0 B5R0.2 BrCCCCBr Amb2686718 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.2 BrCCCCI Amb25861429 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.2 BrCCCNBr Amb27424198 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.2 Br\C=C\CCBr Amb25663040 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.2 C#CCC#CC Amb17670544 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.2 C#CCCC#C Amb17689130 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.2 C#CCCC#N Amb6336489 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.2 C#CCCC=C Amb18117518 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.2 C#CCCC=O Amb28049678 [0,0,0,0,0,0|1,0,1]=2 9 B5R0.2 C#CCCCBr Amb17610060 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.2 C#CCCCC Amb4135448 [0,0,0,0,0,0|2,0,1]=3 11 B5R0.2 C#CCCCCl Amb3940276 [0,0,0,0,0,0|2,0,2]=4 12 B5R0.2 C#CCCCF Amb26904785 [0,0,0,0,0,0|2,0,2]=4 13 B5R0.2 C#CCCCI Amb25843530 [0,0,0,0,0,0|2,0,2]=4 14 B5R0.2 C#CCCCN Amb18962495 [0,0,0,0,0,0|2,0,2]=4 15 B5R0.2 C#CCCCN Amb33532759 [0,0,0,0,0,0|2,0,2]=4 16 B5R0.2 C#CCCCO Amb1219893 [0,0,0,0,0,0|1,0,3]=4 17 B5R0.2 C#CCCCS Amb24333394 [0,0,0,0,0,0|1,1,2]=4 18 B5R0.2 C#CCCNC Amb18962433 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.2 C#CCCNC Amb33339156 [0,0,0,0,0,0|2,0,1]=3 20 B5R0.2 C#CCCNC Amb33611652 [0,0,0,0,0,0|2,0,1]=3 21 B5R0.2 C#CCCOC Amb18117254 [0,0,0,0,0,0|1,1,1]=3 22 B5R0.2 C#CCCON Amb28200358 [0,0,0,0,0,0|2,1,1]=4 23 B5R0.2 C#CCCSC Amb24579788 [0,0,0,0,0,0|1,0,1]=2 24 B5R0.2 C#CCN=C=O Amb19649908 [0,0,0,0,0,0|2,0,2]=4 25 B5R0.2 C#CCNCC Amb10610192 [0,0,0,0,0,0|3,0,1]=4 26 B5R0.2 C#CCNCC Amb6683724 [0,0,0,0,0,0|3,0,1]=4 27 B5R0.2 C#CCNOC Amb27228907 [0,0,0,0,0,0|2,1,1]=4 28 B5R0.2 C#CCOCC Amb17673317 [0,0,0,0,0,0|3,0,1]=4 29 B5R0.2 C#CCSCC Amb3941533 [0,0,0,0,0,0|3,0,1]=4 30 B5R0.2 C#C\C=C\C=O Amb17593013 [0,0,0,0,0,0|1,0,3]=4 31 B5R0.2 C#NCCCC Amb31132446 [0,0,0,0,0,0|3,0,0]=3 32 B5R0.2 C=C=CCC=O Amb27234481 [0,0,0,0,0,0|1,0,2]=3 33 B5R0.2 C=CC#CC=O Amb28284761 [0,0,0,0,0,0|1,0,3]=4 34 B5R0.2 C=CC#CCC Amb24333935 [0,0,0,0,0,0|2,0,2]=4 35 B5R0.2 C=CCCC#N Amb10605750 [0,0,0,0,0,0|3,0,0]=3 36 B5R0.2 C=CCCC=C Amb8513514 [0,0,0,0,0,0|2,0,1]=3 37 B5R0.2 C=CCCC=O Amb4358616 [0,0,0,0,0,0|1,0,1]=2 38 B5R0.2 C=CCCCBr Amb3940219 [0,0,0,0,0,0|3,0,0]=3 39 B5R0.2 C=CCCCC Amb3940497 [0,0,0,0,0,0|2,0,0]=2 40 B5R0.2 C=CCCCCl Amb22229585 [0,0,0,0,0,0|3,0,0]=3 41 B5R0.2 C=CCCCF Amb25689705 [0,0,0,0,0,0|3,0,0]=3 42 B5R0.2 C=CCCCI Amb25278794 [0,0,0,0,0,0|3,0,0]=3 43 B5R0.2 C=CCCCN Amb18299670 [0,0,0,0,0,0|3,0,0]=3 44 B5R0.2 C=CCCCN Amb22001451 [0,0,0,0,0,0|3,0,0]=3 45 B5R0.2 C=CCCCO Amb8513439 [0,0,0,0,0,0|3,0,0]=3 46 B5R0.2 C=CCCC[CH2-] Amb32644015 [0,0,0,0,0,0|2,0,1]=3 47 B5R0.2 C=CCCNC Amb18993048 [0,0,0,0,0,0|2,0,0]=2 48 B5R0.2 C=CCCNC Amb33553635 [0,0,0,0,0,0|2,0,0]=2 49 B5R0.2 C=CCCOC Amb28065418 [0,0,0,0,0,0|1,1,0]=2 50 B5R0.2 C=CCCON Amb22233632 [0,0,0,0,0,0|2,1,0]=3 51 B5R0.2 C=CCCON Amb22896384 [0,0,0,0,0,0|2,1,0]=3 52 B5R0.2 C=CCCSC Amb24431590 [0,0,0,0,0,0|1,0,0]=1 53 B5R0.2 C=CCN=C=O Amb3939127 [0,0,0,0,0,0|2,0,2]=4 54 B5R0.2 C=CCN=C=S Amb3940395 [0,0,0,0,0,0|4,0,0]=4 55 B5R0.2 C=CCN=[N+]=[N-] Amb33538392 [0,0,0,0,0,0|4,0,0]=4 56 B5R0.2 C=CCNC#N Amb26357359 [0,0,0,0,0,0|4,0,0]=4 57 B5R0.2 C=CCNC=C Amb28134893 [0,0,0,0,0,0|3,0,1]=4 58 B5R0.2 C=CCNC=O Amb2781857 [0,0,0,0,0,0|2,0,1]=3 59 B5R0.2 C=CCNCC Amb13951161 [0,0,0,0,0,0|3,0,0]=3 60 B5R0.2 C=CCNCC Amb6683951 [0,0,0,0,0,0|3,0,0]=3 61 B5R0.2 C=CCOC=C Amb17933943 [0,0,0,0,0,0|3,0,1]=4 62 B5R0.2 C=CCOCBr Amb28384107 [0,0,0,0,0,0|4,0,0]=4 63 B5R0.2 C=CCOCC Amb2684299 [0,0,0,0,0,0|3,0,0]=3 64 B5R0.2 C=CCOCCl Amb28429831 [0,0,0,0,0,0|4,0,0]=4 65 B5R0.2 C=CCONC Amb32411015 [0,0,0,0,0,0|3,0,0]=3 66 B5R0.2 C=CCSC#N Amb28461558 [0,0,0,0,0,0|4,0,0]=4 67 B5R0.2 C=CCSCC Amb6366495 [0,0,0,0,0,0|3,0,0]=3 68 B5R0.2 C=CCSCCl Amb25859631 [0,0,0,0,0,0|4,0,0]=4 69 B5R0.2 C=CCSSC Amb22730604 [0,0,0,0,0,0|2,0,0]=2 70 B5R0.2 C=CC\C=C/C Amb26426294 [0,0,0,0,0,0|2,0,1]=3 71 B5R0.2 C=CNCCC Amb27461242 [0,0,0,0,0,0|3,0,0]=3 72 B5R0.2 C=COCCC Amb17940706 [0,0,0,0,0,0|3,0,0]=3 73 B5R0.2 C=COCCI Amb28245341 [0,0,0,0,0,0|4,0,0]=4 74 B5R0.2 C=COCCN Amb17593030 [0,0,0,0,0,0|4,0,0]=4 75 B5R0.2 C=COCCN Amb32409664 [0,0,0,0,0,0|4,0,0]=4 76 B5R0.2 C=COCCO Amb17674184 [0,0,0,0,0,0|4,0,0]=4 77 B5R0.2 C=COCOC Amb28131655 [0,0,0,0,0,0|2,1,0]=3 78 B5R0.2 C=CSCCCl Amb27390785 [0,0,0,0,0,0|4,0,0]=4 79 B5R0.2 C=CSCCO Amb27607172 [0,0,0,0,0,0|4,0,0]=4 80 B5R0.2 C=C\C=C\C=O Amb26369847 [0,0,0,0,0,0|1,0,3]=4 81 B5R0.2 C=C\C=C\CC Amb8513434 [0,0,0,0,0,0|2,0,2]=4 82 B5R0.2 C=NCCCCl Amb28346586 [0,0,0,0,0,0|2,0,2]=4 83 B5R0.2 CC#CCC#N Amb17593010 [0,0,0,0,0,0|2,0,2]=4 84 B5R0.2 CC#CCC=O Amb27850282 [0,0,0,0,0,0|1,0,1]=2 85 B5R0.2 CC#CCCBr Amb26337860 [0,0,0,0,0,0|2,0,2]=4 86 B5R0.2 CC#CCCC Amb8515369 [0,0,0,0,0,0|2,0,2]=4 87 B5R0.2 CC#CCCN Amb18285893 [0,0,0,0,0,0|2,0,2]=4 88 B5R0.2 CC#CCCN Amb33543085 [0,0,0,0,0,0|2,0,2]=4 89 B5R0.2 CC#CCCO Amb2721725 [0,0,0,0,0,0|1,0,3]=4 90 B5R0.2 CC#CCNC Amb18285096 [0,0,0,0,0,0|2,0,2]=4 91 B5R0.2 CC#CCNC Amb33266041 [0,0,0,0,0,0|2,0,2]=4 92 B5R0.2 CC#CCOC Amb27424463 [0,0,0,0,0,0|1,1,2]=4 93 B5R0.2 CC#CCON Amb28200443 [0,0,0,0,0,0|3,0,1]=4 94 B5R0.2 CC#CCSC Amb25362650 [0,0,0,0,0,0|1,0,2]=3 95 B5R0.2 CCC#CC=O Amb25663194 [0,0,0,0,0,0|1,0,2]=3 96 B5R0.2 CCC=C=CBr Amb27194333 [0,0,0,0,0,0|2,0,2]=4 97 B5R0.2 CCCC#CBr Amb24648680 [0,0,0,0,0,0|2,0,2]=4 98 B5R0.2 CCCC#CI Amb22733682 [0,0,0,0,0,0|2,0,2]=4 99 B5R0.2 CCCCC#N Amb6662839 [0,0,0,0,0,0|2,0,1]=3 100 B5R0.2 CCCCC=O Amb3939655 [0,0,0,0,0,0|1,0,0]=1 101 B5R0.2 CCCCCBr Amb3940084 [0,0,0,0,0,0|2,0,1]=3 102 B5R0.2 CCCCCC Amb2447471 [0,0,0,0,0,0|2,0,1]=3 103 B5R0.2 CCCCCCl Amb8514576 [0,0,0,0,0,0|2,0,1]=3 104 B5R0.2 CCCCCF Amb10838686 [0,0,0,0,0,0|2,0,1]=3 105 B5R0.2 CCCCCI Amb6891946 [0,0,0,0,0,0|2,0,1]=3 106 B5R0.2 CCCCCN Amb3939830 [0,0,0,0,0,0|2,0,1]=3 107 B5R0.2 CCCCCO Amb3939051 [0,0,0,0,0,0|1,0,2]=3 108 B5R0.2 CCCCCS Amb8513287 [0,0,0,0,0,0|1,1,1]=3 109 B5R0.2 CCCCC[SiH3] Amb19893989 [0,0,0,0,0,0|2,0,1]=3 110 B5R0.2 CCCCNC Amb3939351 [0,0,0,0,0,0|2,0,1]=3 111 B5R0.2 CCCCNN Amb1105203 [0,0,0,0,0,0|3,0,0]=3 112 B5R0.2 CCCCNN Amb22230363 [0,0,0,0,0,0|3,0,0]=3 113 B5R0.2 CCCCNN Amb33055062 [0,0,0,0,0,0|3,0,0]=3 114 B5R0.2 CCCCNO Amb24686451 [0,0,0,0,0,0|2,0,1]=3 115 B5R0.2 CCCCNO Amb32687485 [0,0,0,0,0,0|2,0,1]=3 116 B5R0.2 CCCCON Amb17101066 [0,0,0,0,0,0|3,0,0]=3 117 B5R0.2 CCCCON Amb6308542 [0,0,0,0,0,0|3,0,0]=3 118 B5R0.2 CCCCSC Amb4036342 [0,0,0,0,0,0|1,0,1]=2 119 B5R0.2 CCCN=C=O Amb3939331 [0,0,0,0,0,0|2,0,1]=3 120 B5R0.2 CCCN=C=S Amb6572523 [0,0,0,0,0,0|2,1,1]=4 121 B5R0.2 CCCN=[N+]=[N-] Amb25811439 [0,0,0,0,0,0|4,0,0]=4 122 B5R0.2 CCCNC=S Amb27754027 [0,0,0,0,0,0|2,1,0]=3 123 B5R0.2 CCCNCC Amb3939843 [0,0,0,0,0,0|3,0,1]=4 124 B5R0.2 CCCNNC Amb25283190 [0,0,0,0,0,0|3,0,1]=4 125 B5R0.2 CCCOCBr Amb25351883 [0,0,0,0,0,0|3,0,1]=4 126 B5R0.2 CCCOCC Amb17673668 [0,0,0,0,0,0|3,0,1]=4 127 B5R0.2 CCCOCCl Amb22002403 [0,0,0,0,0,0|3,0,1]=4 128 B5R0.2 CCCSCC Amb22168047 [0,0,0,0,0,0|3,0,1]=4 129 B5R0.2 CCCSCCl Amb28146719 [0,0,0,0,0,0|3,0,1]=4 130 B5R0.2 CCC\C=C\Br Amb17673688 [0,0,0,0,0,0|2,0,1]=3 131 B5R0.2 CCC\C=C\Cl Amb25026521 [0,0,0,0,0,0|2,0,1]=3 132 B5R0.2 CCC\C=C\N Amb27217273 [0,0,0,0,0,0|2,0,1]=3 133 B5R0.2 CCC\C=N\O Amb27213413 [0,0,0,0,0,0|2,0,2]=4 134 B5R0.2 CCNCC#N Amb6245416 [0,0,0,0,0,0|3,0,1]=4 135 B5R0.2 CCNCCBr Amb27950012 [0,0,0,0,0,0|3,0,1]=4 136 B5R0.2 CCNCCCl Amb17334050 [0,0,0,0,0,0|3,0,1]=4 137 B5R0.2 CCNCCCl Amb33869917 [0,0,0,0,0,0|3,0,1]=4 138 B5R0.2 CCNCCF Amb27858242 [0,0,0,0,0,0|3,0,1]=4 139 B5R0.2 CCNCCI Amb27856942 [0,0,0,0,0,0|3,0,1]=4 140 B5R0.2 CCNCCN Amb6297789 [0,0,0,0,0,0|3,0,1]=4 141 B5R0.2 CCNCCO Amb19372818 [0,0,0,0,0,0|2,0,2]=4 142 B5R0.2 CCNCCO Amb3940070 [0,0,0,0,0,0|2,0,2]=4 143 B5R0.2 CCNCCP Amb27188285 [0,0,0,0,0,0|3,0,1]=4 144 B5R0.2 CCOCC#N Amb6263119 [0,0,0,0,0,0|3,0,1]=4 145 B5R0.2 CCOCCBr Amb1158671 [0,0,0,0,0,0|3,0,1]=4 146 B5R0.2 CCOCCCl Amb8390350 [0,0,0,0,0,0|3,0,1]=4 147 B5R0.2 CCOCCI Amb25117446 [0,0,0,0,0,0|3,0,1]=4 148 B5R0.2 CCOCCN Amb1130918 [0,0,0,0,0,0|3,0,1]=4 149 B5R0.2 CCOCCN Amb29844456 [0,0,0,0,0,0|3,0,1]=4 150 B5R0.2 CCOCCO Amb3939142 [0,0,0,0,0,0|2,0,2]=4 151 B5R0.2 CCOCCS Amb9316644 [0,0,0,0,0,0|2,1,1]=4 152 B5R0.2 CCO\C=C/Br Amb2455970 [0,0,0,0,0,0|3,0,1]=4 153 B5R0.2 CCO\C=C/Cl Amb28315611 [0,0,0,0,0,0|3,0,1]=4 154 B5R0.2 CCO\C=C\Br Amb10068669 [0,0,0,0,0,0|3,0,1]=4 155 B5R0.2 CCSCC#N Amb6680684 [0,0,0,0,0,0|3,0,1]=4 156 B5R0.2 CCSCC=O Amb17940620 [0,0,0,0,0,0|2,0,0]=2 157 B5R0.2 CCSCCBr Amb2685158 [0,0,0,0,0,0|3,0,1]=4 158 B5R0.2 CCSCCCl Amb3940261 [0,0,0,0,0,0|3,0,1]=4 159 B5R0.2 CCSCCN Amb2687948 [0,0,0,0,0,0|3,0,1]=4 160 B5R0.2 CCSCCN Amb9825826 [0,0,0,0,0,0|3,0,1]=4 161 B5R0.2 CCSCCO Amb1085958 [0,0,0,0,0,0|2,0,2]=4 162 B5R0.2 CCSCCS Amb27167723 [0,0,0,0,0,0|2,1,1]=4 163 B5R0.2 CCSSSC Amb25073645 [0,0,0,0,0,0|3,0,1]=4 164 B5R0.2 CCS\C=C/Cl Amb28244706 [0,0,0,0,0,0|3,0,1]=4 165 B5R0.2 CC\C=C\C=O Amb33986391 [0,0,0,0,0,0|1,0,2]=3 166 B5R0.2 CNCCC#N Amb3939367 [0,0,0,0,0,0|2,0,1]=3 167 B5R0.2 CNCCCBr Amb28291325 [0,0,0,0,0,0|2,0,1]=3 168 B5R0.2 CNCCCBr Amb33473632 [0,0,0,0,0,0|2,0,1]=3 169 B5R0.2 CNCCCCl Amb22002154 [0,0,0,0,0,0|2,0,1]=3 170 B5R0.2 CNCCCCl Amb3941419 [0,0,0,0,0,0|2,0,1]=3 171 B5R0.2 CNCCCF Amb27405698 [0,0,0,0,0,0|2,0,1]=3 172 B5R0.2 CNCCCN Amb2698065 [0,0,0,0,0,0|2,0,1]=3 173 B5R0.2 CNCCCO Amb9246656 [0,0,0,0,0,0|1,0,2]=3 174 B5R0.2 CNCCNC Amb4037059 [0,0,0,0,0,0|3,0,0]=3 175 B5R0.2 CNCCNN Amb24117180 [0,0,0,0,0,0|3,0,0]=3 176 B5R0.2 CNCCNO Amb27976196 [0,0,0,0,0,0|2,0,1]=3 177 B5R0.2 CNCCOC Amb10609606 [0,0,0,0,0,0|2,1,0]=3 178 B5R0.2 CNCCOC Amb2689126 [0,0,0,0,0,0|2,1,0]=3 179 B5R0.2 CNCCSC Amb15701319 [0,0,0,0,0,0|2,0,0]=2 180 B5R0.2 CNCCSC Amb20625111 [0,0,0,0,0,0|2,0,0]=2 181 B5R0.2 CNC\C=C/I Amb23539307 [0,0,0,0,0,0|2,0,1]=3 182 B5R0.2 CNOCCN Amb22411501 [0,0,0,0,0,0|3,0,1]=4 183 B5R0.2 CNOCCN Amb22490915 [0,0,0,0,0,0|3,0,1]=4 184 B5R0.2 CNOCCO Amb27637954 [0,0,0,0,0,0|2,0,2]=4 185 B5R0.2 CN\C=C\C=O Amb24564349 [0,0,0,0,0,0|1,0,2]=3 186 B5R0.2 COCCC#N Amb2819688 [0,0,0,0,0,0|1,1,1]=3 187 B5R0.2 COCCC=O Amb10602324 [0,0,0,0,0,0|0,1,0]=1 188 B5R0.2 COCCCBr Amb8828205 [0,0,0,0,0,0|1,1,1]=3 189 B5R0.2 COCCCCl Amb6255994 [0,0,0,0,0,0|1,1,1]=3 190 B5R0.2 COCCCF Amb22007998 [0,0,0,0,0,0|1,1,1]=3 191 B5R0.2 COCCCI Amb33546474 [0,0,0,0,0,0|1,1,1]=3 192 B5R0.2 COCCCN Amb3939346 [0,0,0,0,0,0|1,1,1]=3 193 B5R0.2 COCCCO Amb8385593 [0,0,0,0,0,0|0,1,2]=3 194 B5R0.2 COCCCS Amb13952794 [0,0,0,0,0,0|0,2,1]=3 195 B5R0.2 COCCNN Amb10609107 [0,0,0,0,0,0|2,1,0]=3 196 B5R0.2 COCCNN Amb19374182 [0,0,0,0,0,0|2,1,0]=3 197 B5R0.2 COCCNN Amb22233534 [0,0,0,0,0,0|2,1,0]=3 198 B5R0.2 COCCNN Amb22587527 [0,0,0,0,0,0|2,1,0]=3 199 B5R0.2 COCCNN Amb6248350 [0,0,0,0,0,0|2,1,0]=3 200 B5R0.2 COCCNO Amb25284480 [0,0,0,0,0,0|1,1,1]=3 201 B5R0.2 COCCOC Amb6741456 [0,0,0,0,0,0|2,1,0]=3 202 B5R0.2 COCCON Amb17194148 [0,0,0,0,0,0|2,1,0]=3 203 B5R0.2 COCCON Amb20623946 [0,0,0,0,0,0|2,1,0]=3 204 B5R0.2 COCCSC Amb4020919 [0,0,0,0,0,0|2,0,0]=2 205 B5R0.2 COCN=C=O Amb6265212 [0,0,0,0,0,0|1,1,1]=3 206 B5R0.2 COCN=C=S Amb2689144 [0,0,0,0,0,0|1,2,1]=4 207 B5R0.2 COCN=[N+]=[N-] Amb18632997 [0,0,0,0,0,0|3,1,0]=4 208 B5R0.2 COCNC=O Amb28049834 [0,0,0,0,0,0|1,1,0]=2 209 B5R0.2 CONCCN Amb25733738 [0,0,0,0,0,0|2,1,1]=4 210 B5R0.2 CONCCN Amb32645968 [0,0,0,0,0,0|2,1,1]=4 211 B5R0.2 CONCCO Amb27658816 [0,0,0,0,0,0|1,1,2]=4 212 B5R0.2 CO\C=C/C=O Amb28049941 [0,0,0,0,0,0|0,1,2]=3 213 B5R0.2 CO\C=C\C=O Amb26873964 [0,0,0,0,0,0|0,1,2]=3 214 B5R0.2 CSC#CCO Amb17593093 [0,0,0,0,0,0|0,0,4]=4 215 B5R0.2 CSC#CSC Amb17673866 [0,0,0,0,0,0|2,0,2]=4 216 B5R0.2 CSCCC#N Amb17307555 [0,0,0,0,0,0|1,0,1]=2 217 B5R0.2 CSCCC=O Amb3939952 [0,0,0,0,0,0|0,0,0]=0 218 B5R0.2 CSCCCBr Amb18180189 [0,0,0,0,0,0|1,0,1]=2 219 B5R0.2 CSCCCCl Amb10602296 [0,0,0,0,0,0|1,0,1]=2 220 B5R0.2 CSCCCN Amb33801570 [0,0,0,0,0,0|1,0,1]=2 221 B5R0.2 CSCCCN Amb6718923 [0,0,0,0,0,0|1,0,1]=2 222 B5R0.2 CSCCCO Amb3939523 [0,0,0,0,0,0|0,0,2]=2 223 B5R0.2 CSCCCS Amb25744031 [0,0,0,0,0,0|0,1,1]=2 224 B5R0.2 CSCCNN Amb18640583 [0,0,0,0,0,0|2,0,0]=2 225 B5R0.2 CSCCNO Amb33272071 [0,0,0,0,0,0|1,0,1]=2 226 B5R0.2 CSCCON Amb25806571 [0,0,0,0,0,0|2,0,0]=2 227 B5R0.2 CSCCSC Amb25101746 [0,0,0,0,0,0|2,0,0]=2 228 B5R0.2 CSCSSC Amb25798526 [0,0,0,0,0,0|3,0,0]=3 229 B5R0.2 CSC\C=N\O Amb22168142 [0,0,0,0,0,0|1,0,2]=3 230 B5R0.2 CSSCCN Amb26850738 [0,0,0,0,0,0|2,0,1]=3 231 B5R0.2 CSSCCN Amb32652424 [0,0,0,0,0,0|2,0,1]=3 232 B5R0.2 CS\C=C\CCl Amb26494423 [0,0,0,0,0,0|1,0,3]=4 233 B5R0.2 C[SiH2]CCCN Amb28049027 [0,0,0,0,0,0|2,0,1]=3 234 B5R0.2 C[SiH2]CN=[N+]=[N-] Amb27759075 [0,0,0,0,0,0|4,0,0]=4 235 B5R0.2 C\C=C/C=C/C Amb26318493 [0,0,0,0,0,0|2,0,2]=4 236 B5R0.2 C\C=C/CCC Amb6366719 [0,0,0,0,0,0|2,0,1]=3 237 B5R0.2 C\C=C/CCO Amb19930204 [0,0,0,0,0,0|1,0,3]=4 238 B5R0.2 C\C=C\C=C\Br Amb27791828 [0,0,0,0,0,0|2,0,2]=4 239 B5R0.2 C\C=C\C=C\C Amb27622458 [0,0,0,0,0,0|2,0,2]=4 240 B5R0.2 C\C=C\CC#N Amb2720721 [0,0,0,0,0,0|2,0,2]=4 241 B5R0.2 C\C=C\CC=O Amb26655030 [0,0,0,0,0,0|1,0,1]=2 242 B5R0.2 C\C=C\CCBr Amb32667161 [0,0,0,0,0,0|2,0,2]=4 243 B5R0.2 C\C=C\CCCl Amb26978891 [0,0,0,0,0,0|2,0,2]=4 244 B5R0.2 C\C=C\CCN Amb19374038 [0,0,0,0,0,0|2,0,2]=4 245 B5R0.2 C\C=C\CCN Amb33038294 [0,0,0,0,0,0|2,0,2]=4 246 B5R0.2 C\C=C\CCO Amb24655557 [0,0,0,0,0,0|1,0,3]=4 247 B5R0.2 C\C=C\CNC Amb28049814 [0,0,0,0,0,0|2,0,1]=3 248 B5R0.2 C\C=C\CON Amb18560216 [0,0,0,0,0,0|2,1,1]=4 249 B5R0.2 C\C=C\N=C=O Amb24677922 [0,0,0,0,0,0|2,0,2]=4 250 B5R0.2 C\C=C\OCC Amb8516635 [0,0,0,0,0,0|3,0,1]=4 251 B5R0.2 C\C=C\SSC Amb9790327 [0,0,0,0,0,0|2,0,1]=3 252 B5R0.2 C\C=N\CCC Amb27954749 [0,0,0,0,0,0|3,0,0]=3 253 B5R0.2 C\C=N\CCN Amb27837883 [0,0,0,0,0,0|3,0,1]=4 254 B5R0.2 ClCCCCBr Amb8391065 [0,0,0,0,0,0|3,0,1]=4 255 B5R0.2 ClCCCCCl Amb6608890 [0,0,0,0,0,0|3,0,1]=4 256 B5R0.2 ClCCCCI Amb8517518 [0,0,0,0,0,0|3,0,1]=4 257 B5R0.2 ClCCCNCl Amb27165116 [0,0,0,0,0,0|3,0,1]=4 258 B5R0.2 ClCCC[SiH2]Cl Amb27629993 [0,0,0,0,0,0|3,0,1]=4 259 B5R0.2 ClCCSSBr Amb33352019 [0,0,0,0,0,0|3,0,1]=4 260 B5R0.2 ClCCSSCl Amb25261492 [0,0,0,0,0,0|3,0,1]=4 261 B5R0.2 Cl\C=C\CCCl Amb25929864 [0,0,0,0,0,0|3,0,1]=4 262 B5R0.2 Cl\C=C\CCI Amb27647471 [0,0,0,0,0,0|3,0,1]=4 263 B5R0.2 FCCCCBr Amb2685210 [0,0,0,0,0,0|3,0,1]=4 264 B5R0.2 FCCCCCl Amb27655616 [0,0,0,0,0,0|3,0,1]=4 265 B5R0.2 FCCCCF Amb10839858 [0,0,0,0,0,0|3,0,1]=4 266 B5R0.2 FCCCCI Amb28283837 [0,0,0,0,0,0|3,0,1]=4 267 B5R0.2 FCCCCS Amb25065453 [0,0,0,0,0,0|2,1,1]=4 268 B5R0.2 ICCCCI Amb17672573 [0,0,0,0,0,0|3,0,1]=4 269 B5R0.2 N#CCCC#N Amb8513695 [0,0,0,0,0,0|3,0,1]=4 270 B5R0.2 N#CCCC=O Amb3941009 [0,0,0,0,0,0|2,0,0]=2 271 B5R0.2 N#CCCCBr Amb3940093 [0,0,0,0,0,0|3,0,1]=4 272 B5R0.2 N#CCCCCl Amb3940298 [0,0,0,0,0,0|3,0,1]=4 273 B5R0.2 N#CCCCF Amb25146362 [0,0,0,0,0,0|3,0,1]=4 274 B5R0.2 N#CCCCI Amb8517592 [0,0,0,0,0,0|3,0,1]=4 275 B5R0.2 N#CCCCN Amb28555321 [0,0,0,0,0,0|3,0,1]=4 276 B5R0.2 N#CCCCN Amb6271100 [0,0,0,0,0,0|3,0,1]=4 277 B5R0.2 N#CCCCO Amb4021727 [0,0,0,0,0,0|2,0,2]=4 278 B5R0.2 N#CCCCS Amb17504257 [0,0,0,0,0,0|2,1,1]=4 279 B5R0.2 N#CCCNN Amb2694748 [0,0,0,0,0,0|3,0,1]=4 280 B5R0.2 N#CCCNO Amb22748730 [0,0,0,0,0,0|3,0,1]=4 281 B5R0.2 N#CCN=C=O Amb26482208 [0,0,0,0,0,0|3,0,1]=4 282 B5R0.2 N#CCOC=O Amb22347946 [0,0,0,0,0,0|3,0,0]=3 283 B5R0.2 NCCCC=O Amb26851044 [0,0,0,0,0,0|2,0,0]=2 284 B5R0.2 NCCCCBr Amb21858985 [0,0,0,0,0,0|3,0,1]=4 285 B5R0.2 NCCCCCl Amb18640687 [0,0,0,0,0,0|3,0,1]=4 286 B5R0.2 NCCCCCl Amb22233734 [0,0,0,0,0,0|3,0,1]=4 287 B5R0.2 NCCCCF Amb26017241 [0,0,0,0,0,0|3,0,1]=4 288 B5R0.2 NCCCCF Amb28555328 [0,0,0,0,0,0|3,0,1]=4 289 B5R0.2 NCCCCI Amb27837961 [0,0,0,0,0,0|3,0,1]=4 290 B5R0.2 NCCCCN Amb22489528 [0,0,0,0,0,0|3,0,1]=4 291 B5R0.2 NCCCCN Amb6608640 [0,0,0,0,0,0|3,0,1]=4 292 B5R0.2 NCCCCN Amb8514498 [0,0,0,0,0,0|3,0,1]=4 293 B5R0.2 NCCCCO Amb3939336 [0,0,0,0,0,0|2,0,2]=4 294 B5R0.2 NCCCCS Amb17500976 [0,0,0,0,0,0|2,1,1]=4 295 B5R0.2 NCCCCS Amb22546260 [0,0,0,0,0,0|2,1,1]=4 296 B5R0.2 NCCCN=O Amb28049442 [0,0,0,0,0,0|3,0,0]=3 297 B5R0.2 NCCCNN Amb27392601 [0,0,0,0,0,0|3,0,1]=4 298 B5R0.2 NCCCNO Amb27882495 [0,0,0,0,0,0|3,0,1]=4 299 B5R0.2 NCCCNO Amb32729324 [0,0,0,0,0,0|3,0,1]=4 300 B5R0.2 NCCOC=O Amb24612320 [0,0,0,0,0,0|3,0,0]=3 301 B5R0.2 NCCSN=O Amb27950442 [0,0,0,0,0,0|4,0,0]=4 302 B5R0.2 NCC\C=C\Cl Amb27391191 [0,0,0,0,0,0|3,0,1]=4 303 B5R0.2 NNCCCF Amb25696672 [0,0,0,0,0,0|3,0,1]=4 304 B5R0.2 NNCCCO Amb19514839 [0,0,0,0,0,0|2,0,2]=4 305 B5R0.2 NNCCCO Amb22058994 [0,0,0,0,0,0|2,0,2]=4 306 B5R0.2 NNCCNN Amb25314393 [0,0,0,0,0,0|4,0,0]=4 307 B5R0.2 NOCCCF Amb24632017 [0,0,0,0,0,0|2,1,1]=4 308 B5R0.2 NOCCCO Amb18061671 [0,0,0,0,0,0|1,1,2]=4 309 B5R0.2 NOCCCS Amb17608230 [0,0,0,0,0,0|1,2,1]=4 310 B5R0.2 NOCCCS Amb27489799 [0,0,0,0,0,0|1,2,1]=4 311 B5R0.2 NOCCON Amb31308386 [0,0,0,0,0,0|3,1,0]=4 312 B5R0.2 NOC\C=C\Cl Amb32653337 [0,0,0,0,0,0|2,1,1]=4 313 B5R0.2 NOC\C=C\Cl Amb32701613 [0,0,0,0,0,0|2,1,1]=4 314 B5R0.2 N\C=N\OC=O Amb28118665 [0,0,0,0,0,0|4,0,0]=4 315 B5R0.2 O=BOCCBr Amb27954923 [0,0,0,0,0,0|4,0,0]=4 316 B5R0.2 O=C=NCCBr Amb17194090 [0,0,0,0,0,0|3,0,1]=4 317 B5R0.2 O=C=NCCCl Amb535458 [0,0,0,0,0,0|3,0,1]=4 318 B5R0.2 O=C=NCCF Amb24710430 [0,0,0,0,0,0|3,0,1]=4 319 B5R0.2 O=C=NCCO Amb27659445 [0,0,0,0,0,0|3,0,1]=4 320 B5R0.2 O=CCCC=O Amb8395090 [0,0,0,0,0,0|2,0,0]=2 321 B5R0.2 O=CCCCBr Amb18644189 [0,0,0,0,0,0|2,0,0]=2 322 B5R0.2 O=CCCCCl Amb8395190 [0,0,0,0,0,0|2,0,0]=2 323 B5R0.2 O=CCCCF Amb24056028 [0,0,0,0,0,0|2,0,0]=2 324 B5R0.2 O=CCCCI Amb27249641 [0,0,0,0,0,0|2,0,0]=2 325 B5R0.2 O=CCCCO Amb24589235 [0,0,0,0,0,0|2,0,0]=2 326 B5R0.2 O=CCCSS Amb22524519 [0,0,0,0,0,0|1,0,0]=1 327 B5R0.2 O=CCNC=O Amb26370295 [0,0,0,0,0,0|3,0,0]=3 328 B5R0.2 O=CC\C=C\Cl Amb24571938 [0,0,0,0,0,0|2,0,1]=3 329 B5R0.2 O=CNCCF Amb28205988 [0,0,0,0,0,0|3,0,0]=3 330 B5R0.2 O=CNNC=O Amb6298322 [0,0,0,0,0,0|4,0,0]=4 331 B5R0.2 O=COCCBr Amb27816149 [0,0,0,0,0,0|3,0,0]=3 332 B5R0.2 O=COCCO Amb26625741 [0,0,0,0,0,0|3,0,0]=3 333 B5R0.2 O=C\C=C/C=O Amb28146767 [0,0,0,0,0,0|2,0,2]=4 334 B5R0.2 O=C\C=C\C=O Amb17593019 [0,0,0,0,0,0|2,0,2]=4 335 B5R0.2 O=C\C=C\CCl Amb18122401 [0,0,0,0,0,0|2,0,2]=4 336 B5R0.2 O=C\C=C\CF Amb33475269 [0,0,0,0,0,0|2,0,2]=4 337 B5R0.2 O=C\C=C\CO Amb24356008 [0,0,0,0,0,0|2,0,2]=4 338 B5R0.2 O=NOCCCl Amb27205298 [0,0,0,0,0,0|4,0,0]=4 339 B5R0.2 O=NOCCI Amb28188003 [0,0,0,0,0,0|4,0,0]=4 340 B5R0.2 O=NOCCO Amb22363071 [0,0,0,0,0,0|4,0,0]=4 341 B5R0.2 O=S=NCCCl Amb27634384 [0,0,0,0,0,0|4,0,0]=4 342 B5R0.2 OCCCCBr Amb8395353 [0,0,0,0,0,0|2,0,2]=4 343 B5R0.2 OCCCCCl Amb1101976 [0,0,0,0,0,0|2,0,2]=4 344 B5R0.2 OCCCCF Amb17593046 [0,0,0,0,0,0|2,0,2]=4 345 B5R0.2 OCCCCO Amb2793029 [0,0,0,0,0,0|2,0,2]=4 346 B5R0.2 OCC\C=C\Br Amb27425005 [0,0,0,0,0,0|3,0,1]=4 347 B5R0.2 OCC\C=C\Cl Amb27859286 [0,0,0,0,0,0|3,0,1]=4 348 B5R0.2 ONCCCF Amb25931859 [0,0,0,0,0,0|3,0,1]=4 349 B5R0.2 O\C=N\CCCl Amb24684796 [0,0,0,0,0,0|3,0,1]=4 350 B5R0.2 SCCCCS Amb8513069 [0,0,0,0,0,0|2,1,1]=4 351 B5R0.2 [C-]#[N+]CCCC Amb2235001 [0,0,0,0,0,0|3,0,0]=3 352 B5R0.2 [C-]#[N+]CCCF Amb26423847 [0,0,0,0,0,0|2,0,2]=4 353 B5R0.2 [C-]#[N+]CCOC Amb1981032 [0,0,0,0,0,0|2,1,0]=3 354 B5R0.2 [C-]#[N+]CCSC Amb27222323 [0,0,0,0,0,0|2,0,0]=2 355 B5R0.2 [C-]#[N+]CC[N+]#[C-] Amb27859684 [0,0,0,0,0,0|3,0,1]=4 356 B5R0.2 [N-]=[N+]=NCC=O Amb26953499 [0,0,0,0,0,0|3,0,0]=3 357 B4R0.2 BOCCN Amb28363843 [1,0,0,0,0,0|2,1,0]=4 358 B4R0.2 BrCCCBr Amb2686759 [1,0,0,0,0,0|2,0,1]=4 359 B4R0.2 BrCCCI Amb18090828 [1,0,0,0,0,0|2,0,1]=4 360 B4R0.2 BrC\C=C\I Amb25811655 [1,0,0,0,0,0|2,0,1]=4 361 B4R0.2 Br\C=C\CBr Amb22338450 [1,0,0,0,0,0|2,0,1]=4 362 B4R0.2 C#CCC=C Amb27803732 [1,0,0,0,0,0|1,0,2]=4 363 B4R0.2 C#CCCBr Amb17673313 [1,0,0,0,0,0|2,0,1]=4 364 B4R0.2 C#CCCC Amb3940495 [1,0,0,0,0,0|1,0,1]=3 365 B4R0.2 C#CCCCl Amb20620667 [1,0,0,0,0,0|2,0,1]=4 366 B4R0.2 C#CCCF Amb27391123 [1,0,0,0,0,0|2,0,1]=4 367 B4R0.2 C#CCCI Amb25732840 [1,0,0,0,0,0|2,0,1]=4 368 B4R0.2 C#CCCN Amb10975966 [1,0,0,0,0,0|2,0,1]=4 369 B4R0.2 C#CCCN Amb18280234 [1,0,0,0,0,0|2,0,1]=4 370 B4R0.2 C#CCCO Amb2685716 [1,0,0,0,0,0|1,0,2]=4 371 B4R0.2 C#CCCO Amb34916688 [1,0,0,0,0,0|1,0,2]=4 372 B4R0.2 C#CCNC Amb3940046 [1,0,0,0,0,0|1,0,2]=4 373 B4R0.2 C#CCOC Amb3940471 [1,0,0,0,0,0|0,1,2]=4 374 B4R0.2 C#CCSC Amb17939736 [1,0,0,0,0,0|0,0,2]=3 375 B4R0.2 C#COCC Amb2687848 [1,0,0,0,0,0|2,0,1]=4 376 B4R0.2 C#NCCC Amb31132336 [1,0,0,0,0,0|2,0,0]=3 377 B4R0.2 C=C=CCC Amb10565985 [1,0,0,0,0,0|1,0,2]=4 378 B4R0.2 C=C=COC Amb17673262 [1,0,0,0,0,0|0,1,2]=4 379 B4R0.2 C=CC#CC Amb27975609 [1,0,0,0,0,0|1,0,2]=4 380 B4R0.2 C=CCC#N Amb6257824 [1,0,0,0,0,0|2,0,1]=4 381 B4R0.2 C=CCC=C Amb8513286 [1,0,0,0,0,0|1,0,2]=4 382 B4R0.2 C=CCC=O Amb25058716 [1,0,0,0,0,0|0,0,2]=3 383 B4R0.2 C=CCCBr Amb2684977 [1,0,0,0,0,0|2,0,0]=3 384 B4R0.2 C=CCCC Amb8514606 [1,0,0,0,0,0|1,0,0]=2 385 B4R0.2 C=CCCCl Amb22229725 [1,0,0,0,0,0|2,0,0]=3 386 B4R0.2 C=CCCF Amb27869562 [1,0,0,0,0,0|2,0,0]=3 387 B4R0.2 C=CCCI Amb33546459 [1,0,0,0,0,0|2,0,0]=3 388 B4R0.2 C=CCCN Amb10601640 [1,0,0,0,0,0|2,0,0]=3 389 B4R0.2 C=CCCN Amb33484127 [1,0,0,0,0,0|2,0,0]=3 390 B4R0.2 C=CCCN Amb5717434 [1,0,0,0,0,0|2,0,0]=3 391 B4R0.2 C=CCCO Amb6609024 [1,0,0,0,0,0|1,1,0]=3 392 B4R0.2 C=CCC[NH3+] Amb5718705 [1,0,0,0,0,0|2,0,0]=3 393 B4R0.2 C=CCNC Amb3940004 [1,0,0,0,0,0|1,0,1]=3 394 B4R0.2 C=CCNN Amb10603954 [1,0,0,0,0,0|2,0,1]=4 395 B4R0.2 C=CCNN Amb22886671 [1,0,0,0,0,0|2,0,1]=4 396 B4R0.2 C=CCNN Amb28984064 [1,0,0,0,0,0|2,0,1]=4 397 B4R0.2 C=CCON Amb20620193 [1,0,0,0,0,0|1,1,1]=4 398 B4R0.2 C=CCON Amb3941699 [1,0,0,0,0,0|1,1,1]=4 399 B4R0.2 C=CCSC Amb3940478 [1,0,0,0,0,0|0,0,1]=2 400 B4R0.2 C=CC[Mg]Cl Amb8517089 [1,0,0,0,0,0|2,0,1]=4 401 B4R0.2 C=CC[Pd]Cl Amb8514345 [1,0,0,0,0,0|2,0,1]=4 402 B4R0.2 C=CNC=O Amb10844823 [1,0,0,0,0,0|1,0,2]=4 403 B4R0.2 C=CNCC Amb24120592 [1,0,0,0,0,0|2,0,0]=3 404 B4R0.2 C=COC=O Amb22734253 [1,0,0,0,0,0|1,0,2]=4 405 B4R0.2 C=COCBr Amb27434716 [1,0,0,0,0,0|3,0,0]=4 406 B4R0.2 C=COCC Amb2447619 [1,0,0,0,0,0|2,0,0]=3 407 B4R0.2 C=COCCl Amb28387218 [1,0,0,0,0,0|3,0,0]=4 408 B4R0.2 C=CSCC Amb10604172 [1,0,0,0,0,0|2,0,0]=3 409 B4R0.2 C=C\C=C/C Amb24477227 [1,0,0,0,0,0|1,0,2]=4 410 B4R0.2 C=C\C=C\C Amb17772326 [1,0,0,0,0,0|1,0,2]=4 411 B4R0.2 C=NCC#N Amb4035876 [1,0,0,0,0,0|3,0,0]=4 412 B4R0.2 C=NCCO Amb27827243 [1,0,0,0,0,0|1,0,2]=4 413 B4R0.2 CC#CC=O Amb24477088 [1,0,0,0,0,0|0,0,2]=3 414 B4R0.2 CC#CCBr Amb2684984 [1,0,0,0,0,0|2,0,1]=4 415 B4R0.2 CC#CCCl Amb27846335 [1,0,0,0,0,0|2,0,1]=4 416 B4R0.2 CC#CCI Amb24560926 [1,0,0,0,0,0|2,0,1]=4 417 B4R0.2 CC#CCN Amb18946992 [1,0,0,0,0,0|2,0,1]=4 418 B4R0.2 CC#CCN Amb20622722 [1,0,0,0,0,0|2,0,1]=4 419 B4R0.2 CC#CCO Amb2685715 [1,0,0,0,0,0|1,0,2]=4 420 B4R0.2 CC=C=CC Amb17670597 [1,0,0,0,0,0|1,0,2]=4 421 B4R0.2 CC=C=CI Amb17673291 [1,0,0,0,0,0|1,0,2]=4 422 B4R0.2 CCC#CBr Amb17673880 [1,0,0,0,0,0|1,0,2]=4 423 B4R0.2 CCC#CI Amb22734959 [1,0,0,0,0,0|1,0,2]=4 424 B4R0.2 CCCC#N Amb6662840 [1,0,0,0,0,0|1,0,1]=3 425 B4R0.2 CCCC=O Amb3940026 [1,0,0,0,0,0|0,0,0]=1 426 B4R0.2 CCCCBr Amb2795761 [1,0,0,0,0,0|1,0,1]=3 427 B4R0.2 CCCCCl Amb3940273 [1,0,0,0,0,0|1,0,1]=3 428 B4R0.2 CCCCF Amb2688075 [1,0,0,0,0,0|1,0,1]=3 429 B4R0.2 CCCCI Amb4606011 [1,0,0,0,0,0|1,0,1]=3 430 B4R0.2 CCCCN Amb22002333 [1,0,0,0,0,0|1,0,1]=3 431 B4R0.2 CCCCN Amb3939832 [1,0,0,0,0,0|1,0,1]=3 432 B4R0.2 CCCCO Amb2793053 [1,0,0,0,0,0|0,0,2]=3 433 B4R0.2 CCCCS Amb8513452 [1,0,0,0,0,0|0,1,1]=3 434 B4R0.2 CCCC[SiH3] Amb19883792 [1,0,0,0,0,0|1,0,1]=3 435 B4R0.2 CCCNC Amb1125050 [1,0,0,0,0,0|1,0,1]=3 436 B4R0.2 CCCNC Amb13951517 [1,0,0,0,0,0|1,0,1]=3 437 B4R0.2 CCCNN Amb22490873 [1,0,0,0,0,0|2,0,0]=3 438 B4R0.2 CCCNN Amb6246347 [1,0,0,0,0,0|2,0,0]=3 439 B4R0.2 CCCNN Amb9147579 [1,0,0,0,0,0|2,0,0]=3 440 B4R0.2 CCCOC Amb22227974 [1,0,0,0,0,0|0,1,1]=3 441 B4R0.2 CCCON Amb21929105 [1,0,0,0,0,0|2,0,0]=3 442 B4R0.2 CCCON Amb4061686 [1,0,0,0,0,0|2,0,0]=3 443 B4R0.2 CCCSC Amb22045208 [1,0,0,0,0,0|0,0,1]=2 444 B4R0.2 CCISC Amb27753276 [1,0,0,0,0,0|1,0,1]=3 445 B4R0.2 CCN=C=O Amb3939325 [1,0,0,0,0,0|1,0,1]=3 446 B4R0.2 CCN=C=S Amb2793065 [1,0,0,0,0,0|1,1,1]=4 447 B4R0.2 CCN=[N+]=[N-] Amb18522046 [1,0,0,0,0,0|3,0,0]=4 448 B4R0.2 CCNC#N Amb24706343 [1,0,0,0,0,0|2,0,1]=4 449 B4R0.2 CCNC=O Amb22229692 [1,0,0,0,0,0|1,0,0]=2 450 B4R0.2 CCNC=S Amb24476965 [1,0,0,0,0,0|1,1,0]=3 451 B4R0.2 CCNCC Amb21520464 [1,0,0,0,0,0|2,0,1]=4 452 B4R0.2 CCNCC Amb22047271 [1,0,0,0,0,0|2,0,1]=4 453 B4R0.2 CCNCC Amb2793074 [1,0,0,0,0,0|2,0,1]=4 454 B4R0.2 CCNCC Amb8513512 [1,0,0,0,0,0|2,0,1]=4 455 B4R0.2 CCNCO Amb28048578 [1,0,0,0,0,0|1,0,2]=4 456 B4R0.2 CCNOC Amb25082359 [1,0,0,0,0,0|1,1,1]=4 457 B4R0.2 CCNOC Amb33164114 [1,0,0,0,0,0|1,1,1]=4 458 B4R0.2 CCOC=O Amb3429671 [1,0,0,0,0,0|1,0,0]=2 459 B4R0.2 CCOCBr Amb26033270 [1,0,0,0,0,0|2,0,1]=4 460 B4R0.2 CCOCC Amb10807375 [1,0,0,0,0,0|2,0,1]=4 461 B4R0.2 CCOCC Amb8513220 [1,0,0,0,0,0|2,0,1]=4 462 B4R0.2 CCOCCl Amb8516247 [1,0,0,0,0,0|2,0,1]=4 463 B4R0.2 CCOCO Amb25042105 [1,0,0,0,0,0|1,0,2]=4 464 B4R0.2 CCONC Amb22388890 [1,0,0,0,0,0|2,0,1]=4 465 B4R0.2 CCONC Amb33495158 [1,0,0,0,0,0|2,0,1]=4 466 B4R0.2 CCPCC Amb19889866 [1,0,0,0,0,0|2,0,1]=4 467 B4R0.2 CCSCC Amb8386438 [1,0,0,0,0,0|2,0,1]=4 468 B4R0.2 CCSCCl Amb27599798 [1,0,0,0,0,0|2,0,1]=4 469 B4R0.2 CCSSC Amb22230676 [1,0,0,0,0,0|1,0,1]=3 470 B4R0.2 CC[AlH3+]CC Amb22053728 [1,0,0,0,0,0|2,0,1]=4 471 B4R0.2 CC[Ga]CC Amb33513021 [1,0,0,0,0,0|2,0,1]=4 472 B4R0.2 CC[OH+]CC Amb27461536 [1,0,0,0,0,0|2,0,1]=4 473 B4R0.2 CC[SiH2]CC Amb19893778 [1,0,0,0,0,0|1,1,1]=4 474 B4R0.2 CC[Zn]CC Amb8514301 [1,0,0,0,0,0|2,0,1]=4 475 B4R0.2 CC\C=C/I Amb27985379 [1,0,0,0,0,0|1,0,1]=3 476 B4R0.2 CC\C=C\Cl Amb25024567 [1,0,0,0,0,0|1,0,1]=3 477 B4R0.2 CC\C=C\I Amb28346900 [1,0,0,0,0,0|1,0,1]=3 478 B4R0.2 CC\C=N\O Amb24369620 [1,0,0,0,0,0|1,0,2]=4 479 B4R0.2 CNCC#N Amb2099607 [1,0,0,0,0,0|2,0,1]=4 480 B4R0.2 CNCC#N Amb22489527 [1,0,0,0,0,0|2,0,1]=4 481 B4R0.2 CNCC#N Amb3940530 [1,0,0,0,0,0|2,0,1]=4 482 B4R0.2 CNCC=O Amb28133605 [1,0,0,0,0,0|1,0,0]=2 483 B4R0.2 CNCCBr Amb20224134 [1,0,0,0,0,0|2,0,0]=3 484 B4R0.2 CNCCBr Amb22753915 [1,0,0,0,0,0|2,0,0]=3 485 B4R0.2 CNCCCl Amb19338156 [1,0,0,0,0,0|2,0,0]=3 486 B4R0.2 CNCCCl Amb2196487 [1,0,0,0,0,0|2,0,0]=3 487 B4R0.2 CNCCF Amb25292993 [1,0,0,0,0,0|2,0,0]=3 488 B4R0.2 CNCCF Amb32661249 [1,0,0,0,0,0|2,0,0]=3 489 B4R0.2 CNCCI Amb2099455 [1,0,0,0,0,0|2,0,0]=3 490 B4R0.2 CNCCI Amb6374325 [1,0,0,0,0,0|2,0,0]=3 491 B4R0.2 CNCCN Amb19958520 [1,0,0,0,0,0|2,0,0]=3 492 B4R0.2 CNCCN Amb8513507 [1,0,0,0,0,0|2,0,0]=3 493 B4R0.2 CNCCO Amb2793086 [1,0,0,0,0,0|1,0,1]=3 494 B4R0.2 CNCCP Amb27786982 [1,0,0,0,0,0|2,0,0]=3 495 B4R0.2 CNCCS Amb18641549 [1,0,0,0,0,0|1,1,0]=3 496 B4R0.2 CNCCS Amb32651884 [1,0,0,0,0,0|1,1,0]=3 497 B4R0.2 CN\C=C\N Amb27403876 [1,0,0,0,0,0|2,0,1]=4 498 B4R0.2 COCC#N Amb6663960 [1,0,0,0,0,0|1,1,1]=4 499 B4R0.2 COCC=O Amb3941034 [1,0,0,0,0,0|0,1,0]=2 500 B4R0.2 COCCBr Amb2685166 [1,0,0,0,0,0|1,1,0]=3 501 B4R0.2 COCCCl Amb3940260 [1,0,0,0,0,0|1,1,0]=3 502 B4R0.2 COCCI Amb22228848 [1,0,0,0,0,0|1,1,0]=3 503 B4R0.2 COCCN Amb3939058 [1,0,0,0,0,0|1,1,0]=3 504 B4R0.2 COCCO Amb4605828 [1,0,0,0,0,0|0,1,1]=3 505 B4R0.2 COCCS Amb6255784 [1,0,0,0,0,0|0,2,0]=3 506 B4R0.2 COCOC Amb6608858 [1,0,0,0,0,0|1,1,1]=4 507 B4R0.2 COCON Amb22549472 [1,0,0,0,0,0|2,1,0]=4 508 B4R0.2 CO\C=C\Br Amb27259287 [1,0,0,0,0,0|1,1,1]=4 509 B4R0.2 CO\N=C\N Amb27765422 [1,0,0,0,0,0|2,1,0]=4 510 B4R0.2 CPCCO Amb27594723 [1,0,0,0,0,0|1,0,1]=3 511 B4R0.2 CSCC#N Amb8513692 [1,0,0,0,0,0|1,0,1]=3 512 B4R0.2 CSCC=O Amb27250514 [1,0,0,0,0,0|0,0,0]=1 513 B4R0.2 CSCCBr Amb18176565 [1,0,0,0,0,0|1,0,0]=2 514 B4R0.2 CSCCCl Amb2685909 [1,0,0,0,0,0|1,0,0]=2 515 B4R0.2 CSCCI Amb24477438 [1,0,0,0,0,0|1,0,0]=2 516 B4R0.2 CSCCN Amb2724163 [1,0,0,0,0,0|1,0,0]=2 517 B4R0.2 CSCCN Amb6754152 [1,0,0,0,0,0|1,0,0]=2 518 B4R0.2 CSCCO Amb3568993 [1,0,0,0,0,0|0,0,1]=2 519 B4R0.2 CS\C=C\Br Amb27614429 [1,0,0,0,0,0|1,0,1]=3 520 B4R0.2 CS\C=C\Cl Amb27244119 [1,0,0,0,0,0|1,0,1]=3 521 B4R0.2 C\C=C/CC Amb8517400 [1,0,0,0,0,0|1,0,1]=3 522 B4R0.2 C\C=C/CCl Amb28367227 [1,0,0,0,0,0|2,0,1]=4 523 B4R0.2 C\C=C\C=O Amb6891937 [1,0,0,0,0,0|0,0,2]=3 524 B4R0.2 C\C=C\CBr Amb3940083 [1,0,0,0,0,0|2,0,1]=4 525 B4R0.2 C\C=C\CC Amb9134767 [1,0,0,0,0,0|1,0,1]=3 526 B4R0.2 C\C=C\CCl Amb3940264 [1,0,0,0,0,0|2,0,1]=4 527 B4R0.2 C\C=C\CI Amb26567317 [1,0,0,0,0,0|2,0,1]=4 528 B4R0.2 C\C=C\CN Amb22490422 [1,0,0,0,0,0|2,0,1]=4 529 B4R0.2 C\C=C\CN Amb32693433 [1,0,0,0,0,0|2,0,1]=4 530 B4R0.2 C\C=C\CO Amb9277796 [1,0,0,0,0,0|1,0,2]=4 531 B4R0.2 C\C=C\OC Amb25747348 [1,0,0,0,0,0|1,1,1]=4 532 B4R0.2 C\C=C\SC Amb27782691 [1,0,0,0,0,0|1,0,1]=3 533 B4R0.2 C\C=N\OC Amb24115747 [1,0,0,0,0,0|2,1,0]=4 534 B4R0.2 C\N=C\C=O Amb27849988 [1,0,0,0,0,0|1,0,1]=3 535 B4R0.2 ClCCCBr Amb6608966 [1,0,0,0,0,0|2,0,1]=4 536 B4R0.2 ClCCCCl Amb2793083 [1,0,0,0,0,0|2,0,1]=4 537 B4R0.2 ClCCCI Amb2686137 [1,0,0,0,0,0|2,0,1]=4 538 B4R0.2 ClCCSCl Amb27169228 [1,0,0,0,0,0|2,0,0]=3 539 B4R0.2 ClC\C=C\Br Amb27807677 [1,0,0,0,0,0|2,0,1]=4 540 B4R0.2 ClC\C=C\I Amb28053642 [1,0,0,0,0,0|2,0,1]=4 541 B4R0.2 Cl\C=C/CCl Amb10067980 [1,0,0,0,0,0|2,0,1]=4 542 B4R0.2 Cl\C=C/CI Amb27948135 [1,0,0,0,0,0|2,0,1]=4 543 B4R0.2 Cl\C=C\CBr Amb20622315 [1,0,0,0,0,0|2,0,1]=4 544 B4R0.2 Cl\C=C\CCl Amb9702789 [1,0,0,0,0,0|2,0,1]=4 545 B4R0.2 FCCCBr Amb10845700 [1,0,0,0,0,0|2,0,1]=4 546 B4R0.2 FCCCF Amb10839359 [1,0,0,0,0,0|2,0,1]=4 547 B4R0.2 FCCCI Amb10838561 [1,0,0,0,0,0|2,0,1]=4 548 B4R0.2 FCCCS Amb28344639 [1,0,0,0,0,0|1,0,1]=3 549 B4R0.2 FC\C=C\Cl Amb27954628 [1,0,0,0,0,0|2,0,1]=4 550 B4R0.2 F\C=C\CF Amb10840514 [1,0,0,0,0,0|2,0,1]=4 551 B4R0.2 ICCCI Amb8514578 [1,0,0,0,0,0|2,0,1]=4 552 B4R0.2 N#CCC=O Amb9669129 [1,0,0,0,0,0|1,0,1]=3 553 B4R0.2 N#CCCBr Amb3940092 [1,0,0,0,0,0|2,0,1]=4 554 B4R0.2 N#CCCCl Amb1152297 [1,0,0,0,0,0|2,0,1]=4 555 B4R0.2 N#CCCI Amb33547255 [1,0,0,0,0,0|2,0,1]=4 556 B4R0.2 N#CCCN Amb19516480 [1,0,0,0,0,0|2,0,1]=4 557 B4R0.2 N#CCCN Amb2720712 [1,0,0,0,0,0|2,0,1]=4 558 B4R0.2 N#CCCO Amb534940 [1,0,0,0,0,0|1,1,1]=4 559 B4R0.2 N#CCCS Amb17502414 [1,0,0,0,0,0|1,0,1]=3 560 B4R0.2 N#CNC=O Amb27796080 [1,0,0,0,0,0|2,0,1]=4 561 B4R0.2 NCCC=S Amb28366830 [1,0,0,0,0,0|1,1,0]=3 562 B4R0.2 NCCCBr Amb22489540 [1,0,0,0,0,0|2,0,1]=4 563 B4R0.2 NCCCBr Amb6609025 [1,0,0,0,0,0|2,0,1]=4 564 B4R0.2 NCCCBr Amb932825 [1,0,0,0,0,0|2,0,1]=4 565 B4R0.2 NCCCCl Amb2720482 [1,0,0,0,0,0|2,0,1]=4 566 B4R0.2 NCCCCl Amb6306670 [1,0,0,0,0,0|2,0,1]=4 567 B4R0.2 NCCCF Amb16186035 [1,0,0,0,0,0|2,0,1]=4 568 B4R0.2 NCCCF Amb19374917 [1,0,0,0,0,0|2,0,1]=4 569 B4R0.2 NCCCI Amb33249705 [1,0,0,0,0,0|2,0,1]=4 570 B4R0.2 NCCCN Amb21953130 [1,0,0,0,0,0|2,0,1]=4 571 B4R0.2 NCCCN Amb21953284 [1,0,0,0,0,0|2,0,1]=4 572 B4R0.2 NCCCN Amb2793020 [1,0,0,0,0,0|2,0,1]=4 573 B4R0.2 NCCCO Amb22229163 [1,0,0,0,0,0|1,0,2]=4 574 B4R0.2 NCCCO Amb2793042 [1,0,0,0,0,0|1,0,2]=4 575 B4R0.2 NCCCS Amb17500723 [1,0,0,0,0,0|1,0,1]=3 576 B4R0.2 NCCCS Amb18368606 [1,0,0,0,0,0|1,0,1]=3 577 B4R0.2 NCCCS Amb20623313 [1,0,0,0,0,0|1,0,1]=3 578 B4R0.2 NCCNN Amb24117221 [1,0,0,0,0,0|3,0,0]=4 579 B4R0.2 NCCNN Amb27440245 [1,0,0,0,0,0|3,0,0]=4 580 B4R0.2 NCCNO Amb24476856 [1,0,0,0,0,0|2,0,1]=4 581 B4R0.2 NCCON Amb19958432 [1,0,0,0,0,0|2,1,0]=4 582 B4R0.2 NCCON Amb22054301 [1,0,0,0,0,0|2,1,0]=4 583 B4R0.2 NCCON Amb22233863 [1,0,0,0,0,0|2,1,0]=4 584 B4R0.2 NC\C=C/I Amb23539306 [1,0,0,0,0,0|2,0,1]=4 585 B4R0.2 NC\C=C\Br Amb32660939 [1,0,0,0,0,0|2,0,1]=4 586 B4R0.2 NC\C=C\Cl Amb30584669 [1,0,0,0,0,0|2,0,1]=4 587 B4R0.2 NC\C=C\Cl Amb32992834 [1,0,0,0,0,0|2,0,1]=4 588 B4R0.2 NNCCCl Amb26362372 [1,0,0,0,0,0|3,0,0]=4 589 B4R0.2 NNCCF Amb24351032 [1,0,0,0,0,0|3,0,0]=4 590 B4R0.2 NNCCF Amb33527627 [1,0,0,0,0,0|3,0,0]=4 591 B4R0.2 NNCCO Amb2695098 [1,0,0,0,0,0|2,0,1]=4 592 B4R0.2 NOCCF Amb22008453 [1,0,0,0,0,0|2,1,0]=4 593 B4R0.2 NOCCF Amb25858004 [1,0,0,0,0,0|2,1,0]=4 594 B4R0.2 NOCCO Amb17190317 [1,0,0,0,0,0|1,1,1]=4 595 B4R0.2 N[NH2+]CCO Amb27867172 [1,0,0,0,0,0|2,0,1]=4 596 B4R0.2 N\C=C/C=O Amb25246630 [1,0,0,0,0,0|1,0,2]=4 597 B4R0.2 N\C=C\C=O Amb33946746 [1,0,0,0,0,0|1,0,2]=4 598 B4R0.2 O=C=NCCl Amb17194089 [1,0,0,0,0,0|2,0,1]=4 599 B4R0.2 O=CC#CCl Amb28123140 [1,0,0,0,0,0|1,0,2]=4 600 B4R0.2 O=CC=S=O Amb27436150 [1,0,0,0,0,0|1,0,2]=4 601 B4R0.2 O=CCC=O Amb33512721 [1,0,0,0,0,0|0,1,1]=3 602 B4R0.2 O=CCCCl Amb16233605 [1,0,0,0,0,0|1,0,0]=2 603 B4R0.2 O=CCCF Amb21858609 [1,0,0,0,0,0|1,0,0]=2 604 B4R0.2 O=CCCI Amb26847605 [1,0,0,0,0,0|1,0,0]=2 605 B4R0.2 O=CCCO Amb24412391 [1,0,0,0,0,0|0,1,0]=2 606 B4R0.2 O=CCCS Amb27755008 [1,0,0,0,0,0|0,0,0]=1 607 B4R0.2 O=CNC=O Amb25721263 [1,0,0,0,0,0|1,1,1]=4 608 B4R0.2 O=CNC=O Amb33982955 [1,0,0,0,0,0|1,1,1]=4 609 B4R0.2 O=CNCO Amb27754843 [1,0,0,0,0,0|1,1,0]=3 610 B4R0.2 O=CNCS Amb27846487 [1,0,0,0,0,0|1,0,0]=2 611 B4R0.2 O=C\C=C/Br Amb27876427 [1,0,0,0,0,0|1,0,2]=4 612 B4R0.2 O=C\C=C/I Amb27863578 [1,0,0,0,0,0|1,0,2]=4 613 B4R0.2 O=C\C=C\Cl Amb17593041 [1,0,0,0,0,0|1,0,2]=4 614 B4R0.2 O=C\C=N\O Amb25746308 [1,0,0,0,0,0|1,1,1]=4 615 B4R0.2 OCCCBr Amb932815 [1,0,0,0,0,0|1,0,2]=4 616 B4R0.2 OCCCCl Amb6608905 [1,0,0,0,0,0|1,0,2]=4 617 B4R0.2 OCCCF Amb2688406 [1,0,0,0,0,0|1,0,2]=4 618 B4R0.2 OCCCI Amb2688881 [1,0,0,0,0,0|1,0,2]=4 619 B4R0.2 OCCCO Amb2793089 [1,0,0,0,0,0|0,1,2]=4 620 B4R0.2 OCCCS Amb8517566 [1,0,0,0,0,0|0,0,2]=3 621 B4R0.2 OCCNBr Amb27265947 [1,0,0,0,0,0|2,0,1]=4 622 B4R0.2 OCCNCl Amb27206146 [1,0,0,0,0,0|2,0,1]=4 623 B4R0.2 OCCNF Amb27775764 [1,0,0,0,0,0|2,0,1]=4 624 B4R0.2 OC\C=C/I Amb23539305 [1,0,0,0,0,0|1,1,1]=4 625 B4R0.2 OC\C=C\Br Amb32653556 [1,0,0,0,0,0|1,1,1]=4 626 B4R0.2 OC\C=C\Cl Amb33531874 [1,0,0,0,0,0|1,1,1]=4 627 B4R0.2 OC\C=C\I Amb24642752 [1,0,0,0,0,0|1,1,1]=4 628 B4R0.2 ONCCF Amb25931834 [1,0,0,0,0,0|2,0,1]=4 629 B4R0.2 O\C=C\CCl Amb27449221 [1,0,0,0,0,0|1,0,2]=4 630 B4R0.2 PCCCP Amb22227719 [1,0,0,0,0,0|2,0,1]=4 631 B4R0.2 SCCCBr Amb22270209 [1,0,0,0,0,0|1,0,1]=3 632 B4R0.2 SCCCS Amb7809241 [1,0,0,0,0,0|0,1,1]=3 633 B4R0.2 [C-]#[N+]CC=C Amb5456299 [1,0,0,0,0,0|1,0,2]=4 634 B4R0.2 [C-]#[N+]CCC Amb24117082 [1,0,0,0,0,0|2,0,0]=3 635 B4R0.2 [C-]#[N+]CCF Amb25246985 [1,0,0,0,0,0|2,0,1]=4 636 B4R0.2 [C-]#[N+]CCN Amb28047270 [1,0,0,0,0,0|2,0,1]=4 637 B4R0.2 [SiH3]CCCCl Amb28346288 [1,0,0,0,0,0|1,1,1]=4 638 B6R0.1 C#CC(=O)CSC Amb27667610 [0,1,0,0,0,0|1,0,2]=4 639 B6R0.1 C#CC(Br)CC=C Amb28283588 [0,1,0,0,0,0|2,0,1]=4 640 B6R0.1 C#CC(C)CCC Amb22045137 [0,1,0,0,0,0|2,0,1]=4 641 B6R0.1 C#CC(C)CNC Amb26381869 [0,1,0,0,0,0|2,0,1]=4 642 B6R0.1 C#CC(C)COC Amb24734272 [0,1,0,0,0,0|1,1,1]=4 643 B6R0.1 C#CC(C)CSC Amb33271732 [0,1,0,0,0,0|1,0,1]=3 644 B6R0.1 C#CC(N)CCC Amb27392611 [0,1,0,0,0,0|2,0,1]=4 645 B6R0.1 C#CC(N)CCC Amb33329330 [0,1,0,0,0,0|2,0,1]=4 646 B6R0.1 C#CC(N)COC Amb25691561 [0,1,0,0,0,0|1,1,1]=4 647 B6R0.1 C#CC(N)CSC Amb26867955 [0,1,0,0,0,0|1,0,1]=3 648 B6R0.1 C#CC(O)CCC Amb4034577 [0,1,0,0,0,0|2,0,1]=4 649 B6R0.1 C#CC(O)CNC Amb28050202 [0,1,0,0,0,0|2,0,1]=4 650 B6R0.1 C#CC(O)CSC Amb27229535 [0,1,0,0,0,0|1,0,1]=3 651 B6R0.1 C#CCC(C)CC Amb22229837 [0,1,0,0,0,0|2,0,1]=4 652 B6R0.1 C#CCC(C)NC Amb18959778 [0,1,0,0,0,0|2,0,1]=4 653 B6R0.1 C#CCC(C)NC Amb33734467 [0,1,0,0,0,0|2,0,1]=4 654 B6R0.1 C#CCC(N)CC Amb18959775 [0,1,0,0,0,0|2,0,1]=4 655 B6R0.1 C#CCC(O)C=C Amb17593057 [0,1,0,0,0,0|2,0,1]=4 656 B6R0.1 C#CCC(O)C=O Amb27838261 [0,1,0,0,0,0|1,0,1]=3 657 B6R0.1 C#CC[C@@H](O)CC Amb27780670 [0,1,0,0,0,0|2,0,1]=4 658 B6R0.1 C#CC[C@H](O)C=C Amb27835235 [0,1,0,0,0,0|2,0,1]=4 659 B6R0.1 C#C[C@@H](N)CCC Amb27467403 [0,1,0,0,0,0|2,0,1]=4 660 B6R0.1 C#C[C@@H](O)CC=C Amb28184995 [0,1,0,0,0,0|2,0,1]=4 661 B6R0.1 C#C[C@@H](O)CCC Amb26381982 [0,1,0,0,0,0|2,0,1]=4 662 B6R0.1 C#C[C@H](O)CCC Amb26865453 [0,1,0,0,0,0|2,0,1]=4 663 B6R0.1 C=C(C=O)CCF Amb28253937 [0,1,0,0,0,0|2,0,1]=4 664 B6R0.1 C=C(C=O)COC Amb28066424 [0,1,0,0,0,0|0,1,1]=3 665 B6R0.1 C=C(C=O)SCC Amb28050273 [0,1,0,0,0,0|2,0,1]=4 666 B6R0.1 C=C(CBr)CSC Amb33007144 [0,1,0,0,0,0|1,0,2]=4 667 B6R0.1 C=C(CCl)CSC Amb27242862 [0,1,0,0,0,0|1,0,2]=4 668 B6R0.1 C=C(CN)CSC Amb25048378 [0,1,0,0,0,0|1,0,2]=4 669 B6R0.1 C=CC(=O)CCC Amb8630773 [0,1,0,0,0,0|2,0,1]=4 670 B6R0.1 C=CC(=O)COC Amb22168158 [0,1,0,0,0,0|1,1,1]=4 671 B6R0.1 C=CC(=O)CSC Amb26974013 [0,1,0,0,0,0|1,0,1]=3 672 B6R0.1 C=CC(C)CC=O Amb18120863 [0,1,0,0,0,0|1,0,1]=3 673 B6R0.1 C=CC(C)CCBr Amb25888332 [0,1,0,0,0,0|3,0,0]=4 674 B6R0.1 C=CC(C)CCC Amb4019542 [0,1,0,0,0,0|2,0,0]=3 675 B6R0.1 C=CC(C)CCN Amb27950155 [0,1,0,0,0,0|3,0,0]=4 676 B6R0.1 C=CC(C)CCO Amb22641463 [0,1,0,0,0,0|3,0,0]=4 677 B6R0.1 C=CC(C)CNC Amb18523792 [0,1,0,0,0,0|2,0,0]=3 678 B6R0.1 C=CC(C)CNC Amb32729380 [0,1,0,0,0,0|2,0,0]=3 679 B6R0.1 C=CC(C)NC=O Amb27211656 [0,1,0,0,0,0|2,0,1]=4 680 B6R0.1 C=CC(C)OCC Amb33425058 [0,1,0,0,0,0|3,0,0]=4 681 B6R0.1 C=CC(N)CCC Amb27814468 [0,1,0,0,0,0|2,0,0]=3 682 B6R0.1 C=CC(N)CCO Amb22496689 [0,1,0,0,0,0|3,0,0]=4 683 B6R0.1 C=CC(N)COC Amb25252949 [0,1,0,0,0,0|1,1,0]=3 684 B6R0.1 C=CC(O)C#CC Amb28188930 [0,1,0,0,0,0|2,0,1]=4 685 B6R0.1 C=CC(O)CC#N Amb18638932 [0,1,0,0,0,0|3,0,0]=4 686 B6R0.1 C=CC(O)CC=O Amb27401128 [0,1,0,0,0,0|1,0,1]=3 687 B6R0.1 C=CC(O)CCBr Amb2720722 [0,1,0,0,0,0|3,0,0]=4 688 B6R0.1 C=CC(O)CCC Amb22002474 [0,1,0,0,0,0|2,0,0]=3 689 B6R0.1 C=CC(O)CCF Amb33480803 [0,1,0,0,0,0|3,0,0]=4 690 B6R0.1 C=CC(O)CCO Amb27978087 [0,1,0,0,0,0|3,0,0]=4 691 B6R0.1 C=CC(O)COC Amb26347976 [0,1,0,0,0,0|1,1,0]=3 692 B6R0.1 C=CC(O)CSC Amb25969067 [0,1,0,0,0,0|1,0,0]=2 693 B6R0.1 C=CCC(=C)C=O Amb18120415 [0,1,0,0,0,0|1,0,2]=4 694 B6R0.1 C=CCC(=O)CC Amb27173052 [0,1,0,0,0,0|2,0,1]=4 695 B6R0.1 C=CCC(=O)NC Amb24479782 [0,1,0,0,0,0|2,0,1]=4 696 B6R0.1 C=CCC(C)C=C Amb25705690 [0,1,0,0,0,0|2,0,1]=4 697 B6R0.1 C=CCC(C)C=O Amb4358618 [0,1,0,0,0,0|1,0,1]=3 698 B6R0.1 C=CCC(C)CBr Amb24740775 [0,1,0,0,0,0|3,0,0]=4 699 B6R0.1 C=CCC(C)CC Amb4019543 [0,1,0,0,0,0|2,0,0]=3 700 B6R0.1 C=CCC(C)CCl Amb26036596 [0,1,0,0,0,0|3,0,0]=4 701 B6R0.1 C=CCC(C)CI Amb27838209 [0,1,0,0,0,0|3,0,0]=4 702 B6R0.1 C=CCC(C)CO Amb17593084 [0,1,0,0,0,0|3,0,0]=4 703 B6R0.1 C=CCC(C)NC Amb18292023 [0,1,0,0,0,0|2,0,0]=3 704 B6R0.1 C=CCC(Cl)C=C Amb25115865 [0,1,0,0,0,0|2,0,1]=4 705 B6R0.1 C=CCC(N)CC Amb18977592 [0,1,0,0,0,0|2,0,0]=3 706 B6R0.1 C=CCC(N)CC Amb22831631 [0,1,0,0,0,0|2,0,0]=3 707 B6R0.1 C=CCC(N)CO Amb24745656 [0,1,0,0,0,0|3,0,0]=4 708 B6R0.1 C=CCC(N)CO Amb33548733 [0,1,0,0,0,0|3,0,0]=4 709 B6R0.1 C=CCC(O)C#N Amb27775826 [0,1,0,0,0,0|3,0,0]=4 710 B6R0.1 C=CCC(O)C=C Amb8513481 [0,1,0,0,0,0|2,0,1]=4 711 B6R0.1 C=CCC(O)CC Amb22734219 [0,1,0,0,0,0|2,0,0]=3 712 B6R0.1 C=CCC(O)CN Amb22304831 [0,1,0,0,0,0|3,0,0]=4 713 B6R0.1 C=CC[C@@H](C)CN Amb25836360 [0,1,0,0,0,0|3,0,0]=4 714 B6R0.1 C=CC[C@@H](N)C=C Amb27213303 [0,1,0,0,0,0|2,0,1]=4 715 B6R0.1 C=CC[C@@H](N)CN Amb27803095 [0,1,0,0,0,0|3,0,0]=4 716 B6R0.1 C=CC[C@@H](N)CO Amb24088744 [0,1,0,0,0,0|3,0,0]=4 717 B6R0.1 C=CC[C@@H](N)CO Amb27495413 [0,1,0,0,0,0|3,0,0]=4 718 B6R0.1 C=CC[C@@H](O)C#N Amb27423320 [0,1,0,0,0,0|3,0,0]=4 719 B6R0.1 C=CC[C@@H](O)C=C Amb27636288 [0,1,0,0,0,0|2,0,1]=4 720 B6R0.1 C=CC[C@@H](O)CO Amb27218592 [0,1,0,0,0,0|3,0,0]=4 721 B6R0.1 C=CC[C@H](C)C=O Amb28050198 [0,1,0,0,0,0|1,0,1]=3 722 B6R0.1 C=CC[C@H](C)CI Amb27838216 [0,1,0,0,0,0|3,0,0]=4 723 B6R0.1 C=CC[C@H](I)C=O Amb28042873 [0,1,0,0,0,0|1,0,1]=3 724 B6R0.1 C=CC[C@H](N)C=C Amb28313731 [0,1,0,0,0,0|2,0,1]=4 725 B6R0.1 C=CC[C@H](N)CO Amb24088875 [0,1,0,0,0,0|3,0,0]=4 726 B6R0.1 C=CC[C@H](N)CO Amb25732908 [0,1,0,0,0,0|3,0,0]=4 727 B6R0.1 C=CC[C@H](O)C#N Amb27647932 [0,1,0,0,0,0|3,0,0]=4 728 B6R0.1 C=CC[C@H](O)CCl Amb22736707 [0,1,0,0,0,0|3,0,0]=4 729 B6R0.1 C=CC[C@H](O)CO Amb27632867 [0,1,0,0,0,0|3,0,0]=4 730 B6R0.1 C=CC\C(C)=C\C Amb24479822 [0,1,0,0,0,0|2,0,1]=4 731 B6R0.1 C=CNC(=N)SC Amb27244029 [0,1,0,0,0,0|2,0,1]=4 732 B6R0.1 C=COC(C)CC Amb27231284 [0,1,0,0,0,0|3,0,0]=4 733 B6R0.1 C=C[C@@H](C)CCBr Amb27484165 [0,1,0,0,0,0|3,0,0]=4 734 B6R0.1 C=C[C@@H](O)CC#N Amb22801169 [0,1,0,0,0,0|3,0,0]=4 735 B6R0.1 C=C[C@@H](O)CCO Amb28318694 [0,1,0,0,0,0|3,0,0]=4 736 B6R0.1 C=C[C@H](C)CC=O Amb28252390 [0,1,0,0,0,0|1,0,1]=3 737 B6R0.1 C=C[C@H](N)CC#N Amb27860467 [0,1,0,0,0,0|3,0,0]=4 738 B6R0.1 C=C[C@H](N)COC Amb28069182 [0,1,0,0,0,0|1,1,0]=3 739 B6R0.1 C=C[C@H](O)CC#N Amb27451609 [0,1,0,0,0,0|3,0,0]=4 740 B6R0.1 CC(C=O)CCBr Amb18126359 [0,1,0,0,0,0|2,0,0]=3 741 B6R0.1 CC(C=O)CCF Amb33196124 [0,1,0,0,0,0|2,0,0]=3 742 B6R0.1 CC(C=O)CCO Amb28208492 [0,1,0,0,0,0|2,0,0]=3 743 B6R0.1 CCC(=O)CSC Amb8393183 [0,1,0,0,0,0|1,0,2]=4 744 B6R0.1 CCC(Br)CCBr Amb23571816 [0,1,0,0,0,0|2,0,1]=4 745 B6R0.1 CCC(Br)COC Amb18182635 [0,1,0,0,0,0|1,1,1]=4 746 B6R0.1 CCC(C)CC#N Amb24117251 [0,1,0,0,0,0|2,0,1]=4 747 B6R0.1 CCC(C)CC=O Amb33542231 [0,1,0,0,0,0|1,0,0]=2 748 B6R0.1 CCC(C)CCBr Amb22641836 [0,1,0,0,0,0|2,0,1]=4 749 B6R0.1 CCC(C)CCCl Amb24478904 [0,1,0,0,0,0|2,0,1]=4 750 B6R0.1 CCC(C)CCN Amb10607691 [0,1,0,0,0,0|2,0,1]=4 751 B6R0.1 CCC(C)CCN Amb33532985 [0,1,0,0,0,0|2,0,1]=4 752 B6R0.1 CCC(C)CCO Amb3939035 [0,1,0,0,0,0|1,0,2]=4 753 B6R0.1 CCC(C)CCS Amb24657421 [0,1,0,0,0,0|1,1,1]=4 754 B6R0.1 CCC(C)CNC Amb19271598 [0,1,0,0,0,0|2,0,1]=4 755 B6R0.1 CCC(C)CNC Amb6719002 [0,1,0,0,0,0|2,0,1]=4 756 B6R0.1 CCC(C)CNN Amb6248017 [0,1,0,0,0,0|3,0,0]=4 757 B6R0.1 CCC(C)CNO Amb25888224 [0,1,0,0,0,0|2,0,1]=4 758 B6R0.1 CCC(C)CON Amb25316087 [0,1,0,0,0,0|3,0,0]=4 759 B6R0.1 CCC(C)CSC Amb28293984 [0,1,0,0,0,0|1,0,1]=3 760 B6R0.1 CCC(C)N=C=O Amb9726165 [0,1,0,0,0,0|2,0,1]=4 761 B6R0.1 CCC(C)NC=O Amb4020746 [0,1,0,0,0,0|2,0,0]=3 762 B6R0.1 CCC(C)OC=O Amb22734039 [0,1,0,0,0,0|2,0,0]=3 763 B6R0.1 CCC(Cl)CC#N Amb28382543 [0,1,0,0,0,0|2,0,1]=4 764 B6R0.1 CCC(Cl)CCCl Amb25977587 [0,1,0,0,0,0|2,0,1]=4 765 B6R0.1 CCC(Cl)CCN Amb28280088 [0,1,0,0,0,0|2,0,1]=4 766 B6R0.1 CCC(Cl)CNC Amb27478265 [0,1,0,0,0,0|2,0,1]=4 767 B6R0.1 CCC(Cl)\C=C\Cl Amb27432413 [0,1,0,0,0,0|2,0,1]=4 768 B6R0.1 CCC(F)CCN Amb24524247 [0,1,0,0,0,0|2,0,1]=4 769 B6R0.1 CCC(I)CC#N Amb27838187 [0,1,0,0,0,0|2,0,1]=4 770 B6R0.1 CCC(N)CC#N Amb8868803 [0,1,0,0,0,0|2,0,1]=4 771 B6R0.1 CCC(N)CCCl Amb27188075 [0,1,0,0,0,0|2,0,1]=4 772 B6R0.1 CCC(N)CCF Amb29869363 [0,1,0,0,0,0|2,0,1]=4 773 B6R0.1 CCC(N)CCN Amb3941697 [0,1,0,0,0,0|2,0,1]=4 774 B6R0.1 CCC(N)CCO Amb18833133 [0,1,0,0,0,0|1,0,2]=4 775 B6R0.1 CCC(N)CNC Amb18290359 [0,1,0,0,0,0|2,0,1]=4 776 B6R0.1 CCC(N)COC Amb33544938 [0,1,0,0,0,0|1,1,1]=4 777 B6R0.1 CCC(N)COC Amb3940014 [0,1,0,0,0,0|1,1,1]=4 778 B6R0.1 CCC(N)CSC Amb17485955 [0,1,0,0,0,0|1,0,1]=3 779 B6R0.1 CCC(O)CC#N Amb8868920 [0,1,0,0,0,0|2,0,1]=4 780 B6R0.1 CCC(O)CC=O Amb27268436 [0,1,0,0,0,0|1,0,0]=2 781 B6R0.1 CCC(O)CCBr Amb24373747 [0,1,0,0,0,0|2,0,1]=4 782 B6R0.1 CCC(O)CCI Amb27470452 [0,1,0,0,0,0|2,0,1]=4 783 B6R0.1 CCC(O)CCN Amb9286193 [0,1,0,0,0,0|2,0,1]=4 784 B6R0.1 CCC(O)CCO Amb28341820 [0,1,0,0,0,0|1,0,2]=4 785 B6R0.1 CCC(O)CCS Amb27170546 [0,1,0,0,0,0|1,1,1]=4 786 B6R0.1 CCC(O)CNC Amb18969632 [0,1,0,0,0,0|2,0,1]=4 787 B6R0.1 CCC(O)CNN Amb32653228 [0,1,0,0,0,0|3,0,0]=4 788 B6R0.1 CCC(O)CNN Amb32664205 [0,1,0,0,0,0|3,0,0]=4 789 B6R0.1 CCC(O)CNN Amb844967 [0,1,0,0,0,0|3,0,0]=4 790 B6R0.1 CCC(O)COC Amb3940162 [0,1,0,0,0,0|1,1,1]=4 791 B6R0.1 CCC(O)NC=O Amb28387408 [0,1,0,0,0,0|2,0,0]=3 792 B6R0.1 CCC(S)CCO Amb26605792 [0,1,0,0,0,0|1,0,2]=4 793 B6R0.1 CCC(S)COC Amb26643953 [0,1,0,0,0,0|1,1,1]=4 794 B6R0.1 CCCC(=O)SC Amb8393184 [0,1,0,0,0,0|1,0,2]=4 795 B6R0.1 CCCC(Br)CC Amb4015488 [0,1,0,0,0,0|2,0,1]=4 796 B6R0.1 CCCC(Br)CN Amb27232719 [0,1,0,0,0,0|2,0,1]=4 797 B6R0.1 CCCC(C)C#N Amb8388945 [0,1,0,0,0,0|2,0,1]=4 798 B6R0.1 CCCC(C)C=O Amb3939898 [0,1,0,0,0,0|1,0,0]=2 799 B6R0.1 CCCC(C)CBr Amb18177792 [0,1,0,0,0,0|2,0,1]=4 800 B6R0.1 CCCC(C)CC Amb22229359 [0,1,0,0,0,0|2,0,1]=4 801 B6R0.1 CCCC(C)CCl Amb8999029 [0,1,0,0,0,0|2,0,1]=4 802 B6R0.1 CCCC(C)CN Amb6718925 [0,1,0,0,0,0|2,0,1]=4 803 B6R0.1 CCCC(C)CO Amb8999036 [0,1,0,0,0,0|1,0,2]=4 804 B6R0.1 CCCC(C)CS Amb25851785 [0,1,0,0,0,0|1,1,1]=4 805 B6R0.1 CCCC(C)NC Amb6250869 [0,1,0,0,0,0|2,0,1]=4 806 B6R0.1 CCCC(C)NC Amb7969691 [0,1,0,0,0,0|2,0,1]=4 807 B6R0.1 CCCC(C)NN Amb6245660 [0,1,0,0,0,0|3,0,0]=4 808 B6R0.1 CCCC(C)OC Amb26319305 [0,1,0,0,0,0|1,1,1]=4 809 B6R0.1 CCCC(C)ON Amb24424249 [0,1,0,0,0,0|3,0,0]=4 810 B6R0.1 CCCC(Cl)C=O Amb18124277 [0,1,0,0,0,0|1,0,0]=2 811 B6R0.1 CCCC(Cl)CC Amb22229268 [0,1,0,0,0,0|2,0,1]=4 812 B6R0.1 CCCC(Cl)CCl Amb20622886 [0,1,0,0,0,0|2,0,1]=4 813 B6R0.1 CCCC(Cl)CO Amb25950697 [0,1,0,0,0,0|1,0,2]=4 814 B6R0.1 CCCC(F)CN Amb25791393 [0,1,0,0,0,0|2,0,1]=4 815 B6R0.1 CCCC(I)CC Amb22733970 [0,1,0,0,0,0|2,0,1]=4 816 B6R0.1 CCCC(I)CO Amb27268581 [0,1,0,0,0,0|1,0,2]=4 817 B6R0.1 CCCC(N)C#N Amb1130677 [0,1,0,0,0,0|2,0,1]=4 818 B6R0.1 CCCC(N)C#N Amb7969786 [0,1,0,0,0,0|2,0,1]=4 819 B6R0.1 CCCC(N)CC Amb13951437 [0,1,0,0,0,0|2,0,1]=4 820 B6R0.1 CCCC(N)CC Amb8869707 [0,1,0,0,0,0|2,0,1]=4 821 B6R0.1 CCCC(N)CN Amb9380663 [0,1,0,0,0,0|2,0,1]=4 822 B6R0.1 CCCC(N)CO Amb3940003 [0,1,0,0,0,0|1,0,2]=4 823 B6R0.1 CCCC(O)C#N Amb9294949 [0,1,0,0,0,0|2,0,1]=4 824 B6R0.1 CCCC(O)CBr Amb24365915 [0,1,0,0,0,0|2,0,1]=4 825 B6R0.1 CCCC(O)CC Amb4037277 [0,1,0,0,0,0|2,0,1]=4 826 B6R0.1 CCCC(O)CCl Amb24470722 [0,1,0,0,0,0|2,0,1]=4 827 B6R0.1 CCCC(O)CF Amb26604826 [0,1,0,0,0,0|2,0,1]=4 828 B6R0.1 CCCC(O)CN Amb8630337 [0,1,0,0,0,0|2,0,1]=4 829 B6R0.1 CCCC(O)CO Amb8385613 [0,1,0,0,0,0|1,0,2]=4 830 B6R0.1 CCCC(O)OC Amb27447501 [0,1,0,0,0,0|1,1,1]=4 831 B6R0.1 CCCC(S)CC Amb24507410 [0,1,0,0,0,0|2,0,1]=4 832 B6R0.1 CCCN(C)N=O Amb25231763 [0,1,0,0,0,0|3,0,0]=4 833 B6R0.1 CCCN(N)C=O Amb18121867 [0,1,0,0,0,0|2,0,0]=3 834 B6R0.1 CCC[C@@H](C)CBr Amb27433917 [0,1,0,0,0,0|2,0,1]=4 835 B6R0.1 CCC[C@@H](C)CN Amb27473241 [0,1,0,0,0,0|2,0,1]=4 836 B6R0.1 CCC[C@@H](C)CO Amb22823174 [0,1,0,0,0,0|1,0,2]=4 837 B6R0.1 CCC[C@@H](N)CF Amb33624250 [0,1,0,0,0,0|2,0,1]=4 838 B6R0.1 CCC[C@@H](N)CO Amb22756532 [0,1,0,0,0,0|1,0,2]=4 839 B6R0.1 CCC[C@@H](N)CO Amb3941479 [0,1,0,0,0,0|1,0,2]=4 840 B6R0.1 CCC[C@@H](O)CC Amb25781736 [0,1,0,0,0,0|2,0,1]=4 841 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [0,1,0,0,0,0|2,0,1]=4 842 B6R0.1 CCC[C@@H](O)CN Amb24428580 [0,1,0,0,0,0|2,0,1]=4 843 B6R0.1 CCC[C@H](C)C=O Amb28248332 [0,1,0,0,0,0|1,0,0]=2 844 B6R0.1 CCC[C@H](C)CCl Amb27620529 [0,1,0,0,0,0|2,0,1]=4 845 B6R0.1 CCC[C@H](C)CN Amb27795765 [0,1,0,0,0,0|2,0,1]=4 846 B6R0.1 CCC[C@H](C)CO Amb27423081 [0,1,0,0,0,0|1,0,2]=4 847 B6R0.1 CCC[C@H](F)C=O Amb27644096 [0,1,0,0,0,0|1,0,0]=2 848 B6R0.1 CCC[C@H](N)C=O Amb27488589 [0,1,0,0,0,0|1,0,0]=2 849 B6R0.1 CCC[C@H](N)CF Amb27430280 [0,1,0,0,0,0|2,0,1]=4 850 B6R0.1 CCC[C@H](N)CO Amb33869036 [0,1,0,0,0,0|1,0,2]=4 851 B6R0.1 CCC[C@H](N)CO Amb3941480 [0,1,0,0,0,0|1,0,2]=4 852 B6R0.1 CCC[C@H](O)CC Amb26022373 [0,1,0,0,0,0|2,0,1]=4 853 B6R0.1 CCC[C@H](O)CCl Amb22735942 [0,1,0,0,0,0|2,0,1]=4 854 B6R0.1 CCC[C@H](O)CF Amb28348521 [0,1,0,0,0,0|2,0,1]=4 855 B6R0.1 CCC[C@H](O)CN Amb33204239 [0,1,0,0,0,0|2,0,1]=4 856 B6R0.1 CCOC(=O)C=O Amb8394919 [0,1,0,0,0,0|2,0,1]=4 857 B6R0.1 CCON(C)C=O Amb28247969 [0,1,0,0,0,0|3,0,0]=4 858 B6R0.1 CCSC(=O)C=O Amb27403471 [0,1,0,0,0,0|2,0,1]=4 859 B6R0.1 CCSC(C)C=O Amb28050282 [0,1,0,0,0,0|2,0,0]=3 860 B6R0.1 CC[C@@H](C)CC#N Amb27160837 [0,1,0,0,0,0|2,0,1]=4 861 B6R0.1 CC[C@@H](C)CCO Amb22800733 [0,1,0,0,0,0|1,0,2]=4 862 B6R0.1 CC[C@@H](N)CC#N Amb8384242 [0,1,0,0,0,0|2,0,1]=4 863 B6R0.1 CC[C@@H](N)COC Amb22755736 [0,1,0,0,0,0|1,1,1]=4 864 B6R0.1 CC[C@@H](N)COC Amb24479069 [0,1,0,0,0,0|1,1,1]=4 865 B6R0.1 CC[C@@H](O)CC#N Amb26324104 [0,1,0,0,0,0|2,0,1]=4 866 B6R0.1 CC[C@@H](O)CC=O Amb28287324 [0,1,0,0,0,0|1,0,0]=2 867 B6R0.1 CC[C@@H](O)CCN Amb26633884 [0,1,0,0,0,0|2,0,1]=4 868 B6R0.1 CC[C@@H](O)CCO Amb27448609 [0,1,0,0,0,0|1,0,2]=4 869 B6R0.1 CC[C@@H](S)CCO Amb27662308 [0,1,0,0,0,0|1,0,2]=4 870 B6R0.1 CC[C@H](C)CCBr Amb27391660 [0,1,0,0,0,0|2,0,1]=4 871 B6R0.1 CC[C@H](C)CCI Amb27838223 [0,1,0,0,0,0|2,0,1]=4 872 B6R0.1 CC[C@H](C)CCO Amb24333653 [0,1,0,0,0,0|1,0,2]=4 873 B6R0.1 CC[C@H](N)CC#N Amb19884025 [0,1,0,0,0,0|2,0,1]=4 874 B6R0.1 CC[C@H](N)COC Amb27601302 [0,1,0,0,0,0|1,1,1]=4 875 B6R0.1 CC[C@H](N)COC Amb33339278 [0,1,0,0,0,0|1,1,1]=4 876 B6R0.1 CC[C@H](N)CSC Amb27248591 [0,1,0,0,0,0|1,0,1]=3 877 B6R0.1 CC[C@H](O)CC#N Amb27960298 [0,1,0,0,0,0|2,0,1]=4 878 B6R0.1 CC[C@H](O)CCN Amb25284469 [0,1,0,0,0,0|2,0,1]=4 879 B6R0.1 CC[C@H](O)CCO Amb27757196 [0,1,0,0,0,0|1,0,2]=4 880 B6R0.1 CC[C@H](O)CSC Amb28349605 [0,1,0,0,0,0|1,0,1]=3 881 B6R0.1 CC\C(C)=C\C=O Amb28251868 [0,1,0,0,0,0|1,0,2]=4 882 B6R0.1 CC\C(Cl)=C\C=O Amb28202587 [0,1,0,0,0,0|1,0,2]=4 883 B6R0.1 CC\C=C(/C)C=O Amb3940425 [0,1,0,0,0,0|1,0,2]=4 884 B6R0.1 CC\C=C(/Cl)C=O Amb28050393 [0,1,0,0,0,0|1,0,2]=4 885 B6R0.1 CC\C=C(/O)C=O Amb27849683 [0,1,0,0,0,0|1,0,2]=4 886 B6R0.1 CC\C=C(\O)C=O Amb27195226 [0,1,0,0,0,0|1,0,2]=4 887 B6R0.1 CN(C=O)CCO Amb25849655 [0,1,0,0,0,0|3,0,0]=4 888 B6R0.1 CN(CC=O)N=O Amb27830130 [0,1,0,0,0,0|3,0,0]=4 889 B6R0.1 CNC(C)CC#N Amb18540665 [0,1,0,0,0,0|2,0,1]=4 890 B6R0.1 CNC(C)CCO Amb8428169 [0,1,0,0,0,0|1,0,2]=4 891 B6R0.1 CNC(C)COC Amb33544775 [0,1,0,0,0,0|2,1,0]=4 892 B6R0.1 CNC(C)COC Amb6708747 [0,1,0,0,0,0|2,1,0]=4 893 B6R0.1 CNC(C)CSC Amb18300373 [0,1,0,0,0,0|2,0,0]=3 894 B6R0.1 CNCC(C)C#N Amb7969862 [0,1,0,0,0,0|2,0,1]=4 895 B6R0.1 CNCC(C)CCl Amb27974468 [0,1,0,0,0,0|2,0,1]=4 896 B6R0.1 CNCC(C)CN Amb18300042 [0,1,0,0,0,0|2,0,1]=4 897 B6R0.1 CNCC(C)CO Amb17569890 [0,1,0,0,0,0|1,0,2]=4 898 B6R0.1 CNCC(C)NC Amb18993072 [0,1,0,0,0,0|3,0,0]=4 899 B6R0.1 CNCC(C)NN Amb18640298 [0,1,0,0,0,0|3,0,0]=4 900 B6R0.1 CNCC(C)OC Amb19959922 [0,1,0,0,0,0|2,1,0]=4 901 B6R0.1 CNCC(C)OC Amb2785993 [0,1,0,0,0,0|2,1,0]=4 902 B6R0.1 CNCC(C)SC Amb18299459 [0,1,0,0,0,0|2,0,0]=3 903 B6R0.1 CNCC(F)CO Amb27953011 [0,1,0,0,0,0|1,0,2]=4 904 B6R0.1 CNCC(O)CCl Amb18124297 [0,1,0,0,0,0|2,0,1]=4 905 B6R0.1 CNCC(O)CF Amb25142450 [0,1,0,0,0,0|2,0,1]=4 906 B6R0.1 CNCC(O)CN Amb18061855 [0,1,0,0,0,0|2,0,1]=4 907 B6R0.1 CNCC(O)CO Amb535457 [0,1,0,0,0,0|1,0,2]=4 908 B6R0.1 CNC[C@@H](C)OC Amb35633977 [0,1,0,0,0,0|2,1,0]=4 909 B6R0.1 CNC[C@@H](O)CCl Amb27391222 [0,1,0,0,0,0|2,0,1]=4 910 B6R0.1 CNC[C@@H](O)CO Amb25691371 [0,1,0,0,0,0|1,0,2]=4 911 B6R0.1 CNC[C@H](C)NC Amb27668404 [0,1,0,0,0,0|3,0,0]=4 912 B6R0.1 CNC[C@H](C)OC Amb35637318 [0,1,0,0,0,0|2,1,0]=4 913 B6R0.1 CNC[C@H](O)CO Amb28050008 [0,1,0,0,0,0|1,0,2]=4 914 B6R0.1 CNC\C(C)=C\Br Amb27958846 [0,1,0,0,0,0|2,0,1]=4 915 B6R0.1 CNC\C(C)=C\Cl Amb27857601 [0,1,0,0,0,0|2,0,1]=4 916 B6R0.1 CN[C@@H](C)CCN Amb28424262 [0,1,0,0,0,0|2,0,1]=4 917 B6R0.1 CN[C@H](C)COC Amb32679593 [0,1,0,0,0,0|2,1,0]=4 918 B6R0.1 CN[C@H](C)COC Amb32679594 [0,1,0,0,0,0|2,1,0]=4 919 B6R0.1 COC(=O)CC=O Amb18199826 [0,1,0,0,0,0|0,1,1]=3 920 B6R0.1 COC(=O)CSC Amb2689527 [0,1,0,0,0,0|2,0,1]=4 921 B6R0.1 COC(C)CC#N Amb20622879 [0,1,0,0,0,0|1,1,1]=4 922 B6R0.1 COC(C)CC=O Amb17593089 [0,1,0,0,0,0|0,1,0]=2 923 B6R0.1 COC(C)CCBr Amb22227890 [0,1,0,0,0,0|1,1,1]=4 924 B6R0.1 COC(C)CCN Amb21961545 [0,1,0,0,0,0|1,1,1]=4 925 B6R0.1 COC(C)CCN Amb33537917 [0,1,0,0,0,0|1,1,1]=4 926 B6R0.1 COC(C)CCO Amb3939327 [0,1,0,0,0,0|0,1,2]=4 927 B6R0.1 COC(C)CNN Amb28060369 [0,1,0,0,0,0|2,1,0]=4 928 B6R0.1 COC(C)CNO Amb27841478 [0,1,0,0,0,0|1,1,1]=4 929 B6R0.1 COC(C)CON Amb18640476 [0,1,0,0,0,0|2,1,0]=4 930 B6R0.1 COCC(Br)CF Amb32863275 [0,1,0,0,0,0|1,1,1]=4 931 B6R0.1 COCC(Br)CN Amb27600803 [0,1,0,0,0,0|1,1,1]=4 932 B6R0.1 COCC(C)C#N Amb9028551 [0,1,0,0,0,0|1,1,1]=4 933 B6R0.1 COCC(C)C=O Amb33545315 [0,1,0,0,0,0|0,1,0]=2 934 B6R0.1 COCC(C)CBr Amb24332722 [0,1,0,0,0,0|1,1,1]=4 935 B6R0.1 COCC(C)CCl Amb24393321 [0,1,0,0,0,0|1,1,1]=4 936 B6R0.1 COCC(C)CN Amb33109763 [0,1,0,0,0,0|1,1,1]=4 937 B6R0.1 COCC(C)CN Amb9029115 [0,1,0,0,0,0|1,1,1]=4 938 B6R0.1 COCC(C)CO Amb33545253 [0,1,0,0,0,0|0,1,2]=4 939 B6R0.1 COCC(C)CS Amb28050087 [0,1,0,0,0,0|0,2,1]=4 940 B6R0.1 COCC(C)NN Amb27227840 [0,1,0,0,0,0|2,1,0]=4 941 B6R0.1 COCC(C)NN Amb32941836 [0,1,0,0,0,0|2,1,0]=4 942 B6R0.1 COCC(C)ON Amb25680505 [0,1,0,0,0,0|2,1,0]=4 943 B6R0.1 COCC(Cl)C#N Amb18123371 [0,1,0,0,0,0|1,1,1]=4 944 B6R0.1 COCC(Cl)CN Amb28060609 [0,1,0,0,0,0|1,1,1]=4 945 B6R0.1 COCC(Cl)OC Amb27865391 [0,1,0,0,0,0|2,1,0]=4 946 B6R0.1 COCC(F)CN Amb25888441 [0,1,0,0,0,0|1,1,1]=4 947 B6R0.1 COCC(F)CN Amb33532421 [0,1,0,0,0,0|1,1,1]=4 948 B6R0.1 COCC(F)CO Amb28069627 [0,1,0,0,0,0|0,1,2]=4 949 B6R0.1 COCC(N)C#N Amb18957614 [0,1,0,0,0,0|1,1,1]=4 950 B6R0.1 COCC(N)C#N Amb28555341 [0,1,0,0,0,0|1,1,1]=4 951 B6R0.1 COCC(N)CN Amb24655567 [0,1,0,0,0,0|1,1,1]=4 952 B6R0.1 COCC(N)CO Amb28827629 [0,1,0,0,0,0|0,1,2]=4 953 B6R0.1 COCC(N)CO Amb8630413 [0,1,0,0,0,0|0,1,2]=4 954 B6R0.1 COCC(O)C#N Amb25829809 [0,1,0,0,0,0|1,1,1]=4 955 B6R0.1 COCC(O)CBr Amb27657586 [0,1,0,0,0,0|1,1,1]=4 956 B6R0.1 COCC(O)CCl Amb4020145 [0,1,0,0,0,0|1,1,1]=4 957 B6R0.1 COCC(O)CF Amb27591565 [0,1,0,0,0,0|1,1,1]=4 958 B6R0.1 COCC(O)CN Amb2693569 [0,1,0,0,0,0|1,1,1]=4 959 B6R0.1 COCC(O)CN Amb9708595 [0,1,0,0,0,0|1,1,1]=4 960 B6R0.1 COCC(O)CO Amb8396813 [0,1,0,0,0,0|0,1,2]=4 961 B6R0.1 COCC(O)CS Amb27808403 [0,1,0,0,0,0|0,2,1]=4 962 B6R0.1 COCC(S)CN Amb29854739 [0,1,0,0,0,0|1,1,1]=4 963 B6R0.1 COC[C@@H](N)CF Amb35788510 [0,1,0,0,0,0|1,1,1]=4 964 B6R0.1 COC[C@@H](N)CF Amb35789440 [0,1,0,0,0,0|1,1,1]=4 965 B6R0.1 COC[C@@H](N)CO Amb31291244 [0,1,0,0,0,0|0,1,2]=4 966 B6R0.1 COC[C@@H](N)CO Amb8385867 [0,1,0,0,0,0|0,1,2]=4 967 B6R0.1 COC[C@@H](O)C=O Amb28132745 [0,1,0,0,0,0|0,1,0]=2 968 B6R0.1 COC[C@@H](O)CF Amb35752318 [0,1,0,0,0,0|1,1,1]=4 969 B6R0.1 COC[C@@H](O)CN Amb17933201 [0,1,0,0,0,0|1,1,1]=4 970 B6R0.1 COC[C@@H](O)CN Amb32992071 [0,1,0,0,0,0|1,1,1]=4 971 B6R0.1 COC[C@@H](O)CS Amb25734342 [0,1,0,0,0,0|0,2,1]=4 972 B6R0.1 COC[C@H](C)CCl Amb27174445 [0,1,0,0,0,0|1,1,1]=4 973 B6R0.1 COC[C@H](F)CN Amb27635916 [0,1,0,0,0,0|1,1,1]=4 974 B6R0.1 COC[C@H](N)CF Amb35789441 [0,1,0,0,0,0|1,1,1]=4 975 B6R0.1 COC[C@H](N)CF Amb35789446 [0,1,0,0,0,0|1,1,1]=4 976 B6R0.1 COC[C@H](N)CN Amb27790030 [0,1,0,0,0,0|1,1,1]=4 977 B6R0.1 COC[C@H](N)CO Amb26597391 [0,1,0,0,0,0|0,1,2]=4 978 B6R0.1 COC[C@H](O)C=O Amb27838256 [0,1,0,0,0,0|0,1,0]=2 979 B6R0.1 COC[C@H](O)CF Amb35750954 [0,1,0,0,0,0|1,1,1]=4 980 B6R0.1 COC[C@H](O)CN Amb8630371 [0,1,0,0,0,0|1,1,1]=4 981 B6R0.1 CO\C=C(/Br)C=O Amb28198038 [0,1,0,0,0,0|0,1,2]=4 982 B6R0.1 CO\C=C(/F)C=O Amb27831789 [0,1,0,0,0,0|0,1,2]=4 983 B6R0.1 CO\C=C(/O)C=O Amb27797385 [0,1,0,0,0,0|0,1,2]=4 984 B6R0.1 CO\C=C(\F)C=O Amb27875481 [0,1,0,0,0,0|0,1,2]=4 985 B6R0.1 CSC(=O)CCO Amb27662309 [0,1,0,0,0,0|0,0,3]=4 986 B6R0.1 CSC(C)CC=O Amb8393182 [0,1,0,0,0,0|0,0,0]=1 987 B6R0.1 CSC(C)CCN Amb13952574 [0,1,0,0,0,0|1,0,1]=3 988 B6R0.1 CSC(C)CCO Amb27231283 [0,1,0,0,0,0|0,0,2]=3 989 B6R0.1 CSCC(=O)CCl Amb25965373 [0,1,0,0,0,0|1,0,2]=4 990 B6R0.1 CSCC(=O)CN Amb33225415 [0,1,0,0,0,0|1,0,2]=4 991 B6R0.1 CSCC(=O)NN Amb22058723 [0,1,0,0,0,0|2,0,1]=4 992 B6R0.1 CSCC(=O)NO Amb28057751 [0,1,0,0,0,0|1,0,2]=4 993 B6R0.1 CSCC(C)C#N Amb26636150 [0,1,0,0,0,0|1,0,1]=3 994 B6R0.1 CSCC(C)C=O Amb20621025 [0,1,0,0,0,0|0,0,0]=1 995 B6R0.1 CSCC(C)CBr Amb25861163 [0,1,0,0,0,0|1,0,1]=3 996 B6R0.1 CSCC(C)CCl Amb28398290 [0,1,0,0,0,0|1,0,1]=3 997 B6R0.1 CSCC(C)CN Amb18970333 [0,1,0,0,0,0|1,0,1]=3 998 B6R0.1 CSCC(C)CO Amb33530103 [0,1,0,0,0,0|0,0,2]=3 999 B6R0.1 CSCC(C)NN Amb27488619 [0,1,0,0,0,0|2,0,0]=3 1000 B6R0.1 CSCC(C)ON Amb33271740 [0,1,0,0,0,0|2,0,0]=3 1001 B6R0.1 CSCC(F)CN Amb33225456 [0,1,0,0,0,0|1,0,1]=3 1002 B6R0.1 CSCC(N)CO Amb18642038 [0,1,0,0,0,0|0,0,2]=3 1003 B6R0.1 CSCC(O)C=O Amb27438538 [0,1,0,0,0,0|0,0,0]=1 1004 B6R0.1 CSCC(O)CBr Amb28133716 [0,1,0,0,0,0|1,0,1]=3 1005 B6R0.1 CSCC(O)CCl Amb17593559 [0,1,0,0,0,0|1,0,1]=3 1006 B6R0.1 CSCC(O)CF Amb26450105 [0,1,0,0,0,0|1,0,1]=3 1007 B6R0.1 CSCC(O)CN Amb18523764 [0,1,0,0,0,0|1,0,1]=3 1008 B6R0.1 CSCC(O)CO Amb26908305 [0,1,0,0,0,0|0,0,2]=3 1009 B6R0.1 CSCC(S)CO Amb35752151 [0,1,0,0,0,0|0,0,2]=3 1010 B6R0.1 CSC[C@@H](N)CO Amb24479894 [0,1,0,0,0,0|0,0,2]=3 1011 B6R0.1 CSC[C@@H](O)CN Amb25220971 [0,1,0,0,0,0|1,0,1]=3 1012 B6R0.1 CSC[C@H](N)CO Amb27229163 [0,1,0,0,0,0|0,0,2]=3 1013 B6R0.1 CSC[C@H](O)CN Amb25226300 [0,1,0,0,0,0|1,0,1]=3 1014 B6R0.1 CSC\C(N)=N\N Amb28458092 [0,1,0,0,0,0|2,0,1]=4 1015 B6R0.1 CSC\C(N)=N\O Amb8385720 [0,1,0,0,0,0|1,0,2]=4 1016 B6R0.1 C[C@@H](C=O)CCO Amb27394744 [0,1,0,0,0,0|2,0,0]=3 1017 B6R0.1 C[C@@H](C=O)N=[N+]=[N-] Amb27875198 [0,1,0,0,0,0|3,0,0]=4 1018 B6R0.1 C[C@@H](CO)CC=O Amb27227155 [0,1,0,0,0,0|2,0,0]=3 1019 B6R0.1 C[C@H](C=O)CCCl Amb28252660 [0,1,0,0,0,0|2,0,0]=3 1020 B6R0.1 C[C@H](C=O)CCO Amb27260814 [0,1,0,0,0,0|2,0,0]=3 1021 B6R0.1 C[C@H](CO)NC=O Amb27654572 [0,1,0,0,0,0|3,0,0]=4 1022 B6R0.1 C[SiH2]CC(C)CCl Amb27228579 [0,1,0,0,0,0|2,0,1]=4 1023 B6R0.1 C\C=C(/C)CC=O Amb18120886 [0,1,0,0,0,0|1,0,1]=3 1024 B6R0.1 C\C=C(/C)CCC Amb25744974 [0,1,0,0,0,0|2,0,1]=4 1025 B6R0.1 C\C=C(/C)CNC Amb28241639 [0,1,0,0,0,0|2,0,1]=4 1026 B6R0.1 C\C=C/C(C)CC Amb4019547 [0,1,0,0,0,0|2,0,1]=4 1027 B6R0.1 C\C=C/[C@H](C)NC Amb27848817 [0,1,0,0,0,0|2,0,1]=4 1028 B6R0.1 C\C=C\C(=O)C=O Amb27838207 [0,1,0,0,0,0|1,0,2]=4 1029 B6R0.1 C\C=C\C(Br)CC Amb28121149 [0,1,0,0,0,0|2,0,1]=4 1030 B6R0.1 C\C=C\C(C)CC Amb22232014 [0,1,0,0,0,0|2,0,1]=4 1031 B6R0.1 C\C=C\C(C)NC Amb18639480 [0,1,0,0,0,0|2,0,1]=4 1032 B6R0.1 C\C=C\C(C)OC Amb27473820 [0,1,0,0,0,0|1,1,1]=4 1033 B6R0.1 C\C=C\C(Cl)CC Amb26441343 [0,1,0,0,0,0|2,0,1]=4 1034 B6R0.1 C\C=C\C(N)CC Amb27818157 [0,1,0,0,0,0|2,0,1]=4 1035 B6R0.1 C\C=C\C(O)CC Amb22731799 [0,1,0,0,0,0|2,0,1]=4 1036 B6R0.1 C\C=C\[C@@H](N)CC Amb27852159 [0,1,0,0,0,0|2,0,1]=4 1037 B6R0.1 C\C=N\N(C)C=O Amb10843590 [0,1,0,0,0,0|3,0,0]=4 1038 B6R0.1 N#CCC(O)C=O Amb28370523 [0,1,0,0,0,0|2,0,0]=3 1039 B6R0.1 NC(C=O)CC=O Amb27872844 [0,1,0,0,0,0|2,0,0]=3 1040 B6R0.1 NCCC(O)C=O Amb25682881 [0,1,0,0,0,0|2,0,0]=3 1041 B6R0.1 O=CC(=O)CCO Amb28050238 [0,1,0,0,0,0|2,0,1]=4 1042 B6R0.1 O=CC(Br)CCO Amb28206552 [0,1,0,0,0,0|2,0,0]=3 1043 B6R0.1 O=CC(O)CCBr Amb27838276 [0,1,0,0,0,0|2,0,0]=3 1044 B6R0.1 O=CC(O)CCO Amb27955546 [0,1,0,0,0,0|2,0,0]=3 1045 B6R0.1 O=CCC(F)CF Amb27186291 [0,1,0,0,0,0|2,0,0]=3 1046 B6R0.1 O=CCC(O)C=O Amb28071061 [0,1,0,0,0,0|2,0,0]=3 1047 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [0,1,0,0,0,0|2,0,0]=3 1048 B6R0.1 OCC(O)CSO Amb28455081 [0,1,0,0,0,0|1,0,2]=4 1049 B6R0.1 [C-]#[N+]C(C)CCC Amb3973083 [0,1,0,0,0,0|3,0,0]=4 1050 B6R0.1 [C-]#[N+]C(C)COC Amb33428812 [0,1,0,0,0,0|2,1,0]=4 1051 B6R0.1 [C-]#[N+]C(C)CSC Amb33271174 [0,1,0,0,0,0|2,0,0]=3 1052 B6R0.1 [C-]#[N+]CC(C)CC Amb33373866 [0,1,0,0,0,0|3,0,0]=4 1053 B6R0.4 C#CCCC(=C)C Amb18634222 [0,1,0,0,0,0|2,0,1]=4 1054 B6R0.4 C#CCCC(=O)Cl Amb26949181 [0,1,0,0,0,0|1,0,1]=3 1055 B6R0.4 C#CCCC(=O)O Amb33532622 [0,1,0,0,0,0|1,0,1]=3 1056 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [0,1,0,0,0,0|1,0,1]=3 1057 B6R0.4 C#CCCC(C)=O Amb8869638 [0,1,0,0,0,0|1,0,1]=3 1058 B6R0.4 C#CCCC(C)C Amb4036275 [0,1,0,0,0,0|2,0,1]=4 1059 B6R0.4 C#CCCC(C)N Amb27873806 [0,1,0,0,0,0|2,0,1]=4 1060 B6R0.4 C#CCCC(C)O Amb27175253 [0,1,0,0,0,0|2,0,1]=4 1061 B6R0.4 C#CCCN(C)C Amb24460389 [0,1,0,0,0,0|2,0,1]=4 1062 B6R0.4 C#CCCN(C)C Amb32729352 [0,1,0,0,0,0|2,0,1]=4 1063 B6R0.4 C#CCNC(=O)Br Amb27792816 [0,1,0,0,0,0|2,0,1]=4 1064 B6R0.4 C#CCNC(=O)I Amb27838254 [0,1,0,0,0,0|2,0,1]=4 1065 B6R0.4 C#CCNC(C)=O Amb20623038 [0,1,0,0,0,0|2,0,1]=4 1066 B6R0.4 C#CCNC(N)=O Amb2724225 [0,1,0,0,0,0|2,0,1]=4 1067 B6R0.4 C#CCOC(=O)Cl Amb13777322 [0,1,0,0,0,0|2,0,1]=4 1068 B6R0.4 C#CCOC(C)=O Amb8517415 [0,1,0,0,0,0|2,0,1]=4 1069 B6R0.4 C#CCOC(N)=O Amb26654642 [0,1,0,0,0,0|2,0,1]=4 1070 B6R0.4 C#CCSC(C)=O Amb32683409 [0,1,0,0,0,0|2,0,1]=4 1071 B6R0.4 C#NCCC(C)C Amb31132337 [0,1,0,0,0,0|3,0,0]=4 1072 B6R0.4 C=C(Br)CCCCl Amb28320778 [0,1,0,0,0,0|3,0,0]=4 1073 B6R0.4 C=C(Br)CCCN Amb27219336 [0,1,0,0,0,0|3,0,0]=4 1074 B6R0.4 C=C(Br)CCCO Amb27471781 [0,1,0,0,0,0|3,0,0]=4 1075 B6R0.4 C=C(Br)CSCC Amb28063803 [0,1,0,0,0,0|3,0,0]=4 1076 B6R0.4 C=C(C)C#CC=O Amb28050124 [0,1,0,0,0,0|1,0,2]=4 1077 B6R0.4 C=C(C)CCC#N Amb2778548 [0,1,0,0,0,0|2,0,1]=4 1078 B6R0.4 C=C(C)CCCBr Amb22886717 [0,1,0,0,0,0|2,0,1]=4 1079 B6R0.4 C=C(C)CCCC Amb2721685 [0,1,0,0,0,0|2,0,0]=3 1080 B6R0.4 C=C(C)CCCCl Amb24089299 [0,1,0,0,0,0|2,0,1]=4 1081 B6R0.4 C=C(C)CCCN Amb24761452 [0,1,0,0,0,0|2,0,1]=4 1082 B6R0.4 C=C(C)CCCN Amb33534233 [0,1,0,0,0,0|2,0,1]=4 1083 B6R0.4 C=C(C)CCCO Amb22886814 [0,1,0,0,0,0|1,0,2]=4 1084 B6R0.4 C=C(C)CCCS Amb33198962 [0,1,0,0,0,0|1,1,1]=4 1085 B6R0.4 C=C(C)CCNC Amb18993045 [0,1,0,0,0,0|2,0,0]=3 1086 B6R0.4 C=C(C)CCOC Amb33546340 [0,1,0,0,0,0|1,1,0]=3 1087 B6R0.4 C=C(C)CCON Amb25862621 [0,1,0,0,0,0|2,1,0]=4 1088 B6R0.4 C=C(C)CCSC Amb28400079 [0,1,0,0,0,0|1,0,0]=2 1089 B6R0.4 C=C(C)CN=C=O Amb26456601 [0,1,0,0,0,0|2,0,1]=4 1090 B6R0.4 C=C(C)CNCC Amb3940049 [0,1,0,0,0,0|3,0,0]=4 1091 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [0,1,0,0,0,0|1,0,2]=4 1092 B6R0.4 C=C(Cl)CCCBr Amb25811643 [0,1,0,0,0,0|3,0,0]=4 1093 B6R0.4 C=C(Cl)CCCCl Amb24635037 [0,1,0,0,0,0|3,0,0]=4 1094 B6R0.4 C=C(Cl)CCCN Amb27413032 [0,1,0,0,0,0|3,0,0]=4 1095 B6R0.4 C=C(Cl)CCCO Amb28065233 [0,1,0,0,0,0|3,0,0]=4 1096 B6R0.4 C=C(Cl)CSCC Amb27972493 [0,1,0,0,0,0|3,0,0]=4 1097 B6R0.4 C=C(F)CCCO Amb25811029 [0,1,0,0,0,0|3,0,0]=4 1098 B6R0.4 C=C(I)CCCCl Amb27239930 [0,1,0,0,0,0|3,0,0]=4 1099 B6R0.4 C=C=CCC(=O)O Amb26657414 [0,1,0,0,0,0|1,0,2]=4 1100 B6R0.4 C=CCCB(O)O Amb10067042 [0,1,0,0,0,0|3,0,0]=4 1101 B6R0.4 C=CCCC(=C)C Amb22228883 [0,1,0,0,0,0|2,0,0]=3 1102 B6R0.4 C=CCCC(=N)N Amb25326954 [0,1,0,0,0,0|2,0,1]=4 1103 B6R0.4 C=CCCC(=O)Cl Amb3939003 [0,1,0,0,0,0|1,0,1]=3 1104 B6R0.4 C=CCCC(=O)O Amb3940112 [0,1,0,0,0,0|1,0,1]=3 1105 B6R0.4 C=CCCC(C)=O Amb2721704 [0,1,0,0,0,0|1,0,1]=3 1106 B6R0.4 C=CCCC(C)Br Amb20669632 [0,1,0,0,0,0|2,0,0]=3 1107 B6R0.4 C=CCCC(C)N Amb18121283 [0,1,0,0,0,0|2,0,0]=3 1108 B6R0.4 C=CCCC(C)N Amb35751395 [0,1,0,0,0,0|2,0,0]=3 1109 B6R0.4 C=CCCC(C)O Amb22059013 [0,1,0,0,0,0|2,0,0]=3 1110 B6R0.4 C=CCCC(C)O Amb34915890 [0,1,0,0,0,0|2,0,0]=3 1111 B6R0.4 C=CCCC(C)S Amb17939255 [0,1,0,0,0,0|2,0,0]=3 1112 B6R0.4 C=CCCC(N)=O Amb28136349 [0,1,0,0,0,0|1,0,1]=3 1113 B6R0.4 C=CCCN(C)C Amb27838193 [0,1,0,0,0,0|2,0,0]=3 1114 B6R0.4 C=CCCS(=O)[O-] Amb25680826 [0,1,0,0,0,0|2,0,1]=4 1115 B6R0.4 C=CCC[C@@H](C)O Amb19929324 [0,1,0,0,0,0|2,0,0]=3 1116 B6R0.4 C=CCC[C@H](C)O Amb22226511 [0,1,0,0,0,0|2,0,0]=3 1117 B6R0.4 C=CCNC(C)=N Amb24618156 [0,1,0,0,0,0|3,0,0]=4 1118 B6R0.4 C=CCNC(C)=O Amb5797445 [0,1,0,0,0,0|2,0,1]=4 1119 B6R0.4 C=CCNC(C)C Amb10609485 [0,1,0,0,0,0|3,0,0]=4 1120 B6R0.4 C=CCNC(C)C Amb6683889 [0,1,0,0,0,0|3,0,0]=4 1121 B6R0.4 C=CCNC(C)C Amb8428139 [0,1,0,0,0,0|3,0,0]=4 1122 B6R0.4 C=CCNC(N)=O Amb6599864 [0,1,0,0,0,0|2,0,1]=4 1123 B6R0.4 C=CCOC(=O)Cl Amb6600570 [0,1,0,0,0,0|2,0,1]=4 1124 B6R0.4 C=CCOC(N)=O Amb4017585 [0,1,0,0,0,0|2,0,1]=4 1125 B6R0.4 C=CNCC(=O)O Amb28346027 [0,1,0,0,0,0|2,0,1]=4 1126 B6R0.4 C=COCC(=C)C Amb26873422 [0,1,0,0,0,0|3,0,0]=4 1127 B6R0.4 C=COCC(=O)O Amb27247261 [0,1,0,0,0,0|2,0,1]=4 1128 B6R0.4 C=COCC(C)=O Amb27838258 [0,1,0,0,0,0|2,0,1]=4 1129 B6R0.4 C=COCC(C)C Amb22338580 [0,1,0,0,0,0|3,0,0]=4 1130 B6R0.4 C=COCC(C)C Amb6366362 [0,1,0,0,0,0|3,0,0]=4 1131 B6R0.4 CC#CCC(=O)O Amb17939740 [0,1,0,0,0,0|1,0,1]=3 1132 B6R0.4 CC#CCC(C)=O Amb27648528 [0,1,0,0,0,0|1,0,1]=3 1133 B6R0.4 CC(=O)CC#CO Amb27463647 [0,1,0,0,0,0|2,0,1]=4 1134 B6R0.4 CC(=O)CCC#N Amb17334046 [0,1,0,0,0,0|2,0,0]=3 1135 B6R0.4 CC(=O)CCC=O Amb18639597 [0,1,0,0,0,0|1,0,0]=2 1136 B6R0.4 CC(=O)CCCBr Amb8394105 [0,1,0,0,0,0|2,0,0]=3 1137 B6R0.4 CC(=O)CCCCl Amb3940272 [0,1,0,0,0,0|2,0,0]=3 1138 B6R0.4 CC(=O)CCCF Amb25068187 [0,1,0,0,0,0|2,0,0]=3 1139 B6R0.4 CC(=O)CCCN Amb18121547 [0,1,0,0,0,0|2,0,0]=3 1140 B6R0.4 CC(=O)CCCN Amb32661221 [0,1,0,0,0,0|2,0,0]=3 1141 B6R0.4 CC(=O)CCCN Amb32661286 [0,1,0,0,0,0|2,0,0]=3 1142 B6R0.4 CC(=O)CCCO Amb3940340 [0,1,0,0,0,0|2,0,0]=3 1143 B6R0.4 CC(=O)CN=C=S Amb27490781 [0,1,0,0,0,0|3,0,0]=4 1144 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [0,1,0,0,0,0|3,0,0]=4 1145 B6R0.4 CC(=O)CSC#N Amb9788383 [0,1,0,0,0,0|3,0,0]=4 1146 B6R0.4 CC(=O)C\C=N\O Amb27750272 [0,1,0,0,0,0|2,0,1]=4 1147 B6R0.4 CC(=O)NCC#N Amb3886527 [0,1,0,0,0,0|3,0,0]=4 1148 B6R0.4 CC(=O)NCC=O Amb25757509 [0,1,0,0,0,0|2,0,0]=3 1149 B6R0.4 CC(=O)NCCBr Amb4311522 [0,1,0,0,0,0|3,0,0]=4 1150 B6R0.4 CC(=O)NCCCl Amb423758 [0,1,0,0,0,0|3,0,0]=4 1151 B6R0.4 CC(=O)NCCN Amb1218225 [0,1,0,0,0,0|3,0,0]=4 1152 B6R0.4 CC(=O)NCCO Amb2720909 [0,1,0,0,0,0|3,0,0]=4 1153 B6R0.4 CC(=O)NCCS Amb22230992 [0,1,0,0,0,0|3,0,0]=4 1154 B6R0.4 CC(=O)OCC#N Amb9677308 [0,1,0,0,0,0|3,0,0]=4 1155 B6R0.4 CC(=O)OCCBr Amb3940209 [0,1,0,0,0,0|3,0,0]=4 1156 B6R0.4 CC(=O)OCCN Amb18121947 [0,1,0,0,0,0|3,0,0]=4 1157 B6R0.4 CC(=O)OCCN Amb28827650 [0,1,0,0,0,0|3,0,0]=4 1158 B6R0.4 CC(=O)OCCO Amb3941004 [0,1,0,0,0,0|3,0,0]=4 1159 B6R0.4 CC(=O)SCC=O Amb27873378 [0,1,0,0,0,0|2,0,0]=3 1160 B6R0.4 CC(=O)SCCBr Amb24608039 [0,1,0,0,0,0|3,0,0]=4 1161 B6R0.4 CC(=O)SCCN Amb21953963 [0,1,0,0,0,0|3,0,0]=4 1162 B6R0.4 CC(=O)SCCN Amb22011516 [0,1,0,0,0,0|3,0,0]=4 1163 B6R0.4 CC(=O)SCCN Amb31291049 [0,1,0,0,0,0|3,0,0]=4 1164 B6R0.4 CC(=O)SCCO Amb27481182 [0,1,0,0,0,0|3,0,0]=4 1165 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [0,1,0,0,0,0|1,0,2]=4 1166 B6R0.4 CC(Br)CCC#N Amb23599106 [0,1,0,0,0,0|2,0,1]=4 1167 B6R0.4 CC(Br)CCCBr Amb2686750 [0,1,0,0,0,0|2,0,1]=4 1168 B6R0.4 CC(Br)CCCF Amb33334194 [0,1,0,0,0,0|2,0,1]=4 1169 B6R0.4 CC(C)=CCC=O Amb18120881 [0,1,0,0,0,0|1,0,1]=3 1170 B6R0.4 CC(C)=CNC=O Amb27973472 [0,1,0,0,0,0|2,0,1]=4 1171 B6R0.4 CC(C)=NNC=O Amb2419224 [0,1,0,0,0,0|3,0,0]=4 1172 B6R0.4 CC(C)CCC#N Amb6243011 [0,1,0,0,0,0|2,0,1]=4 1173 B6R0.4 CC(C)CCC=O Amb17673735 [0,1,0,0,0,0|1,0,0]=2 1174 B6R0.4 CC(C)CCCBr Amb3940143 [0,1,0,0,0,0|2,0,1]=4 1175 B6R0.4 CC(C)CCCCl Amb33546075 [0,1,0,0,0,0|2,0,1]=4 1176 B6R0.4 CC(C)CCCI Amb27814431 [0,1,0,0,0,0|2,0,1]=4 1177 B6R0.4 CC(C)CCCN Amb1136518 [0,1,0,0,0,0|2,0,1]=4 1178 B6R0.4 CC(C)CCCN Amb13952127 [0,1,0,0,0,0|2,0,1]=4 1179 B6R0.4 CC(C)CCCO Amb3939329 [0,1,0,0,0,0|1,0,2]=4 1180 B6R0.4 CC(C)CCCS Amb26425936 [0,1,0,0,0,0|1,1,1]=4 1181 B6R0.4 CC(C)CCNN Amb20622972 [0,1,0,0,0,0|3,0,0]=4 1182 B6R0.4 CC(C)CCNN Amb28990929 [0,1,0,0,0,0|3,0,0]=4 1183 B6R0.4 CC(C)CCNN Amb6244044 [0,1,0,0,0,0|3,0,0]=4 1184 B6R0.4 CC(C)CCNO Amb27439608 [0,1,0,0,0,0|2,0,1]=4 1185 B6R0.4 CC(C)CCON Amb17101067 [0,1,0,0,0,0|3,0,0]=4 1186 B6R0.4 CC(C)CCON Amb28994300 [0,1,0,0,0,0|3,0,0]=4 1187 B6R0.4 CC(C)CN=C=O Amb5750714 [0,1,0,0,0,0|2,0,1]=4 1188 B6R0.4 CC(C)CNC=S Amb27422882 [0,1,0,0,0,0|2,1,0]=4 1189 B6R0.4 CC(C)COC=O Amb8513682 [0,1,0,0,0,0|2,0,0]=3 1190 B6R0.4 CC(C)CON=O Amb8514844 [0,1,0,0,0,0|3,0,0]=4 1191 B6R0.4 CC(C)C\C=C\Br Amb27974340 [0,1,0,0,0,0|2,0,1]=4 1192 B6R0.4 CC(C)OCC=O Amb25820659 [0,1,0,0,0,0|2,0,0]=3 1193 B6R0.4 CC(C)SCC=O Amb24479811 [0,1,0,0,0,0|2,0,0]=3 1194 B6R0.4 CC(C)\C=C\C=O Amb8515214 [0,1,0,0,0,0|1,0,2]=4 1195 B6R0.4 CC(Cl)CCC#N Amb33547855 [0,1,0,0,0,0|2,0,1]=4 1196 B6R0.4 CC(Cl)CCC=O Amb18124284 [0,1,0,0,0,0|1,0,0]=2 1197 B6R0.4 CC(Cl)CCCCl Amb19516004 [0,1,0,0,0,0|2,0,1]=4 1198 B6R0.4 CC(Cl)CCCO Amb28138028 [0,1,0,0,0,0|1,0,2]=4 1199 B6R0.4 CC(Cl)CN=S=O Amb28118892 [0,1,0,0,0,0|3,0,0]=4 1200 B6R0.4 CC(F)CCC#N Amb27864416 [0,1,0,0,0,0|2,0,1]=4 1201 B6R0.4 CC(F)CCCBr Amb27760484 [0,1,0,0,0,0|2,0,1]=4 1202 B6R0.4 CC(F)CCCO Amb27186289 [0,1,0,0,0,0|1,0,2]=4 1203 B6R0.4 CC(I)CCC#N Amb27838195 [0,1,0,0,0,0|2,0,1]=4 1204 B6R0.4 CC(N)CCCF Amb27612972 [0,1,0,0,0,0|2,0,1]=4 1205 B6R0.4 CC(N)CCCN Amb22168271 [0,1,0,0,0,0|2,0,1]=4 1206 B6R0.4 CC(N)CCCN Amb28827626 [0,1,0,0,0,0|2,0,1]=4 1207 B6R0.4 CC(N)CCCO Amb17569888 [0,1,0,0,0,0|1,0,2]=4 1208 B6R0.4 CC(N)C\C=C\Cl Amb35606912 [0,1,0,0,0,0|2,0,1]=4 1209 B6R0.4 CC(O)CCC#N Amb27974459 [0,1,0,0,0,0|2,0,1]=4 1210 B6R0.4 CC(O)CCC=O Amb17593090 [0,1,0,0,0,0|1,0,0]=2 1211 B6R0.4 CC(O)CCCBr Amb25889007 [0,1,0,0,0,0|2,0,1]=4 1212 B6R0.4 CC(O)CCCCl Amb22270232 [0,1,0,0,0,0|2,0,1]=4 1213 B6R0.4 CC(O)CCCF Amb24385806 [0,1,0,0,0,0|2,0,1]=4 1214 B6R0.4 CC(O)CCCN Amb8630414 [0,1,0,0,0,0|2,0,1]=4 1215 B6R0.4 CC(O)CCCO Amb22227752 [0,1,0,0,0,0|1,0,2]=4 1216 B6R0.4 CC(O)COC=O Amb27436963 [0,1,0,0,0,0|2,0,0]=3 1217 B6R0.4 CC(O)C\C=C\Br Amb27216240 [0,1,0,0,0,0|2,0,1]=4 1218 B6R0.4 CC(O)C\C=C\Cl Amb24479438 [0,1,0,0,0,0|2,0,1]=4 1219 B6R0.4 CC(O)\C=C\C=O Amb18639615 [0,1,0,0,0,0|1,0,2]=4 1220 B6R0.4 CC(S)CCC#N Amb29852814 [0,1,0,0,0,0|2,0,1]=4 1221 B6R0.4 CC(S)CCCN Amb18251084 [0,1,0,0,0,0|2,0,1]=4 1222 B6R0.4 CC(S)CCCO Amb24412207 [0,1,0,0,0,0|1,0,2]=4 1223 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,1,0,0,0,0|1,0,2]=4 1224 B6R0.4 CCC#CC(=O)O Amb6336503 [0,1,0,0,0,0|1,0,2]=4 1225 B6R0.4 CCC#CC(C)=O Amb2721702 [0,1,0,0,0,0|1,0,2]=4 1226 B6R0.4 CCCC=C(C)C Amb4035860 [0,1,0,0,0,0|2,0,1]=4 1227 B6R0.4 CCCCB(Cl)Cl Amb22230362 [0,1,0,0,0,0|3,0,0]=4 1228 B6R0.4 CCCCB(F)F Amb27268214 [0,1,0,0,0,0|3,0,0]=4 1229 B6R0.4 CCCCB(O)O Amb2447142 [0,1,0,0,0,0|2,0,1]=4 1230 B6R0.4 CCCCC(=N)N Amb10066937 [0,1,0,0,0,0|2,0,0]=3 1231 B6R0.4 CCCCC(=N)N Amb2696360 [0,1,0,0,0,0|2,0,0]=3 1232 B6R0.4 CCCCC(=O)Cl Amb3939066 [0,1,0,0,0,0|1,0,0]=2 1233 B6R0.4 CCCCC(=O)O Amb3939877 [0,1,0,0,0,0|1,0,0]=2 1234 B6R0.4 CCCCC(=O)[O-] Amb22056343 [0,1,0,0,0,0|1,0,0]=2 1235 B6R0.4 CCCCC(=S)S Amb27195855 [0,1,0,0,0,0|1,1,0]=3 1236 B6R0.4 CCCCC(C)=O Amb6608652 [0,1,0,0,0,0|1,0,0]=2 1237 B6R0.4 CCCCC(C)Br Amb4015489 [0,1,0,0,0,0|2,0,1]=4 1238 B6R0.4 CCCCC(C)C Amb8513255 [0,1,0,0,0,0|2,0,1]=4 1239 B6R0.4 CCCCC(C)I Amb17673919 [0,1,0,0,0,0|2,0,1]=4 1240 B6R0.4 CCCCC(C)N Amb33527132 [0,1,0,0,0,0|2,0,1]=4 1241 B6R0.4 CCCCC(C)N Amb33532410 [0,1,0,0,0,0|2,0,1]=4 1242 B6R0.4 CCCCC(C)O Amb4605977 [0,1,0,0,0,0|1,0,2]=4 1243 B6R0.4 CCCCC(C)S Amb26326801 [0,1,0,0,0,0|1,1,1]=4 1244 B6R0.4 CCCCC(Cl)Br Amb28050002 [0,1,0,0,0,0|2,0,1]=4 1245 B6R0.4 CCCCC(Cl)Cl Amb26420376 [0,1,0,0,0,0|2,0,1]=4 1246 B6R0.4 CCCCC(F)Br Amb27211132 [0,1,0,0,0,0|2,0,1]=4 1247 B6R0.4 CCCCC(N)=O Amb6891958 [0,1,0,0,0,0|1,0,0]=2 1248 B6R0.4 CCCCC(N)=S Amb6249558 [0,1,0,0,0,0|1,1,0]=3 1249 B6R0.4 CCCCN(C)N Amb22730468 [0,1,0,0,0,0|2,0,1]=4 1250 B6R0.4 CCCCN(C)O Amb33204268 [0,1,0,0,0,0|2,0,1]=4 1251 B6R0.4 CCCCP(Cl)Cl Amb25051489 [0,1,0,0,0,0|3,0,0]=4 1252 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,1,0,0,0,0|2,0,0]=3 1253 B6R0.4 CCCCS(=O)[O-] Amb19889352 [0,1,0,0,0,0|2,0,0]=3 1254 B6R0.4 CCCCS(N)=O Amb32720302 [0,1,0,0,0,0|2,0,0]=3 1255 B6R0.4 CCCC[C@@H](C)N Amb20242479 [0,1,0,0,0,0|2,0,1]=4 1256 B6R0.4 CCCC[C@@H](C)O Amb19929139 [0,1,0,0,0,0|1,0,2]=4 1257 B6R0.4 CCCC[C@H](C)N Amb20242478 [0,1,0,0,0,0|2,0,1]=4 1258 B6R0.4 CCCC[C@H](C)O Amb8515092 [0,1,0,0,0,0|1,0,2]=4 1259 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [0,1,0,0,0,0|2,0,0]=3 1260 B6R0.4 CCCC[PH](=O)O Amb8391286 [0,1,0,0,0,0|2,0,0]=3 1261 B6R0.4 CCCC[SiH](C)C Amb9807507 [0,1,0,0,0,0|2,0,1]=4 1262 B6R0.4 CCCNC(=N)N Amb10844865 [0,1,0,0,0,0|3,0,0]=4 1263 B6R0.4 CCCNC(=N)N Amb20667746 [0,1,0,0,0,0|3,0,0]=4 1264 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,1,0,0,0,0|2,0,0]=3 1265 B6R0.4 CCCNC(=S)S Amb28128280 [0,1,0,0,0,0|2,1,0]=4 1266 B6R0.4 CCCNC(C)=O Amb5835710 [0,1,0,0,0,0|2,0,0]=3 1267 B6R0.4 CCCNC(N)=O Amb1152241 [0,1,0,0,0,0|2,0,0]=3 1268 B6R0.4 CCCNC(N)=S Amb1152085 [0,1,0,0,0,0|2,1,0]=4 1269 B6R0.4 CCCN[N+](=O)[O-] Amb21953652 [0,1,0,0,0,0|3,0,0]=4 1270 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,1,0,0,0,0|2,0,0]=3 1271 B6R0.4 CCCOC(=O)F Amb32667886 [0,1,0,0,0,0|2,0,0]=3 1272 B6R0.4 CCCOC(=S)[S-] Amb594778 [0,1,0,0,0,0|2,1,0]=4 1273 B6R0.4 CCCOC(N)=O Amb6334809 [0,1,0,0,0,0|2,0,0]=3 1274 B6R0.4 CCCO[N+](=O)[O-] Amb22732564 [0,1,0,0,0,0|3,0,0]=4 1275 B6R0.4 CCCSC(=N)N Amb20676008 [0,1,0,0,0,0|3,0,0]=4 1276 B6R0.4 CCCSC(=N)N Amb23482968 [0,1,0,0,0,0|3,0,0]=4 1277 B6R0.4 CCCSC(C)=O Amb22043301 [0,1,0,0,0,0|2,0,0]=3 1278 B6R0.4 CCCSC(N)=O Amb27167907 [0,1,0,0,0,0|2,0,0]=3 1279 B6R0.4 CCNCC(=N)N Amb28050789 [0,1,0,0,0,0|3,0,0]=4 1280 B6R0.4 CCNCC(=O)Cl Amb27948279 [0,1,0,0,0,0|2,0,0]=3 1281 B6R0.4 CCNCC(=O)O Amb10609667 [0,1,0,0,0,0|2,0,0]=3 1282 B6R0.4 CCNCC(=O)O Amb7764661 [0,1,0,0,0,0|2,0,0]=3 1283 B6R0.4 CCNCC(C)=O Amb24545893 [0,1,0,0,0,0|2,0,0]=3 1284 B6R0.4 CCNCC(C)=O Amb32661185 [0,1,0,0,0,0|2,0,0]=3 1285 B6R0.4 CCNCC(N)=O Amb1128676 [0,1,0,0,0,0|2,0,0]=3 1286 B6R0.4 CCNCC(N)=O Amb4035424 [0,1,0,0,0,0|2,0,0]=3 1287 B6R0.4 CCOCC(=N)N Amb19890012 [0,1,0,0,0,0|3,0,0]=4 1288 B6R0.4 CCOCC(=N)N Amb6268669 [0,1,0,0,0,0|3,0,0]=4 1289 B6R0.4 CCOCC(=O)Cl Amb33528415 [0,1,0,0,0,0|2,0,0]=3 1290 B6R0.4 CCOCC(=O)O Amb3939880 [0,1,0,0,0,0|2,0,0]=3 1291 B6R0.4 CCOCC(=O)S Amb27813482 [0,1,0,0,0,0|2,0,0]=3 1292 B6R0.4 CCOCC(C)=O Amb9666086 [0,1,0,0,0,0|2,0,0]=3 1293 B6R0.4 CCOCC(N)=S Amb6276655 [0,1,0,0,0,0|2,1,0]=4 1294 B6R0.4 CCONC(C)=O Amb22230675 [0,1,0,0,0,0|3,0,0]=4 1295 B6R0.4 CCPCC(=O)O Amb28321137 [0,1,0,0,0,0|2,0,0]=3 1296 B6R0.4 CCSCC(=N)N Amb6680834 [0,1,0,0,0,0|3,0,0]=4 1297 B6R0.4 CCSCC(=O)O Amb1125185 [0,1,0,0,0,0|2,0,0]=3 1298 B6R0.4 CCSCC(C)=O Amb4018179 [0,1,0,0,0,0|2,0,0]=3 1299 B6R0.4 CCSCC(N)=S Amb27188472 [0,1,0,0,0,0|2,1,0]=4 1300 B6R0.4 CC\C=C/C(=O)O Amb28429841 [0,1,0,0,0,0|1,0,2]=4 1301 B6R0.4 CC\C=C/C(C)=O Amb27835645 [0,1,0,0,0,0|1,0,2]=4 1302 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [0,1,0,0,0,0|1,0,2]=4 1303 B6R0.4 CC\C=C\C(=O)O Amb6608967 [0,1,0,0,0,0|1,0,2]=4 1304 B6R0.4 CC\C=C\C(C)=O Amb26022886 [0,1,0,0,0,0|1,0,2]=4 1305 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,1,0,0,0,0|1,0,2]=4 1306 B6R0.4 CC\N=C\C(=O)O Amb28041425 [0,1,0,0,0,0|2,0,1]=4 1307 B6R0.4 CC\N=C\C(C)=O Amb27854982 [0,1,0,0,0,0|2,0,1]=4 1308 B6R0.4 CN(C)C#CC=O Amb27424954 [0,1,0,0,0,0|1,0,2]=4 1309 B6R0.4 CN(C)CCC#N Amb3940297 [0,1,0,0,0,0|2,0,1]=4 1310 B6R0.4 CN(C)CCC#N Amb9677325 [0,1,0,0,0,0|2,0,1]=4 1311 B6R0.4 CN(C)CCC=O Amb22001057 [0,1,0,0,0,0|1,0,0]=2 1312 B6R0.4 CN(C)CCCBr Amb10603677 [0,1,0,0,0,0|2,0,1]=4 1313 B6R0.4 CN(C)CCCCl Amb33537241 [0,1,0,0,0,0|2,0,1]=4 1314 B6R0.4 CN(C)CCCCl Amb8513141 [0,1,0,0,0,0|2,0,1]=4 1315 B6R0.4 CN(C)CCCI Amb35781980 [0,1,0,0,0,0|2,0,1]=4 1316 B6R0.4 CN(C)CCCN Amb3939839 [0,1,0,0,0,0|2,0,1]=4 1317 B6R0.4 CN(C)CCCO Amb3939321 [0,1,0,0,0,0|1,0,2]=4 1318 B6R0.4 CN(C)CCCS Amb24078629 [0,1,0,0,0,0|1,1,1]=4 1319 B6R0.4 CN(C)CCCS Amb27974610 [0,1,0,0,0,0|1,1,1]=4 1320 B6R0.4 CN(C)CCNN Amb1116628 [0,1,0,0,0,0|3,0,0]=4 1321 B6R0.4 CN(C)CCNN Amb32414597 [0,1,0,0,0,0|3,0,0]=4 1322 B6R0.4 CN(C)CCNN Amb33545778 [0,1,0,0,0,0|3,0,0]=4 1323 B6R0.4 CN(C)CCNN Amb6892602 [0,1,0,0,0,0|3,0,0]=4 1324 B6R0.4 CN(C)CCON Amb17104842 [0,1,0,0,0,0|3,0,0]=4 1325 B6R0.4 CN(C)CCON Amb5721904 [0,1,0,0,0,0|3,0,0]=4 1326 B6R0.4 CN(C)CNC=O Amb27216675 [0,1,0,0,0,0|2,0,0]=3 1327 B6R0.4 CN(C)C\C=C/Cl Amb27407781 [0,1,0,0,0,0|2,0,1]=4 1328 B6R0.4 CN(C)\C=C\C=O Amb3940430 [0,1,0,0,0,0|1,0,2]=4 1329 B6R0.4 CN(N)CCC#N Amb18121146 [0,1,0,0,0,0|2,0,1]=4 1330 B6R0.4 CN(O)CCCF Amb33480871 [0,1,0,0,0,0|2,0,1]=4 1331 B6R0.4 CNCCC(=O)Cl Amb27422890 [0,1,0,0,0,0|1,0,0]=2 1332 B6R0.4 CNCCC(=O)O Amb10609760 [0,1,0,0,0,0|1,0,0]=2 1333 B6R0.4 CNCCC(=O)O Amb7766400 [0,1,0,0,0,0|1,0,0]=2 1334 B6R0.4 CNCCC(C)=O Amb24560306 [0,1,0,0,0,0|1,0,0]=2 1335 B6R0.4 CNCCC(C)=O Amb28827637 [0,1,0,0,0,0|1,0,0]=2 1336 B6R0.4 CNCCC(C)C Amb10609494 [0,1,0,0,0,0|2,0,1]=4 1337 B6R0.4 CNCCC(C)C Amb1114399 [0,1,0,0,0,0|2,0,1]=4 1338 B6R0.4 CNCCC(C)N Amb18288833 [0,1,0,0,0,0|2,0,1]=4 1339 B6R0.4 CNCCC(C)O Amb17569889 [0,1,0,0,0,0|1,0,2]=4 1340 B6R0.4 CNCCC(C)O Amb34141241 [0,1,0,0,0,0|1,0,2]=4 1341 B6R0.4 CNCCC(F)F Amb26515235 [0,1,0,0,0,0|2,0,1]=4 1342 B6R0.4 CNCCC(F)F Amb33527624 [0,1,0,0,0,0|2,0,1]=4 1343 B6R0.4 CNCCC(N)=O Amb19959913 [0,1,0,0,0,0|1,0,0]=2 1344 B6R0.4 CNCCC(N)=O Amb33538309 [0,1,0,0,0,0|1,0,0]=2 1345 B6R0.4 CNCCN(C)C Amb19958398 [0,1,0,0,0,0|3,0,0]=4 1346 B6R0.4 CNCCN(C)C Amb3939354 [0,1,0,0,0,0|3,0,0]=4 1347 B6R0.4 CNCCN(C)O Amb27628863 [0,1,0,0,0,0|2,0,1]=4 1348 B6R0.4 CNCCP(C)C Amb28068836 [0,1,0,0,0,0|3,0,0]=4 1349 B6R0.4 CNCCS(C)=O Amb21984676 [0,1,0,0,0,0|2,0,0]=3 1350 B6R0.4 CNCC[C@@H](C)N Amb28429755 [0,1,0,0,0,0|2,0,1]=4 1351 B6R0.4 CNCC[C@H](C)O Amb27801301 [0,1,0,0,0,0|1,0,2]=4 1352 B6R0.4 CNCC[N+](=O)[O-] Amb35704404 [0,1,0,0,0,0|2,0,0]=3 1353 B6R0.4 CN\C=C\C(C)=O Amb17593076 [0,1,0,0,0,0|1,0,2]=4 1354 B6R0.4 COCCB(O)O Amb27173037 [0,1,0,0,0,0|1,1,1]=4 1355 B6R0.4 COCCC(=N)N Amb2696283 [0,1,0,0,0,0|1,1,0]=3 1356 B6R0.4 COCCC(=N)N Amb8630184 [0,1,0,0,0,0|1,1,0]=3 1357 B6R0.4 COCCC(=O)Cl Amb2689274 [0,1,0,0,0,0|0,1,0]=2 1358 B6R0.4 COCCC(=O)O Amb3938990 [0,1,0,0,0,0|0,1,0]=2 1359 B6R0.4 COCCC(C)=O Amb7764907 [0,1,0,0,0,0|0,1,0]=2 1360 B6R0.4 COCCC(C)Br Amb18805533 [0,1,0,0,0,0|1,1,1]=4 1361 B6R0.4 COCCC(C)Cl Amb27207909 [0,1,0,0,0,0|1,1,1]=4 1362 B6R0.4 COCCC(C)N Amb7772188 [0,1,0,0,0,0|1,1,1]=4 1363 B6R0.4 COCCC(C)O Amb20621489 [0,1,0,0,0,0|0,1,2]=4 1364 B6R0.4 COCCC(C)S Amb27836211 [0,1,0,0,0,0|0,2,1]=4 1365 B6R0.4 COCCC(N)=O Amb33538943 [0,1,0,0,0,0|0,1,0]=2 1366 B6R0.4 COCCC(N)=S Amb6250669 [0,1,0,0,0,0|0,2,0]=3 1367 B6R0.4 COCCC(O)Br Amb20242943 [0,1,0,0,0,0|0,1,2]=4 1368 B6R0.4 COCCC(O)O Amb28410462 [0,1,0,0,0,0|0,1,2]=4 1369 B6R0.4 COCCN(C)C Amb16231530 [0,1,0,0,0,0|2,1,0]=4 1370 B6R0.4 COCCN(C)N Amb25326276 [0,1,0,0,0,0|2,1,0]=4 1371 B6R0.4 COCCN(C)O Amb33428857 [0,1,0,0,0,0|1,1,1]=4 1372 B6R0.4 COCCS(=O)Cl Amb25914790 [0,1,0,0,0,0|1,1,0]=3 1373 B6R0.4 COCCS(=O)[O-] Amb26874008 [0,1,0,0,0,0|1,1,0]=3 1374 B6R0.4 COCCS(N)=O Amb32720336 [0,1,0,0,0,0|1,1,0]=3 1375 B6R0.4 COCC[C@@H](C)N Amb25934655 [0,1,0,0,0,0|1,1,1]=4 1376 B6R0.4 COCC[C@@H](C)N Amb33620890 [0,1,0,0,0,0|1,1,1]=4 1377 B6R0.4 COCC[C@@H](C)O Amb27237141 [0,1,0,0,0,0|0,1,2]=4 1378 B6R0.4 COCC[C@H](C)N Amb25888528 [0,1,0,0,0,0|1,1,1]=4 1379 B6R0.4 COCC[C@H](C)N Amb33741910 [0,1,0,0,0,0|1,1,1]=4 1380 B6R0.4 COCC[C@H](C)O Amb26559043 [0,1,0,0,0,0|0,1,2]=4 1381 B6R0.4 COCNC(N)=O Amb25744350 [0,1,0,0,0,0|1,1,0]=3 1382 B6R0.4 COCNC(N)=S Amb8387982 [0,1,0,0,0,0|1,2,0]=4 1383 B6R0.4 COCOC(=N)N Amb27619817 [0,1,0,0,0,0|2,1,0]=4 1384 B6R0.4 CONCC(N)=O Amb28455463 [0,1,0,0,0,0|1,1,0]=3 1385 B6R0.4 CO\C=C/C(C)=O Amb27264758 [0,1,0,0,0,0|0,1,2]=4 1386 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [0,1,0,0,0,0|0,1,2]=4 1387 B6R0.4 CO\C=C\C(=O)O Amb18121767 [0,1,0,0,0,0|0,1,2]=4 1388 B6R0.4 CO\C=C\C(C)=O Amb8385700 [0,1,0,0,0,0|0,1,2]=4 1389 B6R0.4 CO\C=C\C(N)=O Amb27153308 [0,1,0,0,0,0|0,1,2]=4 1390 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,1,0,0,0,0|1,1,1]=4 1391 B6R0.4 CS(=O)CCCN Amb18974527 [0,1,0,0,0,0|1,0,2]=4 1392 B6R0.4 CS(=O)CCCN Amb32684177 [0,1,0,0,0,0|1,0,2]=4 1393 B6R0.4 CSC#CC(=O)O Amb33309663 [0,1,0,0,0,0|0,0,2]=3 1394 B6R0.4 CSCC=C(C)C Amb27594692 [0,1,0,0,0,0|1,0,1]=3 1395 B6R0.4 CSCCC(=N)N Amb19373501 [0,1,0,0,0,0|1,0,0]=2 1396 B6R0.4 CSCCC(=N)N Amb19516878 [0,1,0,0,0,0|1,0,0]=2 1397 B6R0.4 CSCCC(=O)O Amb3939879 [0,1,0,0,0,0|0,0,0]=1 1398 B6R0.4 CSCCC(C)=O Amb8392858 [0,1,0,0,0,0|0,0,0]=1 1399 B6R0.4 CSCCC(C)Br Amb33007127 [0,1,0,0,0,0|1,0,1]=3 1400 B6R0.4 CSCCC(C)C Amb4016370 [0,1,0,0,0,0|1,0,1]=3 1401 B6R0.4 CSCCC(C)N Amb19515505 [0,1,0,0,0,0|1,0,1]=3 1402 B6R0.4 CSCCC(C)O Amb27860401 [0,1,0,0,0,0|0,0,2]=3 1403 B6R0.4 CSCCC(N)=S Amb17307559 [0,1,0,0,0,0|0,1,0]=2 1404 B6R0.4 CSCCN(=O)=O Amb24179458 [0,1,0,0,0,0|1,0,0]=2 1405 B6R0.4 CSCCN(C)O Amb33272058 [0,1,0,0,0,0|1,0,1]=3 1406 B6R0.4 CSCC[C@@H](C)N Amb33200180 [0,1,0,0,0,0|1,0,1]=3 1407 B6R0.4 CSCC[C@@H](C)O Amb33198759 [0,1,0,0,0,0|0,0,2]=3 1408 B6R0.4 CSCC[C@H](C)N Amb33200178 [0,1,0,0,0,0|1,0,1]=3 1409 B6R0.4 CSCC[C@H](C)O Amb33198747 [0,1,0,0,0,0|0,0,2]=3 1410 B6R0.4 CSCSC(C)=O Amb27876851 [0,1,0,0,0,0|1,0,0]=2 1411 B6R0.4 CSSCC(=O)O Amb25378801 [0,1,0,0,0,0|1,0,0]=2 1412 B6R0.4 CSSCC(C)N Amb27480762 [0,1,0,0,0,0|2,0,1]=4 1413 B6R0.4 CS\C=C/C(C)=O Amb27471812 [0,1,0,0,0,0|0,0,2]=3 1414 B6R0.4 CS\C=C\C(=O)O Amb30584688 [0,1,0,0,0,0|0,0,2]=3 1415 B6R0.4 CS\C=C\[N+](=O)[O-] Amb35704405 [0,1,0,0,0,0|1,0,2]=4 1416 B6R0.4 C[C@@H](Cl)CCC=O Amb27595266 [0,1,0,0,0,0|1,0,0]=2 1417 B6R0.4 C[C@@H](Cl)CCCO Amb27233570 [0,1,0,0,0,0|1,0,2]=4 1418 B6R0.4 C[C@@H](N)CCCF Amb33377445 [0,1,0,0,0,0|2,0,1]=4 1419 B6R0.4 C[C@@H](N)CCCO Amb27602210 [0,1,0,0,0,0|1,0,2]=4 1420 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [0,1,0,0,0,0|2,0,1]=4 1421 B6R0.4 C[C@@H](O)CCCF Amb33376908 [0,1,0,0,0,0|2,0,1]=4 1422 B6R0.4 C[C@@H](O)CCCO Amb28047449 [0,1,0,0,0,0|1,0,2]=4 1423 B6R0.4 C[C@H](Cl)CCC=O Amb28141995 [0,1,0,0,0,0|1,0,0]=2 1424 B6R0.4 C[C@H](N)CCCF Amb33377444 [0,1,0,0,0,0|2,0,1]=4 1425 B6R0.4 C[C@H](N)CNC=S Amb28365925 [0,1,0,0,0,0|2,1,0]=4 1426 B6R0.4 C[C@H](O)CCC=O Amb27188424 [0,1,0,0,0,0|1,0,0]=2 1427 B6R0.4 C[C@H](O)CCCF Amb33376887 [0,1,0,0,0,0|2,0,1]=4 1428 B6R0.4 C[SiH](C)CCCCl Amb27655852 [0,1,0,0,0,0|2,0,1]=4 1429 B6R0.4 C[SiH](Cl)CCCCl Amb28364265 [0,1,0,0,0,0|2,0,1]=4 1430 B6R0.4 C\C(N)=N\OC=O Amb27655517 [0,1,0,0,0,0|3,0,0]=4 1431 B6R0.4 C\C=C/CC(C)C Amb27421132 [0,1,0,0,0,0|2,0,1]=4 1432 B6R0.4 C\C=C\CC(=N)N Amb25176208 [0,1,0,0,0,0|2,0,1]=4 1433 B6R0.4 C\C=C\CC(=O)O Amb3941538 [0,1,0,0,0,0|1,0,1]=3 1434 B6R0.4 C\C=C\CC(C)N Amb27843415 [0,1,0,0,0,0|2,0,1]=4 1435 B6R0.4 C\C=C\CC(N)=O Amb26589975 [0,1,0,0,0,0|1,0,1]=3 1436 B6R0.4 C\C=C\CS(=O)[O-] Amb26887775 [0,1,0,0,0,0|2,0,1]=4 1437 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [0,1,0,0,0,0|2,0,1]=4 1438 B6R0.4 C\C=N\NC(N)=O Amb24351023 [0,1,0,0,0,0|3,0,0]=4 1439 B6R0.4 C\N=C\CC(C)=O Amb28202181 [0,1,0,0,0,0|1,0,1]=3 1440 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,1,0,0,0,0|2,0,0]=3 1441 B6R0.4 N#CCCC(=O)O Amb2694975 [0,1,0,0,0,0|2,0,0]=3 1442 B6R0.4 N#CCCC(N)=O Amb8841150 [0,1,0,0,0,0|2,0,0]=3 1443 B6R0.4 N#CCCS(=O)Cl Amb32720334 [0,1,0,0,0,0|3,0,0]=4 1444 B6R0.4 N#CCCS(=O)[O-] Amb32754806 [0,1,0,0,0,0|3,0,0]=4 1445 B6R0.4 N#CCCS(N)=O Amb32720335 [0,1,0,0,0,0|3,0,0]=4 1446 B6R0.4 N#CCNC(N)=O Amb20622301 [0,1,0,0,0,0|3,0,0]=4 1447 B6R0.4 N=C(N)CCCBr Amb4297022 [0,1,0,0,0,0|3,0,0]=4 1448 B6R0.4 N=C(N)CCCCl Amb4297061 [0,1,0,0,0,0|3,0,0]=4 1449 B6R0.4 N=C(N)CCCF Amb27231400 [0,1,0,0,0,0|3,0,0]=4 1450 B6R0.4 N=C(N)CCCN Amb25888970 [0,1,0,0,0,0|3,0,0]=4 1451 B6R0.4 N=C(N)CCCN Amb33299271 [0,1,0,0,0,0|3,0,0]=4 1452 B6R0.4 N=C(N)CCCO Amb33038287 [0,1,0,0,0,0|3,0,0]=4 1453 B6R0.4 N=CNCC(=O)Cl Amb27216499 [0,1,0,0,0,0|3,0,0]=4 1454 B6R0.4 N=CNCC(=O)O Amb24670244 [0,1,0,0,0,0|3,0,0]=4 1455 B6R0.4 NC(=O)CCCCl Amb1138237 [0,1,0,0,0,0|2,0,0]=3 1456 B6R0.4 NC(=O)CCCF Amb28073400 [0,1,0,0,0,0|2,0,0]=3 1457 B6R0.4 NC(=O)CCCO Amb20623438 [0,1,0,0,0,0|2,0,0]=3 1458 B6R0.4 NC(=O)CCCS Amb27174778 [0,1,0,0,0,0|2,0,0]=3 1459 B6R0.4 NC(=O)CN=C=S Amb6673216 [0,1,0,0,0,0|3,0,0]=4 1460 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [0,1,0,0,0,0|2,0,1]=4 1461 B6R0.4 NC(=O)NCCBr Amb28385599 [0,1,0,0,0,0|3,0,0]=4 1462 B6R0.4 NC(=O)NCCF Amb27446994 [0,1,0,0,0,0|3,0,0]=4 1463 B6R0.4 NC(=O)NCCI Amb27454955 [0,1,0,0,0,0|3,0,0]=4 1464 B6R0.4 NC(=O)NCCO Amb1146041 [0,1,0,0,0,0|3,0,0]=4 1465 B6R0.4 NC(=O)OCCCl Amb3940645 [0,1,0,0,0,0|3,0,0]=4 1466 B6R0.4 NC(=O)OCCO Amb20623788 [0,1,0,0,0,0|3,0,0]=4 1467 B6R0.4 NC(=O)SCCCl Amb27619850 [0,1,0,0,0,0|3,0,0]=4 1468 B6R0.4 NC(=S)CCCBr Amb33328371 [0,1,0,0,0,0|2,1,0]=4 1469 B6R0.4 NC(=S)CCCCl Amb33328364 [0,1,0,0,0,0|2,1,0]=4 1470 B6R0.4 NC(=S)CCCO Amb9215001 [0,1,0,0,0,0|2,1,0]=4 1471 B6R0.4 NC(=S)CNC=O Amb24479904 [0,1,0,0,0,0|3,0,0]=4 1472 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,1,0,0,0,0|2,0,0]=3 1473 B6R0.4 NCCCC(=O)O Amb1935210 [0,1,0,0,0,0|2,0,0]=3 1474 B6R0.4 NCCCC(N)=O Amb2099583 [0,1,0,0,0,0|2,0,0]=3 1475 B6R0.4 NCCCC(N)=O Amb6543438 [0,1,0,0,0,0|2,0,0]=3 1476 B6R0.4 NCCCS(=O)O Amb25185942 [0,1,0,0,0,0|3,0,0]=4 1477 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [0,1,0,0,0,0|3,0,0]=4 1478 B6R0.4 NCCC[PH](=O)O Amb22370049 [0,1,0,0,0,0|3,0,0]=4 1479 B6R0.4 NCCNC(N)=O Amb19374121 [0,1,0,0,0,0|3,0,0]=4 1480 B6R0.4 NCCNC(N)=O Amb32665340 [0,1,0,0,0,0|3,0,0]=4 1481 B6R0.4 NCCNC(N)=O Amb6254968 [0,1,0,0,0,0|3,0,0]=4 1482 B6R0.4 NCCOC(N)=O Amb22059480 [0,1,0,0,0,0|3,0,0]=4 1483 B6R0.4 NCCOC(N)=O Amb24271076 [0,1,0,0,0,0|3,0,0]=4 1484 B6R0.4 NNCCC(=O)O Amb33756816 [0,1,0,0,0,0|2,0,0]=3 1485 B6R0.4 NOCCC(=O)O Amb17569891 [0,1,0,0,0,0|1,1,0]=3 1486 B6R0.4 NOCCC(=O)O Amb32693437 [0,1,0,0,0,0|1,1,0]=3 1487 B6R0.4 NOCCC(N)=O Amb27838275 [0,1,0,0,0,0|1,1,0]=3 1488 B6R0.4 NS(=O)CCCBr Amb32720400 [0,1,0,0,0,0|3,0,0]=4 1489 B6R0.4 NS(=O)CCCCl Amb32720303 [0,1,0,0,0,0|3,0,0]=4 1490 B6R0.4 NS(=O)CCCF Amb32720390 [0,1,0,0,0,0|3,0,0]=4 1491 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,1,0,0,0,0|2,0,0]=3 1492 B6R0.4 O=C(Cl)CCCBr Amb3940241 [0,1,0,0,0,0|2,0,0]=3 1493 B6R0.4 O=C(Cl)CCCCl Amb6608638 [0,1,0,0,0,0|2,0,0]=3 1494 B6R0.4 O=C(Cl)NCCBr Amb28123956 [0,1,0,0,0,0|3,0,0]=4 1495 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,1,0,0,0,0|3,0,0]=4 1496 B6R0.4 O=C(Cl)NCCF Amb35633248 [0,1,0,0,0,0|3,0,0]=4 1497 B6R0.4 O=C(Cl)OCCBr Amb8514406 [0,1,0,0,0,0|3,0,0]=4 1498 B6R0.4 O=C(Cl)OCCCl Amb6608837 [0,1,0,0,0,0|3,0,0]=4 1499 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,1,0,0,0,0|3,0,0]=4 1500 B6R0.4 O=C(O)CCCBr Amb8393276 [0,1,0,0,0,0|2,0,0]=3 1501 B6R0.4 O=C(O)CCCCl Amb3940333 [0,1,0,0,0,0|2,0,0]=3 1502 B6R0.4 O=C(O)CCCF Amb17593104 [0,1,0,0,0,0|2,0,0]=3 1503 B6R0.4 O=C(O)CCCI Amb22295911 [0,1,0,0,0,0|2,0,0]=3 1504 B6R0.4 O=C(O)CCCO Amb18640332 [0,1,0,0,0,0|2,0,0]=3 1505 B6R0.4 O=C(O)CCCS Amb16185429 [0,1,0,0,0,0|2,0,0]=3 1506 B6R0.4 O=C(O)CCNO Amb28067767 [0,1,0,0,0,0|2,0,0]=3 1507 B6R0.4 O=C(O)CCSCl Amb28387511 [0,1,0,0,0,0|1,0,0]=2 1508 B6R0.4 O=C(O)COCF Amb33378705 [0,1,0,0,0,0|3,0,0]=4 1509 B6R0.4 O=C(O)CPCO Amb28340565 [0,1,0,0,0,0|3,0,0]=4 1510 B6R0.4 O=C(O)CSSCl Amb27477882 [0,1,0,0,0,0|2,0,0]=3 1511 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [0,1,0,0,0,0|2,0,1]=4 1512 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [0,1,0,0,0,0|2,0,1]=4 1513 B6R0.4 O=C(S)NCCO Amb27430045 [0,1,0,0,0,0|3,0,0]=4 1514 B6R0.4 O=C([O-])CCCO Amb3429667 [0,1,0,0,0,0|2,0,0]=3 1515 B6R0.4 O=C([O-])CNCO Amb8383630 [0,1,0,0,0,0|3,0,0]=4 1516 B6R0.4 O=CCCC(=O)O Amb17673897 [0,1,0,0,0,0|2,0,0]=3 1517 B6R0.4 O=CCCC(F)F Amb25848573 [0,1,0,0,0,0|2,0,0]=3 1518 B6R0.4 O=CCCC(O)O Amb27838257 [0,1,0,0,0,0|2,0,0]=3 1519 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [0,1,0,0,0,0|2,0,0]=3 1520 B6R0.4 O=CNCC(=O)O Amb1911508 [0,1,0,0,0,0|3,0,0]=4 1521 B6R0.4 O=COCC(=O)O Amb26624011 [0,1,0,0,0,0|3,0,0]=4 1522 B6R0.4 O=S(Cl)CCCBr Amb32720399 [0,1,0,0,0,0|3,0,0]=4 1523 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,1,0,0,0,0|3,0,0]=4 1524 B6R0.4 O=S(Cl)CCCF Amb32720389 [0,1,0,0,0,0|3,0,0]=4 1525 B6R0.4 O=S([O-])CCCBr Amb32754123 [0,1,0,0,0,0|3,0,0]=4 1526 B6R0.4 O=S([O-])CCCCl Amb26370094 [0,1,0,0,0,0|3,0,0]=4 1527 B6R0.4 O=S([O-])CCCF Amb32754093 [0,1,0,0,0,0|3,0,0]=4 1528 B6R0.4 O=S([O-])CCCO Amb27221257 [0,1,0,0,0,0|3,0,0]=4 1529 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [0,1,0,0,0,0|3,0,0]=4 1530 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [0,1,0,0,0,0|3,0,0]=4 1531 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [0,1,0,0,0,0|3,0,0]=4 1532 B6R0.4 O=[PH](O)CCCO Amb28345330 [0,1,0,0,0,0|3,0,0]=4 1533 B6R0.4 [C-]#[N+]CCC(=C)C Amb33199608 [0,1,0,0,0,0|2,0,1]=4 1534 B6R0.4 [C-]#[N+]CCC(C)C Amb2688906 [0,1,0,0,0,0|3,0,0]=4 1535 B6R0.4 [C-]#[N+]CCN(C)C Amb1981033 [0,1,0,0,0,0|3,0,0]=4 1536 B6R0.4 [N-]=[N+]=NCC(=O)Cl Amb27267972 [0,1,0,0,0,0|3,0,0]=4 1537 B6R0.4 [N-]=[N+]=NCC(=O)F Amb27187200 [0,1,0,0,0,0|3,0,0]=4 1538 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [0,1,0,0,0,0|3,0,0]=4 1539 B6R0.4 [N-]=[N+]=NCC(=O)[O-] Amb32662603 [0,1,0,0,0,0|3,0,0]=4 1540 B6R0.4 [N-]=[N+]=NCC(N)=O Amb26393051 [0,1,0,0,0,0|3,0,0]=4 1541 B6R0.6 BrCCCCCBr Amb6608668 [0,1,0,0,0,0|2,0,1]=4 1542 B6R0.6 C#CCCCC=C Amb22227961 [0,1,0,0,0,0|2,0,1]=4 1543 B6R0.6 C#CCCCC=O Amb17593060 [0,1,0,0,0,0|1,0,1]=3 1544 B6R0.6 C#CCCCCC Amb6297206 [0,1,0,0,0,0|2,0,1]=4 1545 B6R0.6 C#CCCCCCl Amb6336487 [0,1,0,0,0,0|2,0,1]=4 1546 B6R0.6 C#CCCCCF Amb33196082 [0,1,0,0,0,0|2,0,1]=4 1547 B6R0.6 C#CCCCCI Amb22752649 [0,1,0,0,0,0|2,0,1]=4 1548 B6R0.6 C#CCCCCN Amb22059283 [0,1,0,0,0,0|2,0,1]=4 1549 B6R0.6 C#CCCCCN Amb33549738 [0,1,0,0,0,0|2,0,1]=4 1550 B6R0.6 C#CCCCCO Amb6336500 [0,1,0,0,0,0|2,0,1]=4 1551 B6R0.6 C#CCCCNC Amb29083253 [0,1,0,0,0,0|2,0,1]=4 1552 B6R0.6 C#CCCCOC Amb25694831 [0,1,0,0,0,0|1,1,1]=4 1553 B6R0.6 C#CCCCSC Amb26996684 [0,1,0,0,0,0|1,0,1]=3 1554 B6R0.6 C#CCCNC=O Amb27447032 [0,1,0,0,0,0|1,0,1]=3 1555 B6R0.6 C#CCCOCC Amb33169090 [0,1,0,0,0,0|1,1,1]=4 1556 B6R0.6 C#CCCSCC Amb24670860 [0,1,0,0,0,0|1,0,1]=3 1557 B6R0.6 C#CCNCC=C Amb21953877 [0,1,0,0,0,0|2,0,1]=4 1558 B6R0.6 C#CCNCC=C Amb6365586 [0,1,0,0,0,0|2,0,1]=4 1559 B6R0.6 C#CCNCCC Amb10610181 [0,1,0,0,0,0|2,0,1]=4 1560 B6R0.6 C#CCNCCC Amb5262802 [0,1,0,0,0,0|2,0,1]=4 1561 B6R0.6 C#CCOCC=C Amb26362527 [0,1,0,0,0,0|2,0,1]=4 1562 B6R0.6 C#CCSCC=C Amb27641794 [0,1,0,0,0,0|2,0,1]=4 1563 B6R0.6 C#C\C=C\CCC Amb33424839 [0,1,0,0,0,0|2,0,1]=4 1564 B6R0.6 C=C=CCCC=O Amb28208489 [0,1,0,0,0,0|1,0,1]=3 1565 B6R0.6 C=C=CCCCCl Amb17939722 [0,1,0,0,0,0|3,0,0]=4 1566 B6R0.6 C=C=CCCCN Amb27222280 [0,1,0,0,0,0|3,0,0]=4 1567 B6R0.6 C=C=CCCCO Amb10605300 [0,1,0,0,0,0|3,0,0]=4 1568 B6R0.6 C=CC#CCCC Amb17673843 [0,1,0,0,0,0|2,0,1]=4 1569 B6R0.6 C=CCC#CC=O Amb28388610 [0,1,0,0,0,0|1,0,2]=4 1570 B6R0.6 C=CCC#CCC Amb22227956 [0,1,0,0,0,0|2,0,1]=4 1571 B6R0.6 C=CCC#CCN Amb27639779 [0,1,0,0,0,0|2,0,1]=4 1572 B6R0.6 C=CCC#CCO Amb24479025 [0,1,0,0,0,0|2,0,1]=4 1573 B6R0.6 C=CCCC#CC Amb35680296 [0,1,0,0,0,0|2,0,0]=3 1574 B6R0.6 C=CCCCC#N Amb6298890 [0,1,0,0,0,0|2,0,1]=4 1575 B6R0.6 C=CCCCC=C Amb22227760 [0,1,0,0,0,0|2,0,1]=4 1576 B6R0.6 C=CCCCC=O Amb13883672 [0,1,0,0,0,0|1,0,1]=3 1577 B6R0.6 C=CCCCCBr Amb3940222 [0,1,0,0,0,0|2,0,0]=3 1578 B6R0.6 C=CCCCCC Amb3940498 [0,1,0,0,0,0|2,0,0]=3 1579 B6R0.6 C=CCCCCCl Amb2692039 [0,1,0,0,0,0|2,0,0]=3 1580 B6R0.6 C=CCCCCF Amb24409527 [0,1,0,0,0,0|2,0,0]=3 1581 B6R0.6 C=CCCCCI Amb26858458 [0,1,0,0,0,0|2,0,0]=3 1582 B6R0.6 C=CCCCCN Amb18639514 [0,1,0,0,0,0|2,0,0]=3 1583 B6R0.6 C=CCCCCO Amb3940341 [0,1,0,0,0,0|2,0,0]=3 1584 B6R0.6 C=CCCCNC Amb18523846 [0,1,0,0,0,0|2,0,0]=3 1585 B6R0.6 C=CCCCNC Amb32651835 [0,1,0,0,0,0|2,0,0]=3 1586 B6R0.6 C=CCCCNO Amb27437399 [0,1,0,0,0,0|3,0,0]=4 1587 B6R0.6 C=CCCCOC Amb24432882 [0,1,0,0,0,0|1,1,0]=3 1588 B6R0.6 C=CCCN=C=O Amb28076943 [0,1,0,0,0,0|1,0,2]=4 1589 B6R0.6 C=CCCN=C=S Amb24054319 [0,1,0,0,0,0|2,0,1]=4 1590 B6R0.6 C=CCCN=[N+]=[N-] Amb33545543 [0,1,0,0,0,0|3,0,0]=4 1591 B6R0.6 C=CCCNC#N Amb26878076 [0,1,0,0,0,0|2,0,1]=4 1592 B6R0.6 C=CCCOCCl Amb2696084 [0,1,0,0,0,0|1,1,0]=3 1593 B6R0.6 C=CCCSCC Amb27213772 [0,1,0,0,0,0|1,0,0]=2 1594 B6R0.6 C=CCC\C=C\C Amb22734684 [0,1,0,0,0,0|2,0,0]=3 1595 B6R0.6 C=CCNCC#N Amb6706494 [0,1,0,0,0,0|3,0,0]=4 1596 B6R0.6 C=CCNCC=C Amb3940050 [0,1,0,0,0,0|2,0,1]=4 1597 B6R0.6 C=CCNCCC Amb22587187 [0,1,0,0,0,0|2,0,0]=3 1598 B6R0.6 C=CCNCCC Amb6683949 [0,1,0,0,0,0|2,0,0]=3 1599 B6R0.6 C=CCNCCCl Amb17334072 [0,1,0,0,0,0|3,0,0]=4 1600 B6R0.6 C=CCNCCN Amb17091015 [0,1,0,0,0,0|3,0,0]=4 1601 B6R0.6 C=CCNCCO Amb6706545 [0,1,0,0,0,0|3,0,0]=4 1602 B6R0.6 C=CCNCOC Amb27973157 [0,1,0,0,0,0|1,1,0]=3 1603 B6R0.6 C=CCOCC#N Amb9208775 [0,1,0,0,0,0|3,0,0]=4 1604 B6R0.6 C=CCOCC=C Amb8515934 [0,1,0,0,0,0|2,0,1]=4 1605 B6R0.6 C=CCOCC=O Amb27402231 [0,1,0,0,0,0|1,0,1]=3 1606 B6R0.6 C=CCOCCBr Amb33531510 [0,1,0,0,0,0|3,0,0]=4 1607 B6R0.6 C=CCOCCC Amb3940491 [0,1,0,0,0,0|2,0,0]=3 1608 B6R0.6 C=CCOCCCl Amb2696085 [0,1,0,0,0,0|3,0,0]=4 1609 B6R0.6 C=CCOCCI Amb24739964 [0,1,0,0,0,0|3,0,0]=4 1610 B6R0.6 C=CCOCCN Amb32667523 [0,1,0,0,0,0|3,0,0]=4 1611 B6R0.6 C=CCOCCN Amb33530047 [0,1,0,0,0,0|3,0,0]=4 1612 B6R0.6 C=CCOCCO Amb3940609 [0,1,0,0,0,0|3,0,0]=4 1613 B6R0.6 C=CCOCOC Amb24385255 [0,1,0,0,0,0|1,1,0]=3 1614 B6R0.6 C=CCSCC=C Amb8393147 [0,1,0,0,0,0|2,0,1]=4 1615 B6R0.6 C=CCSCC=O Amb18641509 [0,1,0,0,0,0|1,0,1]=3 1616 B6R0.6 C=CCSCCCl Amb28042684 [0,1,0,0,0,0|3,0,0]=4 1617 B6R0.6 C=CCSCCN Amb13951462 [0,1,0,0,0,0|3,0,0]=4 1618 B6R0.6 C=CCSCCN Amb6273787 [0,1,0,0,0,0|3,0,0]=4 1619 B6R0.6 C=COCCCC Amb8513427 [0,1,0,0,0,0|2,0,0]=3 1620 B6R0.6 C=COCCCCl Amb27613489 [0,1,0,0,0,0|3,0,0]=4 1621 B6R0.6 C=COCCCF Amb22008255 [0,1,0,0,0,0|3,0,0]=4 1622 B6R0.6 C=COCCCN Amb3997182 [0,1,0,0,0,0|3,0,0]=4 1623 B6R0.6 C=COCCNN Amb28421647 [0,1,0,0,0,0|3,0,0]=4 1624 B6R0.6 C=COCCOC Amb21520356 [0,1,0,0,0,0|1,1,0]=3 1625 B6R0.6 C=COCCON Amb22001402 [0,1,0,0,0,0|2,1,0]=4 1626 B6R0.6 C=CSCCCN Amb27800121 [0,1,0,0,0,0|1,0,2]=4 1627 B6R0.6 C=C\C=C\CCC Amb33171502 [0,1,0,0,0,0|2,0,1]=4 1628 B6R0.6 C=C\C=C\CNC Amb25244153 [0,1,0,0,0,0|2,0,1]=4 1629 B6R0.6 CC#CC#CC=O Amb17593044 [0,1,0,0,0,0|1,0,2]=4 1630 B6R0.6 CC#CCCCBr Amb18791571 [0,1,0,0,0,0|2,0,1]=4 1631 B6R0.6 CC#CCCCCl Amb27865837 [0,1,0,0,0,0|2,0,1]=4 1632 B6R0.6 CC#CCCCO Amb20242139 [0,1,0,0,0,0|1,0,2]=4 1633 B6R0.6 CC#CCCNN Amb27243030 [0,1,0,0,0,0|3,0,0]=4 1634 B6R0.6 CC#CCCON Amb27815658 [0,1,0,0,0,0|3,0,0]=4 1635 B6R0.6 CC#CCCSC Amb27594693 [0,1,0,0,0,0|1,0,1]=3 1636 B6R0.6 CC#C\C=C\C=O Amb28050254 [0,1,0,0,0,0|1,0,2]=4 1637 B6R0.6 CCC#CCC=O Amb28396959 [0,1,0,0,0,0|1,0,1]=3 1638 B6R0.6 CCC=C=CC=O Amb27237589 [0,1,0,0,0,0|1,0,2]=4 1639 B6R0.6 CCCC#CC=O Amb27244852 [0,1,0,0,0,0|1,0,1]=3 1640 B6R0.6 CCCC=C=CBr Amb27477883 [0,1,0,0,0,0|2,0,1]=4 1641 B6R0.6 CCCCBOC Amb22728871 [0,1,0,0,0,0|1,1,1]=4 1642 B6R0.6 CCCCC#CI Amb27632377 [0,1,0,0,0,0|2,0,1]=4 1643 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [0,1,0,0,0,0|2,0,0]=3 1644 B6R0.6 CCCCCC#N Amb6250301 [0,1,0,0,0,0|2,0,1]=4 1645 B6R0.6 CCCCCC=O Amb3939522 [0,1,0,0,0,0|1,0,0]=2 1646 B6R0.6 CCCCCCBr Amb3940085 [0,1,0,0,0,0|2,0,1]=4 1647 B6R0.6 CCCCCCC Amb8513177 [0,1,0,0,0,0|2,0,1]=4 1648 B6R0.6 CCCCCCCl Amb7764628 [0,1,0,0,0,0|2,0,1]=4 1649 B6R0.6 CCCCCCF Amb8516643 [0,1,0,0,0,0|2,0,1]=4 1650 B6R0.6 CCCCCCI Amb6608700 [0,1,0,0,0,0|2,0,1]=4 1651 B6R0.6 CCCCCCN Amb2721179 [0,1,0,0,0,0|2,0,1]=4 1652 B6R0.6 CCCCCCN Amb3940465 [0,1,0,0,0,0|2,0,1]=4 1653 B6R0.6 CCCCCCO Amb3941500 [0,1,0,0,0,0|1,0,2]=4 1654 B6R0.6 CCCCCCS Amb8514502 [0,1,0,0,0,0|1,1,1]=4 1655 B6R0.6 CCCCCC[SiH3] Amb19893900 [0,1,0,0,0,0|2,0,1]=4 1656 B6R0.6 CCCCCNC Amb3939381 [0,1,0,0,0,0|2,0,1]=4 1657 B6R0.6 CCCCCNN Amb32693399 [0,1,0,0,0,0|2,0,1]=4 1658 B6R0.6 CCCCCNN Amb6249376 [0,1,0,0,0,0|2,0,1]=4 1659 B6R0.6 CCCCCNO Amb25067859 [0,1,0,0,0,0|1,0,2]=4 1660 B6R0.6 CCCCCOC Amb9787609 [0,1,0,0,0,0|1,0,2]=4 1661 B6R0.6 CCCCCON Amb18122095 [0,1,0,0,0,0|1,0,2]=4 1662 B6R0.6 CCCCCSC Amb21618865 [0,1,0,0,0,0|1,0,1]=3 1663 B6R0.6 CCCCN=C=O Amb3939310 [0,1,0,0,0,0|1,0,1]=3 1664 B6R0.6 CCCCN=C=S Amb6572520 [0,1,0,0,0,0|1,1,1]=4 1665 B6R0.6 CCCCN=[N+]=N Amb34916661 [0,1,0,0,0,0|3,0,0]=4 1666 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [0,1,0,0,0,0|3,0,0]=4 1667 B6R0.6 CCCCN=[N+]=[N-] Amb33526892 [0,1,0,0,0,0|3,0,0]=4 1668 B6R0.6 CCCCNC=O Amb4017838 [0,1,0,0,0,0|1,0,0]=2 1669 B6R0.6 CCCCNCC Amb3939842 [0,1,0,0,0,0|2,0,1]=4 1670 B6R0.6 CCCCNOC Amb24479420 [0,1,0,0,0,0|1,1,1]=4 1671 B6R0.6 CCCCOB=O Amb26900238 [0,1,0,0,0,0|2,0,0]=3 1672 B6R0.6 CCCCOC=O Amb6608882 [0,1,0,0,0,0|1,0,0]=2 1673 B6R0.6 CCCCOCC Amb2685642 [0,1,0,0,0,0|1,1,1]=4 1674 B6R0.6 CCCCOCO Amb24480826 [0,1,0,0,0,0|1,0,2]=4 1675 B6R0.6 CCCCON=O Amb8515227 [0,1,0,0,0,0|2,0,0]=3 1676 B6R0.6 CCCCSC#N Amb4035931 [0,1,0,0,0,0|1,0,2]=4 1677 B6R0.6 CCCCSCC Amb9787545 [0,1,0,0,0,0|1,0,1]=3 1678 B6R0.6 CCCCSCCl Amb25146885 [0,1,0,0,0,0|1,0,1]=3 1679 B6R0.6 CCCCSCO Amb27623932 [0,1,0,0,0,0|1,0,1]=3 1680 B6R0.6 CCCC\C=C\I Amb25173925 [0,1,0,0,0,0|2,0,0]=3 1681 B6R0.6 CCCNCC#N Amb6714443 [0,1,0,0,0,0|2,0,1]=4 1682 B6R0.6 CCCNCCC Amb3939352 [0,1,0,0,0,0|2,0,1]=4 1683 B6R0.6 CCCNCCCl Amb17334074 [0,1,0,0,0,0|2,0,1]=4 1684 B6R0.6 CCCNCCN Amb8515461 [0,1,0,0,0,0|2,0,1]=4 1685 B6R0.6 CCCNCCO Amb3939869 [0,1,0,0,0,0|1,0,2]=4 1686 B6R0.6 CCCNCOC Amb27830080 [0,1,0,0,0,0|1,1,1]=4 1687 B6R0.6 CCCN\C=N\N Amb28049932 [0,1,0,0,0,0|3,0,0]=4 1688 B6R0.6 CCCOCC#N Amb8874819 [0,1,0,0,0,0|2,0,1]=4 1689 B6R0.6 CCCOCCC Amb8513440 [0,1,0,0,0,0|2,0,1]=4 1690 B6R0.6 CCCOCCCl Amb8514866 [0,1,0,0,0,0|2,0,1]=4 1691 B6R0.6 CCCOCCI Amb27596856 [0,1,0,0,0,0|2,0,1]=4 1692 B6R0.6 CCCOCCN Amb3939563 [0,1,0,0,0,0|2,0,1]=4 1693 B6R0.6 CCCOCCO Amb3939227 [0,1,0,0,0,0|1,0,2]=4 1694 B6R0.6 CCCSCC#N Amb6680723 [0,1,0,0,0,0|2,0,1]=4 1695 B6R0.6 CCCSCCBr Amb9304990 [0,1,0,0,0,0|2,0,1]=4 1696 B6R0.6 CCCSCCC Amb9787473 [0,1,0,0,0,0|2,0,1]=4 1697 B6R0.6 CCCSCCCl Amb9304987 [0,1,0,0,0,0|2,0,1]=4 1698 B6R0.6 CCCSCCN Amb19888435 [0,1,0,0,0,0|2,0,1]=4 1699 B6R0.6 CCCSCCN Amb6268693 [0,1,0,0,0,0|2,0,1]=4 1700 B6R0.6 CCCSCCS Amb28050075 [0,1,0,0,0,0|1,1,1]=4 1701 B6R0.6 CCCSCNC Amb27879006 [0,1,0,0,0,0|2,0,1]=4 1702 B6R0.6 CCCSSCC Amb24063527 [0,1,0,0,0,0|2,0,1]=4 1703 B6R0.6 CCCSSSC Amb8392859 [0,1,0,0,0,0|2,0,1]=4 1704 B6R0.6 CCC\C=C/C=O Amb25885814 [0,1,0,0,0,0|1,0,1]=3 1705 B6R0.6 CCC\C=C\C=O Amb3940431 [0,1,0,0,0,0|1,0,1]=3 1706 B6R0.6 CCC\C=C\CCl Amb27482813 [0,1,0,0,0,0|2,0,1]=4 1707 B6R0.6 CCC\C=C\CN Amb33475254 [0,1,0,0,0,0|2,0,1]=4 1708 B6R0.6 CCC\C=C\CO Amb32660968 [0,1,0,0,0,0|1,0,2]=4 1709 B6R0.6 CCC\C=C\CS Amb33373719 [0,1,0,0,0,0|1,1,1]=4 1710 B6R0.6 CCNCCC#N Amb2720499 [0,1,0,0,0,0|2,0,1]=4 1711 B6R0.6 CCNCCCBr Amb27265760 [0,1,0,0,0,0|2,0,1]=4 1712 B6R0.6 CCNCCCF Amb28050218 [0,1,0,0,0,0|2,0,1]=4 1713 B6R0.6 CCNCCCN Amb17315269 [0,1,0,0,0,0|2,0,1]=4 1714 B6R0.6 CCNCCCO Amb6733726 [0,1,0,0,0,0|1,0,2]=4 1715 B6R0.6 CCNCCOC Amb32653021 [0,1,0,0,0,0|1,1,1]=4 1716 B6R0.6 CCNCCOC Amb3939818 [0,1,0,0,0,0|1,1,1]=4 1717 B6R0.6 CCNCCSC Amb19024605 [0,1,0,0,0,0|1,0,1]=3 1718 B6R0.6 CCNCCSC Amb28941534 [0,1,0,0,0,0|1,0,1]=3 1719 B6R0.6 CCNCNC=O Amb27252409 [0,1,0,0,0,0|2,0,0]=3 1720 B6R0.6 CCNC\C=C/I Amb23539308 [0,1,0,0,0,0|2,0,1]=4 1721 B6R0.6 CCN\C=C/C=O Amb27793118 [0,1,0,0,0,0|1,0,2]=4 1722 B6R0.6 CCOCCC#N Amb4019489 [0,1,0,0,0,0|1,1,1]=4 1723 B6R0.6 CCOCCC=O Amb25688261 [0,1,0,0,0,0|0,1,0]=2 1724 B6R0.6 CCOCCCBr Amb8828206 [0,1,0,0,0,0|1,1,1]=4 1725 B6R0.6 CCOCCCCl Amb6255304 [0,1,0,0,0,0|1,1,1]=4 1726 B6R0.6 CCOCCCN Amb3939347 [0,1,0,0,0,0|1,1,1]=4 1727 B6R0.6 CCOCCCO Amb3939322 [0,1,0,0,0,0|0,1,2]=4 1728 B6R0.6 CCOCCNC Amb19959934 [0,1,0,0,0,0|2,0,1]=4 1729 B6R0.6 CCOCCNC Amb33529221 [0,1,0,0,0,0|2,0,1]=4 1730 B6R0.6 CCOCCNN Amb22587352 [0,1,0,0,0,0|2,1,0]=4 1731 B6R0.6 CCOCCNN Amb6744628 [0,1,0,0,0,0|2,1,0]=4 1732 B6R0.6 CCOCCOC Amb22052684 [0,1,0,0,0,0|1,1,1]=4 1733 B6R0.6 CCOCCON Amb18061689 [0,1,0,0,0,0|2,1,0]=4 1734 B6R0.6 CCOCNC=O Amb28252363 [0,1,0,0,0,0|1,1,0]=3 1735 B6R0.6 CCOC\C=C\Br Amb28244732 [0,1,0,0,0,0|1,1,1]=4 1736 B6R0.6 CCO\C=C/C=O Amb27423444 [0,1,0,0,0,0|0,1,2]=4 1737 B6R0.6 CCO\C=C\C=O Amb18639560 [0,1,0,0,0,0|0,1,2]=4 1738 B6R0.6 CCSCCC#N Amb6680683 [0,1,0,0,0,0|1,0,1]=3 1739 B6R0.6 CCSCCC=O Amb27254551 [0,1,0,0,0,0|0,0,0]=1 1740 B6R0.6 CCSCCCBr Amb9305000 [0,1,0,0,0,0|1,0,1]=3 1741 B6R0.6 CCSCCCI Amb28461625 [0,1,0,0,0,0|1,0,1]=3 1742 B6R0.6 CCSCCCN Amb6680223 [0,1,0,0,0,0|1,0,1]=3 1743 B6R0.6 CCSCCCO Amb3939588 [0,1,0,0,0,0|0,0,2]=3 1744 B6R0.6 CCSCCCS Amb26476929 [0,1,0,0,0,0|0,1,1]=3 1745 B6R0.6 CCSCCNC Amb16186669 [0,1,0,0,0,0|2,0,0]=3 1746 B6R0.6 CCSCCNN Amb27218047 [0,1,0,0,0,0|2,0,0]=3 1747 B6R0.6 CCSCCNO Amb33324087 [0,1,0,0,0,0|1,0,1]=3 1748 B6R0.6 CCSCCON Amb24414250 [0,1,0,0,0,0|2,0,0]=3 1749 B6R0.6 CCSCN=[N+]=[N-] Amb27838236 [0,1,0,0,0,0|3,0,0]=4 1750 B6R0.6 CCSCNC=O Amb28315587 [0,1,0,0,0,0|1,0,0]=2 1751 B6R0.6 CCSCSCC Amb17609604 [0,1,0,0,0,0|2,0,1]=4 1752 B6R0.6 CC\C=C/CC=O Amb18639157 [0,1,0,0,0,0|1,0,1]=3 1753 B6R0.6 CC\C=C/CCC Amb26600858 [0,1,0,0,0,0|2,0,1]=4 1754 B6R0.6 CC\C=C\CCC Amb19930065 [0,1,0,0,0,0|2,0,1]=4 1755 B6R0.6 CC\C=C\CNC Amb26618015 [0,1,0,0,0,0|2,0,1]=4 1756 B6R0.6 CNCCCCCl Amb34916601 [0,1,0,0,0,0|2,0,1]=4 1757 B6R0.6 CNCCCCF Amb27231439 [0,1,0,0,0,0|2,0,1]=4 1758 B6R0.6 CNCCCCN Amb17334048 [0,1,0,0,0,0|2,0,1]=4 1759 B6R0.6 CNCCCCN Amb2698063 [0,1,0,0,0,0|2,0,1]=4 1760 B6R0.6 CNCCCCO Amb33539277 [0,1,0,0,0,0|1,0,2]=4 1761 B6R0.6 CNCCCNC Amb3940467 [0,1,0,0,0,0|2,0,1]=4 1762 B6R0.6 CNCCCOC Amb33801534 [0,1,0,0,0,0|1,0,2]=4 1763 B6R0.6 CNCCCOC Amb9204018 [0,1,0,0,0,0|1,0,2]=4 1764 B6R0.6 CNCCCON Amb27430260 [0,1,0,0,0,0|1,0,2]=4 1765 B6R0.6 CNCCCSC Amb6718995 [0,1,0,0,0,0|1,0,1]=3 1766 B6R0.6 CNCCN=[N+]=[N-] Amb27461565 [0,1,0,0,0,0|3,0,0]=4 1767 B6R0.6 CNCCSSC Amb28146208 [0,1,0,0,0,0|2,0,0]=3 1768 B6R0.6 CNCC\C=C\Cl Amb27605601 [0,1,0,0,0,0|2,0,0]=3 1769 B6R0.6 CNC\C=C\CCl Amb28050469 [0,1,0,0,0,0|2,0,1]=4 1770 B6R0.6 CNOCCOC Amb32412843 [0,1,0,0,0,0|2,1,0]=4 1771 B6R0.6 COCCCC#N Amb6258835 [0,1,0,0,0,0|1,1,1]=4 1772 B6R0.6 COCCCC=O Amb33530955 [0,1,0,0,0,0|0,1,0]=2 1773 B6R0.6 COCCCCBr Amb8855443 [0,1,0,0,0,0|1,1,1]=4 1774 B6R0.6 COCCCCCl Amb17942999 [0,1,0,0,0,0|1,1,1]=4 1775 B6R0.6 COCCCCI Amb25933499 [0,1,0,0,0,0|1,1,1]=4 1776 B6R0.6 COCCCCN Amb10610278 [0,1,0,0,0,0|1,1,1]=4 1777 B6R0.6 COCCCCN Amb6251056 [0,1,0,0,0,0|1,1,1]=4 1778 B6R0.6 COCCCCO Amb17666901 [0,1,0,0,0,0|0,1,2]=4 1779 B6R0.6 COCCCCS Amb24654696 [0,1,0,0,0,0|0,2,1]=4 1780 B6R0.6 COCCCNN Amb25887940 [0,1,0,0,0,0|1,1,1]=4 1781 B6R0.6 COCCCNN Amb33204509 [0,1,0,0,0,0|1,1,1]=4 1782 B6R0.6 COCCCNN Amb33553392 [0,1,0,0,0,0|1,1,1]=4 1783 B6R0.6 COCCCNO Amb33378127 [0,1,0,0,0,0|0,1,2]=4 1784 B6R0.6 COCCCOC Amb22168275 [0,1,0,0,0,0|0,1,2]=4 1785 B6R0.6 COCCCON Amb18559290 [0,1,0,0,0,0|0,1,2]=4 1786 B6R0.6 COCCCSC Amb28139052 [0,1,0,0,0,0|0,0,2]=3 1787 B6R0.6 COCCN=C=O Amb901883 [0,1,0,0,0,0|0,1,1]=3 1788 B6R0.6 COCCN=C=S Amb6315776 [0,1,0,0,0,0|0,2,1]=4 1789 B6R0.6 COCCN=[N+]=[N-] Amb25118120 [0,1,0,0,0,0|2,1,0]=4 1790 B6R0.6 COCCNC=O Amb24334241 [0,1,0,0,0,0|0,1,0]=2 1791 B6R0.6 COCCOCCl Amb6608984 [0,1,0,0,0,0|1,1,1]=4 1792 B6R0.6 COCCOCO Amb28281708 [0,1,0,0,0,0|0,1,2]=4 1793 B6R0.6 COCCSCCl Amb33545127 [0,1,0,0,0,0|2,0,0]=3 1794 B6R0.6 COCNCCO Amb18522071 [0,1,0,0,0,0|0,1,2]=4 1795 B6R0.6 COCOCC#N Amb28288512 [0,1,0,0,0,0|1,1,1]=4 1796 B6R0.6 COCOCC=O Amb27409311 [0,1,0,0,0,0|0,1,0]=2 1797 B6R0.6 COCOCCCl Amb22546806 [0,1,0,0,0,0|1,1,1]=4 1798 B6R0.6 COCOCCI Amb26443893 [0,1,0,0,0,0|1,1,1]=4 1799 B6R0.6 COCOCCN Amb25314793 [0,1,0,0,0,0|1,1,1]=4 1800 B6R0.6 COCOCCO Amb23590973 [0,1,0,0,0,0|0,1,2]=4 1801 B6R0.6 COCSCC#N Amb18928019 [0,1,0,0,0,0|1,1,1]=4 1802 B6R0.6 COC\C=C\C#N Amb18120668 [0,1,0,0,0,0|1,1,1]=4 1803 B6R0.6 COC\C=C\C=O Amb33473884 [0,1,0,0,0,0|0,1,1]=3 1804 B6R0.6 COC\C=C\CBr Amb28050318 [0,1,0,0,0,0|1,1,1]=4 1805 B6R0.6 COC\C=C\CN Amb28341719 [0,1,0,0,0,0|1,1,1]=4 1806 B6R0.6 COC\C=C\CO Amb33428788 [0,1,0,0,0,0|0,1,2]=4 1807 B6R0.6 CONCCC#N Amb28124164 [0,1,0,0,0,0|1,1,1]=4 1808 B6R0.6 CONCCCN Amb26953498 [0,1,0,0,0,0|1,1,1]=4 1809 B6R0.6 CONCCCN Amb30584683 [0,1,0,0,0,0|1,1,1]=4 1810 B6R0.6 CONCCCN Amb32666616 [0,1,0,0,0,0|1,1,1]=4 1811 B6R0.6 CONCCCO Amb24479622 [0,1,0,0,0,0|0,1,2]=4 1812 B6R0.6 CONCCCO Amb33456216 [0,1,0,0,0,0|0,1,2]=4 1813 B6R0.6 CSC#CCCO Amb17593203 [0,1,0,0,0,0|0,0,3]=4 1814 B6R0.6 CSCCCC#N Amb17504231 [0,1,0,0,0,0|1,0,1]=3 1815 B6R0.6 CSCCCC=O Amb25992553 [0,1,0,0,0,0|0,0,0]=1 1816 B6R0.6 CSCCCCBr Amb19054837 [0,1,0,0,0,0|1,0,1]=3 1817 B6R0.6 CSCCCCCl Amb25240444 [0,1,0,0,0,0|1,0,1]=3 1818 B6R0.6 CSCCCCF Amb27620229 [0,1,0,0,0,0|1,0,1]=3 1819 B6R0.6 CSCCCCN Amb17500948 [0,1,0,0,0,0|1,0,1]=3 1820 B6R0.6 CSCCCCO Amb9825911 [0,1,0,0,0,0|0,0,2]=3 1821 B6R0.6 CSCCCCS Amb27461555 [0,1,0,0,0,0|0,1,1]=3 1822 B6R0.6 CSCCCNN Amb24093854 [0,1,0,0,0,0|1,0,1]=3 1823 B6R0.6 CSCCCNO Amb27948053 [0,1,0,0,0,0|0,0,2]=3 1824 B6R0.6 CSCCCON Amb27947150 [0,1,0,0,0,0|0,0,2]=3 1825 B6R0.6 CSCCCSC Amb22043311 [0,1,0,0,0,0|0,1,1]=3 1826 B6R0.6 CSCCN=C=O Amb19889355 [0,1,0,0,0,0|0,0,1]=2 1827 B6R0.6 CSCCN=C=S Amb22059365 [0,1,0,0,0,0|0,1,1]=3 1828 B6R0.6 CSCCN=[N+]=[N-] Amb16186858 [0,1,0,0,0,0|2,0,0]=3 1829 B6R0.6 CSCCNC#N Amb27946292 [0,1,0,0,0,0|1,0,1]=3 1830 B6R0.6 CSCCNC=O Amb28437305 [0,1,0,0,0,0|0,0,0]=1 1831 B6R0.6 CSCSCSC Amb25025600 [0,1,0,0,0,0|2,0,0]=3 1832 B6R0.6 CSC\C=C\C=O Amb33271737 [0,1,0,0,0,0|0,0,1]=2 1833 B6R0.6 CSC\C=C\CCl Amb27473343 [0,1,0,0,0,0|1,0,1]=3 1834 B6R0.6 CSC\C=C\CN Amb33474032 [0,1,0,0,0,0|1,0,1]=3 1835 B6R0.6 CSC\C=C\CO Amb33079758 [0,1,0,0,0,0|0,0,2]=3 1836 B6R0.6 C\C=C/C#CC=O Amb28050135 [0,1,0,0,0,0|1,0,2]=4 1837 B6R0.6 C\C=C/CCC=O Amb28202620 [0,1,0,0,0,0|1,0,0]=2 1838 B6R0.6 C\C=C/CCCC Amb24467666 [0,1,0,0,0,0|2,0,0]=3 1839 B6R0.6 C\C=C/CCCN Amb27658374 [0,1,0,0,0,0|2,0,1]=4 1840 B6R0.6 C\C=C/CCCO Amb17614951 [0,1,0,0,0,0|1,0,2]=4 1841 B6R0.6 C\C=C\C=C\C=O Amb33986154 [0,1,0,0,0,0|1,0,2]=4 1842 B6R0.6 C\C=C\CCC=O Amb17593074 [0,1,0,0,0,0|1,0,0]=2 1843 B6R0.6 C\C=C\CCCC Amb8515158 [0,1,0,0,0,0|2,0,0]=3 1844 B6R0.6 C\C=C\CCCI Amb25837122 [0,1,0,0,0,0|2,0,1]=4 1845 B6R0.6 C\C=C\CCCO Amb22347882 [0,1,0,0,0,0|1,0,2]=4 1846 B6R0.6 C\C=C\SCCC Amb22168314 [0,1,0,0,0,0|2,0,1]=4 1847 B6R0.6 C\C=C\SSSC Amb26533859 [0,1,0,0,0,0|2,0,1]=4 1848 B6R0.6 ClCCCCCBr Amb2724373 [0,1,0,0,0,0|2,0,1]=4 1849 B6R0.6 ClCCCCCCl Amb6608828 [0,1,0,0,0,0|2,0,1]=4 1850 B6R0.6 ClCCCCCI Amb10069913 [0,1,0,0,0,0|2,0,1]=4 1851 B6R0.6 ClCCCOCBr Amb28458531 [0,1,0,0,0,0|1,1,1]=4 1852 B6R0.6 ClCCCOCCl Amb24479881 [0,1,0,0,0,0|1,1,1]=4 1853 B6R0.6 ClCOCCCBr Amb25889019 [0,1,0,0,0,0|1,1,1]=4 1854 B6R0.6 FCCCCCBr Amb15701635 [0,1,0,0,0,0|2,0,1]=4 1855 B6R0.6 FCCCCCF Amb27397467 [0,1,0,0,0,0|2,0,1]=4 1856 B6R0.6 FCCCCCS Amb24409033 [0,1,0,0,0,0|1,1,1]=4 1857 B6R0.6 ICCCCCI Amb8514835 [0,1,0,0,0,0|2,0,1]=4 1858 B6R0.6 N#CCCCC=O Amb18120556 [0,1,0,0,0,0|1,0,1]=3 1859 B6R0.6 N#CCCCCBr Amb2685556 [0,1,0,0,0,0|2,0,1]=4 1860 B6R0.6 N#CCCCCCl Amb3940299 [0,1,0,0,0,0|2,0,1]=4 1861 B6R0.6 N#CCCCCF Amb26935678 [0,1,0,0,0,0|2,0,1]=4 1862 B6R0.6 N#CCCCCI Amb27650166 [0,1,0,0,0,0|2,0,1]=4 1863 B6R0.6 N#CCCCCN Amb30628578 [0,1,0,0,0,0|2,0,1]=4 1864 B6R0.6 N#CCCCCN Amb33532899 [0,1,0,0,0,0|2,0,1]=4 1865 B6R0.6 N#CCCCCO Amb33531864 [0,1,0,0,0,0|2,0,1]=4 1866 B6R0.6 N#CC\C=C\C=O Amb25073805 [0,1,0,0,0,0|2,0,1]=4 1867 B6R0.6 N#CSCCCBr Amb27878620 [0,1,0,0,0,0|1,0,2]=4 1868 B6R0.6 N#CSCCCF Amb28343931 [0,1,0,0,0,0|1,0,2]=4 1869 B6R0.6 N#CSCCCN Amb27881665 [0,1,0,0,0,0|1,0,2]=4 1870 B6R0.6 N#CSCCCN Amb32652034 [0,1,0,0,0,0|1,0,2]=4 1871 B6R0.6 N#CS\C=C\C=O Amb27793341 [0,1,0,0,0,0|0,0,3]=4 1872 B6R0.6 NCCCCC=O Amb26627836 [0,1,0,0,0,0|1,0,0]=2 1873 B6R0.6 NCCCCCBr Amb26581378 [0,1,0,0,0,0|2,0,1]=4 1874 B6R0.6 NCCCCCCl Amb17593241 [0,1,0,0,0,0|2,0,1]=4 1875 B6R0.6 NCCCCCF Amb28383861 [0,1,0,0,0,0|2,0,1]=4 1876 B6R0.6 NCCCCCF Amb35747648 [0,1,0,0,0,0|2,0,1]=4 1877 B6R0.6 NCCCCCI Amb27596855 [0,1,0,0,0,0|2,0,1]=4 1878 B6R0.6 NCCCCCN Amb22002397 [0,1,0,0,0,0|2,0,1]=4 1879 B6R0.6 NCCCCCN Amb8513099 [0,1,0,0,0,0|2,0,1]=4 1880 B6R0.6 NCCCCCO Amb3939337 [0,1,0,0,0,0|1,0,2]=4 1881 B6R0.6 NCCCCCS Amb33362345 [0,1,0,0,0,0|1,1,1]=4 1882 B6R0.6 NCCCCCS Amb33527075 [0,1,0,0,0,0|1,1,1]=4 1883 B6R0.6 NCCCCNO Amb24117989 [0,1,0,0,0,0|2,0,1]=4 1884 B6R0.6 NCCCCNO Amb27668394 [0,1,0,0,0,0|2,0,1]=4 1885 B6R0.6 NCCCCON Amb28188672 [0,1,0,0,0,0|3,0,0]=4 1886 B6R0.6 NCCCNC=O Amb5723517 [0,1,0,0,0,0|2,0,0]=3 1887 B6R0.6 NCCCOCF Amb33224234 [0,1,0,0,0,0|1,1,1]=4 1888 B6R0.6 NCCC\C=C/I Amb28050291 [0,1,0,0,0,0|2,0,1]=4 1889 B6R0.6 NNCCCCO Amb24692523 [0,1,0,0,0,0|3,0,0]=4 1890 B6R0.6 NOCCCCF Amb27160797 [0,1,0,0,0,0|3,0,0]=4 1891 B6R0.6 O=C=NCCCBr Amb27859638 [0,1,0,0,0,0|2,0,1]=4 1892 B6R0.6 O=C=NCCCCl Amb3939153 [0,1,0,0,0,0|2,0,1]=4 1893 B6R0.6 O=C=NCCCF Amb27838244 [0,1,0,0,0,0|2,0,1]=4 1894 B6R0.6 O=CCCCC=O Amb6600455 [0,1,0,0,0,0|1,0,1]=3 1895 B6R0.6 O=CCCCCBr Amb18126353 [0,1,0,0,0,0|1,0,0]=2 1896 B6R0.6 O=CCCCCCl Amb18123550 [0,1,0,0,0,0|1,0,0]=2 1897 B6R0.6 O=CCCCCO Amb10603837 [0,1,0,0,0,0|1,0,0]=2 1898 B6R0.6 O=CCCCN=O Amb27838215 [0,1,0,0,0,0|2,0,0]=3 1899 B6R0.6 O=CCC\C=C/Br Amb27838206 [0,1,0,0,0,0|1,0,1]=3 1900 B6R0.6 O=CCC\C=C\Cl Amb27955198 [0,1,0,0,0,0|1,0,1]=3 1901 B6R0.6 O=CNCCCO Amb27248821 [0,1,0,0,0,0|2,0,0]=3 1902 B6R0.6 O=CNCNC=O Amb4017373 [0,1,0,0,0,0|2,0,1]=4 1903 B6R0.6 O=C\C=C/CC=O Amb28050289 [0,1,0,0,0,0|1,0,2]=4 1904 B6R0.6 O=C\C=C/CCO Amb27235316 [0,1,0,0,0,0|1,0,2]=4 1905 B6R0.6 O=C\C=C\CC=O Amb17593064 [0,1,0,0,0,0|1,0,2]=4 1906 B6R0.6 O=C\C=C\CCF Amb33429802 [0,1,0,0,0,0|1,0,2]=4 1907 B6R0.6 O=[PH2]OCCCO Amb27218913 [0,1,0,0,0,0|3,0,0]=4 1908 B6R0.6 OCCCCCBr Amb10603824 [0,1,0,0,0,0|1,0,2]=4 1909 B6R0.6 OCCCCCCl Amb8386939 [0,1,0,0,0,0|1,0,2]=4 1910 B6R0.6 OCCCCCF Amb24479828 [0,1,0,0,0,0|1,0,2]=4 1911 B6R0.6 OCCCCCO Amb6296608 [0,1,0,0,0,0|1,0,2]=4 1912 B6R0.6 OCCCCNO Amb27396013 [0,1,0,0,0,0|2,0,1]=4 1913 B6R0.6 OCCC\C=C\Br Amb27483322 [0,1,0,0,0,0|2,0,1]=4 1914 B6R0.6 OCCC\C=C\I Amb27879078 [0,1,0,0,0,0|2,0,1]=4 1915 B6R0.6 OCSCSCO Amb27826296 [0,1,0,0,0,0|1,0,2]=4 1916 B6R0.6 SCCCCCS Amb8514611 [0,1,0,0,0,0|1,1,1]=4 1917 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [0,1,0,0,0,0|2,0,1]=4 1918 B6R0.6 [C-]#[N+]CCCCF Amb26005128 [0,1,0,0,0,0|3,0,0]=4 1919 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [0,1,0,0,0,0|1,1,1]=4 1920 B6R0.6 [C-]#[N+]CCCSC Amb33198739 [0,1,0,0,0,0|1,0,1]=3 1921 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [0,1,0,0,0,0|2,1,0]=4 1922 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [0,1,0,0,0,0|2,0,0]=3 1923 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [0,1,0,0,0,0|2,0,0]=3 1924 B6R1.1 C1=CCC=CC1 Amb8513501 [0,0,0,1,0,0|2,0,1]=4 1925 B6R1.1 C1=CCCC=C1 Amb6297761 [0,0,0,1,0,0|2,0,1]=4 1926 B6R1.1 C1=CCCCC1 Amb6608805 [0,0,0,1,0,0|2,0,0]=3 1927 B6R1.1 C1=CCNCC1 Amb2720330 [0,0,0,1,0,0|2,0,0]=3 1928 B6R1.1 C1=CCNCC1 Amb3941710 [0,0,0,1,0,0|2,0,0]=3 1929 B6R1.1 C1=CCNNC1 Amb24714188 [0,0,0,1,0,0|3,0,0]=4 1930 B6R1.1 C1=CCNNC1 Amb32668094 [0,0,0,1,0,0|3,0,0]=4 1931 B6R1.1 C1=CCOCC1 Amb16234261 [0,0,0,1,0,0|1,1,0]=3 1932 B6R1.1 C1=CCONC1 Amb19651283 [0,0,0,1,0,0|2,1,0]=4 1933 B6R1.1 C1=CCONC1 Amb21961474 [0,0,0,1,0,0|2,1,0]=4 1934 B6R1.1 C1=CCSCC1 Amb29848083 [0,0,0,1,0,0|1,0,0]=2 1935 B6R1.1 C1=CNCCC1 Amb24389577 [0,0,0,1,0,0|2,0,1]=4 1936 B6R1.1 C1=COCCC1 Amb6609004 [0,0,0,1,0,0|1,0,2]=4 1937 B6R1.1 C1=NCCCC1 Amb27752613 [0,0,0,1,0,0|2,0,0]=3 1938 B6R1.1 C1=NCCCN1 Amb17620508 [0,0,0,1,0,0|3,0,0]=4 1939 B6R1.1 C1=NCNCC1 Amb27175339 [0,0,0,1,0,0|2,0,0]=3 1940 B6R1.1 C1=NCNCS1 Amb27750508 [0,0,0,1,0,0|2,1,0]=4 1941 B6R1.1 C1=NSCCC1 Amb27266087 [0,0,0,1,0,0|2,0,1]=4 1942 B6R1.1 C1CCNCC1 Amb2792840 [0,0,0,1,0,0|2,0,1]=4 1943 B6R1.1 C1CCNCC1 Amb2816589 [0,0,0,1,0,0|2,0,1]=4 1944 B6R1.1 C1CCNNC1 Amb10975991 [0,0,0,1,0,0|3,0,0]=4 1945 B6R1.1 C1CCNNC1 Amb18559485 [0,0,0,1,0,0|3,0,0]=4 1946 B6R1.1 C1CCNNC1 Amb22263856 [0,0,0,1,0,0|3,0,0]=4 1947 B6R1.1 C1CCONC1 Amb22586922 [0,0,0,1,0,0|2,0,1]=4 1948 B6R1.1 C1CCONC1 Amb6365589 [0,0,0,1,0,0|2,0,1]=4 1949 B6R1.1 C1CCSCC1 Amb17666898 [0,0,0,1,0,0|1,0,1]=3 1950 B6R1.1 C1CCSSC1 Amb27845946 [0,0,0,1,0,0|2,0,1]=4 1951 B6R1.1 C1CC[NH2+]CC1 Amb19957935 [0,0,0,1,0,0|2,0,1]=4 1952 B6R1.1 C1CC[NH2+]CC1 Amb21856129 [0,0,0,1,0,0|2,0,1]=4 1953 B6R1.1 C1CNCCN1 Amb15691763 [0,0,0,1,0,0|3,0,0]=4 1954 B6R1.1 C1CNCCN1 Amb22168570 [0,0,0,1,0,0|3,0,0]=4 1955 B6R1.1 C1CNCCN1 Amb2793037 [0,0,0,1,0,0|3,0,0]=4 1956 B6R1.1 C1CNCCN1 Amb8390247 [0,0,0,1,0,0|3,0,0]=4 1957 B6R1.1 C1CNCNC1 Amb4297135 [0,0,0,1,0,0|2,0,1]=4 1958 B6R1.1 C1CNCOC1 Amb17506190 [0,0,0,1,0,0|1,0,2]=4 1959 B6R1.1 C1CNCOC1 Amb32652717 [0,0,0,1,0,0|1,0,2]=4 1960 B6R1.1 C1CNCSC1 Amb20622778 [0,0,0,1,0,0|1,0,1]=3 1961 B6R1.1 C1CNCSC1 Amb22356248 [0,0,0,1,0,0|1,0,1]=3 1962 B6R1.1 C1CNNCN1 Amb27473248 [0,0,0,1,0,0|3,0,0]=4 1963 B6R1.1 C1COCCN1 Amb2792841 [0,0,0,1,0,0|2,1,0]=4 1964 B6R1.1 C1COCCN1 Amb4020200 [0,0,0,1,0,0|2,1,0]=4 1965 B6R1.1 C1COCCO1 Amb6608797 [0,0,0,1,0,0|2,1,0]=4 1966 B6R1.1 C1COCNN1 Amb32679585 [0,0,0,1,0,0|2,1,0]=4 1967 B6R1.1 C1COCOC1 Amb8515936 [0,0,0,1,0,0|0,1,2]=4 1968 B6R1.1 C1CSCCN1 Amb2720305 [0,0,0,1,0,0|2,0,0]=3 1969 B6R1.1 C1CSCCN1 Amb932817 [0,0,0,1,0,0|2,0,0]=3 1970 B6R1.1 C1CSCCO1 Amb2690613 [0,0,0,1,0,0|2,0,0]=3 1971 B6R1.1 C1CSCSC1 Amb8393152 [0,0,0,1,0,0|0,1,1]=3 1972 B6R1.1 C1CSOCS1 Amb28315787 [0,0,0,1,0,0|1,0,1]=3 1973 B6R1.1 C1SCSCS1 Amb8513379 [0,0,0,1,0,0|1,1,1]=4 1974 B6R1.1 [CH+]1SCCCS1 Amb28241473 [0,0,0,1,0,0|0,1,2]=4 1975 B6R1.2 BrC1=CCCC1 Amb10067271 [0,0,0,1,0,0|2,0,1]=4 1976 B6R1.2 BrC1=COCC1 Amb24322594 [0,0,0,1,0,0|1,1,1]=4 1977 B6R1.2 BrC1CCCC1 Amb2686651 [0,0,0,1,0,0|2,0,1]=4 1978 B6R1.2 BrC1CCNC1 Amb10608920 [0,0,0,1,0,0|2,0,1]=4 1979 B6R1.2 BrC1CCNC1 Amb19958764 [0,0,0,1,0,0|2,0,1]=4 1980 B6R1.2 BrC1CCNC1 Amb22229239 [0,0,0,1,0,0|2,0,1]=4 1981 B6R1.2 BrC1CCOC1 Amb19957943 [0,0,0,1,0,0|1,1,1]=4 1982 B6R1.2 BrC1CCSC1 Amb20413646 [0,0,0,1,0,0|1,0,1]=3 1983 B6R1.2 Br[C@@H]1CCNC1 Amb22225312 [0,0,0,1,0,0|2,0,1]=4 1984 B6R1.2 Br[C@@H]1CCNC1 Amb22225313 [0,0,0,1,0,0|2,0,1]=4 1985 B6R1.2 Br[C@H]1CCNC1 Amb22226659 [0,0,0,1,0,0|2,0,1]=4 1986 B6R1.2 Br[C@H]1CCNC1 Amb22226660 [0,0,0,1,0,0|2,0,1]=4 1987 B6R1.2 C=C1CCCC1 Amb22337671 [0,0,0,1,0,0|2,0,0]=3 1988 B6R1.2 C=C1CCCS1 Amb28137153 [0,0,0,1,0,0|3,0,0]=4 1989 B6R1.2 C=C1CCNC1 Amb22490848 [0,0,0,1,0,0|2,0,0]=3 1990 B6R1.2 C=C1CCNC1 Amb27782898 [0,0,0,1,0,0|2,0,0]=3 1991 B6R1.2 C=C1CCSC1 Amb26477950 [0,0,0,1,0,0|1,0,0]=2 1992 B6R1.2 C=C1CNOC1 Amb31156059 [0,0,0,1,0,0|2,1,0]=4 1993 B6R1.2 C=C1CNOC1 Amb33309622 [0,0,0,1,0,0|2,1,0]=4 1994 B6R1.2 CC1=CC=CC1 Amb26338978 [0,0,0,1,0,0|2,0,1]=4 1995 B6R1.2 CC1=CCCC1 Amb8513250 [0,0,0,1,0,0|2,0,1]=4 1996 B6R1.2 CC1=CSCC1 Amb26495749 [0,0,0,1,0,0|1,0,1]=3 1997 B6R1.2 CC1=NCCC1 Amb8513341 [0,0,0,1,0,0|2,0,1]=4 1998 B6R1.2 CC1=NNCC1 Amb8492492 [0,0,0,1,0,0|3,0,0]=4 1999 B6R1.2 CC1C=CCC1 Amb17674168 [0,0,0,1,0,0|2,0,0]=3 2000 B6R1.2 CC1C=CCN1 Amb24120626 [0,0,0,1,0,0|3,0,0]=4 2001 B6R1.2 CC1C=CCS1 Amb27847945 [0,0,0,1,0,0|3,0,0]=4 2002 B6R1.2 CC1C=CNC1 Amb28040927 [0,0,0,1,0,0|3,0,0]=4 2003 B6R1.2 CC1CC=CC1 Amb27492739 [0,0,0,1,0,0|2,0,1]=4 2004 B6R1.2 CC1CCCC1 Amb8516028 [0,0,0,1,0,0|2,0,1]=4 2005 B6R1.2 CC1CCCN1 Amb8387002 [0,0,0,1,0,0|2,0,1]=4 2006 B6R1.2 CC1CCCN1 Amb9713910 [0,0,0,1,0,0|2,0,1]=4 2007 B6R1.2 CC1CCCO1 Amb8385612 [0,0,0,1,0,0|1,0,2]=4 2008 B6R1.2 CC1CCCS1 Amb2689709 [0,0,0,1,0,0|1,1,1]=4 2009 B6R1.2 CC1CCC[Cl+]1 Amb27233495 [0,0,0,1,0,0|2,0,1]=4 2010 B6R1.2 CC1CCNC1 Amb15690616 [0,0,0,1,0,0|2,0,1]=4 2011 B6R1.2 CC1CCNC1 Amb8630788 [0,0,0,1,0,0|2,0,1]=4 2012 B6R1.2 CC1CCNO1 Amb27209819 [0,0,0,1,0,0|2,0,1]=4 2013 B6R1.2 CC1CCOC1 Amb4418362 [0,0,0,1,0,0|1,1,1]=4 2014 B6R1.2 CC1CCON1 Amb27793876 [0,0,0,1,0,0|3,0,0]=4 2015 B6R1.2 CC1CCSC1 Amb20621725 [0,0,0,1,0,0|1,0,1]=3 2016 B6R1.2 CC1CSCN1 Amb24550471 [0,0,0,1,0,0|2,0,1]=4 2017 B6R1.2 CC1CSCN1 Amb33330531 [0,0,0,1,0,0|2,0,1]=4 2018 B6R1.2 CC1N=CCS1 Amb8392841 [0,0,0,1,0,0|3,0,0]=4 2019 B6R1.2 CN1C=NCC1 Amb10565894 [0,0,0,1,0,0|3,0,0]=4 2020 B6R1.2 CN1CC=CC1 Amb17938851 [0,0,0,1,0,0|2,0,1]=4 2021 B6R1.2 CN1CCCC1 Amb8513261 [0,0,0,1,0,0|2,0,1]=4 2022 B6R1.2 CN1CCCN1 Amb28058528 [0,0,0,1,0,0|2,0,1]=4 2023 B6R1.2 CN1CCCN1 Amb35826246 [0,0,0,1,0,0|2,0,1]=4 2024 B6R1.2 CN1CCNC1 Amb25663131 [0,0,0,1,0,0|3,0,0]=4 2025 B6R1.2 CN1CCOC1 Amb25146749 [0,0,0,1,0,0|2,1,0]=4 2026 B6R1.2 CN1CN=CN1 Amb27633594 [0,0,0,1,0,0|3,0,0]=4 2027 B6R1.2 C[C@@H]1CCCN1 Amb10071006 [0,0,0,1,0,0|2,0,1]=4 2028 B6R1.2 C[C@@H]1CCCN1 Amb8628964 [0,0,0,1,0,0|2,0,1]=4 2029 B6R1.2 C[C@@H]1CCNC1 Amb19888329 [0,0,0,1,0,0|2,0,1]=4 2030 B6R1.2 C[C@@H]1CCNC1 Amb27593574 [0,0,0,1,0,0|2,0,1]=4 2031 B6R1.2 C[C@H]1CCCN1 Amb10071007 [0,0,0,1,0,0|2,0,1]=4 2032 B6R1.2 C[C@H]1CCCN1 Amb8387004 [0,0,0,1,0,0|2,0,1]=4 2033 B6R1.2 C[C@H]1CCNC1 Amb19887708 [0,0,0,1,0,0|2,0,1]=4 2034 B6R1.2 ClC1C=CCC1 Amb17672585 [0,0,0,1,0,0|3,0,0]=4 2035 B6R1.2 ClC1CCCC1 Amb3940287 [0,0,0,1,0,0|2,0,1]=4 2036 B6R1.2 ClC1CCNC1 Amb18640558 [0,0,0,1,0,0|2,0,1]=4 2037 B6R1.2 ClC1CCNC1 Amb22229273 [0,0,0,1,0,0|2,0,1]=4 2038 B6R1.2 ClC1CCOC1 Amb20623054 [0,0,0,1,0,0|1,1,1]=4 2039 B6R1.2 Cl[C@H]1CCNC1 Amb22226671 [0,0,0,1,0,0|2,0,1]=4 2040 B6R1.2 FC1=CCNC1 Amb35751388 [0,0,0,1,0,0|2,0,1]=4 2041 B6R1.2 FC1=CCNC1 Amb35752602 [0,0,0,1,0,0|2,0,1]=4 2042 B6R1.2 FC1=COCC1 Amb24322813 [0,0,0,1,0,0|1,1,1]=4 2043 B6R1.2 FC1CCCC1 Amb10839457 [0,0,0,1,0,0|2,0,1]=4 2044 B6R1.2 FC1CCNC1 Amb19148522 [0,0,0,1,0,0|2,0,1]=4 2045 B6R1.2 FC1CCNC1 Amb8010918 [0,0,0,1,0,0|2,0,1]=4 2046 B6R1.2 F[C@@H]1CCNC1 Amb10603224 [0,0,0,1,0,0|2,0,1]=4 2047 B6R1.2 F[C@@H]1CCNC1 Amb2688413 [0,0,0,1,0,0|2,0,1]=4 2048 B6R1.2 F[C@H]1CCNC1 Amb10603273 [0,0,0,1,0,0|2,0,1]=4 2049 B6R1.2 F[C@H]1CCNC1 Amb2688414 [0,0,0,1,0,0|2,0,1]=4 2050 B6R1.2 IC1=CCCC1 Amb24332192 [0,0,0,1,0,0|2,0,1]=4 2051 B6R1.2 IC1=COCC1 Amb24322814 [0,0,0,1,0,0|1,1,1]=4 2052 B6R1.2 IC1CCCC1 Amb3941530 [0,0,0,1,0,0|2,0,1]=4 2053 B6R1.2 IC1CCNC1 Amb22229333 [0,0,0,1,0,0|2,0,1]=4 2054 B6R1.2 IC1CCOC1 Amb9677596 [0,0,0,1,0,0|1,1,1]=4 2055 B6R1.2 IC1CCSC1 Amb35704950 [0,0,0,1,0,0|1,0,1]=3 2056 B6R1.2 IN1CCCC1 Amb27765883 [0,0,0,1,0,0|3,0,0]=4 2057 B6R1.2 I[C@@H]1CCOC1 Amb25337461 [0,0,0,1,0,0|1,1,1]=4 2058 B6R1.2 I[C@H]1CCOC1 Amb22405918 [0,0,0,1,0,0|1,1,1]=4 2059 B6R1.2 N=C1CCC=N1 Amb28436317 [0,0,0,1,0,0|3,0,0]=4 2060 B6R1.2 N=C1CCCN1 Amb2371632 [0,0,0,1,0,0|3,0,0]=4 2061 B6R1.2 N=C1CCCN1 Amb501585 [0,0,0,1,0,0|3,0,0]=4 2062 B6R1.2 N=C1CCCS1 Amb10072429 [0,0,0,1,0,0|3,0,0]=4 2063 B6R1.2 N=C1CCCS1 Amb9825646 [0,0,0,1,0,0|3,0,0]=4 2064 B6R1.2 NC1=NCCC1 Amb10976565 [0,0,0,1,0,0|3,0,0]=4 2065 B6R1.2 NC1=NCCC1 Amb8342250 [0,0,0,1,0,0|3,0,0]=4 2066 B6R1.2 NC1=NNCC1 Amb22330617 [0,0,0,1,0,0|3,0,0]=4 2067 B6R1.2 NC1=NNCC1 Amb28555323 [0,0,0,1,0,0|3,0,0]=4 2068 B6R1.2 NC1=NOCC1 Amb27975619 [0,0,0,1,0,0|2,1,0]=4 2069 B6R1.2 NC1C=CCC1 Amb23385329 [0,0,0,1,0,0|3,0,0]=4 2070 B6R1.2 NC1C=CCC1 Amb26367288 [0,0,0,1,0,0|3,0,0]=4 2071 B6R1.2 NC1CCCC1 Amb2792832 [0,0,0,1,0,0|2,0,1]=4 2072 B6R1.2 NC1CCNC1 Amb2720262 [0,0,0,1,0,0|2,0,1]=4 2073 B6R1.2 NC1CCNC1 Amb2777850 [0,0,0,1,0,0|2,0,1]=4 2074 B6R1.2 NC1CCOC1 Amb33536523 [0,0,0,1,0,0|1,1,1]=4 2075 B6R1.2 NC1CCOC1 Amb3941188 [0,0,0,1,0,0|1,1,1]=4 2076 B6R1.2 NC1CCSC1 Amb19149005 [0,0,0,1,0,0|1,0,1]=3 2077 B6R1.2 NC1CCSC1 Amb9709380 [0,0,0,1,0,0|1,0,1]=3 2078 B6R1.2 NC1CSSC1 Amb8480297 [0,0,0,1,0,0|2,0,1]=4 2079 B6R1.2 NN1CCCC1 Amb2720328 [0,0,0,1,0,0|3,0,0]=4 2080 B6R1.2 NN1CCCC1 Amb32651939 [0,0,0,1,0,0|3,0,0]=4 2081 B6R1.2 NN1CCCC1 Amb836837 [0,0,0,1,0,0|3,0,0]=4 2082 B6R1.2 N[C@@H]1CCNC1 Amb2696338 [0,0,0,1,0,0|2,0,1]=4 2083 B6R1.2 N[C@@H]1CCNC1 Amb8396670 [0,0,0,1,0,0|2,0,1]=4 2084 B6R1.2 N[C@@H]1CCOC1 Amb19515768 [0,0,0,1,0,0|1,1,1]=4 2085 B6R1.2 N[C@@H]1CCOC1 Amb8628967 [0,0,0,1,0,0|1,1,1]=4 2086 B6R1.2 N[C@@H]1CCSC1 Amb28067533 [0,0,0,1,0,0|1,0,1]=3 2087 B6R1.2 N[C@H]1CCNC1 Amb2696339 [0,0,0,1,0,0|2,0,1]=4 2088 B6R1.2 N[C@H]1CCOC1 Amb10603285 [0,0,0,1,0,0|1,1,1]=4 2089 B6R1.2 N[C@H]1CCOC1 Amb8389308 [0,0,0,1,0,0|1,1,1]=4 2090 B6R1.2 N[C@H]1CCSC1 Amb24611361 [0,0,0,1,0,0|1,0,1]=3 2091 B6R1.2 O=C1C=CCC1 Amb4019519 [0,0,0,1,0,0|1,0,1]=3 2092 B6R1.2 O=C1C=CCN1 Amb20241082 [0,0,0,1,0,0|2,0,1]=4 2093 B6R1.2 O=C1C=CCO1 Amb2792769 [0,0,0,1,0,0|2,0,1]=4 2094 B6R1.2 O=C1C=CCS1 Amb22336458 [0,0,0,1,0,0|2,0,1]=4 2095 B6R1.2 O=C1C=COC1 Amb24107591 [0,0,0,1,0,0|0,1,2]=4 2096 B6R1.2 O=C1C=CSN1 Amb19895016 [0,0,0,1,0,0|1,0,2]=4 2097 B6R1.2 O=C1C=CSS1 Amb27421370 [0,0,0,1,0,0|1,0,2]=4 2098 B6R1.2 O=C1C=NCN1 Amb26572891 [0,0,0,1,0,0|2,0,1]=4 2099 B6R1.2 O=C1C=NCO1 Amb25786221 [0,0,0,1,0,0|2,0,1]=4 2100 B6R1.2 O=C1CC=CC1 Amb2686649 [0,0,0,1,0,0|1,0,1]=3 2101 B6R1.2 O=C1CC=CN1 Amb22235167 [0,0,0,1,0,0|2,0,1]=4 2102 B6R1.2 O=C1CC=NN1 Amb3428206 [0,0,0,1,0,0|2,0,1]=4 2103 B6R1.2 O=C1CC=NO1 Amb27654112 [0,0,0,1,0,0|2,0,1]=4 2104 B6R1.2 O=C1CCCC1 Amb2793024 [0,0,0,1,0,0|1,0,0]=2 2105 B6R1.2 O=C1CCCN1 Amb22169686 [0,0,0,1,0,0|2,0,0]=3 2106 B6R1.2 O=C1CCCN1 Amb6608645 [0,0,0,1,0,0|2,0,0]=3 2107 B6R1.2 O=C1CCCO1 Amb3940401 [0,0,0,1,0,0|2,0,0]=3 2108 B6R1.2 O=C1CCCS1 Amb22338102 [0,0,0,1,0,0|2,0,0]=3 2109 B6R1.2 O=C1CCNC1 Amb2700623 [0,0,0,1,0,0|1,0,0]=2 2110 B6R1.2 O=C1CCNC1 Amb8386645 [0,0,0,1,0,0|1,0,0]=2 2111 B6R1.2 O=C1CCNN1 Amb33551041 [0,0,0,1,0,0|2,0,0]=3 2112 B6R1.2 O=C1CCNN1 Amb3428540 [0,0,0,1,0,0|2,0,0]=3 2113 B6R1.2 O=C1CCOC1 Amb7990143 [0,0,0,1,0,0|0,1,0]=2 2114 B6R1.2 O=C1CCON1 Amb22235009 [0,0,0,1,0,0|1,1,0]=3 2115 B6R1.2 O=C1CCSC1 Amb2720904 [0,0,0,1,0,0|0,0,0]=1 2116 B6R1.2 O=C1CN=CS1 Amb27963219 [0,0,0,1,0,0|2,0,1]=4 2117 B6R1.2 O=C1CNCN1 Amb19957368 [0,0,0,1,0,0|2,0,0]=3 2118 B6R1.2 O=C1CNCS1 Amb27443758 [0,0,0,1,0,0|2,0,0]=3 2119 B6R1.2 O=C1COCN1 Amb28132686 [0,0,0,1,0,0|1,1,0]=3 2120 B6R1.2 O=C1CSCN1 Amb28187121 [0,0,0,1,0,0|1,0,0]=2 2121 B6R1.2 O=C1CSSC1 Amb28351444 [0,0,0,1,0,0|1,0,0]=2 2122 B6R1.2 O=C1NCCN1 Amb6357221 [0,0,0,1,0,0|3,0,0]=4 2123 B6R1.2 O=C1NCCN1 Amb6608941 [0,0,0,1,0,0|3,0,0]=4 2124 B6R1.2 O=C1NCCO1 Amb6608807 [0,0,0,1,0,0|3,0,0]=4 2125 B6R1.2 O=C1NCCS1 Amb431322 [0,0,0,1,0,0|3,0,0]=4 2126 B6R1.2 O=C1OCCO1 Amb4057710 [0,0,0,1,0,0|3,0,0]=4 2127 B6R1.2 O=C1OCCS1 Amb27398683 [0,0,0,1,0,0|3,0,0]=4 2128 B6R1.2 O=S1CCCC1 Amb2690579 [0,0,0,1,0,0|2,0,0]=3 2129 B6R1.2 O=S1CCNC1 Amb28075495 [0,0,0,1,0,0|2,0,0]=3 2130 B6R1.2 O=[PH]1CC=CC1 Amb35747085 [0,0,0,1,0,0|2,0,1]=4 2131 B6R1.2 O=[PH]1CCCC1 Amb33804724 [0,0,0,1,0,0|2,0,0]=3 2132 B6R1.2 OC1=NNCC1 Amb2111955 [0,0,0,1,0,0|2,0,1]=4 2133 B6R1.2 OC1=NNCC1 Amb844737 [0,0,0,1,0,0|2,0,1]=4 2134 B6R1.2 OC1C=CCC1 Amb33546881 [0,0,0,1,0,0|3,0,0]=4 2135 B6R1.2 OC1CCCC1 Amb3939016 [0,0,0,1,0,0|1,0,2]=4 2136 B6R1.2 OC1CCNC1 Amb22436788 [0,0,0,1,0,0|1,0,2]=4 2137 B6R1.2 OC1CCNC1 Amb2688790 [0,0,0,1,0,0|1,0,2]=4 2138 B6R1.2 OC1CCNC1 Amb2690449 [0,0,0,1,0,0|1,0,2]=4 2139 B6R1.2 OC1CCOC1 Amb2688794 [0,0,0,1,0,0|0,1,2]=4 2140 B6R1.2 OC1CCSC1 Amb9748224 [0,0,0,1,0,0|0,0,2]=3 2141 B6R1.2 ON1CCCC1 Amb30988006 [0,0,0,1,0,0|2,0,1]=4 2142 B6R1.2 ON1CCCC1 Amb4035438 [0,0,0,1,0,0|2,0,1]=4 2143 B6R1.2 O[C@@H]1CCNC1 Amb2688791 [0,0,0,1,0,0|1,0,2]=4 2144 B6R1.2 O[C@@H]1CCNC1 Amb3939360 [0,0,0,1,0,0|1,0,2]=4 2145 B6R1.2 O[C@@H]1CCOC1 Amb8628960 [0,0,0,1,0,0|0,1,2]=4 2146 B6R1.2 O[C@@H]1CCSC1 Amb27160810 [0,0,0,1,0,0|0,0,2]=3 2147 B6R1.2 O[C@H]1C=CCC1 Amb28133982 [0,0,0,1,0,0|3,0,0]=4 2148 B6R1.2 O[C@H]1CCNC1 Amb2688792 [0,0,0,1,0,0|1,0,2]=4 2149 B6R1.2 O[C@H]1CCNC1 Amb33716680 [0,0,0,1,0,0|1,0,2]=4 2150 B6R1.2 O[C@H]1CCNC1 Amb8384246 [0,0,0,1,0,0|1,0,2]=4 2151 B6R1.2 O[C@H]1CCOC1 Amb32409449 [0,0,0,1,0,0|0,1,2]=4 2152 B6R1.2 O[C@H]1CCOC1 Amb33718794 [0,0,0,1,0,0|0,1,2]=4 2153 B6R1.2 O[C@H]1CCOC1 Amb3940165 [0,0,0,1,0,0|0,1,2]=4 2154 B6R1.2 O[C@H]1CCSC1 Amb27211574 [0,0,0,1,0,0|0,0,2]=3 2155 B6R1.2 PN1CCCC1 Amb27430446 [0,0,0,1,0,0|3,0,0]=4 2156 B6R1.2 S=C1CCCC1 Amb28049287 [0,0,0,1,0,0|1,1,0]=3 2157 B6R1.2 S=C1CCCN1 Amb2778514 [0,0,0,1,0,0|2,1,0]=4 2158 B6R1.2 S=C1CCCO1 Amb27808589 [0,0,0,1,0,0|2,1,0]=4 2159 B6R1.2 SC1C=CCC1 Amb32788808 [0,0,0,1,0,0|3,0,0]=4 2160 B6R1.2 SC1CCCC1 Amb6608767 [0,0,0,1,0,0|1,1,1]=4 2161 B6R1.2 SC1CCNC1 Amb10608919 [0,0,0,1,0,0|1,1,1]=4 2162 B6R1.2 SC1CCOC1 Amb22298444 [0,0,0,1,0,0|0,2,1]=4 2163 B6R1.2 SC1CCSC1 Amb7784766 [0,0,0,1,0,0|0,1,1]=3 2164 B6R1.2 [NH3+]C1CC[NH2+]C1 Amb33513012 [0,0,0,1,0,0|2,0,1]=4 2165 B6R1.2 [NH3+][C@@H]1CC[NH2+]C1 Amb8397249 [0,0,0,1,0,0|2,0,1]=4 2166 B6R1.2 [NH3+][C@H]1CC[NH2+]C1 Amb8397248 [0,0,0,1,0,0|2,0,1]=4 2167 B6R1.2 [SiH3]C1CCCC1 Amb22229567 [0,0,0,1,0,0|2,0,1]=4 2168 B6R1.3 BrCCC1CC1 Amb19149009 [0,0,0,1,0,0|2,0,1]=4 2169 B6R1.3 BrCCC1CO1 Amb20620444 [0,0,0,1,0,0|1,1,1]=4 2170 B6R1.3 BrCC[C@@H]1CO1 Amb27593897 [0,0,0,1,0,0|1,1,1]=4 2171 B6R1.3 BrCC[C@H]1CO1 Amb22348282 [0,0,0,1,0,0|1,1,1]=4 2172 B6R1.3 Br\C=C\C1CC1 Amb33134968 [0,0,0,1,0,0|2,0,1]=4 2173 B6R1.3 C=CCC1CC1 Amb25146408 [0,0,0,1,0,0|2,0,0]=3 2174 B6R1.3 CCCC1CC1 Amb25348836 [0,0,0,1,0,0|2,0,1]=4 2175 B6R1.3 CCCC1CO1 Amb17771535 [0,0,0,1,0,0|1,0,2]=4 2176 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [0,0,0,1,0,0|1,0,2]=4 2177 B6R1.3 CCC[C@H]1CO1 Amb10982593 [0,0,0,1,0,0|1,0,2]=4 2178 B6R1.3 CNCC1CC1 Amb10609255 [0,0,0,1,0,0|2,0,1]=4 2179 B6R1.3 CNCC1CC1 Amb6707425 [0,0,0,1,0,0|2,0,1]=4 2180 B6R1.3 COCC1CO1 Amb9707779 [0,0,0,1,0,0|0,1,2]=4 2181 B6R1.3 COCC1CS1 Amb24735710 [0,0,0,1,0,0|2,0,0]=3 2182 B6R1.3 COC[C@@H]1CO1 Amb8383546 [0,0,0,1,0,0|0,1,2]=4 2183 B6R1.3 COC[C@H]1CO1 Amb8516312 [0,0,0,1,0,0|0,1,2]=4 2184 B6R1.3 CSCC1CO1 Amb22001026 [0,0,0,1,0,0|0,0,2]=3 2185 B6R1.3 CSC[C@@H]1CO1 Amb24361865 [0,0,0,1,0,0|0,0,2]=3 2186 B6R1.3 CSC[C@H]1CO1 Amb24748500 [0,0,0,1,0,0|0,0,2]=3 2187 B6R1.3 C\C=C\C1CO1 Amb25146414 [0,0,0,1,0,0|1,1,1]=4 2188 B6R1.3 ClCCC1CC1 Amb28049296 [0,0,0,1,0,0|2,0,1]=4 2189 B6R1.3 ClCCC1CO1 Amb27954469 [0,0,0,1,0,0|1,1,1]=4 2190 B6R1.3 ClCC[C@@H]1CO1 Amb27262013 [0,0,0,1,0,0|1,1,1]=4 2191 B6R1.3 ClCC[C@H]1CO1 Amb22353778 [0,0,0,1,0,0|1,1,1]=4 2192 B6R1.3 Cl\C=C/C1CO1 Amb28193756 [0,0,0,1,0,0|1,1,1]=4 2193 B6R1.3 Cl\C=C\C1CC1 Amb28144222 [0,0,0,1,0,0|2,0,1]=4 2194 B6R1.3 Cl\C=C\C1CO1 Amb27634918 [0,0,0,1,0,0|1,1,1]=4 2195 B6R1.3 FCCC1CO1 Amb33379300 [0,0,0,1,0,0|1,1,1]=4 2196 B6R1.3 FCC[C@@H]1CO1 Amb33195718 [0,0,0,1,0,0|1,1,1]=4 2197 B6R1.3 FCC[C@H]1CO1 Amb33195719 [0,0,0,1,0,0|1,1,1]=4 2198 B6R1.3 ICCC1CC1 Amb22757415 [0,0,0,1,0,0|2,0,1]=4 2199 B6R1.3 N#CCC1CC1 Amb2686658 [0,0,0,1,0,0|2,0,1]=4 2200 B6R1.3 NCCC1CC1 Amb19149013 [0,0,0,1,0,0|2,0,1]=4 2201 B6R1.3 NCCC1CC1 Amb8630213 [0,0,0,1,0,0|2,0,1]=4 2202 B6R1.3 NNCC1CC1 Amb34912762 [0,0,0,1,0,0|3,0,0]=4 2203 B6R1.3 NNCC1CC1 Amb6662861 [0,0,0,1,0,0|3,0,0]=4 2204 B6R1.3 NNCC1CC1 Amb6892242 [0,0,0,1,0,0|3,0,0]=4 2205 B6R1.3 NNCC1CC1 Amb9677464 [0,0,0,1,0,0|3,0,0]=4 2206 B6R1.3 NNCC1CO1 Amb17593036 [0,0,0,1,0,0|2,1,0]=4 2207 B6R1.3 NOCC1CC1 Amb6307174 [0,0,0,1,0,0|3,0,0]=4 2208 B6R1.3 NOCC1CC1 Amb8627879 [0,0,0,1,0,0|3,0,0]=4 2209 B6R1.3 O=C=NC1CC1 Amb5750713 [0,0,0,1,0,0|2,0,1]=4 2210 B6R1.3 O=CC=C1CC1 Amb27758792 [0,0,0,1,0,0|1,0,2]=4 2211 B6R1.3 O=CCC1CC1 Amb21856083 [0,0,0,1,0,0|1,0,0]=2 2212 B6R1.3 O=CNC1CC1 Amb8386872 [0,0,0,1,0,0|2,0,0]=3 2213 B6R1.3 OCCC1CC1 Amb3939589 [0,0,0,1,0,0|1,0,2]=4 2214 B6R1.3 OCCC1CO1 Amb24334074 [0,0,0,1,0,0|0,1,2]=4 2215 B6R1.3 OCC[C@@H]1CO1 Amb24120634 [0,0,0,1,0,0|0,1,2]=4 2216 B6R1.3 OCC[C@H]1CO1 Amb25052254 [0,0,0,1,0,0|0,1,2]=4 2217 B6R1.3 ONCC1CC1 Amb26488951 [0,0,0,1,0,0|2,0,1]=4 2218 B6R1.3 SCCC1CC1 Amb24642475 [0,0,0,1,0,0|1,1,1]=4 2219 B6R1.3 [C-]#[N+]CC1CC1 Amb3973221 [0,0,0,1,0,0|3,0,0]=4 2220 B6R1.3 [NH3+]OCC1CC1 Amb30876847 [0,0,0,1,0,0|3,0,0]=4 2221 B6R1.4 C=C1CCC1C Amb27424508 [0,0,0,1,0,0|2,0,0]=3 2222 B6R1.4 C=C1CCC1Cl Amb27637701 [0,0,0,1,0,0|3,0,0]=4 2223 B6R1.4 CC1CCC1=O Amb17593022 [0,0,0,1,0,0|1,0,0]=2 2224 B6R1.4 CC1CCC1Br Amb27657001 [0,0,0,1,0,0|2,0,1]=4 2225 B6R1.4 CC1CCC1N Amb26081246 [0,0,0,1,0,0|2,0,1]=4 2226 B6R1.4 CC1CCC1N Amb33550388 [0,0,0,1,0,0|2,0,1]=4 2227 B6R1.4 CC1CCC1O Amb33546533 [0,0,0,1,0,0|1,0,2]=4 2228 B6R1.4 CC1CCC1S Amb26562257 [0,0,0,1,0,0|1,1,1]=4 2229 B6R1.4 CC1CNC1=O Amb24444140 [0,0,0,1,0,0|2,0,0]=3 2230 B6R1.4 CC1COC1=O Amb25794274 [0,0,0,1,0,0|2,0,0]=3 2231 B6R1.4 CC1NNC1=O Amb35751853 [0,0,0,1,0,0|3,0,0]=4 2232 B6R1.4 CC1OCC1=O Amb23456088 [0,0,0,1,0,0|2,0,0]=3 2233 B6R1.4 C[C@@H]1CC[C@H]1N Amb27461478 [0,0,0,1,0,0|2,0,1]=4 2234 B6R1.4 C[C@@H]1CC[C@H]1N Amb31030976 [0,0,0,1,0,0|2,0,1]=4 2235 B6R1.4 C[C@@H]1CC[C@H]1O Amb28053300 [0,0,0,1,0,0|1,0,2]=4 2236 B6R1.4 C[C@H]1CC[C@H]1Br Amb28141451 [0,0,0,1,0,0|2,0,1]=4 2237 B6R1.4 C[C@H]1CNC1=O Amb27620602 [0,0,0,1,0,0|2,0,0]=3 2238 B6R1.4 N=C1CNC1=O Amb27255646 [0,0,0,1,0,0|3,0,0]=4 2239 B6R1.4 NC1CCC1=O Amb22896568 [0,0,0,1,0,0|2,0,0]=3 2240 B6R1.4 NC1CCC1=O Amb25887804 [0,0,0,1,0,0|2,0,0]=3 2241 B6R1.4 NC1CNC1=O Amb18832512 [0,0,0,1,0,0|3,0,0]=4 2242 B6R1.4 NC1CNC1=O Amb32671465 [0,0,0,1,0,0|3,0,0]=4 2243 B6R1.4 NN1CCC1=O Amb27860475 [0,0,0,1,0,0|2,0,0]=3 2244 B6R1.4 NN1CCC1=O Amb30625658 [0,0,0,1,0,0|2,0,0]=3 2245 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [0,0,0,1,0,0|3,0,0]=4 2246 B6R1.4 N[C@@H]1CNC1=O Amb30982058 [0,0,0,1,0,0|3,0,0]=4 2247 B6R1.4 N[C@@H]1COC1=O Amb22748014 [0,0,0,1,0,0|3,0,0]=4 2248 B6R1.4 N[C@H]1CNC1=O Amb25811302 [0,0,0,1,0,0|3,0,0]=4 2249 B6R1.4 N[C@H]1CNC1=O Amb31291144 [0,0,0,1,0,0|3,0,0]=4 2250 B6R1.4 N[C@H]1COC1=O Amb28315731 [0,0,0,1,0,0|3,0,0]=4 2251 B6R1.4 N[C@H]1CSC1=O Amb27391192 [0,0,0,1,0,0|3,0,0]=4 2252 B6R1.4 O=C1CCC1=O Amb4036402 [0,0,0,1,0,0|2,0,0]=3 2253 B6R1.4 O=C1CCC1Br Amb21964157 [0,0,0,1,0,0|2,0,0]=3 2254 B6R1.4 O=C1CCC1Cl Amb33544158 [0,0,0,1,0,0|2,0,0]=3 2255 B6R1.4 O=C1CCC1O Amb17593027 [0,0,0,1,0,0|2,0,0]=3 2256 B6R1.4 O=C1CNC1=O Amb27973276 [0,0,0,1,0,0|3,0,0]=4 2257 B6R1.4 O=C1NCC1O Amb24689689 [0,0,0,1,0,0|3,0,0]=4 2258 B6R1.6 BrC=C1COC1 Amb33483065 [0,0,0,1,0,0|1,1,1]=4 2259 B6R1.6 BrCC1C=CC1 Amb27188357 [0,0,0,1,0,0|3,0,0]=4 2260 B6R1.6 BrCC1CCC1 Amb3940157 [0,0,0,1,0,0|2,0,1]=4 2261 B6R1.6 BrCC1CNC1 Amb34143810 [0,0,0,1,0,0|2,0,1]=4 2262 B6R1.6 BrCC1COC1 Amb22436839 [0,0,0,1,0,0|1,1,1]=4 2263 B6R1.6 C#CC1CCC1 Amb25184959 [0,0,0,1,0,0|2,0,1]=4 2264 B6R1.6 C#CC1CNC1 Amb23598703 [0,0,0,1,0,0|2,0,1]=4 2265 B6R1.6 C#CC1CNC1 Amb33801015 [0,0,0,1,0,0|2,0,1]=4 2266 B6R1.6 C#CC1COC1 Amb26934973 [0,0,0,1,0,0|1,1,1]=4 2267 B6R1.6 C=CC1CCC1 Amb27254044 [0,0,0,1,0,0|2,0,0]=3 2268 B6R1.6 C=C[C@H]1CCN1 Amb27164530 [0,0,0,1,0,0|3,0,0]=4 2269 B6R1.6 CC=C1CCC1 Amb27960500 [0,0,0,1,0,0|2,0,1]=4 2270 B6R1.6 CCC1CCC1 Amb24394555 [0,0,0,1,0,0|2,0,1]=4 2271 B6R1.6 CCC1CCN1 Amb24117042 [0,0,0,1,0,0|2,0,1]=4 2272 B6R1.6 CCC1CCN1 Amb32661102 [0,0,0,1,0,0|2,0,1]=4 2273 B6R1.6 CCC1CNC1 Amb25836819 [0,0,0,1,0,0|2,0,1]=4 2274 B6R1.6 CCC1CNC1 Amb34151372 [0,0,0,1,0,0|2,0,1]=4 2275 B6R1.6 CNC1CCC1 Amb18946245 [0,0,0,1,0,0|2,0,1]=4 2276 B6R1.6 CNC1CCC1 Amb19303706 [0,0,0,1,0,0|2,0,1]=4 2277 B6R1.6 CNC1CCN1 Amb28989493 [0,0,0,1,0,0|2,0,1]=4 2278 B6R1.6 CNC1CNC1 Amb21960524 [0,0,0,1,0,0|3,0,0]=4 2279 B6R1.6 CNC1CNC1 Amb22406409 [0,0,0,1,0,0|3,0,0]=4 2280 B6R1.6 CNC1COC1 Amb22899228 [0,0,0,1,0,0|2,1,0]=4 2281 B6R1.6 CNC1COC1 Amb32651765 [0,0,0,1,0,0|2,1,0]=4 2282 B6R1.6 CNC1COC1 Amb8011492 [0,0,0,1,0,0|2,1,0]=4 2283 B6R1.6 CNC1CSC1 Amb26652187 [0,0,0,1,0,0|2,0,0]=3 2284 B6R1.6 CNC1CSC1 Amb33038459 [0,0,0,1,0,0|2,0,0]=3 2285 B6R1.6 COC1CNC1 Amb10602328 [0,0,0,1,0,0|2,1,0]=4 2286 B6R1.6 COC1CNC1 Amb8010837 [0,0,0,1,0,0|2,1,0]=4 2287 B6R1.6 COC1CSC1 Amb4016253 [0,0,0,1,0,0|2,0,0]=3 2288 B6R1.6 CSC1CCC1 Amb27875235 [0,0,0,1,0,0|1,0,1]=3 2289 B6R1.6 CSC1CNC1 Amb18948252 [0,0,0,1,0,0|2,0,0]=3 2290 B6R1.6 CSC1CNC1 Amb21960723 [0,0,0,1,0,0|2,0,0]=3 2291 B6R1.6 CSC1COC1 Amb25025702 [0,0,0,1,0,0|2,0,0]=3 2292 B6R1.6 ClCC1CCC1 Amb8860570 [0,0,0,1,0,0|2,0,1]=4 2293 B6R1.6 ClCC1CNC1 Amb34151731 [0,0,0,1,0,0|2,0,1]=4 2294 B6R1.6 ClCC1COC1 Amb22235850 [0,0,0,1,0,0|1,1,1]=4 2295 B6R1.6 FCC1CNC1 Amb27165298 [0,0,0,1,0,0|2,0,1]=4 2296 B6R1.6 FCC1CNC1 Amb28990679 [0,0,0,1,0,0|2,0,1]=4 2297 B6R1.6 ICC1CCC1 Amb27831605 [0,0,0,1,0,0|2,0,1]=4 2298 B6R1.6 ICC1COC1 Amb22234623 [0,0,0,1,0,0|1,1,1]=4 2299 B6R1.6 N#CC1CCC1 Amb16232994 [0,0,0,1,0,0|2,0,1]=4 2300 B6R1.6 N#CC1CNC1 Amb21857026 [0,0,0,1,0,0|2,0,1]=4 2301 B6R1.6 N#CC1CNC1 Amb8631392 [0,0,0,1,0,0|2,0,1]=4 2302 B6R1.6 N#CC1COC1 Amb25859879 [0,0,0,1,0,0|1,1,1]=4 2303 B6R1.6 N#CC1CSC1 Amb26331972 [0,0,0,1,0,0|1,0,1]=3 2304 B6R1.6 NCC1C=CC1 Amb32658178 [0,0,0,1,0,0|3,0,0]=4 2305 B6R1.6 NCC1CCC1 Amb6255393 [0,0,0,1,0,0|2,0,1]=4 2306 B6R1.6 NCC1CCC1 Amb7969499 [0,0,0,1,0,0|2,0,1]=4 2307 B6R1.6 NCC1CNC1 Amb19958330 [0,0,0,1,0,0|2,0,1]=4 2308 B6R1.6 NCC1CNC1 Amb22001661 [0,0,0,1,0,0|2,0,1]=4 2309 B6R1.6 NCC1COC1 Amb19957367 [0,0,0,1,0,0|1,1,1]=4 2310 B6R1.6 NCC1COC1 Amb22270011 [0,0,0,1,0,0|1,1,1]=4 2311 B6R1.6 NCC1CSC1 Amb22737306 [0,0,0,1,0,0|1,0,1]=3 2312 B6R1.6 NCC1CSC1 Amb23439787 [0,0,0,1,0,0|1,0,1]=3 2313 B6R1.6 NNC1CCC1 Amb21936692 [0,0,0,1,0,0|3,0,0]=4 2314 B6R1.6 NNC1CCC1 Amb33533268 [0,0,0,1,0,0|3,0,0]=4 2315 B6R1.6 NNC1CCC1 Amb6892241 [0,0,0,1,0,0|3,0,0]=4 2316 B6R1.6 NNC1CNC1 Amb24412921 [0,0,0,1,0,0|3,0,0]=4 2317 B6R1.6 NNC1CNC1 Amb28984078 [0,0,0,1,0,0|3,0,0]=4 2318 B6R1.6 NNC1COC1 Amb22737473 [0,0,0,1,0,0|2,1,0]=4 2319 B6R1.6 NNC1COC1 Amb23412240 [0,0,0,1,0,0|2,1,0]=4 2320 B6R1.6 NNC1COC1 Amb33456237 [0,0,0,1,0,0|2,1,0]=4 2321 B6R1.6 NNC1CSC1 Amb25887550 [0,0,0,1,0,0|2,0,0]=3 2322 B6R1.6 NNC1CSC1 Amb28984079 [0,0,0,1,0,0|2,0,0]=3 2323 B6R1.6 NOC1CCC1 Amb10975959 [0,0,0,1,0,0|3,0,0]=4 2324 B6R1.6 NOC1CCC1 Amb25118834 [0,0,0,1,0,0|3,0,0]=4 2325 B6R1.6 NOC1COC1 Amb33541921 [0,0,0,1,0,0|2,1,0]=4 2326 B6R1.6 O=CC1CCC1 Amb8009552 [0,0,0,1,0,0|1,0,0]=2 2327 B6R1.6 O=CC1CCN1 Amb25757222 [0,0,0,1,0,0|2,0,0]=3 2328 B6R1.6 O=CC1CCS1 Amb27644631 [0,0,0,1,0,0|2,0,0]=3 2329 B6R1.6 O=CC1CNC1 Amb25919428 [0,0,0,1,0,0|1,0,0]=2 2330 B6R1.6 O=CC1COC1 Amb21857829 [0,0,0,1,0,0|0,1,0]=2 2331 B6R1.6 O=NN1CCC1 Amb24407378 [0,0,0,1,0,0|3,0,0]=4 2332 B6R1.6 OCC1C=CC1 Amb26987497 [0,0,0,1,0,0|3,0,0]=4 2333 B6R1.6 OCC1CCC1 Amb2686620 [0,0,0,1,0,0|1,0,2]=4 2334 B6R1.6 OCC1CNC1 Amb17943116 [0,0,0,1,0,0|1,0,2]=4 2335 B6R1.6 OCC1CNC1 Amb33530567 [0,0,0,1,0,0|1,0,2]=4 2336 B6R1.6 OCC1COC1 Amb33546888 [0,0,0,1,0,0|0,1,2]=4 2337 B6R1.6 OCC1CSC1 Amb23438800 [0,0,0,1,0,0|0,0,2]=3 2338 B6R1.6 ON=C1CSC1 Amb27789710 [0,0,0,1,0,0|1,0,2]=4 2339 B6R1.6 ONC1COC1 Amb28201079 [0,0,0,1,0,0|1,1,1]=4 2340 B6R1.6 SCC1CCC1 Amb26511279 [0,0,0,1,0,0|1,1,1]=4 2341 B6R1.6 SCC1CNC1 Amb32788183 [0,0,0,1,0,0|1,1,1]=4 2342 B6R1.6 [C-]#[N+]C1CCC1 Amb19892422 [0,0,0,1,0,0|3,0,0]=4 2343 B6R1.8 C#CC1CC1C Amb33169025 [0,0,0,1,0,0|2,0,1]=4 2344 B6R1.8 C=C1CC1CBr Amb28396549 [0,0,0,1,0,0|3,0,0]=4 2345 B6R1.8 C=C1CC1CCl Amb27949911 [0,0,0,1,0,0|3,0,0]=4 2346 B6R1.8 C=C1CC1CN Amb27837703 [0,0,0,1,0,0|3,0,0]=4 2347 B6R1.8 C=C1CC1CN Amb33734441 [0,0,0,1,0,0|3,0,0]=4 2348 B6R1.8 C=C1CC1CO Amb22224918 [0,0,0,1,0,0|3,0,0]=4 2349 B6R1.8 C=C1C[C@@H]1C=O Amb27802488 [0,0,0,1,0,0|1,0,1]=3 2350 B6R1.8 C=C1C[C@@H]1CO Amb25359146 [0,0,0,1,0,0|3,0,0]=4 2351 B6R1.8 C=C1C[C@H]1C=O Amb27185751 [0,0,0,1,0,0|1,0,1]=3 2352 B6R1.8 C=CC1CC1Br Amb27659343 [0,0,0,1,0,0|3,0,0]=4 2353 B6R1.8 C=CC1CC1C Amb33361017 [0,0,0,1,0,0|2,0,0]=3 2354 B6R1.8 C=CC1CC1Cl Amb28458317 [0,0,0,1,0,0|3,0,0]=4 2355 B6R1.8 C=C[C@@H]1C[C@@H]1Br Amb27462985 [0,0,0,1,0,0|3,0,0]=4 2356 B6R1.8 C=C[C@@H]1C[C@H]1Br Amb25026097 [0,0,0,1,0,0|3,0,0]=4 2357 B6R1.8 C=C[C@H]1C[C@@H]1Br Amb28076750 [0,0,0,1,0,0|3,0,0]=4 2358 B6R1.8 CC1CC1C#N Amb19148757 [0,0,0,1,0,0|2,0,1]=4 2359 B6R1.8 CC1CC1C=O Amb20622289 [0,0,0,1,0,0|1,0,0]=2 2360 B6R1.8 CC1CC1CBr Amb25738234 [0,0,0,1,0,0|2,0,1]=4 2361 B6R1.8 CC1CC1CCl Amb9004341 [0,0,0,1,0,0|2,0,1]=4 2362 B6R1.8 CC1CC1CN Amb9154867 [0,0,0,1,0,0|2,0,1]=4 2363 B6R1.8 CC1CC1CN Amb9717615 [0,0,0,1,0,0|2,0,1]=4 2364 B6R1.8 CC1CC1CO Amb3939121 [0,0,0,1,0,0|1,0,2]=4 2365 B6R1.8 CC1CC1CS Amb32788306 [0,0,0,1,0,0|1,1,1]=4 2366 B6R1.8 CC1CC1NN Amb33144866 [0,0,0,1,0,0|3,0,0]=4 2367 B6R1.8 CC1C\C1=C/Br Amb27454799 [0,0,0,1,0,0|2,0,1]=4 2368 B6R1.8 CCC1=C(Br)C1 Amb26432179 [0,0,0,1,0,0|2,0,1]=4 2369 B6R1.8 CCC1=CC1=O Amb28284229 [0,0,0,1,0,0|1,0,2]=4 2370 B6R1.8 CCC1CC1N Amb18947398 [0,0,0,1,0,0|2,0,1]=4 2371 B6R1.8 CCC1CC1N Amb32737486 [0,0,0,1,0,0|2,0,1]=4 2372 B6R1.8 CC[C@@H]1C[C@@H]1N Amb34915317 [0,0,0,1,0,0|2,0,1]=4 2373 B6R1.8 CC[C@@H]1C[C@H]1Cl Amb28052081 [0,0,0,1,0,0|2,0,1]=4 2374 B6R1.8 CC[C@@H]1C[C@H]1F Amb27783562 [0,0,0,1,0,0|2,0,1]=4 2375 B6R1.8 CC[C@@H]1C[C@H]1N Amb28057542 [0,0,0,1,0,0|2,0,1]=4 2376 B6R1.8 CC[C@@H]1C[C@H]1N Amb33473663 [0,0,0,1,0,0|2,0,1]=4 2377 B6R1.8 CC[C@H]1C[C@H]1C Amb25026122 [0,0,0,1,0,0|2,0,1]=4 2378 B6R1.8 CNC1CC1C Amb18947423 [0,0,0,1,0,0|2,0,1]=4 2379 B6R1.8 COC1CC1Br Amb27455448 [0,0,0,1,0,0|1,1,1]=4 2380 B6R1.8 COC1CC1N Amb22058084 [0,0,0,1,0,0|1,1,1]=4 2381 B6R1.8 COC1CC1N Amb30982571 [0,0,0,1,0,0|1,1,1]=4 2382 B6R1.8 CO[C@@H]1C[C@@H]1Br Amb27983809 [0,0,0,1,0,0|1,1,1]=4 2383 B6R1.8 CO[C@@H]1C[C@H]1N Amb24112918 [0,0,0,1,0,0|1,1,1]=4 2384 B6R1.8 C[C@@H]1C[C@@H]1CCl Amb27206587 [0,0,0,1,0,0|2,0,1]=4 2385 B6R1.8 C[C@@H]1C[C@@H]1CO Amb24519750 [0,0,0,1,0,0|1,0,2]=4 2386 B6R1.8 C[C@@H]1C[C@H]1CCl Amb28057518 [0,0,0,1,0,0|2,0,1]=4 2387 B6R1.8 C[C@@H]1C[C@H]1CN Amb22886350 [0,0,0,1,0,0|2,0,1]=4 2388 B6R1.8 C[C@@H]1C[C@H]1CN Amb24610044 [0,0,0,1,0,0|2,0,1]=4 2389 B6R1.8 C[C@@H]1C[C@H]1CO Amb22886842 [0,0,0,1,0,0|1,0,2]=4 2390 B6R1.8 C[C@H]1C[C@@H]1CCl Amb27422188 [0,0,0,1,0,0|2,0,1]=4 2391 B6R1.8 C[C@H]1C[C@@H]1CO Amb28435687 [0,0,0,1,0,0|1,0,2]=4 2392 B6R1.8 C[C@H]1C[C@H]1CCl Amb25259835 [0,0,0,1,0,0|2,0,1]=4 2393 B6R1.8 C[C@H]1C[C@H]1CO Amb28053440 [0,0,0,1,0,0|1,0,2]=4 2394 B6R1.8 O=CC1CC1Br Amb32667237 [0,0,0,1,0,0|2,0,0]=3 2395 B6R1.8 O=CC1CC1Cl Amb26848532 [0,0,0,1,0,0|2,0,0]=3 2396 B6R1.8 O=CC1CC1F Amb27960633 [0,0,0,1,0,0|2,0,0]=3 2397 B6R1.8 O=C[C@H]1C[C@H]1Cl Amb27198996 [0,0,0,1,0,0|2,0,0]=3 2398 B6R1.8 [C-]#[N+]C1CC1C Amb28071517 [0,0,0,1,0,0|3,0,0]=4 2399 B3R0.1 BrCCBr Amb2793008 [2,0,0,0,0,0|2,0,0]=4 2400 B3R0.1 C#CC=O Amb8393953 [2,0,0,0,0,0|0,0,2]=4 2401 B3R0.1 C#CCC Amb17940370 [2,0,0,0,0,0|0,0,2]=4 2402 B3R0.1 C#CCS Amb17673322 [2,0,0,0,0,0|0,0,2]=4 2403 B3R0.1 C#CSC Amb17940372 [2,0,0,0,0,0|0,0,2]=4 2404 B3R0.1 C#NCC Amb31132335 [2,0,0,0,0,0|1,0,1]=4 2405 B3R0.1 C=C=CC Amb17673300 [2,0,0,0,0,0|0,0,2]=4 2406 B3R0.1 C=CC=O Amb6608861 [2,0,0,0,0,0|0,0,2]=4 2407 B3R0.1 C=CCBr Amb6608667 [2,0,0,0,0,0|1,0,1]=4 2408 B3R0.1 C=CCC Amb2447488 [2,0,0,0,0,0|0,0,1]=3 2409 B3R0.1 C=CCCl Amb6608699 [2,0,0,0,0,0|1,0,1]=4 2410 B3R0.1 C=CCF Amb10839889 [2,0,0,0,0,0|1,0,1]=4 2411 B3R0.1 C=CCN Amb3938971 [2,0,0,0,0,0|1,0,1]=4 2412 B3R0.1 C=CCO Amb6608673 [2,0,0,0,0,0|0,1,1]=4 2413 B3R0.1 C=CCS Amb6608856 [2,0,0,0,0,0|0,0,1]=3 2414 B3R0.1 C=CC[CH2-] Amb24113375 [2,0,0,0,0,0|0,0,2]=4 2415 B3R0.1 C=COC Amb4035050 [2,0,0,0,0,0|0,1,1]=4 2416 B3R0.1 C=CSC Amb25989813 [2,0,0,0,0,0|0,0,1]=3 2417 B3R0.1 CC#CC Amb8517315 [2,0,0,0,0,0|1,0,1]=4 2418 B3R0.1 CCC#N Amb6662838 [2,0,0,0,0,0|1,0,1]=4 2419 B3R0.1 CCC=O Amb3939901 [2,0,0,0,0,0|0,0,0]=2 2420 B3R0.1 CCCBr Amb2793092 [2,0,0,0,0,0|1,0,0]=3 2421 B3R0.1 CCCC Amb10071919 [2,0,0,0,0,0|0,0,1]=3 2422 B3R0.1 CCCCl Amb2793095 [2,0,0,0,0,0|1,0,0]=3 2423 B3R0.1 CCCF Amb10838428 [2,0,0,0,0,0|1,0,0]=3 2424 B3R0.1 CCCI Amb4606010 [2,0,0,0,0,0|1,0,0]=3 2425 B3R0.1 CCCN Amb3939831 [2,0,0,0,0,0|1,0,0]=3 2426 B3R0.1 CCCN Amb8514610 [2,0,0,0,0,0|1,0,0]=3 2427 B3R0.1 CCCO Amb2793067 [2,0,0,0,0,0|0,0,1]=3 2428 B3R0.1 CCCS Amb6609035 [2,0,0,0,0,0|0,0,1]=3 2429 B3R0.1 CCNC Amb1139153 [2,0,0,0,0,0|1,0,0]=3 2430 B3R0.1 CCNC Amb8516701 [2,0,0,0,0,0|1,0,0]=3 2431 B3R0.1 CCNN Amb20623037 [2,0,0,0,0,0|2,0,0]=4 2432 B3R0.1 CCNN Amb33334623 [2,0,0,0,0,0|2,0,0]=4 2433 B3R0.1 CCNN Amb6662803 [2,0,0,0,0,0|2,0,0]=4 2434 B3R0.1 CCNO Amb10552371 [2,0,0,0,0,0|1,0,1]=4 2435 B3R0.1 CCNO Amb24680299 [2,0,0,0,0,0|1,0,1]=4 2436 B3R0.1 CCON Amb17101065 [2,0,0,0,0,0|1,1,0]=4 2437 B3R0.1 CCON Amb6608991 [2,0,0,0,0,0|1,1,0]=4 2438 B3R0.1 CCSC Amb8393185 [2,0,0,0,0,0|0,0,0]=2 2439 B3R0.1 CCS[Na] Amb22348423 [2,0,0,0,0,0|1,0,0]=3 2440 B3R0.1 CC[NH2+]O Amb16231501 [2,0,0,0,0,0|1,0,1]=4 2441 B3R0.1 CN=C=O Amb9901018 [2,0,0,0,0,0|1,0,1]=4 2442 B3R0.1 CNC=N Amb28129065 [2,0,0,0,0,0|2,0,0]=4 2443 B3R0.1 CNC=O Amb6608671 [2,0,0,0,0,0|1,0,0]=3 2444 B3R0.1 CNC=S Amb24459834 [2,0,0,0,0,0|1,1,0]=4 2445 B3R0.1 CNNC Amb17743962 [2,0,0,0,0,0|2,0,0]=4 2446 B3R0.1 CNNC Amb17938638 [2,0,0,0,0,0|2,0,0]=4 2447 B3R0.1 CNNC Amb8513146 [2,0,0,0,0,0|2,0,0]=4 2448 B3R0.1 CNOC Amb19920017 [2,0,0,0,0,0|1,1,0]=4 2449 B3R0.1 CNOC Amb22489450 [2,0,0,0,0,0|1,1,0]=4 2450 B3R0.1 CNOC Amb2691615 [2,0,0,0,0,0|1,1,0]=4 2451 B3R0.1 COC=O Amb8513252 [2,0,0,0,0,0|0,1,0]=3 2452 B3R0.1 COCBr Amb2685330 [2,0,0,0,0,0|1,1,0]=4 2453 B3R0.1 COCCl Amb6608944 [2,0,0,0,0,0|1,1,0]=4 2454 B3R0.1 COCI Amb22230762 [2,0,0,0,0,0|1,1,0]=4 2455 B3R0.1 COCO Amb25969488 [2,0,0,0,0,0|0,1,1]=4 2456 B3R0.1 CSCCl Amb10070575 [2,0,0,0,0,0|1,0,0]=3 2457 B3R0.1 CSCS Amb27167568 [2,0,0,0,0,0|0,1,0]=3 2458 B3R0.1 CSSC Amb6892989 [2,0,0,0,0,0|1,0,0]=3 2459 B3R0.1 C[CH-]CC Amb6609020 [2,0,0,0,0,0|1,0,0]=3 2460 B3R0.1 C[SiH2][SiH2]C Amb27785316 [2,0,0,0,0,0|1,1,0]=4 2461 B3R0.1 C\C=C\Br Amb22347938 [2,0,0,0,0,0|1,0,1]=4 2462 B3R0.1 C\C=C\C Amb10070820 [2,0,0,0,0,0|1,0,1]=4 2463 B3R0.1 C\C=C\F Amb24055876 [2,0,0,0,0,0|1,0,1]=4 2464 B3R0.1 C\C=C\I Amb27632950 [2,0,0,0,0,0|1,0,1]=4 2465 B3R0.1 C\C=C\N Amb28411483 [2,0,0,0,0,0|1,0,1]=4 2466 B3R0.1 ClCCBr Amb6741461 [2,0,0,0,0,0|2,0,0]=4 2467 B3R0.1 ClCCCl Amb2793007 [2,0,0,0,0,0|2,0,0]=4 2468 B3R0.1 ClCCI Amb2686135 [2,0,0,0,0,0|2,0,0]=4 2469 B3R0.1 ClCSCl Amb27803750 [2,0,0,0,0,0|2,0,0]=4 2470 B3R0.1 FCCBr Amb8384269 [2,0,0,0,0,0|2,0,0]=4 2471 B3R0.1 FCCCl Amb10838968 [2,0,0,0,0,0|2,0,0]=4 2472 B3R0.1 FCCF Amb10841170 [2,0,0,0,0,0|2,0,0]=4 2473 B3R0.1 FCCI Amb10838283 [2,0,0,0,0,0|2,0,0]=4 2474 B3R0.1 FCCS Amb25918910 [2,0,0,0,0,0|1,0,0]=3 2475 B3R0.1 ICCI Amb8513131 [2,0,0,0,0,0|2,0,0]=4 2476 B3R0.1 N=CCCl Amb27423919 [2,0,0,0,0,0|2,0,0]=4 2477 B3R0.1 NCCBr Amb22489445 [2,0,0,0,0,0|2,0,0]=4 2478 B3R0.1 NCCBr Amb2722574 [2,0,0,0,0,0|2,0,0]=4 2479 B3R0.1 NCCBr Amb932814 [2,0,0,0,0,0|2,0,0]=4 2480 B3R0.1 NCCCl Amb2718723 [2,0,0,0,0,0|2,0,0]=4 2481 B3R0.1 NCCCl Amb5722487 [2,0,0,0,0,0|2,0,0]=4 2482 B3R0.1 NCCF Amb22489536 [2,0,0,0,0,0|2,0,0]=4 2483 B3R0.1 NCCF Amb2720354 [2,0,0,0,0,0|2,0,0]=4 2484 B3R0.1 NCCF Amb3941512 [2,0,0,0,0,0|2,0,0]=4 2485 B3R0.1 NCCI Amb25834629 [2,0,0,0,0,0|2,0,0]=4 2486 B3R0.1 NCCI Amb33249627 [2,0,0,0,0,0|2,0,0]=4 2487 B3R0.1 NCCN Amb21953131 [2,0,0,0,0,0|2,0,0]=4 2488 B3R0.1 NCCN Amb22347942 [2,0,0,0,0,0|2,0,0]=4 2489 B3R0.1 NCCN Amb22350553 [2,0,0,0,0,0|2,0,0]=4 2490 B3R0.1 NCCN Amb33512889 [2,0,0,0,0,0|2,0,0]=4 2491 B3R0.1 NCCN Amb6608676 [2,0,0,0,0,0|2,0,0]=4 2492 B3R0.1 NCCN Amb8513811 [2,0,0,0,0,0|2,0,0]=4 2493 B3R0.1 NCCN Amb8513858 [2,0,0,0,0,0|2,0,0]=4 2494 B3R0.1 NCCO Amb3939349 [2,0,0,0,0,0|1,0,1]=4 2495 B3R0.1 NCCO Amb8514549 [2,0,0,0,0,0|1,0,1]=4 2496 B3R0.1 NCCS Amb1948463 [2,0,0,0,0,0|1,0,0]=3 2497 B3R0.1 NCCS Amb2689069 [2,0,0,0,0,0|1,0,0]=3 2498 B3R0.1 NNC=O Amb7757844 [2,0,0,0,0,0|2,0,0]=4 2499 B3R0.1 O=CC=O Amb6608650 [2,0,0,0,0,0|0,1,1]=4 2500 B3R0.1 O=CCBr Amb17593254 [2,0,0,0,0,0|1,0,0]=3 2501 B3R0.1 O=CCCl Amb3940428 [2,0,0,0,0,0|1,0,0]=3 2502 B3R0.1 O=CCO Amb22230739 [2,0,0,0,0,0|0,1,0]=3 2503 B3R0.1 O=CO[Na] Amb20246768 [2,0,0,0,0,0|1,1,0]=4 2504 B3R0.1 O=NCCl Amb28239632 [2,0,0,0,0,0|2,0,0]=4 2505 B3R0.1 O=[IH2]CCl Amb28458420 [2,0,0,0,0,0|2,0,0]=4 2506 B3R0.1 OCCBr Amb932813 [2,0,0,0,0,0|1,0,1]=4 2507 B3R0.1 OCCCl Amb2793046 [2,0,0,0,0,0|1,0,1]=4 2508 B3R0.1 OCCF Amb534294 [2,0,0,0,0,0|1,0,1]=4 2509 B3R0.1 OCCI Amb2404891 [2,0,0,0,0,0|1,0,1]=4 2510 B3R0.1 OCCO Amb5395440 [2,0,0,0,0,0|0,1,1]=4 2511 B3R0.1 OCCP Amb22224697 [2,0,0,0,0,0|1,0,1]=4 2512 B3R0.1 OCCS Amb4135356 [2,0,0,0,0,0|0,0,1]=3 2513 B3R0.1 PCCP Amb22054160 [2,0,0,0,0,0|2,0,0]=4 2514 B3R0.1 SCCCl Amb24349613 [2,0,0,0,0,0|1,0,0]=3 2515 B3R0.1 SCCS Amb6608729 [2,0,0,0,0,0|0,1,0]=3 2516 B3R0.1 S\C=C\Cl Amb27798310 [2,0,0,0,0,0|1,0,1]=4 2517 B3R0.1 [C-]#[N+]CC Amb2235947 [2,0,0,0,0,0|1,0,1]=4 2518 B3R0.1 [NH3+]CCCl Amb22436761 [2,0,0,0,0,0|2,0,0]=4 2519 B3R0.1 [SiH3]CCCl Amb25809980 [2,0,0,0,0,0|1,1,0]=4 2520 B5R0.1 BC(=O)NCC Amb27430059 [1,1,0,0,0,0|1,0,0]=3 2521 B5R0.1 C#CCC(=O)O Amb33532662 [1,1,0,0,0,0|0,0,2]=4 2522 B5R0.1 C#CCC(C)C Amb3941531 [1,1,0,0,0,0|1,0,1]=4 2523 B5R0.1 C#CCC(C)N Amb18946962 [1,1,0,0,0,0|1,0,1]=4 2524 B5R0.1 C#CCC(C)N Amb35753058 [1,1,0,0,0,0|1,0,1]=4 2525 B5R0.1 C#CCC(C)O Amb8517580 [1,1,0,0,0,0|1,0,1]=4 2526 B5R0.1 C#CC[C@@H](C)O Amb28461325 [1,1,0,0,0,0|1,0,1]=4 2527 B5R0.1 C#CC[C@H](C)O Amb8390123 [1,1,0,0,0,0|1,0,1]=4 2528 B5R0.1 C#NCC(C)C Amb31132436 [1,1,0,0,0,0|2,0,0]=4 2529 B5R0.1 C=C(Br)CCBr Amb25827098 [1,1,0,0,0,0|2,0,0]=4 2530 B5R0.1 C=C(Br)CCCl Amb8391241 [1,1,0,0,0,0|2,0,0]=4 2531 B5R0.1 C=C(Br)CCO Amb4014497 [1,1,0,0,0,0|1,1,0]=4 2532 B5R0.1 C=C(Br)CNC Amb18950247 [1,1,0,0,0,0|1,0,1]=4 2533 B5R0.1 C=C(Br)COC Amb25361496 [1,1,0,0,0,0|0,1,1]=4 2534 B5R0.1 C=C(Br)CSC Amb28313326 [1,1,0,0,0,0|0,0,1]=3 2535 B5R0.1 C=C(C)CC=O Amb28202583 [1,1,0,0,0,0|0,0,1]=3 2536 B5R0.1 C=C(C)CCBr Amb21857866 [1,1,0,0,0,0|2,0,0]=4 2537 B5R0.1 C=C(C)CCC Amb8513259 [1,1,0,0,0,0|1,0,0]=3 2538 B5R0.1 C=C(C)CCCl Amb27810807 [1,1,0,0,0,0|2,0,0]=4 2539 B5R0.1 C=C(C)CCI Amb26649317 [1,1,0,0,0,0|2,0,0]=4 2540 B5R0.1 C=C(C)CCN Amb17673481 [1,1,0,0,0,0|2,0,0]=4 2541 B5R0.1 C=C(C)CCN Amb33543001 [1,1,0,0,0,0|2,0,0]=4 2542 B5R0.1 C=C(C)CCO Amb34916534 [1,1,0,0,0,0|1,0,1]=4 2543 B5R0.1 C=C(C)CCO Amb8513522 [1,1,0,0,0,0|1,0,1]=4 2544 B5R0.1 C=C(C)CCS Amb25887673 [1,1,0,0,0,0|1,0,0]=3 2545 B5R0.1 C=C(C)CNC Amb30625043 [1,1,0,0,0,0|1,0,1]=4 2546 B5R0.1 C=C(C)CNC Amb3941317 [1,1,0,0,0,0|1,0,1]=4 2547 B5R0.1 C=C(C)COC Amb26589016 [1,1,0,0,0,0|0,1,1]=4 2548 B5R0.1 C=C(C)CSC Amb20671946 [1,1,0,0,0,0|0,0,1]=3 2549 B5R0.1 C=C(C)OCC Amb8393241 [1,1,0,0,0,0|2,0,0]=4 2550 B5R0.1 C=C(Cl)CCI Amb28187982 [1,1,0,0,0,0|2,0,0]=4 2551 B5R0.1 C=C(Cl)CCN Amb27493165 [1,1,0,0,0,0|2,0,0]=4 2552 B5R0.1 C=C(F)CNC Amb28194424 [1,1,0,0,0,0|1,0,1]=4 2553 B5R0.1 C=CCC(=C)C Amb22347764 [1,1,0,0,0,0|1,0,1]=4 2554 B5R0.1 C=CCC(=O)Cl Amb33543701 [1,1,0,0,0,0|0,0,2]=4 2555 B5R0.1 C=CCC(=O)O Amb3940098 [1,1,0,0,0,0|0,0,2]=4 2556 B5R0.1 C=CCC(C)=O Amb8396482 [1,1,0,0,0,0|0,0,2]=4 2557 B5R0.1 C=CCC(C)Br Amb26870150 [1,1,0,0,0,0|1,0,0]=3 2558 B5R0.1 C=CCC(C)C Amb8513260 [1,1,0,0,0,0|1,0,0]=3 2559 B5R0.1 C=CCC(C)Cl Amb26588784 [1,1,0,0,0,0|1,0,0]=3 2560 B5R0.1 C=CCC(C)N Amb17673480 [1,1,0,0,0,0|1,0,0]=3 2561 B5R0.1 C=CCC(C)N Amb19515336 [1,1,0,0,0,0|1,0,0]=3 2562 B5R0.1 C=CCC(C)O Amb33539328 [1,1,0,0,0,0|1,0,0]=3 2563 B5R0.1 C=CCC(N)=O Amb17610156 [1,1,0,0,0,0|0,0,2]=4 2564 B5R0.1 C=CC[C@@H](C)O Amb22225370 [1,1,0,0,0,0|1,0,0]=3 2565 B5R0.1 C=CC[C@H](C)N Amb28315904 [1,1,0,0,0,0|1,0,0]=3 2566 B5R0.1 C=CC[C@H](C)O Amb22226758 [1,1,0,0,0,0|1,0,0]=3 2567 B5R0.1 C=CNC(C)C Amb28075363 [1,1,0,0,0,0|2,0,0]=4 2568 B5R0.1 C=COC(C)C Amb22230777 [1,1,0,0,0,0|2,0,0]=4 2569 B5R0.1 C=NCC(N)=O Amb26548445 [1,1,0,0,0,0|1,0,1]=4 2570 B5R0.1 CC#CC(=O)Cl Amb27778056 [1,1,0,0,0,0|0,0,2]=4 2571 B5R0.1 CC#CC(=O)O Amb2685714 [1,1,0,0,0,0|0,0,2]=4 2572 B5R0.1 CC#CC(C)=O Amb17593016 [1,1,0,0,0,0|0,0,2]=4 2573 B5R0.1 CC#CC(N)=O Amb10552409 [1,1,0,0,0,0|0,0,2]=4 2574 B5R0.1 CC(=O)CC#N Amb1102132 [1,1,0,0,0,0|1,0,1]=4 2575 B5R0.1 CC(=O)CC=N Amb28285098 [1,1,0,0,0,0|1,0,1]=4 2576 B5R0.1 CC(=O)CCBr Amb24078246 [1,1,0,0,0,0|1,0,0]=3 2577 B5R0.1 CC(=O)CCCl Amb2720823 [1,1,0,0,0,0|1,0,0]=3 2578 B5R0.1 CC(=O)CCF Amb26427773 [1,1,0,0,0,0|1,0,0]=3 2579 B5R0.1 CC(=O)CCN Amb18632933 [1,1,0,0,0,0|1,0,0]=3 2580 B5R0.1 CC(=O)CCN Amb33544540 [1,1,0,0,0,0|1,0,0]=3 2581 B5R0.1 CC(=O)CCO Amb836357 [1,1,0,0,0,0|0,1,0]=3 2582 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [1,1,0,0,0,0|1,0,0]=3 2583 B5R0.1 CC(=O)CNO Amb28049954 [1,1,0,0,0,0|1,1,0]=4 2584 B5R0.1 CC(=O)CSN Amb28430346 [1,1,0,0,0,0|1,0,0]=3 2585 B5R0.1 CC(=O)NC=O Amb27850191 [1,1,0,0,0,0|1,0,1]=4 2586 B5R0.1 CC(=O)NCO Amb8516057 [1,1,0,0,0,0|1,1,0]=4 2587 B5R0.1 CC(=O)OC=O Amb25283525 [1,1,0,0,0,0|1,0,1]=4 2588 B5R0.1 CC(=O)OCBr Amb3941481 [1,1,0,0,0,0|2,0,0]=4 2589 B5R0.1 CC(=O)OCCl Amb33542858 [1,1,0,0,0,0|2,0,0]=4 2590 B5R0.1 CC(=O)OCI Amb25226851 [1,1,0,0,0,0|2,0,0]=4 2591 B5R0.1 CC(=O)SCBr Amb25349900 [1,1,0,0,0,0|2,0,0]=4 2592 B5R0.1 CC(=O)SCI Amb33339258 [1,1,0,0,0,0|2,0,0]=4 2593 B5R0.1 CC(=O)SCO Amb27255261 [1,1,0,0,0,0|1,1,0]=4 2594 B5R0.1 CC(Br)CC#N Amb22432187 [1,1,0,0,0,0|1,0,1]=4 2595 B5R0.1 CC(Br)CCBr Amb8513667 [1,1,0,0,0,0|1,0,1]=4 2596 B5R0.1 CC(Br)CCCl Amb27613510 [1,1,0,0,0,0|1,0,1]=4 2597 B5R0.1 CC(Br)CCF Amb28255100 [1,1,0,0,0,0|1,0,1]=4 2598 B5R0.1 CC(Br)\C=C\Cl Amb25196204 [1,1,0,0,0,0|1,0,1]=4 2599 B5R0.1 CC(C)=CC=O Amb8385061 [1,1,0,0,0,0|0,0,2]=4 2600 B5R0.1 CC(C)=CCS Amb17617244 [1,1,0,0,0,0|1,0,1]=4 2601 B5R0.1 CC(C)C=C=O Amb27858445 [1,1,0,0,0,0|0,0,2]=4 2602 B5R0.1 CC(C)CC#N Amb1162737 [1,1,0,0,0,0|1,0,1]=4 2603 B5R0.1 CC(C)CC=O Amb3939851 [1,1,0,0,0,0|0,0,0]=2 2604 B5R0.1 CC(C)CCBr Amb2795762 [1,1,0,0,0,0|1,0,1]=4 2605 B5R0.1 CC(C)CCCl Amb3941523 [1,1,0,0,0,0|1,0,1]=4 2606 B5R0.1 CC(C)CCI Amb6296701 [1,1,0,0,0,0|1,0,1]=4 2607 B5R0.1 CC(C)CCN Amb22337707 [1,1,0,0,0,0|1,0,1]=4 2608 B5R0.1 CC(C)CCN Amb3939010 [1,1,0,0,0,0|1,0,1]=4 2609 B5R0.1 CC(C)CCO Amb4605831 [1,1,0,0,0,0|0,0,2]=4 2610 B5R0.1 CC(C)CCS Amb8513472 [1,1,0,0,0,0|0,1,1]=4 2611 B5R0.1 CC(C)CNN Amb1105732 [1,1,0,0,0,0|2,0,0]=4 2612 B5R0.1 CC(C)CNN Amb22886984 [1,1,0,0,0,0|2,0,0]=4 2613 B5R0.1 CC(C)CNN Amb2691317 [1,1,0,0,0,0|2,0,0]=4 2614 B5R0.1 CC(C)CNO Amb25887512 [1,1,0,0,0,0|1,0,1]=4 2615 B5R0.1 CC(C)CON Amb19889788 [1,1,0,0,0,0|2,0,0]=4 2616 B5R0.1 CC(C)CON Amb2819061 [1,1,0,0,0,0|2,0,0]=4 2617 B5R0.1 CC(C)N=C=O Amb3939055 [1,1,0,0,0,0|1,0,1]=4 2618 B5R0.1 CC(C)NC=O Amb4017634 [1,1,0,0,0,0|1,0,0]=3 2619 B5R0.1 CC(C)NC=S Amb28049627 [1,1,0,0,0,0|1,1,0]=4 2620 B5R0.1 CC(C)OC=N Amb22337834 [1,1,0,0,0,0|2,0,0]=4 2621 B5R0.1 CC(C)OC=O Amb9787311 [1,1,0,0,0,0|1,0,0]=3 2622 B5R0.1 CC(C)ON=O Amb17938692 [1,1,0,0,0,0|2,0,0]=4 2623 B5R0.1 CC(Cl)CC#N Amb18640320 [1,1,0,0,0,0|1,0,1]=4 2624 B5R0.1 CC(Cl)CCBr Amb27412989 [1,1,0,0,0,0|1,0,1]=4 2625 B5R0.1 CC(Cl)CCF Amb27657075 [1,1,0,0,0,0|1,0,1]=4 2626 B5R0.1 CC(Cl)CCN Amb28383162 [1,1,0,0,0,0|1,0,1]=4 2627 B5R0.1 CC(Cl)CCO Amb27625144 [1,1,0,0,0,0|0,0,2]=4 2628 B5R0.1 CC(Cl)\C=C\Cl Amb25256868 [1,1,0,0,0,0|1,0,1]=4 2629 B5R0.1 CC(F)CC=O Amb28051612 [1,1,0,0,0,0|0,0,0]=2 2630 B5R0.1 CC(F)CCBr Amb27955878 [1,1,0,0,0,0|1,0,1]=4 2631 B5R0.1 CC(F)CCCl Amb28315660 [1,1,0,0,0,0|1,0,1]=4 2632 B5R0.1 CC(F)CCI Amb25146599 [1,1,0,0,0,0|1,0,1]=4 2633 B5R0.1 CC(F)CCN Amb26081186 [1,1,0,0,0,0|1,0,1]=4 2634 B5R0.1 CC(F)CCN Amb32653508 [1,1,0,0,0,0|1,0,1]=4 2635 B5R0.1 CC(F)CCO Amb21951900 [1,1,0,0,0,0|0,0,2]=4 2636 B5R0.1 CC(N)CC#N Amb13951628 [1,1,0,0,0,0|1,0,1]=4 2637 B5R0.1 CC(N)CC#N Amb19515067 [1,1,0,0,0,0|1,0,1]=4 2638 B5R0.1 CC(N)CCCl Amb26959021 [1,1,0,0,0,0|1,0,1]=4 2639 B5R0.1 CC(N)CCCl Amb32670914 [1,1,0,0,0,0|1,0,1]=4 2640 B5R0.1 CC(N)CCF Amb25811370 [1,1,0,0,0,0|1,0,1]=4 2641 B5R0.1 CC(N)CCN Amb18951361 [1,1,0,0,0,0|1,0,1]=4 2642 B5R0.1 CC(N)CCN Amb19338152 [1,1,0,0,0,0|1,0,1]=4 2643 B5R0.1 CC(N)CCO Amb2697504 [1,1,0,0,0,0|0,0,2]=4 2644 B5R0.1 CC(N)CCO Amb32666060 [1,1,0,0,0,0|0,0,2]=4 2645 B5R0.1 CC(N)CCS Amb28049414 [1,1,0,0,0,0|0,1,1]=4 2646 B5R0.1 CC(N)CNN Amb24680308 [1,1,0,0,0,0|2,0,0]=4 2647 B5R0.1 CC(N)CNN Amb32651879 [1,1,0,0,0,0|2,0,0]=4 2648 B5R0.1 CC(N)CON Amb28315722 [1,1,0,0,0,0|2,0,0]=4 2649 B5R0.1 CC(O)CC#N Amb8516858 [1,1,0,0,0,0|1,0,1]=4 2650 B5R0.1 CC(O)CC=O Amb4036424 [1,1,0,0,0,0|0,0,0]=2 2651 B5R0.1 CC(O)CCBr Amb33548043 [1,1,0,0,0,0|1,0,1]=4 2652 B5R0.1 CC(O)CCCl Amb24551052 [1,1,0,0,0,0|1,0,1]=4 2653 B5R0.1 CC(O)CCF Amb26449397 [1,1,0,0,0,0|1,0,1]=4 2654 B5R0.1 CC(O)CCN Amb32666140 [1,1,0,0,0,0|1,0,1]=4 2655 B5R0.1 CC(O)CCN Amb33537908 [1,1,0,0,0,0|1,0,1]=4 2656 B5R0.1 CC(O)CCO Amb6608662 [1,1,0,0,0,0|0,0,2]=4 2657 B5R0.1 CC(O)CNN Amb33622274 [1,1,0,0,0,0|2,0,0]=4 2658 B5R0.1 CC(O)CNN Amb844968 [1,1,0,0,0,0|2,0,0]=4 2659 B5R0.1 CC(O)CON Amb21962618 [1,1,0,0,0,0|2,0,0]=4 2660 B5R0.1 CC(O)NC=O Amb28049622 [1,1,0,0,0,0|1,0,0]=3 2661 B5R0.1 CC(S)CCN Amb18908261 [1,1,0,0,0,0|1,0,1]=4 2662 B5R0.1 CC(S)CCN Amb32675067 [1,1,0,0,0,0|1,0,1]=4 2663 B5R0.1 CC(S)CCO Amb19148316 [1,1,0,0,0,0|0,0,2]=4 2664 B5R0.1 CC(S)CCS Amb22227722 [1,1,0,0,0,0|0,1,1]=4 2665 B5R0.1 CCC=C(Br)Br Amb25887651 [1,1,0,0,0,0|1,0,1]=4 2666 B5R0.1 CCC=C(C)C Amb22336412 [1,1,0,0,0,0|1,0,1]=4 2667 B5R0.1 CCC=C(F)F Amb10839842 [1,1,0,0,0,0|1,0,1]=4 2668 B5R0.1 CCCB(O)O Amb2447105 [1,1,0,0,0,0|1,0,1]=4 2669 B5R0.1 CCCC(=N)N Amb10610381 [1,1,0,0,0,0|1,0,0]=3 2670 B5R0.1 CCCC(=N)N Amb2695914 [1,1,0,0,0,0|1,0,0]=3 2671 B5R0.1 CCCC(=O)Br Amb22734023 [1,1,0,0,0,0|0,0,0]=2 2672 B5R0.1 CCCC(=O)Cl Amb2792903 [1,1,0,0,0,0|0,0,0]=2 2673 B5R0.1 CCCC(=O)O Amb3939012 [1,1,0,0,0,0|0,0,0]=2 2674 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,1,0,0,0,0|0,0,0]=2 2675 B5R0.1 CCCC(=S)Cl Amb24626931 [1,1,0,0,0,0|0,1,0]=3 2676 B5R0.1 CCCC(Br)Br Amb27801326 [1,1,0,0,0,0|1,0,1]=4 2677 B5R0.1 CCCC(C)=O Amb6608910 [1,1,0,0,0,0|0,0,0]=2 2678 B5R0.1 CCCC(C)Br Amb3940201 [1,1,0,0,0,0|1,0,1]=4 2679 B5R0.1 CCCC(C)Cl Amb4018346 [1,1,0,0,0,0|1,0,1]=4 2680 B5R0.1 CCCC(C)I Amb17939400 [1,1,0,0,0,0|1,0,1]=4 2681 B5R0.1 CCCC(C)N Amb10609075 [1,1,0,0,0,0|1,0,1]=4 2682 B5R0.1 CCCC(C)N Amb3941259 [1,1,0,0,0,0|1,0,1]=4 2683 B5R0.1 CCCC(C)O Amb4605839 [1,1,0,0,0,0|0,0,2]=4 2684 B5R0.1 CCCC(C)S Amb7784731 [1,1,0,0,0,0|0,1,1]=4 2685 B5R0.1 CCCC(Cl)Br Amb27657591 [1,1,0,0,0,0|1,0,1]=4 2686 B5R0.1 CCCC(Cl)Cl Amb25062516 [1,1,0,0,0,0|1,0,1]=4 2687 B5R0.1 CCCC(F)Br Amb27856781 [1,1,0,0,0,0|1,0,1]=4 2688 B5R0.1 CCCC(N)=O Amb3886524 [1,1,0,0,0,0|0,0,0]=2 2689 B5R0.1 CCCC(N)=S Amb6245403 [1,1,0,0,0,0|0,1,0]=3 2690 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [1,1,0,0,0,0|1,0,0]=3 2691 B5R0.1 CCCC(O)=S Amb22229383 [1,1,0,0,0,0|0,0,1]=3 2692 B5R0.1 CCCC(O)Cl Amb22552567 [1,1,0,0,0,0|0,0,2]=4 2693 B5R0.1 CCCC(O)O Amb26364594 [1,1,0,0,0,0|0,0,2]=4 2694 B5R0.1 CCCN(C)C Amb22733186 [1,1,0,0,0,0|1,0,1]=4 2695 B5R0.1 CCCN(C)O Amb25024622 [1,1,0,0,0,0|1,0,1]=4 2696 B5R0.1 CCCP(Cl)Cl Amb22053969 [1,1,0,0,0,0|2,0,0]=4 2697 B5R0.1 CCCS(=O)Cl Amb25025566 [1,1,0,0,0,0|1,0,0]=3 2698 B5R0.1 CCCS(=O)[O-] Amb19929119 [1,1,0,0,0,0|1,0,0]=3 2699 B5R0.1 CCCS(N)=O Amb24733579 [1,1,0,0,0,0|1,0,0]=3 2700 B5R0.1 CCC[C@@H](C)N Amb22898992 [1,1,0,0,0,0|1,0,1]=4 2701 B5R0.1 CCC[C@@H](C)N Amb23439500 [1,1,0,0,0,0|1,0,1]=4 2702 B5R0.1 CCC[C@@H](C)O Amb8628178 [1,1,0,0,0,0|0,0,2]=4 2703 B5R0.1 CCC[C@@H](N)O Amb28074861 [1,1,0,0,0,0|0,0,2]=4 2704 B5R0.1 CCC[C@H](C)Br Amb27650565 [1,1,0,0,0,0|1,0,1]=4 2705 B5R0.1 CCC[C@H](C)N Amb21618754 [1,1,0,0,0,0|1,0,1]=4 2706 B5R0.1 CCC[C@H](C)N Amb31204590 [1,1,0,0,0,0|1,0,1]=4 2707 B5R0.1 CCC[C@H](C)O Amb8389338 [1,1,0,0,0,0|0,0,2]=4 2708 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [1,1,0,0,0,0|1,0,0]=3 2709 B5R0.1 CCNC(=N)N Amb21964689 [1,1,0,0,0,0|2,0,0]=4 2710 B5R0.1 CCNC(=N)N Amb22053912 [1,1,0,0,0,0|2,0,0]=4 2711 B5R0.1 CCNC(=O)Cl Amb25791793 [1,1,0,0,0,0|1,0,0]=3 2712 B5R0.1 CCNC(=S)S Amb26505127 [1,1,0,0,0,0|1,1,0]=4 2713 B5R0.1 CCNC(C)=O Amb2780415 [1,1,0,0,0,0|1,0,0]=3 2714 B5R0.1 CCNC(N)=O Amb6608844 [1,1,0,0,0,0|1,0,0]=3 2715 B5R0.1 CCNC(N)=S Amb6608838 [1,1,0,0,0,0|1,1,0]=4 2716 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [1,1,0,0,0,0|2,0,0]=4 2717 B5R0.1 CCOC(=N)N Amb16231402 [1,1,0,0,0,0|2,0,0]=4 2718 B5R0.1 CCOC(=N)N Amb27173000 [1,1,0,0,0,0|2,0,0]=4 2719 B5R0.1 CCOC(=O)Cl Amb2793045 [1,1,0,0,0,0|1,0,0]=3 2720 B5R0.1 CCOC(=O)O Amb8393208 [1,1,0,0,0,0|1,0,0]=3 2721 B5R0.1 CCOC(=S)Cl Amb26030825 [1,1,0,0,0,0|1,1,0]=4 2722 B5R0.1 CCOC(=S)[S-] Amb22729921 [1,1,0,0,0,0|1,1,0]=4 2723 B5R0.1 CCOC(=S)[S-] Amb8480129 [1,1,0,0,0,0|1,1,0]=4 2724 B5R0.1 CCOC(C)=N Amb8394853 [1,1,0,0,0,0|2,0,0]=4 2725 B5R0.1 CCOC(C)=N Amb8514666 [1,1,0,0,0,0|2,0,0]=4 2726 B5R0.1 CCOC(C)=O Amb3940488 [1,1,0,0,0,0|1,0,0]=3 2727 B5R0.1 CCOC(C)=S Amb22047276 [1,1,0,0,0,0|1,1,0]=4 2728 B5R0.1 CCOC(N)=O Amb6608672 [1,1,0,0,0,0|1,0,0]=3 2729 B5R0.1 CCOC(N)=S Amb10241338 [1,1,0,0,0,0|1,1,0]=4 2730 B5R0.1 CCOS(=O)Cl Amb25239825 [1,1,0,0,0,0|2,0,0]=4 2731 B5R0.1 CCO[N+](=O)[O-] Amb22732543 [1,1,0,0,0,0|2,0,0]=4 2732 B5R0.1 CCO[PH](=O)O Amb22360741 [1,1,0,0,0,0|2,0,0]=4 2733 B5R0.1 CCO[PH](=O)[O-] Amb22731647 [1,1,0,0,0,0|2,0,0]=4 2734 B5R0.1 CCO[Si](=O)O Amb26569259 [1,1,0,0,0,0|1,1,0]=4 2735 B5R0.1 CCSC(=N)N Amb16205363 [1,1,0,0,0,0|2,0,0]=4 2736 B5R0.1 CCSC(=N)N Amb8393903 [1,1,0,0,0,0|2,0,0]=4 2737 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [1,1,0,0,0,0|2,0,0]=4 2738 B5R0.1 CCSC(=O)Cl Amb8516064 [1,1,0,0,0,0|1,0,0]=3 2739 B5R0.1 CCSC(=S)[S-] Amb27247124 [1,1,0,0,0,0|1,1,0]=4 2740 B5R0.1 CCSC(C)=S Amb8394854 [1,1,0,0,0,0|1,1,0]=4 2741 B5R0.1 CCSC(N)=S Amb25969673 [1,1,0,0,0,0|1,1,0]=4 2742 B5R0.1 CC[O+]=C(N)N Amb22492446 [1,1,0,0,0,0|2,0,0]=4 2743 B5R0.1 CN(Br)CCO Amb27405311 [1,1,0,0,0,0|1,0,1]=4 2744 B5R0.1 CN(C)CC=O Amb22002191 [1,1,0,0,0,0|1,0,0]=3 2745 B5R0.1 CN(C)CC=O Amb22491245 [1,1,0,0,0,0|1,0,0]=3 2746 B5R0.1 CN(C)CCBr Amb10603116 [1,1,0,0,0,0|2,0,0]=4 2747 B5R0.1 CN(C)CCBr Amb10608907 [1,1,0,0,0,0|2,0,0]=4 2748 B5R0.1 CN(C)CCCl Amb1152528 [1,1,0,0,0,0|2,0,0]=4 2749 B5R0.1 CN(C)CCCl Amb22233801 [1,1,0,0,0,0|2,0,0]=4 2750 B5R0.1 CN(C)CCCl Amb2519363 [1,1,0,0,0,0|2,0,0]=4 2751 B5R0.1 CN(C)CCF Amb27861975 [1,1,0,0,0,0|2,0,0]=4 2752 B5R0.1 CN(C)CCI Amb26601022 [1,1,0,0,0,0|2,0,0]=4 2753 B5R0.1 CN(C)CCI Amb32670598 [1,1,0,0,0,0|2,0,0]=4 2754 B5R0.1 CN(C)CCI Amb35781981 [1,1,0,0,0,0|2,0,0]=4 2755 B5R0.1 CN(C)CCN Amb2720698 [1,1,0,0,0,0|2,0,0]=4 2756 B5R0.1 CN(C)CCO Amb2793033 [1,1,0,0,0,0|1,0,1]=4 2757 B5R0.1 CN(C)CCS Amb7764632 [1,1,0,0,0,0|1,1,0]=4 2758 B5R0.1 CN(C)CCS Amb8513139 [1,1,0,0,0,0|1,1,0]=4 2759 B5R0.1 CN(C)NC=O Amb1930732 [1,1,0,0,0,0|2,0,0]=4 2760 B5R0.1 CN(Cl)CCO Amb27457982 [1,1,0,0,0,0|1,0,1]=4 2761 B5R0.1 CN(N)CCCl Amb28195254 [1,1,0,0,0,0|2,0,0]=4 2762 B5R0.1 CN(N)CCO Amb28400197 [1,1,0,0,0,0|1,0,1]=4 2763 B5R0.1 CN(O)CCCl Amb27473361 [1,1,0,0,0,0|2,0,0]=4 2764 B5R0.1 CN(O)CCF Amb33377280 [1,1,0,0,0,0|2,0,0]=4 2765 B5R0.1 CNCC(=O)O Amb6298808 [1,1,0,0,0,0|1,0,0]=3 2766 B5R0.1 CNCC(=O)O Amb6599996 [1,1,0,0,0,0|1,0,0]=3 2767 B5R0.1 CNCC(=O)[O-] Amb20246714 [1,1,0,0,0,0|1,0,0]=3 2768 B5R0.1 CNCC(C)=O Amb17621974 [1,1,0,0,0,0|1,0,0]=3 2769 B5R0.1 CNCC(C)=O Amb21959975 [1,1,0,0,0,0|1,0,0]=3 2770 B5R0.1 CNCC(C)C Amb1119103 [1,1,0,0,0,0|1,0,1]=4 2771 B5R0.1 CNCC(C)C Amb13951443 [1,1,0,0,0,0|1,0,1]=4 2772 B5R0.1 CNCC(C)Cl Amb28049706 [1,1,0,0,0,0|1,0,1]=4 2773 B5R0.1 CNCC(C)N Amb18281800 [1,1,0,0,0,0|1,0,1]=4 2774 B5R0.1 CNCC(C)N Amb20629142 [1,1,0,0,0,0|1,0,1]=4 2775 B5R0.1 CNCC(C)O Amb32666238 [1,1,0,0,0,0|1,0,1]=4 2776 B5R0.1 CNCC(C)O Amb9247471 [1,1,0,0,0,0|1,0,1]=4 2777 B5R0.1 CNCC(Cl)Cl Amb26591548 [1,1,0,0,0,0|2,0,0]=4 2778 B5R0.1 CNCC(Cl)Cl Amb32653161 [1,1,0,0,0,0|2,0,0]=4 2779 B5R0.1 CNCC(F)F Amb10610328 [1,1,0,0,0,0|2,0,0]=4 2780 B5R0.1 CNCC(F)F Amb8853650 [1,1,0,0,0,0|2,0,0]=4 2781 B5R0.1 CNCC(N)=O Amb19134307 [1,1,0,0,0,0|1,0,0]=3 2782 B5R0.1 CNCC(N)=O Amb3940074 [1,1,0,0,0,0|1,0,0]=3 2783 B5R0.1 CNCC(N)=O Amb9151172 [1,1,0,0,0,0|1,0,0]=3 2784 B5R0.1 CNC[C@@H](C)O Amb26972484 [1,1,0,0,0,0|1,0,1]=4 2785 B5R0.1 CNC[C@@H](C)O Amb32652763 [1,1,0,0,0,0|1,0,1]=4 2786 B5R0.1 CNC[C@H](C)N Amb27452084 [1,1,0,0,0,0|1,0,1]=4 2787 B5R0.1 CNC[C@H](C)O Amb27596614 [1,1,0,0,0,0|1,0,1]=4 2788 B5R0.1 CNC[C@H](C)O Amb32652861 [1,1,0,0,0,0|1,0,1]=4 2789 B5R0.1 CNOC(N)=O Amb28341734 [1,1,0,0,0,0|2,0,0]=4 2790 B5R0.1 COCC(=N)N Amb2696281 [1,1,0,0,0,0|1,1,0]=4 2791 B5R0.1 COCC(=N)N Amb33551686 [1,1,0,0,0,0|1,1,0]=4 2792 B5R0.1 COCC(=O)Cl Amb3939326 [1,1,0,0,0,0|0,1,0]=3 2793 B5R0.1 COCC(=O)O Amb3939876 [1,1,0,0,0,0|0,1,0]=3 2794 B5R0.1 COCC(C)=O Amb8513767 [1,1,0,0,0,0|0,1,0]=3 2795 B5R0.1 COCC(C)Br Amb18180533 [1,1,0,0,0,0|0,1,1]=4 2796 B5R0.1 COCC(C)C Amb26897702 [1,1,0,0,0,0|0,1,1]=4 2797 B5R0.1 COCC(C)I Amb25361647 [1,1,0,0,0,0|0,1,1]=4 2798 B5R0.1 COCC(C)N Amb22233778 [1,1,0,0,0,0|0,1,1]=4 2799 B5R0.1 COCC(C)N Amb3939301 [1,1,0,0,0,0|0,1,1]=4 2800 B5R0.1 COCC(C)O Amb33544397 [1,1,0,0,0,0|0,1,1]=4 2801 B5R0.1 COCC(C)S Amb27647273 [1,1,0,0,0,0|0,1,1]=4 2802 B5R0.1 COCC(Cl)Cl Amb28324210 [1,1,0,0,0,0|1,1,0]=4 2803 B5R0.1 COCC(N)=O Amb1153776 [1,1,0,0,0,0|0,1,0]=3 2804 B5R0.1 COCC(N)=S Amb6268129 [1,1,0,0,0,0|0,2,0]=4 2805 B5R0.1 COC[C@@H](C)N Amb18529651 [1,1,0,0,0,0|0,1,1]=4 2806 B5R0.1 COC[C@@H](C)N Amb19149178 [1,1,0,0,0,0|0,1,1]=4 2807 B5R0.1 COC[C@@H](C)O Amb8383545 [1,1,0,0,0,0|0,1,1]=4 2808 B5R0.1 COC[C@H](C)N Amb17061637 [1,1,0,0,0,0|0,1,1]=4 2809 B5R0.1 COC[C@H](C)N Amb24052963 [1,1,0,0,0,0|0,1,1]=4 2810 B5R0.1 COC[C@H](C)O Amb8515770 [1,1,0,0,0,0|0,1,1]=4 2811 B5R0.1 CONC(C)=O Amb25046114 [1,1,0,0,0,0|1,1,0]=4 2812 B5R0.1 CONC(N)=O Amb2417193 [1,1,0,0,0,0|1,1,0]=4 2813 B5R0.1 CS(=O)CCBr Amb28049280 [1,1,0,0,0,0|1,0,1]=4 2814 B5R0.1 CS(=O)CCCl Amb24116979 [1,1,0,0,0,0|1,0,1]=4 2815 B5R0.1 CS(=O)CCI Amb27752977 [1,1,0,0,0,0|1,0,1]=4 2816 B5R0.1 CS(=O)CCN Amb2786559 [1,1,0,0,0,0|1,0,1]=4 2817 B5R0.1 CS(=O)CCN Amb33543191 [1,1,0,0,0,0|1,0,1]=4 2818 B5R0.1 CS(=O)CCO Amb28075364 [1,1,0,0,0,0|0,0,2]=4 2819 B5R0.1 CSCC(=N)N Amb2696282 [1,1,0,0,0,0|1,0,0]=3 2820 B5R0.1 CSCC(=N)N Amb8630183 [1,1,0,0,0,0|1,0,0]=3 2821 B5R0.1 CSCC(=O)Cl Amb24528357 [1,1,0,0,0,0|0,0,0]=2 2822 B5R0.1 CSCC(=O)O Amb1152425 [1,1,0,0,0,0|0,0,0]=2 2823 B5R0.1 CSCC(C)=O Amb20621731 [1,1,0,0,0,0|0,0,0]=2 2824 B5R0.1 CSCC(C)Cl Amb24626062 [1,1,0,0,0,0|0,0,1]=3 2825 B5R0.1 CSCC(C)N Amb18963391 [1,1,0,0,0,0|0,0,1]=3 2826 B5R0.1 CSCC(C)O Amb20622311 [1,1,0,0,0,0|0,0,1]=3 2827 B5R0.1 CSCC(C)S Amb32788395 [1,1,0,0,0,0|0,0,1]=3 2828 B5R0.1 CSCC(Cl)Cl Amb26022177 [1,1,0,0,0,0|1,0,0]=3 2829 B5R0.1 CSCC(N)=O Amb19515874 [1,1,0,0,0,0|0,0,0]=2 2830 B5R0.1 CSCC(N)=S Amb17503394 [1,1,0,0,0,0|0,1,0]=3 2831 B5R0.1 CSCN(C)C Amb19889371 [1,1,0,0,0,0|1,0,1]=4 2832 B5R0.1 CSCS(C)=O Amb22045140 [1,1,0,0,0,0|1,0,0]=3 2833 B5R0.1 CSC[C@@H](C)N Amb27837685 [1,1,0,0,0,0|0,0,1]=3 2834 B5R0.1 CSC[C@@H](C)O Amb24408899 [1,1,0,0,0,0|0,0,1]=3 2835 B5R0.1 CSC[C@H](C)N Amb26537772 [1,1,0,0,0,0|0,0,1]=3 2836 B5R0.1 CSC[C@H](C)O Amb24699036 [1,1,0,0,0,0|0,0,1]=3 2837 B5R0.1 CSNC(C)=O Amb22500292 [1,1,0,0,0,0|1,0,0]=3 2838 B5R0.1 CSSC(=N)N Amb27390877 [1,1,0,0,0,0|2,0,0]=4 2839 B5R0.1 CSSC(C)C Amb26440590 [1,1,0,0,0,0|1,0,1]=4 2840 B5R0.1 C[C@@H](N)CC#N Amb24183330 [1,1,0,0,0,0|1,0,1]=4 2841 B5R0.1 C[C@@H](N)CCF Amb33481445 [1,1,0,0,0,0|1,0,1]=4 2842 B5R0.1 C[C@@H](N)CCO Amb19515999 [1,1,0,0,0,0|0,0,2]=4 2843 B5R0.1 C[C@@H](N)CCO Amb22746127 [1,1,0,0,0,0|0,0,2]=4 2844 B5R0.1 C[C@@H](N)CON Amb28204295 [1,1,0,0,0,0|2,0,0]=4 2845 B5R0.1 C[C@@H](O)CC#N Amb22224888 [1,1,0,0,0,0|1,0,1]=4 2846 B5R0.1 C[C@@H](O)CCBr Amb27392288 [1,1,0,0,0,0|1,0,1]=4 2847 B5R0.1 C[C@@H](O)CCF Amb33376906 [1,1,0,0,0,0|1,0,1]=4 2848 B5R0.1 C[C@@H](O)CCI Amb27594639 [1,1,0,0,0,0|1,0,1]=4 2849 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,1,0,0,0,0|1,0,1]=4 2850 B5R0.1 C[C@@H](O)CCN Amb28555327 [1,1,0,0,0,0|1,0,1]=4 2851 B5R0.1 C[C@@H](O)CCO Amb4166294 [1,1,0,0,0,0|0,0,2]=4 2852 B5R0.1 C[C@@H](O)CON Amb26019757 [1,1,0,0,0,0|2,0,0]=4 2853 B5R0.1 C[C@@H](S)CCO Amb27255216 [1,1,0,0,0,0|0,0,2]=4 2854 B5R0.1 C[C@H](F)CCBr Amb28291619 [1,1,0,0,0,0|1,0,1]=4 2855 B5R0.1 C[C@H](F)CCO Amb28428651 [1,1,0,0,0,0|0,0,2]=4 2856 B5R0.1 C[C@H](N)CC#N Amb33801938 [1,1,0,0,0,0|1,0,1]=4 2857 B5R0.1 C[C@H](N)CCF Amb33481439 [1,1,0,0,0,0|1,0,1]=4 2858 B5R0.1 C[C@H](N)CCO Amb19515998 [1,1,0,0,0,0|0,0,2]=4 2859 B5R0.1 C[C@H](N)CCO Amb24055217 [1,1,0,0,0,0|0,0,2]=4 2860 B5R0.1 C[C@H](O)CC#N Amb22736701 [1,1,0,0,0,0|1,0,1]=4 2861 B5R0.1 C[C@H](O)CC=O Amb27595676 [1,1,0,0,0,0|0,0,0]=2 2862 B5R0.1 C[C@H](O)CCBr Amb28367228 [1,1,0,0,0,0|1,0,1]=4 2863 B5R0.1 C[C@H](O)CCF Amb33376900 [1,1,0,0,0,0|1,0,1]=4 2864 B5R0.1 C[C@H](O)CCN Amb22736705 [1,1,0,0,0,0|1,0,1]=4 2865 B5R0.1 C[C@H](O)CCN Amb34159890 [1,1,0,0,0,0|1,0,1]=4 2866 B5R0.1 C[C@H](O)CCO Amb4166300 [1,1,0,0,0,0|0,0,2]=4 2867 B5R0.1 C[C@H](O)CNN Amb27589718 [1,1,0,0,0,0|2,0,0]=4 2868 B5R0.1 C[C@H](O)CON Amb24557560 [1,1,0,0,0,0|2,0,0]=4 2869 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,1,0,0,0,0|1,0,0]=3 2870 B5R0.1 C[S+](C)CCCl Amb22496543 [1,1,0,0,0,0|1,0,1]=4 2871 B5R0.1 C\C(Br)=C/C=O Amb27202112 [1,1,0,0,0,0|0,0,2]=4 2872 B5R0.1 C\C(Br)=C\C=O Amb27201671 [1,1,0,0,0,0|0,0,2]=4 2873 B5R0.1 C\C(N)=C/C=O Amb2612039 [1,1,0,0,0,0|0,0,2]=4 2874 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,1,0,0,0,0|0,0,2]=4 2875 B5R0.1 C\C=C/C(C)=O Amb28351405 [1,1,0,0,0,0|0,0,2]=4 2876 B5R0.1 C\C=C/C(C)C Amb20618870 [1,1,0,0,0,0|1,0,1]=4 2877 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,1,0,0,0,0|0,0,2]=4 2878 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [1,1,0,0,0,0|0,0,2]=4 2879 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,1,0,0,0,0|0,0,2]=4 2880 B5R0.1 C\C=C\C(C)=O Amb33941980 [1,1,0,0,0,0|0,0,2]=4 2881 B5R0.1 C\C=C\C(C)Br Amb24725263 [1,1,0,0,0,0|1,0,1]=4 2882 B5R0.1 C\C=C\C(C)C Amb4019538 [1,1,0,0,0,0|1,0,1]=4 2883 B5R0.1 C\C=C\C(C)Cl Amb24377224 [1,1,0,0,0,0|1,0,1]=4 2884 B5R0.1 C\C=C\C(C)N Amb19514513 [1,1,0,0,0,0|1,0,1]=4 2885 B5R0.1 C\C=C\C(C)N Amb33295164 [1,1,0,0,0,0|1,0,1]=4 2886 B5R0.1 C\C=C\C(C)O Amb2721243 [1,1,0,0,0,0|1,0,1]=4 2887 B5R0.1 C\C=C\C(N)=O Amb4025906 [1,1,0,0,0,0|0,0,2]=4 2888 B5R0.1 FC(F)CCS Amb25025912 [1,1,0,0,0,0|1,0,1]=4 2889 B5R0.1 N#CCC(=O)Cl Amb17593096 [1,1,0,0,0,0|1,0,1]=4 2890 B5R0.1 N#CCC(=O)O Amb2609022 [1,1,0,0,0,0|1,0,1]=4 2891 B5R0.1 N#CCC(N)=O Amb6336473 [1,1,0,0,0,0|1,0,1]=4 2892 B5R0.1 N=C(Br)CCBr Amb27653883 [1,1,0,0,0,0|2,0,0]=4 2893 B5R0.1 N=C(N)CCBr Amb4297021 [1,1,0,0,0,0|2,0,0]=4 2894 B5R0.1 N=C(N)CCCl Amb25839424 [1,1,0,0,0,0|2,0,0]=4 2895 B5R0.1 N=C(N)CCF Amb26024692 [1,1,0,0,0,0|2,0,0]=4 2896 B5R0.1 N=C(N)CCN Amb27265608 [1,1,0,0,0,0|2,0,0]=4 2897 B5R0.1 N=C(N)CCN Amb32687503 [1,1,0,0,0,0|2,0,0]=4 2898 B5R0.1 N=C(N)CCN Amb33164129 [1,1,0,0,0,0|2,0,0]=4 2899 B5R0.1 N=C(N)CCO Amb2696134 [1,1,0,0,0,0|1,1,0]=4 2900 B5R0.1 N=C(N)CCO Amb8630168 [1,1,0,0,0,0|1,1,0]=4 2901 B5R0.1 NC(=O)CC=O Amb25777522 [1,1,0,0,0,0|0,1,1]=4 2902 B5R0.1 NC(=O)CCBr Amb21618712 [1,1,0,0,0,0|1,0,0]=3 2903 B5R0.1 NC(=O)CCCl Amb1127569 [1,1,0,0,0,0|1,0,0]=3 2904 B5R0.1 NC(=O)CCF Amb28289353 [1,1,0,0,0,0|1,0,0]=3 2905 B5R0.1 NC(=O)CCI Amb27966778 [1,1,0,0,0,0|1,0,0]=3 2906 B5R0.1 NC(=O)CCO Amb9421407 [1,1,0,0,0,0|0,1,0]=3 2907 B5R0.1 NC(=O)CCS Amb27154802 [1,1,0,0,0,0|0,0,0]=2 2908 B5R0.1 NC(=O)CNCl Amb28315673 [1,1,0,0,0,0|2,0,0]=4 2909 B5R0.1 NC(=O)NCO Amb17674341 [1,1,0,0,0,0|1,1,0]=4 2910 B5R0.1 NC(=O)SCCl Amb26419693 [1,1,0,0,0,0|2,0,0]=4 2911 B5R0.1 NC(=S)CCCl Amb33328368 [1,1,0,0,0,0|1,1,0]=4 2912 B5R0.1 NC(=S)CCF Amb27950563 [1,1,0,0,0,0|1,1,0]=4 2913 B5R0.1 NC(=S)CCO Amb8855295 [1,1,0,0,0,0|0,2,0]=4 2914 B5R0.1 NC(=S)CCS Amb17503271 [1,1,0,0,0,0|0,1,0]=3 2915 B5R0.1 NCCC(=O)Cl Amb24117140 [1,1,0,0,0,0|1,0,0]=3 2916 B5R0.1 NCCC(=O)O Amb1935127 [1,1,0,0,0,0|1,0,0]=3 2917 B5R0.1 NCCC(=O)[O-] Amb28991330 [1,1,0,0,0,0|1,0,0]=3 2918 B5R0.1 NCCC(N)=O Amb1137251 [1,1,0,0,0,0|1,0,0]=3 2919 B5R0.1 NCCC(N)=O Amb9147573 [1,1,0,0,0,0|1,0,0]=3 2920 B5R0.1 NCCC(N)=S Amb18523221 [1,1,0,0,0,0|1,1,0]=4 2921 B5R0.1 NCCC(N)=S Amb33456385 [1,1,0,0,0,0|1,1,0]=4 2922 B5R0.1 NCCS(=O)O Amb6600043 [1,1,0,0,0,0|2,0,0]=4 2923 B5R0.1 NCCS(N)=O Amb33512527 [1,1,0,0,0,0|2,0,0]=4 2924 B5R0.1 NCC[N+](=O)[O-] Amb18203119 [1,1,0,0,0,0|2,0,0]=4 2925 B5R0.1 NCC[PH](=O)O Amb22168066 [1,1,0,0,0,0|2,0,0]=4 2926 B5R0.1 NCC[PH](=O)O Amb35788864 [1,1,0,0,0,0|2,0,0]=4 2927 B5R0.1 NNCC(=O)O Amb32751165 [1,1,0,0,0,0|2,0,0]=4 2928 B5R0.1 NNCC(=O)O Amb6740299 [1,1,0,0,0,0|2,0,0]=4 2929 B5R0.1 NNCC(N)=O Amb32990162 [1,1,0,0,0,0|2,0,0]=4 2930 B5R0.1 NOCC(=O)O Amb1154237 [1,1,0,0,0,0|1,1,0]=4 2931 B5R0.1 NOCC(=O)O Amb4324355 [1,1,0,0,0,0|1,1,0]=4 2932 B5R0.1 NOCC(=O)O Amb8513076 [1,1,0,0,0,0|1,1,0]=4 2933 B5R0.1 NOCC(N)=O Amb33528973 [1,1,0,0,0,0|1,1,0]=4 2934 B5R0.1 NS(=O)CCCl Amb24407159 [1,1,0,0,0,0|2,0,0]=4 2935 B5R0.1 NS(=O)CCF Amb32720391 [1,1,0,0,0,0|2,0,0]=4 2936 B5R0.1 NS(=O)CCO Amb32720357 [1,1,0,0,0,0|1,1,0]=4 2937 B5R0.1 O=C(Br)CCBr Amb24624022 [1,1,0,0,0,0|1,0,0]=3 2938 B5R0.1 O=C(Cl)CCBr Amb3941484 [1,1,0,0,0,0|1,0,0]=3 2939 B5R0.1 O=C(Cl)CCCl Amb3939313 [1,1,0,0,0,0|1,0,0]=3 2940 B5R0.1 O=C(Cl)CCF Amb27148631 [1,1,0,0,0,0|1,0,0]=3 2941 B5R0.1 O=C(Cl)CCI Amb28454579 [1,1,0,0,0,0|1,0,0]=3 2942 B5R0.1 O=C(Cl)CCO Amb27270014 [1,1,0,0,0,0|0,1,0]=3 2943 B5R0.1 O=C(Cl)NCCl Amb28315820 [1,1,0,0,0,0|2,0,0]=4 2944 B5R0.1 O=C(Cl)OCCl Amb8389474 [1,1,0,0,0,0|2,0,0]=4 2945 B5R0.1 O=C(F)CCCl Amb27257545 [1,1,0,0,0,0|1,0,0]=3 2946 B5R0.1 O=C(F)OCCl Amb27860169 [1,1,0,0,0,0|2,0,0]=4 2947 B5R0.1 O=C(O)CCBr Amb2685479 [1,1,0,0,0,0|1,0,0]=3 2948 B5R0.1 O=C(O)CCCl Amb5395408 [1,1,0,0,0,0|1,0,0]=3 2949 B5R0.1 O=C(O)CCF Amb10603694 [1,1,0,0,0,0|1,0,0]=3 2950 B5R0.1 O=C(O)CCI Amb2688882 [1,1,0,0,0,0|1,0,0]=3 2951 B5R0.1 O=C(O)CCO Amb2688785 [1,1,0,0,0,0|0,1,0]=3 2952 B5R0.1 O=C(O)CCS Amb6608916 [1,1,0,0,0,0|0,0,0]=2 2953 B5R0.1 O=C(O)CNO Amb24120360 [1,1,0,0,0,0|1,1,0]=4 2954 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,1,0,0,0,0|0,0,2]=4 2955 B5R0.1 O=C(S)CCCl Amb27461454 [1,1,0,0,0,0|1,0,0]=3 2956 B5R0.1 O=C([O-])CCO Amb22055495 [1,1,0,0,0,0|0,1,0]=3 2957 B5R0.1 O=C([O-])NCCl Amb27777248 [1,1,0,0,0,0|2,0,0]=4 2958 B5R0.1 O=CCB(O)O Amb27449470 [1,1,0,0,0,0|1,1,0]=4 2959 B5R0.1 O=CCC(=O)O Amb22169407 [1,1,0,0,0,0|0,1,1]=4 2960 B5R0.1 O=CCC(=O)[Na] Amb27949540 [1,1,0,0,0,0|0,1,1]=4 2961 B5R0.1 O=CCC(Cl)Cl Amb27749867 [1,1,0,0,0,0|1,0,0]=3 2962 B5R0.1 O=CCC(F)F Amb27234494 [1,1,0,0,0,0|1,0,0]=3 2963 B5R0.1 O=CC[N+](=O)[O-] Amb28049659 [1,1,0,0,0,0|1,1,0]=4 2964 B5R0.1 O=S(Cl)CCCl Amb26494051 [1,1,0,0,0,0|2,0,0]=4 2965 B5R0.1 O=S(Cl)CCF Amb32720386 [1,1,0,0,0,0|2,0,0]=4 2966 B5R0.1 O=S(Cl)CCO Amb32720404 [1,1,0,0,0,0|1,1,0]=4 2967 B5R0.1 O=S(O)CCO Amb25937057 [1,1,0,0,0,0|1,1,0]=4 2968 B5R0.1 O=S([O-])CCCl Amb27639192 [1,1,0,0,0,0|2,0,0]=4 2969 B5R0.1 O=S([O-])CCF Amb27213259 [1,1,0,0,0,0|2,0,0]=4 2970 B5R0.1 O=S([O-])CCO Amb32754124 [1,1,0,0,0,0|1,1,0]=4 2971 B5R0.1 O=[N+]([O-])CCBr Amb25965752 [1,1,0,0,0,0|2,0,0]=4 2972 B5R0.1 O=[N+]([O-])CCCl Amb28381478 [1,1,0,0,0,0|2,0,0]=4 2973 B5R0.1 O=[N+]([O-])CCF Amb17674352 [1,1,0,0,0,0|2,0,0]=4 2974 B5R0.1 O=[N+]([O-])CCO Amb3940447 [1,1,0,0,0,0|1,1,0]=4 2975 B5R0.1 O=[N+]([O-])CCS Amb26620894 [1,1,0,0,0,0|1,0,0]=3 2976 B5R0.1 OC(O)CCS Amb25746150 [1,1,0,0,0,0|0,0,2]=4 2977 B5R0.1 SCC=C(Cl)Cl Amb35719516 [1,1,0,0,0,0|1,0,1]=4 2978 B5R0.1 [C-]#[N+]CC(C)C Amb22900913 [1,1,0,0,0,0|2,0,0]=4 2979 B5R0.3 C#CC(C)CC Amb22229366 [1,1,0,0,0,0|1,0,1]=4 2980 B5R0.3 C#CC(Cl)CC Amb28398182 [1,1,0,0,0,0|1,0,1]=4 2981 B5R0.3 C#CC(N)CC Amb26316205 [1,1,0,0,0,0|1,0,1]=4 2982 B5R0.3 C#CC(N)CC Amb33164073 [1,1,0,0,0,0|1,0,1]=4 2983 B5R0.3 C#CC(O)CC Amb2721728 [1,1,0,0,0,0|1,0,1]=4 2984 B5R0.3 C#C[C@@H](C)CC Amb28202885 [1,1,0,0,0,0|1,0,1]=4 2985 B5R0.3 C#C[C@@H](N)CC Amb27837716 [1,1,0,0,0,0|1,0,1]=4 2986 B5R0.3 C=C(C=O)CC Amb17940102 [1,1,0,0,0,0|0,0,1]=3 2987 B5R0.3 C=C(C=O)OC Amb27863725 [1,1,0,0,0,0|0,1,1]=4 2988 B5R0.3 C=C(CCl)SC Amb27810808 [1,1,0,0,0,0|1,0,1]=4 2989 B5R0.3 C=CC(=C)CC Amb28141349 [1,1,0,0,0,0|1,0,1]=4 2990 B5R0.3 C=CC(=O)CC Amb3940490 [1,1,0,0,0,0|1,0,1]=4 2991 B5R0.3 C=CC(Br)C=O Amb27477894 [1,1,0,0,0,0|0,0,2]=4 2992 B5R0.3 C=CC(Br)CBr Amb26649699 [1,1,0,0,0,0|2,0,0]=4 2993 B5R0.3 C=CC(Br)CO Amb25888060 [1,1,0,0,0,0|1,1,0]=4 2994 B5R0.3 C=CC(C)C=O Amb25737956 [1,1,0,0,0,0|0,0,2]=4 2995 B5R0.3 C=CC(C)CBr Amb25310976 [1,1,0,0,0,0|2,0,0]=4 2996 B5R0.3 C=CC(C)CC Amb8513436 [1,1,0,0,0,0|1,0,0]=3 2997 B5R0.3 C=CC(C)CCl Amb25917438 [1,1,0,0,0,0|2,0,0]=4 2998 B5R0.3 C=CC(C)CO Amb22347861 [1,1,0,0,0,0|1,1,0]=4 2999 B5R0.3 C=CC(C)NC Amb33212401 [1,1,0,0,0,0|1,0,1]=4 3000 B5R0.3 C=CC(C)NC Amb33530542 [1,1,0,0,0,0|1,0,1]=4 3001 B5R0.3 C=CC(Cl)C=O Amb27477543 [1,1,0,0,0,0|0,0,2]=4 3002 B5R0.3 C=CC(Cl)CCl Amb3940257 [1,1,0,0,0,0|2,0,0]=4 3003 B5R0.3 C=CC(Cl)CO Amb26946125 [1,1,0,0,0,0|1,1,0]=4 3004 B5R0.3 C=CC(F)CN Amb26476565 [1,1,0,0,0,0|2,0,0]=4 3005 B5R0.3 C=CC(I)CO Amb28291610 [1,1,0,0,0,0|1,1,0]=4 3006 B5R0.3 C=CC(N)CC Amb26349978 [1,1,0,0,0,0|1,0,0]=3 3007 B5R0.3 C=CC(N)CC Amb31291608 [1,1,0,0,0,0|1,0,0]=3 3008 B5R0.3 C=CC(N)CF Amb27593895 [1,1,0,0,0,0|2,0,0]=4 3009 B5R0.3 C=CC(N)CO Amb19374935 [1,1,0,0,0,0|1,1,0]=4 3010 B5R0.3 C=CC(N)CO Amb28555332 [1,1,0,0,0,0|1,1,0]=4 3011 B5R0.3 C=CC(N)CS Amb18120558 [1,1,0,0,0,0|1,0,0]=3 3012 B5R0.3 C=CC(O)CBr Amb10808128 [1,1,0,0,0,0|2,0,0]=4 3013 B5R0.3 C=CC(O)CC Amb3940382 [1,1,0,0,0,0|1,0,0]=3 3014 B5R0.3 C=CC(O)CCl Amb17593108 [1,1,0,0,0,0|2,0,0]=4 3015 B5R0.3 C=CC(O)CF Amb33376917 [1,1,0,0,0,0|2,0,0]=4 3016 B5R0.3 C=CC(O)CN Amb8630112 [1,1,0,0,0,0|2,0,0]=4 3017 B5R0.3 C=CC(O)CO Amb17610151 [1,1,0,0,0,0|1,1,0]=4 3018 B5R0.3 C=CC(S)CO Amb27960052 [1,1,0,0,0,0|1,1,0]=4 3019 B5R0.3 C=CN(C)CC Amb27242626 [1,1,0,0,0,0|2,0,0]=4 3020 B5R0.3 C=C[C@@H](N)CO Amb19886656 [1,1,0,0,0,0|1,1,0]=4 3021 B5R0.3 C=C[C@@H](N)CO Amb27247092 [1,1,0,0,0,0|1,1,0]=4 3022 B5R0.3 C=C[C@@H](O)CC Amb27813799 [1,1,0,0,0,0|1,0,0]=3 3023 B5R0.3 C=C[C@@H](O)CN Amb27837717 [1,1,0,0,0,0|2,0,0]=4 3024 B5R0.3 C=C[C@H](C)CBr Amb27650555 [1,1,0,0,0,0|2,0,0]=4 3025 B5R0.3 C=C[C@H](C)CO Amb27470174 [1,1,0,0,0,0|1,1,0]=4 3026 B5R0.3 C=C[C@H](N)CO Amb25147462 [1,1,0,0,0,0|1,1,0]=4 3027 B5R0.3 C=C[C@H](N)CO Amb8631419 [1,1,0,0,0,0|1,1,0]=4 3028 B5R0.3 C=C[C@H](O)CO Amb19888350 [1,1,0,0,0,0|1,1,0]=4 3029 B5R0.3 CC(C#N)C=O Amb9669144 [1,1,0,0,0,0|1,0,1]=4 3030 B5R0.3 CC(C=O)C=O Amb17593026 [1,1,0,0,0,0|0,1,1]=4 3031 B5R0.3 CC(C=O)CF Amb24638421 [1,1,0,0,0,0|1,0,0]=3 3032 B5R0.3 CC(C=O)O[SiH3] Amb28284225 [1,1,0,0,0,0|0,2,0]=4 3033 B5R0.3 CC(CN)CS Amb18251064 [1,1,0,0,0,0|1,0,1]=4 3034 B5R0.3 CC(CO)CS Amb19375381 [1,1,0,0,0,0|0,0,2]=4 3035 B5R0.3 CC(CO)N=O Amb28365917 [1,1,0,0,0,0|1,1,0]=4 3036 B5R0.3 CC(CS)NN Amb18640585 [1,1,0,0,0,0|2,0,0]=4 3037 B5R0.3 CCC(=O)C=O Amb22228532 [1,1,0,0,0,0|0,0,1]=3 3038 B5R0.3 CCC(Br)C#N Amb18124592 [1,1,0,0,0,0|1,0,1]=4 3039 B5R0.3 CCC(Br)C=O Amb18124003 [1,1,0,0,0,0|0,0,0]=2 3040 B5R0.3 CCC(Br)CBr Amb8515357 [1,1,0,0,0,0|1,0,1]=4 3041 B5R0.3 CCC(Br)CC Amb3940200 [1,1,0,0,0,0|1,0,1]=4 3042 B5R0.3 CCC(Br)CN Amb28458424 [1,1,0,0,0,0|1,0,1]=4 3043 B5R0.3 CCC(Br)CO Amb27637663 [1,1,0,0,0,0|0,0,2]=4 3044 B5R0.3 CCC(C)C#N Amb6740515 [1,1,0,0,0,0|1,0,1]=4 3045 B5R0.3 CCC(C)C=O Amb3939899 [1,1,0,0,0,0|0,0,0]=2 3046 B5R0.3 CCC(C)CBr Amb2720734 [1,1,0,0,0,0|1,0,1]=4 3047 B5R0.3 CCC(C)CCl Amb3940712 [1,1,0,0,0,0|1,0,1]=4 3048 B5R0.3 CCC(C)CI Amb22227967 [1,1,0,0,0,0|1,0,1]=4 3049 B5R0.3 CCC(C)CN Amb2725537 [1,1,0,0,0,0|1,0,1]=4 3050 B5R0.3 CCC(C)CN Amb28555320 [1,1,0,0,0,0|1,0,1]=4 3051 B5R0.3 CCC(C)CO Amb3939046 [1,1,0,0,0,0|0,0,2]=4 3052 B5R0.3 CCC(C)CS Amb8513832 [1,1,0,0,0,0|0,1,1]=4 3053 B5R0.3 CCC(C)NC Amb10609216 [1,1,0,0,0,0|1,0,1]=4 3054 B5R0.3 CCC(C)NC Amb9713591 [1,1,0,0,0,0|1,0,1]=4 3055 B5R0.3 CCC(C)NN Amb33141003 [1,1,0,0,0,0|2,0,0]=4 3056 B5R0.3 CCC(C)NN Amb6248241 [1,1,0,0,0,0|2,0,0]=4 3057 B5R0.3 CCC(C)NN Amb9701815 [1,1,0,0,0,0|2,0,0]=4 3058 B5R0.3 CCC(C)NN Amb9701816 [1,1,0,0,0,0|2,0,0]=4 3059 B5R0.3 CCC(C)OC Amb10069005 [1,1,0,0,0,0|0,1,1]=4 3060 B5R0.3 CCC(C)ON Amb26449467 [1,1,0,0,0,0|2,0,0]=4 3061 B5R0.3 CCC(C)ON Amb32712096 [1,1,0,0,0,0|2,0,0]=4 3062 B5R0.3 CCC(C)SC Amb22043308 [1,1,0,0,0,0|0,0,1]=3 3063 B5R0.3 CCC(C)[Mg]Br Amb22733176 [1,1,0,0,0,0|2,0,0]=4 3064 B5R0.3 CCC(Cl)C#N Amb27452133 [1,1,0,0,0,0|1,0,1]=4 3065 B5R0.3 CCC(Cl)C=O Amb18122610 [1,1,0,0,0,0|0,0,0]=2 3066 B5R0.3 CCC(Cl)CF Amb28200727 [1,1,0,0,0,0|1,0,1]=4 3067 B5R0.3 CCC(Cl)CN Amb28461612 [1,1,0,0,0,0|1,0,1]=4 3068 B5R0.3 CCC(Cl)CO Amb22011826 [1,1,0,0,0,0|0,0,2]=4 3069 B5R0.3 CCC(Cl)CS Amb28366326 [1,1,0,0,0,0|0,1,1]=4 3070 B5R0.3 CCC(Cl)OC Amb28121174 [1,1,0,0,0,0|0,1,1]=4 3071 B5R0.3 CCC(Cl)SC Amb27650678 [1,1,0,0,0,0|0,0,1]=3 3072 B5R0.3 CCC(F)CBr Amb24525153 [1,1,0,0,0,0|1,0,1]=4 3073 B5R0.3 CCC(F)CC Amb24372682 [1,1,0,0,0,0|1,0,1]=4 3074 B5R0.3 CCC(F)CCl Amb27874078 [1,1,0,0,0,0|1,0,1]=4 3075 B5R0.3 CCC(F)CF Amb28325139 [1,1,0,0,0,0|1,0,1]=4 3076 B5R0.3 CCC(F)CN Amb20622434 [1,1,0,0,0,0|1,0,1]=4 3077 B5R0.3 CCC(F)CN Amb28314433 [1,1,0,0,0,0|1,0,1]=4 3078 B5R0.3 CCC(F)CO Amb27454301 [1,1,0,0,0,0|0,0,2]=4 3079 B5R0.3 CCC(I)C#N Amb27772239 [1,1,0,0,0,0|1,0,1]=4 3080 B5R0.3 CCC(I)CC Amb17673918 [1,1,0,0,0,0|1,0,1]=4 3081 B5R0.3 CCC(N)C#N Amb10203825 [1,1,0,0,0,0|1,0,1]=4 3082 B5R0.3 CCC(N)C#N Amb1136995 [1,1,0,0,0,0|1,0,1]=4 3083 B5R0.3 CCC(N)CBr Amb26491532 [1,1,0,0,0,0|1,0,1]=4 3084 B5R0.3 CCC(N)CC Amb3939864 [1,1,0,0,0,0|1,0,1]=4 3085 B5R0.3 CCC(N)CCl Amb28313277 [1,1,0,0,0,0|1,0,1]=4 3086 B5R0.3 CCC(N)CF Amb26601671 [1,1,0,0,0,0|1,0,1]=4 3087 B5R0.3 CCC(N)CF Amb32652398 [1,1,0,0,0,0|1,0,1]=4 3088 B5R0.3 CCC(N)CN Amb33534078 [1,1,0,0,0,0|1,0,1]=4 3089 B5R0.3 CCC(N)CN Amb9380664 [1,1,0,0,0,0|1,0,1]=4 3090 B5R0.3 CCC(N)CO Amb9703106 [1,1,0,0,0,0|0,0,2]=4 3091 B5R0.3 CCC(N)CS Amb18122513 [1,1,0,0,0,0|0,1,1]=4 3092 B5R0.3 CCC(N)CS Amb32693424 [1,1,0,0,0,0|0,1,1]=4 3093 B5R0.3 CCC(N)[SH]=O Amb28241197 [1,1,0,0,0,0|1,0,0]=3 3094 B5R0.3 CCC(O)C#N Amb9270812 [1,1,0,0,0,0|1,0,1]=4 3095 B5R0.3 CCC(O)CBr Amb10844729 [1,1,0,0,0,0|1,0,1]=4 3096 B5R0.3 CCC(O)CC Amb4605838 [1,1,0,0,0,0|1,0,1]=4 3097 B5R0.3 CCC(O)CCl Amb33545087 [1,1,0,0,0,0|1,0,1]=4 3098 B5R0.3 CCC(O)CF Amb25810601 [1,1,0,0,0,0|1,0,1]=4 3099 B5R0.3 CCC(O)CN Amb2684362 [1,1,0,0,0,0|1,0,1]=4 3100 B5R0.3 CCC(O)CN Amb33526499 [1,1,0,0,0,0|1,0,1]=4 3101 B5R0.3 CCC(O)CO Amb8517157 [1,1,0,0,0,0|0,0,2]=4 3102 B5R0.3 CCC(O)CS Amb26546731 [1,1,0,0,0,0|0,1,1]=4 3103 B5R0.3 CCC(O)NC Amb28315667 [1,1,0,0,0,0|1,0,1]=4 3104 B5R0.3 CCC(S)C#N Amb27457768 [1,1,0,0,0,0|1,0,1]=4 3105 B5R0.3 CCC(S)CC Amb7784704 [1,1,0,0,0,0|1,0,1]=4 3106 B5R0.3 CCC(S)CCl Amb27216986 [1,1,0,0,0,0|1,0,1]=4 3107 B5R0.3 CCC(S)CN Amb18908249 [1,1,0,0,0,0|1,0,1]=4 3108 B5R0.3 CCC(S)CN Amb33621229 [1,1,0,0,0,0|1,0,1]=4 3109 B5R0.3 CCC(S)CO Amb27211706 [1,1,0,0,0,0|0,0,2]=4 3110 B5R0.3 CCC(S)CS Amb8393144 [1,1,0,0,0,0|0,1,1]=4 3111 B5R0.3 CCN(C)C=O Amb20627285 [1,1,0,0,0,0|1,0,0]=3 3112 B5R0.3 CCN(C)N=O Amb22055856 [1,1,0,0,0,0|2,0,0]=4 3113 B5R0.3 CCN(N)C=O Amb24428031 [1,1,0,0,0,0|1,0,0]=3 3114 B5R0.3 CC[C@@H](Br)CO Amb27863418 [1,1,0,0,0,0|0,0,2]=4 3115 B5R0.3 CC[C@@H](C)C#N Amb27835114 [1,1,0,0,0,0|1,0,1]=4 3116 B5R0.3 CC[C@@H](C)C=O Amb27759282 [1,1,0,0,0,0|0,0,0]=2 3117 B5R0.3 CC[C@@H](C)CBr Amb22800948 [1,1,0,0,0,0|1,0,1]=4 3118 B5R0.3 CC[C@@H](C)CN Amb22800554 [1,1,0,0,0,0|1,0,1]=4 3119 B5R0.3 CC[C@@H](C)CO Amb22799907 [1,1,0,0,0,0|0,0,2]=4 3120 B5R0.3 CC[C@@H](C)NC Amb27253380 [1,1,0,0,0,0|1,0,1]=4 3121 B5R0.3 CC[C@@H](N)C#N Amb25024729 [1,1,0,0,0,0|1,0,1]=4 3122 B5R0.3 CC[C@@H](N)C#N Amb27949151 [1,1,0,0,0,0|1,0,1]=4 3123 B5R0.3 CC[C@@H](N)CF Amb33624248 [1,1,0,0,0,0|1,0,1]=4 3124 B5R0.3 CC[C@@H](N)CO Amb3940043 [1,1,0,0,0,0|0,0,2]=4 3125 B5R0.3 CC[C@@H](O)CI Amb25146583 [1,1,0,0,0,0|1,0,1]=4 3126 B5R0.3 CC[C@@H](O)CN Amb22232086 [1,1,0,0,0,0|1,0,1]=4 3127 B5R0.3 CC[C@@H](O)CO Amb20241381 [1,1,0,0,0,0|0,0,2]=4 3128 B5R0.3 CC[C@@H](O)CS Amb32679657 [1,1,0,0,0,0|0,1,1]=4 3129 B5R0.3 CC[C@H](C)C#N Amb22351647 [1,1,0,0,0,0|1,0,1]=4 3130 B5R0.3 CC[C@H](C)C=O Amb27837733 [1,1,0,0,0,0|0,0,0]=2 3131 B5R0.3 CC[C@H](C)CBr Amb22351674 [1,1,0,0,0,0|1,0,1]=4 3132 B5R0.3 CC[C@H](C)CCl Amb25728424 [1,1,0,0,0,0|1,0,1]=4 3133 B5R0.3 CC[C@H](C)CI Amb8515352 [1,1,0,0,0,0|1,0,1]=4 3134 B5R0.3 CC[C@H](C)CN Amb3939834 [1,1,0,0,0,0|1,0,1]=4 3135 B5R0.3 CC[C@H](C)CO Amb10844611 [1,1,0,0,0,0|0,0,2]=4 3136 B5R0.3 CC[C@H](C)NC Amb28049633 [1,1,0,0,0,0|1,0,1]=4 3137 B5R0.3 CC[C@H](N)C#N Amb25887559 [1,1,0,0,0,0|1,0,1]=4 3138 B5R0.3 CC[C@H](N)C#N Amb26415160 [1,1,0,0,0,0|1,0,1]=4 3139 B5R0.3 CC[C@H](N)C=O Amb27460588 [1,1,0,0,0,0|0,0,0]=2 3140 B5R0.3 CC[C@H](N)CO Amb3939341 [1,1,0,0,0,0|0,0,2]=4 3141 B5R0.3 CC[C@H](O)CCl Amb27206742 [1,1,0,0,0,0|1,0,1]=4 3142 B5R0.3 CC[C@H](O)CF Amb27979190 [1,1,0,0,0,0|1,0,1]=4 3143 B5R0.3 CC[C@H](O)CI Amb8388903 [1,1,0,0,0,0|1,0,1]=4 3144 B5R0.3 CC[C@H](O)CN Amb23385250 [1,1,0,0,0,0|1,0,1]=4 3145 B5R0.3 CC[C@H](O)CN Amb8630398 [1,1,0,0,0,0|1,0,1]=4 3146 B5R0.3 CC[C@H](O)CO Amb20241380 [1,1,0,0,0,0|0,0,2]=4 3147 B5R0.3 CC[C@H](O)CS Amb32679670 [1,1,0,0,0,0|0,1,1]=4 3148 B5R0.3 CC\C(C)=C\Cl Amb27848092 [1,1,0,0,0,0|1,0,1]=4 3149 B5R0.3 CN(C=O)CO Amb27253133 [1,1,0,0,0,0|1,1,0]=4 3150 B5R0.3 CNC(C)CN Amb33266033 [1,1,0,0,0,0|2,0,0]=4 3151 B5R0.3 CNC(C)CN Amb33529517 [1,1,0,0,0,0|2,0,0]=4 3152 B5R0.3 CNC(C)CO Amb32666213 [1,1,0,0,0,0|1,0,1]=4 3153 B5R0.3 CNC(C)CO Amb9359998 [1,1,0,0,0,0|1,0,1]=4 3154 B5R0.3 CNC(C)CS Amb28397844 [1,1,0,0,0,0|1,1,0]=4 3155 B5R0.3 CN[C@@H](C)CN Amb28316231 [1,1,0,0,0,0|2,0,0]=4 3156 B5R0.3 CN[C@@H](C)CO Amb26642150 [1,1,0,0,0,0|1,0,1]=4 3157 B5R0.3 CN[C@@H](C)CO Amb32652325 [1,1,0,0,0,0|1,0,1]=4 3158 B5R0.3 CN[C@H](C)CO Amb26440136 [1,1,0,0,0,0|1,0,1]=4 3159 B5R0.3 CN[C@H](C)CO Amb32652448 [1,1,0,0,0,0|1,0,1]=4 3160 B5R0.3 COC(=O)C=O Amb29083438 [1,1,0,0,0,0|0,1,1]=4 3161 B5R0.3 COC(=O)C=O Amb8384463 [1,1,0,0,0,0|0,1,1]=4 3162 B5R0.3 COC(C)C=O Amb27875195 [1,1,0,0,0,0|0,1,0]=3 3163 B5R0.3 COC(C)CBr Amb24711458 [1,1,0,0,0,0|1,1,0]=4 3164 B5R0.3 COC(C)CCl Amb28315643 [1,1,0,0,0,0|1,1,0]=4 3165 B5R0.3 COC(C)CI Amb24371608 [1,1,0,0,0,0|1,1,0]=4 3166 B5R0.3 COC(C)CN Amb2140564 [1,1,0,0,0,0|1,1,0]=4 3167 B5R0.3 COC(C)CN Amb927898 [1,1,0,0,0,0|1,1,0]=4 3168 B5R0.3 COC(C)CO Amb19517078 [1,1,0,0,0,0|0,1,1]=4 3169 B5R0.3 COC(C)CS Amb25887604 [1,1,0,0,0,0|0,2,0]=4 3170 B5R0.3 COC(Cl)CCl Amb17689392 [1,1,0,0,0,0|1,1,0]=4 3171 B5R0.3 CON(C)C=O Amb22234045 [1,1,0,0,0,0|1,1,0]=4 3172 B5R0.3 CO[C@@H](C)C=O Amb28121215 [1,1,0,0,0,0|0,1,0]=3 3173 B5R0.3 CO[C@@H](C)CN Amb22746816 [1,1,0,0,0,0|1,1,0]=4 3174 B5R0.3 CO[C@@H](C)CN Amb27613930 [1,1,0,0,0,0|1,1,0]=4 3175 B5R0.3 CO[C@@H](C)CO Amb8515772 [1,1,0,0,0,0|0,1,1]=4 3176 B5R0.3 CO[C@H](C)C=O Amb28284155 [1,1,0,0,0,0|0,1,0]=3 3177 B5R0.3 CO[C@H](C)CN Amb26959026 [1,1,0,0,0,0|1,1,0]=4 3178 B5R0.3 CO[C@H](C)CN Amb33801901 [1,1,0,0,0,0|1,1,0]=4 3179 B5R0.3 CO[C@H](C)CO Amb10603218 [1,1,0,0,0,0|0,1,1]=4 3180 B5R0.3 CSC(=O)C=O Amb28284177 [1,1,0,0,0,0|0,0,1]=3 3181 B5R0.3 CSC(=O)CN Amb27482013 [1,1,0,0,0,0|1,0,1]=4 3182 B5R0.3 CSC(C)C#N Amb28049569 [1,1,0,0,0,0|1,0,1]=4 3183 B5R0.3 CSC(C)C=O Amb27454927 [1,1,0,0,0,0|0,0,0]=2 3184 B5R0.3 CSC(C)CN Amb17485956 [1,1,0,0,0,0|1,0,0]=3 3185 B5R0.3 CSC(C)CO Amb24438636 [1,1,0,0,0,0|0,0,1]=3 3186 B5R0.3 CSC(Cl)C=O Amb27233402 [1,1,0,0,0,0|0,0,0]=2 3187 B5R0.3 CSC(F)CO Amb28428675 [1,1,0,0,0,0|0,0,1]=3 3188 B5R0.3 CS\C(C)=C\Cl Amb27776645 [1,1,0,0,0,0|1,0,1]=4 3189 B5R0.3 C[C@@H](C=O)CBr Amb28200669 [1,1,0,0,0,0|1,0,0]=3 3190 B5R0.3 C[C@@H](C=O)CO Amb27455063 [1,1,0,0,0,0|0,1,0]=3 3191 B5R0.3 C\C(=C/Cl)CS Amb24391502 [1,1,0,0,0,0|1,0,1]=4 3192 B5R0.3 C\C=C(/Br)C=O Amb24478125 [1,1,0,0,0,0|0,0,2]=4 3193 B5R0.3 C\C=C(/C)C=O Amb30526844 [1,1,0,0,0,0|0,0,2]=4 3194 B5R0.3 C\C=C(/C)CC Amb26540266 [1,1,0,0,0,0|1,0,1]=4 3195 B5R0.3 C\C=C(/Cl)C=O Amb18122386 [1,1,0,0,0,0|0,0,2]=4 3196 B5R0.3 C\C=C(/I)C=O Amb28049947 [1,1,0,0,0,0|0,0,2]=4 3197 B5R0.3 C\C=C(\Br)C=O Amb18124612 [1,1,0,0,0,0|0,0,2]=4 3198 B5R0.3 C\C=C(\C)C=O Amb24333046 [1,1,0,0,0,0|0,0,2]=4 3199 B5R0.3 C\C=C(\C)CC Amb25332651 [1,1,0,0,0,0|1,0,1]=4 3200 B5R0.3 N#CC(Cl)C=O Amb21963537 [1,1,0,0,0,0|1,0,1]=4 3201 B5R0.3 N=CC(Br)C=O Amb28141456 [1,1,0,0,0,0|1,0,1]=4 3202 B5R0.3 NC(C=O)C=O Amb22751007 [1,1,0,0,0,0|0,1,1]=4 3203 B5R0.3 NC(C=O)CS Amb27626007 [1,1,0,0,0,0|0,0,0]=2 3204 B5R0.3 NC(CS)CS Amb24120335 [1,1,0,0,0,0|0,1,1]=4 3205 B5R0.3 NCC(N)CS Amb27167387 [1,1,0,0,0,0|1,0,1]=4 3206 B5R0.3 NCC(O)CS Amb35672841 [1,1,0,0,0,0|1,0,1]=4 3207 B5R0.3 NCC(S)CS Amb24761410 [1,1,0,0,0,0|1,0,1]=4 3208 B5R0.3 NCC(S)CS Amb31031116 [1,1,0,0,0,0|1,0,1]=4 3209 B5R0.3 NC[C@H](F)C=O Amb27204919 [1,1,0,0,0,0|1,0,0]=3 3210 B5R0.3 N[C@H](C=O)CO Amb27170308 [1,1,0,0,0,0|0,1,0]=3 3211 B5R0.3 O=CC(=O)CO Amb17593031 [1,1,0,0,0,0|0,1,1]=4 3212 B5R0.3 O=CC(Br)C=O Amb2455922 [1,1,0,0,0,0|0,1,1]=4 3213 B5R0.3 O=CC(Br)CBr Amb17670591 [1,1,0,0,0,0|1,0,0]=3 3214 B5R0.3 O=CC(Br)CCl Amb18647566 [1,1,0,0,0,0|1,0,0]=3 3215 B5R0.3 O=CC(Cl)C=O Amb8515721 [1,1,0,0,0,0|0,1,1]=4 3216 B5R0.3 O=CC(Cl)CO Amb17593122 [1,1,0,0,0,0|0,1,0]=3 3217 B5R0.3 O=CC(F)C=O Amb22230729 [1,1,0,0,0,0|0,1,1]=4 3218 B5R0.3 O=CC(F)CF Amb28051572 [1,1,0,0,0,0|1,0,0]=3 3219 B5R0.3 O=CC(F)CO Amb28043006 [1,1,0,0,0,0|0,1,0]=3 3220 B5R0.3 O=CC(I)C=O Amb24548139 [1,1,0,0,0,0|0,1,1]=4 3221 B5R0.3 O=CC(O)C=O Amb17615780 [1,1,0,0,0,0|0,1,1]=4 3222 B5R0.3 O=CC(O)CO Amb3940759 [1,1,0,0,0,0|0,1,0]=3 3223 B5R0.3 O=CC(S)CO Amb4020723 [1,1,0,0,0,0|0,1,0]=3 3224 B5R0.3 O=C[C@@H](O)CF Amb28247090 [1,1,0,0,0,0|1,0,0]=3 3225 B5R0.3 O=C[C@@H](O)CO Amb16232009 [1,1,0,0,0,0|0,1,0]=3 3226 B5R0.3 O=C[C@H](O)CO Amb20242417 [1,1,0,0,0,0|0,1,0]=3 3227 B5R0.3 O=NC(Cl)CO Amb27232983 [1,1,0,0,0,0|1,1,0]=4 3228 B5R0.3 OC(CF)CS Amb32679383 [1,1,0,0,0,0|1,0,1]=4 3229 B5R0.3 OC(CS)CCl Amb27965116 [1,1,0,0,0,0|1,0,1]=4 3230 B5R0.3 OCC(Cl)CS Amb17593329 [1,1,0,0,0,0|0,0,2]=4 3231 B5R0.3 OCC(O)CS Amb8395100 [1,1,0,0,0,0|0,0,2]=4 3232 B5R0.3 OCC(S)CS Amb8513135 [1,1,0,0,0,0|0,0,2]=4 3233 B5R0.3 OC[C@@H](O)CS Amb25943783 [1,1,0,0,0,0|0,0,2]=4 3234 B5R0.3 OC[C@@H](S)CS Amb26887679 [1,1,0,0,0,0|0,0,2]=4 3235 B5R0.3 OC[C@H](O)CS Amb26635114 [1,1,0,0,0,0|0,0,2]=4 3236 B5R0.3 OC[C@H](S)CS Amb26487293 [1,1,0,0,0,0|0,0,2]=4 3237 B5R0.3 SCC(S)CS Amb26017861 [1,1,0,0,0,0|0,1,1]=4 3238 B5R0.3 SC\C(Cl)=C\Cl Amb28139714 [1,1,0,0,0,0|1,0,1]=4 3239 B5R0.3 [C-]#[N+]C(C)CC Amb2235426 [1,1,0,0,0,0|2,0,0]=4 3240 B5R0.3 [CH2-]C(CC)CC Amb24117230 [1,1,0,0,0,0|1,0,1]=4 3241 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [0,2,0,0,0,0|1,0,1]=4 3242 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [0,2,0,0,0,0|1,0,1]=4 3243 B7R0.2 C=C(Br)C[C@@H](C)C=O Amb28381143 [0,2,0,0,0,0|1,0,1]=4 3244 B7R0.2 C=C(C)CC(C)C=O Amb18641711 [0,2,0,0,0,0|1,0,0]=3 3245 B7R0.2 C=C(C)CC(C)CC Amb22228340 [0,2,0,0,0,0|2,0,0]=4 3246 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [0,2,0,0,0,0|1,0,1]=4 3247 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [0,2,0,0,0,0|1,0,1]=4 3248 B7R0.2 C=CC(Br)CC(=C)C Amb27231804 [0,2,0,0,0,0|2,0,0]=4 3249 B7R0.2 C=CC(Br)CC(C)C Amb27984920 [0,2,0,0,0,0|2,0,0]=4 3250 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [0,2,0,0,0,0|1,0,1]=4 3251 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [0,2,0,0,0,0|1,0,1]=4 3252 B7R0.2 C=CC(C)CC(C)C Amb22229087 [0,2,0,0,0,0|2,0,0]=4 3253 B7R0.2 C=CC(C)CC(N)=O Amb27168118 [0,2,0,0,0,0|1,0,1]=4 3254 B7R0.2 C=CC(C)CN(C)C Amb27837809 [0,2,0,0,0,0|2,0,0]=4 3255 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [0,2,0,0,0,0|1,0,1]=4 3256 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [0,2,0,0,0,0|1,0,1]=4 3257 B7R0.2 C=CC(N)CC(C)C Amb25743094 [0,2,0,0,0,0|2,0,0]=4 3258 B7R0.2 C=CC(N)CN(C)C Amb27224710 [0,2,0,0,0,0|2,0,0]=4 3259 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [0,2,0,0,0,0|1,0,1]=4 3260 B7R0.2 C=CC(O)CC(C)C Amb24532138 [0,2,0,0,0,0|2,0,0]=4 3261 B7R0.2 C=CC(O)CC(C)N Amb35583445 [0,2,0,0,0,0|2,0,0]=4 3262 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [0,2,0,0,0,0|1,0,1]=4 3263 B7R0.2 C=C[C@@H](C)C[C@@H](C)O Amb28138655 [0,2,0,0,0,0|2,0,0]=4 3264 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [0,2,0,0,0,0|1,0,1]=4 3265 B7R0.2 C=C[C@@H](O)CC(C)C Amb28429716 [0,2,0,0,0,0|2,0,0]=4 3266 B7R0.2 C=C[C@@H](O)C[C@H](C)O Amb28318465 [0,2,0,0,0,0|2,0,0]=4 3267 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [0,2,0,0,0,0|1,0,1]=4 3268 B7R0.2 C=C[C@H](C)C[C@H](C)O Amb27221624 [0,2,0,0,0,0|2,0,0]=4 3269 B7R0.2 C=C[C@H](N)CC(C)C Amb27202733 [0,2,0,0,0,0|2,0,0]=4 3270 B7R0.2 C=C[C@H](O)CC(=C)C Amb27854005 [0,2,0,0,0,0|2,0,0]=4 3271 B7R0.2 C=C[C@H](O)CC(C)C Amb28366037 [0,2,0,0,0,0|2,0,0]=4 3272 B7R0.2 CC(=O)CC(C)C#N Amb18124227 [0,2,0,0,0,0|2,0,0]=4 3273 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [0,2,0,0,0,0|2,0,0]=4 3274 B7R0.2 CC(=O)CC(C)CN Amb18251072 [0,2,0,0,0,0|2,0,0]=4 3275 B7R0.2 CC(=O)CC(N)CO Amb27240210 [0,2,0,0,0,0|2,0,0]=4 3276 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [0,2,0,0,0,0|2,0,0]=4 3277 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [0,2,0,0,0,0|1,0,0]=3 3278 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [0,2,0,0,0,0|2,0,0]=4 3279 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [0,2,0,0,0,0|1,0,0]=3 3280 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [0,2,0,0,0,0|2,0,0]=4 3281 B7R0.2 CC(=O)N[C@H](C)C=O Amb27838347 [0,2,0,0,0,0|2,0,0]=4 3282 B7R0.2 CC(=O)OC(C)C=O Amb18641863 [0,2,0,0,0,0|2,0,0]=4 3283 B7R0.2 CC(=O)O[C@H](C)C=O Amb28422009 [0,2,0,0,0,0|2,0,0]=4 3284 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,2,0,0,0,0|2,0,0]=4 3285 B7R0.2 CC(C#N)CC(=O)[O-] Amb32952895 [0,2,0,0,0,0|2,0,0]=4 3286 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [0,2,0,0,0,0|1,0,1]=4 3287 B7R0.2 CC(C)CC(C)C=O Amb18641813 [0,2,0,0,0,0|1,0,0]=3 3288 B7R0.2 CC(C)CC(O)C=O Amb27250174 [0,2,0,0,0,0|1,0,0]=3 3289 B7R0.2 CC(C)C[C@@H](C)C=O Amb27164638 [0,2,0,0,0,0|1,0,0]=3 3290 B7R0.2 CC(C)C[C@H](N)C=O Amb26851754 [0,2,0,0,0,0|1,0,0]=3 3291 B7R0.2 CC(C)OC(C)C=O Amb25243083 [0,2,0,0,0,0|2,0,0]=4 3292 B7R0.2 CC(C)SC(C)C=O Amb18642905 [0,2,0,0,0,0|2,0,0]=4 3293 B7R0.2 CC(CC(=O)O)NN Amb28346224 [0,2,0,0,0,0|2,0,0]=4 3294 B7R0.2 CC(CC(=O)O)NN Amb33141007 [0,2,0,0,0,0|2,0,0]=4 3295 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [0,2,0,0,0,0|2,0,0]=4 3296 B7R0.2 CC(CF)CC(=O)O Amb25990964 [0,2,0,0,0,0|2,0,0]=4 3297 B7R0.2 CC(CN)CC(=O)O Amb18124263 [0,2,0,0,0,0|2,0,0]=4 3298 B7R0.2 CC(CN)CC(=O)O Amb20669501 [0,2,0,0,0,0|2,0,0]=4 3299 B7R0.2 CC(CN)CC(=O)O Amb32752805 [0,2,0,0,0,0|2,0,0]=4 3300 B7R0.2 CC(CN)CC(N)=O Amb18641899 [0,2,0,0,0,0|2,0,0]=4 3301 B7R0.2 CC(CO)CC(=O)O Amb18198168 [0,2,0,0,0,0|2,0,0]=4 3302 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [0,2,0,0,0,0|2,0,0]=4 3303 B7R0.2 CC(Cl)CN(C)C=O Amb27184558 [0,2,0,0,0,0|2,0,0]=4 3304 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,2,0,0,0,0|1,0,1]=4 3305 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [0,2,0,0,0,0|1,0,1]=4 3306 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [0,2,0,0,0,0|1,0,1]=4 3307 B7R0.2 CCC(C)CC(=N)N Amb10607625 [0,2,0,0,0,0|2,0,0]=4 3308 B7R0.2 CCC(C)CC(=N)N Amb19890168 [0,2,0,0,0,0|2,0,0]=4 3309 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [0,2,0,0,0,0|1,0,0]=3 3310 B7R0.2 CCC(C)CC(=O)O Amb2689581 [0,2,0,0,0,0|1,0,0]=3 3311 B7R0.2 CCC(C)CC(C)=O Amb10608208 [0,2,0,0,0,0|1,0,0]=3 3312 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,2,0,0,0,0|1,0,0]=3 3313 B7R0.2 CCC(C)CC(N)=S Amb26989527 [0,2,0,0,0,0|1,1,0]=4 3314 B7R0.2 CCC(C)CS(=O)Cl Amb32720505 [0,2,0,0,0,0|2,0,0]=4 3315 B7R0.2 CCC(C)CS(=O)[O-] Amb27408549 [0,2,0,0,0,0|2,0,0]=4 3316 B7R0.2 CCC(C)CS(C)=O Amb27837877 [0,2,0,0,0,0|2,0,0]=4 3317 B7R0.2 CCC(C)CS(N)=O Amb32720506 [0,2,0,0,0,0|2,0,0]=4 3318 B7R0.2 CCC(C)C[N+](=O)[O-] Amb25075983 [0,2,0,0,0,0|2,0,0]=4 3319 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [0,2,0,0,0,0|2,0,0]=4 3320 B7R0.2 CCC(C)NC(C)=O Amb3358085 [0,2,0,0,0,0|2,0,0]=4 3321 B7R0.2 CCC(C)NC(N)=O Amb9702507 [0,2,0,0,0,0|2,0,0]=4 3322 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,2,0,0,0,0|2,0,0]=4 3323 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,2,0,0,0,0|2,0,0]=4 3324 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [0,2,0,0,0,0|1,0,0]=3 3325 B7R0.2 CCC(Cl)OC(C)=O Amb27392214 [0,2,0,0,0,0|2,0,0]=4 3326 B7R0.2 CCC(Cl)SC(=O)Cl Amb27945612 [0,2,0,0,0,0|2,0,0]=4 3327 B7R0.2 CCC(Cl)SC(C)=O Amb27407733 [0,2,0,0,0,0|2,0,0]=4 3328 B7R0.2 CCC(N)CC(=O)O Amb1993862 [0,2,0,0,0,0|1,0,0]=3 3329 B7R0.2 CCC(N)CC(=O)O Amb8631361 [0,2,0,0,0,0|1,0,0]=3 3330 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,2,0,0,0,0|1,0,0]=3 3331 B7R0.2 CCC(N)CC(C)=O Amb26895708 [0,2,0,0,0,0|1,0,0]=3 3332 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,2,0,0,0,0|1,0,0]=3 3333 B7R0.2 CCC(N)CC(N)=S Amb28078345 [0,2,0,0,0,0|1,1,0]=4 3334 B7R0.2 CCC(O)CC(=O)O Amb10844270 [0,2,0,0,0,0|1,0,0]=3 3335 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,2,0,0,0,0|1,0,0]=3 3336 B7R0.2 CCC(O)CS(C)=O Amb28457838 [0,2,0,0,0,0|2,0,0]=4 3337 B7R0.2 CCC(O)C[N+](=O)[O-] Amb25136685 [0,2,0,0,0,0|2,0,0]=4 3338 B7R0.2 CCC(O)OC(C)=O Amb28256771 [0,2,0,0,0,0|2,0,0]=4 3339 B7R0.2 CCN(C)CC(=O)O Amb33620688 [0,2,0,0,0,0|2,0,0]=4 3340 B7R0.2 CCN(C)CC(=O)O Amb8428140 [0,2,0,0,0,0|2,0,0]=4 3341 B7R0.2 CCN(C)CC(C)=O Amb8427987 [0,2,0,0,0,0|2,0,0]=4 3342 B7R0.2 CCN(C)CC(C)=O Amb9173327 [0,2,0,0,0,0|2,0,0]=4 3343 B7R0.2 CCN(C)CC(N)=O Amb27639873 [0,2,0,0,0,0|2,0,0]=4 3344 B7R0.2 CCN(O)CC(=O)O Amb28195485 [0,2,0,0,0,0|2,0,0]=4 3345 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,2,0,0,0,0|2,0,0]=4 3346 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [0,2,0,0,0,0|2,0,0]=4 3347 B7R0.2 CCS(=O)CC(N)=O Amb27762121 [0,2,0,0,0,0|2,0,0]=4 3348 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [0,2,0,0,0,0|1,0,0]=3 3349 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [0,2,0,0,0,0|1,0,0]=3 3350 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [0,2,0,0,0,0|1,0,0]=3 3351 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [0,2,0,0,0,0|1,0,0]=3 3352 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,2,0,0,0,0|1,0,0]=3 3353 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [0,2,0,0,0,0|1,0,0]=3 3354 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [0,2,0,0,0,0|1,0,0]=3 3355 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [0,2,0,0,0,0|1,0,0]=3 3356 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [0,2,0,0,0,0|1,0,0]=3 3357 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [0,2,0,0,0,0|1,0,0]=3 3358 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [0,2,0,0,0,0|1,0,1]=4 3359 B7R0.2 CNC(=O)CC(=O)[O-] Amb35747299 [0,2,0,0,0,0|1,0,1]=4 3360 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [0,2,0,0,0,0|1,0,1]=4 3361 B7R0.2 CNC(=S)CC(C)=O Amb24096719 [0,2,0,0,0,0|1,0,1]=4 3362 B7R0.2 CNC(C)CC(=N)N Amb27815687 [0,2,0,0,0,0|2,0,0]=4 3363 B7R0.2 CNC(C)CC(=O)O Amb21959674 [0,2,0,0,0,0|1,0,0]=3 3364 B7R0.2 CNC(C)CC(=O)O Amb9398363 [0,2,0,0,0,0|1,0,0]=3 3365 B7R0.2 CNC(C)CC(N)=O Amb17231826 [0,2,0,0,0,0|1,0,0]=3 3366 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,2,0,0,0,0|1,0,0]=3 3367 B7R0.2 CNC(C)CS(C)=O Amb24410768 [0,2,0,0,0,0|2,0,0]=4 3368 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [0,2,0,0,0,0|1,0,0]=3 3369 B7R0.2 COC(=O)CC(=O)Cl Amb3939073 [0,2,0,0,0,0|0,1,1]=4 3370 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,2,0,0,0,0|0,1,1]=4 3371 B7R0.2 COC(=O)CC(=O)[O-] Amb2780363 [0,2,0,0,0,0|0,1,1]=4 3372 B7R0.2 COC(=O)CC(=O)[O-] Amb34915950 [0,2,0,0,0,0|0,1,1]=4 3373 B7R0.2 COC(=O)CC(C)=O Amb6608655 [0,2,0,0,0,0|0,1,1]=4 3374 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,2,0,0,0,0|0,1,1]=4 3375 B7R0.2 COC(=S)CC(N)=O Amb27230798 [0,2,0,0,0,0|0,1,1]=4 3376 B7R0.2 COC(C)CC(=O)O Amb4001695 [0,2,0,0,0,0|0,1,0]=3 3377 B7R0.2 COC(C)CC(C)=O Amb26512071 [0,2,0,0,0,0|0,1,0]=3 3378 B7R0.2 COC(C)CC(N)=O Amb27838372 [0,2,0,0,0,0|0,1,0]=3 3379 B7R0.2 COC(C)CS(=O)Cl Amb32720528 [0,2,0,0,0,0|1,1,0]=4 3380 B7R0.2 COC(C)CS(=O)[O-] Amb25690482 [0,2,0,0,0,0|1,1,0]=4 3381 B7R0.2 COC(C)CS(N)=O Amb32720534 [0,2,0,0,0,0|1,1,0]=4 3382 B7R0.2 COC(C)NC(C)=O Amb27839138 [0,2,0,0,0,0|1,1,0]=4 3383 B7R0.2 CON(C)CC(=O)O Amb8010467 [0,2,0,0,0,0|1,1,0]=4 3384 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [0,2,0,0,0,0|0,1,0]=3 3385 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [0,2,0,0,0,0|0,1,0]=3 3386 B7R0.2 CSC(=O)NC(N)=O Amb27878953 [0,2,0,0,0,0|1,0,1]=4 3387 B7R0.2 CSC(C)CC(=O)O Amb18967824 [0,2,0,0,0,0|0,0,0]=2 3388 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,2,0,0,0,0|0,0,0]=2 3389 B7R0.2 CSC(C)CC(C)N Amb28203188 [0,2,0,0,0,0|1,0,1]=4 3390 B7R0.2 CSC(C)CC(N)=O Amb27838848 [0,2,0,0,0,0|0,0,0]=2 3391 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [0,2,0,0,0,0|0,0,0]=2 3392 B7R0.2 CS\C(C)=C\C(C)=O Amb28315811 [0,2,0,0,0,0|0,0,2]=4 3393 B7R0.2 CS\C(N)=C/C(C)=O Amb8554013 [0,2,0,0,0,0|0,0,2]=4 3394 B7R0.2 CS\C(N)=C\C(C)=O Amb27420945 [0,2,0,0,0,0|0,0,2]=4 3395 B7R0.2 CS\C(N)=N\C(N)=O Amb25757974 [0,2,0,0,0,0|1,0,1]=4 3396 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [0,2,0,0,0,0|2,0,0]=4 3397 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [0,2,0,0,0,0|2,0,0]=4 3398 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [0,2,0,0,0,0|2,0,0]=4 3399 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [0,2,0,0,0,0|2,0,0]=4 3400 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [0,2,0,0,0,0|2,0,0]=4 3401 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [0,2,0,0,0,0|2,0,0]=4 3402 B7R0.2 C\C=C(/C)CC(C)=O Amb28066574 [0,2,0,0,0,0|1,0,1]=4 3403 B7R0.2 C\C=C(\C)CC(C)=O Amb27637813 [0,2,0,0,0,0|1,0,1]=4 3404 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [0,2,0,0,0,0|1,0,1]=4 3405 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [0,2,0,0,0,0|2,0,0]=4 3406 B7R0.2 N#CC(N)CC(N)=O Amb24122907 [0,2,0,0,0,0|2,0,0]=4 3407 B7R0.2 N#CC(O)CC(N)=O Amb28063048 [0,2,0,0,0,0|2,0,0]=4 3408 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [0,2,0,0,0,0|2,0,0]=4 3409 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [0,2,0,0,0,0|2,0,0]=4 3410 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,2,0,0,0,0|2,0,0]=4 3411 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [0,2,0,0,0,0|2,0,0]=4 3412 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [0,2,0,0,0,0|2,0,0]=4 3413 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [0,2,0,0,0,0|2,0,0]=4 3414 B7R0.2 NC(CF)CC(=O)O Amb24428065 [0,2,0,0,0,0|2,0,0]=4 3415 B7R0.2 NC(CS)CC(=O)O Amb25090412 [0,2,0,0,0,0|2,0,0]=4 3416 B7R0.2 NCC(N)CC(=O)O Amb19515145 [0,2,0,0,0,0|2,0,0]=4 3417 B7R0.2 NCC(N)CC(=O)O Amb21858324 [0,2,0,0,0,0|2,0,0]=4 3418 B7R0.2 NCC(N)CC(N)=O Amb27603845 [0,2,0,0,0,0|2,0,0]=4 3419 B7R0.2 NCC(O)CC(=O)O Amb32663899 [0,2,0,0,0,0|2,0,0]=4 3420 B7R0.2 NCC(O)CC(=O)O Amb33544754 [0,2,0,0,0,0|2,0,0]=4 3421 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [0,2,0,0,0,0|2,0,0]=4 3422 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [0,2,0,0,0,0|2,0,0]=4 3423 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [0,2,0,0,0,0|2,0,0]=4 3424 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [0,2,0,0,0,0|2,0,0]=4 3425 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [0,2,0,0,0,0|2,0,0]=4 3426 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [0,2,0,0,0,0|2,0,0]=4 3427 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [0,2,0,0,0,0|2,0,0]=4 3428 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [0,2,0,0,0,0|2,0,0]=4 3429 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [0,2,0,0,0,0|2,0,0]=4 3430 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [0,2,0,0,0,0|2,0,0]=4 3431 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [0,2,0,0,0,0|2,0,0]=4 3432 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [0,2,0,0,0,0|2,0,0]=4 3433 B7R0.2 O=C(O)CC(O)CF Amb26557587 [0,2,0,0,0,0|2,0,0]=4 3434 B7R0.2 O=C(O)CC(O)CO Amb28120003 [0,2,0,0,0,0|2,0,0]=4 3435 B7R0.2 O=C(O)CC(O)CS Amb27244674 [0,2,0,0,0,0|2,0,0]=4 3436 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [0,2,0,0,0,0|2,0,0]=4 3437 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [0,2,0,0,0,0|2,0,0]=4 3438 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [0,2,0,0,0,0|2,0,0]=4 3439 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [0,2,0,0,0,0|2,0,0]=4 3440 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [0,2,0,0,0,0|2,0,0]=4 3441 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [0,2,0,0,0,0|2,0,0]=4 3442 B7R0.3 C#CC(=C)CCC=O Amb27830103 [0,2,0,0,0,0|1,0,1]=4 3443 B7R0.3 C#CC(=O)CCCC Amb28128200 [0,2,0,0,0,0|1,0,0]=3 3444 B7R0.3 C#CC(=O)CCCCl Amb27669507 [0,2,0,0,0,0|2,0,0]=4 3445 B7R0.3 C#CC(=O)CCCN Amb27631285 [0,2,0,0,0,0|2,0,0]=4 3446 B7R0.3 C#CC(=O)CCCO Amb27593195 [0,2,0,0,0,0|2,0,0]=4 3447 B7R0.3 C#CC(=O)OCCC Amb27761363 [0,2,0,0,0,0|2,0,0]=4 3448 B7R0.3 C#CC(C)CCSC Amb33198285 [0,2,0,0,0,0|1,0,1]=4 3449 B7R0.3 C#CC(C)CSCC Amb33223924 [0,2,0,0,0,0|1,0,1]=4 3450 B7R0.3 C#CC(N)CCSC Amb27850266 [0,2,0,0,0,0|1,0,1]=4 3451 B7R0.3 C#CC(O)COC=O Amb27835958 [0,2,0,0,0,0|1,0,1]=4 3452 B7R0.3 C#CCCC(=O)NN Amb18636071 [0,2,0,0,0,0|1,0,1]=4 3453 B7R0.3 C#CCCC(=O)OC Amb18115985 [0,2,0,0,0,0|1,0,1]=4 3454 B7R0.3 C#CCCC(C)C=O Amb28054858 [0,2,0,0,0,0|1,0,1]=4 3455 B7R0.3 C#CCCC(O)C=O Amb28246623 [0,2,0,0,0,0|1,0,1]=4 3456 B7R0.3 C#CCCN(C)C=O Amb35601309 [0,2,0,0,0,0|1,0,1]=4 3457 B7R0.3 C#CCOC(C)C=O Amb28048949 [0,2,0,0,0,0|1,0,1]=4 3458 B7R0.3 C#CCO[C@@H](C)C=O Amb28316109 [0,2,0,0,0,0|1,0,1]=4 3459 B7R0.3 C=C(C=O)CCC#N Amb17593125 [0,2,0,0,0,0|2,0,0]=4 3460 B7R0.3 C=C(C=O)CCCC Amb4025817 [0,2,0,0,0,0|1,0,0]=3 3461 B7R0.3 C=C(C=O)CCCO Amb28128165 [0,2,0,0,0,0|1,0,1]=4 3462 B7R0.3 C=C(C=O)CCOC Amb27948778 [0,2,0,0,0,0|0,1,0]=3 3463 B7R0.3 C=C(C=O)C\C=C\C Amb26441086 [0,2,0,0,0,0|1,0,1]=4 3464 B7R0.3 C=C(CBr)CCCC Amb25249105 [0,2,0,0,0,0|2,0,0]=4 3465 B7R0.3 C=C(CBr)CCOC Amb33387059 [0,2,0,0,0,0|1,1,0]=4 3466 B7R0.3 C=C(CBr)CCSC Amb33334988 [0,2,0,0,0,0|1,0,0]=3 3467 B7R0.3 C=C(CC)CCC=O Amb27233336 [0,2,0,0,0,0|1,0,0]=3 3468 B7R0.3 C=C(CC)CCCC Amb9787281 [0,2,0,0,0,0|2,0,0]=4 3469 B7R0.3 C=C(CC)CCNC Amb28325353 [0,2,0,0,0,0|2,0,0]=4 3470 B7R0.3 C=C(CCl)CCCC Amb25889368 [0,2,0,0,0,0|2,0,0]=4 3471 B7R0.3 C=C(CCl)CCOC Amb33220591 [0,2,0,0,0,0|1,1,0]=4 3472 B7R0.3 C=C(CCl)CCSC Amb33259848 [0,2,0,0,0,0|1,0,0]=3 3473 B7R0.3 C=C(CN)CCCC Amb27630595 [0,2,0,0,0,0|2,0,0]=4 3474 B7R0.3 C=C(CN)CCOC Amb33377483 [0,2,0,0,0,0|1,1,0]=4 3475 B7R0.3 C=C(CN)CCSC Amb33198280 [0,2,0,0,0,0|1,0,0]=3 3476 B7R0.3 C=C=CCC(O)CC Amb27766614 [0,2,0,0,0,0|2,0,0]=4 3477 B7R0.3 C=CC(=O)CCCC Amb25062494 [0,2,0,0,0,0|1,0,0]=3 3478 B7R0.3 C=CC(=O)CCCCl Amb24568327 [0,2,0,0,0,0|2,0,0]=4 3479 B7R0.3 C=CC(=O)CCOC Amb24744935 [0,2,0,0,0,0|0,1,0]=3 3480 B7R0.3 C=CC(=O)CCSC Amb25334636 [0,2,0,0,0,0|0,0,0]=2 3481 B7R0.3 C=CC(=O)COCC Amb27248148 [0,2,0,0,0,0|2,0,0]=4 3482 B7R0.3 C=CC(=O)CSCC Amb25865187 [0,2,0,0,0,0|1,0,1]=4 3483 B7R0.3 C=CC(=O)C\C=C\C Amb26475455 [0,2,0,0,0,0|1,0,1]=4 3484 B7R0.3 C=CC(=O)NCCC Amb9480391 [0,2,0,0,0,0|2,0,0]=4 3485 B7R0.3 C=CC(=O)NCOC Amb27467338 [0,2,0,0,0,0|1,1,0]=4 3486 B7R0.3 C=CC(=O)NCSC Amb27167368 [0,2,0,0,0,0|1,0,0]=3 3487 B7R0.3 C=CC(=O)OCCC Amb22045218 [0,2,0,0,0,0|2,0,0]=4 3488 B7R0.3 C=CC(Br)CCCC Amb25758328 [0,2,0,0,0,0|2,0,0]=4 3489 B7R0.3 C=CC(C)CCCC Amb22641469 [0,2,0,0,0,0|2,0,0]=4 3490 B7R0.3 C=CC(C)CCCCl Amb27412986 [0,2,0,0,0,0|2,0,0]=4 3491 B7R0.3 C=CC(C)CCCO Amb22641468 [0,2,0,0,0,0|2,0,0]=4 3492 B7R0.3 C=CC(C)C\C=C\C Amb4016446 [0,2,0,0,0,0|2,0,0]=4 3493 B7R0.3 C=CC(Cl)CCOC Amb25989152 [0,2,0,0,0,0|1,1,0]=4 3494 B7R0.3 C=CC(N)CCC=O Amb33036368 [0,2,0,0,0,0|1,0,1]=4 3495 B7R0.3 C=CC(N)CCSC Amb28316202 [0,2,0,0,0,0|1,0,0]=3 3496 B7R0.3 C=CC(N)COCC Amb27248147 [0,2,0,0,0,0|1,1,0]=4 3497 B7R0.3 C=CC(N)CSCC Amb27648478 [0,2,0,0,0,0|1,0,0]=3 3498 B7R0.3 C=CC(O)CCOC Amb27868318 [0,2,0,0,0,0|1,1,0]=4 3499 B7R0.3 C=CC(O)CCSC Amb28123529 [0,2,0,0,0,0|1,0,0]=3 3500 B7R0.3 C=CC(O)COCC Amb28316201 [0,2,0,0,0,0|1,1,0]=4 3501 B7R0.3 C=CC(O)CSCC Amb24543994 [0,2,0,0,0,0|1,0,0]=3 3502 B7R0.3 C=CC(O)C\C=C/C Amb25983129 [0,2,0,0,0,0|2,0,0]=4 3503 B7R0.3 C=CC(O)C\C=C\C Amb27666343 [0,2,0,0,0,0|2,0,0]=4 3504 B7R0.3 C=CCCC(=O)C#N Amb27749803 [0,2,0,0,0,0|1,0,1]=4 3505 B7R0.3 C=CCCC(=O)CBr Amb22059627 [0,2,0,0,0,0|1,0,1]=4 3506 B7R0.3 C=CCCC(=O)CC Amb9031676 [0,2,0,0,0,0|1,0,1]=4 3507 B7R0.3 C=CCCC(=O)CCl Amb22059504 [0,2,0,0,0,0|1,0,1]=4 3508 B7R0.3 C=CCCC(=O)CF Amb28074643 [0,2,0,0,0,0|1,0,1]=4 3509 B7R0.3 C=CCCC(=O)NC Amb25041195 [0,2,0,0,0,0|1,0,1]=4 3510 B7R0.3 C=CCCC(=O)NN Amb27775332 [0,2,0,0,0,0|1,0,1]=4 3511 B7R0.3 C=CCCC(=O)NN Amb27831946 [0,2,0,0,0,0|1,0,1]=4 3512 B7R0.3 C=CCCC(=O)NO Amb28205003 [0,2,0,0,0,0|1,0,1]=4 3513 B7R0.3 C=CCCC(=O)OC Amb2369959 [0,2,0,0,0,0|1,0,1]=4 3514 B7R0.3 C=CCCC(Br)CBr Amb17779511 [0,2,0,0,0,0|2,0,0]=4 3515 B7R0.3 C=CCCC(C)C#N Amb18124159 [0,2,0,0,0,0|2,0,0]=4 3516 B7R0.3 C=CCCC(C)C=O Amb25100921 [0,2,0,0,0,0|1,0,1]=4 3517 B7R0.3 C=CCCC(C)CBr Amb26952992 [0,2,0,0,0,0|2,0,0]=4 3518 B7R0.3 C=CCCC(C)CC Amb26860723 [0,2,0,0,0,0|2,0,0]=4 3519 B7R0.3 C=CCCC(C)CCl Amb24481361 [0,2,0,0,0,0|2,0,0]=4 3520 B7R0.3 C=CCCC(C)CN Amb25189032 [0,2,0,0,0,0|2,0,0]=4 3521 B7R0.3 C=CCCC(C)CN Amb33611653 [0,2,0,0,0,0|2,0,0]=4 3522 B7R0.3 C=CCCC(C)CO Amb27760347 [0,2,0,0,0,0|2,0,0]=4 3523 B7R0.3 C=CCCC(C)NC Amb18641747 [0,2,0,0,0,0|2,0,0]=4 3524 B7R0.3 C=CCCC(C)SC Amb28049294 [0,2,0,0,0,0|1,0,0]=3 3525 B7R0.3 C=CCCC(Cl)CC Amb27394730 [0,2,0,0,0,0|2,0,0]=4 3526 B7R0.3 C=CCCC(N)CN Amb20667712 [0,2,0,0,0,0|2,0,0]=4 3527 B7R0.3 C=CCCC(N)CN Amb27267278 [0,2,0,0,0,0|2,0,0]=4 3528 B7R0.3 C=CCCC(N)CO Amb33532619 [0,2,0,0,0,0|2,0,0]=4 3529 B7R0.3 C=CCCC(O)C=O Amb27863605 [0,2,0,0,0,0|1,0,1]=4 3530 B7R0.3 C=CCCC(O)CC Amb22052608 [0,2,0,0,0,0|2,0,0]=4 3531 B7R0.3 C=CCCC(O)CN Amb8630191 [0,2,0,0,0,0|2,0,0]=4 3532 B7R0.3 C=CCCC(O)CO Amb10071251 [0,2,0,0,0,0|2,0,0]=4 3533 B7R0.3 C=CCCN(C)C=O Amb28126048 [0,2,0,0,0,0|1,0,1]=4 3534 B7R0.3 C=CCCN(C)OC Amb27837936 [0,2,0,0,0,0|1,1,0]=4 3535 B7R0.3 C=CCC[C@@H](O)CO Amb27405919 [0,2,0,0,0,0|2,0,0]=4 3536 B7R0.3 C=CCC[C@H](C)C=O Amb27799770 [0,2,0,0,0,0|1,0,1]=4 3537 B7R0.3 C=CCC[C@H](N)CO Amb27390564 [0,2,0,0,0,0|2,0,0]=4 3538 B7R0.3 C=CCC[C@H](O)CC Amb27946057 [0,2,0,0,0,0|2,0,0]=4 3539 B7R0.3 C=CCC\C(C)=N/N Amb27595313 [0,2,0,0,0,0|2,0,0]=4 3540 B7R0.3 C=CCNC(=N)SC Amb26381808 [0,2,0,0,0,0|1,0,1]=4 3541 B7R0.3 C=CCNC(C)CC Amb6683957 [0,2,0,0,0,0|2,0,0]=4 3542 B7R0.3 C=CCSC(C)CC Amb3940675 [0,2,0,0,0,0|2,0,0]=4 3543 B7R0.3 C=COCC(N)CC Amb27413821 [0,2,0,0,0,0|2,0,0]=4 3544 B7R0.3 C=C[C@@H](C)CCC=O Amb25025116 [0,2,0,0,0,0|1,0,0]=3 3545 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [0,2,0,0,0,0|2,0,0]=4 3546 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [0,2,0,0,0,0|2,0,0]=4 3547 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [0,2,0,0,0,0|2,0,0]=4 3548 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [0,2,0,0,0,0|2,0,0]=4 3549 B7R0.3 CC#CCC(=O)OC Amb6336504 [0,2,0,0,0,0|1,0,1]=4 3550 B7R0.3 CC(C=N)CCCN Amb27640100 [0,2,0,0,0,0|2,0,0]=4 3551 B7R0.3 CC(C=O)CCC#N Amb26607829 [0,2,0,0,0,0|1,0,1]=4 3552 B7R0.3 CC(C=O)CCCBr Amb26526795 [0,2,0,0,0,0|1,0,0]=3 3553 B7R0.3 CC(C=O)CN=[N+]=[N-] Amb27759310 [0,2,0,0,0,0|2,0,0]=4 3554 B7R0.3 CC(C=O)CSC#N Amb28239431 [0,2,0,0,0,0|0,0,1]=3 3555 B7R0.3 CC(C=O)SCCO Amb27827864 [0,2,0,0,0,0|2,0,0]=4 3556 B7R0.3 CC(CN)CCC=N Amb27640087 [0,2,0,0,0,0|2,0,0]=4 3557 B7R0.3 CC(CO)CNC=O Amb27482480 [0,2,0,0,0,0|2,0,0]=4 3558 B7R0.3 CCC(=O)CCC#N Amb25321503 [0,2,0,0,0,0|2,0,0]=4 3559 B7R0.3 CCC(=O)CCCBr Amb25765636 [0,2,0,0,0,0|2,0,0]=4 3560 B7R0.3 CCC(=O)CCCCl Amb17593423 [0,2,0,0,0,0|2,0,0]=4 3561 B7R0.3 CCC(=O)CCCN Amb18833012 [0,2,0,0,0,0|2,0,0]=4 3562 B7R0.3 CCC(=O)CCNC Amb27963044 [0,2,0,0,0,0|1,0,0]=3 3563 B7R0.3 CCC(=O)CCSC Amb25680024 [0,2,0,0,0,0|0,0,0]=2 3564 B7R0.3 CCC(=O)NCC=O Amb17102054 [0,2,0,0,0,0|1,0,1]=4 3565 B7R0.3 CCC(C)C#CC=O Amb27828859 [0,2,0,0,0,0|1,0,1]=4 3566 B7R0.3 CCC(C)CN=C=O Amb25783333 [0,2,0,0,0,0|1,0,1]=4 3567 B7R0.3 CCC(C)C\C=N\O Amb27843883 [0,2,0,0,0,0|1,0,1]=4 3568 B7R0.3 CCC(C)\C=C\C=O Amb32954899 [0,2,0,0,0,0|1,0,1]=4 3569 B7R0.3 CCC(Cl)CCC=O Amb27637733 [0,2,0,0,0,0|1,0,0]=3 3570 B7R0.3 CCC(N)CCC=O Amb33036216 [0,2,0,0,0,0|1,0,0]=3 3571 B7R0.3 CCC(N)CCSC Amb28048993 [0,2,0,0,0,0|1,0,1]=4 3572 B7R0.3 CCC(N)C\C=C\Cl Amb35606913 [0,2,0,0,0,0|2,0,0]=4 3573 B7R0.3 CCC(O)\C=C\C=O Amb16233610 [0,2,0,0,0,0|1,0,1]=4 3574 B7R0.3 CCCCC(=N)OC Amb17617956 [0,2,0,0,0,0|1,0,1]=4 3575 B7R0.3 CCCCC(=N)OC Amb25353357 [0,2,0,0,0,0|1,0,1]=4 3576 B7R0.3 CCCCC(=O)C#N Amb22729179 [0,2,0,0,0,0|1,0,0]=3 3577 B7R0.3 CCCCC(=O)CBr Amb24563421 [0,2,0,0,0,0|1,0,0]=3 3578 B7R0.3 CCCCC(=O)CC Amb4605999 [0,2,0,0,0,0|1,0,0]=3 3579 B7R0.3 CCCCC(=O)CCl Amb17593420 [0,2,0,0,0,0|1,0,0]=3 3580 B7R0.3 CCCCC(=O)CN Amb24473062 [0,2,0,0,0,0|1,0,0]=3 3581 B7R0.3 CCCCC(=O)CO Amb26073501 [0,2,0,0,0,0|1,0,0]=3 3582 B7R0.3 CCCCC(=O)NC Amb5797766 [0,2,0,0,0,0|1,0,0]=3 3583 B7R0.3 CCCCC(=O)NN Amb534136 [0,2,0,0,0,0|1,0,0]=3 3584 B7R0.3 CCCCC(=O)NO Amb6269796 [0,2,0,0,0,0|1,0,0]=3 3585 B7R0.3 CCCCC(=S)NC Amb27838397 [0,2,0,0,0,0|1,1,0]=4 3586 B7R0.3 CCCCC(Br)C=O Amb17594581 [0,2,0,0,0,0|1,0,0]=3 3587 B7R0.3 CCCCC(C)C=O Amb17593191 [0,2,0,0,0,0|1,0,0]=3 3588 B7R0.3 CCCCC(F)C=O Amb27838938 [0,2,0,0,0,0|1,0,0]=3 3589 B7R0.3 CCCCC(N)C=O Amb28422291 [0,2,0,0,0,0|1,0,0]=3 3590 B7R0.3 CCCCN(C)C=O Amb26967032 [0,2,0,0,0,0|1,0,0]=3 3591 B7R0.3 CCCCN(C)N=O Amb22231185 [0,2,0,0,0,0|2,0,0]=4 3592 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [0,2,0,0,0,0|1,0,0]=3 3593 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [0,2,0,0,0,0|2,0,0]=4 3594 B7R0.3 CCCC\C(C)=N\N Amb27883272 [0,2,0,0,0,0|2,0,0]=4 3595 B7R0.3 CCCC\C(Cl)=N\O Amb28397410 [0,2,0,0,0,0|1,0,1]=4 3596 B7R0.3 CCCC\C(N)=N/O Amb2696577 [0,2,0,0,0,0|1,0,1]=4 3597 B7R0.3 CCCC\C(N)=N\O Amb8391665 [0,2,0,0,0,0|1,0,1]=4 3598 B7R0.3 CCCNC(=O)CBr Amb17330843 [0,2,0,0,0,0|2,0,0]=4 3599 B7R0.3 CCCNC(=O)CC Amb5797516 [0,2,0,0,0,0|2,0,0]=4 3600 B7R0.3 CCCNC(=O)CCl Amb1207068 [0,2,0,0,0,0|2,0,0]=4 3601 B7R0.3 CCCNC(=O)CI Amb23512283 [0,2,0,0,0,0|2,0,0]=4 3602 B7R0.3 CCCNC(=O)CN Amb10781813 [0,2,0,0,0,0|2,0,0]=4 3603 B7R0.3 CCCNC(=O)CN Amb426858 [0,2,0,0,0,0|2,0,0]=4 3604 B7R0.3 CCCNC(=O)CO Amb5798169 [0,2,0,0,0,0|2,0,0]=4 3605 B7R0.3 CCCNC(=O)NCl Amb28057729 [0,2,0,0,0,0|2,0,0]=4 3606 B7R0.3 CCCNC(=O)NN Amb8854021 [0,2,0,0,0,0|2,0,0]=4 3607 B7R0.3 CCCOC(=O)C=O Amb18641875 [0,2,0,0,0,0|1,0,1]=4 3608 B7R0.3 CCCOC(=O)CCl Amb9787444 [0,2,0,0,0,0|2,0,0]=4 3609 B7R0.3 CCCOC(=O)CN Amb9826861 [0,2,0,0,0,0|2,0,0]=4 3610 B7R0.3 CCCOC(=O)CO Amb25964379 [0,2,0,0,0,0|2,0,0]=4 3611 B7R0.3 CCCOC(=O)OC Amb27153532 [0,2,0,0,0,0|2,0,0]=4 3612 B7R0.3 CCCSC(=O)CBr Amb28385643 [0,2,0,0,0,0|2,0,0]=4 3613 B7R0.3 CCCSC(=O)CC Amb25882938 [0,2,0,0,0,0|2,0,0]=4 3614 B7R0.3 CCCSC(=O)NC Amb27788550 [0,2,0,0,0,0|2,0,0]=4 3615 B7R0.3 CCCSC(=O)NN Amb27769595 [0,2,0,0,0,0|2,0,0]=4 3616 B7R0.3 CCCSC(C)C=O Amb18124367 [0,2,0,0,0,0|1,0,0]=3 3617 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [0,2,0,0,0,0|1,0,1]=4 3618 B7R0.3 CCNCC(=O)NC Amb32680747 [0,2,0,0,0,0|2,0,0]=4 3619 B7R0.3 CCNCC(=O)NC Amb6251820 [0,2,0,0,0,0|2,0,0]=4 3620 B7R0.3 CCNCC(=O)NO Amb27755137 [0,2,0,0,0,0|2,0,0]=4 3621 B7R0.3 CCNCC(=O)OC Amb19514718 [0,2,0,0,0,0|2,0,0]=4 3622 B7R0.3 CCNCC(=O)OC Amb6687125 [0,2,0,0,0,0|2,0,0]=4 3623 B7R0.3 CCNCC(C)SC Amb19025520 [0,2,0,0,0,0|1,0,1]=4 3624 B7R0.3 CCOCC(=O)CC Amb27406475 [0,2,0,0,0,0|2,0,0]=4 3625 B7R0.3 CCOCC(=O)CCl Amb25087764 [0,2,0,0,0,0|2,0,0]=4 3626 B7R0.3 CCOCC(=O)CF Amb28316133 [0,2,0,0,0,0|2,0,0]=4 3627 B7R0.3 CCOCC(=O)CN Amb27453616 [0,2,0,0,0,0|2,0,0]=4 3628 B7R0.3 CCOCC(=O)CO Amb28066809 [0,2,0,0,0,0|2,0,0]=4 3629 B7R0.3 CCOCC(=O)NN Amb2111918 [0,2,0,0,0,0|2,0,0]=4 3630 B7R0.3 CCOCC(=O)NN Amb6744505 [0,2,0,0,0,0|2,0,0]=4 3631 B7R0.3 CCOCC(=O)OC Amb7753022 [0,2,0,0,0,0|2,0,0]=4 3632 B7R0.3 CCOCC(O)C=O Amb27883256 [0,2,0,0,0,0|0,1,0]=3 3633 B7R0.3 CCS(=O)CCNC Amb21984659 [0,2,0,0,0,0|2,0,0]=4 3634 B7R0.3 CCS(=O)CCOC Amb27838120 [0,2,0,0,0,0|1,1,0]=4 3635 B7R0.3 CCSCC(=O)CCl Amb24545960 [0,2,0,0,0,0|2,0,0]=4 3636 B7R0.3 CCSCC(=O)CN Amb33324079 [0,2,0,0,0,0|2,0,0]=4 3637 B7R0.3 CCSCC(=O)NN Amb2610654 [0,2,0,0,0,0|2,0,0]=4 3638 B7R0.3 CCSCC(=O)OC Amb7753193 [0,2,0,0,0,0|2,0,0]=4 3639 B7R0.3 CCSCC(C)C#N Amb9028662 [0,2,0,0,0,0|1,0,1]=4 3640 B7R0.3 CCSCC(C)C=O Amb27592961 [0,2,0,0,0,0|0,0,0]=2 3641 B7R0.3 CCSCC(C)CBr Amb26852087 [0,2,0,0,0,0|1,0,1]=4 3642 B7R0.3 CCSCC(C)CC Amb27395876 [0,2,0,0,0,0|1,0,1]=4 3643 B7R0.3 CCSCC(C)CCl Amb27469104 [0,2,0,0,0,0|1,0,1]=4 3644 B7R0.3 CCSCC(C)CN Amb9391465 [0,2,0,0,0,0|1,0,1]=4 3645 B7R0.3 CCSCC(C)NC Amb19149257 [0,2,0,0,0,0|2,0,0]=4 3646 B7R0.3 CCSCC(C)NN Amb26568830 [0,2,0,0,0,0|2,0,0]=4 3647 B7R0.3 CCSCC(C)ON Amb33223926 [0,2,0,0,0,0|2,0,0]=4 3648 B7R0.3 CCSCC(F)CN Amb33324013 [0,2,0,0,0,0|1,0,1]=4 3649 B7R0.3 CCSCC(N)CC Amb17485958 [0,2,0,0,0,0|1,0,1]=4 3650 B7R0.3 CCSCC(N)CO Amb18643038 [0,2,0,0,0,0|0,0,2]=4 3651 B7R0.3 CCSCC(O)CBr Amb26957421 [0,2,0,0,0,0|1,0,1]=4 3652 B7R0.3 CCSCC(O)CC Amb27827536 [0,2,0,0,0,0|1,0,1]=4 3653 B7R0.3 CCSCC(O)CCl Amb17593873 [0,2,0,0,0,0|1,0,1]=4 3654 B7R0.3 CCSCC(O)CF Amb28062913 [0,2,0,0,0,0|1,0,1]=4 3655 B7R0.3 CCSCC(O)CN Amb6680865 [0,2,0,0,0,0|1,0,1]=4 3656 B7R0.3 CCSCC(O)CO Amb4019001 [0,2,0,0,0,0|0,0,2]=4 3657 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [0,2,0,0,0,0|0,0,2]=4 3658 B7R0.3 CCSC[C@@H](O)CN Amb26370394 [0,2,0,0,0,0|1,0,1]=4 3659 B7R0.3 CCSC[C@H](N)CC Amb27987520 [0,2,0,0,0,0|1,0,1]=4 3660 B7R0.3 CCSC[C@H](N)CO Amb26564857 [0,2,0,0,0,0|0,0,2]=4 3661 B7R0.3 CCSC[C@H](O)CN Amb27213896 [0,2,0,0,0,0|1,0,1]=4 3662 B7R0.3 CCS\C=C(\O)C=O Amb27412581 [0,2,0,0,0,0|0,0,2]=4 3663 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [0,2,0,0,0,0|1,0,0]=3 3664 B7R0.3 CC[C@H](C)CN=C=O Amb27210806 [0,2,0,0,0,0|1,0,1]=4 3665 B7R0.3 CC[C@H](C)\C=C\C=O Amb27873518 [0,2,0,0,0,0|1,0,1]=4 3666 B7R0.3 CC[C@H](O)\C=C\C=O Amb28070938 [0,2,0,0,0,0|1,0,1]=4 3667 B7R0.3 CC\C=C\C(C)C=O Amb33474380 [0,2,0,0,0,0|1,0,1]=4 3668 B7R0.3 CC\C=C\C(F)C=O Amb26049149 [0,2,0,0,0,0|1,0,1]=4 3669 B7R0.3 CN(C=O)CCC#N Amb26572270 [0,2,0,0,0,0|2,0,0]=4 3670 B7R0.3 CN(C=O)CCCCl Amb24589375 [0,2,0,0,0,0|2,0,0]=4 3671 B7R0.3 CN(C=O)CCCO Amb17593211 [0,2,0,0,0,0|2,0,0]=4 3672 B7R0.3 CN(CCC=O)N=O Amb17617679 [0,2,0,0,0,0|1,0,0]=3 3673 B7R0.3 CNC(=N)CCOC Amb24526950 [0,2,0,0,0,0|1,1,0]=4 3674 B7R0.3 CNC(=N)CCOC Amb30585093 [0,2,0,0,0,0|1,1,0]=4 3675 B7R0.3 CNC(=N)CCSC Amb35595278 [0,2,0,0,0,0|1,0,0]=3 3676 B7R0.3 CNC(=O)CCC#N Amb17334052 [0,2,0,0,0,0|2,0,0]=4 3677 B7R0.3 CNC(=O)CCCCl Amb1137464 [0,2,0,0,0,0|2,0,0]=4 3678 B7R0.3 CNC(=O)CCCI Amb27625606 [0,2,0,0,0,0|2,0,0]=4 3679 B7R0.3 CNC(=O)CCCN Amb6263864 [0,2,0,0,0,0|2,0,0]=4 3680 B7R0.3 CNC(=O)CCCN Amb9176288 [0,2,0,0,0,0|2,0,0]=4 3681 B7R0.3 CNC(=O)CCCO Amb17231829 [0,2,0,0,0,0|2,0,0]=4 3682 B7R0.3 CNC(=O)CCCS Amb27259921 [0,2,0,0,0,0|2,0,0]=4 3683 B7R0.3 CNC(=O)CCNN Amb26936043 [0,2,0,0,0,0|2,0,0]=4 3684 B7R0.3 CNC(=O)CCOC Amb27655430 [0,2,0,0,0,0|0,1,0]=3 3685 B7R0.3 CNC(C)CCSC Amb19515468 [0,2,0,0,0,0|1,0,1]=4 3686 B7R0.3 CNCCC(=N)OC Amb28411188 [0,2,0,0,0,0|1,0,1]=4 3687 B7R0.3 CNCCC(=O)NC Amb19959924 [0,2,0,0,0,0|1,0,0]=3 3688 B7R0.3 CNCCC(=O)NC Amb8428200 [0,2,0,0,0,0|1,0,0]=3 3689 B7R0.3 CNCCC(=O)NN Amb28143068 [0,2,0,0,0,0|1,0,0]=3 3690 B7R0.3 CNCCC(=O)NO Amb27763537 [0,2,0,0,0,0|1,0,0]=3 3691 B7R0.3 CNCCC(=O)OC Amb22168213 [0,2,0,0,0,0|1,0,0]=3 3692 B7R0.3 CNCCC(=O)OC Amb7969878 [0,2,0,0,0,0|1,0,0]=3 3693 B7R0.3 CNCC\C(C)=C\Cl Amb27594199 [0,2,0,0,0,0|2,0,0]=4 3694 B7R0.3 CNCC\C(N)=N/O Amb19981296 [0,2,0,0,0,0|1,0,1]=4 3695 B7R0.3 CNCC\C(N)=N\O Amb22410480 [0,2,0,0,0,0|1,0,1]=4 3696 B7R0.3 CNOCC(=O)OC Amb32662920 [0,2,0,0,0,0|2,0,0]=4 3697 B7R0.3 CNOCC(=O)OC Amb33067971 [0,2,0,0,0,0|2,0,0]=4 3698 B7R0.3 COC(=O)CCC#N Amb2689406 [0,2,0,0,0,0|2,0,0]=4 3699 B7R0.3 COC(=O)CCC=O Amb18124259 [0,2,0,0,0,0|0,1,0]=3 3700 B7R0.3 COC(=O)CCCBr Amb8516943 [0,2,0,0,0,0|2,0,0]=4 3701 B7R0.3 COC(=O)CCCCl Amb3940271 [0,2,0,0,0,0|2,0,0]=4 3702 B7R0.3 COC(=O)CCCI Amb3941711 [0,2,0,0,0,0|2,0,0]=4 3703 B7R0.3 COC(=O)CCCN Amb402626 [0,2,0,0,0,0|2,0,0]=4 3704 B7R0.3 COC(=O)CCCS Amb19373761 [0,2,0,0,0,0|2,0,0]=4 3705 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [0,2,0,0,0,0|2,0,0]=4 3706 B7R0.3 COC(=O)CCON Amb29848091 [0,2,0,0,0,0|1,1,0]=4 3707 B7R0.3 COC(=O)CCSC Amb8393179 [0,2,0,0,0,0|0,0,0]=2 3708 B7R0.3 COC(=O)CNC=O Amb22000868 [0,2,0,0,0,0|0,1,1]=4 3709 B7R0.3 COC(=O)NCC=O Amb27839038 [0,2,0,0,0,0|0,1,1]=4 3710 B7R0.3 COC(=O)NCSC Amb28398191 [0,2,0,0,0,0|1,0,0]=3 3711 B7R0.3 COC(=O)OCC=O Amb28208420 [0,2,0,0,0,0|0,1,1]=4 3712 B7R0.3 COC(=O)\C=C\SC Amb33473626 [0,2,0,0,0,0|0,0,2]=4 3713 B7R0.3 COC(C)CCC=O Amb25917630 [0,2,0,0,0,0|0,1,0]=3 3714 B7R0.3 COC(C)\C=C\C=O Amb27640624 [0,2,0,0,0,0|0,1,1]=4 3715 B7R0.3 COC(O)C#CC=O Amb27164614 [0,2,0,0,0,0|0,1,1]=4 3716 B7R0.3 COCCC(=O)CCl Amb20622320 [0,2,0,0,0,0|0,1,0]=3 3717 B7R0.3 COCCC(=O)CN Amb26515688 [0,2,0,0,0,0|0,1,0]=3 3718 B7R0.3 COCCC(=O)NN Amb2689273 [0,2,0,0,0,0|0,1,0]=3 3719 B7R0.3 COCCC(=O)OC Amb6296150 [0,2,0,0,0,0|0,1,0]=3 3720 B7R0.3 COCCC(C)C=O Amb26896518 [0,2,0,0,0,0|0,1,0]=3 3721 B7R0.3 COCCC(C)SC Amb27838053 [0,2,0,0,0,0|0,0,2]=4 3722 B7R0.3 COCCC(N)C=O Amb28397866 [0,2,0,0,0,0|0,1,0]=3 3723 B7R0.3 COCCN(C)N=O Amb26370374 [0,2,0,0,0,0|1,1,0]=4 3724 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [0,2,0,0,0,0|0,1,0]=3 3725 B7R0.3 COCC\C(N)=C\O Amb28364926 [0,2,0,0,0,0|0,1,1]=4 3726 B7R0.3 COCC\C(N)=N/O Amb19890177 [0,2,0,0,0,0|0,1,1]=4 3727 B7R0.3 COCC\C(N)=N/O Amb2696139 [0,2,0,0,0,0|0,1,1]=4 3728 B7R0.3 COCC\C(N)=N\O Amb22490466 [0,2,0,0,0,0|0,1,1]=4 3729 B7R0.3 COCC\C(N)=N\O Amb8384548 [0,2,0,0,0,0|0,1,1]=4 3730 B7R0.3 COCNC(=O)CF Amb28045827 [0,2,0,0,0,0|1,1,0]=4 3731 B7R0.3 COCNC(=O)OC Amb27253203 [0,2,0,0,0,0|1,1,0]=4 3732 B7R0.3 COCOC(=O)CCl Amb27952135 [0,2,0,0,0,0|1,1,0]=4 3733 B7R0.3 COCOC(=O)NN Amb28386033 [0,2,0,0,0,0|1,1,0]=4 3734 B7R0.3 COCO[C@@H](C)C=O Amb28422010 [0,2,0,0,0,0|0,1,0]=3 3735 B7R0.3 CO[C@@H](C)CNC=O Amb35605354 [0,2,0,0,0,0|0,1,0]=3 3736 B7R0.3 CO[C@H](C)CNC=O Amb35605356 [0,2,0,0,0,0|0,1,0]=3 3737 B7R0.3 CO\C(C)=C\CC=O Amb28283269 [0,2,0,0,0,0|0,1,1]=4 3738 B7R0.3 CO\C=C\[C@H](C)C=O Amb27828915 [0,2,0,0,0,0|0,1,1]=4 3739 B7R0.3 CSC(=O)CCCCl Amb27249585 [0,2,0,0,0,0|1,0,1]=4 3740 B7R0.3 CSC(C)CN=C=O Amb28422389 [0,2,0,0,0,0|0,0,1]=3 3741 B7R0.3 CSC(C)CN=C=S Amb27666223 [0,2,0,0,0,0|0,1,1]=4 3742 B7R0.3 CSCCC(=O)CCl Amb25910902 [0,2,0,0,0,0|0,0,0]=2 3743 B7R0.3 CSCCC(=O)CF Amb28316167 [0,2,0,0,0,0|0,0,0]=2 3744 B7R0.3 CSCCC(=O)CN Amb33199125 [0,2,0,0,0,0|0,0,0]=2 3745 B7R0.3 CSCCC(C)C#N Amb33198760 [0,2,0,0,0,0|1,0,1]=4 3746 B7R0.3 CSCCC(C)C=O Amb26624792 [0,2,0,0,0,0|0,0,0]=2 3747 B7R0.3 CSCCC(C)CBr Amb26508349 [0,2,0,0,0,0|1,0,1]=4 3748 B7R0.3 CSCCC(C)CCl Amb27870601 [0,2,0,0,0,0|1,0,1]=4 3749 B7R0.3 CSCCC(C)CN Amb28291178 [0,2,0,0,0,0|1,0,1]=4 3750 B7R0.3 CSCCC(C)NN Amb27391703 [0,2,0,0,0,0|1,0,1]=4 3751 B7R0.3 CSCCC(C)ON Amb33198297 [0,2,0,0,0,0|0,0,2]=4 3752 B7R0.3 CSCCC(F)CN Amb33198736 [0,2,0,0,0,0|1,0,1]=4 3753 B7R0.3 CSCCC(N)CN Amb19003937 [0,2,0,0,0,0|1,0,1]=4 3754 B7R0.3 CSCCC(N)CN Amb33291358 [0,2,0,0,0,0|1,0,1]=4 3755 B7R0.3 CSCCC(N)CO Amb4036829 [0,2,0,0,0,0|0,0,2]=4 3756 B7R0.3 CSCCC(O)CBr Amb25824128 [0,2,0,0,0,0|0,0,2]=4 3757 B7R0.3 CSCCC(O)CCl Amb25067893 [0,2,0,0,0,0|0,0,2]=4 3758 B7R0.3 CSCCC(O)CF Amb33198282 [0,2,0,0,0,0|0,0,2]=4 3759 B7R0.3 CSCCC(O)CN Amb25785761 [0,2,0,0,0,0|0,0,2]=4 3760 B7R0.3 CSCCC(O)CO Amb26019209 [0,2,0,0,0,0|0,0,2]=4 3761 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [0,2,0,0,0,0|0,0,2]=4 3762 B7R0.3 CSCC[C@@H](O)CN Amb26515632 [0,2,0,0,0,0|0,0,2]=4 3763 B7R0.3 CSCC[C@H](N)CN Amb26023438 [0,2,0,0,0,0|1,0,1]=4 3764 B7R0.3 CSCC[C@H](N)CO Amb2720562 [0,2,0,0,0,0|0,0,2]=4 3765 B7R0.3 CSCC[C@H](O)C#N Amb27594841 [0,2,0,0,0,0|0,0,2]=4 3766 B7R0.3 CSCC[C@H](O)CN Amb33198735 [0,2,0,0,0,0|0,0,2]=4 3767 B7R0.3 CSCC\C(N)=N\O Amb25127504 [0,2,0,0,0,0|0,0,1]=3 3768 B7R0.3 CSSCC(C)CO Amb27166642 [0,2,0,0,0,0|0,0,2]=4 3769 B7R0.3 CS\C=C\C(=O)NN Amb27458500 [0,2,0,0,0,0|0,0,2]=4 3770 B7R0.3 C\C(C=O)=C/CC=O Amb27236148 [0,2,0,0,0,0|1,0,1]=4 3771 B7R0.3 C\C=C(/C)CCCC Amb22229367 [0,2,0,0,0,0|2,0,0]=4 3772 B7R0.3 C\C=C/CC(Cl)CC Amb27760501 [0,2,0,0,0,0|2,0,0]=4 3773 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [0,2,0,0,0,0|1,0,1]=4 3774 B7R0.3 C\C=C\CC(C)C=O Amb17593164 [0,2,0,0,0,0|1,0,0]=3 3775 B7R0.3 C\C=C\C[C@H](C)C=O Amb27403477 [0,2,0,0,0,0|1,0,0]=3 3776 B7R0.3 N#CC(=O)CCCCl Amb28410737 [0,2,0,0,0,0|2,0,0]=4 3777 B7R0.3 N#CCCC(=O)C#N Amb28049016 [0,2,0,0,0,0|2,0,0]=4 3778 B7R0.3 N#CCCC(=O)C=O Amb27792293 [0,2,0,0,0,0|2,0,0]=4 3779 B7R0.3 N#CCCC(=O)CN Amb27240440 [0,2,0,0,0,0|2,0,0]=4 3780 B7R0.3 NCC(O)CCC=O Amb27855481 [0,2,0,0,0,0|1,0,0]=3 3781 B7R0.3 NCCCC(=O)NN Amb18061734 [0,2,0,0,0,0|2,0,0]=4 3782 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [0,2,0,0,0,0|1,0,0]=3 3783 B7R0.3 NNC(=O)CCCCl Amb9818914 [0,2,0,0,0,0|2,0,0]=4 3784 B7R0.3 NNC(=O)CCCO Amb535400 [0,2,0,0,0,0|2,0,0]=4 3785 B7R0.3 NNC(=O)CCNO Amb25128022 [0,2,0,0,0,0|2,0,0]=4 3786 B7R0.3 O=C(CBr)CCCBr Amb27153779 [0,2,0,0,0,0|2,0,0]=4 3787 B7R0.3 O=C(CBr)CCCCl Amb27875989 [0,2,0,0,0,0|2,0,0]=4 3788 B7R0.3 O=C(CCCCl)NO Amb28061167 [0,2,0,0,0,0|2,0,0]=4 3789 B7R0.3 O=C(CCCF)NO Amb28185008 [0,2,0,0,0,0|2,0,0]=4 3790 B7R0.3 O=C(CCl)CCCBr Amb22395325 [0,2,0,0,0,0|2,0,0]=4 3791 B7R0.3 O=C(CCl)CCCCl Amb22395285 [0,2,0,0,0,0|2,0,0]=4 3792 B7R0.3 O=C(CO)CCCO Amb27227084 [0,2,0,0,0,0|2,0,0]=4 3793 B7R0.3 O=CC(=O)CCCO Amb27751348 [0,2,0,0,0,0|1,0,1]=4 3794 B7R0.3 O=CC(Cl)CCCO Amb27831369 [0,2,0,0,0,0|1,0,0]=3 3795 B7R0.3 O=CCCC(=O)CO Amb27799816 [0,2,0,0,0,0|1,0,0]=3 3796 B7R0.3 O=CCCC(Cl)C=O Amb27232955 [0,2,0,0,0,0|1,0,1]=4 3797 B7R0.3 O=CCC\C(Cl)=N\O Amb27751320 [0,2,0,0,0,0|2,0,0]=4 3798 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [0,2,0,0,0,0|1,0,0]=3 3799 B7R0.3 [C-]#[N+]C(C)CCSC Amb33198738 [0,2,0,0,0,0|1,0,1]=4 3800 B7R0.3 [C-]#[N+]C(C)CSCC Amb33324018 [0,2,0,0,0,0|2,0,0]=4 3801 B7R0.3 [C-]#[N+]CCC(=O)OC Amb2689499 [0,2,0,0,0,0|1,0,1]=4 3802 B7R0.3 [N-]=[N+]=NCC(O)C=O Amb24529090 [0,2,0,0,0,0|2,0,0]=4 3803 B7R0.3 [N-]=[N+]=NC[C@@H](O)C=O Amb27408484 [0,2,0,0,0,0|2,0,0]=4 3804 B7R0.3 [N-]=[N+]=NC[C@H](O)C=O Amb27668579 [0,2,0,0,0,0|2,0,0]=4 3805 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [0,2,0,0,0,0|1,0,1]=4 3806 B7R0.5 C#CCC(C)C(C)=O Amb27465169 [0,2,0,0,0,0|1,0,1]=4 3807 B7R0.5 C#CCC(F)C(C)=O Amb28249962 [0,2,0,0,0,0|1,0,1]=4 3808 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [0,2,0,0,0,0|1,0,1]=4 3809 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [0,2,0,0,0,0|1,0,1]=4 3810 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [0,2,0,0,0,0|1,0,1]=4 3811 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,2,0,0,0,0|1,0,1]=4 3812 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [0,2,0,0,0,0|1,0,1]=4 3813 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [0,2,0,0,0,0|1,0,1]=4 3814 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [0,2,0,0,0,0|1,0,1]=4 3815 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [0,2,0,0,0,0|1,0,1]=4 3816 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [0,2,0,0,0,0|1,0,1]=4 3817 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [0,2,0,0,0,0|1,0,1]=4 3818 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [0,2,0,0,0,0|1,0,1]=4 3819 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [0,2,0,0,0,0|1,0,1]=4 3820 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [0,2,0,0,0,0|1,0,1]=4 3821 B7R0.5 C=C(C)C(=C)CC=O Amb28245848 [0,2,0,0,0,0|1,0,1]=4 3822 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [0,2,0,0,0,0|2,0,0]=4 3823 B7R0.5 C=C(C)C(O)CNC Amb24716760 [0,2,0,0,0,0|2,0,0]=4 3824 B7R0.5 C=C(C)C(O)COC Amb27662970 [0,2,0,0,0,0|1,1,0]=4 3825 B7R0.5 C=C(C)C(O)CSC Amb27795952 [0,2,0,0,0,0|1,0,0]=3 3826 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [0,2,0,0,0,0|1,0,1]=4 3827 B7R0.5 C=C(COC)C(=O)O Amb26978134 [0,2,0,0,0,0|0,1,1]=4 3828 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [0,2,0,0,0,0|0,0,1]=3 3829 B7R0.5 C=C(Cl)C(O)CSC Amb27660824 [0,2,0,0,0,0|1,0,0]=3 3830 B7R0.5 C=C(F)C(O)CCC Amb27833609 [0,2,0,0,0,0|2,0,0]=4 3831 B7R0.5 C=CCC(Br)C(=C)C Amb28397197 [0,2,0,0,0,0|2,0,0]=4 3832 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [0,2,0,0,0,0|1,0,1]=4 3833 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [0,2,0,0,0,0|1,0,1]=4 3834 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [0,2,0,0,0,0|1,0,1]=4 3835 B7R0.5 C=CCC(C)C(C)C Amb22229588 [0,2,0,0,0,0|2,0,0]=4 3836 B7R0.5 C=CCC(C)C(C)O Amb26435224 [0,2,0,0,0,0|2,0,0]=4 3837 B7R0.5 C=CCC(C)C(N)=O Amb27788519 [0,2,0,0,0,0|1,0,1]=4 3838 B7R0.5 C=CCC(Cl)C(=O)Cl Amb27463323 [0,2,0,0,0,0|1,0,1]=4 3839 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [0,2,0,0,0,0|1,0,1]=4 3840 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [0,2,0,0,0,0|1,0,1]=4 3841 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [0,2,0,0,0,0|1,0,1]=4 3842 B7R0.5 C=CCC(N)C(=C)C Amb28316076 [0,2,0,0,0,0|2,0,0]=4 3843 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [0,2,0,0,0,0|1,0,1]=4 3844 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [0,2,0,0,0,0|1,0,1]=4 3845 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [0,2,0,0,0,0|1,0,1]=4 3846 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [0,2,0,0,0,0|1,0,1]=4 3847 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [0,2,0,0,0,0|1,0,1]=4 3848 B7R0.5 C=CCC(O)C(=C)C Amb4035448 [0,2,0,0,0,0|2,0,0]=4 3849 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [0,2,0,0,0,0|1,0,1]=4 3850 B7R0.5 C=CCC(O)C(C)C Amb22052662 [0,2,0,0,0,0|2,0,0]=4 3851 B7R0.5 C=CCC(O)[C@H](C)N Amb35738412 [0,2,0,0,0,0|2,0,0]=4 3852 B7R0.5 C=CC[C@@H](C)[C@@H](C)N Amb27471731 [0,2,0,0,0,0|2,0,0]=4 3853 B7R0.5 C=CC[C@@H](C)[C@H](C)N Amb28383991 [0,2,0,0,0,0|2,0,0]=4 3854 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [0,2,0,0,0,0|1,0,1]=4 3855 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [0,2,0,0,0,0|1,0,1]=4 3856 B7R0.5 C=CC[C@@H](N)C(C)C Amb27815025 [0,2,0,0,0,0|2,0,0]=4 3857 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [0,2,0,0,0,0|1,0,1]=4 3858 B7R0.5 C=CC[C@@H](O)[C@H](C)N Amb27838342 [0,2,0,0,0,0|2,0,0]=4 3859 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [0,2,0,0,0,0|1,0,1]=4 3860 B7R0.5 C=CC[C@H](C)C(C)O Amb28350029 [0,2,0,0,0,0|2,0,0]=4 3861 B7R0.5 C=CC[C@H](C)[C@@H](C)N Amb27807483 [0,2,0,0,0,0|2,0,0]=4 3862 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [0,2,0,0,0,0|1,0,1]=4 3863 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [0,2,0,0,0,0|1,0,1]=4 3864 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [0,2,0,0,0,0|1,0,1]=4 3865 B7R0.5 C=CC[C@H](O)[C@H](C)O Amb28366034 [0,2,0,0,0,0|2,0,0]=4 3866 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [0,2,0,0,0,0|1,0,1]=4 3867 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [0,2,0,0,0,0|1,0,1]=4 3868 B7R0.5 CC#CC(O)C(C)=O Amb25950589 [0,2,0,0,0,0|1,0,1]=4 3869 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [0,2,0,0,0,0|1,0,1]=4 3870 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [0,2,0,0,0,0|2,0,0]=4 3871 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [0,2,0,0,0,0|2,0,0]=4 3872 B7R0.5 CC(=O)C(C)CC#N Amb27403110 [0,2,0,0,0,0|2,0,0]=4 3873 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [0,2,0,0,0,0|2,0,0]=4 3874 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [0,2,0,0,0,0|2,0,0]=4 3875 B7R0.5 CC(=O)C(C)CCO Amb13881368 [0,2,0,0,0,0|2,0,0]=4 3876 B7R0.5 CC(=O)C(C)NC=O Amb23442778 [0,2,0,0,0,0|2,0,0]=4 3877 B7R0.5 CC(=O)C(C)OC=O Amb26492625 [0,2,0,0,0,0|2,0,0]=4 3878 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [0,2,0,0,0,0|1,0,0]=3 3879 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [0,2,0,0,0,0|2,0,0]=4 3880 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [0,2,0,0,0,0|2,0,0]=4 3881 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [0,2,0,0,0,0|2,0,0]=4 3882 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [0,2,0,0,0,0|2,0,0]=4 3883 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [0,2,0,0,0,0|2,0,0]=4 3884 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,2,0,0,0,0|2,0,0]=4 3885 B7R0.5 CC(=O)C(S)CCO Amb25831127 [0,2,0,0,0,0|2,0,0]=4 3886 B7R0.5 CC(=O)N(C)CC=O Amb17080668 [0,2,0,0,0,0|2,0,0]=4 3887 B7R0.5 CC(=O)[C@@H](C)CC#N Amb26887655 [0,2,0,0,0,0|2,0,0]=4 3888 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [0,2,0,0,0,0|2,0,0]=4 3889 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [0,2,0,0,0,0|1,0,0]=3 3890 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [0,2,0,0,0,0|1,0,1]=4 3891 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [0,2,0,0,0,0|1,0,1]=4 3892 B7R0.5 CC(C)C(C)CC=O Amb18641816 [0,2,0,0,0,0|1,0,0]=3 3893 B7R0.5 CC(C)C(N)CC=O Amb27628058 [0,2,0,0,0,0|1,0,0]=3 3894 B7R0.5 CC(C)[C@@H](C)CC=O Amb28388606 [0,2,0,0,0,0|1,0,0]=3 3895 B7R0.5 CC(C)[C@H](N)NC=O Amb28187220 [0,2,0,0,0,0|2,0,0]=4 3896 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [0,2,0,0,0,0|2,0,0]=4 3897 B7R0.5 CC(CC#N)C(N)=O Amb8944748 [0,2,0,0,0,0|2,0,0]=4 3898 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [0,2,0,0,0,0|2,0,0]=4 3899 B7R0.5 CC(CC=O)C(Cl)Cl Amb28320750 [0,2,0,0,0,0|2,0,0]=4 3900 B7R0.5 CC(CC=O)N(C)C Amb18203067 [0,2,0,0,0,0|1,0,0]=3 3901 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [0,2,0,0,0,0|2,0,0]=4 3902 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [0,2,0,0,0,0|2,0,0]=4 3903 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,2,0,0,0,0|2,0,0]=4 3904 B7R0.5 CC(CCF)C(=O)O Amb24678386 [0,2,0,0,0,0|2,0,0]=4 3905 B7R0.5 CC(CCN)C(=O)O Amb20667970 [0,2,0,0,0,0|2,0,0]=4 3906 B7R0.5 CC(CCN)C(=O)O Amb538221 [0,2,0,0,0,0|2,0,0]=4 3907 B7R0.5 CC(CCO)C(=O)O Amb18641949 [0,2,0,0,0,0|2,0,0]=4 3908 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [0,2,0,0,0,0|2,0,0]=4 3909 B7R0.5 CC(CCO)C(N)=O Amb28280962 [0,2,0,0,0,0|2,0,0]=4 3910 B7R0.5 CC(CNO)C(=O)O Amb28315956 [0,2,0,0,0,0|2,0,0]=4 3911 B7R0.5 CC(CSS)C(=O)O Amb27437183 [0,2,0,0,0,0|1,0,0]=3 3912 B7R0.5 CC(Cl)C(C)OC=O Amb28245214 [0,2,0,0,0,0|2,0,0]=4 3913 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [0,2,0,0,0,0|1,0,1]=4 3914 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [0,2,0,0,0,0|1,0,1]=4 3915 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [0,2,0,0,0,0|1,0,0]=3 3916 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [0,2,0,0,0,0|1,0,0]=3 3917 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [0,2,0,0,0,0|1,0,0]=3 3918 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [0,2,0,0,0,0|2,0,0]=4 3919 B7R0.5 CCCC(C)C(=N)N Amb27810844 [0,2,0,0,0,0|2,0,0]=4 3920 B7R0.5 CCCC(C)C(=N)N Amb33212650 [0,2,0,0,0,0|2,0,0]=4 3921 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [0,2,0,0,0,0|1,0,0]=3 3922 B7R0.5 CCCC(C)C(=O)O Amb3938958 [0,2,0,0,0,0|1,0,0]=3 3923 B7R0.5 CCCC(C)C(C)=O Amb4034597 [0,2,0,0,0,0|1,0,0]=3 3924 B7R0.5 CCCC(C)C(N)=O Amb3886535 [0,2,0,0,0,0|1,0,0]=3 3925 B7R0.5 CCCC(C)C(N)=S Amb25138492 [0,2,0,0,0,0|1,1,0]=4 3926 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [0,2,0,0,0,0|2,0,0]=4 3927 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [0,2,0,0,0,0|2,0,0]=4 3928 B7R0.5 CCCC(C)S(N)=O Amb32720511 [0,2,0,0,0,0|2,0,0]=4 3929 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [0,2,0,0,0,0|1,0,0]=3 3930 B7R0.5 CCCC(F)C(=O)O Amb25842008 [0,2,0,0,0,0|1,0,0]=3 3931 B7R0.5 CCCC(F)C(C)=O Amb28316211 [0,2,0,0,0,0|1,0,0]=3 3932 B7R0.5 CCCC(F)C(N)=O Amb28127390 [0,2,0,0,0,0|1,0,0]=3 3933 B7R0.5 CCCC(N)C(=N)N Amb27222841 [0,2,0,0,0,0|2,0,0]=4 3934 B7R0.5 CCCC(N)C(=O)O Amb6262055 [0,2,0,0,0,0|1,0,0]=3 3935 B7R0.5 CCCC(N)C(C)=O Amb27838289 [0,2,0,0,0,0|1,0,0]=3 3936 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,2,0,0,0,0|1,0,0]=3 3937 B7R0.5 CCCC(N)C(N)=O Amb9514970 [0,2,0,0,0,0|1,0,0]=3 3938 B7R0.5 CCCC(N)C(N)=S Amb28121515 [0,2,0,0,0,0|1,1,0]=4 3939 B7R0.5 CCCC(O)C(=N)N Amb27881736 [0,2,0,0,0,0|2,0,0]=4 3940 B7R0.5 CCCC(O)C(=O)O Amb2818222 [0,2,0,0,0,0|1,0,0]=3 3941 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,2,0,0,0,0|1,0,0]=3 3942 B7R0.5 CCCC(O)C(N)=O Amb24116553 [0,2,0,0,0,0|1,0,0]=3 3943 B7R0.5 CCCC(S)C(=O)O Amb18124440 [0,2,0,0,0,0|1,0,0]=3 3944 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [0,2,0,0,0,0|2,0,0]=4 3945 B7R0.5 CCCN(C)C(N)=O Amb8898960 [0,2,0,0,0,0|2,0,0]=4 3946 B7R0.5 CCCN(N)C(C)=O Amb18641903 [0,2,0,0,0,0|2,0,0]=4 3947 B7R0.5 CCCN(O)C(N)=O Amb28347092 [0,2,0,0,0,0|2,0,0]=4 3948 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [0,2,0,0,0,0|1,0,0]=3 3949 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [0,2,0,0,0,0|1,0,0]=3 3950 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [0,2,0,0,0,0|1,0,0]=3 3951 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [0,2,0,0,0,0|1,0,0]=3 3952 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,2,0,0,0,0|1,0,0]=3 3953 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,2,0,0,0,0|1,0,0]=3 3954 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [0,2,0,0,0,0|1,0,0]=3 3955 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [0,2,0,0,0,0|1,0,0]=3 3956 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [0,2,0,0,0,0|1,0,0]=3 3957 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [0,2,0,0,0,0|1,0,0]=3 3958 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [0,2,0,0,0,0|1,0,0]=3 3959 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [0,2,0,0,0,0|1,0,0]=3 3960 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [0,2,0,0,0,0|1,0,0]=3 3961 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [0,2,0,0,0,0|1,0,0]=3 3962 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [0,2,0,0,0,0|1,0,0]=3 3963 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [0,2,0,0,0,0|1,0,0]=3 3964 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [0,2,0,0,0,0|1,0,0]=3 3965 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,2,0,0,0,0|1,0,0]=3 3966 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [0,2,0,0,0,0|1,0,0]=3 3967 B7R0.5 CCNC(C)C(=O)O Amb33527634 [0,2,0,0,0,0|2,0,0]=4 3968 B7R0.5 CCNC(C)C(=O)O Amb9326962 [0,2,0,0,0,0|2,0,0]=4 3969 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,2,0,0,0,0|2,0,0]=4 3970 B7R0.5 CCNC(C)C(N)=O Amb7758139 [0,2,0,0,0,0|2,0,0]=4 3971 B7R0.5 CCNC(O)C(=O)O Amb27259098 [0,2,0,0,0,0|2,0,0]=4 3972 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [0,2,0,0,0,0|2,0,0]=4 3973 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [0,2,0,0,0,0|2,0,0]=4 3974 B7R0.5 CCOC(C)C(=O)O Amb9725271 [0,2,0,0,0,0|2,0,0]=4 3975 B7R0.5 CCOC(C)C(C)=O Amb9666103 [0,2,0,0,0,0|2,0,0]=4 3976 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,2,0,0,0,0|2,0,0]=4 3977 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [0,2,0,0,0,0|2,0,0]=4 3978 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [0,2,0,0,0,0|2,0,0]=4 3979 B7R0.5 CCOC(F)C(=O)O Amb27210743 [0,2,0,0,0,0|2,0,0]=4 3980 B7R0.5 CCSC(C)C(=O)O Amb9721554 [0,2,0,0,0,0|2,0,0]=4 3981 B7R0.5 CCSC(C)C(N)=O Amb27830179 [0,2,0,0,0,0|2,0,0]=4 3982 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [0,2,0,0,0,0|2,0,0]=4 3983 B7R0.5 CN(C)C(=S)CC=O Amb27974853 [0,2,0,0,0,0|1,0,1]=4 3984 B7R0.5 CNCC(C)C(=N)N Amb28073850 [0,2,0,0,0,0|2,0,0]=4 3985 B7R0.5 CNCC(C)C(=O)O Amb13952364 [0,2,0,0,0,0|1,0,0]=3 3986 B7R0.5 CNCC(C)C(=O)O Amb9400281 [0,2,0,0,0,0|1,0,0]=3 3987 B7R0.5 CNCC(C)C(N)=O Amb8943991 [0,2,0,0,0,0|1,0,0]=3 3988 B7R0.5 CNCC(N)C(=O)O Amb10845350 [0,2,0,0,0,0|1,0,0]=3 3989 B7R0.5 CNCC(O)C(=O)O Amb26894610 [0,2,0,0,0,0|1,0,0]=3 3990 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [0,2,0,0,0,0|1,0,0]=3 3991 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [0,2,0,0,0,0|1,0,0]=3 3992 B7R0.5 COCC(=O)C(C)=O Amb24694271 [0,2,0,0,0,0|0,1,1]=4 3993 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [0,2,0,0,0,0|0,1,0]=3 3994 B7R0.5 COCC(Br)C(=O)O Amb17594709 [0,2,0,0,0,0|0,1,0]=3 3995 B7R0.5 COCC(C)C(=O)O Amb33545090 [0,2,0,0,0,0|0,1,0]=3 3996 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,2,0,0,0,0|0,1,0]=3 3997 B7R0.5 COCC(C)C(N)=O Amb27401584 [0,2,0,0,0,0|0,1,0]=3 3998 B7R0.5 COCC(C)C(N)=S Amb9029622 [0,2,0,0,0,0|0,2,0]=4 3999 B7R0.5 COCC(C)S(=O)Cl Amb26920252 [0,2,0,0,0,0|1,1,0]=4 4000 B7R0.5 COCC(C)S(=O)[O-] Amb24481940 [0,2,0,0,0,0|1,1,0]=4 4001 B7R0.5 COCC(C)S(N)=O Amb32720388 [0,2,0,0,0,0|1,1,0]=4 4002 B7R0.5 COCC(Cl)C(=N)N Amb22493750 [0,2,0,0,0,0|1,1,0]=4 4003 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [0,2,0,0,0,0|0,1,0]=3 4004 B7R0.5 COCC(N)C(=O)O Amb33551350 [0,2,0,0,0,0|0,1,0]=3 4005 B7R0.5 COCC(N)C(=O)O Amb6752055 [0,2,0,0,0,0|0,1,0]=3 4006 B7R0.5 COCC(N)C(C)=O Amb27468401 [0,2,0,0,0,0|0,1,0]=3 4007 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,2,0,0,0,0|0,1,0]=3 4008 B7R0.5 COCC(N)C(N)=O Amb32693410 [0,2,0,0,0,0|0,1,0]=3 4009 B7R0.5 COCC(O)C(=N)N Amb27444847 [0,2,0,0,0,0|1,1,0]=4 4010 B7R0.5 COCC(O)C(=O)O Amb18124273 [0,2,0,0,0,0|0,1,0]=3 4011 B7R0.5 COCC(O)C(N)=O Amb28069186 [0,2,0,0,0,0|0,1,0]=3 4012 B7R0.5 COCC(S)C(=O)O Amb27763656 [0,2,0,0,0,0|0,1,0]=3 4013 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [0,2,0,0,0,0|0,1,0]=3 4014 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [0,2,0,0,0,0|0,1,0]=3 4015 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [0,2,0,0,0,0|0,1,0]=3 4016 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [0,2,0,0,0,0|0,1,0]=3 4017 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [0,2,0,0,0,0|0,1,0]=3 4018 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [0,2,0,0,0,0|0,1,0]=3 4019 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [0,2,0,0,0,0|0,1,0]=3 4020 B7R0.5 CONC(C)C(N)=O Amb27657313 [0,2,0,0,0,0|1,1,0]=4 4021 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [0,2,0,0,0,0|1,1,0]=4 4022 B7R0.5 CSCC(C)C(=O)O Amb18967825 [0,2,0,0,0,0|0,0,0]=2 4023 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [0,2,0,0,0,0|0,0,0]=2 4024 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [0,2,0,0,0,0|0,0,0]=2 4025 B7R0.5 CSCC(N)C(=O)O Amb33804791 [0,2,0,0,0,0|0,0,0]=2 4026 B7R0.5 CSCC(N)C(=O)O Amb6280829 [0,2,0,0,0,0|0,0,0]=2 4027 B7R0.5 CSCC(N)C(F)F Amb33413040 [0,2,0,0,0,0|1,0,1]=4 4028 B7R0.5 CSCC(O)C(=O)O Amb25131873 [0,2,0,0,0,0|0,0,0]=2 4029 B7R0.5 CSCC(O)C(C)=O Amb25983211 [0,2,0,0,0,0|0,0,0]=2 4030 B7R0.5 CSCC(O)C(C)C Amb27401267 [0,2,0,0,0,0|1,0,1]=4 4031 B7R0.5 CSCC(O)C(F)F Amb33411122 [0,2,0,0,0,0|1,0,1]=4 4032 B7R0.5 CSCC(O)C(N)=O Amb27168145 [0,2,0,0,0,0|0,0,0]=2 4033 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [0,2,0,0,0,0|0,0,0]=2 4034 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [0,2,0,0,0,0|0,0,0]=2 4035 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [0,2,0,0,0,0|0,0,0]=2 4036 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [0,2,0,0,0,0|0,0,0]=2 4037 B7R0.5 CS\C=C(/C)C(C)=O Amb24481401 [0,2,0,0,0,0|0,0,2]=4 4038 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [0,2,0,0,0,0|2,0,0]=4 4039 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [0,2,0,0,0,0|2,0,0]=4 4040 B7R0.5 C[C@@H](O)[C@@H](O)CC=O Amb27643485 [0,2,0,0,0,0|1,0,0]=3 4041 B7R0.5 C[C@@H](O)[C@H](O)CC=O Amb27798254 [0,2,0,0,0,0|1,0,0]=3 4042 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [0,2,0,0,0,0|2,0,0]=4 4043 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [0,2,0,0,0,0|0,1,0]=3 4044 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [0,2,0,0,0,0|0,1,0]=3 4045 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [0,2,0,0,0,0|1,0,1]=4 4046 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [0,2,0,0,0,0|1,0,1]=4 4047 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [0,2,0,0,0,0|1,0,1]=4 4048 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [0,2,0,0,0,0|1,0,1]=4 4049 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [0,2,0,0,0,0|1,0,1]=4 4050 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [0,2,0,0,0,0|1,0,1]=4 4051 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [0,2,0,0,0,0|1,0,1]=4 4052 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [0,2,0,0,0,0|2,0,0]=4 4053 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [0,2,0,0,0,0|2,0,0]=4 4054 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [0,2,0,0,0,0|2,0,0]=4 4055 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [0,2,0,0,0,0|2,0,0]=4 4056 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [0,2,0,0,0,0|2,0,0]=4 4057 B7R0.5 NC(=O)C(N)CCF Amb24391278 [0,2,0,0,0,0|2,0,0]=4 4058 B7R0.5 NC(=O)C(N)CCO Amb24481392 [0,2,0,0,0,0|2,0,0]=4 4059 B7R0.5 NC(=O)C(N)CNO Amb27396201 [0,2,0,0,0,0|2,0,0]=4 4060 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [0,2,0,0,0,0|2,0,0]=4 4061 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [0,2,0,0,0,0|2,0,0]=4 4062 B7R0.5 NC(CCF)C(=O)O Amb25889337 [0,2,0,0,0,0|2,0,0]=4 4063 B7R0.5 NC(CCF)C(=O)O Amb28934889 [0,2,0,0,0,0|2,0,0]=4 4064 B7R0.5 NC(CCO)C(=O)O Amb8514287 [0,2,0,0,0,0|2,0,0]=4 4065 B7R0.5 NC(CCS)C(=O)O Amb19267093 [0,2,0,0,0,0|2,0,0]=4 4066 B7R0.5 NC(CCS)C(=O)O Amb3499433 [0,2,0,0,0,0|2,0,0]=4 4067 B7R0.5 NC(CNO)C(=O)O Amb4092732 [0,2,0,0,0,0|2,0,0]=4 4068 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [0,2,0,0,0,0|0,2,0]=4 4069 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [0,2,0,0,0,0|2,0,0]=4 4070 B7R0.5 NCCC(F)C(=O)O Amb10838221 [0,2,0,0,0,0|2,0,0]=4 4071 B7R0.5 NCCC(F)C(=O)O Amb22229524 [0,2,0,0,0,0|2,0,0]=4 4072 B7R0.5 NCCC(N)C(=O)O Amb2697841 [0,2,0,0,0,0|2,0,0]=4 4073 B7R0.5 NCCC(N)C(=O)O Amb8514694 [0,2,0,0,0,0|2,0,0]=4 4074 B7R0.5 NCCC(O)C(=O)O Amb16232090 [0,2,0,0,0,0|2,0,0]=4 4075 B7R0.5 NCCC(O)C(N)=O Amb28121985 [0,2,0,0,0,0|2,0,0]=4 4076 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [0,2,0,0,0,0|2,0,0]=4 4077 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [0,2,0,0,0,0|2,0,0]=4 4078 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [0,2,0,0,0,0|2,0,0]=4 4079 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [0,2,0,0,0,0|2,0,0]=4 4080 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [0,2,0,0,0,0|2,0,0]=4 4081 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [0,2,0,0,0,0|2,0,0]=4 4082 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [0,2,0,0,0,0|2,0,0]=4 4083 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [0,2,0,0,0,0|2,0,0]=4 4084 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [0,2,0,0,0,0|2,0,0]=4 4085 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [0,2,0,0,0,0|2,0,0]=4 4086 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [0,2,0,0,0,0|2,0,0]=4 4087 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [0,2,0,0,0,0|2,0,0]=4 4088 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [0,2,0,0,0,0|2,0,0]=4 4089 B7R0.5 NNCC(O)C(=O)[O-] Amb27956514 [0,2,0,0,0,0|2,0,0]=4 4090 B7R0.5 NOCC(N)C(=O)O Amb24184086 [0,2,0,0,0,0|1,1,0]=4 4091 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [0,2,0,0,0,0|2,0,0]=4 4092 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [0,2,0,0,0,0|2,0,0]=4 4093 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [0,2,0,0,0,0|2,0,0]=4 4094 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [0,2,0,0,0,0|2,0,0]=4 4095 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [0,2,0,0,0,0|2,0,0]=4 4096 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [0,2,0,0,0,0|2,0,0]=4 4097 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [0,2,0,0,0,0|2,0,0]=4 4098 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [0,2,0,0,0,0|2,0,0]=4 4099 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [0,2,0,0,0,0|2,0,0]=4 4100 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [0,2,0,0,0,0|1,0,1]=4 4101 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [0,2,0,0,0,0|2,0,0]=4 4102 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [0,2,0,0,0,0|2,0,0]=4 4103 B7R0.5 O=C(Cl)C(Cl)CSCl Amb28138021 [0,2,0,0,0,0|1,0,0]=3 4104 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [0,2,0,0,0,0|2,0,0]=4 4105 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [0,2,0,0,0,0|2,0,0]=4 4106 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [0,2,0,0,0,0|2,0,0]=4 4107 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [0,2,0,0,0,0|2,0,0]=4 4108 B7R0.5 O=C(O)C(O)CCF Amb28071189 [0,2,0,0,0,0|2,0,0]=4 4109 B7R0.5 O=C(O)C(O)CCO Amb24689942 [0,2,0,0,0,0|2,0,0]=4 4110 B7R0.5 O=C(O)C(O)CNO Amb27405525 [0,2,0,0,0,0|2,0,0]=4 4111 B7R0.5 O=C(O)C(S)CCS Amb27634893 [0,2,0,0,0,0|2,0,0]=4 4112 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [0,2,0,0,0,0|2,0,0]=4 4113 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [0,2,0,0,0,0|2,0,0]=4 4114 B7R0.7 C#CCC(=O)CSC Amb27830250 [0,2,0,0,0,0|1,0,1]=4 4115 B7R0.7 C#CCC(O)CSC Amb27637452 [0,2,0,0,0,0|1,0,1]=4 4116 B7R0.7 C=C(CCN)CSC Amb33271700 [0,2,0,0,0,0|1,0,1]=4 4117 B7R0.7 C=C=C[C@H](C)CC=O Amb27947431 [0,2,0,0,0,0|1,0,1]=4 4118 B7R0.7 C=CCC(=O)COC Amb27168366 [0,2,0,0,0,0|1,1,0]=4 4119 B7R0.7 C=CCC(C)CCBr Amb25211241 [0,2,0,0,0,0|2,0,0]=4 4120 B7R0.7 C=CCC(C)CCC Amb26958532 [0,2,0,0,0,0|2,0,0]=4 4121 B7R0.7 C=CCC(C)CCCl Amb32688175 [0,2,0,0,0,0|2,0,0]=4 4122 B7R0.7 C=CCC(C)CCN Amb27596627 [0,2,0,0,0,0|2,0,0]=4 4123 B7R0.7 C=CCC(C)CCO Amb27603507 [0,2,0,0,0,0|2,0,0]=4 4124 B7R0.7 C=CCC(C)\C=C\C Amb27201351 [0,2,0,0,0,0|2,0,0]=4 4125 B7R0.7 C=CCC(N)COC Amb19018008 [0,2,0,0,0,0|1,1,0]=4 4126 B7R0.7 C=CCC(O)CCBr Amb27669769 [0,2,0,0,0,0|2,0,0]=4 4127 B7R0.7 C=CCC(O)CCC Amb4019981 [0,2,0,0,0,0|2,0,0]=4 4128 B7R0.7 C=CCC(O)CCN Amb27839044 [0,2,0,0,0,0|2,0,0]=4 4129 B7R0.7 C=CCC(O)CSC Amb27463975 [0,2,0,0,0,0|1,0,0]=3 4130 B7R0.7 C=CCC(O)\C=C\C Amb25359897 [0,2,0,0,0,0|2,0,0]=4 4131 B7R0.7 C=CC[C@@H](N)CCO Amb27398150 [0,2,0,0,0,0|2,0,0]=4 4132 B7R0.7 C=CC[C@@H](N)COC Amb28128126 [0,2,0,0,0,0|1,1,0]=4 4133 B7R0.7 C=CC[C@@H](O)CCC Amb28315693 [0,2,0,0,0,0|2,0,0]=4 4134 B7R0.7 C=CC[C@@H](O)\C=C\C Amb27410498 [0,2,0,0,0,0|2,0,0]=4 4135 B7R0.7 C=CC[C@H](N)COC Amb27851131 [0,2,0,0,0,0|1,1,0]=4 4136 B7R0.7 C=CC[C@H](O)CCC Amb27221895 [0,2,0,0,0,0|2,0,0]=4 4137 B7R0.7 C=COC(C)CNC Amb27441621 [0,2,0,0,0,0|2,0,0]=4 4138 B7R0.7 C=COC(O)CCC Amb27222270 [0,2,0,0,0,0|2,0,0]=4 4139 B7R0.7 CC(CC=O)CC=O Amb17593183 [0,2,0,0,0,0|1,0,1]=4 4140 B7R0.7 CCCC(=O)CC=N Amb28049020 [0,2,0,0,0,0|2,0,0]=4 4141 B7R0.7 CCCC(Br)N=C=O Amb27590951 [0,2,0,0,0,0|1,0,1]=4 4142 B7R0.7 CCCC(Br)\C=C\O Amb28458444 [0,2,0,0,0,0|1,0,1]=4 4143 B7R0.7 CCCC(C)CC=S Amb22168291 [0,2,0,0,0,0|1,1,0]=4 4144 B7R0.7 CCCC(C)N=C=O Amb21961819 [0,2,0,0,0,0|1,0,1]=4 4145 B7R0.7 CCCC(C)NC=O Amb27236942 [0,2,0,0,0,0|1,0,0]=3 4146 B7R0.7 CCCC(C)\C=N\O Amb28247268 [0,2,0,0,0,0|1,0,1]=4 4147 B7R0.7 CCCC(Cl)CSC Amb27966841 [0,2,0,0,0,0|1,0,1]=4 4148 B7R0.7 CCCC(N)CSC Amb18313615 [0,2,0,0,0,0|1,0,1]=4 4149 B7R0.7 CCCC(O)\C=C\F Amb27981709 [0,2,0,0,0,0|2,0,0]=4 4150 B7R0.7 CCCC(S)CC=O Amb24481552 [0,2,0,0,0,0|1,0,0]=3 4151 B7R0.7 CCC[C@@H](C)CC=O Amb27393066 [0,2,0,0,0,0|1,0,0]=3 4152 B7R0.7 CCC[C@@H](C)N=C=O Amb28128423 [0,2,0,0,0,0|1,0,1]=4 4153 B7R0.7 CCC[C@H](N)CSC Amb28206579 [0,2,0,0,0,0|1,0,1]=4 4154 B7R0.7 CCC\C(Br)=C/C=O Amb28252419 [0,2,0,0,0,0|1,0,1]=4 4155 B7R0.7 CCC\C(C)=C\C=O Amb27237056 [0,2,0,0,0,0|1,0,1]=4 4156 B7R0.7 CCNC(C)CSC Amb18313762 [0,2,0,0,0,0|1,0,1]=4 4157 B7R0.7 CCOC(=O)CC=O Amb8394868 [0,2,0,0,0,0|0,1,1]=4 4158 B7R0.7 CCOC(C)CC=O Amb25702447 [0,2,0,0,0,0|0,1,0]=3 4159 B7R0.7 CCOC(C)NC=O Amb27391666 [0,2,0,0,0,0|1,1,0]=4 4160 B7R0.7 CCSC(C)CC=O Amb22232285 [0,2,0,0,0,0|0,0,0]=2 4161 B7R0.7 CCSC(C)CCCl Amb27880855 [0,2,0,0,0,0|1,0,1]=4 4162 B7R0.7 CCSC(C)CCO Amb26655908 [0,2,0,0,0,0|0,0,2]=4 4163 B7R0.7 CCSC(C)\C=C\Cl Amb27656974 [0,2,0,0,0,0|1,0,1]=4 4164 B7R0.7 CCS\C(C)=C/C=O Amb18642814 [0,2,0,0,0,0|0,0,2]=4 4165 B7R0.7 CCS\C(C)=C\C=O Amb27482152 [0,2,0,0,0,0|0,0,2]=4 4166 B7R0.7 CNCC(=O)CSC Amb33272051 [0,2,0,0,0,0|2,0,0]=4 4167 B7R0.7 CNCC(O)CSC Amb19008591 [0,2,0,0,0,0|1,0,1]=4 4168 B7R0.7 COCC(C)N=C=O Amb23598696 [0,2,0,0,0,0|0,1,1]=4 4169 B7R0.7 COCC(C)NC=O Amb27838341 [0,2,0,0,0,0|0,1,0]=3 4170 B7R0.7 COCC(N)CSC Amb28041040 [0,2,0,0,0,0|0,0,2]=4 4171 B7R0.7 COCC(O)CSC Amb27399113 [0,2,0,0,0,0|0,0,2]=4 4172 B7R0.7 COCC(O)\C=C/Cl Amb27165704 [0,2,0,0,0,0|1,1,0]=4 4173 B7R0.7 COC\C(C)=C\C=O Amb28287378 [0,2,0,0,0,0|0,1,1]=4 4174 B7R0.7 CO\C=C(/C)CC=O Amb27643505 [0,2,0,0,0,0|0,1,1]=4 4175 B7R0.7 CSCC(=O)CCN Amb33272060 [0,2,0,0,0,0|1,0,1]=4 4176 B7R0.7 CSCC(=O)N=C=O Amb27635239 [0,2,0,0,0,0|0,0,2]=4 4177 B7R0.7 CSCC(=O)\C=C\Cl Amb35609142 [0,2,0,0,0,0|1,0,1]=4 4178 B7R0.7 CSCC(=O)\C=N\O Amb27487829 [0,2,0,0,0,0|0,0,2]=4 4179 B7R0.7 CSCC(C)CCN Amb33272059 [0,2,0,0,0,0|1,0,1]=4 4180 B7R0.7 CSCC(C)CNN Amb27968775 [0,2,0,0,0,0|1,0,1]=4 4181 B7R0.7 CSCC(C)CON Amb33271724 [0,2,0,0,0,0|0,0,2]=4 4182 B7R0.7 CSCC(C)N=C=O Amb24374153 [0,2,0,0,0,0|0,0,1]=3 4183 B7R0.7 CSCC(Cl)CC#N Amb27477909 [0,2,0,0,0,0|1,0,1]=4 4184 B7R0.7 CSCC(F)CCN Amb33225468 [0,2,0,0,0,0|1,0,1]=4 4185 B7R0.7 CSCC(N)CCO Amb19515713 [0,2,0,0,0,0|0,0,2]=4 4186 B7R0.7 CSCC(O)CC#N Amb33272906 [0,2,0,0,0,0|1,0,1]=4 4187 B7R0.7 CSCC(O)CCN Amb25078322 [0,2,0,0,0,0|1,0,1]=4 4188 B7R0.7 CSCC(O)CNN Amb17593467 [0,2,0,0,0,0|1,0,1]=4 4189 B7R0.7 CSCC(O)CSC Amb2779300 [0,2,0,0,0,0|0,1,1]=4 4190 B7R0.7 CSC[C@@H](O)CCN Amb33271743 [0,2,0,0,0,0|1,0,1]=4 4191 B7R0.7 CSC[C@H](O)CCN Amb33271745 [0,2,0,0,0,0|1,0,1]=4 4192 B7R0.7 CSC\C(C)=C\CCl Amb27254190 [0,2,0,0,0,0|1,0,1]=4 4193 B7R0.7 CSSC(C)CCO Amb27593225 [0,2,0,0,0,0|0,0,2]=4 4194 B7R0.7 C\C=C\C(Br)CCC Amb17672603 [0,2,0,0,0,0|2,0,0]=4 4195 B7R0.7 C\C=C\C(C)CC=O Amb25366468 [0,2,0,0,0,0|1,0,0]=3 4196 B7R0.7 C\C=C\C(C)CCC Amb26633016 [0,2,0,0,0,0|2,0,0]=4 4197 B7R0.7 C\C=C\C(Cl)CSC Amb27657144 [0,2,0,0,0,0|1,0,0]=3 4198 B7R0.7 C\C=C\[C@@H](C)CC=O Amb27791915 [0,2,0,0,0,0|1,0,0]=3 4199 B7R0.7 O=CCC(=O)CCO Amb28255739 [0,2,0,0,0,0|1,0,1]=4 4200 B7R0.10 C=C(C=O)[C@@H](C)CC Amb27390187 [0,2,0,0,0,0|1,0,1]=4 4201 B7R0.10 C=CC(C)C(C)CC Amb22229051 [0,2,0,0,0,0|2,0,0]=4 4202 B7R0.10 C=CC(C)C(N)CC Amb30029363 [0,2,0,0,0,0|2,0,0]=4 4203 B7R0.10 C=CC(Cl)C(C)SC Amb27231801 [0,2,0,0,0,0|1,0,0]=3 4204 B7R0.10 C=CC(Cl)C(O)CC Amb27482691 [0,2,0,0,0,0|2,0,0]=4 4205 B7R0.10 C=CC(N)C(C)CC Amb28132556 [0,2,0,0,0,0|2,0,0]=4 4206 B7R0.10 C=CC(O)C(C)CC Amb25139404 [0,2,0,0,0,0|2,0,0]=4 4207 B7R0.10 C=CC(O)[C@@H](N)CC Amb35601262 [0,2,0,0,0,0|2,0,0]=4 4208 B7R0.10 C=CC(O)[C@H](C)NC Amb35662346 [0,2,0,0,0,0|2,0,0]=4 4209 B7R0.10 C=CC(O)[C@H](N)CC Amb35659376 [0,2,0,0,0,0|2,0,0]=4 4210 B7R0.10 C=C[C@@H](C)[C@H](C)C=O Amb27947475 [0,2,0,0,0,0|1,0,1]=4 4211 B7R0.10 C=C[C@@H](C)[C@H](O)CC Amb28280923 [0,2,0,0,0,0|2,0,0]=4 4212 B7R0.10 C=C[C@@H](O)[C@H](C)NC Amb28347026 [0,2,0,0,0,0|2,0,0]=4 4213 B7R0.10 C=C[C@@H](O)[C@H](O)CC Amb28429693 [0,2,0,0,0,0|2,0,0]=4 4214 B7R0.10 C=C[C@H](C)[C@H](C)C=O Amb27631138 [0,2,0,0,0,0|1,0,1]=4 4215 B7R0.10 C=C[C@H](O)[C@H](N)CC Amb27430452 [0,2,0,0,0,0|2,0,0]=4 4216 B7R0.10 CC(C#N)C(O)C=O Amb28239484 [0,2,0,0,0,0|2,0,0]=4 4217 B7R0.10 CC(C=O)C(C)CO Amb28048946 [0,2,0,0,0,0|2,0,0]=4 4218 B7R0.10 CC(C=O)C(O)CCl Amb27776790 [0,2,0,0,0,0|2,0,0]=4 4219 B7R0.10 CC(CN)C(O)C=O Amb26370126 [0,2,0,0,0,0|2,0,0]=4 4220 B7R0.10 CCC(=O)C(Br)C=O Amb27407783 [0,2,0,0,0,0|1,0,1]=4 4221 B7R0.10 CCC(C)C(C)C=O Amb18641810 [0,2,0,0,0,0|1,0,0]=3 4222 B7R0.10 CCC(C)C(N)C=O Amb27257596 [0,2,0,0,0,0|1,0,0]=3 4223 B7R0.10 CCC(C)C(O)C=O Amb28454245 [0,2,0,0,0,0|1,0,0]=3 4224 B7R0.10 CCC(Cl)N(C)C=O Amb27649055 [0,2,0,0,0,0|2,0,0]=4 4225 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [0,2,0,0,0,0|1,0,1]=4 4226 B7R0.10 CCC(O)C(C)C=O Amb17593201 [0,2,0,0,0,0|1,0,0]=3 4227 B7R0.10 CCN(C)C(C)C=O Amb35647553 [0,2,0,0,0,0|2,0,0]=4 4228 B7R0.10 CCS(=O)C(C)C=O Amb35647337 [0,2,0,0,0,0|2,0,0]=4 4229 B7R0.10 CC[C@@H](C)[C@@H](C)C=O Amb28184530 [0,2,0,0,0,0|1,0,0]=3 4230 B7R0.10 CC[C@H](C)[C@H](N)C=O Amb28247667 [0,2,0,0,0,0|1,0,0]=3 4231 B7R0.10 COC(=O)C(Br)C=O Amb28385653 [0,2,0,0,0,0|0,1,1]=4 4232 B7R0.10 COC(=O)C(C)C=O Amb18641861 [0,2,0,0,0,0|0,1,1]=4 4233 B7R0.10 COC(=O)C(Cl)C=O Amb17621536 [0,2,0,0,0,0|0,1,1]=4 4234 B7R0.10 COC(=O)C(O)C=O Amb27468135 [0,2,0,0,0,0|0,1,1]=4 4235 B7R0.10 COC(=O)[C@@H](C)C=O Amb25107069 [0,2,0,0,0,0|0,1,1]=4 4236 B7R0.10 COC(=O)[C@H](C)C=O Amb25889345 [0,2,0,0,0,0|0,1,1]=4 4237 B7R0.10 COC(C)C(=O)C=O Amb27622168 [0,2,0,0,0,0|0,1,1]=4 4238 B7R0.10 COC(C)C(Br)C=O Amb28119865 [0,2,0,0,0,0|0,1,0]=3 4239 B7R0.10 CSC(C)C(N)C#N Amb35655727 [0,2,0,0,0,0|1,0,1]=4 4240 B7R0.10 CSC(C)C(O)C#N Amb28344951 [0,2,0,0,0,0|1,0,1]=4 4241 B7R0.10 CSC(C)C(O)CN Amb35647217 [0,2,0,0,0,0|1,0,1]=4 4242 B7R0.10 CSC(C)C(O)CO Amb27261506 [0,2,0,0,0,0|0,0,2]=4 4243 B7R0.10 O=CC(O)C(O)C=O Amb26319267 [0,2,0,0,0,0|2,0,0]=4 4244 B7R0.10 O=CC(O)C(O)CO Amb8513487 [0,2,0,0,0,0|2,0,0]=4 4245 B7R0.10 O=C[C@@H](O)[C@@H](O)CO Amb25839823 [0,2,0,0,0,0|2,0,0]=4 4246 B7R0.10 O=C[C@H](O)[C@@H](O)CO Amb24481533 [0,2,0,0,0,0|2,0,0]=4 4247 B7R0.10 O=C[C@H](O)[C@H](O)CO Amb9825398 [0,2,0,0,0,0|2,0,0]=4 4248 B7R0.11 C#CC(C)(C)CSC Amb33271727 [0,2,0,0,0,0|1,0,1]=4 4249 B7R0.11 C#CCC(C)(C)C=O Amb25309693 [0,2,0,0,0,0|1,0,1]=4 4250 B7R0.11 C=CC(C)(C)CC=O Amb17593166 [0,2,0,0,0,0|1,0,1]=4 4251 B7R0.11 C=CC(C)(C)CCC Amb22229023 [0,2,0,0,0,0|2,0,0]=4 4252 B7R0.11 C=CCC(C)(C)C=O Amb3940518 [0,2,0,0,0,0|1,0,1]=4 4253 B7R0.11 C=CCC(C)(C)CC Amb17674170 [0,2,0,0,0,0|2,0,0]=4 4254 B7R0.11 C=CCC(C)(C)OC Amb28457661 [0,2,0,0,0,0|1,1,0]=4 4255 B7R0.11 C=CCC(C)(N)CC Amb25849362 [0,2,0,0,0,0|2,0,0]=4 4256 B7R0.11 C=CCC(C)(O)CC Amb3940624 [0,2,0,0,0,0|2,0,0]=4 4257 B7R0.11 CC(C)(C#N)CC=O Amb10071050 [0,2,0,0,0,0|2,0,0]=4 4258 B7R0.11 CC(C)(C=O)CCCl Amb27436137 [0,2,0,0,0,0|2,0,0]=4 4259 B7R0.11 CC(C)(C=O)CCF Amb27760674 [0,2,0,0,0,0|2,0,0]=4 4260 B7R0.11 CC(C)(C=O)CCO Amb18641894 [0,2,0,0,0,0|2,0,0]=4 4261 B7R0.11 CC(C)(C=O)SSCl Amb28315805 [0,2,0,0,0,0|2,0,0]=4 4262 B7R0.11 CC(C)(CBr)CC=O Amb27659232 [0,2,0,0,0,0|2,0,0]=4 4263 B7R0.11 CC(C)(CO)CC=O Amb24481534 [0,2,0,0,0,0|2,0,0]=4 4264 B7R0.11 CC(O)(C=O)CC#N Amb27224713 [0,2,0,0,0,0|2,0,0]=4 4265 B7R0.11 CC(O)(C=O)CCN Amb25770524 [0,2,0,0,0,0|2,0,0]=4 4266 B7R0.11 CCC(C)(C)CC=O Amb10572829 [0,2,0,0,0,0|1,0,0]=3 4267 B7R0.11 CCC(C)(C)NC=O Amb26918304 [0,2,0,0,0,0|2,0,0]=4 4268 B7R0.11 CCC(C)(Cl)CC=O Amb27260590 [0,2,0,0,0,0|1,0,0]=3 4269 B7R0.11 CCC(F)(F)CC=O Amb35631741 [0,2,0,0,0,0|1,0,0]=3 4270 B7R0.11 CCCC(C)(C)C=O Amb18641809 [0,2,0,0,0,0|1,0,0]=3 4271 B7R0.11 CCCC(Cl)(Cl)C=O Amb2720273 [0,2,0,0,0,0|1,0,0]=3 4272 B7R0.11 CCOC(C)(C)C=O Amb25173459 [0,2,0,0,0,0|2,0,0]=4 4273 B7R0.11 CCS(=O)(=O)CC=O Amb23452894 [0,2,0,0,0,0|2,0,0]=4 4274 B7R0.11 CNC(C)(C)CSC Amb33272902 [0,2,0,0,0,0|2,0,0]=4 4275 B7R0.11 CNCC(C)(C)SC Amb27800428 [0,2,0,0,0,0|2,0,0]=4 4276 B7R0.11 COC(C)(C)CC=O Amb25715607 [0,2,0,0,0,0|0,1,0]=3 4277 B7R0.11 COCC(C)(C)C=O Amb18641883 [0,2,0,0,0,0|0,1,0]=3 4278 B7R0.11 COCC(C)(Cl)C=O Amb27794027 [0,2,0,0,0,0|0,1,0]=3 4279 B7R0.11 COP(C)(=O)CC=O Amb27192034 [0,2,0,0,0,0|1,1,0]=4 4280 B7R0.11 CSC(C)(C)CC=O Amb26015185 [0,2,0,0,0,0|0,0,0]=2 4281 B7R0.11 CSC(C)(C)CCN Amb28062776 [0,2,0,0,0,0|1,0,1]=4 4282 B7R0.11 CSC(C)(C)CCS Amb32788153 [0,2,0,0,0,0|0,1,1]=4 4283 B7R0.11 CSCC(C)(C)C#N Amb33273720 [0,2,0,0,0,0|1,0,1]=4 4284 B7R0.11 CSCC(C)(C)C=O Amb18642908 [0,2,0,0,0,0|0,0,0]=2 4285 B7R0.11 CSCC(C)(C)CBr Amb24738212 [0,2,0,0,0,0|1,0,1]=4 4286 B7R0.11 CSCC(C)(C)CN Amb27420998 [0,2,0,0,0,0|1,0,1]=4 4287 B7R0.11 CSCC(C)(C)CO Amb24430385 [0,2,0,0,0,0|0,0,2]=4 4288 B7R0.11 CSCC(C)(C)ON Amb33225467 [0,2,0,0,0,0|2,0,0]=4 4289 B7R0.11 CSCC(C)(F)CCl Amb27794365 [0,2,0,0,0,0|1,0,1]=4 4290 B7R0.11 CSCC(C)(N)C#N Amb18957582 [0,2,0,0,0,0|1,0,1]=4 4291 B7R0.11 CSCC(C)(N)C#N Amb28991393 [0,2,0,0,0,0|1,0,1]=4 4292 B7R0.11 CSCC(C)(N)CO Amb25703161 [0,2,0,0,0,0|0,0,2]=4 4293 B7R0.11 CSCC(C)(O)C#N Amb27816637 [0,2,0,0,0,0|1,0,1]=4 4294 B7R0.11 CSCC(C)(O)CN Amb19515629 [0,2,0,0,0,0|1,0,1]=4 4295 B7R0.11 CSCC(F)(F)CN Amb33413022 [0,2,0,0,0,0|1,0,1]=4 4296 B7R0.11 CSCC(F)(F)CO Amb33413026 [0,2,0,0,0,0|0,0,2]=4 4297 B7R0.11 CSSC(C)(C)C=O Amb8514922 [0,2,0,0,0,0|1,0,0]=3 4298 B7R0.11 C\C=C\C(C)(C)C=O Amb18641707 [0,2,0,0,0,0|1,0,1]=4 4299 B7R0.11 O=CC(Cl)(Cl)CCCl Amb2720197 [0,2,0,0,0,0|2,0,0]=4 4300 B7R0.12 C#CC(CC=C)NC Amb28289453 [0,2,0,0,0,0|2,0,0]=4 4301 B7R0.12 C#C[C@@H](CC=O)OC Amb27828911 [0,2,0,0,0,0|0,1,0]=3 4302 B7R0.12 C=CC(C=C)CNC Amb18641668 [0,2,0,0,0,0|2,0,0]=4 4303 B7R0.12 C=CC(CC)CCC Amb26515787 [0,2,0,0,0,0|2,0,0]=4 4304 B7R0.12 C=CC(CCC)NN Amb28197763 [0,2,0,0,0,0|2,0,0]=4 4305 B7R0.12 C=CC(CO)CCC Amb27857843 [0,2,0,0,0,0|2,0,0]=4 4306 B7R0.12 C=CCC(C=O)C=O Amb27424667 [0,2,0,0,0,0|1,0,1]=4 4307 B7R0.12 C=CCC(C=O)CCl Amb18124370 [0,2,0,0,0,0|1,0,1]=4 4308 B7R0.12 C=CCC(CC)CBr Amb27223717 [0,2,0,0,0,0|2,0,0]=4 4309 B7R0.12 C=CCC(CC)CC Amb25358315 [0,2,0,0,0,0|2,0,0]=4 4310 B7R0.12 C=CCC(CC)CCl Amb26848982 [0,2,0,0,0,0|2,0,0]=4 4311 B7R0.12 C=CCC(CC)CN Amb18641746 [0,2,0,0,0,0|2,0,0]=4 4312 B7R0.12 C=CCC(CC)CO Amb27218609 [0,2,0,0,0,0|2,0,0]=4 4313 B7R0.12 C=CCC(CC)NN Amb27815954 [0,2,0,0,0,0|2,0,0]=4 4314 B7R0.12 C=CCC(OC)OC Amb6297130 [0,2,0,0,0,0|1,1,0]=4 4315 B7R0.12 C=CC[C@H](CC)CO Amb28400708 [0,2,0,0,0,0|2,0,0]=4 4316 B7R0.12 C=C[C@H](CC)CC=O Amb27751329 [0,2,0,0,0,0|1,0,0]=3 4317 B7R0.12 CCC(C#N)NC=O Amb27839037 [0,2,0,0,0,0|2,0,0]=4 4318 B7R0.12 CCC(CC)CC=O Amb20669521 [0,2,0,0,0,0|1,0,0]=3 4319 B7R0.12 CCC(CC)OC=O Amb27668664 [0,2,0,0,0,0|2,0,0]=4 4320 B7R0.12 CCC(CC=O)OC Amb25282646 [0,2,0,0,0,0|0,1,0]=3 4321 B7R0.12 CCC(CC=O)SC Amb27794075 [0,2,0,0,0,0|0,0,0]=2 4322 B7R0.12 CCC(CSC)NC Amb19032081 [0,2,0,0,0,0|1,0,1]=4 4323 B7R0.12 CCCC(C#N)C=O Amb27408303 [0,2,0,0,0,0|1,0,0]=3 4324 B7R0.12 CCCC(C=O)C=O Amb26644051 [0,2,0,0,0,0|1,0,0]=3 4325 B7R0.12 CCCC(C=O)OC Amb25290248 [0,2,0,0,0,0|1,0,0]=3 4326 B7R0.12 CCCC(CC)SC Amb27457518 [0,2,0,0,0,0|1,0,1]=4 4327 B7R0.12 CCC[C@H](C=O)SC Amb28287171 [0,2,0,0,0,0|1,0,0]=3 4328 B7R0.12 CCC\C(C=O)=C\Cl Amb28141986 [0,2,0,0,0,0|1,0,1]=4 4329 B7R0.12 CCC\C(C=O)=C\O Amb27268562 [0,2,0,0,0,0|1,0,1]=4 4330 B7R0.12 CCOC(C=O)CO Amb27164613 [0,2,0,0,0,0|2,0,0]=4 4331 B7R0.12 CCSC(C=O)C=O Amb32682439 [0,2,0,0,0,0|2,0,0]=4 4332 B7R0.12 CC[C@H](CO)NC=O Amb27838419 [0,2,0,0,0,0|2,0,0]=4 4333 B7R0.12 CC\C(=C/C=O)SC Amb27440443 [0,2,0,0,0,0|0,0,2]=4 4334 B7R0.12 CNC(CO)CSC Amb27830294 [0,2,0,0,0,0|0,0,2]=4 4335 B7R0.12 COC(CC=O)OC Amb28193036 [0,2,0,0,0,0|0,1,0]=3 4336 B7R0.12 COC(CSC)OC Amb22043335 [0,2,0,0,0,0|2,0,0]=4 4337 B7R0.12 COC(NC=O)OC Amb28313110 [0,2,0,0,0,0|1,1,0]=4 4338 B7R0.12 COCC(CN)SC Amb27170449 [0,2,0,0,0,0|2,0,0]=4 4339 B7R0.12 CSC(CCCl)SC Amb27233375 [0,2,0,0,0,0|1,0,1]=4 4340 B7R0.12 CSCC(CN)CO Amb33225383 [0,2,0,0,0,0|0,0,2]=4 4341 B7R0.12 C\C=C(\C=O)CCC Amb27435435 [0,2,0,0,0,0|1,0,1]=4 4342 B7R0.12 C\C=C(\C=O)CSC Amb27972922 [0,2,0,0,0,0|0,0,1]=3 4343 B7R0.12 C\C=C(\CO)CSC Amb24740110 [0,2,0,0,0,0|1,0,1]=4 4344 B7R0.12 N#CCC(C#N)C=O Amb27224832 [0,2,0,0,0,0|2,0,0]=4 4345 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [0,2,0,0,0,0|1,0,1]=4 4346 B7R0.4 C#CCCCC(=O)O Amb2721705 [0,2,0,0,0,0|1,0,1]=4 4347 B7R0.4 C#CCCCC(C)=O Amb18115312 [0,2,0,0,0,0|1,0,1]=4 4348 B7R0.4 C#CCCCC(N)=O Amb27590599 [0,2,0,0,0,0|1,0,1]=4 4349 B7R0.4 C#CCCNC(C)=O Amb21942373 [0,2,0,0,0,0|1,0,1]=4 4350 B7R0.4 C#CCCNC(N)=O Amb26993283 [0,2,0,0,0,0|1,0,1]=4 4351 B7R0.4 C#CCCOC(=O)Cl Amb22360631 [0,2,0,0,0,0|1,0,1]=4 4352 B7R0.4 C#CCCOC(N)=O Amb28364943 [0,2,0,0,0,0|1,0,1]=4 4353 B7R0.4 C#CCNCC(=O)O Amb33551387 [0,2,0,0,0,0|1,0,1]=4 4354 B7R0.4 C#CCNCC(=O)O Amb6740302 [0,2,0,0,0,0|1,0,1]=4 4355 B7R0.4 C#CCOCC(=O)O Amb9208655 [0,2,0,0,0,0|1,0,1]=4 4356 B7R0.4 C#CCOCC(C)=O Amb3987398 [0,2,0,0,0,0|1,0,1]=4 4357 B7R0.4 C#CCSCC(=O)O Amb2372297 [0,2,0,0,0,0|1,0,1]=4 4358 B7R0.4 C=C(Br)CCCCBr Amb4035450 [0,2,0,0,0,0|2,0,0]=4 4359 B7R0.4 C=C(C)CC#CC=O Amb28316110 [0,2,0,0,0,0|1,0,1]=4 4360 B7R0.4 C=C(C)CCCCC Amb6298938 [0,2,0,0,0,0|2,0,0]=4 4361 B7R0.4 C=C(C)CCCCO Amb26872404 [0,2,0,0,0,0|2,0,0]=4 4362 B7R0.4 C=C(C)CCN=C=O Amb33199902 [0,2,0,0,0,0|1,0,1]=4 4363 B7R0.4 C=C(C)CCNC=O Amb27228134 [0,2,0,0,0,0|1,0,0]=3 4364 B7R0.4 C=C(C)CCOCCl Amb28366369 [0,2,0,0,0,0|1,1,0]=4 4365 B7R0.4 C=C(C)CC\C=C\C Amb25746764 [0,2,0,0,0,0|2,0,0]=4 4366 B7R0.4 C=C(C)CNCCC Amb17308631 [0,2,0,0,0,0|2,0,0]=4 4367 B7R0.4 C=C(C)COCC=O Amb27949608 [0,2,0,0,0,0|1,0,0]=3 4368 B7R0.4 C=C(C)COCOC Amb27213685 [0,2,0,0,0,0|1,1,0]=4 4369 B7R0.4 C=C(C)CONC=O Amb27620967 [0,2,0,0,0,0|2,0,0]=4 4370 B7R0.4 C=C(C)CSCCC Amb27449649 [0,2,0,0,0,0|2,0,0]=4 4371 B7R0.4 C=C(C)C\C=C\C=O Amb18640955 [0,2,0,0,0,0|1,0,1]=4 4372 B7R0.4 C=C(Cl)CCCC=O Amb27751311 [0,2,0,0,0,0|1,0,1]=4 4373 B7R0.4 C=C(Cl)CNCCC Amb19004838 [0,2,0,0,0,0|2,0,0]=4 4374 B7R0.4 C=C(F)CCCCO Amb22641473 [0,2,0,0,0,0|2,0,0]=4 4375 B7R0.4 C=C=CCCC(C)=O Amb28315801 [0,2,0,0,0,0|1,0,1]=4 4376 B7R0.4 C=CCCC=C(C)C Amb25789441 [0,2,0,0,0,0|2,0,0]=4 4377 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [0,2,0,0,0,0|1,0,1]=4 4378 B7R0.4 C=CCCCC(=O)O Amb3941675 [0,2,0,0,0,0|1,0,1]=4 4379 B7R0.4 C=CCCCC(C)=O Amb17593171 [0,2,0,0,0,0|1,0,1]=4 4380 B7R0.4 C=CCCCC(C)C Amb25127926 [0,2,0,0,0,0|2,0,0]=4 4381 B7R0.4 C=CCCCC(C)N Amb25880150 [0,2,0,0,0,0|2,0,0]=4 4382 B7R0.4 C=CCCCC(C)O Amb22059432 [0,2,0,0,0,0|2,0,0]=4 4383 B7R0.4 C=CCCNC(C)C Amb18312589 [0,2,0,0,0,0|2,0,0]=4 4384 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,2,0,0,0,0|1,0,1]=4 4385 B7R0.4 C=CCCOC(=O)Cl Amb10844792 [0,2,0,0,0,0|1,0,1]=4 4386 B7R0.4 C=CCCOC(C)=O Amb3940828 [0,2,0,0,0,0|1,0,1]=4 4387 B7R0.4 C=CCCOC(C)C Amb28184344 [0,2,0,0,0,0|1,1,0]=4 4388 B7R0.4 C=CCCSC(C)=O Amb24117956 [0,2,0,0,0,0|1,0,0]=3 4389 B7R0.4 C=CCCSC(C)C Amb27802079 [0,2,0,0,0,0|1,0,0]=3 4390 B7R0.4 C=CCNCC(=C)C Amb17308750 [0,2,0,0,0,0|2,0,0]=4 4391 B7R0.4 C=CCNCC(=O)O Amb7766404 [0,2,0,0,0,0|1,0,1]=4 4392 B7R0.4 C=CCNCC(=O)O Amb8631497 [0,2,0,0,0,0|1,0,1]=4 4393 B7R0.4 C=CCNCC(C)C Amb6683812 [0,2,0,0,0,0|2,0,0]=4 4394 B7R0.4 C=CCNCC(C)Cl Amb27658629 [0,2,0,0,0,0|2,0,0]=4 4395 B7R0.4 C=CCNCC(C)O Amb17138365 [0,2,0,0,0,0|2,0,0]=4 4396 B7R0.4 C=CCNCC(N)=O Amb6706481 [0,2,0,0,0,0|1,0,1]=4 4397 B7R0.4 C=CCNC[C@H](C)O Amb27950182 [0,2,0,0,0,0|2,0,0]=4 4398 B7R0.4 C=CCOCC(=C)C Amb26398441 [0,2,0,0,0,0|2,0,0]=4 4399 B7R0.4 C=CCOCC(=O)O Amb9208694 [0,2,0,0,0,0|1,0,1]=4 4400 B7R0.4 C=CCOCC(C)=O Amb27829146 [0,2,0,0,0,0|1,0,1]=4 4401 B7R0.4 C=CCOCC(C)O Amb22733640 [0,2,0,0,0,0|2,0,0]=4 4402 B7R0.4 C=CCOCC(N)=O Amb26859258 [0,2,0,0,0,0|1,0,1]=4 4403 B7R0.4 C=CCOC[C@@H](C)O Amb27780603 [0,2,0,0,0,0|2,0,0]=4 4404 B7R0.4 C=CCSCC(=C)C Amb28127803 [0,2,0,0,0,0|2,0,0]=4 4405 B7R0.4 C=CCSCC(=O)O Amb33526723 [0,2,0,0,0,0|1,0,1]=4 4406 B7R0.4 C=CCSCC(C)C Amb28049003 [0,2,0,0,0,0|2,0,0]=4 4407 B7R0.4 C=CCSCC(C)O Amb28065376 [0,2,0,0,0,0|2,0,0]=4 4408 B7R0.4 C=CCSC[C@@H](C)N Amb28401212 [0,2,0,0,0,0|2,0,0]=4 4409 B7R0.4 C=CCSC[C@H](C)N Amb27752407 [0,2,0,0,0,0|2,0,0]=4 4410 B7R0.4 C=CCSC[C@H](C)O Amb27220310 [0,2,0,0,0,0|2,0,0]=4 4411 B7R0.4 C=CNCCC(=O)O Amb27429817 [0,2,0,0,0,0|1,0,1]=4 4412 B7R0.4 C=COCCC(=O)O Amb28350126 [0,2,0,0,0,0|0,1,1]=4 4413 B7R0.4 C=COCCC(C)Br Amb28343139 [0,2,0,0,0,0|2,0,0]=4 4414 B7R0.4 C=COCCN(C)C Amb21618684 [0,2,0,0,0,0|2,0,0]=4 4415 B7R0.4 C=CSCCN(C)C Amb4017465 [0,2,0,0,0,0|2,0,0]=4 4416 B7R0.4 CC#CCCC(=O)O Amb3987196 [0,2,0,0,0,0|1,0,0]=3 4417 B7R0.4 CC#CCNC(C)=O Amb27758151 [0,2,0,0,0,0|1,0,1]=4 4418 B7R0.4 CC#CCOC(=O)Cl Amb22001616 [0,2,0,0,0,0|1,0,1]=4 4419 B7R0.4 CC(=O)CCCC#N Amb17106756 [0,2,0,0,0,0|1,0,1]=4 4420 B7R0.4 CC(=O)CCCCBr Amb16234126 [0,2,0,0,0,0|1,0,0]=3 4421 B7R0.4 CC(=O)CCCCCl Amb3941549 [0,2,0,0,0,0|1,0,0]=3 4422 B7R0.4 CC(=O)CCCCF Amb27490855 [0,2,0,0,0,0|1,0,0]=3 4423 B7R0.4 CC(=O)CCCCN Amb27401218 [0,2,0,0,0,0|1,0,0]=3 4424 B7R0.4 CC(=O)CCCCO Amb10603864 [0,2,0,0,0,0|1,0,0]=3 4425 B7R0.4 CC(=O)CCN=[N+]=[N-] Amb18522048 [0,2,0,0,0,0|2,0,0]=4 4426 B7R0.4 CC(=O)CCSC#N Amb28062990 [0,2,0,0,0,0|0,0,1]=3 4427 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [0,2,0,0,0,0|1,0,1]=4 4428 B7R0.4 CC(=O)CNOCO Amb27244723 [0,2,0,0,0,0|1,1,0]=4 4429 B7R0.4 CC(=O)COCCCl Amb25346574 [0,2,0,0,0,0|2,0,0]=4 4430 B7R0.4 CC(=O)COCCF Amb27463527 [0,2,0,0,0,0|2,0,0]=4 4431 B7R0.4 CC(=O)COCCO Amb28122841 [0,2,0,0,0,0|2,0,0]=4 4432 B7R0.4 CC(=O)CSCCF Amb24621173 [0,2,0,0,0,0|2,0,0]=4 4433 B7R0.4 CC(=O)CSCCN Amb17500454 [0,2,0,0,0,0|2,0,0]=4 4434 B7R0.4 CC(=O)CSCCO Amb4165952 [0,2,0,0,0,0|2,0,0]=4 4435 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [0,2,0,0,0,0|1,0,1]=4 4436 B7R0.4 CC(=O)NCCC#N Amb5787037 [0,2,0,0,0,0|2,0,0]=4 4437 B7R0.4 CC(=O)NCCC=O Amb17102165 [0,2,0,0,0,0|1,0,0]=3 4438 B7R0.4 CC(=O)NCCCBr Amb8826231 [0,2,0,0,0,0|2,0,0]=4 4439 B7R0.4 CC(=O)NCCCCl Amb3886559 [0,2,0,0,0,0|2,0,0]=4 4440 B7R0.4 CC(=O)NCCCN Amb10610286 [0,2,0,0,0,0|2,0,0]=4 4441 B7R0.4 CC(=O)NCCCN Amb6664982 [0,2,0,0,0,0|2,0,0]=4 4442 B7R0.4 CC(=O)NCCCO Amb3429354 [0,2,0,0,0,0|2,0,0]=4 4443 B7R0.4 CC(=O)NCCNN Amb24117179 [0,2,0,0,0,0|2,0,0]=4 4444 B7R0.4 CC(=O)NCCON Amb17138368 [0,2,0,0,0,0|1,1,0]=4 4445 B7R0.4 CC(=O)OCCCBr Amb26515737 [0,2,0,0,0,0|2,0,0]=4 4446 B7R0.4 CC(=O)OCCCCl Amb3940269 [0,2,0,0,0,0|2,0,0]=4 4447 B7R0.4 CC(=O)OCCCO Amb25854267 [0,2,0,0,0,0|2,0,0]=4 4448 B7R0.4 CC(=O)OCCCS Amb4018773 [0,2,0,0,0,0|2,0,0]=4 4449 B7R0.4 CC(=O)OCCNN Amb27769313 [0,2,0,0,0,0|2,0,0]=4 4450 B7R0.4 CC(=O)OCOCCl Amb27656207 [0,2,0,0,0,0|1,1,0]=4 4451 B7R0.4 CC(=O)SCCC#N Amb22351951 [0,2,0,0,0,0|1,0,1]=4 4452 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,2,0,0,0,0|0,0,0]=2 4453 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,2,0,0,0,0|1,0,1]=4 4454 B7R0.4 CC(=O)SCCCCl Amb3940270 [0,2,0,0,0,0|1,0,1]=4 4455 B7R0.4 CC(C)=CCCC=O Amb17593168 [0,2,0,0,0,0|1,0,0]=3 4456 B7R0.4 CC(C)=CCNC=O Amb27838354 [0,2,0,0,0,0|1,0,1]=4 4457 B7R0.4 CC(C)CCCC=O Amb17940235 [0,2,0,0,0,0|1,0,0]=3 4458 B7R0.4 CC(C)CCN=C=O Amb5750733 [0,2,0,0,0,0|1,0,1]=4 4459 B7R0.4 CC(C)CCNC=O Amb27460935 [0,2,0,0,0,0|1,0,0]=3 4460 B7R0.4 CC(C)CCON=O Amb7809245 [0,2,0,0,0,0|2,0,0]=4 4461 B7R0.4 CC(C)C\C=C\C=O Amb33359709 [0,2,0,0,0,0|1,0,1]=4 4462 B7R0.4 CC(C)OCCC=O Amb26443003 [0,2,0,0,0,0|0,1,0]=3 4463 B7R0.4 CC(C)SCCC#N Amb17307556 [0,2,0,0,0,0|1,0,1]=4 4464 B7R0.4 CC(C)SCCCBr Amb19053955 [0,2,0,0,0,0|1,0,1]=4 4465 B7R0.4 CC(C)SCCCN Amb10075505 [0,2,0,0,0,0|1,0,1]=4 4466 B7R0.4 CC(C)SCCCO Amb17502841 [0,2,0,0,0,0|0,0,2]=4 4467 B7R0.4 CC(C)SCCON Amb27989200 [0,2,0,0,0,0|2,0,0]=4 4468 B7R0.4 CC(Cl)CCCC=O Amb27983674 [0,2,0,0,0,0|1,0,0]=3 4469 B7R0.4 CC(O)CCCC=O Amb18641887 [0,2,0,0,0,0|1,0,0]=3 4470 B7R0.4 CC(O)CCOP=O Amb27443310 [0,2,0,0,0,0|2,0,0]=4 4471 B7R0.4 CC(O)CCO[PH2]=O Amb27594830 [0,2,0,0,0,0|2,0,0]=4 4472 B7R0.4 CC(O)CC\C=C\Cl Amb27878569 [0,2,0,0,0,0|2,0,0]=4 4473 B7R0.4 CCC#CCC(=O)O Amb26515701 [0,2,0,0,0,0|1,0,1]=4 4474 B7R0.4 CCC#CCC(C)=O Amb28040888 [0,2,0,0,0,0|1,0,1]=4 4475 B7R0.4 CCCC#CC(=O)O Amb2721706 [0,2,0,0,0,0|1,0,1]=4 4476 B7R0.4 CCCC#CC(C)=O Amb26844271 [0,2,0,0,0,0|1,0,1]=4 4477 B7R0.4 CCCC#CC(N)=O Amb27175227 [0,2,0,0,0,0|1,0,1]=4 4478 B7R0.4 CCCCC=C(C)C Amb22228888 [0,2,0,0,0,0|2,0,0]=4 4479 B7R0.4 CCCCCC(=N)N Amb19890171 [0,2,0,0,0,0|2,0,0]=4 4480 B7R0.4 CCCCCC(=N)N Amb2696574 [0,2,0,0,0,0|2,0,0]=4 4481 B7R0.4 CCCCCC(=N)N Amb35747068 [0,2,0,0,0,0|2,0,0]=4 4482 B7R0.4 CCCCCC(=O)F Amb26061517 [0,2,0,0,0,0|1,0,0]=3 4483 B7R0.4 CCCCCC(=O)O Amb3939846 [0,2,0,0,0,0|1,0,0]=3 4484 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [0,2,0,0,0,0|1,0,0]=3 4485 B7R0.4 CCCCCC(C)=O Amb6608885 [0,2,0,0,0,0|1,0,0]=3 4486 B7R0.4 CCCCCC(N)=S Amb6246072 [0,2,0,0,0,0|1,1,0]=4 4487 B7R0.4 CCCCCS(=O)Cl Amb32720370 [0,2,0,0,0,0|1,0,1]=4 4488 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [0,2,0,0,0,0|1,0,1]=4 4489 B7R0.4 CCCCCS(C)=O Amb27457494 [0,2,0,0,0,0|1,0,1]=4 4490 B7R0.4 CCCCCS(N)=O Amb32720371 [0,2,0,0,0,0|1,0,1]=4 4491 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [0,2,0,0,0,0|1,0,1]=4 4492 B7R0.4 CCCCNC(=N)N Amb19748357 [0,2,0,0,0,0|2,0,0]=4 4493 B7R0.4 CCCCNC(=N)N Amb32653258 [0,2,0,0,0,0|2,0,0]=4 4494 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,2,0,0,0,0|1,0,0]=3 4495 B7R0.4 CCCCNC(C)=N Amb27663050 [0,2,0,0,0,0|2,0,0]=4 4496 B7R0.4 CCCCNC(C)=O Amb5835711 [0,2,0,0,0,0|1,0,0]=3 4497 B7R0.4 CCCCNC(N)=O Amb6663202 [0,2,0,0,0,0|1,0,0]=3 4498 B7R0.4 CCCCNC(N)=S Amb1152044 [0,2,0,0,0,0|1,1,0]=4 4499 B7R0.4 CCCCOC(=O)Cl Amb6608833 [0,2,0,0,0,0|1,0,0]=3 4500 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [0,2,0,0,0,0|1,1,0]=4 4501 B7R0.4 CCCCOC(C)=O Amb6608782 [0,2,0,0,0,0|1,0,0]=3 4502 B7R0.4 CCCCOC(N)=O Amb4136361 [0,2,0,0,0,0|1,0,0]=3 4503 B7R0.4 CCCCO[PH](=O)O Amb26035392 [0,2,0,0,0,0|2,0,0]=4 4504 B7R0.4 CCCCSC(=N)N Amb10552525 [0,2,0,0,0,0|2,0,0]=4 4505 B7R0.4 CCCCSC(=N)N Amb4007584 [0,2,0,0,0,0|2,0,0]=4 4506 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,2,0,0,0,0|1,0,0]=3 4507 B7R0.4 CCCCSC(C)C Amb4020661 [0,2,0,0,0,0|1,0,1]=4 4508 B7R0.4 CCCCSC(C)O Amb27191967 [0,2,0,0,0,0|1,0,1]=4 4509 B7R0.4 CCCNCC(=O)O Amb10609640 [0,2,0,0,0,0|1,0,0]=3 4510 B7R0.4 CCCNCC(=O)O Amb1110628 [0,2,0,0,0,0|1,0,0]=3 4511 B7R0.4 CCCNCC(C)=O Amb26954588 [0,2,0,0,0,0|1,0,0]=3 4512 B7R0.4 CCCNCC(N)=O Amb1124632 [0,2,0,0,0,0|1,0,0]=3 4513 B7R0.4 CCCNCC(N)=O Amb28934788 [0,2,0,0,0,0|1,0,0]=3 4514 B7R0.4 CCCNNC(N)=O Amb27405031 [0,2,0,0,0,0|2,0,0]=4 4515 B7R0.4 CCCOCC(=O)Cl Amb27260778 [0,2,0,0,0,0|1,0,0]=3 4516 B7R0.4 CCCOCC(=O)O Amb8874504 [0,2,0,0,0,0|1,0,0]=3 4517 B7R0.4 CCCOCC(N)=O Amb27844884 [0,2,0,0,0,0|1,0,0]=3 4518 B7R0.4 CCCOCC(N)=S Amb8874828 [0,2,0,0,0,0|1,1,0]=4 4519 B7R0.4 CCCONC(C)=O Amb27764366 [0,2,0,0,0,0|2,0,0]=4 4520 B7R0.4 CCCONC(N)=O Amb2899788 [0,2,0,0,0,0|2,0,0]=4 4521 B7R0.4 CCCSCC(=O)O Amb1137113 [0,2,0,0,0,0|1,0,0]=3 4522 B7R0.4 CCCSCC(C)=O Amb9668676 [0,2,0,0,0,0|1,0,0]=3 4523 B7R0.4 CCCSCC(N)=O Amb27424658 [0,2,0,0,0,0|1,0,0]=3 4524 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [0,2,0,0,0,0|1,0,1]=4 4525 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [0,2,0,0,0,0|1,0,1]=4 4526 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [0,2,0,0,0,0|1,0,1]=4 4527 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,2,0,0,0,0|1,0,1]=4 4528 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [0,2,0,0,0,0|1,0,1]=4 4529 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [0,2,0,0,0,0|1,0,1]=4 4530 B7R0.4 CCNCCC(=O)O Amb28934794 [0,2,0,0,0,0|1,0,0]=3 4531 B7R0.4 CCNCCC(=O)O Amb7766402 [0,2,0,0,0,0|1,0,0]=3 4532 B7R0.4 CCNCCC(C)=O Amb18641851 [0,2,0,0,0,0|1,0,0]=3 4533 B7R0.4 CCNCCC(N)=O Amb33533384 [0,2,0,0,0,0|1,0,0]=3 4534 B7R0.4 CCNCCC(N)=O Amb35749820 [0,2,0,0,0,0|1,0,0]=3 4535 B7R0.4 CCNCCC(N)=S Amb17231882 [0,2,0,0,0,0|1,1,0]=4 4536 B7R0.4 CCNNCC(=O)O Amb28326075 [0,2,0,0,0,0|2,0,0]=4 4537 B7R0.4 CCOCCC(=N)N Amb2696677 [0,2,0,0,0,0|1,1,0]=4 4538 B7R0.4 CCOCCC(=N)N Amb33551393 [0,2,0,0,0,0|1,1,0]=4 4539 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,2,0,0,0,0|0,1,0]=3 4540 B7R0.4 CCOCCC(=O)O Amb3939859 [0,2,0,0,0,0|0,1,0]=3 4541 B7R0.4 CCOCCC(C)=O Amb7764636 [0,2,0,0,0,0|0,1,0]=3 4542 B7R0.4 CCOCCC(N)=S Amb6263797 [0,2,0,0,0,0|0,2,0]=4 4543 B7R0.4 CCOCCS(=O)Cl Amb24625733 [0,2,0,0,0,0|1,1,0]=4 4544 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [0,2,0,0,0,0|1,1,0]=4 4545 B7R0.4 CCOCCS(N)=O Amb32720346 [0,2,0,0,0,0|1,1,0]=4 4546 B7R0.4 CCOCNC(N)=O Amb25765493 [0,2,0,0,0,0|1,1,0]=4 4547 B7R0.4 CCOCOC(=O)Cl Amb27623794 [0,2,0,0,0,0|1,1,0]=4 4548 B7R0.4 CCSCCC(=N)N Amb6680836 [0,2,0,0,0,0|1,0,0]=3 4549 B7R0.4 CCSCCC(=O)O Amb6273140 [0,2,0,0,0,0|0,0,0]=2 4550 B7R0.4 CCSCCC(C)=O Amb9655821 [0,2,0,0,0,0|0,0,0]=2 4551 B7R0.4 CCSCCC(C)Br Amb33435746 [0,2,0,0,0,0|1,0,1]=4 4552 B7R0.4 CCSCCC(C)C Amb22230685 [0,2,0,0,0,0|1,0,1]=4 4553 B7R0.4 CCSCCC(C)Cl Amb28458510 [0,2,0,0,0,0|1,0,1]=4 4554 B7R0.4 CCSCCC(C)N Amb19149259 [0,2,0,0,0,0|1,0,1]=4 4555 B7R0.4 CCSCCC(C)O Amb28048927 [0,2,0,0,0,0|0,0,2]=4 4556 B7R0.4 CCSCCC(N)=O Amb27258252 [0,2,0,0,0,0|0,0,0]=2 4557 B7R0.4 CCSCCC(N)=S Amb17307560 [0,2,0,0,0,0|0,1,0]=3 4558 B7R0.4 CCSCCN(C)C Amb27198418 [0,2,0,0,0,0|2,0,0]=4 4559 B7R0.4 CCSCCN(C)O Amb33324043 [0,2,0,0,0,0|1,0,1]=4 4560 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [0,2,0,0,0,0|1,0,1]=4 4561 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [0,2,0,0,0,0|0,0,2]=4 4562 B7R0.4 CCSCC[C@H](C)N Amb33323728 [0,2,0,0,0,0|1,0,1]=4 4563 B7R0.4 CCSCC[C@H](C)O Amb33323733 [0,2,0,0,0,0|0,0,2]=4 4564 B7R0.4 CCSCC[N+](=O)[O-] Amb27838043 [0,2,0,0,0,0|1,0,0]=3 4565 B7R0.4 CCSSCC(C)=O Amb28316151 [0,2,0,0,0,0|1,0,0]=3 4566 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [0,2,0,0,0,0|0,0,2]=4 4567 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [0,2,0,0,0,0|1,0,1]=4 4568 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [0,2,0,0,0,0|1,0,1]=4 4569 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [0,2,0,0,0,0|1,0,1]=4 4570 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [0,2,0,0,0,0|1,0,1]=4 4571 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [0,2,0,0,0,0|1,0,1]=4 4572 B7R0.4 CN(C)CCCC=O Amb22753951 [0,2,0,0,0,0|1,0,0]=3 4573 B7R0.4 CN(C)CCCC=O Amb24117840 [0,2,0,0,0,0|1,0,0]=3 4574 B7R0.4 CN(C)CCN=C=O Amb19649310 [0,2,0,0,0,0|1,0,1]=4 4575 B7R0.4 CN(C)CC\C=C\Cl Amb27878814 [0,2,0,0,0,0|2,0,0]=4 4576 B7R0.4 CNCC#CC(=O)O Amb27218273 [0,2,0,0,0,0|1,0,1]=4 4577 B7R0.4 CNCCC=C(Cl)Cl Amb35710754 [0,2,0,0,0,0|2,0,0]=4 4578 B7R0.4 CNCCCC(=O)O Amb1153115 [0,2,0,0,0,0|1,0,0]=3 4579 B7R0.4 CNCCCC(=O)O Amb4521435 [0,2,0,0,0,0|1,0,0]=3 4580 B7R0.4 CNCCCC(C)=O Amb27838406 [0,2,0,0,0,0|1,0,0]=3 4581 B7R0.4 CNCCCC(N)=O Amb18303611 [0,2,0,0,0,0|1,0,0]=3 4582 B7R0.4 CNCCCC(N)=O Amb31307731 [0,2,0,0,0,0|1,0,0]=3 4583 B7R0.4 CNCCCS(C)=O Amb27827686 [0,2,0,0,0,0|1,0,1]=4 4584 B7R0.4 CNCCNC(=S)S Amb28397261 [0,2,0,0,0,0|1,1,0]=4 4585 B7R0.4 CNCCNC(C)=O Amb28934797 [0,2,0,0,0,0|1,0,0]=3 4586 B7R0.4 CNCCNC(C)=O Amb9256137 [0,2,0,0,0,0|1,0,0]=3 4587 B7R0.4 CNCCNC(N)=O Amb18299975 [0,2,0,0,0,0|1,0,0]=3 4588 B7R0.4 CNCCNS(C)=O Amb28286115 [0,2,0,0,0,0|2,0,0]=4 4589 B7R0.4 CNCCOC(C)=O Amb18124262 [0,2,0,0,0,0|1,0,0]=3 4590 B7R0.4 CNCCOC(C)=O Amb33621071 [0,2,0,0,0,0|1,0,0]=3 4591 B7R0.4 CNCCOC(N)=O Amb25136928 [0,2,0,0,0,0|1,0,0]=3 4592 B7R0.4 CNCCOC(N)=O Amb32693459 [0,2,0,0,0,0|1,0,0]=3 4593 B7R0.4 CNCCSC(=N)N Amb23590673 [0,2,0,0,0,0|2,0,0]=4 4594 B7R0.4 CNCCSC(C)C Amb19024679 [0,2,0,0,0,0|2,0,0]=4 4595 B7R0.4 CNCCSC(F)F Amb27483417 [0,2,0,0,0,0|2,0,0]=4 4596 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [0,2,0,0,0,0|1,0,1]=4 4597 B7R0.4 COCC#CC(=O)O Amb33544473 [0,2,0,0,0,0|0,1,1]=4 4598 B7R0.4 COCC#CC(C)=O Amb28053950 [0,2,0,0,0,0|0,1,1]=4 4599 B7R0.4 COCC#CC(N)=O Amb33495809 [0,2,0,0,0,0|0,1,1]=4 4600 B7R0.4 COCCCC(=N)N Amb19269156 [0,2,0,0,0,0|1,1,0]=4 4601 B7R0.4 COCCCC(=N)N Amb6266770 [0,2,0,0,0,0|1,1,0]=4 4602 B7R0.4 COCCCC(=O)O Amb6275629 [0,2,0,0,0,0|0,1,0]=3 4603 B7R0.4 COCCCC(C)=O Amb9031556 [0,2,0,0,0,0|0,1,0]=3 4604 B7R0.4 COCCCC(N)=S Amb6270649 [0,2,0,0,0,0|0,2,0]=4 4605 B7R0.4 COCCCS(=O)Cl Amb26013061 [0,2,0,0,0,0|0,1,1]=4 4606 B7R0.4 COCCCS(=O)[O-] Amb27974844 [0,2,0,0,0,0|0,1,1]=4 4607 B7R0.4 COCCCS(N)=O Amb32720360 [0,2,0,0,0,0|0,1,1]=4 4608 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [0,2,0,0,0,0|0,1,1]=4 4609 B7R0.4 COCCNC(=N)N Amb22587024 [0,2,0,0,0,0|1,1,0]=4 4610 B7R0.4 COCCNC(=N)N Amb33547913 [0,2,0,0,0,0|1,1,0]=4 4611 B7R0.4 COCCNC(=N)N Amb845676 [0,2,0,0,0,0|1,1,0]=4 4612 B7R0.4 COCCNC(C)=O Amb3358082 [0,2,0,0,0,0|0,1,0]=3 4613 B7R0.4 COCCNC(N)=O Amb1104938 [0,2,0,0,0,0|0,1,0]=3 4614 B7R0.4 COCCNC(N)=S Amb379929 [0,2,0,0,0,0|0,2,0]=4 4615 B7R0.4 COCCOC(=O)Cl Amb2689125 [0,2,0,0,0,0|0,1,0]=3 4616 B7R0.4 COCCOC(=S)[S-] Amb20671928 [0,2,0,0,0,0|0,2,0]=4 4617 B7R0.4 COCCOC(C)=O Amb4037074 [0,2,0,0,0,0|0,1,0]=3 4618 B7R0.4 COCCOC(N)=O Amb25054225 [0,2,0,0,0,0|0,1,0]=3 4619 B7R0.4 COCCSC(=N)N Amb20675994 [0,2,0,0,0,0|1,1,0]=4 4620 B7R0.4 COCOCC(=N)N Amb27259902 [0,2,0,0,0,0|1,1,0]=4 4621 B7R0.4 COCOCC(=N)N Amb28934863 [0,2,0,0,0,0|1,1,0]=4 4622 B7R0.4 COCOCC(=O)O Amb28059312 [0,2,0,0,0,0|0,1,0]=3 4623 B7R0.4 COCSCC(=O)O Amb27466837 [0,2,0,0,0,0|0,1,0]=3 4624 B7R0.4 COC\C=C\C(=O)O Amb33986212 [0,2,0,0,0,0|0,1,1]=4 4625 B7R0.4 COC\C=C\C(C)=O Amb33359822 [0,2,0,0,0,0|0,1,1]=4 4626 B7R0.4 COC\C=C\[N+](=O)[O-] Amb33428677 [0,2,0,0,0,0|0,1,1]=4 4627 B7R0.4 CONCCS(C)=O Amb27469149 [0,2,0,0,0,0|1,1,0]=4 4628 B7R0.4 CS(=O)CCCCBr Amb27874454 [0,2,0,0,0,0|2,0,0]=4 4629 B7R0.4 CS(=O)CCCCCl Amb27253421 [0,2,0,0,0,0|2,0,0]=4 4630 B7R0.4 CS(=O)CCCCN Amb17617794 [0,2,0,0,0,0|2,0,0]=4 4631 B7R0.4 CS(=O)CCN=C=O Amb27169747 [0,2,0,0,0,0|0,0,2]=4 4632 B7R0.4 CSCCCC(=N)N Amb27829199 [0,2,0,0,0,0|1,0,0]=3 4633 B7R0.4 CSCCCC(=O)O Amb17503622 [0,2,0,0,0,0|0,0,0]=2 4634 B7R0.4 CSCCCC(C)=O Amb25122381 [0,2,0,0,0,0|0,0,0]=2 4635 B7R0.4 CSCCCC(C)Br Amb27798199 [0,2,0,0,0,0|1,0,1]=4 4636 B7R0.4 CSCCCC(C)C Amb28289938 [0,2,0,0,0,0|1,0,1]=4 4637 B7R0.4 CSCCCC(C)N Amb18124381 [0,2,0,0,0,0|1,0,1]=4 4638 B7R0.4 CSCCCC(C)O Amb25958947 [0,2,0,0,0,0|0,0,2]=4 4639 B7R0.4 CSCCCC(N)=S Amb28048945 [0,2,0,0,0,0|0,1,0]=3 4640 B7R0.4 CSCCCN(C)O Amb33198763 [0,2,0,0,0,0|0,0,2]=4 4641 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [0,2,0,0,0,0|1,0,1]=4 4642 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [0,2,0,0,0,0|0,0,2]=4 4643 B7R0.4 CSCCC[C@H](C)N Amb33200176 [0,2,0,0,0,0|1,0,1]=4 4644 B7R0.4 CSCCC[C@H](C)O Amb33198288 [0,2,0,0,0,0|0,0,2]=4 4645 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [0,2,0,0,0,0|0,0,1]=3 4646 B7R0.4 CSCCNC(=O)Cl Amb29882959 [0,2,0,0,0,0|0,0,0]=2 4647 B7R0.4 CSCCNC(C)=O Amb8504699 [0,2,0,0,0,0|0,0,0]=2 4648 B7R0.4 CSCCNC(N)=O Amb27424586 [0,2,0,0,0,0|0,0,0]=2 4649 B7R0.4 CSCCNC(N)=S Amb24414359 [0,2,0,0,0,0|0,1,0]=3 4650 B7R0.4 CSCCSC(=N)N Amb27984752 [0,2,0,0,0,0|1,0,0]=3 4651 B7R0.4 CSCCSC(C)=O Amb27635033 [0,2,0,0,0,0|0,0,0]=2 4652 B7R0.4 CSCSCC(=O)O Amb27858824 [0,2,0,0,0,0|0,0,0]=2 4653 B7R0.4 CSCSCC(C)C Amb28324036 [0,2,0,0,0,0|1,0,1]=4 4654 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [0,2,0,0,0,0|0,0,1]=3 4655 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [0,2,0,0,0,0|0,0,1]=3 4656 B7R0.4 CSC\C=C\C(C)Cl Amb27267373 [0,2,0,0,0,0|1,0,1]=4 4657 B7R0.4 CSC\C=C\C(C)N Amb33269663 [0,2,0,0,0,0|1,0,1]=4 4658 B7R0.4 CSC\C=C\[N+](=O)[O-] Amb33271736 [0,2,0,0,0,0|0,0,1]=3 4659 B7R0.4 CSSCCC(=O)O Amb26848465 [0,2,0,0,0,0|0,0,0]=2 4660 B7R0.4 CSSCCC(C)N Amb28316247 [0,2,0,0,0,0|1,0,1]=4 4661 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [0,2,0,0,0,0|0,0,1]=3 4662 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [0,2,0,0,0,0|1,0,0]=3 4663 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [0,2,0,0,0,0|1,0,0]=3 4664 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [0,2,0,0,0,0|1,0,0]=3 4665 B7R0.4 C\C=C\CCC(C)Br Amb25889216 [0,2,0,0,0,0|2,0,0]=4 4666 B7R0.4 C\C=C\CCC(C)C Amb24401080 [0,2,0,0,0,0|2,0,0]=4 4667 B7R0.4 C\C=C\CCC(C)N Amb27838292 [0,2,0,0,0,0|2,0,0]=4 4668 B7R0.4 C\C=C\CCC(C)O Amb32665057 [0,2,0,0,0,0|2,0,0]=4 4669 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [0,2,0,0,0,0|2,0,0]=4 4670 B7R0.4 C\C=C\CNC(=O)S Amb26417290 [0,2,0,0,0,0|1,0,1]=4 4671 B7R0.4 C\C=C\COC(C)=O Amb6366590 [0,2,0,0,0,0|1,0,1]=4 4672 B7R0.4 N#CCCCC(=O)O Amb33542831 [0,2,0,0,0,0|1,0,1]=4 4673 B7R0.4 N#CCSCC(=O)O Amb6243720 [0,2,0,0,0,0|2,0,0]=4 4674 B7R0.4 N#CNCCC(=O)O Amb30031691 [0,2,0,0,0,0|1,0,1]=4 4675 B7R0.4 N=C(N)CCCCBr Amb4297024 [0,2,0,0,0,0|2,0,0]=4 4676 B7R0.4 N=C(N)CCCCCl Amb4297063 [0,2,0,0,0,0|2,0,0]=4 4677 B7R0.4 N=C(N)CCCCF Amb27486600 [0,2,0,0,0,0|2,0,0]=4 4678 B7R0.4 N=C(N)CCCCN Amb25714813 [0,2,0,0,0,0|2,0,0]=4 4679 B7R0.4 N=C(N)CCCCN Amb33299438 [0,2,0,0,0,0|2,0,0]=4 4680 B7R0.4 NC(=O)CCCCBr Amb27875083 [0,2,0,0,0,0|1,0,0]=3 4681 B7R0.4 NC(=O)CCCCCl Amb7782532 [0,2,0,0,0,0|1,0,0]=3 4682 B7R0.4 NC(=O)CCCCO Amb3939470 [0,2,0,0,0,0|1,0,0]=3 4683 B7R0.4 NC(=O)CCCCS Amb27839239 [0,2,0,0,0,0|1,0,0]=3 4684 B7R0.4 NC(=O)CCSCCl Amb27430706 [0,2,0,0,0,0|0,0,0]=2 4685 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,2,0,0,0,0|1,0,1]=4 4686 B7R0.4 NC(=O)CNCCO Amb6714605 [0,2,0,0,0,0|2,0,0]=4 4687 B7R0.4 NC(=O)COCCBr Amb25133475 [0,2,0,0,0,0|2,0,0]=4 4688 B7R0.4 NC(=O)COCCCl Amb5722397 [0,2,0,0,0,0|2,0,0]=4 4689 B7R0.4 NC(=O)CSCCBr Amb28193514 [0,2,0,0,0,0|2,0,0]=4 4690 B7R0.4 NC(=O)CSCCO Amb6754148 [0,2,0,0,0,0|2,0,0]=4 4691 B7R0.4 NC(=O)CSCCS Amb27651871 [0,2,0,0,0,0|2,0,0]=4 4692 B7R0.4 NC(=O)NCCCF Amb27396406 [0,2,0,0,0,0|2,0,0]=4 4693 B7R0.4 NC(=O)NCCCO Amb9248133 [0,2,0,0,0,0|2,0,0]=4 4694 B7R0.4 NC(=O)NCCN=O Amb27796959 [0,2,0,0,0,0|2,0,0]=4 4695 B7R0.4 NC(=O)OCCCBr Amb28316236 [0,2,0,0,0,0|2,0,0]=4 4696 B7R0.4 NC(=S)CCCCBr Amb27622634 [0,2,0,0,0,0|1,1,0]=4 4697 B7R0.4 NC(=S)CCCCCl Amb25177620 [0,2,0,0,0,0|1,1,0]=4 4698 B7R0.4 NC(=S)CCNC=O Amb27395809 [0,2,0,0,0,0|2,0,0]=4 4699 B7R0.4 NC(=S)SCCC=O Amb27839069 [0,2,0,0,0,0|0,0,1]=3 4700 B7R0.4 NCC#CCC(=O)O Amb27976019 [0,2,0,0,0,0|1,0,1]=4 4701 B7R0.4 NCCCCC(=O)Cl Amb26599615 [0,2,0,0,0,0|1,0,0]=3 4702 B7R0.4 NCCCCC(=O)O Amb2780021 [0,2,0,0,0,0|1,0,0]=3 4703 B7R0.4 NCCCCC(=O)O Amb3941646 [0,2,0,0,0,0|1,0,0]=3 4704 B7R0.4 NCCCCC(=O)O Amb9825855 [0,2,0,0,0,0|1,0,0]=3 4705 B7R0.4 NCCCCC(N)=O Amb18641897 [0,2,0,0,0,0|1,0,0]=3 4706 B7R0.4 NCCCCC(N)=O Amb33552086 [0,2,0,0,0,0|1,0,0]=3 4707 B7R0.4 NCCCCS(=O)O Amb27882127 [0,2,0,0,0,0|2,0,0]=4 4708 B7R0.4 NCCCNC(=O)O Amb24093884 [0,2,0,0,0,0|2,0,0]=4 4709 B7R0.4 NCCCNC(=O)S Amb27839485 [0,2,0,0,0,0|2,0,0]=4 4710 B7R0.4 NCCCNC(N)=O Amb18296186 [0,2,0,0,0,0|2,0,0]=4 4711 B7R0.4 NCCCNC(N)=O Amb20622408 [0,2,0,0,0,0|2,0,0]=4 4712 B7R0.4 NCCCOC(N)=O Amb26334419 [0,2,0,0,0,0|2,0,0]=4 4713 B7R0.4 NCCCOC(N)=O Amb33299259 [0,2,0,0,0,0|2,0,0]=4 4714 B7R0.4 NCCNCC(=O)O Amb17608063 [0,2,0,0,0,0|2,0,0]=4 4715 B7R0.4 NCCNCC(=O)O Amb33339058 [0,2,0,0,0,0|2,0,0]=4 4716 B7R0.4 NCCNCC(N)=O Amb28388338 [0,2,0,0,0,0|2,0,0]=4 4717 B7R0.4 NCCOCC(=O)O Amb18630146 [0,2,0,0,0,0|2,0,0]=4 4718 B7R0.4 NCCOCC(=O)O Amb33550947 [0,2,0,0,0,0|2,0,0]=4 4719 B7R0.4 NCCOCC(N)=O Amb18523830 [0,2,0,0,0,0|2,0,0]=4 4720 B7R0.4 NCCOCC(N)=O Amb33549549 [0,2,0,0,0,0|2,0,0]=4 4721 B7R0.4 NCCSCC(=O)O Amb17500446 [0,2,0,0,0,0|2,0,0]=4 4722 B7R0.4 NCCSCC(=O)O Amb20622325 [0,2,0,0,0,0|2,0,0]=4 4723 B7R0.4 NCCSCC(N)=O Amb6266329 [0,2,0,0,0,0|2,0,0]=4 4724 B7R0.4 NOCCCC(=O)O Amb10975956 [0,2,0,0,0,0|1,1,0]=4 4725 B7R0.4 NOCCCC(=O)O Amb22011795 [0,2,0,0,0,0|1,1,0]=4 4726 B7R0.4 NOCCCC(=O)O Amb31283653 [0,2,0,0,0,0|1,1,0]=4 4727 B7R0.4 NS(=O)CCCCCl Amb32720307 [0,2,0,0,0,0|2,0,0]=4 4728 B7R0.4 NS(=O)CCCCF Amb32720393 [0,2,0,0,0,0|2,0,0]=4 4729 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [0,2,0,0,0,0|1,0,0]=3 4730 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [0,2,0,0,0,0|1,0,0]=3 4731 B7R0.4 O=C(Cl)COCCCl Amb17610887 [0,2,0,0,0,0|2,0,0]=4 4732 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [0,2,0,0,0,0|2,0,0]=4 4733 B7R0.4 O=C(Cl)NCCCF Amb35633310 [0,2,0,0,0,0|2,0,0]=4 4734 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [0,2,0,0,0,0|2,0,0]=4 4735 B7R0.4 O=C(Cl)OCCCF Amb26994902 [0,2,0,0,0,0|2,0,0]=4 4736 B7R0.4 O=C(O)CCCCBr Amb6608763 [0,2,0,0,0,0|1,0,0]=3 4737 B7R0.4 O=C(O)CCCCCl Amb3940369 [0,2,0,0,0,0|1,0,0]=3 4738 B7R0.4 O=C(O)CCCCF Amb26639920 [0,2,0,0,0,0|1,0,0]=3 4739 B7R0.4 O=C(O)CCCCO Amb9214971 [0,2,0,0,0,0|1,0,0]=3 4740 B7R0.4 O=C(O)CCCCS Amb17503767 [0,2,0,0,0,0|1,0,0]=3 4741 B7R0.4 O=C(O)CCCNCl Amb27173950 [0,2,0,0,0,0|2,0,0]=4 4742 B7R0.4 O=C(O)CCN=C=S Amb24562253 [0,2,0,0,0,0|1,0,1]=4 4743 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [0,2,0,0,0,0|1,0,1]=4 4744 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [0,2,0,0,0,0|2,0,0]=4 4745 B7R0.4 O=C(O)CNCCF Amb28076282 [0,2,0,0,0,0|2,0,0]=4 4746 B7R0.4 O=C(O)CNCCO Amb9325653 [0,2,0,0,0,0|2,0,0]=4 4747 B7R0.4 O=C(O)COCCCl Amb21857870 [0,2,0,0,0,0|2,0,0]=4 4748 B7R0.4 O=C(O)COCCF Amb27866609 [0,2,0,0,0,0|2,0,0]=4 4749 B7R0.4 O=C(O)COCCO Amb6680914 [0,2,0,0,0,0|2,0,0]=4 4750 B7R0.4 O=C(O)CSCCCl Amb18644703 [0,2,0,0,0,0|2,0,0]=4 4751 B7R0.4 O=C(O)CSSCCl Amb27983630 [0,2,0,0,0,0|1,0,0]=3 4752 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [0,2,0,0,0,0|1,0,1]=4 4753 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [0,2,0,0,0,0|1,0,1]=4 4754 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [0,2,0,0,0,0|1,0,1]=4 4755 B7R0.4 O=C([O-])CCCCF Amb33527827 [0,2,0,0,0,0|1,0,0]=3 4756 B7R0.4 O=C([O-])CCCCO Amb13952763 [0,2,0,0,0,0|1,0,0]=3 4757 B7R0.4 O=C([O-])CCCCO Amb22749314 [0,2,0,0,0,0|1,0,0]=3 4758 B7R0.4 O=C([O-])COCCO Amb33553026 [0,2,0,0,0,0|2,0,0]=4 4759 B7R0.4 O=C=NCCC(=O)Cl Amb17593404 [0,2,0,0,0,0|1,0,1]=4 4760 B7R0.4 O=C=NCCC(=O)O Amb26053417 [0,2,0,0,0,0|1,0,1]=4 4761 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,2,0,0,0,0|1,0,1]=4 4762 B7R0.4 O=CCCCC(F)F Amb25243487 [0,2,0,0,0,0|1,0,0]=3 4763 B7R0.4 O=CCCCC(O)O Amb25889261 [0,2,0,0,0,0|1,0,0]=3 4764 B7R0.4 O=CNCCC(=O)O Amb18290434 [0,2,0,0,0,0|1,0,1]=4 4765 B7R0.4 O=NSCCC(=O)O Amb28429846 [0,2,0,0,0,0|1,0,0]=3 4766 B7R0.4 O=S(Cl)CCCCCl Amb32720306 [0,2,0,0,0,0|2,0,0]=4 4767 B7R0.4 O=S(Cl)CCCCF Amb32720392 [0,2,0,0,0,0|2,0,0]=4 4768 B7R0.4 O=S([O-])CCCCCl Amb28400114 [0,2,0,0,0,0|2,0,0]=4 4769 B7R0.4 O=S([O-])CCCCF Amb32754733 [0,2,0,0,0,0|2,0,0]=4 4770 B7R0.4 O=S([O-])CCCCO Amb27181023 [0,2,0,0,0,0|2,0,0]=4 4771 B7R0.4 O=[N+]([O-])CCCCF Amb33171716 [0,2,0,0,0,0|2,0,0]=4 4772 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [0,2,0,0,0,0|2,0,0]=4 4773 B7R0.4 [N-]=[N+]=NCCC(=O)Cl Amb27831534 [0,2,0,0,0,0|2,0,0]=4 4774 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [0,2,0,0,0,0|2,0,0]=4 4775 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,2,0,0,0,0|1,0,1]=4 4776 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,2,0,0,0,0|1,0,0]=3 4777 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,2,0,0,0,0|1,0,0]=3 4778 B7R0.6 C=C(C)CCC(C)Br Amb27878705 [0,2,0,0,0,0|2,0,0]=4 4779 B7R0.6 C=C(C)CCC(C)N Amb18641752 [0,2,0,0,0,0|2,0,0]=4 4780 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,2,0,0,0,0|2,0,0]=4 4781 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,2,0,0,0,0|1,0,0]=3 4782 B7R0.6 C=C(C)CCN(C)C Amb28187650 [0,2,0,0,0,0|2,0,0]=4 4783 B7R0.6 C=C(C)CC[C@@H](C)N Amb33199549 [0,2,0,0,0,0|2,0,0]=4 4784 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,2,0,0,0,0|2,0,0]=4 4785 B7R0.6 C=C(C)CC[C@H](C)N Amb33199548 [0,2,0,0,0,0|2,0,0]=4 4786 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,2,0,0,0,0|2,0,0]=4 4787 B7R0.6 C=C(C)CC[N+](=O)[O-] Amb33199531 [0,2,0,0,0,0|2,0,0]=4 4788 B7R0.6 C=C(C)CNC(N)=O Amb28385347 [0,2,0,0,0,0|2,0,0]=4 4789 B7R0.6 C=C(C)COC(C)=O Amb16187121 [0,2,0,0,0,0|2,0,0]=4 4790 B7R0.6 C=C(C)COC(N)=O Amb4017509 [0,2,0,0,0,0|2,0,0]=4 4791 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,2,0,0,0,0|2,0,0]=4 4792 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [0,2,0,0,0,0|2,0,0]=4 4793 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,2,0,0,0,0|1,0,1]=4 4794 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,2,0,0,0,0|1,0,1]=4 4795 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,2,0,0,0,0|1,0,1]=4 4796 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [0,2,0,0,0,0|2,0,0]=4 4797 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,2,0,0,0,0|1,0,1]=4 4798 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,2,0,0,0,0|2,0,0]=4 4799 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,2,0,0,0,0|1,0,0]=3 4800 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [0,2,0,0,0,0|1,1,0]=4 4801 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [0,2,0,0,0,0|1,0,0]=3 4802 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [0,2,0,0,0,0|1,0,0]=3 4803 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,2,0,0,0,0|1,0,0]=3 4804 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,2,0,0,0,0|1,0,0]=3 4805 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,2,0,0,0,0|1,0,0]=3 4806 B7R0.6 CC(=O)CCC(F)F Amb27413848 [0,2,0,0,0,0|2,0,0]=4 4807 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [0,2,0,0,0,0|1,0,0]=3 4808 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [0,2,0,0,0,0|1,0,1]=4 4809 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,2,0,0,0,0|1,0,0]=3 4810 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,2,0,0,0,0|1,0,0]=3 4811 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,2,0,0,0,0|1,0,0]=3 4812 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [0,2,0,0,0,0|2,0,0]=4 4813 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [0,2,0,0,0,0|2,0,0]=4 4814 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,2,0,0,0,0|2,0,0]=4 4815 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,2,0,0,0,0|2,0,0]=4 4816 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [0,2,0,0,0,0|1,0,1]=4 4817 B7R0.6 CC(=O)COC(C)=O Amb8517567 [0,2,0,0,0,0|2,0,0]=4 4818 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,2,0,0,0,0|2,0,0]=4 4819 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,2,0,0,0,0|2,0,0]=4 4820 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,2,0,0,0,0|1,0,1]=4 4821 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,2,0,0,0,0|2,0,0]=4 4822 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,2,0,0,0,0|2,0,0]=4 4823 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,2,0,0,0,0|2,0,0]=4 4824 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,2,0,0,0,0|2,0,0]=4 4825 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [0,2,0,0,0,0|2,0,0]=4 4826 B7R0.6 CC(=O)NCN(C)C Amb27838840 [0,2,0,0,0,0|2,0,0]=4 4827 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [0,2,0,0,0,0|2,0,0]=4 4828 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,2,0,0,0,0|2,0,0]=4 4829 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,2,0,0,0,0|2,0,0]=4 4830 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,2,0,0,0,0|2,0,0]=4 4831 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,2,0,0,0,0|2,0,0]=4 4832 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,2,0,0,0,0|2,0,0]=4 4833 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,2,0,0,0,0|2,0,0]=4 4834 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,2,0,0,0,0|2,0,0]=4 4835 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,2,0,0,0,0|2,0,0]=4 4836 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,2,0,0,0,0|2,0,0]=4 4837 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,2,0,0,0,0|2,0,0]=4 4838 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,2,0,0,0,0|2,0,0]=4 4839 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,2,0,0,0,0|1,0,0]=3 4840 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [0,2,0,0,0,0|1,0,1]=4 4841 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [0,2,0,0,0,0|1,0,1]=4 4842 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [0,2,0,0,0,0|2,0,0]=4 4843 B7R0.6 CC(C)CCC(=N)N Amb19890005 [0,2,0,0,0,0|2,0,0]=4 4844 B7R0.6 CC(C)CCC(=N)N Amb6266403 [0,2,0,0,0,0|2,0,0]=4 4845 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,2,0,0,0,0|1,0,0]=3 4846 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,2,0,0,0,0|1,0,0]=3 4847 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,2,0,0,0,0|1,0,0]=3 4848 B7R0.6 CC(C)CCC(N)=S Amb6248593 [0,2,0,0,0,0|1,1,0]=4 4849 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [0,2,0,0,0,0|2,0,0]=4 4850 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [0,2,0,0,0,0|2,0,0]=4 4851 B7R0.6 CC(C)CCS(N)=O Amb32720359 [0,2,0,0,0,0|2,0,0]=4 4852 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [0,2,0,0,0,0|2,0,0]=4 4853 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,2,0,0,0,0|2,0,0]=4 4854 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,2,0,0,0,0|2,0,0]=4 4855 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [0,2,0,0,0,0|2,0,0]=4 4856 B7R0.6 CC(C)COC(N)=O Amb4020010 [0,2,0,0,0,0|2,0,0]=4 4857 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,2,0,0,0,0|2,0,0]=4 4858 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,2,0,0,0,0|2,0,0]=4 4859 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,2,0,0,0,0|2,0,0]=4 4860 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,2,0,0,0,0|2,0,0]=4 4861 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,2,0,0,0,0|2,0,0]=4 4862 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,2,0,0,0,0|2,0,0]=4 4863 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,2,0,0,0,0|2,0,0]=4 4864 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,2,0,0,0,0|2,0,0]=4 4865 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,2,0,0,0,0|2,0,0]=4 4866 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,2,0,0,0,0|2,0,0]=4 4867 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,2,0,0,0,0|1,0,0]=3 4868 B7R0.6 CC(Cl)CCS(=O)Cl Amb32720414 [0,2,0,0,0,0|2,0,0]=4 4869 B7R0.6 CC(Cl)CCS(=O)[O-] Amb32755731 [0,2,0,0,0,0|2,0,0]=4 4870 B7R0.6 CC(Cl)CCS(N)=O Amb32720415 [0,2,0,0,0,0|2,0,0]=4 4871 B7R0.6 CC(F)CCS(=O)Cl Amb32720694 [0,2,0,0,0,0|2,0,0]=4 4872 B7R0.6 CC(F)CCS(=O)[O-] Amb32754854 [0,2,0,0,0,0|2,0,0]=4 4873 B7R0.6 CC(F)CCS(N)=O Amb32720695 [0,2,0,0,0,0|2,0,0]=4 4874 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,2,0,0,0,0|1,0,0]=3 4875 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,2,0,0,0,0|1,0,0]=3 4876 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,2,0,0,0,0|1,0,0]=3 4877 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,2,0,0,0,0|2,0,0]=4 4878 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,2,0,0,0,0|2,0,0]=4 4879 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,2,0,0,0,0|2,0,0]=4 4880 B7R0.6 CC(N)CC[N+](=O)[O-] Amb33745572 [0,2,0,0,0,0|2,0,0]=4 4881 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,2,0,0,0,0|2,0,0]=4 4882 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,2,0,0,0,0|2,0,0]=4 4883 B7R0.6 CC(N)COC(N)=O Amb29849466 [0,2,0,0,0,0|2,0,0]=4 4884 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,2,0,0,0,0|2,0,0]=4 4885 B7R0.6 CC(O)CCC(=N)N Amb29849256 [0,2,0,0,0,0|2,0,0]=4 4886 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,2,0,0,0,0|1,0,0]=3 4887 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,2,0,0,0,0|1,0,0]=3 4888 B7R0.6 CC(O)CCC(N)=S Amb28078352 [0,2,0,0,0,0|1,1,0]=4 4889 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [0,2,0,0,0,0|2,0,0]=4 4890 B7R0.6 CC(O)COC(N)=O Amb26359577 [0,2,0,0,0,0|2,0,0]=4 4891 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,2,0,0,0,0|1,0,0]=3 4892 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,2,0,0,0,0|1,0,0]=3 4893 B7R0.6 CN(C)CCC(=N)N Amb2695941 [0,2,0,0,0,0|2,0,0]=4 4894 B7R0.6 CN(C)CCC(=N)N Amb33551563 [0,2,0,0,0,0|2,0,0]=4 4895 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,2,0,0,0,0|1,0,0]=3 4896 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,2,0,0,0,0|1,0,0]=3 4897 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,2,0,0,0,0|1,0,0]=3 4898 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,2,0,0,0,0|1,0,0]=3 4899 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,2,0,0,0,0|1,0,0]=3 4900 B7R0.6 CN(C)CCC(N)=S Amb6268885 [0,2,0,0,0,0|1,1,0]=4 4901 B7R0.6 CN(C)CCC(N)=S Amb6893069 [0,2,0,0,0,0|1,1,0]=4 4902 B7R0.6 CN(C)CCS(=O)[O-] Amb32754654 [0,2,0,0,0,0|2,0,0]=4 4903 B7R0.6 CN(C)CCS(C)=O Amb27811384 [0,2,0,0,0,0|2,0,0]=4 4904 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,2,0,0,0,0|2,0,0]=4 4905 B7R0.6 CN(C)SCC(N)=O Amb27838357 [0,2,0,0,0,0|2,0,0]=4 4906 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,2,0,0,0,0|1,0,0]=3 4907 B7R0.6 CN(O)CCC(N)=O Amb27390605 [0,2,0,0,0,0|1,0,0]=3 4908 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,2,0,0,0,0|0,0,1]=3 4909 B7R0.6 CS(=O)CCS(C)=O Amb26455659 [0,2,0,0,0,0|1,0,1]=4 4910 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,2,0,0,0,0|1,0,1]=4 4911 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,2,0,0,0,0|1,0,0]=3 4912 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,2,0,0,0,0|1,0,0]=3 4913 B7R0.6 C[C@@H](N)CC[N+](=O)[O-] Amb33731289 [0,2,0,0,0,0|2,0,0]=4 4914 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [0,2,0,0,0,0|2,0,0]=4 4915 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,2,0,0,0,0|1,0,0]=3 4916 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,2,0,0,0,0|1,0,0]=3 4917 B7R0.6 C[C@H](N)CC[N+](=O)[O-] Amb33729333 [0,2,0,0,0,0|2,0,0]=4 4918 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,2,0,0,0,0|1,0,0]=3 4919 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,2,0,0,0,0|1,0,0]=3 4920 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,2,0,0,0,0|0,0,1]=3 4921 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,2,0,0,0,0|0,0,1]=3 4922 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [0,2,0,0,0,0|1,0,1]=4 4923 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,2,0,0,0,0|1,0,1]=4 4924 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [0,2,0,0,0,0|2,0,0]=4 4925 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [0,2,0,0,0,0|2,0,0]=4 4926 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [0,2,0,0,0,0|2,0,0]=4 4927 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [0,2,0,0,0,0|2,0,0]=4 4928 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [0,2,0,0,0,0|2,0,0]=4 4929 B7R0.6 NC(=O)CCC(O)O Amb27254204 [0,2,0,0,0,0|2,0,0]=4 4930 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [0,2,0,0,0,0|2,0,0]=4 4931 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [0,2,0,0,0,0|2,0,0]=4 4932 B7R0.6 O=C(O)CCB(O)O Amb24640288 [0,2,0,0,0,0|2,0,0]=4 4933 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [0,2,0,0,0,0|2,0,0]=4 4934 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [0,2,0,0,0,0|2,0,0]=4 4935 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,2,0,0,0,0|2,0,0]=4 4936 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,2,0,0,0,0|2,0,0]=4 4937 B7R0.6 O=C(O)CCN(F)F Amb28370344 [0,2,0,0,0,0|2,0,0]=4 4938 B7R0.6 O=C(O)CCP(O)O Amb27424479 [0,2,0,0,0,0|2,0,0]=4 4939 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [0,2,0,0,0,0|1,0,1]=4 4940 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [0,2,0,0,0,0|2,0,0]=4 4941 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [0,2,0,0,0,0|1,0,1]=4 4942 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [0,2,0,0,0,0|2,0,0]=4 4943 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [0,2,0,0,0,0|2,0,0]=4 4944 B7R0.8 C=CCCC(C)(C)C Amb24687786 [0,2,0,0,0,0|2,0,0]=4 4945 B7R0.8 C=CCCC(C)(C)Cl Amb25068240 [0,2,0,0,0,0|2,0,0]=4 4946 B7R0.8 C=CCCC(C)(C)N Amb18641750 [0,2,0,0,0,0|2,0,0]=4 4947 B7R0.8 C=CCCC(C)(C)N Amb32661209 [0,2,0,0,0,0|2,0,0]=4 4948 B7R0.8 C=CCCC(C)(C)O Amb26932721 [0,2,0,0,0,0|2,0,0]=4 4949 B7R0.8 C=CCCS(C)(=N)=O Amb33457513 [0,2,0,0,0,0|1,0,1]=4 4950 B7R0.8 C=CCCS(C)(=O)=O Amb33054449 [0,2,0,0,0,0|1,0,1]=4 4951 B7R0.8 C=CCC[S@@](C)(=N)=O Amb33744009 [0,2,0,0,0,0|1,0,1]=4 4952 B7R0.8 C=CCC[Si](C)(C)C Amb10071973 [0,2,0,0,0,0|2,0,0]=4 4953 B7R0.8 CC(C)(C)CCC=O Amb18641814 [0,2,0,0,0,0|1,0,0]=3 4954 B7R0.8 CC(C)(F)CCC=O Amb25223234 [0,2,0,0,0,0|1,0,0]=3 4955 B7R0.8 CC(C)(O)CNC=O Amb28250027 [0,2,0,0,0,0|2,0,0]=4 4956 B7R0.8 CC(F)(F)CCC=O Amb25935601 [0,2,0,0,0,0|1,0,0]=3 4957 B7R0.8 CC(F)(F)CNC=O Amb35722437 [0,2,0,0,0,0|2,0,0]=4 4958 B7R0.8 CCCCP(=O)(Cl)Cl Amb8515452 [0,2,0,0,0,0|2,0,0]=4 4959 B7R0.8 CCCCP(=O)(O)O Amb22053921 [0,2,0,0,0,0|2,0,0]=4 4960 B7R0.8 CCCCS(=O)(=O)Cl Amb3939750 [0,2,0,0,0,0|2,0,0]=4 4961 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [0,2,0,0,0,0|2,0,0]=4 4962 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [0,2,0,0,0,0|2,0,0]=4 4963 B7R0.8 CCCCS(=O)(=O)[O-] Amb8514323 [0,2,0,0,0,0|2,0,0]=4 4964 B7R0.8 CCCCS(=O)(=O)[O-] Amb9871422 [0,2,0,0,0,0|2,0,0]=4 4965 B7R0.8 CCCCS(N)(=O)=O Amb1132715 [0,2,0,0,0,0|2,0,0]=4 4966 B7R0.8 CNCCP(=O)(O)O Amb27751957 [0,2,0,0,0,0|2,0,0]=4 4967 B7R0.8 CNCCS(=O)(=O)F Amb32675095 [0,2,0,0,0,0|2,0,0]=4 4968 B7R0.8 CNCCS(=O)(=O)O Amb6825625 [0,2,0,0,0,0|2,0,0]=4 4969 B7R0.8 CNCCS(=O)(=O)[O-] Amb21858847 [0,2,0,0,0,0|2,0,0]=4 4970 B7R0.8 CNCCS(C)(=O)=O Amb33535362 [0,2,0,0,0,0|2,0,0]=4 4971 B7R0.8 CNCCS(C)(=O)=O Amb33801511 [0,2,0,0,0,0|2,0,0]=4 4972 B7R0.8 CNCCS(N)(=O)=O Amb18292520 [0,2,0,0,0,0|2,0,0]=4 4973 B7R0.8 CNCCS(N)(=O)=O Amb30585088 [0,2,0,0,0,0|2,0,0]=4 4974 B7R0.8 COCCS(=O)(=O)Br Amb23555508 [0,2,0,0,0,0|1,1,0]=4 4975 B7R0.8 COCCS(=O)(=O)Cl Amb9271774 [0,2,0,0,0,0|1,1,0]=4 4976 B7R0.8 COCCS(=O)(=O)F Amb19514633 [0,2,0,0,0,0|1,1,0]=4 4977 B7R0.8 COCCS(=O)(=O)[O-] Amb22496266 [0,2,0,0,0,0|1,1,0]=4 4978 B7R0.8 COCCS(C)(=N)=O Amb33457324 [0,2,0,0,0,0|1,1,0]=4 4979 B7R0.8 COCCS(C)(=N)=O Amb33483244 [0,2,0,0,0,0|1,1,0]=4 4980 B7R0.8 COCCS(N)(=O)=O Amb9316792 [0,2,0,0,0,0|1,1,0]=4 4981 B7R0.8 COCC[S@](C)(=N)=O Amb33744012 [0,2,0,0,0,0|1,1,0]=4 4982 B7R0.8 CP(=O)(O)CCC=O Amb27643443 [0,2,0,0,0,0|1,0,0]=3 4983 B7R0.8 CS(=O)(=O)CCC=O Amb28289688 [0,2,0,0,0,0|0,0,1]=3 4984 B7R0.8 CS(=O)(=O)NCC=O Amb17102114 [0,2,0,0,0,0|1,0,1]=4 4985 B7R0.8 CSCCC(C)(C)N Amb24435204 [0,2,0,0,0,0|1,0,1]=4 4986 B7R0.8 CSCCC(C)(C)O Amb24483080 [0,2,0,0,0,0|0,0,2]=4 4987 B7R0.8 CSCCC(Cl)(Cl)Cl Amb27987521 [0,2,0,0,0,0|1,0,1]=4 4988 B7R0.8 CSCCC(F)(F)F Amb28049295 [0,2,0,0,0,0|1,0,1]=4 4989 B7R0.8 CSCCS(=O)(=O)Cl Amb27474654 [0,2,0,0,0,0|1,0,0]=3 4990 B7R0.8 CSCCS(=O)(=O)F Amb33053731 [0,2,0,0,0,0|1,0,0]=3 4991 B7R0.8 CSCCS(C)(=O)=O Amb28049319 [0,2,0,0,0,0|1,0,0]=3 4992 B7R0.8 CSCCS(N)(=O)=O Amb27622120 [0,2,0,0,0,0|1,0,0]=3 4993 B7R0.8 C[N+](C)(N)CCC=O Amb28250962 [0,2,0,0,0,0|1,0,0]=3 4994 B7R0.8 O=CCCC(F)(F)F Amb24056014 [0,2,0,0,0,0|2,0,0]=4 4995 B7R0.8 O=CCCC(F)(F)F Amb33544389 [0,2,0,0,0,0|2,0,0]=4 4996 B7R0.1 C#CCCCCC=C Amb22367006 [0,2,0,0,0,0|2,0,0]=4 4997 B7R0.1 C#CCCCCSC Amb33197631 [0,2,0,0,0,0|1,0,1]=4 4998 B7R0.1 C#CCCCNC=O Amb27838352 [0,2,0,0,0,0|1,0,1]=4 4999 B7R0.1 C#CCCCSCC Amb25960035 [0,2,0,0,0,0|1,0,1]=4 5000 B7R0.1 C#CCCSCCC Amb27410296 [0,2,0,0,0,0|1,0,1]=4 5001 B7R0.1 C#CCCSCCN Amb6258722 [0,2,0,0,0,0|1,0,1]=4 5002 B7R0.1 C#CCNCCC=C Amb27856078 [0,2,0,0,0,0|2,0,0]=4 5003 B7R0.1 C#CCOCCC=O Amb27877538 [0,2,0,0,0,0|0,1,0]=3 5004 B7R0.1 C#CCSCCCC Amb26066454 [0,2,0,0,0,0|1,0,1]=4 5005 B7R0.1 C#CCSCCCN Amb17500721 [0,2,0,0,0,0|1,0,1]=4 5006 B7R0.1 C#CCSCCCO Amb17502862 [0,2,0,0,0,0|0,0,2]=4 5007 B7R0.1 C=C=CCCCC=O Amb28144035 [0,2,0,0,0,0|1,0,1]=4 5008 B7R0.1 C=C=CCCCCCl Amb27986085 [0,2,0,0,0,0|2,0,0]=4 5009 B7R0.1 C=C=CCCCCO Amb17593159 [0,2,0,0,0,0|2,0,0]=4 5010 B7R0.1 C=C=CCOCC=O Amb28321808 [0,2,0,0,0,0|1,0,1]=4 5011 B7R0.1 C=CC#CCCCC Amb17673844 [0,2,0,0,0,0|2,0,0]=4 5012 B7R0.1 C=CCCC#CC=O Amb27224253 [0,2,0,0,0,0|1,0,1]=4 5013 B7R0.1 C=CCCCC#CC Amb28048990 [0,2,0,0,0,0|2,0,0]=4 5014 B7R0.1 C=CCCCCC=O Amb9785164 [0,2,0,0,0,0|1,0,0]=3 5015 B7R0.1 C=CCCCCCBr Amb16234121 [0,2,0,0,0,0|2,0,0]=4 5016 B7R0.1 C=CCCCCCC Amb3940500 [0,2,0,0,0,0|2,0,0]=4 5017 B7R0.1 C=CCCCCCCl Amb6298878 [0,2,0,0,0,0|2,0,0]=4 5018 B7R0.1 C=CCCCCCI Amb24483139 [0,2,0,0,0,0|2,0,0]=4 5019 B7R0.1 C=CCCCCCN Amb18641754 [0,2,0,0,0,0|2,0,0]=4 5020 B7R0.1 C=CCCCCCO Amb4017321 [0,2,0,0,0,0|2,0,0]=4 5021 B7R0.1 C=CCCCCNC Amb19886674 [0,2,0,0,0,0|2,0,0]=4 5022 B7R0.1 C=CCCCCNC Amb22495849 [0,2,0,0,0,0|2,0,0]=4 5023 B7R0.1 C=CCCCNCC Amb28461005 [0,2,0,0,0,0|2,0,0]=4 5024 B7R0.1 C=CCCCNCC Amb32988644 [0,2,0,0,0,0|2,0,0]=4 5025 B7R0.1 C=CCCCOCBr Amb2696014 [0,2,0,0,0,0|1,1,0]=4 5026 B7R0.1 C=CCCCOCCl Amb2694973 [0,2,0,0,0,0|1,1,0]=4 5027 B7R0.1 C=CCCCSC#N Amb26948505 [0,2,0,0,0,0|1,0,1]=4 5028 B7R0.1 C=CCCCSCC Amb27600986 [0,2,0,0,0,0|1,0,0]=3 5029 B7R0.1 C=CCCC\C=C\C Amb24700388 [0,2,0,0,0,0|2,0,0]=4 5030 B7R0.1 C=CCCNCC=C Amb18641672 [0,2,0,0,0,0|2,0,0]=4 5031 B7R0.1 C=CCCNCCC Amb27796644 [0,2,0,0,0,0|2,0,0]=4 5032 B7R0.1 C=CCCOCCBr Amb9208733 [0,2,0,0,0,0|1,1,0]=4 5033 B7R0.1 C=CCCOCCN Amb22059113 [0,2,0,0,0,0|1,1,0]=4 5034 B7R0.1 C=CCCOCCO Amb26613595 [0,2,0,0,0,0|1,1,0]=4 5035 B7R0.1 C=CCCOCOC Amb27664092 [0,2,0,0,0,0|1,1,0]=4 5036 B7R0.1 C=CCCSCCC Amb27806215 [0,2,0,0,0,0|1,0,0]=3 5037 B7R0.1 C=CCCSCCN Amb25889820 [0,2,0,0,0,0|1,0,0]=3 5038 B7R0.1 C=CCCSCCO Amb28283935 [0,2,0,0,0,0|1,0,0]=3 5039 B7R0.1 C=CCC\C=C\CO Amb27406831 [0,2,0,0,0,0|2,0,0]=4 5040 B7R0.1 C=CCNCCCCl Amb27655586 [0,2,0,0,0,0|2,0,0]=4 5041 B7R0.1 C=CCNCCCI Amb28256753 [0,2,0,0,0,0|2,0,0]=4 5042 B7R0.1 C=CCNCCCN Amb17315274 [0,2,0,0,0,0|2,0,0]=4 5043 B7R0.1 C=CCNCCCO Amb17308751 [0,2,0,0,0,0|2,0,0]=4 5044 B7R0.1 C=CCNCCOC Amb6706505 [0,2,0,0,0,0|1,1,0]=4 5045 B7R0.1 C=CCNC\C=C\C Amb18124233 [0,2,0,0,0,0|2,0,0]=4 5046 B7R0.1 C=CCNOCCC Amb28077176 [0,2,0,0,0,0|2,0,0]=4 5047 B7R0.1 C=CCOCCC=O Amb26516382 [0,2,0,0,0,0|0,1,0]=3 5048 B7R0.1 C=CCOCCCBr Amb8828250 [0,2,0,0,0,0|2,0,0]=4 5049 B7R0.1 C=CCOCCCC Amb3940494 [0,2,0,0,0,0|2,0,0]=4 5050 B7R0.1 C=CCOCCCCl Amb9208730 [0,2,0,0,0,0|2,0,0]=4 5051 B7R0.1 C=CCOCCCN Amb25190295 [0,2,0,0,0,0|2,0,0]=4 5052 B7R0.1 C=CCOCCCO Amb25097051 [0,2,0,0,0,0|2,0,0]=4 5053 B7R0.1 C=CCOCCSC Amb27983164 [0,2,0,0,0,0|1,0,0]=3 5054 B7R0.1 C=CCSCC#CC Amb27780334 [0,2,0,0,0,0|2,0,0]=4 5055 B7R0.1 C=CCSCCCBr Amb27228626 [0,2,0,0,0,0|1,0,1]=4 5056 B7R0.1 C=CCSCCCN Amb17500693 [0,2,0,0,0,0|1,0,1]=4 5057 B7R0.1 C=CCSCCCS Amb28293414 [0,2,0,0,0,0|0,1,1]=4 5058 B7R0.1 C=CCSCCNC Amb27594788 [0,2,0,0,0,0|2,0,0]=4 5059 B7R0.1 C=CCSCCOC Amb17799422 [0,2,0,0,0,0|1,1,0]=4 5060 B7R0.1 C=CCSCCSC Amb27594231 [0,2,0,0,0,0|1,0,0]=3 5061 B7R0.1 C=CCSCN=C=O Amb28193492 [0,2,0,0,0,0|1,0,1]=4 5062 B7R0.1 C=CCSSCC=C Amb8393146 [0,2,0,0,0,0|2,0,0]=4 5063 B7R0.1 C=CCSSCCC Amb8393142 [0,2,0,0,0,0|2,0,0]=4 5064 B7R0.1 C=CC\C=C\CCC Amb4035888 [0,2,0,0,0,0|2,0,0]=4 5065 B7R0.1 C=COCCCCO Amb8517109 [0,2,0,0,0,0|2,0,0]=4 5066 B7R0.1 C=COCCCOC Amb28063047 [0,2,0,0,0,0|1,1,0]=4 5067 B7R0.1 C=COCCSCC Amb25720739 [0,2,0,0,0,0|1,0,0]=3 5068 B7R0.1 C=CSCCCCC Amb27666051 [0,2,0,0,0,0|2,0,0]=4 5069 B7R0.1 C=C\C=C\CCCC Amb22729011 [0,2,0,0,0,0|2,0,0]=4 5070 B7R0.1 C=C\C=C\CCNC Amb18641669 [0,2,0,0,0,0|2,0,0]=4 5071 B7R0.1 CC#CCCCC=O Amb17593142 [0,2,0,0,0,0|1,0,0]=3 5072 B7R0.1 CC=C=CCCCC Amb28284500 [0,2,0,0,0,0|2,0,0]=4 5073 B7R0.1 CCCCC#CC=O Amb17593134 [0,2,0,0,0,0|1,0,0]=3 5074 B7R0.1 CCCCCCC=O Amb3939948 [0,2,0,0,0,0|1,0,0]=3 5075 B7R0.1 CCCCCCSC Amb22359692 [0,2,0,0,0,0|1,0,1]=4 5076 B7R0.1 CCCCCN=C=O Amb3939207 [0,2,0,0,0,0|1,0,1]=4 5077 B7R0.1 CCCCCON=O Amb17939401 [0,2,0,0,0,0|1,0,1]=4 5078 B7R0.1 CCCCCSSC Amb25679654 [0,2,0,0,0,0|1,0,1]=4 5079 B7R0.1 CCCCC\C=C\Br Amb27985859 [0,2,0,0,0,0|2,0,0]=4 5080 B7R0.1 CCCCC\C=C\Cl Amb28384465 [0,2,0,0,0,0|2,0,0]=4 5081 B7R0.1 CCCCC\C=C\I Amb22641605 [0,2,0,0,0,0|2,0,0]=4 5082 B7R0.1 CCCCC\C=N\N Amb27837897 [0,2,0,0,0,0|2,0,0]=4 5083 B7R0.1 CCCCC\C=N\O Amb27477089 [0,2,0,0,0,0|1,0,1]=4 5084 B7R0.1 CCCCOCC=O Amb26515709 [0,2,0,0,0,0|1,0,0]=3 5085 B7R0.1 CCCCO\C=C/Cl Amb27777227 [0,2,0,0,0,0|2,0,0]=4 5086 B7R0.1 CCCCO\C=C\Br Amb27858551 [0,2,0,0,0,0|2,0,0]=4 5087 B7R0.1 CCCCSCC#N Amb6760935 [0,2,0,0,0,0|1,0,1]=4 5088 B7R0.1 CCCCSCC=O Amb28189740 [0,2,0,0,0,0|1,0,0]=3 5089 B7R0.1 CCCCSCCC Amb4017586 [0,2,0,0,0,0|1,0,1]=4 5090 B7R0.1 CCCCSCCCl Amb9479748 [0,2,0,0,0,0|1,0,1]=4 5091 B7R0.1 CCCCSCCN Amb2209242 [0,2,0,0,0,0|1,0,1]=4 5092 B7R0.1 CCCCSCCO Amb1032995 [0,2,0,0,0,0|1,0,1]=4 5093 B7R0.1 CCCCSSCC Amb26515761 [0,2,0,0,0,0|1,0,1]=4 5094 B7R0.1 CCCCS\C=C/Cl Amb28048891 [0,2,0,0,0,0|2,0,0]=4 5095 B7R0.1 CCCC\C=C\C#N Amb18641342 [0,2,0,0,0,0|2,0,0]=4 5096 B7R0.1 CCCC\C=C\C=O Amb2720528 [0,2,0,0,0,0|1,0,0]=3 5097 B7R0.1 CCCC\C=C\CN Amb25175053 [0,2,0,0,0,0|2,0,0]=4 5098 B7R0.1 CCCC\C=C\CO Amb8514979 [0,2,0,0,0,0|1,0,1]=4 5099 B7R0.1 CCCC\C=N\OC Amb27969362 [0,2,0,0,0,0|1,0,1]=4 5100 B7R0.1 CCCC\N=C\CCl Amb28141548 [0,2,0,0,0,0|2,0,0]=4 5101 B7R0.1 CCCNCCC=O Amb27838403 [0,2,0,0,0,0|1,0,0]=3 5102 B7R0.1 CCCNCCSC Amb27162672 [0,2,0,0,0,0|1,0,1]=4 5103 B7R0.1 CCCNC\C=C\Cl Amb25340126 [0,2,0,0,0,0|2,0,0]=4 5104 B7R0.1 CCCOC\C=C/Cl Amb27839016 [0,2,0,0,0,0|2,0,0]=4 5105 B7R0.1 CCCSCCC#N Amb6680722 [0,2,0,0,0,0|1,0,1]=4 5106 B7R0.1 CCCSCCCN Amb6680225 [0,2,0,0,0,0|1,0,1]=4 5107 B7R0.1 CCCSCCCO Amb9370793 [0,2,0,0,0,0|0,0,2]=4 5108 B7R0.1 CCCSCCON Amb27262198 [0,2,0,0,0,0|2,0,0]=4 5109 B7R0.1 CCCSCCSC Amb27837913 [0,2,0,0,0,0|1,0,1]=4 5110 B7R0.1 CCC\C=C\CC=O Amb32954538 [0,2,0,0,0,0|1,0,0]=3 5111 B7R0.1 CCC\C=C\N=C=O Amb25260726 [0,2,0,0,0,0|1,0,1]=4 5112 B7R0.1 CCNCC\C=C\Cl Amb27400178 [0,2,0,0,0,0|2,0,0]=4 5113 B7R0.1 CCOCCCC=O Amb27236777 [0,2,0,0,0,0|0,1,0]=3 5114 B7R0.1 CCOCCN=C=O Amb27628260 [0,2,0,0,0,0|0,1,1]=4 5115 B7R0.1 CCOCC\C=N\N Amb27982628 [0,2,0,0,0,0|1,1,0]=4 5116 B7R0.1 CCSCCCC#N Amb6680685 [0,2,0,0,0,0|1,0,1]=4 5117 B7R0.1 CCSCCCC=O Amb33323662 [0,2,0,0,0,0|0,0,0]=2 5118 B7R0.1 CCSCCCCBr Amb9304999 [0,2,0,0,0,0|1,0,1]=4 5119 B7R0.1 CCSCCCCCl Amb18796695 [0,2,0,0,0,0|1,0,1]=4 5120 B7R0.1 CCSCCCCN Amb9391471 [0,2,0,0,0,0|1,0,1]=4 5121 B7R0.1 CCSCCCCO Amb9370799 [0,2,0,0,0,0|0,0,2]=4 5122 B7R0.1 CCSCCCCS Amb27223548 [0,2,0,0,0,0|0,1,1]=4 5123 B7R0.1 CCSCCCNC Amb25044529 [0,2,0,0,0,0|1,0,1]=4 5124 B7R0.1 CCSCCCNO Amb27778147 [0,2,0,0,0,0|0,0,2]=4 5125 B7R0.1 CCSCCCON Amb26975230 [0,2,0,0,0,0|0,0,2]=4 5126 B7R0.1 CCSCCN=C=O Amb25110059 [0,2,0,0,0,0|0,0,1]=3 5127 B7R0.1 CCSCCN=[N+]=[N-] Amb24388976 [0,2,0,0,0,0|2,0,0]=4 5128 B7R0.1 CCSCCNC=O Amb27752341 [0,2,0,0,0,0|0,0,0]=2 5129 B7R0.1 CCSCCSCC Amb4017493 [0,2,0,0,0,0|1,0,1]=4 5130 B7R0.1 CCSCSCCCl Amb27645434 [0,2,0,0,0,0|1,0,1]=4 5131 B7R0.1 CCSC\C=C\C=O Amb33323727 [0,2,0,0,0,0|0,0,1]=3 5132 B7R0.1 CCSC\C=C\CN Amb33474425 [0,2,0,0,0,0|1,0,1]=4 5133 B7R0.1 CCSC\C=C\CO Amb33475304 [0,2,0,0,0,0|0,0,2]=4 5134 B7R0.1 CC\C=C\CCC=O Amb27390797 [0,2,0,0,0,0|1,0,0]=3 5135 B7R0.1 CC\C=C\CCCC Amb19930202 [0,2,0,0,0,0|2,0,0]=4 5136 B7R0.1 CC\C=C\CCNC Amb32953435 [0,2,0,0,0,0|2,0,0]=4 5137 B7R0.1 CC\C=C\CCSC Amb27397344 [0,2,0,0,0,0|1,0,0]=3 5138 B7R0.1 CC\C=N\CCCC Amb27946052 [0,2,0,0,0,0|2,0,0]=4 5139 B7R0.1 CNCCCCSC Amb27433707 [0,2,0,0,0,0|1,0,1]=4 5140 B7R0.1 CNCCSCC#N Amb27669176 [0,2,0,0,0,0|2,0,0]=4 5141 B7R0.1 CNCCSCCO Amb27475549 [0,2,0,0,0,0|2,0,0]=4 5142 B7R0.1 COCCCCC=O Amb27410175 [0,2,0,0,0,0|0,1,0]=3 5143 B7R0.1 COCCCCSC Amb28193488 [0,2,0,0,0,0|0,0,2]=4 5144 B7R0.1 COCCCN=C=O Amb5750716 [0,2,0,0,0,0|0,1,1]=4 5145 B7R0.1 COCCCSCCl Amb27466078 [0,2,0,0,0,0|0,0,2]=4 5146 B7R0.1 COCCC\C=N\N Amb28288582 [0,2,0,0,0,0|1,1,0]=4 5147 B7R0.1 COCCOCC=O Amb26051823 [0,2,0,0,0,0|0,1,0]=3 5148 B7R0.1 COCCONC=O Amb28049001 [0,2,0,0,0,0|0,1,0]=3 5149 B7R0.1 COCCSCCF Amb28142604 [0,2,0,0,0,0|2,0,0]=4 5150 B7R0.1 COCCSCCO Amb9273918 [0,2,0,0,0,0|2,0,0]=4 5151 B7R0.1 COCCSCOC Amb27883297 [0,2,0,0,0,0|2,0,0]=4 5152 B7R0.1 COCC\C=C\C=O Amb33377482 [0,2,0,0,0,0|0,1,0]=3 5153 B7R0.1 COCC\C=C\CCl Amb10844762 [0,2,0,0,0,0|1,1,0]=4 5154 B7R0.1 COCC\C=C\CN Amb33474375 [0,2,0,0,0,0|1,1,0]=4 5155 B7R0.1 COCC\C=C\CO Amb32954125 [0,2,0,0,0,0|0,1,1]=4 5156 B7R0.1 COCOCCC=O Amb25804170 [0,2,0,0,0,0|0,1,0]=3 5157 B7R0.1 CO\C=C\CCC=O Amb18641790 [0,2,0,0,0,0|0,1,0]=3 5158 B7R0.1 CSCCCCC#N Amb27832899 [0,2,0,0,0,0|1,0,1]=4 5159 B7R0.1 CSCCCCC=O Amb25760866 [0,2,0,0,0,0|0,0,0]=2 5160 B7R0.1 CSCCCCCBr Amb25052398 [0,2,0,0,0,0|1,0,1]=4 5161 B7R0.1 CSCCCCCCl Amb18179464 [0,2,0,0,0,0|1,0,1]=4 5162 B7R0.1 CSCCCCCF Amb28049310 [0,2,0,0,0,0|1,0,1]=4 5163 B7R0.1 CSCCCCCN Amb24271082 [0,2,0,0,0,0|1,0,1]=4 5164 B7R0.1 CSCCCCCO Amb24271084 [0,2,0,0,0,0|0,0,2]=4 5165 B7R0.1 CSCCCCCS Amb24633807 [0,2,0,0,0,0|0,1,1]=4 5166 B7R0.1 CSCCCCON Amb33198301 [0,2,0,0,0,0|0,0,2]=4 5167 B7R0.1 CSCCCN=C=O Amb26647796 [0,2,0,0,0,0|0,0,1]=3 5168 B7R0.1 CSCCCN=C=S Amb6296851 [0,2,0,0,0,0|0,1,1]=4 5169 B7R0.1 CSCCCN=[N+]=[N-] Amb28285204 [0,2,0,0,0,0|1,0,1]=4 5170 B7R0.1 CSCCCNC#N Amb28047660 [0,2,0,0,0,0|1,0,1]=4 5171 B7R0.1 CSCCNCC#N Amb27812181 [0,2,0,0,0,0|1,0,1]=4 5172 B7R0.1 CSCCNCCBr Amb27833219 [0,2,0,0,0,0|1,0,1]=4 5173 B7R0.1 CSCCNCCCl Amb27870606 [0,2,0,0,0,0|1,0,1]=4 5174 B7R0.1 CSCCOCC#N Amb27823913 [0,2,0,0,0,0|1,0,1]=4 5175 B7R0.1 CSCCOCCBr Amb28321116 [0,2,0,0,0,0|1,0,1]=4 5176 B7R0.1 CSCCOCCN Amb17501991 [0,2,0,0,0,0|1,0,1]=4 5177 B7R0.1 CSCCOCCO Amb28368979 [0,2,0,0,0,0|0,0,2]=4 5178 B7R0.1 CSCC\C=C\C=O Amb32953448 [0,2,0,0,0,0|0,0,0]=2 5179 B7R0.1 CSCC\C=C\CN Amb33198278 [0,2,0,0,0,0|1,0,0]=3 5180 B7R0.1 CSCC\C=C\CO Amb33198279 [0,2,0,0,0,0|0,0,1]=3 5181 B7R0.1 CSCOCCCBr Amb27477765 [0,2,0,0,0,0|1,0,1]=4 5182 B7R0.1 CSSCCN=C=S Amb28195580 [0,2,0,0,0,0|0,1,1]=4 5183 B7R0.1 CSSCCNC=O Amb27475220 [0,2,0,0,0,0|0,0,0]=2 5184 B7R0.1 C\C=C/CCCCC Amb4035902 [0,2,0,0,0,0|2,0,0]=4 5185 B7R0.1 C\C=C/CCCCO Amb4019856 [0,2,0,0,0,0|2,0,0]=4 5186 B7R0.1 C\C=C\CCCCC Amb8513437 [0,2,0,0,0,0|2,0,0]=4 5187 B7R0.1 C\C=C\CCCCN Amb27209196 [0,2,0,0,0,0|2,0,0]=4 5188 B7R0.1 C\C=C\CCNC=O Amb27874072 [0,2,0,0,0,0|1,0,0]=3 5189 B7R0.1 C\C=C\CC\C=C\C Amb21520377 [0,2,0,0,0,0|2,0,0]=4 5190 B7R0.1 C\C=C\CC\C=C\Cl Amb27433939 [0,2,0,0,0,0|2,0,0]=4 5191 B7R0.1 C\C=C\CNCCC Amb28127654 [0,2,0,0,0,0|2,0,0]=4 5192 B7R0.1 C\C=C\CSCCO Amb9362982 [0,2,0,0,0,0|1,0,1]=4 5193 B7R0.1 C\C=C\C\C=C\C=O Amb27202097 [0,2,0,0,0,0|1,0,1]=4 5194 B7R0.1 C\C=N/CCCCN Amb27838890 [0,2,0,0,0,0|2,0,0]=4 5195 B7R0.1 ClCCCSCCCl Amb24426165 [0,2,0,0,0,0|1,0,1]=4 5196 B7R0.1 FCCSCCCCl Amb27172909 [0,2,0,0,0,0|1,0,1]=4 5197 B7R0.1 N#CCCCCC=O Amb17593149 [0,2,0,0,0,0|1,0,0]=3 5198 B7R0.1 N#CCCOCC=O Amb27613546 [0,2,0,0,0,0|1,0,1]=4 5199 B7R0.1 N#CCCSCCO Amb3939502 [0,2,0,0,0,0|1,0,1]=4 5200 B7R0.1 N#CCSCCCCl Amb20623081 [0,2,0,0,0,0|1,0,1]=4 5201 B7R0.1 N#CCSCCCN Amb17500697 [0,2,0,0,0,0|1,0,1]=4 5202 B7R0.1 NCCCCNC=O Amb18641902 [0,2,0,0,0,0|1,0,0]=3 5203 B7R0.1 NCCCSCCO Amb9481738 [0,2,0,0,0,0|1,0,1]=4 5204 B7R0.1 NCCSCCCF Amb28284467 [0,2,0,0,0,0|1,0,1]=4 5205 B7R0.1 NCCSCCCO Amb8876329 [0,2,0,0,0,0|0,0,2]=4 5206 B7R0.1 NCCSC\C=C\Cl Amb9720269 [0,2,0,0,0,0|1,0,1]=4 5207 B7R0.1 NOCCSCCO Amb27198425 [0,2,0,0,0,0|2,0,0]=4 5208 B7R0.1 O=C=NCCCCCl Amb27595099 [0,2,0,0,0,0|1,0,1]=4 5209 B7R0.1 O=C=NCCCCF Amb27625761 [0,2,0,0,0,0|1,0,1]=4 5210 B7R0.1 O=C=NCCCCO Amb27758809 [0,2,0,0,0,0|1,0,1]=4 5211 B7R0.1 O=CC#CCCCCl Amb27759532 [0,2,0,0,0,0|1,0,1]=4 5212 B7R0.1 O=CCCCCC=O Amb17593185 [0,2,0,0,0,0|1,0,0]=3 5213 B7R0.1 O=CCCCCCBr Amb18127461 [0,2,0,0,0,0|1,0,0]=3 5214 B7R0.1 O=CCCCCCCl Amb16185781 [0,2,0,0,0,0|1,0,0]=3 5215 B7R0.1 O=CCCCCCF Amb24533888 [0,2,0,0,0,0|1,0,0]=3 5216 B7R0.1 O=CCCCCCO Amb18641885 [0,2,0,0,0,0|1,0,0]=3 5217 B7R0.1 O=CCCOCCO Amb18641946 [0,2,0,0,0,0|0,1,0]=3 5218 B7R0.1 O=CCSCCCO Amb27871143 [0,2,0,0,0,0|1,0,0]=3 5219 B7R0.1 O=CCSSCC=O Amb27169089 [0,2,0,0,0,0|1,0,0]=3 5220 B7R0.1 O=CC\C=C\CC=O Amb26402388 [0,2,0,0,0,0|1,0,1]=4 5221 B7R0.1 O=CNCCCCF Amb27168251 [0,2,0,0,0,0|1,0,0]=3 5222 B7R0.1 O=CNCCCCO Amb28187191 [0,2,0,0,0,0|1,0,0]=3 5223 B7R0.1 O=CNCCNC=O Amb1043861 [0,2,0,0,0,0|1,0,1]=4 5224 B7R0.1 O=COCCOC=O Amb2721136 [0,2,0,0,0,0|0,1,1]=4 5225 B7R0.1 O=COCOCCCl Amb28326081 [0,2,0,0,0,0|1,1,0]=4 5226 B7R0.1 O=C\C=C\CCC=O Amb18124241 [0,2,0,0,0,0|1,0,1]=4 5227 B7R0.1 OCCCC\C=N\O Amb22336271 [0,2,0,0,0,0|1,0,1]=4 5228 B7R0.1 OCCCSCCO Amb33531539 [0,2,0,0,0,0|0,0,2]=4 5229 B7R0.1 SCCCSCCS Amb27656809 [0,2,0,0,0,0|0,1,1]=4 5230 B7R0.1 [C-]#[N+]CCCCSC Amb33198737 [0,2,0,0,0,0|1,0,1]=4 5231 B7R0.1 [C-]#[N+]CCCSCC Amb33324017 [0,2,0,0,0,0|1,0,1]=4 5232 B7R0.1 [N-]=[N+]=NCCCC=O Amb26993491 [0,2,0,0,0,0|2,0,0]=4 5233 B5R1.1 C1=CCCC1 Amb6608970 [1,0,0,1,0,0|1,0,0]=3 5234 B5R1.1 C1=CCNC1 Amb2695003 [1,0,0,1,0,0|1,0,1]=4 5235 B5R1.1 C1=CCNC1 Amb8630078 [1,0,0,1,0,0|1,0,1]=4 5236 B5R1.1 C1=CCOC1 Amb7809243 [1,0,0,1,0,0|0,1,1]=4 5237 B5R1.1 C1=CCSC1 Amb33544213 [1,0,0,1,0,0|0,0,1]=3 5238 B5R1.1 C1=CNCC1 Amb24476832 [1,0,0,1,0,0|1,0,1]=4 5239 B5R1.1 C1=COCC1 Amb6609005 [1,0,0,1,0,0|0,0,2]=4 5240 B5R1.1 C1=CSCC1 Amb24065325 [1,0,0,1,0,0|0,0,1]=3 5241 B5R1.1 C1=CSSC1 Amb27437397 [1,0,0,1,0,0|0,1,1]=4 5242 B5R1.1 C1=NCCC1 Amb28282781 [1,0,0,1,0,0|1,0,0]=3 5243 B5R1.1 C1=NCCN1 Amb25083166 [1,0,0,1,0,0|2,0,0]=4 5244 B5R1.1 C1=NCCO1 Amb16234259 [1,0,0,1,0,0|1,0,1]=4 5245 B5R1.1 C1=NCCS1 Amb4022861 [1,0,0,1,0,0|1,0,1]=4 5246 B5R1.1 C1=NCNC1 Amb27449121 [1,0,0,1,0,0|2,0,0]=4 5247 B5R1.1 C1=NNCC1 Amb21618957 [1,0,0,1,0,0|2,0,0]=4 5248 B5R1.1 C1CCNC1 Amb2792830 [1,0,0,1,0,0|1,0,1]=4 5249 B5R1.1 C1CCOC1 Amb2792997 [1,0,0,1,0,0|0,0,2]=4 5250 B5R1.1 C1CCSC1 Amb2690554 [1,0,0,1,0,0|0,0,1]=3 5251 B5R1.1 C1CC[SiH2]C1 Amb27494656 [1,0,0,1,0,0|1,0,1]=4 5252 B5R1.1 C1CNCN1 Amb22497691 [1,0,0,1,0,0|2,0,0]=4 5253 B5R1.1 C1CNNC1 Amb18061973 [1,0,0,1,0,0|2,0,0]=4 5254 B5R1.1 C1CNNC1 Amb21964916 [1,0,0,1,0,0|2,0,0]=4 5255 B5R1.1 C1CNOC1 Amb6365588 [1,0,0,1,0,0|1,0,1]=4 5256 B5R1.1 C1CNOC1 Amb8503363 [1,0,0,1,0,0|1,0,1]=4 5257 B5R1.1 C1COCN1 Amb17506153 [1,0,0,1,0,0|1,0,1]=4 5258 B5R1.1 C1CSCN1 Amb30633758 [1,0,0,1,0,0|1,0,0]=3 5259 B5R1.1 C1CSCN1 Amb3940118 [1,0,0,1,0,0|1,0,0]=3 5260 B5R1.1 C1CSCS1 Amb10071964 [1,0,0,1,0,0|0,1,0]=3 5261 B5R1.2 BrC1CCC1 Amb3941489 [1,0,0,1,0,0|1,0,1]=4 5262 B5R1.2 BrC1CNC1 Amb22229230 [1,0,0,1,0,0|2,0,0]=4 5263 B5R1.2 BrC1CNC1 Amb22235472 [1,0,0,1,0,0|2,0,0]=4 5264 B5R1.2 BrC1CNC1 Amb22304219 [1,0,0,1,0,0|2,0,0]=4 5265 B5R1.2 BrC1COC1 Amb2383522 [1,0,0,1,0,0|1,1,0]=4 5266 B5R1.2 C=C1CCC1 Amb19374657 [1,0,0,1,0,0|1,0,0]=3 5267 B5R1.2 C=C1CCO1 Amb22736695 [1,0,0,1,0,0|1,1,0]=4 5268 B5R1.2 C=C1CNC1 Amb26026628 [1,0,0,1,0,0|1,0,1]=4 5269 B5R1.2 C=C1CNC1 Amb32666987 [1,0,0,1,0,0|1,0,1]=4 5270 B5R1.2 C=C1COC1 Amb27432949 [1,0,0,1,0,0|0,1,1]=4 5271 B5R1.2 CC1CCN1 Amb33544381 [1,0,0,1,0,0|1,0,1]=4 5272 B5R1.2 CC1CCN1 Amb7094895 [1,0,0,1,0,0|1,0,1]=4 5273 B5R1.2 CC1CCO1 Amb22284855 [1,0,0,1,0,0|0,0,2]=4 5274 B5R1.2 CC1CNC1 Amb19957931 [1,0,0,1,0,0|1,0,1]=4 5275 B5R1.2 CC1CNC1 Amb26579404 [1,0,0,1,0,0|1,0,1]=4 5276 B5R1.2 CC1COC1 Amb20621708 [1,0,0,1,0,0|0,1,1]=4 5277 B5R1.2 C[C@@H]1CCN1 Amb34148051 [1,0,0,1,0,0|1,0,1]=4 5278 B5R1.2 C[C@@H]1CCO1 Amb28292927 [1,0,0,1,0,0|0,0,2]=4 5279 B5R1.2 C[C@H]1CCN1 Amb33805340 [1,0,0,1,0,0|1,0,1]=4 5280 B5R1.2 C[C@H]1CCO1 Amb26503922 [1,0,0,1,0,0|0,0,2]=4 5281 B5R1.2 ClC1CCC1 Amb3941524 [1,0,0,1,0,0|1,0,1]=4 5282 B5R1.2 ClC1CNC1 Amb21960859 [1,0,0,1,0,0|2,0,0]=4 5283 B5R1.2 ClC1CNC1 Amb22232545 [1,0,0,1,0,0|2,0,0]=4 5284 B5R1.2 ClC1COC1 Amb22737242 [1,0,0,1,0,0|1,1,0]=4 5285 B5R1.2 FC1CNC1 Amb19148506 [1,0,0,1,0,0|2,0,0]=4 5286 B5R1.2 FC1CNC1 Amb8629955 [1,0,0,1,0,0|2,0,0]=4 5287 B5R1.2 FC1COC1 Amb21960819 [1,0,0,1,0,0|1,1,0]=4 5288 B5R1.2 IC1CCC1 Amb24476982 [1,0,0,1,0,0|1,0,1]=4 5289 B5R1.2 IC1CNC1 Amb22229328 [1,0,0,1,0,0|2,0,0]=4 5290 B5R1.2 IC1CNC1 Amb28247468 [1,0,0,1,0,0|2,0,0]=4 5291 B5R1.2 IC1COC1 Amb2383523 [1,0,0,1,0,0|1,1,0]=4 5292 B5R1.2 NC1C=CC1 Amb32658179 [1,0,0,1,0,0|2,0,0]=4 5293 B5R1.2 NC1CCC1 Amb3938963 [1,0,0,1,0,0|1,0,1]=4 5294 B5R1.2 NC1CCC1 Amb8631327 [1,0,0,1,0,0|1,0,1]=4 5295 B5R1.2 NC1CNC1 Amb2696234 [1,0,0,1,0,0|2,0,0]=4 5296 B5R1.2 NC1CNC1 Amb8630172 [1,0,0,1,0,0|2,0,0]=4 5297 B5R1.2 NC1COC1 Amb21928045 [1,0,0,1,0,0|1,1,0]=4 5298 B5R1.2 NC1COC1 Amb6259281 [1,0,0,1,0,0|1,1,0]=4 5299 B5R1.2 NC1CSC1 Amb17597694 [1,0,0,1,0,0|1,0,0]=3 5300 B5R1.2 NC1CSC1 Amb19373792 [1,0,0,1,0,0|1,0,0]=3 5301 B5R1.2 NC1CSC1 Amb22295804 [1,0,0,1,0,0|1,0,0]=3 5302 B5R1.2 NN1CCC1 Amb24392919 [1,0,0,1,0,0|2,0,0]=4 5303 B5R1.2 NN1CCC1 Amb32656115 [1,0,0,1,0,0|2,0,0]=4 5304 B5R1.2 O=C1BCN1 Amb27403064 [1,0,0,1,0,0|2,0,0]=4 5305 B5R1.2 O=C1C=CC1 Amb24477666 [1,0,0,1,0,0|0,0,2]=4 5306 B5R1.2 O=C1CCC1 Amb4605970 [1,0,0,1,0,0|0,0,0]=2 5307 B5R1.2 O=C1CCN1 Amb2779956 [1,0,0,1,0,0|1,0,0]=3 5308 B5R1.2 O=C1CCO1 Amb8514945 [1,0,0,1,0,0|0,1,0]=3 5309 B5R1.2 O=C1CCS1 Amb28430252 [1,0,0,1,0,0|0,0,0]=2 5310 B5R1.2 O=C1CNC1 Amb10975976 [1,0,0,1,0,0|1,0,0]=3 5311 B5R1.2 O=C1COC1 Amb10067645 [1,0,0,1,0,0|0,1,0]=3 5312 B5R1.2 O=C1CSC1 Amb19516222 [1,0,0,1,0,0|0,0,0]=2 5313 B5R1.2 O=S1CCC1 Amb27653739 [1,0,0,1,0,0|1,0,0]=3 5314 B5R1.2 OC1CCC1 Amb4605821 [1,0,0,1,0,0|0,0,2]=4 5315 B5R1.2 OC1CNC1 Amb22489446 [1,0,0,1,0,0|1,0,1]=4 5316 B5R1.2 OC1CNC1 Amb2688729 [1,0,0,1,0,0|1,0,1]=4 5317 B5R1.2 OC1CNC1 Amb2785246 [1,0,0,1,0,0|1,0,1]=4 5318 B5R1.2 OC1COC1 Amb10602318 [1,0,0,1,0,0|0,1,1]=4 5319 B5R1.2 OC1CSC1 Amb17593039 [1,0,0,1,0,0|0,0,1]=3 5320 B5R1.2 SC1CCC1 Amb25339328 [1,0,0,1,0,0|0,1,1]=4 5321 B5R1.2 SC1CNC1 Amb24477050 [1,0,0,1,0,0|1,1,0]=4 5322 B5R1.2 SC1CNC1 Amb33715987 [1,0,0,1,0,0|1,1,0]=4 5323 B5R1.2 SC1COC1 Amb22737528 [1,0,0,1,0,0|0,2,0]=4 5324 B5R1.2 SC1CSC1 Amb28142120 [1,0,0,1,0,0|0,1,0]=3 5325 B5R1.2 [Mg+]C1CCC1 Amb30591459 [1,0,0,1,0,0|1,0,1]=4 5326 B5R1.3 BrC=C1CC1 Amb27407803 [1,0,0,1,0,0|1,0,1]=4 5327 B5R1.3 BrCC1CC1 Amb535770 [1,0,0,1,0,0|1,0,1]=4 5328 B5R1.3 BrCC1CO1 Amb2795759 [1,0,0,1,0,0|1,1,0]=4 5329 B5R1.3 Br[Mg]C1CC1 Amb22351640 [1,0,0,1,0,0|2,0,0]=4 5330 B5R1.3 C#CC1CC1 Amb2695321 [1,0,0,1,0,0|1,0,1]=4 5331 B5R1.3 C=CC1CC1 Amb33542822 [1,0,0,1,0,0|1,0,0]=3 5332 B5R1.3 C=CC1CO1 Amb8513510 [1,0,0,1,0,0|0,1,1]=4 5333 B5R1.3 C=C[C@@H]1CO1 Amb22351105 [1,0,0,1,0,0|0,1,1]=4 5334 B5R1.3 C=C[C@H]1CO1 Amb22351147 [1,0,0,1,0,0|0,1,1]=4 5335 B5R1.3 CCC1CC1 Amb22230644 [1,0,0,1,0,0|1,0,1]=4 5336 B5R1.3 CCC1CO1 Amb9702846 [1,0,0,1,0,0|0,0,2]=4 5337 B5R1.3 CCC1CS1 Amb2371075 [1,0,0,1,0,0|0,0,1]=3 5338 B5R1.3 CC[C@@H]1CO1 Amb16185821 [1,0,0,1,0,0|0,0,2]=4 5339 B5R1.3 CC[C@H]1CO1 Amb16185820 [1,0,0,1,0,0|0,0,2]=4 5340 B5R1.3 CNC1CC1 Amb6252243 [1,0,0,1,0,0|1,0,1]=4 5341 B5R1.3 CNC1CC1 Amb6892795 [1,0,0,1,0,0|1,0,1]=4 5342 B5R1.3 CSC1CC1 Amb27260972 [1,0,0,1,0,0|0,0,1]=3 5343 B5R1.3 ClCC1CC1 Amb2720790 [1,0,0,1,0,0|1,0,1]=4 5344 B5R1.3 ClCC1CO1 Amb2793023 [1,0,0,1,0,0|1,1,0]=4 5345 B5R1.3 ClCC1CS1 Amb2722497 [1,0,0,1,0,0|1,0,0]=3 5346 B5R1.3 ClC[C@@H]1CO1 Amb2691611 [1,0,0,1,0,0|1,1,0]=4 5347 B5R1.3 ClC[C@H]1CO1 Amb2691610 [1,0,0,1,0,0|1,1,0]=4 5348 B5R1.3 FCC1CO1 Amb2687704 [1,0,0,1,0,0|1,1,0]=4 5349 B5R1.3 FC[C@@H]1CO1 Amb33166589 [1,0,0,1,0,0|1,1,0]=4 5350 B5R1.3 FC[C@H]1CO1 Amb33166590 [1,0,0,1,0,0|1,1,0]=4 5351 B5R1.3 ICC1CC1 Amb16191888 [1,0,0,1,0,0|1,0,1]=4 5352 B5R1.3 ICC1CO1 Amb22735230 [1,0,0,1,0,0|1,1,0]=4 5353 B5R1.3 N#CC1CC1 Amb2686654 [1,0,0,1,0,0|1,0,1]=4 5354 B5R1.3 NCC1CC1 Amb10609028 [1,0,0,1,0,0|1,0,1]=4 5355 B5R1.3 NCC1CC1 Amb16185726 [1,0,0,1,0,0|1,0,1]=4 5356 B5R1.3 NCC1CC1 Amb535736 [1,0,0,1,0,0|1,0,1]=4 5357 B5R1.3 NCC1CO1 Amb27817601 [1,0,0,1,0,0|1,1,0]=4 5358 B5R1.3 NNC1CC1 Amb21857070 [1,0,0,1,0,0|2,0,0]=4 5359 B5R1.3 NNC1CC1 Amb22491510 [1,0,0,1,0,0|2,0,0]=4 5360 B5R1.3 NOC1CC1 Amb22500414 [1,0,0,1,0,0|2,0,0]=4 5361 B5R1.3 O=CC1C=C1 Amb27210245 [1,0,0,1,0,0|0,0,2]=4 5362 B5R1.3 O=CC1CC1 Amb3940027 [1,0,0,1,0,0|0,0,0]=2 5363 B5R1.3 O=CC1CO1 Amb17593007 [1,0,0,1,0,0|0,1,0]=3 5364 B5R1.3 O=C[C@@H]1CO1 Amb27882887 [1,0,0,1,0,0|0,1,0]=3 5365 B5R1.3 OCC1CC1 Amb2686656 [1,0,0,1,0,0|0,0,2]=4 5366 B5R1.3 OCC1CO1 Amb6891957 [1,0,0,1,0,0|0,1,1]=4 5367 B5R1.3 OC[C@@H]1CO1 Amb8389331 [1,0,0,1,0,0|0,1,1]=4 5368 B5R1.3 OC[C@H]1CO1 Amb8396602 [1,0,0,1,0,0|0,1,1]=4 5369 B5R1.3 SCC1CC1 Amb22232250 [1,0,0,1,0,0|0,1,1]=4 5370 B5R1.3 SCC1CC1 Amb27798475 [1,0,0,1,0,0|0,1,1]=4 5371 B5R1.3 [C-]#[N+]C1CC1 Amb2686662 [1,0,0,1,0,0|2,0,0]=4 5372 B5R1.3 [NH3+]CC1CC1 Amb22049490 [1,0,0,1,0,0|1,0,1]=4 5373 B5R1.4 C=C1CC1N Amb28286745 [1,0,0,1,0,0|2,0,0]=4 5374 B5R1.4 CC1CC1Br Amb26868828 [1,0,0,1,0,0|1,0,1]=4 5375 B5R1.4 CC1CC1Cl Amb28317992 [1,0,0,1,0,0|1,0,1]=4 5376 B5R1.4 CC1CC1I Amb27634844 [1,0,0,1,0,0|1,0,1]=4 5377 B5R1.4 CC1CC1N Amb10609752 [1,0,0,1,0,0|1,0,1]=4 5378 B5R1.4 CC1CC1N Amb22886429 [1,0,0,1,0,0|1,0,1]=4 5379 B5R1.4 CC1CC1N Amb9024793 [1,0,0,1,0,0|1,0,1]=4 5380 B5R1.4 CC1CC1O Amb25271917 [1,0,0,1,0,0|0,0,2]=4 5381 B5R1.4 C[C@@H]1C[C@@H]1Br Amb27491106 [1,0,0,1,0,0|1,0,1]=4 5382 B5R1.4 C[C@@H]1C[C@H]1I Amb27444527 [1,0,0,1,0,0|1,0,1]=4 5383 B5R1.4 C[C@@H]1C[C@H]1N Amb13952528 [1,0,0,1,0,0|1,0,1]=4 5384 B5R1.4 C[C@@H]1C[C@H]1N Amb22886313 [1,0,0,1,0,0|1,0,1]=4 5385 B5R1.4 C[C@@H]1C[C@H]1O Amb27448140 [1,0,0,1,0,0|0,0,2]=4 5386 B5R1.4 C[C@H]1C[C@@H]1N Amb32655995 [1,0,0,1,0,0|1,0,1]=4 5387 B5R1.4 C[C@H]1C[C@@H]1N Amb32655996 [1,0,0,1,0,0|1,0,1]=4 5388 B5R1.4 C[C@H]1C[C@H]1N Amb28134094 [1,0,0,1,0,0|1,0,1]=4 5389 B7R1.1 BrC=C1CCCC1 Amb27592183 [0,1,0,1,0,0|2,0,0]=4 5390 B7R1.1 BrCC1C=CCC1 Amb28385457 [0,1,0,1,0,0|2,0,0]=4 5391 B7R1.1 BrCC1CCSC1 Amb27630698 [0,1,0,1,0,0|1,0,1]=4 5392 B7R1.1 BrC[C@@H]1C=CCC1 Amb27233396 [0,1,0,1,0,0|2,0,0]=4 5393 B7R1.1 C#CC1CCSC1 Amb33345729 [0,1,0,1,0,0|1,0,1]=4 5394 B7R1.1 C#CC1CSCN1 Amb33169016 [0,1,0,1,0,0|1,0,1]=4 5395 B7R1.1 C=CC1CCCC1 Amb17934190 [0,1,0,1,0,0|2,0,0]=4 5396 B7R1.1 C=CC1CCCN1 Amb23536605 [0,1,0,1,0,0|2,0,0]=4 5397 B7R1.1 C=CC1CCCN1 Amb24082686 [0,1,0,1,0,0|2,0,0]=4 5398 B7R1.1 C=CC1CCCO1 Amb28137321 [0,1,0,1,0,0|2,0,0]=4 5399 B7R1.1 C=CC1CCCS1 Amb33415623 [0,1,0,1,0,0|2,0,0]=4 5400 B7R1.1 C=CC1CCNC1 Amb22587509 [0,1,0,1,0,0|2,0,0]=4 5401 B7R1.1 C=CC1CCOC1 Amb24478877 [0,1,0,1,0,0|1,1,0]=4 5402 B7R1.1 C=CC1CCSC1 Amb28065280 [0,1,0,1,0,0|1,0,0]=3 5403 B7R1.1 C=CN1CCCC1 Amb25133406 [0,1,0,1,0,0|2,0,0]=4 5404 B7R1.1 CC=C1CCCC1 Amb4035880 [0,1,0,1,0,0|2,0,0]=4 5405 B7R1.1 CCC1C=CCC1 Amb4020582 [0,1,0,1,0,0|2,0,0]=4 5406 B7R1.1 CCC1C=CCN1 Amb10608188 [0,1,0,1,0,0|2,0,0]=4 5407 B7R1.1 CCC1C=CCN1 Amb22587170 [0,1,0,1,0,0|2,0,0]=4 5408 B7R1.1 CCC1CC=CC1 Amb30033009 [0,1,0,1,0,0|2,0,0]=4 5409 B7R1.1 CCC1CC=NN1 Amb32694405 [0,1,0,1,0,0|2,0,0]=4 5410 B7R1.1 CNC1CCSC1 Amb22741543 [0,1,0,1,0,0|1,0,1]=4 5411 B7R1.1 CNC1CCSC1 Amb31291647 [0,1,0,1,0,0|1,0,1]=4 5412 B7R1.1 CNC1CCSC1 Amb9711007 [0,1,0,1,0,0|1,0,1]=4 5413 B7R1.1 COC1C=CCC1 Amb4016570 [0,1,0,1,0,0|1,1,0]=4 5414 B7R1.1 COC1CC=CC1 Amb27421499 [0,1,0,1,0,0|1,1,0]=4 5415 B7R1.1 CSC1C=NCC1 Amb27466721 [0,1,0,1,0,0|1,0,1]=4 5416 B7R1.1 CSC1CCCC1 Amb22230463 [0,1,0,1,0,0|1,0,1]=4 5417 B7R1.1 CSC1CCNC1 Amb18279428 [0,1,0,1,0,0|1,0,1]=4 5418 B7R1.1 CSC1CCNC1 Amb32662537 [0,1,0,1,0,0|1,0,1]=4 5419 B7R1.1 C\C=C1/CCNC1 Amb31161498 [0,1,0,1,0,0|2,0,0]=4 5420 B7R1.1 C\C=C1/CCNC1 Amb33611505 [0,1,0,1,0,0|2,0,0]=4 5421 B7R1.1 ClC=C1CCCC1 Amb28118913 [0,1,0,1,0,0|2,0,0]=4 5422 B7R1.1 ClCC1CCSC1 Amb28423424 [0,1,0,1,0,0|1,0,1]=4 5423 B7R1.1 N#CC1=CCSC1 Amb25949534 [0,1,0,1,0,0|1,0,1]=4 5424 B7R1.1 N#CC1CCSC1 Amb33545171 [0,1,0,1,0,0|1,0,1]=4 5425 B7R1.1 N#C[C@@H]1CSCN1 Amb2686612 [0,1,0,1,0,0|1,0,1]=4 5426 B7R1.1 N#C[C@@H]1CSCN1 Amb27966624 [0,1,0,1,0,0|1,0,1]=4 5427 B7R1.1 NCC1=CCSC1 Amb35743801 [0,1,0,1,0,0|1,0,1]=4 5428 B7R1.1 NCC1C=CCC1 Amb18119742 [0,1,0,1,0,0|2,0,0]=4 5429 B7R1.1 NCC1C=CCC1 Amb30584689 [0,1,0,1,0,0|2,0,0]=4 5430 B7R1.1 NCC1CCSC1 Amb18198289 [0,1,0,1,0,0|1,0,1]=4 5431 B7R1.1 NCC1CSCO1 Amb27234625 [0,1,0,1,0,0|1,0,1]=4 5432 B7R1.1 NC[C@@H]1CSCN1 Amb28342007 [0,1,0,1,0,0|1,0,1]=4 5433 B7R1.1 NNC1CCSC1 Amb22741176 [0,1,0,1,0,0|1,0,1]=4 5434 B7R1.1 NNC1CCSC1 Amb32653036 [0,1,0,1,0,0|1,0,1]=4 5435 B7R1.1 NNC1CCSC1 Amb9714172 [0,1,0,1,0,0|1,0,1]=4 5436 B7R1.1 NOC1CCSC1 Amb29863366 [0,1,0,1,0,0|0,0,2]=4 5437 B7R1.1 O=C=C1CCCC1 Amb17673796 [0,1,0,1,0,0|1,0,0]=3 5438 B7R1.1 O=CC1=CCCC1 Amb17138358 [0,1,0,1,0,0|1,0,1]=4 5439 B7R1.1 O=CC1=CCSC1 Amb423472 [0,1,0,1,0,0|0,0,1]=3 5440 B7R1.1 O=CC1=COCC1 Amb18120774 [0,1,0,1,0,0|0,1,1]=4 5441 B7R1.1 O=CC1=NOCC1 Amb35788708 [0,1,0,1,0,0|1,1,0]=4 5442 B7R1.1 O=CC1C=CCC1 Amb27229924 [0,1,0,1,0,0|1,0,1]=4 5443 B7R1.1 O=CC1CC=CC1 Amb18638871 [0,1,0,1,0,0|1,0,0]=3 5444 B7R1.1 O=CC1CCCC1 Amb31292855 [0,1,0,1,0,0|1,0,0]=3 5445 B7R1.1 O=CC1CCCC1 Amb4605847 [0,1,0,1,0,0|1,0,0]=3 5446 B7R1.1 O=CC1CCCC1 Amb6297186 [0,1,0,1,0,0|1,0,0]=3 5447 B7R1.1 O=CC1CCCO1 Amb3939388 [0,1,0,1,0,0|1,0,0]=3 5448 B7R1.1 O=CC1CCCS1 Amb27214645 [0,1,0,1,0,0|1,0,0]=3 5449 B7R1.1 O=CC1CCNC1 Amb18197564 [0,1,0,1,0,0|1,0,0]=3 5450 B7R1.1 O=CC1CCOC1 Amb6608994 [0,1,0,1,0,0|0,1,0]=3 5451 B7R1.1 O=CC1CCSC1 Amb18199140 [0,1,0,1,0,0|0,0,0]=2 5452 B7R1.1 O=CC1OCCO1 Amb27592967 [0,1,0,1,0,0|2,0,0]=4 5453 B7R1.1 O=CN1CC=CC1 Amb27978047 [0,1,0,1,0,0|1,0,1]=4 5454 B7R1.1 O=CN1CCCC1 Amb2720947 [0,1,0,1,0,0|1,0,0]=3 5455 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [0,1,0,1,0,0|1,0,0]=3 5456 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [0,1,0,1,0,0|1,0,0]=3 5457 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [0,1,0,1,0,0|0,1,0]=3 5458 B7R1.1 O=NC1CCCN1 Amb27488681 [0,1,0,1,0,0|2,0,0]=4 5459 B7R1.1 O=NN1CCCC1 Amb9787681 [0,1,0,1,0,0|2,0,0]=4 5460 B7R1.1 O=NN1CCSC1 Amb25104685 [0,1,0,1,0,0|1,0,0]=3 5461 B7R1.1 OCC1=CCSC1 Amb35606324 [0,1,0,1,0,0|0,0,2]=4 5462 B7R1.1 OCC1=CSCC1 Amb28345026 [0,1,0,1,0,0|0,0,2]=4 5463 B7R1.1 OCC1C=CCC1 Amb23455253 [0,1,0,1,0,0|2,0,0]=4 5464 B7R1.1 OCC1CCSC1 Amb18203349 [0,1,0,1,0,0|0,0,2]=4 5465 B7R1.1 ON=C1CCCC1 Amb6538721 [0,1,0,1,0,0|1,0,1]=4 5466 B7R1.1 SCC1=CCSC1 Amb32788040 [0,1,0,1,0,0|0,1,1]=4 5467 B7R1.1 SCC1CCSC1 Amb32788496 [0,1,0,1,0,0|0,1,1]=4 5468 B7R1.1 [C-]#[N+]C1CCSC1 Amb33141891 [0,1,0,1,0,0|1,0,1]=4 5469 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [0,1,0,1,0,0|2,0,0]=4 5470 B7R1.2 C=C1COC(=O)C1 Amb24589821 [0,1,0,1,0,0|2,0,0]=4 5471 B7R1.2 C=C1COC(C)C1 Amb35695393 [0,1,0,1,0,0|1,1,0]=4 5472 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [0,1,0,1,0,0|1,0,0]=3 5473 B7R1.2 CC1=CC(=O)CN1 Amb27390872 [0,1,0,1,0,0|2,0,0]=4 5474 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,1,0,1,0,0|2,0,0]=4 5475 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [0,1,0,1,0,0|2,0,0]=4 5476 B7R1.2 CC1=CC(=O)OC1 Amb22002703 [0,1,0,1,0,0|2,0,0]=4 5477 B7R1.2 CC1=CC(C)CC1 Amb24479860 [0,1,0,1,0,0|2,0,0]=4 5478 B7R1.2 CC1=NC(=O)CS1 Amb27838191 [0,1,0,1,0,0|1,0,1]=4 5479 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [0,1,0,1,0,0|2,0,0]=4 5480 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [0,1,0,1,0,0|2,0,0]=4 5481 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [0,1,0,1,0,0|1,0,1]=4 5482 B7R1.2 CC1C=CC(C)C1 Amb28365868 [0,1,0,1,0,0|2,0,0]=4 5483 B7R1.2 CC1CC(=O)CN1 Amb28349308 [0,1,0,1,0,0|1,0,0]=3 5484 B7R1.2 CC1CC(=O)CO1 Amb25888380 [0,1,0,1,0,0|0,1,0]=3 5485 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,1,0,1,0,0|0,0,0]=2 5486 B7R1.2 CC1CC(=O)NN1 Amb493880 [0,1,0,1,0,0|2,0,0]=4 5487 B7R1.2 CC1CC(N)CS1 Amb18202610 [0,1,0,1,0,0|1,0,1]=4 5488 B7R1.2 CC1CC(S)CS1 Amb28050071 [0,1,0,1,0,0|0,1,1]=4 5489 B7R1.2 CC1CCC(=O)C1 Amb8513672 [0,1,0,1,0,0|1,0,0]=3 5490 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,1,0,1,0,0|1,0,0]=3 5491 B7R1.2 CC1CCC(=O)O1 Amb6298321 [0,1,0,1,0,0|1,0,0]=3 5492 B7R1.2 CC1CCC(=O)S1 Amb27252897 [0,1,0,1,0,0|1,0,0]=3 5493 B7R1.2 CC1CCC(=S)N1 Amb27849283 [0,1,0,1,0,0|1,1,0]=4 5494 B7R1.2 CC1CNC(=O)C1 Amb10608004 [0,1,0,1,0,0|2,0,0]=4 5495 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,1,0,1,0,0|2,0,0]=4 5496 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,1,0,1,0,0|2,0,0]=4 5497 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,1,0,1,0,0|2,0,0]=4 5498 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,1,0,1,0,0|2,0,0]=4 5499 B7R1.2 CC1COC(=O)O1 Amb8513300 [0,1,0,1,0,0|2,0,0]=4 5500 B7R1.2 CC1CSC(=O)N1 Amb28320497 [0,1,0,1,0,0|2,0,0]=4 5501 B7R1.2 CC1NC(=O)CS1 Amb27806202 [0,1,0,1,0,0|1,0,0]=3 5502 B7R1.2 CC1NCC(=O)N1 Amb28456791 [0,1,0,1,0,0|2,0,0]=4 5503 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,1,0,1,0,0|1,0,0]=3 5504 B7R1.2 CN1CCC(=O)C1 Amb22236123 [0,1,0,1,0,0|1,0,0]=3 5505 B7R1.2 CN1CCC(=O)C1 Amb8947873 [0,1,0,1,0,0|1,0,0]=3 5506 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,1,0,1,0,0|1,0,0]=3 5507 B7R1.2 CN1CCC(N)=N1 Amb28827647 [0,1,0,1,0,0|2,0,0]=4 5508 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [0,1,0,1,0,0|1,0,1]=4 5509 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,1,0,1,0,0|1,0,0]=3 5510 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,1,0,1,0,0|1,0,0]=3 5511 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [0,1,0,1,0,0|1,0,0]=3 5512 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,1,0,1,0,0|2,0,0]=4 5513 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,1,0,1,0,0|2,0,0]=4 5514 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,1,0,1,0,0|2,0,0]=4 5515 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,1,0,1,0,0|2,0,0]=4 5516 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [0,1,0,1,0,0|2,0,0]=4 5517 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [0,1,0,1,0,0|1,0,1]=4 5518 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [0,1,0,1,0,0|1,0,0]=3 5519 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [0,1,0,1,0,0|2,0,0]=4 5520 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [0,1,0,1,0,0|2,0,0]=4 5521 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,1,0,1,0,0|2,0,0]=4 5522 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [0,1,0,1,0,0|2,0,0]=4 5523 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [0,1,0,1,0,0|2,0,0]=4 5524 B7R1.2 C[C@H]1C[C@@H](O)CS1 Amb27662171 [0,1,0,1,0,0|0,0,2]=4 5525 B7R1.2 N=C1CC(=O)CS1 Amb27227202 [0,1,0,1,0,0|0,0,1]=3 5526 B7R1.2 N=C1NC(=O)CS1 Amb8468365 [0,1,0,1,0,0|1,0,1]=4 5527 B7R1.2 NC1=CC(=O)CC1 Amb9753541 [0,1,0,1,0,0|1,0,1]=4 5528 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [0,1,0,1,0,0|0,0,2]=4 5529 B7R1.2 NC1=NC(=O)CS1 Amb6364701 [0,1,0,1,0,0|1,0,1]=4 5530 B7R1.2 NC1C=CC(=O)C1 Amb27445487 [0,1,0,1,0,0|1,0,1]=4 5531 B7R1.2 NC1CCC(=O)C1 Amb22494268 [0,1,0,1,0,0|1,0,0]=3 5532 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,1,0,1,0,0|2,0,0]=4 5533 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,1,0,1,0,0|2,0,0]=4 5534 B7R1.2 NC1CCS(=O)C1 Amb19149072 [0,1,0,1,0,0|2,0,0]=4 5535 B7R1.2 NC1CCS(=O)C1 Amb25133789 [0,1,0,1,0,0|2,0,0]=4 5536 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,1,0,1,0,0|2,0,0]=4 5537 B7R1.2 NC1CNC(=O)C1 Amb33544169 [0,1,0,1,0,0|2,0,0]=4 5538 B7R1.2 NC1COC(=O)C1 Amb30594428 [0,1,0,1,0,0|2,0,0]=4 5539 B7R1.2 NC1COC(=O)C1 Amb9782136 [0,1,0,1,0,0|2,0,0]=4 5540 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,1,0,1,0,0|2,0,0]=4 5541 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,1,0,1,0,0|2,0,0]=4 5542 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [0,1,0,1,0,0|2,0,0]=4 5543 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [0,1,0,1,0,0|2,0,0]=4 5544 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [0,1,0,1,0,0|2,0,0]=4 5545 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [0,1,0,1,0,0|2,0,0]=4 5546 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,1,0,1,0,0|2,0,0]=4 5547 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [0,1,0,1,0,0|2,0,0]=4 5548 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,1,0,1,0,0|2,0,0]=4 5549 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,1,0,1,0,0|2,0,0]=4 5550 B7R1.2 O=C1C=C(Br)CC1 Amb23399816 [0,1,0,1,0,0|1,0,1]=4 5551 B7R1.2 O=C1C=C(Cl)CC1 Amb9753542 [0,1,0,1,0,0|1,0,1]=4 5552 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [0,1,0,1,0,0|1,0,1]=4 5553 B7R1.2 O=C1C=CC(Br)C1 Amb27809803 [0,1,0,1,0,0|1,0,1]=4 5554 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [0,1,0,1,0,0|1,0,1]=4 5555 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [0,1,0,1,0,0|1,0,1]=4 5556 B7R1.2 O=C1C=C[C@H](Cl)C1 Amb27984687 [0,1,0,1,0,0|1,0,1]=4 5557 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [0,1,0,1,0,0|1,0,1]=4 5558 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,1,0,1,0,0|2,0,0]=4 5559 B7R1.2 O=C1CC(I)CO1 Amb27401189 [0,1,0,1,0,0|2,0,0]=4 5560 B7R1.2 O=C1CC(O)CN1 Amb19958404 [0,1,0,1,0,0|2,0,0]=4 5561 B7R1.2 O=C1CC(O)CO1 Amb4006296 [0,1,0,1,0,0|2,0,0]=4 5562 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,1,0,1,0,0|2,0,0]=4 5563 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [0,1,0,1,0,0|1,0,0]=3 5564 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [0,1,0,1,0,0|2,0,0]=4 5565 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [0,1,0,1,0,0|2,0,0]=4 5566 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [0,1,0,1,0,0|2,0,0]=4 5567 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [0,1,0,1,0,0|2,0,0]=4 5568 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [0,1,0,1,0,0|1,0,0]=3 5569 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [0,1,0,1,0,0|2,0,0]=4 5570 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,1,0,1,0,0|2,0,0]=4 5571 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [0,1,0,1,0,0|1,0,0]=3 5572 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [0,1,0,1,0,0|2,0,0]=4 5573 B7R1.2 O=C1CCC(F)C1 Amb21963553 [0,1,0,1,0,0|1,0,0]=3 5574 B7R1.2 O=C1CCC(O)C1 Amb22057378 [0,1,0,1,0,0|1,0,0]=3 5575 B7R1.2 O=C1CCC(O)O1 Amb22740957 [0,1,0,1,0,0|2,0,0]=4 5576 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [0,1,0,1,0,0|0,0,1]=3 5577 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [0,1,0,1,0,0|1,0,0]=3 5578 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [0,1,0,1,0,0|2,0,0]=4 5579 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [0,1,0,1,0,0|1,0,0]=3 5580 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [0,1,0,1,0,0|2,0,0]=4 5581 B7R1.2 O=C1CN(Cl)CN1 Amb27795741 [0,1,0,1,0,0|2,0,0]=4 5582 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [0,1,0,1,0,0|1,0,1]=4 5583 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,1,0,1,0,0|2,0,0]=4 5584 B7R1.2 O=C1COC(=O)C1 Amb2721303 [0,1,0,1,0,0|0,1,1]=4 5585 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [0,1,0,1,0,0|0,0,1]=3 5586 B7R1.2 O=C1CSC(=O)N1 Amb1853667 [0,1,0,1,0,0|1,0,1]=4 5587 B7R1.2 O=C1CSC(=O)[N-]1 Amb435911 [0,1,0,1,0,0|1,0,1]=4 5588 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [0,1,0,1,0,0|1,0,1]=4 5589 B7R1.2 O=C1CSC(Br)=N1 Amb29850234 [0,1,0,1,0,0|1,0,1]=4 5590 B7R1.2 O=C1CSC(Cl)=N1 Amb29850164 [0,1,0,1,0,0|1,0,1]=4 5591 B7R1.2 O=C1CSC(S)=N1 Amb837069 [0,1,0,1,0,0|1,0,1]=4 5592 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [0,1,0,1,0,0|2,0,0]=4 5593 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [0,1,0,1,0,0|2,0,0]=4 5594 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,1,0,1,0,0|2,0,0]=4 5595 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [0,1,0,1,0,0|2,0,0]=4 5596 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [0,1,0,1,0,0|2,0,0]=4 5597 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,1,0,1,0,0|2,0,0]=4 5598 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [0,1,0,1,0,0|2,0,0]=4 5599 B7R1.2 O=S1CCC(O)C1 Amb26600157 [0,1,0,1,0,0|2,0,0]=4 5600 B7R1.2 O=S1CCS(=O)C1 Amb27217021 [0,1,0,1,0,0|1,0,1]=4 5601 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [0,1,0,1,0,0|2,0,0]=4 5602 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,1,0,1,0,0|2,0,0]=4 5603 B7R1.3 BrC1=CCCCC1 Amb21856761 [0,1,0,1,0,0|2,0,0]=4 5604 B7R1.3 BrC1=CCCNC1 Amb27173423 [0,1,0,1,0,0|2,0,0]=4 5605 B7R1.3 BrC1=CCCNC1 Amb32651839 [0,1,0,1,0,0|2,0,0]=4 5606 B7R1.3 BrC1=CCNCC1 Amb24317585 [0,1,0,1,0,0|2,0,0]=4 5607 B7R1.3 BrC1=CCNCC1 Amb33189234 [0,1,0,1,0,0|2,0,0]=4 5608 B7R1.3 BrC1=CCOCC1 Amb21964919 [0,1,0,1,0,0|1,1,0]=4 5609 B7R1.3 BrC1=CCSCC1 Amb22229691 [0,1,0,1,0,0|1,0,0]=3 5610 B7R1.3 BrC1C=CCCC1 Amb2720845 [0,1,0,1,0,0|2,0,0]=4 5611 B7R1.3 BrC1C=NCCC1 Amb24322652 [0,1,0,1,0,0|2,0,0]=4 5612 B7R1.3 BrC1CC=CCC1 Amb22229671 [0,1,0,1,0,0|2,0,0]=4 5613 B7R1.3 BrC1CCCSC1 Amb26545490 [0,1,0,1,0,0|1,0,1]=4 5614 B7R1.3 BrC1CCSCC1 Amb18181050 [0,1,0,1,0,0|1,0,1]=4 5615 B7R1.3 Br[C@H]1C=CCCC1 Amb27442441 [0,1,0,1,0,0|2,0,0]=4 5616 B7R1.3 C=C1CCCCC1 Amb8515603 [0,1,0,1,0,0|2,0,0]=4 5617 B7R1.3 C=C1CCCCN1 Amb27801038 [0,1,0,1,0,0|2,0,0]=4 5618 B7R1.3 C=C1CCCCO1 Amb28345156 [0,1,0,1,0,0|1,0,1]=4 5619 B7R1.3 C=C1CCCNC1 Amb19514641 [0,1,0,1,0,0|2,0,0]=4 5620 B7R1.3 C=C1CCCNC1 Amb22059305 [0,1,0,1,0,0|2,0,0]=4 5621 B7R1.3 C=C1CCCOC1 Amb27594580 [0,1,0,1,0,0|1,1,0]=4 5622 B7R1.3 C=C1CCCSC1 Amb22494848 [0,1,0,1,0,0|1,0,0]=3 5623 B7R1.3 C=C1CCNCC1 Amb19514763 [0,1,0,1,0,0|2,0,0]=4 5624 B7R1.3 C=C1CCNCC1 Amb24079604 [0,1,0,1,0,0|2,0,0]=4 5625 B7R1.3 C=C1CCNCC1 Amb33715165 [0,1,0,1,0,0|2,0,0]=4 5626 B7R1.3 C=C1CCOCC1 Amb22000865 [0,1,0,1,0,0|1,1,0]=4 5627 B7R1.3 CC1=CCCCC1 Amb8513524 [0,1,0,1,0,0|2,0,0]=4 5628 B7R1.3 CC1=CCCNC1 Amb23439963 [0,1,0,1,0,0|2,0,0]=4 5629 B7R1.3 CC1=CCCNC1 Amb25063349 [0,1,0,1,0,0|2,0,0]=4 5630 B7R1.3 CC1=CCNCC1 Amb18639053 [0,1,0,1,0,0|2,0,0]=4 5631 B7R1.3 CC1=CCNCC1 Amb21961140 [0,1,0,1,0,0|2,0,0]=4 5632 B7R1.3 CC1=CCOCC1 Amb24070517 [0,1,0,1,0,0|1,1,0]=4 5633 B7R1.3 CC1=NCCCC1 Amb27459940 [0,1,0,1,0,0|2,0,0]=4 5634 B7R1.3 CC1=NCCCS1 Amb25808748 [0,1,0,1,0,0|1,0,1]=4 5635 B7R1.3 CC1=NCCNC1 Amb22755966 [0,1,0,1,0,0|2,0,0]=4 5636 B7R1.3 CC1C=CCCC1 Amb8515346 [0,1,0,1,0,0|2,0,0]=4 5637 B7R1.3 CC1C=CCCN1 Amb27461298 [0,1,0,1,0,0|2,0,0]=4 5638 B7R1.3 CC1C=CCCO1 Amb33715160 [0,1,0,1,0,0|1,1,0]=4 5639 B7R1.3 CC1C=CCNC1 Amb27170704 [0,1,0,1,0,0|2,0,0]=4 5640 B7R1.3 CC1C=COCC1 Amb27985265 [0,1,0,1,0,0|2,0,0]=4 5641 B7R1.3 CC1CC=CCN1 Amb27460532 [0,1,0,1,0,0|2,0,0]=4 5642 B7R1.3 CC1CC=NCC1 Amb27453017 [0,1,0,1,0,0|2,0,0]=4 5643 B7R1.3 CC1CCCCS1 Amb17666899 [0,1,0,1,0,0|1,0,1]=4 5644 B7R1.3 CC1CCSCC1 Amb27436849 [0,1,0,1,0,0|1,0,1]=4 5645 B7R1.3 CC1CNCCS1 Amb32753223 [0,1,0,1,0,0|2,0,0]=4 5646 B7R1.3 CC1CNCCS1 Amb6683465 [0,1,0,1,0,0|2,0,0]=4 5647 B7R1.3 CC1CSCCN1 Amb9735876 [0,1,0,1,0,0|1,0,1]=4 5648 B7R1.3 CC1SCCCS1 Amb10071965 [0,1,0,1,0,0|0,1,1]=4 5649 B7R1.3 CC1SCCSS1 Amb27488273 [0,1,0,1,0,0|1,1,0]=4 5650 B7R1.3 CN1CC=CCC1 Amb22734271 [0,1,0,1,0,0|2,0,0]=4 5651 B7R1.3 CN1CSCSC1 Amb10552429 [0,1,0,1,0,0|2,0,0]=4 5652 B7R1.3 C[C@@H]1CNCCS1 Amb28423156 [0,1,0,1,0,0|2,0,0]=4 5653 B7R1.3 C[C@@H]1CNCCS1 Amb32671471 [0,1,0,1,0,0|2,0,0]=4 5654 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [0,1,0,1,0,0|1,0,1]=4 5655 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [0,1,0,1,0,0|1,0,1]=4 5656 B7R1.3 ClC1=CCCCC1 Amb9785147 [0,1,0,1,0,0|2,0,0]=4 5657 B7R1.3 ClC1=CCCNC1 Amb32664385 [0,1,0,1,0,0|2,0,0]=4 5658 B7R1.3 ClC1=CCCNC1 Amb32664386 [0,1,0,1,0,0|2,0,0]=4 5659 B7R1.3 ClC1C=CCCC1 Amb22229267 [0,1,0,1,0,0|2,0,0]=4 5660 B7R1.3 ClC1C=CCNC1 Amb32679264 [0,1,0,1,0,0|2,0,0]=4 5661 B7R1.3 ClC1C=CCNC1 Amb32679265 [0,1,0,1,0,0|2,0,0]=4 5662 B7R1.3 ClC1C=CCOC1 Amb27955246 [0,1,0,1,0,0|1,1,0]=4 5663 B7R1.3 ClC1CC=CCC1 Amb22229749 [0,1,0,1,0,0|2,0,0]=4 5664 B7R1.3 ClC1CCCCS1 Amb28123985 [0,1,0,1,0,0|1,0,1]=4 5665 B7R1.3 ClC1CSCCS1 Amb27659242 [0,1,0,1,0,0|1,0,1]=4 5666 B7R1.3 ClC1CSCSC1 Amb28385897 [0,1,0,1,0,0|0,1,1]=4 5667 B7R1.3 FC1=CCCNC1 Amb27181097 [0,1,0,1,0,0|2,0,0]=4 5668 B7R1.3 FC1=CCCNC1 Amb28314663 [0,1,0,1,0,0|2,0,0]=4 5669 B7R1.3 FC1=CCNCC1 Amb27600797 [0,1,0,1,0,0|2,0,0]=4 5670 B7R1.3 FC1=CCNCC1 Amb33484309 [0,1,0,1,0,0|2,0,0]=4 5671 B7R1.3 FC1C=CCCC1 Amb27164038 [0,1,0,1,0,0|2,0,0]=4 5672 B7R1.3 IC1=CCCCC1 Amb27750996 [0,1,0,1,0,0|2,0,0]=4 5673 B7R1.3 IC1=CCOCC1 Amb25364046 [0,1,0,1,0,0|1,1,0]=4 5674 B7R1.3 IC1CC=CCC1 Amb27446684 [0,1,0,1,0,0|2,0,0]=4 5675 B7R1.3 IC1CCSCC1 Amb2724105 [0,1,0,1,0,0|1,0,1]=4 5676 B7R1.3 N=C1CCCCC1 Amb26924126 [0,1,0,1,0,0|2,0,0]=4 5677 B7R1.3 N=C1CCCCN1 Amb17616049 [0,1,0,1,0,0|2,0,0]=4 5678 B7R1.3 N=C1CCCCN1 Amb2780013 [0,1,0,1,0,0|2,0,0]=4 5679 B7R1.3 N=C1COCCN1 Amb24654396 [0,1,0,1,0,0|1,1,0]=4 5680 B7R1.3 N=C1COCCN1 Amb28468104 [0,1,0,1,0,0|1,1,0]=4 5681 B7R1.3 N=C1CSCCN1 Amb32679434 [0,1,0,1,0,0|1,0,0]=3 5682 B7R1.3 NC1=CCCCC1 Amb28456773 [0,1,0,1,0,0|2,0,0]=4 5683 B7R1.3 NC1=NCCCC1 Amb3997189 [0,1,0,1,0,0|2,0,0]=4 5684 B7R1.3 NC1=NCCOC1 Amb33743898 [0,1,0,1,0,0|1,1,0]=4 5685 B7R1.3 NC1=NCCSC1 Amb844759 [0,1,0,1,0,0|1,0,0]=3 5686 B7R1.3 NC1C=CCCC1 Amb20668839 [0,1,0,1,0,0|2,0,0]=4 5687 B7R1.3 NC1C=CCCC1 Amb23385297 [0,1,0,1,0,0|2,0,0]=4 5688 B7R1.3 NC1CC=CCC1 Amb18639038 [0,1,0,1,0,0|2,0,0]=4 5689 B7R1.3 NC1CC=CCC1 Amb19515491 [0,1,0,1,0,0|2,0,0]=4 5690 B7R1.3 NC1CCCCS1 Amb28052869 [0,1,0,1,0,0|1,0,1]=4 5691 B7R1.3 NC1CCCSC1 Amb13953228 [0,1,0,1,0,0|1,0,1]=4 5692 B7R1.3 NC1CCCSC1 Amb32660970 [0,1,0,1,0,0|1,0,1]=4 5693 B7R1.3 NC1CCSCC1 Amb13952147 [0,1,0,1,0,0|1,0,1]=4 5694 B7R1.3 NC1CCSCC1 Amb2724106 [0,1,0,1,0,0|1,0,1]=4 5695 B7R1.3 NC1CNCCS1 Amb28365414 [0,1,0,1,0,0|2,0,0]=4 5696 B7R1.3 NC1CSCSC1 Amb19148038 [0,1,0,1,0,0|0,1,1]=4 5697 B7R1.3 NN1CCSCC1 Amb18641480 [0,1,0,1,0,0|2,0,0]=4 5698 B7R1.3 N[C@@H]1C=CCCC1 Amb24640515 [0,1,0,1,0,0|2,0,0]=4 5699 B7R1.3 N[C@@H]1CC=CCC1 Amb27975676 [0,1,0,1,0,0|2,0,0]=4 5700 B7R1.3 N[C@H]1CC=CCC1 Amb26609127 [0,1,0,1,0,0|2,0,0]=4 5701 B7R1.3 O=C1C=CCCC1 Amb17843126 [0,1,0,1,0,0|1,0,1]=4 5702 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,1,0,1,0,0|1,0,1]=4 5703 B7R1.3 O=C1C=CCCO1 Amb15693457 [0,1,0,1,0,0|1,0,1]=4 5704 B7R1.3 O=C1C=CCOC1 Amb22234519 [0,1,0,1,0,0|0,1,1]=4 5705 B7R1.3 O=C1C=CCSC1 Amb26544956 [0,1,0,1,0,0|0,0,1]=3 5706 B7R1.3 O=C1C=CNCC1 Amb2700614 [0,1,0,1,0,0|1,0,1]=4 5707 B7R1.3 O=C1C=COCC1 Amb22000873 [0,1,0,1,0,0|0,1,1]=4 5708 B7R1.3 O=C1C=CSCC1 Amb25375022 [0,1,0,1,0,0|0,0,1]=3 5709 B7R1.3 O=C1C=NCCN1 Amb28341190 [0,1,0,1,0,0|1,0,1]=4 5710 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,1,0,1,0,0|1,0,1]=4 5711 B7R1.3 O=C1CCCCC1 Amb2793026 [0,1,0,1,0,0|1,0,0]=3 5712 B7R1.3 O=C1CCCCN1 Amb6892006 [0,1,0,1,0,0|1,0,0]=3 5713 B7R1.3 O=C1CCCCO1 Amb8513592 [0,1,0,1,0,0|1,0,0]=3 5714 B7R1.3 O=C1CCCCS1 Amb25186924 [0,1,0,1,0,0|1,0,0]=3 5715 B7R1.3 O=C1CCCNC1 Amb10070944 [0,1,0,1,0,0|1,0,0]=3 5716 B7R1.3 O=C1CCCNC1 Amb10602349 [0,1,0,1,0,0|1,0,0]=3 5717 B7R1.3 O=C1CCCNC1 Amb19958010 [0,1,0,1,0,0|1,0,0]=3 5718 B7R1.3 O=C1CCCNN1 Amb18061622 [0,1,0,1,0,0|2,0,0]=4 5719 B7R1.3 O=C1CCCOC1 Amb19373430 [0,1,0,1,0,0|0,1,0]=3 5720 B7R1.3 O=C1CCCON1 Amb26560803 [0,1,0,1,0,0|1,1,0]=4 5721 B7R1.3 O=C1CCCSC1 Amb13952257 [0,1,0,1,0,0|0,0,0]=2 5722 B7R1.3 O=C1CCN=CN1 Amb27447786 [0,1,0,1,0,0|1,0,1]=4 5723 B7R1.3 O=C1CCNCC1 Amb2690392 [0,1,0,1,0,0|1,0,0]=3 5724 B7R1.3 O=C1CCNCC1 Amb2793002 [0,1,0,1,0,0|1,0,0]=3 5725 B7R1.3 O=C1CCNCC1 Amb8394939 [0,1,0,1,0,0|1,0,0]=3 5726 B7R1.3 O=C1CCNCN1 Amb27458283 [0,1,0,1,0,0|1,0,0]=3 5727 B7R1.3 O=C1CCOCC1 Amb2725565 [0,1,0,1,0,0|0,1,0]=3 5728 B7R1.3 O=C1CCSCC1 Amb1154265 [0,1,0,1,0,0|0,0,0]=2 5729 B7R1.3 O=C1CNCCN1 Amb4138465 [0,1,0,1,0,0|1,0,0]=3 5730 B7R1.3 O=C1CNCCN1 Amb6334808 [0,1,0,1,0,0|1,0,0]=3 5731 B7R1.3 O=C1CNCCO1 Amb19958702 [0,1,0,1,0,0|1,0,0]=3 5732 B7R1.3 O=C1CNCCO1 Amb32410210 [0,1,0,1,0,0|1,0,0]=3 5733 B7R1.3 O=C1COCCN1 Amb15691115 [0,1,0,1,0,0|0,1,0]=3 5734 B7R1.3 O=C1COCCO1 Amb17933352 [0,1,0,1,0,0|0,1,0]=3 5735 B7R1.3 O=C1CSC=CN1 Amb2386683 [0,1,0,1,0,0|0,0,2]=4 5736 B7R1.3 O=C1CSCCN1 Amb674722 [0,1,0,1,0,0|0,0,0]=2 5737 B7R1.3 O=C1CSCCO1 Amb28069740 [0,1,0,1,0,0|0,0,0]=2 5738 B7R1.3 O=C1CSCCS1 Amb24539369 [0,1,0,1,0,0|0,0,0]=2 5739 B7R1.3 O=C1CSCSC1 Amb19148039 [0,1,0,1,0,0|0,0,0]=2 5740 B7R1.3 O=C1N=CCCN1 Amb24480889 [0,1,0,1,0,0|2,0,0]=4 5741 B7R1.3 O=C1NCCCN1 Amb4034594 [0,1,0,1,0,0|2,0,0]=4 5742 B7R1.3 O=C1NCCCO1 Amb10608499 [0,1,0,1,0,0|2,0,0]=4 5743 B7R1.3 O=C1NCCCS1 Amb24117134 [0,1,0,1,0,0|2,0,0]=4 5744 B7R1.3 O=C1NCCNN1 Amb28341733 [0,1,0,1,0,0|2,0,0]=4 5745 B7R1.3 O=C1NCNCN1 Amb25146452 [0,1,0,1,0,0|2,0,0]=4 5746 B7R1.3 O=C1NNCCO1 Amb32683554 [0,1,0,1,0,0|2,0,0]=4 5747 B7R1.3 O=C1OCCCO1 Amb4034896 [0,1,0,1,0,0|2,0,0]=4 5748 B7R1.3 O=S1CCCNC1 Amb27195521 [0,1,0,1,0,0|1,0,1]=4 5749 B7R1.3 O=S1CCNCC1 Amb18943760 [0,1,0,1,0,0|2,0,0]=4 5750 B7R1.3 O=S1CCNCC1 Amb6307179 [0,1,0,1,0,0|2,0,0]=4 5751 B7R1.3 O=S1CCOCC1 Amb26535052 [0,1,0,1,0,0|1,1,0]=4 5752 B7R1.3 O=S1CCSCC1 Amb25679286 [0,1,0,1,0,0|1,0,0]=3 5753 B7R1.3 OC1=NCCNC1 Amb22330543 [0,1,0,1,0,0|1,0,1]=4 5754 B7R1.3 OC1C=CCCC1 Amb4605824 [0,1,0,1,0,0|2,0,0]=4 5755 B7R1.3 OC1C=CCNC1 Amb24426687 [0,1,0,1,0,0|2,0,0]=4 5756 B7R1.3 OC1C=CCNC1 Amb31291592 [0,1,0,1,0,0|2,0,0]=4 5757 B7R1.3 OC1C=CCOC1 Amb25662556 [0,1,0,1,0,0|1,1,0]=4 5758 B7R1.3 OC1C=CCSC1 Amb25832664 [0,1,0,1,0,0|1,0,0]=3 5759 B7R1.3 OC1CCCSC1 Amb4034626 [0,1,0,1,0,0|0,0,2]=4 5760 B7R1.3 OC1CCSCC1 Amb2610612 [0,1,0,1,0,0|0,0,2]=4 5761 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [0,1,0,1,0,0|2,0,0]=4 5762 B7R1.3 O[C@H]1C=CCOC1 Amb8393976 [0,1,0,1,0,0|1,1,0]=4 5763 B7R1.3 S=C1CCCCN1 Amb5720520 [0,1,0,1,0,0|1,1,0]=4 5764 B7R1.3 S=C1CCNCC1 Amb27232690 [0,1,0,1,0,0|1,1,0]=4 5765 B7R1.3 S=C1CCNCN1 Amb27205983 [0,1,0,1,0,0|1,1,0]=4 5766 B7R1.3 S=C1NCSCN1 Amb27838255 [0,1,0,1,0,0|1,1,0]=4 5767 B7R1.3 SC1CC=CCC1 Amb33318612 [0,1,0,1,0,0|2,0,0]=4 5768 B7R1.3 SC1CCCSC1 Amb27480711 [0,1,0,1,0,0|0,1,1]=4 5769 B7R1.3 SC1CCSCC1 Amb26045860 [0,1,0,1,0,0|0,1,1]=4 5770 B7R1.4 BrC1CSCC1Br Amb27423459 [0,1,0,1,0,0|1,0,1]=4 5771 B7R1.4 C=C1CCCC1=O Amb17593061 [0,1,0,1,0,0|1,0,1]=4 5772 B7R1.4 C=C1CCNC1=O Amb26415156 [0,1,0,1,0,0|1,0,1]=4 5773 B7R1.4 C=C1CCOC1=O Amb3941636 [0,1,0,1,0,0|1,0,1]=4 5774 B7R1.4 C=C1CNCC1C Amb28197991 [0,1,0,1,0,0|2,0,0]=4 5775 B7R1.4 C=C1COCC1N Amb31252146 [0,1,0,1,0,0|1,1,0]=4 5776 B7R1.4 C=C1COCC1N Amb32795022 [0,1,0,1,0,0|1,1,0]=4 5777 B7R1.4 C=C1COCC1O Amb24423437 [0,1,0,1,0,0|1,1,0]=4 5778 B7R1.4 CC1=C(Br)CCC1 Amb24479762 [0,1,0,1,0,0|2,0,0]=4 5779 B7R1.4 CC1=C(C)CCC1 Amb22227705 [0,1,0,1,0,0|2,0,0]=4 5780 B7R1.4 CC1=C(C)CNC1 Amb28326117 [0,1,0,1,0,0|2,0,0]=4 5781 B7R1.4 CC1=C(S)CCO1 Amb16232456 [0,1,0,1,0,0|0,2,0]=4 5782 B7R1.4 CC1=CCCC1=O Amb8514958 [0,1,0,1,0,0|1,0,0]=3 5783 B7R1.4 CC1=CCCC1C Amb24479857 [0,1,0,1,0,0|2,0,0]=4 5784 B7R1.4 CC1=CCCN1C Amb17938859 [0,1,0,1,0,0|2,0,0]=4 5785 B7R1.4 CC1=CCOC1=O Amb16231256 [0,1,0,1,0,0|1,0,1]=4 5786 B7R1.4 CC1=NCCN1C Amb28456778 [0,1,0,1,0,0|2,0,0]=4 5787 B7R1.4 CC1=[N+](C)CCS1 Amb24060954 [0,1,0,1,0,0|2,0,0]=4 5788 B7R1.4 CC1C=CCC1C Amb27454828 [0,1,0,1,0,0|2,0,0]=4 5789 B7R1.4 CC1C=CCC1O Amb28324626 [0,1,0,1,0,0|2,0,0]=4 5790 B7R1.4 CC1CCCC1=O Amb8514830 [0,1,0,1,0,0|1,0,0]=3 5791 B7R1.4 CC1CCCC1=S Amb27483022 [0,1,0,1,0,0|1,1,0]=4 5792 B7R1.4 CC1CCNC1=O Amb10603701 [0,1,0,1,0,0|1,0,0]=3 5793 B7R1.4 CC1CCOC1=O Amb16185414 [0,1,0,1,0,0|1,0,0]=3 5794 B7R1.4 CC1CNNC1=O Amb27228083 [0,1,0,1,0,0|2,0,0]=4 5795 B7R1.4 CC1COCC1=O Amb24333426 [0,1,0,1,0,0|0,1,0]=3 5796 B7R1.4 CC1CONC1=O Amb33714888 [0,1,0,1,0,0|1,1,0]=4 5797 B7R1.4 CC1CSCC1=O Amb21964769 [0,1,0,1,0,0|0,0,0]=2 5798 B7R1.4 CC1CSCC1Br Amb27252722 [0,1,0,1,0,0|1,0,1]=4 5799 B7R1.4 CC1CSCC1N Amb18202602 [0,1,0,1,0,0|1,0,1]=4 5800 B7R1.4 CC1CSCC1S Amb24386420 [0,1,0,1,0,0|0,1,1]=4 5801 B7R1.4 CC1NCCC1=O Amb26950680 [0,1,0,1,0,0|1,0,0]=3 5802 B7R1.4 CC1NCCC1=O Amb32410228 [0,1,0,1,0,0|1,0,0]=3 5803 B7R1.4 CC1OCCC1=O Amb2725497 [0,1,0,1,0,0|0,1,0]=3 5804 B7R1.4 CC1OCNC1=O Amb28046854 [0,1,0,1,0,0|1,1,0]=4 5805 B7R1.4 CC1SCCC1=O Amb8392845 [0,1,0,1,0,0|0,0,0]=2 5806 B7R1.4 CC1SCCC1=S Amb27792245 [0,1,0,1,0,0|0,1,0]=3 5807 B7R1.4 CC1SCCC1Cl Amb28144167 [0,1,0,1,0,0|1,0,1]=4 5808 B7R1.4 CC1SCCC1N Amb20623835 [0,1,0,1,0,0|1,0,1]=4 5809 B7R1.4 CC1SCCC1N Amb28827634 [0,1,0,1,0,0|1,0,1]=4 5810 B7R1.4 CC1SCCC1O Amb20623836 [0,1,0,1,0,0|0,0,2]=4 5811 B7R1.4 CC1SCCC1S Amb26335064 [0,1,0,1,0,0|0,1,1]=4 5812 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [0,1,0,1,0,0|0,0,2]=4 5813 B7R1.4 CC1SCC[C@H]1O Amb20623837 [0,1,0,1,0,0|0,0,2]=4 5814 B7R1.4 CC1SCNC1=O Amb27211661 [0,1,0,1,0,0|1,0,0]=3 5815 B7R1.4 CN1CC=CC1=O Amb22372248 [0,1,0,1,0,0|1,0,1]=4 5816 B7R1.4 CN1CCCC1=N Amb20669437 [0,1,0,1,0,0|2,0,0]=4 5817 B7R1.4 CN1CCCC1=O Amb22493780 [0,1,0,1,0,0|1,0,0]=3 5818 B7R1.4 CN1CCCC1=O Amb6608842 [0,1,0,1,0,0|1,0,0]=3 5819 B7R1.4 CN1CCCC1=S Amb10562641 [0,1,0,1,0,0|1,1,0]=4 5820 B7R1.4 CN1CCN=C1N Amb18639451 [0,1,0,1,0,0|2,0,0]=4 5821 B7R1.4 CN1CCN=C1N Amb32412656 [0,1,0,1,0,0|2,0,0]=4 5822 B7R1.4 CN1CCN=C1N Amb6383421 [0,1,0,1,0,0|2,0,0]=4 5823 B7R1.4 CN1CCN=C1S Amb8387135 [0,1,0,1,0,0|1,1,0]=4 5824 B7R1.4 CN1CCNC1=O Amb5718647 [0,1,0,1,0,0|1,0,0]=3 5825 B7R1.4 CN1CCNC1=S Amb2720707 [0,1,0,1,0,0|1,1,0]=4 5826 B7R1.4 CN1CCOC1=O Amb22347786 [0,1,0,1,0,0|1,0,0]=3 5827 B7R1.4 CN1CCSC1=N Amb3318644 [0,1,0,1,0,0|2,0,0]=4 5828 B7R1.4 CN1CCSC1=N Amb4286381 [0,1,0,1,0,0|2,0,0]=4 5829 B7R1.4 CN1CCSC1=S Amb17845152 [0,1,0,1,0,0|1,1,0]=4 5830 B7R1.4 CN1CNCC1=O Amb26582942 [0,1,0,1,0,0|1,0,0]=3 5831 B7R1.4 CN1CNCC1=O Amb28827643 [0,1,0,1,0,0|1,0,0]=3 5832 B7R1.4 CN1N=CCC1=O Amb22233815 [0,1,0,1,0,0|1,0,1]=4 5833 B7R1.4 CN1NCCC1=O Amb18559311 [0,1,0,1,0,0|1,0,0]=3 5834 B7R1.4 CN1SC=CC1=O Amb19133167 [0,1,0,1,0,0|0,0,2]=4 5835 B7R1.4 CN1SC=CC1=O Amb20239425 [0,1,0,1,0,0|0,0,2]=4 5836 B7R1.4 CN1SC=CC1=O Amb31289633 [0,1,0,1,0,0|0,0,2]=4 5837 B7R1.4 C[C@@H]1C=CC[C@H]1C Amb25957944 [0,1,0,1,0,0|2,0,0]=4 5838 B7R1.4 C[C@@H]1C=CC[C@H]1O Amb27486253 [0,1,0,1,0,0|2,0,0]=4 5839 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,1,0,1,0,0|1,0,0]=3 5840 B7R1.4 C[C@@H]1CSC[C@@H]1O Amb27422447 [0,1,0,1,0,0|0,0,2]=4 5841 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,1,0,1,0,0|1,0,0]=3 5842 B7R1.4 C[C@@H]1SCC[C@@H]1O Amb28144028 [0,1,0,1,0,0|0,0,2]=4 5843 B7R1.4 C[C@@H]1SCC[C@H]1O Amb27853254 [0,1,0,1,0,0|0,0,2]=4 5844 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [0,1,0,1,0,0|1,0,0]=3 5845 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,1,0,1,0,0|1,0,0]=3 5846 B7R1.4 C[C@H]1CSC[C@H]1N Amb27961505 [0,1,0,1,0,0|1,0,1]=4 5847 B7R1.4 C[C@H]1CSC[C@H]1O Amb27448475 [0,1,0,1,0,0|0,0,2]=4 5848 B7R1.4 C[C@H]1SCC[C@@H]1O Amb27441450 [0,1,0,1,0,0|0,0,2]=4 5849 B7R1.4 ClC1CCSC1Cl Amb28325647 [0,1,0,1,0,0|1,0,1]=4 5850 B7R1.4 Cl[C@@H]1CSC[C@H]1Cl Amb25061457 [0,1,0,1,0,0|1,0,1]=4 5851 B7R1.4 NC1CCCC1=O Amb17939050 [0,1,0,1,0,0|1,0,0]=3 5852 B7R1.4 NC1CCCC1=O Amb28994832 [0,1,0,1,0,0|1,0,0]=3 5853 B7R1.4 NC1CCNC1=O Amb21955321 [0,1,0,1,0,0|2,0,0]=4 5854 B7R1.4 NC1CCNC1=O Amb6739903 [0,1,0,1,0,0|2,0,0]=4 5855 B7R1.4 NC1CCOC1=O Amb17614991 [0,1,0,1,0,0|2,0,0]=4 5856 B7R1.4 NC1CCOC1=O Amb6609049 [0,1,0,1,0,0|2,0,0]=4 5857 B7R1.4 NC1CCOC1=O Amb9761351 [0,1,0,1,0,0|2,0,0]=4 5858 B7R1.4 NC1CCSC1=O Amb1151877 [0,1,0,1,0,0|2,0,0]=4 5859 B7R1.4 NC1CCSC1=O Amb2720274 [0,1,0,1,0,0|2,0,0]=4 5860 B7R1.4 NC1COCC1=O Amb18202885 [0,1,0,1,0,0|0,1,0]=3 5861 B7R1.4 NC1COCC1=O Amb33328736 [0,1,0,1,0,0|0,1,0]=3 5862 B7R1.4 NC1CONC1=O Amb1865548 [0,1,0,1,0,0|1,1,0]=4 5863 B7R1.4 NC1CSCC1=O Amb18202693 [0,1,0,1,0,0|0,0,0]=2 5864 B7R1.4 NC1CSCC1F Amb28280927 [0,1,0,1,0,0|1,0,1]=4 5865 B7R1.4 NC1CSCC1O Amb2693597 [0,1,0,1,0,0|0,0,2]=4 5866 B7R1.4 NC1CSCC1O Amb5634210 [0,1,0,1,0,0|0,0,2]=4 5867 B7R1.4 NC1CSCC1O Amb8565080 [0,1,0,1,0,0|0,0,2]=4 5868 B7R1.4 NC1CSNC1=O Amb27435893 [0,1,0,1,0,0|1,0,0]=3 5869 B7R1.4 NN1CCCC1=O Amb8496496 [0,1,0,1,0,0|2,0,0]=4 5870 B7R1.4 NN1CCCC1=O Amb9174227 [0,1,0,1,0,0|2,0,0]=4 5871 B7R1.4 NN1CCNC1=O Amb5722000 [0,1,0,1,0,0|2,0,0]=4 5872 B7R1.4 NN1CCOC1=O Amb10068971 [0,1,0,1,0,0|2,0,0]=4 5873 B7R1.4 NN1CCOC1=O Amb33532698 [0,1,0,1,0,0|2,0,0]=4 5874 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,1,0,1,0,0|2,0,0]=4 5875 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,1,0,1,0,0|2,0,0]=4 5876 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [0,1,0,1,0,0|2,0,0]=4 5877 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,1,0,1,0,0|2,0,0]=4 5878 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [0,1,0,1,0,0|2,0,0]=4 5879 B7R1.4 N[C@@H]1CONC1=O Amb533888 [0,1,0,1,0,0|1,1,0]=4 5880 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [0,1,0,1,0,0|0,0,2]=4 5881 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb532933 [0,1,0,1,0,0|0,0,2]=4 5882 B7R1.4 N[C@@H]1CSC[C@H]1O Amb1099355 [0,1,0,1,0,0|0,0,2]=4 5883 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,1,0,1,0,0|2,0,0]=4 5884 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,1,0,1,0,0|2,0,0]=4 5885 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [0,1,0,1,0,0|2,0,0]=4 5886 B7R1.4 N[C@H]1CCOC1=O Amb541960 [0,1,0,1,0,0|2,0,0]=4 5887 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [0,1,0,1,0,0|2,0,0]=4 5888 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,1,0,1,0,0|2,0,0]=4 5889 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [0,1,0,1,0,0|2,0,0]=4 5890 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [0,1,0,1,0,0|2,0,0]=4 5891 B7R1.4 N[C@H]1CNOC1=O Amb27778477 [0,1,0,1,0,0|2,0,0]=4 5892 B7R1.4 N[C@H]1CONC1=O Amb2719694 [0,1,0,1,0,0|1,1,0]=4 5893 B7R1.4 O=C1C=CCC1Cl Amb27482393 [0,1,0,1,0,0|1,0,1]=4 5894 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,1,0,1,0,0|1,0,1]=4 5895 B7R1.4 O=C1CCC=C1I Amb26585706 [0,1,0,1,0,0|1,0,1]=4 5896 B7R1.4 O=C1CCC=C1O Amb17593067 [0,1,0,1,0,0|1,0,1]=4 5897 B7R1.4 O=C1CCCC1=O Amb24053064 [0,1,0,1,0,0|1,0,1]=4 5898 B7R1.4 O=C1CCCC1Br Amb16234114 [0,1,0,1,0,0|1,0,0]=3 5899 B7R1.4 O=C1CCCC1Cl Amb3939970 [0,1,0,1,0,0|1,0,0]=3 5900 B7R1.4 O=C1CCCC1F Amb28050533 [0,1,0,1,0,0|1,0,0]=3 5901 B7R1.4 O=C1CCCC1I Amb25756212 [0,1,0,1,0,0|1,0,0]=3 5902 B7R1.4 O=C1CCCC1O Amb17593081 [0,1,0,1,0,0|1,0,0]=3 5903 B7R1.4 O=C1CCCC1S Amb27838260 [0,1,0,1,0,0|1,0,0]=3 5904 B7R1.4 O=C1CCCN1O Amb33484242 [0,1,0,1,0,0|2,0,0]=4 5905 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [0,1,0,1,0,0|1,0,0]=3 5906 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,1,0,1,0,0|1,0,0]=3 5907 B7R1.4 O=C1CCNC1=O Amb21858086 [0,1,0,1,0,0|1,0,1]=4 5908 B7R1.4 O=C1CCOC1=O Amb27849805 [0,1,0,1,0,0|0,1,1]=4 5909 B7R1.4 O=C1NCCC1Br Amb20623055 [0,1,0,1,0,0|2,0,0]=4 5910 B7R1.4 O=C1NCCC1Cl Amb28050511 [0,1,0,1,0,0|2,0,0]=4 5911 B7R1.4 O=C1NCCC1F Amb25838145 [0,1,0,1,0,0|2,0,0]=4 5912 B7R1.4 O=C1NCCC1O Amb10603089 [0,1,0,1,0,0|2,0,0]=4 5913 B7R1.4 O=C1NCCC1S Amb18202686 [0,1,0,1,0,0|2,0,0]=4 5914 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,1,0,1,0,0|2,0,0]=4 5915 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [0,1,0,1,0,0|2,0,0]=4 5916 B7R1.4 O=C1OCCC1Br Amb3940058 [0,1,0,1,0,0|2,0,0]=4 5917 B7R1.4 O=C1OCCC1F Amb27642041 [0,1,0,1,0,0|2,0,0]=4 5918 B7R1.4 O=C1OCCC1I Amb24418518 [0,1,0,1,0,0|2,0,0]=4 5919 B7R1.4 O=C1OCCC1O Amb5718058 [0,1,0,1,0,0|2,0,0]=4 5920 B7R1.4 O=C1OCCC1S Amb25146639 [0,1,0,1,0,0|2,0,0]=4 5921 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [0,1,0,1,0,0|2,0,0]=4 5922 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [0,1,0,1,0,0|2,0,0]=4 5923 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [0,1,0,1,0,0|2,0,0]=4 5924 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [0,1,0,1,0,0|2,0,0]=4 5925 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [0,1,0,1,0,0|2,0,0]=4 5926 B7R1.4 O=C1OCNC1Br Amb25299209 [0,1,0,1,0,0|2,0,0]=4 5927 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [0,1,0,1,0,0|2,0,0]=4 5928 B7R1.4 O=S1CCCC1Br Amb28046103 [0,1,0,1,0,0|2,0,0]=4 5929 B7R1.4 O=S1CCCC1Cl Amb27796334 [0,1,0,1,0,0|2,0,0]=4 5930 B7R1.4 OC1CSCC1O Amb17593233 [0,1,0,1,0,0|0,0,2]=4 5931 B7R1.4 O[C@@H]1CSC[C@@H]1O Amb28455182 [0,1,0,1,0,0|0,0,2]=4 5932 B7R1.4 O[C@@H]1CSC[C@@H]1S Amb27422639 [0,1,0,1,0,0|0,0,2]=4 5933 B7R1.4 O[C@@H]1CSC[C@H]1S Amb27981741 [0,1,0,1,0,0|0,0,2]=4 5934 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,1,0,1,0,0|2,0,0]=4 5935 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,1,0,1,0,0|2,0,0]=4 5936 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O Amb4269724 [0,1,0,1,0,0|0,0,2]=4 5937 B7R1.5 C=C1CC1CCI Amb27838218 [0,1,0,1,0,0|2,0,0]=4 5938 B7R1.5 C=C1CC1CCN Amb27850014 [0,1,0,1,0,0|2,0,0]=4 5939 B7R1.5 C=CCC1CC1O Amb26478050 [0,1,0,1,0,0|2,0,0]=4 5940 B7R1.5 C=CC[C@@H]1C[C@@H]1Cl Amb27983599 [0,1,0,1,0,0|2,0,0]=4 5941 B7R1.5 C=CC[C@@H]1C[C@@H]1O Amb28053769 [0,1,0,1,0,0|2,0,0]=4 5942 B7R1.5 CC1CC1CC=O Amb25737156 [0,1,0,1,0,0|1,0,0]=3 5943 B7R1.5 CC1CC1N=C=O Amb9730071 [0,1,0,1,0,0|1,0,1]=4 5944 B7R1.5 CC1CC1NC=O Amb28200843 [0,1,0,1,0,0|1,0,0]=3 5945 B7R1.5 CSCC1CC1N Amb33272055 [0,1,0,1,0,0|1,0,1]=4 5946 B7R1.5 CSC[C@@H]1C[C@H]1N Amb33272056 [0,1,0,1,0,0|1,0,1]=4 5947 B7R1.6 Br\C=C\C1CCC1 Amb33135163 [0,1,0,1,0,0|2,0,0]=4 5948 B7R1.6 C=CCC1CCC1 Amb27198597 [0,1,0,1,0,0|2,0,0]=4 5949 B7R1.6 C=CCC1CCN1 Amb25888401 [0,1,0,1,0,0|2,0,0]=4 5950 B7R1.6 C=CCC1CCN1 Amb32992120 [0,1,0,1,0,0|2,0,0]=4 5951 B7R1.6 C=CCC1CNC1 Amb23439504 [0,1,0,1,0,0|2,0,0]=4 5952 B7R1.6 C=CCN1CCC1 Amb26956297 [0,1,0,1,0,0|2,0,0]=4 5953 B7R1.6 CCCC1CCS1 Amb26614197 [0,1,0,1,0,0|1,0,1]=4 5954 B7R1.6 CCNC1CSC1 Amb27457315 [0,1,0,1,0,0|1,0,1]=4 5955 B7R1.6 CCSC1CNC1 Amb22395437 [0,1,0,1,0,0|2,0,0]=4 5956 B7R1.6 CCSC1CNC1 Amb26073964 [0,1,0,1,0,0|2,0,0]=4 5957 B7R1.6 CONC1CSC1 Amb27493266 [0,1,0,1,0,0|1,0,1]=4 5958 B7R1.6 CSCC1CCN1 Amb33272485 [0,1,0,1,0,0|1,0,1]=4 5959 B7R1.6 CSCC1CNC1 Amb25313820 [0,1,0,1,0,0|1,0,1]=4 5960 B7R1.6 CSCC1CNC1 Amb33804316 [0,1,0,1,0,0|1,0,1]=4 5961 B7R1.6 N#CC=C1CSC1 Amb22386888 [0,1,0,1,0,0|1,0,1]=4 5962 B7R1.6 N#CCC1CSC1 Amb27433581 [0,1,0,1,0,0|1,0,1]=4 5963 B7R1.6 NCCC1CSC1 Amb27971340 [0,1,0,1,0,0|1,0,1]=4 5964 B7R1.6 N\N=C\C1CCC1 Amb28313385 [0,1,0,1,0,0|2,0,0]=4 5965 B7R1.6 O=C=NC1CCC1 Amb6267587 [0,1,0,1,0,0|1,0,1]=4 5966 B7R1.6 O=CC=C1CCC1 Amb27827363 [0,1,0,1,0,0|1,0,1]=4 5967 B7R1.6 O=CCC1CCC1 Amb22002603 [0,1,0,1,0,0|1,0,0]=3 5968 B7R1.6 O=CCC1CCO1 Amb26626501 [0,1,0,1,0,0|0,1,0]=3 5969 B7R1.6 O=CCC1COC1 Amb23440119 [0,1,0,1,0,0|0,1,0]=3 5970 B7R1.6 O=CCN1CCC1 Amb25831216 [0,1,0,1,0,0|1,0,0]=3 5971 B7R1.6 O=CNC1CNC1 Amb27798890 [0,1,0,1,0,0|1,0,0]=3 5972 B7R1.6 O=CNC1COC1 Amb28192194 [0,1,0,1,0,0|0,1,0]=3 5973 B7R1.6 OCCC1CSC1 Amb24574115 [0,1,0,1,0,0|0,0,2]=4 5974 B7R1.8 C=CC1CCC1O Amb25848177 [0,1,0,1,0,0|2,0,0]=4 5975 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [0,1,0,1,0,0|2,0,0]=4 5976 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [0,1,0,1,0,0|2,0,0]=4 5977 B7R1.8 CCC1CCC1=O Amb28137082 [0,1,0,1,0,0|1,0,0]=3 5978 B7R1.8 CCC1OCC1=O Amb23456089 [0,1,0,1,0,0|1,0,0]=3 5979 B7R1.8 CN1CCC1C=O Amb27789055 [0,1,0,1,0,0|1,0,0]=3 5980 B7R1.8 COC1C=CC1Cl Amb27755072 [0,1,0,1,0,0|1,1,0]=4 5981 B7R1.8 COC1CCC1=O Amb22896543 [0,1,0,1,0,0|0,1,0]=3 5982 B7R1.8 CSC1CCC1=O Amb26054103 [0,1,0,1,0,0|0,0,0]=2 5983 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [0,1,0,1,0,0|1,0,0]=3 5984 B7R1.8 C\C=C1\CCC1=O Amb24512730 [0,1,0,1,0,0|1,0,0]=3 5985 B7R1.8 NCC1CNC1=O Amb25888547 [0,1,0,1,0,0|2,0,0]=4 5986 B7R1.8 O=C1CCC1CBr Amb24633095 [0,1,0,1,0,0|1,0,0]=3 5987 B7R1.8 O=C1CCC1CCl Amb28197139 [0,1,0,1,0,0|1,0,0]=3 5988 B7R1.8 O=C1CCC1CO Amb24722181 [0,1,0,1,0,0|1,0,0]=3 5989 B7R1.8 O=C1CCN1CBr Amb28137960 [0,1,0,1,0,0|1,0,0]=3 5990 B7R1.8 O=C1CCN1CO Amb28207292 [0,1,0,1,0,0|1,0,0]=3 5991 B7R1.8 O=C1NCC1CO Amb28196532 [0,1,0,1,0,0|2,0,0]=4 5992 B7R1.8 O=CC1=C(Cl)CC1 Amb28050115 [0,1,0,1,0,0|2,0,0]=4 5993 B7R1.8 O=CC1CCC1F Amb32943810 [0,1,0,1,0,0|1,0,0]=3 5994 B7R1.9 C#C[C@@H]1C[C@H]1C=O Amb28131414 [0,1,0,1,0,0|1,0,1]=4 5995 B7R1.9 C=C[C@@H]1C[C@H]1CO Amb27481145 [0,1,0,1,0,0|2,0,0]=4 5996 B7R1.9 C=C[C@H]1C[C@H]1CBr Amb27424762 [0,1,0,1,0,0|2,0,0]=4 5997 B7R1.9 CC[C@@H]1C[C@@H]1C=O Amb28142393 [0,1,0,1,0,0|1,0,0]=3 5998 B7R1.9 CC[C@@H]1O[C@@H]1C=O Amb27640580 [0,1,0,1,0,0|1,0,0]=3 5999 B7R1.9 COC1CC1C=O Amb35720824 [0,1,0,1,0,0|0,1,0]=3 6000 B7R1.9 N#CC1CC1C=O Amb24378434 [0,1,0,1,0,0|1,0,1]=4 6001 B7R1.9 O=CC1CC1C=O Amb27166180 [0,1,0,1,0,0|1,0,1]=4 6002 B7R1.9 O=C[C@H]1C[C@@H]1C=O Amb28057483 [0,1,0,1,0,0|1,0,1]=4 6003 B7R1.10 C#CC1CC(=O)C1 Amb27874486 [0,1,0,1,0,0|1,0,1]=4 6004 B7R1.10 C=C1CC(C=O)C1 Amb22896623 [0,1,0,1,0,0|1,0,0]=3 6005 B7R1.10 C=C1CC(NC)C1 Amb16230428 [0,1,0,1,0,0|2,0,0]=4 6006 B7R1.10 C=C1CC(NC)C1 Amb33734454 [0,1,0,1,0,0|2,0,0]=4 6007 B7R1.10 C=C1CN(C=O)C1 Amb30028121 [0,1,0,1,0,0|2,0,0]=4 6008 B7R1.10 C=CC1CC(=O)C1 Amb26409138 [0,1,0,1,0,0|1,0,1]=4 6009 B7R1.10 C=CC1CC(=O)N1 Amb26507633 [0,1,0,1,0,0|1,0,1]=4 6010 B7R1.10 C=C[C@@H]1CC(=O)N1 Amb27589344 [0,1,0,1,0,0|1,0,1]=4 6011 B7R1.10 C=C[C@H]1C[C@@H](O)C1 Amb27981576 [0,1,0,1,0,0|2,0,0]=4 6012 B7R1.10 CC1CC(C=O)C1 Amb27827798 [0,1,0,1,0,0|1,0,0]=3 6013 B7R1.10 CC1CN(C=O)C1 Amb35587584 [0,1,0,1,0,0|2,0,0]=4 6014 B7R1.10 CCC1CC(=O)C1 Amb24406738 [0,1,0,1,0,0|1,0,0]=3 6015 B7R1.10 CNC1CS(=O)C1 Amb32794923 [0,1,0,1,0,0|2,0,0]=4 6016 B7R1.10 COC1=CC(=O)C1 Amb25092069 [0,1,0,1,0,0|0,1,1]=4 6017 B7R1.10 COC1CC(=O)C1 Amb22754340 [0,1,0,1,0,0|0,1,0]=3 6018 B7R1.10 COC1CC(=O)N1 Amb27802279 [0,1,0,1,0,0|0,1,0]=3 6019 B7R1.10 CSC1CC(=O)C1 Amb32655823 [0,1,0,1,0,0|0,0,0]=2 6020 B7R1.10 CSC1CC(=O)N1 Amb25265230 [0,1,0,1,0,0|0,0,0]=2 6021 B7R1.10 CSC1CC(N)C1 Amb32656155 [0,1,0,1,0,0|1,0,1]=4 6022 B7R1.10 CSC1CC(N)C1 Amb32661994 [0,1,0,1,0,0|1,0,1]=4 6023 B7R1.10 CSC1CC(O)C1 Amb24581791 [0,1,0,1,0,0|0,0,2]=4 6024 B7R1.10 CSC1CC(S)C1 Amb32788119 [0,1,0,1,0,0|0,1,1]=4 6025 B7R1.10 CS[C@@H]1CC(=O)N1 Amb27981333 [0,1,0,1,0,0|0,0,0]=2 6026 B7R1.10 CS[C@H]1C[C@@H](O)C1 Amb32660479 [0,1,0,1,0,0|0,0,2]=4 6027 B7R1.10 CS[C@H]1C[C@H](N)C1 Amb32664040 [0,1,0,1,0,0|1,0,1]=4 6028 B7R1.10 CS[C@H]1C[C@H](N)C1 Amb32664041 [0,1,0,1,0,0|1,0,1]=4 6029 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [0,1,0,1,0,0|2,0,0]=4 6030 B7R1.10 NCC1CC(=O)C1 Amb18251063 [0,1,0,1,0,0|2,0,0]=4 6031 B7R1.10 NCC1CC(=O)C1 Amb22406094 [0,1,0,1,0,0|2,0,0]=4 6032 B7R1.10 NCC1CC(=O)N1 Amb25230632 [0,1,0,1,0,0|2,0,0]=4 6033 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [0,1,0,1,0,0|2,0,0]=4 6034 B7R1.10 O=C1CC(CBr)O1 Amb26981027 [0,1,0,1,0,0|2,0,0]=4 6035 B7R1.10 O=C1CC(CCl)C1 Amb10610581 [0,1,0,1,0,0|2,0,0]=4 6036 B7R1.10 O=C1CC(CCl)O1 Amb28322279 [0,1,0,1,0,0|2,0,0]=4 6037 B7R1.10 O=C1CC(CF)C1 Amb26416198 [0,1,0,1,0,0|2,0,0]=4 6038 B7R1.10 O=C1CC(CI)N1 Amb27838210 [0,1,0,1,0,0|2,0,0]=4 6039 B7R1.10 O=C1CC(CO)C1 Amb16231082 [0,1,0,1,0,0|2,0,0]=4 6040 B7R1.10 O=C1CC(CO)N1 Amb22388379 [0,1,0,1,0,0|2,0,0]=4 6041 B7R1.10 O=C1C[C@H](CO)N1 Amb26887642 [0,1,0,1,0,0|2,0,0]=4 6042 B7R1.10 O=CC1CC(F)C1 Amb28198994 [0,1,0,1,0,0|1,0,0]=3 6043 B7R1.10 O=CC1CC(O)C1 Amb33512133 [0,1,0,1,0,0|1,0,0]=3 6044 B7R1.11 C=C[C@@H]1[C@@H](C)[C@H]1Br Amb27478033 [0,1,0,1,0,0|2,0,0]=4 6045 B7R1.11 CC1C(Cl)C1C=O Amb26552434 [0,1,0,1,0,0|1,0,0]=3 6046 B7R1.11 C[C@@H]1C(C=O)[C@@H]1C Amb27215367 [0,1,0,1,0,0|1,0,0]=3 6047 B7R1.15 CC1=C(C)C(=O)C1 Amb27226738 [0,1,0,1,0,0|1,0,1]=4 6048 B7R1.15 CC1=C(N)CC1=O Amb27975652 [0,1,0,1,0,0|1,0,1]=4 6049 B7R1.15 CC1=C(O)CC1=O Amb27838185 [0,1,0,1,0,0|1,0,1]=4 6050 B7R1.15 CC1C(=O)CC1=O Amb24364046 [0,1,0,1,0,0|1,0,1]=4 6051 B7R1.15 CC1C(=O)CC1O Amb28423178 [0,1,0,1,0,0|1,0,0]=3 6052 B7R1.15 CC1CC(=O)C1C Amb33551302 [0,1,0,1,0,0|1,0,0]=3 6053 B7R1.15 CC1CN(N)C1=O Amb24479155 [0,1,0,1,0,0|2,0,0]=4 6054 B7R1.15 CC1NC(=O)C1C Amb22364651 [0,1,0,1,0,0|2,0,0]=4 6055 B7R1.15 CN1CC(N)C1=O Amb25314708 [0,1,0,1,0,0|1,0,0]=3 6056 B7R1.15 CN1C[C@@H](N)C1=O Amb34137166 [0,1,0,1,0,0|1,0,0]=3 6057 B7R1.15 CN1C[C@H](N)C1=O Amb24746774 [0,1,0,1,0,0|1,0,0]=3 6058 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [0,1,0,1,0,0|1,0,0]=3 6059 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [0,1,0,1,0,0|1,0,0]=3 6060 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [0,1,0,1,0,0|1,0,0]=3 6061 B7R1.21 C=CCC1(N)CC1 Amb24589425 [0,1,0,1,0,0|2,0,0]=4 6062 B7R1.21 C=CCC1(N)CC1 Amb32410229 [0,1,0,1,0,0|2,0,0]=4 6063 B7R1.21 CC1(CC=O)CC1 Amb27267081 [0,1,0,1,0,0|1,0,0]=3 6064 B7R1.21 CC1(CC=O)N=N1 Amb28401427 [0,1,0,1,0,0|2,0,0]=4 6065 B7R1.21 CC1(NC=O)CC1 Amb27837382 [0,1,0,1,0,0|2,0,0]=4 6066 B7R1.21 CSCC1(C)CO1 Amb25726618 [0,1,0,1,0,0|0,0,2]=4 6067 B7R1.21 CSCC1(N)CC1 Amb18286979 [0,1,0,1,0,0|1,0,1]=4 6068 B7R1.21 CSCC1(O)CC1 Amb33359302 [0,1,0,1,0,0|1,0,1]=4 6069 B7R1.22 C=C(C=O)C1CC1 Amb28050249 [0,1,0,1,0,0|1,0,1]=4 6070 B7R1.22 C=CC(N)C1CC1 Amb25296753 [0,1,0,1,0,0|2,0,0]=4 6071 B7R1.22 C=CC(N)C1CC1 Amb33527190 [0,1,0,1,0,0|2,0,0]=4 6072 B7R1.22 C=CC(O)C1CC1 Amb26635453 [0,1,0,1,0,0|2,0,0]=4 6073 B7R1.22 C=CC(O)C1CO1 Amb25806064 [0,1,0,1,0,0|1,1,0]=4 6074 B7R1.22 C=C[C@@H](O)[C@@H]1CO1 Amb27216477 [0,1,0,1,0,0|1,1,0]=4 6075 B7R1.22 C=C[C@@H](O)[C@H]1CO1 Amb27422599 [0,1,0,1,0,0|1,1,0]=4 6076 B7R1.22 C=C[C@H](N)C1CC1 Amb27175395 [0,1,0,1,0,0|2,0,0]=4 6077 B7R1.22 C=C[C@H](O)[C@H]1CO1 Amb26432088 [0,1,0,1,0,0|1,1,0]=4 6078 B7R1.22 CC(C=O)C1CC1 Amb25376838 [0,1,0,1,0,0|1,0,0]=3 6079 B7R1.22 CN(C=O)C1CC1 Amb24117128 [0,1,0,1,0,0|2,0,0]=4 6080 B7R1.22 O=CC(=O)C1CC1 Amb22900251 [0,1,0,1,0,0|1,0,1]=4 6081 B7R1.22 O=CC(F)C1CC1 Amb27777027 [0,1,0,1,0,0|1,0,0]=3 6082 B7R1.22 O=CC(O)C1CC1 Amb27593028 [0,1,0,1,0,0|1,0,0]=3 6083 B7R1.22 OC(CS)C1CS1 Amb28461439 [0,1,0,1,0,0|0,1,1]=4 6084 B7R1.22 O[C@@H](CS)[C@@H]1CS1 Amb28435746 [0,1,0,1,0,0|0,1,1]=4 6085 B7R1.25 C#CC1(O)CSC1 Amb26458969 [0,1,0,1,0,0|1,0,1]=4 6086 B7R1.25 C=CC1(C)COC1 Amb33374030 [0,1,0,1,0,0|1,1,0]=4 6087 B7R1.25 C=CC1(O)CCC1 Amb26654916 [0,1,0,1,0,0|2,0,0]=4 6088 B7R1.25 C=CC1(O)CNC1 Amb28120723 [0,1,0,1,0,0|2,0,0]=4 6089 B7R1.25 C=CC1(O)COC1 Amb22896688 [0,1,0,1,0,0|1,1,0]=4 6090 B7R1.25 CC1(C=O)CCC1 Amb20667762 [0,1,0,1,0,0|1,0,0]=3 6091 B7R1.25 CC1(C=O)COC1 Amb17933843 [0,1,0,1,0,0|0,1,0]=3 6092 B7R1.25 CC1(C=O)CSC1 Amb33330520 [0,1,0,1,0,0|0,0,0]=2 6093 B7R1.25 CC1(CBr)CSC1 Amb33329487 [0,1,0,1,0,0|1,0,1]=4 6094 B7R1.25 CC1(CN)CSC1 Amb21960855 [0,1,0,1,0,0|1,0,1]=4 6095 B7R1.25 CC1(CN)CSC1 Amb33329059 [0,1,0,1,0,0|1,0,1]=4 6096 B7R1.25 CC1(CO)CSC1 Amb21960455 [0,1,0,1,0,0|0,0,2]=4 6097 B7R1.25 CCC1(O)CSC1 Amb27810981 [0,1,0,1,0,0|1,0,1]=4 6098 B7R1.25 N#CC1(Cl)CSC1 Amb27639499 [0,1,0,1,0,0|1,0,1]=4 6099 B7R1.25 N#CC1(N)CSC1 Amb27963814 [0,1,0,1,0,0|1,0,1]=4 6100 B7R1.25 NC1(CO)CSC1 Amb27439891 [0,1,0,1,0,0|0,0,2]=4 6101 B7R1.25 NCC1(N)CSC1 Amb27202474 [0,1,0,1,0,0|1,0,1]=4 6102 B7R1.25 NCC1(O)CSC1 Amb27265040 [0,1,0,1,0,0|1,0,1]=4 6103 B7R1.27 C=C1CC1(C)C=O Amb27838213 [0,1,0,1,0,0|1,0,1]=4 6104 B7R1.27 C=CC1(N)CC1C Amb27965807 [0,1,0,1,0,0|2,0,0]=4 6105 B7R1.27 CC1(C=O)CC1F Amb27431004 [0,1,0,1,0,0|2,0,0]=4 6106 B7R1.27 CC1CC1(C)C=O Amb25076193 [0,1,0,1,0,0|1,0,0]=3 6107 B7R1.27 CC1OC1(C)C=O Amb28071199 [0,1,0,1,0,0|2,0,0]=4 6108 B7R1.27 C[C@@H]1C[C@]1(C)C=O Amb27493432 [0,1,0,1,0,0|1,0,0]=3 6109 B7R1.7 C=CCCC1CO1 Amb3940512 [0,1,0,1,0,0|1,1,0]=4 6110 B7R1.7 C=CCC[C@@H]1CO1 Amb28050706 [0,1,0,1,0,0|1,1,0]=4 6111 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [0,1,0,1,0,0|1,1,0]=4 6112 B7R1.7 C=CCNC1CC1 Amb17309103 [0,1,0,1,0,0|2,0,0]=4 6113 B7R1.7 C=CCNC1CC1 Amb28555343 [0,1,0,1,0,0|2,0,0]=4 6114 B7R1.7 CCSCC1CC1 Amb27206075 [0,1,0,1,0,0|1,0,1]=4 6115 B7R1.7 CCSCC1CO1 Amb6680858 [0,1,0,1,0,0|0,0,2]=4 6116 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [0,1,0,1,0,0|0,0,2]=4 6117 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [0,1,0,1,0,0|0,0,2]=4 6118 B7R1.7 CSCCC1CC1 Amb28079007 [0,1,0,1,0,0|1,0,1]=4 6119 B7R1.7 CSCCC1CO1 Amb25241000 [0,1,0,1,0,0|0,0,2]=4 6120 B7R1.7 CSCC[C@@H]1CO1 Amb33203333 [0,1,0,1,0,0|0,0,2]=4 6121 B7R1.7 CSCC[C@H]1CO1 Amb33203334 [0,1,0,1,0,0|0,0,2]=4 6122 B7R1.7 C\C=C\CC1CO1 Amb25285825 [0,1,0,1,0,0|1,1,0]=4 6123 B7R1.7 O=C=NCC1CC1 Amb18955466 [0,1,0,1,0,0|1,0,1]=4 6124 B7R1.7 O=CCC=C1CC1 Amb27799822 [0,1,0,1,0,0|1,0,1]=4 6125 B7R1.7 O=CCCC1CC1 Amb21864768 [0,1,0,1,0,0|1,0,0]=3 6126 B7R1.7 O=CNCC1CC1 Amb28322746 [0,1,0,1,0,0|1,0,0]=3 6127 B7R1.7 O=COCC1CO1 Amb24632689 [0,1,0,1,0,0|0,1,0]=3 6128 B7R1.7 O=C\C=C\C1CC1 Amb32664515 [0,1,0,1,0,0|1,0,1]=4 6129 B7R1.7 O\N=C\CC1CC1 Amb24627412 [0,1,0,1,0,0|1,0,1]=4 6130 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,1,0,1,0,0|1,0,1]=4 6131 B7R1.12 C=C1CC1C(N)=O Amb28191145 [0,1,0,1,0,0|1,0,1]=4 6132 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,1,0,1,0,0|1,0,0]=3 6133 B7R1.12 CC(=O)C1N=C1C Amb28050540 [0,1,0,1,0,0|2,0,0]=4 6134 B7R1.12 CC(=O)C1OC1C Amb25920285 [0,1,0,1,0,0|2,0,0]=4 6135 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,1,0,1,0,0|1,0,0]=3 6136 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [0,1,0,1,0,0|2,0,0]=4 6137 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,1,0,1,0,0|1,0,0]=3 6138 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [0,1,0,1,0,0|2,0,0]=4 6139 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [0,1,0,1,0,0|2,0,0]=4 6140 B7R1.12 CC1=CC1C(=O)O Amb27157805 [0,1,0,1,0,0|1,0,1]=4 6141 B7R1.12 CC1CC1C(=N)N Amb25139920 [0,1,0,1,0,0|2,0,0]=4 6142 B7R1.12 CC1CC1C(=N)N Amb32667599 [0,1,0,1,0,0|2,0,0]=4 6143 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,1,0,1,0,0|1,0,0]=3 6144 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,1,0,1,0,0|1,0,0]=3 6145 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,1,0,1,0,0|1,0,0]=3 6146 B7R1.12 CC1CC1C(N)=S Amb25302556 [0,1,0,1,0,0|1,1,0]=4 6147 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,1,0,1,0,0|2,0,0]=4 6148 B7R1.12 CC1SC1C(=O)O Amb27195238 [0,1,0,1,0,0|2,0,0]=4 6149 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [0,1,0,1,0,0|2,0,0]=4 6150 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,1,0,1,0,0|1,0,0]=3 6151 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb27252052 [0,1,0,1,0,0|2,0,0]=4 6152 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb33483860 [0,1,0,1,0,0|2,0,0]=4 6153 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,1,0,1,0,0|1,0,0]=3 6154 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,1,0,1,0,0|1,0,0]=3 6155 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,1,0,1,0,0|1,0,0]=3 6156 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,1,0,1,0,0|2,0,0]=4 6157 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [0,1,0,1,0,0|2,0,0]=4 6158 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [0,1,0,1,0,0|2,0,0]=4 6159 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,1,0,1,0,0|1,0,0]=3 6160 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,1,0,1,0,0|1,0,0]=3 6161 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,1,0,1,0,0|1,0,0]=3 6162 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [0,1,0,1,0,0|2,0,0]=4 6163 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [0,1,0,1,0,0|2,0,0]=4 6164 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,1,0,1,0,0|2,0,0]=4 6165 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,1,0,1,0,0|2,0,0]=4 6166 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,1,0,1,0,0|2,0,0]=4 6167 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,1,0,1,0,0|2,0,0]=4 6168 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,1,0,1,0,0|2,0,0]=4 6169 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,1,0,1,0,0|2,0,0]=4 6170 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,1,0,1,0,0|2,0,0]=4 6171 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,1,0,1,0,0|2,0,0]=4 6172 B7R1.12 O=C(Cl)C1CC1=O Amb27838228 [0,1,0,1,0,0|2,0,0]=4 6173 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [0,1,0,1,0,0|2,0,0]=4 6174 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [0,1,0,1,0,0|2,0,0]=4 6175 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [0,1,0,1,0,0|2,0,0]=4 6176 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,1,0,1,0,0|2,0,0]=4 6177 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,1,0,1,0,0|2,0,0]=4 6178 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,1,0,1,0,0|2,0,0]=4 6179 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,1,0,1,0,0|2,0,0]=4 6180 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,1,0,1,0,0|2,0,0]=4 6181 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,1,0,1,0,0|2,0,0]=4 6182 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,1,0,1,0,0|2,0,0]=4 6183 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,1,0,1,0,0|2,0,0]=4 6184 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,1,0,1,0,0|2,0,0]=4 6185 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,1,0,1,0,0|2,0,0]=4 6186 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,1,0,1,0,0|2,0,0]=4 6187 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,1,0,1,0,0|2,0,0]=4 6188 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,1,0,1,0,0|2,0,0]=4 6189 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,1,0,1,0,0|2,0,0]=4 6190 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,1,0,1,0,0|2,0,0]=4 6191 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,1,0,1,0,0|2,0,0]=4 6192 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,1,0,1,0,0|2,0,0]=4 6193 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,1,0,1,0,0|2,0,0]=4 6194 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,1,0,1,0,0|2,0,0]=4 6195 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,1,0,1,0,0|2,0,0]=4 6196 B7R1.14 CC1(C)C=CCC1 Amb27471019 [0,1,0,1,0,0|2,0,0]=4 6197 B7R1.14 CC1(C)CCC=N1 Amb23589194 [0,1,0,1,0,0|2,0,0]=4 6198 B7R1.14 CC1(O)CCSC1 Amb28050063 [0,1,0,1,0,0|0,0,2]=4 6199 B7R1.14 CP1(=O)C=CCC1 Amb27833507 [0,1,0,1,0,0|2,0,0]=4 6200 B7R1.14 C[N+]1(C)CCC=N1 Amb27780346 [0,1,0,1,0,0|2,0,0]=4 6201 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,1,0,1,0,0|2,0,0]=4 6202 B7R1.14 NC1(F)CCSC1 Amb28318189 [0,1,0,1,0,0|1,0,1]=4 6203 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [0,1,0,1,0,0|2,0,0]=4 6204 B7R1.14 O=S1(=O)CCNC1 Amb27877957 [0,1,0,1,0,0|2,0,0]=4 6205 B7R1.17 C=C1CCC1(C)C Amb28254823 [0,1,0,1,0,0|2,0,0]=4 6206 B7R1.17 CC1(C)CCC1=O Amb28050382 [0,1,0,1,0,0|1,0,0]=3 6207 B7R1.17 CC1(C)CNC1=O Amb26954140 [0,1,0,1,0,0|2,0,0]=4 6208 B7R1.17 CC1(C)COC1=O Amb17619458 [0,1,0,1,0,0|2,0,0]=4 6209 B7R1.17 CC1(C)OCC1=O Amb27666218 [0,1,0,1,0,0|2,0,0]=4 6210 B7R1.17 CC1(N)COC1=O Amb24626106 [0,1,0,1,0,0|2,0,0]=4 6211 B7R1.17 CC1CCS1(=O)=O Amb22364950 [0,1,0,1,0,0|2,0,0]=4 6212 B7R1.17 C[C@H]1CCS1(=O)=O Amb27661382 [0,1,0,1,0,0|2,0,0]=4 6213 B7R1.17 C[C@]1(N)COC1=O Amb27232689 [0,1,0,1,0,0|2,0,0]=4 6214 B7R1.18 C=C(C)C1CCC1 Amb25662691 [0,1,0,1,0,0|2,0,0]=4 6215 B7R1.18 C=C(C)C1CNC1 Amb33226197 [0,1,0,1,0,0|2,0,0]=4 6216 B7R1.18 C=C(F)C1CCC1 Amb27403200 [0,1,0,1,0,0|2,0,0]=4 6217 B7R1.18 CC(=O)C1CCC1 Amb4037098 [0,1,0,1,0,0|1,0,0]=3 6218 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,1,0,1,0,0|2,0,0]=4 6219 B7R1.18 CC(=O)C1CNC1 Amb23400009 [0,1,0,1,0,0|1,0,0]=3 6220 B7R1.18 CC(=O)C1CNC1 Amb23401240 [0,1,0,1,0,0|1,0,0]=3 6221 B7R1.18 CC(=O)C1CNC1 Amb33473586 [0,1,0,1,0,0|1,0,0]=3 6222 B7R1.18 CC(=O)C1COC1 Amb27397483 [0,1,0,1,0,0|0,1,0]=3 6223 B7R1.18 CC(=O)C1CSC1 Amb29849423 [0,1,0,1,0,0|0,0,0]=2 6224 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,1,0,1,0,0|2,0,0]=4 6225 B7R1.18 CC(N)C1CSC1 Amb27847110 [0,1,0,1,0,0|1,0,1]=4 6226 B7R1.18 CC(N)C1CSC1 Amb33189137 [0,1,0,1,0,0|1,0,1]=4 6227 B7R1.18 CC(O)C1CSC1 Amb32674717 [0,1,0,1,0,0|0,0,2]=4 6228 B7R1.18 CC(S)C1CSC1 Amb32788692 [0,1,0,1,0,0|0,1,1]=4 6229 B7R1.18 CS(=O)C1CNC1 Amb34155891 [0,1,0,1,0,0|2,0,0]=4 6230 B7R1.18 C[C@@H](N)C1CSC1 Amb35717407 [0,1,0,1,0,0|1,0,1]=4 6231 B7R1.18 C[C@H](N)C1CSC1 Amb35717406 [0,1,0,1,0,0|1,0,1]=4 6232 B7R1.18 N=C(N)C1CCC1 Amb2695056 [0,1,0,1,0,0|2,0,0]=4 6233 B7R1.18 N=C(N)C1CCC1 Amb33528962 [0,1,0,1,0,0|2,0,0]=4 6234 B7R1.18 N=C(N)C1CSC1 Amb27230259 [0,1,0,1,0,0|1,0,0]=3 6235 B7R1.18 N=C(N)C1CSC1 Amb28465476 [0,1,0,1,0,0|1,0,0]=3 6236 B7R1.18 N=C(N)C1CSC1 Amb32680403 [0,1,0,1,0,0|1,0,0]=3 6237 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,1,0,1,0,0|1,0,0]=3 6238 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,1,0,1,0,0|2,0,0]=4 6239 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,1,0,1,0,0|2,0,0]=4 6240 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,1,0,1,0,0|1,0,0]=3 6241 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,1,0,1,0,0|1,0,0]=3 6242 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,1,0,1,0,0|1,0,0]=3 6243 B7R1.18 NC(=O)C1CSC1 Amb27209831 [0,1,0,1,0,0|0,0,0]=2 6244 B7R1.18 NC(=O)N1CCC1 Amb25326782 [0,1,0,1,0,0|2,0,0]=4 6245 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,1,0,1,0,0|2,0,0]=4 6246 B7R1.18 NC(=S)C1CCC1 Amb18108358 [0,1,0,1,0,0|1,1,0]=4 6247 B7R1.18 NC(=S)C1CSC1 Amb29867873 [0,1,0,1,0,0|0,1,0]=3 6248 B7R1.18 NS(=O)C1CCC1 Amb32720395 [0,1,0,1,0,0|2,0,0]=4 6249 B7R1.18 NS(=O)C1COC1 Amb32720384 [0,1,0,1,0,0|1,1,0]=4 6250 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [0,1,0,1,0,0|1,0,0]=3 6251 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [0,1,0,1,0,0|1,0,0]=3 6252 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [0,1,0,1,0,0|2,0,0]=4 6253 B7R1.18 O=C(O)C1CCC1 Amb2686619 [0,1,0,1,0,0|1,0,0]=3 6254 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,1,0,1,0,0|2,0,0]=4 6255 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,1,0,1,0,0|2,0,0]=4 6256 B7R1.18 O=C(O)C1CCO1 Amb2383526 [0,1,0,1,0,0|2,0,0]=4 6257 B7R1.18 O=C(O)C1CCS1 Amb27209836 [0,1,0,1,0,0|2,0,0]=4 6258 B7R1.18 O=C(O)C1CNC1 Amb2444164 [0,1,0,1,0,0|1,0,0]=3 6259 B7R1.18 O=C(O)C1CNC1 Amb8384273 [0,1,0,1,0,0|1,0,0]=3 6260 B7R1.18 O=C(O)C1COC1 Amb33542663 [0,1,0,1,0,0|0,1,0]=3 6261 B7R1.18 O=C(O)C1CSC1 Amb20171470 [0,1,0,1,0,0|0,0,0]=2 6262 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,1,0,1,0,0|2,0,0]=4 6263 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,1,0,1,0,0|2,0,0]=4 6264 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [0,1,0,1,0,0|2,0,0]=4 6265 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,1,0,1,0,0|2,0,0]=4 6266 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,1,0,1,0,0|2,0,0]=4 6267 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [0,1,0,1,0,0|2,0,0]=4 6268 B7R1.18 O=S(Cl)C1CCC1 Amb32720394 [0,1,0,1,0,0|2,0,0]=4 6269 B7R1.18 O=S(Cl)C1COC1 Amb32720383 [0,1,0,1,0,0|1,1,0]=4 6270 B7R1.18 O=S([O-])C1CCC1 Amb32755305 [0,1,0,1,0,0|2,0,0]=4 6271 B7R1.18 O=S([O-])C1CNC1 Amb32755449 [0,1,0,1,0,0|2,0,0]=4 6272 B7R1.18 O=[N+]([O-])C1CCC1 Amb13883563 [0,1,0,1,0,0|2,0,0]=4 6273 B7R1.18 O=[N+]([O-])C1CNC1 Amb34150823 [0,1,0,1,0,0|2,0,0]=4 6274 B7R1.18 O=[N+]([O-])C1CNC1 Amb34199881 [0,1,0,1,0,0|2,0,0]=4 6275 B7R1.18 O=[N+]([O-])C1COC1 Amb22289560 [0,1,0,1,0,0|1,1,0]=4 6276 B7R1.20 C=C(C)CC1CC1 Amb27207160 [0,1,0,1,0,0|2,0,0]=4 6277 B7R1.20 C=C(C)CC1CO1 Amb33199536 [0,1,0,1,0,0|1,1,0]=4 6278 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,1,0,1,0,0|1,0,0]=3 6279 B7R1.20 CC(=O)NC1CC1 Amb3366973 [0,1,0,1,0,0|2,0,0]=4 6280 B7R1.20 CC(=O)OC1CO1 Amb25261586 [0,1,0,1,0,0|1,1,0]=4 6281 B7R1.20 N=C(N)CC1CC1 Amb21964664 [0,1,0,1,0,0|2,0,0]=4 6282 B7R1.20 N=C(N)CC1CC1 Amb9423215 [0,1,0,1,0,0|2,0,0]=4 6283 B7R1.20 NC(=O)CC1CC1 Amb33552967 [0,1,0,1,0,0|1,0,0]=3 6284 B7R1.20 NC(=O)NC1CC1 Amb1152776 [0,1,0,1,0,0|2,0,0]=4 6285 B7R1.20 NC(=O)OC1CC1 Amb27265645 [0,1,0,1,0,0|2,0,0]=4 6286 B7R1.20 NC(=O)OC1CO1 Amb27184555 [0,1,0,1,0,0|1,1,0]=4 6287 B7R1.20 NC(=S)CC1CC1 Amb9423151 [0,1,0,1,0,0|1,1,0]=4 6288 B7R1.20 NS(=O)CC1CC1 Amb32720358 [0,1,0,1,0,0|2,0,0]=4 6289 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,1,0,1,0,0|1,0,0]=3 6290 B7R1.20 O=C(Cl)NC1CC1 Amb27848787 [0,1,0,1,0,0|2,0,0]=4 6291 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [0,1,0,1,0,0|2,0,0]=4 6292 B7R1.20 O=C(O)CC1CC1 Amb2686657 [0,1,0,1,0,0|1,0,0]=3 6293 B7R1.20 O=C(O)CC1CO1 Amb25244347 [0,1,0,1,0,0|0,1,0]=3 6294 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [0,1,0,1,0,0|0,1,0]=3 6295 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [0,1,0,1,0,0|0,1,0]=3 6296 B7R1.20 O=S(Cl)CC1CC1 Amb25914604 [0,1,0,1,0,0|2,0,0]=4 6297 B7R1.20 O=S([O-])CC1CC1 Amb27483189 [0,1,0,1,0,0|2,0,0]=4 6298 B7R1.20 O=[N+]([O-])CC1CO1 Amb23589333 [0,1,0,1,0,0|1,1,0]=4 6299 B7R1.23 C=CC1CC1(C)Br Amb28284153 [0,1,0,1,0,0|2,0,0]=4 6300 B7R1.23 CC1(Br)CC1C=O Amb25679179 [0,1,0,1,0,0|1,0,0]=3 6301 B7R1.23 CC1(C)CC1C=O Amb28071200 [0,1,0,1,0,0|1,0,0]=3 6302 B7R1.23 CC1(C)C[C@@H]1C=O Amb26416941 [0,1,0,1,0,0|1,0,0]=3 6303 B7R1.23 CC1(C)OC1C=O Amb24724709 [0,1,0,1,0,0|2,0,0]=4 6304 B7R1.23 CC1(C)O[C@@H]1C=O Amb28050526 [0,1,0,1,0,0|2,0,0]=4 6305 B7R1.23 C[C@]1(Br)C[C@@H]1C=O Amb27215359 [0,1,0,1,0,0|1,0,0]=3 6306 B7R1.23 O=CC1CC1(Cl)Cl Amb25187914 [0,1,0,1,0,0|2,0,0]=4 6307 B7R1.23 O=CC1CC1(F)F Amb22002395 [0,1,0,1,0,0|2,0,0]=4 6308 B7R1.24 C1=CCCC=CC1 Amb22365118 [0,1,0,1,0,0|2,0,0]=4 6309 B7R1.24 C1=CCCCCC1 Amb8515344 [0,1,0,1,0,0|2,0,0]=4 6310 B7R1.24 C1=CCCNCC1 Amb22169408 [0,1,0,1,0,0|2,0,0]=4 6311 B7R1.24 C1=CCCNCC1 Amb24530335 [0,1,0,1,0,0|2,0,0]=4 6312 B7R1.24 C1=CCNCCC1 Amb25104535 [0,1,0,1,0,0|2,0,0]=4 6313 B7R1.24 C1=CCNCCC1 Amb33330391 [0,1,0,1,0,0|2,0,0]=4 6314 B7R1.24 C1=CCOCOC1 Amb6600543 [0,1,0,1,0,0|1,1,0]=4 6315 B7R1.24 C1=COCCCC1 Amb28254269 [0,1,0,1,0,0|1,0,1]=4 6316 B7R1.24 C1=NCCCCC1 Amb27445210 [0,1,0,1,0,0|2,0,0]=4 6317 B7R1.24 C1CCSCSC1 Amb22227736 [0,1,0,1,0,0|0,1,1]=4 6318 B7R1.24 C1CNCCSC1 Amb13951191 [0,1,0,1,0,0|1,0,1]=4 6319 B7R1.24 C1CNCCSC1 Amb9176341 [0,1,0,1,0,0|1,0,1]=4 6320 B7R1.24 C1CSSCCN1 Amb24381772 [0,1,0,1,0,0|2,0,0]=4 6321 B7R1.24 C1CSSCCN1 Amb32674818 [0,1,0,1,0,0|2,0,0]=4 6322 B7R1.24 C1CSSCCO1 Amb10565588 [0,1,0,1,0,0|2,0,0]=4 6323 B7R1.24 C1CSSCCS1 Amb33352020 [0,1,0,1,0,0|1,1,0]=4 6324 B7R2.12 C1=CC2NCC12 Amb24763738 [0,0,0,2,0,0|2,0,0]=4 6325 B7R2.13 C1=CC2OC2C1 Amb22002013 [0,0,0,2,0,0|1,1,0]=4