0,0,0|1,1,0]=4 6507 B9R0.46 CCC(F)CSCCOC Amb24431294 [0,2,0,0,0,0|0,1,0]=3 6508 B9R0.46 CCC(N)CCCCC#C Amb24469799 [0,2,0,0,0,0|2,0,0]=4 6509 B9R0.46 CCC(N)CCCCC=C Amb24563254 [0,2,0,0,0,0|2,0,0]=4 6510 B9R0.46 CCC(N)CCCNCC Amb25299572 [0,2,0,0,0,0|2,0,0]=4 6511 B9R0.46 CCC(N)CCNCCF Amb24613932 [0,2,0,0,0,0|2,0,0]=4 6512 B9R0.46 CCC(N)CNCCCO Amb25246794 [0,2,0,0,0,0|1,0,0]=3 6513 B9R0.46 CCC(N)CNCCOC Amb25375423 [0,2,0,0,0,0|1,0,0]=3 6514 B9R0.46 CCC(N)COCCCO Amb24473270 [0,2,0,0,0,0|0,0,0]=2 6515 B9R0.46 CCC(N)CSCCCF Amb24669733 [0,2,0,0,0,0|1,1,0]=4 6516 B9R0.46 CCC(N)CSCOCC Amb25109843 [0,2,0,0,0,0|1,1,0]=4 6517 B9R0.46 CCC(O)C#CCCCC Amb24471339 [0,2,0,0,0,0|1,0,1]=4 6518 B9R0.46 CCC(O)CCCCC#N Amb18643752 [0,2,0,0,0,0|2,0,0]=4 6519 B9R0.46 CCC(O)CCCCC=C Amb25359278 [0,2,0,0,0,0|2,0,0]=4 6520 B9R0.46 CCC(O)CCCCCF Amb25846271 [0,2,0,0,0,0|2,0,0]=4 6521 B9R0.46 CCC(O)CCCCCO Amb24403979 [0,2,0,0,0,0|1,0,0]=3 6522 B9R0.46 CCC(O)CCCCSC Amb25198133 [0,2,0,0,0,0|1,1,0]=4 6523 B9R0.46 CCC(O)CCCSCC Amb24450086 [0,2,0,0,0,0|2,0,0]=4 6524 B9R0.46 CCC(O)CCNCCN Amb24371991 [0,2,0,0,0,0|2,0,0]=4 6525 B9R0.46 CCC(O)CNCCC=C Amb24582232 [0,2,0,0,0,0|2,0,0]=4 6526 B9R0.46 CCC(O)CNCCCN Amb24495241 [0,2,0,0,0,0|2,0,0]=4 6527 B9R0.46 CCC(O)CNCCOC Amb24434339 [0,2,0,0,0,0|1,0,0]=3 6528 B9R0.46 CCC(O)CNCCSC Amb25232520 [0,2,0,0,0,0|1,1,0]=4 6529 B9R0.46 CCC(O)CNOCC#C Amb25800173 [0,2,0,0,0,0|1,0,1]=4 6530 B9R0.46 CCC(O)COCCCN Amb24621134 [0,2,0,0,0,0|1,0,0]=3 6531 B9R0.46 CCC(O)COCCNC Amb24556768 [0,2,0,0,0,0|1,0,0]=3 6532 B9R0.46 CCC(O)CSCCCO Amb24603730 [0,2,0,0,0,0|0,1,0]=3 6533 B9R0.46 CCC(O)CSCCOC Amb18792607 [0,2,0,0,0,0|0,1,0]=3 6534 B9R0.46 CCCC=C=CC(C)CO Amb25306485 [0,2,0,0,0,0|1,0,1]=4 6535 B9R0.46 CCCCC#CC(=C)CO Amb25042281 [0,2,0,0,0,0|1,0,1]=4 6536 B9R0.46 CCCCC#CC(C)CO Amb25127843 [0,2,0,0,0,0|1,0,0]=3 6537 B9R0.46 CCCCC#CC(N)CO Amb24424174 [0,2,0,0,0,0|1,0,0]=3 6538 B9R0.46 CCCCC#CC(O)CO Amb25829952 [0,2,0,0,0,0|1,0,0]=3 6539 B9R0.46 CCCCC#C[C@@H](O)CF Amb25832668 [0,2,0,0,0,0|1,0,1]=4 6540 B9R0.46 CCCCC#C[C@@H](O)CO Amb25681401 [0,2,0,0,0,0|1,0,0]=3 6541 B9R0.46 CCCCC=C=C(C)CO Amb25823611 [0,2,0,0,0,0|1,0,1]=4 6542 B9R0.46 CCCCCCC(=C)CBr Amb25067914 [0,2,0,0,0,0|2,0,0]=4 6543 B9R0.46 CCCCCCC(=C)CCl Amb24350824 [0,2,0,0,0,0|2,0,0]=4 6544 B9R0.46 CCCCCCC(=C)CO Amb25145395 [0,2,0,0,0,0|1,0,0]=3 6545 B9R0.46 CCCCCCC(=N)NO Amb22733338 [0,2,0,0,0,0|1,0,1]=4 6546 B9R0.46 CCCCCCC(=O)CBr Amb24078361 [0,2,0,0,0,0|2,0,0]=4 6547 B9R0.46 CCCCCCC(=O)CCl Amb24078365 [0,2,0,0,0,0|2,0,0]=4 6548 B9R0.46 CCCCCCC(=O)CN Amb25731786 [0,2,0,0,0,0|2,0,0]=4 6549 B9R0.46 CCCCCCC(=O)CS Amb25146854 [0,2,0,0,0,0|1,1,0]=4 6550 B9R0.46 CCCCCCC(=O)NO Amb25146254 [0,2,0,0,0,0|1,0,1]=4 6551 B9R0.46 CCCCCCC(Br)C#C Amb17939781 [0,2,0,0,0,0|2,0,0]=4 6552 B9R0.46 CCCCCCC(Br)C#N Amb24597064 [0,2,0,0,0,0|2,0,0]=4 6553 B9R0.46 CCCCCCC(Br)CBr Amb17845325 [0,2,0,0,0,0|2,0,0]=4 6554 B9R0.46 CCCCCCC(Br)CC Amb24476891 [0,2,0,0,0,0|2,0,0]=4 6555 B9R0.46 CCCCCCC(Br)CF Amb25783737 [0,2,0,0,0,0|2,0,0]=4 6556 B9R0.46 CCCCCCC(C)=NO Amb24476810 [0,2,0,0,0,0|1,0,1]=4 6557 B9R0.46 CCCCCCC(C)C=C Amb25209348 [0,2,0,0,0,0|2,0,0]=4 6558 B9R0.46 CCCCCCC(C)CBr Amb20240804 [0,2,0,0,0,0|2,0,0]=4 6559 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|1,0,0]=3 6560 B9R0.46 CCCCCCC(C)NN Amb20623338 [0,2,0,0,0,0|2,0,0]=4 6561 B9R0.46 CCCCCCC(C)NO Amb25048804 [0,2,0,0,0,0|1,0,0]=3 6562 B9R0.46 CCCCCCC(C)OC Amb24637476 [0,2,0,0,0,0|1,0,0]=3 6563 B9R0.46 CCCCCCC(C)[Mg]Br Amb22897345 [0,2,0,0,0,0|2,0,0]=4 6564 B9R0.46 CCCCCCC(C)[Zn]Br Amb22898146 [0,2,0,0,0,0|2,0,0]=4 6565 B9R0.46 CCCCCCC(C=O)C Amb10603627 [0,2,0,0,0,0|1,0,1]=4 6566 B9R0.46 CCCCCCC(CC)O Amb10068521 [0,2,0,0,0,0|1,0,0]=3 6567 B9R0.46 CCCCCCC(CS)S Amb16232249 [0,2,0,0,0,0|1,1,0]=4 6568 B9R0.46 CCCCCCC(Cl)C#N Amb18177676 [0,2,0,0,0,0|2,0,0]=4 6569 B9R0.46 CCCCCCC(Cl)CO Amb24684197 [0,2,0,0,0,0|1,0,0]=3 6570 B9R0.46 CCCCCCC(Cl)OC Amb24433943 [0,2,0,0,0,0|1,0,0]=3 6571 B9R0.46 CCCCCCC(F)C=O Amb25069121 [0,2,0,0,0,0|1,0,1]=4 6572 B9R0.46 CCCCCCC(F)CN Amb24714278 [0,2,0,0,0,0|2,0,0]=4 6573 B9R0.46 CCCCCCC(F)CO Amb24615387 [0,2,0,0,0,0|1,0,0]=3 6574 B9R0.46 CCCCCCC(N)CS Amb25760528 [0,2,0,0,0,0|1,1,0]=4 6575 B9R0.46 CCCCCCC(O)C=C Amb22227999 [0,2,0,0,0,0|1,0,0]=3 6576 B9R0.46 CCCCCCC(O)C=O Amb25820734 [0,2,0,0,0,0|1,0,0]=3 6577 B9R0.46 CCCCCCC(O)CBr Amb24477464 [0,2,0,0,0,0|1,0,0]=3 6578 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|1,0,0]=3 6579 B9R0.46 CCCCCCC(O)OC Amb24482551 [0,2,0,0,0,0|1,0,0]=3 6580 B9R0.46 CCCCCCN(C)CC Amb24332468 [0,2,0,0,0,0|2,0,0]=4 6581 B9R0.46 CCCCCC[C@@H](C)CCl Amb25072753 [0,2,0,0,0,0|2,0,0]=4 6582 B9R0.46 CCCCCC[C@@H](C)CO Amb25332327 [0,2,0,0,0,0|1,0,0]=3 6583 B9R0.46 CCCCCC[C@@H](Cl)CO Amb24618972 [0,2,0,0,0,0|1,0,0]=3 6584 B9R0.46 CCCCCC[C@@H](O)C=C Amb25734439 [0,2,0,0,0,0|1,0,0]=3 6585 B9R0.46 CCCCCC[C@@H](O)CC Amb25076225 [0,2,0,0,0,0|1,0,0]=3 6586 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|1,0,0]=3 6587 B9R0.46 CCCCCC[C@@H](O)CN Amb25147470 [0,2,0,0,0,0|1,0,0]=3 6588 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|1,0,0]=3 6589 B9R0.46 CCCCCC[C@H](C)C=O Amb24374798 [0,2,0,0,0,0|1,0,1]=4 6590 B9R0.46 CCCCCC[C@H](C)CBr Amb24714619 [0,2,0,0,0,0|2,0,0]=4 6591 B9R0.46 CCCCCC[C@H](Cl)C=O Amb25109926 [0,2,0,0,0,0|1,0,1]=4 6592 B9R0.46 CCCCCC[C@H](Cl)CO Amb25113528 [0,2,0,0,0,0|1,0,0]=3 6593 B9R0.46 CCCCCC[C@H](F)C=O Amb24424433 [0,2,0,0,0,0|1,0,1]=4 6594 B9R0.46 CCCCCC[C@H](F)CBr Amb24495511 [0,2,0,0,0,0|2,0,0]=4 6595 B9R0.46 CCCCCC[C@H](O)C=O Amb25285757 [0,2,0,0,0,0|1,0,0]=3 6596 B9R0.46 CCCCCC[C@H](O)CBr Amb24453367 [0,2,0,0,0,0|1,0,0]=3 6597 B9R0.46 CCCCCC[C@H](O)CC Amb25083849 [0,2,0,0,0,0|1,0,0]=3 6598 B9R0.46 CCCCCC[C@H](O)CCl Amb25129523 [0,2,0,0,0,0|1,0,0]=3 6599 B9R0.46 CCCCCC[C@H](O)CO Amb22225460 [0,2,0,0,0,0|1,0,0]=3 6600 B9R0.46 CCCCCC[S+](C)CC Amb25799914 [0,2,0,0,0,0|2,0,0]=4 6601 B9R0.46 CCCCCNC(=O)CO Amb17334236 [0,2,0,0,0,0|1,0,1]=4 6602 B9R0.46 CCCCCNC(C)CBr Amb25060825 [0,2,0,0,0,0|2,0,0]=4 6603 B9R0.46 CCCCCNC(C)CN Amb24661762 [0,2,0,0,0,0|2,0,0]=4 6604 B9R0.46 CCCCCNC(O)CC Amb24578736 [0,2,0,0,0,0|2,0,0]=4 6605 B9R0.46 CCCCCN[C@H](C)CN Amb24381277 [0,2,0,0,0,0|2,0,0]=4 6606 B9R0.46 CCCCCOC(=O)CBr Amb22036620 [0,2,0,0,0,0|1,0,1]=4 6607 B9R0.46 CCCCCOC(=O)CN Amb22277108 [0,2,0,0,0,0|1,0,1]=4 6608 B9R0.46 CCCCCOC(C)C#N Amb25254648 [0,2,0,0,0,0|1,0,1]=4 6609 B9R0.46 CCCCCSC(=C)CO Amb25854022 [0,2,0,0,0,0|0,1,1]=4 6610 B9R0.46 CCCCCSC(C)CC Amb25120456 [0,2,0,0,0,0|1,1,0]=4 6611 B9R0.46 CCCCCSC(C)CCl Amb25788328 [0,2,0,0,0,0|1,1,0]=4 6612 B9R0.46 CCCCCSC(C)CN Amb25831615 [0,2,0,0,0,0|1,1,0]=4 6613 B9R0.46 CCCCCSC(C)CO Amb24456023 [0,2,0,0,0,0|0,1,0]=3 6614 B9R0.46 CCCCNCC(=O)CC Amb24478874 [0,2,0,0,0,0|2,0,0]=4 6615 B9R0.46 CCCCNCC(C)CN Amb24382977 [0,2,0,0,0,0|2,0,0]=4 6616 B9R0.46 CCCCNCC(C)CO Amb25778162 [0,2,0,0,0,0|1,0,0]=3 6617 B9R0.46 CCCCNCC(C)OC Amb23570900 [0,2,0,0,0,0|1,0,0]=3 6618 B9R0.46 CCCCNCC(C)SC Amb18798067 [0,2,0,0,0,0|1,1,0]=4 6619 B9R0.46 CCCCNCC(CO)O Amb17308645 [0,2,0,0,0,0|1,0,0]=3 6620 B9R0.46 CCCCNCC(N)=NO Amb25365486 [0,2,0,0,0,0|1,0,1]=4 6621 B9R0.46 CCCCNCC(O)C=C Amb24524515 [0,2,0,0,0,0|1,0,0]=3 6622 B9R0.46 CCCCNCC(O)CCl Amb24479197 [0,2,0,0,0,0|1,0,0]=3 6623 B9R0.46 CCCCNCC(O)CF Amb24578257 [0,2,0,0,0,0|1,0,0]=3 6624 B9R0.46 CCCCNC[C@@H](N)CC Amb25834994 [0,2,0,0,0,0|2,0,0]=4 6625 B9R0.46 CCCCNC[C@H](N)CC Amb25779083 [0,2,0,0,0,0|2,0,0]=4 6626 B9R0.46 CCCCNOC(C)C=C Amb25342609 [0,2,0,0,0,0|1,0,1]=4 6627 B9R0.46 CCCCOCC(=C)CCl Amb25066972 [0,2,0,0,0,0|1,0,0]=3 6628 B9R0.46 CCCCOCC(=C)CN Amb25769674 [0,2,0,0,0,0|1,0,0]=3 6629 B9R0.46 CCCCOCC(=O)C=C Amb24707067 [0,2,0,0,0,0|0,0,2]=4 6630 B9R0.46 CCCCOCC(=O)CO Amb25264319 [0,2,0,0,0,0|0,0,0]=2 6631 B9R0.46 CCCCOCC(=O)NC Amb24683967 [0,2,0,0,0,0|0,0,2]=4 6632 B9R0.46 CCCCOCC(=O)NN Amb19960250 [0,2,0,0,0,0|0,0,2]=4 6633 B9R0.46 CCCCOCC(=O)NO Amb24684124 [0,2,0,0,0,0|0,0,1]=3 6634 B9R0.46 CCCCOCC(C)CS Amb25788552 [0,2,0,0,0,0|0,1,0]=3 6635 B9R0.46 CCCCOCC(C)NC Amb25050097 [0,2,0,0,0,0|1,0,0]=3 6636 B9R0.46 CCCCOCC(CC)N Amb17485997 [0,2,0,0,0,0|1,0,0]=3 6637 B9R0.46 CCCCOCC(Cl)C=O Amb25138639 [0,2,0,0,0,0|0,0,1]=3 6638 B9R0.46 CCCCOCC(N)C#N Amb24699738 [0,2,0,0,0,0|1,0,0]=3 6639 B9R0.46 CCCCOCC(O)CBr Amb24388692 [0,2,0,0,0,0|0,0,0]=2 6640 B9R0.46 CCCCOCC(O)CI Amb24764143 [0,2,0,0,0,0|0,0,0]=2 6641 B9R0.46 CCCCOC[C@@H](O)CCl Amb24707805 [0,2,0,0,0,0|0,0,0]=2 6642 B9R0.46 CCCCOC[C@H](O)CCl Amb24406600 [0,2,0,0,0,0|0,0,0]=2 6643 B9R0.46 CCCCON=C(N)CC Amb24482859 [0,2,0,0,0,0|1,0,1]=4 6644 B9R0.46 CCCCSCC(=C)CCl Amb25234502 [0,2,0,0,0,0|1,1,0]=4 6645 B9R0.46 CCCCSCC(=C)CS Amb24404561 [0,2,0,0,0,0|0,2,0]=4 6646 B9R0.46 CCCCSCC(=O)CC Amb18800474 [0,2,0,0,0,0|1,1,0]=4 6647 B9R0.46 CCCCSCC(=O)NO Amb25845592 [0,2,0,0,0,0|0,1,1]=4 6648 B9R0.46 CCCCSCC(C)CBr Amb25177328 [0,2,0,0,0,0|1,1,0]=4 6649 B9R0.46 CCCCSCC(C)CC Amb25781749 [0,2,0,0,0,0|1,1,0]=4 6650 B9R0.46 CCCCSCC(C)CCl Amb24355523 [0,2,0,0,0,0|1,1,0]=4 6651 B9R0.46 CCCCSCC(C)CS Amb24407652 [0,2,0,0,0,0|0,2,0]=4 6652 B9R0.46 CCCCSCC(C)NC Amb24554949 [0,2,0,0,0,0|1,1,0]=4 6653 B9R0.46 CCCCSCC(C)OC Amb24464870 [0,2,0,0,0,0|0,1,0]=3 6654 B9R0.46 CCCCSCC(CO)O Amb10669577 [0,2,0,0,0,0|0,1,0]=3 6655 B9R0.46 CCCCSCC(N)C#N Amb18799998 [0,2,0,0,0,0|1,1,0]=4 6656 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|0,1,0]=3 6657 B9R0.46 CCCCSCC(O)C=C Amb24748798 [0,2,0,0,0,0|0,1,0]=3 6658 B9R0.46 CCCCSCC(O)CC Amb18792454 [0,2,0,0,0,0|0,1,0]=3 6659 B9R0.46 CCCCSCC(O)CCl Amb25320949 [0,2,0,0,0,0|0,1,0]=3 6660 B9R0.46 CCCCSC[C@@H](O)CC Amb24584629 [0,2,0,0,0,0|0,1,0]=3 6661 B9R0.46 CCCCSC[C@@H](O)CN Amb24384739 [0,2,0,0,0,0|0,1,0]=3 6662 B9R0.46 CCCCSC[C@H](N)CO Amb24581523 [0,2,0,0,0,0|0,1,0]=3 6663 B9R0.46 CCCC\C=C\C(C)CO Amb25305234 [0,2,0,0,0,0|1,0,0]=3 6664 B9R0.46 CCCC\C=C\C(O)C=C Amb25687957 [0,2,0,0,0,0|1,0,1]=4 6665 B9R0.46 CCCC\C=C\C(O)CCl Amb24555568 [0,2,0,0,0,0|1,0,1]=4 6666 B9R0.46 CCCC\C=C\C(O)CN Amb25142457 [0,2,0,0,0,0|1,0,1]=4 6667 B9R0.46 CCCC\C=C\[C@@H](O)CCl Amb25378854 [0,2,0,0,0,0|1,0,1]=4 6668 B9R0.46 CCCNCCC(=O)CC Amb25366402 [0,2,0,0,0,0|2,0,0]=4 6669 B9R0.46 CCCNCCC(Br)CC Amb25130719 [0,2,0,0,0,0|2,0,0]=4 6670 B9R0.46 CCCNCCC(CN)C Amb17334225 [0,2,0,0,0,0|2,0,0]=4 6671 B9R0.46 CCCNCCC(O)CC Amb24340228 [0,2,0,0,0,0|2,0,0]=4 6672 B9R0.46 CCCNCCN(C)CC Amb25324885 [0,2,0,0,0,0|2,0,0]=4 6673 B9R0.46 CCCNC\C=C(\C)/CO Amb18644033 [0,2,0,0,0,0|1,0,1]=4 6674 B9R0.46 CCCOCCC(=O)NC Amb24410354 [0,2,0,0,0,0|1,0,1]=4 6675 B9R0.46 CCCOCCC(C)C=O Amb24581823 [0,2,0,0,0,0|1,0,0]=3 6676 B9R0.46 CCCOCCC(C)CN Amb24461190 [0,2,0,0,0,0|1,0,0]=3 6677 B9R0.46 CCCOCCC(C)CO Amb24529311 [0,2,0,0,0,0|1,0,0]=3 6678 B9R0.46 CCCOCCC(Cl)C=C Amb24373225 [0,2,0,0,0,0|1,0,1]=4 6679 B9R0.46 CCCOCCC(Cl)CC Amb25794364 [0,2,0,0,0,0|1,0,0]=3 6680 B9R0.46 CCCOCCC(N)C#N Amb24701504 [0,2,0,0,0,0|1,0,1]=4 6681 B9R0.46 CCCOCCC(O)C=C Amb25266854 [0,2,0,0,0,0|1,0,1]=4 6682 B9R0.46 CCCONCC(=C)CC Amb25812810 [0,2,0,0,0,0|1,0,1]=4 6683 B9R0.46 CCCONCC(C)CC Amb24373494 [0,2,0,0,0,0|1,0,0]=3 6684 B9R0.46 CCCONCC(O)CF Amb25749172 [0,2,0,0,0,0|2,0,0]=4 6685 B9R0.46 CCCONCC(O)CO Amb24648565 [0,2,0,0,0,0|2,0,0]=4 6686 B9R0.46 CCCONC[C@@H](O)CC Amb25349554 [0,2,0,0,0,0|1,0,0]=3 6687 B9R0.46 CCCONC[C@H](O)CC Amb25287398 [0,2,0,0,0,0|1,0,0]=3 6688 B9R0.46 CCCONC[C@H](O)CO Amb25784266 [0,2,0,0,0,0|2,0,0]=4 6689 B9R0.46 CCCSCCC(O)CN Amb25849798 [0,2,0,0,0,0|1,1,0]=4 6690 B9R0.46 CCCSCCC(O)CO Amb25359745 [0,2,0,0,0,0|1,0,0]=3 6691 B9R0.46 CCCSCSC(O)CO Amb25234748 [0,2,0,0,0,0|0,1,0]=3 6692 B9R0.46 CCC\C=C\CC(=O)CO Amb24708991 [0,2,0,0,0,0|1,0,1]=4 6693 B9R0.46 CCC\C=C\CC(O)CC Amb24420793 [0,2,0,0,0,0|1,0,1]=4 6694 B9R0.46 CCC\C=C\CC(O)CCl Amb24605090 [0,2,0,0,0,0|1,0,1]=4 6695 B9R0.46 CCC\C=C\CC(O)CO Amb24718536 [0,2,0,0,0,0|1,0,1]=4 6696 B9R0.46 CCC\C=C\C[C@@H](C)CO Amb25219276 [0,2,0,0,0,0|1,0,1]=4 6697 B9R0.46 CCC\C=C\C[C@@H](N)CO Amb24564877 [0,2,0,0,0,0|1,0,1]=4 6698 B9R0.46 CCC\C=C\C[C@H](O)CC Amb25126314 [0,2,0,0,0,0|1,0,1]=4 6699 B9R0.46 CCC\C=C\C[C@H](O)CO Amb25823108 [0,2,0,0,0,0|1,0,1]=4 6700 B9R0.46 CCN(C)CCCCCBr Amb25728227 [0,2,0,0,0,0|2,0,0]=4 6701 B9R0.46 CCN(C)CCCCCCl Amb18788251 [0,2,0,0,0,0|2,0,0]=4 6702 B9R0.46 CCN(C)CCCCCN Amb24700898 [0,2,0,0,0,0|2,0,0]=4 6703 B9R0.46 CCN(C)CCCCCO Amb24677798 [0,2,0,0,0,0|1,0,0]=3 6704 B9R0.46 CCN(C)CCCCCS Amb25769217 [0,2,0,0,0,0|1,1,0]=4 6705 B9R0.46 CCN(C)CCNCCO Amb25071808 [0,2,0,0,0,0|1,0,0]=3 6706 B9R0.46 CCN(C)CCOCCO Amb24616704 [0,2,0,0,0,0|0,0,0]=2 6707 B9R0.46 CCNCCCC(C)CN Amb24724138 [0,2,0,0,0,0|2,0,0]=4 6708 B9R0.46 CCNCCCC(C)CO Amb25072913 [0,2,0,0,0,0|1,0,0]=3 6709 B9R0.46 CCNCCCC(C)OC Amb25738781 [0,2,0,0,0,0|2,0,0]=4 6710 B9R0.46 CCNCCOC(C)C#N Amb25105313 [0,2,0,0,0,0|1,0,1]=4 6711 B9R0.46 CCOCCCC(C)CO Amb25291426 [0,2,0,0,0,0|1,0,0]=3 6712 B9R0.46 CCOCCNC(=O)CO Amb25372631 [0,2,0,0,0,0|1,0,1]=4 6713 B9R0.46 CCOCCN[C@@H](C)CN Amb25044711 [0,2,0,0,0,0|2,0,0]=4 6714 B9R0.46 CCOCCOC(=O)CBr Amb25765727 [0,2,0,0,0,0|1,0,1]=4 6715 B9R0.46 CCOCCOC(=O)CCl Amb18602724 [0,2,0,0,0,0|1,0,1]=4 6716 B9R0.46 CCOCCOC(C)C#N Amb25075361 [0,2,0,0,0,0|1,0,1]=4 6717 B9R0.46 CCOCCOC(C)CN Amb25361567 [0,2,0,0,0,0|1,0,0]=3 6718 B9R0.46 CCOCCO[C@@H](C)C=O Amb24441439 [0,2,0,0,0,0|0,0,2]=4 6719 B9R0.46 CCOCCO[C@@H](C)CO Amb25356206 [0,2,0,0,0,0|0,0,0]=2 6720 B9R0.46 CCOCOCC(C)CN Amb25147445 [0,2,0,0,0,0|2,0,0]=4 6721 B9R0.46 CCOCSCC(C)CO Amb24482498 [0,2,0,0,0,0|1,1,0]=4 6722 B9R0.46 CCS(=O)CCCCCCl Amb24740814 [0,2,0,0,0,0|2,0,0]=4 6723 B9R0.46 CCS(=O)CCCCCN Amb24573569 [0,2,0,0,0,0|2,0,0]=4 6724 B9R0.46 CCS(=O)CCCCCO Amb25246408 [0,2,0,0,0,0|1,0,0]=3 6725 B9R0.46 CCS(=O)CCNCCN Amb24369752 [0,2,0,0,0,0|2,0,0]=4 6726 B9R0.46 CCS(=O)CCNCCO Amb25222985 [0,2,0,0,0,0|1,0,0]=3 6727 B9R0.46 CCSCCCC(C)CBr Amb24509145 [0,2,0,0,0,0|2,0,0]=4 6728 B9R0.46 CCSCCCC(C)CN Amb25046097 [0,2,0,0,0,0|2,0,0]=4 6729 B9R0.46 CCSCCNC(C)CBr Amb24479732 [0,2,0,0,0,0|2,0,0]=4 6730 B9R0.46 CCSCCNC(C)CO Amb24475699 [0,2,0,0,0,0|1,0,0]=3 6731 B9R0.46 CCSCCN[C@@H](C)CO Amb25099839 [0,2,0,0,0,0|1,0,0]=3 6732 B9R0.46 CCSCCN[C@H](C)CO Amb24466714 [0,2,0,0,0,0|1,0,0]=3 6733 B9R0.46 CCSCSCC(C)CO Amb24422060 [0,2,0,0,0,0|1,1,0]=4 6734 B9R0.46 CC[C@@H](C)CCCCCBr Amb24651500 [0,2,0,0,0,0|2,0,0]=4 6735 B9R0.46 CC[C@@H](C)CCCCCO Amb22746927 [0,2,0,0,0,0|1,0,0]=3 6736 B9R0.46 CC[C@@H](C)OCCCCCl Amb25760660 [0,2,0,0,0,0|1,0,0]=3 6737 B9R0.46 CC[C@@H](O)C#CCCCC Amb24406042 [0,2,0,0,0,0|1,0,1]=4 6738 B9R0.46 CC[C@@H](O)CCCCCF Amb24448035 [0,2,0,0,0,0|2,0,0]=4 6739 B9R0.46 CC[C@@H](O)CNCCOC Amb25807907 [0,2,0,0,0,0|1,0,0]=3 6740 B9R0.46 CC[C@@H](O)CNCCSC Amb24736269 [0,2,0,0,0,0|1,1,0]=4 6741 B9R0.46 CC[C@@H](O)CNOCC=C Amb24625926 [0,2,0,0,0,0|1,0,1]=4 6742 B9R0.46 CC[C@@H](O)CSCCOC Amb24662809 [0,2,0,0,0,0|0,1,0]=3 6743 B9R0.46 CC[C@@H](O)\C=C\CCCC Amb24379864 [0,2,0,0,0,0|1,0,1]=4 6744 B9R0.46 CC[C@H](C)CCCCC=O Amb25691434 [0,2,0,0,0,0|1,0,1]=4 6745 B9R0.46 CC[C@H](C)CCCCCBr Amb24477236 [0,2,0,0,0,0|2,0,0]=4 6746 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|1,0,0]=3 6747 B9R0.46 CC[C@H](C)COCCCBr Amb24356696 [0,2,0,0,0,0|1,0,0]=3 6748 B9R0.46 CC[C@H](C)C\C=C\CCO Amb25317632 [0,2,0,0,0,0|1,0,0]=3 6749 B9R0.46 CC[C@H](O)CNCCCF Amb24551656 [0,2,0,0,0,0|2,0,0]=4 6750 B9R0.46 CC[C@H](O)CNCCCN Amb25793257 [0,2,0,0,0,0|2,0,0]=4 6751 B9R0.46 CC[C@H](O)CNCCCO Amb25347959 [0,2,0,0,0,0|1,0,0]=3 6752 B9R0.46 CC[C@H](O)CNCCOC Amb25759827 [0,2,0,0,0,0|1,0,0]=3 6753 B9R0.46 CC[C@H](O)CNOCC#C Amb24389855 [0,2,0,0,0,0|1,0,1]=4 6754 B9R0.46 CC[C@H](O)CSCCCO Amb24571047 [0,2,0,0,0,0|0,1,0]=3 6755 B9R0.46 CC[C@H](O)\C=C\CCCC Amb25806713 [0,2,0,0,0,0|1,0,1]=4 6756 B9R0.46 CC\C(\C)=C/COCCCl Amb24480514 [0,2,0,0,0,0|1,0,1]=4 6757 B9R0.46 CC\C=C/CCC(N)CO Amb24558725 [0,2,0,0,0,0|1,0,1]=4 6758 B9R0.46 CC\C=C\CCC(C)CO Amb25682791 [0,2,0,0,0,0|1,0,1]=4 6759 B9R0.46 CC\C=C\CCC(O)CO Amb25806679 [0,2,0,0,0,0|1,0,1]=4 6760 B9R0.46 CC\C=C\CC[C@@H](O)CO Amb25245918 [0,2,0,0,0,0|1,0,1]=4 6761 B9R0.46 CN(CCOCCBr)C#N Amb25785679 [0,2,0,0,0,0|2,0,0]=4 6762 B9R0.46 CN(CCOCCO)C#N Amb24481154 [0,2,0,0,0,0|1,0,0]=3 6763 B9R0.46 CNC(=O)CCNCCO Amb24478100 [0,2,0,0,0,0|1,0,1]=4 6764 B9R0.46 CNC(=O)CCSCCO Amb18798234 [0,2,0,0,0,0|0,1,1]=4 6765 B9R0.46 CNC(C)CCCCCO Amb25680151 [0,2,0,0,0,0|1,0,0]=3 6766 B9R0.46 CNC(C)CNCCCC Amb24477898 [0,2,0,0,0,0|2,0,0]=4 6767 B9R0.46 CNC(C)CSCCCO Amb24626031 [0,2,0,0,0,0|1,1,0]=4 6768 B9R0.46 CNCCCCC(N)CO Amb25217030 [0,2,0,0,0,0|1,0,0]=3 6769 B9R0.46 CNCCCCC(OC)C Amb17569968 [0,2,0,0,0,0|2,0,0]=4 6770 B9R0.46 CNCCCNC(C)CC Amb20171984 [0,2,0,0,0,0|2,0,0]=4 6771 B9R0.46 CNCCCSC(C)CN Amb24474442 [0,2,0,0,0,0|1,1,0]=4 6772 B9R0.46 CNCCCSC(C)CO Amb25359962 [0,2,0,0,0,0|0,1,0]=3 6773 B9R0.46 CNCCOCC(O)CN Amb24674063 [0,2,0,0,0,0|1,0,0]=3 6774 B9R0.46 CNCCOCC(O)CO Amb24458754 [0,2,0,0,0,0|1,0,0]=3 6775 B9R0.46 CNCCSCC(C)CO Amb24708964 [0,2,0,0,0,0|1,1,0]=4 6776 B9R0.46 CNCCSCC(O)CN Amb25374356 [0,2,0,0,0,0|1,1,0]=4 6777 B9R0.46 CN[C@@H](C)CNCCOC Amb25140354 [0,2,0,0,0,0|2,0,0]=4 6778 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,2,0,0,0,0|1,0,1]=4 6779 B9R0.46 COC(=O)COCCCBr Amb24477190 [0,2,0,0,0,0|1,0,1]=4 6780 B9R0.46 COC(C)CCCCCCl Amb25809507 [0,2,0,0,0,0|2,0,0]=4 6781 B9R0.46 COC(C)CCCCCO Amb25756223 [0,2,0,0,0,0|1,0,0]=3 6782 B9R0.46 COC(C)CCNCCF Amb25323221 [0,2,0,0,0,0|2,0,0]=4 6783 B9R0.46 COC(C)CCOCCO Amb25855823 [0,2,0,0,0,0|0,0,0]=2 6784 B9R0.46 COC(C)CNCCCBr Amb25147770 [0,2,0,0,0,0|2,0,0]=4 6785 B9R0.46 COC(C)CNCCCF Amb25091456 [0,2,0,0,0,0|2,0,0]=4 6786 B9R0.46 COC(C)CNCCCI Amb24431931 [0,2,0,0,0,0|2,0,0]=4 6787 B9R0.46 COC(C)CNCCCO Amb25374619 [0,2,0,0,0,0|2,0,0]=4 6788 B9R0.46 COC(C)CNCCSC Amb25340765 [0,2,0,0,0,0|2,0,0]=4 6789 B9R0.46 COC(C)COCCNC Amb25794422 [0,2,0,0,0,0|1,0,0]=3 6790 B9R0.46 COC(C)CSCCCF Amb25169378 [0,2,0,0,0,0|1,1,0]=4 6791 B9R0.46 COC(C)CSCCCO Amb24586265 [0,2,0,0,0,0|1,1,0]=4 6792 B9R0.46 COCCCCC(C)CN Amb24644918 [0,2,0,0,0,0|2,0,0]=4 6793 B9R0.46 COCCCCC(Cl)CCl Amb25233418 [0,2,0,0,0,0|2,0,0]=4 6794 B9R0.46 COCCCCC(NC)C Amb17569972 [0,2,0,0,0,0|2,0,0]=4 6795 B9R0.46 COCCCNC(C)CBr Amb25100712 [0,2,0,0,0,0|2,0,0]=4 6796 B9R0.46 COCCCNC(C)CCl Amb25705686 [0,2,0,0,0,0|2,0,0]=4 6797 B9R0.46 COCCCNC(C)CN Amb24690013 [0,2,0,0,0,0|2,0,0]=4 6798 B9R0.46 COCCCOC(=O)CC Amb24350143 [0,2,0,0,0,0|1,0,1]=4 6799 B9R0.46 COCCCSC(C)CN Amb24400759 [0,2,0,0,0,0|1,1,0]=4 6800 B9R0.46 COCCCSC(C)CO Amb25776315 [0,2,0,0,0,0|0,1,0]=3 6801 B9R0.46 COCCC\C=C(\C)/CO Amb24513532 [0,2,0,0,0,0|1,0,1]=4 6802 B9R0.46 COCCNCC(C)CN Amb24727363 [0,2,0,0,0,0|2,0,0]=4 6803 B9R0.46 COCCNCC(C)SC Amb18182605 [0,2,0,0,0,0|2,0,0]=4 6804 B9R0.46 COCCNCC(CO)O Amb17308972 [0,2,0,0,0,0|2,0,0]=4 6805 B9R0.46 COCCNCC(O)C#C Amb25725736 [0,2,0,0,0,0|2,0,0]=4 6806 B9R0.46 COCCNCC(O)CF Amb24737289 [0,2,0,0,0,0|2,0,0]=4 6807 B9R0.46 COCCNC[C@H](O)CO Amb25055503 [0,2,0,0,0,0|2,0,0]=4 6808 B9R0.46 COCCOCC(=C)CCl Amb25114691 [0,2,0,0,0,0|1,0,1]=4 6809 B9R0.46 COCCOCC(=C)CS Amb25091771 [0,2,0,0,0,0|1,0,1]=4 6810 B9R0.46 COCCOCC(=N)NC Amb24595133 [0,2,0,0,0,0|1,0,1]=4 6811 B9R0.46 COCCOCC(=N)OC Amb25240882 [0,2,0,0,0,0|1,0,1]=4 6812 B9R0.46 COCCOCC(=O)CCl Amb25704798 [0,2,0,0,0,0|1,0,1]=4 6813 B9R0.46 COCCOCC(=O)NC Amb24476338 [0,2,0,0,0,0|1,0,1]=4 6814 B9R0.46 COCCOCC(=O)NO Amb24593158 [0,2,0,0,0,0|1,0,1]=4 6815 B9R0.46 COCCOCC(C)CBr Amb24664875 [0,2,0,0,0,0|1,0,0]=3 6816 B9R0.46 COCCOCC(C)CCl Amb25321390 [0,2,0,0,0,0|1,0,0]=3 6817 B9R0.46 COCCOCC(C)CO Amb25851627 [0,2,0,0,0,0|1,0,0]=3 6818 B9R0.46 COCCOCC(C)CS Amb25333043 [0,2,0,0,0,0|1,0,0]=3 6819 B9R0.46 COCCOCC(C)NN Amb24480923 [0,2,0,0,0,0|2,0,0]=4 6820 B9R0.46 COCCOCC(N)C#N Amb25331654 [0,2,0,0,0,0|1,0,1]=4 6821 B9R0.46 COCCOCC(N)C=C Amb24372750 [0,2,0,0,0,0|0,0,2]=4 6822 B9R0.46 COCCOCC(O)C#C Amb24707422 [0,2,0,0,0,0|1,0,0]=3 6823 B9R0.46 COCCOCC(O)CBr Amb24632679 [0,2,0,0,0,0|1,0,0]=3 6824 B9R0.46 COCCOCC(O)OC Amb25356298 [0,2,0,0,0,0|1,0,0]=3 6825 B9R0.46 COCCOC[C@@H](N)CC Amb24603306 [0,2,0,0,0,0|0,0,0]=2 6826 B9R0.46 COCCOC[C@@H](O)CN Amb24481122 [0,2,0,0,0,0|1,0,0]=3 6827 B9R0.46 COCCOC[C@H](N)CC Amb24557892 [0,2,0,0,0,0|0,0,0]=2 6828 B9R0.46 COCCON=C(N)CC Amb24482947 [0,2,0,0,0,0|1,0,1]=4 6829 B9R0.46 COCCONC(=O)CC Amb25066775 [0,2,0,0,0,0|1,0,1]=4 6830 B9R0.46 COCCONC(=O)CO Amb25345661 [0,2,0,0,0,0|1,0,1]=4 6831 B9R0.46 COCCONC(C)CC Amb25124211 [0,2,0,0,0,0|1,0,0]=3 6832 B9R0.46 COCCSCC(C)CCl Amb24710449 [0,2,0,0,0,0|1,1,0]=4 6833 B9R0.46 COCCSCC(O)CBr Amb25065740 [0,2,0,0,0,0|1,1,0]=4 6834 B9R0.46 COCCSCC(O)CCl Amb24407851 [0,2,0,0,0,0|1,1,0]=4 6835 B9R0.46 COCCSCC(O)CF Amb24736090 [0,2,0,0,0,0|1,1,0]=4 6836 B9R0.46 COCCSC[C@@H](O)CN Amb25126113 [0,2,0,0,0,0|1,1,0]=4 6837 B9R0.46 COCCSC[C@H](O)CN Amb25742383 [0,2,0,0,0,0|1,1,0]=4 6838 B9R0.46 COCOCC[C@H](O)CO Amb25129719 [0,2,0,0,0,0|2,0,0]=4 6839 B9R0.46 CON(C)CCCCCO Amb25763782 [0,2,0,0,0,0|2,0,0]=4 6840 B9R0.46 CON(C)CCOCCO Amb25222706 [0,2,0,0,0,0|1,0,0]=3 6841 B9R0.46 CSC(C)CCNCCF Amb24711184 [0,2,0,0,0,0|2,0,0]=4 6842 B9R0.46 CSC(C)CCNCCN Amb25712028 [0,2,0,0,0,0|2,0,0]=4 6843 B9R0.46 CSC(C)CCOCC=O Amb24587616 [0,2,0,0,0,0|0,0,2]=4 6844 B9R0.46 CSC(C)CCOCCBr Amb24647581 [0,2,0,0,0,0|1,0,0]=3 6845 B9R0.46 CSC(C)CCOCCCl Amb24572508 [0,2,0,0,0,0|1,0,0]=3 6846 B9R0.46 CSC(C)CNCCCO Amb25283162 [0,2,0,0,0,0|2,0,0]=4 6847 B9R0.46 CSCCCN[C@@H](C)CN Amb24441361 [0,2,0,0,0,0|2,0,0]=4 6848 B9R0.46 CSCCCOC(=O)CS Amb25252055 [0,2,0,0,0,0|0,1,1]=4 6849 B9R0.46 CSCCCOC(C)C#N Amb24692217 [0,2,0,0,0,0|1,0,1]=4 6850 B9R0.46 CSCCCOC(C)CN Amb24570569 [0,2,0,0,0,0|1,0,0]=3 6851 B9R0.46 CSCCCSC(C)CN Amb25287561 [0,2,0,0,0,0|1,1,0]=4 6852 B9R0.46 CSCCCSC(C)CO Amb24452951 [0,2,0,0,0,0|0,1,0]=3 6853 B9R0.46 CSCCOCC(=C)CCl Amb25132750 [0,2,0,0,0,0|2,0,0]=4 6854 B9R0.46 CSCCOCC(=C)CN Amb24474446 [0,2,0,0,0,0|2,0,0]=4 6855 B9R0.46 CSCCOCC(C)CCl Amb25173432 [0,2,0,0,0,0|1,1,0]=4 6856 B9R0.46 CSCCOCC(C)CS Amb25271654 [0,2,0,0,0,0|1,1,0]=4 6857 B9R0.46 CSCCOCC(N)CO Amb25850816 [0,2,0,0,0,0|1,0,0]=3 6858 B9R0.46 CSCCOCC(O)CBr Amb25825561 [0,2,0,0,0,0|1,0,0]=3 6859 B9R0.46 CSCCONC(=O)CO Amb25704529 [0,2,0,0,0,0|1,0,1]=4 6860 B9R0.46 CSCCSCC(C)CC Amb25832324 [0,2,0,0,0,0|0,2,0]=4 6861 B9R0.46 CSCCSCC(C)CO Amb24376757 [0,2,0,0,0,0|1,1,0]=4 6862 B9R0.46 CSCCSCC(C)OC Amb25283025 [0,2,0,0,0,0|1,1,0]=4 6863 B9R0.46 CSCCSCC(F)CC Amb24354035 [0,2,0,0,0,0|0,2,0]=4 6864 B9R0.46 CSCCSCC(N)CO Amb24398857 [0,2,0,0,0,0|1,1,0]=4 6865 B9R0.46 CSCCSCC(O)CCl Amb24728138 [0,2,0,0,0,0|1,1,0]=4 6866 B9R0.46 CSCCSC[C@@H](O)CC Amb24374866 [0,2,0,0,0,0|0,2,0]=4 6867 B9R0.46 CSCCSC[C@H](O)CC Amb24356149 [0,2,0,0,0,0|0,2,0]=4 6868 B9R0.46 CSCOCCC(O)CO Amb24509370 [0,2,0,0,0,0|2,0,0]=4 6869 B9R0.46 CSCOCC[C@@H](O)CO Amb24407496 [0,2,0,0,0,0|2,0,0]=4 6870 B9R0.46 CSSCCNC(C)CO Amb24538757 [0,2,0,0,0,0|2,0,0]=4 6871 B9R0.46 C[C@@H](CCOCC=C)C=O Amb24690646 [0,2,0,0,0,0|1,0,1]=4 6872 B9R0.46 C[C@H](CCCCCO)CO Amb24363587 [0,2,0,0,0,0|1,0,0]=3 6873 B9R0.46 C[C@H](CCOCC=C)C=O Amb24662383 [0,2,0,0,0,0|1,0,1]=4 6874 B9R0.46 C[C@H](CC\C=C\CO)C=C Amb24509016 [0,2,0,0,0,0|1,0,1]=4 6875 B9R0.46 C\C(\CO)=C/CCCCN Amb25314967 [0,2,0,0,0,0|1,0,1]=4 6876 B9R0.46 C\C=C\COCC(O)CCl Amb25709578 [0,2,0,0,0,0|0,0,2]=4 6877 B9R0.46 C\C=C\COCC(O)CO Amb25792409 [0,2,0,0,0,0|0,0,2]=4 6878 B9R0.46 N#CC(O)CCCCCCl Amb24616334 [0,2,0,0,0,0|2,0,0]=4 6879 B9R0.46 N#CCCCOC(=O)CO Amb24703415 [0,2,0,0,0,0|0,0,2]=4 6880 B9R0.46 N#C[C@@H](O)CCCCCBr Amb25790100 [0,2,0,0,0,0|2,0,0]=4 6881 B9R0.46 NC(CCCCCO)CO Amb25323751 [0,2,0,0,0,0|1,0,0]=3 6882 B9R0.46 NC(CCSCCO)C#N Amb18787997 [0,2,0,0,0,0|0,1,1]=4 6883 B9R0.46 NC(CO)CCCCCF Amb24704903 [0,2,0,0,0,0|1,0,0]=3 6884 B9R0.46 NC(CO)COCCCF Amb25855212 [0,2,0,0,0,0|1,0,0]=3 6885 B9R0.46 NC(CSCCCO)CO Amb24549825 [0,2,0,0,0,0|1,1,0]=4 6886 B9R0.46 NCC(=O)OCCCCCl Amb25200017 [0,2,0,0,0,0|1,0,1]=4 6887 B9R0.46 NCC(O)CCCCCBr Amb25290968 [0,2,0,0,0,0|2,0,0]=4 6888 B9R0.46 NCC(O)CNCCCBr Amb25253487 [0,2,0,0,0,0|2,0,0]=4 6889 B9R0.46 NCCCCCC(N)CBr Amb25857899 [0,2,0,0,0,0|2,0,0]=4 6890 B9R0.46 NCCCCNC(CC)C Amb17334223 [0,2,0,0,0,0|2,0,0]=4 6891 B9R0.46 NCCCNCC(O)CF Amb25348382 [0,2,0,0,0,0|2,0,0]=4 6892 B9R0.46 NCCCNCC(O)CN Amb25198252 [0,2,0,0,0,0|2,0,0]=4 6893 B9R0.46 NCCCNCC(O)CO Amb24395671 [0,2,0,0,0,0|2,0,0]=4 6894 B9R0.46 NCCCNC[C@H](N)CO Amb25848603 [0,2,0,0,0,0|2,0,0]=4 6895 B9R0.46 NCCCOCC(O)CN Amb24479062 [0,2,0,0,0,0|1,0,0]=3 6896 B9R0.46 NCCCOCC(O)CO Amb24654813 [0,2,0,0,0,0|1,0,0]=3 6897 B9R0.46 NCCCSCC(O)CN Amb25352516 [0,2,0,0,0,0|1,1,0]=4 6898 B9R0.46 NNC(=O)CCOCCO Amb25769029 [0,2,0,0,0,0|1,0,1]=4 6899 B9R0.46 O=C(CBr)OCCCCBr Amb24598197 [0,2,0,0,0,0|1,0,1]=4 6900 B9R0.46 O=C(CCl)OCCCCCl Amb24355856 [0,2,0,0,0,0|1,0,1]=4 6901 B9R0.46 O=C(CF)OCCCCBr Amb24477290 [0,2,0,0,0,0|1,0,1]=4 6902 B9R0.46 O=C(CF)OCCCCCl Amb25709579 [0,2,0,0,0,0|1,0,1]=4 6903 B9R0.46 OC(CCl)CSCCCS Amb24653522 [0,2,0,0,0,0|1,1,0]=4 6904 B9R0.46 OCC(=O)NCCCCF Amb25731398 [0,2,0,0,0,0|1,0,1]=4 6905 B9R0.46 OCC(O)C#CCCCCl Amb25725221 [0,2,0,0,0,0|1,0,1]=4 6906 B9R0.46 OCC(O)CNCCCF Amb25327089 [0,2,0,0,0,0|2,0,0]=4 6907 B9R0.46 OCC(O)COCCCF Amb22008115 [0,2,0,0,0,0|1,0,0]=3 6908 B9R0.46 OCCCCCC(O)CO Amb22731576 [0,2,0,0,0,0|1,0,0]=3 6909 B9R0.46 OCCCCNC(=O)CC Amb17102978 [0,2,0,0,0,0|1,0,1]=4 6910 B9R0.46 OCCCCNC(CC)C Amb17334253 [0,2,0,0,0,0|1,0,0]=3 6911 B9R0.46 OCCCCOC(=O)CCl Amb24406599 [0,2,0,0,0,0|1,0,1]=4 6912 B9R0.46 OCCCNCC(O)CF Amb24551855 [0,2,0,0,0,0|2,0,0]=4 6913 B9R0.46 OCCCNCC(O)CO Amb25700542 [0,2,0,0,0,0|2,0,0]=4 6914 B9R0.46 OCCCNC[C@H](O)CO Amb25705530 [0,2,0,0,0,0|2,0,0]=4 6915 B9R0.46 OCCCSCC(O)CF Amb24583481 [0,2,0,0,0,0|1,1,0]=4 6916 B9R0.46 [C-]#[N+]CCSCC(C)CC Amb25187300 [0,2,0,0,0,0|1,1,0]=4 6917 B9R0.1 CC(=O)CCOC(=O)CO Amb24482823 [0,2,0,0,0,0|0,0,2]=4 6918 B9R0.1 CC(C)CCCC(Br)CC Amb25255283 [0,2,0,0,0,0|2,0,0]=4 6919 B9R0.1 CC(C)CCCC(C)CCl Amb25056436 [0,2,0,0,0,0|2,0,0]=4 6920 B9R0.1 CC(C)CCCC(C)CN Amb18644042 [0,2,0,0,0,0|2,0,0]=4 6921 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,2,0,0,0,0|1,0,0]=3 6922 B9R0.1 CC(C)CCCC(Cl)CC Amb24366924 [0,2,0,0,0,0|2,0,0]=4 6923 B9R0.1 CC(C)CCCC(F)CO Amb25105959 [0,2,0,0,0,0|1,0,0]=3 6924 B9R0.1 CC(C)CCCC(O)CC Amb24478002 [0,2,0,0,0,0|2,0,0]=4 6925 B9R0.1 CC(C)CCCC(O)CCl Amb24502306 [0,2,0,0,0,0|2,0,0]=4 6926 B9R0.1 CC(C)CCC[C@@H](C)CN Amb25147597 [0,2,0,0,0,0|2,0,0]=4 6927 B9R0.1 CC(C)CCC[C@@H](O)CCl Amb24505277 [0,2,0,0,0,0|2,0,0]=4 6928 B9R0.1 CC(C)CCC[C@H](O)CO Amb25069735 [0,2,0,0,0,0|1,0,0]=3 6929 B9R0.1 CC(C)CCNC(C)CCl Amb25098708 [0,2,0,0,0,0|2,0,0]=4 6930 B9R0.1 CC(C)CCNC(C)CF Amb24524488 [0,2,0,0,0,0|2,0,0]=4 6931 B9R0.1 CC(C)CCNC(C)CN Amb25185161 [0,2,0,0,0,0|2,0,0]=4 6932 B9R0.1 CC(C)CCN[C@@H](C)CO Amb25686264 [0,2,0,0,0,0|1,0,0]=3 6933 B9R0.1 CC(C)CCOC(=O)CBr Amb25828483 [0,2,0,0,0,0|1,0,1]=4 6934 B9R0.1 CC(C)CCOC(=O)CS Amb22230770 [0,2,0,0,0,0|0,1,1]=4 6935 B9R0.1 CC(C)CCOC(C)CN Amb24502261 [0,2,0,0,0,0|1,0,0]=3 6936 B9R0.1 CC(C)CCOC(Cl)CCl Amb17689391 [0,2,0,0,0,0|1,0,0]=3 6937 B9R0.1 CC(C)CCO[C@@H](C)CO Amb25357520 [0,2,0,0,0,0|0,0,0]=2 6938 B9R0.1 CC(C)CCSC(C)CC Amb24450679 [0,2,0,0,0,0|1,1,0]=4 6939 B9R0.1 CC(C)CCSC(C)CN Amb25064976 [0,2,0,0,0,0|1,1,0]=4 6940 B9R0.1 CC(C)CNCC(N)CC Amb25083649 [0,2,0,0,0,0|2,0,0]=4 6941 B9R0.1 CC(C)CNCC(O)CC Amb24558054 [0,2,0,0,0,0|2,0,0]=4 6942 B9R0.1 CC(C)CNC[C@@H](N)CC Amb24395705 [0,2,0,0,0,0|2,0,0]=4 6943 B9R0.1 CC(C)CNC[C@@H](O)CC Amb24425124 [0,2,0,0,0,0|2,0,0]=4 6944 B9R0.1 CC(C)CNC[C@H](C)CO Amb25071769 [0,2,0,0,0,0|2,0,0]=4 6945 B9R0.1 CC(C)CNC[C@H](N)CC Amb24361562 [0,2,0,0,0,0|2,0,0]=4 6946 B9R0.1 CC(C)COCC(C)CBr Amb25253385 [0,2,0,0,0,0|2,0,0]=4 6947 B9R0.1 CC(C)COCC(C)CCl Amb25772268 [0,2,0,0,0,0|2,0,0]=4 6948 B9R0.1 CC(C)COCC(C)CO Amb25718715 [0,2,0,0,0,0|2,0,0]=4 6949 B9R0.1 CC(C)COCC(O)CC Amb25728347 [0,2,0,0,0,0|1,0,0]=3 6950 B9R0.1 CC(C)COC[C@@H](O)CN Amb24659665 [0,2,0,0,0,0|2,0,0]=4 6951 B9R0.1 CC(C)COC[C@H](O)CN Amb24383911 [0,2,0,0,0,0|2,0,0]=4 6952 B9R0.1 CC(C)CSCC(O)CC Amb18792450 [0,2,0,0,0,0|1,1,0]=4 6953 B9R0.1 CC(C)CSCC(O)CO Amb24704716 [0,2,0,0,0,0|2,0,0]=4 6954 B9R0.1 CC(C)CSC[C@@H](O)CC Amb25272476 [0,2,0,0,0,0|1,1,0]=4 6955 B9R0.1 CC(C)C\C=C\[C@H](C)CO Amb25214291 [0,2,0,0,0,0|1,0,1]=4 6956 B9R0.1 CC(C)C\C=C\[C@H](O)CO Amb25043850 [0,2,0,0,0,0|1,0,1]=4 6957 B9R0.1 CC(C)OCCC(N)CO Amb24592118 [0,2,0,0,0,0|2,0,0]=4 6958 B9R0.1 CC(C)SCCC(C)CO Amb24371727 [0,2,0,0,0,0|2,0,0]=4 6959 B9R0.1 CC(C)SCCC(N)CO Amb24743364 [0,2,0,0,0,0|2,0,0]=4 6960 B9R0.1 CC(CBr)COCC(F)F Amb24434501 [0,2,0,0,0,0|2,0,0]=4 6961 B9R0.1 CC(CCl)COCC(F)F Amb25187264 [0,2,0,0,0,0|2,0,0]=4 6962 B9R0.1 CC(CN)CNCC(C)O Amb25372424 [0,2,0,0,0,0|2,0,0]=4 6963 B9R0.1 CC(CN)COCC(F)F Amb24422851 [0,2,0,0,0,0|2,0,0]=4 6964 B9R0.1 CC(CN)CSCC(C)O Amb25704682 [0,2,0,0,0,0|1,1,0]=4 6965 B9R0.1 CC(CN)NCCC(C)O Amb25028008 [0,2,0,0,0,0|2,0,0]=4 6966 B9R0.1 CC(CN)OCCC(C)=C Amb24431935 [0,2,0,0,0,0|1,0,1]=4 6967 B9R0.1 CC(CN)OCCC(C)=O Amb18630514 [0,2,0,0,0,0|1,0,1]=4 6968 B9R0.1 CC(CN)SCCC(C)O Amb25826259 [0,2,0,0,0,0|1,1,0]=4 6969 B9R0.1 CC(CNCC(C)O)OC Amb25859050 [0,2,0,0,0,0|2,0,0]=4 6970 B9R0.1 CC(CNCC(C)O)SC Amb24520789 [0,2,0,0,0,0|2,0,0]=4 6971 B9R0.1 CC(CNCC(F)F)CC Amb18796654 [0,2,0,0,0,0|2,0,0]=4 6972 B9R0.1 CC(CNC[C@H](C)O)OC Amb24360707 [0,2,0,0,0,0|2,0,0]=4 6973 B9R0.1 CC(CNC[C@H](C)O)SC Amb25110537 [0,2,0,0,0,0|2,0,0]=4 6974 B9R0.1 CC(CO)CCCN(C)C Amb25306850 [0,2,0,0,0,0|2,0,0]=4 6975 B9R0.1 CC(CO)NCCC(F)F Amb24538245 [0,2,0,0,0,0|2,0,0]=4 6976 B9R0.1 CC(CO)OCC=C(C)C Amb25356908 [0,2,0,0,0,0|0,0,2]=4 6977 B9R0.1 CC(CO)SCCC(C)=O Amb24393859 [0,2,0,0,0,0|0,1,1]=4 6978 B9R0.1 CC(CO)SCCC(C)F Amb25343517 [0,2,0,0,0,0|0,1,0]=3 6979 B9R0.1 CC(CO)SCCC(C)N Amb25147702 [0,2,0,0,0,0|0,1,0]=3 6980 B9R0.1 CC(CO)SCCN(C)C Amb24472515 [0,2,0,0,0,0|1,1,0]=4 6981 B9R0.1 CC(COCC(F)F)NC Amb25269375 [0,2,0,0,0,0|2,0,0]=4 6982 B9R0.1 CC(CSCC(C)N)CO Amb24589262 [0,2,0,0,0,0|2,0,0]=4 6983 B9R0.1 CC(CSCC(F)F)CC Amb24747998 [0,2,0,0,0,0|1,1,0]=4 6984 B9R0.1 CC(CSC[C@@H](C)N)CO Amb24676015 [0,2,0,0,0,0|2,0,0]=4 6985 B9R0.1 CC(Cl)CCOC(=O)CCl Amb24482285 [0,2,0,0,0,0|1,0,1]=4 6986 B9R0.1 CC(N)CSCC(N)CC Amb24480948 [0,2,0,0,0,0|1,1,0]=4 6987 B9R0.1 CC(N)CSCC(O)CC Amb24438743 [0,2,0,0,0,0|1,1,0]=4 6988 B9R0.1 CC(O)CC#CC(O)CC Amb25098562 [0,2,0,0,0,0|1,0,1]=4 6989 B9R0.1 CC(O)CCCC(C)CO Amb24420267 [0,2,0,0,0,0|1,0,0]=3 6990 B9R0.1 CC(O)CCCC(Cl)CCl Amb24751581 [0,2,0,0,0,0|2,0,0]=4 6991 B9R0.1 CC(O)CCCC(O)CC Amb25147814 [0,2,0,0,0,0|1,0,0]=3 6992 B9R0.1 CC(O)CCCC(O)CCl Amb24351651 [0,2,0,0,0,0|2,0,0]=4 6993 B9R0.1 CC(O)CCNC(=O)CO Amb24482704 [0,2,0,0,0,0|1,0,1]=4 6994 B9R0.1 CC(O)CCNC(C)CO Amb25147813 [0,2,0,0,0,0|1,0,0]=3 6995 B9R0.1 CC(O)CCSC(C)CO Amb24437913 [0,2,0,0,0,0|0,1,0]=3 6996 B9R0.1 CC(O)CC\C=C(\C)/CO Amb25761912 [0,2,0,0,0,0|1,0,1]=4 6997 B9R0.1 CC(O)CNCC(C)CO Amb25742842 [0,2,0,0,0,0|2,0,0]=4 6998 B9R0.1 CC(O)CNCC(O)CF Amb25347347 [0,2,0,0,0,0|2,0,0]=4 6999 B9R0.1 CC(O)CNC[C@@H](O)CC Amb25839101 [0,2,0,0,0,0|1,0,0]=3 7000 B9R0.1 CC(O)COCC(=O)CO Amb24371356 [0,2,0,0,0,0|1,0,1]=4 7001 B9R0.1 CC(O)COCC(N)CO Amb24334020 [0,2,0,0,0,0|1,0,0]=3 7002 B9R0.1 CC(O)COCC(O)CC Amb25215417 [0,2,0,0,0,0|0,0,0]=2 7003 B9R0.1 CC(O)COC[C@@H](N)CO Amb24450327 [0,2,0,0,0,0|1,0,0]=3 7004 B9R0.1 CC(S)CSCC(S)CO Amb25058475 [0,2,0,0,0,0|2,0,0]=4 7005 B9R0.1 CCC(=C)CCCC(C)O Amb24529321 [0,2,0,0,0,0|1,0,1]=4 7006 B9R0.1 CCC(=C)CNCC(C)O Amb24474489 [0,2,0,0,0,0|1,0,1]=4 7007 B9R0.1 CCC(=C)CNC[C@@H](C)O Amb25707181 [0,2,0,0,0,0|1,0,1]=4 7008 B9R0.1 CCC(=C)CNC[C@H](C)O Amb24678199 [0,2,0,0,0,0|1,0,1]=4 7009 B9R0.1 CCC(=O)CCC[C@H](C)O Amb25723337 [0,2,0,0,0,0|1,0,1]=4 7010 B9R0.1 CCC(=O)OCCC(C)O Amb24735173 [0,2,0,0,0,0|1,0,1]=4 7011 B9R0.1 CCC(C)C#CCC(C)O Amb25344899 [0,2,0,0,0,0|1,0,1]=4 7012 B9R0.1 CCC(C)CCCC(C)Cl Amb25107922 [0,2,0,0,0,0|2,0,0]=4 7013 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,2,0,0,0,0|1,0,1]=4 7014 B9R0.1 CCC(C)CNC[C@@H](C)O Amb25045168 [0,2,0,0,0,0|1,0,0]=3 7015 B9R0.1 CCC(C)CSCC(C)N Amb24437953 [0,2,0,0,0,0|1,1,0]=4 7016 B9R0.1 CCC(C)CSCC(C)O Amb25733215 [0,2,0,0,0,0|0,1,0]=3 7017 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [0,2,0,0,0,0|0,1,1]=4 7018 B9R0.1 CCC(C)CSC[C@H](C)N Amb25741594 [0,2,0,0,0,0|1,1,0]=4 7019 B9R0.1 CCC(C)NCCC(C)O Amb25093108 [0,2,0,0,0,0|2,0,0]=4 7020 B9R0.1 CCC(C)NCC[C@@H](C)O Amb25796571 [0,2,0,0,0,0|2,0,0]=4 7021 B9R0.1 CCC(C)NCC[C@H](C)O Amb25769129 [0,2,0,0,0,0|2,0,0]=4 7022 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,2,0,0,0,0|1,0,1]=4 7023 B9R0.1 CCC(C)SCCC(C)N Amb24351929 [0,2,0,0,0,0|1,1,0]=4 7024 B9R0.1 CCC(COCC(C)C)N Amb17485994 [0,2,0,0,0,0|1,0,0]=3 7025 B9R0.1 CCC(N)CNCC(F)F Amb24426063 [0,2,0,0,0,0|2,0,0]=4 7026 B9R0.1 CCC(N)COCC(C)=C Amb18111719 [0,2,0,0,0,0|1,0,1]=4 7027 B9R0.1 CCC(N)COCC(C)=O Amb18103858 [0,2,0,0,0,0|0,0,2]=4 7028 B9R0.1 CCC(N)COCC(N)=O Amb25776983 [0,2,0,0,0,0|0,0,2]=4 7029 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [0,2,0,0,0,0|0,0,1]=3 7030 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,2,0,0,0,0|1,0,1]=4 7031 B9R0.1 CCC(O)COCC(F)F Amb24694525 [0,2,0,0,0,0|1,0,0]=3 7032 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [0,2,0,0,0,0|0,0,1]=3 7033 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [0,2,0,0,0,0|0,1,1]=4 7034 B9R0.1 CC[C@H](C)C#CCC(C)O Amb25788131 [0,2,0,0,0,0|1,0,1]=4 7035 B9R0.1 CN(C)CCCC(N)CO Amb18202279 [0,2,0,0,0,0|2,0,0]=4 7036 B9R0.1 CN(C)CCCC(O)CO Amb24371392 [0,2,0,0,0,0|2,0,0]=4 7037 B9R0.1 COC(C)COCC(C)O Amb22729718 [0,2,0,0,0,0|1,0,0]=3 7038 B9R0.1 C[C@@H](O)CCNC(=O)CO Amb24570702 [0,2,0,0,0,0|1,0,1]=4 7039 B9R0.1 C[C@@H](O)CNCC(O)CO Amb25140331 [0,2,0,0,0,0|2,0,0]=4 7040 B9R0.1 C[C@@H](O)CSCC(O)CO Amb25690458 [0,2,0,0,0,0|1,1,0]=4 7041 B9R0.1 C[C@H](CO)CCCC(C)=O Amb25335279 [0,2,0,0,0,0|1,0,1]=4 7042 B9R0.1 C[C@H](O)CCNC(=O)CO Amb25358407 [0,2,0,0,0,0|1,0,1]=4 7043 B9R0.1 C[C@H](O)CNCC(C)CO Amb25303273 [0,2,0,0,0,0|2,0,0]=4 7044 B9R0.1 C[C@H](O)CSCC(C)CO Amb25683518 [0,2,0,0,0,0|1,1,0]=4 7045 B9R0.1 NCC(=O)OCCC(C)C Amb17569860 [0,2,0,0,0,0|1,0,1]=4 7046 B9R0.1 NCC(N)COCC(O)=O Amb24677956 [0,2,0,0,0,0|1,0,1]=4 7047 B9R0.1 NCC(O)COCC(F)F Amb24724139 [0,2,0,0,0,0|2,0,0]=4 7048 B9R0.1 NC[C@@H](O)COCC(F)F Amb24362355 [0,2,0,0,0,0|2,0,0]=4 7049 B9R0.1 OC(=O)COCC(S)CS Amb18129098 [0,2,0,0,0,0|1,0,1]=4 7050 B9R0.1 OC(CCl)COCC(F)F Amb24387289 [0,2,0,0,0,0|2,0,0]=4 7051 B9R0.1 OC(COCC(F)F)CO Amb22008144 [0,2,0,0,0,0|2,0,0]=4 7052 B9R0.1 OCC(CNCC(C)C)O Amb17308639 [0,2,0,0,0,0|2,0,0]=4 7053 B9R0.1 OCC(CNCC(O)C)O Amb17308666 [0,2,0,0,0,0|2,0,0]=4 7054 B9R0.1 OCC(O)COCC(O)=O Amb24534716 [0,2,0,0,0,0|1,0,1]=4 7055 B9R0.20 CC(C)(CCCCO)CO Amb24474220 [0,2,0,0,0,0|2,0,0]=4 7056 B9R0.20 CC(C)(CN)CCCCO Amb25840677 [0,2,0,0,0,0|2,0,0]=4 7057 B9R0.20 CC(C)(CN)CSCCO Amb24578143 [0,2,0,0,0,0|1,1,0]=4 7058 B9R0.20 CC(C)(CN)OCCCF Amb25851826 [0,2,0,0,0,0|2,0,0]=4 7059 B9R0.20 CC(C)(CN)OCCCO Amb24656854 [0,2,0,0,0,0|2,0,0]=4 7060 B9R0.20 CC(C)(CNCCO)CO Amb25334136 [0,2,0,0,0,0|2,0,0]=4 7061 B9R0.20 CC(C)(CO)CCCCBr Amb25095266 [0,2,0,0,0,0|2,0,0]=4 7062 B9R0.20 CC(C)(CO)SCCCF Amb24345973 [0,2,0,0,0,0|1,1,0]=4 7063 B9R0.20 CC(C)(CO)SCCCN Amb24687229 [0,2,0,0,0,0|1,1,0]=4 7064 B9R0.20 CC(C)(CO)SCCCO Amb25267561 [0,2,0,0,0,0|1,1,0]=4 7065 B9R0.20 CC(O)(CCCCO)CO Amb25680514 [0,2,0,0,0,0|2,0,0]=4 7066 B9R0.20 CC(O)(CN)CSCCO Amb24670004 [0,2,0,0,0,0|1,1,0]=4 7067 B9R0.20 CCC(C)(C)CNCCF Amb24504813 [0,2,0,0,0,0|2,0,0]=4 7068 B9R0.20 CCC(C)(C)NCCCO Amb20207331 [0,2,0,0,0,0|2,0,0]=4 7069 B9R0.20 CCC(C)(C)OCCCO Amb24476830 [0,2,0,0,0,0|2,0,0]=4 7070 B9R0.20 CCC(C)(F)CCCCN Amb24439124 [0,2,0,0,0,0|2,0,0]=4 7071 B9R0.20 CCC(C)(N)CCCCF Amb25662473 [0,2,0,0,0,0|2,0,0]=4 7072 B9R0.20 CCC(C)(N)CNCCF Amb25823365 [0,2,0,0,0,0|2,0,0]=4 7073 B9R0.20 CCC(C)(N)COCC#C Amb25837027 [0,2,0,0,0,0|1,0,1]=4 7074 B9R0.20 CCC(C)(N)COCC=C Amb24673839 [0,2,0,0,0,0|1,0,1]=4 7075 B9R0.20 CCC(C)(N)COCCO Amb24363705 [0,2,0,0,0,0|0,0,0]=2 7076 B9R0.20 CCC(C)(O)C#CCCO Amb25845301 [0,2,0,0,0,0|1,0,1]=4 7077 B9R0.20 CCC(C)(O)CNCCF Amb25825695 [0,2,0,0,0,0|2,0,0]=4 7078 B9R0.20 CCC(C)(O)CNCCN Amb24718940 [0,2,0,0,0,0|2,0,0]=4 7079 B9R0.20 CCC(C)(O)COCCCl Amb24415284 [0,2,0,0,0,0|1,0,0]=3 7080 B9R0.20 CCC(C)(O)COCCN Amb25788034 [0,2,0,0,0,0|1,0,0]=3 7081 B9R0.20 CCC(C)(O)CSCCO Amb25129957 [0,2,0,0,0,0|0,1,0]=3 7082 B9R0.20 CCC(C)(O)C\C=C\CO Amb25129812 [0,2,0,0,0,0|1,0,1]=4 7083 B9R0.20 CCCCCC(C)(C)CC Amb22052710 [0,2,0,0,0,0|2,0,0]=4 7084 B9R0.20 CCCCCC(C)(C)CCl Amb25804367 [0,2,0,0,0,0|2,0,0]=4 7085 B9R0.20 CCCCCC(C)(C)CN Amb20632202 [0,2,0,0,0,0|2,0,0]=4 7086 B9R0.20 CCCCCC(C)(Cl)CC Amb22229257 [0,2,0,0,0,0|2,0,0]=4 7087 B9R0.20 CCCCCC(C)(Cl)CO Amb24482527 [0,2,0,0,0,0|1,0,0]=3 7088 B9R0.20 CCCCCC(C)(F)CN Amb25261446 [0,2,0,0,0,0|2,0,0]=4 7089 B9R0.20 CCCCCC(C)(O)CCl Amb25084549 [0,2,0,0,0,0|2,0,0]=4 7090 B9R0.20 CCCCCC(C)(O)CN Amb24744522 [0,2,0,0,0,0|2,0,0]=4 7091 B9R0.20 CCCCCC(C)(O)CO Amb25719931 [0,2,0,0,0,0|1,0,0]=3 7092 B9R0.20 CCCCCC(F)(F)CBr Amb25117473 [0,2,0,0,0,0|2,0,0]=4 7093 B9R0.20 CCCCC[C@@](C)(F)CO Amb25239659 [0,2,0,0,0,0|1,0,0]=3 7094 B9R0.20 CCCCC[C@@](C)(O)CO Amb24448062 [0,2,0,0,0,0|1,0,0]=3 7095 B9R0.20 CCCCC[C@](C)(O)CO Amb24389439 [0,2,0,0,0,0|1,0,0]=3 7096 B9R0.20 CCCCOC(C)(O)CO Amb25806665 [0,2,0,0,0,0|0,0,0]=2 7097 B9R0.20 CCCCOS(=O)(=O)CCl Amb24334952 [0,2,0,0,0,0|2,0,0]=4 7098 B9R0.20 CCCCSC(C)(C)CN Amb25134715 [0,2,0,0,0,0|1,1,0]=4 7099 B9R0.20 CCCCSC(C)(C)CO Amb25356732 [0,2,0,0,0,0|0,1,0]=3 7100 B9R0.20 CCCNCC(F)(F)CO Amb25350028 [0,2,0,0,0,0|2,0,0]=4 7101 B9R0.20 CCCOCC(C)(C)CBr Amb24720067 [0,2,0,0,0,0|2,0,0]=4 7102 B9R0.20 CCCOCC(C)(C)CN Amb24419188 [0,2,0,0,0,0|2,0,0]=4 7103 B9R0.20 CCCOCC(C)(C)CS Amb25136657 [0,2,0,0,0,0|2,0,0]=4 7104 B9R0.20 CCCOCC(C)(N)CC Amb25367107 [0,2,0,0,0,0|1,0,0]=3 7105 B9R0.20 CCCOCC(C)(O)CCl Amb24480452 [0,2,0,0,0,0|2,0,0]=4 7106 B9R0.20 CCCOCC(C)(O)CN Amb25732087 [0,2,0,0,0,0|2,0,0]=4 7107 B9R0.20 CCCOC[C@@](C)(O)CO Amb24475105 [0,2,0,0,0,0|2,0,0]=4 7108 B9R0.20 CCCOC[C@](C)(O)CO Amb25788112 [0,2,0,0,0,0|2,0,0]=4 7109 B9R0.20 CCNCCC(C)(C)CO Amb24582872 [0,2,0,0,0,0|2,0,0]=4 7110 B9R0.20 CCOCOC(C)(C)CN Amb25307839 [0,2,0,0,0,0|2,0,0]=4 7111 B9R0.20 CCS(=O)(=O)CCCCO Amb23452896 [0,2,0,0,0,0|2,0,0]=4 7112 B9R0.20 CCSCCC(C)(C)CO Amb24335083 [0,2,0,0,0,0|2,0,0]=4 7113 B9R0.20 CCSCCC(C)(N)CO Amb25785411 [0,2,0,0,0,0|2,0,0]=4 7114 B9R0.20 CNC(C)(C)CNCCO Amb25257013 [0,2,0,0,0,0|2,0,0]=4 7115 B9R0.20 CNCCCC(CO)(C)C Amb17569964 [0,2,0,0,0,0|2,0,0]=4 7116 B9R0.20 COC(C)(C)CNCCO Amb25060354 [0,2,0,0,0,0|2,0,0]=4 7117 B9R0.20 COC(C)(C)COCCO Amb25751054 [0,2,0,0,0,0|1,0,0]=3 7118 B9R0.20 COC(C)(C)COCCS Amb25768906 [0,2,0,0,0,0|1,1,0]=4 7119 B9R0.20 COCCOC(C)(C)CBr Amb24459822 [0,2,0,0,0,0|2,0,0]=4 7120 B9R0.20 COCCOC(C)(C)CC Amb25841714 [0,2,0,0,0,0|2,0,0]=4 7121 B9R0.20 COCCOC(C)(C)CN Amb19515688 [0,2,0,0,0,0|2,0,0]=4 7122 B9R0.20 COCCOC(C)(C)CN Amb24112401 [0,2,0,0,0,0|2,0,0]=4 7123 B9R0.20 COCCOC(Cl)(Cl)CCl Amb25212129 [0,2,0,0,0,0|2,0,0]=4 7124 B9R0.20 COCCSC(C)(C)CO Amb25136380 [0,2,0,0,0,0|1,1,0]=4 7125 B9R0.20 CSCCCC(C)(C)CO Amb24473183 [0,2,0,0,0,0|2,0,0]=4 7126 B9R0.20 CSCCCC(C)(N)CO Amb24757368 [0,2,0,0,0,0|2,0,0]=4 7127 B9R0.20 CSCCNC(C)(C)CO Amb25187284 [0,2,0,0,0,0|2,0,0]=4 7128 B9R0.20 CSCCSC(C)(C)CO Amb25172090 [0,2,0,0,0,0|1,1,0]=4 7129 B9R0.20 C[C@](O)(CCCCBr)CO Amb25119355 [0,2,0,0,0,0|2,0,0]=4 7130 B9R0.20 C[C@](O)(CCCCO)CO Amb25832451 [0,2,0,0,0,0|2,0,0]=4 7131 B9R0.20 OCCCCC(NC)(C)C Amb17569967 [0,2,0,0,0,0|2,0,0]=4 7132 B9R0.20 OCCNCC(F)(F)CO Amb25269408 [0,2,0,0,0,0|2,0,0]=4 7133 B9R0.24 CC(CC)NCC(N)CC Amb24477987 [0,2,0,0,0,0|2,0,0]=4 7134 B9R0.24 CC(CC)NCC(O)CC Amb24649552 [0,2,0,0,0,0|2,0,0]=4 7135 B9R0.24 CC(CC)NC[C@H](N)CC Amb25027507 [0,2,0,0,0,0|2,0,0]=4 7136 B9R0.24 CC(CC)NC[C@H](O)CO Amb24461491 [0,2,0,0,0,0|2,0,0]=4 7137 B9R0.24 CC(CC)OCC(N)CC Amb24505227 [0,2,0,0,0,0|1,0,0]=3 7138 B9R0.24 CC(CC)OCC(N)CO Amb24619673 [0,2,0,0,0,0|2,0,0]=4 7139 B9R0.24 CC(CC)OCC(O)CBr Amb24479485 [0,2,0,0,0,0|2,0,0]=4 7140 B9R0.24 CC(CC)OCC(O)CC Amb25271058 [0,2,0,0,0,0|1,0,0]=3 7141 B9R0.24 CC(CC)OCC(O)CCl Amb24581833 [0,2,0,0,0,0|2,0,0]=4 7142 B9R0.24 CC(CC)OC[C@@H](N)CO Amb24538009 [0,2,0,0,0,0|2,0,0]=4 7143 B9R0.24 CC(CC)OC[C@H](O)CN Amb24431923 [0,2,0,0,0,0|2,0,0]=4 7144 B9R0.24 CC(CC)SCC(N)CO Amb24509500 [0,2,0,0,0,0|2,0,0]=4 7145 B9R0.24 CC(CC)SCC(O)CC Amb18792452 [0,2,0,0,0,0|1,1,0]=4 7146 B9R0.24 CC(CC)SC[C@@H](N)CC Amb25726801 [0,2,0,0,0,0|1,1,0]=4 7147 B9R0.24 CC(CC)SC[C@H](N)CC Amb24469926 [0,2,0,0,0,0|1,1,0]=4 7148 B9R0.24 CC(CC)SC[C@H](O)CC Amb25782195 [0,2,0,0,0,0|1,1,0]=4 7149 B9R0.24 CC(CCC(Br)CC)CC Amb25737784 [0,2,0,0,0,0|2,0,0]=4 7150 B9R0.24 CC(CCC(C)CO)CO Amb25232821 [0,2,0,0,0,0|2,0,0]=4 7151 B9R0.24 CC(CCC(O)CC)CC Amb24388933 [0,2,0,0,0,0|2,0,0]=4 7152 B9R0.24 CC(CCC(O)CC)CO Amb25206034 [0,2,0,0,0,0|1,0,0]=3 7153 B9R0.24 CC(CCl)OCC(O)CO Amb24624209 [0,2,0,0,0,0|2,0,0]=4 7154 B9R0.24 CC(CF)NC[C@@H](O)CC Amb24430464 [0,2,0,0,0,0|2,0,0]=4 7155 B9R0.24 CC(CN)NCC(O)CC Amb24740164 [0,2,0,0,0,0|2,0,0]=4 7156 B9R0.24 CC(CN)SCC(N)CC Amb25710108 [0,2,0,0,0,0|1,1,0]=4 7157 B9R0.24 CC(CO)NCC(C)CN Amb24645520 [0,2,0,0,0,0|2,0,0]=4 7158 B9R0.24 CC(CO)NCC(O)CC Amb25135532 [0,2,0,0,0,0|1,0,0]=3 7159 B9R0.24 CC(CO)NCC(O)CO Amb25760284 [0,2,0,0,0,0|2,0,0]=4 7160 B9R0.24 CC(CO)OC[C@@H](N)CO Amb25674917 [0,2,0,0,0,0|1,0,0]=3 7161 B9R0.24 CC(CO)SCC(C)CN Amb25303573 [0,2,0,0,0,0|1,1,0]=4 7162 B9R0.24 CC(CO)SCC(C)NC Amb24725630 [0,2,0,0,0,0|1,1,0]=4 7163 B9R0.24 CC(CO)SCC(C)OC Amb24352100 [0,2,0,0,0,0|1,1,0]=4 7164 B9R0.24 CC(CO)SCC(F)CC Amb25317024 [0,2,0,0,0,0|0,1,0]=3 7165 B9R0.24 CC(CO)SCC(N)CC Amb24408842 [0,2,0,0,0,0|0,1,0]=3 7166 B9R0.24 CC(COC(=O)CC)CC Amb24061296 [0,2,0,0,0,0|1,0,1]=4 7167 B9R0.24 CCC(=C)CC[C@@H](C)CO Amb25782256 [0,2,0,0,0,0|1,0,1]=4 7168 B9R0.24 CCC(=C)CNC(C)CO Amb25686460 [0,2,0,0,0,0|1,0,1]=4 7169 B9R0.24 CCC(=C)CSC(C)CO Amb25075236 [0,2,0,0,0,0|0,1,1]=4 7170 B9R0.24 CCC(=O)CCC(C)CO Amb25146971 [0,2,0,0,0,0|1,0,1]=4 7171 B9R0.24 CCC(=O)COC(C)CCl Amb25111994 [0,2,0,0,0,0|1,0,1]=4 7172 B9R0.24 CCC(=O)OCC(F)CC Amb25058063 [0,2,0,0,0,0|1,0,1]=4 7173 B9R0.24 CCC(=O)OCC(O)CC Amb24449905 [0,2,0,0,0,0|1,0,1]=4 7174 B9R0.24 CCC(=O)OC[C@@H](O)CC Amb24481128 [0,2,0,0,0,0|1,0,1]=4 7175 B9R0.24 CCC(=O)OC[C@H](O)CC Amb25259058 [0,2,0,0,0,0|1,0,1]=4 7176 B9R0.24 CCC(C)CCC(C)CO Amb22641860 [0,2,0,0,0,0|1,0,0]=3 7177 B9R0.24 CCC(C)CNC(C)CF Amb24363330 [0,2,0,0,0,0|2,0,0]=4 7178 B9R0.24 CCC(C)CNC(C)CN Amb25729244 [0,2,0,0,0,0|2,0,0]=4 7179 B9R0.24 CCC(C)CN[C@@H](C)CF Amb24621132 [0,2,0,0,0,0|2,0,0]=4 7180 B9R0.24 CCC(C)CN[C@@H](C)CN Amb25169329 [0,2,0,0,0,0|2,0,0]=4 7181 B9R0.24 CCC(C)COC(=O)CBr Amb25799480 [0,2,0,0,0,0|1,0,1]=4 7182 B9R0.24 CCC(C)CSC(C)CO Amb25146973 [0,2,0,0,0,0|0,1,0]=3 7183 B9R0.24 CCC(C)NCC(C)CO Amb25335107 [0,2,0,0,0,0|2,0,0]=4 7184 B9R0.24 CCC(C)OCC(C)CCl Amb25273966 [0,2,0,0,0,0|2,0,0]=4 7185 B9R0.24 CCC(C)OCC(C)CN Amb24365350 [0,2,0,0,0,0|2,0,0]=4 7186 B9R0.24 CCC(C)OCC(C)CO Amb25044070 [0,2,0,0,0,0|2,0,0]=4 7187 B9R0.24 CCC(C)OCC(C)CS Amb25057619 [0,2,0,0,0,0|2,0,0]=4 7188 B9R0.24 CCC(C)OCC(C)NC Amb24653368 [0,2,0,0,0,0|2,0,0]=4 7189 B9R0.24 CCC(CCC(CC)C)C Amb10069376 [0,2,0,0,0,0|2,0,0]=4 7190 B9R0.24 CCC(N)CCC(N)CF Amb25197615 [0,2,0,0,0,0|2,0,0]=4 7191 B9R0.24 CCC(NCC(CO)O)C Amb17308622 [0,2,0,0,0,0|2,0,0]=4 7192 B9R0.24 CCC(O)CCC(N)CO Amb25368410 [0,2,0,0,0,0|1,0,0]=3 7193 B9R0.24 CCC(O)CCC(O)CO Amb24364854 [0,2,0,0,0,0|1,0,0]=3 7194 B9R0.24 CCN(C)CCC(O)CO Amb24406795 [0,2,0,0,0,0|2,0,0]=4 7195 B9R0.24 CC[C@@H](N)COC(=O)CN Amb25147512 [0,2,0,0,0,0|1,0,1]=4 7196 B9R0.24 CC[C@H](C)CCC(C)CO Amb25676351 [0,2,0,0,0,0|1,0,0]=3 7197 B9R0.24 CC[C@H](C)COC(=O)CBr Amb24477461 [0,2,0,0,0,0|1,0,1]=4 7198 B9R0.24 CC[C@H](N)CC[C@@H](N)CC Amb25082022 [0,2,0,0,0,0|2,0,0]=4 7199 B9R0.24 COC(C)COC(=O)CO Amb24752113 [0,2,0,0,0,0|1,0,1]=4 7200 B9R0.24 COC(C)COC(C)CO Amb22733980 [0,2,0,0,0,0|1,0,0]=3 7201 B9R0.24 C[C@@H](CCC(O)CC)CC Amb25686198 [0,2,0,0,0,0|2,0,0]=4 7202 B9R0.24 C[C@@H](CF)NC[C@@H](O)CC Amb25063809 [0,2,0,0,0,0|2,0,0]=4 7203 B9R0.24 C[C@H](CCC(O)CO)CC Amb25332161 [0,2,0,0,0,0|1,0,0]=3 7204 B9R0.24 C[C@H](CC[C@@H](C)CO)CO Amb25236144 [0,2,0,0,0,0|2,0,0]=4 7205 B9R0.24 C[C@H](CC[C@@H](O)CO)CC Amb24592097 [0,2,0,0,0,0|1,0,0]=3 7206 B9R0.24 OC(COC(=O)CO)CO Amb25854328 [0,2,0,0,0,0|1,0,1]=4 7207 B9R0.24 O[C@@H](CC[C@H](O)CO)CO Amb25792326 [0,2,0,0,0,0|2,0,0]=4 7208 B9R0.24 O[C@H](CCC(O)CO)CO Amb25221375 [0,2,0,0,0,0|2,0,0]=4 7209 B9R0.47 CC(Br)C(O)CCCCC Amb24567150 [0,2,0,0,0,0|2,0,0]=4 7210 B9R0.47 CC(C)C(=O)NOCCO Amb24581955 [0,2,0,0,0,0|1,0,1]=4 7211 B9R0.47 CC(C)C(C)CCCCN Amb24389393 [0,2,0,0,0,0|2,0,0]=4 7212 B9R0.47 CC(C)C(C)CCCCO Amb24513833 [0,2,0,0,0,0|1,0,0]=3 7213 B9R0.47 CC(C)C(C)CNCCC Amb24477937 [0,2,0,0,0,0|2,0,0]=4 7214 B9R0.47 CC(C)C(C)CNCCF Amb24701682 [0,2,0,0,0,0|2,0,0]=4 7215 B9R0.47 CC(C)C(C)NOCCC Amb25055388 [0,2,0,0,0,0|2,0,0]=4 7216 B9R0.47 CC(C)C(C)OCCCS Amb25047139 [0,2,0,0,0,0|2,0,0]=4 7217 B9R0.47 CC(C)C(C)OCCNC Amb25736894 [0,2,0,0,0,0|2,0,0]=4 7218 B9R0.47 CC(C)C(C)SCCCC Amb24588156 [0,2,0,0,0,0|1,1,0]=4 7219 B9R0.47 CC(C)C(C)SCCCO Amb24719880 [0,2,0,0,0,0|2,0,0]=4 7220 B9R0.47 CC(C)C(Cl)CCCCC Amb25842560 [0,2,0,0,0,0|2,0,0]=4 7221 B9R0.47 CC(C)C(N)CNCCF Amb25369679 [0,2,0,0,0,0|2,0,0]=4 7222 B9R0.47 CC(C)C(N)CNCCN Amb24398455 [0,2,0,0,0,0|2,0,0]=4 7223 B9R0.47 CC(C)C(N)COCCC Amb21953834 [0,2,0,0,0,0|1,0,0]=3 7224 B9R0.47 CC(C)C(N)COCCC Amb22009215 [0,2,0,0,0,0|1,0,0]=3 7225 B9R0.47 CC(C)C(N)CSCCO Amb24415739 [0,2,0,0,0,0|0,1,0]=3 7226 B9R0.47 CC(C)C(O)C#CCCO Amb24466261 [0,2,0,0,0,0|1,0,1]=4 7227 B9R0.47 CC(C)C(O)CCCCCl Amb25788308 [0,2,0,0,0,0|2,0,0]=4 7228 B9R0.47 CC(C)C(O)CCCCO Amb24529316 [0,2,0,0,0,0|1,0,0]=3 7229 B9R0.47 CC(C)C(O)CNCCN Amb25221239 [0,2,0,0,0,0|2,0,0]=4 7230 B9R0.47 CC(C)C(O)CNCCO Amb24436492 [0,2,0,0,0,0|1,0,0]=3 7231 B9R0.47 CC(C)C(O)COCCC Amb25331736 [0,2,0,0,0,0|1,0,0]=3 7232 B9R0.47 CC(C)C(O)C\C=C\CO Amb25680681 [0,2,0,0,0,0|1,0,1]=4 7233 B9R0.47 CC(C)C(O)\C=C\CCO Amb24524411 [0,2,0,0,0,0|1,0,1]=4 7234 B9R0.47 CC(C)[C@@H](N)CSCCC Amb24743487 [0,2,0,0,0,0|1,1,0]=4 7235 B9R0.47 CC(C)[C@@H](O)C\C=C\CO Amb24481132 [0,2,0,0,0,0|1,0,1]=4 7236 B9R0.47 CC(C)[C@H](C)NCCCC Amb24680021 [0,2,0,0,0,0|2,0,0]=4 7237 B9R0.47 CC(C)[C@H](N)CNCCC Amb24753655 [0,2,0,0,0,0|2,0,0]=4 7238 B9R0.47 CC(C)[C@H](N)CNCCN Amb24443135 [0,2,0,0,0,0|2,0,0]=4 7239 B9R0.47 CC(C)[C@H](O)CCCCC Amb25129291 [0,2,0,0,0,0|2,0,0]=4 7240 B9R0.47 CC(CCCOC)C(C)O Amb24478010 [0,2,0,0,0,0|2,0,0]=4 7241 B9R0.47 CC(CCCSC)C(C)O Amb24361756 [0,2,0,0,0,0|2,0,0]=4 7242 B9R0.47 CC(CNCCO)N(C)C Amb24478117 [0,2,0,0,0,0|2,0,0]=4 7243 B9R0.47 CC(Cl)C(O)CCCCC Amb24692698 [0,2,0,0,0,0|2,0,0]=4 7244 B9R0.47 CC(N)C(N)CCCCC Amb25147529 [0,2,0,0,0,0|2,0,0]=4 7245 B9R0.47 CC(N)C(O)CCCCC Amb18124761 [0,2,0,0,0,0|2,0,0]=4 7246 B9R0.47 CC(NCCCN)C(C)O Amb25147428 [0,2,0,0,0,0|2,0,0]=4 7247 B9R0.47 CC(O)C(=O)NOCCO Amb25098343 [0,2,0,0,0,0|1,0,1]=4 7248 B9R0.47 CC(O)C(=O)OCCCF Amb25716095 [0,2,0,0,0,0|1,0,1]=4 7249 B9R0.47 CC(O)C(C)CCCCO Amb25854852 [0,2,0,0,0,0|1,0,0]=3 7250 B9R0.47 CC(O)C(C)NCCCO Amb25207107 [0,2,0,0,0,0|2,0,0]=4 7251 B9R0.47 CC(O)C(N)CCCCC Amb18644212 [0,2,0,0,0,0|1,0,0]=3 7252 B9R0.47 CC(O)C(O)CCCCF Amb24747720 [0,2,0,0,0,0|2,0,0]=4 7253 B9R0.47 CC(O)C(O)COCC=C Amb25284492 [0,2,0,0,0,0|1,0,1]=4 7254 B9R0.47 CC(OCCCF)C(O)=O Amb24602795 [0,2,0,0,0,0|1,0,1]=4 7255 B9R0.47 CC(OCCCN)C(O)=O Amb18111477 [0,2,0,0,0,0|1,0,1]=4 7256 B9R0.47 CC(OCCCO)C(O)=O Amb25132795 [0,2,0,0,0,0|1,0,1]=4 7257 B9R0.47 CC(SCCNC)C(C)O Amb24679026 [0,2,0,0,0,0|1,1,0]=4 7258 B9R0.47 CCCCCC(=C)C(C)O Amb25828956 [0,2,0,0,0,0|1,0,1]=4 7259 B9R0.47 CCCCCC(=C)[C@@H](C)O Amb24625124 [0,2,0,0,0,0|1,0,1]=4 7260 B9R0.47 CCCCCC(=O)C(C)O Amb25146485 [0,2,0,0,0,0|1,0,1]=4 7261 B9R0.47 CCCCCC(=O)[C@@H](C)O Amb25729179 [0,2,0,0,0,0|1,0,1]=4 7262 B9R0.47 CCCCCC(Br)C(O)=O Amb18130346 [0,2,0,0,0,0|1,0,1]=4 7263 B9R0.47 CCCCCC(C(=O)O)F Amb17593693 [0,2,0,0,0,0|1,0,1]=4 7264 B9R0.47 CCCCCC(C(C)C)C Amb10069375 [0,2,0,0,0,0|2,0,0]=4 7265 B9R0.47 CCCCCC(C)C(C)O Amb24478011 [0,2,0,0,0,0|1,0,0]=3 7266 B9R0.47 CCCCCC(C)P(O)=O Amb25287382 [0,2,0,0,0,0|2,0,0]=4 7267 B9R0.47 CCCCCC(Cl)C(Cl)Cl Amb24444835 [0,2,0,0,0,0|2,0,0]=4 7268 B9R0.47 CCCCCC(Cl)C(O)=O Amb18646187 [0,2,0,0,0,0|1,0,1]=4 7269 B9R0.47 CCCCCC(O)C(F)F Amb25185272 [0,2,0,0,0,0|2,0,0]=4 7270 B9R0.47 CCCCCC(O)C(O)=O Amb17778103 [0,2,0,0,0,0|1,0,1]=4 7271 B9R0.47 CCCCC[C@@H](C(=O)O)C Amb10844510 [0,2,0,0,0,0|1,0,1]=4 7272 B9R0.47 CCCCC[C@@H](N)C(O)=O Amb22745982 [0,2,0,0,0,0|1,0,1]=4 7273 B9R0.47 CCCCC[C@H](C(=O)O)C Amb10844515 [0,2,0,0,0,0|1,0,1]=4 7274 B9R0.47 CCCCC[C@H](N)C(O)=O Amb17943098 [0,2,0,0,0,0|1,0,1]=4 7275 B9R0.47 CCCCC[C@H](O)C(O)=O Amb25728353 [0,2,0,0,0,0|1,0,1]=4 7276 B9R0.47 CCCCNC(=O)[C@@H](C)O Amb25740293 [0,2,0,0,0,0|1,0,1]=4 7277 B9R0.47 CCCCNC(C)C(C)S Amb18126308 [0,2,0,0,0,0|1,1,0]=4 7278 B9R0.47 CCCCOC(=O)C(C)S Amb25098485 [0,2,0,0,0,0|0,1,1]=4 7279 B9R0.47 CCCCOC(=O)C(Cl)Cl Amb17940051 [0,2,0,0,0,0|1,0,1]=4 7280 B9R0.47 CCCCOC(=O)C(Cl)F Amb10840262 [0,2,0,0,0,0|1,0,1]=4 7281 B9R0.47 CCCCOC(=O)C(F)F Amb10838765 [0,2,0,0,0,0|1,0,1]=4 7282 B9R0.47 CCCCOC(=O)[C@@H](C)Cl Amb25101546 [0,2,0,0,0,0|1,0,1]=4 7283 B9R0.47 CCCCOC(=O)[C@@H](C)N Amb22744849 [0,2,0,0,0,0|1,0,1]=4 7284 B9R0.47 CCCCOC(=O)[C@@H](C)O Amb22800542 [0,2,0,0,0,0|0,0,1]=3 7285 B9R0.47 CCCCOC(=S)C(F)Cl Amb25765762 [0,2,0,0,0,0|1,0,1]=4 7286 B9R0.47 CCCCOC(C)C(C)Br Amb25105290 [0,2,0,0,0,0|1,0,0]=3 7287 B9R0.47 CCCCOC(C)C(N)=S Amb18798045 [0,2,0,0,0,0|0,1,1]=4 7288 B9R0.47 CCCCOC(C)[C@H](C)N Amb25066338 [0,2,0,0,0,0|1,0,0]=3 7289 B9R0.47 CCCCOC(C)[C@H](C)O Amb24373040 [0,2,0,0,0,0|0,0,0]=2 7290 B9R0.47 CCCCOC(Cl)C(=O)Cl Amb24626835 [0,2,0,0,0,0|0,0,2]=4 7291 B9R0.47 CCCCOC(O)C(Cl)Cl Amb25107785 [0,2,0,0,0,0|1,0,0]=3 7292 B9R0.47 CCCCOP(=O)C(C)O Amb25357308 [0,2,0,0,0,0|1,0,0]=3 7293 B9R0.47 CCCCO[C@H](C)C(O)=O Amb24480807 [0,2,0,0,0,0|0,0,1]=3 7294 B9R0.47 CCCCO[C@H](C)[C@@H](C)O Amb24749770 [0,2,0,0,0,0|0,0,0]=2 7295 B9R0.47 CCCCSC(C)C(C)N Amb24439757 [0,2,0,0,0,0|1,1,0]=4 7296 B9R0.47 CCCCSC(C)C(C)O Amb24467934 [0,2,0,0,0,0|0,1,0]=3 7297 B9R0.47 CCCCS[C@@H](C)[C@H](C)O Amb25070650 [0,2,0,0,0,0|0,1,0]=3 7298 B9R0.47 CCCCS[C@H](C)C(O)=O Amb24725214 [0,2,0,0,0,0|0,1,1]=4 7299 B9R0.47 CCCC\C=C(\C)/C(C)O Amb25769451 [0,2,0,0,0,0|1,0,1]=4 7300 B9R0.47 CCCNCC(C)C(C)N Amb24679869 [0,2,0,0,0,0|2,0,0]=4 7301 B9R0.47 CCCOCC(=O)C(C)C Amb24478082 [0,2,0,0,0,0|1,0,1]=4 7302 B9R0.47 CCCOCC(=O)C(C)O Amb25762309 [0,2,0,0,0,0|1,0,1]=4 7303 B9R0.47 CCCOCC(C)C(C)=O Amb24725662 [0,2,0,0,0,0|1,0,1]=4 7304 B9R0.47 CCCOCC(C)C(C)N Amb24553879 [0,2,0,0,0,0|1,0,0]=3 7305 B9R0.47 CCCOCC(C)C(C)O Amb25273307 [0,2,0,0,0,0|1,0,0]=3 7306 B9R0.47 CCCOCC(Cl)C(C)=C Amb24482380 [0,2,0,0,0,0|1,0,1]=4 7307 B9R0.47 CCCOCC(N)C(C)=C Amb24375016 [0,2,0,0,0,0|1,0,1]=4 7308 B9R0.47 CCCOCC(N)C(F)F Amb25708828 [0,2,0,0,0,0|2,0,0]=4 7309 B9R0.47 CCCOCC(O)C(C)=C Amb25136372 [0,2,0,0,0,0|1,0,1]=4 7310 B9R0.47 CCCOCC(O)C(F)F Amb25144653 [0,2,0,0,0,0|2,0,0]=4 7311 B9R0.47 CCC\C=C\C(C)C(C)O Amb24548360 [0,2,0,0,0,0|1,0,1]=4 7312 B9R0.47 CCC\C=C\[C@@H](C)[C@@H](C)O Amb25356424 [0,2,0,0,0,0|1,0,1]=4 7313 B9R0.47 CCC\C=C\[C@@H](C)[C@H](C)O Amb25308675 [0,2,0,0,0,0|1,0,1]=4 7314 B9R0.47 CCOCCC(C)C(C)O Amb25057048 [0,2,0,0,0,0|2,0,0]=4 7315 B9R0.47 CCOCOC(C)C(C)Br Amb24478292 [0,2,0,0,0,0|2,0,0]=4 7316 B9R0.47 CCOCOC(C)C(C)Cl Amb24424385 [0,2,0,0,0,0|2,0,0]=4 7317 B9R0.47 CCOCSC(C)C(C)O Amb25075346 [0,2,0,0,0,0|1,1,0]=4 7318 B9R0.47 CCSCSC(C)C(C)O Amb25162703 [0,2,0,0,0,0|1,1,0]=4 7319 B9R0.47 CN(C)C(=O)COCCO Amb24577058 [0,2,0,0,0,0|1,0,1]=4 7320 B9R0.47 CNCCOC(C)C(O)=O Amb18630742 [0,2,0,0,0,0|1,0,1]=4 7321 B9R0.47 COCCOC(=O)C(C)O Amb25781141 [0,2,0,0,0,0|1,0,1]=4 7322 B9R0.47 COCCOC(=O)[C@@H](C)O Amb24482714 [0,2,0,0,0,0|1,0,1]=4 7323 B9R0.47 COCCOC(C)[C@H](C)O Amb25060338 [0,2,0,0,0,0|1,0,0]=3 7324 B9R0.47 CSCCOC(=O)[C@@H](C)O Amb25169432 [0,2,0,0,0,0|1,0,1]=4 7325 B9R0.47 CSCCOC(=O)[C@H](C)O Amb24730180 [0,2,0,0,0,0|1,0,1]=4 7326 B9R0.47 CSCCOC(C)C(O)=O Amb24482366 [0,2,0,0,0,0|1,0,1]=4 7327 B9R0.47 CSCCOC(F)C(O)=O Amb25683225 [0,2,0,0,0,0|1,0,1]=4 7328 B9R0.47 CSCCO[C@@H](C)C(O)=O Amb25146944 [0,2,0,0,0,0|1,0,1]=4 7329 B9R0.47 CSCCSC(C)C(C)O Amb24509345 [0,2,0,0,0,0|1,1,0]=4 7330 B9R0.47 C[C@@H](CSCCO)N(C)C Amb24721200 [0,2,0,0,0,0|1,1,0]=4 7331 B9R0.47 C[C@@H](O)C(=O)NOCCO Amb25688528 [0,2,0,0,0,0|1,0,1]=4 7332 B9R0.47 C[C@@H](O)C(=O)OCCCF Amb25358441 [0,2,0,0,0,0|1,0,1]=4 7333 B9R0.47 C[C@@H](O)[C@H](F)CCCCC Amb25788166 [0,2,0,0,0,0|1,0,0]=3 7334 B9R0.47 C[C@@H](O)[C@H](N)CCCCC Amb24679627 [0,2,0,0,0,0|1,0,0]=3 7335 B9R0.47 C[C@@H](O)[C@H](O)CCCCC Amb25842141 [0,2,0,0,0,0|1,0,0]=3 7336 B9R0.47 C[C@@H](O)[C@H](O)\C=C\CCC Amb25261767 [0,2,0,0,0,0|1,0,1]=4 7337 B9R0.47 C[C@@H](OCCCF)C(O)=O Amb25146943 [0,2,0,0,0,0|1,0,1]=4 7338 B9R0.47 C[C@@H](OCCCO)C(O)=O Amb24692362 [0,2,0,0,0,0|1,0,1]=4 7339 B9R0.47 C[C@H](N)[C@H](O)CCCCC Amb24524514 [0,2,0,0,0,0|2,0,0]=4 7340 B9R0.47 C[C@H](O)C(=O)NOCCO Amb25823490 [0,2,0,0,0,0|1,0,1]=4 7341 B9R0.47 C[C@H](O)C(=O)OCCCF Amb25099335 [0,2,0,0,0,0|1,0,1]=4 7342 B9R0.47 C[C@H](O)[C@@H](O)CCCCC Amb25115950 [0,2,0,0,0,0|1,0,0]=3 7343 B9R0.47 C[C@H](O)[C@@H](O)\C=C\CCC Amb24513736 [0,2,0,0,0,0|1,0,1]=4 7344 B9R0.47 C[C@H](OCCCN)C(O)=O Amb25146951 [0,2,0,0,0,0|1,0,1]=4 7345 B9R0.47 C[C@H](OCCCO)C(O)=O Amb25720488 [0,2,0,0,0,0|1,0,1]=4 7346 B9R0.47 NCCCO[C@H](N)C(O)=O Amb25111856 [0,2,0,0,0,0|1,0,1]=4 7347 B9R0.47 N[C@@H](COCCO)C(O)=O Amb24479093 [0,2,0,0,0,0|1,0,1]=4 7348 B9R0.50 C=CCCOC(CO)C=C Amb25846276 [0,2,0,0,0,0|0,0,2]=4 7349 B9R0.50 C=CCCO[C@H](CO)C=C Amb25832418 [0,2,0,0,0,0|0,0,2]=4 7350 B9R0.50 C=C[C@@H](CCCCO)CO Amb24354441 [0,2,0,0,0,0|2,0,0]=4 7351 B9R0.50 CCC(C#C)NCCCO Amb25774259 [0,2,0,0,0,0|2,0,0]=4 7352 B9R0.50 CCC(C#N)NCCCO Amb24696392 [0,2,0,0,0,0|2,0,0]=4 7353 B9R0.50 CCC(C#N)NOCCC Amb25044990 [0,2,0,0,0,0|2,0,0]=4 7354 B9R0.50 CCC(C#N)OCCCN Amb24538014 [0,2,0,0,0,0|2,0,0]=4 7355 B9R0.50 CCC(C#N)OCCCO Amb24602674 [0,2,0,0,0,0|2,0,0]=4 7356 B9R0.50 CCC(C#N)OCCNC Amb25854518 [0,2,0,0,0,0|2,0,0]=4 7357 B9R0.50 CCC(C#N)OCCSC Amb25780991 [0,2,0,0,0,0|2,0,0]=4 7358 B9R0.50 CCC(C=O)OCCCO Amb25290831 [0,2,0,0,0,0|2,0,0]=4 7359 B9R0.50 CCC(CBr)COCC=C Amb24524562 [0,2,0,0,0,0|1,0,1]=4 7360 B9R0.50 CCC(CC)OCCCCl Amb25851628 [0,2,0,0,0,0|2,0,0]=4 7361 B9R0.50 CCC(CCCCBr)OC Amb24696582 [0,2,0,0,0,0|2,0,0]=4 7362 B9R0.50 CCC(CCCCCl)C=O Amb25213058 [0,2,0,0,0,0|2,0,0]=4 7363 B9R0.50 CCC(CCCCCl)OC Amb25072820 [0,2,0,0,0,0|2,0,0]=4 7364 B9R0.50 CCC(CCCCF)NN Amb24748714 [0,2,0,0,0,0|2,0,0]=4 7365 B9R0.50 CCC(CCCCN)CC Amb24373288 [0,2,0,0,0,0|2,0,0]=4 7366 B9R0.50 CCC(CCCCN)CN Amb25253768 [0,2,0,0,0,0|2,0,0]=4 7367 B9R0.50 CCC(CN)CNCCF Amb25725720 [0,2,0,0,0,0|2,0,0]=4 7368 B9R0.50 CCC(CN)OCCCO Amb24750188 [0,2,0,0,0,0|2,0,0]=4 7369 B9R0.50 CCC(CN)OCCSC Amb25187189 [0,2,0,0,0,0|2,0,0]=4 7370 B9R0.50 CCC(CNCCF)CC Amb25275922 [0,2,0,0,0,0|2,0,0]=4 7371 B9R0.50 CCC(CO)CCCSC Amb24365702 [0,2,0,0,0,0|2,0,0]=4 7372 B9R0.50 CCC(CO)CCOCC Amb24340505 [0,2,0,0,0,0|2,0,0]=4 7373 B9R0.50 CCC(CO)CCSCC Amb25241074 [0,2,0,0,0,0|2,0,0]=4 7374 B9R0.50 CCC(CO)N=CCCC Amb25776744 [0,2,0,0,0,0|1,0,1]=4 7375 B9R0.50 CCC(CO)NCCCF Amb25032108 [0,2,0,0,0,0|2,0,0]=4 7376 B9R0.50 CCC(CO)NCCCO Amb24363916 [0,2,0,0,0,0|2,0,0]=4 7377 B9R0.50 CCC(COCC=O)CC Amb24479365 [0,2,0,0,0,0|0,0,2]=4 7378 B9R0.50 CCC(COCCBr)CC Amb24479367 [0,2,0,0,0,0|1,0,0]=3 7379 B9R0.50 CCC(COCCN)CC Amb24585102 [0,2,0,0,0,0|1,0,0]=3 7380 B9R0.50 CCC(CSCCCl)CC Amb24734052 [0,2,0,0,0,0|1,1,0]=4 7381 B9R0.50 CCC(CSCCN)CC Amb25260300 [0,2,0,0,0,0|1,1,0]=4 7382 B9R0.50 CCC(CSCCN)OC Amb24714071 [0,2,0,0,0,0|1,1,0]=4 7383 B9R0.50 CCCC#CC(CO)CC Amb24412994 [0,2,0,0,0,0|1,0,1]=4 7384 B9R0.50 CCCCCC(CBr)C=C Amb25766539 [0,2,0,0,0,0|2,0,0]=4 7385 B9R0.50 CCCCCC(CBr)CBr Amb24570078 [0,2,0,0,0,0|2,0,0]=4 7386 B9R0.50 CCCCCC(CBr)OC Amb25139566 [0,2,0,0,0,0|2,0,0]=4 7387 B9R0.50 CCCCCC(CC)CC Amb22229275 [0,2,0,0,0,0|2,0,0]=4 7388 B9R0.50 CCCCCC(CC)NC Amb24598729 [0,2,0,0,0,0|2,0,0]=4 7389 B9R0.50 CCCCCC(CC)[Mg]Br Amb22897346 [0,2,0,0,0,0|2,0,0]=4 7390 B9R0.50 CCCCCC(CC)[Zn]Br Amb22897858 [0,2,0,0,0,0|2,0,0]=4 7391 B9R0.50 CCCCCC(CCl)CCl Amb24429090 [0,2,0,0,0,0|2,0,0]=4 7392 B9R0.50 CCCCCC(CCl)OC Amb25373853 [0,2,0,0,0,0|2,0,0]=4 7393 B9R0.50 CCCCCC(CN)CC Amb25090204 [0,2,0,0,0,0|2,0,0]=4 7394 B9R0.50 CCCCCC(CO)=C=C Amb25027810 [0,2,0,0,0,0|1,0,1]=4 7395 B9R0.50 CCCCCC(CO)C#N Amb24477943 [0,2,0,0,0,0|1,0,0]=3 7396 B9R0.50 CCCCCC(CO)NC Amb24444104 [0,2,0,0,0,0|1,0,0]=3 7397 B9R0.50 CCCCCP(CO)CO Amb24642930 [0,2,0,0,0,0|2,0,0]=4 7398 B9R0.50 CCCCC[C@@H](CC)C=O Amb24559168 [0,2,0,0,0,0|2,0,0]=4 7399 B9R0.50 CCCCC[C@@H](CO)CC Amb25763987 [0,2,0,0,0,0|1,0,0]=3 7400 B9R0.50 CCCCNC(CCl)CC Amb24688650 [0,2,0,0,0,0|2,0,0]=4 7401 B9R0.50 CCCCNC(CN)CC Amb25147534 [0,2,0,0,0,0|2,0,0]=4 7402 B9R0.50 CCCCNC(CO)C#C Amb24629721 [0,2,0,0,0,0|1,0,0]=3 7403 B9R0.50 CCCCNC(CO)CCl Amb24480647 [0,2,0,0,0,0|1,0,0]=3 7404 B9R0.50 CCCCNC(CO)CO Amb24745627 [0,2,0,0,0,0|1,0,0]=3 7405 B9R0.50 CCCCN[C@@H](CN)CC Amb24407414 [0,2,0,0,0,0|2,0,0]=4 7406 B9R0.50 CCCCN[C@@H](CO)CC Amb25147323 [0,2,0,0,0,0|1,0,0]=3 7407 B9R0.50 CCCCOC(CBr)C=C Amb25069383 [0,2,0,0,0,0|1,0,0]=3 7408 B9R0.50 CCCCOC(CCl)C=C Amb25368329 [0,2,0,0,0,0|1,0,0]=3 7409 B9R0.50 CCCCOC(CCl)CC Amb25378777 [0,2,0,0,0,0|1,0,0]=3 7410 B9R0.50 CCCCOC(CCl)CCl Amb25232605 [0,2,0,0,0,0|1,0,0]=3 7411 B9R0.50 CCCCOC(CO)C=C Amb25677472 [0,2,0,0,0,0|0,0,0]=2 7412 B9R0.50 CCCCSC(CC)C#N Amb18182314 [0,2,0,0,0,0|1,1,0]=4 7413 B9R0.50 CCCCSC(CN)CC Amb18798051 [0,2,0,0,0,0|1,1,0]=4 7414 B9R0.50 CCCCSC(CO)=CC Amb25796330 [0,2,0,0,0,0|0,1,1]=4 7415 B9R0.50 CCCCSC(CO)C=C Amb24429363 [0,2,0,0,0,0|0,1,0]=3 7416 B9R0.50 CCCC\C=C(/CO)\CC Amb25327448 [0,2,0,0,0,0|1,0,1]=4 7417 B9R0.50 CCCOCC(C#C)NC Amb25685075 [0,2,0,0,0,0|2,0,0]=4 7418 B9R0.50 CCCOCC(C#N)NC Amb25327311 [0,2,0,0,0,0|2,0,0]=4 7419 B9R0.50 CCCOCC(CC)NC Amb25331666 [0,2,0,0,0,0|1,0,0]=3 7420 B9R0.50 CCCOCC(CS)CC Amb24529336 [0,2,0,0,0,0|1,0,0]=3 7421 B9R0.50 CCCOCC(OC)OC Amb25299385 [0,2,0,0,0,0|2,0,0]=4 7422 B9R0.50 CCCSCC(CBr)CC Amb25324483 [0,2,0,0,0,0|1,1,0]=4 7423 B9R0.50 CCCSCC(CC)NC Amb25801635 [0,2,0,0,0,0|1,1,0]=4 7424 B9R0.50 CCCSCC(CS)CC Amb24675735 [0,2,0,0,0,0|1,1,0]=4 7425 B9R0.50 CCC\C=C\C(CO)CC Amb24642614 [0,2,0,0,0,0|1,0,1]=4 7426 B9R0.50 CCC\C=C\C(CO)CO Amb25692304 [0,2,0,0,0,0|1,0,1]=4 7427 B9R0.50 CCN(CCCCO)N=O Amb22732229 [0,2,0,0,0,0|2,0,0]=4 7428 B9R0.50 CCOCCC(CO)CO Amb24674390 [0,2,0,0,0,0|2,0,0]=4 7429 B9R0.50 CCOCOC(CCl)CCl Amb24426156 [0,2,0,0,0,0|2,0,0]=4 7430 B9R0.50 CCP(CCCCO)CC Amb24414971 [0,2,0,0,0,0|2,0,0]=4 7431 B9R0.50 CCSCCC(CN)CO Amb24603471 [0,2,0,0,0,0|2,0,0]=4 7432 B9R0.50 CCSCCC(CO)C#N Amb24428532 [0,2,0,0,0,0|2,0,0]=4 7433 B9R0.50 CC[C@@H](CO)NCCOC Amb25042941 [0,2,0,0,0,0|2,0,0]=4 7434 B9R0.50 CNC(CCCCO)C#N Amb24479129 [0,2,0,0,0,0|2,0,0]=4 7435 B9R0.50 CNC(CO)CCCSC Amb24387020 [0,2,0,0,0,0|2,0,0]=4 7436 B9R0.50 CNC(CSCCO)C#N Amb18800427 [0,2,0,0,0,0|1,1,0]=4 7437 B9R0.50 CNCCOC(CC)CC Amb25095073 [0,2,0,0,0,0|2,0,0]=4 7438 B9R0.50 COC(CBr)OCCCC Amb24617531 [0,2,0,0,0,0|1,0,0]=3 7439 B9R0.50 COC(CCCCO)CO Amb24355183 [0,2,0,0,0,0|2,0,0]=4 7440 B9R0.50 COC(CCl)OCCCC Amb25346505 [0,2,0,0,0,0|1,0,0]=3 7441 B9R0.50 COC(CNCCO)OC Amb18633482 [0,2,0,0,0,0|2,0,0]=4 7442 B9R0.50 COC(COCCN)OC Amb25703974 [0,2,0,0,0,0|2,0,0]=4 7443 B9R0.50 COC(CSCCO)OC Amb24509742 [0,2,0,0,0,0|1,1,0]=4 7444 B9R0.50 COCCNC(CO)C#N Amb25348906 [0,2,0,0,0,0|2,0,0]=4 7445 B9R0.50 COCCNC(CO)CO Amb25306916 [0,2,0,0,0,0|2,0,0]=4 7446 B9R0.50 COCCOC(CBr)C=C Amb24621776 [0,2,0,0,0,0|2,0,0]=4 7447 B9R0.50 COCCOC(CC)C#N Amb25130838 [0,2,0,0,0,0|2,0,0]=4 7448 B9R0.50 COCCOC(CCl)CCl Amb25109274 [0,2,0,0,0,0|2,0,0]=4 7449 B9R0.50 COCCOC(CCl)OC Amb25106353 [0,2,0,0,0,0|2,0,0]=4 7450 B9R0.50 COCCOC(CN)CC Amb24750187 [0,2,0,0,0,0|2,0,0]=4 7451 B9R0.50 CSCCCC(CO)CO Amb25088935 [0,2,0,0,0,0|2,0,0]=4 7452 B9R0.50 C\C=C\COC(CO)CO Amb25098626 [0,2,0,0,0,0|0,0,2]=4 7453 B9R0.50 ClCCCOC(CCl)CCl Amb24477316 [0,2,0,0,0,0|2,0,0]=4 7454 B9R0.50 NCCCNC(CO)CO Amb25126008 [0,2,0,0,0,0|2,0,0]=4 7455 B9R0.50 OCC(CCCCCl)CO Amb24665788 [0,2,0,0,0,0|2,0,0]=4 7456 B9R0.50 OCCCCC(CO)CO Amb24537302 [0,2,0,0,0,0|2,0,0]=4 7457 B9R0.50 OCCCNC(CO)CO Amb25346601 [0,2,0,0,0,0|2,0,0]=4 7458 B9R0.38 CC(C)(C)CC#CCCO Amb25295433 [0,2,0,0,0,0|1,0,1]=4 7459 B9R0.38 CC(C)(C)CCNCCF Amb25086037 [0,2,0,0,0,0|2,0,0]=4 7460 B9R0.38 CC(C)(C)CCNCCN Amb24478043 [0,2,0,0,0,0|2,0,0]=4 7461 B9R0.38 CC(C)(C)CCOCC#N Amb25689936 [0,2,0,0,0,0|1,0,1]=4 7462 B9R0.38 CC(C)(C)CCOCC=O Amb24439615 [0,2,0,0,0,0|0,0,2]=4 7463 B9R0.38 CC(C)(C)CCOCCBr Amb25095422 [0,2,0,0,0,0|1,0,0]=3 7464 B9R0.38 CC(C)(C)CCOCCN Amb21954029 [0,2,0,0,0,0|1,0,0]=3 7465 B9R0.38 CC(C)(C)CCOCCS Amb24412608 [0,2,0,0,0,0|0,1,0]=3 7466 B9R0.38 CC(C)(C)CNCCCO Amb19373346 [0,2,0,0,0,0|2,0,0]=4 7467 B9R0.38 CC(C)(C)COCCCN Amb23449223 [0,2,0,0,0,0|2,0,0]=4 7468 B9R0.38 CC(C)(C)OCCCCO Amb25024661 [0,2,0,0,0,0|2,0,0]=4 7469 B9R0.38 CC(C)(F)CCCCCBr Amb25774434 [0,2,0,0,0,0|2,0,0]=4 7470 B9R0.38 CC(C)(F)CCCCCO Amb24454675 [0,2,0,0,0,0|1,0,0]=3 7471 B9R0.38 CC(C)(N)CCCCCF Amb25686440 [0,2,0,0,0,0|2,0,0]=4 7472 B9R0.38 CC(C)(N)CCCCCN Amb25147427 [0,2,0,0,0,0|2,0,0]=4 7473 B9R0.38 CC(C)(N)CCNCCN Amb25323185 [0,2,0,0,0,0|2,0,0]=4 7474 B9R0.38 CC(C)(N)COCCCO Amb24643959 [0,2,0,0,0,0|2,0,0]=4 7475 B9R0.38 CC(C)(O)CCCCCBr Amb25737898 [0,2,0,0,0,0|2,0,0]=4 7476 B9R0.38 CC(C)(O)CCCCCS Amb25692387 [0,2,0,0,0,0|1,1,0]=4 7477 B9R0.38 CC(C)(O)CCNCCO Amb24454411 [0,2,0,0,0,0|1,0,0]=3 7478 B9R0.38 CC(C)(O)CCOCC=C Amb25311551 [0,2,0,0,0,0|1,0,1]=4 7479 B9R0.38 CC(C)(O)CCOCCN Amb24676042 [0,2,0,0,0,0|1,0,0]=3 7480 B9R0.38 CC(C)(O)CCSCCN Amb24701905 [0,2,0,0,0,0|1,1,0]=4 7481 B9R0.38 CC(C)(O)CCSCCO Amb25283529 [0,2,0,0,0,0|0,1,0]=3 7482 B9R0.38 CC(C)(O)CNCCCO Amb22723314 [0,2,0,0,0,0|2,0,0]=4 7483 B9R0.38 CC(C)(O)CSCCCF Amb24482938 [0,2,0,0,0,0|1,1,0]=4 7484 B9R0.38 CC(C)(O)CSCCCO Amb25850811 [0,2,0,0,0,0|1,1,0]=4 7485 B9R0.38 CC(C)(O)C\C=C\CCO Amb24481192 [0,2,0,0,0,0|1,0,1]=4 7486 B9R0.38 CC(F)(F)CCCCCBr Amb25309673 [0,2,0,0,0,0|2,0,0]=4 7487 B9R0.38 CC(F)(F)CCNCCN Amb25364333 [0,2,0,0,0,0|2,0,0]=4 7488 B9R0.38 CC(F)(F)CCOCCN Amb24602404 [0,2,0,0,0,0|1,0,0]=3 7489 B9R0.38 CCCCCCC(C)(C)C Amb10069374 [0,2,0,0,0,0|2,0,0]=4 7490 B9R0.38 CCCCCCC(C)(C)Cl Amb22228729 [0,2,0,0,0,0|2,0,0]=4 7491 B9R0.38 CCCCCCC(C)(C)O Amb21520374 [0,2,0,0,0,0|1,0,0]=3 7492 B9R0.38 CCCCCCC(Cl)(Cl)F Amb10840161 [0,2,0,0,0,0|2,0,0]=4 7493 B9R0.38 CCCCCCC(F)(F)F Amb17672623 [0,2,0,0,0,0|2,0,0]=4 7494 B9R0.38 CCCCCCS(O)(=O)=O Amb25138206 [0,2,0,0,0,0|2,0,0]=4 7495 B9R0.38 CCCCNCC(C)(C)C Amb17231975 [0,2,0,0,0,0|2,0,0]=4 7496 B9R0.38 CCCCNCC(C)(C)Cl Amb25059090 [0,2,0,0,0,0|2,0,0]=4 7497 B9R0.38 CCCCNCC(C)(C)N Amb24074597 [0,2,0,0,0,0|2,0,0]=4 7498 B9R0.38 CCCCNCC(C)(F)F Amb24701940 [0,2,0,0,0,0|2,0,0]=4 7499 B9R0.38 CCCCNCC(O)(C)C Amb17138402 [0,2,0,0,0,0|1,0,0]=3 7500 B9R0.38 CCCCNCP(=O)(O)C Amb1776475 [0,2,0,0,0,0|2,0,0]=4 7501 B9R0.38 CCCCNCS(O)(=O)=O Amb25784458 [0,2,0,0,0,0|2,0,0]=4 7502 B9R0.38 CCCCOCC(F)(F)F Amb25072282 [0,2,0,0,0,0|1,0,0]=3 7503 B9R0.38 CCCCOCC(N)(C)C Amb17485999 [0,2,0,0,0,0|1,0,0]=3 7504 B9R0.38 CCCCOCP(O)(O)=O Amb25349493 [0,2,0,0,0,0|1,0,0]=3 7505 B9R0.38 CCCCSCC(C)(C)O Amb18792455 [0,2,0,0,0,0|0,1,0]=3 7506 B9R0.38 CCCCSCC(F)(F)F Amb24482682 [0,2,0,0,0,0|1,1,0]=4 7507 B9R0.38 CCCNCCC(C)(F)F Amb25688657 [0,2,0,0,0,0|2,0,0]=4 7508 B9R0.38 CCCOCCC(C)(C)N Amb25341882 [0,2,0,0,0,0|1,0,0]=3 7509 B9R0.38 CCCONCC(C)(C)C Amb25300532 [0,2,0,0,0,0|2,0,0]=4 7510 B9R0.38 CCCONCC(C)(C)O Amb25322475 [0,2,0,0,0,0|2,0,0]=4 7511 B9R0.38 CCCSCCC(C)(C)C Amb25225909 [0,2,0,0,0,0|1,1,0]=4 7512 B9R0.38 CNCCCCC(O)(C)C Amb17569963 [0,2,0,0,0,0|2,0,0]=4 7513 B9R0.38 CNCCOCC(F)(F)F Amb18791798 [0,2,0,0,0,0|2,0,0]=4 7514 B9R0.38 CNCCSCC(C)(C)O Amb25180154 [0,2,0,0,0,0|1,1,0]=4 7515 B9R0.38 COCCNCC(O)(C)C Amb17138418 [0,2,0,0,0,0|2,0,0]=4 7516 B9R0.38 COCCOCC(C)(C)C Amb25146240 [0,2,0,0,0,0|2,0,0]=4 7517 B9R0.38 COCCOCC(C)(C)O Amb22348060 [0,2,0,0,0,0|1,0,0]=3 7518 B9R0.38 COCCSCC(C)(C)O Amb18792608 [0,2,0,0,0,0|1,1,0]=4 7519 B9R0.38 CS(=O)(=O)CCCCCO Amb25098992 [0,2,0,0,0,0|2,0,0]=4 7520 B9R0.38 CS(=O)(=O)CCNCCO Amb18798863 [0,2,0,0,0,0|2,0,0]=4 7521 B9R0.38 CS(=O)(=O)CCOCCCl Amb23452895 [0,2,0,0,0,0|2,0,0]=4 7522 B9R0.38 CS(=O)(=O)CCOCCN Amb19352281 [0,2,0,0,0,0|2,0,0]=4 7523 B9R0.38 CS(=O)(=O)CCSCCO Amb18324344 [0,2,0,0,0,0|1,1,0]=4 7524 B9R0.38 CSCCOCC(F)(F)F Amb25340605 [0,2,0,0,0,0|2,0,0]=4 7525 B9R0.38 CSCCSCC(C)(C)O Amb24652646 [0,2,0,0,0,0|1,1,0]=4 7526 B9R0.38 C[N+](C)(N)CCOCCCl Amb25314303 [0,2,0,0,0,0|2,0,0]=4 7527 B9R0.38 C[Si](C)(C)CCOCCCl Amb24557806 [0,2,0,0,0,0|1,1,0]=4 7528 B9R0.38 FC(F)(F)CCOCCBr Amb24624564 [0,2,0,0,0,0|2,0,0]=4 7529 B9R0.38 FC(F)(F)COCCCI Amb24590187 [0,2,0,0,0,0|2,0,0]=4 7530 B9R0.38 FC(F)(F)COCCCS Amb18180425 [0,2,0,0,0,0|2,0,0]=4 7531 B9R0.38 NCCCOCC(F)(F)F Amb10203828 [0,2,0,0,0,0|2,0,0]=4 7532 B9R0.38 NCCCOCC(F)(F)F Amb1138245 [0,2,0,0,0,0|2,0,0]=4 7533 B9R0.38 NCCOCCS(=O)(=O)C Amb17502064 [0,2,0,0,0,0|2,0,0]=4 7534 B9R0.38 OCCCOCC(F)(F)F Amb18787748 [0,2,0,0,0,0|2,0,0]=4 7535 B9R0.38 OCCOCCS(=O)(=O)F Amb24353067 [0,2,0,0,0,0|2,0,0]=4 7536 B9R0.55 CC(=C)CCOCC(O)=O Amb18644114 [0,2,0,0,0,0|0,0,2]=4 7537 B9R0.55 CC(Br)CCCCB(O)O Amb25293151 [0,2,0,0,0,0|2,0,0]=4 7538 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [0,2,0,0,0,0|1,0,1]=4 7539 B9R0.55 CC(C)CCCCC(C)C Amb22043289 [0,2,0,0,0,0|2,0,0]=4 7540 B9R0.55 CC(C)CCCCC(C)O Amb24334713 [0,2,0,0,0,0|1,0,0]=3 7541 B9R0.55 CC(C)CCNCC(C)Cl Amb25305127 [0,2,0,0,0,0|2,0,0]=4 7542 B9R0.55 CC(C)CCNCC(C)N Amb24544512 [0,2,0,0,0,0|2,0,0]=4 7543 B9R0.55 CC(C)CCNCC(F)F Amb18177901 [0,2,0,0,0,0|2,0,0]=4 7544 B9R0.55 CC(C)CCNC[C@H](C)O Amb25125982 [0,2,0,0,0,0|1,0,0]=3 7545 B9R0.55 CC(C)CCOCC(=C)Br Amb25829671 [0,2,0,0,0,0|1,0,1]=4 7546 B9R0.55 CC(C)CCOCC(C)O Amb24478035 [0,2,0,0,0,0|0,0,0]=2 7547 B9R0.55 CC(C)CCOCC(N)=O Amb25055946 [0,2,0,0,0,0|0,0,2]=4 7548 B9R0.55 CC(C)CCOC[C@@H](C)N Amb25831001 [0,2,0,0,0,0|1,0,0]=3 7549 B9R0.55 CC(C)CCOC[C@H](C)O Amb25295154 [0,2,0,0,0,0|0,0,0]=2 7550 B9R0.55 CC(C)CCSC[C@H](C)N Amb24613670 [0,2,0,0,0,0|1,1,0]=4 7551 B9R0.55 CC(C)CNCCC(C)N Amb25677564 [0,2,0,0,0,0|2,0,0]=4 7552 B9R0.55 CC(C)CNCC[C@H](C)O Amb25730715 [0,2,0,0,0,0|2,0,0]=4 7553 B9R0.55 CC(C)COCCC(C)O Amb24478037 [0,2,0,0,0,0|1,0,0]=3 7554 B9R0.55 CC(C)CSCCC(C)O Amb25353802 [0,2,0,0,0,0|1,1,0]=4 7555 B9R0.55 CC(C)NCCCC(C)O Amb24478897 [0,2,0,0,0,0|2,0,0]=4 7556 B9R0.55 CC(C)OCCCC(C)O Amb24450979 [0,2,0,0,0,0|2,0,0]=4 7557 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [0,2,0,0,0,0|1,0,1]=4 7558 B9R0.55 CC(CCNCC(=O)O)C Amb1111021 [0,2,0,0,0,0|1,0,1]=4 7559 B9R0.55 CC(CCSCC(=O)O)C Amb1137397 [0,2,0,0,0,0|0,1,1]=4 7560 B9R0.55 CC(Cl)CCCCC(Cl)Cl Amb24741814 [0,2,0,0,0,0|2,0,0]=4 7561 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [0,2,0,0,0,0|1,0,1]=4 7562 B9R0.55 CC(N)CCCCC(C)N Amb24637580 [0,2,0,0,0,0|2,0,0]=4 7563 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [0,2,0,0,0,0|1,0,1]=4 7564 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [0,2,0,0,0,0|1,0,1]=4 7565 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [0,2,0,0,0,0|1,0,1]=4 7566 B9R0.55 CC(O)CCCCN(C)C Amb24271124 [0,2,0,0,0,0|2,0,0]=4 7567 B9R0.55 CC(O)CCCC[SiH](C)C Amb25043567 [0,2,0,0,0,0|1,1,0]=4 7568 B9R0.55 CC(O)CCNCC(F)F Amb24361047 [0,2,0,0,0,0|2,0,0]=4 7569 B9R0.55 CC(O)CCNCC(O)=O Amb25369892 [0,2,0,0,0,0|1,0,1]=4 7570 B9R0.55 CC(O)CNCCS(C)=O Amb24704852 [0,2,0,0,0,0|2,0,0]=4 7571 B9R0.55 CC(O)COCCC(O)=O Amb24746704 [0,2,0,0,0,0|1,0,1]=4 7572 B9R0.55 CC(O)CSCCN(C)C Amb25806842 [0,2,0,0,0,0|1,1,0]=4 7573 B9R0.55 CC(O)C\C=C\CC(C)O Amb25098643 [0,2,0,0,0,0|1,0,1]=4 7574 B9R0.55 CN(C)CCOCC(O)=O Amb20667765 [0,2,0,0,0,0|1,0,1]=4 7575 B9R0.55 CN(C)CCOCC(O)=O Amb22059502 [0,2,0,0,0,0|1,0,1]=4 7576 B9R0.55 CS(=O)CCOCC(O)=O Amb24600087 [0,2,0,0,0,0|1,0,1]=4 7577 B9R0.55 C[C@@H](N)CCOCC(F)F Amb24479637 [0,2,0,0,0,0|1,0,0]=3 7578 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [0,2,0,0,0,0|1,0,1]=4 7579 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [0,2,0,0,0,0|1,0,1]=4 7580 B9R0.55 C[C@@H](O)CNCCS(C)=O Amb24424223 [0,2,0,0,0,0|2,0,0]=4 7581 B9R0.55 C[C@@H](O)CSCCN(C)C Amb24504819 [0,2,0,0,0,0|1,1,0]=4 7582 B9R0.55 C[C@@H](O)C\C=C\C[C@@H](C)O Amb25106041 [0,2,0,0,0,0|1,0,1]=4 7583 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [0,2,0,0,0,0|1,0,1]=4 7584 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [0,2,0,0,0,0|1,0,1]=4 7585 B9R0.55 C[C@H](O)CNCCC(C)O Amb25352546 [0,2,0,0,0,0|1,0,0]=3 7586 B9R0.55 C[C@H](O)CNCCN(C)C Amb24479100 [0,2,0,0,0,0|2,0,0]=4 7587 B7R1.1 BrCC1CCCN1 Amb20618588 [1,0,0,1,0,0|2,0,0]=4 7588 B7R1.1 BrCC1CCCN1 Amb21962027 [1,0,0,1,0,0|2,0,0]=4 7589 B7R1.1 BrCC1CNCC1 Amb20618587 [1,0,0,1,0,0|2,0,0]=4 7590 B7R1.1 BrCC1CNCC1 Amb22229236 [1,0,0,1,0,0|2,0,0]=4 7591 B7R1.1 BrCC1COCO1 Amb25138742 [1,0,0,1,0,0|1,0,0]=3 7592 B7R1.1 BrC[C@@H]1CCCN1 Amb22225950 [1,0,0,1,0,0|2,0,0]=4 7593 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [1,0,0,1,0,0|2,0,0]=4 7594 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [1,0,0,1,0,0|1,0,0]=3 7595 B7R1.1 BrC[C@@H]1CNCC1 Amb25702233 [1,0,0,1,0,0|2,0,0]=4 7596 B7R1.1 BrC[C@H]1CCCN1 Amb25355431 [1,0,0,1,0,0|2,0,0]=4 7597 B7R1.1 BrC[C@H]1CNCC1 Amb24753555 [1,0,0,1,0,0|2,0,0]=4 7598 B7R1.1 C#CC1COCC1 Amb23439658 [1,0,0,1,0,0|0,0,2]=4 7599 B7R1.1 C=CC1CCCC1 Amb17934190 [1,0,0,1,0,0|1,0,1]=4 7600 B7R1.1 C=CC1COCC1 Amb24478877 [1,0,0,1,0,0|0,0,2]=4 7601 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|1,0,0]=3 7602 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,0]=3 7603 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,1,0]=3 7604 B7R1.1 CCC1CNCC1 Amb18946548 [1,0,0,1,0,0|1,0,0]=3 7605 B7R1.1 CCC1CNCC1 Amb20630619 [1,0,0,1,0,0|1,0,0]=3 7606 B7R1.1 CCC1CNOC1 Amb25747042 [1,0,0,1,0,0|1,0,0]=3 7607 B7R1.1 CCC1COCN1 Amb24090823 [1,0,0,1,0,0|1,0,0]=3 7608 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|0,0,0]=2 7609 B7R1.1 CCC1NCCO1 Amb17506183 [1,0,0,1,0,0|1,0,0]=3 7610 B7R1.1 CCC1NCCS1 Amb25811802 [1,0,0,1,0,0|1,1,0]=4 7611 B7R1.1 CCC1OCCO1 Amb19892413 [1,0,0,1,0,0|0,0,0]=2 7612 B7R1.1 CCC=1CCCN1 Amb22055207 [1,0,0,1,0,0|1,0,1]=4 7613 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|1,0,0]=3 7614 B7R1.1 CC[C@@H]1CCCN1 Amb22225172 [1,0,0,1,0,0|1,0,0]=3 7615 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,0]=3 7616 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,0]=3 7617 B7R1.1 CC[C@H]1CNCC1 Amb24479851 [1,0,0,1,0,0|1,0,0]=3 7618 B7R1.1 CNC1CCCC1 Amb1223228 [1,0,0,1,0,0|2,0,0]=4 7619 B7R1.1 CNC1CNCC1 Amb22491402 [1,0,0,1,0,0|2,0,0]=4 7620 B7R1.1 CNC1COCC1 Amb20241377 [1,0,0,1,0,0|1,0,0]=3 7621 B7R1.1 CNC1CSCC1 Amb1139583 [1,0,0,1,0,0|1,1,0]=4 7622 B7R1.1 CNC1CSCC1 Amb22741543 [1,0,0,1,0,0|1,1,0]=4 7623 B7R1.1 CN[C@@H]1COCC1 Amb20240861 [1,0,0,1,0,0|1,0,0]=3 7624 B7R1.1 CN[C@@H]1COCC1 Amb20241500 [1,0,0,1,0,0|1,0,0]=3 7625 B7R1.1 CN[C@H]1COCC1 Amb20241026 [1,0,0,1,0,0|1,0,0]=3 7626 B7R1.1 COC1CCCN1 Amb22493883 [1,0,0,1,0,0|2,0,0]=4 7627 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|1,0,0]=3 7628 B7R1.1 COC1CNCC1 Amb10603699 [1,0,0,1,0,0|2,0,0]=4 7629 B7R1.1 COC1OCCO1 Amb17939672 [1,0,0,1,0,0|1,0,0]=3 7630 B7R1.1 COC1OCCS1 Amb25056247 [1,0,0,1,0,0|1,1,0]=4 7631 B7R1.1 CO[C@@H]1CNCC1 Amb10603275 [1,0,0,1,0,0|2,0,0]=4 7632 B7R1.1 CO[C@@H]1CNCC1 Amb20241379 [1,0,0,1,0,0|2,0,0]=4 7633 B7R1.1 CO[C@H]1CNCC1 Amb10603225 [1,0,0,1,0,0|2,0,0]=4 7634 B7R1.1 CO[C@H]1CNCC1 Amb10603226 [1,0,0,1,0,0|2,0,0]=4 7635 B7R1.1 CSC1CCCC1 Amb22230463 [1,0,0,1,0,0|2,0,0]=4 7636 B7R1.1 CSC1CNCC1 Amb18279428 [1,0,0,1,0,0|2,0,0]=4 7637 B7R1.1 CS[C@H]1CNCC1 Amb24610101 [1,0,0,1,0,0|2,0,0]=4 7638 B7R1.1 ClCC1CCCN1 Amb1102532 [1,0,0,1,0,0|2,0,0]=4 7639 B7R1.1 ClCC1CCCN1 Amb22228750 [1,0,0,1,0,0|2,0,0]=4 7640 B7R1.1 ClCC1CCCO1 Amb2377520 [1,0,0,1,0,0|1,0,0]=3 7641 B7R1.1 ClCC1CCCS1 Amb25339278 [1,0,0,1,0,0|1,1,0]=4 7642 B7R1.1 ClCC1CNCC1 Amb20618586 [1,0,0,1,0,0|2,0,0]=4 7643 B7R1.1 ClCC1CNCC1 Amb22229271 [1,0,0,1,0,0|2,0,0]=4 7644 B7R1.1 ClCC1COCO1 Amb25147241 [1,0,0,1,0,0|1,0,0]=3 7645 B7R1.1 ClCC1CSCO1 Amb24454663 [1,0,0,1,0,0|1,1,0]=4 7646 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [1,0,0,1,0,0|2,0,0]=4 7647 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [1,0,0,1,0,0|2,0,0]=4 7648 B7R1.1 ClC[C@@H]1CCCO1 Amb25225942 [1,0,0,1,0,0|1,0,0]=3 7649 B7R1.1 ClC[C@@H]1CNCC1 Amb25064501 [1,0,0,1,0,0|2,0,0]=4 7650 B7R1.1 ClC[C@H]1CCCO1 Amb24406034 [1,0,0,1,0,0|1,0,0]=3 7651 B7R1.1 Cl[Mg]C1CCCC1 Amb17689222 [1,0,0,1,0,0|2,0,0]=4 7652 B7R1.1 FCC1CCCN1 Amb13953136 [1,0,0,1,0,0|2,0,0]=4 7653 B7R1.1 FCC1CCCO1 Amb24456901 [1,0,0,1,0,0|1,0,0]=3 7654 B7R1.1 FCC1CNCC1 Amb24423478 [1,0,0,1,0,0|2,0,0]=4 7655 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [1,0,0,1,0,0|2,0,0]=4 7656 B7R1.1 FC[C@@H]1CNCC1 Amb24184002 [1,0,0,1,0,0|2,0,0]=4 7657 B7R1.1 ICC1CCCN1 Amb21861199 [1,0,0,1,0,0|2,0,0]=4 7658 B7R1.1 ICC1CCCN1 Amb22228742 [1,0,0,1,0,0|2,0,0]=4 7659 B7R1.1 ICC1CCCO1 Amb24060886 [1,0,0,1,0,0|1,0,0]=3 7660 B7R1.1 ICC1CNCC1 Amb21861201 [1,0,0,1,0,0|2,0,0]=4 7661 B7R1.1 ICC1CNCC1 Amb22229332 [1,0,0,1,0,0|2,0,0]=4 7662 B7R1.1 ICC1COCC1 Amb23439064 [1,0,0,1,0,0|1,0,0]=3 7663 B7R1.1 ICN1CCCC1 Amb24060254 [1,0,0,1,0,0|2,0,0]=4 7664 B7R1.1 IC[C@@H]1CCCN1 Amb22226246 [1,0,0,1,0,0|2,0,0]=4 7665 B7R1.1 IC[C@@H]1CCCN1 Amb24612062 [1,0,0,1,0,0|2,0,0]=4 7666 B7R1.1 N#CC1CCCO1 Amb17506326 [1,0,0,1,0,0|1,0,1]=4 7667 B7R1.1 N#CC1COCC1 Amb16233563 [1,0,0,1,0,0|1,0,1]=4 7668 B7R1.1 N#C[C@@H]1COCC1 Amb23439943 [1,0,0,1,0,0|1,0,1]=4 7669 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|1,0,0]=3 7670 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|1,0,0]=3 7671 B7R1.1 NCC1CCCN1 Amb19516137 [1,0,0,1,0,0|2,0,0]=4 7672 B7R1.1 NCC1CCCN1 Amb22504269 [1,0,0,1,0,0|2,0,0]=4 7673 B7R1.1 NCC1CCCO1 Amb2568046 [1,0,0,1,0,0|1,0,0]=3 7674 B7R1.1 NCC1CCCS1 Amb20668756 [1,0,0,1,0,0|1,1,0]=4 7675 B7R1.1 NCC1CNCC1 Amb20242959 [1,0,0,1,0,0|2,0,0]=4 7676 B7R1.1 NCC1COCC1 Amb1117962 [1,0,0,1,0,0|1,0,0]=3 7677 B7R1.1 NCC1COCO1 Amb25261501 [1,0,0,1,0,0|1,0,0]=3 7678 B7R1.1 NCC1CSCC1 Amb18198289 [1,0,0,1,0,0|1,1,0]=4 7679 B7R1.1 NCC1OCCS1 Amb23447046 [1,0,0,1,0,0|1,1,0]=4 7680 B7R1.1 NCN1CCCC1 Amb25368345 [1,0,0,1,0,0|2,0,0]=4 7681 B7R1.1 NCN1CCCO1 Amb25091742 [1,0,0,1,0,0|2,0,0]=4 7682 B7R1.1 NC[C@@H]1CCCN1 Amb10066983 [1,0,0,1,0,0|2,0,0]=4 7683 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [1,0,0,1,0,0|2,0,0]=4 7684 B7R1.1 NC[C@@H]1CCCN1 Amb22748399 [1,0,0,1,0,0|2,0,0]=4 7685 B7R1.1 NC[C@@H]1CNCC1 Amb20242961 [1,0,0,1,0,0|2,0,0]=4 7686 B7R1.1 NC[C@@H]1CNCC1 Amb25079280 [1,0,0,1,0,0|2,0,0]=4 7687 B7R1.1 NC[C@@H]1COCC1 Amb23439065 [1,0,0,1,0,0|1,0,0]=3 7688 B7R1.1 NC[C@@H]1COCC1 Amb23439174 [1,0,0,1,0,0|1,0,0]=3 7689 B7R1.1 NC[C@H]1CNCC1 Amb20242960 [1,0,0,1,0,0|2,0,0]=4 7690 B7R1.1 NNC1CCCC1 Amb10071294 [1,0,0,1,0,0|2,0,0]=4 7691 B7R1.1 NNC1COCC1 Amb20668064 [1,0,0,1,0,0|2,0,0]=4 7692 B7R1.1 NNC1COCC1 Amb22059240 [1,0,0,1,0,0|2,0,0]=4 7693 B7R1.1 NNC1COCC1 Amb22491679 [1,0,0,1,0,0|2,0,0]=4 7694 B7R1.1 NN[C@@H]1COCC1 Amb24183622 [1,0,0,1,0,0|2,0,0]=4 7695 B7R1.1 NN[C@@H]1COCC1 Amb24424248 [1,0,0,1,0,0|2,0,0]=4 7696 B7R1.1 NOC1CCCC1 Amb17101093 [1,0,0,1,0,0|2,0,0]=4 7697 B7R1.1 NOC1CCCC1 Amb22750164 [1,0,0,1,0,0|2,0,0]=4 7698 B7R1.1 NOC1COCC1 Amb22295766 [1,0,0,1,0,0|2,0,0]=4 7699 B7R1.1 O=CC1COCO1 Amb25767896 [1,0,0,1,0,0|1,0,1]=4 7700 B7R1.1 O=C[C@@H]1CCCO1 Amb25338193 [1,0,0,1,0,0|0,0,2]=4 7701 B7R1.1 O=C[C@@H]1COCC1 Amb25123223 [1,0,0,1,0,0|1,0,1]=4 7702 B7R1.1 O=C[C@H]1CCCO1 Amb25216742 [1,0,0,1,0,0|0,0,2]=4 7703 B7R1.1 OCC1=CCCO1 Amb25045240 [1,0,0,1,0,0|0,0,2]=4 7704 B7R1.1 OCC1=NCCO1 Amb22410786 [1,0,0,1,0,0|1,0,1]=4 7705 B7R1.1 OCC1C=CCO1 Amb25222276 [1,0,0,1,0,0|0,0,2]=4 7706 B7R1.1 OCC1CCC=C1 Amb23455253 [1,0,0,1,0,0|0,0,2]=4 7707 B7R1.1 OCC1CCCN1 Amb2237182 [1,0,0,1,0,0|1,0,0]=3 7708 B7R1.1 OCC1CCCO1 Amb22731176 [1,0,0,1,0,0|0,0,0]=2 7709 B7R1.1 OCC1CCCS1 Amb19149313 [1,0,0,1,0,0|0,1,0]=3 7710 B7R1.1 OCC1CNCC1 Amb20240954 [1,0,0,1,0,0|1,0,0]=3 7711 B7R1.1 OCC1CNCC1 Amb21858960 [1,0,0,1,0,0|1,0,0]=3 7712 B7R1.1 OCC1CSCC1 Amb18203349 [1,0,0,1,0,0|1,0,0]=3 7713 B7R1.1 OCC1CSCS1 Amb24542520 [1,0,0,1,0,0|1,1,0]=4 7714 B7R1.1 OCC1NCCO1 Amb25230305 [1,0,0,1,0,0|1,0,0]=3 7715 B7R1.1 OCC1NCCS1 Amb25821150 [1,0,0,1,0,0|1,1,0]=4 7716 B7R1.1 OCC=1CCCC1 Amb24479891 [1,0,0,1,0,0|0,0,2]=4 7717 B7R1.1 OC[C@@H]1C=CCO1 Amb25169572 [1,0,0,1,0,0|0,0,2]=4 7718 B7R1.1 OC[C@@H]1CC=CO1 Amb25120125 [1,0,0,1,0,0|0,0,2]=4 7719 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [1,0,0,1,0,0|1,0,0]=3 7720 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [1,0,0,1,0,0|0,0,0]=2 7721 B7R1.1 OC[C@@H]1CNCC1 Amb10067155 [1,0,0,1,0,0|1,0,0]=3 7722 B7R1.1 OC[C@@H]1COCC1 Amb22746669 [1,0,0,1,0,0|1,0,0]=3 7723 B7R1.1 OC[C@@H]1OCCS1 Amb22748777 [1,0,0,1,0,0|1,0,0]=3 7724 B7R1.1 OC[C@H]1C=CCO1 Amb25282911 [1,0,0,1,0,0|0,0,2]=4 7725 B7R1.1 OC[C@H]1CC=CO1 Amb25058557 [1,0,0,1,0,0|0,0,2]=4 7726 B7R1.1 OC[C@H]1CCC=C1 Amb25723081 [1,0,0,1,0,0|0,0,2]=4 7727 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [1,0,0,1,0,0|1,0,0]=3 7728 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [1,0,0,1,0,0|0,0,0]=2 7729 B7R1.1 OC[C@H]1OCCS1 Amb25198578 [1,0,0,1,0,0|1,0,0]=3 7730 B7R1.1 ONC1CNCC1 Amb23586396 [1,0,0,1,0,0|2,0,0]=4 7731 B7R1.1 ONC1CSCC1 Amb24713460 [1,0,0,1,0,0|2,0,0]=4 7732 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|0,1,0]=3 7733 B7R1.1 SCC1CCCO1 Amb10563132 [1,0,0,1,0,0|0,1,0]=3 7734 B7R1.1 SCC1CNCC1 Amb22299730 [1,0,0,1,0,0|1,1,0]=4 7735 B7R1.1 SCC1CNCC1 Amb25198695 [1,0,0,1,0,0|1,1,0]=4 7736 B7R1.1 SC[C@@H]1CCCN1 Amb24120350 [1,0,0,1,0,0|1,1,0]=4 7737 B7R1.1 [13CH3][13CH2]C=1CCCN1 Amb22055208 [1,0,0,1,0,0|1,0,1]=4 7738 B7R1.1 [C-]#[N+]C1CCCC1 Amb1981028 [1,0,0,1,0,0|2,0,0]=4 7739 B7R1.3 BN1CCCCC1 Amb24621882 [1,0,0,1,0,0|2,0,0]=4 7740 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,1,0,0|1,0,0]=3 7741 B7R1.3 BrC1CCCNC1 Amb10603668 [1,0,0,1,0,0|2,0,0]=4 7742 B7R1.3 BrC1CCNCC1 Amb22229718 [1,0,0,1,0,0|2,0,0]=4 7743 B7R1.3 BrC1CCSCC1 Amb18181050 [1,0,0,1,0,0|1,1,0]=4 7744 B7R1.3 BrC1CNCCC1 Amb22497824 [1,0,0,1,0,0|2,0,0]=4 7745 B7R1.3 BrC1COCCO1 Amb24322807 [1,0,0,1,0,0|1,0,0]=3 7746 B7R1.3 C=C1CCOCC1 Amb22000865 [1,0,0,1,0,0|0,0,2]=4 7747 B7R1.3 CB1OCCCO1 Amb25273130 [1,0,0,1,0,0|2,0,0]=4 7748 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|0,0,2]=4 7749 B7R1.3 CC1CC=CCC1 Amb22729698 [1,0,0,1,0,0|1,0,1]=4 7750 B7R1.3 CC1CC=CCO1 Amb25719582 [1,0,0,1,0,0|0,0,2]=4 7751 B7R1.3 CC1CCCCN1 Amb10552680 [1,0,0,1,0,0|1,0,0]=3 7752 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|0,1,0]=3 7753 B7R1.3 CC1CCNCC1 Amb22549250 [1,0,0,1,0,0|1,0,0]=3 7754 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|0,0,0]=2 7755 B7R1.3 CC1CCOCO1 Amb17776591 [1,0,0,1,0,0|0,0,0]=2 7756 B7R1.3 CC1CCSCN1 Amb24475244 [1,0,0,1,0,0|1,1,0]=4 7757 B7R1.3 CC1CNCCC1 Amb22491688 [1,0,0,1,0,0|2,0,0]=4 7758 B7R1.3 CC1CNCCO1 Amb20621613 [1,0,0,1,0,0|1,0,0]=3 7759 B7R1.3 CC1COCCC1 Amb22347806 [1,0,0,1,0,0|1,0,0]=3 7760 B7R1.3 CC1COCCN1 Amb22728071 [1,0,0,1,0,0|1,0,0]=3 7761 B7R1.3 CC1COCOC1 Amb24587149 [1,0,0,1,0,0|2,0,0]=4 7762 B7R1.3 CC1NCCCN1 Amb24381838 [1,0,0,1,0,0|2,0,0]=4 7763 B7R1.3 CC1NCCCO1 Amb17506191 [1,0,0,1,0,0|1,0,0]=3 7764 B7R1.3 CC1NCCCS1 Amb22356247 [1,0,0,1,0,0|1,1,0]=4 7765 B7R1.3 CC1NCCCS1 Amb24479852 [1,0,0,1,0,0|1,1,0]=4 7766 B7R1.3 CC1SCCCS1 Amb10071965 [1,0,0,1,0,0|1,1,0]=4 7767 B7R1.3 CC=1CCOCC1 Amb24070517 [1,0,0,1,0,0|0,0,2]=4 7768 B7R1.3 CN1CCCCN1 Amb24681349 [1,0,0,1,0,0|2,0,0]=4 7769 B7R1.3 CN1CCOCC1 Amb2031952 [1,0,0,1,0,0|1,0,0]=3 7770 B7R1.3 CN1CCOCC1 Amb22730073 [1,0,0,1,0,0|1,0,0]=3 7771 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|1,0,0]=3 7772 B7R1.3 C[C@@H]1CNCCC1 Amb22745835 [1,0,0,1,0,0|2,0,0]=4 7773 B7R1.3 C[C@@H]1CNCCN1 Amb23399598 [1,0,0,1,0,0|2,0,0]=4 7774 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [1,0,0,1,0,0|1,0,0]=3 7775 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [1,0,0,1,0,0|1,0,0]=3 7776 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [1,0,0,1,0,0|1,0,0]=3 7777 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [1,0,0,1,0,0|1,0,0]=3 7778 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [1,0,0,1,0,0|1,1,0]=4 7779 B7R1.3 C[C@H]1CNCCC1 Amb24461444 [1,0,0,1,0,0|2,0,0]=4 7780 B7R1.3 C[C@H]1CNCCN1 Amb22226120 [1,0,0,1,0,0|2,0,0]=4 7781 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [1,0,0,1,0,0|1,0,0]=3 7782 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [1,0,0,1,0,0|1,0,0]=3 7783 B7R1.3 C[C@H]1COCCN1 Amb10066947 [1,0,0,1,0,0|1,0,0]=3 7784 B7R1.3 C[C@H]1COCCN1 Amb19516190 [1,0,0,1,0,0|1,0,0]=3 7785 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [1,0,0,1,0,0|1,1,0]=4 7786 B7R1.3 ClC1CCCCN1 Amb20242688 [1,0,0,1,0,0|2,0,0]=4 7787 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,1,0,0|1,0,0]=3 7788 B7R1.3 ClC1CCSCC1 Amb24355721 [1,0,0,1,0,0|1,1,0]=4 7789 B7R1.3 ClC1CNCCC1 Amb20618570 [1,0,0,1,0,0|2,0,0]=4 7790 B7R1.3 ClC1CNCCC1 Amb22229260 [1,0,0,1,0,0|2,0,0]=4 7791 B7R1.3 ClC1COCCC1 Amb20622589 [1,0,0,1,0,0|1,0,0]=3 7792 B7R1.3 ClC1COCCO1 Amb24677637 [1,0,0,1,0,0|1,0,0]=3 7793 B7R1.3 ClC1COCCS1 Amb25092492 [1,0,0,1,0,0|1,1,0]=4 7794 B7R1.3 ClC1COCOC1 Amb25064950 [1,0,0,1,0,0|2,0,0]=4 7795 B7R1.3 ClN1CCOCC1 Amb20670597 [1,0,0,1,0,0|2,0,0]=4 7796 B7R1.3 Cl[C@@H]1CNCCC1 Amb22226397 [1,0,0,1,0,0|2,0,0]=4 7797 B7R1.3 Cl[C@H]1CCCCO1 Amb24479760 [1,0,0,1,0,0|1,0,0]=3 7798 B7R1.3 Cl[C@H]1CNCCC1 Amb22225326 [1,0,0,1,0,0|2,0,0]=4 7799 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,1,0,0|1,0,0]=3 7800 B7R1.3 FC1CCCNC1 Amb13953137 [1,0,0,1,0,0|2,0,0]=4 7801 B7R1.3 FC1CCNCC1 Amb13885425 [1,0,0,1,0,0|2,0,0]=4 7802 B7R1.3 FC1CCNCC1 Amb22753888 [1,0,0,1,0,0|2,0,0]=4 7803 B7R1.3 FC1CCOCC1 Amb22296909 [1,0,0,1,0,0|1,0,0]=3 7804 B7R1.3 FC1COCCC1 Amb24322825 [1,0,0,1,0,0|1,0,0]=3 7805 B7R1.3 FC1COCCO1 Amb24322827 [1,0,0,1,0,0|1,0,0]=3 7806 B7R1.3 FC1C[NH2+]CCC1 Amb22042691 [1,0,0,1,0,0|2,0,0]=4 7807 B7R1.3 FN1CCCCC1 Amb24541335 [1,0,0,1,0,0|2,0,0]=4 7808 B7R1.3 F[C@@H]1CNCCC1 Amb20242275 [1,0,0,1,0,0|2,0,0]=4 7809 B7R1.3 F[C@H]1CNCCC1 Amb20242276 [1,0,0,1,0,0|2,0,0]=4 7810 B7R1.3 IC1CCNCC1 Amb21860421 [1,0,0,1,0,0|2,0,0]=4 7811 B7R1.3 IC1CCNCC1 Amb22229796 [1,0,0,1,0,0|2,0,0]=4 7812 B7R1.3 IC1CNCCC1 Amb22496356 [1,0,0,1,0,0|2,0,0]=4 7813 B7R1.3 IC1COCCC1 Amb22831295 [1,0,0,1,0,0|1,0,0]=3 7814 B7R1.3 IC1CSCCC1 Amb25744806 [1,0,0,1,0,0|1,1,0]=4 7815 B7R1.3 N=C1CCOCC1 Amb24618556 [1,0,0,1,0,0|1,0,1]=4 7816 B7R1.3 NC1CCCCC1 Amb17837163 [1,0,0,1,0,0|1,0,0]=3 7817 B7R1.3 NC1CCCCC1 Amb20246801 [1,0,0,1,0,0|1,0,0]=3 7818 B7R1.3 NC1CCCCC1 Amb22350215 [1,0,0,1,0,0|1,0,0]=3 7819 B7R1.3 NC1CCCCC1 Amb22352716 [1,0,0,1,0,0|1,0,0]=3 7820 B7R1.3 NC1CCCCN1 Amb16233706 [1,0,0,1,0,0|2,0,0]=4 7821 B7R1.3 NC1CCCCN1 Amb22491043 [1,0,0,1,0,0|2,0,0]=4 7822 B7R1.3 NC1CCCCO1 Amb25137158 [1,0,0,1,0,0|1,0,0]=3 7823 B7R1.3 NC1CCCOC1 Amb1091859 [1,0,0,1,0,0|1,0,0]=3 7824 B7R1.3 NC1CCCSC1 Amb13953228 [1,0,0,1,0,0|1,1,0]=4 7825 B7R1.3 NC1CCNCC1 Amb17943826 [1,0,0,1,0,0|2,0,0]=4 7826 B7R1.3 NC1CCNCC1 Amb20620337 [1,0,0,1,0,0|2,0,0]=4 7827 B7R1.3 NC1CCOCC1 Amb10069117 [1,0,0,1,0,0|1,0,0]=3 7828 B7R1.3 NC1CCOCC1 Amb1102242 [1,0,0,1,0,0|1,0,0]=3 7829 B7R1.3 NC1CCSCC1 Amb13952147 [1,0,0,1,0,0|1,1,0]=4 7830 B7R1.3 NC1COCCC1 Amb19889218 [1,0,0,1,0,0|1,0,0]=3 7831 B7R1.3 NN1CCOCC1 Amb22450064 [1,0,0,1,0,0|2,0,0]=4 7832 B7R1.3 NN1CCOCC1 Amb24066189 [1,0,0,1,0,0|2,0,0]=4 7833 B7R1.3 NN1COCCC1 Amb24333890 [1,0,0,1,0,0|2,0,0]=4 7834 B7R1.3 N[C@@H]1CCCCO1 Amb25146492 [1,0,0,1,0,0|1,0,0]=3 7835 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [1,0,0,1,0,0|2,0,0]=4 7836 B7R1.3 N[C@@H]1CNCCC1 Amb22756860 [1,0,0,1,0,0|2,0,0]=4 7837 B7R1.3 N[C@@H]1COCCC1 Amb19516313 [1,0,0,1,0,0|1,0,0]=3 7838 B7R1.3 N[C@@H]1COCCC1 Amb20241266 [1,0,0,1,0,0|1,0,0]=3 7839 B7R1.3 N[C@@H]1COCCN1 Amb22747393 [1,0,0,1,0,0|2,0,0]=4 7840 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [1,0,0,1,0,0|2,0,0]=4 7841 B7R1.3 N[C@H]1COCCC1 Amb19516292 [1,0,0,1,0,0|1,0,0]=3 7842 B7R1.3 N[C@H]1COCCC1 Amb20241267 [1,0,0,1,0,0|1,0,0]=3 7843 B7R1.3 O=C1COCCC1 Amb19373430 [1,0,0,1,0,0|0,0,2]=4 7844 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,1]=4 7845 B7R1.3 O=[13C]1CCCCC1 Amb22367406 [1,0,0,1,0,0|0,0,2]=4 7846 B7R1.3 OC1C=CCCO1 Amb24526044 [1,0,0,1,0,0|0,0,2]=4 7847 B7R1.3 OC1CC=CCC1 Amb24089165 [1,0,0,1,0,0|0,0,2]=4 7848 B7R1.3 OC1CC=COC1 Amb25663138 [1,0,0,1,0,0|0,0,2]=4 7849 B7R1.3 OC1CCCCN1 Amb20247437 [1,0,0,1,0,0|1,0,0]=3 7850 B7R1.3 OC1CCCCS1 Amb17615672 [1,0,0,1,0,0|0,1,0]=3 7851 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|0,0,0]=2 7852 B7R1.3 OC1CCNCC1 Amb1152974 [1,0,0,1,0,0|1,0,0]=3 7853 B7R1.3 OC1CNCCN1 Amb23442001 [1,0,0,1,0,0|2,0,0]=4 7854 B7R1.3 OC1CNCCO1 Amb13883759 [1,0,0,1,0,0|1,0,0]=3 7855 B7R1.3 OC1CNCCO1 Amb22011707 [1,0,0,1,0,0|1,0,0]=3 7856 B7R1.3 OC1COCC=C1 Amb25662556 [1,0,0,1,0,0|0,0,2]=4 7857 B7R1.3 OC1COCCO1 Amb24536571 [1,0,0,1,0,0|1,0,0]=3 7858 B7R1.3 OC1COCCS1 Amb24404788 [1,0,0,1,0,0|1,0,0]=3 7859 B7R1.3 OC1CSCCO1 Amb25721431 [1,0,0,1,0,0|1,0,0]=3 7860 B7R1.3 OC1CSCCS1 Amb25333667 [1,0,0,1,0,0|1,1,0]=4 7861 B7R1.3 OC1CSCSC1 Amb25700155 [1,0,0,1,0,0|1,1,0]=4 7862 B7R1.3 OC1CSSCC1 Amb25730926 [1,0,0,1,0,0|1,1,0]=4 7863 B7R1.3 OC1OCCCO1 Amb24736493 [1,0,0,1,0,0|1,0,0]=3 7864 B7R1.3 ON1CCOCC1 Amb25243510 [1,0,0,1,0,0|2,0,0]=4 7865 B7R1.3 O[13CH]1CCCCC1 Amb22336567 [1,0,0,1,0,0|0,0,0]=2 7866 B7R1.3 O[C@@H]1CCCC=C1 Amb10601567 [1,0,0,1,0,0|0,0,2]=4 7867 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|0,0,0]=2 7868 B7R1.3 O[C@@H]1COCCC1 Amb20241306 [1,0,0,1,0,0|0,0,0]=2 7869 B7R1.3 O[C@H]1CC=COC1 Amb25272017 [1,0,0,1,0,0|0,0,2]=4 7870 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [1,0,0,1,0,0|1,0,0]=3 7871 B7R1.3 O[C@H]1CNCCC1 Amb20241315 [1,0,0,1,0,0|1,0,0]=3 7872 B7R1.3 O[C@H]1CSCCC1 Amb25761109 [1,0,0,1,0,0|0,1,0]=3 7873 B7R1.3 PC1CCCCC1 Amb19889857 [1,0,0,1,0,0|1,0,0]=3 7874 B7R1.3 S=C1CCCCC1 Amb24565839 [1,0,0,1,0,0|0,1,1]=4 7875 B7R1.3 SC1CCNCC1 Amb17502200 [1,0,0,1,0,0|1,1,0]=4 7876 B7R1.3 SC1CCNCC1 Amb22371055 [1,0,0,1,0,0|1,1,0]=4 7877 B7R1.3 SC1CNCCC1 Amb22371077 [1,0,0,1,0,0|1,1,0]=4 7878 B7R1.3 SC1COCCC1 Amb24066221 [1,0,0,1,0,0|0,1,0]=3 7879 B7R1.3 SN1CCCCC1 Amb24479351 [1,0,0,1,0,0|1,1,0]=4 7880 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|1,0,0]=3 7881 B7R1.3 [NH3+]C1CCCCC1 Amb10552681 [1,0,0,1,0,0|1,0,0]=3 7882 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [1,0,0,1,0,0|1,0,0]=3 7883 B7R1.3 [SiH3]N1CCCCC1 Amb24565228 [1,0,0,1,0,0|2,0,0]=4 7884 B7R1.4 BrC1CCOC1Br Amb17673849 [1,0,0,1,0,0|2,0,0]=4 7885 B7R1.4 C=C1CCCC1O Amb25045562 [1,0,0,1,0,0|0,0,2]=4 7886 B7R1.4 C=C1CCC[C@@H]1O Amb24642468 [1,0,0,1,0,0|0,0,2]=4 7887 B7R1.4 C=C1COCC1O Amb24423437 [1,0,0,1,0,0|0,0,2]=4 7888 B7R1.4 CC1=CCCC1O Amb25220686 [1,0,0,1,0,0|0,0,2]=4 7889 B7R1.4 CC1=CCC[C@@H]1O Amb24506387 [1,0,0,1,0,0|0,0,2]=4 7890 B7R1.4 CC1CCC=C1C Amb24479857 [1,0,0,1,0,0|1,0,1]=4 7891 B7R1.4 CC1CCCC1=C Amb25066862 [1,0,0,1,0,0|1,0,1]=4 7892 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|1,0,0]=3 7893 B7R1.4 CC1CCCC1I Amb24658382 [1,0,0,1,0,0|1,0,0]=3 7894 B7R1.4 CC1CCCC1N Amb19373269 [1,0,0,1,0,0|1,0,0]=3 7895 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|0,0,0]=2 7896 B7R1.4 CC1CCCN1N Amb25068361 [1,0,0,1,0,0|2,0,0]=4 7897 B7R1.4 CC1CCCN1O Amb25221771 [1,0,0,1,0,0|1,0,0]=3 7898 B7R1.4 CC1CCN=C1C Amb24411616 [1,0,0,1,0,0|1,0,1]=4 7899 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,0]=3 7900 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,0]=3 7901 B7R1.4 CC1CNCC1Br Amb25232379 [1,0,0,1,0,0|2,0,0]=4 7902 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|2,0,0]=4 7903 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|2,0,0]=4 7904 B7R1.4 CC1CNCC1N Amb24070522 [1,0,0,1,0,0|2,0,0]=4 7905 B7R1.4 CC1CNCC1O Amb22886911 [1,0,0,1,0,0|1,0,0]=3 7906 B7R1.4 CC1CNCC1O Amb25792196 [1,0,0,1,0,0|1,0,0]=3 7907 B7R1.4 CC1COCC1=C Amb25830669 [1,0,0,1,0,0|1,0,1]=4 7908 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|0,0,2]=4 7909 B7R1.4 CC1CSCC1Cl Amb25377919 [1,0,0,1,0,0|1,1,0]=4 7910 B7R1.4 CC1CSCC1N Amb18202602 [1,0,0,1,0,0|1,1,0]=4 7911 B7R1.4 CC1CSCC1O Amb25694499 [1,0,0,1,0,0|0,1,0]=3 7912 B7R1.4 CC1CSCC1S Amb24386420 [1,0,0,1,0,0|0,2,0]=4 7913 B7R1.4 CC1OCCC1=C Amb25254786 [1,0,0,1,0,0|0,0,2]=4 7914 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,1,0,0|1,0,0]=3 7915 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,1,0,0|1,0,0]=3 7916 B7R1.4 CC1OCCC1I Amb25840995 [1,0,0,1,0,0|1,0,0]=3 7917 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|1,0,0]=3 7918 B7R1.4 CC1SCCC1N Amb20623835 [1,0,0,1,0,0|1,1,0]=4 7919 B7R1.4 CC1SCCC1O Amb20623836 [1,0,0,1,0,0|1,0,0]=3 7920 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [1,0,0,1,0,0|1,0,0]=3 7921 B7R1.4 CC1SCC[C@H]1O Amb20623837 [1,0,0,1,0,0|1,0,0]=3 7922 B7R1.4 CC1SCNC1C Amb25833302 [1,0,0,1,0,0|1,1,0]=4 7923 B7R1.4 CN1=NCCC1O Amb21952741 [1,0,0,1,0,0|2,0,0]=4 7924 B7R1.4 CN1CCCC1Br Amb24652845 [1,0,0,1,0,0|2,0,0]=4 7925 B7R1.4 CN1CCCC1O Amb24064861 [1,0,0,1,0,0|1,0,0]=3 7926 B7R1.4 CN1CCC[C@H]1O Amb25788080 [1,0,0,1,0,0|1,0,0]=3 7927 B7R1.4 C[C@@H]1CCC[C@@H]1C Amb22230410 [1,0,0,1,0,0|1,0,0]=3 7928 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|1,0,0]=3 7929 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|1,0,0]=3 7930 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|0,0,0]=2 7931 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|1,0,0]=3 7932 B7R1.4 C[C@@H]1CCC[C@H]1Cl Amb24597933 [1,0,0,1,0,0|1,0,0]=3 7933 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,0]=3 7934 B7R1.4 C[C@@H]1CCN[C@H]1C Amb24515067 [1,0,0,1,0,0|1,0,0]=3 7935 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|2,0,0]=4 7936 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb22886189 [1,0,0,1,0,0|2,0,0]=4 7937 B7R1.4 C[C@@H]1CNC[C@@H]1O Amb22886215 [1,0,0,1,0,0|1,0,0]=3 7938 B7R1.4 C[C@@H]1CNC[C@@H]1O Amb25784275 [1,0,0,1,0,0|1,0,0]=3 7939 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|2,0,0]=4 7940 B7R1.4 C[C@@H]1CNC[C@H]1C Amb24597585 [1,0,0,1,0,0|2,0,0]=4 7941 B7R1.4 C[C@@H]1CNC[C@H]1O Amb22886846 [1,0,0,1,0,0|1,0,0]=3 7942 B7R1.4 C[C@@H]1CNC[C@H]1O Amb25110287 [1,0,0,1,0,0|1,0,0]=3 7943 B7R1.4 C[C@@H]1COC[C@@H]1N Amb25766097 [1,0,0,1,0,0|1,0,0]=3 7944 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|0,0,0]=2 7945 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [1,0,0,1,0,0|1,0,0]=3 7946 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|0,0,0]=2 7947 B7R1.4 C[C@@H]1CSC[C@H]1N Amb25339505 [1,0,0,1,0,0|1,1,0]=4 7948 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [1,0,0,1,0,0|2,0,0]=4 7949 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [1,0,0,1,0,0|1,0,0]=3 7950 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [1,0,0,1,0,0|1,0,0]=3 7951 B7R1.4 C[C@@H]1NCN[C@H]1C Amb25367908 [1,0,0,1,0,0|2,0,0]=4 7952 B7R1.4 C[C@@H]1OCCC1=O Amb24728733 [1,0,0,1,0,0|1,0,1]=4 7953 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|1,0,0]=3 7954 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|1,0,0]=3 7955 B7R1.4 C[C@@H]1OCC[C@H]1O Amb24624737 [1,0,0,1,0,0|1,0,0]=3 7956 B7R1.4 C[C@@H]1SCC[C@@H]1N Amb25201157 [1,0,0,1,0,0|1,1,0]=4 7957 B7R1.4 C[C@@H]1SCC[C@H]1N Amb25265262 [1,0,0,1,0,0|1,1,0]=4 7958 B7R1.4 C[C@H]1C=CC[C@@H]1O Amb24630805 [1,0,0,1,0,0|0,0,2]=4 7959 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|1,0,0]=3 7960 B7R1.4 C[C@H]1CCC[C@H]1Br Amb24595359 [1,0,0,1,0,0|1,0,0]=3 7961 B7R1.4 C[C@H]1CCC[C@H]1Cl Amb24690084 [1,0,0,1,0,0|1,0,0]=3 7962 B7R1.4 C[C@H]1CNC[C@@H]1C Amb24567666 [1,0,0,1,0,0|2,0,0]=4 7963 B7R1.4 C[C@H]1CNC[C@@H]1N Amb24614981 [1,0,0,1,0,0|2,0,0]=4 7964 B7R1.4 C[C@H]1CNC[C@@H]1O Amb24587394 [1,0,0,1,0,0|1,0,0]=3 7965 B7R1.4 C[C@H]1CNC[C@H]1N Amb25174297 [1,0,0,1,0,0|2,0,0]=4 7966 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|0,0,0]=2 7967 B7R1.4 C[C@H]1NCC[C@H]1O Amb25810947 [1,0,0,1,0,0|1,0,0]=3 7968 B7R1.4 C[C@H]1OCCC1=O Amb25811510 [1,0,0,1,0,0|1,0,1]=4 7969 B7R1.4 C[C@H]1OCC[C@@H]1N Amb24515056 [1,0,0,1,0,0|1,0,0]=3 7970 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|1,0,0]=3 7971 B7R1.4 C[C@H]1SCC[C@H]1O Amb25025820 [1,0,0,1,0,0|1,0,0]=3 7972 B7R1.4 ClC1CCOC1Cl Amb22731370 [1,0,0,1,0,0|2,0,0]=4 7973 B7R1.4 ClC1COCC1Br Amb25258047 [1,0,0,1,0,0|2,0,0]=4 7974 B7R1.4 ClC1COCC1Cl Amb25250434 [1,0,0,1,0,0|2,0,0]=4 7975 B7R1.4 ClC1OCCC1Br Amb25798941 [1,0,0,1,0,0|2,0,0]=4 7976 B7R1.4 Cl[C@@H]1CCC[C@@H]1Cl Amb25296670 [1,0,0,1,0,0|2,0,0]=4 7977 B7R1.4 Cl[C@@H]1CCC[C@H]1Cl Amb22231649 [1,0,0,1,0,0|2,0,0]=4 7978 B7R1.4 Cl[C@@H]1COC[C@@H]1Cl Amb25145546 [1,0,0,1,0,0|2,0,0]=4 7979 B7R1.4 Cl[C@H]1CCC[C@@H]1Cl Amb24553810 [1,0,0,1,0,0|2,0,0]=4 7980 B7R1.4 F[C@@H]1CCC[C@H]1Br Amb24692923 [1,0,0,1,0,0|2,0,0]=4 7981 B7R1.4 F[C@@H]1CCC[C@H]1Cl Amb25274976 [1,0,0,1,0,0|2,0,0]=4 7982 B7R1.4 F[C@H]1CCC[C@H]1Br Amb25238330 [1,0,0,1,0,0|2,0,0]=4 7983 B7R1.4 NC1CCCC1Br Amb20667786 [1,0,0,1,0,0|2,0,0]=4 7984 B7R1.4 NC1CCCC1Br Amb24691577 [1,0,0,1,0,0|2,0,0]=4 7985 B7R1.4 NC1CCCC1F Amb23538754 [1,0,0,1,0,0|2,0,0]=4 7986 B7R1.4 NC1CCCC1N Amb18639642 [1,0,0,1,0,0|2,0,0]=4 7987 B7R1.4 NC1CCCC1S Amb18641940 [1,0,0,1,0,0|1,1,0]=4 7988 B7R1.4 NC1CNCC1O Amb22235661 [1,0,0,1,0,0|2,0,0]=4 7989 B7R1.4 NC1CNCC1O Amb22497199 [1,0,0,1,0,0|2,0,0]=4 7990 B7R1.4 NC1COCC1Br Amb24369528 [1,0,0,1,0,0|2,0,0]=4 7991 B7R1.4 NC1COCC1N Amb23590778 [1,0,0,1,0,0|2,0,0]=4 7992 B7R1.4 NC1COCC1O Amb18277417 [1,0,0,1,0,0|1,0,0]=3 7993 B7R1.4 NC1COCC1O Amb19515137 [1,0,0,1,0,0|1,0,0]=3 7994 B7R1.4 NC1CONC1O Amb24571000 [1,0,0,1,0,0|2,0,0]=4 7995 B7R1.4 N[C@@H]1CCCC1Cl Amb24710762 [1,0,0,1,0,0|2,0,0]=4 7996 B7R1.4 N[C@@H]1CCCC1O Amb24347806 [1,0,0,1,0,0|1,0,0]=3 7997 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb25174659 [1,0,0,1,0,0|2,0,0]=4 7998 B7R1.4 N[C@@H]1CCC[C@H]1Br Amb24612101 [1,0,0,1,0,0|2,0,0]=4 7999 B7R1.4 N[C@@H]1CCC[C@H]1N Amb16231433 [1,0,0,1,0,0|2,0,0]=4 8000 B7R1.4 N[C@@H]1CCC[C@H]1N Amb22748826 [1,0,0,1,0,0|2,0,0]=4 8001 B7R1.4 N[C@@H]1CNC[C@H]1O Amb24604330 [1,0,0,1,0,0|2,0,0]=4 8002 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [1,0,0,1,0,0|2,0,0]=4 8003 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [1,0,0,1,0,0|2,0,0]=4 8004 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [1,0,0,1,0,0|1,0,0]=3 8005 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [1,0,0,1,0,0|1,0,0]=3 8006 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [1,0,0,1,0,0|2,0,0]=4 8007 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [1,0,0,1,0,0|2,0,0]=4 8008 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [1,0,0,1,0,0|1,0,0]=3 8009 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [1,0,0,1,0,0|1,0,0]=3 8010 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [1,0,0,1,0,0|1,0,0]=3 8011 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [1,0,0,1,0,0|1,1,0]=4 8012 B7R1.4 N[C@H]1CCC[C@@H]1N Amb16231434 [1,0,0,1,0,0|2,0,0]=4 8013 B7R1.4 N[C@H]1CCC[C@H]1Cl Amb24578417 [1,0,0,1,0,0|2,0,0]=4 8014 B7R1.4 N[C@H]1CNC[C@@H]1O Amb25187848 [1,0,0,1,0,0|2,0,0]=4 8015 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [1,0,0,1,0,0|1,0,0]=3 8016 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [1,0,0,1,0,0|1,0,0]=3 8017 B7R1.4 N[C@H]1CONC1O Amb24332118 [1,0,0,1,0,0|2,0,0]=4 8018 B7R1.4 N[C@H]1CSC[C@H]1O Amb25324268 [1,0,0,1,0,0|1,1,0]=4 8019 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,1]=4 8020 B7R1.4 O=C1OCCC1C Amb16185414 [1,0,0,1,0,0|0,0,2]=4 8021 B7R1.4 OC1CCCC1F Amb25746323 [1,0,0,1,0,0|1,0,0]=3 8022 B7R1.4 OC1CCCC1N Amb13951342 [1,0,0,1,0,0|1,0,0]=3 8023 B7R1.4 OC1CCCC1O Amb17935884 [1,0,0,1,0,0|1,0,0]=3 8024 B7R1.4 OC1CCOC1Cl Amb25783977 [1,0,0,1,0,0|2,0,0]=4 8025 B7R1.4 OC1CNCC1F Amb24377167 [1,0,0,1,0,0|2,0,0]=4 8026 B7R1.4 OC1CNCC1O Amb18640019 [1,0,0,1,0,0|2,0,0]=4 8027 B7R1.4 OC1COCC1Br Amb25321008 [1,0,0,1,0,0|1,0,0]=3 8028 B7R1.4 OC1COCC1Cl Amb24479454 [1,0,0,1,0,0|1,0,0]=3 8029 B7R1.4 OC1COCC1I Amb24332672 [1,0,0,1,0,0|1,0,0]=3 8030 B7R1.4 OC1CSCC1O Amb17593233 [1,0,0,1,0,0|1,1,0]=4 8031 B7R1.4 OC1CSCC1S Amb24332120 [1,0,0,1,0,0|1,1,0]=4 8032 B7R1.4 OC1OCCC1F Amb22641467 [1,0,0,1,0,0|1,0,0]=3 8033 B7R1.4 O[C@@H]1CCCC1=O Amb25166028 [1,0,0,1,0,0|1,0,1]=4 8034 B7R1.4 O[C@@H]1CCC[C@@H]1Br Amb24470331 [1,0,0,1,0,0|1,0,0]=3 8035 B7R1.4 O[C@@H]1CCC[C@@H]1N Amb10603107 [1,0,0,1,0,0|1,0,0]=3 8036 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb17938993 [1,0,0,1,0,0|1,0,0]=3 8037 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993811 [1,0,0,1,0,0|1,0,0]=3 8038 B7R1.4 O[C@@H]1CCC[C@H]1N Amb1993922 [1,0,0,1,0,0|1,0,0]=3 8039 B7R1.4 O[C@@H]1CCC[C@H]1O Amb22224803 [1,0,0,1,0,0|1,0,0]=3 8040 B7R1.4 O[C@@H]1CCC[C@H]1O Amb22224833 [1,0,0,1,0,0|1,0,0]=3 8041 B7R1.4 O[C@@H]1CCOC1O Amb25769388 [1,0,0,1,0,0|1,0,0]=3 8042 B7R1.4 O[C@@H]1CCO[C@H]1O Amb24618710 [1,0,0,1,0,0|1,0,0]=3 8043 B7R1.4 O[C@@H]1CNC[C@@H]1F Amb22886226 [1,0,0,1,0,0|2,0,0]=4 8044 B7R1.4 O[C@@H]1CNC[C@@H]1F Amb24714910 [1,0,0,1,0,0|2,0,0]=4 8045 B7R1.4 O[C@@H]1CNC[C@@H]1O Amb22406184 [1,0,0,1,0,0|2,0,0]=4 8046 B7R1.4 O[C@@H]1CNC[C@H]1F Amb22406204 [1,0,0,1,0,0|2,0,0]=4 8047 B7R1.4 O[C@@H]1CNC[C@H]1F Amb22757855 [1,0,0,1,0,0|2,0,0]=4 8048 B7R1.4 O[C@@H]1CNC[C@H]1O Amb22746349 [1,0,0,1,0,0|2,0,0]=4 8049 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [1,0,0,1,0,0|1,0,0]=3 8050 B7R1.4 O[C@@H]1COC[C@@H]1O Amb22406017 [1,0,0,1,0,0|1,0,0]=3 8051 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [1,0,0,1,0,0|1,0,0]=3 8052 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [1,0,0,1,0,0|1,0,0]=3 8053 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [1,0,0,1,0,0|1,0,0]=3 8054 B7R1.4 O[C@@H]1CSC[C@H]1N Amb1099355 [1,0,0,1,0,0|1,1,0]=4 8055 B7R1.4 O[C@H]1CCC[C@@H]1Br Amb25373943 [1,0,0,1,0,0|1,0,0]=3 8056 B7R1.4 O[C@H]1CCC[C@@H]1C Amb10844719 [1,0,0,1,0,0|0,0,0]=2 8057 B7R1.4 O[C@H]1CCC[C@@H]1F Amb24612635 [1,0,0,1,0,0|1,0,0]=3 8058 B7R1.4 O[C@H]1CCC[C@@H]1N Amb10604100 [1,0,0,1,0,0|1,0,0]=3 8059 B7R1.4 O[C@H]1CCC[C@@H]1O Amb22350708 [1,0,0,1,0,0|1,0,0]=3 8060 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993810 [1,0,0,1,0,0|1,0,0]=3 8061 B7R1.4 O[C@H]1CCC[C@H]1N Amb1993921 [1,0,0,1,0,0|1,0,0]=3 8062 B7R1.4 O[C@H]1CCC[C@H]1S Amb24749619 [1,0,0,1,0,0|1,0,0]=3 8063 B7R1.4 O[C@H]1CCO[C@H]1O Amb25025810 [1,0,0,1,0,0|1,0,0]=3 8064 B7R1.4 O[C@H]1CNC[C@@H]1O Amb23385333 [1,0,0,1,0,0|2,0,0]=4 8065 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [1,0,0,1,0,0|1,0,0]=3 8066 B7R1.4 O[C@H]1COC[C@@H]1F Amb25168929 [1,0,0,1,0,0|1,0,0]=3 8067 B7R1.4 O[C@H]1COC[C@@H]1N Amb10608341 [1,0,0,1,0,0|1,0,0]=3 8068 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [1,0,0,1,0,0|1,0,0]=3 8069 B7R1.4 O[C@H]1COC[C@H]1Cl Amb25321006 [1,0,0,1,0,0|1,0,0]=3 8070 B7R1.4 O[C@H]1CSC[C@H]1S Amb25176867 [1,0,0,1,0,0|1,1,0]=4 8071 B7R1.4 O[C@H]1OCC[C@@H]1Cl Amb25232988 [1,0,0,1,0,0|1,0,0]=3 8072 B7R1.4 SC1CCCC1Cl Amb24558650 [1,0,0,1,0,0|1,1,0]=4 8073 B7R1.4 SC1CCCC1O Amb17593219 [1,0,0,1,0,0|1,0,0]=3 8074 B7R1.4 S[C@H]1CCC[C@H]1Cl Amb25235093 [1,0,0,1,0,0|1,1,0]=4 8075 B7R1.5 C=C1CC1CCO Amb25251181 [1,0,0,1,0,0|0,0,2]=4 8076 B7R1.5 C=CC[C@@H]1C[C@H]1O Amb25215350 [1,0,0,1,0,0|0,0,2]=4 8077 B7R1.5 CC1CC1=CCO Amb24386982 [1,0,0,1,0,0|0,0,2]=4 8078 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,2]=4 8079 B7R1.5 CC1CC1CCC Amb24699677 [1,0,0,1,0,0|1,0,0]=3 8080 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,0]=2 8081 B7R1.5 CC1CC1NCC Amb18961500 [1,0,0,1,0,0|1,0,0]=3 8082 B7R1.5 CC1NN1CCO Amb25173823 [1,0,0,1,0,0|2,0,0]=4 8083 B7R1.5 CC1OC1CC#N Amb16233004 [1,0,0,1,0,0|1,0,1]=4 8084 B7R1.5 CC1OC1CCBr Amb24479229 [1,0,0,1,0,0|1,0,0]=3 8085 B7R1.5 CC1OC1CCI Amb25137116 [1,0,0,1,0,0|1,0,0]=3 8086 B7R1.5 CC1OC1CCO Amb24471660 [1,0,0,1,0,0|1,0,0]=3 8087 B7R1.5 CC1O[C@@H]1CCCl Amb24478558 [1,0,0,1,0,0|1,0,0]=3 8088 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|1,0,0]=3 8089 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|1,0,0]=3 8090 B7R1.5 CCCC1CC1O Amb25811022 [1,0,0,1,0,0|0,0,0]=2 8091 B7R1.5 CCCC1ON1C Amb22232363 [1,0,0,1,0,0|1,0,0]=3 8092 B7R1.5 CCC[C@H]1C[C@@H]1Cl Amb25176030 [1,0,0,1,0,0|1,0,0]=3 8093 B7R1.5 CCOC1CC1Br Amb24650022 [1,0,0,1,0,0|1,0,0]=3 8094 B7R1.5 CCOC1CC1N Amb19515720 [1,0,0,1,0,0|1,0,0]=3 8095 B7R1.5 CCO[C@@H]1C[C@H]1Br Amb25362288 [1,0,0,1,0,0|1,0,0]=3 8096 B7R1.5 COC[C@@H]1C[C@@H]1N Amb24693326 [1,0,0,1,0,0|2,0,0]=4 8097 B7R1.5 COC[C@H]1C[C@H]1N Amb24100234 [1,0,0,1,0,0|2,0,0]=4 8098 B7R1.5 C[C@@H]1C[C@@H]1CCC Amb24544739 [1,0,0,1,0,0|1,0,0]=3 8099 B7R1.5 C[C@@H]1C[C@H]1CCO Amb24593150 [1,0,0,1,0,0|0,0,0]=2 8100 B7R1.5 C[C@@H]1O[C@@H]1CCBr Amb25216935 [1,0,0,1,0,0|1,0,0]=3 8101 B7R1.5 C[C@@H]1O[C@@H]1CCO Amb25176735 [1,0,0,1,0,0|1,0,0]=3 8102 B7R1.5 C[C@H]1C[C@H]1CCBr Amb24587326 [1,0,0,1,0,0|1,0,0]=3 8103 B7R1.5 C[C@H]1C[C@H]1CCC Amb25302063 [1,0,0,1,0,0|1,0,0]=3 8104 B7R1.5 C[C@H]1C[C@H]1CCO Amb25810215 [1,0,0,1,0,0|0,0,0]=2 8105 B7R1.5 C[C@H]1O[C@@H]1CCO Amb25226333 [1,0,0,1,0,0|1,0,0]=3 8106 B7R1.5 C[C@H]1O[C@H]1CCO Amb25025230 [1,0,0,1,0,0|1,0,0]=3 8107 B7R1.5 NNCC1CC1C Amb10610283 [1,0,0,1,0,0|2,0,0]=4 8108 B7R1.5 N[C@H]1C[C@@H]1CCO Amb24681172 [1,0,0,1,0,0|1,0,0]=3 8109 B7R1.5 N[C@H]1C[C@H]1CCO Amb24562303 [1,0,0,1,0,0|1,0,0]=3 8110 B7R1.6 BrCCC1CNC1 Amb24480690 [1,0,0,1,0,0|2,0,0]=4 8111 B7R1.6 BrCCC1CSC1 Amb25228072 [1,0,0,1,0,0|2,0,0]=4 8112 B7R1.6 BrCCN1CCC1 Amb25830678 [1,0,0,1,0,0|2,0,0]=4 8113 B7R1.6 CCCC1CCN1 Amb24504364 [1,0,0,1,0,0|1,0,0]=3 8114 B7R1.6 CCCC1CNC1 Amb25297768 [1,0,0,1,0,0|2,0,0]=4 8115 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|1,0,0]=3 8116 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|1,0,0]=3 8117 B7R1.6 CCNC1CNC1 Amb24619347 [1,0,0,1,0,0|2,0,0]=4 8118 B7R1.6 CCNC1COC1 Amb22406248 [1,0,0,1,0,0|2,0,0]=4 8119 B7R1.6 CCNC1COC1 Amb22736884 [1,0,0,1,0,0|2,0,0]=4 8120 B7R1.6 CCOC1CNC1 Amb18523751 [1,0,0,1,0,0|1,0,0]=3 8121 B7R1.6 CCOC1CNC1 Amb19889815 [1,0,0,1,0,0|1,0,0]=3 8122 B7R1.6 CCSC1CNC1 Amb22395437 [1,0,0,1,0,0|1,1,0]=4 8123 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|2,0,0]=4 8124 B7R1.6 CNCC1CCN1 Amb24651166 [1,0,0,1,0,0|2,0,0]=4 8125 B7R1.6 COCC1CCN1 Amb23439866 [1,0,0,1,0,0|2,0,0]=4 8126 B7R1.6 COC[C@@H]1CCN1 Amb22757160 [1,0,0,1,0,0|2,0,0]=4 8127 B7R1.6 COC[C@@H]1CCN1 Amb23440214 [1,0,0,1,0,0|2,0,0]=4 8128 B7R1.6 COC[C@H]1CCN1 Amb25808228 [1,0,0,1,0,0|2,0,0]=4 8129 B7R1.6 CONC1CCC1 Amb22897036 [1,0,0,1,0,0|2,0,0]=4 8130 B7R1.6 CSCC1CCC1 Amb24613430 [1,0,0,1,0,0|2,0,0]=4 8131 B7R1.6 ClCCC1COC1 Amb25769308 [1,0,0,1,0,0|2,0,0]=4 8132 B7R1.6 ClCCN1CCC1 Amb10069966 [1,0,0,1,0,0|2,0,0]=4 8133 B7R1.6 FCCC1CCN1 Amb25377475 [1,0,0,1,0,0|2,0,0]=4 8134 B7R1.6 ICCC1CCC1 Amb25291483 [1,0,0,1,0,0|1,0,0]=3 8135 B7R1.6 ICCC1COC1 Amb25207110 [1,0,0,1,0,0|2,0,0]=4 8136 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,0]=3 8137 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,0]=3 8138 B7R1.6 NCCC1COC1 Amb21864698 [1,0,0,1,0,0|2,0,0]=4 8139 B7R1.6 NCCC1COC1 Amb22896746 [1,0,0,1,0,0|2,0,0]=4 8140 B7R1.6 NCCN1CCC1 Amb20622304 [1,0,0,1,0,0|2,0,0]=4 8141 B7R1.6 NNCC1CCC1 Amb19893039 [1,0,0,1,0,0|2,0,0]=4 8142 B7R1.6 NNCC1CCO1 Amb24708419 [1,0,0,1,0,0|2,0,0]=4 8143 B7R1.6 NOCC1CCC1 Amb22896602 [1,0,0,1,0,0|2,0,0]=4 8144 B7R1.6 O=CCC1CCC1 Amb22002603 [1,0,0,1,0,0|0,0,2]=4 8145 B7R1.6 OCCC1CC=C1 Amb25271839 [1,0,0,1,0,0|0,0,2]=4 8146 B7R1.6 OCCC1CCC1 Amb22371147 [1,0,0,1,0,0|0,0,0]=2 8147 B7R1.6 OCCC1CCN1 Amb25350591 [1,0,0,1,0,0|1,0,0]=3 8148 B7R1.6 OCCC1CCO1 Amb25780445 [1,0,0,1,0,0|1,0,0]=3 8149 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|1,0,0]=3 8150 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|1,0,0]=3 8151 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|1,0,0]=3 8152 B7R1.6 OCCN1CCC1 Amb22002602 [1,0,0,1,0,0|1,0,0]=3 8153 B7R1.6 OCC[C@@H]1CCN1 Amb24479867 [1,0,0,1,0,0|1,0,0]=3 8154 B7R1.6 OCC[C@H]1CCO1 Amb25129832 [1,0,0,1,0,0|1,0,0]=3 8155 B7R1.6 OCNC1CCC1 Amb24670261 [1,0,0,1,0,0|1,0,0]=3 8156 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,0]=3 8157 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|1,0,0]=3 8158 B7R1.7 BrCCC[C@@H]1CO1 Amb25073870 [1,0,0,1,0,0|1,0,0]=3 8159 B7R1.7 BrCCC[C@H]1CO1 Amb24441393 [1,0,0,1,0,0|1,0,0]=3 8160 B7R1.7 BrCCNC1CC1 Amb25308141 [1,0,0,1,0,0|2,0,0]=4 8161 B7R1.7 C#CCCC1CO1 Amb10606899 [1,0,0,1,0,0|0,0,2]=4 8162 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [1,0,0,1,0,0|0,0,2]=4 8163 B7R1.7 C=COCC1CC1 Amb25025455 [1,0,0,1,0,0|0,0,2]=4 8164 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|0,0,0]=2 8165 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|0,0,0]=2 8166 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|0,0,0]=2 8167 B7R1.7 CCCNC1CC1 Amb1135100 [1,0,0,1,0,0|2,0,0]=4 8168 B7R1.7 CCOCC1CC1 Amb25066918 [1,0,0,1,0,0|0,0,0]=2 8169 B7R1.7 CCOCC1CO1 Amb1133334 [1,0,0,1,0,0|1,0,0]=3 8170 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [1,0,0,1,0,0|1,0,0]=3 8171 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [1,0,0,1,0,0|1,0,0]=3 8172 B7R1.7 CNCCC1CC1 Amb18979588 [1,0,0,1,0,0|2,0,0]=4 8173 B7R1.7 CNCCC1CC1 Amb20667659 [1,0,0,1,0,0|2,0,0]=4 8174 B7R1.7 CNOCC1CC1 Amb25216135 [1,0,0,1,0,0|1,0,0]=3 8175 B7R1.7 CONCC1CC1 Amb22896989 [1,0,0,1,0,0|2,0,0]=4 8176 B7R1.7 CSCCC1CO1 Amb25241000 [1,0,0,1,0,0|1,0,0]=3 8177 B7R1.7 C\C=C\CC1CO1 Amb25285825 [1,0,0,1,0,0|0,0,2]=4 8178 B7R1.7 ClCCCC1CO1 Amb24093915 [1,0,0,1,0,0|1,0,0]=3 8179 B7R1.7 ClCCNC1CC1 Amb17334071 [1,0,0,1,0,0|2,0,0]=4 8180 B7R1.7 ClCCOC1CC1 Amb10603117 [1,0,0,1,0,0|1,0,0]=3 8181 B7R1.7 ClCOCC1CC1 Amb25077257 [1,0,0,1,0,0|1,0,0]=3 8182 B7R1.7 FCCNC1CC1 Amb25790936 [1,0,0,1,0,0|2,0,0]=4 8183 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|1,0,0]=3 8184 B7R1.7 NCCCC1CC1 Amb19374503 [1,0,0,1,0,0|1,0,0]=3 8185 B7R1.7 NCCNC1CC1 Amb13951961 [1,0,0,1,0,0|2,0,0]=4 8186 B7R1.7 NCCSC1CC1 Amb25810119 [1,0,0,1,0,0|1,1,0]=4 8187 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,2]=4 8188 B7R1.7 O=CCCC1CO1 Amb25054703 [1,0,0,1,0,0|1,0,1]=4 8189 B7R1.7 OCC#CC1CC1 Amb25773951 [1,0,0,1,0,0|0,0,2]=4 8190 B7R1.7 OCCC=C1CC1 Amb24680927 [1,0,0,1,0,0|0,0,2]=4 8191 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|0,0,0]=2 8192 B7R1.7 OCCC[C@H]1CO1 Amb24661078 [1,0,0,1,0,0|1,0,0]=3 8193 B7R1.7 OCCSC1CC1 Amb25167463 [1,0,0,1,0,0|0,1,0]=3 8194 B7R1.7 ON=CCC1CC1 Amb24627412 [1,0,0,1,0,0|1,0,1]=4 8195 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|0,0,2]=4 8196 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,0]=3 8197 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,0]=2 8198 B7R1.8 CC1CCC1NC Amb25790859 [1,0,0,1,0,0|2,0,0]=4 8199 B7R1.8 CC1CNC1CO Amb25310037 [1,0,0,1,0,0|1,0,0]=3 8200 B7R1.8 CC1COC1CC Amb25024514 [1,0,0,1,0,0|1,0,0]=3 8201 B7R1.8 CC1COC1CI Amb24445415 [1,0,0,1,0,0|1,0,0]=3 8202 B7R1.8 CCC1CSC1O Amb25681482 [1,0,0,1,0,0|0,1,0]=3 8203 B7R1.8 CCC1NCC1N Amb25116264 [1,0,0,1,0,0|2,0,0]=4 8204 B7R1.8 CCC1OCC1=O Amb23456089 [1,0,0,1,0,0|0,0,2]=4 8205 B7R1.8 CC[C@@H]1NC[C@@H]1N Amb25102070 [1,0,0,1,0,0|2,0,0]=4 8206 B7R1.8 CN1CCC1CN Amb25108789 [1,0,0,1,0,0|2,0,0]=4 8207 B7R1.8 CN1CC[C@@H]1CN Amb25701112 [1,0,0,1,0,0|2,0,0]=4 8208 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|1,0,0]=3 8209 B7R1.8 CN1CC[C@H]1CN Amb25216747 [1,0,0,1,0,0|2,0,0]=4 8210 B7R1.8 CNC1CCC1O Amb24741053 [1,0,0,1,0,0|1,0,0]=3 8211 B7R1.8 CN[C@@H]1CC[C@H]1O Amb25224473 [1,0,0,1,0,0|1,0,0]=3 8212 B7R1.8 CO[C@@H]1CC[C@H]1N Amb25026007 [1,0,0,1,0,0|2,0,0]=4 8213 B7R1.8 CSC1CCC1N Amb25743480 [1,0,0,1,0,0|2,0,0]=4 8214 B7R1.8 C[C@@H]1CC[C@@H]1CCl Amb24514841 [1,0,0,1,0,0|1,0,0]=3 8215 B7R1.8 C[C@@H]1CC[C@H]1CO Amb24520389 [1,0,0,1,0,0|0,0,0]=2 8216 B7R1.8 C[C@@H]1CN[C@@H]1CO Amb25230021 [1,0,0,1,0,0|1,0,0]=3 8217 B7R1.8 C[C@H]1CC[C@H]1C=O Amb25373249 [1,0,0,1,0,0|0,0,2]=4 8218 B7R1.8 C[C@H]1CC[C@H]1CI Amb24519631 [1,0,0,1,0,0|1,0,0]=3 8219 B7R1.8 N#CC1CCC1O Amb24675300 [1,0,0,1,0,0|1,0,1]=4 8220 B7R1.8 NC1CCC1CBr Amb24652725 [1,0,0,1,0,0|2,0,0]=4 8221 B7R1.8 NC1CCC1CO Amb24375248 [1,0,0,1,0,0|1,0,0]=3 8222 B7R1.8 NC1CC[C@H]1CBr Amb25200011 [1,0,0,1,0,0|2,0,0]=4 8223 B7R1.8 NC1COC1CO Amb25745669 [1,0,0,1,0,0|1,0,0]=3 8224 B7R1.8 NCC1CCC1S Amb25122796 [1,0,0,1,0,0|1,1,0]=4 8225 B7R1.8 NC[C@@H]1CC[C@@H]1S Amb25214682 [1,0,0,1,0,0|1,1,0]=4 8226 B7R1.8 N[C@@H]1CC[C@@H]1CO Amb25782608 [1,0,0,1,0,0|1,0,0]=3 8227 B7R1.8 N[C@@H]1CC[C@H]1CO Amb25025452 [1,0,0,1,0,0|1,0,0]=3 8228 B7R1.8 N[C@H]1CC[C@H]1CO Amb25327109 [1,0,0,1,0,0|1,0,0]=3 8229 B7R1.8 OC1CNC1CO Amb25276544 [1,0,0,1,0,0|2,0,0]=4 8230 B7R1.8 OC1CSC1CO Amb25044422 [1,0,0,1,0,0|1,1,0]=4 8231 B7R1.8 OCC1CCC1=O Amb24722181 [1,0,0,1,0,0|1,0,1]=4 8232 B7R1.8 O[C@@H]1CC[C@@H]1CO Amb25662759 [1,0,0,1,0,0|1,0,0]=3 8233 B7R1.8 O[C@@H]1CN[C@H]1CO Amb25663178 [1,0,0,1,0,0|2,0,0]=4 8234 B7R1.9 C#C[C@@H]1O[C@H]1CO Amb25215851 [1,0,0,1,0,0|0,0,2]=4 8235 B7R1.9 C#C[C@H]1O[C@@H]1CO Amb24680253 [1,0,0,1,0,0|0,0,2]=4 8236 B7R1.9 C#C[C@H]1O[C@H]1CO Amb25811466 [1,0,0,1,0,0|0,0,2]=4 8237 B7R1.9 C=C[C@H]1C[C@@H]1CO Amb25176489 [1,0,0,1,0,0|0,0,2]=4 8238 B7R1.9 C=C[C@H]1C[C@H]1CO Amb24519860 [1,0,0,1,0,0|0,0,2]=4 8239 B7R1.9 CCC1=CC1CO Amb24592765 [1,0,0,1,0,0|0,0,2]=4 8240 B7R1.9 CCC1CC1C=O Amb24435958 [1,0,0,1,0,0|0,0,2]=4 8241 B7R1.9 CCC1CC1CCl Amb25278342 [1,0,0,1,0,0|1,0,0]=3 8242 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,0]=3 8243 B7R1.9 CCC1CC1NC Amb24480727 [1,0,0,1,0,0|2,0,0]=4 8244 B7R1.9 CCC1OC1C=O Amb25292367 [1,0,0,1,0,0|0,0,2]=4 8245 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,0]=2 8246 B7R1.9 CC[C@@H]1C[C@H]1C=O Amb24603090 [1,0,0,1,0,0|0,0,2]=4 8247 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,0]=3 8248 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,0]=2 8249 B7R1.9 CC[C@H]1C[C@@H]1CO Amb25215336 [1,0,0,1,0,0|0,0,0]=2 8250 B7R1.9 CC[C@H]1C[C@H]1C=O Amb25366612 [1,0,0,1,0,0|0,0,2]=4 8251 B7R1.9 CC[C@H]1O[C@@H]1C=O Amb24627851 [1,0,0,1,0,0|0,0,2]=4 8252 B7R1.9 CC[C@H]1O[C@@H]1CO Amb25213716 [1,0,0,1,0,0|0,0,0]=2 8253 B7R1.9 CC[C@H]1O[C@H]1CBr Amb24584697 [1,0,0,1,0,0|1,0,0]=3 8254 B7R1.9 CC[C@H]1O[C@H]1CO Amb24715828 [1,0,0,1,0,0|0,0,0]=2 8255 B7R1.9 CN[C@@H]1C[C@@H]1CO Amb24551057 [1,0,0,1,0,0|1,0,0]=3 8256 B7R1.9 ClCC1OC1CCl Amb24349733 [1,0,0,1,0,0|2,0,0]=4 8257 B7R1.9 ClCC1O[C@H]1CCl Amb24647116 [1,0,0,1,0,0|2,0,0]=4 8258 B7R1.9 ClC[C@@H]1C[C@@H]1CCl Amb24117131 [1,0,0,1,0,0|2,0,0]=4 8259 B7R1.9 ClC[C@H]1C[C@@H]1CCl Amb25312727 [1,0,0,1,0,0|2,0,0]=4 8260 B7R1.9 N#CC1CC1CO Amb22755200 [1,0,0,1,0,0|1,0,1]=4 8261 B7R1.9 NCC1CC1CN Amb25108261 [1,0,0,1,0,0|2,0,0]=4 8262 B7R1.9 NCC1CC1CO Amb22499310 [1,0,0,1,0,0|1,0,0]=3 8263 B7R1.9 NC[C@@H]1C[C@@H]1CN Amb24436461 [1,0,0,1,0,0|2,0,0]=4 8264 B7R1.9 NC[C@@H]1C[C@@H]1CO Amb22746714 [1,0,0,1,0,0|1,0,0]=3 8265 B7R1.9 NC[C@@H]1C[C@H]1CN Amb25026692 [1,0,0,1,0,0|2,0,0]=4 8266 B7R1.9 NC[C@@H]1C[C@H]1CO Amb22746972 [1,0,0,1,0,0|1,0,0]=3 8267 B7R1.9 NC[C@H]1C[C@@H]1CO Amb22224716 [1,0,0,1,0,0|1,0,0]=3 8268 B7R1.9 NC[C@H]1C[C@H]1CO Amb25217566 [1,0,0,1,0,0|1,0,0]=3 8269 B7R1.9 OCC1CC1C=O Amb25726392 [1,0,0,1,0,0|1,0,1]=4 8270 B7R1.9 OCC1CC1CF Amb25129076 [1,0,0,1,0,0|1,0,0]=3 8271 B7R1.9 OCC1O[C@H]1CO Amb25344954 [1,0,0,1,0,0|1,0,0]=3 8272 B7R1.9 OCC1SC1CS Amb25716432 [1,0,0,1,0,0|1,1,0]=4 8273 B7R1.9 OC[C@@H]1C[C@H]1CO Amb25333423 [1,0,0,1,0,0|1,0,0]=3 8274 B7R1.9 OC[C@@H]1O[C@H]1CCl Amb24670409 [1,0,0,1,0,0|1,0,0]=3 8275 B7R1.9 OC[C@H]1C[C@@H]1CF Amb25235989 [1,0,0,1,0,0|1,0,0]=3 8276 B7R1.9 OC[C@H]1C[C@@H]1CO Amb24738177 [1,0,0,1,0,0|1,0,0]=3 8277 B7R1.9 SCC1OC1CS Amb24060962 [1,0,0,1,0,0|1,1,0]=4 8278 B7R1.24 C1C=CCCCO1 Amb22490272 [1,0,0,1,0,0|0,0,2]=4 8279 B7R1.24 C1C=COCCO1 Amb25096349 [1,0,0,1,0,0|0,0,2]=4 8280 B7R1.24 C1CC=CCCO1 Amb22490271 [1,0,0,1,0,0|0,0,2]=4 8281 B7R1.24 C1CCCCCO1 Amb22045221 [1,0,0,1,0,0|0,0,0]=2 8282 B7R1.24 C1CCCCNN1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 8283 B7R1.24 C1CCCCON1 Amb25025475 [1,0,0,1,0,0|1,0,0]=3 8284 B7R1.24 C1CCCCSC1 Amb17620604 [1,0,0,1,0,0|0,1,0]=3 8285 B7R1.24 C1CCCC[NH2+]C1 Amb10552679 [1,0,0,1,0,0|1,0,0]=3 8286 B7R1.24 C1CCOCCN1 Amb19889085 [1,0,0,1,0,0|1,0,0]=3 8287 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|1,1,0]=4 8288 B7R1.24 C1CNNCCO1 Amb18559514 [1,0,0,1,0,0|2,0,0]=4 8289 B7R1.24 C1CNNCCO1 Amb22728775 [1,0,0,1,0,0|2,0,0]=4 8290 B7R1.24 C1CNNCCO1 Amb22739935 [1,0,0,1,0,0|2,0,0]=4 8291 B7R1.24 C1CNNCCO1 Amb22739942 [1,0,0,1,0,0|2,0,0]=4 8292 B7R1.24 C1CNOCCN1 Amb24637039 [1,0,0,1,0,0|2,0,0]=4 8293 B7R1.24 C1NCCCCN1 Amb24426822 [1,0,0,1,0,0|2,0,0]=4 8294 B7R1.24 C1OCCCCO1 Amb22731870 [1,0,0,1,0,0|0,0,0]=2 8295 B7R1.24 C1SCCCCS1 Amb22227736 [1,0,0,1,0,0|0,2,0]=4 8296 B7R1.24 O1CCSSCC1 Amb10565588 [1,0,0,1,0,0|1,1,0]=4 8297 B9R1.2 C#CC1CCCC(O)O1 Amb24387759 [0,1,0,1,0,0|1,0,1]=4 8298 B9R1.2 C=C1CC(CO)NCC1 Amb25219592 [0,1,0,1,0,0|1,0,1]=4 8299 B9R1.2 C=CC1CCCC(O)O1 Amb24355182 [0,1,0,1,0,0|1,0,1]=4 8300 B9R1.2 C=C[C@@H]1CCC[C@@H](O)O1 Amb24735133 [0,1,0,1,0,0|1,0,1]=4 8301 B9R1.2 CC1CC(C=O)OCC1 Amb25032291 [0,1,0,1,0,0|0,0,2]=4 8302 B9R1.2 CC1CC(CBr)CCC1 Amb22059638 [0,1,0,1,0,0|2,0,0]=4 8303 B9R1.2 CC1CC(CCO1)CO Amb24679585 [0,1,0,1,0,0|2,0,0]=4 8304 B9R1.2 CC1CC(CN)NCC1 Amb25851909 [0,1,0,1,0,0|2,0,0]=4 8305 B9R1.2 CC1CC(CNC1)CO Amb24554370 [0,1,0,1,0,0|2,0,0]=4 8306 B9R1.2 CC1CC(CO)CCC1 Amb20248640 [0,1,0,1,0,0|1,0,0]=3 8307 B9R1.2 CC1CC(CO)NCC1 Amb24571948 [0,1,0,1,0,0|1,0,0]=3 8308 B9R1.2 CC1CC(CO)OCC1 Amb24412052 [0,1,0,1,0,0|0,0,0]=2 8309 B9R1.2 CC1CC(CO)OCO1 Amb24520489 [0,1,0,1,0,0|1,0,0]=3 8310 B9R1.2 CC1CCCC(CC)N1 Amb25146110 [0,1,0,1,0,0|2,0,0]=4 8311 B9R1.2 CC1CCCC(CF)N1 Amb25768224 [0,1,0,1,0,0|2,0,0]=4 8312 B9R1.2 CC1CCCC(CO)=C1 Amb25811041 [0,1,0,1,0,0|1,0,1]=4 8313 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [0,1,0,1,0,0|1,0,0]=3 8314 B9R1.2 CC1CCCC(CO)O1 Amb25085302 [0,1,0,1,0,0|0,0,0]=2 8315 B9R1.2 CC1CCOC(C#C)O1 Amb24682901 [0,1,0,1,0,0|1,0,1]=4 8316 B9R1.2 CC1CCOC(C1)NC Amb24666173 [0,1,0,1,0,0|2,0,0]=4 8317 B9R1.2 CC1CCOC(CBr)O1 Amb25684844 [0,1,0,1,0,0|1,0,0]=3 8318 B9R1.2 CC1CCSC(CC)N1 Amb24532853 [0,1,0,1,0,0|1,1,0]=4 8319 B9R1.2 CC1CNCC(C1)CC Amb24477764 [0,1,0,1,0,0|2,0,0]=4 8320 B9R1.2 CC1CNCC(CO)O1 Amb25139435 [0,1,0,1,0,0|1,0,0]=3 8321 B9R1.2 CC1COCC(CC)N1 Amb18063152 [0,1,0,1,0,0|1,0,0]=3 8322 B9R1.2 CC1COCC(CO)O1 Amb25686099 [0,1,0,1,0,0|1,0,0]=3 8323 B9R1.2 CC1COCC(CS)N1 Amb24523149 [0,1,0,1,0,0|2,0,0]=4 8324 B9R1.2 CC1OC(CO)CCO1 Amb24619171 [0,1,0,1,0,0|1,0,0]=3 8325 B9R1.2 CC1O[C@H](CO)CCO1 Amb25052164 [0,1,0,1,0,0|1,0,0]=3 8326 B9R1.2 CCC1CC(=C)CCC1 Amb24420328 [0,1,0,1,0,0|2,0,0]=4 8327 B9R1.2 CCC1CC(=O)CCC1 Amb19335038 [0,1,0,1,0,0|2,0,0]=4 8328 B9R1.2 CCC1CC(=O)CCN1 Amb22228813 [0,1,0,1,0,0|2,0,0]=4 8329 B9R1.2 CCC1CC(=O)CCN1 Amb24589388 [0,1,0,1,0,0|2,0,0]=4 8330 B9R1.2 CCC1CC(=O)CCO1 Amb19373926 [0,1,0,1,0,0|1,0,0]=3 8331 B9R1.2 CCC1CC(Br)CCO1 Amb24432480 [0,1,0,1,0,0|1,0,0]=3 8332 B9R1.2 CCC1CC(N)CCN1 Amb25320367 [0,1,0,1,0,0|2,0,0]=4 8333 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|1,0,0]=3 8334 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|1,0,0]=3 8335 B9R1.2 CCC1CC(O)CCS1 Amb24464826 [0,1,0,1,0,0|1,1,0]=4 8336 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|1,0,0]=3 8337 B9R1.2 CCC1CCCC(Br)C1 Amb25793528 [0,1,0,1,0,0|2,0,0]=4 8338 B9R1.2 CCC1CCCC(C1)O Amb17593352 [0,1,0,1,0,0|1,0,0]=3 8339 B9R1.2 CCC1CCCC(Cl)C1 Amb24737995 [0,1,0,1,0,0|2,0,0]=4 8340 B9R1.2 CCC1CCCC(N)C1 Amb19374220 [0,1,0,1,0,0|2,0,0]=4 8341 B9R1.2 CCC1CCCC(O)O1 Amb25220248 [0,1,0,1,0,0|1,0,0]=3 8342 B9R1.2 CCC1CN(C)CCN1 Amb18832590 [0,1,0,1,0,0|2,0,0]=4 8343 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,1,0,0|0,0,2]=4 8344 B9R1.2 CCC=1CCC[C@H](O)C1 Amb25207396 [0,1,0,1,0,0|1,0,1]=4 8345 B9R1.2 CC[C@@H]1CC(=O)CCC1 Amb25373198 [0,1,0,1,0,0|2,0,0]=4 8346 B9R1.2 CC[C@@H]1CC(=O)CCN1 Amb24558461 [0,1,0,1,0,0|2,0,0]=4 8347 B9R1.2 CC[C@@H]1CC(=O)CCO1 Amb25373176 [0,1,0,1,0,0|1,0,0]=3 8348 B9R1.2 CC[C@@H]1CN(C)CCN1 Amb25147060 [0,1,0,1,0,0|2,0,0]=4 8349 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,1,0,0|0,0,2]=4 8350 B9R1.2 CC[C@@H]1COCC(O)O1 Amb24406259 [0,1,0,1,0,0|0,0,0]=2 8351 B9R1.2 CC[C@@H]1C[C@@H](O)CCO1 Amb25175513 [0,1,0,1,0,0|1,0,0]=3 8352 B9R1.2 CC[C@H]1CC(=O)CCN1 Amb24652709 [0,1,0,1,0,0|2,0,0]=4 8353 B9R1.2 CC[C@H]1CC(=O)CCO1 Amb24633506 [0,1,0,1,0,0|1,0,0]=3 8354 B9R1.2 CC[C@H]1CCC[C@H](N)C1 Amb25369620 [0,1,0,1,0,0|2,0,0]=4 8355 B9R1.2 CC[C@H]1CN(C)CCN1 Amb25756657 [0,1,0,1,0,0|2,0,0]=4 8356 B9R1.2 CC[C@H]1COCC(=O)N1 Amb25831485 [0,1,0,1,0,0|0,0,2]=4 8357 B9R1.2 CC[C@H]1C[C@@H](Cl)CCO1 Amb25241544 [0,1,0,1,0,0|1,0,0]=3 8358 B9R1.2 CC[C@H]1C[C@H](O)CCO1 Amb25215427 [0,1,0,1,0,0|1,0,0]=3 8359 B9R1.2 CN1CC(CBr)OCC1 Amb23450046 [0,1,0,1,0,0|2,0,0]=4 8360 B9R1.2 CN1CC(CCl)OCC1 Amb13952422 [0,1,0,1,0,0|2,0,0]=4 8361 B9R1.2 CN1CC(CN)OCC1 Amb1080933 [0,1,0,1,0,0|2,0,0]=4 8362 B9R1.2 CN1CC(CN)OCC1 Amb22587154 [0,1,0,1,0,0|2,0,0]=4 8363 B9R1.2 CN1CC(CN)OCC1 Amb22886187 [0,1,0,1,0,0|2,0,0]=4 8364 B9R1.2 CN1CC(CO)NCC1 Amb15701335 [0,1,0,1,0,0|2,0,0]=4 8365 B9R1.2 CN1CC(CO)OCC1 Amb15692185 [0,1,0,1,0,0|1,0,0]=3 8366 B9R1.2 CN1CC(CO)SCC1 Amb24649090 [0,1,0,1,0,0|1,1,0]=4 8367 B9R1.2 CN1CC(CS)OCC1 Amb24478675 [0,1,0,1,0,0|1,1,0]=4 8368 B9R1.2 CN1C[C@@H](CN)OCC1 Amb22747950 [0,1,0,1,0,0|2,0,0]=4 8369 B9R1.2 CN1C[C@H](CN)OCC1 Amb25721466 [0,1,0,1,0,0|2,0,0]=4 8370 B9R1.2 CN1C[C@H](CO)NCC1 Amb24615625 [0,1,0,1,0,0|2,0,0]=4 8371 B9R1.2 CNC1CCCC(O)C1 Amb18642723 [0,1,0,1,0,0|2,0,0]=4 8372 B9R1.2 CNC1CN(C)CCO1 Amb24477845 [0,1,0,1,0,0|2,0,0]=4 8373 B9R1.2 CN[C@H]1CCC[C@H](O)C1 Amb24712944 [0,1,0,1,0,0|2,0,0]=4 8374 B9R1.2 COC1CC(Cl)CCO1 Amb24724609 [0,1,0,1,0,0|2,0,0]=4 8375 B9R1.2 COC1CCCC(C1)O Amb13951102 [0,1,0,1,0,0|2,0,0]=4 8376 B9R1.2 COC1COCC(N)C1 Amb24476653 [0,1,0,1,0,0|2,0,0]=4 8377 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 Amb25271471 [0,1,0,1,0,0|2,0,0]=4 8378 B9R1.2 C[C@@H]1CCC[C@@H](C1)CC Amb22230415 [0,1,0,1,0,0|2,0,0]=4 8379 B9R1.2 C[C@@H]1CCC[C@@H](CO)N1 Amb24585706 [0,1,0,1,0,0|1,0,0]=3 8380 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [0,1,0,1,0,0|1,0,0]=3 8381 B9R1.2 C[C@@H]1CCO[C@H](C1)NC Amb25174867 [0,1,0,1,0,0|2,0,0]=4 8382 B9R1.2 C[C@@H]1CCO[C@H](CCl)O1 Amb24616640 [0,1,0,1,0,0|1,0,0]=3 8383 B9R1.2 C[C@@H]1CNC[C@@H](CO)O1 Amb24682877 [0,1,0,1,0,0|1,0,0]=3 8384 B9R1.2 C[C@@H]1COCC(CS)N1 Amb24582979 [0,1,0,1,0,0|2,0,0]=4 8385 B9R1.2 C[C@@H]1COC[C@@H](CC)N1 Amb24424122 [0,1,0,1,0,0|1,0,0]=3 8386 B9R1.2 C[C@@H]1CSC[C@@H](CO)O1 Amb24583757 [0,1,0,1,0,0|1,0,0]=3 8387 B9R1.2 C[C@@H]1CSC[C@H](CO)O1 Amb25343807 [0,1,0,1,0,0|1,0,0]=3 8388 B9R1.2 C[C@@H]1C[C@@H](CO)NCC1 Amb24586583 [0,1,0,1,0,0|1,0,0]=3 8389 B9R1.2 C[C@@H]1C[C@H](C=O)OCC1 Amb25366622 [0,1,0,1,0,0|0,0,2]=4 8390 B9R1.2 C[C@@H]1C[C@H](CO)CCC1 Amb25176090 [0,1,0,1,0,0|1,0,0]=3 8391 B9R1.2 C[C@@H]1C[C@H](CO)OCC1 Amb24630517 [0,1,0,1,0,0|0,0,0]=2 8392 B9R1.2 C[C@H]1CC(CN)CCC1 Amb24569298 [0,1,0,1,0,0|2,0,0]=4 8393 B9R1.2 C[C@H]1CCC[C@@H](CC)N1 Amb24562231 [0,1,0,1,0,0|2,0,0]=4 8394 B9R1.2 C[C@H]1CCC[C@@H](CO)N1 Amb25174876 [0,1,0,1,0,0|1,0,0]=3 8395 B9R1.2 C[C@H]1CCC[C@@H](CO)O1 Amb25259234 [0,1,0,1,0,0|0,0,0]=2 8396 B9R1.2 C[C@H]1CCC[C@H](C1)CC Amb25756224 [0,1,0,1,0,0|2,0,0]=4 8397 B9R1.2 C[C@H]1CCO[C@@H](C#C)O1 Amb25248581 [0,1,0,1,0,0|1,0,1]=4 8398 B9R1.2 C[C@H]1CCO[C@H](C1)NC Amb25174873 [0,1,0,1,0,0|2,0,0]=4 8399 B9R1.2 C[C@H]1CNC[C@@H](CO)O1 Amb24549804 [0,1,0,1,0,0|1,0,0]=3 8400 B9R1.2 C[C@H]1COCC(CS)N1 Amb25114696 [0,1,0,1,0,0|2,0,0]=4 8401 B9R1.2 C[C@H]1COC[C@H](CO)O1 Amb25357711 [0,1,0,1,0,0|1,0,0]=3 8402 B9R1.2 C[C@H]1C[C@H](C=O)OCC1 Amb25339741 [0,1,0,1,0,0|0,0,2]=4 8403 B9R1.2 C[C@H]1C[C@H](CCN1)CO Amb24558717 [0,1,0,1,0,0|2,0,0]=4 8404 B9R1.2 C[C@H]1C[C@H](CO)CCC1 Amb24519733 [0,1,0,1,0,0|1,0,0]=3 8405 B9R1.2 ClC1CCCC(C1)CCl Amb25064320 [0,1,0,1,0,0|2,0,0]=4 8406 B9R1.2 NC1CC(CF)CCC1 Amb24654055 [0,1,0,1,0,0|2,0,0]=4 8407 B9R1.2 NC1CC(CO)CCC1 Amb24426645 [0,1,0,1,0,0|1,0,0]=3 8408 B9R1.2 NC1CC(CSC1)CO Amb25351507 [0,1,0,1,0,0|2,0,0]=4 8409 B9R1.2 NCC1CCCC(C1)N Amb16233731 [0,1,0,1,0,0|2,0,0]=4 8410 B9R1.2 NN1CC(CO)OCC1 Amb25850254 [0,1,0,1,0,0|1,0,0]=3 8411 B9R1.2 N[C@@H]1C[C@H](CCl)CCC1 Amb24699165 [0,1,0,1,0,0|2,0,0]=4 8412 B9R1.2 N[C@@H]1C[C@H](CO)CCC1 Amb23385323 [0,1,0,1,0,0|1,0,0]=3 8413 B9R1.2 N[C@H]1CCC[C@H](C1)CN Amb25770684 [0,1,0,1,0,0|2,0,0]=4 8414 B9R1.2 O=C1CCCC(CI)O1 Amb24675480 [0,1,0,1,0,0|1,0,1]=4 8415 B9R1.2 O=C1CCC[C@@H](CCl)O1 Amb24408738 [0,1,0,1,0,0|1,0,1]=4 8416 B9R1.2 OC1CC(CCl)CCC1 Amb25342173 [0,1,0,1,0,0|2,0,0]=4 8417 B9R1.2 OC1CC(CF)CCC1 Amb25222936 [0,1,0,1,0,0|2,0,0]=4 8418 B9R1.2 OC1CC(CI)CCC1 Amb25144515 [0,1,0,1,0,0|2,0,0]=4 8419 B9R1.2 OC1CCCC(C1)CO Amb24429742 [0,1,0,1,0,0|1,0,0]=3 8420 B9R1.2 OC1CCCC(C=O)O1 Amb25063184 [0,1,0,1,0,0|0,0,2]=4 8421 B9R1.2 OC1CSCC(CO)O1 Amb24593900 [0,1,0,1,0,0|1,0,0]=3 8422 B9R1.2 OC1CSC[C@@H](CO)O1 Amb25307802 [0,1,0,1,0,0|1,0,0]=3 8423 B9R1.2 OCC1CC(=O)CCN1 Amb25147026 [0,1,0,1,0,0|1,0,1]=4 8424 B9R1.2 OCC1CC(F)CNC1 Amb13889103 [0,1,0,1,0,0|2,0,0]=4 8425 B9R1.2 OCC1CCCC(=O)C1 Amb16231079 [0,1,0,1,0,0|1,0,1]=4 8426 B9R1.2 OCC1CCCC(=O)N1 Amb13886257 [0,1,0,1,0,0|1,0,1]=4 8427 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [0,1,0,1,0,0|1,0,0]=3 8428 B9R1.2 OCC1CCOC(=S)O1 Amb24752278 [0,1,0,1,0,0|1,0,1]=4 8429 B9R1.2 OCC1CNCC(F)C1 Amb22886258 [0,1,0,1,0,0|2,0,0]=4 8430 B9R1.2 OCC1COCC(=O)O1 Amb25246215 [0,1,0,1,0,0|1,0,1]=4 8431 B9R1.2 OC[C@@H]1CC(=O)CCC1 Amb22748907 [0,1,0,1,0,0|1,0,1]=4 8432 B9R1.2 OC[C@@H]1CCCC(=O)N1 Amb22745829 [0,1,0,1,0,0|1,0,1]=4 8433 B9R1.2 OC[C@@H]1CCCC(=O)O1 Amb25045754 [0,1,0,1,0,0|0,0,1]=3 8434 B9R1.2 OC[C@@H]1CCCN(C1)C Amb10068404 [0,1,0,1,0,0|2,0,0]=4 8435 B9R1.2 OC[C@H]1CCCC(=O)N1 Amb25187085 [0,1,0,1,0,0|1,0,1]=4 8436 B9R1.2 OC[C@H]1CCCN(C1)C Amb10068405 [0,1,0,1,0,0|2,0,0]=4 8437 B9R1.2 O[C@H]1CCC[C@H](CO)O1 Amb25175180 [0,1,0,1,0,0|0,0,0]=2 8438 B9R1.2 O[C@H]1CNC[C@H](C1)CO Amb24558018 [0,1,0,1,0,0|2,0,0]=4 8439 B9R1.2 O[C@H]1C[C@@H](CO)OC=C1 Amb24759137 [0,1,0,1,0,0|0,0,2]=4 8440 B9R1.7 C=C1CC(CCO)CC1 Amb24575578 [0,1,0,1,0,0|1,0,1]=4 8441 B9R1.7 C=CC[C@H]1C[C@H](O)CO1 Amb25271510 [0,1,0,1,0,0|0,0,2]=4 8442 B9R1.7 CC1CCC(CCCl)O1 Amb25130051 [0,1,0,1,0,0|2,0,0]=4 8443 B9R1.7 CC1CCC(CCN)N1 Amb23560219 [0,1,0,1,0,0|2,0,0]=4 8444 B9R1.7 CC1CCC(CCN)O1 Amb25107033 [0,1,0,1,0,0|2,0,0]=4 8445 B9R1.7 CC1CCC(CCO)N1 Amb25195208 [0,1,0,1,0,0|1,0,0]=3 8446 B9R1.7 CC1CCC(CCO)O1 Amb24420913 [0,1,0,1,0,0|1,0,0]=3 8447 B9R1.7 CC1CCC(CNC)O1 Amb18642726 [0,1,0,1,0,0|2,0,0]=4 8448 B9R1.7 CC1CN(CCBr)CC1 Amb18317662 [0,1,0,1,0,0|2,0,0]=4 8449 B9R1.7 CC1CN(CCBr)CC1 Amb20667700 [0,1,0,1,0,0|2,0,0]=4 8450 B9R1.7 CC1CN(CCF)CC1 Amb25261627 [0,1,0,1,0,0|2,0,0]=4 8451 B9R1.7 CC1CN(CCI)CC1 Amb25031737 [0,1,0,1,0,0|2,0,0]=4 8452 B9R1.7 CC1CN(CCN)CC1 Amb18523740 [0,1,0,1,0,0|2,0,0]=4 8453 B9R1.7 CC1CN(CCO)CC1 Amb20668415 [0,1,0,1,0,0|1,0,0]=3 8454 B9R1.7 CC1CN(CCS)CC1 Amb24646809 [0,1,0,1,0,0|1,1,0]=4 8455 B9R1.7 CC1CNC(C1)CCC Amb24474040 [0,1,0,1,0,0|2,0,0]=4 8456 B9R1.7 CC1COC(C#CC)O1 Amb24711713 [0,1,0,1,0,0|0,0,2]=4 8457 B9R1.7 CC1COC(CCCl)O1 Amb24089603 [0,1,0,1,0,0|1,0,0]=3 8458 B9R1.7 CC1COC(CCO)O1 Amb25057721 [0,1,0,1,0,0|1,0,0]=3 8459 B9R1.7 CC1COC(\C=C/C)O1 Amb22346145 [0,1,0,1,0,0|0,0,2]=4 8460 B9R1.7 CC1COC(\C=C\C)O1 Amb24546344 [0,1,0,1,0,0|0,0,2]=4 8461 B9R1.7 CC1CSC(CCC)N1 Amb25350086 [0,1,0,1,0,0|1,1,0]=4 8462 B9R1.7 CCCC1CC(O)CN1 Amb24428583 [0,1,0,1,0,0|1,0,0]=3 8463 B9R1.7 CCCC1CCC(Br)C1 Amb25115513 [0,1,0,1,0,0|2,0,0]=4 8464 B9R1.7 CCCC1CCC(O)C1 Amb24554977 [0,1,0,1,0,0|1,0,0]=3 8465 B9R1.7 CCCC=1CCC(O)C1 Amb25241423 [0,1,0,1,0,0|1,0,1]=4 8466 B9R1.7 CCCC=1CC[C@@H](O)C1 Amb24704978 [0,1,0,1,0,0|1,0,1]=4 8467 B9R1.7 CCCN1CC(Cl)CC1 Amb25185358 [0,1,0,1,0,0|2,0,0]=4 8468 B9R1.7 CCCN1CC(O)CO1 Amb24703686 [0,1,0,1,0,0|1,0,0]=3 8469 B9R1.7 CCCN1C[C@H](O)CC1 Amb24396613 [0,1,0,1,0,0|2,0,0]=4 8470 B9R1.7 CCC[C@@H]1CC[C@H](N1)C Amb10569094 [0,1,0,1,0,0|2,0,0]=4 8471 B9R1.7 CCOC1CC(O)CO1 Amb24481757 [0,1,0,1,0,0|1,0,0]=3 8472 B9R1.7 CCOC1CCC(O)C1 Amb24642566 [0,1,0,1,0,0|2,0,0]=4 8473 B9R1.7 CCOP1OCC(C)O1 Amb24405949 [0,1,0,1,0,0|2,0,0]=4 8474 B9R1.7 CCO[C@@H]1CC[C@H](O)C1 Amb25175111 [0,1,0,1,0,0|2,0,0]=4 8475 B9R1.7 CN1CC(CCO)CC1 Amb22585688 [0,1,0,1,0,0|2,0,0]=4 8476 B9R1.7 CN1CCC(CCO)O1 Amb25236560 [0,1,0,1,0,0|2,0,0]=4 8477 B9R1.7 COCC1CC(O)CN1 Amb25102542 [0,1,0,1,0,0|2,0,0]=4 8478 B9R1.7 COCC1CCC(O)C1 Amb25692823 [0,1,0,1,0,0|2,0,0]=4 8479 B9R1.7 COC[C@@H]1C[C@H](O)CN1 Amb25841067 [0,1,0,1,0,0|2,0,0]=4 8480 B9R1.7 C[C@@H]1CC[C@@H](CCC)N1 Amb24674087 [0,1,0,1,0,0|2,0,0]=4 8481 B9R1.7 C[C@@H]1CC[C@H](CCO)O1 Amb25358333 [0,1,0,1,0,0|1,0,0]=3 8482 B9R1.7 C[C@@H]1CN(CCO)CC1 Amb25680980 [0,1,0,1,0,0|1,0,0]=3 8483 B9R1.7 C[C@@H]1CO[C@@H](CCO)O1 Amb25261859 [0,1,0,1,0,0|1,0,0]=3 8484 B9R1.7 C[C@H]1CC[C@H](CCO)O1 Amb25238048 [0,1,0,1,0,0|1,0,0]=3 8485 B9R1.7 C[C@H]1CN(CCO)CC1 Amb25683829 [0,1,0,1,0,0|1,0,0]=3 8486 B9R1.7 C[C@H]1CO[C@@H](CCO)O1 Amb24592565 [0,1,0,1,0,0|1,0,0]=3 8487 B9R1.7 F[C@H]1CN(CCCl)CC1 Amb24405836 [0,1,0,1,0,0|2,0,0]=4 8488 B9R1.7 NC1CC(CC1)CCF Amb25202354 [0,1,0,1,0,0|2,0,0]=4 8489 B9R1.7 NCCN1CC(N)CC1 Amb24516305 [0,1,0,1,0,0|2,0,0]=4 8490 B9R1.7 NCCN1CC(O)CC1 Amb18965717 [0,1,0,1,0,0|2,0,0]=4 8491 B9R1.7 NCCN1C[C@@H](N)CC1 Amb24389851 [0,1,0,1,0,0|2,0,0]=4 8492 B9R1.7 NCCN1C[C@@H](O)CC1 Amb22748958 [0,1,0,1,0,0|2,0,0]=4 8493 B9R1.7 NCCN1C[C@@H](O)CC1 Amb24052962 [0,1,0,1,0,0|2,0,0]=4 8494 B9R1.7 NCCN1C[C@H](F)CC1 Amb24688764 [0,1,0,1,0,0|2,0,0]=4 8495 B9R1.7 NCC[C@@H]1CC[C@@H](O)C1 Amb17933186 [0,1,0,1,0,0|2,0,0]=4 8496 B9R1.7 NCC[C@@H]1CC[C@H](O)C1 Amb17933187 [0,1,0,1,0,0|2,0,0]=4 8497 B9R1.7 N[C@@H]1CN(CCO)CC1 Amb25794128 [0,1,0,1,0,0|1,0,0]=3 8498 B9R1.7 N[C@H]1CN(CCF)CC1 Amb25357935 [0,1,0,1,0,0|2,0,0]=4 8499 B9R1.7 OC1CN(CCBr)CC1 Amb18316435 [0,1,0,1,0,0|2,0,0]=4 8500 B9R1.7 OC1CN(CCI)CC1 Amb24429798 [0,1,0,1,0,0|2,0,0]=4 8501 B9R1.7 OC1CNC(C1)CCO Amb25312112 [0,1,0,1,0,0|2,0,0]=4 8502 B9R1.7 OCCC1CC(=O)CC1 Amb24467811 [0,1,0,1,0,0|1,0,1]=4 8503 B9R1.7 OCCN1CC(O)CO1 Amb25725753 [0,1,0,1,0,0|2,0,0]=4 8504 B9R1.7 OCCN1CCC(C1)N Amb17134545 [0,1,0,1,0,0|1,0,0]=3 8505 B9R1.7 OCCN1C[C@H](F)CC1 Amb25808777 [0,1,0,1,0,0|1,0,0]=3 8506 B9R1.7 OCC[C@@H]1CC(=O)CC1 Amb24750224 [0,1,0,1,0,0|1,0,1]=4 8507 B9R1.7 O[C@@H]1CC[C@H](C1)CCO Amb24719687 [0,1,0,1,0,0|1,0,0]=3 8508 B9R1.7 O[C@H]1CN(CCI)CC1 Amb25783399 [0,1,0,1,0,0|2,0,0]=4 8509 B9R1.8 BrCCC1C=CCCO1 Amb24479997 [0,1,0,1,0,0|1,0,1]=4 8510 B9R1.8 BrCCC1CCCCN1 Amb1102639 [0,1,0,1,0,0|2,0,0]=4 8511 B9R1.8 BrCCC1CCCCN1 Amb21955305 [0,1,0,1,0,0|2,0,0]=4 8512 B9R1.8 BrCCC1CCCCN1 Amb22284142 [0,1,0,1,0,0|2,0,0]=4 8513 B9R1.8 BrCCC1CCCCO1 Amb24480305 [0,1,0,1,0,0|1,0,0]=3 8514 B9R1.8 BrCCC1CCNCC1 Amb18129678 [0,1,0,1,0,0|2,0,0]=4 8515 B9R1.8 BrCCC1CCSCC1 Amb24356130 [0,1,0,1,0,0|2,0,0]=4 8516 B9R1.8 BrCCC1CNCCC1 Amb22274545 [0,1,0,1,0,0|2,0,0]=4 8517 B9R1.8 BrCCN1CCCCC1 Amb10608903 [0,1,0,1,0,0|2,0,0]=4 8518 B9R1.8 BrCCN1CCCCC1 Amb19373647 [0,1,0,1,0,0|2,0,0]=4 8519 B9R1.8 BrCCN1CCCCO1 Amb22886697 [0,1,0,1,0,0|1,0,0]=3 8520 B9R1.8 BrCCN1CCOCC1 Amb10066882 [0,1,0,1,0,0|2,0,0]=4 8521 B9R1.8 BrCCN1CCOCC1 Amb19373542 [0,1,0,1,0,0|2,0,0]=4 8522 B9R1.8 BrCOC1COCCC1 Amb24475225 [0,1,0,1,0,0|2,0,0]=4 8523 B9R1.8 Br[Mg]CC1CCCCC1 Amb22000557 [0,1,0,1,0,0|2,0,0]=4 8524 B9R1.8 Br[Zn]CC1CCCCC1 Amb22000375 [0,1,0,1,0,0|2,0,0]=4 8525 B9R1.8 Br\C=C\C1CCCCO1 Amb24429040 [0,1,0,1,0,0|1,0,1]=4 8526 B9R1.8 C#CCC1CCCCN1 Amb18280972 [0,1,0,1,0,0|2,0,0]=4 8527 B9R1.8 C#CCC1COCCN1 Amb25689909 [0,1,0,1,0,0|1,0,1]=4 8528 B9R1.8 C#CCN1CCCCO1 Amb25126173 [0,1,0,1,0,0|1,0,1]=4 8529 B9R1.8 C=CCC1CCCCN1 Amb18967413 [0,1,0,1,0,0|2,0,0]=4 8530 B9R1.8 C=CCC1COCCC1 Amb25800921 [0,1,0,1,0,0|1,0,1]=4 8531 B9R1.8 C=CCC1COCCO1 Amb25689792 [0,1,0,1,0,0|0,0,1]=3 8532 B9R1.8 C=CC[C@@H]1COCCN1 Amb22746801 [0,1,0,1,0,0|1,0,1]=4 8533 B9R1.8 C=COC1CCCCO1 Amb22730655 [0,1,0,1,0,0|1,0,1]=4 8534 B9R1.8 CCCC1CCCCC1 Amb22336542 [0,1,0,1,0,0|2,0,0]=4 8535 B9R1.8 CCCC1CCCCN1 Amb2235347 [0,1,0,1,0,0|2,0,0]=4 8536 B9R1.8 CCCC1CCCCO1 Amb24066767 [0,1,0,1,0,0|1,0,0]=3 8537 B9R1.8 CCCC1CCNCC1 Amb10553113 [0,1,0,1,0,0|2,0,0]=4 8538 B9R1.8 CCCC1CCOCS1 Amb24469218 [0,1,0,1,0,0|1,1,0]=4 8539 B9R1.8 CCCC1CNCCC1 Amb18285007 [0,1,0,1,0,0|2,0,0]=4 8540 B9R1.8 CCCC1CNCCC1 Amb20630890 [0,1,0,1,0,0|2,0,0]=4 8541 B9R1.8 CCCC1CNCCN1 Amb20667630 [0,1,0,1,0,0|2,0,0]=4 8542 B9R1.8 CCCC1CNCCO1 Amb22059500 [0,1,0,1,0,0|1,0,0]=3 8543 B9R1.8 CCCC1COCCN1 Amb10607878 [0,1,0,1,0,0|1,0,0]=3 8544 B9R1.8 CCCC1NCCCO1 Amb25757497 [0,1,0,1,0,0|1,0,0]=3 8545 B9R1.8 CCCN1CCNCC1 Amb1995335 [0,1,0,1,0,0|2,0,0]=4 8546 B9R1.8 CCCN1CCNCC1 Amb22292475 [0,1,0,1,0,0|2,0,0]=4 8547 B9R1.8 CCC[C@@H]1CCCCN1 Amb10567812 [0,1,0,1,0,0|2,0,0]=4 8548 B9R1.8 CCC[C@@H]1CCCCN1 Amb20241517 [0,1,0,1,0,0|2,0,0]=4 8549 B9R1.8 CCC[C@@H]1CNCCN1 Amb25224582 [0,1,0,1,0,0|2,0,0]=4 8550 B9R1.8 CCC[C@H]1CCCCN1 Amb10567367 [0,1,0,1,0,0|2,0,0]=4 8551 B9R1.8 CCC[C@H]1CCCCN1 Amb20241111 [0,1,0,1,0,0|2,0,0]=4 8552 B9R1.8 CCC[C@H]1CNCCC1 Amb25340059 [0,1,0,1,0,0|2,0,0]=4 8553 B9R1.8 CCC[C@H]1CNCCS1 Amb24543814 [0,1,0,1,0,0|1,1,0]=4 8554 B9R1.8 CCC[C@H]1COCCN1 Amb24478590 [0,1,0,1,0,0|1,0,0]=3 8555 B9R1.8 CCNC1CNCCC1 Amb18955851 [0,1,0,1,0,0|2,0,0]=4 8556 B9R1.8 CCNC1CNCCO1 Amb24460143 [0,1,0,1,0,0|1,0,0]=3 8557 B9R1.8 CCNC1CSCCC1 Amb18287619 [0,1,0,1,0,0|1,1,0]=4 8558 B9R1.8 CCN[C@H]1CNCCC1 Amb19892597 [0,1,0,1,0,0|2,0,0]=4 8559 B9R1.8 CCOC1CCCCC1 Amb17939402 [0,1,0,1,0,0|2,0,0]=4 8560 B9R1.8 CCOC1CNCCC1 Amb19889821 [0,1,0,1,0,0|2,0,0]=4 8561 B9R1.8 CCOC1CNCCO1 Amb25146119 [0,1,0,1,0,0|1,0,0]=3 8562 B9R1.8 CCOC1COCCN1 Amb24393066 [0,1,0,1,0,0|1,0,0]=3 8563 B9R1.8 CCO[C@@H]1CNCCC1 Amb24478793 [0,1,0,1,0,0|2,0,0]=4 8564 B9R1.8 CCO[C@H]1CNCCC1 Amb24559280 [0,1,0,1,0,0|2,0,0]=4 8565 B9R1.8 CCSC1CCCCC1 Amb17672782 [0,1,0,1,0,0|2,0,0]=4 8566 B9R1.8 CCSC1CNCCC1 Amb18956223 [0,1,0,1,0,0|2,0,0]=4 8567 B9R1.8 CCSC1COCCC1 Amb24721347 [0,1,0,1,0,0|1,0,0]=3 8568 B9R1.8 CNCC1CCCCC1 Amb1117772 [0,1,0,1,0,0|2,0,0]=4 8569 B9R1.8 CNCC1CCCCC1 Amb2119455 [0,1,0,1,0,0|2,0,0]=4 8570 B9R1.8 CNCC1CCCCN1 Amb18281799 [0,1,0,1,0,0|2,0,0]=4 8571 B9R1.8 CNCC1CCCNC1 Amb16186636 [0,1,0,1,0,0|2,0,0]=4 8572 B9R1.8 CNCC1CNCCC1 Amb21959752 [0,1,0,1,0,0|2,0,0]=4 8573 B9R1.8 CNCC1CNCCN1 Amb25340113 [0,1,0,1,0,0|2,0,0]=4 8574 B9R1.8 CNCC1CNCCO1 Amb22829908 [0,1,0,1,0,0|1,0,0]=3 8575 B9R1.8 CNCC1COCCC1 Amb18288267 [0,1,0,1,0,0|1,0,0]=3 8576 B9R1.8 CNCC1COCCN1 Amb23585550 [0,1,0,1,0,0|1,0,0]=3 8577 B9R1.8 CNCC1COCCO1 Amb1102054 [0,1,0,1,0,0|0,0,0]=2 8578 B9R1.8 CNCC1COCCO1 Amb22587651 [0,1,0,1,0,0|0,0,0]=2 8579 B9R1.8 CNCC1OCCCO1 Amb18663858 [0,1,0,1,0,0|1,0,0]=3 8580 B9R1.8 CNCC=1COCCC1 Amb24329063 [0,1,0,1,0,0|1,0,1]=4 8581 B9R1.8 CNC[C@@H]1CCCCN1 Amb24477709 [0,1,0,1,0,0|2,0,0]=4 8582 B9R1.8 CNC[C@@H]1COCCO1 Amb25087223 [0,1,0,1,0,0|0,0,0]=2 8583 B9R1.8 CNC[C@H]1CCCCN1 Amb25115403 [0,1,0,1,0,0|2,0,0]=4 8584 B9R1.8 CNC[C@H]1COCCO1 Amb24678766 [0,1,0,1,0,0|0,0,0]=2 8585 B9R1.8 COCC1CCCCN1 Amb2235005 [0,1,0,1,0,0|1,0,0]=3 8586 B9R1.8 COCC1CCCNC1 Amb2140573 [0,1,0,1,0,0|2,0,0]=4 8587 B9R1.8 COCC1CCNCC1 Amb2179588 [0,1,0,1,0,0|2,0,0]=4 8588 B9R1.8 COCC1CCNCC1 Amb2235515 [0,1,0,1,0,0|2,0,0]=4 8589 B9R1.8 COCC1CNCCN1 Amb24101336 [0,1,0,1,0,0|2,0,0]=4 8590 B9R1.8 COCC1CNCCO1 Amb19333126 [0,1,0,1,0,0|1,0,0]=3 8591 B9R1.8 COCC1CNCCO1 Amb22234267 [0,1,0,1,0,0|1,0,0]=3 8592 B9R1.8 COCC1COCCN1 Amb21858859 [0,1,0,1,0,0|1,0,0]=3 8593 B9R1.8 COCC1NCCCS1 Amb24481936 [0,1,0,1,0,0|1,1,0]=4 8594 B9R1.8 COC[C@@H]1CCCCN1 Amb15692169 [0,1,0,1,0,0|1,0,0]=3 8595 B9R1.8 COC[C@@H]1CCCCN1 Amb22748820 [0,1,0,1,0,0|1,0,0]=3 8596 B9R1.8 COC[C@@H]1CNCCO1 Amb22745244 [0,1,0,1,0,0|1,0,0]=3 8597 B9R1.8 COC[C@@H]1CNCCO1 Amb22745940 [0,1,0,1,0,0|1,0,0]=3 8598 B9R1.8 COC[C@@H]1COCCN1 Amb22737235 [0,1,0,1,0,0|1,0,0]=3 8599 B9R1.8 COC[C@@H]1COCCN1 Amb25062753 [0,1,0,1,0,0|1,0,0]=3 8600 B9R1.8 COC[C@H]1CCCCN1 Amb24420160 [0,1,0,1,0,0|1,0,0]=3 8601 B9R1.8 COC[C@H]1CNCCO1 Amb25145666 [0,1,0,1,0,0|1,0,0]=3 8602 B9R1.8 COC[C@H]1COCCN1 Amb22736700 [0,1,0,1,0,0|1,0,0]=3 8603 B9R1.8 CONC1COCCC1 Amb24416869 [0,1,0,1,0,0|2,0,0]=4 8604 B9R1.8 CSCC1CCCCN1 Amb2237237 [0,1,0,1,0,0|1,1,0]=4 8605 B9R1.8 CSCC1CCCCO1 Amb25162772 [0,1,0,1,0,0|0,1,0]=3 8606 B9R1.8 CSCC1CCCNC1 Amb17503123 [0,1,0,1,0,0|2,0,0]=4 8607 B9R1.8 CSCC1CNCCC1 Amb21959895 [0,1,0,1,0,0|2,0,0]=4 8608 B9R1.8 CSCC1CNCCO1 Amb25093056 [0,1,0,1,0,0|1,0,0]=3 8609 B9R1.8 C\C=C\C1OCCCO1 Amb17334099 [0,1,0,1,0,0|0,0,2]=4 8610 B9R1.8 ClCCC1CCOCC1 Amb22299854 [0,1,0,1,0,0|2,0,0]=4 8611 B9R1.8 ClCCC1CNCCC1 Amb22299848 [0,1,0,1,0,0|2,0,0]=4 8612 B9R1.8 ClCCC1CNCCN1 Amb24104481 [0,1,0,1,0,0|2,0,0]=4 8613 B9R1.8 ClCCC1CNCCN1 Amb24120381 [0,1,0,1,0,0|2,0,0]=4 8614 B9R1.8 ClCCC1COCCN1 Amb25200158 [0,1,0,1,0,0|1,0,0]=3 8615 B9R1.8 ClCCN1CCCCC1 Amb1154247 [0,1,0,1,0,0|2,0,0]=4 8616 B9R1.8 ClCCN1CCNCC1 Amb21959787 [0,1,0,1,0,0|2,0,0]=4 8617 B9R1.8 ClCCN1CCOCC1 Amb1935070 [0,1,0,1,0,0|2,0,0]=4 8618 B9R1.8 ClCCN1CCSCC1 Amb18788423 [0,1,0,1,0,0|2,0,0]=4 8619 B9R1.8 ClCCN1CCSCC1 Amb20622476 [0,1,0,1,0,0|2,0,0]=4 8620 B9R1.8 ClCC[NH+]1CCOCC1 Amb24122602 [0,1,0,1,0,0|2,0,0]=4 8621 B9R1.8 ClCC[S+]1CCSCC1 Amb24579503 [0,1,0,1,0,0|1,1,0]=4 8622 B9R1.8 ClCOC1CCCCC1 Amb24323400 [0,1,0,1,0,0|2,0,0]=4 8623 B9R1.8 ClCOC1COCCC1 Amb25082924 [0,1,0,1,0,0|2,0,0]=4 8624 B9R1.8 FCCC1CCNCC1 Amb22274784 [0,1,0,1,0,0|2,0,0]=4 8625 B9R1.8 FCCC1CCNCC1 Amb24055930 [0,1,0,1,0,0|2,0,0]=4 8626 B9R1.8 FCCC1CNCCC1 Amb21959219 [0,1,0,1,0,0|2,0,0]=4 8627 B9R1.8 FCCN1CCNCC1 Amb21964371 [0,1,0,1,0,0|2,0,0]=4 8628 B9R1.8 FCCN1CCNCC1 Amb22234059 [0,1,0,1,0,0|2,0,0]=4 8629 B9R1.8 FCCN1CCNCC1 Amb22263131 [0,1,0,1,0,0|2,0,0]=4 8630 B9R1.8 ICCC1CCCCC1 Amb25046814 [0,1,0,1,0,0|2,0,0]=4 8631 B9R1.8 ICCC1CCNCC1 Amb22296927 [0,1,0,1,0,0|2,0,0]=4 8632 B9R1.8 ICCC1CCOCC1 Amb22296928 [0,1,0,1,0,0|2,0,0]=4 8633 B9R1.8 ICCC1CNCCC1 Amb22296921 [0,1,0,1,0,0|2,0,0]=4 8634 B9R1.8 ICCC=1CCCCC1 Amb25272763 [0,1,0,1,0,0|2,0,0]=4 8635 B9R1.8 ICCN1CCCCC1 Amb25063410 [0,1,0,1,0,0|2,0,0]=4 8636 B9R1.8 ICCN1CCOCC1 Amb25733746 [0,1,0,1,0,0|2,0,0]=4 8637 B9R1.8 ICCN1CCSCC1 Amb25043360 [0,1,0,1,0,0|2,0,0]=4 8638 B9R1.8 ICOC1CCCCC1 Amb25369857 [0,1,0,1,0,0|2,0,0]=4 8639 B9R1.8 N#CCC1CCCCN1 Amb18642252 [0,1,0,1,0,0|2,0,0]=4 8640 B9R1.8 N#CCC1COCCN1 Amb18832758 [0,1,0,1,0,0|1,0,1]=4 8641 B9R1.8 N#CCC1OCCCO1 Amb17334093 [0,1,0,1,0,0|1,0,1]=4 8642 B9R1.8 N#CC[C@@H]1COCCO1 Amb25707855 [0,1,0,1,0,0|0,0,1]=3 8643 B9R1.8 NCCC1=NCCCO1 Amb24741836 [0,1,0,1,0,0|2,0,0]=4 8644 B9R1.8 NCCC1CCCCN1 Amb16233732 [0,1,0,1,0,0|2,0,0]=4 8645 B9R1.8 NCCC1CCCCO1 Amb10067654 [0,1,0,1,0,0|1,0,0]=3 8646 B9R1.8 NCCC1CCCNC1 Amb16186592 [0,1,0,1,0,0|2,0,0]=4 8647 B9R1.8 NCCC1CCCOC1 Amb10072965 [0,1,0,1,0,0|1,0,0]=3 8648 B9R1.8 NCCC1CCNCC1 Amb2209234 [0,1,0,1,0,0|2,0,0]=4 8649 B9R1.8 NCCC1CCOCC1 Amb10068548 [0,1,0,1,0,0|2,0,0]=4 8650 B9R1.8 NCCC1CCOCC1 Amb10068583 [0,1,0,1,0,0|2,0,0]=4 8651 B9R1.8 NCCC1CCSCC1 Amb18199237 [0,1,0,1,0,0|2,0,0]=4 8652 B9R1.8 NCCC1CNCCN1 Amb24061327 [0,1,0,1,0,0|2,0,0]=4 8653 B9R1.8 NCCC1COCCO1 Amb17507065 [0,1,0,1,0,0|0,0,0]=2 8654 B9R1.8 NCCC1CSCCC1 Amb18199319 [0,1,0,1,0,0|1,1,0]=4 8655 B9R1.8 NCCC1CSCCN1 Amb18559611 [0,1,0,1,0,0|1,1,0]=4 8656 B9R1.8 NCCC1OCCCO1 Amb17226715 [0,1,0,1,0,0|1,0,0]=3 8657 B9R1.8 NCCN1CCCCC1 Amb1155423 [0,1,0,1,0,0|2,0,0]=4 8658 B9R1.8 NCCN1CCCCC1 Amb20171369 [0,1,0,1,0,0|2,0,0]=4 8659 B9R1.8 NCCN1CCCCO1 Amb22886181 [0,1,0,1,0,0|1,0,0]=3 8660 B9R1.8 NCC[C@@H]1CCCCN1 Amb22746803 [0,1,0,1,0,0|2,0,0]=4 8661 B9R1.8 NCC[C@@H]1CCCCN1 Amb22899081 [0,1,0,1,0,0|2,0,0]=4 8662 B9R1.8 NCC[C@H]1CCCCN1 Amb25041454 [0,1,0,1,0,0|2,0,0]=4 8663 B9R1.8 NCC[C@H]1COCCN1 Amb24707342 [0,1,0,1,0,0|1,0,0]=3 8664 B9R1.8 NNCC1CCCCO1 Amb13952745 [0,1,0,1,0,0|1,0,0]=3 8665 B9R1.8 NNCC1COCCO1 Amb19516843 [0,1,0,1,0,0|1,0,0]=3 8666 B9R1.8 NNCC1COCCO1 Amb22587354 [0,1,0,1,0,0|1,0,0]=3 8667 B9R1.8 NNCC1CSCCO1 Amb25296828 [0,1,0,1,0,0|1,1,0]=4 8668 B9R1.8 NOCC1CCCCC1 Amb10976085 [0,1,0,1,0,0|1,0,0]=3 8669 B9R1.8 NOCC1CCCCO1 Amb24584902 [0,1,0,1,0,0|0,0,0]=2 8670 B9R1.8 NOCC1CCOCC1 Amb24477835 [0,1,0,1,0,0|2,0,0]=4 8671 B9R1.8 NOCC1CNCCO1 Amb24600873 [0,1,0,1,0,0|1,0,0]=3 8672 B9R1.8 NOCN1CCCCC1 Amb25784092 [0,1,0,1,0,0|2,0,0]=4 8673 B9R1.8 O=C=NC1CCCCO1 Amb25790678 [0,1,0,1,0,0|0,0,2]=4 8674 B9R1.8 O=CCC1CCCCC1 Amb10070777 [0,1,0,1,0,0|1,0,1]=4 8675 B9R1.8 O=CCC1CCCCN1 Amb18203260 [0,1,0,1,0,0|1,0,1]=4 8676 B9R1.8 O=CCC1CCCCS1 Amb25337846 [0,1,0,1,0,0|0,1,1]=4 8677 B9R1.8 O=CCC1CNCCO1 Amb22228172 [0,1,0,1,0,0|1,0,1]=4 8678 B9R1.8 O=CCC1COCCC1 Amb22411365 [0,1,0,1,0,0|1,0,1]=4 8679 B9R1.8 O=CC[C@@H]1COCCC1 Amb25277180 [0,1,0,1,0,0|1,0,1]=4 8680 B9R1.8 OCC=C1CCCCC1 Amb25783847 [0,1,0,1,0,0|1,0,1]=4 8681 B9R1.8 OCCC1=CCCCC1 Amb17593322 [0,1,0,1,0,0|1,0,0]=3 8682 B9R1.8 OCCC1=CCCCO1 Amb25266822 [0,1,0,1,0,0|0,0,1]=3 8683 B9R1.8 OCCC1C=CCCO1 Amb24423433 [0,1,0,1,0,0|0,0,2]=4 8684 B9R1.8 OCCC1CCC=CC1 Amb17593319 [0,1,0,1,0,0|1,0,1]=4 8685 B9R1.8 OCCC1CCC=CO1 Amb24481996 [0,1,0,1,0,0|0,0,2]=4 8686 B9R1.8 OCCC1CCCC=C1 Amb17593314 [0,1,0,1,0,0|1,0,1]=4 8687 B9R1.8 OCCC1CCCCN1 Amb22492461 [0,1,0,1,0,0|1,0,0]=3 8688 B9R1.8 OCCC1CCNCC1 Amb22234816 [0,1,0,1,0,0|1,0,0]=3 8689 B9R1.8 OCCC1CCSCC1 Amb18831400 [0,1,0,1,0,0|1,0,0]=3 8690 B9R1.8 OCCC1CNCCC1 Amb19308093 [0,1,0,1,0,0|1,0,0]=3 8691 B9R1.8 OCCC1CNCCN1 Amb20241013 [0,1,0,1,0,0|2,0,0]=4 8692 B9R1.8 OCCC1CNCCO1 Amb22228173 [0,1,0,1,0,0|1,0,0]=3 8693 B9R1.8 OCCC1CNCCS1 Amb25268565 [0,1,0,1,0,0|1,1,0]=4 8694 B9R1.8 OCCC1COCCC1 Amb18203195 [0,1,0,1,0,0|1,0,0]=3 8695 B9R1.8 OCCC1COCCN1 Amb21858855 [0,1,0,1,0,0|1,0,0]=3 8696 B9R1.8 OCCC1COCCN1 Amb22276154 [0,1,0,1,0,0|1,0,0]=3 8697 B9R1.8 OCCC1COCCO1 Amb25328496 [0,1,0,1,0,0|0,0,0]=2 8698 B9R1.8 OCCC1COCOC1 Amb25769417 [0,1,0,1,0,0|2,0,0]=4 8699 B9R1.8 OCCC1CSCCC1 Amb18202274 [0,1,0,1,0,0|1,0,0]=3 8700 B9R1.8 OCCC1CSCCN1 Amb20667793 [0,1,0,1,0,0|1,1,0]=4 8701 B9R1.8 OCCC=1CNCCC1 Amb24559854 [0,1,0,1,0,0|1,0,1]=4 8702 B9R1.8 OCCN1CCCCN1 Amb24395634 [0,1,0,1,0,0|1,0,0]=3 8703 B9R1.8 OCCN1CCCCO1 Amb22886802 [0,1,0,1,0,0|0,0,0]=2 8704 B9R1.8 OCCN1CNCCC1 Amb25858737 [0,1,0,1,0,0|1,0,0]=3 8705 B9R1.8 OCCN1COCOC1 Amb24079197 [0,1,0,1,0,0|2,0,0]=4 8706 B9R1.8 OCCN1CSCSC1 Amb22396043 [0,1,0,1,0,0|2,0,0]=4 8707 B9R1.8 OCC[C@@H]1CCCCN1 Amb22168885 [0,1,0,1,0,0|1,0,0]=3 8708 B9R1.8 OCC[C@@H]1CNCCN1 Amb22288654 [0,1,0,1,0,0|2,0,0]=4 8709 B9R1.8 OCC[C@@H]1COCCN1 Amb20242174 [0,1,0,1,0,0|1,0,0]=3 8710 B9R1.8 OCC[C@@H]1COCCN1 Amb20242979 [0,1,0,1,0,0|1,0,0]=3 8711 B9R1.8 OCC[C@@H]1NCCNC1 Amb15692003 [0,1,0,1,0,0|2,0,0]=4 8712 B9R1.8 OCC[C@H]1CCCC=C1 Amb25090885 [0,1,0,1,0,0|1,0,1]=4 8713 B9R1.8 OCC[C@H]1CCCCN1 Amb17619440 [0,1,0,1,0,0|1,0,0]=3 8714 B9R1.8 OCC[C@H]1CCCCO1 Amb25788223 [0,1,0,1,0,0|0,0,0]=2 8715 B9R1.8 OCC[C@H]1CNCCN1 Amb22265555 [0,1,0,1,0,0|2,0,0]=4 8716 B9R1.8 OCC[C@H]1COCCN1 Amb20242185 [0,1,0,1,0,0|1,0,0]=3 8717 B9R1.8 OCC[C@H]1COCCN1 Amb20242980 [0,1,0,1,0,0|1,0,0]=3 8718 B9R1.8 OCC[C@H]1COCCO1 Amb24458560 [0,1,0,1,0,0|0,0,0]=2 8719 B9R1.8 OCNC1CCCCC1 Amb24409850 [0,1,0,1,0,0|1,0,0]=3 8720 B9R1.8 OCOC1CCCCC1 Amb25681462 [0,1,0,1,0,0|1,0,0]=3 8721 B9R1.8 ONCC1CCC=CO1 Amb24715148 [0,1,0,1,0,0|0,0,2]=4 8722 B9R1.8 ONCC1CCCCC1 Amb25251761 [0,1,0,1,0,0|1,0,0]=3 8723 B9R1.8 ONCC1CCCCN1 Amb25206467 [0,1,0,1,0,0|1,0,0]=3 8724 B9R1.8 ONCC1CCOCC1 Amb25736560 [0,1,0,1,0,0|2,0,0]=4 8725 B9R1.8 ONCC1COCCC1 Amb25084814 [0,1,0,1,0,0|2,0,0]=4 8726 B9R1.8 SCCC1CCCCC1 Amb24368740 [0,1,0,1,0,0|1,1,0]=4 8727 B9R1.8 SCCC1CCCCN1 Amb17503520 [0,1,0,1,0,0|1,1,0]=4 8728 B9R1.8 SCCC1CCNCC1 Amb22297524 [0,1,0,1,0,0|1,1,0]=4 8729 B9R1.8 SCCC1CCOCC1 Amb22297642 [0,1,0,1,0,0|1,1,0]=4 8730 B9R1.8 SCCC1CNCCC1 Amb22298478 [0,1,0,1,0,0|1,1,0]=4 8731 B9R1.8 SCCN1CCNCC1 Amb18251292 [0,1,0,1,0,0|1,1,0]=4 8732 B9R1.8 SCCN1CCSCC1 Amb24340206 [0,1,0,1,0,0|1,1,0]=4 8733 B9R1.8 [N-]=[N+]=N[C@@H]1CCCCO1 Amb25054709 [0,1,0,1,0,0|2,0,0]=4 8734 B9R1.9 C=CCOC1CC(N)C1 Amb24478731 [0,1,0,1,0,0|1,0,1]=4 8735 B9R1.9 CC1CC(C1)NCCC Amb25218930 [0,1,0,1,0,0|2,0,0]=4 8736 B9R1.9 CC1CC(C1)NCCO Amb25244362 [0,1,0,1,0,0|1,0,0]=3 8737 B9R1.9 CC1CC(CCCN)C1 Amb23456208 [0,1,0,1,0,0|2,0,0]=4 8738 B9R1.9 CC1CC(CCCO)C1 Amb23456207 [0,1,0,1,0,0|1,0,0]=3 8739 B9R1.9 CC1CN(CCCO)C1 Amb25676868 [0,1,0,1,0,0|2,0,0]=4 8740 B9R1.9 CCCCC1CC(=O)O1 Amb25202242 [0,1,0,1,0,0|1,0,1]=4 8741 B9R1.9 CCCCC=1CC(O)C1 Amb25204732 [0,1,0,1,0,0|1,0,0]=3 8742 B9R1.9 CCCC[C@@H]1C[C@@H](O)C1 Amb24529089 [0,1,0,1,0,0|1,0,0]=3 8743 B9R1.9 CCCNC1CC(Cl)C1 Amb24758265 [0,1,0,1,0,0|2,0,0]=4 8744 B9R1.9 CCCNC1CC(N)C1 Amb24426950 [0,1,0,1,0,0|2,0,0]=4 8745 B9R1.9 CCCNC1CC(O)C1 Amb24758264 [0,1,0,1,0,0|2,0,0]=4 8746 B9R1.9 CCCOC1CC(=O)C1 Amb24563290 [0,1,0,1,0,0|1,0,1]=4 8747 B9R1.9 CCCOC1CC(Br)C1 Amb25115165 [0,1,0,1,0,0|1,0,0]=3 8748 B9R1.9 CCCOC1CC(Cl)C1 Amb24607826 [0,1,0,1,0,0|1,0,0]=3 8749 B9R1.9 CCCOC1CC(N)C1 Amb24757409 [0,1,0,1,0,0|1,0,0]=3 8750 B9R1.9 CN1CC(CCCO)C1 Amb24549280 [0,1,0,1,0,0|2,0,0]=4 8751 B9R1.9 FCCNC1CC(Cl)C1 Amb24399338 [0,1,0,1,0,0|2,0,0]=4 8752 B9R1.9 NC1CC(C1)OCC#N Amb24598705 [0,1,0,1,0,0|1,0,1]=4 8753 B9R1.9 NC1CN(CCCO)C1 Amb24375825 [0,1,0,1,0,0|2,0,0]=4 8754 B9R1.9 NCCCN1CC(O)C1 Amb21959303 [0,1,0,1,0,0|2,0,0]=4 8755 B9R1.9 OC1CN(CCCBr)C1 Amb24735980 [0,1,0,1,0,0|2,0,0]=4 8756 B9R1.12 BrCCCC1CCCC1 Amb19073227 [0,1,0,1,0,0|2,0,0]=4 8757 B9R1.12 BrCCCC1CCCO1 Amb18324625 [0,1,0,1,0,0|1,0,0]=3 8758 B9R1.12 BrCCCC1OCCO1 Amb17226721 [0,1,0,1,0,0|0,0,0]=2 8759 B9R1.12 BrCCNC1CCCC1 Amb25077897 [0,1,0,1,0,0|2,0,0]=4 8760 B9R1.12 BrCCNC1COCC1 Amb25268373 [0,1,0,1,0,0|2,0,0]=4 8761 B9R1.12 BrCCNC1CSCC1 Amb25235978 [0,1,0,1,0,0|2,0,0]=4 8762 B9R1.12 BrCCOB1CCCO1 Amb24479966 [0,1,0,1,0,0|2,0,0]=4 8763 B9R1.12 BrCCOC1CCCO1 Amb25059111 [0,1,0,1,0,0|1,0,0]=3 8764 B9R1.12 BrC\C=C\C1OCCO1 Amb24481761 [0,1,0,1,0,0|0,0,2]=4 8765 B9R1.12 Br[Mg]CCC1OCCO1 Amb22897295 [0,1,0,1,0,0|1,0,0]=3 8766 B9R1.12 C#CCCN1CCCC1 Amb23598313 [0,1,0,1,0,0|2,0,0]=4 8767 B9R1.12 C#CCOC1CCCC1 Amb23598925 [0,1,0,1,0,0|1,0,1]=4 8768 B9R1.12 C#CCOC1CNCC1 Amb18285174 [0,1,0,1,0,0|1,0,1]=4 8769 B9R1.12 C#CCOC1CNCC1 Amb21954581 [0,1,0,1,0,0|1,0,1]=4 8770 B9R1.12 C#CCOC1COCC1 Amb23598929 [0,1,0,1,0,0|1,0,1]=4 8771 B9R1.12 C#CCO[C@@H]1CNCC1 Amb25840876 [0,1,0,1,0,0|1,0,1]=4 8772 B9R1.12 C=CCCC1OCCO1 Amb25787439 [0,1,0,1,0,0|0,0,1]=3 8773 B9R1.12 C=CCOC1CNCC1 Amb18989606 [0,1,0,1,0,0|1,0,1]=4 8774 B9R1.12 C=CCOC1CNCC1 Amb21954781 [0,1,0,1,0,0|1,0,1]=4 8775 B9R1.12 CCC#CC1OCCO1 Amb24741178 [0,1,0,1,0,0|0,0,1]=3 8776 B9R1.12 CCCCB1CCCS1 Amb24616799 [0,1,0,1,0,0|1,1,0]=4 8777 B9R1.12 CCCCC1=CCCN1 Amb25810489 [0,1,0,1,0,0|2,0,0]=4 8778 B9R1.12 CCCCC1CCC=C1 Amb17674167 [0,1,0,1,0,0|2,0,0]=4 8779 B9R1.12 CCCCC1CCCC1 Amb22053873 [0,1,0,1,0,0|2,0,0]=4 8780 B9R1.12 CCCCC1CCCN1 Amb2234986 [0,1,0,1,0,0|2,0,0]=4 8781 B9R1.12 CCCCC1CCCN1 Amb22587191 [0,1,0,1,0,0|2,0,0]=4 8782 B9R1.12 CCCCC1CCCO1 Amb25238477 [0,1,0,1,0,0|1,0,0]=3 8783 B9R1.12 CCCCC1CNCC1 Amb2236116 [0,1,0,1,0,0|2,0,0]=4 8784 B9R1.12 CCCCC1CNCC1 Amb2237160 [0,1,0,1,0,0|2,0,0]=4 8785 B9R1.12 CCCCC1NCCO1 Amb25075532 [0,1,0,1,0,0|1,0,0]=3 8786 B9R1.12 CCCCC=1CCCC1 Amb22227915 [0,1,0,1,0,0|2,0,0]=4 8787 B9R1.12 CCCCC=1CCCN1 Amb24053774 [0,1,0,1,0,0|2,0,0]=4 8788 B9R1.12 CCCC[C@@H]1CCCN1 Amb25146078 [0,1,0,1,0,0|2,0,0]=4 8789 B9R1.12 CCCC[C@@H]1CNCN1 Amb24626110 [0,1,0,1,0,0|2,0,0]=4 8790 B9R1.12 CCCC[C@H]1CCCN1 Amb25075490 [0,1,0,1,0,0|2,0,0]=4 8791 B9R1.12 CCCNC1CCCC1 Amb2097979 [0,1,0,1,0,0|2,0,0]=4 8792 B9R1.12 CCCOC1CNCC1 Amb17191402 [0,1,0,1,0,0|1,0,0]=3 8793 B9R1.12 CCCO[C@@H]1CNCC1 Amb22752856 [0,1,0,1,0,0|1,0,0]=3 8794 B9R1.12 CCCSC1CCCC1 Amb25246485 [0,1,0,1,0,0|1,1,0]=4 8795 B9R1.12 CCCSC1CNCC1 Amb18292979 [0,1,0,1,0,0|1,1,0]=4 8796 B9R1.12 CCNCC1=CCCO1 Amb24609743 [0,1,0,1,0,0|1,0,1]=4 8797 B9R1.12 CCNCC1CCCN1 Amb17231855 [0,1,0,1,0,0|2,0,0]=4 8798 B9R1.12 CCNCC1CCCO1 Amb10610065 [0,1,0,1,0,0|1,0,0]=3 8799 B9R1.12 CCNC[C@H]1CCCN1 Amb25236671 [0,1,0,1,0,0|2,0,0]=4 8800 B9R1.12 CCOCC1CCCN1 Amb10608177 [0,1,0,1,0,0|2,0,0]=4 8801 B9R1.12 CCOCC1CCCN1 Amb22754022 [0,1,0,1,0,0|2,0,0]=4 8802 B9R1.12 CCOC[C@@H]1CCCN1 Amb17061648 [0,1,0,1,0,0|2,0,0]=4 8803 B9R1.12 CCOC[C@H]1CCCN1 Amb25147111 [0,1,0,1,0,0|2,0,0]=4 8804 B9R1.12 CCSCC1CCCN1 Amb18985026 [0,1,0,1,0,0|2,0,0]=4 8805 B9R1.12 CCSC[C@H]1CCCN1 Amb24725610 [0,1,0,1,0,0|2,0,0]=4 8806 B9R1.12 CC\C=C\C1OCCO1 Amb24359824 [0,1,0,1,0,0|0,0,1]=3 8807 B9R1.12 CNCCC1CCCC1 Amb18523811 [0,1,0,1,0,0|2,0,0]=4 8808 B9R1.12 CNCCC1CCCN1 Amb18291920 [0,1,0,1,0,0|2,0,0]=4 8809 B9R1.12 CNCCC1CCCO1 Amb18300050 [0,1,0,1,0,0|1,0,0]=3 8810 B9R1.12 CNCCC1COCC1 Amb18993054 [0,1,0,1,0,0|2,0,0]=4 8811 B9R1.12 CNCCN1CCCC1 Amb19115418 [0,1,0,1,0,0|2,0,0]=4 8812 B9R1.12 COCCC1CCCN1 Amb17436678 [0,1,0,1,0,0|2,0,0]=4 8813 B9R1.12 COCCC1CNCC1 Amb21959195 [0,1,0,1,0,0|2,0,0]=4 8814 B9R1.12 COCCN1CCCN1 Amb25243757 [0,1,0,1,0,0|2,0,0]=4 8815 B9R1.12 COCCN1CCCO1 Amb25261400 [0,1,0,1,0,0|2,0,0]=4 8816 B9R1.12 COCO[C@H]1CCNC1 Amb25293276 [0,1,0,1,0,0|2,0,0]=4 8817 B9R1.12 CONCC1CCCO1 Amb24467391 [0,1,0,1,0,0|2,0,0]=4 8818 B9R1.12 CONCC1OCCO1 Amb25283691 [0,1,0,1,0,0|1,0,0]=3 8819 B9R1.12 CSCCC1CCCC1 Amb25125419 [0,1,0,1,0,0|1,1,0]=4 8820 B9R1.12 CSCCC1CCCO1 Amb25121396 [0,1,0,1,0,0|1,0,0]=3 8821 B9R1.12 CSCCC1NCCS1 Amb18792524 [0,1,0,1,0,0|1,1,0]=4 8822 B9R1.12 CSCCC1OCCO1 Amb24060801 [0,1,0,1,0,0|0,0,0]=2 8823 B9R1.12 CSCOC1CCCC1 Amb24631289 [0,1,0,1,0,0|2,0,0]=4 8824 B9R1.12 ClCCCC1=CCCO1 Amb24460779 [0,1,0,1,0,0|1,0,1]=4 8825 B9R1.12 ClCCCC1CCCN1 Amb24481781 [0,1,0,1,0,0|2,0,0]=4 8826 B9R1.12 ClCCCC1OCCO1 Amb16185417 [0,1,0,1,0,0|0,0,0]=2 8827 B9R1.12 ClCCCC1OCCS1 Amb25808888 [0,1,0,1,0,0|0,1,0]=3 8828 B9R1.12 ClCCNC1CCCC1 Amb17334277 [0,1,0,1,0,0|2,0,0]=4 8829 B9R1.12 ClCCNC1COCC1 Amb25050316 [0,1,0,1,0,0|2,0,0]=4 8830 B9R1.12 ClCCOB1CCCO1 Amb25190589 [0,1,0,1,0,0|2,0,0]=4 8831 B9R1.12 ClCCOB1OCCO1 Amb24480043 [0,1,0,1,0,0|2,0,0]=4 8832 B9R1.12 ClCCOC1CCCO1 Amb25294545 [0,1,0,1,0,0|1,0,0]=3 8833 B9R1.12 ClCCOC1COCO1 Amb25808402 [0,1,0,1,0,0|2,0,0]=4 8834 B9R1.12 ClCCOC1OCCO1 Amb25180886 [0,1,0,1,0,0|1,0,0]=3 8835 B9R1.12 ClCCO[PH2]1OCCO1 Amb24522971 [0,1,0,1,0,0|2,0,0]=4 8836 B9R1.12 ClCSCC1CCCO1 Amb24733567 [0,1,0,1,0,0|2,0,0]=4 8837 B9R1.12 FCCCC1CNCC1 Amb22011551 [0,1,0,1,0,0|2,0,0]=4 8838 B9R1.12 FCCNC1CNCC1 Amb24387193 [0,1,0,1,0,0|2,0,0]=4 8839 B9R1.12 FCCNC1CSCC1 Amb24641185 [0,1,0,1,0,0|2,0,0]=4 8840 B9R1.12 FCCOC1CCCC1 Amb25715101 [0,1,0,1,0,0|1,0,0]=3 8841 B9R1.12 FCCOC1CNCC1 Amb21956716 [0,1,0,1,0,0|1,0,0]=3 8842 B9R1.12 FCCOC1CNCC1 Amb23571354 [0,1,0,1,0,0|1,0,0]=3 8843 B9R1.12 ICCCN1CCCC1 Amb25147182 [0,1,0,1,0,0|2,0,0]=4 8844 B9R1.12 ICCNC1CCCC1 Amb25268478 [0,1,0,1,0,0|2,0,0]=4 8845 B9R1.12 ICCNC1COCC1 Amb24481809 [0,1,0,1,0,0|2,0,0]=4 8846 B9R1.12 N#CCCC1CCCC1 Amb24502326 [0,1,0,1,0,0|2,0,0]=4 8847 B9R1.12 N#CCCC1OCCO1 Amb17334092 [0,1,0,1,0,0|0,0,1]=3 8848 B9R1.12 N#CCOC1CNCC1 Amb18285181 [0,1,0,1,0,0|1,0,1]=4 8849 B9R1.12 NCCCC1=NCCO1 Amb24728630 [0,1,0,1,0,0|1,0,1]=4 8850 B9R1.12 NCCCC1CCCC1 Amb10609767 [0,1,0,1,0,0|2,0,0]=4 8851 B9R1.12 NCCCC1CCCN1 Amb18642686 [0,1,0,1,0,0|2,0,0]=4 8852 B9R1.12 NCCCC1CCCO1 Amb18301442 [0,1,0,1,0,0|1,0,0]=3 8853 B9R1.12 NCCCC1CNCC1 Amb18642687 [0,1,0,1,0,0|2,0,0]=4 8854 B9R1.12 NCCCC1COCC1 Amb1090895 [0,1,0,1,0,0|2,0,0]=4 8855 B9R1.12 NCCCC1COCC1 Amb21954298 [0,1,0,1,0,0|2,0,0]=4 8856 B9R1.12 NCCCC1OCCO1 Amb17087679 [0,1,0,1,0,0|0,0,0]=2 8857 B9R1.12 NCCCN1CCCC1 Amb1154419 [0,1,0,1,0,0|2,0,0]=4 8858 B9R1.12 NCCNC1CCCC1 Amb17091017 [0,1,0,1,0,0|2,0,0]=4 8859 B9R1.12 NCCNC1CNCC1 Amb25109891 [0,1,0,1,0,0|2,0,0]=4 8860 B9R1.12 NCCNC1CSCC1 Amb18969721 [0,1,0,1,0,0|2,0,0]=4 8861 B9R1.12 NCCNN1CCCC1 Amb18062203 [0,1,0,1,0,0|2,0,0]=4 8862 B9R1.12 NCCN[C@@H]1CNCC1 Amb24645075 [0,1,0,1,0,0|2,0,0]=4 8863 B9R1.12 NCCN[C@H]1CNCC1 Amb25705264 [0,1,0,1,0,0|2,0,0]=4 8864 B9R1.12 NCCOB1CCCC1 Amb25123948 [0,1,0,1,0,0|1,0,0]=3 8865 B9R1.12 NCCOC1CCCC1 Amb10609211 [0,1,0,1,0,0|1,0,0]=3 8866 B9R1.12 NCCOC1CCCC1 Amb1127307 [0,1,0,1,0,0|1,0,0]=3 8867 B9R1.12 NCCOC1CNCC1 Amb23571377 [0,1,0,1,0,0|1,0,0]=3 8868 B9R1.12 NCCOC1CSCC1 Amb24740561 [0,1,0,1,0,0|1,0,0]=3 8869 B9R1.12 NCCSC1CCCC1 Amb19389681 [0,1,0,1,0,0|1,1,0]=4 8870 B9R1.12 NCCSC1CNCC1 Amb18988575 [0,1,0,1,0,0|1,1,0]=4 8871 B9R1.12 NCCSC1COCC1 Amb25123043 [0,1,0,1,0,0|1,1,0]=4 8872 B9R1.12 NNCCN1CCCC1 Amb22489702 [0,1,0,1,0,0|2,0,0]=4 8873 B9R1.12 NOCCC1CCCO1 Amb25269925 [0,1,0,1,0,0|2,0,0]=4 8874 B9R1.12 NOCCC1COCC1 Amb24538931 [0,1,0,1,0,0|2,0,0]=4 8875 B9R1.12 NOCCN1CCCC1 Amb17104844 [0,1,0,1,0,0|1,0,0]=3 8876 B9R1.12 O=CCCC1CCCO1 Amb22489681 [0,1,0,1,0,0|1,0,1]=4 8877 B9R1.12 O=CCCC1OCCO1 Amb10567127 [0,1,0,1,0,0|0,0,1]=3 8878 B9R1.12 O=CCOC1CCCO1 Amb18203202 [0,1,0,1,0,0|0,0,2]=4 8879 B9R1.12 O=CCOC1COCC1 Amb25081574 [0,1,0,1,0,0|0,0,2]=4 8880 B9R1.12 O=CCO[C@@H]1COCC1 Amb24481885 [0,1,0,1,0,0|0,0,2]=4 8881 B9R1.12 OCC#CC1OCCO1 Amb25346874 [0,1,0,1,0,0|0,0,2]=4 8882 B9R1.12 OCC=C=C1CCCC1 Amb24734004 [0,1,0,1,0,0|1,0,1]=4 8883 B9R1.12 OCCCC1CCCO1 Amb17939196 [0,1,0,1,0,0|1,0,0]=3 8884 B9R1.12 OCCCC1CNCC1 Amb24674180 [0,1,0,1,0,0|1,0,0]=3 8885 B9R1.12 OCCCC1COCC1 Amb25147186 [0,1,0,1,0,0|1,0,0]=3 8886 B9R1.12 OCCCC=1CCCC1 Amb24457013 [0,1,0,1,0,0|1,0,1]=4 8887 B9R1.12 OCCCC=1CCCN1 Amb24558706 [0,1,0,1,0,0|1,0,1]=4 8888 B9R1.12 OCCCN1CCCN1 Amb24591723 [0,1,0,1,0,0|2,0,0]=4 8889 B9R1.12 OCCC[C@@H]1CCCN1 Amb25145987 [0,1,0,1,0,0|1,0,0]=3 8890 B9R1.12 OCCNC1=NCCC1 Amb10976567 [0,1,0,1,0,0|1,0,1]=4 8891 B9R1.12 OCCNC1CCCC1 Amb10609474 [0,1,0,1,0,0|1,0,0]=3 8892 B9R1.12 OCCNN1CCCC1 Amb24070031 [0,1,0,1,0,0|1,0,0]=3 8893 B9R1.12 OCCNP1OCCO1 Amb24733410 [0,1,0,1,0,0|2,0,0]=4 8894 B9R1.12 OCCOB1OCCO1 Amb25246556 [0,1,0,1,0,0|2,0,0]=4 8895 B9R1.12 OCCOC1CNCC1 Amb23570376 [0,1,0,1,0,0|0,0,0]=2 8896 B9R1.12 OCCOC1COCC1 Amb25338417 [0,1,0,1,0,0|0,0,0]=2 8897 B9R1.12 OCCOC=1CCCC1 Amb25697596 [0,1,0,1,0,0|0,0,1]=3 8898 B9R1.12 OCCO[C@H]1CNCC1 Amb24381182 [0,1,0,1,0,0|0,0,0]=2 8899 B9R1.12 OCCO[C@H]1COCC1 Amb25851079 [0,1,0,1,0,0|0,0,0]=2 8900 B9R1.12 OCCSC1CNCC1 Amb18988573 [0,1,0,1,0,0|0,1,0]=3 8901 B9R1.12 OCOCC1CCCO1 Amb24505054 [0,1,0,1,0,0|2,0,0]=4 8902 B9R1.12 OCOCC1OCCO1 Amb24421989 [0,1,0,1,0,0|1,0,0]=3 8903 B9R1.12 OC\C=C\C1CCCN1 Amb25702213 [0,1,0,1,0,0|1,0,1]=4 8904 B9R1.12 OC\C=C\C1COCC1 Amb24413589 [0,1,0,1,0,0|1,0,1]=4 8905 B9R1.12 OC\C=C\[C@@H]1CCCN1 Amb24455785 [0,1,0,1,0,0|1,0,1]=4 8906 B9R1.12 SCCCC1CCCN1 Amb25737786 [0,1,0,1,0,0|1,1,0]=4 8907 B9R1.12 SCCNC1CNCC1 Amb25352003 [0,1,0,1,0,0|1,1,0]=4 8908 B9R1.12 [C-]#[N+]CCN1CCCC1 Amb1981099 [0,1,0,1,0,0|2,0,0]=4 8909 B9R1.12 [N-]=[N+]=NCC1OCCO1 Amb25072614 [0,1,0,1,0,0|2,0,0]=4 8910 B9R1.15 BrC1CCCOC1C#C Amb17940347 [0,1,0,1,0,0|1,0,1]=4 8911 B9R1.15 C#C[C@@H]1OCCC[C@@H]1O Amb25228432 [0,1,0,1,0,0|1,0,1]=4 8912 B9R1.15 C#C[C@@H]1OCCC[C@H]1Br Amb25172934 [0,1,0,1,0,0|1,0,1]=4 8913 B9R1.15 C#C[C@@H]1OCCC[C@H]1Cl Amb24740784 [0,1,0,1,0,0|1,0,1]=4 8914 B9R1.15 C#C[C@H]1CCCC[C@H]1O Amb25237297 [0,1,0,1,0,0|1,0,1]=4 8915 B9R1.15 C=CC1CCCCC1O Amb25706048 [0,1,0,1,0,0|1,0,1]=4 8916 B9R1.15 C=CC1OCCCC1N Amb25175715 [0,1,0,1,0,0|1,0,1]=4 8917 B9R1.15 C=C[C@@H]1CCCC[C@H]1O Amb22802080 [0,1,0,1,0,0|1,0,1]=4 8918 B9R1.15 C=C[C@@H]1COCC[C@H]1O Amb24618399 [0,1,0,1,0,0|0,0,2]=4 8919 B9R1.15 C=C[C@@H]1OCCC[C@@H]1Cl Amb25227410 [0,1,0,1,0,0|1,0,1]=4 8920 B9R1.15 C=C[C@@H]1OCCC[C@H]1N Amb25250863 [0,1,0,1,0,0|1,0,1]=4 8921 B9R1.15 C=C[C@H]1CCCC[C@H]1O Amb24733988 [0,1,0,1,0,0|1,0,1]=4 8922 B9R1.15 C=C[C@H]1OCCC[C@@H]1O Amb25176582 [0,1,0,1,0,0|1,0,1]=4 8923 B9R1.15 CC/1CCCC\C1=N/O Amb20619925 [0,1,0,1,0,0|1,0,1]=4 8924 B9R1.15 CC/1CCCC\C1=N\O Amb19650930 [0,1,0,1,0,0|1,0,1]=4 8925 B9R1.15 CC1CCCC=C1CO Amb25048354 [0,1,0,1,0,0|1,0,1]=4 8926 B9R1.15 CC1CCCCC1=NO Amb25355481 [0,1,0,1,0,0|1,0,1]=4 8927 B9R1.15 CC1CCCCC1C#C Amb24602567 [0,1,0,1,0,0|2,0,0]=4 8928 B9R1.15 CC1CCCCC1C=C Amb24626702 [0,1,0,1,0,0|2,0,0]=4 8929 B9R1.15 CC1CCCCC1C=O Amb18642449 [0,1,0,1,0,0|1,0,1]=4 8930 B9R1.15 CC1CCCCC1CC Amb22232355 [0,1,0,1,0,0|2,0,0]=4 8931 B9R1.15 CC1CCCCC1CO Amb25804856 [0,1,0,1,0,0|1,0,0]=3 8932 B9R1.15 CC1CCCC[C@H]1NC Amb25368676 [0,1,0,1,0,0|2,0,0]=4 8933 B9R1.15 CC1CCCNC1CN Amb24730245 [0,1,0,1,0,0|2,0,0]=4 8934 B9R1.15 CC1CCCNC1CO Amb22886363 [0,1,0,1,0,0|1,0,0]=3 8935 B9R1.15 CC1CCNCC1CC Amb18642547 [0,1,0,1,0,0|2,0,0]=4 8936 B9R1.15 CC1CCNCC1CO Amb24117064 [0,1,0,1,0,0|1,0,0]=3 8937 B9R1.15 CC1CCNCC1NC Amb25111152 [0,1,0,1,0,0|2,0,0]=4 8938 B9R1.15 CC1CNCCC1NC Amb24376691 [0,1,0,1,0,0|2,0,0]=4 8939 B9R1.15 CC1CNCCC1OC Amb22755833 [0,1,0,1,0,0|2,0,0]=4 8940 B9R1.15 CC1COCCC1CCl Amb24357003 [0,1,0,1,0,0|1,0,0]=3 8941 B9R1.15 CC1COCCC1CN Amb25274303 [0,1,0,1,0,0|1,0,0]=3 8942 B9R1.15 CC1COCCC1CO Amb24758141 [0,1,0,1,0,0|1,0,0]=3 8943 B9R1.15 CC1COCCC1NC Amb22301329 [0,1,0,1,0,0|1,0,0]=3 8944 B9R1.15 CC1NCCCC1CC Amb25727319 [0,1,0,1,0,0|2,0,0]=4 8945 B9R1.15 CC1NCCCC1CO Amb22886280 [0,1,0,1,0,0|1,0,0]=3 8946 B9R1.15 CC1NCCCC1NO Amb25377936 [0,1,0,1,0,0|2,0,0]=4 8947 B9R1.15 CC1NCCCC1OC Amb25703507 [0,1,0,1,0,0|2,0,0]=4 8948 B9R1.15 CC1OCCCC1CCl Amb24591376 [0,1,0,1,0,0|2,0,0]=4 8949 B9R1.15 CC1OCCCC1CN Amb25369111 [0,1,0,1,0,0|2,0,0]=4 8950 B9R1.15 CC1OCCNC1CN Amb25027407 [0,1,0,1,0,0|2,0,0]=4 8951 B9R1.15 CC1OCCNC1CO Amb24693650 [0,1,0,1,0,0|1,0,0]=3 8952 B9R1.15 CC1SCCNC1CC Amb18644223 [0,1,0,1,0,0|1,1,0]=4 8953 B9R1.15 CC1SCCSC1CN Amb25377004 [0,1,0,1,0,0|1,1,0]=4 8954 B9R1.15 CCC1C=CCCC1O Amb24688182 [0,1,0,1,0,0|1,0,1]=4 8955 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,1,0,1,0,0|1,0,1]=4 8956 B9R1.15 CCC1CCCCC1Br Amb19076564 [0,1,0,1,0,0|2,0,0]=4 8957 B9R1.15 CCC1CCCCC1S Amb25360773 [0,1,0,1,0,0|1,1,0]=4 8958 B9R1.15 CCC1CCCOC1O Amb25083486 [0,1,0,1,0,0|1,0,0]=3 8959 B9R1.15 CCC1CCNCC1O Amb24411485 [0,1,0,1,0,0|1,0,0]=3 8960 B9R1.15 CCC1CNCCC1=O Amb18642532 [0,1,0,1,0,0|1,0,1]=4 8961 B9R1.15 CCC1CNCCC1=O Amb23400918 [0,1,0,1,0,0|1,0,1]=4 8962 B9R1.15 CCC1CNCCC1N Amb24101086 [0,1,0,1,0,0|2,0,0]=4 8963 B9R1.15 CCC1CNCCN1C Amb22499981 [0,1,0,1,0,0|2,0,0]=4 8964 B9R1.15 CCC1CNCCN1C Amb22587615 [0,1,0,1,0,0|2,0,0]=4 8965 B9R1.15 CCC1COCCC1=O Amb25687037 [0,1,0,1,0,0|0,0,1]=3 8966 B9R1.15 CCC1COCCC1Br Amb25690185 [0,1,0,1,0,0|1,0,0]=3 8967 B9R1.15 CCC1COCCC1Cl Amb25146995 [0,1,0,1,0,0|1,0,0]=3 8968 B9R1.15 CCC1COCCC1N Amb18203224 [0,1,0,1,0,0|1,0,0]=3 8969 B9R1.15 CCC1COCCC1O Amb25317943 [0,1,0,1,0,0|0,0,0]=2 8970 B9R1.15 CCC1COCCN1N Amb24638543 [0,1,0,1,0,0|1,0,0]=3 8971 B9R1.15 CCC1COCOC1O Amb24749729 [0,1,0,1,0,0|0,0,0]=2 8972 B9R1.15 CCC1CSCCC1=O Amb24582464 [0,1,0,1,0,0|0,1,1]=4 8973 B9R1.15 CCC1OCCCC1N Amb18203225 [0,1,0,1,0,0|1,0,0]=3 8974 B9R1.15 CCC1SCCOC1O Amb24372059 [0,1,0,1,0,0|0,1,0]=3 8975 B9R1.15 CCN1CCNCC1O Amb25096086 [0,1,0,1,0,0|1,0,0]=3 8976 B9R1.15 CCN1CCNC[C@@H]1C Amb25774363 [0,1,0,1,0,0|2,0,0]=4 8977 B9R1.15 CCN1CCOC[C@H]1C Amb25791997 [0,1,0,1,0,0|1,0,0]=3 8978 B9R1.15 CC[C@@H]1C=CCC[C@@H]1O Amb25175312 [0,1,0,1,0,0|1,0,1]=4 8979 B9R1.15 CC[C@@H]1CC=CC[C@@H]1N Amb25174978 [0,1,0,1,0,0|2,0,0]=4 8980 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,1,0,1,0,0|1,0,1]=4 8981 B9R1.15 CC[C@@H]1CCCC[C@H]1N Amb25211308 [0,1,0,1,0,0|2,0,0]=4 8982 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [0,1,0,1,0,0|1,0,0]=3 8983 B9R1.15 CC[C@@H]1CCCO[C@@H]1O Amb25356336 [0,1,0,1,0,0|1,0,0]=3 8984 B9R1.15 CC[C@@H]1CCCO[C@H]1O Amb25176792 [0,1,0,1,0,0|1,0,0]=3 8985 B9R1.15 CC[C@@H]1CCNC[C@H]1N Amb24573675 [0,1,0,1,0,0|2,0,0]=4 8986 B9R1.15 CC[C@@H]1CNCCN1C Amb22587563 [0,1,0,1,0,0|2,0,0]=4 8987 B9R1.15 CC[C@@H]1CNCCN1C Amb23385293 [0,1,0,1,0,0|2,0,0]=4 8988 B9R1.15 CC[C@@H]1COCCN1N Amb24101034 [0,1,0,1,0,0|1,0,0]=3 8989 B9R1.15 CC[C@@H]1COCC[C@@H]1Cl Amb24758683 [0,1,0,1,0,0|1,0,0]=3 8990 B9R1.15 CC[C@@H]1COCC[C@H]1Cl Amb24696391 [0,1,0,1,0,0|1,0,0]=3 8991 B9R1.15 CC[C@@H]1CSCC[C@H]1O Amb24597079 [0,1,0,1,0,0|0,1,0]=3 8992 B9R1.15 CC[C@H]1CCCCC1=O Amb25093777 [0,1,0,1,0,0|1,0,1]=4 8993 B9R1.15 CC[C@H]1CCCCN1C Amb25055671 [0,1,0,1,0,0|2,0,0]=4 8994 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,1,0,1,0,0|1,0,1]=4 8995 B9R1.15 CC[C@H]1CCNC[C@@H]1N Amb24062214 [0,1,0,1,0,0|2,0,0]=4 8996 B9R1.15 CC[C@H]1CCNC[C@@H]1O Amb24624057 [0,1,0,1,0,0|1,0,0]=3 8997 B9R1.15 CC[C@H]1CCNC[C@H]1O Amb24617426 [0,1,0,1,0,0|1,0,0]=3 8998 B9R1.15 CC[C@H]1CNCCN1C Amb22587567 [0,1,0,1,0,0|2,0,0]=4 8999 B9R1.15 CC[C@H]1CNCCN1C Amb23385284 [0,1,0,1,0,0|2,0,0]=4 9000 B9R1.15 CC[C@H]1COCC[C@@H]1Cl Amb25373920 [0,1,0,1,0,0|1,0,0]=3 9001 B9R1.15 CC[C@H]1CSCCC1=O Amb25713540 [0,1,0,1,0,0|0,1,1]=4 9002 B9R1.15 CC[C@H]1CSCC[C@H]1O Amb24748323 [0,1,0,1,0,0|0,1,0]=3 9003 B9R1.15 CN1CCCCC1CBr Amb21961477 [0,1,0,1,0,0|2,0,0]=4 9004 B9R1.15 CN1CCCCC1CN Amb22587643 [0,1,0,1,0,0|2,0,0]=4 9005 B9R1.15 CN1CCCCC1CN Amb22727986 [0,1,0,1,0,0|2,0,0]=4 9006 B9R1.15 CN1CCCC[C@@H]1CCl Amb24462635 [0,1,0,1,0,0|2,0,0]=4 9007 B9R1.15 CN1CCCC[C@@H]1CN Amb24411478 [0,1,0,1,0,0|2,0,0]=4 9008 B9R1.15 CN1CCCC[C@@H]1CO Amb22744972 [0,1,0,1,0,0|1,0,0]=3 9009 B9R1.15 CN1CCNCC1CC Amb10607749 [0,1,0,1,0,0|2,0,0]=4 9010 B9R1.15 CN1CCNCC1CO Amb17578109 [0,1,0,1,0,0|2,0,0]=4 9011 B9R1.15 CN1CCNCC1CO Amb22587293 [0,1,0,1,0,0|2,0,0]=4 9012 B9R1.15 CN1CCNC[C@@H]1CO Amb25224131 [0,1,0,1,0,0|2,0,0]=4 9013 B9R1.15 CN1CCOCC1C#N Amb19888951 [0,1,0,1,0,0|2,0,0]=4 9014 B9R1.15 CN1CCOCC1CN Amb18560558 [0,1,0,1,0,0|2,0,0]=4 9015 B9R1.15 CN1CCOCC1CN Amb22755071 [0,1,0,1,0,0|2,0,0]=4 9016 B9R1.15 CN1CCOC[C@H]1CN Amb24556108 [0,1,0,1,0,0|2,0,0]=4 9017 B9R1.15 CN1CSCCC1CO Amb25178703 [0,1,0,1,0,0|2,0,0]=4 9018 B9R1.15 CNC1CCCCC1Br Amb25078116 [0,1,0,1,0,0|2,0,0]=4 9019 B9R1.15 CNC1CCCCC1C Amb1116060 [0,1,0,1,0,0|2,0,0]=4 9020 B9R1.15 CNC1CCCCC1Cl Amb25147050 [0,1,0,1,0,0|2,0,0]=4 9021 B9R1.15 CNC1CCCCC1F Amb23443827 [0,1,0,1,0,0|2,0,0]=4 9022 B9R1.15 CNC1CCCCC1N Amb24120327 [0,1,0,1,0,0|2,0,0]=4 9023 B9R1.15 CNC1CCCCC1S Amb18644222 [0,1,0,1,0,0|1,1,0]=4 9024 B9R1.15 CNC1CCNCC1F Amb24332448 [0,1,0,1,0,0|2,0,0]=4 9025 B9R1.15 CNC1CCOCC1O Amb25145591 [0,1,0,1,0,0|0,0,0]=2 9026 B9R1.15 CNC1COCCC1O Amb24759355 [0,1,0,1,0,0|1,0,0]=3 9027 B9R1.15 CN[C@@H]1CCCC[C@@H]1O Amb1993808 [0,1,0,1,0,0|1,0,0]=3 9028 B9R1.15 CN[C@@H]1CCCC[C@@H]1O Amb1993919 [0,1,0,1,0,0|1,0,0]=3 9029 B9R1.15 CN[C@@H]1CCCC[C@H]1Cl Amb25201193 [0,1,0,1,0,0|2,0,0]=4 9030 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993807 [0,1,0,1,0,0|1,0,0]=3 9031 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993918 [0,1,0,1,0,0|1,0,0]=3 9032 B9R1.15 CN[C@H]1CCCC[C@H]1O Amb22230420 [0,1,0,1,0,0|1,0,0]=3 9033 B9R1.15 COC1CCCCC1Br Amb18321009 [0,1,0,1,0,0|2,0,0]=4 9034 B9R1.15 COC1CCCCC1I Amb25189979 [0,1,0,1,0,0|2,0,0]=4 9035 B9R1.15 COC1CCCCC1N Amb23438872 [0,1,0,1,0,0|2,0,0]=4 9036 B9R1.15 COC1CCNCC1F Amb25286219 [0,1,0,1,0,0|2,0,0]=4 9037 B9R1.15 COC1CCNCC1N Amb25845660 [0,1,0,1,0,0|2,0,0]=4 9038 B9R1.15 COC1CCOCC1N Amb18203181 [0,1,0,1,0,0|1,0,0]=3 9039 B9R1.15 COC1CNCCC1N Amb18642809 [0,1,0,1,0,0|2,0,0]=4 9040 B9R1.15 COC1CNCCC1N Amb24078985 [0,1,0,1,0,0|2,0,0]=4 9041 B9R1.15 COC1CNCCC1O Amb24624663 [0,1,0,1,0,0|2,0,0]=4 9042 B9R1.15 COC1COCCC1=O Amb20241319 [0,1,0,1,0,0|1,0,1]=4 9043 B9R1.15 COC1COCCC1Cl Amb25826366 [0,1,0,1,0,0|1,0,0]=3 9044 B9R1.15 COC1COCCC1O Amb25733031 [0,1,0,1,0,0|1,0,0]=3 9045 B9R1.15 COC1CSSCC1O Amb25846097 [0,1,0,1,0,0|1,1,0]=4 9046 B9R1.15 COC1OCCCC1Br Amb24480249 [0,1,0,1,0,0|2,0,0]=4 9047 B9R1.15 COC1OCCCC1N Amb18203180 [0,1,0,1,0,0|2,0,0]=4 9048 B9R1.15 COC1OCCCC1O Amb25284546 [0,1,0,1,0,0|2,0,0]=4 9049 B9R1.15 CO[C@@H]1CCCC[C@@H]1Cl Amb25237965 [0,1,0,1,0,0|2,0,0]=4 9050 B9R1.15 CO[C@@H]1CCCC[C@@H]1N Amb25026218 [0,1,0,1,0,0|2,0,0]=4 9051 B9R1.15 CO[C@@H]1CCCC[C@@H]1O Amb24671865 [0,1,0,1,0,0|1,0,0]=3 9052 B9R1.15 CO[C@@H]1CCCC[C@H]1Cl Amb24511330 [0,1,0,1,0,0|2,0,0]=4 9053 B9R1.15 CO[C@@H]1CCCC[C@H]1O Amb17940177 [0,1,0,1,0,0|1,0,0]=3 9054 B9R1.15 CO[C@@H]1CCNC[C@@H]1O Amb25691574 [0,1,0,1,0,0|1,0,0]=3 9055 B9R1.15 CO[C@@H]1CCNC[C@H]1N Amb24062216 [0,1,0,1,0,0|2,0,0]=4 9056 B9R1.15 CO[C@@H]1CCNC[C@H]1O Amb23439820 [0,1,0,1,0,0|1,0,0]=3 9057 B9R1.15 CO[C@@H]1CCOC[C@@H]1N Amb23385325 [0,1,0,1,0,0|1,0,0]=3 9058 B9R1.15 CO[C@@H]1CCOC[C@H]1N Amb23385321 [0,1,0,1,0,0|1,0,0]=3 9059 B9R1.15 CO[C@@H]1CNCC[C@@H]1N Amb25758868 [0,1,0,1,0,0|2,0,0]=4 9060 B9R1.15 CO[C@@H]1COCCC1=O Amb22232585 [0,1,0,1,0,0|1,0,1]=4 9061 B9R1.15 CO[C@@H]1COCC[C@@H]1N Amb23385243 [0,1,0,1,0,0|1,0,0]=3 9062 B9R1.15 CO[C@@H]1COCC[C@@H]1N Amb25274460 [0,1,0,1,0,0|1,0,0]=3 9063 B9R1.15 CO[C@@H]1COCC[C@H]1N Amb22405971 [0,1,0,1,0,0|1,0,0]=3 9064 B9R1.15 CO[C@@H]1COCC[C@H]1N Amb23385335 [0,1,0,1,0,0|1,0,0]=3 9065 B9R1.15 CO[C@@H]1COCC[C@H]1O Amb25236062 [0,1,0,1,0,0|1,0,0]=3 9066 B9R1.15 CO[C@@H]1CSSC[C@@H]1O Amb24642453 [0,1,0,1,0,0|1,1,0]=4 9067 B9R1.15 CO[C@@H]1OCCC[C@@H]1Cl Amb25230640 [0,1,0,1,0,0|2,0,0]=4 9068 B9R1.15 CO[C@@H]1OCCC[C@H]1Br Amb25176058 [0,1,0,1,0,0|2,0,0]=4 9069 B9R1.15 CO[C@@H]1OCCC[C@H]1Cl Amb25252267 [0,1,0,1,0,0|2,0,0]=4 9070 B9R1.15 CO[C@@H]1OCCO[C@H]1O Amb24544437 [0,1,0,1,0,0|1,0,0]=3 9071 B9R1.15 CO[C@H]1CCCC[C@@H]1O Amb22047253 [0,1,0,1,0,0|1,0,0]=3 9072 B9R1.15 CO[C@H]1CCOC[C@H]1N Amb25175868 [0,1,0,1,0,0|1,0,0]=3 9073 B9R1.15 CO[C@H]1CNCC[C@H]1O Amb24555090 [0,1,0,1,0,0|2,0,0]=4 9074 B9R1.15 CO[C@H]1COCC[C@@H]1N Amb22405973 [0,1,0,1,0,0|1,0,0]=3 9075 B9R1.15 CO[C@H]1COCC[C@H]1N Amb22405969 [0,1,0,1,0,0|1,0,0]=3 9076 B9R1.15 CSC1CCCCC1Cl Amb24434409 [0,1,0,1,0,0|2,0,0]=4 9077 B9R1.15 CSC1CCCCC1F Amb24382198 [0,1,0,1,0,0|2,0,0]=4 9078 B9R1.15 CSC1CCCCC1N Amb18644219 [0,1,0,1,0,0|2,0,0]=4 9079 B9R1.15 CSC1CCCC[C@H]1O Amb24431892 [0,1,0,1,0,0|1,0,0]=3 9080 B9R1.15 CS[C@H]1CCCC[C@@H]1N Amb25175699 [0,1,0,1,0,0|2,0,0]=4 9081 B9R1.15 CS[C@H]1CCCC[C@@H]1O Amb24424734 [0,1,0,1,0,0|1,0,0]=3 9082 B9R1.15 C[C@@H]1CCCC[C@@H]1CC Amb25294655 [0,1,0,1,0,0|2,0,0]=4 9083 B9R1.15 C[C@@H]1CCCC[C@@H]1CO Amb24623715 [0,1,0,1,0,0|1,0,0]=3 9084 B9R1.15 C[C@@H]1CCCC[C@@H]1NC Amb25194970 [0,1,0,1,0,0|2,0,0]=4 9085 B9R1.15 C[C@@H]1CCCC[C@H]1CC Amb22231655 [0,1,0,1,0,0|2,0,0]=4 9086 B9R1.15 C[C@@H]1CCCC[C@H]1CN Amb24532395 [0,1,0,1,0,0|2,0,0]=4 9087 B9R1.15 C[C@@H]1CCCC[C@H]1CO Amb22801055 [0,1,0,1,0,0|1,0,0]=3 9088 B9R1.15 C[C@@H]1CCNC[C@@H]1NC Amb20670806 [0,1,0,1,0,0|2,0,0]=4 9089 B9R1.15 C[C@@H]1NCCC[C@H]1CN Amb18832593 [0,1,0,1,0,0|2,0,0]=4 9090 B9R1.15 C[C@@H]1OCCC[C@H]1CO Amb24620879 [0,1,0,1,0,0|1,0,0]=3 9091 B9R1.15 C[C@@H]1OCCN[C@H]1CO Amb22746961 [0,1,0,1,0,0|1,0,0]=3 9092 B9R1.15 C[C@H]1CC=CO[C@@H]1CO Amb24723035 [0,1,0,1,0,0|0,0,1]=3 9093 B9R1.15 C[C@H]1CCCC[C@@H]1C=O Amb25209797 [0,1,0,1,0,0|1,0,1]=4 9094 B9R1.15 C[C@H]1CCCC[C@H]1CC Amb22230296 [0,1,0,1,0,0|2,0,0]=4 9095 B9R1.15 C[C@H]1CCCC[C@H]1NC Amb25742534 [0,1,0,1,0,0|2,0,0]=4 9096 B9R1.15 C[C@H]1CCCC[C@H]1NN Amb24617509 [0,1,0,1,0,0|2,0,0]=4 9097 B9R1.15 C[C@H]1CCCN[C@@H]1CO Amb24586494 [0,1,0,1,0,0|1,0,0]=3 9098 B9R1.15 C[C@H]1CCCN[C@H]1CO Amb24594233 [0,1,0,1,0,0|1,0,0]=3 9099 B9R1.15 C[C@H]1CCCO[C@@H]1C=O Amb24513078 [0,1,0,1,0,0|0,0,2]=4 9100 B9R1.15 C[C@H]1CCCO[C@H]1NC Amb25230636 [0,1,0,1,0,0|2,0,0]=4 9101 B9R1.15 C[C@H]1CCNC[C@H]1CC Amb25293642 [0,1,0,1,0,0|2,0,0]=4 9102 B9R1.15 C[C@H]1NCCC[C@@H]1CO Amb25240361 [0,1,0,1,0,0|1,0,0]=3 9103 B9R1.15 C[C@H]1OCCC[C@H]1CO Amb24705727 [0,1,0,1,0,0|1,0,0]=3 9104 B9R1.15 C[C@H]1SCCN[C@@H]1CC Amb24629253 [0,1,0,1,0,0|1,1,0]=4 9105 B9R1.15 C\C=C/1\CCCCC1O Amb24423432 [0,1,0,1,0,0|1,0,1]=4 9106 B9R1.15 C\C=C/1\CCCC[C@@H]1O Amb25686294 [0,1,0,1,0,0|1,0,1]=4 9107 B9R1.15 C\C=C/1\CCCC[C@H]1O Amb25271855 [0,1,0,1,0,0|1,0,1]=4 9108 B9R1.15 ClC1CCCCC1CBr Amb24714673 [0,1,0,1,0,0|2,0,0]=4 9109 B9R1.15 ClCC1CCCCN1C Amb10068244 [0,1,0,1,0,0|2,0,0]=4 9110 B9R1.15 FC1CNCCC1CF Amb25252979 [0,1,0,1,0,0|2,0,0]=4 9111 B9R1.15 N#CC1CCOCC1O Amb25065507 [0,1,0,1,0,0|0,0,1]=3 9112 B9R1.15 N#CC1OCCCC1Br Amb22236125 [0,1,0,1,0,0|1,0,1]=4 9113 B9R1.15 N#CC1OCCCC1Cl Amb24480239 [0,1,0,1,0,0|1,0,1]=4 9114 B9R1.15 N#C[C@@H]1CCCC[C@H]1O Amb1993741 [0,1,0,1,0,0|1,0,1]=4 9115 B9R1.15 N#C[C@@H]1CCNC[C@H]1O Amb24674088 [0,1,0,1,0,0|1,0,1]=4 9116 B9R1.15 N#C[C@@H]1CCOC[C@H]1O Amb24577057 [0,1,0,1,0,0|0,0,1]=3 9117 B9R1.15 N#C[C@@H]1COCC[C@H]1O Amb24585140 [0,1,0,1,0,0|1,0,1]=4 9118 B9R1.15 NC1CCCCC1CBr Amb25032122 [0,1,0,1,0,0|2,0,0]=4 9119 B9R1.15 NC1CCCCC1CCl Amb24477720 [0,1,0,1,0,0|2,0,0]=4 9120 B9R1.15 NC1CCCCC1CI Amb24688098 [0,1,0,1,0,0|2,0,0]=4 9121 B9R1.15 NC1CCCCC1CO Amb19515684 [0,1,0,1,0,0|1,0,0]=3 9122 B9R1.15 NC1CCCCC1CS Amb25758424 [0,1,0,1,0,0|1,1,0]=4 9123 B9R1.15 NC1CCCOC1CO Amb25223947 [0,1,0,1,0,0|0,0,0]=2 9124 B9R1.15 NC1CCOCC1CN Amb19515155 [0,1,0,1,0,0|2,0,0]=4 9125 B9R1.15 NC1CCOCC1CO Amb22491259 [0,1,0,1,0,0|1,0,0]=3 9126 B9R1.15 NC1CCSCC1CO Amb25223538 [0,1,0,1,0,0|1,1,0]=4 9127 B9R1.15 NC1COCCC1CO Amb24480308 [0,1,0,1,0,0|1,0,0]=3 9128 B9R1.15 NC1COCNC1CO Amb25259239 [0,1,0,1,0,0|2,0,0]=4 9129 B9R1.15 NCC1CCCCC1=O Amb18203259 [0,1,0,1,0,0|2,0,0]=4 9130 B9R1.15 NCC1CCCCC1C Amb10610368 [0,1,0,1,0,0|2,0,0]=4 9131 B9R1.15 NCC1CCCCC1Cl Amb25146158 [0,1,0,1,0,0|2,0,0]=4 9132 B9R1.15 NCC1CCCCC1O Amb22228582 [0,1,0,1,0,0|1,0,0]=3 9133 B9R1.15 NCC1CCOCC1O Amb18203182 [0,1,0,1,0,0|0,0,0]=2 9134 B9R1.15 NCC1CCSCC1F Amb25248743 [0,1,0,1,0,0|1,1,0]=4 9135 B9R1.15 NCC1COCCC1=O Amb25136587 [0,1,0,1,0,0|1,0,1]=4 9136 B9R1.15 NCC1COCCC1F Amb25322615 [0,1,0,1,0,0|2,0,0]=4 9137 B9R1.15 NCC1COCCC1O Amb18561401 [0,1,0,1,0,0|1,0,0]=3 9138 B9R1.15 NCC1OCCCC1O Amb18203183 [0,1,0,1,0,0|1,0,0]=3 9139 B9R1.15 NC[C@@H]1CCCC[C@@H]1N Amb1993783 [0,1,0,1,0,0|2,0,0]=4 9140 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Amb1993737 [0,1,0,1,0,0|1,0,0]=3 9141 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Amb1993771 [0,1,0,1,0,0|1,0,0]=3 9142 B9R1.15 NC[C@@H]1CCCC[C@H]1N Amb1993785 [0,1,0,1,0,0|2,0,0]=4 9143 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb1993738 [0,1,0,1,0,0|1,0,0]=3 9144 B9R1.15 NC[C@@H]1CCNC[C@@H]1O Amb24425962 [0,1,0,1,0,0|1,0,0]=3 9145 B9R1.15 NC[C@@H]1CCNC[C@H]1O Amb25756301 [0,1,0,1,0,0|1,0,0]=3 9146 B9R1.15 NC[C@@H]1COCC[C@H]1O Amb25293842 [0,1,0,1,0,0|1,0,0]=3 9147 B9R1.15 NC[C@@H]1OCNC[C@@H]1O Amb25327056 [0,1,0,1,0,0|2,0,0]=4 9148 B9R1.15 NC[C@@H]1OCOC[C@@H]1O Amb25367500 [0,1,0,1,0,0|1,0,0]=3 9149 B9R1.15 NC[C@H]1COCC[C@H]1O Amb24757788 [0,1,0,1,0,0|1,0,0]=3 9150 B9R1.15 NN1CCCCC1CO Amb24704204 [0,1,0,1,0,0|1,0,0]=3 9151 B9R1.15 NN1CCCC[C@H]1CO Amb25066310 [0,1,0,1,0,0|1,0,0]=3 9152 B9R1.15 NNC1CCCCC1C Amb10610508 [0,1,0,1,0,0|2,0,0]=4 9153 B9R1.15 NNC1CCOCC1O Amb25090625 [0,1,0,1,0,0|1,0,0]=3 9154 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb10608261 [0,1,0,1,0,0|2,0,0]=4 9155 B9R1.15 NN[C@@H]1CCCC[C@H]1O Amb22754030 [0,1,0,1,0,0|2,0,0]=4 9156 B9R1.15 N[C@@H]1CCCC[C@@H]1CN Amb19374536 [0,1,0,1,0,0|2,0,0]=4 9157 B9R1.15 N[C@@H]1CCCC[C@@H]1CO Amb22230419 [0,1,0,1,0,0|1,0,0]=3 9158 B9R1.15 N[C@@H]1CCCC[C@@H]1NO Amb25349448 [0,1,0,1,0,0|2,0,0]=4 9159 B9R1.15 N[C@@H]1COCC[C@@H]1CO Amb25200349 [0,1,0,1,0,0|1,0,0]=3 9160 B9R1.15 N[C@H]1CCCC[C@@H]1CN Amb24612401 [0,1,0,1,0,0|2,0,0]=4 9161 B9R1.15 N[C@H]1CCCC[C@H]1NO Amb25347870 [0,1,0,1,0,0|2,0,0]=4 9162 B9R1.15 N[C@H]1COCC[C@H]1CO Amb25026124 [0,1,0,1,0,0|1,0,0]=3 9163 B9R1.15 O=C1CCCCC1CI Amb24667741 [0,1,0,1,0,0|2,0,0]=4 9164 B9R1.15 OC1C=CCOC1CO Amb25702117 [0,1,0,1,0,0|0,0,2]=4 9165 B9R1.15 OC1CC=CCC1CO Amb25345062 [0,1,0,1,0,0|1,0,1]=4 9166 B9R1.15 OC1CC=COC1CO Amb24482017 [0,1,0,1,0,0|0,0,2]=4 9167 B9R1.15 OC1CCCCC1C=O Amb25350532 [0,1,0,1,0,0|1,0,1]=4 9168 B9R1.15 OC1CCCCC1CI Amb24355837 [0,1,0,1,0,0|1,0,0]=3 9169 B9R1.15 OC1CCCNC1CO Amb25105455 [0,1,0,1,0,0|1,0,0]=3 9170 B9R1.15 OC1CCCOC1CO Amb25740025 [0,1,0,1,0,0|0,0,0]=2 9171 B9R1.15 OC1CCNCC1CO Amb22727975 [0,1,0,1,0,0|2,0,0]=4 9172 B9R1.15 OC1CCNNC1CO Amb24354292 [0,1,0,1,0,0|2,0,0]=4 9173 B9R1.15 OC1CCSCC1CO Amb25257039 [0,1,0,1,0,0|1,1,0]=4 9174 B9R1.15 OC1CNCCC1CO Amb22298269 [0,1,0,1,0,0|1,0,0]=3 9175 B9R1.15 OC1CNCCC1CO Amb22886290 [0,1,0,1,0,0|1,0,0]=3 9176 B9R1.15 OCC1=CCCCC1O Amb25083485 [0,1,0,1,0,0|1,0,1]=4 9177 B9R1.15 OCC1CCCCC1=O Amb16231080 [0,1,0,1,0,0|1,0,0]=3 9178 B9R1.15 OCC1CCCCC1Br Amb25320883 [0,1,0,1,0,0|1,0,0]=3 9179 B9R1.15 OCC1CCCCC1F Amb25216302 [0,1,0,1,0,0|1,0,0]=3 9180 B9R1.15 OCC1CCCCN1Cl Amb24475026 [0,1,0,1,0,0|1,0,0]=3 9181 B9R1.15 OCC1CCCOC1=O Amb25234377 [0,1,0,1,0,0|2,0,0]=4 9182 B9R1.15 OCC1CCNCC1F Amb25278099 [0,1,0,1,0,0|2,0,0]=4 9183 B9R1.15 OCC1OCCNC1=O Amb25235028 [0,1,0,1,0,0|1,0,1]=4 9184 B9R1.15 OC[C@@H]1CCCC[C@@H]1N Amb1993772 [0,1,0,1,0,0|1,0,0]=3 9185 B9R1.15 OC[C@@H]1CCCC[C@H]1N Amb1993740 [0,1,0,1,0,0|1,0,0]=3 9186 B9R1.15 OC[C@@H]1CCCC[C@H]1N Amb1993773 [0,1,0,1,0,0|1,0,0]=3 9187 B9R1.15 OC[C@@H]1CCCOC1=O Amb25051434 [0,1,0,1,0,0|2,0,0]=4 9188 B9R1.15 OC[C@@H]1CCNC[C@@H]1F Amb23439393 [0,1,0,1,0,0|2,0,0]=4 9189 B9R1.15 OC[C@@H]1CCNC[C@@H]1F Amb24077308 [0,1,0,1,0,0|2,0,0]=4 9190 B9R1.15 OC[C@H]1CCNC[C@@H]1F Amb25230797 [0,1,0,1,0,0|2,0,0]=4 9191 B9R1.15 ON[C@@H]1CCCC[C@H]1Cl Amb24710265 [0,1,0,1,0,0|2,0,0]=4 9192 B9R1.15 O[C@@H]1CC=CC[C@@H]1CO Amb24733847 [0,1,0,1,0,0|1,0,1]=4 9193 B9R1.15 O[C@@H]1CCC=C[C@@H]1CO Amb24582605 [0,1,0,1,0,0|1,0,1]=4 9194 B9R1.15 O[C@@H]1CCCC[C@H]1CBr Amb25258313 [0,1,0,1,0,0|1,0,0]=3 9195 B9R1.15 O[C@@H]1CCCN[C@H]1CO Amb25174874 [0,1,0,1,0,0|1,0,0]=3 9196 B9R1.15 O[C@@H]1CCNC[C@@H]1CO Amb24517217 [0,1,0,1,0,0|2,0,0]=4 9197 B9R1.15 O[C@@H]1CCNC[C@H]1CO Amb22753677 [0,1,0,1,0,0|2,0,0]=4 9198 B9R1.15 O[C@@H]1CNCC[C@@H]1CO Amb22750649 [0,1,0,1,0,0|1,0,0]=3 9199 B9R1.15 O[C@@H]1CNCC[C@@H]1CO Amb22757875 [0,1,0,1,0,0|1,0,0]=3 9200 B9R1.15 O[C@@H]1CNCC[C@H]1CO Amb22757887 [0,1,0,1,0,0|1,0,0]=3 9201 B9R1.15 O[C@@H]1CNCC[C@H]1CO Amb22757970 [0,1,0,1,0,0|1,0,0]=3 9202 B9R1.15 O[C@H]1CC=CO[C@@H]1CO Amb25303086 [0,1,0,1,0,0|0,0,2]=4 9203 B9R1.15 O[C@H]1CCCS[C@H]1CO Amb25306370 [0,1,0,1,0,0|0,1,0]=3 9204 B9R1.15 O[C@H]1CCNC[C@H]1CO Amb25175076 [0,1,0,1,0,0|2,0,0]=4 9205 B9R1.15 O[C@H]1CCSC[C@H]1CO Amb24733358 [0,1,0,1,0,0|1,1,0]=4 9206 B9R1.15 [C-]#[N+]C1CCCCC1O Amb25129067 [0,1,0,1,0,0|1,0,1]=4 9207 B9R1.15 [C-]#[N+][C@H]1CCCC[C@@H]1O Amb25239946 [0,1,0,1,0,0|1,0,1]=4 9208 B9R1.18 CCCC1CC1CNC Amb18315990 [0,1,0,1,0,0|2,0,0]=4 9209 B9R1.18 CCC[C@@H]1O[C@@H]1CCC Amb24578282 [0,1,0,1,0,0|1,0,0]=3 9210 B9R1.18 CCC[C@@H]1O[C@@H]1CCO Amb25175335 [0,1,0,1,0,0|0,0,0]=2 9211 B9R1.18 CCC[C@H]1O[C@H]1CNC Amb24606155 [0,1,0,1,0,0|1,0,0]=3 9212 B9R1.18 CNC[C@@H]1O[C@@H]1CNC Amb24721167 [0,1,0,1,0,0|2,0,0]=4 9213 B9R1.18 ClCCC1OC1CCCl Amb24351522 [0,1,0,1,0,0|2,0,0]=4 9214 B9R1.18 ClCC[C@@H]1C[C@H]1CCCl Amb24516834 [0,1,0,1,0,0|2,0,0]=4 9215 B9R1.18 OCCC1OC1CCO Amb24060961 [0,1,0,1,0,0|1,0,0]=3 9216 B9R1.18 OCC[C@H]1C[C@H]1CCO Amb25854340 [0,1,0,1,0,0|1,0,0]=3 9217 B9R1.20 C#C[C@H]1O[C@H]1CCCO Amb25271497 [0,1,0,1,0,0|1,0,1]=4 9218 B9R1.20 C=CC1OC1CCCBr Amb25053962 [0,1,0,1,0,0|1,0,1]=4 9219 B9R1.20 C=CC1OC1CCCCl Amb25115353 [0,1,0,1,0,0|1,0,1]=4 9220 B9R1.20 C=CCCC1CC1CO Amb25855737 [0,1,0,1,0,0|1,0,1]=4 9221 B9R1.20 C=CCCC1OC1CCl Amb25252873 [0,1,0,1,0,0|1,0,1]=4 9222 B9R1.20 C=C[C@H]1O[C@H]1CCCO Amb24733209 [0,1,0,1,0,0|1,0,1]=4 9223 B9R1.20 CC#CCC1OC1CO Amb24663336 [0,1,0,1,0,0|0,0,1]=3 9224 B9R1.20 CC#CC[C@@H]1O[C@@H]1CO Amb24583792 [0,1,0,1,0,0|0,0,1]=3 9225 B9R1.20 CCC1CC1CNCC Amb18523852 [0,1,0,1,0,0|2,0,0]=4 9226 B9R1.20 CCC1CC1NCCF Amb24532902 [0,1,0,1,0,0|2,0,0]=4 9227 B9R1.20 CCC1CC1NCCO Amb24382253 [0,1,0,1,0,0|1,0,0]=3 9228 B9R1.20 CCC1CC1OCCCl Amb24391608 [0,1,0,1,0,0|1,0,0]=3 9229 B9R1.20 CCC1OC1CCCBr Amb25701545 [0,1,0,1,0,0|1,0,0]=3 9230 B9R1.20 CCCCC1=CC1CO Amb24520760 [0,1,0,1,0,0|1,0,0]=3 9231 B9R1.20 CCCCC1CC1CBr Amb25251333 [0,1,0,1,0,0|2,0,0]=4 9232 B9R1.20 CCCCC1OC1CBr Amb24480230 [0,1,0,1,0,0|1,0,0]=3 9233 B9R1.20 CCCCC=1CC1CO Amb25741443 [0,1,0,1,0,0|1,0,0]=3 9234 B9R1.20 CCCCN1NC1CC Amb24481718 [0,1,0,1,0,0|2,0,0]=4 9235 B9R1.20 CCCC[C@@H]1C[C@@H]1CO Amb25326700 [0,1,0,1,0,0|1,0,0]=3 9236 B9R1.20 CCCC[C@@H]1O[C@@H]1CN Amb25245206 [0,1,0,1,0,0|1,0,0]=3 9237 B9R1.20 CCCC[C@@H]1O[C@@H]1CO Amb25296361 [0,1,0,1,0,0|0,0,0]=2 9238 B9R1.20 CCCC[C@@H]1O[C@H]1C=O Amb24562977 [0,1,0,1,0,0|0,0,2]=4 9239 B9R1.20 CCCC[C@@H]1O[C@H]1CCl Amb24656042 [0,1,0,1,0,0|1,0,0]=3 9240 B9R1.20 CCCC[C@@H]1O[C@H]1CO Amb24745811 [0,1,0,1,0,0|0,0,0]=2 9241 B9R1.20 CCCNC1CC1CC Amb25047142 [0,1,0,1,0,0|2,0,0]=4 9242 B9R1.20 CC[C@H]1O[C@H]1CCCBr Amb24649326 [0,1,0,1,0,0|1,0,0]=3 9243 B9R1.20 CC\C=C\[C@@H]1O[C@H]1CO Amb24515222 [0,1,0,1,0,0|0,0,1]=3 9244 B9R1.20 COCCC1OC1CCl Amb24621023 [0,1,0,1,0,0|1,0,0]=3 9245 B9R1.20 C\C=C\CC1OC1CO Amb24430775 [0,1,0,1,0,0|0,0,1]=3 9246 B9R1.20 O=CC1OC1CCCBr Amb24480119 [0,1,0,1,0,0|0,0,2]=4 9247 B9R1.20 O=C[C@H]1O[C@@H]1CCCBr Amb25274101 [0,1,0,1,0,0|0,0,2]=4 9248 B9R1.20 OCC1CC1CCCBr Amb24739463 [0,1,0,1,0,0|1,0,0]=3 9249 B9R1.20 OCC1CC1CCCO Amb24609877 [0,1,0,1,0,0|1,0,0]=3 9250 B9R1.20 OCCCC1=CC1CO Amb24449674 [0,1,0,1,0,0|1,0,1]=4 9251 B9R1.20 OC[C@@H]1C[C@H]1CCCBr Amb25294333 [0,1,0,1,0,0|1,0,0]=3 9252 B9R1.20 OC[C@H]1C[C@H]1CCCBr Amb24519446 [0,1,0,1,0,0|1,0,0]=3 9253 B9R1.20 OC[C@H]1O[C@@H]1CCCBr Amb24602447 [0,1,0,1,0,0|0,0,0]=2 9254 B9R1.20 [N-]=[N+]=NC[C@@H]1O[C@H]1CO Amb24612067 [0,1,0,1,0,0|2,0,0]=4 9255 B9R1.22 C=C1CC(O)C(C1)CO Amb25080201 [0,1,0,1,0,0|2,0,0]=4 9256 B9R1.22 CC1CC(=C)OC1CO Amb25220526 [0,1,0,1,0,0|0,0,1]=3 9257 B9R1.22 CC1CC(=O)CC1CC Amb25032178 [0,1,0,1,0,0|2,0,0]=4 9258 B9R1.22 CC1CC(=O)OC1CBr Amb25240937 [0,1,0,1,0,0|1,0,1]=4 9259 B9R1.22 CC1CC(=O)OC1CCl Amb24480344 [0,1,0,1,0,0|1,0,1]=4 9260 B9R1.22 CC1CC(=O)OC1CN Amb25300550 [0,1,0,1,0,0|1,0,1]=4 9261 B9R1.22 CC1CC(=O)O[C@@H]1CN Amb25222804 [0,1,0,1,0,0|1,0,1]=4 9262 B9R1.22 CC1CC(C)C=C1CO Amb25304354 [0,1,0,1,0,0|1,0,1]=4 9263 B9R1.22 CC1CC(C)NC1CO Amb24562309 [0,1,0,1,0,0|1,0,0]=3 9264 B9R1.22 CC1CC(CC)C(O)O1 Amb25065208 [0,1,0,1,0,0|2,0,0]=4 9265 B9R1.22 CC1CC(CO)C(C)C1 Amb25246590 [0,1,0,1,0,0|1,0,0]=3 9266 B9R1.22 CC1CC(O)C(CO)O1 Amb24379808 [0,1,0,1,0,0|1,0,0]=3 9267 B9R1.22 CC1OC(C)CC1CO Amb25286847 [0,1,0,1,0,0|2,0,0]=4 9268 B9R1.22 CC1OC(CBr)C(C)O1 Amb25123682 [0,1,0,1,0,0|2,0,0]=4 9269 B9R1.22 CCC1CC(=O)CC1O Amb25237318 [0,1,0,1,0,0|1,0,0]=3 9270 B9R1.22 CCC1CN(C)CC1N Amb18203238 [0,1,0,1,0,0|2,0,0]=4 9271 B9R1.22 CCC1OC(=O)CC1O Amb25788884 [0,1,0,1,0,0|2,0,0]=4 9272 B9R1.22 CCC1OC(O)CC1O Amb24583689 [0,1,0,1,0,0|2,0,0]=4 9273 B9R1.22 CC[C@@H]1CC(=O)C[C@H]1O Amb24534308 [0,1,0,1,0,0|1,0,0]=3 9274 B9R1.22 CC[C@@H]1NC(=O)C[C@@H]1O Amb25258693 [0,1,0,1,0,0|2,0,0]=4 9275 B9R1.22 CC[C@@H]1NC(=O)C[C@H]1O Amb24513054 [0,1,0,1,0,0|2,0,0]=4 9276 B9R1.22 CC[C@H]1CC(=O)C[C@H]1O Amb24575930 [0,1,0,1,0,0|1,0,0]=3 9277 B9R1.22 CC[C@H]1CC(=O)OC1O Amb25725427 [0,1,0,1,0,0|2,0,0]=4 9278 B9R1.22 CC[C@H]1NC(=O)C[C@@H]1O Amb24374772 [0,1,0,1,0,0|2,0,0]=4 9279 B9R1.22 CC[C@H]1OC(=O)C[C@@H]1O Amb25195896 [0,1,0,1,0,0|2,0,0]=4 9280 B9R1.22 CN1CC(F)CC1CO Amb24753799 [0,1,0,1,0,0|2,0,0]=4 9281 B9R1.22 CN1CC(S)CC1CO Amb24745804 [0,1,0,1,0,0|2,0,0]=4 9282 B9R1.22 CN1C[C@@H](C[C@H]1CO)N Amb15701329 [0,1,0,1,0,0|2,0,0]=4 9283 B9R1.22 CN1C[C@@H](N)C[C@H]1CO Amb22587281 [0,1,0,1,0,0|2,0,0]=4 9284 B9R1.22 CN1C[C@@H](N)C[C@H]1CO Amb23385232 [0,1,0,1,0,0|2,0,0]=4 9285 B9R1.22 CN1C[C@@H](O)C[C@@H]1CO Amb22746005 [0,1,0,1,0,0|2,0,0]=4 9286 B9R1.22 CN1C[C@H](O)C[C@H]1CO Amb19888613 [0,1,0,1,0,0|2,0,0]=4 9287 B9R1.22 CN[C@@H]1CN(C)C[C@H]1O Amb22748756 [0,1,0,1,0,0|2,0,0]=4 9288 B9R1.22 CN[C@H]1CN(C[C@@H]1O)C Amb10608283 [0,1,0,1,0,0|2,0,0]=4 9289 B9R1.22 CO[C@@H]1CN(N)C[C@H]1O Amb24692182 [0,1,0,1,0,0|2,0,0]=4 9290 B9R1.22 C[C@@H]1CC(=O)O[C@@H]1CO Amb25176497 [0,1,0,1,0,0|0,0,1]=3 9291 B9R1.22 C[C@@H]1CC(O)O[C@@H]1CC Amb25343890 [0,1,0,1,0,0|1,0,0]=3 9292 B9R1.22 C[C@@H]1CN(C)C[C@H]1CO Amb24746976 [0,1,0,1,0,0|2,0,0]=4 9293 B9R1.22 C[C@@H]1C[C@H](O)[C@H](CBr)O1 Amb24670452 [0,1,0,1,0,0|2,0,0]=4 9294 B9R1.22 C[C@H]1CC(=O)C[C@H]1CC Amb25179756 [0,1,0,1,0,0|2,0,0]=4 9295 B9R1.22 C[C@H]1CC(=O)N[C@H]1CO Amb25175007 [0,1,0,1,0,0|1,0,1]=4 9296 B9R1.22 C[C@H]1CC(=O)O[C@@H]1CBr Amb25210841 [0,1,0,1,0,0|1,0,1]=4 9297 B9R1.22 C[C@H]1CC(=O)O[C@H]1CCl Amb24554768 [0,1,0,1,0,0|1,0,1]=4 9298 B9R1.22 C[C@H]1CC(=O)O[C@H]1CO Amb25175374 [0,1,0,1,0,0|0,0,1]=3 9299 B9R1.22 C[C@H]1C[C@@H](O)[C@H](CBr)O1 Amb24744758 [0,1,0,1,0,0|2,0,0]=4 9300 B9R1.22 N[C@@H]1C[C@H](O)[C@@H](C1)CO Amb24669226 [0,1,0,1,0,0|2,0,0]=4 9301 B9R1.22 OC1CC(=O)OC1CO Amb24356603 [0,1,0,1,0,0|1,0,1]=4 9302 B9R1.22 OC1CC(O)OC1CBr Amb25241638 [0,1,0,1,0,0|2,0,0]=4 9303 B9R1.22 OCC1OC(O)CC1O Amb25288402 [0,1,0,1,0,0|1,0,0]=3 9304 B9R1.22 OC[C@@H]1C[C@H](CN1C)O Amb13883425 [0,1,0,1,0,0|2,0,0]=4 9305 B9R1.22 OC[C@@H]1O[C@@H](O)C[C@H]1O Amb25174943 [0,1,0,1,0,0|1,0,0]=3 9306 B9R1.22 OC[C@@H]1O[C@H](O)C[C@H]1O Amb25174953 [0,1,0,1,0,0|1,0,0]=3 9307 B9R1.22 OC[C@H]1OC(O)C[C@H]1O Amb24553841 [0,1,0,1,0,0|1,0,0]=3 9308 B9R1.22 O[C@@H]1CC(=O)O[C@@H]1CO Amb24515317 [0,1,0,1,0,0|1,0,1]=4 9309 B9R1.22 O[C@@H]1CC(=O)O[C@H]1CO Amb22748461 [0,1,0,1,0,0|1,0,1]=4 9310 B9R1.22 O[C@H]1CC(=O)OC1CO Amb24404778 [0,1,0,1,0,0|1,0,1]=4 9311 B9R1.22 O[C@H]1CC(=O)O[C@@H]1CO Amb20242107 [0,1,0,1,0,0|1,0,1]=4 9312 B9R1.22 O[C@H]1C[C@@H](O)O[C@@H]1CBr Amb25746537 [0,1,0,1,0,0|2,0,0]=4 9313 B9R1.22 O[C@H]1C[C@H](O)O[C@@H]1CBr Amb24656066 [0,1,0,1,0,0|2,0,0]=4 9314 B9R1.27 CC1CCC(=C)C1CO Amb25110751 [0,1,0,1,0,0|1,0,0]=3 9315 B9R1.27 CC1CCC(=O)C1CO Amb25730008 [0,1,0,1,0,0|1,0,0]=3 9316 B9R1.27 CC1CCC(=O)N1CO Amb25741531 [0,1,0,1,0,0|2,0,0]=4 9317 B9R1.27 CC1CCC(C)C1CO Amb24435966 [0,1,0,1,0,0|1,0,0]=3 9318 B9R1.27 CC1CCC(F)C1CN Amb20623959 [0,1,0,1,0,0|2,0,0]=4 9319 B9R1.27 CC1CCC(N)C1CF Amb20623960 [0,1,0,1,0,0|2,0,0]=4 9320 B9R1.27 CC1CCC(N)C1CN Amb20622976 [0,1,0,1,0,0|2,0,0]=4 9321 B9R1.27 CC1CCC(N)C1CO Amb20623115 [0,1,0,1,0,0|1,0,0]=3 9322 B9R1.27 CC1CCC(O)C1CN Amb20623190 [0,1,0,1,0,0|2,0,0]=4 9323 B9R1.27 CC1CCN(C)C1CN Amb25032134 [0,1,0,1,0,0|2,0,0]=4 9324 B9R1.27 CC1CCN(C)C1CO Amb25831248 [0,1,0,1,0,0|1,0,0]=3 9325 B9R1.27 CC1CCN(N)C1CC Amb25240673 [0,1,0,1,0,0|2,0,0]=4 9326 B9R1.27 CC=1CCC(C)C1CO Amb25676436 [0,1,0,1,0,0|1,0,1]=4 9327 B9R1.27 CCC1C(O)CCN1C Amb18832553 [0,1,0,1,0,0|2,0,0]=4 9328 B9R1.27 CCC1C(O)COC1=O Amb24420023 [0,1,0,1,0,0|0,0,1]=3 9329 B9R1.27 CC[C@@H]1[C@@H](O)COC1=O Amb25332099 [0,1,0,1,0,0|0,0,1]=3 9330 B9R1.27 CC[C@H]1[C@H](O)CCC1=C Amb25315615 [0,1,0,1,0,0|1,0,1]=4 9331 B9R1.27 CN1CCC(N)C1CO Amb25180472 [0,1,0,1,0,0|2,0,0]=4 9332 B9R1.27 C[C@@H]1CCC(=C)[C@H]1CO Amb24550174 [0,1,0,1,0,0|1,0,0]=3 9333 B9R1.27 C[C@@H]1CCC(=O)[C@H]1CO Amb24616665 [0,1,0,1,0,0|1,0,0]=3 9334 B9R1.27 C[C@@H]1CCC(O)[C@H]1CO Amb24595460 [0,1,0,1,0,0|1,0,0]=3 9335 B9R1.27 C[C@@H]1CC[C@@H](C)P1CO Amb24644202 [0,1,0,1,0,0|2,0,0]=4 9336 B9R1.27 C[C@@H]1CC[C@H](O)[C@@H]1CO Amb24555582 [0,1,0,1,0,0|1,0,0]=3 9337 B9R1.27 C[C@H]1CCC(=O)[C@H]1CC Amb24512736 [0,1,0,1,0,0|2,0,0]=4 9338 B9R1.27 C[C@H]1CCC(O)[C@@H]1CO Amb24576528 [0,1,0,1,0,0|1,0,0]=3 9339 B9R1.27 C[C@H]1COC(O)[C@@H]1OC Amb25382120 [0,1,0,1,0,0|2,0,0]=4 9340 B9R1.33 C#CCC1CCCC1O Amb24720084 [0,1,0,1,0,0|1,0,1]=4 9341 B9R1.33 C#CCC1CSCC1O Amb24684410 [0,1,0,1,0,0|0,1,1]=4 9342 B9R1.33 C=C1CCCC1CCO Amb25714493 [0,1,0,1,0,0|1,0,1]=4 9343 B9R1.33 C=CCC1COCC1O Amb25802917 [0,1,0,1,0,0|0,0,1]=3 9344 B9R1.33 C=CCC1CSCC1O Amb24481666 [0,1,0,1,0,0|0,1,1]=4 9345 B9R1.33 C=CC[C@@H]1CCC[C@H]1O Amb25215733 [0,1,0,1,0,0|1,0,1]=4 9346 B9R1.33 C=CC[C@@H]1COC[C@@H]1N Amb24562137 [0,1,0,1,0,0|1,0,1]=4 9347 B9R1.33 CC#CC1CCCC1O Amb25781551 [0,1,0,1,0,0|1,0,1]=4 9348 B9R1.33 CC#C[C@@H]1CCC[C@H]1O Amb25277131 [0,1,0,1,0,0|1,0,1]=4 9349 B9R1.33 CC1=NCCN1CCO Amb24089674 [0,1,0,1,0,0|1,0,1]=4 9350 B9R1.33 CC1CCCC1=CCO Amb25855774 [0,1,0,1,0,0|1,0,1]=4 9351 B9R1.33 CC1CCCC1CCN Amb25147053 [0,1,0,1,0,0|2,0,0]=4 9352 B9R1.33 CC1CCCC1CCO Amb25219174 [0,1,0,1,0,0|1,0,0]=3 9353 B9R1.33 CC1CCCC1CNC Amb25810046 [0,1,0,1,0,0|2,0,0]=4 9354 B9R1.33 CC1CCCC1NCC Amb18282857 [0,1,0,1,0,0|2,0,0]=4 9355 B9R1.33 CC1CCCN1CCBr Amb18317658 [0,1,0,1,0,0|2,0,0]=4 9356 B9R1.33 CC1CCCN1CCCl Amb25688283 [0,1,0,1,0,0|2,0,0]=4 9357 B9R1.33 CC1CCCN1CCN Amb18962426 [0,1,0,1,0,0|2,0,0]=4 9358 B9R1.33 CC1CCCN1CCO Amb25236089 [0,1,0,1,0,0|1,0,0]=3 9359 B9R1.33 CC1CCNC1CSC Amb24653301 [0,1,0,1,0,0|1,1,0]=4 9360 B9R1.33 CC1CCOC1CNC Amb25234483 [0,1,0,1,0,0|1,0,0]=3 9361 B9R1.33 CC1CCOC1CNN Amb24448936 [0,1,0,1,0,0|1,0,0]=3 9362 B9R1.33 CC1CCOC1N=C=O Amb25317668 [0,1,0,1,0,0|0,0,2]=4 9363 B9R1.33 CC1CNCC1OCC Amb25312131 [0,1,0,1,0,0|2,0,0]=4 9364 B9R1.33 CC1CSCC1NCC Amb24701881 [0,1,0,1,0,0|1,1,0]=4 9365 B9R1.33 CC1NCCC1CCC Amb18961055 [0,1,0,1,0,0|2,0,0]=4 9366 B9R1.33 CC1NCCN1CCN Amb24499798 [0,1,0,1,0,0|2,0,0]=4 9367 B9R1.33 CC1NCCN1CCO Amb24477786 [0,1,0,1,0,0|1,0,0]=3 9368 B9R1.33 CC1OCCC1CCN Amb25769636 [0,1,0,1,0,0|2,0,0]=4 9369 B9R1.33 CC1OCCN1CCN Amb24629713 [0,1,0,1,0,0|2,0,0]=4 9370 B9R1.33 CCCC1CCCC1Br Amb18329730 [0,1,0,1,0,0|2,0,0]=4 9371 B9R1.33 CCCC1CCCC1N Amb18954322 [0,1,0,1,0,0|2,0,0]=4 9372 B9R1.33 CCCC1CCCN1N Amb25700027 [0,1,0,1,0,0|2,0,0]=4 9373 B9R1.33 CCCC1CCOC1O Amb25346331 [0,1,0,1,0,0|1,0,0]=3 9374 B9R1.33 CCCC1CSCC1Cl Amb24701882 [0,1,0,1,0,0|1,1,0]=4 9375 B9R1.33 CCCC1CSCC1N Amb18199840 [0,1,0,1,0,0|1,1,0]=4 9376 B9R1.33 CCCC1NCCS1=O Amb24744981 [0,1,0,1,0,0|1,0,1]=4 9377 B9R1.33 CCCC1OCCC1Br Amb25372833 [0,1,0,1,0,0|1,0,0]=3 9378 B9R1.33 CCCN1OCCC1=O Amb24581636 [0,1,0,1,0,0|1,0,1]=4 9379 B9R1.33 CCC[C@@H]1CC=C[C@H]1O Amb25343780 [0,1,0,1,0,0|1,0,1]=4 9380 B9R1.33 CCC[C@@H]1CCC[C@H]1O Amb24519919 [0,1,0,1,0,0|1,0,0]=3 9381 B9R1.33 CCC[C@@H]1OCC[C@@H]1Cl Amb25359005 [0,1,0,1,0,0|1,0,0]=3 9382 B9R1.33 CCC[C@H]1CCC[C@@H]1O Amb24588282 [0,1,0,1,0,0|1,0,0]=3 9383 B9R1.33 CCC[C@H]1CNC[C@H]1O Amb24574536 [0,1,0,1,0,0|1,0,0]=3 9384 B9R1.33 CCC[C@H]1SCC[C@H]1O Amb25261777 [0,1,0,1,0,0|0,1,0]=3 9385 B9R1.33 CCNC1CCCC1Cl Amb25359522 [0,1,0,1,0,0|2,0,0]=4 9386 B9R1.33 CCNC1CCCC1N Amb23559232 [0,1,0,1,0,0|2,0,0]=4 9387 B9R1.33 CCNC1CCCC1O Amb17231860 [0,1,0,1,0,0|1,0,0]=3 9388 B9R1.33 CCNC1COCC1Cl Amb25798510 [0,1,0,1,0,0|1,0,0]=3 9389 B9R1.33 CCNC1COCC1O Amb18281482 [0,1,0,1,0,0|0,0,0]=2 9390 B9R1.33 CCN[C@@H]1CNC[C@H]1O Amb25051222 [0,1,0,1,0,0|1,0,0]=3 9391 B9R1.33 CCN[C@@H]1COC[C@H]1O Amb22748740 [0,1,0,1,0,0|0,0,0]=2 9392 B9R1.33 CCN[C@H]1COC[C@@H]1O Amb10608161 [0,1,0,1,0,0|0,0,0]=2 9393 B9R1.33 CCOC1CCCC1Br Amb18321006 [0,1,0,1,0,0|2,0,0]=4 9394 B9R1.33 CCOC1CCCC1N Amb1138244 [0,1,0,1,0,0|2,0,0]=4 9395 B9R1.33 CCOC1CNCC1O Amb25231812 [0,1,0,1,0,0|1,0,0]=3 9396 B9R1.33 CCOC1COCC1Br Amb24481875 [0,1,0,1,0,0|1,0,0]=3 9397 B9R1.33 CCOC1COCC1O Amb24412051 [0,1,0,1,0,0|0,0,0]=2 9398 B9R1.33 CCOC1OCCC1Br Amb24415385 [0,1,0,1,0,0|2,0,0]=4 9399 B9R1.33 CCO[C@@H]1CCC[C@H]1O Amb24595865 [0,1,0,1,0,0|1,0,0]=3 9400 B9R1.33 CCO[C@@H]1CNC[C@H]1O Amb25737699 [0,1,0,1,0,0|1,0,0]=3 9401 B9R1.33 CCO[C@@H]1COC[C@H]1N Amb22748739 [0,1,0,1,0,0|1,0,0]=3 9402 B9R1.33 CCO[C@@H]1COC[C@H]1N Amb22757836 [0,1,0,1,0,0|1,0,0]=3 9403 B9R1.33 CCO[C@@H]1OCC[C@H]1Cl Amb25275013 [0,1,0,1,0,0|2,0,0]=4 9404 B9R1.33 CCO[C@@H]1OCC[C@H]1O Amb25234800 [0,1,0,1,0,0|1,0,0]=3 9405 B9R1.33 CCO[C@H]1CCC[C@@H]1O Amb25206651 [0,1,0,1,0,0|1,0,0]=3 9406 B9R1.33 CCO[C@H]1COC[C@@H]1N Amb10608157 [0,1,0,1,0,0|1,0,0]=3 9407 B9R1.33 CCO[C@H]1OCC[C@H]1Cl Amb25238328 [0,1,0,1,0,0|2,0,0]=4 9408 B9R1.33 CCSC1CCCC1N Amb20623771 [0,1,0,1,0,0|2,0,0]=4 9409 B9R1.33 CCSC1CCCC1O Amb25296680 [0,1,0,1,0,0|1,0,0]=3 9410 B9R1.33 CCSC1CNCC1O Amb24423349 [0,1,0,1,0,0|1,0,0]=3 9411 B9R1.33 CCSC1COCC1O Amb24482016 [0,1,0,1,0,0|0,0,0]=2 9412 B9R1.33 CCS[C@@H]1CCC[C@H]1O Amb24721171 [0,1,0,1,0,0|1,0,0]=3 9413 B9R1.33 CCS[C@@H]1CNC[C@H]1O Amb24724294 [0,1,0,1,0,0|1,0,0]=3 9414 B9R1.33 CN1CCCC1CCBr Amb20668048 [0,1,0,1,0,0|2,0,0]=4 9415 B9R1.33 CN1CCCC1CCBr Amb24478647 [0,1,0,1,0,0|2,0,0]=4 9416 B9R1.33 CN1CCC[C@@H]1CCN Amb22386854 [0,1,0,1,0,0|2,0,0]=4 9417 B9R1.33 CN1CCC[C@@H]1CCN Amb23400917 [0,1,0,1,0,0|2,0,0]=4 9418 B9R1.33 CN1CCC[C@@H]1CCO Amb22755468 [0,1,0,1,0,0|1,0,0]=3 9419 B9R1.33 CN1CCC[C@H]1CCCl Amb24582218 [0,1,0,1,0,0|2,0,0]=4 9420 B9R1.33 CN1CCC[C@H]1CCN Amb20241159 [0,1,0,1,0,0|2,0,0]=4 9421 B9R1.33 CNCC1CCCC1Cl Amb25828695 [0,1,0,1,0,0|2,0,0]=4 9422 B9R1.33 CNCC1CCCC1N Amb25734644 [0,1,0,1,0,0|2,0,0]=4 9423 B9R1.33 CNCC1CCCC1O Amb18642712 [0,1,0,1,0,0|1,0,0]=3 9424 B9R1.33 CNCC1COCC1N Amb24684660 [0,1,0,1,0,0|1,0,0]=3 9425 B9R1.33 CNC[C@@H]1CCC[C@@H]1O Amb24621807 [0,1,0,1,0,0|1,0,0]=3 9426 B9R1.33 CNC[C@@H]1CCC[C@H]1O Amb24514887 [0,1,0,1,0,0|1,0,0]=3 9427 B9R1.33 CNC[C@H]1OCC[C@@H]1O Amb24713437 [0,1,0,1,0,0|1,0,0]=3 9428 B9R1.33 COCC1C=CCC1O Amb25079293 [0,1,0,1,0,0|1,0,1]=4 9429 B9R1.33 COCC1CCCC1Cl Amb25122722 [0,1,0,1,0,0|2,0,0]=4 9430 B9R1.33 COCC1CCCC1N Amb22504262 [0,1,0,1,0,0|2,0,0]=4 9431 B9R1.33 COCC1CCCC1O Amb25223631 [0,1,0,1,0,0|1,0,0]=3 9432 B9R1.33 COCC1CCOC1O Amb24525756 [0,1,0,1,0,0|2,0,0]=4 9433 B9R1.33 COCC1CNCC1N Amb25185302 [0,1,0,1,0,0|2,0,0]=4 9434 B9R1.33 COCC1CNCC1O Amb25835045 [0,1,0,1,0,0|1,0,0]=3 9435 B9R1.33 COCC1SCCC1O Amb24622734 [0,1,0,1,0,0|1,1,0]=4 9436 B9R1.33 COC[C@@H]1CCCN1C Amb24613634 [0,1,0,1,0,0|2,0,0]=4 9437 B9R1.33 COC[C@@H]1CCC[C@@H]1N Amb22748722 [0,1,0,1,0,0|2,0,0]=4 9438 B9R1.33 COC[C@@H]1CCC[C@@H]1O Amb25175346 [0,1,0,1,0,0|1,0,0]=3 9439 B9R1.33 COC[C@H]1CCC[C@H]1N Amb10607714 [0,1,0,1,0,0|2,0,0]=4 9440 B9R1.33 COC[C@H]1CNC[C@@H]1O Amb24555085 [0,1,0,1,0,0|1,0,0]=3 9441 B9R1.33 CONC1CCCC1O Amb24355658 [0,1,0,1,0,0|2,0,0]=4 9442 B9R1.33 CON[C@@H]1CNC[C@H]1O Amb24703688 [0,1,0,1,0,0|2,0,0]=4 9443 B9R1.33 CSC[C@@H]1CNC[C@H]1O Amb24658258 [0,1,0,1,0,0|1,0,0]=3 9444 B9R1.33 CSC[C@H]1CNC[C@@H]1O Amb25174892 [0,1,0,1,0,0|1,0,0]=3 9445 B9R1.33 C\C=C\C1CCCC1O Amb24620765 [0,1,0,1,0,0|1,0,1]=4 9446 B9R1.33 N#CCC1CCCC1O Amb18642327 [0,1,0,1,0,0|1,0,1]=4 9447 B9R1.33 N#CC[C@@H]1CCC[C@H]1O Amb24623352 [0,1,0,1,0,0|1,0,1]=4 9448 B9R1.33 NC1CCCC1CCF Amb25112523 [0,1,0,1,0,0|2,0,0]=4 9449 B9R1.33 NCCC1CCCC1Cl Amb24385086 [0,1,0,1,0,0|2,0,0]=4 9450 B9R1.33 NCCC1CCCC1O Amb18832551 [0,1,0,1,0,0|1,0,0]=3 9451 B9R1.33 NCCC1CNCC1F Amb24563622 [0,1,0,1,0,0|2,0,0]=4 9452 B9R1.33 NCCC1CSCC1F Amb25178500 [0,1,0,1,0,0|1,1,0]=4 9453 B9R1.33 N[C@@H]1CCC[C@H]1CCBr Amb24627054 [0,1,0,1,0,0|2,0,0]=4 9454 B9R1.33 O=CC[C@@H]1OCC[C@@H]1Cl Amb25258391 [0,1,0,1,0,0|1,0,1]=4 9455 B9R1.33 OC1C=CCC1CCO Amb25282917 [0,1,0,1,0,0|1,0,1]=4 9456 B9R1.33 OC1CCCC1CCBr Amb24480210 [0,1,0,1,0,0|1,0,0]=3 9457 B9R1.33 OC1CSCC1CCF Amb24734066 [0,1,0,1,0,0|0,1,0]=3 9458 B9R1.33 OCC[C@H]1OCCC1=O Amb25730039 [0,1,0,1,0,0|1,0,1]=4 9459 B9R1.33 O[C@@H]1CC=C[C@@H]1CCO Amb25236260 [0,1,0,1,0,0|1,0,1]=4 9460 B9R1.33 O[C@@H]1COC[C@H]1NC=O Amb25696684 [0,1,0,1,0,0|1,0,1]=4 9461 B9R1.33 O[C@H]1C=CC[C@H]1CCO Amb25252869 [0,1,0,1,0,0|1,0,1]=4 9462 B9R1.33 [N-]=[N+]=N[C@@H]1COC[C@@H]1O Amb25208523 [0,1,0,1,0,0|2,0,0]=4 9463 B9R1.48 C=C1CC(O)CCCC1 Amb25045697 [0,1,0,1,0,0|1,0,0]=3 9464 B9R1.48 C=C1CC(O)COCC1 Amb25854214 [0,1,0,1,0,0|0,0,1]=3 9465 B9R1.48 CC1CC(C)CNCC1 Amb20622727 [0,1,0,1,0,0|2,0,0]=4 9466 B9R1.48 CC1CC(C)NCCN1 Amb18832587 [0,1,0,1,0,0|2,0,0]=4 9467 B9R1.48 CC1CC(Cl)CCCC1 Amb25147199 [0,1,0,1,0,0|2,0,0]=4 9468 B9R1.48 CC1CC(N)CCCC1 Amb25842051 [0,1,0,1,0,0|2,0,0]=4 9469 B9R1.48 CC1CC(O)CCNC1 Amb25725421 [0,1,0,1,0,0|2,0,0]=4 9470 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|2,0,0]=4 9471 B9R1.48 CC1CCCCC(O)O1 Amb24752219 [0,1,0,1,0,0|1,0,0]=3 9472 B9R1.48 CC1CNCCC(C)N1 Amb24740219 [0,1,0,1,0,0|2,0,0]=4 9473 B9R1.48 CC1CNCCC(C)S1 Amb24475559 [0,1,0,1,0,0|1,1,0]=4 9474 B9R1.48 CN1CC(Cl)CCCC1 Amb24532544 [0,1,0,1,0,0|2,0,0]=4 9475 B9R1.48 CN1CC(F)CCCC1 Amb25823034 [0,1,0,1,0,0|2,0,0]=4 9476 B9R1.48 CN1CC(N)CCCC1 Amb19516791 [0,1,0,1,0,0|2,0,0]=4 9477 B9R1.48 CN1CCOCC(C1)N Amb16233734 [0,1,0,1,0,0|2,0,0]=4 9478 B9R1.48 C[C@@H]1CC(=O)CCCC1 Amb25044345 [0,1,0,1,0,0|2,0,0]=4 9479 B9R1.48 C[C@@H]1C[C@@H](O)CCCC1 Amb24593171 [0,1,0,1,0,0|1,0,0]=3 9480 B9R1.48 C[C@H]1C[C@@H](O)C=CCC1 Amb24620795 [0,1,0,1,0,0|1,0,1]=4 9481 B9R1.48 C[C@H]1C[C@@H](O)CCCC1 Amb25221381 [0,1,0,1,0,0|1,0,0]=3 9482 B9R1.48 Cl[C@@H]1C[C@H](Cl)CCCC1 Amb24480094 [0,1,0,1,0,0|2,0,0]=4 9483 B9R1.48 Cl[C@H]1C[C@H](Cl)CCCC1 Amb24531890 [0,1,0,1,0,0|2,0,0]=4 9484 B9R1.48 NC1CC(F)CCCC1 Amb24454709 [0,1,0,1,0,0|2,0,0]=4 9485 B9R1.48 NC1CC(O)CCCC1 Amb24374638 [0,1,0,1,0,0|1,0,0]=3 9486 B9R1.48 NN1CC(O)COCC1 Amb25267305 [0,1,0,1,0,0|1,0,0]=3 9487 B9R1.48 O=C1CC(Br)CCCC1 Amb25685402 [0,1,0,1,0,0|2,0,0]=4 9488 B9R1.48 O=C1CC(Cl)CCCC1 Amb25061378 [0,1,0,1,0,0|2,0,0]=4 9489 B9R1.48 O=C1COCCC(Cl)C1 Amb25102535 [0,1,0,1,0,0|0,0,2]=4 9490 B9R1.48 OC1CC(=O)NCCC1 Amb25147021 [0,1,0,1,0,0|2,0,0]=4 9491 B9R1.48 OC1CC(O)CC=CC1 Amb25763865 [0,1,0,1,0,0|1,0,1]=4 9492 B9R1.48 OC1CC(O)CSSC1 Amb25032202 [0,1,0,1,0,0|1,1,0]=4 9493 B9R1.48 OC1CCCCC(=O)N1 Amb24477685 [0,1,0,1,0,0|2,0,0]=4 9494 B9R1.48 O[C@@H]1CCCCC(=O)O1 Amb25296333 [0,1,0,1,0,0|2,0,0]=4 9495 B9R1.48 O[C@@H]1C[C@H](O)CCCC1 Amb24556565 [0,1,0,1,0,0|1,0,0]=3 9496 B9R1.48 O[C@H]1CCCCC(=O)O1 Amb24529319 [0,1,0,1,0,0|2,0,0]=4 9497 B9R1.48 O[C@H]1CCCCC(Br)=C1 Amb24466250 [0,1,0,1,0,0|1,0,1]=4 9498 B9R1.48 O[C@H]1C[C@H](O)CCCC1 Amb25288223 [0,1,0,1,0,0|1,0,0]=3 9499 B9R1.49 C=C1CCOC(O)CC1 Amb25215779 [0,1,0,1,0,0|2,0,0]=4 9500 B9R1.49 CC1CCC(C)NCC1 Amb25339633 [0,1,0,1,0,0|2,0,0]=4 9501 B9R1.49 CC1CCC(O)OCC1 Amb24697549 [0,1,0,1,0,0|1,0,0]=3 9502 B9R1.49 CC1CCCC(=C)CC1 Amb22364866 [0,1,0,1,0,0|2,0,0]=4 9503 B9R1.49 CC1CCCC(Br)CC1 Amb24709251 [0,1,0,1,0,0|2,0,0]=4 9504 B9R1.49 CC1CCCC(N)CC1 Amb25178098 [0,1,0,1,0,0|2,0,0]=4 9505 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|1,0,0]=3 9506 B9R1.49 CC1CCN(C)CCN1 Amb18943772 [0,1,0,1,0,0|2,0,0]=4 9507 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,1,0,0|1,0,1]=4 9508 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,1,0,1,0,0|1,1,0]=4 9509 B9R1.49 CC1CNC(C)CCC1 Amb19148123 [0,1,0,1,0,0|2,0,0]=4 9510 B9R1.49 CC1CNC(C)COC1 Amb18112854 [0,1,0,1,0,0|2,0,0]=4 9511 B9R1.49 CN1CCCC(O)CC1 Amb18832552 [0,1,0,1,0,0|2,0,0]=4 9512 B9R1.49 CN1CCCC(O)CC1 Amb22751622 [0,1,0,1,0,0|2,0,0]=4 9513 B9R1.49 C[C@@H]1CCC[C@@H](O)CC1 Amb24623728 [0,1,0,1,0,0|1,0,0]=3 9514 B9R1.49 C[C@@H]1CCC[C@H](O)CC1 Amb24515396 [0,1,0,1,0,0|1,0,0]=3 9515 B9R1.49 C[C@@H]1CNCC(O)CN1 Amb24565361 [0,1,0,1,0,0|2,0,0]=4 9516 B9R1.49 C[C@@H]1CNC[C@@H](C)CC1 Amb24612413 [0,1,0,1,0,0|2,0,0]=4 9517 B9R1.49 C[C@H]1CCC(O)OCC1 Amb25051811 [0,1,0,1,0,0|1,0,0]=3 9518 B9R1.49 ClC1CCCC(Cl)CC1 Amb22364836 [0,1,0,1,0,0|2,0,0]=4 9519 B9R1.49 Cl[C@@H]1CCC[C@H](Cl)CC1 Amb24479995 [0,1,0,1,0,0|2,0,0]=4 9520 B9R1.49 NC1CCCC(Br)CC1 Amb25078711 [0,1,0,1,0,0|2,0,0]=4 9521 B9R1.49 NC1CCCC(Cl)CC1 Amb24609768 [0,1,0,1,0,0|2,0,0]=4 9522 B9R1.49 NC1CCCC(O)CC1 Amb25713454 [0,1,0,1,0,0|1,0,0]=3 9523 B9R1.49 N[C@H]1CCC[C@@H](O)C=C1 Amb24745229 [0,1,0,1,0,0|1,0,1]=4 9524 B9R1.49 N[C@H]1CCC[C@H](O)CC1 Amb24568295 [0,1,0,1,0,0|1,0,0]=3 9525 B9R1.49 OC1CCCC(O)C=C1 Amb24431858 [0,1,0,1,0,0|1,0,1]=4 9526 B9R1.49 OC1CCCC(O)CC1 Amb25680581 [0,1,0,1,0,0|1,0,0]=3 9527 B9R1.49 OC1CNC(=O)CCC1 Amb22491274 [0,1,0,1,0,0|1,0,1]=4 9528 B9R1.49 OC1CSCC(O)CC1 Amb25316350 [0,1,0,1,0,0|0,1,0]=3 9529 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [0,1,0,1,0,0|1,0,1]=4 9530 B9R1.49 O[C@@H]1CCC[C@H](O)CC1 Amb24544307 [0,1,0,1,0,0|1,0,0]=3 9531 B9R1.49 O[C@H]1CCC[C@H](O)C=C1 Amb24570019 [0,1,0,1,0,0|1,0,1]=4 9532 B9R1.50 BrC1CC=CCCCC1 Amb25794325 [0,1,0,1,0,0|2,0,0]=4 9533 B9R1.50 CC1CCCCCC=C1 Amb22229355 [0,1,0,1,0,0|2,0,0]=4 9534 B9R1.50 CC1CCCCCCC1 Amb22230834 [0,1,0,1,0,0|2,0,0]=4 9535 B9R1.50 CC1CCNCCCN1 Amb18832588 [0,1,0,1,0,0|2,0,0]=4 9536 B9R1.50 CC=1CCCCCCC1 Amb22227979 [0,1,0,1,0,0|2,0,0]=4 9537 B9R1.50 CN1CCCNCCC1 Amb18276963 [0,1,0,1,0,0|2,0,0]=4 9538 B9R1.50 CN1CCNCCCC1 Amb18832595 [0,1,0,1,0,0|2,0,0]=4 9539 B9R1.50 ClC1CCCCCCS1 Amb25102404 [0,1,0,1,0,0|1,1,0]=4 9540 B9R1.50 IC1CCCCCCC1 Amb25314159 [0,1,0,1,0,0|2,0,0]=4 9541 B9R1.50 NC1CNCCCCC1 Amb24447204 [0,1,0,1,0,0|2,0,0]=4 9542 B9R1.50 NC1CSCCCCC1 Amb25146060 [0,1,0,1,0,0|1,1,0]=4 9543 B9R1.50 O=C1CCOCCCC1 Amb25032168 [0,1,0,1,0,0|0,0,1]=3 9544 B9R1.50 O=C1CCOCCCN1 Amb24502350 [0,1,0,1,0,0|1,0,1]=4 9545 B9R1.50 OC1CC=CCCCC1 Amb25676565 [0,1,0,1,0,0|1,0,0]=3 9546 B9R1.50 OC1CC=CCCOC1 Amb22364794 [0,1,0,1,0,0|0,0,1]=3 9547 B9R1.50 OC1CCCC=CCC1 Amb21858009 [0,1,0,1,0,0|1,0,1]=4 9548 B9R1.50 OC1CCCCCC#C1 Amb24528376 [0,1,0,1,0,0|1,0,1]=4 9549 B9R1.50 OC1CCCCCC=C1 Amb22364937 [0,1,0,1,0,0|1,0,1]=4 9550 B9R1.50 OC1CCCOCCC1 Amb24632568 [0,1,0,1,0,0|1,0,0]=3 9551 B9R1.50 OC1CCOCCC=C1 Amb24582073 [0,1,0,1,0,0|0,0,2]=4 9552 B9R1.50 OC1CCOCCCC1 Amb25847873 [0,1,0,1,0,0|0,0,0]=2 9553 B9R1.50 OC1COCCCCC1 Amb22364795 [0,1,0,1,0,0|0,0,0]=2 9554 B9R1.50 OC1CSCCCC#C1 Amb25811501 [0,1,0,1,0,0|0,1,1]=4 9555 B9R1.50 O[C@@H]1CC=CCCCC1 Amb25257204 [0,1,0,1,0,0|1,0,0]=3 9556 B9R1.50 O[C@@H]1CCCC=CCC1 Amb24481888 [0,1,0,1,0,0|1,0,1]=4 9557 B9R1.50 O[C@@H]1CCCCCC=C1 Amb25781852 [0,1,0,1,0,0|1,0,1]=4 9558 B9R1.50 O[C@H]1CCCC=CCC1 Amb25781269 [0,1,0,1,0,0|1,0,1]=4 9559 B9R1.57 CC1C(CCC)C1CO Amb24370036 [0,1,0,1,0,0|1,0,0]=3 9560 B9R1.57 CCC[C@H]1[C@@H](CO)S1=O Amb25271356 [0,1,0,1,0,0|0,1,0]=3 9561 B9R1.57 CCC[C@H]1[C@@H](F)[C@@H]1CO Amb24733391 [0,1,0,1,0,0|1,0,0]=3 9562 B9R1.58 CCC1CN(CCO)C1 Amb24402628 [0,1,0,1,0,0|1,0,0]=3 9563 B9R1.58 CCCC1CC(CBr)C1 Amb23537353 [0,1,0,1,0,0|2,0,0]=4 9564 B9R1.58 CCCC1CC(CO)C1 Amb23537555 [0,1,0,1,0,0|1,0,0]=3 9565 B9R1.58 CCCN1CC(CO)C1 Amb25044451 [0,1,0,1,0,0|2,0,0]=4 9566 B9R1.58 CNC1CN(CCO)C1 Amb24518908 [0,1,0,1,0,0|2,0,0]=4 9567 B9R1.58 NCC1CN(CCO)C1 Amb25025120 [0,1,0,1,0,0|2,0,0]=4 9568 B9R1.58 NCCC1CC(CO)C1 Amb25222647 [0,1,0,1,0,0|2,0,0]=4 9569 B9R1.58 OCCC1CC(CF)C1 Amb24527522 [0,1,0,1,0,0|2,0,0]=4 9570 B9R1.58 OCCN1CC(C1)CO Amb25334435 [0,1,0,1,0,0|2,0,0]=4 9571 B9R1.69 C=C1C[C@H](O)OC[C@H]1O Amb24752147 [0,1,0,1,0,0|0,0,2]=4 9572 B9R1.69 CC1CC(=O)CCC1C Amb22732216 [0,1,0,1,0,0|2,0,0]=4 9573 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|1,0,1]=4 9574 B9R1.69 CC1CC(Br)C(C)CC1 Amb25050773 [0,1,0,1,0,0|2,0,0]=4 9575 B9R1.69 CC1CC(Br)CCC1C Amb25838066 [0,1,0,1,0,0|2,0,0]=4 9576 B9R1.69 CC1CC(C)C(Br)CC1 Amb18329561 [0,1,0,1,0,0|2,0,0]=4 9577 B9R1.69 CC1CC(C)C(N)CC1 Amb19515132 [0,1,0,1,0,0|2,0,0]=4 9578 B9R1.69 CC1CC(C)C(O)C=C1 Amb24614848 [0,1,0,1,0,0|1,0,1]=4 9579 B9R1.69 CC1CC(I)CCC1C Amb25147178 [0,1,0,1,0,0|2,0,0]=4 9580 B9R1.69 CC1CC(N)CCC1C Amb25188919 [0,1,0,1,0,0|2,0,0]=4 9581 B9R1.69 CC1CC(N)CCC1O Amb24624100 [0,1,0,1,0,0|1,0,0]=3 9582 B9R1.69 CC1CC(O)CCC1O Amb24726092 [0,1,0,1,0,0|1,0,0]=3 9583 B9R1.69 CC1CC(S)C(C)CC1 Amb25296681 [0,1,0,1,0,0|1,1,0]=4 9584 B9R1.69 CC1CCC(=C)CC1Br Amb24635906 [0,1,0,1,0,0|2,0,0]=4 9585 B9R1.69 CC1CCC(=C)CC1O Amb25333669 [0,1,0,1,0,0|1,0,0]=3 9586 B9R1.69 CC1CCC(=O)CC1Br Amb24398782 [0,1,0,1,0,0|2,0,0]=4 9587 B9R1.69 CC1CCC(C(C1)N)C Amb2099453 [0,1,0,1,0,0|2,0,0]=4 9588 B9R1.69 CC1CCC(C)=CC1O Amb25056479 [0,1,0,1,0,0|1,0,1]=4 9589 B9R1.69 CC1CCC(C)OC1O Amb24464497 [0,1,0,1,0,0|2,0,0]=4 9590 B9R1.69 CC1CCC(N)CC1N Amb25321520 [0,1,0,1,0,0|2,0,0]=4 9591 B9R1.69 CC1CCC(N)CC1O Amb24547299 [0,1,0,1,0,0|1,0,0]=3 9592 B9R1.69 CC1CCC(O)C(C)N1 Amb25145975 [0,1,0,1,0,0|2,0,0]=4 9593 B9R1.69 CC1CCC(O)C(C)O1 Amb25842535 [0,1,0,1,0,0|2,0,0]=4 9594 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [0,1,0,1,0,0|2,0,0]=4 9595 B9R1.69 CC1CCC(O)C(O)C1 Amb17939305 [0,1,0,1,0,0|2,0,0]=4 9596 B9R1.69 CC1CCC(O)CC1O Amb25847038 [0,1,0,1,0,0|1,0,0]=3 9597 B9R1.69 CC1CCN(C)CC1Br Amb25133852 [0,1,0,1,0,0|2,0,0]=4 9598 B9R1.69 CC1CCN(C)CC1Cl Amb24523999 [0,1,0,1,0,0|2,0,0]=4 9599 B9R1.69 CC1CCN(C)CC1N Amb18203239 [0,1,0,1,0,0|2,0,0]=4 9600 B9R1.69 CC1CCN(N)CC1O Amb24524067 [0,1,0,1,0,0|1,0,0]=3 9601 B9R1.69 CC1CN(C)CC[C@H]1O Amb25136838 [0,1,0,1,0,0|2,0,0]=4 9602 B9R1.69 CC1CN(N)CCC1O Amb25043238 [0,1,0,1,0,0|2,0,0]=4 9603 B9R1.69 CC1CNC(C)CC1O Amb21867988 [0,1,0,1,0,0|2,0,0]=4 9604 B9R1.69 CC1COC(=O)CC1O Amb25781910 [0,1,0,1,0,0|2,0,0]=4 9605 B9R1.69 CC1COC(O)C(C)C1 Amb25740656 [0,1,0,1,0,0|2,0,0]=4 9606 B9R1.69 CC1COC(O)CC1C Amb24333809 [0,1,0,1,0,0|1,0,0]=3 9607 B9R1.69 CC1C[C@@H](N)C(C)CC1 Amb25708996 [0,1,0,1,0,0|2,0,0]=4 9608 B9R1.69 CC1C[C@@H](O)[C@@H](O)CC1 Amb25241376 [0,1,0,1,0,0|2,0,0]=4 9609 B9R1.69 CC1C[C@@H](O)[C@H](O)CC1 Amb25175409 [0,1,0,1,0,0|2,0,0]=4 9610 B9R1.69 CC1C[C@@H](S)[C@H](O)CC1 Amb25266569 [0,1,0,1,0,0|2,0,0]=4 9611 B9R1.69 CC1C[C@H](O)[C@@H](O)CC1 Amb25240222 [0,1,0,1,0,0|2,0,0]=4 9612 B9R1.69 CC1OC(O)CCC1O Amb25092090 [0,1,0,1,0,0|2,0,0]=4 9613 B9R1.69 CC1SCC(O)CC1O Amb24421524 [0,1,0,1,0,0|2,0,0]=4 9614 B9R1.69 CN1CC(O)C(N)CC1 Amb18832535 [0,1,0,1,0,0|2,0,0]=4 9615 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1C Amb22231666 [0,1,0,1,0,0|2,0,0]=4 9616 B9R1.69 C[C@@H]1CC(N)=NC[C@H]1O Amb24068474 [0,1,0,1,0,0|1,0,1]=4 9617 B9R1.69 C[C@@H]1CC(O)CC[C@@H]1C Amb25215758 [0,1,0,1,0,0|2,0,0]=4 9618 B9R1.69 C[C@@H]1CCC(=C)C[C@H]1O Amb24666635 [0,1,0,1,0,0|1,0,0]=3 9619 B9R1.69 C[C@@H]1CCC(C)=C[C@H]1O Amb25206333 [0,1,0,1,0,0|1,0,1]=4 9620 B9R1.69 C[C@@H]1CC[C@@H](N)C[C@@H]1N Amb24561324 [0,1,0,1,0,0|2,0,0]=4 9621 B9R1.69 C[C@@H]1CC[C@@H](N)C[C@H]1O Amb25366497 [0,1,0,1,0,0|1,0,0]=3 9622 B9R1.69 C[C@@H]1CC[C@H](O)[C@H](C)N1 Amb24516976 [0,1,0,1,0,0|2,0,0]=4 9623 B9R1.69 C[C@@H]1CN[C@@H](C)C[C@H]1O Amb25175068 [0,1,0,1,0,0|2,0,0]=4 9624 B9R1.69 C[C@@H]1COC(O)C[C@@H]1C Amb25266294 [0,1,0,1,0,0|1,0,0]=3 9625 B9R1.69 C[C@@H]1C[C@@H](C)[C@@H](O)CC1 Amb24520434 [0,1,0,1,0,0|1,0,0]=3 9626 B9R1.69 C[C@@H]1C[C@@H](C)[C@H](O)CC1 Amb25315496 [0,1,0,1,0,0|1,0,0]=3 9627 B9R1.69 C[C@@H]1C[C@@H](Cl)[C@@H](C)CC1 Amb24634142 [0,1,0,1,0,0|2,0,0]=4 9628 B9R1.69 C[C@@H]1C[C@@H](N)CC[C@H]1O Amb24573275 [0,1,0,1,0,0|1,0,0]=3 9629 B9R1.69 C[C@@H]1C[C@@H](N)[C@H](C)CC1 Amb24601128 [0,1,0,1,0,0|2,0,0]=4 9630 B9R1.69 C[C@@H]1C[C@@H](O)CC[C@H]1C Amb24705627 [0,1,0,1,0,0|2,0,0]=4 9631 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](C)CC1 Amb25276352 [0,1,0,1,0,0|1,0,0]=3 9632 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](O)CC1 Amb24515640 [0,1,0,1,0,0|2,0,0]=4 9633 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](O)CO1 Amb25257664 [0,1,0,1,0,0|1,0,0]=3 9634 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](C)CC1 Amb24589067 [0,1,0,1,0,0|1,0,0]=3 9635 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](O)CC1 Amb25258757 [0,1,0,1,0,0|2,0,0]=4 9636 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](O)CO1 Amb24519786 [0,1,0,1,0,0|1,0,0]=3 9637 B9R1.69 C[C@@H]1C[C@H](C)[C@@H](C)CC1 Amb22801520 [0,1,0,1,0,0|2,0,0]=4 9638 B9R1.69 C[C@@H]1C[C@H](C)[C@H](N)CC1 Amb24612173 [0,1,0,1,0,0|2,0,0]=4 9639 B9R1.69 C[C@@H]1C[C@H](N)[C@H](C)CC1 Amb24540834 [0,1,0,1,0,0|2,0,0]=4 9640 B9R1.69 C[C@@H]1C[C@H](O)[C@@H](O)CO1 Amb24592446 [0,1,0,1,0,0|1,0,0]=3 9641 B9R1.69 C[C@@H]1C[C@H](O)[C@H](C)CC1 Amb25239717 [0,1,0,1,0,0|1,0,0]=3 9642 B9R1.69 C[C@@H]1C[C@H](O)[C@H](O)CN1 Amb25327529 [0,1,0,1,0,0|2,0,0]=4 9643 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O Amb25202720 [0,1,0,1,0,0|1,0,1]=4 9644 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|2,0,0]=4 9645 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1Cl Amb25179045 [0,1,0,1,0,0|2,0,0]=4 9646 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Br Amb25178854 [0,1,0,1,0,0|2,0,0]=4 9647 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Cl Amb25179044 [0,1,0,1,0,0|2,0,0]=4 9648 B9R1.69 C[C@H]1CCC(C)=CC1O Amb24340096 [0,1,0,1,0,0|1,0,1]=4 9649 B9R1.69 C[C@H]1CCC(C)=C[C@H]1O Amb24733593 [0,1,0,1,0,0|1,0,1]=4 9650 B9R1.69 C[C@H]1CN(C)CC[C@@H]1O Amb24683746 [0,1,0,1,0,0|2,0,0]=4 9651 B9R1.69 C[C@H]1COC(=O)C[C@H]1O Amb24516166 [0,1,0,1,0,0|2,0,0]=4 9652 B9R1.69 C[C@H]1COC(O)C[C@@H]1O Amb24646262 [0,1,0,1,0,0|2,0,0]=4 9653 B9R1.69 C[C@H]1C[C@@H](C)[C@H](O)C=C1 Amb24539315 [0,1,0,1,0,0|1,0,1]=4 9654 B9R1.69 C[C@H]1C[C@@H](C)[C@H](O)CC1 Amb25258776 [0,1,0,1,0,0|1,0,0]=3 9655 B9R1.69 C[C@H]1C[C@@H](N)[C@H](C)CC1 Amb24577949 [0,1,0,1,0,0|2,0,0]=4 9656 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1O Amb24515361 [0,1,0,1,0,0|1,0,0]=3 9657 B9R1.69 C[C@H]1C[C@@H](S)[C@H](O)CC1 Amb24520438 [0,1,0,1,0,0|2,0,0]=4 9658 B9R1.69 C[C@H]1C[C@H](C)[C@@H](C)CC1 Amb24565013 [0,1,0,1,0,0|2,0,0]=4 9659 B9R1.69 C[C@H]1C[C@H](C)[C@H](O)CC1 Amb25234825 [0,1,0,1,0,0|1,0,0]=3 9660 B9R1.69 C[C@H]1C[C@H](N)CC[C@@H]1O Amb24669791 [0,1,0,1,0,0|1,0,0]=3 9661 B9R1.69 C[C@H]1C[C@H](O)CC[C@H]1C Amb24620750 [0,1,0,1,0,0|2,0,0]=4 9662 B9R1.69 C[C@H]1OC(O)CC[C@H]1O Amb25326126 [0,1,0,1,0,0|2,0,0]=4 9663 B9R1.69 NC1CC(O)C(O)CC1 Amb25703026 [0,1,0,1,0,0|2,0,0]=4 9664 B9R1.69 N[C@@H]1C[C@@H](O)[C@H](O)CC1 Amb25227975 [0,1,0,1,0,0|2,0,0]=4 9665 B9R1.69 N[C@@H]1C[C@H](N)[C@@H](O)CC1 Amb24621973 [0,1,0,1,0,0|2,0,0]=4 9666 B9R1.69 N[C@H]1CC(Cl)[C@H](O)CC1 Amb24514989 [0,1,0,1,0,0|2,0,0]=4 9667 B9R1.69 OC1CC(=O)CCC1O Amb24384658 [0,1,0,1,0,0|2,0,0]=4 9668 B9R1.69 OC1CC(Cl)CCC1O Amb24480128 [0,1,0,1,0,0|2,0,0]=4 9669 B9R1.69 OC1CCC(C(C1)C)C Amb10844787 [0,1,0,1,0,0|2,0,0]=4 9670 B9R1.69 OC1COC(=O)CC1O Amb25057673 [0,1,0,1,0,0|1,0,1]=4 9671 B9R1.69 OC1CO[C@@H](O)CC1O Amb24712436 [0,1,0,1,0,0|1,0,0]=3 9672 B9R1.69 OC1CSC(O)CC1O Amb24613410 [0,1,0,1,0,0|1,1,0]=4 9673 B9R1.69 OC1C[C@@H](O)[C@H](O)CC1 Amb24625275 [0,1,0,1,0,0|2,0,0]=4 9674 B9R1.69 OC1OC[C@H]([C@@H](C1)O)O Amb16183698 [0,1,0,1,0,0|1,0,0]=3 9675 B9R1.69 O[C@@H]1COC(O)CC1O Amb22800953 [0,1,0,1,0,0|1,0,0]=3 9676 B9R1.69 O[C@@H]1COC(O)C[C@@H]1O Amb20240603 [0,1,0,1,0,0|1,0,0]=3 9677 B9R1.69 O[C@@H]1CSC(O)C[C@@H]1O Amb24544451 [0,1,0,1,0,0|1,1,0]=4 9678 B9R1.69 O[C@@H]1C[C@@H](O)[C@H](O)CC1 Amb24645228 [0,1,0,1,0,0|2,0,0]=4 9679 B9R1.69 O[C@@H]1C[C@H](O)[C@H](O)CC1 Amb25176285 [0,1,0,1,0,0|2,0,0]=4 9680 B9R1.69 O[C@@H]1OC[C@@H]([C@@H](C1)O)O Amb10072157 [0,1,0,1,0,0|1,0,0]=3 9681 B9R1.69 O[C@H]1COC(O)CC1O Amb25195348 [0,1,0,1,0,0|1,0,0]=3 9682 B9R1.69 O[C@H]1CO[C@@H](O)C[C@@H]1O Amb24618720 [0,1,0,1,0,0|1,0,0]=3 9683 B9R1.69 O[C@H]1C[C@@H](O)[C@@H](O)CC1 Amb24556436 [0,1,0,1,0,0|2,0,0]=4 9684 B9R1.69 O[C@H]1C[C@H](O)[C@H](O)CC1 Amb25220954 [0,1,0,1,0,0|2,0,0]=4 9685 B9R1.73 BrC(CCBr)C1CCC1 Amb23455638 [0,1,0,1,0,0|2,0,0]=4 9686 B9R1.73 CC(CCO)C1CCC1 Amb24581446 [0,1,0,1,0,0|1,0,0]=3 9687 B9R1.73 CC(CCO)C1CCO1 Amb24728455 [0,1,0,1,0,0|2,0,0]=4 9688 B9R1.73 CC(CCO)C1CNC1 Amb24639609 [0,1,0,1,0,0|2,0,0]=4 9689 B9R1.73 CC(CCO)C1CSC1 Amb24728493 [0,1,0,1,0,0|2,0,0]=4 9690 B9R1.73 CCCC(=O)C1CCC1 Amb24390209 [0,1,0,1,0,0|2,0,0]=4 9691 B9R1.73 CCCC(N)C1CCC1 Amb25374014 [0,1,0,1,0,0|2,0,0]=4 9692 B9R1.73 CCC[C@@H](O)C1CCC1 Amb24381070 [0,1,0,1,0,0|2,0,0]=4 9693 B9R1.73 CCC[C@H](O)C1CCC1 Amb24381117 [0,1,0,1,0,0|2,0,0]=4 9694 B9R1.73 CN(CCBr)C1CCC1 Amb24715108 [0,1,0,1,0,0|2,0,0]=4 9695 B9R1.73 CN(CCCl)C1CCC1 Amb24396643 [0,1,0,1,0,0|2,0,0]=4 9696 B9R1.73 CN(CCO)C1CCC1 Amb25127350 [0,1,0,1,0,0|1,0,0]=3 9697 B9R1.73 CN(CCO)C1CNC1 Amb24101188 [0,1,0,1,0,0|2,0,0]=4 9698 B9R1.73 NC(CCO)C1CNC1 Amb22296982 [0,1,0,1,0,0|2,0,0]=4 9699 B9R1.73 NCCC(F)C1CCC1 Amb25300576 [0,1,0,1,0,0|2,0,0]=4 9700 B9R1.73 NCCC(O)C1CCC1 Amb22642025 [0,1,0,1,0,0|2,0,0]=4 9701 B9R1.73 OC(CCO)C1CCC1 Amb23512730 [0,1,0,1,0,0|1,0,0]=3 9702 B9R1.73 OC(CCO)C1CNC1 Amb22298370 [0,1,0,1,0,0|2,0,0]=4 9703 B9R1.75 CC(CC1CC1)CCN Amb25188986 [0,1,0,1,0,0|2,0,0]=4 9704 B9R1.75 CC(CCC)CC1CO1 Amb25769573 [0,1,0,1,0,0|1,0,0]=3 9705 B9R1.75 CC(COC)CC1CO1 Amb24739366 [0,1,0,1,0,0|2,0,0]=4 9706 B9R1.75 CCCC(=O)OC1CC1 Amb24333393 [0,1,0,1,0,0|1,0,1]=4 9707 B9R1.75 CCCC(N)CC1CC1 Amb18832669 [0,1,0,1,0,0|2,0,0]=4 9708 B9R1.75 CCCC(O)CC1CC1 Amb25281509 [0,1,0,1,0,0|2,0,0]=4 9709 B9R1.75 CCCC(O)CC1CO1 Amb25739633 [0,1,0,1,0,0|1,0,0]=3 9710 B9R1.75 CCC[C@@H](O)CC1CC1 Amb25109763 [0,1,0,1,0,0|2,0,0]=4 9711 B9R1.75 CCC[C@H](O)CC1CC1 Amb25202528 [0,1,0,1,0,0|2,0,0]=4 9712 B9R1.75 CCC[C@H](O)C[C@@H]1CO1 Amb25221355 [0,1,0,1,0,0|1,0,0]=3 9713 B9R1.75 CN(CCBr)CC1CC1 Amb18317661 [0,1,0,1,0,0|2,0,0]=4 9714 B9R1.75 CN(CCCl)CC1CC1 Amb25843434 [0,1,0,1,0,0|2,0,0]=4 9715 B9R1.75 CN(CCN)CC1CC1 Amb18314659 [0,1,0,1,0,0|2,0,0]=4 9716 B9R1.75 CN(CCO)CC1CO1 Amb25775104 [0,1,0,1,0,0|2,0,0]=4 9717 B9R1.75 CN(CCO)C[C@@H]1CO1 Amb25026468 [0,1,0,1,0,0|2,0,0]=4 9718 B9R1.75 CN(CCO)C[C@H]1CO1 Amb25847174 [0,1,0,1,0,0|2,0,0]=4 9719 B9R1.75 NC(CC1CC1)CCO Amb24358108 [0,1,0,1,0,0|1,0,0]=3 9720 B9R1.75 NCCC(=O)CC1CC1 Amb25113049 [0,1,0,1,0,0|2,0,0]=4 9721 B9R1.75 NCCC(O)CC1CC1 Amb25274744 [0,1,0,1,0,0|2,0,0]=4 9722 B9R1.75 OC(CCO)NC1CC1 Amb24476669 [0,1,0,1,0,0|2,0,0]=4 9723 B9R1.75 OCCC(=O)NC1CC1 Amb17334105 [0,1,0,1,0,0|2,0,0]=4 9724 B9R1.75 OCCS(=O)CC1CC1 Amb25855312 [0,1,0,1,0,0|0,1,0]=3 9725 B9R1.90 C=C1CC(CO)C1CO Amb24704345 [0,1,0,1,0,0|2,0,0]=4 9726 B9R1.90 C=C1C[C@@H](CO)[C@@H]1CO Amb25261769 [0,1,0,1,0,0|2,0,0]=4 9727 B9R1.90 CC[C@H]1[C@H](CO)NC1=O Amb25174779 [0,1,0,1,0,0|1,0,1]=4 9728 B9R1.90 NC1CC(CO)C1CO Amb24472234 [0,1,0,1,0,0|2,0,0]=4 9729 B9R1.90 N[C@@H]1C[C@H](CO)[C@@H]1CO Amb24610538 [0,1,0,1,0,0|2,0,0]=4 9730 B9R1.90 OC[C@@H]1CC(=O)[C@H]1CO Amb22747124 [0,1,0,1,0,0|2,0,0]=4 9731 B9R1.90 OC[C@H]1CC(=O)[C@@H]1CO Amb25328887 [0,1,0,1,0,0|2,0,0]=4 9732 B9R1.90 O[C@@H]1C[C@@H](CO)[C@@H]1CO Amb25240032 [0,1,0,1,0,0|2,0,0]=4 9733 B9R1.100 C=C(CCCO)C1CC1 Amb24448092 [0,1,0,1,0,0|1,0,1]=4 9734 B9R1.100 CC(CCCC)C1CC1 Amb25286937 [0,1,0,1,0,0|2,0,0]=4 9735 B9R1.100 CC(CCCC)C1CO1 Amb25141603 [0,1,0,1,0,0|1,0,0]=3 9736 B9R1.100 CC(NCCF)C1CC1 Amb25758448 [0,1,0,1,0,0|2,0,0]=4 9737 B9R1.100 CC(NCCN)C1CC1 Amb18307075 [0,1,0,1,0,0|2,0,0]=4 9738 B9R1.100 CC(OCCBr)C1CC1 Amb24354443 [0,1,0,1,0,0|1,0,0]=3 9739 B9R1.100 CC(OCCN)C1CC1 Amb23537735 [0,1,0,1,0,0|1,0,0]=3 9740 B9R1.100 CC(OCCO)C1CC1 Amb25271488 [0,1,0,1,0,0|0,0,0]=2 9741 B9R1.100 CCCCC(=O)C1CO1 Amb24422064 [0,1,0,1,0,0|1,0,0]=3 9742 B9R1.100 CCCCC(=O)[C@@H]1CO1 Amb25662143 [0,1,0,1,0,0|1,0,0]=3 9743 B9R1.100 CCCC[C@H](O)[C@@H]1CO1 Amb25176377 [0,1,0,1,0,0|1,0,0]=3 9744 B9R1.100 CSCCC(O)C1CO1 Amb24760175 [0,1,0,1,0,0|2,0,0]=4 9745 B9R1.100 NCCCC(O)C1CC1 Amb18203226 [0,1,0,1,0,0|2,0,0]=4 9746 B9R1.100 O=C(OCCF)C1CC1 Amb25802526 [0,1,0,1,0,0|1,0,1]=4 9747 B9R1.100 OC(CCCF)C1CC1 Amb25262012 [0,1,0,1,0,0|2,0,0]=4 9748 B9R1.100 OCCCC(=O)C1CC1 Amb24643396 [0,1,0,1,0,0|1,0,1]=4 9749 B9R1.100 OCC\C=C(\Cl)/C1CC1 Amb24644732 [0,1,0,1,0,0|1,0,1]=4 9750 B9R1.117 CC1(CCC1)NCCN Amb25361887 [0,1,0,1,0,0|2,0,0]=4 9751 B9R1.117 CC1(CCC1)OCCN Amb24458133 [0,1,0,1,0,0|1,0,0]=3 9752 B9R1.117 CC1(CNC1)OCCN Amb24713254 [0,1,0,1,0,0|2,0,0]=4 9753 B9R1.117 CC1(CNC1)OCCO Amb25246866 [0,1,0,1,0,0|1,0,0]=3 9754 B9R1.117 CCCCC1(N)CCC1 Amb24420313 [0,1,0,1,0,0|2,0,0]=4 9755 B9R1.117 CCCNC1(C)CCC1 Amb24481745 [0,1,0,1,0,0|2,0,0]=4 9756 B9R1.117 C[Si]1(CCCO)CCC1 Amb24352441 [0,1,0,1,0,0|1,1,0]=4 9757 B9R1.117 NC1(CCCF)CCC1 Amb25042923 [0,1,0,1,0,0|2,0,0]=4 9758 B9R1.117 NC1(CCCO)COC1 Amb22737299 [0,1,0,1,0,0|2,0,0]=4 9759 B9R1.117 NCCCC1(O)CCC1 Amb25199996 [0,1,0,1,0,0|2,0,0]=4 9760 B9R1.117 OCCCC1(F)CCC1 Amb25285193 [0,1,0,1,0,0|1,0,0]=3 9761 B9R1.117 OCCCC1(O)CCC1 Amb25032198 [0,1,0,1,0,0|1,0,0]=3 9762 B9R1.134 BrCCC1(C)OCCO1 Amb17226719 [0,1,0,1,0,0|1,0,0]=3 9763 B9R1.134 CC#CC1(C)OCCO1 Amb25708727 [0,1,0,1,0,0|0,0,2]=4 9764 B9R1.134 CC1(CC=O)OCCO1 Amb18203200 [0,1,0,1,0,0|1,0,1]=4 9765 B9R1.134 CC1(CCCl)CCCC1 Amb25703738 [0,1,0,1,0,0|2,0,0]=4 9766 B9R1.134 CC1(CCI)OCCO1 Amb24520560 [0,1,0,1,0,0|1,0,0]=3 9767 B9R1.134 CC1(CCN)CCCC1 Amb18251115 [0,1,0,1,0,0|2,0,0]=4 9768 B9R1.134 CC1(CCN)CCCO1 Amb25778448 [0,1,0,1,0,0|2,0,0]=4 9769 B9R1.134 CCCC1(C)NCCO1 Amb25146152 [0,1,0,1,0,0|1,0,0]=3 9770 B9R1.134 CNCC1(C)CCCO1 Amb17506325 [0,1,0,1,0,0|2,0,0]=4 9771 B9R1.134 CNCC1(C)OCCO1 Amb2369956 [0,1,0,1,0,0|1,0,0]=3 9772 B9R1.134 N#CCC1(C)OCCO1 Amb1068377 [0,1,0,1,0,0|1,0,1]=4 9773 B9R1.134 NC1(CCO)COCC1 Amb25349777 [0,1,0,1,0,0|2,0,0]=4 9774 B9R1.134 NCCC1(C)OCCO1 Amb17101121 [0,1,0,1,0,0|1,0,0]=3 9775 B9R1.134 NCCC1(F)CCCC1 Amb25198832 [0,1,0,1,0,0|2,0,0]=4 9776 B9R1.134 O=P1(CCCl)OCCO1 Amb24355949 [0,1,0,1,0,0|2,0,0]=4 9777 B9R1.134 OC1(CCCl)CCCC1 Amb24385368 [0,1,0,1,0,0|2,0,0]=4 9778 B9R1.134 OCCC1(C)OCCO1 Amb17399825 [0,1,0,1,0,0|1,0,0]=3 9779 B9R1.134 OCCC1(F)CCCC1 Amb25248772 [0,1,0,1,0,0|1,0,0]=3 9780 B9R1.134 OCCC1(O)CCCC1 Amb21961004 [0,1,0,1,0,0|1,0,0]=3 9781 B9R1.134 [13CH3][13C]1([13CH2][13CH2]I)OCCO1 Amb22339005 [0,1,0,1,0,0|1,0,0]=3 9782 B9R1.154 CC1CC(=O)N1CCO Amb24364645 [0,1,0,1,0,0|1,0,1]=4 9783 B9R1.154 CC1CC(C)N1CCF Amb25842340 [0,1,0,1,0,0|2,0,0]=4 9784 B9R1.154 CC1CC(C)N1CCI Amb25788664 [0,1,0,1,0,0|2,0,0]=4 9785 B9R1.173 CC1CCC1(O)CCN Amb25728613 [0,1,0,1,0,0|2,0,0]=4 9786 B9R1.173 CCCC1(O)CCC1C Amb24689545 [0,1,0,1,0,0|2,0,0]=4 9787 B9R1.178 CC#C[C@@]1(C)O[C@@H]1CO Amb25357743 [0,1,0,1,0,0|0,0,2]=4 9788 B9R1.178 CC#C[C@]1(C)O[C@H]1CO Amb24661070 [0,1,0,1,0,0|0,0,2]=4 9789 B9R1.178 CCC1CC1(O)CCBr Amb24558995 [0,1,0,1,0,0|2,0,0]=4 9790 B9R1.178 CCC1CC1(O)CCCl Amb25039927 [0,1,0,1,0,0|2,0,0]=4 9791 B9R1.178 CCCC1(C)CC1CBr Amb24340193 [0,1,0,1,0,0|2,0,0]=4 9792 B9R1.178 CCCC1(C)CC1CN Amb18300446 [0,1,0,1,0,0|2,0,0]=4 9793 B9R1.178 CCCC1(C)CC1CO Amb25731501 [0,1,0,1,0,0|1,0,0]=3 9794 B9R1.178 CCCC1(C)OC1C#N Amb25125741 [0,1,0,1,0,0|1,0,1]=4 9795 B9R1.178 CCCC1(C)OC1CO Amb25136230 [0,1,0,1,0,0|0,0,0]=2 9796 B9R1.178 CCCC1(N)CC1CC Amb24700718 [0,1,0,1,0,0|2,0,0]=4 9797 B9R1.178 CCC[C@@]1(C)O[C@H]1CO Amb24719742 [0,1,0,1,0,0|0,0,0]=2 9798 B9R1.178 CCC[C@]1(C)O[C@H]1C=O Amb25179630 [0,1,0,1,0,0|0,0,2]=4 9799 B9R1.178 CCC[C@]1(C)O[C@H]1CO Amb24577268 [0,1,0,1,0,0|0,0,0]=2 9800 B9R1.178 CC[C@H]1C[C@@]1(O)CCBr Amb24739629 [0,1,0,1,0,0|2,0,0]=4 9801 B9R1.178 CC[C@H]1C[C@@]1(O)CCCl Amb24610117 [0,1,0,1,0,0|2,0,0]=4 9802 B9R1.178 COCC1(C)CC1CO Amb23596524 [0,1,0,1,0,0|2,0,0]=4 9803 B9R1.183 CC(CCBr)C1CC1C Amb24564833 [0,1,0,1,0,0|2,0,0]=4 9804 B9R1.183 CC(CCO)C1CC1C Amb25676652 [0,1,0,1,0,0|1,0,0]=3 9805 B9R1.183 CC1CC1C(=O)CCC Amb25147007 [0,1,0,1,0,0|2,0,0]=4 9806 B9R1.183 CC1CC1C(O)CCN Amb25147103 [0,1,0,1,0,0|2,0,0]=4 9807 B9R1.183 CC1CC1[C@@H](N)CCC Amb25702074 [0,1,0,1,0,0|2,0,0]=4 9808 B9R1.183 CC1CC1[C@H](N)CCC Amb25111025 [0,1,0,1,0,0|2,0,0]=4 9809 B9R1.183 C[C@@H](CCO)[C@@H]1C[C@H]1C Amb25215772 [0,1,0,1,0,0|1,0,0]=3 9810 B9R1.183 C[C@H](CCO)[C@@H]1C[C@H]1C Amb25316253 [0,1,0,1,0,0|1,0,0]=3 9811 B9R1.191 CC1CC1(O)CCCCl Amb25082690 [0,1,0,1,0,0|2,0,0]=4 9812 B9R1.191 CCCCC1(C)CC1N Amb25026339 [0,1,0,1,0,0|2,0,0]=4 9813 B9R1.191 CCCCC1(N)CC1C Amb24464185 [0,1,0,1,0,0|2,0,0]=4 9814 B9R1.191 CCCCC1(O)CC1C Amb25691921 [0,1,0,1,0,0|2,0,0]=4 9815 B9R1.191 CCCOC1(C)OC1C Amb24443329 [0,1,0,1,0,0|2,0,0]=4 9816 B9R1.4 C=CC[C@H]1CN[C@@H]1CO Amb24628435 [0,1,0,1,0,0|1,0,1]=4 9817 B9R1.4 CCC1CCC1CNC Amb24436357 [0,1,0,1,0,0|2,0,0]=4 9818 B9R1.4 CCC1CCN1CCI Amb25706055 [0,1,0,1,0,0|2,0,0]=4 9819 B9R1.4 CCCC1NCC1CC Amb25218564 [0,1,0,1,0,0|2,0,0]=4 9820 B9R1.4 CCC[C@H]1NC[C@H]1CC Amb24548860 [0,1,0,1,0,0|2,0,0]=4 9821 B9R1.4 CCNC1CCC1CC Amb25761790 [0,1,0,1,0,0|2,0,0]=4 9822 B9R1.4 C\C=C\C1CCC1CO Amb25356184 [0,1,0,1,0,0|1,0,1]=4 9823 B9R1.4 OCC1CCC1CCO Amb25686093 [0,1,0,1,0,0|1,0,0]=3 9824 B9R1.4 OC[C@@H]1CC[C@H]1CCO Amb24733574 [0,1,0,1,0,0|1,0,0]=3 9825 B9R1.5 BrC1CCCCCC1Br Amb17669998 [0,1,0,1,0,0|2,0,0]=4 9826 B9R1.5 Br[C@@H]1CCCCC[C@@H]1Br Amb24425642 [0,1,0,1,0,0|2,0,0]=4 9827 B9R1.5 C=C1CCCCCC1O Amb24475137 [0,1,0,1,0,0|1,0,1]=4 9828 B9R1.5 C=C1CCCCC[C@H]1O Amb25343771 [0,1,0,1,0,0|1,0,1]=4 9829 B9R1.5 C=C1COCOCC1O Amb24648228 [0,1,0,1,0,0|0,0,2]=4 9830 B9R1.5 C=C1COCOC[C@H]1O Amb25682297 [0,1,0,1,0,0|0,0,2]=4 9831 B9R1.5 CC1CCCCCC1Br Amb18329569 [0,1,0,1,0,0|2,0,0]=4 9832 B9R1.5 CC1CCCCCC1N Amb18278100 [0,1,0,1,0,0|2,0,0]=4 9833 B9R1.5 CC1CCCCNC1C Amb25830593 [0,1,0,1,0,0|2,0,0]=4 9834 B9R1.5 CC1CCNCCC1=O Amb22263520 [0,1,0,1,0,0|1,0,1]=4 9835 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,1,0,1,0,0|1,0,1]=4 9836 B9R1.5 CC1CCNCCC1N Amb24559676 [0,1,0,1,0,0|2,0,0]=4 9837 B9R1.5 CC1CCNCCC1O Amb22886251 [0,1,0,1,0,0|1,0,0]=3 9838 B9R1.5 CC1CCNCCN1C Amb17578107 [0,1,0,1,0,0|2,0,0]=4 9839 B9R1.5 CC1CCOCCC1N Amb25228150 [0,1,0,1,0,0|1,0,0]=3 9840 B9R1.5 CC1CCOCCN1C Amb24474941 [0,1,0,1,0,0|1,0,0]=3 9841 B9R1.5 CC1CCSCCC1=O Amb25092920 [0,1,0,1,0,0|0,1,1]=4 9842 B9R1.5 CC1CNCCCC1C Amb22886370 [0,1,0,1,0,0|2,0,0]=4 9843 B9R1.5 CC1CNCCCC1O Amb22886276 [0,1,0,1,0,0|1,0,0]=3 9844 B9R1.5 CC1COCCCN1N Amb24657533 [0,1,0,1,0,0|2,0,0]=4 9845 B9R1.5 CC1COCCNC1C Amb24426584 [0,1,0,1,0,0|1,0,0]=3 9846 B9R1.5 CC1OCCCCC1=O Amb25825779 [0,1,0,1,0,0|0,0,2]=4 9847 B9R1.5 CN1CCCNCC1C Amb17578105 [0,1,0,1,0,0|2,0,0]=4 9848 B9R1.5 C[C@@H]1CCCCCC1=O Amb25032177 [0,1,0,1,0,0|1,0,1]=4 9849 B9R1.5 C[C@@H]1CCCCC[C@H]1N Amb25175062 [0,1,0,1,0,0|2,0,0]=4 9850 B9R1.5 C[C@H]1CCCCCC1=O Amb24475484 [0,1,0,1,0,0|1,0,1]=4 9851 B9R1.5 C[C@H]1CNCCCN1C Amb24714271 [0,1,0,1,0,0|2,0,0]=4 9852 B9R1.5 ClC1CCCCCC1Cl Amb17669999 [0,1,0,1,0,0|2,0,0]=4 9853 B9R1.5 ClC1COCOCC1Cl Amb24565801 [0,1,0,1,0,0|2,0,0]=4 9854 B9R1.5 Cl[C@@H]1CCCCC[C@@H]1Cl Amb25216944 [0,1,0,1,0,0|2,0,0]=4 9855 B9R1.5 Cl[C@@H]1CCCCC[C@H]1Cl Amb24589422 [0,1,0,1,0,0|2,0,0]=4 9856 B9R1.5 Cl[C@H]1CCCCC[C@@H]1Cl Amb25275014 [0,1,0,1,0,0|2,0,0]=4 9857 B9R1.5 FC1CCCCCC1Br Amb24387987 [0,1,0,1,0,0|2,0,0]=4 9858 B9R1.5 NC1CCCCCC1N Amb18832604 [0,1,0,1,0,0|2,0,0]=4 9859 B9R1.5 NC1CCCOCC1O Amb25702979 [0,1,0,1,0,0|0,0,0]=2 9860 B9R1.5 NC1CNCCCC1O Amb25230992 [0,1,0,1,0,0|2,0,0]=4 9861 B9R1.5 NC1COCOCC1N Amb24441646 [0,1,0,1,0,0|2,0,0]=4 9862 B9R1.5 NC1CSCCCC1O Amb24392121 [0,1,0,1,0,0|1,1,0]=4 9863 B9R1.5 N[C@@H]1CCCCC[C@@H]1N Amb24659857 [0,1,0,1,0,0|2,0,0]=4 9864 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,1,0,1,0,0|1,0,0]=3 9865 B9R1.5 N[C@@H]1CCCCC[C@H]1N Amb24546493 [0,1,0,1,0,0|2,0,0]=4 9866 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,1,0,1,0,0|1,0,0]=3 9867 B9R1.5 N[C@@H]1CCCNC[C@H]1O Amb24078419 [0,1,0,1,0,0|1,0,0]=3 9868 B9R1.5 N[C@@H]1CCCOC[C@H]1O Amb25367605 [0,1,0,1,0,0|0,0,0]=2 9869 B9R1.5 N[C@@H]1CNCCC[C@H]1O Amb24078420 [0,1,0,1,0,0|2,0,0]=4 9870 B9R1.5 N[C@@H]1COCOC[C@@H]1N Amb25834799 [0,1,0,1,0,0|2,0,0]=4 9871 B9R1.5 N[C@H]1CCCCC[C@@H]1N Amb25790654 [0,1,0,1,0,0|2,0,0]=4 9872 B9R1.5 N[C@H]1CCCCC[C@H]1O Amb22270235 [0,1,0,1,0,0|1,0,0]=3 9873 B9R1.5 N[C@H]1CNCCC[C@@H]1O Amb24078410 [0,1,0,1,0,0|2,0,0]=4 9874 B9R1.5 N[C@H]1CNCCC[C@H]1O Amb24580324 [0,1,0,1,0,0|2,0,0]=4 9875 B9R1.5 O=C1OCCCCC1Br Amb24725884 [0,1,0,1,0,0|1,0,1]=4 9876 B9R1.5 OC1CCCC=CC1O Amb25069753 [0,1,0,1,0,0|1,0,1]=4 9877 B9R1.5 OC1CCCCCC1=O Amb25284997 [0,1,0,1,0,0|1,0,1]=4 9878 B9R1.5 OC1CCCCCC1Br Amb24480058 [0,1,0,1,0,0|1,0,0]=3 9879 B9R1.5 OC1CCCCCC1O Amb2196454 [0,1,0,1,0,0|1,0,0]=3 9880 B9R1.5 OC1CCCCC[C@H]1F Amb25332433 [0,1,0,1,0,0|1,0,0]=3 9881 B9R1.5 OC1CCNCCC1F Amb22886248 [0,1,0,1,0,0|2,0,0]=4 9882 B9R1.5 OC1CCNCCC1F Amb24597170 [0,1,0,1,0,0|2,0,0]=4 9883 B9R1.5 OC1CCNCCC1O Amb24595878 [0,1,0,1,0,0|2,0,0]=4 9884 B9R1.5 OC1CCSCCC1O Amb25261389 [0,1,0,1,0,0|1,1,0]=4 9885 B9R1.5 OC1CNCCCC1F Amb22886240 [0,1,0,1,0,0|1,0,0]=3 9886 B9R1.5 OC1CNCCCC1O Amb24423783 [0,1,0,1,0,0|1,0,0]=3 9887 B9R1.5 O[C@@H]1CCCCC[C@H]1Cl Amb25252293 [0,1,0,1,0,0|1,0,0]=3 9888 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [0,1,0,1,0,0|1,0,0]=3 9889 B9R1.5 O[C@@H]1CCOCC[C@@H]1O Amb24749737 [0,1,0,1,0,0|1,0,0]=3 9890 B9R1.5 O[C@@H]1COCOC[C@@H]1O Amb25284491 [0,1,0,1,0,0|1,0,0]=3 9891 B9R1.5 O[C@@H]1COCOC[C@H]1O Amb25176716 [0,1,0,1,0,0|1,0,0]=3 9892 B9R1.5 O[C@H]1CCCCC[C@@H]1Br Amb25204581 [0,1,0,1,0,0|1,0,0]=3 9893 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [0,1,0,1,0,0|1,0,0]=3 9894 B9R1.5 O[C@H]1CCCCC[C@H]1O Amb17666644 [0,1,0,1,0,0|1,0,0]=3 9895 B9R1.14 BrCC1CCCN1CC Amb16186922 [0,1,0,1,0,0|2,0,0]=4 9896 B9R1.14 C=CC1CCCC1CO Amb24419330 [0,1,0,1,0,0|1,0,1]=4 9897 B9R1.14 C=CC1CCOC1CO Amb25316307 [0,1,0,1,0,0|0,0,1]=3 9898 B9R1.14 C=CC1OCCC1CN Amb25381398 [0,1,0,1,0,0|1,0,1]=4 9899 B9R1.14 C=C[C@@H]1OCC[C@H]1CN Amb24548005 [0,1,0,1,0,0|1,0,1]=4 9900 B9R1.14 C=C[C@H]1CCC[C@H]1CO Amb24520013 [0,1,0,1,0,0|1,0,1]=4 9901 B9R1.14 CCC1CCCC1C#N Amb24652015 [0,1,0,1,0,0|2,0,0]=4 9902 B9R1.14 CCC1CCCC1C=O Amb25227553 [0,1,0,1,0,0|1,0,1]=4 9903 B9R1.14 CCC1CCCC1CN Amb25145993 [0,1,0,1,0,0|2,0,0]=4 9904 B9R1.14 CCC1CCCC1CO Amb24481687 [0,1,0,1,0,0|1,0,0]=3 9905 B9R1.14 CCC1CCCC1NC Amb18282856 [0,1,0,1,0,0|2,0,0]=4 9906 B9R1.14 CCC1CCCC1NO Amb24481708 [0,1,0,1,0,0|1,0,0]=3 9907 B9R1.14 CCC1CNCC1CC Amb22371139 [0,1,0,1,0,0|2,0,0]=4 9908 B9R1.14 CCC1NCCC1CCl Amb24608559 [0,1,0,1,0,0|2,0,0]=4 9909 B9R1.14 CCC1NCCC1CN Amb18832605 [0,1,0,1,0,0|2,0,0]=4 9910 B9R1.14 CCC1OCCC1C=O Amb18642660 [0,1,0,1,0,0|1,0,1]=4 9911 B9R1.14 CCN1CCCC1CBr Amb21959790 [0,1,0,1,0,0|2,0,0]=4 9912 B9R1.14 CCN1CCCC1CCl Amb19516950 [0,1,0,1,0,0|2,0,0]=4 9913 B9R1.14 CCN1CCCC1CCl Amb22587445 [0,1,0,1,0,0|2,0,0]=4 9914 B9R1.14 CCN1CCC[C@@H]1CCl Amb22757842 [0,1,0,1,0,0|2,0,0]=4 9915 B9R1.14 CCN1CCC[C@@H]1CN Amb23399734 [0,1,0,1,0,0|2,0,0]=4 9916 B9R1.14 CCN1CCC[C@@H]1CO Amb24678478 [0,1,0,1,0,0|1,0,0]=3 9917 B9R1.14 CCN1CCC[C@H]1CCl Amb24432827 [0,1,0,1,0,0|2,0,0]=4 9918 B9R1.14 CCN1CCC[C@H]1CN Amb19929384 [0,1,0,1,0,0|2,0,0]=4 9919 B9R1.14 CCN1CCC[C@H]1CO Amb19517075 [0,1,0,1,0,0|1,0,0]=3 9920 B9R1.14 CC[C@@H]1CCC[C@H]1CC Amb22231650 [0,1,0,1,0,0|2,0,0]=4 9921 B9R1.14 CC[C@@H]1CCC[C@H]1CO Amb24688267 [0,1,0,1,0,0|1,0,0]=3 9922 B9R1.14 CC[C@@H]1CCC[C@H]1NN Amb25810510 [0,1,0,1,0,0|2,0,0]=4 9923 B9R1.14 CC[C@H]1CCN[C@@H]1CO Amb24629705 [0,1,0,1,0,0|1,0,0]=3 9924 B9R1.14 CNC1CCCC1CN Amb24478693 [0,1,0,1,0,0|2,0,0]=4 9925 B9R1.14 CNC1CCCC1CO Amb18642720 [0,1,0,1,0,0|1,0,0]=3 9926 B9R1.14 CNC1CCCC1OC Amb17606029 [0,1,0,1,0,0|2,0,0]=4 9927 B9R1.14 CNC1CNCC1OC Amb24391983 [0,1,0,1,0,0|2,0,0]=4 9928 B9R1.14 CNC1COCC1CN Amb25247623 [0,1,0,1,0,0|2,0,0]=4 9929 B9R1.14 CNC1COCC1CO Amb25681616 [0,1,0,1,0,0|1,0,0]=3 9930 B9R1.14 CNC1CSCC1CO Amb25208601 [0,1,0,1,0,0|1,1,0]=4 9931 B9R1.14 CN[C@@H]1CCC[C@@H]1CO Amb25028012 [0,1,0,1,0,0|1,0,0]=3 9932 B9R1.14 CN[C@@H]1CCC[C@H]1CO Amb24517285 [0,1,0,1,0,0|1,0,0]=3 9933 B9R1.14 CN[C@@H]1CNC[C@H]1OC Amb22899611 [0,1,0,1,0,0|2,0,0]=4 9934 B9R1.14 CN[C@H]1CNC[C@H]1OC Amb25326350 [0,1,0,1,0,0|2,0,0]=4 9935 B9R1.14 COC1CNCC1CBr Amb24540247 [0,1,0,1,0,0|2,0,0]=4 9936 B9R1.14 COC1CNCC1CCl Amb24745729 [0,1,0,1,0,0|2,0,0]=4 9937 B9R1.14 COC1CNCC1CI Amb24679914 [0,1,0,1,0,0|2,0,0]=4 9938 B9R1.14 COC1CNCC1CS Amb25326633 [0,1,0,1,0,0|2,0,0]=4 9939 B9R1.14 COC1OCCC1CO Amb25381274 [0,1,0,1,0,0|2,0,0]=4 9940 B9R1.14 COC1OCC[C@@H]1CO Amb24686639 [0,1,0,1,0,0|2,0,0]=4 9941 B9R1.14 CO[C@@H]1CNC[C@@H]1OC Amb22886348 [0,1,0,1,0,0|2,0,0]=4 9942 B9R1.14 CO[C@@H]1CNC[C@@H]1OC Amb24749498 [0,1,0,1,0,0|2,0,0]=4 9943 B9R1.14 CO[C@@H]1CNC[C@H]1OC Amb25302319 [0,1,0,1,0,0|2,0,0]=4 9944 B9R1.14 CO[C@@H]1OCC[C@@H]1CO Amb24569987 [0,1,0,1,0,0|2,0,0]=4 9945 B9R1.14 CO[C@H]1C=CO[C@@H]1CO Amb25332206 [0,1,0,1,0,0|0,0,2]=4 9946 B9R1.14 CO[C@H]1CCO[C@@H]1CO Amb25175401 [0,1,0,1,0,0|0,0,0]=2 9947 B9R1.14 CO[C@H]1COC[C@@H]1NC Amb24615226 [0,1,0,1,0,0|1,0,0]=3 9948 B9R1.14 CO[C@H]1OCC[C@@H]1CO Amb24598938 [0,1,0,1,0,0|2,0,0]=4 9949 B9R1.14 CSC1CCCC1CN Amb18951039 [0,1,0,1,0,0|2,0,0]=4 9950 B9R1.14 ClCC1CCCC1CCl Amb24544535 [0,1,0,1,0,0|2,0,0]=4 9951 B9R1.14 ClCC1COCC1CCl Amb24524197 [0,1,0,1,0,0|2,0,0]=4 9952 B9R1.14 ClC[C@@H]1CCC[C@@H]1CCl Amb24455809 [0,1,0,1,0,0|2,0,0]=4 9953 B9R1.14 ClC[C@@H]1CCC[C@H]1CCl Amb24565536 [0,1,0,1,0,0|2,0,0]=4 9954 B9R1.14 ClC[C@@H]1COC[C@@H]1CCl Amb25847384 [0,1,0,1,0,0|2,0,0]=4 9955 B9R1.14 ClC[C@@H]1OCO[C@H]1CCl Amb24601402 [0,1,0,1,0,0|2,0,0]=4 9956 B9R1.14 ClC[C@H]1COC[C@@H]1CCl Amb24604809 [0,1,0,1,0,0|2,0,0]=4 9957 B9R1.14 NCC1CCCC1CBr Amb25788397 [0,1,0,1,0,0|2,0,0]=4 9958 B9R1.14 NCC1CCCC1CF Amb20668101 [0,1,0,1,0,0|2,0,0]=4 9959 B9R1.14 NCC1OCOC1CN Amb24715764 [0,1,0,1,0,0|2,0,0]=4 9960 B9R1.14 NC[C@@H]1CCC[C@@H]1CO Amb25269079 [0,1,0,1,0,0|1,0,0]=3 9961 B9R1.14 NC[C@@H]1OCO[C@H]1CN Amb25292230 [0,1,0,1,0,0|2,0,0]=4 9962 B9R1.14 NC[C@H]1CCC[C@@H]1CN Amb24601071 [0,1,0,1,0,0|2,0,0]=4 9963 B9R1.14 OCC1CC=CC1CO Amb24464798 [0,1,0,1,0,0|1,0,1]=4 9964 B9R1.14 OCC1CCCC1CCl Amb25108199 [0,1,0,1,0,0|1,0,0]=3 9965 B9R1.14 OCC1COCC1CO Amb24386969 [0,1,0,1,0,0|1,0,0]=3 9966 B9R1.14 OCC1NCCC1CO Amb24617756 [0,1,0,1,0,0|1,0,0]=3 9967 B9R1.14 OCC1OCOC1C=O Amb25830056 [0,1,0,1,0,0|1,0,1]=4 9968 B9R1.14 OCC1OCOC1CO Amb25057735 [0,1,0,1,0,0|1,0,0]=3 9969 B9R1.14 OC[C@@H]1CC=C[C@H]1CO Amb24515143 [0,1,0,1,0,0|1,0,1]=4 9970 B9R1.14 OC[C@@H]1CNC[C@@H]1CO Amb13883446 [0,1,0,1,0,0|2,0,0]=4 9971 B9R1.14 OC[C@@H]1CNC[C@@H]1CO Amb22230441 [0,1,0,1,0,0|2,0,0]=4 9972 B9R1.14 OC[C@@H]1CNC[C@H]1CO Amb17621969 [0,1,0,1,0,0|2,0,0]=4 9973 B9R1.14 OC[C@@H]1CNC[C@H]1CO Amb22757866 [0,1,0,1,0,0|2,0,0]=4 9974 B9R1.14 OC[C@@H]1CSC[C@H]1CO Amb24705791 [0,1,0,1,0,0|1,1,0]=4 9975 B9R1.14 OC[C@@H]1NCC[C@@H]1CO Amb25180858 [0,1,0,1,0,0|1,0,0]=3 9976 B9R1.14 OC[C@@H]1OCO[C@H]1CO Amb24579941 [0,1,0,1,0,0|1,0,0]=3 9977 B9R1.14 OC[C@H]1CCC[C@H]1C=O Amb25168879 [0,1,0,1,0,0|1,0,1]=4 9978 B9R1.14 OC[C@H]1OCO[C@@H]1CO Amb24542297 [0,1,0,1,0,0|1,0,0]=3 9979 B9R1.14 OC[C@H]1OCO[C@H]1C=O Amb24608896 [0,1,0,1,0,0|1,0,1]=4 9980 B9R1.16 C#CCCC[C@@H]1C[C@H]1O Amb25255526 [0,1,0,1,0,0|1,0,1]=4 9981 B9R1.16 C=C1CC1CCCCO Amb24502368 [0,1,0,1,0,0|1,0,1]=4 9982 B9R1.16 C=CCCCC1CC1O Amb25098896 [0,1,0,1,0,0|1,0,1]=4 9983 B9R1.16 CC1CC1CNCCN Amb24550824 [0,1,0,1,0,0|2,0,0]=4 9984 B9R1.16 CC1CC1NCCC#N Amb18990745 [0,1,0,1,0,0|2,0,0]=4 9985 B9R1.16 CC1CC1NCCC=C Amb24340288 [0,1,0,1,0,0|2,0,0]=4 9986 B9R1.16 CC1CC1NCCCC Amb19022375 [0,1,0,1,0,0|2,0,0]=4 9987 B9R1.16 CC1CC1NCCCN Amb19022472 [0,1,0,1,0,0|2,0,0]=4 9988 B9R1.16 CC1CC1NCCCO Amb19022443 [0,1,0,1,0,0|1,0,0]=3 9989 B9R1.16 CC1CC1NCCNC Amb19022475 [0,1,0,1,0,0|2,0,0]=4 9990 B9R1.16 CC1CC1NCCOC Amb19022449 [0,1,0,1,0,0|1,0,0]=3 9991 B9R1.16 CC1OC1CCCCO Amb25221862 [0,1,0,1,0,0|1,0,0]=3 9992 B9R1.16 CC1OC1CNCCC Amb25207703 [0,1,0,1,0,0|2,0,0]=4 9993 B9R1.16 CCCCCC1CC1O Amb25760737 [0,1,0,1,0,0|1,0,0]=3 9994 B9R1.16 CCCCCC1OC1Cl Amb25690213 [0,1,0,1,0,0|1,0,0]=3 9995 B9R1.16 CCCCC[C@@H]1C[C@@H]1Br Amb25211284 [0,1,0,1,0,0|2,0,0]=4 9996 B9R1.16 CCCCC[C@@H]1C[C@@H]1O Amb25257126 [0,1,0,1,0,0|1,0,0]=3 9997 B9R1.16 CCCCC[C@@H]1C[C@H]1Br Amb24563828 [0,1,0,1,0,0|2,0,0]=4 9998 B9R1.16 CCCCC[C@@H]1C[C@H]1N Amb24100225 [0,1,0,1,0,0|2,0,0]=4 9999 B9R1.16 CCCCC[C@@H]1C[C@H]1O Amb24582386 [0,1,0,1,0,0|1,0,0]=3 10000 B9R1.16 CCCCC[C@H]1C[C@@H]1O Amb25266383 [0,1,0,1,0,0|1,0,0]=3 10001 B9R1.16 CCCCOC1CC1N Amb24477705 [0,1,0,1,0,0|1,0,0]=3 10002 B9R1.16 CCCCO[C@@H]1C[C@H]1Cl Amb24589330 [0,1,0,1,0,0|1,0,0]=3 10003 B9R1.16 CCCCO[C@@H]1C[C@H]1N Amb25366599 [0,1,0,1,0,0|1,0,0]=3 10004 B9R1.16 C[C@@H]1C[C@H]1CCCCBr Amb24558562 [0,1,0,1,0,0|2,0,0]=4 10005 B9R1.17 BrCCCOC1CCC1 Amb18321012 [0,1,0,1,0,0|1,0,0]=3 10006 B9R1.17 C#CCCOC1CNC1 Amb24618212 [0,1,0,1,0,0|2,0,0]=4 10007 B9R1.17 C=CCCOC1CNC1 Amb24626068 [0,1,0,1,0,0|2,0,0]=4 10008 B9R1.17 CCCCCN1CCC1 Amb25080741 [0,1,0,1,0,0|2,0,0]=4 10009 B9R1.17 CCCCNC1CCC1 Amb19021245 [0,1,0,1,0,0|2,0,0]=4 10010 B9R1.17 CCCCNC1CNC1 Amb25032264 [0,1,0,1,0,0|2,0,0]=4 10011 B9R1.17 CCCCNC1COC1 Amb25710042 [0,1,0,1,0,0|1,0,0]=3 10012 B9R1.17 CCCCNC1CSC1 Amb24465939 [0,1,0,1,0,0|1,1,0]=4 10013 B9R1.17 CCCCOC1CNC1 Amb19031045 [0,1,0,1,0,0|1,0,0]=3 10014 B9R1.17 CCCCOC1CNC1 Amb23440522 [0,1,0,1,0,0|1,0,0]=3 10015 B9R1.17 CCCOCC1CNC1 Amb21959283 [0,1,0,1,0,0|1,0,0]=3 10016 B9R1.17 CCCON=C1CCC1 Amb24414674 [0,1,0,1,0,0|1,0,1]=4 10017 B9R1.17 CCCONC1CCC1 Amb25746348 [0,1,0,1,0,0|1,0,0]=3 10018 B9R1.17 CCCONC1CNC1 Amb25275474 [0,1,0,1,0,0|2,0,0]=4 10019 B9R1.17 CCNCCN1CCC1 Amb24339155 [0,1,0,1,0,0|2,0,0]=4 10020 B9R1.17 CNCCCC1CCC1 Amb23570803 [0,1,0,1,0,0|2,0,0]=4 10021 B9R1.17 CNCCCN1CCC1 Amb24424575 [0,1,0,1,0,0|2,0,0]=4 10022 B9R1.17 CNCCNC1CCC1 Amb19022298 [0,1,0,1,0,0|2,0,0]=4 10023 B9R1.17 CNCCOC1CCC1 Amb19024861 [0,1,0,1,0,0|1,0,0]=3 10024 B9R1.17 CNCCOC1COC1 Amb25032147 [0,1,0,1,0,0|1,0,0]=3 10025 B9R1.17 COCCNC1CCC1 Amb23597827 [0,1,0,1,0,0|1,0,0]=3 10026 B9R1.17 COCCNC1COC1 Amb25190091 [0,1,0,1,0,0|2,0,0]=4 10027 B9R1.17 COCCNC1CSC1 Amb24540669 [0,1,0,1,0,0|2,0,0]=4 10028 B9R1.17 COCCOC1CNC1 Amb19031040 [0,1,0,1,0,0|1,0,0]=3 10029 B9R1.17 COCCOC1CNC1 Amb20623365 [0,1,0,1,0,0|1,0,0]=3 10030 B9R1.17 COCCSC1COC1 Amb25105523 [0,1,0,1,0,0|1,1,0]=4 10031 B9R1.17 CSCCNC1CCC1 Amb25354363 [0,1,0,1,0,0|1,1,0]=4 10032 B9R1.17 CSCCNC1COC1 Amb25126395 [0,1,0,1,0,0|2,0,0]=4 10033 B9R1.17 ClCC\C=C\C1CCC1 Amb24685576 [0,1,0,1,0,0|2,0,0]=4 10034 B9R1.17 ClCOCCC1CCC1 Amb24502228 [0,1,0,1,0,0|2,0,0]=4 10035 B9R1.17 FCCCNC1CCC1 Amb25251633 [0,1,0,1,0,0|2,0,0]=4 10036 B9R1.17 FCCCNC1COC1 Amb24359548 [0,1,0,1,0,0|2,0,0]=4 10037 B9R1.17 FCCNCC1CCN1 Amb24607035 [0,1,0,1,0,0|2,0,0]=4 10038 B9R1.17 FCCONC1CCC1 Amb22896752 [0,1,0,1,0,0|1,0,0]=3 10039 B9R1.17 N#CCCNC1CCC1 Amb18989386 [0,1,0,1,0,0|2,0,0]=4 10040 B9R1.17 NCCCCC1COC1 Amb25178448 [0,1,0,1,0,0|2,0,0]=4 10041 B9R1.17 NCCCNC1CCC1 Amb19021296 [0,1,0,1,0,0|2,0,0]=4 10042 B9R1.17 NCCCOC1CSC1 Amb25222668 [0,1,0,1,0,0|1,1,0]=4 10043 B9R1.17 NCCCSC1COC1 Amb24607271 [0,1,0,1,0,0|1,1,0]=4 10044 B9R1.17 NCCOCC1COC1 Amb25195576 [0,1,0,1,0,0|1,0,0]=3 10045 B9R1.17 NCCSCC1CNC1 Amb24412946 [0,1,0,1,0,0|1,1,0]=4 10046 B9R1.17 NOCCCN1CCC1 Amb25347232 [0,1,0,1,0,0|2,0,0]=4 10047 B9R1.17 NOCCOC1COC1 Amb24600853 [0,1,0,1,0,0|1,0,0]=3 10048 B9R1.17 O=CCCOC1CCC1 Amb25229799 [0,1,0,1,0,0|0,0,1]=3 10049 B9R1.17 O=CCCOC1COC1 Amb24383231 [0,1,0,1,0,0|1,0,1]=4 10050 B9R1.17 OCCCCC1COC1 Amb25187833 [0,1,0,1,0,0|1,0,0]=3 10051 B9R1.17 OCCCCN1CCC1 Amb24368536 [0,1,0,1,0,0|1,0,0]=3 10052 B9R1.17 OCCCNC1CCC1 Amb22229279 [0,1,0,1,0,0|1,0,0]=3 10053 B9R1.17 OCCCNC1CNC1 Amb25103513 [0,1,0,1,0,0|2,0,0]=4 10054 B9R1.17 OCCCNC1COC1 Amb25265104 [0,1,0,1,0,0|2,0,0]=4 10055 B9R1.17 OCCCNC1CSC1 Amb25722890 [0,1,0,1,0,0|2,0,0]=4 10056 B9R1.17 OCCCSC1CCC1 Amb24481850 [0,1,0,1,0,0|0,1,0]=3 10057 B9R1.17 OCCNCC1CCN1 Amb25253622 [0,1,0,1,0,0|1,0,0]=3 10058 B9R1.17 OCCNN=C1CCC1 Amb24569799 [0,1,0,1,0,0|1,0,1]=4 10059 B9R1.17 OCCSCC1CNC1 Amb24369337 [0,1,0,1,0,0|0,1,0]=3 10060 B9R1.17 SCCCCN1CCC1 Amb24611155 [0,1,0,1,0,0|1,1,0]=4 10061 B9R1.17 SCCCOC1CCC1 Amb24588190 [0,1,0,1,0,0|0,1,0]=3 10062 B9R1.17 [C-]#[N+]CCCC1CCC1 Amb25223205 [0,1,0,1,0,0|2,0,0]=4 10063 B9R1.39 CC1CCC1=CCCN Amb25717888 [0,1,0,1,0,0|2,0,0]=4 10064 B9R1.39 CC1CCC1CNCC Amb23512036 [0,1,0,1,0,0|2,0,0]=4 10065 B9R1.39 CC1CCC1NCCF Amb25821732 [0,1,0,1,0,0|2,0,0]=4 10066 B9R1.39 CC1CCC1NCCN Amb25834509 [0,1,0,1,0,0|2,0,0]=4 10067 B9R1.39 CC1CCC1NCCO Amb25297606 [0,1,0,1,0,0|1,0,0]=3 10068 B9R1.39 CC1CCN1CCCO Amb24730134 [0,1,0,1,0,0|1,0,0]=3 10069 B9R1.39 NCCCC1CCC1O Amb25784142 [0,1,0,1,0,0|1,0,0]=3 10070 B9R1.39 O[C@@H]1CC[C@H]1CCCO Amb25025535 [0,1,0,1,0,0|1,0,0]=3 10071 B9R1.83 BrCCCCCC1CO1 Amb25759075 [0,1,0,1,0,0|1,0,0]=3 10072 B9R1.83 BrCCOCCC1CC1 Amb25315384 [0,1,0,1,0,0|1,0,0]=3 10073 B9R1.83 BrCC\C=C\CC1CC1 Amb25247718 [0,1,0,1,0,0|2,0,0]=4 10074 B9R1.83 C#CCCNCC1CC1 Amb24469394 [0,1,0,1,0,0|2,0,0]=4 10075 B9R1.83 C#CCCSCC1CC1 Amb24632433 [0,1,0,1,0,0|1,1,0]=4 10076 B9R1.83 C#CCONCC1CC1 Amb25051149 [0,1,0,1,0,0|1,0,1]=4 10077 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|1,0,0]=3 10078 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|1,0,0]=3 10079 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|1,0,0]=3 10080 B9R1.83 CCCCCC[C@H]1CS1 Amb22367053 [0,1,0,1,0,0|1,1,0]=4 10081 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|0,0,0]=2 10082 B9R1.83 CCCCSCC1CC1 Amb25284080 [0,1,0,1,0,0|1,1,0]=4 10083 B9R1.83 CCCCSC[C@@H]1CO1 Amb25688021 [0,1,0,1,0,0|0,1,0]=3 10084 B9R1.83 CCCOCCC1CO1 Amb25066444 [0,1,0,1,0,0|1,0,0]=3 10085 B9R1.83 CCCONCC1CC1 Amb25031183 [0,1,0,1,0,0|1,0,0]=3 10086 B9R1.83 CCNCCCC1CC1 Amb25147174 [0,1,0,1,0,0|2,0,0]=4 10087 B9R1.83 CCOCSCC1CC1 Amb24661837 [0,1,0,1,0,0|1,1,0]=4 10088 B9R1.83 CCSCCCC1CO1 Amb24619566 [0,1,0,1,0,0|1,0,0]=3 10089 B9R1.83 CCSCSCC1CC1 Amb24466826 [0,1,0,1,0,0|1,1,0]=4 10090 B9R1.83 CC\C=C\CC[C@@H]1CO1 Amb24685103 [0,1,0,1,0,0|1,0,1]=4 10091 B9R1.83 CNCCCNC1CC1 Amb25137327 [0,1,0,1,0,0|2,0,0]=4 10092 B9R1.83 CNCCNCC1CC1 Amb25338648 [0,1,0,1,0,0|2,0,0]=4 10093 B9R1.83 CNCCOCC1CC1 Amb20622213 [0,1,0,1,0,0|1,0,0]=3 10094 B9R1.83 CNCCSCC1CC1 Amb25337227 [0,1,0,1,0,0|1,1,0]=4 10095 B9R1.83 COCCCNC1CC1 Amb17231857 [0,1,0,1,0,0|2,0,0]=4 10096 B9R1.83 COCCCOC1CC1 Amb24481811 [0,1,0,1,0,0|1,0,0]=3 10097 B9R1.83 COCCOC[C@@H]1CO1 Amb25662106 [0,1,0,1,0,0|1,0,0]=3 10098 B9R1.83 COCCOC[C@H]1CO1 Amb25235829 [0,1,0,1,0,0|1,0,0]=3 10099 B9R1.83 COCCSC[C@@H]1CO1 Amb25144763 [0,1,0,1,0,0|1,1,0]=4 10100 B9R1.83 COCCSC[C@H]1CO1 Amb24688758 [0,1,0,1,0,0|1,1,0]=4 10101 B9R1.83 COCC\C=C\C1CC1 Amb22365293 [0,1,0,1,0,0|1,0,1]=4 10102 B9R1.83 CSCCSCC1CC1 Amb25767453 [0,1,0,1,0,0|0,2,0]=4 10103 B9R1.83 CSCCSCC1CO1 Amb24504393 [0,1,0,1,0,0|1,1,0]=4 10104 B9R1.83 CSCCSC[C@@H]1CO1 Amb24423532 [0,1,0,1,0,0|1,1,0]=4 10105 B9R1.83 CSCCSC[C@H]1CO1 Amb25288538 [0,1,0,1,0,0|1,1,0]=4 10106 B9R1.83 C\C=C\COCC1CO1 Amb25121507 [0,1,0,1,0,0|0,0,2]=4 10107 B9R1.83 ClCCCNCC1CC1 Amb24387928 [0,1,0,1,0,0|2,0,0]=4 10108 B9R1.83 ClCCNCCC1CC1 Amb24532852 [0,1,0,1,0,0|2,0,0]=4 10109 B9R1.83 FCCCOCC1CO1 Amb22008167 [0,1,0,1,0,0|1,0,0]=3 10110 B9R1.83 FCCNCCC1CC1 Amb25269922 [0,1,0,1,0,0|2,0,0]=4 10111 B9R1.83 N#CCOCCC1CC1 Amb24529227 [0,1,0,1,0,0|1,0,1]=4 10112 B9R1.83 NCCCCCN1CC1 Amb24078338 [0,1,0,1,0,0|2,0,0]=4 10113 B9R1.83 NCCCCNC1CC1 Amb17334101 [0,1,0,1,0,0|2,0,0]=4 10114 B9R1.83 NCCCOCC1CC1 Amb1216862 [0,1,0,1,0,0|1,0,0]=3 10115 B9R1.83 NCCNCCC1CC1 Amb23513067 [0,1,0,1,0,0|2,0,0]=4 10116 B9R1.83 NCCOCCC1CC1 Amb25841330 [0,1,0,1,0,0|1,0,0]=3 10117 B9R1.83 NCCSCCC1CC1 Amb24405385 [0,1,0,1,0,0|1,1,0]=4 10118 B9R1.83 NNCCOCC1CC1 Amb24650131 [0,1,0,1,0,0|1,0,0]=3 10119 B9R1.83 NOCCOCC1CC1 Amb25175509 [0,1,0,1,0,0|0,0,0]=2 10120 B9R1.83 O=CCCCCC1CO1 Amb24469270 [0,1,0,1,0,0|1,0,1]=4 10121 B9R1.83 O=CCCCOC1CC1 Amb25373356 [0,1,0,1,0,0|1,0,1]=4 10122 B9R1.83 OCCCCNC1CC1 Amb17334108 [0,1,0,1,0,0|1,0,0]=3 10123 B9R1.83 OCCCCOC1CC1 Amb25162768 [0,1,0,1,0,0|1,0,0]=3 10124 B9R1.83 OCCCSCC1CC1 Amb24478768 [0,1,0,1,0,0|0,1,0]=3 10125 B9R1.83 OCCC\C=C\C1CC1 Amb24405654 [0,1,0,1,0,0|1,0,1]=4 10126 B9R1.83 OCCNCCC1CC1 Amb23513086 [0,1,0,1,0,0|1,0,0]=3 10127 B9R1.83 OCCNN=CC1CC1 Amb25043822 [0,1,0,1,0,0|1,0,1]=4 10128 B9R1.83 OCCSCCC1CC1 Amb25342808 [0,1,0,1,0,0|0,1,0]=3 10129 B9R1.89 BrCC1CCCCCC1 Amb19073228 [0,1,0,1,0,0|2,0,0]=4 10130 B9R1.89 BrCC1CCCCCN1 Amb25283719 [0,1,0,1,0,0|2,0,0]=4 10131 B9R1.89 BrCC1CCCOCC1 Amb24478817 [0,1,0,1,0,0|1,0,0]=3 10132 B9R1.89 BrCC1CCOCCO1 Amb25187693 [0,1,0,1,0,0|0,0,0]=2 10133 B9R1.89 BrCC1COCCOC1 Amb24383404 [0,1,0,1,0,0|1,0,0]=3 10134 B9R1.89 Br[Zn]C1CCCCCC1 Amb22897736 [0,1,0,1,0,0|2,0,0]=4 10135 B9R1.89 C#CC1CCCCCC1 Amb25277452 [0,1,0,1,0,0|2,0,0]=4 10136 B9R1.89 C=CC1CCCCCC1 Amb25068667 [0,1,0,1,0,0|2,0,0]=4 10137 B9R1.89 CCC1CCCCCN1 Amb22055381 [0,1,0,1,0,0|2,0,0]=4 10138 B9R1.89 CCC1CCNCCO1 Amb25367816 [0,1,0,1,0,0|1,0,0]=3 10139 B9R1.89 CCC1CNCCCS1 Amb25841075 [0,1,0,1,0,0|1,1,0]=4 10140 B9R1.89 CCC1COCCCN1 Amb18106727 [0,1,0,1,0,0|1,0,0]=3 10141 B9R1.89 CCC1CSCCCN1 Amb25197771 [0,1,0,1,0,0|1,1,0]=4 10142 B9R1.89 CCN1CCCCCC1 Amb16231374 [0,1,0,1,0,0|2,0,0]=4 10143 B9R1.89 CCN1CCCNCC1 Amb22586917 [0,1,0,1,0,0|2,0,0]=4 10144 B9R1.89 CCN1CCNCCC1 Amb1139329 [0,1,0,1,0,0|2,0,0]=4 10145 B9R1.89 CNC1CCCCCC1 Amb1106215 [0,1,0,1,0,0|2,0,0]=4 10146 B9R1.89 CNC1CCCCCC1 Amb22587117 [0,1,0,1,0,0|2,0,0]=4 10147 B9R1.89 CNC1CCCCNC1 Amb10576552 [0,1,0,1,0,0|2,0,0]=4 10148 B9R1.89 CNC1CCCNCC1 Amb22059341 [0,1,0,1,0,0|2,0,0]=4 10149 B9R1.89 CNC1COCCOC1 Amb24644195 [0,1,0,1,0,0|1,0,0]=3 10150 B9R1.89 CN[C@@H]1CNCCCC1 Amb25146100 [0,1,0,1,0,0|2,0,0]=4 10151 B9R1.89 COC1CCCNCC1 Amb22405875 [0,1,0,1,0,0|2,0,0]=4 10152 B9R1.89 COC1CCCNCC1 Amb22405876 [0,1,0,1,0,0|2,0,0]=4 10153 B9R1.89 COC1CNCCCC1 Amb25282918 [0,1,0,1,0,0|1,0,0]=3 10154 B9R1.89 COC1CNCCNC1 Amb24679242 [0,1,0,1,0,0|2,0,0]=4 10155 B9R1.89 CSC1CCCNCC1 Amb24457994 [0,1,0,1,0,0|2,0,0]=4 10156 B9R1.89 CSC1CNCCCC1 Amb20668460 [0,1,0,1,0,0|1,1,0]=4 10157 B9R1.89 ClCC1CCCNCC1 Amb25839149 [0,1,0,1,0,0|2,0,0]=4 10158 B9R1.89 ClCC1COCCOC1 Amb25702249 [0,1,0,1,0,0|1,0,0]=3 10159 B9R1.89 ClCC1SCCCCS1 Amb22265160 [0,1,0,1,0,0|1,1,0]=4 10160 B9R1.89 ICC1CCCCCO1 Amb22489614 [0,1,0,1,0,0|1,0,0]=3 10161 B9R1.89 N#CC1CNCCCO1 Amb25731311 [0,1,0,1,0,0|1,0,1]=4 10162 B9R1.89 N#C[C@H]1COCCCN1 Amb24604900 [0,1,0,1,0,0|2,0,0]=4 10163 B9R1.89 NCC1CCCCCC1 Amb22001955 [0,1,0,1,0,0|2,0,0]=4 10164 B9R1.89 NCC1CCCOCC1 Amb18203218 [0,1,0,1,0,0|1,0,0]=3 10165 B9R1.89 NCC1CCCSCC1 Amb18198731 [0,1,0,1,0,0|1,1,0]=4 10166 B9R1.89 NCC1CNCCCS1 Amb25336569 [0,1,0,1,0,0|1,1,0]=4 10167 B9R1.89 NCC1COCCCO1 Amb25131279 [0,1,0,1,0,0|1,0,0]=3 10168 B9R1.89 NCC1COCCOC1 Amb24383679 [0,1,0,1,0,0|1,0,0]=3 10169 B9R1.89 NNC1CCCCCC1 Amb19373178 [0,1,0,1,0,0|2,0,0]=4 10170 B9R1.89 NNC1CCCCCC1 Amb22227928 [0,1,0,1,0,0|2,0,0]=4 10171 B9R1.89 NNC1CCCOCC1 Amb24707598 [0,1,0,1,0,0|2,0,0]=4 10172 B9R1.89 NNC1COCCOC1 Amb24375626 [0,1,0,1,0,0|2,0,0]=4 10173 B9R1.89 NOC1CCCCCC1 Amb25315377 [0,1,0,1,0,0|1,0,0]=3 10174 B9R1.89 O=CC1CCCOCC1 Amb18832626 [0,1,0,1,0,0|1,0,1]=4 10175 B9R1.89 O=CC1CCOCCO1 Amb24397234 [0,1,0,1,0,0|0,0,1]=3 10176 B9R1.89 O=CC1COCCOC1 Amb25721225 [0,1,0,1,0,0|1,0,1]=4 10177 B9R1.89 OCC1C=CCCCO1 Amb25262906 [0,1,0,1,0,0|0,0,1]=3 10178 B9R1.89 OCC1CC=CCCC1 Amb24520604 [0,1,0,1,0,0|1,0,1]=4 10179 B9R1.89 OCC1CCC=CCC1 Amb25100187 [0,1,0,1,0,0|1,0,1]=4 10180 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|1,0,0]=3 10181 B9R1.89 OCC1CCCCCO1 Amb25687959 [0,1,0,1,0,0|0,0,0]=2 10182 B9R1.89 OCC1CCCNCC1 Amb22886282 [0,1,0,1,0,0|1,0,0]=3 10183 B9R1.89 OCC1CCCOCC1 Amb18203196 [0,1,0,1,0,0|1,0,0]=3 10184 B9R1.89 OCC1CCCSCC1 Amb18202263 [0,1,0,1,0,0|1,0,0]=3 10185 B9R1.89 OCC1CCOCC=C1 Amb25296401 [0,1,0,1,0,0|1,0,1]=4 10186 B9R1.89 OCC1CNCCCC1 Amb19149352 [0,1,0,1,0,0|1,0,0]=3 10187 B9R1.89 OCC1CNCCCN1 Amb17578110 [0,1,0,1,0,0|1,0,0]=3 10188 B9R1.89 OCC1CNCCCO1 Amb17935876 [0,1,0,1,0,0|0,0,0]=2 10189 B9R1.89 OCC1CNCCCO1 Amb22497000 [0,1,0,1,0,0|0,0,0]=2 10190 B9R1.89 OCC1CNCCCS1 Amb24513528 [0,1,0,1,0,0|0,1,0]=3 10191 B9R1.89 OCC1CNCCNC1 Amb22224806 [0,1,0,1,0,0|2,0,0]=4 10192 B9R1.89 OCC1CNCCOC1 Amb24481995 [0,1,0,1,0,0|1,0,0]=3 10193 B9R1.89 OCC1COCCCO1 Amb25229839 [0,1,0,1,0,0|0,0,0]=2 10194 B9R1.89 OCC1CSCCCS1 Amb24403868 [0,1,0,1,0,0|0,1,0]=3 10195 B9R1.89 OC[C@@H]1C=CCCCO1 Amb25306512 [0,1,0,1,0,0|0,0,1]=3 10196 B9R1.89 OC[C@@H]1CC=CCCO1 Amb25741386 [0,1,0,1,0,0|0,0,1]=3 10197 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [0,1,0,1,0,0|1,0,0]=3 10198 B9R1.89 OC[C@@H]1CNCCCC1 Amb24407589 [0,1,0,1,0,0|1,0,0]=3 10199 B9R1.89 OC[C@@H]1CNCCCO1 Amb24461208 [0,1,0,1,0,0|0,0,0]=2 10200 B9R1.89 ONC1CCCCCC1 Amb25724076 [0,1,0,1,0,0|1,0,0]=3 10201 B9R1.89 ONC1CCCOCC1 Amb24409239 [0,1,0,1,0,0|2,0,0]=4 10202 B9R1.89 SCC1CCCCCN1 Amb24477790 [0,1,0,1,0,0|1,1,0]=4 10203 B9R1.89 [C-]#[N+]C1CCCCCC1 Amb1981029 [0,1,0,1,0,0|2,0,0]=4 10204 B9R1.103 C1CCCCCCC=C1 Amb22365157 [0,1,0,1,0,0|2,0,0]=4 10205 B9R1.103 C1CCCCCCCC1 Amb25779653 [0,1,0,1,0,0|2,0,0]=4 10206 B9R1.103 C1CCCCCCCN1 Amb21963016 [0,1,0,1,0,0|2,0,0]=4 10207 B9R1.103 C1CCNCCCCN1 Amb24460244 [0,1,0,1,0,0|2,0,0]=4 10208 B9R1.103 C1CCSCCCCN1 Amb25368301 [0,1,0,1,0,0|1,1,0]=4 10209 B9R1.103 C1CNCCNCCN1 Amb20203706 [0,1,0,1,0,0|2,0,0]=4 10210 B9R1.103 C1CNCCNCCN1 Amb21953158 [0,1,0,1,0,0|2,0,0]=4 10211 B9R1.103 C1CNCCNCCO1 Amb25742766 [0,1,0,1,0,0|1,0,0]=3 10212 B9R1.103 C1CNCCNCCS1 Amb21953151 [0,1,0,1,0,0|1,1,0]=4 10213 B9R1.103 C1CNCCNCCS1 Amb21953197 [0,1,0,1,0,0|1,1,0]=4 10214 B9R1.103 C1CSCCSCCO1 Amb24647700 [0,1,0,1,0,0|0,1,0]=3 10215 B9R1.1 CC1CCC(CBr)CC1 Amb22886696 [0,1,0,1,0,0|2,0,0]=4 10216 B9R1.1 CC1CCC(CC1)CC Amb22227949 [0,1,0,1,0,0|2,0,0]=4 10217 B9R1.1 CC1CCC(CI)CC1 Amb24642716 [0,1,0,1,0,0|2,0,0]=4 10218 B9R1.1 CC1CCC(CN)NC1 Amb25379312 [0,1,0,1,0,0|2,0,0]=4 10219 B9R1.1 CC1CCC(CN1)CO Amb22886321 [0,1,0,1,0,0|2,0,0]=4 10220 B9R1.1 CC1CCC(CO)C=C1 Amb25266254 [0,1,0,1,0,0|1,0,1]=4 10221 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [0,1,0,1,0,0|1,0,0]=3 10222 B9R1.1 CC1CCC(CO)NC1 Amb22886337 [0,1,0,1,0,0|1,0,0]=3 10223 B9R1.1 CC1CCC(CO)NC1 Amb24745499 [0,1,0,1,0,0|1,0,0]=3 10224 B9R1.1 CC1CCC(CS)CC1 Amb25188956 [0,1,0,1,0,0|1,1,0]=4 10225 B9R1.1 CC1CCC(OC1)OC Amb24742805 [0,1,0,1,0,0|2,0,0]=4 10226 B9R1.1 CC1CNC(CN1)CC Amb22739936 [0,1,0,1,0,0|2,0,0]=4 10227 B9R1.1 CC1CNC(CN1)CC Amb22739939 [0,1,0,1,0,0|2,0,0]=4 10228 B9R1.1 CC1CNC(CN1)CO Amb17578108 [0,1,0,1,0,0|2,0,0]=4 10229 B9R1.1 CC1CNC(CS1)CC Amb25276028 [0,1,0,1,0,0|1,1,0]=4 10230 B9R1.1 CC1COC(CCl)OC1 Amb24407279 [0,1,0,1,0,0|2,0,0]=4 10231 B9R1.1 CC1COC(CN1)CO Amb20669470 [0,1,0,1,0,0|1,0,0]=3 10232 B9R1.1 CC1COC(CN1)CO Amb22755055 [0,1,0,1,0,0|1,0,0]=3 10233 B9R1.1 CC1COC(CO1)CC Amb25726501 [0,1,0,1,0,0|0,0,0]=2 10234 B9R1.1 CC1COC(CO1)CO Amb24556857 [0,1,0,1,0,0|1,0,0]=3 10235 B9R1.1 CC1CSC(CN1)CC Amb24478779 [0,1,0,1,0,0|1,1,0]=4 10236 B9R1.1 CCC1CCC(CC1)N Amb1117745 [0,1,0,1,0,0|2,0,0]=4 10237 B9R1.1 CCC1CCC(I)CC1 Amb25147180 [0,1,0,1,0,0|2,0,0]=4 10238 B9R1.1 CCC1CCC(O)OC1 Amb24593816 [0,1,0,1,0,0|1,0,0]=3 10239 B9R1.1 CCC1COC(CN1)C Amb1105038 [0,1,0,1,0,0|1,0,0]=3 10240 B9R1.1 CC[C@@H]1CC[C@@H](Br)CC1 Amb25363274 [0,1,0,1,0,0|2,0,0]=4 10241 B9R1.1 CC[C@@H]1CC[C@@H](O)CC1 Amb22231677 [0,1,0,1,0,0|2,0,0]=4 10242 B9R1.1 CC[C@H]1CC[C@@H](N)CC1 Amb25731260 [0,1,0,1,0,0|2,0,0]=4 10243 B9R1.1 CC[C@H]1CN[C@@H](CN1)C Amb15692176 [0,1,0,1,0,0|2,0,0]=4 10244 B9R1.1 CC[C@H]1OC[C@@H](O)CO1 Amb24419662 [0,1,0,1,0,0|2,0,0]=4 10245 B9R1.1 COC1CC[C@@H](O)CO1 Amb25740683 [0,1,0,1,0,0|2,0,0]=4 10246 B9R1.1 CO[C@@H]1CC[C@@H](O)CO1 Amb24619202 [0,1,0,1,0,0|2,0,0]=4 10247 B9R1.1 CO[C@@H]1CC[C@H](O)CO1 Amb25271394 [0,1,0,1,0,0|2,0,0]=4 10248 B9R1.1 CO[C@H]1CC[C@H](O)CO1 Amb25333575 [0,1,0,1,0,0|2,0,0]=4 10249 B9R1.1 C[C@@H]1CC[C@@H](CCl)CC1 Amb24350282 [0,1,0,1,0,0|2,0,0]=4 10250 B9R1.1 C[C@@H]1CC[C@@H](CO)CC1 Amb22886817 [0,1,0,1,0,0|1,0,0]=3 10251 B9R1.1 C[C@@H]1CC[C@H](CC1)CC Amb22231656 [0,1,0,1,0,0|2,0,0]=4 10252 B9R1.1 C[C@@H]1CC[C@H](CN)CC1 Amb24477759 [0,1,0,1,0,0|2,0,0]=4 10253 B9R1.1 C[C@@H]1CC[C@H](CN1)CO Amb24062957 [0,1,0,1,0,0|2,0,0]=4 10254 B9R1.1 C[C@@H]1CC[C@H](CN1)CO Amb24515133 [0,1,0,1,0,0|2,0,0]=4 10255 B9R1.1 C[C@@H]1CN[C@H](CN1)CO Amb25245301 [0,1,0,1,0,0|2,0,0]=4 10256 B9R1.1 C[C@@H]1CO[C@@H](CBr)OC1 Amb25100945 [0,1,0,1,0,0|2,0,0]=4 10257 B9R1.1 C[C@H]1CC[C@@H](CO)OC1 Amb25245499 [0,1,0,1,0,0|0,0,0]=2 10258 B9R1.1 C[C@H]1CC[C@H](CC1)CC Amb22230416 [0,1,0,1,0,0|2,0,0]=4 10259 B9R1.1 C[C@H]1CO[C@@H](CO1)CO Amb25206642 [0,1,0,1,0,0|1,0,0]=3 10260 B9R1.1 ClCC1OCC(CO1)O Amb17593814 [0,1,0,1,0,0|2,0,0]=4 10261 B9R1.1 Cl[C@H]1CC[C@H](CCl)SC1 Amb25275005 [0,1,0,1,0,0|1,1,0]=4 10262 B9R1.1 NC1CCC(CC1)CN Amb22491653 [0,1,0,1,0,0|2,0,0]=4 10263 B9R1.1 NC1CCC(CC1)CN Amb22491656 [0,1,0,1,0,0|2,0,0]=4 10264 B9R1.1 NC1CCC(CC1)NO Amb25304980 [0,1,0,1,0,0|2,0,0]=4 10265 B9R1.1 NC1CCC(CCl)CC1 Amb25106851 [0,1,0,1,0,0|2,0,0]=4 10266 B9R1.1 NC1CCC(CO)OC1 Amb25260412 [0,1,0,1,0,0|0,0,0]=2 10267 B9R1.1 NC1COC(CO)C=C1 Amb25252252 [0,1,0,1,0,0|0,0,2]=4 10268 B9R1.1 NCC1CCC(CC1)N Amb16233730 [0,1,0,1,0,0|2,0,0]=4 10269 B9R1.1 NCC1CCC(F)CC1 Amb24122686 [0,1,0,1,0,0|2,0,0]=4 10270 B9R1.1 NCC1CCC(F)CC1 Amb25727264 [0,1,0,1,0,0|2,0,0]=4 10271 B9R1.1 NCC1CCC(O)CC1 Amb20669423 [0,1,0,1,0,0|2,0,0]=4 10272 B9R1.1 NCC1CCC(O)CS1 Amb23596946 [0,1,0,1,0,0|1,1,0]=4 10273 B9R1.1 NC[C@@H]1CC[C@@H](O)CC1 Amb23439293 [0,1,0,1,0,0|2,0,0]=4 10274 B9R1.1 NC[C@@H]1CC[C@@H](O)CC1 Amb25075878 [0,1,0,1,0,0|2,0,0]=4 10275 B9R1.1 NC[C@@H]1CC[C@H](O)CC1 Amb24183403 [0,1,0,1,0,0|2,0,0]=4 10276 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb25323044 [0,1,0,1,0,0|2,0,0]=4 10277 B9R1.1 NC[C@H]1CC[C@@H](S)CC1 Amb24461708 [0,1,0,1,0,0|2,0,0]=4 10278 B9R1.1 N[C@@H]1CC[C@@H](CO)CC1 Amb22747955 [0,1,0,1,0,0|1,0,0]=3 10279 B9R1.1 N[C@@H]1CC[C@H](CCl)CC1 Amb24476613 [0,1,0,1,0,0|2,0,0]=4 10280 B9R1.1 N[C@@H]1CC[C@H](CO)C=C1 Amb24443345 [0,1,0,1,0,0|1,0,1]=4 10281 B9R1.1 N[C@@H]1CC[C@H](CO)CC1 Amb20668772 [0,1,0,1,0,0|1,0,0]=3 10282 B9R1.1 N[C@@H]1CC[C@H](CO)CC1 Amb22899692 [0,1,0,1,0,0|1,0,0]=3 10283 B9R1.1 N[C@H]1CC[C@@H](CO)C=C1 Amb24649717 [0,1,0,1,0,0|1,0,1]=4 10284 B9R1.1 N[C@H]1CC[C@H](CC1)CN Amb24405174 [0,1,0,1,0,0|2,0,0]=4 10285 B9R1.1 OC1CCC(CBr)CC1 Amb24697955 [0,1,0,1,0,0|2,0,0]=4 10286 B9R1.1 OC1CCC(CCl)CC1 Amb24480360 [0,1,0,1,0,0|2,0,0]=4 10287 B9R1.1 OC1CCC(CI)CC1 Amb25728551 [0,1,0,1,0,0|2,0,0]=4 10288 B9R1.1 OC1CCC(CO)SC1 Amb24520392 [0,1,0,1,0,0|0,1,0]=3 10289 B9R1.1 OC1COC(CO)OC1 Amb24648150 [0,1,0,1,0,0|1,0,0]=3 10290 B9R1.1 OCC1CCC(=C)CC1 Amb10975464 [0,1,0,1,0,0|1,0,1]=4 10291 B9R1.1 OCC1CCC(=O)CC1 Amb10071596 [0,1,0,1,0,0|1,0,1]=4 10292 B9R1.1 OCC1CCC(=O)CN1 Amb25207554 [0,1,0,1,0,0|1,0,1]=4 10293 B9R1.1 OCC1CCC(CC1)O Amb13883568 [0,1,0,1,0,0|1,0,0]=3 10294 B9R1.1 OCC1CCC(F)CC1 Amb24122685 [0,1,0,1,0,0|1,0,0]=3 10295 B9R1.1 OCC1CCN(CC1)C Amb1099350 [0,1,0,1,0,0|2,0,0]=4 10296 B9R1.1 OCC1CNC(=O)CO1 Amb22236094 [0,1,0,1,0,0|1,0,1]=4 10297 B9R1.1 OC[C@@H]1CC[C@H](CC1)N Amb17607961 [0,1,0,1,0,0|1,0,0]=3 10298 B9R1.1 OC[C@@H]1CNC(=O)CO1 Amb10067153 [0,1,0,1,0,0|1,0,1]=4 10299 B9R1.1 O[C@@H]1CC[C@@H](CO)OC1 Amb25263973 [0,1,0,1,0,0|0,0,0]=2 10300 B9R1.1 O[C@@H]1CC[C@H](CC1)CO Amb25320791 [0,1,0,1,0,0|1,0,0]=3 10301 B9R1.1 O[C@@H]1CC[C@H](CCl)CC1 Amb25745432 [0,1,0,1,0,0|2,0,0]=4 10302 B9R1.3 BrC1C(C)CCNC1C Amb10602249 [0,1,0,1,0,0|2,0,0]=4 10303 B9R1.3 CC1C(C)CCCC1C Amb22227691 [0,1,0,1,0,0|2,0,0]=4 10304 B9R1.3 CC1C(O)CCCC1=C Amb25685563 [0,1,0,1,0,0|1,0,1]=4 10305 B9R1.3 CC1C(O)CCCC1O Amb24464013 [0,1,0,1,0,0|1,0,0]=3 10306 B9R1.3 CC1C(O)CCNC1C Amb22291647 [0,1,0,1,0,0|2,0,0]=4 10307 B9R1.3 CC1C(O)CNCC1O Amb24362710 [0,1,0,1,0,0|1,0,0]=3 10308 B9R1.3 CC1CCCC(Br)C1O Amb24601208 [0,1,0,1,0,0|1,0,0]=3 10309 B9R1.3 CC1CCCC(C1N)C Amb1116609 [0,1,0,1,0,0|2,0,0]=4 10310 B9R1.3 CC1CCCC(C1O)C Amb2227580 [0,1,0,1,0,0|1,0,0]=3 10311 B9R1.3 CC1CCCC(Cl)C1O Amb24539273 [0,1,0,1,0,0|1,0,0]=3 10312 B9R1.3 CC1CCCC(F)C1N Amb24650619 [0,1,0,1,0,0|2,0,0]=4 10313 B9R1.3 CC1CCCC(N)C1F Amb24738759 [0,1,0,1,0,0|2,0,0]=4 10314 B9R1.3 CC1CCCC(N)C1N Amb24761483 [0,1,0,1,0,0|2,0,0]=4 10315 B9R1.3 CC1CCCC(O)C1Cl Amb25707552 [0,1,0,1,0,0|2,0,0]=4 10316 B9R1.3 CC1CCCC(O)C1N Amb25377554 [0,1,0,1,0,0|2,0,0]=4 10317 B9R1.3 CC1CCCC(O)C1O Amb25823103 [0,1,0,1,0,0|1,0,0]=3 10318 B9R1.3 CC1CCCC(S)C1C Amb25731166 [0,1,0,1,0,0|1,1,0]=4 10319 B9R1.3 CC1CCC[C@@H](O)[C@H]1O Amb25245925 [0,1,0,1,0,0|1,0,0]=3 10320 B9R1.3 CC1CCNC(C)C1N Amb24529075 [0,1,0,1,0,0|2,0,0]=4 10321 B9R1.3 CC1CCOC(=O)C1O Amb25369401 [0,1,0,1,0,0|0,0,1]=3 10322 B9R1.3 CC1CCOC(=O)[C@H]1O Amb25315194 [0,1,0,1,0,0|0,0,1]=3 10323 B9R1.3 CC1CCOC(C)C1=O Amb25834282 [0,1,0,1,0,0|0,0,2]=4 10324 B9R1.3 CC1CCOC(C)C1O Amb24428158 [0,1,0,1,0,0|0,0,0]=2 10325 B9R1.3 CC1CCOC(O)C1C Amb25255954 [0,1,0,1,0,0|1,0,0]=3 10326 B9R1.3 CC1CNCC(C)C1O Amb22299424 [0,1,0,1,0,0|2,0,0]=4 10327 B9R1.3 CC1COCC(C)C1N Amb22299426 [0,1,0,1,0,0|2,0,0]=4 10328 B9R1.3 CC1COCC(C)C1O Amb22299419 [0,1,0,1,0,0|2,0,0]=4 10329 B9R1.3 CC1COCC(C)C1S Amb22299428 [0,1,0,1,0,0|2,0,0]=4 10330 B9R1.3 CC1OCCC(=O)C1O Amb24723617 [0,1,0,1,0,0|1,0,1]=4 10331 B9R1.3 CC1OCCC(Br)C1O Amb24652672 [0,1,0,1,0,0|1,0,0]=3 10332 B9R1.3 CC1OCCC(N)[C@@H]1O Amb24603424 [0,1,0,1,0,0|1,0,0]=3 10333 B9R1.3 CC1OCCC(N)[C@H]1O Amb24561304 [0,1,0,1,0,0|1,0,0]=3 10334 B9R1.3 CC1OCCC(O)C1O Amb25147154 [0,1,0,1,0,0|1,0,0]=3 10335 B9R1.3 CC1[C@H](O)CCC[C@H]1O Amb25246240 [0,1,0,1,0,0|1,0,0]=3 10336 B9R1.3 C[C@@H]1CC=C[C@H](O)[C@@H]1O Amb25215836 [0,1,0,1,0,0|1,0,1]=4 10337 B9R1.3 C[C@@H]1CCCC(C)C1N Amb24524152 [0,1,0,1,0,0|2,0,0]=4 10338 B9R1.3 C[C@@H]1CCC[C@@H](C)C1N Amb24598857 [0,1,0,1,0,0|2,0,0]=4 10339 B9R1.3 C[C@@H]1CCC[C@@H](Cl)[C@@H]1O Amb25258029 [0,1,0,1,0,0|1,0,0]=3 10340 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1N Amb24515607 [0,1,0,1,0,0|2,0,0]=4 10341 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@H]1C Amb24747627 [0,1,0,1,0,0|1,0,0]=3 10342 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@H]1O Amb25176154 [0,1,0,1,0,0|1,0,0]=3 10343 B9R1.3 C[C@@H]1CCC[C@H](C)[C@@H]1N Amb25836294 [0,1,0,1,0,0|2,0,0]=4 10344 B9R1.3 C[C@@H]1CCC[C@H](N)[C@@H]1N Amb24604365 [0,1,0,1,0,0|2,0,0]=4 10345 B9R1.3 C[C@@H]1CCOC(O)[C@H]1O Amb25226516 [0,1,0,1,0,0|0,0,0]=2 10346 B9R1.3 C[C@@H]1CNC[C@@H](O)[C@@H]1O Amb25215689 [0,1,0,1,0,0|2,0,0]=4 10347 B9R1.3 C[C@@H]1CNC[C@H](O)[C@H]1O Amb24622269 [0,1,0,1,0,0|2,0,0]=4 10348 B9R1.3 C[C@@H]1OCO[C@@H](C)C1Cl Amb25233425 [0,1,0,1,0,0|2,0,0]=4 10349 B9R1.3 C[C@@H]1[C@@H](C)CCC[C@H]1C Amb24502189 [0,1,0,1,0,0|2,0,0]=4 10350 B9R1.3 C[C@@H]1[C@@H](N)CCC[C@@H]1O Amb24567883 [0,1,0,1,0,0|1,0,0]=3 10351 B9R1.3 C[C@@H]1[C@@H](N)CCC[C@H]1O Amb24547389 [0,1,0,1,0,0|1,0,0]=3 10352 B9R1.3 C[C@@H]1[C@@H](O)CCCC1=C Amb25346368 [0,1,0,1,0,0|1,0,1]=4 10353 B9R1.3 C[C@@H]1[C@@H](O)CCCN1C Amb24539353 [0,1,0,1,0,0|2,0,0]=4 10354 B9R1.3 C[C@@H]1[C@H](C)CCC[C@@H]1C Amb25245256 [0,1,0,1,0,0|2,0,0]=4 10355 B9R1.3 C[C@@H]1[C@H](N)CCC[C@@H]1N Amb25377989 [0,1,0,1,0,0|2,0,0]=4 10356 B9R1.3 C[C@@H]1[C@H](N)CCC[C@@H]1O Amb24580457 [0,1,0,1,0,0|1,0,0]=3 10357 B9R1.3 C[C@@H]1[C@H](O)CCNC1C Amb24182208 [0,1,0,1,0,0|2,0,0]=4 10358 B9R1.3 C[C@H]1CCCC(N)[C@@H]1C Amb24628802 [0,1,0,1,0,0|2,0,0]=4 10359 B9R1.3 C[C@H]1CCC[C@@H](C)[C@@H]1N Amb25146182 [0,1,0,1,0,0|2,0,0]=4 10360 B9R1.3 C[C@H]1CCOC(=O)[C@H]1O Amb25239425 [0,1,0,1,0,0|0,0,1]=3 10361 B9R1.3 C[C@H]1CNC[C@@H](O)[C@@H]1O Amb24514890 [0,1,0,1,0,0|2,0,0]=4 10362 B9R1.3 C[C@H]1CNC[C@H](O)[C@H]1O Amb25302335 [0,1,0,1,0,0|2,0,0]=4 10363 B9R1.3 C[C@H]1NCC[C@@H](O)[C@@H]1O Amb25363990 [0,1,0,1,0,0|2,0,0]=4 10364 B9R1.3 C[C@H]1OCC[C@@H](Br)[C@@H]1O Amb25225661 [0,1,0,1,0,0|1,0,0]=3 10365 B9R1.3 C[C@H]1OCO[C@@H](C)[C@@H]1Cl Amb25138652 [0,1,0,1,0,0|2,0,0]=4 10366 B9R1.3 C[C@H]1[C@@H](O)CCCC1=O Amb24737440 [0,1,0,1,0,0|1,0,1]=4 10367 B9R1.3 C[C@H]1[C@@H](O)CCNC1C Amb1019529 [0,1,0,1,0,0|2,0,0]=4 10368 B9R1.3 C[C@H]1[C@H](O)CCCC1=C Amb24515569 [0,1,0,1,0,0|1,0,1]=4 10369 B9R1.3 NC1C(O)CCCC1O Amb18642840 [0,1,0,1,0,0|2,0,0]=4 10370 B9R1.3 NC1CCCC(N)C1O Amb25046672 [0,1,0,1,0,0|2,0,0]=4 10371 B9R1.3 NC1CCCC(O)C1N Amb24120363 [0,1,0,1,0,0|2,0,0]=4 10372 B9R1.3 NC1CCCC(O)C1O Amb25800086 [0,1,0,1,0,0|2,0,0]=4 10373 B9R1.3 NC1[C@H](O)CCC[C@H]1O Amb25232667 [0,1,0,1,0,0|2,0,0]=4 10374 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@@H]1N Amb24616745 [0,1,0,1,0,0|2,0,0]=4 10375 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@@H]1O Amb24698018 [0,1,0,1,0,0|2,0,0]=4 10376 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1N Amb24697711 [0,1,0,1,0,0|2,0,0]=4 10377 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1O Amb22899068 [0,1,0,1,0,0|2,0,0]=4 10378 B9R1.3 N[C@@H]1CCC[C@@H](O)[C@H]1O Amb24117833 [0,1,0,1,0,0|2,0,0]=4 10379 B9R1.3 N[C@@H]1CNC[C@H](O)[C@@H]1O Amb24516608 [0,1,0,1,0,0|2,0,0]=4 10380 B9R1.3 N[C@H]1CCC[C@@H](N)[C@@H]1O Amb25128067 [0,1,0,1,0,0|2,0,0]=4 10381 B9R1.3 N[C@H]1CCC[C@@H](O)[C@@H]1N Amb24514812 [0,1,0,1,0,0|2,0,0]=4 10382 B9R1.3 N[C@H]1CCC[C@@H](O)[C@H]1N Amb24624699 [0,1,0,1,0,0|2,0,0]=4 10383 B9R1.3 N[C@H]1CCO[C@H](O)[C@H]1O Amb25261021 [0,1,0,1,0,0|1,0,0]=3 10384 B9R1.3 OC1C(O)CCCC1O Amb22227693 [0,1,0,1,0,0|2,0,0]=4 10385 B9R1.3 OC1C(O)CNCC1O Amb22489592 [0,1,0,1,0,0|2,0,0]=4 10386 B9R1.3 OC1C(O)CSCC1O Amb24403776 [0,1,0,1,0,0|1,1,0]=4 10387 B9R1.3 OC1CCCC(O)C1Cl Amb24601854 [0,1,0,1,0,0|2,0,0]=4 10388 B9R1.3 OC1CCC[C@@H](Cl)[C@@H]1Cl Amb25172902 [0,1,0,1,0,0|2,0,0]=4 10389 B9R1.3 OC1CCOC(=O)C1O Amb24735003 [0,1,0,1,0,0|1,0,1]=4 10390 B9R1.3 OC1COCC(O)C1F Amb25366444 [0,1,0,1,0,0|1,0,0]=3 10391 B9R1.3 OC1[C@@H](O)CNC[C@@H]1O Amb25174875 [0,1,0,1,0,0|2,0,0]=4 10392 B9R1.3 OC1[C@H](O)CCC[C@H]1O Amb25176360 [0,1,0,1,0,0|2,0,0]=4 10393 B9R1.3 O[C@@H]1CCC[C@@H](Br)[C@H]1O Amb25336534 [0,1,0,1,0,0|2,0,0]=4 10394 B9R1.3 O[C@@H]1CCC[C@@H](F)[C@@H]1O Amb24749596 [0,1,0,1,0,0|2,0,0]=4 10395 B9R1.3 O[C@@H]1CCOC(O)[C@@H]1O Amb24592416 [0,1,0,1,0,0|1,0,0]=3 10396 B9R1.3 O[C@@H]1CCO[C@H](O)[C@H]1O Amb25220597 [0,1,0,1,0,0|1,0,0]=3 10397 B9R1.3 O[C@@H]1[C@@H](Cl)CCC[C@H]1Cl Amb24480156 [0,1,0,1,0,0|2,0,0]=4 10398 B9R1.3 O[C@@H]1[C@@H](F)CCC[C@H]1Br Amb25273584 [0,1,0,1,0,0|2,0,0]=4 10399 B9R1.3 O[C@@H]1[C@@H](O)CSC[C@H]1O Amb25832442 [0,1,0,1,0,0|1,1,0]=4 10400 B9R1.3 O[C@@H]1[C@H](Cl)CCC[C@@H]1Cl Amb24479979 [0,1,0,1,0,0|2,0,0]=4 10401 B9R1.3 O[C@@H]1[C@H](O)CCC[C@@H]1O Amb24618740 [0,1,0,1,0,0|2,0,0]=4 10402 B9R1.3 O[C@H]1CCC[C@@H](Cl)[C@@H]1O Amb24601497 [0,1,0,1,0,0|2,0,0]=4 10403 B9R1.3 O[C@H]1CCC[C@H](Br)[C@H]1O Amb24512141 [0,1,0,1,0,0|2,0,0]=4 10404 B9R1.3 O[C@H]1CCO[C@H](O)[C@H]1O Amb24576622 [0,1,0,1,0,0|1,0,0]=3 10405 B9R1.11 BrCC(C1OCCO1)C Amb17336913 [0,1,0,1,0,0|1,0,0]=3 10406 B9R1.11 CC(CBr)C1CCCC1 Amb24478814 [0,1,0,1,0,0|2,0,0]=4 10407 B9R1.11 CC(CCl)C1CCCC1 Amb25327474 [0,1,0,1,0,0|2,0,0]=4 10408 B9R1.11 CC(CCl)C1CCCO1 Amb25764692 [0,1,0,1,0,0|2,0,0]=4 10409 B9R1.11 CC(CCl)C1OCCO1 Amb25270916 [0,1,0,1,0,0|1,0,0]=3 10410 B9R1.11 CC(CCl)N1CCCC1 Amb21955715 [0,1,0,1,0,0|2,0,0]=4 10411 B9R1.11 CC(CO)=C1CCCC1 Amb24525538 [0,1,0,1,0,0|1,0,1]=4 10412 B9R1.11 CC(CO)C1CCCS1 Amb25268662 [0,1,0,1,0,0|2,0,0]=4 10413 B9R1.11 CC(CO)C1CCSC1 Amb25268663 [0,1,0,1,0,0|2,0,0]=4 10414 B9R1.11 CC(CO)C1OCCO1 Amb25369294 [0,1,0,1,0,0|1,0,0]=3 10415 B9R1.11 CC(CS)C1OCCS1 Amb25712935 [0,1,0,1,0,0|1,1,0]=4 10416 B9R1.11 CC(NO)C1CCCC1 Amb24608800 [0,1,0,1,0,0|2,0,0]=4 10417 B9R1.11 CCC(=O)C1CCCO1 Amb23590157 [0,1,0,1,0,0|1,0,1]=4 10418 B9R1.11 CCC(=O)C1OCCO1 Amb25059671 [0,1,0,1,0,0|0,0,1]=3 10419 B9R1.11 CCC(Br)C1CCCC1 Amb25316496 [0,1,0,1,0,0|2,0,0]=4 10420 B9R1.11 CCC(C)C1CCCC1 Amb17689395 [0,1,0,1,0,0|2,0,0]=4 10421 B9R1.11 CCC(C)N1CCCC1 Amb25375419 [0,1,0,1,0,0|2,0,0]=4 10422 B9R1.11 CCC(C1CCCN1)C Amb2234975 [0,1,0,1,0,0|2,0,0]=4 10423 B9R1.11 CCC(C1CCCN1)O Amb17231861 [0,1,0,1,0,0|2,0,0]=4 10424 B9R1.11 CCC(Cl)C1=CCCO1 Amb24387023 [0,1,0,1,0,0|1,0,1]=4 10425 B9R1.11 CCC(Cl)C1CCCO1 Amb25134267 [0,1,0,1,0,0|1,0,0]=3 10426 B9R1.11 CCC(F)C1CCCN1 Amb23454754 [0,1,0,1,0,0|2,0,0]=4 10427 B9R1.11 CCC(N)C1CCCC1 Amb18281187 [0,1,0,1,0,0|2,0,0]=4 10428 B9R1.11 CCC(N)C1CCCO1 Amb22059669 [0,1,0,1,0,0|1,0,0]=3 10429 B9R1.11 CCC(N)C1OCCO1 Amb25162815 [0,1,0,1,0,0|0,0,0]=2 10430 B9R1.11 CCC(N)[C@H]1CCCO1 Amb24587727 [0,1,0,1,0,0|1,0,0]=3 10431 B9R1.11 CCC(O)C1=CCCO1 Amb25844889 [0,1,0,1,0,0|1,0,1]=4 10432 B9R1.11 CCC(O)C1CCCS1 Amb24435821 [0,1,0,1,0,0|1,1,0]=4 10433 B9R1.11 CC[C@@H](N)C1CCCS1 Amb24583880 [0,1,0,1,0,0|1,1,0]=4 10434 B9R1.11 CC[C@@H](N)[C@H]1CCCO1 Amb24606917 [0,1,0,1,0,0|1,0,0]=3 10435 B9R1.11 CC[C@@H](O)C1CCCC1 Amb25784145 [0,1,0,1,0,0|2,0,0]=4 10436 B9R1.11 CC[C@H](N)C1CCCO1 Amb25350059 [0,1,0,1,0,0|1,0,0]=3 10437 B9R1.11 CC[C@H](N)C1CCCS1 Amb25106188 [0,1,0,1,0,0|1,1,0]=4 10438 B9R1.11 CC[C@H](O)[C@@H]1CCCN1 Amb24514813 [0,1,0,1,0,0|2,0,0]=4 10439 B9R1.11 CC[C@H](O)[C@H]1CCCN1 Amb24558620 [0,1,0,1,0,0|2,0,0]=4 10440 B9R1.11 C[C@@H](CN)N1CCCC1 Amb25075638 [0,1,0,1,0,0|2,0,0]=4 10441 B9R1.11 C[C@@H](CO)N1CCCC1 Amb25348107 [0,1,0,1,0,0|1,0,0]=3 10442 B9R1.11 C[C@H](CN)N1CCCC1 Amb24416457 [0,1,0,1,0,0|2,0,0]=4 10443 B9R1.11 C[C@H](CO)C1OCCO1 Amb24704729 [0,1,0,1,0,0|1,0,0]=3 10444 B9R1.11 C[C@H](CO)[C@@H]1CCCN1 Amb24713470 [0,1,0,1,0,0|2,0,0]=4 10445 B9R1.11 C\C=C(/C)\C1OCCO1 Amb24640796 [0,1,0,1,0,0|0,0,2]=4 10446 B9R1.11 N=C(CO)N1CCCC1 Amb23514997 [0,1,0,1,0,0|1,0,1]=4 10447 B9R1.11 NC(CBr)C1CCCC1 Amb24523717 [0,1,0,1,0,0|2,0,0]=4 10448 B9R1.11 NC(CN)C1CCCC1 Amb18284364 [0,1,0,1,0,0|2,0,0]=4 10449 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [0,1,0,1,0,0|1,0,0]=3 10450 B9R1.11 NC(CO)C1CCCO1 Amb24480307 [0,1,0,1,0,0|2,0,0]=4 10451 B9R1.11 NC(CO)C1CCOC1 Amb20628792 [0,1,0,1,0,0|2,0,0]=4 10452 B9R1.11 NC(CO)C=1CCCC1 Amb25239090 [0,1,0,1,0,0|1,0,1]=4 10453 B9R1.11 NCC(C1CCCC1)C Amb17087397 [0,1,0,1,0,0|2,0,0]=4 10454 B9R1.11 NCC(C1OCCO1)C Amb17334126 [0,1,0,1,0,0|1,0,0]=3 10455 B9R1.11 NCC(N1CCCC1)C Amb1124431 [0,1,0,1,0,0|2,0,0]=4 10456 B9R1.11 NCC(O)C1CCCC1 Amb18959867 [0,1,0,1,0,0|2,0,0]=4 10457 B9R1.11 NCC(O)C1CCCC1 Amb19515470 [0,1,0,1,0,0|2,0,0]=4 10458 B9R1.11 NCC(O)C1CCCO1 Amb25662050 [0,1,0,1,0,0|2,0,0]=4 10459 B9R1.11 NC[C@@H](O)[C@@H]1CCCO1 Amb24515599 [0,1,0,1,0,0|2,0,0]=4 10460 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [0,1,0,1,0,0|1,0,0]=3 10461 B9R1.11 N[C@@H](CO)[C@@H]1CCCO1 Amb25360168 [0,1,0,1,0,0|2,0,0]=4 10462 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [0,1,0,1,0,0|1,0,0]=3 10463 B9R1.11 N[C@H](CO)[C@@H]1CCCO1 Amb24515629 [0,1,0,1,0,0|2,0,0]=4 10464 B9R1.11 OC(CCl)C1CCCO1 Amb25118314 [0,1,0,1,0,0|2,0,0]=4 10465 B9R1.11 OC(CO)C1CCCN1 Amb24652702 [0,1,0,1,0,0|2,0,0]=4 10466 B9R1.11 OC(CO)C1CNCC1 Amb25305634 [0,1,0,1,0,0|2,0,0]=4 10467 B9R1.11 OC(CO)C1COCC1 Amb24379358 [0,1,0,1,0,0|2,0,0]=4 10468 B9R1.11 OCC(C1OCCO1)Cl Amb17593816 [0,1,0,1,0,0|1,0,0]=3 10469 B9R1.11 OCC(C1OCCO1)O Amb17593408 [0,1,0,1,0,0|1,0,0]=3 10470 B9R1.11 OCC(F)C1CCCC1 Amb25239531 [0,1,0,1,0,0|1,0,0]=3 10471 B9R1.11 O[C@@H](CBr)C1CCCC1 Amb25269300 [0,1,0,1,0,0|2,0,0]=4 10472 B9R1.11 O[C@@H](CBr)C1CCCO1 Amb24610551 [0,1,0,1,0,0|2,0,0]=4 10473 B9R1.11 O[C@H](CBr)C1CCCO1 Amb24664841 [0,1,0,1,0,0|2,0,0]=4 10474 B9R1.11 O[C@H](CCl)C1CCCO1 Amb24559622 [0,1,0,1,0,0|2,0,0]=4 10475 B9R1.21 CCC1CC(CCl)CC1 Amb24479913 [0,1,0,1,0,0|2,0,0]=4 10476 B9R1.21 CCC1CC(CN1)CC Amb24619413 [0,1,0,1,0,0|2,0,0]=4 10477 B9R1.21 CCC1CCC(CBr)O1 Amb24427433 [0,1,0,1,0,0|2,0,0]=4 10478 B9R1.21 CCC1CCC(CC)O1 Amb17672310 [0,1,0,1,0,0|2,0,0]=4 10479 B9R1.21 CCC1CCC(CCl)O1 Amb24566214 [0,1,0,1,0,0|2,0,0]=4 10480 B9R1.21 CCC1CCC(CI)O1 Amb25292814 [0,1,0,1,0,0|2,0,0]=4 10481 B9R1.21 CCC1CCC(CO)N1 Amb24404906 [0,1,0,1,0,0|1,0,0]=3 10482 B9R1.21 CCC1CCC(CO)O1 Amb25852850 [0,1,0,1,0,0|1,0,0]=3 10483 B9R1.21 CCC1COB(CC)O1 Amb25188922 [0,1,0,1,0,0|2,0,0]=4 10484 B9R1.21 CCC1COC(CBr)O1 Amb25797963 [0,1,0,1,0,0|1,0,0]=3 10485 B9R1.21 CCC1CSC(CC)N1 Amb24478763 [0,1,0,1,0,0|1,1,0]=4 10486 B9R1.21 CCC1OCC(CCl)O1 Amb25141024 [0,1,0,1,0,0|2,0,0]=4 10487 B9R1.21 CCC1OCC(CN)O1 Amb25319425 [0,1,0,1,0,0|2,0,0]=4 10488 B9R1.21 CCC=1C[C@@H](CO)OC1 Amb25284402 [0,1,0,1,0,0|0,0,2]=4 10489 B9R1.21 CCC=1C[C@@H](CO)ON1 Amb25069707 [0,1,0,1,0,0|1,0,1]=4 10490 B9R1.21 CCN1C[C@H](CO)CC1 Amb24387825 [0,1,0,1,0,0|2,0,0]=4 10491 B9R1.21 CC[C@@H]1CC[C@H](CC)N1 Amb25269475 [0,1,0,1,0,0|2,0,0]=4 10492 B9R1.21 CC[C@@H]1C[C@H](CO)CC1 Amb25205088 [0,1,0,1,0,0|1,0,0]=3 10493 B9R1.21 CC[C@@H]1N[C@H](CO)CS1 Amb24581674 [0,1,0,1,0,0|2,0,0]=4 10494 B9R1.21 CC[C@@H]1OC[C@H](CCl)O1 Amb25326770 [0,1,0,1,0,0|2,0,0]=4 10495 B9R1.21 CC[C@H]1CC[C@@H](CO)N1 Amb24591178 [0,1,0,1,0,0|1,0,0]=3 10496 B9R1.21 CC[C@H]1CC[C@H](CC)N1 Amb24517035 [0,1,0,1,0,0|2,0,0]=4 10497 B9R1.21 CC[C@H]1COC(CCl)=N1 Amb24738239 [0,1,0,1,0,0|1,0,1]=4 10498 B9R1.21 CC[C@H]1C[C@@H](CO)NC1 Amb24547528 [0,1,0,1,0,0|1,0,0]=3 10499 B9R1.21 CC[C@H]1C[C@H](CO)CC1 Amb24719755 [0,1,0,1,0,0|1,0,0]=3 10500 B9R1.21 CC[C@H]1OC[C@@H](CCl)O1 Amb24617266 [0,1,0,1,0,0|2,0,0]=4 10501 B9R1.21 CC[C@H]1OC[C@H](CCl)O1 Amb24515091 [0,1,0,1,0,0|2,0,0]=4 10502 B9R1.21 CNC1CCC(CO)C1 Amb18642728 [0,1,0,1,0,0|2,0,0]=4 10503 B9R1.21 CNC1CNC(C1)CO Amb24433815 [0,1,0,1,0,0|2,0,0]=4 10504 B9R1.21 CN[C@@H]1CC[C@H](CO)C1 Amb24599213 [0,1,0,1,0,0|2,0,0]=4 10505 B9R1.21 CN[C@@H]1CN[C@@H](C1)CO Amb24551897 [0,1,0,1,0,0|2,0,0]=4 10506 B9R1.21 CO[C@@H]1CC[C@@H](CO)O1 Amb24744712 [0,1,0,1,0,0|2,0,0]=4 10507 B9R1.21 CSC1CNC(CO)C1 Amb25172160 [0,1,0,1,0,0|2,0,0]=4 10508 B9R1.21 ClCC1COC(CBr)O1 Amb24350522 [0,1,0,1,0,0|2,0,0]=4 10509 B9R1.21 ClCC1COC(CCl)O1 Amb24480091 [0,1,0,1,0,0|2,0,0]=4 10510 B9R1.21 NC[C@H]1CC[C@@H](CO)O1 Amb25367672 [0,1,0,1,0,0|2,0,0]=4 10511 B9R1.21 NC[C@H]1CC[C@H](CO)O1 Amb24746153 [0,1,0,1,0,0|2,0,0]=4 10512 B9R1.21 OCC1CCC(CF)N1 Amb24417543 [0,1,0,1,0,0|2,0,0]=4 10513 B9R1.21 OCC1CCC(CO)N1 Amb22728597 [0,1,0,1,0,0|2,0,0]=4 10514 B9R1.21 OCC1CCC(O1)CO Amb15691966 [0,1,0,1,0,0|2,0,0]=4 10515 B9R1.21 OCC1COC(CBr)O1 Amb25708362 [0,1,0,1,0,0|2,0,0]=4 10516 B9R1.21 OCC1COC(CI)O1 Amb25684134 [0,1,0,1,0,0|2,0,0]=4 10517 B9R1.21 OCC1COC(O1)CCl Amb17593813 [0,1,0,1,0,0|2,0,0]=4 10518 B9R1.21 OC[C@@H]1CC[C@@H](CO)N1 Amb24375528 [0,1,0,1,0,0|2,0,0]=4 10519 B9R1.21 OC[C@@H]1CC[C@H](CO)N1 Amb24117031 [0,1,0,1,0,0|2,0,0]=4 10520 B9R1.21 OC[C@H]1CC[C@H](CO)N1 Amb24539840 [0,1,0,1,0,0|2,0,0]=4 10521 B9R1.21 OC[C@H]1CC[C@H](CO)O1 Amb24613888 [0,1,0,1,0,0|2,0,0]=4 10522 B9R1.21 OC[C@H]1CO[C@@H](CCl)O1 Amb24574753 [0,1,0,1,0,0|2,0,0]=4 10523 B9R1.21 OC[C@H]1CO[C@H](CBr)O1 Amb25246565 [0,1,0,1,0,0|2,0,0]=4 10524 B9R1.21 OC[C@H]1CS[C@@H](CO)O1 Amb24576664 [0,1,0,1,0,0|1,1,0]=4 10525 B9R1.21 OC[C@H]1C[C@H](CC1)CO Amb25847797 [0,1,0,1,0,0|2,0,0]=4 10526 B9R1.60 CCCC1CC1(C)CO Amb24541566 [0,1,0,1,0,0|1,0,0]=3 10527 B9R1.60 CCCC1CC1(O)CN Amb24367560 [0,1,0,1,0,0|2,0,0]=4 10528 B9R1.60 CCCC1OC1(C)CN Amb24677863 [0,1,0,1,0,0|1,0,0]=3 10529 B9R1.60 CCCC1OC1(C)CO Amb25760352 [0,1,0,1,0,0|0,0,0]=2 10530 B9R1.60 CCC[C@H]1O[C@@]1(C)CO Amb25296427 [0,1,0,1,0,0|0,0,0]=2 10531 B9R1.60 CCOC1CC1(C)CO Amb25837899 [0,1,0,1,0,0|2,0,0]=4 10532 B9R1.76 CC1C(OCCCl)C1C Amb24673007 [0,1,0,1,0,0|1,0,0]=3 10533 B9R1.76 C[C@@H]1C(OCCCl)[C@@H]1C Amb25757905 [0,1,0,1,0,0|1,0,0]=3 10534 B9R1.76 C[C@@H]1[C@@H](OCCCl)[C@@H]1C Amb25791612 [0,1,0,1,0,0|1,0,0]=3 10535 B9R1.78 CC(CC)OC1CC1Cl Amb25249181 [0,1,0,1,0,0|2,0,0]=4 10536 B9R1.78 CC(CC)O[C@@H]1C[C@@H]1Cl Amb24697769 [0,1,0,1,0,0|2,0,0]=4 10537 B9R1.78 CC(CC)O[C@@H]1C[C@H]1Cl Amb24699865 [0,1,0,1,0,0|2,0,0]=4 10538 B9R1.78 CC(CN)NC1CC1C Amb24383827 [0,1,0,1,0,0|2,0,0]=4 10539 B9R1.78 CC1CC1CC(=C)CO Amb25333398 [0,1,0,1,0,0|1,0,1]=4 10540 B9R1.78 CC1CC1NC(=O)CO Amb24375769 [0,1,0,1,0,0|1,0,1]=4 10541 B9R1.78 CCC(C)N[C@@H]1C[C@H]1C Amb24561947 [0,1,0,1,0,0|2,0,0]=4 10542 B9R1.79 CC(CC)NC1CCC1 Amb18989302 [0,1,0,1,0,0|2,0,0]=4 10543 B9R1.79 CC(CC1CCC1)CCl Amb25235179 [0,1,0,1,0,0|2,0,0]=4 10544 B9R1.79 CC(CC1CCC1)CO Amb24402725 [0,1,0,1,0,0|1,0,0]=3 10545 B9R1.79 CC(CN)OC1CCC1 Amb18298662 [0,1,0,1,0,0|1,0,0]=3 10546 B9R1.79 CC(CN)OC1COC1 Amb25040953 [0,1,0,1,0,0|2,0,0]=4 10547 B9R1.79 CC(CO)NC1CCC1 Amb18982439 [0,1,0,1,0,0|1,0,0]=3 10548 B9R1.79 CC(CO)SC1CNC1 Amb25731393 [0,1,0,1,0,0|1,1,0]=4 10549 B9R1.79 CCC(=O)OC1CCC1 Amb25851974 [0,1,0,1,0,0|1,0,1]=4 10550 B9R1.79 CCC(Cl)CC1CCC1 Amb25296615 [0,1,0,1,0,0|2,0,0]=4 10551 B9R1.79 CCC(N)CC1CCC1 Amb24417311 [0,1,0,1,0,0|2,0,0]=4 10552 B9R1.79 CCC(O)CC1CCC1 Amb24479921 [0,1,0,1,0,0|2,0,0]=4 10553 B9R1.79 CC[C@@H](N)CC1CCC1 Amb24759465 [0,1,0,1,0,0|2,0,0]=4 10554 B9R1.79 CC[C@@H](O)CC1CCC1 Amb24700781 [0,1,0,1,0,0|2,0,0]=4 10555 B9R1.79 CC[C@@H](O)CN1CCC1 Amb25306114 [0,1,0,1,0,0|2,0,0]=4 10556 B9R1.79 CC[C@H](O)CC1CCC1 Amb24481965 [0,1,0,1,0,0|2,0,0]=4 10557 B9R1.79 CC[C@H](O)CN1CCC1 Amb24732968 [0,1,0,1,0,0|2,0,0]=4 10558 B9R1.79 NC(CC1CCC1)CF Amb25248771 [0,1,0,1,0,0|2,0,0]=4 10559 B9R1.79 NC(CC1CCC1)CO Amb24601442 [0,1,0,1,0,0|1,0,0]=3 10560 B9R1.79 NC(CC1COC1)CO Amb25180508 [0,1,0,1,0,0|2,0,0]=4 10561 B9R1.79 NCC(=O)OC1CCC1 Amb18295938 [0,1,0,1,0,0|1,0,1]=4 10562 B9R1.79 NCC(F)CC1CCC1 Amb24566684 [0,1,0,1,0,0|2,0,0]=4 10563 B9R1.79 OC(CC1CCC1)CCl Amb24374081 [0,1,0,1,0,0|2,0,0]=4 10564 B9R1.79 OCC(=O)OC1CCC1 Amb25802506 [0,1,0,1,0,0|0,0,1]=3 10565 B9R1.79 OCC(=O)OC1COC1 Amb24683681 [0,1,0,1,0,0|1,0,1]=4 10566 B9R1.79 OCC(F)CC1CCC1 Amb24518712 [0,1,0,1,0,0|1,0,0]=3 10567 B9R1.79 OCC(O)CN1CCC1 Amb24524207 [0,1,0,1,0,0|2,0,0]=4 10568 B9R1.80 CC(CBr)NCC1CC1 Amb24660489 [0,1,0,1,0,0|2,0,0]=4 10569 B9R1.80 CC(CC)OCC1CO1 Amb25844344 [0,1,0,1,0,0|2,0,0]=4 10570 B9R1.80 CC(CC)OC[C@@H]1CO1 Amb25851839 [0,1,0,1,0,0|2,0,0]=4 10571 B9R1.80 CC(CC)SCC1CC1 Amb25315089 [0,1,0,1,0,0|1,1,0]=4 10572 B9R1.80 CC(CCC1CO1)CC Amb24595175 [0,1,0,1,0,0|1,0,0]=3 10573 B9R1.80 CC(CCl)NCC1CC1 Amb25838286 [0,1,0,1,0,0|2,0,0]=4 10574 B9R1.80 CC(CN)CCC1CC1 Amb24481956 [0,1,0,1,0,0|2,0,0]=4 10575 B9R1.80 CC(CN)OCC1CC1 Amb18310563 [0,1,0,1,0,0|1,0,0]=3 10576 B9R1.80 CC(CN)SCC1CC1 Amb25783653 [0,1,0,1,0,0|1,1,0]=4 10577 B9R1.80 CC(CO)=CCC1CC1 Amb25032203 [0,1,0,1,0,0|1,0,1]=4 10578 B9R1.80 CC(CO)SCC1CC1 Amb24454820 [0,1,0,1,0,0|0,1,0]=3 10579 B9R1.80 CCC(N)CNC1CC1 Amb18303276 [0,1,0,1,0,0|2,0,0]=4 10580 B9R1.80 CCC(N)CSC1CC1 Amb25800592 [0,1,0,1,0,0|1,1,0]=4 10581 B9R1.80 CCC(O)CCC1CC1 Amb25845587 [0,1,0,1,0,0|2,0,0]=4 10582 B9R1.80 CCC(O)CNC1CC1 Amb18304015 [0,1,0,1,0,0|2,0,0]=4 10583 B9R1.80 CCN(C)CCC1CO1 Amb25822190 [0,1,0,1,0,0|2,0,0]=4 10584 B9R1.80 CC[C@@H](O)CNC1CC1 Amb25781964 [0,1,0,1,0,0|2,0,0]=4 10585 B9R1.80 CC[C@H](N)CNC1CC1 Amb24570089 [0,1,0,1,0,0|2,0,0]=4 10586 B9R1.80 CC[C@H](O)CNC1CC1 Amb25856291 [0,1,0,1,0,0|2,0,0]=4 10587 B9R1.80 C[C@@H](CN)NCC1CC1 Amb24481771 [0,1,0,1,0,0|2,0,0]=4 10588 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|1,0,0]=3 10589 B9R1.80 NCC(=O)OCC1CC1 Amb13952550 [0,1,0,1,0,0|1,0,1]=4 10590 B9R1.80 NCC(=O)OCC1CC1 Amb18305119 [0,1,0,1,0,0|1,0,1]=4 10591 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|2,0,0]=4 10592 B9R1.80 O=C(CBr)OCC1CC1 Amb24392877 [0,1,0,1,0,0|1,0,1]=4 10593 B9R1.80 OC(CCl)CCC1CC1 Amb24398131 [0,1,0,1,0,0|2,0,0]=4 10594 B9R1.80 O[C@@H](CNC1CC1)CO Amb24332901 [0,1,0,1,0,0|2,0,0]=4 10595 B9R1.81 CC(CC)C1CCC1N Amb24349564 [0,1,0,1,0,0|2,0,0]=4 10596 B9R1.81 CC1CCC1C(N)CC Amb24677158 [0,1,0,1,0,0|2,0,0]=4 10597 B9R1.81 OCC(O)C1NCC1O Amb25102544 [0,1,0,1,0,0|2,0,0]=4 10598 B9R1.81 OC[C@H](O)[C@@H]1NC[C@@H]1O Amb24573509 [0,1,0,1,0,0|2,0,0]=4 10599 B9R1.88 CC(CC)C1OC1CO Amb25699932 [0,1,0,1,0,0|0,0,0]=2 10600 B9R1.88 CC(CN)C1CC1CC Amb25365311 [0,1,0,1,0,0|2,0,0]=4 10601 B9R1.88 CC(CO)C1OC1CC Amb25856418 [0,1,0,1,0,0|2,0,0]=4 10602 B9R1.88 CCC(=O)[C@@H]1O[C@H]1CC Amb24534297 [0,1,0,1,0,0|1,0,1]=4 10603 B9R1.88 CC[C@@H](O)[C@@H]1O[C@H]1CC Amb25236199 [0,1,0,1,0,0|1,0,0]=3 10604 B9R1.88 COC(=O)[C@@H]1O[C@H]1CO Amb24107515 [0,1,0,1,0,0|1,0,1]=4 10605 B9R1.88 C[C@@H](C=C)[C@H]1O[C@@H]1CO Amb25176661 [0,1,0,1,0,0|0,0,2]=4 10606 B9R1.88 C[C@@H](CC)C1OC1CO Amb24384312 [0,1,0,1,0,0|0,0,0]=2 10607 B9R1.88 C[C@@H](CC)[C@@H]1O[C@H]1CO Amb24616273 [0,1,0,1,0,0|0,0,0]=2 10608 B9R1.88 C[C@@H](CO)[C@@H]1O[C@@H]1CC Amb25175446 [0,1,0,1,0,0|2,0,0]=4 10609 B9R1.88 C[C@H](C=C)[C@@H]1O[C@H]1CO Amb24622713 [0,1,0,1,0,0|0,0,2]=4 10610 B9R1.88 C[C@H](CO)[C@H]1O[C@H]1CC Amb24632278 [0,1,0,1,0,0|2,0,0]=4 10611 B9R1.97 CC1(CNC1CC)CC Amb24583975 [0,1,0,1,0,0|2,0,0]=4 10612 B9R1.97 CC[C@@H]1CC[C@@]1(C)CO Amb24620945 [0,1,0,1,0,0|1,0,0]=3 10613 B9R1.97 CC[C@H]1CC[C@@]1(C)CO Amb24719553 [0,1,0,1,0,0|1,0,0]=3 10614 B9R1.99 CC1(CC1)NCCCO Amb24481742 [0,1,0,1,0,0|2,0,0]=4 10615 B9R1.99 CC1(CCCCBr)CO1 Amb24355378 [0,1,0,1,0,0|2,0,0]=4 10616 B9R1.99 CC1(CNCCN)CC1 Amb24706050 [0,1,0,1,0,0|2,0,0]=4 10617 B9R1.99 CC1(CNCCO)CC1 Amb25686464 [0,1,0,1,0,0|1,0,0]=3 10618 B9R1.99 CCCCCC1(N)CC1 Amb24623686 [0,1,0,1,0,0|2,0,0]=4 10619 B9R1.99 CCCCC[C@]1(C)CO1 Amb25339190 [0,1,0,1,0,0|1,0,0]=3 10620 B9R1.99 CCCOCC1(C)CO1 Amb24478795 [0,1,0,1,0,0|2,0,0]=4 10621 B9R1.99 C[C@@]1(CCCCBr)CO1 Amb25185367 [0,1,0,1,0,0|2,0,0]=4 10622 B9R1.99 C[C@]1(CCCCBr)CO1 Amb25275973 [0,1,0,1,0,0|2,0,0]=4 10623 B9R1.99 FCCNCC1(F)CC1 Amb25852526 [0,1,0,1,0,0|2,0,0]=4 10624 B9R1.99 NC1(CCCCS)CC1 Amb25223526 [0,1,0,1,0,0|1,1,0]=4 10625 B9R1.99 NC1(CNCCF)CC1 Amb24333169 [0,1,0,1,0,0|2,0,0]=4 10626 B9R1.99 OCCCCC1(O)CC1 Amb25829959 [0,1,0,1,0,0|1,0,0]=3 10627 B9R1.99 OCCNCC1(F)CC1 Amb25187748 [0,1,0,1,0,0|1,0,0]=3 10628 B9R1.118 CC1(CBr)CCCCO1 Amb25031393 [0,1,0,1,0,0|1,0,0]=3 10629 B9R1.118 CC1(CBr)COCCC1 Amb25851591 [0,1,0,1,0,0|2,0,0]=4 10630 B9R1.118 CC1(CBr)OCCCO1 Amb25211292 [0,1,0,1,0,0|2,0,0]=4 10631 B9R1.118 CC1(CC)CNCCO1 Amb13953189 [0,1,0,1,0,0|1,0,0]=3 10632 B9R1.118 CC1(CCCCO1)C#N Amb24700167 [0,1,0,1,0,0|1,0,1]=4 10633 B9R1.118 CC1(CCCCO1)C=O Amb24627620 [0,1,0,1,0,0|0,0,2]=4 10634 B9R1.118 CC1(CN)CCCCC1 Amb20632204 [0,1,0,1,0,0|2,0,0]=4 10635 B9R1.118 CC1(CN)CCCCS1 Amb25232219 [0,1,0,1,0,0|1,1,0]=4 10636 B9R1.118 CC1(CN)CCOCO1 Amb24467406 [0,1,0,1,0,0|2,0,0]=4 10637 B9R1.118 CC1(CN)COCCC1 Amb18949053 [0,1,0,1,0,0|2,0,0]=4 10638 B9R1.118 CC1(CN)COCCO1 Amb25174403 [0,1,0,1,0,0|1,0,0]=3 10639 B9R1.118 CC1(CO)CC=CCO1 Amb24661081 [0,1,0,1,0,0|0,0,2]=4 10640 B9R1.118 CC1(CO)CCC=CO1 Amb25226631 [0,1,0,1,0,0|0,0,2]=4 10641 B9R1.118 CC1(CO)CCCCN1 Amb19516855 [0,1,0,1,0,0|1,0,0]=3 10642 B9R1.118 CC1(CO)CCCCN1 Amb22587374 [0,1,0,1,0,0|1,0,0]=3 10643 B9R1.118 CC1(CO)CCCCO1 Amb24353049 [0,1,0,1,0,0|0,0,0]=2 10644 B9R1.118 CC1(CO)CCNCC1 Amb22234242 [0,1,0,1,0,0|2,0,0]=4 10645 B9R1.118 CC1(CO)CCOCC1 Amb22749322 [0,1,0,1,0,0|2,0,0]=4 10646 B9R1.118 CC1(CO)CNCCC1 Amb22406108 [0,1,0,1,0,0|2,0,0]=4 10647 B9R1.118 CC1(CO)COCCC1 Amb25325793 [0,1,0,1,0,0|2,0,0]=4 10648 B9R1.118 CC1(CO)COCCN1 Amb25836752 [0,1,0,1,0,0|2,0,0]=4 10649 B9R1.118 CC1(CO)CSCCN1 Amb24677568 [0,1,0,1,0,0|2,0,0]=4 10650 B9R1.118 CC1(CS)CCCCC1 Amb24572456 [0,1,0,1,0,0|1,1,0]=4 10651 B9R1.118 CCC1(C)CCCCC1 Amb22227942 [0,1,0,1,0,0|2,0,0]=4 10652 B9R1.118 CCC1(C)CCCNC1 Amb17622028 [0,1,0,1,0,0|2,0,0]=4 10653 B9R1.118 CCC1(C)CNCCC1 Amb22587423 [0,1,0,1,0,0|2,0,0]=4 10654 B9R1.118 CCC1(C)CNCCN1 Amb25147195 [0,1,0,1,0,0|2,0,0]=4 10655 B9R1.118 CCC1(C)NCCCO1 Amb24391322 [0,1,0,1,0,0|2,0,0]=4 10656 B9R1.118 CCC1(N)COCCC1 Amb24524297 [0,1,0,1,0,0|1,0,0]=3 10657 B9R1.118 CCC1(N)COCOC1 Amb25064317 [0,1,0,1,0,0|2,0,0]=4 10658 B9R1.118 CCC1(O)CCCCC1 Amb1019962 [0,1,0,1,0,0|2,0,0]=4 10659 B9R1.118 CCC1(O)CCCNC1 Amb10607740 [0,1,0,1,0,0|2,0,0]=4 10660 B9R1.118 CCC1(O)CNCCC1 Amb22491665 [0,1,0,1,0,0|2,0,0]=4 10661 B9R1.118 CC[C@@]1(C)CNCCC1 Amb22757832 [0,1,0,1,0,0|2,0,0]=4 10662 B9R1.118 CC[C@@]1(C)NCCCO1 Amb24744545 [0,1,0,1,0,0|2,0,0]=4 10663 B9R1.118 C[C@@]1(CN)CCCCN1 Amb24476618 [0,1,0,1,0,0|2,0,0]=4 10664 B9R1.118 C[C@]1(CO)C=CCCO1 Amb24587977 [0,1,0,1,0,0|0,0,2]=4 10665 B9R1.118 C[C@]1(CO)CCCC=C1 Amb25806757 [0,1,0,1,0,0|1,0,1]=4 10666 B9R1.118 C[C@]1(CO)CCCCN1 Amb24417675 [0,1,0,1,0,0|1,0,0]=3 10667 B9R1.118 ClC1(CBr)CCCCC1 Amb24525178 [0,1,0,1,0,0|2,0,0]=4 10668 B9R1.118 ClCC1(Br)CCCCC1 Amb24631169 [0,1,0,1,0,0|2,0,0]=4 10669 B9R1.118 FC1(CCl)CCCCC1 Amb24751621 [0,1,0,1,0,0|2,0,0]=4 10670 B9R1.118 NC1(CO)CCNCC1 Amb18944649 [0,1,0,1,0,0|2,0,0]=4 10671 B9R1.118 NC1(CO)CCNCC1 Amb20623937 [0,1,0,1,0,0|2,0,0]=4 10672 B9R1.118 NC1(CO)CCOCC1 Amb23440142 [0,1,0,1,0,0|2,0,0]=4 10673 B9R1.118 NC1(CO)COCCC1 Amb24476680 [0,1,0,1,0,0|2,0,0]=4 10674 B9R1.118 NC1(CO)CSCCC1 Amb18523729 [0,1,0,1,0,0|2,0,0]=4 10675 B9R1.118 NCC1(C)OCCCO1 Amb17226712 [0,1,0,1,0,0|2,0,0]=4 10676 B9R1.118 NCC1(F)CCCCC1 Amb22174148 [0,1,0,1,0,0|2,0,0]=4 10677 B9R1.118 NCC1(F)CCCCC1 Amb22887010 [0,1,0,1,0,0|2,0,0]=4 10678 B9R1.118 NCC1(F)COCCC1 Amb25195545 [0,1,0,1,0,0|2,0,0]=4 10679 B9R1.118 NCC1(N)CCCCC1 Amb2371826 [0,1,0,1,0,0|2,0,0]=4 10680 B9R1.118 NCC1(O)CCCCC1 Amb1108364 [0,1,0,1,0,0|2,0,0]=4 10681 B9R1.118 NCC1(O)COCCC1 Amb25070087 [0,1,0,1,0,0|2,0,0]=4 10682 B9R1.118 OC1(CBr)CCCCC1 Amb23597825 [0,1,0,1,0,0|2,0,0]=4 10683 B9R1.118 OC1(CCl)CCCCC1 Amb25348439 [0,1,0,1,0,0|2,0,0]=4 10684 B9R1.118 OCC1(C)CCCNC1 Amb10607790 [0,1,0,1,0,0|2,0,0]=4 10685 B9R1.118 OCC1(Cl)CCNCC1 Amb25243172 [0,1,0,1,0,0|2,0,0]=4 10686 B9R1.118 OCC1(F)CCCCC1 Amb10603424 [0,1,0,1,0,0|1,0,0]=3 10687 B9R1.118 OCC1(F)CCNCC1 Amb22001985 [0,1,0,1,0,0|2,0,0]=4 10688 B9R1.118 OCC1(F)CCNCC1 Amb22234785 [0,1,0,1,0,0|2,0,0]=4 10689 B9R1.118 OCC1(F)CCOCC1 Amb22500945 [0,1,0,1,0,0|2,0,0]=4 10690 B9R1.118 OCC1(F)CSCCC1 Amb24656245 [0,1,0,1,0,0|2,0,0]=4 10691 B9R1.118 OCC1(N)CCCCC1 Amb10608249 [0,1,0,1,0,0|1,0,0]=3 10692 B9R1.118 OCC1(O)CCCCC1 Amb10552888 [0,1,0,1,0,0|1,0,0]=3 10693 B9R1.118 OCC1(O)CCNCC1 Amb15701357 [0,1,0,1,0,0|2,0,0]=4 10694 B9R1.118 OCC1(O)CCNCC1 Amb22405951 [0,1,0,1,0,0|2,0,0]=4 10695 B9R1.118 OCC1(O)CCOCC1 Amb24116825 [0,1,0,1,0,0|2,0,0]=4 10696 B9R1.118 OCC1(O)CCSCC1 Amb24116829 [0,1,0,1,0,0|2,0,0]=4 10697 B9R1.118 OCC1(O)CNCCC1 Amb19516807 [0,1,0,1,0,0|2,0,0]=4 10698 B9R1.118 OCC1(O)CNCCC1 Amb22406180 [0,1,0,1,0,0|2,0,0]=4 10699 B9R1.118 OCC1(O)CSCCC1 Amb25373567 [0,1,0,1,0,0|2,0,0]=4 10700 B9R1.118 OCC1(S)CCCCC1 Amb25084707 [0,1,0,1,0,0|1,0,0]=3 10701 B9R1.118 OC[C@@]1(F)CNCCC1 Amb24732070 [0,1,0,1,0,0|2,0,0]=4 10702 B9R1.132 C=C1[C@@H](CO)OC[C@@H]1O Amb24759060 [0,1,0,1,0,0|0,0,2]=4 10703 B9R1.132 C=C1[C@H](CO)OC[C@H]1O Amb24619198 [0,1,0,1,0,0|0,0,2]=4 10704 B9R1.132 CC1C(Br)CCC1CC Amb25141703 [0,1,0,1,0,0|2,0,0]=4 10705 B9R1.132 CC1C(CN)COC1C Amb24659793 [0,1,0,1,0,0|2,0,0]=4 10706 B9R1.132 CC1C(CO)ON=C1C Amb24687310 [0,1,0,1,0,0|1,0,1]=4 10707 B9R1.132 CC1C(O)CCC1CC Amb25682024 [0,1,0,1,0,0|2,0,0]=4 10708 B9R1.132 CC1C(O)CCC1CN Amb25258217 [0,1,0,1,0,0|2,0,0]=4 10709 B9R1.132 CC1CCC(CC)C1O Amb25306537 [0,1,0,1,0,0|1,0,0]=3 10710 B9R1.132 CC1CCC(OC)C1O Amb24608064 [0,1,0,1,0,0|2,0,0]=4 10711 B9R1.132 CC1CNC(CO)C1O Amb24524190 [0,1,0,1,0,0|2,0,0]=4 10712 B9R1.132 CCC1CCC(O)C1O Amb25780900 [0,1,0,1,0,0|1,0,0]=3 10713 B9R1.132 CCC1NCC(O)C1O Amb25269346 [0,1,0,1,0,0|2,0,0]=4 10714 B9R1.132 CC[C@@H]1NC[C@@H](O)[C@@H]1O Amb25203762 [0,1,0,1,0,0|2,0,0]=4 10715 B9R1.132 CC[C@H]1NC[C@H](O)[C@H]1O Amb24617458 [0,1,0,1,0,0|2,0,0]=4 10716 B9R1.132 CO[C@@H]1COC(=O)[C@@H]1O Amb24733177 [0,1,0,1,0,0|1,0,1]=4 10717 B9R1.132 CO[C@H]1CC[C@H](O)[C@H]1O Amb24612170 [0,1,0,1,0,0|2,0,0]=4 10718 B9R1.132 C[C@@H]1CC[C@@H](CO)N1C Amb25226239 [0,1,0,1,0,0|2,0,0]=4 10719 B9R1.132 C[C@@H]1CC[C@H](CO)[C@@H]1C Amb25357317 [0,1,0,1,0,0|1,0,0]=3 10720 B9R1.132 C[C@@H]1[C@@H](CO)NCC1=O Amb25180835 [0,1,0,1,0,0|1,0,1]=4 10721 B9R1.132 C[C@H]1CC[C@H](CO)N1C Amb24520238 [0,1,0,1,0,0|2,0,0]=4 10722 B9R1.132 C[C@H]1CN[C@H](CO)[C@H]1O Amb24617977 [0,1,0,1,0,0|2,0,0]=4 10723 B9R1.132 C[C@H]1CO[C@H](CO)[C@@H]1O Amb24520314 [0,1,0,1,0,0|1,0,0]=3 10724 B9R1.132 C[C@H]1OC[C@H](C=C)[C@@H]1O Amb24520128 [0,1,0,1,0,0|0,0,2]=4 10725 B9R1.132 C[C@H]1[C@@H](CCC1=O)CO Amb24582507 [0,1,0,1,0,0|1,0,1]=4 10726 B9R1.132 C[C@H]1[C@@H](CCC1O)CO Amb25176819 [0,1,0,1,0,0|1,0,0]=3 10727 B9R1.132 NC1C(CO)NCC1O Amb25258864 [0,1,0,1,0,0|2,0,0]=4 10728 B9R1.132 NC1COC(CO)C1O Amb25275287 [0,1,0,1,0,0|1,0,0]=3 10729 B9R1.132 NC[C@H]1OC[C@H](O)[C@@H]1O Amb24670332 [0,1,0,1,0,0|2,0,0]=4 10730 B9R1.132 NC[C@H]1OC[C@H](O)[C@H]1O Amb25378767 [0,1,0,1,0,0|2,0,0]=4 10731 B9R1.132 N[C@@H]1CN[C@H](CO)[C@H]1O Amb24515541 [0,1,0,1,0,0|2,0,0]=4 10732 B9R1.132 N[C@@H]1[C@@H](CO)NC[C@H]1O Amb24671216 [0,1,0,1,0,0|2,0,0]=4 10733 B9R1.132 N[C@H]1[C@@H](CO)NC[C@@H]1O Amb25745255 [0,1,0,1,0,0|2,0,0]=4 10734 B9R1.132 OC1C(CF)OCC1O Amb24583688 [0,1,0,1,0,0|2,0,0]=4 10735 B9R1.132 OC1C(F)CNC1CO Amb24753826 [0,1,0,1,0,0|2,0,0]=4 10736 B9R1.132 OCC1NCC(O)C1O Amb25348005 [0,1,0,1,0,0|2,0,0]=4 10737 B9R1.132 OCC1NCC(O)[C@H]1O Amb24694168 [0,1,0,1,0,0|2,0,0]=4 10738 B9R1.132 OCC1OC[C@@H](O)[C@H]1O Amb24688231 [0,1,0,1,0,0|1,0,0]=3 10739 B9R1.132 OC[C@@H]1NC[C@@H](O)[C@H]1O Amb23541061 [0,1,0,1,0,0|2,0,0]=4 10740 B9R1.132 OC[C@@H]1NC[C@H](O)[C@@H]1O Amb24118007 [0,1,0,1,0,0|2,0,0]=4 10741 B9R1.132 OC[C@@H]1NC[C@H](O)[C@H]1O Amb22799417 [0,1,0,1,0,0|2,0,0]=4 10742 B9R1.132 OC[C@@H]1OC[C@@H](O)[C@@H]1O Amb22747091 [0,1,0,1,0,0|1,0,0]=3 10743 B9R1.132 OC[C@@H]1OC[C@H](O)[C@H]1O Amb24587006 [0,1,0,1,0,0|1,0,0]=3 10744 B9R1.132 OC[C@H]1NCC(O)C1O Amb25294362 [0,1,0,1,0,0|2,0,0]=4 10745 B9R1.132 OC[C@H]1NCC(O)[C@H]1O Amb25294352 [0,1,0,1,0,0|2,0,0]=4 10746 B9R1.132 OC[C@H]1NC[C@@H](O)[C@@H]1O Amb25231751 [0,1,0,1,0,0|2,0,0]=4 10747 B9R1.132 OC[C@H]1OC[C@H](O)[C@@H]1O Amb22233163 [0,1,0,1,0,0|1,0,0]=3 10748 B9R1.132 OC[C@H]1OC[C@H](O)[C@H]1O Amb24572863 [0,1,0,1,0,0|1,0,0]=3 10749 B9R1.132 OC[C@H]1SCC(O)C1O Amb25346221 [0,1,0,1,0,0|1,1,0]=4 10750 B9R1.132 OC[C@H]1SC[C@@H](O)[C@@H]1O Amb24563495 [0,1,0,1,0,0|1,1,0]=4 10751 B9R1.132 OC[C@H]1SC[C@@H](O)[C@H]1O Amb24576957 [0,1,0,1,0,0|1,1,0]=4 10752 B9R1.132 O[C@@H]1C(CCl)OC[C@@H]1O Amb24515095 [0,1,0,1,0,0|2,0,0]=4 10753 B9R1.132 O[C@@H]1C(CF)OC[C@@H]1O Amb24584075 [0,1,0,1,0,0|2,0,0]=4 10754 B9R1.132 O[C@@H]1[C@@H](CCl)OC[C@H]1O Amb25202017 [0,1,0,1,0,0|2,0,0]=4 10755 B9R1.132 O[C@H]1[C@@H](CBr)OC[C@@H]1O Amb24570884 [0,1,0,1,0,0|2,0,0]=4 10756 B9R1.132 O[C@H]1[C@@H](F)CS[C@@H]1CO Amb25307559 [0,1,0,1,0,0|1,1,0]=4 10757 B9R1.132 O[C@H]1[C@H](CCl)OC[C@@H]1Cl Amb24677763 [0,1,0,1,0,0|2,0,0]=4 10758 B9R1.132 O[C@H]1[C@H](CCl)OC[C@H]1O Amb24628973 [0,1,0,1,0,0|2,0,0]=4 10759 B9R1.132 O[C@H]1[C@H](COC1=O)CO Amb24733237 [0,1,0,1,0,0|1,0,1]=4 10760 B9R1.132 O[C@H]1[C@H](F)CN[C@@H]1CO Amb25292264 [0,1,0,1,0,0|2,0,0]=4 10761 B9R1.135 CC1C(C)CN1CCI Amb24633198 [0,1,0,1,0,0|2,0,0]=4 10762 B9R1.135 CCCN1CC(C)C1C Amb25162422 [0,1,0,1,0,0|2,0,0]=4 10763 B9R1.202 CC1(CCCC1O)CO Amb24622978 [0,1,0,1,0,0|2,0,0]=4 10764 B9R1.202 CC1(CO)CCCC1N Amb19337610 [0,1,0,1,0,0|2,0,0]=4 10765 B9R1.202 CC1(CO)COCC1N Amb24590914 [0,1,0,1,0,0|2,0,0]=4 10766 B9R1.202 CC1(COCC1N)CN Amb25380648 [0,1,0,1,0,0|2,0,0]=4 10767 B9R1.202 CC1CCCC1(C)CN Amb24615536 [0,1,0,1,0,0|2,0,0]=4 10768 B9R1.202 CC1CCCC1(N)CO Amb25792492 [0,1,0,1,0,0|1,0,0]=3 10769 B9R1.202 CC1CCCC1(O)CN Amb25146157 [0,1,0,1,0,0|2,0,0]=4 10770 B9R1.202 CC1CSCC1(O)CO Amb25765926 [0,1,0,1,0,0|2,0,0]=4 10771 B9R1.202 CC1OCCC1(C)CO Amb25356615 [0,1,0,1,0,0|2,0,0]=4 10772 B9R1.202 CC1OCOC1(C)CO Amb24414860 [0,1,0,1,0,0|1,0,0]=3 10773 B9R1.202 CCC1(C)CCOC1O Amb25185383 [0,1,0,1,0,0|2,0,0]=4 10774 B9R1.202 CCC1(C)CNCC1C Amb24585935 [0,1,0,1,0,0|2,0,0]=4 10775 B9R1.202 CCC1(O)CCCC1C Amb24474369 [0,1,0,1,0,0|2,0,0]=4 10776 B9R1.202 CCC1(O)CCCC1Cl Amb24470021 [0,1,0,1,0,0|2,0,0]=4 10777 B9R1.202 CCC1(O)CCCC1N Amb25274889 [0,1,0,1,0,0|2,0,0]=4 10778 B9R1.202 CC[C@]1(C)CCC[C@H]1O Amb25177049 [0,1,0,1,0,0|1,0,0]=3 10779 B9R1.202 CC[C@]1(C)OCC[C@H]1Cl Amb24601774 [0,1,0,1,0,0|2,0,0]=4 10780 B9R1.202 CC[C@]1(O)CCC[C@H]1O Amb24609847 [0,1,0,1,0,0|1,0,0]=3 10781 B9R1.202 CN1CCCC1(C)CO Amb25357576 [0,1,0,1,0,0|2,0,0]=4 10782 B9R1.202 COC1(C)CCCC1O Amb25284489 [0,1,0,1,0,0|2,0,0]=4 10783 B9R1.202 C[C@H]1OCO[C@]1(C)CO Amb25226687 [0,1,0,1,0,0|1,0,0]=3 10784 B9R1.202 OC[C@@]1(F)CNC[C@@H]1O Amb24671252 [0,1,0,1,0,0|2,0,0]=4 10785 B9R1.202 OC[C@@]1(O)CNC[C@@H]1O Amb25175441 [0,1,0,1,0,0|2,0,0]=4 10786 B9R1.202 OC[C@@]1(O)CNC[C@H]1O Amb24629389 [0,1,0,1,0,0|2,0,0]=4 10787 B9R1.202 OC[C@@]1(O)OCC[C@H]1O Amb24539966 [0,1,0,1,0,0|1,0,0]=3 10788 B9R1.202 OC[C@]1(F)CNC[C@H]1O Amb24581193 [0,1,0,1,0,0|2,0,0]=4 10789 B9R1.202 OC[C@]1(O)CNC[C@H]1O Amb24598285 [0,1,0,1,0,0|2,0,0]=4 10790 B9R1.202 OC[C@]1(O)OCC[C@@H]1O Amb24735508 [0,1,0,1,0,0|1,0,0]=3 10791 B9R1.6 CC(=O)C1CCCCO1 Amb23585662 [0,1,0,1,0,0|0,0,2]=4 10792 B9R1.6 CC(=O)C1CNCCO1 Amb22754664 [0,1,0,1,0,0|1,0,1]=4 10793 B9R1.6 CC(=O)C1CNCCO1 Amb25147230 [0,1,0,1,0,0|1,0,1]=4 10794 B9R1.6 CC(=O)C1COCCN1 Amb24761214 [0,1,0,1,0,0|1,0,1]=4 10795 B9R1.6 CC(=O)C1COCCO1 Amb20669104 [0,1,0,1,0,0|0,0,1]=3 10796 B9R1.6 CC(=O)C1CSCCO1 Amb24751439 [0,1,0,1,0,0|0,1,1]=4 10797 B9R1.6 CC(Br)C1=NOCCO1 Amb25774096 [0,1,0,1,0,0|1,0,1]=4 10798 B9R1.6 CC(Br)C1CCCOC1 Amb25105081 [0,1,0,1,0,0|1,0,0]=3 10799 B9R1.6 CC(Br)C1OCCCO1 Amb25045267 [0,1,0,1,0,0|2,0,0]=4 10800 B9R1.6 CC(C)C1CNCCN1 Amb20241001 [0,1,0,1,0,0|2,0,0]=4 10801 B9R1.6 CC(C)C1CNCCO1 Amb22436835 [0,1,0,1,0,0|1,0,0]=3 10802 B9R1.6 CC(C)C1CNCCS1 Amb19149205 [0,1,0,1,0,0|1,1,0]=4 10803 B9R1.6 CC(C)C1CSCCN1 Amb25294013 [0,1,0,1,0,0|1,1,0]=4 10804 B9R1.6 CC(C)[C@@H]1CCCCN1 Amb24671326 [0,1,0,1,0,0|2,0,0]=4 10805 B9R1.6 CC(C)[C@@H]1CNCCO1 Amb20242065 [0,1,0,1,0,0|1,0,0]=3 10806 B9R1.6 CC(C)[C@@H]1COCCN1 Amb20242983 [0,1,0,1,0,0|1,0,0]=3 10807 B9R1.6 CC(C)[C@@H]1COCCN1 Amb22232226 [0,1,0,1,0,0|1,0,0]=3 10808 B9R1.6 CC(C)[C@@H]1CSCCN1 Amb25269723 [0,1,0,1,0,0|1,1,0]=4 10809 B9R1.6 CC(C)[C@H]1CCCCN1 Amb24417281 [0,1,0,1,0,0|2,0,0]=4 10810 B9R1.6 CC(C)[C@H]1CNCCC1 Amb24745922 [0,1,0,1,0,0|2,0,0]=4 10811 B9R1.6 CC(C)[C@H]1CNCCO1 Amb20241789 [0,1,0,1,0,0|1,0,0]=3 10812 B9R1.6 CC(C)[C@H]1COCCN1 Amb20242984 [0,1,0,1,0,0|1,0,0]=3 10813 B9R1.6 CC(C1CCCCN1)C Amb2235858 [0,1,0,1,0,0|2,0,0]=4 10814 B9R1.6 CC(C1CCCCN1)C Amb2237211 [0,1,0,1,0,0|2,0,0]=4 10815 B9R1.6 CC(C1CCCNC1)C Amb10607741 [0,1,0,1,0,0|2,0,0]=4 10816 B9R1.6 CC(C1CCCNC1)O Amb17593363 [0,1,0,1,0,0|2,0,0]=4 10817 B9R1.6 CC(C1NCCCO1)C Amb17506193 [0,1,0,1,0,0|2,0,0]=4 10818 B9R1.6 CC(C1NCCNC1)C Amb10068388 [0,1,0,1,0,0|2,0,0]=4 10819 B9R1.6 CC(C1NCCOC1)C Amb17231859 [0,1,0,1,0,0|1,0,0]=3 10820 B9R1.6 CC(C1OCCNC1)C Amb17470366 [0,1,0,1,0,0|1,0,0]=3 10821 B9R1.6 CC(Cl)C1CCCOC1 Amb24604738 [0,1,0,1,0,0|1,0,0]=3 10822 B9R1.6 CC(Cl)C1CNCCO1 Amb25076729 [0,1,0,1,0,0|1,0,0]=3 10823 B9R1.6 CC(F)C1CCCCN1 Amb23454847 [0,1,0,1,0,0|2,0,0]=4 10824 B9R1.6 CC(F)C1CCCNC1 Amb23454853 [0,1,0,1,0,0|2,0,0]=4 10825 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [0,1,0,1,0,0|2,0,0]=4 10826 B9R1.6 CC(N)C1CCCNC1 Amb18832598 [0,1,0,1,0,0|2,0,0]=4 10827 B9R1.6 CC(N)C1CCCOC1 Amb18832549 [0,1,0,1,0,0|1,0,0]=3 10828 B9R1.6 CC(N)C1CCCSC1 Amb18825995 [0,1,0,1,0,0|1,1,0]=4 10829 B9R1.6 CC(N)C1CNCCN1 Amb24567234 [0,1,0,1,0,0|2,0,0]=4 10830 B9R1.6 CC(N)C1CSCCO1 Amb25822930 [0,1,0,1,0,0|0,1,0]=3 10831 B9R1.6 CC(N)[SiH]1CCCCO1 Amb24640666 [0,1,0,1,0,0|1,1,0]=4 10832 B9R1.6 CC(N1CCCCC1)O Amb10603455 [0,1,0,1,0,0|2,0,0]=4 10833 B9R1.6 CC(O)C1=CCCCO1 Amb25349292 [0,1,0,1,0,0|0,0,2]=4 10834 B9R1.6 CC(O)C1CCCC=C1 Amb22365214 [0,1,0,1,0,0|1,0,1]=4 10835 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,1,0,1,0,0|1,0,0]=3 10836 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|0,0,0]=2 10837 B9R1.6 CC(O)C1CCCCS1 Amb23568559 [0,1,0,1,0,0|0,1,0]=3 10838 B9R1.6 CC(O)C1CCCOC1 Amb23590161 [0,1,0,1,0,0|1,0,0]=3 10839 B9R1.6 CC(O)C1CCNCC1 Amb21955698 [0,1,0,1,0,0|2,0,0]=4 10840 B9R1.6 CC(O)C1CCNCC1 Amb22587101 [0,1,0,1,0,0|2,0,0]=4 10841 B9R1.6 CC(O)C1CCNCC1 Amb22899459 [0,1,0,1,0,0|2,0,0]=4 10842 B9R1.6 CC(O)C1CCOCC1 Amb20667854 [0,1,0,1,0,0|2,0,0]=4 10843 B9R1.6 CC(O)C1CNCCN1 Amb24373460 [0,1,0,1,0,0|2,0,0]=4 10844 B9R1.6 CC(O)C=1CCCCC1 Amb25747240 [0,1,0,1,0,0|1,0,1]=4 10845 B9R1.6 CC(S)C1CCCCN1 Amb25707556 [0,1,0,1,0,0|1,1,0]=4 10846 B9R1.6 CC([C@@H]1NCCNC1)C Amb15690737 [0,1,0,1,0,0|2,0,0]=4 10847 B9R1.6 CC([C@H]1NCCNC1)C Amb15690738 [0,1,0,1,0,0|2,0,0]=4 10848 B9R1.6 CN(C)C1CCCCO1 Amb22523025 [0,1,0,1,0,0|2,0,0]=4 10849 B9R1.6 CS(=O)C1COCCC1 Amb25303295 [0,1,0,1,0,0|2,0,0]=4 10850 B9R1.6 C[C@@H](C1CCCCC1)O Amb13952949 [0,1,0,1,0,0|1,0,0]=3 10851 B9R1.6 C[C@@H](N)C1CCCOC1 Amb25705770 [0,1,0,1,0,0|1,0,0]=3 10852 B9R1.6 C[C@@H](N)C1CSCCO1 Amb24465737 [0,1,0,1,0,0|0,1,0]=3 10853 B9R1.6 C[C@@H](N)C1CSCCS1 Amb24517283 [0,1,0,1,0,0|0,2,0]=4 10854 B9R1.6 C[C@@H](O)C1CCOCC1 Amb25121022 [0,1,0,1,0,0|2,0,0]=4 10855 B9R1.6 C[C@@H](O)C=1CCCCC1 Amb25822621 [0,1,0,1,0,0|1,0,1]=4 10856 B9R1.6 C[C@@H](O)[C@@H]1CCCC=C1 Amb25218235 [0,1,0,1,0,0|1,0,1]=4 10857 B9R1.6 C[C@@H](O)[C@H]1CCCCO1 Amb25306509 [0,1,0,1,0,0|0,0,0]=2 10858 B9R1.6 C[C@H](C1CCCCC1)O Amb13952948 [0,1,0,1,0,0|1,0,0]=3 10859 B9R1.6 C[C@H](N)C1CCCOC1 Amb25147114 [0,1,0,1,0,0|1,0,0]=3 10860 B9R1.6 C[C@H](N)C1CSCCO1 Amb25180314 [0,1,0,1,0,0|0,1,0]=3 10861 B9R1.6 C[C@H](O)C1CCOCC1 Amb25077475 [0,1,0,1,0,0|2,0,0]=4 10862 B9R1.6 C[C@H](O)C1OCCCO1 Amb25824593 [0,1,0,1,0,0|1,0,0]=3 10863 B9R1.6 C[C@H](O)[C@@H]1CCCCN1 Amb25260768 [0,1,0,1,0,0|1,0,0]=3 10864 B9R1.6 C[C@H](O)[C@H]1CCCC=C1 Amb24705837 [0,1,0,1,0,0|1,0,1]=4 10865 B9R1.6 C[C@H](O)[C@H]1CCCCO1 Amb25357465 [0,1,0,1,0,0|0,0,0]=2 10866 B9R1.6 ClC(Cl)C1CCCCC1 Amb25772790 [0,1,0,1,0,0|2,0,0]=4 10867 B9R1.6 ClC(Cl)C1CCCCO1 Amb24558164 [0,1,0,1,0,0|1,0,0]=3 10868 B9R1.6 ClC(Cl)C1OCCCO1 Amb25074560 [0,1,0,1,0,0|2,0,0]=4 10869 B9R1.6 FC(F)C1CCCCN1 Amb23585655 [0,1,0,1,0,0|2,0,0]=4 10870 B9R1.6 FC(F)C1CNCCO1 Amb24382465 [0,1,0,1,0,0|2,0,0]=4 10871 B9R1.6 NC(=N)C1CCCCO1 Amb25212338 [0,1,0,1,0,0|1,0,1]=4 10872 B9R1.6 NC(O)C1CCCCC1 Amb24527829 [0,1,0,1,0,0|1,0,0]=3 10873 B9R1.6 O=C(Cl)C1COCCO1 Amb18280665 [0,1,0,1,0,0|1,0,1]=4 10874 B9R1.6 O=C(Cl)[C@H]1CCCCO1 Amb24478586 [0,1,0,1,0,0|0,0,2]=4 10875 B9R1.6 OB(C1CCCCC1)O Amb1630358 [0,1,0,1,0,0|2,0,0]=4 10876 B9R1.6 OB(O)C1CNCCO1 Amb24314284 [0,1,0,1,0,0|2,0,0]=4 10877 B9R1.6 OB(O)C1COCCO1 Amb24314285 [0,1,0,1,0,0|2,0,0]=4 10878 B9R1.6 OC(=O)C1CCCCS1 Amb18202314 [0,1,0,1,0,0|0,1,1]=4 10879 B9R1.6 OC(=O)C1CCCNO1 Amb24672392 [0,1,0,1,0,0|1,0,1]=4 10880 B9R1.6 OC(=O)C1CNCCO1 Amb16232076 [0,1,0,1,0,0|1,0,1]=4 10881 B9R1.6 OC(=O)C1CSCCO1 Amb25241709 [0,1,0,1,0,0|1,0,1]=4 10882 B9R1.6 OC(=O)C1OCCCO1 Amb24715581 [0,1,0,1,0,0|1,0,1]=4 10883 B9R1.6 OC(=O)[C@@H]1CCCCO1 Amb22746821 [0,1,0,1,0,0|0,0,1]=3 10884 B9R1.6 OC(=O)[C@@H]1CNCCO1 Amb22737231 [0,1,0,1,0,0|1,0,1]=4 10885 B9R1.6 OC(=O)[C@@H]1COCCO1 Amb23438856 [0,1,0,1,0,0|1,0,1]=4 10886 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb10067023 [0,1,0,1,0,0|1,0,1]=4 10887 B9R1.6 OC(=O)[C@H]1CNCCO1 Amb22737232 [0,1,0,1,0,0|1,0,1]=4 10888 B9R1.6 OC(O)C1CCCCC1 Amb25051444 [0,1,0,1,0,0|1,0,0]=3 10889 B9R1.6 OP(=O)C1CCCCC1 Amb25327219 [0,1,0,1,0,0|2,0,0]=4 10890 B9R1.6 OS(=O)C1CCCCC1 Amb24603074 [0,1,0,1,0,0|2,0,0]=4 10891 B9R1.6 O[13C](=O)C1CCCCN1 Amb22363349 [0,1,0,1,0,0|1,0,1]=4 10892 B9R1.6 [O-]C(=S)[C@H]1CCCCO1 Amb24382724 [0,1,0,1,0,0|0,0,2]=4 10893 B9R1.13 CC(=O)CC1CCCO1 Amb13952621 [0,1,0,1,0,0|1,0,1]=4 10894 B9R1.13 CC(=O)CC1OCCO1 Amb22359800 [0,1,0,1,0,0|0,0,1]=3 10895 B9R1.13 CC(=O)C[C@H]1CCCO1 Amb24752778 [0,1,0,1,0,0|1,0,1]=4 10896 B9R1.13 CC(Br)CC1CCCC1 Amb24693833 [0,1,0,1,0,0|2,0,0]=4 10897 B9R1.13 CC(Br)CC1CCCN1 Amb25306699 [0,1,0,1,0,0|2,0,0]=4 10898 B9R1.13 CC(C)=CC1OCCO1 Amb24668230 [0,1,0,1,0,0|0,0,2]=4 10899 B9R1.13 CC(C)CC1CCCC1 Amb22230763 [0,1,0,1,0,0|2,0,0]=4 10900 B9R1.13 CC(C)CC1CCCN1 Amb17659147 [0,1,0,1,0,0|2,0,0]=4 10901 B9R1.13 CC(C)CC1NCCS1 Amb25677555 [0,1,0,1,0,0|1,1,0]=4 10902 B9R1.13 CC(C)CN1CCCO1 Amb24481928 [0,1,0,1,0,0|2,0,0]=4 10903 B9R1.13 CC(C)C[C@@H]1CCCN1 Amb25338158 [0,1,0,1,0,0|2,0,0]=4 10904 B9R1.13 CC(C)C[C@H]1CCCN1 Amb25757364 [0,1,0,1,0,0|2,0,0]=4 10905 B9R1.13 CC(C)OB1OCCO1 Amb24596037 [0,1,0,1,0,0|2,0,0]=4 10906 B9R1.13 CC(CC1CCCN1)C Amb10068751 [0,1,0,1,0,0|2,0,0]=4 10907 B9R1.13 CC(CC1CCCN1)C Amb2234647 [0,1,0,1,0,0|2,0,0]=4 10908 B9R1.13 CC(CC1CCCO1)N Amb13952622 [0,1,0,1,0,0|1,0,0]=3 10909 B9R1.13 CC(CC1NCCO1)C Amb17506169 [0,1,0,1,0,0|1,0,0]=3 10910 B9R1.13 CC(CC1OCCO1)Br Amb17336914 [0,1,0,1,0,0|0,0,0]=2 10911 B9R1.13 CC(CC1OCCO1)N Amb17334127 [0,1,0,1,0,0|0,0,0]=2 10912 B9R1.13 CC(CN1CCCC1)C Amb17231850 [0,1,0,1,0,0|2,0,0]=4 10913 B9R1.13 CC(CN1CCCC1)N Amb1099344 [0,1,0,1,0,0|2,0,0]=4 10914 B9R1.13 CC(Cl)CC1CCCC1 Amb25205158 [0,1,0,1,0,0|2,0,0]=4 10915 B9R1.13 CC(N)CC1CCCC1 Amb18962767 [0,1,0,1,0,0|2,0,0]=4 10916 B9R1.13 CC(N)CC1CCCN1 Amb25770853 [0,1,0,1,0,0|2,0,0]=4 10917 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|2,0,0]=4 10918 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|1,1,0]=4 10919 B9R1.13 CC(O)CC1OCCO1 Amb24543557 [0,1,0,1,0,0|0,0,0]=2 10920 B9R1.13 CC(O)C[C@@H]1CCCN1 Amb25027963 [0,1,0,1,0,0|2,0,0]=4 10921 B9R1.13 CN(C)CC1CCCO1 Amb25075157 [0,1,0,1,0,0|2,0,0]=4 10922 B9R1.13 CN(C)CC1OCCO1 Amb25228107 [0,1,0,1,0,0|1,0,0]=3 10923 B9R1.13 CN(N)CC1CCCO1 Amb24340207 [0,1,0,1,0,0|2,0,0]=4 10924 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|1,0,0]=3 10925 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|1,0,0]=3 10926 B9R1.13 C[C@H](O)CC1SCCS1 Amb24407537 [0,1,0,1,0,0|0,2,0]=4 10927 B9R1.13 C[C@H](O)C[C@@H]1CCCO1 Amb25176662 [0,1,0,1,0,0|1,0,0]=3 10928 B9R1.13 ClC(Cl)CC1CCCO1 Amb24652299 [0,1,0,1,0,0|2,0,0]=4 10929 B9R1.13 ClC(Cl)CC1OCCO1 Amb24480171 [0,1,0,1,0,0|1,0,0]=3 10930 B9R1.13 OB(O)CC1CCCC1 Amb25320686 [0,1,0,1,0,0|2,0,0]=4 10931 B9R1.13 OC(=O)CC1CCCC1 Amb16192937 [0,1,0,1,0,0|1,0,1]=4 10932 B9R1.13 OC(=O)CC1OCCO1 Amb22740193 [0,1,0,1,0,0|1,0,1]=4 10933 B9R1.13 OC(O)CC1NCCO1 Amb25824204 [0,1,0,1,0,0|2,0,0]=4 10934 B9R1.24 CC1(C)CCCC1CO Amb25698070 [0,1,0,1,0,0|1,0,0]=3 10935 B9R1.24 CC1(C)CCC[C@@H]1CN Amb24476773 [0,1,0,1,0,0|2,0,0]=4 10936 B9R1.24 CC1(C)CCC[C@H]1CN Amb24476765 [0,1,0,1,0,0|2,0,0]=4 10937 B9R1.24 CC1(C)CCNC1CO Amb24470876 [0,1,0,1,0,0|1,0,0]=3 10938 B9R1.24 CC1(C)CCOC1C=O Amb21961947 [0,1,0,1,0,0|0,0,2]=4 10939 B9R1.24 CC1(C)CCOC1CO Amb25725383 [0,1,0,1,0,0|0,0,0]=2 10940 B9R1.24 CC1(C)COCC1CBr Amb25773000 [0,1,0,1,0,0|2,0,0]=4 10941 B9R1.24 CC1(C)COCC1CN Amb24353568 [0,1,0,1,0,0|2,0,0]=4 10942 B9R1.24 CC1(C)COCC1CO Amb25028034 [0,1,0,1,0,0|2,0,0]=4 10943 B9R1.24 CC1(C)OCCC1CO Amb25823110 [0,1,0,1,0,0|2,0,0]=4 10944 B9R1.24 CC1(C)SCNC1CO Amb25298896 [0,1,0,1,0,0|2,0,0]=4 10945 B9R1.24 CC1(C)SCN[C@H]1CO Amb25743198 [0,1,0,1,0,0|2,0,0]=4 10946 B9R1.24 CC1(N)CCCC1CO Amb24743154 [0,1,0,1,0,0|1,0,0]=3 10947 B9R1.24 CCC1CCCC1(C)O Amb24457207 [0,1,0,1,0,0|1,0,0]=3 10948 B9R1.24 CCC1CNCC1(C)O Amb18642714 [0,1,0,1,0,0|1,0,0]=3 10949 B9R1.24 CCC1CNCC1(F)F Amb25178309 [0,1,0,1,0,0|2,0,0]=4 10950 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb24056604 [0,1,0,1,0,0|1,0,0]=3 10951 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [0,1,0,1,0,0|1,0,0]=3 10952 B9R1.24 C[C@@]1(O)CCC[C@H]1CO Amb25206321 [0,1,0,1,0,0|1,0,0]=3 10953 B9R1.24 C[C@]1(O)CCC[C@H]1CN Amb24563033 [0,1,0,1,0,0|2,0,0]=4 10954 B9R1.24 C[N+]1(C)CCCC1CO Amb25345378 [0,1,0,1,0,0|2,0,0]=4 10955 B9R1.24 OCC1CCCC1(F)F Amb25852586 [0,1,0,1,0,0|2,0,0]=4 10956 B9R1.24 OCC1NCCC1(F)F Amb25064333 [0,1,0,1,0,0|2,0,0]=4 10957 B9R1.24 OC[C@@H]1CCC[C@]1(C)N Amb1993801 [0,1,0,1,0,0|1,0,0]=3 10958 B9R1.40 CC1(Br)CCCCC1Br Amb25091475 [0,1,0,1,0,0|2,0,0]=4 10959 B9R1.40 CC1(C)CCC=CC1O Amb25320580 [0,1,0,1,0,0|1,0,1]=4 10960 B9R1.40 CC1(C)CCC=C[C@H]1O Amb24431884 [0,1,0,1,0,0|1,0,1]=4 10961 B9R1.40 CC1(C)CCCCC1Br Amb24340302 [0,1,0,1,0,0|2,0,0]=4 10962 B9R1.40 CC1(C)CCCCC1Cl Amb24635734 [0,1,0,1,0,0|2,0,0]=4 10963 B9R1.40 CC1(C)CCCCC1N Amb18642545 [0,1,0,1,0,0|2,0,0]=4 10964 B9R1.40 CC1(C)CCCCC1O Amb22748701 [0,1,0,1,0,0|1,0,0]=3 10965 B9R1.40 CC1(C)CCCC[C@H]1N Amb24477719 [0,1,0,1,0,0|2,0,0]=4 10966 B9R1.40 CC1(C)CCCOC1O Amb24395641 [0,1,0,1,0,0|2,0,0]=4 10967 B9R1.40 CC1(C)CCSCC1S Amb24448173 [0,1,0,1,0,0|0,2,0]=4 10968 B9R1.40 CC1(C)COCCC1N Amb23439967 [0,1,0,1,0,0|2,0,0]=4 10969 B9R1.40 CC1(C)COCCC1N Amb24120412 [0,1,0,1,0,0|2,0,0]=4 10970 B9R1.40 CC1(Cl)CCCCC1Br Amb24567107 [0,1,0,1,0,0|2,0,0]=4 10971 B9R1.40 CC1(Cl)CCOCC1Cl Amb25146996 [0,1,0,1,0,0|1,0,0]=3 10972 B9R1.40 CC1(F)CCCCC1Br Amb25701675 [0,1,0,1,0,0|2,0,0]=4 10973 B9R1.40 CC1(F)CCCCC1O Amb25676651 [0,1,0,1,0,0|1,0,0]=3 10974 B9R1.40 CC1(F)CCNCC1F Amb22886355 [0,1,0,1,0,0|2,0,0]=4 10975 B9R1.40 CC1(N)CCCCC1N Amb24480309 [0,1,0,1,0,0|2,0,0]=4 10976 B9R1.40 CC1(O)CCCCC1Br Amb24480133 [0,1,0,1,0,0|2,0,0]=4 10977 B9R1.40 CC1(O)CCCCC1N Amb25709525 [0,1,0,1,0,0|2,0,0]=4 10978 B9R1.40 CC1(O)CCCOC1O Amb24370044 [0,1,0,1,0,0|2,0,0]=4 10979 B9R1.40 CC1(O)CCOCC1Cl Amb25032288 [0,1,0,1,0,0|1,0,0]=3 10980 B9R1.40 CC1(O)CCOCC1N Amb24478329 [0,1,0,1,0,0|1,0,0]=3 10981 B9R1.40 CC1(O)CNCCC1O Amb24653757 [0,1,0,1,0,0|2,0,0]=4 10982 B9R1.40 CC1(O)COCCC1=O Amb24737493 [0,1,0,1,0,0|1,0,1]=4 10983 B9R1.40 CC1(O)COCCC1N Amb24480311 [0,1,0,1,0,0|1,0,0]=3 10984 B9R1.40 CC1CCCCC1(C)C Amb22227673 [0,1,0,1,0,0|2,0,0]=4 10985 B9R1.40 CC1CCCCC1(F)F Amb20670617 [0,1,0,1,0,0|2,0,0]=4 10986 B9R1.40 CC1CCNCC1(C)C Amb25091675 [0,1,0,1,0,0|2,0,0]=4 10987 B9R1.40 CC1CCNCC1(F)F Amb22886349 [0,1,0,1,0,0|2,0,0]=4 10988 B9R1.40 CC1CNCCC1(C)C Amb25727683 [0,1,0,1,0,0|2,0,0]=4 10989 B9R1.40 CC1CNCCC1(C)O Amb22886361 [0,1,0,1,0,0|2,0,0]=4 10990 B9R1.40 CC1CNCCC1(C)O Amb24480321 [0,1,0,1,0,0|2,0,0]=4 10991 B9R1.40 C[C@@H]1CCCCC1(C)N Amb24477704 [0,1,0,1,0,0|2,0,0]=4 10992 B9R1.40 C[C@@H]1CCCC[C@@]1(C)N Amb25174496 [0,1,0,1,0,0|2,0,0]=4 10993 B9R1.40 C[C@@H]1CCCC[C@]1(C)N Amb24549933 [0,1,0,1,0,0|2,0,0]=4 10994 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O Amb22886386 [0,1,0,1,0,0|1,0,0]=3 10995 B9R1.40 C[C@@H]1CCNC[C@]1(C)O Amb22886385 [0,1,0,1,0,0|1,0,0]=3 10996 B9R1.40 C[C@@H]1CCNC[C@]1(C)O Amb24573524 [0,1,0,1,0,0|1,0,0]=3 10997 B9R1.40 C[C@@H]1CNCC[C@]1(C)O Amb25025153 [0,1,0,1,0,0|2,0,0]=4 10998 B9R1.40 C[C@@]1(Br)CCCC[C@H]1O Amb25176127 [0,1,0,1,0,0|1,0,0]=3 10999 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [0,1,0,1,0,0|1,0,0]=3 11000 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1Cl Amb25287109 [0,1,0,1,0,0|2,0,0]=4 11001 B9R1.40 C[C@@]1(Cl)CCCO[C@@H]1O Amb24630778 [0,1,0,1,0,0|2,0,0]=4 11002 B9R1.40 C[C@@]1(N)CCCC[C@@H]1N Amb25264096 [0,1,0,1,0,0|2,0,0]=4 11003 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [0,1,0,1,0,0|1,0,0]=3 11004 B9R1.40 C[C@@]1(O)CCCC[C@@H]1O Amb17844355 [0,1,0,1,0,0|1,0,0]=3 11005 B9R1.40 C[C@@]1(O)CCCC[C@H]1N Amb24382560 [0,1,0,1,0,0|2,0,0]=4 11006 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [0,1,0,1,0,0|1,0,0]=3 11007 B9R1.40 C[C@@]1(O)CCNC[C@@H]1F Amb22886354 [0,1,0,1,0,0|2,0,0]=4 11008 B9R1.40 C[C@@]1(O)CCNC[C@@H]1O Amb25025955 [0,1,0,1,0,0|1,0,0]=3 11009 B9R1.40 C[C@@]1(O)CCNC[C@H]1F Amb22886353 [0,1,0,1,0,0|2,0,0]=4 11010 B9R1.40 C[C@@]1(O)CCOC[C@@H]1O Amb22757723 [0,1,0,1,0,0|0,0,0]=2 11011 B9R1.40 C[C@@]1(O)CCOC[C@H]1Cl Amb24745847 [0,1,0,1,0,0|1,0,0]=3 11012 B9R1.40 C[C@@]1(O)CNCC[C@@H]1O Amb24622491 [0,1,0,1,0,0|2,0,0]=4 11013 B9R1.40 C[C@]1(Br)CCCC[C@@H]1Cl Amb25176615 [0,1,0,1,0,0|2,0,0]=4 11014 B9R1.40 C[C@]1(Cl)CCCC[C@@H]1Br Amb25218852 [0,1,0,1,0,0|2,0,0]=4 11015 B9R1.40 C[C@]1(Cl)CCCO[C@@H]1O Amb24613840 [0,1,0,1,0,0|2,0,0]=4 11016 B9R1.40 C[C@]1(Cl)CCCO[C@H]1O Amb24631495 [0,1,0,1,0,0|2,0,0]=4 11017 B9R1.40 C[C@]1(F)CCCC[C@H]1O Amb24582074 [0,1,0,1,0,0|1,0,0]=3 11018 B9R1.40 C[C@]1(O)CCCCC1Cl Amb24480007 [0,1,0,1,0,0|2,0,0]=4 11019 B9R1.40 C[C@]1(O)CCCC[C@@H]1N Amb25293517 [0,1,0,1,0,0|2,0,0]=4 11020 B9R1.40 C[C@]1(O)CCCC[C@H]1Br Amb24595012 [0,1,0,1,0,0|2,0,0]=4 11021 B9R1.40 C[C@]1(O)CCCC[C@H]1O Amb25285065 [0,1,0,1,0,0|1,0,0]=3 11022 B9R1.40 C[C@]1(O)COCC[C@H]1N Amb24550283 [0,1,0,1,0,0|1,0,0]=3 11023 B9R1.40 C[Si]1(C)CCCC[C@@H]1O Amb24413730 [0,1,0,1,0,0|1,1,0]=4 11024 B9R1.40 ClC1CCCCC1(C)O Amb17593706 [0,1,0,1,0,0|2,0,0]=4 11025 B9R1.40 ClC1CCOCC1(Cl)Cl Amb24480072 [0,1,0,1,0,0|2,0,0]=4 11026 B9R1.40 NC1CCCCC1(N)O Amb25111965 [0,1,0,1,0,0|2,0,0]=4 11027 B9R1.40 NC1COCCC1(F)F Amb22490260 [0,1,0,1,0,0|2,0,0]=4 11028 B9R1.40 NC1COCCC1(F)F Amb22899786 [0,1,0,1,0,0|2,0,0]=4 11029 B9R1.40 OC1(O)CCOCC1F Amb23439962 [0,1,0,1,0,0|2,0,0]=4 11030 B9R1.40 OC1CCNCC1(C)C Amb10602172 [0,1,0,1,0,0|2,0,0]=4 11031 B9R1.40 OC1CNCCC1(F)F Amb23439334 [0,1,0,1,0,0|2,0,0]=4 11032 B9R1.41 CC(=C)C1CNCC1O Amb24568954 [0,1,0,1,0,0|1,0,1]=4 11033 B9R1.41 CC(=C)[C@H]1CCC[C@H]1O Amb25276295 [0,1,0,1,0,0|1,0,1]=4 11034 B9R1.41 CC(=C)[C@H]1CNC[C@@H]1O Amb25206231 [0,1,0,1,0,0|1,0,1]=4 11035 B9R1.41 CC(=O)C1CCCC1O Amb25086736 [0,1,0,1,0,0|1,0,1]=4 11036 B9R1.41 CC(=O)C1CSCC1O Amb25685933 [0,1,0,1,0,0|0,1,1]=4 11037 B9R1.41 CC(=O)[C@@H]1CSC[C@@H]1O Amb25046323 [0,1,0,1,0,0|0,1,1]=4 11038 B9R1.41 CC(=O)[C@@H]1CSC[C@H]1O Amb25110108 [0,1,0,1,0,0|0,1,1]=4 11039 B9R1.41 CC(=O)[C@H]1CCC[C@@H]1O Amb24512739 [0,1,0,1,0,0|1,0,1]=4 11040 B9R1.41 CC(=O)[C@H]1CSC[C@@H]1O Amb25174811 [0,1,0,1,0,0|0,1,1]=4 11041 B9R1.41 CC(=O)[C@H]1CSC[C@H]1O Amb24594984 [0,1,0,1,0,0|0,1,1]=4 11042 B9R1.41 CC(C)C1CCCC1Br Amb19073226 [0,1,0,1,0,0|2,0,0]=4 11043 B9R1.41 CC(C)C1CCCC1Cl Amb24402060 [0,1,0,1,0,0|2,0,0]=4 11044 B9R1.41 CC(C)C1CCCC1N Amb18947760 [0,1,0,1,0,0|2,0,0]=4 11045 B9R1.41 CC(C)C1CCCC1O Amb25749420 [0,1,0,1,0,0|1,0,0]=3 11046 B9R1.41 CC(C)C1CCOC1O Amb25098606 [0,1,0,1,0,0|2,0,0]=4 11047 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,1,0,1,0,0|0,0,2]=4 11048 B9R1.41 CC(C)C1COCC1O Amb24386874 [0,1,0,1,0,0|0,0,0]=2 11049 B9R1.41 CC(C)C1CSCC1O Amb24481668 [0,1,0,1,0,0|0,1,0]=3 11050 B9R1.41 CC(C)C1OCCC1Cl Amb24558782 [0,1,0,1,0,0|2,0,0]=4 11051 B9R1.41 CC(C)C1SCCC1O Amb24454927 [0,1,0,1,0,0|2,0,0]=4 11052 B9R1.41 CC(C)[C@@H]1CCC[C@@H]1N Amb24622101 [0,1,0,1,0,0|2,0,0]=4 11053 B9R1.41 CC(C)[C@@H]1CCC[C@@H]1O Amb25175483 [0,1,0,1,0,0|1,0,0]=3 11054 B9R1.41 CC(C)[C@@H]1NCCC1O Amb18832556 [0,1,0,1,0,0|2,0,0]=4 11055 B9R1.41 CC(C)[C@@H]1NCC[C@@H]1O Amb25172339 [0,1,0,1,0,0|2,0,0]=4 11056 B9R1.41 CC(C)[C@@H]1NCC[C@H]1C Amb18832663 [0,1,0,1,0,0|2,0,0]=4 11057 B9R1.41 CC(C)[C@@H]1NCC[C@H]1O Amb24366323 [0,1,0,1,0,0|2,0,0]=4 11058 B9R1.41 CC(C)[C@@H]1SCC[C@@H]1O Amb25332176 [0,1,0,1,0,0|2,0,0]=4 11059 B9R1.41 CC(C)[C@H]1NCC[C@@H]1C Amb25254691 [0,1,0,1,0,0|2,0,0]=4 11060 B9R1.41 CC(C)[C@H]1OCC[C@H]1Cl Amb25258418 [0,1,0,1,0,0|2,0,0]=4 11061 B9R1.41 CC(O)[C@@H]1CCCN1C Amb24534366 [0,1,0,1,0,0|2,0,0]=4 11062 B9R1.41 CC1CCCC1C(C)Cl Amb24713516 [0,1,0,1,0,0|2,0,0]=4 11063 B9R1.41 CC1CCCC1[C@H](C)O Amb24738206 [0,1,0,1,0,0|1,0,0]=3 11064 B9R1.41 CC1CCNC1C(O)=O Amb22496299 [0,1,0,1,0,0|1,0,1]=4 11065 B9R1.41 CC1CCN[C@@H]1C(O)=O Amb25786199 [0,1,0,1,0,0|1,0,1]=4 11066 B9R1.41 CC1CCOC1C(C)O Amb24332228 [0,1,0,1,0,0|0,0,0]=2 11067 B9R1.41 CC1CCOC1C(N)=O Amb25107757 [0,1,0,1,0,0|0,0,2]=4 11068 B9R1.41 CC1CCOC1C(O)=O Amb20668280 [0,1,0,1,0,0|0,0,1]=3 11069 B9R1.41 CN(C)C1CCCC1O Amb19650708 [0,1,0,1,0,0|2,0,0]=4 11070 B9R1.41 CN(C)C1CNCC1O Amb25283476 [0,1,0,1,0,0|2,0,0]=4 11071 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1O Amb22899696 [0,1,0,1,0,0|2,0,0]=4 11072 B9R1.41 CN(C)[C@@H]1CNC[C@@H]1O Amb22757943 [0,1,0,1,0,0|2,0,0]=4 11073 B9R1.41 CN(C)[C@@H]1CNC[C@@H]1O Amb23385263 [0,1,0,1,0,0|2,0,0]=4 11074 B9R1.41 CN(C)[C@@H]1CNC[C@H]1O Amb22748751 [0,1,0,1,0,0|2,0,0]=4 11075 B9R1.41 CN(C)[C@@H]1COC[C@@H]1O Amb22746864 [0,1,0,1,0,0|1,0,0]=3 11076 B9R1.41 CN(C)[C@H]1CCCC1O Amb25369374 [0,1,0,1,0,0|2,0,0]=4 11077 B9R1.41 CN(C)[C@H]1CCC[C@@H]1O Amb25852161 [0,1,0,1,0,0|2,0,0]=4 11078 B9R1.41 CN(C)[C@H]1COC[C@@H]1N Amb24061623 [0,1,0,1,0,0|2,0,0]=4 11079 B9R1.41 CN(C)[C@H]1COC[C@H]1O Amb22230433 [0,1,0,1,0,0|1,0,0]=3 11080 B9R1.41 CN(N)C1CCCC1O Amb24371238 [0,1,0,1,0,0|2,0,0]=4 11081 B9R1.41 CN([C@@H]1CCC[C@H]1O)C Amb16230278 [0,1,0,1,0,0|2,0,0]=4 11082 B9R1.41 CS(=O)C1CNCC1O Amb24674532 [0,1,0,1,0,0|2,0,0]=4 11083 B9R1.41 CS(=O)[C@@H]1CNC[C@H]1O Amb24495227 [0,1,0,1,0,0|2,0,0]=4 11084 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|1,0,1]=4 11085 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|1,0,1]=4 11086 B9R1.41 C[C@@H]1CCN[C@H]1C(O)=O Amb22747259 [0,1,0,1,0,0|1,0,1]=4 11087 B9R1.41 C[C@@H]1CCO[C@@H]1C(O)=O Amb25251332 [0,1,0,1,0,0|0,0,1]=3 11088 B9R1.41 C[C@H](N)[C@@H]1OCC[C@@H]1O Amb24715824 [0,1,0,1,0,0|2,0,0]=4 11089 B9R1.41 C[C@H](N)[C@@H]1OCC[C@H]1O Amb25315960 [0,1,0,1,0,0|2,0,0]=4 11090 B9R1.41 C[C@H](N)[C@H]1CCC[C@H]1O Amb24621967 [0,1,0,1,0,0|1,0,0]=3 11091 B9R1.41 C[C@H]1CCC[C@@H]1B(O)O Amb24566352 [0,1,0,1,0,0|2,0,0]=4 11092 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|1,0,1]=4 11093 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|1,0,1]=4 11094 B9R1.41 C[C@H]1CCN[C@H]1C(O)=O Amb24715733 [0,1,0,1,0,0|1,0,1]=4 11095 B9R1.41 C[C@H]1COC[C@@H]1C(C)=O Amb24645383 [0,1,0,1,0,0|1,0,1]=4 11096 B9R1.41 OC(=O)C1OCCC1Cl Amb25124121 [0,1,0,1,0,0|1,0,1]=4 11097 B9R1.41 OC1CCCC1C(F)F Amb24738925 [0,1,0,1,0,0|2,0,0]=4 11098 B9R1.41 OC1COCC1B(O)O Amb24314286 [0,1,0,1,0,0|2,0,0]=4 11099 B9R1.41 O[C@H]1CNC[C@@H]1N(C)C Amb10608226 [0,1,0,1,0,0|2,0,0]=4 11100 B9R1.46 CC(C)CNC1CC1C Amb18298107 [0,1,0,1,0,0|2,0,0]=4 11101 B9R1.46 CC(C)CO[C@@H]1C[C@@H]1F Amb24600086 [0,1,0,1,0,0|2,0,0]=4 11102 B9R1.46 CC(C)CO[C@@H]1C[C@H]1F Amb24538987 [0,1,0,1,0,0|2,0,0]=4 11103 B9R1.46 CC1CC1NCC(C)N Amb25765193 [0,1,0,1,0,0|2,0,0]=4 11104 B9R1.46 CC1CC1NCC(C)O Amb25139772 [0,1,0,1,0,0|1,0,0]=3 11105 B9R1.46 CC1CC1NCC(O)=O Amb18993215 [0,1,0,1,0,0|1,0,1]=4 11106 B9R1.46 CC1CC1NC[C@@H](C)N Amb25129062 [0,1,0,1,0,0|2,0,0]=4 11107 B9R1.46 CC1CC1NC[C@@H](C)O Amb24644247 [0,1,0,1,0,0|1,0,0]=3 11108 B9R1.56 CCCC1NCC1(C)C Amb25686958 [0,1,0,1,0,0|2,0,0]=4 11109 B9R1.59 CC(C)C=1CC1CCO Amb25356230 [0,1,0,1,0,0|1,0,1]=4 11110 B9R1.59 CC(O)[C@@H]1O[C@H]1CCC Amb24583802 [0,1,0,1,0,0|0,0,0]=2 11111 B9R1.59 CCCC1CC1B(O)O Amb24329445 [0,1,0,1,0,0|2,0,0]=4 11112 B9R1.59 CCCC1CC1C(O)=O Amb19001459 [0,1,0,1,0,0|1,0,1]=4 11113 B9R1.59 CCCC1OC1C(O)=O Amb24561183 [0,1,0,1,0,0|0,0,1]=3 11114 B9R1.59 CCC[C@@H]1C[C@H]1C(O)=O Amb25368727 [0,1,0,1,0,0|1,0,1]=4 11115 B9R1.59 CCC[C@@H]1O[C@H]1C(C)=O Amb24366229 [0,1,0,1,0,0|0,0,2]=4 11116 B9R1.59 C[C@H](O)[C@@H]1O[C@@H]1CC=O Amb24553403 [0,1,0,1,0,0|1,0,1]=4 11117 B9R1.59 C[C@H](O)[C@@H]1O[C@H]1CCC Amb24660197 [0,1,0,1,0,0|0,0,0]=2 11118 B9R1.67 CC(=C)C[C@H]1SC[C@H]1O Amb24541579 [0,1,0,1,0,0|0,1,1]=4 11119 B9R1.67 CC(C)CC1CCC1N Amb24715445 [0,1,0,1,0,0|2,0,0]=4 11120 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,1,0,1,0,0|1,0,1]=4 11121 B9R1.67 CC1CCN1CC(C)N Amb24443529 [0,1,0,1,0,0|2,0,0]=4 11122 B9R1.67 CC1COC1CC(Cl)Cl Amb25835086 [0,1,0,1,0,0|2,0,0]=4 11123 B9R1.67 CN(C)CC1CCC1O Amb25781641 [0,1,0,1,0,0|2,0,0]=4 11124 B9R1.67 CN(C)C[C@@H]1CCC1O Amb24475829 [0,1,0,1,0,0|2,0,0]=4 11125 B9R1.77 CC1(C)CC1CCCO Amb24675490 [0,1,0,1,0,0|1,0,0]=3 11126 B9R1.77 CC1(C)CC1NCCN Amb18984061 [0,1,0,1,0,0|2,0,0]=4 11127 B9R1.77 CC1(C)CC1NCCO Amb18294623 [0,1,0,1,0,0|1,0,0]=3 11128 B9R1.77 CC1(C)CC1OCCCl Amb25145671 [0,1,0,1,0,0|1,0,0]=3 11129 B9R1.77 CC1(C)C[C@@H]1CCCBr Amb22745871 [0,1,0,1,0,0|2,0,0]=4 11130 B9R1.77 CC1(C)O[C@@H]1CCCO Amb25788968 [0,1,0,1,0,0|2,0,0]=4 11131 B9R1.77 CC1(O)CC1CCCO Amb24362727 [0,1,0,1,0,0|1,0,0]=3 11132 B9R1.77 CCCNC1CC1(C)C Amb18294322 [0,1,0,1,0,0|2,0,0]=4 11133 B9R1.77 CCCOC1CC1(Cl)Cl Amb25281055 [0,1,0,1,0,0|2,0,0]=4 11134 B9R1.77 C[C@@]1(O)C[C@@H]1CCCO Amb24698634 [0,1,0,1,0,0|1,0,0]=3 11135 B9R1.77 C[C@@]1(O)C[C@H]1CCCBr Amb25173061 [0,1,0,1,0,0|2,0,0]=4 11136 B9R1.77 ClCCOC1CC1(Cl)Cl Amb25774632 [0,1,0,1,0,0|2,0,0]=4 11137 B9R1.84 CC(C)CNC1CCC1 Amb18989307 [0,1,0,1,0,0|2,0,0]=4 11138 B9R1.84 CC(C)COC1CNC1 Amb18997211 [0,1,0,1,0,0|2,0,0]=4 11139 B9R1.84 CC(C)COC1CNC1 Amb20623614 [0,1,0,1,0,0|2,0,0]=4 11140 B9R1.84 CC(Cl)CCC1CCC1 Amb25334999 [0,1,0,1,0,0|2,0,0]=4 11141 B9R1.84 CC(N)CCC1CCO1 Amb25352168 [0,1,0,1,0,0|1,0,0]=3 11142 B9R1.84 CC(N)CCC1CCS1 Amb25376457 [0,1,0,1,0,0|1,1,0]=4 11143 B9R1.84 CC(N)CNC1CCC1 Amb18990486 [0,1,0,1,0,0|2,0,0]=4 11144 B9R1.84 CC(N)COC1CCC1 Amb18989557 [0,1,0,1,0,0|1,0,0]=3 11145 B9R1.84 CC(N)COC1COC1 Amb23454888 [0,1,0,1,0,0|2,0,0]=4 11146 B9R1.84 CC(N)COC1CSC1 Amb24740440 [0,1,0,1,0,0|2,0,0]=4 11147 B9R1.84 CC(N)CSC1CCC1 Amb24685575 [0,1,0,1,0,0|1,1,0]=4 11148 B9R1.84 CC(O)CCC1CSC1 Amb25377027 [0,1,0,1,0,0|2,0,0]=4 11149 B9R1.84 CC(O)CCN1CCC1 Amb24645974 [0,1,0,1,0,0|2,0,0]=4 11150 B9R1.84 CC(O)CNC1CCC1 Amb18989413 [0,1,0,1,0,0|1,0,0]=3 11151 B9R1.84 CC(O)CNC1CSC1 Amb24524244 [0,1,0,1,0,0|2,0,0]=4 11152 B9R1.84 CC(O)COC1CNC1 Amb24688760 [0,1,0,1,0,0|1,0,0]=3 11153 B9R1.84 CC(O)COC1COC1 Amb23454886 [0,1,0,1,0,0|1,0,0]=3 11154 B9R1.84 C[C@@H](N)CNC1CCC1 Amb25050269 [0,1,0,1,0,0|2,0,0]=4 11155 B9R1.84 C[C@@H](O)CNC1CNC1 Amb24439696 [0,1,0,1,0,0|2,0,0]=4 11156 B9R1.84 C[C@@H](O)CNC1CSC1 Amb24631306 [0,1,0,1,0,0|2,0,0]=4 11157 B9R1.84 C[C@H](N)CNC1CCC1 Amb24413158 [0,1,0,1,0,0|2,0,0]=4 11158 B9R1.84 C[C@H](N)COC1CCC1 Amb25032163 [0,1,0,1,0,0|1,0,0]=3 11159 B9R1.84 C[C@H](O)CNC1CCC1 Amb24481590 [0,1,0,1,0,0|1,0,0]=3 11160 B9R1.84 C[C@H](O)CNC1CSC1 Amb25297020 [0,1,0,1,0,0|2,0,0]=4 11161 B9R1.84 C[C@H](O)COC1COC1 Amb24605012 [0,1,0,1,0,0|1,0,0]=3 11162 B9R1.84 FC(F)CNC1CCC1 Amb20667985 [0,1,0,1,0,0|2,0,0]=4 11163 B9R1.84 FC(F)CNC1CCC1 Amb25686986 [0,1,0,1,0,0|2,0,0]=4 11164 B9R1.84 FC(F)COC1CNC1 Amb20623759 [0,1,0,1,0,0|2,0,0]=4 11165 B9R1.84 FC(F)COC1CNC1 Amb22059193 [0,1,0,1,0,0|2,0,0]=4 11166 B9R1.84 NC(=O)COC1CCC1 Amb24714151 [0,1,0,1,0,0|0,0,2]=4 11167 B9R1.84 NC(=S)COC1CCC1 Amb25266184 [0,1,0,1,0,0|0,1,1]=4 11168 B9R1.84 OC(=O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,1]=4 11169 B9R1.84 OC(=O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|0,0,1]=3 11170 B9R1.84 OC(=O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|1,0,1]=4 11171 B9R1.84 OC(=O)COC1COC1 Amb24539538 [0,1,0,1,0,0|1,0,1]=4 11172 B9R1.84 OC(=O)CSC1CCC1 Amb24439698 [0,1,0,1,0,0|0,1,1]=4 11173 B9R1.85 C=C(Br)COCC1CC1 Amb25047572 [0,1,0,1,0,0|1,0,1]=4 11174 B9R1.85 CC(C)OCCC1CO1 Amb25138542 [0,1,0,1,0,0|2,0,0]=4 11175 B9R1.85 CC(CCNC1CC1)C Amb1113142 [0,1,0,1,0,0|2,0,0]=4 11176 B9R1.85 CC(Cl)CNCC1CC1 Amb24532127 [0,1,0,1,0,0|2,0,0]=4 11177 B9R1.85 CC(N)CCNC1CC1 Amb19007235 [0,1,0,1,0,0|2,0,0]=4 11178 B9R1.85 CC(N)CNCC1CC1 Amb19009744 [0,1,0,1,0,0|2,0,0]=4 11179 B9R1.85 CC(O)C#CCC1CC1 Amb25681407 [0,1,0,1,0,0|1,0,1]=4 11180 B9R1.85 CC(O)CCNC1CC1 Amb24693766 [0,1,0,1,0,0|2,0,0]=4 11181 B9R1.85 CC(O)CSCC1CC1 Amb24524245 [0,1,0,1,0,0|0,1,0]=3 11182 B9R1.85 CS(=O)CCCC1CO1 Amb25284396 [0,1,0,1,0,0|2,0,0]=4 11183 B9R1.85 C[C@@H](N)COCC1CC1 Amb25032162 [0,1,0,1,0,0|1,0,0]=3 11184 B9R1.85 C[C@@H](O)CCNC1CC1 Amb25191935 [0,1,0,1,0,0|2,0,0]=4 11185 B9R1.85 C[C@@H](O)COCC1CC1 Amb24711074 [0,1,0,1,0,0|0,0,0]=2 11186 B9R1.85 C[C@H](N)COCC1CC1 Amb24712175 [0,1,0,1,0,0|1,0,0]=3 11187 B9R1.85 C[C@H](O)CNCC1CC1 Amb25781762 [0,1,0,1,0,0|1,0,0]=3 11188 B9R1.85 ClC(Cl)CNCC1CC1 Amb25128432 [0,1,0,1,0,0|2,0,0]=4 11189 B9R1.85 FC(F)CNCC1CC1 Amb20622636 [0,1,0,1,0,0|2,0,0]=4 11190 B9R1.85 FC(F)COCC1CO1 Amb22008166 [0,1,0,1,0,0|2,0,0]=4 11191 B9R1.85 FC(F)CSCC1CC1 Amb25722869 [0,1,0,1,0,0|1,1,0]=4 11192 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,1,0,1,0,0|0,0,2]=4 11193 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [0,1,0,1,0,0|1,0,1]=4 11194 B9R1.86 C=C(Br)CC1OC1CO Amb25680484 [0,1,0,1,0,0|0,0,2]=4 11195 B9R1.86 C=C(Br)C[C@@H]1O[C@H]1CO Amb25236094 [0,1,0,1,0,0|0,0,2]=4 11196 B9R1.86 C=C(Br)C[C@H]1O[C@H]1CO Amb25236108 [0,1,0,1,0,0|0,0,2]=4 11197 B9R1.86 CC(=C)CC1OC1CO Amb24430852 [0,1,0,1,0,0|0,0,1]=3 11198 B9R1.86 CC(=C)C[C@@H]1O[C@H]1CCl Amb24617362 [0,1,0,1,0,0|1,0,1]=4 11199 B9R1.86 CC(C)CC1CC1CN Amb18302671 [0,1,0,1,0,0|2,0,0]=4 11200 B9R1.86 CC(C)CC1CC1CO Amb25756770 [0,1,0,1,0,0|1,0,0]=3 11201 B9R1.86 CC(C)C[C@H]1O[C@H]1CO Amb24620586 [0,1,0,1,0,0|0,0,0]=2 11202 B9R1.86 CC(O)CC1CC1CC Amb24356232 [0,1,0,1,0,0|1,0,0]=3 11203 B9R1.86 CC(O)CC1OC1C=C Amb24528310 [0,1,0,1,0,0|1,0,1]=4 11204 B9R1.86 CN(C)C[C@@H]1C[C@@H]1CO Amb25219230 [0,1,0,1,0,0|2,0,0]=4 11205 B9R1.86 C[C@@H](O)CC1OC1C=C Amb24363576 [0,1,0,1,0,0|1,0,1]=4 11206 B9R1.86 C[C@@H](O)C[C@@H]1C[C@@H]1CC Amb25204804 [0,1,0,1,0,0|1,0,0]=3 11207 B9R1.86 C[C@@H](O)C[C@@H]1O[C@@H]1C=O Amb24515298 [0,1,0,1,0,0|0,0,2]=4 11208 B9R1.86 C[C@@H](O)C[C@H]1O[C@@H]1C=C Amb24519496 [0,1,0,1,0,0|1,0,1]=4 11209 B9R1.86 C[C@@H](O)C[C@H]1O[C@H]1C=C Amb25221451 [0,1,0,1,0,0|1,0,1]=4 11210 B9R1.86 C[C@H](O)C[C@@H]1O[C@H]1C=C Amb24733093 [0,1,0,1,0,0|1,0,1]=4 11211 B9R1.86 C[C@H](O)C[C@H]1O[C@H]1C=C Amb25176992 [0,1,0,1,0,0|1,0,1]=4 11212 B9R1.96 CC(C)C1CCC1CN Amb25213009 [0,1,0,1,0,0|2,0,0]=4 11213 B9R1.96 CC(C)N1CCC1CO Amb25163353 [0,1,0,1,0,0|2,0,0]=4 11214 B9R1.96 CC(O)C1C=CC1CO Amb25311479 [0,1,0,1,0,0|1,0,1]=4 11215 B9R1.96 CCC1CCC1C(O)=O Amb25727014 [0,1,0,1,0,0|1,0,1]=4 11216 B9R1.96 CN(C)C1CCC1CO Amb25783398 [0,1,0,1,0,0|2,0,0]=4 11217 B9R1.96 C[C@H](O)[C@@H]1C=C[C@@H]1CO Amb25261905 [0,1,0,1,0,0|1,0,1]=4 11218 B9R1.96 OCC1CCC1C(F)F Amb25253042 [0,1,0,1,0,0|2,0,0]=4 11219 B9R1.148 CC1(C)CCCCCN1 Amb18832660 [0,1,0,1,0,0|2,0,0]=4 11220 B9R1.148 CC1(C)CCCNCC1 Amb18832664 [0,1,0,1,0,0|2,0,0]=4 11221 B9R1.148 CC1(C)CCNCCO1 Amb23585285 [0,1,0,1,0,0|1,0,0]=3 11222 B9R1.148 CC1(C)CCNCCS1 Amb22642029 [0,1,0,1,0,0|1,1,0]=4 11223 B9R1.148 CC1(C)CCOCCN1 Amb24449809 [0,1,0,1,0,0|1,0,0]=3 11224 B9R1.148 CC1(C)CNCCCC1 Amb24611736 [0,1,0,1,0,0|2,0,0]=4 11225 B9R1.148 CC1(C)CNCCCO1 Amb19374211 [0,1,0,1,0,0|2,0,0]=4 11226 B9R1.148 CC1(F)CCCNCC1 Amb22886292 [0,1,0,1,0,0|2,0,0]=4 11227 B9R1.148 CC1(F)CNCCCC1 Amb22886308 [0,1,0,1,0,0|2,0,0]=4 11228 B9R1.148 CC1(F)CNCCCC1 Amb24672176 [0,1,0,1,0,0|2,0,0]=4 11229 B9R1.148 CC1(F)CNCCOC1 Amb22886366 [0,1,0,1,0,0|2,0,0]=4 11230 B9R1.148 CC1(N)CCCCCC1 Amb13952349 [0,1,0,1,0,0|2,0,0]=4 11231 B9R1.148 CC1(O)CCCNCC1 Amb19516809 [0,1,0,1,0,0|2,0,0]=4 11232 B9R1.148 CC1(O)CCCNCC1 Amb22886914 [0,1,0,1,0,0|2,0,0]=4 11233 B9R1.148 CC1(O)CCCOCC1 Amb20669018 [0,1,0,1,0,0|1,0,0]=3 11234 B9R1.148 CC1(O)CNCCCC1 Amb22886278 [0,1,0,1,0,0|1,0,0]=3 11235 B9R1.148 CC1(O)CNCCOC1 Amb22886368 [0,1,0,1,0,0|1,0,0]=3 11236 B9R1.148 FC1(F)CNCCCC1 Amb22886425 [0,1,0,1,0,0|2,0,0]=4 11237 B9R1.148 FC1(F)CNCCOC1 Amb22886689 [0,1,0,1,0,0|2,0,0]=4 11238 B9R1.148 NC1(N)CCCCCC1 Amb24427215 [0,1,0,1,0,0|2,0,0]=4 11239 B9R2.24 BrC1C2CCC1CC2 Amb22348296 [0,0,0,2,0,0|2,0,0]=4 11240 B9R2.24 BrC1[C@@H]2CC[C@H]1CC2 Amb16231050 [0,0,0,2,0,0|2,0,0]=4 11241 B9R2.24 BrC1[C@H]2CC[C@@H]1CN2 Amb24763596 [0,0,0,2,0,0|2,0,0]=4 11242 B9R2.24 Br[C@H]1[C@H]2CC[C@@H]1CN2 Amb24519438 [0,0,0,2,0,0|2,0,0]=4 11243 B9R2.24 ClC1[C@@H]2CC[C@H]1CC2 Amb25707320 [0,0,0,2,0,0|2,0,0]=4 11244 B9R2.24 NC1C2CCC1CC2 Amb18641658 [0,0,0,2,0,0|2,0,0]=4 11245 B9R2.24 OC1C2CCC1C=C2 Amb24745608 [0,0,0,2,0,0|1,0,1]=4 11246 B9R2.24 OC1C2COC1CO2 Amb25092004 [0,0,0,2,0,0|1,0,0]=3 11247 B9R2.24 OC1[C@@H]2CC[C@@H]1CC2 Amb25803000 [0,0,0,2,0,0|1,0,0]=3 11248 B9R2.24 OC1[C@@H]2CC[C@H]1C=C2 Amb24690983 [0,0,0,2,0,0|1,0,1]=4 11249 B9R2.24 OC1[C@@H]2CO[C@H]1CO2 Amb24735044 [0,0,0,2,0,0|1,0,0]=3 11250 B9R2.24 OC1[C@H]2CCC1CN2 Amb25282800 [0,0,0,2,0,0|1,0,0]=3 11251 B9R2.24 OC1[C@H]2CO[C@@H]1CO2 Amb24520338 [0,0,0,2,0,0|1,0,0]=3 11252 B9R2.24 O[C@@H]1[C@@H]2CO[C@@H]1CO2 Amb25162787 [0,0,0,2,0,0|1,0,0]=3 11253 B9R2.24 O[C@@H]1[C@H]2CC[C@@H]1C=C2 Amb24454857 [0,0,0,2,0,0|1,0,1]=4 11254 B9R2.47 BrCC1C[C@@H]2C[C@@H]2C1 Amb25711595 [0,0,0,2,0,0|2,0,0]=4 11255 B9R2.47 CC[C@@H]1C[C@H]2C[C@H]2N1 Amb25247181 [0,0,0,2,0,0|2,0,0]=4 11256 B9R2.47 OCC1CC2CC2C1 Amb25809340 [0,0,0,2,0,0|1,0,0]=3 11257 B9R2.47 OCC1C[C@@H]2O[C@@H]2C1 Amb24423370 [0,0,0,2,0,0|2,0,0]=4 11258 B9R2.47 OC[C@@H]1C[C@@H]2O[C@@H]2C1 Amb25854390 [0,0,0,2,0,0|2,0,0]=4 11259 B9R2.47 OC[C@@H]1C[C@H]2C[C@H]2C1 Amb24734520 [0,0,0,2,0,0|1,0,0]=3 11260 B9R2.49 C1CC2CCC1CC2 Amb22230312 [0,0,0,2,0,0|2,0,0]=4 11261 B9R2.49 C1C[C@H]2CC[C@@H]1CC2 Amb25324201 [0,0,0,2,0,0|2,0,0]=4 11262 B9R2.49 C1C[C@H]2CN[C@@H]1CN2 Amb10601644 [0,0,0,2,0,0|2,0,0]=4 11263 B9R2.49 C1NC2CCC1CC2 Amb22728599 [0,0,0,2,0,0|2,0,0]=4 11264 B9R2.49 C1NC2CNC1CC2 Amb22749474 [0,0,0,2,0,0|2,0,0]=4 11265 B9R2.49 C1NC2COC1CC2 Amb22406229 [0,0,0,2,0,0|1,0,0]=3 11266 B9R2.49 C1NC2COC1CC2 Amb22886459 [0,0,0,2,0,0|1,0,0]=3 11267 B9R2.49 C1NC2COC1CC2 Amb24120395 [0,0,0,2,0,0|1,0,0]=3 11268 B9R2.49 C1N[C@@H]2CC[C@H]1CC2 Amb24053071 [0,0,0,2,0,0|2,0,0]=4 11269 B9R2.49 C1N[C@@H]2CO[C@H]1CC2 Amb25366415 [0,0,0,2,0,0|1,0,0]=3 11270 B9R2.49 C1OC2CNC1CC2 Amb23440292 [0,0,0,2,0,0|1,0,0]=3 11271 B9R2.50 C1NC2CCCOC21 Amb24618174 [0,0,0,2,0,0|1,0,0]=3 11272 B9R2.50 C1NC2CNCCC21 Amb23555780 [0,0,0,2,0,0|2,0,0]=4 11273 B9R2.50 C1NCCC2OCC21 Amb23597836 [0,0,0,2,0,0|2,0,0]=4 11274 B9R2.50 C1NCCN2CCC21 Amb22011778 [0,0,0,2,0,0|2,0,0]=4 11275 B9R2.50 C1N[C@@H]2CCCC[C@@H]21 Amb25168918 [0,0,0,2,0,0|2,0,0]=4 11276 B9R2.50 C1N[C@H]2CCCC[C@H]21 Amb24610209 [0,0,0,2,0,0|2,0,0]=4 11277 B9R2.50 C1OC2CNCCC21 Amb23597837 [0,0,0,2,0,0|1,0,0]=3 11278 B9R2.53 CC1C2CNCC1C2 Amb24523152 [0,0,0,2,0,0|2,0,0]=4 11279 B9R2.53 NC1C2CC1CCC2 Amb24482176 [0,0,0,2,0,0|2,0,0]=4 11280 B9R2.53 N[C@@H]1[C@H]2C[C@@H]1CCC2 Amb24435064 [0,0,0,2,0,0|2,0,0]=4 11281 B9R2.53 OC1C2CC1CC=C2 Amb25242033 [0,0,0,2,0,0|1,0,1]=4 11282 B9R2.53 OC1C2CC1CCC2 Amb24340191 [0,0,0,2,0,0|1,0,0]=3 11283 B9R2.53 OC1C2CNCC1C2 Amb19148665 [0,0,0,2,0,0|2,0,0]=4 11284 B9R2.53 OC1C2CNCC1C2 Amb22899728 [0,0,0,2,0,0|2,0,0]=4 11285 B9R2.53 OC1[C@@H]2CNC[C@H]1C2 Amb25796611 [0,0,0,2,0,0|2,0,0]=4 11286 B9R2.53 O[C@@H]1[C@@H]2C[C@H]1CCC2 Amb24355233 [0,0,0,2,0,0|1,0,0]=3 11287 B9R2.53 O[C@@H]1[C@H]2C[C@@H]1CCC2 Amb25234733 [0,0,0,2,0,0|1,0,0]=3 11288 B9R2.56 NCC12CC1CCO2 Amb24447387 [0,0,0,2,0,0|1,0,0]=3 11289 B9R2.56 NCC12COCC1C2 Amb24555663 [0,0,0,2,0,0|2,0,0]=4 11290 B9R2.56 O=CC12CC1CCO2 Amb25173847 [0,0,0,2,0,0|0,0,2]=4 11291 B9R2.56 OCC12CC1CC=C2 Amb24718628 [0,0,0,2,0,0|1,0,1]=4 11292 B9R2.56 OCC12CC1CCN2 Amb18278269 [0,0,0,2,0,0|1,0,0]=3 11293 B9R2.56 OCC12CNCC1C2 Amb23440140 [0,0,0,2,0,0|2,0,0]=4 11294 B9R2.56 OCC12CNCC1C2 Amb23440141 [0,0,0,2,0,0|2,0,0]=4 11295 B9R2.56 OCC12COCC1C2 Amb25847035 [0,0,0,2,0,0|2,0,0]=4 11296 B9R2.56 OC[C@@]12CNCC1C2 Amb25082830 [0,0,0,2,0,0|2,0,0]=4 11297 B9R2.56 OC[C@@]12CNC[C@@H]1C2 Amb22757897 [0,0,0,2,0,0|2,0,0]=4 11298 B9R2.56 OC[C@@]12C[C@@H]1CC=C2 Amb24514627 [0,0,0,2,0,0|1,0,1]=4 11299 B9R2.56 OC[C@@]12C[C@H]1CCN2 Amb19372684 [0,0,0,2,0,0|1,0,0]=3 11300 B9R2.56 OC[C@]12CCC[C@H]1O2 Amb24687963 [0,0,0,2,0,0|0,0,0]=2 11301 B9R2.57 NCC12CCC1CC2 Amb24569375 [0,0,0,2,0,0|2,0,0]=4 11302 B9R2.57 NC[C@@]12CC[C@@H]1CC2 Amb25365386 [0,0,0,2,0,0|2,0,0]=4 11303 B9R2.57 OCC12CCC1CC2 Amb24593914 [0,0,0,2,0,0|1,0,0]=3 11304 B9R2.57 OC[C@@]12CC[C@@H]1CC2 Amb24457795 [0,0,0,2,0,0|1,0,0]=3 11305 B9R2.65 BrCC1C2CCCC21 Amb25060211 [0,0,0,2,0,0|2,0,0]=4 11306 B9R2.65 CNC1[C@@H]2OCC[C@@H]21 Amb24667930 [0,0,0,2,0,0|2,0,0]=4 11307 B9R2.65 ClCC1C2CCCC21 Amb24563592 [0,0,0,2,0,0|2,0,0]=4 11308 B9R2.65 NCC1C2OCCC21 Amb23449251 [0,0,0,2,0,0|2,0,0]=4 11309 B9R2.65 OCC1C2CNCC21 Amb24112955 [0,0,0,2,0,0|2,0,0]=4 11310 B9R2.65 OCC1C2CNCC21 Amb24183585 [0,0,0,2,0,0|2,0,0]=4 11311 B9R2.65 OCC1C2OCCC21 Amb23448843 [0,0,0,2,0,0|2,0,0]=4 11312 B9R2.65 OCC1[C@@H]2CNC[C@@H]21 Amb22745856 [0,0,0,2,0,0|2,0,0]=4 11313 B9R2.65 OC[C@@H]1[C@@H]2COC[C@@H]21 Amb23439355 [0,0,0,2,0,0|2,0,0]=4 11314 B9R2.65 OC[C@@H]1[C@H]2SCC[C@H]21 Amb24733319 [0,0,0,2,0,0|2,0,0]=4 11315 B9R2.68 C1C2CCC1CCN2 Amb18641674 [0,0,0,2,0,0|2,0,0]=4 11316 B9R2.68 C1C2CCN1CCN2 Amb22586692 [0,0,0,2,0,0|2,0,0]=4 11317 B9R2.68 C1CC2CCC(C1)N2 Amb10610725 [0,0,0,2,0,0|2,0,0]=4 11318 B9R2.68 C1CCC2CCC1N2 Amb19374849 [0,0,0,2,0,0|2,0,0]=4 11319 B9R2.68 C1CCC2CCC1O2 Amb22364980 [0,0,0,2,0,0|1,0,0]=3 11320 B9R2.68 C1CC[C@@H]2CC[C@@H]1N2 Amb22405871 [0,0,0,2,0,0|2,0,0]=4 11321 B9R2.68 C1CC[C@H]2CC[C@@H]1N2 Amb22735874 [0,0,0,2,0,0|2,0,0]=4 11322 B9R2.68 C1NC2CNCC1O2 Amb25051730 [0,0,0,2,0,0|2,0,0]=4 11323 B9R2.68 C1NCC2CC1CC2 Amb18124234 [0,0,0,2,0,0|2,0,0]=4 11324 B9R2.68 C1NCC2CC1CO2 Amb19515653 [0,0,0,2,0,0|2,0,0]=4 11325 B9R2.68 C1NCC2CCC1N2 Amb18641717 [0,0,0,2,0,0|2,0,0]=4 11326 B9R2.68 C1NCC2CCC1N2 Amb20171180 [0,0,0,2,0,0|2,0,0]=4 11327 B9R2.68 C1NC[C@@H]2C[C@@H]1CC2 Amb24684930 [0,0,0,2,0,0|2,0,0]=4 11328 B9R2.68 C1NC[C@@H]2C[C@H]1CC2 Amb22757909 [0,0,0,2,0,0|2,0,0]=4 11329 B9R2.68 C1NC[C@H]2CC[C@@H]1N2 Amb25726184 [0,0,0,2,0,0|2,0,0]=4 11330 B9R2.68 C1NC[C@H]2CC[C@@H]1O2 Amb24477891 [0,0,0,2,0,0|1,0,0]=3 11331 B9R2.68 C1NC[C@H]2C[C@@H]1CC2 Amb24392297 [0,0,0,2,0,0|2,0,0]=4 11332 B9R2.68 C1N[C@@H]2C[C@H]1CCC2 Amb23385228 [0,0,0,2,0,0|2,0,0]=4 11333 B9R2.68 C1N[C@H]2C[C@@H]1CCC2 Amb24606188 [0,0,0,2,0,0|2,0,0]=4 11334 B9R2.68 C1OCC2CCC1N2 Amb19516231 [0,0,0,2,0,0|1,0,0]=3 11335 B9R2.68 C1OCC2CCC1N2 Amb22899993 [0,0,0,2,0,0|1,0,0]=3 11336 B9R2.68 C1OC[C@@H]2CC[C@H]1N2 Amb22756624 [0,0,0,2,0,0|1,0,0]=3 11337 B9R2.68 C1OC[C@H]2CC[C@@H]1N2 Amb22224855 [0,0,0,2,0,0|1,0,0]=3 11338 B9R2.68 C1ON2CC1CCC2 Amb24333259 [0,0,0,2,0,0|2,0,0]=4 11339 B9R2.68 C1ON2C[C@@H]1CCC2 Amb25760706 [0,0,0,2,0,0|2,0,0]=4 11340 B9R2.68 C1[C@@H]2CCCN1CC2 Amb25046164 [0,0,0,2,0,0|2,0,0]=4 11341 B9R2.68 C1[C@@H]2CCN1CCN2 Amb24575184 [0,0,0,2,0,0|2,0,0]=4 11342 B9R2.68 C1[C@@H]2CC[C@H]1CCN2 Amb24738443 [0,0,0,2,0,0|2,0,0]=4 11343 B9R2.68 C1[C@H]2CCN1CCN2 Amb22432488 [0,0,0,2,0,0|2,0,0]=4 11344 B9R2.68 N1CC2CCC(C1)C2 Amb10608778 [0,0,0,2,0,0|2,0,0]=4 11345 B9R2.68 N1CC2CCC(C1)O2 Amb16231394 [0,0,0,2,0,0|1,0,0]=3 11346 B9R2.68 N1C[C@@H]2CC[C@H](C1)O2 Amb13783695 [0,0,0,2,0,0|1,0,0]=3 11347 B9R2.68 O1CC2CCC(C1)N2 Amb13783963 [0,0,0,2,0,0|1,0,0]=3 11348 B9R2.70 ClC[C@@H]1CC[C@@H]2C[C@@H]21 Amb24715946 [0,0,0,2,0,0|2,0,0]=4 11349 B9R2.70 ClC[C@H]1CC[C@@H]2C[C@@H]21 Amb25302332 [0,0,0,2,0,0|2,0,0]=4 11350 B9R2.70 FCC1NCC2CC21 Amb25201801 [0,0,0,2,0,0|2,0,0]=4 11351 B9R2.70 O=CC1OCC2OC12 Amb24722037 [0,0,0,2,0,0|1,0,1]=4 11352 B9R2.70 O=C[C@H]1OC[C@H]2O[C@@H]12 Amb25272531 [0,0,0,2,0,0|1,0,1]=4 11353 B9R2.70 OC[C@@H]1CC[C@@H]2O[C@@H]21 Amb25206596 [0,0,0,2,0,0|2,0,0]=4 11354 B9R2.70 OC[C@@H]1NC[C@@H]2C[C@@H]21 Amb23439459 [0,0,0,2,0,0|1,0,0]=3 11355 B9R2.70 OC[C@@H]1NC[C@H]2C[C@H]21 Amb25235945 [0,0,0,2,0,0|1,0,0]=3 11356 B9R2.70 OC[C@@H]1NC[C@H]2[C@@H]1C2 Amb13886216 [0,0,0,2,0,0|1,0,0]=3 11357 B9R2.70 OC[C@H]1NC[C@H]2C[C@H]21 Amb24519421 [0,0,0,2,0,0|1,0,0]=3 11358 B9R2.70 OC[C@H]1OC[C@@H]2C[C@@H]21 Amb25175209 [0,0,0,2,0,0|0,0,0]=2 11359 B9R2.123 BrC1C2CCCCC21 Amb22001016 [0,0,0,2,0,0|2,0,0]=4 11360 B9R2.123 Br[C@@H]1[C@@H]2CCOC[C@@H]21 Amb25361078 [0,0,0,2,0,0|2,0,0]=4 11361 B9R2.123 Br[C@@H]1[C@H]2CCCC[C@H]21 Amb25279388 [0,0,0,2,0,0|2,0,0]=4 11362 B9R2.123 Br[C@H]1[C@@H]2CCOC[C@@H]21 Amb25241529 [0,0,0,2,0,0|2,0,0]=4 11363 B9R2.123 CC1C2CCCCC21 Amb22365158 [0,0,0,2,0,0|2,0,0]=4 11364 B9R2.123 ClC1C2CCCCC21 Amb25337704 [0,0,0,2,0,0|2,0,0]=4 11365 B9R2.123 ClC1C2OCCOC21 Amb25276157 [0,0,0,2,0,0|1,0,0]=3 11366 B9R2.123 ClC1[C@H]2CCCC[C@H]21 Amb24483271 [0,0,0,2,0,0|2,0,0]=4 11367 B9R2.123 Cl[C@@H]1[C@H]2CCCC[C@H]21 Amb24440860 [0,0,0,2,0,0|2,0,0]=4 11368 B9R2.123 Cl[C@@H]1[C@H]2OCCC[C@H]21 Amb25227457 [0,0,0,2,0,0|1,0,0]=3 11369 B9R2.123 NC1C2CCCCC21 Amb20623881 [0,0,0,2,0,0|2,0,0]=4 11370 B9R2.123 NC1C2CCOCC21 Amb23538735 [0,0,0,2,0,0|2,0,0]=4 11371 B9R2.123 NC1C2NCCCC21 Amb18833089 [0,0,0,2,0,0|2,0,0]=4 11372 B9R2.123 NC1C2OCCCC21 Amb19372862 [0,0,0,2,0,0|1,0,0]=3 11373 B9R2.123 NC1C2OCCOC21 Amb25270649 [0,0,0,2,0,0|1,0,0]=3 11374 B9R2.123 NC1C2SCCCC21 Amb25264967 [0,0,0,2,0,0|1,1,0]=4 11375 B9R2.123 N[C@@H]1[C@@H]2CCCC[C@@H]21 Amb25117564 [0,0,0,2,0,0|2,0,0]=4 11376 B9R2.123 N[C@@H]1[C@H]2CCCC[C@H]21 Amb25113495 [0,0,0,2,0,0|2,0,0]=4 11377 B9R2.123 OC1C2C1CCCC2 Amb17593167 [0,0,0,2,0,0|1,0,0]=3 11378 B9R2.123 OC1C2C=CCCC21 Amb25686162 [0,0,0,2,0,0|1,0,1]=4 11379 B9R2.123 O[C@@H]1[C@@H]2CCCC[C@@H]21 Amb24543995 [0,0,0,2,0,0|1,0,0]=3 11380 B9R2.123 O[C@@H]1[C@H]2CCCC[C@H]21 Amb25042742 [0,0,0,2,0,0|1,0,0]=3 11381 B9R2.174 C1CC12CCCCC2 Amb22231454 [0,0,0,2,0,0|2,0,0]=4 11382 B9R2.174 C1CC12CCCCN2 Amb22586669 [0,0,0,2,0,0|2,0,0]=4 11383 B9R2.174 C1CCC2(NC1)CC2 Amb10607947 [0,0,0,2,0,0|2,0,0]=4 11384 B9R2.174 C1NC12CCCCC2 Amb24117848 [0,0,0,2,0,0|2,0,0]=4 11385 B9R2.174 C1NCCCC12CC2 Amb18833098 [0,0,0,2,0,0|2,0,0]=4 11386 B9R2.174 C1NCCCC12CC2 Amb22754138 [0,0,0,2,0,0|2,0,0]=4 11387 B9R2.174 C1NCCCC12CO2 Amb25142385 [0,0,0,2,0,0|2,0,0]=4 11388 B9R2.174 C1NCCNC12CC2 Amb18203373 [0,0,0,2,0,0|2,0,0]=4 11389 B9R2.174 C1NCCNC12CC2 Amb21962062 [0,0,0,2,0,0|2,0,0]=4 11390 B9R2.174 C1NCCNC12CC2 Amb22406081 [0,0,0,2,0,0|2,0,0]=4 11391 B9R2.174 C1NCCOC12CC2 Amb22233784 [0,0,0,2,0,0|1,0,0]=3 11392 B9R2.174 C1NCCOC12CC2 Amb22284759 [0,0,0,2,0,0|1,0,0]=3 11393 B9R2.174 C1OC12CCSCC2 Amb22896493 [0,0,0,2,0,0|2,0,0]=4 11394 B9R2.174 C1OCCNC12CC2 Amb22752817 [0,0,0,2,0,0|1,0,0]=3 11395 B9R2.174 C1OCCNC12CC2 Amb23598562 [0,0,0,2,0,0|1,0,0]=3 11396 B9R2.174 O1CCC2(CC1)CO2 Amb10976057 [0,0,0,2,0,0|2,0,0]=4 11397 B9R2.6 CC12CC1CNCC2 Amb24183542 [0,0,0,2,0,0|2,0,0]=4 11398 B9R2.6 CC12CC1CNCC2 Amb25338129 [0,0,0,2,0,0|2,0,0]=4 11399 B9R2.6 CC12CC=CCC1O2 Amb22365024 [0,0,0,2,0,0|1,0,1]=4 11400 B9R2.6 CC12CCCCC1O2 Amb17939278 [0,0,0,2,0,0|1,0,0]=3 11401 B9R2.6 CC12COCCC1O2 Amb24061740 [0,0,0,2,0,0|2,0,0]=4 11402 B9R2.6 CC12OC1CCCO2 Amb25348648 [0,0,0,2,0,0|2,0,0]=4 11403 B9R2.6 C[C@]12CCOC[C@H]1O2 Amb24589232 [0,0,0,2,0,0|0,0,0]=2 11404 B9R2.6 NC12CC1CCCC2 Amb25137276 [0,0,0,2,0,0|2,0,0]=4 11405 B9R2.6 OC12CC1CNCC2 Amb19149081 [0,0,0,2,0,0|2,0,0]=4 11406 B9R2.6 OC12CNCCC1C2 Amb19148517 [0,0,0,2,0,0|1,0,0]=3 11407 B9R2.6 OC12CNCCC1C2 Amb20669515 [0,0,0,2,0,0|1,0,0]=3 11408 B9R2.6 O[C@@]12CNCC[C@@H]1C2 Amb24550647 [0,0,0,2,0,0|1,0,0]=3 11409 B9R2.17 C[C@@]12C[C@@H]1CC[C@H]2O Amb25226334 [0,0,0,2,0,0|1,0,0]=3 11410 B9R2.17 C[C@@]12O[C@@H]1CC[C@H]2O Amb24622986 [0,0,0,2,0,0|2,0,0]=4 11411 B9R2.19 O[C@@H]1C=C[C@H]2C[C@@H]1C2 Amb25226049 [0,0,0,2,0,0|1,0,1]=4 11412 B9R2.37 CC1C(O)CC2CC21 Amb24529293 [0,0,0,2,0,0|1,0,0]=3 11413 B9R2.37 C[C@@H]1[C@@H](O)C[C@H]2O[C@H]21 Amb24688268 [0,0,0,2,0,0|2,0,0]=4 11414 B9R2.37 NC1CC2CC2C1O Amb25195550 [0,0,0,2,0,0|2,0,0]=4 11415 B9R2.37 OC1C2OC2CC1O Amb24583675 [0,0,0,2,0,0|1,0,0]=3 11416 B9R2.39 BrC1CC2CCC1O2 Amb25685922 [0,0,0,2,0,0|2,0,0]=4 11417 B9R2.39 BrC1C[C@@H]2C[C@H]1CC2 Amb24598753 [0,0,0,2,0,0|2,0,0]=4 11418 B9R2.39 Br[C@@H]1CC2CC1CC2 Amb22800320 [0,0,0,2,0,0|2,0,0]=4 11419 B9R2.39 Br[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb24512105 [0,0,0,2,0,0|2,0,0]=4 11420 B9R2.39 Br[C@H]1CC2CC1CC2 Amb22337809 [0,0,0,2,0,0|2,0,0]=4 11421 B9R2.39 Br[C@H]1C[C@@H]2C[C@H]1CC2 Amb25259275 [0,0,0,2,0,0|2,0,0]=4 11422 B9R2.39 Br[C@H]1C[C@H]2C[C@@H]1CC2 Amb25378969 [0,0,0,2,0,0|2,0,0]=4 11423 B9R2.39 C[C@@H]1CN2CC[C@@H]1O2 Amb24574991 [0,0,0,2,0,0|2,0,0]=4 11424 B9R2.39 C[C@H]1C[C@@H]2CC[C@H]1O2 Amb24586711 [0,0,0,2,0,0|1,0,0]=3 11425 B9R2.39 ClC1CC2CC1CC2 Amb22360712 [0,0,0,2,0,0|2,0,0]=4 11426 B9R2.39 ClC1CC2CCC1O2 Amb24481548 [0,0,0,2,0,0|2,0,0]=4 11427 B9R2.39 ClC1C[C@@H]2C[C@H]1CC2 Amb24655099 [0,0,0,2,0,0|2,0,0]=4 11428 B9R2.39 Cl[C@@H]1CC2CC1CC2 Amb25721561 [0,0,0,2,0,0|2,0,0]=4 11429 B9R2.39 Cl[C@@H]1CC2C[C@H]1CC2 Amb22801514 [0,0,0,2,0,0|2,0,0]=4 11430 B9R2.39 Cl[C@@H]1C[C@H]2C[C@@H]1CC2 Amb24616847 [0,0,0,2,0,0|2,0,0]=4 11431 B9R2.39 Cl[C@H]1CC2CC1CC2 Amb24398324 [0,0,0,2,0,0|2,0,0]=4 11432 B9R2.39 Cl[C@H]1C[C@@H]2CC[C@H]1O2 Amb24513730 [0,0,0,2,0,0|2,0,0]=4 11433 B9R2.39 Cl[C@H]1C[C@H]2C[C@@H]1CC2 Amb24565762 [0,0,0,2,0,0|2,0,0]=4 11434 B9R2.39 NC1CC2CC1CC2 Amb10607816 [0,0,0,2,0,0|2,0,0]=4 11435 B9R2.39 NC1CC2CC1CC2 Amb19374620 [0,0,0,2,0,0|2,0,0]=4 11436 B9R2.39 NC1CC2CCC1O2 Amb18833071 [0,0,0,2,0,0|2,0,0]=4 11437 B9R2.39 NC1CN2CC1CC2 Amb22831595 [0,0,0,2,0,0|2,0,0]=4 11438 B9R2.39 NC1C[C@H]2C[C@@H]1CC2 Amb25260433 [0,0,0,2,0,0|2,0,0]=4 11439 B9R2.39 N[C@@H]1CN2CC1CC2 Amb20623302 [0,0,0,2,0,0|2,0,0]=4 11440 B9R2.39 N[C@@H]1CN2C[C@@H]1CC2 Amb25367624 [0,0,0,2,0,0|2,0,0]=4 11441 B9R2.39 N[C@@H]1CN2C[C@H]1CC2 Amb22747500 [0,0,0,2,0,0|2,0,0]=4 11442 B9R2.39 N[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25338378 [0,0,0,2,0,0|2,0,0]=4 11443 B9R2.39 N[C@@H]1C[C@@H]2C[C@H]1CC2 Amb24181889 [0,0,0,2,0,0|2,0,0]=4 11444 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1O2 Amb19515250 [0,0,0,2,0,0|2,0,0]=4 11445 B9R2.39 N[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22745923 [0,0,0,2,0,0|2,0,0]=4 11446 B9R2.39 N[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22757963 [0,0,0,2,0,0|2,0,0]=4 11447 B9R2.39 N[C@@H]1C[C@H]2C[C@H]1CC2 Amb25219162 [0,0,0,2,0,0|2,0,0]=4 11448 B9R2.39 N[C@H]1CC2CCC1O2 Amb19149282 [0,0,0,2,0,0|2,0,0]=4 11449 B9R2.39 N[C@H]1CC2C[C@H]1CC2 Amb25305786 [0,0,0,2,0,0|2,0,0]=4 11450 B9R2.39 N[C@H]1CN2C[C@@H]1CC2 Amb24604315 [0,0,0,2,0,0|2,0,0]=4 11451 B9R2.39 OC1CC2CC1CO2 Amb25265659 [0,0,0,2,0,0|2,0,0]=4 11452 B9R2.39 OC1CC2CC1CS2 Amb25332994 [0,0,0,2,0,0|2,0,0]=4 11453 B9R2.39 OC1CC2CCC1N2 Amb24482057 [0,0,0,2,0,0|2,0,0]=4 11454 B9R2.39 OC1CC2COC1C2 Amb25241390 [0,0,0,2,0,0|2,0,0]=4 11455 B9R2.39 OC1CC2CSC1C2 Amb25143187 [0,0,0,2,0,0|2,0,0]=4 11456 B9R2.39 OC1CN2CC1CC2 Amb20623296 [0,0,0,2,0,0|1,0,0]=3 11457 B9R2.39 OC1C[C@@H]2C[C@H]1CC2 Amb24556818 [0,0,0,2,0,0|1,0,0]=3 11458 B9R2.39 ON1CC2CC1CC2 Amb25376585 [0,0,0,2,0,0|2,0,0]=4 11459 B9R2.39 O[C@@H]1CC2CC1CC2 Amb22363271 [0,0,0,2,0,0|1,0,0]=3 11460 B9R2.39 O[C@@H]1CC2C[C@H]1CC2 Amb25266771 [0,0,0,2,0,0|1,0,0]=3 11461 B9R2.39 O[C@@H]1CN2CC1CC2 Amb20623303 [0,0,0,2,0,0|1,0,0]=3 11462 B9R2.39 O[C@@H]1CN2C[C@@H]1CC2 Amb25025128 [0,0,0,2,0,0|1,0,0]=3 11463 B9R2.39 O[C@@H]1CN2C[C@H]1CC2 Amb24553840 [0,0,0,2,0,0|1,0,0]=3 11464 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb25222600 [0,0,0,2,0,0|2,0,0]=4 11465 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23439253 [0,0,0,2,0,0|2,0,0]=4 11466 B9R2.39 O[C@@H]1C[C@@H]2CS[C@@H]1C2 Amb24734261 [0,0,0,2,0,0|2,0,0]=4 11467 B9R2.39 O[C@@H]1C[C@@H]2C[C@@H]1CC2 Amb25176323 [0,0,0,2,0,0|1,0,0]=3 11468 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CC2 Amb10844941 [0,0,0,2,0,0|1,0,0]=3 11469 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 Amb24682880 [0,0,0,2,0,0|2,0,0]=4 11470 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23439252 [0,0,0,2,0,0|2,0,0]=4 11471 B9R2.39 O[C@@H]1C[C@H]2CO[C@H]1C2 Amb24748508 [0,0,0,2,0,0|2,0,0]=4 11472 B9R2.39 O[C@@H]1C[C@H]2CS[C@@H]1C2 Amb24641541 [0,0,0,2,0,0|2,0,0]=4 11473 B9R2.39 O[C@@H]1C[C@H]2C[C@@H]1CC2 Amb22744882 [0,0,0,2,0,0|1,0,0]=3 11474 B9R2.39 O[C@H]1CC2CC1CC2 Amb25759926 [0,0,0,2,0,0|1,0,0]=3 11475 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1O2 Amb25332128 [0,0,0,2,0,0|2,0,0]=4 11476 B9R2.39 O[C@H]1C[C@@H]2C[C@@H]1CC2 Amb25204244 [0,0,0,2,0,0|1,0,0]=3 11477 B9R2.39 O[C@H]1C[C@H]2CC[C@@H]1N2 Amb24621843 [0,0,0,2,0,0|2,0,0]=4 11478 B9R2.39 O[C@H]1C[C@H]2C[C@@H]1CC2 Amb24567063 [0,0,0,2,0,0|1,0,0]=3 11479 B9R2.39 SC1CC2CC1CC2 Amb25359572 [0,0,0,2,0,0|1,1,0]=4 11480 B9R2.109 BrC1CCCC2OC21 Amb24382388 [0,0,0,2,0,0|1,0,0]=3 11481 B9R2.109 Br[C@@H]1CCC[C@@H]2O[C@@H]21 Amb24513538 [0,0,0,2,0,0|1,0,0]=3 11482 B9R2.109 Br[C@@H]1CCC[C@H]2O[C@H]21 Amb25238295 [0,0,0,2,0,0|1,0,0]=3 11483 B9R2.109 CN1CCOC2CC12 Amb24403460 [0,0,0,2,0,0|2,0,0]=4 11484 B9R2.109 ClC1CCCC2OC21 Amb25189940 [0,0,0,2,0,0|1,0,0]=3 11485 B9R2.109 Cl[C@@H]1CCC[C@H]2C[C@H]21 Amb25347145 [0,0,0,2,0,0|2,0,0]=4 11486 B9R2.109 Cl[C@H]1CCC[C@H]2C[C@H]21 Amb25272786 [0,0,0,2,0,0|2,0,0]=4 11487 B9R2.109 Cl[C@H]1CCC[C@H]2O[C@H]21 Amb25238302 [0,0,0,2,0,0|1,0,0]=3 11488 B9R2.109 FC1CNCC2CC21 Amb25326678 [0,0,0,2,0,0|2,0,0]=4 11489 B9R2.109 NC1CCCC2CC21 Amb19375082 [0,0,0,2,0,0|2,0,0]=4 11490 B9R2.109 NC1CCCC2OC21 Amb24426732 [0,0,0,2,0,0|1,0,0]=3 11491 B9R2.109 N[C@@H]1CCC[C@H]2C[C@H]21 Amb24516528 [0,0,0,2,0,0|2,0,0]=4 11492 B9R2.109 O=C1CCCC2OC12 Amb20671097 [0,0,0,2,0,0|0,0,2]=4 11493 B9R2.109 O=C1CCC[C@@H]2O[C@@H]12 Amb25373140 [0,0,0,2,0,0|0,0,2]=4 11494 B9R2.109 O=C1CCC[C@@H]2O[C@H]12 Amb24631684 [0,0,0,2,0,0|0,0,2]=4 11495 B9R2.109 O=C1CCC[C@H]2O[C@@H]12 Amb25252262 [0,0,0,2,0,0|0,0,2]=4 11496 B9R2.109 OC1C=CCC2OC21 Amb25745315 [0,0,0,2,0,0|0,0,2]=4 11497 B9R2.109 OC1CC=CC2CC21 Amb24748209 [0,0,0,2,0,0|1,0,1]=4 11498 B9R2.109 OC1CC=CC2OC21 Amb24690473 [0,0,0,2,0,0|0,0,2]=4 11499 B9R2.109 OC1CCC[C@H]2O[C@@H]21 Amb25261824 [0,0,0,2,0,0|0,0,0]=2 11500 B9R2.109 OC1CCC[C@H]2O[C@H]21 Amb24519679 [0,0,0,2,0,0|0,0,0]=2 11501 B9R2.109 OC1OCC[C@H]2C[C@H]21 Amb24580427 [0,0,0,2,0,0|2,0,0]=4 11502 B9R2.109 O[C@@H]1CCCC2OC21 Amb24370473 [0,0,0,2,0,0|0,0,0]=2 11503 B9R2.109 O[C@@H]1OCC[C@H]2O[C@H]21 Amb25175489 [0,0,0,2,0,0|1,0,0]=3 11504 B9R2.109 O[C@H]1C=CC[C@@H]2O[C@@H]21 Amb24576977 [0,0,0,2,0,0|0,0,2]=4 11505 B9R2.109 O[C@H]1C=CC[C@H]2O[C@H]21 Amb24644540 [0,0,0,2,0,0|0,0,2]=4 11506 B9R2.109 O[C@H]1CC=C[C@@H]2O[C@@H]21 Amb24620822 [0,0,0,2,0,0|0,0,2]=4 11507 B9R2.109 O[C@H]1CC=C[C@H]2O[C@H]21 Amb25239366 [0,0,0,2,0,0|0,0,2]=4 11508 B9R2.109 O[C@H]1CCCC2C[C@H]21 Amb25175056 [0,0,0,2,0,0|1,0,0]=3 11509 B9R2.109 O[C@H]1CCCC2OC21 Amb25098633 [0,0,0,2,0,0|0,0,0]=2 11510 B9R2.1 NC1CC12CCCC2 Amb17605510 [0,0,0,2,0,0|2,0,0]=4 11511 B9R2.2 C1CC1C2CCCN2 Amb19372940 [0,0,0,2,0,0|2,0,0]=4 11512 B9R2.2 C1CC1C2CCCO2 Amb22364700 [0,0,0,2,0,0|1,0,0]=3 11513 B9R2.2 C1CC1C2OCCO2 Amb24377650 [0,0,0,2,0,0|0,0,0]=2 11514 B9R2.2 C1NCC(O1)C2CC2 Amb25195199 [0,0,0,2,0,0|2,0,0]=4 11515 B9R2.2 C1OCCC1C2CO2 Amb22757940 [0,0,0,2,0,0|2,0,0]=4 11516 B9R2.3 C1CC2C(C1)CNC2 Amb10604048 [0,0,0,2,0,0|2,0,0]=4 11517 B9R2.3 C1CC2OCCC2N1 Amb24411464 [0,0,0,2,0,0|2,0,0]=4 11518 B9R2.3 C1CCC2CCCC21 Amb22230311 [0,0,0,2,0,0|2,0,0]=4 11519 B9R2.3 C1CCC2NCCC21 Amb18641673 [0,0,0,2,0,0|2,0,0]=4 11520 B9R2.3 C1CCN2CCCC21 Amb22371122 [0,0,0,2,0,0|2,0,0]=4 11521 B9R2.3 C1CCN2CCOC21 Amb24414454 [0,0,0,2,0,0|1,0,0]=3 11522 B9R2.3 C1CCN2OCC[C@H]21 Amb24576696 [0,0,0,2,0,0|2,0,0]=4 11523 B9R2.3 C1CC[C@@H]2NCC[C@H]21 Amb18203381 [0,0,0,2,0,0|2,0,0]=4 11524 B9R2.3 C1CC[C@H]2NCC[C@@H]21 Amb24616781 [0,0,0,2,0,0|2,0,0]=4 11525 B9R2.3 C1CC[C@H]2NCC[C@H]21 Amb25230592 [0,0,0,2,0,0|2,0,0]=4 11526 B9R2.3 C1CN2CCSC2O1 Amb24097136 [0,0,0,2,0,0|2,0,0]=4 11527 B9R2.3 C1C[C@@H]2OCC[C@@H]2N1 Amb22757961 [0,0,0,2,0,0|2,0,0]=4 11528 B9R2.3 C1NCC2COCC21 Amb18833061 [0,0,0,2,0,0|2,0,0]=4 11529 B9R2.3 C1NCC2COCC21 Amb22493837 [0,0,0,2,0,0|2,0,0]=4 11530 B9R2.3 C1NCC2NCCC21 Amb22235619 [0,0,0,2,0,0|2,0,0]=4 11531 B9R2.3 C1NCC2NCCC21 Amb22490645 [0,0,0,2,0,0|2,0,0]=4 11532 B9R2.3 C1NCC2NCC[C@@H]21 Amb25138444 [0,0,0,2,0,0|2,0,0]=4 11533 B9R2.3 C1NCC2OCCC21 Amb25743923 [0,0,0,2,0,0|1,0,0]=3 11534 B9R2.3 C1NC[C@@H]2CCC[C@@H]21 Amb22745958 [0,0,0,2,0,0|2,0,0]=4 11535 B9R2.3 C1NC[C@@H]2COC[C@@H]21 Amb22746773 [0,0,0,2,0,0|2,0,0]=4 11536 B9R2.3 C1NC[C@@H]2COC[C@@H]21 Amb22747277 [0,0,0,2,0,0|2,0,0]=4 11537 B9R2.3 C1NC[C@@H]2NCC[C@H]21 Amb18833088 [0,0,0,2,0,0|2,0,0]=4 11538 B9R2.3 C1NC[C@@H]2OCC[C@@H]21 Amb22757949 [0,0,0,2,0,0|1,0,0]=3 11539 B9R2.3 C1NC[C@@H]2OCC[C@@H]21 Amb25168863 [0,0,0,2,0,0|1,0,0]=3 11540 B9R2.3 C1NC[C@H]2CCC[C@@H]21 Amb24550678 [0,0,0,2,0,0|2,0,0]=4 11541 B9R2.3 C1NC[C@H]2NCC[C@H]21 Amb24689862 [0,0,0,2,0,0|2,0,0]=4 11542 B9R2.3 C1NC[C@H]2OCC[C@H]21 Amb25312372 [0,0,0,2,0,0|1,0,0]=3 11543 B9R2.3 C1NOC2CCCC21 Amb23512675 [0,0,0,2,0,0|2,0,0]=4 11544 B9R2.3 C1OCC2NCCC21 Amb22295819 [0,0,0,2,0,0|1,0,0]=3 11545 B9R2.3 C1OC[C@@H]2NCC[C@H]21 Amb18833060 [0,0,0,2,0,0|1,0,0]=3 11546 B9R2.3 C1ONC2CCCC21 Amb22897223 [0,0,0,2,0,0|2,0,0]=4 11547 B9R2.3 C1SC[C@@H]2NCC[C@H]21 Amb18832543 [0,0,0,2,0,0|1,1,0]=4 11548 B9R2.7 NC1CC2COCC21 Amb24483071 [0,0,0,2,0,0|2,0,0]=4 11549 B9R2.7 N[C@@H]1C[C@@H]2CCO[C@@H]21 Amb24713650 [0,0,0,2,0,0|1,0,0]=3 11550 B9R2.7 N[C@@H]1C[C@@H]2OCC[C@@H]21 Amb22757948 [0,0,0,2,0,0|2,0,0]=4 11551 B9R2.7 N[C@@H]1C[C@@H]2OCC[C@@H]21 Amb24514283 [0,0,0,2,0,0|2,0,0]=4 11552 B9R2.7 N[C@@H]1C[C@H]2OCC[C@H]21 Amb22757936 [0,0,0,2,0,0|2,0,0]=4 11553 B9R2.7 N[C@@H]1C[C@H]2OCC[C@H]21 Amb25207095 [0,0,0,2,0,0|2,0,0]=4 11554 B9R2.7 N[C@H]1C[C@@H]2CCO[C@@H]21 Amb24579472 [0,0,0,2,0,0|1,0,0]=3 11555 B9R2.7 N[C@H]1C[C@H]2CCC[C@H]21 Amb25245225 [0,0,0,2,0,0|2,0,0]=4 11556 B9R2.7 N[C@H]1C[C@H]2CCO[C@@H]21 Amb24609864 [0,0,0,2,0,0|1,0,0]=3 11557 B9R2.7 O=C1C[C@@H]2CCO[C@H]12 Amb22757944 [0,0,0,2,0,0|0,0,2]=4 11558 B9R2.7 OC1CC2CCCC21 Amb24474223 [0,0,0,2,0,0|1,0,0]=3 11559 B9R2.7 OC1CC2CNCC21 Amb25376641 [0,0,0,2,0,0|2,0,0]=4 11560 B9R2.7 O[C@@H]1C[C@H]2CNC[C@H]21 Amb24592143 [0,0,0,2,0,0|2,0,0]=4 11561 B9R2.7 O[C@H]1C[C@@H]2CCC[C@@H]21 Amb24542287 [0,0,0,2,0,0|1,0,0]=3 11562 B9R2.7 O[C@H]1C[C@H]2CNC[C@H]21 Amb25175095 [0,0,0,2,0,0|2,0,0]=4 11563 B9R2.7 O[C@H]1C[C@H]2OCC[C@H]21 Amb25254213 [0,0,0,2,0,0|2,0,0]=4 11564 B9R2.80 BrCC1C2CC1CC2 Amb25124996 [0,0,0,2,0,0|2,0,0]=4 11565 B9R2.80 NCC1C2CC1CC2 Amb24625745 [0,0,0,2,0,0|2,0,0]=4 11566 B9R2.80 NC[C@@H]1[C@H]2C[C@@H]1CC2 Amb25692627 [0,0,0,2,0,0|2,0,0]=4 11567 B9R2.80 NC[C@H]1[C@@H]2C[C@H]1CO2 Amb25367455 [0,0,0,2,0,0|2,0,0]=4 11568 B9R2.80 OCC1C2CC1CO2 Amb25143598 [0,0,0,2,0,0|2,0,0]=4 11569 B9R2.80 OC[C@@H]1[C@H]2C[C@@H]1CN2 Amb24553802 [0,0,0,2,0,0|2,0,0]=4 11570 B9R2.80 OC[C@H]1[C@@H]2C[C@H]1CN2 Amb25199862 [0,0,0,2,0,0|2,0,0]=4 11571 B9R2.80 OC[C@H]1[C@@H]2C[C@H]1CO2 Amb25226126 [0,0,0,2,0,0|2,0,0]=4 11572 B9R2.173 C1CC2(CCCC2)N1 Amb21964937 [0,0,0,2,0,0|2,0,0]=4 11573 B9R2.173 C1CCC2(CCC2)N1 Amb22229939 [0,0,0,2,0,0|2,0,0]=4 11574 B9R2.173 C1CCC2(CCC2)N1 Amb22406280 [0,0,0,2,0,0|2,0,0]=4 11575 B9R2.173 C1CCC2(CCO2)N1 Amb21962983 [0,0,0,2,0,0|2,0,0]=4 11576 B9R2.173 C1CC[Si]12CCCC2 Amb25366068 [0,0,0,2,0,0|2,0,0]=4 11577 B9R2.173 C1NCC12CCCO2 Amb22406130 [0,0,0,2,0,0|2,0,0]=4 11578 B9R2.173 C1NCC12CCCO2 Amb22736820 [0,0,0,2,0,0|2,0,0]=4 11579 B9R2.173 C1NCC12CCCO2 Amb22737537 [0,0,0,2,0,0|2,0,0]=4 11580 B9R2.173 C1NCC12CCCO2 Amb22757395 [0,0,0,2,0,0|2,0,0]=4 11581 B9R2.173 C1NCCC12CCO2 Amb21856698 [0,0,0,2,0,0|2,0,0]=4 11582 B9R2.173 C1NCCC12CCO2 Amb22406281 [0,0,0,2,0,0|2,0,0]=4 11583 B9R2.173 C1NCCC12CCO2 Amb22491534 [0,0,0,2,0,0|2,0,0]=4 11584 B9R2.18 CC1[C@H]2[C@H](O)CC[C@H]21 Amb25235724 [0,0,0,2,0,0|1,0,0]=3 11585 B9R2.18 N[C@@H]1[C@H]2C(O)CC[C@H]21 Amb24679730 [0,0,0,2,0,0|2,0,0]=4 11586 B9R2.21 CC1CC2OC2CO1 Amb24061741 [0,0,0,2,0,0|0,0,0]=2 11587 B9R2.21 CC1CCC2C(C1)O2 Amb1141335 [0,0,0,2,0,0|1,0,0]=3 11588 B9R2.21 CN1CC2OC2CC1 Amb23558011 [0,0,0,2,0,0|2,0,0]=4 11589 B9R2.21 ClC1CC2OC2CC1 Amb24453343 [0,0,0,2,0,0|2,0,0]=4 11590 B9R2.21 Cl[C@@H]1C[C@H]2O[C@H]2CC1 Amb25172981 [0,0,0,2,0,0|2,0,0]=4 11591 B9R2.21 Cl[C@H]1C[C@H]2O[C@H]2CC1 Amb24563430 [0,0,0,2,0,0|2,0,0]=4 11592 B9R2.21 OC1CC2CC2CC1 Amb25169523 [0,0,0,2,0,0|1,0,0]=3 11593 B9R2.21 OC1CC2CC2NC1 Amb24473820 [0,0,0,2,0,0|1,0,0]=3 11594 B9R2.21 OC1CC2OC2CC1 Amb25854336 [0,0,0,2,0,0|2,0,0]=4 11595 B9R2.21 OC1C[C@@H]2C[C@@H]2NC1 Amb25292329 [0,0,0,2,0,0|1,0,0]=3 11596 B9R2.21 OC1C[C@@H]2C[C@H]2CC1 Amb25307522 [0,0,0,2,0,0|1,0,0]=3 11597 B9R2.21 O[C@@H]1C[C@H]2C[C@H]2C=C1 Amb25257096 [0,0,0,2,0,0|1,0,1]=4 11598 B9R2.21 O[C@@H]1C[C@H]2C[C@H]2CC1 Amb25288224 [0,0,0,2,0,0|1,0,0]=3 11599 B9R2.21 O[C@H]1C[C@@H]2C[C@@H]2CC1 Amb25024733 [0,0,0,2,0,0|1,0,0]=3 11600 B9R2.21 O[C@H]1C[C@H]2C[C@H]2CC1 Amb24556801 [0,0,0,2,0,0|1,0,0]=3 11601 B9R2.44 C[C@@H]1C[C@@]12C[C@H]2CO Amb25357553 [0,0,0,2,0,0|1,0,0]=3 11602 B9R2.44 NC1CC12CC2CO Amb25376085 [0,0,0,2,0,0|2,0,0]=4 11603 B9R2.44 N[C@@H]1C[C@@]12C[C@@H]2CO Amb25326771 [0,0,0,2,0,0|2,0,0]=4 11604 B9R2.44 N[C@@H]1C[C@@]12C[C@H]2CO Amb25024533 [0,0,0,2,0,0|2,0,0]=4 11605 B9R2.44 OCC1CC12CC2Br Amb24481530 [0,0,0,2,0,0|2,0,0]=4 11606 B9R2.52 C1C2CCNCCC21 Amb18203386 [0,0,0,2,0,0|2,0,0]=4 11607 B9R2.52 C1C2NCCCCC21 Amb18203388 [0,0,0,2,0,0|2,0,0]=4 11608 B9R2.52 C1CCC2C(CC1)N2 Amb10609123 [0,0,0,2,0,0|2,0,0]=4 11609 B9R2.52 C1CCC2C(CC1)O2 Amb1134987 [0,0,0,2,0,0|1,0,0]=3 11610 B9R2.52 C1NCCCC2CC21 Amb18203387 [0,0,0,2,0,0|2,0,0]=4 11611 B9R2.52 C1NCCCC2OC21 Amb24678167 [0,0,0,2,0,0|1,0,0]=3 11612 B9R2.52 C1OCOCC2OC21 Amb25286617 [0,0,0,2,0,0|1,0,0]=3 11613 B9R2.108 NC1CC1C2CCC2 Amb24483254 [0,0,0,2,0,0|2,0,0]=4 11614 B9R2.108 N[C@@H]1C[C@H]1C2CCC2 Amb24581403 [0,0,0,2,0,0|2,0,0]=4 11615 B9R2.20 BrC1CC[C@@H]2CC[C@@H]21 Amb25237428 [0,0,0,2,0,0|2,0,0]=4 11616 B9R2.20 ClC1CCC2CCC21 Amb24483261 [0,0,0,2,0,0|2,0,0]=4 11617 B9R2.20 N[C@@H]1CC[C@@H]2CC[C@@H]21 Amb24580671 [0,0,0,2,0,0|2,0,0]=4 11618 B9R2.20 N[C@@H]1CC[C@H]2CC[C@H]21 Amb24621875 [0,0,0,2,0,0|2,0,0]=4 11619 B9R2.20 OC1CCC2CCC21 Amb24395686 [0,0,0,2,0,0|1,0,0]=3 11620 B9R2.20 OC1CC[C@@H]2CC[C@@H]21 Amb24642457 [0,0,0,2,0,0|1,0,0]=3 11621 B9R2.20 OC1COC2COC21 Amb25079233 [0,0,0,2,0,0|1,0,0]=3 11622 B9R2.20 O[C@@H]1C=C[C@@H]2CC[C@@H]21 Amb25252536 [0,0,0,2,0,0|1,0,1]=4 11623 B9R2.20 O[C@H]1C=C[C@@H]2CC[C@@H]21 Amb24648863 [0,0,0,2,0,0|1,0,1]=4 11624 B9R2.20 O[C@H]1CO[C@@H]2CO[C@@H]21 Amb24644046 [0,0,0,2,0,0|1,0,0]=3 11625 B9R2.91 C1CCC1[C@H]2CCN2 Amb24599147 [0,0,0,2,0,0|2,0,0]=4 11626 B9R2.140 CC1CCC12CCN2 Amb24466445 [0,0,0,2,0,0|2,0,0]=4 11627 B9R2.140 OC1CCC12CNC2 Amb24564765 [0,0,0,2,0,0|2,0,0]=4 11628 B9R2.140 OC1CCC12COC2 Amb25278821 [0,0,0,2,0,0|2,0,0]=4 11629 B9R2.153 BrCC1OC12CCC2 Amb25765408 [0,0,0,2,0,0|1,0,0]=3 11630 B9R2.153 OCC1CC12CNC2 Amb24756856 [0,0,0,2,0,0|2,0,0]=4 11631 B9R2.153 OCC1CC12COC2 Amb25195963 [0,0,0,2,0,0|2,0,0]=4 11632 B9R2.153 OCC1OC12CCC2 Amb24089203 [0,0,0,2,0,0|0,0,0]=2 11633 B9R2.157 C1CC(C1)NC2CC2 Amb16230427 [0,0,0,2,0,0|2,0,0]=4 11634 B9R2.157 C1NCC1OC2CC2 Amb22642542 [0,0,0,2,0,0|2,0,0]=4 11635 B9R2.157 C1OC1CN2CCC2 Amb25747065 [0,0,0,2,0,0|2,0,0]=4 11636 B9R2.157 C1O[C@@H]1CN2CCC2 Amb25662088 [0,0,0,2,0,0|2,0,0]=4 11637 B9R2.157 C1O[C@H]1CN2CCC2 Amb25058470 [0,0,0,2,0,0|2,0,0]=4 11638 B9R2.5 BrC1CNCC12CC2 Amb25240387 [0,0,0,2,0,0|2,0,0]=4 11639 B9R2.5 CC1CCCC12CO2 Amb24533573 [0,0,0,2,0,0|1,0,0]=3 11640 B9R2.5 CC1CNCC12CC2 Amb25365594 [0,0,0,2,0,0|2,0,0]=4 11641 B9R2.5 FC1CNCC12CC2 Amb25072814 [0,0,0,2,0,0|2,0,0]=4 11642 B9R2.5 NC1CCCC12CC2 Amb18833097 [0,0,0,2,0,0|2,0,0]=4 11643 B9R2.5 N[C@H]1CNCC12CC2 Amb25375097 [0,0,0,2,0,0|2,0,0]=4 11644 B9R2.5 OC1CNCC12CC2 Amb22737477 [0,0,0,2,0,0|1,0,0]=3 11645 B9R2.5 OC1CNCC12CC2 Amb24113078 [0,0,0,2,0,0|1,0,0]=3 11646 B9R2.23 O[C@@H]1[C@@H]2CC[C@H]1[C@@H]2Cl Amb25347646 [0,0,0,2,0,0|2,0,0]=4 11647 B9R2.23 O[C@@H]1[C@H]2CC[C@@H]1[C@@H]2Cl Amb25024745 [0,0,0,2,0,0|2,0,0]=4 11648 B9R2.31 CC1C2CC1CC2N Amb25311011 [0,0,0,2,0,0|2,0,0]=4 11649 B9R2.31 C[C@H]1[C@@H]2C[C@H]1C[C@@H]2N Amb24527781 [0,0,0,2,0,0|2,0,0]=4 11650 B9R2.31 C[C@H]1[C@@H]2C[C@H]1C[C@H]2O Amb24550216 [0,0,0,2,0,0|1,0,0]=3 11651 B9R2.31 NC1C2CC1CC2O Amb24724805 [0,0,0,2,0,0|2,0,0]=4 11652 B9R2.48 OCC1CCC12CC2 Amb24355154 [0,0,0,2,0,0|1,0,0]=3 11653 B9R2.33 BrC1CC2CCC2C1 Amb24419943 [0,0,0,2,0,0|2,0,0]=4 11654 B9R2.33 NC1CC2CCC2C1 Amb24696800 [0,0,0,2,0,0|2,0,0]=4 11655 B9R2.36 NC1CCC1C2CC2 Amb24553955 [0,0,0,2,0,0|2,0,0]=4 11656 B9R2.36 OC1CCC1C2CC2 Amb24711940 [0,0,0,2,0,0|1,0,0]=3 11657 B9R2.28 BrCCC1CC12CC2 Amb24483151 [0,0,0,2,0,0|2,0,0]=4 11658 B9R2.28 OCCC1CC12CC2 Amb22727912 [0,0,0,2,0,0|1,0,0]=3 11659 B9R2.79 NCC1CC1C2CC2 Amb18963619 [0,0,0,2,0,0|2,0,0]=4 11660 B9R2.79 NCC1CC1C2CC2 Amb20632198 [0,0,0,2,0,0|2,0,0]=4 11661 B9R2.69 C(NC1CC1)C2CO2 Amb25229848 [0,0,0,2,0,0|2,0,0]=4 11662 B9R2.69 C(OC1CC1)C2CC2 Amb24502270 [0,0,0,2,0,0|1,0,0]=3