0 B11R1.17 BrCC#Cc1ccccc1Br Amb25891657 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.17 BrCCCc1ccccc1Br Amb26341120 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.17 BrCCCc1cccnc1Br Amb33388172 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.17 BrCCCc1ccncc1Br Amb24416596 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.17 BrCCCc1ncccc1Br Amb26654973 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.17 BrCCOc1ccccc1Br Amb6280497 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.17 BrCCOc1cccnc1Br Amb32988374 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.17 BrCCSc1ncccc1Br Amb27754896 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.17 C#CCCc1ccccc1Br Amb3991957 [0,0,0,0,0,0|1,0,1]=2 9 B11R1.17 C#CCCc1ccccc1C Amb18636111 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,0,0,0,0,0|1,1,1]=3 11 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,0,0,0,0,0|1,1,1]=3 12 B11R1.17 C#CCCc1ccccc1O Amb28253821 [0,0,0,0,0,0|2,0,1]=3 13 B11R1.17 C#CCCc1cccnc1Br Amb33388110 [0,0,0,0,0,0|2,0,1]=3 14 B11R1.17 C#CCCc1cccnc1C Amb32878342 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.17 C#CCCc1cccnc1Cl Amb33257070 [0,0,0,0,0,0|2,1,1]=4 16 B11R1.17 C#CCCc1cccnc1F Amb33377147 [0,0,0,0,0,0|2,1,1]=4 17 B11R1.17 C#CCCc1ccncc1Br Amb33388698 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.17 C#CCCc1ccncc1C Amb33426430 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.17 C#CCCc1ccncc1Cl Amb33413605 [0,0,0,0,0,0|2,1,1]=4 20 B11R1.17 C#CCCc1ccncc1F Amb33316823 [0,0,0,0,0,0|2,1,1]=4 21 B11R1.17 C#CCCc1cnccc1C Amb33375284 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.17 C#CCCc1ncccc1Br Amb33336113 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.17 C#CCCc1ncccc1C Amb33360224 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.17 C#CCCc1ncccc1F Amb33418416 [0,0,0,0,0,0|2,1,1]=4 25 B11R1.17 C#CCNc1ccccc1F Amb27441677 [0,0,0,0,0,0|2,1,1]=4 26 B11R1.17 C#CCNc1ccccc1I Amb27597826 [0,0,0,0,0,0|2,1,1]=4 27 B11R1.17 C#CCNc1cccnc1Br Amb28070764 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.17 C#CCOc1ccccc1Br Amb6263893 [0,0,0,0,0,0|2,0,1]=3 29 B11R1.17 C#CCOc1ccccc1C Amb19373366 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,0,0,0,0,0|2,1,1]=4 31 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,0,0,0,0,0|2,1,1]=4 32 B11R1.17 C#CCOc1ccccc1I Amb27217813 [0,0,0,0,0,0|2,1,1]=4 33 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,0,0,0,0,0|3,0,1]=4 34 B11R1.17 C#CCOc1ccccc1N Amb8389695 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.17 C#CCOc1ccccc1O Amb8837375 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.17 C#CCOc1cccnc1Br Amb22642319 [0,0,0,0,0,0|3,0,1]=4 37 B11R1.17 C#CCOc1ccncc1Br Amb26343092 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.17 C#CCOc1ncccc1Br Amb28074465 [0,0,0,0,0,0|3,0,1]=4 39 B11R1.17 C#CCSc1ccccc1Br Amb28312974 [0,0,0,0,0,0|2,0,1]=3 40 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,0,0,0,0,0|2,1,1]=4 41 B11R1.17 C#CCSc1ccccc1N Amb6275344 [0,0,0,0,0,0|3,0,1]=4 42 B11R1.17 C=CCCN1C=CC=CC1=O Amb27461258 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,0,0,0,0,0|2,0,1]=3 44 B11R1.17 C=CCCc1cccnc1N Amb25916395 [0,0,0,0,0,0|3,0,1]=4 45 B11R1.17 C=CCCc1ccncc1Br Amb26462441 [0,0,0,0,0,0|2,0,1]=3 46 B11R1.17 C=CCCc1ccncc1F Amb35711460 [0,0,0,0,0,0|2,1,1]=4 47 B11R1.17 C=CCCc1cnccc1C Amb29864608 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.17 C=CCCc1ncccc1Br Amb27840078 [0,0,0,0,0,0|2,0,1]=3 49 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,0,0,0,0,0|2,0,1]=3 50 B11R1.17 C=CCNc1ccccc1C Amb4035723 [0,0,0,0,0,0|3,0,1]=4 51 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,0,0,0,0,0|2,1,1]=4 52 B11R1.17 C=CCNc1ccccc1I Amb28285324 [0,0,0,0,0,0|2,1,1]=4 53 B11R1.17 C=CCNc1ccccc1S Amb27870731 [0,0,0,0,0,0|3,0,1]=4 54 B11R1.17 C=CCNc1ccncc1Br Amb27766985 [0,0,0,0,0,0|3,0,1]=4 55 B11R1.17 C=CCOc1ccccc1Br Amb4422143 [0,0,0,0,0,0|2,0,1]=3 56 B11R1.17 C=CCOc1ccccc1C Amb2721161 [0,0,0,0,0,0|3,0,1]=4 57 B11R1.17 C=CCOc1ccccc1Cl Amb3940570 [0,0,0,0,0,0|2,1,1]=4 58 B11R1.17 C=CCOc1ccccc1F Amb2688315 [0,0,0,0,0,0|2,1,1]=4 59 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,0,0,0,0,0|2,1,1]=4 60 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,0,0,0,0,0|3,0,1]=4 61 B11R1.17 C=CCOc1ccccc1N Amb2721826 [0,0,0,0,0,0|3,0,1]=4 62 B11R1.17 C=CCOc1ccccc1O Amb8837354 [0,0,0,0,0,0|3,0,1]=4 63 B11R1.17 C=CCOc1cccnc1Br Amb27157328 [0,0,0,0,0,0|3,0,1]=4 64 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,0,0,0,0,0|2,0,1]=3 65 B11R1.17 C=CCSc1ccccc1C Amb25231651 [0,0,0,0,0,0|3,0,1]=4 66 B11R1.17 C=CCSc1ccccc1Cl Amb27218500 [0,0,0,0,0,0|2,1,1]=4 67 B11R1.17 C=CCSc1ccccc1F Amb28319358 [0,0,0,0,0,0|2,1,1]=4 68 B11R1.17 C=CCSc1ccccc1N Amb433020 [0,0,0,0,0,0|3,0,1]=4 69 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,0,0,0,0,0|3,0,1]=4 70 B11R1.17 C=CCSc1ncccc1Br Amb24486891 [0,0,0,0,0,0|3,0,1]=4 71 B11R1.17 CC#CCc1cnccc1N Amb28143907 [0,0,0,0,0,0|3,0,1]=4 72 B11R1.17 CCC#Cc1ccccc1Br Amb27879801 [0,0,0,0,0,0|1,0,2]=3 73 B11R1.17 CCC#Cc1ccccc1C Amb25891559 [0,0,0,0,0,0|2,0,2]=4 74 B11R1.17 CCC#Cc1ccccc1Cl Amb25198269 [0,0,0,0,0,0|1,1,2]=4 75 B11R1.17 CCC#Cc1ccccc1F Amb26984263 [0,0,0,0,0,0|1,1,2]=4 76 B11R1.17 CCC#Cc1ccccc1I Amb24447638 [0,0,0,0,0,0|1,1,2]=4 77 B11R1.17 CCC#Cc1ccccc1N Amb24670207 [0,0,0,0,0,0|2,0,2]=4 78 B11R1.17 CCC#Cc1ccccc1O Amb25320119 [0,0,0,0,0,0|2,0,2]=4 79 B11R1.17 CCCCC1=CN=CNC1=S Amb27750740 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.17 CCCCN1C=NC=CC1=O Amb22522708 [0,0,0,0,0,0|4,0,0]=4 82 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,0,0,0,0,0|1,0,0]=1 83 B11R1.17 CCCCc1ccccc1C Amb25825024 [0,0,0,0,0,0|2,0,0]=2 84 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,0,0,0,0,0|1,1,0]=2 85 B11R1.17 CCCCc1ccccc1I Amb25955656 [0,0,0,0,0,0|1,1,0]=2 86 B11R1.17 CCCCc1ccccc1N Amb4037102 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,0,0,0,0,0|2,0,0]=2 88 B11R1.17 CCCCc1cccnc1Br Amb33038909 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.17 CCCCc1cccnc1N Amb8386853 [0,0,0,0,0,0|3,0,0]=3 90 B11R1.17 CCCCc1ccncc1N Amb27666549 [0,0,0,0,0,0|3,0,0]=3 91 B11R1.17 CCCCc1cnccc1N Amb25785815 [0,0,0,0,0,0|3,0,0]=3 92 B11R1.17 CCCCc1cnccc1O Amb33189016 [0,0,0,0,0,0|3,0,0]=3 93 B11R1.17 CCCCc1ncccc1N Amb26848966 [0,0,0,0,0,0|3,0,0]=3 94 B11R1.17 CCCCc1ncccc1O Amb27483034 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.17 CCCCc1nccnc1Br Amb27653340 [0,0,0,0,0,0|3,0,0]=3 96 B11R1.17 CCCCc1nccnc1C Amb22234797 [0,0,0,0,0,0|4,0,0]=4 97 B11R1.17 CCCCc1nccnc1Cl Amb34182524 [0,0,0,0,0,0|3,1,0]=4 98 B11R1.17 CCCCc1nccnc1N Amb22495916 [0,0,0,0,0,0|4,0,0]=4 99 B11R1.17 CCCCc1ncncc1Br Amb10068155 [0,0,0,0,0,0|3,0,0]=3 100 B11R1.17 CCCCc1ncncc1O Amb27764280 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.17 CCCNc1ccccc1Br Amb6696451 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.17 CCCNc1ccccc1C Amb6701222 [0,0,0,0,0,0|3,0,0]=3 103 B11R1.17 CCCNc1ccccc1Cl Amb4313502 [0,0,0,0,0,0|2,1,0]=3 104 B11R1.17 CCCNc1ccccc1F Amb6697369 [0,0,0,0,0,0|2,1,0]=3 105 B11R1.17 CCCNc1ccccc1N Amb440116 [0,0,0,0,0,0|3,0,0]=3 106 B11R1.17 CCCNc1cccnc1F Amb35725083 [0,0,0,0,0,0|3,1,0]=4 107 B11R1.17 CCCNc1ccncc1C Amb28437320 [0,0,0,0,0,0|4,0,0]=4 108 B11R1.17 CCCNc1ccncc1N Amb9205187 [0,0,0,0,0,0|4,0,0]=4 109 B11R1.17 CCCNc1cnccc1C Amb27436805 [0,0,0,0,0,0|4,0,0]=4 110 B11R1.17 CCCNc1cnccc1Cl Amb27814860 [0,0,0,0,0,0|3,1,0]=4 111 B11R1.17 CCCNc1ncccc1C Amb18987728 [0,0,0,0,0,0|4,0,0]=4 112 B11R1.17 CCCNc1ncccc1F Amb18300627 [0,0,0,0,0,0|3,1,0]=4 113 B11R1.17 CCCNc1ncccc1N Amb20668081 [0,0,0,0,0,0|4,0,0]=4 114 B11R1.17 CCCNc1ncccc1N Amb7767452 [0,0,0,0,0,0|4,0,0]=4 115 B11R1.17 CCCOC1=CC=CNC1=O Amb18034627 [0,0,0,0,0,0|4,0,0]=4 116 B11R1.17 CCCOc1ccccc1Br Amb6267012 [0,0,0,0,0,0|2,0,0]=2 117 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,0,0,0,0,0|2,1,0]=3 118 B11R1.17 CCCOc1ccccc1I Amb27171983 [0,0,0,0,0,0|2,1,0]=3 119 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,0,0,0,0,0|3,0,0]=3 120 B11R1.17 CCCOc1ccccc1N Amb840073 [0,0,0,0,0,0|3,0,0]=3 121 B11R1.17 CCCOc1ccccc1O Amb433886 [0,0,0,0,0,0|3,0,0]=3 122 B11R1.17 CCCOc1ccccc1S Amb28399283 [0,0,0,0,0,0|3,0,0]=3 123 B11R1.17 CCCOc1cccnc1Br Amb24321030 [0,0,0,0,0,0|3,0,0]=3 124 B11R1.17 CCCOc1cccnc1C Amb27668969 [0,0,0,0,0,0|4,0,0]=4 125 B11R1.17 CCCOc1cccnc1I Amb27477526 [0,0,0,0,0,0|3,1,0]=4 126 B11R1.17 CCCOc1cccnc1N Amb9208357 [0,0,0,0,0,0|4,0,0]=4 127 B11R1.17 CCCOc1ccncc1Br Amb24320776 [0,0,0,0,0,0|3,0,0]=3 128 B11R1.17 CCCOc1ccncc1N Amb8874526 [0,0,0,0,0,0|4,0,0]=4 129 B11R1.17 CCCOc1cnccc1Cl Amb24055245 [0,0,0,0,0,0|3,1,0]=4 130 B11R1.17 CCCOc1cnccc1N Amb24320961 [0,0,0,0,0,0|4,0,0]=4 131 B11R1.17 CCCOc1ncccc1Br Amb19959527 [0,0,0,0,0,0|3,0,0]=3 132 B11R1.17 CCCOc1ncccc1Cl Amb27962160 [0,0,0,0,0,0|3,1,0]=4 133 B11R1.17 CCCOc1ncccc1N Amb8874532 [0,0,0,0,0,0|4,0,0]=4 134 B11R1.17 CCCOc1ncccc1O Amb27645342 [0,0,0,0,0,0|4,0,0]=4 135 B11R1.17 CCCOc1ncncc1Br Amb27814937 [0,0,0,0,0,0|4,0,0]=4 136 B11R1.17 CCCSc1ccccc1Br Amb28046780 [0,0,0,0,0,0|2,0,0]=2 137 B11R1.17 CCCSc1ccccc1Cl Amb25957434 [0,0,0,0,0,0|2,1,0]=3 138 B11R1.17 CCCSc1ccccc1F Amb27752807 [0,0,0,0,0,0|2,1,0]=3 139 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,0,0,0,0,0|3,0,0]=3 140 B11R1.17 CCCSc1ccccc1N Amb6276699 [0,0,0,0,0,0|3,0,0]=3 141 B11R1.17 CCCSc1ccccc1S Amb26323053 [0,0,0,0,0,0|3,0,0]=3 142 B11R1.17 CCCSc1ncccc1N Amb6680310 [0,0,0,0,0,0|4,0,0]=4 143 B11R1.17 CCCSc1ncccc1O Amb33295106 [0,0,0,0,0,0|4,0,0]=4 144 B11R1.17 CCCSc1ncncc1Br Amb27168724 [0,0,0,0,0,0|4,0,0]=4 145 B11R1.17 CCNCc1ccccc1Br Amb28872271 [0,0,0,0,0,0|2,0,0]=2 146 B11R1.17 CCNCc1ccccc1Br Amb6243296 [0,0,0,0,0,0|2,0,0]=2 147 B11R1.17 CCNCc1ccccc1C Amb5785552 [0,0,0,0,0,0|3,0,0]=3 148 B11R1.17 CCNCc1ccccc1C Amb6865250 [0,0,0,0,0,0|3,0,0]=3 149 B11R1.17 CCNCc1ccccc1Cl Amb5785551 [0,0,0,0,0,0|2,1,0]=3 150 B11R1.17 CCNCc1ccccc1Cl Amb6542581 [0,0,0,0,0,0|2,1,0]=3 151 B11R1.17 CCNCc1ccccc1F Amb5785550 [0,0,0,0,0,0|2,1,0]=3 152 B11R1.17 CCNCc1ccccc1F Amb6865249 [0,0,0,0,0,0|2,1,0]=3 153 B11R1.17 CCNCc1ccccc1N Amb28973216 [0,0,0,0,0,0|3,0,0]=3 154 B11R1.17 CCNCc1ccccc1N Amb7173571 [0,0,0,0,0,0|3,0,0]=3 155 B11R1.17 CCNCc1ccccc1O Amb6257868 [0,0,0,0,0,0|3,0,0]=3 156 B11R1.17 CCNCc1cccnc1Cl Amb29848142 [0,0,0,0,0,0|3,1,0]=4 157 B11R1.17 CCNCc1ccncc1Br Amb25695866 [0,0,0,0,0,0|3,0,0]=3 158 B11R1.17 CCNCc1ccncc1Cl Amb27978641 [0,0,0,0,0,0|3,1,0]=4 159 B11R1.17 CCNCc1ccncc1O Amb27494612 [0,0,0,0,0,0|4,0,0]=4 160 B11R1.17 CCNCc1cnccc1C Amb18125201 [0,0,0,0,0,0|4,0,0]=4 161 B11R1.17 CCNCc1cnccc1Cl Amb27237102 [0,0,0,0,0,0|3,1,0]=4 162 B11R1.17 CCNCc1cnccc1N Amb28388519 [0,0,0,0,0,0|4,0,0]=4 163 B11R1.17 CCNCc1ncccc1C Amb18296368 [0,0,0,0,0,0|4,0,0]=4 164 B11R1.17 CCNCc1ncccc1F Amb28398171 [0,0,0,0,0,0|3,1,0]=4 165 B11R1.17 CCOCC1=CC=CNC1=O Amb27186324 [0,0,0,0,0,0|4,0,0]=4 166 B11R1.17 CCOCN1C=CC=CC1=O Amb27461241 [0,0,0,0,0,0|4,0,0]=4 167 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,0,0,0,0,0|2,0,0]=2 168 B11R1.17 CCOCc1ccccc1N Amb6245712 [0,0,0,0,0,0|3,0,0]=3 169 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,0,0,0,0,0|3,0,0]=3 170 B11R1.17 CCSCc1ccccc1Br Amb22228180 [0,0,0,0,0,0|2,0,0]=2 171 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [0,0,0,0,0,0|2,1,0]=3 172 B11R1.17 CCSCc1ccccc1F Amb26622298 [0,0,0,0,0,0|2,1,0]=3 173 B11R1.17 CCSCc1cccnc1N Amb18298620 [0,0,0,0,0,0|4,0,0]=4 174 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [0,0,0,0,0,0|2,0,2]=4 175 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [0,0,0,0,0,0|2,0,2]=4 176 B11R1.17 CC\N=C\c1ccccc1N Amb25991917 [0,0,0,0,0,0|3,0,1]=4 177 B11R1.17 CNCCC1=CC=CNC1=O Amb27442144 [0,0,0,0,0,0|2,0,0]=2 178 B11R1.17 CNCCC1=CNC=NC1=O Amb28286925 [0,0,0,0,0,0|3,0,0]=3 179 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,0,0,0,0,0|0,0,0]=0 180 B11R1.17 CNCCc1ccccc1Br Amb33313471 [0,0,0,0,0,0|0,0,0]=0 181 B11R1.17 CNCCc1ccccc1C Amb19959980 [0,0,0,0,0,0|1,0,0]=1 182 B11R1.17 CNCCc1ccccc1C Amb8841496 [0,0,0,0,0,0|1,0,0]=1 183 B11R1.17 CNCCc1ccccc1Cl Amb8853664 [0,0,0,0,0,0|0,1,0]=1 184 B11R1.17 CNCCc1ccccc1F Amb6710685 [0,0,0,0,0,0|0,1,0]=1 185 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,0,0,0,0,0|1,0,0]=1 186 B11R1.17 CNCCc1ccccc1O Amb30584750 [0,0,0,0,0,0|1,0,0]=1 187 B11R1.17 CNCCc1cccnc1Br Amb33389453 [0,0,0,0,0,0|1,0,0]=1 188 B11R1.17 CNCCc1cccnc1C Amb24635443 [0,0,0,0,0,0|2,0,0]=2 189 B11R1.17 CNCCc1cccnc1Cl Amb33256856 [0,0,0,0,0,0|1,1,0]=2 190 B11R1.17 CNCCc1cccnc1F Amb33377639 [0,0,0,0,0,0|1,1,0]=2 191 B11R1.17 CNCCc1cccnc1N Amb27170722 [0,0,0,0,0,0|2,0,0]=2 192 B11R1.17 CNCCc1ccncc1Br Amb33451218 [0,0,0,0,0,0|1,0,0]=1 193 B11R1.17 CNCCc1ccncc1C Amb25977379 [0,0,0,0,0,0|2,0,0]=2 194 B11R1.17 CNCCc1ccncc1Cl Amb27804415 [0,0,0,0,0,0|1,1,0]=2 195 B11R1.17 CNCCc1ccncc1F Amb24593125 [0,0,0,0,0,0|1,1,0]=2 196 B11R1.17 CNCCc1cnccc1C Amb26933148 [0,0,0,0,0,0|2,0,0]=2 197 B11R1.17 CNCCc1cncnc1C Amb33472506 [0,0,0,0,0,0|3,0,0]=3 198 B11R1.17 CNCCc1ncccc1Br Amb18657771 [0,0,0,0,0,0|1,0,0]=1 199 B11R1.17 CNCCc1ncccc1C Amb18125193 [0,0,0,0,0,0|2,0,0]=2 200 B11R1.17 CNCCc1ncccc1Cl Amb18126745 [0,0,0,0,0,0|1,1,0]=2 201 B11R1.17 CNCCc1ncccc1F Amb24636895 [0,0,0,0,0,0|1,1,0]=2 202 B11R1.17 CNCCc1nccnc1C Amb33142591 [0,0,0,0,0,0|3,0,0]=3 203 B11R1.17 CN\C=N/c1cccnc1Cl Amb26855514 [0,0,0,0,0,0|2,1,1]=4 204 B11R1.17 CN\N=C\c1ccccc1F Amb17704011 [0,0,0,0,0,0|1,1,1]=3 205 B11R1.17 COCCN1N=CC=CC1=O Amb27649738 [0,0,0,0,0,0|4,0,0]=4 206 B11R1.17 COCC[n+]1ccccc1Cl Amb27852703 [0,0,0,0,0,0|2,1,0]=3 207 B11R1.17 COCCc1cccc[n+]1[O-] Amb10573566 [0,0,0,0,0,0|3,0,0]=3 208 B11R1.17 COCCc1ccccc1Br Amb4021414 [0,0,0,0,0,0|1,0,0]=1 209 B11R1.17 COCCc1ccccc1N Amb18992153 [0,0,0,0,0,0|2,0,0]=2 210 B11R1.17 COCCc1ccccc1O Amb33552299 [0,0,0,0,0,0|2,0,0]=2 211 B11R1.17 COCCc1cccnc1N Amb27459527 [0,0,0,0,0,0|3,0,0]=3 212 B11R1.17 COCCc1cncnc1Cl Amb23538201 [0,0,0,0,0,0|3,1,0]=4 213 B11R1.17 COCCc1cncnc1O Amb23538347 [0,0,0,0,0,0|4,0,0]=4 214 B11R1.17 COCCc1ncccc1O Amb27452504 [0,0,0,0,0,0|3,0,0]=3 215 B11R1.17 COCOC1=CC=CNC1=S Amb28428646 [0,0,0,0,0,0|4,0,0]=4 216 B11R1.17 COCOc1cccc[n+]1[O-] Amb27858168 [0,0,0,0,0,0|4,0,0]=4 217 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,0,0,0,0,0|2,0,0]=2 218 B11R1.17 COCOc1ccccc1C Amb10559613 [0,0,0,0,0,0|3,0,0]=3 219 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,0,0,0,0,0|2,1,0]=3 220 B11R1.17 COCOc1ccccc1F Amb22546792 [0,0,0,0,0,0|2,1,0]=3 221 B11R1.17 COCOc1ccccc1I Amb22284514 [0,0,0,0,0,0|2,1,0]=3 222 B11R1.17 COCOc1ccccc1N Amb23599107 [0,0,0,0,0,0|3,0,0]=3 223 B11R1.17 COCOc1cccnc1Cl Amb28041341 [0,0,0,0,0,0|3,1,0]=4 224 B11R1.17 COCOc1cnccc1Br Amb32412226 [0,0,0,0,0,0|3,0,0]=3 225 B11R1.17 COCOc1cnccc1Cl Amb25921402 [0,0,0,0,0,0|3,1,0]=4 226 B11R1.17 COCOc1cnccc1I Amb24593865 [0,0,0,0,0,0|3,1,0]=4 227 B11R1.17 COCSc1ccccc1Br Amb27605149 [0,0,0,0,0,0|2,0,0]=2 228 B11R1.17 COCSc1ccccc1C Amb27775698 [0,0,0,0,0,0|3,0,0]=3 229 B11R1.17 COCSc1ccccc1F Amb28282291 [0,0,0,0,0,0|2,1,0]=3 230 B11R1.17 COCSc1ccccc1O Amb27754976 [0,0,0,0,0,0|3,0,0]=3 231 B11R1.17 COCSc1ncccc1Br Amb28256685 [0,0,0,0,0,0|3,0,0]=3 232 B11R1.17 CONCc1ccccc1Br Amb27471699 [0,0,0,0,0,0|2,0,0]=2 233 B11R1.17 CONCc1ccccc1C Amb28055849 [0,0,0,0,0,0|3,0,0]=3 234 B11R1.17 CONCc1ccccc1Cl Amb26643050 [0,0,0,0,0,0|2,1,0]=3 235 B11R1.17 CONCc1ccccc1Cl Amb33552565 [0,0,0,0,0,0|2,1,0]=3 236 B11R1.17 CONCc1ccccc1F Amb24725975 [0,0,0,0,0,0|2,1,0]=3 237 B11R1.17 CONCc1cccnc1C Amb27176647 [0,0,0,0,0,0|4,0,0]=4 238 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [0,0,0,0,0,0|2,0,2]=4 239 B11R1.17 CO\C=C\c1ccccc1C Amb27804452 [0,0,0,0,0,0|2,0,2]=4 240 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [0,0,0,0,0,0|2,0,2]=4 241 B11R1.17 CO\N=C\c1ccccc1Br Amb28400546 [0,0,0,0,0,0|2,0,1]=3 242 B11R1.17 CO\N=C\c1ccccc1I Amb27853303 [0,0,0,0,0,0|2,1,1]=4 243 B11R1.17 CO\N=C\c1ccccc1N Amb24605335 [0,0,0,0,0,0|3,0,1]=4 244 B11R1.17 CO\N=C\c1ccccc1O Amb25740232 [0,0,0,0,0,0|3,0,1]=4 245 B11R1.17 CSC#Cc1ccccc1N Amb27606341 [0,0,0,0,0,0|2,0,2]=4 246 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,0,0,0,0,0|2,0,0]=2 247 B11R1.17 CSCSc1cccc[n+]1[O-] Amb27660182 [0,0,0,0,0,0|4,0,0]=4 248 B11R1.17 CSSSc1ccccc1N Amb28040975 [0,0,0,0,0,0|4,0,0]=4 249 B11R1.17 CS\C=C/c1ccccc1O Amb28351599 [0,0,0,0,0,0|2,0,2]=4 250 B11R1.17 C\C=C/Oc1ccccc1O Amb28137745 [0,0,0,0,0,0|3,0,1]=4 251 B11R1.17 C\C=C\CN1C=CC=CC1=O Amb27882210 [0,0,0,0,0,0|3,0,1]=4 252 B11R1.17 C\C=C\C[n+]1ccccc1Br Amb27980024 [0,0,0,0,0,0|2,0,1]=3 253 B11R1.17 C\C=C\Cc1ccccc1O Amb3940146 [0,0,0,0,0,0|2,0,1]=3 254 B11R1.17 C\C=C\Sc1ccccc1N Amb27234697 [0,0,0,0,0,0|3,0,1]=4 255 B11R1.17 C\C=N\Nc1ccccc1N Amb27167739 [0,0,0,0,0,0|4,0,0]=4 256 B11R1.17 Cc1ccccc1CCC#N Amb17204295 [0,0,0,0,0,0|3,0,0]=3 257 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [0,0,0,0,0,0|3,0,0]=3 258 B11R1.17 Cc1ccccc1CCCBr Amb17104552 [0,0,0,0,0,0|3,0,0]=3 259 B11R1.17 Cc1ccccc1CCCCl Amb17104525 [0,0,0,0,0,0|3,0,0]=3 260 B11R1.17 Cc1ccccc1CCCN Amb33743608 [0,0,0,0,0,0|3,0,0]=3 261 B11R1.17 Cc1ccccc1CCCN Amb5735477 [0,0,0,0,0,0|3,0,0]=3 262 B11R1.17 Cc1ccccc1CCCO Amb17089494 [0,0,0,0,0,0|3,0,0]=3 263 B11R1.17 Cc1ccccc1CCCS Amb17400218 [0,0,0,0,0,0|3,0,0]=3 264 B11R1.17 Cc1ccccc1CCNN Amb6242730 [0,0,0,0,0,0|2,0,0]=2 265 B11R1.17 Cc1ccccc1CCON Amb26991554 [0,0,0,0,0,0|3,0,0]=3 266 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,0,0,0,0,0|3,0,0]=3 267 B11R1.17 Cc1ccccc1CN=C=O Amb3941010 [0,0,0,0,0,0|4,0,0]=4 268 B11R1.17 Cc1ccccc1CN=C=S Amb2689351 [0,0,0,0,0,0|4,0,0]=4 269 B11R1.17 Cc1ccccc1CN=[N+]=[N-] Amb32652772 [0,0,0,0,0,0|3,0,1]=4 270 B11R1.17 Cc1ccccc1CN=[N+]=[N-] Amb8938150 [0,0,0,0,0,0|3,0,1]=4 271 B11R1.17 Cc1ccccc1CNC#N Amb16186975 [0,0,0,0,0,0|4,0,0]=4 272 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,0,0,0,0,0|4,0,0]=4 273 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,0,0,0,0,0|4,0,0]=4 274 B11R1.17 Cc1ccccc1CSC#N Amb17778963 [0,0,0,0,0,0|4,0,0]=4 275 B11R1.17 Cc1ccccc1NCC#N Amb6714251 [0,0,0,0,0,0|4,0,0]=4 276 B11R1.17 Cc1ccccc1NCCBr Amb27481681 [0,0,0,0,0,0|4,0,0]=4 277 B11R1.17 Cc1ccccc1NCCCl Amb17334785 [0,0,0,0,0,0|4,0,0]=4 278 B11R1.17 Cc1ccccc1NCCN Amb17057744 [0,0,0,0,0,0|4,0,0]=4 279 B11R1.17 Cc1ccccc1NCCO Amb2720820 [0,0,0,0,0,0|4,0,0]=4 280 B11R1.17 Cc1ccccc1OCC#N Amb4036310 [0,0,0,0,0,0|4,0,0]=4 281 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [0,0,0,0,0,0|4,0,0]=4 282 B11R1.17 Cc1ccccc1OCCBr Amb1105693 [0,0,0,0,0,0|4,0,0]=4 283 B11R1.17 Cc1ccccc1OCCCl Amb5559281 [0,0,0,0,0,0|4,0,0]=4 284 B11R1.17 Cc1ccccc1OCCF Amb26588103 [0,0,0,0,0,0|4,0,0]=4 285 B11R1.17 Cc1ccccc1OCCN Amb1098984 [0,0,0,0,0,0|4,0,0]=4 286 B11R1.17 Cc1ccccc1OCCN Amb2052283 [0,0,0,0,0,0|4,0,0]=4 287 B11R1.17 Cc1ccccc1OCCO Amb2209345 [0,0,0,0,0,0|4,0,0]=4 288 B11R1.17 Cc1ccccc1OCCS Amb6255243 [0,0,0,0,0,0|4,0,0]=4 289 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,0,0,0,0,0|4,0,0]=4 290 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,0,0,0,0,0|4,0,0]=4 291 B11R1.17 Cc1ccccc1SCCF Amb27853875 [0,0,0,0,0,0|4,0,0]=4 292 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,0,0,0,0,0|4,0,0]=4 293 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,0,0,0,0,0|4,0,0]=4 294 B11R1.17 Cc1cccnc1CCC#N Amb24085237 [0,0,0,0,0,0|4,0,0]=4 295 B11R1.17 Cc1cccnc1CCCBr Amb33451722 [0,0,0,0,0,0|4,0,0]=4 296 B11R1.17 Cc1cccnc1CCCN Amb22886485 [0,0,0,0,0,0|4,0,0]=4 297 B11R1.17 Cc1cccnc1CCCN Amb26458764 [0,0,0,0,0,0|4,0,0]=4 298 B11R1.17 Cc1cccnc1CCCO Amb24685021 [0,0,0,0,0,0|4,0,0]=4 299 B11R1.17 Cc1cccnc1CCCS Amb33360199 [0,0,0,0,0,0|4,0,0]=4 300 B11R1.17 Cc1cccnc1CCNN Amb35731469 [0,0,0,0,0,0|3,0,0]=3 301 B11R1.17 Cc1cccnc1CCON Amb33429250 [0,0,0,0,0,0|4,0,0]=4 302 B11R1.17 Cc1ccncc1CCC#N Amb33377100 [0,0,0,0,0,0|4,0,0]=4 303 B11R1.17 Cc1ccncc1CCC=O Amb27971665 [0,0,0,0,0,0|4,0,0]=4 304 B11R1.17 Cc1ccncc1CCCBr Amb25089629 [0,0,0,0,0,0|4,0,0]=4 305 B11R1.17 Cc1ccncc1CCCBr Amb33743790 [0,0,0,0,0,0|4,0,0]=4 306 B11R1.17 Cc1ccncc1CCCCl Amb27465644 [0,0,0,0,0,0|4,0,0]=4 307 B11R1.17 Cc1ccncc1CCCN Amb26590860 [0,0,0,0,0,0|4,0,0]=4 308 B11R1.17 Cc1ccncc1CCCO Amb25717118 [0,0,0,0,0,0|4,0,0]=4 309 B11R1.17 Cc1ccncc1CCCS Amb33375260 [0,0,0,0,0,0|4,0,0]=4 310 B11R1.17 Cc1ccncc1CCON Amb33376748 [0,0,0,0,0,0|4,0,0]=4 311 B11R1.17 Cc1cnccc1CCC#N Amb27788732 [0,0,0,0,0,0|4,0,0]=4 312 B11R1.17 Cc1cnccc1CCC=O Amb33426427 [0,0,0,0,0,0|4,0,0]=4 313 B11R1.17 Cc1cnccc1CCCBr Amb24611779 [0,0,0,0,0,0|4,0,0]=4 314 B11R1.17 Cc1cnccc1CCCN Amb25916323 [0,0,0,0,0,0|4,0,0]=4 315 B11R1.17 Cc1cnccc1CCCO Amb10573523 [0,0,0,0,0,0|4,0,0]=4 316 B11R1.17 Cc1cnccc1CCCS Amb33426104 [0,0,0,0,0,0|4,0,0]=4 317 B11R1.17 Cc1cnccc1CCON Amb33414181 [0,0,0,0,0,0|4,0,0]=4 318 B11R1.17 Cc1ncccc1CCC#N Amb32954009 [0,0,0,0,0,0|4,0,0]=4 319 B11R1.17 Cc1ncccc1CCC=O Amb32879664 [0,0,0,0,0,0|4,0,0]=4 320 B11R1.17 Cc1ncccc1CCCBr Amb33432593 [0,0,0,0,0,0|4,0,0]=4 321 B11R1.17 Cc1ncccc1CCCN Amb26975097 [0,0,0,0,0,0|4,0,0]=4 322 B11R1.17 Cc1ncccc1CCCO Amb24360630 [0,0,0,0,0,0|4,0,0]=4 323 B11R1.17 Cc1ncccc1CCCS Amb32878313 [0,0,0,0,0,0|4,0,0]=4 324 B11R1.17 Cc1ncccc1CCON Amb32879317 [0,0,0,0,0,0|4,0,0]=4 325 B11R1.17 ClCC#Cc1ccccc1Br Amb26460989 [0,0,0,0,0,0|2,0,2]=4 326 B11R1.17 ClCCCc1ccccc1Br Amb26508575 [0,0,0,0,0,0|2,0,0]=2 327 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,0,0,0,0,0|2,1,0]=3 328 B11R1.17 ClCCCc1ccncc1Br Amb32689599 [0,0,0,0,0,0|3,0,0]=3 329 B11R1.17 ClCCCc1ccncc1Cl Amb25344160 [0,0,0,0,0,0|3,1,0]=4 330 B11R1.17 ClCCCc1ncccc1Br Amb25089986 [0,0,0,0,0,0|3,0,0]=3 331 B11R1.17 ClCCCc1ncccc1Cl Amb32690847 [0,0,0,0,0,0|3,1,0]=4 332 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,0,0,0,0,0|3,0,0]=3 333 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,0,0,0,0,0|3,1,0]=4 334 B11R1.17 ClCCNc1ccncc1Br Amb28050806 [0,0,0,0,0,0|4,0,0]=4 335 B11R1.17 ClCCOc1ccccc1Br Amb4477181 [0,0,0,0,0,0|3,0,0]=3 336 B11R1.17 ClCCOc1ccccc1Cl Amb8828429 [0,0,0,0,0,0|3,1,0]=4 337 B11R1.17 ClCCSc1ccccc1Cl Amb8827948 [0,0,0,0,0,0|3,1,0]=4 338 B11R1.17 ClCCSc1ccncc1Br Amb28123863 [0,0,0,0,0,0|4,0,0]=4 339 B11R1.17 ClCCSc1ncccc1Br Amb28058208 [0,0,0,0,0,0|4,0,0]=4 340 B11R1.17 ClCSCc1ccccc1Cl Amb28456984 [0,0,0,0,0,0|3,1,0]=4 341 B11R1.17 Clc1ccccc1CCCBr Amb17104560 [0,0,0,0,0,0|2,1,0]=3 342 B11R1.17 Clc1ccccc1OCCBr Amb1150980 [0,0,0,0,0,0|3,1,0]=4 343 B11R1.17 Clc1ccccc1OCCI Amb28056714 [0,0,0,0,0,0|3,1,0]=4 344 B11R1.17 Clc1cccnc1CCCBr Amb32690848 [0,0,0,0,0,0|3,1,0]=4 345 B11R1.17 Clc1cnccc1CCCBr Amb25851696 [0,0,0,0,0,0|3,1,0]=4 346 B11R1.17 Clc1ncccc1CCCBr Amb33389022 [0,0,0,0,0,0|3,1,0]=4 347 B11R1.17 FCC#Cc1ccccc1Br Amb25252787 [0,0,0,0,0,0|2,0,2]=4 348 B11R1.17 FCCNc1ccccc1Br Amb27596368 [0,0,0,0,0,0|3,0,0]=3 349 B11R1.17 FCCNc1ccccc1Cl Amb27868080 [0,0,0,0,0,0|3,1,0]=4 350 B11R1.17 FCCNc1ncccc1Br Amb27249939 [0,0,0,0,0,0|4,0,0]=4 351 B11R1.17 FCCOc1ccccc1Br Amb27391893 [0,0,0,0,0,0|3,0,0]=3 352 B11R1.17 FCCOc1ccccc1I Amb28072521 [0,0,0,0,0,0|3,1,0]=4 353 B11R1.17 FCCOc1cnccc1Br Amb27267251 [0,0,0,0,0,0|4,0,0]=4 354 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,0,0,0,0,0|3,0,0]=3 355 B11R1.17 Fc1ccccc1CCCBr Amb17104555 [0,0,0,0,0,0|2,1,0]=3 356 B11R1.17 Fc1ccccc1CCCCl Amb17104528 [0,0,0,0,0,0|2,1,0]=3 357 B11R1.17 Fc1ccccc1CCCS Amb17400332 [0,0,0,0,0,0|2,1,0]=3 358 B11R1.17 Fc1ccccc1CN=C=S Amb2688052 [0,0,0,0,0,0|3,1,0]=4 359 B11R1.17 Fc1ccccc1COCCl Amb27654557 [0,0,0,0,0,0|3,1,0]=4 360 B11R1.17 Fc1ccccc1NCCCl Amb17334964 [0,0,0,0,0,0|3,1,0]=4 361 B11R1.17 Fc1ccccc1OCCBr Amb1103643 [0,0,0,0,0,0|3,1,0]=4 362 B11R1.17 Fc1ccccc1OCCCl Amb8828428 [0,0,0,0,0,0|3,1,0]=4 363 B11R1.17 Fc1ccccc1OCCS Amb6255864 [0,0,0,0,0,0|3,1,0]=4 364 B11R1.17 Fc1ccccc1SCCCl Amb1154202 [0,0,0,0,0,0|3,1,0]=4 365 B11R1.17 Fc1ccccc1SCCI Amb28364151 [0,0,0,0,0,0|3,1,0]=4 366 B11R1.17 Fc1cccnc1CCCBr Amb33335708 [0,0,0,0,0,0|3,1,0]=4 367 B11R1.17 Fc1cccnc1CCCS Amb33327465 [0,0,0,0,0,0|3,1,0]=4 368 B11R1.17 Fc1cnccc1CCCBr Amb24486812 [0,0,0,0,0,0|3,1,0]=4 369 B11R1.17 Fc1cnccc1CCCS Amb33316480 [0,0,0,0,0,0|3,1,0]=4 370 B11R1.17 Fc1ncccc1CCCBr Amb33450427 [0,0,0,0,0,0|3,1,0]=4 371 B11R1.17 Fc1ncccc1CCCS Amb33376782 [0,0,0,0,0,0|3,1,0]=4 372 B11R1.17 N#CC#Cc1ccccc1Br Amb27158779 [0,0,0,0,0,0|2,0,2]=4 373 B11R1.17 N#CCCN1C=CC=CC1=O Amb18542616 [0,0,0,0,0,0|4,0,0]=4 374 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,0,0,0,0,0|2,0,0]=2 375 B11R1.17 N#CCCc1ccccc1Cl Amb2686406 [0,0,0,0,0,0|2,1,0]=3 376 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,0,0,0,0,0|2,1,0]=3 377 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,0,0,0,0,0|3,0,0]=3 378 B11R1.17 N#CCCc1ccccc1S Amb28208431 [0,0,0,0,0,0|3,0,0]=3 379 B11R1.17 N#CCCc1cccnc1Br Amb33389414 [0,0,0,0,0,0|3,0,0]=3 380 B11R1.17 N#CCCc1cccnc1Cl Amb33256972 [0,0,0,0,0,0|3,1,0]=4 381 B11R1.17 N#CCCc1cccnc1F Amb33378324 [0,0,0,0,0,0|3,1,0]=4 382 B11R1.17 N#CCCc1ccncc1Br Amb33451915 [0,0,0,0,0,0|3,0,0]=3 383 B11R1.17 N#CCCc1ccncc1Cl Amb26000432 [0,0,0,0,0,0|3,1,0]=4 384 B11R1.17 N#CCCc1ccncc1F Amb33317722 [0,0,0,0,0,0|3,1,0]=4 385 B11R1.17 N#CCCc1ncccc1Br Amb26940680 [0,0,0,0,0,0|3,0,0]=3 386 B11R1.17 N#CCCc1ncccc1F Amb33420863 [0,0,0,0,0,0|3,1,0]=4 387 B11R1.17 N#CCNc1ccccc1Br Amb6712133 [0,0,0,0,0,0|3,0,0]=3 388 B11R1.17 N#CCNc1ccccc1Cl Amb6712355 [0,0,0,0,0,0|3,1,0]=4 389 B11R1.17 N#CCNc1ccccc1F Amb6712545 [0,0,0,0,0,0|3,1,0]=4 390 B11R1.17 N#CCNc1ccccc1N Amb2609638 [0,0,0,0,0,0|4,0,0]=4 391 B11R1.17 N#CCNc1ccccc1O Amb28119295 [0,0,0,0,0,0|4,0,0]=4 392 B11R1.17 N#CCOc1ccccc1Br Amb2720452 [0,0,0,0,0,0|3,0,0]=3 393 B11R1.17 N#CCOc1ccccc1Cl Amb2686311 [0,0,0,0,0,0|3,1,0]=4 394 B11R1.17 N#CCOc1ccccc1F Amb33532602 [0,0,0,0,0,0|3,1,0]=4 395 B11R1.17 N#CCOc1ccccc1N Amb6251107 [0,0,0,0,0,0|4,0,0]=4 396 B11R1.17 N#CCSc1ccccc1Br Amb8994901 [0,0,0,0,0,0|3,0,0]=3 397 B11R1.17 N#CCSc1ccccc1Cl Amb6677759 [0,0,0,0,0,0|3,1,0]=4 398 B11R1.17 N#CCSc1ccccc1F Amb6677732 [0,0,0,0,0,0|3,1,0]=4 399 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,0,0,0,0,0|4,0,0]=4 400 B11R1.17 N#CCSc1ncccc1Br Amb19370974 [0,0,0,0,0,0|4,0,0]=4 401 B11R1.17 N#CNCc1ccccc1Cl Amb16186973 [0,0,0,0,0,0|3,1,0]=4 402 B11R1.17 N#CNCc1ccccc1F Amb16186971 [0,0,0,0,0,0|3,1,0]=4 403 B11R1.17 N#CNCc1ccccc1O Amb27486716 [0,0,0,0,0,0|4,0,0]=4 404 B11R1.17 N#CSCc1ccccc1Cl Amb19889456 [0,0,0,0,0,0|3,1,0]=4 405 B11R1.17 N#CSCc1ccccc1F Amb10789221 [0,0,0,0,0,0|3,1,0]=4 406 B11R1.17 N#CSCc1ccccc1O Amb28126599 [0,0,0,0,0,0|4,0,0]=4 407 B11R1.17 N#C\C=C\c1ccccc1Br Amb17239681 [0,0,0,0,0,0|2,0,2]=4 408 B11R1.17 NCC#Cc1ccccc1Br Amb25727777 [0,0,0,0,0,0|2,0,2]=4 409 B11R1.17 NCCCN1C=CC=CC1=O Amb18535490 [0,0,0,0,0,0|4,0,0]=4 410 B11R1.17 NCCCN1C=CC=CC1=O Amb19514396 [0,0,0,0,0,0|4,0,0]=4 411 B11R1.17 NCCCc1ccccc1Br Amb33533965 [0,0,0,0,0,0|2,0,0]=2 412 B11R1.17 NCCCc1ccccc1Br Amb9304915 [0,0,0,0,0,0|2,0,0]=2 413 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,0,0,0,0,0|2,1,0]=3 414 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,0,0,0,0,0|2,1,0]=3 415 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,0,0,0,0,0|2,1,0]=3 416 B11R1.17 NCCCc1ccccc1F Amb5735478 [0,0,0,0,0,0|2,1,0]=3 417 B11R1.17 NCCCc1ccccc1I Amb27814275 [0,0,0,0,0,0|2,1,0]=3 418 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,0,0,0,0,0|3,0,0]=3 419 B11R1.17 NCCCc1ccccc1O Amb2695303 [0,0,0,0,0,0|3,0,0]=3 420 B11R1.17 NCCCc1cccnc1Br Amb26330157 [0,0,0,0,0,0|3,0,0]=3 421 B11R1.17 NCCCc1cccnc1Cl Amb26959473 [0,0,0,0,0,0|3,1,0]=4 422 B11R1.17 NCCCc1cccnc1F Amb27595673 [0,0,0,0,0,0|3,1,0]=4 423 B11R1.17 NCCCc1cccnc1N Amb28040866 [0,0,0,0,0,0|4,0,0]=4 424 B11R1.17 NCCCc1cccnc1N Amb33249805 [0,0,0,0,0,0|4,0,0]=4 425 B11R1.17 NCCCc1ccncc1Br Amb27644751 [0,0,0,0,0,0|3,0,0]=3 426 B11R1.17 NCCCc1ccncc1Cl Amb23596508 [0,0,0,0,0,0|3,1,0]=4 427 B11R1.17 NCCCc1ccncc1F Amb25111554 [0,0,0,0,0,0|3,1,0]=4 428 B11R1.17 NCCCc1cnccc1F Amb27475861 [0,0,0,0,0,0|3,1,0]=4 429 B11R1.17 NCCCc1cnccc1N Amb27850543 [0,0,0,0,0,0|4,0,0]=4 430 B11R1.17 NCCCc1ncccc1Br Amb25771023 [0,0,0,0,0,0|3,0,0]=3 431 B11R1.17 NCCCc1ncccc1F Amb25032548 [0,0,0,0,0,0|3,1,0]=4 432 B11R1.17 NCCCc1ncccc1N Amb27825891 [0,0,0,0,0,0|4,0,0]=4 433 B11R1.17 NCCCc1ncccc1O Amb25111600 [0,0,0,0,0,0|4,0,0]=4 434 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,0,0,0,0,0|3,0,0]=3 435 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,0,0,0,0,0|3,1,0]=4 436 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,0,0,0,0,0|3,1,0]=4 437 B11R1.17 NCCNc1ccccc1N Amb2794704 [0,0,0,0,0,0|4,0,0]=4 438 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,0,0,0,0,0|4,0,0]=4 439 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,0,0,0,0,0|3,0,0]=3 440 B11R1.17 NCCOc1ccccc1Br Amb5781215 [0,0,0,0,0,0|3,0,0]=3 441 B11R1.17 NCCOc1ccccc1Cl Amb836407 [0,0,0,0,0,0|3,1,0]=4 442 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,0,0,0,0,0|3,1,0]=4 443 B11R1.17 NCCOc1ccccc1F Amb6859379 [0,0,0,0,0,0|3,1,0]=4 444 B11R1.17 NCCOc1ccccc1N Amb18251366 [0,0,0,0,0,0|4,0,0]=4 445 B11R1.17 NCCOc1cccnc1Br Amb33388121 [0,0,0,0,0,0|4,0,0]=4 446 B11R1.17 NCCOc1ccncc1Br Amb24353235 [0,0,0,0,0,0|4,0,0]=4 447 B11R1.17 NCCOc1ncccc1Br Amb18988886 [0,0,0,0,0,0|4,0,0]=4 448 B11R1.17 NCCSc1ccccc1F Amb6265436 [0,0,0,0,0,0|3,1,0]=4 449 B11R1.17 NCCSc1ccccc1N Amb6761760 [0,0,0,0,0,0|4,0,0]=4 450 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,0,0,0,0,0|4,0,0]=4 451 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,0,0,0,0,0|2,0,2]=4 452 B11R1.17 NNCCc1ccccc1Cl Amb6243429 [0,0,0,0,0,0|1,1,0]=2 453 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,0,0,0,0,0|1,1,0]=2 454 B11R1.17 NNCCc1ccccc1F Amb6480211 [0,0,0,0,0,0|1,1,0]=2 455 B11R1.17 NNCCc1cnccc1N Amb27474016 [0,0,0,0,0,0|3,0,0]=3 456 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,0,0,0,0,0|2,0,0]=2 457 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,0,0,0,0,0|2,1,0]=3 458 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,0,0,0,0,0|2,1,0]=3 459 B11R1.17 NOCCc1ccccc1O Amb28063031 [0,0,0,0,0,0|3,0,0]=3 460 B11R1.17 NOCCc1cccnc1Br Amb33387766 [0,0,0,0,0,0|3,0,0]=3 461 B11R1.17 NOCCc1cccnc1Cl Amb33257319 [0,0,0,0,0,0|3,1,0]=4 462 B11R1.17 NOCCc1cccnc1F Amb33377681 [0,0,0,0,0,0|3,1,0]=4 463 B11R1.17 NOCCc1ccncc1Br Amb33388633 [0,0,0,0,0,0|3,0,0]=3 464 B11R1.17 NOCCc1ccncc1Cl Amb33413759 [0,0,0,0,0,0|3,1,0]=4 465 B11R1.17 NOCCc1ccncc1F Amb33317195 [0,0,0,0,0,0|3,1,0]=4 466 B11R1.17 NOCCc1ncccc1Br Amb33336065 [0,0,0,0,0,0|3,0,0]=3 467 B11R1.17 NOCCc1ncccc1F Amb33224647 [0,0,0,0,0,0|3,1,0]=4 468 B11R1.17 N\N=C\Cc1ccccc1F Amb28248964 [0,0,0,0,0,0|1,1,2]=4 469 B11R1.17 Nc1ccccc1CCCCl Amb17477710 [0,0,0,0,0,0|3,0,0]=3 470 B11R1.17 Nc1ccccc1CCCF Amb28059275 [0,0,0,0,0,0|3,0,0]=3 471 B11R1.17 Nc1ccccc1CCCO Amb17477702 [0,0,0,0,0,0|3,0,0]=3 472 B11R1.17 Nc1ccccc1COCS Amb27659006 [0,0,0,0,0,0|4,0,0]=4 473 B11R1.17 Nc1ccccc1NCCO Amb404596 [0,0,0,0,0,0|4,0,0]=4 474 B11R1.17 Nc1ccccc1NCCO Amb6891865 [0,0,0,0,0,0|4,0,0]=4 475 B11R1.17 Nc1ccccc1NCCS Amb27794574 [0,0,0,0,0,0|4,0,0]=4 476 B11R1.17 Nc1ccccc1OCCBr Amb34157677 [0,0,0,0,0,0|4,0,0]=4 477 B11R1.17 Nc1ccccc1OCCBr Amb842426 [0,0,0,0,0,0|4,0,0]=4 478 B11R1.17 Nc1ccccc1OCCCl Amb27474853 [0,0,0,0,0,0|4,0,0]=4 479 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,0,0,0,0,0|4,0,0]=4 480 B11R1.17 Nc1ccccc1OCCO Amb33734854 [0,0,0,0,0,0|4,0,0]=4 481 B11R1.17 Nc1ccccc1OCCO Amb6702378 [0,0,0,0,0,0|4,0,0]=4 482 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,0,0,0,0,0|4,0,0]=4 483 B11R1.17 Nc1ccccc1SCCS Amb28137778 [0,0,0,0,0,0|4,0,0]=4 484 B11R1.17 Nc1ccncc1CCCCl Amb27989139 [0,0,0,0,0,0|4,0,0]=4 485 B11R1.17 Nc1ccncc1CCCO Amb24355779 [0,0,0,0,0,0|4,0,0]=4 486 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,0,0,0,0,0|4,0,0]=4 487 B11R1.17 O=C1C=CC=CN1CCCF Amb27882103 [0,0,0,0,0,0|4,0,0]=4 488 B11R1.17 O=C1C=CC=CN1CCCO Amb18041289 [0,0,0,0,0,0|4,0,0]=4 489 B11R1.17 O=C=NCc1ccccc1Br Amb25251434 [0,0,0,0,0,0|3,0,0]=3 490 B11R1.17 O=C=NCc1ccccc1Cl Amb2720550 [0,0,0,0,0,0|3,1,0]=4 491 B11R1.17 O=C=NCc1ccccc1F Amb3939408 [0,0,0,0,0,0|3,1,0]=4 492 B11R1.17 O=C=NCc1cccnc1Br Amb33387446 [0,0,0,0,0,0|4,0,0]=4 493 B11R1.17 O=C=NCc1ccncc1Br Amb33388170 [0,0,0,0,0,0|4,0,0]=4 494 B11R1.17 O=C=NCc1ncccc1Br Amb33336040 [0,0,0,0,0,0|4,0,0]=4 495 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,0,0,0,0,0|2,0,0]=2 496 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,0,0,0,0,0|2,1,0]=3 497 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,0,0,0,0,0|2,1,0]=3 498 B11R1.17 O=CCCc1ccccc1O Amb22228954 [0,0,0,0,0,0|3,0,0]=3 499 B11R1.17 O=CCCc1cccnc1Br Amb33388081 [0,0,0,0,0,0|3,0,0]=3 500 B11R1.17 O=CCCc1cccnc1Cl Amb33052730 [0,0,0,0,0,0|3,1,0]=4 501 B11R1.17 O=CCCc1cccnc1F Amb33377143 [0,0,0,0,0,0|3,1,0]=4 502 B11R1.17 O=CCCc1ccncc1Br Amb33243315 [0,0,0,0,0,0|3,0,0]=3 503 B11R1.17 O=CCCc1ccncc1Cl Amb27617324 [0,0,0,0,0,0|3,1,0]=4 504 B11R1.17 O=CCCc1ccncc1F Amb25677089 [0,0,0,0,0,0|3,1,0]=4 505 B11R1.17 O=CCCc1ncccc1Br Amb27153362 [0,0,0,0,0,0|3,0,0]=3 506 B11R1.17 O=CCCc1ncccc1F Amb27878559 [0,0,0,0,0,0|3,1,0]=4 507 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,0,0,0,0,0|3,0,0]=3 508 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [0,0,0,0,0,0|3,1,0]=4 509 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,0,0,0,0,0|3,1,0]=4 510 B11R1.17 O=CCOc1ccccc1I Amb27871520 [0,0,0,0,0,0|3,1,0]=4 511 B11R1.17 O=CCOc1ccccc1O Amb27176428 [0,0,0,0,0,0|4,0,0]=4 512 B11R1.17 O=CCSc1ccccc1Br Amb26008308 [0,0,0,0,0,0|3,0,0]=3 513 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,0,0,0,0,0|3,1,0]=4 514 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,0,0,0,0,0|3,1,0]=4 515 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,0,0,0,0,0|3,1,0]=4 516 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,0,0,0,0,0|2,0,2]=4 517 B11R1.17 OCC#Cc1ccccc1Br Amb836727 [0,0,0,0,0,0|2,0,2]=4 518 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,0,0,0,0,0|2,0,0]=2 519 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,0,0,0,0,0|2,1,0]=3 520 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,0,0,0,0,0|2,1,0]=3 521 B11R1.17 OCCCc1ccccc1I Amb27246348 [0,0,0,0,0,0|2,1,0]=3 522 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,0,0,0,0,0|3,0,0]=3 523 B11R1.17 OCCCc1cccnc1Br Amb33388120 [0,0,0,0,0,0|3,0,0]=3 524 B11R1.17 OCCCc1cccnc1Cl Amb32668114 [0,0,0,0,0,0|3,1,0]=4 525 B11R1.17 OCCCc1cccnc1F Amb33377128 [0,0,0,0,0,0|3,1,0]=4 526 B11R1.17 OCCCc1ccncc1Br Amb26577096 [0,0,0,0,0,0|3,0,0]=3 527 B11R1.17 OCCCc1ccncc1Cl Amb23596495 [0,0,0,0,0,0|3,1,0]=4 528 B11R1.17 OCCCc1ccncc1F Amb25825625 [0,0,0,0,0,0|3,1,0]=4 529 B11R1.17 OCCCc1ccncc1O Amb27803932 [0,0,0,0,0,0|4,0,0]=4 530 B11R1.17 OCCCc1cnccc1O Amb13889999 [0,0,0,0,0,0|4,0,0]=4 531 B11R1.17 OCCCc1ncccc1Br Amb25273165 [0,0,0,0,0,0|3,0,0]=3 532 B11R1.17 OCCCc1ncccc1Cl Amb32944661 [0,0,0,0,0,0|3,1,0]=4 533 B11R1.17 OCCCc1ncccc1F Amb33418423 [0,0,0,0,0,0|3,1,0]=4 534 B11R1.17 OCCCc1ncccc1O Amb18125538 [0,0,0,0,0,0|4,0,0]=4 535 B11R1.17 OCCNc1ccccc1Br Amb6712178 [0,0,0,0,0,0|3,0,0]=3 536 B11R1.17 OCCNc1ccccc1Cl Amb6712397 [0,0,0,0,0,0|3,1,0]=4 537 B11R1.17 OCCNc1ccccc1F Amb6712587 [0,0,0,0,0,0|3,1,0]=4 538 B11R1.17 OCCNc1ccncc1Br Amb27766939 [0,0,0,0,0,0|4,0,0]=4 539 B11R1.17 OCCNc1ncccc1Br Amb18292072 [0,0,0,0,0,0|4,0,0]=4 540 B11R1.17 OCCOc1ccccc1Br Amb6702414 [0,0,0,0,0,0|3,0,0]=3 541 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,0,0,0,0,0|3,1,0]=4 542 B11R1.17 OCCOc1ccccc1F Amb9370651 [0,0,0,0,0,0|3,1,0]=4 543 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,0,0,0,0,0|3,1,0]=4 544 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,0,0,0,0,0|4,0,0]=4 545 B11R1.17 OCCOc1ncccc1Br Amb23598436 [0,0,0,0,0,0|4,0,0]=4 546 B11R1.17 OCCSc1ccccc1Br Amb2685464 [0,0,0,0,0,0|3,0,0]=3 547 B11R1.17 OCCSc1ccccc1Cl Amb2686420 [0,0,0,0,0,0|3,1,0]=4 548 B11R1.17 OCCSc1ccccc1F Amb2688392 [0,0,0,0,0,0|3,1,0]=4 549 B11R1.17 OCCSc1ccccc1O Amb18177935 [0,0,0,0,0,0|4,0,0]=4 550 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [0,0,0,0,0,0|2,0,2]=4 551 B11R1.17 Oc1ccccc1CCCBr Amb27667946 [0,0,0,0,0,0|3,0,0]=3 552 B11R1.17 Oc1ccccc1CCCCl Amb17477721 [0,0,0,0,0,0|3,0,0]=3 553 B11R1.17 Oc1ccccc1CCCS Amb26040563 [0,0,0,0,0,0|3,0,0]=3 554 B11R1.17 Oc1ccccc1OCCCl Amb27595619 [0,0,0,0,0,0|4,0,0]=4 555 B11R1.17 Oc1ccccc1OCCF Amb27601772 [0,0,0,0,0,0|4,0,0]=4 556 B11R1.17 S=C=NCc1ccccc1Br Amb24402120 [0,0,0,0,0,0|3,0,0]=3 557 B11R1.17 S=C=NCc1ccccc1Cl Amb2685778 [0,0,0,0,0,0|3,1,0]=4 558 B11R1.17 S=C=NCc1ccccc1I Amb27402469 [0,0,0,0,0,0|3,1,0]=4 559 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,0,0,0,0,0|2,0,0]=2 560 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,0,0,0,0,0|2,1,0]=3 561 B11R1.17 SCCCc1cccnc1Br Amb33388138 [0,0,0,0,0,0|3,0,0]=3 562 B11R1.17 SCCCc1cccnc1Cl Amb33263115 [0,0,0,0,0,0|3,1,0]=4 563 B11R1.17 SCCCc1ccncc1Br Amb33388696 [0,0,0,0,0,0|3,0,0]=3 564 B11R1.17 SCCCc1ccncc1Cl Amb33413849 [0,0,0,0,0,0|3,1,0]=4 565 B11R1.17 SCCCc1ncccc1Br Amb33336399 [0,0,0,0,0,0|3,0,0]=3 566 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,0,0,0,0,0|3,0,0]=3 567 B11R1.17 SCCOc1ccccc1Cl Amb6255607 [0,0,0,0,0,0|3,1,0]=4 568 B11R1.17 SCCOc1ccccc1I Amb27761382 [0,0,0,0,0,0|3,1,0]=4 569 B11R1.17 SCCSc1ccccc1Cl Amb27588702 [0,0,0,0,0,0|3,1,0]=4 570 B11R1.17 [C-]#[N+]CCc1ccccc1Br Amb33387614 [0,0,0,0,0,0|0,0,2]=2 571 B11R1.17 [C-]#[N+]CCc1ccccc1C Amb2689592 [0,0,0,0,0,0|1,0,2]=3 572 B11R1.17 [C-]#[N+]CCc1ccccc1Cl Amb2686344 [0,0,0,0,0,0|0,1,2]=3 573 B11R1.17 [C-]#[N+]CCc1ccccc1F Amb2688285 [0,0,0,0,0,0|0,1,2]=3 574 B11R1.17 [C-]#[N+]CCc1cccnc1Br Amb33387838 [0,0,0,0,0,0|1,0,2]=3 575 B11R1.17 [C-]#[N+]CCc1cccnc1C Amb32879578 [0,0,0,0,0,0|2,0,2]=4 576 B11R1.17 [C-]#[N+]CCc1cccnc1Cl Amb33257011 [0,0,0,0,0,0|1,1,2]=4 577 B11R1.17 [C-]#[N+]CCc1cccnc1F Amb33377938 [0,0,0,0,0,0|1,1,2]=4 578 B11R1.17 [C-]#[N+]CCc1ccncc1Br Amb33388195 [0,0,0,0,0,0|1,0,2]=3 579 B11R1.17 [C-]#[N+]CCc1ccncc1C Amb33414474 [0,0,0,0,0,0|2,0,2]=4 580 B11R1.17 [C-]#[N+]CCc1ccncc1Cl Amb33413756 [0,0,0,0,0,0|1,1,2]=4 581 B11R1.17 [C-]#[N+]CCc1ccncc1F Amb33317678 [0,0,0,0,0,0|1,1,2]=4 582 B11R1.17 [C-]#[N+]CCc1cnccc1C Amb33377025 [0,0,0,0,0,0|2,0,2]=4 583 B11R1.17 [C-]#[N+]CCc1ncccc1Br Amb33336055 [0,0,0,0,0,0|1,0,2]=3 584 B11R1.17 [C-]#[N+]CCc1ncccc1C Amb33428995 [0,0,0,0,0,0|2,0,2]=4 585 B11R1.17 [C-]#[N+]CCc1ncccc1F Amb33419155 [0,0,0,0,0,0|1,1,2]=4 586 B11R1.17 [N-]=[N+]=NCc1ccccc1Br Amb8938157 [0,0,0,0,0,0|2,0,1]=3 587 B11R1.17 [N-]=[N+]=NCc1ccccc1Cl Amb8938161 [0,0,0,0,0,0|2,1,1]=4 588 B11R1.17 [N-]=[N+]=NCc1ccccc1F Amb8938165 [0,0,0,0,0,0|2,1,1]=4 589 B11R1.17 [N-]=[N+]=NCc1ccccc1I Amb27194978 [0,0,0,0,0,0|2,1,1]=4 590 B11R1.17 [N-]=[N+]=NCc1ccccc1N Amb27849788 [0,0,0,0,0,0|3,0,1]=4 591 B11R1.17 [N-]=[N+]=NCc1ccccc1O Amb26034413 [0,0,0,0,0,0|3,0,1]=4 592 B11R1.17 [N-]=[N+]=NCc1cccnc1Br Amb33387845 [0,0,0,0,0,0|3,0,1]=4 593 B11R1.17 [N-]=[N+]=NCc1ccncc1Br Amb33241886 [0,0,0,0,0,0|3,0,1]=4 594 B11R1.17 [N-]=[N+]=NCc1ncccc1Br Amb27840017 [0,0,0,0,0,0|3,0,1]=4 595 B11R1.17 [O-][n+]1ccccc1CCCO Amb28384875 [0,0,0,0,0,0|4,0,0]=4 596 B10R1.4 BrCCc1ccccc1Br Amb19515770 [1,0,0,0,0,0|1,0,0]=2 597 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,0,0,0,0,0|1,1,0]=3 598 B10R1.4 BrCCc1cccnc1Br Amb33389472 [1,0,0,0,0,0|2,0,0]=3 599 B10R1.4 BrCCc1ccncc1Br Amb33242646 [1,0,0,0,0,0|2,0,0]=3 600 B10R1.4 BrCCc1ncccc1Br Amb33242278 [1,0,0,0,0,0|2,0,0]=3 601 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,0,0,0,0,0|1,0,2]=4 602 B10R1.4 Brc1ccccc1C#CI Amb27642043 [1,0,0,0,0,0|1,0,2]=4 603 B10R1.4 Brc1ccccc1\C=C\I Amb27843450 [1,0,0,0,0,0|1,0,2]=4 604 B10R1.4 C#CCc1ccccc1Br Amb33451964 [1,0,0,0,0,0|0,0,2]=3 605 B10R1.4 C#CCc1ccccc1C Amb33449990 [1,0,0,0,0,0|1,0,2]=4 606 B10R1.4 C#CCc1ccccc1Cl Amb33052524 [1,0,0,0,0,0|0,1,2]=4 607 B10R1.4 C#CCc1ccccc1F Amb33456146 [1,0,0,0,0,0|0,1,2]=4 608 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,0,0,0,0,0|1,0,2]=4 609 B10R1.4 C#CCc1cccnc1Br Amb33387814 [1,0,0,0,0,0|1,0,2]=4 610 B10R1.4 C#CCc1ccncc1Br Amb33388598 [1,0,0,0,0,0|1,0,2]=4 611 B10R1.4 C#CCc1ncccc1Br Amb33336061 [1,0,0,0,0,0|1,0,2]=4 612 B10R1.4 C#NCc1ccccc1Br Amb31112144 [1,0,0,0,0,0|0,0,2]=3 613 B10R1.4 C#NCc1ccccc1C Amb31132458 [1,0,0,0,0,0|1,0,2]=4 614 B10R1.4 C#NCc1ccccc1Cl Amb31111982 [1,0,0,0,0,0|0,1,2]=4 615 B10R1.4 C#NCc1ccccc1F Amb31132461 [1,0,0,0,0,0|0,1,2]=4 616 B10R1.4 C=CCc1ccccc1Br Amb26451399 [1,0,0,0,0,0|0,0,2]=3 617 B10R1.4 C=CCc1ccccc1C Amb6298985 [1,0,0,0,0,0|1,0,2]=4 618 B10R1.4 C=CCc1ccccc1Cl Amb6298963 [1,0,0,0,0,0|0,1,2]=4 619 B10R1.4 C=CCc1ccccc1F Amb6299090 [1,0,0,0,0,0|0,1,2]=4 620 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,0,0,0,0,0|1,0,2]=4 621 B10R1.4 C=CCc1ccncc1Br Amb27483136 [1,0,0,0,0,0|1,0,2]=4 622 B10R1.4 CC#Cc1ccccc1Cl Amb28384813 [1,0,0,0,0,0|0,1,2]=4 623 B10R1.4 CC#Cc1ccncc1Br Amb27186151 [1,0,0,0,0,0|1,0,2]=4 624 B10R1.4 CCCN1C=CC=CC1=O Amb22730334 [1,0,0,0,0,0|2,0,0]=3 625 B10R1.4 CCCN1C=CC=CC1=S Amb24480486 [1,0,0,0,0,0|2,0,0]=3 626 B10R1.4 CCCN1C=CN=CC1=O Amb28047193 [1,0,0,0,0,0|3,0,0]=4 627 B10R1.4 CCCc1ccccc1Br Amb26623759 [1,0,0,0,0,0|0,0,0]=1 628 B10R1.4 CCCc1ccccc1C Amb22227985 [1,0,0,0,0,0|1,0,0]=2 629 B10R1.4 CCCc1ccccc1Cl Amb28049677 [1,0,0,0,0,0|0,1,0]=2 630 B10R1.4 CCCc1ccccc1I Amb20622716 [1,0,0,0,0,0|0,1,0]=2 631 B10R1.4 CCCc1ccccc1N Amb2724372 [1,0,0,0,0,0|1,0,0]=2 632 B10R1.4 CCCc1ccccc1O Amb2726171 [1,0,0,0,0,0|1,0,0]=2 633 B10R1.4 CCCc1ccccc1S Amb32688038 [1,0,0,0,0,0|1,0,0]=2 634 B10R1.4 CCCc1cccnc1Br Amb24319271 [1,0,0,0,0,0|1,0,0]=2 635 B10R1.4 CCCc1cccnc1Cl Amb24319272 [1,0,0,0,0,0|1,1,0]=3 636 B10R1.4 CCCc1cccnc1N Amb8386852 [1,0,0,0,0,0|2,0,0]=3 637 B10R1.4 CCCc1cccnc1O Amb24319273 [1,0,0,0,0,0|2,0,0]=3 638 B10R1.4 CCCc1ccncc1Br Amb24320559 [1,0,0,0,0,0|1,0,0]=2 639 B10R1.4 CCCc1ccncc1N Amb18203088 [1,0,0,0,0,0|2,0,0]=3 640 B10R1.4 CCCc1cnccc1Br Amb20617515 [1,0,0,0,0,0|1,0,0]=2 641 B10R1.4 CCCc1cnccc1C Amb26366029 [1,0,0,0,0,0|2,0,0]=3 642 B10R1.4 CCCc1cnccc1N Amb22522169 [1,0,0,0,0,0|2,0,0]=3 643 B10R1.4 CCCc1cnccc1O Amb33189019 [1,0,0,0,0,0|2,0,0]=3 644 B10R1.4 CCCc1cncnc1Br Amb24323117 [1,0,0,0,0,0|2,0,0]=3 645 B10R1.4 CCCc1cncnc1Cl Amb10607977 [1,0,0,0,0,0|2,1,0]=4 646 B10R1.4 CCCc1cncnc1N Amb25756869 [1,0,0,0,0,0|3,0,0]=4 647 B10R1.4 CCCc1ncccc1Br Amb24320669 [1,0,0,0,0,0|1,0,0]=2 648 B10R1.4 CCCc1ncccc1C Amb28293496 [1,0,0,0,0,0|2,0,0]=3 649 B10R1.4 CCCc1ncccc1Cl Amb27968734 [1,0,0,0,0,0|1,1,0]=3 650 B10R1.4 CCCc1ncccc1N Amb18832434 [1,0,0,0,0,0|2,0,0]=3 651 B10R1.4 CCCc1ncccc1O Amb24320670 [1,0,0,0,0,0|2,0,0]=3 652 B10R1.4 CCCc1nccnc1Br Amb27958765 [1,0,0,0,0,0|2,0,0]=3 653 B10R1.4 CCCc1nccnc1C Amb8515907 [1,0,0,0,0,0|3,0,0]=4 654 B10R1.4 CCCc1nccnc1Cl Amb27955319 [1,0,0,0,0,0|2,1,0]=4 655 B10R1.4 CCCc1nccnc1F Amb35598360 [1,0,0,0,0,0|2,1,0]=4 656 B10R1.4 CCCc1nccnc1I Amb35598358 [1,0,0,0,0,0|2,1,0]=4 657 B10R1.4 CCCc1nccnc1N Amb27393644 [1,0,0,0,0,0|3,0,0]=4 658 B10R1.4 CCCc1nccnc1O Amb18643252 [1,0,0,0,0,0|3,0,0]=4 659 B10R1.4 CCCc1nccnc1S Amb35602544 [1,0,0,0,0,0|3,0,0]=4 660 B10R1.4 CCCc1ncncc1Br Amb10068152 [1,0,0,0,0,0|2,0,0]=3 661 B10R1.4 CCNc1ccccc1Br Amb6696453 [1,0,0,0,0,0|1,0,0]=2 662 B10R1.4 CCNc1ccccc1C Amb4037021 [1,0,0,0,0,0|2,0,0]=3 663 B10R1.4 CCNc1ccccc1Cl Amb32651858 [1,0,0,0,0,0|1,1,0]=3 664 B10R1.4 CCNc1ccccc1Cl Amb4313295 [1,0,0,0,0,0|1,1,0]=3 665 B10R1.4 CCNc1ccccc1F Amb2688341 [1,0,0,0,0,0|1,1,0]=3 666 B10R1.4 CCNc1ccccc1I Amb9203660 [1,0,0,0,0,0|1,1,0]=3 667 B10R1.4 CCNc1ccccc1N Amb29847532 [1,0,0,0,0,0|2,0,0]=3 668 B10R1.4 CCNc1ccccc1N Amb7767530 [1,0,0,0,0,0|2,0,0]=3 669 B10R1.4 CCNc1ccccc1O Amb18643152 [1,0,0,0,0,0|2,0,0]=3 670 B10R1.4 CCNc1cccnc1Br Amb27616234 [1,0,0,0,0,0|2,0,0]=3 671 B10R1.4 CCNc1cccnc1C Amb27224954 [1,0,0,0,0,0|3,0,0]=4 672 B10R1.4 CCNc1cccnc1F Amb35725079 [1,0,0,0,0,0|2,1,0]=4 673 B10R1.4 CCNc1cccnc1N Amb23557979 [1,0,0,0,0,0|3,0,0]=4 674 B10R1.4 CCNc1cccnc1O Amb30633550 [1,0,0,0,0,0|3,0,0]=4 675 B10R1.4 CCNc1ccncc1Br Amb28386593 [1,0,0,0,0,0|2,0,0]=3 676 B10R1.4 CCNc1ccncc1N Amb9205237 [1,0,0,0,0,0|3,0,0]=4 677 B10R1.4 CCNc1cnccc1C Amb26957116 [1,0,0,0,0,0|3,0,0]=4 678 B10R1.4 CCNc1cnccc1C Amb28555476 [1,0,0,0,0,0|3,0,0]=4 679 B10R1.4 CCNc1ncccc1Br Amb18955277 [1,0,0,0,0,0|2,0,0]=3 680 B10R1.4 CCNc1ncccc1C Amb33529830 [1,0,0,0,0,0|3,0,0]=4 681 B10R1.4 CCNc1ncccc1F Amb18963791 [1,0,0,0,0,0|2,1,0]=4 682 B10R1.4 CCNc1ncccc1N Amb10609970 [1,0,0,0,0,0|3,0,0]=4 683 B10R1.4 CCNc1ncccc1N Amb8630465 [1,0,0,0,0,0|3,0,0]=4 684 B10R1.4 CCNc1nnccc1Br Amb25849945 [1,0,0,0,0,0|3,0,0]=4 685 B10R1.4 CCOC1=CC=CNC1=O Amb18537475 [1,0,0,0,0,0|3,0,0]=4 686 B10R1.4 CCON1C=CC=CC1=S Amb25257642 [1,0,0,0,0,0|3,0,0]=4 687 B10R1.4 CCOc1ccccc1Br Amb4010257 [1,0,0,0,0,0|1,0,0]=2 688 B10R1.4 CCOc1ccccc1C Amb9787457 [1,0,0,0,0,0|2,0,0]=3 689 B10R1.4 CCOc1ccccc1Cl Amb9787476 [1,0,0,0,0,0|1,1,0]=3 690 B10R1.4 CCOc1ccccc1F Amb2688288 [1,0,0,0,0,0|1,1,0]=3 691 B10R1.4 CCOc1ccccc1I Amb19888234 [1,0,0,0,0,0|1,1,0]=3 692 B10R1.4 CCOc1ccccc1N Amb840072 [1,0,0,0,0,0|2,0,0]=3 693 B10R1.4 CCOc1ccccc1O Amb3939539 [1,0,0,0,0,0|2,0,0]=3 694 B10R1.4 CCOc1ccccc1S Amb20242711 [1,0,0,0,0,0|2,0,0]=3 695 B10R1.4 CCOc1cccnc1Br Amb33547876 [1,0,0,0,0,0|2,0,0]=3 696 B10R1.4 CCOc1cccnc1C Amb24057152 [1,0,0,0,0,0|3,0,0]=4 697 B10R1.4 CCOc1cccnc1Cl Amb9175211 [1,0,0,0,0,0|2,1,0]=4 698 B10R1.4 CCOc1cccnc1F Amb26359800 [1,0,0,0,0,0|2,1,0]=4 699 B10R1.4 CCOc1cccnc1I Amb25681793 [1,0,0,0,0,0|2,1,0]=4 700 B10R1.4 CCOc1cccnc1N Amb1102343 [1,0,0,0,0,0|3,0,0]=4 701 B10R1.4 CCOc1ccncc1Br Amb8438924 [1,0,0,0,0,0|2,0,0]=3 702 B10R1.4 CCOc1ccncc1F Amb2610080 [1,0,0,0,0,0|2,1,0]=4 703 B10R1.4 CCOc1ccncc1I Amb24536249 [1,0,0,0,0,0|2,1,0]=4 704 B10R1.4 CCOc1ccncc1N Amb7765083 [1,0,0,0,0,0|3,0,0]=4 705 B10R1.4 CCOc1cnccc1C Amb27810354 [1,0,0,0,0,0|3,0,0]=4 706 B10R1.4 CCOc1cnccc1N Amb21857560 [1,0,0,0,0,0|3,0,0]=4 707 B10R1.4 CCOc1ncccc1Br Amb20242466 [1,0,0,0,0,0|2,0,0]=3 708 B10R1.4 CCOc1ncccc1Cl Amb8439534 [1,0,0,0,0,0|2,1,0]=4 709 B10R1.4 CCOc1ncccc1I Amb6565054 [1,0,0,0,0,0|2,1,0]=4 710 B10R1.4 CCOc1ncccc1N Amb1136817 [1,0,0,0,0,0|3,0,0]=4 711 B10R1.4 CCOc1ncccc1O Amb19895105 [1,0,0,0,0,0|3,0,0]=4 712 B10R1.4 CCOc1nccnc1Br Amb24524317 [1,0,0,0,0,0|3,0,0]=4 713 B10R1.4 CCOc1ncncc1Br Amb27215130 [1,0,0,0,0,0|3,0,0]=4 714 B10R1.4 CCPc1ccccc1N Amb27637691 [1,0,0,0,0,0|2,0,0]=3 715 B10R1.4 CCSC1=CC=CNC1=O Amb24478310 [1,0,0,0,0,0|3,0,0]=4 716 B10R1.4 CCSc1cccc[n+]1[O-] Amb26887542 [1,0,0,0,0,0|3,0,0]=4 717 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,0,0,0,0,0|1,0,0]=2 718 B10R1.4 CCSc1ccccc1C Amb27259108 [1,0,0,0,0,0|2,0,0]=3 719 B10R1.4 CCSc1ccccc1Cl Amb26500521 [1,0,0,0,0,0|1,1,0]=3 720 B10R1.4 CCSc1ccccc1F Amb24480376 [1,0,0,0,0,0|1,1,0]=3 721 B10R1.4 CCSc1ccccc1N Amb10609429 [1,0,0,0,0,0|2,0,0]=3 722 B10R1.4 CCSc1ccccc1N Amb6281496 [1,0,0,0,0,0|2,0,0]=3 723 B10R1.4 CCSc1ccccc1O Amb33529393 [1,0,0,0,0,0|2,0,0]=3 724 B10R1.4 CCSc1ccncc1Br Amb27975336 [1,0,0,0,0,0|2,0,0]=3 725 B10R1.4 CCSc1ccncc1C Amb28386407 [1,0,0,0,0,0|3,0,0]=4 726 B10R1.4 CCSc1ncccc1Br Amb25075348 [1,0,0,0,0,0|2,0,0]=3 727 B10R1.4 CCSc1ncccc1C Amb26861471 [1,0,0,0,0,0|3,0,0]=4 728 B10R1.4 CCSc1ncccc1I Amb32411437 [1,0,0,0,0,0|2,1,0]=4 729 B10R1.4 CCSc1ncccc1N Amb6680288 [1,0,0,0,0,0|3,0,0]=4 730 B10R1.4 CCSc1ncccc1O Amb10552831 [1,0,0,0,0,0|3,0,0]=4 731 B10R1.4 CNCC1=CC=CNC1=O Amb18260767 [1,0,0,0,0,0|2,0,0]=3 732 B10R1.4 CNCc1cccc[n+]1[O-] Amb27237288 [1,0,0,0,0,0|2,0,0]=3 733 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,0,0,0,0,0|0,0,0]=1 734 B10R1.4 CNCc1ccccc1C Amb1648007 [1,0,0,0,0,0|1,0,0]=2 735 B10R1.4 CNCc1ccccc1C Amb6865246 [1,0,0,0,0,0|1,0,0]=2 736 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,0,0,0,0,0|0,1,0]=2 737 B10R1.4 CNCc1ccccc1F Amb10609411 [1,0,0,0,0,0|0,1,0]=2 738 B10R1.4 CNCc1ccccc1F Amb1675335 [1,0,0,0,0,0|0,1,0]=2 739 B10R1.4 CNCc1ccccc1N Amb20239390 [1,0,0,0,0,0|1,0,0]=2 740 B10R1.4 CNCc1ccccc1N Amb7173572 [1,0,0,0,0,0|1,0,0]=2 741 B10R1.4 CNCc1ccccc1O Amb1113119 [1,0,0,0,0,0|1,0,0]=2 742 B10R1.4 CNCc1ccccc1O Amb7969802 [1,0,0,0,0,0|1,0,0]=2 743 B10R1.4 CNCc1cccnc1Br Amb25747185 [1,0,0,0,0,0|1,0,0]=2 744 B10R1.4 CNCc1cccnc1C Amb18216945 [1,0,0,0,0,0|2,0,0]=3 745 B10R1.4 CNCc1cccnc1Cl Amb10975541 [1,0,0,0,0,0|1,1,0]=3 746 B10R1.4 CNCc1cccnc1Cl Amb21967911 [1,0,0,0,0,0|1,1,0]=3 747 B10R1.4 CNCc1cccnc1F Amb28050213 [1,0,0,0,0,0|1,1,0]=3 748 B10R1.4 CNCc1ccncc1Br Amb23412258 [1,0,0,0,0,0|1,0,0]=2 749 B10R1.4 CNCc1ccncc1C Amb10607510 [1,0,0,0,0,0|2,0,0]=3 750 B10R1.4 CNCc1ccncc1C Amb8503308 [1,0,0,0,0,0|2,0,0]=3 751 B10R1.4 CNCc1ccncc1Cl Amb27803881 [1,0,0,0,0,0|1,1,0]=3 752 B10R1.4 CNCc1ccncc1F Amb24398098 [1,0,0,0,0,0|1,1,0]=3 753 B10R1.4 CNCc1cnccc1C Amb33547389 [1,0,0,0,0,0|2,0,0]=3 754 B10R1.4 CNCc1cnccc1F Amb27806993 [1,0,0,0,0,0|1,1,0]=3 755 B10R1.4 CNCc1cnccc1N Amb27226567 [1,0,0,0,0,0|2,0,0]=3 756 B10R1.4 CNCc1cncnc1C Amb26980689 [1,0,0,0,0,0|3,0,0]=4 757 B10R1.4 CNCc1cncnc1N Amb28126832 [1,0,0,0,0,0|3,0,0]=4 758 B10R1.4 CNCc1ncccc1Br Amb28059958 [1,0,0,0,0,0|1,0,0]=2 759 B10R1.4 CNCc1ncccc1C Amb3941175 [1,0,0,0,0,0|2,0,0]=3 760 B10R1.4 CNCc1ncccc1Cl Amb26329059 [1,0,0,0,0,0|1,1,0]=3 761 B10R1.4 CNCc1ncccc1F Amb2723488 [1,0,0,0,0,0|1,1,0]=3 762 B10R1.4 CNCc1ncccc1O Amb27643801 [1,0,0,0,0,0|2,0,0]=3 763 B10R1.4 CN\C=C1\C=CN=CC1=O Amb26391014 [1,0,0,0,0,0|2,0,1]=4 764 B10R1.4 COCc1ccccc1Br Amb8517636 [1,0,0,0,0,0|1,0,0]=2 765 B10R1.4 COCc1ccccc1Cl Amb27425949 [1,0,0,0,0,0|1,1,0]=3 766 B10R1.4 COCc1ccccc1F Amb28050262 [1,0,0,0,0,0|1,1,0]=3 767 B10R1.4 COCc1ccccc1I Amb19373361 [1,0,0,0,0,0|1,1,0]=3 768 B10R1.4 COCc1ccccc1N Amb6249470 [1,0,0,0,0,0|2,0,0]=3 769 B10R1.4 COCc1ccccc1O Amb22751673 [1,0,0,0,0,0|2,0,0]=3 770 B10R1.4 COCc1cccnc1N Amb18961776 [1,0,0,0,0,0|3,0,0]=4 771 B10R1.4 COCc1ccncc1Br Amb24479286 [1,0,0,0,0,0|2,0,0]=3 772 B10R1.4 COCc1ccncc1S Amb27199279 [1,0,0,0,0,0|3,0,0]=4 773 B10R1.4 COCc1ncncc1Br Amb18676799 [1,0,0,0,0,0|3,0,0]=4 774 B10R1.4 CSCN1C=CC=CC1=S Amb24502171 [1,0,0,0,0,0|3,0,0]=4 775 B10R1.4 CSCc1ccccc1Br Amb4012755 [1,0,0,0,0,0|1,0,0]=2 776 B10R1.4 CSCc1ccccc1Cl Amb27600716 [1,0,0,0,0,0|1,1,0]=3 777 B10R1.4 CSCc1ccccc1F Amb27146597 [1,0,0,0,0,0|1,1,0]=3 778 B10R1.4 CSCc1ccccc1I Amb26472202 [1,0,0,0,0,0|1,1,0]=3 779 B10R1.4 CSCc1ccccc1N Amb18951025 [1,0,0,0,0,0|2,0,0]=3 780 B10R1.4 CSCc1ccccc1O Amb18125792 [1,0,0,0,0,0|2,0,0]=3 781 B10R1.4 CSCc1ccncc1C Amb27851528 [1,0,0,0,0,0|3,0,0]=4 782 B10R1.4 CSCc1cnccc1O Amb27962918 [1,0,0,0,0,0|3,0,0]=4 783 B10R1.4 C[n+]1ccccc1CCO Amb27173561 [1,0,0,0,0,0|3,0,0]=4 784 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,0,0,0,0,0|0,1,2]=4 785 B10R1.4 C\C=C\c1ccccc1O Amb3372048 [1,0,0,0,0,0|1,0,2]=4 786 B10R1.4 C\C=C\c1ccncc1Br Amb26051337 [1,0,0,0,0,0|1,0,2]=4 787 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,0,0,0,0,0|2,0,1]=4 788 B10R1.4 C\N=C\c1ccccc1N Amb27619729 [1,0,0,0,0,0|1,0,2]=4 789 B10R1.4 Cc1ccccc1CC#N Amb1651450 [1,0,0,0,0,0|1,0,2]=4 790 B10R1.4 Cc1ccccc1CC=O Amb10844840 [1,0,0,0,0,0|2,0,1]=4 791 B10R1.4 Cc1ccccc1CCBr Amb2685163 [1,0,0,0,0,0|2,0,0]=3 792 B10R1.4 Cc1ccccc1CCCl Amb9004323 [1,0,0,0,0,0|2,0,0]=3 793 B10R1.4 Cc1ccccc1CCI Amb27246006 [1,0,0,0,0,0|2,0,0]=3 794 B10R1.4 Cc1ccccc1CCN Amb1212557 [1,0,0,0,0,0|1,0,0]=2 795 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,0,0,0,0,0|1,0,0]=2 796 B10R1.4 Cc1ccccc1CCO Amb3939095 [1,0,0,0,0,0|2,0,0]=3 797 B10R1.4 Cc1ccccc1CCS Amb17399938 [1,0,0,0,0,0|2,0,0]=3 798 B10R1.4 Cc1ccccc1CNN Amb1118964 [1,0,0,0,0,0|2,0,0]=3 799 B10R1.4 Cc1ccccc1CNN Amb6892665 [1,0,0,0,0,0|2,0,0]=3 800 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,0,0,0,0,0|2,0,0]=3 801 B10R1.4 Cc1ccccc1CON Amb17091424 [1,0,0,0,0,0|2,0,0]=3 802 B10R1.4 Cc1ccccc1CON Amb33715629 [1,0,0,0,0,0|2,0,0]=3 803 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,0,0,0,0,0|3,0,0]=4 804 B10R1.4 Cc1ccccc1OCCl Amb27494113 [1,0,0,0,0,0|3,0,0]=4 805 B10R1.4 Cc1cccnc1CCBr Amb24641164 [1,0,0,0,0,0|3,0,0]=4 806 B10R1.4 Cc1cccnc1CCI Amb35711451 [1,0,0,0,0,0|3,0,0]=4 807 B10R1.4 Cc1cccnc1CCN Amb1995200 [1,0,0,0,0,0|2,0,0]=3 808 B10R1.4 Cc1cccnc1CCN Amb32662795 [1,0,0,0,0,0|2,0,0]=3 809 B10R1.4 Cc1cccnc1CCN Amb32664156 [1,0,0,0,0,0|2,0,0]=3 810 B10R1.4 Cc1cccnc1CCO Amb2694545 [1,0,0,0,0,0|3,0,0]=4 811 B10R1.4 Cc1cccnc1CCS Amb33361011 [1,0,0,0,0,0|3,0,0]=4 812 B10R1.4 Cc1cccnc1CNN Amb27768852 [1,0,0,0,0,0|3,0,0]=4 813 B10R1.4 Cc1cccnc1CNO Amb33429076 [1,0,0,0,0,0|3,0,0]=4 814 B10R1.4 Cc1cccnc1CON Amb25684335 [1,0,0,0,0,0|3,0,0]=4 815 B10R1.4 Cc1ccncc1CCBr Amb24693233 [1,0,0,0,0,0|3,0,0]=4 816 B10R1.4 Cc1ccncc1CCCl Amb27875306 [1,0,0,0,0,0|3,0,0]=4 817 B10R1.4 Cc1ccncc1CCN Amb18832435 [1,0,0,0,0,0|2,0,0]=3 818 B10R1.4 Cc1ccncc1CCO Amb27467536 [1,0,0,0,0,0|3,0,0]=4 819 B10R1.4 Cc1ccncc1CCS Amb33375261 [1,0,0,0,0,0|3,0,0]=4 820 B10R1.4 Cc1ccncc1CNN Amb25132682 [1,0,0,0,0,0|3,0,0]=4 821 B10R1.4 Cc1ccncc1CNO Amb25135601 [1,0,0,0,0,0|3,0,0]=4 822 B10R1.4 Cc1ccncc1CON Amb33376749 [1,0,0,0,0,0|3,0,0]=4 823 B10R1.4 Cc1cnccc1CCBr Amb24548352 [1,0,0,0,0,0|3,0,0]=4 824 B10R1.4 Cc1cnccc1CCN Amb22059435 [1,0,0,0,0,0|2,0,0]=3 825 B10R1.4 Cc1cnccc1CCO Amb26539673 [1,0,0,0,0,0|3,0,0]=4 826 B10R1.4 Cc1cnccc1CCS Amb25197336 [1,0,0,0,0,0|3,0,0]=4 827 B10R1.4 Cc1cnccc1CNN Amb26516871 [1,0,0,0,0,0|3,0,0]=4 828 B10R1.4 Cc1cnccc1CNO Amb26925533 [1,0,0,0,0,0|3,0,0]=4 829 B10R1.4 Cc1cnccc1CON Amb33079980 [1,0,0,0,0,0|3,0,0]=4 830 B10R1.4 Cc1ncccc1CCBr Amb33432583 [1,0,0,0,0,0|3,0,0]=4 831 B10R1.4 Cc1ncccc1CCN Amb18203091 [1,0,0,0,0,0|2,0,0]=3 832 B10R1.4 Cc1ncccc1CCO Amb24061576 [1,0,0,0,0,0|3,0,0]=4 833 B10R1.4 Cc1ncccc1CCS Amb32878314 [1,0,0,0,0,0|3,0,0]=4 834 B10R1.4 Cc1ncccc1CNN Amb24596259 [1,0,0,0,0,0|3,0,0]=4 835 B10R1.4 Cc1ncccc1CNO Amb32880816 [1,0,0,0,0,0|3,0,0]=4 836 B10R1.4 Cc1ncccc1CON Amb28144547 [1,0,0,0,0,0|3,0,0]=4 837 B10R1.4 Cc1nccnc1CCN Amb18832320 [1,0,0,0,0,0|3,0,0]=4 838 B10R1.4 Cc1ncncc1CCN Amb18832325 [1,0,0,0,0,0|3,0,0]=4 839 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,0,0,0,0,0|1,0,0]=2 840 B10R1.4 ClCCc1ccccc1Cl Amb8860565 [1,0,0,0,0,0|1,1,0]=3 841 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,0,0,0,0,0|1,1,0]=3 842 B10R1.4 ClCCc1cccnc1Cl Amb33329271 [1,0,0,0,0,0|2,1,0]=4 843 B10R1.4 ClCCc1ccncc1Cl Amb27615771 [1,0,0,0,0,0|2,1,0]=4 844 B10R1.4 ClCOc1ccccc1Br Amb26889271 [1,0,0,0,0,0|2,0,0]=3 845 B10R1.4 ClCOc1ccccc1Cl Amb22227923 [1,0,0,0,0,0|2,1,0]=4 846 B10R1.4 ClCOc1ccccc1I Amb28187723 [1,0,0,0,0,0|2,1,0]=4 847 B10R1.4 ClCSc1ccccc1Br Amb25887879 [1,0,0,0,0,0|2,0,0]=3 848 B10R1.4 ClCSc1ccccc1Cl Amb28137812 [1,0,0,0,0,0|2,1,0]=4 849 B10R1.4 ClCSc1ccccc1I Amb27641365 [1,0,0,0,0,0|2,1,0]=4 850 B10R1.4 ClCSc1ncccc1Br Amb25834865 [1,0,0,0,0,0|3,0,0]=4 851 B10R1.4 Cl[Zn]Cc1ccccc1Cl Amb22000427 [1,0,0,0,0,0|2,1,0]=4 852 B10R1.4 Clc1ccccc1CCBr Amb2685155 [1,0,0,0,0,0|1,1,0]=3 853 B10R1.4 Clc1cnccc1CCBr Amb25076266 [1,0,0,0,0,0|2,1,0]=4 854 B10R1.4 Clc1ncccc1CCBr Amb33389001 [1,0,0,0,0,0|2,1,0]=4 855 B10R1.4 FCCc1ccccc1I Amb22739042 [1,0,0,0,0,0|1,1,0]=3 856 B10R1.4 Fc1ccccc1CCBr Amb2685159 [1,0,0,0,0,0|1,1,0]=3 857 B10R1.4 Fc1ccccc1CCCl Amb8860569 [1,0,0,0,0,0|1,1,0]=3 858 B10R1.4 Fc1ccccc1CCI Amb28248386 [1,0,0,0,0,0|1,1,0]=3 859 B10R1.4 Fc1ccccc1CCS Amb17400004 [1,0,0,0,0,0|1,1,0]=3 860 B10R1.4 Fc1ccccc1C[Mg]Cl Amb6300393 [1,0,0,0,0,0|2,1,0]=4 861 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,0,0,0,0,0|2,1,0]=4 862 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,0,0,0,0,0|2,1,0]=4 863 B10R1.4 Fc1ccccc1SCCl Amb27447816 [1,0,0,0,0,0|2,1,0]=4 864 B10R1.4 Fc1cccnc1CCBr Amb33337356 [1,0,0,0,0,0|2,1,0]=4 865 B10R1.4 Fc1cccnc1CCS Amb33327466 [1,0,0,0,0,0|2,1,0]=4 866 B10R1.4 Fc1cnccc1CCBr Amb25172854 [1,0,0,0,0,0|2,1,0]=4 867 B10R1.4 Fc1cnccc1CCS Amb33316476 [1,0,0,0,0,0|2,1,0]=4 868 B10R1.4 Fc1ncccc1CCBr Amb33450421 [1,0,0,0,0,0|2,1,0]=4 869 B10R1.4 Fc1ncccc1CCS Amb33376783 [1,0,0,0,0,0|2,1,0]=4 870 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,0,0,0,0,0|0,0,2]=3 871 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,0,0,0,0,0|0,1,2]=4 872 B10R1.4 N#CCc1ccccc1F Amb2688304 [1,0,0,0,0,0|0,1,2]=4 873 B10R1.4 N#CCc1ccccc1I Amb3939789 [1,0,0,0,0,0|0,1,2]=4 874 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,0,0,0,0,0|1,0,2]=4 875 B10R1.4 N#CCc1ccccc1N Amb3997244 [1,0,0,0,0,0|1,0,2]=4 876 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,0,0,0,0,0|1,0,2]=4 877 B10R1.4 N#CCc1ccccc1S Amb27490861 [1,0,0,0,0,0|1,0,2]=4 878 B10R1.4 N#CCc1cccnc1Br Amb22751894 [1,0,0,0,0,0|1,0,2]=4 879 B10R1.4 N#CCc1ccncc1Br Amb20247907 [1,0,0,0,0,0|1,0,2]=4 880 B10R1.4 N#CCc1cnccc1Br Amb26944716 [1,0,0,0,0,0|1,0,2]=4 881 B10R1.4 N#CCc1ncccc1Br Amb18130371 [1,0,0,0,0,0|1,0,2]=4 882 B10R1.4 N#COc1ccccc1Br Amb27776524 [1,0,0,0,0,0|1,0,2]=4 883 B10R1.4 N#CSc1ccccc1Br Amb2685463 [1,0,0,0,0,0|1,0,2]=4 884 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,0,0,0,0,0|3,0,0]=4 885 B10R1.4 N=CCc1ccccc1N Amb27175164 [1,0,0,0,0,0|1,0,2]=4 886 B10R1.4 NCCN1C=CC=CC1=O Amb18535437 [1,0,0,0,0,0|2,0,0]=3 887 B10R1.4 NCCN1C=CC=CC1=O Amb19514535 [1,0,0,0,0,0|2,0,0]=3 888 B10R1.4 NCCN1C=CC=CC1=O Amb20668789 [1,0,0,0,0,0|2,0,0]=3 889 B10R1.4 NCCN1C=CC=NC1=O Amb18956968 [1,0,0,0,0,0|3,0,0]=4 890 B10R1.4 NCCN1C=CC=NC1=O Amb29083340 [1,0,0,0,0,0|3,0,0]=4 891 B10R1.4 NCCN1C=CC=NC1=O Amb31217497 [1,0,0,0,0,0|3,0,0]=4 892 B10R1.4 NCCN1C=NC=CC1=O Amb27476237 [1,0,0,0,0,0|3,0,0]=4 893 B10R1.4 NCCN1C=NC=CC1=O Amb28555481 [1,0,0,0,0,0|3,0,0]=4 894 B10R1.4 NCCN1N=CC=CC1=O Amb33540408 [1,0,0,0,0,0|3,0,0]=4 895 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,0,0,0,0,0|0,0,0]=1 896 B10R1.4 NCCc1ccccc1Br Amb4605963 [1,0,0,0,0,0|0,0,0]=1 897 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,0,0,0,0,0|0,1,0]=2 898 B10R1.4 NCCc1ccccc1Cl Amb2686343 [1,0,0,0,0,0|0,1,0]=2 899 B10R1.4 NCCc1ccccc1F Amb22039505 [1,0,0,0,0,0|0,1,0]=2 900 B10R1.4 NCCc1ccccc1F Amb421247 [1,0,0,0,0,0|0,1,0]=2 901 B10R1.4 NCCc1ccccc1I Amb27796258 [1,0,0,0,0,0|0,1,0]=2 902 B10R1.4 NCCc1ccccc1N Amb8631277 [1,0,0,0,0,0|1,0,0]=2 903 B10R1.4 NCCc1ccccc1N Amb8631278 [1,0,0,0,0,0|1,0,0]=2 904 B10R1.4 NCCc1ccccc1O Amb33549438 [1,0,0,0,0,0|1,0,0]=2 905 B10R1.4 NCCc1ccccc1O Amb6246475 [1,0,0,0,0,0|1,0,0]=2 906 B10R1.4 NCCc1cccnc1Br Amb25190186 [1,0,0,0,0,0|1,0,0]=2 907 B10R1.4 NCCc1cccnc1Cl Amb24551153 [1,0,0,0,0,0|1,1,0]=3 908 B10R1.4 NCCc1cccnc1Cl Amb33299325 [1,0,0,0,0,0|1,1,0]=3 909 B10R1.4 NCCc1cccnc1F Amb24062493 [1,0,0,0,0,0|1,1,0]=3 910 B10R1.4 NCCc1cccnc1N Amb25714008 [1,0,0,0,0,0|2,0,0]=3 911 B10R1.4 NCCc1cccnc1O Amb26550960 [1,0,0,0,0,0|2,0,0]=3 912 B10R1.4 NCCc1ccncc1Br Amb26565968 [1,0,0,0,0,0|1,0,0]=2 913 B10R1.4 NCCc1ccncc1Cl Amb23596506 [1,0,0,0,0,0|1,1,0]=3 914 B10R1.4 NCCc1ccncc1F Amb24383725 [1,0,0,0,0,0|1,1,0]=3 915 B10R1.4 NCCc1ccncc1N Amb28423471 [1,0,0,0,0,0|2,0,0]=3 916 B10R1.4 NCCc1cnccc1Br Amb27793514 [1,0,0,0,0,0|1,0,0]=2 917 B10R1.4 NCCc1cnccc1F Amb25721852 [1,0,0,0,0,0|1,1,0]=3 918 B10R1.4 NCCc1cncnc1Cl Amb18830516 [1,0,0,0,0,0|2,1,0]=4 919 B10R1.4 NCCc1cncnc1N Amb18832166 [1,0,0,0,0,0|3,0,0]=4 920 B10R1.4 NCCc1cncnc1O Amb18832090 [1,0,0,0,0,0|3,0,0]=4 921 B10R1.4 NCCc1ncccc1Br Amb24183541 [1,0,0,0,0,0|1,0,0]=2 922 B10R1.4 NCCc1ncccc1Cl Amb18200051 [1,0,0,0,0,0|1,1,0]=3 923 B10R1.4 NCCc1ncccc1F Amb33537364 [1,0,0,0,0,0|1,1,0]=3 924 B10R1.4 NCCc1ncccc1F Amb8011391 [1,0,0,0,0,0|1,1,0]=3 925 B10R1.4 NCCc1ncccc1N Amb25915119 [1,0,0,0,0,0|2,0,0]=3 926 B10R1.4 NCCc1ncccc1O Amb26588910 [1,0,0,0,0,0|2,0,0]=3 927 B10R1.4 NCCc1ncncc1Br Amb27857057 [1,0,0,0,0,0|2,0,0]=3 928 B10R1.4 NCCc1ncncc1Cl Amb28280690 [1,0,0,0,0,0|2,1,0]=4 929 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,0,0,0,0,0|1,0,0]=2 930 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,0,0,0,0,0|1,0,0]=2 931 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,0,0,0,0,0|1,1,0]=3 932 B10R1.4 NNCc1ccccc1Cl Amb4008405 [1,0,0,0,0,0|1,1,0]=3 933 B10R1.4 NNCc1ccccc1Cl Amb5400451 [1,0,0,0,0,0|1,1,0]=3 934 B10R1.4 NNCc1ccccc1F Amb19893256 [1,0,0,0,0,0|1,1,0]=3 935 B10R1.4 NNCc1ccccc1F Amb33553561 [1,0,0,0,0,0|1,1,0]=3 936 B10R1.4 NNCc1ccccc1F Amb6247906 [1,0,0,0,0,0|1,1,0]=3 937 B10R1.4 NNCc1ccccc1O Amb24681968 [1,0,0,0,0,0|2,0,0]=3 938 B10R1.4 NNCc1cccnc1Br Amb27758317 [1,0,0,0,0,0|2,0,0]=3 939 B10R1.4 NNCc1cccnc1Cl Amb19664695 [1,0,0,0,0,0|2,1,0]=4 940 B10R1.4 NNCc1cccnc1F Amb25243144 [1,0,0,0,0,0|2,1,0]=4 941 B10R1.4 NNCc1cccnc1N Amb19664694 [1,0,0,0,0,0|3,0,0]=4 942 B10R1.4 NNCc1ccncc1Br Amb25274178 [1,0,0,0,0,0|2,0,0]=3 943 B10R1.4 NNCc1ccncc1Cl Amb27146995 [1,0,0,0,0,0|2,1,0]=4 944 B10R1.4 NNCc1ccncc1F Amb27838901 [1,0,0,0,0,0|2,1,0]=4 945 B10R1.4 NNCc1ncccc1Br Amb27822676 [1,0,0,0,0,0|2,0,0]=3 946 B10R1.4 NNCc1ncccc1Cl Amb28322503 [1,0,0,0,0,0|2,1,0]=4 947 B10R1.4 NNCc1ncccc1F Amb24572209 [1,0,0,0,0,0|2,1,0]=4 948 B10R1.4 NNCc1ncncc1Br Amb28070046 [1,0,0,0,0,0|3,0,0]=4 949 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,0,0,0,0,0|1,0,0]=2 950 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,0,0,0,0,0|1,0,0]=2 951 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,0,0,0,0,0|1,1,0]=3 952 B10R1.4 NOCc1ccccc1Cl Amb8471898 [1,0,0,0,0,0|1,1,0]=3 953 B10R1.4 NOCc1ccccc1F Amb19894376 [1,0,0,0,0,0|1,1,0]=3 954 B10R1.4 NOCc1ccccc1F Amb8471897 [1,0,0,0,0,0|1,1,0]=3 955 B10R1.4 NOCc1ccccc1I Amb22235087 [1,0,0,0,0,0|1,1,0]=3 956 B10R1.4 NOCc1ccccc1I Amb27445122 [1,0,0,0,0,0|1,1,0]=3 957 B10R1.4 NOCc1ccccc1O Amb24502260 [1,0,0,0,0,0|2,0,0]=3 958 B10R1.4 NOCc1cccnc1Br Amb25947050 [1,0,0,0,0,0|2,0,0]=3 959 B10R1.4 NOCc1cccnc1Cl Amb22396129 [1,0,0,0,0,0|2,1,0]=4 960 B10R1.4 NOCc1cccnc1F Amb33377682 [1,0,0,0,0,0|2,1,0]=4 961 B10R1.4 NOCc1cccnc1N Amb27862932 [1,0,0,0,0,0|3,0,0]=4 962 B10R1.4 NOCc1ccncc1Br Amb33241889 [1,0,0,0,0,0|2,0,0]=3 963 B10R1.4 NOCc1ccncc1Cl Amb25764086 [1,0,0,0,0,0|2,1,0]=4 964 B10R1.4 NOCc1ccncc1F Amb26423136 [1,0,0,0,0,0|2,1,0]=4 965 B10R1.4 NOCc1cnccc1Cl Amb27254698 [1,0,0,0,0,0|2,1,0]=4 966 B10R1.4 NOCc1ncccc1Br Amb26871580 [1,0,0,0,0,0|2,0,0]=3 967 B10R1.4 NOCc1ncccc1F Amb26370102 [1,0,0,0,0,0|2,1,0]=4 968 B10R1.4 N\C=N\c1ccccc1Cl Amb27803970 [1,0,0,0,0,0|1,1,1]=4 969 B10R1.4 N\N=C\c1ccccc1O Amb594479 [1,0,0,0,0,0|2,0,1]=4 970 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,0,0,0,0,0|2,0,0]=3 971 B10R1.4 Nc1ccccc1CCCl Amb28204640 [1,0,0,0,0,0|2,0,0]=3 972 B10R1.4 Nc1ccccc1CCO Amb33733822 [1,0,0,0,0,0|2,0,0]=3 973 B10R1.4 Nc1ccccc1CCO Amb4605841 [1,0,0,0,0,0|2,0,0]=3 974 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,0,0,0,0,0|3,0,0]=4 975 B10R1.4 Nc1cccnc1CCO Amb26398866 [1,0,0,0,0,0|3,0,0]=4 976 B10R1.4 Nc1ccncc1CCF Amb26001806 [1,0,0,0,0,0|3,0,0]=4 977 B10R1.4 Nc1ccncc1CCO Amb24062498 [1,0,0,0,0,0|3,0,0]=4 978 B10R1.4 Nc1ncccc1CCCl Amb27256835 [1,0,0,0,0,0|3,0,0]=4 979 B10R1.4 Nc1ncccc1CCO Amb21858404 [1,0,0,0,0,0|3,0,0]=4 980 B10R1.4 O=C1C=CC=CN1CCBr Amb19514604 [1,0,0,0,0,0|3,0,0]=4 981 B10R1.4 O=C1C=CC=CN1CCBr Amb33299911 [1,0,0,0,0,0|3,0,0]=4 982 B10R1.4 O=C1C=CC=CN1CCCl Amb18787739 [1,0,0,0,0,0|3,0,0]=4 983 B10R1.4 O=C1C=CC=CN1CCF Amb27426877 [1,0,0,0,0,0|3,0,0]=4 984 B10R1.4 O=C1C=CC=CN1CCI Amb28254877 [1,0,0,0,0,0|3,0,0]=4 985 B10R1.4 O=C1C=CC=CN1CCO Amb18041231 [1,0,0,0,0,0|3,0,0]=4 986 B10R1.4 O=C1NC=CC=C1CCO Amb27241736 [1,0,0,0,0,0|3,0,0]=4 987 B10R1.4 O=C=Nc1ccccc1Br Amb2726242 [1,0,0,0,0,0|2,0,1]=4 988 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,0,0,0,0,0|1,0,1]=3 989 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,0,0,0,0,0|1,1,1]=4 990 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,0,0,0,0,0|1,1,1]=4 991 B10R1.4 O=CCc1ccccc1O Amb6739922 [1,0,0,0,0,0|2,0,1]=4 992 B10R1.4 O=CCc1cccnc1Br Amb24746150 [1,0,0,0,0,0|2,0,1]=4 993 B10R1.4 O=CCc1ccncc1Br Amb26618713 [1,0,0,0,0,0|2,0,1]=4 994 B10R1.4 O=CCc1ncccc1Br Amb28187085 [1,0,0,0,0,0|2,0,1]=4 995 B10R1.4 O=CNc1ccccc1Br Amb33718582 [1,0,0,0,0,0|2,0,1]=4 996 B10R1.4 O=CNc1ccccc1Br Amb3988017 [1,0,0,0,0,0|2,0,1]=4 997 B10R1.4 O=c1ccccn1CCCl Amb22274576 [1,0,0,0,0,0|3,0,0]=4 998 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,0,0,0,0,0|3,0,0]=4 999 B10R1.4 OCCc1ccccc1Br Amb3939212 [1,0,0,0,0,0|1,0,0]=2 1000 B10R1.4 OCCc1ccccc1Cl Amb3939106 [1,0,0,0,0,0|1,1,0]=3 1001 B10R1.4 OCCc1ccccc1F Amb2688283 [1,0,0,0,0,0|1,1,0]=3 1002 B10R1.4 OCCc1ccccc1I Amb22753529 [1,0,0,0,0,0|1,1,0]=3 1003 B10R1.4 OCCc1ccccc1O Amb3940101 [1,0,0,0,0,0|2,0,0]=3 1004 B10R1.4 OCCc1cccnc1Br Amb27200606 [1,0,0,0,0,0|2,0,0]=3 1005 B10R1.4 OCCc1cccnc1Cl Amb28050705 [1,0,0,0,0,0|2,1,0]=4 1006 B10R1.4 OCCc1cccnc1F Amb24513826 [1,0,0,0,0,0|2,1,0]=4 1007 B10R1.4 OCCc1ccncc1Br Amb24482101 [1,0,0,0,0,0|2,0,0]=3 1008 B10R1.4 OCCc1ccncc1Cl Amb25890041 [1,0,0,0,0,0|2,1,0]=4 1009 B10R1.4 OCCc1ccncc1F Amb25776747 [1,0,0,0,0,0|2,1,0]=4 1010 B10R1.4 OCCc1cnccc1F Amb25865877 [1,0,0,0,0,0|2,1,0]=4 1011 B10R1.4 OCCc1ncccc1Br Amb22896751 [1,0,0,0,0,0|2,0,0]=3 1012 B10R1.4 OCCc1ncccc1Cl Amb28288389 [1,0,0,0,0,0|2,1,0]=4 1013 B10R1.4 OCCc1ncccc1F Amb26024787 [1,0,0,0,0,0|2,1,0]=4 1014 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,0,0,0,0,0|1,0,0]=2 1015 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,0,0,0,0,0|1,1,0]=3 1016 B10R1.4 ONCc1ccccc1Cl Amb32679300 [1,0,0,0,0,0|1,1,0]=3 1017 B10R1.4 ONCc1ccccc1F Amb27252972 [1,0,0,0,0,0|1,1,0]=3 1018 B10R1.4 ONCc1ccccc1O Amb25128279 [1,0,0,0,0,0|2,0,0]=3 1019 B10R1.4 ONCc1cccnc1Br Amb33387397 [1,0,0,0,0,0|2,0,0]=3 1020 B10R1.4 ONCc1cccnc1Cl Amb21847006 [1,0,0,0,0,0|2,1,0]=4 1021 B10R1.4 ONCc1cccnc1F Amb33378660 [1,0,0,0,0,0|2,1,0]=4 1022 B10R1.4 ONCc1ccncc1Br Amb33242569 [1,0,0,0,0,0|2,0,0]=3 1023 B10R1.4 ONCc1ccncc1Cl Amb33052755 [1,0,0,0,0,0|2,1,0]=4 1024 B10R1.4 ONCc1ccncc1F Amb33318031 [1,0,0,0,0,0|2,1,0]=4 1025 B10R1.4 ONCc1ncccc1Br Amb33485075 [1,0,0,0,0,0|2,0,0]=3 1026 B10R1.4 ONCc1ncccc1F Amb33420499 [1,0,0,0,0,0|2,1,0]=4 1027 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,0,0,0,0,0|1,0,2]=4 1028 B10R1.4 O\N=C\c1ccccc1Br Amb33788652 [1,0,0,0,0,0|1,0,2]=4 1029 B10R1.4 Oc1ccccc1CCBr Amb33549255 [1,0,0,0,0,0|2,0,0]=3 1030 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,0,0,0,0,0|2,0,0]=3 1031 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,0,0,0,0,0|2,0,0]=3 1032 B10R1.4 Oc1ccccc1SCCl Amb28204207 [1,0,0,0,0,0|3,0,0]=4 1033 B10R1.4 S=C=Nc1ccccc1Br Amb6572483 [1,0,0,0,0,0|2,0,1]=4 1034 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,0,0,0,0,0|1,0,0]=2 1035 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,0,0,0,0,0|1,1,0]=3 1036 B10R1.4 SCCc1ccccc1I Amb24089655 [1,0,0,0,0,0|1,1,0]=3 1037 B10R1.4 SCCc1cccnc1Br Amb33388044 [1,0,0,0,0,0|2,0,0]=3 1038 B10R1.4 SCCc1cccnc1Cl Amb33257708 [1,0,0,0,0,0|2,1,0]=4 1039 B10R1.4 SCCc1ccncc1Br Amb33389013 [1,0,0,0,0,0|2,0,0]=3 1040 B10R1.4 SCCc1ccncc1Cl Amb33413845 [1,0,0,0,0,0|2,1,0]=4 1041 B10R1.4 SCCc1ncccc1Br Amb33336357 [1,0,0,0,0,0|2,0,0]=3 1042 B10R1.4 Sc1ccccc1CCBr Amb27450103 [1,0,0,0,0,0|2,0,0]=3 1043 B10R1.4 Sc1ccccc1CCCl Amb27776252 [1,0,0,0,0,0|2,0,0]=3 1044 B10R1.4 [C-]#[N+]Cc1ccccc1Br Amb3973085 [1,0,0,0,0,0|0,0,2]=3 1045 B10R1.4 [C-]#[N+]Cc1ccccc1C Amb2689349 [1,0,0,0,0,0|1,0,2]=4 1046 B10R1.4 [C-]#[N+]Cc1ccccc1Cl Amb2685776 [1,0,0,0,0,0|0,1,2]=4 1047 B10R1.4 [C-]#[N+]Cc1ccccc1F Amb2688050 [1,0,0,0,0,0|0,1,2]=4 1048 B10R1.4 [C-]#[N+]Cc1ccccc1O Amb28048077 [1,0,0,0,0,0|1,0,2]=4 1049 B10R1.4 [C-]#[N+]Cc1cccnc1Br Amb33387828 [1,0,0,0,0,0|1,0,2]=4 1050 B10R1.4 [C-]#[N+]Cc1ccncc1Br Amb33388245 [1,0,0,0,0,0|1,0,2]=4 1051 B10R1.4 [N-]=[N+]=Nc1ccccc1Br Amb8844903 [1,0,0,0,0,0|2,0,1]=4 1052 B10R1.4 [NH3+]CCc1ccccc1Cl Amb33512987 [1,0,0,0,0,0|0,1,1]=3 1053 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,0,0,0,0,0|1,0,1]=3 1054 B10R1.4 [O-][n+]1ccccc1CCO Amb541137 [1,0,0,0,0,0|3,0,0]=4 1055 B10R1.17 BrCCCc1ccccc1 Amb2721516 [1,0,0,0,0,0|2,0,0]=3 1056 B10R1.17 BrCCCc1ccccn1 Amb27866171 [1,0,0,0,0,0|3,0,0]=4 1057 B10R1.17 BrCCCc1cccnc1 Amb1102301 [1,0,0,0,0,0|3,0,0]=4 1058 B10R1.17 BrCCCc1cccnc1 Amb17610084 [1,0,0,0,0,0|3,0,0]=4 1059 B10R1.17 BrCCCc1ccncc1 Amb32751195 [1,0,0,0,0,0|3,0,0]=4 1060 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,0,0,0,0,0|3,0,0]=4 1061 B10R1.17 BrCCSc1ccccc1 Amb6255409 [1,0,0,0,0,0|3,0,0]=4 1062 B10R1.17 BrCOCc1ccccc1 Amb27410470 [1,0,0,0,0,0|3,0,0]=4 1063 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [1,0,0,0,0,0|2,0,0]=3 1064 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [1,0,0,0,0,0|2,0,1]=4 1065 B10R1.17 C#CCCc1ccccc1 Amb6336492 [1,0,0,0,0,0|1,0,1]=3 1066 B10R1.17 C#CCCc1ccccn1 Amb24571654 [1,0,0,0,0,0|2,0,1]=4 1067 B10R1.17 C#CCCc1cccnc1 Amb24085226 [1,0,0,0,0,0|2,0,1]=4 1068 B10R1.17 C#CCCc1ccncc1 Amb24091331 [1,0,0,0,0,0|2,0,1]=4 1069 B10R1.17 C#CCOc1ccccc1 Amb839455 [1,0,0,0,0,0|2,0,1]=4 1070 B10R1.17 C#CCSc1ccccc1 Amb3836098 [1,0,0,0,0,0|2,0,1]=4 1071 B10R1.17 C=CCCc1ccccc1 Amb2721241 [1,0,0,0,0,0|1,0,1]=3 1072 B10R1.17 C=CCCc1ccccn1 Amb25337662 [1,0,0,0,0,0|2,0,1]=4 1073 B10R1.17 C=CCCc1cccnc1 Amb24477186 [1,0,0,0,0,0|2,0,1]=4 1074 B10R1.17 C=CCNc1ccccc1 Amb2720315 [1,0,0,0,0,0|2,0,1]=4 1075 B10R1.17 C=CCOc1ccccc1 Amb2842273 [1,0,0,0,0,0|2,0,1]=4 1076 B10R1.17 C=CCSc1ccccc1 Amb3836099 [1,0,0,0,0,0|2,0,1]=4 1077 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|2,0,1]=4 1078 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [1,0,0,0,0,0|1,0,2]=4 1079 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [1,0,0,0,0,0|2,0,0]=3 1080 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [1,0,0,0,0,0|2,0,0]=3 1081 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [1,0,0,0,0,0|2,0,0]=3 1082 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [1,0,0,0,0,0|2,0,0]=3 1083 B10R1.17 CCCCc1ccccc1 Amb6608912 [1,0,0,0,0,0|1,0,0]=2 1084 B10R1.17 CCCCc1ccccn1 Amb8395993 [1,0,0,0,0,0|2,0,0]=3 1085 B10R1.17 CCCCc1cccnc1 Amb4037068 [1,0,0,0,0,0|2,0,0]=3 1086 B10R1.17 CCCCc1cccnn1 Amb22235740 [1,0,0,0,0,0|3,0,0]=4 1087 B10R1.17 CCCCc1ccncc1 Amb10555008 [1,0,0,0,0,0|2,0,0]=3 1088 B10R1.17 CCCNc1ccccc1 Amb534130 [1,0,0,0,0,0|2,0,0]=3 1089 B10R1.17 CCCNc1cccnc1 Amb6686632 [1,0,0,0,0,0|3,0,0]=4 1090 B10R1.17 CCCNc1ccncc1 Amb6614447 [1,0,0,0,0,0|3,0,0]=4 1091 B10R1.17 CCCOc1ccccc1 Amb2842271 [1,0,0,0,0,0|2,0,0]=3 1092 B10R1.17 CCCSc1ccccc1 Amb4014460 [1,0,0,0,0,0|2,0,0]=3 1093 B10R1.17 CCCSc1ccccn1 Amb24733306 [1,0,0,0,0,0|3,0,0]=4 1094 B10R1.17 CCCSc1ccncc1 Amb28126322 [1,0,0,0,0,0|3,0,0]=4 1095 B10R1.17 CCNCc1ccccc1 Amb3699539 [1,0,0,0,0,0|2,0,0]=3 1096 B10R1.17 CCNCc1ccccn1 Amb2592098 [1,0,0,0,0,0|3,0,0]=4 1097 B10R1.17 CCNCc1cccnc1 Amb21972163 [1,0,0,0,0,0|3,0,0]=4 1098 B10R1.17 CCNCc1cccnc1 Amb837759 [1,0,0,0,0,0|3,0,0]=4 1099 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,0,0,0,0,0|3,0,0]=4 1100 B10R1.17 CCOCc1ccccc1 Amb9787555 [1,0,0,0,0,0|2,0,0]=3 1101 B10R1.17 CCOCc1ccccn1 Amb27267027 [1,0,0,0,0,0|3,0,0]=4 1102 B10R1.17 CCOCc1ccncc1 Amb27255285 [1,0,0,0,0,0|3,0,0]=4 1103 B10R1.17 CCOSc1ccccc1 Amb28049338 [1,0,0,0,0,0|3,0,0]=4 1104 B10R1.17 CCSCc1ccccc1 Amb9787636 [1,0,0,0,0,0|2,0,0]=3 1105 B10R1.17 CCSCc1ccccn1 Amb28124640 [1,0,0,0,0,0|3,0,0]=4 1106 B10R1.17 CCSCc1cccnc1 Amb26909883 [1,0,0,0,0,0|3,0,0]=4 1107 B10R1.17 CCSSc1ccccc1 Amb28057163 [1,0,0,0,0,0|3,0,0]=4 1108 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,2]=4 1109 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|2,0,1]=4 1110 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [1,0,0,0,0,0|0,0,3]=4 1111 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [1,0,0,0,0,0|0,0,2]=3 1112 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,0,0,0,0,0|0,0,0]=1 1113 B10R1.17 CNCCc1ccccc1 Amb33545919 [1,0,0,0,0,0|0,0,0]=1 1114 B10R1.17 CNCCc1ccccn1 Amb1651624 [1,0,0,0,0,0|1,0,0]=2 1115 B10R1.17 CNCCc1ccccn1 Amb22167479 [1,0,0,0,0,0|1,0,0]=2 1116 B10R1.17 CNCCc1ccccn1 Amb6741463 [1,0,0,0,0,0|1,0,0]=2 1117 B10R1.17 CNCCc1cccnc1 Amb10068754 [1,0,0,0,0,0|1,0,0]=2 1118 B10R1.17 CNCCc1cccnc1 Amb10576410 [1,0,0,0,0,0|1,0,0]=2 1119 B10R1.17 CNCCc1ccncc1 Amb10071184 [1,0,0,0,0,0|1,0,0]=2 1120 B10R1.17 CNCCc1ccncc1 Amb19958269 [1,0,0,0,0,0|1,0,0]=2 1121 B10R1.17 CNCCc1ccncc1 Amb2592519 [1,0,0,0,0,0|1,0,0]=2 1122 B10R1.17 CNCCc1ccncn1 Amb8010524 [1,0,0,0,0,0|2,0,0]=3 1123 B10R1.17 CNCCc1cnccn1 Amb22059364 [1,0,0,0,0,0|2,0,0]=3 1124 B10R1.17 CNCCc1cncnc1 Amb8010527 [1,0,0,0,0,0|2,0,0]=3 1125 B10R1.17 CNCCc1cncnn1 Amb27848609 [1,0,0,0,0,0|3,0,0]=4 1126 B10R1.17 CNCCc1ncccn1 Amb31156561 [1,0,0,0,0,0|2,0,0]=3 1127 B10R1.17 CNCCc1ncccn1 Amb8010522 [1,0,0,0,0,0|2,0,0]=3 1128 B10R1.17 CNCCc1nccnn1 Amb18224135 [1,0,0,0,0,0|3,0,0]=4 1129 B10R1.17 CNCCc1ncncn1 Amb18861081 [1,0,0,0,0,0|3,0,0]=4 1130 B10R1.17 CNNCc1ccccc1 Amb26859422 [1,0,0,0,0,0|1,0,0]=2 1131 B10R1.17 CNNCc1ccccc1 Amb33328543 [1,0,0,0,0,0|1,0,0]=2 1132 B10R1.17 CNNCc1ccccn1 Amb26421896 [1,0,0,0,0,0|2,0,0]=3 1133 B10R1.17 CNNCc1cccnc1 Amb24558769 [1,0,0,0,0,0|2,0,0]=3 1134 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,0,0,0,0,0|1,0,0]=2 1135 B10R1.17 CNOCc1ccccc1 Amb32412803 [1,0,0,0,0,0|1,0,0]=2 1136 B10R1.17 CN\C=N\c1cccnc1 Amb24671021 [1,0,0,0,0,0|2,0,1]=4 1137 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [1,0,0,0,0,0|1,0,1]=3 1138 B10R1.17 CN\N=C\c1cccnc1 Amb28049739 [1,0,0,0,0,0|2,0,1]=4 1139 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [1,0,0,0,0,0|2,0,0]=3 1140 B10R1.17 COCC[n+]1ccccc1 Amb28125435 [1,0,0,0,0,0|2,0,0]=3 1141 B10R1.17 COCCc1ccccc1 Amb4020014 [1,0,0,0,0,0|1,0,0]=2 1142 B10R1.17 COCCc1ccccn1 Amb4034583 [1,0,0,0,0,0|2,0,0]=3 1143 B10R1.17 COCCc1ccncc1 Amb26565974 [1,0,0,0,0,0|2,0,0]=3 1144 B10R1.17 COCOc1ccccc1 Amb2608594 [1,0,0,0,0,0|2,0,0]=3 1145 B10R1.17 COCOc1ccccn1 Amb27757113 [1,0,0,0,0,0|3,0,0]=4 1146 B10R1.17 CONCc1ccccc1 Amb26432339 [1,0,0,0,0,0|2,0,0]=3 1147 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|1,0,2]=4 1148 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [1,0,0,0,0,0|2,0,1]=4 1149 B10R1.17 CSCCc1ccccc1 Amb26586093 [1,0,0,0,0,0|1,0,0]=2 1150 B10R1.17 CSCCc1ccccn1 Amb24552366 [1,0,0,0,0,0|2,0,0]=3 1151 B10R1.17 CSCNc1ccccc1 Amb25992690 [1,0,0,0,0,0|2,0,0]=3 1152 B10R1.17 CSCNc1ccccn1 Amb27972069 [1,0,0,0,0,0|3,0,0]=4 1153 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,0,0,0,0,0|2,0,0]=3 1154 B10R1.17 CSCOc1ccccn1 Amb27256230 [1,0,0,0,0,0|3,0,0]=4 1155 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [1,0,0,0,0,0|1,0,2]=4 1156 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [1,0,0,0,0,0|2,0,1]=4 1157 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [1,0,0,0,0,0|1,0,1]=3 1158 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,1]=4 1159 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [1,0,0,0,0,0|3,0,0]=4 1160 B10R1.17 ClCCCc1ccccc1 Amb3941487 [1,0,0,0,0,0|2,0,0]=3 1161 B10R1.17 ClCCCc1ccccn1 Amb32751196 [1,0,0,0,0,0|3,0,0]=4 1162 B10R1.17 ClCCCc1cccnc1 Amb17477795 [1,0,0,0,0,0|3,0,0]=4 1163 B10R1.17 ClCCCc1cccnc1 Amb32665795 [1,0,0,0,0,0|3,0,0]=4 1164 B10R1.17 ClCCCc1ccncc1 Amb17477794 [1,0,0,0,0,0|3,0,0]=4 1165 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,0,0,0,0,0|3,0,0]=4 1166 B10R1.17 ClCCOc1ccccc1 Amb3940573 [1,0,0,0,0,0|3,0,0]=4 1167 B10R1.17 ClCCSc1ccccc1 Amb2685910 [1,0,0,0,0,0|3,0,0]=4 1168 B10R1.17 ClCOCc1ccccc1 Amb2684626 [1,0,0,0,0,0|3,0,0]=4 1169 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,0,0,0,0,0|3,0,0]=4 1170 B10R1.17 FCCNc1ccccc1 Amb26349791 [1,0,0,0,0,0|3,0,0]=4 1171 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,0,0,0,0,0|2,0,0]=3 1172 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,0,0,0,0,0|3,0,0]=4 1173 B10R1.17 ICCSc1ccccc1 Amb27458209 [1,0,0,0,0,0|3,0,0]=4 1174 B10R1.17 ICOCc1ccccc1 Amb28348666 [1,0,0,0,0,0|3,0,0]=4 1175 B10R1.17 N#CCC[n+]1ccccc1 Amb28458262 [1,0,0,0,0,0|3,0,0]=4 1176 B10R1.17 N#CCCc1ccccc1 Amb33551192 [1,0,0,0,0,0|2,0,0]=3 1177 B10R1.17 N#CCCc1ccccn1 Amb1102488 [1,0,0,0,0,0|3,0,0]=4 1178 B10R1.17 N#CCCc1cccnc1 Amb10605345 [1,0,0,0,0,0|3,0,0]=4 1179 B10R1.17 N#CCCc1ccncc1 Amb2694189 [1,0,0,0,0,0|3,0,0]=4 1180 B10R1.17 N#CCNc1ccccc1 Amb1651088 [1,0,0,0,0,0|3,0,0]=4 1181 B10R1.17 N#CCOc1ccccc1 Amb2725206 [1,0,0,0,0,0|3,0,0]=4 1182 B10R1.17 N#CCSc1ccccc1 Amb2690327 [1,0,0,0,0,0|3,0,0]=4 1183 B10R1.17 N#CNCc1ccccc1 Amb27257452 [1,0,0,0,0,0|3,0,0]=4 1184 B10R1.17 N#CSCc1ccccc1 Amb2611897 [1,0,0,0,0,0|3,0,0]=4 1185 B10R1.17 NCCCc1ccccc1 Amb844788 [1,0,0,0,0,0|2,0,0]=3 1186 B10R1.17 NCCCc1ccccn1 Amb1088884 [1,0,0,0,0,0|3,0,0]=4 1187 B10R1.17 NCCCc1ccccn1 Amb21954278 [1,0,0,0,0,0|3,0,0]=4 1188 B10R1.17 NCCCc1cccnc1 Amb18363942 [1,0,0,0,0,0|3,0,0]=4 1189 B10R1.17 NCCCc1cccnc1 Amb31188323 [1,0,0,0,0,0|3,0,0]=4 1190 B10R1.17 NCCCc1cccnc1 Amb5735475 [1,0,0,0,0,0|3,0,0]=4 1191 B10R1.17 NCCCc1ccncc1 Amb22490382 [1,0,0,0,0,0|3,0,0]=4 1192 B10R1.17 NCCCc1ccncc1 Amb24099592 [1,0,0,0,0,0|3,0,0]=4 1193 B10R1.17 NCCCc1ccncc1 Amb33535434 [1,0,0,0,0,0|3,0,0]=4 1194 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,0,0,0,0,0|3,0,0]=4 1195 B10R1.17 NCCNc1ccccc1 Amb2720312 [1,0,0,0,0,0|3,0,0]=4 1196 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,0,0,0,0,0|3,0,0]=4 1197 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,0,0,0,0,0|3,0,0]=4 1198 B10R1.17 NCCSc1ccccc1 Amb6374305 [1,0,0,0,0,0|3,0,0]=4 1199 B10R1.17 NCCSc1ccccc1 Amb6827055 [1,0,0,0,0,0|3,0,0]=4 1200 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,0,0,0,0,0|1,0,0]=2 1201 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,0,0,0,0,0|1,0,0]=2 1202 B10R1.17 NNCCc1ccccc1 Amb33552804 [1,0,0,0,0,0|1,0,0]=2 1203 B10R1.17 NNCCc1ccccn1 Amb20669588 [1,0,0,0,0,0|2,0,0]=3 1204 B10R1.17 NNCCc1ccccn1 Amb33528741 [1,0,0,0,0,0|2,0,0]=3 1205 B10R1.17 NNCCc1ccncc1 Amb6248763 [1,0,0,0,0,0|2,0,0]=3 1206 B10R1.17 NNCCc1cnccn1 Amb35695639 [1,0,0,0,0,0|3,0,0]=4 1207 B10R1.17 NOCCc1ccccc1 Amb2899735 [1,0,0,0,0,0|2,0,0]=3 1208 B10R1.17 NOCCc1ccccc1 Amb6308543 [1,0,0,0,0,0|2,0,0]=3 1209 B10R1.17 NOCCc1ccccn1 Amb17231907 [1,0,0,0,0,0|3,0,0]=4 1210 B10R1.17 NOCCc1cccnc1 Amb25779030 [1,0,0,0,0,0|3,0,0]=4 1211 B10R1.17 NOCCc1ccncc1 Amb17231908 [1,0,0,0,0,0|3,0,0]=4 1212 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [1,0,0,0,0,0|3,0,0]=4 1213 B10R1.17 O=CCCc1ccccc1 Amb2720576 [1,0,0,0,0,0|2,0,0]=3 1214 B10R1.17 O=CCCc1ccccn1 Amb17081674 [1,0,0,0,0,0|3,0,0]=4 1215 B10R1.17 O=CCCc1cccnc1 Amb17081675 [1,0,0,0,0,0|3,0,0]=4 1216 B10R1.17 O=CCCc1ccncc1 Amb8388451 [1,0,0,0,0,0|3,0,0]=4 1217 B10R1.17 O=CCOc1ccccc1 Amb3465095 [1,0,0,0,0,0|3,0,0]=4 1218 B10R1.17 O=CCSc1ccccc1 Amb17082903 [1,0,0,0,0,0|3,0,0]=4 1219 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,0,0,0,0,0|3,0,0]=4 1220 B10R1.17 O=COCc1ccccc1 Amb4605893 [1,0,0,0,0,0|3,0,0]=4 1221 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [1,0,0,0,0,0|2,0,1]=4 1222 B10R1.17 OCCCc1ccccc1 Amb3939054 [1,0,0,0,0,0|2,0,0]=3 1223 B10R1.17 OCCCc1ccccn1 Amb22749323 [1,0,0,0,0,0|3,0,0]=4 1224 B10R1.17 OCCCc1ccccn1 Amb3939333 [1,0,0,0,0,0|3,0,0]=4 1225 B10R1.17 OCCCc1cccnc1 Amb2694598 [1,0,0,0,0,0|3,0,0]=4 1226 B10R1.17 OCCCc1cccnc1 Amb33623848 [1,0,0,0,0,0|3,0,0]=4 1227 B10R1.17 OCCCc1ccncc1 Amb3650114 [1,0,0,0,0,0|3,0,0]=4 1228 B10R1.17 OCCNc1ccccc1 Amb3940335 [1,0,0,0,0,0|3,0,0]=4 1229 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,0,0,0,0,0|3,0,0]=4 1230 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,0,0,0,0,0|3,0,0]=4 1231 B10R1.17 OCSCc1ccccc1 Amb27839241 [1,0,0,0,0,0|3,0,0]=4 1232 B10R1.17 ONCCc1ccccc1 Amb33544180 [1,0,0,0,0,0|1,0,0]=2 1233 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [1,0,0,0,0,0|1,0,2]=4 1234 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [1,0,0,0,0,0|3,0,0]=4 1235 B10R1.17 SCCCc1ccccc1 Amb6255807 [1,0,0,0,0,0|2,0,0]=3 1236 B10R1.17 SCCCc1ccccn1 Amb17399950 [1,0,0,0,0,0|3,0,0]=4 1237 B10R1.17 SCCCc1cccnc1 Amb17399951 [1,0,0,0,0,0|3,0,0]=4 1238 B10R1.17 SCCCc1ccncc1 Amb17399952 [1,0,0,0,0,0|3,0,0]=4 1239 B10R1.17 SCCOc1ccccc1 Amb2794986 [1,0,0,0,0,0|3,0,0]=4 1240 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,0,0,0,0,0|3,0,0]=4 1241 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [1,0,0,0,0,0|0,0,2]=3 1242 B10R1.17 [C-]#[N+]CCc1ccccn1 Amb5456295 [1,0,0,0,0,0|1,0,2]=4 1243 B10R1.17 [C-]#[N+]CCc1cccnc1 Amb33429418 [1,0,0,0,0,0|1,0,2]=4 1244 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [1,0,0,0,0,0|1,0,2]=4 1245 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [1,0,0,0,0,0|2,0,1]=4 1246 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,0,0,0,0,0|1,1,0]=3 1247 B12R1.25 BrCCCc1cccc(Br)c1I Amb26532847 [0,1,0,0,0,0|2,1,0]=4 1248 B12R1.25 BrCCCc1cccc(I)c1Br Amb26907784 [0,1,0,0,0,0|2,0,0]=3 1249 B12R1.25 C#CCCc1cccc(Br)c1C Amb33477272 [0,1,0,0,0,0|2,0,1]=4 1250 B12R1.25 C#CCCc1cccc(Br)c1F Amb33386955 [0,1,0,0,0,0|1,1,1]=4 1251 B12R1.25 C#CCCc1cccc(Br)c1O Amb33332586 [0,1,0,0,0,0|2,0,1]=4 1252 B12R1.25 C#CCCc1cccc(C)c1C Amb33314566 [0,1,0,0,0,0|2,0,1]=4 1253 B12R1.25 C#CCCc1cccc(C)c1F Amb33324251 [0,1,0,0,0,0|1,1,1]=4 1254 B12R1.25 C#CCCc1cccc(Cl)c1Cl Amb33485141 [0,1,0,0,0,0|1,1,1]=4 1255 B12R1.25 C#CCCc1cccc(Cl)c1F Amb33223294 [0,1,0,0,0,0|1,1,1]=4 1256 B12R1.25 C#CCCc1cccc(Cl)c1O Amb33057230 [0,1,0,0,0,0|2,0,1]=4 1257 B12R1.25 C#CCCc1cccc(F)c1Br Amb33386499 [0,1,0,0,0,0|1,0,1]=3 1258 B12R1.25 C#CCCc1cccc(F)c1C Amb33428344 [0,1,0,0,0,0|2,0,1]=4 1259 B12R1.25 C#CCCc1cccc(F)c1F Amb33427379 [0,1,0,0,0,0|1,1,1]=4 1260 B12R1.25 C#CCCc1cccc(F)c1O Amb33310821 [0,1,0,0,0,0|2,0,1]=4 1261 B12R1.25 C#CCCc1cccc(O)c1Br Amb33386900 [0,1,0,0,0,0|1,0,1]=3 1262 B12R1.25 C#CCCc1cccc(O)c1O Amb33268076 [0,1,0,0,0,0|2,0,1]=4 1263 B12R1.25 C#CCNc1cccc(Cl)c1Br Amb27869361 [0,1,0,0,0,0|2,0,1]=4 1264 B12R1.25 C=CCCc1cccc(Br)c1F Amb35715387 [0,1,0,0,0,0|1,1,1]=4 1265 B12R1.25 C=CCCc1cccc(C)c1C Amb30012802 [0,1,0,0,0,0|2,0,1]=4 1266 B12R1.25 C=CCCc1cccc(C)c1F Amb27461509 [0,1,0,0,0,0|1,1,1]=4 1267 B12R1.25 CCCCC1=C(N)C(=O)NC=C1 Amb32943650 [0,1,0,0,0,0|3,0,0]=4 1268 B12R1.25 CCCCN1C=CC=C(C)C1=O Amb18405639 [0,1,0,0,0,0|3,0,0]=4 1269 B12R1.25 CCCCN1C=CC=C(N)C1=O Amb18986286 [0,1,0,0,0,0|3,0,0]=4 1270 B12R1.25 CCCCN1C=CC=C(O)C1=O Amb27202010 [0,1,0,0,0,0|3,0,0]=4 1271 B12R1.25 CCCCc1cccc(F)c1F Amb27475766 [0,1,0,0,0,0|1,1,0]=3 1272 B12R1.25 CCCCc1cccc(N)c1F Amb29869565 [0,1,0,0,0,0|1,1,0]=3 1273 B12R1.25 CCCCc1nccc(C)c1N Amb25160013 [0,1,0,0,0,0|3,0,0]=4 1274 B12R1.25 CCCNc1cccc(Br)c1Cl Amb29865088 [0,1,0,0,0,0|2,1,0]=4 1275 B12R1.25 CCCNc1cccc(Br)c1F Amb35642859 [0,1,0,0,0,0|2,1,0]=4 1276 B12R1.25 CCCNc1cccc(C)c1C Amb6700736 [0,1,0,0,0,0|3,0,0]=4 1277 B12R1.25 CCCNc1cccc(C)c1O Amb27751740 [0,1,0,0,0,0|3,0,0]=4 1278 B12R1.25 CCCNc1cccc(Cl)c1C Amb4313518 [0,1,0,0,0,0|3,0,0]=4 1279 B12R1.25 CCCNc1cccc(Cl)c1Cl Amb33329381 [0,1,0,0,0,0|2,1,0]=4 1280 B12R1.25 CCCNc1cccc(Cl)c1Cl Amb6631952 [0,1,0,0,0,0|2,1,0]=4 1281 B12R1.25 CCCNc1cccc(F)c1Cl Amb29864394 [0,1,0,0,0,0|2,1,0]=4 1282 B12R1.25 CCCNc1cccc(F)c1I Amb27591891 [0,1,0,0,0,0|2,1,0]=4 1283 B12R1.25 CCCNc1cccc(F)c1N Amb18968033 [0,1,0,0,0,0|3,0,0]=4 1284 B12R1.25 CCCNc1cccc(I)c1C Amb27760819 [0,1,0,0,0,0|3,0,0]=4 1285 B12R1.25 CCCNc1nccc(C)c1Br Amb27180020 [0,1,0,0,0,0|3,0,0]=4 1286 B12R1.25 CCCOc1cccc(Br)c1N Amb24406179 [0,1,0,0,0,0|3,0,0]=4 1287 B12R1.25 CCCOc1cccc(C)c1C Amb25051268 [0,1,0,0,0,0|3,0,0]=4 1288 B12R1.25 CCCOc1cccc(C)c1Cl Amb28064846 [0,1,0,0,0,0|2,1,0]=4 1289 B12R1.25 CCCOc1cccc(C)c1I Amb33512236 [0,1,0,0,0,0|2,1,0]=4 1290 B12R1.25 CCCOc1cccc(C)c1N Amb9296663 [0,1,0,0,0,0|3,0,0]=4 1291 B12R1.25 CCCOc1cccc(Cl)c1Cl Amb27840687 [0,1,0,0,0,0|2,1,0]=4 1292 B12R1.25 CCCOc1cccc(Cl)c1F Amb27449039 [0,1,0,0,0,0|2,1,0]=4 1293 B12R1.25 CCCOc1cccc(Cl)c1N Amb26398550 [0,1,0,0,0,0|3,0,0]=4 1294 B12R1.25 CCCOc1cccc(F)c1F Amb10839414 [0,1,0,0,0,0|2,1,0]=4 1295 B12R1.25 CCCOc1cccc(F)c1N Amb18288907 [0,1,0,0,0,0|3,0,0]=4 1296 B12R1.25 CCCOc1cccc(N)c1C Amb9296464 [0,1,0,0,0,0|3,0,0]=4 1297 B12R1.25 CCCOc1cccc(N)c1N Amb28243820 [0,1,0,0,0,0|3,0,0]=4 1298 B12R1.25 CCCOc1cccc(O)c1F Amb28344026 [0,1,0,0,0,0|2,1,0]=4 1299 B12R1.25 CCCOc1cccc(O)c1N Amb27849945 [0,1,0,0,0,0|3,0,0]=4 1300 B12R1.25 CCCOc1cccc(O)c1O Amb25092908 [0,1,0,0,0,0|3,0,0]=4 1301 B12R1.25 CCCOc1cccc(S)c1N Amb18271336 [0,1,0,0,0,0|3,0,0]=4 1302 B12R1.25 CCCOc1nccc(N)c1Br Amb23455165 [0,1,0,0,0,0|3,0,0]=4 1303 B12R1.25 CCCSc1cccc(C)c1N Amb27608036 [0,1,0,0,0,0|3,0,0]=4 1304 B12R1.25 CCNCc1cccc(Br)c1C Amb27478890 [0,1,0,0,0,0|3,0,0]=4 1305 B12R1.25 CCNCc1cccc(Br)c1Cl Amb27776414 [0,1,0,0,0,0|2,1,0]=4 1306 B12R1.25 CCNCc1cccc(Br)c1F Amb26392490 [0,1,0,0,0,0|2,1,0]=4 1307 B12R1.25 CCNCc1cccc(C)c1Cl Amb28243839 [0,1,0,0,0,0|2,1,0]=4 1308 B12R1.25 CCNCc1cccc(C)c1F Amb28201346 [0,1,0,0,0,0|2,1,0]=4 1309 B12R1.25 CCNCc1cccc(Cl)c1Cl Amb6276353 [0,1,0,0,0,0|2,1,0]=4 1310 B12R1.25 CCNCc1cccc(F)c1O Amb28144401 [0,1,0,0,0,0|3,0,0]=4 1311 B12R1.25 CCNCc1cccc(N)c1F Amb28341326 [0,1,0,0,0,0|2,1,0]=4 1312 B12R1.25 CCNCc1cccc(O)c1Br Amb28121432 [0,1,0,0,0,0|2,0,0]=3 1313 B12R1.25 CCNCc1cccc(O)c1O Amb18291189 [0,1,0,0,0,0|3,0,0]=4 1314 B12R1.25 CCOCc1cccc(N)c1F Amb27227479 [0,1,0,0,0,0|2,1,0]=4 1315 B12R1.25 CNCCN1C=CC=C(Br)C1=O Amb28194989 [0,1,0,0,0,0|2,0,0]=3 1316 B12R1.25 CNCCN1C=CC=C(C)C1=O Amb27833153 [0,1,0,0,0,0|2,0,0]=3 1317 B12R1.25 CNCCN1C=CN=C(C)C1=O Amb27273571 [0,1,0,0,0,0|3,0,0]=4 1318 B12R1.25 CNCCN1C=NC=C(I)C1=O Amb27236514 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.25 CNCCc1cccc(Br)c1C Amb25953673 [0,1,0,0,0,0|1,0,0]=2 1320 B12R1.25 CNCCc1cccc(Br)c1Cl Amb26883787 [0,1,0,0,0,0|0,1,0]=2 1321 B12R1.25 CNCCc1cccc(Br)c1F Amb25159686 [0,1,0,0,0,0|0,1,0]=2 1322 B12R1.25 CNCCc1cccc(Br)c1O Amb33332266 [0,1,0,0,0,0|1,0,0]=2 1323 B12R1.25 CNCCc1cccc(C)c1Br Amb26386551 [0,1,0,0,0,0|0,0,0]=1 1324 B12R1.25 CNCCc1cccc(C)c1C Amb18993611 [0,1,0,0,0,0|1,0,0]=2 1325 B12R1.25 CNCCc1cccc(C)c1Cl Amb27450779 [0,1,0,0,0,0|0,1,0]=2 1326 B12R1.25 CNCCc1cccc(C)c1F Amb25069543 [0,1,0,0,0,0|0,1,0]=2 1327 B12R1.25 CNCCc1cccc(Cl)c1Br Amb25953995 [0,1,0,0,0,0|0,0,0]=1 1328 B12R1.25 CNCCc1cccc(Cl)c1C Amb26358504 [0,1,0,0,0,0|1,0,0]=2 1329 B12R1.25 CNCCc1cccc(Cl)c1Cl Amb24460400 [0,1,0,0,0,0|0,1,0]=2 1330 B12R1.25 CNCCc1cccc(Cl)c1F Amb24407330 [0,1,0,0,0,0|0,1,0]=2 1331 B12R1.25 CNCCc1cccc(Cl)c1O Amb33056864 [0,1,0,0,0,0|1,0,0]=2 1332 B12R1.25 CNCCc1cccc(F)c1Br Amb25291460 [0,1,0,0,0,0|0,0,0]=1 1333 B12R1.25 CNCCc1cccc(F)c1C Amb27615200 [0,1,0,0,0,0|1,0,0]=2 1334 B12R1.25 CNCCc1cccc(F)c1Cl Amb27980761 [0,1,0,0,0,0|0,1,0]=2 1335 B12R1.25 CNCCc1cccc(F)c1F Amb18993051 [0,1,0,0,0,0|0,1,0]=2 1336 B12R1.25 CNCCc1cccc(F)c1O Amb28139875 [0,1,0,0,0,0|1,0,0]=2 1337 B12R1.25 CNCCc1cccc(O)c1Br Amb25331885 [0,1,0,0,0,0|0,0,0]=1 1338 B12R1.25 CNCCc1cccc(O)c1C Amb28061617 [0,1,0,0,0,0|1,0,0]=2 1339 B12R1.25 CNCCc1cccc(O)c1Cl Amb24497424 [0,1,0,0,0,0|0,1,0]=2 1340 B12R1.25 CNCCc1cccc(O)c1F Amb25080086 [0,1,0,0,0,0|0,1,0]=2 1341 B12R1.25 CNCCc1cccc(O)c1O Amb24664300 [0,1,0,0,0,0|1,0,0]=2 1342 B12R1.25 CN\C=N\c1cccc(Cl)c1C Amb27984928 [0,1,0,0,0,0|2,0,1]=4 1343 B12R1.25 CN\C=N\c1cccc(Cl)c1Cl Amb28252351 [0,1,0,0,0,0|1,1,1]=4 1344 B12R1.25 COCCN1C=CC=C(Br)C1=O Amb25036263 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.25 COCCN1C=CC=C(N)C1=O Amb18295567 [0,1,0,0,0,0|3,0,0]=4 1346 B12R1.25 COCCc1cccc(C)c1F Amb27586192 [0,1,0,0,0,0|1,1,0]=3 1347 B12R1.25 COCOc1cccc(C)c1F Amb27482279 [0,1,0,0,0,0|2,1,0]=4 1348 B12R1.25 COCOc1cccc(C)c1I Amb28127075 [0,1,0,0,0,0|2,1,0]=4 1349 B12R1.25 COCOc1cccc(C)c1O Amb27476261 [0,1,0,0,0,0|3,0,0]=4 1350 B12R1.25 COCOc1cccc(F)c1Br Amb24623278 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.25 COCOc1cccc(F)c1Cl Amb22546881 [0,1,0,0,0,0|2,1,0]=4 1352 B12R1.25 COCOc1cccc(F)c1F Amb22641752 [0,1,0,0,0,0|2,1,0]=4 1353 B12R1.25 COCOc1cccc(F)c1I Amb27448664 [0,1,0,0,0,0|2,1,0]=4 1354 B12R1.25 COCOc1cccc(O)c1F Amb27811367 [0,1,0,0,0,0|2,1,0]=4 1355 B12R1.25 COCOc1cncc(C)c1Br Amb27667896 [0,1,0,0,0,0|3,0,0]=4 1356 B12R1.25 CONCc1cccc(Br)c1C Amb28281686 [0,1,0,0,0,0|3,0,0]=4 1357 B12R1.25 CONCc1cccc(Cl)c1Cl Amb27483770 [0,1,0,0,0,0|2,1,0]=4 1358 B12R1.25 CONCc1cccc(Cl)c1O Amb28381434 [0,1,0,0,0,0|3,0,0]=4 1359 B12R1.25 CONCc1cccc(F)c1Cl Amb27833827 [0,1,0,0,0,0|2,1,0]=4 1360 B12R1.25 CONCc1cccc(F)c1F Amb27863298 [0,1,0,0,0,0|2,1,0]=4 1361 B12R1.25 CSCCN1C=CC=C(C)C1=O Amb27252901 [0,1,0,0,0,0|3,0,0]=4 1362 B12R1.25 CSCCN1C=CC=C(N)C1=O Amb26856519 [0,1,0,0,0,0|3,0,0]=4 1363 B12R1.25 Cc1c(Br)cccc1CCC#N Amb26616078 [0,1,0,0,0,0|3,0,0]=4 1364 B12R1.25 Cc1c(Br)cccc1CCC=O Amb26607997 [0,1,0,0,0,0|3,0,0]=4 1365 B12R1.25 Cc1c(Br)cccc1CCCBr Amb26532697 [0,1,0,0,0,0|3,0,0]=4 1366 B12R1.25 Cc1c(Br)cccc1CCCCl Amb24579173 [0,1,0,0,0,0|3,0,0]=4 1367 B12R1.25 Cc1c(Br)cccc1CCCN Amb27953077 [0,1,0,0,0,0|3,0,0]=4 1368 B12R1.25 Cc1c(Br)cccc1CCCO Amb32950654 [0,1,0,0,0,0|3,0,0]=4 1369 B12R1.25 Cc1c(Br)cccc1CCCS Amb33478017 [0,1,0,0,0,0|3,0,0]=4 1370 B12R1.25 Cc1c(Br)cccc1CCON Amb33476889 [0,1,0,0,0,0|3,0,0]=4 1371 B12R1.25 Cc1c(Cl)cccc1CCC#N Amb17204322 [0,1,0,0,0,0|3,0,0]=4 1372 B12R1.25 Cc1c(Cl)cccc1CCC=O Amb18564226 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.25 Cc1c(Cl)cccc1CCCBr Amb26914994 [0,1,0,0,0,0|3,0,0]=4 1374 B12R1.25 Cc1c(Cl)cccc1CCCCl Amb26444908 [0,1,0,0,0,0|3,0,0]=4 1375 B12R1.25 Cc1c(Cl)cccc1CCCN Amb17204335 [0,1,0,0,0,0|3,0,0]=4 1376 B12R1.25 Cc1c(F)cccc1CCC#N Amb25224723 [0,1,0,0,0,0|3,0,0]=4 1377 B12R1.25 Cc1c(F)cccc1CCC=O Amb25299267 [0,1,0,0,0,0|3,0,0]=4 1378 B12R1.25 Cc1c(F)cccc1CCCBr Amb27423786 [0,1,0,0,0,0|3,0,0]=4 1379 B12R1.25 Cc1c(F)cccc1CCCN Amb23442800 [0,1,0,0,0,0|3,0,0]=4 1380 B12R1.25 Cc1c(F)cccc1CCCO Amb23590885 [0,1,0,0,0,0|3,0,0]=4 1381 B12R1.25 Cc1c(F)cccc1CCCS Amb33428040 [0,1,0,0,0,0|3,0,0]=4 1382 B12R1.25 Cc1c(F)cccc1CCON Amb33372390 [0,1,0,0,0,0|3,0,0]=4 1383 B12R1.25 Cc1c(I)cccc1CCC#N Amb27787485 [0,1,0,0,0,0|3,0,0]=4 1384 B12R1.25 Cc1c(I)cccc1CCCBr Amb27423171 [0,1,0,0,0,0|3,0,0]=4 1385 B12R1.25 Cc1c(I)cccc1CCCCl Amb27258155 [0,1,0,0,0,0|3,0,0]=4 1386 B12R1.25 Cc1c(N)cccc1CCC#N Amb28196149 [0,1,0,0,0,0|3,0,0]=4 1387 B12R1.25 Cc1c(N)cccc1CCC=O Amb27624875 [0,1,0,0,0,0|3,0,0]=4 1388 B12R1.25 Cc1c(N)cccc1CCCBr Amb27616071 [0,1,0,0,0,0|3,0,0]=4 1389 B12R1.25 Cc1c(N)cccc1CCCCl Amb26057433 [0,1,0,0,0,0|3,0,0]=4 1390 B12R1.25 Cc1c(O)cccc1CCC=O Amb27199497 [0,1,0,0,0,0|3,0,0]=4 1391 B12R1.25 Cc1c(O)cccc1CCCBr Amb28198936 [0,1,0,0,0,0|3,0,0]=4 1392 B12R1.25 Cc1c(O)cccc1CCCCl Amb26617886 [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.25 Cc1c(O)cccc1CCCN Amb27641492 [0,1,0,0,0,0|3,0,0]=4 1394 B12R1.25 Cc1c(S)cccc1CCC=O Amb27623403 [0,1,0,0,0,0|3,0,0]=4 1395 B12R1.25 Cc1c(S)cccc1CCCCl Amb26617895 [0,1,0,0,0,0|3,0,0]=4 1396 B12R1.25 Cc1cccc(CCC#N)c1Br Amb28188208 [0,1,0,0,0,0|2,0,0]=3 1397 B12R1.25 Cc1cccc(CCC#N)c1C Amb17204304 [0,1,0,0,0,0|3,0,0]=4 1398 B12R1.25 Cc1cccc(CCC#N)c1Cl Amb25922219 [0,1,0,0,0,0|2,1,0]=4 1399 B12R1.25 Cc1cccc(CCC#N)c1F Amb26582339 [0,1,0,0,0,0|2,1,0]=4 1400 B12R1.25 Cc1cccc(CCC#N)c1I Amb27230837 [0,1,0,0,0,0|2,1,0]=4 1401 B12R1.25 Cc1cccc(CCC=O)c1Br Amb24532658 [0,1,0,0,0,0|2,0,0]=3 1402 B12R1.25 Cc1cccc(CCC=O)c1C Amb18563554 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.25 Cc1cccc(CCC=O)c1Cl Amb26880111 [0,1,0,0,0,0|2,1,0]=4 1404 B12R1.25 Cc1cccc(CCC=O)c1F Amb24093002 [0,1,0,0,0,0|2,1,0]=4 1405 B12R1.25 Cc1cccc(CCC=O)c1I Amb28251276 [0,1,0,0,0,0|2,1,0]=4 1406 B12R1.25 Cc1cccc(CCC=O)c1N Amb27847134 [0,1,0,0,0,0|3,0,0]=4 1407 B12R1.25 Cc1cccc(CCCBr)c1Br Amb25248971 [0,1,0,0,0,0|2,0,0]=3 1408 B12R1.25 Cc1cccc(CCCBr)c1C Amb26621550 [0,1,0,0,0,0|3,0,0]=4 1409 B12R1.25 Cc1cccc(CCCBr)c1Cl Amb25922221 [0,1,0,0,0,0|2,1,0]=4 1410 B12R1.25 Cc1cccc(CCCBr)c1F Amb27200488 [0,1,0,0,0,0|2,1,0]=4 1411 B12R1.25 Cc1cccc(CCCBr)c1I Amb28133805 [0,1,0,0,0,0|2,1,0]=4 1412 B12R1.25 Cc1cccc(CCCBr)c1N Amb27624874 [0,1,0,0,0,0|3,0,0]=4 1413 B12R1.25 Cc1cccc(CCCBr)c1O Amb25269813 [0,1,0,0,0,0|3,0,0]=4 1414 B12R1.25 Cc1cccc(CCCBr)c1S Amb25195138 [0,1,0,0,0,0|3,0,0]=4 1415 B12R1.25 Cc1cccc(CCCCl)c1C Amb25862381 [0,1,0,0,0,0|3,0,0]=4 1416 B12R1.25 Cc1cccc(CCCCl)c1Cl Amb24656579 [0,1,0,0,0,0|2,1,0]=4 1417 B12R1.25 Cc1cccc(CCCCl)c1F Amb27438334 [0,1,0,0,0,0|2,1,0]=4 1418 B12R1.25 Cc1cccc(CCCCl)c1I Amb26989872 [0,1,0,0,0,0|2,1,0]=4 1419 B12R1.25 Cc1cccc(CCCCl)c1N Amb26644373 [0,1,0,0,0,0|3,0,0]=4 1420 B12R1.25 Cc1cccc(CCCCl)c1S Amb27793916 [0,1,0,0,0,0|3,0,0]=4 1421 B12R1.25 Cc1cccc(CCCN)c1Br Amb28127011 [0,1,0,0,0,0|2,0,0]=3 1422 B12R1.25 Cc1cccc(CCCN)c1C Amb17204309 [0,1,0,0,0,0|3,0,0]=4 1423 B12R1.25 Cc1cccc(CCCN)c1Cl Amb25677548 [0,1,0,0,0,0|2,1,0]=4 1424 B12R1.25 Cc1cccc(CCCN)c1F Amb25135172 [0,1,0,0,0,0|2,1,0]=4 1425 B12R1.25 Cc1cccc(CCCN)c1O Amb27809091 [0,1,0,0,0,0|3,0,0]=4 1426 B12R1.25 Cc1cccc(CCCO)c1Br Amb25159971 [0,1,0,0,0,0|2,0,0]=3 1427 B12R1.25 Cc1cccc(CCCO)c1C Amb23537989 [0,1,0,0,0,0|3,0,0]=4 1428 B12R1.25 Cc1cccc(CCCO)c1F Amb26487243 [0,1,0,0,0,0|2,1,0]=4 1429 B12R1.25 Cc1cccc(CCCO)c1O Amb24671286 [0,1,0,0,0,0|3,0,0]=4 1430 B12R1.25 Cc1cccc(CCCS)c1C Amb33314450 [0,1,0,0,0,0|3,0,0]=4 1431 B12R1.25 Cc1cccc(CCCS)c1F Amb33324234 [0,1,0,0,0,0|2,1,0]=4 1432 B12R1.25 Cc1cccc(CCNN)c1C Amb17400169 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.25 Cc1cccc(CCON)c1C Amb33197958 [0,1,0,0,0,0|3,0,0]=4 1434 B12R1.25 Cc1cccc(CCON)c1F Amb33325035 [0,1,0,0,0,0|2,1,0]=4 1435 B12R1.25 Cc1cccc(CN=C=O)c1Br Amb28280081 [0,1,0,0,0,0|3,0,0]=4 1436 B12R1.25 Cc1cccc(NCCO)c1Br Amb25046066 [0,1,0,0,0,0|3,0,0]=4 1437 B12R1.25 Cc1cccc(OCCN)c1Br Amb26457225 [0,1,0,0,0,0|3,0,0]=4 1438 B12R1.25 ClCCCc1cccc(Br)c1Br Amb26645554 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.25 ClCCCc1cccc(Br)c1Cl Amb26424047 [0,1,0,0,0,0|2,1,0]=4 1440 B12R1.25 ClCCCc1cccc(Cl)c1Br Amb28323419 [0,1,0,0,0,0|2,0,0]=3 1441 B12R1.25 ClCCCc1cccc(Cl)c1Cl Amb24367464 [0,1,0,0,0,0|2,1,0]=4 1442 B12R1.25 ClCCCc1cccc(I)c1Br Amb25208583 [0,1,0,0,0,0|2,0,0]=3 1443 B12R1.25 Clc1c(Br)cccc1CCCBr Amb26617921 [0,1,0,0,0,0|2,1,0]=4 1444 B12R1.25 Clc1cccc(CCCBr)c1Br Amb27192633 [0,1,0,0,0,0|2,0,0]=3 1445 B12R1.25 Clc1cccc(CCCBr)c1Cl Amb24730274 [0,1,0,0,0,0|2,1,0]=4 1446 B12R1.25 Fc1c(Br)cccc1CCCBr Amb27587461 [0,1,0,0,0,0|2,1,0]=4 1447 B12R1.25 Fc1c(Br)cccc1CCCCl Amb26328571 [0,1,0,0,0,0|2,1,0]=4 1448 B12R1.25 Fc1c(Br)cccc1CCCS Amb33387365 [0,1,0,0,0,0|2,1,0]=4 1449 B12R1.25 Fc1c(Cl)cccc1CCCBr Amb26066699 [0,1,0,0,0,0|2,1,0]=4 1450 B12R1.25 Fc1c(Cl)cccc1CCCCl Amb27148806 [0,1,0,0,0,0|2,1,0]=4 1451 B12R1.25 Fc1c(Cl)cccc1CCCS Amb33223264 [0,1,0,0,0,0|2,1,0]=4 1452 B12R1.25 Fc1c(I)cccc1CCCCl Amb27880875 [0,1,0,0,0,0|2,1,0]=4 1453 B12R1.25 Fc1c(S)cccc1CCCBr Amb27798714 [0,1,0,0,0,0|2,1,0]=4 1454 B12R1.25 Fc1c(S)cccc1CCCCl Amb27423556 [0,1,0,0,0,0|2,1,0]=4 1455 B12R1.25 Fc1cccc(CCCBr)c1Br Amb25039114 [0,1,0,0,0,0|2,0,0]=3 1456 B12R1.25 Fc1cccc(CCCBr)c1Cl Amb27978793 [0,1,0,0,0,0|2,1,0]=4 1457 B12R1.25 Fc1cccc(CCCBr)c1F Amb22001598 [0,1,0,0,0,0|2,1,0]=4 1458 B12R1.25 Fc1cccc(CCCBr)c1S Amb27423554 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.25 Fc1cccc(CCCCl)c1Br Amb24566065 [0,1,0,0,0,0|2,0,0]=3 1460 B12R1.25 Fc1cccc(CCCCl)c1Cl Amb28207499 [0,1,0,0,0,0|2,1,0]=4 1461 B12R1.25 Fc1cccc(CCCCl)c1F Amb19073202 [0,1,0,0,0,0|2,1,0]=4 1462 B12R1.25 Fc1cccc(CCCCl)c1I Amb27423482 [0,1,0,0,0,0|2,1,0]=4 1463 B12R1.25 Fc1cccc(CCCS)c1Br Amb33477648 [0,1,0,0,0,0|2,0,0]=3 1464 B12R1.25 Fc1cccc(CCCS)c1F Amb33427378 [0,1,0,0,0,0|2,1,0]=4 1465 B12R1.25 N#CCCc1cccc(Br)c1Br Amb27636532 [0,1,0,0,0,0|2,0,0]=3 1466 B12R1.25 N#CCCc1cccc(Br)c1F Amb26449245 [0,1,0,0,0,0|2,1,0]=4 1467 B12R1.25 N#CCCc1cccc(Br)c1O Amb24586533 [0,1,0,0,0,0|3,0,0]=4 1468 B12R1.25 N#CCCc1cccc(Cl)c1Cl Amb17204388 [0,1,0,0,0,0|2,1,0]=4 1469 B12R1.25 N#CCCc1cccc(Cl)c1F Amb26573506 [0,1,0,0,0,0|2,1,0]=4 1470 B12R1.25 N#CCCc1cccc(Cl)c1I Amb27623454 [0,1,0,0,0,0|2,1,0]=4 1471 B12R1.25 N#CCCc1cccc(Cl)c1O Amb27798929 [0,1,0,0,0,0|3,0,0]=4 1472 B12R1.25 N#CCCc1cccc(F)c1Br Amb25258746 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.25 N#CCCc1cccc(F)c1Cl Amb24751316 [0,1,0,0,0,0|2,1,0]=4 1474 B12R1.25 N#CCCc1cccc(F)c1F Amb6297120 [0,1,0,0,0,0|2,1,0]=4 1475 B12R1.25 N#CCCc1cccc(F)c1I Amb27798712 [0,1,0,0,0,0|2,1,0]=4 1476 B12R1.25 N#CCCc1cccc(F)c1N Amb27614015 [0,1,0,0,0,0|3,0,0]=4 1477 B12R1.25 N#CCCc1cccc(F)c1O Amb26005429 [0,1,0,0,0,0|3,0,0]=4 1478 B12R1.25 N#CCCc1cccc(I)c1Br Amb27796622 [0,1,0,0,0,0|2,0,0]=3 1479 B12R1.25 N#CCCc1cccc(I)c1Cl Amb27441436 [0,1,0,0,0,0|2,1,0]=4 1480 B12R1.25 N#CCCc1cccc(I)c1F Amb27263037 [0,1,0,0,0,0|2,1,0]=4 1481 B12R1.25 N#CCCc1cccc(I)c1O Amb27871536 [0,1,0,0,0,0|3,0,0]=4 1482 B12R1.25 N#CCCc1cccc(N)c1F Amb27442126 [0,1,0,0,0,0|2,1,0]=4 1483 B12R1.25 N#CCCc1cccc(N)c1I Amb28196503 [0,1,0,0,0,0|2,1,0]=4 1484 B12R1.25 N#CCCc1cccc(O)c1Br Amb27613857 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.25 N#CCCc1cccc(O)c1Cl Amb27963205 [0,1,0,0,0,0|2,1,0]=4 1486 B12R1.25 N#CCCc1cccc(O)c1F Amb27423547 [0,1,0,0,0,0|2,1,0]=4 1487 B12R1.25 N#CCCc1cccc(O)c1O Amb24497134 [0,1,0,0,0,0|3,0,0]=4 1488 B12R1.25 N#CCCc1cccc(O)c1S Amb27423584 [0,1,0,0,0,0|3,0,0]=4 1489 B12R1.25 N#CCOc1cccc(N)c1Br Amb27450848 [0,1,0,0,0,0|3,0,0]=4 1490 B12R1.25 NCCCc1cccc(Br)c1Cl Amb26605865 [0,1,0,0,0,0|2,1,0]=4 1491 B12R1.25 NCCCc1cccc(Br)c1F Amb27450742 [0,1,0,0,0,0|2,1,0]=4 1492 B12R1.25 NCCCc1cccc(Br)c1O Amb25738591 [0,1,0,0,0,0|3,0,0]=4 1493 B12R1.25 NCCCc1cccc(Cl)c1Br Amb25320523 [0,1,0,0,0,0|2,0,0]=3 1494 B12R1.25 NCCCc1cccc(Cl)c1Cl Amb17204407 [0,1,0,0,0,0|2,1,0]=4 1495 B12R1.25 NCCCc1cccc(Cl)c1F Amb27768166 [0,1,0,0,0,0|2,1,0]=4 1496 B12R1.25 NCCCc1cccc(Cl)c1O Amb26940977 [0,1,0,0,0,0|3,0,0]=4 1497 B12R1.25 NCCCc1cccc(F)c1Br Amb25683566 [0,1,0,0,0,0|2,0,0]=3 1498 B12R1.25 NCCCc1cccc(F)c1Br Amb28465465 [0,1,0,0,0,0|2,0,0]=3 1499 B12R1.25 NCCCc1cccc(F)c1Cl Amb25957315 [0,1,0,0,0,0|2,1,0]=4 1500 B12R1.25 NCCCc1cccc(F)c1F Amb9524118 [0,1,0,0,0,0|2,1,0]=4 1501 B12R1.25 NCCCc1cccc(F)c1O Amb27251972 [0,1,0,0,0,0|3,0,0]=4 1502 B12R1.25 NCCCc1cccc(O)c1Br Amb27480867 [0,1,0,0,0,0|2,0,0]=3 1503 B12R1.25 NCCCc1cccc(O)c1Cl Amb26514553 [0,1,0,0,0,0|2,1,0]=4 1504 B12R1.25 NCCCc1cccc(O)c1F Amb25871603 [0,1,0,0,0,0|2,1,0]=4 1505 B12R1.25 NCCCc1cccc(O)c1O Amb24426748 [0,1,0,0,0,0|3,0,0]=4 1506 B12R1.25 NCCCc1cccc(O)c1O Amb34913247 [0,1,0,0,0,0|3,0,0]=4 1507 B12R1.25 NCCOc1cccc(Cl)c1Br Amb24686813 [0,1,0,0,0,0|3,0,0]=4 1508 B12R1.25 NCCOc1cccc(F)c1Br Amb26345510 [0,1,0,0,0,0|3,0,0]=4 1509 B12R1.25 NCCOc1cccc(O)c1Br Amb33386872 [0,1,0,0,0,0|3,0,0]=4 1510 B12R1.25 NNCCc1cccc(Cl)c1Cl Amb24751331 [0,1,0,0,0,0|1,1,0]=3 1511 B12R1.25 NOCCc1cccc(Br)c1F Amb33387314 [0,1,0,0,0,0|2,1,0]=4 1512 B12R1.25 NOCCc1cccc(Br)c1O Amb33332290 [0,1,0,0,0,0|3,0,0]=4 1513 B12R1.25 NOCCc1cccc(Cl)c1Cl Amb33057740 [0,1,0,0,0,0|2,1,0]=4 1514 B12R1.25 NOCCc1cccc(Cl)c1F Amb33223012 [0,1,0,0,0,0|2,1,0]=4 1515 B12R1.25 NOCCc1cccc(Cl)c1O Amb33056896 [0,1,0,0,0,0|3,0,0]=4 1516 B12R1.25 NOCCc1cccc(F)c1Br Amb33450528 [0,1,0,0,0,0|2,0,0]=3 1517 B12R1.25 NOCCc1cccc(F)c1F Amb24497503 [0,1,0,0,0,0|2,1,0]=4 1518 B12R1.25 NOCCc1cccc(F)c1O Amb33310939 [0,1,0,0,0,0|3,0,0]=4 1519 B12R1.25 NOCCc1cccc(O)c1Br Amb33386795 [0,1,0,0,0,0|2,0,0]=3 1520 B12R1.25 NOCCc1cccc(O)c1O Amb33225044 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.25 Nc1c(Br)cccc1CCCBr Amb25270390 [0,1,0,0,0,0|3,0,0]=4 1522 B12R1.25 Nc1c(Br)cccc1CCCCl Amb28133088 [0,1,0,0,0,0|3,0,0]=4 1523 B12R1.25 Nc1c(F)cccc1CCCBr Amb27963212 [0,1,0,0,0,0|3,0,0]=4 1524 B12R1.25 Nc1c(F)cccc1CCCCl Amb27614020 [0,1,0,0,0,0|3,0,0]=4 1525 B12R1.25 Nc1c(I)cccc1CCCBr Amb27634248 [0,1,0,0,0,0|3,0,0]=4 1526 B12R1.25 Nc1c(O)cccc1CCCBr Amb27963108 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.25 Nc1c(S)cccc1CCCBr Amb28199233 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.25 Nc1c(S)cccc1CCCCl Amb27633721 [0,1,0,0,0,0|3,0,0]=4 1529 B12R1.25 Nc1cccc(CCC=O)c1N Amb27246821 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.25 Nc1cccc(CCC=O)c1O Amb27215519 [0,1,0,0,0,0|3,0,0]=4 1531 B12R1.25 Nc1cccc(CCCBr)c1Br Amb27793936 [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.25 Nc1cccc(CCCBr)c1F Amb27851682 [0,1,0,0,0,0|2,1,0]=4 1533 B12R1.25 Nc1cccc(CCCBr)c1N Amb27209374 [0,1,0,0,0,0|3,0,0]=4 1534 B12R1.25 Nc1cccc(CCCBr)c1S Amb27846982 [0,1,0,0,0,0|3,0,0]=4 1535 B12R1.25 Nc1cccc(CCCCl)c1Br Amb26023355 [0,1,0,0,0,0|2,0,0]=3 1536 B12R1.25 Nc1cccc(CCCCl)c1F Amb27193834 [0,1,0,0,0,0|2,1,0]=4 1537 B12R1.25 Nc1cccc(CCCCl)c1S Amb28208570 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.25 Nc1cccc(OCCO)c1Br Amb28434490 [0,1,0,0,0,0|3,0,0]=4 1539 B12R1.25 O=C=NCc1cccc(F)c1Br Amb26626862 [0,1,0,0,0,0|3,0,0]=4 1540 B12R1.25 O=CCCc1cccc(Br)c1Br Amb26844644 [0,1,0,0,0,0|2,0,0]=3 1541 B12R1.25 O=CCCc1cccc(Br)c1Cl Amb24483778 [0,1,0,0,0,0|2,1,0]=4 1542 B12R1.25 O=CCCc1cccc(Br)c1F Amb25739079 [0,1,0,0,0,0|2,1,0]=4 1543 B12R1.25 O=CCCc1cccc(Br)c1I Amb26880680 [0,1,0,0,0,0|2,1,0]=4 1544 B12R1.25 O=CCCc1cccc(Br)c1O Amb24728306 [0,1,0,0,0,0|3,0,0]=4 1545 B12R1.25 O=CCCc1cccc(Cl)c1Cl Amb18066576 [0,1,0,0,0,0|2,1,0]=4 1546 B12R1.25 O=CCCc1cccc(Cl)c1F Amb26315353 [0,1,0,0,0,0|2,1,0]=4 1547 B12R1.25 O=CCCc1cccc(Cl)c1I Amb26935759 [0,1,0,0,0,0|2,1,0]=4 1548 B12R1.25 O=CCCc1cccc(Cl)c1O Amb26898533 [0,1,0,0,0,0|3,0,0]=4 1549 B12R1.25 O=CCCc1cccc(F)c1Br Amb27876559 [0,1,0,0,0,0|2,0,0]=3 1550 B12R1.25 O=CCCc1cccc(F)c1Cl Amb27798762 [0,1,0,0,0,0|2,1,0]=4 1551 B12R1.25 O=CCCc1cccc(F)c1F Amb18801722 [0,1,0,0,0,0|2,1,0]=4 1552 B12R1.25 O=CCCc1cccc(F)c1I Amb26880769 [0,1,0,0,0,0|2,1,0]=4 1553 B12R1.25 O=CCCc1cccc(F)c1O Amb26339327 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.25 O=CCCc1cccc(I)c1Br Amb25890570 [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.25 O=CCCc1cccc(I)c1Cl Amb28119151 [0,1,0,0,0,0|2,1,0]=4 1556 B12R1.25 O=CCCc1cccc(I)c1I Amb27633745 [0,1,0,0,0,0|2,1,0]=4 1557 B12R1.25 O=CCCc1cccc(I)c1O Amb27800783 [0,1,0,0,0,0|3,0,0]=4 1558 B12R1.25 O=CCCc1cccc(O)c1Br Amb28123651 [0,1,0,0,0,0|2,0,0]=3 1559 B12R1.25 O=CCCc1cccc(O)c1Cl Amb27632383 [0,1,0,0,0,0|2,1,0]=4 1560 B12R1.25 O=CCCc1cccc(O)c1F Amb25831101 [0,1,0,0,0,0|2,1,0]=4 1561 B12R1.25 O=CCCc1cccc(O)c1I Amb26645175 [0,1,0,0,0,0|2,1,0]=4 1562 B12R1.25 O=CCCc1cccc(O)c1O Amb27192383 [0,1,0,0,0,0|3,0,0]=4 1563 B12R1.25 O=CCCc1cccc(O)c1S Amb27423590 [0,1,0,0,0,0|3,0,0]=4 1564 B12R1.25 O=CCCc1cccc(S)c1Br Amb27964574 [0,1,0,0,0,0|2,0,0]=3 1565 B12R1.25 O=CCCc1cccc(S)c1Cl Amb28196073 [0,1,0,0,0,0|2,1,0]=4 1566 B12R1.25 O=CCCc1cccc(S)c1O Amb27965652 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.25 O=CCCc1cccc(S)c1S Amb28196024 [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.25 OCCCc1cccc(Br)c1F Amb28244244 [0,1,0,0,0,0|2,1,0]=4 1569 B12R1.25 OCCCc1cccc(Br)c1O Amb33332585 [0,1,0,0,0,0|3,0,0]=4 1570 B12R1.25 OCCCc1cccc(Cl)c1Br Amb32950162 [0,1,0,0,0,0|2,0,0]=3 1571 B12R1.25 OCCCc1cccc(Cl)c1Cl Amb17605780 [0,1,0,0,0,0|2,1,0]=4 1572 B12R1.25 OCCCc1cccc(Cl)c1F Amb24402092 [0,1,0,0,0,0|2,1,0]=4 1573 B12R1.25 OCCCc1cccc(Cl)c1O Amb25098650 [0,1,0,0,0,0|3,0,0]=4 1574 B12R1.25 OCCCc1cccc(F)c1Br Amb25834826 [0,1,0,0,0,0|2,0,0]=3 1575 B12R1.25 OCCCc1cccc(F)c1Cl Amb25136399 [0,1,0,0,0,0|2,1,0]=4 1576 B12R1.25 OCCCc1cccc(F)c1F Amb18802844 [0,1,0,0,0,0|2,1,0]=4 1577 B12R1.25 OCCCc1cccc(F)c1O Amb24551042 [0,1,0,0,0,0|3,0,0]=4 1578 B12R1.25 OCCCc1cccc(O)c1Br Amb33386870 [0,1,0,0,0,0|2,0,0]=3 1579 B12R1.25 OCCCc1cccc(O)c1O Amb25063876 [0,1,0,0,0,0|3,0,0]=4 1580 B12R1.25 OCCNc1cccc(Cl)c1Br Amb24271233 [0,1,0,0,0,0|3,0,0]=4 1581 B12R1.25 Oc1c(Br)cccc1CCCBr Amb27613859 [0,1,0,0,0,0|3,0,0]=4 1582 B12R1.25 Oc1c(Br)cccc1CCCS Amb33332605 [0,1,0,0,0,0|3,0,0]=4 1583 B12R1.25 Oc1c(Cl)cccc1CCCBr Amb24759296 [0,1,0,0,0,0|3,0,0]=4 1584 B12R1.25 Oc1c(Cl)cccc1CCCS Amb33057231 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.25 Oc1c(F)cccc1CCCBr Amb27423566 [0,1,0,0,0,0|3,0,0]=4 1586 B12R1.25 Oc1c(F)cccc1CCCCl Amb28134080 [0,1,0,0,0,0|3,0,0]=4 1587 B12R1.25 Oc1c(F)cccc1CCCS Amb33310588 [0,1,0,0,0,0|3,0,0]=4 1588 B12R1.25 Oc1c(I)cccc1CCCCl Amb27624175 [0,1,0,0,0,0|3,0,0]=4 1589 B12R1.25 Oc1cccc(CCCBr)c1Br Amb25325193 [0,1,0,0,0,0|2,0,0]=3 1590 B12R1.25 Oc1cccc(CCCBr)c1Cl Amb27428167 [0,1,0,0,0,0|2,1,0]=4 1591 B12R1.25 Oc1cccc(CCCBr)c1O Amb27192379 [0,1,0,0,0,0|3,0,0]=4 1592 B12R1.25 Oc1cccc(CCCCl)c1Br Amb24638371 [0,1,0,0,0,0|2,0,0]=3 1593 B12R1.25 Oc1cccc(CCCCl)c1Cl Amb27428169 [0,1,0,0,0,0|2,1,0]=4 1594 B12R1.25 Oc1cccc(CCCCl)c1F Amb27423572 [0,1,0,0,0,0|2,1,0]=4 1595 B12R1.25 Oc1cccc(CCCCl)c1O Amb27225085 [0,1,0,0,0,0|3,0,0]=4 1596 B12R1.25 Oc1cccc(CCCCl)c1S Amb27423587 [0,1,0,0,0,0|3,0,0]=4 1597 B12R1.25 Oc1cccc(CCCS)c1Br Amb33386847 [0,1,0,0,0,0|2,0,0]=3 1598 B12R1.25 Oc1cccc(CCCS)c1O Amb33267639 [0,1,0,0,0,0|3,0,0]=4 1599 B12R1.25 SCCCc1cccc(Cl)c1Cl Amb33057791 [0,1,0,0,0,0|2,1,0]=4 1600 B12R1.25 Sc1c(Br)cccc1CCCBr Amb27795311 [0,1,0,0,0,0|3,0,0]=4 1601 B12R1.25 Sc1c(Br)cccc1CCCCl Amb26905842 [0,1,0,0,0,0|3,0,0]=4 1602 B12R1.25 Sc1c(Cl)cccc1CCCBr Amb27200569 [0,1,0,0,0,0|3,0,0]=4 1603 B12R1.25 Sc1c(Cl)cccc1CCCCl Amb27199201 [0,1,0,0,0,0|3,0,0]=4 1604 B12R1.25 Sc1cccc(CCCBr)c1Br Amb27613897 [0,1,0,0,0,0|2,0,0]=3 1605 B12R1.25 Sc1cccc(CCCCl)c1Br Amb26952748 [0,1,0,0,0,0|2,0,0]=3 1606 B12R1.25 [C-]#[N+]CCc1cccc(Br)c1C Amb33389370 [0,1,0,0,0,0|1,0,2]=4 1607 B12R1.25 [C-]#[N+]CCc1cccc(Br)c1F Amb33386558 [0,1,0,0,0,0|0,1,2]=4 1608 B12R1.25 [C-]#[N+]CCc1cccc(C)c1C Amb33199871 [0,1,0,0,0,0|1,0,2]=4 1609 B12R1.25 [C-]#[N+]CCc1cccc(C)c1F Amb33325053 [0,1,0,0,0,0|0,1,2]=4 1610 B12R1.25 [C-]#[N+]CCc1cccc(Cl)c1Cl Amb33057717 [0,1,0,0,0,0|0,1,2]=4 1611 B12R1.25 [C-]#[N+]CCc1cccc(Cl)c1F Amb33222968 [0,1,0,0,0,0|0,1,2]=4 1612 B12R1.25 [C-]#[N+]CCc1cccc(F)c1Br Amb33450562 [0,1,0,0,0,0|0,0,2]=3 1613 B12R1.25 [C-]#[N+]CCc1cccc(F)c1C Amb33372427 [0,1,0,0,0,0|1,0,2]=4 1614 B12R1.25 [C-]#[N+]CCc1cccc(F)c1F Amb33425951 [0,1,0,0,0,0|0,1,2]=4 1615 B12R1.25 [N-]=[N+]=NCc1cccc(F)c1Br Amb24356376 [0,1,0,0,0,0|2,0,1]=4 1616 B12R1.25 [N-]=[N+]=NCc1cccc(O)c1Br Amb33386824 [0,1,0,0,0,0|2,0,1]=4 1617 B12R1.69 BrCCCc1ccc(Br)cc1I Amb25248923 [0,1,0,0,0,0|2,1,0]=4 1618 B12R1.69 C#CCCc1ccc(Br)cc1Br Amb33383300 [0,1,0,0,0,0|1,0,1]=3 1619 B12R1.69 C#CCCc1ccc(Br)cc1C Amb33435316 [0,1,0,0,0,0|2,0,1]=4 1620 B12R1.69 C#CCCc1ccc(Br)cc1Cl Amb33334525 [0,1,0,0,0,0|1,1,1]=4 1621 B12R1.69 C#CCCc1ccc(Br)cc1F Amb33477053 [0,1,0,0,0,0|1,1,1]=4 1622 B12R1.69 C#CCCc1ccc(Br)cc1O Amb33389632 [0,1,0,0,0,0|2,0,1]=4 1623 B12R1.69 C#CCCc1ccc(C)cc1Br Amb33387280 [0,1,0,0,0,0|1,0,1]=3 1624 B12R1.69 C#CCCc1ccc(C)cc1C Amb33313083 [0,1,0,0,0,0|2,0,1]=4 1625 B12R1.69 C#CCCc1ccc(C)cc1Cl Amb33058527 [0,1,0,0,0,0|1,1,1]=4 1626 B12R1.69 C#CCCc1ccc(C)cc1F Amb33324276 [0,1,0,0,0,0|1,1,1]=4 1627 B12R1.69 C#CCCc1ccc(C)cc1O Amb33425620 [0,1,0,0,0,0|2,0,1]=4 1628 B12R1.69 C#CCCc1ccc(Cl)cc1Br Amb33450196 [0,1,0,0,0,0|1,0,1]=3 1629 B12R1.69 C#CCCc1ccc(Cl)cc1C Amb33413508 [0,1,0,0,0,0|2,0,1]=4 1630 B12R1.69 C#CCCc1ccc(Cl)cc1Cl Amb18634789 [0,1,0,0,0,0|1,1,1]=4 1631 B12R1.69 C#CCCc1ccc(Cl)cc1F Amb33220826 [0,1,0,0,0,0|1,1,1]=4 1632 B12R1.69 C#CCCc1ccc(Cl)cc1O Amb33260839 [0,1,0,0,0,0|2,0,1]=4 1633 B12R1.69 C#CCCc1ccc(F)cc1Br Amb33334172 [0,1,0,0,0,0|1,0,1]=3 1634 B12R1.69 C#CCCc1ccc(F)cc1C Amb33380176 [0,1,0,0,0,0|2,0,1]=4 1635 B12R1.69 C#CCCc1ccc(F)cc1Cl Amb33258084 [0,1,0,0,0,0|1,1,1]=4 1636 B12R1.69 C#CCCc1ccc(F)cc1F Amb33195993 [0,1,0,0,0,0|1,1,1]=4 1637 B12R1.69 C#CCCc1ccc(O)cc1Cl Amb33056602 [0,1,0,0,0,0|1,1,1]=4 1638 B12R1.69 C#CCCc1ccc(O)cc1F Amb33376537 [0,1,0,0,0,0|1,1,1]=4 1639 B12R1.69 C#CCCc1ccc(O)cc1O Amb33269276 [0,1,0,0,0,0|2,0,1]=4 1640 B12R1.69 C#CCCc1ncc(Br)cc1Br Amb33433309 [0,1,0,0,0,0|2,0,1]=4 1641 B12R1.69 C#CCNc1ccc(Cl)cc1Br Amb28207704 [0,1,0,0,0,0|2,0,1]=4 1642 B12R1.69 C#CCNc1ccc(I)cc1Br Amb27628305 [0,1,0,0,0,0|2,0,1]=4 1643 B12R1.69 C#CCOc1ccc(Cl)cc1Br Amb28129077 [0,1,0,0,0,0|2,0,1]=4 1644 B12R1.69 C=CCCc1ccc(Br)cc1F Amb28368315 [0,1,0,0,0,0|1,1,1]=4 1645 B12R1.69 C=CCCc1ccc(C)cc1C Amb6299298 [0,1,0,0,0,0|2,0,1]=4 1646 B12R1.69 C=CCCc1ccc(C)cc1Cl Amb27954390 [0,1,0,0,0,0|1,1,1]=4 1647 B12R1.69 C=CCCc1ccc(Cl)cc1F Amb27831897 [0,1,0,0,0,0|1,1,1]=4 1648 B12R1.69 C=CCCc1ccc(F)cc1C Amb28186153 [0,1,0,0,0,0|2,0,1]=4 1649 B12R1.69 C=CCNc1ccc(Br)cc1Br Amb27760816 [0,1,0,0,0,0|2,0,1]=4 1650 B12R1.69 C=CCOc1ccc(Br)cc1Br Amb4422144 [0,1,0,0,0,0|2,0,1]=4 1651 B12R1.69 C=CCOc1ccc(C)cc1Br Amb6717110 [0,1,0,0,0,0|2,0,1]=4 1652 B12R1.69 C=CCOc1ccc(Cl)cc1Br Amb17259614 [0,1,0,0,0,0|2,0,1]=4 1653 B12R1.69 C=CCOc1ccc(F)cc1Br Amb6278845 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.69 CCCCC1=C(C)NC(=O)C=C1 Amb28388597 [0,1,0,0,0,0|3,0,0]=4 1655 B12R1.69 CCCCC1=C(Cl)OC(=O)C=C1 Amb27840648 [0,1,0,0,0,0|2,1,0]=4 1656 B12R1.69 CCCCN1C=CC(=O)C=C1Cl Amb27457348 [0,1,0,0,0,0|2,1,0]=4 1657 B12R1.69 CCCCN1C=CC(Br)=CC1=O Amb24645127 [0,1,0,0,0,0|3,0,0]=4 1658 B12R1.69 CCCCN1C=CC(C)=CC1=O Amb18403659 [0,1,0,0,0,0|3,0,0]=4 1659 B12R1.69 CCCCc1ccc(C)nc1N Amb35713104 [0,1,0,0,0,0|3,0,0]=4 1660 B12R1.69 CCCCc1ccc(I)cc1N Amb28287217 [0,1,0,0,0,0|2,0,0]=3 1661 B12R1.69 CCCCc1ccc(N)cc1C Amb26517027 [0,1,0,0,0,0|2,0,0]=3 1662 B12R1.69 CCCCc1ccc(N)cc1Cl Amb25858096 [0,1,0,0,0,0|1,1,0]=3 1663 B12R1.69 CCCCc1ccc(N)cc1N Amb28245267 [0,1,0,0,0,0|2,0,0]=3 1664 B12R1.69 CCCCc1ccc(N)cc1O Amb28250041 [0,1,0,0,0,0|2,0,0]=3 1665 B12R1.69 CCCCc1ccc(O)cc1F Amb28248864 [0,1,0,0,0,0|1,1,0]=3 1666 B12R1.69 CCCCc1ccc(O)cc1O Amb8393298 [0,1,0,0,0,0|2,0,0]=3 1667 B12R1.69 CCCCc1cnc(N)cc1C Amb27803388 [0,1,0,0,0,0|3,0,0]=4 1668 B12R1.69 CCCCc1cnc(O)cc1O Amb23570643 [0,1,0,0,0,0|3,0,0]=4 1669 B12R1.69 CCCCc1ncc(Br)cc1N Amb24361500 [0,1,0,0,0,0|3,0,0]=4 1670 B12R1.69 CCCCc1ncc(C)cc1N Amb24673024 [0,1,0,0,0,0|3,0,0]=4 1671 B12R1.69 CCCCc1ncc(Cl)cc1N Amb24657067 [0,1,0,0,0,0|3,0,0]=4 1672 B12R1.69 CCCCc1ncc(F)cc1N Amb24563181 [0,1,0,0,0,0|3,0,0]=4 1673 B12R1.69 CCCCc1ncc(N)cc1Br Amb27753939 [0,1,0,0,0,0|2,0,0]=3 1674 B12R1.69 CCCCc1ncc(N)cc1C Amb25974813 [0,1,0,0,0,0|3,0,0]=4 1675 B12R1.69 CCCCc1ncc(N)cc1Cl Amb26632378 [0,1,0,0,0,0|2,1,0]=4 1676 B12R1.69 CCCNc1ccc(Br)cc1C Amb6690047 [0,1,0,0,0,0|3,0,0]=4 1677 B12R1.69 CCCNc1ccc(Br)cc1Cl Amb30584837 [0,1,0,0,0,0|2,1,0]=4 1678 B12R1.69 CCCNc1ccc(Br)cc1Cl Amb9000418 [0,1,0,0,0,0|2,1,0]=4 1679 B12R1.69 CCCNc1ccc(Br)cc1N Amb7767450 [0,1,0,0,0,0|3,0,0]=4 1680 B12R1.69 CCCNc1ccc(C)cc1Br Amb6688269 [0,1,0,0,0,0|2,0,0]=3 1681 B12R1.69 CCCNc1ccc(C)cc1C Amb4313506 [0,1,0,0,0,0|3,0,0]=4 1682 B12R1.69 CCCNc1ccc(C)cc1Cl Amb7780594 [0,1,0,0,0,0|2,1,0]=4 1683 B12R1.69 CCCNc1ccc(C)cc1N Amb9002761 [0,1,0,0,0,0|3,0,0]=4 1684 B12R1.69 CCCNc1ccc(Cl)cc1C Amb6610047 [0,1,0,0,0,0|3,0,0]=4 1685 B12R1.69 CCCNc1ccc(Cl)cc1Cl Amb6639162 [0,1,0,0,0,0|2,1,0]=4 1686 B12R1.69 CCCNc1ccc(Cl)cc1F Amb9582472 [0,1,0,0,0,0|2,1,0]=4 1687 B12R1.69 CCCNc1ccc(Cl)cc1N Amb7767457 [0,1,0,0,0,0|3,0,0]=4 1688 B12R1.69 CCCNc1ccc(F)cc1Cl Amb7808035 [0,1,0,0,0,0|2,1,0]=4 1689 B12R1.69 CCCNc1ccc(F)cc1F Amb6698329 [0,1,0,0,0,0|2,1,0]=4 1690 B12R1.69 CCCNc1ccc(F)cc1I Amb27881381 [0,1,0,0,0,0|2,1,0]=4 1691 B12R1.69 CCCNc1ccc(F)cc1N Amb845869 [0,1,0,0,0,0|3,0,0]=4 1692 B12R1.69 CCCNc1ccc(I)cc1Br Amb27465186 [0,1,0,0,0,0|2,0,0]=3 1693 B12R1.69 CCCNc1ccc(I)cc1F Amb35597038 [0,1,0,0,0,0|2,1,0]=4 1694 B12R1.69 CCCNc1ccc(N)cc1F Amb845921 [0,1,0,0,0,0|2,1,0]=4 1695 B12R1.69 CCCNc1ccc(N)cc1I Amb27408784 [0,1,0,0,0,0|2,1,0]=4 1696 B12R1.69 CCCNc1ccc(O)cc1C Amb27614719 [0,1,0,0,0,0|3,0,0]=4 1697 B12R1.69 CCCNc1ccc(O)cc1Cl Amb35735282 [0,1,0,0,0,0|2,1,0]=4 1698 B12R1.69 CCCNc1ncc(C)cc1Br Amb18227744 [0,1,0,0,0,0|3,0,0]=4 1699 B12R1.69 CCCNc1ncc(N)cc1Br Amb17213693 [0,1,0,0,0,0|3,0,0]=4 1700 B12R1.69 CCCOc1ccc(Br)cc1C Amb25323749 [0,1,0,0,0,0|3,0,0]=4 1701 B12R1.69 CCCOc1ccc(Br)cc1Cl Amb28119263 [0,1,0,0,0,0|2,1,0]=4 1702 B12R1.69 CCCOc1ccc(Br)cc1F Amb10607074 [0,1,0,0,0,0|2,1,0]=4 1703 B12R1.69 CCCOc1ccc(Br)cc1N Amb8874531 [0,1,0,0,0,0|3,0,0]=4 1704 B12R1.69 CCCOc1ccc(Br)cc1S Amb25342159 [0,1,0,0,0,0|3,0,0]=4 1705 B12R1.69 CCCOc1ccc(C)cc1Br Amb6717096 [0,1,0,0,0,0|2,0,0]=3 1706 B12R1.69 CCCOc1ccc(C)cc1N Amb840315 [0,1,0,0,0,0|3,0,0]=4 1707 B12R1.69 CCCOc1ccc(C)cc1S Amb24688543 [0,1,0,0,0,0|3,0,0]=4 1708 B12R1.69 CCCOc1ccc(Cl)cc1Br Amb17261136 [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.69 CCCOc1ccc(Cl)cc1F Amb27468493 [0,1,0,0,0,0|2,1,0]=4 1710 B12R1.69 CCCOc1ccc(Cl)cc1N Amb840193 [0,1,0,0,0,0|3,0,0]=4 1711 B12R1.69 CCCOc1ccc(F)cc1Br Amb6269501 [0,1,0,0,0,0|2,0,0]=3 1712 B12R1.69 CCCOc1ccc(F)cc1F Amb2782302 [0,1,0,0,0,0|2,1,0]=4 1713 B12R1.69 CCCOc1ccc(F)cc1N Amb8874529 [0,1,0,0,0,0|3,0,0]=4 1714 B12R1.69 CCCOc1ccc(F)cc1S Amb24640815 [0,1,0,0,0,0|3,0,0]=4 1715 B12R1.69 CCCOc1ccc(I)cc1N Amb18057209 [0,1,0,0,0,0|3,0,0]=4 1716 B12R1.69 CCCOc1ccc(I)cc1S Amb28289534 [0,1,0,0,0,0|3,0,0]=4 1717 B12R1.69 CCCOc1ccc(N)cc1Br Amb18293616 [0,1,0,0,0,0|2,0,0]=3 1718 B12R1.69 CCCOc1ccc(N)cc1C Amb21954722 [0,1,0,0,0,0|3,0,0]=4 1719 B12R1.69 CCCOc1ccc(N)cc1C Amb8439149 [0,1,0,0,0,0|3,0,0]=4 1720 B12R1.69 CCCOc1ccc(N)cc1Cl Amb1141135 [0,1,0,0,0,0|2,1,0]=4 1721 B12R1.69 CCCOc1ccc(N)cc1Cl Amb8627522 [0,1,0,0,0,0|2,1,0]=4 1722 B12R1.69 CCCOc1ccc(N)cc1F Amb8874525 [0,1,0,0,0,0|2,1,0]=4 1723 B12R1.69 CCCOc1ccc(N)cc1I Amb26950528 [0,1,0,0,0,0|2,1,0]=4 1724 B12R1.69 CCCOc1ccc(O)cc1Br Amb28244202 [0,1,0,0,0,0|2,0,0]=3 1725 B12R1.69 CCCOc1ccc(O)cc1Cl Amb17202481 [0,1,0,0,0,0|2,1,0]=4 1726 B12R1.69 CCCOc1ccc(O)cc1F Amb27783538 [0,1,0,0,0,0|2,1,0]=4 1727 B12R1.69 CCCOc1ccc(O)cc1S Amb26996271 [0,1,0,0,0,0|3,0,0]=4 1728 B12R1.69 CCCOc1ccc(S)cc1C Amb26644076 [0,1,0,0,0,0|3,0,0]=4 1729 B12R1.69 CCCOc1ccc(S)cc1Cl Amb25669642 [0,1,0,0,0,0|2,1,0]=4 1730 B12R1.69 CCCOc1ccc(S)cc1F Amb25359884 [0,1,0,0,0,0|2,1,0]=4 1731 B12R1.69 CCCOc1ncc(Br)cc1Br Amb24317465 [0,1,0,0,0,0|3,0,0]=4 1732 B12R1.69 CCCOc1ncc(C)cc1Br Amb28196302 [0,1,0,0,0,0|3,0,0]=4 1733 B12R1.69 CCCOc1ncc(N)cc1Br Amb27459565 [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.69 CCCSc1ccc(N)cc1F Amb7783536 [0,1,0,0,0,0|2,1,0]=4 1735 B12R1.69 CCCSc1ccc(O)cc1Cl Amb27193044 [0,1,0,0,0,0|2,1,0]=4 1736 B12R1.69 CCNCc1ccc(Br)cc1O Amb35609050 [0,1,0,0,0,0|3,0,0]=4 1737 B12R1.69 CCNCc1ccc(C)cc1Br Amb28243796 [0,1,0,0,0,0|2,0,0]=3 1738 B12R1.69 CCNCc1ccc(C)cc1C Amb6276679 [0,1,0,0,0,0|3,0,0]=4 1739 B12R1.69 CCNCc1ccc(C)cc1O Amb28077801 [0,1,0,0,0,0|3,0,0]=4 1740 B12R1.69 CCNCc1ccc(Cl)cc1Cl Amb838328 [0,1,0,0,0,0|2,1,0]=4 1741 B12R1.69 CCNCc1ccc(Cl)cc1F Amb8853700 [0,1,0,0,0,0|2,1,0]=4 1742 B12R1.69 CCNCc1ccc(F)cc1C Amb18295698 [0,1,0,0,0,0|3,0,0]=4 1743 B12R1.69 CCNCc1ccc(F)cc1F Amb6273308 [0,1,0,0,0,0|2,1,0]=4 1744 B12R1.69 CCNCc1ccc(O)cc1O Amb6279180 [0,1,0,0,0,0|3,0,0]=4 1745 B12R1.69 CCOCc1ccc(Br)cc1Cl Amb27592032 [0,1,0,0,0,0|2,1,0]=4 1746 B12R1.69 CCOCc1ccc(Br)cc1F Amb22900163 [0,1,0,0,0,0|2,1,0]=4 1747 B12R1.69 CCOCc1ccc(F)cc1Br Amb22900189 [0,1,0,0,0,0|2,0,0]=3 1748 B12R1.69 CCOCc1ccc(F)cc1N Amb27175752 [0,1,0,0,0,0|3,0,0]=4 1749 B12R1.69 CCOCc1ccc(N)cc1Cl Amb18294632 [0,1,0,0,0,0|2,1,0]=4 1750 B12R1.69 CCSCc1ccc(Br)cc1F Amb27198669 [0,1,0,0,0,0|2,1,0]=4 1751 B12R1.69 CCSCc1ccc(Cl)cc1Cl Amb25334440 [0,1,0,0,0,0|2,1,0]=4 1752 B12R1.69 CCSCc1ccc(F)cc1Cl Amb28187456 [0,1,0,0,0,0|2,1,0]=4 1753 B12R1.69 CCSCc1ccc(F)cc1F Amb26346379 [0,1,0,0,0,0|2,1,0]=4 1754 B12R1.69 CNCCN1N=CC(C)=CC1=O Amb27615379 [0,1,0,0,0,0|3,0,0]=4 1755 B12R1.69 CNCCc1ccc(Br)cc1C Amb25135302 [0,1,0,0,0,0|1,0,0]=2 1756 B12R1.69 CNCCc1ccc(Br)cc1Cl Amb24415809 [0,1,0,0,0,0|0,1,0]=2 1757 B12R1.69 CNCCc1ccc(Br)cc1F Amb16230489 [0,1,0,0,0,0|0,1,0]=2 1758 B12R1.69 CNCCc1ccc(Br)cc1O Amb33389524 [0,1,0,0,0,0|1,0,0]=2 1759 B12R1.69 CNCCc1ccc(C)cc1Br Amb25235798 [0,1,0,0,0,0|0,0,0]=1 1760 B12R1.69 CNCCc1ccc(C)cc1C Amb17400139 [0,1,0,0,0,0|1,0,0]=2 1761 B12R1.69 CNCCc1ccc(C)cc1Cl Amb25850179 [0,1,0,0,0,0|0,1,0]=2 1762 B12R1.69 CNCCc1ccc(C)cc1F Amb26879900 [0,1,0,0,0,0|0,1,0]=2 1763 B12R1.69 CNCCc1ccc(C)cc1O Amb25777142 [0,1,0,0,0,0|1,0,0]=2 1764 B12R1.69 CNCCc1ccc(C)nc1Cl Amb33259877 [0,1,0,0,0,0|1,1,0]=3 1765 B12R1.69 CNCCc1ccc(Cl)cc1Br Amb24364955 [0,1,0,0,0,0|0,0,0]=1 1766 B12R1.69 CNCCc1ccc(Cl)cc1C Amb25722327 [0,1,0,0,0,0|1,0,0]=2 1767 B12R1.69 CNCCc1ccc(Cl)cc1Cl Amb5785539 [0,1,0,0,0,0|0,1,0]=2 1768 B12R1.69 CNCCc1ccc(Cl)cc1F Amb26643052 [0,1,0,0,0,0|0,1,0]=2 1769 B12R1.69 CNCCc1ccc(Cl)cc1O Amb33260061 [0,1,0,0,0,0|1,0,0]=2 1770 B12R1.69 CNCCc1ccc(F)cc1Br Amb18299496 [0,1,0,0,0,0|0,0,0]=1 1771 B12R1.69 CNCCc1ccc(F)cc1C Amb18301295 [0,1,0,0,0,0|1,0,0]=2 1772 B12R1.69 CNCCc1ccc(F)cc1Cl Amb18993044 [0,1,0,0,0,0|0,1,0]=2 1773 B12R1.69 CNCCc1ccc(F)cc1F Amb18299524 [0,1,0,0,0,0|0,1,0]=2 1774 B12R1.69 CNCCc1ccc(F)cc1F Amb33483487 [0,1,0,0,0,0|0,1,0]=2 1775 B12R1.69 CNCCc1ccc(O)cc1Cl Amb33057337 [0,1,0,0,0,0|0,1,0]=2 1776 B12R1.69 CNCCc1ccc(O)cc1F Amb24376021 [0,1,0,0,0,0|0,1,0]=2 1777 B12R1.69 CNCCc1ccc(O)cc1O Amb18273699 [0,1,0,0,0,0|1,0,0]=2 1778 B12R1.69 CNCCc1cnc(Cl)cc1Cl Amb33256860 [0,1,0,0,0,0|1,1,0]=3 1779 B12R1.69 CN\C=N\c1ccc(C)cc1C Amb4318031 [0,1,0,0,0,0|2,0,1]=4 1780 B12R1.69 CN\C=N\c1ccc(Cl)cc1C Amb24568873 [0,1,0,0,0,0|2,0,1]=4 1781 B12R1.69 CN\C=N\c1ccc(Cl)cc1Cl Amb27799865 [0,1,0,0,0,0|1,1,1]=4 1782 B12R1.69 CN\C=N\c1ccc(F)cc1C Amb28240522 [0,1,0,0,0,0|2,0,1]=4 1783 B12R1.69 CN\C=N\c1ccc(O)cc1C Amb26352515 [0,1,0,0,0,0|2,0,1]=4 1784 B12R1.69 COCCN1C=CC(Br)=CC1=O Amb25958557 [0,1,0,0,0,0|3,0,0]=4 1785 B12R1.69 COCCN1C=CC(N)=CC1=O Amb22736857 [0,1,0,0,0,0|3,0,0]=4 1786 B12R1.69 COCCN1C=CC(N)=CC1=O Amb30869772 [0,1,0,0,0,0|3,0,0]=4 1787 B12R1.69 COCCc1ccc(Br)cc1F Amb28435248 [0,1,0,0,0,0|1,1,0]=3 1788 B12R1.69 COCCc1cnc(O)cc1O Amb23570644 [0,1,0,0,0,0|3,0,0]=4 1789 B12R1.69 COCOc1ccc(Br)cc1Br Amb27396048 [0,1,0,0,0,0|2,0,0]=3 1790 B12R1.69 COCOc1ccc(Br)cc1C Amb24485679 [0,1,0,0,0,0|3,0,0]=4 1791 B12R1.69 COCOc1ccc(Br)cc1Cl Amb25677213 [0,1,0,0,0,0|2,1,0]=4 1792 B12R1.69 COCOc1ccc(Br)cc1F Amb22034392 [0,1,0,0,0,0|2,1,0]=4 1793 B12R1.69 COCOc1ccc(Br)cc1N Amb27412398 [0,1,0,0,0,0|3,0,0]=4 1794 B12R1.69 COCOc1ccc(Br)cc1O Amb32412958 [0,1,0,0,0,0|3,0,0]=4 1795 B12R1.69 COCOc1ccc(C)cc1Br Amb20241784 [0,1,0,0,0,0|2,0,0]=3 1796 B12R1.69 COCOc1ccc(Cl)cc1C Amb28430312 [0,1,0,0,0,0|3,0,0]=4 1797 B12R1.69 COCOc1ccc(Cl)cc1Cl Amb24439524 [0,1,0,0,0,0|2,1,0]=4 1798 B12R1.69 COCOc1ccc(Cl)cc1F Amb25753343 [0,1,0,0,0,0|2,1,0]=4 1799 B12R1.69 COCOc1ccc(F)cc1Br Amb25934751 [0,1,0,0,0,0|2,0,0]=3 1800 B12R1.69 COCOc1ccc(F)cc1Cl Amb27827099 [0,1,0,0,0,0|2,1,0]=4 1801 B12R1.69 COCOc1ccc(F)cc1F Amb22546899 [0,1,0,0,0,0|2,1,0]=4 1802 B12R1.69 COCOc1ccc(F)cc1N Amb28043143 [0,1,0,0,0,0|3,0,0]=4 1803 B12R1.69 COCOc1ccc(N)cc1Cl Amb27627218 [0,1,0,0,0,0|2,1,0]=4 1804 B12R1.69 COCSc1ccc(C)cc1C Amb27598238 [0,1,0,0,0,0|3,0,0]=4 1805 B12R1.69 COCSc1ccc(C)cc1N Amb28118716 [0,1,0,0,0,0|3,0,0]=4 1806 B12R1.69 COCSc1ccc(N)cc1F Amb27788926 [0,1,0,0,0,0|2,1,0]=4 1807 B12R1.69 CONCc1ccc(Br)cc1Cl Amb28076359 [0,1,0,0,0,0|2,1,0]=4 1808 B12R1.69 CONCc1ccc(Br)cc1O Amb35609053 [0,1,0,0,0,0|3,0,0]=4 1809 B12R1.69 CONCc1ccc(C)cc1Br Amb28126973 [0,1,0,0,0,0|2,0,0]=3 1810 B12R1.69 CONCc1ccc(Cl)cc1Cl Amb27193074 [0,1,0,0,0,0|2,1,0]=4 1811 B12R1.69 CONCc1ccc(Cl)cc1F Amb28349158 [0,1,0,0,0,0|2,1,0]=4 1812 B12R1.69 CONCc1ccc(F)cc1Br Amb27840407 [0,1,0,0,0,0|2,0,0]=3 1813 B12R1.69 CONCc1ccc(F)cc1F Amb27157330 [0,1,0,0,0,0|2,1,0]=4 1814 B12R1.69 CONCc1ccc(O)cc1F Amb35696323 [0,1,0,0,0,0|2,1,0]=4 1815 B12R1.69 CO\N=C\c1ccc(C)cc1Br Amb27827155 [0,1,0,0,0,0|2,0,1]=4 1816 B12R1.69 CO\N=C\c1ccc(F)cc1Br Amb27178780 [0,1,0,0,0,0|2,0,1]=4 1817 B12R1.69 CSCCN1C=CC(=O)C=C1Cl Amb28194507 [0,1,0,0,0,0|2,1,0]=4 1818 B12R1.69 CSCCN1C=CC(C)=CC1=O Amb28342136 [0,1,0,0,0,0|3,0,0]=4 1819 B12R1.69 CSCOc1ccc(C)cc1I Amb27842958 [0,1,0,0,0,0|2,1,0]=4 1820 B12R1.69 CSCOc1ccc(Cl)cc1Cl Amb27245847 [0,1,0,0,0,0|2,1,0]=4 1821 B12R1.69 CSCOc1ccc(Cl)cc1F Amb28198477 [0,1,0,0,0,0|2,1,0]=4 1822 B12R1.69 CSCSc1ccc(C)cc1C Amb27750734 [0,1,0,0,0,0|3,0,0]=4 1823 B12R1.69 C\C=C\Cc1ccc(C)cc1O Amb24408311 [0,1,0,0,0,0|2,0,1]=4 1824 B12R1.69 Cc1cc(Br)ccc1CCC#N Amb17204518 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.69 Cc1cc(Br)ccc1CCC=O Amb18070232 [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.69 Cc1cc(Br)ccc1CCCBr Amb27642848 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.69 Cc1cc(Br)ccc1CCCCl Amb27200792 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.69 Cc1cc(Br)ccc1CCCN Amb17204538 [0,1,0,0,0,0|3,0,0]=4 1829 B12R1.69 Cc1cc(Br)ccc1CCCO Amb23537809 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.69 Cc1cc(Br)ccc1CCCS Amb33435451 [0,1,0,0,0,0|3,0,0]=4 1831 B12R1.69 Cc1cc(Br)ccc1CCON Amb33435004 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.69 Cc1cc(Cl)ccc1CCC#N Amb17204324 [0,1,0,0,0,0|3,0,0]=4 1833 B12R1.69 Cc1cc(Cl)ccc1CCC=O Amb18564228 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.69 Cc1cc(Cl)ccc1CCCBr Amb27623584 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.69 Cc1cc(Cl)ccc1CCCCl Amb25922222 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.69 Cc1cc(Cl)ccc1CCCN Amb17204337 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.69 Cc1cc(Cl)ccc1CCCO Amb27645295 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.69 Cc1cc(Cl)ccc1CCCS Amb33413534 [0,1,0,0,0,0|3,0,0]=4 1839 B12R1.69 Cc1cc(Cl)ccc1CCON Amb33260989 [0,1,0,0,0,0|3,0,0]=4 1840 B12R1.69 Cc1cc(F)ccc1CCC#N Amb27796954 [0,1,0,0,0,0|3,0,0]=4 1841 B12R1.69 Cc1cc(F)ccc1CCC=O Amb25691957 [0,1,0,0,0,0|3,0,0]=4 1842 B12R1.69 Cc1cc(F)ccc1CCCBr Amb26325781 [0,1,0,0,0,0|3,0,0]=4 1843 B12R1.69 Cc1cc(F)ccc1CCCCl Amb25840107 [0,1,0,0,0,0|3,0,0]=4 1844 B12R1.69 Cc1cc(F)ccc1CCCN Amb18295693 [0,1,0,0,0,0|3,0,0]=4 1845 B12R1.69 Cc1cc(F)ccc1CCCO Amb25148633 [0,1,0,0,0,0|3,0,0]=4 1846 B12R1.69 Cc1cc(F)ccc1CCCS Amb33380162 [0,1,0,0,0,0|3,0,0]=4 1847 B12R1.69 Cc1cc(F)ccc1CCNN Amb27221503 [0,1,0,0,0,0|2,0,0]=3 1848 B12R1.69 Cc1cc(F)ccc1CCON Amb33374759 [0,1,0,0,0,0|3,0,0]=4 1849 B12R1.69 Cc1cc(I)ccc1CCCCl Amb27230838 [0,1,0,0,0,0|3,0,0]=4 1850 B12R1.69 Cc1cc(N)ccc1CCC#N Amb27242757 [0,1,0,0,0,0|3,0,0]=4 1851 B12R1.69 Cc1cc(N)ccc1CCCBr Amb27616073 [0,1,0,0,0,0|3,0,0]=4 1852 B12R1.69 Cc1cc(N)ccc1CCCCl Amb24695776 [0,1,0,0,0,0|3,0,0]=4 1853 B12R1.69 Cc1cc(O)ccc1CCCCl Amb27623395 [0,1,0,0,0,0|3,0,0]=4 1854 B12R1.69 Cc1cc(O)ccc1CCCN Amb18554106 [0,1,0,0,0,0|3,0,0]=4 1855 B12R1.69 Cc1cc(S)ccc1CCC#N Amb27199502 [0,1,0,0,0,0|3,0,0]=4 1856 B12R1.69 Cc1cc(S)ccc1CCC=O Amb28246213 [0,1,0,0,0,0|3,0,0]=4 1857 B12R1.69 Cc1cc(S)ccc1CCCCl Amb24541029 [0,1,0,0,0,0|3,0,0]=4 1858 B12R1.69 Cc1ccc(CCC#N)c(Br)c1 Amb17204517 [0,1,0,0,0,0|2,0,0]=3 1859 B12R1.69 Cc1ccc(CCC#N)c(C)c1 Amb17204300 [0,1,0,0,0,0|3,0,0]=4 1860 B12R1.69 Cc1ccc(CCC#N)c(Cl)c1 Amb26540103 [0,1,0,0,0,0|2,1,0]=4 1861 B12R1.69 Cc1ccc(CCC#N)c(F)c1 Amb26568938 [0,1,0,0,0,0|2,1,0]=4 1862 B12R1.69 Cc1ccc(CCC#N)c(I)c1 Amb27871514 [0,1,0,0,0,0|2,1,0]=4 1863 B12R1.69 Cc1ccc(CCC#N)c(N)c1 Amb27615949 [0,1,0,0,0,0|3,0,0]=4 1864 B12R1.69 Cc1ccc(CCC#N)c(O)c1 Amb28245941 [0,1,0,0,0,0|3,0,0]=4 1865 B12R1.69 Cc1ccc(CCC=O)c(Br)c1 Amb18070227 [0,1,0,0,0,0|2,0,0]=3 1866 B12R1.69 Cc1ccc(CCC=O)c(C)c1 Amb18563553 [0,1,0,0,0,0|3,0,0]=4 1867 B12R1.69 Cc1ccc(CCC=O)c(Cl)c1 Amb24484219 [0,1,0,0,0,0|2,1,0]=4 1868 B12R1.69 Cc1ccc(CCC=O)c(F)c1 Amb25773961 [0,1,0,0,0,0|2,1,0]=4 1869 B12R1.69 Cc1ccc(CCC=O)c(I)c1 Amb24594357 [0,1,0,0,0,0|2,1,0]=4 1870 B12R1.69 Cc1ccc(CCC=O)c(O)c1 Amb25253209 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.69 Cc1ccc(CCCBr)c(Br)c1 Amb27625160 [0,1,0,0,0,0|2,0,0]=3 1872 B12R1.69 Cc1ccc(CCCBr)c(C)c1 Amb26429322 [0,1,0,0,0,0|3,0,0]=4 1873 B12R1.69 Cc1ccc(CCCBr)c(Cl)c1 Amb25798590 [0,1,0,0,0,0|2,1,0]=4 1874 B12R1.69 Cc1ccc(CCCBr)c(F)c1 Amb26066087 [0,1,0,0,0,0|2,1,0]=4 1875 B12R1.69 Cc1ccc(CCCBr)c(I)c1 Amb26611991 [0,1,0,0,0,0|2,1,0]=4 1876 B12R1.69 Cc1ccc(CCCBr)c(O)c1 Amb25194824 [0,1,0,0,0,0|3,0,0]=4 1877 B12R1.69 Cc1ccc(CCCBr)c(S)c1 Amb25920100 [0,1,0,0,0,0|3,0,0]=4 1878 B12R1.69 Cc1ccc(CCCCl)c(Br)c1 Amb28323252 [0,1,0,0,0,0|2,0,0]=3 1879 B12R1.69 Cc1ccc(CCCCl)c(Cl)c1 Amb27251170 [0,1,0,0,0,0|2,1,0]=4 1880 B12R1.69 Cc1ccc(CCCCl)c(F)c1 Amb27193303 [0,1,0,0,0,0|2,1,0]=4 1881 B12R1.69 Cc1ccc(CCCCl)c(I)c1 Amb27423548 [0,1,0,0,0,0|2,1,0]=4 1882 B12R1.69 Cc1ccc(CCCCl)c(O)c1 Amb26988904 [0,1,0,0,0,0|3,0,0]=4 1883 B12R1.69 Cc1ccc(CCCCl)c(S)c1 Amb27647047 [0,1,0,0,0,0|3,0,0]=4 1884 B12R1.69 Cc1ccc(CCCN)c(Br)c1 Amb17204537 [0,1,0,0,0,0|2,0,0]=3 1885 B12R1.69 Cc1ccc(CCCN)c(C)c1 Amb1215673 [0,1,0,0,0,0|3,0,0]=4 1886 B12R1.69 Cc1ccc(CCCN)c(C)c1 Amb32670630 [0,1,0,0,0,0|3,0,0]=4 1887 B12R1.69 Cc1ccc(CCCN)c(Cl)c1 Amb25159902 [0,1,0,0,0,0|2,1,0]=4 1888 B12R1.69 Cc1ccc(CCCN)c(F)c1 Amb25677595 [0,1,0,0,0,0|2,1,0]=4 1889 B12R1.69 Cc1ccc(CCCN)c(O)c1 Amb25776876 [0,1,0,0,0,0|3,0,0]=4 1890 B12R1.69 Cc1ccc(CCCO)c(Br)c1 Amb23537990 [0,1,0,0,0,0|2,0,0]=3 1891 B12R1.69 Cc1ccc(CCCO)c(C)c1 Amb17400157 [0,1,0,0,0,0|3,0,0]=4 1892 B12R1.69 Cc1ccc(CCCO)c(Cl)c1 Amb25820255 [0,1,0,0,0,0|2,1,0]=4 1893 B12R1.69 Cc1ccc(CCCO)c(F)c1 Amb25135641 [0,1,0,0,0,0|2,1,0]=4 1894 B12R1.69 Cc1ccc(CCCO)c(N)c1 Amb22233216 [0,1,0,0,0,0|3,0,0]=4 1895 B12R1.69 Cc1ccc(CCCO)c(O)c1 Amb26589790 [0,1,0,0,0,0|3,0,0]=4 1896 B12R1.69 Cc1ccc(CCCS)c(Br)c1 Amb33387491 [0,1,0,0,0,0|2,0,0]=3 1897 B12R1.69 Cc1ccc(CCCS)c(C)c1 Amb24497542 [0,1,0,0,0,0|3,0,0]=4 1898 B12R1.69 Cc1ccc(CCCS)c(Cl)c1 Amb33221379 [0,1,0,0,0,0|2,1,0]=4 1899 B12R1.69 Cc1ccc(CCCS)c(F)c1 Amb33324275 [0,1,0,0,0,0|2,1,0]=4 1900 B12R1.69 Cc1ccc(CCCS)c(O)c1 Amb33425273 [0,1,0,0,0,0|3,0,0]=4 1901 B12R1.69 Cc1ccc(CCNN)c(C)c1 Amb17400165 [0,1,0,0,0,0|2,0,0]=3 1902 B12R1.69 Cc1ccc(CCON)c(Br)c1 Amb33450472 [0,1,0,0,0,0|2,0,0]=3 1903 B12R1.69 Cc1ccc(CCON)c(C)c1 Amb33312644 [0,1,0,0,0,0|3,0,0]=4 1904 B12R1.69 Cc1ccc(CCON)c(Cl)c1 Amb33058477 [0,1,0,0,0,0|2,1,0]=4 1905 B12R1.69 Cc1ccc(CCON)c(F)c1 Amb33323350 [0,1,0,0,0,0|2,1,0]=4 1906 B12R1.69 Cc1ccc(CCON)c(O)c1 Amb33426047 [0,1,0,0,0,0|3,0,0]=4 1907 B12R1.69 Cc1ccc(CN=C=O)c(Br)c1 Amb26356642 [0,1,0,0,0,0|3,0,0]=4 1908 B12R1.69 Cc1ccc(CN=[N+]=[N-])c(Br)c1 Amb33450475 [0,1,0,0,0,0|2,0,1]=4 1909 B12R1.69 Cc1ccc(NCC#N)c(Br)c1 Amb6708140 [0,1,0,0,0,0|3,0,0]=4 1910 B12R1.69 Cc1ccc(NCCCl)c(Br)c1 Amb17351915 [0,1,0,0,0,0|3,0,0]=4 1911 B12R1.69 Cc1ccc(NCCN)c(Br)c1 Amb17091075 [0,1,0,0,0,0|3,0,0]=4 1912 B12R1.69 Cc1ccc(NCCO)c(Br)c1 Amb6708181 [0,1,0,0,0,0|3,0,0]=4 1913 B12R1.69 Cc1ccc(OCC#N)c(Br)c1 Amb5780908 [0,1,0,0,0,0|3,0,0]=4 1914 B12R1.69 Cc1ccc(OCC=O)c(Br)c1 Amb17099967 [0,1,0,0,0,0|3,0,0]=4 1915 B12R1.69 Cc1ccc(OCCF)c(Br)c1 Amb27475775 [0,1,0,0,0,0|3,0,0]=4 1916 B12R1.69 Cc1ccc(OCCN)c(Br)c1 Amb6315948 [0,1,0,0,0,0|3,0,0]=4 1917 B12R1.69 Cc1ccc(SCCO)c(Br)c1 Amb26613162 [0,1,0,0,0,0|3,0,0]=4 1918 B12R1.69 ClCCCc1ccc(Br)cc1Br Amb24756782 [0,1,0,0,0,0|2,0,0]=3 1919 B12R1.69 ClCCCc1ccc(Br)cc1Cl Amb26491293 [0,1,0,0,0,0|2,1,0]=4 1920 B12R1.69 ClCCCc1ccc(Br)cc1I Amb26653620 [0,1,0,0,0,0|2,1,0]=4 1921 B12R1.69 ClCCCc1ccc(Cl)cc1Br Amb27965661 [0,1,0,0,0,0|2,0,0]=3 1922 B12R1.69 ClCCCc1ccc(Cl)cc1Cl Amb17477748 [0,1,0,0,0,0|2,1,0]=4 1923 B12R1.69 ClCCCc1ccc(I)cc1Br Amb27963012 [0,1,0,0,0,0|2,0,0]=3 1924 B12R1.69 Clc1cc(Br)ccc1CCCBr Amb26652758 [0,1,0,0,0,0|2,1,0]=4 1925 B12R1.69 Clc1ccc(CCCBr)c(Cl)c1 Amb24064155 [0,1,0,0,0,0|2,1,0]=4 1926 B12R1.69 Clc1ccc(OCCBr)c(Br)c1 Amb1154146 [0,1,0,0,0,0|3,0,0]=4 1927 B12R1.69 FCCNc1ccc(Br)cc1Br Amb27984467 [0,1,0,0,0,0|3,0,0]=4 1928 B12R1.69 FCCOc1ccc(Cl)cc1Br Amb28125500 [0,1,0,0,0,0|3,0,0]=4 1929 B12R1.69 Fc1cc(Br)ccc1CCCBr Amb20075851 [0,1,0,0,0,0|2,1,0]=4 1930 B12R1.69 Fc1cc(Br)ccc1CCCCl Amb25770333 [0,1,0,0,0,0|2,1,0]=4 1931 B12R1.69 Fc1cc(Br)ccc1CCCS Amb33477370 [0,1,0,0,0,0|2,1,0]=4 1932 B12R1.69 Fc1cc(Cl)ccc1CCCBr Amb27633944 [0,1,0,0,0,0|2,1,0]=4 1933 B12R1.69 Fc1cc(Cl)ccc1CCCCl Amb26424917 [0,1,0,0,0,0|2,1,0]=4 1934 B12R1.69 Fc1cc(Cl)ccc1CCCS Amb33052033 [0,1,0,0,0,0|2,1,0]=4 1935 B12R1.69 Fc1cc(S)ccc1CCCBr Amb28133833 [0,1,0,0,0,0|2,1,0]=4 1936 B12R1.69 Fc1ccc(CCCBr)c(Br)c1 Amb24448383 [0,1,0,0,0,0|2,0,0]=3 1937 B12R1.69 Fc1ccc(CCCBr)c(Cl)c1 Amb27254548 [0,1,0,0,0,0|2,1,0]=4 1938 B12R1.69 Fc1ccc(CCCBr)c(F)c1 Amb26433081 [0,1,0,0,0,0|2,1,0]=4 1939 B12R1.69 Fc1ccc(CCCCl)c(Br)c1 Amb27751483 [0,1,0,0,0,0|2,0,0]=3 1940 B12R1.69 Fc1ccc(CCCCl)c(Cl)c1 Amb27855924 [0,1,0,0,0,0|2,1,0]=4 1941 B12R1.69 Fc1ccc(CCCCl)c(F)c1 Amb19073200 [0,1,0,0,0,0|2,1,0]=4 1942 B12R1.69 Fc1ccc(CCCCl)c(I)c1 Amb27490051 [0,1,0,0,0,0|2,1,0]=4 1943 B12R1.69 Fc1ccc(CCCS)c(Br)c1 Amb33334158 [0,1,0,0,0,0|2,0,0]=3 1944 B12R1.69 Fc1ccc(CCCS)c(Cl)c1 Amb33258064 [0,1,0,0,0,0|2,1,0]=4 1945 B12R1.69 Fc1ccc(CCCS)c(F)c1 Amb25159701 [0,1,0,0,0,0|2,1,0]=4 1946 B12R1.69 Fc1ccc(OCCBr)c(Br)c1 Amb6274766 [0,1,0,0,0,0|3,0,0]=4 1947 B12R1.69 Fc1ccc(OCCS)c(Br)c1 Amb27218799 [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.69 N#CCCc1ccc(Br)cc1Br Amb25942236 [0,1,0,0,0,0|2,0,0]=3 1949 B12R1.69 N#CCCc1ccc(Br)cc1Cl Amb26566004 [0,1,0,0,0,0|2,1,0]=4 1950 B12R1.69 N#CCCc1ccc(Br)cc1F Amb24737736 [0,1,0,0,0,0|2,1,0]=4 1951 B12R1.69 N#CCCc1ccc(Br)cc1O Amb27966214 [0,1,0,0,0,0|3,0,0]=4 1952 B12R1.69 N#CCCc1ccc(Br)cc1S Amb27445822 [0,1,0,0,0,0|3,0,0]=4 1953 B12R1.69 N#CCCc1ccc(Cl)cc1Br Amb26990195 [0,1,0,0,0,0|2,0,0]=3 1954 B12R1.69 N#CCCc1ccc(Cl)cc1Cl Amb17204385 [0,1,0,0,0,0|2,1,0]=4 1955 B12R1.69 N#CCCc1ccc(Cl)cc1F Amb26604145 [0,1,0,0,0,0|2,1,0]=4 1956 B12R1.69 N#CCCc1ccc(Cl)cc1I Amb27624776 [0,1,0,0,0,0|2,1,0]=4 1957 B12R1.69 N#CCCc1ccc(Cl)cc1O Amb26063392 [0,1,0,0,0,0|3,0,0]=4 1958 B12R1.69 N#CCCc1ccc(Cl)cc1S Amb28436245 [0,1,0,0,0,0|3,0,0]=4 1959 B12R1.69 N#CCCc1ccc(F)cc1Br Amb26002912 [0,1,0,0,0,0|2,0,0]=3 1960 B12R1.69 N#CCCc1ccc(F)cc1Cl Amb19045344 [0,1,0,0,0,0|2,1,0]=4 1961 B12R1.69 N#CCCc1ccc(F)cc1F Amb16193191 [0,1,0,0,0,0|2,1,0]=4 1962 B12R1.69 N#CCCc1ccc(F)cc1I Amb27637400 [0,1,0,0,0,0|2,1,0]=4 1963 B12R1.69 N#CCCc1ccc(F)cc1N Amb27621613 [0,1,0,0,0,0|3,0,0]=4 1964 B12R1.69 N#CCCc1ccc(F)cc1S Amb28134076 [0,1,0,0,0,0|3,0,0]=4 1965 B12R1.69 N#CCCc1ccc(I)cc1N Amb27636564 [0,1,0,0,0,0|3,0,0]=4 1966 B12R1.69 N#CCCc1ccc(I)cc1O Amb27654257 [0,1,0,0,0,0|3,0,0]=4 1967 B12R1.69 N#CCCc1ccc(N)cc1Cl Amb25700092 [0,1,0,0,0,0|2,1,0]=4 1968 B12R1.69 N#CCCc1ccc(O)cc1Br Amb27613858 [0,1,0,0,0,0|2,0,0]=3 1969 B12R1.69 N#CCCc1ccc(O)cc1Cl Amb26619916 [0,1,0,0,0,0|2,1,0]=4 1970 B12R1.69 N#CCCc1ccc(O)cc1F Amb33377697 [0,1,0,0,0,0|2,1,0]=4 1971 B12R1.69 N#CCCc1ccc(O)cc1O Amb24742016 [0,1,0,0,0,0|3,0,0]=4 1972 B12R1.69 N#CCCc1ccc(S)cc1Br Amb27193577 [0,1,0,0,0,0|2,0,0]=3 1973 B12R1.69 N#CCCc1ccc(S)cc1F Amb27619327 [0,1,0,0,0,0|2,1,0]=4 1974 B12R1.69 N#CCCc1ccc(S)cc1O Amb27423582 [0,1,0,0,0,0|3,0,0]=4 1975 B12R1.69 N#CCCc1ccc(S)cc1S Amb28133072 [0,1,0,0,0,0|3,0,0]=4 1976 B12R1.69 N#CCCc1ncc(Br)cc1Br Amb33433311 [0,1,0,0,0,0|3,0,0]=4 1977 B12R1.69 N#CCNc1ccc(Br)cc1Br Amb27482452 [0,1,0,0,0,0|3,0,0]=4 1978 B12R1.69 N#CCNc1ccc(I)cc1Br Amb27832873 [0,1,0,0,0,0|3,0,0]=4 1979 B12R1.69 N#CCOc1ccc(Br)cc1Br Amb6384256 [0,1,0,0,0,0|3,0,0]=4 1980 B12R1.69 NCCCc1ccc(Br)cc1Cl Amb25897417 [0,1,0,0,0,0|2,1,0]=4 1981 B12R1.69 NCCCc1ccc(Br)cc1F Amb9304930 [0,1,0,0,0,0|2,1,0]=4 1982 B12R1.69 NCCCc1ccc(Br)cc1O Amb27644606 [0,1,0,0,0,0|3,0,0]=4 1983 B12R1.69 NCCCc1ccc(Cl)cc1Br Amb27250429 [0,1,0,0,0,0|2,0,0]=3 1984 B12R1.69 NCCCc1ccc(Cl)cc1Cl Amb9304921 [0,1,0,0,0,0|2,1,0]=4 1985 B12R1.69 NCCCc1ccc(Cl)cc1F Amb23315399 [0,1,0,0,0,0|2,1,0]=4 1986 B12R1.69 NCCCc1ccc(Cl)cc1O Amb25084560 [0,1,0,0,0,0|3,0,0]=4 1987 B12R1.69 NCCCc1ccc(F)cc1Br Amb9304914 [0,1,0,0,0,0|2,0,0]=3 1988 B12R1.69 NCCCc1ccc(F)cc1Cl Amb9304919 [0,1,0,0,0,0|2,1,0]=4 1989 B12R1.69 NCCCc1ccc(F)cc1F Amb17204313 [0,1,0,0,0,0|2,1,0]=4 1990 B12R1.69 NCCCc1ccc(O)cc1Cl Amb18556149 [0,1,0,0,0,0|2,1,0]=4 1991 B12R1.69 NCCCc1ccc(O)cc1F Amb27389254 [0,1,0,0,0,0|2,1,0]=4 1992 B12R1.69 NCCCc1ccc(O)cc1O Amb18054814 [0,1,0,0,0,0|3,0,0]=4 1993 B12R1.69 NCCNc1ccc(Br)cc1Br Amb27416820 [0,1,0,0,0,0|3,0,0]=4 1994 B12R1.69 NCCNc1ccc(Cl)cc1Br Amb27416757 [0,1,0,0,0,0|3,0,0]=4 1995 B12R1.69 NCCOc1ccc(Br)cc1Br Amb17381668 [0,1,0,0,0,0|3,0,0]=4 1996 B12R1.69 NCCOc1ccc(Cl)cc1Br Amb5781250 [0,1,0,0,0,0|3,0,0]=4 1997 B12R1.69 NCCOc1ccc(F)cc1Br Amb5781248 [0,1,0,0,0,0|3,0,0]=4 1998 B12R1.69 NCCSc1ccc(N)cc1Br Amb28127135 [0,1,0,0,0,0|3,0,0]=4 1999 B12R1.69 NNCCc1ccc(Cl)cc1Cl Amb17402983 [0,1,0,0,0,0|1,1,0]=3 2000 B12R1.69 NNCCc1ccc(Cl)cc1Cl Amb19887737 [0,1,0,0,0,0|1,1,0]=3 2001 B12R1.69 NNCCc1ccc(F)cc1F Amb27168587 [0,1,0,0,0,0|1,1,0]=3 2002 B12R1.69 NNCSc1ccc(Cl)cc1Cl Amb28041652 [0,1,0,0,0,0|2,1,0]=4 2003 B12R1.69 NOCCc1ccc(Br)cc1Cl Amb33334550 [0,1,0,0,0,0|2,1,0]=4 2004 B12R1.69 NOCCc1ccc(Br)cc1F Amb33450284 [0,1,0,0,0,0|2,1,0]=4 2005 B12R1.69 NOCCc1ccc(Br)cc1O Amb33389159 [0,1,0,0,0,0|3,0,0]=4 2006 B12R1.69 NOCCc1ccc(Cl)cc1Br Amb33478346 [0,1,0,0,0,0|2,0,0]=3 2007 B12R1.69 NOCCc1ccc(Cl)cc1Cl Amb18655205 [0,1,0,0,0,0|2,1,0]=4 2008 B12R1.69 NOCCc1ccc(Cl)cc1F Amb33052645 [0,1,0,0,0,0|2,1,0]=4 2009 B12R1.69 NOCCc1ccc(Cl)cc1O Amb33260446 [0,1,0,0,0,0|3,0,0]=4 2010 B12R1.69 NOCCc1ccc(F)cc1Br Amb33336569 [0,1,0,0,0,0|2,0,0]=3 2011 B12R1.69 NOCCc1ccc(F)cc1Cl Amb33258369 [0,1,0,0,0,0|2,1,0]=4 2012 B12R1.69 NOCCc1ccc(F)cc1F Amb33196333 [0,1,0,0,0,0|2,1,0]=4 2013 B12R1.69 NOCCc1ccc(O)cc1Cl Amb33056572 [0,1,0,0,0,0|2,1,0]=4 2014 B12R1.69 NOCCc1ccc(O)cc1F Amb33377246 [0,1,0,0,0,0|2,1,0]=4 2015 B12R1.69 NOCCc1ccc(O)cc1O Amb33270126 [0,1,0,0,0,0|3,0,0]=4 2016 B12R1.69 Nc1cc(Br)ccc1CCCCl Amb27790897 [0,1,0,0,0,0|3,0,0]=4 2017 B12R1.69 Nc1cc(Cl)ccc1CCCO Amb28346320 [0,1,0,0,0,0|3,0,0]=4 2018 B12R1.69 Nc1cc(F)ccc1CCC=O Amb28130009 [0,1,0,0,0,0|3,0,0]=4 2019 B12R1.69 Nc1cc(F)ccc1CCCBr Amb27614017 [0,1,0,0,0,0|3,0,0]=4 2020 B12R1.69 Nc1cc(F)ccc1CCCCl Amb27614021 [0,1,0,0,0,0|3,0,0]=4 2021 B12R1.69 Nc1cc(I)ccc1CCCBr Amb27847294 [0,1,0,0,0,0|3,0,0]=4 2022 B12R1.69 Nc1cc(O)ccc1CCCBr Amb27442057 [0,1,0,0,0,0|3,0,0]=4 2023 B12R1.69 Nc1cc(O)ccc1CCCCl Amb27849133 [0,1,0,0,0,0|3,0,0]=4 2024 B12R1.69 Nc1ccc(CCC=O)c(Br)c1 Amb28196038 [0,1,0,0,0,0|2,0,0]=3 2025 B12R1.69 Nc1ccc(CCCBr)c(Br)c1 Amb25243524 [0,1,0,0,0,0|2,0,0]=3 2026 B12R1.69 Nc1ccc(CCCBr)c(F)c1 Amb27877558 [0,1,0,0,0,0|2,1,0]=4 2027 B12R1.69 Nc1ccc(CCCBr)c(N)c1 Amb27462505 [0,1,0,0,0,0|3,0,0]=4 2028 B12R1.69 Nc1ccc(CCCCl)c(Br)c1 Amb27964587 [0,1,0,0,0,0|2,0,0]=3 2029 B12R1.69 Nc1ccc(CCCCl)c(Cl)c1 Amb28196582 [0,1,0,0,0,0|2,1,0]=4 2030 B12R1.69 Nc1ccc(CCCCl)c(F)c1 Amb28286909 [0,1,0,0,0,0|2,1,0]=4 2031 B12R1.69 Nc1ccc(CCCCl)c(S)c1 Amb27616195 [0,1,0,0,0,0|3,0,0]=4 2032 B12R1.69 Nc1ccc(OCCF)c(Br)c1 Amb32939660 [0,1,0,0,0,0|3,0,0]=4 2033 B12R1.69 Nc1ccc(OCCO)c(Br)c1 Amb18981633 [0,1,0,0,0,0|3,0,0]=4 2034 B12R1.69 Nc1ccc(SCCF)c(Br)c1 Amb27754657 [0,1,0,0,0,0|3,0,0]=4 2035 B12R1.69 O=C=NCc1ccc(Cl)cc1Br Amb26055864 [0,1,0,0,0,0|3,0,0]=4 2036 B12R1.69 O=C=NCc1ccc(F)cc1Br Amb24554739 [0,1,0,0,0,0|3,0,0]=4 2037 B12R1.69 O=CCCc1ccc(Br)cc1Br Amb25995251 [0,1,0,0,0,0|2,0,0]=3 2038 B12R1.69 O=CCCc1ccc(Br)cc1Cl Amb24455343 [0,1,0,0,0,0|2,1,0]=4 2039 B12R1.69 O=CCCc1ccc(Br)cc1F Amb24078525 [0,1,0,0,0,0|2,1,0]=4 2040 B12R1.69 O=CCCc1ccc(Br)cc1I Amb28398138 [0,1,0,0,0,0|2,1,0]=4 2041 B12R1.69 O=CCCc1ccc(Br)cc1O Amb25883424 [0,1,0,0,0,0|3,0,0]=4 2042 B12R1.69 O=CCCc1ccc(Cl)cc1Br Amb24483728 [0,1,0,0,0,0|2,0,0]=3 2043 B12R1.69 O=CCCc1ccc(Cl)cc1Cl Amb17612588 [0,1,0,0,0,0|2,1,0]=4 2044 B12R1.69 O=CCCc1ccc(Cl)cc1F Amb25149928 [0,1,0,0,0,0|2,1,0]=4 2045 B12R1.69 O=CCCc1ccc(Cl)cc1I Amb26048883 [0,1,0,0,0,0|2,1,0]=4 2046 B12R1.69 O=CCCc1ccc(Cl)cc1O Amb27175625 [0,1,0,0,0,0|3,0,0]=4 2047 B12R1.69 O=CCCc1ccc(F)cc1Br Amb25189497 [0,1,0,0,0,0|2,0,0]=3 2048 B12R1.69 O=CCCc1ccc(F)cc1Cl Amb19070647 [0,1,0,0,0,0|2,1,0]=4 2049 B12R1.69 O=CCCc1ccc(F)cc1F Amb18801723 [0,1,0,0,0,0|2,1,0]=4 2050 B12R1.69 O=CCCc1ccc(F)cc1I Amb25305164 [0,1,0,0,0,0|2,1,0]=4 2051 B12R1.69 O=CCCc1ccc(F)cc1O Amb26517520 [0,1,0,0,0,0|3,0,0]=4 2052 B12R1.69 O=CCCc1ccc(I)cc1Br Amb27461905 [0,1,0,0,0,0|2,0,0]=3 2053 B12R1.69 O=CCCc1ccc(I)cc1Cl Amb27461948 [0,1,0,0,0,0|2,1,0]=4 2054 B12R1.69 O=CCCc1ccc(I)cc1F Amb24728158 [0,1,0,0,0,0|2,1,0]=4 2055 B12R1.69 O=CCCc1ccc(I)cc1O Amb27238630 [0,1,0,0,0,0|3,0,0]=4 2056 B12R1.69 O=CCCc1ccc(I)cc1S Amb27423734 [0,1,0,0,0,0|3,0,0]=4 2057 B12R1.69 O=CCCc1ccc(O)cc1Cl Amb28291426 [0,1,0,0,0,0|2,1,0]=4 2058 B12R1.69 O=CCCc1ccc(O)cc1F Amb26880100 [0,1,0,0,0,0|2,1,0]=4 2059 B12R1.69 O=CCCc1ccc(O)cc1O Amb25993938 [0,1,0,0,0,0|3,0,0]=4 2060 B12R1.69 O=CCCc1ccc(S)cc1F Amb28287544 [0,1,0,0,0,0|2,1,0]=4 2061 B12R1.69 O=CCCc1ccc(S)cc1I Amb27647094 [0,1,0,0,0,0|2,1,0]=4 2062 B12R1.69 OCCCc1ccc(Br)cc1Cl Amb26481654 [0,1,0,0,0,0|2,1,0]=4 2063 B12R1.69 OCCCc1ccc(Br)cc1F Amb20171344 [0,1,0,0,0,0|2,1,0]=4 2064 B12R1.69 OCCCc1ccc(Br)cc1O Amb33389673 [0,1,0,0,0,0|3,0,0]=4 2065 B12R1.69 OCCCc1ccc(Cl)cc1Br Amb32944418 [0,1,0,0,0,0|2,0,0]=3 2066 B12R1.69 OCCCc1ccc(Cl)cc1Cl Amb17402981 [0,1,0,0,0,0|2,1,0]=4 2067 B12R1.69 OCCCc1ccc(Cl)cc1F Amb25720643 [0,1,0,0,0,0|2,1,0]=4 2068 B12R1.69 OCCCc1ccc(Cl)cc1O Amb33261476 [0,1,0,0,0,0|3,0,0]=4 2069 B12R1.69 OCCCc1ccc(F)cc1Br Amb24090111 [0,1,0,0,0,0|2,0,0]=3 2070 B12R1.69 OCCCc1ccc(F)cc1Cl Amb19072148 [0,1,0,0,0,0|2,1,0]=4 2071 B12R1.69 OCCCc1ccc(F)cc1F Amb17605787 [0,1,0,0,0,0|2,1,0]=4 2072 B12R1.69 OCCCc1ccc(F)cc1O Amb25106077 [0,1,0,0,0,0|3,0,0]=4 2073 B12R1.69 OCCCc1ccc(O)cc1Cl Amb25690683 [0,1,0,0,0,0|2,1,0]=4 2074 B12R1.69 OCCCc1ccc(O)cc1F Amb25281830 [0,1,0,0,0,0|2,1,0]=4 2075 B12R1.69 OCCCc1ccc(O)cc1O Amb18646882 [0,1,0,0,0,0|3,0,0]=4 2076 B12R1.69 OCCOc1ccc(Cl)cc1Br Amb2712563 [0,1,0,0,0,0|3,0,0]=4 2077 B12R1.69 OCCOc1ccc(I)cc1Br Amb27242867 [0,1,0,0,0,0|3,0,0]=4 2078 B12R1.69 Oc1cc(Br)ccc1CCCBr Amb27613860 [0,1,0,0,0,0|3,0,0]=4 2079 B12R1.69 Oc1cc(Br)ccc1CCCCl Amb28286872 [0,1,0,0,0,0|3,0,0]=4 2080 B12R1.69 Oc1cc(Br)ccc1CCCS Amb33389685 [0,1,0,0,0,0|3,0,0]=4 2081 B12R1.69 Oc1cc(Cl)ccc1CCCBr Amb24743949 [0,1,0,0,0,0|3,0,0]=4 2082 B12R1.69 Oc1cc(Cl)ccc1CCCS Amb33413683 [0,1,0,0,0,0|3,0,0]=4 2083 B12R1.69 Oc1cc(F)ccc1CCCBr Amb27877080 [0,1,0,0,0,0|3,0,0]=4 2084 B12R1.69 Oc1cc(F)ccc1CCCCl Amb28423941 [0,1,0,0,0,0|3,0,0]=4 2085 B12R1.69 Oc1cc(I)ccc1CCCBr Amb27230861 [0,1,0,0,0,0|3,0,0]=4 2086 B12R1.69 Oc1ccc(CCCBr)c(Cl)c1 Amb27428168 [0,1,0,0,0,0|2,1,0]=4 2087 B12R1.69 Oc1ccc(CCCBr)c(F)c1 Amb27965291 [0,1,0,0,0,0|2,1,0]=4 2088 B12R1.69 Oc1ccc(CCCBr)c(O)c1 Amb27462654 [0,1,0,0,0,0|3,0,0]=4 2089 B12R1.69 Oc1ccc(CCCCl)c(Br)c1 Amb27968276 [0,1,0,0,0,0|2,0,0]=3 2090 B12R1.69 Oc1ccc(CCCCl)c(Cl)c1 Amb27215608 [0,1,0,0,0,0|2,1,0]=4 2091 B12R1.69 Oc1ccc(CCCCl)c(F)c1 Amb27423574 [0,1,0,0,0,0|2,1,0]=4 2092 B12R1.69 Oc1ccc(CCCCl)c(I)c1 Amb27439362 [0,1,0,0,0,0|2,1,0]=4 2093 B12R1.69 Oc1ccc(CCCS)c(Cl)c1 Amb33057343 [0,1,0,0,0,0|2,1,0]=4 2094 B12R1.69 Oc1ccc(CCCS)c(F)c1 Amb33376506 [0,1,0,0,0,0|2,1,0]=4 2095 B12R1.69 Oc1ccc(CCCS)c(O)c1 Amb33268961 [0,1,0,0,0,0|3,0,0]=4 2096 B12R1.69 SCCCc1ccc(Br)cc1Cl Amb33485051 [0,1,0,0,0,0|2,1,0]=4 2097 B12R1.69 SCCCc1ccc(Cl)cc1Br Amb33478798 [0,1,0,0,0,0|2,0,0]=3 2098 B12R1.69 SCCCc1ccc(Cl)cc1Cl Amb26961727 [0,1,0,0,0,0|2,1,0]=4 2099 B12R1.69 Sc1cc(Br)ccc1CCCBr Amb27445823 [0,1,0,0,0,0|3,0,0]=4 2100 B12R1.69 Sc1cc(Br)ccc1CCCCl Amb26894885 [0,1,0,0,0,0|3,0,0]=4 2101 B12R1.69 Sc1cc(Cl)ccc1CCCBr Amb27200568 [0,1,0,0,0,0|3,0,0]=4 2102 B12R1.69 Sc1cc(I)ccc1CCCBr Amb27441617 [0,1,0,0,0,0|3,0,0]=4 2103 B12R1.69 Sc1cc(I)ccc1CCCCl Amb27624810 [0,1,0,0,0,0|3,0,0]=4 2104 B12R1.69 Sc1ccc(CCCBr)c(Br)c1 Amb27796646 [0,1,0,0,0,0|2,0,0]=3 2105 B12R1.69 Sc1ccc(CCCBr)c(S)c1 Amb27813667 [0,1,0,0,0,0|3,0,0]=4 2106 B12R1.69 Sc1ccc(CCCCl)c(Br)c1 Amb26445164 [0,1,0,0,0,0|2,0,0]=3 2107 B12R1.69 [C-]#[N+]CCc1ccc(Br)cc1Br Amb33432301 [0,1,0,0,0,0|0,0,2]=3 2108 B12R1.69 [C-]#[N+]CCc1ccc(Br)cc1C Amb33431499 [0,1,0,0,0,0|1,0,2]=4 2109 B12R1.69 [C-]#[N+]CCc1ccc(Br)cc1Cl Amb33334314 [0,1,0,0,0,0|0,1,2]=4 2110 B12R1.69 [C-]#[N+]CCc1ccc(Br)cc1F Amb33450303 [0,1,0,0,0,0|0,1,2]=4 2111 B12R1.69 [C-]#[N+]CCc1ccc(C)cc1Br Amb33450465 [0,1,0,0,0,0|0,0,2]=3 2112 B12R1.69 [C-]#[N+]CCc1ccc(C)cc1C Amb33312649 [0,1,0,0,0,0|1,0,2]=4 2113 B12R1.69 [C-]#[N+]CCc1ccc(C)cc1Cl Amb33058163 [0,1,0,0,0,0|0,1,2]=4 2114 B12R1.69 [C-]#[N+]CCc1ccc(C)cc1F Amb33323357 [0,1,0,0,0,0|0,1,2]=4 2115 B12R1.69 [C-]#[N+]CCc1ccc(Cl)cc1Br Amb33478323 [0,1,0,0,0,0|0,0,2]=3 2116 B12R1.69 [C-]#[N+]CCc1ccc(Cl)cc1C Amb33261011 [0,1,0,0,0,0|1,0,2]=4 2117 B12R1.69 [C-]#[N+]CCc1ccc(Cl)cc1Cl Amb2686900 [0,1,0,0,0,0|0,1,2]=4 2118 B12R1.69 [C-]#[N+]CCc1ccc(Cl)cc1F Amb33052614 [0,1,0,0,0,0|0,1,2]=4 2119 B12R1.69 [C-]#[N+]CCc1ccc(F)cc1Br Amb33336558 [0,1,0,0,0,0|0,0,2]=3 2120 B12R1.69 [C-]#[N+]CCc1ccc(F)cc1C Amb33374768 [0,1,0,0,0,0|1,0,2]=4 2121 B12R1.69 [C-]#[N+]CCc1ccc(F)cc1Cl Amb33258104 [0,1,0,0,0,0|0,1,2]=4 2122 B12R1.69 [C-]#[N+]CCc1ccc(F)cc1F Amb33196374 [0,1,0,0,0,0|0,1,2]=4 2123 B12R1.69 [C-]#[N+]CCc1ncc(Br)cc1Br Amb33433329 [0,1,0,0,0,0|1,0,2]=4 2124 B12R1.69 [N-]=[N+]=NCc1ccc(Cl)cc1Br Amb33450985 [0,1,0,0,0,0|2,0,1]=4 2125 B12R1.69 [N-]=[N+]=NCc1ccc(F)cc1Br Amb8938156 [0,1,0,0,0,0|2,0,1]=4 2126 B12R1.121 C#CCCc1ccccc1C#C Amb33373903 [0,1,0,0,0,0|2,0,1]=4 2127 B12R1.121 C#CCCc1ccccc1C#N Amb18118066 [0,1,0,0,0,0|2,0,1]=4 2128 B12R1.121 C#CCCc1ccccc1CC Amb33198315 [0,1,0,0,0,0|2,0,1]=4 2129 B12R1.121 C#CCCc1ccccc1CN Amb27624554 [0,1,0,0,0,0|2,0,1]=4 2130 B12R1.121 C#CCCc1ccccc1OC Amb18636005 [0,1,0,0,0,0|2,0,1]=4 2131 B12R1.121 C#CCCc1ccccc1SC Amb32876164 [0,1,0,0,0,0|2,0,1]=4 2132 B12R1.121 C#Cc1ccccc1CCC#N Amb33204319 [0,1,0,0,0,0|3,0,0]=4 2133 B12R1.121 C#Cc1ccccc1CCC=O Amb24422382 [0,1,0,0,0,0|3,0,0]=4 2134 B12R1.121 C#Cc1ccccc1CCCBr Amb33386550 [0,1,0,0,0,0|3,0,0]=4 2135 B12R1.121 C#Cc1ccccc1CCCN Amb33314763 [0,1,0,0,0,0|3,0,0]=4 2136 B12R1.121 C#Cc1ccccc1CCCO Amb27978387 [0,1,0,0,0,0|3,0,0]=4 2137 B12R1.121 C#Cc1ccccc1CCCS Amb33373849 [0,1,0,0,0,0|3,0,0]=4 2138 B12R1.121 C#Cc1ccccc1CCNC Amb33204327 [0,1,0,0,0,0|1,0,0]=2 2139 B12R1.121 C#Cc1ccccc1CCON Amb33203605 [0,1,0,0,0,0|3,0,0]=4 2140 B12R1.121 C#Cc1ccccc1OCCC Amb27457126 [0,1,0,0,0,0|3,0,0]=4 2141 B12R1.121 C=CCCc1ccccc1CO Amb24069012 [0,1,0,0,0,0|2,0,1]=4 2142 B12R1.121 C=CCCc1ccccc1OC Amb6299112 [0,1,0,0,0,0|2,0,1]=4 2143 B12R1.121 C=CCOc1ccccc1CBr Amb30640043 [0,1,0,0,0,0|2,0,1]=4 2144 B12R1.121 CCCCc1ccccc1C#N Amb27156264 [0,1,0,0,0,0|2,0,0]=3 2145 B12R1.121 CCCCc1ccccc1NN Amb3942594 [0,1,0,0,0,0|2,0,0]=3 2146 B12R1.121 CCCNc1ccccc1C#N Amb6716331 [0,1,0,0,0,0|3,0,0]=4 2147 B12R1.121 CCCNc1ccccc1CC Amb6698992 [0,1,0,0,0,0|3,0,0]=4 2148 B12R1.121 CCCNc1ccccc1CN Amb18800850 [0,1,0,0,0,0|3,0,0]=4 2149 B12R1.121 CCCNc1ccccc1OC Amb6688440 [0,1,0,0,0,0|3,0,0]=4 2150 B12R1.121 CCCOc1ccccc1C=O Amb1033069 [0,1,0,0,0,0|3,0,0]=4 2151 B12R1.121 CCCOc1ccccc1CCl Amb6622493 [0,1,0,0,0,0|2,1,0]=4 2152 B12R1.121 CCCOc1ccccc1CN Amb1141875 [0,1,0,0,0,0|3,0,0]=4 2153 B12R1.121 CCCOc1ccccc1CO Amb3542437 [0,1,0,0,0,0|3,0,0]=4 2154 B12R1.121 CCCOc1ccccc1NC Amb18316381 [0,1,0,0,0,0|3,0,0]=4 2155 B12R1.121 CCCSc1ccccc1CCl Amb32697564 [0,1,0,0,0,0|2,1,0]=4 2156 B12R1.121 CCNCc1ccccc1C#N Amb10610322 [0,1,0,0,0,0|3,0,0]=4 2157 B12R1.121 CCNCc1ccccc1C#N Amb6247254 [0,1,0,0,0,0|3,0,0]=4 2158 B12R1.121 CCNCc1ccccc1CN Amb19649753 [0,1,0,0,0,0|3,0,0]=4 2159 B12R1.121 CCNCc1ccccc1CO Amb6739981 [0,1,0,0,0,0|3,0,0]=4 2160 B12R1.121 CCNCc1ccccc1OC Amb6864718 [0,1,0,0,0,0|3,0,0]=4 2161 B12R1.121 CCNCc1ccccc1OC Amb837659 [0,1,0,0,0,0|3,0,0]=4 2162 B12R1.121 CCOCc1ccccc1C#N Amb6257394 [0,1,0,0,0,0|3,0,0]=4 2163 B12R1.121 CCOCc1ccccc1CN Amb1137684 [0,1,0,0,0,0|3,0,0]=4 2164 B12R1.121 CCc1ccccc1CCC#N Amb25995564 [0,1,0,0,0,0|3,0,0]=4 2165 B12R1.121 CCc1ccccc1CCC=O Amb33448757 [0,1,0,0,0,0|3,0,0]=4 2166 B12R1.121 CCc1ccccc1CCCBr Amb33451547 [0,1,0,0,0,0|3,0,0]=4 2167 B12R1.121 CCc1ccccc1CCCN Amb18310623 [0,1,0,0,0,0|3,0,0]=4 2168 B12R1.121 CCc1ccccc1CCCO Amb32950119 [0,1,0,0,0,0|3,0,0]=4 2169 B12R1.121 CCc1ccccc1CCCS Amb33198664 [0,1,0,0,0,0|3,0,0]=4 2170 B12R1.121 CCc1ccccc1CCNC Amb33475047 [0,1,0,0,0,0|1,0,0]=2 2171 B12R1.121 CCc1ccccc1CCON Amb33199000 [0,1,0,0,0,0|3,0,0]=4 2172 B12R1.121 CNCCc1ccccc1C#N Amb27167755 [0,1,0,0,0,0|1,0,0]=2 2173 B12R1.121 CNCCc1ccccc1CO Amb8629051 [0,1,0,0,0,0|1,0,0]=2 2174 B12R1.121 CNCCc1ccccc1OC Amb33544252 [0,1,0,0,0,0|1,0,0]=2 2175 B12R1.121 CNCCc1ccccc1SC Amb33429970 [0,1,0,0,0,0|1,0,0]=2 2176 B12R1.121 CNCCc1cccnc1OC Amb33449209 [0,1,0,0,0,0|2,0,0]=3 2177 B12R1.121 CNCCc1ncccc1OC Amb32953939 [0,1,0,0,0,0|2,0,0]=3 2178 B12R1.121 CN\C=C/c1ccccc1OC Amb27828629 [0,1,0,0,0,0|1,0,2]=4 2179 B12R1.121 CN\C=C\c1ccccc1OC Amb28051924 [0,1,0,0,0,0|1,0,2]=4 2180 B12R1.121 CN\N=C\c1ccccc1OC Amb17865864 [0,1,0,0,0,0|2,0,1]=4 2181 B12R1.121 CN\N=N\c1ccccc1CO Amb27260257 [0,1,0,0,0,0|3,0,0]=4 2182 B12R1.121 CNc1ccccc1CCCO Amb26445075 [0,1,0,0,0,0|3,0,0]=4 2183 B12R1.121 COCNc1ccccc1OC Amb27238667 [0,1,0,0,0,0|3,0,0]=4 2184 B12R1.121 COCOc1ccccc1C=O Amb17594124 [0,1,0,0,0,0|3,0,0]=4 2185 B12R1.121 CONCc1ccccc1C#N Amb27251390 [0,1,0,0,0,0|3,0,0]=4 2186 B12R1.121 CONCc1ccccc1OC Amb32653473 [0,1,0,0,0,0|3,0,0]=4 2187 B12R1.121 COc1ccccc1CCC#N Amb17508974 [0,1,0,0,0,0|3,0,0]=4 2188 B12R1.121 COc1ccccc1CCC=O Amb17081677 [0,1,0,0,0,0|3,0,0]=4 2189 B12R1.121 COc1ccccc1CCCBr Amb7089047 [0,1,0,0,0,0|3,0,0]=4 2190 B12R1.121 COc1ccccc1CCCCl Amb17104531 [0,1,0,0,0,0|3,0,0]=4 2191 B12R1.121 COc1ccccc1CCCN Amb2721871 [0,1,0,0,0,0|3,0,0]=4 2192 B12R1.121 COc1ccccc1CCCO Amb4019180 [0,1,0,0,0,0|3,0,0]=4 2193 B12R1.121 COc1ccccc1CCCS Amb17400949 [0,1,0,0,0,0|3,0,0]=4 2194 B12R1.121 COc1ccccc1CCNN Amb8828049 [0,1,0,0,0,0|2,0,0]=3 2195 B12R1.121 COc1ccccc1CCON Amb22896636 [0,1,0,0,0,0|3,0,0]=4 2196 B12R1.121 COc1ccccc1CC[Zn]Br Amb6300304 [0,1,0,0,0,0|3,0,0]=4 2197 B12R1.121 CSCSc1ccccc1C#N Amb28323914 [0,1,0,0,0,0|3,0,0]=4 2198 B12R1.121 CSc1ccccc1CCC#N Amb25239192 [0,1,0,0,0,0|3,0,0]=4 2199 B12R1.121 CSc1ccccc1CCC=O Amb33473857 [0,1,0,0,0,0|3,0,0]=4 2200 B12R1.121 CSc1ccccc1CCCBr Amb33240777 [0,1,0,0,0,0|3,0,0]=4 2201 B12R1.121 CSc1ccccc1CCCN Amb33079267 [0,1,0,0,0,0|3,0,0]=4 2202 B12R1.121 CSc1ccccc1CCCO Amb33079338 [0,1,0,0,0,0|3,0,0]=4 2203 B12R1.121 CSc1ccccc1CCCS Amb32876734 [0,1,0,0,0,0|3,0,0]=4 2204 B12R1.121 CSc1ccccc1CCON Amb33465864 [0,1,0,0,0,0|3,0,0]=4 2205 B12R1.121 C\C=C\Cc1ccccc1NC Amb27477966 [0,1,0,0,0,0|2,0,1]=4 2206 B12R1.121 FCCOc1ccccc1CBr Amb31207745 [0,1,0,0,0,0|3,0,0]=4 2207 B12R1.121 N#CCCc1ccccc1C#N Amb17593908 [0,1,0,0,0,0|3,0,0]=4 2208 B12R1.121 N#CCCc1ccccc1C=O Amb26627922 [0,1,0,0,0,0|3,0,0]=4 2209 B12R1.121 N#CCCc1ccccc1CBr Amb27613735 [0,1,0,0,0,0|2,0,0]=3 2210 B12R1.121 N#CCCc1ccccc1CCl Amb28246273 [0,1,0,0,0,0|2,1,0]=4 2211 B12R1.121 N#Cc1ccccc1CCC=O Amb25685434 [0,1,0,0,0,0|3,0,0]=4 2212 B12R1.121 N#Cc1ccccc1CCCBr Amb27614096 [0,1,0,0,0,0|3,0,0]=4 2213 B12R1.121 N#Cc1ccccc1CCCCl Amb28365648 [0,1,0,0,0,0|3,0,0]=4 2214 B12R1.121 N#Cc1ccccc1CCCN Amb18251586 [0,1,0,0,0,0|3,0,0]=4 2215 B12R1.121 N#Cc1ccccc1CCCO Amb28437188 [0,1,0,0,0,0|3,0,0]=4 2216 B12R1.121 N#Cc1ccccc1CCCS Amb33204244 [0,1,0,0,0,0|3,0,0]=4 2217 B12R1.121 N#Cc1ccccc1CCON Amb33314675 [0,1,0,0,0,0|3,0,0]=4 2218 B12R1.121 [C-]#[N+]CCc1ccccc1C#C Amb33204013 [0,1,0,0,0,0|1,0,2]=4 2219 B12R1.121 [C-]#[N+]CCc1ccccc1C#N Amb33314684 [0,1,0,0,0,0|1,0,2]=4 2220 B12R1.121 [C-]#[N+]CCc1ccccc1CC Amb33199008 [0,1,0,0,0,0|1,0,2]=4 2221 B12R1.121 [C-]#[N+]CCc1ccccc1OC Amb3973126 [0,1,0,0,0,0|1,0,2]=4 2222 B12R1.121 [C-]#[N+]CCc1ccccc1SC Amb33472542 [0,1,0,0,0,0|1,0,2]=4 2223 B12R1.125 C=C(Br)CNc1ccccc1Br Amb27863101 [0,1,0,0,0,0|2,0,1]=4 2224 B12R1.125 C=C(C)CCN1C=CC=CC1=O Amb28369040 [0,1,0,0,0,0|3,0,0]=4 2225 B12R1.125 C=C(C)COc1ccccc1Br Amb6273934 [0,1,0,0,0,0|2,0,0]=3 2226 B12R1.125 C=C(C)COc1ccccc1Cl Amb25831212 [0,1,0,0,0,0|2,1,0]=4 2227 B12R1.125 C=C(C)COc1ccccc1N Amb2081551 [0,1,0,0,0,0|3,0,0]=4 2228 B12R1.125 C=C(C)COc1ccccc1N Amb6740593 [0,1,0,0,0,0|3,0,0]=4 2229 B12R1.125 C=C(C)COc1ccccc1O Amb8837378 [0,1,0,0,0,0|3,0,0]=4 2230 B12R1.125 C=C(C)CSc1ccccc1C Amb4016676 [0,1,0,0,0,0|3,0,0]=4 2231 B12R1.125 C=C(C)CSc1ccccc1Cl Amb27589388 [0,1,0,0,0,0|2,1,0]=4 2232 B12R1.125 C=C(Cl)CCc1ccccc1Cl Amb6298966 [0,1,0,0,0,0|1,1,1]=4 2233 B12R1.125 C=C(Cl)CSc1ccccc1Br Amb27160007 [0,1,0,0,0,0|2,0,1]=4 2234 B12R1.125 C=C(F)COc1ccccc1Br Amb23570547 [0,1,0,0,0,0|2,0,1]=4 2235 B12R1.125 CC(=N)NCc1ccccc1Cl Amb27425220 [0,1,0,0,0,0|2,1,0]=4 2236 B12R1.125 CC(=O)CCc1ccccc1Br Amb9031563 [0,1,0,0,0,0|1,0,0]=2 2237 B12R1.125 CC(=O)CCc1ccccc1C Amb9031558 [0,1,0,0,0,0|2,0,0]=3 2238 B12R1.125 CC(=O)CCc1ccccc1Cl Amb9031570 [0,1,0,0,0,0|1,1,0]=3 2239 B12R1.125 CC(=O)CCc1ccccc1F Amb9031573 [0,1,0,0,0,0|1,1,0]=3 2240 B12R1.125 CC(=O)CCc1ccccc1N Amb27246247 [0,1,0,0,0,0|2,0,0]=3 2241 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,1,0,0,0,0|2,0,0]=3 2242 B12R1.125 CC(=O)CCc1cccnc1Br Amb33388129 [0,1,0,0,0,0|2,0,0]=3 2243 B12R1.125 CC(=O)CCc1cccnc1C Amb25859556 [0,1,0,0,0,0|3,0,0]=4 2244 B12R1.125 CC(=O)CCc1cccnc1Cl Amb25731066 [0,1,0,0,0,0|2,1,0]=4 2245 B12R1.125 CC(=O)CCc1cccnc1F Amb33377141 [0,1,0,0,0,0|2,1,0]=4 2246 B12R1.125 CC(=O)CCc1ccncc1Br Amb33385809 [0,1,0,0,0,0|2,0,0]=3 2247 B12R1.125 CC(=O)CCc1ccncc1C Amb26449976 [0,1,0,0,0,0|3,0,0]=4 2248 B12R1.125 CC(=O)CCc1ccncc1Cl Amb24678607 [0,1,0,0,0,0|2,1,0]=4 2249 B12R1.125 CC(=O)CCc1ccncc1F Amb26657206 [0,1,0,0,0,0|2,1,0]=4 2250 B12R1.125 CC(=O)CCc1cnccc1C Amb28205627 [0,1,0,0,0,0|3,0,0]=4 2251 B12R1.125 CC(=O)CCc1ncccc1Br Amb25703295 [0,1,0,0,0,0|2,0,0]=3 2252 B12R1.125 CC(=O)CCc1ncccc1C Amb26961458 [0,1,0,0,0,0|3,0,0]=4 2253 B12R1.125 CC(=O)CCc1ncccc1F Amb33419609 [0,1,0,0,0,0|2,1,0]=4 2254 B12R1.125 CC(=O)CNc1ccccc1C Amb25062983 [0,1,0,0,0,0|3,0,0]=4 2255 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,1,0,0,0,0|2,0,0]=3 2256 B12R1.125 CC(=O)COc1ccccc1F Amb9269602 [0,1,0,0,0,0|2,1,0]=4 2257 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,1,0,0,0,0|3,0,0]=4 2258 B12R1.125 CC(=O)COc1cccnc1Br Amb27665185 [0,1,0,0,0,0|3,0,0]=4 2259 B12R1.125 CC(=O)CSc1ccccc1Br Amb9229574 [0,1,0,0,0,0|2,0,0]=3 2260 B12R1.125 CC(=O)CSc1ccccc1C Amb18796318 [0,1,0,0,0,0|3,0,0]=4 2261 B12R1.125 CC(=O)CSc1ccccc1Cl Amb4744662 [0,1,0,0,0,0|2,1,0]=4 2262 B12R1.125 CC(=O)CSc1ccccc1F Amb9268572 [0,1,0,0,0,0|2,1,0]=4 2263 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [0,1,0,0,0,0|3,0,0]=4 2264 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [0,1,0,0,0,0|2,0,0]=3 2265 B12R1.125 CC(=O)NCc1ccccc1Cl Amb3094828 [0,1,0,0,0,0|2,1,0]=4 2266 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [0,1,0,0,0,0|2,1,0]=4 2267 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [0,1,0,0,0,0|3,0,0]=4 2268 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [0,1,0,0,0,0|3,0,0]=4 2269 B12R1.125 CC(=O)OCc1ccccc1N Amb27985013 [0,1,0,0,0,0|3,0,0]=4 2270 B12R1.125 CC(=O)SCc1ccccc1Cl Amb27767953 [0,1,0,0,0,0|2,1,0]=4 2271 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [0,1,0,0,0,0|1,0,2]=4 2272 B12R1.125 CC(=S)NCc1ccccc1Cl Amb27753692 [0,1,0,0,0,0|2,1,0]=4 2273 B12R1.125 CC(Br)CCc1ccccc1Cl Amb27425314 [0,1,0,0,0,0|1,1,0]=3 2274 B12R1.125 CC(Br)CCc1ccncc1Cl Amb27249810 [0,1,0,0,0,0|2,1,0]=4 2275 B12R1.125 CC(Br)CCc1ncccc1Br Amb27457039 [0,1,0,0,0,0|2,0,0]=3 2276 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [0,1,0,0,0,0|2,0,1]=4 2277 B12R1.125 CC(C)CC[n+]1ccccc1Br Amb27399385 [0,1,0,0,0,0|2,0,0]=3 2278 B12R1.125 CC(C)CC[n+]1ccccc1Cl Amb28204778 [0,1,0,0,0,0|2,1,0]=4 2279 B12R1.125 CC(C)CCc1ccccc1I Amb28244344 [0,1,0,0,0,0|1,1,0]=3 2280 B12R1.125 CC(C)CCc1ccccc1N Amb13951566 [0,1,0,0,0,0|2,0,0]=3 2281 B12R1.125 CC(C)CCc1ccccc1O Amb27972959 [0,1,0,0,0,0|2,0,0]=3 2282 B12R1.125 CC(C)CCc1ccncc1N Amb18828686 [0,1,0,0,0,0|3,0,0]=4 2283 B12R1.125 CC(C)CCc1cnccc1N Amb24417551 [0,1,0,0,0,0|3,0,0]=4 2284 B12R1.125 CC(C)CCc1ncccc1N Amb18828682 [0,1,0,0,0,0|3,0,0]=4 2285 B12R1.125 CC(C)CCc1ncccc1O Amb27255307 [0,1,0,0,0,0|3,0,0]=4 2286 B12R1.125 CC(C)CNc1ccccc1Br Amb6696377 [0,1,0,0,0,0|2,0,0]=3 2287 B12R1.125 CC(C)CNc1ccccc1Cl Amb6696853 [0,1,0,0,0,0|2,1,0]=4 2288 B12R1.125 CC(C)CNc1ccccc1F Amb6697273 [0,1,0,0,0,0|2,1,0]=4 2289 B12R1.125 CC(C)CNc1ccccc1I Amb7785761 [0,1,0,0,0,0|2,1,0]=4 2290 B12R1.125 CC(C)CNc1ccccc1N Amb7767494 [0,1,0,0,0,0|3,0,0]=4 2291 B12R1.125 CC(C)CNc1ncccc1Br Amb28456824 [0,1,0,0,0,0|3,0,0]=4 2292 B12R1.125 CC(C)COc1ccccc1Br Amb6271437 [0,1,0,0,0,0|2,0,0]=3 2293 B12R1.125 CC(C)COc1ccccc1Cl Amb24632680 [0,1,0,0,0,0|2,1,0]=4 2294 B12R1.125 CC(C)COc1ccccc1N Amb1137660 [0,1,0,0,0,0|3,0,0]=4 2295 B12R1.125 CC(C)COc1ccccc1N Amb2140563 [0,1,0,0,0,0|3,0,0]=4 2296 B12R1.125 CC(C)COc1ccccc1O Amb1016836 [0,1,0,0,0,0|3,0,0]=4 2297 B12R1.125 CC(C)COc1ccccc1S Amb25844615 [0,1,0,0,0,0|3,0,0]=4 2298 B12R1.125 CC(C)COc1cccnc1Br Amb27976379 [0,1,0,0,0,0|3,0,0]=4 2299 B12R1.125 CC(C)COc1ncccc1Br Amb27780761 [0,1,0,0,0,0|3,0,0]=4 2300 B12R1.125 CC(C)CSc1ccccc1Br Amb24728137 [0,1,0,0,0,0|2,0,0]=3 2301 B12R1.125 CC(C)CSc1ncccc1Br Amb27852887 [0,1,0,0,0,0|3,0,0]=4 2302 B12R1.125 CC(C)NCc1ccccc1Br Amb2111113 [0,1,0,0,0,0|2,0,0]=3 2303 B12R1.125 CC(C)NCc1ccccc1Br Amb6248131 [0,1,0,0,0,0|2,0,0]=3 2304 B12R1.125 CC(C)NCc1ccccc1Cl Amb2098773 [0,1,0,0,0,0|2,1,0]=4 2305 B12R1.125 CC(C)NCc1ccccc1Cl Amb2785874 [0,1,0,0,0,0|2,1,0]=4 2306 B12R1.125 CC(C)NCc1ccccc1F Amb2118765 [0,1,0,0,0,0|2,1,0]=4 2307 B12R1.125 CC(C)NCc1ccccc1F Amb6252500 [0,1,0,0,0,0|2,1,0]=4 2308 B12R1.125 CC(C)NCc1ccccc1I Amb21861743 [0,1,0,0,0,0|2,1,0]=4 2309 B12R1.125 CC(C)NCc1ccccc1N Amb18973318 [0,1,0,0,0,0|3,0,0]=4 2310 B12R1.125 CC(C)NCc1ccccc1O Amb20673451 [0,1,0,0,0,0|3,0,0]=4 2311 B12R1.125 CC(C)NCc1ccccc1O Amb4297794 [0,1,0,0,0,0|3,0,0]=4 2312 B12R1.125 CC(C)NCc1ccncc1Br Amb27433774 [0,1,0,0,0,0|3,0,0]=4 2313 B12R1.125 CC(C)OCc1ccccc1Br Amb22900130 [0,1,0,0,0,0|2,0,0]=3 2314 B12R1.125 CC(C)OCc1ccccc1N Amb6251243 [0,1,0,0,0,0|3,0,0]=4 2315 B12R1.125 CC(C)OCc1ccccc1S Amb26478592 [0,1,0,0,0,0|3,0,0]=4 2316 B12R1.125 CC(C)OCc1cccnc1Br Amb27260365 [0,1,0,0,0,0|3,0,0]=4 2317 B12R1.125 CC(C)OCc1ccncc1Br Amb27484871 [0,1,0,0,0,0|3,0,0]=4 2318 B12R1.125 CC(C)SCc1ccccc1Br Amb22228181 [0,1,0,0,0,0|2,0,0]=3 2319 B12R1.125 CC(C)SCc1ccccc1Cl Amb28283495 [0,1,0,0,0,0|2,1,0]=4 2320 B12R1.125 CC(F)CCc1ccccc1O Amb27958749 [0,1,0,0,0,0|2,0,0]=3 2321 B12R1.125 CC(F)COc1ccccc1O Amb27958799 [0,1,0,0,0,0|3,0,0]=4 2322 B12R1.125 CC(F)CSc1ccccc1O Amb27958812 [0,1,0,0,0,0|3,0,0]=4 2323 B12R1.125 CC(N)CCc1ccccc1Br Amb9031766 [0,1,0,0,0,0|1,0,0]=2 2324 B12R1.125 CC(N)CCc1ccccc1Cl Amb2721943 [0,1,0,0,0,0|1,1,0]=3 2325 B12R1.125 CC(N)CCc1ccccc1F Amb9031774 [0,1,0,0,0,0|1,1,0]=3 2326 B12R1.125 CC(N)CCc1ccccc1O Amb17507315 [0,1,0,0,0,0|2,0,0]=3 2327 B12R1.125 CC(N)CCc1cccnc1Br Amb33387776 [0,1,0,0,0,0|2,0,0]=3 2328 B12R1.125 CC(N)CCc1cccnc1Cl Amb33257363 [0,1,0,0,0,0|2,1,0]=4 2329 B12R1.125 CC(N)CCc1cccnc1F Amb33224050 [0,1,0,0,0,0|2,1,0]=4 2330 B12R1.125 CC(N)CCc1ccncc1Br Amb33450963 [0,1,0,0,0,0|2,0,0]=3 2331 B12R1.125 CC(N)CCc1ccncc1Cl Amb27985656 [0,1,0,0,0,0|2,1,0]=4 2332 B12R1.125 CC(N)CCc1ccncc1F Amb26841241 [0,1,0,0,0,0|2,1,0]=4 2333 B12R1.125 CC(N)CCc1ncccc1Br Amb24462438 [0,1,0,0,0,0|2,0,0]=3 2334 B12R1.125 CC(N)CCc1ncccc1F Amb33419590 [0,1,0,0,0,0|2,1,0]=4 2335 B12R1.125 CC(N)CNc1ccccc1Br Amb27399526 [0,1,0,0,0,0|2,0,0]=3 2336 B12R1.125 CC(N)CNc1ccccc1Cl Amb26923176 [0,1,0,0,0,0|2,1,0]=4 2337 B12R1.125 CC(N)CNc1ccccc1F Amb27756404 [0,1,0,0,0,0|2,1,0]=4 2338 B12R1.125 CC(N)COc1ccccc1Br Amb17062516 [0,1,0,0,0,0|2,0,0]=3 2339 B12R1.125 CC(N)COc1ccccc1Cl Amb9756354 [0,1,0,0,0,0|2,1,0]=4 2340 B12R1.125 CC(N)COc1ccccc1F Amb1134402 [0,1,0,0,0,0|2,1,0]=4 2341 B12R1.125 CC(N)COc1ccccc1O Amb27814458 [0,1,0,0,0,0|3,0,0]=4 2342 B12R1.125 CC(N)COc1ccncc1Br Amb35727459 [0,1,0,0,0,0|3,0,0]=4 2343 B12R1.125 CC(N)COc1ncccc1Br Amb35727460 [0,1,0,0,0,0|3,0,0]=4 2344 B12R1.125 CC(N)CSc1ccccc1N Amb18648678 [0,1,0,0,0,0|3,0,0]=4 2345 B12R1.125 CC(N)\C=C\c1ccccc1Br Amb33242295 [0,1,0,0,0,0|1,0,2]=4 2346 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,1,0,0,0,0|1,0,0]=2 2347 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,1,0,0,0,0|1,1,0]=3 2348 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,1,0,0,0,0|1,1,0]=3 2349 B12R1.125 CC(O)CCc1ccccc1O Amb17507249 [0,1,0,0,0,0|2,0,0]=3 2350 B12R1.125 CC(O)CCc1cccnc1Br Amb33387779 [0,1,0,0,0,0|2,0,0]=3 2351 B12R1.125 CC(O)CCc1cccnc1Cl Amb33257367 [0,1,0,0,0,0|2,1,0]=4 2352 B12R1.125 CC(O)CCc1cccnc1F Amb33377666 [0,1,0,0,0,0|2,1,0]=4 2353 B12R1.125 CC(O)CCc1ccncc1Br Amb33242104 [0,1,0,0,0,0|2,0,0]=3 2354 B12R1.125 CC(O)CCc1ccncc1Cl Amb25053788 [0,1,0,0,0,0|2,1,0]=4 2355 B12R1.125 CC(O)CCc1ccncc1F Amb27946215 [0,1,0,0,0,0|2,1,0]=4 2356 B12R1.125 CC(O)CCc1ncccc1Br Amb26038236 [0,1,0,0,0,0|2,0,0]=3 2357 B12R1.125 CC(O)CCc1ncccc1F Amb33418875 [0,1,0,0,0,0|2,1,0]=4 2358 B12R1.125 CC(O)CNc1ccccc1Br Amb17142610 [0,1,0,0,0,0|2,0,0]=3 2359 B12R1.125 CC(O)CNc1ccccc1Cl Amb17139125 [0,1,0,0,0,0|2,1,0]=4 2360 B12R1.125 CC(O)CNc1ccccc1F Amb17138650 [0,1,0,0,0,0|2,1,0]=4 2361 B12R1.125 CC(O)CNc1ccccc1I Amb28410519 [0,1,0,0,0,0|2,1,0]=4 2362 B12R1.125 CC(O)CNc1ccccc1N Amb9359006 [0,1,0,0,0,0|3,0,0]=4 2363 B12R1.125 CC(O)CNc1ccncc1Br Amb27654861 [0,1,0,0,0,0|3,0,0]=4 2364 B12R1.125 CC(O)COc1ccccc1Cl Amb25337460 [0,1,0,0,0,0|2,1,0]=4 2365 B12R1.125 CC(O)COc1ccccc1F Amb18806458 [0,1,0,0,0,0|2,1,0]=4 2366 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [0,1,0,0,0,0|3,0,0]=4 2367 B12R1.125 CC(O)COc1cccnc1Br Amb28241064 [0,1,0,0,0,0|3,0,0]=4 2368 B12R1.125 CC(O)CSc1ccccc1Cl Amb27477548 [0,1,0,0,0,0|2,1,0]=4 2369 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [0,1,0,0,0,0|1,0,2]=4 2370 B12R1.125 CN(C)CCN1C=CC=CC1=O Amb27972586 [0,1,0,0,0,0|2,0,0]=3 2371 B12R1.125 CN(C)CCN1C=CN=CC1=O Amb28127682 [0,1,0,0,0,0|3,0,0]=4 2372 B12R1.125 CN(C)CCc1ccccc1Br Amb25795341 [0,1,0,0,0,0|0,0,0]=1 2373 B12R1.125 CN(C)CCc1ccccc1Cl Amb27755453 [0,1,0,0,0,0|0,1,0]=2 2374 B12R1.125 CN(C)CCc1ccccc1I Amb28280836 [0,1,0,0,0,0|0,1,0]=2 2375 B12R1.125 CN(C)CCc1ccccc1N Amb5733548 [0,1,0,0,0,0|1,0,0]=2 2376 B12R1.125 CN(C)NCc1ccccc1N Amb18646396 [0,1,0,0,0,0|2,0,0]=3 2377 B12R1.125 CN(C)NCc1ccncc1Cl Amb27251467 [0,1,0,0,0,0|2,1,0]=4 2378 B12R1.125 CN(C)\C=N\c1ccccc1I Amb2241300 [0,1,0,0,0,0|1,1,1]=4 2379 B12R1.125 CN(C)\C=P\c1ccccc1O Amb28381183 [0,1,0,0,0,0|2,0,1]=4 2380 B12R1.125 CN(C)\N=C\c1ccccc1Br Amb16842475 [0,1,0,0,0,0|1,0,1]=3 2381 B12R1.125 CN(C)\N=C\c1ccccc1F Amb17804258 [0,1,0,0,0,0|1,1,1]=4 2382 B12R1.125 CN(C)\N=C\c1ccccc1I Amb27651459 [0,1,0,0,0,0|1,1,1]=4 2383 B12R1.125 CN(N)CCc1ccccc1Cl Amb18564316 [0,1,0,0,0,0|0,1,0]=2 2384 B12R1.125 CN(N)CCc1ccccc1F Amb18563850 [0,1,0,0,0,0|0,1,0]=2 2385 B12R1.125 CS(=O)CCc1cccnc1N Amb27469143 [0,1,0,0,0,0|3,0,0]=4 2386 B12R1.125 CS(=O)CCc1cnccc1N Amb27787312 [0,1,0,0,0,0|3,0,0]=4 2387 B12R1.125 CS(=O)\N=C\c1ccccc1Br Amb35718864 [0,1,0,0,0,0|2,0,1]=4 2388 B12R1.125 C[C@@H](N)CCc1ccccc1Br Amb33242308 [0,1,0,0,0,0|1,0,0]=2 2389 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [0,1,0,0,0,0|1,1,0]=3 2390 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb32750188 [0,1,0,0,0,0|1,1,0]=3 2391 B12R1.125 C[C@@H](N)CCc1ccccc1F Amb27817738 [0,1,0,0,0,0|1,1,0]=3 2392 B12R1.125 C[C@@H](N)CCc1ccccc1O Amb27830642 [0,1,0,0,0,0|2,0,0]=3 2393 B12R1.125 C[C@@H](N)CCc1cccnc1Br Amb33387791 [0,1,0,0,0,0|2,0,0]=3 2394 B12R1.125 C[C@@H](N)CCc1cccnc1Cl Amb33257030 [0,1,0,0,0,0|2,1,0]=4 2395 B12R1.125 C[C@@H](N)CCc1cccnc1F Amb33377663 [0,1,0,0,0,0|2,1,0]=4 2396 B12R1.125 C[C@@H](N)CCc1ccncc1Br Amb33388593 [0,1,0,0,0,0|2,0,0]=3 2397 B12R1.125 C[C@@H](N)CCc1ccncc1Cl Amb33413795 [0,1,0,0,0,0|2,1,0]=4 2398 B12R1.125 C[C@@H](N)CCc1ccncc1F Amb33317436 [0,1,0,0,0,0|2,1,0]=4 2399 B12R1.125 C[C@@H](N)CCc1ncccc1Br Amb33336049 [0,1,0,0,0,0|2,0,0]=3 2400 B12R1.125 C[C@@H](N)CCc1ncccc1F Amb33418889 [0,1,0,0,0,0|2,1,0]=4 2401 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [0,1,0,0,0,0|2,0,0]=3 2402 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [0,1,0,0,0,0|2,1,0]=4 2403 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [0,1,0,0,0,0|2,1,0]=4 2404 B12R1.125 C[C@@H](N)COc1ccccc1I Amb29850634 [0,1,0,0,0,0|2,1,0]=4 2405 B12R1.125 C[C@@H](N)CSc1ccccc1Br Amb27847418 [0,1,0,0,0,0|2,0,0]=3 2406 B12R1.125 C[C@@H](N)CSc1ccccc1Cl Amb28430384 [0,1,0,0,0,0|2,1,0]=4 2407 B12R1.125 C[C@@H](N)CSc1ccccc1F Amb27663015 [0,1,0,0,0,0|2,1,0]=4 2408 B12R1.125 C[C@@H](O)CCc1ccccc1Br Amb33387630 [0,1,0,0,0,0|1,0,0]=2 2409 B12R1.125 C[C@@H](O)CCc1ccccc1Cl Amb33052597 [0,1,0,0,0,0|1,1,0]=3 2410 B12R1.125 C[C@@H](O)CCc1ccccc1F Amb33361481 [0,1,0,0,0,0|1,1,0]=3 2411 B12R1.125 C[C@@H](O)CCc1ccccc1O Amb33196173 [0,1,0,0,0,0|2,0,0]=3 2412 B12R1.125 C[C@@H](O)CCc1cccnc1Br Amb33387786 [0,1,0,0,0,0|2,0,0]=3 2413 B12R1.125 C[C@@H](O)CCc1cccnc1Cl Amb33257027 [0,1,0,0,0,0|2,1,0]=4 2414 B12R1.125 C[C@@H](O)CCc1cccnc1F Amb33377664 [0,1,0,0,0,0|2,1,0]=4 2415 B12R1.125 C[C@@H](O)CCc1ccncc1Br Amb33388260 [0,1,0,0,0,0|2,0,0]=3 2416 B12R1.125 C[C@@H](O)CCc1ccncc1Cl Amb33413792 [0,1,0,0,0,0|2,1,0]=4 2417 B12R1.125 C[C@@H](O)CCc1ccncc1F Amb33317437 [0,1,0,0,0,0|2,1,0]=4 2418 B12R1.125 C[C@@H](O)CCc1ncccc1Br Amb33336091 [0,1,0,0,0,0|2,0,0]=3 2419 B12R1.125 C[C@@H](O)CCc1ncccc1F Amb33418795 [0,1,0,0,0,0|2,1,0]=4 2420 B12R1.125 C[C@@H](O)CNc1ccccc1Cl Amb27848418 [0,1,0,0,0,0|2,1,0]=4 2421 B12R1.125 C[C@@H](O)COc1ccccc1F Amb27754541 [0,1,0,0,0,0|2,1,0]=4 2422 B12R1.125 C[C@@H](O)COc1ccccc1I Amb35687744 [0,1,0,0,0,0|2,1,0]=4 2423 B12R1.125 C[C@@H](O)CSc1ccccc1O Amb27466695 [0,1,0,0,0,0|3,0,0]=4 2424 B12R1.125 C[C@H](N)CCc1ccccc1Br Amb27812499 [0,1,0,0,0,0|1,0,0]=2 2425 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [0,1,0,0,0,0|1,1,0]=3 2426 B12R1.125 C[C@H](N)CCc1ccccc1F Amb26946665 [0,1,0,0,0,0|1,1,0]=3 2427 B12R1.125 C[C@H](N)CCc1ccccc1N Amb28201211 [0,1,0,0,0,0|2,0,0]=3 2428 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [0,1,0,0,0,0|2,0,0]=3 2429 B12R1.125 C[C@H](N)CCc1cccnc1Br Amb33387784 [0,1,0,0,0,0|2,0,0]=3 2430 B12R1.125 C[C@H](N)CCc1cccnc1Cl Amb33257031 [0,1,0,0,0,0|2,1,0]=4 2431 B12R1.125 C[C@H](N)CCc1cccnc1F Amb33377662 [0,1,0,0,0,0|2,1,0]=4 2432 B12R1.125 C[C@H](N)CCc1ccncc1Br Amb33388606 [0,1,0,0,0,0|2,0,0]=3 2433 B12R1.125 C[C@H](N)CCc1ccncc1Cl Amb33413799 [0,1,0,0,0,0|2,1,0]=4 2434 B12R1.125 C[C@H](N)CCc1ccncc1F Amb33317435 [0,1,0,0,0,0|2,1,0]=4 2435 B12R1.125 C[C@H](N)CCc1ncccc1Br Amb33337343 [0,1,0,0,0,0|2,0,0]=3 2436 B12R1.125 C[C@H](N)CCc1ncccc1F Amb33418888 [0,1,0,0,0,0|2,1,0]=4 2437 B12R1.125 C[C@H](N)COc1ccccc1I Amb29850633 [0,1,0,0,0,0|2,1,0]=4 2438 B12R1.125 C[C@H](O)CCc1ccccc1Br Amb33387628 [0,1,0,0,0,0|1,0,0]=2 2439 B12R1.125 C[C@H](O)CCc1ccccc1Cl Amb33052594 [0,1,0,0,0,0|1,1,0]=3 2440 B12R1.125 C[C@H](O)CCc1ccccc1F Amb33361482 [0,1,0,0,0,0|1,1,0]=3 2441 B12R1.125 C[C@H](O)CCc1ccccc1O Amb33196408 [0,1,0,0,0,0|2,0,0]=3 2442 B12R1.125 C[C@H](O)CCc1cccnc1Br Amb33387783 [0,1,0,0,0,0|2,0,0]=3 2443 B12R1.125 C[C@H](O)CCc1cccnc1Cl Amb33257023 [0,1,0,0,0,0|2,1,0]=4 2444 B12R1.125 C[C@H](O)CCc1cccnc1F Amb33377665 [0,1,0,0,0,0|2,1,0]=4 2445 B12R1.125 C[C@H](O)CCc1ccncc1Br Amb33388502 [0,1,0,0,0,0|2,0,0]=3 2446 B12R1.125 C[C@H](O)CCc1ccncc1Cl Amb33413788 [0,1,0,0,0,0|2,1,0]=4 2447 B12R1.125 C[C@H](O)CCc1ccncc1F Amb33317438 [0,1,0,0,0,0|2,1,0]=4 2448 B12R1.125 C[C@H](O)CCc1ncccc1Br Amb33337344 [0,1,0,0,0,0|2,0,0]=3 2449 B12R1.125 C[C@H](O)CCc1ncccc1F Amb33418796 [0,1,0,0,0,0|2,1,0]=4 2450 B12R1.125 C[C@H](O)CNc1ccccc1Br Amb27213619 [0,1,0,0,0,0|2,0,0]=3 2451 B12R1.125 C[C@H](O)CNc1ccccc1Cl Amb28244269 [0,1,0,0,0,0|2,1,0]=4 2452 B12R1.125 C[C@H](O)COc1ccccc1Br Amb28244310 [0,1,0,0,0,0|2,0,0]=3 2453 B12R1.125 C[C@H](O)COc1ccccc1I Amb35687743 [0,1,0,0,0,0|2,1,0]=4 2454 B12R1.125 Cc1ccccc1CCC(=N)N Amb18065464 [0,1,0,0,0,0|3,0,0]=4 2455 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,1,0,0,0,0|3,0,0]=4 2456 B12R1.125 Cc1ccccc1CCC(=O)O Amb2689629 [0,1,0,0,0,0|3,0,0]=4 2457 B12R1.125 Cc1ccccc1CCC(C)Br Amb27647242 [0,1,0,0,0,0|2,0,0]=3 2458 B12R1.125 Cc1ccccc1CCC(C)C Amb8394140 [0,1,0,0,0,0|2,0,0]=3 2459 B12R1.125 Cc1ccccc1CCC(C)N Amb9031759 [0,1,0,0,0,0|2,0,0]=3 2460 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,1,0,0,0,0|2,0,0]=3 2461 B12R1.125 Cc1ccccc1CCC(N)=O Amb17400134 [0,1,0,0,0,0|3,0,0]=4 2462 B12R1.125 Cc1ccccc1CCN(C)N Amb18563651 [0,1,0,0,0,0|1,0,0]=2 2463 B12R1.125 Cc1ccccc1CC[C@@H](C)N Amb33225585 [0,1,0,0,0,0|2,0,0]=3 2464 B12R1.125 Cc1ccccc1CC[C@@H](C)O Amb33360566 [0,1,0,0,0,0|2,0,0]=3 2465 B12R1.125 Cc1ccccc1CC[C@H](C)N Amb26611454 [0,1,0,0,0,0|2,0,0]=3 2466 B12R1.125 Cc1ccccc1CC[C@H](C)O Amb33360567 [0,1,0,0,0,0|2,0,0]=3 2467 B12R1.125 Cc1ccccc1CC[N+](=O)[O-] Amb17400176 [0,1,0,0,0,0|2,0,1]=4 2468 B12R1.125 Cc1ccccc1CNC(C)C Amb2118769 [0,1,0,0,0,0|3,0,0]=4 2469 B12R1.125 Cc1ccccc1CNC(C)C Amb6243580 [0,1,0,0,0,0|3,0,0]=4 2470 B12R1.125 Cc1ccccc1NCC(C)C Amb6701131 [0,1,0,0,0,0|3,0,0]=4 2471 B12R1.125 Cc1ccccc1NCC(C)N Amb25913696 [0,1,0,0,0,0|3,0,0]=4 2472 B12R1.125 Cc1ccccc1NCC(C)O Amb17138592 [0,1,0,0,0,0|3,0,0]=4 2473 B12R1.125 Cc1ccccc1NCC(C)S Amb27658986 [0,1,0,0,0,0|3,0,0]=4 2474 B12R1.125 Cc1ccccc1OCC(C)N Amb9756347 [0,1,0,0,0,0|3,0,0]=4 2475 B12R1.125 Cc1ccccc1OCC(C)O Amb18182639 [0,1,0,0,0,0|3,0,0]=4 2476 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [0,1,0,0,0,0|3,0,0]=4 2477 B12R1.125 Cc1ccccc1OC[C@@H](C)O Amb27225582 [0,1,0,0,0,0|3,0,0]=4 2478 B12R1.125 Cc1ccccc1SCC(C)C Amb25730826 [0,1,0,0,0,0|3,0,0]=4 2479 B12R1.125 Cc1ccccc1SC[C@@H](C)N Amb27879389 [0,1,0,0,0,0|3,0,0]=4 2480 B12R1.125 Cc1ccccc1SC[C@H](C)O Amb28075850 [0,1,0,0,0,0|3,0,0]=4 2481 B12R1.125 Cc1ccccc1\C=N\N(C)C Amb28283585 [0,1,0,0,0,0|2,0,1]=4 2482 B12R1.125 Cc1ccccc1\N=C\N(C)C Amb24557059 [0,1,0,0,0,0|2,0,1]=4 2483 B12R1.125 Cc1cccnc1CCC(C)N Amb30029447 [0,1,0,0,0,0|3,0,0]=4 2484 B12R1.125 Cc1cccnc1CCC(C)O Amb27663089 [0,1,0,0,0,0|3,0,0]=4 2485 B12R1.125 Cc1cccnc1CCN(C)C Amb29868811 [0,1,0,0,0,0|2,0,0]=3 2486 B12R1.125 Cc1cccnc1CC[C@@H](C)N Amb33428755 [0,1,0,0,0,0|3,0,0]=4 2487 B12R1.125 Cc1cccnc1CC[C@@H](C)O Amb33428756 [0,1,0,0,0,0|3,0,0]=4 2488 B12R1.125 Cc1cccnc1CC[C@H](C)N Amb33428754 [0,1,0,0,0,0|3,0,0]=4 2489 B12R1.125 Cc1cccnc1CC[C@H](C)O Amb33428790 [0,1,0,0,0,0|3,0,0]=4 2490 B12R1.125 Cc1cccnc1CNN(C)C Amb27652306 [0,1,0,0,0,0|3,0,0]=4 2491 B12R1.125 Cc1ccncc1CCC(C)N Amb28256045 [0,1,0,0,0,0|3,0,0]=4 2492 B12R1.125 Cc1ccncc1CCC(C)O Amb27149348 [0,1,0,0,0,0|3,0,0]=4 2493 B12R1.125 Cc1ccncc1CC[C@@H](C)N Amb33376700 [0,1,0,0,0,0|3,0,0]=4 2494 B12R1.125 Cc1ccncc1CC[C@@H](C)O Amb33376701 [0,1,0,0,0,0|3,0,0]=4 2495 B12R1.125 Cc1ccncc1CC[C@H](C)N Amb33376699 [0,1,0,0,0,0|3,0,0]=4 2496 B12R1.125 Cc1ccncc1CC[C@H](C)O Amb33377430 [0,1,0,0,0,0|3,0,0]=4 2497 B12R1.125 Cc1cnccc1CCC(C)N Amb28144798 [0,1,0,0,0,0|3,0,0]=4 2498 B12R1.125 Cc1cnccc1CCC(C)O Amb25986351 [0,1,0,0,0,0|3,0,0]=4 2499 B12R1.125 Cc1cnccc1CCN(C)C Amb27811134 [0,1,0,0,0,0|2,0,0]=3 2500 B12R1.125 Cc1cnccc1CC[C@@H](C)N Amb33414173 [0,1,0,0,0,0|3,0,0]=4 2501 B12R1.125 Cc1cnccc1CC[C@@H](C)O Amb33414171 [0,1,0,0,0,0|3,0,0]=4 2502 B12R1.125 Cc1cnccc1CC[C@H](C)N Amb33414329 [0,1,0,0,0,0|3,0,0]=4 2503 B12R1.125 Cc1cnccc1CC[C@H](C)O Amb33414328 [0,1,0,0,0,0|3,0,0]=4 2504 B12R1.125 Cc1ncccc1CCC(C)N Amb32879705 [0,1,0,0,0,0|3,0,0]=4 2505 B12R1.125 Cc1ncccc1CCC(C)O Amb26342122 [0,1,0,0,0,0|3,0,0]=4 2506 B12R1.125 Cc1ncccc1CC[C@@H](C)N Amb32879645 [0,1,0,0,0,0|3,0,0]=4 2507 B12R1.125 Cc1ncccc1CC[C@@H](C)O Amb32878985 [0,1,0,0,0,0|3,0,0]=4 2508 B12R1.125 Cc1ncccc1CC[C@H](C)N Amb32879644 [0,1,0,0,0,0|3,0,0]=4 2509 B12R1.125 Cc1ncccc1CC[C@H](C)O Amb32878987 [0,1,0,0,0,0|3,0,0]=4 2510 B12R1.125 FC(F)COc1ccccc1Br Amb22008304 [0,1,0,0,0,0|3,0,0]=4 2511 B12R1.125 FC(F)CSc1ccccc1Br Amb10976061 [0,1,0,0,0,0|3,0,0]=4 2512 B12R1.125 N=C(N)CCc1ccccc1Br Amb18070244 [0,1,0,0,0,0|2,0,0]=3 2513 B12R1.125 N=C(N)CCc1ccccc1Cl Amb10844871 [0,1,0,0,0,0|2,1,0]=4 2514 B12R1.125 N=C(N)CCc1ccccc1F Amb18563718 [0,1,0,0,0,0|2,1,0]=4 2515 B12R1.125 N=C(N)NCc1ccccc1Br Amb33456834 [0,1,0,0,0,0|3,0,0]=4 2516 B12R1.125 N=C(N)NCc1ccccc1Br Amb580130 [0,1,0,0,0,0|3,0,0]=4 2517 B12R1.125 N=C(N)SCc1ccccc1Br Amb20676051 [0,1,0,0,0,0|3,0,0]=4 2518 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,1,0,0,0,0|2,0,0]=3 2519 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,1,0,0,0,0|2,1,0]=4 2520 B12R1.125 NC(=O)CCc1ccccc1F Amb8341221 [0,1,0,0,0,0|2,1,0]=4 2521 B12R1.125 NC(=O)CCc1ccccc1N Amb8941622 [0,1,0,0,0,0|3,0,0]=4 2522 B12R1.125 NC(=O)CCc1ccccc1O Amb2695332 [0,1,0,0,0,0|3,0,0]=4 2523 B12R1.125 NC(=O)CNc1ccccc1Br Amb6712122 [0,1,0,0,0,0|3,0,0]=4 2524 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,1,0,0,0,0|3,0,0]=4 2525 B12R1.125 NC(=S)COc1ccccc1Br Amb6278086 [0,1,0,0,0,0|3,0,0]=4 2526 B12R1.125 NC(=S)CSc1ccccc1Br Amb28342723 [0,1,0,0,0,0|3,0,0]=4 2527 B12R1.125 Nc1ccccc1CCC(=O)O Amb17477727 [0,1,0,0,0,0|3,0,0]=4 2528 B12R1.125 Nc1ccccc1CCC(=O)O Amb24118035 [0,1,0,0,0,0|3,0,0]=4 2529 B12R1.125 Nc1ccccc1CCC(=O)[O-] Amb34189651 [0,1,0,0,0,0|3,0,0]=4 2530 B12R1.125 Nc1ccccc1CCC(F)F Amb27958848 [0,1,0,0,0,0|3,0,0]=4 2531 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,1,0,0,0,0|2,0,0]=3 2532 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,1,0,0,0,0|2,1,0]=4 2533 B12R1.125 O=C(Cl)CCc1ccccc1F Amb10838958 [0,1,0,0,0,0|2,1,0]=4 2534 B12R1.125 O=C(Cl)COc1ccccc1Br Amb16230053 [0,1,0,0,0,0|3,0,0]=4 2535 B12R1.125 O=C(Cl)NCc1ccccc1Br Amb35625598 [0,1,0,0,0,0|3,0,0]=4 2536 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [0,1,0,0,0,0|3,0,0]=4 2537 B12R1.125 O=C(O)CCc1ccccc1Br Amb2685458 [0,1,0,0,0,0|2,0,0]=3 2538 B12R1.125 O=C(O)CCc1ccccc1Cl Amb1209214 [0,1,0,0,0,0|2,1,0]=4 2539 B12R1.125 O=C(O)CCc1ccccc1F Amb6336154 [0,1,0,0,0,0|2,1,0]=4 2540 B12R1.125 O=C(O)CCc1ccccc1I Amb10071543 [0,1,0,0,0,0|2,1,0]=4 2541 B12R1.125 O=C(O)CCc1ccccc1O Amb1211927 [0,1,0,0,0,0|3,0,0]=4 2542 B12R1.125 O=C(O)CCc1ccccc1S Amb18648646 [0,1,0,0,0,0|3,0,0]=4 2543 B12R1.125 O=C(O)CCc1cccnc1Br Amb24525068 [0,1,0,0,0,0|3,0,0]=4 2544 B12R1.125 O=C(O)CCc1ccncc1Br Amb33242388 [0,1,0,0,0,0|3,0,0]=4 2545 B12R1.125 O=C(O)CCc1ncccc1Br Amb25898946 [0,1,0,0,0,0|3,0,0]=4 2546 B12R1.125 O=C(O)CNc1ccccc1Br Amb840526 [0,1,0,0,0,0|3,0,0]=4 2547 B12R1.125 O=C(O)COc1ccccc1Br Amb6364728 [0,1,0,0,0,0|3,0,0]=4 2548 B12R1.125 O=C(O)CSc1ccccc1Br Amb1113386 [0,1,0,0,0,0|3,0,0]=4 2549 B12R1.125 O=C([O-])CCc1ccccc1F Amb15692476 [0,1,0,0,0,0|2,1,0]=4 2550 B12R1.125 O=S([O-])CCc1ccccc1Br Amb32755052 [0,1,0,0,0,0|2,0,0]=3 2551 B12R1.125 O=S([O-])CCc1ccccc1Cl Amb32755617 [0,1,0,0,0,0|2,1,0]=4 2552 B12R1.125 O=S([O-])CCc1ccccc1F Amb32755634 [0,1,0,0,0,0|2,1,0]=4 2553 B12R1.125 O=[N+]([O-])CCc1ccccc1Br Amb26372563 [0,1,0,0,0,0|1,0,1]=3 2554 B12R1.125 O=[N+]([O-])CCc1ccccc1Cl Amb17401072 [0,1,0,0,0,0|1,1,1]=4 2555 B12R1.125 O=[N+]([O-])CCc1ccccc1F Amb17400297 [0,1,0,0,0,0|1,1,1]=4 2556 B12R1.125 O=[N+]([O-])CCc1ccccc1O Amb25892692 [0,1,0,0,0,0|2,0,1]=4 2557 B12R1.125 O=[N+]([O-])CCc1cccnc1Br Amb33456713 [0,1,0,0,0,0|2,0,1]=4 2558 B12R1.125 O=[N+]([O-])CCc1ccncc1Br Amb33388611 [0,1,0,0,0,0|2,0,1]=4 2559 B12R1.125 O=[N+]([O-])CCc1ncccc1Br Amb33336104 [0,1,0,0,0,0|2,0,1]=4 2560 B12R1.125 O=[N+]([O-])CSc1ccccc1Br Amb27178655 [0,1,0,0,0,0|2,0,1]=4 2561 B12R1.125 OB(O)CCc1ccccc1Br Amb27986176 [0,1,0,0,0,0|2,0,0]=3 2562 B12R1.125 OB(O)CCc1ccccc1Cl Amb27639202 [0,1,0,0,0,0|2,1,0]=4 2563 B12R1.125 OB(O)CCc1ccccc1F Amb26016822 [0,1,0,0,0,0|2,1,0]=4 2564 B12R1.267 BrCCCCc1ccccc1Br Amb34914026 [0,1,0,0,0,0|1,0,0]=2 2565 B12R1.267 BrCCCOc1ccccc1Br Amb8517103 [0,1,0,0,0,0|2,0,0]=3 2566 B12R1.267 Brc1ccccc1CCCCI Amb34914024 [0,1,0,0,0,0|1,0,0]=2 2567 B12R1.267 C#CCCNc1ccccc1Br Amb28133302 [0,1,0,0,0,0|1,0,1]=3 2568 B12R1.267 C#CCCNc1ccccc1I Amb27401663 [0,1,0,0,0,0|1,1,1]=4 2569 B12R1.267 C#CCCOc1ccccc1C Amb27397416 [0,1,0,0,0,0|2,0,1]=4 2570 B12R1.267 C#CCCOc1ccccc1I Amb27869109 [0,1,0,0,0,0|1,1,1]=4 2571 B12R1.267 C#CCCOc1ccccc1N Amb18290041 [0,1,0,0,0,0|2,0,1]=4 2572 B12R1.267 C#CCCSc1ncccc1Br Amb27214066 [0,1,0,0,0,0|2,0,1]=4 2573 B12R1.267 C#CCNCc1ccccc1C Amb21979502 [0,1,0,0,0,0|2,0,1]=4 2574 B12R1.267 C#CCNCc1ccccc1C Amb6683555 [0,1,0,0,0,0|2,0,1]=4 2575 B12R1.267 C#CCNCc1ccccc1Cl Amb1925447 [0,1,0,0,0,0|1,1,1]=4 2576 B12R1.267 C#CCNCc1ccccc1Cl Amb6868432 [0,1,0,0,0,0|1,1,1]=4 2577 B12R1.267 C#CCNCc1ccccc1F Amb21979501 [0,1,0,0,0,0|1,1,1]=4 2578 B12R1.267 C#CCNCc1ccccc1F Amb6683727 [0,1,0,0,0,0|1,1,1]=4 2579 B12R1.267 C#CCNCc1ccccc1I Amb28317561 [0,1,0,0,0,0|1,1,1]=4 2580 B12R1.267 C#CCNCc1ccccc1O Amb6683601 [0,1,0,0,0,0|2,0,1]=4 2581 B12R1.267 C#CCSCc1ccccc1Cl Amb28422116 [0,1,0,0,0,0|1,1,1]=4 2582 B12R1.267 C=CCCCc1ccccc1Br Amb32654215 [0,1,0,0,0,0|1,0,1]=3 2583 B12R1.267 C=CCCNc1ncccc1Br Amb28046026 [0,1,0,0,0,0|2,0,1]=4 2584 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,1,0,0,0,0|1,0,1]=3 2585 B12R1.267 C=CCCOc1cccnc1Br Amb20241441 [0,1,0,0,0,0|2,0,1]=4 2586 B12R1.267 C=CCNCc1ccccc1Br Amb20673595 [0,1,0,0,0,0|1,0,1]=3 2587 B12R1.267 C=CCNCc1ccccc1Br Amb6683971 [0,1,0,0,0,0|1,0,1]=3 2588 B12R1.267 C=CCNCc1ccccc1C Amb6683786 [0,1,0,0,0,0|2,0,1]=4 2589 B12R1.267 C=CCNCc1ccccc1C Amb6865276 [0,1,0,0,0,0|2,0,1]=4 2590 B12R1.267 C=CCNCc1ccccc1Cl Amb6683768 [0,1,0,0,0,0|1,1,1]=4 2591 B12R1.267 C=CCNCc1ccccc1Cl Amb6865275 [0,1,0,0,0,0|1,1,1]=4 2592 B12R1.267 C=CCNCc1ccccc1F Amb10609764 [0,1,0,0,0,0|1,1,1]=4 2593 B12R1.267 C=CCNCc1ccccc1F Amb2721870 [0,1,0,0,0,0|1,1,1]=4 2594 B12R1.267 C=CCNCc1ccccc1O Amb19890804 [0,1,0,0,0,0|2,0,1]=4 2595 B12R1.267 C=CCNCc1ccccc1O Amb6683831 [0,1,0,0,0,0|2,0,1]=4 2596 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,1,0,0,0,0|1,1,1]=4 2597 B12R1.267 CC#CCCN1C=CC=CC1=O Amb27595839 [0,1,0,0,0,0|3,0,0]=4 2598 B12R1.267 CC#CCCc1cccnc1N Amb27596610 [0,1,0,0,0,0|3,0,0]=4 2599 B12R1.267 CC#CCCc1cnccc1N Amb27975672 [0,1,0,0,0,0|3,0,0]=4 2600 B12R1.267 CC#CCNc1ccccc1Br Amb27948329 [0,1,0,0,0,0|1,0,1]=3 2601 B12R1.267 CC#CCNc1ccccc1C Amb18797550 [0,1,0,0,0,0|2,0,1]=4 2602 B12R1.267 CC#CCNc1ccccc1F Amb18182603 [0,1,0,0,0,0|1,1,1]=4 2603 B12R1.267 CC#CCNc1ccccc1I Amb27453194 [0,1,0,0,0,0|1,1,1]=4 2604 B12R1.267 CC#CCOc1ccccc1Br Amb28366470 [0,1,0,0,0,0|1,0,1]=3 2605 B12R1.267 CC#CCOc1ccccc1Cl Amb27470986 [0,1,0,0,0,0|1,1,1]=4 2606 B12R1.267 CC#CCOc1cccnc1Br Amb27197787 [0,1,0,0,0,0|2,0,1]=4 2607 B12R1.267 CC#CCSc1ccccc1Cl Amb27198267 [0,1,0,0,0,0|1,1,1]=4 2608 B12R1.267 CC#CCSc1ccccc1F Amb27809952 [0,1,0,0,0,0|1,1,1]=4 2609 B12R1.267 CC#CCSc1ccccc1N Amb18988251 [0,1,0,0,0,0|2,0,1]=4 2610 B12R1.267 CCCC#Cc1ccccc1Br Amb25676440 [0,1,0,0,0,0|1,0,1]=3 2611 B12R1.267 CCCC#Cc1ccccc1C Amb27599818 [0,1,0,0,0,0|2,0,1]=4 2612 B12R1.267 CCCC#Cc1ccccc1Cl Amb26347731 [0,1,0,0,0,0|1,1,1]=4 2613 B12R1.267 CCCC#Cc1ccccc1F Amb27952893 [0,1,0,0,0,0|1,1,1]=4 2614 B12R1.267 CCCC#Cc1ccccc1I Amb26861404 [0,1,0,0,0,0|1,1,1]=4 2615 B12R1.267 CCCC#Cc1ccccc1N Amb25238355 [0,1,0,0,0,0|2,0,1]=4 2616 B12R1.267 CCCC#Cc1ccccc1O Amb26883333 [0,1,0,0,0,0|2,0,1]=4 2617 B12R1.267 CCCCCc1ncncc1Br Amb10068165 [0,1,0,0,0,0|3,0,0]=4 2618 B12R1.267 CCCCNc1ccccc1Br Amb6696452 [0,1,0,0,0,0|1,0,0]=2 2619 B12R1.267 CCCCNc1ccccc1C Amb4016420 [0,1,0,0,0,0|2,0,0]=3 2620 B12R1.267 CCCCNc1ccccc1Cl Amb4313689 [0,1,0,0,0,0|1,1,0]=3 2621 B12R1.267 CCCCNc1ccccc1F Amb6697370 [0,1,0,0,0,0|1,1,0]=3 2622 B12R1.267 CCCCNc1ccccc1N Amb7767737 [0,1,0,0,0,0|2,0,0]=3 2623 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,1,0,0,0,0|2,0,0]=3 2624 B12R1.267 CCCCNc1cccnc1C Amb27616824 [0,1,0,0,0,0|3,0,0]=4 2625 B12R1.267 CCCCNc1cccnc1F Amb35725090 [0,1,0,0,0,0|2,1,0]=4 2626 B12R1.267 CCCCNc1ccncc1F Amb28063758 [0,1,0,0,0,0|2,1,0]=4 2627 B12R1.267 CCCCNc1ccncc1N Amb7767727 [0,1,0,0,0,0|3,0,0]=4 2628 B12R1.267 CCCCNc1ccncc1O Amb28240840 [0,1,0,0,0,0|3,0,0]=4 2629 B12R1.267 CCCCNc1ncccc1F Amb18314049 [0,1,0,0,0,0|2,1,0]=4 2630 B12R1.267 CCCCNc1ncccc1N Amb7767733 [0,1,0,0,0,0|3,0,0]=4 2631 B12R1.267 CCCCOC1=CC=CNC1=O Amb18034630 [0,1,0,0,0,0|3,0,0]=4 2632 B12R1.267 CCCCOc1ccccc1Br Amb6272446 [0,1,0,0,0,0|1,0,0]=2 2633 B12R1.267 CCCCOc1ccccc1N Amb1033054 [0,1,0,0,0,0|2,0,0]=3 2634 B12R1.267 CCCCOc1ccccc1O Amb8837327 [0,1,0,0,0,0|2,0,0]=3 2635 B12R1.267 CCCCOc1cccnc1Cl Amb20242808 [0,1,0,0,0,0|2,1,0]=4 2636 B12R1.267 CCCCOc1cccnc1N Amb9208363 [0,1,0,0,0,0|3,0,0]=4 2637 B12R1.267 CCCCOc1ccncc1N Amb8895012 [0,1,0,0,0,0|3,0,0]=4 2638 B12R1.267 CCCCOc1cnccc1N Amb33035436 [0,1,0,0,0,0|3,0,0]=4 2639 B12R1.267 CCCCOc1ncccc1Cl Amb24308905 [0,1,0,0,0,0|2,1,0]=4 2640 B12R1.267 CCCCOc1ncccc1N Amb8895018 [0,1,0,0,0,0|3,0,0]=4 2641 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,1,0,0,0,0|1,0,0]=2 2642 B12R1.267 CCCNCc1ccccc1Br Amb6272793 [0,1,0,0,0,0|1,0,0]=2 2643 B12R1.267 CCCNCc1ccccc1C Amb6276128 [0,1,0,0,0,0|2,0,0]=3 2644 B12R1.267 CCCNCc1ccccc1C Amb6865254 [0,1,0,0,0,0|2,0,0]=3 2645 B12R1.267 CCCNCc1ccccc1Cl Amb6271434 [0,1,0,0,0,0|1,1,0]=3 2646 B12R1.267 CCCNCc1ccccc1Cl Amb6542582 [0,1,0,0,0,0|1,1,0]=3 2647 B12R1.267 CCCNCc1ccccc1F Amb6258177 [0,1,0,0,0,0|1,1,0]=3 2648 B12R1.267 CCCNCc1ccccc1F Amb6865253 [0,1,0,0,0,0|1,1,0]=3 2649 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,1,0,0,0,0|2,0,0]=3 2650 B12R1.267 CCCNCc1ccccc1O Amb6281040 [0,1,0,0,0,0|2,0,0]=3 2651 B12R1.267 CCCSCc1ccccc1Br Amb22228182 [0,1,0,0,0,0|1,0,0]=2 2652 B12R1.267 CCC\N=C\c1ccccc1O Amb24408352 [0,1,0,0,0,0|2,0,1]=4 2653 B12R1.267 CCNCCc1ccccc1C Amb8841498 [0,1,0,0,0,0|1,0,0]=2 2654 B12R1.267 CCNCCc1ccccc1Cl Amb8853702 [0,1,0,0,0,0|0,1,0]=2 2655 B12R1.267 CCNCCc1ccccc1F Amb6693099 [0,1,0,0,0,0|0,1,0]=2 2656 B12R1.267 CCN\C=N\c1ccccc1C Amb28187103 [0,1,0,0,0,0|2,0,1]=4 2657 B12R1.267 CCOCOc1ccccc1Br Amb32729439 [0,1,0,0,0,0|2,0,0]=3 2658 B12R1.267 CNCC#Cc1ccncc1C Amb27416309 [0,1,0,0,0,0|2,0,1]=4 2659 B12R1.267 CNCCCc1ccccc1Br Amb17605546 [0,1,0,0,0,0|0,0,0]=1 2660 B12R1.267 CNCCCc1ccccc1C Amb17104499 [0,1,0,0,0,0|1,0,0]=2 2661 B12R1.267 CNCCCc1ccccc1Cl Amb17104507 [0,1,0,0,0,0|0,1,0]=2 2662 B12R1.267 CNCCCc1ccccc1F Amb17104502 [0,1,0,0,0,0|0,1,0]=2 2663 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,1,0,0,0,0|1,0,0]=2 2664 B12R1.267 CNCCNc1ccncc1C Amb27476648 [0,1,0,0,0,0|2,0,0]=3 2665 B12R1.267 CNCCNc1ccncc1F Amb30036674 [0,1,0,0,0,0|1,1,0]=3 2666 B12R1.267 CNCCNc1ncccc1F Amb18314045 [0,1,0,0,0,0|1,1,0]=3 2667 B12R1.267 CNCCOc1ccccc1Br Amb7798227 [0,1,0,0,0,0|0,0,0]=1 2668 B12R1.267 CNCCOc1ccccc1Br Amb8597811 [0,1,0,0,0,0|0,0,0]=1 2669 B12R1.267 CNCCOc1ccccc1C Amb1222745 [0,1,0,0,0,0|1,0,0]=2 2670 B12R1.267 CNCCOc1ccccc1C Amb2140560 [0,1,0,0,0,0|1,0,0]=2 2671 B12R1.267 CNCCOc1ccccc1Cl Amb1669286 [0,1,0,0,0,0|0,1,0]=2 2672 B12R1.267 CNCCOc1ccccc1Cl Amb34914122 [0,1,0,0,0,0|0,1,0]=2 2673 B12R1.267 CNCCOc1ccccc1F Amb1669285 [0,1,0,0,0,0|0,1,0]=2 2674 B12R1.267 CNCCOc1ccccc1N Amb17232613 [0,1,0,0,0,0|1,0,0]=2 2675 B12R1.267 CNC\C=C\c1ccccc1C Amb23442941 [0,1,0,0,0,0|1,0,1]=3 2676 B12R1.267 CNC\C=C\c1ccccc1F Amb23442841 [0,1,0,0,0,0|0,1,1]=3 2677 B12R1.267 COCC#Cc1ccccc1Br Amb28041413 [0,1,0,0,0,0|1,0,1]=3 2678 B12R1.267 COCC#Cc1ccccc1C Amb27617757 [0,1,0,0,0,0|2,0,1]=4 2679 B12R1.267 COCC#Cc1ccccc1Cl Amb25693189 [0,1,0,0,0,0|1,1,1]=4 2680 B12R1.267 COCC#Cc1ccccc1F Amb26597466 [0,1,0,0,0,0|1,1,1]=4 2681 B12R1.267 COCC#Cc1ccccc1I Amb26047613 [0,1,0,0,0,0|1,1,1]=4 2682 B12R1.267 COCC#Cc1ccccc1N Amb28121010 [0,1,0,0,0,0|2,0,1]=4 2683 B12R1.267 COCC#Cc1ccccc1O Amb27861309 [0,1,0,0,0,0|2,0,1]=4 2684 B12R1.267 COCCNc1ccccc1Br Amb6712141 [0,1,0,0,0,0|1,0,0]=2 2685 B12R1.267 COCCNc1ccccc1C Amb595420 [0,1,0,0,0,0|2,0,0]=3 2686 B12R1.267 COCCNc1ccccc1Cl Amb6712363 [0,1,0,0,0,0|1,1,0]=3 2687 B12R1.267 COCCNc1ccccc1F Amb6712555 [0,1,0,0,0,0|1,1,0]=3 2688 B12R1.267 COCCNc1ccccc1I Amb7785821 [0,1,0,0,0,0|1,1,0]=3 2689 B12R1.267 COCCNc1ccccc1N Amb7767474 [0,1,0,0,0,0|2,0,0]=3 2690 B12R1.267 COCCNc1cccnc1C Amb28043479 [0,1,0,0,0,0|3,0,0]=4 2691 B12R1.267 COCCNc1cccnc1Cl Amb27257672 [0,1,0,0,0,0|2,1,0]=4 2692 B12R1.267 COCCNc1cccnc1F Amb35725094 [0,1,0,0,0,0|2,1,0]=4 2693 B12R1.267 COCCNc1ccncc1Br Amb28120814 [0,1,0,0,0,0|2,0,0]=3 2694 B12R1.267 COCCNc1ccncc1F Amb30036543 [0,1,0,0,0,0|2,1,0]=4 2695 B12R1.267 COCCNc1ccncc1N Amb33529101 [0,1,0,0,0,0|3,0,0]=4 2696 B12R1.267 COCCNc1ncccc1Br Amb27837386 [0,1,0,0,0,0|2,0,0]=3 2697 B12R1.267 COCCNc1ncccc1F Amb18314046 [0,1,0,0,0,0|2,1,0]=4 2698 B12R1.267 COCCNc1ncccc1I Amb27805975 [0,1,0,0,0,0|2,1,0]=4 2699 B12R1.267 COCCNc1ncccc1N Amb9205201 [0,1,0,0,0,0|3,0,0]=4 2700 B12R1.267 COCCOc1ccccc1Br Amb6263904 [0,1,0,0,0,0|1,0,0]=2 2701 B12R1.267 COCCOc1ccccc1I Amb32413960 [0,1,0,0,0,0|1,1,0]=3 2702 B12R1.267 COCCOc1ccccc1N Amb22492333 [0,1,0,0,0,0|2,0,0]=3 2703 B12R1.267 COCCOc1ccccc1N Amb840085 [0,1,0,0,0,0|2,0,0]=3 2704 B12R1.267 COCCOc1ccccc1O Amb8837338 [0,1,0,0,0,0|2,0,0]=3 2705 B12R1.267 COCCOc1cccnc1Cl Amb22642366 [0,1,0,0,0,0|2,1,0]=4 2706 B12R1.267 COCCOc1ccncc1N Amb7765148 [0,1,0,0,0,0|3,0,0]=4 2707 B12R1.267 COCCOc1cnccc1N Amb33035236 [0,1,0,0,0,0|3,0,0]=4 2708 B12R1.267 COCCOc1ncccc1Br Amb19448504 [0,1,0,0,0,0|2,0,0]=3 2709 B12R1.267 COCCOc1ncccc1N Amb6251609 [0,1,0,0,0,0|3,0,0]=4 2710 B12R1.267 COCOCc1ccccc1Br Amb21964629 [0,1,0,0,0,0|1,0,0]=2 2711 B12R1.267 COCOCc1ccccc1F Amb28464076 [0,1,0,0,0,0|1,1,0]=3 2712 B12R1.267 CO\N=C\Cc1ccccc1F Amb28138336 [0,1,0,0,0,0|0,1,2]=4 2713 B12R1.267 CSCCNc1ccccc1Br Amb27875069 [0,1,0,0,0,0|1,0,0]=2 2714 B12R1.267 CSCCNc1ccccc1I Amb28044651 [0,1,0,0,0,0|1,1,0]=3 2715 B12R1.267 CSCCNc1ccccc1N Amb27863236 [0,1,0,0,0,0|2,0,0]=3 2716 B12R1.267 CSCCNc1ccncc1C Amb28188686 [0,1,0,0,0,0|3,0,0]=4 2717 B12R1.267 CSCCNc1ccncc1F Amb30036546 [0,1,0,0,0,0|2,1,0]=4 2718 B12R1.267 CSCCNc1ncccc1Br Amb27465992 [0,1,0,0,0,0|2,0,0]=3 2719 B12R1.267 CSCCNc1ncccc1I Amb27261082 [0,1,0,0,0,0|2,1,0]=4 2720 B12R1.267 C\C=C\CCc1ccccc1C Amb27267945 [0,1,0,0,0,0|2,0,0]=3 2721 B12R1.267 C\C=C\CNc1ccccc1C Amb27606301 [0,1,0,0,0,0|2,0,1]=4 2722 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,1,0,0,0,0|2,0,1]=4 2723 B12R1.267 C\C=C\CSc1ccccc1Br Amb28398756 [0,1,0,0,0,0|1,0,1]=3 2724 B12R1.267 C\C=C\CSc1ccccc1C Amb4020367 [0,1,0,0,0,0|2,0,1]=4 2725 B12R1.267 C\C=C\CSc1ncccc1Br Amb27187835 [0,1,0,0,0,0|2,0,1]=4 2726 B12R1.267 Cc1ccccc1CCCC#N Amb24502058 [0,1,0,0,0,0|2,0,1]=4 2727 B12R1.267 Cc1ccccc1CCCC=O Amb18645710 [0,1,0,0,0,0|2,0,1]=4 2728 B12R1.267 Cc1ccccc1CCCCBr Amb34914032 [0,1,0,0,0,0|2,0,0]=3 2729 B12R1.267 Cc1ccccc1CCCCN Amb17991254 [0,1,0,0,0,0|2,0,0]=3 2730 B12R1.267 Cc1ccccc1CCCCN Amb5735492 [0,1,0,0,0,0|2,0,0]=3 2731 B12R1.267 Cc1ccccc1CCCCO Amb34913207 [0,1,0,0,0,0|2,0,0]=3 2732 B12R1.267 Cc1ccccc1CCCCS Amb18564154 [0,1,0,0,0,0|2,0,0]=3 2733 B12R1.267 Cc1ccccc1CCCON Amb17089549 [0,1,0,0,0,0|3,0,0]=4 2734 B12R1.267 Cc1ccccc1CCN=C=O Amb17232365 [0,1,0,0,0,0|1,0,2]=4 2735 B12R1.267 Cc1ccccc1CCN=C=S Amb17233308 [0,1,0,0,0,0|1,0,2]=4 2736 B12R1.267 Cc1ccccc1CCN=[N+]=[N-] Amb26334709 [0,1,0,0,0,0|2,0,1]=4 2737 B12R1.267 Cc1ccccc1CNCC#N Amb17400074 [0,1,0,0,0,0|3,0,0]=4 2738 B12R1.267 Cc1ccccc1CNCCN Amb9174055 [0,1,0,0,0,0|3,0,0]=4 2739 B12R1.267 Cc1ccccc1CNCCO Amb6865192 [0,1,0,0,0,0|3,0,0]=4 2740 B12R1.267 Cc1ccccc1CNCCO Amb7757032 [0,1,0,0,0,0|3,0,0]=4 2741 B12R1.267 Cc1ccccc1COCCN Amb17061814 [0,1,0,0,0,0|3,0,0]=4 2742 B12R1.267 Cc1ccccc1CSCC#N Amb17501732 [0,1,0,0,0,0|3,0,0]=4 2743 B12R1.267 Cc1ccccc1CSCC=O Amb18184909 [0,1,0,0,0,0|3,0,0]=4 2744 B12R1.267 Cc1ccccc1CSCCN Amb844773 [0,1,0,0,0,0|3,0,0]=4 2745 B12R1.267 Cc1ccccc1NCCC#N Amb2794093 [0,1,0,0,0,0|3,0,0]=4 2746 B12R1.267 Cc1ccccc1NCCCF Amb27757671 [0,1,0,0,0,0|3,0,0]=4 2747 B12R1.267 Cc1ccccc1NCCCN Amb17057721 [0,1,0,0,0,0|3,0,0]=4 2748 B12R1.267 Cc1ccccc1NCCCO Amb17306598 [0,1,0,0,0,0|3,0,0]=4 2749 B12R1.267 Cc1ccccc1OCCC#N Amb1635755 [0,1,0,0,0,0|3,0,0]=4 2750 B12R1.267 Cc1ccccc1OCCC=O Amb5731759 [0,1,0,0,0,0|3,0,0]=4 2751 B12R1.267 Cc1ccccc1OCCCBr Amb2795769 [0,1,0,0,0,0|3,0,0]=4 2752 B12R1.267 Cc1ccccc1OCCCCl Amb1141955 [0,1,0,0,0,0|3,0,0]=4 2753 B12R1.267 Cc1ccccc1OCCCN Amb1136099 [0,1,0,0,0,0|3,0,0]=4 2754 B12R1.267 Cc1ccccc1OCCCO Amb9370674 [0,1,0,0,0,0|3,0,0]=4 2755 B12R1.267 Cc1ccccc1OCCCS Amb17233940 [0,1,0,0,0,0|3,0,0]=4 2756 B12R1.267 Cc1ccccc1OCCNN Amb2282444 [0,1,0,0,0,0|2,0,0]=3 2757 B12R1.267 Cc1ccccc1OCCNN Amb2370790 [0,1,0,0,0,0|2,0,0]=3 2758 B12R1.267 Cc1ccccc1OCCNO Amb17088414 [0,1,0,0,0,0|2,0,0]=3 2759 B12R1.267 Cc1ccccc1OCCON Amb17088288 [0,1,0,0,0,0|3,0,0]=4 2760 B12R1.267 Cc1ccccc1SCCC=O Amb18178931 [0,1,0,0,0,0|3,0,0]=4 2761 B12R1.267 Cc1cccnc1CCCCN Amb32953263 [0,1,0,0,0,0|3,0,0]=4 2762 B12R1.267 Cc1cccnc1CCNC#N Amb35580467 [0,1,0,0,0,0|2,0,1]=4 2763 B12R1.267 Cc1cccnc1CCNC=O Amb35720303 [0,1,0,0,0,0|2,0,1]=4 2764 B12R1.267 Cc1ccncc1CCCCN Amb18828701 [0,1,0,0,0,0|3,0,0]=4 2765 B12R1.267 Cc1cnccc1CCCCN Amb33426428 [0,1,0,0,0,0|3,0,0]=4 2766 B12R1.267 Cc1ncccc1CCCCN Amb32881346 [0,1,0,0,0,0|3,0,0]=4 2767 B12R1.267 ClCCCOc1ccccc1Br Amb6260781 [0,1,0,0,0,0|2,0,0]=3 2768 B12R1.267 ClCCCOc1ccccc1Cl Amb1135755 [0,1,0,0,0,0|2,1,0]=4 2769 B12R1.267 ClCCCSc1ccccc1Cl Amb6662701 [0,1,0,0,0,0|2,1,0]=4 2770 B12R1.267 Clc1ccccc1CCCCBr Amb34914033 [0,1,0,0,0,0|1,1,0]=3 2771 B12R1.267 Clc1ccccc1OCCCBr Amb8517138 [0,1,0,0,0,0|2,1,0]=4 2772 B12R1.267 FCCCNc1ccncc1Br Amb28127377 [0,1,0,0,0,0|3,0,0]=4 2773 B12R1.267 Fc1ccccc1CCCCBr Amb34914037 [0,1,0,0,0,0|1,1,0]=3 2774 B12R1.267 Fc1ccccc1CCCCI Amb34914090 [0,1,0,0,0,0|1,1,0]=3 2775 B12R1.267 Fc1ccccc1CCCCS Amb18066143 [0,1,0,0,0,0|1,1,0]=3 2776 B12R1.267 Fc1ccccc1CCN=C=S Amb5750750 [0,1,0,0,0,0|0,1,2]=4 2777 B12R1.267 Fc1ccccc1OCCCBr Amb7089048 [0,1,0,0,0,0|2,1,0]=4 2778 B12R1.267 Fc1ccccc1OCCCCl Amb1131839 [0,1,0,0,0,0|2,1,0]=4 2779 B12R1.267 Fc1ccccc1OCCCS Amb17234296 [0,1,0,0,0,0|2,1,0]=4 2780 B12R1.267 N#CCC#Cc1ccccc1Br Amb24702504 [0,1,0,0,0,0|2,0,1]=4 2781 B12R1.267 N#CCCCc1ccccc1Br Amb25732390 [0,1,0,0,0,0|1,0,1]=3 2782 B12R1.267 N#CCCCc1ccccc1Cl Amb28057145 [0,1,0,0,0,0|1,1,1]=4 2783 B12R1.267 N#CCCCc1ccccc1F Amb27394350 [0,1,0,0,0,0|1,1,1]=4 2784 B12R1.267 N#CCCNc1ccccc1Br Amb7094593 [0,1,0,0,0,0|2,0,0]=3 2785 B12R1.267 N#CCCNc1ccccc1Cl Amb2794094 [0,1,0,0,0,0|2,1,0]=4 2786 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,1,0,0,0,0|2,1,0]=4 2787 B12R1.267 N#CCCNc1ccccc1I Amb9202488 [0,1,0,0,0,0|2,1,0]=4 2788 B12R1.267 N#CCCNc1ccccc1O Amb4401572 [0,1,0,0,0,0|3,0,0]=4 2789 B12R1.267 N#CCCNc1ccncc1Br Amb27595419 [0,1,0,0,0,0|3,0,0]=4 2790 B12R1.267 N#CCCNc1ncccc1Br Amb28435643 [0,1,0,0,0,0|3,0,0]=4 2791 B12R1.267 N#CCCOc1ccccc1Br Amb6263050 [0,1,0,0,0,0|2,0,0]=3 2792 B12R1.267 N#CCCOc1ccccc1Cl Amb356216 [0,1,0,0,0,0|2,1,0]=4 2793 B12R1.267 N#CCCOc1ccccc1F Amb1148995 [0,1,0,0,0,0|2,1,0]=4 2794 B12R1.267 N#CCCOc1ccccc1N Amb18971549 [0,1,0,0,0,0|3,0,0]=4 2795 B12R1.267 N#CCCSc1ccccc1F Amb2779413 [0,1,0,0,0,0|2,1,0]=4 2796 B12R1.267 N#CCCSc1ccccc1N Amb4477155 [0,1,0,0,0,0|3,0,0]=4 2797 B12R1.267 N#CCNCc1ccccc1Cl Amb6709999 [0,1,0,0,0,0|2,1,0]=4 2798 B12R1.267 N#CCNCc1ccccc1F Amb6712731 [0,1,0,0,0,0|2,1,0]=4 2799 B12R1.267 N#CCOCc1ccccc1F Amb27165383 [0,1,0,0,0,0|2,1,0]=4 2800 B12R1.267 N#CC\C=C\c1ccccc1Br Amb26607196 [0,1,0,0,0,0|2,0,1]=4 2801 B12R1.267 NCCCCN1C=CC=CC1=O Amb18535494 [0,1,0,0,0,0|3,0,0]=4 2802 B12R1.267 NCCCCc1ccccc1Br Amb18069064 [0,1,0,0,0,0|1,0,0]=2 2803 B12R1.267 NCCCCc1ccccc1Cl Amb22904185 [0,1,0,0,0,0|1,1,0]=3 2804 B12R1.267 NCCCCc1ccccc1Cl Amb5735501 [0,1,0,0,0,0|1,1,0]=3 2805 B12R1.267 NCCCCc1ccccc1F Amb18524598 [0,1,0,0,0,0|1,1,0]=3 2806 B12R1.267 NCCCCc1ccccc1F Amb5735495 [0,1,0,0,0,0|1,1,0]=3 2807 B12R1.267 NCCCCc1ccccc1O Amb18828230 [0,1,0,0,0,0|2,0,0]=3 2808 B12R1.267 NCCCCc1cccnc1Br Amb33388117 [0,1,0,0,0,0|2,0,0]=3 2809 B12R1.267 NCCCCc1cccnc1Cl Amb33257389 [0,1,0,0,0,0|2,1,0]=4 2810 B12R1.267 NCCCCc1cccnc1F Amb33377145 [0,1,0,0,0,0|2,1,0]=4 2811 B12R1.267 NCCCCc1ccncc1Br Amb33478368 [0,1,0,0,0,0|2,0,0]=3 2812 B12R1.267 NCCCCc1ccncc1Cl Amb33220578 [0,1,0,0,0,0|2,1,0]=4 2813 B12R1.267 NCCCCc1ccncc1F Amb33316819 [0,1,0,0,0,0|2,1,0]=4 2814 B12R1.267 NCCCCc1ncccc1Br Amb33451068 [0,1,0,0,0,0|2,0,0]=3 2815 B12R1.267 NCCCCc1ncccc1F Amb33418424 [0,1,0,0,0,0|2,1,0]=4 2816 B12R1.267 NCCCNc1ccccc1Br Amb27226464 [0,1,0,0,0,0|2,0,0]=3 2817 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,1,0,0,0,0|2,1,0]=4 2818 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,1,0,0,0,0|2,1,0]=4 2819 B12R1.267 NCCCNc1ccccc1F Amb32718812 [0,1,0,0,0,0|2,1,0]=4 2820 B12R1.267 NCCCNc1ccncc1Br Amb27460980 [0,1,0,0,0,0|3,0,0]=4 2821 B12R1.267 NCCCOc1ccccc1Br Amb6267751 [0,1,0,0,0,0|2,0,0]=3 2822 B12R1.267 NCCCOc1ccccc1Cl Amb5731731 [0,1,0,0,0,0|2,1,0]=4 2823 B12R1.267 NCCCOc1ccccc1F Amb1107911 [0,1,0,0,0,0|2,1,0]=4 2824 B12R1.267 NCCCOc1ccccc1F Amb1221365 [0,1,0,0,0,0|2,1,0]=4 2825 B12R1.267 NCCCOc1ccccc1O Amb33226613 [0,1,0,0,0,0|3,0,0]=4 2826 B12R1.267 NCCCOc1cccnc1Br Amb33451406 [0,1,0,0,0,0|3,0,0]=4 2827 B12R1.267 NCCCOc1ccncc1Br Amb33452049 [0,1,0,0,0,0|3,0,0]=4 2828 B12R1.267 NCCCOc1ncccc1Br Amb18308525 [0,1,0,0,0,0|3,0,0]=4 2829 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,1,0,0,0,0|2,0,0]=3 2830 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,1,0,0,0,0|2,1,0]=4 2831 B12R1.267 NCCNCc1ccccc1Cl Amb29844472 [0,1,0,0,0,0|2,1,0]=4 2832 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,1,0,0,0,0|2,1,0]=4 2833 B12R1.267 NCCNCc1ccccc1F Amb29844475 [0,1,0,0,0,0|2,1,0]=4 2834 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,1,0,0,0,0|3,0,0]=4 2835 B12R1.267 NCCOCc1ccccc1Cl Amb6335301 [0,1,0,0,0,0|2,1,0]=4 2836 B12R1.267 NCCOCc1ccccc1Cl Amb6880857 [0,1,0,0,0,0|2,1,0]=4 2837 B12R1.267 NCCOCc1ccccc1F Amb17061817 [0,1,0,0,0,0|2,1,0]=4 2838 B12R1.267 NCCSCc1ccccc1Cl Amb844775 [0,1,0,0,0,0|2,1,0]=4 2839 B12R1.267 NCCSCc1ccccc1F Amb431326 [0,1,0,0,0,0|2,1,0]=4 2840 B12R1.267 NCCSCc1ccccc1F Amb9677309 [0,1,0,0,0,0|2,1,0]=4 2841 B12R1.267 NNCCOc1ccccc1Br Amb17407554 [0,1,0,0,0,0|1,0,0]=2 2842 B12R1.267 NNCCOc1ccccc1Cl Amb1114795 [0,1,0,0,0,0|1,1,0]=3 2843 B12R1.267 NNCCOc1ccccc1F Amb17400321 [0,1,0,0,0,0|1,1,0]=3 2844 B12R1.267 NNC\C=C\c1ccccc1Cl Amb18648720 [0,1,0,0,0,0|1,1,1]=4 2845 B12R1.267 NOCCCc1ccccc1Cl Amb17089558 [0,1,0,0,0,0|2,1,0]=4 2846 B12R1.267 NOCCCc1ccccc1F Amb17089552 [0,1,0,0,0,0|2,1,0]=4 2847 B12R1.267 NOCCOc1ccccc1Br Amb17088297 [0,1,0,0,0,0|2,0,0]=3 2848 B12R1.267 NOCCOc1ccccc1Cl Amb17088294 [0,1,0,0,0,0|2,1,0]=4 2849 B12R1.267 NOCCOc1ccccc1F Amb17088291 [0,1,0,0,0,0|2,1,0]=4 2850 B12R1.267 Nc1ccccc1C\C=C\CO Amb28290910 [0,1,0,0,0,0|2,0,1]=4 2851 B12R1.267 Nc1ccccc1NCCCF Amb27656342 [0,1,0,0,0,0|3,0,0]=4 2852 B12R1.267 Nc1ccccc1NCCCO Amb8997320 [0,1,0,0,0,0|3,0,0]=4 2853 B12R1.267 Nc1ccccc1OCCCF Amb23539407 [0,1,0,0,0,0|3,0,0]=4 2854 B12R1.267 Nc1ccccc1OCCCO Amb8842578 [0,1,0,0,0,0|3,0,0]=4 2855 B12R1.267 O=C=NCCc1ccccc1Br Amb26038761 [0,1,0,0,0,0|0,0,2]=3 2856 B12R1.267 O=C=NCCc1ccccc1Cl Amb17233866 [0,1,0,0,0,0|0,1,2]=4 2857 B12R1.267 O=C=NCCc1ccccc1F Amb5750720 [0,1,0,0,0,0|0,1,2]=4 2858 B12R1.267 O=C=NCCc1cccnc1Br Amb33387448 [0,1,0,0,0,0|1,0,2]=4 2859 B12R1.267 O=C=NCCc1ccncc1Br Amb33388238 [0,1,0,0,0,0|1,0,2]=4 2860 B12R1.267 O=C=NCCc1ncccc1Br Amb33336042 [0,1,0,0,0,0|1,0,2]=4 2861 B12R1.267 O=CCCCc1ccccc1Br Amb33451106 [0,1,0,0,0,0|1,0,1]=3 2862 B12R1.267 O=CCCCc1ccccc1Cl Amb32750392 [0,1,0,0,0,0|1,1,1]=4 2863 B12R1.267 O=CCCCc1ccccc1F Amb33474216 [0,1,0,0,0,0|1,1,1]=4 2864 B12R1.267 O=CCCCc1ccccc1O Amb18646065 [0,1,0,0,0,0|2,0,1]=4 2865 B12R1.267 O=CCCCc1cccnc1Br Amb33388136 [0,1,0,0,0,0|2,0,1]=4 2866 B12R1.267 O=CCCCc1ccncc1Br Amb33388993 [0,1,0,0,0,0|2,0,1]=4 2867 B12R1.267 O=CCCCc1ncccc1Br Amb33450764 [0,1,0,0,0,0|2,0,1]=4 2868 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,1,0,0,0,0|2,0,0]=3 2869 B12R1.267 O=CCCOc1ccccc1Cl Amb5731775 [0,1,0,0,0,0|2,1,0]=4 2870 B12R1.267 O=CCCSc1ccccc1Br Amb32682705 [0,1,0,0,0,0|2,0,0]=3 2871 B12R1.267 O=CCCSc1ccccc1Cl Amb18317016 [0,1,0,0,0,0|2,1,0]=4 2872 B12R1.267 O=CCCSc1ccccc1F Amb19045412 [0,1,0,0,0,0|2,1,0]=4 2873 B12R1.267 O=CCSCc1ccccc1Cl Amb32683106 [0,1,0,0,0,0|2,1,0]=4 2874 B12R1.267 O=CNCCc1ccccc1Br Amb28410820 [0,1,0,0,0,0|0,0,1]=2 2875 B12R1.267 OCCCCc1ccccc1Br Amb34003425 [0,1,0,0,0,0|1,0,0]=2 2876 B12R1.267 OCCCCc1ccccc1Cl Amb4037443 [0,1,0,0,0,0|1,1,0]=3 2877 B12R1.267 OCCCCc1ccccc1F Amb34913201 [0,1,0,0,0,0|1,1,0]=3 2878 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,1,0,0,0,0|2,0,0]=3 2879 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,1,0,0,0,0|2,1,0]=4 2880 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,1,0,0,0,0|2,1,0]=4 2881 B12R1.267 OCCCNc1ccccc1I Amb27395286 [0,1,0,0,0,0|2,1,0]=4 2882 B12R1.267 OCCCNc1ncccc1Br Amb19015766 [0,1,0,0,0,0|3,0,0]=4 2883 B12R1.267 OCCCOc1ccccc1Br Amb9247656 [0,1,0,0,0,0|2,0,0]=3 2884 B12R1.267 OCCCOc1ccccc1Cl Amb9247633 [0,1,0,0,0,0|2,1,0]=4 2885 B12R1.267 OCCCOc1ccccc1F Amb9370652 [0,1,0,0,0,0|2,1,0]=4 2886 B12R1.267 OCCNCc1ccccc1Br Amb9203175 [0,1,0,0,0,0|2,0,0]=3 2887 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,1,0,0,0,0|2,1,0]=4 2888 B12R1.267 OCCNCc1ccccc1Cl Amb2721952 [0,1,0,0,0,0|2,1,0]=4 2889 B12R1.267 OCCNCc1ccccc1F Amb2592100 [0,1,0,0,0,0|2,1,0]=4 2890 B12R1.267 OCCNCc1ccccc1F Amb6865191 [0,1,0,0,0,0|2,1,0]=4 2891 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,1,0,0,0,0|2,1,0]=4 2892 B12R1.267 OCCSCc1ccccc1F Amb3568982 [0,1,0,0,0,0|2,1,0]=4 2893 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [0,1,0,0,0,0|1,0,0]=2 2894 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [0,1,0,0,0,0|1,1,0]=3 2895 B12R1.267 ONCCOc1ccccc1F Amb17088417 [0,1,0,0,0,0|1,1,0]=3 2896 B12R1.267 S=C=NCCc1ccccc1Cl Amb17236675 [0,1,0,0,0,0|0,1,2]=4 2897 B12R1.267 SCCCCc1ccccc1Br Amb18576923 [0,1,0,0,0,0|1,0,0]=2 2898 B12R1.267 SCCCCc1ccccc1Cl Amb18066299 [0,1,0,0,0,0|1,1,0]=3 2899 B12R1.267 SCCCNc1ccccc1S Amb27667794 [0,1,0,0,0,0|3,0,0]=4 2900 B12R1.267 SCCCOc1ccccc1Br Amb17258957 [0,1,0,0,0,0|2,0,0]=3 2901 B12R1.267 SCCCOc1ccccc1Cl Amb17237588 [0,1,0,0,0,0|2,1,0]=4 2902 B12R1.267 [C-]#[N+]CCOc1ccccc1C Amb28435228 [0,1,0,0,0,0|1,0,2]=4 2903 B12R1.267 [C-]#[N+]CCOc1ccccc1Cl Amb27958954 [0,1,0,0,0,0|0,1,2]=4 2904 B12R1.267 [C-]#[N+]CCOc1ccccc1O Amb27429201 [0,1,0,0,0,0|1,0,2]=4 2905 B12R1.267 [C-]#[N+]CCSc1ccccc1F Amb27660770 [0,1,0,0,0,0|0,1,2]=4 2906 B12R1.267 [N-]=[N+]=NCCc1ccccc1Br Amb33387997 [0,1,0,0,0,0|1,0,1]=3 2907 B12R1.267 [N-]=[N+]=NCCc1ccccc1Cl Amb26421356 [0,1,0,0,0,0|1,1,1]=4 2908 B12R1.267 [N-]=[N+]=NCCc1ccccc1F Amb33360865 [0,1,0,0,0,0|1,1,1]=4 2909 B12R1.267 [N-]=[N+]=NCCc1ccccc1O Amb33195772 [0,1,0,0,0,0|2,0,1]=4 2910 B12R1.267 [N-]=[N+]=NCCc1cccnc1Br Amb33388118 [0,1,0,0,0,0|2,0,1]=4 2911 B12R1.267 [N-]=[N+]=NCCc1ccncc1Br Amb33388699 [0,1,0,0,0,0|2,0,1]=4 2912 B12R1.267 [N-]=[N+]=NCCc1ncccc1Br Amb33336416 [0,1,0,0,0,0|2,0,1]=4 2913 B12R1.308 C#CCC(N)c1ccccc1I Amb28044520 [0,1,0,0,0,0|1,1,1]=4 2914 B12R1.308 C#CCC(N)c1ccncc1Br Amb28434381 [0,1,0,0,0,0|2,0,1]=4 2915 B12R1.308 C#CCC(N)c1ncccc1Br Amb27411217 [0,1,0,0,0,0|2,0,1]=4 2916 B12R1.308 C#CCC(O)c1ccccc1O Amb28321844 [0,1,0,0,0,0|2,0,1]=4 2917 B12R1.308 C#CC[C@@H](O)c1ccccc1C Amb28400792 [0,1,0,0,0,0|2,0,1]=4 2918 B12R1.308 C#CC[C@H](O)c1ccccc1F Amb28065958 [0,1,0,0,0,0|1,1,1]=4 2919 B12R1.308 C=C(CCN)c1ccccc1Br Amb33388000 [0,1,0,0,0,0|2,0,1]=4 2920 B12R1.308 C=CCC(C)c1ccccc1O Amb27256380 [0,1,0,0,0,0|2,0,1]=4 2921 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,1,0,0,0,0|1,1,1]=4 2922 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,1,0,0,0,0|1,1,1]=4 2923 B12R1.308 C=CCC(N)c1cccnc1Br Amb27239831 [0,1,0,0,0,0|2,0,1]=4 2924 B12R1.308 C=CCC(N)c1ccncc1Br Amb27621578 [0,1,0,0,0,0|2,0,1]=4 2925 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,1,0,0,0,0|1,0,1]=3 2926 B12R1.308 C=CCC(O)c1ccccc1C Amb18177787 [0,1,0,0,0,0|2,0,1]=4 2927 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,1,0,0,0,0|1,1,1]=4 2928 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,1,0,0,0,0|1,1,1]=4 2929 B12R1.308 C=CC[C@@H](N)c1ccccc1O Amb27947600 [0,1,0,0,0,0|2,0,1]=4 2930 B12R1.308 C=CC[C@@H](O)c1ccccc1Br Amb28129784 [0,1,0,0,0,0|1,0,1]=3 2931 B12R1.308 C=CC[C@@H](O)c1ccccc1C Amb28188194 [0,1,0,0,0,0|2,0,1]=4 2932 B12R1.308 C=CC[C@@H](O)c1ccccc1F Amb27812041 [0,1,0,0,0,0|1,1,1]=4 2933 B12R1.308 C=CC[C@@H](O)c1ccccc1S Amb28066020 [0,1,0,0,0,0|2,0,1]=4 2934 B12R1.308 C=CC[C@H](N)c1ccccc1Br Amb27642507 [0,1,0,0,0,0|1,0,1]=3 2935 B12R1.308 C=CC[C@H](N)c1ccccc1C Amb27850932 [0,1,0,0,0,0|2,0,1]=4 2936 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb28364530 [0,1,0,0,0,0|1,1,1]=4 2937 B12R1.308 C=CC[C@H](N)c1ccccc1F Amb27951102 [0,1,0,0,0,0|1,1,1]=4 2938 B12R1.308 C=CC[C@H](N)c1cnccc1Br Amb27394129 [0,1,0,0,0,0|2,0,1]=4 2939 B12R1.308 C=CC[C@H](O)c1ccccc1C Amb27981945 [0,1,0,0,0,0|2,0,1]=4 2940 B12R1.308 C=CC[C@H](O)c1ccccc1F Amb27219078 [0,1,0,0,0,0|1,1,1]=4 2941 B12R1.308 CC#CC(O)c1ccccc1C Amb28453534 [0,1,0,0,0,0|2,0,1]=4 2942 B12R1.308 CC(CC#N)c1ccccc1Br Amb26631665 [0,1,0,0,0,0|2,0,0]=3 2943 B12R1.308 CC(CC#N)c1ccccc1Cl Amb25083306 [0,1,0,0,0,0|2,1,0]=4 2944 B12R1.308 CC(CC#N)c1ccccc1F Amb26883743 [0,1,0,0,0,0|2,1,0]=4 2945 B12R1.308 CC(CCN)c1ccccc1Br Amb33387586 [0,1,0,0,0,0|2,0,0]=3 2946 B12R1.308 CC(CCN)c1ccccc1Cl Amb17234048 [0,1,0,0,0,0|2,1,0]=4 2947 B12R1.308 CC(CCN)c1ccccc1F Amb17232646 [0,1,0,0,0,0|2,1,0]=4 2948 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,1,0,0,0,0|3,0,0]=4 2949 B12R1.308 CC(CCN)c1cccnc1Br Amb33110731 [0,1,0,0,0,0|3,0,0]=4 2950 B12R1.308 CC(CCN)c1ccncc1Br Amb33388508 [0,1,0,0,0,0|3,0,0]=4 2951 B12R1.308 CC(CCN)c1ncccc1Br Amb33335729 [0,1,0,0,0,0|3,0,0]=4 2952 B12R1.308 CC(CCO)c1ccccc1Cl Amb17234164 [0,1,0,0,0,0|2,1,0]=4 2953 B12R1.308 CC(CCO)c1ccccc1F Amb17232671 [0,1,0,0,0,0|2,1,0]=4 2954 B12R1.308 CC(CCO)c1ccccc1N Amb28196373 [0,1,0,0,0,0|3,0,0]=4 2955 B12R1.308 CC(CON)c1ccccc1Br Amb33387624 [0,1,0,0,0,0|2,0,0]=3 2956 B12R1.308 CC(CON)c1ccccc1Cl Amb33052584 [0,1,0,0,0,0|2,1,0]=4 2957 B12R1.308 CC(CON)c1ccccc1F Amb33361487 [0,1,0,0,0,0|2,1,0]=4 2958 B12R1.308 CC(CON)c1ccccc1O Amb33196415 [0,1,0,0,0,0|3,0,0]=4 2959 B12R1.308 CC(CON)c1cccnc1Br Amb33387775 [0,1,0,0,0,0|3,0,0]=4 2960 B12R1.308 CC(CON)c1ccncc1Br Amb33388680 [0,1,0,0,0,0|3,0,0]=4 2961 B12R1.308 CC(CON)c1ncccc1Br Amb33336074 [0,1,0,0,0,0|3,0,0]=4 2962 B12R1.308 CC(N=C=O)c1ccccc1Br Amb28044126 [0,1,0,0,0,0|3,0,0]=4 2963 B12R1.308 CC(N=[N+]=[N-])c1ccccc1Br Amb26561544 [0,1,0,0,0,0|2,0,1]=4 2964 B12R1.308 CC(NC=O)c1ccccc1Br Amb27770008 [0,1,0,0,0,0|3,0,0]=4 2965 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,1,0,0,0,0|1,0,1]=3 2966 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,1,0,0,0,0|2,0,1]=4 2967 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,1,0,0,0,0|1,1,1]=4 2968 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,1,0,0,0,0|1,1,1]=4 2969 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,1,0,0,0,0|2,0,1]=4 2970 B12R1.308 CCCC(=O)c1ccccc1O Amb8629040 [0,1,0,0,0,0|2,0,1]=4 2971 B12R1.308 CCCC(=O)c1cccnc1Br Amb27841846 [0,1,0,0,0,0|2,0,1]=4 2972 B12R1.308 CCCC(C)c1ccccc1C Amb27244850 [0,1,0,0,0,0|2,0,0]=3 2973 B12R1.308 CCCC(C)c1ccccc1O Amb3939443 [0,1,0,0,0,0|2,0,0]=3 2974 B12R1.308 CCCC(Cl)c1ccccc1Cl Amb27808095 [0,1,0,0,0,0|1,1,0]=3 2975 B12R1.308 CCCC(N)c1ccccc1Br Amb27815075 [0,1,0,0,0,0|1,0,0]=2 2976 B12R1.308 CCCC(N)c1ccccc1C Amb17232446 [0,1,0,0,0,0|2,0,0]=3 2977 B12R1.308 CCCC(N)c1ccccc1C Amb32662363 [0,1,0,0,0,0|2,0,0]=3 2978 B12R1.308 CCCC(N)c1ccccc1Cl Amb17234047 [0,1,0,0,0,0|1,1,0]=3 2979 B12R1.308 CCCC(N)c1ccccc1F Amb17232645 [0,1,0,0,0,0|1,1,0]=3 2980 B12R1.308 CCCC(N)c1ccccc1F Amb30982461 [0,1,0,0,0,0|1,1,0]=3 2981 B12R1.308 CCCC(N)c1cccnc1Br Amb27465808 [0,1,0,0,0,0|2,0,0]=3 2982 B12R1.308 CCCC(N)c1cccnc1Cl Amb27655462 [0,1,0,0,0,0|2,1,0]=4 2983 B12R1.308 CCCC(N)c1cccnc1N Amb28124004 [0,1,0,0,0,0|3,0,0]=4 2984 B12R1.308 CCCC(N)c1cccnc1O Amb27587404 [0,1,0,0,0,0|3,0,0]=4 2985 B12R1.308 CCCC(N)c1ccncc1Br Amb27814583 [0,1,0,0,0,0|2,0,0]=3 2986 B12R1.308 CCCC(N)c1ccncc1F Amb27168255 [0,1,0,0,0,0|2,1,0]=4 2987 B12R1.308 CCCC(N)c1cnccc1C Amb18828707 [0,1,0,0,0,0|3,0,0]=4 2988 B12R1.308 CCCC(N)c1ncncc1Br Amb27593176 [0,1,0,0,0,0|3,0,0]=4 2989 B12R1.308 CCCC(O)c1ccccc1C Amb17232483 [0,1,0,0,0,0|2,0,0]=3 2990 B12R1.308 CCCC(O)c1ccccc1Cl Amb17234154 [0,1,0,0,0,0|1,1,0]=3 2991 B12R1.308 CCCC(O)c1ccccc1F Amb17232666 [0,1,0,0,0,0|1,1,0]=3 2992 B12R1.308 CCCC(O)c1cccnc1Br Amb35702777 [0,1,0,0,0,0|2,0,0]=3 2993 B12R1.308 CCCC(O)c1cccnc1C Amb27399818 [0,1,0,0,0,0|3,0,0]=4 2994 B12R1.308 CCCC(O)c1ccncc1Cl Amb27979725 [0,1,0,0,0,0|2,1,0]=4 2995 B12R1.308 CCCC(O)c1cnccc1N Amb27803449 [0,1,0,0,0,0|3,0,0]=4 2996 B12R1.308 CCCC(O)c1ncccc1C Amb18182634 [0,1,0,0,0,0|3,0,0]=4 2997 B12R1.308 CCCC(O)c1ncccc1Cl Amb27162023 [0,1,0,0,0,0|2,1,0]=4 2998 B12R1.308 CCCC(O)c1ncccc1N Amb35587562 [0,1,0,0,0,0|3,0,0]=4 2999 B12R1.308 CCCN(C)c1ccccc1N Amb8898676 [0,1,0,0,0,0|3,0,0]=4 3000 B12R1.308 CCC[C@@H](N)c1ccccc1C Amb27391198 [0,1,0,0,0,0|2,0,0]=3 3001 B12R1.308 CCC[C@@H](N)c1ccccc1Cl Amb27196196 [0,1,0,0,0,0|1,1,0]=3 3002 B12R1.308 CCC[C@@H](N)c1cccnc1Cl Amb27831928 [0,1,0,0,0,0|2,1,0]=4 3003 B12R1.308 CCC[C@@H](N)c1cccnc1O Amb25789514 [0,1,0,0,0,0|3,0,0]=4 3004 B12R1.308 CCC[C@@H](N)c1ccncc1C Amb28072847 [0,1,0,0,0,0|3,0,0]=4 3005 B12R1.308 CCC[C@@H](N)c1ccncc1N Amb28291421 [0,1,0,0,0,0|3,0,0]=4 3006 B12R1.308 CCC[C@@H](N)c1cnccc1C Amb28397848 [0,1,0,0,0,0|3,0,0]=4 3007 B12R1.308 CCC[C@@H](N)c1ncccc1Br Amb28123203 [0,1,0,0,0,0|2,0,0]=3 3008 B12R1.308 CCC[C@@H](N)c1ncccc1Cl Amb27620350 [0,1,0,0,0,0|2,1,0]=4 3009 B12R1.308 CCC[C@@H](N)c1ncccc1N Amb27470724 [0,1,0,0,0,0|3,0,0]=4 3010 B12R1.308 CCC[C@@H](O)c1ccccc1F Amb28064219 [0,1,0,0,0,0|1,1,0]=3 3011 B12R1.308 CCC[C@@H](O)c1ccncc1C Amb27220301 [0,1,0,0,0,0|3,0,0]=4 3012 B12R1.308 CCC[C@H](N)c1ccccc1C Amb26841003 [0,1,0,0,0,0|2,0,0]=3 3013 B12R1.308 CCC[C@H](N)c1ccccc1F Amb27830664 [0,1,0,0,0,0|1,1,0]=3 3014 B12R1.308 CCC[C@H](N)c1ccccc1I Amb28401584 [0,1,0,0,0,0|1,1,0]=3 3015 B12R1.308 CCC[C@H](N)c1ccccc1O Amb28072846 [0,1,0,0,0,0|2,0,0]=3 3016 B12R1.308 CCC[C@H](N)c1ccccc1S Amb27816971 [0,1,0,0,0,0|2,0,0]=3 3017 B12R1.308 CCC[C@H](N)c1cccnc1F Amb27469618 [0,1,0,0,0,0|2,1,0]=4 3018 B12R1.308 CCC[C@H](N)c1cccnc1O Amb28457234 [0,1,0,0,0,0|3,0,0]=4 3019 B12R1.308 CCC[C@H](N)c1ccncc1Br Amb27851411 [0,1,0,0,0,0|2,0,0]=3 3020 B12R1.308 CCC[C@H](N)c1cnccc1Br Amb27461989 [0,1,0,0,0,0|2,0,0]=3 3021 B12R1.308 CCC[C@H](N)c1ncccc1N Amb27227956 [0,1,0,0,0,0|3,0,0]=4 3022 B12R1.308 CCC[C@H](O)c1ccccc1Br Amb27661408 [0,1,0,0,0,0|1,0,0]=2 3023 B12R1.308 CCC[C@H](O)c1ccccc1Cl Amb28381799 [0,1,0,0,0,0|1,1,0]=3 3024 B12R1.308 CCC[C@H](O)c1ccncc1C Amb28185410 [0,1,0,0,0,0|3,0,0]=4 3025 B12R1.308 CCC[C@H](O)c1cnccc1C Amb27758501 [0,1,0,0,0,0|3,0,0]=4 3026 B12R1.308 CCC[C@H](O)c1ncccc1Br Amb27228260 [0,1,0,0,0,0|2,0,0]=3 3027 B12R1.308 CCC[C@H](O)c1ncccc1C Amb27651963 [0,1,0,0,0,0|3,0,0]=4 3028 B12R1.308 CCC[C@H](O)c1ncccc1Cl Amb27871918 [0,1,0,0,0,0|2,1,0]=4 3029 B12R1.308 CCNC(=N)c1ccccc1Br Amb27590883 [0,1,0,0,0,0|2,0,1]=4 3030 B12R1.308 CCNC(=O)c1ccccc1Br Amb3373826 [0,1,0,0,0,0|2,0,1]=4 3031 B12R1.308 CCNC(C)c1ccccc1I Amb28288975 [0,1,0,0,0,0|2,1,0]=4 3032 B12R1.308 CCN[C@H](C)c1ccccc1Br Amb27615416 [0,1,0,0,0,0|2,0,0]=3 3033 B12R1.308 CCN[C@H](C)c1ccccc1C Amb28350570 [0,1,0,0,0,0|3,0,0]=4 3034 B12R1.308 CCN[C@H](C)c1ccccc1Cl Amb27637568 [0,1,0,0,0,0|2,1,0]=4 3035 B12R1.308 CCOC(=O)c1ccccc1Br Amb2687785 [0,1,0,0,0,0|2,0,1]=4 3036 B12R1.308 CCSC(C)c1ccccc1Cl Amb28127831 [0,1,0,0,0,0|2,1,0]=4 3037 B12R1.308 CCSC(C)c1ccccc1F Amb28185640 [0,1,0,0,0,0|2,1,0]=4 3038 B12R1.308 CN(CC#N)c1ccccc1Br Amb17343206 [0,1,0,0,0,0|3,0,0]=4 3039 B12R1.308 CN(CCCl)c1ccccc1Br Amb17351919 [0,1,0,0,0,0|3,0,0]=4 3040 B12R1.308 CN(CCN)c1ccccc1Br Amb17059772 [0,1,0,0,0,0|3,0,0]=4 3041 B12R1.308 CN(CCO)c1ccccc1Br Amb17344451 [0,1,0,0,0,0|3,0,0]=4 3042 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,1,0,0,0,0|0,0,1]=2 3043 B12R1.308 CNCC(=O)c1ccccc1C Amb18862585 [0,1,0,0,0,0|1,0,1]=3 3044 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,1,0,0,0,0|0,1,1]=3 3045 B12R1.308 CNCC(=O)c1ccccc1Cl Amb32679864 [0,1,0,0,0,0|0,1,1]=3 3046 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,1,0,0,0,0|0,1,1]=3 3047 B12R1.308 CNCC(=O)c1ccccc1O Amb26392452 [0,1,0,0,0,0|1,0,1]=3 3048 B12R1.308 CNCC(=O)c1cccnc1Br Amb33387442 [0,1,0,0,0,0|1,0,1]=3 3049 B12R1.308 CNCC(=O)c1cccnc1C Amb32880138 [0,1,0,0,0,0|2,0,1]=4 3050 B12R1.308 CNCC(=O)c1cccnc1Cl Amb33256936 [0,1,0,0,0,0|1,1,1]=4 3051 B12R1.308 CNCC(=O)c1cccnc1F Amb33378328 [0,1,0,0,0,0|1,1,1]=4 3052 B12R1.308 CNCC(=O)c1ccncc1Br Amb33388473 [0,1,0,0,0,0|1,0,1]=3 3053 B12R1.308 CNCC(=O)c1ccncc1C Amb33414506 [0,1,0,0,0,0|2,0,1]=4 3054 B12R1.308 CNCC(=O)c1ccncc1Cl Amb33413520 [0,1,0,0,0,0|1,1,1]=4 3055 B12R1.308 CNCC(=O)c1ccncc1F Amb25076936 [0,1,0,0,0,0|1,1,1]=4 3056 B12R1.308 CNCC(=O)c1cnccc1C Amb26503018 [0,1,0,0,0,0|2,0,1]=4 3057 B12R1.308 CNCC(=O)c1cnccc1N Amb27196154 [0,1,0,0,0,0|2,0,1]=4 3058 B12R1.308 CNCC(=O)c1ncccc1Br Amb33335735 [0,1,0,0,0,0|1,0,1]=3 3059 B12R1.308 CNCC(=O)c1ncccc1C Amb33429064 [0,1,0,0,0,0|2,0,1]=4 3060 B12R1.308 CNCC(=O)c1ncccc1F Amb28435430 [0,1,0,0,0,0|1,1,1]=4 3061 B12R1.308 CNCC(C)c1ccccc1Cl Amb28207901 [0,1,0,0,0,0|0,1,0]=2 3062 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [0,1,0,0,0,0|0,0,0]=1 3063 B12R1.308 CNCC(O)c1ccccc1C Amb5750895 [0,1,0,0,0,0|1,0,0]=2 3064 B12R1.308 CNCC(O)c1ccccc1Cl Amb5750901 [0,1,0,0,0,0|0,1,0]=2 3065 B12R1.308 CNCC(O)c1ccccc1F Amb5750898 [0,1,0,0,0,0|0,1,0]=2 3066 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [0,1,0,0,0,0|1,0,0]=2 3067 B12R1.308 CNCC(O)c1cccnc1Br Amb33387439 [0,1,0,0,0,0|1,0,0]=2 3068 B12R1.308 CNCC(O)c1cccnc1C Amb32880621 [0,1,0,0,0,0|2,0,0]=3 3069 B12R1.308 CNCC(O)c1cccnc1Cl Amb33256933 [0,1,0,0,0,0|1,1,0]=3 3070 B12R1.308 CNCC(O)c1cccnc1F Amb33378329 [0,1,0,0,0,0|1,1,0]=3 3071 B12R1.308 CNCC(O)c1ccncc1Br Amb33241237 [0,1,0,0,0,0|1,0,0]=2 3072 B12R1.308 CNCC(O)c1ccncc1C Amb33414520 [0,1,0,0,0,0|2,0,0]=3 3073 B12R1.308 CNCC(O)c1ccncc1Cl Amb33413516 [0,1,0,0,0,0|1,1,0]=3 3074 B12R1.308 CNCC(O)c1ccncc1F Amb25259123 [0,1,0,0,0,0|1,1,0]=3 3075 B12R1.308 CNCC(O)c1cnccc1C Amb26616381 [0,1,0,0,0,0|2,0,0]=3 3076 B12R1.308 CNCC(O)c1cncnc1C Amb33472505 [0,1,0,0,0,0|3,0,0]=4 3077 B12R1.308 CNCC(O)c1ncccc1Br Amb23586111 [0,1,0,0,0,0|1,0,0]=2 3078 B12R1.308 CNCC(O)c1ncccc1C Amb24711552 [0,1,0,0,0,0|2,0,0]=3 3079 B12R1.308 CNCC(O)c1ncccc1F Amb27958803 [0,1,0,0,0,0|1,1,0]=3 3080 B12R1.308 CNCC(O)c1nccnc1C Amb33142590 [0,1,0,0,0,0|3,0,0]=4 3081 B12R1.308 CNNC(=O)c1ccccc1N Amb18646316 [0,1,0,0,0,0|2,0,1]=4 3082 B12R1.308 CNNC(=O)c1ccccc1O Amb25910765 [0,1,0,0,0,0|2,0,1]=4 3083 B12R1.308 CNOC(=O)c1ccccc1O Amb28381144 [0,1,0,0,0,0|2,0,1]=4 3084 B12R1.308 COCC(C)c1cnccc1N Amb27231363 [0,1,0,0,0,0|3,0,0]=4 3085 B12R1.308 COCC(F)c1ccccc1N Amb27615210 [0,1,0,0,0,0|2,0,0]=3 3086 B12R1.308 COCC(N)c1ccccc1Br Amb25974461 [0,1,0,0,0,0|1,0,0]=2 3087 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [0,1,0,0,0,0|1,1,0]=3 3088 B12R1.308 COCC(N)c1cccnc1N Amb27470702 [0,1,0,0,0,0|3,0,0]=4 3089 B12R1.308 COCC(N)c1ccncc1C Amb27391221 [0,1,0,0,0,0|3,0,0]=4 3090 B12R1.308 COCC(N)c1ncccc1C Amb27872125 [0,1,0,0,0,0|3,0,0]=4 3091 B12R1.308 COCC(N)c1ncccc1O Amb27398623 [0,1,0,0,0,0|3,0,0]=4 3092 B12R1.308 COCC(N)c1ncncc1Br Amb27465624 [0,1,0,0,0,0|3,0,0]=4 3093 B12R1.308 COCC(O)c1cccnc1Br Amb35702779 [0,1,0,0,0,0|2,0,0]=3 3094 B12R1.308 COCC(O)c1ccncc1F Amb27754889 [0,1,0,0,0,0|2,1,0]=4 3095 B12R1.308 COCC(O)c1cnccc1C Amb27243298 [0,1,0,0,0,0|3,0,0]=4 3096 B12R1.308 COCC(O)c1cnccc1N Amb28197976 [0,1,0,0,0,0|3,0,0]=4 3097 B12R1.308 COCC(O)c1ncccc1Br Amb27436429 [0,1,0,0,0,0|2,0,0]=3 3098 B12R1.308 COCC(O)c1ncccc1N Amb30022916 [0,1,0,0,0,0|3,0,0]=4 3099 B12R1.308 COC[C@@H](N)c1ccccc1Br Amb27259275 [0,1,0,0,0,0|1,0,0]=2 3100 B12R1.308 COC[C@@H](N)c1ccccc1I Amb27642503 [0,1,0,0,0,0|1,1,0]=3 3101 B12R1.308 COC[C@@H](N)c1ccccc1N Amb27882660 [0,1,0,0,0,0|2,0,0]=3 3102 B12R1.308 COC[C@@H](N)c1ccccc1O Amb27399755 [0,1,0,0,0,0|2,0,0]=3 3103 B12R1.308 COC[C@@H](N)c1cccnc1Cl Amb27780864 [0,1,0,0,0,0|2,1,0]=4 3104 B12R1.308 COC[C@@H](N)c1cccnc1S Amb27817815 [0,1,0,0,0,0|3,0,0]=4 3105 B12R1.308 COC[C@@H](N)c1ccncc1Cl Amb27256689 [0,1,0,0,0,0|2,1,0]=4 3106 B12R1.308 COC[C@@H](N)c1ncccc1Br Amb27597609 [0,1,0,0,0,0|2,0,0]=3 3107 B12R1.308 COC[C@@H](N)c1ncccc1O Amb27879452 [0,1,0,0,0,0|3,0,0]=4 3108 B12R1.308 COC[C@H](N)c1ccccc1F Amb27752235 [0,1,0,0,0,0|1,1,0]=3 3109 B12R1.308 COC[C@H](N)c1ccccc1O Amb28341304 [0,1,0,0,0,0|2,0,0]=3 3110 B12R1.308 COC[C@H](N)c1cccnc1Cl Amb27596522 [0,1,0,0,0,0|2,1,0]=4 3111 B12R1.308 COC[C@H](N)c1cccnc1N Amb27593480 [0,1,0,0,0,0|3,0,0]=4 3112 B12R1.308 COC[C@H](N)c1cnccc1Cl Amb27785556 [0,1,0,0,0,0|2,1,0]=4 3113 B12R1.308 COC[C@H](N)c1ncccc1Br Amb28133343 [0,1,0,0,0,0|2,0,0]=3 3114 B12R1.308 COC[C@H](N)c1ncccc1O Amb27250849 [0,1,0,0,0,0|3,0,0]=4 3115 B12R1.308 CONC(C)c1ccccc1Br Amb28075911 [0,1,0,0,0,0|2,0,0]=3 3116 B12R1.308 CONC(C)c1ccccc1C Amb26449486 [0,1,0,0,0,0|3,0,0]=4 3117 B12R1.308 CONC(C)c1ccccc1C Amb33552564 [0,1,0,0,0,0|3,0,0]=4 3118 B12R1.308 CO\N=C(/N)c1ccccc1Br Amb18227754 [0,1,0,0,0,0|2,0,1]=4 3119 B12R1.308 CO\N=C(\C)c1ccccc1Br Amb27207597 [0,1,0,0,0,0|2,0,1]=4 3120 B12R1.308 CSCC(=O)c1ccccc1Br Amb27389140 [0,1,0,0,0,0|1,0,1]=3 3121 B12R1.308 CSCC(=O)c1ccccc1C Amb18796321 [0,1,0,0,0,0|2,0,1]=4 3122 B12R1.308 CSCC(=O)c1ccccc1Cl Amb18320104 [0,1,0,0,0,0|1,1,1]=4 3123 B12R1.308 CSCC(=O)c1ccccc1F Amb19057447 [0,1,0,0,0,0|1,1,1]=4 3124 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [0,1,0,0,0,0|1,1,0]=3 3125 B12R1.308 CSCC(N)c1ccncc1F Amb27760134 [0,1,0,0,0,0|2,1,0]=4 3126 B12R1.308 CSCC(N)c1cnccc1N Amb28132671 [0,1,0,0,0,0|3,0,0]=4 3127 B12R1.308 CSCC(O)c1ccccc1C Amb19061296 [0,1,0,0,0,0|2,0,0]=3 3128 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [0,1,0,0,0,0|2,0,0]=3 3129 B12R1.308 C[C@@H](N=[N+]=[N-])c1ccccc1Br Amb27251930 [0,1,0,0,0,0|2,0,1]=4 3130 B12R1.308 C[C@H](N=[N+]=[N-])c1ccccc1Br Amb26841248 [0,1,0,0,0,0|2,0,1]=4 3131 B12R1.308 C\C=C/C(O)c1ccccc1O Amb28324317 [0,1,0,0,0,0|2,0,1]=4 3132 B12R1.308 Cc1ccccc1C(C)CC#N Amb27762988 [0,1,0,0,0,0|3,0,0]=4 3133 B12R1.308 Cc1ccccc1C(C)CCN Amb17232447 [0,1,0,0,0,0|3,0,0]=4 3134 B12R1.308 Cc1ccccc1C(C)CCO Amb17232499 [0,1,0,0,0,0|3,0,0]=4 3135 B12R1.308 Cc1ccccc1C(C)CON Amb33360571 [0,1,0,0,0,0|3,0,0]=4 3136 B12R1.308 Cc1ccccc1C(F)CCN Amb25894968 [0,1,0,0,0,0|3,0,0]=4 3137 B12R1.308 Cc1ccccc1C(N)CC#N Amb18563498 [0,1,0,0,0,0|3,0,0]=4 3138 B12R1.308 Cc1ccccc1C(N)CCO Amb17103953 [0,1,0,0,0,0|3,0,0]=4 3139 B12R1.308 Cc1ccccc1C(O)CC#N Amb1111330 [0,1,0,0,0,0|3,0,0]=4 3140 B12R1.308 Cc1ccccc1C(O)CCN Amb17232539 [0,1,0,0,0,0|3,0,0]=4 3141 B12R1.308 Cc1ccccc1C(O)CCO Amb28195046 [0,1,0,0,0,0|3,0,0]=4 3142 B12R1.308 Cc1ccccc1C(O)CNN Amb17232608 [0,1,0,0,0,0|2,0,0]=3 3143 B12R1.308 Cc1ccccc1C(O)CNO Amb17334702 [0,1,0,0,0,0|2,0,0]=3 3144 B12R1.308 Cc1ccccc1[C@@H](C)CCO Amb27981985 [0,1,0,0,0,0|3,0,0]=4 3145 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,1,0,0,0,0|3,0,0]=4 3146 B12R1.308 Cc1ccccc1[C@@H](O)CC#N Amb28188196 [0,1,0,0,0,0|3,0,0]=4 3147 B12R1.308 Cc1ccccc1[C@@H](O)CCN Amb33360572 [0,1,0,0,0,0|3,0,0]=4 3148 B12R1.308 Cc1ccccc1[C@H](N)CCO Amb27221061 [0,1,0,0,0,0|3,0,0]=4 3149 B12R1.308 Cc1ccccc1[C@H](O)CCN Amb33360573 [0,1,0,0,0,0|3,0,0]=4 3150 B12R1.308 N#CCC(=O)c1ccccc1Br Amb3941065 [0,1,0,0,0,0|2,0,1]=4 3151 B12R1.308 N#CCC(N)c1ccccc1Br Amb18066761 [0,1,0,0,0,0|2,0,0]=3 3152 B12R1.308 N#CCC(N)c1ccccc1Cl Amb18564158 [0,1,0,0,0,0|2,1,0]=4 3153 B12R1.308 N#CCC(N)c1ccccc1F Amb18563603 [0,1,0,0,0,0|2,1,0]=4 3154 B12R1.308 N#CCC(N)c1ccccc1I Amb27202260 [0,1,0,0,0,0|2,1,0]=4 3155 B12R1.308 N#CCC(N)c1ccccc1N Amb27595646 [0,1,0,0,0,0|3,0,0]=4 3156 B12R1.308 N#CCC(N)c1ccccc1S Amb27389236 [0,1,0,0,0,0|3,0,0]=4 3157 B12R1.308 N#CCC(O)c1ccccc1Br Amb27444920 [0,1,0,0,0,0|2,0,0]=3 3158 B12R1.308 N#CCC(O)c1ccccc1Cl Amb4405009 [0,1,0,0,0,0|2,1,0]=4 3159 B12R1.308 N#CCC(O)c1ccccc1F Amb17232516 [0,1,0,0,0,0|2,1,0]=4 3160 B12R1.308 N#CCC(O)c1ccccc1O Amb27433523 [0,1,0,0,0,0|3,0,0]=4 3161 B12R1.308 N#CCC(O)c1cccnc1Br Amb33387802 [0,1,0,0,0,0|3,0,0]=4 3162 B12R1.308 N#CCC(O)c1ccncc1Br Amb33244352 [0,1,0,0,0,0|3,0,0]=4 3163 B12R1.308 N#CCC(O)c1ncccc1Br Amb33336093 [0,1,0,0,0,0|3,0,0]=4 3164 B12R1.308 N#CC[C@@H](N)c1ccncc1Br Amb28120699 [0,1,0,0,0,0|3,0,0]=4 3165 B12R1.308 N#CC[C@@H](O)c1ccccc1F Amb27879709 [0,1,0,0,0,0|2,1,0]=4 3166 B12R1.308 N#CC[C@H](N)c1ccccc1Br Amb27403589 [0,1,0,0,0,0|2,0,0]=3 3167 B12R1.308 N#CC[C@H](N)c1ccccc1F Amb27425307 [0,1,0,0,0,0|2,1,0]=4 3168 B12R1.308 N#CC[C@H](N)c1ccncc1Br Amb27947277 [0,1,0,0,0,0|3,0,0]=4 3169 B12R1.308 N#CC[C@H](N)c1cnccc1Br Amb28319461 [0,1,0,0,0,0|3,0,0]=4 3170 B12R1.308 N#CC[C@H](O)c1ccccc1Br Amb27464759 [0,1,0,0,0,0|2,0,0]=3 3171 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,1,0,0,0,0|2,0,0]=3 3172 B12R1.308 NC(CCO)c1ccccc1Cl Amb1993960 [0,1,0,0,0,0|2,1,0]=4 3173 B12R1.308 NC(CCO)c1ccccc1F Amb2408130 [0,1,0,0,0,0|2,1,0]=4 3174 B12R1.308 NC(CCO)c1ccccc1F Amb32664424 [0,1,0,0,0,0|2,1,0]=4 3175 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,1,0,0,0,0|3,0,0]=4 3176 B12R1.308 NC(CCO)c1cccnc1Br Amb24461552 [0,1,0,0,0,0|3,0,0]=4 3177 B12R1.308 NC(CCO)c1ccncc1Br Amb25212924 [0,1,0,0,0,0|3,0,0]=4 3178 B12R1.308 NC(CCO)c1ncccc1Br Amb25244942 [0,1,0,0,0,0|3,0,0]=4 3179 B12R1.308 NCCC(=O)c1ccccc1Br Amb33389465 [0,1,0,0,0,0|2,0,1]=4 3180 B12R1.308 NCCC(F)c1ccccc1Br Amb25996777 [0,1,0,0,0,0|2,0,0]=3 3181 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,1,0,0,0,0|2,1,0]=4 3182 B12R1.308 NCCC(F)c1ccccc1F Amb25894969 [0,1,0,0,0,0|2,1,0]=4 3183 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,1,0,0,0,0|3,0,0]=4 3184 B12R1.308 NCCC(F)c1cccnc1Br Amb33387478 [0,1,0,0,0,0|3,0,0]=4 3185 B12R1.308 NCCC(F)c1ccncc1Br Amb33388650 [0,1,0,0,0,0|3,0,0]=4 3186 B12R1.308 NCCC(F)c1ncccc1Br Amb33336060 [0,1,0,0,0,0|3,0,0]=4 3187 B12R1.308 NCCC(N)c1ccccc1I Amb27788534 [0,1,0,0,0,0|2,1,0]=4 3188 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,1,0,0,0,0|2,0,0]=3 3189 B12R1.308 NCCC(O)c1ccccc1Cl Amb17234259 [0,1,0,0,0,0|2,1,0]=4 3190 B12R1.308 NCCC(O)c1ccccc1F Amb17232696 [0,1,0,0,0,0|2,1,0]=4 3191 B12R1.308 NCCC(O)c1ccccc1N Amb28249964 [0,1,0,0,0,0|3,0,0]=4 3192 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,1,0,0,0,0|3,0,0]=4 3193 B12R1.308 NCCC(O)c1cccnc1Br Amb33389447 [0,1,0,0,0,0|3,0,0]=4 3194 B12R1.308 NCCC(O)c1ccncc1Br Amb32693729 [0,1,0,0,0,0|3,0,0]=4 3195 B12R1.308 NCCC(O)c1ncccc1Br Amb33335706 [0,1,0,0,0,0|3,0,0]=4 3196 B12R1.308 NCC[C@@H](N)c1ccccc1Cl Amb27205254 [0,1,0,0,0,0|2,1,0]=4 3197 B12R1.308 NCC[C@@H](N)c1ccccc1I Amb27204878 [0,1,0,0,0,0|2,1,0]=4 3198 B12R1.308 NCC[C@@H](O)c1ccccc1Br Amb33387618 [0,1,0,0,0,0|2,0,0]=3 3199 B12R1.308 NCC[C@@H](O)c1ccccc1Cl Amb33052581 [0,1,0,0,0,0|2,1,0]=4 3200 B12R1.308 NCC[C@@H](O)c1ccccc1F Amb33361507 [0,1,0,0,0,0|2,1,0]=4 3201 B12R1.308 NCC[C@@H](O)c1ccccc1O Amb33196477 [0,1,0,0,0,0|3,0,0]=4 3202 B12R1.308 NCC[C@@H](O)c1cccnc1Br Amb33388507 [0,1,0,0,0,0|3,0,0]=4 3203 B12R1.308 NCC[C@@H](O)c1ccncc1Br Amb33388253 [0,1,0,0,0,0|3,0,0]=4 3204 B12R1.308 NCC[C@@H](O)c1ncccc1Br Amb33336054 [0,1,0,0,0,0|3,0,0]=4 3205 B12R1.308 NCC[C@H](N)c1cccnc1Br Amb27640706 [0,1,0,0,0,0|3,0,0]=4 3206 B12R1.308 NCC[C@H](O)c1ccccc1Br Amb33387621 [0,1,0,0,0,0|2,0,0]=3 3207 B12R1.308 NCC[C@H](O)c1ccccc1Cl Amb33052779 [0,1,0,0,0,0|2,1,0]=4 3208 B12R1.308 NCC[C@H](O)c1ccccc1F Amb33361910 [0,1,0,0,0,0|2,1,0]=4 3209 B12R1.308 NCC[C@H](O)c1ccccc1O Amb33196476 [0,1,0,0,0,0|3,0,0]=4 3210 B12R1.308 NCC[C@H](O)c1cccnc1Br Amb33227263 [0,1,0,0,0,0|3,0,0]=4 3211 B12R1.308 NCC[C@H](O)c1ccncc1Br Amb33389537 [0,1,0,0,0,0|3,0,0]=4 3212 B12R1.308 NCC[C@H](O)c1ncccc1Br Amb33336057 [0,1,0,0,0,0|3,0,0]=4 3213 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [0,1,0,0,0,0|1,0,0]=2 3214 B12R1.308 NNCC(O)c1ccccc1Cl Amb17234360 [0,1,0,0,0,0|1,1,0]=3 3215 B12R1.308 NNCC(O)c1ccccc1F Amb17232742 [0,1,0,0,0,0|1,1,0]=3 3216 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,1,0,0,0,0|2,0,0]=3 3217 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,1,0,0,0,0|2,1,0]=4 3218 B12R1.308 N[C@@H](CCO)c1ccccc1F Amb27468716 [0,1,0,0,0,0|2,1,0]=4 3219 B12R1.308 N[C@@H](CCO)c1ccccc1I Amb27851414 [0,1,0,0,0,0|2,1,0]=4 3220 B12R1.308 N[C@@H](CCO)c1ccccc1O Amb28345683 [0,1,0,0,0,0|3,0,0]=4 3221 B12R1.308 N[C@@H](CCO)c1cccnc1Br Amb27864944 [0,1,0,0,0,0|3,0,0]=4 3222 B12R1.308 N[C@@H](CCO)c1cnccc1Br Amb27770052 [0,1,0,0,0,0|3,0,0]=4 3223 B12R1.308 N[C@@H](CCO)c1ncccc1Br Amb27801074 [0,1,0,0,0,0|3,0,0]=4 3224 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,1,0,0,0,0|2,0,0]=3 3225 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,1,0,0,0,0|2,1,0]=4 3226 B12R1.308 N[C@H](CCO)c1ccccc1F Amb25970063 [0,1,0,0,0,0|2,1,0]=4 3227 B12R1.308 N[C@H](CCO)c1ccccc1I Amb27411983 [0,1,0,0,0,0|2,1,0]=4 3228 B12R1.308 N[C@H](CCO)c1cccnc1Br Amb27259290 [0,1,0,0,0,0|3,0,0]=4 3229 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,1,0,0,0,0|3,0,0]=4 3230 B12R1.308 Nc1ccccc1[C@@H](N)CCO Amb8631341 [0,1,0,0,0,0|3,0,0]=4 3231 B12R1.308 O=C(CCBr)c1ccccc1Br Amb24695292 [0,1,0,0,0,0|2,0,1]=4 3232 B12R1.308 O=C(CCF)c1ccccc1Br Amb16231892 [0,1,0,0,0,0|2,0,1]=4 3233 B12R1.308 O=CCC(=O)c1ccccc1Br Amb9204919 [0,1,0,0,0,0|2,0,1]=4 3234 B12R1.308 O=CCC(O)c1ccccc1F Amb27947440 [0,1,0,0,0,0|2,1,0]=4 3235 B12R1.308 O=CCS(=O)c1ccccc1Br Amb27861640 [0,1,0,0,0,0|3,0,0]=4 3236 B12R1.308 OCCC(F)c1ccccc1Br Amb27421489 [0,1,0,0,0,0|2,0,0]=3 3237 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,1,0,0,0,0|2,0,0]=3 3238 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,1,0,0,0,0|2,1,0]=4 3239 B12R1.308 ONCC(O)c1ccccc1Cl Amb17335947 [0,1,0,0,0,0|1,1,0]=3 3240 B12R1.308 ONCC(O)c1ccccc1F Amb17334837 [0,1,0,0,0,0|1,1,0]=3 3241 B12R1.308 [C-]#[N+]CC(F)c1ccccc1F Amb27638289 [0,1,0,0,0,0|0,1,2]=4 3242 B12R1.371 C#CC(N)Cc1ccccc1Cl Amb28245089 [0,1,0,0,0,0|1,1,1]=4 3243 B12R1.371 C#CC(O)Cc1ccccc1Br Amb35691448 [0,1,0,0,0,0|1,0,1]=3 3244 B12R1.371 C=C(CC)Cc1ccccc1N Amb28398180 [0,1,0,0,0,0|2,0,1]=4 3245 B12R1.371 C=CC(=O)Cc1ccccc1Br Amb28143882 [0,1,0,0,0,0|1,0,2]=4 3246 B12R1.371 C=CC(C)Sc1ccccc1Br Amb28400670 [0,1,0,0,0,0|2,0,1]=4 3247 B12R1.371 C=CC(N)Cc1ccccc1Br Amb27389711 [0,1,0,0,0,0|1,0,1]=3 3248 B12R1.371 C=CC(N)Cc1ccccc1C Amb27162019 [0,1,0,0,0,0|2,0,1]=4 3249 B12R1.371 C=CC(N)Cc1ccccc1Cl Amb28367910 [0,1,0,0,0,0|1,1,1]=4 3250 B12R1.371 C=CC(O)Cc1ccccc1C Amb28401244 [0,1,0,0,0,0|2,0,1]=4 3251 B12R1.371 C=CC(O)Cc1ccccc1Cl Amb27211337 [0,1,0,0,0,0|1,1,1]=4 3252 B12R1.371 C=CC(O)Cc1ccccc1F Amb27431183 [0,1,0,0,0,0|1,1,1]=4 3253 B12R1.371 CC(C#N)Cc1ccccc1Br Amb26955520 [0,1,0,0,0,0|2,0,0]=3 3254 B12R1.371 CC(C#N)Cc1ccccc1Cl Amb25717018 [0,1,0,0,0,0|2,1,0]=4 3255 B12R1.371 CC(C#N)Cc1ccccc1F Amb28255995 [0,1,0,0,0,0|2,1,0]=4 3256 B12R1.371 CC(C#N)Nc1ccccc1Br Amb17406668 [0,1,0,0,0,0|3,0,0]=4 3257 B12R1.371 CC(C=O)Cc1ccccc1Br Amb25324057 [0,1,0,0,0,0|2,0,0]=3 3258 B12R1.371 CC(C=O)Cc1ccccc1Cl Amb26398801 [0,1,0,0,0,0|2,1,0]=4 3259 B12R1.371 CC(C=O)Cc1ccccc1F Amb24429443 [0,1,0,0,0,0|2,1,0]=4 3260 B12R1.371 CC(C=O)Cc1ccccc1I Amb24437612 [0,1,0,0,0,0|2,1,0]=4 3261 B12R1.371 CC(C=O)Cc1ccccc1N Amb27166705 [0,1,0,0,0,0|3,0,0]=4 3262 B12R1.371 CC(C=O)Cc1ccccc1O Amb25313067 [0,1,0,0,0,0|3,0,0]=4 3263 B12R1.371 CC(C=O)Oc1ccccc1Br Amb30020613 [0,1,0,0,0,0|3,0,0]=4 3264 B12R1.371 CC(C=O)Sc1ccccc1Br Amb30020876 [0,1,0,0,0,0|3,0,0]=4 3265 B12R1.371 CC(CBr)Cc1ccccc1Br Amb25040689 [0,1,0,0,0,0|2,0,0]=3 3266 B12R1.371 CC(CBr)Cc1ccccc1Cl Amb28043482 [0,1,0,0,0,0|2,1,0]=4 3267 B12R1.371 CC(CBr)Cc1ccccc1F Amb25741700 [0,1,0,0,0,0|2,1,0]=4 3268 B12R1.371 CC(CBr)Cc1ccncc1Br Amb32689601 [0,1,0,0,0,0|3,0,0]=4 3269 B12R1.371 CC(CBr)Cc1ncccc1Br Amb25111379 [0,1,0,0,0,0|3,0,0]=4 3270 B12R1.371 CC(CCl)Cc1ccccc1Br Amb26645125 [0,1,0,0,0,0|2,0,0]=3 3271 B12R1.371 CC(CCl)Cc1ccccc1Cl Amb25997478 [0,1,0,0,0,0|2,1,0]=4 3272 B12R1.371 CC(CCl)Cc1ccccc1F Amb25349982 [0,1,0,0,0,0|2,1,0]=4 3273 B12R1.371 CC(CCl)Cc1ccncc1Br Amb32689600 [0,1,0,0,0,0|3,0,0]=4 3274 B12R1.371 CC(CCl)Cc1ncccc1Br Amb26503346 [0,1,0,0,0,0|3,0,0]=4 3275 B12R1.371 CC(CCl)Oc1ccccc1Br Amb17261132 [0,1,0,0,0,0|3,0,0]=4 3276 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [0,1,0,0,0,0|2,0,0]=3 3277 B12R1.371 CC(CN)Cc1ccccc1Cl Amb5743846 [0,1,0,0,0,0|2,1,0]=4 3278 B12R1.371 CC(CN)Cc1ccccc1F Amb5743840 [0,1,0,0,0,0|2,1,0]=4 3279 B12R1.371 CC(CN)Cc1ncccc1Br Amb28346175 [0,1,0,0,0,0|3,0,0]=4 3280 B12R1.371 CC(CN)Nc1ccccc1Br Amb28118354 [0,1,0,0,0,0|3,0,0]=4 3281 B12R1.371 CC(CN)Oc1ccccc1Br Amb33530517 [0,1,0,0,0,0|3,0,0]=4 3282 B12R1.371 CC(CO)Cc1ccccc1F Amb26508993 [0,1,0,0,0,0|2,1,0]=4 3283 B12R1.371 CC(CO)Cc1ccccc1O Amb28061434 [0,1,0,0,0,0|3,0,0]=4 3284 B12R1.371 CC(CO)Oc1ccccc1Br Amb17249276 [0,1,0,0,0,0|3,0,0]=4 3285 B12R1.371 CC(CO)Sc1ccccc1Br Amb27755752 [0,1,0,0,0,0|3,0,0]=4 3286 B12R1.371 CC(Cc1ccccc1Br)NN Amb27623259 [0,1,0,0,0,0|1,0,0]=2 3287 B12R1.371 CC(Cc1ccccc1F)NN Amb28421760 [0,1,0,0,0,0|1,1,0]=3 3288 B12R1.371 CC(Cc1ccccc1O)NO Amb28074598 [0,1,0,0,0,0|2,0,0]=3 3289 B12R1.371 CC(Cc1ncccc1Br)NN Amb27173450 [0,1,0,0,0,0|2,0,0]=3 3290 B12R1.371 CCC(=O)Cc1ccccc1Br Amb33534982 [0,1,0,0,0,0|1,0,1]=3 3291 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [0,1,0,0,0,0|2,0,1]=4 3292 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [0,1,0,0,0,0|1,1,1]=4 3293 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [0,1,0,0,0,0|1,1,1]=4 3294 B12R1.371 CCC(=O)Nc1ccccc1Br Amb2222500 [0,1,0,0,0,0|2,0,1]=4 3295 B12R1.371 CCC(=O)Oc1ccccc1Br Amb26609039 [0,1,0,0,0,0|2,0,1]=4 3296 B12R1.371 CCC(Br)Cc1ccncc1Cl Amb28421961 [0,1,0,0,0,0|2,1,0]=4 3297 B12R1.371 CCC(C)Cc1ccccc1O Amb27177732 [0,1,0,0,0,0|2,0,0]=3 3298 B12R1.371 CCC(C)Cc1cnccc1N Amb27954500 [0,1,0,0,0,0|3,0,0]=4 3299 B12R1.371 CCC(C)Nc1ccccc1Br Amb6696460 [0,1,0,0,0,0|2,0,0]=3 3300 B12R1.371 CCC(C)Nc1ccccc1C Amb6701228 [0,1,0,0,0,0|3,0,0]=4 3301 B12R1.371 CCC(C)Nc1ccccc1Cl Amb6696915 [0,1,0,0,0,0|2,1,0]=4 3302 B12R1.371 CCC(C)Nc1ccccc1F Amb6697377 [0,1,0,0,0,0|2,1,0]=4 3303 B12R1.371 CCC(C)Nc1ccccc1I Amb7785642 [0,1,0,0,0,0|2,1,0]=4 3304 B12R1.371 CCC(C)Nc1ccccc1O Amb27760304 [0,1,0,0,0,0|3,0,0]=4 3305 B12R1.371 CCC(C)Nc1ncccc1Br Amb27218032 [0,1,0,0,0,0|3,0,0]=4 3306 B12R1.371 CCC(C)Oc1ccccc1C Amb28364230 [0,1,0,0,0,0|3,0,0]=4 3307 B12R1.371 CCC(C)Oc1ccccc1Cl Amb27175754 [0,1,0,0,0,0|2,1,0]=4 3308 B12R1.371 CCC(C)Oc1ccccc1N Amb9702145 [0,1,0,0,0,0|3,0,0]=4 3309 B12R1.371 CCC(C)Sc1ccccc1Br Amb27835038 [0,1,0,0,0,0|2,0,0]=3 3310 B12R1.371 CCC(Cl)Cc1ccccc1C Amb17477425 [0,1,0,0,0,0|2,0,0]=3 3311 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [0,1,0,0,0,0|1,1,0]=3 3312 B12R1.371 CCC(Cl)Cc1cccnc1N Amb27485211 [0,1,0,0,0,0|3,0,0]=4 3313 B12R1.371 CCC(Cl)Cc1ncccc1Br Amb28410611 [0,1,0,0,0,0|2,0,0]=3 3314 B12R1.371 CCC(N)CN1C=CC=CC1=O Amb18040292 [0,1,0,0,0,0|3,0,0]=4 3315 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [0,1,0,0,0,0|1,0,0]=2 3316 B12R1.371 CCC(N)Cc1ccccc1Br Amb9428862 [0,1,0,0,0,0|1,0,0]=2 3317 B12R1.371 CCC(N)Cc1ccccc1C Amb9428910 [0,1,0,0,0,0|2,0,0]=3 3318 B12R1.371 CCC(N)Cc1ccccc1Cl Amb9428938 [0,1,0,0,0,0|1,1,0]=3 3319 B12R1.371 CCC(N)Cc1ccccc1F Amb9428867 [0,1,0,0,0,0|1,1,0]=3 3320 B12R1.371 CCC(N)Cc1cccnc1C Amb35654000 [0,1,0,0,0,0|3,0,0]=4 3321 B12R1.371 CCC(N)Cc1cccnc1Cl Amb25791112 [0,1,0,0,0,0|2,1,0]=4 3322 B12R1.371 CCC(N)Cc1ccncc1F Amb28077214 [0,1,0,0,0,0|2,1,0]=4 3323 B12R1.371 CCC(N)Cc1ccncc1N Amb27873952 [0,1,0,0,0,0|3,0,0]=4 3324 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,1,0,0,0,0|1,0,0]=2 3325 B12R1.371 CCC(O)Cc1ccccc1C Amb17138581 [0,1,0,0,0,0|2,0,0]=3 3326 B12R1.371 CCC(O)Cc1ccccc1Cl Amb17139101 [0,1,0,0,0,0|1,1,0]=3 3327 B12R1.371 CCC(O)Cc1ccccc1F Amb17138635 [0,1,0,0,0,0|1,1,0]=3 3328 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,1,0,0,0,0|2,0,0]=3 3329 B12R1.371 CCC(O)Sc1ccccc1C Amb22228394 [0,1,0,0,0,0|3,0,0]=4 3330 B12R1.371 CCN(C)Cc1ccccc1Cl Amb28126470 [0,1,0,0,0,0|2,1,0]=4 3331 B12R1.371 CCN(C)Cc1ncccc1Br Amb27417075 [0,1,0,0,0,0|3,0,0]=4 3332 B12R1.371 CCN(N)Cc1ccccc1Br Amb25738572 [0,1,0,0,0,0|2,0,0]=3 3333 B12R1.371 CC[C@@H](C)Cc1ccccc1O Amb28243798 [0,1,0,0,0,0|2,0,0]=3 3334 B12R1.371 CC[C@@H](N)Cc1ccccc1Br Amb27459365 [0,1,0,0,0,0|1,0,0]=2 3335 B12R1.371 CC[C@@H](N)Cc1ccccc1Cl Amb27668323 [0,1,0,0,0,0|1,1,0]=3 3336 B12R1.371 CN(C=O)Cc1ccccc1Br Amb27228720 [0,1,0,0,0,0|3,0,0]=4 3337 B12R1.371 CNC(=N)Cc1ccccc1Br Amb27954483 [0,1,0,0,0,0|0,0,1]=2 3338 B12R1.371 CNC(=N)Cc1ccccc1Cl Amb27165054 [0,1,0,0,0,0|0,1,1]=3 3339 B12R1.371 CNC(=N)Nc1ccccc1I Amb27469580 [0,1,0,0,0,0|1,1,1]=4 3340 B12R1.371 CNC(=O)C[n+]1ccccc1Cl Amb27829236 [0,1,0,0,0,0|1,1,1]=4 3341 B12R1.371 CNC(=O)C[n+]1ccccc1F Amb27946534 [0,1,0,0,0,0|1,1,1]=4 3342 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [0,1,0,0,0,0|0,0,1]=2 3343 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [0,1,0,0,0,0|1,0,1]=3 3344 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [0,1,0,0,0,0|0,1,1]=3 3345 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [0,1,0,0,0,0|0,1,1]=3 3346 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [0,1,0,0,0,0|1,0,1]=3 3347 B12R1.371 CNC(=O)Cc1cccnc1Br Amb27857766 [0,1,0,0,0,0|1,0,1]=3 3348 B12R1.371 CNC(=O)Cc1ncccc1C Amb28067810 [0,1,0,0,0,0|2,0,1]=4 3349 B12R1.371 CNC(=O)Nc1ccccc1Br Amb11316867 [0,1,0,0,0,0|1,0,1]=3 3350 B12R1.371 CNC(=O)Nc1ccccc1Cl Amb4010921 [0,1,0,0,0,0|1,1,1]=4 3351 B12R1.371 CNC(=O)Nc1ccccc1F Amb2444100 [0,1,0,0,0,0|1,1,1]=4 3352 B12R1.371 CNC(=O)Nc1ccccc1I Amb14010753 [0,1,0,0,0,0|1,1,1]=4 3353 B12R1.371 CNC(=O)Nc1ncccc1Br Amb27763210 [0,1,0,0,0,0|2,0,1]=4 3354 B12R1.371 CNC(=O)Oc1ccccc1O Amb18646674 [0,1,0,0,0,0|2,0,1]=4 3355 B12R1.371 CNC(=S)Nc1ccccc1Br Amb1811707 [0,1,0,0,0,0|1,0,1]=3 3356 B12R1.371 CNC(=S)Nc1ccccc1C Amb6855667 [0,1,0,0,0,0|2,0,1]=4 3357 B12R1.371 CNC(=S)Nc1ccccc1Cl Amb1841527 [0,1,0,0,0,0|1,1,1]=4 3358 B12R1.371 CNC(=S)Nc1ccccc1F Amb6514454 [0,1,0,0,0,0|1,1,1]=4 3359 B12R1.371 CNC(=S)Nc1ccccc1N Amb2423166 [0,1,0,0,0,0|2,0,1]=4 3360 B12R1.371 CNC(=S)Nc1ccccc1O Amb28368290 [0,1,0,0,0,0|2,0,1]=4 3361 B12R1.371 CNC(=S)Sc1ccccc1Cl Amb27605821 [0,1,0,0,0,0|1,1,1]=4 3362 B12R1.371 CNC(C)Cc1ccccc1C Amb24271197 [0,1,0,0,0,0|1,0,0]=2 3363 B12R1.371 CNC(C)Cc1ccccc1C Amb5735451 [0,1,0,0,0,0|1,0,0]=2 3364 B12R1.371 CNC(C)Cc1ccccc1I Amb27178924 [0,1,0,0,0,0|0,1,0]=2 3365 B12R1.371 CNC(C)Cc1ccccc1O Amb28456494 [0,1,0,0,0,0|1,0,0]=2 3366 B12R1.371 CNC(C)Cc1ncccc1Br Amb28190371 [0,1,0,0,0,0|1,0,0]=2 3367 B12R1.371 CNC(C)Cc1ncccc1C Amb1995153 [0,1,0,0,0,0|2,0,0]=3 3368 B12R1.371 COC(=O)Cc1ccccc1Br Amb8471030 [0,1,0,0,0,0|1,0,1]=3 3369 B12R1.371 COC(=O)Cc1ccccc1C Amb6357785 [0,1,0,0,0,0|2,0,1]=4 3370 B12R1.371 COC(=O)Cc1ccccc1Cl Amb6365742 [0,1,0,0,0,0|1,1,1]=4 3371 B12R1.371 COC(=O)Cc1ccccc1F Amb6336633 [0,1,0,0,0,0|1,1,1]=4 3372 B12R1.371 COC(=O)Cc1ccccc1I Amb22749395 [0,1,0,0,0,0|1,1,1]=4 3373 B12R1.371 COC(=O)Cc1ccccc1N Amb20623565 [0,1,0,0,0,0|2,0,1]=4 3374 B12R1.371 COC(=O)Cc1ccccc1N Amb8427007 [0,1,0,0,0,0|2,0,1]=4 3375 B12R1.371 COC(=O)Cc1ccccc1O Amb2699823 [0,1,0,0,0,0|2,0,1]=4 3376 B12R1.371 COC(=O)Cc1ccncc1Br Amb22586456 [0,1,0,0,0,0|2,0,1]=4 3377 B12R1.371 COC(=O)Cc1ncccc1Br Amb22263925 [0,1,0,0,0,0|2,0,1]=4 3378 B12R1.371 COC(=O)Nc1ccccc1Br Amb6498257 [0,1,0,0,0,0|2,0,1]=4 3379 B12R1.371 COC(C)CN1C=CC=CC1=O Amb28072405 [0,1,0,0,0,0|3,0,0]=4 3380 B12R1.371 COC(C)Sc1ccccc1O Amb27486157 [0,1,0,0,0,0|3,0,0]=4 3381 B12R1.371 CON(C)Cc1ccccc1C Amb27178942 [0,1,0,0,0,0|3,0,0]=4 3382 B12R1.371 CON(C)Cc1ccccc1F Amb27665165 [0,1,0,0,0,0|2,1,0]=4 3383 B12R1.371 CSC(=S)Nc1ccccc1Br Amb5716126 [0,1,0,0,0,0|2,0,1]=4 3384 B12R1.371 C[C@@H](CN)Cc1ccccc1F Amb33731703 [0,1,0,0,0,0|2,1,0]=4 3385 B12R1.371 C[C@@H](CO)Cc1ccccc1Cl Amb28207131 [0,1,0,0,0,0|2,1,0]=4 3386 B12R1.371 C[C@@H](CO)Cc1ccccc1F Amb26956773 [0,1,0,0,0,0|2,1,0]=4 3387 B12R1.371 C[C@H](CN)Cc1ccccc1F Amb33747137 [0,1,0,0,0,0|2,1,0]=4 3388 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,1,0,0,0,0|2,1,0]=4 3389 B12R1.371 C\C=C(\C)Cc1ccccc1O Amb24380771 [0,1,0,0,0,0|2,0,1]=4 3390 B12R1.371 Cc1ccccc1CC(=O)NN Amb6249209 [0,1,0,0,0,0|2,0,1]=4 3391 B12R1.371 Cc1ccccc1CC(=O)NO Amb6257569 [0,1,0,0,0,0|2,0,1]=4 3392 B12R1.371 Cc1ccccc1CC(Br)C#N Amb17342951 [0,1,0,0,0,0|3,0,0]=4 3393 B12R1.371 Cc1ccccc1CC(C)C#N Amb27149910 [0,1,0,0,0,0|3,0,0]=4 3394 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,1,0,0,0,0|3,0,0]=4 3395 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [0,1,0,0,0,0|3,0,0]=4 3396 B12R1.371 Cc1ccccc1CC(C)CCl Amb28422132 [0,1,0,0,0,0|3,0,0]=4 3397 B12R1.371 Cc1ccccc1CC(C)CN Amb5743837 [0,1,0,0,0,0|3,0,0]=4 3398 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,1,0,0,0,0|3,0,0]=4 3399 B12R1.371 Cc1ccccc1CC(Cl)C#N Amb17204319 [0,1,0,0,0,0|3,0,0]=4 3400 B12R1.371 Cc1ccccc1CC(Cl)C=O Amb17204326 [0,1,0,0,0,0|3,0,0]=4 3401 B12R1.371 Cc1ccccc1CC(F)C=O Amb27251880 [0,1,0,0,0,0|3,0,0]=4 3402 B12R1.371 Cc1ccccc1CC(N)CO Amb17062685 [0,1,0,0,0,0|3,0,0]=4 3403 B12R1.371 Cc1ccccc1CC(N)CO Amb33329338 [0,1,0,0,0,0|3,0,0]=4 3404 B12R1.371 Cc1ccccc1CC(O)C#N Amb28244190 [0,1,0,0,0,0|3,0,0]=4 3405 B12R1.371 Cc1ccccc1CC(O)CN Amb17232545 [0,1,0,0,0,0|3,0,0]=4 3406 B12R1.371 Cc1ccccc1CC(O)CN Amb32661067 [0,1,0,0,0,0|3,0,0]=4 3407 B12R1.371 Cc1ccccc1C[C@@H](C)CN Amb33747733 [0,1,0,0,0,0|3,0,0]=4 3408 B12R1.371 Cc1ccccc1C[C@@H](C)CO Amb33746673 [0,1,0,0,0,0|3,0,0]=4 3409 B12R1.371 Cc1ccccc1C[C@H](C)CN Amb33738932 [0,1,0,0,0,0|3,0,0]=4 3410 B12R1.371 Cc1ccccc1C[C@H](C)CO Amb33738161 [0,1,0,0,0,0|3,0,0]=4 3411 B12R1.371 Cc1ccccc1C[C@H](N)CO Amb26844931 [0,1,0,0,0,0|3,0,0]=4 3412 B12R1.371 N#CC(Br)Cc1ccccc1Cl Amb17349963 [0,1,0,0,0,0|2,1,0]=4 3413 B12R1.371 N#CC(Br)Cc1ccccc1F Amb17344011 [0,1,0,0,0,0|2,1,0]=4 3414 B12R1.371 N#CC(Cl)Cc1ccccc1Br Amb17204671 [0,1,0,0,0,0|2,0,0]=3 3415 B12R1.371 N#CC(Cl)Cc1ccccc1Cl Amb2520868 [0,1,0,0,0,0|2,1,0]=4 3416 B12R1.371 N#CC(Cl)Cc1ccccc1F Amb17204330 [0,1,0,0,0,0|2,1,0]=4 3417 B12R1.371 N#CC(N)Cc1ccccc1Br Amb27635957 [0,1,0,0,0,0|2,0,0]=3 3418 B12R1.371 N#CC(N)Cc1ccccc1Cl Amb23557157 [0,1,0,0,0,0|2,1,0]=4 3419 B12R1.371 N#CC(N)Cc1ccccc1F Amb28243982 [0,1,0,0,0,0|2,1,0]=4 3420 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,1,0,0,0,0|2,0,0]=3 3421 B12R1.371 NC(CO)Cc1ccccc1Cl Amb17062694 [0,1,0,0,0,0|2,1,0]=4 3422 B12R1.371 NC(CO)Cc1ccccc1F Amb17062688 [0,1,0,0,0,0|2,1,0]=4 3423 B12R1.371 NC(CO)Cc1ccccc1O Amb18827210 [0,1,0,0,0,0|3,0,0]=4 3424 B12R1.371 NC(CO)Cc1cccnc1Br Amb27790025 [0,1,0,0,0,0|3,0,0]=4 3425 B12R1.371 NC(CO)Cc1ccncc1Br Amb24542635 [0,1,0,0,0,0|3,0,0]=4 3426 B12R1.371 NC(CO)Cc1ncccc1Br Amb24581707 [0,1,0,0,0,0|3,0,0]=4 3427 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [0,1,0,0,0,0|2,0,1]=4 3428 B12R1.371 NCC(N)Cc1ccccc1F Amb27955290 [0,1,0,0,0,0|2,1,0]=4 3429 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [0,1,0,0,0,0|2,0,0]=3 3430 B12R1.371 NCC(O)Cc1ccccc1Cl Amb17234263 [0,1,0,0,0,0|2,1,0]=4 3431 B12R1.371 NCC(O)Cc1ccccc1Cl Amb32652702 [0,1,0,0,0,0|2,1,0]=4 3432 B12R1.371 NCC(O)Cc1ccccc1F Amb17232700 [0,1,0,0,0,0|2,1,0]=4 3433 B12R1.371 NCC(O)Cc1ccccc1O Amb26883501 [0,1,0,0,0,0|3,0,0]=4 3434 B12R1.371 NCC(O)Cc1cccnc1Br Amb33387857 [0,1,0,0,0,0|3,0,0]=4 3435 B12R1.371 NCC(O)Cc1ccncc1Br Amb33451537 [0,1,0,0,0,0|3,0,0]=4 3436 B12R1.371 NCC(O)Cc1ncccc1Br Amb25144691 [0,1,0,0,0,0|3,0,0]=4 3437 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [0,1,0,0,0,0|1,0,1]=3 3438 B12R1.371 NNC(=O)Cc1ccccc1Cl Amb6573008 [0,1,0,0,0,0|1,1,1]=4 3439 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [0,1,0,0,0,0|1,1,1]=4 3440 B12R1.371 NNC(=O)Cc1ccccc1O Amb32667213 [0,1,0,0,0,0|2,0,1]=4 3441 B12R1.371 NNC(=O)Cc1ccccc1O Amb3988948 [0,1,0,0,0,0|2,0,1]=4 3442 B12R1.371 NNC(=S)Nc1ccccc1Br Amb7771619 [0,1,0,0,0,0|2,0,1]=4 3443 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,1,0,0,0,0|2,1,0]=4 3444 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,1,0,0,0,0|2,1,0]=4 3445 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,1,0,0,0,0|2,1,0]=4 3446 B12R1.371 N\C(Cc1ccccc1Br)=N/O Amb6243809 [0,1,0,0,0,0|1,0,2]=4 3447 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,1,0,0,0,0|3,0,0]=4 3448 B12R1.371 O=C(CBr)Cc1ccccc1Br Amb25951715 [0,1,0,0,0,0|2,0,1]=4 3449 B12R1.371 O=C(CCl)Cc1ccccc1Br Amb33526899 [0,1,0,0,0,0|2,0,1]=4 3450 B12R1.371 O=C(Cc1ccccc1Cl)NO Amb6273362 [0,1,0,0,0,0|1,1,1]=4 3451 B12R1.371 O=C(Cc1ccccc1I)NO Amb28184737 [0,1,0,0,0,0|1,1,1]=4 3452 B12R1.371 O=CC(Cl)Cc1ccccc1Br Amb17204707 [0,1,0,0,0,0|2,0,0]=3 3453 B12R1.371 O=CC(Cl)Cc1ccccc1Cl Amb17204401 [0,1,0,0,0,0|2,1,0]=4 3454 B12R1.371 O=CC(Cl)Cc1ccccc1F Amb17204341 [0,1,0,0,0,0|2,1,0]=4 3455 B12R1.371 OC(CCl)Cc1cccnc1Br Amb35702780 [0,1,0,0,0,0|3,0,0]=4 3456 B12R1.371 Oc1ccccc1CC(Cl)CCl Amb28313629 [0,1,0,0,0,0|3,0,0]=4 3457 B12R1.374 BrCCCc1cc(Br)ccc1I Amb27462500 [0,1,0,0,0,0|2,1,0]=4 3458 B12R1.374 BrCCOc1cc(Br)ccc1Br Amb10068285 [0,1,0,0,0,0|3,0,0]=4 3459 B12R1.374 C#CCCc1cc(Br)ccc1Br Amb33331389 [0,1,0,0,0,0|1,0,1]=3 3460 B12R1.374 C#CCCc1cc(Br)ccc1C Amb33386634 [0,1,0,0,0,0|2,0,1]=4 3461 B12R1.374 C#CCCc1cc(Br)ccc1Cl Amb33386452 [0,1,0,0,0,0|1,1,1]=4 3462 B12R1.374 C#CCCc1cc(Br)ccc1F Amb33114449 [0,1,0,0,0,0|1,1,1]=4 3463 B12R1.374 C#CCCc1cc(Br)ccc1O Amb33333602 [0,1,0,0,0,0|2,0,1]=4 3464 B12R1.374 C#CCCc1cc(Br)cnc1Br Amb33009016 [0,1,0,0,0,0|2,0,1]=4 3465 B12R1.374 C#CCCc1cc(C)ccc1Br Amb33477898 [0,1,0,0,0,0|1,0,1]=3 3466 B12R1.374 C#CCCc1cc(C)ccc1C Amb18117997 [0,1,0,0,0,0|2,0,1]=4 3467 B12R1.374 C#CCCc1cc(C)ccc1Cl Amb33260850 [0,1,0,0,0,0|1,1,1]=4 3468 B12R1.374 C#CCCc1cc(C)ccc1F Amb33270567 [0,1,0,0,0,0|1,1,1]=4 3469 B12R1.374 C#CCCc1cc(C)ccc1O Amb27164666 [0,1,0,0,0,0|2,0,1]=4 3470 B12R1.374 C#CCCc1cc(Cl)ccc1Br Amb33478273 [0,1,0,0,0,0|1,0,1]=3 3471 B12R1.374 C#CCCc1cc(Cl)ccc1O Amb33052698 [0,1,0,0,0,0|2,0,1]=4 3472 B12R1.374 C#CCCc1cc(Cl)ncc1Br Amb33478174 [0,1,0,0,0,0|2,0,1]=4 3473 B12R1.374 C#CCCc1cc(F)ccc1Br Amb33008796 [0,1,0,0,0,0|1,0,1]=3 3474 B12R1.374 C#CCCc1cc(F)ccc1C Amb33199721 [0,1,0,0,0,0|2,0,1]=4 3475 B12R1.374 C#CCCc1cc(F)ccc1Cl Amb33058823 [0,1,0,0,0,0|1,1,1]=4 3476 B12R1.374 C#CCCc1cc(F)ccc1F Amb33267005 [0,1,0,0,0,0|1,1,1]=4 3477 B12R1.374 C#CCCc1cc(F)ccc1O Amb24100511 [0,1,0,0,0,0|2,0,1]=4 3478 B12R1.374 C#CCCc1cc(O)ccc1Br Amb33387004 [0,1,0,0,0,0|1,0,1]=3 3479 B12R1.374 C#CCCc1cc(O)ccc1O Amb33268494 [0,1,0,0,0,0|2,0,1]=4 3480 B12R1.374 C#CCNc1cc(I)ccc1Br Amb27765021 [0,1,0,0,0,0|2,0,1]=4 3481 B12R1.374 C#CCOc1cc(C)ccc1Br Amb35666826 [0,1,0,0,0,0|2,0,1]=4 3482 B12R1.374 C#CCOc1cc(N)ccc1Br Amb27770893 [0,1,0,0,0,0|2,0,1]=4 3483 B12R1.374 C=CCCc1cc(C)ccc1Cl Amb29867188 [0,1,0,0,0,0|1,1,1]=4 3484 B12R1.374 C=CCCc1cc(C)ccc1F Amb30012313 [0,1,0,0,0,0|1,1,1]=4 3485 B12R1.374 C=CCCc1cc(Cl)ccc1Br Amb28460915 [0,1,0,0,0,0|1,0,1]=3 3486 B12R1.374 C=CCCc1cc(Cl)ccc1F Amb28314187 [0,1,0,0,0,0|1,1,1]=4 3487 B12R1.374 C=CCCc1cc(Cl)ccc1I Amb35706094 [0,1,0,0,0,0|1,1,1]=4 3488 B12R1.374 C=CCCc1cc(F)ccc1Br Amb27631371 [0,1,0,0,0,0|1,0,1]=3 3489 B12R1.374 C=CCCc1cc(F)ccc1Cl Amb27784280 [0,1,0,0,0,0|1,1,1]=4 3490 B12R1.374 C=CCNc1cc(I)ccc1Br Amb27983424 [0,1,0,0,0,0|2,0,1]=4 3491 B12R1.374 C=CCOc1cc(C)ccc1Br Amb35663089 [0,1,0,0,0,0|2,0,1]=4 3492 B12R1.374 C=CCOc1cc(F)ccc1Br Amb24605603 [0,1,0,0,0,0|2,0,1]=4 3493 B12R1.374 CCCCC1=C(C)C=CC(=O)N1 Amb27613064 [0,1,0,0,0,0|3,0,0]=4 3494 B12R1.374 CCCCN1C=C(Br)C=CC1=O Amb18404496 [0,1,0,0,0,0|3,0,0]=4 3495 B12R1.374 CCCCN1C=C(C)C=CC1=O Amb18404884 [0,1,0,0,0,0|3,0,0]=4 3496 B12R1.374 CCCCN1C=C(N)C=CC1=O Amb18030068 [0,1,0,0,0,0|3,0,0]=4 3497 B12R1.374 CCCCc1cc(Br)ccc1N Amb27812883 [0,1,0,0,0,0|2,0,0]=3 3498 B12R1.374 CCCCc1cc(Br)cnc1Br Amb27185991 [0,1,0,0,0,0|2,0,0]=3 3499 B12R1.374 CCCCc1cc(C)ccc1O Amb27973016 [0,1,0,0,0,0|2,0,0]=3 3500 B12R1.374 CCCCc1cc(Cl)cnc1F Amb32648146 [0,1,0,0,0,0|2,1,0]=4 3501 B12R1.374 CCCCc1cc(N)ccc1C Amb26961999 [0,1,0,0,0,0|2,0,0]=3 3502 B12R1.374 CCCCc1cc(N)ccc1Cl Amb25843846 [0,1,0,0,0,0|1,1,0]=3 3503 B12R1.374 CCCCc1cc(O)ccc1N Amb27657773 [0,1,0,0,0,0|2,0,0]=3 3504 B12R1.374 CCCCc1cc(O)cnc1C Amb32759498 [0,1,0,0,0,0|3,0,0]=4 3505 B12R1.374 CCCCc1nc(C)ccc1N Amb27143903 [0,1,0,0,0,0|3,0,0]=4 3506 B12R1.374 CCCCc1nc(N)ccc1I Amb26639469 [0,1,0,0,0,0|2,1,0]=4 3507 B12R1.374 CCCNc1cc(Br)ccc1N Amb25738246 [0,1,0,0,0,0|3,0,0]=4 3508 B12R1.374 CCCNc1cc(C)ccc1C Amb4313517 [0,1,0,0,0,0|3,0,0]=4 3509 B12R1.374 CCCNc1cc(C)ccc1N Amb23114177 [0,1,0,0,0,0|3,0,0]=4 3510 B12R1.374 CCCNc1cc(Cl)ccc1C Amb6683517 [0,1,0,0,0,0|3,0,0]=4 3511 B12R1.374 CCCNc1cc(Cl)ccc1Cl Amb6647443 [0,1,0,0,0,0|2,1,0]=4 3512 B12R1.374 CCCNc1cc(Cl)ccc1I Amb30016029 [0,1,0,0,0,0|2,1,0]=4 3513 B12R1.374 CCCNc1cc(Cl)ccc1N Amb26025569 [0,1,0,0,0,0|3,0,0]=4 3514 B12R1.374 CCCNc1cc(Cl)ccc1O Amb27164011 [0,1,0,0,0,0|3,0,0]=4 3515 B12R1.374 CCCNc1cc(F)ccc1Cl Amb28384962 [0,1,0,0,0,0|2,1,0]=4 3516 B12R1.374 CCCNc1cc(F)ccc1F Amb6691519 [0,1,0,0,0,0|2,1,0]=4 3517 B12R1.374 CCCNc1cc(F)ccc1N Amb18989853 [0,1,0,0,0,0|3,0,0]=4 3518 B12R1.374 CCCNc1cc(I)ccc1C Amb27760818 [0,1,0,0,0,0|3,0,0]=4 3519 B12R1.374 CCCNc1nc(C)ccc1Br Amb35676279 [0,1,0,0,0,0|3,0,0]=4 3520 B12R1.374 CCCOc1cc(Br)ccc1F Amb24483694 [0,1,0,0,0,0|2,1,0]=4 3521 B12R1.374 CCCOc1cc(Br)ccc1N Amb24727840 [0,1,0,0,0,0|3,0,0]=4 3522 B12R1.374 CCCOc1cc(C)ccc1Br Amb35663090 [0,1,0,0,0,0|2,0,0]=3 3523 B12R1.374 CCCOc1cc(C)ccc1Cl Amb27466768 [0,1,0,0,0,0|2,1,0]=4 3524 B12R1.374 CCCOc1cc(C)ccc1F Amb21856655 [0,1,0,0,0,0|2,1,0]=4 3525 B12R1.374 CCCOc1cc(C)ccc1N Amb6266710 [0,1,0,0,0,0|3,0,0]=4 3526 B12R1.374 CCCOc1cc(Cl)ccc1N Amb18296228 [0,1,0,0,0,0|3,0,0]=4 3527 B12R1.374 CCCOc1cc(Cl)ccc1O Amb25282670 [0,1,0,0,0,0|3,0,0]=4 3528 B12R1.374 CCCOc1cc(F)ccc1Br Amb27623285 [0,1,0,0,0,0|2,0,0]=3 3529 B12R1.374 CCCOc1cc(F)ccc1N Amb1132322 [0,1,0,0,0,0|3,0,0]=4 3530 B12R1.374 CCCOc1cc(F)ccc1S Amb26651834 [0,1,0,0,0,0|3,0,0]=4 3531 B12R1.374 CCCOc1cc(N)ccc1C Amb9381478 [0,1,0,0,0,0|3,0,0]=4 3532 B12R1.374 CCCOc1cc(N)ccc1Cl Amb18649207 [0,1,0,0,0,0|2,1,0]=4 3533 B12R1.374 CCCOc1cc(N)ccc1N Amb28364725 [0,1,0,0,0,0|3,0,0]=4 3534 B12R1.374 CCCOc1cc(N)ncc1Br Amb27442557 [0,1,0,0,0,0|3,0,0]=4 3535 B12R1.374 CCCOc1cc(O)ccc1Cl Amb26463653 [0,1,0,0,0,0|2,1,0]=4 3536 B12R1.374 CCCOc1cc(O)ccc1N Amb24461245 [0,1,0,0,0,0|3,0,0]=4 3537 B12R1.374 CCCOc1cc(S)ccc1C Amb28399363 [0,1,0,0,0,0|3,0,0]=4 3538 B12R1.374 CCCOc1cc(S)ccc1F Amb25692041 [0,1,0,0,0,0|2,1,0]=4 3539 B12R1.374 CCCSc1cc(Br)ccc1N Amb27794183 [0,1,0,0,0,0|3,0,0]=4 3540 B12R1.374 CCCSc1cc(C)ccc1C Amb27649867 [0,1,0,0,0,0|3,0,0]=4 3541 B12R1.374 CCCSc1cc(Cl)ccc1Cl Amb26038787 [0,1,0,0,0,0|2,1,0]=4 3542 B12R1.374 CCCSc1cc(F)ccc1F Amb28185683 [0,1,0,0,0,0|2,1,0]=4 3543 B12R1.374 CCNCc1cc(Br)ccc1Br Amb27636783 [0,1,0,0,0,0|2,0,0]=3 3544 B12R1.374 CCNCc1cc(Br)ccc1C Amb25743327 [0,1,0,0,0,0|3,0,0]=4 3545 B12R1.374 CCNCc1cc(Br)ccc1F Amb13952066 [0,1,0,0,0,0|2,1,0]=4 3546 B12R1.374 CCNCc1cc(Br)ccc1F Amb6252225 [0,1,0,0,0,0|2,1,0]=4 3547 B12R1.374 CCNCc1cc(Br)ccc1I Amb27439500 [0,1,0,0,0,0|2,1,0]=4 3548 B12R1.374 CCNCc1cc(Br)ccc1N Amb27200279 [0,1,0,0,0,0|3,0,0]=4 3549 B12R1.374 CCNCc1cc(Br)ccc1O Amb17144307 [0,1,0,0,0,0|3,0,0]=4 3550 B12R1.374 CCNCc1cc(C)ccc1Br Amb27834140 [0,1,0,0,0,0|2,0,0]=3 3551 B12R1.374 CCNCc1cc(C)ccc1C Amb8841260 [0,1,0,0,0,0|3,0,0]=4 3552 B12R1.374 CCNCc1cc(C)ccc1O Amb9776241 [0,1,0,0,0,0|3,0,0]=4 3553 B12R1.374 CCNCc1cc(Cl)ccc1C Amb27656730 [0,1,0,0,0,0|3,0,0]=4 3554 B12R1.374 CCNCc1cc(Cl)ccc1O Amb6261308 [0,1,0,0,0,0|3,0,0]=4 3555 B12R1.374 CCNCc1cc(F)ccc1C Amb19002202 [0,1,0,0,0,0|3,0,0]=4 3556 B12R1.374 CCNCc1cc(F)ccc1F Amb8853695 [0,1,0,0,0,0|2,1,0]=4 3557 B12R1.374 CCNCc1cc(F)ccc1O Amb18275908 [0,1,0,0,0,0|3,0,0]=4 3558 B12R1.374 CCNCc1cc(I)ccc1Br Amb27867308 [0,1,0,0,0,0|2,0,0]=3 3559 B12R1.374 CCNCc1cc(I)ccc1F Amb27426763 [0,1,0,0,0,0|2,1,0]=4 3560 B12R1.374 CCNCc1cc(N)ccc1F Amb28249253 [0,1,0,0,0,0|2,1,0]=4 3561 B12R1.374 CCNCc1cc(N)ccc1O Amb17613931 [0,1,0,0,0,0|3,0,0]=4 3562 B12R1.374 CCNCc1cc(O)ccc1Br Amb21926786 [0,1,0,0,0,0|2,0,0]=3 3563 B12R1.374 CCNCc1cc(O)ccc1C Amb35664909 [0,1,0,0,0,0|3,0,0]=4 3564 B12R1.374 CCOCc1cc(Br)ccc1C Amb27956158 [0,1,0,0,0,0|3,0,0]=4 3565 B12R1.374 CCOCc1cc(Br)ccc1F Amb22900162 [0,1,0,0,0,0|2,1,0]=4 3566 B12R1.374 CCOCc1cc(Cl)ccc1I Amb35697894 [0,1,0,0,0,0|2,1,0]=4 3567 B12R1.374 CCOCc1cc(Cl)ccc1N Amb27483601 [0,1,0,0,0,0|3,0,0]=4 3568 B12R1.374 CCOCc1cc(F)ccc1Br Amb22900140 [0,1,0,0,0,0|2,0,0]=3 3569 B12R1.374 CCSCc1cc(C)ccc1C Amb26615679 [0,1,0,0,0,0|3,0,0]=4 3570 B12R1.374 CCSCc1cc(Cl)ccc1I Amb29864007 [0,1,0,0,0,0|2,1,0]=4 3571 B12R1.374 CCSCc1cc(F)ccc1Br Amb26957752 [0,1,0,0,0,0|2,0,0]=3 3572 B12R1.374 CCSCc1cc(F)ccc1C Amb27589578 [0,1,0,0,0,0|3,0,0]=4 3573 B12R1.374 CCSCc1cc(F)ccc1F Amb26327729 [0,1,0,0,0,0|2,1,0]=4 3574 B12R1.374 CCSCc1cc(F)ccc1N Amb9302803 [0,1,0,0,0,0|3,0,0]=4 3575 B12R1.374 CNCCN1C=C(C)C=CC1=O Amb27623755 [0,1,0,0,0,0|2,0,0]=3 3576 B12R1.374 CNCCN1C=C(Cl)C=NC1=O Amb27248875 [0,1,0,0,0,0|3,0,0]=4 3577 B12R1.374 CNCCc1cc(Br)ccc1C Amb26552634 [0,1,0,0,0,0|1,0,0]=2 3578 B12R1.374 CNCCc1cc(Br)ccc1Cl Amb25159743 [0,1,0,0,0,0|0,1,0]=2 3579 B12R1.374 CNCCc1cc(Br)ccc1F Amb18299520 [0,1,0,0,0,0|0,1,0]=2 3580 B12R1.374 CNCCc1cc(Br)ccc1O Amb33333200 [0,1,0,0,0,0|1,0,0]=2 3581 B12R1.374 CNCCc1cc(Br)cnc1Cl Amb33009437 [0,1,0,0,0,0|1,1,0]=3 3582 B12R1.374 CNCCc1cc(Br)cnc1F Amb33477701 [0,1,0,0,0,0|1,1,0]=3 3583 B12R1.374 CNCCc1cc(C)ccc1Br Amb28292457 [0,1,0,0,0,0|0,0,0]=1 3584 B12R1.374 CNCCc1cc(C)ccc1C Amb17085230 [0,1,0,0,0,0|1,0,0]=2 3585 B12R1.374 CNCCc1cc(C)ccc1Cl Amb26969992 [0,1,0,0,0,0|0,1,0]=2 3586 B12R1.374 CNCCc1cc(C)ccc1F Amb18301316 [0,1,0,0,0,0|0,1,0]=2 3587 B12R1.374 CNCCc1cc(C)ccc1O Amb18940457 [0,1,0,0,0,0|1,0,0]=2 3588 B12R1.374 CNCCc1cc(C)nnc1C Amb27962661 [0,1,0,0,0,0|3,0,0]=4 3589 B12R1.374 CNCCc1cc(Cl)ccc1Br Amb27817336 [0,1,0,0,0,0|0,0,0]=1 3590 B12R1.374 CNCCc1cc(Cl)ccc1C Amb25878157 [0,1,0,0,0,0|1,0,0]=2 3591 B12R1.374 CNCCc1cc(Cl)ccc1Cl Amb26503159 [0,1,0,0,0,0|0,1,0]=2 3592 B12R1.374 CNCCc1cc(Cl)ccc1F Amb18243883 [0,1,0,0,0,0|0,1,0]=2 3593 B12R1.374 CNCCc1cc(Cl)ccc1I Amb29864289 [0,1,0,0,0,0|0,1,0]=2 3594 B12R1.374 CNCCc1cc(Cl)ccc1O Amb18939315 [0,1,0,0,0,0|1,0,0]=2 3595 B12R1.374 CNCCc1cc(Cl)cnc1F Amb33257190 [0,1,0,0,0,0|1,1,0]=3 3596 B12R1.374 CNCCc1cc(Cl)ncc1Br Amb33477810 [0,1,0,0,0,0|1,0,0]=2 3597 B12R1.374 CNCCc1cc(Cl)nnc1Cl Amb33258540 [0,1,0,0,0,0|2,1,0]=4 3598 B12R1.374 CNCCc1cc(F)ccc1Br Amb18299508 [0,1,0,0,0,0|0,0,0]=1 3599 B12R1.374 CNCCc1cc(F)ccc1C Amb18301289 [0,1,0,0,0,0|1,0,0]=2 3600 B12R1.374 CNCCc1cc(F)ccc1Cl Amb26323416 [0,1,0,0,0,0|0,1,0]=2 3601 B12R1.374 CNCCc1cc(F)ccc1F Amb18993055 [0,1,0,0,0,0|0,1,0]=2 3602 B12R1.374 CNCCc1cc(F)ccc1O Amb18275939 [0,1,0,0,0,0|1,0,0]=2 3603 B12R1.374 CNCCc1cc(O)ccc1Br Amb25283021 [0,1,0,0,0,0|0,0,0]=1 3604 B12R1.374 CNCCc1cc(O)ccc1C Amb26058176 [0,1,0,0,0,0|1,0,0]=2 3605 B12R1.374 CNCCc1cc(O)ccc1Cl Amb24684086 [0,1,0,0,0,0|0,1,0]=2 3606 B12R1.374 CNCCc1cc(O)ccc1F Amb26883675 [0,1,0,0,0,0|0,1,0]=2 3607 B12R1.374 CNCCc1cc(O)ccc1O Amb27658706 [0,1,0,0,0,0|1,0,0]=2 3608 B12R1.374 COCCN1C=C(Br)C=CC1=O Amb18404572 [0,1,0,0,0,0|3,0,0]=4 3609 B12R1.374 COCCN1C=C(Cl)C=CC1=O Amb18405168 [0,1,0,0,0,0|3,0,0]=4 3610 B12R1.374 COCCN1C=C(N)C=CC1=O Amb18288793 [0,1,0,0,0,0|3,0,0]=4 3611 B12R1.374 COCCN1C=C(N)C=CC1=O Amb19514339 [0,1,0,0,0,0|3,0,0]=4 3612 B12R1.374 COCCc1cc(O)ccc1N Amb28397614 [0,1,0,0,0,0|2,0,0]=3 3613 B12R1.374 COCOc1cc(Br)ccc1C Amb26506766 [0,1,0,0,0,0|3,0,0]=4 3614 B12R1.374 COCOc1cc(Br)ccc1Cl Amb27247650 [0,1,0,0,0,0|2,1,0]=4 3615 B12R1.374 COCOc1cc(Br)ccc1F Amb27255632 [0,1,0,0,0,0|2,1,0]=4 3616 B12R1.374 COCOc1cc(Br)ccc1O Amb35788330 [0,1,0,0,0,0|3,0,0]=4 3617 B12R1.374 COCOc1cc(C)ccc1Br Amb30016168 [0,1,0,0,0,0|2,0,0]=3 3618 B12R1.374 COCOc1cc(Cl)ccc1Cl Amb27948670 [0,1,0,0,0,0|2,1,0]=4 3619 B12R1.374 COCOc1cc(Cl)ccc1F Amb28138338 [0,1,0,0,0,0|2,1,0]=4 3620 B12R1.374 COCOc1cc(Cl)ccc1N Amb27662698 [0,1,0,0,0,0|3,0,0]=4 3621 B12R1.374 COCOc1cc(Cl)cnc1Br Amb24758901 [0,1,0,0,0,0|3,0,0]=4 3622 B12R1.374 COCOc1cc(F)ccc1Br Amb21856392 [0,1,0,0,0,0|2,0,0]=3 3623 B12R1.374 COCOc1cc(F)ccc1C Amb27264425 [0,1,0,0,0,0|3,0,0]=4 3624 B12R1.374 COCOc1cc(F)ccc1Cl Amb26332127 [0,1,0,0,0,0|2,1,0]=4 3625 B12R1.374 COCOc1cc(F)ccc1F Amb10607090 [0,1,0,0,0,0|2,1,0]=4 3626 B12R1.374 COCOc1cc(N)ccc1Br Amb27459422 [0,1,0,0,0,0|2,0,0]=3 3627 B12R1.374 COCSc1cc(Cl)ccc1F Amb27764603 [0,1,0,0,0,0|2,1,0]=4 3628 B12R1.374 COCSc1cc(F)ccc1N Amb27949708 [0,1,0,0,0,0|3,0,0]=4 3629 B12R1.374 COCSc1cc(N)ccc1Cl Amb27268147 [0,1,0,0,0,0|2,1,0]=4 3630 B12R1.374 CONCc1cc(Br)ccc1C Amb27390737 [0,1,0,0,0,0|3,0,0]=4 3631 B12R1.374 CONCc1cc(Br)ccc1F Amb25882651 [0,1,0,0,0,0|2,1,0]=4 3632 B12R1.374 CONCc1cc(Br)ccc1O Amb27777130 [0,1,0,0,0,0|3,0,0]=4 3633 B12R1.374 CONCc1cc(C)ccc1F Amb27644210 [0,1,0,0,0,0|2,1,0]=4 3634 B12R1.374 CONCc1cc(Cl)ccc1Cl Amb27624981 [0,1,0,0,0,0|2,1,0]=4 3635 B12R1.374 CONCc1cc(Cl)ccc1I Amb35706079 [0,1,0,0,0,0|2,1,0]=4 3636 B12R1.374 CONCc1cc(F)ccc1F Amb24484289 [0,1,0,0,0,0|2,1,0]=4 3637 B12R1.374 CONCc1cc(F)ccc1O Amb27984515 [0,1,0,0,0,0|3,0,0]=4 3638 B12R1.374 CSCCN1C=C(N)C=CC1=O Amb18290078 [0,1,0,0,0,0|3,0,0]=4 3639 B12R1.374 CSCCc1cc(C)cnc1N Amb28137492 [0,1,0,0,0,0|3,0,0]=4 3640 B12R1.374 CSCOc1cc(C)ccc1I Amb27261268 [0,1,0,0,0,0|2,1,0]=4 3641 B12R1.374 CSCSc1cc(Cl)ccc1Cl Amb4010848 [0,1,0,0,0,0|2,1,0]=4 3642 B12R1.374 CSCSc1cc(Cl)ccc1F Amb27442664 [0,1,0,0,0,0|2,1,0]=4 3643 B12R1.374 C\C=C\Cc1cc(C)ccc1O Amb26344517 [0,1,0,0,0,0|2,0,1]=4 3644 B12R1.374 C\C=C\Cc1cc(N)ccc1O Amb24341889 [0,1,0,0,0,0|2,0,1]=4 3645 B12R1.374 C\C=C\Cc1cc(O)ccc1O Amb26555817 [0,1,0,0,0,0|2,0,1]=4 3646 B12R1.374 Cc1ccc(Br)c(CCC#N)c1 Amb28286751 [0,1,0,0,0,0|2,0,0]=3 3647 B12R1.374 Cc1ccc(Br)c(CCC=O)c1 Amb28187072 [0,1,0,0,0,0|2,0,0]=3 3648 B12R1.374 Cc1ccc(Br)c(CCCBr)c1 Amb26645598 [0,1,0,0,0,0|2,0,0]=3 3649 B12R1.374 Cc1ccc(Br)c(CCCCl)c1 Amb28196523 [0,1,0,0,0,0|2,0,0]=3 3650 B12R1.374 Cc1ccc(Br)c(CCCN)c1 Amb26605852 [0,1,0,0,0,0|2,0,0]=3 3651 B12R1.374 Cc1ccc(Br)c(CCCO)c1 Amb33477903 [0,1,0,0,0,0|2,0,0]=3 3652 B12R1.374 Cc1ccc(Br)c(CCCS)c1 Amb33477913 [0,1,0,0,0,0|2,0,0]=3 3653 B12R1.374 Cc1ccc(Br)c(CCON)c1 Amb33477508 [0,1,0,0,0,0|2,0,0]=3 3654 B12R1.374 Cc1ccc(Br)c(CN=C=O)c1 Amb33477232 [0,1,0,0,0,0|3,0,0]=4 3655 B12R1.374 Cc1ccc(Br)c(CN=[N+]=[N-])c1 Amb33227839 [0,1,0,0,0,0|2,0,1]=4 3656 B12R1.374 Cc1ccc(Br)c(NCC#N)c1 Amb27255872 [0,1,0,0,0,0|3,0,0]=4 3657 B12R1.374 Cc1ccc(Br)c(NCCO)c1 Amb27599653 [0,1,0,0,0,0|3,0,0]=4 3658 B12R1.374 Cc1ccc(Br)c(OCC#N)c1 Amb35663088 [0,1,0,0,0,0|3,0,0]=4 3659 B12R1.374 Cc1ccc(Br)c(OCC=O)c1 Amb35666597 [0,1,0,0,0,0|3,0,0]=4 3660 B12R1.374 Cc1ccc(Br)c(OCCBr)c1 Amb35602464 [0,1,0,0,0,0|3,0,0]=4 3661 B12R1.374 Cc1ccc(Br)c(OCCCl)c1 Amb35602463 [0,1,0,0,0,0|3,0,0]=4 3662 B12R1.374 Cc1ccc(Br)c(OCCF)c1 Amb35663354 [0,1,0,0,0,0|3,0,0]=4 3663 B12R1.374 Cc1ccc(Br)c(OCCN)c1 Amb27166651 [0,1,0,0,0,0|3,0,0]=4 3664 B12R1.374 Cc1ccc(Br)c(OCCO)c1 Amb30016163 [0,1,0,0,0,0|3,0,0]=4 3665 B12R1.374 Cc1ccc(Br)c(OCCS)c1 Amb35664907 [0,1,0,0,0,0|3,0,0]=4 3666 B12R1.374 Cc1ccc(Br)cc1CCC#N Amb25701944 [0,1,0,0,0,0|3,0,0]=4 3667 B12R1.374 Cc1ccc(Br)cc1CCC=O Amb27209546 [0,1,0,0,0,0|3,0,0]=4 3668 B12R1.374 Cc1ccc(Br)cc1CCCBr Amb26951927 [0,1,0,0,0,0|3,0,0]=4 3669 B12R1.374 Cc1ccc(Br)cc1CCCCl Amb26846546 [0,1,0,0,0,0|3,0,0]=4 3670 B12R1.374 Cc1ccc(Br)cc1CCCN Amb26970083 [0,1,0,0,0,0|3,0,0]=4 3671 B12R1.374 Cc1ccc(Br)cc1CCCO Amb28318384 [0,1,0,0,0,0|3,0,0]=4 3672 B12R1.374 Cc1ccc(Br)cc1CCCS Amb25036393 [0,1,0,0,0,0|3,0,0]=4 3673 B12R1.374 Cc1ccc(Br)cc1CCON Amb28048103 [0,1,0,0,0,0|3,0,0]=4 3674 B12R1.374 Cc1ccc(C)c(CCC#N)c1 Amb17204301 [0,1,0,0,0,0|3,0,0]=4 3675 B12R1.374 Cc1ccc(C)c(CCC=O)c1 Amb18798123 [0,1,0,0,0,0|3,0,0]=4 3676 B12R1.374 Cc1ccc(C)c(CCCBr)c1 Amb24593678 [0,1,0,0,0,0|3,0,0]=4 3677 B12R1.374 Cc1ccc(C)c(CCCCl)c1 Amb18325129 [0,1,0,0,0,0|3,0,0]=4 3678 B12R1.374 Cc1ccc(C)c(CCCN)c1 Amb17204307 [0,1,0,0,0,0|3,0,0]=4 3679 B12R1.374 Cc1ccc(C)c(CCCO)c1 Amb17400156 [0,1,0,0,0,0|3,0,0]=4 3680 B12R1.374 Cc1ccc(C)c(CCCS)c1 Amb27147594 [0,1,0,0,0,0|3,0,0]=4 3681 B12R1.374 Cc1ccc(C)c(CCNN)c1 Amb17400164 [0,1,0,0,0,0|2,0,0]=3 3682 B12R1.374 Cc1ccc(C)c(CCON)c1 Amb33422608 [0,1,0,0,0,0|3,0,0]=4 3683 B12R1.374 Cc1ccc(Cl)c(CCC#N)c1 Amb25376438 [0,1,0,0,0,0|2,1,0]=4 3684 B12R1.374 Cc1ccc(Cl)c(CCC=O)c1 Amb27471041 [0,1,0,0,0,0|2,1,0]=4 3685 B12R1.374 Cc1ccc(Cl)c(CCCBr)c1 Amb28458592 [0,1,0,0,0,0|2,1,0]=4 3686 B12R1.374 Cc1ccc(Cl)c(CCCCl)c1 Amb25242993 [0,1,0,0,0,0|2,1,0]=4 3687 B12R1.374 Cc1ccc(Cl)c(CCCN)c1 Amb18909370 [0,1,0,0,0,0|2,1,0]=4 3688 B12R1.374 Cc1ccc(Cl)c(CCCO)c1 Amb25074743 [0,1,0,0,0,0|2,1,0]=4 3689 B12R1.374 Cc1ccc(Cl)c(CCCS)c1 Amb33413736 [0,1,0,0,0,0|2,1,0]=4 3690 B12R1.374 Cc1ccc(Cl)c(CCON)c1 Amb33260497 [0,1,0,0,0,0|2,1,0]=4 3691 B12R1.374 Cc1ccc(Cl)cc1CCC#N Amb17204323 [0,1,0,0,0,0|3,0,0]=4 3692 B12R1.374 Cc1ccc(Cl)cc1CCC=O Amb18564227 [0,1,0,0,0,0|3,0,0]=4 3693 B12R1.374 Cc1ccc(Cl)cc1CCCBr Amb24615762 [0,1,0,0,0,0|3,0,0]=4 3694 B12R1.374 Cc1ccc(Cl)cc1CCCCl Amb25952144 [0,1,0,0,0,0|3,0,0]=4 3695 B12R1.374 Cc1ccc(Cl)cc1CCCN Amb17204336 [0,1,0,0,0,0|3,0,0]=4 3696 B12R1.374 Cc1ccc(F)c(CCC#N)c1 Amb26016373 [0,1,0,0,0,0|2,1,0]=4 3697 B12R1.374 Cc1ccc(F)c(CCC=O)c1 Amb25775656 [0,1,0,0,0,0|2,1,0]=4 3698 B12R1.374 Cc1ccc(F)c(CCCBr)c1 Amb25876331 [0,1,0,0,0,0|2,1,0]=4 3699 B12R1.374 Cc1ccc(F)c(CCCCl)c1 Amb25250611 [0,1,0,0,0,0|2,1,0]=4 3700 B12R1.374 Cc1ccc(F)c(CCCN)c1 Amb28047637 [0,1,0,0,0,0|2,1,0]=4 3701 B12R1.374 Cc1ccc(F)c(CCCO)c1 Amb25148634 [0,1,0,0,0,0|2,1,0]=4 3702 B12R1.374 Cc1ccc(F)c(CCCS)c1 Amb33270316 [0,1,0,0,0,0|2,1,0]=4 3703 B12R1.374 Cc1ccc(F)c(CCON)c1 Amb33271319 [0,1,0,0,0,0|2,1,0]=4 3704 B12R1.374 Cc1ccc(F)cc1CCC#N Amb25738354 [0,1,0,0,0,0|3,0,0]=4 3705 B12R1.374 Cc1ccc(F)cc1CCC=O Amb26860965 [0,1,0,0,0,0|3,0,0]=4 3706 B12R1.374 Cc1ccc(F)cc1CCCBr Amb26061387 [0,1,0,0,0,0|3,0,0]=4 3707 B12R1.374 Cc1ccc(F)cc1CCCCl Amb26330814 [0,1,0,0,0,0|3,0,0]=4 3708 B12R1.374 Cc1ccc(F)cc1CCCN Amb27592446 [0,1,0,0,0,0|3,0,0]=4 3709 B12R1.374 Cc1ccc(F)cc1CCCO Amb25886854 [0,1,0,0,0,0|3,0,0]=4 3710 B12R1.374 Cc1ccc(F)cc1CCCS Amb33199386 [0,1,0,0,0,0|3,0,0]=4 3711 B12R1.374 Cc1ccc(F)cc1CCNN Amb28457890 [0,1,0,0,0,0|2,0,0]=3 3712 B12R1.374 Cc1ccc(F)cc1CCON Amb33200105 [0,1,0,0,0,0|3,0,0]=4 3713 B12R1.374 Cc1ccc(I)c(CCC=O)c1 Amb27851427 [0,1,0,0,0,0|2,1,0]=4 3714 B12R1.374 Cc1ccc(I)c(CCCBr)c1 Amb27654240 [0,1,0,0,0,0|2,1,0]=4 3715 B12R1.374 Cc1ccc(I)cc1CCC#N Amb27798702 [0,1,0,0,0,0|3,0,0]=4 3716 B12R1.374 Cc1ccc(I)cc1CCCBr Amb26621066 [0,1,0,0,0,0|3,0,0]=4 3717 B12R1.374 Cc1ccc(I)cc1CCCCl Amb25959093 [0,1,0,0,0,0|3,0,0]=4 3718 B12R1.374 Cc1ccc(N)c(CCC#N)c1 Amb27615829 [0,1,0,0,0,0|3,0,0]=4 3719 B12R1.374 Cc1ccc(N)c(CCCBr)c1 Amb25952097 [0,1,0,0,0,0|3,0,0]=4 3720 B12R1.374 Cc1ccc(N)c(CCCCl)c1 Amb27616077 [0,1,0,0,0,0|3,0,0]=4 3721 B12R1.374 Cc1ccc(N)cc1CCC#N Amb26647304 [0,1,0,0,0,0|3,0,0]=4 3722 B12R1.374 Cc1ccc(N)cc1CCCBr Amb27616076 [0,1,0,0,0,0|3,0,0]=4 3723 B12R1.374 Cc1ccc(O)c(CCC#N)c1 Amb25773347 [0,1,0,0,0,0|3,0,0]=4 3724 B12R1.374 Cc1ccc(O)c(CCC=O)c1 Amb24527959 [0,1,0,0,0,0|3,0,0]=4 3725 B12R1.374 Cc1ccc(O)c(CCCBr)c1 Amb24558916 [0,1,0,0,0,0|3,0,0]=4 3726 B12R1.374 Cc1ccc(O)c(CCCCl)c1 Amb27200457 [0,1,0,0,0,0|3,0,0]=4 3727 B12R1.374 Cc1ccc(O)c(CCCN)c1 Amb18552860 [0,1,0,0,0,0|3,0,0]=4 3728 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [0,1,0,0,0,0|3,0,0]=4 3729 B12R1.374 Cc1ccc(O)c(CCCS)c1 Amb33269437 [0,1,0,0,0,0|3,0,0]=4 3730 B12R1.374 Cc1ccc(O)c(CCON)c1 Amb33268997 [0,1,0,0,0,0|3,0,0]=4 3731 B12R1.374 Cc1ccc(O)cc1CCC#N Amb27438025 [0,1,0,0,0,0|3,0,0]=4 3732 B12R1.374 Cc1ccc(O)cc1CCCBr Amb28326332 [0,1,0,0,0,0|3,0,0]=4 3733 B12R1.374 Cc1ccc(O)cc1CCCCl Amb27965623 [0,1,0,0,0,0|3,0,0]=4 3734 B12R1.374 Cc1ccc(O)cc1CCCN Amb25777725 [0,1,0,0,0,0|3,0,0]=4 3735 B12R1.374 Cc1ccc(S)c(CCC#N)c1 Amb27209134 [0,1,0,0,0,0|3,0,0]=4 3736 B12R1.374 Cc1ccc(S)c(CCCBr)c1 Amb27624764 [0,1,0,0,0,0|3,0,0]=4 3737 B12R1.374 Cc1ccc(S)c(CCCCl)c1 Amb27246556 [0,1,0,0,0,0|3,0,0]=4 3738 B12R1.374 Cc1ccc(S)cc1CCCBr Amb25920102 [0,1,0,0,0,0|3,0,0]=4 3739 B12R1.374 Cc1ccc(S)cc1CCCCl Amb24610834 [0,1,0,0,0,0|3,0,0]=4 3740 B12R1.374 ClCCCc1cc(Br)ccc1Br Amb26938883 [0,1,0,0,0,0|2,0,0]=3 3741 B12R1.374 ClCCCc1cc(Br)ccc1Cl Amb27442173 [0,1,0,0,0,0|2,1,0]=4 3742 B12R1.374 ClCCCc1cc(Cl)ccc1Br Amb25714131 [0,1,0,0,0,0|2,0,0]=3 3743 B12R1.374 ClCCCc1cc(Cl)ccc1Cl Amb26079912 [0,1,0,0,0,0|2,1,0]=4 3744 B12R1.374 ClCCCc1cc(Cl)ccc1I Amb26617928 [0,1,0,0,0,0|2,1,0]=4 3745 B12R1.374 ClCCCc1cc(I)ccc1Br Amb26532857 [0,1,0,0,0,0|2,0,0]=3 3746 B12R1.374 Clc1ccc(Br)c(CCCBr)c1 Amb25984343 [0,1,0,0,0,0|2,0,0]=3 3747 B12R1.374 Clc1ccc(Br)cc1CCCBr Amb27633998 [0,1,0,0,0,0|2,1,0]=4 3748 B12R1.374 Clc1ccc(Cl)c(CCCBr)c1 Amb26926828 [0,1,0,0,0,0|2,1,0]=4 3749 B12R1.374 Clc1ccc(I)c(CCCBr)c1 Amb26896800 [0,1,0,0,0,0|2,1,0]=4 3750 B12R1.374 FCCNc1cc(F)ccc1Br Amb27662624 [0,1,0,0,0,0|3,0,0]=4 3751 B12R1.374 FCCNc1cc(I)ccc1Br Amb28119464 [0,1,0,0,0,0|3,0,0]=4 3752 B12R1.374 FCCOc1cc(F)ccc1Br Amb27753288 [0,1,0,0,0,0|3,0,0]=4 3753 B12R1.374 Fc1ccc(Br)c(CCCBr)c1 Amb26840983 [0,1,0,0,0,0|2,0,0]=3 3754 B12R1.374 Fc1ccc(Br)c(CCCCl)c1 Amb24341770 [0,1,0,0,0,0|2,0,0]=3 3755 B12R1.374 Fc1ccc(Br)c(CCCS)c1 Amb33008797 [0,1,0,0,0,0|2,0,0]=3 3756 B12R1.374 Fc1ccc(Br)cc1CCCBr Amb25204237 [0,1,0,0,0,0|2,1,0]=4 3757 B12R1.374 Fc1ccc(Br)cc1CCCCl Amb28069965 [0,1,0,0,0,0|2,1,0]=4 3758 B12R1.374 Fc1ccc(Br)cc1CCCS Amb25778866 [0,1,0,0,0,0|2,1,0]=4 3759 B12R1.374 Fc1ccc(Cl)c(CCCBr)c1 Amb26410622 [0,1,0,0,0,0|2,1,0]=4 3760 B12R1.374 Fc1ccc(Cl)c(CCCCl)c1 Amb25796501 [0,1,0,0,0,0|2,1,0]=4 3761 B12R1.374 Fc1ccc(Cl)c(CCCS)c1 Amb33059181 [0,1,0,0,0,0|2,1,0]=4 3762 B12R1.374 Fc1ccc(Cl)cc1CCCBr Amb24441885 [0,1,0,0,0,0|2,1,0]=4 3763 B12R1.374 Fc1ccc(Cl)cc1CCCCl Amb26607500 [0,1,0,0,0,0|2,1,0]=4 3764 B12R1.374 Fc1ccc(Cl)cc1CCCS Amb28205387 [0,1,0,0,0,0|2,1,0]=4 3765 B12R1.374 Fc1ccc(F)c(CCCBr)c1 Amb24439123 [0,1,0,0,0,0|2,1,0]=4 3766 B12R1.374 Fc1ccc(F)c(CCCCl)c1 Amb19073201 [0,1,0,0,0,0|2,1,0]=4 3767 B12R1.374 Fc1ccc(F)c(CCCS)c1 Amb26035320 [0,1,0,0,0,0|2,1,0]=4 3768 B12R1.374 Fc1ccc(I)c(CCCBr)c1 Amb27439355 [0,1,0,0,0,0|2,1,0]=4 3769 B12R1.374 Fc1ccc(I)cc1CCCCl Amb27800287 [0,1,0,0,0,0|2,1,0]=4 3770 B12R1.374 Fc1ccc(S)cc1CCCBr Amb27263039 [0,1,0,0,0,0|2,1,0]=4 3771 B12R1.374 Fc1ccc(S)cc1CCCCl Amb27622872 [0,1,0,0,0,0|2,1,0]=4 3772 B12R1.374 N#CCCc1cc(Br)ccc1Br Amb25248926 [0,1,0,0,0,0|2,0,0]=3 3773 B12R1.374 N#CCCc1cc(Br)ccc1Cl Amb28323418 [0,1,0,0,0,0|2,1,0]=4 3774 B12R1.374 N#CCCc1cc(Br)ccc1O Amb26628165 [0,1,0,0,0,0|3,0,0]=4 3775 B12R1.374 N#CCCc1cc(Br)ccc1S Amb27613915 [0,1,0,0,0,0|3,0,0]=4 3776 B12R1.374 N#CCCc1cc(Br)cnc1Br Amb33008834 [0,1,0,0,0,0|3,0,0]=4 3777 B12R1.374 N#CCCc1cc(Cl)ccc1Br Amb26376281 [0,1,0,0,0,0|2,0,0]=3 3778 B12R1.374 N#CCCc1cc(Cl)ccc1Cl Amb17204386 [0,1,0,0,0,0|2,1,0]=4 3779 B12R1.374 N#CCCc1cc(Cl)ccc1F Amb18863064 [0,1,0,0,0,0|2,1,0]=4 3780 B12R1.374 N#CCCc1cc(Cl)ccc1O Amb24679559 [0,1,0,0,0,0|3,0,0]=4 3781 B12R1.374 N#CCCc1cc(Cl)ncc1Br Amb33477848 [0,1,0,0,0,0|3,0,0]=4 3782 B12R1.374 N#CCCc1cc(F)ccc1Br Amb26040484 [0,1,0,0,0,0|2,0,0]=3 3783 B12R1.374 N#CCCc1cc(F)ccc1Cl Amb26867212 [0,1,0,0,0,0|2,1,0]=4 3784 B12R1.374 N#CCCc1cc(F)ccc1F Amb18798745 [0,1,0,0,0,0|2,1,0]=4 3785 B12R1.374 N#CCCc1cc(F)ccc1O Amb27624792 [0,1,0,0,0,0|3,0,0]=4 3786 B12R1.374 N#CCCc1cc(I)ccc1Cl Amb27795075 [0,1,0,0,0,0|2,1,0]=4 3787 B12R1.374 N#CCCc1cc(I)ccc1I Amb27877058 [0,1,0,0,0,0|2,1,0]=4 3788 B12R1.374 N#CCCc1cc(I)ccc1O Amb27204224 [0,1,0,0,0,0|3,0,0]=4 3789 B12R1.374 N#CCCc1cc(N)ccc1F Amb27789045 [0,1,0,0,0,0|2,1,0]=4 3790 B12R1.374 N#CCCc1cc(O)ccc1Br Amb24586510 [0,1,0,0,0,0|2,0,0]=3 3791 B12R1.374 N#CCCc1cc(O)ccc1Cl Amb27966238 [0,1,0,0,0,0|2,1,0]=4 3792 B12R1.374 N#CCCc1cc(O)ccc1O Amb27616210 [0,1,0,0,0,0|3,0,0]=4 3793 B12R1.374 N#CCCc1cc(O)ccc1S Amb27967558 [0,1,0,0,0,0|3,0,0]=4 3794 B12R1.374 N#CCCc1cc(S)ccc1Br Amb27200765 [0,1,0,0,0,0|2,0,0]=3 3795 B12R1.374 N#CCCc1cc(S)ccc1I Amb27423730 [0,1,0,0,0,0|2,1,0]=4 3796 B12R1.374 N#CCCc1cc(S)ccc1N Amb27616054 [0,1,0,0,0,0|3,0,0]=4 3797 B12R1.374 N#CCNc1cc(Br)ccc1Br Amb27198411 [0,1,0,0,0,0|3,0,0]=4 3798 B12R1.374 N#CCNc1cc(Cl)ccc1Br Amb28366677 [0,1,0,0,0,0|3,0,0]=4 3799 B12R1.374 N#CCNc1cc(F)ccc1Br Amb27794016 [0,1,0,0,0,0|3,0,0]=4 3800 B12R1.374 N#CCOc1cc(F)ccc1Br Amb19892313 [0,1,0,0,0,0|3,0,0]=4 3801 B12R1.374 N#CNCc1cc(F)ccc1Br Amb27791535 [0,1,0,0,0,0|3,0,0]=4 3802 B12R1.374 NCCCc1cc(Br)ccc1Cl Amb25036212 [0,1,0,0,0,0|2,1,0]=4 3803 B12R1.374 NCCCc1cc(Br)ccc1F Amb9304922 [0,1,0,0,0,0|2,1,0]=4 3804 B12R1.374 NCCCc1cc(Br)ccc1N Amb27208273 [0,1,0,0,0,0|3,0,0]=4 3805 B12R1.374 NCCCc1cc(Br)ccc1O Amb26608950 [0,1,0,0,0,0|3,0,0]=4 3806 B12R1.374 NCCCc1cc(Cl)ccc1Br Amb25150112 [0,1,0,0,0,0|2,0,0]=3 3807 B12R1.374 NCCCc1cc(Cl)ccc1Cl Amb17204405 [0,1,0,0,0,0|2,1,0]=4 3808 B12R1.374 NCCCc1cc(Cl)ccc1F Amb18863289 [0,1,0,0,0,0|2,1,0]=4 3809 B12R1.374 NCCCc1cc(Cl)ccc1I Amb30015437 [0,1,0,0,0,0|2,1,0]=4 3810 B12R1.374 NCCCc1cc(Cl)ccc1N Amb25177280 [0,1,0,0,0,0|3,0,0]=4 3811 B12R1.374 NCCCc1cc(Cl)ccc1O Amb18909512 [0,1,0,0,0,0|3,0,0]=4 3812 B12R1.374 NCCCc1cc(Cl)ncc1Br Amb33477787 [0,1,0,0,0,0|3,0,0]=4 3813 B12R1.374 NCCCc1cc(F)ccc1Br Amb9304908 [0,1,0,0,0,0|2,0,0]=3 3814 B12R1.374 NCCCc1cc(F)ccc1Cl Amb18821281 [0,1,0,0,0,0|2,1,0]=4 3815 B12R1.374 NCCCc1cc(F)ccc1F Amb18980797 [0,1,0,0,0,0|2,1,0]=4 3816 B12R1.374 NCCCc1cc(F)ccc1O Amb18556316 [0,1,0,0,0,0|3,0,0]=4 3817 B12R1.374 NCCCc1cc(N)ccc1F Amb27201935 [0,1,0,0,0,0|2,1,0]=4 3818 B12R1.374 NCCCc1cc(O)ccc1Br Amb24537692 [0,1,0,0,0,0|2,0,0]=3 3819 B12R1.374 NCCCc1cc(O)ccc1Cl Amb25682654 [0,1,0,0,0,0|2,1,0]=4 3820 B12R1.374 NCCCc1cc(O)ccc1F Amb27808605 [0,1,0,0,0,0|2,1,0]=4 3821 B12R1.374 NCCCc1cc(O)ccc1O Amb26505313 [0,1,0,0,0,0|3,0,0]=4 3822 B12R1.374 NCCOc1cc(Cl)ccc1Br Amb25896544 [0,1,0,0,0,0|3,0,0]=4 3823 B12R1.374 NCCOc1cc(F)ccc1Br Amb25106321 [0,1,0,0,0,0|3,0,0]=4 3824 B12R1.374 NCCOc1cc(O)ccc1Br Amb33387323 [0,1,0,0,0,0|3,0,0]=4 3825 B12R1.374 NNCCc1cc(Cl)ccc1Cl Amb27474442 [0,1,0,0,0,0|1,1,0]=3 3826 B12R1.374 NNCCc1cc(Cl)ccc1I Amb35697577 [0,1,0,0,0,0|1,1,0]=3 3827 B12R1.374 NNCCc1cc(F)ccc1F Amb27168823 [0,1,0,0,0,0|1,1,0]=3 3828 B12R1.374 NOCCc1cc(Br)ccc1Cl Amb33450482 [0,1,0,0,0,0|2,1,0]=4 3829 B12R1.374 NOCCc1cc(Br)ccc1F Amb25159910 [0,1,0,0,0,0|2,1,0]=4 3830 B12R1.374 NOCCc1cc(Br)ccc1O Amb33333246 [0,1,0,0,0,0|3,0,0]=4 3831 B12R1.374 NOCCc1cc(Cl)ccc1Br Amb33478241 [0,1,0,0,0,0|2,0,0]=3 3832 B12R1.374 NOCCc1cc(Cl)ccc1F Amb26991450 [0,1,0,0,0,0|2,1,0]=4 3833 B12R1.374 NOCCc1cc(Cl)ccc1O Amb33052626 [0,1,0,0,0,0|3,0,0]=4 3834 B12R1.374 NOCCc1cc(Cl)ncc1Br Amb33478118 [0,1,0,0,0,0|3,0,0]=4 3835 B12R1.374 NOCCc1cc(F)ccc1Br Amb33008573 [0,1,0,0,0,0|2,0,0]=3 3836 B12R1.374 NOCCc1cc(F)ccc1F Amb32875161 [0,1,0,0,0,0|2,1,0]=4 3837 B12R1.374 NOCCc1cc(F)ccc1O Amb33379927 [0,1,0,0,0,0|3,0,0]=4 3838 B12R1.374 NOCCc1cc(O)ccc1Br Amb33450362 [0,1,0,0,0,0|2,0,0]=3 3839 B12R1.374 NOCCc1cc(O)ccc1O Amb33268916 [0,1,0,0,0,0|3,0,0]=4 3840 B12R1.374 Nc1ccc(Br)c(CCCBr)c1 Amb24541058 [0,1,0,0,0,0|2,0,0]=3 3841 B12R1.374 Nc1ccc(Br)c(OCCF)c1 Amb26326461 [0,1,0,0,0,0|3,0,0]=4 3842 B12R1.374 Nc1ccc(Br)cc1CCCBr Amb26398043 [0,1,0,0,0,0|3,0,0]=4 3843 B12R1.374 Nc1ccc(Br)cc1CCCCl Amb26398045 [0,1,0,0,0,0|3,0,0]=4 3844 B12R1.374 Nc1ccc(Cl)c(CCCCl)c1 Amb27966176 [0,1,0,0,0,0|2,1,0]=4 3845 B12R1.374 Nc1ccc(Cl)cc1CCCBr Amb27971067 [0,1,0,0,0,0|3,0,0]=4 3846 B12R1.374 Nc1ccc(Cl)cc1CCCO Amb27455752 [0,1,0,0,0,0|3,0,0]=4 3847 B12R1.374 Nc1ccc(F)c(CCC=O)c1 Amb27614027 [0,1,0,0,0,0|2,1,0]=4 3848 B12R1.374 Nc1ccc(F)c(CCCBr)c1 Amb27614019 [0,1,0,0,0,0|2,1,0]=4 3849 B12R1.374 Nc1ccc(F)cc1CCC=O Amb27614026 [0,1,0,0,0,0|3,0,0]=4 3850 B12R1.374 Nc1ccc(F)cc1CCCBr Amb28286555 [0,1,0,0,0,0|3,0,0]=4 3851 B12R1.374 Nc1ccc(F)cc1CCCCl Amb27614023 [0,1,0,0,0,0|3,0,0]=4 3852 B12R1.374 Nc1ccc(I)cc1CCCCl Amb27209116 [0,1,0,0,0,0|3,0,0]=4 3853 B12R1.374 Nc1ccc(O)c(CCC=O)c1 Amb28129930 [0,1,0,0,0,0|3,0,0]=4 3854 B12R1.374 Nc1ccc(O)c(CCCBr)c1 Amb27616173 [0,1,0,0,0,0|3,0,0]=4 3855 B12R1.374 Nc1ccc(O)c(CCCCl)c1 Amb27209802 [0,1,0,0,0,0|3,0,0]=4 3856 B12R1.374 Nc1ccc(O)cc1CCCCl Amb28196575 [0,1,0,0,0,0|3,0,0]=4 3857 B12R1.374 Nc1ccc(O)cc1CCCO Amb27411950 [0,1,0,0,0,0|3,0,0]=4 3858 B12R1.374 Nc1ccc(S)c(CCC=O)c1 Amb27777371 [0,1,0,0,0,0|3,0,0]=4 3859 B12R1.374 Nc1ccc(S)c(CCCCl)c1 Amb27445215 [0,1,0,0,0,0|3,0,0]=4 3860 B12R1.374 Nc1ccc(S)cc1CCCBr Amb28196004 [0,1,0,0,0,0|3,0,0]=4 3861 B12R1.374 Nc1ccc(S)cc1CCCCl Amb27616194 [0,1,0,0,0,0|3,0,0]=4 3862 B12R1.374 O=C1C=CC(=O)C(CCCO)=C1 Amb27177915 [0,1,0,0,0,0|3,0,0]=4 3863 B12R1.374 O=C=NCc1cc(Cl)ccc1Br Amb25035142 [0,1,0,0,0,0|3,0,0]=4 3864 B12R1.374 O=C=NCc1cc(F)ccc1Br Amb26375848 [0,1,0,0,0,0|3,0,0]=4 3865 B12R1.374 O=CCCc1cc(Br)ccc1Br Amb26904631 [0,1,0,0,0,0|2,0,0]=3 3866 B12R1.374 O=CCCc1cc(Br)ccc1Cl Amb24093048 [0,1,0,0,0,0|2,1,0]=4 3867 B12R1.374 O=CCCc1cc(Br)ccc1F Amb27460881 [0,1,0,0,0,0|2,1,0]=4 3868 B12R1.374 O=CCCc1cc(Br)ccc1O Amb26009876 [0,1,0,0,0,0|3,0,0]=4 3869 B12R1.374 O=CCCc1cc(Cl)ccc1Br Amb25669683 [0,1,0,0,0,0|2,0,0]=3 3870 B12R1.374 O=CCCc1cc(Cl)ccc1Cl Amb10606178 [0,1,0,0,0,0|2,1,0]=4 3871 B12R1.374 O=CCCc1cc(Cl)ccc1F Amb25336451 [0,1,0,0,0,0|2,1,0]=4 3872 B12R1.374 O=CCCc1cc(Cl)ccc1I Amb25941284 [0,1,0,0,0,0|2,1,0]=4 3873 B12R1.374 O=CCCc1cc(Cl)ccc1O Amb27148868 [0,1,0,0,0,0|3,0,0]=4 3874 B12R1.374 O=CCCc1cc(Cl)ncc1Br Amb33478195 [0,1,0,0,0,0|3,0,0]=4 3875 B12R1.374 O=CCCc1cc(F)ccc1Br Amb20669022 [0,1,0,0,0,0|2,0,0]=3 3876 B12R1.374 O=CCCc1cc(F)ccc1Cl Amb25968941 [0,1,0,0,0,0|2,1,0]=4 3877 B12R1.374 O=CCCc1cc(F)ccc1F Amb18801724 [0,1,0,0,0,0|2,1,0]=4 3878 B12R1.374 O=CCCc1cc(F)ccc1I Amb25302517 [0,1,0,0,0,0|2,1,0]=4 3879 B12R1.374 O=CCCc1cc(F)ccc1O Amb24432683 [0,1,0,0,0,0|3,0,0]=4 3880 B12R1.374 O=CCCc1cc(F)ccc1S Amb27423576 [0,1,0,0,0,0|3,0,0]=4 3881 B12R1.374 O=CCCc1cc(I)ccc1Cl Amb27876661 [0,1,0,0,0,0|2,1,0]=4 3882 B12R1.374 O=CCCc1cc(I)ccc1F Amb27978680 [0,1,0,0,0,0|2,1,0]=4 3883 B12R1.374 O=CCCc1cc(I)ccc1O Amb27638722 [0,1,0,0,0,0|3,0,0]=4 3884 B12R1.374 O=CCCc1cc(I)ccc1S Amb27423735 [0,1,0,0,0,0|3,0,0]=4 3885 B12R1.374 O=CCCc1cc(O)ccc1Br Amb25311997 [0,1,0,0,0,0|2,0,0]=3 3886 B12R1.374 O=CCCc1cc(O)ccc1Cl Amb26846620 [0,1,0,0,0,0|2,1,0]=4 3887 B12R1.374 O=CCCc1cc(O)ccc1F Amb26879965 [0,1,0,0,0,0|2,1,0]=4 3888 B12R1.374 O=CCCc1cc(O)ccc1I Amb27604868 [0,1,0,0,0,0|2,1,0]=4 3889 B12R1.374 O=CCCc1cc(O)ccc1O Amb27962672 [0,1,0,0,0,0|3,0,0]=4 3890 B12R1.374 O=CCCc1cc(S)ccc1Cl Amb27428155 [0,1,0,0,0,0|2,1,0]=4 3891 B12R1.374 O=CCCc1cc(S)ccc1O Amb27423589 [0,1,0,0,0,0|3,0,0]=4 3892 B12R1.374 O=CCOc1cc(F)ccc1Br Amb27776004 [0,1,0,0,0,0|3,0,0]=4 3893 B12R1.374 OCCCc1cc(Br)ccc1Cl Amb33386703 [0,1,0,0,0,0|2,1,0]=4 3894 B12R1.374 OCCCc1cc(Br)ccc1F Amb25669437 [0,1,0,0,0,0|2,1,0]=4 3895 B12R1.374 OCCCc1cc(Br)ccc1O Amb25931046 [0,1,0,0,0,0|3,0,0]=4 3896 B12R1.374 OCCCc1cc(Cl)ccc1Br Amb26497942 [0,1,0,0,0,0|2,0,0]=3 3897 B12R1.374 OCCCc1cc(Cl)ccc1Cl Amb26852629 [0,1,0,0,0,0|2,1,0]=4 3898 B12R1.374 OCCCc1cc(Cl)ccc1F Amb18863273 [0,1,0,0,0,0|2,1,0]=4 3899 B12R1.374 OCCCc1cc(Cl)ccc1I Amb32945190 [0,1,0,0,0,0|2,1,0]=4 3900 B12R1.374 OCCCc1cc(Cl)ccc1O Amb25762478 [0,1,0,0,0,0|3,0,0]=4 3901 B12R1.374 OCCCc1cc(Cl)ncc1Br Amb33478191 [0,1,0,0,0,0|3,0,0]=4 3902 B12R1.374 OCCCc1cc(F)ccc1Br Amb26373423 [0,1,0,0,0,0|2,0,0]=3 3903 B12R1.374 OCCCc1cc(F)ccc1Cl Amb25271650 [0,1,0,0,0,0|2,1,0]=4 3904 B12R1.374 OCCCc1cc(F)ccc1F Amb17605791 [0,1,0,0,0,0|2,1,0]=4 3905 B12R1.374 OCCCc1cc(F)ccc1O Amb24377655 [0,1,0,0,0,0|3,0,0]=4 3906 B12R1.374 OCCCc1cc(I)ccc1F Amb27463082 [0,1,0,0,0,0|2,1,0]=4 3907 B12R1.374 OCCCc1cc(O)ccc1Br Amb33386709 [0,1,0,0,0,0|2,0,0]=3 3908 B12R1.374 OCCCc1cc(O)ccc1O Amb26347304 [0,1,0,0,0,0|3,0,0]=4 3909 B12R1.374 OCCNc1cc(F)ccc1Br Amb27175199 [0,1,0,0,0,0|3,0,0]=4 3910 B12R1.374 OCCOc1cc(Br)ccc1Br Amb23412184 [0,1,0,0,0,0|3,0,0]=4 3911 B12R1.374 Oc1ccc(Br)c(CCCBr)c1 Amb27971117 [0,1,0,0,0,0|2,0,0]=3 3912 B12R1.374 Oc1ccc(Br)c(CCCS)c1 Amb33387013 [0,1,0,0,0,0|2,0,0]=3 3913 B12R1.374 Oc1ccc(Br)cc1CCCCl Amb27638928 [0,1,0,0,0,0|3,0,0]=4 3914 B12R1.374 Oc1ccc(Br)cc1CCCS Amb33333973 [0,1,0,0,0,0|3,0,0]=4 3915 B12R1.374 Oc1ccc(Cl)cc1CCCBr Amb28286546 [0,1,0,0,0,0|3,0,0]=4 3916 B12R1.374 Oc1ccc(Cl)cc1CCCCl Amb28286547 [0,1,0,0,0,0|3,0,0]=4 3917 B12R1.374 Oc1ccc(Cl)cc1CCCS Amb33261242 [0,1,0,0,0,0|3,0,0]=4 3918 B12R1.374 Oc1ccc(F)c(CCCBr)c1 Amb27423567 [0,1,0,0,0,0|2,1,0]=4 3919 B12R1.374 Oc1ccc(F)cc1CCCBr Amb27423565 [0,1,0,0,0,0|3,0,0]=4 3920 B12R1.374 Oc1ccc(F)cc1CCCCl Amb27423571 [0,1,0,0,0,0|3,0,0]=4 3921 B12R1.374 Oc1ccc(F)cc1CCCS Amb33379205 [0,1,0,0,0,0|3,0,0]=4 3922 B12R1.374 Oc1ccc(I)c(CCCCl)c1 Amb27263907 [0,1,0,0,0,0|2,1,0]=4 3923 B12R1.374 Oc1ccc(I)cc1CCCBr Amb27622483 [0,1,0,0,0,0|3,0,0]=4 3924 B12R1.374 Oc1ccc(O)c(CCCBr)c1 Amb26966089 [0,1,0,0,0,0|3,0,0]=4 3925 B12R1.374 Oc1ccc(O)c(CCCCl)c1 Amb27192380 [0,1,0,0,0,0|3,0,0]=4 3926 B12R1.374 Oc1ccc(O)c(CCCS)c1 Amb33268155 [0,1,0,0,0,0|3,0,0]=4 3927 B12R1.374 Oc1ccc(S)c(CCCBr)c1 Amb28323411 [0,1,0,0,0,0|3,0,0]=4 3928 B12R1.374 Oc1ccc(S)c(CCCCl)c1 Amb27796397 [0,1,0,0,0,0|3,0,0]=4 3929 B12R1.374 SCCCc1cc(Br)ccc1Cl Amb33386525 [0,1,0,0,0,0|2,1,0]=4 3930 B12R1.374 SCCCc1cc(Cl)ccc1Br Amb33478281 [0,1,0,0,0,0|2,0,0]=3 3931 B12R1.374 SCCCc1cc(Cl)ncc1Br Amb33478602 [0,1,0,0,0,0|3,0,0]=4 3932 B12R1.374 Sc1ccc(Br)c(CCCBr)c1 Amb27614077 [0,1,0,0,0,0|2,0,0]=3 3933 B12R1.374 Sc1ccc(Br)c(CCCCl)c1 Amb26995163 [0,1,0,0,0,0|2,0,0]=3 3934 B12R1.374 Sc1ccc(Br)cc1CCCCl Amb25971086 [0,1,0,0,0,0|3,0,0]=4 3935 B12R1.374 Sc1ccc(Cl)cc1CCCCl Amb28435545 [0,1,0,0,0,0|3,0,0]=4 3936 B12R1.374 Sc1ccc(I)c(CCCBr)c1 Amb27423732 [0,1,0,0,0,0|2,1,0]=4 3937 B12R1.374 Sc1ccc(I)c(CCCCl)c1 Amb28368478 [0,1,0,0,0,0|2,1,0]=4 3938 B12R1.374 Sc1ccc(I)cc1CCCBr Amb27423731 [0,1,0,0,0,0|3,0,0]=4 3939 B12R1.374 Sc1ccc(I)cc1CCCCl Amb28368477 [0,1,0,0,0,0|3,0,0]=4 3940 B12R1.374 [C-]#[N+]CCc1cc(Br)ccc1Br Amb33331351 [0,1,0,0,0,0|0,0,2]=3 3941 B12R1.374 [C-]#[N+]CCc1cc(Br)ccc1C Amb33478647 [0,1,0,0,0,0|1,0,2]=4 3942 B12R1.374 [C-]#[N+]CCc1cc(Br)ccc1Cl Amb33450214 [0,1,0,0,0,0|0,1,2]=4 3943 B12R1.374 [C-]#[N+]CCc1cc(Br)ccc1F Amb33478724 [0,1,0,0,0,0|0,1,2]=4 3944 B12R1.374 [C-]#[N+]CCc1cc(Br)cnc1Br Amb33009001 [0,1,0,0,0,0|1,0,2]=4 3945 B12R1.374 [C-]#[N+]CCc1cc(C)ccc1Br Amb33477504 [0,1,0,0,0,0|0,0,2]=3 3946 B12R1.374 [C-]#[N+]CCc1cc(C)ccc1C Amb33418345 [0,1,0,0,0,0|1,0,2]=4 3947 B12R1.374 [C-]#[N+]CCc1cc(C)ccc1Cl Amb33260107 [0,1,0,0,0,0|0,1,2]=4 3948 B12R1.374 [C-]#[N+]CCc1cc(C)ccc1F Amb33271438 [0,1,0,0,0,0|0,1,2]=4 3949 B12R1.374 [C-]#[N+]CCc1cc(Cl)ccc1Br Amb33478229 [0,1,0,0,0,0|0,0,2]=3 3950 B12R1.374 [C-]#[N+]CCc1cc(Cl)ncc1Br Amb33477844 [0,1,0,0,0,0|1,0,2]=4 3951 B12R1.374 [C-]#[N+]CCc1cc(F)ccc1Br Amb33008545 [0,1,0,0,0,0|0,0,2]=3 3952 B12R1.374 [C-]#[N+]CCc1cc(F)ccc1C Amb33200577 [0,1,0,0,0,0|1,0,2]=4 3953 B12R1.374 [C-]#[N+]CCc1cc(F)ccc1F Amb32875165 [0,1,0,0,0,0|0,1,2]=4 3954 B12R1.374 [N-]=[N+]=NCc1cc(Cl)ccc1Br Amb25868251 [0,1,0,0,0,0|2,0,1]=4 3955 B12R1.374 [N-]=[N+]=NCc1cc(F)ccc1Br Amb26871785 [0,1,0,0,0,0|2,0,1]=4 3956 B12R1.374 [N-]=[N+]=NCc1cc(O)ccc1Br Amb33450378 [0,1,0,0,0,0|2,0,1]=4 3957 B12R1.1631 BrCCCc1c(Br)cccc1I Amb28208339 [0,1,0,0,0,0|2,0,0]=3 3958 B12R1.1631 BrCCOc1c(Br)cccc1Br Amb6632263 [0,1,0,0,0,0|3,0,0]=4 3959 B12R1.1631 C#CCCc1c(Br)cccc1Br Amb33009389 [0,1,0,0,0,0|1,0,1]=3 3960 B12R1.1631 C#CCCc1c(Br)cncc1Br Amb33388951 [0,1,0,0,0,0|2,0,1]=4 3961 B12R1.1631 C#CCCc1c(C)cccc1C Amb32725505 [0,1,0,0,0,0|2,0,1]=4 3962 B12R1.1631 C#CCCc1c(C)cccc1Cl Amb33259749 [0,1,0,0,0,0|1,1,1]=4 3963 B12R1.1631 C#CCCc1c(C)cccc1F Amb33148579 [0,1,0,0,0,0|1,1,1]=4 3964 B12R1.1631 C#CCCc1c(Cl)cccc1Br Amb33331851 [0,1,0,0,0,0|1,0,1]=3 3965 B12R1.1631 C#CCCc1c(Cl)cccc1Cl Amb18115182 [0,1,0,0,0,0|1,1,1]=4 3966 B12R1.1631 C#CCCc1c(F)cccc1Br Amb33430142 [0,1,0,0,0,0|1,0,1]=3 3967 B12R1.1631 C#CCCc1c(F)cccc1Cl Amb18636109 [0,1,0,0,0,0|1,1,1]=4 3968 B12R1.1631 C#CCCc1c(F)cccc1F Amb33226399 [0,1,0,0,0,0|1,1,1]=4 3969 B12R1.1631 C#CCCc1c(O)cccc1Br Amb33336513 [0,1,0,0,0,0|1,0,1]=3 3970 B12R1.1631 C#CCCc1c(O)cccc1Cl Amb33256166 [0,1,0,0,0,0|1,1,1]=4 3971 B12R1.1631 C#CCNc1c(C)cccc1Br Amb35721341 [0,1,0,0,0,0|2,0,1]=4 3972 B12R1.1631 C=CCCN1C(=O)C=CC=C1Br Amb27484358 [0,1,0,0,0,0|2,0,1]=4 3973 B12R1.1631 C=CCCc1c(C)cccc1C Amb27596124 [0,1,0,0,0,0|2,0,1]=4 3974 B12R1.1631 C=CCCc1c(Cl)cccc1Br Amb35715389 [0,1,0,0,0,0|1,0,1]=3 3975 B12R1.1631 C=CCNc1c(C)cccc1Br Amb35706681 [0,1,0,0,0,0|2,0,1]=4 3976 B12R1.1631 C=CCNc1c(N)cccc1Br Amb35638508 [0,1,0,0,0,0|2,0,1]=4 3977 B12R1.1631 C=CCOc1c(Br)cccc1Br Amb27946036 [0,1,0,0,0,0|2,0,1]=4 3978 B12R1.1631 C=CCSc1c(N)cccc1Br Amb35591418 [0,1,0,0,0,0|2,0,1]=4 3979 B12R1.1631 CCCCN1C(=O)C=CC=C1Br Amb28187881 [0,1,0,0,0,0|2,0,0]=3 3980 B12R1.1631 CCCCN1C(=O)C=CC=C1Cl Amb27178824 [0,1,0,0,0,0|2,1,0]=4 3981 B12R1.1631 CCCCc1c(C)cccc1N Amb27812884 [0,1,0,0,0,0|2,0,0]=3 3982 B12R1.1631 CCCCc1c(N)cccc1Br Amb29889508 [0,1,0,0,0,0|1,0,0]=2 3983 B12R1.1631 CCCCc1c(N)cncc1Br Amb25380660 [0,1,0,0,0,0|2,0,0]=3 3984 B12R1.1631 CCCCc1c(N)cncc1Cl Amb26332294 [0,1,0,0,0,0|2,1,0]=4 3985 B12R1.1631 CCCCc1c(O)cccc1O Amb27211987 [0,1,0,0,0,0|2,0,0]=3 3986 B12R1.1631 CCCNc1c(C)cccc1Br Amb35721344 [0,1,0,0,0,0|2,0,0]=3 3987 B12R1.1631 CCCNc1c(C)cccc1C Amb9174039 [0,1,0,0,0,0|3,0,0]=4 3988 B12R1.1631 CCCNc1c(C)cccc1Cl Amb27784256 [0,1,0,0,0,0|2,1,0]=4 3989 B12R1.1631 CCCNc1c(C)cccc1F Amb28423309 [0,1,0,0,0,0|2,1,0]=4 3990 B12R1.1631 CCCNc1c(C)cccc1N Amb24678901 [0,1,0,0,0,0|3,0,0]=4 3991 B12R1.1631 CCCNc1c(F)cccc1Br Amb27840814 [0,1,0,0,0,0|2,0,0]=3 3992 B12R1.1631 CCCNc1c(F)cccc1F Amb7784430 [0,1,0,0,0,0|2,1,0]=4 3993 B12R1.1631 CCCNc1c(N)cccc1Br Amb32708759 [0,1,0,0,0,0|2,0,0]=3 3994 B12R1.1631 CCCNc1c(N)cccc1F Amb22289420 [0,1,0,0,0,0|2,1,0]=4 3995 B12R1.1631 CCCOc1c(Br)cccc1Br Amb26472880 [0,1,0,0,0,0|2,0,0]=3 3996 B12R1.1631 CCCOc1c(C)cccc1C Amb28047213 [0,1,0,0,0,0|3,0,0]=4 3997 B12R1.1631 CCCOc1c(C)cccc1Cl Amb28185653 [0,1,0,0,0,0|2,1,0]=4 3998 B12R1.1631 CCCOc1c(C)cccc1N Amb27233002 [0,1,0,0,0,0|3,0,0]=4 3999 B12R1.1631 CCCOc1c(N)cccc1Br Amb25258745 [0,1,0,0,0,0|2,0,0]=3 4000 B12R1.1631 CCCOc1c(N)cccc1Cl Amb840118 [0,1,0,0,0,0|2,1,0]=4 4001 B12R1.1631 CCCOc1c(N)cccc1Cl Amb8627521 [0,1,0,0,0,0|2,1,0]=4 4002 B12R1.1631 CCCOc1c(N)cccc1F Amb25678737 [0,1,0,0,0,0|2,1,0]=4 4003 B12R1.1631 CCCOc1c(N)cncc1Br Amb27472758 [0,1,0,0,0,0|3,0,0]=4 4004 B12R1.1631 CCCOc1c(O)cccc1Br Amb22896497 [0,1,0,0,0,0|2,0,0]=3 4005 B12R1.1631 CCCSc1c(Cl)cccc1Cl Amb28455300 [0,1,0,0,0,0|2,1,0]=4 4006 B12R1.1631 CCCSc1c(N)cccc1Br Amb35591419 [0,1,0,0,0,0|2,0,0]=3 4007 B12R1.1631 CCCSc1c(N)cccc1F Amb27946345 [0,1,0,0,0,0|2,1,0]=4 4008 B12R1.1631 CCNCc1c(Br)cncc1Br Amb27650003 [0,1,0,0,0,0|3,0,0]=4 4009 B12R1.1631 CCNCc1c(C)cccc1Br Amb27970004 [0,1,0,0,0,0|2,0,0]=3 4010 B12R1.1631 CCNCc1c(Cl)cccc1Cl Amb837777 [0,1,0,0,0,0|2,1,0]=4 4011 B12R1.1631 CCNCc1c(F)cccc1Cl Amb838071 [0,1,0,0,0,0|2,1,0]=4 4012 B12R1.1631 CCNCc1c(F)cccc1F Amb6271048 [0,1,0,0,0,0|2,1,0]=4 4013 B12R1.1631 CCNCc1c(O)cccc1Cl Amb26957305 [0,1,0,0,0,0|2,1,0]=4 4014 B12R1.1631 CCNCc1c(O)cccc1F Amb27175605 [0,1,0,0,0,0|2,1,0]=4 4015 B12R1.1631 CCSCN1C(=O)C=CC=C1Br Amb28382995 [0,1,0,0,0,0|3,0,0]=4 4016 B12R1.1631 CCSCc1c(C)cccc1C Amb25669819 [0,1,0,0,0,0|3,0,0]=4 4017 B12R1.1631 CCSCc1c(Cl)cccc1Cl Amb28283402 [0,1,0,0,0,0|2,1,0]=4 4018 B12R1.1631 CCSCc1c(F)cccc1Cl Amb25710319 [0,1,0,0,0,0|2,1,0]=4 4019 B12R1.1631 CNCCc1c(Br)cncc1Br Amb28194108 [0,1,0,0,0,0|1,0,0]=2 4020 B12R1.1631 CNCCc1c(C)cccc1C Amb26993747 [0,1,0,0,0,0|1,0,0]=2 4021 B12R1.1631 CNCCc1c(C)cccc1Cl Amb33259433 [0,1,0,0,0,0|0,1,0]=2 4022 B12R1.1631 CNCCc1c(C)cccc1F Amb25311693 [0,1,0,0,0,0|0,1,0]=2 4023 B12R1.1631 CNCCc1c(Cl)cccc1Br Amb26511718 [0,1,0,0,0,0|0,0,0]=1 4024 B12R1.1631 CNCCc1c(Cl)cccc1Cl Amb17193870 [0,1,0,0,0,0|0,1,0]=2 4025 B12R1.1631 CNCCc1c(Cl)cncc1Cl Amb33260861 [0,1,0,0,0,0|1,1,0]=3 4026 B12R1.1631 CNCCc1c(Cl)ncnc1Cl Amb33262306 [0,1,0,0,0,0|2,1,0]=4 4027 B12R1.1631 CNCCc1c(F)cccc1Br Amb24603339 [0,1,0,0,0,0|0,0,0]=1 4028 B12R1.1631 CNCCc1c(F)cccc1Cl Amb8853651 [0,1,0,0,0,0|0,1,0]=2 4029 B12R1.1631 CNCCc1c(F)cccc1F Amb25342833 [0,1,0,0,0,0|0,1,0]=2 4030 B12R1.1631 CNCCc1c(F)cncc1F Amb32882305 [0,1,0,0,0,0|1,1,0]=3 4031 B12R1.1631 CNCCc1c(O)cccc1Br Amb33331533 [0,1,0,0,0,0|0,0,0]=1 4032 B12R1.1631 CNCCc1c(O)cccc1Cl Amb33260729 [0,1,0,0,0,0|0,1,0]=2 4033 B12R1.1631 CN\C=N\c1c(C)cccc1Cl Amb27666994 [0,1,0,0,0,0|1,1,1]=4 4034 B12R1.1631 CN\N=C\c1c(Br)cncc1Br Amb29848688 [0,1,0,0,0,0|2,0,1]=4 4035 B12R1.1631 COCCc1c(C)ccnc1Cl Amb27966245 [0,1,0,0,0,0|2,1,0]=4 4036 B12R1.1631 COCOc1c(Br)cccc1Br Amb25280184 [0,1,0,0,0,0|2,0,0]=3 4037 B12R1.1631 COCOc1c(C)cccc1C Amb28422599 [0,1,0,0,0,0|3,0,0]=4 4038 B12R1.1631 COCOc1c(Cl)cccc1Cl Amb24732716 [0,1,0,0,0,0|2,1,0]=4 4039 B12R1.1631 COCOc1c(F)cccc1Br Amb27652191 [0,1,0,0,0,0|2,0,0]=3 4040 B12R1.1631 COCOc1c(F)cccc1Cl Amb28400667 [0,1,0,0,0,0|2,1,0]=4 4041 B12R1.1631 COCOc1c(F)cncc1Br Amb27962433 [0,1,0,0,0,0|3,0,0]=4 4042 B12R1.1631 COCOc1c(N)ccnc1Br Amb27799963 [0,1,0,0,0,0|3,0,0]=4 4043 B12R1.1631 CONCc1c(F)cccc1Br Amb27178858 [0,1,0,0,0,0|2,0,0]=3 4044 B12R1.1631 CSCCN1C(=O)C=CC=C1Br Amb27256092 [0,1,0,0,0,0|2,0,0]=3 4045 B12R1.1631 CSCOc1c(Br)cccc1Br Amb27489108 [0,1,0,0,0,0|2,0,0]=3 4046 B12R1.1631 CSCOc1c(F)cccc1F Amb27261359 [0,1,0,0,0,0|2,1,0]=4 4047 B12R1.1631 CSCSc1c(Cl)cccc1Cl Amb28201731 [0,1,0,0,0,0|2,1,0]=4 4048 B12R1.1631 Cc1cccc(Br)c1CCC=O Amb24341814 [0,1,0,0,0,0|2,0,0]=3 4049 B12R1.1631 Cc1cccc(Br)c1CCCBr Amb26532699 [0,1,0,0,0,0|2,0,0]=3 4050 B12R1.1631 Cc1cccc(Br)c1CCCCl Amb26424709 [0,1,0,0,0,0|2,0,0]=3 4051 B12R1.1631 Cc1cccc(Br)c1CN=C=O Amb27206697 [0,1,0,0,0,0|3,0,0]=4 4052 B12R1.1631 Cc1cccc(Br)c1NCC#N Amb35706680 [0,1,0,0,0,0|3,0,0]=4 4053 B12R1.1631 Cc1cccc(Br)c1NCCF Amb35706683 [0,1,0,0,0,0|3,0,0]=4 4054 B12R1.1631 Cc1cccc(Br)c1NCCN Amb35721345 [0,1,0,0,0,0|3,0,0]=4 4055 B12R1.1631 Cc1cccc(Br)c1NCCO Amb35706949 [0,1,0,0,0,0|3,0,0]=4 4056 B12R1.1631 Cc1cccc(C)c1CCC#N Amb25156532 [0,1,0,0,0,0|3,0,0]=4 4057 B12R1.1631 Cc1cccc(C)c1CCC=O Amb24092993 [0,1,0,0,0,0|3,0,0]=4 4058 B12R1.1631 Cc1cccc(C)c1CCCBr Amb26392428 [0,1,0,0,0,0|3,0,0]=4 4059 B12R1.1631 Cc1cccc(C)c1CCCCl Amb26656221 [0,1,0,0,0,0|3,0,0]=4 4060 B12R1.1631 Cc1cccc(C)c1CCCN Amb18251668 [0,1,0,0,0,0|3,0,0]=4 4061 B12R1.1631 Cc1cccc(C)c1CCCO Amb27217279 [0,1,0,0,0,0|3,0,0]=4 4062 B12R1.1631 Cc1cccc(C)c1CCCS Amb32726843 [0,1,0,0,0,0|3,0,0]=4 4063 B12R1.1631 Cc1cccc(C)c1CCNN Amb28423368 [0,1,0,0,0,0|2,0,0]=3 4064 B12R1.1631 Cc1cccc(C)c1CCON Amb32725538 [0,1,0,0,0,0|3,0,0]=4 4065 B12R1.1631 Cc1cccc(Cl)c1CCC#N Amb26906388 [0,1,0,0,0,0|2,1,0]=4 4066 B12R1.1631 Cc1cccc(Cl)c1CCC=O Amb27211329 [0,1,0,0,0,0|2,1,0]=4 4067 B12R1.1631 Cc1cccc(Cl)c1CCCBr Amb25922220 [0,1,0,0,0,0|2,1,0]=4 4068 B12R1.1631 Cc1cccc(Cl)c1CCCCl Amb25234260 [0,1,0,0,0,0|2,1,0]=4 4069 B12R1.1631 Cc1cccc(Cl)c1CCCN Amb26059714 [0,1,0,0,0,0|2,1,0]=4 4070 B12R1.1631 Cc1cccc(Cl)c1CCCN Amb32782496 [0,1,0,0,0,0|2,1,0]=4 4071 B12R1.1631 Cc1cccc(Cl)c1CCCO Amb25791304 [0,1,0,0,0,0|2,1,0]=4 4072 B12R1.1631 Cc1cccc(Cl)c1CCCS Amb33413820 [0,1,0,0,0,0|2,1,0]=4 4073 B12R1.1631 Cc1cccc(Cl)c1CCON Amb33259450 [0,1,0,0,0,0|2,1,0]=4 4074 B12R1.1631 Cc1cccc(F)c1CCC#N Amb27427642 [0,1,0,0,0,0|2,1,0]=4 4075 B12R1.1631 Cc1cccc(F)c1CCC=O Amb24432818 [0,1,0,0,0,0|2,1,0]=4 4076 B12R1.1631 Cc1cccc(F)c1CCCBr Amb24637088 [0,1,0,0,0,0|2,1,0]=4 4077 B12R1.1631 Cc1cccc(F)c1CCCCl Amb27669873 [0,1,0,0,0,0|2,1,0]=4 4078 B12R1.1631 Cc1cccc(F)c1CCCN Amb27229462 [0,1,0,0,0,0|2,1,0]=4 4079 B12R1.1631 Cc1cccc(F)c1CCCO Amb33148581 [0,1,0,0,0,0|2,1,0]=4 4080 B12R1.1631 Cc1cccc(F)c1CCCS Amb33148308 [0,1,0,0,0,0|2,1,0]=4 4081 B12R1.1631 Cc1cccc(F)c1CCON Amb33143408 [0,1,0,0,0,0|2,1,0]=4 4082 B12R1.1631 Cc1cccc(I)c1CCC#N Amb28056976 [0,1,0,0,0,0|2,1,0]=4 4083 B12R1.1631 Cc1cccc(I)c1CCC=O Amb27962889 [0,1,0,0,0,0|2,1,0]=4 4084 B12R1.1631 Cc1cccc(I)c1CCCBr Amb28290904 [0,1,0,0,0,0|2,1,0]=4 4085 B12R1.1631 Cc1cccc(N)c1CCCBr Amb25223463 [0,1,0,0,0,0|3,0,0]=4 4086 B12R1.1631 Cc1cccc(O)c1CCCBr Amb28245942 [0,1,0,0,0,0|3,0,0]=4 4087 B12R1.1631 Cc1cccc(O)c1CCCCl Amb27199955 [0,1,0,0,0,0|3,0,0]=4 4088 B12R1.1631 Cc1cccc(S)c1CCC=O Amb27624765 [0,1,0,0,0,0|3,0,0]=4 4089 B12R1.1631 Cc1cccc(S)c1CCCBr Amb27846993 [0,1,0,0,0,0|3,0,0]=4 4090 B12R1.1631 Cc1cccc(S)c1CCCCl Amb25961171 [0,1,0,0,0,0|3,0,0]=4 4091 B12R1.1631 ClCCCc1c(Br)cccc1Br Amb25208586 [0,1,0,0,0,0|2,0,0]=3 4092 B12R1.1631 ClCCCc1c(Br)cccc1I Amb26917468 [0,1,0,0,0,0|2,0,0]=3 4093 B12R1.1631 ClCCCc1c(Cl)cccc1Br Amb26599739 [0,1,0,0,0,0|2,0,0]=3 4094 B12R1.1631 ClCCCc1c(Cl)cccc1Cl Amb24341769 [0,1,0,0,0,0|2,1,0]=4 4095 B12R1.1631 ClCCOc1c(Br)cccc1Br Amb8828462 [0,1,0,0,0,0|3,0,0]=4 4096 B12R1.1631 Clc1cccc(Br)c1CCCBr Amb25986634 [0,1,0,0,0,0|2,0,0]=3 4097 B12R1.1631 Clc1cccc(Cl)c1CCCBr Amb24456278 [0,1,0,0,0,0|2,1,0]=4 4098 B12R1.1631 Fc1cccc(Br)c1CCCBr Amb25312282 [0,1,0,0,0,0|2,0,0]=3 4099 B12R1.1631 Fc1cccc(Br)c1CCCCl Amb26617884 [0,1,0,0,0,0|2,0,0]=3 4100 B12R1.1631 Fc1cccc(Br)c1CCCS Amb33478531 [0,1,0,0,0,0|2,0,0]=3 4101 B12R1.1631 Fc1cccc(Br)c1OCCBr Amb22896607 [0,1,0,0,0,0|3,0,0]=4 4102 B12R1.1631 Fc1cccc(Cl)c1CCCBr Amb17104568 [0,1,0,0,0,0|2,1,0]=4 4103 B12R1.1631 Fc1cccc(Cl)c1CCCCl Amb17104540 [0,1,0,0,0,0|2,1,0]=4 4104 B12R1.1631 Fc1cccc(Cl)c1CCCS Amb17402978 [0,1,0,0,0,0|2,1,0]=4 4105 B12R1.1631 Fc1cccc(F)c1CCCBr Amb25152621 [0,1,0,0,0,0|2,1,0]=4 4106 B12R1.1631 Fc1cccc(F)c1CCCCl Amb25189588 [0,1,0,0,0,0|2,1,0]=4 4107 B12R1.1631 Fc1cccc(F)c1CCCS Amb33314363 [0,1,0,0,0,0|2,1,0]=4 4108 B12R1.1631 Fc1cccc(S)c1CCCBr Amb28133830 [0,1,0,0,0,0|2,1,0]=4 4109 B12R1.1631 Fc1cccc(S)c1CCCCl Amb27423555 [0,1,0,0,0,0|2,1,0]=4 4110 B12R1.1631 Fc1cncc(Br)c1CCCCl Amb27268660 [0,1,0,0,0,0|3,0,0]=4 4111 B12R1.1631 N#CCCc1c(Br)cccc1Br Amb27445792 [0,1,0,0,0,0|2,0,0]=3 4112 B12R1.1631 N#CCCc1c(Br)cncc1Br Amb33477176 [0,1,0,0,0,0|3,0,0]=4 4113 B12R1.1631 N#CCCc1c(Cl)cccc1Br Amb27193320 [0,1,0,0,0,0|2,0,0]=3 4114 B12R1.1631 N#CCCc1c(Cl)cccc1Cl Amb19038886 [0,1,0,0,0,0|2,1,0]=4 4115 B12R1.1631 N#CCCc1c(Cl)cccc1I Amb27967915 [0,1,0,0,0,0|2,1,0]=4 4116 B12R1.1631 N#CCCc1c(F)cccc1Br Amb25311739 [0,1,0,0,0,0|2,0,0]=3 4117 B12R1.1631 N#CCCc1c(F)cccc1Cl Amb19057365 [0,1,0,0,0,0|2,1,0]=4 4118 B12R1.1631 N#CCCc1c(F)cccc1F Amb27393483 [0,1,0,0,0,0|2,1,0]=4 4119 B12R1.1631 N#CCCc1c(I)cccc1I Amb27638364 [0,1,0,0,0,0|2,1,0]=4 4120 B12R1.1631 N#CCCc1c(N)cccc1F Amb27614016 [0,1,0,0,0,0|2,1,0]=4 4121 B12R1.1631 N#CCCc1c(N)cccc1O Amb27616170 [0,1,0,0,0,0|3,0,0]=4 4122 B12R1.1631 N#CCCc1c(O)cccc1Br Amb26445584 [0,1,0,0,0,0|2,0,0]=3 4123 B12R1.1631 N#CCCc1c(O)cccc1Cl Amb26414102 [0,1,0,0,0,0|2,1,0]=4 4124 B12R1.1631 N#CCCc1c(O)cccc1F Amb27239024 [0,1,0,0,0,0|2,1,0]=4 4125 B12R1.1631 N#CCCc1c(O)cccc1S Amb27423578 [0,1,0,0,0,0|3,0,0]=4 4126 B12R1.1631 N#CCCc1c(S)cccc1Br Amb27613913 [0,1,0,0,0,0|2,0,0]=3 4127 B12R1.1631 N#CCCc1c(S)cccc1I Amb27230865 [0,1,0,0,0,0|2,1,0]=4 4128 B12R1.1631 NCCCN1C(=O)C=CC=C1Br Amb18040601 [0,1,0,0,0,0|3,0,0]=4 4129 B12R1.1631 NCCCc1c(Cl)cccc1Br Amb24447135 [0,1,0,0,0,0|2,0,0]=3 4130 B12R1.1631 NCCCc1c(Cl)cccc1Cl Amb32665389 [0,1,0,0,0,0|2,1,0]=4 4131 B12R1.1631 NCCCc1c(Cl)cccc1Cl Amb9304926 [0,1,0,0,0,0|2,1,0]=4 4132 B12R1.1631 NCCCc1c(F)cccc1Br Amb28127001 [0,1,0,0,0,0|2,0,0]=3 4133 B12R1.1631 NCCCc1c(F)cccc1Cl Amb22548235 [0,1,0,0,0,0|2,1,0]=4 4134 B12R1.1631 NCCCc1c(F)cccc1Cl Amb5735482 [0,1,0,0,0,0|2,1,0]=4 4135 B12R1.1631 NCCCc1c(F)cccc1F Amb18981388 [0,1,0,0,0,0|2,1,0]=4 4136 B12R1.1631 NCCCc1c(O)cccc1Br Amb33331524 [0,1,0,0,0,0|2,0,0]=3 4137 B12R1.1631 NCCCc1c(O)cccc1Cl Amb28365633 [0,1,0,0,0,0|2,1,0]=4 4138 B12R1.1631 NCCCc1c(O)cccc1F Amb25149830 [0,1,0,0,0,0|2,1,0]=4 4139 B12R1.1631 NCCCc1c(O)cccc1O Amb27238060 [0,1,0,0,0,0|3,0,0]=4 4140 B12R1.1631 NCCNc1c(N)cccc1Br Amb35638510 [0,1,0,0,0,0|3,0,0]=4 4141 B12R1.1631 NCCOc1c(Cl)cccc1Br Amb28075330 [0,1,0,0,0,0|3,0,0]=4 4142 B12R1.1631 NCCOc1c(F)cccc1Br Amb25896405 [0,1,0,0,0,0|3,0,0]=4 4143 B12R1.1631 NCCOc1c(O)cccc1Br Amb33336515 [0,1,0,0,0,0|3,0,0]=4 4144 B12R1.1631 NNCCc1c(F)cccc1Cl Amb7771380 [0,1,0,0,0,0|1,1,0]=3 4145 B12R1.1631 NOCCc1c(Cl)cccc1Br Amb33336237 [0,1,0,0,0,0|2,0,0]=3 4146 B12R1.1631 NOCCc1c(Cl)cccc1Cl Amb33256470 [0,1,0,0,0,0|2,1,0]=4 4147 B12R1.1631 NOCCc1c(F)cccc1Br Amb33430009 [0,1,0,0,0,0|2,0,0]=3 4148 B12R1.1631 NOCCc1c(F)cccc1Cl Amb33256126 [0,1,0,0,0,0|2,1,0]=4 4149 B12R1.1631 NOCCc1c(F)cccc1F Amb22900926 [0,1,0,0,0,0|2,1,0]=4 4150 B12R1.1631 NOCCc1c(O)cccc1Br Amb33431137 [0,1,0,0,0,0|2,0,0]=3 4151 B12R1.1631 NOCCc1c(O)cccc1Cl Amb33261089 [0,1,0,0,0,0|2,1,0]=4 4152 B12R1.1631 Nc1cccc(Br)c1CCCBr Amb27259767 [0,1,0,0,0,0|2,0,0]=3 4153 B12R1.1631 Nc1cccc(Br)c1CCCCl Amb24626552 [0,1,0,0,0,0|2,0,0]=3 4154 B12R1.1631 Nc1cccc(Br)c1NCCF Amb35638514 [0,1,0,0,0,0|3,0,0]=4 4155 B12R1.1631 Nc1cccc(Br)c1NCCO Amb35638513 [0,1,0,0,0,0|3,0,0]=4 4156 B12R1.1631 Nc1cccc(Br)c1OCCF Amb25898835 [0,1,0,0,0,0|3,0,0]=4 4157 B12R1.1631 Nc1cccc(Br)c1OCCO Amb25898836 [0,1,0,0,0,0|3,0,0]=4 4158 B12R1.1631 Nc1cccc(Br)c1SCCO Amb35591421 [0,1,0,0,0,0|3,0,0]=4 4159 B12R1.1631 Nc1cccc(F)c1CCCBr Amb27614018 [0,1,0,0,0,0|2,1,0]=4 4160 B12R1.1631 Nc1cccc(F)c1CCCCl Amb27614024 [0,1,0,0,0,0|2,1,0]=4 4161 B12R1.1631 Nc1cccc(N)c1CCCCl Amb27209712 [0,1,0,0,0,0|3,0,0]=4 4162 B12R1.1631 Nc1cccc(O)c1CCCCl Amb27625210 [0,1,0,0,0,0|3,0,0]=4 4163 B12R1.1631 Nc1cccc(S)c1CCC=O Amb28384695 [0,1,0,0,0,0|3,0,0]=4 4164 B12R1.1631 O=C=NCc1c(Br)cccc1Br Amb27811990 [0,1,0,0,0,0|3,0,0]=4 4165 B12R1.1631 O=C=NCc1c(Cl)cccc1Br Amb25695634 [0,1,0,0,0,0|3,0,0]=4 4166 B12R1.1631 O=C=NCc1c(F)cccc1Br Amb25722005 [0,1,0,0,0,0|3,0,0]=4 4167 B12R1.1631 O=CCCc1c(Cl)cccc1Br Amb26494572 [0,1,0,0,0,0|2,0,0]=3 4168 B12R1.1631 O=CCCc1c(Cl)cccc1Cl Amb24092996 [0,1,0,0,0,0|2,1,0]=4 4169 B12R1.1631 O=CCCc1c(Cl)cccc1I Amb27759488 [0,1,0,0,0,0|2,1,0]=4 4170 B12R1.1631 O=CCCc1c(F)cccc1Br Amb25035166 [0,1,0,0,0,0|2,0,0]=3 4171 B12R1.1631 O=CCCc1c(F)cccc1Cl Amb17081684 [0,1,0,0,0,0|2,1,0]=4 4172 B12R1.1631 O=CCCc1c(F)cccc1F Amb25728226 [0,1,0,0,0,0|2,1,0]=4 4173 B12R1.1631 O=CCCc1c(F)cccc1I Amb25055675 [0,1,0,0,0,0|2,1,0]=4 4174 B12R1.1631 O=CCCc1c(F)cccc1S Amb27798716 [0,1,0,0,0,0|2,1,0]=4 4175 B12R1.1631 O=CCCc1c(O)cccc1Br Amb28046347 [0,1,0,0,0,0|2,0,0]=3 4176 B12R1.1631 O=CCCc1c(O)cccc1Cl Amb26845539 [0,1,0,0,0,0|2,1,0]=4 4177 B12R1.1631 O=CCCc1c(O)cccc1I Amb25784762 [0,1,0,0,0,0|2,1,0]=4 4178 B12R1.1631 O=CCCc1c(O)cccc1S Amb27259768 [0,1,0,0,0,0|3,0,0]=4 4179 B12R1.1631 O=CCCc1c(S)cccc1Br Amb28435487 [0,1,0,0,0,0|2,0,0]=3 4180 B12R1.1631 O=CCCc1c(S)cccc1Cl Amb27623464 [0,1,0,0,0,0|2,1,0]=4 4181 B12R1.1631 O=CCCc1c(S)cccc1S Amb28133073 [0,1,0,0,0,0|3,0,0]=4 4182 B12R1.1631 OCCCc1c(Cl)cccc1Br Amb25829173 [0,1,0,0,0,0|2,0,0]=3 4183 B12R1.1631 OCCCc1c(Cl)cccc1Cl Amb24356168 [0,1,0,0,0,0|2,1,0]=4 4184 B12R1.1631 OCCCc1c(F)cccc1Br Amb33241224 [0,1,0,0,0,0|2,0,0]=3 4185 B12R1.1631 OCCCc1c(F)cccc1Cl Amb17089506 [0,1,0,0,0,0|2,1,0]=4 4186 B12R1.1631 OCCCc1c(F)cccc1F Amb24447301 [0,1,0,0,0,0|2,1,0]=4 4187 B12R1.1631 OCCCc1c(O)cccc1Cl Amb24416761 [0,1,0,0,0,0|2,1,0]=4 4188 B12R1.1631 OCCCc1c(O)cccc1F Amb28119944 [0,1,0,0,0,0|2,1,0]=4 4189 B12R1.1631 Oc1cccc(Br)c1CCCBr Amb25377434 [0,1,0,0,0,0|2,0,0]=3 4190 B12R1.1631 Oc1cccc(Br)c1CCCCl Amb24638372 [0,1,0,0,0,0|2,0,0]=3 4191 B12R1.1631 Oc1cccc(Br)c1CCCS Amb33336526 [0,1,0,0,0,0|2,0,0]=3 4192 B12R1.1631 Oc1cccc(Cl)c1CCCBr Amb27789042 [0,1,0,0,0,0|2,1,0]=4 4193 B12R1.1631 Oc1cccc(Cl)c1CCCCl Amb28202634 [0,1,0,0,0,0|2,1,0]=4 4194 B12R1.1631 Oc1cccc(Cl)c1CCCS Amb33256190 [0,1,0,0,0,0|2,1,0]=4 4195 B12R1.1631 Oc1cccc(F)c1CCCBr Amb27208811 [0,1,0,0,0,0|2,1,0]=4 4196 B12R1.1631 Oc1cccc(F)c1CCCCl Amb27423570 [0,1,0,0,0,0|2,1,0]=4 4197 B12R1.1631 Oc1cccc(S)c1CCCBr Amb28196039 [0,1,0,0,0,0|3,0,0]=4 4198 B12R1.1631 SCCCc1c(Cl)cccc1Br Amb33333768 [0,1,0,0,0,0|2,0,0]=3 4199 B12R1.1631 SCCCc1c(Cl)cccc1Cl Amb33258780 [0,1,0,0,0,0|2,1,0]=4 4200 B12R1.1631 SCCOc1c(Br)cccc1Br Amb27853476 [0,1,0,0,0,0|3,0,0]=4 4201 B12R1.1631 Sc1cccc(Br)c1CCCCl Amb27259749 [0,1,0,0,0,0|2,0,0]=3 4202 B12R1.1631 Sc1cccc(Cl)c1CCCBr Amb27795116 [0,1,0,0,0,0|2,1,0]=4 4203 B12R1.1631 Sc1cccc(Cl)c1CCCCl Amb27239050 [0,1,0,0,0,0|2,1,0]=4 4204 B12R1.1631 [C-]#[N+]CCc1c(Br)cccc1Br Amb33009391 [0,1,0,0,0,0|0,0,2]=3 4205 B12R1.1631 [C-]#[N+]CCc1c(Br)cncc1Br Amb33477208 [0,1,0,0,0,0|1,0,2]=4 4206 B12R1.1631 [C-]#[N+]CCc1c(C)cccc1C Amb32725565 [0,1,0,0,0,0|1,0,2]=4 4207 B12R1.1631 [C-]#[N+]CCc1c(C)cccc1Cl Amb33259700 [0,1,0,0,0,0|0,1,2]=4 4208 B12R1.1631 [C-]#[N+]CCc1c(C)cccc1F Amb33143455 [0,1,0,0,0,0|0,1,2]=4 4209 B12R1.1631 [C-]#[N+]CCc1c(Cl)cccc1Br Amb33336247 [0,1,0,0,0,0|0,0,2]=3 4210 B12R1.1631 [C-]#[N+]CCc1c(Cl)cccc1Cl Amb2686901 [0,1,0,0,0,0|0,1,2]=4 4211 B12R1.1631 [C-]#[N+]CCc1c(F)cccc1Br Amb33429994 [0,1,0,0,0,0|0,0,2]=3 4212 B12R1.1631 [C-]#[N+]CCc1c(F)cccc1Cl Amb33256177 [0,1,0,0,0,0|0,1,2]=4 4213 B12R1.1631 [C-]#[N+]CCc1c(F)cccc1F Amb33315273 [0,1,0,0,0,0|0,1,2]=4 4214 B12R1.1631 [N-]=[N+]=NCc1c(Cl)cccc1Br Amb33485094 [0,1,0,0,0,0|2,0,1]=4 4215 B12R1.1631 [N-]=[N+]=NCc1c(F)cccc1Br Amb33430026 [0,1,0,0,0,0|2,0,1]=4 4216 B12R1.1631 [N-]=[N+]=NCc1c(O)cccc1Br Amb33336185 [0,1,0,0,0,0|2,0,1]=4 4217 B10R0.71 C=C\C=C/C=C/CCCCC Amb22546765 [0,0,1,0,0,0|2,0,1]=4 4218 B10R0.71 CCCCC\C=C\C=C\C=O Amb8392854 [0,0,1,0,0,0|2,0,1]=4 4219 B12R2.24 BrC1=Cc2ccccc2CC1 Amb25726468 [0,0,0,1,0,0|3,0,0]=4 4220 B12R2.24 BrC1CCc2ccccc2C1 Amb13952699 [0,0,0,1,0,0|3,0,0]=4 4221 B12R2.24 C=C1CCc2ccccc2O1 Amb27210216 [0,0,0,1,0,0|2,0,1]=4 4222 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [0,0,0,1,0,0|2,0,0]=3 4223 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [0,0,0,1,0,0|3,0,0]=4 4224 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [0,0,0,1,0,0|3,0,0]=4 4225 B12R2.24 CC1=Nc2ccccc2CN1 Amb6892861 [0,0,0,1,0,0|3,0,0]=4 4226 B12R2.24 CC1=Nc2ccccc2CO1 Amb27391671 [0,0,0,1,0,0|3,0,0]=4 4227 B12R2.24 CC1=Nc2ccccc2NC1 Amb27244163 [0,0,0,1,0,0|3,0,0]=4 4228 B12R2.24 CC1=Nc2ccccc2SC1 Amb10976510 [0,0,0,1,0,0|3,0,0]=4 4229 B12R2.24 CC1CCc2ccccc2C1 Amb27232124 [0,0,0,1,0,0|2,0,0]=3 4230 B12R2.24 CC1CCc2ccccc2N1 Amb2792500 [0,0,0,1,0,0|2,0,0]=3 4231 B12R2.24 CC1CCc2ccccc2N1 Amb6773975 [0,0,0,1,0,0|2,0,0]=3 4232 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,0,0,1,0,0|2,0,0]=3 4233 B12R2.24 CC1CCc2cccnc2C1 Amb25187438 [0,0,0,1,0,0|3,0,0]=4 4234 B12R2.24 CC1CCc2ncccc2C1 Amb27474500 [0,0,0,1,0,0|3,0,0]=4 4235 B12R2.24 CC1CNc2ccccc2C1 Amb5745971 [0,0,0,1,0,0|3,0,0]=4 4236 B12R2.24 CC1CNc2ccccc2N1 Amb4138615 [0,0,0,1,0,0|3,0,0]=4 4237 B12R2.24 CC1CNc2ccccc2O1 Amb17097653 [0,0,0,1,0,0|3,0,0]=4 4238 B12R2.24 CC1CNc2ccccc2O1 Amb5716804 [0,0,0,1,0,0|3,0,0]=4 4239 B12R2.24 CC1CNc2ccccc2S1 Amb9173896 [0,0,0,1,0,0|3,0,0]=4 4240 B12R2.24 CC1COc2ccccc2N1 Amb3427952 [0,0,0,1,0,0|3,0,0]=4 4241 B12R2.24 CC1COc2ccccc2O1 Amb27762394 [0,0,0,1,0,0|3,0,0]=4 4242 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,0,0,1,0,0|3,0,0]=4 4243 B12R2.24 CC1Cc2ccccc2CN1 Amb4125575 [0,0,0,1,0,0|3,0,0]=4 4244 B12R2.24 CC1Cc2ccccc2CO1 Amb27490040 [0,0,0,1,0,0|3,0,0]=4 4245 B12R2.24 CN1CCc2ccccc2C1 Amb22001820 [0,0,0,1,0,0|1,0,0]=2 4246 B12R2.24 CN1CCc2ccccc2C1 Amb2581727 [0,0,0,1,0,0|1,0,0]=2 4247 B12R2.24 CN1CCc2cnccc2C1 Amb26963065 [0,0,0,1,0,0|2,0,0]=3 4248 B12R2.24 CN1CCc2ncccc2C1 Amb28315050 [0,0,0,1,0,0|2,0,0]=3 4249 B12R2.24 CN1CNc2ccccc2C1 Amb27858302 [0,0,0,1,0,0|2,0,0]=3 4250 B12R2.24 CN1Cc2ccccc2C=N1 Amb8391965 [0,0,0,1,0,0|2,0,1]=4 4251 B12R2.24 CN1Cc2ccccc2CN1 Amb9677363 [0,0,0,1,0,0|2,0,0]=3 4252 B12R2.24 CN1Cc2ccccc2CO1 Amb27850763 [0,0,0,1,0,0|2,0,0]=3 4253 B12R2.24 C[C@@H]1CNc2ccccc2C1 Amb27975495 [0,0,0,1,0,0|3,0,0]=4 4254 B12R2.24 C[C@@H]1CNc2ccccc2N1 Amb25992852 [0,0,0,1,0,0|3,0,0]=4 4255 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,0,0,1,0,0|3,0,0]=4 4256 B12R2.24 C[C@H]1COc2ccccc2N1 Amb28340950 [0,0,0,1,0,0|3,0,0]=4 4257 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,0,0,1,0,0|3,0,0]=4 4258 B12R2.24 FC1=Cc2ccccc2CC1 Amb26441264 [0,0,0,1,0,0|3,0,0]=4 4259 B12R2.24 FC1CCc2ccccc2O1 Amb27668649 [0,0,0,1,0,0|3,0,0]=4 4260 B12R2.24 IC1CCc2ccccc2C1 Amb33714903 [0,0,0,1,0,0|3,0,0]=4 4261 B12R2.24 NC1=Nc2ccccc2CC1 Amb2373583 [0,0,0,1,0,0|3,0,0]=4 4262 B12R2.24 NC1CCc2ccccc2C1 Amb13952050 [0,0,0,1,0,0|3,0,0]=4 4263 B12R2.24 NC1CCc2ccccc2C1 Amb2383251 [0,0,0,1,0,0|3,0,0]=4 4264 B12R2.24 NN1CCc2ccccc2C1 Amb17232046 [0,0,0,1,0,0|2,0,0]=3 4265 B12R2.24 NN1CCc2ccccc2C1 Amb22495461 [0,0,0,1,0,0|2,0,0]=3 4266 B12R2.24 N[C@@H]1CCc2ccccc2C1 Amb25113422 [0,0,0,1,0,0|3,0,0]=4 4267 B12R2.24 N[C@H]1CCc2ccccc2C1 Amb8383954 [0,0,0,1,0,0|3,0,0]=4 4268 B12R2.24 O=C1CCc2ccccc2C1 Amb2383557 [0,0,0,1,0,0|3,0,0]=4 4269 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [0,0,0,1,0,0|3,0,0]=4 4270 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [0,0,0,1,0,0|3,0,0]=4 4271 B12R2.24 OC1CCc2ccccc2C1 Amb2721268 [0,0,0,1,0,0|3,0,0]=4 4272 B12R2.24 OC1CCc2ccccc2N1 Amb27209313 [0,0,0,1,0,0|3,0,0]=4 4273 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,0,0,1,0,0|3,0,0]=4 4274 B12R2.24 O[C@@H]1CCc2ccccc2C1 Amb25043599 [0,0,0,1,0,0|3,0,0]=4 4275 B12R2.24 O[C@H]1CCc2ccccc2C1 Amb25149682 [0,0,0,1,0,0|3,0,0]=4 4276 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,0,0,1,0,0|3,0,0]=4 4277 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,0,0,1,0,0|3,0,0]=4 4278 B12R2.24 [O-][N+]1=Cc2ccccc2CC1 Amb27869931 [0,0,0,1,0,0|2,0,1]=4 4279 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [0,0,0,1,0,0|3,0,0]=4 4280 B12R2.32 BrCC1Cc2ccccc2O1 Amb17040446 [0,0,0,1,0,0|3,0,0]=4 4281 B12R2.32 BrCC1Cc2ccccc2S1 Amb27826930 [0,0,0,1,0,0|3,0,0]=4 4282 B12R2.32 C#CC1Cc2ccccc2C1 Amb24074759 [0,0,0,1,0,0|2,0,1]=4 4283 B12R2.32 C=CC1Cc2ccccc2C1 Amb33342617 [0,0,0,1,0,0|2,0,1]=4 4284 B12R2.32 C=CC1Cc2ccccc2N1 Amb28410346 [0,0,0,1,0,0|2,0,1]=4 4285 B12R2.32 CCC1=Cc2ccccc2C1 Amb6357923 [0,0,0,1,0,0|2,0,1]=4 4286 B12R2.32 CCC1Cc2ccccc2N1 Amb27238349 [0,0,0,1,0,0|2,0,0]=3 4287 B12R2.32 CCC1Nc2ccccc2O1 Amb28046870 [0,0,0,1,0,0|3,0,0]=4 4288 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [0,0,0,1,0,0|1,0,0]=2 4289 B12R2.32 CNC1Cc2ccccc2C1 Amb9173647 [0,0,0,1,0,0|1,0,0]=2 4290 B12R2.32 CNN1Cc2ccccc2C1 Amb26035337 [0,0,0,1,0,0|2,0,0]=3 4291 B12R2.32 CNc1cc2ccccc2s1 Amb27428924 [0,0,0,1,0,0|1,0,2]=4 4292 B12R2.32 CNc1nc2ccccc2o1 Amb1162733 [0,0,0,1,0,0|2,0,1]=4 4293 B12R2.32 CNc1nc2ccccc2s1 Amb219907 [0,0,0,1,0,0|2,0,1]=4 4294 B12R2.32 CNc1nc2ccccc2s1 Amb6393235 [0,0,0,1,0,0|2,0,1]=4 4295 B12R2.32 CON1Cc2ccccc2C1 Amb27965846 [0,0,0,1,0,0|3,0,0]=4 4296 B12R2.32 ClCC1Cc2ccccc2C1 Amb27395181 [0,0,0,1,0,0|3,0,0]=4 4297 B12R2.32 ClCC1Cc2ccccc2O1 Amb33550114 [0,0,0,1,0,0|3,0,0]=4 4298 B12R2.32 ICC1Cc2ccccc2C1 Amb27460286 [0,0,0,1,0,0|3,0,0]=4 4299 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,0,0,1,0,0|3,0,0]=4 4300 B12R2.32 N#CC1Cc2ccccc2C1 Amb9675769 [0,0,0,1,0,0|3,0,0]=4 4301 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [0,0,0,1,0,0|3,0,0]=4 4302 B12R2.32 NCC1Cc2ccccc2C1 Amb9675770 [0,0,0,1,0,0|3,0,0]=4 4303 B12R2.32 NCC1Cc2ccccc2O1 Amb2723363 [0,0,0,1,0,0|3,0,0]=4 4304 B12R2.32 NCC1Cc2ccccc2O1 Amb9717685 [0,0,0,1,0,0|3,0,0]=4 4305 B12R2.32 NC[C@@H]1Cc2ccccc2N1 Amb27606056 [0,0,0,1,0,0|3,0,0]=4 4306 B12R2.32 NNC1Cc2ccccc2C1 Amb10071076 [0,0,0,1,0,0|2,0,0]=3 4307 B12R2.32 NNC1Cc2ccccc2C1 Amb19890159 [0,0,0,1,0,0|2,0,0]=3 4308 B12R2.32 NNC1Cc2ccccc2C1 Amb9675735 [0,0,0,1,0,0|2,0,0]=3 4309 B12R2.32 NNC1Cc2ccccc2N1 Amb27641029 [0,0,0,1,0,0|2,0,0]=3 4310 B12R2.32 O=CC1Cc2ccccc2C1 Amb33547407 [0,0,0,1,0,0|3,0,0]=4 4311 B12R2.32 O=CC1Cc2ccccc2N1 Amb27232668 [0,0,0,1,0,0|3,0,0]=4 4312 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,0,0,1,0,0|3,0,0]=4 4313 B12R2.32 OCC1Cc2ccccc2N1 Amb2724872 [0,0,0,1,0,0|3,0,0]=4 4314 B12R2.32 OCC1Cc2ccccc2O1 Amb9782879 [0,0,0,1,0,0|3,0,0]=4 4315 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,0,0,1,0,0|3,0,0]=4 4316 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,0,0,1,0,0|3,0,0]=4 4317 B12R2.32 ONC1=Nc2ccccc2C1 Amb27202201 [0,0,0,1,0,0|2,0,1]=4 4318 B12R2.32 ONC1Cc2ccccc2C1 Amb27648605 [0,0,0,1,0,0|2,0,0]=3 4319 B12R2.32 SCC1Cc2ccccc2C1 Amb33342304 [0,0,0,1,0,0|3,0,0]=4 4320 B12R2.32 [C-]#[N+]C1Cc2ccccc2C1 Amb33342897 [0,0,0,1,0,0|1,0,2]=4 4321 B12R2.41 C1=CCc2ccccc2OC1 Amb22585745 [0,0,0,1,0,0|2,0,1]=4 4322 B12R2.41 C1=CNC2=NCCCCC2=C1 Amb25698578 [0,0,0,1,0,0|3,0,0]=4 4323 B12R2.41 C1=Cc2ccccc2CCC1 Amb2383779 [0,0,0,1,0,0|2,0,1]=4 4324 B12R2.41 C1=Cc2ccccc2CCN1 Amb28140661 [0,0,0,1,0,0|1,0,1]=3 4325 B12R2.41 c1cc2c(cn1)CCCCN2 Amb27493609 [0,0,0,1,0,0|3,0,0]=4 4326 B12R2.41 c1cc2c(cn1)NCCCC2 Amb25302725 [0,0,0,1,0,0|3,0,0]=4 4327 B12R2.41 c1cc2c(cn1)NCCCC2 Amb30584700 [0,0,0,1,0,0|3,0,0]=4 4328 B12R2.41 c1ccc2c(c1)CCCCN2 Amb2383457 [0,0,0,1,0,0|2,0,0]=3 4329 B12R2.41 c1ccc2c(c1)CCCCO2 Amb25340494 [0,0,0,1,0,0|2,0,0]=3 4330 B12R2.41 c1ccc2c(c1)CCCNC2 Amb10608887 [0,0,0,1,0,0|3,0,0]=4 4331 B12R2.41 c1ccc2c(c1)CCCNC2 Amb17470382 [0,0,0,1,0,0|3,0,0]=4 4332 B12R2.41 c1ccc2c(c1)CCCOC2 Amb27216707 [0,0,0,1,0,0|3,0,0]=4 4333 B12R2.41 c1ccc2c(c1)CCNCC2 Amb1811889 [0,0,0,1,0,0|1,0,0]=2 4334 B12R2.41 c1ccc2c(c1)CCNCC2 Amb6769007 [0,0,0,1,0,0|1,0,0]=2 4335 B12R2.41 c1ccc2c(c1)CCOCC2 Amb22233129 [0,0,0,1,0,0|2,0,0]=3 4336 B12R2.41 c1ccc2c(c1)CNCCN2 Amb21864900 [0,0,0,1,0,0|3,0,0]=4 4337 B12R2.41 c1ccc2c(c1)CNCCN2 Amb7969771 [0,0,0,1,0,0|3,0,0]=4 4338 B12R2.41 c1ccc2c(c1)CNCCO2 Amb33544399 [0,0,0,1,0,0|3,0,0]=4 4339 B12R2.41 c1ccc2c(c1)CNCCO2 Amb3941249 [0,0,0,1,0,0|3,0,0]=4 4340 B12R2.41 c1ccc2c(c1)CNCCS2 Amb20668198 [0,0,0,1,0,0|3,0,0]=4 4341 B12R2.41 c1ccc2c(c1)CNCCS2 Amb21858414 [0,0,0,1,0,0|3,0,0]=4 4342 B12R2.41 c1ccc2c(c1)COCCN2 Amb22751644 [0,0,0,1,0,0|3,0,0]=4 4343 B12R2.41 c1ccc2c(c1)CSCCN2 Amb24484529 [0,0,0,1,0,0|3,0,0]=4 4344 B12R2.41 c1ccc2c(c1)NCCCN2 Amb10070197 [0,0,0,1,0,0|3,0,0]=4 4345 B12R2.41 c1ccc2c(c1)NCCCO2 Amb13951845 [0,0,0,1,0,0|3,0,0]=4 4346 B12R2.41 c1ccc2c(c1)NCCCO2 Amb31308571 [0,0,0,1,0,0|3,0,0]=4 4347 B12R2.41 c1ccc2c(c1)NCCCS2 Amb32664275 [0,0,0,1,0,0|3,0,0]=4 4348 B12R2.41 c1ccc2c(c1)NCCCS2 Amb419555 [0,0,0,1,0,0|3,0,0]=4 4349 B12R2.41 c1ccc2c(c1)OCCCO2 Amb1397744 [0,0,0,1,0,0|3,0,0]=4 4350 B12R2.41 c1cnc2c(c1)CCCCC2 Amb22347821 [0,0,0,1,0,0|3,0,0]=4 4351 B12R2.41 c1cnc2c(c1)CCCCN2 Amb33544995 [0,0,0,1,0,0|3,0,0]=4 4352 B12R2.41 c1cnc2c(c1)CCNCC2 Amb25152680 [0,0,0,1,0,0|2,0,0]=3 4353 B12R2.41 c1cnc2c(c1)CCOCC2 Amb24359900 [0,0,0,1,0,0|3,0,0]=4 4354 B12R2.41 c1cnc2c(c1)NCCCC2 Amb25981440 [0,0,0,1,0,0|3,0,0]=4 4355 B12R2.41 c1ncc2c(n1)CCNCC2 Amb8011525 [0,0,0,1,0,0|3,0,0]=4 4356 B12R2.115 Br[C@@H]1C[C@H]1c2ccccc2I Amb27618991 [0,0,0,1,0,0|2,1,0]=4 4357 B12R2.115 Brc1ccccc1[C@@H]2C[C@H]2Br Amb27253972 [0,0,0,1,0,0|2,0,0]=3 4358 B12R2.115 CC1CC1c2ccccc2O Amb28246506 [0,0,0,1,0,0|2,0,0]=3 4359 B12R2.115 CC1OC1c2ccccc2F Amb24433748 [0,0,0,1,0,0|2,1,0]=4 4360 B12R2.115 Cc1ccccc1C2CC2Cl Amb27863768 [0,0,0,1,0,0|3,0,0]=4 4361 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,0,0,1,0,0|3,0,0]=4 4362 B12R2.115 Cc1ccccc1C2CC2N Amb9677208 [0,0,0,1,0,0|3,0,0]=4 4363 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,0,0,1,0,0|3,0,0]=4 4364 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb32663427 [0,0,0,1,0,0|3,0,0]=4 4365 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,0,0,1,0,0|2,1,0]=4 4366 B12R2.115 Clc1ccccc1[C@@H]2C[C@H]2Br Amb27814773 [0,0,0,1,0,0|2,1,0]=4 4367 B12R2.115 Fc1ccccc1[C@@H]2C[C@H]2Br Amb27592280 [0,0,0,1,0,0|2,1,0]=4 4368 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,0,0,1,0,0|2,0,0]=3 4369 B12R2.115 NC1CC1c2ccccc2Br Amb9677239 [0,0,0,1,0,0|2,0,0]=3 4370 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,0,0,1,0,0|2,1,0]=4 4371 B12R2.115 NC1CC1c2ccccc2Cl Amb9677226 [0,0,0,1,0,0|2,1,0]=4 4372 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,0,0,1,0,0|2,1,0]=4 4373 B12R2.115 NC1CC1c2ccccc2F Amb9677241 [0,0,0,1,0,0|2,1,0]=4 4374 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,0,0,1,0,0|3,0,0]=4 4375 B12R2.115 NC1CC1c2cccnc2Br Amb33387464 [0,0,0,1,0,0|3,0,0]=4 4376 B12R2.115 NC1CC1c2ccncc2Br Amb33451416 [0,0,0,1,0,0|3,0,0]=4 4377 B12R2.115 NC1CC1c2ncccc2Br Amb33335727 [0,0,0,1,0,0|3,0,0]=4 4378 B12R2.115 NC1OC1c2ccccc2Br Amb28041353 [0,0,0,1,0,0|3,0,0]=4 4379 B12R2.115 N[C@@H]1C[C@@H]1c2ccccc2F Amb34916223 [0,0,0,1,0,0|2,1,0]=4 4380 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Br Amb26055453 [0,0,0,1,0,0|2,0,0]=3 4381 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Br Amb33473602 [0,0,0,1,0,0|2,0,0]=3 4382 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,0,0,1,0,0|2,1,0]=4 4383 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb33473675 [0,0,0,1,0,0|2,1,0]=4 4384 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2F Amb26445730 [0,0,0,1,0,0|2,1,0]=4 4385 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2F Amb32663429 [0,0,0,1,0,0|2,1,0]=4 4386 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2O Amb33197211 [0,0,0,1,0,0|3,0,0]=4 4387 B12R2.115 N[C@@H]1C[C@H]1c2cccnc2Br Amb33387461 [0,0,0,1,0,0|3,0,0]=4 4388 B12R2.115 N[C@@H]1C[C@H]1c2ccncc2Br Amb33388249 [0,0,0,1,0,0|3,0,0]=4 4389 B12R2.115 N[C@@H]1C[C@H]1c2ncccc2Br Amb33335719 [0,0,0,1,0,0|3,0,0]=4 4390 B12R2.196 CC1=CCc2c(F)cccc21 Amb25114614 [0,0,0,1,0,0|1,1,1]=4 4391 B12R2.196 CC1CNc2c(Br)cccc21 Amb26371262 [0,0,0,1,0,0|2,0,0]=3 4392 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,0,0,1,0,0|2,1,0]=4 4393 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,0,0,1,0,0|2,1,0]=4 4394 B12R2.196 CC1CNc2c(N)cccc21 Amb32658300 [0,0,0,1,0,0|3,0,0]=4 4395 B12R2.196 CC1COc2c(F)cccc21 Amb27410107 [0,0,0,1,0,0|2,1,0]=4 4396 B12R2.196 CC1NCc2c(Cl)cccc21 Amb27780174 [0,0,0,1,0,0|2,1,0]=4 4397 B12R2.196 CC1NCc2c(N)cccc21 Amb27764050 [0,0,0,1,0,0|3,0,0]=4 4398 B12R2.196 CN1CCN2C(=O)N=CC=C12 Amb24356794 [0,0,0,1,0,0|3,0,0]=4 4399 B12R2.196 CN1CCc2c(Br)ccnc21 Amb27654064 [0,0,0,1,0,0|1,0,0]=2 4400 B12R2.196 CN1CCc2c(Cl)ccnc21 Amb27231528 [0,0,0,1,0,0|1,1,0]=3 4401 B12R2.196 CN1CCc2c(N)cccc21 Amb18669647 [0,0,0,1,0,0|1,0,0]=2 4402 B12R2.196 CN1CCc2c(O)cccc21 Amb17593716 [0,0,0,1,0,0|1,0,0]=2 4403 B12R2.196 C[C@@H]1NCc2c(F)cccc21 Amb27823682 [0,0,0,1,0,0|2,1,0]=4 4404 B12R2.196 C[C@@H]1NCc2c(I)cccc21 Amb27237017 [0,0,0,1,0,0|2,1,0]=4 4405 B12R2.196 C[C@H]1NCc2c(Br)cccc21 Amb28284902 [0,0,0,1,0,0|2,0,0]=3 4406 B12R2.196 Cc1cccc2c1CCC2=O Amb4605923 [0,0,0,1,0,0|3,0,0]=4 4407 B12R2.196 Cc1cccc2c1CCC2Cl Amb17087981 [0,0,0,1,0,0|3,0,0]=4 4408 B12R2.196 Cc1cccc2c1CCC2F Amb28208696 [0,0,0,1,0,0|3,0,0]=4 4409 B12R2.196 Cc1cccc2c1CCC2N Amb19514831 [0,0,0,1,0,0|3,0,0]=4 4410 B12R2.196 Cc1cccc2c1CCC2N Amb9735877 [0,0,0,1,0,0|3,0,0]=4 4411 B12R2.196 Cc1cccc2c1CCC2O Amb17087931 [0,0,0,1,0,0|3,0,0]=4 4412 B12R2.196 Cc1cccc2c1CCN2C Amb28365675 [0,0,0,1,0,0|1,0,0]=2 4413 B12R2.196 Cc1cccc2c1CC[C@@H]2N Amb31289668 [0,0,0,1,0,0|3,0,0]=4 4414 B12R2.196 Cc1cccc2c1CC[C@H]2N Amb26934915 [0,0,0,1,0,0|3,0,0]=4 4415 B12R2.196 Cc1cccc2c1CNC2C Amb27663354 [0,0,0,1,0,0|3,0,0]=4 4416 B12R2.196 Cc1cccc2c1CN[C@@H]2C Amb27858274 [0,0,0,1,0,0|3,0,0]=4 4417 B12R2.196 Cc1cccc2c1NCC2C Amb17040659 [0,0,0,1,0,0|3,0,0]=4 4418 B12R2.196 Cc1cccc2c1ccn2C Amb9768354 [0,0,0,1,0,0|1,0,2]=4 4419 B12R2.196 Cc1cccc2c1nnn2C Amb23402462 [0,0,0,1,0,0|3,0,0]=4 4420 B12R2.196 Cc1cncc2c1CC[C@@H]2C Amb27227960 [0,0,0,1,0,0|3,0,0]=4 4421 B12R2.196 Cc1coc2c(Br)cccc12 Amb28245157 [0,0,0,1,0,0|2,0,1]=4 4422 B12R2.196 Cc1csc2c(Br)cccc12 Amb22500032 [0,0,0,1,0,0|2,0,1]=4 4423 B12R2.196 Cc1noc2c(Br)cccc12 Amb26373010 [0,0,0,1,0,0|3,0,0]=4 4424 B12R2.196 Cc1nsc2c(Br)cccc12 Amb24432090 [0,0,0,1,0,0|3,0,0]=4 4425 B12R2.196 ClC1CCc2c(Br)cccc21 Amb22059235 [0,0,0,1,0,0|2,0,0]=3 4426 B12R2.196 Clc1cccc2c1CCC2Cl Amb17087984 [0,0,0,1,0,0|2,1,0]=4 4427 B12R2.196 Cn1ccc2c(Br)cccc21 Amb2723832 [0,0,0,1,0,0|0,0,2]=3 4428 B12R2.196 Cn1ccc2c(Br)ccnc21 Amb22496111 [0,0,0,1,0,0|1,0,2]=4 4429 B12R2.196 Cn1ccc2c(Br)cncc21 Amb26424713 [0,0,0,1,0,0|1,0,2]=4 4430 B12R2.196 Cn1ccc2c(Br)nccc21 Amb18175896 [0,0,0,1,0,0|1,0,2]=4 4431 B12R2.196 Cn1ccc2c(Cl)cccc21 Amb22751213 [0,0,0,1,0,0|0,1,2]=4 4432 B12R2.196 Cn1ccc2c(F)cccc21 Amb25348450 [0,0,0,1,0,0|0,1,2]=4 4433 B12R2.196 Cn1ccc2c(I)cccc21 Amb22751214 [0,0,0,1,0,0|0,1,2]=4 4434 B12R2.196 Cn1ccc2c(N)cccc21 Amb22587189 [0,0,0,1,0,0|1,0,2]=4 4435 B12R2.196 Cn1ccc2c(N)cccc21 Amb22741110 [0,0,0,1,0,0|1,0,2]=4 4436 B12R2.196 Cn1ccc2c(N)cccc21 Amb8389568 [0,0,0,1,0,0|1,0,2]=4 4437 B12R2.196 Cn1ccc2c(O)cccc21 Amb13884900 [0,0,0,1,0,0|1,0,2]=4 4438 B12R2.196 Cn1ccc2c(S)cccc21 Amb26974874 [0,0,0,1,0,0|1,0,2]=4 4439 B12R2.196 Cn1cnc2c(Br)cccc21 Amb18176119 [0,0,0,1,0,0|1,0,1]=3 4440 B12R2.196 Cn1cnc2c(Br)cncc21 Amb23559929 [0,0,0,1,0,0|2,0,1]=4 4441 B12R2.196 Cn1cnc2c(Br)nccc21 Amb26024850 [0,0,0,1,0,0|2,0,1]=4 4442 B12R2.196 Cn1cnc2c(Cl)cccc21 Amb21971815 [0,0,0,1,0,0|1,1,1]=4 4443 B12R2.196 Cn1cnc2c(F)cccc21 Amb24487735 [0,0,0,1,0,0|1,1,1]=4 4444 B12R2.196 Cn1cnc2c(I)cccc21 Amb25218000 [0,0,0,1,0,0|1,1,1]=4 4445 B12R2.196 Cn1cnc2c(N)cccc21 Amb2694874 [0,0,0,1,0,0|2,0,1]=4 4446 B12R2.196 Cn1cnc2c(O)cccc21 Amb10561806 [0,0,0,1,0,0|2,0,1]=4 4447 B12R2.196 Cn1cnc2c(O)cccc21 Amb28872308 [0,0,0,1,0,0|2,0,1]=4 4448 B12R2.196 Cn1ncc2c(Br)cccc21 Amb10067306 [0,0,0,1,0,0|1,0,1]=3 4449 B12R2.196 Cn1ncc2c(Br)ccnc21 Amb20407310 [0,0,0,1,0,0|2,0,1]=4 4450 B12R2.196 Cn1ncc2c(Br)cncc21 Amb21856883 [0,0,0,1,0,0|2,0,1]=4 4451 B12R2.196 Cn1ncc2c(Cl)cccc21 Amb10069418 [0,0,0,1,0,0|1,1,1]=4 4452 B12R2.196 Cn1ncc2c(F)cccc21 Amb21864867 [0,0,0,1,0,0|1,1,1]=4 4453 B12R2.196 Cn1ncc2c(I)cccc21 Amb19958177 [0,0,0,1,0,0|1,1,1]=4 4454 B12R2.196 Cn1ncc2c(N)cccc21 Amb8630405 [0,0,0,1,0,0|2,0,1]=4 4455 B12R2.196 Cn1ncc2c(O)cccc21 Amb10070481 [0,0,0,1,0,0|2,0,1]=4 4456 B12R2.196 Cn1nnc2c(Br)cccc21 Amb23580646 [0,0,0,1,0,0|2,0,0]=3 4457 B12R2.196 Cn1nnc2c(Br)cncc21 Amb23559939 [0,0,0,1,0,0|3,0,0]=4 4458 B12R2.196 Cn1nnc2c(I)cccc21 Amb32685586 [0,0,0,1,0,0|2,1,0]=4 4459 B12R2.196 Cn1nnc2c(N)cccc21 Amb19516892 [0,0,0,1,0,0|3,0,0]=4 4460 B12R2.196 Cn1nnc2c(O)cccc21 Amb27836781 [0,0,0,1,0,0|3,0,0]=4 4461 B12R2.196 FC1CCc2c(Br)cccc21 Amb27816681 [0,0,0,1,0,0|2,0,0]=3 4462 B12R2.196 FC1CCc2c(Cl)cccc21 Amb27794950 [0,0,0,1,0,0|2,1,0]=4 4463 B12R2.196 Fc1cccc2c1CCC2Br Amb20623563 [0,0,0,1,0,0|2,1,0]=4 4464 B12R2.196 Fc1cccc2c1CCC2Cl Amb33538441 [0,0,0,1,0,0|2,1,0]=4 4465 B12R2.196 Fc1cccc2c1CCC2S Amb27643018 [0,0,0,1,0,0|2,1,0]=4 4466 B12R2.196 NC1CCc2c(Br)cccc21 Amb19342600 [0,0,0,1,0,0|2,0,0]=3 4467 B12R2.196 NC1CCc2c(Br)cccc21 Amb6683470 [0,0,0,1,0,0|2,0,0]=3 4468 B12R2.196 NC1CCc2c(Br)cncc21 Amb27805487 [0,0,0,1,0,0|3,0,0]=4 4469 B12R2.196 NC1CCc2c(Cl)cccc21 Amb10609924 [0,0,0,1,0,0|2,1,0]=4 4470 B12R2.196 NC1CCc2c(Cl)cccc21 Amb2383228 [0,0,0,1,0,0|2,1,0]=4 4471 B12R2.196 NC1CCc2c(F)cccc21 Amb10609944 [0,0,0,1,0,0|2,1,0]=4 4472 B12R2.196 NC1CCc2c(F)cccc21 Amb9735878 [0,0,0,1,0,0|2,1,0]=4 4473 B12R2.196 NC1CCc2c(O)cccc21 Amb32661676 [0,0,0,1,0,0|3,0,0]=4 4474 B12R2.196 NC1CCc2c(O)cccc21 Amb9725461 [0,0,0,1,0,0|3,0,0]=4 4475 B12R2.196 NC1COc2c(Br)cccc21 Amb31028992 [0,0,0,1,0,0|3,0,0]=4 4476 B12R2.196 NC1COc2c(Br)cccc21 Amb6683475 [0,0,0,1,0,0|3,0,0]=4 4477 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb22288665 [0,0,0,1,0,0|2,0,0]=3 4478 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb27230466 [0,0,0,1,0,0|2,0,0]=3 4479 B12R2.196 N[C@@H]1CCc2c(Cl)cccc21 Amb13953028 [0,0,0,1,0,0|2,1,0]=4 4480 B12R2.196 N[C@@H]1CCc2c(Cl)cccc21 Amb31289675 [0,0,0,1,0,0|2,1,0]=4 4481 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22288666 [0,0,0,1,0,0|2,1,0]=4 4482 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22746050 [0,0,0,1,0,0|2,1,0]=4 4483 B12R2.196 N[C@@H]1CCc2c(O)cccc21 Amb2699155 [0,0,0,1,0,0|3,0,0]=4 4484 B12R2.196 N[C@@H]1COc2c(Br)cccc21 Amb31028978 [0,0,0,1,0,0|3,0,0]=4 4485 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb22288709 [0,0,0,1,0,0|2,0,0]=3 4486 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb27794553 [0,0,0,1,0,0|2,0,0]=3 4487 B12R2.196 N[C@H]1CCc2c(Cl)cccc21 Amb13953027 [0,0,0,1,0,0|2,1,0]=4 4488 B12R2.196 N[C@H]1CCc2c(Cl)cccc21 Amb33457339 [0,0,0,1,0,0|2,1,0]=4 4489 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb16233799 [0,0,0,1,0,0|2,1,0]=4 4490 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb22388651 [0,0,0,1,0,0|2,1,0]=4 4491 B12R2.196 N[C@H]1CCc2c(I)cccc21 Amb27945476 [0,0,0,1,0,0|2,1,0]=4 4492 B12R2.196 N[C@H]1CCc2c(O)cccc21 Amb2699154 [0,0,0,1,0,0|3,0,0]=4 4493 B12R2.196 N[C@H]1CCc2c(S)cccc21 Amb27461350 [0,0,0,1,0,0|3,0,0]=4 4494 B12R2.196 N[C@H]1COc2c(Br)cccc21 Amb26395931 [0,0,0,1,0,0|3,0,0]=4 4495 B12R2.196 Nc1cccc2c1CCC2=O Amb10067615 [0,0,0,1,0,0|3,0,0]=4 4496 B12R2.196 Nc1cccc2c1CC[C@@H]2N Amb28145068 [0,0,0,1,0,0|3,0,0]=4 4497 B12R2.196 O=C1CCc2c(Br)cccc21 Amb6683468 [0,0,0,1,0,0|2,0,0]=3 4498 B12R2.196 O=C1CCc2c(Br)cncc21 Amb27968458 [0,0,0,1,0,0|3,0,0]=4 4499 B12R2.196 O=C1CCc2c(Cl)cccc21 Amb2383535 [0,0,0,1,0,0|2,1,0]=4 4500 B12R2.196 O=C1CCc2c(F)cccc21 Amb2383536 [0,0,0,1,0,0|2,1,0]=4 4501 B12R2.196 O=C1CCc2c(O)cccc21 Amb1158068 [0,0,0,1,0,0|3,0,0]=4 4502 B12R2.196 O=C1COc2c(Br)cccc21 Amb33534390 [0,0,0,1,0,0|3,0,0]=4 4503 B12R2.196 O=C1CSc2c(Br)cccc21 Amb18159421 [0,0,0,1,0,0|3,0,0]=4 4504 B12R2.196 O=C1NCc2c(Br)cccc21 Amb15693064 [0,0,0,1,0,0|3,0,0]=4 4505 B12R2.196 O=C1OCc2c(Br)cccc21 Amb6296519 [0,0,0,1,0,0|3,0,0]=4 4506 B12R2.196 OB1OCc2c(Br)cccc21 Amb27153180 [0,0,0,1,0,0|3,0,0]=4 4507 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,0,0,1,0,0|2,0,0]=3 4508 B12R2.196 OC1CCc2c(Br)cncc21 Amb26337804 [0,0,0,1,0,0|3,0,0]=4 4509 B12R2.196 OC1CCc2c(Cl)cccc21 Amb17087934 [0,0,0,1,0,0|2,1,0]=4 4510 B12R2.196 OC1CCc2c(F)cccc21 Amb17087933 [0,0,0,1,0,0|2,1,0]=4 4511 B12R2.196 OC1COc2c(Br)cccc21 Amb22751583 [0,0,0,1,0,0|3,0,0]=4 4512 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,0,0,1,0,0|2,0,0]=3 4513 B12R2.196 O[C@@H]1CCc2c(Cl)cccc21 Amb13953026 [0,0,0,1,0,0|2,1,0]=4 4514 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,0,0,1,0,0|2,1,0]=4 4515 B12R2.196 O[C@H]1CCc2c(Br)cccc21 Amb27596691 [0,0,0,1,0,0|2,0,0]=3 4516 B12R2.196 O[C@H]1CCc2c(Cl)cccc21 Amb13953025 [0,0,0,1,0,0|2,1,0]=4 4517 B12R2.196 O[C@H]1CCc2c(F)cccc21 Amb27664626 [0,0,0,1,0,0|2,1,0]=4 4518 B12R2.196 Oc1cccc2c1CCC2S Amb32788536 [0,0,0,1,0,0|3,0,0]=4 4519 B12R2.196 Oc1cccc2c1CCN2O Amb27971133 [0,0,0,1,0,0|2,0,0]=3 4520 B12R2.196 SC1CCc2c(Br)cccc21 Amb24352616 [0,0,0,1,0,0|2,0,0]=3 4521 B12R2.225 Brc1ccccc1CC2CO2 Amb25890766 [0,0,0,1,0,0|1,0,0]=2 4522 B12R2.225 Brc1ccccc1NC2CC2 Amb25922951 [0,0,0,1,0,0|2,0,0]=3 4523 B12R2.225 Brc1ccccc1OC2CC2 Amb25771923 [0,0,0,1,0,0|2,0,0]=3 4524 B12R2.225 Brc1ccccc1SC2CC2 Amb26505970 [0,0,0,1,0,0|2,0,0]=3 4525 B12R2.225 Brc1cccnc1CC2CO2 Amb33336088 [0,0,0,1,0,0|2,0,0]=3 4526 B12R2.225 Brc1cccnc1NC2CC2 Amb18282851 [0,0,0,1,0,0|3,0,0]=4 4527 B12R2.225 Brc1cccnc1OC2CC2 Amb27963689 [0,0,0,1,0,0|3,0,0]=4 4528 B12R2.225 Brc1ccncc1OC2CC2 Amb25890502 [0,0,0,1,0,0|3,0,0]=4 4529 B12R2.225 Brc1cnccc1CC2CO2 Amb33388630 [0,0,0,1,0,0|2,0,0]=3 4530 B12R2.225 Brc1cnccc1NC2CC2 Amb27485101 [0,0,0,1,0,0|3,0,0]=4 4531 B12R2.225 Brc1cnccc1OC2CC2 Amb28186461 [0,0,0,1,0,0|3,0,0]=4 4532 B12R2.225 Brc1ncccc1CC2CO2 Amb33387840 [0,0,0,1,0,0|2,0,0]=3 4533 B12R2.225 Brc1ncccc1OC2CC2 Amb28129826 [0,0,0,1,0,0|3,0,0]=4 4534 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,0,0,1,0,0|2,0,0]=3 4535 B12R2.225 Cc1ccccc1NC2CC2 Amb27593469 [0,0,0,1,0,0|3,0,0]=4 4536 B12R2.225 Cc1cccnc1CC2CO2 Amb33428741 [0,0,0,1,0,0|3,0,0]=4 4537 B12R2.225 Cc1ccncc1CC2CO2 Amb25784408 [0,0,0,1,0,0|3,0,0]=4 4538 B12R2.225 Cc1cnccc1CC2CO2 Amb33424633 [0,0,0,1,0,0|3,0,0]=4 4539 B12R2.225 Cc1ncccc1CC2CO2 Amb32879704 [0,0,0,1,0,0|3,0,0]=4 4540 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,0,0,1,0,0|1,1,0]=3 4541 B12R2.225 Clc1ccccc1OC2CC2 Amb27664627 [0,0,0,1,0,0|2,1,0]=4 4542 B12R2.225 Clc1cnccc1CC2CO2 Amb33413587 [0,0,0,1,0,0|2,1,0]=4 4543 B12R2.225 Clc1ncccc1CC2CO2 Amb33257354 [0,0,0,1,0,0|2,1,0]=4 4544 B12R2.225 Fc1ccccc1CC2CO2 Amb27839801 [0,0,0,1,0,0|1,1,0]=3 4545 B12R2.225 Fc1ccccc1OC2CC2 Amb26871851 [0,0,0,1,0,0|2,1,0]=4 4546 B12R2.225 Fc1ccccc1SC2CC2 Amb24717992 [0,0,0,1,0,0|2,1,0]=4 4547 B12R2.225 Fc1cccnc1CC2CO2 Amb33418781 [0,0,0,1,0,0|2,1,0]=4 4548 B12R2.225 Fc1cnccc1CC2CO2 Amb26637281 [0,0,0,1,0,0|2,1,0]=4 4549 B12R2.225 Fc1ncccc1CC2CO2 Amb33377201 [0,0,0,1,0,0|2,1,0]=4 4550 B12R2.225 Ic1ccccc1OC2CC2 Amb25940708 [0,0,0,1,0,0|2,1,0]=4 4551 B12R2.225 Nc1ccccc1CC2CC2 Amb24117001 [0,0,0,1,0,0|2,0,0]=3 4552 B12R2.225 Nc1ccccc1NC2CC2 Amb28960308 [0,0,0,1,0,0|3,0,0]=4 4553 B12R2.225 Nc1ccccc1NC2CC2 Amb9205213 [0,0,0,1,0,0|3,0,0]=4 4554 B12R2.225 Nc1ccccc1OC2CC2 Amb26322391 [0,0,0,1,0,0|3,0,0]=4 4555 B12R2.225 Nc1ccccc1SC2CC2 Amb25302953 [0,0,0,1,0,0|3,0,0]=4 4556 B12R2.225 Nc1ccncc1CC2CC2 Amb27448590 [0,0,0,1,0,0|3,0,0]=4 4557 B12R2.225 Oc1ccccc1CC2CC2 Amb22752448 [0,0,0,1,0,0|2,0,0]=3 4558 B12R2.225 Oc1ccccc1OC2CC2 Amb8390104 [0,0,0,1,0,0|3,0,0]=4 4559 B12R2.306 N#CC1Cc2c(Cl)cccc21 Amb27210977 [0,0,0,1,0,0|2,1,0]=4 4560 B12R2.306 N#CC1Cc2c(F)cccc21 Amb27840369 [0,0,0,1,0,0|2,1,0]=4 4561 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,0,0,1,0,0|1,0,0]=2 4562 B12R2.517 Brc1ccccc1C2CCN2 Amb27871922 [0,0,0,1,0,0|2,0,0]=3 4563 B12R2.517 Brc1ccccc1C2CCO2 Amb32992865 [0,0,0,1,0,0|2,0,0]=3 4564 B12R2.517 Brc1ccccc1C2CNC2 Amb27441459 [0,0,0,1,0,0|0,0,0]=1 4565 B12R2.517 Brc1ccccc1C2CNC2 Amb27614578 [0,0,0,1,0,0|0,0,0]=1 4566 B12R2.517 Brc1ccccc1C2COC2 Amb28348738 [0,0,0,1,0,0|1,0,0]=2 4567 B12R2.517 Brc1cccnc1C2CCN2 Amb25890769 [0,0,0,1,0,0|3,0,0]=4 4568 B12R2.517 Brc1cccnc1C2CNC2 Amb25971531 [0,0,0,1,0,0|1,0,0]=2 4569 B12R2.517 Brc1ccncc1C2CCC2 Amb20617516 [0,0,0,1,0,0|2,0,0]=3 4570 B12R2.517 Brc1ccncc1C2CCN2 Amb27393487 [0,0,0,1,0,0|3,0,0]=4 4571 B12R2.517 Brc1cnccc1C2CCN2 Amb25103778 [0,0,0,1,0,0|3,0,0]=4 4572 B12R2.517 Brc1cnccc1C2CCO2 Amb25891761 [0,0,0,1,0,0|3,0,0]=4 4573 B12R2.517 Brc1cnccc1C2CNC2 Amb25923131 [0,0,0,1,0,0|1,0,0]=2 4574 B12R2.517 Brc1cnccc1[C@@H]2CCN2 Amb27605977 [0,0,0,1,0,0|3,0,0]=4 4575 B12R2.517 Brc1cnncc1C2CCC2 Amb18169808 [0,0,0,1,0,0|3,0,0]=4 4576 B12R2.517 Brc1ncccc1C2CCC2 Amb24319276 [0,0,0,1,0,0|2,0,0]=3 4577 B12R2.517 Brc1ncccc1C2CCN2 Amb24663934 [0,0,0,1,0,0|3,0,0]=4 4578 B12R2.517 Brc1ncccc1C2CNC2 Amb25952152 [0,0,0,1,0,0|1,0,0]=2 4579 B12R2.517 Brc1ncncc1C2CCC2 Amb24323119 [0,0,0,1,0,0|3,0,0]=4 4580 B12R2.517 Cc1ccccc1C2CCN2 Amb26505394 [0,0,0,1,0,0|3,0,0]=4 4581 B12R2.517 Cc1ccccc1C2CNC2 Amb18065237 [0,0,0,1,0,0|1,0,0]=2 4582 B12R2.517 Cc1ccccc1C2COC2 Amb28070666 [0,0,0,1,0,0|2,0,0]=3 4583 B12R2.517 Cc1cccnc1C2CNC2 Amb27841823 [0,0,0,1,0,0|2,0,0]=3 4584 B12R2.517 Cc1ccncc1C2CNC2 Amb25807999 [0,0,0,1,0,0|2,0,0]=3 4585 B12R2.517 Cc1cnccc1C2CNC2 Amb27149393 [0,0,0,1,0,0|2,0,0]=3 4586 B12R2.517 Cc1ncccc1C2CNC2 Amb26638984 [0,0,0,1,0,0|2,0,0]=3 4587 B12R2.517 Cc1nccnc1C2CNC2 Amb33143011 [0,0,0,1,0,0|3,0,0]=4 4588 B12R2.517 Cc1ncncc1C2CNC2 Amb33465815 [0,0,0,1,0,0|3,0,0]=4 4589 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,0,0,1,0,0|2,1,0]=4 4590 B12R2.517 Clc1ccccc1C2CNC2 Amb18563825 [0,0,0,1,0,0|0,1,0]=2 4591 B12R2.517 Clc1ccccc1C2CNC2 Amb30588621 [0,0,0,1,0,0|0,1,0]=2 4592 B12R2.517 Clc1ccccc1[C@H]2CCN2 Amb27975768 [0,0,0,1,0,0|2,1,0]=4 4593 B12R2.517 Clc1cccnc1C2CCC2 Amb24082820 [0,0,0,1,0,0|2,1,0]=4 4594 B12R2.517 Clc1ccncc1C2CNC2 Amb28254469 [0,0,0,1,0,0|1,1,0]=3 4595 B12R2.517 Clc1cnccc1C2CNC2 Amb27251523 [0,0,0,1,0,0|1,1,0]=3 4596 B12R2.517 Clc1ncccc1C2CCC2 Amb24319277 [0,0,0,1,0,0|2,1,0]=4 4597 B12R2.517 Clc1ncccc1C2CNC2 Amb26573624 [0,0,0,1,0,0|1,1,0]=3 4598 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,0,0,1,0,0|2,1,0]=4 4599 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,0,0,1,0,0|2,1,0]=4 4600 B12R2.517 Fc1ccccc1C2CNC2 Amb18065350 [0,0,0,1,0,0|0,1,0]=2 4601 B12R2.517 Fc1ccccc1C2CNC2 Amb32661026 [0,0,0,1,0,0|0,1,0]=2 4602 B12R2.517 Fc1ccccc1C2CNC2 Amb33552598 [0,0,0,1,0,0|0,1,0]=2 4603 B12R2.517 Fc1ccccc1[C@H]2CCN2 Amb28072859 [0,0,0,1,0,0|2,1,0]=4 4604 B12R2.517 Fc1cccnc1C2CNC2 Amb27165264 [0,0,0,1,0,0|1,1,0]=3 4605 B12R2.517 Fc1cnccc1C2CNC2 Amb27949148 [0,0,0,1,0,0|1,1,0]=3 4606 B12R2.517 Fc1ncccc1C2CNC2 Amb26357254 [0,0,0,1,0,0|1,1,0]=3 4607 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,0,0,1,0,0|2,1,0]=4 4608 B12R2.517 Ic1ccccc1C2COC2 Amb25871542 [0,0,0,1,0,0|1,1,0]=3 4609 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,0,0,1,0,0|2,0,0]=3 4610 B12R2.517 Nc1ccccc1C2CCC2 Amb31156619 [0,0,0,1,0,0|2,0,0]=3 4611 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,0,0,1,0,0|3,0,0]=4 4612 B12R2.517 Nc1cccnc1C2CCC2 Amb22737142 [0,0,0,1,0,0|3,0,0]=4 4613 B12R2.517 Nc1ncccc1C2CCC2 Amb24319278 [0,0,0,1,0,0|3,0,0]=4 4614 B12R2.517 Nc1ncccc1C2CNC2 Amb28188909 [0,0,0,1,0,0|2,0,0]=3 4615 B12R2.517 O=C1C=CC=CN1C2CNC2 Amb31031268 [0,0,0,1,0,0|2,0,0]=3 4616 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,0,0,1,0,0|2,0,0]=3 4617 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,0,0,1,0,0|3,0,0]=4 4618 B12R2.517 Oc1ccccc1C2CCO2 Amb32641912 [0,0,0,1,0,0|3,0,0]=4 4619 B12R2.517 Oc1ccccc1C2CNC2 Amb22228635 [0,0,0,1,0,0|1,0,0]=2 4620 B12R2.517 Oc1ccccc1C2COC2 Amb22737352 [0,0,0,1,0,0|2,0,0]=3 4621 B12R2.517 Sc1ccccc1C2CCN2 Amb27948429 [0,0,0,1,0,0|3,0,0]=4 4622 B12R2.517 Sc1ccccc1C2CNC2 Amb27862428 [0,0,0,1,0,0|1,0,0]=2 4623 B12R2.517 Sc1ncccc1C2CNC2 Amb27393847 [0,0,0,1,0,0|2,0,0]=3 4624 B12R2.931 BrCCC1Cc2ccccc21 Amb28060024 [0,0,0,1,0,0|3,0,0]=4 4625 B12R2.931 CCNC1Cc2ccccc21 Amb27840306 [0,0,0,1,0,0|3,0,0]=4 4626 B12R2.931 ClCCC1Cc2ccccc21 Amb27260584 [0,0,0,1,0,0|3,0,0]=4 4627 B12R2.931 N#CCC1Cc2ccccc21 Amb27780963 [0,0,0,1,0,0|3,0,0]=4 4628 B12R2.1081 Brc1cccc2c1CCC=C2 Amb22500941 [0,0,0,1,0,0|1,0,1]=3 4629 B12R2.1081 Brc1cccc2c1CCCC2 Amb5494140 [0,0,0,1,0,0|1,0,0]=2 4630 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,0,0,1,0,0|2,0,0]=3 4631 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,0,0,1,0,0|2,0,0]=3 4632 B12R2.1081 Brc1cccc2c1CCCO2 Amb24081434 [0,0,0,1,0,0|2,0,0]=3 4633 B12R2.1081 Brc1cccc2c1CCCS2 Amb28292948 [0,0,0,1,0,0|2,0,0]=3 4634 B12R2.1081 Brc1cccc2c1CCN=C2 Amb26071625 [0,0,0,1,0,0|0,0,2]=3 4635 B12R2.1081 Brc1cccc2c1CCNC2 Amb33532120 [0,0,0,1,0,0|0,0,0]=1 4636 B12R2.1081 Brc1cccc2c1CCNC2 Amb8631550 [0,0,0,1,0,0|0,0,0]=1 4637 B12R2.1081 Brc1cccc2c1CCOC2 Amb26887629 [0,0,0,1,0,0|1,0,0]=2 4638 B12R2.1081 Brc1cccc2c1CNCC2 Amb10603937 [0,0,0,1,0,0|2,0,0]=3 4639 B12R2.1081 Brc1cccc2c1CNCC2 Amb18131355 [0,0,0,1,0,0|2,0,0]=3 4640 B12R2.1081 Brc1cccc2c1COCC2 Amb22886734 [0,0,0,1,0,0|2,0,0]=3 4641 B12R2.1081 Brc1cccc2c1COCO2 Amb26565178 [0,0,0,1,0,0|3,0,0]=4 4642 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,0,0,1,0,0|2,0,0]=3 4643 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,0,0,1,0,0|2,0,0]=3 4644 B12R2.1081 Brc1cccc2c1NCCO2 Amb28075686 [0,0,0,1,0,0|3,0,0]=4 4645 B12R2.1081 Brc1cccc2c1NCCS2 Amb22491567 [0,0,0,1,0,0|3,0,0]=4 4646 B12R2.1081 Brc1cccc2c1OCCC2 Amb18769314 [0,0,0,1,0,0|2,0,0]=3 4647 B12R2.1081 Brc1cccc2c1OCCN2 Amb21964594 [0,0,0,1,0,0|3,0,0]=4 4648 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,0,0,1,0,0|3,0,0]=4 4649 B12R2.1081 Brc1cccc2c1OCCO2 Amb20171376 [0,0,0,1,0,0|3,0,0]=4 4650 B12R2.1081 Brc1cccc2c1SCCC2 Amb18161542 [0,0,0,1,0,0|2,0,0]=3 4651 B12R2.1081 Brc1cccc2c1SCCN2 Amb25715188 [0,0,0,1,0,0|3,0,0]=4 4652 B12R2.1081 Brc1ccnc2c1CCCC2 Amb24519031 [0,0,0,1,0,0|2,0,0]=3 4653 B12R2.1081 Brc1ccnc2c1CCCN2 Amb26371025 [0,0,0,1,0,0|3,0,0]=4 4654 B12R2.1081 Brc1ccnc2c1CCNC2 Amb24451051 [0,0,0,1,0,0|1,0,0]=2 4655 B12R2.1081 Brc1ccnc2c1CCNC2 Amb32666736 [0,0,0,1,0,0|1,0,0]=2 4656 B12R2.1081 Brc1ccnc2c1CNCC2 Amb27643477 [0,0,0,1,0,0|3,0,0]=4 4657 B12R2.1081 Brc1ccnc2c1CNCC2 Amb32664383 [0,0,0,1,0,0|3,0,0]=4 4658 B12R2.1081 Brc1cncc2c1CCCC2 Amb33549226 [0,0,0,1,0,0|2,0,0]=3 4659 B12R2.1081 Brc1cncc2c1CCCN2 Amb10602840 [0,0,0,1,0,0|3,0,0]=4 4660 B12R2.1081 Brc1cncc2c1CCCO2 Amb28384757 [0,0,0,1,0,0|3,0,0]=4 4661 B12R2.1081 Brc1cncc2c1CCNC2 Amb18173750 [0,0,0,1,0,0|1,0,0]=2 4662 B12R2.1081 Brc1cncc2c1CNCC2 Amb31028910 [0,0,0,1,0,0|3,0,0]=4 4663 B12R2.1081 Brc1cncc2c1COCC2 Amb27958984 [0,0,0,1,0,0|3,0,0]=4 4664 B12R2.1081 Brc1cncc2c1CSCC2 Amb28129399 [0,0,0,1,0,0|3,0,0]=4 4665 B12R2.1081 Brc1cncc2c1NCCC2 Amb9174241 [0,0,0,1,0,0|3,0,0]=4 4666 B12R2.1081 Brc1nccc2c1CCCC2 Amb23439886 [0,0,0,1,0,0|2,0,0]=3 4667 B12R2.1081 Cc1cccc2c1CCCC2 Amb22731111 [0,0,0,1,0,0|2,0,0]=3 4668 B12R2.1081 Cc1cccc2c1CCCN2 Amb19957907 [0,0,0,1,0,0|3,0,0]=4 4669 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,0,0,1,0,0|3,0,0]=4 4670 B12R2.1081 Cc1cccc2c1CCCO2 Amb27169746 [0,0,0,1,0,0|3,0,0]=4 4671 B12R2.1081 Cc1cccc2c1CCCS2 Amb27447859 [0,0,0,1,0,0|3,0,0]=4 4672 B12R2.1081 Cc1cccc2c1CCNC2 Amb19373251 [0,0,0,1,0,0|1,0,0]=2 4673 B12R2.1081 Cc1cccc2c1CCNC2 Amb2383355 [0,0,0,1,0,0|1,0,0]=2 4674 B12R2.1081 Cc1cccc2c1CCOC2 Amb24743009 [0,0,0,1,0,0|2,0,0]=3 4675 B12R2.1081 Cc1cccc2c1CNCC2 Amb17194044 [0,0,0,1,0,0|3,0,0]=4 4676 B12R2.1081 Cc1cccc2c1CNCC2 Amb22500762 [0,0,0,1,0,0|3,0,0]=4 4677 B12R2.1081 Cc1cccc2c1COCC2 Amb26594560 [0,0,0,1,0,0|3,0,0]=4 4678 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,0,0,1,0,0|3,0,0]=4 4679 B12R2.1081 Cc1ccnc2c1CCCC2 Amb27983518 [0,0,0,1,0,0|3,0,0]=4 4680 B12R2.1081 Cc1ncnc2c1CCNC2 Amb19958482 [0,0,0,1,0,0|3,0,0]=4 4681 B12R2.1081 Cc1ncnc2c1CCNC2 Amb27244733 [0,0,0,1,0,0|3,0,0]=4 4682 B12R2.1081 Clc1cccc2c1CCC=C2 Amb2383775 [0,0,0,1,0,0|1,1,1]=4 4683 B12R2.1081 Clc1cccc2c1CCCN2 Amb19957902 [0,0,0,1,0,0|2,1,0]=4 4684 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,0,0,1,0,0|2,1,0]=4 4685 B12R2.1081 Clc1cccc2c1CCCS2 Amb27184149 [0,0,0,1,0,0|2,1,0]=4 4686 B12R2.1081 Clc1cccc2c1CCNC2 Amb13948964 [0,0,0,1,0,0|0,1,0]=2 4687 B12R2.1081 Clc1cccc2c1CCNC2 Amb2383349 [0,0,0,1,0,0|0,1,0]=2 4688 B12R2.1081 Clc1cccc2c1CCOC2 Amb25974039 [0,0,0,1,0,0|1,1,0]=3 4689 B12R2.1081 Clc1cccc2c1CNCC2 Amb10067198 [0,0,0,1,0,0|2,1,0]=4 4690 B12R2.1081 Clc1cccc2c1CNCC2 Amb19889644 [0,0,0,1,0,0|2,1,0]=4 4691 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,0,0,1,0,0|2,1,0]=4 4692 B12R2.1081 Clc1cccc2c1NCCC2 Amb19373263 [0,0,0,1,0,0|2,1,0]=4 4693 B12R2.1081 Clc1cccc2c1OCCC2 Amb27831935 [0,0,0,1,0,0|2,1,0]=4 4694 B12R2.1081 Clc1cccc2c1SCCC2 Amb28203721 [0,0,0,1,0,0|2,1,0]=4 4695 B12R2.1081 Clc1ccnc2c1CCCC2 Amb21857662 [0,0,0,1,0,0|2,1,0]=4 4696 B12R2.1081 Clc1ccnc2c1CCNC2 Amb26072253 [0,0,0,1,0,0|1,1,0]=3 4697 B12R2.1081 Clc1nccc2c1CCCC2 Amb24684179 [0,0,0,1,0,0|2,1,0]=4 4698 B12R2.1081 Clc1nccc2c1CCNC2 Amb28423919 [0,0,0,1,0,0|1,1,0]=3 4699 B12R2.1081 Clc1nccc2c1CCNC2 Amb33331064 [0,0,0,1,0,0|1,1,0]=3 4700 B12R2.1081 Clc1ncnc2c1CCNC2 Amb20241718 [0,0,0,1,0,0|2,1,0]=4 4701 B12R2.1081 Clc1ncnc2c1CCNC2 Amb31378653 [0,0,0,1,0,0|2,1,0]=4 4702 B12R2.1081 Fc1cccc2c1CCC=C2 Amb2383776 [0,0,0,1,0,0|1,1,1]=4 4703 B12R2.1081 Fc1cccc2c1CCCN2 Amb19958505 [0,0,0,1,0,0|2,1,0]=4 4704 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,0,0,1,0,0|2,1,0]=4 4705 B12R2.1081 Fc1cccc2c1CCNC2 Amb21858226 [0,0,0,1,0,0|0,1,0]=2 4706 B12R2.1081 Fc1cccc2c1CCNC2 Amb33532115 [0,0,0,1,0,0|0,1,0]=2 4707 B12R2.1081 Fc1cccc2c1CCOC2 Amb25773904 [0,0,0,1,0,0|1,1,0]=3 4708 B12R2.1081 Fc1cccc2c1CNCC2 Amb17194043 [0,0,0,1,0,0|2,1,0]=4 4709 B12R2.1081 Fc1cccc2c1CNCC2 Amb22232787 [0,0,0,1,0,0|2,1,0]=4 4710 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,0,0,1,0,0|2,1,0]=4 4711 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,0,0,1,0,0|2,1,0]=4 4712 B12R2.1081 Fc1cccc2c1OCCC2 Amb24554425 [0,0,0,1,0,0|2,1,0]=4 4713 B12R2.1081 Ic1cccc2c1CCCC2 Amb8839224 [0,0,0,1,0,0|1,1,0]=3 4714 B12R2.1081 Ic1cccc2c1CCNC2 Amb2383357 [0,0,0,1,0,0|0,1,0]=2 4715 B12R2.1081 Ic1cccc2c1CNCC2 Amb24756500 [0,0,0,1,0,0|2,1,0]=4 4716 B12R2.1081 Ic1cccc2c1COCC2 Amb25324648 [0,0,0,1,0,0|2,1,0]=4 4717 B12R2.1081 Ic1cccc2c1OCCC2 Amb25875739 [0,0,0,1,0,0|2,1,0]=4 4718 B12R2.1081 Nc1cccc2c1CC=CC2 Amb17593645 [0,0,0,1,0,0|2,0,1]=4 4719 B12R2.1081 Nc1cccc2c1CCCC2 Amb1088906 [0,0,0,1,0,0|2,0,0]=3 4720 B12R2.1081 Nc1cccc2c1CCCN2 Amb33543645 [0,0,0,1,0,0|3,0,0]=4 4721 B12R2.1081 Nc1cccc2c1CCCO2 Amb17570000 [0,0,0,1,0,0|3,0,0]=4 4722 B12R2.1081 Nc1cccc2c1CCCO2 Amb31291594 [0,0,0,1,0,0|3,0,0]=4 4723 B12R2.1081 Nc1cccc2c1CCCS2 Amb27868696 [0,0,0,1,0,0|3,0,0]=4 4724 B12R2.1081 Nc1cccc2c1CCNC2 Amb10067205 [0,0,0,1,0,0|1,0,0]=2 4725 B12R2.1081 Nc1cccc2c1CCNC2 Amb21858678 [0,0,0,1,0,0|1,0,0]=2 4726 B12R2.1081 Nc1cccc2c1CCOC2 Amb25869808 [0,0,0,1,0,0|2,0,0]=3 4727 B12R2.1081 Nc1cccc2c1CCOC2 Amb33620938 [0,0,0,1,0,0|2,0,0]=3 4728 B12R2.1081 Nc1cccc2c1CNCC2 Amb18355098 [0,0,0,1,0,0|3,0,0]=4 4729 B12R2.1081 Nc1cccc2c1CNCC2 Amb30586521 [0,0,0,1,0,0|3,0,0]=4 4730 B12R2.1081 Nc1cccc2c1CNNC2 Amb32668355 [0,0,0,1,0,0|2,0,0]=3 4731 B12R2.1081 Nc1cccc2c1COCC2 Amb25330800 [0,0,0,1,0,0|3,0,0]=4 4732 B12R2.1081 Nc1cccc2c1COCC2 Amb28653003 [0,0,0,1,0,0|3,0,0]=4 4733 B12R2.1081 Nc1cccc2c1NCCC2 Amb2606143 [0,0,0,1,0,0|3,0,0]=4 4734 B12R2.1081 Nc1cccc2c1OCCC2 Amb17569999 [0,0,0,1,0,0|3,0,0]=4 4735 B12R2.1081 Nc1cccc2c1OCCC2 Amb28652885 [0,0,0,1,0,0|3,0,0]=4 4736 B12R2.1081 Nc1cccc2c1OCOC2 Amb17570008 [0,0,0,1,0,0|3,0,0]=4 4737 B12R2.1081 Nc1ccnc2c1CCCC2 Amb33456343 [0,0,0,1,0,0|3,0,0]=4 4738 B12R2.1081 Nc1ccnc2c1CCCC2 Amb33544883 [0,0,0,1,0,0|3,0,0]=4 4739 B12R2.1081 Nc1cncc2c1CCCC2 Amb24070842 [0,0,0,1,0,0|3,0,0]=4 4740 B12R2.1081 Nc1cncc2c1CCCC2 Amb7172688 [0,0,0,1,0,0|3,0,0]=4 4741 B12R2.1081 Nc1nccc2c1CCCC2 Amb26940227 [0,0,0,1,0,0|3,0,0]=4 4742 B12R2.1081 O=C1C=CC=C2CNCCN12 Amb33718705 [0,0,0,1,0,0|2,0,0]=3 4743 B12R2.1081 O=C1C=CNC2=C1CCCC2 Amb22749082 [0,0,0,1,0,0|3,0,0]=4 4744 B12R2.1081 O=C1NC=CC2=C1CCNC2 Amb21928075 [0,0,0,1,0,0|2,0,0]=3 4745 B12R2.1081 O=C1NC=CC2=C1CCNC2 Amb22001417 [0,0,0,1,0,0|2,0,0]=3 4746 B12R2.1081 O=C1NC=CC2=C1CCNC2 Amb32663688 [0,0,0,1,0,0|2,0,0]=3 4747 B12R2.1081 O=C1NC=NC2=C1CCNC2 Amb19958468 [0,0,0,1,0,0|3,0,0]=4 4748 B12R2.1081 O=C1NC=NC2=C1CCNC2 Amb22490902 [0,0,0,1,0,0|3,0,0]=4 4749 B12R2.1081 O=C1NC=NC2=C1CCNC2 Amb33473128 [0,0,0,1,0,0|3,0,0]=4 4750 B12R2.1081 O=C1NN=CC2=C1CCNC2 Amb23557661 [0,0,0,1,0,0|3,0,0]=4 4751 B12R2.1081 O=C1NN=CC2=C1CCNC2 Amb32729740 [0,0,0,1,0,0|3,0,0]=4 4752 B12R2.1081 O=C1NN=CC2=C1CCNC2 Amb33743610 [0,0,0,1,0,0|3,0,0]=4 4753 B12R2.1081 Oc1cccc2c1CC=CC2 Amb8386792 [0,0,0,1,0,0|2,0,1]=4 4754 B12R2.1081 Oc1cccc2c1CCCC2 Amb33550500 [0,0,0,1,0,0|2,0,0]=3 4755 B12R2.1081 Oc1cccc2c1CCCN2 Amb18124994 [0,0,0,1,0,0|3,0,0]=4 4756 B12R2.1081 Oc1cccc2c1CCCS2 Amb27628967 [0,0,0,1,0,0|3,0,0]=4 4757 B12R2.1081 Oc1cccc2c1CCNC2 Amb21858675 [0,0,0,1,0,0|1,0,0]=2 4758 B12R2.1081 Oc1cccc2c1CCNC2 Amb23403654 [0,0,0,1,0,0|1,0,0]=2 4759 B12R2.1081 Oc1cccc2c1CCNC2 Amb2700187 [0,0,0,1,0,0|1,0,0]=2 4760 B12R2.1081 Oc1cccc2c1CCOC2 Amb24417190 [0,0,0,1,0,0|2,0,0]=3 4761 B12R2.1081 Oc1cccc2c1CNCC2 Amb10067195 [0,0,0,1,0,0|3,0,0]=4 4762 B12R2.1081 Oc1cccc2c1CNCC2 Amb21858715 [0,0,0,1,0,0|3,0,0]=4 4763 B12R2.1081 Oc1cccc2c1COCC2 Amb28348541 [0,0,0,1,0,0|3,0,0]=4 4764 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,0,0,1,0,0|3,0,0]=4 4765 B12R2.1081 Oc1cccc2c1OCCC2 Amb25142441 [0,0,0,1,0,0|3,0,0]=4 4766 B12R2.1081 Oc1cccc2c1SCCC2 Amb24715725 [0,0,0,1,0,0|3,0,0]=4 4767 B12R2.1081 Oc1ccnc2c1CCCC2 Amb22728833 [0,0,0,1,0,0|3,0,0]=4 4768 B12R2.1081 Oc1nccc2c1CCCC2 Amb22727883 [0,0,0,1,0,0|3,0,0]=4 4769 B12R2.1081 Sc1cccc2c1CCCC2 Amb5494141 [0,0,0,1,0,0|2,0,0]=3 4770 B12R2.1081 Sc1cccc2c1CNCC2 Amb27870522 [0,0,0,1,0,0|3,0,0]=4 4771 B12R2.1081 [O-][n+]1cccc2c1CCCC2 Amb2779966 [0,0,0,1,0,0|3,0,0]=4 4772 B10R1.29 BrCCCc1ccsc1Br Amb26430972 [0,0,0,0,1,0|3,0,0]=4 4773 B10R1.29 BrCCCc1sccc1Br Amb25916454 [0,0,0,0,1,0|3,0,0]=4 4774 B10R1.29 C#CCCc1sccc1Br Amb33387645 [0,0,0,0,1,0|2,0,1]=4 4775 B10R1.29 C=CCCc1cscc1Br Amb29863973 [0,0,0,0,1,0|2,0,1]=4 4776 B10R1.29 C=CCCc1occc1Br Amb29863834 [0,0,0,0,1,0|2,0,1]=4 4777 B10R1.29 CCCCc1cccn1N Amb27838833 [0,0,0,0,1,0|3,0,0]=4 4778 B10R1.29 CCCCc1ccsc1Br Amb19958946 [0,0,0,0,1,0|2,0,0]=3 4779 B10R1.29 CCCCc1ncsc1Br Amb20617209 [0,0,0,0,1,0|3,0,0]=4 4780 B10R1.29 CCCCn1ccnc1Br Amb17402626 [0,0,0,0,1,0|3,0,0]=4 4781 B10R1.29 CCCCn1nccc1Br Amb23539581 [0,0,0,0,1,0|3,0,0]=4 4782 B10R1.29 CCNCc1cscc1Br Amb28136063 [0,0,0,0,1,0|3,0,0]=4 4783 B10R1.29 CCNCc1occc1Br Amb27197261 [0,0,0,0,1,0|3,0,0]=4 4784 B10R1.29 CNCCN1C=CNC1=S Amb27463389 [0,0,0,0,1,0|3,0,0]=4 4785 B10R1.29 CNCCc1cccn1C Amb27881712 [0,0,0,0,1,0|2,0,0]=3 4786 B10R1.29 CNCCc1ccnn1C Amb27768611 [0,0,0,0,1,0|3,0,0]=4 4787 B10R1.29 CNCCc1ccnn1C Amb33299313 [0,0,0,0,1,0|3,0,0]=4 4788 B10R1.29 CNCCc1ccoc1C Amb26526948 [0,0,0,0,1,0|2,0,0]=3 4789 B10R1.29 CNCCc1cncn1C Amb23603748 [0,0,0,0,1,0|3,0,0]=4 4790 B10R1.29 CNCCc1cnoc1C Amb33361712 [0,0,0,0,1,0|3,0,0]=4 4791 B10R1.29 CNCCc1cscc1C Amb28384666 [0,0,0,0,1,0|2,0,0]=3 4792 B10R1.29 CNCCc1cscc1Cl Amb27390923 [0,0,0,0,1,0|1,1,0]=3 4793 B10R1.29 CNCCc1nccn1C Amb18294366 [0,0,0,0,1,0|3,0,0]=4 4794 B10R1.29 CNCCc1occc1C Amb24608196 [0,0,0,0,1,0|2,0,0]=3 4795 B10R1.29 CNCCc1sccc1Br Amb18293202 [0,0,0,0,1,0|1,0,0]=2 4796 B10R1.29 CNCCc1sccc1C Amb25767110 [0,0,0,0,1,0|2,0,0]=3 4797 B10R1.29 CNCCc1sccc1Cl Amb24401866 [0,0,0,0,1,0|1,1,0]=3 4798 B10R1.29 CNCCc1scnc1C Amb17622292 [0,0,0,0,1,0|3,0,0]=4 4799 B10R1.29 CNCCc1scnc1C Amb19134553 [0,0,0,0,1,0|3,0,0]=4 4800 B10R1.29 CNCCc1scnc1C Amb3941229 [0,0,0,0,1,0|3,0,0]=4 4801 B10R1.29 CNCCn1ccnc1C Amb21954069 [0,0,0,0,1,0|3,0,0]=4 4802 B10R1.29 CNCCn1ccnc1C Amb5559945 [0,0,0,0,1,0|3,0,0]=4 4803 B10R1.29 CNCCn1cncc1C Amb18254859 [0,0,0,0,1,0|3,0,0]=4 4804 B10R1.29 CNCCn1nncc1Br Amb35650911 [0,0,0,0,1,0|3,0,0]=4 4805 B10R1.29 COCCc1sccc1Br Amb27763658 [0,0,0,0,1,0|2,0,0]=3 4806 B10R1.29 COCCn1ccnc1Br Amb17402980 [0,0,0,0,1,0|3,0,0]=4 4807 B10R1.29 COCCn1nccc1Br Amb23539115 [0,0,0,0,1,0|3,0,0]=4 4808 B10R1.29 CONCc1occc1Br Amb28195925 [0,0,0,0,1,0|3,0,0]=4 4809 B10R1.29 ClCCCc1ccsc1Br Amb24554079 [0,0,0,0,1,0|3,0,0]=4 4810 B10R1.29 ClCCCc1sccc1Br Amb25856509 [0,0,0,0,1,0|3,0,0]=4 4811 B10R1.29 N#CCCc1ccsc1Br Amb28061855 [0,0,0,0,1,0|3,0,0]=4 4812 B10R1.29 N#CCCc1sccc1Br Amb27158451 [0,0,0,0,1,0|3,0,0]=4 4813 B10R1.29 NCCCc1ccsc1Br Amb27773189 [0,0,0,0,1,0|3,0,0]=4 4814 B10R1.29 NCCCc1cscc1Br Amb28183085 [0,0,0,0,1,0|3,0,0]=4 4815 B10R1.29 NCCCc1sccc1Br Amb18301839 [0,0,0,0,1,0|3,0,0]=4 4816 B10R1.29 NNCCc1ccsc1Cl Amb35631943 [0,0,0,0,1,0|2,1,0]=4 4817 B10R1.29 NNCCc1sccc1Br Amb28341016 [0,0,0,0,1,0|2,0,0]=3 4818 B10R1.29 NOCCc1sccc1Br Amb33387186 [0,0,0,0,1,0|3,0,0]=4 4819 B10R1.29 O=CCCc1occc1Br Amb28194630 [0,0,0,0,1,0|3,0,0]=4 4820 B10R1.29 O=CCCc1sccc1Br Amb25838062 [0,0,0,0,1,0|3,0,0]=4 4821 B10R1.29 OCCCc1ccsc1Br Amb25187302 [0,0,0,0,1,0|3,0,0]=4 4822 B10R1.29 OCCCc1sccc1Br Amb24495718 [0,0,0,0,1,0|3,0,0]=4 4823 B10R1.29 SCCCc1sccc1Br Amb33387985 [0,0,0,0,1,0|3,0,0]=4 4824 B10R1.29 [C-]#[N+]CCc1sccc1Br Amb33387161 [0,0,0,0,1,0|1,0,2]=4 4825 B12R1.18 CCCCC1C=CC=CCC1=O Amb27177858 [0,0,0,0,0,1|2,0,1]=4 4826 B12R1.18 COCCC1=CSC=CNC1=O Amb27882775 [0,0,0,0,0,1|3,0,0]=4 4827 B9R0.40 C\C=C\C=C(\C=O)CCC Amb27974020 [1,0,1,0,0,0|1,0,1]=4 4828 B9R0.45 CCC\C=C\C=C\C=N\O Amb27843401 [1,0,1,0,0,0|2,0,0]=4 4829 B9R0.45 CCC\C=C\C\C=C\C=O Amb27635823 [1,0,1,0,0,0|1,0,1]=4 4830 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [1,0,1,0,0,0|1,0,1]=4 4831 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [1,0,1,0,0,0|1,0,1]=4 4832 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [1,0,1,0,0,0|1,0,1]=4 4833 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [1,0,1,0,0,0|1,0,0]=3 4834 B9R0.45 C\C=C\C=C\C=C\C=C\Br Amb27451756 [1,0,1,0,0,0|0,0,2]=4 4835 B9R0.45 C\C=C\C=C\C=C\CCBr Amb28053636 [1,0,1,0,0,0|2,0,0]=4 4836 B9R0.45 C\C=C\C=C\C=C\CCCl Amb28195306 [1,0,1,0,0,0|2,0,0]=4 4837 B9R0.15 C=C\C=C(/CCC)C(=O)O Amb17619615 [1,0,1,0,0,0|2,0,0]=4 4838 B9R1.8 BrCC[n+]1ccccc1 Amb2617784 [2,0,0,0,0,0|2,0,0]=4 4839 B9R1.8 BrCC[n+]1ccccc1 Amb26365793 [2,0,0,0,0,0|2,0,0]=4 4840 B9R1.8 BrCCc1ccccn1 Amb1102303 [2,0,0,0,0,0|2,0,0]=4 4841 B9R1.8 BrCCc1ccccn1 Amb17935743 [2,0,0,0,0,0|2,0,0]=4 4842 B9R1.8 BrCCc1cccnc1 Amb19069960 [2,0,0,0,0,0|2,0,0]=4 4843 B9R1.8 BrCCc1cccnc1 Amb19372982 [2,0,0,0,0,0|2,0,0]=4 4844 B9R1.8 BrCCc1ccncc1 Amb18326675 [2,0,0,0,0,0|2,0,0]=4 4845 B9R1.8 BrCCc1ccncc1 Amb33313562 [2,0,0,0,0,0|2,0,0]=4 4846 B9R1.8 C#NCc1ccccc1 Amb31132452 [2,0,0,0,0,0|0,0,2]=4 4847 B9R1.8 C=CCc1ccccc1 Amb2599341 [2,0,0,0,0,0|0,0,2]=4 4848 B9R1.8 C=NCc1ccccc1 Amb28256747 [2,0,0,0,0,0|0,0,2]=4 4849 B9R1.8 CC#Cc1ccccc1 Amb8513696 [2,0,0,0,0,0|0,0,2]=4 4850 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [2,0,0,0,0,0|1,0,0]=3 4851 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,0]=2 4852 B9R1.8 CCCc1ccccn1 Amb6366812 [2,0,0,0,0,0|1,0,0]=3 4853 B9R1.8 CCCc1cccnc1 Amb2613018 [2,0,0,0,0,0|1,0,0]=3 4854 B9R1.8 CCCc1cccnn1 Amb24447402 [2,0,0,0,0,0|2,0,0]=4 4855 B9R1.8 CCCc1ccncc1 Amb4017941 [2,0,0,0,0,0|1,0,0]=3 4856 B9R1.8 CCCc1ccncn1 Amb24070638 [2,0,0,0,0,0|2,0,0]=4 4857 B9R1.8 CCCc1cnccn1 Amb2690413 [2,0,0,0,0,0|2,0,0]=4 4858 B9R1.8 CCNc1ccccc1 Amb3940127 [2,0,0,0,0,0|1,0,0]=3 4859 B9R1.8 CCNc1ccccn1 Amb6640743 [2,0,0,0,0,0|2,0,0]=4 4860 B9R1.8 CCNc1cccnc1 Amb6686634 [2,0,0,0,0,0|2,0,0]=4 4861 B9R1.8 CCNc1ccncc1 Amb33545749 [2,0,0,0,0,0|2,0,0]=4 4862 B9R1.8 CCOc1ccccc1 Amb2842270 [2,0,0,0,0,0|1,0,0]=3 4863 B9R1.8 CCOc1ccccn1 Amb2609960 [2,0,0,0,0,0|2,0,0]=4 4864 B9R1.8 CCOc1cccnc1 Amb10573342 [2,0,0,0,0,0|2,0,0]=4 4865 B9R1.8 CCOc1ccncc1 Amb8396897 [2,0,0,0,0,0|2,0,0]=4 4866 B9R1.8 CCSc1ccccc1 Amb2687929 [2,0,0,0,0,0|1,0,0]=3 4867 B9R1.8 CCSc1ccccn1 Amb26656831 [2,0,0,0,0,0|2,0,0]=4 4868 B9R1.8 CCSc1ccncc1 Amb27766422 [2,0,0,0,0,0|2,0,0]=4 4869 B9R1.8 CNCc1ccccc1 Amb3699562 [2,0,0,0,0,0|0,0,0]=2 4870 B9R1.8 CNCc1ccccn1 Amb10068750 [2,0,0,0,0,0|1,0,0]=3 4871 B9R1.8 CNCc1ccccn1 Amb10576408 [2,0,0,0,0,0|1,0,0]=3 4872 B9R1.8 CNCc1ccccn1 Amb3941148 [2,0,0,0,0,0|1,0,0]=3 4873 B9R1.8 CNCc1cccnc1 Amb10066918 [2,0,0,0,0,0|1,0,0]=3 4874 B9R1.8 CNCc1cccnc1 Amb10576409 [2,0,0,0,0,0|1,0,0]=3 4875 B9R1.8 CNCc1cccnc1 Amb1648828 [2,0,0,0,0,0|1,0,0]=3 4876 B9R1.8 CNCc1cccnn1 Amb32667437 [2,0,0,0,0,0|2,0,0]=4 4877 B9R1.8 CNCc1cccnn1 Amb8010012 [2,0,0,0,0,0|2,0,0]=4 4878 B9R1.8 CNCc1ccncc1 Amb10068773 [2,0,0,0,0,0|1,0,0]=3 4879 B9R1.8 CNCc1ccncc1 Amb1115812 [2,0,0,0,0,0|1,0,0]=3 4880 B9R1.8 CNCc1ccncn1 Amb21962059 [2,0,0,0,0,0|2,0,0]=4 4881 B9R1.8 CNCc1ccncn1 Amb22587684 [2,0,0,0,0,0|2,0,0]=4 4882 B9R1.8 CNCc1ccncn1 Amb3941356 [2,0,0,0,0,0|2,0,0]=4 4883 B9R1.8 CNCc1ccnnc1 Amb24183593 [2,0,0,0,0,0|2,0,0]=4 4884 B9R1.8 CNCc1ccnnc1 Amb27784160 [2,0,0,0,0,0|2,0,0]=4 4885 B9R1.8 CNCc1cnccn1 Amb1094140 [2,0,0,0,0,0|2,0,0]=4 4886 B9R1.8 CNCc1cnccn1 Amb21959600 [2,0,0,0,0,0|2,0,0]=4 4887 B9R1.8 CNCc1cncnc1 Amb32664708 [2,0,0,0,0,0|2,0,0]=4 4888 B9R1.8 CNCc1cncnc1 Amb8010525 [2,0,0,0,0,0|2,0,0]=4 4889 B9R1.8 CNCc1ncccn1 Amb30585159 [2,0,0,0,0,0|2,0,0]=4 4890 B9R1.8 CNCc1ncccn1 Amb8010518 [2,0,0,0,0,0|2,0,0]=4 4891 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|1,0,0]=3 4892 B9R1.8 CNNc1ccccc1 Amb27969267 [2,0,0,0,0,0|1,0,0]=3 4893 B9R1.8 COCc1ccccc1 Amb2782562 [2,0,0,0,0,0|1,0,0]=3 4894 B9R1.8 COCc1ccccn1 Amb4017561 [2,0,0,0,0,0|2,0,0]=4 4895 B9R1.8 CSCc1ccccn1 Amb27837576 [2,0,0,0,0,0|2,0,0]=4 4896 B9R1.8 CSCc1cccnc1 Amb24523080 [2,0,0,0,0,0|2,0,0]=4 4897 B9R1.8 CSSc1ccccc1 Amb4008371 [2,0,0,0,0,0|2,0,0]=4 4898 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|0,0,1]=3 4899 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [2,0,0,0,0,0|0,0,2]=4 4900 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [2,0,0,0,0,0|0,0,2]=4 4901 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [2,0,0,0,0,0|1,0,1]=4 4902 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [2,0,0,0,0,0|0,0,2]=4 4903 B9R1.8 ClCC[n+]1ccccc1 Amb28195087 [2,0,0,0,0,0|2,0,0]=4 4904 B9R1.8 ClCCc1ccccc1 Amb535682 [2,0,0,0,0,0|1,0,0]=3 4905 B9R1.8 ClCCc1ccccn1 Amb1102254 [2,0,0,0,0,0|2,0,0]=4 4906 B9R1.8 ClCCc1ccccn1 Amb19892295 [2,0,0,0,0,0|2,0,0]=4 4907 B9R1.8 ClCCc1cccnc1 Amb24061504 [2,0,0,0,0,0|2,0,0]=4 4908 B9R1.8 ClCCc1ccncc1 Amb23400891 [2,0,0,0,0,0|2,0,0]=4 4909 B9R1.8 ClCCc1ccncc1 Amb9004339 [2,0,0,0,0,0|2,0,0]=4 4910 B9R1.8 ClCOc1ccccc1 Amb22059503 [2,0,0,0,0,0|2,0,0]=4 4911 B9R1.8 ClNCc1cccnc1 Amb27951574 [2,0,0,0,0,0|2,0,0]=4 4912 B9R1.8 ICCc1ccccc1 Amb8515353 [2,0,0,0,0,0|1,0,0]=3 4913 B9R1.8 ICCc1cccnc1 Amb33534604 [2,0,0,0,0,0|2,0,0]=4 4914 B9R1.8 ICCc1ccncc1 Amb28383331 [2,0,0,0,0,0|2,0,0]=4 4915 B9R1.8 N#CCc1ccccc1 Amb3598087 [2,0,0,0,0,0|0,0,2]=4 4916 B9R1.8 NCC[n+]1ccccc1 Amb27246156 [2,0,0,0,0,0|1,0,0]=3 4917 B9R1.8 NCCc1ccccc1 Amb17843439 [2,0,0,0,0,0|0,0,0]=2 4918 B9R1.8 NCCc1ccccc1 Amb2792829 [2,0,0,0,0,0|0,0,0]=2 4919 B9R1.8 NCCc1ccccn1 Amb1156071 [2,0,0,0,0,0|1,0,0]=3 4920 B9R1.8 NCCc1ccccn1 Amb24066975 [2,0,0,0,0,0|1,0,0]=3 4921 B9R1.8 NCCc1cccnc1 Amb1134784 [2,0,0,0,0,0|1,0,0]=3 4922 B9R1.8 NCCc1cccnc1 Amb16230500 [2,0,0,0,0,0|1,0,0]=3 4923 B9R1.8 NCCc1cccnc1 Amb20241523 [2,0,0,0,0,0|1,0,0]=3 4924 B9R1.8 NCCc1cccnc1 Amb8631307 [2,0,0,0,0,0|1,0,0]=3 4925 B9R1.8 NCCc1cccnn1 Amb23592188 [2,0,0,0,0,0|2,0,0]=4 4926 B9R1.8 NCCc1ccncc1 Amb1102164 [2,0,0,0,0,0|1,0,0]=3 4927 B9R1.8 NCCc1ccncc1 Amb8631358 [2,0,0,0,0,0|1,0,0]=3 4928 B9R1.8 NCCc1ccncn1 Amb22899210 [2,0,0,0,0,0|2,0,0]=4 4929 B9R1.8 NCCc1ccncn1 Amb8009432 [2,0,0,0,0,0|2,0,0]=4 4930 B9R1.8 NCCc1ccnnc1 Amb31217486 [2,0,0,0,0,0|2,0,0]=4 4931 B9R1.8 NCCc1ccnnc1 Amb8009433 [2,0,0,0,0,0|2,0,0]=4 4932 B9R1.8 NCCc1cnccn1 Amb10067912 [2,0,0,0,0,0|2,0,0]=4 4933 B9R1.8 NCCc1cnccn1 Amb1995199 [2,0,0,0,0,0|2,0,0]=4 4934 B9R1.8 NCCc1cnccn1 Amb22756001 [2,0,0,0,0,0|2,0,0]=4 4935 B9R1.8 NCCc1cnccn1 Amb24066949 [2,0,0,0,0,0|2,0,0]=4 4936 B9R1.8 NCCc1cnccn1 Amb30526944 [2,0,0,0,0,0|2,0,0]=4 4937 B9R1.8 NCCc1cncnc1 Amb32667660 [2,0,0,0,0,0|2,0,0]=4 4938 B9R1.8 NCCc1cncnc1 Amb8009434 [2,0,0,0,0,0|2,0,0]=4 4939 B9R1.8 NCCc1cncnc1 Amb8631335 [2,0,0,0,0,0|2,0,0]=4 4940 B9R1.8 NCCc1ncccn1 Amb17074351 [2,0,0,0,0,0|2,0,0]=4 4941 B9R1.8 NCCc1ncccn1 Amb18199432 [2,0,0,0,0,0|2,0,0]=4 4942 B9R1.8 NCCc1ncccn1 Amb23399636 [2,0,0,0,0,0|2,0,0]=4 4943 B9R1.8 NCNc1ccccc1 Amb17117015 [2,0,0,0,0,0|1,0,0]=3 4944 B9R1.8 NCOc1ccccc1 Amb25128781 [2,0,0,0,0,0|1,0,0]=3 4945 B9R1.8 NNCc1ccccc1 Amb1105200 [2,0,0,0,0,0|1,0,0]=3 4946 B9R1.8 NNCc1ccccc1 Amb16231890 [2,0,0,0,0,0|1,0,0]=3 4947 B9R1.8 NNCc1ccccc1 Amb22492438 [2,0,0,0,0,0|1,0,0]=3 4948 B9R1.8 NNCc1ccccc1 Amb8513062 [2,0,0,0,0,0|1,0,0]=3 4949 B9R1.8 NNCc1ccccc1 Amb9826089 [2,0,0,0,0,0|1,0,0]=3 4950 B9R1.8 NNCc1ccccn1 Amb1117330 [2,0,0,0,0,0|2,0,0]=4 4951 B9R1.8 NNCc1ccccn1 Amb28984160 [2,0,0,0,0,0|2,0,0]=4 4952 B9R1.8 NNCc1ccccn1 Amb6892424 [2,0,0,0,0,0|2,0,0]=4 4953 B9R1.8 NNCc1cccnc1 Amb1121062 [2,0,0,0,0,0|2,0,0]=4 4954 B9R1.8 NNCc1cccnc1 Amb22491471 [2,0,0,0,0,0|2,0,0]=4 4955 B9R1.8 NNCc1cccnc1 Amb33551495 [2,0,0,0,0,0|2,0,0]=4 4956 B9R1.8 NNCc1ccncc1 Amb1118337 [2,0,0,0,0,0|2,0,0]=4 4957 B9R1.8 NNCc1ccncc1 Amb19893255 [2,0,0,0,0,0|2,0,0]=4 4958 B9R1.8 NNCc1ccncc1 Amb2691315 [2,0,0,0,0,0|2,0,0]=4 4959 B9R1.8 NNCc1ccncc1 Amb28984138 [2,0,0,0,0,0|2,0,0]=4 4960 B9R1.8 NOCc1ccccc1 Amb1154307 [2,0,0,0,0,0|1,0,0]=3 4961 B9R1.8 NOCc1ccccc1 Amb22489499 [2,0,0,0,0,0|1,0,0]=3 4962 B9R1.8 NOCc1ccccc1 Amb6600539 [2,0,0,0,0,0|1,0,0]=3 4963 B9R1.8 NOCc1ccccn1 Amb18642195 [2,0,0,0,0,0|2,0,0]=4 4964 B9R1.8 NOCc1ccccn1 Amb32663271 [2,0,0,0,0,0|2,0,0]=4 4965 B9R1.8 NOCc1cccnc1 Amb24074265 [2,0,0,0,0,0|2,0,0]=4 4966 B9R1.8 NOCc1cccnc1 Amb33546939 [2,0,0,0,0,0|2,0,0]=4 4967 B9R1.8 NOCc1ccncc1 Amb22397036 [2,0,0,0,0,0|2,0,0]=4 4968 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [2,0,0,0,0,0|1,0,1]=4 4969 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [2,0,0,0,0,0|1,0,1]=4 4970 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [2,0,0,0,0,0|1,0,1]=4 4971 B9R1.8 O=CCc1ccccc1 Amb3939950 [2,0,0,0,0,0|1,0,1]=4 4972 B9R1.8 OCC[n+]1ccccc1 Amb27839429 [2,0,0,0,0,0|2,0,0]=4 4973 B9R1.8 OCCc1ccccc1 Amb2793058 [2,0,0,0,0,0|1,0,0]=3 4974 B9R1.8 OCCc1ccccn1 Amb3939045 [2,0,0,0,0,0|2,0,0]=4 4975 B9R1.8 OCCc1cccnc1 Amb2688750 [2,0,0,0,0,0|2,0,0]=4 4976 B9R1.8 OCCc1ccncc1 Amb3939219 [2,0,0,0,0,0|2,0,0]=4 4977 B9R1.8 OCSc1ccccc1 Amb27776457 [2,0,0,0,0,0|2,0,0]=4 4978 B9R1.8 ONCc1ccccc1 Amb22001943 [2,0,0,0,0,0|1,0,0]=3 4979 B9R1.8 ONCc1ccccc1 Amb9825936 [2,0,0,0,0,0|1,0,0]=3 4980 B9R1.8 ONCc1ccccn1 Amb28457793 [2,0,0,0,0,0|2,0,0]=4 4981 B9R1.8 ONCc1ccccn1 Amb32680372 [2,0,0,0,0,0|2,0,0]=4 4982 B9R1.8 ONCc1cccnc1 Amb25147084 [2,0,0,0,0,0|2,0,0]=4 4983 B9R1.8 ONCc1ccncc1 Amb25851052 [2,0,0,0,0,0|2,0,0]=4 4984 B9R1.8 SCCc1ccccc1 Amb6255605 [2,0,0,0,0,0|1,0,0]=3 4985 B9R1.8 SCCc1ccccn1 Amb17619707 [2,0,0,0,0,0|2,0,0]=4 4986 B9R1.8 SCCc1cccnc1 Amb22008806 [2,0,0,0,0,0|2,0,0]=4 4987 B9R1.8 SCCc1ccncc1 Amb10552830 [2,0,0,0,0,0|2,0,0]=4 4988 B9R1.8 SCCc1ccncc1 Amb9800962 [2,0,0,0,0,0|2,0,0]=4 4989 B9R1.8 SSCc1ccccc1 Amb27646980 [2,0,0,0,0,0|2,0,0]=4 4990 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [2,0,0,0,0,0|0,0,2]=4 4991 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [2,0,0,0,0,0|0,0,1]=3 4992 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [2,0,0,0,0,0|1,0,1]=4 4993 B9R1.15 Bc1ccccc1CN Amb27463133 [2,0,0,0,0,0|1,0,0]=3 4994 B9R1.15 BrCc1ccccc1Br Amb1152530 [2,0,0,0,0,0|1,0,0]=3 4995 B9R1.15 BrCc1ccccc1I Amb8397039 [2,0,0,0,0,0|1,1,0]=4 4996 B9R1.15 BrCc1cccnc1Br Amb10071486 [2,0,0,0,0,0|2,0,0]=4 4997 B9R1.15 BrCc1cccnc1Br Amb10608824 [2,0,0,0,0,0|2,0,0]=4 4998 B9R1.15 BrCc1ccncc1Br Amb22898756 [2,0,0,0,0,0|2,0,0]=4 4999 B9R1.15 BrCc1ccncc1Br Amb32671433 [2,0,0,0,0,0|2,0,0]=4 5000 B9R1.15 BrCc1cnccc1Br Amb25921109 [2,0,0,0,0,0|2,0,0]=4 5001 B9R1.15 BrCc1ncccc1Br Amb22728103 [2,0,0,0,0,0|2,0,0]=4 5002 B9R1.15 BrCc1ncccc1Br Amb33527603 [2,0,0,0,0,0|2,0,0]=4 5003 B9R1.15 C#Cc1ccccc1Br Amb3939383 [2,0,0,0,0,0|0,0,2]=4 5004 B9R1.15 C=Cc1ccccc1Br Amb6365618 [2,0,0,0,0,0|0,0,2]=4 5005 B9R1.15 CCC1=CNC=CC1=N Amb22126003 [2,0,0,0,0,0|2,0,0]=4 5006 B9R1.15 CCC1=CNC=CC1=O Amb24062648 [2,0,0,0,0,0|2,0,0]=4 5007 B9R1.15 CCN1C=CC=CC1=O Amb22359913 [2,0,0,0,0,0|2,0,0]=4 5008 B9R1.15 CC[n+]1ccccc1Br Amb2685167 [2,0,0,0,0,0|1,0,0]=3 5009 B9R1.15 CC[n+]1ccccc1Br Amb28049734 [2,0,0,0,0,0|1,0,0]=3 5010 B9R1.15 CC[n+]1ccccc1C Amb27966049 [2,0,0,0,0,0|2,0,0]=4 5011 B9R1.15 CC[n+]1ccccc1Cl Amb5794570 [2,0,0,0,0,0|1,1,0]=4 5012 B9R1.15 CCc1cccc[n+]1N Amb27424792 [2,0,0,0,0,0|2,0,0]=4 5013 B9R1.15 CCc1cccc[n+]1[O-] Amb2694608 [2,0,0,0,0,0|2,0,0]=4 5014 B9R1.15 CCc1ccccc1Br Amb3939183 [2,0,0,0,0,0|0,0,0]=2 5015 B9R1.15 CCc1ccccc1C Amb8397274 [2,0,0,0,0,0|1,0,0]=3 5016 B9R1.15 CCc1ccccc1Cl Amb2685897 [2,0,0,0,0,0|0,1,0]=3 5017 B9R1.15 CCc1ccccc1F Amb10840487 [2,0,0,0,0,0|0,1,0]=3 5018 B9R1.15 CCc1ccccc1I Amb2688848 [2,0,0,0,0,0|0,1,0]=3 5019 B9R1.15 CCc1ccccc1N Amb2792823 [2,0,0,0,0,0|1,0,0]=3 5020 B9R1.15 CCc1ccccc1O Amb3939546 [2,0,0,0,0,0|1,0,0]=3 5021 B9R1.15 CCc1ccccc1S Amb2687958 [2,0,0,0,0,0|1,0,0]=3 5022 B9R1.15 CCc1cccnc1Br Amb24319268 [2,0,0,0,0,0|1,0,0]=3 5023 B9R1.15 CCc1cccnc1C Amb22169849 [2,0,0,0,0,0|2,0,0]=4 5024 B9R1.15 CCc1cccnc1Cl Amb19516800 [2,0,0,0,0,0|1,1,0]=4 5025 B9R1.15 CCc1cccnc1F Amb8396947 [2,0,0,0,0,0|1,1,0]=4 5026 B9R1.15 CCc1cccnc1I Amb27156636 [2,0,0,0,0,0|1,1,0]=4 5027 B9R1.15 CCc1cccnc1N Amb31291141 [2,0,0,0,0,0|2,0,0]=4 5028 B9R1.15 CCc1cccnc1N Amb8386854 [2,0,0,0,0,0|2,0,0]=4 5029 B9R1.15 CCc1cccnc1O Amb21864629 [2,0,0,0,0,0|2,0,0]=4 5030 B9R1.15 CCc1ccncc1Br Amb21857366 [2,0,0,0,0,0|1,0,0]=3 5031 B9R1.15 CCc1ccncc1Cl Amb22748741 [2,0,0,0,0,0|1,1,0]=4 5032 B9R1.15 CCc1ccncc1F Amb19959241 [2,0,0,0,0,0|1,1,0]=4 5033 B9R1.15 CCc1ccncc1N Amb18832983 [2,0,0,0,0,0|2,0,0]=4 5034 B9R1.15 CCc1ccncc1O Amb18642098 [2,0,0,0,0,0|2,0,0]=4 5035 B9R1.15 CCc1cnccc1Br Amb20617488 [2,0,0,0,0,0|1,0,0]=3 5036 B9R1.15 CCc1cnccc1Br Amb30633552 [2,0,0,0,0,0|1,0,0]=3 5037 B9R1.15 CCc1cnccc1Br Amb31307736 [2,0,0,0,0,0|1,0,0]=3 5038 B9R1.15 CCc1cnccc1Cl Amb25188972 [2,0,0,0,0,0|1,1,0]=4 5039 B9R1.15 CCc1cnccc1N Amb19514793 [2,0,0,0,0,0|2,0,0]=4 5040 B9R1.15 CCc1cncnc1Br Amb24323116 [2,0,0,0,0,0|2,0,0]=4 5041 B9R1.15 CCc1cnncc1Br Amb18187414 [2,0,0,0,0,0|2,0,0]=4 5042 B9R1.15 CCc1ncccc1Br Amb22233901 [2,0,0,0,0,0|1,0,0]=3 5043 B9R1.15 CCc1ncccc1Cl Amb22497670 [2,0,0,0,0,0|1,1,0]=4 5044 B9R1.15 CCc1ncccc1F Amb27836980 [2,0,0,0,0,0|1,1,0]=4 5045 B9R1.15 CCc1ncccc1N Amb18832982 [2,0,0,0,0,0|2,0,0]=4 5046 B9R1.15 CCc1ncccc1O Amb6468133 [2,0,0,0,0,0|2,0,0]=4 5047 B9R1.15 CCc1ncncc1Br Amb10068158 [2,0,0,0,0,0|2,0,0]=4 5048 B9R1.15 CNc1ccccc1Br Amb10068173 [2,0,0,0,0,0|0,0,0]=2 5049 B9R1.15 CNc1ccccc1Br Amb6712117 [2,0,0,0,0,0|0,0,0]=2 5050 B9R1.15 CNc1ccccc1C Amb22236040 [2,0,0,0,0,0|1,0,0]=3 5051 B9R1.15 CNc1ccccc1C Amb2689512 [2,0,0,0,0,0|1,0,0]=3 5052 B9R1.15 CNc1ccccc1Cl Amb20620844 [2,0,0,0,0,0|0,1,0]=3 5053 B9R1.15 CNc1ccccc1Cl Amb2686180 [2,0,0,0,0,0|0,1,0]=3 5054 B9R1.15 CNc1ccccc1F Amb2688174 [2,0,0,0,0,0|0,1,0]=3 5055 B9R1.15 CNc1ccccc1I Amb10610348 [2,0,0,0,0,0|0,1,0]=3 5056 B9R1.15 CNc1ccccc1I Amb7759816 [2,0,0,0,0,0|0,1,0]=3 5057 B9R1.15 CNc1ccccc1N Amb22489478 [2,0,0,0,0,0|1,0,0]=3 5058 B9R1.15 CNc1ccccc1N Amb3997180 [2,0,0,0,0,0|1,0,0]=3 5059 B9R1.15 CNc1ccccc1N Amb6854101 [2,0,0,0,0,0|1,0,0]=3 5060 B9R1.15 CNc1ccccc1N Amb8386940 [2,0,0,0,0,0|1,0,0]=3 5061 B9R1.15 CNc1ccccc1O Amb6336644 [2,0,0,0,0,0|1,0,0]=3 5062 B9R1.15 CNc1ccccc1P Amb27459031 [2,0,0,0,0,0|1,0,0]=3 5063 B9R1.15 CNc1cccnc1Br Amb22276193 [2,0,0,0,0,0|1,0,0]=3 5064 B9R1.15 CNc1cccnc1C Amb24062314 [2,0,0,0,0,0|2,0,0]=4 5065 B9R1.15 CNc1cccnc1C Amb33338773 [2,0,0,0,0,0|2,0,0]=4 5066 B9R1.15 CNc1cccnc1C Amb33537130 [2,0,0,0,0,0|2,0,0]=4 5067 B9R1.15 CNc1cccnc1Cl Amb8438980 [2,0,0,0,0,0|1,1,0]=4 5068 B9R1.15 CNc1cccnc1F Amb26576985 [2,0,0,0,0,0|1,1,0]=4 5069 B9R1.15 CNc1cccnc1I Amb27463154 [2,0,0,0,0,0|1,1,0]=4 5070 B9R1.15 CNc1cccnc1N Amb18642122 [2,0,0,0,0,0|2,0,0]=4 5071 B9R1.15 CNc1cccsc1=O Amb3375564 [2,0,0,0,0,0|2,0,0]=4 5072 B9R1.15 CNc1ccncc1Br Amb22728835 [2,0,0,0,0,0|1,0,0]=3 5073 B9R1.15 CNc1ccncc1C Amb27466851 [2,0,0,0,0,0|2,0,0]=4 5074 B9R1.15 CNc1ccncc1F Amb27859669 [2,0,0,0,0,0|1,1,0]=4 5075 B9R1.15 CNc1ccncc1N Amb33528510 [2,0,0,0,0,0|2,0,0]=4 5076 B9R1.15 CNc1ccncc1S Amb28455334 [2,0,0,0,0,0|2,0,0]=4 5077 B9R1.15 CNc1cnccc1C Amb15690613 [2,0,0,0,0,0|2,0,0]=4 5078 B9R1.15 CNc1cnccc1Cl Amb27793415 [2,0,0,0,0,0|1,1,0]=4 5079 B9R1.15 CNc1cnccc1I Amb27756345 [2,0,0,0,0,0|1,1,0]=4 5080 B9R1.15 CNc1cnccc1N Amb17933837 [2,0,0,0,0,0|2,0,0]=4 5081 B9R1.15 CNc1ncccc1Br Amb18279191 [2,0,0,0,0,0|1,0,0]=3 5082 B9R1.15 CNc1ncccc1C Amb18279778 [2,0,0,0,0,0|2,0,0]=4 5083 B9R1.15 CNc1ncccc1Cl Amb6643711 [2,0,0,0,0,0|1,1,0]=4 5084 B9R1.15 CNc1ncccc1F Amb18948166 [2,0,0,0,0,0|1,1,0]=4 5085 B9R1.15 CNc1ncccc1I Amb24524201 [2,0,0,0,0,0|1,1,0]=4 5086 B9R1.15 CNc1ncccc1N Amb10610030 [2,0,0,0,0,0|2,0,0]=4 5087 B9R1.15 CNc1ncccc1N Amb7172739 [2,0,0,0,0,0|2,0,0]=4 5088 B9R1.15 CNc1ncncc1Br Amb19957799 [2,0,0,0,0,0|2,0,0]=4 5089 B9R1.15 CNc1nnccc1Br Amb26318803 [2,0,0,0,0,0|2,0,0]=4 5090 B9R1.15 COc1ccccc1Br Amb2684946 [2,0,0,0,0,0|1,0,0]=3 5091 B9R1.15 COc1ccccc1C Amb8513241 [2,0,0,0,0,0|2,0,0]=4 5092 B9R1.15 COc1ccccc1Cl Amb6297184 [2,0,0,0,0,0|1,1,0]=4 5093 B9R1.15 COc1ccccc1F Amb2688014 [2,0,0,0,0,0|1,1,0]=4 5094 B9R1.15 COc1ccccc1I Amb2688832 [2,0,0,0,0,0|1,1,0]=4 5095 B9R1.15 COc1ccccc1N Amb19929908 [2,0,0,0,0,0|2,0,0]=4 5096 B9R1.15 COc1ccccc1N Amb840071 [2,0,0,0,0,0|2,0,0]=4 5097 B9R1.15 COc1ccccc1O Amb3939629 [2,0,0,0,0,0|2,0,0]=4 5098 B9R1.15 COc1ccccc1P Amb22228914 [2,0,0,0,0,0|2,0,0]=4 5099 B9R1.15 COc1ccccc1S Amb2689086 [2,0,0,0,0,0|2,0,0]=4 5100 B9R1.15 COc1cccnc1Br Amb2715581 [2,0,0,0,0,0|2,0,0]=4 5101 B9R1.15 COc1ccncc1Br Amb10602259 [2,0,0,0,0,0|2,0,0]=4 5102 B9R1.15 COc1cnccc1Br Amb10602632 [2,0,0,0,0,0|2,0,0]=4 5103 B9R1.15 COc1cnccc1Br Amb19957814 [2,0,0,0,0,0|2,0,0]=4 5104 B9R1.15 COc1ncccc1Br Amb24065697 [2,0,0,0,0,0|2,0,0]=4 5105 B9R1.15 COc1ncccc1Br Amb33538379 [2,0,0,0,0,0|2,0,0]=4 5106 B9R1.15 CPc1ccccc1N Amb27862120 [2,0,0,0,0,0|1,1,0]=4 5107 B9R1.15 CSc1ccccc1Br Amb2685500 [2,0,0,0,0,0|1,0,0]=3 5108 B9R1.15 CSc1ccccc1C Amb10571827 [2,0,0,0,0,0|2,0,0]=4 5109 B9R1.15 CSc1ccccc1F Amb2688420 [2,0,0,0,0,0|1,1,0]=4 5110 B9R1.15 CSc1ccccc1I Amb2688886 [2,0,0,0,0,0|1,1,0]=4 5111 B9R1.15 CSc1ccccc1N Amb2689720 [2,0,0,0,0,0|2,0,0]=4 5112 B9R1.15 CSc1ccccc1O Amb2688795 [2,0,0,0,0,0|2,0,0]=4 5113 B9R1.15 CSc1ccccc1S Amb19887951 [2,0,0,0,0,0|2,0,0]=4 5114 B9R1.15 CSc1cccnc1Br Amb22232104 [2,0,0,0,0,0|2,0,0]=4 5115 B9R1.15 CSc1cnccc1Br Amb25727456 [2,0,0,0,0,0|2,0,0]=4 5116 B9R1.15 CSc1ncccc1Br Amb22301525 [2,0,0,0,0,0|2,0,0]=4 5117 B9R1.15 C[NH2+]c1ccccc1[NH3+] Amb30876911 [2,0,0,0,0,0|1,0,1]=4 5118 B9R1.15 Cc1ccccc1CBr Amb3939708 [2,0,0,0,0,0|2,0,0]=4 5119 B9R1.15 Cc1ccccc1CCl Amb2792896 [2,0,0,0,0,0|2,0,0]=4 5120 B9R1.15 Cc1ccccc1CN Amb1651810 [2,0,0,0,0,0|1,0,0]=3 5121 B9R1.15 Cc1ccccc1CN Amb24065797 [2,0,0,0,0,0|1,0,0]=3 5122 B9R1.15 Cc1ccccc1CO Amb837463 [2,0,0,0,0,0|2,0,0]=4 5123 B9R1.15 Cc1ccccc1CS Amb2726199 [2,0,0,0,0,0|2,0,0]=4 5124 B9R1.15 Cc1ccccc1NN Amb1039461 [2,0,0,0,0,0|2,0,0]=4 5125 B9R1.15 Cc1ccccc1NN Amb1208830 [2,0,0,0,0,0|2,0,0]=4 5126 B9R1.15 Cc1ccccc1NN Amb22489459 [2,0,0,0,0,0|2,0,0]=4 5127 B9R1.15 Cc1ccccc1NO Amb21961958 [2,0,0,0,0,0|2,0,0]=4 5128 B9R1.15 Cc1cccnc1CN Amb22233790 [2,0,0,0,0,0|2,0,0]=4 5129 B9R1.15 Cc1cccnc1CN Amb2684467 [2,0,0,0,0,0|2,0,0]=4 5130 B9R1.15 Cc1ccncc1CN Amb22500751 [2,0,0,0,0,0|2,0,0]=4 5131 B9R1.15 Cc1ccncc1CN Amb22747290 [2,0,0,0,0,0|2,0,0]=4 5132 B9R1.15 Cc1ccncc1CN Amb8010867 [2,0,0,0,0,0|2,0,0]=4 5133 B9R1.15 Cc1cnccc1CN Amb2695617 [2,0,0,0,0,0|2,0,0]=4 5134 B9R1.15 Cc1cnccc1CN Amb8630132 [2,0,0,0,0,0|2,0,0]=4 5135 B9R1.15 Cc1ncccc1CN Amb22747289 [2,0,0,0,0,0|2,0,0]=4 5136 B9R1.15 Cc1ncccc1CN Amb33542974 [2,0,0,0,0,0|2,0,0]=4 5137 B9R1.15 ClCc1ccccc1Br Amb5395415 [2,0,0,0,0,0|1,0,0]=3 5138 B9R1.15 ClCc1ccccc1Cl Amb1691713 [2,0,0,0,0,0|1,1,0]=4 5139 B9R1.15 ClCc1cccnc1Br Amb22044048 [2,0,0,0,0,0|2,0,0]=4 5140 B9R1.15 ClCc1ccncc1Br Amb27424026 [2,0,0,0,0,0|2,0,0]=4 5141 B9R1.15 ClCc1ccncc1Br Amb30588572 [2,0,0,0,0,0|2,0,0]=4 5142 B9R1.15 ClCc1cnccc1Br Amb28189615 [2,0,0,0,0,0|2,0,0]=4 5143 B9R1.15 ClCc1ncccc1Br Amb21926821 [2,0,0,0,0,0|2,0,0]=4 5144 B9R1.15 ClCc1ncccc1Br Amb32674865 [2,0,0,0,0,0|2,0,0]=4 5145 B9R1.15 Clc1ccccc1CBr Amb2685772 [2,0,0,0,0,0|1,1,0]=4 5146 B9R1.15 Clc1ccccc1CI Amb33546475 [2,0,0,0,0,0|1,1,0]=4 5147 B9R1.15 FCc1ccccc1Br Amb25762101 [2,0,0,0,0,0|1,0,0]=3 5148 B9R1.15 FCc1ncccc1Br Amb35744428 [2,0,0,0,0,0|2,0,0]=4 5149 B9R1.15 Fc1ccccc1CBr Amb2688042 [2,0,0,0,0,0|1,1,0]=4 5150 B9R1.15 Fc1ccccc1CCl Amb6364744 [2,0,0,0,0,0|1,1,0]=4 5151 B9R1.15 Fc1ccccc1CS Amb2691866 [2,0,0,0,0,0|1,1,0]=4 5152 B9R1.15 N#Cc1ccccc1Br Amb2609951 [2,0,0,0,0,0|0,0,2]=4 5153 B9R1.15 NCC1=CC=CNC1=O Amb18043158 [2,0,0,0,0,0|2,0,0]=4 5154 B9R1.15 NCC1=CC=CNC1=O Amb22054312 [2,0,0,0,0,0|2,0,0]=4 5155 B9R1.15 NCc1cccc[n+]1[O-] Amb27196290 [2,0,0,0,0,0|2,0,0]=4 5156 B9R1.15 NCc1ccccc1Br Amb4037050 [2,0,0,0,0,0|0,0,0]=2 5157 B9R1.15 NCc1ccccc1Br Amb6365738 [2,0,0,0,0,0|0,0,0]=2 5158 B9R1.15 NCc1ccccc1Cl Amb19958655 [2,0,0,0,0,0|0,1,0]=3 5159 B9R1.15 NCc1ccccc1Cl Amb932820 [2,0,0,0,0,0|0,1,0]=3 5160 B9R1.15 NCc1ccccc1F Amb2780405 [2,0,0,0,0,0|0,1,0]=3 5161 B9R1.15 NCc1ccccc1F Amb535712 [2,0,0,0,0,0|0,1,0]=3 5162 B9R1.15 NCc1ccccc1I Amb8397048 [2,0,0,0,0,0|0,1,0]=3 5163 B9R1.15 NCc1ccccc1N Amb3941688 [2,0,0,0,0,0|1,0,0]=3 5164 B9R1.15 NCc1ccccc1N Amb8631266 [2,0,0,0,0,0|1,0,0]=3 5165 B9R1.15 NCc1ccccc1O Amb1111172 [2,0,0,0,0,0|1,0,0]=3 5166 B9R1.15 NCc1ccccc1O Amb13951900 [2,0,0,0,0,0|1,0,0]=3 5167 B9R1.15 NCc1ccccc1O Amb30594500 [2,0,0,0,0,0|1,0,0]=3 5168 B9R1.15 NCc1ccccc1S Amb27487957 [2,0,0,0,0,0|1,0,0]=3 5169 B9R1.15 NCc1cccnc1Br Amb20247921 [2,0,0,0,0,0|1,0,0]=3 5170 B9R1.15 NCc1cccnc1Cl Amb19929364 [2,0,0,0,0,0|1,1,0]=4 5171 B9R1.15 NCc1cccnc1Cl Amb22498734 [2,0,0,0,0,0|1,1,0]=4 5172 B9R1.15 NCc1cccnc1Cl Amb8631118 [2,0,0,0,0,0|1,1,0]=4 5173 B9R1.15 NCc1cccnc1F Amb10603597 [2,0,0,0,0,0|1,1,0]=4 5174 B9R1.15 NCc1cccnc1F Amb21857815 [2,0,0,0,0,0|1,1,0]=4 5175 B9R1.15 NCc1cccnc1I Amb25889424 [2,0,0,0,0,0|1,1,0]=4 5176 B9R1.15 NCc1cccnc1N Amb15701368 [2,0,0,0,0,0|2,0,0]=4 5177 B9R1.15 NCc1cccnc1O Amb32409635 [2,0,0,0,0,0|2,0,0]=4 5178 B9R1.15 NCc1cccnc1O Amb33611602 [2,0,0,0,0,0|2,0,0]=4 5179 B9R1.15 NCc1cccnc1O Amb8855139 [2,0,0,0,0,0|2,0,0]=4 5180 B9R1.15 NCc1ccncc1Br Amb18252030 [2,0,0,0,0,0|1,0,0]=3 5181 B9R1.15 NCc1ccncc1Br Amb30585169 [2,0,0,0,0,0|1,0,0]=3 5182 B9R1.15 NCc1ccncc1Cl Amb18831608 [2,0,0,0,0,0|1,1,0]=4 5183 B9R1.15 NCc1ccncc1Cl Amb21927836 [2,0,0,0,0,0|1,1,0]=4 5184 B9R1.15 NCc1ccncc1F Amb13890638 [2,0,0,0,0,0|1,1,0]=4 5185 B9R1.15 NCc1ccncc1F Amb16186030 [2,0,0,0,0,0|1,1,0]=4 5186 B9R1.15 NCc1ccncc1I Amb24554252 [2,0,0,0,0,0|1,1,0]=4 5187 B9R1.15 NCc1ccncc1N Amb16230501 [2,0,0,0,0,0|2,0,0]=4 5188 B9R1.15 NCc1ccncc1N Amb22755075 [2,0,0,0,0,0|2,0,0]=4 5189 B9R1.15 NCc1ccncc1O Amb20247896 [2,0,0,0,0,0|2,0,0]=4 5190 B9R1.15 NCc1cnccc1Br Amb22292211 [2,0,0,0,0,0|1,0,0]=3 5191 B9R1.15 NCc1cnccc1Cl Amb18831607 [2,0,0,0,0,0|1,1,0]=4 5192 B9R1.15 NCc1cnccc1Cl Amb22886403 [2,0,0,0,0,0|1,1,0]=4 5193 B9R1.15 NCc1cnccc1Cl Amb33715871 [2,0,0,0,0,0|1,1,0]=4 5194 B9R1.15 NCc1cnccc1N Amb33552971 [2,0,0,0,0,0|2,0,0]=4 5195 B9R1.15 NCc1cnccc1O Amb18908274 [2,0,0,0,0,0|2,0,0]=4 5196 B9R1.15 NCc1ncccc1Br Amb22501100 [2,0,0,0,0,0|1,0,0]=3 5197 B9R1.15 NCc1ncccc1Br Amb22756452 [2,0,0,0,0,0|1,0,0]=3 5198 B9R1.15 NCc1ncccc1Br Amb32667089 [2,0,0,0,0,0|1,0,0]=3 5199 B9R1.15 NCc1ncccc1Cl Amb19929608 [2,0,0,0,0,0|1,1,0]=4 5200 B9R1.15 NCc1ncccc1Cl Amb21857817 [2,0,0,0,0,0|1,1,0]=4 5201 B9R1.15 NCc1ncccc1F Amb21962659 [2,0,0,0,0,0|1,1,0]=4 5202 B9R1.15 NCc1ncccc1F Amb22754755 [2,0,0,0,0,0|1,1,0]=4 5203 B9R1.15 NCc1ncccc1F Amb8629674 [2,0,0,0,0,0|1,1,0]=4 5204 B9R1.15 NCc1ncccc1N Amb18908273 [2,0,0,0,0,0|2,0,0]=4 5205 B9R1.15 NCc1ncccc1N Amb23401213 [2,0,0,0,0,0|2,0,0]=4 5206 B9R1.15 NCc1ncccc1O Amb22501146 [2,0,0,0,0,0|2,0,0]=4 5207 B9R1.15 NCc1ncccc1O Amb2697349 [2,0,0,0,0,0|2,0,0]=4 5208 B9R1.15 NCc1ncccc1O Amb33482924 [2,0,0,0,0,0|2,0,0]=4 5209 B9R1.15 NCc1ncccc1S Amb24427279 [2,0,0,0,0,0|2,0,0]=4 5210 B9R1.15 NCc1ncncc1Br Amb18523223 [2,0,0,0,0,0|2,0,0]=4 5211 B9R1.15 NNc1ccccc1Br Amb1043737 [2,0,0,0,0,0|1,0,0]=3 5212 B9R1.15 NNc1ccccc1Br Amb1158939 [2,0,0,0,0,0|1,0,0]=3 5213 B9R1.15 NNc1ccccc1Br Amb22489456 [2,0,0,0,0,0|1,0,0]=3 5214 B9R1.15 NNc1ccccc1Cl Amb1039456 [2,0,0,0,0,0|1,1,0]=4 5215 B9R1.15 NNc1ccccc1Cl Amb1152012 [2,0,0,0,0,0|1,1,0]=4 5216 B9R1.15 NNc1ccccc1Cl Amb22432563 [2,0,0,0,0,0|1,1,0]=4 5217 B9R1.15 NNc1ccccc1F Amb1058739 [2,0,0,0,0,0|1,1,0]=4 5218 B9R1.15 NNc1ccccc1F Amb1158938 [2,0,0,0,0,0|1,1,0]=4 5219 B9R1.15 NNc1ccccc1I Amb10072000 [2,0,0,0,0,0|1,1,0]=4 5220 B9R1.15 NNc1ccccc1I Amb1055179 [2,0,0,0,0,0|1,1,0]=4 5221 B9R1.15 NNc1ccccc1N Amb28047832 [2,0,0,0,0,0|2,0,0]=4 5222 B9R1.15 NNc1ccccc1O Amb25827397 [2,0,0,0,0,0|2,0,0]=4 5223 B9R1.15 NNc1ccccc1S Amb27192454 [2,0,0,0,0,0|2,0,0]=4 5224 B9R1.15 NNc1cccnc1Br Amb23454429 [2,0,0,0,0,0|2,0,0]=4 5225 B9R1.15 NNc1ccncc1Br Amb22458356 [2,0,0,0,0,0|2,0,0]=4 5226 B9R1.15 NNc1cnccc1Br Amb23559469 [2,0,0,0,0,0|2,0,0]=4 5227 B9R1.15 NNc1ncccc1Br Amb19046890 [2,0,0,0,0,0|2,0,0]=4 5228 B9R1.15 NOc1ccccc1Br Amb24556800 [2,0,0,0,0,0|1,0,0]=3 5229 B9R1.15 NOc1ccccc1Cl Amb18124665 [2,0,0,0,0,0|1,1,0]=4 5230 B9R1.15 NOc1ccccc1Cl Amb32651980 [2,0,0,0,0,0|1,1,0]=4 5231 B9R1.15 NOc1ccccc1F Amb22900914 [2,0,0,0,0,0|1,1,0]=4 5232 B9R1.15 NOc1ccccc1F Amb26427812 [2,0,0,0,0,0|1,1,0]=4 5233 B9R1.15 Nc1ccccc1CCl Amb6740281 [2,0,0,0,0,0|2,0,0]=4 5234 B9R1.15 Nc1ccccc1CF Amb19515970 [2,0,0,0,0,0|2,0,0]=4 5235 B9R1.15 Nc1ccccc1CO Amb1808337 [2,0,0,0,0,0|2,0,0]=4 5236 B9R1.15 Nc1ccccc1CS Amb27787743 [2,0,0,0,0,0|2,0,0]=4 5237 B9R1.15 O=Cc1ccccc1Br Amb2684948 [2,0,0,0,0,0|1,0,1]=4 5238 B9R1.15 OCc1ccccc1Br Amb3939081 [2,0,0,0,0,0|1,0,0]=3 5239 B9R1.15 OCc1ccccc1Cl Amb837338 [2,0,0,0,0,0|1,1,0]=4 5240 B9R1.15 OCc1ccccc1F Amb837270 [2,0,0,0,0,0|1,1,0]=4 5241 B9R1.15 OCc1ccccc1I Amb6373404 [2,0,0,0,0,0|1,1,0]=4 5242 B9R1.15 OCc1ccccc1O Amb3940117 [2,0,0,0,0,0|2,0,0]=4 5243 B9R1.15 OCc1ccccc1S Amb2689068 [2,0,0,0,0,0|2,0,0]=4 5244 B9R1.15 OCc1cccnc1Br Amb4561110 [2,0,0,0,0,0|2,0,0]=4 5245 B9R1.15 OCc1ccncc1Br Amb19958216 [2,0,0,0,0,0|2,0,0]=4 5246 B9R1.15 OCc1cnccc1Br Amb19958695 [2,0,0,0,0,0|2,0,0]=4 5247 B9R1.15 OCc1cnccc1Br Amb20671165 [2,0,0,0,0,0|2,0,0]=4 5248 B9R1.15 OCc1cnccc1Br Amb31205724 [2,0,0,0,0,0|2,0,0]=4 5249 B9R1.15 OCc1ncccc1Br Amb13882830 [2,0,0,0,0,0|2,0,0]=4 5250 B9R1.15 ONc1ccccc1Cl Amb24093632 [2,0,0,0,0,0|1,1,0]=4 5251 B9R1.15 ONc1ccccc1I Amb22230990 [2,0,0,0,0,0|1,1,0]=4 5252 B9R1.15 Oc1ccccc1CBr Amb18129657 [2,0,0,0,0,0|2,0,0]=4 5253 B9R1.15 Oc1ccccc1CCl Amb17477840 [2,0,0,0,0,0|2,0,0]=4 5254 B9R1.15 Oc1ccccc1CS Amb25188976 [2,0,0,0,0,0|2,0,0]=4 5255 B9R1.15 SCc1ccccc1Br Amb2691875 [2,0,0,0,0,0|1,0,0]=3 5256 B9R1.15 SCc1ccccc1Cl Amb6255353 [2,0,0,0,0,0|1,1,0]=4 5257 B9R1.15 SCc1cccnc1Br Amb33387702 [2,0,0,0,0,0|2,0,0]=4 5258 B9R1.15 SCc1ccncc1Br Amb32788848 [2,0,0,0,0,0|2,0,0]=4 5259 B9R1.15 SCc1ncccc1Br Amb24528797 [2,0,0,0,0,0|2,0,0]=4 5260 B9R1.15 Sc1ccccc1CBr Amb27482544 [2,0,0,0,0,0|2,0,0]=4 5261 B9R1.15 [C-]#[N+]c1ccccc1Br Amb2685423 [2,0,0,0,0,0|0,0,2]=4 5262 B9R1.15 [NH3+]Nc1ccccc1Cl Amb24113856 [2,0,0,0,0,0|1,1,0]=4 5263 B11R1.13 C#CCc1cccc(F)c1Br Amb33450555 [1,1,0,0,0,0|0,0,2]=4 5264 B11R1.13 C#CCc1cccc(O)c1Br Amb33386801 [1,1,0,0,0,0|0,0,2]=4 5265 B11R1.13 CC#Cc1cccc(O)c1Br Amb27261946 [1,1,0,0,0,0|0,0,2]=4 5266 B11R1.13 CC1=CC=CN(CCN)C1=O Amb18030460 [1,1,0,0,0,0|2,0,0]=4 5267 B11R1.13 CCCC1=C(Br)C(=S)NC=N1 Amb27595271 [1,1,0,0,0,0|2,0,0]=4 5268 B11R1.13 CCCC1=C(C)C(=O)NC=C1 Amb26512041 [1,1,0,0,0,0|2,0,0]=4 5269 B11R1.13 CCCC1=C(N)C(=O)NC=C1 Amb18201354 [1,1,0,0,0,0|2,0,0]=4 5270 B11R1.13 CCCC1=C(O)C(=O)C=CN1 Amb27239973 [1,1,0,0,0,0|2,0,0]=4 5271 B11R1.13 CCCN1C=CC=C(N)C1=O Amb18958852 [1,1,0,0,0,0|2,0,0]=4 5272 B11R1.13 CCCN1C=CC=C(O)C1=O Amb27434869 [1,1,0,0,0,0|2,0,0]=4 5273 B11R1.13 CCCc1cccc(C)c1O Amb3940824 [1,1,0,0,0,0|1,0,0]=3 5274 B11R1.13 CCCc1cccc(F)c1Br Amb32670089 [1,1,0,0,0,0|0,0,0]=2 5275 B11R1.13 CCCc1cccc(F)c1O Amb32670090 [1,1,0,0,0,0|1,0,0]=3 5276 B11R1.13 CCCc1cccc(N)c1C Amb27755736 [1,1,0,0,0,0|1,0,0]=3 5277 B11R1.13 CCCc1cccc(O)c1O Amb2924052 [1,1,0,0,0,0|1,0,0]=3 5278 B11R1.13 CCCc1ccnc(Br)c1Br Amb24319821 [1,1,0,0,0,0|1,0,0]=3 5279 B11R1.13 CCCc1ccnc(Cl)c1Br Amb24318891 [1,1,0,0,0,0|1,0,0]=3 5280 B11R1.13 CCCc1ccnc(N)c1Br Amb24319840 [1,1,0,0,0,0|1,0,0]=3 5281 B11R1.13 CCCc1cncc(N)c1C Amb32696505 [1,1,0,0,0,0|2,0,0]=4 5282 B11R1.13 CCCc1nccc(C)c1N Amb26058565 [1,1,0,0,0,0|2,0,0]=4 5283 B11R1.13 CCCc1ncnc(F)c1Br Amb35653641 [1,1,0,0,0,0|2,0,0]=4 5284 B11R1.13 CCNc1cccc(Br)c1F Amb35642855 [1,1,0,0,0,0|1,1,0]=4 5285 B11R1.13 CCNc1cccc(C)c1C Amb6700738 [1,1,0,0,0,0|2,0,0]=4 5286 B11R1.13 CCNc1cccc(C)c1F Amb25765462 [1,1,0,0,0,0|1,1,0]=4 5287 B11R1.13 CCNc1cccc(Cl)c1C Amb33527402 [1,1,0,0,0,0|2,0,0]=4 5288 B11R1.13 CCNc1cccc(Cl)c1Cl Amb28960306 [1,1,0,0,0,0|1,1,0]=4 5289 B11R1.13 CCNc1cccc(Cl)c1Cl Amb6742377 [1,1,0,0,0,0|1,1,0]=4 5290 B11R1.13 CCNc1cccc(Cl)c1F Amb7760396 [1,1,0,0,0,0|1,1,0]=4 5291 B11R1.13 CCNc1cccc(F)c1C Amb18955807 [1,1,0,0,0,0|2,0,0]=4 5292 B11R1.13 CCNc1cccc(F)c1F Amb18281709 [1,1,0,0,0,0|1,1,0]=4 5293 B11R1.13 CCNc1cccc(F)c1N Amb18281122 [1,1,0,0,0,0|2,0,0]=4 5294 B11R1.13 CCNc1nccc(C)c1Br Amb28453655 [1,1,0,0,0,0|2,0,0]=4 5295 B11R1.13 CCOc1cccc(Br)c1C Amb26868521 [1,1,0,0,0,0|2,0,0]=4 5296 B11R1.13 CCOc1cccc(Br)c1F Amb27236784 [1,1,0,0,0,0|1,1,0]=4 5297 B11R1.13 CCOc1cccc(Br)c1I Amb20171238 [1,1,0,0,0,0|1,1,0]=4 5298 B11R1.13 CCOc1cccc(Br)c1N Amb19959102 [1,1,0,0,0,0|2,0,0]=4 5299 B11R1.13 CCOc1cccc(Br)c1O Amb24104068 [1,1,0,0,0,0|2,0,0]=4 5300 B11R1.13 CCOc1cccc(Br)c1S Amb24350428 [1,1,0,0,0,0|2,0,0]=4 5301 B11R1.13 CCOc1cccc(C)c1C Amb25064103 [1,1,0,0,0,0|2,0,0]=4 5302 B11R1.13 CCOc1cccc(C)c1F Amb27653765 [1,1,0,0,0,0|1,1,0]=4 5303 B11R1.13 CCOc1cccc(C)c1I Amb33512234 [1,1,0,0,0,0|1,1,0]=4 5304 B11R1.13 CCOc1cccc(C)c1N Amb9296571 [1,1,0,0,0,0|2,0,0]=4 5305 B11R1.13 CCOc1cccc(C)c1S Amb25368870 [1,1,0,0,0,0|2,0,0]=4 5306 B11R1.13 CCOc1cccc(Cl)c1Br Amb27461051 [1,1,0,0,0,0|1,0,0]=3 5307 B11R1.13 CCOc1cccc(Cl)c1C Amb25920682 [1,1,0,0,0,0|2,0,0]=4 5308 B11R1.13 CCOc1cccc(Cl)c1Cl Amb28043964 [1,1,0,0,0,0|1,1,0]=4 5309 B11R1.13 CCOc1cccc(Cl)c1F Amb27405131 [1,1,0,0,0,0|1,1,0]=4 5310 B11R1.13 CCOc1cccc(Cl)c1N Amb26850237 [1,1,0,0,0,0|2,0,0]=4 5311 B11R1.13 CCOc1cccc(Cl)c1S Amb26610306 [1,1,0,0,0,0|2,0,0]=4 5312 B11R1.13 CCOc1cccc(F)c1Br Amb24183610 [1,1,0,0,0,0|1,0,0]=3 5313 B11R1.13 CCOc1cccc(F)c1Cl Amb20620697 [1,1,0,0,0,0|1,1,0]=4 5314 B11R1.13 CCOc1cccc(F)c1F Amb8383572 [1,1,0,0,0,0|1,1,0]=4 5315 B11R1.13 CCOc1cccc(F)c1N Amb18949547 [1,1,0,0,0,0|2,0,0]=4 5316 B11R1.13 CCOc1cccc(F)c1S Amb26627300 [1,1,0,0,0,0|2,0,0]=4 5317 B11R1.13 CCOc1cccc(I)c1S Amb27945707 [1,1,0,0,0,0|2,0,0]=4 5318 B11R1.13 CCOc1cccc(N)c1C Amb9296372 [1,1,0,0,0,0|2,0,0]=4 5319 B11R1.13 CCOc1cccc(N)c1N Amb16191992 [1,1,0,0,0,0|2,0,0]=4 5320 B11R1.13 CCOc1cccc(N)c1O Amb25210451 [1,1,0,0,0,0|2,0,0]=4 5321 B11R1.13 CCOc1cccc(O)c1F Amb26496891 [1,1,0,0,0,0|1,1,0]=4 5322 B11R1.13 CCOc1cccc(O)c1N Amb25189127 [1,1,0,0,0,0|2,0,0]=4 5323 B11R1.13 CCOc1cccc(O)c1O Amb18125666 [1,1,0,0,0,0|2,0,0]=4 5324 B11R1.13 CCOc1cccc(O)c1S Amb25281573 [1,1,0,0,0,0|2,0,0]=4 5325 B11R1.13 CCOc1cccc(S)c1N Amb18126624 [1,1,0,0,0,0|2,0,0]=4 5326 B11R1.13 CCOc1cccc(S)c1O Amb33376727 [1,1,0,0,0,0|2,0,0]=4 5327 B11R1.13 CCOc1ccnc(Br)c1Br Amb2609584 [1,1,0,0,0,0|2,0,0]=4 5328 B11R1.13 CCOc1ccnc(Cl)c1Br Amb25338436 [1,1,0,0,0,0|2,0,0]=4 5329 B11R1.13 CCOc1nccc(N)c1Br Amb24323148 [1,1,0,0,0,0|2,0,0]=4 5330 B11R1.13 CCSc1cccc(Br)c1Br Amb24471381 [1,1,0,0,0,0|1,0,0]=3 5331 B11R1.13 CCSc1cccc(Br)c1C Amb26330531 [1,1,0,0,0,0|2,0,0]=4 5332 B11R1.13 CCSc1cccc(Br)c1Cl Amb25783006 [1,1,0,0,0,0|1,1,0]=4 5333 B11R1.13 CCSc1cccc(Br)c1F Amb26080221 [1,1,0,0,0,0|1,1,0]=4 5334 B11R1.13 CCSc1cccc(Br)c1N Amb25891810 [1,1,0,0,0,0|2,0,0]=4 5335 B11R1.13 CCSc1cccc(Br)c1O Amb26498158 [1,1,0,0,0,0|2,0,0]=4 5336 B11R1.13 CCSc1cccc(C)c1Br Amb25922699 [1,1,0,0,0,0|1,0,0]=3 5337 B11R1.13 CCSc1cccc(C)c1C Amb27398673 [1,1,0,0,0,0|2,0,0]=4 5338 B11R1.13 CCSc1cccc(C)c1Cl Amb24403168 [1,1,0,0,0,0|1,1,0]=4 5339 B11R1.13 CCSc1cccc(C)c1F Amb24333547 [1,1,0,0,0,0|1,1,0]=4 5340 B11R1.13 CCSc1cccc(C)c1I Amb26047488 [1,1,0,0,0,0|1,1,0]=4 5341 B11R1.13 CCSc1cccc(C)c1N Amb28119144 [1,1,0,0,0,0|2,0,0]=4 5342 B11R1.13 CCSc1cccc(Cl)c1Br Amb26021045 [1,1,0,0,0,0|1,0,0]=3 5343 B11R1.13 CCSc1cccc(Cl)c1C Amb26968539 [1,1,0,0,0,0|2,0,0]=4 5344 B11R1.13 CCSc1cccc(Cl)c1Cl Amb27162317 [1,1,0,0,0,0|1,1,0]=4 5345 B11R1.13 CCSc1cccc(Cl)c1I Amb25121785 [1,1,0,0,0,0|1,1,0]=4 5346 B11R1.13 CCSc1cccc(Cl)c1O Amb26985969 [1,1,0,0,0,0|2,0,0]=4 5347 B11R1.13 CCSc1cccc(F)c1Br Amb25139971 [1,1,0,0,0,0|1,0,0]=3 5348 B11R1.13 CCSc1cccc(F)c1C Amb25992471 [1,1,0,0,0,0|2,0,0]=4 5349 B11R1.13 CCSc1cccc(F)c1Cl Amb27169183 [1,1,0,0,0,0|1,1,0]=4 5350 B11R1.13 CCSc1cccc(F)c1I Amb25891815 [1,1,0,0,0,0|1,1,0]=4 5351 B11R1.13 CCSc1cccc(F)c1N Amb33534857 [1,1,0,0,0,0|2,0,0]=4 5352 B11R1.13 CCSc1cccc(F)c1O Amb24471305 [1,1,0,0,0,0|2,0,0]=4 5353 B11R1.13 CCSc1cccc(I)c1Br Amb25922702 [1,1,0,0,0,0|1,0,0]=3 5354 B11R1.13 CCSc1cccc(I)c1C Amb24471552 [1,1,0,0,0,0|2,0,0]=4 5355 B11R1.13 CCSc1cccc(I)c1Cl Amb28182550 [1,1,0,0,0,0|1,1,0]=4 5356 B11R1.13 CCSc1cccc(I)c1F Amb25742443 [1,1,0,0,0,0|1,1,0]=4 5357 B11R1.13 CCSc1cccc(I)c1N Amb26587962 [1,1,0,0,0,0|2,0,0]=4 5358 B11R1.13 CCSc1cccc(I)c1O Amb26053396 [1,1,0,0,0,0|2,0,0]=4 5359 B11R1.13 CCSc1cccc(N)c1Br Amb25891590 [1,1,0,0,0,0|1,0,0]=3 5360 B11R1.13 CCSc1cccc(N)c1Cl Amb25943768 [1,1,0,0,0,0|1,1,0]=4 5361 B11R1.13 CCSc1cccc(N)c1F Amb24334626 [1,1,0,0,0,0|1,1,0]=4 5362 B11R1.13 CCSc1cccc(N)c1I Amb25891613 [1,1,0,0,0,0|1,1,0]=4 5363 B11R1.13 CCSc1cccc(N)c1N Amb25729889 [1,1,0,0,0,0|2,0,0]=4 5364 B11R1.13 CCSc1cccc(N)c1O Amb25126644 [1,1,0,0,0,0|2,0,0]=4 5365 B11R1.13 CCSc1cccc(O)c1Br Amb26559003 [1,1,0,0,0,0|1,0,0]=3 5366 B11R1.13 CCSc1cccc(O)c1Cl Amb24737484 [1,1,0,0,0,0|1,1,0]=4 5367 B11R1.13 CCSc1cccc(O)c1I Amb27273104 [1,1,0,0,0,0|1,1,0]=4 5368 B11R1.13 CCSc1cccc(O)c1N Amb25862019 [1,1,0,0,0,0|2,0,0]=4 5369 B11R1.13 CCSc1cccc(O)c1O Amb26982592 [1,1,0,0,0,0|2,0,0]=4 5370 B11R1.13 CNCC1=CC=CC(=O)N1C Amb27484697 [1,1,0,0,0,0|2,0,0]=4 5371 B11R1.13 CNCC1=CC=CN(C)C1=O Amb18925092 [1,1,0,0,0,0|2,0,0]=4 5372 B11R1.13 CNCc1cccc(Br)c1C Amb27413954 [1,1,0,0,0,0|1,0,0]=3 5373 B11R1.13 CNCc1cccc(Br)c1Cl Amb28314387 [1,1,0,0,0,0|0,1,0]=3 5374 B11R1.13 CNCc1cccc(Br)c1F Amb19929945 [1,1,0,0,0,0|0,1,0]=3 5375 B11R1.13 CNCc1cccc(Br)c1O Amb18955438 [1,1,0,0,0,0|1,0,0]=3 5376 B11R1.13 CNCc1cccc(C)c1Br Amb21961705 [1,1,0,0,0,0|0,0,0]=2 5377 B11R1.13 CNCc1cccc(C)c1C Amb9203987 [1,1,0,0,0,0|1,0,0]=3 5378 B11R1.13 CNCc1cccc(C)c1Cl Amb25922781 [1,1,0,0,0,0|0,1,0]=3 5379 B11R1.13 CNCc1cccc(C)c1F Amb19929943 [1,1,0,0,0,0|0,1,0]=3 5380 B11R1.13 CNCc1cccc(Cl)c1Br Amb26058052 [1,1,0,0,0,0|0,0,0]=2 5381 B11R1.13 CNCc1cccc(Cl)c1C Amb18862831 [1,1,0,0,0,0|1,0,0]=3 5382 B11R1.13 CNCc1cccc(Cl)c1Cl Amb1648455 [1,1,0,0,0,0|0,1,0]=3 5383 B11R1.13 CNCc1cccc(Cl)c1Cl Amb20668318 [1,1,0,0,0,0|0,1,0]=3 5384 B11R1.13 CNCc1cccc(Cl)c1F Amb22371428 [1,1,0,0,0,0|0,1,0]=3 5385 B11R1.13 CNCc1cccc(Cl)c1F Amb30625688 [1,1,0,0,0,0|0,1,0]=3 5386 B11R1.13 CNCc1cccc(Cl)c1O Amb24104294 [1,1,0,0,0,0|1,0,0]=3 5387 B11R1.13 CNCc1cccc(F)c1Br Amb25292066 [1,1,0,0,0,0|0,0,0]=2 5388 B11R1.13 CNCc1cccc(F)c1C Amb25723888 [1,1,0,0,0,0|1,0,0]=3 5389 B11R1.13 CNCc1cccc(F)c1Cl Amb26511761 [1,1,0,0,0,0|0,1,0]=3 5390 B11R1.13 CNCc1cccc(F)c1F Amb9232928 [1,1,0,0,0,0|0,1,0]=3 5391 B11R1.13 CNCc1cccc(F)c1O Amb27240416 [1,1,0,0,0,0|1,0,0]=3 5392 B11R1.13 CNCc1cccc(O)c1Br Amb25922737 [1,1,0,0,0,0|0,0,0]=2 5393 B11R1.13 CNCc1cccc(O)c1C Amb26373138 [1,1,0,0,0,0|1,0,0]=3 5394 B11R1.13 CNCc1cccc(O)c1Cl Amb24644000 [1,1,0,0,0,0|0,1,0]=3 5395 B11R1.13 CNCc1cccc(O)c1F Amb27169646 [1,1,0,0,0,0|0,1,0]=3 5396 B11R1.13 CNCc1cccc(O)c1O Amb18953132 [1,1,0,0,0,0|1,0,0]=3 5397 B11R1.13 CNCc1ccnc(F)c1F Amb32721896 [1,1,0,0,0,0|1,1,0]=4 5398 B11R1.13 CNCc1ccnc(N)c1F Amb27808550 [1,1,0,0,0,0|1,1,0]=4 5399 B11R1.13 CN\C=C1\C=CC=C(O)C1=O Amb25287285 [1,1,0,0,0,0|1,0,1]=4 5400 B11R1.13 COCc1cccc(Br)c1F Amb24105371 [1,1,0,0,0,0|1,1,0]=4 5401 B11R1.13 COCc1cccc(C)c1Br Amb27808753 [1,1,0,0,0,0|1,0,0]=3 5402 B11R1.13 COCc1cccc(N)c1C Amb9369778 [1,1,0,0,0,0|2,0,0]=4 5403 B11R1.13 COCc1cccc(O)c1F Amb28351562 [1,1,0,0,0,0|1,1,0]=4 5404 B11R1.13 COCc1ccnc(N)c1Br Amb27438601 [1,1,0,0,0,0|2,0,0]=4 5405 B11R1.13 CSCc1cccc(Cl)c1F Amb27644227 [1,1,0,0,0,0|1,1,0]=4 5406 B11R1.13 CSCc1cccc(I)c1Cl Amb27812170 [1,1,0,0,0,0|1,1,0]=4 5407 B11R1.13 CSCc1cccc(I)c1F Amb28321488 [1,1,0,0,0,0|1,1,0]=4 5408 B11R1.13 CSCc1cccc(N)c1Br Amb27948395 [1,1,0,0,0,0|1,0,0]=3 5409 B11R1.13 CSCc1cccc(N)c1C Amb18951032 [1,1,0,0,0,0|2,0,0]=4 5410 B11R1.13 CSCc1cccc(O)c1O Amb28351594 [1,1,0,0,0,0|2,0,0]=4 5411 B11R1.13 Cc1c(Br)cccc1CCBr Amb33476916 [1,1,0,0,0,0|2,0,0]=4 5412 B11R1.13 Cc1c(Br)cccc1CCN Amb28182541 [1,1,0,0,0,0|1,0,0]=3 5413 B11R1.13 Cc1c(Br)cccc1CCO Amb27823517 [1,1,0,0,0,0|2,0,0]=4 5414 B11R1.13 Cc1c(Br)cccc1CCS Amb33478012 [1,1,0,0,0,0|2,0,0]=4 5415 B11R1.13 Cc1c(Br)cccc1CNN Amb26073758 [1,1,0,0,0,0|2,0,0]=4 5416 B11R1.13 Cc1c(Br)cccc1CNO Amb33389560 [1,1,0,0,0,0|2,0,0]=4 5417 B11R1.13 Cc1c(Br)cccc1CON Amb25121314 [1,1,0,0,0,0|2,0,0]=4 5418 B11R1.13 Cc1c(CCN)ccnc1F Amb27460784 [1,1,0,0,0,0|2,0,0]=4 5419 B11R1.13 Cc1c(Cl)cccc1CCN Amb17470477 [1,1,0,0,0,0|1,0,0]=3 5420 B11R1.13 Cc1c(Cl)cccc1CCO Amb27593870 [1,1,0,0,0,0|2,0,0]=4 5421 B11R1.13 Cc1c(Cl)cccc1CCS Amb27771319 [1,1,0,0,0,0|2,0,0]=4 5422 B11R1.13 Cc1c(Cl)ccnc1CCN Amb27787554 [1,1,0,0,0,0|2,0,0]=4 5423 B11R1.13 Cc1c(F)cccc1CCBr Amb33333338 [1,1,0,0,0,0|2,0,0]=4 5424 B11R1.13 Cc1c(F)cccc1CCN Amb23442805 [1,1,0,0,0,0|1,0,0]=3 5425 B11R1.13 Cc1c(F)cccc1CCO Amb25256405 [1,1,0,0,0,0|2,0,0]=4 5426 B11R1.13 Cc1c(F)cccc1CCS Amb25865867 [1,1,0,0,0,0|2,0,0]=4 5427 B11R1.13 Cc1c(F)cccc1CNN Amb26581503 [1,1,0,0,0,0|2,0,0]=4 5428 B11R1.13 Cc1c(F)cccc1CNO Amb33310532 [1,1,0,0,0,0|2,0,0]=4 5429 B11R1.13 Cc1c(F)cccc1CON Amb27879782 [1,1,0,0,0,0|2,0,0]=4 5430 B11R1.13 Cc1c(I)cccc1CCN Amb27495435 [1,1,0,0,0,0|1,0,0]=3 5431 B11R1.13 Cc1c(O)cccc1CCN Amb26889136 [1,1,0,0,0,0|1,0,0]=3 5432 B11R1.13 Cc1cccc(CC#N)c1Br Amb24382489 [1,1,0,0,0,0|0,0,2]=4 5433 B11R1.13 Cc1cccc(CCBr)c1C Amb27801990 [1,1,0,0,0,0|2,0,0]=4 5434 B11R1.13 Cc1cccc(CCBr)c1Cl Amb33434217 [1,1,0,0,0,0|1,1,0]=4 5435 B11R1.13 Cc1cccc(CCBr)c1F Amb24571323 [1,1,0,0,0,0|1,1,0]=4 5436 B11R1.13 Cc1cccc(CCN)c1Br Amb24395145 [1,1,0,0,0,0|0,0,0]=2 5437 B11R1.13 Cc1cccc(CCN)c1C Amb17470389 [1,1,0,0,0,0|1,0,0]=3 5438 B11R1.13 Cc1cccc(CCN)c1Cl Amb27839876 [1,1,0,0,0,0|0,1,0]=3 5439 B11R1.13 Cc1cccc(CCN)c1F Amb25887175 [1,1,0,0,0,0|0,1,0]=3 5440 B11R1.13 Cc1cccc(CCO)c1Br Amb22753531 [1,1,0,0,0,0|1,0,0]=3 5441 B11R1.13 Cc1cccc(CCO)c1C Amb18181673 [1,1,0,0,0,0|2,0,0]=4 5442 B11R1.13 Cc1cccc(CCO)c1F Amb26437897 [1,1,0,0,0,0|1,1,0]=4 5443 B11R1.13 Cc1cccc(CCS)c1C Amb17400227 [1,1,0,0,0,0|2,0,0]=4 5444 B11R1.13 Cc1cccc(CCS)c1F Amb33324235 [1,1,0,0,0,0|1,1,0]=4 5445 B11R1.13 Cc1cccc(CNN)c1C Amb6248601 [1,1,0,0,0,0|2,0,0]=4 5446 B11R1.13 Cc1cccc(CNN)c1Cl Amb25334913 [1,1,0,0,0,0|1,1,0]=4 5447 B11R1.13 Cc1cccc(CNN)c1F Amb28281019 [1,1,0,0,0,0|1,1,0]=4 5448 B11R1.13 Cc1cccc(CNN)c1O Amb27857235 [1,1,0,0,0,0|2,0,0]=4 5449 B11R1.13 Cc1cccc(CNO)c1C Amb28348043 [1,1,0,0,0,0|2,0,0]=4 5450 B11R1.13 Cc1cccc(CNO)c1F Amb27445573 [1,1,0,0,0,0|1,1,0]=4 5451 B11R1.13 Cc1cccc(CON)c1Br Amb27494955 [1,1,0,0,0,0|1,0,0]=3 5452 B11R1.13 Cc1cccc(CON)c1C Amb25840439 [1,1,0,0,0,0|2,0,0]=4 5453 B11R1.13 Cc1cccc(CON)c1Cl Amb27227289 [1,1,0,0,0,0|1,1,0]=4 5454 B11R1.13 Cc1cccc(CON)c1F Amb28204211 [1,1,0,0,0,0|1,1,0]=4 5455 B11R1.13 Cc1ccnc(CCN)c1C Amb28124623 [1,1,0,0,0,0|2,0,0]=4 5456 B11R1.13 Cc1cncc(CCN)c1F Amb27227288 [1,1,0,0,0,0|1,1,0]=4 5457 B11R1.13 Cc1nccc(CCN)c1C Amb27823452 [1,1,0,0,0,0|2,0,0]=4 5458 B11R1.13 Clc1cccc(CCBr)c1Cl Amb27604333 [1,1,0,0,0,0|1,1,0]=4 5459 B11R1.13 Fc1c(Br)cccc1CCBr Amb25716671 [1,1,0,0,0,0|1,1,0]=4 5460 B11R1.13 Fc1c(Br)cccc1CCCl Amb28128397 [1,1,0,0,0,0|1,1,0]=4 5461 B11R1.13 Fc1c(Br)cccc1CCS Amb33387362 [1,1,0,0,0,0|1,1,0]=4 5462 B11R1.13 Fc1c(Cl)cccc1CCBr Amb26349833 [1,1,0,0,0,0|1,1,0]=4 5463 B11R1.13 Fc1c(Cl)cccc1CCS Amb33223044 [1,1,0,0,0,0|1,1,0]=4 5464 B11R1.13 Fc1cccc(CCBr)c1Br Amb27191661 [1,1,0,0,0,0|1,0,0]=3 5465 B11R1.13 Fc1cccc(CCBr)c1Cl Amb27635931 [1,1,0,0,0,0|1,1,0]=4 5466 B11R1.13 Fc1cccc(CCBr)c1F Amb26953081 [1,1,0,0,0,0|1,1,0]=4 5467 B11R1.13 Fc1cccc(CCCl)c1Br Amb28123903 [1,1,0,0,0,0|1,0,0]=3 5468 B11R1.13 Fc1cccc(CCCl)c1F Amb27644223 [1,1,0,0,0,0|1,1,0]=4 5469 B11R1.13 Fc1cccc(CCS)c1Br Amb33477645 [1,1,0,0,0,0|1,0,0]=3 5470 B11R1.13 Fc1cccc(CCS)c1F Amb33475255 [1,1,0,0,0,0|1,1,0]=4 5471 B11R1.13 Fc1cccc(OCCl)c1Br Amb32685629 [1,1,0,0,0,0|2,0,0]=4 5472 B11R1.13 N#CCc1cccc(Br)c1Br Amb23412434 [1,1,0,0,0,0|0,0,2]=4 5473 B11R1.13 N#CCc1cccc(Cl)c1Br Amb27945483 [1,1,0,0,0,0|0,0,2]=4 5474 B11R1.13 N#CCc1cccc(F)c1Br Amb10838902 [1,1,0,0,0,0|0,0,2]=4 5475 B11R1.13 N#CCc1cccc(O)c1Br Amb24451143 [1,1,0,0,0,0|0,0,2]=4 5476 B11R1.13 NCCN1C=CC=C(Br)C1=O Amb18542931 [1,1,0,0,0,0|2,0,0]=4 5477 B11R1.13 NCCc1cccc(Br)c1Cl Amb25849940 [1,1,0,0,0,0|0,1,0]=3 5478 B11R1.13 NCCc1cccc(Br)c1F Amb25922697 [1,1,0,0,0,0|0,1,0]=3 5479 B11R1.13 NCCc1cccc(Br)c1O Amb28872330 [1,1,0,0,0,0|1,0,0]=3 5480 B11R1.13 NCCc1cccc(Cl)c1Br Amb26616069 [1,1,0,0,0,0|0,0,0]=2 5481 B11R1.13 NCCc1cccc(Cl)c1Cl Amb2720154 [1,1,0,0,0,0|0,1,0]=3 5482 B11R1.13 NCCc1cccc(Cl)c1Cl Amb33551204 [1,1,0,0,0,0|0,1,0]=3 5483 B11R1.13 NCCc1cccc(Cl)c1F Amb25786406 [1,1,0,0,0,0|0,1,0]=3 5484 B11R1.13 NCCc1cccc(Cl)c1F Amb33483455 [1,1,0,0,0,0|0,1,0]=3 5485 B11R1.13 NCCc1cccc(Cl)c1O Amb27823101 [1,1,0,0,0,0|1,0,0]=3 5486 B11R1.13 NCCc1cccc(F)c1Br Amb25281255 [1,1,0,0,0,0|0,0,0]=2 5487 B11R1.13 NCCc1cccc(F)c1Cl Amb26618418 [1,1,0,0,0,0|0,1,0]=3 5488 B11R1.13 NCCc1cccc(F)c1F Amb19515069 [1,1,0,0,0,0|0,1,0]=3 5489 B11R1.13 NCCc1cccc(F)c1F Amb9523763 [1,1,0,0,0,0|0,1,0]=3 5490 B11R1.13 NCCc1cccc(F)c1O Amb27593428 [1,1,0,0,0,0|1,0,0]=3 5491 B11R1.13 NCCc1cccc(I)c1F Amb27641409 [1,1,0,0,0,0|0,1,0]=3 5492 B11R1.13 NCCc1cccc(N)c1N Amb28384586 [1,1,0,0,0,0|1,0,0]=3 5493 B11R1.13 NCCc1cccc(O)c1Br Amb24727441 [1,1,0,0,0,0|0,0,0]=2 5494 B11R1.13 NCCc1cccc(O)c1Cl Amb26347289 [1,1,0,0,0,0|0,1,0]=3 5495 B11R1.13 NCCc1cccc(O)c1O Amb18062197 [1,1,0,0,0,0|1,0,0]=3 5496 B11R1.13 NCCc1ccnc(Cl)c1O Amb27789553 [1,1,0,0,0,0|2,0,0]=4 5497 B11R1.13 NCCc1cncc(Cl)c1F Amb27234838 [1,1,0,0,0,0|1,1,0]=4 5498 B11R1.13 NNCc1cccc(Br)c1Cl Amb24562164 [1,1,0,0,0,0|1,1,0]=4 5499 B11R1.13 NNCc1cccc(Br)c1F Amb26373401 [1,1,0,0,0,0|1,1,0]=4 5500 B11R1.13 NNCc1cccc(Br)c1O Amb24646836 [1,1,0,0,0,0|2,0,0]=4 5501 B11R1.13 NNCc1cccc(Cl)c1Cl Amb32729426 [1,1,0,0,0,0|1,1,0]=4 5502 B11R1.13 NNCc1cccc(Cl)c1Cl Amb33329427 [1,1,0,0,0,0|1,1,0]=4 5503 B11R1.13 NNCc1cccc(Cl)c1Cl Amb6242925 [1,1,0,0,0,0|1,1,0]=4 5504 B11R1.13 NNCc1cccc(Cl)c1F Amb24401067 [1,1,0,0,0,0|1,1,0]=4 5505 B11R1.13 NNCc1cccc(Cl)c1O Amb33056889 [1,1,0,0,0,0|2,0,0]=4 5506 B11R1.13 NNCc1cccc(F)c1Br Amb27823609 [1,1,0,0,0,0|1,0,0]=3 5507 B11R1.13 NNCc1cccc(F)c1Cl Amb25116901 [1,1,0,0,0,0|1,1,0]=4 5508 B11R1.13 NNCc1cccc(F)c1F Amb9523824 [1,1,0,0,0,0|1,1,0]=4 5509 B11R1.13 NNCc1cccc(F)c1O Amb24084218 [1,1,0,0,0,0|2,0,0]=4 5510 B11R1.13 NNCc1cccc(O)c1Br Amb33386789 [1,1,0,0,0,0|1,0,0]=3 5511 B11R1.13 NNCc1cccc(O)c1O Amb33268813 [1,1,0,0,0,0|2,0,0]=4 5512 B11R1.13 NOCc1cccc(Br)c1Cl Amb28203527 [1,1,0,0,0,0|1,1,0]=4 5513 B11R1.13 NOCc1cccc(Br)c1F Amb25235272 [1,1,0,0,0,0|1,1,0]=4 5514 B11R1.13 NOCc1cccc(Br)c1O Amb33332287 [1,1,0,0,0,0|2,0,0]=4 5515 B11R1.13 NOCc1cccc(Cl)c1Br Amb27951057 [1,1,0,0,0,0|1,0,0]=3 5516 B11R1.13 NOCc1cccc(Cl)c1Cl Amb21929111 [1,1,0,0,0,0|1,1,0]=4 5517 B11R1.13 NOCc1cccc(Cl)c1Cl Amb26333177 [1,1,0,0,0,0|1,1,0]=4 5518 B11R1.13 NOCc1cccc(Cl)c1F Amb26474282 [1,1,0,0,0,0|1,1,0]=4 5519 B11R1.13 NOCc1cccc(Cl)c1O Amb33056892 [1,1,0,0,0,0|2,0,0]=4 5520 B11R1.13 NOCc1cccc(F)c1Br Amb24420090 [1,1,0,0,0,0|1,0,0]=3 5521 B11R1.13 NOCc1cccc(F)c1Cl Amb27184154 [1,1,0,0,0,0|1,1,0]=4 5522 B11R1.13 NOCc1cccc(F)c1F Amb24366609 [1,1,0,0,0,0|1,1,0]=4 5523 B11R1.13 NOCc1cccc(F)c1O Amb33310940 [1,1,0,0,0,0|2,0,0]=4 5524 B11R1.13 NOCc1cccc(O)c1Br Amb33386791 [1,1,0,0,0,0|1,0,0]=3 5525 B11R1.13 NOCc1cccc(O)c1O Amb33268780 [1,1,0,0,0,0|2,0,0]=4 5526 B11R1.13 Nc1cccc(CCO)c1N Amb27866275 [1,1,0,0,0,0|2,0,0]=4 5527 B11R1.13 O=CCc1cccc(F)c1Br Amb25866155 [1,1,0,0,0,0|1,0,1]=4 5528 B11R1.13 O=CCc1cccc(O)c1Br Amb33386831 [1,1,0,0,0,0|1,0,1]=4 5529 B11R1.13 OCCc1cccc(Br)c1F Amb26452828 [1,1,0,0,0,0|1,1,0]=4 5530 B11R1.13 OCCc1cccc(Br)c1O Amb33332277 [1,1,0,0,0,0|2,0,0]=4 5531 B11R1.13 OCCc1cccc(Cl)c1Cl Amb6365681 [1,1,0,0,0,0|1,1,0]=4 5532 B11R1.13 OCCc1cccc(Cl)c1F Amb22047538 [1,1,0,0,0,0|1,1,0]=4 5533 B11R1.13 OCCc1cccc(Cl)c1O Amb24457612 [1,1,0,0,0,0|2,0,0]=4 5534 B11R1.13 OCCc1cccc(F)c1Cl Amb25883314 [1,1,0,0,0,0|1,1,0]=4 5535 B11R1.13 OCCc1cccc(F)c1F Amb10605598 [1,1,0,0,0,0|1,1,0]=4 5536 B11R1.13 OCCc1cccc(F)c1O Amb33310982 [1,1,0,0,0,0|2,0,0]=4 5537 B11R1.13 OCCc1cccc(O)c1Br Amb33227249 [1,1,0,0,0,0|1,0,0]=3 5538 B11R1.13 OCCc1cccc(O)c1O Amb25986019 [1,1,0,0,0,0|2,0,0]=4 5539 B11R1.13 ONCc1cccc(Br)c1F Amb25950483 [1,1,0,0,0,0|1,1,0]=4 5540 B11R1.13 ONCc1cccc(Br)c1O Amb25354526 [1,1,0,0,0,0|2,0,0]=4 5541 B11R1.13 ONCc1cccc(Cl)c1Cl Amb28139348 [1,1,0,0,0,0|1,1,0]=4 5542 B11R1.13 ONCc1cccc(Cl)c1F Amb27491824 [1,1,0,0,0,0|1,1,0]=4 5543 B11R1.13 ONCc1cccc(Cl)c1O Amb28285027 [1,1,0,0,0,0|2,0,0]=4 5544 B11R1.13 ONCc1cccc(F)c1Br Amb28141679 [1,1,0,0,0,0|1,0,0]=3 5545 B11R1.13 ONCc1cccc(F)c1F Amb25675083 [1,1,0,0,0,0|1,1,0]=4 5546 B11R1.13 ONCc1cccc(F)c1O Amb24701869 [1,1,0,0,0,0|2,0,0]=4 5547 B11R1.13 ONCc1cccc(O)c1Br Amb27645913 [1,1,0,0,0,0|1,0,0]=3 5548 B11R1.13 ONCc1cccc(O)c1O Amb25150244 [1,1,0,0,0,0|2,0,0]=4 5549 B11R1.13 Oc1c(Br)cccc1CCBr Amb33332507 [1,1,0,0,0,0|2,0,0]=4 5550 B11R1.13 Oc1c(Br)cccc1CCS Amb33332604 [1,1,0,0,0,0|2,0,0]=4 5551 B11R1.13 Oc1c(Cl)cccc1CCBr Amb33433693 [1,1,0,0,0,0|2,0,0]=4 5552 B11R1.13 Oc1c(Cl)cccc1CCS Amb33057280 [1,1,0,0,0,0|2,0,0]=4 5553 B11R1.13 Oc1c(F)cccc1CCBr Amb33477555 [1,1,0,0,0,0|2,0,0]=4 5554 B11R1.13 Oc1c(F)cccc1CCS Amb33310589 [1,1,0,0,0,0|2,0,0]=4 5555 B11R1.13 Oc1cccc(CCBr)c1Br Amb33386796 [1,1,0,0,0,0|1,0,0]=3 5556 B11R1.13 Oc1cccc(CCBr)c1O Amb33007159 [1,1,0,0,0,0|2,0,0]=4 5557 B11R1.13 Oc1cccc(CCS)c1Br Amb33386898 [1,1,0,0,0,0|1,0,0]=3 5558 B11R1.13 Oc1cccc(CCS)c1O Amb33267640 [1,1,0,0,0,0|2,0,0]=4 5559 B11R1.13 SCCc1cccc(Cl)c1Cl Amb33052740 [1,1,0,0,0,0|1,1,0]=4 5560 B11R1.13 [C-]#[N+]Cc1cccc(F)c1Br Amb33450550 [1,1,0,0,0,0|0,0,2]=4 5561 B11R1.41 BrCCc1ccccc1CBr Amb2609054 [1,1,0,0,0,0|1,0,0]=3 5562 B11R1.41 C#Cc1ccccc1CCBr Amb33386535 [1,1,0,0,0,0|2,0,0]=4 5563 B11R1.41 C#Cc1ccccc1CCN Amb27874038 [1,1,0,0,0,0|1,0,0]=3 5564 B11R1.41 C#Cc1ccccc1CCO Amb28292134 [1,1,0,0,0,0|2,0,0]=4 5565 B11R1.41 C#Cc1ccccc1CCS Amb33373850 [1,1,0,0,0,0|2,0,0]=4 5566 B11R1.41 C#Cc1ccccc1CNC Amb25151949 [1,1,0,0,0,0|1,0,0]=3 5567 B11R1.41 C#Cc1ccccc1CNN Amb33203606 [1,1,0,0,0,0|2,0,0]=4 5568 B11R1.41 C#Cc1ccccc1CNO Amb33314772 [1,1,0,0,0,0|2,0,0]=4 5569 B11R1.41 C#Cc1ccccc1COC Amb27273609 [1,1,0,0,0,0|2,0,0]=4 5570 B11R1.41 C#Cc1ccccc1CON Amb26631058 [1,1,0,0,0,0|2,0,0]=4 5571 B11R1.41 C#Cc1ccccc1CSC Amb27396248 [1,1,0,0,0,0|2,0,0]=4 5572 B11R1.41 C#Cc1ccccc1OCC Amb33540801 [1,1,0,0,0,0|2,0,0]=4 5573 B11R1.41 C#Cc1cccnc1CCN Amb26604611 [1,1,0,0,0,0|2,0,0]=4 5574 B11R1.41 C#Cc1ccncc1CCN Amb28249550 [1,1,0,0,0,0|2,0,0]=4 5575 B11R1.41 C#Cc1ccncc1CNC Amb25709767 [1,1,0,0,0,0|2,0,0]=4 5576 B11R1.41 C=CCc1ccccc1CBr Amb25799496 [1,1,0,0,0,0|0,0,2]=4 5577 B11R1.41 C=Cc1ccccc1CCN Amb27468637 [1,1,0,0,0,0|1,0,0]=3 5578 B11R1.41 C=Cc1ccccc1CCO Amb25148236 [1,1,0,0,0,0|2,0,0]=4 5579 B11R1.41 C=Cc1ccccc1COC Amb25234064 [1,1,0,0,0,0|2,0,0]=4 5580 B11R1.41 C=Cc1ccccc1OCC Amb26635795 [1,1,0,0,0,0|2,0,0]=4 5581 B11R1.41 C=Cc1cccnc1CCN Amb24487026 [1,1,0,0,0,0|2,0,0]=4 5582 B11R1.41 C=Cc1ccncc1CCC Amb28249774 [1,1,0,0,0,0|2,0,0]=4 5583 B11R1.41 C=Cc1ccncc1CCN Amb27398279 [1,1,0,0,0,0|2,0,0]=4 5584 B11R1.41 C=Cc1ccncc1CNC Amb27210611 [1,1,0,0,0,0|2,0,0]=4 5585 B11R1.41 C=Cc1ncccc1CCN Amb24438442 [1,1,0,0,0,0|2,0,0]=4 5586 B11R1.41 CC#Cc1ccccc1CBr Amb28428432 [1,1,0,0,0,0|0,0,2]=4 5587 B11R1.41 CCCc1ccccc1C#N Amb18124753 [1,1,0,0,0,0|1,0,0]=3 5588 B11R1.41 CCCc1ccccc1CBr Amb28251078 [1,1,0,0,0,0|0,0,0]=2 5589 B11R1.41 CCCc1ccccc1CCl Amb26880226 [1,1,0,0,0,0|0,1,0]=3 5590 B11R1.41 CCCc1ccccc1CN Amb22495320 [1,1,0,0,0,0|1,0,0]=3 5591 B11R1.41 CCCc1ccccc1CO Amb25148384 [1,1,0,0,0,0|1,0,0]=3 5592 B11R1.41 CCCc1ccccc1ON Amb35663049 [1,1,0,0,0,0|1,0,0]=3 5593 B11R1.41 CCCc1ccncc1C#N Amb27405249 [1,1,0,0,0,0|2,0,0]=4 5594 B11R1.41 CCCc1ccncc1NN Amb23559890 [1,1,0,0,0,0|2,0,0]=4 5595 B11R1.41 CCCc1ncccc1CN Amb23559645 [1,1,0,0,0,0|2,0,0]=4 5596 B11R1.41 CCNc1ccccc1C#N Amb6696141 [1,1,0,0,0,0|2,0,0]=4 5597 B11R1.41 CCNc1ccccc1C=O Amb18125011 [1,1,0,0,0,0|2,0,0]=4 5598 B11R1.41 CCNc1ccccc1CC Amb6698994 [1,1,0,0,0,0|2,0,0]=4 5599 B11R1.41 CCNc1ccccc1CN Amb18985733 [1,1,0,0,0,0|2,0,0]=4 5600 B11R1.41 CCNc1ccccc1OC Amb6688442 [1,1,0,0,0,0|2,0,0]=4 5601 B11R1.41 CCNc1ccccc1OC Amb8426360 [1,1,0,0,0,0|2,0,0]=4 5602 B11R1.41 CCNc1ccccc1SC Amb9226547 [1,1,0,0,0,0|2,0,0]=4 5603 B11R1.41 CCOc1ccccc1C#N Amb2687708 [1,1,0,0,0,0|2,0,0]=4 5604 B11R1.41 CCOc1ccccc1C=O Amb845365 [1,1,0,0,0,0|2,0,0]=4 5605 B11R1.41 CCOc1ccccc1CBr Amb9210672 [1,1,0,0,0,0|1,0,0]=3 5606 B11R1.41 CCOc1ccccc1CCl Amb1105979 [1,1,0,0,0,0|1,1,0]=4 5607 B11R1.41 CCOc1ccccc1CN Amb1121122 [1,1,0,0,0,0|2,0,0]=4 5608 B11R1.41 CCOc1ccccc1CN Amb6298751 [1,1,0,0,0,0|2,0,0]=4 5609 B11R1.41 CCOc1ccccc1CO Amb3546826 [1,1,0,0,0,0|2,0,0]=4 5610 B11R1.41 CCOc1ccccc1CS Amb6255949 [1,1,0,0,0,0|2,0,0]=4 5611 B11R1.41 CCOc1ccccc1NC Amb28960305 [1,1,0,0,0,0|2,0,0]=4 5612 B11R1.41 CCOc1ccccc1NC Amb6708581 [1,1,0,0,0,0|2,0,0]=4 5613 B11R1.41 CCOc1ccccc1NN Amb1048096 [1,1,0,0,0,0|2,0,0]=4 5614 B11R1.41 CCOc1ccccc1OC Amb6297291 [1,1,0,0,0,0|2,0,0]=4 5615 B11R1.41 CCOc1ccccc1ON Amb27768515 [1,1,0,0,0,0|2,0,0]=4 5616 B11R1.41 CCOc1ccccc1SC Amb27950613 [1,1,0,0,0,0|2,0,0]=4 5617 B11R1.41 CCOc1ccccc1[Mg]Br Amb22000597 [1,1,0,0,0,0|1,0,0]=3 5618 B11R1.41 CCSc1ccccc1C#N Amb6717013 [1,1,0,0,0,0|2,0,0]=4 5619 B11R1.41 CCSc1ccccc1C=O Amb18126446 [1,1,0,0,0,0|2,0,0]=4 5620 B11R1.41 CCSc1ccccc1CCl Amb26942337 [1,1,0,0,0,0|1,1,0]=4 5621 B11R1.41 CCSc1ccccc1OC Amb24728558 [1,1,0,0,0,0|2,0,0]=4 5622 B11R1.41 CCc1ccccc1CCBr Amb26048272 [1,1,0,0,0,0|2,0,0]=4 5623 B11R1.41 CCc1ccccc1CCN Amb17470390 [1,1,0,0,0,0|1,0,0]=3 5624 B11R1.41 CCc1ccccc1CCO Amb22365060 [1,1,0,0,0,0|2,0,0]=4 5625 B11R1.41 CCc1ccccc1CCS Amb24744538 [1,1,0,0,0,0|2,0,0]=4 5626 B11R1.41 CCc1ccccc1CNC Amb18298138 [1,1,0,0,0,0|1,0,0]=3 5627 B11R1.41 CCc1ccccc1CNN Amb18181676 [1,1,0,0,0,0|2,0,0]=4 5628 B11R1.41 CCc1ccccc1CNO Amb26610242 [1,1,0,0,0,0|2,0,0]=4 5629 B11R1.41 CCc1ccccc1CON Amb28047388 [1,1,0,0,0,0|2,0,0]=4 5630 B11R1.41 CCc1ccccc1CSC Amb26935918 [1,1,0,0,0,0|2,0,0]=4 5631 B11R1.41 CCc1cnccc1CNC Amb27648539 [1,1,0,0,0,0|2,0,0]=4 5632 B11R1.41 CNCc1ccccc1CF Amb27224062 [1,1,0,0,0,0|0,1,0]=3 5633 B11R1.41 CNCc1ccccc1CN Amb19649558 [1,1,0,0,0,0|1,0,0]=3 5634 B11R1.41 CNCc1ccccc1CO Amb6739980 [1,1,0,0,0,0|1,0,0]=3 5635 B11R1.41 CNCc1ccccc1NO Amb27863623 [1,1,0,0,0,0|1,0,0]=3 5636 B11R1.41 CNCc1ccccc1OC Amb1209261 [1,1,0,0,0,0|1,0,0]=3 5637 B11R1.41 CNCc1ccccc1OC Amb13777232 [1,1,0,0,0,0|1,0,0]=3 5638 B11R1.41 CNCc1ccccc1OC Amb6198738 [1,1,0,0,0,0|1,0,0]=3 5639 B11R1.41 CNCc1ccccc1SC Amb28346176 [1,1,0,0,0,0|1,0,0]=3 5640 B11R1.41 CNCc1cccnc1OC Amb18296135 [1,1,0,0,0,0|2,0,0]=4 5641 B11R1.41 CNCc1ncccc1OC Amb22501149 [1,1,0,0,0,0|2,0,0]=4 5642 B11R1.41 CNc1ccccc1CCO Amb20246815 [1,1,0,0,0,0|2,0,0]=4 5643 B11R1.41 CNc1ccccc1COC Amb18292436 [1,1,0,0,0,0|2,0,0]=4 5644 B11R1.41 CNc1ccccc1CSC Amb27230204 [1,1,0,0,0,0|2,0,0]=4 5645 B11R1.41 COCc1ccccc1C#N Amb6273717 [1,1,0,0,0,0|2,0,0]=4 5646 B11R1.41 COCc1ccccc1C=O Amb18644422 [1,1,0,0,0,0|2,0,0]=4 5647 B11R1.41 COCc1ccccc1CBr Amb26868657 [1,1,0,0,0,0|1,0,0]=3 5648 B11R1.41 COCc1ccccc1CI Amb27421603 [1,1,0,0,0,0|1,1,0]=4 5649 B11R1.41 COCc1ccccc1CN Amb1135743 [1,1,0,0,0,0|2,0,0]=4 5650 B11R1.41 COCc1ccccc1CO Amb24069032 [1,1,0,0,0,0|2,0,0]=4 5651 B11R1.41 COCc1ccccc1CS Amb26371095 [1,1,0,0,0,0|2,0,0]=4 5652 B11R1.41 COCc1ccccc1NN Amb18791509 [1,1,0,0,0,0|2,0,0]=4 5653 B11R1.41 COc1ccccc1CCBr Amb7089046 [1,1,0,0,0,0|2,0,0]=4 5654 B11R1.41 COc1ccccc1CCCl Amb9004320 [1,1,0,0,0,0|2,0,0]=4 5655 B11R1.41 COc1ccccc1CCI Amb27239817 [1,1,0,0,0,0|2,0,0]=4 5656 B11R1.41 COc1ccccc1CCN Amb1233400 [1,1,0,0,0,0|1,0,0]=3 5657 B11R1.41 COc1ccccc1CCN Amb32405011 [1,1,0,0,0,0|1,0,0]=3 5658 B11R1.41 COc1ccccc1CCO Amb3939092 [1,1,0,0,0,0|2,0,0]=4 5659 B11R1.41 COc1ccccc1CCS Amb17400285 [1,1,0,0,0,0|2,0,0]=4 5660 B11R1.41 COc1ccccc1CNN Amb2691314 [1,1,0,0,0,0|2,0,0]=4 5661 B11R1.41 COc1ccccc1CNN Amb5559614 [1,1,0,0,0,0|2,0,0]=4 5662 B11R1.41 COc1ccccc1CNN Amb8471150 [1,1,0,0,0,0|2,0,0]=4 5663 B11R1.41 COc1ccccc1CNO Amb23449445 [1,1,0,0,0,0|2,0,0]=4 5664 B11R1.41 COc1ccccc1CON Amb17091435 [1,1,0,0,0,0|2,0,0]=4 5665 B11R1.41 COc1ccccc1CON Amb21929115 [1,1,0,0,0,0|2,0,0]=4 5666 B11R1.41 COc1ccccc1CSC Amb4020913 [1,1,0,0,0,0|2,0,0]=4 5667 B11R1.41 COc1cccnc1CCN Amb8011394 [1,1,0,0,0,0|2,0,0]=4 5668 B11R1.41 COc1ccncc1CCN Amb25840789 [1,1,0,0,0,0|2,0,0]=4 5669 B11R1.41 COc1ccncc1CCN Amb30584658 [1,1,0,0,0,0|2,0,0]=4 5670 B11R1.41 COc1cnccc1CCN Amb22494560 [1,1,0,0,0,0|2,0,0]=4 5671 B11R1.41 COc1cnccc1CCN Amb33718647 [1,1,0,0,0,0|2,0,0]=4 5672 B11R1.41 COc1ncccc1CCN Amb8011374 [1,1,0,0,0,0|2,0,0]=4 5673 B11R1.41 CSCc1ccccc1C#N Amb17498205 [1,1,0,0,0,0|2,0,0]=4 5674 B11R1.41 CSCc1ccccc1CCl Amb27883437 [1,1,0,0,0,0|1,1,0]=4 5675 B11R1.41 CSCc1ccccc1CN Amb18290092 [1,1,0,0,0,0|2,0,0]=4 5676 B11R1.41 CSCc1ccccc1CO Amb28401109 [1,1,0,0,0,0|2,0,0]=4 5677 B11R1.41 CSc1ccccc1CCBr Amb33007107 [1,1,0,0,0,0|2,0,0]=4 5678 B11R1.41 CSc1ccccc1CCCl Amb28342221 [1,1,0,0,0,0|2,0,0]=4 5679 B11R1.41 CSc1ccccc1CCN Amb18126484 [1,1,0,0,0,0|1,0,0]=3 5680 B11R1.41 CSc1ccccc1CCO Amb25305735 [1,1,0,0,0,0|2,0,0]=4 5681 B11R1.41 CSc1ccccc1CCS Amb32876635 [1,1,0,0,0,0|2,0,0]=4 5682 B11R1.41 CSc1ccccc1CNN Amb24465726 [1,1,0,0,0,0|2,0,0]=4 5683 B11R1.41 CSc1ccccc1CNO Amb33266282 [1,1,0,0,0,0|2,0,0]=4 5684 B11R1.41 CSc1ccccc1CON Amb33465867 [1,1,0,0,0,0|2,0,0]=4 5685 B11R1.41 N#CCc1ccccc1CBr Amb18131117 [1,1,0,0,0,0|0,0,2]=4 5686 B11R1.41 N#Cc1ccccc1CCBr Amb27792951 [1,1,0,0,0,0|2,0,0]=4 5687 B11R1.41 N#Cc1ccccc1CCN Amb19889666 [1,1,0,0,0,0|1,0,0]=3 5688 B11R1.41 N#Cc1ccccc1CCN Amb26482791 [1,1,0,0,0,0|1,0,0]=3 5689 B11R1.41 N#Cc1ccccc1CCO Amb13883613 [1,1,0,0,0,0|2,0,0]=4 5690 B11R1.41 N#Cc1ccccc1CCS Amb33449680 [1,1,0,0,0,0|2,0,0]=4 5691 B11R1.41 N#Cc1ccccc1CNN Amb24457826 [1,1,0,0,0,0|2,0,0]=4 5692 B11R1.41 N#Cc1ccccc1CNO Amb26025983 [1,1,0,0,0,0|2,0,0]=4 5693 B11R1.41 N#Cc1ccccc1CON Amb26371077 [1,1,0,0,0,0|2,0,0]=4 5694 B11R1.41 N#Cc1cnccc1CCN Amb18202294 [1,1,0,0,0,0|2,0,0]=4 5695 B11R1.41 N#Cc1ncccc1CCN Amb28423115 [1,1,0,0,0,0|2,0,0]=4 5696 B11R1.41 NCCc1ccccc1CN Amb27175357 [1,1,0,0,0,0|1,0,0]=3 5697 B11R1.41 NCCc1ccccc1CO Amb25727716 [1,1,0,0,0,0|1,0,0]=3 5698 B11R1.41 NCCc1cccnc1CN Amb25824951 [1,1,0,0,0,0|2,0,0]=4 5699 B11R1.41 NNCc1ccccc1NN Amb28382144 [1,1,0,0,0,0|2,0,0]=4 5700 B11R1.41 O=Cc1ccccc1CCBr Amb16231602 [1,1,0,0,0,0|2,0,0]=4 5701 B11R1.41 O=Cc1ccccc1CCCl Amb17594227 [1,1,0,0,0,0|2,0,0]=4 5702 B11R1.41 O=Cc1ccccc1CCF Amb22739039 [1,1,0,0,0,0|2,0,0]=4 5703 B11R1.41 O=Cc1ccccc1CCO Amb17593729 [1,1,0,0,0,0|2,0,0]=4 5704 B11R1.41 OCCc1ccccc1CO Amb17593783 [1,1,0,0,0,0|2,0,0]=4 5705 B11R1.41 OCc1ccccc1CCCl Amb24079845 [1,1,0,0,0,0|2,0,0]=4 5706 B11R1.41 [C-]#[N+]c1ccccc1OCC Amb2687752 [1,1,0,0,0,0|2,0,0]=4 5707 B11R1.81 C#CCc1ccc(Br)cc1Br Amb33432335 [1,1,0,0,0,0|0,0,2]=4 5708 B11R1.81 C#CCc1ccc(C)cc1Br Amb33386413 [1,1,0,0,0,0|0,0,2]=4 5709 B11R1.81 C#CCc1ccc(Cl)cc1Br Amb33478472 [1,1,0,0,0,0|0,0,2]=4 5710 B11R1.81 C#CCc1ccc(F)cc1Br Amb33389614 [1,1,0,0,0,0|0,0,2]=4 5711 B11R1.81 CC1=CC(=O)N(CCN)C=C1 Amb18030461 [1,1,0,0,0,0|2,0,0]=4 5712 B11R1.81 CCCC1=CNC(=O)C=C1N Amb32416786 [1,1,0,0,0,0|2,0,0]=4 5713 B11R1.81 CCCN1C=CC(C)=CC1=O Amb18403658 [1,1,0,0,0,0|2,0,0]=4 5714 B11R1.81 CCCN1C=CC(N)=CC1=O Amb27664190 [1,1,0,0,0,0|2,0,0]=4 5715 B11R1.81 CCCc1ccc(C)cc1C Amb27814633 [1,1,0,0,0,0|1,0,0]=3 5716 B11R1.81 CCCc1ccc(C)cc1N Amb27399786 [1,1,0,0,0,0|1,0,0]=3 5717 B11R1.81 CCCc1ccc(C)cc1O Amb25920846 [1,1,0,0,0,0|1,0,0]=3 5718 B11R1.81 CCCc1ccc(I)cc1F Amb26326578 [1,1,0,0,0,0|0,1,0]=3 5719 B11R1.81 CCCc1ccc(N)cc1Br Amb28317892 [1,1,0,0,0,0|0,0,0]=2 5720 B11R1.81 CCCc1ccc(N)cc1C Amb28437206 [1,1,0,0,0,0|1,0,0]=3 5721 B11R1.81 CCCc1ccc(N)cc1F Amb26933208 [1,1,0,0,0,0|0,1,0]=3 5722 B11R1.81 CCCc1ccc(O)cc1O Amb6297247 [1,1,0,0,0,0|1,0,0]=3 5723 B11R1.81 CCCc1ccc(S)cc1O Amb28122446 [1,1,0,0,0,0|1,0,0]=3 5724 B11R1.81 CCCc1cnc(Br)cc1Br Amb20617521 [1,1,0,0,0,0|1,0,0]=3 5725 B11R1.81 CCCc1cnc(Br)cc1Cl Amb20617543 [1,1,0,0,0,0|1,1,0]=4 5726 B11R1.81 CCCc1cnc(Br)cc1N Amb24319616 [1,1,0,0,0,0|2,0,0]=4 5727 B11R1.81 CCCc1cnc(Br)nc1Br Amb24322894 [1,1,0,0,0,0|2,0,0]=4 5728 B11R1.81 CCCc1cnc(Cl)cc1N Amb24322527 [1,1,0,0,0,0|2,0,0]=4 5729 B11R1.81 CCCc1cnc(N)cc1Br Amb24319537 [1,1,0,0,0,0|1,0,0]=3 5730 B11R1.81 CCCc1cnc(N)nc1Br Amb24322895 [1,1,0,0,0,0|2,0,0]=4 5731 B11R1.81 CCCc1cnc(O)cc1O Amb23570642 [1,1,0,0,0,0|2,0,0]=4 5732 B11R1.81 CCCc1cnc(O)nc1Br Amb24322896 [1,1,0,0,0,0|2,0,0]=4 5733 B11R1.81 CCCc1ncc(Br)cc1N Amb27148657 [1,1,0,0,0,0|2,0,0]=4 5734 B11R1.81 CCCc1ncc(C)cc1N Amb27431035 [1,1,0,0,0,0|2,0,0]=4 5735 B11R1.81 CCCc1ncc(Cl)cc1N Amb25722566 [1,1,0,0,0,0|2,0,0]=4 5736 B11R1.81 CCCc1ncc(F)cc1N Amb28430286 [1,1,0,0,0,0|2,0,0]=4 5737 B11R1.81 CCCc1ncc(N)cc1Br Amb28319687 [1,1,0,0,0,0|1,0,0]=3 5738 B11R1.81 CCCc1ncc(N)cc1C Amb26322673 [1,1,0,0,0,0|2,0,0]=4 5739 B11R1.81 CCCc1ncc(N)cc1Cl Amb28129137 [1,1,0,0,0,0|1,1,0]=4 5740 B11R1.81 CCNc1ccc(Br)cc1Br Amb9226536 [1,1,0,0,0,0|1,0,0]=3 5741 B11R1.81 CCNc1ccc(Br)cc1C Amb6690049 [1,1,0,0,0,0|2,0,0]=4 5742 B11R1.81 CCNc1ccc(Br)cc1Cl Amb8998406 [1,1,0,0,0,0|1,1,0]=4 5743 B11R1.81 CCNc1ccc(Br)cc1F Amb22236051 [1,1,0,0,0,0|1,1,0]=4 5744 B11R1.81 CCNc1ccc(Br)cc1F Amb6691623 [1,1,0,0,0,0|1,1,0]=4 5745 B11R1.81 CCNc1ccc(Br)cc1N Amb9205239 [1,1,0,0,0,0|2,0,0]=4 5746 B11R1.81 CCNc1ccc(C)cc1Br Amb6688271 [1,1,0,0,0,0|1,0,0]=3 5747 B11R1.81 CCNc1ccc(C)cc1C Amb10609624 [1,1,0,0,0,0|2,0,0]=4 5748 B11R1.81 CCNc1ccc(C)cc1C Amb4313298 [1,1,0,0,0,0|2,0,0]=4 5749 B11R1.81 CCNc1ccc(C)cc1Cl Amb7759940 [1,1,0,0,0,0|1,1,0]=4 5750 B11R1.81 CCNc1ccc(C)cc1F Amb7760232 [1,1,0,0,0,0|1,1,0]=4 5751 B11R1.81 CCNc1ccc(C)cc1N Amb8860046 [1,1,0,0,0,0|2,0,0]=4 5752 B11R1.81 CCNc1ccc(C)cc1O Amb27439019 [1,1,0,0,0,0|2,0,0]=4 5753 B11R1.81 CCNc1ccc(C)cc1P Amb27165246 [1,1,0,0,0,0|2,0,0]=4 5754 B11R1.81 CCNc1ccc(Cl)cc1Br Amb26860933 [1,1,0,0,0,0|1,0,0]=3 5755 B11R1.81 CCNc1ccc(Cl)cc1C Amb6722567 [1,1,0,0,0,0|2,0,0]=4 5756 B11R1.81 CCNc1ccc(Cl)cc1Cl Amb6689979 [1,1,0,0,0,0|1,1,0]=4 5757 B11R1.81 CCNc1ccc(Cl)cc1F Amb9226388 [1,1,0,0,0,0|1,1,0]=4 5758 B11R1.81 CCNc1ccc(Cl)cc1N Amb2685896 [1,1,0,0,0,0|2,0,0]=4 5759 B11R1.81 CCNc1ccc(F)cc1C Amb6699663 [1,1,0,0,0,0|2,0,0]=4 5760 B11R1.81 CCNc1ccc(F)cc1Cl Amb9203667 [1,1,0,0,0,0|1,1,0]=4 5761 B11R1.81 CCNc1ccc(F)cc1I Amb24663791 [1,1,0,0,0,0|1,1,0]=4 5762 B11R1.81 CCNc1ccc(F)cc1N Amb9205238 [1,1,0,0,0,0|2,0,0]=4 5763 B11R1.81 CCNc1ccc(F)cc1S Amb28291487 [1,1,0,0,0,0|2,0,0]=4 5764 B11R1.81 CCNc1ccc(I)cc1F Amb35589299 [1,1,0,0,0,0|1,1,0]=4 5765 B11R1.81 CCNc1ccc(N)cc1Br Amb18956505 [1,1,0,0,0,0|1,0,0]=3 5766 B11R1.81 CCNc1ccc(N)cc1C Amb8439243 [1,1,0,0,0,0|2,0,0]=4 5767 B11R1.81 CCNc1ccc(N)cc1F Amb9207831 [1,1,0,0,0,0|1,1,0]=4 5768 B11R1.81 CCNc1ccc(O)cc1Cl Amb18556151 [1,1,0,0,0,0|1,1,0]=4 5769 B11R1.81 CCNc1ncc(Br)cc1Br Amb18888817 [1,1,0,0,0,0|2,0,0]=4 5770 B11R1.81 CCNc1ncc(C)cc1Br Amb18225210 [1,1,0,0,0,0|2,0,0]=4 5771 B11R1.81 CCNc1ncc(N)cc1Br Amb17213700 [1,1,0,0,0,0|2,0,0]=4 5772 B11R1.81 CCOc1cc[n+]([O-])cc1Br Amb22522276 [1,1,0,0,0,0|2,0,0]=4 5773 B11R1.81 CCOc1ccc(Br)cc1C Amb18244025 [1,1,0,0,0,0|2,0,0]=4 5774 B11R1.81 CCOc1ccc(Br)cc1Cl Amb18246275 [1,1,0,0,0,0|1,1,0]=4 5775 B11R1.81 CCOc1ccc(Br)cc1F Amb18896519 [1,1,0,0,0,0|1,1,0]=4 5776 B11R1.81 CCOc1ccc(Br)cc1I Amb28397824 [1,1,0,0,0,0|1,1,0]=4 5777 B11R1.81 CCOc1ccc(Br)cc1N Amb6676111 [1,1,0,0,0,0|2,0,0]=4 5778 B11R1.81 CCOc1ccc(Br)cc1O Amb17200384 [1,1,0,0,0,0|2,0,0]=4 5779 B11R1.81 CCOc1ccc(Br)cc1S Amb8943984 [1,1,0,0,0,0|2,0,0]=4 5780 B11R1.81 CCOc1ccc(C)cc1Br Amb6717103 [1,1,0,0,0,0|1,0,0]=3 5781 B11R1.81 CCOc1ccc(C)cc1Cl Amb25380617 [1,1,0,0,0,0|1,1,0]=4 5782 B11R1.81 CCOc1ccc(C)cc1N Amb840314 [1,1,0,0,0,0|2,0,0]=4 5783 B11R1.81 CCOc1ccc(C)cc1O Amb17199766 [1,1,0,0,0,0|2,0,0]=4 5784 B11R1.81 CCOc1ccc(C)cc1S Amb18182685 [1,1,0,0,0,0|2,0,0]=4 5785 B11R1.81 CCOc1ccc(C)nc1Br Amb2612504 [1,1,0,0,0,0|2,0,0]=4 5786 B11R1.81 CCOc1ccc(Cl)cc1Br Amb17252602 [1,1,0,0,0,0|1,0,0]=3 5787 B11R1.81 CCOc1ccc(Cl)cc1C Amb24584271 [1,1,0,0,0,0|2,0,0]=4 5788 B11R1.81 CCOc1ccc(Cl)cc1Cl Amb9787479 [1,1,0,0,0,0|1,1,0]=4 5789 B11R1.81 CCOc1ccc(Cl)cc1F Amb10841503 [1,1,0,0,0,0|1,1,0]=4 5790 B11R1.81 CCOc1ccc(Cl)cc1N Amb21964941 [1,1,0,0,0,0|2,0,0]=4 5791 B11R1.81 CCOc1ccc(Cl)cc1N Amb840192 [1,1,0,0,0,0|2,0,0]=4 5792 B11R1.81 CCOc1ccc(Cl)cc1O Amb17200369 [1,1,0,0,0,0|2,0,0]=4 5793 B11R1.81 CCOc1ccc(Cl)cc1S Amb25152786 [1,1,0,0,0,0|2,0,0]=4 5794 B11R1.81 CCOc1ccc(F)cc1Br Amb6269069 [1,1,0,0,0,0|1,0,0]=3 5795 B11R1.81 CCOc1ccc(F)cc1C Amb27218035 [1,1,0,0,0,0|2,0,0]=4 5796 B11R1.81 CCOc1ccc(F)cc1Cl Amb10841499 [1,1,0,0,0,0|1,1,0]=4 5797 B11R1.81 CCOc1ccc(F)cc1F Amb26356288 [1,1,0,0,0,0|1,1,0]=4 5798 B11R1.81 CCOc1ccc(F)cc1N Amb22279460 [1,1,0,0,0,0|2,0,0]=4 5799 B11R1.81 CCOc1ccc(F)cc1N Amb6679798 [1,1,0,0,0,0|2,0,0]=4 5800 B11R1.81 CCOc1ccc(F)cc1O Amb18057886 [1,1,0,0,0,0|2,0,0]=4 5801 B11R1.81 CCOc1ccc(F)cc1S Amb26947381 [1,1,0,0,0,0|2,0,0]=4 5802 B11R1.81 CCOc1ccc(I)cc1F Amb19888285 [1,1,0,0,0,0|1,1,0]=4 5803 B11R1.81 CCOc1ccc(I)cc1N Amb18555918 [1,1,0,0,0,0|2,0,0]=4 5804 B11R1.81 CCOc1ccc(I)cc1S Amb27954267 [1,1,0,0,0,0|2,0,0]=4 5805 B11R1.81 CCOc1ccc(N)cc1Br Amb33292475 [1,1,0,0,0,0|1,0,0]=3 5806 B11R1.81 CCOc1ccc(N)cc1Br Amb8396791 [1,1,0,0,0,0|1,0,0]=3 5807 B11R1.81 CCOc1ccc(N)cc1C Amb33545939 [1,1,0,0,0,0|2,0,0]=4 5808 B11R1.81 CCOc1ccc(N)cc1Cl Amb1128949 [1,1,0,0,0,0|1,1,0]=4 5809 B11R1.81 CCOc1ccc(N)cc1F Amb7783396 [1,1,0,0,0,0|1,1,0]=4 5810 B11R1.81 CCOc1ccc(N)cc1I Amb24565621 [1,1,0,0,0,0|1,1,0]=4 5811 B11R1.81 CCOc1ccc(N)cc1N Amb8396874 [1,1,0,0,0,0|2,0,0]=4 5812 B11R1.81 CCOc1ccc(N)cc1O Amb27251511 [1,1,0,0,0,0|2,0,0]=4 5813 B11R1.81 CCOc1ccc(N)cc1S Amb27963606 [1,1,0,0,0,0|2,0,0]=4 5814 B11R1.81 CCOc1ccc(O)cc1Br Amb17200595 [1,1,0,0,0,0|1,0,0]=3 5815 B11R1.81 CCOc1ccc(O)cc1C Amb17200783 [1,1,0,0,0,0|2,0,0]=4 5816 B11R1.81 CCOc1ccc(O)cc1Cl Amb17202438 [1,1,0,0,0,0|1,1,0]=4 5817 B11R1.81 CCOc1ccc(O)cc1F Amb18243536 [1,1,0,0,0,0|1,1,0]=4 5818 B11R1.81 CCOc1ccc(O)cc1S Amb24717074 [1,1,0,0,0,0|2,0,0]=4 5819 B11R1.81 CCOc1ccc(S)cc1C Amb23504421 [1,1,0,0,0,0|2,0,0]=4 5820 B11R1.81 CCOc1ccc(S)cc1Cl Amb25152765 [1,1,0,0,0,0|1,1,0]=4 5821 B11R1.81 CCOc1ccc(S)cc1F Amb19893252 [1,1,0,0,0,0|1,1,0]=4 5822 B11R1.81 CCOc1ncc(Br)cc1Br Amb20242585 [1,1,0,0,0,0|2,0,0]=4 5823 B11R1.81 CCOc1ncc(C)cc1Br Amb10068401 [1,1,0,0,0,0|2,0,0]=4 5824 B11R1.81 CCOc1ncc(Cl)cc1Br Amb24394993 [1,1,0,0,0,0|2,0,0]=4 5825 B11R1.81 CCOc1ncc(I)cc1Br Amb22495436 [1,1,0,0,0,0|2,0,0]=4 5826 B11R1.81 CCOc1ncc(N)cc1Br Amb19959133 [1,1,0,0,0,0|2,0,0]=4 5827 B11R1.81 CCOc1ncc(N)cc1Br Amb24057201 [1,1,0,0,0,0|2,0,0]=4 5828 B11R1.81 CCSc1ccc(Br)cc1Br Amb25922807 [1,1,0,0,0,0|1,0,0]=3 5829 B11R1.81 CCSc1ccc(Br)cc1Cl Amb28255844 [1,1,0,0,0,0|1,1,0]=4 5830 B11R1.81 CCSc1ccc(C)cc1Br Amb25768551 [1,1,0,0,0,0|1,0,0]=3 5831 B11R1.81 CCSc1ccc(C)cc1C Amb27595596 [1,1,0,0,0,0|2,0,0]=4 5832 B11R1.81 CCSc1ccc(C)cc1N Amb9003018 [1,1,0,0,0,0|2,0,0]=4 5833 B11R1.81 CCSc1ccc(C)cc1O Amb18055733 [1,1,0,0,0,0|2,0,0]=4 5834 B11R1.81 CCSc1ccc(Cl)cc1Br Amb28204127 [1,1,0,0,0,0|1,0,0]=3 5835 B11R1.81 CCSc1ccc(Cl)cc1Cl Amb25893564 [1,1,0,0,0,0|1,1,0]=4 5836 B11R1.81 CCSc1ccc(Cl)cc1N Amb1069168 [1,1,0,0,0,0|2,0,0]=4 5837 B11R1.81 CCSc1ccc(Cl)cc1N Amb6859386 [1,1,0,0,0,0|2,0,0]=4 5838 B11R1.81 CCSc1ccc(F)cc1Br Amb28366465 [1,1,0,0,0,0|1,0,0]=3 5839 B11R1.81 CCSc1ccc(F)cc1C Amb25727248 [1,1,0,0,0,0|2,0,0]=4 5840 B11R1.81 CCSc1ccc(I)cc1Br Amb25715241 [1,1,0,0,0,0|1,0,0]=3 5841 B11R1.81 CCSc1ccc(N)cc1Br Amb18283611 [1,1,0,0,0,0|1,0,0]=3 5842 B11R1.81 CCSc1ccc(N)cc1Cl Amb6680290 [1,1,0,0,0,0|1,1,0]=4 5843 B11R1.81 CCSc1ccc(N)cc1I Amb27390434 [1,1,0,0,0,0|1,1,0]=4 5844 B11R1.81 CCSc1ncc(Br)cc1Br Amb28314286 [1,1,0,0,0,0|2,0,0]=4 5845 B11R1.81 CCSc1ncc(C)cc1Br Amb25083767 [1,1,0,0,0,0|2,0,0]=4 5846 B11R1.81 CNCC1=CNC(=S)C=C1C Amb23446904 [1,1,0,0,0,0|2,0,0]=4 5847 B11R1.81 CNCc1ccc(Br)cc1Br Amb27752416 [1,1,0,0,0,0|0,0,0]=2 5848 B11R1.81 CNCc1ccc(Br)cc1C Amb33532292 [1,1,0,0,0,0|1,0,0]=3 5849 B11R1.81 CNCc1ccc(Br)cc1Cl Amb9671951 [1,1,0,0,0,0|0,1,0]=3 5850 B11R1.81 CNCc1ccc(Br)cc1F Amb8841276 [1,1,0,0,0,0|0,1,0]=3 5851 B11R1.81 CNCc1ccc(Br)cc1N Amb27188747 [1,1,0,0,0,0|1,0,0]=3 5852 B11R1.81 CNCc1ccc(Br)cc1O Amb33478315 [1,1,0,0,0,0|1,0,0]=3 5853 B11R1.81 CNCc1ccc(C)cc1Br Amb26020671 [1,1,0,0,0,0|0,0,0]=2 5854 B11R1.81 CNCc1ccc(C)cc1C Amb33334647 [1,1,0,0,0,0|1,0,0]=3 5855 B11R1.81 CNCc1ccc(C)cc1C Amb433085 [1,1,0,0,0,0|1,0,0]=3 5856 B11R1.81 CNCc1ccc(C)cc1Cl Amb24509646 [1,1,0,0,0,0|0,1,0]=3 5857 B11R1.81 CNCc1ccc(C)cc1F Amb18951057 [1,1,0,0,0,0|0,1,0]=3 5858 B11R1.81 CNCc1ccc(C)cc1O Amb25774491 [1,1,0,0,0,0|1,0,0]=3 5859 B11R1.81 CNCc1ccc(C)nc1Cl Amb33259875 [1,1,0,0,0,0|1,1,0]=4 5860 B11R1.81 CNCc1ccc(C)nc1N Amb35642082 [1,1,0,0,0,0|2,0,0]=4 5861 B11R1.81 CNCc1ccc(Cl)cc1Br Amb27256896 [1,1,0,0,0,0|0,0,0]=2 5862 B11R1.81 CNCc1ccc(Cl)cc1C Amb18224412 [1,1,0,0,0,0|1,0,0]=3 5863 B11R1.81 CNCc1ccc(Cl)cc1Cl Amb10067930 [1,1,0,0,0,0|0,1,0]=3 5864 B11R1.81 CNCc1ccc(Cl)cc1Cl Amb1648686 [1,1,0,0,0,0|0,1,0]=3 5865 B11R1.81 CNCc1ccc(Cl)cc1F Amb8853662 [1,1,0,0,0,0|0,1,0]=3 5866 B11R1.81 CNCc1ccc(Cl)cc1O Amb17779383 [1,1,0,0,0,0|1,0,0]=3 5867 B11R1.81 CNCc1ccc(Cl)cc1O Amb25217547 [1,1,0,0,0,0|1,0,0]=3 5868 B11R1.81 CNCc1ccc(Cl)nc1C Amb23446970 [1,1,0,0,0,0|2,0,0]=4 5869 B11R1.81 CNCc1ccc(Cl)nc1Cl Amb26511447 [1,1,0,0,0,0|1,1,0]=4 5870 B11R1.81 CNCc1ccc(F)cc1Br Amb24271152 [1,1,0,0,0,0|0,0,0]=2 5871 B11R1.81 CNCc1ccc(F)cc1C Amb18288035 [1,1,0,0,0,0|1,0,0]=3 5872 B11R1.81 CNCc1ccc(F)cc1Cl Amb6249585 [1,1,0,0,0,0|0,1,0]=3 5873 B11R1.81 CNCc1ccc(F)cc1F Amb1116828 [1,1,0,0,0,0|0,1,0]=3 5874 B11R1.81 CNCc1ccc(F)nc1F Amb19929951 [1,1,0,0,0,0|1,1,0]=4 5875 B11R1.81 CNCc1ccc(N)cc1O Amb27233615 [1,1,0,0,0,0|1,0,0]=3 5876 B11R1.81 CNCc1ccc(N)nc1Cl Amb27494771 [1,1,0,0,0,0|1,1,0]=4 5877 B11R1.81 CNCc1ccc(O)cc1Cl Amb26373368 [1,1,0,0,0,0|0,1,0]=3 5878 B11R1.81 CNCc1ccc(O)cc1F Amb25953685 [1,1,0,0,0,0|0,1,0]=3 5879 B11R1.81 CNCc1ccc(O)cc1O Amb1115772 [1,1,0,0,0,0|1,0,0]=3 5880 B11R1.81 CNCc1ccc(O)nc1C Amb23446084 [1,1,0,0,0,0|2,0,0]=4 5881 B11R1.81 CNCc1cnc(Cl)cc1C Amb23446952 [1,1,0,0,0,0|2,0,0]=4 5882 B11R1.81 CNCc1cnc(Cl)cc1Cl Amb25129066 [1,1,0,0,0,0|1,1,0]=4 5883 B11R1.81 CNCc1cnc(N)cc1C Amb23579366 [1,1,0,0,0,0|2,0,0]=4 5884 B11R1.81 CNCc1ncc(Br)cc1Br Amb27958463 [1,1,0,0,0,0|1,0,0]=3 5885 B11R1.81 CNCc1ncc(Cl)cc1Cl Amb26573669 [1,1,0,0,0,0|1,1,0]=4 5886 B11R1.81 CNCc1ncc(Cl)cc1Cl Amb33483597 [1,1,0,0,0,0|1,1,0]=4 5887 B11R1.81 CNCc1ncc(F)cc1F Amb25323110 [1,1,0,0,0,0|1,1,0]=4 5888 B11R1.81 COCc1ccc(Br)cc1Br Amb26558505 [1,1,0,0,0,0|1,0,0]=3 5889 B11R1.81 COCc1ccc(Br)cc1C Amb27653537 [1,1,0,0,0,0|2,0,0]=4 5890 B11R1.81 COCc1ccc(Br)cc1F Amb19374695 [1,1,0,0,0,0|1,1,0]=4 5891 B11R1.81 COCc1ccc(Br)cc1I Amb26597457 [1,1,0,0,0,0|1,1,0]=4 5892 B11R1.81 COCc1ccc(Br)cc1N Amb28430310 [1,1,0,0,0,0|2,0,0]=4 5893 B11R1.81 COCc1ccc(Br)cc1O Amb26654757 [1,1,0,0,0,0|2,0,0]=4 5894 B11R1.81 COCc1ccc(C)cc1C Amb25891744 [1,1,0,0,0,0|2,0,0]=4 5895 B11R1.81 COCc1ccc(C)cc1I Amb27868777 [1,1,0,0,0,0|1,1,0]=4 5896 B11R1.81 COCc1ccc(C)cc1N Amb26318744 [1,1,0,0,0,0|2,0,0]=4 5897 B11R1.81 COCc1ccc(C)cc1O Amb26513206 [1,1,0,0,0,0|2,0,0]=4 5898 B11R1.81 COCc1ccc(C)nc1Br Amb27209718 [1,1,0,0,0,0|2,0,0]=4 5899 B11R1.81 COCc1ccc(Cl)cc1Br Amb25084994 [1,1,0,0,0,0|1,0,0]=3 5900 B11R1.81 COCc1ccc(Cl)cc1C Amb25089191 [1,1,0,0,0,0|2,0,0]=4 5901 B11R1.81 COCc1ccc(Cl)cc1I Amb27464623 [1,1,0,0,0,0|1,1,0]=4 5902 B11R1.81 COCc1ccc(Cl)cc1N Amb18958848 [1,1,0,0,0,0|2,0,0]=4 5903 B11R1.81 COCc1ccc(Cl)cc1O Amb27435915 [1,1,0,0,0,0|2,0,0]=4 5904 B11R1.81 COCc1ccc(F)cc1Br Amb22900188 [1,1,0,0,0,0|1,0,0]=3 5905 B11R1.81 COCc1ccc(F)cc1I Amb25986460 [1,1,0,0,0,0|1,1,0]=4 5906 B11R1.81 COCc1ccc(F)cc1N Amb25247613 [1,1,0,0,0,0|2,0,0]=4 5907 B11R1.81 COCc1ccc(F)cc1O Amb25891648 [1,1,0,0,0,0|2,0,0]=4 5908 B11R1.81 COCc1ccc(I)cc1Br Amb28066204 [1,1,0,0,0,0|1,0,0]=3 5909 B11R1.81 COCc1ccc(I)cc1C Amb26864587 [1,1,0,0,0,0|2,0,0]=4 5910 B11R1.81 COCc1ccc(I)cc1F Amb28120129 [1,1,0,0,0,0|1,1,0]=4 5911 B11R1.81 COCc1ccc(I)cc1N Amb25733056 [1,1,0,0,0,0|2,0,0]=4 5912 B11R1.81 COCc1ccc(I)cc1O Amb25084992 [1,1,0,0,0,0|2,0,0]=4 5913 B11R1.81 COCc1ccc(N)cc1Br Amb18949684 [1,1,0,0,0,0|1,0,0]=3 5914 B11R1.81 COCc1ccc(N)cc1C Amb26513134 [1,1,0,0,0,0|2,0,0]=4 5915 B11R1.81 COCc1ccc(N)cc1Cl Amb18284171 [1,1,0,0,0,0|1,1,0]=4 5916 B11R1.81 COCc1ccc(N)cc1F Amb22756889 [1,1,0,0,0,0|1,1,0]=4 5917 B11R1.81 COCc1ccc(N)cc1I Amb24640932 [1,1,0,0,0,0|1,1,0]=4 5918 B11R1.81 COCc1ccc(N)cc1O Amb25089192 [1,1,0,0,0,0|2,0,0]=4 5919 B11R1.81 COCc1ccc(O)cc1C Amb28285035 [1,1,0,0,0,0|2,0,0]=4 5920 B11R1.81 COCc1ccc(O)cc1F Amb25315449 [1,1,0,0,0,0|1,1,0]=4 5921 B11R1.81 COCc1ccc(O)cc1I Amb25934976 [1,1,0,0,0,0|1,1,0]=4 5922 B11R1.81 COCc1ccc(O)cc1N Amb24402652 [1,1,0,0,0,0|2,0,0]=4 5923 B11R1.81 COCc1ccc(O)cc1O Amb25891622 [1,1,0,0,0,0|2,0,0]=4 5924 B11R1.81 COCc1cnc(N)cc1Br Amb28368622 [1,1,0,0,0,0|2,0,0]=4 5925 B11R1.81 COCc1ncc(N)cc1Br Amb27795213 [1,1,0,0,0,0|2,0,0]=4 5926 B11R1.81 CSCc1ccc(Br)cc1F Amb25108882 [1,1,0,0,0,0|1,1,0]=4 5927 B11R1.81 CSCc1ccc(Br)cc1N Amb27632881 [1,1,0,0,0,0|2,0,0]=4 5928 B11R1.81 CSCc1ccc(F)cc1Br Amb27878444 [1,1,0,0,0,0|1,0,0]=3 5929 B11R1.81 CSCc1ccc(F)cc1C Amb27261223 [1,1,0,0,0,0|2,0,0]=4 5930 B11R1.81 CSCc1ccc(F)cc1Cl Amb27436830 [1,1,0,0,0,0|1,1,0]=4 5931 B11R1.81 CSCc1ccc(F)cc1F Amb25692349 [1,1,0,0,0,0|1,1,0]=4 5932 B11R1.81 CSCc1ccc(I)cc1C Amb28385044 [1,1,0,0,0,0|2,0,0]=4 5933 B11R1.81 CSCc1ccc(N)cc1Cl Amb18284172 [1,1,0,0,0,0|1,1,0]=4 5934 B11R1.81 CSCc1ccc(N)cc1F Amb28383332 [1,1,0,0,0,0|1,1,0]=4 5935 B11R1.81 CSSc1ccc(N)cc1Br Amb27948117 [1,1,0,0,0,0|2,0,0]=4 5936 B11R1.81 Cc1cc(Br)ccc1CCBr Amb24565565 [1,1,0,0,0,0|2,0,0]=4 5937 B11R1.81 Cc1cc(Br)ccc1CCCl Amb28146524 [1,1,0,0,0,0|2,0,0]=4 5938 B11R1.81 Cc1cc(Br)ccc1CCN Amb17471495 [1,1,0,0,0,0|1,0,0]=3 5939 B11R1.81 Cc1cc(Br)ccc1CCO Amb27763641 [1,1,0,0,0,0|2,0,0]=4 5940 B11R1.81 Cc1cc(Br)ccc1CCS Amb33435449 [1,1,0,0,0,0|2,0,0]=4 5941 B11R1.81 Cc1cc(Br)ccc1CNN Amb9494361 [1,1,0,0,0,0|2,0,0]=4 5942 B11R1.81 Cc1cc(Br)ccc1CNO Amb24595158 [1,1,0,0,0,0|2,0,0]=4 5943 B11R1.81 Cc1cc(Br)ccc1CON Amb27414188 [1,1,0,0,0,0|2,0,0]=4 5944 B11R1.81 Cc1cc(Br)cnc1CCN Amb27402738 [1,1,0,0,0,0|2,0,0]=4 5945 B11R1.81 Cc1cc(Cl)ccc1CCBr Amb27751057 [1,1,0,0,0,0|2,0,0]=4 5946 B11R1.81 Cc1cc(Cl)ccc1CCCl Amb28182605 [1,1,0,0,0,0|2,0,0]=4 5947 B11R1.81 Cc1cc(Cl)ccc1CCN Amb17470479 [1,1,0,0,0,0|1,0,0]=3 5948 B11R1.81 Cc1cc(Cl)ccc1CCO Amb19928756 [1,1,0,0,0,0|2,0,0]=4 5949 B11R1.81 Cc1cc(Cl)ccc1CCS Amb25076776 [1,1,0,0,0,0|2,0,0]=4 5950 B11R1.81 Cc1cc(Cl)ccc1CNN Amb24386115 [1,1,0,0,0,0|2,0,0]=4 5951 B11R1.81 Cc1cc(Cl)ccc1CNO Amb27463008 [1,1,0,0,0,0|2,0,0]=4 5952 B11R1.81 Cc1cc(Cl)ccc1CON Amb24436632 [1,1,0,0,0,0|2,0,0]=4 5953 B11R1.81 Cc1cc(F)ccc1CCBr Amb27664198 [1,1,0,0,0,0|2,0,0]=4 5954 B11R1.81 Cc1cc(F)ccc1CCN Amb18959073 [1,1,0,0,0,0|1,0,0]=3 5955 B11R1.81 Cc1cc(F)ccc1CCO Amb18791565 [1,1,0,0,0,0|2,0,0]=4 5956 B11R1.81 Cc1cc(F)ccc1CCS Amb25113845 [1,1,0,0,0,0|2,0,0]=4 5957 B11R1.81 Cc1cc(F)ccc1CNN Amb18791567 [1,1,0,0,0,0|2,0,0]=4 5958 B11R1.81 Cc1cc(F)ccc1CNO Amb24447685 [1,1,0,0,0,0|2,0,0]=4 5959 B11R1.81 Cc1cc(F)ccc1CON Amb27436189 [1,1,0,0,0,0|2,0,0]=4 5960 B11R1.81 Cc1cc(O)ccc1CCN Amb18054132 [1,1,0,0,0,0|1,0,0]=3 5961 B11R1.81 Cc1ccc(CC#N)c(Br)c1 Amb25890779 [1,1,0,0,0,0|0,0,2]=4 5962 B11R1.81 Cc1ccc(CC=O)c(Br)c1 Amb25144656 [1,1,0,0,0,0|1,0,1]=4 5963 B11R1.81 Cc1ccc(CCBr)c(Br)c1 Amb25215507 [1,1,0,0,0,0|1,0,0]=3 5964 B11R1.81 Cc1ccc(CCBr)c(C)c1 Amb26479840 [1,1,0,0,0,0|2,0,0]=4 5965 B11R1.81 Cc1ccc(CCBr)c(Cl)c1 Amb30012823 [1,1,0,0,0,0|1,1,0]=4 5966 B11R1.81 Cc1ccc(CCBr)c(F)c1 Amb33435751 [1,1,0,0,0,0|1,1,0]=4 5967 B11R1.81 Cc1ccc(CCBr)c(O)c1 Amb33336464 [1,1,0,0,0,0|2,0,0]=4 5968 B11R1.81 Cc1ccc(CCCl)c(Br)c1 Amb27176939 [1,1,0,0,0,0|1,0,0]=3 5969 B11R1.81 Cc1ccc(CCCl)c(Cl)c1 Amb28206667 [1,1,0,0,0,0|1,1,0]=4 5970 B11R1.81 Cc1ccc(CCN)c(Br)c1 Amb17471494 [1,1,0,0,0,0|0,0,0]=2 5971 B11R1.81 Cc1ccc(CCN)c(C)c1 Amb2687562 [1,1,0,0,0,0|1,0,0]=3 5972 B11R1.81 Cc1ccc(CCN)c(C)n1 Amb18201863 [1,1,0,0,0,0|2,0,0]=4 5973 B11R1.81 Cc1ccc(CCN)c(Cl)c1 Amb28184514 [1,1,0,0,0,0|0,1,0]=3 5974 B11R1.81 Cc1ccc(CCN)c(Cl)n1 Amb33259723 [1,1,0,0,0,0|1,1,0]=4 5975 B11R1.81 Cc1ccc(CCN)c(F)c1 Amb24070128 [1,1,0,0,0,0|0,1,0]=3 5976 B11R1.81 Cc1ccc(CCN)c(F)n1 Amb25084524 [1,1,0,0,0,0|1,1,0]=4 5977 B11R1.81 Cc1ccc(CCN)c(O)c1 Amb25872693 [1,1,0,0,0,0|1,0,0]=3 5978 B11R1.81 Cc1ccc(CCN)c(O)n1 Amb8011397 [1,1,0,0,0,0|2,0,0]=4 5979 B11R1.81 Cc1ccc(CCO)c(Br)c1 Amb25788229 [1,1,0,0,0,0|1,0,0]=3 5980 B11R1.81 Cc1ccc(CCO)c(C)c1 Amb17232073 [1,1,0,0,0,0|2,0,0]=4 5981 B11R1.81 Cc1ccc(CCO)c(Cl)c1 Amb25148333 [1,1,0,0,0,0|1,1,0]=4 5982 B11R1.81 Cc1ccc(CCO)c(F)c1 Amb25113714 [1,1,0,0,0,0|1,1,0]=4 5983 B11R1.81 Cc1ccc(CCO)c(I)c1 Amb22753533 [1,1,0,0,0,0|1,1,0]=4 5984 B11R1.81 Cc1ccc(CCS)c(Br)c1 Amb33387486 [1,1,0,0,0,0|1,0,0]=3 5985 B11R1.81 Cc1ccc(CCS)c(C)c1 Amb17400223 [1,1,0,0,0,0|2,0,0]=4 5986 B11R1.81 Cc1ccc(CCS)c(Cl)c1 Amb33221377 [1,1,0,0,0,0|1,1,0]=4 5987 B11R1.81 Cc1ccc(CCS)c(F)c1 Amb33322867 [1,1,0,0,0,0|1,1,0]=4 5988 B11R1.81 Cc1ccc(CCS)c(O)c1 Amb33425275 [1,1,0,0,0,0|2,0,0]=4 5989 B11R1.81 Cc1ccc(CNN)c(Br)c1 Amb25764058 [1,1,0,0,0,0|1,0,0]=3 5990 B11R1.81 Cc1ccc(CNN)c(C)c1 Amb6243244 [1,1,0,0,0,0|2,0,0]=4 5991 B11R1.81 Cc1ccc(CNN)c(Cl)c1 Amb24621014 [1,1,0,0,0,0|1,1,0]=4 5992 B11R1.81 Cc1ccc(CNN)c(F)c1 Amb33324350 [1,1,0,0,0,0|1,1,0]=4 5993 B11R1.81 Cc1ccc(CNN)c(O)c1 Amb33426049 [1,1,0,0,0,0|2,0,0]=4 5994 B11R1.81 Cc1ccc(CNO)c(Br)c1 Amb25782558 [1,1,0,0,0,0|1,0,0]=3 5995 B11R1.81 Cc1ccc(CNO)c(C)c1 Amb25983015 [1,1,0,0,0,0|2,0,0]=4 5996 B11R1.81 Cc1ccc(CNO)c(Cl)c1 Amb33223942 [1,1,0,0,0,0|1,1,0]=4 5997 B11R1.81 Cc1ccc(CNO)c(F)c1 Amb33324399 [1,1,0,0,0,0|1,1,0]=4 5998 B11R1.81 Cc1ccc(CNO)c(O)c1 Amb33426694 [1,1,0,0,0,0|2,0,0]=4 5999 B11R1.81 Cc1ccc(CON)c(Br)c1 Amb27867789 [1,1,0,0,0,0|1,0,0]=3 6000 B11R1.81 Cc1ccc(CON)c(C)c1 Amb17091431 [1,1,0,0,0,0|2,0,0]=4 6001 B11R1.81 Cc1ccc(CON)c(Cl)c1 Amb25129063 [1,1,0,0,0,0|1,1,0]=4 6002 B11R1.81 Cc1ccc(CON)c(F)c1 Amb28118611 [1,1,0,0,0,0|1,1,0]=4 6003 B11R1.81 Cc1ccc(CON)c(I)c1 Amb27240802 [1,1,0,0,0,0|1,1,0]=4 6004 B11R1.81 Cc1ccc(CON)c(O)c1 Amb33426048 [1,1,0,0,0,0|2,0,0]=4 6005 B11R1.81 Cc1ccc(OCCl)c(Br)c1 Amb28288310 [1,1,0,0,0,0|2,0,0]=4 6006 B11R1.81 Cc1cnc(CCN)c(C)c1 Amb25060057 [1,1,0,0,0,0|2,0,0]=4 6007 B11R1.81 Cc1cnc(CCN)c(Cl)c1 Amb28187407 [1,1,0,0,0,0|1,1,0]=4 6008 B11R1.81 Cc1cnc(CCN)c(F)c1 Amb27254610 [1,1,0,0,0,0|1,1,0]=4 6009 B11R1.81 Cc1nc(F)ccc1CCN Amb25327536 [1,1,0,0,0,0|2,0,0]=4 6010 B11R1.81 ClCCc1ccc(Cl)cc1Cl Amb18049972 [1,1,0,0,0,0|1,1,0]=4 6011 B11R1.81 ClCOc1ccc(Br)cc1Br Amb27830483 [1,1,0,0,0,0|2,0,0]=4 6012 B11R1.81 ClCOc1ccc(Cl)cc1Br Amb27427254 [1,1,0,0,0,0|2,0,0]=4 6013 B11R1.81 Clc1cc(Br)ccc1CCBr Amb27401659 [1,1,0,0,0,0|1,1,0]=4 6014 B11R1.81 Clc1cc(Br)ccc1CCI Amb22054543 [1,1,0,0,0,0|1,1,0]=4 6015 B11R1.81 Clc1ccc(CCBr)c(Br)c1 Amb22235096 [1,1,0,0,0,0|1,0,0]=3 6016 B11R1.81 Clc1ccc(CCBr)c(Cl)c1 Amb18548872 [1,1,0,0,0,0|1,1,0]=4 6017 B11R1.81 Fc1cc(Br)ccc1CCBr Amb25185177 [1,1,0,0,0,0|1,1,0]=4 6018 B11R1.81 Fc1cc(Br)ccc1CCCl Amb27450287 [1,1,0,0,0,0|1,1,0]=4 6019 B11R1.81 Fc1cc(Br)ccc1CCI Amb28315042 [1,1,0,0,0,0|1,1,0]=4 6020 B11R1.81 Fc1cc(Br)ccc1CCS Amb33430571 [1,1,0,0,0,0|1,1,0]=4 6021 B11R1.81 Fc1cc(Cl)ccc1CCBr Amb27259435 [1,1,0,0,0,0|1,1,0]=4 6022 B11R1.81 Fc1cc(Cl)ccc1CCS Amb33406952 [1,1,0,0,0,0|1,1,0]=4 6023 B11R1.81 Fc1ccc(CCBr)c(Br)c1 Amb25148050 [1,1,0,0,0,0|1,0,0]=3 6024 B11R1.81 Fc1ccc(CCBr)c(Cl)c1 Amb24063950 [1,1,0,0,0,0|1,1,0]=4 6025 B11R1.81 Fc1ccc(CCBr)c(F)c1 Amb27638636 [1,1,0,0,0,0|1,1,0]=4 6026 B11R1.81 Fc1ccc(CCCl)c(Br)c1 Amb27188792 [1,1,0,0,0,0|1,0,0]=3 6027 B11R1.81 Fc1ccc(CCCl)c(Cl)c1 Amb24460313 [1,1,0,0,0,0|1,1,0]=4 6028 B11R1.81 Fc1ccc(CCCl)c(F)c1 Amb18180625 [1,1,0,0,0,0|1,1,0]=4 6029 B11R1.81 Fc1ccc(CCS)c(Br)c1 Amb33451033 [1,1,0,0,0,0|1,0,0]=3 6030 B11R1.81 Fc1ccc(CCS)c(Cl)c1 Amb33053156 [1,1,0,0,0,0|1,1,0]=4 6031 B11R1.81 Fc1ccc(CCS)c(F)c1 Amb18564016 [1,1,0,0,0,0|1,1,0]=4 6032 B11R1.81 Fc1ccc(OCCl)c(Br)c1 Amb27600269 [1,1,0,0,0,0|2,0,0]=4 6033 B11R1.81 N#CCc1ccc(Br)cc1Br Amb22232849 [1,1,0,0,0,0|0,0,2]=4 6034 B11R1.81 N#CCc1ccc(Cl)cc1Br Amb22737588 [1,1,0,0,0,0|0,0,2]=4 6035 B11R1.81 N#CCc1ccc(F)cc1Br Amb6245937 [1,1,0,0,0,0|0,0,2]=4 6036 B11R1.81 N#CCc1ccc(I)cc1Br Amb27945295 [1,1,0,0,0,0|0,0,2]=4 6037 B11R1.81 N#CCc1ccc(N)cc1Br Amb26057142 [1,1,0,0,0,0|0,0,2]=4 6038 B11R1.81 NCCc1ccc(Br)cc1Br Amb23412116 [1,1,0,0,0,0|0,0,0]=2 6039 B11R1.81 NCCc1ccc(Br)cc1Cl Amb25866908 [1,1,0,0,0,0|0,1,0]=3 6040 B11R1.81 NCCc1ccc(Br)cc1F Amb30874083 [1,1,0,0,0,0|0,1,0]=3 6041 B11R1.81 NCCc1ccc(Br)cc1F Amb9025218 [1,1,0,0,0,0|0,1,0]=3 6042 B11R1.81 NCCc1ccc(Br)cc1O Amb23399924 [1,1,0,0,0,0|1,0,0]=3 6043 B11R1.81 NCCc1ccc(Cl)cc1Br Amb28182491 [1,1,0,0,0,0|0,0,0]=2 6044 B11R1.81 NCCc1ccc(Cl)cc1Br Amb30584774 [1,1,0,0,0,0|0,0,0]=2 6045 B11R1.81 NCCc1ccc(Cl)cc1Cl Amb1232852 [1,1,0,0,0,0|0,1,0]=3 6046 B11R1.81 NCCc1ccc(Cl)cc1Cl Amb22224889 [1,1,0,0,0,0|0,1,0]=3 6047 B11R1.81 NCCc1ccc(Cl)cc1F Amb23315393 [1,1,0,0,0,0|0,1,0]=3 6048 B11R1.81 NCCc1ccc(Cl)cc1N Amb28119215 [1,1,0,0,0,0|1,0,0]=3 6049 B11R1.81 NCCc1ccc(Cl)cc1O Amb25209511 [1,1,0,0,0,0|1,0,0]=3 6050 B11R1.81 NCCc1ccc(Cl)nc1Cl Amb25680170 [1,1,0,0,0,0|1,1,0]=4 6051 B11R1.81 NCCc1ccc(F)cc1Br Amb10067806 [1,1,0,0,0,0|0,0,0]=2 6052 B11R1.81 NCCc1ccc(F)cc1Cl Amb18962493 [1,1,0,0,0,0|0,1,0]=3 6053 B11R1.81 NCCc1ccc(F)cc1Cl Amb19353488 [1,1,0,0,0,0|0,1,0]=3 6054 B11R1.81 NCCc1ccc(F)cc1F Amb6242636 [1,1,0,0,0,0|0,1,0]=3 6055 B11R1.81 NCCc1ccc(F)cc1I Amb27879631 [1,1,0,0,0,0|0,1,0]=3 6056 B11R1.81 NCCc1ccc(O)cc1Cl Amb18553695 [1,1,0,0,0,0|0,1,0]=3 6057 B11R1.81 NCCc1ccc(O)cc1F Amb18644718 [1,1,0,0,0,0|0,1,0]=3 6058 B11R1.81 NCCc1ccc(O)cc1F Amb32675323 [1,1,0,0,0,0|0,1,0]=3 6059 B11R1.81 NCCc1ccc(O)cc1O Amb17742991 [1,1,0,0,0,0|1,0,0]=3 6060 B11R1.81 NCCc1ccc(O)cc1O Amb6251485 [1,1,0,0,0,0|1,0,0]=3 6061 B11R1.81 NCCc1cnc(Cl)cc1Cl Amb33256823 [1,1,0,0,0,0|1,1,0]=4 6062 B11R1.81 NCCc1ncc(Br)cc1Br Amb26006019 [1,1,0,0,0,0|1,0,0]=3 6063 B11R1.81 NCCc1ncc(Br)cc1Cl Amb23557162 [1,1,0,0,0,0|1,1,0]=4 6064 B11R1.81 NCCc1ncc(Br)cc1F Amb25890541 [1,1,0,0,0,0|1,1,0]=4 6065 B11R1.81 NCCc1ncc(Br)cc1O Amb25265878 [1,1,0,0,0,0|2,0,0]=4 6066 B11R1.81 NCCc1ncc(Cl)cc1Cl Amb22754454 [1,1,0,0,0,0|1,1,0]=4 6067 B11R1.81 NCCc1ncc(Cl)cc1F Amb26993036 [1,1,0,0,0,0|1,1,0]=4 6068 B11R1.81 NCCc1ncc(F)cc1Cl Amb24454630 [1,1,0,0,0,0|1,1,0]=4 6069 B11R1.81 NCCc1ncc(F)cc1F Amb25339363 [1,1,0,0,0,0|1,1,0]=4 6070 B11R1.81 NCCc1ncc(F)cc1F Amb31156648 [1,1,0,0,0,0|1,1,0]=4 6071 B11R1.81 NNCc1ccc(Br)cc1Br Amb25787526 [1,1,0,0,0,0|1,0,0]=3 6072 B11R1.81 NNCc1ccc(Br)cc1Cl Amb9671946 [1,1,0,0,0,0|1,1,0]=4 6073 B11R1.81 NNCc1ccc(Br)cc1F Amb33624804 [1,1,0,0,0,0|1,1,0]=4 6074 B11R1.81 NNCc1ccc(Br)cc1F Amb9297267 [1,1,0,0,0,0|1,1,0]=4 6075 B11R1.81 NNCc1ccc(Br)cc1O Amb33389137 [1,1,0,0,0,0|2,0,0]=4 6076 B11R1.81 NNCc1ccc(Cl)cc1Br Amb26371330 [1,1,0,0,0,0|1,0,0]=3 6077 B11R1.81 NNCc1ccc(Cl)cc1Cl Amb1120951 [1,1,0,0,0,0|1,1,0]=4 6078 B11R1.81 NNCc1ccc(Cl)cc1Cl Amb6892889 [1,1,0,0,0,0|1,1,0]=4 6079 B11R1.81 NNCc1ccc(Cl)cc1F Amb28367605 [1,1,0,0,0,0|1,1,0]=4 6080 B11R1.81 NNCc1ccc(Cl)cc1O Amb33261907 [1,1,0,0,0,0|2,0,0]=4 6081 B11R1.81 NNCc1ccc(F)cc1Br Amb1113568 [1,1,0,0,0,0|1,0,0]=3 6082 B11R1.81 NNCc1ccc(F)cc1Br Amb33625235 [1,1,0,0,0,0|1,0,0]=3 6083 B11R1.81 NNCc1ccc(F)cc1Cl Amb1116015 [1,1,0,0,0,0|1,1,0]=4 6084 B11R1.81 NNCc1ccc(F)cc1Cl Amb30869706 [1,1,0,0,0,0|1,1,0]=4 6085 B11R1.81 NNCc1ccc(F)cc1F Amb33624790 [1,1,0,0,0,0|1,1,0]=4 6086 B11R1.81 NNCc1ccc(F)cc1F Amb6243524 [1,1,0,0,0,0|1,1,0]=4 6087 B11R1.81 NNCc1ccc(O)cc1Cl Amb33056565 [1,1,0,0,0,0|1,1,0]=4 6088 B11R1.81 NNCc1ccc(O)cc1F Amb33377248 [1,1,0,0,0,0|1,1,0]=4 6089 B11R1.81 NNCc1ccc(O)cc1O Amb27466688 [1,1,0,0,0,0|2,0,0]=4 6090 B11R1.81 NNCc1ncc(Br)cc1Br Amb25349240 [1,1,0,0,0,0|2,0,0]=4 6091 B11R1.81 NOCc1ccc(Br)cc1Br Amb33435370 [1,1,0,0,0,0|1,0,0]=3 6092 B11R1.81 NOCc1ccc(Br)cc1Cl Amb25676308 [1,1,0,0,0,0|1,1,0]=4 6093 B11R1.81 NOCc1ccc(Br)cc1F Amb27404140 [1,1,0,0,0,0|1,1,0]=4 6094 B11R1.81 NOCc1ccc(Br)cc1O Amb33478389 [1,1,0,0,0,0|2,0,0]=4 6095 B11R1.81 NOCc1ccc(Cl)cc1Br Amb27851149 [1,1,0,0,0,0|1,0,0]=3 6096 B11R1.81 NOCc1ccc(Cl)cc1Cl Amb17091443 [1,1,0,0,0,0|1,1,0]=4 6097 B11R1.81 NOCc1ccc(Cl)cc1Cl Amb21929140 [1,1,0,0,0,0|1,1,0]=4 6098 B11R1.81 NOCc1ccc(Cl)cc1F Amb17091438 [1,1,0,0,0,0|1,1,0]=4 6099 B11R1.81 NOCc1ccc(Cl)cc1O Amb33260485 [1,1,0,0,0,0|2,0,0]=4 6100 B11R1.81 NOCc1ccc(F)cc1Br Amb24340345 [1,1,0,0,0,0|1,0,0]=3 6101 B11R1.81 NOCc1ccc(F)cc1Cl Amb19894375 [1,1,0,0,0,0|1,1,0]=4 6102 B11R1.81 NOCc1ccc(F)cc1Cl Amb28062483 [1,1,0,0,0,0|1,1,0]=4 6103 B11R1.81 NOCc1ccc(F)cc1F Amb24740331 [1,1,0,0,0,0|1,1,0]=4 6104 B11R1.81 NOCc1ccc(F)cc1I Amb27850008 [1,1,0,0,0,0|1,1,0]=4 6105 B11R1.81 NOCc1ccc(O)cc1Cl Amb33056567 [1,1,0,0,0,0|1,1,0]=4 6106 B11R1.81 NOCc1ccc(O)cc1F Amb33377247 [1,1,0,0,0,0|1,1,0]=4 6107 B11R1.81 NOCc1ccc(O)cc1O Amb33270121 [1,1,0,0,0,0|2,0,0]=4 6108 B11R1.81 NOCc1ncc(Br)cc1Br Amb33433331 [1,1,0,0,0,0|2,0,0]=4 6109 B11R1.81 N\N=C\c1ccc(F)cc1Br Amb27207244 [1,1,0,0,0,0|1,0,1]=4 6110 B11R1.81 O=CCc1ccc(Br)cc1Br Amb33435369 [1,1,0,0,0,0|1,0,1]=4 6111 B11R1.81 O=CCc1ccc(Cl)cc1Br Amb26011014 [1,1,0,0,0,0|1,0,1]=4 6112 B11R1.81 O=CCc1ccc(F)cc1Br Amb25145784 [1,1,0,0,0,0|1,0,1]=4 6113 B11R1.81 OCCc1ccc(Br)cc1Br Amb23412115 [1,1,0,0,0,0|1,0,0]=3 6114 B11R1.81 OCCc1ccc(Br)cc1Cl Amb22054544 [1,1,0,0,0,0|1,1,0]=4 6115 B11R1.81 OCCc1ccc(Br)cc1F Amb25909581 [1,1,0,0,0,0|1,1,0]=4 6116 B11R1.81 OCCc1ccc(Br)cc1O Amb33388830 [1,1,0,0,0,0|2,0,0]=4 6117 B11R1.81 OCCc1ccc(Br)nc1Br Amb27215555 [1,1,0,0,0,0|2,0,0]=4 6118 B11R1.81 OCCc1ccc(Cl)cc1Br Amb27261943 [1,1,0,0,0,0|1,0,0]=3 6119 B11R1.81 OCCc1ccc(Cl)cc1Cl Amb3939213 [1,1,0,0,0,0|1,1,0]=4 6120 B11R1.81 OCCc1ccc(Cl)cc1F Amb24366247 [1,1,0,0,0,0|1,1,0]=4 6121 B11R1.81 OCCc1ccc(Cl)cc1O Amb33260465 [1,1,0,0,0,0|2,0,0]=4 6122 B11R1.81 OCCc1ccc(F)cc1Br Amb25101426 [1,1,0,0,0,0|1,0,0]=3 6123 B11R1.81 OCCc1ccc(F)cc1Cl Amb6336629 [1,1,0,0,0,0|1,1,0]=4 6124 B11R1.81 OCCc1ccc(F)cc1F Amb18791913 [1,1,0,0,0,0|1,1,0]=4 6125 B11R1.81 OCCc1ccc(O)cc1Cl Amb33057388 [1,1,0,0,0,0|1,1,0]=4 6126 B11R1.81 OCCc1ccc(O)cc1F Amb26418047 [1,1,0,0,0,0|1,1,0]=4 6127 B11R1.81 OCCc1ccc(O)cc1O Amb8398785 [1,1,0,0,0,0|2,0,0]=4 6128 B11R1.81 OCCc1ncc(Br)cc1Br Amb26081025 [1,1,0,0,0,0|2,0,0]=4 6129 B11R1.81 ONCc1ccc(Br)cc1Br Amb33431907 [1,1,0,0,0,0|1,0,0]=3 6130 B11R1.81 ONCc1ccc(Br)cc1Cl Amb26074948 [1,1,0,0,0,0|1,1,0]=4 6131 B11R1.81 ONCc1ccc(Br)cc1F Amb27150272 [1,1,0,0,0,0|1,1,0]=4 6132 B11R1.81 ONCc1ccc(Br)cc1O Amb33478321 [1,1,0,0,0,0|2,0,0]=4 6133 B11R1.81 ONCc1ccc(Cl)cc1Br Amb24383872 [1,1,0,0,0,0|1,0,0]=3 6134 B11R1.81 ONCc1ccc(Cl)cc1Cl Amb22433171 [1,1,0,0,0,0|1,1,0]=4 6135 B11R1.81 ONCc1ccc(Cl)cc1F Amb26497148 [1,1,0,0,0,0|1,1,0]=4 6136 B11R1.81 ONCc1ccc(Cl)cc1O Amb33256796 [1,1,0,0,0,0|2,0,0]=4 6137 B11R1.81 ONCc1ccc(F)cc1Br Amb25148031 [1,1,0,0,0,0|1,0,0]=3 6138 B11R1.81 ONCc1ccc(F)cc1Cl Amb24372387 [1,1,0,0,0,0|1,1,0]=4 6139 B11R1.81 ONCc1ccc(F)cc1F Amb24734286 [1,1,0,0,0,0|1,1,0]=4 6140 B11R1.81 ONCc1ccc(O)cc1Cl Amb33057332 [1,1,0,0,0,0|1,1,0]=4 6141 B11R1.81 ONCc1ccc(O)cc1F Amb33358198 [1,1,0,0,0,0|1,1,0]=4 6142 B11R1.81 ONCc1ccc(O)cc1O Amb25370578 [1,1,0,0,0,0|2,0,0]=4 6143 B11R1.81 ONCc1ncc(Br)cc1Br Amb24509460 [1,1,0,0,0,0|2,0,0]=4 6144 B11R1.81 Oc1cc(Br)ccc1CCBr Amb33227517 [1,1,0,0,0,0|2,0,0]=4 6145 B11R1.81 Oc1cc(Br)ccc1CCS Amb33389683 [1,1,0,0,0,0|2,0,0]=4 6146 B11R1.81 Oc1cc(Cl)ccc1CCBr Amb33332411 [1,1,0,0,0,0|2,0,0]=4 6147 B11R1.81 Oc1cc(Cl)ccc1CCS Amb33413662 [1,1,0,0,0,0|2,0,0]=4 6148 B11R1.81 Oc1ccc(CCBr)c(Cl)c1 Amb33007146 [1,1,0,0,0,0|1,1,0]=4 6149 B11R1.81 Oc1ccc(CCBr)c(F)c1 Amb27876449 [1,1,0,0,0,0|1,1,0]=4 6150 B11R1.81 Oc1ccc(CCBr)c(O)c1 Amb33009098 [1,1,0,0,0,0|2,0,0]=4 6151 B11R1.81 Oc1ccc(CCCl)c(F)c1 Amb28365461 [1,1,0,0,0,0|1,1,0]=4 6152 B11R1.81 Oc1ccc(CCS)c(Cl)c1 Amb33057339 [1,1,0,0,0,0|1,1,0]=4 6153 B11R1.81 Oc1ccc(CCS)c(F)c1 Amb33376507 [1,1,0,0,0,0|1,1,0]=4 6154 B11R1.81 Oc1ccc(CCS)c(O)c1 Amb33268962 [1,1,0,0,0,0|2,0,0]=4 6155 B11R1.81 SCCc1ccc(Br)cc1Cl Amb33334700 [1,1,0,0,0,0|1,1,0]=4 6156 B11R1.81 SCCc1ccc(Cl)cc1Br Amb33478795 [1,1,0,0,0,0|1,0,0]=3 6157 B11R1.81 SCCc1ccc(Cl)cc1Cl Amb17403374 [1,1,0,0,0,0|1,1,0]=4 6158 B11R1.81 [C-]#[N+]Cc1ccc(Br)cc1Br Amb33432295 [1,1,0,0,0,0|0,0,2]=4 6159 B11R1.81 [C-]#[N+]Cc1ccc(C)cc1Br Amb33450457 [1,1,0,0,0,0|0,0,2]=4 6160 B11R1.81 [C-]#[N+]Cc1ccc(Cl)cc1Br Amb33478320 [1,1,0,0,0,0|0,0,2]=4 6161 B11R1.81 [C-]#[N+]Cc1ccc(F)cc1Br Amb33336551 [1,1,0,0,0,0|0,0,2]=4 6162 B11R1.81 [NH3+]CCc1ccc(Cl)cc1Cl Amb33513230 [1,1,0,0,0,0|0,1,1]=4 6163 B11R1.86 C=C(C)Cc1ccccc1N Amb18124844 [1,1,0,0,0,0|1,0,1]=4 6164 B11R1.86 C=C(C)Cc1ncccc1Br Amb27165908 [1,1,0,0,0,0|1,0,1]=4 6165 B11R1.86 CC(=N)Nc1ccccc1Br Amb28249813 [1,1,0,0,0,0|1,0,1]=4 6166 B11R1.86 CC(=O)Cc1ccccc1Br Amb6365737 [1,1,0,0,0,0|0,0,1]=3 6167 B11R1.86 CC(=O)Cc1ccccc1C Amb5751053 [1,1,0,0,0,0|1,0,1]=4 6168 B11R1.86 CC(=O)Cc1ccccc1Cl Amb2724208 [1,1,0,0,0,0|0,1,1]=4 6169 B11R1.86 CC(=O)Cc1ccccc1F Amb5751055 [1,1,0,0,0,0|0,1,1]=4 6170 B11R1.86 CC(=O)Cc1ccccc1I Amb24431271 [1,1,0,0,0,0|0,1,1]=4 6171 B11R1.86 CC(=O)Cc1ccccc1N Amb8439140 [1,1,0,0,0,0|1,0,1]=4 6172 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [1,1,0,0,0,0|1,0,1]=4 6173 B11R1.86 CC(=O)Cc1cccnc1Br Amb33387404 [1,1,0,0,0,0|1,0,1]=4 6174 B11R1.86 CC(=O)Cc1ccncc1Br Amb33451972 [1,1,0,0,0,0|1,0,1]=4 6175 B11R1.86 CC(=O)Cc1ncccc1Br Amb26622459 [1,1,0,0,0,0|1,0,1]=4 6176 B11R1.86 CC(=O)Nc1ccccc1Br Amb2611397 [1,1,0,0,0,0|1,0,1]=4 6177 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [1,1,0,0,0,0|1,0,1]=4 6178 B11R1.86 CC(Br)Cc1ccccc1Br Amb28043948 [1,1,0,0,0,0|0,0,0]=2 6179 B11R1.86 CC(Br)Cc1ccccc1Cl Amb24477523 [1,1,0,0,0,0|0,1,0]=3 6180 B11R1.86 CC(Br)Cc1ccccc1F Amb24477522 [1,1,0,0,0,0|0,1,0]=3 6181 B11R1.86 CC(Br)Cc1ccccc1O Amb33334190 [1,1,0,0,0,0|1,0,0]=3 6182 B11R1.86 CC(Br)Cc1cccnc1Br Amb33387807 [1,1,0,0,0,0|1,0,0]=3 6183 B11R1.86 CC(Br)Cc1cccnc1Cl Amb33388965 [1,1,0,0,0,0|1,1,0]=4 6184 B11R1.86 CC(Br)Cc1cccnc1F Amb33450425 [1,1,0,0,0,0|1,1,0]=4 6185 B11R1.86 CC(Br)Cc1ccncc1Br Amb33388612 [1,1,0,0,0,0|1,0,0]=3 6186 B11R1.86 CC(Br)Cc1ccncc1Cl Amb24373775 [1,1,0,0,0,0|1,1,0]=4 6187 B11R1.86 CC(Br)Cc1ccncc1F Amb33478248 [1,1,0,0,0,0|1,1,0]=4 6188 B11R1.86 CC(Br)Cc1ncccc1Br Amb33241031 [1,1,0,0,0,0|1,0,0]=3 6189 B11R1.86 CC(Br)Cc1ncccc1F Amb33451283 [1,1,0,0,0,0|1,1,0]=4 6190 B11R1.86 CC(C)=Cc1ccccc1Br Amb27395335 [1,1,0,0,0,0|0,0,2]=4 6191 B11R1.86 CC(C)CN1C=CC=CC1=O Amb27252073 [1,1,0,0,0,0|2,0,0]=4 6192 B11R1.86 CC(C)C[n+]1ccccc1F Amb28280717 [1,1,0,0,0,0|1,1,0]=4 6193 B11R1.86 CC(C)Cc1ccccc1Br Amb23400887 [1,1,0,0,0,0|0,0,0]=2 6194 B11R1.86 CC(C)Cc1ccccc1N Amb18644400 [1,1,0,0,0,0|1,0,0]=3 6195 B11R1.86 CC(C)Cc1ccccc1O Amb18125161 [1,1,0,0,0,0|1,0,0]=3 6196 B11R1.86 CC(C)Cc1cccnc1Br Amb24319295 [1,1,0,0,0,0|1,0,0]=3 6197 B11R1.86 CC(C)Cc1cccnc1Cl Amb24318856 [1,1,0,0,0,0|1,1,0]=4 6198 B11R1.86 CC(C)Cc1cccnc1N Amb18201847 [1,1,0,0,0,0|2,0,0]=4 6199 B11R1.86 CC(C)Cc1cccnc1O Amb24319296 [1,1,0,0,0,0|2,0,0]=4 6200 B11R1.86 CC(C)Cc1ccncc1Br Amb24321009 [1,1,0,0,0,0|1,0,0]=3 6201 B11R1.86 CC(C)Cc1ccncc1N Amb18201850 [1,1,0,0,0,0|2,0,0]=4 6202 B11R1.86 CC(C)Cc1cnccc1Br Amb24320976 [1,1,0,0,0,0|1,0,0]=3 6203 B11R1.86 CC(C)Cc1cnccc1N Amb24320977 [1,1,0,0,0,0|2,0,0]=4 6204 B11R1.86 CC(C)Cc1cnccc1O Amb33189017 [1,1,0,0,0,0|2,0,0]=4 6205 B11R1.86 CC(C)Cc1ncccc1Br Amb24320819 [1,1,0,0,0,0|1,0,0]=3 6206 B11R1.86 CC(C)Cc1ncccc1Cl Amb25197809 [1,1,0,0,0,0|1,1,0]=4 6207 B11R1.86 CC(C)Cc1ncccc1N Amb18201846 [1,1,0,0,0,0|2,0,0]=4 6208 B11R1.86 CC(C)Cc1ncncc1Br Amb18522209 [1,1,0,0,0,0|2,0,0]=4 6209 B11R1.86 CC(C)Nc1ccccc1Br Amb6696421 [1,1,0,0,0,0|1,0,0]=3 6210 B11R1.86 CC(C)Nc1ccccc1Cl Amb6696890 [1,1,0,0,0,0|1,1,0]=4 6211 B11R1.86 CC(C)Nc1ccccc1F Amb6697329 [1,1,0,0,0,0|1,1,0]=4 6212 B11R1.86 CC(C)Nc1ccccc1I Amb9203659 [1,1,0,0,0,0|1,1,0]=4 6213 B11R1.86 CC(C)Nc1ccccc1N Amb33801477 [1,1,0,0,0,0|2,0,0]=4 6214 B11R1.86 CC(C)Nc1ccccc1N Amb7767465 [1,1,0,0,0,0|2,0,0]=4 6215 B11R1.86 CC(C)Nc1ccccc1O Amb18644479 [1,1,0,0,0,0|2,0,0]=4 6216 B11R1.86 CC(C)Nc1ccccc1S Amb25312158 [1,1,0,0,0,0|2,0,0]=4 6217 B11R1.86 CC(C)Nc1ccncc1Br Amb27261968 [1,1,0,0,0,0|2,0,0]=4 6218 B11R1.86 CC(C)Nc1ncccc1Br Amb18282843 [1,1,0,0,0,0|2,0,0]=4 6219 B11R1.86 CC(C)Oc1ccccc1Br Amb6266593 [1,1,0,0,0,0|1,0,0]=3 6220 B11R1.86 CC(C)Oc1ccccc1Cl Amb7969638 [1,1,0,0,0,0|1,1,0]=4 6221 B11R1.86 CC(C)Oc1ccccc1I Amb10575381 [1,1,0,0,0,0|1,1,0]=4 6222 B11R1.86 CC(C)Oc1ccccc1N Amb1134319 [1,1,0,0,0,0|2,0,0]=4 6223 B11R1.86 CC(C)Oc1ccccc1N Amb19984801 [1,1,0,0,0,0|2,0,0]=4 6224 B11R1.86 CC(C)Oc1ccccc1O Amb2725468 [1,1,0,0,0,0|2,0,0]=4 6225 B11R1.86 CC(C)Oc1ccccc1S Amb19888301 [1,1,0,0,0,0|2,0,0]=4 6226 B11R1.86 CC(C)Oc1cccnc1Br Amb22498132 [1,1,0,0,0,0|2,0,0]=4 6227 B11R1.86 CC(C)Oc1ccncc1Br Amb24321012 [1,1,0,0,0,0|2,0,0]=4 6228 B11R1.86 CC(C)Oc1ncccc1Br Amb20242816 [1,1,0,0,0,0|2,0,0]=4 6229 B11R1.86 CC(C)Sc1ccccc1Br Amb28400693 [1,1,0,0,0,0|1,0,0]=3 6230 B11R1.86 CC(C)Sc1ccccc1Cl Amb28435634 [1,1,0,0,0,0|1,1,0]=4 6231 B11R1.86 CC(C)Sc1ccccc1N Amb6267169 [1,1,0,0,0,0|2,0,0]=4 6232 B11R1.86 CC(C)Sc1ccccc1N Amb8622743 [1,1,0,0,0,0|2,0,0]=4 6233 B11R1.86 CC(C)Sc1ncccc1Br Amb27229537 [1,1,0,0,0,0|2,0,0]=4 6234 B11R1.86 CC(Cl)Cc1ccccc1Cl Amb17477735 [1,1,0,0,0,0|0,1,0]=3 6235 B11R1.86 CC(Cl)Cc1cccnc1N Amb28365594 [1,1,0,0,0,0|2,0,0]=4 6236 B11R1.86 CC(F)Cc1ccccc1N Amb27613236 [1,1,0,0,0,0|1,0,0]=3 6237 B11R1.86 CC(N)CN1C=CC=CC1=O Amb18028970 [1,1,0,0,0,0|2,0,0]=4 6238 B11R1.86 CC(N)Cc1ccccc1Br Amb20626162 [1,1,0,0,0,0|0,0,0]=2 6239 B11R1.86 CC(N)Cc1ccccc1Br Amb6258428 [1,1,0,0,0,0|0,0,0]=2 6240 B11R1.86 CC(N)Cc1ccccc1Cl Amb5735435 [1,1,0,0,0,0|0,1,0]=3 6241 B11R1.86 CC(N)Cc1ccccc1Cl Amb9147578 [1,1,0,0,0,0|0,1,0]=3 6242 B11R1.86 CC(N)Cc1ccccc1F Amb9715171 [1,1,0,0,0,0|0,1,0]=3 6243 B11R1.86 CC(N)Cc1ccccc1I Amb27401005 [1,1,0,0,0,0|0,1,0]=3 6244 B11R1.86 CC(N)Cc1ccccc1O Amb4079280 [1,1,0,0,0,0|1,0,0]=3 6245 B11R1.86 CC(N)Cc1cccnc1Br Amb27482767 [1,1,0,0,0,0|1,0,0]=3 6246 B11R1.86 CC(N)Cc1cccnc1Cl Amb24761342 [1,1,0,0,0,0|1,1,0]=4 6247 B11R1.86 CC(N)Cc1cccnc1F Amb27466728 [1,1,0,0,0,0|1,1,0]=4 6248 B11R1.86 CC(N)Cc1ccncc1F Amb28314197 [1,1,0,0,0,0|1,1,0]=4 6249 B11R1.86 CC(N)Cc1ccncc1N Amb24538256 [1,1,0,0,0,0|2,0,0]=4 6250 B11R1.86 CC(N)Cc1cnccc1Br Amb27398652 [1,1,0,0,0,0|1,0,0]=3 6251 B11R1.86 CC(N)Cc1ncccc1N Amb25763254 [1,1,0,0,0,0|2,0,0]=4 6252 B11R1.86 CC(O)CN1C=CC=CC1=N Amb19895632 [1,1,0,0,0,0|2,0,0]=4 6253 B11R1.86 CC(O)Cc1ccccc1Br Amb28319667 [1,1,0,0,0,0|0,0,0]=2 6254 B11R1.86 CC(O)Cc1ccccc1Cl Amb17138668 [1,1,0,0,0,0|0,1,0]=3 6255 B11R1.86 CC(O)Cc1ccccc1F Amb17138450 [1,1,0,0,0,0|0,1,0]=3 6256 B11R1.86 CC(O)Cc1ccccc1N Amb24369609 [1,1,0,0,0,0|1,0,0]=3 6257 B11R1.86 CC(O)Cc1ccccc1O Amb18125386 [1,1,0,0,0,0|1,0,0]=3 6258 B11R1.86 CC(O)Cc1cccnc1Br Amb33387768 [1,1,0,0,0,0|1,0,0]=3 6259 B11R1.86 CC(O)Cc1cccnc1Cl Amb32747336 [1,1,0,0,0,0|1,1,0]=4 6260 B11R1.86 CC(O)Cc1cccnc1F Amb33378291 [1,1,0,0,0,0|1,1,0]=4 6261 B11R1.86 CC(O)Cc1ccncc1Br Amb33451027 [1,1,0,0,0,0|1,0,0]=3 6262 B11R1.86 CC(O)Cc1ccncc1Cl Amb25885768 [1,1,0,0,0,0|1,1,0]=4 6263 B11R1.86 CC(O)Cc1ccncc1F Amb33374460 [1,1,0,0,0,0|1,1,0]=4 6264 B11R1.86 CC(O)Cc1cnccc1N Amb27640265 [1,1,0,0,0,0|2,0,0]=4 6265 B11R1.86 CC(O)Cc1ncccc1Br Amb28318912 [1,1,0,0,0,0|1,0,0]=3 6266 B11R1.86 CC(O)Cc1ncccc1F Amb33079171 [1,1,0,0,0,0|1,1,0]=4 6267 B11R1.86 CC(S)Cc1ccccc1F Amb27978991 [1,1,0,0,0,0|0,1,0]=3 6268 B11R1.86 CN(C)CC1=CC=CNC1=O Amb29848140 [1,1,0,0,0,0|2,0,0]=4 6269 B11R1.86 CN(C)Cc1ccccc1Br Amb2592360 [1,1,0,0,0,0|0,0,0]=2 6270 B11R1.86 CN(C)Cc1ccccc1Cl Amb17827038 [1,1,0,0,0,0|0,1,0]=3 6271 B11R1.86 CN(C)Cc1ccccc1I Amb10071381 [1,1,0,0,0,0|0,1,0]=3 6272 B11R1.86 CN(C)Cc1ccccc1N Amb13949144 [1,1,0,0,0,0|1,0,0]=3 6273 B11R1.86 CN(C)Cc1ccccc1N Amb22755856 [1,1,0,0,0,0|1,0,0]=3 6274 B11R1.86 CN(C)Cc1ccccc1N Amb5722450 [1,1,0,0,0,0|1,0,0]=3 6275 B11R1.86 CN(C)Cc1ccccc1O Amb2052288 [1,1,0,0,0,0|1,0,0]=3 6276 B11R1.86 CN(C)Cc1ccccc1O Amb604021 [1,1,0,0,0,0|1,0,0]=3 6277 B11R1.86 CN(C)Cc1ccccc1S Amb19649790 [1,1,0,0,0,0|1,0,0]=3 6278 B11R1.86 CN(C)Cc1cccnc1Cl Amb18806824 [1,1,0,0,0,0|1,1,0]=4 6279 B11R1.86 CN(C)Cc1cccnc1F Amb27453484 [1,1,0,0,0,0|1,1,0]=4 6280 B11R1.86 CN(C)Cc1ccncc1F Amb28066052 [1,1,0,0,0,0|1,1,0]=4 6281 B11R1.86 CN(C)Cc1ncccc1O Amb1152389 [1,1,0,0,0,0|2,0,0]=4 6282 B11R1.86 CN(C)Nc1ccccc1N Amb28434486 [1,1,0,0,0,0|2,0,0]=4 6283 B11R1.86 CN(C)Nc1ccncc1Br Amb28194341 [1,1,0,0,0,0|2,0,0]=4 6284 B11R1.86 CN(N)Cc1ccccc1Cl Amb18563932 [1,1,0,0,0,0|0,1,0]=3 6285 B11R1.86 CN(N)Cc1ccccc1F Amb18065410 [1,1,0,0,0,0|0,1,0]=3 6286 B11R1.86 CN(O)Cc1ccccc1Br Amb33388491 [1,1,0,0,0,0|0,0,0]=2 6287 B11R1.86 CN(O)Cc1ccccc1Cl Amb27150038 [1,1,0,0,0,0|0,1,0]=3 6288 B11R1.86 CN(O)Cc1ccccc1F Amb33361531 [1,1,0,0,0,0|0,1,0]=3 6289 B11R1.86 CN(O)Cc1ccccc1O Amb24676904 [1,1,0,0,0,0|1,0,0]=3 6290 B11R1.86 CN(O)Cc1cccnc1Br Amb33387435 [1,1,0,0,0,0|1,0,0]=3 6291 B11R1.86 CN(O)Cc1cccnc1Cl Amb33256926 [1,1,0,0,0,0|1,1,0]=4 6292 B11R1.86 CN(O)Cc1cccnc1F Amb33378331 [1,1,0,0,0,0|1,1,0]=4 6293 B11R1.86 CN(O)Cc1ccncc1Br Amb33388501 [1,1,0,0,0,0|1,0,0]=3 6294 B11R1.86 CN(O)Cc1ccncc1Cl Amb33413514 [1,1,0,0,0,0|1,1,0]=4 6295 B11R1.86 CN(O)Cc1ccncc1F Amb33318028 [1,1,0,0,0,0|1,1,0]=4 6296 B11R1.86 CN(O)Cc1ncccc1Br Amb33485074 [1,1,0,0,0,0|1,0,0]=3 6297 B11R1.86 CN(O)Cc1ncccc1F Amb33419504 [1,1,0,0,0,0|1,1,0]=4 6298 B11R1.86 CS(=O)Cc1ccccc1N Amb18282229 [1,1,0,0,0,0|2,0,0]=4 6299 B11R1.86 C[C@@H](N)Cc1ccccc1Br Amb28437214 [1,1,0,0,0,0|0,0,0]=2 6300 B11R1.86 C[C@@H](N)Cc1ccccc1Cl Amb25996509 [1,1,0,0,0,0|0,1,0]=3 6301 B11R1.86 C[C@@H](N)Cc1ccccc1F Amb27176270 [1,1,0,0,0,0|0,1,0]=3 6302 B11R1.86 C[C@@H](N)Cc1ccccc1I Amb27798459 [1,1,0,0,0,0|0,1,0]=3 6303 B11R1.86 C[C@@H](N)Cc1ccccc1O Amb27154223 [1,1,0,0,0,0|1,0,0]=3 6304 B11R1.86 C[C@@H](N)Cc1cccnc1Br Amb33242619 [1,1,0,0,0,0|1,0,0]=3 6305 B11R1.86 C[C@@H](N)Cc1cccnc1Cl Amb33407314 [1,1,0,0,0,0|1,1,0]=4 6306 B11R1.86 C[C@@H](N)Cc1cccnc1F Amb33448386 [1,1,0,0,0,0|1,1,0]=4 6307 B11R1.86 C[C@@H](N)Cc1ccncc1Br Amb33242642 [1,1,0,0,0,0|1,0,0]=3 6308 B11R1.86 C[C@@H](N)Cc1ccncc1Cl Amb33407310 [1,1,0,0,0,0|1,1,0]=4 6309 B11R1.86 C[C@@H](N)Cc1ccncc1F Amb33449522 [1,1,0,0,0,0|1,1,0]=4 6310 B11R1.86 C[C@@H](N)Cc1ncccc1Br Amb33241857 [1,1,0,0,0,0|1,0,0]=3 6311 B11R1.86 C[C@@H](N)Cc1ncccc1F Amb33448807 [1,1,0,0,0,0|1,1,0]=4 6312 B11R1.86 C[C@@H](O)Cc1ccccc1Br Amb33387635 [1,1,0,0,0,0|0,0,0]=2 6313 B11R1.86 C[C@@H](O)Cc1ccccc1Cl Amb25842201 [1,1,0,0,0,0|0,1,0]=3 6314 B11R1.86 C[C@@H](O)Cc1ccccc1F Amb26536845 [1,1,0,0,0,0|0,1,0]=3 6315 B11R1.86 C[C@@H](O)Cc1ccccc1O Amb22896916 [1,1,0,0,0,0|1,0,0]=3 6316 B11R1.86 C[C@@H](O)Cc1cccnc1Br Amb33387803 [1,1,0,0,0,0|1,0,0]=3 6317 B11R1.86 C[C@@H](O)Cc1cccnc1Cl Amb33257308 [1,1,0,0,0,0|1,1,0]=4 6318 B11R1.86 C[C@@H](O)Cc1cccnc1F Amb33377612 [1,1,0,0,0,0|1,1,0]=4 6319 B11R1.86 C[C@@H](O)Cc1ccncc1Br Amb33388610 [1,1,0,0,0,0|1,0,0]=3 6320 B11R1.86 C[C@@H](O)Cc1ccncc1Cl Amb33413801 [1,1,0,0,0,0|1,1,0]=4 6321 B11R1.86 C[C@@H](O)Cc1ccncc1F Amb33317432 [1,1,0,0,0,0|1,1,0]=4 6322 B11R1.86 C[C@@H](O)Cc1ncccc1Br Amb33336050 [1,1,0,0,0,0|1,0,0]=3 6323 B11R1.86 C[C@@H](O)Cc1ncccc1F Amb33418792 [1,1,0,0,0,0|1,1,0]=4 6324 B11R1.86 C[C@H](N)Cc1ccccc1Br Amb27972637 [1,1,0,0,0,0|0,0,0]=2 6325 B11R1.86 C[C@H](N)Cc1ccccc1Cl Amb25793461 [1,1,0,0,0,0|0,1,0]=3 6326 B11R1.86 C[C@H](N)Cc1ccccc1F Amb25726401 [1,1,0,0,0,0|0,1,0]=3 6327 B11R1.86 C[C@H](N)Cc1ccccc1O Amb27390584 [1,1,0,0,0,0|1,0,0]=3 6328 B11R1.86 C[C@H](N)Cc1cccnc1Br Amb33242764 [1,1,0,0,0,0|1,0,0]=3 6329 B11R1.86 C[C@H](N)Cc1cccnc1Cl Amb33261286 [1,1,0,0,0,0|1,1,0]=4 6330 B11R1.86 C[C@H](N)Cc1cccnc1F Amb33079844 [1,1,0,0,0,0|1,1,0]=4 6331 B11R1.86 C[C@H](N)Cc1ccncc1Br Amb33451375 [1,1,0,0,0,0|1,0,0]=3 6332 B11R1.86 C[C@H](N)Cc1ccncc1Cl Amb33406769 [1,1,0,0,0,0|1,1,0]=4 6333 B11R1.86 C[C@H](N)Cc1ccncc1F Amb32953227 [1,1,0,0,0,0|1,1,0]=4 6334 B11R1.86 C[C@H](N)Cc1ncccc1Br Amb33242081 [1,1,0,0,0,0|1,0,0]=3 6335 B11R1.86 C[C@H](N)Cc1ncccc1F Amb33358495 [1,1,0,0,0,0|1,1,0]=4 6336 B11R1.86 C[C@H](O)Cc1ccccc1Br Amb33387632 [1,1,0,0,0,0|0,0,0]=2 6337 B11R1.86 C[C@H](O)Cc1ccccc1Cl Amb26472337 [1,1,0,0,0,0|0,1,0]=3 6338 B11R1.86 C[C@H](O)Cc1ccccc1F Amb25792429 [1,1,0,0,0,0|0,1,0]=3 6339 B11R1.86 C[C@H](O)Cc1ccccc1O Amb26497542 [1,1,0,0,0,0|1,0,0]=3 6340 B11R1.86 C[C@H](O)Cc1cccnc1Br Amb33387801 [1,1,0,0,0,0|1,0,0]=3 6341 B11R1.86 C[C@H](O)Cc1cccnc1Cl Amb33257306 [1,1,0,0,0,0|1,1,0]=4 6342 B11R1.86 C[C@H](O)Cc1cccnc1F Amb33224049 [1,1,0,0,0,0|1,1,0]=4 6343 B11R1.86 C[C@H](O)Cc1ccncc1Br Amb33388609 [1,1,0,0,0,0|1,0,0]=3 6344 B11R1.86 C[C@H](O)Cc1ccncc1Cl Amb33256248 [1,1,0,0,0,0|1,1,0]=4 6345 B11R1.86 C[C@H](O)Cc1ccncc1F Amb33317433 [1,1,0,0,0,0|1,1,0]=4 6346 B11R1.86 C[C@H](O)Cc1ncccc1Br Amb33336053 [1,1,0,0,0,0|1,0,0]=3 6347 B11R1.86 C[C@H](O)Cc1ncccc1F Amb33418793 [1,1,0,0,0,0|1,1,0]=4 6348 B11R1.86 Cc1ccccc1CC(=N)N Amb2696413 [1,1,0,0,0,0|1,0,1]=4 6349 B11R1.86 Cc1ccccc1CC(=N)N Amb33549015 [1,1,0,0,0,0|1,0,1]=4 6350 B11R1.86 Cc1ccccc1CC(C)Br Amb26653906 [1,1,0,0,0,0|1,0,0]=3 6351 B11R1.86 Cc1ccccc1CC(C)C Amb25955887 [1,1,0,0,0,0|1,0,0]=3 6352 B11R1.86 Cc1ccccc1CC(C)N Amb10609282 [1,1,0,0,0,0|1,0,0]=3 6353 B11R1.86 Cc1ccccc1CC(C)N Amb4079277 [1,1,0,0,0,0|1,0,0]=3 6354 B11R1.86 Cc1ccccc1CC(C)O Amb17138429 [1,1,0,0,0,0|1,0,0]=3 6355 B11R1.86 Cc1ccccc1CC(N)=O Amb2107849 [1,1,0,0,0,0|1,0,1]=4 6356 B11R1.86 Cc1ccccc1CC(N)=S Amb6247953 [1,1,0,0,0,0|1,0,1]=4 6357 B11R1.86 Cc1ccccc1CN(C)C Amb17663824 [1,1,0,0,0,0|1,0,0]=3 6358 B11R1.86 Cc1ccccc1CN(C)N Amb18064378 [1,1,0,0,0,0|1,0,0]=3 6359 B11R1.86 Cc1ccccc1CN(C)O Amb33360855 [1,1,0,0,0,0|1,0,0]=3 6360 B11R1.86 Cc1ccccc1CS(C)=O Amb27261207 [1,1,0,0,0,0|2,0,0]=4 6361 B11R1.86 Cc1ccccc1C[C@@H](C)N Amb26508805 [1,1,0,0,0,0|1,0,0]=3 6362 B11R1.86 Cc1ccccc1C[C@@H](C)O Amb24432685 [1,1,0,0,0,0|1,0,0]=3 6363 B11R1.86 Cc1ccccc1C[C@H](C)N Amb26026806 [1,1,0,0,0,0|1,0,0]=3 6364 B11R1.86 Cc1ccccc1C[C@H](C)O Amb33360564 [1,1,0,0,0,0|1,0,0]=3 6365 B11R1.86 Cc1ccccc1NC(C)C Amb6701185 [1,1,0,0,0,0|2,0,0]=4 6366 B11R1.86 Cc1ccccc1OC(C)C Amb2694428 [1,1,0,0,0,0|2,0,0]=4 6367 B11R1.86 Cc1ccccc1SC(C)C Amb28124330 [1,1,0,0,0,0|2,0,0]=4 6368 B11R1.86 Cc1cccnc1CC(C)Br Amb24477590 [1,1,0,0,0,0|2,0,0]=4 6369 B11R1.86 Cc1cccnc1CC(C)N Amb1995154 [1,1,0,0,0,0|2,0,0]=4 6370 B11R1.86 Cc1cccnc1CC(C)O Amb1995155 [1,1,0,0,0,0|2,0,0]=4 6371 B11R1.86 Cc1cccnc1CN(C)O Amb33429061 [1,1,0,0,0,0|2,0,0]=4 6372 B11R1.86 Cc1cccnc1C[C@@H](C)N Amb33428753 [1,1,0,0,0,0|2,0,0]=4 6373 B11R1.86 Cc1cccnc1C[C@@H](C)O Amb33428749 [1,1,0,0,0,0|2,0,0]=4 6374 B11R1.86 Cc1cccnc1C[C@H](C)N Amb33428751 [1,1,0,0,0,0|2,0,0]=4 6375 B11R1.86 Cc1cccnc1C[C@H](C)O Amb33428750 [1,1,0,0,0,0|2,0,0]=4 6376 B11R1.86 Cc1ccncc1CC(C)Br Amb33389462 [1,1,0,0,0,0|2,0,0]=4 6377 B11R1.86 Cc1ccncc1CC(C)N Amb28131246 [1,1,0,0,0,0|2,0,0]=4 6378 B11R1.86 Cc1ccncc1CC(C)O Amb33377019 [1,1,0,0,0,0|2,0,0]=4 6379 B11R1.86 Cc1ccncc1CN(C)C Amb25697089 [1,1,0,0,0,0|2,0,0]=4 6380 B11R1.86 Cc1ccncc1CN(C)O Amb33377103 [1,1,0,0,0,0|2,0,0]=4 6381 B11R1.86 Cc1ccncc1C[C@@H](C)N Amb33376697 [1,1,0,0,0,0|2,0,0]=4 6382 B11R1.86 Cc1ccncc1C[C@@H](C)O Amb33376694 [1,1,0,0,0,0|2,0,0]=4 6383 B11R1.86 Cc1ccncc1C[C@H](C)N Amb33376696 [1,1,0,0,0,0|2,0,0]=4 6384 B11R1.86 Cc1ccncc1C[C@H](C)O Amb33376695 [1,1,0,0,0,0|2,0,0]=4 6385 B11R1.86 Cc1cnccc1CC(C)Br Amb33451683 [1,1,0,0,0,0|2,0,0]=4 6386 B11R1.86 Cc1cnccc1CC(C)O Amb33080073 [1,1,0,0,0,0|2,0,0]=4 6387 B11R1.86 Cc1cnccc1CN(C)O Amb33415543 [1,1,0,0,0,0|2,0,0]=4 6388 B11R1.86 Cc1cnccc1C[C@@H](C)N Amb33424644 [1,1,0,0,0,0|2,0,0]=4 6389 B11R1.86 Cc1cnccc1C[C@@H](C)O Amb33424641 [1,1,0,0,0,0|2,0,0]=4 6390 B11R1.86 Cc1cnccc1C[C@H](C)N Amb33424643 [1,1,0,0,0,0|2,0,0]=4 6391 B11R1.86 Cc1cnccc1C[C@H](C)O Amb33424642 [1,1,0,0,0,0|2,0,0]=4 6392 B11R1.86 Cc1ncccc1CC(C)Br Amb33432584 [1,1,0,0,0,0|2,0,0]=4 6393 B11R1.86 Cc1ncccc1CC(C)N Amb35653999 [1,1,0,0,0,0|2,0,0]=4 6394 B11R1.86 Cc1ncccc1CC(C)O Amb32879587 [1,1,0,0,0,0|2,0,0]=4 6395 B11R1.86 Cc1ncccc1CN(C)O Amb33224601 [1,1,0,0,0,0|2,0,0]=4 6396 B11R1.86 Cc1ncccc1C[C@@H](C)N Amb33171950 [1,1,0,0,0,0|2,0,0]=4 6397 B11R1.86 Cc1ncccc1C[C@@H](C)O Amb32878983 [1,1,0,0,0,0|2,0,0]=4 6398 B11R1.86 Cc1ncccc1C[C@H](C)N Amb33225599 [1,1,0,0,0,0|2,0,0]=4 6399 B11R1.86 Cc1ncccc1C[C@H](C)O Amb32878984 [1,1,0,0,0,0|2,0,0]=4 6400 B11R1.86 FC(F)Cc1ccccc1Br Amb19929261 [1,1,0,0,0,0|1,0,0]=3 6401 B11R1.86 FC(F)Cc1ccccc1I Amb22739040 [1,1,0,0,0,0|1,1,0]=4 6402 B11R1.86 FC(F)Oc1ccccc1Br Amb2687163 [1,1,0,0,0,0|2,0,0]=4 6403 B11R1.86 FC(F)Sc1ccccc1Br Amb17254601 [1,1,0,0,0,0|2,0,0]=4 6404 B11R1.86 N=C(N)Cc1ccccc1Br Amb16231135 [1,1,0,0,0,0|0,0,1]=3 6405 B11R1.86 N=C(N)Cc1ccccc1Br Amb6259549 [1,1,0,0,0,0|0,0,1]=3 6406 B11R1.86 N=C(N)Cc1ccccc1Cl Amb20673127 [1,1,0,0,0,0|0,1,1]=4 6407 B11R1.86 N=C(N)Cc1ccccc1Cl Amb6280626 [1,1,0,0,0,0|0,1,1]=4 6408 B11R1.86 N=C(N)Cc1ccccc1F Amb2696586 [1,1,0,0,0,0|0,1,1]=4 6409 B11R1.86 N=C(N)Cc1ccccc1F Amb7365488 [1,1,0,0,0,0|0,1,1]=4 6410 B11R1.86 N=C(N)Cc1ccccc1I Amb27945485 [1,1,0,0,0,0|0,1,1]=4 6411 B11R1.86 N=C(N)Cc1ccccc1O Amb25045573 [1,1,0,0,0,0|1,0,1]=4 6412 B11R1.86 N=C(N)Cc1cccnc1Br Amb33388145 [1,1,0,0,0,0|1,0,1]=4 6413 B11R1.86 N=C(N)Cc1ccncc1Br Amb33242871 [1,1,0,0,0,0|1,0,1]=4 6414 B11R1.86 N=C(N)Cc1ncccc1Br Amb25823671 [1,1,0,0,0,0|1,0,1]=4 6415 B11R1.86 N=C(N)Nc1ccccc1Br Amb10879748 [1,1,0,0,0,0|1,0,1]=4 6416 B11R1.86 N=C(N)Sc1ccccc1Br Amb27761151 [1,1,0,0,0,0|1,0,1]=4 6417 B11R1.86 NC(=O)C[n+]1ccccc1Br Amb28078435 [1,1,0,0,0,0|1,0,1]=4 6418 B11R1.86 NC(=O)Cc1ccccc1Br Amb2754651 [1,1,0,0,0,0|0,0,1]=3 6419 B11R1.86 NC(=O)Cc1ccccc1Cl Amb33551592 [1,1,0,0,0,0|0,1,1]=4 6420 B11R1.86 NC(=O)Cc1ccccc1F Amb33551560 [1,1,0,0,0,0|0,1,1]=4 6421 B11R1.86 NC(=O)Cc1ccccc1I Amb24685113 [1,1,0,0,0,0|0,1,1]=4 6422 B11R1.86 NC(=O)Cc1ccccc1N Amb1116123 [1,1,0,0,0,0|1,0,1]=4 6423 B11R1.86 NC(=O)Cc1ccccc1O Amb4020853 [1,1,0,0,0,0|1,0,1]=4 6424 B11R1.86 NC(=O)Nc1ccccc1Br Amb1140530 [1,1,0,0,0,0|1,0,1]=4 6425 B11R1.86 NC(=S)Cc1ccccc1Br Amb6248548 [1,1,0,0,0,0|0,0,1]=3 6426 B11R1.86 NC(=S)Cc1ccccc1Cl Amb2736727 [1,1,0,0,0,0|0,1,1]=4 6427 B11R1.86 NC(=S)Cc1ccccc1F Amb6250493 [1,1,0,0,0,0|0,1,1]=4 6428 B11R1.86 NC(=S)Cc1ccccc1O Amb26373191 [1,1,0,0,0,0|1,0,1]=4 6429 B11R1.86 NC(=S)Cc1cccnc1Br Amb33388147 [1,1,0,0,0,0|1,0,1]=4 6430 B11R1.86 NC(=S)Cc1ccncc1Br Amb33450958 [1,1,0,0,0,0|1,0,1]=4 6431 B11R1.86 NC(=S)Cc1ncccc1Br Amb27840018 [1,1,0,0,0,0|1,0,1]=4 6432 B11R1.86 NC(=S)Nc1ccccc1Br Amb2372750 [1,1,0,0,0,0|1,0,1]=4 6433 B11R1.86 Nc1ccccc1CC(F)F Amb27635565 [1,1,0,0,0,0|2,0,0]=4 6434 B11R1.86 O=C(Cl)Cc1ccccc1Br Amb3939380 [1,1,0,0,0,0|1,0,1]=4 6435 B11R1.86 O=C(O)Cc1ccccc1Br Amb1139894 [1,1,0,0,0,0|1,0,1]=4 6436 B11R1.86 O=S([O-])Cc1ccccc1Br Amb32754312 [1,1,0,0,0,0|2,0,0]=4 6437 B11R1.86 O=[N+]([O-])Cc1ccccc1Br Amb23589328 [1,1,0,0,0,0|1,0,1]=4 6438 B11R1.182 C#CCc1cc(Br)ccc1Br Amb33331346 [1,1,0,0,0,0|0,0,2]=4 6439 B11R1.182 C#CCc1cc(C)ccc1Br Amb33477529 [1,1,0,0,0,0|0,0,2]=4 6440 B11R1.182 C#CCc1cc(Cl)ccc1Br Amb33478234 [1,1,0,0,0,0|0,0,2]=4 6441 B11R1.182 C#CCc1cc(F)ccc1Br Amb33008546 [1,1,0,0,0,0|0,0,2]=4 6442 B11R1.182 C#CCc1cc(O)ccc1Br Amb33450333 [1,1,0,0,0,0|0,0,2]=4 6443 B11R1.182 CC1=CN(CCN)C(=O)C=C1 Amb18030462 [1,1,0,0,0,0|2,0,0]=4 6444 B11R1.182 CCCN1C=C(I)C=CC1=O Amb27173414 [1,1,0,0,0,0|2,0,0]=4 6445 B11R1.182 CCCN1C=C(N)C=CC1=O Amb18030054 [1,1,0,0,0,0|2,0,0]=4 6446 B11R1.182 CCCN1C=C(N)C=CC1=O Amb19372740 [1,1,0,0,0,0|2,0,0]=4 6447 B11R1.182 CCCc1cc(Br)ccc1N Amb28128360 [1,1,0,0,0,0|1,0,0]=3 6448 B11R1.182 CCCc1cc(Br)ccc1O Amb27839911 [1,1,0,0,0,0|1,0,0]=3 6449 B11R1.182 CCCc1cc(Br)ncc1Br Amb24319739 [1,1,0,0,0,0|1,0,0]=3 6450 B11R1.182 CCCc1cc(Br)ncc1N Amb24322579 [1,1,0,0,0,0|2,0,0]=4 6451 B11R1.182 CCCc1cc(C)cnc1N Amb27805589 [1,1,0,0,0,0|2,0,0]=4 6452 B11R1.182 CCCc1cc(Cl)cnc1F Amb32644874 [1,1,0,0,0,0|1,1,0]=4 6453 B11R1.182 CCCc1cc(N)ccc1Br Amb28140059 [1,1,0,0,0,0|0,0,0]=2 6454 B11R1.182 CCCc1cc(N)ccc1N Amb27645477 [1,1,0,0,0,0|1,0,0]=3 6455 B11R1.182 CCCc1cc(N)ncc1Br Amb24319774 [1,1,0,0,0,0|1,0,0]=3 6456 B11R1.182 CCCc1cc(O)ccc1Br Amb28139098 [1,1,0,0,0,0|0,0,0]=2 6457 B11R1.182 CCCc1cc(O)ccc1Cl Amb26910144 [1,1,0,0,0,0|0,1,0]=3 6458 B11R1.182 CCCc1cc(O)cnc1C Amb32759504 [1,1,0,0,0,0|2,0,0]=4 6459 B11R1.182 CCCc1nc(C)ccc1C Amb28368589 [1,1,0,0,0,0|2,0,0]=4 6460 B11R1.182 CCCc1nc(C)ccc1N Amb26622758 [1,1,0,0,0,0|2,0,0]=4 6461 B11R1.182 CCCc1nc(I)ccc1O Amb27237710 [1,1,0,0,0,0|2,0,0]=4 6462 B11R1.182 CCCc1nc(N)ncc1Br Amb24317497 [1,1,0,0,0,0|2,0,0]=4 6463 B11R1.182 CCCc1nc(O)ncc1Br Amb24317501 [1,1,0,0,0,0|2,0,0]=4 6464 B11R1.182 CCNC1=CC(=O)C=CC1=O Amb27828586 [1,1,0,0,0,0|2,0,0]=4 6465 B11R1.182 CCNc1cc(Br)ccc1C Amb9595585 [1,1,0,0,0,0|2,0,0]=4 6466 B11R1.182 CCNc1cc(Br)ccc1Cl Amb24438946 [1,1,0,0,0,0|1,1,0]=4 6467 B11R1.182 CCNc1cc(Br)ccc1N Amb22059682 [1,1,0,0,0,0|2,0,0]=4 6468 B11R1.182 CCNc1cc(C)ccc1Br Amb27169701 [1,1,0,0,0,0|1,0,0]=3 6469 B11R1.182 CCNc1cc(C)ccc1C Amb10609582 [1,1,0,0,0,0|2,0,0]=4 6470 B11R1.182 CCNc1cc(C)ccc1C Amb4313308 [1,1,0,0,0,0|2,0,0]=4 6471 B11R1.182 CCNc1cc(C)ccc1F Amb7760288 [1,1,0,0,0,0|1,1,0]=4 6472 B11R1.182 CCNc1cc(C)ccc1N Amb23114121 [1,1,0,0,0,0|2,0,0]=4 6473 B11R1.182 CCNc1cc(C)ccc1O Amb1091058 [1,1,0,0,0,0|2,0,0]=4 6474 B11R1.182 CCNc1cc(Cl)ccc1C Amb6683518 [1,1,0,0,0,0|2,0,0]=4 6475 B11R1.182 CCNc1cc(Cl)ccc1Cl Amb6687675 [1,1,0,0,0,0|1,1,0]=4 6476 B11R1.182 CCNc1cc(Cl)ccc1F Amb9238490 [1,1,0,0,0,0|1,1,0]=4 6477 B11R1.182 CCNc1cc(Cl)ccc1I Amb30016026 [1,1,0,0,0,0|1,1,0]=4 6478 B11R1.182 CCNc1cc(Cl)ccc1N Amb27828628 [1,1,0,0,0,0|2,0,0]=4 6479 B11R1.182 CCNc1cc(Cl)ccc1N Amb33338826 [1,1,0,0,0,0|2,0,0]=4 6480 B11R1.182 CCNc1cc(Cl)ccc1O Amb18940920 [1,1,0,0,0,0|2,0,0]=4 6481 B11R1.182 CCNc1cc(F)ccc1Br Amb27823513 [1,1,0,0,0,0|1,0,0]=3 6482 B11R1.182 CCNc1cc(F)ccc1C Amb30982589 [1,1,0,0,0,0|2,0,0]=4 6483 B11R1.182 CCNc1cc(F)ccc1C Amb6698533 [1,1,0,0,0,0|2,0,0]=4 6484 B11R1.182 CCNc1cc(F)ccc1F Amb6691521 [1,1,0,0,0,0|1,1,0]=4 6485 B11R1.182 CCNc1cc(F)ccc1N Amb18961168 [1,1,0,0,0,0|2,0,0]=4 6486 B11R1.182 CCNc1cc(F)ccc1O Amb18057774 [1,1,0,0,0,0|2,0,0]=4 6487 B11R1.182 CCNc1cc(I)ccc1Cl Amb27971950 [1,1,0,0,0,0|1,1,0]=4 6488 B11R1.182 CCNc1cc(O)ccc1C Amb6608932 [1,1,0,0,0,0|2,0,0]=4 6489 B11R1.182 CCNc1nc(C)ccc1Br Amb35676278 [1,1,0,0,0,0|2,0,0]=4 6490 B11R1.182 CCOC1=CC(=O)C=CC1=O Amb25808014 [1,1,0,0,0,0|2,0,0]=4 6491 B11R1.182 CCOc1cc(Br)ccc1Br Amb19888214 [1,1,0,0,0,0|1,0,0]=3 6492 B11R1.182 CCOc1cc(Br)ccc1C Amb22490068 [1,1,0,0,0,0|2,0,0]=4 6493 B11R1.182 CCOc1cc(Br)ccc1Cl Amb19888232 [1,1,0,0,0,0|1,1,0]=4 6494 B11R1.182 CCOc1cc(Br)ccc1F Amb21963483 [1,1,0,0,0,0|1,1,0]=4 6495 B11R1.182 CCOc1cc(Br)ccc1I Amb19888233 [1,1,0,0,0,0|1,1,0]=4 6496 B11R1.182 CCOc1cc(Br)ccc1N Amb18657907 [1,1,0,0,0,0|2,0,0]=4 6497 B11R1.182 CCOc1cc(Br)ccc1O Amb5781633 [1,1,0,0,0,0|2,0,0]=4 6498 B11R1.182 CCOc1cc(Br)ccc1S Amb28280097 [1,1,0,0,0,0|2,0,0]=4 6499 B11R1.182 CCOc1cc(Br)cnc1Br Amb2609587 [1,1,0,0,0,0|2,0,0]=4 6500 B11R1.182 CCOc1cc(Br)ncc1Br Amb2609585 [1,1,0,0,0,0|2,0,0]=4 6501 B11R1.182 CCOc1cc(C)ccc1Br Amb25085057 [1,1,0,0,0,0|1,0,0]=3 6502 B11R1.182 CCOc1cc(C)ccc1N Amb6275717 [1,1,0,0,0,0|2,0,0]=4 6503 B11R1.182 CCOc1cc(C)ccc1O Amb2720927 [1,1,0,0,0,0|2,0,0]=4 6504 B11R1.182 CCOc1cc(C)ccc1S Amb26606875 [1,1,0,0,0,0|2,0,0]=4 6505 B11R1.182 CCOc1cc(Cl)ccc1F Amb16186002 [1,1,0,0,0,0|1,1,0]=4 6506 B11R1.182 CCOc1cc(Cl)ccc1N Amb18960041 [1,1,0,0,0,0|2,0,0]=4 6507 B11R1.182 CCOc1cc(Cl)ccc1N Amb22274126 [1,1,0,0,0,0|2,0,0]=4 6508 B11R1.182 CCOc1cc(Cl)ccc1O Amb18126988 [1,1,0,0,0,0|2,0,0]=4 6509 B11R1.182 CCOc1cc(Cl)ccc1S Amb26597554 [1,1,0,0,0,0|2,0,0]=4 6510 B11R1.182 CCOc1cc(Cl)cnc1Br Amb28127947 [1,1,0,0,0,0|2,0,0]=4 6511 B11R1.182 CCOc1cc(F)ccc1Br Amb24065598 [1,1,0,0,0,0|1,0,0]=3 6512 B11R1.182 CCOc1cc(F)ccc1C Amb27606152 [1,1,0,0,0,0|2,0,0]=4 6513 B11R1.182 CCOc1cc(F)ccc1Cl Amb10841500 [1,1,0,0,0,0|1,1,0]=4 6514 B11R1.182 CCOc1cc(F)ccc1N Amb1129616 [1,1,0,0,0,0|2,0,0]=4 6515 B11R1.182 CCOc1cc(F)ccc1N Amb21964960 [1,1,0,0,0,0|2,0,0]=4 6516 B11R1.182 CCOc1cc(F)ccc1S Amb24649837 [1,1,0,0,0,0|2,0,0]=4 6517 B11R1.182 CCOc1cc(I)ccc1S Amb27469856 [1,1,0,0,0,0|2,0,0]=4 6518 B11R1.182 CCOc1cc(N)ccc1Br Amb22274125 [1,1,0,0,0,0|1,0,0]=3 6519 B11R1.182 CCOc1cc(N)ccc1Br Amb6366087 [1,1,0,0,0,0|1,0,0]=3 6520 B11R1.182 CCOc1cc(N)ccc1C Amb19283587 [1,1,0,0,0,0|2,0,0]=4 6521 B11R1.182 CCOc1cc(N)ccc1C Amb9381361 [1,1,0,0,0,0|2,0,0]=4 6522 B11R1.182 CCOc1cc(N)ccc1Cl Amb19959885 [1,1,0,0,0,0|1,1,0]=4 6523 B11R1.182 CCOc1cc(N)ccc1N Amb26919930 [1,1,0,0,0,0|2,0,0]=4 6524 B11R1.182 CCOc1cc(N)ccc1O Amb18125535 [1,1,0,0,0,0|2,0,0]=4 6525 B11R1.182 CCOc1cc(N)ccc1S Amb26460975 [1,1,0,0,0,0|2,0,0]=4 6526 B11R1.182 CCOc1cc(N)cnc1Br Amb19958188 [1,1,0,0,0,0|2,0,0]=4 6527 B11R1.182 CCOc1cc(N)ncc1Br Amb22263317 [1,1,0,0,0,0|2,0,0]=4 6528 B11R1.182 CCOc1cc(O)ccc1Br Amb24091323 [1,1,0,0,0,0|1,0,0]=3 6529 B11R1.182 CCOc1cc(O)ccc1N Amb28652848 [1,1,0,0,0,0|2,0,0]=4 6530 B11R1.182 CCOc1cc(O)ccc1O Amb18125661 [1,1,0,0,0,0|2,0,0]=4 6531 B11R1.182 CCOc1cc(O)ccc1S Amb25188767 [1,1,0,0,0,0|2,0,0]=4 6532 B11R1.182 CCOc1cc(S)ccc1C Amb26055384 [1,1,0,0,0,0|2,0,0]=4 6533 B11R1.182 CCOc1cc(S)ccc1F Amb25677321 [1,1,0,0,0,0|1,1,0]=4 6534 B11R1.182 CCOc1cc(S)ccc1O Amb33223760 [1,1,0,0,0,0|2,0,0]=4 6535 B11R1.182 CCOc1nc(Br)ccc1Br Amb27667188 [1,1,0,0,0,0|2,0,0]=4 6536 B11R1.182 CCOc1nc(N)ccc1Br Amb27871463 [1,1,0,0,0,0|2,0,0]=4 6537 B11R1.182 CCSc1cc(Br)ccc1Br Amb25324695 [1,1,0,0,0,0|1,0,0]=3 6538 B11R1.182 CCSc1cc(Br)ccc1C Amb25891668 [1,1,0,0,0,0|2,0,0]=4 6539 B11R1.182 CCSc1cc(Br)ccc1Cl Amb27234899 [1,1,0,0,0,0|1,1,0]=4 6540 B11R1.182 CCSc1cc(Br)ccc1F Amb26395974 [1,1,0,0,0,0|1,1,0]=4 6541 B11R1.182 CCSc1cc(Br)ccc1I Amb28182552 [1,1,0,0,0,0|1,1,0]=4 6542 B11R1.182 CCSc1cc(Br)ccc1O Amb24732310 [1,1,0,0,0,0|2,0,0]=4 6543 B11R1.182 CCSc1cc(C)ccc1C Amb27194507 [1,1,0,0,0,0|2,0,0]=4 6544 B11R1.182 CCSc1cc(C)ccc1Cl Amb25721943 [1,1,0,0,0,0|1,1,0]=4 6545 B11R1.182 CCSc1cc(C)ccc1F Amb26504011 [1,1,0,0,0,0|1,1,0]=4 6546 B11R1.182 CCSc1cc(C)ccc1I Amb25891795 [1,1,0,0,0,0|1,1,0]=4 6547 B11R1.182 CCSc1cc(C)ccc1N Amb24399329 [1,1,0,0,0,0|2,0,0]=4 6548 B11R1.182 CCSc1cc(C)ccc1O Amb26634530 [1,1,0,0,0,0|2,0,0]=4 6549 B11R1.182 CCSc1cc(Cl)ccc1Br Amb25782875 [1,1,0,0,0,0|1,0,0]=3 6550 B11R1.182 CCSc1cc(Cl)ccc1C Amb25923209 [1,1,0,0,0,0|2,0,0]=4 6551 B11R1.182 CCSc1cc(Cl)ccc1Cl Amb25250548 [1,1,0,0,0,0|1,1,0]=4 6552 B11R1.182 CCSc1cc(Cl)ccc1F Amb25891612 [1,1,0,0,0,0|1,1,0]=4 6553 B11R1.182 CCSc1cc(Cl)ccc1I Amb28185509 [1,1,0,0,0,0|1,1,0]=4 6554 B11R1.182 CCSc1cc(Cl)ccc1N Amb28048872 [1,1,0,0,0,0|2,0,0]=4 6555 B11R1.182 CCSc1cc(F)ccc1C Amb24484432 [1,1,0,0,0,0|2,0,0]=4 6556 B11R1.182 CCSc1cc(F)ccc1Cl Amb27494960 [1,1,0,0,0,0|1,1,0]=4 6557 B11R1.182 CCSc1cc(F)ccc1F Amb25352573 [1,1,0,0,0,0|1,1,0]=4 6558 B11R1.182 CCSc1cc(F)ccc1I Amb27823458 [1,1,0,0,0,0|1,1,0]=4 6559 B11R1.182 CCSc1cc(F)ccc1N Amb18961236 [1,1,0,0,0,0|2,0,0]=4 6560 B11R1.182 CCSc1cc(F)ccc1O Amb25722002 [1,1,0,0,0,0|2,0,0]=4 6561 B11R1.182 CCSc1cc(I)ccc1C Amb27868740 [1,1,0,0,0,0|2,0,0]=4 6562 B11R1.182 CCSc1cc(I)ccc1Cl Amb24379061 [1,1,0,0,0,0|1,1,0]=4 6563 B11R1.182 CCSc1cc(I)ccc1F Amb24591510 [1,1,0,0,0,0|1,1,0]=4 6564 B11R1.182 CCSc1cc(I)ccc1N Amb28253071 [1,1,0,0,0,0|2,0,0]=4 6565 B11R1.182 CCSc1cc(I)ccc1O Amb28187342 [1,1,0,0,0,0|2,0,0]=4 6566 B11R1.182 CCSc1cc(N)ccc1Br Amb25955506 [1,1,0,0,0,0|1,0,0]=3 6567 B11R1.182 CCSc1cc(N)ccc1C Amb18962632 [1,1,0,0,0,0|2,0,0]=4 6568 B11R1.182 CCSc1cc(N)ccc1Cl Amb25893012 [1,1,0,0,0,0|1,1,0]=4 6569 B11R1.182 CCSc1cc(N)ccc1N Amb26372746 [1,1,0,0,0,0|2,0,0]=4 6570 B11R1.182 CCSc1cc(N)ncc1Br Amb27490255 [1,1,0,0,0,0|2,0,0]=4 6571 B11R1.182 CCSc1cc(O)ccc1Br Amb24600972 [1,1,0,0,0,0|1,0,0]=3 6572 B11R1.182 CCSc1cc(O)ccc1F Amb24396758 [1,1,0,0,0,0|1,1,0]=4 6573 B11R1.182 CCSc1cc(O)ccc1I Amb26984357 [1,1,0,0,0,0|1,1,0]=4 6574 B11R1.182 CCSc1cc(O)ccc1N Amb26508590 [1,1,0,0,0,0|2,0,0]=4 6575 B11R1.182 CCSc1cc(O)ccc1O Amb25922682 [1,1,0,0,0,0|2,0,0]=4 6576 B11R1.182 CNCc1cc(Br)ccc1Br Amb27953575 [1,1,0,0,0,0|0,0,0]=2 6577 B11R1.182 CNCc1cc(Br)ccc1C Amb25765319 [1,1,0,0,0,0|1,0,0]=3 6578 B11R1.182 CNCc1cc(Br)ccc1Cl Amb8962203 [1,1,0,0,0,0|0,1,0]=3 6579 B11R1.182 CNCc1cc(Br)ccc1F Amb1116065 [1,1,0,0,0,0|0,1,0]=3 6580 B11R1.182 CNCc1cc(Br)ccc1F Amb13952065 [1,1,0,0,0,0|0,1,0]=3 6581 B11R1.182 CNCc1cc(Br)ccc1N Amb25055768 [1,1,0,0,0,0|1,0,0]=3 6582 B11R1.182 CNCc1cc(Br)ccc1O Amb31305183 [1,1,0,0,0,0|1,0,0]=3 6583 B11R1.182 CNCc1cc(Br)ccc1O Amb7173567 [1,1,0,0,0,0|1,0,0]=3 6584 B11R1.182 CNCc1cc(Br)cnc1Br Amb27665875 [1,1,0,0,0,0|1,0,0]=3 6585 B11R1.182 CNCc1cc(Br)cnc1Cl Amb24377459 [1,1,0,0,0,0|1,1,0]=4 6586 B11R1.182 CNCc1cc(Br)cnc1F Amb33477699 [1,1,0,0,0,0|1,1,0]=4 6587 B11R1.182 CNCc1cc(C)ccc1Br Amb28050925 [1,1,0,0,0,0|0,0,0]=2 6588 B11R1.182 CNCc1cc(C)ccc1C Amb8841273 [1,1,0,0,0,0|1,0,0]=3 6589 B11R1.182 CNCc1cc(C)ccc1Cl Amb27224686 [1,1,0,0,0,0|0,1,0]=3 6590 B11R1.182 CNCc1cc(C)ccc1F Amb18961993 [1,1,0,0,0,0|0,1,0]=3 6591 B11R1.182 CNCc1cc(C)ccc1O Amb9776245 [1,1,0,0,0,0|1,0,0]=3 6592 B11R1.182 CNCc1cc(C)cnc1N Amb27948153 [1,1,0,0,0,0|2,0,0]=4 6593 B11R1.182 CNCc1cc(Cl)ccc1Br Amb22371430 [1,1,0,0,0,0|0,0,0]=2 6594 B11R1.182 CNCc1cc(Cl)ccc1C Amb18224411 [1,1,0,0,0,0|1,0,0]=3 6595 B11R1.182 CNCc1cc(Cl)ccc1Cl Amb8853682 [1,1,0,0,0,0|0,1,0]=3 6596 B11R1.182 CNCc1cc(Cl)ccc1F Amb9214714 [1,1,0,0,0,0|0,1,0]=3 6597 B11R1.182 CNCc1cc(Cl)ccc1I Amb27218007 [1,1,0,0,0,0|0,1,0]=3 6598 B11R1.182 CNCc1cc(Cl)ccc1N Amb27475651 [1,1,0,0,0,0|1,0,0]=3 6599 B11R1.182 CNCc1cc(Cl)ccc1O Amb1113632 [1,1,0,0,0,0|1,0,0]=3 6600 B11R1.182 CNCc1cc(Cl)cnc1Cl Amb28124622 [1,1,0,0,0,0|1,1,0]=4 6601 B11R1.182 CNCc1cc(Cl)cnc1F Amb33257185 [1,1,0,0,0,0|1,1,0]=4 6602 B11R1.182 CNCc1cc(Cl)ncc1Br Amb33477761 [1,1,0,0,0,0|1,0,0]=3 6603 B11R1.182 CNCc1cc(F)ccc1Br Amb33528452 [1,1,0,0,0,0|0,0,0]=2 6604 B11R1.182 CNCc1cc(F)ccc1Br Amb6244834 [1,1,0,0,0,0|0,0,0]=2 6605 B11R1.182 CNCc1cc(F)ccc1C Amb18967157 [1,1,0,0,0,0|1,0,0]=3 6606 B11R1.182 CNCc1cc(F)ccc1C Amb24271164 [1,1,0,0,0,0|1,0,0]=3 6607 B11R1.182 CNCc1cc(F)ccc1Cl Amb22371429 [1,1,0,0,0,0|0,1,0]=3 6608 B11R1.182 CNCc1cc(F)ccc1F Amb33314323 [1,1,0,0,0,0|0,1,0]=3 6609 B11R1.182 CNCc1cc(F)ccc1F Amb8853657 [1,1,0,0,0,0|0,1,0]=3 6610 B11R1.182 CNCc1cc(F)ccc1O Amb18941476 [1,1,0,0,0,0|1,0,0]=3 6611 B11R1.182 CNCc1cc(I)ccc1Br Amb27465255 [1,1,0,0,0,0|0,0,0]=2 6612 B11R1.182 CNCc1cc(N)ncc1Br Amb27398994 [1,1,0,0,0,0|1,0,0]=3 6613 B11R1.182 CNCc1cc(N)ncc1Cl Amb27247954 [1,1,0,0,0,0|1,1,0]=4 6614 B11R1.182 CNCc1cc(O)ccc1Br Amb25867703 [1,1,0,0,0,0|0,0,0]=2 6615 B11R1.182 CNCc1cc(O)ccc1C Amb25072384 [1,1,0,0,0,0|1,0,0]=3 6616 B11R1.182 CNCc1cc(O)ccc1Cl Amb24463726 [1,1,0,0,0,0|0,1,0]=3 6617 B11R1.182 CNCc1cc(O)ccc1F Amb25071644 [1,1,0,0,0,0|0,1,0]=3 6618 B11R1.182 CNCc1cc(O)ccc1O Amb19929937 [1,1,0,0,0,0|1,0,0]=3 6619 B11R1.182 CNCc1nc(C)ccc1O Amb27775983 [1,1,0,0,0,0|2,0,0]=4 6620 B11R1.182 CNCc1nc(N)ccc1Cl Amb27847838 [1,1,0,0,0,0|1,1,0]=4 6621 B11R1.182 COCc1cc(Br)ccc1C Amb28182665 [1,1,0,0,0,0|2,0,0]=4 6622 B11R1.182 COCc1cc(Br)ccc1F Amb10839216 [1,1,0,0,0,0|1,1,0]=4 6623 B11R1.182 COCc1cc(C)ccc1O Amb18125394 [1,1,0,0,0,0|2,0,0]=4 6624 B11R1.182 COCc1cc(Cl)ccc1Br Amb25303236 [1,1,0,0,0,0|1,0,0]=3 6625 B11R1.182 COCc1cc(Cl)ccc1I Amb35697893 [1,1,0,0,0,0|1,1,0]=4 6626 B11R1.182 COCc1cc(Cl)ccc1N Amb28076591 [1,1,0,0,0,0|2,0,0]=4 6627 B11R1.182 COCc1cc(Cl)ccc1N Amb33314330 [1,1,0,0,0,0|2,0,0]=4 6628 B11R1.182 COCc1cc(F)ccc1Br Amb10839214 [1,1,0,0,0,0|1,0,0]=3 6629 B11R1.182 COCc1cc(F)ccc1N Amb33038305 [1,1,0,0,0,0|2,0,0]=4 6630 B11R1.182 COCc1cc(F)ccc1N Amb9302679 [1,1,0,0,0,0|2,0,0]=4 6631 B11R1.182 COCc1cc(N)ccc1C Amb18644477 [1,1,0,0,0,0|2,0,0]=4 6632 B11R1.182 COCc1cc(N)ccc1Cl Amb8860298 [1,1,0,0,0,0|1,1,0]=4 6633 B11R1.182 COCc1cc(N)ccc1N Amb27845406 [1,1,0,0,0,0|2,0,0]=4 6634 B11R1.182 COCc1cc(N)ccc1O Amb24065718 [1,1,0,0,0,0|2,0,0]=4 6635 B11R1.182 COCc1cc(O)ccc1N Amb26372659 [1,1,0,0,0,0|2,0,0]=4 6636 B11R1.182 CSCc1cc(Br)ccc1F Amb25886132 [1,1,0,0,0,0|1,1,0]=4 6637 B11R1.182 CSCc1cc(Br)ccc1I Amb28187324 [1,1,0,0,0,0|1,1,0]=4 6638 B11R1.182 CSCc1cc(C)ccc1Br Amb27399491 [1,1,0,0,0,0|1,0,0]=3 6639 B11R1.182 CSCc1cc(C)ccc1C Amb27768279 [1,1,0,0,0,0|2,0,0]=4 6640 B11R1.182 CSCc1cc(C)ccc1N Amb18126485 [1,1,0,0,0,0|2,0,0]=4 6641 B11R1.182 CSCc1cc(C)ccc1O Amb18126552 [1,1,0,0,0,0|2,0,0]=4 6642 B11R1.182 CSCc1cc(Cl)ccc1I Amb29864006 [1,1,0,0,0,0|1,1,0]=4 6643 B11R1.182 CSCc1cc(Cl)ccc1N Amb18129729 [1,1,0,0,0,0|2,0,0]=4 6644 B11R1.182 CSCc1cc(Cl)ccc1O Amb18650044 [1,1,0,0,0,0|2,0,0]=4 6645 B11R1.182 CSCc1cc(Cl)ncc1Br Amb27840324 [1,1,0,0,0,0|2,0,0]=4 6646 B11R1.182 CSCc1cc(F)ccc1Br Amb26879523 [1,1,0,0,0,0|1,0,0]=3 6647 B11R1.182 CSCc1cc(F)ccc1Cl Amb27256062 [1,1,0,0,0,0|1,1,0]=4 6648 B11R1.182 CSCc1cc(F)ccc1F Amb25197234 [1,1,0,0,0,0|1,1,0]=4 6649 B11R1.182 CSCc1cc(N)ccc1Cl Amb18281519 [1,1,0,0,0,0|1,1,0]=4 6650 B11R1.182 CSCc1nc(Cl)ccc1Br Amb27827304 [1,1,0,0,0,0|2,0,0]=4 6651 B11R1.182 Cc1cc(CCN)c(Cl)cn1 Amb27605357 [1,1,0,0,0,0|1,1,0]=4 6652 B11R1.182 Cc1ccc(Br)c(CC#N)c1 Amb26066766 [1,1,0,0,0,0|0,0,2]=4 6653 B11R1.182 Cc1ccc(Br)c(CC=O)c1 Amb33477539 [1,1,0,0,0,0|1,0,1]=4 6654 B11R1.182 Cc1ccc(Br)c(CCBr)c1 Amb33477523 [1,1,0,0,0,0|1,0,0]=3 6655 B11R1.182 Cc1ccc(Br)c(CCN)c1 Amb18253545 [1,1,0,0,0,0|0,0,0]=2 6656 B11R1.182 Cc1ccc(Br)c(CCO)c1 Amb33477482 [1,1,0,0,0,0|1,0,0]=3 6657 B11R1.182 Cc1ccc(Br)c(CCO)n1 Amb35752869 [1,1,0,0,0,0|2,0,0]=4 6658 B11R1.182 Cc1ccc(Br)c(CCS)c1 Amb33477910 [1,1,0,0,0,0|1,0,0]=3 6659 B11R1.182 Cc1ccc(Br)c(CNN)c1 Amb28046627 [1,1,0,0,0,0|1,0,0]=3 6660 B11R1.182 Cc1ccc(Br)c(CNO)c1 Amb33477490 [1,1,0,0,0,0|1,0,0]=3 6661 B11R1.182 Cc1ccc(Br)c(CON)c1 Amb27464746 [1,1,0,0,0,0|1,0,0]=3 6662 B11R1.182 Cc1ccc(Br)c(OCCl)c1 Amb32685631 [1,1,0,0,0,0|2,0,0]=4 6663 B11R1.182 Cc1ccc(Br)cc1CCBr Amb33450314 [1,1,0,0,0,0|2,0,0]=4 6664 B11R1.182 Cc1ccc(Br)cc1CCN Amb25315270 [1,1,0,0,0,0|1,0,0]=3 6665 B11R1.182 Cc1ccc(Br)cc1CCO Amb24659878 [1,1,0,0,0,0|2,0,0]=4 6666 B11R1.182 Cc1ccc(Br)cc1CCS Amb27823718 [1,1,0,0,0,0|2,0,0]=4 6667 B11R1.182 Cc1ccc(Br)cc1CNN Amb24487712 [1,1,0,0,0,0|2,0,0]=4 6668 B11R1.182 Cc1ccc(Br)cc1CNO Amb33478597 [1,1,0,0,0,0|2,0,0]=4 6669 B11R1.182 Cc1ccc(Br)cc1CON Amb24334627 [1,1,0,0,0,0|2,0,0]=4 6670 B11R1.182 Cc1ccc(C)c(CCBr)c1 Amb24533037 [1,1,0,0,0,0|2,0,0]=4 6671 B11R1.182 Cc1ccc(C)c(CCN)c1 Amb2720444 [1,1,0,0,0,0|1,0,0]=3 6672 B11R1.182 Cc1ccc(C)c(CCO)c1 Amb2720463 [1,1,0,0,0,0|2,0,0]=4 6673 B11R1.182 Cc1ccc(C)c(CCS)c1 Amb17400222 [1,1,0,0,0,0|2,0,0]=4 6674 B11R1.182 Cc1ccc(C)c(CC[NH3+])c1 Amb33512944 [1,1,0,0,0,0|1,0,1]=4 6675 B11R1.182 Cc1ccc(C)c(CNN)c1 Amb29838003 [1,1,0,0,0,0|2,0,0]=4 6676 B11R1.182 Cc1ccc(C)c(CNN)c1 Amb6253543 [1,1,0,0,0,0|2,0,0]=4 6677 B11R1.182 Cc1ccc(C)c(CNO)c1 Amb27656587 [1,1,0,0,0,0|2,0,0]=4 6678 B11R1.182 Cc1ccc(C)c(CON)c1 Amb17091432 [1,1,0,0,0,0|2,0,0]=4 6679 B11R1.182 Cc1ccc(Cl)c(CCBr)c1 Amb26045630 [1,1,0,0,0,0|1,1,0]=4 6680 B11R1.182 Cc1ccc(Cl)c(CCCl)c1 Amb27758211 [1,1,0,0,0,0|1,1,0]=4 6681 B11R1.182 Cc1ccc(Cl)c(CCN)c1 Amb17198911 [1,1,0,0,0,0|0,1,0]=3 6682 B11R1.182 Cc1ccc(Cl)c(CCO)c1 Amb24373319 [1,1,0,0,0,0|1,1,0]=4 6683 B11R1.182 Cc1ccc(Cl)c(CCS)c1 Amb33413750 [1,1,0,0,0,0|1,1,0]=4 6684 B11R1.182 Cc1ccc(Cl)c(CNN)c1 Amb27455163 [1,1,0,0,0,0|1,1,0]=4 6685 B11R1.182 Cc1ccc(Cl)c(CNO)c1 Amb33256247 [1,1,0,0,0,0|1,1,0]=4 6686 B11R1.182 Cc1ccc(Cl)c(CON)c1 Amb26327838 [1,1,0,0,0,0|1,1,0]=4 6687 B11R1.182 Cc1ccc(Cl)cc1CCN Amb17470478 [1,1,0,0,0,0|1,0,0]=3 6688 B11R1.182 Cc1ccc(Cl)cc1CCO Amb24513879 [1,1,0,0,0,0|2,0,0]=4 6689 B11R1.182 Cc1ccc(Cl)cc1CCS Amb24411432 [1,1,0,0,0,0|2,0,0]=4 6690 B11R1.182 Cc1ccc(Cl)cc1CNN Amb27854401 [1,1,0,0,0,0|2,0,0]=4 6691 B11R1.182 Cc1ccc(Cl)nc1CCN Amb27171541 [1,1,0,0,0,0|2,0,0]=4 6692 B11R1.182 Cc1ccc(F)c(CCBr)c1 Amb25958048 [1,1,0,0,0,0|1,1,0]=4 6693 B11R1.182 Cc1ccc(F)c(CCN)c1 Amb33540282 [1,1,0,0,0,0|0,1,0]=3 6694 B11R1.182 Cc1ccc(F)c(CCO)c1 Amb18791566 [1,1,0,0,0,0|1,1,0]=4 6695 B11R1.182 Cc1ccc(F)c(CCS)c1 Amb33225257 [1,1,0,0,0,0|1,1,0]=4 6696 B11R1.182 Cc1ccc(F)c(CNN)c1 Amb26657475 [1,1,0,0,0,0|1,1,0]=4 6697 B11R1.182 Cc1ccc(F)c(CNO)c1 Amb26018730 [1,1,0,0,0,0|1,1,0]=4 6698 B11R1.182 Cc1ccc(F)c(CON)c1 Amb25087230 [1,1,0,0,0,0|1,1,0]=4 6699 B11R1.182 Cc1ccc(F)cc1CCBr Amb25887036 [1,1,0,0,0,0|2,0,0]=4 6700 B11R1.182 Cc1ccc(F)cc1CCCl Amb18794738 [1,1,0,0,0,0|2,0,0]=4 6701 B11R1.182 Cc1ccc(F)cc1CCN Amb18287500 [1,1,0,0,0,0|1,0,0]=3 6702 B11R1.182 Cc1ccc(F)cc1CCO Amb18791564 [1,1,0,0,0,0|2,0,0]=4 6703 B11R1.182 Cc1ccc(F)cc1CCS Amb24746647 [1,1,0,0,0,0|2,0,0]=4 6704 B11R1.182 Cc1ccc(F)cc1CNN Amb18177328 [1,1,0,0,0,0|2,0,0]=4 6705 B11R1.182 Cc1ccc(F)cc1CNO Amb25040812 [1,1,0,0,0,0|2,0,0]=4 6706 B11R1.182 Cc1ccc(F)cc1CON Amb25251205 [1,1,0,0,0,0|2,0,0]=4 6707 B11R1.182 Cc1ccc(F)nc1CCN Amb27241728 [1,1,0,0,0,0|2,0,0]=4 6708 B11R1.182 Cc1ccc(I)c(CCN)c1 Amb27783816 [1,1,0,0,0,0|0,1,0]=3 6709 B11R1.182 Cc1ccc(N)cc1CCO Amb27786984 [1,1,0,0,0,0|2,0,0]=4 6710 B11R1.182 Cc1ccc(O)c(CCBr)c1 Amb33009011 [1,1,0,0,0,0|2,0,0]=4 6711 B11R1.182 Cc1ccc(O)c(CCN)c1 Amb18054566 [1,1,0,0,0,0|1,0,0]=3 6712 B11R1.182 Cc1ccc(O)c(CCO)c1 Amb27954032 [1,1,0,0,0,0|2,0,0]=4 6713 B11R1.182 Cc1ccc(O)c(CCS)c1 Amb33267898 [1,1,0,0,0,0|2,0,0]=4 6714 B11R1.182 Cc1ccc(O)c(CNN)c1 Amb24716621 [1,1,0,0,0,0|2,0,0]=4 6715 B11R1.182 Cc1ccc(O)c(CNO)c1 Amb27857349 [1,1,0,0,0,0|2,0,0]=4 6716 B11R1.182 Cc1ccc(O)c(CON)c1 Amb33269957 [1,1,0,0,0,0|2,0,0]=4 6717 B11R1.182 Cc1ccc(O)cc1CCN Amb25331992 [1,1,0,0,0,0|1,0,0]=3 6718 B11R1.182 Cc1cnc(Cl)cc1CCN Amb27223092 [1,1,0,0,0,0|2,0,0]=4 6719 B11R1.182 Cc1ncc(Br)c(CCN)n1 Amb28066853 [1,1,0,0,0,0|2,0,0]=4 6720 B11R1.182 Cc1ncc(Cl)cc1CCN Amb28145836 [1,1,0,0,0,0|2,0,0]=4 6721 B11R1.182 ClCCc1cc(Br)ccc1Br Amb33098642 [1,1,0,0,0,0|1,0,0]=3 6722 B11R1.182 ClCCc1cc(Cl)ccc1Cl Amb27413979 [1,1,0,0,0,0|1,1,0]=4 6723 B11R1.182 ClCCc1cc(Cl)ccc1I Amb35697868 [1,1,0,0,0,0|1,1,0]=4 6724 B11R1.182 ClCOc1cc(Cl)ccc1Br Amb32685632 [1,1,0,0,0,0|2,0,0]=4 6725 B11R1.182 Clc1ccc(Cl)c(CCBr)c1 Amb25762993 [1,1,0,0,0,0|1,1,0]=4 6726 B11R1.182 Fc1ccc(Br)c(CCBr)c1 Amb26862733 [1,1,0,0,0,0|1,0,0]=3 6727 B11R1.182 Fc1ccc(Br)c(CCS)c1 Amb33008794 [1,1,0,0,0,0|1,0,0]=3 6728 B11R1.182 Fc1ccc(Br)c(OCCl)c1 Amb26455480 [1,1,0,0,0,0|2,0,0]=4 6729 B11R1.182 Fc1ccc(Br)cc1CCBr Amb25151334 [1,1,0,0,0,0|1,1,0]=4 6730 B11R1.182 Fc1ccc(Br)cc1CCS Amb28201901 [1,1,0,0,0,0|1,1,0]=4 6731 B11R1.182 Fc1ccc(Cl)c(CCBr)c1 Amb24463828 [1,1,0,0,0,0|1,1,0]=4 6732 B11R1.182 Fc1ccc(Cl)c(CCCl)c1 Amb27466296 [1,1,0,0,0,0|1,1,0]=4 6733 B11R1.182 Fc1ccc(Cl)c(CCS)c1 Amb33059177 [1,1,0,0,0,0|1,1,0]=4 6734 B11R1.182 Fc1ccc(Cl)cc1CCBr Amb18228348 [1,1,0,0,0,0|1,1,0]=4 6735 B11R1.182 Fc1ccc(Cl)cc1CCCl Amb18224853 [1,1,0,0,0,0|1,1,0]=4 6736 B11R1.182 Fc1ccc(Cl)cc1CCS Amb26921549 [1,1,0,0,0,0|1,1,0]=4 6737 B11R1.182 Fc1ccc(F)c(CCBr)c1 Amb26647474 [1,1,0,0,0,0|1,1,0]=4 6738 B11R1.182 Fc1ccc(F)c(CCCl)c1 Amb18180626 [1,1,0,0,0,0|1,1,0]=4 6739 B11R1.182 Fc1ccc(F)c(CCS)c1 Amb17470504 [1,1,0,0,0,0|1,1,0]=4 6740 B11R1.182 N#CCc1cc(Br)ccc1Br Amb21962794 [1,1,0,0,0,0|0,0,2]=4 6741 B11R1.182 N#CCc1cc(Cl)ccc1Br Amb22232529 [1,1,0,0,0,0|0,0,2]=4 6742 B11R1.182 N#CCc1cc(F)ccc1Br Amb6245764 [1,1,0,0,0,0|0,0,2]=4 6743 B11R1.182 N#CCc1cc(I)ccc1Br Amb22735948 [1,1,0,0,0,0|0,0,2]=4 6744 B11R1.182 N#CCc1cc(O)ccc1Br Amb26406083 [1,1,0,0,0,0|0,0,2]=4 6745 B11R1.182 NCCC1=CC(Br)=CNC1=O Amb33483070 [1,1,0,0,0,0|2,0,0]=4 6746 B11R1.182 NCCC1=CC(Br)=CNC1=O Amb33483514 [1,1,0,0,0,0|2,0,0]=4 6747 B11R1.182 NCCN1C=C(Br)C=CC1=O Amb18030465 [1,1,0,0,0,0|2,0,0]=4 6748 B11R1.182 NCCN1C=C(Br)C=CC1=O Amb28960299 [1,1,0,0,0,0|2,0,0]=4 6749 B11R1.182 NCCN1C=C(Cl)C=CC1=O Amb18030464 [1,1,0,0,0,0|2,0,0]=4 6750 B11R1.182 NCCN1C=C(F)C=CC1=O Amb18542932 [1,1,0,0,0,0|2,0,0]=4 6751 B11R1.182 NCCc1cc(Br)ccc1Br Amb17198921 [1,1,0,0,0,0|0,0,0]=2 6752 B11R1.182 NCCc1cc(Br)ccc1Cl Amb25947838 [1,1,0,0,0,0|0,1,0]=3 6753 B11R1.182 NCCc1cc(Br)ccc1F Amb6247780 [1,1,0,0,0,0|0,1,0]=3 6754 B11R1.182 NCCc1cc(Br)ccc1O Amb28398000 [1,1,0,0,0,0|1,0,0]=3 6755 B11R1.182 NCCc1cc(Br)cnc1Br Amb33482250 [1,1,0,0,0,0|1,0,0]=3 6756 B11R1.182 NCCc1cc(Br)cnc1Cl Amb28289528 [1,1,0,0,0,0|1,1,0]=4 6757 B11R1.182 NCCc1cc(Br)cnc1F Amb33477683 [1,1,0,0,0,0|1,1,0]=4 6758 B11R1.182 NCCc1cc(Cl)ccc1Br Amb22059800 [1,1,0,0,0,0|0,0,0]=2 6759 B11R1.182 NCCc1cc(Cl)ccc1Br Amb33550233 [1,1,0,0,0,0|0,0,0]=2 6760 B11R1.182 NCCc1cc(Cl)ccc1Cl Amb17198798 [1,1,0,0,0,0|0,1,0]=3 6761 B11R1.182 NCCc1cc(Cl)ccc1Cl Amb19374210 [1,1,0,0,0,0|0,1,0]=3 6762 B11R1.182 NCCc1cc(Cl)ccc1F Amb18243556 [1,1,0,0,0,0|0,1,0]=3 6763 B11R1.182 NCCc1cc(Cl)ccc1I Amb28136903 [1,1,0,0,0,0|0,1,0]=3 6764 B11R1.182 NCCc1cc(Cl)ccc1N Amb26439511 [1,1,0,0,0,0|1,0,0]=3 6765 B11R1.182 NCCc1cc(Cl)ccc1O Amb5761080 [1,1,0,0,0,0|1,0,0]=3 6766 B11R1.182 NCCc1cc(Cl)cnc1F Amb33256802 [1,1,0,0,0,0|1,1,0]=4 6767 B11R1.182 NCCc1cc(Cl)ncc1Br Amb25212522 [1,1,0,0,0,0|1,0,0]=3 6768 B11R1.182 NCCc1cc(Cl)ncc1F Amb28203265 [1,1,0,0,0,0|1,1,0]=4 6769 B11R1.182 NCCc1cc(F)ccc1Br Amb10067805 [1,1,0,0,0,0|0,0,0]=2 6770 B11R1.182 NCCc1cc(F)ccc1Cl Amb18197847 [1,1,0,0,0,0|0,1,0]=3 6771 B11R1.182 NCCc1cc(F)ccc1F Amb8945113 [1,1,0,0,0,0|0,1,0]=3 6772 B11R1.182 NCCc1cc(F)ccc1I Amb27948338 [1,1,0,0,0,0|0,1,0]=3 6773 B11R1.182 NCCc1cc(F)ccc1O Amb18555152 [1,1,0,0,0,0|1,0,0]=3 6774 B11R1.182 NCCc1cc(F)cnc1Cl Amb25049558 [1,1,0,0,0,0|1,1,0]=4 6775 B11R1.182 NCCc1cc(F)ncc1F Amb28139969 [1,1,0,0,0,0|1,1,0]=4 6776 B11R1.182 NCCc1cc(I)ccc1F Amb27986108 [1,1,0,0,0,0|0,1,0]=3 6777 B11R1.182 NCCc1cc(I)ccc1O Amb25938897 [1,1,0,0,0,0|1,0,0]=3 6778 B11R1.182 NCCc1cc(N)ccc1Cl Amb33339229 [1,1,0,0,0,0|0,1,0]=3 6779 B11R1.182 NCCc1cc(O)ccc1Br Amb22755934 [1,1,0,0,0,0|0,0,0]=2 6780 B11R1.182 NCCc1cc(O)ccc1Br Amb33620377 [1,1,0,0,0,0|0,0,0]=2 6781 B11R1.182 NCCc1cc(O)ccc1Cl Amb28120456 [1,1,0,0,0,0|0,1,0]=3 6782 B11R1.182 NCCc1cc(O)ccc1F Amb24085162 [1,1,0,0,0,0|0,1,0]=3 6783 B11R1.182 NCCc1cc(O)ccc1O Amb17593832 [1,1,0,0,0,0|1,0,0]=3 6784 B11R1.182 NCCc1nc(Br)ccc1F Amb27786845 [1,1,0,0,0,0|1,1,0]=4 6785 B11R1.182 NCCc1nc(Cl)ccc1Br Amb27790893 [1,1,0,0,0,0|1,0,0]=3 6786 B11R1.182 NCCc1nc(Cl)ccc1F Amb27171402 [1,1,0,0,0,0|1,1,0]=4 6787 B11R1.182 NNCc1cc(Br)ccc1Br Amb25893605 [1,1,0,0,0,0|1,0,0]=3 6788 B11R1.182 NNCc1cc(Br)ccc1Cl Amb8962109 [1,1,0,0,0,0|1,1,0]=4 6789 B11R1.182 NNCc1cc(Br)ccc1F Amb13951985 [1,1,0,0,0,0|1,1,0]=4 6790 B11R1.182 NNCc1cc(Br)ccc1F Amb33624822 [1,1,0,0,0,0|1,1,0]=4 6791 B11R1.182 NNCc1cc(Br)ccc1F Amb6244911 [1,1,0,0,0,0|1,1,0]=4 6792 B11R1.182 NNCc1cc(Br)ccc1O Amb19664511 [1,1,0,0,0,0|2,0,0]=4 6793 B11R1.182 NNCc1cc(Br)cnc1Br Amb33008824 [1,1,0,0,0,0|2,0,0]=4 6794 B11R1.182 NNCc1cc(Cl)ccc1Br Amb24713745 [1,1,0,0,0,0|1,0,0]=3 6795 B11R1.182 NNCc1cc(Cl)ccc1Br Amb33624198 [1,1,0,0,0,0|1,0,0]=3 6796 B11R1.182 NNCc1cc(Cl)ccc1Cl Amb32952902 [1,1,0,0,0,0|1,1,0]=4 6797 B11R1.182 NNCc1cc(Cl)ccc1Cl Amb6245290 [1,1,0,0,0,0|1,1,0]=4 6798 B11R1.182 NNCc1cc(Cl)ccc1F Amb22011753 [1,1,0,0,0,0|1,1,0]=4 6799 B11R1.182 NNCc1cc(Cl)ccc1F Amb30633532 [1,1,0,0,0,0|1,1,0]=4 6800 B11R1.182 NNCc1cc(Cl)ccc1I Amb35697576 [1,1,0,0,0,0|1,1,0]=4 6801 B11R1.182 NNCc1cc(Cl)ccc1O Amb19664545 [1,1,0,0,0,0|2,0,0]=4 6802 B11R1.182 NNCc1cc(Cl)ncc1Br Amb33477875 [1,1,0,0,0,0|2,0,0]=4 6803 B11R1.182 NNCc1cc(F)ccc1Br Amb6248605 [1,1,0,0,0,0|1,0,0]=3 6804 B11R1.182 NNCc1cc(F)ccc1Cl Amb27391597 [1,1,0,0,0,0|1,1,0]=4 6805 B11R1.182 NNCc1cc(F)ccc1Cl Amb33625211 [1,1,0,0,0,0|1,1,0]=4 6806 B11R1.182 NNCc1cc(F)ccc1F Amb20669064 [1,1,0,0,0,0|1,1,0]=4 6807 B11R1.182 NNCc1cc(F)ccc1F Amb6269657 [1,1,0,0,0,0|1,1,0]=4 6808 B11R1.182 NNCc1cc(F)ccc1O Amb24529552 [1,1,0,0,0,0|2,0,0]=4 6809 B11R1.182 NNCc1cc(O)ccc1Br Amb33450357 [1,1,0,0,0,0|1,0,0]=3 6810 B11R1.182 NNCc1cc(O)ccc1O Amb33268917 [1,1,0,0,0,0|2,0,0]=4 6811 B11R1.182 NOCc1cc(Br)ccc1Br Amb33331353 [1,1,0,0,0,0|1,0,0]=3 6812 B11R1.182 NOCc1cc(Br)ccc1Cl Amb27184150 [1,1,0,0,0,0|1,1,0]=4 6813 B11R1.182 NOCc1cc(Br)ccc1F Amb27245798 [1,1,0,0,0,0|1,1,0]=4 6814 B11R1.182 NOCc1cc(Br)ccc1O Amb33333221 [1,1,0,0,0,0|2,0,0]=4 6815 B11R1.182 NOCc1cc(Br)cnc1Br Amb33008826 [1,1,0,0,0,0|2,0,0]=4 6816 B11R1.182 NOCc1cc(Cl)ccc1Br Amb25681930 [1,1,0,0,0,0|1,0,0]=3 6817 B11R1.182 NOCc1cc(Cl)ccc1Cl Amb21929113 [1,1,0,0,0,0|1,1,0]=4 6818 B11R1.182 NOCc1cc(Cl)ccc1Cl Amb25039792 [1,1,0,0,0,0|1,1,0]=4 6819 B11R1.182 NOCc1cc(Cl)ccc1F Amb25061805 [1,1,0,0,0,0|1,1,0]=4 6820 B11R1.182 NOCc1cc(Cl)ccc1O Amb33052624 [1,1,0,0,0,0|2,0,0]=4 6821 B11R1.182 NOCc1cc(Cl)ncc1Br Amb33477862 [1,1,0,0,0,0|2,0,0]=4 6822 B11R1.182 NOCc1cc(F)ccc1Br Amb26321935 [1,1,0,0,0,0|1,0,0]=3 6823 B11R1.182 NOCc1cc(F)ccc1Cl Amb25691275 [1,1,0,0,0,0|1,1,0]=4 6824 B11R1.182 NOCc1cc(F)ccc1F Amb24652032 [1,1,0,0,0,0|1,1,0]=4 6825 B11R1.182 NOCc1cc(F)ccc1O Amb33379923 [1,1,0,0,0,0|2,0,0]=4 6826 B11R1.182 NOCc1cc(I)ccc1F Amb27859493 [1,1,0,0,0,0|1,1,0]=4 6827 B11R1.182 NOCc1cc(O)ccc1Br Amb33450345 [1,1,0,0,0,0|1,0,0]=3 6828 B11R1.182 NOCc1cc(O)ccc1O Amb33268911 [1,1,0,0,0,0|2,0,0]=4 6829 B11R1.182 Nc1ccc(Br)cc1CCO Amb27784896 [1,1,0,0,0,0|2,0,0]=4 6830 B11R1.182 Nc1ccc(N)c(CCO)c1 Amb8387071 [1,1,0,0,0,0|2,0,0]=4 6831 B11R1.182 Nc1ccc(O)c(CCO)c1 Amb27823127 [1,1,0,0,0,0|2,0,0]=4 6832 B11R1.182 O=CCc1cc(Cl)ccc1Br Amb22753505 [1,1,0,0,0,0|1,0,1]=4 6833 B11R1.182 O=CCc1cc(F)ccc1Br Amb28285968 [1,1,0,0,0,0|1,0,1]=4 6834 B11R1.182 O=CCc1cc(O)ccc1Br Amb33451008 [1,1,0,0,0,0|1,0,1]=4 6835 B11R1.182 OCCc1cc(Br)ccc1Br Amb26059595 [1,1,0,0,0,0|1,0,0]=3 6836 B11R1.182 OCCc1cc(Br)ccc1Cl Amb25790339 [1,1,0,0,0,0|1,1,0]=4 6837 B11R1.182 OCCc1cc(Br)ccc1F Amb25909582 [1,1,0,0,0,0|1,1,0]=4 6838 B11R1.182 OCCc1cc(Br)ccc1O Amb28240563 [1,1,0,0,0,0|2,0,0]=4 6839 B11R1.182 OCCc1cc(Br)cnc1Br Amb33008857 [1,1,0,0,0,0|2,0,0]=4 6840 B11R1.182 OCCc1cc(Cl)ccc1Br Amb27447543 [1,1,0,0,0,0|1,0,0]=3 6841 B11R1.182 OCCc1cc(Cl)ccc1Cl Amb6298204 [1,1,0,0,0,0|1,1,0]=4 6842 B11R1.182 OCCc1cc(Cl)ccc1F Amb18862908 [1,1,0,0,0,0|1,1,0]=4 6843 B11R1.182 OCCc1cc(Cl)ccc1I Amb35716997 [1,1,0,0,0,0|1,1,0]=4 6844 B11R1.182 OCCc1cc(Cl)ccc1O Amb33052625 [1,1,0,0,0,0|2,0,0]=4 6845 B11R1.182 OCCc1cc(Cl)ncc1Br Amb33477830 [1,1,0,0,0,0|2,0,0]=4 6846 B11R1.182 OCCc1cc(F)ccc1Br Amb22753532 [1,1,0,0,0,0|1,0,0]=3 6847 B11R1.182 OCCc1cc(F)ccc1Cl Amb26465671 [1,1,0,0,0,0|1,1,0]=4 6848 B11R1.182 OCCc1cc(F)ccc1F Amb18791914 [1,1,0,0,0,0|1,1,0]=4 6849 B11R1.182 OCCc1cc(F)ccc1O Amb33380284 [1,1,0,0,0,0|2,0,0]=4 6850 B11R1.182 OCCc1cc(O)ccc1Br Amb24570872 [1,1,0,0,0,0|1,0,0]=3 6851 B11R1.182 OCCc1cc(O)ccc1O Amb22751348 [1,1,0,0,0,0|2,0,0]=4 6852 B11R1.182 ONCc1cc(Br)ccc1Br Amb33337617 [1,1,0,0,0,0|1,0,0]=3 6853 B11R1.182 ONCc1cc(Br)ccc1Cl Amb26057077 [1,1,0,0,0,0|1,1,0]=4 6854 B11R1.182 ONCc1cc(Br)ccc1F Amb25150243 [1,1,0,0,0,0|1,1,0]=4 6855 B11R1.182 ONCc1cc(Br)ccc1O Amb25147981 [1,1,0,0,0,0|2,0,0]=4 6856 B11R1.182 ONCc1cc(Br)cnc1Br Amb33008831 [1,1,0,0,0,0|2,0,0]=4 6857 B11R1.182 ONCc1cc(Cl)ccc1Br Amb27478799 [1,1,0,0,0,0|1,0,0]=3 6858 B11R1.182 ONCc1cc(Cl)ccc1Cl Amb26442715 [1,1,0,0,0,0|1,1,0]=4 6859 B11R1.182 ONCc1cc(Cl)ccc1F Amb26626335 [1,1,0,0,0,0|1,1,0]=4 6860 B11R1.182 ONCc1cc(Cl)ccc1O Amb26500190 [1,1,0,0,0,0|2,0,0]=4 6861 B11R1.182 ONCc1cc(Cl)ncc1Br Amb33477472 [1,1,0,0,0,0|2,0,0]=4 6862 B11R1.182 ONCc1cc(F)ccc1Br Amb25288770 [1,1,0,0,0,0|1,0,0]=3 6863 B11R1.182 ONCc1cc(F)ccc1F Amb26506862 [1,1,0,0,0,0|1,1,0]=4 6864 B11R1.182 ONCc1cc(F)ccc1O Amb25056319 [1,1,0,0,0,0|2,0,0]=4 6865 B11R1.182 ONCc1cc(O)ccc1Br Amb24425348 [1,1,0,0,0,0|1,0,0]=3 6866 B11R1.182 ONCc1cc(O)ccc1O Amb26476526 [1,1,0,0,0,0|2,0,0]=4 6867 B11R1.182 Oc1ccc(Br)c(CCBr)c1 Amb33386640 [1,1,0,0,0,0|1,0,0]=3 6868 B11R1.182 Oc1ccc(Br)c(CCS)c1 Amb33387010 [1,1,0,0,0,0|1,0,0]=3 6869 B11R1.182 Oc1ccc(Br)cc1CCBr Amb33333275 [1,1,0,0,0,0|2,0,0]=4 6870 B11R1.182 Oc1ccc(Br)cc1CCS Amb33333971 [1,1,0,0,0,0|2,0,0]=4 6871 B11R1.182 Oc1ccc(Cl)cc1CCBr Amb33477190 [1,1,0,0,0,0|2,0,0]=4 6872 B11R1.182 Oc1ccc(Cl)cc1CCS Amb33261203 [1,1,0,0,0,0|2,0,0]=4 6873 B11R1.182 Oc1ccc(F)cc1CCBr Amb33387909 [1,1,0,0,0,0|2,0,0]=4 6874 B11R1.182 Oc1ccc(F)cc1CCS Amb33379206 [1,1,0,0,0,0|2,0,0]=4 6875 B11R1.182 Oc1ccc(O)c(CCBr)c1 Amb25028166 [1,1,0,0,0,0|2,0,0]=4 6876 B11R1.182 Oc1ccc(O)c(CCS)c1 Amb22388692 [1,1,0,0,0,0|2,0,0]=4 6877 B11R1.182 SCCc1cc(Br)ccc1Cl Amb33386522 [1,1,0,0,0,0|1,1,0]=4 6878 B11R1.182 SCCc1cc(Cl)ccc1Br Amb33478279 [1,1,0,0,0,0|1,0,0]=3 6879 B11R1.182 SCCc1cc(Cl)ccc1Cl Amb33407753 [1,1,0,0,0,0|1,1,0]=4 6880 B11R1.182 SCCc1cc(Cl)ncc1Br Amb33478600 [1,1,0,0,0,0|2,0,0]=4 6881 B11R1.182 [C-]#[N+]Cc1cc(Br)ccc1Br Amb33331344 [1,1,0,0,0,0|0,0,2]=4 6882 B11R1.182 [C-]#[N+]Cc1cc(C)ccc1Br Amb33477501 [1,1,0,0,0,0|0,0,2]=4 6883 B11R1.182 [C-]#[N+]Cc1cc(Cl)ccc1Br Amb33478225 [1,1,0,0,0,0|0,0,2]=4 6884 B11R1.182 [C-]#[N+]Cc1cc(F)ccc1Br Amb33008516 [1,1,0,0,0,0|0,0,2]=4 6885 B11R1.222 C#CC(C)c1ccccc1Br Amb33387638 [1,1,0,0,0,0|0,0,2]=4 6886 B11R1.222 C#CC(N)c1ccccc1Br Amb23448711 [1,1,0,0,0,0|0,0,2]=4 6887 B11R1.222 C#CC(O)c1ccccc1Br Amb8392584 [1,1,0,0,0,0|0,0,2]=4 6888 B11R1.222 C#C[C@@H](O)c1ccccc1Br Amb27409743 [1,1,0,0,0,0|0,0,2]=4 6889 B11R1.222 C#C[C@H](O)c1ccccc1Br Amb27647996 [1,1,0,0,0,0|0,0,2]=4 6890 B11R1.222 C=C(CBr)c1ccccc1Br Amb33388003 [1,1,0,0,0,0|1,0,1]=4 6891 B11R1.222 C=C(CCl)c1ccccc1Br Amb33388005 [1,1,0,0,0,0|1,0,1]=4 6892 B11R1.222 C=C(CN)c1ccccc1Br Amb33388495 [1,1,0,0,0,0|0,0,1]=3 6893 B11R1.222 C=C(CN)c1ccccc1C Amb18251307 [1,1,0,0,0,0|1,0,1]=4 6894 B11R1.222 C=C(CN)c1ccccc1Cl Amb18251924 [1,1,0,0,0,0|0,1,1]=4 6895 B11R1.222 C=C(CN)c1ccccc1F Amb18908418 [1,1,0,0,0,0|0,1,1]=4 6896 B11R1.222 C=C(CN)c1ccccc1O Amb33196166 [1,1,0,0,0,0|1,0,1]=4 6897 B11R1.222 C=C(CN)c1cccnc1Br Amb33387806 [1,1,0,0,0,0|1,0,1]=4 6898 B11R1.222 C=C(CN)c1ccncc1Br Amb33388640 [1,1,0,0,0,0|1,0,1]=4 6899 B11R1.222 C=C(CN)c1ncccc1Br Amb33336098 [1,1,0,0,0,0|1,0,1]=4 6900 B11R1.222 C=CC(N)c1ccccc1Br Amb25856652 [1,1,0,0,0,0|0,0,2]=4 6901 B11R1.222 C=CC(O)c1ccccc1Br Amb26445116 [1,1,0,0,0,0|0,0,2]=4 6902 B11R1.222 C=C[C@@H](N)c1ccccc1Br Amb27412001 [1,1,0,0,0,0|0,0,2]=4 6903 B11R1.222 C=C[C@@H](O)c1ccccc1Br Amb28410436 [1,1,0,0,0,0|0,0,2]=4 6904 B11R1.222 CC(C#N)c1ccccc1Br Amb18131118 [1,1,0,0,0,0|0,0,2]=4 6905 B11R1.222 CC(CBr)c1ccccc1Br Amb25875710 [1,1,0,0,0,0|1,0,0]=3 6906 B11R1.222 CC(CBr)c1ccccc1Cl Amb25148944 [1,1,0,0,0,0|1,1,0]=4 6907 B11R1.222 CC(CBr)c1ccccc1F Amb25890520 [1,1,0,0,0,0|1,1,0]=4 6908 B11R1.222 CC(CBr)c1ccccc1O Amb33334192 [1,1,0,0,0,0|2,0,0]=4 6909 B11R1.222 CC(CBr)c1cccnc1Br Amb33387809 [1,1,0,0,0,0|2,0,0]=4 6910 B11R1.222 CC(CBr)c1ccncc1Br Amb33388614 [1,1,0,0,0,0|2,0,0]=4 6911 B11R1.222 CC(CBr)c1ncccc1Br Amb33336056 [1,1,0,0,0,0|2,0,0]=4 6912 B11R1.222 CC(CCl)c1ccccc1Br Amb25055326 [1,1,0,0,0,0|1,0,0]=3 6913 B11R1.222 CC(CCl)c1ccccc1Cl Amb27805648 [1,1,0,0,0,0|1,1,0]=4 6914 B11R1.222 CC(CCl)c1ccccc1F Amb25098050 [1,1,0,0,0,0|1,1,0]=4 6915 B11R1.222 CC(CCl)c1ccccc1I Amb28292839 [1,1,0,0,0,0|1,1,0]=4 6916 B11R1.222 CC(CN)N1C=CC=CC1=O Amb18542686 [1,1,0,0,0,0|2,0,0]=4 6917 B11R1.222 CC(CN)c1ccccc1Br Amb18174811 [1,1,0,0,0,0|0,0,0]=2 6918 B11R1.222 CC(CN)c1ccccc1Cl Amb17232735 [1,1,0,0,0,0|0,1,0]=3 6919 B11R1.222 CC(CN)c1ccccc1F Amb8950126 [1,1,0,0,0,0|0,1,0]=3 6920 B11R1.222 CC(CN)c1ccccc1I Amb24558935 [1,1,0,0,0,0|0,1,0]=3 6921 B11R1.222 CC(CN)c1ccccc1O Amb25100841 [1,1,0,0,0,0|1,0,0]=3 6922 B11R1.222 CC(CN)c1cccnc1Br Amb33387428 [1,1,0,0,0,0|1,0,0]=3 6923 B11R1.222 CC(CN)c1cccnc1Cl Amb33256917 [1,1,0,0,0,0|1,1,0]=4 6924 B11R1.222 CC(CN)c1cccnc1F Amb33378335 [1,1,0,0,0,0|1,1,0]=4 6925 B11R1.222 CC(CN)c1ccncc1Br Amb33389527 [1,1,0,0,0,0|1,0,0]=3 6926 B11R1.222 CC(CN)c1ccncc1Cl Amb33413506 [1,1,0,0,0,0|1,1,0]=4 6927 B11R1.222 CC(CN)c1ccncc1F Amb25677090 [1,1,0,0,0,0|1,1,0]=4 6928 B11R1.222 CC(CN)c1ncccc1Br Amb24486134 [1,1,0,0,0,0|1,0,0]=3 6929 B11R1.222 CC(CN)c1ncccc1F Amb33502825 [1,1,0,0,0,0|1,1,0]=4 6930 B11R1.222 CC(CO)c1ccccc1Br Amb24453441 [1,1,0,0,0,0|1,0,0]=3 6931 B11R1.222 CC(CO)c1ccccc1Cl Amb27594243 [1,1,0,0,0,0|1,1,0]=4 6932 B11R1.222 CC(CO)c1ccccc1F Amb26648146 [1,1,0,0,0,0|1,1,0]=4 6933 B11R1.222 CC(CO)c1ccccc1N Amb27433927 [1,1,0,0,0,0|2,0,0]=4 6934 B11R1.222 CC(CO)c1ccccc1O Amb27804491 [1,1,0,0,0,0|2,0,0]=4 6935 B11R1.222 CC(CO)c1ccncc1Br Amb33620376 [1,1,0,0,0,0|2,0,0]=4 6936 B11R1.222 CC(NO)c1ccccc1F Amb27162764 [1,1,0,0,0,0|1,1,0]=4 6937 B11R1.222 CC(ON)c1ccccc1Br Amb33388419 [1,1,0,0,0,0|1,0,0]=3 6938 B11R1.222 CC(ON)c1ccccc1Cl Amb33052586 [1,1,0,0,0,0|1,1,0]=4 6939 B11R1.222 CC(ON)c1ccccc1F Amb33361486 [1,1,0,0,0,0|1,1,0]=4 6940 B11R1.222 CC(ON)c1ccccc1O Amb33196414 [1,1,0,0,0,0|2,0,0]=4 6941 B11R1.222 CC(ON)c1cccnc1Br Amb33387778 [1,1,0,0,0,0|2,0,0]=4 6942 B11R1.222 CC(ON)c1ccncc1Br Amb33388683 [1,1,0,0,0,0|2,0,0]=4 6943 B11R1.222 CC(ON)c1ncccc1Br Amb33336077 [1,1,0,0,0,0|2,0,0]=4 6944 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [1,1,0,0,0,0|0,0,1]=3 6945 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [1,1,0,0,0,0|1,0,1]=4 6946 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [1,1,0,0,0,0|0,1,1]=4 6947 B11R1.222 CCC(=O)c1ccccc1F Amb4605916 [1,1,0,0,0,0|0,1,1]=4 6948 B11R1.222 CCC(=O)c1ccccc1I Amb26353010 [1,1,0,0,0,0|0,1,1]=4 6949 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [1,1,0,0,0,0|1,0,1]=4 6950 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [1,1,0,0,0,0|1,0,1]=4 6951 B11R1.222 CCC(Br)c1ccccc1F Amb25990504 [1,1,0,0,0,0|0,1,0]=3 6952 B11R1.222 CCC(Br)c1cccnc1Br Amb27662156 [1,1,0,0,0,0|1,0,0]=3 6953 B11R1.222 CCC(Br)c1cccnc1C Amb27662293 [1,1,0,0,0,0|2,0,0]=4 6954 B11R1.222 CCC(Br)c1cccnc1Cl Amb28365792 [1,1,0,0,0,0|1,1,0]=4 6955 B11R1.222 CCC(Br)c1ncccc1Cl Amb27394819 [1,1,0,0,0,0|1,1,0]=4 6956 B11R1.222 CCC(Br)c1ncccc1F Amb27790385 [1,1,0,0,0,0|1,1,0]=4 6957 B11R1.222 CCC(C)c1ccccc1Br Amb20617128 [1,1,0,0,0,0|0,0,0]=2 6958 B11R1.222 CCC(C)c1ccccc1C Amb28455793 [1,1,0,0,0,0|1,0,0]=3 6959 B11R1.222 CCC(C)c1ccccc1Cl Amb27635396 [1,1,0,0,0,0|0,1,0]=3 6960 B11R1.222 CCC(C)c1ccccc1F Amb26891261 [1,1,0,0,0,0|0,1,0]=3 6961 B11R1.222 CCC(C)c1ccccc1I Amb24564175 [1,1,0,0,0,0|0,1,0]=3 6962 B11R1.222 CCC(C)c1ccccc1N Amb9756155 [1,1,0,0,0,0|1,0,0]=3 6963 B11R1.222 CCC(C)c1ccccc1O Amb3939542 [1,1,0,0,0,0|1,0,0]=3 6964 B11R1.222 CCC(C)c1ccccc1S Amb27451633 [1,1,0,0,0,0|1,0,0]=3 6965 B11R1.222 CCC(C)c1cccnc1Br Amb24319292 [1,1,0,0,0,0|1,0,0]=3 6966 B11R1.222 CCC(C)c1cccnc1C Amb27159369 [1,1,0,0,0,0|2,0,0]=4 6967 B11R1.222 CCC(C)c1cccnc1Cl Amb24319293 [1,1,0,0,0,0|1,1,0]=4 6968 B11R1.222 CCC(C)c1cccnc1N Amb18201848 [1,1,0,0,0,0|2,0,0]=4 6969 B11R1.222 CCC(C)c1cccnc1O Amb24319294 [1,1,0,0,0,0|2,0,0]=4 6970 B11R1.222 CCC(C)c1ccncc1Br Amb24321010 [1,1,0,0,0,0|1,0,0]=3 6971 B11R1.222 CCC(C)c1ccncc1C Amb28146835 [1,1,0,0,0,0|2,0,0]=4 6972 B11R1.222 CCC(C)c1ccncc1N Amb18831281 [1,1,0,0,0,0|2,0,0]=4 6973 B11R1.222 CCC(C)c1cnccc1Br Amb24320591 [1,1,0,0,0,0|1,0,0]=3 6974 B11R1.222 CCC(C)c1cnccc1N Amb24320593 [1,1,0,0,0,0|2,0,0]=4 6975 B11R1.222 CCC(C)c1ncccc1Br Amb24320822 [1,1,0,0,0,0|1,0,0]=3 6976 B11R1.222 CCC(C)c1ncccc1N Amb18201845 [1,1,0,0,0,0|2,0,0]=4 6977 B11R1.222 CCC(C)c1nccnc1Br Amb26475506 [1,1,0,0,0,0|2,0,0]=4 6978 B11R1.222 CCC(C)c1ncncc1Br Amb10068153 [1,1,0,0,0,0|2,0,0]=4 6979 B11R1.222 CCC(Cl)c1ccccc1Cl Amb27402010 [1,1,0,0,0,0|0,1,0]=3 6980 B11R1.222 CCC(N)c1ccccc1Br Amb18966096 [1,1,0,0,0,0|0,0,0]=2 6981 B11R1.222 CCC(N)c1ccccc1C Amb17232057 [1,1,0,0,0,0|1,0,0]=3 6982 B11R1.222 CCC(N)c1ccccc1Cl Amb17232736 [1,1,0,0,0,0|0,1,0]=3 6983 B11R1.222 CCC(N)c1ccccc1Cl Amb22276945 [1,1,0,0,0,0|0,1,0]=3 6984 B11R1.222 CCC(N)c1ccccc1F Amb10840595 [1,1,0,0,0,0|0,1,0]=3 6985 B11R1.222 CCC(N)c1ccccc1F Amb30982522 [1,1,0,0,0,0|0,1,0]=3 6986 B11R1.222 CCC(N)c1ccccc1O Amb1118100 [1,1,0,0,0,0|1,0,0]=3 6987 B11R1.222 CCC(N)c1ccccc1O Amb19404313 [1,1,0,0,0,0|1,0,0]=3 6988 B11R1.222 CCC(N)c1cccnc1Br Amb27390045 [1,1,0,0,0,0|1,0,0]=3 6989 B11R1.222 CCC(N)c1cccnc1Cl Amb27627388 [1,1,0,0,0,0|1,1,0]=4 6990 B11R1.222 CCC(N)c1cccnc1F Amb18831021 [1,1,0,0,0,0|1,1,0]=4 6991 B11R1.222 CCC(N)c1ccncc1F Amb27175481 [1,1,0,0,0,0|1,1,0]=4 6992 B11R1.222 CCC(N)c1ccncc1N Amb28046654 [1,1,0,0,0,0|2,0,0]=4 6993 B11R1.222 CCC(N)c1ncccc1C Amb10608013 [1,1,0,0,0,0|2,0,0]=4 6994 B11R1.222 CCC(N)c1ncccc1C Amb30869584 [1,1,0,0,0,0|2,0,0]=4 6995 B11R1.222 CCC(N)c1ncncc1Br Amb27839954 [1,1,0,0,0,0|2,0,0]=4 6996 B11R1.222 CCC(O)c1ccccc1Br Amb26598101 [1,1,0,0,0,0|0,0,0]=2 6997 B11R1.222 CCC(O)c1ccccc1C Amb17232069 [1,1,0,0,0,0|1,0,0]=3 6998 B11R1.222 CCC(O)c1ccccc1Cl Amb17232794 [1,1,0,0,0,0|0,1,0]=3 6999 B11R1.222 CCC(O)c1ccccc1F Amb6298273 [1,1,0,0,0,0|0,1,0]=3 7000 B11R1.222 CCC(O)c1ccccc1O Amb1111067 [1,1,0,0,0,0|1,0,0]=3 7001 B11R1.222 CCC(O)c1cccnc1Br Amb27393934 [1,1,0,0,0,0|1,0,0]=3 7002 B11R1.222 CCC(O)c1ncccc1Br Amb27589910 [1,1,0,0,0,0|1,0,0]=3 7003 B11R1.222 CCC(O)c1ncccc1Cl Amb27410271 [1,1,0,0,0,0|1,1,0]=4 7004 B11R1.222 CCC(O)c1ncccc1N Amb35587558 [1,1,0,0,0,0|2,0,0]=4 7005 B11R1.222 CCC(O)c1ncccc1O Amb28143070 [1,1,0,0,0,0|2,0,0]=4 7006 B11R1.222 CCC(S)c1ccccc1F Amb25920899 [1,1,0,0,0,0|0,1,0]=3 7007 B11R1.222 CCC(S)c1ccccc1O Amb7784755 [1,1,0,0,0,0|1,0,0]=3 7008 B11R1.222 CCN(C)c1ccccc1Br Amb28207106 [1,1,0,0,0,0|1,0,0]=3 7009 B11R1.222 CCN(C)c1ccccc1C Amb27806082 [1,1,0,0,0,0|2,0,0]=4 7010 B11R1.222 CCN(C)c1ccccc1Cl Amb28281916 [1,1,0,0,0,0|1,1,0]=4 7011 B11R1.222 CCN(C)c1ccccc1F Amb28065028 [1,1,0,0,0,0|1,1,0]=4 7012 B11R1.222 CCN(C)c1ccccc1N Amb33526915 [1,1,0,0,0,0|2,0,0]=4 7013 B11R1.222 CCN(C)c1cccnc1Br Amb24321076 [1,1,0,0,0,0|2,0,0]=4 7014 B11R1.222 CCN(C)c1ccncc1Br Amb24321027 [1,1,0,0,0,0|2,0,0]=4 7015 B11R1.222 CCN(C)c1cnccc1Br Amb24320902 [1,1,0,0,0,0|2,0,0]=4 7016 B11R1.222 CCN(C)c1ncccc1Br Amb24320854 [1,1,0,0,0,0|2,0,0]=4 7017 B11R1.222 CCN(N)c1ccccc1C Amb18125192 [1,1,0,0,0,0|2,0,0]=4 7018 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [1,1,0,0,0,0|2,0,0]=4 7019 B11R1.222 CC[C@@H](N)c1ccccc1C Amb22298520 [1,1,0,0,0,0|1,0,0]=3 7020 B11R1.222 CC[C@@H](N)c1ccccc1C Amb25335271 [1,1,0,0,0,0|1,0,0]=3 7021 B11R1.222 CC[C@@H](N)c1ccccc1Cl Amb28457747 [1,1,0,0,0,0|0,1,0]=3 7022 B11R1.222 CC[C@@H](N)c1ccccc1F Amb22288620 [1,1,0,0,0,0|0,1,0]=3 7023 B11R1.222 CC[C@@H](N)c1ccccc1F Amb27788276 [1,1,0,0,0,0|0,1,0]=3 7024 B11R1.222 CC[C@@H](N)c1ccccc1N Amb27590277 [1,1,0,0,0,0|1,0,0]=3 7025 B11R1.222 CC[C@@H](N)c1cccnc1N Amb27873962 [1,1,0,0,0,0|2,0,0]=4 7026 B11R1.222 CC[C@@H](N)c1cccnc1O Amb24455838 [1,1,0,0,0,0|2,0,0]=4 7027 B11R1.222 CC[C@@H](N)c1cnccc1Br Amb28191897 [1,1,0,0,0,0|1,0,0]=3 7028 B11R1.222 CC[C@@H](N)c1cnccc1C Amb28057698 [1,1,0,0,0,0|2,0,0]=4 7029 B11R1.222 CC[C@@H](N)c1ncccc1Br Amb27945482 [1,1,0,0,0,0|1,0,0]=3 7030 B11R1.222 CC[C@@H](O)c1ccccc1Br Amb28318376 [1,1,0,0,0,0|0,0,0]=2 7031 B11R1.222 CC[C@@H](O)c1ccccc1C Amb27217839 [1,1,0,0,0,0|1,0,0]=3 7032 B11R1.222 CC[C@@H](O)c1cccnc1N Amb28119960 [1,1,0,0,0,0|2,0,0]=4 7033 B11R1.222 CC[C@@H](O)c1ccncc1F Amb27832825 [1,1,0,0,0,0|1,1,0]=4 7034 B11R1.222 CC[C@H](C)C1=CC=CNC1=O Amb27945668 [1,1,0,0,0,0|2,0,0]=4 7035 B11R1.222 CC[C@H](C)c1ccccc1N Amb28456473 [1,1,0,0,0,0|1,0,0]=3 7036 B11R1.222 CC[C@H](C)c1ccccc1O Amb28074773 [1,1,0,0,0,0|1,0,0]=3 7037 B11R1.222 CC[C@H](N)c1ccccc1C Amb25145851 [1,1,0,0,0,0|1,0,0]=3 7038 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb22298557 [1,1,0,0,0,0|0,1,0]=3 7039 B11R1.222 CC[C@H](N)c1ccccc1F Amb22288682 [1,1,0,0,0,0|0,1,0]=3 7040 B11R1.222 CC[C@H](N)c1ccccc1F Amb27640236 [1,1,0,0,0,0|0,1,0]=3 7041 B11R1.222 CC[C@H](N)c1ccccc1I Amb27390094 [1,1,0,0,0,0|0,1,0]=3 7042 B11R1.222 CC[C@H](N)c1ccccc1N Amb27803863 [1,1,0,0,0,0|1,0,0]=3 7043 B11R1.222 CC[C@H](N)c1ccccc1S Amb28206137 [1,1,0,0,0,0|1,0,0]=3 7044 B11R1.222 CC[C@H](N)c1cccnc1Br Amb27623288 [1,1,0,0,0,0|1,0,0]=3 7045 B11R1.222 CC[C@H](N)c1cccnc1C Amb27952038 [1,1,0,0,0,0|2,0,0]=4 7046 B11R1.222 CC[C@H](N)c1cccnc1O Amb27602616 [1,1,0,0,0,0|2,0,0]=4 7047 B11R1.222 CC[C@H](N)c1cccnc1S Amb27831977 [1,1,0,0,0,0|2,0,0]=4 7048 B11R1.222 CC[C@H](N)c1ccncc1Br Amb27438456 [1,1,0,0,0,0|1,0,0]=3 7049 B11R1.222 CC[C@H](N)c1ccncc1O Amb27960309 [1,1,0,0,0,0|2,0,0]=4 7050 B11R1.222 CC[C@H](N)c1ncccc1C Amb27390201 [1,1,0,0,0,0|2,0,0]=4 7051 B11R1.222 CC[C@H](O)c1ccccc1Br Amb24447235 [1,1,0,0,0,0|0,0,0]=2 7052 B11R1.222 CC[C@H](O)c1ccccc1C Amb25884212 [1,1,0,0,0,0|1,0,0]=3 7053 B11R1.222 CC[C@H](O)c1ccccc1Cl Amb25188608 [1,1,0,0,0,0|0,1,0]=3 7054 B11R1.222 CC[C@H](O)c1ccccc1F Amb27161900 [1,1,0,0,0,0|0,1,0]=3 7055 B11R1.222 CC[C@H](O)c1ccncc1C Amb27855841 [1,1,0,0,0,0|2,0,0]=4 7056 B11R1.222 CC[C@H](O)c1ccncc1F Amb28124348 [1,1,0,0,0,0|1,1,0]=4 7057 B11R1.222 CC[C@H](O)c1ncccc1Br Amb27453735 [1,1,0,0,0,0|1,0,0]=3 7058 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [1,1,0,0,0,0|0,1,1]=4 7059 B11R1.222 CNC(=N)c1ccccc1Cl Amb28652842 [1,1,0,0,0,0|0,1,1]=4 7060 B11R1.222 CNC(=N)c1ccncc1Br Amb27444779 [1,1,0,0,0,0|1,0,1]=4 7061 B11R1.222 CNC(=O)c1ccccc1Br Amb2625865 [1,1,0,0,0,0|0,0,1]=3 7062 B11R1.222 CNC(=O)c1ccccc1C Amb2613120 [1,1,0,0,0,0|1,0,1]=4 7063 B11R1.222 CNC(=O)c1ccccc1I Amb2754649 [1,1,0,0,0,0|0,1,1]=4 7064 B11R1.222 CNC(=O)c1ccccc1N Amb6541338 [1,1,0,0,0,0|1,0,1]=4 7065 B11R1.222 CNC(=O)c1ccccc1N Amb6773994 [1,1,0,0,0,0|1,0,1]=4 7066 B11R1.222 CNC(=O)c1ccccc1O Amb534308 [1,1,0,0,0,0|1,0,1]=4 7067 B11R1.222 CNC(=O)c1cccnc1Br Amb28184490 [1,1,0,0,0,0|1,0,1]=4 7068 B11R1.222 CNC(=O)c1ccncc1Br Amb28074145 [1,1,0,0,0,0|1,0,1]=4 7069 B11R1.222 CNC(=S)c1ccccc1F Amb27412514 [1,1,0,0,0,0|0,1,1]=4 7070 B11R1.222 CNC(=S)c1ccccc1N Amb26845442 [1,1,0,0,0,0|1,0,1]=4 7071 B11R1.222 CNC(=S)c1ccccc1O Amb27215302 [1,1,0,0,0,0|1,0,1]=4 7072 B11R1.222 CNC(C)c1ccccc1Br Amb1138040 [1,1,0,0,0,0|0,0,0]=2 7073 B11R1.222 CNC(C)c1ccccc1Br Amb33550297 [1,1,0,0,0,0|0,0,0]=2 7074 B11R1.222 CNC(C)c1ccccc1C Amb32752837 [1,1,0,0,0,0|1,0,0]=3 7075 B11R1.222 CNC(C)c1ccccc1C Amb9704678 [1,1,0,0,0,0|1,0,0]=3 7076 B11R1.222 CNC(C)c1ccccc1Cl Amb1127237 [1,1,0,0,0,0|0,1,0]=3 7077 B11R1.222 CNC(C)c1ccccc1F Amb1116429 [1,1,0,0,0,0|0,1,0]=3 7078 B11R1.222 CNC(C)c1ccccc1I Amb27617484 [1,1,0,0,0,0|0,1,0]=3 7079 B11R1.222 CNC(C)c1ccccc1O Amb1118530 [1,1,0,0,0,0|1,0,0]=3 7080 B11R1.222 CNC(C)c1ccccc1O Amb6751804 [1,1,0,0,0,0|1,0,0]=3 7081 B11R1.222 CNC(C)c1ccccc1S Amb28434695 [1,1,0,0,0,0|1,0,0]=3 7082 B11R1.222 CNC(C)c1cccnc1Br Amb27830619 [1,1,0,0,0,0|1,0,0]=3 7083 B11R1.222 CNC(C)c1ccncc1N Amb27791980 [1,1,0,0,0,0|2,0,0]=4 7084 B11R1.222 CNC(C)c1cnccc1Cl Amb27607824 [1,1,0,0,0,0|1,1,0]=4 7085 B11R1.222 CNC(C)c1ncccc1Br Amb27985030 [1,1,0,0,0,0|1,0,0]=3 7086 B11R1.222 CNC(C)c1ncccc1C Amb18283561 [1,1,0,0,0,0|2,0,0]=4 7087 B11R1.222 CNC(C)c1ncccc1F Amb27836780 [1,1,0,0,0,0|1,1,0]=4 7088 B11R1.222 CNC(C)c1ncccc1O Amb27176483 [1,1,0,0,0,0|2,0,0]=4 7089 B11R1.222 CNC(C)c1ncncc1Br Amb27778186 [1,1,0,0,0,0|2,0,0]=4 7090 B11R1.222 CNC(O)c1ccncc1O Amb27176839 [1,1,0,0,0,0|2,0,0]=4 7091 B11R1.222 CN[C@@H](C)c1ccccc1C Amb28282685 [1,1,0,0,0,0|1,0,0]=3 7092 B11R1.222 CN[C@@H](C)c1ccccc1Cl Amb26495013 [1,1,0,0,0,0|0,1,0]=3 7093 B11R1.222 CN[C@@H](C)c1ccccc1Cl Amb33309524 [1,1,0,0,0,0|0,1,0]=3 7094 B11R1.222 CN[C@@H](C)c1ccccc1F Amb10838815 [1,1,0,0,0,0|0,1,0]=3 7095 B11R1.222 CN[C@@H](C)c1ccccc1I Amb27647707 [1,1,0,0,0,0|0,1,0]=3 7096 B11R1.222 CN[C@@H](C)c1cccnc1Br Amb27592846 [1,1,0,0,0,0|1,0,0]=3 7097 B11R1.222 CN[C@@H](C)c1cccnc1C Amb27409368 [1,1,0,0,0,0|2,0,0]=4 7098 B11R1.222 CN[C@@H](C)c1cccnc1F Amb27459912 [1,1,0,0,0,0|1,1,0]=4 7099 B11R1.222 CN[C@@H](C)c1cccnc1O Amb28399286 [1,1,0,0,0,0|2,0,0]=4 7100 B11R1.222 CN[C@@H](C)c1cccnc1S Amb28141842 [1,1,0,0,0,0|2,0,0]=4 7101 B11R1.222 CN[C@@H](C)c1ncccc1Br Amb28075548 [1,1,0,0,0,0|1,0,0]=3 7102 B11R1.222 CN[C@H](C)c1ccccc1C Amb24746717 [1,1,0,0,0,0|1,0,0]=3 7103 B11R1.222 CN[C@H](C)c1ccccc1C Amb32657987 [1,1,0,0,0,0|1,0,0]=3 7104 B11R1.222 CN[C@H](C)c1ccccc1Cl Amb27175385 [1,1,0,0,0,0|0,1,0]=3 7105 B11R1.222 CN[C@H](C)c1ccccc1I Amb27866359 [1,1,0,0,0,0|0,1,0]=3 7106 B11R1.222 CN[C@H](C)c1cccnc1Br Amb27798455 [1,1,0,0,0,0|1,0,0]=3 7107 B11R1.222 CN[C@H](C)c1cccnc1O Amb27213169 [1,1,0,0,0,0|2,0,0]=4 7108 B11R1.222 CN[C@H](C)c1cccnc1S Amb28381645 [1,1,0,0,0,0|2,0,0]=4 7109 B11R1.222 CN[C@H](C)c1ccncc1Br Amb27393586 [1,1,0,0,0,0|1,0,0]=3 7110 B11R1.222 CN[C@H](C)c1ccncc1C Amb27798729 [1,1,0,0,0,0|2,0,0]=4 7111 B11R1.222 CN[C@H](C)c1ccncc1O Amb27617420 [1,1,0,0,0,0|2,0,0]=4 7112 B11R1.222 CN[C@H](C)c1ncccc1Br Amb28133638 [1,1,0,0,0,0|1,0,0]=3 7113 B11R1.222 COC(=O)c1ccccc1Br Amb2725116 [1,1,0,0,0,0|1,0,1]=4 7114 B11R1.222 COC(C)c1ccccc1O Amb18125398 [1,1,0,0,0,0|2,0,0]=4 7115 B11R1.222 COC(O)c1ccccc1Cl Amb27651946 [1,1,0,0,0,0|1,1,0]=4 7116 B11R1.222 CSC(C)c1ccccc1F Amb28285777 [1,1,0,0,0,0|1,1,0]=4 7117 B11R1.222 CSC(C)c1ccccc1O Amb27432693 [1,1,0,0,0,0|2,0,0]=4 7118 B11R1.222 C[C@@H](CN)c1ccccc1F Amb33731710 [1,1,0,0,0,0|0,1,0]=3 7119 B11R1.222 C[C@@H](CO)c1ccccc1F Amb33746405 [1,1,0,0,0,0|1,1,0]=4 7120 B11R1.222 C[C@@H](NO)c1ccccc1Br Amb28241543 [1,1,0,0,0,0|1,0,0]=3 7121 B11R1.222 C[C@@H](NO)c1ccccc1F Amb28041566 [1,1,0,0,0,0|1,1,0]=4 7122 B11R1.222 C[C@@H](NO)c1ccccc1O Amb27222589 [1,1,0,0,0,0|2,0,0]=4 7123 B11R1.222 C[C@H](CN)c1ccccc1F Amb33746912 [1,1,0,0,0,0|0,1,0]=3 7124 B11R1.222 C[C@H](CO)c1ccccc1F Amb33748468 [1,1,0,0,0,0|1,1,0]=4 7125 B11R1.222 C[C@H](NO)c1ccccc1Cl Amb28074234 [1,1,0,0,0,0|1,1,0]=4 7126 B11R1.222 C[C@H](NO)c1ccccc1O Amb27663515 [1,1,0,0,0,0|2,0,0]=4 7127 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [1,1,0,0,0,0|1,0,1]=4 7128 B11R1.222 Cc1ccccc1C(=O)CN Amb2693529 [1,1,0,0,0,0|1,0,1]=4 7129 B11R1.222 Cc1ccccc1C(C)CBr Amb25148992 [1,1,0,0,0,0|2,0,0]=4 7130 B11R1.222 Cc1ccccc1C(C)CCl Amb27469675 [1,1,0,0,0,0|2,0,0]=4 7131 B11R1.222 Cc1ccccc1C(C)CN Amb28465568 [1,1,0,0,0,0|1,0,0]=3 7132 B11R1.222 Cc1ccccc1C(C)CN Amb8950134 [1,1,0,0,0,0|1,0,0]=3 7133 B11R1.222 Cc1ccccc1C(C)CO Amb25129854 [1,1,0,0,0,0|2,0,0]=4 7134 B11R1.222 Cc1ccccc1C(C)NN Amb6249679 [1,1,0,0,0,0|2,0,0]=4 7135 B11R1.222 Cc1ccccc1C(C)ON Amb33360515 [1,1,0,0,0,0|2,0,0]=4 7136 B11R1.222 Cc1ccccc1C(F)CN Amb25151822 [1,1,0,0,0,0|1,0,0]=3 7137 B11R1.222 Cc1ccccc1C(N)CF Amb24603875 [1,1,0,0,0,0|2,0,0]=4 7138 B11R1.222 Cc1ccccc1C(N)CF Amb31217523 [1,1,0,0,0,0|2,0,0]=4 7139 B11R1.222 Cc1ccccc1C(N)CN Amb9380695 [1,1,0,0,0,0|1,0,0]=3 7140 B11R1.222 Cc1ccccc1C(N)CO Amb8855227 [1,1,0,0,0,0|2,0,0]=4 7141 B11R1.222 Cc1ccccc1C(O)CBr Amb24106267 [1,1,0,0,0,0|2,0,0]=4 7142 B11R1.222 Cc1ccccc1C(O)CCl Amb24104159 [1,1,0,0,0,0|2,0,0]=4 7143 B11R1.222 Cc1ccccc1C(O)CF Amb24661131 [1,1,0,0,0,0|2,0,0]=4 7144 B11R1.222 Cc1ccccc1C(O)CI Amb26601620 [1,1,0,0,0,0|2,0,0]=4 7145 B11R1.222 Cc1ccccc1C(O)CN Amb10068895 [1,1,0,0,0,0|1,0,0]=3 7146 B11R1.222 Cc1ccccc1C(O)CN Amb33801451 [1,1,0,0,0,0|1,0,0]=3 7147 B11R1.222 Cc1ccccc1C(O)CN Amb9703614 [1,1,0,0,0,0|1,0,0]=3 7148 B11R1.222 Cc1ccccc1C(O)CO Amb27146455 [1,1,0,0,0,0|2,0,0]=4 7149 B11R1.222 Cc1ccccc1[C@@H](C)CN Amb33731716 [1,1,0,0,0,0|1,0,0]=3 7150 B11R1.222 Cc1ccccc1[C@@H](C)CO Amb27431457 [1,1,0,0,0,0|2,0,0]=4 7151 B11R1.222 Cc1ccccc1[C@@H](N)CN Amb27473367 [1,1,0,0,0,0|1,0,0]=3 7152 B11R1.222 Cc1ccccc1[C@@H](N)CO Amb25887070 [1,1,0,0,0,0|2,0,0]=4 7153 B11R1.222 Cc1ccccc1[C@@H](O)CBr Amb28285028 [1,1,0,0,0,0|2,0,0]=4 7154 B11R1.222 Cc1ccccc1[C@@H](O)CCl Amb28142883 [1,1,0,0,0,0|2,0,0]=4 7155 B11R1.222 Cc1ccccc1[C@@H](O)CN Amb24100213 [1,1,0,0,0,0|1,0,0]=3 7156 B11R1.222 Cc1ccccc1[C@H](C)CN Amb33746798 [1,1,0,0,0,0|1,0,0]=3 7157 B11R1.222 Cc1ccccc1[C@H](C)CO Amb33749842 [1,1,0,0,0,0|2,0,0]=4 7158 B11R1.222 Cc1ccccc1[C@H](N)CO Amb27398610 [1,1,0,0,0,0|2,0,0]=4 7159 B11R1.222 Cc1ccccc1[C@H](O)CCl Amb27400107 [1,1,0,0,0,0|2,0,0]=4 7160 B11R1.222 Cc1ccccc1[C@H](O)CN Amb26537233 [1,1,0,0,0,0|1,0,0]=3 7161 B11R1.222 Cc1ccccc1[C@H](O)CO Amb27776437 [1,1,0,0,0,0|2,0,0]=4 7162 B11R1.222 Cc1cccnc1C(C)CN Amb33502820 [1,1,0,0,0,0|2,0,0]=4 7163 B11R1.222 Cc1cccnc1C(F)CN Amb33428805 [1,1,0,0,0,0|2,0,0]=4 7164 B11R1.222 Cc1cccnc1C(O)CN Amb27483900 [1,1,0,0,0,0|2,0,0]=4 7165 B11R1.222 Cc1cccnc1[C@@H](N)CN Amb27473253 [1,1,0,0,0,0|2,0,0]=4 7166 B11R1.222 Cc1cccnc1[C@@H](O)CN Amb33428804 [1,1,0,0,0,0|2,0,0]=4 7167 B11R1.222 Cc1cccnc1[C@H](N)CN Amb27961477 [1,1,0,0,0,0|2,0,0]=4 7168 B11R1.222 Cc1cccnc1[C@H](O)CN Amb33428803 [1,1,0,0,0,0|2,0,0]=4 7169 B11R1.222 Cc1ccncc1C(C)CN Amb18201825 [1,1,0,0,0,0|2,0,0]=4 7170 B11R1.222 Cc1ccncc1C(F)CN Amb26051916 [1,1,0,0,0,0|2,0,0]=4 7171 B11R1.222 Cc1ccncc1C(O)CN Amb28349054 [1,1,0,0,0,0|2,0,0]=4 7172 B11R1.222 Cc1ccncc1[C@@H](O)CN Amb33377020 [1,1,0,0,0,0|2,0,0]=4 7173 B11R1.222 Cc1ccncc1[C@H](O)CN Amb33377018 [1,1,0,0,0,0|2,0,0]=4 7174 B11R1.222 Cc1cnccc1C(C)CN Amb27853963 [1,1,0,0,0,0|2,0,0]=4 7175 B11R1.222 Cc1cnccc1C(F)CN Amb33414469 [1,1,0,0,0,0|2,0,0]=4 7176 B11R1.222 Cc1cnccc1C(N)CN Amb27475952 [1,1,0,0,0,0|2,0,0]=4 7177 B11R1.222 Cc1cnccc1C(O)CN Amb28246816 [1,1,0,0,0,0|2,0,0]=4 7178 B11R1.222 Cc1cnccc1[C@@H](O)CN Amb33414187 [1,1,0,0,0,0|2,0,0]=4 7179 B11R1.222 Cc1cnccc1[C@H](O)CN Amb33414191 [1,1,0,0,0,0|2,0,0]=4 7180 B11R1.222 Cc1ncccc1C(C)CN Amb32880139 [1,1,0,0,0,0|2,0,0]=4 7181 B11R1.222 Cc1ncccc1C(F)CN Amb32880589 [1,1,0,0,0,0|2,0,0]=4 7182 B11R1.222 Cc1ncccc1C(O)CN Amb18831196 [1,1,0,0,0,0|2,0,0]=4 7183 B11R1.222 Cc1ncccc1[C@@H](O)CN Amb32879572 [1,1,0,0,0,0|2,0,0]=4 7184 B11R1.222 Cc1ncccc1[C@H](O)CN Amb32879571 [1,1,0,0,0,0|2,0,0]=4 7185 B11R1.222 N#CC(F)c1ccccc1Br Amb27450789 [1,1,0,0,0,0|0,0,2]=4 7186 B11R1.222 N#CC(N)c1ccccc1Br Amb28960298 [1,1,0,0,0,0|0,0,2]=4 7187 B11R1.222 N#CC(N)c1ccccc1Br Amb6265449 [1,1,0,0,0,0|0,0,2]=4 7188 B11R1.222 N#C[C@H](N)c1ccccc1Br Amb27968426 [1,1,0,0,0,0|0,0,2]=4 7189 B11R1.222 N=C(NO)c1ccccc1Br Amb22489654 [1,1,0,0,0,0|1,0,1]=4 7190 B11R1.222 NC(CF)c1ccccc1Br Amb28041536 [1,1,0,0,0,0|1,0,0]=3 7191 B11R1.222 NC(CF)c1ccccc1Cl Amb27247457 [1,1,0,0,0,0|1,1,0]=4 7192 B11R1.222 NC(CF)c1ccccc1F Amb2372611 [1,1,0,0,0,0|1,1,0]=4 7193 B11R1.222 NC(CF)c1ccccc1O Amb24488040 [1,1,0,0,0,0|2,0,0]=4 7194 B11R1.222 NC(CO)c1ccccc1Br Amb23596558 [1,1,0,0,0,0|1,0,0]=3 7195 B11R1.222 NC(CO)c1ccccc1Cl Amb17232852 [1,1,0,0,0,0|1,1,0]=4 7196 B11R1.222 NC(CO)c1ccccc1F Amb19374114 [1,1,0,0,0,0|1,1,0]=4 7197 B11R1.222 NC(CO)c1ccccc1F Amb2236915 [1,1,0,0,0,0|1,1,0]=4 7198 B11R1.222 NC(CO)c1ccccc1I Amb25738482 [1,1,0,0,0,0|1,1,0]=4 7199 B11R1.222 NC(CO)c1ccccc1I Amb30584760 [1,1,0,0,0,0|1,1,0]=4 7200 B11R1.222 NC(CO)c1ccccc1O Amb24069930 [1,1,0,0,0,0|2,0,0]=4 7201 B11R1.222 NC(CO)c1cccnc1Br Amb25149024 [1,1,0,0,0,0|2,0,0]=4 7202 B11R1.222 NC(CO)c1ccncc1Br Amb25147958 [1,1,0,0,0,0|2,0,0]=4 7203 B11R1.222 NC(CO)c1cnccc1Br Amb27412007 [1,1,0,0,0,0|2,0,0]=4 7204 B11R1.222 NC(CO)c1ncccc1Br Amb27202314 [1,1,0,0,0,0|2,0,0]=4 7205 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [1,1,0,0,0,0|0,0,1]=3 7206 B11R1.222 NCC(=O)c1ccccc1Br Amb8383857 [1,1,0,0,0,0|0,0,1]=3 7207 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [1,1,0,0,0,0|0,1,1]=4 7208 B11R1.222 NCC(=O)c1ccccc1Cl Amb8383856 [1,1,0,0,0,0|0,1,1]=4 7209 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [1,1,0,0,0,0|0,1,1]=4 7210 B11R1.222 NCC(=O)c1ccccc1F Amb8383855 [1,1,0,0,0,0|0,1,1]=4 7211 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [1,1,0,0,0,0|1,0,1]=4 7212 B11R1.222 NCC(=O)c1ccccc1O Amb32664086 [1,1,0,0,0,0|1,0,1]=4 7213 B11R1.222 NCC(=O)c1ccccc1O Amb33801554 [1,1,0,0,0,0|1,0,1]=4 7214 B11R1.222 NCC(=O)c1cccnc1Br Amb25718599 [1,1,0,0,0,0|1,0,1]=4 7215 B11R1.222 NCC(=O)c1ccncc1Br Amb33389483 [1,1,0,0,0,0|1,0,1]=4 7216 B11R1.222 NCC(=O)c1ncccc1Br Amb33335701 [1,1,0,0,0,0|1,0,1]=4 7217 B11R1.222 NCC(F)c1ccccc1Br Amb23454845 [1,1,0,0,0,0|0,0,0]=2 7218 B11R1.222 NCC(F)c1ccccc1Cl Amb24392618 [1,1,0,0,0,0|0,1,0]=3 7219 B11R1.222 NCC(F)c1ccccc1F Amb28457718 [1,1,0,0,0,0|0,1,0]=3 7220 B11R1.222 NCC(F)c1ccccc1N Amb25942093 [1,1,0,0,0,0|1,0,0]=3 7221 B11R1.222 NCC(F)c1ccccc1O Amb26445570 [1,1,0,0,0,0|1,0,0]=3 7222 B11R1.222 NCC(F)c1cccnc1Br Amb33387460 [1,1,0,0,0,0|1,0,0]=3 7223 B11R1.222 NCC(F)c1cccnc1Cl Amb33257024 [1,1,0,0,0,0|1,1,0]=4 7224 B11R1.222 NCC(F)c1cccnc1F Amb33377932 [1,1,0,0,0,0|1,1,0]=4 7225 B11R1.222 NCC(F)c1cccnc1N Amb27172095 [1,1,0,0,0,0|2,0,0]=4 7226 B11R1.222 NCC(F)c1ccncc1Br Amb33388256 [1,1,0,0,0,0|1,0,0]=3 7227 B11R1.222 NCC(F)c1ccncc1Cl Amb33413768 [1,1,0,0,0,0|1,1,0]=4 7228 B11R1.222 NCC(F)c1ccncc1F Amb25321024 [1,1,0,0,0,0|1,1,0]=4 7229 B11R1.222 NCC(F)c1ncccc1Br Amb33335741 [1,1,0,0,0,0|1,0,0]=3 7230 B11R1.222 NCC(F)c1ncccc1F Amb33418785 [1,1,0,0,0,0|1,1,0]=4 7231 B11R1.222 NCC(N)c1ccccc1Br Amb9380656 [1,1,0,0,0,0|0,0,0]=2 7232 B11R1.222 NCC(N)c1cccnc1F Amb27617282 [1,1,0,0,0,0|1,1,0]=4 7233 B11R1.222 NCC(N)c1ccncc1Br Amb27801071 [1,1,0,0,0,0|1,0,0]=3 7234 B11R1.222 NCC(N)c1ccncc1Cl Amb27165132 [1,1,0,0,0,0|1,1,0]=4 7235 B11R1.222 NCC(N)c1ccncc1N Amb27173265 [1,1,0,0,0,0|2,0,0]=4 7236 B11R1.222 NCC(N)c1ccncc1O Amb28313703 [1,1,0,0,0,0|2,0,0]=4 7237 B11R1.222 NCC(N)c1cnccc1Br Amb27441737 [1,1,0,0,0,0|1,0,0]=3 7238 B11R1.222 NCC(N)c1cnccc1Cl Amb27881554 [1,1,0,0,0,0|1,1,0]=4 7239 B11R1.222 NCC(N)c1ncccc1F Amb27488656 [1,1,0,0,0,0|1,1,0]=4 7240 B11R1.222 NCC(O)c1ccccc1Br Amb22587182 [1,1,0,0,0,0|0,0,0]=2 7241 B11R1.222 NCC(O)c1ccccc1Br Amb2383122 [1,1,0,0,0,0|0,0,0]=2 7242 B11R1.222 NCC(O)c1ccccc1Cl Amb2697538 [1,1,0,0,0,0|0,1,0]=3 7243 B11R1.222 NCC(O)c1ccccc1Cl Amb9703590 [1,1,0,0,0,0|0,1,0]=3 7244 B11R1.222 NCC(O)c1ccccc1F Amb1108863 [1,1,0,0,0,0|0,1,0]=3 7245 B11R1.222 NCC(O)c1ccccc1F Amb2699087 [1,1,0,0,0,0|0,1,0]=3 7246 B11R1.222 NCC(O)c1ccccc1I Amb22234793 [1,1,0,0,0,0|0,1,0]=3 7247 B11R1.222 NCC(O)c1ccccc1I Amb2383126 [1,1,0,0,0,0|0,1,0]=3 7248 B11R1.222 NCC(O)c1ccccc1O Amb1108822 [1,1,0,0,0,0|1,0,0]=3 7249 B11R1.222 NCC(O)c1cccnc1Br Amb33389446 [1,1,0,0,0,0|1,0,0]=3 7250 B11R1.222 NCC(O)c1cccnc1Cl Amb33256981 [1,1,0,0,0,0|1,1,0]=4 7251 B11R1.222 NCC(O)c1cccnc1F Amb26038957 [1,1,0,0,0,0|1,1,0]=4 7252 B11R1.222 NCC(O)c1ccncc1Br Amb33430084 [1,1,0,0,0,0|1,0,0]=3 7253 B11R1.222 NCC(O)c1ccncc1Cl Amb33407322 [1,1,0,0,0,0|1,1,0]=4 7254 B11R1.222 NCC(O)c1ccncc1F Amb25863245 [1,1,0,0,0,0|1,1,0]=4 7255 B11R1.222 NCC(O)c1ncccc1Br Amb23586110 [1,1,0,0,0,0|1,0,0]=3 7256 B11R1.222 NCC(O)c1ncccc1F Amb27642083 [1,1,0,0,0,0|1,1,0]=4 7257 B11R1.222 NC[C@@H](N)c1ccccc1O Amb28203922 [1,1,0,0,0,0|1,0,0]=3 7258 B11R1.222 NC[C@@H](N)c1cccnc1F Amb27873973 [1,1,0,0,0,0|1,1,0]=4 7259 B11R1.222 NC[C@@H](N)c1cccnc1S Amb27620326 [1,1,0,0,0,0|2,0,0]=4 7260 B11R1.222 NC[C@@H](N)c1cnccc1Br Amb27823159 [1,1,0,0,0,0|1,0,0]=3 7261 B11R1.222 NC[C@@H](N)c1ncccc1Cl Amb27645058 [1,1,0,0,0,0|1,1,0]=4 7262 B11R1.222 NC[C@@H](N)c1ncccc1F Amb28072886 [1,1,0,0,0,0|1,1,0]=4 7263 B11R1.222 NC[C@@H](N)c1ncccc1O Amb27252086 [1,1,0,0,0,0|2,0,0]=4 7264 B11R1.222 NC[C@@H](O)c1ccccc1Br Amb24415174 [1,1,0,0,0,0|0,0,0]=2 7265 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241478 [1,1,0,0,0,0|0,1,0]=3 7266 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241480 [1,1,0,0,0,0|0,1,0]=3 7267 B11R1.222 NC[C@@H](O)c1ccccc1F Amb26880377 [1,1,0,0,0,0|0,1,0]=3 7268 B11R1.222 NC[C@@H](O)c1ccccc1O Amb33196482 [1,1,0,0,0,0|1,0,0]=3 7269 B11R1.222 NC[C@@H](O)c1cccnc1Br Amb33388505 [1,1,0,0,0,0|1,0,0]=3 7270 B11R1.222 NC[C@@H](O)c1cccnc1Cl Amb33263088 [1,1,0,0,0,0|1,1,0]=4 7271 B11R1.222 NC[C@@H](O)c1cccnc1F Amb33224055 [1,1,0,0,0,0|1,1,0]=4 7272 B11R1.222 NC[C@@H](O)c1ccncc1Br Amb33388510 [1,1,0,0,0,0|1,0,0]=3 7273 B11R1.222 NC[C@@H](O)c1ccncc1Cl Amb33413775 [1,1,0,0,0,0|1,1,0]=4 7274 B11R1.222 NC[C@@H](O)c1ccncc1F Amb33317200 [1,1,0,0,0,0|1,1,0]=4 7275 B11R1.222 NC[C@@H](O)c1ncccc1Br Amb33336041 [1,1,0,0,0,0|1,0,0]=3 7276 B11R1.222 NC[C@@H](O)c1ncccc1F Amb33224648 [1,1,0,0,0,0|1,1,0]=4 7277 B11R1.222 NC[C@H](N)c1ccccc1Br Amb28135268 [1,1,0,0,0,0|0,0,0]=2 7278 B11R1.222 NC[C@H](N)c1ccccc1I Amb28365341 [1,1,0,0,0,0|0,1,0]=3 7279 B11R1.222 NC[C@H](N)c1ccccc1O Amb27831169 [1,1,0,0,0,0|1,0,0]=3 7280 B11R1.222 NC[C@H](N)c1cccnc1S Amb27602190 [1,1,0,0,0,0|2,0,0]=4 7281 B11R1.222 NC[C@H](N)c1ccncc1Cl Amb27233806 [1,1,0,0,0,0|1,1,0]=4 7282 B11R1.222 NC[C@H](N)c1ccncc1F Amb27409349 [1,1,0,0,0,0|1,1,0]=4 7283 B11R1.222 NC[C@H](N)c1cnccc1Cl Amb27617257 [1,1,0,0,0,0|1,1,0]=4 7284 B11R1.222 NC[C@H](N)c1ncccc1Br Amb27597504 [1,1,0,0,0,0|1,0,0]=3 7285 B11R1.222 NC[C@H](O)c1ccccc1Br Amb25686880 [1,1,0,0,0,0|0,0,0]=2 7286 B11R1.222 NC[C@H](O)c1ccccc1Cl Amb27954604 [1,1,0,0,0,0|0,1,0]=3 7287 B11R1.222 NC[C@H](O)c1ccccc1F Amb25994717 [1,1,0,0,0,0|0,1,0]=3 7288 B11R1.222 NC[C@H](O)c1ccccc1O Amb33196478 [1,1,0,0,0,0|1,0,0]=3 7289 B11R1.222 NC[C@H](O)c1cccnc1Br Amb33388504 [1,1,0,0,0,0|1,0,0]=3 7290 B11R1.222 NC[C@H](O)c1cccnc1Cl Amb33257028 [1,1,0,0,0,0|1,1,0]=4 7291 B11R1.222 NC[C@H](O)c1cccnc1F Amb33377690 [1,1,0,0,0,0|1,1,0]=4 7292 B11R1.222 NC[C@H](O)c1ccncc1Br Amb33388509 [1,1,0,0,0,0|1,0,0]=3 7293 B11R1.222 NC[C@H](O)c1ccncc1Cl Amb33413771 [1,1,0,0,0,0|1,1,0]=4 7294 B11R1.222 NC[C@H](O)c1ccncc1F Amb33317201 [1,1,0,0,0,0|1,1,0]=4 7295 B11R1.222 NC[C@H](O)c1ncccc1Br Amb33336039 [1,1,0,0,0,0|1,0,0]=3 7296 B11R1.222 NC[C@H](O)c1ncccc1F Amb33418815 [1,1,0,0,0,0|1,1,0]=4 7297 B11R1.222 NNC(=O)c1ccccc1Br Amb6366604 [1,1,0,0,0,0|1,0,1]=4 7298 B11R1.222 N[C@@H](CF)c1ccccc1F Amb24487040 [1,1,0,0,0,0|1,1,0]=4 7299 B11R1.222 N[C@@H](CF)c1cccnc1Br Amb27807496 [1,1,0,0,0,0|2,0,0]=4 7300 B11R1.222 N[C@@H](CO)c1ccccc1Br Amb26868624 [1,1,0,0,0,0|1,0,0]=3 7301 B11R1.222 N[C@@H](CO)c1ccccc1Cl Amb22756886 [1,1,0,0,0,0|1,1,0]=4 7302 B11R1.222 N[C@@H](CO)c1ccccc1F Amb22756438 [1,1,0,0,0,0|1,1,0]=4 7303 B11R1.222 N[C@@H](CO)c1ccccc1O Amb27669549 [1,1,0,0,0,0|2,0,0]=4 7304 B11R1.222 N[C@@H](CO)c1cccnc1Br Amb25921363 [1,1,0,0,0,0|2,0,0]=4 7305 B11R1.222 N[C@@H](CO)c1ccncc1Br Amb27403188 [1,1,0,0,0,0|2,0,0]=4 7306 B11R1.222 N[C@@H](CO)c1ncccc1Br Amb26646593 [1,1,0,0,0,0|2,0,0]=4 7307 B11R1.222 N[C@H](CF)c1ccccc1Cl Amb27807596 [1,1,0,0,0,0|1,1,0]=4 7308 B11R1.222 N[C@H](CF)c1ccccc1F Amb25125365 [1,1,0,0,0,0|1,1,0]=4 7309 B11R1.222 N[C@H](CO)c1ccccc1Br Amb26498620 [1,1,0,0,0,0|1,0,0]=3 7310 B11R1.222 N[C@H](CO)c1ccccc1Cl Amb25228430 [1,1,0,0,0,0|1,1,0]=4 7311 B11R1.222 N[C@H](CO)c1ccccc1Cl Amb33872480 [1,1,0,0,0,0|1,1,0]=4 7312 B11R1.222 N[C@H](CO)c1ccccc1F Amb24349743 [1,1,0,0,0,0|1,1,0]=4 7313 B11R1.222 N[C@H](CO)c1ccccc1F Amb33801935 [1,1,0,0,0,0|1,1,0]=4 7314 B11R1.222 N[C@H](CO)c1ccccc1O Amb24383657 [1,1,0,0,0,0|2,0,0]=4 7315 B11R1.222 N[C@H](CO)c1cccnc1Br Amb25216116 [1,1,0,0,0,0|2,0,0]=4 7316 B11R1.222 N[C@H](CO)c1ccncc1Br Amb27750820 [1,1,0,0,0,0|2,0,0]=4 7317 B11R1.222 N[C@H](CO)c1cnccc1Br Amb27876737 [1,1,0,0,0,0|2,0,0]=4 7318 B11R1.222 N[C@H](CO)c1ncccc1Br Amb26868106 [1,1,0,0,0,0|2,0,0]=4 7319 B11R1.222 N\N=C(\N)c1ccccc1Br Amb27171792 [1,1,0,0,0,0|1,0,1]=4 7320 B11R1.222 Nc1ccccc1C(N)CF Amb33190142 [1,1,0,0,0,0|2,0,0]=4 7321 B11R1.222 O=C(CBr)c1ccccc1Br Amb1106771 [1,1,0,0,0,0|1,0,1]=4 7322 B11R1.222 O=C(CF)c1ccccc1Br Amb22489704 [1,1,0,0,0,0|1,0,1]=4 7323 B11R1.222 O=C(CO)c1ccccc1Br Amb24639690 [1,1,0,0,0,0|1,0,1]=4 7324 B11R1.222 O=C(NO)c1ccccc1Br Amb6269839 [1,1,0,0,0,0|1,0,1]=4 7325 B11R1.222 OC(CBr)c1ccccc1Br Amb25741136 [1,1,0,0,0,0|1,0,0]=3 7326 B11R1.222 OC(CBr)c1ccccc1Cl Amb24081185 [1,1,0,0,0,0|1,1,0]=4 7327 B11R1.222 OC(CBr)c1ccccc1F Amb28195216 [1,1,0,0,0,0|1,1,0]=4 7328 B11R1.222 OC(CBr)c1cccnc1Br Amb33387835 [1,1,0,0,0,0|2,0,0]=4 7329 B11R1.222 OC(CBr)c1ccncc1Br Amb33388627 [1,1,0,0,0,0|2,0,0]=4 7330 B11R1.222 OC(CBr)c1ncccc1Br Amb33336083 [1,1,0,0,0,0|2,0,0]=4 7331 B11R1.222 OC(CCl)c1ccccc1Br Amb27452273 [1,1,0,0,0,0|1,0,0]=3 7332 B11R1.222 OC(CCl)c1ccccc1Cl Amb25726431 [1,1,0,0,0,0|1,1,0]=4 7333 B11R1.222 OC(CCl)c1ccccc1F Amb25306094 [1,1,0,0,0,0|1,1,0]=4 7334 B11R1.222 OC(CCl)c1cccnc1Br Amb33387831 [1,1,0,0,0,0|2,0,0]=4 7335 B11R1.222 OC(CCl)c1ccncc1Br Amb33388624 [1,1,0,0,0,0|2,0,0]=4 7336 B11R1.222 OC(CCl)c1ncccc1Br Amb33336080 [1,1,0,0,0,0|2,0,0]=4 7337 B11R1.222 OC(CF)c1ccccc1Br Amb27219160 [1,1,0,0,0,0|1,0,0]=3 7338 B11R1.222 OC(CF)c1ccccc1Cl Amb27790858 [1,1,0,0,0,0|1,1,0]=4 7339 B11R1.222 OC(CF)c1ccccc1F Amb24688002 [1,1,0,0,0,0|1,1,0]=4 7340 B11R1.222 OC(CF)c1cccnc1Br Amb33387837 [1,1,0,0,0,0|2,0,0]=4 7341 B11R1.222 OC(CF)c1ccncc1Br Amb33388628 [1,1,0,0,0,0|2,0,0]=4 7342 B11R1.222 OC(CF)c1ncccc1Br Amb33336085 [1,1,0,0,0,0|2,0,0]=4 7343 B11R1.222 OC(CI)c1ccccc1Br Amb24555966 [1,1,0,0,0,0|1,0,0]=3 7344 B11R1.222 OC(CI)c1ccccc1Cl Amb26638892 [1,1,0,0,0,0|1,1,0]=4 7345 B11R1.222 OC(CI)c1ccccc1F Amb26862764 [1,1,0,0,0,0|1,1,0]=4 7346 B11R1.222 OCC(Br)c1ccccc1Cl Amb27839842 [1,1,0,0,0,0|1,1,0]=4 7347 B11R1.222 OCC(F)c1ccccc1Br Amb27591310 [1,1,0,0,0,0|1,0,0]=3 7348 B11R1.222 OCC(F)c1ccccc1Cl Amb25145452 [1,1,0,0,0,0|1,1,0]=4 7349 B11R1.222 OCC(F)c1ccccc1F Amb27983139 [1,1,0,0,0,0|1,1,0]=4 7350 B11R1.222 OCC(F)c1ccccc1O Amb28368767 [1,1,0,0,0,0|2,0,0]=4 7351 B11R1.222 OCC(O)c1ccccc1Br Amb24123020 [1,1,0,0,0,0|1,0,0]=3 7352 B11R1.222 OCC(O)c1ccccc1Cl Amb24123046 [1,1,0,0,0,0|1,1,0]=4 7353 B11R1.222 OCC(O)c1ccccc1F Amb24123031 [1,1,0,0,0,0|1,1,0]=4 7354 B11R1.222 OCC(O)c1ccccc1I Amb27176284 [1,1,0,0,0,0|1,1,0]=4 7355 B11R1.222 OCC(O)c1ccccc1O Amb24646646 [1,1,0,0,0,0|2,0,0]=4 7356 B11R1.222 OCC(O)c1cccnc1Br Amb33387827 [1,1,0,0,0,0|2,0,0]=4 7357 B11R1.222 OCC(O)c1ccncc1Br Amb33450639 [1,1,0,0,0,0|2,0,0]=4 7358 B11R1.222 OCC(O)c1ncccc1Br Amb33336076 [1,1,0,0,0,0|2,0,0]=4 7359 B11R1.222 OC[C@@H](F)c1ccccc1Cl Amb27409787 [1,1,0,0,0,0|1,1,0]=4 7360 B11R1.222 OC[C@@H](O)c1ccccc1Cl Amb6365718 [1,1,0,0,0,0|1,1,0]=4 7361 B11R1.222 OC[C@H](O)c1ccccc1Br Amb27867396 [1,1,0,0,0,0|1,0,0]=3 7362 B11R1.222 OC[C@H](O)c1ccccc1Cl Amb25776080 [1,1,0,0,0,0|1,1,0]=4 7363 B11R1.222 O[C@@H](CCl)c1ccccc1Br Amb28342836 [1,1,0,0,0,0|1,0,0]=3 7364 B11R1.222 O[C@@H](CCl)c1ccccc1F Amb27228743 [1,1,0,0,0,0|1,1,0]=4 7365 B11R1.222 O[C@@H](CF)c1ccccc1F Amb26978378 [1,1,0,0,0,0|1,1,0]=4 7366 B11R1.222 O[C@H](CBr)c1ccccc1Cl Amb6893368 [1,1,0,0,0,0|1,1,0]=4 7367 B11R1.222 O[C@H](CBr)c1ccccc1F Amb28250735 [1,1,0,0,0,0|1,1,0]=4 7368 B11R1.222 O[C@H](CCl)c1ccccc1Br Amb28285031 [1,1,0,0,0,0|1,0,0]=3 7369 B11R1.222 O[C@H](CF)c1ccccc1F Amb24454550 [1,1,0,0,0,0|1,1,0]=4 7370 B11R1.222 Oc1ccccc1C(O)CBr Amb33334195 [1,1,0,0,0,0|2,0,0]=4 7371 B11R1.222 Oc1ccccc1C(O)CCl Amb33262875 [1,1,0,0,0,0|2,0,0]=4 7372 B11R1.222 Oc1ccccc1C(O)CF Amb26529482 [1,1,0,0,0,0|2,0,0]=4 7373 B11R1.222 [C-]#[N+]C(C)c1ccccc1Br Amb3973420 [1,1,0,0,0,0|0,0,2]=4 7374 B11R1.605 BrCCc1c(Br)cccc1Br Amb23412439 [1,1,0,0,0,0|1,0,0]=3 7375 B11R1.605 BrCCc1c(Br)cccc1I Amb28194314 [1,1,0,0,0,0|1,0,0]=3 7376 B11R1.605 BrCCc1c(Br)cncc1Br Amb28146455 [1,1,0,0,0,0|2,0,0]=4 7377 B11R1.605 C#CCc1c(Br)cccc1Br Amb33009373 [1,1,0,0,0,0|0,0,2]=4 7378 B11R1.605 C#CCc1c(Cl)cccc1Br Amb33336214 [1,1,0,0,0,0|0,0,2]=4 7379 B11R1.605 C#CCc1c(F)cccc1Br Amb33430043 [1,1,0,0,0,0|0,0,2]=4 7380 B11R1.605 C#CCc1c(O)cccc1Br Amb33431176 [1,1,0,0,0,0|0,0,2]=4 7381 B11R1.605 C=CCc1c(F)cccc1Br Amb32698612 [1,1,0,0,0,0|0,0,2]=4 7382 B11R1.605 C=CCc1c(O)cccc1Br Amb27594891 [1,1,0,0,0,0|0,0,2]=4 7383 B11R1.605 CC1=CC=CC(=O)N1CCN Amb18030463 [1,1,0,0,0,0|2,0,0]=4 7384 B11R1.605 CCCN1C(=O)C=CC=C1C Amb19126670 [1,1,0,0,0,0|2,0,0]=4 7385 B11R1.605 CCCc1c(Br)ccnc1Br Amb24319971 [1,1,0,0,0,0|1,0,0]=3 7386 B11R1.605 CCCc1c(Br)ccnc1N Amb24319972 [1,1,0,0,0,0|1,0,0]=3 7387 B11R1.605 CCCc1c(Br)cncc1Br Amb27796522 [1,1,0,0,0,0|1,0,0]=3 7388 B11R1.605 CCCc1c(C)cccc1C Amb27635398 [1,1,0,0,0,0|1,0,0]=3 7389 B11R1.605 CCCc1c(C)ccnc1N Amb28346833 [1,1,0,0,0,0|2,0,0]=4 7390 B11R1.605 CCCc1c(C)cncc1Br Amb27462633 [1,1,0,0,0,0|1,0,0]=3 7391 B11R1.605 CCCc1c(C)cncc1C Amb27612873 [1,1,0,0,0,0|2,0,0]=4 7392 B11R1.605 CCCc1c(F)cncc1Br Amb27410561 [1,1,0,0,0,0|1,0,0]=3 7393 B11R1.605 CCCc1c(N)cccc1Br Amb29889680 [1,1,0,0,0,0|0,0,0]=2 7394 B11R1.605 CCCc1c(N)cccc1Cl Amb27268268 [1,1,0,0,0,0|0,1,0]=3 7395 B11R1.605 CCCc1c(N)ccnc1Cl Amb24322866 [1,1,0,0,0,0|1,1,0]=4 7396 B11R1.605 CCCc1c(N)cncc1Br Amb26879749 [1,1,0,0,0,0|1,0,0]=3 7397 B11R1.605 CCCc1c(N)cncc1Cl Amb27768460 [1,1,0,0,0,0|1,1,0]=4 7398 B11R1.605 CCCc1c(O)cccc1O Amb4451079 [1,1,0,0,0,0|1,0,0]=3 7399 B11R1.605 CCNc1c(C)cccc1Br Amb35721364 [1,1,0,0,0,0|1,0,0]=3 7400 B11R1.605 CCNc1c(C)cccc1C Amb13951084 [1,1,0,0,0,0|2,0,0]=4 7401 B11R1.605 CCNc1c(C)cccc1Cl Amb25149187 [1,1,0,0,0,0|1,1,0]=4 7402 B11R1.605 CCNc1c(C)cccc1F Amb25724560 [1,1,0,0,0,0|1,1,0]=4 7403 B11R1.605 CCNc1c(C)cccc1N Amb25362043 [1,1,0,0,0,0|2,0,0]=4 7404 B11R1.605 CCNc1c(Cl)cccc1Cl Amb17306289 [1,1,0,0,0,0|1,1,0]=4 7405 B11R1.605 CCNc1c(F)cccc1Br Amb27164317 [1,1,0,0,0,0|1,0,0]=3 7406 B11R1.605 CCNc1c(F)cccc1Cl Amb27658211 [1,1,0,0,0,0|1,1,0]=4 7407 B11R1.605 CCNc1c(F)cccc1F Amb7760085 [1,1,0,0,0,0|1,1,0]=4 7408 B11R1.605 CCNc1c(N)cccc1Br Amb32708756 [1,1,0,0,0,0|1,0,0]=3 7409 B11R1.605 CCNc1c(N)cccc1Cl Amb7767526 [1,1,0,0,0,0|1,1,0]=4 7410 B11R1.605 CCNc1c(N)cccc1N Amb28208282 [1,1,0,0,0,0|2,0,0]=4 7411 B11R1.605 CCNc1c(N)cncc1Br Amb21963837 [1,1,0,0,0,0|2,0,0]=4 7412 B11R1.605 CCOc1c(Br)cccc1Br Amb25829849 [1,1,0,0,0,0|1,0,0]=3 7413 B11R1.605 CCOc1c(Br)ccnc1Br Amb25705126 [1,1,0,0,0,0|2,0,0]=4 7414 B11R1.605 CCOc1c(Br)ccnc1F Amb32757297 [1,1,0,0,0,0|2,0,0]=4 7415 B11R1.605 CCOc1c(C)cccc1Br Amb19888311 [1,1,0,0,0,0|1,0,0]=3 7416 B11R1.605 CCOc1c(C)cccc1C Amb28351011 [1,1,0,0,0,0|2,0,0]=4 7417 B11R1.605 CCOc1c(C)cccc1N Amb27823129 [1,1,0,0,0,0|2,0,0]=4 7418 B11R1.605 CCOc1c(C)cccc1S Amb27256637 [1,1,0,0,0,0|2,0,0]=4 7419 B11R1.605 CCOc1c(Cl)cccc1Br Amb34911529 [1,1,0,0,0,0|1,0,0]=3 7420 B11R1.605 CCOc1c(Cl)cccc1Cl Amb24658452 [1,1,0,0,0,0|1,1,0]=4 7421 B11R1.605 CCOc1c(Cl)cncc1Br Amb27966183 [1,1,0,0,0,0|2,0,0]=4 7422 B11R1.605 CCOc1c(F)cccc1Br Amb22227885 [1,1,0,0,0,0|1,0,0]=3 7423 B11R1.605 CCOc1c(F)cccc1Cl Amb25736402 [1,1,0,0,0,0|1,1,0]=4 7424 B11R1.605 CCOc1c(F)cccc1F Amb10840419 [1,1,0,0,0,0|1,1,0]=4 7425 B11R1.605 CCOc1c(F)cccc1I Amb27799988 [1,1,0,0,0,0|1,1,0]=4 7426 B11R1.605 CCOc1c(F)cccc1S Amb27219098 [1,1,0,0,0,0|1,1,0]=4 7427 B11R1.605 CCOc1c(F)cncc1Br Amb32674101 [1,1,0,0,0,0|2,0,0]=4 7428 B11R1.605 CCOc1c(N)cccc1Br Amb26371304 [1,1,0,0,0,0|1,0,0]=3 7429 B11R1.605 CCOc1c(N)cccc1Cl Amb10610040 [1,1,0,0,0,0|1,1,0]=4 7430 B11R1.605 CCOc1c(N)cccc1Cl Amb840117 [1,1,0,0,0,0|1,1,0]=4 7431 B11R1.605 CCOc1c(N)cccc1F Amb19891622 [1,1,0,0,0,0|1,1,0]=4 7432 B11R1.605 CCOc1c(N)cccc1N Amb26053559 [1,1,0,0,0,0|2,0,0]=4 7433 B11R1.605 CCOc1c(N)cccc1S Amb25703672 [1,1,0,0,0,0|2,0,0]=4 7434 B11R1.605 CCOc1c(N)cncc1Br Amb25323657 [1,1,0,0,0,0|2,0,0]=4 7435 B11R1.605 CCOc1c(O)cccc1Cl Amb28202148 [1,1,0,0,0,0|1,1,0]=4 7436 B11R1.605 CCOc1c(O)cccc1F Amb22228803 [1,1,0,0,0,0|1,1,0]=4 7437 B11R1.605 CCOc1c(O)cccc1S Amb26996225 [1,1,0,0,0,0|2,0,0]=4 7438 B11R1.605 CCSc1c(Br)cccc1Br Amb25710426 [1,1,0,0,0,0|1,0,0]=3 7439 B11R1.605 CCSc1c(Br)cccc1I Amb27219154 [1,1,0,0,0,0|1,0,0]=3 7440 B11R1.605 CCSc1c(C)cccc1Br Amb26597272 [1,1,0,0,0,0|1,0,0]=3 7441 B11R1.605 CCSc1c(C)cccc1N Amb27766762 [1,1,0,0,0,0|2,0,0]=4 7442 B11R1.605 CCSc1c(Cl)cccc1Br Amb24437473 [1,1,0,0,0,0|1,0,0]=3 7443 B11R1.605 CCSc1c(Cl)cccc1Cl Amb25998969 [1,1,0,0,0,0|1,1,0]=4 7444 B11R1.605 CCSc1c(F)cccc1Br Amb25371884 [1,1,0,0,0,0|1,0,0]=3 7445 B11R1.605 CCSc1c(N)cccc1Br Amb26596423 [1,1,0,0,0,0|1,0,0]=3 7446 B11R1.605 CCSc1c(O)cccc1Br Amb27436181 [1,1,0,0,0,0|1,0,0]=3 7447 B11R1.605 CNCc1c(Br)cccc1Br Amb25119605 [1,1,0,0,0,0|0,0,0]=2 7448 B11R1.605 CNCc1c(Br)cncc1Br Amb25991656 [1,1,0,0,0,0|1,0,0]=3 7449 B11R1.605 CNCc1c(C)cccc1C Amb26484509 [1,1,0,0,0,0|1,0,0]=3 7450 B11R1.605 CNCc1c(C)cccc1C Amb30584644 [1,1,0,0,0,0|1,0,0]=3 7451 B11R1.605 CNCc1c(C)cccc1Cl Amb25311475 [1,1,0,0,0,0|0,1,0]=3 7452 B11R1.605 CNCc1c(C)cccc1F Amb25803639 [1,1,0,0,0,0|0,1,0]=3 7453 B11R1.605 CNCc1c(C)cccc1O Amb27964545 [1,1,0,0,0,0|1,0,0]=3 7454 B11R1.605 CNCc1c(Cl)cccc1Br Amb25087384 [1,1,0,0,0,0|0,0,0]=2 7455 B11R1.605 CNCc1c(Cl)cccc1Cl Amb19957435 [1,1,0,0,0,0|0,1,0]=3 7456 B11R1.605 CNCc1c(Cl)cccc1Cl Amb837845 [1,1,0,0,0,0|0,1,0]=3 7457 B11R1.605 CNCc1c(Cl)cncc1Cl Amb33260860 [1,1,0,0,0,0|1,1,0]=4 7458 B11R1.605 CNCc1c(F)cccc1Br Amb19929944 [1,1,0,0,0,0|0,0,0]=2 7459 B11R1.605 CNCc1c(F)cccc1Cl Amb1648533 [1,1,0,0,0,0|0,1,0]=3 7460 B11R1.605 CNCc1c(F)cccc1Cl Amb6891826 [1,1,0,0,0,0|0,1,0]=3 7461 B11R1.605 CNCc1c(F)cccc1F Amb1135037 [1,1,0,0,0,0|0,1,0]=3 7462 B11R1.605 CNCc1c(F)cncc1F Amb32993245 [1,1,0,0,0,0|1,1,0]=4 7463 B11R1.605 CNCc1c(O)cccc1Br Amb33451785 [1,1,0,0,0,0|0,0,0]=2 7464 B11R1.605 CNCc1c(O)cccc1Cl Amb26620244 [1,1,0,0,0,0|0,1,0]=3 7465 B11R1.605 COCc1c(C)cccc1N Amb32795034 [1,1,0,0,0,0|2,0,0]=4 7466 B11R1.605 COCc1c(Cl)cccc1Cl Amb6365635 [1,1,0,0,0,0|1,1,0]=4 7467 B11R1.605 COCc1c(N)cccc1Br Amb9003120 [1,1,0,0,0,0|1,0,0]=3 7468 B11R1.605 COCc1c(N)cccc1Cl Amb22059316 [1,1,0,0,0,0|1,1,0]=4 7469 B11R1.605 COCc1c(N)cccc1Cl Amb33549634 [1,1,0,0,0,0|1,1,0]=4 7470 B11R1.605 COCc1c(N)cccc1F Amb27489628 [1,1,0,0,0,0|1,1,0]=4 7471 B11R1.605 CSCN1C(=O)C=CC=C1Br Amb28201544 [1,1,0,0,0,0|2,0,0]=4 7472 B11R1.605 CSCc1c(C)cccc1C Amb24633035 [1,1,0,0,0,0|2,0,0]=4 7473 B11R1.605 CSCc1c(F)cccc1Cl Amb25924054 [1,1,0,0,0,0|1,1,0]=4 7474 B11R1.605 CSCc1c(N)cccc1Cl Amb18129731 [1,1,0,0,0,0|1,1,0]=4 7475 B11R1.605 CSCc1c(N)cccc1F Amb23571431 [1,1,0,0,0,0|1,1,0]=4 7476 B11R1.605 Cc1cccc(C)c1CCBr Amb26558234 [1,1,0,0,0,0|2,0,0]=4 7477 B11R1.605 Cc1cccc(C)c1CCN Amb10844885 [1,1,0,0,0,0|1,0,0]=3 7478 B11R1.605 Cc1cccc(C)c1CCO Amb22228066 [1,1,0,0,0,0|2,0,0]=4 7479 B11R1.605 Cc1cccc(C)c1CCS Amb32726844 [1,1,0,0,0,0|2,0,0]=4 7480 B11R1.605 Cc1cccc(C)c1CNN Amb24358731 [1,1,0,0,0,0|2,0,0]=4 7481 B11R1.605 Cc1cccc(C)c1CNO Amb24701974 [1,1,0,0,0,0|2,0,0]=4 7482 B11R1.605 Cc1cccc(C)c1CON Amb26658695 [1,1,0,0,0,0|2,0,0]=4 7483 B11R1.605 Cc1cccc(Cl)c1CCBr Amb33336950 [1,1,0,0,0,0|1,1,0]=4 7484 B11R1.605 Cc1cccc(Cl)c1CCN Amb26969734 [1,1,0,0,0,0|0,1,0]=3 7485 B11R1.605 Cc1cccc(Cl)c1CCO Amb33259717 [1,1,0,0,0,0|1,1,0]=4 7486 B11R1.605 Cc1cccc(Cl)c1CCS Amb33260080 [1,1,0,0,0,0|1,1,0]=4 7487 B11R1.605 Cc1cccc(Cl)c1CNN Amb33259447 [1,1,0,0,0,0|1,1,0]=4 7488 B11R1.605 Cc1cccc(Cl)c1CNO Amb33259415 [1,1,0,0,0,0|1,1,0]=4 7489 B11R1.605 Cc1cccc(Cl)c1CON Amb25341196 [1,1,0,0,0,0|1,1,0]=4 7490 B11R1.605 Cc1cccc(F)c1CCBr Amb33433484 [1,1,0,0,0,0|1,1,0]=4 7491 B11R1.605 Cc1cccc(F)c1CCN Amb25909792 [1,1,0,0,0,0|0,1,0]=3 7492 B11R1.605 Cc1cccc(F)c1CCO Amb33143469 [1,1,0,0,0,0|1,1,0]=4 7493 B11R1.605 Cc1cccc(F)c1CCS Amb33148310 [1,1,0,0,0,0|1,1,0]=4 7494 B11R1.605 Cc1cccc(F)c1CNN Amb33143402 [1,1,0,0,0,0|1,1,0]=4 7495 B11R1.605 Cc1cccc(F)c1CNO Amb25242759 [1,1,0,0,0,0|1,1,0]=4 7496 B11R1.605 Cc1cccc(F)c1CON Amb28182539 [1,1,0,0,0,0|1,1,0]=4 7497 B11R1.605 Cc1cncc(C)c1CCN Amb18201834 [1,1,0,0,0,0|2,0,0]=4 7498 B11R1.605 Cc1cncc(Cl)c1CCN Amb28293003 [1,1,0,0,0,0|1,1,0]=4 7499 B11R1.605 ClCCc1c(Br)cccc1Br Amb23402713 [1,1,0,0,0,0|1,0,0]=3 7500 B11R1.605 ClCCc1c(Cl)cccc1Cl Amb24386419 [1,1,0,0,0,0|1,1,0]=4 7501 B11R1.605 ClCOc1c(Br)cccc1Br Amb27215922 [1,1,0,0,0,0|2,0,0]=4 7502 B11R1.605 Clc1cccc(Cl)c1CCBr Amb22228373 [1,1,0,0,0,0|1,1,0]=4 7503 B11R1.605 Clc1cccc(Cl)c1CCI Amb27494877 [1,1,0,0,0,0|1,1,0]=4 7504 B11R1.605 Fc1cccc(Br)c1CCBr Amb28244992 [1,1,0,0,0,0|1,0,0]=3 7505 B11R1.605 Fc1cccc(Br)c1CCCl Amb27751248 [1,1,0,0,0,0|1,0,0]=3 7506 B11R1.605 Fc1cccc(Br)c1CCS Amb33478469 [1,1,0,0,0,0|1,0,0]=3 7507 B11R1.605 Fc1cccc(Br)c1OCCl Amb32685635 [1,1,0,0,0,0|2,0,0]=4 7508 B11R1.605 Fc1cccc(Cl)c1CCBr Amb20623684 [1,1,0,0,0,0|1,1,0]=4 7509 B11R1.605 Fc1cccc(Cl)c1CCCl Amb33545972 [1,1,0,0,0,0|1,1,0]=4 7510 B11R1.605 Fc1cccc(Cl)c1CCS Amb17401472 [1,1,0,0,0,0|1,1,0]=4 7511 B11R1.605 Fc1cccc(F)c1CCBr Amb26630775 [1,1,0,0,0,0|1,1,0]=4 7512 B11R1.605 Fc1cccc(F)c1CCCl Amb25303279 [1,1,0,0,0,0|1,1,0]=4 7513 B11R1.605 Fc1cccc(F)c1CCS Amb33080214 [1,1,0,0,0,0|1,1,0]=4 7514 B11R1.605 N#CCc1c(Br)cccc1Br Amb20248067 [1,1,0,0,0,0|0,0,2]=4 7515 B11R1.605 N#CCc1c(Br)cccc1I Amb23412436 [1,1,0,0,0,0|0,0,2]=4 7516 B11R1.605 N#CCc1c(Cl)cccc1Br Amb23412435 [1,1,0,0,0,0|0,0,2]=4 7517 B11R1.605 N#CCc1c(F)cccc1Br Amb22044248 [1,1,0,0,0,0|0,0,2]=4 7518 B11R1.605 N#CCc1c(N)cccc1Br Amb27199742 [1,1,0,0,0,0|0,0,2]=4 7519 B11R1.605 NCCN1C(=O)C=CC=C1Br Amb18040578 [1,1,0,0,0,0|1,0,0]=3 7520 B11R1.605 NCCc1c(Br)cccc1Br Amb23412437 [1,1,0,0,0,0|0,0,0]=2 7521 B11R1.605 NCCc1c(Br)cncc1Br Amb26003887 [1,1,0,0,0,0|1,0,0]=3 7522 B11R1.605 NCCc1c(Br)cncc1Br Amb33621046 [1,1,0,0,0,0|1,0,0]=3 7523 B11R1.605 NCCc1c(Br)cncc1Br Amb33741723 [1,1,0,0,0,0|1,0,0]=3 7524 B11R1.605 NCCc1c(Cl)cccc1Br Amb24334629 [1,1,0,0,0,0|0,0,0]=2 7525 B11R1.605 NCCc1c(Cl)cccc1Cl Amb22224894 [1,1,0,0,0,0|0,1,0]=3 7526 B11R1.605 NCCc1c(Cl)cccc1Cl Amb2686898 [1,1,0,0,0,0|0,1,0]=3 7527 B11R1.605 NCCc1c(Cl)ccnc1Cl Amb27457865 [1,1,0,0,0,0|1,1,0]=4 7528 B11R1.605 NCCc1c(Cl)ccnc1F Amb27879780 [1,1,0,0,0,0|1,1,0]=4 7529 B11R1.605 NCCc1c(Cl)cncc1Cl Amb25292175 [1,1,0,0,0,0|1,1,0]=4 7530 B11R1.605 NCCc1c(F)cccc1Cl Amb20625679 [1,1,0,0,0,0|0,1,0]=3 7531 B11R1.605 NCCc1c(F)cccc1Cl Amb2372426 [1,1,0,0,0,0|0,1,0]=3 7532 B11R1.605 NCCc1c(F)cccc1F Amb6243797 [1,1,0,0,0,0|0,1,0]=3 7533 B11R1.605 NCCc1c(F)cncc1Cl Amb28279978 [1,1,0,0,0,0|1,1,0]=4 7534 B11R1.605 NCCc1c(F)cncc1F Amb8011390 [1,1,0,0,0,0|1,1,0]=4 7535 B11R1.605 NCCc1c(N)cccc1F Amb27240267 [1,1,0,0,0,0|0,1,0]=3 7536 B11R1.605 NCCc1c(O)cccc1Br Amb33452126 [1,1,0,0,0,0|0,0,0]=2 7537 B11R1.605 NCCc1c(O)cccc1Cl Amb26371253 [1,1,0,0,0,0|0,1,0]=3 7538 B11R1.605 NNCc1c(Br)cccc1Br Amb33451215 [1,1,0,0,0,0|1,0,0]=3 7539 B11R1.605 NNCc1c(Br)cncc1Br Amb27966984 [1,1,0,0,0,0|2,0,0]=4 7540 B11R1.605 NNCc1c(Cl)cccc1Br Amb26858392 [1,1,0,0,0,0|1,0,0]=3 7541 B11R1.605 NNCc1c(Cl)cccc1Cl Amb2607595 [1,1,0,0,0,0|1,1,0]=4 7542 B11R1.605 NNCc1c(Cl)cccc1Cl Amb33552692 [1,1,0,0,0,0|1,1,0]=4 7543 B11R1.605 NNCc1c(F)cccc1Br Amb26003888 [1,1,0,0,0,0|1,0,0]=3 7544 B11R1.605 NNCc1c(F)cccc1Cl Amb10841869 [1,1,0,0,0,0|1,1,0]=4 7545 B11R1.605 NNCc1c(F)cccc1Cl Amb1111957 [1,1,0,0,0,0|1,1,0]=4 7546 B11R1.605 NNCc1c(F)cccc1F Amb6243762 [1,1,0,0,0,0|1,1,0]=4 7547 B11R1.605 NNCc1c(O)cccc1Br Amb33431132 [1,1,0,0,0,0|1,0,0]=3 7548 B11R1.605 NNCc1c(O)cccc1Cl Amb33261083 [1,1,0,0,0,0|1,1,0]=4 7549 B11R1.605 NOCc1c(Br)cccc1Br Amb32807614 [1,1,0,0,0,0|1,0,0]=3 7550 B11R1.605 NOCc1c(Br)cncc1Br Amb33477211 [1,1,0,0,0,0|2,0,0]=4 7551 B11R1.605 NOCc1c(Cl)cccc1Br Amb24436631 [1,1,0,0,0,0|1,0,0]=3 7552 B11R1.605 NOCc1c(Cl)cccc1Cl Amb17091442 [1,1,0,0,0,0|1,1,0]=4 7553 B11R1.605 NOCc1c(F)cccc1Br Amb33430008 [1,1,0,0,0,0|1,0,0]=3 7554 B11R1.605 NOCc1c(F)cccc1Cl Amb17091430 [1,1,0,0,0,0|1,1,0]=4 7555 B11R1.605 NOCc1c(F)cccc1Cl Amb19894374 [1,1,0,0,0,0|1,1,0]=4 7556 B11R1.605 NOCc1c(F)cccc1F Amb25936408 [1,1,0,0,0,0|1,1,0]=4 7557 B11R1.605 NOCc1c(O)cccc1Br Amb33431134 [1,1,0,0,0,0|1,0,0]=3 7558 B11R1.605 NOCc1c(O)cccc1Cl Amb33261086 [1,1,0,0,0,0|1,1,0]=4 7559 B11R1.605 N\N=C\c1c(F)cccc1Br Amb27977270 [1,1,0,0,0,0|1,0,1]=4 7560 B11R1.605 Nc1cccc(Br)c1CCO Amb18657905 [1,1,0,0,0,0|1,0,0]=3 7561 B11R1.605 Nc1cccc(Cl)c1CCCl Amb28384702 [1,1,0,0,0,0|1,1,0]=4 7562 B11R1.605 Nc1cccc(Cl)c1CCO Amb6328001 [1,1,0,0,0,0|1,1,0]=4 7563 B11R1.605 O=C1C=CC=C(Br)N1CCF Amb28281228 [1,1,0,0,0,0|2,0,0]=4 7564 B11R1.605 O=C1C=CC=C(Br)N1CCO Amb18543063 [1,1,0,0,0,0|2,0,0]=4 7565 B11R1.605 O=CCc1c(Br)cccc1Br Amb23412438 [1,1,0,0,0,0|1,0,1]=4 7566 B11R1.605 O=CCc1c(Cl)cccc1Br Amb28365688 [1,1,0,0,0,0|1,0,1]=4 7567 B11R1.605 O=CCc1c(F)cccc1Br Amb27785822 [1,1,0,0,0,0|1,0,1]=4 7568 B11R1.605 O=CCc1c(O)cccc1Br Amb33431184 [1,1,0,0,0,0|1,0,1]=4 7569 B11R1.605 OCCc1c(Br)cccc1Br Amb23402712 [1,1,0,0,0,0|1,0,0]=3 7570 B11R1.605 OCCc1c(Br)cccc1I Amb27840023 [1,1,0,0,0,0|1,0,0]=3 7571 B11R1.605 OCCc1c(Br)cncc1Br Amb24738830 [1,1,0,0,0,0|2,0,0]=4 7572 B11R1.605 OCCc1c(Cl)cccc1Br Amb24647247 [1,1,0,0,0,0|1,0,0]=3 7573 B11R1.605 OCCc1c(Cl)cccc1Cl Amb2720460 [1,1,0,0,0,0|1,1,0]=4 7574 B11R1.605 OCCc1c(F)cccc1Br Amb27965127 [1,1,0,0,0,0|1,0,0]=3 7575 B11R1.605 OCCc1c(F)cccc1Cl Amb6336630 [1,1,0,0,0,0|1,1,0]=4 7576 B11R1.605 OCCc1c(F)cccc1F Amb21964546 [1,1,0,0,0,0|1,1,0]=4 7577 B11R1.605 OCCc1c(F)cncc1Br Amb32945795 [1,1,0,0,0,0|2,0,0]=4 7578 B11R1.605 OCCc1c(O)cccc1Br Amb27424112 [1,1,0,0,0,0|1,0,0]=3 7579 B11R1.605 OCCc1c(O)cccc1Cl Amb33260731 [1,1,0,0,0,0|1,1,0]=4 7580 B11R1.605 OCCc1c(O)cccc1O Amb24545678 [1,1,0,0,0,0|2,0,0]=4 7581 B11R1.605 ONCc1c(Br)cccc1Br Amb33010655 [1,1,0,0,0,0|1,0,0]=3 7582 B11R1.605 ONCc1c(Br)cncc1Br Amb26552551 [1,1,0,0,0,0|2,0,0]=4 7583 B11R1.605 ONCc1c(Cl)cccc1Br Amb33335881 [1,1,0,0,0,0|1,0,0]=3 7584 B11R1.605 ONCc1c(Cl)cccc1Cl Amb27466734 [1,1,0,0,0,0|1,1,0]=4 7585 B11R1.605 ONCc1c(F)cccc1Br Amb28345351 [1,1,0,0,0,0|1,0,0]=3 7586 B11R1.605 ONCc1c(F)cccc1Cl Amb25150227 [1,1,0,0,0,0|1,1,0]=4 7587 B11R1.605 ONCc1c(F)cccc1F Amb28348044 [1,1,0,0,0,0|1,1,0]=4 7588 B11R1.605 ONCc1c(O)cccc1Br Amb33452273 [1,1,0,0,0,0|1,0,0]=3 7589 B11R1.605 ONCc1c(O)cccc1Cl Amb25188745 [1,1,0,0,0,0|1,1,0]=4 7590 B11R1.605 Oc1cccc(Br)c1CCBr Amb24559323 [1,1,0,0,0,0|1,0,0]=3 7591 B11R1.605 Oc1cccc(Br)c1CCS Amb33336545 [1,1,0,0,0,0|1,0,0]=3 7592 B11R1.605 Oc1cccc(Cl)c1CCBr Amb33332331 [1,1,0,0,0,0|1,1,0]=4 7593 B11R1.605 Oc1cccc(Cl)c1CCS Amb33256181 [1,1,0,0,0,0|1,1,0]=4 7594 B11R1.605 SCCc1c(Cl)cccc1Br Amb33333766 [1,1,0,0,0,0|1,0,0]=3 7595 B11R1.605 SCCc1c(Cl)cccc1Cl Amb33052742 [1,1,0,0,0,0|1,1,0]=4 7596 B11R1.605 [C-]#[N+]Cc1c(Br)cccc1Br Amb33009384 [1,1,0,0,0,0|0,0,2]=4 7597 B11R1.605 [C-]#[N+]Cc1c(Cl)cccc1Br Amb33336228 [1,1,0,0,0,0|0,0,2]=4 7598 B11R1.605 [C-]#[N+]Cc1c(F)cccc1Br Amb33429989 [1,1,0,0,0,0|0,0,2]=4 7599 B11R1.605 [NH3+]CCc1c(F)cccc1Cl Amb33513109 [1,1,0,0,0,0|0,1,1]=4 7600 B11R1.1 BrCCCc1ccc(Br)cc1 Amb17104577 [1,1,0,0,0,0|2,0,0]=4 7601 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [1,1,0,0,0,0|2,0,0]=4 7602 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [1,1,0,0,0,0|1,0,1]=4 7603 B11R1.1 C#CCCc1ccc(C)cc1 Amb18634818 [1,1,0,0,0,0|1,0,1]=4 7604 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [1,1,0,0,0,0|1,0,1]=4 7605 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [1,1,0,0,0,0|1,0,1]=4 7606 B11R1.1 C#CCCc1ccc(O)cc1 Amb26053114 [1,1,0,0,0,0|1,0,1]=4 7607 B11R1.1 C=CCCc1ccc(Br)cc1 Amb6298956 [1,1,0,0,0,0|1,0,1]=4 7608 B11R1.1 C=CCCc1ccc(C)cc1 Amb6299000 [1,1,0,0,0,0|1,0,1]=4 7609 B11R1.1 C=CCCc1ccc(F)cc1 Amb2721507 [1,1,0,0,0,0|1,0,1]=4 7610 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [1,1,0,0,0,0|1,0,1]=4 7611 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [1,1,0,0,0,0|2,0,0]=4 7612 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [1,1,0,0,0,0|2,0,0]=4 7613 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [1,1,0,0,0,0|2,0,0]=4 7614 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb9825673 [1,1,0,0,0,0|2,0,0]=4 7615 B11R1.1 CCCCc1ccc(Br)cc1 Amb3939176 [1,1,0,0,0,0|1,0,0]=3 7616 B11R1.1 CCCCc1ccc(C)cc1 Amb22002059 [1,1,0,0,0,0|1,0,0]=3 7617 B11R1.1 CCCCc1ccc(Cl)cc1 Amb6365908 [1,1,0,0,0,0|1,0,0]=3 7618 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [1,1,0,0,0,0|1,0,0]=3 7619 B11R1.1 CCCCc1ccc(I)cc1 Amb2726236 [1,1,0,0,0,0|1,0,0]=3 7620 B11R1.1 CCCCc1ccc(N)cc1 Amb2721121 [1,1,0,0,0,0|1,0,0]=3 7621 B11R1.1 CCCCc1ccc(N)cn1 Amb26866351 [1,1,0,0,0,0|2,0,0]=4 7622 B11R1.1 CCCCc1ccc(N)nc1 Amb26477797 [1,1,0,0,0,0|2,0,0]=4 7623 B11R1.1 CCCCc1ccc(O)cc1 Amb2778508 [1,1,0,0,0,0|1,0,0]=3 7624 B11R1.1 CCCCc1ccc(O)cn1 Amb25831110 [1,1,0,0,0,0|2,0,0]=4 7625 B11R1.1 CCCCc1ccc(S)cc1 Amb2685702 [1,1,0,0,0,0|1,0,0]=3 7626 B11R1.1 CCCNc1ccc(Br)cc1 Amb29083384 [1,1,0,0,0,0|2,0,0]=4 7627 B11R1.1 CCCNc1ccc(Br)cc1 Amb4313508 [1,1,0,0,0,0|2,0,0]=4 7628 B11R1.1 CCCNc1ccc(C)cc1 Amb4313501 [1,1,0,0,0,0|2,0,0]=4 7629 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [1,1,0,0,0,0|2,0,0]=4 7630 B11R1.1 CCCNc1ccc(Cl)cc1 Amb4313503 [1,1,0,0,0,0|2,0,0]=4 7631 B11R1.1 CCCNc1ccc(F)cc1 Amb4313509 [1,1,0,0,0,0|2,0,0]=4 7632 B11R1.1 CCCNc1ccc(I)cc1 Amb7784946 [1,1,0,0,0,0|2,0,0]=4 7633 B11R1.1 CCCOc1ccc(Br)cc1 Amb3428588 [1,1,0,0,0,0|2,0,0]=4 7634 B11R1.1 CCCOc1ccc(C)cc1 Amb26409646 [1,1,0,0,0,0|2,0,0]=4 7635 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [1,1,0,0,0,0|2,0,0]=4 7636 B11R1.1 CCCOc1ccc(N)cc1 Amb1125044 [1,1,0,0,0,0|2,0,0]=4 7637 B11R1.1 CCCOc1ccc(N)cc1 Amb32409662 [1,1,0,0,0,0|2,0,0]=4 7638 B11R1.1 CCCOc1ccc(O)cc1 Amb1810008 [1,1,0,0,0,0|2,0,0]=4 7639 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [1,1,0,0,0,0|2,0,0]=4 7640 B11R1.1 CCCSc1ccc(Br)cc1 Amb28184382 [1,1,0,0,0,0|2,0,0]=4 7641 B11R1.1 CCCSc1ccc(C)cc1 Amb4035211 [1,1,0,0,0,0|2,0,0]=4 7642 B11R1.1 CCCSc1ccc(Cl)cc1 Amb27466470 [1,1,0,0,0,0|2,0,0]=4 7643 B11R1.1 CCCSc1ccc(F)cc1 Amb28365659 [1,1,0,0,0,0|2,0,0]=4 7644 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [1,1,0,0,0,0|2,0,0]=4 7645 B11R1.1 CCCSc1ccc(N)cc1 Amb6680313 [1,1,0,0,0,0|2,0,0]=4 7646 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [1,1,0,0,0,0|2,0,0]=4 7647 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [1,1,0,0,0,0|2,0,0]=4 7648 B11R1.1 CCNCc1ccc(Br)cc1 Amb6864710 [1,1,0,0,0,0|2,0,0]=4 7649 B11R1.1 CCNCc1ccc(Br)cc1 Amb837745 [1,1,0,0,0,0|2,0,0]=4 7650 B11R1.1 CCNCc1ccc(C)cc1 Amb32667090 [1,1,0,0,0,0|2,0,0]=4 7651 B11R1.1 CCNCc1ccc(C)cc1 Amb837583 [1,1,0,0,0,0|2,0,0]=4 7652 B11R1.1 CCNCc1ccc(Cl)cc1 Amb6542591 [1,1,0,0,0,0|2,0,0]=4 7653 B11R1.1 CCNCc1ccc(Cl)cc1 Amb837762 [1,1,0,0,0,0|2,0,0]=4 7654 B11R1.1 CCNCc1ccc(F)cc1 Amb6864711 [1,1,0,0,0,0|2,0,0]=4 7655 B11R1.1 CCNCc1ccc(F)cc1 Amb838198 [1,1,0,0,0,0|2,0,0]=4 7656 B11R1.1 CCNCc1ccc(O)cc1 Amb13952053 [1,1,0,0,0,0|2,0,0]=4 7657 B11R1.1 CCNCc1ccc(O)cc1 Amb6257941 [1,1,0,0,0,0|2,0,0]=4 7658 B11R1.1 CCNCc1ccc(S)cc1 Amb27952729 [1,1,0,0,0,0|2,0,0]=4 7659 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [1,1,0,0,0,0|2,0,0]=4 7660 B11R1.1 CCOCc1ccc(C)cc1 Amb33733834 [1,1,0,0,0,0|2,0,0]=4 7661 B11R1.1 CCOCc1ccc(Cl)cc1 Amb25977812 [1,1,0,0,0,0|2,0,0]=4 7662 B11R1.1 CCOCc1ccc(F)cc1 Amb30594745 [1,1,0,0,0,0|2,0,0]=4 7663 B11R1.1 CCOCc1ccc(N)cc1 Amb1125782 [1,1,0,0,0,0|2,0,0]=4 7664 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [1,1,0,0,0,0|2,0,0]=4 7665 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [1,1,0,0,0,0|2,0,0]=4 7666 B11R1.1 CCSCc1ccc(C)cc1 Amb24536616 [1,1,0,0,0,0|2,0,0]=4 7667 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [1,1,0,0,0,0|2,0,0]=4 7668 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [1,1,0,0,0,0|2,0,0]=4 7669 B11R1.1 CCSCc1ccc(N)cc1 Amb6680506 [1,1,0,0,0,0|2,0,0]=4 7670 B11R1.1 CNCCc1ccc(Br)cc1 Amb9214717 [1,1,0,0,0,0|0,0,0]=2 7671 B11R1.1 CNCCc1ccc(Br)cn1 Amb26912040 [1,1,0,0,0,0|1,0,0]=3 7672 B11R1.1 CNCCc1ccc(Br)nc1 Amb33387712 [1,1,0,0,0,0|1,0,0]=3 7673 B11R1.1 CNCCc1ccc(C)cc1 Amb8853647 [1,1,0,0,0,0|0,0,0]=2 7674 B11R1.1 CNCCc1ccc(C)cn1 Amb18125195 [1,1,0,0,0,0|1,0,0]=3 7675 B11R1.1 CNCCc1ccc(C)nc1 Amb26888747 [1,1,0,0,0,0|1,0,0]=3 7676 B11R1.1 CNCCc1ccc(Cl)cc1 Amb32789565 [1,1,0,0,0,0|0,0,0]=2 7677 B11R1.1 CNCCc1ccc(Cl)cc1 Amb5785545 [1,1,0,0,0,0|0,0,0]=2 7678 B11R1.1 CNCCc1ccc(Cl)cn1 Amb28369544 [1,1,0,0,0,0|1,0,0]=3 7679 B11R1.1 CNCCc1ccc(Cl)nc1 Amb33261516 [1,1,0,0,0,0|1,0,0]=3 7680 B11R1.1 CNCCc1ccc(F)cc1 Amb33483732 [1,1,0,0,0,0|0,0,0]=2 7681 B11R1.1 CNCCc1ccc(F)cc1 Amb5785548 [1,1,0,0,0,0|0,0,0]=2 7682 B11R1.1 CNCCc1ccc(F)cn1 Amb26958172 [1,1,0,0,0,0|1,0,0]=3 7683 B11R1.1 CNCCc1ccc(F)nc1 Amb25869882 [1,1,0,0,0,0|1,0,0]=3 7684 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [1,1,0,0,0,0|0,0,0]=2 7685 B11R1.1 CNCCc1ccc(O)cc1 Amb15690577 [1,1,0,0,0,0|0,0,0]=2 7686 B11R1.1 CNCCc1ccc(O)cc1 Amb2698071 [1,1,0,0,0,0|0,0,0]=2 7687 B11R1.1 CNCCc1cnc(C)cn1 Amb33377403 [1,1,0,0,0,0|2,0,0]=4 7688 B11R1.1 CNCCc1cnc(C)nc1 Amb27466184 [1,1,0,0,0,0|2,0,0]=4 7689 B11R1.1 CNCCc1cnc(N)nc1 Amb27193859 [1,1,0,0,0,0|2,0,0]=4 7690 B11R1.1 CNCCc1cnc(S)nc1 Amb27209411 [1,1,0,0,0,0|2,0,0]=4 7691 B11R1.1 CNCCc1ncc(Br)cn1 Amb25189084 [1,1,0,0,0,0|2,0,0]=4 7692 B11R1.1 CNCCc1ncc(Br)cn1 Amb31156653 [1,1,0,0,0,0|2,0,0]=4 7693 B11R1.1 CNCCc1ncc(C)cn1 Amb27248049 [1,1,0,0,0,0|2,0,0]=4 7694 B11R1.1 CNCCc1ncc(Cl)cn1 Amb33494233 [1,1,0,0,0,0|2,0,0]=4 7695 B11R1.1 CN\C=N\c1ccc(C)cc1 Amb27596513 [1,1,0,0,0,0|1,0,1]=4 7696 B11R1.1 CN\N=C\c1ccc(Cl)cc1 Amb27484285 [1,1,0,0,0,0|1,0,1]=4 7697 B11R1.1 CN\N=C\c1ccc(F)cc1 Amb17805862 [1,1,0,0,0,0|1,0,1]=4 7698 B11R1.1 CN\N=C\c1ccc(O)cc1 Amb17696985 [1,1,0,0,0,0|1,0,1]=4 7699 B11R1.1 COCC[n+]1ccc(C)cc1 Amb27178652 [1,1,0,0,0,0|2,0,0]=4 7700 B11R1.1 COCCc1ccc(Br)cc1 Amb6257601 [1,1,0,0,0,0|1,0,0]=3 7701 B11R1.1 COCCc1ccc(Br)cn1 Amb27589014 [1,1,0,0,0,0|2,0,0]=4 7702 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [1,1,0,0,0,0|1,0,0]=3 7703 B11R1.1 COCCc1ccc(N)cc1 Amb1139224 [1,1,0,0,0,0|1,0,0]=3 7704 B11R1.1 COCCc1ccc(N)cc1 Amb33551018 [1,1,0,0,0,0|1,0,0]=3 7705 B11R1.1 COCCc1ccc(O)cc1 Amb3939657 [1,1,0,0,0,0|1,0,0]=3 7706 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [1,1,0,0,0,0|2,0,0]=4 7707 B11R1.1 COCOc1ccc(Cl)cc1 Amb26860995 [1,1,0,0,0,0|2,0,0]=4 7708 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [1,1,0,0,0,0|2,0,0]=4 7709 B11R1.1 COCOc1ccc(I)cc1 Amb26900030 [1,1,0,0,0,0|2,0,0]=4 7710 B11R1.1 COCOc1ccc(N)cc1 Amb33547964 [1,1,0,0,0,0|2,0,0]=4 7711 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [1,1,0,0,0,0|2,0,0]=4 7712 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [1,1,0,0,0,0|2,0,0]=4 7713 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [1,1,0,0,0,0|2,0,0]=4 7714 B11R1.1 CONCc1ccc(Cl)cc1 Amb27860837 [1,1,0,0,0,0|2,0,0]=4 7715 B11R1.1 CONCc1ccc(F)cc1 Amb26495017 [1,1,0,0,0,0|2,0,0]=4 7716 B11R1.1 CSCCc1ccc(Br)cn1 Amb27867853 [1,1,0,0,0,0|2,0,0]=4 7717 B11R1.1 CSCCc1ccc(C)cc1 Amb27404222 [1,1,0,0,0,0|1,0,0]=3 7718 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [1,1,0,0,0,0|1,0,0]=3 7719 B11R1.1 CSCSc1ccc(O)cc1 Amb27762489 [1,1,0,0,0,0|2,0,0]=4 7720 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [1,1,0,0,0,0|1,0,1]=4 7721 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [1,1,0,0,0,0|1,0,1]=4 7722 B11R1.1 Cc1ccc(CCC#N)cc1 Amb17204297 [1,1,0,0,0,0|2,0,0]=4 7723 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [1,1,0,0,0,0|2,0,0]=4 7724 B11R1.1 Cc1ccc(CCCBr)cc1 Amb17104554 [1,1,0,0,0,0|2,0,0]=4 7725 B11R1.1 Cc1ccc(CCCCl)cc1 Amb17104527 [1,1,0,0,0,0|2,0,0]=4 7726 B11R1.1 Cc1ccc(CCCN)cc1 Amb844761 [1,1,0,0,0,0|2,0,0]=4 7727 B11R1.1 Cc1ccc(CCCO)cc1 Amb3372062 [1,1,0,0,0,0|2,0,0]=4 7728 B11R1.1 Cc1ccc(CCCS)cc1 Amb17400220 [1,1,0,0,0,0|2,0,0]=4 7729 B11R1.1 Cc1ccc(CCNN)cc1 Amb8842845 [1,1,0,0,0,0|1,0,0]=3 7730 B11R1.1 Cc1ccc(CCON)cc1 Amb33373961 [1,1,0,0,0,0|2,0,0]=4 7731 B11R1.1 Cc1ccc(CC[Mg]Br)cc1 Amb6300498 [1,1,0,0,0,0|2,0,0]=4 7732 B11R1.1 ClCCCc1ccc(Br)cc1 Amb17104549 [1,1,0,0,0,0|2,0,0]=4 7733 B11R1.1 ClCCCc1ccc(Cl)cc1 Amb3429107 [1,1,0,0,0,0|2,0,0]=4 7734 B11R1.1 ClCCCc1ccc(I)cc1 Amb27163564 [1,1,0,0,0,0|2,0,0]=4 7735 B11R1.1 Clc1ccc(CCCBr)cc1 Amb17104562 [1,1,0,0,0,0|2,0,0]=4 7736 B11R1.1 Clc1ccc(CC[Mg]Br)cc1 Amb6300494 [1,1,0,0,0,0|2,0,0]=4 7737 B11R1.1 Fc1ccc(CCCBr)cc1 Amb17104556 [1,1,0,0,0,0|2,0,0]=4 7738 B11R1.1 Fc1ccc(CCCCl)cc1 Amb17104529 [1,1,0,0,0,0|2,0,0]=4 7739 B11R1.1 Fc1ccc(CCCS)cc1 Amb17400333 [1,1,0,0,0,0|2,0,0]=4 7740 B11R1.1 Fc1ccc(CC[Mg]Br)cc1 Amb6300496 [1,1,0,0,0,0|2,0,0]=4 7741 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [1,1,0,0,0,0|2,0,0]=4 7742 B11R1.1 N#CCCc1ccc(Br)cc1 Amb2685460 [1,1,0,0,0,0|2,0,0]=4 7743 B11R1.1 N#CCCc1ccc(Cl)cc1 Amb2686407 [1,1,0,0,0,0|2,0,0]=4 7744 B11R1.1 N#CCCc1ccc(F)cc1 Amb17204299 [1,1,0,0,0,0|2,0,0]=4 7745 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [1,1,0,0,0,0|2,0,0]=4 7746 B11R1.1 N#CCCc1ccc(N)cc1 Amb26509671 [1,1,0,0,0,0|2,0,0]=4 7747 B11R1.1 N#CCCc1ccc(O)cc1 Amb2688782 [1,1,0,0,0,0|2,0,0]=4 7748 B11R1.1 N#CCCc1ccc(S)cc1 Amb27634330 [1,1,0,0,0,0|2,0,0]=4 7749 B11R1.1 NCCCc1ccc(Br)cc1 Amb9304905 [1,1,0,0,0,0|2,0,0]=4 7750 B11R1.1 NCCCc1ccc(Cl)cc1 Amb1092541 [1,1,0,0,0,0|2,0,0]=4 7751 B11R1.1 NCCCc1ccc(Cl)cc1 Amb13952055 [1,1,0,0,0,0|2,0,0]=4 7752 B11R1.1 NCCCc1ccc(F)cc1 Amb28988628 [1,1,0,0,0,0|2,0,0]=4 7753 B11R1.1 NCCCc1ccc(F)cc1 Amb5400261 [1,1,0,0,0,0|2,0,0]=4 7754 B11R1.1 NCCCc1ccc(N)cc1 Amb17477693 [1,1,0,0,0,0|2,0,0]=4 7755 B11R1.1 NCCCc1ccc(N)cc1 Amb34913304 [1,1,0,0,0,0|2,0,0]=4 7756 B11R1.1 NCCCc1ccc(O)cc1 Amb2695306 [1,1,0,0,0,0|2,0,0]=4 7757 B11R1.1 NCCCc1ccc(O)cc1 Amb33548453 [1,1,0,0,0,0|2,0,0]=4 7758 B11R1.1 NNCCc1ccc(Br)cc1 Amb6243917 [1,1,0,0,0,0|1,0,0]=3 7759 B11R1.1 NNCCc1ccc(Cl)cc1 Amb6257002 [1,1,0,0,0,0|1,0,0]=3 7760 B11R1.1 NNCCc1ccc(F)cc1 Amb6245233 [1,1,0,0,0,0|1,0,0]=3 7761 B11R1.1 NNCCc1ccc(I)cc1 Amb27816617 [1,1,0,0,0,0|1,0,0]=3 7762 B11R1.1 NNCCc1ccc(O)cc1 Amb27802782 [1,1,0,0,0,0|1,0,0]=3 7763 B11R1.1 NOCCc1ccc(Br)cc1 Amb33241028 [1,1,0,0,0,0|2,0,0]=4 7764 B11R1.1 NOCCc1ccc(Cl)cc1 Amb28411635 [1,1,0,0,0,0|2,0,0]=4 7765 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [1,1,0,0,0,0|2,0,0]=4 7766 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [1,1,0,0,0,0|2,0,0]=4 7767 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [1,1,0,0,0,0|2,0,0]=4 7768 B11R1.1 Nc1ccc(CCCBr)cc1 Amb27751175 [1,1,0,0,0,0|2,0,0]=4 7769 B11R1.1 Nc1ccc(CCCCl)cc1 Amb17477708 [1,1,0,0,0,0|2,0,0]=4 7770 B11R1.1 Nc1ccc(CCCO)cc1 Amb17477700 [1,1,0,0,0,0|2,0,0]=4 7771 B11R1.1 Nc1ccc(CCCS)cc1 Amb29854940 [1,1,0,0,0,0|2,0,0]=4 7772 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [1,1,0,0,0,0|2,0,0]=4 7773 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [1,1,0,0,0,0|2,0,0]=4 7774 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [1,1,0,0,0,0|2,0,0]=4 7775 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [1,1,0,0,0,0|2,0,0]=4 7776 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [1,1,0,0,0,0|2,0,0]=4 7777 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [1,1,0,0,0,0|2,0,0]=4 7778 B11R1.1 OCCCc1ccc(Br)cc1 Amb13883587 [1,1,0,0,0,0|2,0,0]=4 7779 B11R1.1 OCCCc1ccc(Cl)cc1 Amb2724698 [1,1,0,0,0,0|2,0,0]=4 7780 B11R1.1 OCCCc1ccc(F)cc1 Amb17089497 [1,1,0,0,0,0|2,0,0]=4 7781 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [1,1,0,0,0,0|2,0,0]=4 7782 B11R1.1 OCCCc1ccc(O)cc1 Amb9825857 [1,1,0,0,0,0|2,0,0]=4 7783 B11R1.1 ONCCc1ccc(O)cc1 Amb27409616 [1,1,0,0,0,0|1,0,0]=3 7784 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [1,1,0,0,0,0|2,0,0]=4 7785 B11R1.1 Oc1ccc(CCCCl)cc1 Amb17477722 [1,1,0,0,0,0|2,0,0]=4 7786 B11R1.1 Oc1ccc(CCCS)cc1 Amb26880425 [1,1,0,0,0,0|2,0,0]=4 7787 B11R1.1 SCCCc1ccc(Br)cc1 Amb17407562 [1,1,0,0,0,0|2,0,0]=4 7788 B11R1.1 SCCCc1ccc(Cl)cc1 Amb17401097 [1,1,0,0,0,0|2,0,0]=4 7789 B11R1.1 Sc1ccc(CCCCl)cc1 Amb27233376 [1,1,0,0,0,0|2,0,0]=4 7790 B11R1.1 [C-]#[N+]CCc1ccc(Br)cc1 Amb2685409 [1,1,0,0,0,0|0,0,2]=4 7791 B11R1.1 [C-]#[N+]CCc1ccc(C)cc1 Amb33203684 [1,1,0,0,0,0|0,0,2]=4 7792 B11R1.1 [C-]#[N+]CCc1ccc(Cl)cc1 Amb2686346 [1,1,0,0,0,0|0,0,2]=4 7793 B11R1.1 [C-]#[N+]CCc1ccc(F)cc1 Amb2688287 [1,1,0,0,0,0|0,0,2]=4 7794 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [1,1,0,0,0,0|2,0,0]=4 7795 B11R1.16 C#CCC(Br)c1ccccc1 Amb27841700 [1,1,0,0,0,0|1,0,1]=4 7796 B11R1.16 C#CCC(C)c1ccccc1 Amb18117214 [1,1,0,0,0,0|1,0,1]=4 7797 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [1,1,0,0,0,0|1,0,1]=4 7798 B11R1.16 C#CCC(N)c1ccccc1 Amb6752054 [1,1,0,0,0,0|1,0,1]=4 7799 B11R1.16 C#CCC(O)c1ccccc1 Amb2721611 [1,1,0,0,0,0|1,0,1]=4 7800 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb28423448 [1,1,0,0,0,0|1,0,1]=4 7801 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb33871477 [1,1,0,0,0,0|1,0,1]=4 7802 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [1,1,0,0,0,0|1,0,1]=4 7803 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [1,1,0,0,0,0|1,0,1]=4 7804 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [1,1,0,0,0,0|1,0,1]=4 7805 B11R1.16 C=CCC(Cl)c1ccccc1 Amb27232993 [1,1,0,0,0,0|1,0,1]=4 7806 B11R1.16 C=CCC(N)c1ccccc1 Amb17226687 [1,1,0,0,0,0|1,0,1]=4 7807 B11R1.16 C=CCC(O)c1ccccc1 Amb2389146 [1,1,0,0,0,0|1,0,1]=4 7808 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [1,1,0,0,0,0|1,0,1]=4 7809 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [1,1,0,0,0,0|1,0,1]=4 7810 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [1,1,0,0,0,0|1,0,1]=4 7811 B11R1.16 C=CC[C@H](N)c1ccccc1 Amb27253729 [1,1,0,0,0,0|1,0,1]=4 7812 B11R1.16 C=CC[C@H](O)c1ccccc1 Amb8392356 [1,1,0,0,0,0|1,0,1]=4 7813 B11R1.16 CC#CC(Cl)c1ccccc1 Amb28365466 [1,1,0,0,0,0|1,0,1]=4 7814 B11R1.16 CC#C[C@H](O)c1ccccc1 Amb27981913 [1,1,0,0,0,0|1,0,1]=4 7815 B11R1.16 CC(CC#N)c1ccccc1 Amb17593643 [1,1,0,0,0,0|2,0,0]=4 7816 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [1,1,0,0,0,0|2,0,0]=4 7817 B11R1.16 CC(CCBr)c1ccccc1 Amb857802 [1,1,0,0,0,0|2,0,0]=4 7818 B11R1.16 CC(CCCl)c1ccccc1 Amb17232691 [1,1,0,0,0,0|2,0,0]=4 7819 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [1,1,0,0,0,0|2,0,0]=4 7820 B11R1.16 CC(CCN)c1ccccc1 Amb5739006 [1,1,0,0,0,0|2,0,0]=4 7821 B11R1.16 CC(CCO)c1ccccc1 Amb3938966 [1,1,0,0,0,0|2,0,0]=4 7822 B11R1.16 CC(CCS)c1ccccc1 Amb25866017 [1,1,0,0,0,0|2,0,0]=4 7823 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [1,1,0,0,0,0|1,0,0]=3 7824 B11R1.16 CC(CNN)c1ccccn1 Amb30010191 [1,1,0,0,0,0|2,0,0]=4 7825 B11R1.16 CC(CNO)c1ccccc1 Amb26657287 [1,1,0,0,0,0|1,0,0]=3 7826 B11R1.16 CC(CON)c1ccccc1 Amb28144909 [1,1,0,0,0,0|2,0,0]=4 7827 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [1,1,0,0,0,0|1,0,1]=4 7828 B11R1.16 CCCC(Br)c1ccccc1 Amb8835450 [1,1,0,0,0,0|1,0,0]=3 7829 B11R1.16 CCCC(Br)c1ccccn1 Amb25675709 [1,1,0,0,0,0|2,0,0]=4 7830 B11R1.16 CCCC(C)c1ccccc1 Amb4017935 [1,1,0,0,0,0|1,0,0]=3 7831 B11R1.16 CCCC(Cl)c1ccccc1 Amb7766848 [1,1,0,0,0,0|1,0,0]=3 7832 B11R1.16 CCCC(N)c1ccccc1 Amb8503301 [1,1,0,0,0,0|1,0,0]=3 7833 B11R1.16 CCCC(N)c1ccccc1 Amb9729508 [1,1,0,0,0,0|1,0,0]=3 7834 B11R1.16 CCCC(N)c1ccccn1 Amb18984959 [1,1,0,0,0,0|2,0,0]=4 7835 B11R1.16 CCCC(N)c1cccnc1 Amb18984960 [1,1,0,0,0,0|2,0,0]=4 7836 B11R1.16 CCCC(N)c1ccncc1 Amb18984961 [1,1,0,0,0,0|2,0,0]=4 7837 B11R1.16 CCCC(N)c1ccncc1 Amb30982091 [1,1,0,0,0,0|2,0,0]=4 7838 B11R1.16 CCCC(O)c1ccccc1 Amb9748221 [1,1,0,0,0,0|1,0,0]=3 7839 B11R1.16 CCCC(O)c1ccccn1 Amb18179397 [1,1,0,0,0,0|2,0,0]=4 7840 B11R1.16 CCCC(O)c1cccnc1 Amb17232090 [1,1,0,0,0,0|2,0,0]=4 7841 B11R1.16 CCCC(S)c1ccccc1 Amb9208055 [1,1,0,0,0,0|1,0,0]=3 7842 B11R1.16 CCCN(C)c1ccccc1 Amb27176635 [1,1,0,0,0,0|2,0,0]=4 7843 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [1,1,0,0,0,0|2,0,0]=4 7844 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb16233791 [1,1,0,0,0,0|1,0,0]=3 7845 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [1,1,0,0,0,0|1,0,0]=3 7846 B11R1.16 CCC[C@@H](O)c1cccnc1 Amb28069903 [1,1,0,0,0,0|2,0,0]=4 7847 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [1,1,0,0,0,0|1,0,0]=3 7848 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [1,1,0,0,0,0|1,0,0]=3 7849 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [1,1,0,0,0,0|1,0,0]=3 7850 B11R1.16 CCNC(C)c1ccccc1 Amb1771733 [1,1,0,0,0,0|2,0,0]=4 7851 B11R1.16 CCNC(C)c1ccccc1 Amb6537886 [1,1,0,0,0,0|2,0,0]=4 7852 B11R1.16 CCN[C@@H](C)c1ccccc1 Amb27175162 [1,1,0,0,0,0|2,0,0]=4 7853 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [1,1,0,0,0,0|2,0,0]=4 7854 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [1,1,0,0,0,0|2,0,0]=4 7855 B11R1.16 CCSC(C)c1ccccc1 Amb28145240 [1,1,0,0,0,0|2,0,0]=4 7856 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [1,1,0,0,0,0|0,0,1]=3 7857 B11R1.16 CNCC(=O)c1ccccn1 Amb31094252 [1,1,0,0,0,0|1,0,1]=4 7858 B11R1.16 CNCC(=O)c1cccnc1 Amb27146952 [1,1,0,0,0,0|1,0,1]=4 7859 B11R1.16 CNCC(=O)c1ccncc1 Amb31094250 [1,1,0,0,0,0|1,0,1]=4 7860 B11R1.16 CNCC(C)c1ccccc1 Amb17619365 [1,1,0,0,0,0|0,0,0]=2 7861 B11R1.16 CNCC(C)c1ccccc1 Amb6355911 [1,1,0,0,0,0|0,0,0]=2 7862 B11R1.16 CNCC(C)c1ccncc1 Amb27199701 [1,1,0,0,0,0|1,0,0]=3 7863 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [1,1,0,0,0,0|0,0,0]=2 7864 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [1,1,0,0,0,0|0,0,0]=2 7865 B11R1.16 CNCC(O)c1ccccc1 Amb32405137 [1,1,0,0,0,0|0,0,0]=2 7866 B11R1.16 CNCC(O)c1ccccc1 Amb3939362 [1,1,0,0,0,0|0,0,0]=2 7867 B11R1.16 CNCC(O)c1ccccn1 Amb17138440 [1,1,0,0,0,0|1,0,0]=3 7868 B11R1.16 CNCC(O)c1cccnc1 Amb17138441 [1,1,0,0,0,0|1,0,0]=3 7869 B11R1.16 CNCC(O)c1cccnc1 Amb19515701 [1,1,0,0,0,0|1,0,0]=3 7870 B11R1.16 CNCC(O)c1ccncc1 Amb17138442 [1,1,0,0,0,0|1,0,0]=3 7871 B11R1.16 CNCC(O)c1ccncn1 Amb33269068 [1,1,0,0,0,0|2,0,0]=4 7872 B11R1.16 CNCC(O)c1cnccn1 Amb26476252 [1,1,0,0,0,0|2,0,0]=4 7873 B11R1.16 CNCC(O)c1cncnc1 Amb25141262 [1,1,0,0,0,0|2,0,0]=4 7874 B11R1.16 CNCC(O)c1ncccn1 Amb27199745 [1,1,0,0,0,0|2,0,0]=4 7875 B11R1.16 CNC[C@@H](C)c1ccccc1 Amb27253876 [1,1,0,0,0,0|0,0,0]=2 7876 B11R1.16 CNC[C@@H](O)c1ccccn1 Amb28119961 [1,1,0,0,0,0|1,0,0]=3 7877 B11R1.16 CNC[C@@H](O)c1cccnc1 Amb28067718 [1,1,0,0,0,0|1,0,0]=3 7878 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [1,1,0,0,0,0|1,0,1]=4 7879 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [1,1,0,0,0,0|0,0,2]=4 7880 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [1,1,0,0,0,0|1,0,1]=4 7881 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [1,1,0,0,0,0|1,0,1]=4 7882 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [1,1,0,0,0,0|1,0,0]=3 7883 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [1,1,0,0,0,0|1,0,0]=3 7884 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [1,1,0,0,0,0|1,0,0]=3 7885 B11R1.16 COCC(N)c1ccccn1 Amb10607922 [1,1,0,0,0,0|2,0,0]=4 7886 B11R1.16 COCC(N)c1ccccn1 Amb13949181 [1,1,0,0,0,0|2,0,0]=4 7887 B11R1.16 COCC(N)c1ccncc1 Amb27168231 [1,1,0,0,0,0|2,0,0]=4 7888 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [1,1,0,0,0,0|1,0,0]=3 7889 B11R1.16 COCC(O)c1ccccn1 Amb27165137 [1,1,0,0,0,0|2,0,0]=4 7890 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [1,1,0,0,0,0|1,0,0]=3 7891 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [1,1,0,0,0,0|1,0,0]=3 7892 B11R1.16 COC[C@@H](N)c1ccccn1 Amb25104762 [1,1,0,0,0,0|2,0,0]=4 7893 B11R1.16 COC[C@@H](N)c1ccccn1 Amb33620942 [1,1,0,0,0,0|2,0,0]=4 7894 B11R1.16 COC[C@@H](N)c1cccnc1 Amb24351094 [1,1,0,0,0,0|2,0,0]=4 7895 B11R1.16 COC[C@@H](N)c1cccnc1 Amb33804039 [1,1,0,0,0,0|2,0,0]=4 7896 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [1,1,0,0,0,0|1,0,0]=3 7897 B11R1.16 COC[C@H](N)c1ccccn1 Amb27493999 [1,1,0,0,0,0|2,0,0]=4 7898 B11R1.16 COC[C@H](N)c1cccnc1 Amb24533043 [1,1,0,0,0,0|2,0,0]=4 7899 B11R1.16 COC[C@H](N)c1cccnc1 Amb33803139 [1,1,0,0,0,0|2,0,0]=4 7900 B11R1.16 COC[C@H](N)c1ccncc1 Amb28250847 [1,1,0,0,0,0|2,0,0]=4 7901 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [1,1,0,0,0,0|1,0,0]=3 7902 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [1,1,0,0,0,0|2,0,0]=4 7903 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [1,1,0,0,0,0|1,0,1]=4 7904 B11R1.16 CSCC(Cl)c1ccccc1 Amb27272993 [1,1,0,0,0,0|1,0,0]=3 7905 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [1,1,0,0,0,0|1,0,0]=3 7906 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [1,1,0,0,0,0|1,0,0]=3 7907 B11R1.16 CSC[C@H](N)c1ccccc1 Amb28397956 [1,1,0,0,0,0|1,0,0]=3 7908 B11R1.16 CSC[C@H](O)c1ccccc1 Amb28077783 [1,1,0,0,0,0|1,0,0]=3 7909 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [1,1,0,0,0,0|2,0,0]=4 7910 B11R1.16 C[C@@H](CCN)c1ccccc1 Amb28285355 [1,1,0,0,0,0|2,0,0]=4 7911 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [1,1,0,0,0,0|2,0,0]=4 7912 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [1,1,0,0,0,0|1,0,1]=4 7913 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [1,1,0,0,0,0|1,0,1]=4 7914 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [1,1,0,0,0,0|2,0,0]=4 7915 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [1,1,0,0,0,0|2,0,0]=4 7916 B11R1.16 N#CCC(N)c1ccccc1 Amb18964887 [1,1,0,0,0,0|2,0,0]=4 7917 B11R1.16 N#CCC(N)c1ccccc1 Amb20632783 [1,1,0,0,0,0|2,0,0]=4 7918 B11R1.16 N#CCC(N)c1ccccc1 Amb33068991 [1,1,0,0,0,0|2,0,0]=4 7919 B11R1.16 N#CCC(O)c1ccccc1 Amb4407013 [1,1,0,0,0,0|2,0,0]=4 7920 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb26346763 [1,1,0,0,0,0|2,0,0]=4 7921 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb32653409 [1,1,0,0,0,0|2,0,0]=4 7922 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb33212393 [1,1,0,0,0,0|2,0,0]=4 7923 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [1,1,0,0,0,0|2,0,0]=4 7924 B11R1.16 N#CC[C@H](N)c1ccccc1 Amb28398545 [1,1,0,0,0,0|2,0,0]=4 7925 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [1,1,0,0,0,0|2,0,0]=4 7926 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [1,1,0,0,0,0|2,0,0]=4 7927 B11R1.16 NC(CCCl)c1ccccc1 Amb27247405 [1,1,0,0,0,0|2,0,0]=4 7928 B11R1.16 NC(CCO)c1ccccc1 Amb1993953 [1,1,0,0,0,0|2,0,0]=4 7929 B11R1.16 NCCC(Br)c1ccccc1 Amb27643497 [1,1,0,0,0,0|2,0,0]=4 7930 B11R1.16 NCCC(F)c1ccccc1 Amb27760515 [1,1,0,0,0,0|2,0,0]=4 7931 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [1,1,0,0,0,0|2,0,0]=4 7932 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [1,1,0,0,0,0|2,0,0]=4 7933 B11R1.16 NCCC(O)c1ccccc1 Amb9782359 [1,1,0,0,0,0|2,0,0]=4 7934 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [1,1,0,0,0,0|2,0,0]=4 7935 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [1,1,0,0,0,0|2,0,0]=4 7936 B11R1.16 NNCC(O)c1ccccc1 Amb17232104 [1,1,0,0,0,0|1,0,0]=3 7937 B11R1.16 NNCC(O)c1ccccn1 Amb18065400 [1,1,0,0,0,0|2,0,0]=4 7938 B11R1.16 NNCC(O)c1cccnc1 Amb17232118 [1,1,0,0,0,0|2,0,0]=4 7939 B11R1.16 NNCC(O)c1ccncc1 Amb18065401 [1,1,0,0,0,0|2,0,0]=4 7940 B11R1.16 NOCC(O)c1ccccc1 Amb17334342 [1,1,0,0,0,0|2,0,0]=4 7941 B11R1.16 N[C@@H](CCO)c1ccccc1 Amb8384290 [1,1,0,0,0,0|2,0,0]=4 7942 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [1,1,0,0,0,0|2,0,0]=4 7943 B11R1.16 N[C@H](CCO)c1ccccc1 Amb8397180 [1,1,0,0,0,0|2,0,0]=4 7944 B11R1.16 OC(CCBr)c1ccccc1 Amb26365753 [1,1,0,0,0,0|2,0,0]=4 7945 B11R1.16 OC(CCCl)c1ccccc1 Amb17611064 [1,1,0,0,0,0|2,0,0]=4 7946 B11R1.16 OCCC(Cl)c1ccccc1 Amb27823326 [1,1,0,0,0,0|2,0,0]=4 7947 B11R1.16 OCCC(F)c1ccccc1 Amb28460703 [1,1,0,0,0,0|2,0,0]=4 7948 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [1,1,0,0,0,0|2,0,0]=4 7949 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [1,1,0,0,0,0|2,0,0]=4 7950 B11R1.16 ONCC(O)c1ccccc1 Amb4009046 [1,1,0,0,0,0|1,0,0]=3 7951 B11R1.16 ONCC(O)c1ccccn1 Amb17334345 [1,1,0,0,0,0|2,0,0]=4 7952 B11R1.16 ONCC(O)c1cccnc1 Amb17334346 [1,1,0,0,0,0|2,0,0]=4 7953 B11R1.16 ONCC(O)c1ccncc1 Amb17334347 [1,1,0,0,0,0|2,0,0]=4 7954 B11R1.16 O[C@@H](CCCl)c1ccccc1 Amb17611058 [1,1,0,0,0,0|2,0,0]=4 7955 B11R1.16 O[C@H](CCBr)c1ccccc1 Amb27437857 [1,1,0,0,0,0|2,0,0]=4 7956 B11R1.16 O[C@H](CCCl)c1ccccc1 Amb2779830 [1,1,0,0,0,0|2,0,0]=4 7957 B11R1.16 O[C@H](CCI)c1ccccc1 Amb27603615 [1,1,0,0,0,0|2,0,0]=4 7958 B11R1.16 [C-]#[N+]CC(C)c1ccccc1 Amb2684685 [1,1,0,0,0,0|0,0,2]=4 7959 B11R1.16 [C-]#[N+]CC(F)c1ccccc1 Amb27441196 [1,1,0,0,0,0|0,0,2]=4 7960 B11R1.24 BrCCCc1cccc(Br)c1 Amb17104576 [1,1,0,0,0,0|2,0,0]=4 7961 B11R1.24 C#CCCc1cccc(Br)c1 Amb33451616 [1,1,0,0,0,0|1,0,1]=4 7962 B11R1.24 C#CCCc1cccc(C)c1 Amb33380572 [1,1,0,0,0,0|1,0,1]=4 7963 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [1,1,0,0,0,0|1,0,1]=4 7964 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [1,1,0,0,0,0|1,0,1]=4 7965 B11R1.24 C#CCCc1cccc(O)c1 Amb33312065 [1,1,0,0,0,0|1,0,1]=4 7966 B11R1.24 C=CCCc1cccc(Br)c1 Amb6298948 [1,1,0,0,0,0|1,0,1]=4 7967 B11R1.24 C=CCCc1cccc(Cl)c1 Amb6298971 [1,1,0,0,0,0|1,0,1]=4 7968 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [1,1,0,0,0,0|1,0,1]=4 7969 B11R1.24 CCCCC1=CC(=O)C=CS1 Amb27855025 [1,1,0,0,0,0|2,0,0]=4 7970 B11R1.24 CCCCC1=CC(=S)C=CN1 Amb28119415 [1,1,0,0,0,0|2,0,0]=4 7971 B11R1.24 CCCC[n+]1cccc(C)c1 Amb22411627 [1,1,0,0,0,0|2,0,0]=4 7972 B11R1.24 CCCC[n+]1cccc(C)c1 Amb24323548 [1,1,0,0,0,0|2,0,0]=4 7973 B11R1.24 CCCC[n+]1cccc(C)c1 Amb33934312 [1,1,0,0,0,0|2,0,0]=4 7974 B11R1.24 CCCCc1cc(Br)ccn1 Amb24083005 [1,1,0,0,0,0|2,0,0]=4 7975 B11R1.24 CCCCc1cc(N)ccn1 Amb30010808 [1,1,0,0,0,0|2,0,0]=4 7976 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [1,1,0,0,0,0|1,0,0]=3 7977 B11R1.24 CCCCc1cccc(C)c1 Amb22730119 [1,1,0,0,0,0|1,0,0]=3 7978 B11R1.24 CCCCc1cccc(Cl)c1 Amb26984112 [1,1,0,0,0,0|1,0,0]=3 7979 B11R1.24 CCCCc1cccc(F)c1 Amb27221595 [1,1,0,0,0,0|1,0,0]=3 7980 B11R1.24 CCCCc1cccc(F)n1 Amb28280759 [1,1,0,0,0,0|2,0,0]=4 7981 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [1,1,0,0,0,0|1,0,0]=3 7982 B11R1.24 CCCCc1cccc(N)c1 Amb17593719 [1,1,0,0,0,0|1,0,0]=3 7983 B11R1.24 CCCCc1cccc(N)n1 Amb18644442 [1,1,0,0,0,0|2,0,0]=4 7984 B11R1.24 CCCCc1cccc(O)c1 Amb26463186 [1,1,0,0,0,0|1,0,0]=3 7985 B11R1.24 CCCCc1ccnc(C)c1 Amb27176838 [1,1,0,0,0,0|2,0,0]=4 7986 B11R1.24 CCCCc1ccnc(Cl)c1 Amb27250650 [1,1,0,0,0,0|2,0,0]=4 7987 B11R1.24 CCCCc1ccnc(O)c1 Amb22749775 [1,1,0,0,0,0|2,0,0]=4 7988 B11R1.24 CCCCc1cncc(O)c1 Amb28383031 [1,1,0,0,0,0|2,0,0]=4 7989 B11R1.24 CCCCc1cncc(S)c1 Amb33276291 [1,1,0,0,0,0|2,0,0]=4 7990 B11R1.24 CCCNc1cccc(Br)c1 Amb6696672 [1,1,0,0,0,0|2,0,0]=4 7991 B11R1.24 CCCNc1cccc(C)c1 Amb6684516 [1,1,0,0,0,0|2,0,0]=4 7992 B11R1.24 CCCNc1cccc(Cl)c1 Amb6695728 [1,1,0,0,0,0|2,0,0]=4 7993 B11R1.24 CCCNc1cccc(F)c1 Amb6695885 [1,1,0,0,0,0|2,0,0]=4 7994 B11R1.24 CCCNc1cccc(N)c1 Amb8825430 [1,1,0,0,0,0|2,0,0]=4 7995 B11R1.24 CCCOc1cccc(Br)c1 Amb33532692 [1,1,0,0,0,0|2,0,0]=4 7996 B11R1.24 CCCOc1cccc(C)c1 Amb10573406 [1,1,0,0,0,0|2,0,0]=4 7997 B11R1.24 CCCOc1cccc(Cl)c1 Amb25787001 [1,1,0,0,0,0|2,0,0]=4 7998 B11R1.24 CCCOc1cccc(F)c1 Amb25700428 [1,1,0,0,0,0|2,0,0]=4 7999 B11R1.24 CCCOc1cccc(I)c1 Amb27393748 [1,1,0,0,0,0|2,0,0]=4 8000 B11R1.24 CCCOc1cccc(N)c1 Amb1138945 [1,1,0,0,0,0|2,0,0]=4 8001 B11R1.24 CCCOc1cccc(O)c1 Amb8837439 [1,1,0,0,0,0|2,0,0]=4 8002 B11R1.24 CCCOc1cccc(S)c1 Amb26554006 [1,1,0,0,0,0|2,0,0]=4 8003 B11R1.24 CCCSc1cccc(Br)c1 Amb24538191 [1,1,0,0,0,0|2,0,0]=4 8004 B11R1.24 CCCSc1cccc(C)c1 Amb28315009 [1,1,0,0,0,0|2,0,0]=4 8005 B11R1.24 CCCSc1cccc(Cl)c1 Amb25801816 [1,1,0,0,0,0|2,0,0]=4 8006 B11R1.24 CCCSc1cccc(N)c1 Amb18289141 [1,1,0,0,0,0|2,0,0]=4 8007 B11R1.24 CCCSc1cccc(S)c1 Amb26337168 [1,1,0,0,0,0|2,0,0]=4 8008 B11R1.24 CCNCc1cccc(Br)c1 Amb13949217 [1,1,0,0,0,0|2,0,0]=4 8009 B11R1.24 CCNCc1cccc(Br)c1 Amb838402 [1,1,0,0,0,0|2,0,0]=4 8010 B11R1.24 CCNCc1cccc(C)c1 Amb6242953 [1,1,0,0,0,0|2,0,0]=4 8011 B11R1.24 CCNCc1cccc(Cl)c1 Amb29845814 [1,1,0,0,0,0|2,0,0]=4 8012 B11R1.24 CCNCc1cccc(Cl)c1 Amb6245035 [1,1,0,0,0,0|2,0,0]=4 8013 B11R1.24 CCNCc1cccc(F)c1 Amb435909 [1,1,0,0,0,0|2,0,0]=4 8014 B11R1.24 CCNCc1cccc(O)c1 Amb6260672 [1,1,0,0,0,0|2,0,0]=4 8015 B11R1.24 CCOCc1cccc(Br)c1 Amb23512545 [1,1,0,0,0,0|2,0,0]=4 8016 B11R1.24 CCOCc1cccc(Cl)c1 Amb24486866 [1,1,0,0,0,0|2,0,0]=4 8017 B11R1.24 CCOCc1cccc(N)c1 Amb6244214 [1,1,0,0,0,0|2,0,0]=4 8018 B11R1.24 CCOCc1cccc(O)c1 Amb23443319 [1,1,0,0,0,0|2,0,0]=4 8019 B11R1.24 CCSCc1cccc(Br)c1 Amb24476579 [1,1,0,0,0,0|2,0,0]=4 8020 B11R1.24 CCSCc1cccc(Cl)c1 Amb25891456 [1,1,0,0,0,0|2,0,0]=4 8021 B11R1.24 CCSCc1cccc(F)c1 Amb27406048 [1,1,0,0,0,0|2,0,0]=4 8022 B11R1.24 CCSCc1cccc(N)c1 Amb6680425 [1,1,0,0,0,0|2,0,0]=4 8023 B11R1.24 CNCCC1=CC=CC(=O)N1 Amb27847152 [1,1,0,0,0,0|1,0,0]=3 8024 B11R1.24 CNCCc1cc(C)ccn1 Amb18125194 [1,1,0,0,0,0|1,0,0]=3 8025 B11R1.24 CNCCc1cc(C)ncn1 Amb18224297 [1,1,0,0,0,0|2,0,0]=4 8026 B11R1.24 CNCCc1cc(Cl)ccn1 Amb25163179 [1,1,0,0,0,0|1,0,0]=3 8027 B11R1.24 CNCCc1cc(F)ccn1 Amb33415291 [1,1,0,0,0,0|1,0,0]=3 8028 B11R1.24 CNCCc1cc(O)ncn1 Amb18224341 [1,1,0,0,0,0|2,0,0]=4 8029 B11R1.24 CNCCc1cccc(Br)c1 Amb16230486 [1,1,0,0,0,0|0,0,0]=2 8030 B11R1.24 CNCCc1cccc(Br)c1 Amb28652826 [1,1,0,0,0,0|0,0,0]=2 8031 B11R1.24 CNCCc1cccc(Br)n1 Amb25324918 [1,1,0,0,0,0|1,0,0]=3 8032 B11R1.24 CNCCc1cccc(C)c1 Amb16230487 [1,1,0,0,0,0|0,0,0]=2 8033 B11R1.24 CNCCc1cccc(C)n1 Amb18125196 [1,1,0,0,0,0|1,0,0]=3 8034 B11R1.24 CNCCc1cccc(Cl)c1 Amb5785537 [1,1,0,0,0,0|0,0,0]=2 8035 B11R1.24 CNCCc1cccc(Cl)n1 Amb24679236 [1,1,0,0,0,0|1,0,0]=3 8036 B11R1.24 CNCCc1cccc(F)c1 Amb8841505 [1,1,0,0,0,0|0,0,0]=2 8037 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [1,1,0,0,0,0|0,0,0]=2 8038 B11R1.24 CNCCc1cccc(N)n1 Amb27778638 [1,1,0,0,0,0|1,0,0]=3 8039 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [1,1,0,0,0,0|0,0,0]=2 8040 B11R1.24 CNCCc1ccnc(C)c1 Amb33227097 [1,1,0,0,0,0|1,0,0]=3 8041 B11R1.24 CNCCc1ccnc(Cl)c1 Amb24407156 [1,1,0,0,0,0|1,0,0]=3 8042 B11R1.24 CNCCc1ccnc(N)c1 Amb27759957 [1,1,0,0,0,0|1,0,0]=3 8043 B11R1.24 CNCCc1cncc(Br)c1 Amb25149055 [1,1,0,0,0,0|1,0,0]=3 8044 B11R1.24 CNCCc1cncc(C)c1 Amb27176243 [1,1,0,0,0,0|1,0,0]=3 8045 B11R1.24 CNCCc1cncc(F)c1 Amb18993612 [1,1,0,0,0,0|1,0,0]=3 8046 B11R1.24 CNCCc1nccc(C)n1 Amb8010523 [1,1,0,0,0,0|2,0,0]=4 8047 B11R1.24 CNCCc1nccc(N)n1 Amb26333065 [1,1,0,0,0,0|2,0,0]=4 8048 B11R1.24 CNCCc1nccc(O)n1 Amb18862495 [1,1,0,0,0,0|2,0,0]=4 8049 B11R1.24 CNCCc1nccc(O)n1 Amb31157054 [1,1,0,0,0,0|2,0,0]=4 8050 B11R1.24 CNOCc1cccc(I)c1 Amb32412842 [1,1,0,0,0,0|1,0,0]=3 8051 B11R1.24 CN\C=N\c1cccc(C)c1 Amb27617263 [1,1,0,0,0,0|1,0,1]=4 8052 B11R1.24 CN\N=C\c1cccc(Cl)c1 Amb27261064 [1,1,0,0,0,0|1,0,1]=4 8053 B11R1.24 COCC[n+]1cccc(Br)c1 Amb28189045 [1,1,0,0,0,0|2,0,0]=4 8054 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [1,1,0,0,0,0|1,0,0]=3 8055 B11R1.24 COCCc1ccnc(C)c1 Amb27606969 [1,1,0,0,0,0|2,0,0]=4 8056 B11R1.24 COCCc1ccnc(N)c1 Amb27665601 [1,1,0,0,0,0|2,0,0]=4 8057 B11R1.24 COCOc1cccc(Br)c1 Amb25810590 [1,1,0,0,0,0|2,0,0]=4 8058 B11R1.24 COCOc1cccc(C)c1 Amb27169027 [1,1,0,0,0,0|2,0,0]=4 8059 B11R1.24 COCOc1cccc(Cl)c1 Amb24551706 [1,1,0,0,0,0|2,0,0]=4 8060 B11R1.24 COCOc1cccc(F)c1 Amb21858121 [1,1,0,0,0,0|2,0,0]=4 8061 B11R1.24 COCOc1cccc(N)c1 Amb25096531 [1,1,0,0,0,0|2,0,0]=4 8062 B11R1.24 COCOc1cccc(O)c1 Amb26575320 [1,1,0,0,0,0|2,0,0]=4 8063 B11R1.24 COCSc1cccc(Br)c1 Amb27196993 [1,1,0,0,0,0|2,0,0]=4 8064 B11R1.24 CONCc1cccc(Cl)c1 Amb27251173 [1,1,0,0,0,0|2,0,0]=4 8065 B11R1.24 CONCc1cccc(F)c1 Amb26643051 [1,1,0,0,0,0|2,0,0]=4 8066 B11R1.24 CSCCC1=CC=CC(=O)N1 Amb28292737 [1,1,0,0,0,0|2,0,0]=4 8067 B11R1.24 CSCSc1cccc(C)c1 Amb27172833 [1,1,0,0,0,0|2,0,0]=4 8068 B11R1.24 CSCSc1cccc(O)c1 Amb28201670 [1,1,0,0,0,0|2,0,0]=4 8069 B11R1.24 Cc1cccc(CCC#N)c1 Amb17204296 [1,1,0,0,0,0|2,0,0]=4 8070 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [1,1,0,0,0,0|2,0,0]=4 8071 B11R1.24 Cc1cccc(CCCBr)c1 Amb17104553 [1,1,0,0,0,0|2,0,0]=4 8072 B11R1.24 Cc1cccc(CCCCl)c1 Amb17104526 [1,1,0,0,0,0|2,0,0]=4 8073 B11R1.24 Cc1cccc(CCCN)c1 Amb844760 [1,1,0,0,0,0|2,0,0]=4 8074 B11R1.24 Cc1cccc(CCCO)c1 Amb17089495 [1,1,0,0,0,0|2,0,0]=4 8075 B11R1.24 Cc1cccc(CCCS)c1 Amb17400219 [1,1,0,0,0,0|2,0,0]=4 8076 B11R1.24 Cc1cccc(CCNN)c1 Amb17399915 [1,1,0,0,0,0|1,0,0]=3 8077 B11R1.24 Cc1cccc(CCNN)n1 Amb27779952 [1,1,0,0,0,0|2,0,0]=4 8078 B11R1.24 Cc1cccc(CCON)c1 Amb25704227 [1,1,0,0,0,0|2,0,0]=4 8079 B11R1.24 Cc1cccc(CC[Zn]Br)c1 Amb6300300 [1,1,0,0,0,0|2,0,0]=4 8080 B11R1.24 ClCCCc1cccc(Br)c1 Amb17104548 [1,1,0,0,0,0|2,0,0]=4 8081 B11R1.24 ClCCCc1cccc(Cl)c1 Amb17104534 [1,1,0,0,0,0|2,0,0]=4 8082 B11R1.24 Clc1cccc(CCCBr)c1 Amb17104561 [1,1,0,0,0,0|2,0,0]=4 8083 B11R1.24 Fc1cccc(CCCBr)c1 Amb22886712 [1,1,0,0,0,0|2,0,0]=4 8084 B11R1.24 Fc1cccc(CCCCl)c1 Amb18803316 [1,1,0,0,0,0|2,0,0]=4 8085 B11R1.24 Fc1cccc(CCCS)c1 Amb18065480 [1,1,0,0,0,0|2,0,0]=4 8086 B11R1.24 N#CCCc1cccc(Br)c1 Amb2685459 [1,1,0,0,0,0|2,0,0]=4 8087 B11R1.24 N#CCCc1cccc(Cl)c1 Amb17204310 [1,1,0,0,0,0|2,0,0]=4 8088 B11R1.24 N#CCCc1cccc(F)c1 Amb10841716 [1,1,0,0,0,0|2,0,0]=4 8089 B11R1.24 N#CCCc1cccc(N)c1 Amb25929710 [1,1,0,0,0,0|2,0,0]=4 8090 B11R1.24 N#CCCc1cccc(O)c1 Amb2609108 [1,1,0,0,0,0|2,0,0]=4 8091 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [1,1,0,0,0,0|2,0,0]=4 8092 B11R1.24 NCCCc1cccc(Br)c1 Amb9304906 [1,1,0,0,0,0|2,0,0]=4 8093 B11R1.24 NCCCc1cccc(Cl)c1 Amb13951536 [1,1,0,0,0,0|2,0,0]=4 8094 B11R1.24 NCCCc1cccc(Cl)c1 Amb5735480 [1,1,0,0,0,0|2,0,0]=4 8095 B11R1.24 NCCCc1cccc(F)c1 Amb13949159 [1,1,0,0,0,0|2,0,0]=4 8096 B11R1.24 NCCCc1cccc(F)c1 Amb9304903 [1,1,0,0,0,0|2,0,0]=4 8097 B11R1.24 NCCCc1cccc(I)c1 Amb26471163 [1,1,0,0,0,0|2,0,0]=4 8098 B11R1.24 NCCCc1cccc(N)c1 Amb17477694 [1,1,0,0,0,0|2,0,0]=4 8099 B11R1.24 NCCCc1cccc(O)c1 Amb17101314 [1,1,0,0,0,0|2,0,0]=4 8100 B11R1.24 NCCCc1cccc(O)c1 Amb33552047 [1,1,0,0,0,0|2,0,0]=4 8101 B11R1.24 NCCCc1cccc(O)c1 Amb33719034 [1,1,0,0,0,0|2,0,0]=4 8102 B11R1.24 NNCCc1cccc(Br)c1 Amb17404394 [1,1,0,0,0,0|1,0,0]=3 8103 B11R1.24 NNCCc1cccc(Cl)c1 Amb17400340 [1,1,0,0,0,0|1,0,0]=3 8104 B11R1.24 NNCCc1cccc(F)c1 Amb32661220 [1,1,0,0,0,0|1,0,0]=3 8105 B11R1.24 NNCCc1cccc(F)c1 Amb6250670 [1,1,0,0,0,0|1,0,0]=3 8106 B11R1.24 NNCCc1cncc(Br)c1 Amb28364146 [1,1,0,0,0,0|2,0,0]=4 8107 B11R1.24 NOCCc1cccc(Br)c1 Amb33450765 [1,1,0,0,0,0|2,0,0]=4 8108 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [1,1,0,0,0,0|2,0,0]=4 8109 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [1,1,0,0,0,0|2,0,0]=4 8110 B11R1.24 NOCCc1cccc(O)c1 Amb33310970 [1,1,0,0,0,0|2,0,0]=4 8111 B11R1.24 Nc1cccc(CCCBr)c1 Amb27475647 [1,1,0,0,0,0|2,0,0]=4 8112 B11R1.24 Nc1cccc(CCCCl)c1 Amb17477709 [1,1,0,0,0,0|2,0,0]=4 8113 B11R1.24 Nc1cccc(CCCO)c1 Amb17477701 [1,1,0,0,0,0|2,0,0]=4 8114 B11R1.24 Nc1cccc(CCCS)c1 Amb35672845 [1,1,0,0,0,0|2,0,0]=4 8115 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [1,1,0,0,0,0|2,0,0]=4 8116 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [1,1,0,0,0,0|2,0,0]=4 8117 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [1,1,0,0,0,0|2,0,0]=4 8118 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [1,1,0,0,0,0|2,0,0]=4 8119 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [1,1,0,0,0,0|2,0,0]=4 8120 B11R1.24 OCCCc1cccc(Br)c1 Amb17089515 [1,1,0,0,0,0|2,0,0]=4 8121 B11R1.24 OCCCc1cccc(Cl)c1 Amb17089500 [1,1,0,0,0,0|2,0,0]=4 8122 B11R1.24 OCCCc1cccc(F)c1 Amb17605781 [1,1,0,0,0,0|2,0,0]=4 8123 B11R1.24 OCCCc1cccc(O)c1 Amb17089514 [1,1,0,0,0,0|2,0,0]=4 8124 B11R1.24 Oc1cccc(CCCBr)c1 Amb18657769 [1,1,0,0,0,0|2,0,0]=4 8125 B11R1.24 Oc1cccc(CCCCl)c1 Amb17477723 [1,1,0,0,0,0|2,0,0]=4 8126 B11R1.24 Oc1cccc(CCCS)c1 Amb33310794 [1,1,0,0,0,0|2,0,0]=4 8127 B11R1.24 SCCCc1cccc(Br)c1 Amb17407561 [1,1,0,0,0,0|2,0,0]=4 8128 B11R1.24 SCCCc1cccc(Cl)c1 Amb17401096 [1,1,0,0,0,0|2,0,0]=4 8129 B11R1.24 Sc1cccc(CCCBr)c1 Amb27192455 [1,1,0,0,0,0|2,0,0]=4 8130 B11R1.24 Sc1cccc(CCCCl)c1 Amb28196581 [1,1,0,0,0,0|2,0,0]=4 8131 B11R1.24 [C-]#[N+]CCc1cccc(Br)c1 Amb2685408 [1,1,0,0,0,0|0,0,2]=4 8132 B11R1.24 [C-]#[N+]CCc1cccc(C)c1 Amb2689593 [1,1,0,0,0,0|0,0,2]=4 8133 B11R1.24 [C-]#[N+]CCc1cccc(Cl)c1 Amb2686345 [1,1,0,0,0,0|0,0,2]=4 8134 B11R1.24 [C-]#[N+]CCc1cccc(F)c1 Amb2688286 [1,1,0,0,0,0|0,0,2]=4 8135 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [1,1,0,0,0,0|1,0,0]=3 8136 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [1,1,0,0,0,0|2,0,0]=4 8137 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [1,1,0,0,0,0|2,0,0]=4 8138 B11R1.28 BrCCOCc1ccccc1 Amb3941567 [1,1,0,0,0,0|2,0,0]=4 8139 B11R1.28 BrCCSCc1ccccc1 Amb9305028 [1,1,0,0,0,0|2,0,0]=4 8140 B11R1.28 Br[Mg]CCCc1ccccc1 Amb6300511 [1,1,0,0,0,0|2,0,0]=4 8141 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [1,1,0,0,0,0|1,0,1]=4 8142 B11R1.28 C#CCCOc1ccccc1 Amb25885800 [1,1,0,0,0,0|1,0,1]=4 8143 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [1,1,0,0,0,0|1,0,1]=4 8144 B11R1.28 C#CCNCc1ccccc1 Amb4303989 [1,1,0,0,0,0|1,0,1]=4 8145 B11R1.28 C#CCOCc1ccccc1 Amb8517297 [1,1,0,0,0,0|1,0,1]=4 8146 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [1,1,0,0,0,0|1,0,1]=4 8147 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [1,1,0,0,0,0|1,0,1]=4 8148 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [1,1,0,0,0,0|1,0,1]=4 8149 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [1,1,0,0,0,0|1,0,1]=4 8150 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [1,1,0,0,0,0|1,0,1]=4 8151 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,1,0,0,0,0|1,0,1]=4 8152 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [1,1,0,0,0,0|1,0,1]=4 8153 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [1,1,0,0,0,0|1,0,1]=4 8154 B11R1.28 CCCC#Cc1ccccc1 Amb2721608 [1,1,0,0,0,0|1,0,1]=4 8155 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [1,1,0,0,0,0|2,0,0]=4 8156 B11R1.28 CCCCCc1ccccc1 Amb2722921 [1,1,0,0,0,0|1,0,0]=3 8157 B11R1.28 CCCCCc1ccccn1 Amb533507 [1,1,0,0,0,0|2,0,0]=4 8158 B11R1.28 CCCCCc1cccnc1 Amb17672949 [1,1,0,0,0,0|2,0,0]=4 8159 B11R1.28 CCCCCc1ccncc1 Amb17672950 [1,1,0,0,0,0|2,0,0]=4 8160 B11R1.28 CCCCNc1ccccc1 Amb3940154 [1,1,0,0,0,0|1,0,0]=3 8161 B11R1.28 CCCCNc1ccccn1 Amb6633041 [1,1,0,0,0,0|2,0,0]=4 8162 B11R1.28 CCCCNc1cccnc1 Amb6686633 [1,1,0,0,0,0|2,0,0]=4 8163 B11R1.28 CCCCNc1ccncc1 Amb6648934 [1,1,0,0,0,0|2,0,0]=4 8164 B11R1.28 CCCCOc1ccccc1 Amb2685665 [1,1,0,0,0,0|1,0,0]=3 8165 B11R1.28 CCCCOc1ccccn1 Amb4034584 [1,1,0,0,0,0|2,0,0]=4 8166 B11R1.28 CCCCOc1cccnc1 Amb25382997 [1,1,0,0,0,0|2,0,0]=4 8167 B11R1.28 CCCCSc1ccccc1 Amb3836105 [1,1,0,0,0,0|1,0,0]=3 8168 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,1,0,0,0,0|1,0,0]=3 8169 B11R1.28 CCCNCc1ccccc1 Amb6537999 [1,1,0,0,0,0|1,0,0]=3 8170 B11R1.28 CCCNCc1ccccn1 Amb19890306 [1,1,0,0,0,0|2,0,0]=4 8171 B11R1.28 CCCNCc1ccccn1 Amb19890563 [1,1,0,0,0,0|2,0,0]=4 8172 B11R1.28 CCCNCc1ccccn1 Amb2592504 [1,1,0,0,0,0|2,0,0]=4 8173 B11R1.28 CCCNCc1cccnc1 Amb19890575 [1,1,0,0,0,0|2,0,0]=4 8174 B11R1.28 CCCNCc1cccnc1 Amb6864723 [1,1,0,0,0,0|2,0,0]=4 8175 B11R1.28 CCCNCc1cccnc1 Amb838293 [1,1,0,0,0,0|2,0,0]=4 8176 B11R1.28 CCCNCc1ccncc1 Amb19890591 [1,1,0,0,0,0|2,0,0]=4 8177 B11R1.28 CCCNCc1ccncc1 Amb6864722 [1,1,0,0,0,0|2,0,0]=4 8178 B11R1.28 CCCNCc1ccncc1 Amb837657 [1,1,0,0,0,0|2,0,0]=4 8179 B11R1.28 CCCSCc1ccccc1 Amb27000631 [1,1,0,0,0,0|1,0,0]=3 8180 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [1,1,0,0,0,0|1,0,1]=4 8181 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,1,0,0,0,0|1,0,1]=4 8182 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [1,1,0,0,0,0|1,0,1]=4 8183 B11R1.28 CCNCCc1ccccc1 Amb33551205 [1,1,0,0,0,0|0,0,0]=2 8184 B11R1.28 CCNCCc1ccccc1 Amb6244873 [1,1,0,0,0,0|0,0,0]=2 8185 B11R1.28 CCNCCc1ccccn1 Amb33527538 [1,1,0,0,0,0|1,0,0]=3 8186 B11R1.28 CCNCCc1ccncc1 Amb2592520 [1,1,0,0,0,0|1,0,0]=3 8187 B11R1.28 CCNCCc1ccncn1 Amb27670958 [1,1,0,0,0,0|2,0,0]=4 8188 B11R1.28 CCNCCc1ncccn1 Amb19028710 [1,1,0,0,0,0|2,0,0]=4 8189 B11R1.28 CCNOCc1ccccc1 Amb25923077 [1,1,0,0,0,0|1,0,0]=3 8190 B11R1.28 CCOCCc1ccccc1 Amb4035236 [1,1,0,0,0,0|1,0,0]=3 8191 B11R1.28 CCOCCc1ccccn1 Amb2722907 [1,1,0,0,0,0|2,0,0]=4 8192 B11R1.28 CCOCOc1ccccc1 Amb28388170 [1,1,0,0,0,0|2,0,0]=4 8193 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,1,0,0,0,0|2,0,0]=4 8194 B11R1.28 CCSCCc1ccccn1 Amb27988878 [1,1,0,0,0,0|2,0,0]=4 8195 B11R1.28 CCSCCc1cccnc1 Amb27988879 [1,1,0,0,0,0|2,0,0]=4 8196 B11R1.28 CCSCCc1ccncc1 Amb27988880 [1,1,0,0,0,0|2,0,0]=4 8197 B11R1.28 CNCC#Cc1ccccn1 Amb27761723 [1,1,0,0,0,0|1,0,1]=4 8198 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,1,0,0,0,0|0,0,0]=2 8199 B11R1.28 CNCCCc1ccccc1 Amb2721795 [1,1,0,0,0,0|0,0,0]=2 8200 B11R1.28 CNCCCc1ccccn1 Amb18312462 [1,1,0,0,0,0|1,0,0]=3 8201 B11R1.28 CNCCNc1ccccc1 Amb6825621 [1,1,0,0,0,0|0,0,0]=2 8202 B11R1.28 CNCCNc1ccccn1 Amb18313466 [1,1,0,0,0,0|1,0,0]=3 8203 B11R1.28 CNCCNc1ccccn1 Amb32757639 [1,1,0,0,0,0|1,0,0]=3 8204 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,1,0,0,0,0|0,0,0]=2 8205 B11R1.28 CNCCOc1ccccc1 Amb2691365 [1,1,0,0,0,0|0,0,0]=2 8206 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,1,0,0,0,0|0,0,0]=2 8207 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,1,0,0,0,0|0,0,0]=2 8208 B11R1.28 CNCCSc1ccccn1 Amb19024669 [1,1,0,0,0,0|1,0,0]=3 8209 B11R1.28 CNCCSc1ccccn1 Amb32662293 [1,1,0,0,0,0|1,0,0]=3 8210 B11R1.28 CNCCSc1ccncc1 Amb27671140 [1,1,0,0,0,0|1,0,0]=3 8211 B11R1.28 CNCCSc1cnccn1 Amb27269175 [1,1,0,0,0,0|2,0,0]=4 8212 B11R1.28 CNCCSc1ncccn1 Amb18312269 [1,1,0,0,0,0|2,0,0]=4 8213 B11R1.28 CNCCSc1ncccn1 Amb32662274 [1,1,0,0,0,0|2,0,0]=4 8214 B11R1.28 CNC\C=C/c1cccnc1 Amb28423371 [1,1,0,0,0,0|1,0,1]=4 8215 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|0,0,1]=3 8216 B11R1.28 CNC\C=C\c1ccccn1 Amb26859034 [1,1,0,0,0,0|1,0,1]=4 8217 B11R1.28 CNC\C=C\c1cccnc1 Amb23442752 [1,1,0,0,0,0|1,0,1]=4 8218 B11R1.28 CNC\C=C\c1ccncc1 Amb26859033 [1,1,0,0,0,0|1,0,1]=4 8219 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,1,0,0,0,0|1,0,1]=4 8220 B11R1.28 COCCNc1ccccc1 Amb596066 [1,1,0,0,0,0|1,0,0]=3 8221 B11R1.28 COCCNc1cccnc1 Amb18268638 [1,1,0,0,0,0|2,0,0]=4 8222 B11R1.28 COCCNc1ccncc1 Amb6632784 [1,1,0,0,0,0|2,0,0]=4 8223 B11R1.28 COCCOc1ccccc1 Amb4018811 [1,1,0,0,0,0|1,0,0]=3 8224 B11R1.28 COCCSc1ccccn1 Amb17760116 [1,1,0,0,0,0|2,0,0]=4 8225 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,1,0,0,0,0|1,0,0]=3 8226 B11R1.28 CONCCc1cccnc1 Amb27987592 [1,1,0,0,0,0|1,0,0]=3 8227 B11R1.28 CONCCc1ccncc1 Amb27987581 [1,1,0,0,0,0|1,0,0]=3 8228 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,1,0,0,0,0|1,0,0]=3 8229 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,1,0,0,0,0|1,0,0]=3 8230 B11R1.28 CSCCOc1ccccc1 Amb4020915 [1,1,0,0,0,0|1,0,0]=3 8231 B11R1.28 CSCCOc1ccccn1 Amb27988044 [1,1,0,0,0,0|2,0,0]=4 8232 B11R1.28 CSCCOc1cccnc1 Amb27492324 [1,1,0,0,0,0|2,0,0]=4 8233 B11R1.28 CSCCOc1ccncc1 Amb28387285 [1,1,0,0,0,0|2,0,0]=4 8234 B11R1.28 CSCCSc1ccccn1 Amb27988049 [1,1,0,0,0,0|2,0,0]=4 8235 B11R1.28 CSCCSc1ccncc1 Amb27988052 [1,1,0,0,0,0|2,0,0]=4 8236 B11R1.28 CSCNCc1ccccc1 Amb26414504 [1,1,0,0,0,0|1,0,0]=3 8237 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [1,1,0,0,0,0|1,0,1]=4 8238 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [1,1,0,0,0,0|1,0,0]=3 8239 B11R1.28 C\C=C\CCc1ccncc1 Amb25830692 [1,1,0,0,0,0|2,0,0]=4 8240 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [1,1,0,0,0,0|1,0,1]=4 8241 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [1,1,0,0,0,0|1,0,1]=4 8242 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [1,1,0,0,0,0|1,0,1]=4 8243 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [1,1,0,0,0,0|1,0,0]=3 8244 B11R1.28 ClCCCCc1ccncc1 Amb20622009 [1,1,0,0,0,0|2,0,0]=4 8245 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [1,1,0,0,0,0|2,0,0]=4 8246 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [1,1,0,0,0,0|2,0,0]=4 8247 B11R1.28 ClCCNCc1ccccc1 Amb2880633 [1,1,0,0,0,0|2,0,0]=4 8248 B11R1.28 ClCCNCc1ccccc1 Amb4323279 [1,1,0,0,0,0|2,0,0]=4 8249 B11R1.28 ClCCOCc1ccccc1 Amb8391048 [1,1,0,0,0,0|2,0,0]=4 8250 B11R1.28 ClCCSCc1ccccc1 Amb9270911 [1,1,0,0,0,0|2,0,0]=4 8251 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [1,1,0,0,0,0|2,0,0]=4 8252 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [1,1,0,0,0,0|1,0,1]=4 8253 B11R1.28 FCCNCc1ccccc1 Amb24611358 [1,1,0,0,0,0|2,0,0]=4 8254 B11R1.28 FCCSCc1ccccc1 Amb27271863 [1,1,0,0,0,0|2,0,0]=4 8255 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,1,0,0,0,0|1,0,0]=3 8256 B11R1.28 ICCCOc1ccccc1 Amb27271705 [1,1,0,0,0,0|2,0,0]=4 8257 B11R1.28 ICCOCc1ccccc1 Amb16191915 [1,1,0,0,0,0|2,0,0]=4 8258 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [1,1,0,0,0,0|1,0,1]=4 8259 B11R1.28 N#CCCCc1ccccc1 Amb6251750 [1,1,0,0,0,0|1,0,1]=4 8260 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [1,1,0,0,0,0|2,0,0]=4 8261 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [1,1,0,0,0,0|2,0,0]=4 8262 B11R1.28 N#CCCSc1ccccc1 Amb4018040 [1,1,0,0,0,0|2,0,0]=4 8263 B11R1.28 N#CCNCc1ccccc1 Amb4477202 [1,1,0,0,0,0|2,0,0]=4 8264 B11R1.28 N#CCOCc1ccccc1 Amb4011553 [1,1,0,0,0,0|2,0,0]=4 8265 B11R1.28 N#CCSCc1ccccc1 Amb6677693 [1,1,0,0,0,0|2,0,0]=4 8266 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [1,1,0,0,0,0|2,0,0]=4 8267 B11R1.28 N#CNCCc1ccccc1 Amb27763256 [1,1,0,0,0,0|0,0,1]=3 8268 B11R1.28 N#CNOCc1ccccc1 Amb27245690 [1,1,0,0,0,0|1,0,1]=4 8269 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,1,0,0,0,0|1,0,0]=3 8270 B11R1.28 NCCCCc1ccccn1 Amb1102767 [1,1,0,0,0,0|2,0,0]=4 8271 B11R1.28 NCCCCc1cccnc1 Amb5735490 [1,1,0,0,0,0|2,0,0]=4 8272 B11R1.28 NCCCCc1ccncc1 Amb17991253 [1,1,0,0,0,0|2,0,0]=4 8273 B11R1.28 NCCCCc1ccncc1 Amb5735491 [1,1,0,0,0,0|2,0,0]=4 8274 B11R1.28 NCCCNc1ccccc1 Amb10086594 [1,1,0,0,0,0|2,0,0]=4 8275 B11R1.28 NCCCOc1ccccc1 Amb1108619 [1,1,0,0,0,0|2,0,0]=4 8276 B11R1.28 NCCCOc1ccccc1 Amb2606353 [1,1,0,0,0,0|2,0,0]=4 8277 B11R1.28 NCCCSc1ccccc1 Amb1089343 [1,1,0,0,0,0|2,0,0]=4 8278 B11R1.28 NCCCSc1ccccc1 Amb2099802 [1,1,0,0,0,0|2,0,0]=4 8279 B11R1.28 NCCNCc1ccccc1 Amb2725583 [1,1,0,0,0,0|2,0,0]=4 8280 B11R1.28 NCCOCc1ccccc1 Amb1081962 [1,1,0,0,0,0|2,0,0]=4 8281 B11R1.28 NCCOCc1ccccc1 Amb2137059 [1,1,0,0,0,0|2,0,0]=4 8282 B11R1.28 NCCOCc1ccccc1 Amb28524733 [1,1,0,0,0,0|2,0,0]=4 8283 B11R1.28 NCCPCc1ccccc1 Amb27990149 [1,1,0,0,0,0|2,0,0]=4 8284 B11R1.28 NCCSCc1ccccc1 Amb432271 [1,1,0,0,0,0|2,0,0]=4 8285 B11R1.28 NCCSCc1ccccc1 Amb6335199 [1,1,0,0,0,0|2,0,0]=4 8286 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [1,1,0,0,0,0|1,0,1]=4 8287 B11R1.28 NNCC#Cc1ccccc1 Amb27409247 [1,1,0,0,0,0|1,0,1]=4 8288 B11R1.28 NNCCCc1ccccc1 Amb19373221 [1,1,0,0,0,0|1,0,0]=3 8289 B11R1.28 NNCCCc1ccccc1 Amb6252219 [1,1,0,0,0,0|1,0,0]=3 8290 B11R1.28 NNCCCc1ccccn1 Amb27671029 [1,1,0,0,0,0|2,0,0]=4 8291 B11R1.28 NNCCCc1cccnc1 Amb18125323 [1,1,0,0,0,0|2,0,0]=4 8292 B11R1.28 NNCCCc1ccncc1 Amb27671030 [1,1,0,0,0,0|2,0,0]=4 8293 B11R1.28 NNCCNc1ccccc1 Amb28365488 [1,1,0,0,0,0|1,0,0]=3 8294 B11R1.28 NNCCOc1ccccc1 Amb2792851 [1,1,0,0,0,0|1,0,0]=3 8295 B11R1.28 NNCCOc1ccccc1 Amb33624872 [1,1,0,0,0,0|1,0,0]=3 8296 B11R1.28 NNCCOc1ccccc1 Amb9677389 [1,1,0,0,0,0|1,0,0]=3 8297 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [1,1,0,0,0,0|1,0,1]=4 8298 B11R1.28 NOCCCc1ccccc1 Amb2610651 [1,1,0,0,0,0|2,0,0]=4 8299 B11R1.28 NOCCOc1ccccc1 Amb17088287 [1,1,0,0,0,0|2,0,0]=4 8300 B11R1.28 NOCCOc1ccccc1 Amb19894640 [1,1,0,0,0,0|2,0,0]=4 8301 B11R1.28 NOCOCc1ccccc1 Amb10606697 [1,1,0,0,0,0|2,0,0]=4 8302 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [1,1,0,0,0,0|1,0,1]=4 8303 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [1,1,0,0,0,0|0,0,2]=4 8304 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [1,1,0,0,0,0|1,0,1]=4 8305 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [1,1,0,0,0,0|2,0,0]=4 8306 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [1,1,0,0,0,0|2,0,0]=4 8307 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [1,1,0,0,0,0|2,0,0]=4 8308 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [1,1,0,0,0,0|2,0,0]=4 8309 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [1,1,0,0,0,0|2,0,0]=4 8310 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [1,1,0,0,0,0|1,0,1]=4 8311 B11R1.28 O=COCCc1ccccc1 Amb6357955 [1,1,0,0,0,0|1,0,1]=4 8312 B11R1.28 OCCCCc1ccccc1 Amb3939083 [1,1,0,0,0,0|1,0,0]=3 8313 B11R1.28 OCCCCc1ccccn1 Amb21520414 [1,1,0,0,0,0|2,0,0]=4 8314 B11R1.28 OCCCCc1cccnc1 Amb22732495 [1,1,0,0,0,0|2,0,0]=4 8315 B11R1.28 OCCCCc1ccncc1 Amb17740015 [1,1,0,0,0,0|2,0,0]=4 8316 B11R1.28 OCCCNc1ccccc1 Amb17307125 [1,1,0,0,0,0|2,0,0]=4 8317 B11R1.28 OCCCOc1ccccc1 Amb4476987 [1,1,0,0,0,0|2,0,0]=4 8318 B11R1.28 OCCCSc1ccccc1 Amb4018847 [1,1,0,0,0,0|2,0,0]=4 8319 B11R1.28 OCCC[SiH2]c1ccccc1 Amb27989504 [1,1,0,0,0,0|1,1,0]=4 8320 B11R1.28 OCCNCc1ccccc1 Amb1835287 [1,1,0,0,0,0|2,0,0]=4 8321 B11R1.28 OCCNCc1ccccc1 Amb6537902 [1,1,0,0,0,0|2,0,0]=4 8322 B11R1.28 OCCOCc1ccccc1 Amb3939139 [1,1,0,0,0,0|2,0,0]=4 8323 B11R1.28 OCCSCc1ccccc1 Amb2688740 [1,1,0,0,0,0|2,0,0]=4 8324 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [1,1,0,0,0,0|1,0,1]=4 8325 B11R1.28 ONCCCc1ccccc1 Amb26650950 [1,1,0,0,0,0|1,0,0]=3 8326 B11R1.28 ONCCOc1ccccc1 Amb17088413 [1,1,0,0,0,0|1,0,0]=3 8327 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [1,1,0,0,0,0|1,0,1]=4 8328 B11R1.28 S=C=NCCc1ccccc1 Amb6316073 [1,1,0,0,0,0|0,0,2]=4 8329 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,1,0,0,0,0|1,0,0]=3 8330 B11R1.28 SCCCCc1ccccn1 Amb18563822 [1,1,0,0,0,0|2,0,0]=4 8331 B11R1.28 SCCCCc1cccnc1 Amb18563823 [1,1,0,0,0,0|2,0,0]=4 8332 B11R1.28 SCCCCc1ccncc1 Amb18065469 [1,1,0,0,0,0|2,0,0]=4 8333 B11R1.28 SCCCOc1ccccc1 Amb6255479 [1,1,0,0,0,0|2,0,0]=4 8334 B11R1.28 SCCNCc1ccccc1 Amb4405222 [1,1,0,0,0,0|2,0,0]=4 8335 B11R1.28 SCCOCc1ccccc1 Amb27457406 [1,1,0,0,0,0|2,0,0]=4 8336 B11R1.28 [C-]#[N+]CCCc1ccccc1 Amb2690315 [1,1,0,0,0,0|0,0,2]=4 8337 B11R1.28 [C-]#[N+]CCOc1ccccc1 Amb27428630 [1,1,0,0,0,0|0,0,2]=4 8338 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [1,1,0,0,0,0|1,0,1]=4 8339 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [1,1,0,0,0,0|1,0,1]=4 8340 B11R1.40 C#CC(O)Cc1ccccc1 Amb8392589 [1,1,0,0,0,0|1,0,1]=4 8341 B11R1.40 C#C[C@H](N)Cc1ccccc1 Amb27468328 [1,1,0,0,0,0|1,0,1]=4 8342 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [1,1,0,0,0,0|1,0,1]=4 8343 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [1,1,0,0,0,0|1,0,1]=4 8344 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [1,1,0,0,0,0|1,0,1]=4 8345 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,1,0,0,0,0|1,0,1]=4 8346 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [1,1,0,0,0,0|1,0,1]=4 8347 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [1,1,0,0,0,0|2,0,0]=4 8348 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [1,1,0,0,0,0|2,0,0]=4 8349 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,1,0,0,0,0|2,0,0]=4 8350 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [1,1,0,0,0,0|2,0,0]=4 8351 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,1,0,0,0,0|2,0,0]=4 8352 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [1,1,0,0,0,0|2,0,0]=4 8353 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [1,1,0,0,0,0|2,0,0]=4 8354 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [1,1,0,0,0,0|1,0,0]=3 8355 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [1,1,0,0,0,0|1,0,0]=3 8356 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [1,1,0,0,0,0|2,0,0]=4 8357 B11R1.40 CC(Cc1ccccn1)NN Amb27976484 [1,1,0,0,0,0|2,0,0]=4 8358 B11R1.40 CC(Cc1ccncc1)NN Amb27493950 [1,1,0,0,0,0|2,0,0]=4 8359 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [1,1,0,0,0,0|1,0,1]=4 8360 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,1,0,0,0,0|1,0,0]=3 8361 B11R1.40 CCC(Br)Cc1ccccn1 Amb28285520 [1,1,0,0,0,0|2,0,0]=4 8362 B11R1.40 CCC(Br)Cc1ccncc1 Amb24353281 [1,1,0,0,0,0|2,0,0]=4 8363 B11R1.40 CCC(Br)Cc1ccncc1 Amb32758727 [1,1,0,0,0,0|2,0,0]=4 8364 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [1,1,0,0,0,0|2,0,0]=4 8365 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,1,0,0,0,0|2,0,0]=4 8366 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,1,0,0,0,0|2,0,0]=4 8367 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,1,0,0,0,0|1,0,0]=3 8368 B11R1.40 CCC(Cl)Cc1ccncc1 Amb17477712 [1,1,0,0,0,0|2,0,0]=4 8369 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [1,1,0,0,0,0|1,0,0]=3 8370 B11R1.40 CCC(N)Cc1ccccn1 Amb7772139 [1,1,0,0,0,0|2,0,0]=4 8371 B11R1.40 CCC(N)Cc1cccnc1 Amb9428899 [1,1,0,0,0,0|2,0,0]=4 8372 B11R1.40 CCC(N)Cc1ccncc1 Amb9428894 [1,1,0,0,0,0|2,0,0]=4 8373 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [1,1,0,0,0,0|1,0,0]=3 8374 B11R1.40 CCC(O)Cc1ccccn1 Amb17477703 [1,1,0,0,0,0|2,0,0]=4 8375 B11R1.40 CCC(O)Cc1ccncc1 Amb17477704 [1,1,0,0,0,0|2,0,0]=4 8376 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [1,1,0,0,0,0|1,0,0]=3 8377 B11R1.40 CCN(N)Cc1ccccc1 Amb17232076 [1,1,0,0,0,0|2,0,0]=4 8378 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,1,0,0,0,0|1,0,0]=3 8379 B11R1.40 CC[C@@H](N)Cc1ccccn1 Amb27471046 [1,1,0,0,0,0|2,0,0]=4 8380 B11R1.40 CC[C@@H](N)Cc1ccncc1 Amb27945734 [1,1,0,0,0,0|2,0,0]=4 8381 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,1,0,0,0,0|1,0,0]=3 8382 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [1,1,0,0,0,0|1,0,0]=3 8383 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,1,0,0,0,0|1,0,0]=3 8384 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [1,1,0,0,0,0|1,0,0]=3 8385 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [1,1,0,0,0,0|1,0,1]=4 8386 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [1,1,0,0,0,0|1,0,1]=4 8387 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [1,1,0,0,0,0|0,0,1]=3 8388 B11R1.40 CNC(=O)Cc1ccccn1 Amb28365941 [1,1,0,0,0,0|1,0,1]=4 8389 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [1,1,0,0,0,0|1,0,1]=4 8390 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [1,1,0,0,0,0|1,0,1]=4 8391 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [1,1,0,0,0,0|1,0,1]=4 8392 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [1,1,0,0,0,0|1,0,1]=4 8393 B11R1.40 CNC(=S)Cc1ccncc1 Amb28119234 [1,1,0,0,0,0|1,0,1]=4 8394 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [1,1,0,0,0,0|1,0,1]=4 8395 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [1,1,0,0,0,0|1,0,1]=4 8396 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [1,1,0,0,0,0|0,0,0]=2 8397 B11R1.40 CNC(C)Cc1ccccn1 Amb1995150 [1,1,0,0,0,0|1,0,0]=3 8398 B11R1.40 CNC(C)Cc1cccnc1 Amb5735448 [1,1,0,0,0,0|1,0,0]=3 8399 B11R1.40 CNC(C)Cc1ccncc1 Amb5735449 [1,1,0,0,0,0|1,0,0]=3 8400 B11R1.40 CNC(C)Cc1cnccn1 Amb1995173 [1,1,0,0,0,0|2,0,0]=4 8401 B11R1.40 CNC(O)Cc1ccccc1 Amb34915471 [1,1,0,0,0,0|0,0,0]=2 8402 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [1,1,0,0,0,0|0,0,0]=2 8403 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [1,1,0,0,0,0|0,0,0]=2 8404 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [1,1,0,0,0,0|0,0,2]=4 8405 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,1,0,0,0,0|1,0,1]=4 8406 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,1,0,0,0,0|1,0,1]=4 8407 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [1,1,0,0,0,0|1,0,1]=4 8408 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [1,1,0,0,0,0|2,0,0]=4 8409 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [1,1,0,0,0,0|2,0,0]=4 8410 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,1,0,0,0,0|2,0,0]=4 8411 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [1,1,0,0,0,0|2,0,0]=4 8412 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [1,1,0,0,0,0|2,0,0]=4 8413 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,1,0,0,0,0|2,0,0]=4 8414 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [1,1,0,0,0,0|0,0,2]=4 8415 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,1,0,0,0,0|2,0,0]=4 8416 B11R1.40 N#CC(Br)Cc1ccccc1 Amb1154191 [1,1,0,0,0,0|2,0,0]=4 8417 B11R1.40 N#CC(Cl)Cc1ccccc1 Amb1103676 [1,1,0,0,0,0|2,0,0]=4 8418 B11R1.40 N#CC(N)Cc1ccccc1 Amb6892763 [1,1,0,0,0,0|2,0,0]=4 8419 B11R1.40 N#CC(N)Cc1ccccc1 Amb9707863 [1,1,0,0,0,0|2,0,0]=4 8420 B11R1.40 N#C[C@@H](N)Cc1ccccc1 Amb17399902 [1,1,0,0,0,0|2,0,0]=4 8421 B11R1.40 N#C[C@H](N)Cc1ccccc1 Amb26366283 [1,1,0,0,0,0|2,0,0]=4 8422 B11R1.40 N=C(Cc1ccccc1)NN Amb2616207 [1,1,0,0,0,0|1,0,1]=4 8423 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,1,0,0,0,0|1,0,1]=4 8424 B11R1.40 NC(CBr)Cc1ccccc1 Amb26619555 [1,1,0,0,0,0|2,0,0]=4 8425 B11R1.40 NC(CCl)Cc1ccccc1 Amb28076898 [1,1,0,0,0,0|2,0,0]=4 8426 B11R1.40 NC(CO)Cc1ccccc1 Amb6739795 [1,1,0,0,0,0|2,0,0]=4 8427 B11R1.40 NC(CS)Cc1ccccc1 Amb27401982 [1,1,0,0,0,0|2,0,0]=4 8428 B11R1.40 NCC(N)Cc1ccccc1 Amb9380670 [1,1,0,0,0,0|2,0,0]=4 8429 B11R1.40 NCC(O)Cc1ccccc1 Amb2697590 [1,1,0,0,0,0|2,0,0]=4 8430 B11R1.40 NCC(O)Cc1ccccc1 Amb8630271 [1,1,0,0,0,0|2,0,0]=4 8431 B11R1.40 NC[C@@H](N)Cc1ccccc1 Amb17619360 [1,1,0,0,0,0|2,0,0]=4 8432 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,1,0,0,0,0|2,0,0]=4 8433 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb33456886 [1,1,0,0,0,0|2,0,0]=4 8434 B11R1.40 NC[C@H](N)Cc1ccccc1 Amb17619359 [1,1,0,0,0,0|2,0,0]=4 8435 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,1,0,0,0,0|2,0,0]=4 8436 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [1,1,0,0,0,0|1,0,1]=4 8437 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb27413229 [1,1,0,0,0,0|2,0,0]=4 8438 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb33624252 [1,1,0,0,0,0|2,0,0]=4 8439 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb534734 [1,1,0,0,0,0|2,0,0]=4 8440 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [1,1,0,0,0,0|2,0,0]=4 8441 B11R1.40 N[C@H](CBr)Cc1ccccc1 Amb25923127 [1,1,0,0,0,0|2,0,0]=4 8442 B11R1.40 N[C@H](CO)Cc1ccccc1 Amb3939343 [1,1,0,0,0,0|2,0,0]=4 8443 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [1,1,0,0,0,0|2,0,0]=4 8444 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [1,1,0,0,0,0|2,0,0]=4 8445 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [1,1,0,0,0,0|2,0,0]=4 8446 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [1,1,0,0,0,0|2,0,0]=4 8447 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [1,1,0,0,0,0|2,0,0]=4 8448 B11R1.40 OC(CBr)Cc1ccccc1 Amb17595843 [1,1,0,0,0,0|2,0,0]=4 8449 B11R1.40 OC(CCl)Cc1ccccc1 Amb4035193 [1,1,0,0,0,0|2,0,0]=4 8450 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,1,0,0,0,0|2,0,0]=4 8451 B11R1.40 OCC(Br)Cc1ccccc1 Amb27225418 [1,1,0,0,0,0|2,0,0]=4 8452 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,1,0,0,0,0|2,0,0]=4 8453 B11R1.40 OCC(O)Cc1ccccc1 Amb17593786 [1,1,0,0,0,0|2,0,0]=4 8454 B11R1.40 OCC(S)Cc1ccccc1 Amb28292008 [1,1,0,0,0,0|2,0,0]=4 8455 B11R1.40 OC[C@@H](Br)Cc1ccccc1 Amb26974518 [1,1,0,0,0,0|2,0,0]=4 8456 B11R1.40 OC[C@@H](Cl)Cc1ccccc1 Amb25984616 [1,1,0,0,0,0|2,0,0]=4 8457 B11R1.40 OC[C@H](F)Cc1ccccc1 Amb27756441 [1,1,0,0,0,0|2,0,0]=4 8458 B11R1.40 O[C@@H](CBr)Cc1ccccc1 Amb28135916 [1,1,0,0,0,0|2,0,0]=4 8459 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,1,0,0,0,0|2,0,0]=4 8460 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,1,0,0,0,0|2,0,0]=4 8461 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [1,1,0,0,0,0|0,0,2]=4 8462 B11R1.40 [NH3+]C(CO)Cc1ccccc1 Amb33512954 [1,1,0,0,0,0|2,0,0]=4 8463 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [1,1,0,0,0,0|1,0,0]=3 8464 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [1,1,0,0,0,0|2,0,0]=4 8465 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [1,1,0,0,0,0|2,0,0]=4 8466 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [1,1,0,0,0,0|2,0,0]=4 8467 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [1,1,0,0,0,0|2,0,0]=4 8468 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [1,1,0,0,0,0|2,0,0]=4 8469 B11R1.91 C=[ClH](C)COc1ccccc1 Amb28059898 [1,1,0,0,0,0|2,0,0]=4 8470 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,1,0,0,0,0|2,0,0]=4 8471 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,1,0,0,0,0|2,0,0]=4 8472 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [1,1,0,0,0,0|1,0,0]=3 8473 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,1,0,0,0,0|2,0,0]=4 8474 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,1,0,0,0,0|2,0,0]=4 8475 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,1,0,0,0,0|2,0,0]=4 8476 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [1,1,0,0,0,0|2,0,0]=4 8477 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,1,0,0,0,0|2,0,0]=4 8478 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [1,1,0,0,0,0|2,0,0]=4 8479 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [1,1,0,0,0,0|2,0,0]=4 8480 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,1,0,0,0,0|2,0,0]=4 8481 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,1,0,0,0,0|2,0,0]=4 8482 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [1,1,0,0,0,0|2,0,0]=4 8483 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,1,0,0,0,0|2,0,0]=4 8484 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [1,1,0,0,0,0|1,0,0]=3 8485 B11R1.91 CC(Br)CCc1cccnc1 Amb28401177 [1,1,0,0,0,0|2,0,0]=4 8486 B11R1.91 CC(Br)CNc1ccccc1 Amb28428528 [1,1,0,0,0,0|2,0,0]=4 8487 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [1,1,0,0,0,0|2,0,0]=4 8488 B11R1.91 CC(Br)CSc1ccccc1 Amb27628746 [1,1,0,0,0,0|2,0,0]=4 8489 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [1,1,0,0,0,0|1,0,1]=4 8490 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [1,1,0,0,0,0|2,0,0]=4 8491 B11R1.91 CC(C)CC[n+]1ccccc1 Amb27809209 [1,1,0,0,0,0|2,0,0]=4 8492 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [1,1,0,0,0,0|1,0,0]=3 8493 B11R1.91 CC(C)CCc1ccccn1 Amb27400236 [1,1,0,0,0,0|2,0,0]=4 8494 B11R1.91 CC(C)CNc1ccccc1 Amb28960302 [1,1,0,0,0,0|2,0,0]=4 8495 B11R1.91 CC(C)CNc1ccccc1 Amb4304155 [1,1,0,0,0,0|2,0,0]=4 8496 B11R1.91 CC(C)COc1ccccc1 Amb27668259 [1,1,0,0,0,0|2,0,0]=4 8497 B11R1.91 CC(C)CSc1ccccc1 Amb4016673 [1,1,0,0,0,0|2,0,0]=4 8498 B11R1.91 CC(C)NCc1ccccc1 Amb4020804 [1,1,0,0,0,0|2,0,0]=4 8499 B11R1.91 CC(C)NCc1ccccc1 Amb6383293 [1,1,0,0,0,0|2,0,0]=4 8500 B11R1.91 CC(C)OCc1ccccc1 Amb3988003 [1,1,0,0,0,0|2,0,0]=4 8501 B11R1.91 CC(C)SCc1ccccc1 Amb25935134 [1,1,0,0,0,0|2,0,0]=4 8502 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [1,1,0,0,0,0|1,0,0]=3 8503 B11R1.91 CC(Cl)CCc1ccccn1 Amb27763955 [1,1,0,0,0,0|2,0,0]=4 8504 B11R1.91 CC(Cl)SCc1ccccc1 Amb27638041 [1,1,0,0,0,0|2,0,0]=4 8505 B11R1.91 CC(F)CNc1ccccc1 Amb27872143 [1,1,0,0,0,0|2,0,0]=4 8506 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [1,1,0,0,0,0|1,0,0]=3 8507 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [1,1,0,0,0,0|1,0,0]=3 8508 B11R1.91 CC(N)CCc1ccccn1 Amb17507327 [1,1,0,0,0,0|2,0,0]=4 8509 B11R1.91 CC(N)CCc1cccnc1 Amb17507328 [1,1,0,0,0,0|2,0,0]=4 8510 B11R1.91 CC(N)CCc1ccncc1 Amb17507329 [1,1,0,0,0,0|2,0,0]=4 8511 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [1,1,0,0,0,0|2,0,0]=4 8512 B11R1.91 CC(N)COc1ccccc1 Amb10609380 [1,1,0,0,0,0|2,0,0]=4 8513 B11R1.91 CC(N)COc1ccccc1 Amb9756346 [1,1,0,0,0,0|2,0,0]=4 8514 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [1,1,0,0,0,0|2,0,0]=4 8515 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [1,1,0,0,0,0|2,0,0]=4 8516 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [1,1,0,0,0,0|1,0,0]=3 8517 B11R1.91 CC(O)CCc1ccccn1 Amb17507263 [1,1,0,0,0,0|2,0,0]=4 8518 B11R1.91 CC(O)CCc1cccnc1 Amb17507264 [1,1,0,0,0,0|2,0,0]=4 8519 B11R1.91 CC(O)CCc1ccncc1 Amb17507265 [1,1,0,0,0,0|2,0,0]=4 8520 B11R1.91 CC(O)CNc1ccccc1 Amb6537763 [1,1,0,0,0,0|2,0,0]=4 8521 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [1,1,0,0,0,0|2,0,0]=4 8522 B11R1.91 CC(O)CPc1ccccc1 Amb27756306 [1,1,0,0,0,0|2,0,0]=4 8523 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,1,0,0,0,0|2,0,0]=4 8524 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [1,1,0,0,0,0|1,0,0]=3 8525 B11R1.91 CC(S)COc1ccccc1 Amb29854435 [1,1,0,0,0,0|2,0,0]=4 8526 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [1,1,0,0,0,0|0,0,0]=2 8527 B11R1.91 CN(C)CCc1ccccn1 Amb2725569 [1,1,0,0,0,0|1,0,0]=3 8528 B11R1.91 CN(C)CCc1cccnc1 Amb8484655 [1,1,0,0,0,0|1,0,0]=3 8529 B11R1.91 CN(C)CCc1ccncc1 Amb24073816 [1,1,0,0,0,0|1,0,0]=3 8530 B11R1.91 CN(C)CCc1cnccn1 Amb4005051 [1,1,0,0,0,0|2,0,0]=4 8531 B11R1.91 CN(C)NCc1ccccc1 Amb25921006 [1,1,0,0,0,0|1,0,0]=3 8532 B11R1.91 CN(C)NCc1ccccn1 Amb27831849 [1,1,0,0,0,0|2,0,0]=4 8533 B11R1.91 CN(C)\C=N\c1ccccc1 Amb33512937 [1,1,0,0,0,0|1,0,1]=4 8534 B11R1.91 CN(C)\N=C\c1ccccc1 Amb33512938 [1,1,0,0,0,0|1,0,1]=4 8535 B11R1.91 CN(C)\N=N\c1ccccc1 Amb4016230 [1,1,0,0,0,0|2,0,0]=4 8536 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,1,0,0,0,0|0,0,0]=2 8537 B11R1.91 CN(N)CCc1ccncc1 Amb28187960 [1,1,0,0,0,0|1,0,0]=3 8538 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [1,1,0,0,0,0|0,0,0]=2 8539 B11R1.91 CN(O)CCc1ccncc1 Amb25684228 [1,1,0,0,0,0|1,0,0]=3 8540 B11R1.91 CN(O)\N=N\c1ccccc1 Amb27185830 [1,1,0,0,0,0|2,0,0]=4 8541 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [1,1,0,0,0,0|1,0,0]=3 8542 B11R1.91 C[C@@H](N)CCc1ccccn1 Amb25076768 [1,1,0,0,0,0|2,0,0]=4 8543 B11R1.91 C[C@@H](N)CCc1cccnc1 Amb27461341 [1,1,0,0,0,0|2,0,0]=4 8544 B11R1.91 C[C@@H](N)CCc1ccncc1 Amb24551017 [1,1,0,0,0,0|2,0,0]=4 8545 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [1,1,0,0,0,0|2,0,0]=4 8546 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,1,0,0,0,0|1,0,0]=3 8547 B11R1.91 C[C@@H](O)CCc1ccccn1 Amb33360774 [1,1,0,0,0,0|2,0,0]=4 8548 B11R1.91 C[C@@H](O)CCc1cccnc1 Amb33360059 [1,1,0,0,0,0|2,0,0]=4 8549 B11R1.91 C[C@@H](O)CCc1ccncc1 Amb33380653 [1,1,0,0,0,0|2,0,0]=4 8550 B11R1.91 C[C@@H](O)CNc1ccccc1 Amb27400122 [1,1,0,0,0,0|2,0,0]=4 8551 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [1,1,0,0,0,0|2,0,0]=4 8552 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [1,1,0,0,0,0|1,0,0]=3 8553 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [1,1,0,0,0,0|1,0,0]=3 8554 B11R1.91 C[C@H](N)CCc1ccccn1 Amb27655480 [1,1,0,0,0,0|2,0,0]=4 8555 B11R1.91 C[C@H](N)CCc1cccnc1 Amb27391591 [1,1,0,0,0,0|2,0,0]=4 8556 B11R1.91 C[C@H](N)CCc1ccncc1 Amb24715801 [1,1,0,0,0,0|2,0,0]=4 8557 B11R1.91 C[C@H](N)COc1ccccc1 Amb17232092 [1,1,0,0,0,0|2,0,0]=4 8558 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,1,0,0,0,0|1,0,0]=3 8559 B11R1.91 C[C@H](O)CCc1ccccn1 Amb33360775 [1,1,0,0,0,0|2,0,0]=4 8560 B11R1.91 C[C@H](O)CCc1cccnc1 Amb33360413 [1,1,0,0,0,0|2,0,0]=4 8561 B11R1.91 C[C@H](O)CCc1ccncc1 Amb33380654 [1,1,0,0,0,0|2,0,0]=4 8562 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [1,1,0,0,0,0|1,1,0]=4 8563 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [1,1,0,0,0,0|2,0,0]=4 8564 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [1,1,0,0,0,0|2,0,0]=4 8565 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [1,1,0,0,0,0|2,0,0]=4 8566 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,1,0,0,0,0|2,0,0]=4 8567 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [1,1,0,0,0,0|2,0,0]=4 8568 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,1,0,0,0,0|2,0,0]=4 8569 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [1,1,0,0,0,0|2,0,0]=4 8570 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [1,1,0,0,0,0|2,0,0]=4 8571 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [1,1,0,0,0,0|1,0,1]=4 8572 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [1,1,0,0,0,0|1,1,0]=4 8573 B11R1.91 OB(O)CCc1ccccc1 Amb2456045 [1,1,0,0,0,0|2,0,0]=4 8574 B11R1.18 CCc1ccsc1CCNC Amb32729310 [0,1,0,0,1,0|2,0,0]=4 8575 B11R1.90 CC(=O)CCc1sccc1Br Amb25329410 [0,1,0,0,1,0|2,0,0]=4 8576 B11R1.90 CC(C)CCc1ccsc1Br Amb18743196 [0,1,0,0,1,0|2,0,0]=4 8577 B11R1.90 CC(N)CCc1ccsc1Br Amb27773345 [0,1,0,0,1,0|2,0,0]=4 8578 B11R1.90 CC(N)CCc1cscc1Br Amb27412458 [0,1,0,0,1,0|2,0,0]=4 8579 B11R1.90 CC(N)CCc1sccc1Br Amb18294509 [0,1,0,0,1,0|2,0,0]=4 8580 B11R1.90 CC(O)CCc1occc1Br Amb27798185 [0,1,0,0,1,0|2,0,0]=4 8581 B11R1.90 CC(O)CCc1sccc1Br Amb28043657 [0,1,0,0,1,0|2,0,0]=4 8582 B11R1.90 CN(C)CCc1ccsc1Br Amb27764783 [0,1,0,0,1,0|1,0,0]=3 8583 B11R1.90 CN(C)CCn1ccnc1Br Amb17404906 [0,1,0,0,1,0|2,0,0]=4 8584 B11R1.90 CN(C)NCc1ccsc1Br Amb27200519 [0,1,0,0,1,0|2,0,0]=4 8585 B11R1.90 CN(C)NCc1occc1Br Amb27853357 [0,1,0,0,1,0|2,0,0]=4 8586 B11R1.90 C[C@@H](N)CCc1sccc1Br Amb33387210 [0,1,0,0,1,0|2,0,0]=4 8587 B11R1.90 C[C@@H](O)CCc1sccc1Br Amb33387207 [0,1,0,0,1,0|2,0,0]=4 8588 B11R1.90 C[C@H](N)CCc1sccc1Br Amb33387332 [0,1,0,0,1,0|2,0,0]=4 8589 B11R1.90 C[C@H](O)CCc1sccc1Br Amb33387334 [0,1,0,0,1,0|2,0,0]=4 8590 B11R1.90 Cc1sccc1CCN(C)C Amb27267850 [0,1,0,0,1,0|2,0,0]=4 8591 B11R1.180 BrCCCCc1sccc1Br Amb27987857 [0,1,0,0,1,0|2,0,0]=4 8592 B11R1.180 CCCNCc1ccoc1Br Amb27671507 [0,1,0,0,1,0|2,0,0]=4 8593 B11R1.180 CCCNCc1ccsc1Br Amb27673067 [0,1,0,0,1,0|2,0,0]=4 8594 B11R1.180 CCCNCc1cscc1Br Amb25380434 [0,1,0,0,1,0|2,0,0]=4 8595 B11R1.180 CCCNCc1sccc1Br Amb27269142 [0,1,0,0,1,0|2,0,0]=4 8596 B11R1.180 CCCOCc1ccsc1Br Amb27673090 [0,1,0,0,1,0|2,0,0]=4 8597 B11R1.180 CCCSCc1ccsc1Br Amb27673960 [0,1,0,0,1,0|2,0,0]=4 8598 B11R1.180 CCNCCc1ccoc1C Amb27989304 [0,1,0,0,1,0|2,0,0]=4 8599 B11R1.180 CCNCCc1ccsc1Br Amb27673104 [0,1,0,0,1,0|1,0,0]=3 8600 B11R1.180 CCNCCc1ccsc1C Amb27271143 [0,1,0,0,1,0|2,0,0]=4 8601 B11R1.180 CCNCCc1occc1Br Amb27266774 [0,1,0,0,1,0|1,0,0]=3 8602 B11R1.180 CCNCCc1occc1C Amb27670325 [0,1,0,0,1,0|2,0,0]=4 8603 B11R1.180 CCNCCc1sccc1Br Amb18312587 [0,1,0,0,1,0|1,0,0]=3 8604 B11R1.180 CCNCCc1sccc1C Amb27670956 [0,1,0,0,1,0|2,0,0]=4 8605 B11R1.180 CCNCCc1sccc1Cl Amb27271047 [0,1,0,0,1,0|1,1,0]=4 8606 B11R1.180 CNCC#Cc1sccc1Br Amb28318967 [0,1,0,0,1,0|1,0,1]=4 8607 B11R1.180 CNCCCc1ccsc1Br Amb27673084 [0,1,0,0,1,0|1,0,0]=3 8608 B11R1.180 CNCCCc1occc1Br Amb27986880 [0,1,0,0,1,0|1,0,0]=3 8609 B11R1.180 CNCCCc1sccc1Cl Amb27271048 [0,1,0,0,1,0|1,1,0]=4 8610 B11R1.180 CNCCSc1ccoc1C Amb27670686 [0,1,0,0,1,0|2,0,0]=4 8611 B11R1.180 ClCCCCc1ccsc1Br Amb27673991 [0,1,0,0,1,0|2,0,0]=4 8612 B11R1.180 NCCCCc1ccsc1Br Amb27673992 [0,1,0,0,1,0|2,0,0]=4 8613 B11R1.180 NCCCCc1sccc1Br Amb27986874 [0,1,0,0,1,0|2,0,0]=4 8614 B11R1.180 OCCCCc1ccsc1Br Amb27989303 [0,1,0,0,1,0|2,0,0]=4 8615 B11R1.180 OCCCCc1sccc1Br Amb27986871 [0,1,0,0,1,0|2,0,0]=4 8616 B11R1.199 CCCC(Cl)c1cscc1Br Amb27854031 [0,1,0,0,1,0|2,0,0]=4 8617 B11R1.199 CCCC(Cl)c1occc1Br Amb27458087 [0,1,0,0,1,0|2,0,0]=4 8618 B11R1.199 CCCC(N)c1ccsc1Br Amb35602847 [0,1,0,0,1,0|2,0,0]=4 8619 B11R1.199 CCCC(N)c1cscc1Br Amb27397570 [0,1,0,0,1,0|2,0,0]=4 8620 B11R1.199 CCCC(O)c1ccsc1Br Amb29890864 [0,1,0,0,1,0|2,0,0]=4 8621 B11R1.199 CCCC(O)c1cscc1Br Amb27848919 [0,1,0,0,1,0|2,0,0]=4 8622 B11R1.199 CCC[C@@H](N)c1cscc1Br Amb27238662 [0,1,0,0,1,0|2,0,0]=4 8623 B11R1.199 CNCC(=O)c1cscc1Br Amb25989829 [0,1,0,0,1,0|1,0,1]=4 8624 B11R1.199 CNCC(=O)c1occc1Br Amb25698018 [0,1,0,0,1,0|1,0,1]=4 8625 B11R1.199 CNCC(=O)c1sccc1Br Amb24401206 [0,1,0,0,1,0|1,0,1]=4 8626 B11R1.199 CNCC(O)c1cccn1C Amb26317821 [0,1,0,0,1,0|2,0,0]=4 8627 B11R1.199 CNCC(O)c1ccoc1C Amb33473296 [0,1,0,0,1,0|2,0,0]=4 8628 B11R1.199 CNCC(O)c1ccsc1C Amb27826777 [0,1,0,0,1,0|2,0,0]=4 8629 B11R1.199 CNCC(O)c1cscc1Br Amb27165921 [0,1,0,0,1,0|1,0,0]=3 8630 B11R1.199 CNCC(O)c1cscc1C Amb33147696 [0,1,0,0,1,0|2,0,0]=4 8631 B11R1.199 CNCC(O)c1occc1C Amb33343969 [0,1,0,0,1,0|2,0,0]=4 8632 B11R1.199 CNCC(O)c1sccc1Br Amb26013039 [0,1,0,0,1,0|1,0,0]=3 8633 B11R1.199 CNCC(O)c1sccc1C Amb18301176 [0,1,0,0,1,0|2,0,0]=4 8634 B11R1.199 CNCC(O)c1sccc1Cl Amb27475562 [0,1,0,0,1,0|1,1,0]=4 8635 B11R1.199 COCC(N)c1ccsc1Br Amb35602848 [0,1,0,0,1,0|2,0,0]=4 8636 B11R1.199 COCC(O)c1ccsc1Br Amb29890865 [0,1,0,0,1,0|2,0,0]=4 8637 B11R1.199 COC[C@H](N)c1sccc1Br Amb28398021 [0,1,0,0,1,0|2,0,0]=4 8638 B11R1.199 CSCC(N)c1cscc1Br Amb28133864 [0,1,0,0,1,0|2,0,0]=4 8639 B11R1.212 CNCCc1scc(C)c1Br Amb33433534 [0,1,0,0,1,0|1,0,0]=3 8640 B11R1.228 CC(Cc1sccc1Br)NN Amb27823482 [0,1,0,0,1,0|2,0,0]=4 8641 B11R1.228 CCC(Cl)Cc1ccsc1Br Amb27452636 [0,1,0,0,1,0|2,0,0]=4 8642 B11R1.228 CCC(N)Cc1sccc1Br Amb18993574 [0,1,0,0,1,0|2,0,0]=4 8643 B11R1.228 CCC(O)Cc1sccc1Br Amb27617386 [0,1,0,0,1,0|2,0,0]=4 8644 B11R1.228 CNC(C)Cc1ccsc1Br Amb28069350 [0,1,0,0,1,0|1,0,0]=3 8645 B11R1.228 CNC(C)Cc1ccsc1Cl Amb29878412 [0,1,0,0,1,0|1,1,0]=4 8646 B11R1.230 CCCCc1cc(Br)sc1Br Amb2696543 [0,1,0,0,1,0|2,0,0]=4 8647 B11R1.230 CNCCc1cc(C)oc1C Amb33141069 [0,1,0,0,1,0|2,0,0]=4 8648 B11R1.230 CNCCc1cc(C)sc1C Amb25327228 [0,1,0,0,1,0|2,0,0]=4 8649 B11R1.230 CNCCc1nn(C)cc1Br Amb31308550 [0,1,0,0,1,0|2,0,0]=4 8650 B11R1.230 CNCCc1oc(Br)cc1C Amb33450675 [0,1,0,0,1,0|2,0,0]=4 8651 B11R1.230 CNCCc1oc(C)cc1C Amb27225152 [0,1,0,0,1,0|2,0,0]=4 8652 B11R1.230 CNCCc1sc(C)cc1Br Amb33431115 [0,1,0,0,1,0|1,0,0]=3 8653 B13R1.34 COCCNC1=CC=CC=CC1=O Amb28255543 [0,1,0,0,0,1|2,0,0]=4 8654 B13R1.1148 CCCCNC1=CC(=O)C=CC=C1 Amb28343146 [0,1,0,0,0,1|2,0,0]=4 8655 B13R1.1920 CCCCC1=CC=CC(=O)C(C)=C1 Amb27434302 [0,1,0,0,0,1|2,0,0]=4 8656 B13R1.12 C#CCC(O)c1cccc(C)c1Br Amb27253688 [0,2,0,0,0,0|1,0,1]=4 8657 B13R1.12 C=CCC(N)c1cccc(Br)c1Br Amb28204167 [0,2,0,0,0,0|1,0,1]=4 8658 B13R1.12 C=CC[C@@H](N)c1cccc(Cl)c1Br Amb28136700 [0,2,0,0,0,0|1,0,1]=4 8659 B13R1.12 C=CC[C@H](N)c1cccc(O)c1Br Amb27867524 [0,2,0,0,0,0|1,0,1]=4 8660 B13R1.12 CC(CCN)c1cccc(F)c1Br Amb33450955 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.12 CC(CCN)c1cccc(O)c1Br Amb33386526 [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.12 CC(CON)c1cccc(F)c1Br Amb33450536 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.12 CC(CON)c1cccc(O)c1Br Amb33386805 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.12 CCCC(=O)c1cccc(C)c1Br Amb27478292 [0,2,0,0,0,0|1,0,1]=4 8665 B13R1.12 CCCC(C)c1cccc(N)c1O Amb28255544 [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.12 CCCC(Cl)c1cccc(F)c1F Amb27458101 [0,2,0,0,0,0|1,1,0]=4 8667 B13R1.12 CCCC(N)c1cccc(Br)c1C Amb27795679 [0,2,0,0,0,0|2,0,0]=4 8668 B13R1.12 CCCC(N)c1cccc(C)c1Br Amb28388813 [0,2,0,0,0,0|1,0,0]=3 8669 B13R1.12 CCCC(N)c1cccc(C)c1C Amb17233372 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.12 CCCC(N)c1cccc(C)c1F Amb27873452 [0,2,0,0,0,0|1,1,0]=4 8671 B13R1.12 CCCC(N)c1cccc(C)c1O Amb27445025 [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.12 CCCC(N)c1cccc(Cl)c1N Amb27851086 [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.12 CCCC(N)c1cccc(Cl)c1O Amb28397300 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.12 CCCC(N)c1cccc(F)c1F Amb25691968 [0,2,0,0,0,0|1,1,0]=4 8675 B13R1.12 CCCC(N)c1cccc(F)c1O Amb27184581 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.12 CCCC(N)c1cccc(I)c1Br Amb27450458 [0,2,0,0,0,0|1,0,0]=3 8677 B13R1.12 CCCC(N)c1cccc(N)c1C Amb27875880 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.12 CCCC(N)c1cccc(O)c1Br Amb28430514 [0,2,0,0,0,0|1,0,0]=3 8679 B13R1.12 CCCC(N)c1ccnc(Cl)c1Br Amb27463206 [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.12 CCCC(O)c1cccc(C)c1Br Amb27177384 [0,2,0,0,0,0|1,0,0]=3 8681 B13R1.12 CCCC(O)c1cccc(C)c1C Amb17233485 [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.12 CCCC(O)c1cccc(Cl)c1C Amb25694315 [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.12 CCCC(O)c1cccc(Cl)c1F Amb28240674 [0,2,0,0,0,0|1,1,0]=4 8684 B13R1.12 CCCC(O)c1cccc(F)c1Br Amb27985197 [0,2,0,0,0,0|1,0,0]=3 8685 B13R1.12 CCCC(O)c1cccc(F)c1C Amb27609576 [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.12 CCCC(O)c1cccc(F)c1F Amb28241855 [0,2,0,0,0,0|1,1,0]=4 8687 B13R1.12 CCCC(O)c1cccc(F)c1N Amb35582027 [0,2,0,0,0,0|2,0,0]=4 8688 B13R1.12 CCCC(O)c1cccc(N)c1C Amb35622576 [0,2,0,0,0,0|2,0,0]=4 8689 B13R1.12 CCCC(O)c1cccc(N)c1F Amb35741060 [0,2,0,0,0,0|1,1,0]=4 8690 B13R1.12 CCC[C@@H](N)c1cccc(Br)c1F Amb28312900 [0,2,0,0,0,0|1,1,0]=4 8691 B13R1.12 CCC[C@@H](N)c1cccc(Br)c1O Amb27758489 [0,2,0,0,0,0|2,0,0]=4 8692 B13R1.12 CCC[C@@H](N)c1cccc(C)c1F Amb28141974 [0,2,0,0,0,0|1,1,0]=4 8693 B13R1.12 CCC[C@@H](N)c1cccc(C)c1N Amb27754772 [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.12 CCC[C@@H](N)c1cccc(C)c1O Amb28243480 [0,2,0,0,0,0|2,0,0]=4 8695 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1N Amb27240914 [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1O Amb27590356 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.12 CCC[C@@H](N)c1cccc(F)c1C Amb27404120 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.12 CCC[C@@H](N)c1cccc(F)c1Cl Amb28291157 [0,2,0,0,0,0|1,1,0]=4 8699 B13R1.12 CCC[C@@H](N)c1cccc(F)c1N Amb27598053 [0,2,0,0,0,0|2,0,0]=4 8700 B13R1.12 CCC[C@@H](N)c1cccc(I)c1O Amb27462163 [0,2,0,0,0,0|2,0,0]=4 8701 B13R1.12 CCC[C@@H](N)c1cccc(N)c1F Amb27764131 [0,2,0,0,0,0|1,1,0]=4 8702 B13R1.12 CCC[C@@H](N)c1cccc(O)c1Br Amb28187281 [0,2,0,0,0,0|1,0,0]=3 8703 B13R1.12 CCC[C@@H](N)c1cccc(O)c1C Amb28399367 [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.12 CCC[C@@H](N)c1cccc(O)c1F Amb27641224 [0,2,0,0,0,0|1,1,0]=4 8705 B13R1.12 CCC[C@@H](O)c1cccc(Br)c1C Amb27393638 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.12 CCC[C@H](N)c1cccc(C)c1Br Amb28133933 [0,2,0,0,0,0|1,0,0]=3 8707 B13R1.12 CCC[C@H](N)c1cccc(C)c1C Amb28251775 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.12 CCC[C@H](N)c1cccc(C)c1Cl Amb28316496 [0,2,0,0,0,0|1,1,0]=4 8709 B13R1.12 CCC[C@H](N)c1cccc(C)c1I Amb27608266 [0,2,0,0,0,0|1,1,0]=4 8710 B13R1.12 CCC[C@H](N)c1cccc(F)c1Br Amb28240901 [0,2,0,0,0,0|1,0,0]=3 8711 B13R1.12 CCC[C@H](N)c1cccc(F)c1F Amb27961485 [0,2,0,0,0,0|1,1,0]=4 8712 B13R1.12 CCC[C@H](N)c1cccc(F)c1N Amb28291511 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.12 CCC[C@H](N)c1cccc(I)c1Br Amb27784165 [0,2,0,0,0,0|1,0,0]=3 8714 B13R1.12 CCC[C@H](N)c1cccc(I)c1C Amb27230120 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.12 CCC[C@H](N)c1cccc(O)c1Cl Amb27868259 [0,2,0,0,0,0|1,1,0]=4 8716 B13R1.12 CCC[C@H](N)c1ccnc(Br)c1Br Amb27238817 [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.12 CCC[C@H](O)c1cccc(C)c1F Amb28341160 [0,2,0,0,0,0|1,1,0]=4 8718 B13R1.12 CCC[C@H](O)c1cccc(Cl)c1F Amb27222985 [0,2,0,0,0,0|1,1,0]=4 8719 B13R1.12 CCC[C@H](O)c1cccc(O)c1O Amb28324318 [0,2,0,0,0,0|2,0,0]=4 8720 B13R1.12 CCNC(C)c1cccc(C)c1Br Amb28317429 [0,2,0,0,0,0|2,0,0]=4 8721 B13R1.12 CNCC(=O)c1cccc(Br)c1C Amb27411578 [0,2,0,0,0,0|1,0,1]=4 8722 B13R1.12 CNCC(=O)c1cccc(Br)c1Cl Amb25038829 [0,2,0,0,0,0|0,1,1]=4 8723 B13R1.12 CNCC(=O)c1cccc(Br)c1F Amb25158632 [0,2,0,0,0,0|0,1,1]=4 8724 B13R1.12 CNCC(=O)c1cccc(Br)c1O Amb33332271 [0,2,0,0,0,0|1,0,1]=4 8725 B13R1.12 CNCC(=O)c1cccc(C)c1Br Amb24463728 [0,2,0,0,0,0|0,0,1]=3 8726 B13R1.12 CNCC(=O)c1cccc(C)c1C Amb18224566 [0,2,0,0,0,0|1,0,1]=4 8727 B13R1.12 CNCC(=O)c1cccc(C)c1Cl Amb27213736 [0,2,0,0,0,0|0,1,1]=4 8728 B13R1.12 CNCC(=O)c1cccc(C)c1F Amb24685079 [0,2,0,0,0,0|0,1,1]=4 8729 B13R1.12 CNCC(=O)c1cccc(C)c1O Amb25048342 [0,2,0,0,0,0|1,0,1]=4 8730 B13R1.12 CNCC(=O)c1cccc(Cl)c1Br Amb26502374 [0,2,0,0,0,0|0,0,1]=3 8731 B13R1.12 CNCC(=O)c1cccc(Cl)c1C Amb18224962 [0,2,0,0,0,0|1,0,1]=4 8732 B13R1.12 CNCC(=O)c1cccc(Cl)c1Cl Amb18866812 [0,2,0,0,0,0|0,1,1]=4 8733 B13R1.12 CNCC(=O)c1cccc(Cl)c1F Amb25997945 [0,2,0,0,0,0|0,1,1]=4 8734 B13R1.12 CNCC(=O)c1cccc(Cl)c1O Amb28410502 [0,2,0,0,0,0|1,0,1]=4 8735 B13R1.12 CNCC(=O)c1cccc(F)c1Br Amb27172367 [0,2,0,0,0,0|0,0,1]=3 8736 B13R1.12 CNCC(=O)c1cccc(F)c1C Amb25158393 [0,2,0,0,0,0|1,0,1]=4 8737 B13R1.12 CNCC(=O)c1cccc(F)c1Cl Amb26942698 [0,2,0,0,0,0|0,1,1]=4 8738 B13R1.12 CNCC(=O)c1cccc(F)c1F Amb25795369 [0,2,0,0,0,0|0,1,1]=4 8739 B13R1.12 CNCC(=O)c1cccc(F)c1O Amb25320557 [0,2,0,0,0,0|1,0,1]=4 8740 B13R1.12 CNCC(=O)c1cccc(O)c1Br Amb27610301 [0,2,0,0,0,0|0,0,1]=3 8741 B13R1.12 CNCC(=O)c1cccc(O)c1C Amb26081142 [0,2,0,0,0,0|1,0,1]=4 8742 B13R1.12 CNCC(=O)c1cccc(O)c1Cl Amb26481823 [0,2,0,0,0,0|0,1,1]=4 8743 B13R1.12 CNCC(=O)c1cccc(O)c1F Amb25755292 [0,2,0,0,0,0|0,1,1]=4 8744 B13R1.12 CNCC(=O)c1cccc(O)c1O Amb33269498 [0,2,0,0,0,0|1,0,1]=4 8745 B13R1.12 CNCC(C)c1cccc(Br)c1C Amb28205395 [0,2,0,0,0,0|1,0,0]=3 8746 B13R1.12 CNCC(C)c1cccc(Br)c1Cl Amb26991641 [0,2,0,0,0,0|0,1,0]=3 8747 B13R1.12 CNCC(C)c1cccc(Br)c1F Amb28316666 [0,2,0,0,0,0|0,1,0]=3 8748 B13R1.12 CNCC(C)c1cccc(Br)c1O Amb25266358 [0,2,0,0,0,0|1,0,0]=3 8749 B13R1.12 CNCC(C)c1cccc(C)c1Br Amb25923696 [0,2,0,0,0,0|0,0,0]=2 8750 B13R1.12 CNCC(C)c1cccc(C)c1C Amb25762222 [0,2,0,0,0,0|1,0,0]=3 8751 B13R1.12 CNCC(C)c1cccc(C)c1Cl Amb26035451 [0,2,0,0,0,0|0,1,0]=3 8752 B13R1.12 CNCC(C)c1cccc(C)c1F Amb27143472 [0,2,0,0,0,0|0,1,0]=3 8753 B13R1.12 CNCC(C)c1cccc(C)c1O Amb26058385 [0,2,0,0,0,0|1,0,0]=3 8754 B13R1.12 CNCC(C)c1cccc(Cl)c1Br Amb24408997 [0,2,0,0,0,0|0,0,0]=2 8755 B13R1.12 CNCC(C)c1cccc(Cl)c1C Amb25280153 [0,2,0,0,0,0|1,0,0]=3 8756 B13R1.12 CNCC(C)c1cccc(Cl)c1Cl Amb25217532 [0,2,0,0,0,0|0,1,0]=3 8757 B13R1.12 CNCC(C)c1cccc(Cl)c1F Amb26407384 [0,2,0,0,0,0|0,1,0]=3 8758 B13R1.12 CNCC(C)c1cccc(Cl)c1O Amb24384475 [0,2,0,0,0,0|1,0,0]=3 8759 B13R1.12 CNCC(C)c1cccc(F)c1Br Amb24535375 [0,2,0,0,0,0|0,0,0]=2 8760 B13R1.12 CNCC(C)c1cccc(F)c1C Amb26631610 [0,2,0,0,0,0|1,0,0]=3 8761 B13R1.12 CNCC(C)c1cccc(F)c1Cl Amb27478686 [0,2,0,0,0,0|0,1,0]=3 8762 B13R1.12 CNCC(C)c1cccc(F)c1F Amb25823421 [0,2,0,0,0,0|0,1,0]=3 8763 B13R1.12 CNCC(C)c1cccc(F)c1O Amb25878777 [0,2,0,0,0,0|1,0,0]=3 8764 B13R1.12 CNCC(C)c1cccc(O)c1Br Amb28125815 [0,2,0,0,0,0|0,0,0]=2 8765 B13R1.12 CNCC(C)c1cccc(O)c1C Amb24533736 [0,2,0,0,0,0|1,0,0]=3 8766 B13R1.12 CNCC(C)c1cccc(O)c1Cl Amb26632840 [0,2,0,0,0,0|0,1,0]=3 8767 B13R1.12 CNCC(C)c1cccc(O)c1F Amb24686183 [0,2,0,0,0,0|0,1,0]=3 8768 B13R1.12 CNCC(O)c1cccc(Br)c1C Amb25158740 [0,2,0,0,0,0|1,0,0]=3 8769 B13R1.12 CNCC(O)c1cccc(Br)c1Cl Amb25116690 [0,2,0,0,0,0|0,1,0]=3 8770 B13R1.12 CNCC(O)c1cccc(Br)c1F Amb27143452 [0,2,0,0,0,0|0,1,0]=3 8771 B13R1.12 CNCC(O)c1cccc(Br)c1O Amb33332269 [0,2,0,0,0,0|1,0,0]=3 8772 B13R1.12 CNCC(O)c1cccc(C)c1Br Amb24724264 [0,2,0,0,0,0|0,0,0]=2 8773 B13R1.12 CNCC(O)c1cccc(C)c1C Amb18997480 [0,2,0,0,0,0|1,0,0]=3 8774 B13R1.12 CNCC(O)c1cccc(C)c1Cl Amb26991631 [0,2,0,0,0,0|0,1,0]=3 8775 B13R1.12 CNCC(O)c1cccc(C)c1F Amb25958027 [0,2,0,0,0,0|0,1,0]=3 8776 B13R1.12 CNCC(O)c1cccc(C)c1O Amb26970070 [0,2,0,0,0,0|1,0,0]=3 8777 B13R1.12 CNCC(O)c1cccc(Cl)c1Br Amb25832404 [0,2,0,0,0,0|0,0,0]=2 8778 B13R1.12 CNCC(O)c1cccc(Cl)c1C Amb27629063 [0,2,0,0,0,0|1,0,0]=3 8779 B13R1.12 CNCC(O)c1cccc(Cl)c1Cl Amb18997458 [0,2,0,0,0,0|0,1,0]=3 8780 B13R1.12 CNCC(O)c1cccc(Cl)c1F Amb26639842 [0,2,0,0,0,0|0,1,0]=3 8781 B13R1.12 CNCC(O)c1cccc(Cl)c1O Amb33056868 [0,2,0,0,0,0|1,0,0]=3 8782 B13R1.12 CNCC(O)c1cccc(F)c1Br Amb25851315 [0,2,0,0,0,0|0,0,0]=2 8783 B13R1.12 CNCC(O)c1cccc(F)c1C Amb25142390 [0,2,0,0,0,0|1,0,0]=3 8784 B13R1.12 CNCC(O)c1cccc(F)c1Cl Amb26018030 [0,2,0,0,0,0|0,1,0]=3 8785 B13R1.12 CNCC(O)c1cccc(F)c1F Amb26508304 [0,2,0,0,0,0|0,1,0]=3 8786 B13R1.12 CNCC(O)c1cccc(F)c1O Amb33311164 [0,2,0,0,0,0|1,0,0]=3 8787 B13R1.12 CNCC(O)c1cccc(O)c1Br Amb28188851 [0,2,0,0,0,0|0,0,0]=2 8788 B13R1.12 CNCC(O)c1cccc(O)c1C Amb25848428 [0,2,0,0,0,0|1,0,0]=3 8789 B13R1.12 CNCC(O)c1cccc(O)c1Cl Amb25832391 [0,2,0,0,0,0|0,1,0]=3 8790 B13R1.12 CNCC(O)c1cccc(O)c1F Amb18129513 [0,2,0,0,0,0|0,1,0]=3 8791 B13R1.12 CNCC(O)c1cccc(O)c1O Amb33269528 [0,2,0,0,0,0|1,0,0]=3 8792 B13R1.12 COCC(N)c1cccc(Br)c1Cl Amb27879728 [0,2,0,0,0,0|1,1,0]=4 8793 B13R1.12 COCC(N)c1cccc(Br)c1F Amb27771821 [0,2,0,0,0,0|1,1,0]=4 8794 B13R1.12 COCC(N)c1cccc(C)c1I Amb27450725 [0,2,0,0,0,0|1,1,0]=4 8795 B13R1.12 COCC(N)c1cccc(C)c1O Amb27398219 [0,2,0,0,0,0|2,0,0]=4 8796 B13R1.12 COCC(N)c1cccc(Cl)c1Br Amb27171241 [0,2,0,0,0,0|1,0,0]=3 8797 B13R1.12 COCC(N)c1cccc(F)c1Br Amb28368185 [0,2,0,0,0,0|1,0,0]=3 8798 B13R1.12 COCC(N)c1cccc(I)c1C Amb27794528 [0,2,0,0,0,0|2,0,0]=4 8799 B13R1.12 COCC(N)c1cccc(N)c1C Amb27392957 [0,2,0,0,0,0|2,0,0]=4 8800 B13R1.12 COCC(N)c1cccc(N)c1O Amb27162250 [0,2,0,0,0,0|2,0,0]=4 8801 B13R1.12 COCC(N)c1cccc(O)c1C Amb27592459 [0,2,0,0,0,0|2,0,0]=4 8802 B13R1.12 COCC(N)c1ccnc(Br)c1Br Amb28135326 [0,2,0,0,0,0|2,0,0]=4 8803 B13R1.12 COCC(O)c1cccc(C)c1Br Amb27873860 [0,2,0,0,0,0|1,0,0]=3 8804 B13R1.12 COCC(O)c1cccc(C)c1Cl Amb27235477 [0,2,0,0,0,0|1,1,0]=4 8805 B13R1.12 COCC(O)c1cccc(C)c1I Amb27805760 [0,2,0,0,0,0|1,1,0]=4 8806 B13R1.12 COCC(O)c1cccc(F)c1C Amb27217129 [0,2,0,0,0,0|2,0,0]=4 8807 B13R1.12 COCC(O)c1cccc(F)c1Cl Amb27663146 [0,2,0,0,0,0|1,1,0]=4 8808 B13R1.12 COCC(O)c1cccc(F)c1N Amb35582034 [0,2,0,0,0,0|2,0,0]=4 8809 B13R1.12 COCC(O)c1cccc(N)c1C Amb35622594 [0,2,0,0,0,0|2,0,0]=4 8810 B13R1.12 COCC(O)c1cccc(N)c1F Amb35741097 [0,2,0,0,0,0|1,1,0]=4 8811 B13R1.12 COC[C@@H](N)c1cccc(Br)c1Br Amb27171485 [0,2,0,0,0,0|1,0,0]=3 8812 B13R1.12 COC[C@@H](N)c1cccc(Br)c1C Amb27814581 [0,2,0,0,0,0|2,0,0]=4 8813 B13R1.12 COC[C@@H](N)c1cccc(Br)c1O Amb27812031 [0,2,0,0,0,0|2,0,0]=4 8814 B13R1.12 COC[C@@H](N)c1cccc(C)c1O Amb28197646 [0,2,0,0,0,0|2,0,0]=4 8815 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1F Amb27180892 [0,2,0,0,0,0|1,1,0]=4 8816 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1N Amb28187252 [0,2,0,0,0,0|2,0,0]=4 8817 B13R1.12 COC[C@@H](N)c1cccc(F)c1Br Amb28129777 [0,2,0,0,0,0|1,0,0]=3 8818 B13R1.12 COC[C@@H](N)c1cccc(F)c1C Amb27655554 [0,2,0,0,0,0|2,0,0]=4 8819 B13R1.12 COC[C@@H](N)c1cccc(F)c1O Amb27593839 [0,2,0,0,0,0|2,0,0]=4 8820 B13R1.12 COC[C@@H](N)c1cccc(N)c1C Amb27817758 [0,2,0,0,0,0|2,0,0]=4 8821 B13R1.12 COC[C@@H](N)c1cccc(O)c1Br Amb27171240 [0,2,0,0,0,0|1,0,0]=3 8822 B13R1.12 COC[C@@H](N)c1cccc(S)c1O Amb27494865 [0,2,0,0,0,0|2,0,0]=4 8823 B13R1.12 COC[C@H](N)c1cccc(Br)c1C Amb27267239 [0,2,0,0,0,0|2,0,0]=4 8824 B13R1.12 COC[C@H](N)c1cccc(C)c1N Amb27234635 [0,2,0,0,0,0|2,0,0]=4 8825 B13R1.12 COC[C@H](N)c1cccc(Cl)c1F Amb27608537 [0,2,0,0,0,0|1,1,0]=4 8826 B13R1.12 COC[C@H](N)c1cccc(F)c1C Amb28316566 [0,2,0,0,0,0|2,0,0]=4 8827 B13R1.12 COC[C@H](N)c1cccc(F)c1N Amb27596131 [0,2,0,0,0,0|2,0,0]=4 8828 B13R1.12 COC[C@H](N)c1cccc(F)c1O Amb27252070 [0,2,0,0,0,0|2,0,0]=4 8829 B13R1.12 COC[C@H](N)c1cccc(O)c1Br Amb28341101 [0,2,0,0,0,0|1,0,0]=3 8830 B13R1.12 CSCC(N)c1cccc(C)c1C Amb18300369 [0,2,0,0,0,0|2,0,0]=4 8831 B13R1.12 CSCC(N)c1cccc(F)c1F Amb27589284 [0,2,0,0,0,0|1,1,0]=4 8832 B13R1.12 CSCC(O)c1cccc(C)c1C Amb18325106 [0,2,0,0,0,0|2,0,0]=4 8833 B13R1.12 Cc1cccc(C(N)CC#N)c1Br Amb27226022 [0,2,0,0,0,0|2,0,0]=4 8834 B13R1.12 Cc1cccc(C(N)CCO)c1Br Amb27828077 [0,2,0,0,0,0|2,0,0]=4 8835 B13R1.12 Cc1cccc(C(O)CCN)c1Br Amb27655148 [0,2,0,0,0,0|2,0,0]=4 8836 B13R1.12 N#CCC(O)c1cccc(F)c1Br Amb26890852 [0,2,0,0,0,0|2,0,0]=4 8837 B13R1.12 N#CCC(O)c1cccc(O)c1Br Amb33386828 [0,2,0,0,0,0|2,0,0]=4 8838 B13R1.12 N#CC[C@@H](N)c1cccc(O)c1Br Amb27427114 [0,2,0,0,0,0|2,0,0]=4 8839 B13R1.12 N#CC[C@H](N)c1cccc(O)c1Br Amb28313655 [0,2,0,0,0,0|2,0,0]=4 8840 B13R1.12 NC(CCO)c1cccc(F)c1Br Amb25269350 [0,2,0,0,0,0|2,0,0]=4 8841 B13R1.12 NC(CCO)c1cccc(I)c1Br Amb27222617 [0,2,0,0,0,0|2,0,0]=4 8842 B13R1.12 NC(CCO)c1cccc(O)c1Br Amb24518615 [0,2,0,0,0,0|2,0,0]=4 8843 B13R1.12 NCCC(F)c1cccc(F)c1Br Amb33450513 [0,2,0,0,0,0|2,0,0]=4 8844 B13R1.12 NCCC(F)c1cccc(O)c1Br Amb33386787 [0,2,0,0,0,0|2,0,0]=4 8845 B13R1.12 NCCC(O)c1cccc(Cl)c1Br Amb32694011 [0,2,0,0,0,0|2,0,0]=4 8846 B13R1.12 NCCC(O)c1cccc(F)c1Br Amb26542658 [0,2,0,0,0,0|2,0,0]=4 8847 B13R1.12 NCCC(O)c1cccc(O)c1Br Amb33386510 [0,2,0,0,0,0|2,0,0]=4 8848 B13R1.12 NCC[C@@H](N)c1cccc(F)c1Br Amb27850011 [0,2,0,0,0,0|2,0,0]=4 8849 B13R1.12 NCC[C@@H](O)c1cccc(F)c1Br Amb33450509 [0,2,0,0,0,0|2,0,0]=4 8850 B13R1.12 NCC[C@@H](O)c1cccc(O)c1Br Amb33386778 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.12 NCC[C@H](N)c1cccc(F)c1Br Amb27210556 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.12 NCC[C@H](O)c1cccc(F)c1Br Amb33450511 [0,2,0,0,0,0|2,0,0]=4 8853 B13R1.12 NCC[C@H](O)c1cccc(O)c1Br Amb33386784 [0,2,0,0,0,0|2,0,0]=4 8854 B13R1.12 N[C@@H](CCO)c1cccc(F)c1Br Amb27814332 [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.12 N[C@H](CCO)c1cccc(O)c1Br Amb27439396 [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.16 C#CCCNc1cccc(Cl)c1Br Amb27403421 [0,2,0,0,0,0|1,0,1]=4 8857 B13R1.16 C=CCCNc1cccc(Cl)c1Br Amb28322930 [0,2,0,0,0,0|1,0,1]=4 8858 B13R1.16 CC#CCNc1cccc(Cl)c1Br Amb28367828 [0,2,0,0,0,0|1,0,1]=4 8859 B13R1.16 CCCCNc1cccc(Br)c1Cl Amb29865133 [0,2,0,0,0,0|1,1,0]=4 8860 B13R1.16 CCCCNc1cccc(Br)c1F Amb35649541 [0,2,0,0,0,0|1,1,0]=4 8861 B13R1.16 CCCCNc1cccc(C)c1C Amb6700737 [0,2,0,0,0,0|2,0,0]=4 8862 B13R1.16 CCCCNc1cccc(C)c1F Amb28073698 [0,2,0,0,0,0|1,1,0]=4 8863 B13R1.16 CCCCNc1cccc(C)c1N Amb27248831 [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.16 CCCCNc1cccc(Cl)c1C Amb4313704 [0,2,0,0,0,0|2,0,0]=4 8865 B13R1.16 CCCCNc1cccc(Cl)c1Cl Amb6615349 [0,2,0,0,0,0|1,1,0]=4 8866 B13R1.16 CCCCNc1cccc(Cl)c1F Amb7760390 [0,2,0,0,0,0|1,1,0]=4 8867 B13R1.16 CCCCNc1cccc(F)c1C Amb18185177 [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.16 CCCCNc1cccc(F)c1F Amb18323162 [0,2,0,0,0,0|1,1,0]=4 8869 B13R1.16 CCCCNc1cccc(I)c1C Amb27955034 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.16 CCCCNc1nccc(C)c1Br Amb27412739 [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.16 CCCCOc1cccc(Br)c1N Amb33035524 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.16 CCCCOc1cccc(C)c1I Amb33512238 [0,2,0,0,0,0|1,1,0]=4 8873 B13R1.16 CCCCOc1cccc(C)c1N Amb9296570 [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.16 CCCCOc1cccc(Cl)c1Br Amb21856680 [0,2,0,0,0,0|1,0,0]=3 8875 B13R1.16 CCCCOc1cccc(Cl)c1N Amb33035523 [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.16 CCCCOc1cccc(F)c1F Amb8394621 [0,2,0,0,0,0|1,1,0]=4 8877 B13R1.16 CCCCOc1cccc(F)c1N Amb18303391 [0,2,0,0,0,0|2,0,0]=4 8878 B13R1.16 CCCCOc1cccc(S)c1N Amb18273956 [0,2,0,0,0,0|2,0,0]=4 8879 B13R1.16 CCCNCc1cccc(Br)c1O Amb18307167 [0,2,0,0,0,0|2,0,0]=4 8880 B13R1.16 CCCNCc1cccc(C)c1C Amb8841248 [0,2,0,0,0,0|2,0,0]=4 8881 B13R1.16 CCCNCc1cccc(Cl)c1Cl Amb19890375 [0,2,0,0,0,0|1,1,0]=4 8882 B13R1.16 CCCNCc1cccc(Cl)c1Cl Amb6665891 [0,2,0,0,0,0|1,1,0]=4 8883 B13R1.16 CCCNCc1cccc(Cl)c1F Amb33363411 [0,2,0,0,0,0|1,1,0]=4 8884 B13R1.16 CCCNCc1cccc(F)c1F Amb9232965 [0,2,0,0,0,0|1,1,0]=4 8885 B13R1.16 CNCC#Cc1cccc(C)c1C Amb27420753 [0,2,0,0,0,0|1,0,1]=4 8886 B13R1.16 CNCC#Cc1cccc(F)c1F Amb27239555 [0,2,0,0,0,0|0,1,1]=4 8887 B13R1.16 CNCCCc1cccc(C)c1C Amb18065731 [0,2,0,0,0,0|1,0,0]=3 8888 B13R1.16 CNCCCc1cccc(Cl)c1C Amb18565994 [0,2,0,0,0,0|1,0,0]=3 8889 B13R1.16 CNCCCc1cccc(Cl)c1Cl Amb18067284 [0,2,0,0,0,0|0,1,0]=3 8890 B13R1.16 CNCCCc1cccc(F)c1C Amb23442806 [0,2,0,0,0,0|1,0,0]=3 8891 B13R1.16 CNCCOc1cccc(C)c1C Amb2139091 [0,2,0,0,0,0|1,0,0]=3 8892 B13R1.16 CNCCOc1cccc(C)c1C Amb857134 [0,2,0,0,0,0|1,0,0]=3 8893 B13R1.16 CNCCOc1cccc(Cl)c1Cl Amb7798790 [0,2,0,0,0,0|0,1,0]=3 8894 B13R1.16 CNC\C=C\c1cccc(C)c1F Amb27428409 [0,2,0,0,0,0|0,1,1]=4 8895 B13R1.16 COCCNc1cccc(Br)c1Cl Amb29865146 [0,2,0,0,0,0|1,1,0]=4 8896 B13R1.16 COCCNc1cccc(Br)c1F Amb35649543 [0,2,0,0,0,0|1,1,0]=4 8897 B13R1.16 COCCNc1cccc(Br)c1N Amb27617883 [0,2,0,0,0,0|2,0,0]=4 8898 B13R1.16 COCCNc1cccc(C)c1Br Amb28315356 [0,2,0,0,0,0|1,0,0]=3 8899 B13R1.16 COCCNc1cccc(C)c1C Amb6714014 [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.16 COCCNc1cccc(C)c1F Amb28340720 [0,2,0,0,0,0|1,1,0]=4 8901 B13R1.16 COCCNc1cccc(Cl)c1C Amb6709015 [0,2,0,0,0,0|2,0,0]=4 8902 B13R1.16 COCCNc1cccc(Cl)c1Cl Amb6742657 [0,2,0,0,0,0|1,1,0]=4 8903 B13R1.16 COCCNc1cccc(F)c1Cl Amb29864404 [0,2,0,0,0,0|1,1,0]=4 8904 B13R1.16 COCCNc1cccc(F)c1N Amb18303385 [0,2,0,0,0,0|2,0,0]=4 8905 B13R1.16 COCCOc1cccc(Br)c1N Amb33035512 [0,2,0,0,0,0|2,0,0]=4 8906 B13R1.16 COCCOc1cccc(C)c1N Amb9296561 [0,2,0,0,0,0|2,0,0]=4 8907 B13R1.16 COCCOc1cccc(Cl)c1N Amb33035430 [0,2,0,0,0,0|2,0,0]=4 8908 B13R1.16 COCCOc1cccc(F)c1N Amb19003293 [0,2,0,0,0,0|2,0,0]=4 8909 B13R1.16 CSCCNc1cccc(Br)c1Cl Amb35721546 [0,2,0,0,0,0|1,1,0]=4 8910 B13R1.16 CSCCNc1cccc(Br)c1F Amb35615176 [0,2,0,0,0,0|1,1,0]=4 8911 B13R1.16 CSCCNc1cccc(C)c1Cl Amb27475778 [0,2,0,0,0,0|1,1,0]=4 8912 B13R1.16 CSCCNc1cccc(C)c1N Amb27873893 [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.16 CSCCNc1cccc(Cl)c1C Amb27397252 [0,2,0,0,0,0|2,0,0]=4 8914 B13R1.16 CSCCNc1cccc(Cl)c1F Amb27832957 [0,2,0,0,0,0|1,1,0]=4 8915 B13R1.16 CSCCNc1cccc(F)c1Cl Amb29864432 [0,2,0,0,0,0|1,1,0]=4 8916 B13R1.16 C\C=C\CNc1cccc(Cl)c1Br Amb27664341 [0,2,0,0,0,0|1,0,1]=4 8917 B13R1.16 Cc1c(Br)cccc1CCCCN Amb33477277 [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.16 Cc1c(Cl)cccc1CCCCN Amb18066467 [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.16 Cc1c(F)cccc1CCCCN Amb33428340 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.16 Cc1cccc(CCCCN)c1C Amb18065732 [0,2,0,0,0,0|2,0,0]=4 8921 B13R1.16 Cc1cccc(CCCCN)c1F Amb33224198 [0,2,0,0,0,0|1,1,0]=4 8922 B13R1.16 Cc1cccc(OCCNN)c1C Amb17400833 [0,2,0,0,0,0|2,0,0]=4 8923 B13R1.16 Cc1cccc(OCCNO)c1C Amb17088444 [0,2,0,0,0,0|2,0,0]=4 8924 B13R1.16 NCCCCc1cccc(Br)c1F Amb33388454 [0,2,0,0,0,0|1,1,0]=4 8925 B13R1.16 NCCCCc1cccc(Br)c1O Amb33332592 [0,2,0,0,0,0|2,0,0]=4 8926 B13R1.16 NCCCCc1cccc(Cl)c1Cl Amb18067286 [0,2,0,0,0,0|1,1,0]=4 8927 B13R1.16 NCCCCc1cccc(Cl)c1F Amb33262255 [0,2,0,0,0,0|1,1,0]=4 8928 B13R1.16 NCCCCc1cccc(Cl)c1O Amb33057235 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.16 NCCCCc1cccc(F)c1Br Amb33242609 [0,2,0,0,0,0|1,0,0]=3 8930 B13R1.16 NCCCCc1cccc(F)c1Cl Amb33262164 [0,2,0,0,0,0|1,1,0]=4 8931 B13R1.16 NCCCCc1cccc(F)c1F Amb33448995 [0,2,0,0,0,0|1,1,0]=4 8932 B13R1.16 NCCCCc1cccc(F)c1O Amb33310820 [0,2,0,0,0,0|2,0,0]=4 8933 B13R1.16 NCCCCc1cccc(O)c1Br Amb33386865 [0,2,0,0,0,0|1,0,0]=3 8934 B13R1.16 NCCCCc1cccc(O)c1O Amb33268075 [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.16 NCCCNc1cccc(Cl)c1Br Amb27229803 [0,2,0,0,0,0|2,0,0]=4 8936 B13R1.16 NCCCOc1cccc(F)c1Br Amb33478461 [0,2,0,0,0,0|2,0,0]=4 8937 B13R1.16 NCCCOc1cccc(O)c1Br Amb33386895 [0,2,0,0,0,0|2,0,0]=4 8938 B13R1.16 NNCCOc1cccc(Cl)c1Cl Amb17405674 [0,2,0,0,0,0|1,1,0]=4 8939 B13R1.16 O=C=NCCc1cccc(F)c1Br Amb33450224 [0,2,0,0,0,0|0,0,2]=4 8940 B13R1.16 O=CCCCc1cccc(F)c1Br Amb33242459 [0,2,0,0,0,0|1,0,1]=4 8941 B13R1.16 O=CCCCc1cccc(O)c1Br Amb33386884 [0,2,0,0,0,0|1,0,1]=4 8942 B13R1.16 O=CNCCc1cccc(O)c1O Amb27985928 [0,2,0,0,0,0|1,0,1]=4 8943 B13R1.16 OCCCCc1cccc(F)c1F Amb34912544 [0,2,0,0,0,0|1,1,0]=4 8944 B13R1.16 OCCCNc1cccc(Cl)c1Br Amb27765414 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.16 ONCCOc1cccc(Cl)c1Cl Amb17088473 [0,2,0,0,0,0|1,1,0]=4 8946 B13R1.16 [N-]=[N+]=NCCc1cccc(F)c1Br Amb33477939 [0,2,0,0,0,0|1,0,1]=4 8947 B13R1.16 [N-]=[N+]=NCCc1cccc(O)c1Br Amb33386902 [0,2,0,0,0,0|1,0,1]=4 8948 B13R1.40 CC(C=O)Cc1cccc(Br)c1Br Amb24494488 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.40 CC(C=O)Cc1cccc(Cl)c1Br Amb25256018 [0,2,0,0,0,0|2,0,0]=4 8950 B13R1.40 CC(C=O)Cc1cccc(F)c1Br Amb25140323 [0,2,0,0,0,0|2,0,0]=4 8951 B13R1.40 CC(Cc1cccc(F)c1F)NN Amb27856583 [0,2,0,0,0,0|1,1,0]=4 8952 B13R1.40 CCC(C)Nc1cccc(Cl)c1Br Amb27238401 [0,2,0,0,0,0|2,0,0]=4 8953 B13R1.40 CCC(N)Cc1cccc(Br)c1F Amb28194006 [0,2,0,0,0,0|1,1,0]=4 8954 B13R1.40 CCC(N)Cc1cccc(Cl)c1F Amb27585563 [0,2,0,0,0,0|1,1,0]=4 8955 B13R1.40 CCC(N)Cc1cccc(F)c1Br Amb27165937 [0,2,0,0,0,0|1,0,0]=3 8956 B13R1.40 CCC(N)Cc1cccc(F)c1F Amb18299692 [0,2,0,0,0,0|1,1,0]=4 8957 B13R1.40 CCC(N)Cc1cccc(O)c1Cl Amb28398202 [0,2,0,0,0,0|1,1,0]=4 8958 B13R1.40 CCC(O)Cc1cccc(C)c1C Amb25236534 [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.40 CCC(O)Cc1cccc(Cl)c1C Amb24387751 [0,2,0,0,0,0|2,0,0]=4 8960 B13R1.40 CCC(O)Cc1cccc(Cl)c1F Amb27807873 [0,2,0,0,0,0|1,1,0]=4 8961 B13R1.40 CCN(C)Cc1cccc(C)c1Br Amb32993297 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.40 CCN(C)Cc1cccc(Cl)c1Br Amb32696322 [0,2,0,0,0,0|2,0,0]=4 8963 B13R1.40 CCN(C)Cc1cccc(F)c1Br Amb26989175 [0,2,0,0,0,0|2,0,0]=4 8964 B13R1.40 CC[C@@H](N)Cc1cccc(Cl)c1F Amb27855823 [0,2,0,0,0,0|1,1,0]=4 8965 B13R1.40 CNC(=N)Nc1cccc(C)c1Br Amb27814075 [0,2,0,0,0,0|1,0,1]=4 8966 B13R1.40 CNC(=O)Cc1cccc(Cl)c1Cl Amb27756992 [0,2,0,0,0,0|0,1,1]=4 8967 B13R1.40 CNC(=O)Cc1cccc(Cl)c1F Amb28205056 [0,2,0,0,0,0|0,1,1]=4 8968 B13R1.40 CNC(C)CN1C=CC=C(C)C1=O Amb27970623 [0,2,0,0,0,0|2,0,0]=4 8969 B13R1.40 CNC(C)Cc1cccc(O)c1F Amb27842210 [0,2,0,0,0,0|0,1,0]=3 8970 B13R1.40 COC(=O)Cc1cccc(Cl)c1Br Amb10603555 [0,2,0,0,0,0|1,0,1]=4 8971 B13R1.40 NC(CO)Cc1cccc(F)c1Br Amb25067057 [0,2,0,0,0,0|2,0,0]=4 8972 B13R1.40 NC(CO)Cc1cccc(O)c1Br Amb33386756 [0,2,0,0,0,0|2,0,0]=4 8973 B13R1.40 NCC(O)Cc1cccc(F)c1Br Amb27753951 [0,2,0,0,0,0|2,0,0]=4 8974 B13R1.40 NCC(O)Cc1cccc(O)c1Br Amb33386848 [0,2,0,0,0,0|2,0,0]=4 8975 B13R1.123 CCCCc1cc(Cl)cc(Cl)c1O Amb27262973 [0,2,0,0,0,0|2,0,0]=4 8976 B13R1.123 CCCCc1cc(F)cc(Cl)c1N Amb27984447 [0,2,0,0,0,0|2,0,0]=4 8977 B13R1.123 CCCCc1cc(O)cc(C)c1O Amb27618137 [0,2,0,0,0,0|2,0,0]=4 8978 B13R1.123 CNCCN1C=C(Br)C=C(Br)C1=O Amb28453660 [0,2,0,0,0,0|2,0,0]=4 8979 B13R1.123 CNCCN1C=C(Br)C=C(C)C1=O Amb27435528 [0,2,0,0,0,0|2,0,0]=4 8980 B13R1.123 CNCCc1cc(Br)cc(F)c1O Amb33007899 [0,2,0,0,0,0|1,0,0]=3 8981 B13R1.123 CNCCc1cc(C)cc(F)c1C Amb27872494 [0,2,0,0,0,0|1,0,0]=3 8982 B13R1.123 CNCCc1cc(C)cc(F)c1O Amb27642856 [0,2,0,0,0,0|1,0,0]=3 8983 B13R1.123 CNCCc1cc(Cl)cc(Br)c1O Amb33331721 [0,2,0,0,0,0|1,0,0]=3 8984 B13R1.123 CNCCc1cc(F)cc(F)c1F Amb28283734 [0,2,0,0,0,0|0,1,0]=3 8985 B13R1.123 CNCCc1cc(F)cc(F)c1O Amb25174546 [0,2,0,0,0,0|1,0,0]=3 8986 B13R1.123 COCCc1cc(Br)cc(Br)c1N Amb25158938 [0,2,0,0,0,0|2,0,0]=4 8987 B13R1.123 NNCCc1cc(F)cc(F)c1F Amb24666157 [0,2,0,0,0,0|1,1,0]=4 8988 B13R1.150 C=C(C)CCc1cccc(C)c1F Amb28316389 [0,2,0,0,0,0|1,1,0]=4 8989 B13R1.150 CC(=O)CCc1cccc(Br)c1C Amb27223475 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.150 CC(=O)CCc1cccc(Br)c1Cl Amb24361777 [0,2,0,0,0,0|1,1,0]=4 8991 B13R1.150 CC(=O)CCc1cccc(Br)c1F Amb25992837 [0,2,0,0,0,0|1,1,0]=4 8992 B13R1.150 CC(=O)CCc1cccc(Br)c1O Amb28139660 [0,2,0,0,0,0|2,0,0]=4 8993 B13R1.150 CC(=O)CCc1cccc(C)c1Br Amb25990991 [0,2,0,0,0,0|1,0,0]=3 8994 B13R1.150 CC(=O)CCc1cccc(C)c1C Amb18564044 [0,2,0,0,0,0|2,0,0]=4 8995 B13R1.150 CC(=O)CCc1cccc(C)c1Cl Amb28369888 [0,2,0,0,0,0|1,1,0]=4 8996 B13R1.150 CC(=O)CCc1cccc(C)c1F Amb24732973 [0,2,0,0,0,0|1,1,0]=4 8997 B13R1.150 CC(=O)CCc1cccc(C)c1O Amb26377382 [0,2,0,0,0,0|2,0,0]=4 8998 B13R1.150 CC(=O)CCc1cccc(Cl)c1Br Amb25128172 [0,2,0,0,0,0|1,0,0]=3 8999 B13R1.150 CC(=O)CCc1cccc(Cl)c1C Amb18066406 [0,2,0,0,0,0|2,0,0]=4 9000 B13R1.150 CC(=O)CCc1cccc(Cl)c1Cl Amb18067064 [0,2,0,0,0,0|1,1,0]=4 9001 B13R1.150 CC(=O)CCc1cccc(Cl)c1F Amb24676928 [0,2,0,0,0,0|1,1,0]=4 9002 B13R1.150 CC(=O)CCc1cccc(Cl)c1O Amb26081110 [0,2,0,0,0,0|2,0,0]=4 9003 B13R1.150 CC(=O)CCc1cccc(F)c1Br Amb27608871 [0,2,0,0,0,0|1,0,0]=3 9004 B13R1.150 CC(=O)CCc1cccc(F)c1C Amb25158326 [0,2,0,0,0,0|2,0,0]=4 9005 B13R1.150 CC(=O)CCc1cccc(F)c1Cl Amb26966774 [0,2,0,0,0,0|1,1,0]=4 9006 B13R1.150 CC(=O)CCc1cccc(F)c1F Amb9524078 [0,2,0,0,0,0|1,1,0]=4 9007 B13R1.150 CC(=O)CCc1cccc(F)c1O Amb25755267 [0,2,0,0,0,0|2,0,0]=4 9008 B13R1.150 CC(=O)CCc1cccc(O)c1Br Amb24644230 [0,2,0,0,0,0|1,0,0]=3 9009 B13R1.150 CC(=O)CCc1cccc(O)c1C Amb27481004 [0,2,0,0,0,0|2,0,0]=4 9010 B13R1.150 CC(=O)CCc1cccc(O)c1Cl Amb25894324 [0,2,0,0,0,0|1,1,0]=4 9011 B13R1.150 CC(=O)CCc1cccc(O)c1F Amb25697519 [0,2,0,0,0,0|1,1,0]=4 9012 B13R1.150 CC(=O)CCc1cccc(O)c1O Amb33268074 [0,2,0,0,0,0|2,0,0]=4 9013 B13R1.150 CC(=O)SCc1cccc(Br)c1Br Amb33249798 [0,2,0,0,0,0|2,0,0]=4 9014 B13R1.150 CC(Br)CCc1cccc(Cl)c1Cl Amb27862522 [0,2,0,0,0,0|1,1,0]=4 9015 B13R1.150 CC(Br)CCc1cccc(Cl)c1F Amb27950413 [0,2,0,0,0,0|1,1,0]=4 9016 B13R1.150 CC(Br)CCc1cccc(F)c1Cl Amb27250350 [0,2,0,0,0,0|1,1,0]=4 9017 B13R1.150 CC(Br)CCc1cccc(F)c1F Amb27187284 [0,2,0,0,0,0|1,1,0]=4 9018 B13R1.150 CC(C)COc1cccc(N)c1Br Amb27414670 [0,2,0,0,0,0|2,0,0]=4 9019 B13R1.150 CC(C)NCc1cccc(F)c1Br Amb27592758 [0,2,0,0,0,0|2,0,0]=4 9020 B13R1.150 CC(Cl)CCc1cccc(Cl)c1F Amb28350476 [0,2,0,0,0,0|1,1,0]=4 9021 B13R1.150 CC(N)CCc1cccc(Br)c1F Amb25797696 [0,2,0,0,0,0|1,1,0]=4 9022 B13R1.150 CC(N)CCc1cccc(Br)c1O Amb25941731 [0,2,0,0,0,0|2,0,0]=4 9023 B13R1.150 CC(N)CCc1cccc(Cl)c1Cl Amb28281340 [0,2,0,0,0,0|1,1,0]=4 9024 B13R1.150 CC(N)CCc1cccc(Cl)c1F Amb26610367 [0,2,0,0,0,0|1,1,0]=4 9025 B13R1.150 CC(N)CCc1cccc(Cl)c1O Amb28290385 [0,2,0,0,0,0|2,0,0]=4 9026 B13R1.150 CC(N)CCc1cccc(F)c1Br Amb26316673 [0,2,0,0,0,0|1,0,0]=3 9027 B13R1.150 CC(N)CCc1cccc(F)c1Cl Amb25140883 [0,2,0,0,0,0|1,1,0]=4 9028 B13R1.150 CC(N)CCc1cccc(F)c1F Amb9524084 [0,2,0,0,0,0|1,1,0]=4 9029 B13R1.150 CC(N)CCc1cccc(F)c1O Amb28290420 [0,2,0,0,0,0|2,0,0]=4 9030 B13R1.150 CC(N)CCc1cccc(I)c1O Amb28076919 [0,2,0,0,0,0|2,0,0]=4 9031 B13R1.150 CC(N)CCc1cccc(N)c1O Amb27273178 [0,2,0,0,0,0|2,0,0]=4 9032 B13R1.150 CC(N)CCc1cccc(O)c1Br Amb25685845 [0,2,0,0,0,0|1,0,0]=3 9033 B13R1.150 CC(N)CCc1cccc(O)c1O Amb27408579 [0,2,0,0,0,0|2,0,0]=4 9034 B13R1.150 CC(O)CCc1cccc(Br)c1F Amb25877527 [0,2,0,0,0,0|1,1,0]=4 9035 B13R1.150 CC(O)CCc1cccc(Br)c1O Amb33332554 [0,2,0,0,0,0|2,0,0]=4 9036 B13R1.150 CC(O)CCc1cccc(Cl)c1Cl Amb24643724 [0,2,0,0,0,0|1,1,0]=4 9037 B13R1.150 CC(O)CCc1cccc(Cl)c1F Amb27485333 [0,2,0,0,0,0|1,1,0]=4 9038 B13R1.150 CC(O)CCc1cccc(Cl)c1O Amb33056893 [0,2,0,0,0,0|2,0,0]=4 9039 B13R1.150 CC(O)CCc1cccc(F)c1Br Amb27165939 [0,2,0,0,0,0|1,0,0]=3 9040 B13R1.150 CC(O)CCc1cccc(F)c1Cl Amb26511894 [0,2,0,0,0,0|1,1,0]=4 9041 B13R1.150 CC(O)CCc1cccc(F)c1F Amb19075704 [0,2,0,0,0,0|1,1,0]=4 9042 B13R1.150 CC(O)CCc1cccc(F)c1O Amb33310923 [0,2,0,0,0,0|2,0,0]=4 9043 B13R1.150 CC(O)CCc1cccc(O)c1Br Amb33386790 [0,2,0,0,0,0|1,0,0]=3 9044 B13R1.150 CC(O)CCc1cccc(O)c1O Amb33268811 [0,2,0,0,0,0|2,0,0]=4 9045 B13R1.150 CN(C)CCN1C=CC=C(Br)C1=O Amb28280391 [0,2,0,0,0,0|2,0,0]=4 9046 B13R1.150 CN(C)CCN1C=CC=C(N)C1=O Amb18986295 [0,2,0,0,0,0|2,0,0]=4 9047 B13R1.150 CN(C)CCc1cccc(Cl)c1F Amb27748634 [0,2,0,0,0,0|0,1,0]=3 9048 B13R1.150 CN(C)NCc1cccc(Cl)c1F Amb27817024 [0,2,0,0,0,0|1,1,0]=4 9049 B13R1.150 CN(C)NCc1cccc(O)c1Br Amb27758857 [0,2,0,0,0,0|1,0,0]=3 9050 B13R1.150 CN(C)NCc1cccc(O)c1Cl Amb27802984 [0,2,0,0,0,0|1,1,0]=4 9051 B13R1.150 C[C@@H](N)CCc1cccc(Br)c1F Amb33241851 [0,2,0,0,0,0|1,1,0]=4 9052 B13R1.150 C[C@@H](N)CCc1cccc(Br)c1O Amb24700234 [0,2,0,0,0,0|2,0,0]=4 9053 B13R1.150 C[C@@H](N)CCc1cccc(Cl)c1Cl Amb33261640 [0,2,0,0,0,0|1,1,0]=4 9054 B13R1.150 C[C@@H](N)CCc1cccc(Cl)c1F Amb33262432 [0,2,0,0,0,0|1,1,0]=4 9055 B13R1.150 C[C@@H](N)CCc1cccc(Cl)c1O Amb25313326 [0,2,0,0,0,0|2,0,0]=4 9056 B13R1.150 C[C@@H](N)CCc1cccc(F)c1Br Amb33241853 [0,2,0,0,0,0|1,0,0]=3 9057 B13R1.150 C[C@@H](N)CCc1cccc(F)c1Cl Amb33051995 [0,2,0,0,0,0|1,1,0]=4 9058 B13R1.150 C[C@@H](N)CCc1cccc(F)c1F Amb32953624 [0,2,0,0,0,0|1,1,0]=4 9059 B13R1.150 C[C@@H](N)CCc1cccc(F)c1O Amb26329472 [0,2,0,0,0,0|2,0,0]=4 9060 B13R1.150 C[C@@H](N)CCc1cccc(I)c1O Amb27258931 [0,2,0,0,0,0|2,0,0]=4 9061 B13R1.150 C[C@@H](N)CCc1cccc(O)c1Br Amb25669183 [0,2,0,0,0,0|1,0,0]=3 9062 B13R1.150 C[C@@H](N)CCc1cccc(O)c1F Amb27948084 [0,2,0,0,0,0|1,1,0]=4 9063 B13R1.150 C[C@@H](N)CCc1cccc(O)c1O Amb26035003 [0,2,0,0,0,0|2,0,0]=4 9064 B13R1.150 C[C@@H](O)CCc1cccc(Br)c1F Amb33386970 [0,2,0,0,0,0|1,1,0]=4 9065 B13R1.150 C[C@@H](O)CCc1cccc(Br)c1O Amb33332558 [0,2,0,0,0,0|2,0,0]=4 9066 B13R1.150 C[C@@H](O)CCc1cccc(Cl)c1Cl Amb33057767 [0,2,0,0,0,0|1,1,0]=4 9067 B13R1.150 C[C@@H](O)CCc1cccc(Cl)c1F Amb33222969 [0,2,0,0,0,0|1,1,0]=4 9068 B13R1.150 C[C@@H](O)CCc1cccc(Cl)c1O Amb33056902 [0,2,0,0,0,0|2,0,0]=4 9069 B13R1.150 C[C@@H](O)CCc1cccc(F)c1Br Amb33450549 [0,2,0,0,0,0|1,0,0]=3 9070 B13R1.150 C[C@@H](O)CCc1cccc(F)c1F Amb33425587 [0,2,0,0,0,0|1,1,0]=4 9071 B13R1.150 C[C@@H](O)CCc1cccc(F)c1O Amb33310920 [0,2,0,0,0,0|2,0,0]=4 9072 B13R1.150 C[C@@H](O)CCc1cccc(O)c1Br Amb33386797 [0,2,0,0,0,0|1,0,0]=3 9073 B13R1.150 C[C@@H](O)CCc1cccc(O)c1O Amb33268809 [0,2,0,0,0,0|2,0,0]=4 9074 B13R1.150 C[C@H](N)CCc1cccc(Br)c1F Amb26497571 [0,2,0,0,0,0|1,1,0]=4 9075 B13R1.150 C[C@H](N)CCc1cccc(Br)c1O Amb27961449 [0,2,0,0,0,0|2,0,0]=4 9076 B13R1.150 C[C@H](N)CCc1cccc(Cl)c1Cl Amb26503913 [0,2,0,0,0,0|1,1,0]=4 9077 B13R1.150 C[C@H](N)CCc1cccc(Cl)c1F Amb27410644 [0,2,0,0,0,0|1,1,0]=4 9078 B13R1.150 C[C@H](N)CCc1cccc(Cl)c1O Amb26567169 [0,2,0,0,0,0|2,0,0]=4 9079 B13R1.150 C[C@H](N)CCc1cccc(F)c1Br Amb26463407 [0,2,0,0,0,0|1,0,0]=3 9080 B13R1.150 C[C@H](N)CCc1cccc(F)c1Cl Amb27162389 [0,2,0,0,0,0|1,1,0]=4 9081 B13R1.150 C[C@H](N)CCc1cccc(F)c1F Amb25126676 [0,2,0,0,0,0|1,1,0]=4 9082 B13R1.150 C[C@H](N)CCc1cccc(F)c1O Amb24641583 [0,2,0,0,0,0|2,0,0]=4 9083 B13R1.150 C[C@H](N)CCc1cccc(O)c1Br Amb27153781 [0,2,0,0,0,0|1,0,0]=3 9084 B13R1.150 C[C@H](N)CCc1cccc(O)c1F Amb27488242 [0,2,0,0,0,0|1,1,0]=4 9085 B13R1.150 C[C@H](N)CCc1cccc(O)c1O Amb25978834 [0,2,0,0,0,0|2,0,0]=4 9086 B13R1.150 C[C@H](O)CCc1cccc(Br)c1F Amb33387326 [0,2,0,0,0,0|1,1,0]=4 9087 B13R1.150 C[C@H](O)CCc1cccc(Br)c1O Amb33332556 [0,2,0,0,0,0|2,0,0]=4 9088 B13R1.150 C[C@H](O)CCc1cccc(Cl)c1Cl Amb33057761 [0,2,0,0,0,0|1,1,0]=4 9089 B13R1.150 C[C@H](O)CCc1cccc(Cl)c1F Amb33224002 [0,2,0,0,0,0|1,1,0]=4 9090 B13R1.150 C[C@H](O)CCc1cccc(Cl)c1O Amb33056897 [0,2,0,0,0,0|2,0,0]=4 9091 B13R1.150 C[C@H](O)CCc1cccc(F)c1Br Amb33450959 [0,2,0,0,0,0|1,0,0]=3 9092 B13R1.150 C[C@H](O)CCc1cccc(F)c1F Amb33425885 [0,2,0,0,0,0|1,1,0]=4 9093 B13R1.150 C[C@H](O)CCc1cccc(F)c1O Amb33310922 [0,2,0,0,0,0|2,0,0]=4 9094 B13R1.150 C[C@H](O)CCc1cccc(O)c1Br Amb33386792 [0,2,0,0,0,0|1,0,0]=3 9095 B13R1.150 C[C@H](O)CCc1cccc(O)c1O Amb33268810 [0,2,0,0,0,0|2,0,0]=4 9096 B13R1.150 C[C@H](O)CNc1cccc(Cl)c1Br Amb28244677 [0,2,0,0,0,0|2,0,0]=4 9097 B13R1.150 Cc1c(Br)cccc1CCC(C)N Amb26982039 [0,2,0,0,0,0|2,0,0]=4 9098 B13R1.150 Cc1c(Br)cccc1CCC(C)O Amb33478438 [0,2,0,0,0,0|2,0,0]=4 9099 B13R1.150 Cc1c(Br)cccc1CC[C@@H](C)N Amb33242652 [0,2,0,0,0,0|2,0,0]=4 9100 B13R1.150 Cc1c(Br)cccc1CC[C@@H](C)O Amb33478425 [0,2,0,0,0,0|2,0,0]=4 9101 B13R1.150 Cc1c(Br)cccc1CC[C@H](C)N Amb25896300 [0,2,0,0,0,0|2,0,0]=4 9102 B13R1.150 Cc1c(Br)cccc1CC[C@H](C)O Amb33478439 [0,2,0,0,0,0|2,0,0]=4 9103 B13R1.150 Cc1c(Cl)cccc1CCC(C)N Amb27146747 [0,2,0,0,0,0|2,0,0]=4 9104 B13R1.150 Cc1c(F)cccc1CCC(C)N Amb24454684 [0,2,0,0,0,0|2,0,0]=4 9105 B13R1.150 Cc1c(F)cccc1CCC(C)O Amb33372373 [0,2,0,0,0,0|2,0,0]=4 9106 B13R1.150 Cc1c(F)cccc1CC[C@@H](C)N Amb33474384 [0,2,0,0,0,0|2,0,0]=4 9107 B13R1.150 Cc1c(F)cccc1CC[C@@H](C)O Amb33372370 [0,2,0,0,0,0|2,0,0]=4 9108 B13R1.150 Cc1c(F)cccc1CC[C@H](C)N Amb28430516 [0,2,0,0,0,0|2,0,0]=4 9109 B13R1.150 Cc1c(F)cccc1CC[C@H](C)O Amb33372372 [0,2,0,0,0,0|2,0,0]=4 9110 B13R1.150 Cc1c(I)cccc1CCC(C)N Amb28187447 [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.150 Cc1c(I)cccc1CC[C@H](C)N Amb27196467 [0,2,0,0,0,0|2,0,0]=4 9112 B13R1.150 Cc1cccc(CCC(=O)O)c1Br Amb22473857 [0,2,0,0,0,0|2,0,0]=4 9113 B13R1.150 Cc1cccc(CCC(C)N)c1C Amb25802373 [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.150 Cc1cccc(CCC(C)N)c1Cl Amb27237246 [0,2,0,0,0,0|1,1,0]=4 9115 B13R1.150 Cc1cccc(CCC(C)N)c1F Amb27464756 [0,2,0,0,0,0|1,1,0]=4 9116 B13R1.150 Cc1cccc(CCC(C)N)c1N Amb27659482 [0,2,0,0,0,0|2,0,0]=4 9117 B13R1.150 Cc1cccc(CCC(C)O)c1C Amb25067254 [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.150 Cc1cccc(CCC(C)O)c1F Amb24691399 [0,2,0,0,0,0|1,1,0]=4 9119 B13R1.150 Cc1cccc(CC[C@@H](C)N)c1C Amb33474317 [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.150 Cc1cccc(CC[C@@H](C)N)c1Cl Amb33262417 [0,2,0,0,0,0|1,1,0]=4 9121 B13R1.150 Cc1cccc(CC[C@@H](C)N)c1F Amb33474466 [0,2,0,0,0,0|1,1,0]=4 9122 B13R1.150 Cc1cccc(CC[C@@H](C)N)c1N Amb27948105 [0,2,0,0,0,0|2,0,0]=4 9123 B13R1.150 Cc1cccc(CC[C@@H](C)O)c1C Amb33197945 [0,2,0,0,0,0|2,0,0]=4 9124 B13R1.150 Cc1cccc(CC[C@@H](C)O)c1F Amb33325024 [0,2,0,0,0,0|1,1,0]=4 9125 B13R1.150 Cc1cccc(CC[C@H](C)N)c1C Amb24494786 [0,2,0,0,0,0|2,0,0]=4 9126 B13R1.150 Cc1cccc(CC[C@H](C)N)c1Cl Amb26861341 [0,2,0,0,0,0|1,1,0]=4 9127 B13R1.150 Cc1cccc(CC[C@H](C)N)c1F Amb26996581 [0,2,0,0,0,0|1,1,0]=4 9128 B13R1.150 Cc1cccc(CC[C@H](C)O)c1C Amb33197946 [0,2,0,0,0,0|2,0,0]=4 9129 B13R1.150 Cc1cccc(CC[C@H](C)O)c1F Amb33325025 [0,2,0,0,0,0|1,1,0]=4 9130 B13R1.150 Cc1cccc(CNC(C)C)c1Br Amb27251778 [0,2,0,0,0,0|2,0,0]=4 9131 B13R1.150 Cc1cccc(CNN(C)C)c1F Amb27974400 [0,2,0,0,0,0|1,1,0]=4 9132 B13R1.150 O=C(O)CCc1cccc(Br)c1Br Amb25155278 [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.150 O=C(O)CCc1cccc(Cl)c1Br Amb24728330 [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.150 O=C(O)CCc1cccc(F)c1Br Amb24411438 [0,2,0,0,0,0|2,0,0]=4 9135 B13R1.150 O=C(O)CCc1cccc(I)c1Br Amb24637733 [0,2,0,0,0,0|2,0,0]=4 9136 B13R1.150 O=C(O)CCc1cccc(O)c1Br Amb27223884 [0,2,0,0,0,0|2,0,0]=4 9137 B13R1.150 O=[N+]([O-])CCc1cccc(F)c1Br Amb33450565 [0,2,0,0,0,0|1,0,1]=4 9138 B13R1.150 O=[N+]([O-])CCc1cccc(O)c1Br Amb33386843 [0,2,0,0,0,0|1,0,1]=4 9139 B13R1.569 C#CCCc1cccc(OC)c1Br Amb33484744 [0,2,0,0,0,0|1,0,1]=4 9140 B13R1.569 CCCCc1cccc(CN)c1Cl Amb34916563 [0,2,0,0,0,0|1,1,0]=4 9141 B13R1.569 CNCCc1cccc(OC)c1Br Amb33388480 [0,2,0,0,0,0|0,0,0]=2 9142 B13R1.569 CNCCc1cccc(OC)c1C Amb33270011 [0,2,0,0,0,0|1,0,0]=3 9143 B13R1.569 CNCCc1cccc(OC)c1O Amb33372437 [0,2,0,0,0,0|1,0,0]=3 9144 B13R1.569 COc1cccc(CCC#N)c1Br Amb27615925 [0,2,0,0,0,0|2,0,0]=4 9145 B13R1.569 COc1cccc(CCC=O)c1Br Amb33451943 [0,2,0,0,0,0|2,0,0]=4 9146 B13R1.569 COc1cccc(CCCN)c1Br Amb33388478 [0,2,0,0,0,0|2,0,0]=4 9147 B13R1.569 COc1cccc(CCCO)c1Br Amb33331681 [0,2,0,0,0,0|2,0,0]=4 9148 B13R1.569 COc1cccc(CCCS)c1Br Amb33331618 [0,2,0,0,0,0|2,0,0]=4 9149 B13R1.569 COc1cccc(CCON)c1Br Amb33331605 [0,2,0,0,0,0|2,0,0]=4 9150 B13R1.569 CSc1cccc(CCC#N)c1Br Amb26617905 [0,2,0,0,0,0|2,0,0]=4 9151 B13R1.569 N#CCCc1cccc(C=O)c1Br Amb27209369 [0,2,0,0,0,0|2,0,0]=4 9152 B13R1.569 N#CCCc1cccc(CCl)c1Br Amb27844579 [0,2,0,0,0,0|2,0,0]=4 9153 B13R1.569 N#CCCc1cccc(CF)c1Br Amb27225079 [0,2,0,0,0,0|2,0,0]=4 9154 B13R1.569 N#Cc1cccc(CCCCl)c1Br Amb26571518 [0,2,0,0,0,0|2,0,0]=4 9155 B13R1.569 [C-]#[N+]CCc1cccc(OC)c1Br Amb33387120 [0,2,0,0,0,0|0,0,2]=4 9156 B13R1.3395 C#CCCc1c(Br)ccc(Cl)c1F Amb33434493 [0,2,0,0,0,0|1,0,1]=4 9157 B13R1.3395 C=CCCc1c(F)ccc(F)c1Br Amb29867192 [0,2,0,0,0,0|1,0,1]=4 9158 B13R1.3395 CCCCc1c(N)ccc(F)c1Br Amb35656392 [0,2,0,0,0,0|1,0,0]=3 9159 B13R1.3395 CCCNc1c(N)ccc(F)c1Br Amb35634134 [0,2,0,0,0,0|2,0,0]=4 9160 B13R1.3395 CCCOc1c(Br)ccc(C)c1F Amb27598289 [0,2,0,0,0,0|2,0,0]=4 9161 B13R1.3395 CCCOc1c(N)ccc(F)c1Br Amb33035568 [0,2,0,0,0,0|2,0,0]=4 9162 B13R1.3395 CCCSc1c(N)ccc(F)c1Br Amb35656237 [0,2,0,0,0,0|2,0,0]=4 9163 B13R1.3395 CCNCc1c(F)ccc(F)c1Br Amb30014221 [0,2,0,0,0,0|2,0,0]=4 9164 B13R1.3395 CNCCc1c(Br)ccc(Cl)c1F Amb33434385 [0,2,0,0,0,0|0,0,0]=2 9165 B13R1.3395 CNCCc1c(Cl)ccc(F)c1F Amb27882578 [0,2,0,0,0,0|0,1,0]=3 9166 B13R1.3395 CNCCc1c(Cl)ccc(F)c1O Amb27224148 [0,2,0,0,0,0|0,1,0]=3 9167 B13R1.3395 CNCCc1c(F)ccc(C)c1C Amb27792334 [0,2,0,0,0,0|0,1,0]=3 9168 B13R1.3395 CNCCc1c(F)ccc(C)c1Cl Amb27636177 [0,2,0,0,0,0|0,1,0]=3 9169 B13R1.3395 CNCCc1c(F)ccc(C)c1F Amb26079172 [0,2,0,0,0,0|0,1,0]=3 9170 B13R1.3395 CNCCc1c(F)ccc(C)c1O Amb28246082 [0,2,0,0,0,0|0,1,0]=3 9171 B13R1.3395 CNCCc1c(F)ccc(Cl)c1F Amb27864253 [0,2,0,0,0,0|0,1,0]=3 9172 B13R1.3395 CNCCc1c(F)ccc(F)c1Br Amb30014075 [0,2,0,0,0,0|0,0,0]=2 9173 B13R1.3395 CNCCc1c(F)ccc(F)c1Cl Amb33052751 [0,2,0,0,0,0|0,1,0]=3 9174 B13R1.3395 CNCCc1c(F)ccc(F)c1F Amb33422750 [0,2,0,0,0,0|0,1,0]=3 9175 B13R1.3395 CNCCc1c(F)ccc(O)c1Cl Amb28367766 [0,2,0,0,0,0|0,1,0]=3 9176 B13R1.3395 CNCCc1c(O)ccc(Cl)c1F Amb27958716 [0,2,0,0,0,0|0,1,0]=3 9177 B13R1.3395 CNCCc1c(O)ccc(F)c1C Amb28062453 [0,2,0,0,0,0|1,0,0]=3 9178 B13R1.3395 CSCCc1c(F)ccc(C)c1Br Amb28453516 [0,2,0,0,0,0|1,0,0]=3 9179 B13R1.3395 CSCOc1c(Cl)ccc(Cl)c1Br Amb28194011 [0,2,0,0,0,0|2,0,0]=4 9180 B13R1.3395 Fc1c(Cl)ccc(Br)c1CCCS Amb33434499 [0,2,0,0,0,0|2,0,0]=4 9181 B13R1.3395 Fc1ccc(F)c(CCCBr)c1Br Amb29875274 [0,2,0,0,0,0|2,0,0]=4 9182 B13R1.3395 Fc1ccc(F)c(CCCCl)c1Br Amb29875273 [0,2,0,0,0,0|2,0,0]=4 9183 B13R1.3395 N#CCCc1c(Br)ccc(Cl)c1F Amb28460725 [0,2,0,0,0,0|2,0,0]=4 9184 B13R1.3395 NCCCc1c(Br)ccc(Cl)c1F Amb33434384 [0,2,0,0,0,0|2,0,0]=4 9185 B13R1.3395 NCCCc1c(F)ccc(F)c1Br Amb30014047 [0,2,0,0,0,0|2,0,0]=4 9186 B13R1.3395 NOCCc1c(Br)ccc(Cl)c1F Amb33435406 [0,2,0,0,0,0|2,0,0]=4 9187 B13R1.3395 O=CCCc1c(Br)ccc(Cl)c1F Amb33434500 [0,2,0,0,0,0|2,0,0]=4 9188 B13R1.3395 O=CCCc1c(F)ccc(F)c1Br Amb35704927 [0,2,0,0,0,0|2,0,0]=4 9189 B13R1.3395 OCCCc1c(Br)ccc(Cl)c1F Amb33434498 [0,2,0,0,0,0|2,0,0]=4 9190 B13R1.3395 OCCCc1c(F)ccc(F)c1Br Amb35704638 [0,2,0,0,0,0|2,0,0]=4 9191 B13R1.3395 [C-]#[N+]CCc1c(Br)ccc(Cl)c1F Amb33434117 [0,2,0,0,0,0|0,0,2]=4 9192 B13R1.3516 CNCCc1cccc(Br)c1OC Amb33008854 [0,2,0,0,0,0|1,0,0]=3 9193 B13R1.3516 CNCCc1cccc(C)c1OC Amb33323561 [0,2,0,0,0,0|1,0,0]=3 9194 B13R1.3516 CNCCc1cccc(Cl)c1OC Amb33261859 [0,2,0,0,0,0|1,0,0]=3 9195 B13R1.3516 CNCCc1cccc(F)c1OC Amb33310418 [0,2,0,0,0,0|1,0,0]=3 9196 B13R1.3516 Cc1cccc(CCC#N)c1CBr Amb27215547 [0,2,0,0,0,0|2,0,0]=4 9197 B13R1.3516 N#CCCc1cccc(Br)c1CBr Amb24651208 [0,2,0,0,0,0|2,0,0]=4 9198 B13R1.3516 N#CCCc1cccc(I)c1CBr Amb27967968 [0,2,0,0,0,0|2,0,0]=4 9199 B13R1.3518 CCCCc1ncc(N)c(C)c1Br Amb26518342 [0,2,0,0,0,0|2,0,0]=4 9200 B13R1.3518 CCNCc1ccc(F)c(F)c1Br Amb27174573 [0,2,0,0,0,0|2,0,0]=4 9201 B13R1.3518 CNCCc1ccc(Br)c(F)c1F Amb30029387 [0,2,0,0,0,0|0,1,0]=3 9202 B13R1.3518 CNCCc1ccc(C)c(Br)c1C Amb33008352 [0,2,0,0,0,0|1,0,0]=3 9203 B13R1.3518 CNCCc1ccc(Cl)c(Cl)c1Cl Amb18941150 [0,2,0,0,0,0|0,1,0]=3 9204 B13R1.3518 CNCCc1ccc(F)c(Br)c1F Amb33005510 [0,2,0,0,0,0|0,1,0]=3 9205 B13R1.3518 CNCCc1ccc(F)c(Cl)c1C Amb27623732 [0,2,0,0,0,0|1,0,0]=3 9206 B13R1.3518 CNCCc1ccc(F)c(Cl)c1F Amb25208742 [0,2,0,0,0,0|0,1,0]=3 9207 B13R1.3518 CNCCc1ccc(F)c(F)c1F Amb18302206 [0,2,0,0,0,0|0,1,0]=3 9208 B13R1.3518 CNCCc1ccc(O)c(Cl)c1F Amb27636749 [0,2,0,0,0,0|0,1,0]=3 9209 B13R1.3518 CNCCc1ccc(O)c(O)c1Cl Amb22750798 [0,2,0,0,0,0|0,1,0]=3 9210 B13R1.3518 CNCCc1ccc(O)c(O)c1O Amb18274751 [0,2,0,0,0,0|1,0,0]=3 9211 B13R1.3518 CNNCc1ccc(O)c(O)c1O Amb25077161 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.3518 CSCCc1ccc(F)c(F)c1C Amb28324488 [0,2,0,0,0,0|2,0,0]=4 9213 B13R1.73 CNCCc1ccc(Br)cc1OC Amb33477672 [0,2,0,0,0,0|1,0,0]=3 9214 B13R1.73 CNCCc1ccc(C)cc1OC Amb33343270 [0,2,0,0,0,0|1,0,0]=3 9215 B13R1.73 CNCCc1ccc(Cl)cc1OC Amb33052051 [0,2,0,0,0,0|1,0,0]=3 9216 B13R1.73 CNCCc1ccc(Cl)nc1OC Amb33221530 [0,2,0,0,0,0|2,0,0]=4 9217 B13R1.73 CNCCc1ccc(F)cc1OC Amb33313718 [0,2,0,0,0,0|1,0,0]=3 9218 B13R1.73 CNCCc1ccc(O)cc1OC Amb33313150 [0,2,0,0,0,0|1,0,0]=3 9219 B13R1.73 N#CCCc1ccc(Br)cc1CBr Amb26573283 [0,2,0,0,0,0|2,0,0]=4 9220 B13R1.73 N#CCCc1ccc(Cl)cc1CBr Amb28246205 [0,2,0,0,0,0|2,0,0]=4 9221 B13R1.73 N#CCCc1ccc(F)cc1CBr Amb27609755 [0,2,0,0,0,0|2,0,0]=4 9222 B13R1.73 N#CCCc1ccc(S)cc1CBr Amb28368699 [0,2,0,0,0,0|2,0,0]=4 9223 B13R1.75 C#CCCc1ccc(OC)cc1Br Amb33387563 [0,2,0,0,0,0|1,0,1]=4 9224 B13R1.75 CCCOc1ccc(C#N)cc1Br Amb5775939 [0,2,0,0,0,0|2,0,0]=4 9225 B13R1.75 CCCOc1ccc(C=O)cc1Br Amb3545950 [0,2,0,0,0,0|2,0,0]=4 9226 B13R1.75 CCCOc1ccc(CN)cc1Br Amb18316223 [0,2,0,0,0,0|2,0,0]=4 9227 B13R1.75 CCCOc1ccc(CO)cc1Br Amb3541597 [0,2,0,0,0,0|2,0,0]=4 9228 B13R1.75 CNCCc1ccc(OC)cc1Br Amb33242584 [0,2,0,0,0,0|0,0,0]=2 9229 B13R1.75 CNCCc1ccc(OC)cc1C Amb18942887 [0,2,0,0,0,0|1,0,0]=3 9230 B13R1.75 CNCCc1ccc(OC)cc1Cl Amb18566192 [0,2,0,0,0,0|0,1,0]=3 9231 B13R1.75 CNCCc1ccc(OC)cc1F Amb33359686 [0,2,0,0,0,0|0,1,0]=3 9232 B13R1.75 CNCCc1ccc(OC)cc1O Amb33317748 [0,2,0,0,0,0|1,0,0]=3 9233 B13R1.75 COc1ccc(CCC#N)c(Br)c1 Amb26639472 [0,2,0,0,0,0|2,0,0]=4 9234 B13R1.75 COc1ccc(CCC=O)c(Br)c1 Amb24092999 [0,2,0,0,0,0|2,0,0]=4 9235 B13R1.75 COc1ccc(CCCN)c(Br)c1 Amb33389502 [0,2,0,0,0,0|2,0,0]=4 9236 B13R1.75 COc1ccc(CCCO)c(Br)c1 Amb33387564 [0,2,0,0,0,0|2,0,0]=4 9237 B13R1.75 COc1ccc(CCCS)c(Br)c1 Amb33387897 [0,2,0,0,0,0|2,0,0]=4 9238 B13R1.75 COc1ccc(CCON)c(Br)c1 Amb33389456 [0,2,0,0,0,0|2,0,0]=4 9239 B13R1.75 N#CCCc1ccc(C=O)cc1Br Amb27665948 [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.75 N#CCCc1ccc(CBr)cc1Br Amb25941128 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.75 N#Cc1ccc(CCCBr)c(Br)c1 Amb25942621 [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.75 N#Cc1ccc(CCCCl)c(Br)c1 Amb27636413 [0,2,0,0,0,0|2,0,0]=4 9243 B13R1.75 [C-]#[N+]CCc1ccc(OC)cc1Br Amb33386433 [0,2,0,0,0,0|0,0,2]=4 9244 B13R1.164 C=C(C)CNc1ccc(C)cc1Br Amb17307364 [0,2,0,0,0,0|2,0,0]=4 9245 B13R1.164 C=C(C)CNc1ccc(Cl)cc1Br Amb28047888 [0,2,0,0,0,0|2,0,0]=4 9246 B13R1.164 C=C(C)CNc1ccc(F)cc1Br Amb28249593 [0,2,0,0,0,0|2,0,0]=4 9247 B13R1.164 C=C(C)COc1ccc(Br)cc1Br Amb28284013 [0,2,0,0,0,0|2,0,0]=4 9248 B13R1.164 C=C(C)COc1ccc(C)cc1Br Amb33528077 [0,2,0,0,0,0|2,0,0]=4 9249 B13R1.164 C=C(C)COc1ccc(Cl)cc1Br Amb17268806 [0,2,0,0,0,0|2,0,0]=4 9250 B13R1.164 C=C(C)COc1ccc(F)cc1Br Amb6277301 [0,2,0,0,0,0|2,0,0]=4 9251 B13R1.164 CC(=O)CCc1ccc(Br)cc1C Amb18577423 [0,2,0,0,0,0|2,0,0]=4 9252 B13R1.164 CC(=O)CCc1ccc(Br)cc1Cl Amb25822305 [0,2,0,0,0,0|1,1,0]=4 9253 B13R1.164 CC(=O)CCc1ccc(Br)cc1F Amb9297396 [0,2,0,0,0,0|1,1,0]=4 9254 B13R1.164 CC(=O)CCc1ccc(Br)cc1O Amb24356968 [0,2,0,0,0,0|2,0,0]=4 9255 B13R1.164 CC(=O)CCc1ccc(C)cc1Br Amb18071682 [0,2,0,0,0,0|1,0,0]=3 9256 B13R1.164 CC(=O)CCc1ccc(C)cc1C Amb17400575 [0,2,0,0,0,0|2,0,0]=4 9257 B13R1.164 CC(=O)CCc1ccc(C)cc1Cl Amb26017800 [0,2,0,0,0,0|1,1,0]=4 9258 B13R1.164 CC(=O)CCc1ccc(C)cc1F Amb27840947 [0,2,0,0,0,0|1,1,0]=4 9259 B13R1.164 CC(=O)CCc1ccc(C)cc1O Amb26317277 [0,2,0,0,0,0|2,0,0]=4 9260 B13R1.164 CC(=O)CCc1ccc(Cl)cc1Br Amb27657318 [0,2,0,0,0,0|1,0,0]=3 9261 B13R1.164 CC(=O)CCc1ccc(Cl)cc1C Amb18066412 [0,2,0,0,0,0|2,0,0]=4 9262 B13R1.164 CC(=O)CCc1ccc(Cl)cc1Cl Amb8869636 [0,2,0,0,0,0|1,1,0]=4 9263 B13R1.164 CC(=O)CCc1ccc(Cl)cc1F Amb24489568 [0,2,0,0,0,0|1,1,0]=4 9264 B13R1.164 CC(=O)CCc1ccc(Cl)cc1O Amb26017884 [0,2,0,0,0,0|2,0,0]=4 9265 B13R1.164 CC(=O)CCc1ccc(F)cc1Br Amb9031562 [0,2,0,0,0,0|1,0,0]=3 9266 B13R1.164 CC(=O)CCc1ccc(F)cc1C Amb25354362 [0,2,0,0,0,0|2,0,0]=4 9267 B13R1.164 CC(=O)CCc1ccc(F)cc1Cl Amb9031568 [0,2,0,0,0,0|1,1,0]=4 9268 B13R1.164 CC(=O)CCc1ccc(F)cc1F Amb18328432 [0,2,0,0,0,0|1,1,0]=4 9269 B13R1.164 CC(=O)CCc1ccc(F)cc1O Amb27812270 [0,2,0,0,0,0|2,0,0]=4 9270 B13R1.164 CC(=O)CCc1ccc(N)cc1C Amb26498211 [0,2,0,0,0,0|2,0,0]=4 9271 B13R1.164 CC(=O)CCc1ccc(N)cc1Cl Amb25133843 [0,2,0,0,0,0|1,1,0]=4 9272 B13R1.164 CC(=O)CCc1ccc(O)cc1Br Amb28316728 [0,2,0,0,0,0|1,0,0]=3 9273 B13R1.164 CC(=O)CCc1ccc(O)cc1C Amb24737536 [0,2,0,0,0,0|2,0,0]=4 9274 B13R1.164 CC(=O)CCc1ccc(O)cc1Cl Amb26647311 [0,2,0,0,0,0|1,1,0]=4 9275 B13R1.164 CC(=O)CCc1ccc(O)cc1F Amb25859174 [0,2,0,0,0,0|1,1,0]=4 9276 B13R1.164 CC(=O)CCc1ccc(O)cc1O Amb25358936 [0,2,0,0,0,0|2,0,0]=4 9277 B13R1.164 CC(=O)SCc1ccc(Br)cc1Br Amb33249801 [0,2,0,0,0,0|2,0,0]=4 9278 B13R1.164 CC(Br)CCc1ccc(Br)cc1Cl Amb28188133 [0,2,0,0,0,0|1,1,0]=4 9279 B13R1.164 CC(Br)CCc1ccc(Br)cc1F Amb27801739 [0,2,0,0,0,0|1,1,0]=4 9280 B13R1.164 CC(Br)CCc1ccc(Cl)cc1F Amb27982434 [0,2,0,0,0,0|1,1,0]=4 9281 B13R1.164 CC(Br)CCc1ccc(F)cc1F Amb28366106 [0,2,0,0,0,0|1,1,0]=4 9282 B13R1.164 CC(C)CCc1ncc(N)cc1Br Amb26447049 [0,2,0,0,0,0|2,0,0]=4 9283 B13R1.164 CC(C)CNc1ccc(F)cc1Br Amb7773177 [0,2,0,0,0,0|2,0,0]=4 9284 B13R1.164 CC(C)CNc1ccc(I)cc1Br Amb28203253 [0,2,0,0,0,0|2,0,0]=4 9285 B13R1.164 CC(C)COc1ccc(Br)cc1Br Amb26881834 [0,2,0,0,0,0|2,0,0]=4 9286 B13R1.164 CC(C)COc1ccc(Cl)cc1Br Amb17270685 [0,2,0,0,0,0|2,0,0]=4 9287 B13R1.164 CC(C)COc1ccc(F)cc1Br Amb6278060 [0,2,0,0,0,0|2,0,0]=4 9288 B13R1.164 CC(C)COc1ccc(N)cc1Br Amb24642123 [0,2,0,0,0,0|2,0,0]=4 9289 B13R1.164 CC(C)CSc1ccc(N)cc1Br Amb27651026 [0,2,0,0,0,0|2,0,0]=4 9290 B13R1.164 CC(C)NCc1ccc(Cl)cc1Br Amb25233874 [0,2,0,0,0,0|2,0,0]=4 9291 B13R1.164 CC(C)OCc1ccc(F)cc1Br Amb22900179 [0,2,0,0,0,0|2,0,0]=4 9292 B13R1.164 CC(C)OCc1ccc(N)cc1Br Amb18288994 [0,2,0,0,0,0|2,0,0]=4 9293 B13R1.164 CC(Cl)CCc1ccc(F)cc1Cl Amb27649466 [0,2,0,0,0,0|1,1,0]=4 9294 B13R1.164 CC(Cl)CCc1ccc(O)cc1F Amb35696317 [0,2,0,0,0,0|1,1,0]=4 9295 B13R1.164 CC(N)CCc1ccc(Br)cc1Cl Amb25126685 [0,2,0,0,0,0|1,1,0]=4 9296 B13R1.164 CC(N)CCc1ccc(Br)cc1F Amb9297401 [0,2,0,0,0,0|1,1,0]=4 9297 B13R1.164 CC(N)CCc1ccc(Br)cc1O Amb24558669 [0,2,0,0,0,0|2,0,0]=4 9298 B13R1.164 CC(N)CCc1ccc(Cl)cc1Br Amb25704372 [0,2,0,0,0,0|1,0,0]=3 9299 B13R1.164 CC(N)CCc1ccc(Cl)cc1Cl Amb9031772 [0,2,0,0,0,0|1,1,0]=4 9300 B13R1.164 CC(N)CCc1ccc(Cl)cc1F Amb26043260 [0,2,0,0,0,0|1,1,0]=4 9301 B13R1.164 CC(N)CCc1ccc(Cl)cc1O Amb25897996 [0,2,0,0,0,0|2,0,0]=4 9302 B13R1.164 CC(N)CCc1ccc(F)cc1Br Amb9031765 [0,2,0,0,0,0|1,0,0]=3 9303 B13R1.164 CC(N)CCc1ccc(F)cc1Cl Amb8869699 [0,2,0,0,0,0|1,1,0]=4 9304 B13R1.164 CC(N)CCc1ccc(F)cc1F Amb18987280 [0,2,0,0,0,0|1,1,0]=4 9305 B13R1.164 CC(N)CCc1ccc(O)cc1Br Amb28422392 [0,2,0,0,0,0|1,0,0]=3 9306 B13R1.164 CC(N)CCc1ccc(O)cc1Cl Amb25804054 [0,2,0,0,0,0|1,1,0]=4 9307 B13R1.164 CC(N)CCc1ccc(O)cc1F Amb25766413 [0,2,0,0,0,0|1,1,0]=4 9308 B13R1.164 CC(N)CCc1ccc(O)cc1O Amb25322235 [0,2,0,0,0,0|2,0,0]=4 9309 B13R1.164 CC(O)CCc1ccc(Br)cc1Cl Amb24577288 [0,2,0,0,0,0|1,1,0]=4 9310 B13R1.164 CC(O)CCc1ccc(Br)cc1F Amb24680448 [0,2,0,0,0,0|1,1,0]=4 9311 B13R1.164 CC(O)CCc1ccc(Br)cc1O Amb33388901 [0,2,0,0,0,0|2,0,0]=4 9312 B13R1.164 CC(O)CCc1ccc(Cl)cc1Br Amb33450978 [0,2,0,0,0,0|1,0,0]=3 9313 B13R1.164 CC(O)CCc1ccc(Cl)cc1Cl Amb27969298 [0,2,0,0,0,0|1,1,0]=4 9314 B13R1.164 CC(O)CCc1ccc(Cl)cc1F Amb26468207 [0,2,0,0,0,0|1,1,0]=4 9315 B13R1.164 CC(O)CCc1ccc(Cl)cc1O Amb33260507 [0,2,0,0,0,0|2,0,0]=4 9316 B13R1.164 CC(O)CCc1ccc(F)cc1Br Amb27414490 [0,2,0,0,0,0|1,0,0]=3 9317 B13R1.164 CC(O)CCc1ccc(F)cc1Cl Amb27815398 [0,2,0,0,0,0|1,1,0]=4 9318 B13R1.164 CC(O)CCc1ccc(F)cc1F Amb18329172 [0,2,0,0,0,0|1,1,0]=4 9319 B13R1.164 CC(O)CCc1ccc(O)cc1Cl Amb33224665 [0,2,0,0,0,0|1,1,0]=4 9320 B13R1.164 CC(O)CCc1ccc(O)cc1F Amb33377433 [0,2,0,0,0,0|1,1,0]=4 9321 B13R1.164 CC(O)CCc1ccc(O)cc1O Amb26925625 [0,2,0,0,0,0|2,0,0]=4 9322 B13R1.164 CC(O)CNc1ccc(F)cc1Br Amb18969611 [0,2,0,0,0,0|2,0,0]=4 9323 B13R1.164 CN(C)CCc1ccc(F)cc1Br Amb27463288 [0,2,0,0,0,0|0,0,0]=2 9324 B13R1.164 CN(C)CCc1ccc(F)cc1N Amb27186282 [0,2,0,0,0,0|1,0,0]=3 9325 B13R1.164 CN(C)NCc1ccc(Br)cc1O Amb35609057 [0,2,0,0,0,0|2,0,0]=4 9326 B13R1.164 CN(C)NCc1ccc(Cl)cc1F Amb27472948 [0,2,0,0,0,0|1,1,0]=4 9327 B13R1.164 CN(C)NCc1ccc(F)cc1Br Amb27618546 [0,2,0,0,0,0|1,0,0]=3 9328 B13R1.164 CN(C)NCc1ccc(F)cc1Cl Amb27834019 [0,2,0,0,0,0|1,1,0]=4 9329 B13R1.164 CN(C)NCc1ccc(F)cc1F Amb28188547 [0,2,0,0,0,0|1,1,0]=4 9330 B13R1.164 CN(C)NCc1ccc(O)cc1F Amb35696325 [0,2,0,0,0,0|1,1,0]=4 9331 B13R1.164 CN(C)\C=N\c1ccc(Br)cc1Br Amb28293716 [0,2,0,0,0,0|1,0,1]=4 9332 B13R1.164 CN(N)CCc1ccc(Cl)cc1Cl Amb18067451 [0,2,0,0,0,0|0,1,0]=3 9333 B13R1.164 C[C@@H](N)CCc1ccc(Br)cc1Cl Amb33450923 [0,2,0,0,0,0|1,1,0]=4 9334 B13R1.164 C[C@@H](N)CCc1ccc(Br)cc1F Amb33240221 [0,2,0,0,0,0|1,1,0]=4 9335 B13R1.164 C[C@@H](N)CCc1ccc(Br)cc1O Amb24419022 [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.164 C[C@@H](N)CCc1ccc(Cl)cc1Br Amb33451534 [0,2,0,0,0,0|1,0,0]=3 9337 B13R1.164 C[C@@H](N)CCc1ccc(Cl)cc1Cl Amb33407348 [0,2,0,0,0,0|1,1,0]=4 9338 B13R1.164 C[C@@H](N)CCc1ccc(Cl)cc1F Amb33052110 [0,2,0,0,0,0|1,1,0]=4 9339 B13R1.164 C[C@@H](N)CCc1ccc(Cl)cc1O Amb26044426 [0,2,0,0,0,0|2,0,0]=4 9340 B13R1.164 C[C@@H](N)CCc1ccc(F)cc1Br Amb33452108 [0,2,0,0,0,0|1,0,0]=3 9341 B13R1.164 C[C@@H](N)CCc1ccc(F)cc1Cl Amb33220746 [0,2,0,0,0,0|1,1,0]=4 9342 B13R1.164 C[C@@H](N)CCc1ccc(F)cc1F Amb33475178 [0,2,0,0,0,0|1,1,0]=4 9343 B13R1.164 C[C@@H](N)CCc1ccc(I)cc1O Amb28388786 [0,2,0,0,0,0|2,0,0]=4 9344 B13R1.164 C[C@@H](N)CCc1ccc(N)cc1Cl Amb28059505 [0,2,0,0,0,0|1,1,0]=4 9345 B13R1.164 C[C@@H](N)CCc1ccc(O)cc1Cl Amb25927203 [0,2,0,0,0,0|1,1,0]=4 9346 B13R1.164 C[C@@H](N)CCc1ccc(O)cc1F Amb26859299 [0,2,0,0,0,0|1,1,0]=4 9347 B13R1.164 C[C@@H](N)CCc1ccc(O)cc1O Amb27644564 [0,2,0,0,0,0|2,0,0]=4 9348 B13R1.164 C[C@@H](N)COc1ccc(Br)cc1Br Amb35714496 [0,2,0,0,0,0|2,0,0]=4 9349 B13R1.164 C[C@@H](N)COc1ccc(Cl)cc1Br Amb30012133 [0,2,0,0,0,0|2,0,0]=4 9350 B13R1.164 C[C@@H](N)COc1ccc(F)cc1Br Amb35687549 [0,2,0,0,0,0|2,0,0]=4 9351 B13R1.164 C[C@@H](O)CCc1ccc(Br)cc1Cl Amb33334301 [0,2,0,0,0,0|1,1,0]=4 9352 B13R1.164 C[C@@H](O)CCc1ccc(Br)cc1F Amb33389584 [0,2,0,0,0,0|1,1,0]=4 9353 B13R1.164 C[C@@H](O)CCc1ccc(Br)cc1O Amb33389158 [0,2,0,0,0,0|2,0,0]=4 9354 B13R1.164 C[C@@H](O)CCc1ccc(Cl)cc1Br Amb33478462 [0,2,0,0,0,0|1,0,0]=3 9355 B13R1.164 C[C@@H](O)CCc1ccc(Cl)cc1Cl Amb33220524 [0,2,0,0,0,0|1,1,0]=4 9356 B13R1.164 C[C@@H](O)CCc1ccc(Cl)cc1F Amb33052685 [0,2,0,0,0,0|1,1,0]=4 9357 B13R1.164 C[C@@H](O)CCc1ccc(Cl)cc1O Amb33260513 [0,2,0,0,0,0|2,0,0]=4 9358 B13R1.164 C[C@@H](O)CCc1ccc(F)cc1Br Amb33336592 [0,2,0,0,0,0|1,0,0]=3 9359 B13R1.164 C[C@@H](O)CCc1ccc(F)cc1Cl Amb33258089 [0,2,0,0,0,0|1,1,0]=4 9360 B13R1.164 C[C@@H](O)CCc1ccc(F)cc1F Amb33196056 [0,2,0,0,0,0|1,1,0]=4 9361 B13R1.164 C[C@@H](O)CCc1ccc(O)cc1Cl Amb33224016 [0,2,0,0,0,0|1,1,0]=4 9362 B13R1.164 C[C@@H](O)CCc1ccc(O)cc1F Amb33376901 [0,2,0,0,0,0|1,1,0]=4 9363 B13R1.164 C[C@@H](O)CCc1ccc(O)cc1O Amb33270107 [0,2,0,0,0,0|2,0,0]=4 9364 B13R1.164 C[C@@H](O)CNc1ccc(Cl)cc1Br Amb27171875 [0,2,0,0,0,0|2,0,0]=4 9365 B13R1.164 C[C@@H](O)CNc1ccc(F)cc1Br Amb27649681 [0,2,0,0,0,0|2,0,0]=4 9366 B13R1.164 C[C@@H](O)CNc1ccc(I)cc1Br Amb27758282 [0,2,0,0,0,0|2,0,0]=4 9367 B13R1.164 C[C@@H](O)COc1ccc(Cl)cc1Br Amb27446902 [0,2,0,0,0,0|2,0,0]=4 9368 B13R1.164 C[C@@H](O)COc1ccc(F)cc1Br Amb27478242 [0,2,0,0,0,0|2,0,0]=4 9369 B13R1.164 C[C@H](N)CCc1ccc(Br)cc1Cl Amb26969785 [0,2,0,0,0,0|1,1,0]=4 9370 B13R1.164 C[C@H](N)CCc1ccc(Br)cc1F Amb24491975 [0,2,0,0,0,0|1,1,0]=4 9371 B13R1.164 C[C@H](N)CCc1ccc(Br)cc1O Amb25082496 [0,2,0,0,0,0|2,0,0]=4 9372 B13R1.164 C[C@H](N)CCc1ccc(Cl)cc1Br Amb27783397 [0,2,0,0,0,0|1,0,0]=3 9373 B13R1.164 C[C@H](N)CCc1ccc(Cl)cc1Cl Amb25244151 [0,2,0,0,0,0|1,1,0]=4 9374 B13R1.164 C[C@H](N)CCc1ccc(Cl)cc1F Amb24492024 [0,2,0,0,0,0|1,1,0]=4 9375 B13R1.164 C[C@H](N)CCc1ccc(Cl)cc1N Amb27259002 [0,2,0,0,0,0|2,0,0]=4 9376 B13R1.164 C[C@H](N)CCc1ccc(Cl)cc1O Amb26869958 [0,2,0,0,0,0|2,0,0]=4 9377 B13R1.164 C[C@H](N)CCc1ccc(F)cc1Br Amb26984359 [0,2,0,0,0,0|1,0,0]=3 9378 B13R1.164 C[C@H](N)CCc1ccc(F)cc1Cl Amb24384342 [0,2,0,0,0,0|1,1,0]=4 9379 B13R1.164 C[C@H](N)CCc1ccc(F)cc1F Amb24404917 [0,2,0,0,0,0|1,1,0]=4 9380 B13R1.164 C[C@H](N)CCc1ccc(I)cc1F Amb27234829 [0,2,0,0,0,0|1,1,0]=4 9381 B13R1.164 C[C@H](N)CCc1ccc(O)cc1Cl Amb25138121 [0,2,0,0,0,0|1,1,0]=4 9382 B13R1.164 C[C@H](N)CCc1ccc(O)cc1F Amb25320262 [0,2,0,0,0,0|1,1,0]=4 9383 B13R1.164 C[C@H](N)CCc1ccc(O)cc1O Amb25927426 [0,2,0,0,0,0|2,0,0]=4 9384 B13R1.164 C[C@H](N)COc1ccc(Br)cc1Br Amb35714495 [0,2,0,0,0,0|2,0,0]=4 9385 B13R1.164 C[C@H](N)COc1ccc(Cl)cc1Br Amb30012132 [0,2,0,0,0,0|2,0,0]=4 9386 B13R1.164 C[C@H](N)COc1ccc(F)cc1Br Amb35687548 [0,2,0,0,0,0|2,0,0]=4 9387 B13R1.164 C[C@H](O)CCc1ccc(Br)cc1Cl Amb33334611 [0,2,0,0,0,0|1,1,0]=4 9388 B13R1.164 C[C@H](O)CCc1ccc(Br)cc1F Amb33389580 [0,2,0,0,0,0|1,1,0]=4 9389 B13R1.164 C[C@H](O)CCc1ccc(Br)cc1O Amb33389156 [0,2,0,0,0,0|2,0,0]=4 9390 B13R1.164 C[C@H](O)CCc1ccc(Cl)cc1Br Amb33478467 [0,2,0,0,0,0|1,0,0]=3 9391 B13R1.164 C[C@H](O)CCc1ccc(Cl)cc1Cl Amb33220522 [0,2,0,0,0,0|1,1,0]=4 9392 B13R1.164 C[C@H](O)CCc1ccc(Cl)cc1F Amb33052676 [0,2,0,0,0,0|1,1,0]=4 9393 B13R1.164 C[C@H](O)CCc1ccc(Cl)cc1O Amb33260510 [0,2,0,0,0,0|2,0,0]=4 9394 B13R1.164 C[C@H](O)CCc1ccc(F)cc1Br Amb33337348 [0,2,0,0,0,0|1,0,0]=3 9395 B13R1.164 C[C@H](O)CCc1ccc(F)cc1Cl Amb33258088 [0,2,0,0,0,0|1,1,0]=4 9396 B13R1.164 C[C@H](O)CCc1ccc(F)cc1F Amb33196058 [0,2,0,0,0,0|1,1,0]=4 9397 B13R1.164 C[C@H](O)CCc1ccc(O)cc1Cl Amb33224015 [0,2,0,0,0,0|1,1,0]=4 9398 B13R1.164 C[C@H](O)CCc1ccc(O)cc1F Amb33376903 [0,2,0,0,0,0|1,1,0]=4 9399 B13R1.164 C[C@H](O)CCc1ccc(O)cc1O Amb33270108 [0,2,0,0,0,0|2,0,0]=4 9400 B13R1.164 C[C@H](O)CNc1ccc(Cl)cc1Br Amb28313201 [0,2,0,0,0,0|2,0,0]=4 9401 B13R1.164 Cc1cc(Br)ccc1CCC(C)N Amb26610366 [0,2,0,0,0,0|2,0,0]=4 9402 B13R1.164 Cc1cc(Br)ccc1CCC(C)O Amb33435299 [0,2,0,0,0,0|2,0,0]=4 9403 B13R1.164 Cc1cc(Br)ccc1CC[C@@H](C)N Amb33451060 [0,2,0,0,0,0|2,0,0]=4 9404 B13R1.164 Cc1cc(Br)ccc1CC[C@@H](C)O Amb33435304 [0,2,0,0,0,0|2,0,0]=4 9405 B13R1.164 Cc1cc(Br)ccc1CC[C@H](C)N Amb28410161 [0,2,0,0,0,0|2,0,0]=4 9406 B13R1.164 Cc1cc(Br)ccc1CC[C@H](C)O Amb33435302 [0,2,0,0,0,0|2,0,0]=4 9407 B13R1.164 Cc1cc(Cl)ccc1CCC(C)N Amb25797631 [0,2,0,0,0,0|2,0,0]=4 9408 B13R1.164 Cc1cc(Cl)ccc1CCC(C)O Amb33261472 [0,2,0,0,0,0|2,0,0]=4 9409 B13R1.164 Cc1cc(Cl)ccc1CC[C@@H](C)N Amb33407207 [0,2,0,0,0,0|2,0,0]=4 9410 B13R1.164 Cc1cc(Cl)ccc1CC[C@@H](C)O Amb33261471 [0,2,0,0,0,0|2,0,0]=4 9411 B13R1.164 Cc1cc(Cl)ccc1CC[C@H](C)N Amb24494612 [0,2,0,0,0,0|2,0,0]=4 9412 B13R1.164 Cc1cc(Cl)ccc1CC[C@H](C)O Amb33261916 [0,2,0,0,0,0|2,0,0]=4 9413 B13R1.164 Cc1cc(F)ccc1CCC(C)N Amb24397428 [0,2,0,0,0,0|2,0,0]=4 9414 B13R1.164 Cc1cc(F)ccc1CCC(C)O Amb25923990 [0,2,0,0,0,0|2,0,0]=4 9415 B13R1.164 Cc1cc(F)ccc1CC[C@@H](C)N Amb33359136 [0,2,0,0,0,0|2,0,0]=4 9416 B13R1.164 Cc1cc(F)ccc1CC[C@@H](C)O Amb33374748 [0,2,0,0,0,0|2,0,0]=4 9417 B13R1.164 Cc1cc(F)ccc1CC[C@H](C)N Amb24413812 [0,2,0,0,0,0|2,0,0]=4 9418 B13R1.164 Cc1cc(F)ccc1CC[C@H](C)O Amb33374749 [0,2,0,0,0,0|2,0,0]=4 9419 B13R1.164 Cc1cc(I)ccc1CCC(C)N Amb28187316 [0,2,0,0,0,0|2,0,0]=4 9420 B13R1.164 Cc1cc(O)ccc1CC[C@H](C)N Amb27948787 [0,2,0,0,0,0|2,0,0]=4 9421 B13R1.164 Cc1ccc(CCC(=O)Cl)c(Br)c1 Amb27784740 [0,2,0,0,0,0|2,0,0]=4 9422 B13R1.164 Cc1ccc(CCC(=O)O)c(Br)c1 Amb17204665 [0,2,0,0,0,0|2,0,0]=4 9423 B13R1.164 Cc1ccc(CCC(C)Br)c(Cl)c1 Amb28197937 [0,2,0,0,0,0|1,1,0]=4 9424 B13R1.164 Cc1ccc(CCC(C)N)c(Br)c1 Amb24729706 [0,2,0,0,0,0|1,0,0]=3 9425 B13R1.164 Cc1ccc(CCC(C)N)c(C)c1 Amb18824946 [0,2,0,0,0,0|2,0,0]=4 9426 B13R1.164 Cc1ccc(CCC(C)N)c(Cl)c1 Amb26640292 [0,2,0,0,0,0|1,1,0]=4 9427 B13R1.164 Cc1ccc(CCC(C)N)c(F)c1 Amb25693063 [0,2,0,0,0,0|1,1,0]=4 9428 B13R1.164 Cc1ccc(CCC(C)N)c(O)c1 Amb25798983 [0,2,0,0,0,0|2,0,0]=4 9429 B13R1.164 Cc1ccc(CCC(C)O)c(Br)c1 Amb33386391 [0,2,0,0,0,0|1,0,0]=3 9430 B13R1.164 Cc1ccc(CCC(C)O)c(C)c1 Amb24493702 [0,2,0,0,0,0|2,0,0]=4 9431 B13R1.164 Cc1ccc(CCC(C)O)c(Cl)c1 Amb25305186 [0,2,0,0,0,0|1,1,0]=4 9432 B13R1.164 Cc1ccc(CCC(C)O)c(F)c1 Amb33324287 [0,2,0,0,0,0|1,1,0]=4 9433 B13R1.164 Cc1ccc(CCC(C)O)c(O)c1 Amb33426031 [0,2,0,0,0,0|2,0,0]=4 9434 B13R1.164 Cc1ccc(CCN(C)N)c(C)c1 Amb18065803 [0,2,0,0,0,0|1,0,0]=3 9435 B13R1.164 Cc1ccc(CC[C@@H](C)N)c(Br)c1 Amb33430080 [0,2,0,0,0,0|1,0,0]=3 9436 B13R1.164 Cc1ccc(CC[C@@H](C)N)c(C)c1 Amb33079305 [0,2,0,0,0,0|2,0,0]=4 9437 B13R1.164 Cc1ccc(CC[C@@H](C)N)c(Cl)c1 Amb33390579 [0,2,0,0,0,0|1,1,0]=4 9438 B13R1.164 Cc1ccc(CC[C@@H](C)N)c(F)c1 Amb33448589 [0,2,0,0,0,0|1,1,0]=4 9439 B13R1.164 Cc1ccc(CC[C@@H](C)N)c(O)c1 Amb27460197 [0,2,0,0,0,0|2,0,0]=4 9440 B13R1.164 Cc1ccc(CC[C@@H](C)O)c(Br)c1 Amb33386401 [0,2,0,0,0,0|1,0,0]=3 9441 B13R1.164 Cc1ccc(CC[C@@H](C)O)c(C)c1 Amb33312637 [0,2,0,0,0,0|2,0,0]=4 9442 B13R1.164 Cc1ccc(CC[C@@H](C)O)c(Cl)c1 Amb33058507 [0,2,0,0,0,0|1,1,0]=4 9443 B13R1.164 Cc1ccc(CC[C@@H](C)O)c(F)c1 Amb33323332 [0,2,0,0,0,0|1,1,0]=4 9444 B13R1.164 Cc1ccc(CC[C@@H](C)O)c(O)c1 Amb33426029 [0,2,0,0,0,0|2,0,0]=4 9445 B13R1.164 Cc1ccc(CC[C@H](C)N)c(Br)c1 Amb26611370 [0,2,0,0,0,0|1,0,0]=3 9446 B13R1.164 Cc1ccc(CC[C@H](C)N)c(C)c1 Amb24494737 [0,2,0,0,0,0|2,0,0]=4 9447 B13R1.164 Cc1ccc(CC[C@H](C)N)c(Cl)c1 Amb24494602 [0,2,0,0,0,0|1,1,0]=4 9448 B13R1.164 Cc1ccc(CC[C@H](C)N)c(F)c1 Amb24492338 [0,2,0,0,0,0|1,1,0]=4 9449 B13R1.164 Cc1ccc(CC[C@H](C)N)c(O)c1 Amb27961397 [0,2,0,0,0,0|2,0,0]=4 9450 B13R1.164 Cc1ccc(CC[C@H](C)O)c(Br)c1 Amb33386395 [0,2,0,0,0,0|1,0,0]=3 9451 B13R1.164 Cc1ccc(CC[C@H](C)O)c(C)c1 Amb33312638 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.164 Cc1ccc(CC[C@H](C)O)c(Cl)c1 Amb33221608 [0,2,0,0,0,0|1,1,0]=4 9453 B13R1.164 Cc1ccc(CC[C@H](C)O)c(F)c1 Amb33323333 [0,2,0,0,0,0|1,1,0]=4 9454 B13R1.164 Cc1ccc(CC[C@H](C)O)c(O)c1 Amb33426030 [0,2,0,0,0,0|2,0,0]=4 9455 B13R1.164 Cc1ccc(CC[N+](=O)[O-])c(Br)c1 Amb33241006 [0,2,0,0,0,0|1,0,1]=4 9456 B13R1.164 Cc1ccc(CNC(C)C)c(Br)c1 Amb26478174 [0,2,0,0,0,0|2,0,0]=4 9457 B13R1.164 Cc1ccc(NCC(C)C)c(Br)c1 Amb6688222 [0,2,0,0,0,0|2,0,0]=4 9458 B13R1.164 Cc1ccc(NCC(C)N)c(Br)c1 Amb26448687 [0,2,0,0,0,0|2,0,0]=4 9459 B13R1.164 Cc1ccc(NCC(C)O)c(Br)c1 Amb17159565 [0,2,0,0,0,0|2,0,0]=4 9460 B13R1.164 Cc1ccc(OCC(C)C)c(Br)c1 Amb6717094 [0,2,0,0,0,0|2,0,0]=4 9461 B13R1.164 Cc1ccc(OCC(C)N)c(Br)c1 Amb27444923 [0,2,0,0,0,0|2,0,0]=4 9462 B13R1.164 Cc1ccc(OC[C@@H](C)N)c(Br)c1 Amb29850618 [0,2,0,0,0,0|2,0,0]=4 9463 B13R1.164 Cc1ccc(OC[C@H](C)N)c(Br)c1 Amb29850617 [0,2,0,0,0,0|2,0,0]=4 9464 B13R1.164 Cc1ccc(OC[C@H](C)O)c(Br)c1 Amb27398995 [0,2,0,0,0,0|2,0,0]=4 9465 B13R1.164 Cc1ccc(\N=C\N(C)C)c(Br)c1 Amb27804714 [0,2,0,0,0,0|1,0,1]=4 9466 B13R1.164 O=C(O)CCc1ccc(Br)cc1Br Amb24331873 [0,2,0,0,0,0|2,0,0]=4 9467 B13R1.164 O=C(O)CCc1ccc(Cl)cc1Br Amb24350628 [0,2,0,0,0,0|2,0,0]=4 9468 B13R1.164 O=C(O)CCc1ccc(F)cc1Br Amb9384328 [0,2,0,0,0,0|2,0,0]=4 9469 B13R1.164 O=C(O)CCc1ccc(I)cc1Br Amb26468162 [0,2,0,0,0,0|2,0,0]=4 9470 B13R1.164 O=C(O)CCc1ccc(O)cc1Br Amb27794397 [0,2,0,0,0,0|2,0,0]=4 9471 B13R1.164 O=C(O)CCc1ccc(S)cc1Br Amb27613909 [0,2,0,0,0,0|2,0,0]=4 9472 B13R1.164 O=[N+]([O-])CCc1ccc(Cl)cc1Br Amb33450766 [0,2,0,0,0,0|1,0,1]=4 9473 B13R1.164 O=[N+]([O-])CCc1ccc(F)cc1Br Amb10067816 [0,2,0,0,0,0|1,0,1]=4 9474 B13R1.369 C#CCCNc1ccc(F)cc1Br Amb27226221 [0,2,0,0,0,0|1,0,1]=4 9475 B13R1.369 C#CCCOc1ccc(Br)cc1Br Amb28255394 [0,2,0,0,0,0|1,0,1]=4 9476 B13R1.369 C=CCCNc1ccc(F)cc1Br Amb27984485 [0,2,0,0,0,0|1,0,1]=4 9477 B13R1.369 CC#CCOc1ccc(Cl)cc1Br Amb28454623 [0,2,0,0,0,0|1,0,1]=4 9478 B13R1.369 CC#CCOc1ccc(F)cc1Br Amb27187289 [0,2,0,0,0,0|1,0,1]=4 9479 B13R1.369 CC#CCSc1ccc(N)cc1Br Amb27470360 [0,2,0,0,0,0|1,0,1]=4 9480 B13R1.369 CCCCCc1ccc(C)cc1O Amb10070426 [0,2,0,0,0,0|2,0,0]=4 9481 B13R1.369 CCCCNc1ccc(Br)cc1C Amb6690048 [0,2,0,0,0,0|2,0,0]=4 9482 B13R1.369 CCCCNc1ccc(Br)cc1N Amb7767731 [0,2,0,0,0,0|2,0,0]=4 9483 B13R1.369 CCCCNc1ccc(C)cc1Br Amb6688270 [0,2,0,0,0,0|1,0,0]=3 9484 B13R1.369 CCCCNc1ccc(C)cc1C Amb4313693 [0,2,0,0,0,0|2,0,0]=4 9485 B13R1.369 CCCCNc1ccc(C)cc1F Amb7760226 [0,2,0,0,0,0|1,1,0]=4 9486 B13R1.369 CCCCNc1ccc(C)cc1N Amb9002782 [0,2,0,0,0,0|2,0,0]=4 9487 B13R1.369 CCCCNc1ccc(Cl)cc1C Amb6649651 [0,2,0,0,0,0|2,0,0]=4 9488 B13R1.369 CCCCNc1ccc(Cl)cc1Cl Amb6638956 [0,2,0,0,0,0|1,1,0]=4 9489 B13R1.369 CCCCNc1ccc(Cl)cc1F Amb9226384 [0,2,0,0,0,0|1,1,0]=4 9490 B13R1.369 CCCCNc1ccc(Cl)cc1N Amb7767738 [0,2,0,0,0,0|2,0,0]=4 9491 B13R1.369 CCCCNc1ccc(F)cc1Br Amb7773056 [0,2,0,0,0,0|1,0,0]=3 9492 B13R1.369 CCCCNc1ccc(F)cc1C Amb6699662 [0,2,0,0,0,0|2,0,0]=4 9493 B13R1.369 CCCCNc1ccc(F)cc1Cl Amb7760054 [0,2,0,0,0,0|1,1,0]=4 9494 B13R1.369 CCCCNc1ccc(F)cc1F Amb6698330 [0,2,0,0,0,0|1,1,0]=4 9495 B13R1.369 CCCCNc1ccc(I)cc1Br Amb27983404 [0,2,0,0,0,0|1,0,0]=3 9496 B13R1.369 CCCCNc1ccc(I)cc1C Amb9226201 [0,2,0,0,0,0|2,0,0]=4 9497 B13R1.369 CCCCNc1ccc(I)cc1F Amb35597045 [0,2,0,0,0,0|1,1,0]=4 9498 B13R1.369 CCCCNc1ccc(N)cc1Br Amb26492094 [0,2,0,0,0,0|1,0,0]=3 9499 B13R1.369 CCCCNc1ccc(N)cc1C Amb9215096 [0,2,0,0,0,0|2,0,0]=4 9500 B13R1.369 CCCCNc1ccc(N)cc1I Amb27260651 [0,2,0,0,0,0|1,1,0]=4 9501 B13R1.369 CCCCNc1ccc(O)cc1C Amb27187304 [0,2,0,0,0,0|2,0,0]=4 9502 B13R1.369 CCCCNc1ccc(O)cc1Cl Amb35735285 [0,2,0,0,0,0|1,1,0]=4 9503 B13R1.369 CCCCNc1ncc(C)cc1Br Amb18869110 [0,2,0,0,0,0|2,0,0]=4 9504 B13R1.369 CCCCNc1ncc(N)cc1Br Amb17213696 [0,2,0,0,0,0|2,0,0]=4 9505 B13R1.369 CCCCOc1ccc(Br)cc1Cl Amb22490163 [0,2,0,0,0,0|1,1,0]=4 9506 B13R1.369 CCCCOc1ccc(Br)cc1F Amb22490061 [0,2,0,0,0,0|1,1,0]=4 9507 B13R1.369 CCCCOc1ccc(Br)cc1N Amb8895017 [0,2,0,0,0,0|2,0,0]=4 9508 B13R1.369 CCCCOc1ccc(C)cc1Br Amb6717104 [0,2,0,0,0,0|1,0,0]=3 9509 B13R1.369 CCCCOc1ccc(C)cc1N Amb840317 [0,2,0,0,0,0|2,0,0]=4 9510 B13R1.369 CCCCOc1ccc(Cl)cc1N Amb840195 [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.369 CCCCOc1ccc(F)cc1Br Amb6665093 [0,2,0,0,0,0|1,0,0]=3 9512 B13R1.369 CCCCOc1ccc(F)cc1N Amb8895015 [0,2,0,0,0,0|2,0,0]=4 9513 B13R1.369 CCCCOc1ccc(I)cc1N Amb33035517 [0,2,0,0,0,0|2,0,0]=4 9514 B13R1.369 CCCCOc1ccc(N)cc1Br Amb33035460 [0,2,0,0,0,0|1,0,0]=3 9515 B13R1.369 CCCCOc1ccc(N)cc1C Amb8895010 [0,2,0,0,0,0|2,0,0]=4 9516 B13R1.369 CCCCOc1ccc(N)cc1Cl Amb1141055 [0,2,0,0,0,0|1,1,0]=4 9517 B13R1.369 CCCCOc1ccc(N)cc1F Amb8886525 [0,2,0,0,0,0|1,1,0]=4 9518 B13R1.369 CCCCOc1ccc(N)cc1I Amb33035561 [0,2,0,0,0,0|1,1,0]=4 9519 B13R1.369 CCCCOc1ncc(N)cc1Br Amb33035521 [0,2,0,0,0,0|2,0,0]=4 9520 B13R1.369 CCCNCc1ccc(Br)cc1Cl Amb9671953 [0,2,0,0,0,0|1,1,0]=4 9521 B13R1.369 CCCNCc1ccc(Br)cc1F Amb8841250 [0,2,0,0,0,0|1,1,0]=4 9522 B13R1.369 CCCNCc1ccc(C)cc1Br Amb33442030 [0,2,0,0,0,0|1,0,0]=3 9523 B13R1.369 CCCNCc1ccc(C)cc1C Amb6284622 [0,2,0,0,0,0|2,0,0]=4 9524 B13R1.369 CCCNCc1ccc(Cl)cc1Br Amb33441952 [0,2,0,0,0,0|1,0,0]=3 9525 B13R1.369 CCCNCc1ccc(Cl)cc1Cl Amb1846421 [0,2,0,0,0,0|1,1,0]=4 9526 B13R1.369 CCCNCc1ccc(Cl)cc1Cl Amb19890390 [0,2,0,0,0,0|1,1,0]=4 9527 B13R1.369 CCCNCc1ccc(F)cc1C Amb18796469 [0,2,0,0,0,0|2,0,0]=4 9528 B13R1.369 CCCNCc1ccc(F)cc1F Amb6257265 [0,2,0,0,0,0|1,1,0]=4 9529 B13R1.369 CCNCCc1ccc(C)cc1C Amb17400634 [0,2,0,0,0,0|1,0,0]=3 9530 B13R1.369 CCNCCc1ccc(Cl)cc1Cl Amb5785547 [0,2,0,0,0,0|0,1,0]=3 9531 B13R1.369 CNCC#Cc1ccc(C)cc1C Amb27163472 [0,2,0,0,0,0|1,0,1]=4 9532 B13R1.369 CNCCCc1ccc(Br)cc1C Amb18071381 [0,2,0,0,0,0|1,0,0]=3 9533 B13R1.369 CNCCCc1ccc(C)cc1Br Amb18071370 [0,2,0,0,0,0|0,0,0]=2 9534 B13R1.369 CNCCCc1ccc(C)cc1C Amb17400635 [0,2,0,0,0,0|1,0,0]=3 9535 B13R1.369 CNCCCc1ccc(Cl)cc1C Amb18066470 [0,2,0,0,0,0|1,0,0]=3 9536 B13R1.369 CNCCCc1ccc(Cl)cc1Cl Amb17404908 [0,2,0,0,0,0|0,1,0]=3 9537 B13R1.369 CNCCCc1ccc(F)cc1C Amb23442795 [0,2,0,0,0,0|1,0,0]=3 9538 B13R1.369 CNCCCc1ccc(F)cc1F Amb19025800 [0,2,0,0,0,0|0,1,0]=3 9539 B13R1.369 CNCCNc1ncc(Br)cc1Br Amb27470594 [0,2,0,0,0,0|1,0,0]=3 9540 B13R1.369 CNCCNc1ncc(Cl)cc1C Amb35676519 [0,2,0,0,0,0|2,0,0]=4 9541 B13R1.369 CNCCOc1ccc(Br)cc1C Amb10608688 [0,2,0,0,0,0|1,0,0]=3 9542 B13R1.369 CNCCOc1ccc(C)cc1Br Amb22588053 [0,2,0,0,0,0|0,0,0]=2 9543 B13R1.369 CNCCOc1ccc(C)cc1C Amb7761782 [0,2,0,0,0,0|1,0,0]=3 9544 B13R1.369 CNCCOc1ccc(C)cc1Cl Amb10608728 [0,2,0,0,0,0|0,1,0]=3 9545 B13R1.369 CNCCOc1ccc(Cl)cc1Br Amb7760956 [0,2,0,0,0,0|0,0,0]=2 9546 B13R1.369 CNCCOc1ccc(Cl)cc1C Amb7798620 [0,2,0,0,0,0|1,0,0]=3 9547 B13R1.369 CNCCOc1ccc(Cl)cc1Cl Amb7760945 [0,2,0,0,0,0|0,1,0]=3 9548 B13R1.369 CNCCOc1ccc(F)cc1Br Amb7798761 [0,2,0,0,0,0|0,0,0]=2 9549 B13R1.369 CNCCOc1ccc(F)cc1Cl Amb17139934 [0,2,0,0,0,0|0,1,0]=3 9550 B13R1.369 CNCCOc1ccc(F)cc1F Amb32662268 [0,2,0,0,0,0|0,1,0]=3 9551 B13R1.369 CNCCOc1ccc(F)cc1F Amb7798675 [0,2,0,0,0,0|0,1,0]=3 9552 B13R1.369 CNC\C=C\c1ccc(Br)cc1Cl Amb27806098 [0,2,0,0,0,0|0,1,1]=4 9553 B13R1.369 CNC\C=C\c1ccc(C)cc1C Amb24490002 [0,2,0,0,0,0|1,0,1]=4 9554 B13R1.369 CNC\C=C\c1ccc(C)cc1Cl Amb29867593 [0,2,0,0,0,0|0,1,1]=4 9555 B13R1.369 CNC\C=C\c1ccc(Cl)cc1Cl Amb23442859 [0,2,0,0,0,0|0,1,1]=4 9556 B13R1.369 CNC\C=C\c1ccc(F)cc1F Amb23442754 [0,2,0,0,0,0|0,1,1]=4 9557 B13R1.369 COCCNc1ccc(Br)cc1C Amb6709105 [0,2,0,0,0,0|2,0,0]=4 9558 B13R1.369 COCCNc1ccc(Br)cc1N Amb9205200 [0,2,0,0,0,0|2,0,0]=4 9559 B13R1.369 COCCNc1ccc(C)cc1Br Amb6708148 [0,2,0,0,0,0|1,0,0]=3 9560 B13R1.369 COCCNc1ccc(C)cc1C Amb6706781 [0,2,0,0,0,0|2,0,0]=4 9561 B13R1.369 COCCNc1ccc(C)cc1N Amb8860044 [0,2,0,0,0,0|2,0,0]=4 9562 B13R1.369 COCCNc1ccc(Cl)cc1Br Amb27466136 [0,2,0,0,0,0|1,0,0]=3 9563 B13R1.369 COCCNc1ccc(Cl)cc1C Amb17139787 [0,2,0,0,0,0|2,0,0]=4 9564 B13R1.369 COCCNc1ccc(Cl)cc1F Amb26325812 [0,2,0,0,0,0|1,1,0]=4 9565 B13R1.369 COCCNc1ccc(Cl)cc1N Amb9205205 [0,2,0,0,0,0|2,0,0]=4 9566 B13R1.369 COCCNc1ccc(F)cc1C Amb6713502 [0,2,0,0,0,0|2,0,0]=4 9567 B13R1.369 COCCNc1ccc(I)cc1Br Amb28120498 [0,2,0,0,0,0|1,0,0]=3 9568 B13R1.369 COCCNc1ccc(I)cc1Cl Amb28140994 [0,2,0,0,0,0|1,1,0]=4 9569 B13R1.369 COCCNc1ccc(I)cc1F Amb35597048 [0,2,0,0,0,0|1,1,0]=4 9570 B13R1.369 COCCNc1ccc(I)cc1N Amb27180766 [0,2,0,0,0,0|2,0,0]=4 9571 B13R1.369 COCCNc1ccc(N)cc1Cl Amb9205204 [0,2,0,0,0,0|1,1,0]=4 9572 B13R1.369 COCCNc1ccc(N)cc1I Amb27260650 [0,2,0,0,0,0|1,1,0]=4 9573 B13R1.369 COCCNc1ccc(O)cc1Cl Amb35735288 [0,2,0,0,0,0|1,1,0]=4 9574 B13R1.369 COCCNc1ncc(C)cc1Br Amb18873506 [0,2,0,0,0,0|2,0,0]=4 9575 B13R1.369 COCCNc1ncc(N)cc1Br Amb17213717 [0,2,0,0,0,0|2,0,0]=4 9576 B13R1.369 COCCOc1ccc(Br)cc1Br Amb22001109 [0,2,0,0,0,0|1,0,0]=3 9577 B13R1.369 COCCOc1ccc(Br)cc1F Amb22301510 [0,2,0,0,0,0|1,1,0]=4 9578 B13R1.369 COCCOc1ccc(Br)cc1N Amb6676237 [0,2,0,0,0,0|2,0,0]=4 9579 B13R1.369 COCCOc1ccc(C)cc1Br Amb6717088 [0,2,0,0,0,0|1,0,0]=3 9580 B13R1.369 COCCOc1ccc(C)cc1N Amb840329 [0,2,0,0,0,0|2,0,0]=4 9581 B13R1.369 COCCOc1ccc(Cl)cc1Br Amb17271956 [0,2,0,0,0,0|1,0,0]=3 9582 B13R1.369 COCCOc1ccc(Cl)cc1N Amb6336196 [0,2,0,0,0,0|2,0,0]=4 9583 B13R1.369 COCCOc1ccc(F)cc1Br Amb6263406 [0,2,0,0,0,0|1,0,0]=3 9584 B13R1.369 COCCOc1ccc(F)cc1Cl Amb34048720 [0,2,0,0,0,0|1,1,0]=4 9585 B13R1.369 COCCOc1ccc(F)cc1N Amb6679922 [0,2,0,0,0,0|2,0,0]=4 9586 B13R1.369 COCCOc1ccc(I)cc1N Amb33035481 [0,2,0,0,0,0|2,0,0]=4 9587 B13R1.369 COCCOc1ccc(N)cc1Br Amb32411599 [0,2,0,0,0,0|1,0,0]=3 9588 B13R1.369 COCCOc1ccc(N)cc1C Amb9215129 [0,2,0,0,0,0|2,0,0]=4 9589 B13R1.369 COCCOc1ccc(N)cc1Cl Amb840169 [0,2,0,0,0,0|1,1,0]=4 9590 B13R1.369 COCCOc1ccc(N)cc1F Amb7783457 [0,2,0,0,0,0|1,1,0]=4 9591 B13R1.369 COCCOc1ccc(N)cc1I Amb33035558 [0,2,0,0,0,0|1,1,0]=4 9592 B13R1.369 COCCOc1ccc(N)cc1O Amb24070995 [0,2,0,0,0,0|2,0,0]=4 9593 B13R1.369 COCCOc1ncc(N)cc1Br Amb33035563 [0,2,0,0,0,0|2,0,0]=4 9594 B13R1.369 CSCCNc1ccc(Br)cc1Br Amb27754240 [0,2,0,0,0,0|1,0,0]=3 9595 B13R1.369 CSCCNc1ccc(Br)cc1Cl Amb27414693 [0,2,0,0,0,0|1,1,0]=4 9596 B13R1.369 CSCCNc1ccc(Br)cc1F Amb27597725 [0,2,0,0,0,0|1,1,0]=4 9597 B13R1.369 CSCCNc1ccc(Br)cc1N Amb27589984 [0,2,0,0,0,0|2,0,0]=4 9598 B13R1.369 CSCCNc1ccc(C)cc1F Amb27402375 [0,2,0,0,0,0|1,1,0]=4 9599 B13R1.369 CSCCNc1ccc(Cl)cc1F Amb27765087 [0,2,0,0,0,0|1,1,0]=4 9600 B13R1.369 CSCCNc1ccc(Cl)cc1N Amb27244424 [0,2,0,0,0,0|2,0,0]=4 9601 B13R1.369 CSCCNc1ccc(F)cc1Br Amb27238388 [0,2,0,0,0,0|1,0,0]=3 9602 B13R1.369 CSCCNc1ccc(F)cc1I Amb28140347 [0,2,0,0,0,0|1,1,0]=4 9603 B13R1.369 CSCCNc1ccc(I)cc1F Amb35589478 [0,2,0,0,0,0|1,1,0]=4 9604 B13R1.369 CSCCNc1ncc(C)cc1Br Amb28317003 [0,2,0,0,0,0|2,0,0]=4 9605 B13R1.369 CSCCNc1ncc(Cl)cc1Br Amb27464963 [0,2,0,0,0,0|2,0,0]=4 9606 B13R1.369 C\C=C\CNc1ccc(Cl)cc1Br Amb27198572 [0,2,0,0,0,0|1,0,1]=4 9607 B13R1.369 C\C=C\COc1ccc(C)cc1Br Amb4012893 [0,2,0,0,0,0|1,0,1]=4 9608 B13R1.369 C\C=C\COc1ccc(Cl)cc1Br Amb27761313 [0,2,0,0,0,0|1,0,1]=4 9609 B13R1.369 C\C=C\CSc1ccc(N)cc1Br Amb27453041 [0,2,0,0,0,0|1,0,1]=4 9610 B13R1.369 Cc1cc(Br)ccc1CCCCN Amb18071383 [0,2,0,0,0,0|2,0,0]=4 9611 B13R1.369 Cc1cc(Cl)ccc1CCCCN Amb18066471 [0,2,0,0,0,0|2,0,0]=4 9612 B13R1.369 Cc1cc(Cl)ccc1OCCNN Amb17402388 [0,2,0,0,0,0|2,0,0]=4 9613 B13R1.369 Cc1cc(Cl)ccc1OCCNO Amb17088465 [0,2,0,0,0,0|2,0,0]=4 9614 B13R1.369 Cc1cc(F)ccc1CCCCN Amb33079935 [0,2,0,0,0,0|2,0,0]=4 9615 B13R1.369 Cc1ccc(CCCC=O)c(Br)c1 Amb33386392 [0,2,0,0,0,0|1,0,1]=4 9616 B13R1.369 Cc1ccc(CCCCN)c(Br)c1 Amb18071373 [0,2,0,0,0,0|1,0,0]=3 9617 B13R1.369 Cc1ccc(CCCCN)c(C)c1 Amb17194518 [0,2,0,0,0,0|2,0,0]=4 9618 B13R1.369 Cc1ccc(CCCCN)c(Cl)c1 Amb33406927 [0,2,0,0,0,0|1,1,0]=4 9619 B13R1.369 Cc1ccc(CCCCN)c(F)c1 Amb33324278 [0,2,0,0,0,0|1,1,0]=4 9620 B13R1.369 Cc1ccc(CCCCN)c(O)c1 Amb33425619 [0,2,0,0,0,0|2,0,0]=4 9621 B13R1.369 Cc1ccc(CCCCO)c(C)c1 Amb17194527 [0,2,0,0,0,0|2,0,0]=4 9622 B13R1.369 Cc1ccc(CCCCS)c(C)c1 Amb17401983 [0,2,0,0,0,0|2,0,0]=4 9623 B13R1.369 Cc1ccc(CCN=[N+]=[N-])c(Br)c1 Amb33387494 [0,2,0,0,0,0|1,0,1]=4 9624 B13R1.369 Cc1ccc(CNCCO)c(Br)c1 Amb33442052 [0,2,0,0,0,0|2,0,0]=4 9625 B13R1.369 Cc1ccc(NCCC#N)c(Br)c1 Amb9202495 [0,2,0,0,0,0|2,0,0]=4 9626 B13R1.369 Cc1ccc(NCCCF)c(Br)c1 Amb27832801 [0,2,0,0,0,0|2,0,0]=4 9627 B13R1.369 Cc1ccc(NCCCN)c(Br)c1 Amb27863113 [0,2,0,0,0,0|2,0,0]=4 9628 B13R1.369 Cc1ccc(NCCCO)c(Br)c1 Amb17349682 [0,2,0,0,0,0|2,0,0]=4 9629 B13R1.369 Cc1ccc(OCCC#N)c(Br)c1 Amb6717165 [0,2,0,0,0,0|2,0,0]=4 9630 B13R1.369 Cc1ccc(OCCCN)c(Br)c1 Amb6717177 [0,2,0,0,0,0|2,0,0]=4 9631 B13R1.369 Cc1ccc(OCCNN)c(C)c1 Amb17400832 [0,2,0,0,0,0|2,0,0]=4 9632 B13R1.369 Cc1ccc(OCCNO)c(C)c1 Amb17088443 [0,2,0,0,0,0|2,0,0]=4 9633 B13R1.369 Fc1ccc(CCCCS)c(F)c1 Amb18566553 [0,2,0,0,0,0|1,1,0]=4 9634 B13R1.369 Fc1ccc(OCCCBr)c(Br)c1 Amb8828195 [0,2,0,0,0,0|2,0,0]=4 9635 B13R1.369 N#CCCCc1ccc(F)cc1Br Amb27640038 [0,2,0,0,0,0|1,0,1]=4 9636 B13R1.369 N#CCCOc1ccc(Cl)cc1Br Amb6275590 [0,2,0,0,0,0|2,0,0]=4 9637 B13R1.369 N#CNCCc1ccc(Cl)cc1Cl Amb27669576 [0,2,0,0,0,0|0,1,1]=4 9638 B13R1.369 NCCCCc1ccc(Br)cc1Cl Amb33451776 [0,2,0,0,0,0|1,1,0]=4 9639 B13R1.369 NCCCCc1ccc(Br)cc1F Amb33451810 [0,2,0,0,0,0|1,1,0]=4 9640 B13R1.369 NCCCCc1ccc(Br)cc1O Amb33389639 [0,2,0,0,0,0|2,0,0]=4 9641 B13R1.369 NCCCCc1ccc(Cl)cc1Br Amb33430073 [0,2,0,0,0,0|1,0,0]=3 9642 B13R1.369 NCCCCc1ccc(Cl)cc1Cl Amb18049819 [0,2,0,0,0,0|1,1,0]=4 9643 B13R1.369 NCCCCc1ccc(Cl)cc1F Amb33407346 [0,2,0,0,0,0|1,1,0]=4 9644 B13R1.369 NCCCCc1ccc(Cl)cc1O Amb33261922 [0,2,0,0,0,0|2,0,0]=4 9645 B13R1.369 NCCCCc1ccc(F)cc1Br Amb33451384 [0,2,0,0,0,0|1,0,0]=3 9646 B13R1.369 NCCCCc1ccc(F)cc1Cl Amb33261408 [0,2,0,0,0,0|1,1,0]=4 9647 B13R1.369 NCCCCc1ccc(F)cc1F Amb18066163 [0,2,0,0,0,0|1,1,0]=4 9648 B13R1.369 NCCCCc1ccc(O)cc1Cl Amb33056606 [0,2,0,0,0,0|1,1,0]=4 9649 B13R1.369 NCCCCc1ccc(O)cc1F Amb33376533 [0,2,0,0,0,0|1,1,0]=4 9650 B13R1.369 NCCCCc1ccc(O)cc1O Amb33269275 [0,2,0,0,0,0|2,0,0]=4 9651 B13R1.369 NCCCNc1ccc(Cl)cc1Br Amb27162781 [0,2,0,0,0,0|2,0,0]=4 9652 B13R1.369 NCCCNc1ccc(F)cc1Br Amb27407437 [0,2,0,0,0,0|2,0,0]=4 9653 B13R1.369 NCCCOc1ccc(Cl)cc1Br Amb6274123 [0,2,0,0,0,0|2,0,0]=4 9654 B13R1.369 NCCCOc1ccc(F)cc1Br Amb6258582 [0,2,0,0,0,0|2,0,0]=4 9655 B13R1.369 NNCCOc1ccc(Cl)cc1Cl Amb17405673 [0,2,0,0,0,0|1,1,0]=4 9656 B13R1.369 NNCCOc1ccc(F)cc1Cl Amb17402972 [0,2,0,0,0,0|1,1,0]=4 9657 B13R1.369 NNCCOc1ccc(F)cc1F Amb17401156 [0,2,0,0,0,0|1,1,0]=4 9658 B13R1.369 Nc1ccc(NCCCF)c(Br)c1 Amb27777745 [0,2,0,0,0,0|2,0,0]=4 9659 B13R1.369 Nc1ccc(OCCCO)c(Br)c1 Amb33035438 [0,2,0,0,0,0|2,0,0]=4 9660 B13R1.369 O=C=NCCc1ccc(Cl)cc1Br Amb33478013 [0,2,0,0,0,0|0,0,2]=4 9661 B13R1.369 O=C=NCCc1ccc(F)cc1Br Amb33336215 [0,2,0,0,0,0|0,0,2]=4 9662 B13R1.369 O=CCCCc1ccc(Cl)cc1Br Amb33450999 [0,2,0,0,0,0|1,0,1]=4 9663 B13R1.369 O=CCCCc1ccc(F)cc1Br Amb33452257 [0,2,0,0,0,0|1,0,1]=4 9664 B13R1.369 O=CCCOc1ccc(Cl)cc1Br Amb17099963 [0,2,0,0,0,0|2,0,0]=4 9665 B13R1.369 O=CNCCc1ccc(F)cc1F Amb27210978 [0,2,0,0,0,0|0,1,1]=4 9666 B13R1.369 OCCCCc1ccc(Cl)cc1Cl Amb34912532 [0,2,0,0,0,0|1,1,0]=4 9667 B13R1.369 OCCCCc1ccc(F)cc1F Amb18863160 [0,2,0,0,0,0|1,1,0]=4 9668 B13R1.369 OCCNCc1ccc(Cl)cc1Br Amb33441959 [0,2,0,0,0,0|2,0,0]=4 9669 B13R1.369 ONCCOc1ccc(Cl)cc1Cl Amb17088472 [0,2,0,0,0,0|1,1,0]=4 9670 B13R1.369 ONCCOc1ccc(F)cc1Cl Amb17088468 [0,2,0,0,0,0|1,1,0]=4 9671 B13R1.369 ONCCOc1ccc(F)cc1F Amb17088463 [0,2,0,0,0,0|1,1,0]=4 9672 B13R1.369 [N-]=[N+]=NCCc1ccc(Cl)cc1Br Amb33478802 [0,2,0,0,0,0|1,0,1]=4 9673 B13R1.369 [N-]=[N+]=NCCc1ccc(F)cc1Br Amb33334173 [0,2,0,0,0,0|1,0,1]=4 9674 B13R1.1511 C#CCC(N)c1ccc(Br)cc1Br Amb27803631 [0,2,0,0,0,0|1,0,1]=4 9675 B13R1.1511 C#CCC(N)c1ccc(Cl)cc1Br Amb27265474 [0,2,0,0,0,0|1,0,1]=4 9676 B13R1.1511 C#CCC(O)c1ccc(Br)cc1Br Amb27205878 [0,2,0,0,0,0|1,0,1]=4 9677 B13R1.1511 C#CCC(O)c1ccc(Cl)cc1Br Amb28286035 [0,2,0,0,0,0|1,0,1]=4 9678 B13R1.1511 C#CCC(O)c1ccc(N)cc1Br Amb27635657 [0,2,0,0,0,0|1,0,1]=4 9679 B13R1.1511 C=CCC(N)c1ccc(N)cc1Br Amb27234898 [0,2,0,0,0,0|1,0,1]=4 9680 B13R1.1511 C=CC[C@@H](N)c1ccc(C)cc1Br Amb27606409 [0,2,0,0,0,0|1,0,1]=4 9681 B13R1.1511 C=CC[C@@H](N)c1ccc(O)cc1Br Amb28136837 [0,2,0,0,0,0|1,0,1]=4 9682 B13R1.1511 CC(CCN)c1ccc(Cl)cc1Br Amb33450944 [0,2,0,0,0,0|2,0,0]=4 9683 B13R1.1511 CC(CCN)c1ccc(F)cc1Br Amb33336202 [0,2,0,0,0,0|2,0,0]=4 9684 B13R1.1511 CC(CON)c1ccc(Cl)cc1Br Amb33478353 [0,2,0,0,0,0|2,0,0]=4 9685 B13R1.1511 CC(CON)c1ccc(F)cc1Br Amb33336577 [0,2,0,0,0,0|2,0,0]=4 9686 B13R1.1511 CCCC(=O)c1ccc(Br)cc1Br Amb28317192 [0,2,0,0,0,0|1,0,1]=4 9687 B13R1.1511 CCCC(=O)c1ccc(C)cc1Br Amb17348644 [0,2,0,0,0,0|1,0,1]=4 9688 B13R1.1511 CCCC(=O)c1ccc(Cl)cc1Br Amb28317496 [0,2,0,0,0,0|1,0,1]=4 9689 B13R1.1511 CCCC(=O)c1ccc(N)cc1Br Amb27451787 [0,2,0,0,0,0|1,0,1]=4 9690 B13R1.1511 CCCC(C)c1ccc(F)cc1O Amb28199960 [0,2,0,0,0,0|2,0,0]=4 9691 B13R1.1511 CCCC(C)c1ccc(O)cc1F Amb27948645 [0,2,0,0,0,0|1,1,0]=4 9692 B13R1.1511 CCCC(Cl)c1ccc(Cl)cc1Cl Amb27833791 [0,2,0,0,0,0|1,1,0]=4 9693 B13R1.1511 CCCC(Cl)c1ccc(Cl)cc1F Amb27589200 [0,2,0,0,0,0|1,1,0]=4 9694 B13R1.1511 CCCC(Cl)c1ccc(F)cc1C Amb27167966 [0,2,0,0,0,0|2,0,0]=4 9695 B13R1.1511 CCCC(N)c1ccc(Br)cc1Cl Amb27813324 [0,2,0,0,0,0|1,1,0]=4 9696 B13R1.1511 CCCC(N)c1ccc(Br)nc1Br Amb27238636 [0,2,0,0,0,0|2,0,0]=4 9697 B13R1.1511 CCCC(N)c1ccc(C)cc1C Amb6705028 [0,2,0,0,0,0|2,0,0]=4 9698 B13R1.1511 CCCC(N)c1ccc(C)cc1Cl Amb22642872 [0,2,0,0,0,0|1,1,0]=4 9699 B13R1.1511 CCCC(N)c1ccc(Cl)cc1Br Amb28241046 [0,2,0,0,0,0|1,0,0]=3 9700 B13R1.1511 CCCC(N)c1ccc(Cl)cc1I Amb27958500 [0,2,0,0,0,0|1,1,0]=4 9701 B13R1.1511 CCCC(N)c1ccc(F)cc1Br Amb27654089 [0,2,0,0,0,0|1,0,0]=3 9702 B13R1.1511 CCCC(N)c1ccc(F)cc1C Amb18796470 [0,2,0,0,0,0|2,0,0]=4 9703 B13R1.1511 CCCC(N)c1ccc(F)cc1F Amb9746075 [0,2,0,0,0,0|1,1,0]=4 9704 B13R1.1511 CCCC(N)c1ccc(N)cc1Br Amb27207157 [0,2,0,0,0,0|1,0,0]=3 9705 B13R1.1511 CCCC(N)c1ccc(N)cc1O Amb27967231 [0,2,0,0,0,0|2,0,0]=4 9706 B13R1.1511 CCCC(N)c1ccc(O)cc1Br Amb27410661 [0,2,0,0,0,0|1,0,0]=3 9707 B13R1.1511 CCCC(N)c1ccc(O)cc1C Amb26440133 [0,2,0,0,0,0|2,0,0]=4 9708 B13R1.1511 CCCC(N)c1ccc(O)cc1F Amb28317758 [0,2,0,0,0,0|1,1,0]=4 9709 B13R1.1511 CCCC(N)c1ccc(O)cc1I Amb28323160 [0,2,0,0,0,0|1,1,0]=4 9710 B13R1.1511 CCCC(N)c1ccc(O)cc1O Amb18275065 [0,2,0,0,0,0|2,0,0]=4 9711 B13R1.1511 CCCC(N)c1ncc(C)cc1Br Amb28128866 [0,2,0,0,0,0|2,0,0]=4 9712 B13R1.1511 CCCC(O)c1ccc(Br)cc1Cl Amb27847408 [0,2,0,0,0,0|1,1,0]=4 9713 B13R1.1511 CCCC(O)c1ccc(Br)cc1F Amb28293301 [0,2,0,0,0,0|1,1,0]=4 9714 B13R1.1511 CCCC(O)c1ccc(Br)cc1N Amb35621633 [0,2,0,0,0,0|2,0,0]=4 9715 B13R1.1511 CCCC(O)c1ccc(C)cc1C Amb17194529 [0,2,0,0,0,0|2,0,0]=4 9716 B13R1.1511 CCCC(O)c1ccc(C)cc1Cl Amb28045156 [0,2,0,0,0,0|1,1,0]=4 9717 B13R1.1511 CCCC(O)c1ccc(C)cc1F Amb28421707 [0,2,0,0,0,0|1,1,0]=4 9718 B13R1.1511 CCCC(O)c1ccc(Cl)cc1C Amb27620341 [0,2,0,0,0,0|2,0,0]=4 9719 B13R1.1511 CCCC(O)c1ccc(F)cc1C Amb18805551 [0,2,0,0,0,0|2,0,0]=4 9720 B13R1.1511 CCCC(O)c1ccc(F)cc1I Amb27594911 [0,2,0,0,0,0|1,1,0]=4 9721 B13R1.1511 CCCC(O)c1ccc(N)cc1Br Amb27792523 [0,2,0,0,0,0|1,0,0]=3 9722 B13R1.1511 CCCC(O)c1ccc(N)cc1Cl Amb27646103 [0,2,0,0,0,0|1,1,0]=4 9723 B13R1.1511 CCC[C@@H](N)c1ccc(Br)cc1Br Amb27250796 [0,2,0,0,0,0|1,0,0]=3 9724 B13R1.1511 CCC[C@@H](N)c1ccc(Br)cc1F Amb28077088 [0,2,0,0,0,0|1,1,0]=4 9725 B13R1.1511 CCC[C@@H](N)c1ccc(C)cc1C Amb27259077 [0,2,0,0,0,0|2,0,0]=4 9726 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1F Amb27972111 [0,2,0,0,0,0|1,1,0]=4 9727 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1I Amb27180857 [0,2,0,0,0,0|1,1,0]=4 9728 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1O Amb28291514 [0,2,0,0,0,0|2,0,0]=4 9729 B13R1.1511 CCC[C@@H](N)c1ccc(F)cc1Cl Amb27177108 [0,2,0,0,0,0|1,1,0]=4 9730 B13R1.1511 CCC[C@@H](N)c1ccc(F)cc1I Amb27800008 [0,2,0,0,0,0|1,1,0]=4 9731 B13R1.1511 CCC[C@@H](N)c1ccc(N)cc1C Amb27803017 [0,2,0,0,0,0|2,0,0]=4 9732 B13R1.1511 CCC[C@@H](N)c1ccc(N)cc1F Amb28316497 [0,2,0,0,0,0|1,1,0]=4 9733 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1C Amb27975728 [0,2,0,0,0,0|2,0,0]=4 9734 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1F Amb27190834 [0,2,0,0,0,0|1,1,0]=4 9735 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1I Amb27608345 [0,2,0,0,0,0|1,1,0]=4 9736 B13R1.1511 CCC[C@@H](N)c1ccc(S)cc1O Amb28457254 [0,2,0,0,0,0|2,0,0]=4 9737 B13R1.1511 CCC[C@@H](N)c1ncc(C)cc1Br Amb27181198 [0,2,0,0,0,0|2,0,0]=4 9738 B13R1.1511 CCC[C@@H](N)c1ncc(Cl)cc1Br Amb27394212 [0,2,0,0,0,0|2,0,0]=4 9739 B13R1.1511 CCC[C@@H](O)c1ccc(Br)cc1C Amb28252319 [0,2,0,0,0,0|2,0,0]=4 9740 B13R1.1511 CCC[C@@H](O)c1ccc(Br)cc1F Amb27472966 [0,2,0,0,0,0|1,1,0]=4 9741 B13R1.1511 CCC[C@H](N)c1ccc(Br)cc1Cl Amb28048837 [0,2,0,0,0,0|1,1,0]=4 9742 B13R1.1511 CCC[C@H](N)c1ccc(Br)nc1Br Amb27608417 [0,2,0,0,0,0|2,0,0]=4 9743 B13R1.1511 CCC[C@H](N)c1ccc(C)cc1C Amb27830657 [0,2,0,0,0,0|2,0,0]=4 9744 B13R1.1511 CCC[C@H](N)c1ccc(C)cc1Cl Amb28254806 [0,2,0,0,0,0|1,1,0]=4 9745 B13R1.1511 CCC[C@H](N)c1ccc(C)cc1N Amb28243358 [0,2,0,0,0,0|2,0,0]=4 9746 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1Br Amb28135400 [0,2,0,0,0,0|1,0,0]=3 9747 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1F Amb27800562 [0,2,0,0,0,0|1,1,0]=4 9748 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1I Amb27392627 [0,2,0,0,0,0|1,1,0]=4 9749 B13R1.1511 CCC[C@H](N)c1ccc(F)cc1O Amb28365970 [0,2,0,0,0,0|2,0,0]=4 9750 B13R1.1511 CCC[C@H](N)c1ccc(I)cc1Cl Amb27809005 [0,2,0,0,0,0|1,1,0]=4 9751 B13R1.1511 CCC[C@H](N)c1ccc(N)cc1O Amb28322850 [0,2,0,0,0,0|2,0,0]=4 9752 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1C Amb28282686 [0,2,0,0,0,0|2,0,0]=4 9753 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1Cl Amb27231679 [0,2,0,0,0,0|1,1,0]=4 9754 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1F Amb27228145 [0,2,0,0,0,0|1,1,0]=4 9755 B13R1.1511 CCC[C@H](O)c1ccc(C)cc1C Amb28243316 [0,2,0,0,0,0|2,0,0]=4 9756 B13R1.1511 CCC[C@H](O)c1ccc(C)cc1F Amb27394324 [0,2,0,0,0,0|1,1,0]=4 9757 B13R1.1511 CCC[C@H](O)c1ccc(F)cc1Cl Amb27493934 [0,2,0,0,0,0|1,1,0]=4 9758 B13R1.1511 CCC[C@H](O)c1ccc(F)cc1F Amb28060049 [0,2,0,0,0,0|1,1,0]=4 9759 B13R1.1511 CCNC(C)c1ccc(Cl)cc1Br Amb27426550 [0,2,0,0,0,0|2,0,0]=4 9760 B13R1.1511 CCNC(C)c1ccc(F)cc1Br Amb27861887 [0,2,0,0,0,0|2,0,0]=4 9761 B13R1.1511 CCNC(C)c1ccc(O)cc1Br Amb27428517 [0,2,0,0,0,0|2,0,0]=4 9762 B13R1.1511 CNCC(=O)c1ccc(Br)cc1C Amb18227884 [0,2,0,0,0,0|1,0,1]=4 9763 B13R1.1511 CNCC(=O)c1ccc(Br)cc1Cl Amb25066509 [0,2,0,0,0,0|0,1,1]=4 9764 B13R1.1511 CNCC(=O)c1ccc(Br)cc1F Amb27495667 [0,2,0,0,0,0|0,1,1]=4 9765 B13R1.1511 CNCC(=O)c1ccc(Br)cc1O Amb33388517 [0,2,0,0,0,0|1,0,1]=4 9766 B13R1.1511 CNCC(=O)c1ccc(C)cc1Br Amb24533505 [0,2,0,0,0,0|0,0,1]=3 9767 B13R1.1511 CNCC(=O)c1ccc(C)cc1C Amb17233281 [0,2,0,0,0,0|1,0,1]=4 9768 B13R1.1511 CNCC(=O)c1ccc(C)cc1Cl Amb27478735 [0,2,0,0,0,0|0,1,1]=4 9769 B13R1.1511 CNCC(=O)c1ccc(C)cc1F Amb25157233 [0,2,0,0,0,0|0,1,1]=4 9770 B13R1.1511 CNCC(=O)c1ccc(C)cc1O Amb25723071 [0,2,0,0,0,0|1,0,1]=4 9771 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1Br Amb27466526 [0,2,0,0,0,0|0,0,1]=3 9772 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1C Amb18224988 [0,2,0,0,0,0|1,0,1]=4 9773 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1Cl Amb17314180 [0,2,0,0,0,0|0,1,1]=4 9774 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1F Amb25327295 [0,2,0,0,0,0|0,1,1]=4 9775 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1O Amb33260069 [0,2,0,0,0,0|1,0,1]=4 9776 B13R1.1511 CNCC(=O)c1ccc(F)cc1Br Amb27953197 [0,2,0,0,0,0|0,0,1]=3 9777 B13R1.1511 CNCC(=O)c1ccc(F)cc1C Amb26968105 [0,2,0,0,0,0|1,0,1]=4 9778 B13R1.1511 CNCC(=O)c1ccc(F)cc1Cl Amb27840969 [0,2,0,0,0,0|0,1,1]=4 9779 B13R1.1511 CNCC(=O)c1ccc(F)cc1F Amb18564319 [0,2,0,0,0,0|0,1,1]=4 9780 B13R1.1511 CNCC(=O)c1ccc(F)cc1O Amb27831581 [0,2,0,0,0,0|1,0,1]=4 9781 B13R1.1511 CNCC(=O)c1ccc(O)cc1C Amb27466310 [0,2,0,0,0,0|1,0,1]=4 9782 B13R1.1511 CNCC(=O)c1ccc(O)cc1Cl Amb28188889 [0,2,0,0,0,0|0,1,1]=4 9783 B13R1.1511 CNCC(=O)c1ccc(O)cc1F Amb27173019 [0,2,0,0,0,0|0,1,1]=4 9784 B13R1.1511 CNCC(=O)c1ccc(O)cc1O Amb25180646 [0,2,0,0,0,0|1,0,1]=4 9785 B13R1.1511 CNCC(C)c1ccc(Br)cc1C Amb27158010 [0,2,0,0,0,0|1,0,0]=3 9786 B13R1.1511 CNCC(C)c1ccc(Br)cc1Cl Amb26647363 [0,2,0,0,0,0|0,1,0]=3 9787 B13R1.1511 CNCC(C)c1ccc(Br)cc1F Amb25192550 [0,2,0,0,0,0|0,1,0]=3 9788 B13R1.1511 CNCC(C)c1ccc(Br)cc1O Amb27756302 [0,2,0,0,0,0|1,0,0]=3 9789 B13R1.1511 CNCC(C)c1ccc(C)cc1Br Amb24379660 [0,2,0,0,0,0|0,0,0]=2 9790 B13R1.1511 CNCC(C)c1ccc(C)cc1C Amb17233345 [0,2,0,0,0,0|1,0,0]=3 9791 B13R1.1511 CNCC(C)c1ccc(C)cc1Cl Amb28077835 [0,2,0,0,0,0|0,1,0]=3 9792 B13R1.1511 CNCC(C)c1ccc(C)cc1F Amb27449852 [0,2,0,0,0,0|0,1,0]=3 9793 B13R1.1511 CNCC(C)c1ccc(C)cc1O Amb24473330 [0,2,0,0,0,0|1,0,0]=3 9794 B13R1.1511 CNCC(C)c1ccc(Cl)cc1Br Amb25066510 [0,2,0,0,0,0|0,0,0]=2 9795 B13R1.1511 CNCC(C)c1ccc(Cl)cc1C Amb26976228 [0,2,0,0,0,0|1,0,0]=3 9796 B13R1.1511 CNCC(C)c1ccc(Cl)cc1Cl Amb26436814 [0,2,0,0,0,0|0,1,0]=3 9797 B13R1.1511 CNCC(C)c1ccc(Cl)cc1F Amb26493981 [0,2,0,0,0,0|0,1,0]=3 9798 B13R1.1511 CNCC(C)c1ccc(Cl)cc1O Amb27968772 [0,2,0,0,0,0|1,0,0]=3 9799 B13R1.1511 CNCC(C)c1ccc(F)cc1Br Amb24421752 [0,2,0,0,0,0|0,0,0]=2 9800 B13R1.1511 CNCC(C)c1ccc(F)cc1C Amb26605721 [0,2,0,0,0,0|1,0,0]=3 9801 B13R1.1511 CNCC(C)c1ccc(F)cc1Cl Amb24420935 [0,2,0,0,0,0|0,1,0]=3 9802 B13R1.1511 CNCC(C)c1ccc(F)cc1F Amb18243851 [0,2,0,0,0,0|0,1,0]=3 9803 B13R1.1511 CNCC(C)c1ccc(F)cc1O Amb27250732 [0,2,0,0,0,0|1,0,0]=3 9804 B13R1.1511 CNCC(C)c1ccc(O)cc1Br Amb28280905 [0,2,0,0,0,0|0,0,0]=2 9805 B13R1.1511 CNCC(C)c1ccc(O)cc1C Amb25769248 [0,2,0,0,0,0|1,0,0]=3 9806 B13R1.1511 CNCC(C)c1ccc(O)cc1Cl Amb24718302 [0,2,0,0,0,0|0,1,0]=3 9807 B13R1.1511 CNCC(C)c1ccc(O)cc1F Amb25923838 [0,2,0,0,0,0|0,1,0]=3 9808 B13R1.1511 CNCC(O)c1ccc(Br)cc1C Amb26050136 [0,2,0,0,0,0|1,0,0]=3 9809 B13R1.1511 CNCC(O)c1ccc(Br)cc1Cl Amb25741122 [0,2,0,0,0,0|0,1,0]=3 9810 B13R1.1511 CNCC(O)c1ccc(Br)cc1F Amb18997472 [0,2,0,0,0,0|0,1,0]=3 9811 B13R1.1511 CNCC(O)c1ccc(Br)cc1O Amb33388515 [0,2,0,0,0,0|1,0,0]=3 9812 B13R1.1511 CNCC(O)c1ccc(C)cc1Br Amb25695051 [0,2,0,0,0,0|0,0,0]=2 9813 B13R1.1511 CNCC(O)c1ccc(C)cc1C Amb17233596 [0,2,0,0,0,0|1,0,0]=3 9814 B13R1.1511 CNCC(O)c1ccc(C)cc1Cl Amb27642121 [0,2,0,0,0,0|0,1,0]=3 9815 B13R1.1511 CNCC(O)c1ccc(C)cc1F Amb27610239 [0,2,0,0,0,0|0,1,0]=3 9816 B13R1.1511 CNCC(O)c1ccc(C)cc1O Amb33426661 [0,2,0,0,0,0|1,0,0]=3 9817 B13R1.1511 CNCC(O)c1ccc(C)nc1Cl Amb33260141 [0,2,0,0,0,0|1,1,0]=4 9818 B13R1.1511 CNCC(O)c1ccc(Cl)cc1Br Amb25828813 [0,2,0,0,0,0|0,0,0]=2 9819 B13R1.1511 CNCC(O)c1ccc(Cl)cc1C Amb27968617 [0,2,0,0,0,0|1,0,0]=3 9820 B13R1.1511 CNCC(O)c1ccc(Cl)cc1Cl Amb18301235 [0,2,0,0,0,0|0,1,0]=3 9821 B13R1.1511 CNCC(O)c1ccc(Cl)cc1F Amb24388791 [0,2,0,0,0,0|0,1,0]=3 9822 B13R1.1511 CNCC(O)c1ccc(Cl)cc1O Amb33260065 [0,2,0,0,0,0|1,0,0]=3 9823 B13R1.1511 CNCC(O)c1ccc(F)cc1Br Amb27950414 [0,2,0,0,0,0|0,0,0]=2 9824 B13R1.1511 CNCC(O)c1ccc(F)cc1C Amb18997476 [0,2,0,0,0,0|1,0,0]=3 9825 B13R1.1511 CNCC(O)c1ccc(F)cc1Cl Amb25870535 [0,2,0,0,0,0|0,1,0]=3 9826 B13R1.1511 CNCC(O)c1ccc(F)cc1F Amb18289717 [0,2,0,0,0,0|0,1,0]=3 9827 B13R1.1511 CNCC(O)c1ccc(O)cc1Cl Amb25095789 [0,2,0,0,0,0|0,1,0]=3 9828 B13R1.1511 CNCC(O)c1ccc(O)cc1F Amb33377701 [0,2,0,0,0,0|0,1,0]=3 9829 B13R1.1511 CNCC(O)c1ccc(O)cc1O Amb33340448 [0,2,0,0,0,0|1,0,0]=3 9830 B13R1.1511 CNCC(O)c1cnc(Cl)cc1Cl Amb33256865 [0,2,0,0,0,0|1,1,0]=4 9831 B13R1.1511 COCC(=O)c1ccc(C)cc1Br Amb27465774 [0,2,0,0,0,0|1,0,1]=4 9832 B13R1.1511 COCC(=O)c1ccc(N)cc1Br Amb28077651 [0,2,0,0,0,0|1,0,1]=4 9833 B13R1.1511 COCC(C)c1ccc(N)cc1C Amb27462107 [0,2,0,0,0,0|2,0,0]=4 9834 B13R1.1511 COCC(N)c1ccc(Br)cc1F Amb27866449 [0,2,0,0,0,0|1,1,0]=4 9835 B13R1.1511 COCC(N)c1ccc(Br)nc1Br Amb27397540 [0,2,0,0,0,0|2,0,0]=4 9836 B13R1.1511 COCC(N)c1ccc(C)cc1N Amb27815052 [0,2,0,0,0,0|2,0,0]=4 9837 B13R1.1511 COCC(N)c1ccc(Cl)cc1Cl Amb27177154 [0,2,0,0,0,0|1,1,0]=4 9838 B13R1.1511 COCC(N)c1ccc(Cl)cc1F Amb28123223 [0,2,0,0,0,0|1,1,0]=4 9839 B13R1.1511 COCC(N)c1ccc(F)cc1I Amb27273072 [0,2,0,0,0,0|1,1,0]=4 9840 B13R1.1511 COCC(N)c1ccc(F)cc1N Amb27494055 [0,2,0,0,0,0|2,0,0]=4 9841 B13R1.1511 COCC(N)c1ccc(I)cc1Cl Amb27951704 [0,2,0,0,0,0|1,1,0]=4 9842 B13R1.1511 COCC(N)c1ccc(I)cc1F Amb27650839 [0,2,0,0,0,0|1,1,0]=4 9843 B13R1.1511 COCC(N)c1ccc(O)cc1Br Amb27952891 [0,2,0,0,0,0|1,0,0]=3 9844 B13R1.1511 COCC(N)c1ccc(O)cc1N Amb28124691 [0,2,0,0,0,0|2,0,0]=4 9845 B13R1.1511 COCC(N)c1ccc(O)cc1O Amb28203801 [0,2,0,0,0,0|2,0,0]=4 9846 B13R1.1511 COCC(N)c1ncc(C)cc1Br Amb27597590 [0,2,0,0,0,0|2,0,0]=4 9847 B13R1.1511 COCC(O)c1ccc(Br)cc1Cl Amb27651549 [0,2,0,0,0,0|1,1,0]=4 9848 B13R1.1511 COCC(O)c1ccc(Br)cc1N Amb35621244 [0,2,0,0,0,0|2,0,0]=4 9849 B13R1.1511 COCC(O)c1ccc(C)cc1Br Amb27758516 [0,2,0,0,0,0|1,0,0]=3 9850 B13R1.1511 COCC(O)c1ccc(C)cc1C Amb18809341 [0,2,0,0,0,0|2,0,0]=4 9851 B13R1.1511 COCC(O)c1ccc(Cl)cc1Cl Amb27977120 [0,2,0,0,0,0|1,1,0]=4 9852 B13R1.1511 COCC(O)c1ccc(N)cc1Br Amb27635177 [0,2,0,0,0,0|1,0,0]=3 9853 B13R1.1511 COCC(O)c1ccc(N)cc1Cl Amb27769058 [0,2,0,0,0,0|1,1,0]=4 9854 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1Br Amb27410678 [0,2,0,0,0,0|1,0,0]=3 9855 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1C Amb28429207 [0,2,0,0,0,0|2,0,0]=4 9856 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1N Amb27802710 [0,2,0,0,0,0|2,0,0]=4 9857 B13R1.1511 COC[C@@H](N)c1ccc(C)cc1Cl Amb28437298 [0,2,0,0,0,0|1,1,0]=4 9858 B13R1.1511 COC[C@@H](N)c1ccc(C)cc1N Amb27609582 [0,2,0,0,0,0|2,0,0]=4 9859 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1C Amb28397916 [0,2,0,0,0,0|2,0,0]=4 9860 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1Cl Amb27848185 [0,2,0,0,0,0|1,1,0]=4 9861 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1F Amb27813319 [0,2,0,0,0,0|1,1,0]=4 9862 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1N Amb27643442 [0,2,0,0,0,0|2,0,0]=4 9863 B13R1.1511 COC[C@@H](N)c1ccc(F)cc1N Amb27175374 [0,2,0,0,0,0|2,0,0]=4 9864 B13R1.1511 COC[C@@H](N)c1ccc(N)cc1F Amb28203753 [0,2,0,0,0,0|1,1,0]=4 9865 B13R1.1511 COC[C@@H](N)c1ccc(N)cc1O Amb27494787 [0,2,0,0,0,0|2,0,0]=4 9866 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1F Amb27800009 [0,2,0,0,0,0|1,1,0]=4 9867 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1N Amb28293084 [0,2,0,0,0,0|2,0,0]=4 9868 B13R1.1511 COC[C@H](N)c1ccc(C)cc1N Amb27173669 [0,2,0,0,0,0|2,0,0]=4 9869 B13R1.1511 COC[C@H](N)c1ccc(F)cc1O Amb26603712 [0,2,0,0,0,0|2,0,0]=4 9870 B13R1.1511 COC[C@H](N)c1ccc(N)cc1Br Amb28203781 [0,2,0,0,0,0|1,0,0]=3 9871 B13R1.1511 COC[C@H](N)c1ccc(N)cc1Cl Amb28340832 [0,2,0,0,0,0|1,1,0]=4 9872 B13R1.1511 COC[C@H](N)c1ccc(O)cc1C Amb28119998 [0,2,0,0,0,0|2,0,0]=4 9873 B13R1.1511 COC[C@H](N)c1ccc(O)cc1F Amb27413086 [0,2,0,0,0,0|1,1,0]=4 9874 B13R1.1511 COC[C@H](N)c1ncc(C)cc1Br Amb27962851 [0,2,0,0,0,0|2,0,0]=4 9875 B13R1.1511 COC[C@H](N)c1ncc(Cl)cc1Br Amb27412508 [0,2,0,0,0,0|2,0,0]=4 9876 B13R1.1511 CSCC(=O)c1ccc(Br)cc1Br Amb27405613 [0,2,0,0,0,0|1,0,1]=4 9877 B13R1.1511 CSCC(=O)c1ccc(C)cc1Br Amb28285471 [0,2,0,0,0,0|1,0,1]=4 9878 B13R1.1511 CSCC(O)c1ccc(F)cc1C Amb19086356 [0,2,0,0,0,0|2,0,0]=4 9879 B13R1.1511 CSCC(O)c1ccc(F)cc1F Amb28240854 [0,2,0,0,0,0|1,1,0]=4 9880 B13R1.1511 Cc1ccc(C(C)CCN)c(Br)c1 Amb33450424 [0,2,0,0,0,0|2,0,0]=4 9881 B13R1.1511 Cc1ccc(C(C)CON)c(Br)c1 Amb33386362 [0,2,0,0,0,0|2,0,0]=4 9882 B13R1.1511 Cc1ccc(C(F)CCN)c(Br)c1 Amb33450469 [0,2,0,0,0,0|2,0,0]=4 9883 B13R1.1511 Cc1ccc(C(N)CCO)c(Br)c1 Amb24664283 [0,2,0,0,0,0|2,0,0]=4 9884 B13R1.1511 Cc1ccc(C(O)CC#N)c(Br)c1 Amb25269373 [0,2,0,0,0,0|2,0,0]=4 9885 B13R1.1511 Cc1ccc(C(O)CCN)c(Br)c1 Amb27599459 [0,2,0,0,0,0|2,0,0]=4 9886 B13R1.1511 Cc1ccc(C(O)CNN)c(C)c1 Amb18065949 [0,2,0,0,0,0|2,0,0]=4 9887 B13R1.1511 Cc1ccc(C(O)CNO)c(C)c1 Amb17335497 [0,2,0,0,0,0|2,0,0]=4 9888 B13R1.1511 Cc1ccc([C@@H](N)CC#N)c(Br)c1 Amb27797113 [0,2,0,0,0,0|2,0,0]=4 9889 B13R1.1511 Cc1ccc([C@@H](N)CCO)c(Br)c1 Amb26571410 [0,2,0,0,0,0|2,0,0]=4 9890 B13R1.1511 Cc1ccc([C@@H](O)CCN)c(Br)c1 Amb33263222 [0,2,0,0,0,0|2,0,0]=4 9891 B13R1.1511 Cc1ccc([C@@H](O)CCO)c(Br)c1 Amb27961235 [0,2,0,0,0,0|2,0,0]=4 9892 B13R1.1511 Cc1ccc([C@H](N)CCO)c(Br)c1 Amb27217979 [0,2,0,0,0,0|2,0,0]=4 9893 B13R1.1511 Cc1ccc([C@H](O)CCN)c(Br)c1 Amb33450459 [0,2,0,0,0,0|2,0,0]=4 9894 B13R1.1511 Cc1ccc([C@H](O)CCO)c(Br)c1 Amb27628970 [0,2,0,0,0,0|2,0,0]=4 9895 B13R1.1511 N#CCC(N)c1ccc(F)cc1Br Amb28196370 [0,2,0,0,0,0|2,0,0]=4 9896 B13R1.1511 N#CCC(O)c1ccc(Cl)cc1Br Amb25718538 [0,2,0,0,0,0|2,0,0]=4 9897 B13R1.1511 N#CCC(O)c1ccc(F)cc1Br Amb24437749 [0,2,0,0,0,0|2,0,0]=4 9898 B13R1.1511 N#CC[C@@H](N)c1ccc(Cl)cc1Br Amb28398155 [0,2,0,0,0,0|2,0,0]=4 9899 B13R1.1511 N#CC[C@@H](N)c1ccc(N)cc1Br Amb27166627 [0,2,0,0,0,0|2,0,0]=4 9900 B13R1.1511 N#CC[C@H](N)c1ccc(Br)cc1Br Amb27449321 [0,2,0,0,0,0|2,0,0]=4 9901 B13R1.1511 N#CC[C@H](N)c1ccc(Cl)cc1Br Amb27608551 [0,2,0,0,0,0|2,0,0]=4 9902 B13R1.1511 N#CC[C@H](N)c1ccc(F)cc1Br Amb27638668 [0,2,0,0,0,0|2,0,0]=4 9903 B13R1.1511 NC(CCO)c1ccc(Br)cc1Br Amb28118563 [0,2,0,0,0,0|2,0,0]=4 9904 B13R1.1511 NC(CCO)c1ccc(Cl)cc1Br Amb27667941 [0,2,0,0,0,0|2,0,0]=4 9905 B13R1.1511 NC(CCO)c1ccc(F)cc1Br Amb27633850 [0,2,0,0,0,0|2,0,0]=4 9906 B13R1.1511 NCCC(F)c1ccc(Cl)cc1Br Amb33478344 [0,2,0,0,0,0|2,0,0]=4 9907 B13R1.1511 NCCC(F)c1ccc(F)cc1Br Amb33336573 [0,2,0,0,0,0|2,0,0]=4 9908 B13R1.1511 NCCC(N)c1ccc(Cl)cc1Br Amb28248154 [0,2,0,0,0,0|2,0,0]=4 9909 B13R1.1511 NCCC(O)c1ccc(Cl)cc1Br Amb28122765 [0,2,0,0,0,0|2,0,0]=4 9910 B13R1.1511 NCCC(O)c1ccc(F)cc1Br Amb28202403 [0,2,0,0,0,0|2,0,0]=4 9911 B13R1.1511 NCC[C@@H](N)c1ccc(Cl)cc1Br Amb28056176 [0,2,0,0,0,0|2,0,0]=4 9912 B13R1.1511 NCC[C@@H](N)c1ccc(F)cc1Br Amb27850074 [0,2,0,0,0,0|2,0,0]=4 9913 B13R1.1511 NCC[C@@H](O)c1ccc(Cl)cc1Br Amb33478341 [0,2,0,0,0,0|2,0,0]=4 9914 B13R1.1511 NCC[C@@H](O)c1ccc(F)cc1Br Amb33336567 [0,2,0,0,0,0|2,0,0]=4 9915 B13R1.1511 NCC[C@H](O)c1ccc(Cl)cc1Br Amb33478424 [0,2,0,0,0,0|2,0,0]=4 9916 B13R1.1511 NCC[C@H](O)c1ccc(F)cc1Br Amb33336570 [0,2,0,0,0,0|2,0,0]=4 9917 B13R1.1511 NNCC(O)c1ccc(F)cc1F Amb18066217 [0,2,0,0,0,0|1,1,0]=4 9918 B13R1.1511 N[C@@H](CCO)c1ccc(Cl)cc1Br Amb27176977 [0,2,0,0,0,0|2,0,0]=4 9919 B13R1.1511 N[C@@H](CCO)c1ccc(F)cc1Br Amb25375770 [0,2,0,0,0,0|2,0,0]=4 9920 B13R1.1511 N[C@H](CCO)c1ccc(Cl)cc1Br Amb26595132 [0,2,0,0,0,0|2,0,0]=4 9921 B13R1.1511 N[C@H](CCO)c1ccc(F)cc1Br Amb26559715 [0,2,0,0,0,0|2,0,0]=4 9922 B13R1.1511 Nc1ccc([C@H](N)CCO)c(Br)c1 Amb28203533 [0,2,0,0,0,0|2,0,0]=4 9923 B13R1.1511 OCC[C@@H](O)c1ccc(F)cc1Br Amb27248679 [0,2,0,0,0,0|2,0,0]=4 9924 B13R1.1511 OCC[C@H](O)c1ccc(F)cc1Br Amb28068946 [0,2,0,0,0,0|2,0,0]=4 9925 B13R1.1601 CCCCc1c(C)cc(C)cc1O Amb27238190 [0,2,0,0,0,0|2,0,0]=4 9926 B13R1.1601 CCCCc1c(Cl)cc(N)cc1Cl Amb28056740 [0,2,0,0,0,0|1,1,0]=4 9927 B13R1.1601 CCCNc1c(Br)cc(Cl)cc1Br Amb27861702 [0,2,0,0,0,0|2,0,0]=4 9928 B13R1.1601 CCCOc1c(Br)cc(N)cc1Br Amb9010807 [0,2,0,0,0,0|2,0,0]=4 9929 B13R1.1601 CCCOc1c(C)cc(C)cc1Br Amb17256464 [0,2,0,0,0,0|2,0,0]=4 9930 B13R1.1601 CCCOc1c(F)cc(F)cc1Br Amb27402667 [0,2,0,0,0,0|2,0,0]=4 9931 B13R1.1601 CCCOc1c(S)cc(Cl)cc1Br Amb27476296 [0,2,0,0,0,0|2,0,0]=4 9932 B13R1.1601 CNCCc1c(C)cc(C)cc1C Amb17085229 [0,2,0,0,0,0|1,0,0]=3 9933 B13R1.1601 CNCCc1c(C)cc(O)cc1C Amb18275832 [0,2,0,0,0,0|1,0,0]=3 9934 B13R1.1601 CNCCc1c(Cl)cc(Cl)cc1Cl Amb33309454 [0,2,0,0,0,0|0,1,0]=3 9935 B13R1.1601 CNCCc1c(F)cc(Br)cc1F Amb33335225 [0,2,0,0,0,0|0,1,0]=3 9936 B13R1.1601 CNCCc1c(F)cc(C)cc1F Amb25960840 [0,2,0,0,0,0|0,1,0]=3 9937 B13R1.1601 CNCCc1c(F)cc(F)cc1F Amb33312684 [0,2,0,0,0,0|0,1,0]=3 9938 B13R1.1601 CNCCc1c(O)cc(O)cc1O Amb18939979 [0,2,0,0,0,0|1,0,0]=3 9939 B13R1.1601 COCOc1c(Br)cc(C)cc1Br Amb27594402 [0,2,0,0,0,0|2,0,0]=4 9940 B13R1.1601 COCOc1c(F)cc(F)cc1Br Amb24728943 [0,2,0,0,0,0|2,0,0]=4 9941 B13R1.1601 Cc1cc(C)c(CCNN)c(C)c1 Amb17400678 [0,2,0,0,0,0|2,0,0]=4 9942 B13R1.1601 Cc1cc(C)c(CCNO)c(C)c1 Amb33481174 [0,2,0,0,0,0|2,0,0]=4 9943 B13R1.1601 NNCCc1c(F)cc(F)cc1F Amb27795525 [0,2,0,0,0,0|1,1,0]=4 9944 B13R1.1630 C#CCCc1cc(F)c(F)cc1Br Amb33332896 [0,2,0,0,0,0|1,0,1]=4 9945 B13R1.1630 CCCCC1=CC(=O)C(=O)C=C1C Amb28122384 [0,2,0,0,0,0|2,0,0]=4 9946 B13R1.1630 CCCCc1cc(C)c(O)cc1C Amb27434282 [0,2,0,0,0,0|2,0,0]=4 9947 B13R1.1630 CCCCc1cc(Cl)c(F)cc1O Amb27791540 [0,2,0,0,0,0|2,0,0]=4 9948 B13R1.1630 CCCCc1cc(Cl)c(N)cc1C Amb28141384 [0,2,0,0,0,0|2,0,0]=4 9949 B13R1.1630 CCCCc1cc(O)c(F)cc1C Amb28141278 [0,2,0,0,0,0|2,0,0]=4 9950 B13R1.1630 CCCCc1cc(O)c(O)cc1C Amb28201035 [0,2,0,0,0,0|2,0,0]=4 9951 B13R1.1630 CCCNc1cc(C)c(N)cc1Br Amb27393254 [0,2,0,0,0,0|2,0,0]=4 9952 B13R1.1630 CCCOc1cc(C)c(C)cc1Br Amb17256466 [0,2,0,0,0,0|2,0,0]=4 9953 B13R1.1630 CCCOc1cc(C)c(N)cc1Br Amb26497097 [0,2,0,0,0,0|2,0,0]=4 9954 B13R1.1630 CCCOc1cc(N)c(N)cc1Br Amb25277355 [0,2,0,0,0,0|2,0,0]=4 9955 B13R1.1630 CCNCc1cc(Br)c(C)cc1Br Amb27750087 [0,2,0,0,0,0|2,0,0]=4 9956 B13R1.1630 CCNCc1cc(Cl)c(C)cc1Br Amb27791718 [0,2,0,0,0,0|2,0,0]=4 9957 B13R1.1630 CCNCc1cc(F)c(F)cc1Br Amb28243082 [0,2,0,0,0,0|2,0,0]=4 9958 B13R1.1630 CNCCc1cc(C)c(Br)cc1C Amb18275632 [0,2,0,0,0,0|1,0,0]=3 9959 B13R1.1630 CNCCc1cc(C)c(C)cc1Br Amb18276743 [0,2,0,0,0,0|0,0,0]=2 9960 B13R1.1630 CNCCc1cc(C)c(C)cc1C Amb18065736 [0,2,0,0,0,0|1,0,0]=3 9961 B13R1.1630 CNCCc1cc(C)c(C)cc1Cl Amb18274666 [0,2,0,0,0,0|0,1,0]=3 9962 B13R1.1630 CNCCc1cc(C)c(C)cc1O Amb33340289 [0,2,0,0,0,0|1,0,0]=3 9963 B13R1.1630 CNCCc1cc(C)c(Cl)cc1C Amb18275666 [0,2,0,0,0,0|1,0,0]=3 9964 B13R1.1630 CNCCc1cc(Cl)c(C)cc1C Amb18275699 [0,2,0,0,0,0|1,0,0]=3 9965 B13R1.1630 CNCCc1cc(Cl)c(C)cc1O Amb18942549 [0,2,0,0,0,0|1,0,0]=3 9966 B13R1.1630 CNCCc1cc(Cl)c(Cl)cc1Cl Amb18275686 [0,2,0,0,0,0|0,1,0]=3 9967 B13R1.1630 CNCCc1cc(Cl)c(Cl)cc1O Amb18277312 [0,2,0,0,0,0|1,0,0]=3 9968 B13R1.1630 CNCCc1cc(F)c(C)cc1F Amb27638469 [0,2,0,0,0,0|0,1,0]=3 9969 B13R1.1630 CNCCc1cc(F)c(Cl)cc1Cl Amb33221866 [0,2,0,0,0,0|0,1,0]=3 9970 B13R1.1630 CNCCc1cc(F)c(Cl)cc1F Amb26952863 [0,2,0,0,0,0|0,1,0]=3 9971 B13R1.1630 CNCCc1cc(F)c(Cl)nc1Cl Amb33413902 [0,2,0,0,0,0|1,1,0]=4 9972 B13R1.1630 CNCCc1cc(F)c(F)cc1Br Amb33333827 [0,2,0,0,0,0|0,0,0]=2 9973 B13R1.1630 CNCCc1cc(F)c(F)cc1Cl Amb26644505 [0,2,0,0,0,0|0,1,0]=3 9974 B13R1.1630 CNCCc1cc(F)c(F)cc1F Amb25158718 [0,2,0,0,0,0|0,1,0]=3 9975 B13R1.1630 CNCCc1cc(F)c(O)cc1C Amb28195895 [0,2,0,0,0,0|1,0,0]=3 9976 B13R1.1630 CNCNc1cc(O)c(C)cc1O Amb27776834 [0,2,0,0,0,0|2,0,0]=4 9977 B13R1.1630 Fc1cc(Br)c(CCCS)cc1F Amb33332918 [0,2,0,0,0,0|2,0,0]=4 9978 B13R1.1630 N#CCCc1cc(F)c(F)cc1Br Amb33335235 [0,2,0,0,0,0|2,0,0]=4 9979 B13R1.1630 NCCCc1cc(F)c(F)cc1Br Amb33333825 [0,2,0,0,0,0|2,0,0]=4 9980 B13R1.1630 NNCCc1cc(F)c(F)cc1F Amb24444084 [0,2,0,0,0,0|1,1,0]=4 9981 B13R1.1630 NOCCc1cc(F)c(F)cc1Br Amb33333832 [0,2,0,0,0,0|2,0,0]=4 9982 B13R1.1630 O=CCCc1cc(F)c(F)cc1Br Amb33335218 [0,2,0,0,0,0|2,0,0]=4 9983 B13R1.1630 OCCCc1cc(F)c(F)cc1Br Amb33333823 [0,2,0,0,0,0|2,0,0]=4 9984 B13R1.1630 ONCCc1cc(F)c(F)cc1F Amb33418260 [0,2,0,0,0,0|1,1,0]=4 9985 B13R1.1630 [C-]#[N+]CCc1cc(F)c(F)cc1Br Amb33332543 [0,2,0,0,0,0|0,0,2]=4 9986 B13R1.2679 CC(C=O)Cc1ccc(Br)cc1Br Amb28348429 [0,2,0,0,0,0|2,0,0]=4 9987 B13R1.2679 CC(C=O)Cc1ccc(Cl)cc1Br Amb28124860 [0,2,0,0,0,0|2,0,0]=4 9988 B13R1.2679 CC(C=O)Cc1ccc(F)cc1Br Amb25324754 [0,2,0,0,0,0|2,0,0]=4 9989 B13R1.2679 CC(Cc1ccc(Cl)cc1Cl)NN Amb26855398 [0,2,0,0,0,0|1,1,0]=4 9990 B13R1.2679 CC(Cc1ccc(F)cc1F)NN Amb28208533 [0,2,0,0,0,0|1,1,0]=4 9991 B13R1.2679 CCC(Br)Cc1ccc(C)cc1C Amb18548969 [0,2,0,0,0,0|2,0,0]=4 9992 B13R1.2679 CCC(Br)Cc1ccc(Cl)cc1Cl Amb18548931 [0,2,0,0,0,0|1,1,0]=4 9993 B13R1.2679 CCC(Br)Cc1ccc(F)cc1F Amb27948357 [0,2,0,0,0,0|1,1,0]=4 9994 B13R1.2679 CCC(C)Nc1ccc(C)cc1Br Amb6688275 [0,2,0,0,0,0|2,0,0]=4 9995 B13R1.2679 CCC(C)Nc1ccc(Cl)cc1Br Amb27608743 [0,2,0,0,0,0|2,0,0]=4 9996 B13R1.2679 CCC(C)Oc1ccc(N)cc1Br Amb25941711 [0,2,0,0,0,0|2,0,0]=4 9997 B13R1.2679 CCC(Cl)Cc1ccc(F)cc1C Amb27458096 [0,2,0,0,0,0|2,0,0]=4 9998 B13R1.2679 CCC(N)Cc1ccc(Br)cc1C Amb27862697 [0,2,0,0,0,0|2,0,0]=4 9999 B13R1.2679 CCC(N)Cc1ccc(Br)cc1O Amb35591939 [0,2,0,0,0,0|2,0,0]=4 10000 B13R1.2679 CCC(N)Cc1ccc(C)cc1Cl Amb27592805 [0,2,0,0,0,0|1,1,0]=4 10001 B13R1.2679 CCC(N)Cc1ccc(C)cc1O Amb25865441 [0,2,0,0,0,0|2,0,0]=4 10002 B13R1.2679 CCC(N)Cc1ccc(Cl)cc1Cl Amb9428896 [0,2,0,0,0,0|1,1,0]=4 10003 B13R1.2679 CCC(N)Cc1ccc(F)cc1Br Amb28387751 [0,2,0,0,0,0|1,0,0]=3 10004 B13R1.2679 CCC(N)Cc1ccc(O)cc1C Amb26019579 [0,2,0,0,0,0|2,0,0]=4 10005 B13R1.2679 CCC(N)Cc1ccc(O)cc1F Amb35669033 [0,2,0,0,0,0|1,1,0]=4 10006 B13R1.2679 CCC(O)Cc1ccc(Br)cc1Cl Amb27414812 [0,2,0,0,0,0|1,1,0]=4 10007 B13R1.2679 CCC(O)Cc1ccc(Br)cc1F Amb25848635 [0,2,0,0,0,0|1,1,0]=4 10008 B13R1.2679 CCC(O)Cc1ccc(C)cc1C Amb26883002 [0,2,0,0,0,0|2,0,0]=4 10009 B13R1.2679 CCC(O)Cc1ccc(C)cc1Cl Amb28428053 [0,2,0,0,0,0|1,1,0]=4 10010 B13R1.2679 CCC(O)Cc1ccc(Cl)cc1C Amb24362823 [0,2,0,0,0,0|2,0,0]=4 10011 B13R1.2679 CCC(O)Cc1ccc(Cl)cc1Cl Amb17141147 [0,2,0,0,0,0|1,1,0]=4 10012 B13R1.2679 CCC(O)Cc1ccc(F)cc1Br Amb27756565 [0,2,0,0,0,0|1,0,0]=3 10013 B13R1.2679 CCC(O)Cc1ccc(F)cc1C Amb24491866 [0,2,0,0,0,0|2,0,0]=4 10014 B13R1.2679 CCC(O)Cc1ccc(F)cc1Cl Amb25816817 [0,2,0,0,0,0|1,1,0]=4 10015 B13R1.2679 CCC(O)Cc1ccc(F)cc1F Amb18329171 [0,2,0,0,0,0|1,1,0]=4 10016 B13R1.2679 CCS(=O)Cc1ccc(N)cc1Br Amb27414497 [0,2,0,0,0,0|2,0,0]=4 10017 B13R1.2679 CC[C@@H](N)Cc1ccc(F)cc1Cl Amb27867064 [0,2,0,0,0,0|1,1,0]=4 10018 B13R1.2679 CNC(=N)Cc1ccc(Cl)cc1Cl Amb28242169 [0,2,0,0,0,0|0,1,1]=4 10019 B13R1.2679 CNC(=N)Nc1ccc(Cl)cc1Br Amb27955036 [0,2,0,0,0,0|1,0,1]=4 10020 B13R1.2679 CNC(=O)Cc1ccc(Br)cc1F Amb32414342 [0,2,0,0,0,0|0,1,1]=4 10021 B13R1.2679 CNC(=O)Cc1ccc(Cl)cc1Br Amb21926823 [0,2,0,0,0,0|0,0,1]=3 10022 B13R1.2679 CNC(=O)Cc1ccc(Cl)cc1Cl Amb1225666 [0,2,0,0,0,0|0,1,1]=4 10023 B13R1.2679 CNC(=O)Cc1ccc(Cl)cc1N Amb27227914 [0,2,0,0,0,0|1,0,1]=4 10024 B13R1.2679 CNC(=O)Cc1ccc(F)cc1F Amb27460782 [0,2,0,0,0,0|0,1,1]=4 10025 B13R1.2679 CNC(=O)Cc1ccc(F)cc1N Amb35668874 [0,2,0,0,0,0|1,0,1]=4 10026 B13R1.2679 CNC(=O)Cc1ccc(N)cc1N Amb27967824 [0,2,0,0,0,0|1,0,1]=4 10027 B13R1.2679 CNC(=O)Cc1ccc(O)cc1Cl Amb27248392 [0,2,0,0,0,0|0,1,1]=4 10028 B13R1.2679 CNC(=O)Nc1ccc(Br)cc1Br Amb14010755 [0,2,0,0,0,0|1,0,1]=4 10029 B13R1.2679 CNC(=O)Oc1ccc(Br)cc1Br Amb4006140 [0,2,0,0,0,0|1,0,1]=4 10030 B13R1.2679 CNC(C)Cc1ccc(Br)cc1Cl Amb27836416 [0,2,0,0,0,0|0,1,0]=3 10031 B13R1.2679 CNC(C)Cc1ccc(C)cc1C Amb18552924 [0,2,0,0,0,0|1,0,0]=3 10032 B13R1.2679 CNC(C)Cc1ccc(C)cc1Cl Amb27972005 [0,2,0,0,0,0|0,1,0]=3 10033 B13R1.2679 CNC(C)Cc1ccc(F)cc1Br Amb27390874 [0,2,0,0,0,0|0,0,0]=2 10034 B13R1.2679 CNC(C)Cc1ccc(F)cc1C Amb27647459 [0,2,0,0,0,0|1,0,0]=3 10035 B13R1.2679 CNC(C)Cc1ccc(F)cc1F Amb19075194 [0,2,0,0,0,0|0,1,0]=3 10036 B13R1.2679 CNC(C)Cc1ccc(F)cc1O Amb27636240 [0,2,0,0,0,0|1,0,0]=3 10037 B13R1.2679 CNC(C)Cc1ccc(O)cc1F Amb28135580 [0,2,0,0,0,0|0,1,0]=3 10038 B13R1.2679 CN[C@@H](C)Cc1ccc(F)cc1F Amb33621126 [0,2,0,0,0,0|0,1,0]=3 10039 B13R1.2679 COC(=O)Cc1ccc(Br)cc1Br Amb25217922 [0,2,0,0,0,0|1,0,1]=4 10040 B13R1.2679 COC(=O)Cc1ccc(C)cc1Br Amb22831596 [0,2,0,0,0,0|1,0,1]=4 10041 B13R1.2679 COC(=O)Cc1ccc(Cl)cc1Br Amb6297103 [0,2,0,0,0,0|1,0,1]=4 10042 B13R1.2679 COC(=O)Cc1ccc(F)cc1Br Amb25802314 [0,2,0,0,0,0|1,0,1]=4 10043 B13R1.2679 Cc1ccc(CC(Cl)C#N)c(Br)c1 Amb17204792 [0,2,0,0,0,0|2,0,0]=4 10044 B13R1.2679 Cc1ccc(CC(Cl)C=O)c(Br)c1 Amb17204820 [0,2,0,0,0,0|2,0,0]=4 10045 B13R1.2679 Cc1ccc(CC(N)CO)c(Br)c1 Amb27445457 [0,2,0,0,0,0|2,0,0]=4 10046 B13R1.2679 Cc1ccc(CC(O)CN)c(Br)c1 Amb18071611 [0,2,0,0,0,0|2,0,0]=4 10047 B13R1.2679 NC(CO)Cc1ccc(Cl)cc1Br Amb33450977 [0,2,0,0,0,0|2,0,0]=4 10048 B13R1.2679 NC(CO)Cc1ccc(F)cc1Br Amb26944414 [0,2,0,0,0,0|2,0,0]=4 10049 B13R1.2679 NCC(F)Cc1ccc(F)cc1Br Amb28424243 [0,2,0,0,0,0|2,0,0]=4 10050 B13R1.2679 NCC(O)Cc1ccc(Cl)cc1Br Amb33450981 [0,2,0,0,0,0|2,0,0]=4 10051 B13R1.2679 NCC(O)Cc1ccc(F)cc1Br Amb25069905 [0,2,0,0,0,0|2,0,0]=4 10052 B13R1.2679 O=C(Cc1ccc(Cl)cc1Br)NO Amb27448638 [0,2,0,0,0,0|1,0,1]=4 10053 B13R1.2679 O=CC(Cl)Cc1ccc(Cl)cc1Br Amb27608855 [0,2,0,0,0,0|2,0,0]=4 10054 B13R1.2679 O=CC(O)Cc1ccc(F)cc1Br Amb27664466 [0,2,0,0,0,0|2,0,0]=4 10055 B13R1.84 C#Cc1ccccc1CCCCN Amb33373899 [0,2,0,0,0,0|2,0,0]=4 10056 B13R1.84 CCCCCc1ccccc1CO Amb24100493 [0,2,0,0,0,0|2,0,0]=4 10057 B13R1.84 CCCCNc1ccccc1C#N Amb6696140 [0,2,0,0,0,0|2,0,0]=4 10058 B13R1.84 CCCCNc1ccccc1OC Amb6688441 [0,2,0,0,0,0|2,0,0]=4 10059 B13R1.84 CCCCNc1ccccc1SC Amb9226543 [0,2,0,0,0,0|2,0,0]=4 10060 B13R1.84 CCCCOc1ccccc1C=O Amb6705789 [0,2,0,0,0,0|2,0,0]=4 10061 B13R1.84 CCCCOc1ccccc1CO Amb6296943 [0,2,0,0,0,0|2,0,0]=4 10062 B13R1.84 CCCCSc1ccccc1C=O Amb30592316 [0,2,0,0,0,0|2,0,0]=4 10063 B13R1.84 CCCNCc1ccccc1CN Amb19649754 [0,2,0,0,0,0|2,0,0]=4 10064 B13R1.84 CCCNCc1ccccc1CO Amb19649742 [0,2,0,0,0,0|2,0,0]=4 10065 B13R1.84 CCCNCc1ccccc1OC Amb19890382 [0,2,0,0,0,0|2,0,0]=4 10066 B13R1.84 CCCNCc1ccccc1OC Amb837723 [0,2,0,0,0,0|2,0,0]=4 10067 B13R1.84 CCCOCc1ccccc1CN Amb8874645 [0,2,0,0,0,0|2,0,0]=4 10068 B13R1.84 CCc1ccccc1C#CCNC Amb27480330 [0,2,0,0,0,0|1,0,1]=4 10069 B13R1.84 CCc1ccccc1CCCCN Amb33474508 [0,2,0,0,0,0|2,0,0]=4 10070 B13R1.84 CCc1ccccc1OCCNC Amb3433752 [0,2,0,0,0,0|1,0,0]=3 10071 B13R1.84 CCc1ccccc1OCCNC Amb9024984 [0,2,0,0,0,0|1,0,0]=3 10072 B13R1.84 CNCC#Cc1ccccc1OC Amb28385423 [0,2,0,0,0,0|1,0,1]=4 10073 B13R1.84 CNCCCc1ccccc1OC Amb17104505 [0,2,0,0,0,0|1,0,0]=3 10074 B13R1.84 CNCCNc1ccccc1C#N Amb19027476 [0,2,0,0,0,0|1,0,0]=3 10075 B13R1.84 CNCCNc1ccncc1C#N Amb27786674 [0,2,0,0,0,0|2,0,0]=4 10076 B13R1.84 CNCCNc1cnccc1C#N Amb28064579 [0,2,0,0,0,0|2,0,0]=4 10077 B13R1.84 CNCCOc1ccccc1C#N Amb19373473 [0,2,0,0,0,0|1,0,0]=3 10078 B13R1.84 CNCCOc1ccccc1C#N Amb7798184 [0,2,0,0,0,0|1,0,0]=3 10079 B13R1.84 CNCCOc1ccccc1OC Amb30982583 [0,2,0,0,0,0|1,0,0]=3 10080 B13R1.84 CNCCOc1ccccc1OC Amb33528818 [0,2,0,0,0,0|1,0,0]=3 10081 B13R1.84 CNC\C=C\c1ccccc1C#N Amb28351826 [0,2,0,0,0,0|1,0,1]=4 10082 B13R1.84 CNC\C=C\c1ccccc1OC Amb23442943 [0,2,0,0,0,0|1,0,1]=4 10083 B13R1.84 COCCNc1ccccc1CN Amb18184816 [0,2,0,0,0,0|2,0,0]=4 10084 B13R1.84 COCCOc1ccccc1C#N Amb6273560 [0,2,0,0,0,0|2,0,0]=4 10085 B13R1.84 COCCOc1ccccc1C=O Amb845325 [0,2,0,0,0,0|2,0,0]=4 10086 B13R1.84 COCCOc1ccccc1CN Amb6246145 [0,2,0,0,0,0|2,0,0]=4 10087 B13R1.84 COCCOc1ccccc1CO Amb6706307 [0,2,0,0,0,0|2,0,0]=4 10088 B13R1.84 COc1ccccc1CCCCBr Amb34914036 [0,2,0,0,0,0|2,0,0]=4 10089 B13R1.84 COc1ccccc1CCCCI Amb34914022 [0,2,0,0,0,0|2,0,0]=4 10090 B13R1.84 COc1ccccc1CCCCN Amb18015289 [0,2,0,0,0,0|2,0,0]=4 10091 B13R1.84 COc1ccccc1CCCCN Amb5735498 [0,2,0,0,0,0|2,0,0]=4 10092 B13R1.84 COc1ccccc1CCCCO Amb17106039 [0,2,0,0,0,0|2,0,0]=4 10093 B13R1.84 CSc1ccccc1CCCCN Amb32876728 [0,2,0,0,0,0|2,0,0]=4 10094 B13R1.84 N#Cc1ccccc1CCCCN Amb33204272 [0,2,0,0,0,0|2,0,0]=4 10095 B13R1.90 C#Cc1ccccc1CCC(C)=O Amb33226974 [0,2,0,0,0,0|2,0,0]=4 10096 B13R1.90 C#Cc1ccccc1CCC(C)N Amb33203590 [0,2,0,0,0,0|2,0,0]=4 10097 B13R1.90 C#Cc1ccccc1CCC(C)O Amb33203589 [0,2,0,0,0,0|2,0,0]=4 10098 B13R1.90 C#Cc1ccccc1CC[C@@H](C)N Amb33203585 [0,2,0,0,0,0|2,0,0]=4 10099 B13R1.90 C#Cc1ccccc1CC[C@@H](C)O Amb33203587 [0,2,0,0,0,0|2,0,0]=4 10100 B13R1.90 C#Cc1ccccc1CC[C@H](C)N Amb33203584 [0,2,0,0,0,0|2,0,0]=4 10101 B13R1.90 C#Cc1ccccc1CC[C@H](C)O Amb33203588 [0,2,0,0,0,0|2,0,0]=4 10102 B13R1.90 C=C(C)CCc1ccccc1C#N Amb6299027 [0,2,0,0,0,0|2,0,0]=4 10103 B13R1.90 C=C(C)CCc1ccccc1OC Amb6299118 [0,2,0,0,0,0|2,0,0]=4 10104 B13R1.90 CC(=O)CCc1ccccc1C#N Amb25192581 [0,2,0,0,0,0|2,0,0]=4 10105 B13R1.90 CC(C)CCc1ccccc1C=O Amb33483427 [0,2,0,0,0,0|2,0,0]=4 10106 B13R1.90 CC(C)COc1ccccc1CBr Amb8835554 [0,2,0,0,0,0|2,0,0]=4 10107 B13R1.90 CC(N)CCc1ccccc1C#N Amb26375283 [0,2,0,0,0,0|2,0,0]=4 10108 B13R1.90 CC(O)CCc1ccccc1C#N Amb33314664 [0,2,0,0,0,0|2,0,0]=4 10109 B13R1.90 CCc1ccccc1CCC(C)=O Amb18196347 [0,2,0,0,0,0|2,0,0]=4 10110 B13R1.90 CCc1ccccc1CCC(C)N Amb33474276 [0,2,0,0,0,0|2,0,0]=4 10111 B13R1.90 CCc1ccccc1CCC(C)O Amb32953763 [0,2,0,0,0,0|2,0,0]=4 10112 B13R1.90 CCc1ccccc1CC[C@@H](C)N Amb33449220 [0,2,0,0,0,0|2,0,0]=4 10113 B13R1.90 CCc1ccccc1CC[C@@H](C)O Amb33198991 [0,2,0,0,0,0|2,0,0]=4 10114 B13R1.90 CCc1ccccc1CC[C@H](C)N Amb32954758 [0,2,0,0,0,0|2,0,0]=4 10115 B13R1.90 CCc1ccccc1CC[C@H](C)O Amb33198992 [0,2,0,0,0,0|2,0,0]=4 10116 B13R1.90 CN(C)CCc1ccccc1C=O Amb18127996 [0,2,0,0,0,0|1,0,0]=3 10117 B13R1.90 CN(C)CCc1ccccc1CO Amb26304169 [0,2,0,0,0,0|1,0,0]=3 10118 B13R1.90 CN(C)NCc1ccccc1C#N Amb27235737 [0,2,0,0,0,0|2,0,0]=4 10119 B13R1.90 COc1ccccc1CCC(C)=O Amb17400663 [0,2,0,0,0,0|2,0,0]=4 10120 B13R1.90 COc1ccccc1CCC(C)N Amb17507289 [0,2,0,0,0,0|2,0,0]=4 10121 B13R1.90 COc1ccccc1CCC(C)O Amb17507225 [0,2,0,0,0,0|2,0,0]=4 10122 B13R1.90 COc1ccccc1CCN(C)N Amb18564139 [0,2,0,0,0,0|1,0,0]=3 10123 B13R1.90 COc1ccccc1CC[C@@H](C)N Amb33359274 [0,2,0,0,0,0|2,0,0]=4 10124 B13R1.90 COc1ccccc1CC[C@@H](C)O Amb33362085 [0,2,0,0,0,0|2,0,0]=4 10125 B13R1.90 COc1ccccc1CC[C@H](C)N Amb33359070 [0,2,0,0,0,0|2,0,0]=4 10126 B13R1.90 COc1ccccc1CC[C@H](C)O Amb33362086 [0,2,0,0,0,0|2,0,0]=4 10127 B13R1.90 CSc1ccccc1CCC(C)=O Amb32876726 [0,2,0,0,0,0|2,0,0]=4 10128 B13R1.90 CSc1ccccc1CCC(C)N Amb33223792 [0,2,0,0,0,0|2,0,0]=4 10129 B13R1.90 CSc1ccccc1CCC(C)O Amb33465850 [0,2,0,0,0,0|2,0,0]=4 10130 B13R1.90 CSc1ccccc1CC[C@@H](C)N Amb33449930 [0,2,0,0,0,0|2,0,0]=4 10131 B13R1.90 CSc1ccccc1CC[C@@H](C)O Amb33465848 [0,2,0,0,0,0|2,0,0]=4 10132 B13R1.90 CSc1ccccc1CC[C@H](C)N Amb33358733 [0,2,0,0,0,0|2,0,0]=4 10133 B13R1.90 CSc1ccccc1CC[C@H](C)O Amb33465849 [0,2,0,0,0,0|2,0,0]=4 10134 B13R1.90 C[C@@H](N)CCc1ccccc1C#N Amb27817737 [0,2,0,0,0,0|2,0,0]=4 10135 B13R1.90 C[C@@H](O)CCc1ccccc1C#N Amb33314661 [0,2,0,0,0,0|2,0,0]=4 10136 B13R1.90 C[C@H](N)CCc1ccccc1C#N Amb27196185 [0,2,0,0,0,0|2,0,0]=4 10137 B13R1.90 C[C@H](O)CCc1ccccc1C#N Amb33314662 [0,2,0,0,0,0|2,0,0]=4 10138 B13R1.91 C#Cc1ccccc1CC(N)CC Amb28196693 [0,2,0,0,0,0|2,0,0]=4 10139 B13R1.91 CCc1ccccc1CC(=O)NC Amb28051004 [0,2,0,0,0,0|1,0,1]=4 10140 B13R1.91 CNC(=N)Cc1ccccc1OC Amb27489338 [0,2,0,0,0,0|1,0,1]=4 10141 B13R1.91 CNC(=O)Cc1ccccc1CCl Amb27639291 [0,2,0,0,0,0|0,1,1]=4 10142 B13R1.91 CNC(=O)Cc1ccccc1NC Amb18303208 [0,2,0,0,0,0|1,0,1]=4 10143 B13R1.91 CNC(=O)Cc1ccccc1SC Amb27604985 [0,2,0,0,0,0|1,0,1]=4 10144 B13R1.91 CNC(C)Cc1ccccc1OC Amb3940073 [0,2,0,0,0,0|1,0,0]=3 10145 B13R1.91 CNC(C)Cc1ccccc1OC Amb6366247 [0,2,0,0,0,0|1,0,0]=3 10146 B13R1.91 COC(=O)Cc1ccccc1CBr Amb20621573 [0,2,0,0,0,0|1,0,1]=4 10147 B13R1.464 C#Cc1ccccc1C(=O)CNC Amb33204325 [0,2,0,0,0,0|1,0,1]=4 10148 B13R1.464 C#Cc1ccccc1C(O)CNC Amb33204326 [0,2,0,0,0,0|1,0,0]=3 10149 B13R1.464 CCCC(Cl)c1ccccc1OC Amb17139741 [0,2,0,0,0,0|2,0,0]=4 10150 B13R1.464 CCCC(N)c1ccccc1OC Amb17233600 [0,2,0,0,0,0|2,0,0]=4 10151 B13R1.464 CCCC(N)c1ccccc1OC Amb35746798 [0,2,0,0,0,0|2,0,0]=4 10152 B13R1.464 CCCC(O)c1ccccc1OC Amb17138973 [0,2,0,0,0,0|2,0,0]=4 10153 B13R1.464 CCc1ccccc1C(=O)CNC Amb33449013 [0,2,0,0,0,0|1,0,1]=4 10154 B13R1.464 CCc1ccccc1C(O)CNC Amb19031256 [0,2,0,0,0,0|1,0,0]=3 10155 B13R1.464 CNCC(=O)c1ccccc1C#N Amb26444206 [0,2,0,0,0,0|1,0,1]=4 10156 B13R1.464 CNCC(=O)c1ccccc1OC Amb17233535 [0,2,0,0,0,0|1,0,1]=4 10157 B13R1.464 CNCC(=O)c1ccccc1SC Amb33448730 [0,2,0,0,0,0|1,0,1]=4 10158 B13R1.464 CNCC(C)c1ccccc1OC Amb17233593 [0,2,0,0,0,0|1,0,0]=3 10159 B13R1.464 CNCC(O)c1ccccc1C#N Amb26965088 [0,2,0,0,0,0|1,0,0]=3 10160 B13R1.464 CNCC(O)c1ccccc1OC Amb5750900 [0,2,0,0,0,0|1,0,0]=3 10161 B13R1.464 CNCC(O)c1ccccc1SC Amb33079000 [0,2,0,0,0,0|1,0,0]=3 10162 B13R1.464 CNCC(O)c1cccnc1OC Amb33359153 [0,2,0,0,0,0|2,0,0]=4 10163 B13R1.464 CNCC(O)c1ncccc1OC Amb33429479 [0,2,0,0,0,0|2,0,0]=4 10164 B13R1.464 COC[C@@H](N)c1ccccc1C#N Amb27205094 [0,2,0,0,0,0|2,0,0]=4 10165 B13R1.464 COc1ccccc1C(O)CNN Amb17233903 [0,2,0,0,0,0|2,0,0]=4 10166 B13R1.464 COc1ccccc1C(O)CNO Amb17335611 [0,2,0,0,0,0|2,0,0]=4 10167 B13R1.485 CCOc1ccccc1CCNC Amb17400734 [0,2,0,0,0,0|1,0,0]=3 10168 B13R1.485 CNCCc1ccccc1COC Amb33133304 [0,2,0,0,0,0|1,0,0]=3 10169 B13R1.556 CNCCc1cc(Br)ccc1OC Amb17410972 [0,2,0,0,0,0|1,0,0]=3 10170 B13R1.556 CNCCc1cc(Br)cnc1OC Amb33434023 [0,2,0,0,0,0|2,0,0]=4 10171 B13R1.556 CNCCc1cc(C)ccc1OC Amb17400741 [0,2,0,0,0,0|1,0,0]=3 10172 B13R1.556 CNCCc1cc(C)ccc1SC Amb18942644 [0,2,0,0,0,0|1,0,0]=3 10173 B13R1.556 CNCCc1cc(Cl)ccc1OC Amb17402332 [0,2,0,0,0,0|1,0,0]=3 10174 B13R1.556 CNCCc1cc(Cl)ccc1SC Amb18277030 [0,2,0,0,0,0|1,0,0]=3 10175 B13R1.556 CNCCc1cc(F)ccc1OC Amb17400985 [0,2,0,0,0,0|1,0,0]=3 10176 B13R1.556 COc1ccc(Br)cc1CCNN Amb17411225 [0,2,0,0,0,0|2,0,0]=4 10177 B13R1.556 COc1ccc(C)cc1CCNN Amb17400820 [0,2,0,0,0,0|2,0,0]=4 10178 B13R1.556 COc1ccc(Cl)cc1CCNN Amb17402384 [0,2,0,0,0,0|2,0,0]=4 10179 B13R1.556 COc1ccc(F)cc1CCNN Amb17401017 [0,2,0,0,0,0|2,0,0]=4 10180 B13R1.556 N#CCCc1cc(Br)ccc1CBr Amb24628303 [0,2,0,0,0,0|2,0,0]=4 10181 B13R1.556 N#CCCc1cc(Cl)ccc1CBr Amb27229509 [0,2,0,0,0,0|2,0,0]=4 10182 B13R1.572 CCCCc1ccccc1C(=O)O Amb32951200 [0,2,0,0,0,0|2,0,0]=4 10183 B13R1.572 CCCCc1ccccc1S(=O)[O-] Amb21964852 [0,2,0,0,0,0|2,0,0]=4 10184 B13R1.572 CCCCc1ccccc1[N+](=O)[O-] Amb22493937 [0,2,0,0,0,0|2,0,0]=4 10185 B13R1.572 CNCCc1ccccc1C(=O)O Amb28600353 [0,2,0,0,0,0|1,0,0]=3 10186 B13R1.572 CNCCc1ccccc1C(=O)O Amb32718804 [0,2,0,0,0,0|1,0,0]=3 10187 B13R1.572 CNCCc1ccccc1C(C)C Amb33359353 [0,2,0,0,0,0|1,0,0]=3 10188 B13R1.572 CNCCc1ccccc1N(C)C Amb32881450 [0,2,0,0,0,0|1,0,0]=3 10189 B13R1.572 CNCCc1ccccc1[N+](=O)[O-] Amb28555890 [0,2,0,0,0,0|1,0,0]=3 10190 B13R1.572 CNCCc1cccnc1N(C)C Amb33142974 [0,2,0,0,0,0|2,0,0]=4 10191 B13R1.572 COCCc1ccccc1B(O)O Amb28984145 [0,2,0,0,0,0|2,0,0]=4 10192 B13R1.572 COCCc1ccccc1C(=O)O Amb33191750 [0,2,0,0,0,0|2,0,0]=4 10193 B13R1.572 COCCc1ccccc1[N+](=O)[O-] Amb32409777 [0,2,0,0,0,0|2,0,0]=4 10194 B13R1.1619 C#CCCc1c(Br)cccc1OC Amb33451989 [0,2,0,0,0,0|1,0,1]=4 10195 B13R1.1619 CCCCc1c(F)cccc1CCl Amb32696613 [0,2,0,0,0,0|1,1,0]=4 10196 B13R1.1619 CCCOc1c(Br)cccc1CN Amb32411432 [0,2,0,0,0,0|2,0,0]=4 10197 B13R1.1619 CNCCc1c(Br)cccc1OC Amb33452140 [0,2,0,0,0,0|0,0,0]=2 10198 B13R1.1619 CNCCc1c(Br)cncc1OC Amb33389559 [0,2,0,0,0,0|1,0,0]=3 10199 B13R1.1619 CNCCc1c(C)cccc1OC Amb33447831 [0,2,0,0,0,0|1,0,0]=3 10200 B13R1.1619 CNCCc1c(Cl)cccc1OC Amb33406662 [0,2,0,0,0,0|0,1,0]=3 10201 B13R1.1619 CNCCc1c(F)cccc1OC Amb33202278 [0,2,0,0,0,0|0,1,0]=3 10202 B13R1.1619 COc1cccc(Br)c1CCC#N Amb27462395 [0,2,0,0,0,0|2,0,0]=4 10203 B13R1.1619 COc1cccc(Br)c1CCC=O Amb33451336 [0,2,0,0,0,0|2,0,0]=4 10204 B13R1.1619 COc1cccc(Br)c1CCCN Amb33452139 [0,2,0,0,0,0|2,0,0]=4 10205 B13R1.1619 COc1cccc(Br)c1CCCO Amb33451991 [0,2,0,0,0,0|2,0,0]=4 10206 B13R1.1619 COc1cccc(Br)c1CCCS Amb33430159 [0,2,0,0,0,0|2,0,0]=4 10207 B13R1.1619 COc1cccc(Br)c1CCON Amb33451749 [0,2,0,0,0,0|2,0,0]=4 10208 B13R1.1619 CSc1cccc(Br)c1CCC#N Amb27642585 [0,2,0,0,0,0|2,0,0]=4 10209 B13R1.1619 N#CCCc1c(Br)cccc1CBr Amb27240116 [0,2,0,0,0,0|2,0,0]=4 10210 B13R1.1619 N#CCCc1c(Br)cccc1CCl Amb25996863 [0,2,0,0,0,0|2,0,0]=4 10211 B13R1.1619 N#CCCc1c(Br)cccc1CF Amb26919169 [0,2,0,0,0,0|2,0,0]=4 10212 B13R1.1619 N#CCCc1c(Cl)cccc1CBr Amb27259729 [0,2,0,0,0,0|2,0,0]=4 10213 B13R1.1619 N#CCCc1c(F)cccc1CBr Amb27239222 [0,2,0,0,0,0|2,0,0]=4 10214 B13R1.1619 N#Cc1cccc(Br)c1CCCBr Amb27796527 [0,2,0,0,0,0|2,0,0]=4 10215 B13R1.1619 N#Cc1cccc(Br)c1CCCCl Amb27965770 [0,2,0,0,0,0|2,0,0]=4 10216 B13R1.1619 [C-]#[N+]CCc1c(Br)cccc1OC Amb33451710 [0,2,0,0,0,0|0,0,2]=4 10217 B13R1.157 CC(C)(C)CCc1ccccc1N Amb25189694 [0,2,0,0,0,0|2,0,0]=4 10218 B13R1.157 CC(C)(C)CNc1ccccc1Br Amb17255969 [0,2,0,0,0,0|2,0,0]=4 10219 B13R1.157 CC(C)(C)COc1ccccc1Br Amb17256460 [0,2,0,0,0,0|2,0,0]=4 10220 B13R1.157 CC(C)(C)NCc1ccccc1Br Amb10203716 [0,2,0,0,0,0|2,0,0]=4 10221 B13R1.157 CC(C)(C)NCc1ccccc1Br Amb4313362 [0,2,0,0,0,0|2,0,0]=4 10222 B13R1.157 CC(C)(C)OCc1ccccc1Br Amb27426533 [0,2,0,0,0,0|2,0,0]=4 10223 B13R1.157 CC(C)(C)SCc1ccccc1Br Amb27882295 [0,2,0,0,0,0|2,0,0]=4 10224 B13R1.157 CC(C)(F)CCc1ccccc1Br Amb27633386 [0,2,0,0,0,0|1,0,0]=3 10225 B13R1.157 CC(C)(N)CCc1ccccc1Br Amb18576728 [0,2,0,0,0,0|1,0,0]=3 10226 B13R1.157 CC(C)(N)CCc1ccccc1Cl Amb17337260 [0,2,0,0,0,0|1,1,0]=4 10227 B13R1.157 CC(C)(N)CCc1ccccc1F Amb17335507 [0,2,0,0,0,0|1,1,0]=4 10228 B13R1.157 CC(C)(N)CCc1ccccc1O Amb26850238 [0,2,0,0,0,0|2,0,0]=4 10229 B13R1.157 CC(C)(N)CCc1cccnc1Br Amb33387800 [0,2,0,0,0,0|2,0,0]=4 10230 B13R1.157 CC(C)(N)CCc1ccncc1Br Amb33227498 [0,2,0,0,0,0|2,0,0]=4 10231 B13R1.157 CC(C)(N)CCc1ncccc1Br Amb33336086 [0,2,0,0,0,0|2,0,0]=4 10232 B13R1.157 CC(C)(N)CNc1ccccc1Br Amb25180530 [0,2,0,0,0,0|2,0,0]=4 10233 B13R1.157 CC(C)(N)COc1ccccc1Br Amb17074742 [0,2,0,0,0,0|2,0,0]=4 10234 B13R1.157 CC(C)(O)CCc1ccccc1Cl Amb17337364 [0,2,0,0,0,0|1,1,0]=4 10235 B13R1.157 CC(C)(O)CCc1ccccc1F Amb17335553 [0,2,0,0,0,0|1,1,0]=4 10236 B13R1.157 CC(C)(O)CCc1ccccc1O Amb2780285 [0,2,0,0,0,0|2,0,0]=4 10237 B13R1.157 CC(C)(O)CNc1ccccc1Br Amb17159569 [0,2,0,0,0,0|2,0,0]=4 10238 B13R1.157 CC(F)(F)CCc1ccccc1O Amb28198671 [0,2,0,0,0,0|2,0,0]=4 10239 B13R1.157 CC(F)(F)COc1ccccc1Br Amb24627443 [0,2,0,0,0,0|2,0,0]=4 10240 B13R1.157 CC(F)(F)CSc1ccccc1Br Amb27443151 [0,2,0,0,0,0|2,0,0]=4 10241 B13R1.157 CS(=N)(=O)NCc1ccccc1Br Amb35715455 [0,2,0,0,0,0|2,0,0]=4 10242 B13R1.157 CS(=O)(=O)CCc1ccccc1N Amb18299123 [0,2,0,0,0,0|2,0,0]=4 10243 B13R1.157 CS(=O)(=O)CCc1ccccc1O Amb18130700 [0,2,0,0,0,0|2,0,0]=4 10244 B13R1.157 CS(=O)(=O)NCc1ccccc1Br Amb6505129 [0,2,0,0,0,0|2,0,0]=4 10245 B13R1.157 C[Si](C)(C)CCc1ccccc1N Amb27758719 [0,2,0,0,0,0|2,0,0]=4 10246 B13R1.157 C[Si](C)(C)CNc1ccccc1Br Amb30011207 [0,2,0,0,0,0|2,0,0]=4 10247 B13R1.157 Cc1ccccc1CCC(C)(C)N Amb17335194 [0,2,0,0,0,0|2,0,0]=4 10248 B13R1.157 Cc1ccccc1CCC(C)(C)O Amb17335251 [0,2,0,0,0,0|2,0,0]=4 10249 B13R1.157 FC(F)(F)CCc1ccccc1Br Amb20669830 [0,2,0,0,0,0|2,0,0]=4 10250 B13R1.157 NS(=O)(=O)CCc1ccccc1Br Amb25153326 [0,2,0,0,0,0|2,0,0]=4 10251 B13R1.157 O=S(=O)(Cl)CCc1ccccc1Br Amb22371483 [0,2,0,0,0,0|2,0,0]=4 10252 B13R1.157 O=S(=O)(F)CCc1ccccc1Br Amb27249870 [0,2,0,0,0,0|2,0,0]=4 10253 B13R1.157 O=S(=O)([O-])CCc1ccccc1Br Amb32413757 [0,2,0,0,0,0|2,0,0]=4 10254 B13R1.201 C=C(C)CC(=O)c1ccccc1Br Amb18071275 [0,2,0,0,0,0|1,0,1]=4 10255 B13R1.201 C=C(C)CC(Cl)c1ccccc1Cl Amb28042893 [0,2,0,0,0,0|1,1,0]=4 10256 B13R1.201 C=C(C)CC(O)c1ccccc1Br Amb28454898 [0,2,0,0,0,0|1,0,0]=3 10257 B13R1.201 C=C(C)C[C@@H](N)c1ccccc1Cl Amb27447313 [0,2,0,0,0,0|1,1,0]=4 10258 B13R1.201 C=C(C)C[C@@H](N)c1ccccc1I Amb27788457 [0,2,0,0,0,0|1,1,0]=4 10259 B13R1.201 C=C(C)C[C@H](N)c1ccccc1C Amb28132463 [0,2,0,0,0,0|2,0,0]=4 10260 B13R1.201 C=C(C)C[C@H](N)c1ccccc1O Amb27620372 [0,2,0,0,0,0|2,0,0]=4 10261 B13R1.201 C=C(C)C[C@H](N)c1cccnc1Br Amb28142388 [0,2,0,0,0,0|2,0,0]=4 10262 B13R1.201 CC(=O)CC(=O)c1ccccc1Br Amb7766265 [0,2,0,0,0,0|1,0,1]=4 10263 B13R1.201 CC(=O)CC(C)c1ccccc1F Amb28243768 [0,2,0,0,0,0|1,1,0]=4 10264 B13R1.201 CC(=O)CC(C)c1ccccc1O Amb28054397 [0,2,0,0,0,0|2,0,0]=4 10265 B13R1.201 CC(=O)CC(O)c1ccccc1F Amb27432175 [0,2,0,0,0,0|1,1,0]=4 10266 B13R1.201 CC(=O)CS(=O)c1ccccc1Br Amb27587792 [0,2,0,0,0,0|2,0,0]=4 10267 B13R1.201 CC(=O)NC(C)c1ccccc1Br Amb13955929 [0,2,0,0,0,0|2,0,0]=4 10268 B13R1.201 CC(=O)OC(C)c1ccccc1Br Amb28206970 [0,2,0,0,0,0|2,0,0]=4 10269 B13R1.201 CC(Br)CC(C)c1ccccc1F Amb28324627 [0,2,0,0,0,0|1,1,0]=4 10270 B13R1.201 CC(C)CC(=O)c1ccccc1Br Amb17348647 [0,2,0,0,0,0|1,0,1]=4 10271 B13R1.201 CC(C)CC(C)c1ccccc1N Amb27152226 [0,2,0,0,0,0|2,0,0]=4 10272 B13R1.201 CC(C)CC(N)c1ccccc1Cl Amb17236702 [0,2,0,0,0,0|1,1,0]=4 10273 B13R1.201 CC(C)CC(N)c1ccccc1F Amb17233837 [0,2,0,0,0,0|1,1,0]=4 10274 B13R1.201 CC(C)CC(N)c1ccccc1N Amb17608154 [0,2,0,0,0,0|2,0,0]=4 10275 B13R1.201 CC(C)CC(N)c1cccnc1Br Amb27629781 [0,2,0,0,0,0|2,0,0]=4 10276 B13R1.201 CC(C)CC(N)c1ccncc1Br Amb27491418 [0,2,0,0,0,0|2,0,0]=4 10277 B13R1.201 CC(C)CC(O)c1ccccc1Cl Amb17236852 [0,2,0,0,0,0|1,1,0]=4 10278 B13R1.201 CC(C)CC(O)c1ccccc1F Amb17233911 [0,2,0,0,0,0|1,1,0]=4 10279 B13R1.201 CC(C)CC(O)c1cccnc1Br Amb35702474 [0,2,0,0,0,0|2,0,0]=4 10280 B13R1.201 CC(C)C[C@@H](N)c1ccccc1Cl Amb27440515 [0,2,0,0,0,0|1,1,0]=4 10281 B13R1.201 CC(C)C[C@@H](N)c1ccccc1I Amb28142334 [0,2,0,0,0,0|1,1,0]=4 10282 B13R1.201 CC(C)C[C@@H](N)c1ccccc1O Amb27489189 [0,2,0,0,0,0|2,0,0]=4 10283 B13R1.201 CC(C)C[C@@H](N)c1cccnc1Br Amb28142333 [0,2,0,0,0,0|2,0,0]=4 10284 B13R1.201 CC(C)C[C@H](N)c1ccccc1I Amb27440431 [0,2,0,0,0,0|1,1,0]=4 10285 B13R1.201 CC(C)NC(C)c1ccccc1Br Amb6685450 [0,2,0,0,0,0|2,0,0]=4 10286 B13R1.201 CC(C)SC(C)c1ccccc1Br Amb27586094 [0,2,0,0,0,0|2,0,0]=4 10287 B13R1.201 CC(CC(=O)O)c1ccccc1Br Amb19293241 [0,2,0,0,0,0|2,0,0]=4 10288 B13R1.201 CC(CC(N)=O)c1ccccc1Br Amb28345259 [0,2,0,0,0,0|2,0,0]=4 10289 B13R1.201 CC(Cl)CC(C)c1ccccc1Cl Amb28243717 [0,2,0,0,0,0|1,1,0]=4 10290 B13R1.201 CC(N)CC(O)c1ccccc1Br Amb28122640 [0,2,0,0,0,0|1,0,0]=3 10291 B13R1.201 CC(N)CC(O)c1ccccc1Cl Amb27609230 [0,2,0,0,0,0|1,1,0]=4 10292 B13R1.201 CC(N)CN(C)c1ccccc1Br Amb26907335 [0,2,0,0,0,0|2,0,0]=4 10293 B13R1.201 CC(NN(C)C)c1ccccc1Cl Amb28059427 [0,2,0,0,0,0|1,1,0]=4 10294 B13R1.201 CC(NN(C)C)c1ccccc1F Amb27825965 [0,2,0,0,0,0|1,1,0]=4 10295 B13R1.201 CC(O)CC(C)c1ccccc1Cl Amb28069703 [0,2,0,0,0,0|1,1,0]=4 10296 B13R1.201 CC(O)CN(C)c1ccccc1Br Amb17349691 [0,2,0,0,0,0|2,0,0]=4 10297 B13R1.201 CN(C)CC(=O)c1ccccc1N Amb27954261 [0,2,0,0,0,0|1,0,1]=4 10298 B13R1.201 CN(C)CC(Cl)c1ccccc1F Amb2608953 [0,2,0,0,0,0|0,1,0]=3 10299 B13R1.201 CN(C)CC(Cl)c1ccccc1I Amb2614506 [0,2,0,0,0,0|0,1,0]=3 10300 B13R1.201 CN(C)CC(F)c1ccccc1N Amb28189413 [0,2,0,0,0,0|1,0,0]=3 10301 B13R1.201 CN(C)CC(F)c1ccccc1O Amb27448126 [0,2,0,0,0,0|1,0,0]=3 10302 B13R1.201 CN(C)CC(N)c1ccccc1Br Amb25071594 [0,2,0,0,0,0|0,0,0]=2 10303 B13R1.201 CN(C)CC(N)c1ccccc1F Amb1130761 [0,2,0,0,0,0|0,1,0]=3 10304 B13R1.201 CN(C)CC(N)c1cccnc1N Amb27238333 [0,2,0,0,0,0|2,0,0]=4 10305 B13R1.201 CN(C)CC(O)c1ccccc1Cl Amb2614499 [0,2,0,0,0,0|0,1,0]=3 10306 B13R1.201 CN(C)CC(O)c1ccccc1F Amb17104285 [0,2,0,0,0,0|0,1,0]=3 10307 B13R1.201 CN(C)CC(O)c1ccccc1I Amb2614508 [0,2,0,0,0,0|0,1,0]=3 10308 B13R1.201 C\C(=N\N(C)C)c1ccccc1Br Amb27977520 [0,2,0,0,0,0|1,0,1]=4 10309 B13R1.201 Cc1ccccc1C(C)CC(C)O Amb27397078 [0,2,0,0,0,0|2,0,0]=4 10310 B13R1.201 Cc1ccccc1C(Cl)CC(C)C Amb27589204 [0,2,0,0,0,0|2,0,0]=4 10311 B13R1.201 Cc1ccccc1C(N)CC(C)C Amb17233357 [0,2,0,0,0,0|2,0,0]=4 10312 B13R1.201 Cc1ccccc1C(N)CN(C)C Amb1125486 [0,2,0,0,0,0|1,0,0]=3 10313 B13R1.201 Cc1ccccc1C(N)CN(C)C Amb31217565 [0,2,0,0,0,0|1,0,0]=3 10314 B13R1.201 Cc1ccccc1C(O)CC(C)C Amb17233447 [0,2,0,0,0,0|2,0,0]=4 10315 B13R1.201 Cc1ccccc1C(O)CC(C)N Amb28201410 [0,2,0,0,0,0|2,0,0]=4 10316 B13R1.201 Cc1ccccc1C(O)CN(C)C Amb17104282 [0,2,0,0,0,0|1,0,0]=3 10317 B13R1.201 Cc1ccccc1[C@@H](N)CC(C)C Amb27850037 [0,2,0,0,0,0|2,0,0]=4 10318 B13R1.201 Cc1ccccc1[C@H](N)CC(C)C Amb28142407 [0,2,0,0,0,0|2,0,0]=4 10319 B13R1.201 Cc1ccncc1C(N)CN(C)C Amb28249298 [0,2,0,0,0,0|2,0,0]=4 10320 B13R1.201 NC(=O)CC(N)c1ccccc1Br Amb7800591 [0,2,0,0,0,0|2,0,0]=4 10321 B13R1.201 NC(=O)C[C@@H](N)c1ccccc1Br Amb25883935 [0,2,0,0,0,0|2,0,0]=4 10322 B13R1.201 NC(=O)C[C@H](N)c1ccccc1Br Amb27869896 [0,2,0,0,0,0|2,0,0]=4 10323 B13R1.201 NC(CC(=O)O)c1ccccc1Br Amb17659134 [0,2,0,0,0,0|2,0,0]=4 10324 B13R1.201 N[C@@H](CC(=O)O)c1ccccc1Br Amb20240882 [0,2,0,0,0,0|2,0,0]=4 10325 B13R1.201 N[C@H](CC(=O)O)c1ccccc1Br Amb25102891 [0,2,0,0,0,0|2,0,0]=4 10326 B13R1.201 O=C(O)CC(O)c1ccccc1Br Amb18298166 [0,2,0,0,0,0|2,0,0]=4 10327 B13R1.201 O=C(O)C[C@@H](O)c1ccccc1Br Amb24642857 [0,2,0,0,0,0|2,0,0]=4 10328 B13R1.201 O=C(O)C[C@H](O)c1ccccc1Br Amb25121791 [0,2,0,0,0,0|2,0,0]=4 10329 B13R1.202 C=C(C)C(=O)Cc1ccccc1Br Amb27778385 [0,2,0,0,0,0|1,0,1]=4 10330 B13R1.202 C=C(C)C(N)Cc1ccccc1F Amb27195513 [0,2,0,0,0,0|1,1,0]=4 10331 B13R1.202 C=C(C)C(O)Cc1ccccc1Br Amb27974945 [0,2,0,0,0,0|1,0,0]=3 10332 B13R1.202 C=C(C)C(O)Cc1ccccc1Cl Amb27617551 [0,2,0,0,0,0|1,1,0]=4 10333 B13R1.202 CC(=O)C(=O)Cc1ccccc1Br Amb27241132 [0,2,0,0,0,0|1,0,1]=4 10334 B13R1.202 CC(=O)C(Br)Cc1ccccc1Br Amb18601676 [0,2,0,0,0,0|1,0,0]=3 10335 B13R1.202 CC(=O)C(Br)Cc1ccccc1C Amb25154824 [0,2,0,0,0,0|2,0,0]=4 10336 B13R1.202 CC(=O)C(Br)Cc1ccccc1Cl Amb18589744 [0,2,0,0,0,0|1,1,0]=4 10337 B13R1.202 CC(=O)C(Br)Cc1ccccc1F Amb33530399 [0,2,0,0,0,0|1,1,0]=4 10338 B13R1.202 CC(=O)C(Br)Cc1ccccc1I Amb28381308 [0,2,0,0,0,0|1,1,0]=4 10339 B13R1.202 CC(=O)C(Br)Cc1ccccc1O Amb17507801 [0,2,0,0,0,0|2,0,0]=4 10340 B13R1.202 CC(=O)C(C)Cc1ccccc1C Amb17233203 [0,2,0,0,0,0|2,0,0]=4 10341 B13R1.202 CC(=O)C(C)Cc1ccccc1Cl Amb17236507 [0,2,0,0,0,0|1,1,0]=4 10342 B13R1.202 CC(=O)C(C)Cc1ccccc1F Amb17233678 [0,2,0,0,0,0|1,1,0]=4 10343 B13R1.202 CC(=O)C(C)Sc1ccccc1Br Amb9230774 [0,2,0,0,0,0|2,0,0]=4 10344 B13R1.202 CC(=O)C(Cl)Cc1ccccc1Br Amb17204824 [0,2,0,0,0,0|1,0,0]=3 10345 B13R1.202 CC(=O)C(Cl)Cc1ccccc1C Amb17204368 [0,2,0,0,0,0|2,0,0]=4 10346 B13R1.202 CC(=O)C(Cl)Cc1ccccc1Cl Amb4020125 [0,2,0,0,0,0|1,1,0]=4 10347 B13R1.202 CC(=O)C(Cl)Cc1ccccc1F Amb17204389 [0,2,0,0,0,0|1,1,0]=4 10348 B13R1.202 CC(=O)C(F)Cc1ccccc1Cl Amb28280408 [0,2,0,0,0,0|1,1,0]=4 10349 B13R1.202 CC(=O)C(N)Cc1ccccc1Br Amb18726733 [0,2,0,0,0,0|1,0,0]=3 10350 B13R1.202 CC(=O)C(N)Cc1ccccc1F Amb25079181 [0,2,0,0,0,0|1,1,0]=4 10351 B13R1.202 CC(C)C(=O)Cc1ccccc1Br Amb19374406 [0,2,0,0,0,0|1,0,1]=4 10352 B13R1.202 CC(C)C(Br)Cc1ccccc1Cl Amb28317870 [0,2,0,0,0,0|1,1,0]=4 10353 B13R1.202 CC(C)C(N)Cc1ccccc1Cl Amb17139687 [0,2,0,0,0,0|1,1,0]=4 10354 B13R1.202 CC(C)C(N)Cc1ccccc1F Amb17139010 [0,2,0,0,0,0|1,1,0]=4 10355 B13R1.202 CC(C)C(O)Cc1ccccc1Br Amb19288491 [0,2,0,0,0,0|1,0,0]=3 10356 B13R1.202 CC(C)C(O)Cc1ccccc1Cl Amb17139742 [0,2,0,0,0,0|1,1,0]=4 10357 B13R1.202 CC(C)C(O)Cc1ccccc1F Amb17139024 [0,2,0,0,0,0|1,1,0]=4 10358 B13R1.202 CC(Cc1ccccc1Br)C(=O)O Amb17605816 [0,2,0,0,0,0|2,0,0]=4 10359 B13R1.202 CC(Cc1cccnc1F)N(C)C Amb27490862 [0,2,0,0,0,0|1,1,0]=4 10360 B13R1.202 CC(Cl)C(C)Cc1ccccc1Br Amb27443401 [0,2,0,0,0,0|1,0,0]=3 10361 B13R1.202 CC(Cl)C(C)Cc1ccccc1Cl Amb28123866 [0,2,0,0,0,0|1,1,0]=4 10362 B13R1.202 CC(Cl)C(C)Cc1ccccc1F Amb18333928 [0,2,0,0,0,0|1,1,0]=4 10363 B13R1.202 CC(Cl)C(C)Cc1ncccc1Br Amb27978749 [0,2,0,0,0,0|2,0,0]=4 10364 B13R1.202 CC(F)C(N)Cc1ccccc1O Amb27965578 [0,2,0,0,0,0|2,0,0]=4 10365 B13R1.202 CC(N)C(C)Oc1ccccc1Br Amb29850593 [0,2,0,0,0,0|2,0,0]=4 10366 B13R1.202 CC(N)C(O)Cc1ccccc1Br Amb18155754 [0,2,0,0,0,0|1,0,0]=3 10367 B13R1.202 CC(N)C(O)Cc1ccccc1Cl Amb18187530 [0,2,0,0,0,0|1,1,0]=4 10368 B13R1.202 CC(N)C(O)Cc1ccccc1F Amb18191983 [0,2,0,0,0,0|1,1,0]=4 10369 B13R1.202 CC(N)C(O)Cc1ncccc1Br Amb30024014 [0,2,0,0,0,0|2,0,0]=4 10370 B13R1.202 CC(O)C(C)Cc1ccccc1Br Amb24430235 [0,2,0,0,0,0|1,0,0]=3 10371 B13R1.202 CC(O)C(C)Cc1ccccc1Cl Amb17236857 [0,2,0,0,0,0|1,1,0]=4 10372 B13R1.202 CC(O)C(C)Cc1ccccc1F Amb17233912 [0,2,0,0,0,0|1,1,0]=4 10373 B13R1.202 CC(O)C(C)Cc1ccncc1Br Amb32950501 [0,2,0,0,0,0|2,0,0]=4 10374 B13R1.202 CC(O)C(C)Cc1ncccc1Br Amb25344265 [0,2,0,0,0,0|2,0,0]=4 10375 B13R1.202 CC(O)C(C)Sc1ccccc1Br Amb27416116 [0,2,0,0,0,0|2,0,0]=4 10376 B13R1.202 CC(O)C(N)Cc1ccccc1Br Amb18155747 [0,2,0,0,0,0|1,0,0]=3 10377 B13R1.202 CC(Oc1ccccc1Br)[C@@H](C)N Amb29850591 [0,2,0,0,0,0|2,0,0]=4 10378 B13R1.202 CC(Oc1ccccc1Br)[C@@H](C)O Amb35695613 [0,2,0,0,0,0|2,0,0]=4 10379 B13R1.202 CC(Oc1ccccc1Br)[C@H](C)N Amb29850592 [0,2,0,0,0,0|2,0,0]=4 10380 B13R1.202 CC(Oc1ccccc1Br)[C@H](C)O Amb35695614 [0,2,0,0,0,0|2,0,0]=4 10381 B13R1.202 CN(C)C(=O)Cc1ccccc1Br Amb22001119 [0,2,0,0,0,0|0,0,1]=3 10382 B13R1.202 CN(C)C(=O)Cc1ccccc1Cl Amb15739661 [0,2,0,0,0,0|0,1,1]=4 10383 B13R1.202 CN(C)C(=O)Cc1ccccc1I Amb25926451 [0,2,0,0,0,0|0,1,1]=4 10384 B13R1.202 CN(C)C(=O)Cc1ccccc1N Amb1137686 [0,2,0,0,0,0|1,0,1]=4 10385 B13R1.202 CN(C)C(=O)Cc1ccccc1O Amb28364939 [0,2,0,0,0,0|1,0,1]=4 10386 B13R1.202 CN(C)C(=O)Nc1ccccc1Br Amb28410636 [0,2,0,0,0,0|1,0,1]=4 10387 B13R1.202 C[C@@H](N)C(=O)Cc1ccccc1Br Amb35618234 [0,2,0,0,0,0|1,0,1]=4 10388 B13R1.202 C[C@@H](N)C(O)Cc1ccccc1Br Amb35617956 [0,2,0,0,0,0|1,0,0]=3 10389 B13R1.202 C[C@@H](N)C(O)Cc1ccccc1Cl Amb35617935 [0,2,0,0,0,0|1,1,0]=4 10390 B13R1.202 C[C@@H](N)C(O)Cc1ccccc1F Amb35618091 [0,2,0,0,0,0|1,1,0]=4 10391 B13R1.202 C[C@@H](N)C(O)Cc1ncccc1Br Amb35738424 [0,2,0,0,0,0|2,0,0]=4 10392 B13R1.202 C[C@H](N)C(=O)Cc1ccccc1Br Amb35737859 [0,2,0,0,0,0|1,0,1]=4 10393 B13R1.202 C[C@H](N)C(O)Cc1ccccc1Br Amb35588775 [0,2,0,0,0,0|1,0,0]=3 10394 B13R1.202 C[C@H](N)C(O)Cc1ccccc1Cl Amb35588663 [0,2,0,0,0,0|1,1,0]=4 10395 B13R1.202 C[C@H](N)C(O)Cc1ccccc1F Amb35738408 [0,2,0,0,0,0|1,1,0]=4 10396 B13R1.202 C[C@H](N)C(O)Cc1ncccc1Br Amb35618082 [0,2,0,0,0,0|2,0,0]=4 10397 B13R1.202 Cc1ccccc1CC(=O)N(C)C Amb2106656 [0,2,0,0,0,0|1,0,1]=4 10398 B13R1.202 Cc1ccccc1CC(Br)C(C)C Amb28077604 [0,2,0,0,0,0|2,0,0]=4 10399 B13R1.202 Cc1ccccc1CC(C)C(C)O Amb17233449 [0,2,0,0,0,0|2,0,0]=4 10400 B13R1.202 Cc1ccccc1CC(C)N(C)C Amb27187943 [0,2,0,0,0,0|1,0,0]=3 10401 B13R1.202 Cc1ccccc1CC(N)C(C)C Amb17138831 [0,2,0,0,0,0|2,0,0]=4 10402 B13R1.202 Cc1ccccc1CC(O)C(C)C Amb17138886 [0,2,0,0,0,0|2,0,0]=4 10403 B13R1.202 Cc1ccccc1CC(O)C(C)N Amb35588468 [0,2,0,0,0,0|2,0,0]=4 10404 B13R1.202 Cc1ccccc1CC(O)[C@@H](C)N Amb35617958 [0,2,0,0,0,0|2,0,0]=4 10405 B13R1.202 Cc1ccccc1CC(O)[C@H](C)N Amb35588777 [0,2,0,0,0,0|2,0,0]=4 10406 B13R1.202 NC(=O)C(Cl)Cc1ccccc1Br Amb17204831 [0,2,0,0,0,0|2,0,0]=4 10407 B13R1.202 NC(=O)C(N)Cc1ccccc1Br Amb27436997 [0,2,0,0,0,0|2,0,0]=4 10408 B13R1.202 NC(Cc1ccccc1Br)C(=O)O Amb28963434 [0,2,0,0,0,0|2,0,0]=4 10409 B13R1.202 NC(Cc1ccccc1Br)C(=O)O Amb3790942 [0,2,0,0,0,0|2,0,0]=4 10410 B13R1.202 NC(Cc1ccccc1Br)C(F)F Amb25238069 [0,2,0,0,0,0|2,0,0]=4 10411 B13R1.202 N[C@@H](Cc1ccccc1Br)C(=O)O Amb6295856 [0,2,0,0,0,0|2,0,0]=4 10412 B13R1.202 N[C@H](Cc1ccccc1Br)C(=O)O Amb8389456 [0,2,0,0,0,0|2,0,0]=4 10413 B13R1.202 O=C(O)C(Br)Cc1ccccc1Br Amb22549389 [0,2,0,0,0,0|2,0,0]=4 10414 B13R1.202 O=C(O)C(Cl)Cc1ccccc1Br Amb17204843 [0,2,0,0,0,0|2,0,0]=4 10415 B13R1.202 O=C(O)C(F)Cc1ccccc1Br Amb27843640 [0,2,0,0,0,0|2,0,0]=4 10416 B13R1.202 O=C(O)C(O)Cc1ccccc1Br Amb26914266 [0,2,0,0,0,0|2,0,0]=4 10417 B13R1.528 CC(C#N)CNc1ccccc1Br Amb9028665 [0,2,0,0,0,0|2,0,0]=4 10418 B13R1.528 CC(C#N)COc1ccccc1Br Amb9024578 [0,2,0,0,0,0|2,0,0]=4 10419 B13R1.528 CC(CN)COc1ccccc1Br Amb9392446 [0,2,0,0,0,0|2,0,0]=4 10420 B13R1.528 CC(CO)COc1ccccc1Br Amb17257491 [0,2,0,0,0,0|2,0,0]=4 10421 B13R1.528 CC(CO)NCc1ccccc1Br Amb9359666 [0,2,0,0,0,0|2,0,0]=4 10422 B13R1.528 CC(COc1ccccc1Br)NN Amb18579100 [0,2,0,0,0,0|1,0,0]=3 10423 B13R1.528 CC(COc1ccccc1Cl)NN Amb18066549 [0,2,0,0,0,0|1,1,0]=4 10424 B13R1.528 CC(COc1ccccc1F)NN Amb18564283 [0,2,0,0,0,0|1,1,0]=4 10425 B13R1.528 CCC(=O)CCc1ccccc1C Amb9031664 [0,2,0,0,0,0|2,0,0]=4 10426 B13R1.528 CCC(=O)CCc1ccccc1Cl Amb9031682 [0,2,0,0,0,0|1,1,0]=4 10427 B13R1.528 CCC(=O)CCc1ccccc1F Amb9031685 [0,2,0,0,0,0|1,1,0]=4 10428 B13R1.528 CCC(=O)CSc1ccccc1Br Amb32682962 [0,2,0,0,0,0|1,0,1]=4 10429 B13R1.528 CCC(=O)NCc1ccccc1Br Amb2085745 [0,2,0,0,0,0|1,0,1]=4 10430 B13R1.528 CCC(C)CNc1ccccc1C Amb6620312 [0,2,0,0,0,0|2,0,0]=4 10431 B13R1.528 CCC(C)CNc1ccccc1Cl Amb6620185 [0,2,0,0,0,0|1,1,0]=4 10432 B13R1.528 CCC(C)CNc1ccccc1F Amb6644631 [0,2,0,0,0,0|1,1,0]=4 10433 B13R1.528 CCC(C)CNc1ccccc1N Amb19031071 [0,2,0,0,0,0|2,0,0]=4 10434 B13R1.528 CCC(C)CNc1cccnc1Br Amb28317411 [0,2,0,0,0,0|2,0,0]=4 10435 B13R1.528 CCC(C)CNc1ccncc1Br Amb27662976 [0,2,0,0,0,0|2,0,0]=4 10436 B13R1.528 CCC(C)NCc1ccccc1Br Amb2111114 [0,2,0,0,0,0|1,0,0]=3 10437 B13R1.528 CCC(C)NCc1ccccc1Br Amb6685937 [0,2,0,0,0,0|1,0,0]=3 10438 B13R1.528 CCC(C)NCc1ccccc1C Amb6542609 [0,2,0,0,0,0|2,0,0]=4 10439 B13R1.528 CCC(C)NCc1ccccc1C Amb9740382 [0,2,0,0,0,0|2,0,0]=4 10440 B13R1.528 CCC(C)NCc1ccccc1Cl Amb6542610 [0,2,0,0,0,0|1,1,0]=4 10441 B13R1.528 CCC(C)NCc1ccccc1Cl Amb6691811 [0,2,0,0,0,0|1,1,0]=4 10442 B13R1.528 CCC(C)NCc1ccccc1F Amb6865261 [0,2,0,0,0,0|1,1,0]=4 10443 B13R1.528 CCC(C)NCc1ccccc1F Amb9740538 [0,2,0,0,0,0|1,1,0]=4 10444 B13R1.528 CCC(C)NCc1ccccc1O Amb19890529 [0,2,0,0,0,0|2,0,0]=4 10445 B13R1.528 CCC(C)NCc1ccccc1O Amb9740429 [0,2,0,0,0,0|2,0,0]=4 10446 B13R1.528 CCC(Cl)CNc1ncccc1Br Amb27588541 [0,2,0,0,0,0|2,0,0]=4 10447 B13R1.528 CCC(F)CNc1ccccc1C Amb27853057 [0,2,0,0,0,0|2,0,0]=4 10448 B13R1.528 CCC(F)CNc1ccccc1I Amb27649930 [0,2,0,0,0,0|1,1,0]=4 10449 B13R1.528 CCC(N)CNc1ccncc1Br Amb27863226 [0,2,0,0,0,0|2,0,0]=4 10450 B13R1.528 CCC(N)CNc1ncccc1Br Amb27211613 [0,2,0,0,0,0|2,0,0]=4 10451 B13R1.528 CCC(N)COc1ccccc1Cl Amb18332680 [0,2,0,0,0,0|1,1,0]=4 10452 B13R1.528 CCC(N)COc1ccccc1Cl Amb32662253 [0,2,0,0,0,0|1,1,0]=4 10453 B13R1.528 CCC(N)COc1ccccc1F Amb18328168 [0,2,0,0,0,0|1,1,0]=4 10454 B13R1.528 CCC(N)COc1ccccc1F Amb19351287 [0,2,0,0,0,0|1,1,0]=4 10455 B13R1.528 CCC(O)CNc1ccccc1C Amb18304030 [0,2,0,0,0,0|2,0,0]=4 10456 B13R1.528 CC[C@@H](O)CNc1ccccc1Br Amb28365055 [0,2,0,0,0,0|1,0,0]=3 10457 B13R1.528 CC[C@@H](O)CNc1ccccc1C Amb27659614 [0,2,0,0,0,0|2,0,0]=4 10458 B13R1.528 CC[C@@H](O)CNc1ccccc1F Amb27854398 [0,2,0,0,0,0|1,1,0]=4 10459 B13R1.528 CC[C@@H](O)CNc1ccccc1I Amb28200230 [0,2,0,0,0,0|1,1,0]=4 10460 B13R1.528 CC[C@H](O)CNc1ccccc1Br Amb28382805 [0,2,0,0,0,0|1,0,0]=3 10461 B13R1.528 CC[C@H](O)CNc1ccccc1C Amb27188363 [0,2,0,0,0,0|2,0,0]=4 10462 B13R1.528 CNC(=N)CSc1ccccc1F Amb27665575 [0,2,0,0,0,0|0,1,1]=4 10463 B13R1.528 CNC(=N)NCc1ccccc1Cl Amb18325452 [0,2,0,0,0,0|0,1,1]=4 10464 B13R1.528 CNC(=O)CCc1ccccc1Cl Amb13957943 [0,2,0,0,0,0|0,1,0]=3 10465 B13R1.528 CNC(=O)CCc1ccccc1N Amb8941577 [0,2,0,0,0,0|1,0,0]=3 10466 B13R1.528 CNC(=O)CCc1ccccc1O Amb8333456 [0,2,0,0,0,0|1,0,0]=3 10467 B13R1.528 CNC(=O)CNc1ccccc1C Amb6714259 [0,2,0,0,0,0|1,0,1]=4 10468 B13R1.528 CNC(=O)COc1ccccc1Br Amb1174422 [0,2,0,0,0,0|0,0,1]=3 10469 B13R1.528 CNC(=O)COc1ccccc1Cl Amb8340723 [0,2,0,0,0,0|0,1,1]=4 10470 B13R1.528 CNC(=O)COc1ccccc1N Amb1121495 [0,2,0,0,0,0|1,0,1]=4 10471 B13R1.528 CNC(=O)COc1ccccc1O Amb1199497 [0,2,0,0,0,0|1,0,1]=4 10472 B13R1.528 CNC(=O)COc1cccnc1Br Amb11622994 [0,2,0,0,0,0|1,0,1]=4 10473 B13R1.528 CNC(=O)CSc1ccccc1C Amb27458330 [0,2,0,0,0,0|1,0,1]=4 10474 B13R1.528 CNC(=O)CSc1ccccc1Cl Amb8246920 [0,2,0,0,0,0|0,1,1]=4 10475 B13R1.528 CNC(=O)CSc1ccccc1F Amb8341742 [0,2,0,0,0,0|0,1,1]=4 10476 B13R1.528 CNC(=O)CSc1ccccc1N Amb6270099 [0,2,0,0,0,0|1,0,1]=4 10477 B13R1.528 CNC(=O)CSc1ccncc1Br Amb27812607 [0,2,0,0,0,0|1,0,1]=4 10478 B13R1.528 CNC(=O)NCc1ccccc1C Amb27949555 [0,2,0,0,0,0|1,0,1]=4 10479 B13R1.528 CNC(=O)NCc1ccccc1Cl Amb2132766 [0,2,0,0,0,0|0,1,1]=4 10480 B13R1.528 CNC(=O)NCc1ccccc1F Amb22584226 [0,2,0,0,0,0|0,1,1]=4 10481 B13R1.528 CNC(=S)NCc1ccccc1Br Amb27406359 [0,2,0,0,0,0|0,0,1]=3 10482 B13R1.528 CNC(=S)NCc1ccccc1O Amb27599127 [0,2,0,0,0,0|1,0,1]=4 10483 B13R1.528 CNC(C)CCc1ccccc1Cl Amb18321879 [0,2,0,0,0,0|0,1,0]=3 10484 B13R1.528 CNC(C)CCc1ccccc1F Amb19007575 [0,2,0,0,0,0|0,1,0]=3 10485 B13R1.528 CNC(C)CNc1ccncc1F Amb30036683 [0,2,0,0,0,0|1,1,0]=4 10486 B13R1.528 CNC(C)CNc1ncccc1Cl Amb28076225 [0,2,0,0,0,0|1,1,0]=4 10487 B13R1.528 COC(=N)CCc1ccccc1Br Amb18071214 [0,2,0,0,0,0|1,0,0]=3 10488 B13R1.528 COC(=N)CCc1ccccc1C Amb18065690 [0,2,0,0,0,0|2,0,0]=4 10489 B13R1.528 COC(=N)CCc1ccccc1Cl Amb18066439 [0,2,0,0,0,0|1,1,0]=4 10490 B13R1.528 COC(=N)CCc1ccccc1F Amb18066000 [0,2,0,0,0,0|1,1,0]=4 10491 B13R1.528 COC(=N)COc1ccccc1Br Amb18577242 [0,2,0,0,0,0|1,0,1]=4 10492 B13R1.528 COC(=O)CCc1ccccc1Br Amb10604254 [0,2,0,0,0,0|1,0,0]=3 10493 B13R1.528 COC(=O)CCc1ccccc1C Amb17400660 [0,2,0,0,0,0|2,0,0]=4 10494 B13R1.528 COC(=O)CCc1ccccc1Cl Amb17402275 [0,2,0,0,0,0|1,1,0]=4 10495 B13R1.528 COC(=O)CCc1ccccc1F Amb17400908 [0,2,0,0,0,0|1,1,0]=4 10496 B13R1.528 COC(=O)CCc1ccccc1N Amb33803798 [0,2,0,0,0,0|2,0,0]=4 10497 B13R1.528 COC(=O)CCc1ccccc1O Amb2722678 [0,2,0,0,0,0|2,0,0]=4 10498 B13R1.528 COC(=O)COc1ccccc1Br Amb844184 [0,2,0,0,0,0|1,0,1]=4 10499 B13R1.528 COC(C)CNc1ccccc1Cl Amb27257031 [0,2,0,0,0,0|1,1,0]=4 10500 B13R1.528 COC(C)CNc1ccccc1N Amb27165552 [0,2,0,0,0,0|2,0,0]=4 10501 B13R1.528 COC(C)CNc1cccnc1Br Amb28246500 [0,2,0,0,0,0|2,0,0]=4 10502 B13R1.528 Cc1ccccc1CCC(=O)CCl Amb17139632 [0,2,0,0,0,0|2,0,0]=4 10503 B13R1.528 Cc1ccccc1CCC(=O)CN Amb18564059 [0,2,0,0,0,0|2,0,0]=4 10504 B13R1.528 Cc1ccccc1CCC(=O)CO Amb18065752 [0,2,0,0,0,0|2,0,0]=4 10505 B13R1.528 Cc1ccccc1CCC(=O)NN Amb8387841 [0,2,0,0,0,0|2,0,0]=4 10506 B13R1.528 Cc1ccccc1CCC(N)CO Amb18065850 [0,2,0,0,0,0|2,0,0]=4 10507 B13R1.528 Cc1ccccc1CCC(O)CN Amb18065879 [0,2,0,0,0,0|2,0,0]=4 10508 B13R1.528 Cc1ccccc1OCC(C)NN Amb18065972 [0,2,0,0,0,0|2,0,0]=4 10509 B13R1.528 N#CC(N)COc1ccccc1Br Amb17076565 [0,2,0,0,0,0|2,0,0]=4 10510 B13R1.528 N#CC(N)CSc1ccccc1Br Amb27796834 [0,2,0,0,0,0|2,0,0]=4 10511 B13R1.528 NC(CO)CCc1ccccc1Br Amb18071604 [0,2,0,0,0,0|1,0,0]=3 10512 B13R1.528 NC(CO)CCc1ccccc1Cl Amb18066512 [0,2,0,0,0,0|1,1,0]=4 10513 B13R1.528 NC(CO)CCc1ccccc1F Amb18066104 [0,2,0,0,0,0|1,1,0]=4 10514 B13R1.528 NC(CO)COc1ccccc1Br Amb18579699 [0,2,0,0,0,0|2,0,0]=4 10515 B13R1.528 NCC(=O)CCc1ccccc1Br Amb18156124 [0,2,0,0,0,0|1,0,0]=3 10516 B13R1.528 NCC(=O)CCc1ccccc1Cl Amb18066458 [0,2,0,0,0,0|1,1,0]=4 10517 B13R1.528 NCC(=O)COc1ccccc1Br Amb18155770 [0,2,0,0,0,0|2,0,0]=4 10518 B13R1.528 NCC(=O)NCc1ccccc1Br Amb18977751 [0,2,0,0,0,0|2,0,0]=4 10519 B13R1.528 NCC(O)CCc1ccccc1Br Amb18155749 [0,2,0,0,0,0|1,0,0]=3 10520 B13R1.528 NCC(O)CCc1ccccc1Cl Amb18066529 [0,2,0,0,0,0|1,1,0]=4 10521 B13R1.528 NCC(O)CNc1ccccc1Br Amb9802654 [0,2,0,0,0,0|2,0,0]=4 10522 B13R1.528 NCC(O)COc1ccccc1Br Amb9722749 [0,2,0,0,0,0|2,0,0]=4 10523 B13R1.528 NNC(=O)CCc1ccccc1Br Amb24729756 [0,2,0,0,0,0|1,0,0]=3 10524 B13R1.528 NNC(=O)CCc1ccccc1F Amb27447821 [0,2,0,0,0,0|1,1,0]=4 10525 B13R1.528 NNC(=O)CCc1ccccc1O Amb1625126 [0,2,0,0,0,0|2,0,0]=4 10526 B13R1.528 NNC(=O)COc1ccccc1Br Amb32676724 [0,2,0,0,0,0|1,0,1]=4 10527 B13R1.528 NNC(=O)COc1ccccc1Br Amb6337024 [0,2,0,0,0,0|1,0,1]=4 10528 B13R1.528 NNC(=O)CSc1ccccc1Br Amb27662984 [0,2,0,0,0,0|1,0,1]=4 10529 B13R1.528 NNC(=S)NCc1ccccc1Br Amb27414537 [0,2,0,0,0,0|1,0,1]=4 10530 B13R1.528 Nc1ccccc1CCC(=O)NO Amb28364592 [0,2,0,0,0,0|2,0,0]=4 10531 B13R1.528 O=C(CBr)NCc1ccccc1Br Amb27242392 [0,2,0,0,0,0|2,0,0]=4 10532 B13R1.528 O=C(CCc1ccccc1Cl)NO Amb27826130 [0,2,0,0,0,0|1,1,0]=4 10533 B13R1.528 O=C(CCc1ccccc1O)NO Amb28182959 [0,2,0,0,0,0|2,0,0]=4 10534 B13R1.528 O=C(CCl)CCc1ccccc1Cl Amb17141004 [0,2,0,0,0,0|1,1,0]=4 10535 B13R1.528 O=C(CCl)CCc1ccccc1F Amb17139826 [0,2,0,0,0,0|1,1,0]=4 10536 B13R1.528 O=C(CCl)COc1ccccc1Br Amb17164620 [0,2,0,0,0,0|2,0,0]=4 10537 B13R1.528 O=C(CCl)NCc1ccccc1Br Amb10075557 [0,2,0,0,0,0|2,0,0]=4 10538 B13R1.528 O=C(CO)CCc1ccccc1Br Amb18576942 [0,2,0,0,0,0|1,0,0]=3 10539 B13R1.528 O=C(CO)CCc1ccccc1Cl Amb18066485 [0,2,0,0,0,0|1,1,0]=4 10540 B13R1.528 O=C(CO)CCc1ccccc1F Amb18564200 [0,2,0,0,0,0|1,1,0]=4 10541 B13R1.528 O=C(CO)COc1ccccc1Br Amb18072010 [0,2,0,0,0,0|2,0,0]=4 10542 B13R1.528 OC(CF)CNc1ccccc1Br Amb26021493 [0,2,0,0,0,0|2,0,0]=4 10543 B13R1.893 C=C(C)CNc1cc(Br)ccc1Br Amb27666461 [0,2,0,0,0,0|2,0,0]=4 10544 B13R1.893 C=C(C)CNc1cc(F)ccc1Br Amb27663858 [0,2,0,0,0,0|2,0,0]=4 10545 B13R1.893 C=C(C)COc1cc(C)ccc1Br Amb35663091 [0,2,0,0,0,0|2,0,0]=4 10546 B13R1.893 CC(=O)CCC1=CC(=O)C=CC1=O Amb27948551 [0,2,0,0,0,0|2,0,0]=4 10547 B13R1.893 CC(=O)CCc1cc(Br)ccc1C Amb27163154 [0,2,0,0,0,0|2,0,0]=4 10548 B13R1.893 CC(=O)CCc1cc(Br)ccc1Cl Amb25694289 [0,2,0,0,0,0|1,1,0]=4 10549 B13R1.893 CC(=O)CCc1cc(Br)ccc1F Amb9031571 [0,2,0,0,0,0|1,1,0]=4 10550 B13R1.893 CC(=O)CCc1cc(Br)ccc1O Amb28366437 [0,2,0,0,0,0|2,0,0]=4 10551 B13R1.893 CC(=O)CCc1cc(C)ccc1Br Amb25245067 [0,2,0,0,0,0|1,0,0]=3 10552 B13R1.893 CC(=O)CCc1cc(C)ccc1C Amb5740055 [0,2,0,0,0,0|2,0,0]=4 10553 B13R1.893 CC(=O)CCc1cc(C)ccc1Cl Amb26970143 [0,2,0,0,0,0|1,1,0]=4 10554 B13R1.893 CC(=O)CCc1cc(C)ccc1F Amb26460747 [0,2,0,0,0,0|1,1,0]=4 10555 B13R1.893 CC(=O)CCc1cc(C)ccc1O Amb28381175 [0,2,0,0,0,0|2,0,0]=4 10556 B13R1.893 CC(=O)CCc1cc(Cl)ccc1Br Amb27163262 [0,2,0,0,0,0|1,0,0]=3 10557 B13R1.893 CC(=O)CCc1cc(Cl)ccc1C Amb18066382 [0,2,0,0,0,0|2,0,0]=4 10558 B13R1.893 CC(=O)CCc1cc(Cl)ccc1Cl Amb18067060 [0,2,0,0,0,0|1,1,0]=4 10559 B13R1.893 CC(=O)CCc1cc(Cl)ccc1F Amb18225061 [0,2,0,0,0,0|1,1,0]=4 10560 B13R1.893 CC(=O)CCc1cc(Cl)ccc1I Amb29857022 [0,2,0,0,0,0|1,1,0]=4 10561 B13R1.893 CC(=O)CCc1cc(Cl)ccc1O Amb27781997 [0,2,0,0,0,0|2,0,0]=4 10562 B13R1.893 CC(=O)CCc1cc(Cl)ncc1Br Amb33478202 [0,2,0,0,0,0|2,0,0]=4 10563 B13R1.893 CC(=O)CCc1cc(F)ccc1Br Amb9031559 [0,2,0,0,0,0|1,0,0]=3 10564 B13R1.893 CC(=O)CCc1cc(F)ccc1C Amb25897372 [0,2,0,0,0,0|2,0,0]=4 10565 B13R1.893 CC(=O)CCc1cc(F)ccc1Cl Amb26940599 [0,2,0,0,0,0|1,1,0]=4 10566 B13R1.893 CC(=O)CCc1cc(F)ccc1F Amb19068669 [0,2,0,0,0,0|1,1,0]=4 10567 B13R1.893 CC(=O)CCc1cc(F)ccc1O Amb26062016 [0,2,0,0,0,0|2,0,0]=4 10568 B13R1.893 CC(=O)CCc1cc(N)ccc1C Amb26452657 [0,2,0,0,0,0|2,0,0]=4 10569 B13R1.893 CC(=O)CCc1cc(N)ccc1Cl Amb25158581 [0,2,0,0,0,0|1,1,0]=4 10570 B13R1.893 CC(=O)CCc1cc(O)ccc1Br Amb26358331 [0,2,0,0,0,0|1,0,0]=3 10571 B13R1.893 CC(=O)CCc1cc(O)ccc1C Amb25158631 [0,2,0,0,0,0|2,0,0]=4 10572 B13R1.893 CC(=O)CCc1cc(O)ccc1Cl Amb28410500 [0,2,0,0,0,0|1,1,0]=4 10573 B13R1.893 CC(=O)CCc1cc(O)ccc1F Amb24368852 [0,2,0,0,0,0|1,1,0]=4 10574 B13R1.893 CC(=O)CCc1cc(O)ccc1N Amb27239723 [0,2,0,0,0,0|2,0,0]=4 10575 B13R1.893 CC(=O)CCc1cc(O)ccc1O Amb18648342 [0,2,0,0,0,0|2,0,0]=4 10576 B13R1.893 CC(=O)COc1cc(C)ccc1Br Amb30016165 [0,2,0,0,0,0|2,0,0]=4 10577 B13R1.893 CC(=O)COc1cc(F)ccc1Br Amb27771871 [0,2,0,0,0,0|2,0,0]=4 10578 B13R1.893 CC(=O)OCc1cc(F)ccc1Br Amb28205664 [0,2,0,0,0,0|2,0,0]=4 10579 B13R1.893 CC(Br)CCc1cc(Cl)ccc1I Amb35689701 [0,2,0,0,0,0|1,1,0]=4 10580 B13R1.893 CC(Br)CCc1cc(F)ccc1Br Amb27662556 [0,2,0,0,0,0|1,0,0]=3 10581 B13R1.893 CC(C)CCc1cc(N)ccc1O Amb28145860 [0,2,0,0,0,0|2,0,0]=4 10582 B13R1.893 CC(C)CNc1cc(F)ccc1Br Amb27495364 [0,2,0,0,0,0|2,0,0]=4 10583 B13R1.893 CC(C)CNc1cc(I)ccc1Br Amb27760803 [0,2,0,0,0,0|2,0,0]=4 10584 B13R1.893 CC(C)COc1cc(Cl)ccc1Br Amb28073473 [0,2,0,0,0,0|2,0,0]=4 10585 B13R1.893 CC(C)COc1cc(F)ccc1Br Amb26318467 [0,2,0,0,0,0|2,0,0]=4 10586 B13R1.893 CC(C)COc1cc(N)ccc1Br Amb27229774 [0,2,0,0,0,0|2,0,0]=4 10587 B13R1.893 CC(C)OCc1cc(F)ccc1Br Amb22900182 [0,2,0,0,0,0|2,0,0]=4 10588 B13R1.893 CC(Cl)CCc1cc(Cl)ccc1Cl Amb27955135 [0,2,0,0,0,0|1,1,0]=4 10589 B13R1.893 CC(Cl)CCc1cc(Cl)ccc1I Amb29856978 [0,2,0,0,0,0|1,1,0]=4 10590 B13R1.893 CC(Cl)CCc1cc(F)ccc1F Amb28365921 [0,2,0,0,0,0|1,1,0]=4 10591 B13R1.893 CC(N)CCc1cc(Br)ccc1Cl Amb25330686 [0,2,0,0,0,0|1,1,0]=4 10592 B13R1.893 CC(N)CCc1cc(Br)ccc1F Amb8869700 [0,2,0,0,0,0|1,1,0]=4 10593 B13R1.893 CC(N)CCc1cc(Br)ccc1N Amb27405847 [0,2,0,0,0,0|2,0,0]=4 10594 B13R1.893 CC(N)CCc1cc(Br)ccc1O Amb26637699 [0,2,0,0,0,0|2,0,0]=4 10595 B13R1.893 CC(N)CCc1cc(Cl)ccc1Br Amb24658698 [0,2,0,0,0,0|1,0,0]=3 10596 B13R1.893 CC(N)CCc1cc(Cl)ccc1Cl Amb22396230 [0,2,0,0,0,0|1,1,0]=4 10597 B13R1.893 CC(N)CCc1cc(Cl)ccc1F Amb18225078 [0,2,0,0,0,0|1,1,0]=4 10598 B13R1.893 CC(N)CCc1cc(Cl)ccc1I Amb27951625 [0,2,0,0,0,0|1,1,0]=4 10599 B13R1.893 CC(N)CCc1cc(Cl)ccc1O Amb25358076 [0,2,0,0,0,0|2,0,0]=4 10600 B13R1.893 CC(N)CCc1cc(Cl)ncc1Br Amb33478134 [0,2,0,0,0,0|2,0,0]=4 10601 B13R1.893 CC(N)CCc1cc(F)ccc1Br Amb9031761 [0,2,0,0,0,0|1,0,0]=3 10602 B13R1.893 CC(N)CCc1cc(F)ccc1Cl Amb18177059 [0,2,0,0,0,0|1,1,0]=4 10603 B13R1.893 CC(N)CCc1cc(F)ccc1F Amb18984514 [0,2,0,0,0,0|1,1,0]=4 10604 B13R1.893 CC(N)CCc1cc(F)ccc1I Amb27174408 [0,2,0,0,0,0|1,1,0]=4 10605 B13R1.893 CC(N)CCc1cc(F)ccc1O Amb26866915 [0,2,0,0,0,0|2,0,0]=4 10606 B13R1.893 CC(N)CCc1cc(N)ccc1N Amb27596863 [0,2,0,0,0,0|2,0,0]=4 10607 B13R1.893 CC(N)CCc1cc(O)ccc1Br Amb24448209 [0,2,0,0,0,0|1,0,0]=3 10608 B13R1.893 CC(N)CCc1cc(O)ccc1N Amb27171484 [0,2,0,0,0,0|2,0,0]=4 10609 B13R1.893 CC(N)CCc1cc(O)ccc1O Amb25102603 [0,2,0,0,0,0|2,0,0]=4 10610 B13R1.893 CC(N)COc1cc(F)ccc1Br Amb27657363 [0,2,0,0,0,0|2,0,0]=4 10611 B13R1.893 CC(O)CCc1cc(Br)ccc1Cl Amb33450508 [0,2,0,0,0,0|1,1,0]=4 10612 B13R1.893 CC(O)CCc1cc(Br)ccc1F Amb26605993 [0,2,0,0,0,0|1,1,0]=4 10613 B13R1.893 CC(O)CCc1cc(Br)ccc1O Amb33333280 [0,2,0,0,0,0|2,0,0]=4 10614 B13R1.893 CC(O)CCc1cc(Cl)ccc1Br Amb24378663 [0,2,0,0,0,0|1,0,0]=3 10615 B13R1.893 CC(O)CCc1cc(Cl)ccc1Cl Amb25877301 [0,2,0,0,0,0|1,1,0]=4 10616 B13R1.893 CC(O)CCc1cc(Cl)ccc1F Amb25141255 [0,2,0,0,0,0|1,1,0]=4 10617 B13R1.893 CC(O)CCc1cc(Cl)ccc1I Amb30015462 [0,2,0,0,0,0|1,1,0]=4 10618 B13R1.893 CC(O)CCc1cc(Cl)ccc1O Amb33052631 [0,2,0,0,0,0|2,0,0]=4 10619 B13R1.893 CC(O)CCc1cc(Cl)ncc1Br Amb33478135 [0,2,0,0,0,0|2,0,0]=4 10620 B13R1.893 CC(O)CCc1cc(F)ccc1Br Amb25697936 [0,2,0,0,0,0|1,0,0]=3 10621 B13R1.893 CC(O)CCc1cc(F)ccc1Cl Amb27459420 [0,2,0,0,0,0|1,1,0]=4 10622 B13R1.893 CC(O)CCc1cc(F)ccc1F Amb19075705 [0,2,0,0,0,0|1,1,0]=4 10623 B13R1.893 CC(O)CCc1cc(F)ccc1O Amb33379912 [0,2,0,0,0,0|2,0,0]=4 10624 B13R1.893 CC(O)CCc1cc(O)ccc1Br Amb33386621 [0,2,0,0,0,0|1,0,0]=3 10625 B13R1.893 CC(O)CCc1cc(O)ccc1O Amb33269956 [0,2,0,0,0,0|2,0,0]=4 10626 B13R1.893 CC(O)CNc1cc(Cl)ccc1Br Amb28457931 [0,2,0,0,0,0|2,0,0]=4 10627 B13R1.893 CC(O)CNc1cc(I)ccc1Br Amb27875597 [0,2,0,0,0,0|2,0,0]=4 10628 B13R1.893 CC(O)COc1cc(N)ccc1Br Amb28046681 [0,2,0,0,0,0|2,0,0]=4 10629 B13R1.893 CN(C)CCN1C=C(Cl)C=CC1=O Amb19127778 [0,2,0,0,0,0|2,0,0]=4 10630 B13R1.893 CN(C)CCN1C=C(N)C=CC1=O Amb18535273 [0,2,0,0,0,0|2,0,0]=4 10631 B13R1.893 CN(C)CCc1cc(F)ccc1N Amb27186283 [0,2,0,0,0,0|1,0,0]=3 10632 B13R1.893 CN(C)NCc1cc(Cl)ccc1Cl Amb28256356 [0,2,0,0,0,0|1,1,0]=4 10633 B13R1.893 CN(C)NCc1cc(Cl)ccc1I Amb35706081 [0,2,0,0,0,0|1,1,0]=4 10634 B13R1.893 CN(C)NCc1cc(F)ccc1Cl Amb27623829 [0,2,0,0,0,0|1,1,0]=4 10635 B13R1.893 C[C@@H](N)CCc1cc(Br)ccc1Cl Amb33451171 [0,2,0,0,0,0|1,1,0]=4 10636 B13R1.893 C[C@@H](N)CCc1cc(Br)ccc1F Amb33451277 [0,2,0,0,0,0|1,1,0]=4 10637 B13R1.893 C[C@@H](N)CCc1cc(Br)ccc1O Amb25827676 [0,2,0,0,0,0|2,0,0]=4 10638 B13R1.893 C[C@@H](N)CCc1cc(Cl)ccc1Br Amb33243019 [0,2,0,0,0,0|1,0,0]=3 10639 B13R1.893 C[C@@H](N)CCc1cc(Cl)ccc1Cl Amb33261969 [0,2,0,0,0,0|1,1,0]=4 10640 B13R1.893 C[C@@H](N)CCc1cc(Cl)ccc1F Amb33406352 [0,2,0,0,0,0|1,1,0]=4 10641 B13R1.893 C[C@@H](N)CCc1cc(Cl)ccc1O Amb25895746 [0,2,0,0,0,0|2,0,0]=4 10642 B13R1.893 C[C@@H](N)CCc1cc(Cl)ncc1Br Amb33478145 [0,2,0,0,0,0|2,0,0]=4 10643 B13R1.893 C[C@@H](N)CCc1cc(F)ccc1Br Amb33242763 [0,2,0,0,0,0|1,0,0]=3 10644 B13R1.893 C[C@@H](N)CCc1cc(F)ccc1Cl Amb33261488 [0,2,0,0,0,0|1,1,0]=4 10645 B13R1.893 C[C@@H](N)CCc1cc(F)ccc1F Amb33079354 [0,2,0,0,0,0|1,1,0]=4 10646 B13R1.893 C[C@@H](N)CCc1cc(F)ccc1O Amb28042968 [0,2,0,0,0,0|2,0,0]=4 10647 B13R1.893 C[C@@H](N)CCc1cc(N)ccc1Cl Amb27169555 [0,2,0,0,0,0|1,1,0]=4 10648 B13R1.893 C[C@@H](N)CCc1cc(O)ccc1Br Amb25034370 [0,2,0,0,0,0|1,0,0]=3 10649 B13R1.893 C[C@@H](N)CCc1cc(O)ccc1O Amb24494024 [0,2,0,0,0,0|2,0,0]=4 10650 B13R1.893 C[C@@H](N)COc1cc(F)ccc1Br Amb29850684 [0,2,0,0,0,0|2,0,0]=4 10651 B13R1.893 C[C@@H](O)CCc1cc(Br)ccc1Cl Amb33450231 [0,2,0,0,0,0|1,1,0]=4 10652 B13R1.893 C[C@@H](O)CCc1cc(Br)ccc1F Amb33478753 [0,2,0,0,0,0|1,1,0]=4 10653 B13R1.893 C[C@@H](O)CCc1cc(Br)ccc1O Amb33333534 [0,2,0,0,0,0|2,0,0]=4 10654 B13R1.893 C[C@@H](O)CCc1cc(Cl)ccc1Br Amb33478228 [0,2,0,0,0,0|1,0,0]=3 10655 B13R1.893 C[C@@H](O)CCc1cc(Cl)ccc1O Amb33052634 [0,2,0,0,0,0|2,0,0]=4 10656 B13R1.893 C[C@@H](O)CCc1cc(Cl)ncc1Br Amb33478141 [0,2,0,0,0,0|2,0,0]=4 10657 B13R1.893 C[C@@H](O)CCc1cc(F)ccc1Br Amb33008594 [0,2,0,0,0,0|1,0,0]=3 10658 B13R1.893 C[C@@H](O)CCc1cc(F)ccc1F Amb32873957 [0,2,0,0,0,0|1,1,0]=4 10659 B13R1.893 C[C@@H](O)CCc1cc(F)ccc1O Amb33379910 [0,2,0,0,0,0|2,0,0]=4 10660 B13R1.893 C[C@@H](O)CCc1cc(O)ccc1Br Amb33386627 [0,2,0,0,0,0|1,0,0]=3 10661 B13R1.893 C[C@@H](O)CCc1cc(O)ccc1O Amb33269513 [0,2,0,0,0,0|2,0,0]=4 10662 B13R1.893 C[C@H](N)CCc1cc(Br)ccc1Cl Amb25347740 [0,2,0,0,0,0|1,1,0]=4 10663 B13R1.893 C[C@H](N)CCc1cc(Br)ccc1F Amb25034440 [0,2,0,0,0,0|1,1,0]=4 10664 B13R1.893 C[C@H](N)CCc1cc(Br)ccc1N Amb27470220 [0,2,0,0,0,0|2,0,0]=4 10665 B13R1.893 C[C@H](N)CCc1cc(Br)ccc1O Amb27830615 [0,2,0,0,0,0|2,0,0]=4 10666 B13R1.893 C[C@H](N)CCc1cc(Cl)ccc1Br Amb28348424 [0,2,0,0,0,0|1,0,0]=3 10667 B13R1.893 C[C@H](N)CCc1cc(Cl)ccc1Cl Amb24436777 [0,2,0,0,0,0|1,1,0]=4 10668 B13R1.893 C[C@H](N)CCc1cc(Cl)ccc1F Amb26460979 [0,2,0,0,0,0|1,1,0]=4 10669 B13R1.893 C[C@H](N)CCc1cc(Cl)ccc1O Amb27808380 [0,2,0,0,0,0|2,0,0]=4 10670 B13R1.893 C[C@H](N)CCc1cc(Cl)ncc1Br Amb33478147 [0,2,0,0,0,0|2,0,0]=4 10671 B13R1.893 C[C@H](N)CCc1cc(F)ccc1Br Amb26596249 [0,2,0,0,0,0|1,0,0]=3 10672 B13R1.893 C[C@H](N)CCc1cc(F)ccc1Cl Amb28204204 [0,2,0,0,0,0|1,1,0]=4 10673 B13R1.893 C[C@H](N)CCc1cc(F)ccc1F Amb27776539 [0,2,0,0,0,0|1,1,0]=4 10674 B13R1.893 C[C@H](N)CCc1cc(F)ccc1I Amb27970353 [0,2,0,0,0,0|1,1,0]=4 10675 B13R1.893 C[C@H](N)CCc1cc(F)ccc1O Amb25034179 [0,2,0,0,0,0|2,0,0]=4 10676 B13R1.893 C[C@H](N)CCc1cc(I)ccc1Cl Amb27663394 [0,2,0,0,0,0|1,1,0]=4 10677 B13R1.893 C[C@H](N)CCc1cc(I)ccc1O Amb27467541 [0,2,0,0,0,0|2,0,0]=4 10678 B13R1.893 C[C@H](N)CCc1cc(N)ccc1F Amb27259000 [0,2,0,0,0,0|1,1,0]=4 10679 B13R1.893 C[C@H](N)CCc1cc(O)ccc1Br Amb26349635 [0,2,0,0,0,0|1,0,0]=3 10680 B13R1.893 C[C@H](N)CCc1cc(O)ccc1O Amb26620870 [0,2,0,0,0,0|2,0,0]=4 10681 B13R1.893 C[C@H](N)COc1cc(F)ccc1Br Amb29850683 [0,2,0,0,0,0|2,0,0]=4 10682 B13R1.893 C[C@H](O)CCc1cc(Br)ccc1Cl Amb33450234 [0,2,0,0,0,0|1,1,0]=4 10683 B13R1.893 C[C@H](O)CCc1cc(Br)ccc1F Amb33478751 [0,2,0,0,0,0|1,1,0]=4 10684 B13R1.893 C[C@H](O)CCc1cc(Br)ccc1O Amb33333479 [0,2,0,0,0,0|2,0,0]=4 10685 B13R1.893 C[C@H](O)CCc1cc(Cl)ccc1Br Amb33478226 [0,2,0,0,0,0|1,0,0]=3 10686 B13R1.893 C[C@H](O)CCc1cc(Cl)ccc1O Amb33052632 [0,2,0,0,0,0|2,0,0]=4 10687 B13R1.893 C[C@H](O)CCc1cc(Cl)ncc1Br Amb33478137 [0,2,0,0,0,0|2,0,0]=4 10688 B13R1.893 C[C@H](O)CCc1cc(F)ccc1Br Amb33009263 [0,2,0,0,0,0|1,0,0]=3 10689 B13R1.893 C[C@H](O)CCc1cc(F)ccc1F Amb32873959 [0,2,0,0,0,0|1,1,0]=4 10690 B13R1.893 C[C@H](O)CCc1cc(F)ccc1O Amb33379911 [0,2,0,0,0,0|2,0,0]=4 10691 B13R1.893 C[C@H](O)CCc1cc(O)ccc1Br Amb33386624 [0,2,0,0,0,0|1,0,0]=3 10692 B13R1.893 C[C@H](O)CCc1cc(O)ccc1O Amb33269516 [0,2,0,0,0,0|2,0,0]=4 10693 B13R1.893 Cc1ccc(Br)c(CCC(=O)O)c1 Amb27798383 [0,2,0,0,0,0|2,0,0]=4 10694 B13R1.893 Cc1ccc(Br)c(CCC(C)N)c1 Amb24491286 [0,2,0,0,0,0|1,0,0]=3 10695 B13R1.893 Cc1ccc(Br)c(CCC(C)O)c1 Amb33477511 [0,2,0,0,0,0|1,0,0]=3 10696 B13R1.893 Cc1ccc(Br)c(CC[C@@H](C)N)c1 Amb33450896 [0,2,0,0,0,0|1,0,0]=3 10697 B13R1.893 Cc1ccc(Br)c(CC[C@@H](C)O)c1 Amb33477515 [0,2,0,0,0,0|1,0,0]=3 10698 B13R1.893 Cc1ccc(Br)c(CC[C@H](C)N)c1 Amb25330903 [0,2,0,0,0,0|1,0,0]=3 10699 B13R1.893 Cc1ccc(Br)c(CC[C@H](C)O)c1 Amb33477513 [0,2,0,0,0,0|1,0,0]=3 10700 B13R1.893 Cc1ccc(Br)c(CC[N+](=O)[O-])c1 Amb33477543 [0,2,0,0,0,0|1,0,1]=4 10701 B13R1.893 Cc1ccc(Br)c(NCC(C)O)c1 Amb28200214 [0,2,0,0,0,0|2,0,0]=4 10702 B13R1.893 Cc1ccc(Br)c(OCC(C)C)c1 Amb35663092 [0,2,0,0,0,0|2,0,0]=4 10703 B13R1.893 Cc1ccc(Br)c(OCC(C)N)c1 Amb35663347 [0,2,0,0,0,0|2,0,0]=4 10704 B13R1.893 Cc1ccc(Br)c(OCC(C)O)c1 Amb35665083 [0,2,0,0,0,0|2,0,0]=4 10705 B13R1.893 Cc1ccc(Br)c(OC[C@@H](C)N)c1 Amb35663346 [0,2,0,0,0,0|2,0,0]=4 10706 B13R1.893 Cc1ccc(Br)c(OC[C@@H](C)O)c1 Amb35695638 [0,2,0,0,0,0|2,0,0]=4 10707 B13R1.893 Cc1ccc(Br)c(OC[C@H](C)N)c1 Amb35663345 [0,2,0,0,0,0|2,0,0]=4 10708 B13R1.893 Cc1ccc(Br)c(OC[C@H](C)O)c1 Amb35695645 [0,2,0,0,0,0|2,0,0]=4 10709 B13R1.893 Cc1ccc(Br)cc1CCC(C)N Amb26558510 [0,2,0,0,0,0|2,0,0]=4 10710 B13R1.893 Cc1ccc(Br)cc1CCC(C)O Amb24391732 [0,2,0,0,0,0|2,0,0]=4 10711 B13R1.893 Cc1ccc(Br)cc1CC[C@@H](C)N Amb33451628 [0,2,0,0,0,0|2,0,0]=4 10712 B13R1.893 Cc1ccc(Br)cc1CC[C@@H](C)O Amb33450353 [0,2,0,0,0,0|2,0,0]=4 10713 B13R1.893 Cc1ccc(Br)cc1CC[C@H](C)N Amb24689460 [0,2,0,0,0,0|2,0,0]=4 10714 B13R1.893 Cc1ccc(Br)cc1CC[C@H](C)O Amb33450350 [0,2,0,0,0,0|2,0,0]=4 10715 B13R1.893 Cc1ccc(Br)cc1CNN(C)C Amb27607924 [0,2,0,0,0,0|2,0,0]=4 10716 B13R1.893 Cc1ccc(C)c(CCC(C)Cl)c1 Amb18330805 [0,2,0,0,0,0|2,0,0]=4 10717 B13R1.893 Cc1ccc(C)c(CCC(C)N)c1 Amb5740111 [0,2,0,0,0,0|2,0,0]=4 10718 B13R1.893 Cc1ccc(C)c(CCC(C)O)c1 Amb18186257 [0,2,0,0,0,0|2,0,0]=4 10719 B13R1.893 Cc1ccc(C)c(CCN(C)N)c1 Amb18065802 [0,2,0,0,0,0|1,0,0]=3 10720 B13R1.893 Cc1ccc(C)c(CC[C@@H](C)N)c1 Amb32953516 [0,2,0,0,0,0|2,0,0]=4 10721 B13R1.893 Cc1ccc(C)c(CC[C@@H](C)O)c1 Amb33422602 [0,2,0,0,0,0|2,0,0]=4 10722 B13R1.893 Cc1ccc(C)c(CC[C@H](C)N)c1 Amb25126783 [0,2,0,0,0,0|2,0,0]=4 10723 B13R1.893 Cc1ccc(C)c(CC[C@H](C)O)c1 Amb33422603 [0,2,0,0,0,0|2,0,0]=4 10724 B13R1.893 Cc1ccc(Cl)c(CCC(C)N)c1 Amb25281638 [0,2,0,0,0,0|1,1,0]=4 10725 B13R1.893 Cc1ccc(Cl)c(CCC(C)O)c1 Amb28396889 [0,2,0,0,0,0|1,1,0]=4 10726 B13R1.893 Cc1ccc(Cl)c(CC[C@@H](C)N)c1 Amb33406635 [0,2,0,0,0,0|1,1,0]=4 10727 B13R1.893 Cc1ccc(Cl)c(CC[C@@H](C)O)c1 Amb33261469 [0,2,0,0,0,0|1,1,0]=4 10728 B13R1.893 Cc1ccc(Cl)c(CC[C@H](C)N)c1 Amb24598124 [0,2,0,0,0,0|1,1,0]=4 10729 B13R1.893 Cc1ccc(Cl)c(CC[C@H](C)O)c1 Amb33261908 [0,2,0,0,0,0|1,1,0]=4 10730 B13R1.893 Cc1ccc(Cl)cc1CCC(C)N Amb24682442 [0,2,0,0,0,0|2,0,0]=4 10731 B13R1.893 Cc1ccc(F)c(CCC(C)Cl)c1 Amb28207554 [0,2,0,0,0,0|1,1,0]=4 10732 B13R1.893 Cc1ccc(F)c(CCC(C)N)c1 Amb27264341 [0,2,0,0,0,0|1,1,0]=4 10733 B13R1.893 Cc1ccc(F)c(CCC(C)O)c1 Amb25069844 [0,2,0,0,0,0|1,1,0]=4 10734 B13R1.893 Cc1ccc(F)c(CC[C@@H](C)N)c1 Amb33429967 [0,2,0,0,0,0|1,1,0]=4 10735 B13R1.893 Cc1ccc(F)c(CC[C@@H](C)O)c1 Amb33271255 [0,2,0,0,0,0|1,1,0]=4 10736 B13R1.893 Cc1ccc(F)c(CC[C@H](C)N)c1 Amb25705544 [0,2,0,0,0,0|1,1,0]=4 10737 B13R1.893 Cc1ccc(F)c(CC[C@H](C)O)c1 Amb33271431 [0,2,0,0,0,0|1,1,0]=4 10738 B13R1.893 Cc1ccc(F)c(CNN(C)C)c1 Amb27205419 [0,2,0,0,0,0|1,1,0]=4 10739 B13R1.893 Cc1ccc(F)cc1CCC(C)Br Amb28435938 [0,2,0,0,0,0|2,0,0]=4 10740 B13R1.893 Cc1ccc(F)cc1CCC(C)N Amb26630760 [0,2,0,0,0,0|2,0,0]=4 10741 B13R1.893 Cc1ccc(F)cc1CCC(C)O Amb25692896 [0,2,0,0,0,0|2,0,0]=4 10742 B13R1.893 Cc1ccc(F)cc1CC[C@@H](C)N Amb33449166 [0,2,0,0,0,0|2,0,0]=4 10743 B13R1.893 Cc1ccc(F)cc1CC[C@@H](C)O Amb33200097 [0,2,0,0,0,0|2,0,0]=4 10744 B13R1.893 Cc1ccc(F)cc1CC[C@H](C)N Amb26345583 [0,2,0,0,0,0|2,0,0]=4 10745 B13R1.893 Cc1ccc(F)cc1CC[C@H](C)O Amb33200215 [0,2,0,0,0,0|2,0,0]=4 10746 B13R1.893 Cc1ccc(I)c(CCC(C)N)c1 Amb27447852 [0,2,0,0,0,0|1,1,0]=4 10747 B13R1.893 Cc1ccc(N)c(CC[C@H](C)N)c1 Amb27814667 [0,2,0,0,0,0|2,0,0]=4 10748 B13R1.893 Cc1ccc(O)c(CCC(C)N)c1 Amb26613517 [0,2,0,0,0,0|2,0,0]=4 10749 B13R1.893 Cc1ccc(O)c(CCC(C)O)c1 Amb33268983 [0,2,0,0,0,0|2,0,0]=4 10750 B13R1.893 Cc1ccc(O)c(CC[C@@H](C)N)c1 Amb27800912 [0,2,0,0,0,0|2,0,0]=4 10751 B13R1.893 Cc1ccc(O)c(CC[C@@H](C)O)c1 Amb33268981 [0,2,0,0,0,0|2,0,0]=4 10752 B13R1.893 Cc1ccc(O)c(CC[C@H](C)N)c1 Amb25756225 [0,2,0,0,0,0|2,0,0]=4 10753 B13R1.893 Cc1ccc(O)c(CC[C@H](C)O)c1 Amb33268982 [0,2,0,0,0,0|2,0,0]=4 10754 B13R1.893 NC(=O)CCc1cc(F)ccc1Br Amb27802437 [0,2,0,0,0,0|2,0,0]=4 10755 B13R1.893 O=C(O)CCc1cc(Br)ccc1Br Amb17198912 [0,2,0,0,0,0|2,0,0]=4 10756 B13R1.893 O=C(O)CCc1cc(Cl)ccc1Br Amb20622630 [0,2,0,0,0,0|2,0,0]=4 10757 B13R1.893 O=C(O)CCc1cc(F)ccc1Br Amb9384325 [0,2,0,0,0,0|2,0,0]=4 10758 B13R1.893 O=C(O)CCc1cc(I)ccc1Br Amb28383384 [0,2,0,0,0,0|2,0,0]=4 10759 B13R1.893 O=C(O)CCc1cc(O)ccc1Br Amb27771793 [0,2,0,0,0,0|2,0,0]=4 10760 B13R1.893 O=C(O)CCc1cc(S)ccc1Br Amb27613910 [0,2,0,0,0,0|2,0,0]=4 10761 B13R1.893 O=[N+]([O-])CCc1cc(Cl)ccc1Br Amb33241834 [0,2,0,0,0,0|1,0,1]=4 10762 B13R1.893 O=[N+]([O-])CCc1cc(F)ccc1Br Amb33242581 [0,2,0,0,0,0|1,0,1]=4 10763 B13R1.893 O=[N+]([O-])CCc1cc(O)ccc1Br Amb33386612 [0,2,0,0,0,0|1,0,1]=4 10764 B13R1.3787 C=C(C)CCc1c(C)cccc1C Amb28282701 [0,2,0,0,0,0|2,0,0]=4 10765 B13R1.3787 C=C(C)CNc1c(C)cccc1Br Amb35706688 [0,2,0,0,0,0|2,0,0]=4 10766 B13R1.3787 C=C(C)CNc1c(N)cccc1Br Amb35638518 [0,2,0,0,0,0|2,0,0]=4 10767 B13R1.3787 CC(=O)CCc1c(C)cccc1C Amb18196353 [0,2,0,0,0,0|2,0,0]=4 10768 B13R1.3787 CC(=O)CCc1c(C)cccc1Cl Amb33259770 [0,2,0,0,0,0|1,1,0]=4 10769 B13R1.3787 CC(=O)CCc1c(C)cccc1F Amb33148576 [0,2,0,0,0,0|1,1,0]=4 10770 B13R1.3787 CC(=O)CCc1c(Cl)cccc1Br Amb28283947 [0,2,0,0,0,0|1,0,0]=3 10771 B13R1.3787 CC(=O)CCc1c(Cl)cccc1Cl Amb9031576 [0,2,0,0,0,0|1,1,0]=4 10772 B13R1.3787 CC(=O)CCc1c(F)cccc1Br Amb33430097 [0,2,0,0,0,0|1,0,0]=3 10773 B13R1.3787 CC(=O)CCc1c(F)cccc1Cl Amb17402374 [0,2,0,0,0,0|1,1,0]=4 10774 B13R1.3787 CC(=O)CCc1c(F)cccc1F Amb25354361 [0,2,0,0,0,0|1,1,0]=4 10775 B13R1.3787 CC(=O)CCc1c(O)cccc1Br Amb33336491 [0,2,0,0,0,0|1,0,0]=3 10776 B13R1.3787 CC(=O)CCc1c(O)cccc1Cl Amb33413984 [0,2,0,0,0,0|1,1,0]=4 10777 B13R1.3787 CC(=O)OCc1c(Br)cccc1Br Amb21961242 [0,2,0,0,0,0|2,0,0]=4 10778 B13R1.3787 CC(=O)OCc1c(F)cccc1Br Amb27388578 [0,2,0,0,0,0|2,0,0]=4 10779 B13R1.3787 CC(=O)SCc1c(Br)cccc1Br Amb25081266 [0,2,0,0,0,0|2,0,0]=4 10780 B13R1.3787 CC(Br)CCc1c(F)cccc1Cl Amb28205587 [0,2,0,0,0,0|1,1,0]=4 10781 B13R1.3787 CC(C)CCN1C(=O)C=CC=C1Br Amb27980273 [0,2,0,0,0,0|2,0,0]=4 10782 B13R1.3787 CC(C)CCc1c(N)cccc1Br Amb29889614 [0,2,0,0,0,0|1,0,0]=3 10783 B13R1.3787 CC(C)CCc1c(N)cccc1F Amb27485397 [0,2,0,0,0,0|1,1,0]=4 10784 B13R1.3787 CC(C)CCc1c(N)cncc1Br Amb27260774 [0,2,0,0,0,0|2,0,0]=4 10785 B13R1.3787 CC(C)CNc1c(F)cccc1Br Amb27245803 [0,2,0,0,0,0|2,0,0]=4 10786 B13R1.3787 CC(C)CNc1c(N)cccc1Br Amb32708758 [0,2,0,0,0,0|2,0,0]=4 10787 B13R1.3787 CC(C)COc1c(Br)cccc1Br Amb28188036 [0,2,0,0,0,0|2,0,0]=4 10788 B13R1.3787 CC(C)COc1c(N)cccc1Br Amb27257673 [0,2,0,0,0,0|2,0,0]=4 10789 B13R1.3787 CC(C)CSc1c(N)cccc1Br Amb35591423 [0,2,0,0,0,0|2,0,0]=4 10790 B13R1.3787 CC(C)NCc1c(Cl)cccc1Br Amb27834481 [0,2,0,0,0,0|2,0,0]=4 10791 B13R1.3787 CC(C)NCc1c(F)cccc1Br Amb26856888 [0,2,0,0,0,0|2,0,0]=4 10792 B13R1.3787 CC(Cl)CCc1c(F)cccc1F Amb28204663 [0,2,0,0,0,0|1,1,0]=4 10793 B13R1.3787 CC(N)CCc1c(Cl)cccc1Br Amb24491287 [0,2,0,0,0,0|1,0,0]=3 10794 B13R1.3787 CC(N)CCc1c(Cl)cccc1Cl Amb9031778 [0,2,0,0,0,0|1,1,0]=4 10795 B13R1.3787 CC(N)CCc1c(F)cccc1Br Amb28118565 [0,2,0,0,0,0|1,0,0]=3 10796 B13R1.3787 CC(N)CCc1c(F)cccc1Cl Amb25297484 [0,2,0,0,0,0|1,1,0]=4 10797 B13R1.3787 CC(N)CCc1c(F)cccc1F Amb22396840 [0,2,0,0,0,0|1,1,0]=4 10798 B13R1.3787 CC(N)CCc1c(F)cccc1F Amb32668023 [0,2,0,0,0,0|1,1,0]=4 10799 B13R1.3787 CC(N)CCc1c(N)cccc1F Amb28290383 [0,2,0,0,0,0|1,1,0]=4 10800 B13R1.3787 CC(N)CCc1c(O)cccc1Br Amb27233688 [0,2,0,0,0,0|1,0,0]=3 10801 B13R1.3787 CC(N)CCc1c(O)cccc1Cl Amb33261057 [0,2,0,0,0,0|1,1,0]=4 10802 B13R1.3787 CC(N)CCc1c(O)cccc1F Amb27872336 [0,2,0,0,0,0|1,1,0]=4 10803 B13R1.3787 CC(N)COc1c(Br)cccc1Br Amb27759050 [0,2,0,0,0,0|2,0,0]=4 10804 B13R1.3787 CC(O)CCc1c(Cl)cccc1Br Amb26454667 [0,2,0,0,0,0|1,0,0]=3 10805 B13R1.3787 CC(O)CCc1c(Cl)cccc1Cl Amb26459150 [0,2,0,0,0,0|1,1,0]=4 10806 B13R1.3787 CC(O)CCc1c(F)cccc1Br Amb33430033 [0,2,0,0,0,0|1,0,0]=3 10807 B13R1.3787 CC(O)CCc1c(F)cccc1Cl Amb27187281 [0,2,0,0,0,0|1,1,0]=4 10808 B13R1.3787 CC(O)CCc1c(F)cccc1F Amb25862845 [0,2,0,0,0,0|1,1,0]=4 10809 B13R1.3787 CC(O)CCc1c(O)cccc1Br Amb33431159 [0,2,0,0,0,0|1,0,0]=3 10810 B13R1.3787 CC(O)CCc1c(O)cccc1Cl Amb33261060 [0,2,0,0,0,0|1,1,0]=4 10811 B13R1.3787 CC(O)CNc1c(Br)cccc1Br Amb28456894 [0,2,0,0,0,0|2,0,0]=4 10812 B13R1.3787 CC(O)CNc1c(N)cccc1Br Amb35645872 [0,2,0,0,0,0|2,0,0]=4 10813 B13R1.3787 CC(O)CSc1c(Cl)cccc1Br Amb27396763 [0,2,0,0,0,0|2,0,0]=4 10814 B13R1.3787 CN(C)CCc1c(F)cccc1F Amb28282759 [0,2,0,0,0,0|0,1,0]=3 10815 B13R1.3787 CN(C)NCc1c(Br)cncc1Br Amb28437053 [0,2,0,0,0,0|2,0,0]=4 10816 B13R1.3787 CN(C)NCc1c(Cl)cccc1Cl Amb27668747 [0,2,0,0,0,0|1,1,0]=4 10817 B13R1.3787 CN(C)NCc1c(F)cccc1Cl Amb27777857 [0,2,0,0,0,0|1,1,0]=4 10818 B13R1.3787 CN(C)NCc1c(F)cccc1F Amb28184419 [0,2,0,0,0,0|1,1,0]=4 10819 B13R1.3787 CN(C)NCc1c(O)cccc1Cl Amb27859773 [0,2,0,0,0,0|1,1,0]=4 10820 B13R1.3787 CN(N)CCc1c(F)cccc1Cl Amb18566630 [0,2,0,0,0,0|0,1,0]=3 10821 B13R1.3787 C[C@@H](N)CCc1c(Cl)cccc1Br Amb33240284 [0,2,0,0,0,0|1,0,0]=3 10822 B13R1.3787 C[C@@H](N)CCc1c(Cl)cccc1Cl Amb33406398 [0,2,0,0,0,0|1,1,0]=4 10823 B13R1.3787 C[C@@H](N)CCc1c(F)cccc1Br Amb33430206 [0,2,0,0,0,0|1,0,0]=3 10824 B13R1.3787 C[C@@H](N)CCc1c(F)cccc1Cl Amb33390423 [0,2,0,0,0,0|1,1,0]=4 10825 B13R1.3787 C[C@@H](N)CCc1c(F)cccc1F Amb32953668 [0,2,0,0,0,0|1,1,0]=4 10826 B13R1.3787 C[C@@H](N)CCc1c(O)cccc1Br Amb24712392 [0,2,0,0,0,0|1,0,0]=3 10827 B13R1.3787 C[C@@H](N)CCc1c(O)cccc1Cl Amb33261067 [0,2,0,0,0,0|1,1,0]=4 10828 B13R1.3787 C[C@@H](N)COc1c(Br)cccc1Br Amb29850665 [0,2,0,0,0,0|2,0,0]=4 10829 B13R1.3787 C[C@@H](O)CCc1c(Cl)cccc1Br Amb33336229 [0,2,0,0,0,0|1,0,0]=3 10830 B13R1.3787 C[C@@H](O)CCc1c(Cl)cccc1Cl Amb33256982 [0,2,0,0,0,0|1,1,0]=4 10831 B13R1.3787 C[C@@H](O)CCc1c(F)cccc1Br Amb33430036 [0,2,0,0,0,0|1,0,0]=3 10832 B13R1.3787 C[C@@H](O)CCc1c(F)cccc1Cl Amb33256149 [0,2,0,0,0,0|1,1,0]=4 10833 B13R1.3787 C[C@@H](O)CCc1c(O)cccc1Br Amb33431165 [0,2,0,0,0,0|1,0,0]=3 10834 B13R1.3787 C[C@@H](O)CCc1c(O)cccc1Cl Amb33261066 [0,2,0,0,0,0|1,1,0]=4 10835 B13R1.3787 C[C@@H](O)CNc1c(F)cccc1Br Amb28285513 [0,2,0,0,0,0|2,0,0]=4 10836 B13R1.3787 C[C@@H](O)COc1c(Br)cccc1Br Amb30010788 [0,2,0,0,0,0|2,0,0]=4 10837 B13R1.3787 C[C@H](N)CCc1c(Br)cccc1Br Amb27600861 [0,2,0,0,0,0|1,0,0]=3 10838 B13R1.3787 C[C@H](N)CCc1c(Cl)cccc1Br Amb25776041 [0,2,0,0,0,0|1,0,0]=3 10839 B13R1.3787 C[C@H](N)CCc1c(Cl)cccc1Cl Amb26461197 [0,2,0,0,0,0|1,1,0]=4 10840 B13R1.3787 C[C@H](N)CCc1c(F)cccc1Br Amb25329547 [0,2,0,0,0,0|1,0,0]=3 10841 B13R1.3787 C[C@H](N)CCc1c(F)cccc1Cl Amb28241250 [0,2,0,0,0,0|1,1,0]=4 10842 B13R1.3787 C[C@H](N)CCc1c(F)cccc1F Amb24492243 [0,2,0,0,0,0|1,1,0]=4 10843 B13R1.3787 C[C@H](N)CCc1c(O)cccc1Br Amb26989625 [0,2,0,0,0,0|1,0,0]=3 10844 B13R1.3787 C[C@H](N)CCc1c(O)cccc1Cl Amb33261103 [0,2,0,0,0,0|1,1,0]=4 10845 B13R1.3787 C[C@H](N)COc1c(Br)cccc1Br Amb29850664 [0,2,0,0,0,0|2,0,0]=4 10846 B13R1.3787 C[C@H](O)CCc1c(Cl)cccc1Br Amb33336226 [0,2,0,0,0,0|1,0,0]=3 10847 B13R1.3787 C[C@H](O)CCc1c(Cl)cccc1Cl Amb33256978 [0,2,0,0,0,0|1,1,0]=4 10848 B13R1.3787 C[C@H](O)CCc1c(F)cccc1Br Amb33430034 [0,2,0,0,0,0|1,0,0]=3 10849 B13R1.3787 C[C@H](O)CCc1c(F)cccc1Cl Amb33256146 [0,2,0,0,0,0|1,1,0]=4 10850 B13R1.3787 C[C@H](O)CCc1c(F)cccc1F Amb33314562 [0,2,0,0,0,0|1,1,0]=4 10851 B13R1.3787 C[C@H](O)CCc1c(O)cccc1Br Amb33431162 [0,2,0,0,0,0|1,0,0]=3 10852 B13R1.3787 C[C@H](O)CCc1c(O)cccc1Cl Amb33261063 [0,2,0,0,0,0|1,1,0]=4 10853 B13R1.3787 C[C@H](O)COc1c(Br)cccc1Br Amb30010789 [0,2,0,0,0,0|2,0,0]=4 10854 B13R1.3787 Cc1cccc(Br)c1CCC(=O)O Amb27267238 [0,2,0,0,0,0|2,0,0]=4 10855 B13R1.3787 Cc1cccc(Br)c1NCC(C)C Amb35721353 [0,2,0,0,0,0|2,0,0]=4 10856 B13R1.3787 Cc1cccc(Br)c1NCC(C)O Amb35706692 [0,2,0,0,0,0|2,0,0]=4 10857 B13R1.3787 Cc1cccc(Br)c1NC[C@@H](C)O Amb35725706 [0,2,0,0,0,0|2,0,0]=4 10858 B13R1.3787 Cc1cccc(Br)c1NC[C@H](C)O Amb35725733 [0,2,0,0,0,0|2,0,0]=4 10859 B13R1.3787 Cc1cccc(Br)c1OCC(C)C Amb27162728 [0,2,0,0,0,0|2,0,0]=4 10860 B13R1.3787 Cc1cccc(C)c1CCC(C)N Amb22396190 [0,2,0,0,0,0|2,0,0]=4 10861 B13R1.3787 Cc1cccc(C)c1CCC(C)O Amb25192359 [0,2,0,0,0,0|2,0,0]=4 10862 B13R1.3787 Cc1cccc(C)c1CCN(C)C Amb28068532 [0,2,0,0,0,0|1,0,0]=3 10863 B13R1.3787 Cc1cccc(C)c1CC[C@@H](C)N Amb33172030 [0,2,0,0,0,0|2,0,0]=4 10864 B13R1.3787 Cc1cccc(C)c1CC[C@@H](C)O Amb32725545 [0,2,0,0,0,0|2,0,0]=4 10865 B13R1.3787 Cc1cccc(C)c1CC[C@H](C)N Amb25876187 [0,2,0,0,0,0|2,0,0]=4 10866 B13R1.3787 Cc1cccc(C)c1CC[C@H](C)O Amb32725546 [0,2,0,0,0,0|2,0,0]=4 10867 B13R1.3787 Cc1cccc(C)c1CNN(C)C Amb27249113 [0,2,0,0,0,0|2,0,0]=4 10868 B13R1.3787 Cc1cccc(Cl)c1CCC(C)N Amb25192340 [0,2,0,0,0,0|1,1,0]=4 10869 B13R1.3787 Cc1cccc(Cl)c1CCC(C)O Amb33259731 [0,2,0,0,0,0|1,1,0]=4 10870 B13R1.3787 Cc1cccc(Cl)c1CC[C@@H](C)N Amb33262154 [0,2,0,0,0,0|1,1,0]=4 10871 B13R1.3787 Cc1cccc(Cl)c1CC[C@@H](C)O Amb33259741 [0,2,0,0,0,0|1,1,0]=4 10872 B13R1.3787 Cc1cccc(Cl)c1CC[C@H](C)N Amb25775339 [0,2,0,0,0,0|1,1,0]=4 10873 B13R1.3787 Cc1cccc(Cl)c1CC[C@H](C)O Amb33259737 [0,2,0,0,0,0|1,1,0]=4 10874 B13R1.3787 Cc1cccc(F)c1CCC(C)N Amb33143389 [0,2,0,0,0,0|1,1,0]=4 10875 B13R1.3787 Cc1cccc(F)c1CCC(C)O Amb33143388 [0,2,0,0,0,0|1,1,0]=4 10876 B13R1.3787 Cc1cccc(F)c1CC[C@@H](C)N Amb33143183 [0,2,0,0,0,0|1,1,0]=4 10877 B13R1.3787 Cc1cccc(F)c1CC[C@@H](C)O Amb33143475 [0,2,0,0,0,0|1,1,0]=4 10878 B13R1.3787 Cc1cccc(F)c1CC[C@H](C)N Amb33143181 [0,2,0,0,0,0|1,1,0]=4 10879 B13R1.3787 Cc1cccc(F)c1CC[C@H](C)O Amb33143387 [0,2,0,0,0,0|1,1,0]=4 10880 B13R1.3787 Cc1cccc(N)c1CCC(C)C Amb27255544 [0,2,0,0,0,0|2,0,0]=4 10881 B13R1.3787 O=C(O)CCc1c(Br)cccc1I Amb25843924 [0,2,0,0,0,0|2,0,0]=4 10882 B13R1.3787 O=C(O)CCc1c(Cl)cccc1Br Amb26325744 [0,2,0,0,0,0|2,0,0]=4 10883 B13R1.3787 O=C(O)CCc1c(F)cccc1Br Amb24367288 [0,2,0,0,0,0|2,0,0]=4 10884 B13R1.3787 O=C(O)CCc1c(O)cccc1Br Amb26988742 [0,2,0,0,0,0|2,0,0]=4 10885 B13R1.3787 O=[N+]([O-])CCc1c(Cl)cccc1Br Amb33336255 [0,2,0,0,0,0|1,0,1]=4 10886 B13R1.3787 O=[N+]([O-])CCc1c(F)cccc1Br Amb33451264 [0,2,0,0,0,0|1,0,1]=4 10887 B13R1.3787 O=[N+]([O-])CCc1c(O)cccc1Br Amb33336473 [0,2,0,0,0,0|1,0,1]=4 10888 B13R1.158 C=C(C)CCNc1ccccc1C Amb27174738 [0,2,0,0,0,0|2,0,0]=4 10889 B13R1.158 C=C(C)CCNc1ccccc1N Amb27790840 [0,2,0,0,0,0|2,0,0]=4 10890 B13R1.158 C=C(C)CCNc1ccncc1Br Amb27267366 [0,2,0,0,0,0|2,0,0]=4 10891 B13R1.158 C=C(C)CNCc1ccccc1Cl Amb17317898 [0,2,0,0,0,0|1,1,0]=4 10892 B13R1.158 C=C(C)CNCc1ccccc1F Amb17309099 [0,2,0,0,0,0|1,1,0]=4 10893 B13R1.158 C=C(C)CNCc1ccccc1O Amb33098597 [0,2,0,0,0,0|2,0,0]=4 10894 B13R1.158 CC(=N)NCCc1ncccc1C Amb35580305 [0,2,0,0,0,0|2,0,0]=4 10895 B13R1.158 CC(=O)CCCc1ccccc1C Amb17233198 [0,2,0,0,0,0|2,0,0]=4 10896 B13R1.158 CC(=O)CCCc1ccccc1Cl Amb17236501 [0,2,0,0,0,0|1,1,0]=4 10897 B13R1.158 CC(=O)CCCc1ccccc1F Amb17233676 [0,2,0,0,0,0|1,1,0]=4 10898 B13R1.158 CC(=O)CCNc1ccccc1O Amb28388299 [0,2,0,0,0,0|2,0,0]=4 10899 B13R1.158 CC(=O)CCOc1ccccc1C Amb7777349 [0,2,0,0,0,0|2,0,0]=4 10900 B13R1.158 CC(=O)CCOc1ccccc1Cl Amb17139723 [0,2,0,0,0,0|1,1,0]=4 10901 B13R1.158 CC(=O)CCOc1ccccc1F Amb7777344 [0,2,0,0,0,0|1,1,0]=4 10902 B13R1.158 CC(=O)CCSc1ccccc1Br Amb9229575 [0,2,0,0,0,0|1,0,0]=3 10903 B13R1.158 CC(=O)CCSc1ccccc1C Amb19051952 [0,2,0,0,0,0|2,0,0]=4 10904 B13R1.158 CC(=O)CCSc1ccccc1Cl Amb9224162 [0,2,0,0,0,0|1,1,0]=4 10905 B13R1.158 CC(=O)CCSc1ccccc1F Amb9224177 [0,2,0,0,0,0|1,1,0]=4 10906 B13R1.158 CC(=O)CSCc1ccccc1C Amb18330489 [0,2,0,0,0,0|2,0,0]=4 10907 B13R1.158 CC(=O)CSCc1ccccc1Cl Amb32683019 [0,2,0,0,0,0|1,1,0]=4 10908 B13R1.158 CC(=O)NCCc1ccccc1Br Amb13133608 [0,2,0,0,0,0|0,0,0]=2 10909 B13R1.158 CC(=O)NCCc1ccccc1Cl Amb25324158 [0,2,0,0,0,0|0,1,0]=3 10910 B13R1.158 CC(=O)NCCc1ccccc1N Amb27180309 [0,2,0,0,0,0|1,0,0]=3 10911 B13R1.158 CC(=O)NCCc1ccccc1O Amb16982301 [0,2,0,0,0,0|1,0,0]=3 10912 B13R1.158 CC(=O)NCCc1cccnc1Br Amb28319510 [0,2,0,0,0,0|1,0,0]=3 10913 B13R1.158 CC(=O)NCCc1ncccc1C Amb35579988 [0,2,0,0,0,0|2,0,0]=4 10914 B13R1.158 CC(=O)NOCc1ccccc1Br Amb28283840 [0,2,0,0,0,0|1,0,0]=3 10915 B13R1.158 CC(=O)N\N=C\c1ccccc1Br Amb4355273 [0,2,0,0,0,0|1,0,1]=4 10916 B13R1.158 CC(C)=CCCc1ccccc1C Amb35582933 [0,2,0,0,0,0|2,0,0]=4 10917 B13R1.158 CC(C)=CCCc1ccccc1Cl Amb35588028 [0,2,0,0,0,0|1,1,0]=4 10918 B13R1.158 CC(C)=CCCc1ccccc1F Amb35588017 [0,2,0,0,0,0|1,1,0]=4 10919 B13R1.158 CC(C)=CCNc1ccccc1Br Amb27395100 [0,2,0,0,0,0|1,0,1]=4 10920 B13R1.158 CC(C)CCNc1ccccc1Br Amb6696383 [0,2,0,0,0,0|1,0,0]=3 10921 B13R1.158 CC(C)CCNc1ccccc1Cl Amb6643413 [0,2,0,0,0,0|1,1,0]=4 10922 B13R1.158 CC(C)CCNc1ccccc1F Amb6697280 [0,2,0,0,0,0|1,1,0]=4 10923 B13R1.158 CC(C)CCNc1ccccc1O Amb27458173 [0,2,0,0,0,0|2,0,0]=4 10924 B13R1.158 CC(C)CCNc1cccnc1Br Amb27791466 [0,2,0,0,0,0|2,0,0]=4 10925 B13R1.158 CC(C)CCNc1ccncc1Br Amb27879271 [0,2,0,0,0,0|2,0,0]=4 10926 B13R1.158 CC(C)CCOc1ccccc1N Amb1141188 [0,2,0,0,0,0|2,0,0]=4 10927 B13R1.158 CC(C)CCOc1ccccc1N Amb32665391 [0,2,0,0,0,0|2,0,0]=4 10928 B13R1.158 CC(C)CNCc1ccccc1Br Amb19890581 [0,2,0,0,0,0|1,0,0]=3 10929 B13R1.158 CC(C)CNCc1ccccc1Br Amb6686116 [0,2,0,0,0,0|1,0,0]=3 10930 B13R1.158 CC(C)CNCc1ccccc1Cl Amb1923461 [0,2,0,0,0,0|1,1,0]=4 10931 B13R1.158 CC(C)CNCc1ccccc1Cl Amb6865178 [0,2,0,0,0,0|1,1,0]=4 10932 B13R1.158 CC(C)CNCc1ccccc1F Amb19890335 [0,2,0,0,0,0|1,1,0]=4 10933 B13R1.158 CC(C)CNCc1ccccc1F Amb4303793 [0,2,0,0,0,0|1,1,0]=4 10934 B13R1.158 CC(C)CNCc1ccccc1O Amb19890465 [0,2,0,0,0,0|2,0,0]=4 10935 B13R1.158 CC(C)CNCc1ccccc1O Amb6685998 [0,2,0,0,0,0|2,0,0]=4 10936 B13R1.158 CC(C)C\C=C/c1ccccc1Br Amb22546777 [0,2,0,0,0,0|1,0,1]=4 10937 B13R1.158 CC(C)NCCc1ccccc1Cl Amb8853787 [0,2,0,0,0,0|0,1,0]=3 10938 B13R1.158 CC(C)NCCc1ccccc1F Amb6693073 [0,2,0,0,0,0|0,1,0]=3 10939 B13R1.158 CC(Cl)CCNc1ccncc1Br Amb28422580 [0,2,0,0,0,0|2,0,0]=4 10940 B13R1.158 CC(N)CCCc1ccccc1Cl Amb17236681 [0,2,0,0,0,0|1,1,0]=4 10941 B13R1.158 CC(N)CCCc1ccccc1F Amb17233820 [0,2,0,0,0,0|1,1,0]=4 10942 B13R1.158 CC(N)CCOc1ccccc1Br Amb17159571 [0,2,0,0,0,0|1,0,0]=3 10943 B13R1.158 CC(N)CCOc1ccccc1Cl Amb17139784 [0,2,0,0,0,0|1,1,0]=4 10944 B13R1.158 CC(N)CCOc1ccccc1F Amb7772207 [0,2,0,0,0,0|1,1,0]=4 10945 B13R1.158 CC(O)CCNc1ccccc1Cl Amb27798160 [0,2,0,0,0,0|1,1,0]=4 10946 B13R1.158 CC(O)CCNc1ccccc1F Amb28291138 [0,2,0,0,0,0|1,1,0]=4 10947 B13R1.158 CC(O)CCNc1ccccc1N Amb27228575 [0,2,0,0,0,0|2,0,0]=4 10948 B13R1.158 CC(O)CCOc1ccccc1Cl Amb17139828 [0,2,0,0,0,0|1,1,0]=4 10949 B13R1.158 CC(O)CCOc1ccccc1F Amb17139085 [0,2,0,0,0,0|1,1,0]=4 10950 B13R1.158 CC(O)CNCc1ccccc1Cl Amb9245691 [0,2,0,0,0,0|1,1,0]=4 10951 B13R1.158 CC(O)CNCc1ccccc1F Amb2692204 [0,2,0,0,0,0|1,1,0]=4 10952 B13R1.158 CC(O)CNCc1ccccc1O Amb9359532 [0,2,0,0,0,0|2,0,0]=4 10953 B13R1.158 CN(C)CCCc1ccccc1N Amb17050681 [0,2,0,0,0,0|1,0,0]=3 10954 B13R1.158 CN(C)CCNc1ccccc1Br Amb6712129 [0,2,0,0,0,0|0,0,0]=2 10955 B13R1.158 CN(C)CCNc1ccccc1Cl Amb6712353 [0,2,0,0,0,0|0,1,0]=3 10956 B13R1.158 CN(C)CCNc1ccccc1F Amb6712541 [0,2,0,0,0,0|0,1,0]=3 10957 B13R1.158 CN(C)CCNc1ccccc1N Amb495583 [0,2,0,0,0,0|1,0,0]=3 10958 B13R1.158 CN(C)CCNc1ccccc1O Amb28071241 [0,2,0,0,0,0|1,0,0]=3 10959 B13R1.158 CN(C)CCNc1cccnc1Br Amb27256705 [0,2,0,0,0,0|1,0,0]=3 10960 B13R1.158 CN(C)CCNc1ccncc1F Amb35655198 [0,2,0,0,0,0|1,1,0]=4 10961 B13R1.158 CN(C)CCNc1ncccc1Cl Amb6655428 [0,2,0,0,0,0|1,1,0]=4 10962 B13R1.158 CN(C)CCNc1ncccc1N Amb7767518 [0,2,0,0,0,0|2,0,0]=4 10963 B13R1.158 CN(C)CCNc1ncncc1Br Amb27400937 [0,2,0,0,0,0|2,0,0]=4 10964 B13R1.158 CN(C)CCOC1=CC=CNC1=O Amb18537480 [0,2,0,0,0,0|2,0,0]=4 10965 B13R1.158 CN(C)CCOc1ccccc1Br Amb1242501 [0,2,0,0,0,0|0,0,0]=2 10966 B13R1.158 CN(C)CCOc1ccccc1Br Amb33330118 [0,2,0,0,0,0|0,0,0]=2 10967 B13R1.158 CN(C)CCOc1ccccc1Br Amb6260392 [0,2,0,0,0,0|0,0,0]=2 10968 B13R1.158 CN(C)CCOc1ccccc1F Amb17233995 [0,2,0,0,0,0|0,1,0]=3 10969 B13R1.158 CN(C)CCOc1ccccc1N Amb1111891 [0,2,0,0,0,0|1,0,0]=3 10970 B13R1.158 CN(C)CCOc1ccccc1N Amb28524724 [0,2,0,0,0,0|1,0,0]=3 10971 B13R1.158 CN(C)CCOc1ccccc1N Amb29565796 [0,2,0,0,0,0|1,0,0]=3 10972 B13R1.158 CN(C)CCOc1cccnc1N Amb7787278 [0,2,0,0,0,0|2,0,0]=4 10973 B13R1.158 CN(C)CCOc1ccncc1N Amb19009390 [0,2,0,0,0,0|2,0,0]=4 10974 B13R1.158 CN(C)CCOc1cnccc1N Amb33035256 [0,2,0,0,0,0|2,0,0]=4 10975 B13R1.158 CN(C)CCOc1ncccc1Br Amb33483138 [0,2,0,0,0,0|1,0,0]=3 10976 B13R1.158 CN(C)CCOc1ncccc1N Amb17093701 [0,2,0,0,0,0|2,0,0]=4 10977 B13R1.158 CN(C)CCOc1ncccc1O Amb30621944 [0,2,0,0,0,0|2,0,0]=4 10978 B13R1.158 CN(C)\C=N\Cc1ccccc1F Amb27752854 [0,2,0,0,0,0|0,1,1]=4 10979 B13R1.158 CN(N)CCOc1ccccc1Br Amb18579102 [0,2,0,0,0,0|0,0,0]=2 10980 B13R1.158 CN(N)CCOc1ccccc1Cl Amb18566290 [0,2,0,0,0,0|0,1,0]=3 10981 B13R1.158 CN(N)CCOc1ccccc1F Amb18066136 [0,2,0,0,0,0|0,1,0]=3 10982 B13R1.158 CS(=O)CCNc1ccccc1I Amb27855612 [0,2,0,0,0,0|1,1,0]=4 10983 B13R1.158 C[C@H](N)COCc1ccccc1Cl Amb17061663 [0,2,0,0,0,0|1,1,0]=4 10984 B13R1.158 C[C@H](N)COCc1ccccc1F Amb17061660 [0,2,0,0,0,0|1,1,0]=4 10985 B13R1.158 Cc1ccccc1CCCC(C)N Amb17233313 [0,2,0,0,0,0|2,0,0]=4 10986 B13R1.158 Cc1ccccc1CCNC(=N)N Amb18065724 [0,2,0,0,0,0|1,0,1]=4 10987 B13R1.158 Cc1ccccc1CCNC(C)C Amb8841497 [0,2,0,0,0,0|1,0,0]=3 10988 B13R1.158 Cc1ccccc1CCNC(N)=S Amb27180080 [0,2,0,0,0,0|1,0,1]=4 10989 B13R1.158 Cc1ccccc1CNCC(C)C Amb1923477 [0,2,0,0,0,0|2,0,0]=4 10990 B13R1.158 Cc1ccccc1CNCC(C)C Amb6865258 [0,2,0,0,0,0|2,0,0]=4 10991 B13R1.158 Cc1ccccc1CNCC(C)O Amb9245703 [0,2,0,0,0,0|2,0,0]=4 10992 B13R1.158 Cc1ccccc1COC[C@H](C)N Amb17061657 [0,2,0,0,0,0|2,0,0]=4 10993 B13R1.158 Cc1ccccc1NCCC(C)C Amb6701137 [0,2,0,0,0,0|2,0,0]=4 10994 B13R1.158 Cc1ccccc1NCCN(C)C Amb6714246 [0,2,0,0,0,0|1,0,0]=3 10995 B13R1.158 Cc1ccccc1NCCS(C)=O Amb27620836 [0,2,0,0,0,0|2,0,0]=4 10996 B13R1.158 Cc1ccccc1OCCC(C)N Amb7772213 [0,2,0,0,0,0|2,0,0]=4 10997 B13R1.158 Cc1ccccc1OCCC(C)O Amb17138975 [0,2,0,0,0,0|2,0,0]=4 10998 B13R1.158 Cc1ccccc1OCCN(C)C Amb2876296 [0,2,0,0,0,0|1,0,0]=3 10999 B13R1.158 Cc1ccccc1OCCN(C)N Amb18065974 [0,2,0,0,0,0|1,0,0]=3 11000 B13R1.158 Cc1cnccc1NCCN(C)C Amb27447961 [0,2,0,0,0,0|2,0,0]=4 11001 B13R1.158 N=C(N)NCCc1ccccc1Br Amb18071317 [0,2,0,0,0,0|0,0,1]=3 11002 B13R1.158 N=C(N)NCCc1ccccc1Cl Amb18066463 [0,2,0,0,0,0|0,1,1]=4 11003 B13R1.158 N=C(N)NCCc1ccccc1F Amb31156131 [0,2,0,0,0,0|0,1,1]=4 11004 B13R1.158 NC(=O)CCNc1ccccc1Br Amb8842938 [0,2,0,0,0,0|2,0,0]=4 11005 B13R1.158 NC(=O)NCCc1ccccc1Cl Amb24627934 [0,2,0,0,0,0|0,1,1]=4 11006 B13R1.158 NC(=O)NCCc1ccccc1O Amb28048054 [0,2,0,0,0,0|1,0,1]=4 11007 B13R1.158 O=C(Cl)NCCc1ccccc1F Amb35625505 [0,2,0,0,0,0|0,1,1]=4 11008 B13R1.158 O=C(Cl)OCCc1ccccc1Br Amb33297174 [0,2,0,0,0,0|1,0,1]=4 11009 B13R1.158 O=C(O)CCCc1ccccc1Br Amb33545182 [0,2,0,0,0,0|1,0,1]=4 11010 B13R1.158 O=C(O)CCNc1ccccc1Br Amb7766524 [0,2,0,0,0,0|2,0,0]=4 11011 B13R1.158 O=C(O)CCOc1ccccc1Br Amb1117859 [0,2,0,0,0,0|2,0,0]=4 11012 B13R1.158 O=C(O)CCSc1ccccc1Br Amb1113939 [0,2,0,0,0,0|2,0,0]=4 11013 B13R1.158 O=C(O)CNCc1ccccc1Br Amb1111282 [0,2,0,0,0,0|2,0,0]=4 11014 B13R1.158 O=C(O)COCc1ccccc1Br Amb32669719 [0,2,0,0,0,0|2,0,0]=4 11015 B13R1.158 O=C(O)CSCc1ccccc1Br Amb2372136 [0,2,0,0,0,0|2,0,0]=4 11016 B13R1.470 CC(CC#N)Nc1ccccc1Br Amb17158704 [0,2,0,0,0,0|2,0,0]=4 11017 B13R1.470 CC(CC#N)Oc1ccccc1Br Amb17255070 [0,2,0,0,0,0|2,0,0]=4 11018 B13R1.470 CC(CCN)Cc1ccccc1Cl Amb17236688 [0,2,0,0,0,0|1,1,0]=4 11019 B13R1.470 CC(CCN)Cc1ccccc1F Amb17233826 [0,2,0,0,0,0|1,1,0]=4 11020 B13R1.470 CC(CCN)Oc1ccccc1Br Amb17256974 [0,2,0,0,0,0|2,0,0]=4 11021 B13R1.470 CC(CCO)Cc1ccccc1Cl Amb17236858 [0,2,0,0,0,0|1,1,0]=4 11022 B13R1.470 CC(CCO)Cc1ccccc1F Amb17233913 [0,2,0,0,0,0|1,1,0]=4 11023 B13R1.470 CC(CCO)Oc1ccccc1Br Amb17257490 [0,2,0,0,0,0|2,0,0]=4 11024 B13R1.470 CC(CNN)Oc1ccccc1Br Amb18579101 [0,2,0,0,0,0|1,0,0]=3 11025 B13R1.470 CC(CNN)Oc1ccccc1Cl Amb18066550 [0,2,0,0,0,0|1,1,0]=4 11026 B13R1.470 CC(CNN)Oc1ccccc1F Amb18564284 [0,2,0,0,0,0|1,1,0]=4 11027 B13R1.470 CC(Cc1ccccc1Br)N=C=O Amb20622477 [0,2,0,0,0,0|0,0,2]=4 11028 B13R1.470 CCCC(=O)Cc1ccccc1C Amb17138794 [0,2,0,0,0,0|2,0,0]=4 11029 B13R1.470 CCCC(=O)Cc1ccccc1Cl Amb17139625 [0,2,0,0,0,0|1,1,0]=4 11030 B13R1.470 CCCC(=O)Cc1ccccc1F Amb17138960 [0,2,0,0,0,0|1,1,0]=4 11031 B13R1.470 CCCC(=O)Nc1ccccc1Br Amb2587895 [0,2,0,0,0,0|1,0,1]=4 11032 B13R1.470 CCCC(C)Nc1ccccc1C Amb6701232 [0,2,0,0,0,0|2,0,0]=4 11033 B13R1.470 CCCC(C)Nc1ccccc1F Amb6697381 [0,2,0,0,0,0|1,1,0]=4 11034 B13R1.470 CCCC(C)Oc1ccccc1N Amb840083 [0,2,0,0,0,0|2,0,0]=4 11035 B13R1.470 CCNC(=O)Cc1ccccc1Br Amb22230625 [0,2,0,0,0,0|0,0,1]=3 11036 B13R1.470 CCNC(=O)Cc1ccccc1Cl Amb23014083 [0,2,0,0,0,0|0,1,1]=4 11037 B13R1.470 CCNC(=O)Cc1ccccc1F Amb8341226 [0,2,0,0,0,0|0,1,1]=4 11038 B13R1.470 CCNC(=O)Cc1ccccc1N Amb1121104 [0,2,0,0,0,0|1,0,1]=4 11039 B13R1.470 CCNC(=O)Cc1cccnc1Br Amb28207078 [0,2,0,0,0,0|1,0,1]=4 11040 B13R1.470 CCNC(=S)Nc1ccccc1Br Amb5287444 [0,2,0,0,0,0|1,0,1]=4 11041 B13R1.470 CCNC(C)Cc1ncccc1C Amb1995152 [0,2,0,0,0,0|2,0,0]=4 11042 B13R1.470 CCOC(=O)Cc1ccccc1Br Amb3429172 [0,2,0,0,0,0|1,0,1]=4 11043 B13R1.470 CN(CCN)Cc1ccccc1Br Amb8956787 [0,2,0,0,0,0|2,0,0]=4 11044 B13R1.470 CN(CCO)Cc1ccccc1Br Amb21861545 [0,2,0,0,0,0|2,0,0]=4 11045 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2277697 [0,2,0,0,0,0|0,0,1]=3 11046 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2370683 [0,2,0,0,0,0|0,0,1]=3 11047 B13R1.470 CNCC(=O)Nc1ccccc1C Amb6251329 [0,2,0,0,0,0|1,0,1]=4 11048 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2281752 [0,2,0,0,0,0|0,1,1]=4 11049 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2370637 [0,2,0,0,0,0|0,1,1]=4 11050 B13R1.470 CNCC(=O)Nc1ccccc1I Amb7755136 [0,2,0,0,0,0|0,1,1]=4 11051 B13R1.470 CNCC(=O)Nc1ccccc1N Amb28291835 [0,2,0,0,0,0|1,0,1]=4 11052 B13R1.470 CNCC(=O)Nc1cccnc1Br Amb28317486 [0,2,0,0,0,0|1,0,1]=4 11053 B13R1.470 CNCC(=O)Nc1ccncc1Br Amb27262998 [0,2,0,0,0,0|1,0,1]=4 11054 B13R1.470 CNCC(=O)Nc1ncccc1Br Amb27975213 [0,2,0,0,0,0|1,0,1]=4 11055 B13R1.470 CNCC(O)Cc1ccccc1Br Amb18071609 [0,2,0,0,0,0|0,0,0]=2 11056 B13R1.470 CNCC(O)Cc1ccccc1C Amb17233563 [0,2,0,0,0,0|1,0,0]=3 11057 B13R1.470 CNCC(O)Cc1ccccc1Cl Amb17237032 [0,2,0,0,0,0|0,1,0]=3 11058 B13R1.470 CNCC(O)Cc1ccccc1F Amb17233986 [0,2,0,0,0,0|0,1,0]=3 11059 B13R1.470 CNC\C(C)=C\c1ccccc1C Amb27828991 [0,2,0,0,0,0|1,0,1]=4 11060 B13R1.470 COCC(=O)Nc1ccccc1Br Amb6279750 [0,2,0,0,0,0|1,0,1]=4 11061 B13R1.470 COCC(C)Nc1ccccc1Br Amb18312244 [0,2,0,0,0,0|1,0,0]=3 11062 B13R1.470 COCC(C)Nc1ccccc1Cl Amb18312248 [0,2,0,0,0,0|1,1,0]=4 11063 B13R1.470 COCC(C)Nc1ccccc1F Amb19024321 [0,2,0,0,0,0|1,1,0]=4 11064 B13R1.470 COCC(C)Nc1ccccc1I Amb28381374 [0,2,0,0,0,0|1,1,0]=4 11065 B13R1.470 COCC(C)Nc1ccccc1N Amb7767687 [0,2,0,0,0,0|2,0,0]=4 11066 B13R1.470 COCC(C)Nc1cccnc1Br Amb28245180 [0,2,0,0,0,0|2,0,0]=4 11067 B13R1.470 COCC(C)Nc1ccncc1Br Amb28382409 [0,2,0,0,0,0|2,0,0]=4 11068 B13R1.470 COCC(C)Nc1ncccc1Br Amb19015765 [0,2,0,0,0,0|2,0,0]=4 11069 B13R1.470 COCC(C)Oc1ccccc1N Amb9702192 [0,2,0,0,0,0|2,0,0]=4 11070 B13R1.470 COC[C@@H](C)Nc1ncccc1Br Amb27218766 [0,2,0,0,0,0|2,0,0]=4 11071 B13R1.470 CONC(=O)Cc1ccccc1C Amb10694421 [0,2,0,0,0,0|1,0,1]=4 11072 B13R1.470 CONC(=O)Cc1ccccc1N Amb28122050 [0,2,0,0,0,0|1,0,1]=4 11073 B13R1.470 CSCC(=O)Cc1ccccc1F Amb19055167 [0,2,0,0,0,0|1,1,0]=4 11074 B13R1.470 CSCC(C)Nc1ccncc1Br Amb27236378 [0,2,0,0,0,0|2,0,0]=4 11075 B13R1.470 Cc1ccccc1CC(C)CCN Amb17233327 [0,2,0,0,0,0|2,0,0]=4 11076 B13R1.470 Cc1ccccc1CC(C)CCO Amb17233450 [0,2,0,0,0,0|2,0,0]=4 11077 B13R1.470 Cc1ccccc1CC(O)CCN Amb17233580 [0,2,0,0,0,0|2,0,0]=4 11078 B13R1.470 Cc1ccccc1OC(C)CNN Amb18065973 [0,2,0,0,0,0|2,0,0]=4 11079 B13R1.470 N#CNC(=O)Cc1ccccc1Br Amb35692650 [0,2,0,0,0,0|0,0,2]=4 11080 B13R1.470 NC(CCO)Cc1ccccc1Br Amb18155748 [0,2,0,0,0,0|1,0,0]=3 11081 B13R1.470 NC(CCO)Cc1ccccc1Cl Amb18187529 [0,2,0,0,0,0|1,1,0]=4 11082 B13R1.470 NCCC(O)Cc1ccccc1Br Amb18155766 [0,2,0,0,0,0|1,0,0]=3 11083 B13R1.470 NCCC(O)Cc1ccccc1Cl Amb17237045 [0,2,0,0,0,0|1,1,0]=4 11084 B13R1.470 NCCC(O)Cc1ccccc1F Amb17233997 [0,2,0,0,0,0|1,1,0]=4 11085 B13R1.470 NNCC(=O)Nc1ccccc1Br Amb28319563 [0,2,0,0,0,0|1,0,1]=4 11086 B13R1.555 CC#CCCNc1ccccc1Br Amb27474469 [0,2,0,0,0,0|1,0,0]=3 11087 B13R1.555 CC#CCCOc1ccccc1F Amb27971913 [0,2,0,0,0,0|1,1,0]=4 11088 B13R1.555 CC#CCCOc1cccnc1Br Amb28077402 [0,2,0,0,0,0|2,0,0]=4 11089 B13R1.555 CC#CCCSc1ccccc1O Amb28293418 [0,2,0,0,0,0|2,0,0]=4 11090 B13R1.555 CC#CCNCc1ccccc1C Amb18803521 [0,2,0,0,0,0|2,0,0]=4 11091 B13R1.555 CC#CCNCc1ccccc1Cl Amb18324690 [0,2,0,0,0,0|1,1,0]=4 11092 B13R1.555 CC#CCNCc1ccccc1N Amb27803308 [0,2,0,0,0,0|2,0,0]=4 11093 B13R1.555 CC#CCNCc1ncccc1Br Amb27179442 [0,2,0,0,0,0|2,0,0]=4 11094 B13R1.555 CC#CCSCc1ccccc1Br Amb27188975 [0,2,0,0,0,0|1,0,0]=3 11095 B13R1.555 CC#CCSCc1ccccc1C Amb27589494 [0,2,0,0,0,0|2,0,0]=4 11096 B13R1.555 CC#CCSCc1ccccc1F Amb28188148 [0,2,0,0,0,0|1,1,0]=4 11097 B13R1.555 CCCCC#Cc1ccccc1C Amb27641296 [0,2,0,0,0,0|2,0,0]=4 11098 B13R1.555 CCCCC#Cc1ccccc1N Amb25900192 [0,2,0,0,0,0|2,0,0]=4 11099 B13R1.555 CCCCCNc1ccccc1C Amb6714250 [0,2,0,0,0,0|2,0,0]=4 11100 B13R1.555 CCCCCNc1ccccc1Cl Amb6611214 [0,2,0,0,0,0|1,1,0]=4 11101 B13R1.555 CCCCCNc1ccccc1F Amb6712544 [0,2,0,0,0,0|1,1,0]=4 11102 B13R1.555 CCCCCNc1ncccc1Br Amb19374420 [0,2,0,0,0,0|2,0,0]=4 11103 B13R1.555 CCCCCOc1ccccc1N Amb840082 [0,2,0,0,0,0|2,0,0]=4 11104 B13R1.555 CCCCCOc1ncccc1Br Amb19300489 [0,2,0,0,0,0|2,0,0]=4 11105 B13R1.555 CCCCCSc1ccccc1N Amb6666821 [0,2,0,0,0,0|2,0,0]=4 11106 B13R1.555 CCCCNCc1ccccc1Br Amb20673550 [0,2,0,0,0,0|1,0,0]=3 11107 B13R1.555 CCCCNCc1ccccc1Br Amb6691117 [0,2,0,0,0,0|1,0,0]=3 11108 B13R1.555 CCCCNCc1ccccc1C Amb1923466 [0,2,0,0,0,0|2,0,0]=4 11109 B13R1.555 CCCCNCc1ccccc1C Amb6865207 [0,2,0,0,0,0|2,0,0]=4 11110 B13R1.555 CCCCNCc1ccccc1Cl Amb1931460 [0,2,0,0,0,0|1,1,0]=4 11111 B13R1.555 CCCCNCc1ccccc1Cl Amb6542612 [0,2,0,0,0,0|1,1,0]=4 11112 B13R1.555 CCCCNCc1ccccc1F Amb6691101 [0,2,0,0,0,0|1,1,0]=4 11113 B13R1.555 CCCCNCc1ccccc1F Amb6865206 [0,2,0,0,0,0|1,1,0]=4 11114 B13R1.555 CCCCNCc1ccccc1O Amb19890814 [0,2,0,0,0,0|2,0,0]=4 11115 B13R1.555 CCCCNCc1ccccc1O Amb936944 [0,2,0,0,0,0|2,0,0]=4 11116 B13R1.555 CCCCSCc1ccccc1Br Amb33859230 [0,2,0,0,0,0|1,0,0]=3 11117 B13R1.555 CCCNCCc1cccnc1C Amb33040284 [0,2,0,0,0,0|2,0,0]=4 11118 B13R1.555 CCNCC#Cc1ccccc1C Amb27970359 [0,2,0,0,0,0|1,0,1]=4 11119 B13R1.555 CCNCC#Cc1ccccc1Cl Amb27664444 [0,2,0,0,0,0|0,1,1]=4 11120 B13R1.555 CCNCCOc1ccccc1Br Amb8620386 [0,2,0,0,0,0|0,0,0]=2 11121 B13R1.555 CCNCCOc1ccccc1C Amb28963432 [0,2,0,0,0,0|1,0,0]=3 11122 B13R1.555 CCNCCOc1ccccc1C Amb7760970 [0,2,0,0,0,0|1,0,0]=3 11123 B13R1.555 CCNCCOc1ccccc1Cl Amb7760971 [0,2,0,0,0,0|0,1,0]=3 11124 B13R1.555 CCNCCOc1ccccc1F Amb7760968 [0,2,0,0,0,0|0,1,0]=3 11125 B13R1.555 CCOCCNc1ccccc1N Amb8396582 [0,2,0,0,0,0|2,0,0]=4 11126 B13R1.555 CCOCCOc1ccccc1N Amb2111920 [0,2,0,0,0,0|2,0,0]=4 11127 B13R1.555 CCOCCOc1ccccc1N Amb6676242 [0,2,0,0,0,0|2,0,0]=4 11128 B13R1.555 CCOCCOc1ncccc1Br Amb19349907 [0,2,0,0,0,0|2,0,0]=4 11129 B13R1.555 CNCCC#Cc1ccccc1C Amb35618190 [0,2,0,0,0,0|1,0,0]=3 11130 B13R1.555 CNCCC#Cc1ccccc1Cl Amb30024600 [0,2,0,0,0,0|0,1,0]=3 11131 B13R1.555 CNCCC#Cc1ccccc1F Amb35618200 [0,2,0,0,0,0|0,1,0]=3 11132 B13R1.555 CNCCC#Cc1ccncc1C Amb35738182 [0,2,0,0,0,0|2,0,0]=4 11133 B13R1.555 CNCCC#Cc1ccncc1F Amb30024596 [0,2,0,0,0,0|1,1,0]=4 11134 B13R1.555 CNCCC#Cc1cnccc1C Amb35618193 [0,2,0,0,0,0|2,0,0]=4 11135 B13R1.555 CNCCCOc1ccccc1Br Amb22588052 [0,2,0,0,0,0|0,0,0]=2 11136 B13R1.555 CNCCCOc1ccccc1Br Amb7798222 [0,2,0,0,0,0|0,0,0]=2 11137 B13R1.555 CNCCCOc1ccccc1C Amb5562391 [0,2,0,0,0,0|1,0,0]=3 11138 B13R1.555 CNCCCOc1ccccc1Cl Amb5562393 [0,2,0,0,0,0|0,1,0]=3 11139 B13R1.555 CNCCCOc1ccccc1F Amb7798486 [0,2,0,0,0,0|0,1,0]=3 11140 B13R1.555 CNCCSCc1ccccc1C Amb18324952 [0,2,0,0,0,0|1,0,0]=3 11141 B13R1.555 CNCCSCc1ccccc1Cl Amb20224037 [0,2,0,0,0,0|0,1,0]=3 11142 B13R1.555 CNCCSCc1ccccc1F Amb20224043 [0,2,0,0,0,0|0,1,0]=3 11143 B13R1.555 COCCCNc1ccccc1N Amb8843666 [0,2,0,0,0,0|2,0,0]=4 11144 B13R1.555 COCCCOc1ccccc1Br Amb17257505 [0,2,0,0,0,0|1,0,0]=3 11145 B13R1.555 COCCCOc1ccccc1N Amb9026891 [0,2,0,0,0,0|2,0,0]=4 11146 B13R1.555 COCCNCc1ccccc1Br Amb6685749 [0,2,0,0,0,0|1,0,0]=3 11147 B13R1.555 COCCNCc1ccccc1C Amb17622504 [0,2,0,0,0,0|2,0,0]=4 11148 B13R1.555 COCCNCc1ccccc1C Amb6685573 [0,2,0,0,0,0|2,0,0]=4 11149 B13R1.555 COCCNCc1ccccc1Cl Amb13949020 [0,2,0,0,0,0|1,1,0]=4 11150 B13R1.555 COCCNCc1ccccc1Cl Amb4552724 [0,2,0,0,0,0|1,1,0]=4 11151 B13R1.555 COCCNCc1ccccc1F Amb1836065 [0,2,0,0,0,0|1,1,0]=4 11152 B13R1.555 COCCNCc1ccccc1F Amb6865358 [0,2,0,0,0,0|1,1,0]=4 11153 B13R1.555 COCCNCc1ccccc1O Amb1836923 [0,2,0,0,0,0|2,0,0]=4 11154 B13R1.555 COCOCCc1ccccc1F Amb22641546 [0,2,0,0,0,0|1,1,0]=4 11155 B13R1.555 C\C=C\CCNc1ncccc1Br Amb27812568 [0,2,0,0,0,0|2,0,0]=4 11156 B13R1.555 Cc1ccccc1CCNCCN Amb31094268 [0,2,0,0,0,0|1,0,0]=3 11157 B13R1.555 Cc1ccccc1CCNCCO Amb17400737 [0,2,0,0,0,0|1,0,0]=3 11158 B13R1.555 Cc1ccccc1CNCCCBr Amb33068942 [0,2,0,0,0,0|2,0,0]=4 11159 B13R1.555 Cc1ccccc1CNCCCBr Amb33164125 [0,2,0,0,0,0|2,0,0]=4 11160 B13R1.555 Cc1ccccc1CNCCCN Amb10075556 [0,2,0,0,0,0|2,0,0]=4 11161 B13R1.555 Cc1ccccc1CNCCCO Amb6733570 [0,2,0,0,0,0|2,0,0]=4 11162 B13R1.555 Cc1ccccc1CSCCCN Amb10608340 [0,2,0,0,0,0|2,0,0]=4 11163 B13R1.555 Cc1ccccc1OCCCCO Amb9370675 [0,2,0,0,0,0|2,0,0]=4 11164 B13R1.555 ClC\C=C\CNc1ccccc1Br Amb27609069 [0,2,0,0,0,0|1,0,1]=4 11165 B13R1.555 Clc1ccccc1OCCCCBr Amb8517130 [0,2,0,0,0,0|1,1,0]=4 11166 B13R1.555 Fc1ccccc1OCCCCBr Amb8517231 [0,2,0,0,0,0|1,1,0]=4 11167 B13R1.555 N#CCCCOc1ccccc1Br Amb6260920 [0,2,0,0,0,0|1,0,1]=4 11168 B13R1.555 N#CCNCCc1ccccc1F Amb6710702 [0,2,0,0,0,0|0,1,0]=3 11169 B13R1.555 NCCCC#Cc1ccccc1Br Amb28243176 [0,2,0,0,0,0|1,0,1]=4 11170 B13R1.555 NCCCCOc1ccccc1Cl Amb32662391 [0,2,0,0,0,0|1,1,0]=4 11171 B13R1.555 NCCCCOc1ccccc1Cl Amb9392564 [0,2,0,0,0,0|1,1,0]=4 11172 B13R1.555 NCCCCOc1ccccc1F Amb32662389 [0,2,0,0,0,0|1,1,0]=4 11173 B13R1.555 NCCCCOc1ccccc1F Amb6248985 [0,2,0,0,0,0|1,1,0]=4 11174 B13R1.555 NCCCCSc1ccccc1Br Amb19374152 [0,2,0,0,0,0|1,0,0]=3 11175 B13R1.555 NCCCCSc1ccccc1Br Amb9391374 [0,2,0,0,0,0|1,0,0]=3 11176 B13R1.555 NCCCNCc1ccccc1Br Amb31094279 [0,2,0,0,0,0|1,0,0]=3 11177 B13R1.555 NCCCNCc1ccccc1Cl Amb2389533 [0,2,0,0,0,0|1,1,0]=4 11178 B13R1.555 NCCCNCc1ccccc1F Amb17315306 [0,2,0,0,0,0|1,1,0]=4 11179 B13R1.555 NCCCSCc1ccccc1Cl Amb10608255 [0,2,0,0,0,0|1,1,0]=4 11180 B13R1.555 NCCCSCc1ccccc1F Amb10608376 [0,2,0,0,0,0|1,1,0]=4 11181 B13R1.555 NCCNCCc1ccccc1Cl Amb31094272 [0,2,0,0,0,0|0,1,0]=3 11182 B13R1.555 NCCNCCc1ccccc1F Amb17091032 [0,2,0,0,0,0|0,1,0]=3 11183 B13R1.555 NC\C=C\COc1ccccc1Br Amb32428723 [0,2,0,0,0,0|1,0,1]=4 11184 B13R1.555 O=C=NCCOc1ccccc1Br Amb17104903 [0,2,0,0,0,0|0,0,2]=4 11185 B13R1.555 OCCCCOc1ccccc1Cl Amb9370656 [0,2,0,0,0,0|1,1,0]=4 11186 B13R1.555 OCCCNCc1ccccc1Br Amb6733748 [0,2,0,0,0,0|1,0,0]=3 11187 B13R1.555 OCCCNCc1ccccc1Cl Amb22586768 [0,2,0,0,0,0|1,1,0]=4 11188 B13R1.555 OCCCNCc1ccccc1Cl Amb2722026 [0,2,0,0,0,0|1,1,0]=4 11189 B13R1.555 OCCCNCc1ccccc1F Amb4304115 [0,2,0,0,0,0|1,1,0]=4 11190 B13R1.555 OCCCNCc1ccccc1O Amb6733611 [0,2,0,0,0,0|2,0,0]=4 11191 B13R1.555 OCCNCCc1ccccc1Cl Amb17402328 [0,2,0,0,0,0|0,1,0]=3 11192 B13R1.555 OCCNCCc1ccccc1F Amb6710744 [0,2,0,0,0,0|0,1,0]=3 11193 B13R1.555 Oc1ccccc1OCCCCBr Amb23590650 [0,2,0,0,0,0|2,0,0]=4 11194 B13R1.555 S=C=NCCOc1ccccc1Br Amb17266162 [0,2,0,0,0,0|0,0,2]=4 11195 B13R1.656 C#CCCNc1cc(I)ccc1Br Amb27669519 [0,2,0,0,0,0|1,0,1]=4 11196 B13R1.656 C#CCCOc1cc(C)ccc1Br Amb35665079 [0,2,0,0,0,0|1,0,1]=4 11197 B13R1.656 C#CCCOc1cc(N)ccc1Br Amb27403835 [0,2,0,0,0,0|1,0,1]=4 11198 B13R1.656 C#CCSCc1cc(F)ccc1Br Amb28185583 [0,2,0,0,0,0|1,0,1]=4 11199 B13R1.656 C=CCCNc1cc(Cl)ccc1Br Amb27984460 [0,2,0,0,0,0|1,0,1]=4 11200 B13R1.656 C=CCCNc1cc(F)ccc1Br Amb27807890 [0,2,0,0,0,0|1,0,1]=4 11201 B13R1.656 CC#CCNc1cc(Cl)ccc1Br Amb27970433 [0,2,0,0,0,0|1,0,1]=4 11202 B13R1.656 CC#CCOc1cc(C)ccc1Br Amb35663032 [0,2,0,0,0,0|1,0,1]=4 11203 B13R1.656 CCCCNc1cc(Br)ccc1F Amb9417711 [0,2,0,0,0,0|1,1,0]=4 11204 B13R1.656 CCCCNc1cc(Br)ccc1N Amb25197893 [0,2,0,0,0,0|2,0,0]=4 11205 B13R1.656 CCCCNc1cc(C)ccc1C Amb4313703 [0,2,0,0,0,0|2,0,0]=4 11206 B13R1.656 CCCCNc1cc(C)ccc1N Amb23114180 [0,2,0,0,0,0|2,0,0]=4 11207 B13R1.656 CCCCNc1cc(C)cnc1Br Amb28242735 [0,2,0,0,0,0|2,0,0]=4 11208 B13R1.656 CCCCNc1cc(Cl)ccc1C Amb6616163 [0,2,0,0,0,0|2,0,0]=4 11209 B13R1.656 CCCCNc1cc(Cl)ccc1Cl Amb6639025 [0,2,0,0,0,0|1,1,0]=4 11210 B13R1.656 CCCCNc1cc(Cl)ccc1F Amb9238484 [0,2,0,0,0,0|1,1,0]=4 11211 B13R1.656 CCCCNc1cc(Cl)ccc1I Amb30016038 [0,2,0,0,0,0|1,1,0]=4 11212 B13R1.656 CCCCNc1cc(Cl)ccc1N Amb26495541 [0,2,0,0,0,0|2,0,0]=4 11213 B13R1.656 CCCCNc1cc(Cl)cnc1Br Amb27415472 [0,2,0,0,0,0|2,0,0]=4 11214 B13R1.656 CCCCNc1cc(F)ccc1C Amb6698532 [0,2,0,0,0,0|2,0,0]=4 11215 B13R1.656 CCCCNc1cc(F)ccc1F Amb6691520 [0,2,0,0,0,0|1,1,0]=4 11216 B13R1.656 CCCCNc1cc(F)ccc1N Amb19021452 [0,2,0,0,0,0|2,0,0]=4 11217 B13R1.656 CCCCNc1cc(I)ccc1Br Amb28120982 [0,2,0,0,0,0|1,0,0]=3 11218 B13R1.656 CCCCNc1cc(I)ccc1Cl Amb27475753 [0,2,0,0,0,0|1,1,0]=4 11219 B13R1.656 CCCCNc1cc(N)ncc1Br Amb27491088 [0,2,0,0,0,0|2,0,0]=4 11220 B13R1.656 CCCCOc1cc(Br)ccc1F Amb30591625 [0,2,0,0,0,0|1,1,0]=4 11221 B13R1.656 CCCCOc1cc(Br)ccc1N Amb33035370 [0,2,0,0,0,0|2,0,0]=4 11222 B13R1.656 CCCCOc1cc(C)ccc1N Amb6278459 [0,2,0,0,0,0|2,0,0]=4 11223 B13R1.656 CCCCOc1cc(Cl)ccc1N Amb19086091 [0,2,0,0,0,0|2,0,0]=4 11224 B13R1.656 CCCCOc1cc(F)ccc1Br Amb21856386 [0,2,0,0,0,0|1,0,0]=3 11225 B13R1.656 CCCCOc1cc(F)ccc1N Amb1137535 [0,2,0,0,0,0|2,0,0]=4 11226 B13R1.656 CCCCOc1cc(N)ccc1C Amb9381360 [0,2,0,0,0,0|2,0,0]=4 11227 B13R1.656 CCCNCc1cc(Br)ccc1F Amb6256248 [0,2,0,0,0,0|1,1,0]=4 11228 B13R1.656 CCCNCc1cc(Br)ccc1O Amb19890411 [0,2,0,0,0,0|2,0,0]=4 11229 B13R1.656 CCCNCc1cc(Br)ccc1O Amb19892254 [0,2,0,0,0,0|2,0,0]=4 11230 B13R1.656 CCCNCc1cc(C)ccc1C Amb6283836 [0,2,0,0,0,0|2,0,0]=4 11231 B13R1.656 CCCNCc1cc(C)ccc1O Amb33496290 [0,2,0,0,0,0|2,0,0]=4 11232 B13R1.656 CCCNCc1cc(Cl)ccc1Br Amb33363112 [0,2,0,0,0,0|1,0,0]=3 11233 B13R1.656 CCCNCc1cc(Cl)ccc1O Amb6280999 [0,2,0,0,0,0|2,0,0]=4 11234 B13R1.656 CCCNCc1cc(F)ccc1F Amb8853736 [0,2,0,0,0,0|1,1,0]=4 11235 B13R1.656 CCNCCc1cc(Br)ccc1C Amb33068792 [0,2,0,0,0,0|1,0,0]=3 11236 B13R1.656 CCNCCc1cc(C)ccc1C Amb17400631 [0,2,0,0,0,0|1,0,0]=3 11237 B13R1.656 CCNCCc1cc(Cl)ccc1F Amb18244120 [0,2,0,0,0,0|0,1,0]=3 11238 B13R1.656 CNCC#Cc1cc(C)ccc1F Amb27219599 [0,2,0,0,0,0|0,1,1]=4 11239 B13R1.656 CNCCCc1cc(C)ccc1C Amb17400632 [0,2,0,0,0,0|1,0,0]=3 11240 B13R1.656 CNCCCc1cc(Cl)ccc1C Amb18066468 [0,2,0,0,0,0|1,0,0]=3 11241 B13R1.656 CNCCCc1cc(Cl)ccc1Cl Amb18067276 [0,2,0,0,0,0|0,1,0]=3 11242 B13R1.656 CNCCCc1cc(Cl)ccc1F Amb18864492 [0,2,0,0,0,0|0,1,0]=3 11243 B13R1.656 CNCCOc1cc(C)ccc1C Amb7760946 [0,2,0,0,0,0|1,0,0]=3 11244 B13R1.656 CNCCOc1cc(C)ccc1Cl Amb9025114 [0,2,0,0,0,0|0,1,0]=3 11245 B13R1.656 CNCCOc1cc(Cl)ccc1Cl Amb7760954 [0,2,0,0,0,0|0,1,0]=3 11246 B13R1.656 CNCCOc1cc(F)ccc1Cl Amb32412207 [0,2,0,0,0,0|0,1,0]=3 11247 B13R1.656 CNC\C=C\c1cc(Br)ccc1C Amb26923256 [0,2,0,0,0,0|1,0,1]=4 11248 B13R1.656 CNC\C=C\c1cc(Br)ccc1Cl Amb27219982 [0,2,0,0,0,0|0,1,1]=4 11249 B13R1.656 CNC\C=C\c1cc(Br)ccc1F Amb26463790 [0,2,0,0,0,0|0,1,1]=4 11250 B13R1.656 CNC\C=C\c1cc(C)ccc1C Amb25094743 [0,2,0,0,0,0|1,0,1]=4 11251 B13R1.656 CNC\C=C\c1cc(C)ccc1F Amb28346204 [0,2,0,0,0,0|0,1,1]=4 11252 B13R1.656 CNC\C=C\c1cc(Cl)ccc1Br Amb27947068 [0,2,0,0,0,0|0,0,1]=3 11253 B13R1.656 CNC\C=C\c1cc(Cl)ccc1F Amb25848623 [0,2,0,0,0,0|0,1,1]=4 11254 B13R1.656 CNC\C=C\c1cc(F)ccc1F Amb25894120 [0,2,0,0,0,0|0,1,1]=4 11255 B13R1.656 COCCNc1cc(Br)ccc1Cl Amb27601193 [0,2,0,0,0,0|1,1,0]=4 11256 B13R1.656 COCCNc1cc(Br)ccc1N Amb27167161 [0,2,0,0,0,0|2,0,0]=4 11257 B13R1.656 COCCNc1cc(C)ccc1C Amb6714131 [0,2,0,0,0,0|2,0,0]=4 11258 B13R1.656 COCCNc1cc(C)ccc1Cl Amb27952468 [0,2,0,0,0,0|1,1,0]=4 11259 B13R1.656 COCCNc1cc(C)ccc1N Amb25116289 [0,2,0,0,0,0|2,0,0]=4 11260 B13R1.656 COCCNc1cc(Cl)ccc1Br Amb27608854 [0,2,0,0,0,0|1,0,0]=3 11261 B13R1.656 COCCNc1cc(Cl)ccc1C Amb6706377 [0,2,0,0,0,0|2,0,0]=4 11262 B13R1.656 COCCNc1cc(Cl)ccc1Cl Amb6707794 [0,2,0,0,0,0|1,1,0]=4 11263 B13R1.656 COCCNc1cc(Cl)ccc1I Amb30016043 [0,2,0,0,0,0|1,1,0]=4 11264 B13R1.656 COCCNc1cc(Cl)ccc1N Amb26342141 [0,2,0,0,0,0|2,0,0]=4 11265 B13R1.656 COCCNc1cc(F)ccc1Br Amb27450804 [0,2,0,0,0,0|1,0,0]=3 11266 B13R1.656 COCCNc1cc(N)ncc1Br Amb27669282 [0,2,0,0,0,0|2,0,0]=4 11267 B13R1.656 COCCOc1cc(Br)ccc1C Amb22491146 [0,2,0,0,0,0|2,0,0]=4 11268 B13R1.656 COCCOc1cc(Br)ccc1Cl Amb21856724 [0,2,0,0,0,0|1,1,0]=4 11269 B13R1.656 COCCOc1cc(Br)ccc1N Amb28994542 [0,2,0,0,0,0|2,0,0]=4 11270 B13R1.656 COCCOc1cc(C)ccc1N Amb6259617 [0,2,0,0,0,0|2,0,0]=4 11271 B13R1.656 COCCOc1cc(Cl)ccc1Br Amb21856723 [0,2,0,0,0,0|1,0,0]=3 11272 B13R1.656 COCCOc1cc(Cl)ccc1N Amb33035550 [0,2,0,0,0,0|2,0,0]=4 11273 B13R1.656 COCCOc1cc(F)ccc1N Amb6251298 [0,2,0,0,0,0|2,0,0]=4 11274 B13R1.656 COCCOc1cc(N)ccc1Br Amb33071716 [0,2,0,0,0,0|1,0,0]=3 11275 B13R1.656 COCCOc1cc(N)ccc1C Amb9381350 [0,2,0,0,0,0|2,0,0]=4 11276 B13R1.656 COCCOc1cc(N)ccc1Cl Amb23454636 [0,2,0,0,0,0|1,1,0]=4 11277 B13R1.656 CSCCNc1cc(Br)ccc1C Amb27218685 [0,2,0,0,0,0|2,0,0]=4 11278 B13R1.656 CSCCNc1cc(Br)ccc1I Amb27242990 [0,2,0,0,0,0|1,1,0]=4 11279 B13R1.656 CSCCNc1cc(C)ccc1Br Amb27414760 [0,2,0,0,0,0|1,0,0]=3 11280 B13R1.656 CSCCNc1cc(C)ccc1C Amb27587218 [0,2,0,0,0,0|2,0,0]=4 11281 B13R1.656 CSCCNc1cc(C)ccc1F Amb27834579 [0,2,0,0,0,0|1,1,0]=4 11282 B13R1.656 CSCCNc1cc(Cl)ccc1C Amb27414594 [0,2,0,0,0,0|2,0,0]=4 11283 B13R1.656 CSCCNc1cc(Cl)ccc1I Amb35706582 [0,2,0,0,0,0|1,1,0]=4 11284 B13R1.656 CSCCNc1cc(F)ccc1Cl Amb27954409 [0,2,0,0,0,0|1,1,0]=4 11285 B13R1.656 CSCCNc1cc(I)ccc1Br Amb27754243 [0,2,0,0,0,0|1,0,0]=3 11286 B13R1.656 C\C=C\COc1cc(C)ccc1Br Amb35663078 [0,2,0,0,0,0|1,0,1]=4 11287 B13R1.656 Cc1ccc(Br)c(CCCC=O)c1 Amb33477888 [0,2,0,0,0,0|1,0,1]=4 11288 B13R1.656 Cc1ccc(Br)c(CCCCN)c1 Amb33478404 [0,2,0,0,0,0|1,0,0]=3 11289 B13R1.656 Cc1ccc(Br)c(CCN=C=O)c1 Amb33227825 [0,2,0,0,0,0|0,0,2]=4 11290 B13R1.656 Cc1ccc(Br)c(CCN=[N+]=[N-])c1 Amb33477917 [0,2,0,0,0,0|1,0,1]=4 11291 B13R1.656 Cc1ccc(Br)c(NCCCF)c1 Amb27749872 [0,2,0,0,0,0|2,0,0]=4 11292 B13R1.656 Cc1ccc(Br)c(OCCC#N)c1 Amb35678632 [0,2,0,0,0,0|2,0,0]=4 11293 B13R1.656 Cc1ccc(Br)c(OCCCN)c1 Amb33450938 [0,2,0,0,0,0|2,0,0]=4 11294 B13R1.656 Cc1ccc(Br)cc1CCCCN Amb33387319 [0,2,0,0,0,0|2,0,0]=4 11295 B13R1.656 Cc1ccc(C)c(CCCCN)c1 Amb17194517 [0,2,0,0,0,0|2,0,0]=4 11296 B13R1.656 Cc1ccc(C)c(CCCCO)c1 Amb17089155 [0,2,0,0,0,0|2,0,0]=4 11297 B13R1.656 Cc1ccc(C)c(CCCCS)c1 Amb17401982 [0,2,0,0,0,0|2,0,0]=4 11298 B13R1.656 Cc1ccc(C)c(OCCNN)c1 Amb17400831 [0,2,0,0,0,0|2,0,0]=4 11299 B13R1.656 Cc1ccc(C)c(OCCNO)c1 Amb17088442 [0,2,0,0,0,0|2,0,0]=4 11300 B13R1.656 Cc1ccc(Cl)c(CCCCN)c1 Amb33256626 [0,2,0,0,0,0|1,1,0]=4 11301 B13R1.656 Cc1ccc(Cl)c(OCCNN)c1 Amb17402390 [0,2,0,0,0,0|1,1,0]=4 11302 B13R1.656 Cc1ccc(Cl)c(OCCNO)c1 Amb17088467 [0,2,0,0,0,0|1,1,0]=4 11303 B13R1.656 Cc1ccc(Cl)cc1CCCCN Amb18066469 [0,2,0,0,0,0|2,0,0]=4 11304 B13R1.656 Cc1ccc(F)c(CCCCN)c1 Amb33474741 [0,2,0,0,0,0|1,1,0]=4 11305 B13R1.656 Cc1ccc(F)cc1CCCCN Amb33359555 [0,2,0,0,0,0|2,0,0]=4 11306 B13R1.656 Cc1ccc(O)c(CCCCN)c1 Amb33269438 [0,2,0,0,0,0|2,0,0]=4 11307 B13R1.656 FCCCNc1cc(Cl)ccc1Br Amb27480745 [0,2,0,0,0,0|2,0,0]=4 11308 B13R1.656 Fc1ccc(F)c(CCCCS)c1 Amb18566551 [0,2,0,0,0,0|1,1,0]=4 11309 B13R1.656 N#CCCCc1cc(F)ccc1Br Amb28364193 [0,2,0,0,0,0|1,0,1]=4 11310 B13R1.656 N#CCCNc1cc(Br)ccc1Br Amb28041704 [0,2,0,0,0,0|2,0,0]=4 11311 B13R1.656 N#CCCNc1cc(Cl)ccc1Br Amb28288806 [0,2,0,0,0,0|2,0,0]=4 11312 B13R1.656 N#CCCOc1cc(F)ccc1Br Amb26332034 [0,2,0,0,0,0|2,0,0]=4 11313 B13R1.656 N#CCNCc1cc(O)ccc1Br Amb28204819 [0,2,0,0,0,0|2,0,0]=4 11314 B13R1.656 NCCCCc1cc(Br)ccc1Cl Amb33451677 [0,2,0,0,0,0|1,1,0]=4 11315 B13R1.656 NCCCCc1cc(Br)ccc1F Amb33451670 [0,2,0,0,0,0|1,1,0]=4 11316 B13R1.656 NCCCCc1cc(Br)ccc1O Amb33333589 [0,2,0,0,0,0|2,0,0]=4 11317 B13R1.656 NCCCCc1cc(Cl)ccc1Br Amb33240458 [0,2,0,0,0,0|1,0,0]=3 11318 B13R1.656 NCCCCc1cc(Cl)ccc1Cl Amb18067278 [0,2,0,0,0,0|1,1,0]=4 11319 B13R1.656 NCCCCc1cc(Cl)ccc1F Amb18864493 [0,2,0,0,0,0|1,1,0]=4 11320 B13R1.656 NCCCCc1cc(Cl)ccc1O Amb33261923 [0,2,0,0,0,0|2,0,0]=4 11321 B13R1.656 NCCCCc1cc(Cl)ncc1Br Amb33478186 [0,2,0,0,0,0|2,0,0]=4 11322 B13R1.656 NCCCCc1cc(F)ccc1Br Amb33452096 [0,2,0,0,0,0|1,0,0]=3 11323 B13R1.656 NCCCCc1cc(F)ccc1Cl Amb18177058 [0,2,0,0,0,0|1,1,0]=4 11324 B13R1.656 NCCCCc1cc(F)ccc1F Amb17194575 [0,2,0,0,0,0|1,1,0]=4 11325 B13R1.656 NCCCCc1cc(F)ccc1O Amb33379547 [0,2,0,0,0,0|2,0,0]=4 11326 B13R1.656 NCCCCc1cc(O)ccc1Br Amb33386236 [0,2,0,0,0,0|1,0,0]=3 11327 B13R1.656 NCCCCc1cc(O)ccc1O Amb33268493 [0,2,0,0,0,0|2,0,0]=4 11328 B13R1.656 NCCCNc1cc(Br)ccc1Br Amb27640934 [0,2,0,0,0,0|2,0,0]=4 11329 B13R1.656 NCCCOc1cc(Cl)ccc1Br Amb33450940 [0,2,0,0,0,0|2,0,0]=4 11330 B13R1.656 NCCCOc1cc(F)ccc1Br Amb33452305 [0,2,0,0,0,0|2,0,0]=4 11331 B13R1.656 NCCCOc1cc(O)ccc1Br Amb33387009 [0,2,0,0,0,0|2,0,0]=4 11332 B13R1.656 NNCCOc1cc(Cl)ccc1Cl Amb17405672 [0,2,0,0,0,0|1,1,0]=4 11333 B13R1.656 O=C=NCCc1cc(Cl)ccc1Br Amb20668435 [0,2,0,0,0,0|0,0,2]=4 11334 B13R1.656 O=C=NCCc1cc(F)ccc1Br Amb33008301 [0,2,0,0,0,0|0,0,2]=4 11335 B13R1.656 O=CCCCc1cc(Cl)ccc1Br Amb33451104 [0,2,0,0,0,0|1,0,1]=4 11336 B13R1.656 O=CCCCc1cc(F)ccc1Br Amb33242480 [0,2,0,0,0,0|1,0,1]=4 11337 B13R1.656 O=CCCCc1cc(O)ccc1Br Amb33386651 [0,2,0,0,0,0|1,0,1]=4 11338 B13R1.656 OCCCCc1cc(Cl)ccc1Cl Amb34914132 [0,2,0,0,0,0|1,1,0]=4 11339 B13R1.656 OCCCCc1cc(Cl)ccc1F Amb18225080 [0,2,0,0,0,0|1,1,0]=4 11340 B13R1.656 OCCCCc1cc(F)ccc1F Amb17194581 [0,2,0,0,0,0|1,1,0]=4 11341 B13R1.656 OCCCNc1cc(Br)ccc1Br Amb27856558 [0,2,0,0,0,0|2,0,0]=4 11342 B13R1.656 OCCCNc1cc(F)ccc1Br Amb28041919 [0,2,0,0,0,0|2,0,0]=4 11343 B13R1.656 OCCNCc1cc(Cl)ccc1Br Amb33363123 [0,2,0,0,0,0|2,0,0]=4 11344 B13R1.656 ONCCOc1cc(Cl)ccc1Cl Amb17088471 [0,2,0,0,0,0|1,1,0]=4 11345 B13R1.656 [N-]=[N+]=NCCc1cc(Cl)ccc1Br Amb33478283 [0,2,0,0,0,0|1,0,1]=4 11346 B13R1.656 [N-]=[N+]=NCCc1cc(F)ccc1Br Amb33008801 [0,2,0,0,0,0|1,0,1]=4 11347 B13R1.656 [N-]=[N+]=NCCc1cc(O)ccc1Br Amb33387017 [0,2,0,0,0,0|1,0,1]=4 11348 B13R1.674 C#CCCC(N)c1ccccc1Br Amb27810637 [0,2,0,0,0,0|1,0,1]=4 11349 B13R1.674 C=CCCC(O)c1ccccc1Br Amb32677629 [0,2,0,0,0,0|1,0,1]=4 11350 B13R1.674 C=CCNC(C)c1ccccc1Br Amb6683866 [0,2,0,0,0,0|1,0,1]=4 11351 B13R1.674 CC#CCC(=O)c1ccccc1Br Amb28313078 [0,2,0,0,0,0|1,0,1]=4 11352 B13R1.674 CC#CCC(N)c1ccccc1Br Amb27759149 [0,2,0,0,0,0|1,0,0]=3 11353 B13R1.674 CC#CCC(N)c1ccccc1Cl Amb19062409 [0,2,0,0,0,0|1,1,0]=4 11354 B13R1.674 CC#CCC(N)c1ncccc1Br Amb28060821 [0,2,0,0,0,0|2,0,0]=4 11355 B13R1.674 CC#CCC(O)c1ccccc1Br Amb27210595 [0,2,0,0,0,0|1,0,0]=3 11356 B13R1.674 CC#CCC(O)c1ccccc1C Amb18183852 [0,2,0,0,0,0|2,0,0]=4 11357 B13R1.674 CC(CN=C=O)c1ccccc1Br Amb25039031 [0,2,0,0,0,0|0,0,2]=4 11358 B13R1.674 CC(NCCO)c1ccccc1Br Amb7809193 [0,2,0,0,0,0|2,0,0]=4 11359 B13R1.674 CCCCC(=O)c1ccccc1C Amb8391610 [0,2,0,0,0,0|2,0,0]=4 11360 B13R1.674 CCCCC(=O)c1ccccc1Cl Amb17198752 [0,2,0,0,0,0|1,1,0]=4 11361 B13R1.674 CCCCC(=O)c1ccccc1F Amb17198741 [0,2,0,0,0,0|1,1,0]=4 11362 B13R1.674 CCCCC(=O)c1ccccc1O Amb17621754 [0,2,0,0,0,0|2,0,0]=4 11363 B13R1.674 CCCCC(N)c1ccccc1C Amb18184247 [0,2,0,0,0,0|2,0,0]=4 11364 B13R1.674 CCCCC(N)c1ccccc1C Amb32662438 [0,2,0,0,0,0|2,0,0]=4 11365 B13R1.674 CCCCC(N)c1ccccc1F Amb18791291 [0,2,0,0,0,0|1,1,0]=4 11366 B13R1.674 CCCCN(C)c1ccccc1N Amb6246643 [0,2,0,0,0,0|2,0,0]=4 11367 B13R1.674 CCCNC(=O)c1ccccc1Br Amb6347208 [0,2,0,0,0,0|1,0,1]=4 11368 B13R1.674 CCCNC(C)c1ccccc1Br Amb6264990 [0,2,0,0,0,0|1,0,0]=3 11369 B13R1.674 CCCNC(C)c1ccccc1C Amb6274398 [0,2,0,0,0,0|2,0,0]=4 11370 B13R1.674 CCCNC(C)c1ccccc1Cl Amb6665859 [0,2,0,0,0,0|1,1,0]=4 11371 B13R1.674 CCCNC(C)c1ccccc1F Amb6257107 [0,2,0,0,0,0|1,1,0]=4 11372 B13R1.674 CCNCC(O)c1ccccc1C Amb17138909 [0,2,0,0,0,0|1,0,0]=3 11373 B13R1.674 CCNCC(O)c1ccccc1Cl Amb17139771 [0,2,0,0,0,0|0,1,0]=3 11374 B13R1.674 CCNCC(O)c1ccccc1F Amb17139058 [0,2,0,0,0,0|0,1,0]=3 11375 B13R1.674 CCSCC(=O)c1ccccc1Br Amb9668521 [0,2,0,0,0,0|1,0,1]=4 11376 B13R1.674 CN(CCC#N)c1ccccc1Br Amb17347969 [0,2,0,0,0,0|2,0,0]=4 11377 B13R1.674 CN(CCCCl)c1ccccc1Br Amb17359053 [0,2,0,0,0,0|2,0,0]=4 11378 B13R1.674 CN(CCCN)c1ccccc1Br Amb17059826 [0,2,0,0,0,0|2,0,0]=4 11379 B13R1.674 CN(CCCO)c1ccccc1Br Amb17349692 [0,2,0,0,0,0|2,0,0]=4 11380 B13R1.674 CNCCC(C)c1ccccc1C Amb17233360 [0,2,0,0,0,0|1,0,0]=3 11381 B13R1.674 CNCCC(C)c1ccccc1Cl Amb17236705 [0,2,0,0,0,0|0,1,0]=3 11382 B13R1.674 CNCCC(C)c1ccccc1F Amb17233840 [0,2,0,0,0,0|0,1,0]=3 11383 B13R1.674 CNC\C=C(/C)c1ccccc1C Amb31174808 [0,2,0,0,0,0|1,0,1]=4 11384 B13R1.674 CNC\C=C(/C)c1ccccc1F Amb31174821 [0,2,0,0,0,0|0,1,1]=4 11385 B13R1.674 CNC\C=C(\C)c1ccccc1C Amb27610365 [0,2,0,0,0,0|1,0,1]=4 11386 B13R1.674 COCCC(=O)c1ccccc1C Amb17233410 [0,2,0,0,0,0|2,0,0]=4 11387 B13R1.674 COCCC(=O)c1ccccc1Cl Amb17236834 [0,2,0,0,0,0|1,1,0]=4 11388 B13R1.674 COCCC(=O)c1ccccc1F Amb17233887 [0,2,0,0,0,0|1,1,0]=4 11389 B13R1.674 CSCCC(O)c1ccccc1Cl Amb32661739 [0,2,0,0,0,0|1,1,0]=4 11390 B13R1.674 C[C@H](NCC#N)c1ccccc1Br Amb27453109 [0,2,0,0,0,0|2,0,0]=4 11391 B13R1.674 Cc1ccccc1C(O)CCCN Amb17233564 [0,2,0,0,0,0|2,0,0]=4 11392 B13R1.674 N#CCCC(=O)c1ccccc1Br Amb3941058 [0,2,0,0,0,0|2,0,0]=4 11393 B13R1.674 NCCCC(=O)c1ccccc1Br Amb18727416 [0,2,0,0,0,0|1,0,1]=4 11394 B13R1.674 NCCCC(O)c1ccccc1Br Amb18577254 [0,2,0,0,0,0|1,0,0]=3 11395 B13R1.674 NCCCC(O)c1ccccc1Cl Amb17237033 [0,2,0,0,0,0|1,1,0]=4 11396 B13R1.674 NCCCC(O)c1ccccc1F Amb17233987 [0,2,0,0,0,0|1,1,0]=4 11397 B13R1.674 [C-]#[N+]CCC(F)c1ccccc1Br Amb27438573 [0,2,0,0,0,0|0,0,2]=4 11398 B13R1.674 [N-]=[N+]=NCC(O)c1ccccc1Br Amb24374992 [0,2,0,0,0,0|1,0,1]=4 11399 B13R1.674 [N-]=[N+]=NC[C@@H](O)c1ccccc1Br Amb28382586 [0,2,0,0,0,0|1,0,1]=4 11400 B13R1.674 [N-]=[N+]=NC[C@H](O)c1ccccc1Br Amb24423771 [0,2,0,0,0,0|1,0,1]=4 11401 B13R1.8919 BrCCCOc1c(Br)cccc1Br Amb8828201 [0,2,0,0,0,0|2,0,0]=4 11402 B13R1.8919 C#CCCNc1c(C)cccc1Br Amb35721366 [0,2,0,0,0,0|1,0,1]=4 11403 B13R1.8919 C=CCCNc1c(C)cccc1Br Amb35706689 [0,2,0,0,0,0|1,0,1]=4 11404 B13R1.8919 C=CCCNc1c(N)cccc1Br Amb35638519 [0,2,0,0,0,0|1,0,1]=4 11405 B13R1.8919 CC#CCNc1c(Br)cccc1Br Amb27865267 [0,2,0,0,0,0|1,0,1]=4 11406 B13R1.8919 CC#CCNc1c(C)cccc1Br Amb35706684 [0,2,0,0,0,0|1,0,1]=4 11407 B13R1.8919 CCCCNc1c(C)cccc1Br Amb35721352 [0,2,0,0,0,0|1,0,0]=3 11408 B13R1.8919 CCCCNc1c(C)cccc1C Amb17138830 [0,2,0,0,0,0|2,0,0]=4 11409 B13R1.8919 CCCCNc1c(C)cccc1F Amb28059939 [0,2,0,0,0,0|1,1,0]=4 11410 B13R1.8919 CCCCNc1c(C)cccc1N Amb26625357 [0,2,0,0,0,0|2,0,0]=4 11411 B13R1.8919 CCCCNc1c(F)cccc1Br Amb27764991 [0,2,0,0,0,0|1,0,0]=3 11412 B13R1.8919 CCCCNc1c(F)cccc1Cl Amb27411107 [0,2,0,0,0,0|1,1,0]=4 11413 B13R1.8919 CCCCNc1c(F)cccc1F Amb7760079 [0,2,0,0,0,0|1,1,0]=4 11414 B13R1.8919 CCCCNc1c(N)cccc1Br Amb32708754 [0,2,0,0,0,0|1,0,0]=3 11415 B13R1.8919 CCCCNc1c(N)cccc1Cl Amb7767732 [0,2,0,0,0,0|1,1,0]=4 11416 B13R1.8919 CCCCNc1c(N)cncc1Br Amb22753280 [0,2,0,0,0,0|2,0,0]=4 11417 B13R1.8919 CCCCOc1c(C)cccc1N Amb28984521 [0,2,0,0,0,0|2,0,0]=4 11418 B13R1.8919 CCCCOc1c(N)cccc1Br Amb33035752 [0,2,0,0,0,0|1,0,0]=3 11419 B13R1.8919 CCCCOc1c(N)cccc1Cl Amb840120 [0,2,0,0,0,0|1,1,0]=4 11420 B13R1.8919 CCCCOc1c(N)cccc1F Amb33035566 [0,2,0,0,0,0|1,1,0]=4 11421 B13R1.8919 CCCCOc1c(N)cncc1Br Amb33035415 [0,2,0,0,0,0|2,0,0]=4 11422 B13R1.8919 CCCNCc1c(C)cccc1C Amb33442119 [0,2,0,0,0,0|2,0,0]=4 11423 B13R1.8919 CCCNCc1c(Cl)cccc1Cl Amb19890393 [0,2,0,0,0,0|1,1,0]=4 11424 B13R1.8919 CCCNCc1c(Cl)cccc1Cl Amb838247 [0,2,0,0,0,0|1,1,0]=4 11425 B13R1.8919 CCCNCc1c(F)cccc1Br Amb33838464 [0,2,0,0,0,0|1,0,0]=3 11426 B13R1.8919 CCCNCc1c(F)cccc1Cl Amb19890378 [0,2,0,0,0,0|1,1,0]=4 11427 B13R1.8919 CCCNCc1c(F)cccc1Cl Amb837960 [0,2,0,0,0,0|1,1,0]=4 11428 B13R1.8919 CCCNCc1c(F)cccc1F Amb6273510 [0,2,0,0,0,0|1,1,0]=4 11429 B13R1.8919 CCCNCc1c(O)cccc1Cl Amb33496448 [0,2,0,0,0,0|1,1,0]=4 11430 B13R1.8919 CCNCCc1c(Cl)cccc1Cl Amb17193873 [0,2,0,0,0,0|0,1,0]=3 11431 B13R1.8919 CCNCCc1c(F)cccc1Cl Amb8853689 [0,2,0,0,0,0|0,1,0]=3 11432 B13R1.8919 CNCC#Cc1c(Cl)cccc1Br Amb27242177 [0,2,0,0,0,0|0,0,1]=3 11433 B13R1.8919 CNCC#Cc1c(F)cccc1F Amb27393907 [0,2,0,0,0,0|0,1,1]=4 11434 B13R1.8919 CNCCCc1c(F)cccc1Cl Amb17104515 [0,2,0,0,0,0|0,1,0]=3 11435 B13R1.8919 CNCCCc1c(F)cccc1F Amb23442867 [0,2,0,0,0,0|0,1,0]=3 11436 B13R1.8919 CNCCNc1c(Cl)cccc1Cl Amb18132929 [0,2,0,0,0,0|0,1,0]=3 11437 B13R1.8919 CNCCOc1c(Br)cccc1Br Amb9211547 [0,2,0,0,0,0|0,0,0]=2 11438 B13R1.8919 CNCCOc1c(C)cccc1C Amb17622506 [0,2,0,0,0,0|1,0,0]=3 11439 B13R1.8919 CNCCOc1c(C)cccc1C Amb7760948 [0,2,0,0,0,0|1,0,0]=3 11440 B13R1.8919 CNCCOc1c(Cl)cccc1Cl Amb17099979 [0,2,0,0,0,0|0,1,0]=3 11441 B13R1.8919 CNC\C=C\c1c(F)cccc1Br Amb27232186 [0,2,0,0,0,0|0,0,1]=3 11442 B13R1.8919 COCCNc1c(C)cccc1Br Amb35721356 [0,2,0,0,0,0|1,0,0]=3 11443 B13R1.8919 COCCNc1c(C)cccc1C Amb17138936 [0,2,0,0,0,0|2,0,0]=4 11444 B13R1.8919 COCCNc1c(C)cccc1N Amb25973461 [0,2,0,0,0,0|2,0,0]=4 11445 B13R1.8919 COCCNc1c(F)cccc1F Amb7784595 [0,2,0,0,0,0|1,1,0]=4 11446 B13R1.8919 COCCNc1c(N)cccc1Br Amb32708751 [0,2,0,0,0,0|1,0,0]=3 11447 B13R1.8919 COCCNc1c(N)cccc1Cl Amb7767472 [0,2,0,0,0,0|1,1,0]=4 11448 B13R1.8919 COCCNc1c(N)cccc1F Amb19891558 [0,2,0,0,0,0|1,1,0]=4 11449 B13R1.8919 COCCOc1c(C)cccc1N Amb33035520 [0,2,0,0,0,0|2,0,0]=4 11450 B13R1.8919 COCCOc1c(N)cccc1Br Amb32411386 [0,2,0,0,0,0|1,0,0]=3 11451 B13R1.8919 COCCOc1c(N)cccc1Cl Amb840132 [0,2,0,0,0,0|1,1,0]=4 11452 B13R1.8919 COCCOc1c(N)cccc1F Amb19891774 [0,2,0,0,0,0|1,1,0]=4 11453 B13R1.8919 COCCOc1c(N)cncc1Br Amb33035565 [0,2,0,0,0,0|2,0,0]=4 11454 B13R1.8919 CSCCNc1c(Br)cccc1Br Amb27396286 [0,2,0,0,0,0|1,0,0]=3 11455 B13R1.8919 CSCCNc1c(C)cccc1Br Amb35725736 [0,2,0,0,0,0|1,0,0]=3 11456 B13R1.8919 CSCCNc1c(C)cccc1Cl Amb27414998 [0,2,0,0,0,0|1,1,0]=4 11457 B13R1.8919 CSCCNc1c(N)cccc1Br Amb35645877 [0,2,0,0,0,0|1,0,0]=3 11458 B13R1.8919 CSCCNc1c(N)cccc1Cl Amb27860063 [0,2,0,0,0,0|1,1,0]=4 11459 B13R1.8919 C\C=C\CNc1c(Br)cccc1Br Amb27233104 [0,2,0,0,0,0|1,0,1]=4 11460 B13R1.8919 C\C=C\CNc1c(C)cccc1Br Amb35706682 [0,2,0,0,0,0|1,0,1]=4 11461 B13R1.8919 C\C=C\CNc1c(N)cccc1Br Amb35654006 [0,2,0,0,0,0|1,0,1]=4 11462 B13R1.8919 Cc1cccc(Br)c1NCCC#N Amb35706686 [0,2,0,0,0,0|2,0,0]=4 11463 B13R1.8919 Cc1cccc(Br)c1NCCCF Amb35725734 [0,2,0,0,0,0|2,0,0]=4 11464 B13R1.8919 Cc1cccc(Br)c1NCCCN Amb35721354 [0,2,0,0,0,0|2,0,0]=4 11465 B13R1.8919 Cc1cccc(Br)c1NCCCO Amb35706948 [0,2,0,0,0,0|2,0,0]=4 11466 B13R1.8919 Cc1cccc(C)c1CCCCN Amb18195749 [0,2,0,0,0,0|2,0,0]=4 11467 B13R1.8919 Cc1cccc(C)c1OCCNN Amb17400830 [0,2,0,0,0,0|2,0,0]=4 11468 B13R1.8919 Cc1cccc(C)c1OCCNO Amb17088441 [0,2,0,0,0,0|2,0,0]=4 11469 B13R1.8919 Cc1cccc(Cl)c1CCCCN Amb33259763 [0,2,0,0,0,0|1,1,0]=4 11470 B13R1.8919 Cc1cccc(F)c1CCCCN Amb33148582 [0,2,0,0,0,0|1,1,0]=4 11471 B13R1.8919 Fc1cccc(Cl)c1CCCCS Amb18067431 [0,2,0,0,0,0|1,1,0]=4 11472 B13R1.8919 NCCCCN1C(=O)C=CC=C1Br Amb18542962 [0,2,0,0,0,0|2,0,0]=4 11473 B13R1.8919 NCCCCc1c(Cl)cccc1Br Amb33331852 [0,2,0,0,0,0|1,0,0]=3 11474 B13R1.8919 NCCCCc1c(Cl)cccc1Cl Amb33220782 [0,2,0,0,0,0|1,1,0]=4 11475 B13R1.8919 NCCCCc1c(F)cccc1Br Amb33431050 [0,2,0,0,0,0|1,0,0]=3 11476 B13R1.8919 NCCCCc1c(F)cccc1Cl Amb5735509 [0,2,0,0,0,0|1,1,0]=4 11477 B13R1.8919 NCCCCc1c(F)cccc1F Amb32953863 [0,2,0,0,0,0|1,1,0]=4 11478 B13R1.8919 NCCCCc1c(O)cccc1Br Amb33336520 [0,2,0,0,0,0|1,0,0]=3 11479 B13R1.8919 NCCCCc1c(O)cccc1Cl Amb33256175 [0,2,0,0,0,0|1,1,0]=4 11480 B13R1.8919 NCCCNc1c(Cl)cccc1Br Amb27402801 [0,2,0,0,0,0|2,0,0]=4 11481 B13R1.8919 NCCCOc1c(Cl)cccc1Br Amb33333763 [0,2,0,0,0,0|2,0,0]=4 11482 B13R1.8919 NCCCOc1c(F)cccc1Br Amb33450989 [0,2,0,0,0,0|2,0,0]=4 11483 B13R1.8919 NCCCOc1c(O)cccc1Br Amb33336544 [0,2,0,0,0,0|2,0,0]=4 11484 B13R1.8919 NNCCOc1c(Cl)cccc1Cl Amb17405671 [0,2,0,0,0,0|1,1,0]=4 11485 B13R1.8919 Nc1cccc(Br)c1NCCCF Amb35645875 [0,2,0,0,0,0|2,0,0]=4 11486 B13R1.8919 Nc1cccc(Br)c1NCCCO Amb35645874 [0,2,0,0,0,0|2,0,0]=4 11487 B13R1.8919 Nc1cccc(Br)c1OCCCO Amb33035274 [0,2,0,0,0,0|2,0,0]=4 11488 B13R1.8919 O=C=NCCc1c(Cl)cccc1Br Amb33335915 [0,2,0,0,0,0|0,0,2]=4 11489 B13R1.8919 O=C=NCCc1c(F)cccc1Br Amb33452309 [0,2,0,0,0,0|0,0,2]=4 11490 B13R1.8919 O=CCCCc1c(Cl)cccc1Br Amb33336550 [0,2,0,0,0,0|1,0,1]=4 11491 B13R1.8919 O=CCCCc1c(F)cccc1Br Amb33430098 [0,2,0,0,0,0|1,0,1]=4 11492 B13R1.8919 O=CCCCc1c(O)cccc1Br Amb33336493 [0,2,0,0,0,0|1,0,1]=4 11493 B13R1.8919 OCCCCc1c(F)cccc1F Amb33213124 [0,2,0,0,0,0|1,1,0]=4 11494 B13R1.8919 OCCCNc1c(Br)cccc1Br Amb27983364 [0,2,0,0,0,0|2,0,0]=4 11495 B13R1.8919 ONCCOc1c(Cl)cccc1Cl Amb17088470 [0,2,0,0,0,0|1,1,0]=4 11496 B13R1.8919 [N-]=[N+]=NCCc1c(Cl)cccc1Br Amb33333770 [0,2,0,0,0,0|1,0,1]=4 11497 B13R1.8919 [N-]=[N+]=NCCc1c(F)cccc1Br Amb33478548 [0,2,0,0,0,0|1,0,1]=4 11498 B13R1.8919 [N-]=[N+]=NCCc1c(O)cccc1Br Amb33336546 [0,2,0,0,0,0|1,0,1]=4 11499 B13R1.173 CCCC(CN)c1ccccc1C Amb17233356 [0,2,0,0,0,0|2,0,0]=4 11500 B13R1.173 CCCC(CN)c1ccccc1Cl Amb17236701 [0,2,0,0,0,0|1,1,0]=4 11501 B13R1.173 CCCC(CN)c1ccccc1F Amb17233836 [0,2,0,0,0,0|1,1,0]=4 11502 B13R1.173 CCOC(CBr)c1ccccc1Br Amb32710281 [0,2,0,0,0,0|2,0,0]=4 11503 B13R1.173 CCOC(CI)c1ccccc1Br Amb33348092 [0,2,0,0,0,0|2,0,0]=4 11504 B13R1.173 CNC(CSC)c1ccccc1Cl Amb19028865 [0,2,0,0,0,0|1,1,0]=4 11505 B13R1.173 CNCC(OC)c1ccccc1C Amb17605895 [0,2,0,0,0,0|1,0,0]=3 11506 B13R1.173 CNCC(OC)c1ccccc1Cl Amb17605888 [0,2,0,0,0,0|0,1,0]=3 11507 B13R1.173 CNCC(OC)c1ccccc1F Amb17605889 [0,2,0,0,0,0|0,1,0]=3 11508 B13R1.446 C#CCC(N)c1cc(C)ccc1Br Amb27480369 [0,2,0,0,0,0|1,0,1]=4 11509 B13R1.446 C#CCC(O)c1cc(N)ccc1Br Amb35587069 [0,2,0,0,0,0|1,0,1]=4 11510 B13R1.446 C=CCC(N)c1cc(Br)ccc1Br Amb28118536 [0,2,0,0,0,0|1,0,1]=4 11511 B13R1.446 C=CCC(N)c1cc(F)ccc1Br Amb27482804 [0,2,0,0,0,0|1,0,1]=4 11512 B13R1.446 C=CCC(O)c1cc(C)ccc1Br Amb28342563 [0,2,0,0,0,0|1,0,1]=4 11513 B13R1.446 C=CCC(O)c1cc(N)ccc1Br Amb29884668 [0,2,0,0,0,0|1,0,1]=4 11514 B13R1.446 C=CCC(O)c1cc(O)ccc1Br Amb27273372 [0,2,0,0,0,0|1,0,1]=4 11515 B13R1.446 C=CC[C@@H](N)c1cc(I)ccc1Br Amb27807551 [0,2,0,0,0,0|1,0,1]=4 11516 B13R1.446 C=CC[C@@H](N)c1cc(O)ccc1Br Amb28135353 [0,2,0,0,0,0|1,0,1]=4 11517 B13R1.446 C=CC[C@@H](O)c1cc(Cl)ccc1Br Amb27973125 [0,2,0,0,0,0|1,0,1]=4 11518 B13R1.446 C=CC[C@@H](O)c1cc(F)ccc1Br Amb27236993 [0,2,0,0,0,0|1,0,1]=4 11519 B13R1.446 CC#CC(O)c1cc(Cl)ccc1Br Amb27486730 [0,2,0,0,0,0|1,0,1]=4 11520 B13R1.446 CC(CCN)c1cc(Cl)ccc1Br Amb33450947 [0,2,0,0,0,0|2,0,0]=4 11521 B13R1.446 CC(CCN)c1cc(F)ccc1Br Amb33008289 [0,2,0,0,0,0|2,0,0]=4 11522 B13R1.446 CC(CCN)c1cc(O)ccc1Br Amb33478656 [0,2,0,0,0,0|2,0,0]=4 11523 B13R1.446 CC(CON)c1cc(Cl)ccc1Br Amb33477938 [0,2,0,0,0,0|2,0,0]=4 11524 B13R1.446 CC(CON)c1cc(F)ccc1Br Amb33008583 [0,2,0,0,0,0|2,0,0]=4 11525 B13R1.446 CC(CON)c1cc(O)ccc1Br Amb33450377 [0,2,0,0,0,0|2,0,0]=4 11526 B13R1.446 CCCC(=O)c1cc(Cl)ccc1Br Amb27449189 [0,2,0,0,0,0|1,0,1]=4 11527 B13R1.446 CCCC(Br)c1cc(C)ccc1C Amb28455436 [0,2,0,0,0,0|2,0,0]=4 11528 B13R1.446 CCCC(Br)c1cc(Cl)ccc1Cl Amb28455437 [0,2,0,0,0,0|1,1,0]=4 11529 B13R1.446 CCCC(Br)c1cc(F)ccc1F Amb27756669 [0,2,0,0,0,0|1,1,0]=4 11530 B13R1.446 CCCC(Cl)c1cc(C)ccc1C Amb17139644 [0,2,0,0,0,0|2,0,0]=4 11531 B13R1.446 CCCC(Cl)c1cc(Cl)ccc1Cl Amb27598807 [0,2,0,0,0,0|1,1,0]=4 11532 B13R1.446 CCCC(Cl)c1cc(F)ccc1Cl Amb27760059 [0,2,0,0,0,0|1,1,0]=4 11533 B13R1.446 CCCC(N)c1cc(Br)ccc1F Amb18940359 [0,2,0,0,0,0|1,1,0]=4 11534 B13R1.446 CCCC(N)c1cc(Br)ccc1N Amb27665648 [0,2,0,0,0,0|2,0,0]=4 11535 B13R1.446 CCCC(N)c1cc(Br)ccc1O Amb27950671 [0,2,0,0,0,0|2,0,0]=4 11536 B13R1.446 CCCC(N)c1cc(C)ccc1Br Amb27460213 [0,2,0,0,0,0|1,0,0]=3 11537 B13R1.446 CCCC(N)c1cc(C)ccc1C Amb6705101 [0,2,0,0,0,0|2,0,0]=4 11538 B13R1.446 CCCC(N)c1cc(C)ccc1O Amb18940456 [0,2,0,0,0,0|2,0,0]=4 11539 B13R1.446 CCCC(N)c1cc(C)cnc1Br Amb27225882 [0,2,0,0,0,0|2,0,0]=4 11540 B13R1.446 CCCC(N)c1cc(Cl)ccc1Br Amb28323247 [0,2,0,0,0,0|1,0,0]=3 11541 B13R1.446 CCCC(N)c1cc(Cl)ccc1O Amb18275472 [0,2,0,0,0,0|2,0,0]=4 11542 B13R1.446 CCCC(N)c1cc(F)ccc1Br Amb28196343 [0,2,0,0,0,0|1,0,0]=3 11543 B13R1.446 CCCC(N)c1cc(F)ccc1Cl Amb27808257 [0,2,0,0,0,0|1,1,0]=4 11544 B13R1.446 CCCC(N)c1cc(F)ccc1F Amb9746336 [0,2,0,0,0,0|1,1,0]=4 11545 B13R1.446 CCCC(N)c1cc(F)ccc1N Amb27168622 [0,2,0,0,0,0|2,0,0]=4 11546 B13R1.446 CCCC(N)c1cc(F)ccc1O Amb18941520 [0,2,0,0,0,0|2,0,0]=4 11547 B13R1.446 CCCC(N)c1cc(I)ccc1I Amb28120665 [0,2,0,0,0,0|1,1,0]=4 11548 B13R1.446 CCCC(N)c1cc(I)ccc1O Amb27644649 [0,2,0,0,0,0|2,0,0]=4 11549 B13R1.446 CCCC(N)c1cc(N)ccc1Cl Amb27173411 [0,2,0,0,0,0|1,1,0]=4 11550 B13R1.446 CCCC(N)c1cc(O)ccc1Cl Amb27465561 [0,2,0,0,0,0|1,1,0]=4 11551 B13R1.446 CCCC(N)c1cc(O)ccc1N Amb28317760 [0,2,0,0,0,0|2,0,0]=4 11552 B13R1.446 CCCC(N)c1cc(O)ccc1O Amb27445026 [0,2,0,0,0,0|2,0,0]=4 11553 B13R1.446 CCCC(O)c1cc(C)ccc1C Amb17138885 [0,2,0,0,0,0|2,0,0]=4 11554 B13R1.446 CCCC(O)c1cc(C)ccc1Cl Amb28121275 [0,2,0,0,0,0|1,1,0]=4 11555 B13R1.446 CCCC(O)c1cc(C)ccc1F Amb18805552 [0,2,0,0,0,0|1,1,0]=4 11556 B13R1.446 CCCC(O)c1cc(C)ccc1N Amb35583088 [0,2,0,0,0,0|2,0,0]=4 11557 B13R1.446 CCCC(O)c1cc(Cl)ccc1Br Amb27606589 [0,2,0,0,0,0|1,0,0]=3 11558 B13R1.446 CCCC(O)c1cc(Cl)ccc1C Amb27609575 [0,2,0,0,0,0|2,0,0]=4 11559 B13R1.446 CCCC(O)c1cc(Cl)ccc1Cl Amb27395019 [0,2,0,0,0,0|1,1,0]=4 11560 B13R1.446 CCCC(O)c1cc(Cl)ccc1N Amb29875755 [0,2,0,0,0,0|2,0,0]=4 11561 B13R1.446 CCCC(O)c1cc(F)ccc1C Amb18185536 [0,2,0,0,0,0|2,0,0]=4 11562 B13R1.446 CCCC(O)c1cc(F)ccc1F Amb17194583 [0,2,0,0,0,0|1,1,0]=4 11563 B13R1.446 CCCC(O)c1cc(N)ccc1Br Amb29884670 [0,2,0,0,0,0|1,0,0]=3 11564 B13R1.446 CCCC(O)c1cc(N)ccc1F Amb35622289 [0,2,0,0,0,0|1,1,0]=4 11565 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1C Amb27950117 [0,2,0,0,0,0|2,0,0]=4 11566 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1Cl Amb27441127 [0,2,0,0,0,0|1,1,0]=4 11567 B13R1.446 CCC[C@@H](N)c1cc(C)ccc1C Amb28346828 [0,2,0,0,0,0|2,0,0]=4 11568 B13R1.446 CCC[C@@H](N)c1cc(C)ccc1F Amb27468607 [0,2,0,0,0,0|1,1,0]=4 11569 B13R1.446 CCC[C@@H](N)c1cc(Cl)ccc1I Amb27465517 [0,2,0,0,0,0|1,1,0]=4 11570 B13R1.446 CCC[C@@H](N)c1cc(Cl)ncc1Br Amb27751284 [0,2,0,0,0,0|2,0,0]=4 11571 B13R1.446 CCC[C@@H](N)c1cc(F)ccc1I Amb27606485 [0,2,0,0,0,0|1,1,0]=4 11572 B13R1.446 CCC[C@@H](N)c1cc(I)ccc1O Amb27226000 [0,2,0,0,0,0|2,0,0]=4 11573 B13R1.446 CCC[C@@H](N)c1cc(N)ccc1Cl Amb27426693 [0,2,0,0,0,0|1,1,0]=4 11574 B13R1.446 CCC[C@@H](N)c1cc(O)ccc1Br Amb27868264 [0,2,0,0,0,0|1,0,0]=3 11575 B13R1.446 CCC[C@@H](N)c1cc(O)ccc1F Amb27488684 [0,2,0,0,0,0|1,1,0]=4 11576 B13R1.446 CCC[C@@H](O)c1cc(Br)ccc1C Amb28065140 [0,2,0,0,0,0|2,0,0]=4 11577 B13R1.446 CCC[C@@H](O)c1cc(C)ccc1C Amb28243753 [0,2,0,0,0,0|2,0,0]=4 11578 B13R1.446 CCC[C@@H](O)c1cc(Cl)ccc1F Amb27393944 [0,2,0,0,0,0|1,1,0]=4 11579 B13R1.446 CCC[C@@H](O)c1cc(F)ccc1F Amb28368046 [0,2,0,0,0,0|1,1,0]=4 11580 B13R1.446 CCC[C@H](N)c1cc(Br)ccc1Br Amb28058383 [0,2,0,0,0,0|1,0,0]=3 11581 B13R1.446 CCC[C@H](N)c1cc(Br)ccc1C Amb28323157 [0,2,0,0,0,0|2,0,0]=4 11582 B13R1.446 CCC[C@H](N)c1cc(Br)ccc1O Amb27618202 [0,2,0,0,0,0|2,0,0]=4 11583 B13R1.446 CCC[C@H](N)c1cc(C)ccc1O Amb27647135 [0,2,0,0,0,0|2,0,0]=4 11584 B13R1.446 CCC[C@H](N)c1cc(C)cnc1Br Amb27947276 [0,2,0,0,0,0|2,0,0]=4 11585 B13R1.446 CCC[C@H](N)c1cc(Cl)ccc1I Amb27608314 [0,2,0,0,0,0|1,1,0]=4 11586 B13R1.446 CCC[C@H](N)c1cc(Cl)ccc1N Amb27668890 [0,2,0,0,0,0|2,0,0]=4 11587 B13R1.446 CCC[C@H](N)c1cc(F)ccc1Cl Amb27258802 [0,2,0,0,0,0|1,1,0]=4 11588 B13R1.446 CCC[C@H](N)c1cc(F)ccc1F Amb27640258 [0,2,0,0,0,0|1,1,0]=4 11589 B13R1.446 CCC[C@H](N)c1cc(I)ccc1Br Amb27412419 [0,2,0,0,0,0|1,0,0]=3 11590 B13R1.446 CCC[C@H](N)c1cc(I)ccc1N Amb27748651 [0,2,0,0,0,0|2,0,0]=4 11591 B13R1.446 CCC[C@H](N)c1cc(N)ccc1F Amb27860237 [0,2,0,0,0,0|1,1,0]=4 11592 B13R1.446 CCC[C@H](N)c1cc(N)ncc1Br Amb27412828 [0,2,0,0,0,0|2,0,0]=4 11593 B13R1.446 CCC[C@H](N)c1cc(O)ccc1C Amb27831978 [0,2,0,0,0,0|2,0,0]=4 11594 B13R1.446 CCC[C@H](N)c1cc(O)ccc1O Amb28457276 [0,2,0,0,0,0|2,0,0]=4 11595 B13R1.446 CCC[C@H](O)c1cc(Br)ccc1C Amb27196845 [0,2,0,0,0,0|2,0,0]=4 11596 B13R1.446 CCC[C@H](O)c1cc(C)ccc1C Amb28243754 [0,2,0,0,0,0|2,0,0]=4 11597 B13R1.446 CCC[C@H](O)c1cc(C)ccc1F Amb27595821 [0,2,0,0,0,0|1,1,0]=4 11598 B13R1.446 CCC[C@H](O)c1cc(F)ccc1C Amb27975536 [0,2,0,0,0,0|2,0,0]=4 11599 B13R1.446 CCNC(C)c1cc(Br)ccc1Br Amb9349682 [0,2,0,0,0,0|2,0,0]=4 11600 B13R1.446 CCNC(C)c1cc(F)ccc1Br Amb28119411 [0,2,0,0,0,0|2,0,0]=4 11601 B13R1.446 CNCC(=O)c1cc(Br)ccc1C Amb27147599 [0,2,0,0,0,0|1,0,1]=4 11602 B13R1.446 CNCC(=O)c1cc(Br)ccc1Cl Amb25936939 [0,2,0,0,0,0|0,1,1]=4 11603 B13R1.446 CNCC(=O)c1cc(Br)ccc1F Amb25153485 [0,2,0,0,0,0|0,1,1]=4 11604 B13R1.446 CNCC(=O)c1cc(Br)ccc1O Amb33333206 [0,2,0,0,0,0|1,0,1]=4 11605 B13R1.446 CNCC(=O)c1cc(C)ccc1Br Amb26607203 [0,2,0,0,0,0|0,0,1]=3 11606 B13R1.446 CNCC(=O)c1cc(C)ccc1C Amb17233279 [0,2,0,0,0,0|1,0,1]=4 11607 B13R1.446 CNCC(=O)c1cc(C)ccc1Cl Amb27840874 [0,2,0,0,0,0|0,1,1]=4 11608 B13R1.446 CNCC(=O)c1cc(C)ccc1F Amb28423075 [0,2,0,0,0,0|0,1,1]=4 11609 B13R1.446 CNCC(=O)c1cc(C)ccc1O Amb27607699 [0,2,0,0,0,0|1,0,1]=4 11610 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Br Amb27808526 [0,2,0,0,0,0|0,0,1]=3 11611 B13R1.446 CNCC(=O)c1cc(Cl)ccc1C Amb18864129 [0,2,0,0,0,0|1,0,1]=4 11612 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Cl Amb18225699 [0,2,0,0,0,0|0,1,1]=4 11613 B13R1.446 CNCC(=O)c1cc(Cl)ccc1F Amb18894775 [0,2,0,0,0,0|0,1,1]=4 11614 B13R1.446 CNCC(=O)c1cc(Cl)ccc1O Amb33052474 [0,2,0,0,0,0|1,0,1]=4 11615 B13R1.446 CNCC(=O)c1cc(Cl)ncc1Br Amb33477818 [0,2,0,0,0,0|1,0,1]=4 11616 B13R1.446 CNCC(=O)c1cc(F)ccc1Br Amb25191402 [0,2,0,0,0,0|0,0,1]=3 11617 B13R1.446 CNCC(=O)c1cc(F)ccc1C Amb25820145 [0,2,0,0,0,0|1,0,1]=4 11618 B13R1.446 CNCC(=O)c1cc(F)ccc1Cl Amb27639643 [0,2,0,0,0,0|0,1,1]=4 11619 B13R1.446 CNCC(=O)c1cc(F)ccc1F Amb17335731 [0,2,0,0,0,0|0,1,1]=4 11620 B13R1.446 CNCC(=O)c1cc(F)ccc1O Amb26611607 [0,2,0,0,0,0|1,0,1]=4 11621 B13R1.446 CNCC(=O)c1cc(O)ccc1Br Amb27762933 [0,2,0,0,0,0|0,0,1]=3 11622 B13R1.446 CNCC(=O)c1cc(O)ccc1C Amb26502184 [0,2,0,0,0,0|1,0,1]=4 11623 B13R1.446 CNCC(=O)c1cc(O)ccc1Cl Amb26026154 [0,2,0,0,0,0|0,1,1]=4 11624 B13R1.446 CNCC(=O)c1cc(O)ccc1F Amb26478016 [0,2,0,0,0,0|0,1,1]=4 11625 B13R1.446 CNCC(=O)c1cc(O)ccc1O Amb28187132 [0,2,0,0,0,0|1,0,1]=4 11626 B13R1.446 CNCC(C)c1cc(Br)ccc1C Amb27610342 [0,2,0,0,0,0|1,0,0]=3 11627 B13R1.446 CNCC(C)c1cc(Br)ccc1Cl Amb26502269 [0,2,0,0,0,0|0,1,0]=3 11628 B13R1.446 CNCC(C)c1cc(Br)ccc1F Amb25357943 [0,2,0,0,0,0|0,1,0]=3 11629 B13R1.446 CNCC(C)c1cc(Br)ccc1O Amb27666848 [0,2,0,0,0,0|1,0,0]=3 11630 B13R1.446 CNCC(C)c1cc(C)ccc1Br Amb27495572 [0,2,0,0,0,0|0,0,0]=2 11631 B13R1.446 CNCC(C)c1cc(C)ccc1C Amb17233343 [0,2,0,0,0,0|1,0,0]=3 11632 B13R1.446 CNCC(C)c1cc(C)ccc1Cl Amb25781805 [0,2,0,0,0,0|0,1,0]=3 11633 B13R1.446 CNCC(C)c1cc(C)ccc1F Amb25177554 [0,2,0,0,0,0|0,1,0]=3 11634 B13R1.446 CNCC(C)c1cc(C)ccc1O Amb25121987 [0,2,0,0,0,0|1,0,0]=3 11635 B13R1.446 CNCC(C)c1cc(Cl)ccc1Br Amb26055669 [0,2,0,0,0,0|0,0,0]=2 11636 B13R1.446 CNCC(C)c1cc(Cl)ccc1C Amb24533700 [0,2,0,0,0,0|1,0,0]=3 11637 B13R1.446 CNCC(C)c1cc(Cl)ccc1Cl Amb26510359 [0,2,0,0,0,0|0,1,0]=3 11638 B13R1.446 CNCC(C)c1cc(Cl)ccc1F Amb18244125 [0,2,0,0,0,0|0,1,0]=3 11639 B13R1.446 CNCC(C)c1cc(Cl)ccc1O Amb28044072 [0,2,0,0,0,0|1,0,0]=3 11640 B13R1.446 CNCC(C)c1cc(F)ccc1Br Amb27270873 [0,2,0,0,0,0|0,0,0]=2 11641 B13R1.446 CNCC(C)c1cc(F)ccc1C Amb26876595 [0,2,0,0,0,0|1,0,0]=3 11642 B13R1.446 CNCC(C)c1cc(F)ccc1Cl Amb25802013 [0,2,0,0,0,0|0,1,0]=3 11643 B13R1.446 CNCC(C)c1cc(F)ccc1F Amb18243849 [0,2,0,0,0,0|0,1,0]=3 11644 B13R1.446 CNCC(C)c1cc(F)ccc1O Amb25079100 [0,2,0,0,0,0|1,0,0]=3 11645 B13R1.446 CNCC(C)c1cc(O)ccc1Br Amb25341505 [0,2,0,0,0,0|0,0,0]=2 11646 B13R1.446 CNCC(C)c1cc(O)ccc1C Amb27219435 [0,2,0,0,0,0|1,0,0]=3 11647 B13R1.446 CNCC(C)c1cc(O)ccc1Cl Amb24361969 [0,2,0,0,0,0|0,1,0]=3 11648 B13R1.446 CNCC(C)c1cc(O)ccc1F Amb25119955 [0,2,0,0,0,0|0,1,0]=3 11649 B13R1.446 CNCC(O)c1cc(Br)ccc1C Amb25135385 [0,2,0,0,0,0|1,0,0]=3 11650 B13R1.446 CNCC(O)c1cc(Br)ccc1Cl Amb26860063 [0,2,0,0,0,0|0,1,0]=3 11651 B13R1.446 CNCC(O)c1cc(Br)ccc1F Amb18997464 [0,2,0,0,0,0|0,1,0]=3 11652 B13R1.446 CNCC(O)c1cc(Br)ccc1O Amb33333203 [0,2,0,0,0,0|1,0,0]=3 11653 B13R1.446 CNCC(O)c1cc(Br)cnc1Cl Amb33009439 [0,2,0,0,0,0|1,1,0]=4 11654 B13R1.446 CNCC(O)c1cc(Br)cnc1F Amb33477704 [0,2,0,0,0,0|1,1,0]=4 11655 B13R1.446 CNCC(O)c1cc(C)ccc1Br Amb26647498 [0,2,0,0,0,0|0,0,0]=2 11656 B13R1.446 CNCC(O)c1cc(C)ccc1C Amb17233589 [0,2,0,0,0,0|1,0,0]=3 11657 B13R1.446 CNCC(O)c1cc(C)ccc1Cl Amb24450049 [0,2,0,0,0,0|0,1,0]=3 11658 B13R1.446 CNCC(O)c1cc(C)ccc1F Amb24583855 [0,2,0,0,0,0|0,1,0]=3 11659 B13R1.446 CNCC(O)c1cc(C)ccc1O Amb27415816 [0,2,0,0,0,0|1,0,0]=3 11660 B13R1.446 CNCC(O)c1cc(Cl)ccc1Br Amb28289758 [0,2,0,0,0,0|0,0,0]=2 11661 B13R1.446 CNCC(O)c1cc(Cl)ccc1C Amb28316732 [0,2,0,0,0,0|1,0,0]=3 11662 B13R1.446 CNCC(O)c1cc(Cl)ccc1Cl Amb18289716 [0,2,0,0,0,0|0,1,0]=3 11663 B13R1.446 CNCC(O)c1cc(Cl)ccc1F Amb18244129 [0,2,0,0,0,0|0,1,0]=3 11664 B13R1.446 CNCC(O)c1cc(Cl)ccc1O Amb33052470 [0,2,0,0,0,0|1,0,0]=3 11665 B13R1.446 CNCC(O)c1cc(Cl)cnc1F Amb33257194 [0,2,0,0,0,0|1,1,0]=4 11666 B13R1.446 CNCC(O)c1cc(Cl)ncc1Br Amb33477814 [0,2,0,0,0,0|1,0,0]=3 11667 B13R1.446 CNCC(O)c1cc(F)ccc1Br Amb24715440 [0,2,0,0,0,0|0,0,0]=2 11668 B13R1.446 CNCC(O)c1cc(F)ccc1C Amb26068182 [0,2,0,0,0,0|1,0,0]=3 11669 B13R1.446 CNCC(O)c1cc(F)ccc1Cl Amb26604986 [0,2,0,0,0,0|0,1,0]=3 11670 B13R1.446 CNCC(O)c1cc(F)ccc1F Amb17335897 [0,2,0,0,0,0|0,1,0]=3 11671 B13R1.446 CNCC(O)c1cc(F)ccc1O Amb33380303 [0,2,0,0,0,0|1,0,0]=3 11672 B13R1.446 CNCC(O)c1cc(O)ccc1Br Amb25720409 [0,2,0,0,0,0|0,0,0]=2 11673 B13R1.446 CNCC(O)c1cc(O)ccc1C Amb25204267 [0,2,0,0,0,0|1,0,0]=3 11674 B13R1.446 CNCC(O)c1cc(O)ccc1Cl Amb28429764 [0,2,0,0,0,0|0,1,0]=3 11675 B13R1.446 CNCC(O)c1cc(O)ccc1Cl Amb32655880 [0,2,0,0,0,0|0,1,0]=3 11676 B13R1.446 CNCC(O)c1cc(O)ccc1O Amb33269244 [0,2,0,0,0,0|1,0,0]=3 11677 B13R1.446 COCC(=O)c1cc(Cl)ccc1Br Amb28317210 [0,2,0,0,0,0|1,0,1]=4 11678 B13R1.446 COCC(=O)c1cc(I)ccc1Br Amb27832284 [0,2,0,0,0,0|1,0,1]=4 11679 B13R1.446 COCC(N)c1cc(Br)ccc1Br Amb28066207 [0,2,0,0,0,0|1,0,0]=3 11680 B13R1.446 COCC(N)c1cc(Br)ccc1C Amb27156675 [0,2,0,0,0,0|2,0,0]=4 11681 B13R1.446 COCC(N)c1cc(Br)ccc1Cl Amb27167729 [0,2,0,0,0,0|1,1,0]=4 11682 B13R1.446 COCC(N)c1cc(Br)ccc1F Amb25858707 [0,2,0,0,0,0|1,1,0]=4 11683 B13R1.446 COCC(N)c1cc(C)ccc1I Amb27273488 [0,2,0,0,0,0|1,1,0]=4 11684 B13R1.446 COCC(N)c1cc(C)ccc1O Amb27461468 [0,2,0,0,0,0|2,0,0]=4 11685 B13R1.446 COCC(N)c1cc(Cl)ccc1F Amb24741694 [0,2,0,0,0,0|1,1,0]=4 11686 B13R1.446 COCC(N)c1cc(Cl)ccc1I Amb28204536 [0,2,0,0,0,0|1,1,0]=4 11687 B13R1.446 COCC(N)c1cc(Cl)ccc1N Amb27239836 [0,2,0,0,0,0|2,0,0]=4 11688 B13R1.446 COCC(N)c1cc(F)ccc1F Amb10610140 [0,2,0,0,0,0|1,1,0]=4 11689 B13R1.446 COCC(N)c1cc(F)ccc1F Amb1131932 [0,2,0,0,0,0|1,1,0]=4 11690 B13R1.446 COCC(N)c1cc(F)ccc1N Amb28314237 [0,2,0,0,0,0|2,0,0]=4 11691 B13R1.446 COCC(N)c1cc(F)ccc1O Amb27413863 [0,2,0,0,0,0|2,0,0]=4 11692 B13R1.446 COCC(N)c1cc(I)ccc1Br Amb28187983 [0,2,0,0,0,0|1,0,0]=3 11693 B13R1.446 COCC(N)c1cc(I)ccc1N Amb27619712 [0,2,0,0,0,0|2,0,0]=4 11694 B13R1.446 COCC(N)c1cc(N)ccc1Cl Amb27467386 [0,2,0,0,0,0|1,1,0]=4 11695 B13R1.446 COCC(N)c1cc(N)ccc1O Amb27969165 [0,2,0,0,0,0|2,0,0]=4 11696 B13R1.446 COCC(N)c1cc(O)ccc1Br Amb27827747 [0,2,0,0,0,0|1,0,0]=3 11697 B13R1.446 COCC(N)c1cc(O)ccc1F Amb27596599 [0,2,0,0,0,0|1,1,0]=4 11698 B13R1.446 COCC(O)c1cc(Br)ccc1Br Amb28256237 [0,2,0,0,0,0|1,0,0]=3 11699 B13R1.446 COCC(O)c1cc(C)ccc1N Amb35583192 [0,2,0,0,0,0|2,0,0]=4 11700 B13R1.446 COCC(O)c1cc(Cl)ccc1N Amb29875757 [0,2,0,0,0,0|2,0,0]=4 11701 B13R1.446 COCC(O)c1cc(F)ccc1F Amb18324057 [0,2,0,0,0,0|1,1,0]=4 11702 B13R1.446 COCC(O)c1cc(N)ccc1Br Amb35740837 [0,2,0,0,0,0|1,0,0]=3 11703 B13R1.446 COCC(O)c1cc(N)ccc1F Amb35622398 [0,2,0,0,0,0|1,1,0]=4 11704 B13R1.446 COC[C@@H](N)c1cc(Br)ccc1Br Amb28280035 [0,2,0,0,0,0|1,0,0]=3 11705 B13R1.446 COC[C@@H](N)c1cc(C)ccc1I Amb27600140 [0,2,0,0,0,0|1,1,0]=4 11706 B13R1.446 COC[C@@H](N)c1cc(C)ccc1O Amb27252145 [0,2,0,0,0,0|2,0,0]=4 11707 B13R1.446 COC[C@@H](N)c1cc(Cl)ccc1Br Amb27814406 [0,2,0,0,0,0|1,0,0]=3 11708 B13R1.446 COC[C@@H](N)c1cc(Cl)ccc1O Amb27633186 [0,2,0,0,0,0|2,0,0]=4 11709 B13R1.446 COC[C@@H](N)c1cc(F)ccc1C Amb28317770 [0,2,0,0,0,0|2,0,0]=4 11710 B13R1.446 COC[C@@H](N)c1cc(F)ccc1O Amb28193525 [0,2,0,0,0,0|2,0,0]=4 11711 B13R1.446 COC[C@@H](N)c1cc(I)ccc1C Amb27807436 [0,2,0,0,0,0|2,0,0]=4 11712 B13R1.446 COC[C@@H](N)c1cc(I)ccc1N Amb27177210 [0,2,0,0,0,0|2,0,0]=4 11713 B13R1.446 COC[C@@H](N)c1cc(N)ccc1Cl Amb27224099 [0,2,0,0,0,0|1,1,0]=4 11714 B13R1.446 COC[C@@H](N)c1cc(N)ccc1F Amb27609581 [0,2,0,0,0,0|1,1,0]=4 11715 B13R1.446 COC[C@@H](N)c1cc(O)ccc1C Amb27874025 [0,2,0,0,0,0|2,0,0]=4 11716 B13R1.446 COC[C@@H](N)c1cc(O)ccc1F Amb27849932 [0,2,0,0,0,0|1,1,0]=4 11717 B13R1.446 COC[C@H](N)c1cc(Br)ccc1F Amb27608281 [0,2,0,0,0,0|1,1,0]=4 11718 B13R1.446 COC[C@H](N)c1cc(C)ccc1F Amb27831884 [0,2,0,0,0,0|1,1,0]=4 11719 B13R1.446 COC[C@H](N)c1cc(N)ccc1O Amb27602192 [0,2,0,0,0,0|2,0,0]=4 11720 B13R1.446 CSCC(=O)c1cc(C)ccc1Br Amb27608808 [0,2,0,0,0,0|1,0,1]=4 11721 B13R1.446 CSCC(N)c1cc(C)ccc1C Amb18995355 [0,2,0,0,0,0|2,0,0]=4 11722 B13R1.446 CSCC(O)c1cc(C)ccc1Cl Amb27262810 [0,2,0,0,0,0|1,1,0]=4 11723 B13R1.446 CSCC(O)c1cc(Cl)ccc1Cl Amb28282108 [0,2,0,0,0,0|1,1,0]=4 11724 B13R1.446 CSCC(O)c1cc(F)ccc1Cl Amb27263465 [0,2,0,0,0,0|1,1,0]=4 11725 B13R1.446 Cc1ccc(Br)c(C(C)CCN)c1 Amb33478403 [0,2,0,0,0,0|2,0,0]=4 11726 B13R1.446 Cc1ccc(Br)c(C(C)CON)c1 Amb33477514 [0,2,0,0,0,0|2,0,0]=4 11727 B13R1.446 Cc1ccc(Br)c(C(F)CCN)c1 Amb33477505 [0,2,0,0,0,0|2,0,0]=4 11728 B13R1.446 Cc1ccc(Br)c(C(N)CCO)c1 Amb27828002 [0,2,0,0,0,0|2,0,0]=4 11729 B13R1.446 Cc1ccc(Br)c(C(O)CC#N)c1 Amb33477561 [0,2,0,0,0,0|2,0,0]=4 11730 B13R1.446 Cc1ccc(Br)c(C(O)CCN)c1 Amb27800478 [0,2,0,0,0,0|2,0,0]=4 11731 B13R1.446 Cc1ccc(Br)c([C@@H](N)CC#N)c1 Amb27460200 [0,2,0,0,0,0|2,0,0]=4 11732 B13R1.446 Cc1ccc(Br)c([C@@H](O)CCN)c1 Amb33477503 [0,2,0,0,0,0|2,0,0]=4 11733 B13R1.446 Cc1ccc(Br)c([C@H](O)CCN)c1 Amb33477502 [0,2,0,0,0,0|2,0,0]=4 11734 B13R1.446 Cc1ccc(C)c(C(O)CNN)c1 Amb18065948 [0,2,0,0,0,0|2,0,0]=4 11735 B13R1.446 Cc1ccc(C)c(C(O)CNO)c1 Amb17335491 [0,2,0,0,0,0|2,0,0]=4 11736 B13R1.446 N#CCC(N)c1cc(Br)ccc1Br Amb28044831 [0,2,0,0,0,0|2,0,0]=4 11737 B13R1.446 N#CCC(N)c1cc(Cl)ccc1Br Amb27848962 [0,2,0,0,0,0|2,0,0]=4 11738 B13R1.446 N#CCC(O)c1cc(Cl)ccc1Br Amb27946403 [0,2,0,0,0,0|2,0,0]=4 11739 B13R1.446 N#CCC(O)c1cc(F)ccc1Br Amb28366736 [0,2,0,0,0,0|2,0,0]=4 11740 B13R1.446 N#CCC(O)c1cc(O)ccc1Br Amb27405783 [0,2,0,0,0,0|2,0,0]=4 11741 B13R1.446 N#CC[C@@H](N)c1cc(Br)ccc1Br Amb27172150 [0,2,0,0,0,0|2,0,0]=4 11742 B13R1.446 N#CC[C@@H](O)c1cc(F)ccc1Br Amb27223185 [0,2,0,0,0,0|2,0,0]=4 11743 B13R1.446 N#CC[C@H](N)c1cc(Cl)ccc1Br Amb27642339 [0,2,0,0,0,0|2,0,0]=4 11744 B13R1.446 NC(CCO)c1cc(Cl)ccc1Br Amb27638090 [0,2,0,0,0,0|2,0,0]=4 11745 B13R1.446 NC(CCO)c1cc(F)ccc1Br Amb25981469 [0,2,0,0,0,0|2,0,0]=4 11746 B13R1.446 NC(CCO)c1cc(O)ccc1Br Amb26445698 [0,2,0,0,0,0|2,0,0]=4 11747 B13R1.446 NCCC(F)c1cc(Cl)ccc1Br Amb33478187 [0,2,0,0,0,0|2,0,0]=4 11748 B13R1.446 NCCC(F)c1cc(F)ccc1Br Amb33008570 [0,2,0,0,0,0|2,0,0]=4 11749 B13R1.446 NCCC(F)c1cc(O)ccc1Br Amb33450352 [0,2,0,0,0,0|2,0,0]=4 11750 B13R1.446 NCCC(N)c1cc(O)ccc1Br Amb27626997 [0,2,0,0,0,0|2,0,0]=4 11751 B13R1.446 NCCC(O)c1cc(Cl)ccc1Br Amb27750045 [0,2,0,0,0,0|2,0,0]=4 11752 B13R1.446 NCCC(O)c1cc(F)ccc1Br Amb26536054 [0,2,0,0,0,0|2,0,0]=4 11753 B13R1.446 NCCC(O)c1cc(O)ccc1Br Amb33478644 [0,2,0,0,0,0|2,0,0]=4 11754 B13R1.446 NCC[C@@H](N)c1cc(Br)ccc1Br Amb28422776 [0,2,0,0,0,0|2,0,0]=4 11755 B13R1.446 NCC[C@@H](N)c1cc(F)ccc1Br Amb28056005 [0,2,0,0,0,0|2,0,0]=4 11756 B13R1.446 NCC[C@@H](N)c1cc(O)ccc1Br Amb27630506 [0,2,0,0,0,0|2,0,0]=4 11757 B13R1.446 NCC[C@@H](O)c1cc(Cl)ccc1Br Amb33478237 [0,2,0,0,0,0|2,0,0]=4 11758 B13R1.446 NCC[C@@H](O)c1cc(F)ccc1Br Amb33008562 [0,2,0,0,0,0|2,0,0]=4 11759 B13R1.446 NCC[C@@H](O)c1cc(O)ccc1Br Amb33450344 [0,2,0,0,0,0|2,0,0]=4 11760 B13R1.446 NCC[C@H](N)c1cc(F)ccc1Br Amb28349341 [0,2,0,0,0,0|2,0,0]=4 11761 B13R1.446 NCC[C@H](O)c1cc(Cl)ccc1Br Amb33478239 [0,2,0,0,0,0|2,0,0]=4 11762 B13R1.446 NCC[C@H](O)c1cc(F)ccc1Br Amb33009262 [0,2,0,0,0,0|2,0,0]=4 11763 B13R1.446 NCC[C@H](O)c1cc(O)ccc1Br Amb33450349 [0,2,0,0,0,0|2,0,0]=4 11764 B13R1.446 NNCC(O)c1cc(Cl)ccc1F Amb24686949 [0,2,0,0,0,0|1,1,0]=4 11765 B13R1.446 NNCC(O)c1cc(F)ccc1F Amb18564462 [0,2,0,0,0,0|1,1,0]=4 11766 B13R1.446 N[C@@H](CCO)c1cc(Br)ccc1Br Amb27801094 [0,2,0,0,0,0|2,0,0]=4 11767 B13R1.446 N[C@@H](CCO)c1cc(Cl)ccc1Br Amb26348880 [0,2,0,0,0,0|2,0,0]=4 11768 B13R1.446 N[C@@H](CCO)c1cc(F)ccc1Br Amb28128654 [0,2,0,0,0,0|2,0,0]=4 11769 B13R1.446 N[C@H](CCO)c1cc(Br)ccc1Br Amb28140734 [0,2,0,0,0,0|2,0,0]=4 11770 B13R1.446 N[C@H](CCO)c1cc(Cl)ccc1Br Amb26851440 [0,2,0,0,0,0|2,0,0]=4 11771 B13R1.446 N[C@H](CCO)c1cc(F)ccc1Br Amb25194716 [0,2,0,0,0,0|2,0,0]=4 11772 B13R1.446 N[C@H](CCO)c1cc(I)ccc1Br Amb27390702 [0,2,0,0,0,0|2,0,0]=4 11773 B13R1.446 OCCC(O)c1cc(Cl)ccc1Br Amb28288456 [0,2,0,0,0,0|2,0,0]=4 11774 B13R1.446 OCCC(O)c1cc(O)ccc1Br Amb28060615 [0,2,0,0,0,0|2,0,0]=4 11775 B13R1.446 OCC[C@H](O)c1cc(Cl)ccc1Br Amb27395956 [0,2,0,0,0,0|2,0,0]=4 11776 B13R1.446 OCC[C@H](O)c1cc(F)ccc1Br Amb28042373 [0,2,0,0,0,0|2,0,0]=4 11777 B13R1.446 OCC[C@H](O)c1cc(O)ccc1Br Amb28410175 [0,2,0,0,0,0|2,0,0]=4 11778 B13R1.446 ONCC(O)c1cc(F)ccc1F Amb17336063 [0,2,0,0,0,0|1,1,0]=4 11779 B13R1.696 CC(CN)C(O)c1ccccc1Br Amb27235565 [0,2,0,0,0,0|2,0,0]=4 11780 B13R1.696 CC(c1ccccc1Br)C(N)CO Amb27636544 [0,2,0,0,0,0|2,0,0]=4 11781 B13R1.696 CCC(C)C(Cl)c1ccccc1C Amb27658972 [0,2,0,0,0,0|2,0,0]=4 11782 B13R1.696 CCC(C)C(N)c1cccnc1Br Amb28384626 [0,2,0,0,0,0|2,0,0]=4 11783 B13R1.696 CCC(C)C(N)c1ncccc1Br Amb28366765 [0,2,0,0,0,0|2,0,0]=4 11784 B13R1.696 CCC(C)C(O)c1cccnc1Br Amb35702787 [0,2,0,0,0,0|2,0,0]=4 11785 B13R1.696 CCC(C)[C@@H](N)c1ccccc1Br Amb27985363 [0,2,0,0,0,0|1,0,0]=3 11786 B13R1.696 CCC(C)[C@@H](N)c1ccccc1Cl Amb28055869 [0,2,0,0,0,0|1,1,0]=4 11787 B13R1.696 CCC(C)[C@H](N)c1ccccc1O Amb28384636 [0,2,0,0,0,0|2,0,0]=4 11788 B13R1.696 CCC(N)C(=O)c1ccccc1Br Amb18156123 [0,2,0,0,0,0|1,0,1]=4 11789 B13R1.696 CCC(N)C(C)c1ccccc1Cl Amb27807135 [0,2,0,0,0,0|1,1,0]=4 11790 B13R1.696 CCC(N)C(N)c1ccccc1Br Amb27776919 [0,2,0,0,0,0|1,0,0]=3 11791 B13R1.696 CCC(N)C(N)c1ccccc1C Amb27874518 [0,2,0,0,0,0|2,0,0]=4 11792 B13R1.696 CCC(N)C(N)c1ccccc1F Amb27792163 [0,2,0,0,0,0|1,1,0]=4 11793 B13R1.696 CCC(N)C(N)c1ccccc1I Amb27430385 [0,2,0,0,0,0|1,1,0]=4 11794 B13R1.696 CCC(N)C(N)c1ccccc1O Amb27430308 [0,2,0,0,0,0|2,0,0]=4 11795 B13R1.696 CCC(N)C(O)c1ccccc1F Amb19149127 [0,2,0,0,0,0|1,1,0]=4 11796 B13R1.696 CCC(N)C(O)c1ccccc1F Amb9429017 [0,2,0,0,0,0|1,1,0]=4 11797 B13R1.696 CCC(O)C(N)c1ccccc1Br Amb28281808 [0,2,0,0,0,0|1,0,0]=3 11798 B13R1.696 CCC(O)C(N)c1ccccc1Cl Amb27617875 [0,2,0,0,0,0|1,1,0]=4 11799 B13R1.696 CCC(O)C(N)c1cccnc1Br Amb27486311 [0,2,0,0,0,0|2,0,0]=4 11800 B13R1.696 CC[C@@H](N)C(O)c1ccccc1C Amb35659373 [0,2,0,0,0,0|2,0,0]=4 11801 B13R1.696 CC[C@@H](N)C(O)c1ccccc1Cl Amb35659338 [0,2,0,0,0,0|1,1,0]=4 11802 B13R1.696 CC[C@@H](N)C(O)c1ccccc1F Amb35659339 [0,2,0,0,0,0|1,1,0]=4 11803 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1Br Amb27445501 [0,2,0,0,0,0|1,0,0]=3 11804 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1C Amb27445509 [0,2,0,0,0,0|2,0,0]=4 11805 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1Br Amb27205110 [0,2,0,0,0,0|1,0,0]=3 11806 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1C Amb27430242 [0,2,0,0,0,0|2,0,0]=4 11807 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1N Amb27964149 [0,2,0,0,0,0|2,0,0]=4 11808 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1Br Amb28289649 [0,2,0,0,0,0|1,0,0]=3 11809 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1F Amb28256732 [0,2,0,0,0,0|1,1,0]=4 11810 B13R1.696 CC[C@@H](O)[C@@H](N)c1cccnc1Br Amb27486236 [0,2,0,0,0,0|2,0,0]=4 11811 B13R1.696 CC[C@H](N)C(O)c1ccccc1C Amb35601234 [0,2,0,0,0,0|2,0,0]=4 11812 B13R1.696 CC[C@H](N)C(O)c1ccccc1Cl Amb35601342 [0,2,0,0,0,0|1,1,0]=4 11813 B13R1.696 CC[C@H](N)C(O)c1ccccc1F Amb35601343 [0,2,0,0,0,0|1,1,0]=4 11814 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1C Amb28384672 [0,2,0,0,0,0|2,0,0]=4 11815 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1Cl Amb27430304 [0,2,0,0,0,0|1,1,0]=4 11816 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1I Amb27785046 [0,2,0,0,0,0|1,1,0]=4 11817 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1O Amb27620451 [0,2,0,0,0,0|2,0,0]=4 11818 B13R1.696 CC[C@H](N)[C@@H](N)c1cccnc1Br Amb27629702 [0,2,0,0,0,0|2,0,0]=4 11819 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1Cl Amb27430474 [0,2,0,0,0,0|1,1,0]=4 11820 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1F Amb27630528 [0,2,0,0,0,0|1,1,0]=4 11821 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1Br Amb27792205 [0,2,0,0,0,0|1,0,0]=3 11822 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1C Amb28348708 [0,2,0,0,0,0|2,0,0]=4 11823 B13R1.696 CC[C@H](O)[C@H](N)c1cccnc1Br Amb27411550 [0,2,0,0,0,0|2,0,0]=4 11824 B13R1.696 CNC(=O)C(C)c1ccccc1C Amb27179428 [0,2,0,0,0,0|1,0,1]=4 11825 B13R1.696 CNC(=O)C(C)c1ccccc1Cl Amb2444727 [0,2,0,0,0,0|0,1,1]=4 11826 B13R1.696 CNC(=O)C(Cl)c1ccccc1F Amb27812873 [0,2,0,0,0,0|0,1,1]=4 11827 B13R1.696 CNC(=O)C(N)c1ccccc1Br Amb27143467 [0,2,0,0,0,0|0,0,1]=3 11828 B13R1.696 CNC(=O)C(N)c1ccccc1C Amb25127837 [0,2,0,0,0,0|1,0,1]=4 11829 B13R1.696 CNC(=O)C(N)c1ccccc1Cl Amb24733869 [0,2,0,0,0,0|0,1,1]=4 11830 B13R1.696 CNC(=O)C(N)c1ccccc1F Amb28188743 [0,2,0,0,0,0|0,1,1]=4 11831 B13R1.696 CNC(=O)C(O)c1ccccc1Br Amb27196729 [0,2,0,0,0,0|0,0,1]=3 11832 B13R1.696 CNC(=O)C(O)c1ccccc1C Amb25949513 [0,2,0,0,0,0|1,0,1]=4 11833 B13R1.696 CNC(=O)C(O)c1ccccc1F Amb25936901 [0,2,0,0,0,0|0,1,1]=4 11834 B13R1.696 CNC(=O)[C@H](O)c1ccccc1Cl Amb27457359 [0,2,0,0,0,0|0,1,1]=4 11835 B13R1.696 CNC(C)C(=O)c1ccccc1Br Amb26514902 [0,2,0,0,0,0|0,0,1]=3 11836 B13R1.696 CNC(C)C(=O)c1ccccc1C Amb25836669 [0,2,0,0,0,0|1,0,1]=4 11837 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,2,0,0,0,0|0,1,1]=4 11838 B13R1.696 CNC(C)C(C)c1ccccc1Br Amb27949357 [0,2,0,0,0,0|0,0,0]=2 11839 B13R1.696 CNC(C)C(O)c1ccccc1C Amb35741407 [0,2,0,0,0,0|1,0,0]=3 11840 B13R1.696 CNC(C)C(O)c1ccccc1F Amb35621407 [0,2,0,0,0,0|0,1,0]=3 11841 B13R1.696 CNC(C)C(O)c1cccnc1N Amb35621615 [0,2,0,0,0,0|2,0,0]=4 11842 B13R1.696 CNC(C)C(O)c1ccncc1F Amb35624559 [0,2,0,0,0,0|1,1,0]=4 11843 B13R1.696 CNC(C)C(O)c1cnccc1C Amb35741400 [0,2,0,0,0,0|2,0,0]=4 11844 B13R1.696 CNC(C)C(O)c1cnccc1N Amb35621603 [0,2,0,0,0,0|2,0,0]=4 11845 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1C Amb35659960 [0,2,0,0,0,0|1,0,1]=4 11846 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1Cl Amb29891464 [0,2,0,0,0,0|0,1,1]=4 11847 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1F Amb35659965 [0,2,0,0,0,0|0,1,1]=4 11848 B13R1.696 CN[C@@H](C)C(O)c1ccccc1C Amb35662207 [0,2,0,0,0,0|1,0,0]=3 11849 B13R1.696 CN[C@@H](C)C(O)c1ccccc1Cl Amb35662568 [0,2,0,0,0,0|0,1,0]=3 11850 B13R1.696 CN[C@@H](C)C(O)c1ccccc1F Amb35662596 [0,2,0,0,0,0|0,1,0]=3 11851 B13R1.696 CN[C@@H](C)C(O)c1cccnc1N Amb29891490 [0,2,0,0,0,0|2,0,0]=4 11852 B13R1.696 CN[C@@H](C)C(O)c1ccncc1F Amb35659714 [0,2,0,0,0,0|1,1,0]=4 11853 B13R1.696 CN[C@@H](C)C(O)c1cnccc1C Amb30038954 [0,2,0,0,0,0|2,0,0]=4 11854 B13R1.696 CN[C@@H](C)C(O)c1cnccc1N Amb29891489 [0,2,0,0,0,0|2,0,0]=4 11855 B13R1.696 CN[C@@H](C)[C@H](O)c1ccccc1Cl Amb27793498 [0,2,0,0,0,0|0,1,0]=3 11856 B13R1.696 CN[C@H](C)[C@@H](O)c1ccccc1Cl Amb28123192 [0,2,0,0,0,0|0,1,0]=3 11857 B13R1.696 COC(=O)C(Br)c1ccccc1Br Amb32665444 [0,2,0,0,0,0|1,0,1]=4 11858 B13R1.696 COC(=O)C(C)c1ccccc1Br Amb24597051 [0,2,0,0,0,0|1,0,1]=4 11859 B13R1.696 COC(=O)C(Cl)c1ccccc1Br Amb23596603 [0,2,0,0,0,0|1,0,1]=4 11860 B13R1.696 COC(=O)C(N)c1ccccc1Br Amb28991129 [0,2,0,0,0,0|1,0,1]=4 11861 B13R1.696 COC(=O)C(N)c1ccccc1Br Amb9175255 [0,2,0,0,0,0|1,0,1]=4 11862 B13R1.696 COC(=O)C(O)c1ccccc1Br Amb23596557 [0,2,0,0,0,0|1,0,1]=4 11863 B13R1.696 COC(=O)[C@@H](N)c1ccccc1Br Amb27402704 [0,2,0,0,0,0|1,0,1]=4 11864 B13R1.696 COC(C)C(C)c1ccccc1N Amb27864034 [0,2,0,0,0,0|2,0,0]=4 11865 B13R1.696 COC(C)C(O)c1ccccc1C Amb27458098 [0,2,0,0,0,0|2,0,0]=4 11866 B13R1.696 COC(C)C(O)c1cccnc1Br Amb35670264 [0,2,0,0,0,0|2,0,0]=4 11867 B13R1.696 NC(CO)C(O)c1ccccc1Br Amb18717858 [0,2,0,0,0,0|2,0,0]=4 11868 B13R1.2819 C=CCC(C)(N)c1ccccc1Br Amb27494784 [0,2,0,0,0,0|1,0,1]=4 11869 B13R1.2819 C=CC[C@@](C)(N)c1ccccc1Br Amb27236987 [0,2,0,0,0,0|1,0,1]=4 11870 B13R1.2819 CC(C)(CCN)c1ccccc1Br Amb33387589 [0,2,0,0,0,0|2,0,0]=4 11871 B13R1.2819 CC(C)(CON)c1ccccc1Br Amb27463635 [0,2,0,0,0,0|2,0,0]=4 11872 B13R1.2819 CC(F)(CCN)c1ccccc1Br Amb28436449 [0,2,0,0,0,0|2,0,0]=4 11873 B13R1.2819 CC(N)(CC#N)c1ccccc1Br Amb27654103 [0,2,0,0,0,0|2,0,0]=4 11874 B13R1.2819 CC(O)(CC#N)c1ccccc1Br Amb27812960 [0,2,0,0,0,0|2,0,0]=4 11875 B13R1.2819 CC(O)(CC=O)c1ccccc1Br Amb28140387 [0,2,0,0,0,0|2,0,0]=4 11876 B13R1.2819 CC(O)(CCN)c1ccccc1Br Amb26869885 [0,2,0,0,0,0|2,0,0]=4 11877 B13R1.2819 CCCC(C)(O)c1ccccc1C Amb9676788 [0,2,0,0,0,0|2,0,0]=4 11878 B13R1.2819 CCCC(C)(O)c1cccnc1Br Amb35702775 [0,2,0,0,0,0|2,0,0]=4 11879 B13R1.2819 CCCS(=O)(=O)c1ccccc1Br Amb19375513 [0,2,0,0,0,0|2,0,0]=4 11880 B13R1.2819 CCNC(C)(C)c1ccccc1Br Amb28453918 [0,2,0,0,0,0|2,0,0]=4 11881 B13R1.2819 CNCC(C)(C)c1ccccc1C Amb17233329 [0,2,0,0,0,0|1,0,0]=3 11882 B13R1.2819 CNCC(C)(C)c1ccccc1Cl Amb17236690 [0,2,0,0,0,0|0,1,0]=3 11883 B13R1.2819 CNCC(C)(C)c1ccccc1F Amb17233828 [0,2,0,0,0,0|0,1,0]=3 11884 B13R1.2819 CNCC(C)(O)c1ccccc1C Amb18997533 [0,2,0,0,0,0|1,0,0]=3 11885 B13R1.2819 CNCC(C)(O)c1cccnc1N Amb28189635 [0,2,0,0,0,0|2,0,0]=4 11886 B13R1.2819 CNCC(F)(F)c1ccccc1Br Amb28145551 [0,2,0,0,0,0|0,0,0]=2 11887 B13R1.2819 CNCC(F)(F)c1ccccc1Cl Amb27618547 [0,2,0,0,0,0|0,1,0]=3 11888 B13R1.2819 COCC(C)(N)c1ccccc1Br Amb27663724 [0,2,0,0,0,0|1,0,0]=3 11889 B13R1.2819 COCC(C)(N)c1ccccc1Cl Amb18299363 [0,2,0,0,0,0|1,1,0]=4 11890 B13R1.2819 COCC(C)(O)c1ccccc1Cl Amb18333908 [0,2,0,0,0,0|1,1,0]=4 11891 B13R1.2819 COCC(C)(O)c1ccccc1F Amb19074708 [0,2,0,0,0,0|1,1,0]=4 11892 B13R1.2819 COCC(C)(O)c1ccccc1O Amb27826424 [0,2,0,0,0,0|2,0,0]=4 11893 B13R1.2819 COCC(C)(O)c1cccnc1Br Amb35702792 [0,2,0,0,0,0|2,0,0]=4 11894 B13R1.2819 COCC(F)(F)c1ccccc1N Amb27205659 [0,2,0,0,0,0|2,0,0]=4 11895 B13R1.2819 C[C@@](N)(CC#N)c1ccccc1Br Amb27402622 [0,2,0,0,0,0|2,0,0]=4 11896 B13R1.2819 C[C@](N)(CCO)c1ccccc1Br Amb27401074 [0,2,0,0,0,0|2,0,0]=4 11897 B13R1.2819 NCCC(F)(F)c1ccccc1Br Amb26386849 [0,2,0,0,0,0|2,0,0]=4 11898 B13R1.2819 OCCC(F)(F)c1ccccc1Br Amb32814243 [0,2,0,0,0,0|2,0,0]=4 11899 B13R1.4453 C=CC[C@@H](N)c1c(Cl)cccc1Br Amb28068912 [0,2,0,0,0,0|1,0,1]=4 11900 B13R1.4453 C=CC[C@H](N)c1c(F)cccc1Br Amb27181179 [0,2,0,0,0,0|1,0,1]=4 11901 B13R1.4453 C=CC[C@H](N)c1c(N)cccc1Br Amb27653411 [0,2,0,0,0,0|1,0,1]=4 11902 B13R1.4453 C=CC[C@H](O)c1c(F)cccc1Br Amb27641227 [0,2,0,0,0,0|1,0,1]=4 11903 B13R1.4453 CC(CCN)c1c(Cl)cccc1Br Amb24444131 [0,2,0,0,0,0|2,0,0]=4 11904 B13R1.4453 CC(CCN)c1c(F)cccc1Br Amb33452248 [0,2,0,0,0,0|2,0,0]=4 11905 B13R1.4453 CC(CCN)c1c(O)cccc1Br Amb33331528 [0,2,0,0,0,0|2,0,0]=4 11906 B13R1.4453 CC(CON)c1c(Cl)cccc1Br Amb33336241 [0,2,0,0,0,0|2,0,0]=4 11907 B13R1.4453 CC(CON)c1c(F)cccc1Br Amb33430014 [0,2,0,0,0,0|2,0,0]=4 11908 B13R1.4453 CC(CON)c1c(O)cccc1Br Amb33431146 [0,2,0,0,0,0|2,0,0]=4 11909 B13R1.4453 CCCC(=O)c1c(Cl)cccc1Br Amb27810732 [0,2,0,0,0,0|1,0,1]=4 11910 B13R1.4453 CCCC(=O)c1c(F)cccc1Br Amb28141461 [0,2,0,0,0,0|1,0,1]=4 11911 B13R1.4453 CCCC(C)c1c(C)cccc1O Amb27854989 [0,2,0,0,0,0|2,0,0]=4 11912 B13R1.4453 CCCC(N)c1c(Br)cccc1Br Amb27467581 [0,2,0,0,0,0|1,0,0]=3 11913 B13R1.4453 CCCC(N)c1c(C)cccc1F Amb28282692 [0,2,0,0,0,0|1,1,0]=4 11914 B13R1.4453 CCCC(N)c1c(C)cccc1O Amb27405788 [0,2,0,0,0,0|2,0,0]=4 11915 B13R1.4453 CCCC(N)c1c(C)ccnc1Br Amb27796213 [0,2,0,0,0,0|2,0,0]=4 11916 B13R1.4453 CCCC(N)c1c(F)cccc1Br Amb28398159 [0,2,0,0,0,0|1,0,0]=3 11917 B13R1.4453 CCCC(N)c1c(F)cccc1F Amb18191402 [0,2,0,0,0,0|1,1,0]=4 11918 B13R1.4453 CCCC(N)c1c(F)cccc1F Amb35745604 [0,2,0,0,0,0|1,1,0]=4 11919 B13R1.4453 CCCC(N)c1c(N)cccc1Cl Amb27663489 [0,2,0,0,0,0|1,1,0]=4 11920 B13R1.4453 CCCC(N)c1c(O)cccc1Cl Amb27483615 [0,2,0,0,0,0|1,1,0]=4 11921 B13R1.4453 CCCC(N)c1c(O)cccc1F Amb27491500 [0,2,0,0,0,0|1,1,0]=4 11922 B13R1.4453 CCCC(N)c1c(O)cccc1O Amb27168788 [0,2,0,0,0,0|2,0,0]=4 11923 B13R1.4453 CCCC(O)c1c(Br)cncc1Br Amb27781844 [0,2,0,0,0,0|2,0,0]=4 11924 B13R1.4453 CCCC(O)c1c(F)cccc1Br Amb27405786 [0,2,0,0,0,0|1,0,0]=3 11925 B13R1.4453 CCCC(O)c1c(F)cccc1Cl Amb17237578 [0,2,0,0,0,0|1,1,0]=4 11926 B13R1.4453 CCCN(C)c1c(N)cccc1Br Amb35645868 [0,2,0,0,0,0|2,0,0]=4 11927 B13R1.4453 CCC[C@@H](N)c1c(Br)cncc1Br Amb28185906 [0,2,0,0,0,0|2,0,0]=4 11928 B13R1.4453 CCC[C@@H](N)c1c(C)cccc1Br Amb28401455 [0,2,0,0,0,0|1,0,0]=3 11929 B13R1.4453 CCC[C@@H](N)c1c(C)cccc1C Amb28250048 [0,2,0,0,0,0|2,0,0]=4 11930 B13R1.4453 CCC[C@@H](N)c1c(C)ccnc1Br Amb27748647 [0,2,0,0,0,0|2,0,0]=4 11931 B13R1.4453 CCC[C@@H](N)c1c(Cl)cccc1Cl Amb27652691 [0,2,0,0,0,0|1,1,0]=4 11932 B13R1.4453 CCC[C@@H](N)c1c(Cl)cccc1I Amb27174375 [0,2,0,0,0,0|1,1,0]=4 11933 B13R1.4453 CCC[C@@H](N)c1c(F)cccc1Br Amb27794527 [0,2,0,0,0,0|1,0,0]=3 11934 B13R1.4453 CCC[C@@H](N)c1c(F)cccc1Cl Amb27203956 [0,2,0,0,0,0|1,1,0]=4 11935 B13R1.4453 CCC[C@@H](N)c1c(O)cccc1Br Amb28060680 [0,2,0,0,0,0|1,0,0]=3 11936 B13R1.4453 CCC[C@@H](N)c1c(O)cccc1O Amb27215275 [0,2,0,0,0,0|2,0,0]=4 11937 B13R1.4453 CCC[C@H](N)c1c(Br)cccc1Br Amb27181207 [0,2,0,0,0,0|1,0,0]=3 11938 B13R1.4453 CCC[C@H](N)c1c(Br)cncc1Br Amb27230375 [0,2,0,0,0,0|2,0,0]=4 11939 B13R1.4453 CCC[C@H](N)c1c(C)cccc1Br Amb27180579 [0,2,0,0,0,0|1,0,0]=3 11940 B13R1.4453 CCC[C@H](N)c1c(C)cccc1C Amb27597953 [0,2,0,0,0,0|2,0,0]=4 11941 B13R1.4453 CCC[C@H](N)c1c(C)cccc1F Amb27434422 [0,2,0,0,0,0|1,1,0]=4 11942 B13R1.4453 CCC[C@H](N)c1c(Cl)cccc1Br Amb27180627 [0,2,0,0,0,0|1,0,0]=3 11943 B13R1.4453 CCC[C@H](N)c1c(F)cccc1Br Amb27771811 [0,2,0,0,0,0|1,0,0]=3 11944 B13R1.4453 CCC[C@H](N)c1c(F)cccc1Cl Amb27608436 [0,2,0,0,0,0|1,1,0]=4 11945 B13R1.4453 CCC[C@H](N)c1c(N)cccc1Br Amb28197580 [0,2,0,0,0,0|1,0,0]=3 11946 B13R1.4453 CCC[C@H](N)c1c(O)cccc1Br Amb28060207 [0,2,0,0,0,0|1,0,0]=3 11947 B13R1.4453 CCC[C@H](N)c1c(O)cccc1O Amb27471901 [0,2,0,0,0,0|2,0,0]=4 11948 B13R1.4453 CCC[C@H](O)c1c(C)cccc1C Amb28200905 [0,2,0,0,0,0|2,0,0]=4 11949 B13R1.4453 CCC[C@H](O)c1c(C)cccc1F Amb27482972 [0,2,0,0,0,0|1,1,0]=4 11950 B13R1.4453 CNCC(=O)c1c(C)cccc1C Amb32727957 [0,2,0,0,0,0|1,0,1]=4 11951 B13R1.4453 CNCC(=O)c1c(C)cccc1Cl Amb33259444 [0,2,0,0,0,0|0,1,1]=4 11952 B13R1.4453 CNCC(=O)c1c(C)cccc1F Amb24578587 [0,2,0,0,0,0|0,1,1]=4 11953 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Br Amb25845605 [0,2,0,0,0,0|0,0,1]=3 11954 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Cl Amb33256482 [0,2,0,0,0,0|0,1,1]=4 11955 B13R1.4453 CNCC(=O)c1c(F)cccc1Br Amb33452256 [0,2,0,0,0,0|0,0,1]=3 11956 B13R1.4453 CNCC(=O)c1c(F)cccc1Cl Amb25381392 [0,2,0,0,0,0|0,1,1]=4 11957 B13R1.4453 CNCC(=O)c1c(F)cccc1F Amb27760183 [0,2,0,0,0,0|0,1,1]=4 11958 B13R1.4453 CNCC(=O)c1c(O)cccc1Br Amb33331539 [0,2,0,0,0,0|0,0,1]=3 11959 B13R1.4453 CNCC(=O)c1c(O)cccc1Cl Amb33260738 [0,2,0,0,0,0|0,1,1]=4 11960 B13R1.4453 CNCC(C)c1c(Cl)cccc1Cl Amb27874409 [0,2,0,0,0,0|0,1,0]=3 11961 B13R1.4453 CNCC(O)c1c(C)cccc1C Amb24534303 [0,2,0,0,0,0|1,0,0]=3 11962 B13R1.4453 CNCC(O)c1c(C)cccc1Cl Amb33259440 [0,2,0,0,0,0|0,1,0]=3 11963 B13R1.4453 CNCC(O)c1c(C)cccc1F Amb27238887 [0,2,0,0,0,0|0,1,0]=3 11964 B13R1.4453 CNCC(O)c1c(C)ccnc1N Amb27180717 [0,2,0,0,0,0|2,0,0]=4 11965 B13R1.4453 CNCC(O)c1c(Cl)cccc1Br Amb24399691 [0,2,0,0,0,0|0,0,0]=2 11966 B13R1.4453 CNCC(O)c1c(Cl)cccc1Cl Amb18997469 [0,2,0,0,0,0|0,1,0]=3 11967 B13R1.4453 CNCC(O)c1c(Cl)cncc1Cl Amb33260865 [0,2,0,0,0,0|1,1,0]=4 11968 B13R1.4453 CNCC(O)c1c(F)cccc1Br Amb24536637 [0,2,0,0,0,0|0,0,0]=2 11969 B13R1.4453 CNCC(O)c1c(F)cccc1Cl Amb5750908 [0,2,0,0,0,0|0,1,0]=3 11970 B13R1.4453 CNCC(O)c1c(F)cccc1F Amb18289719 [0,2,0,0,0,0|0,1,0]=3 11971 B13R1.4453 CNCC(O)c1c(F)cncc1F Amb32882363 [0,2,0,0,0,0|1,1,0]=4 11972 B13R1.4453 CNCC(O)c1c(O)cccc1Br Amb33331536 [0,2,0,0,0,0|0,0,0]=2 11973 B13R1.4453 CNCC(O)c1c(O)cccc1Cl Amb33260733 [0,2,0,0,0,0|0,1,0]=3 11974 B13R1.4453 COCC(N)c1c(Cl)cccc1I Amb28203582 [0,2,0,0,0,0|1,1,0]=4 11975 B13R1.4453 COCC(N)c1c(F)cccc1Br Amb28119060 [0,2,0,0,0,0|1,0,0]=3 11976 B13R1.4453 COCC(N)c1c(F)cccc1Cl Amb27239752 [0,2,0,0,0,0|1,1,0]=4 11977 B13R1.4453 COCC(N)c1c(N)cccc1Br Amb27273172 [0,2,0,0,0,0|1,0,0]=3 11978 B13R1.4453 COCC(O)c1c(Cl)cccc1Cl Amb27399163 [0,2,0,0,0,0|1,1,0]=4 11979 B13R1.4453 COCC(O)c1c(F)cccc1Cl Amb28140204 [0,2,0,0,0,0|1,1,0]=4 11980 B13R1.4453 COC[C@@H](N)c1c(Br)cccc1Br Amb28068908 [0,2,0,0,0,0|1,0,0]=3 11981 B13R1.4453 COC[C@@H](N)c1c(C)cccc1Br Amb27405944 [0,2,0,0,0,0|1,0,0]=3 11982 B13R1.4453 COC[C@@H](N)c1c(C)cccc1Cl Amb27435622 [0,2,0,0,0,0|1,1,0]=4 11983 B13R1.4453 COC[C@@H](N)c1c(C)cccc1F Amb27473302 [0,2,0,0,0,0|1,1,0]=4 11984 B13R1.4453 COC[C@@H](N)c1c(C)ccnc1Br Amb27874728 [0,2,0,0,0,0|2,0,0]=4 11985 B13R1.4453 COC[C@@H](N)c1c(Cl)cccc1Cl Amb27390050 [0,2,0,0,0,0|1,1,0]=4 11986 B13R1.4453 COC[C@@H](N)c1c(F)cccc1Cl Amb28252318 [0,2,0,0,0,0|1,1,0]=4 11987 B13R1.4453 COC[C@@H](N)c1c(F)cccc1I Amb27436601 [0,2,0,0,0,0|1,1,0]=4 11988 B13R1.4453 COC[C@@H](N)c1c(N)cccc1F Amb28057155 [0,2,0,0,0,0|1,1,0]=4 11989 B13R1.4453 COC[C@@H](N)c1c(O)cccc1Br Amb27450422 [0,2,0,0,0,0|1,0,0]=3 11990 B13R1.4453 COC[C@@H](N)c1c(O)cccc1O Amb27166596 [0,2,0,0,0,0|2,0,0]=4 11991 B13R1.4453 COC[C@H](N)c1c(C)cccc1C Amb27473414 [0,2,0,0,0,0|2,0,0]=4 11992 B13R1.4453 COC[C@H](N)c1c(F)cccc1F Amb27259071 [0,2,0,0,0,0|1,1,0]=4 11993 B13R1.4453 COC[C@H](N)c1c(N)cccc1F Amb27391701 [0,2,0,0,0,0|1,1,0]=4 11994 B13R1.4453 Cc1cccc(Br)c1C(N)CC#N Amb28366821 [0,2,0,0,0,0|2,0,0]=4 11995 B13R1.4453 Cc1cccc(Br)c1C(N)CCO Amb27486764 [0,2,0,0,0,0|2,0,0]=4 11996 B13R1.4453 Cc1cccc(Br)c1[C@H](N)CCO Amb28136626 [0,2,0,0,0,0|2,0,0]=4 11997 B13R1.4453 N#CCC(O)c1c(Cl)cccc1Br Amb33337362 [0,2,0,0,0,0|2,0,0]=4 11998 B13R1.4453 N#CCC(O)c1c(F)cccc1Br Amb26631342 [0,2,0,0,0,0|2,0,0]=4 11999 B13R1.4453 N#CCC(O)c1c(O)cccc1Br Amb33336186 [0,2,0,0,0,0|2,0,0]=4 12000 B13R1.4453 N#CC[C@@H](N)c1c(Br)cccc1Br Amb28046759 [0,2,0,0,0,0|2,0,0]=4 12001 B13R1.4453 N#CC[C@@H](N)c1c(Cl)cccc1Br Amb27644568 [0,2,0,0,0,0|2,0,0]=4 12002 B13R1.4453 N#CC[C@H](N)c1c(Cl)cccc1Br Amb27799993 [0,2,0,0,0,0|2,0,0]=4 12003 B13R1.4453 NC(CCO)c1c(Cl)cccc1Br Amb25108324 [0,2,0,0,0,0|2,0,0]=4 12004 B13R1.4453 NC(CCO)c1c(F)cccc1Br Amb25937148 [0,2,0,0,0,0|2,0,0]=4 12005 B13R1.4453 NC(CCO)c1c(O)cccc1Br Amb26905527 [0,2,0,0,0,0|2,0,0]=4 12006 B13R1.4453 NCCC(F)c1c(Cl)cccc1Br Amb26412262 [0,2,0,0,0,0|2,0,0]=4 12007 B13R1.4453 NCCC(F)c1c(F)cccc1Br Amb33430013 [0,2,0,0,0,0|2,0,0]=4 12008 B13R1.4453 NCCC(F)c1c(O)cccc1Br Amb33431130 [0,2,0,0,0,0|2,0,0]=4 12009 B13R1.4453 NCCC(O)c1c(Cl)cccc1Br Amb26886116 [0,2,0,0,0,0|2,0,0]=4 12010 B13R1.4453 NCCC(O)c1c(F)cccc1Br Amb25842899 [0,2,0,0,0,0|2,0,0]=4 12011 B13R1.4453 NCCC(O)c1c(O)cccc1Br Amb33331520 [0,2,0,0,0,0|2,0,0]=4 12012 B13R1.4453 NCC[C@@H](O)c1c(Cl)cccc1Br Amb33336234 [0,2,0,0,0,0|2,0,0]=4 12013 B13R1.4453 NCC[C@@H](O)c1c(F)cccc1Br Amb33430010 [0,2,0,0,0,0|2,0,0]=4 12014 B13R1.4453 NCC[C@@H](O)c1c(O)cccc1Br Amb33431123 [0,2,0,0,0,0|2,0,0]=4 12015 B13R1.4453 NCC[C@H](O)c1c(Cl)cccc1Br Amb33336235 [0,2,0,0,0,0|2,0,0]=4 12016 B13R1.4453 NCC[C@H](O)c1c(F)cccc1Br Amb33430012 [0,2,0,0,0,0|2,0,0]=4 12017 B13R1.4453 NCC[C@H](O)c1c(O)cccc1Br Amb33431125 [0,2,0,0,0,0|2,0,0]=4 12018 B13R1.4453 NNCC(O)c1c(F)cccc1Cl Amb17238276 [0,2,0,0,0,0|1,1,0]=4 12019 B13R1.4453 N[C@@H](CCO)c1c(F)cccc1Br Amb27403671 [0,2,0,0,0,0|2,0,0]=4 12020 B13R1.4453 N[C@@H](CCO)c1c(O)cccc1Br Amb28120645 [0,2,0,0,0,0|2,0,0]=4 12021 B13R1.4453 N[C@H](CCO)c1c(F)cccc1Br Amb27870827 [0,2,0,0,0,0|2,0,0]=4 12022 B13R1.4453 Nc1cccc(Br)c1[C@H](N)CCO Amb28041665 [0,2,0,0,0,0|2,0,0]=4 12023 B13R1.4453 O=CCC(O)c1c(F)cccc1Br Amb27477195 [0,2,0,0,0,0|2,0,0]=4 12024 B13R1.4453 ONCC(O)c1c(F)cccc1Cl Amb17338415 [0,2,0,0,0,0|1,1,0]=4 12025 B13R1.275 CC(C)(C#N)Cc1ccccc1Br Amb27167118 [0,2,0,0,0,0|2,0,0]=4 12026 B13R1.275 CC(C)(C=O)Cc1ccccc1Br Amb26327952 [0,2,0,0,0,0|2,0,0]=4 12027 B13R1.275 CC(C)(CBr)Cc1ccccc1Br Amb27169982 [0,2,0,0,0,0|2,0,0]=4 12028 B13R1.275 CC(C)(CN)Cc1ccccc1Br Amb25942329 [0,2,0,0,0,0|2,0,0]=4 12029 B13R1.275 CC(N)(CO)Cc1ccccc1Br Amb33387995 [0,2,0,0,0,0|2,0,0]=4 12030 B13R1.275 CC(O)(C=O)Cc1ccccc1Br Amb27229881 [0,2,0,0,0,0|2,0,0]=4 12031 B13R1.275 CC(O)(CN)Cc1ccccc1Br Amb27795518 [0,2,0,0,0,0|2,0,0]=4 12032 B13R1.275 CCC(C)(N)Cc1ccccc1Cl Amb19054919 [0,2,0,0,0,0|1,1,0]=4 12033 B13R1.275 CCC(C)(N)Cc1ccccc1F Amb18968273 [0,2,0,0,0,0|1,1,0]=4 12034 B13R1.275 CCC(C)(N)Cc1ncccc1Br Amb27759612 [0,2,0,0,0,0|2,0,0]=4 12035 B13R1.275 CCC(C)(O)Cc1ccccc1Cl Amb18322127 [0,2,0,0,0,0|1,1,0]=4 12036 B13R1.275 CCS(=O)(=O)Cc1ccccc1Br Amb27661637 [0,2,0,0,0,0|2,0,0]=4 12037 B13R1.275 CC[N+](C)(C)Cc1ccccc1Br Amb10604068 [0,2,0,0,0,0|2,0,0]=4 12038 B13R1.275 CNC(C)(C)Cc1ccccc1Br Amb24449976 [0,2,0,0,0,0|0,0,0]=2 12039 B13R1.275 CNC(C)(C)Cc1ccccc1C Amb17400627 [0,2,0,0,0,0|1,0,0]=3 12040 B13R1.275 CNC(C)(C)Cc1ccccc1Cl Amb17402234 [0,2,0,0,0,0|0,1,0]=3 12041 B13R1.275 CNC(C)(C)Cc1ccccc1F Amb17400876 [0,2,0,0,0,0|0,1,0]=3 12042 B13R1.275 CNC(C)(C)Cc1ccccc1O Amb33195788 [0,2,0,0,0,0|1,0,0]=3 12043 B13R1.275 CNC(C)(C)Cc1cccnc1Br Amb33388148 [0,2,0,0,0,0|1,0,0]=3 12044 B13R1.275 CNC(C)(C)Cc1cccnc1C Amb32878334 [0,2,0,0,0,0|2,0,0]=4 12045 B13R1.275 CNC(C)(C)Cc1cccnc1Cl Amb33257370 [0,2,0,0,0,0|1,1,0]=4 12046 B13R1.275 CNC(C)(C)Cc1cccnc1F Amb33376814 [0,2,0,0,0,0|1,1,0]=4 12047 B13R1.275 CNC(C)(C)Cc1ccncc1Br Amb33388996 [0,2,0,0,0,0|1,0,0]=3 12048 B13R1.275 CNC(C)(C)Cc1ccncc1C Amb33426422 [0,2,0,0,0,0|2,0,0]=4 12049 B13R1.275 CNC(C)(C)Cc1ccncc1Cl Amb33413832 [0,2,0,0,0,0|1,1,0]=4 12050 B13R1.275 CNC(C)(C)Cc1ccncc1F Amb33316810 [0,2,0,0,0,0|1,1,0]=4 12051 B13R1.275 CNC(C)(C)Cc1cnccc1C Amb33375278 [0,2,0,0,0,0|2,0,0]=4 12052 B13R1.275 CNC(C)(C)Cc1ncccc1Br Amb33336382 [0,2,0,0,0,0|1,0,0]=3 12053 B13R1.275 CNC(C)(C)Cc1ncccc1C Amb33360219 [0,2,0,0,0,0|2,0,0]=4 12054 B13R1.275 CNC(C)(C)Cc1ncccc1F Amb33418417 [0,2,0,0,0,0|1,1,0]=4 12055 B13R1.275 CNS(=O)(=O)Cc1ccccc1Br Amb26988801 [0,2,0,0,0,0|1,0,0]=3 12056 B13R1.275 CNS(=O)(=O)Cc1ccccc1C Amb22301451 [0,2,0,0,0,0|2,0,0]=4 12057 B13R1.275 CNS(=O)(=O)Cc1ccccc1Cl Amb6862569 [0,2,0,0,0,0|1,1,0]=4 12058 B13R1.275 CNS(=O)(=O)Cc1ccccc1F Amb993286 [0,2,0,0,0,0|1,1,0]=4 12059 B13R1.275 CNS(=O)(=O)Cc1ccncc1Br Amb32692440 [0,2,0,0,0,0|2,0,0]=4 12060 B13R1.275 NCC(F)(F)Cc1ccccc1Br Amb32814242 [0,2,0,0,0,0|2,0,0]=4 12061 B13R1.335 C#CC(CC)Nc1ccccc1Br Amb27980884 [0,2,0,0,0,0|2,0,0]=4 12062 B13R1.335 C#CC(Cc1ccccc1Br)NC Amb27181013 [0,2,0,0,0,0|0,0,0]=2 12063 B13R1.335 C#CC(Cc1ccccc1F)NC Amb27180846 [0,2,0,0,0,0|0,1,0]=3 12064 B13R1.335 C#CC(Cc1ccccc1F)NN Amb27599743 [0,2,0,0,0,0|1,1,0]=4 12065 B13R1.335 CCC(CN)Cc1ccccc1C Amb5743868 [0,2,0,0,0,0|2,0,0]=4 12066 B13R1.335 CCC(CN)Cc1ccccc1Cl Amb5743877 [0,2,0,0,0,0|1,1,0]=4 12067 B13R1.335 CCC(CN)Cc1ccccc1F Amb5743871 [0,2,0,0,0,0|1,1,0]=4 12068 B13R1.335 CCC(CN)Nc1ccccc1Br Amb27215254 [0,2,0,0,0,0|2,0,0]=4 12069 B13R1.335 CCC(Cc1ccccc1Br)NC Amb33292447 [0,2,0,0,0,0|0,0,0]=2 12070 B13R1.335 CN\C(Cc1ccccc1Br)=N\N Amb29860598 [0,2,0,0,0,0|0,0,1]=3 12071 B13R1.335 COC(Cc1ccccc1F)OC Amb19419528 [0,2,0,0,0,0|1,1,0]=4 12072 B13R1.335 COC(Cc1ccccc1N)OC Amb8395713 [0,2,0,0,0,0|2,0,0]=4 12073 B13R1.335 C\N=C(\NC)Nc1ccccc1Br Amb27860488 [0,2,0,0,0,0|1,0,1]=4 12074 B13R1.335 N#CC(CBr)Cc1ccccc1Br Amb27458401 [0,2,0,0,0,0|2,0,0]=4 12075 B13R1.335 N#CC(CO)Cc1ccccc1Br Amb18629238 [0,2,0,0,0,0|2,0,0]=4 12076 B13R1.335 NCC(CO)Cc1ccccc1Br Amb17605849 [0,2,0,0,0,0|2,0,0]=4 12077 B13R1.335 NCC(CO)Cc1ccccc1Br Amb33543175 [0,2,0,0,0,0|2,0,0]=4 12078 B13R1.2872 CC(CBr)Cc1cc(F)ccc1Br Amb27227426 [0,2,0,0,0,0|2,0,0]=4 12079 B13R1.2872 CC(CN)Cc1cc(F)ccc1Br Amb28143979 [0,2,0,0,0,0|2,0,0]=4 12080 B13R1.2872 CC(CO)Cc1cc(Cl)ccc1Br Amb27226370 [0,2,0,0,0,0|2,0,0]=4 12081 B13R1.2872 CC(Cc1cc(Br)ccc1F)NN Amb27776427 [0,2,0,0,0,0|1,1,0]=4 12082 B13R1.2872 CC(Cc1cc(Cl)ccc1I)NN Amb35697536 [0,2,0,0,0,0|1,1,0]=4 12083 B13R1.2872 CC(Cc1cc(F)ccc1F)NN Amb27171145 [0,2,0,0,0,0|1,1,0]=4 12084 B13R1.2872 CCC(=O)Cc1cc(F)ccc1Br Amb26374545 [0,2,0,0,0,0|1,0,1]=4 12085 B13R1.2872 CCC(Br)Cc1cc(F)ccc1F Amb18048891 [0,2,0,0,0,0|1,1,0]=4 12086 B13R1.2872 CCC(C)Nc1cc(N)ccc1Br Amb28424213 [0,2,0,0,0,0|2,0,0]=4 12087 B13R1.2872 CCC(C)Oc1cc(C)ccc1Br Amb35663093 [0,2,0,0,0,0|2,0,0]=4 12088 B13R1.2872 CCC(C)Oc1cc(F)ccc1Br Amb27230434 [0,2,0,0,0,0|2,0,0]=4 12089 B13R1.2872 CCC(Cl)Cc1cc(Br)ccc1C Amb27833946 [0,2,0,0,0,0|2,0,0]=4 12090 B13R1.2872 CCC(Cl)Cc1cc(C)ccc1C Amb18318178 [0,2,0,0,0,0|2,0,0]=4 12091 B13R1.2872 CCC(Cl)Cc1cc(Cl)ccc1Br Amb27659710 [0,2,0,0,0,0|1,0,0]=3 12092 B13R1.2872 CCC(Cl)Cc1cc(Cl)ccc1Cl Amb28435952 [0,2,0,0,0,0|1,1,0]=4 12093 B13R1.2872 CCC(Cl)Cc1cc(Cl)ccc1I Amb35697870 [0,2,0,0,0,0|1,1,0]=4 12094 B13R1.2872 CCC(Cl)Cc1cc(F)ccc1Br Amb28435953 [0,2,0,0,0,0|1,0,0]=3 12095 B13R1.2872 CCC(Cl)Cc1cc(F)ccc1Cl Amb28207846 [0,2,0,0,0,0|1,1,0]=4 12096 B13R1.2872 CCC(N)Cc1cc(Br)ccc1C Amb28143085 [0,2,0,0,0,0|2,0,0]=4 12097 B13R1.2872 CCC(N)Cc1cc(C)ccc1F Amb28347844 [0,2,0,0,0,0|1,1,0]=4 12098 B13R1.2872 CCC(N)Cc1cc(Cl)ccc1I Amb29864290 [0,2,0,0,0,0|1,1,0]=4 12099 B13R1.2872 CCC(N)Cc1cc(F)ccc1O Amb27488732 [0,2,0,0,0,0|2,0,0]=4 12100 B13R1.2872 CCC(N)Cc1cc(O)ccc1Br Amb27235520 [0,2,0,0,0,0|1,0,0]=3 12101 B13R1.2872 CCC(O)Cc1cc(C)ccc1C Amb18180857 [0,2,0,0,0,0|2,0,0]=4 12102 B13R1.2872 CCC(O)Cc1cc(Cl)ccc1C Amb26881889 [0,2,0,0,0,0|2,0,0]=4 12103 B13R1.2872 CCC(O)Cc1cc(Cl)ccc1F Amb27262073 [0,2,0,0,0,0|1,1,0]=4 12104 B13R1.2872 CCC(O)Cc1cc(Cl)ccc1I Amb35717002 [0,2,0,0,0,0|1,1,0]=4 12105 B13R1.2872 CCC(O)Cc1cc(F)ccc1C Amb25827881 [0,2,0,0,0,0|2,0,0]=4 12106 B13R1.2872 CCC(O)Cc1cc(F)ccc1F Amb18327112 [0,2,0,0,0,0|1,1,0]=4 12107 B13R1.2872 CCN(C)Cc1cc(N)ccc1Br Amb24614359 [0,2,0,0,0,0|2,0,0]=4 12108 B13R1.2872 CNC(=N)Nc1cc(Br)ccc1Br Amb27460736 [0,2,0,0,0,0|1,0,1]=4 12109 B13R1.2872 CNC(=N)Nc1cc(Cl)ccc1Br Amb27408725 [0,2,0,0,0,0|1,0,1]=4 12110 B13R1.2872 CNC(=N)Nc1cc(F)ccc1Br Amb27395281 [0,2,0,0,0,0|1,0,1]=4 12111 B13R1.2872 CNC(=O)Cc1cc(C)ccc1C Amb8016389 [0,2,0,0,0,0|1,0,1]=4 12112 B13R1.2872 CNC(=O)Nc1cc(Br)ccc1Br Amb27229845 [0,2,0,0,0,0|1,0,1]=4 12113 B13R1.2872 CNC(=O)Nc1cc(C)ccc1Br Amb28122097 [0,2,0,0,0,0|1,0,1]=4 12114 B13R1.2872 CNC(=O)Nc1cc(F)ccc1Br Amb28321074 [0,2,0,0,0,0|1,0,1]=4 12115 B13R1.2872 CNC(=S)Nc1cc(Br)ccc1Br Amb27772365 [0,2,0,0,0,0|1,0,1]=4 12116 B13R1.2872 CNC(=S)Nc1cc(Cl)ccc1Br Amb27211462 [0,2,0,0,0,0|1,0,1]=4 12117 B13R1.2872 CNC(C)CN1C=C(F)C=CC1=O Amb27778195 [0,2,0,0,0,0|2,0,0]=4 12118 B13R1.2872 CNC(C)Cc1cc(Br)ccc1F Amb27391287 [0,2,0,0,0,0|0,1,0]=3 12119 B13R1.2872 CNC(C)Cc1cc(Cl)ccc1I Amb29864291 [0,2,0,0,0,0|0,1,0]=3 12120 B13R1.2872 CNC(C)Cc1cc(F)ccc1O Amb28323355 [0,2,0,0,0,0|1,0,0]=3 12121 B13R1.2872 COC(=O)Cc1cc(Br)ccc1Br Amb26472328 [0,2,0,0,0,0|1,0,1]=4 12122 B13R1.2872 COC(=O)Cc1cc(C)ccc1Br Amb27181078 [0,2,0,0,0,0|1,0,1]=4 12123 B13R1.2872 COC(=O)Cc1cc(Cl)ccc1Br Amb22001696 [0,2,0,0,0,0|1,0,1]=4 12124 B13R1.2872 COC(=O)Cc1cc(F)ccc1Br Amb24271298 [0,2,0,0,0,0|1,0,1]=4 12125 B13R1.2872 Cc1ccc(Br)c(CC(N)CO)c1 Amb33477509 [0,2,0,0,0,0|2,0,0]=4 12126 B13R1.2872 Cc1ccc(Br)c(CC(O)CN)c1 Amb33477909 [0,2,0,0,0,0|2,0,0]=4 12127 B13R1.2872 NC(CO)Cc1cc(Cl)ccc1Br Amb25086867 [0,2,0,0,0,0|2,0,0]=4 12128 B13R1.2872 NC(CO)Cc1cc(F)ccc1Br Amb26439786 [0,2,0,0,0,0|2,0,0]=4 12129 B13R1.2872 NC(CO)Cc1cc(O)ccc1Br Amb33450311 [0,2,0,0,0,0|2,0,0]=4 12130 B13R1.2872 NCC(O)Cc1cc(Cl)ccc1Br Amb28202474 [0,2,0,0,0,0|2,0,0]=4 12131 B13R1.2872 NCC(O)Cc1cc(F)ccc1Br Amb26881477 [0,2,0,0,0,0|2,0,0]=4 12132 B13R1.2872 NCC(O)Cc1cc(O)ccc1Br Amb33386644 [0,2,0,0,0,0|2,0,0]=4 12133 B13R1.2872 O=C(Cc1cc(Cl)ccc1Br)NO Amb28185517 [0,2,0,0,0,0|1,0,1]=4 12134 B13R1.2872 O=CC(Cl)Cc1cc(Cl)ccc1Br Amb27591878 [0,2,0,0,0,0|2,0,0]=4 12135 B13R1.2872 O=CC(Cl)Cc1cc(F)ccc1Br Amb28064536 [0,2,0,0,0,0|2,0,0]=4 12136 B13R1.2872 O=CC(Cl)Cc1cc(I)ccc1Br Amb28318026 [0,2,0,0,0,0|2,0,0]=4 12137 B13R1.2872 O=CC(O)Cc1cc(F)ccc1Br Amb27809095 [0,2,0,0,0,0|2,0,0]=4 12138 B13R1.4928 CC(CO)Cc1c(Cl)cccc1Br Amb27400007 [0,2,0,0,0,0|2,0,0]=4 12139 B13R1.4928 CC(Cc1c(Cl)cccc1Cl)NN Amb28436142 [0,2,0,0,0,0|1,1,0]=4 12140 B13R1.4928 CCC(C)CN1C(=O)C=CC=C1Br Amb27651424 [0,2,0,0,0,0|2,0,0]=4 12141 B13R1.4928 CCC(C)Nc1c(C)cccc1Br Amb35721349 [0,2,0,0,0,0|2,0,0]=4 12142 B13R1.4928 CCC(C)Nc1c(F)cccc1Br Amb27984449 [0,2,0,0,0,0|2,0,0]=4 12143 B13R1.4928 CCC(C)Nc1c(N)cccc1Br Amb35645866 [0,2,0,0,0,0|2,0,0]=4 12144 B13R1.4928 CCC(C)Oc1c(N)cccc1Br Amb24418244 [0,2,0,0,0,0|2,0,0]=4 12145 B13R1.4928 CCC(C)Sc1c(N)cccc1Br Amb35591424 [0,2,0,0,0,0|2,0,0]=4 12146 B13R1.4928 CCC(Cl)Cc1c(F)cccc1F Amb28188433 [0,2,0,0,0,0|1,1,0]=4 12147 B13R1.4928 CCC(F)CN1C(=O)C=CC=C1Br Amb28078802 [0,2,0,0,0,0|2,0,0]=4 12148 B13R1.4928 CCC(N)CN1C(=O)C=CC=C1Br Amb18543112 [0,2,0,0,0,0|2,0,0]=4 12149 B13R1.4928 CCC(N)Cc1c(F)cccc1Br Amb27428385 [0,2,0,0,0,0|1,0,0]=3 12150 B13R1.4928 CCC(N)Cc1c(F)cccc1F Amb9428903 [0,2,0,0,0,0|1,1,0]=4 12151 B13R1.4928 CCC(O)Cc1c(Cl)cccc1Cl Amb17477601 [0,2,0,0,0,0|1,1,0]=4 12152 B13R1.4928 CCC(O)Cc1c(F)cccc1Cl Amb26854394 [0,2,0,0,0,0|1,1,0]=4 12153 B13R1.4928 CCN(C)Cc1c(N)cccc1Br Amb8890293 [0,2,0,0,0,0|2,0,0]=4 12154 B13R1.4928 CNC(=N)Cc1c(F)cccc1Cl Amb27405436 [0,2,0,0,0,0|0,1,1]=4 12155 B13R1.4928 CNC(=N)Nc1c(C)cccc1Br Amb35721161 [0,2,0,0,0,0|1,0,1]=4 12156 B13R1.4928 CNC(=O)CN1C(=O)C=CC=C1Br Amb27805950 [0,2,0,0,0,0|1,0,1]=4 12157 B13R1.4928 CNC(=O)Cc1c(Cl)cccc1Cl Amb8245469 [0,2,0,0,0,0|0,1,1]=4 12158 B13R1.4928 CNC(=O)Nc1c(C)cccc1Br Amb35717914 [0,2,0,0,0,0|1,0,1]=4 12159 B13R1.4928 CNC(=O)Nc1c(F)cccc1Br Amb28317479 [0,2,0,0,0,0|1,0,1]=4 12160 B13R1.4928 CNC(=S)Nc1c(Br)cccc1Br Amb27443789 [0,2,0,0,0,0|1,0,1]=4 12161 B13R1.4928 CNC(=S)Nc1c(C)cccc1Br Amb35717911 [0,2,0,0,0,0|1,0,1]=4 12162 B13R1.4928 CNC(C)Cc1c(F)cccc1Cl Amb5735467 [0,2,0,0,0,0|0,1,0]=3 12163 B13R1.4928 CNC(C)Cc1c(F)cccc1F Amb27480468 [0,2,0,0,0,0|0,1,0]=3 12164 B13R1.4928 CNC(C)Cc1c(O)cccc1F Amb27842212 [0,2,0,0,0,0|0,1,0]=3 12165 B13R1.4928 CN[C@@H](C)Cc1c(F)cccc1F Amb33621125 [0,2,0,0,0,0|0,1,0]=3 12166 B13R1.4928 COC(=O)Cc1c(Br)cccc1Br Amb23402717 [0,2,0,0,0,0|1,0,1]=4 12167 B13R1.4928 COC(=O)Cc1c(F)cccc1Br Amb25142151 [0,2,0,0,0,0|1,0,1]=4 12168 B13R1.4928 COC(=O)Cc1c(O)cccc1Br Amb27180749 [0,2,0,0,0,0|1,0,1]=4 12169 B13R1.4928 Cc1cccc(Br)c1CC(Cl)C=O Amb29864766 [0,2,0,0,0,0|2,0,0]=4 12170 B13R1.4928 Cc1cccc(C)c1CC(C)NN Amb27198875 [0,2,0,0,0,0|2,0,0]=4 12171 B13R1.4928 NC(CO)Cc1c(Cl)cccc1Br Amb33336252 [0,2,0,0,0,0|2,0,0]=4 12172 B13R1.4928 NC(CO)Cc1c(F)cccc1Br Amb33429998 [0,2,0,0,0,0|2,0,0]=4 12173 B13R1.4928 NC(CO)Cc1c(O)cccc1Br Amb33331558 [0,2,0,0,0,0|2,0,0]=4 12174 B13R1.4928 NCC(O)Cc1c(Cl)cccc1Br Amb33336276 [0,2,0,0,0,0|2,0,0]=4 12175 B13R1.4928 NCC(O)Cc1c(F)cccc1Br Amb26639205 [0,2,0,0,0,0|2,0,0]=4 12176 B13R1.4928 NCC(O)Cc1c(O)cccc1Br Amb33336465 [0,2,0,0,0,0|2,0,0]=4 12177 B13R1.4928 O=CC(Cl)Cc1c(F)cccc1Br Amb28317476 [0,2,0,0,0,0|2,0,0]=4 12178 B13R1.558 C#CCCc1cc(C#N)ccc1Br Amb33006465 [0,2,0,0,0,0|1,0,1]=4 12179 B13R1.558 C#CCCc1cc(OC)ccc1Br Amb33006942 [0,2,0,0,0,0|1,0,1]=4 12180 B13R1.558 CCCCc1cc(C#N)ccc1N Amb32685694 [0,2,0,0,0,0|2,0,0]=4 12181 B13R1.558 CCCCc1cc(CN)ccc1N Amb32697411 [0,2,0,0,0,0|2,0,0]=4 12182 B13R1.558 CCOCc1cc(C#N)ccc1Br Amb28348712 [0,2,0,0,0,0|2,0,0]=4 12183 B13R1.558 CCOCc1cc(C=O)ccc1Br Amb8388136 [0,2,0,0,0,0|2,0,0]=4 12184 B13R1.558 CNCCc1cc(C#N)ccc1Br Amb33005863 [0,2,0,0,0,0|0,0,0]=2 12185 B13R1.558 CNCCc1cc(OC)ccc1Br Amb33430069 [0,2,0,0,0,0|0,0,0]=2 12186 B13R1.558 CNCCc1cc(OC)ccc1O Amb32876028 [0,2,0,0,0,0|1,0,0]=3 12187 B13R1.558 CONCc1cc(C#N)ccc1Br Amb28293758 [0,2,0,0,0,0|2,0,0]=4 12188 B13R1.558 COc1ccc(Br)c(CCC=O)c1 Amb24093000 [0,2,0,0,0,0|2,0,0]=4 12189 B13R1.558 COc1ccc(Br)c(CCCN)c1 Amb33241843 [0,2,0,0,0,0|2,0,0]=4 12190 B13R1.558 COc1ccc(Br)c(CCCO)c1 Amb32950930 [0,2,0,0,0,0|2,0,0]=4 12191 B13R1.558 COc1ccc(Br)c(CCCS)c1 Amb33007239 [0,2,0,0,0,0|2,0,0]=4 12192 B13R1.558 COc1ccc(Br)c(CCON)c1 Amb33006890 [0,2,0,0,0,0|2,0,0]=4 12193 B13R1.558 CSc1ccc(Br)c(CCC#N)c1 Amb27813668 [0,2,0,0,0,0|2,0,0]=4 12194 B13R1.558 N#CCCc1cc(C#N)ccc1Br Amb26537714 [0,2,0,0,0,0|2,0,0]=4 12195 B13R1.558 N#CCCc1cc(CBr)ccc1Br Amb26895023 [0,2,0,0,0,0|2,0,0]=4 12196 B13R1.558 N#CCCc1cc(CF)ccc1Br Amb28196599 [0,2,0,0,0,0|2,0,0]=4 12197 B13R1.558 N#CCCc1cc(CO)ccc1Br Amb27616040 [0,2,0,0,0,0|2,0,0]=4 12198 B13R1.558 N#Cc1ccc(Br)c(CCC=O)c1 Amb28326080 [0,2,0,0,0,0|2,0,0]=4 12199 B13R1.558 N#Cc1ccc(Br)c(CCCBr)c1 Amb26594418 [0,2,0,0,0,0|2,0,0]=4 12200 B13R1.558 N#Cc1ccc(Br)c(CCCCl)c1 Amb26537719 [0,2,0,0,0,0|2,0,0]=4 12201 B13R1.558 N#Cc1ccc(Br)c(CCCN)c1 Amb33005853 [0,2,0,0,0,0|2,0,0]=4 12202 B13R1.558 N#Cc1ccc(Br)c(CCCO)c1 Amb33006488 [0,2,0,0,0,0|2,0,0]=4 12203 B13R1.558 N#Cc1ccc(Br)c(CCCS)c1 Amb33006805 [0,2,0,0,0,0|2,0,0]=4 12204 B13R1.558 N#Cc1ccc(Br)c(CCON)c1 Amb33006178 [0,2,0,0,0,0|2,0,0]=4 12205 B13R1.558 [C-]#[N+]CCc1cc(C#N)ccc1Br Amb33006156 [0,2,0,0,0,0|0,0,2]=4 12206 B13R1.558 [C-]#[N+]CCc1cc(OC)ccc1Br Amb33006630 [0,2,0,0,0,0|0,0,2]=4 12207 B11R1.214 C=Cn1cc(CCNC)cn1 Amb32727855 [0,0,1,1,0,0|2,0,0]=4 12208 B11R1.29 CNCCC(=O)c1ccco1 Amb25382971 [0,0,1,1,0,0|2,0,0]=4 12209 B11R1.29 CNCCC(=O)c1cccs1 Amb17334774 [0,0,1,1,0,0|2,0,0]=4 12210 B11R1.29 CNCCC(=O)c1cccs1 Amb22235115 [0,0,1,1,0,0|2,0,0]=4 12211 B11R1.4 CNCC\C=C\c1ccco1 Amb27987208 [0,0,1,1,0,0|1,0,0]=3 12212 B11R1.4 CNCC\C=C\c1cccs1 Amb27987212 [0,0,1,1,0,0|1,0,0]=3 12213 B11R1.4 CNCC\C=C\c1ccns1 Amb27671831 [0,0,1,1,0,0|2,0,0]=4 12214 B11R1.4 CNCC\C=C\c1ccoc1 Amb27987220 [0,0,1,1,0,0|2,0,0]=4 12215 B11R1.4 CNCC\C=C\c1ccsc1 Amb27987211 [0,0,1,1,0,0|2,0,0]=4 12216 B11R1.109 CCCn1cccc1\C=C\Br Amb33135114 [0,0,1,1,0,0|2,0,0]=4 12217 B11R2.10 BrC1Cc2ccccc2C1 Amb9675743 [1,0,0,1,0,0|2,0,0]=4 12218 B11R2.10 CC1=Cc2ccccc2C1 Amb15692403 [1,0,0,1,0,0|1,0,1]=4 12219 B11R2.10 CC1CC2=CC=CNC2=N1 Amb27668374 [1,0,0,1,0,0|2,0,0]=4 12220 B11R2.10 CC1CC2=CNC=CC2=N1 Amb27599020 [1,0,0,1,0,0|2,0,0]=4 12221 B11R2.10 CC1Cc2ccccc2C1 Amb20248354 [1,0,0,1,0,0|1,0,0]=3 12222 B11R2.10 CC1Cc2ccccc2N1 Amb9703084 [1,0,0,1,0,0|1,0,0]=3 12223 B11R2.10 CC1Cc2ccccc2O1 Amb6374258 [1,0,0,1,0,0|1,0,0]=3 12224 B11R2.10 CC1Cc2cccnc2C1 Amb27404234 [1,0,0,1,0,0|2,0,0]=4 12225 B11R2.10 CC1Cc2cnccc2N1 Amb26959428 [1,0,0,1,0,0|2,0,0]=4 12226 B11R2.10 CC1Nc2ccccc2N1 Amb27615032 [1,0,0,1,0,0|2,0,0]=4 12227 B11R2.10 CC1Nc2ccccc2S1 Amb27794283 [1,0,0,1,0,0|2,0,0]=4 12228 B11R2.10 CN1Cc2cccnc2C1 Amb24432669 [1,0,0,1,0,0|2,0,0]=4 12229 B11R2.10 CN1Sc2ccccc2S1 Amb26079681 [1,0,0,1,0,0|2,0,0]=4 12230 B11R2.10 C[C@@H]1Cc2ccccc2N1 Amb23439109 [1,0,0,1,0,0|1,0,0]=3 12231 B11R2.10 C[C@H]1Cc2ccccc2N1 Amb25294551 [1,0,0,1,0,0|1,0,0]=3 12232 B11R2.10 Cn1cc2ccccc2c1 Amb28313764 [1,0,0,1,0,0|1,0,1]=4 12233 B11R2.10 Cn1cc2ccccc2n1 Amb2609633 [1,0,0,1,0,0|1,0,1]=4 12234 B11R2.10 FC1Cc2ccccc2C1 Amb27751084 [1,0,0,1,0,0|2,0,0]=4 12235 B11R2.10 IC1Cc2ccccc2C1 Amb23401305 [1,0,0,1,0,0|2,0,0]=4 12236 B11R2.10 NC1Cc2ccccc2C1 Amb2182881 [1,0,0,1,0,0|1,0,0]=3 12237 B11R2.10 NC1Cc2ccccc2C1 Amb2720222 [1,0,0,1,0,0|1,0,0]=3 12238 B11R2.10 NC1Cc2ccccc2N1 Amb8397236 [1,0,0,1,0,0|1,0,0]=3 12239 B11R2.10 NC1Cc2cccnc2C1 Amb22831095 [1,0,0,1,0,0|2,0,0]=4 12240 B11R2.10 NC1Cc2cccnc2C1 Amb24105466 [1,0,0,1,0,0|2,0,0]=4 12241 B11R2.10 NC1Cc2ccncc2C1 Amb25936300 [1,0,0,1,0,0|2,0,0]=4 12242 B11R2.10 NC1Cc2ccncc2C1 Amb28895993 [1,0,0,1,0,0|2,0,0]=4 12243 B11R2.10 NN1Cc2ccccc2C1 Amb22586451 [1,0,0,1,0,0|2,0,0]=4 12244 B11R2.10 NN1Cc2ccccc2C1 Amb836832 [1,0,0,1,0,0|2,0,0]=4 12245 B11R2.10 OC1Cc2ccccc2C1 Amb3940105 [1,0,0,1,0,0|2,0,0]=4 12246 B11R2.10 OC1Cc2ccccc2O1 Amb27410400 [1,0,0,1,0,0|2,0,0]=4 12247 B11R2.10 SC1Cc2ccccc2C1 Amb9675741 [1,0,0,1,0,0|2,0,0]=4 12248 B11R2.10 [NH3+]C1Cc2ccccc2C1 Amb24113669 [1,0,0,1,0,0|1,0,1]=4 12249 B11R2.10 [NH3+]C1Cc2ccccc2C1 Amb6366004 [1,0,0,1,0,0|1,0,1]=4 12250 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [1,0,0,1,0,0|1,0,1]=4 12251 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [1,0,0,1,0,0|1,0,1]=4 12252 B11R2.20 C1=NCCc2ccccc21 Amb10603654 [1,0,0,1,0,0|1,0,1]=4 12253 B11R2.20 c1cc2c(cn1)CCCC2 Amb5399109 [1,0,0,1,0,0|2,0,0]=4 12254 B11R2.20 c1cc2c(cn1)CCCN2 Amb9174240 [1,0,0,1,0,0|2,0,0]=4 12255 B11R2.20 c1cc2c(cn1)CCCO2 Amb13889664 [1,0,0,1,0,0|2,0,0]=4 12256 B11R2.20 c1cc2c(cn1)CCNC2 Amb18124435 [1,0,0,1,0,0|2,0,0]=4 12257 B11R2.20 c1cc2c(cn1)CCNC2 Amb20075877 [1,0,0,1,0,0|2,0,0]=4 12258 B11R2.20 c1cc2c(cn1)CCNC2 Amb22752076 [1,0,0,1,0,0|2,0,0]=4 12259 B11R2.20 c1cc2c(cn1)CNCC2 Amb19958148 [1,0,0,1,0,0|2,0,0]=4 12260 B11R2.20 c1cc2c(cn1)CNCC2 Amb21858409 [1,0,0,1,0,0|2,0,0]=4 12261 B11R2.20 c1cc2c(cn1)CNCC2 Amb8011539 [1,0,0,1,0,0|2,0,0]=4 12262 B11R2.20 c1cc2c(cn1)NCCC2 Amb21864834 [1,0,0,1,0,0|2,0,0]=4 12263 B11R2.20 c1cc2c(cn1)OCCC2 Amb27618518 [1,0,0,1,0,0|2,0,0]=4 12264 B11R2.20 c1ccc2c(c1)CCCC2 Amb6608921 [1,0,0,1,0,0|1,0,0]=3 12265 B11R2.20 c1ccc2c(c1)CCCN2 Amb1869492 [1,0,0,1,0,0|1,0,0]=3 12266 B11R2.20 c1ccc2c(c1)CCCO2 Amb9677672 [1,0,0,1,0,0|1,0,0]=3 12267 B11R2.20 c1ccc2c(c1)CCNC2 Amb2383348 [1,0,0,1,0,0|1,0,0]=3 12268 B11R2.20 c1ccc2c(c1)CCNC2 Amb2720224 [1,0,0,1,0,0|1,0,0]=3 12269 B11R2.20 c1ccc2c(c1)CCNS2 Amb27421368 [1,0,0,1,0,0|1,0,0]=3 12270 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [1,0,0,1,0,0|2,0,0]=4 12271 B11R2.20 c1ccc2c(c1)CCSO2 Amb27965466 [1,0,0,1,0,0|2,0,0]=4 12272 B11R2.20 c1ccc2c(c1)CNCN2 Amb25147572 [1,0,0,1,0,0|1,0,0]=3 12273 B11R2.20 c1ccc2c(c1)CNNC2 Amb22497223 [1,0,0,1,0,0|2,0,0]=4 12274 B11R2.20 c1ccc2c(c1)CNNC2 Amb28985797 [1,0,0,1,0,0|2,0,0]=4 12275 B11R2.20 c1ccc2c(c1)CNNC2 Amb32661310 [1,0,0,1,0,0|2,0,0]=4 12276 B11R2.20 c1ccc2c(c1)CNOC2 Amb25997729 [1,0,0,1,0,0|2,0,0]=4 12277 B11R2.20 c1ccc2c(c1)CNOC2 Amb28555648 [1,0,0,1,0,0|2,0,0]=4 12278 B11R2.20 c1ccc2c(c1)CSCN2 Amb27412411 [1,0,0,1,0,0|2,0,0]=4 12279 B11R2.20 c1ccc2c(c1)NCCN2 Amb6537963 [1,0,0,1,0,0|2,0,0]=4 12280 B11R2.20 c1ccc2c(c1)NCCO2 Amb2371970 [1,0,0,1,0,0|2,0,0]=4 12281 B11R2.20 c1ccc2c(c1)NCCO2 Amb29844650 [1,0,0,1,0,0|2,0,0]=4 12282 B11R2.20 c1ccc2c(c1)NCCS2 Amb1104964 [1,0,0,1,0,0|2,0,0]=4 12283 B11R2.20 c1ccc2c(c1)OCCO2 Amb2722914 [1,0,0,1,0,0|2,0,0]=4 12284 B11R2.20 c1ccc2c(c1)OCCS2 Amb19374957 [1,0,0,1,0,0|2,0,0]=4 12285 B11R2.20 c1ccc2c(c1)SCCS2 Amb2781726 [1,0,0,1,0,0|2,0,0]=4 12286 B11R2.20 c1cnc2c(c1)CCCC2 Amb2390042 [1,0,0,1,0,0|2,0,0]=4 12287 B11R2.20 c1cnc2c(c1)CCCN2 Amb15692065 [1,0,0,1,0,0|2,0,0]=4 12288 B11R2.20 c1cnc2c(c1)CCCO2 Amb22753924 [1,0,0,1,0,0|2,0,0]=4 12289 B11R2.20 c1cnc2c(c1)CCCS2 Amb27442141 [1,0,0,1,0,0|2,0,0]=4 12290 B11R2.20 c1cnc2c(c1)CCNC2 Amb21858385 [1,0,0,1,0,0|2,0,0]=4 12291 B11R2.20 c1cnc2c(c1)CCNC2 Amb22436767 [1,0,0,1,0,0|2,0,0]=4 12292 B11R2.20 c1cnc2c(c1)CCNC2 Amb8011540 [1,0,0,1,0,0|2,0,0]=4 12293 B11R2.20 c1cnc2c(c1)CNCC2 Amb10608993 [1,0,0,1,0,0|2,0,0]=4 12294 B11R2.20 c1cnc2c(c1)CNCC2 Amb19373278 [1,0,0,1,0,0|2,0,0]=4 12295 B11R2.20 c1cnc2c(c1)CNCC2 Amb19958501 [1,0,0,1,0,0|2,0,0]=4 12296 B11R2.20 c1cnc2c(c1)CNCC2 Amb22002369 [1,0,0,1,0,0|2,0,0]=4 12297 B11R2.20 c1cnc2c(c1)CNCC2 Amb6892842 [1,0,0,1,0,0|2,0,0]=4 12298 B11R2.20 c1cnc2c(c1)NCCC2 Amb488375 [1,0,0,1,0,0|2,0,0]=4 12299 B11R2.20 c1cnc2c(c1)OCCC2 Amb13889663 [1,0,0,1,0,0|2,0,0]=4 12300 B11R2.55 Brc1ccccc1C2CC2 Amb13884115 [1,0,0,1,0,0|0,0,0]=2 12301 B11R2.55 Brc1ccccc1C2CN2 Amb18224967 [1,0,0,1,0,0|0,0,0]=2 12302 B11R2.55 Brc1ccccc1C2CO2 Amb1125957 [1,0,0,1,0,0|1,0,0]=3 12303 B11R2.55 Brc1ccccc1[C@@H]2CO2 Amb27424858 [1,0,0,1,0,0|1,0,0]=3 12304 B11R2.55 Brc1ccccc1[C@H]2CO2 Amb27254540 [1,0,0,1,0,0|1,0,0]=3 12305 B11R2.55 Brc1cccnc1C2CC2 Amb22494600 [1,0,0,1,0,0|1,0,0]=3 12306 B11R2.55 Brc1cccnc1C2CO2 Amb23586100 [1,0,0,1,0,0|2,0,0]=4 12307 B11R2.55 Brc1cccnc1[C@@H]2CO2 Amb33336442 [1,0,0,1,0,0|2,0,0]=4 12308 B11R2.55 Brc1cccnc1[C@H]2CO2 Amb33336440 [1,0,0,1,0,0|2,0,0]=4 12309 B11R2.55 Brc1ccncc1C2CC2 Amb20617493 [1,0,0,1,0,0|1,0,0]=3 12310 B11R2.55 Brc1cnccc1C2CC2 Amb24320561 [1,0,0,1,0,0|1,0,0]=3 12311 B11R2.55 Brc1cnccc1C2CO2 Amb26338193 [1,0,0,1,0,0|2,0,0]=4 12312 B11R2.55 Brc1cnccc1[C@@H]2CO2 Amb33388934 [1,0,0,1,0,0|2,0,0]=4 12313 B11R2.55 Brc1cnccc1[C@H]2CO2 Amb33388992 [1,0,0,1,0,0|2,0,0]=4 12314 B11R2.55 Brc1cncnc1C2CC2 Amb18142755 [1,0,0,1,0,0|2,0,0]=4 12315 B11R2.55 Brc1cnncc1C2CC2 Amb18187819 [1,0,0,1,0,0|2,0,0]=4 12316 B11R2.55 Brc1ncccc1C2CO2 Amb23586098 [1,0,0,1,0,0|2,0,0]=4 12317 B11R2.55 Brc1ncccc1[C@@H]2CO2 Amb33388158 [1,0,0,1,0,0|2,0,0]=4 12318 B11R2.55 Brc1ncccc1[C@H]2CO2 Amb33388161 [1,0,0,1,0,0|2,0,0]=4 12319 B11R2.55 Brc1nccnc1C2CC2 Amb35598364 [1,0,0,1,0,0|2,0,0]=4 12320 B11R2.55 Cc1ccccc1C2CC2 Amb9769895 [1,0,0,1,0,0|1,0,0]=3 12321 B11R2.55 Cc1ccccc1C2CN2 Amb18222812 [1,0,0,1,0,0|1,0,0]=3 12322 B11R2.55 Cc1ccccc1C2CO2 Amb1140946 [1,0,0,1,0,0|2,0,0]=4 12323 B11R2.55 Cc1ccccc1[C@@H]2CO2 Amb26498851 [1,0,0,1,0,0|2,0,0]=4 12324 B11R2.55 Cc1ccccc1[C@H]2CO2 Amb24478493 [1,0,0,1,0,0|2,0,0]=4 12325 B11R2.55 Cc1ccncc1C2CC2 Amb22235727 [1,0,0,1,0,0|2,0,0]=4 12326 B11R2.55 Cc1ncccc1C2CC2 Amb22276237 [1,0,0,1,0,0|2,0,0]=4 12327 B11R2.55 Clc1ccccc1C2CC2 Amb22737226 [1,0,0,1,0,0|0,1,0]=3 12328 B11R2.55 Clc1ccccc1C2CN2 Amb18224351 [1,0,0,1,0,0|0,1,0]=3 12329 B11R2.55 Clc1ccccc1C2CO2 Amb1136428 [1,0,0,1,0,0|1,1,0]=4 12330 B11R2.55 Clc1ccccc1[C@@H]2CO2 Amb27470320 [1,0,0,1,0,0|1,1,0]=4 12331 B11R2.55 Clc1ccccc1[C@H]2CO2 Amb26405300 [1,0,0,1,0,0|1,1,0]=4 12332 B11R2.55 Clc1cccnc1C2CC2 Amb23401490 [1,0,0,1,0,0|1,1,0]=4 12333 B11R2.55 Clc1ccncc1C2CC2 Amb22276374 [1,0,0,1,0,0|1,1,0]=4 12334 B11R2.55 Clc1ccncc1C2CC2 Amb30634197 [1,0,0,1,0,0|1,1,0]=4 12335 B11R2.55 Clc1cnccc1C2CC2 Amb27263877 [1,0,0,1,0,0|1,1,0]=4 12336 B11R2.55 Fc1ccccc1C2CC2 Amb27432397 [1,0,0,1,0,0|0,1,0]=3 12337 B11R2.55 Fc1ccccc1C2CN2 Amb18222139 [1,0,0,1,0,0|0,1,0]=3 12338 B11R2.55 Fc1ccccc1C2CO2 Amb9707103 [1,0,0,1,0,0|1,1,0]=4 12339 B11R2.55 Fc1ccccc1[C@@H]2CO2 Amb26642147 [1,0,0,1,0,0|1,1,0]=4 12340 B11R2.55 Fc1ccccc1[C@H]2CO2 Amb25859332 [1,0,0,1,0,0|1,1,0]=4 12341 B11R2.55 Fc1ncccc1C2CC2 Amb22276397 [1,0,0,1,0,0|1,1,0]=4 12342 B11R2.55 Ic1ccccc1C2CC2 Amb22900094 [1,0,0,1,0,0|0,1,0]=3 12343 B11R2.55 Ic1ccccc1C2CO2 Amb27869435 [1,0,0,1,0,0|1,1,0]=4 12344 B11R2.55 Ic1cnccc1C2CC2 Amb28136751 [1,0,0,1,0,0|1,1,0]=4 12345 B11R2.55 Nc1ccccc1C2CC2 Amb1933788 [1,0,0,1,0,0|1,0,0]=3 12346 B11R2.55 Nc1ccccc1C2CC2 Amb4302533 [1,0,0,1,0,0|1,0,0]=3 12347 B11R2.55 Nc1cccnc1C2CC2 Amb33552862 [1,0,0,1,0,0|2,0,0]=4 12348 B11R2.55 Nc1ccncc1C2CC2 Amb22276361 [1,0,0,1,0,0|2,0,0]=4 12349 B11R2.55 Nc1cnccc1C2CC2 Amb22737113 [1,0,0,1,0,0|2,0,0]=4 12350 B11R2.55 Nc1ncccc1C2CC2 Amb22276264 [1,0,0,1,0,0|2,0,0]=4 12351 B11R2.55 O=C1NC=CC=C1C2CC2 Amb22276350 [1,0,0,1,0,0|2,0,0]=4 12352 B11R2.55 Oc1ccccc1C2CC2 Amb9769894 [1,0,0,1,0,0|1,0,0]=3 12353 B11R2.55 Oc1ccccc1C2CO2 Amb22055488 [1,0,0,1,0,0|2,0,0]=4 12354 B11R2.55 Oc1ccncc1C2CC2 Amb33189018 [1,0,0,1,0,0|2,0,0]=4 12355 B11R2.55 Sc1ccccc1C2CC2 Amb25293886 [1,0,0,1,0,0|1,0,0]=3 12356 B11R2.55 [O-][n+]1ccccc1C2CC2 Amb28066762 [1,0,0,1,0,0|2,0,0]=4 12357 B11R2.104 NC1Cc2c(O)cccc21 Amb27186102 [1,0,0,1,0,0|1,0,0]=3 12358 B11R2.106 BrC1=CNC=C2CCN=C12 Amb28049441 [1,0,0,1,0,0|2,0,0]=4 12359 B11R2.106 Brc1cccc2c1CC=C2 Amb20247104 [1,0,0,1,0,0|0,0,2]=4 12360 B11R2.106 Brc1cccc2c1CCC2 Amb18812699 [1,0,0,1,0,0|0,0,0]=2 12361 B11R2.106 Brc1cccc2c1CCN2 Amb18048701 [1,0,0,1,0,0|0,0,0]=2 12362 B11R2.106 Brc1cccc2c1CCN2 Amb2383418 [1,0,0,1,0,0|0,0,0]=2 12363 B11R2.106 Brc1cccc2c1CCO2 Amb22054550 [1,0,0,1,0,0|1,0,0]=3 12364 B11R2.106 Brc1cccc2c1CNC2 Amb10067202 [1,0,0,1,0,0|0,0,0]=2 12365 B11R2.106 Brc1cccc2c1CNC2 Amb19515794 [1,0,0,1,0,0|0,0,0]=2 12366 B11R2.106 Brc1cccc2c1COC2 Amb28073852 [1,0,0,1,0,0|1,0,0]=3 12367 B11R2.106 Brc1cccc2c1NCC2 Amb1128232 [1,0,0,1,0,0|1,0,0]=3 12368 B11R2.106 Brc1cccc2c1NCC2 Amb22498225 [1,0,0,1,0,0|1,0,0]=3 12369 B11R2.106 Brc1cccc2c1OCC2 Amb18187519 [1,0,0,1,0,0|1,0,0]=3 12370 B11R2.106 Brc1cccc2c1OCO2 Amb33548833 [1,0,0,1,0,0|2,0,0]=4 12371 B11R2.106 Brc1cccc2c1SCC2 Amb18770997 [1,0,0,1,0,0|1,0,0]=3 12372 B11R2.106 Brc1ccnc2c1CCC2 Amb22500462 [1,0,0,1,0,0|1,0,0]=3 12373 B11R2.106 Brc1ccnc2c1CCN2 Amb24183367 [1,0,0,1,0,0|1,0,0]=3 12374 B11R2.106 Brc1ccnc2c1CCO2 Amb28280837 [1,0,0,1,0,0|2,0,0]=4 12375 B11R2.106 Brc1ccnc2c1CNC2 Amb27478784 [1,0,0,1,0,0|1,0,0]=3 12376 B11R2.106 Brc1ccnc2c1NCC2 Amb24449511 [1,0,0,1,0,0|2,0,0]=4 12377 B11R2.106 Brc1cncc2c1CCN2 Amb26527671 [1,0,0,1,0,0|1,0,0]=3 12378 B11R2.106 Brc1cncc2c1CNC2 Amb27478519 [1,0,0,1,0,0|1,0,0]=3 12379 B11R2.106 Brc1cncc2c1NCC2 Amb23440182 [1,0,0,1,0,0|2,0,0]=4 12380 B11R2.106 Cc1cccc2c1CCC2 Amb17231881 [1,0,0,1,0,0|1,0,0]=3 12381 B11R2.106 Cc1cccc2c1CCN2 Amb21857789 [1,0,0,1,0,0|1,0,0]=3 12382 B11R2.106 Cc1cccc2c1CCN2 Amb2383422 [1,0,0,1,0,0|1,0,0]=3 12383 B11R2.106 Cc1cccc2c1CNC2 Amb23403689 [1,0,0,1,0,0|1,0,0]=3 12384 B11R2.106 Cc1cccc2c1CNC2 Amb32412173 [1,0,0,1,0,0|1,0,0]=3 12385 B11R2.106 Cc1cccc2c1CNC2 Amb9783181 [1,0,0,1,0,0|1,0,0]=3 12386 B11R2.106 Cc1cccc2c1NCC2 Amb1108032 [1,0,0,1,0,0|2,0,0]=4 12387 B11R2.106 Cc1cccc2c1NCC2 Amb33551674 [1,0,0,1,0,0|2,0,0]=4 12388 B11R2.106 Cc1ccnc2c1CNC2 Amb22276546 [1,0,0,1,0,0|2,0,0]=4 12389 B11R2.106 Cc1ccnc2c1CNC2 Amb35751895 [1,0,0,1,0,0|2,0,0]=4 12390 B11R2.106 Cc1cncc2c1CNC2 Amb18203139 [1,0,0,1,0,0|2,0,0]=4 12391 B11R2.106 Cc1nccc2c1CCC2 Amb27589775 [1,0,0,1,0,0|2,0,0]=4 12392 B11R2.106 Cc1nccc2c1CNC2 Amb18203141 [1,0,0,1,0,0|2,0,0]=4 12393 B11R2.106 Clc1cccc2c1CCC2 Amb17232112 [1,0,0,1,0,0|0,1,0]=3 12394 B11R2.106 Clc1cccc2c1CCN2 Amb20630553 [1,0,0,1,0,0|0,1,0]=3 12395 B11R2.106 Clc1cccc2c1CCN2 Amb2383416 [1,0,0,1,0,0|0,1,0]=3 12396 B11R2.106 Clc1cccc2c1CCO2 Amb8389512 [1,0,0,1,0,0|1,1,0]=4 12397 B11R2.106 Clc1cccc2c1CNC2 Amb15690753 [1,0,0,1,0,0|0,1,0]=3 12398 B11R2.106 Clc1cccc2c1CNC2 Amb18831049 [1,0,0,1,0,0|0,1,0]=3 12399 B11R2.106 Clc1cccc2c1NCC2 Amb10199852 [1,0,0,1,0,0|1,1,0]=4 12400 B11R2.106 Clc1cccc2c1NCC2 Amb1107936 [1,0,0,1,0,0|1,1,0]=4 12401 B11R2.106 Clc1cccc2c1OCC2 Amb20620687 [1,0,0,1,0,0|1,1,0]=4 12402 B11R2.106 Clc1ccnc2c1CCC2 Amb19957876 [1,0,0,1,0,0|1,1,0]=4 12403 B11R2.106 Clc1ccnc2c1CCN2 Amb25980973 [1,0,0,1,0,0|1,1,0]=4 12404 B11R2.106 Clc1ccnc2c1CCN2 Amb30633723 [1,0,0,1,0,0|1,1,0]=4 12405 B11R2.106 Clc1ccnc2c1CNC2 Amb24087639 [1,0,0,1,0,0|1,1,0]=4 12406 B11R2.106 Clc1ccnc2c1CNC2 Amb24577957 [1,0,0,1,0,0|1,1,0]=4 12407 B11R2.106 Clc1ccnc2c1CNC2 Amb33338858 [1,0,0,1,0,0|1,1,0]=4 12408 B11R2.106 Clc1cncc2c1CCN2 Amb18200565 [1,0,0,1,0,0|1,1,0]=4 12409 B11R2.106 Clc1cncc2c1CNC2 Amb27642393 [1,0,0,1,0,0|1,1,0]=4 12410 B11R2.106 Clc1nccc2c1CCN2 Amb20241664 [1,0,0,1,0,0|1,1,0]=4 12411 B11R2.106 Clc1nccc2c1CCN2 Amb21960889 [1,0,0,1,0,0|1,1,0]=4 12412 B11R2.106 Fc1cccc2c1CCC2 Amb17231895 [1,0,0,1,0,0|0,1,0]=3 12413 B11R2.106 Fc1cccc2c1CCN2 Amb10602729 [1,0,0,1,0,0|0,1,0]=3 12414 B11R2.106 Fc1cccc2c1CCN2 Amb2383417 [1,0,0,1,0,0|0,1,0]=3 12415 B11R2.106 Fc1cccc2c1CNC2 Amb15690752 [1,0,0,1,0,0|0,1,0]=3 12416 B11R2.106 Fc1cccc2c1CNC2 Amb8011543 [1,0,0,1,0,0|0,1,0]=3 12417 B11R2.106 Fc1cccc2c1NCC2 Amb1108731 [1,0,0,1,0,0|1,1,0]=4 12418 B11R2.106 Fc1cccc2c1NCC2 Amb22500604 [1,0,0,1,0,0|1,1,0]=4 12419 B11R2.106 Fc1cccc2c1NCN2 Amb27190714 [1,0,0,1,0,0|1,1,0]=4 12420 B11R2.106 Fc1cccc2c1OCC2 Amb23399921 [1,0,0,1,0,0|1,1,0]=4 12421 B11R2.106 Fc1cncc2c1CCN2 Amb27240162 [1,0,0,1,0,0|1,1,0]=4 12422 B11R2.106 Ic1cccc2c1CCC2 Amb22494907 [1,0,0,1,0,0|0,1,0]=3 12423 B11R2.106 Ic1cccc2c1CCN2 Amb2383424 [1,0,0,1,0,0|0,1,0]=3 12424 B11R2.106 Ic1cccc2c1CCO2 Amb23399919 [1,0,0,1,0,0|1,1,0]=4 12425 B11R2.106 Ic1cccc2c1CNC2 Amb27242966 [1,0,0,1,0,0|0,1,0]=3 12426 B11R2.106 Ic1cccc2c1OCC2 Amb7990028 [1,0,0,1,0,0|1,1,0]=4 12427 B11R2.106 Ic1ccnc2c1CCC2 Amb27836857 [1,0,0,1,0,0|1,1,0]=4 12428 B11R2.106 Ic1ccnc2c1CCN2 Amb25229555 [1,0,0,1,0,0|1,1,0]=4 12429 B11R2.106 Nc1cccc2c1CCC2 Amb10068703 [1,0,0,1,0,0|1,0,0]=3 12430 B11R2.106 Nc1cccc2c1CCC2 Amb33456125 [1,0,0,1,0,0|1,0,0]=3 12431 B11R2.106 Nc1cccc2c1CCN2 Amb17569955 [1,0,0,1,0,0|1,0,0]=3 12432 B11R2.106 Nc1cccc2c1CCO2 Amb16233744 [1,0,0,1,0,0|2,0,0]=4 12433 B11R2.106 Nc1cccc2c1CNC2 Amb10067193 [1,0,0,1,0,0|1,0,0]=3 12434 B11R2.106 Nc1cccc2c1CNC2 Amb20241528 [1,0,0,1,0,0|1,0,0]=3 12435 B11R2.106 Nc1cccc2c1COC2 Amb18124450 [1,0,0,1,0,0|2,0,0]=4 12436 B11R2.106 Nc1cccc2c1NCC2 Amb17569956 [1,0,0,1,0,0|2,0,0]=4 12437 B11R2.106 Nc1cccc2c1NCC2 Amb22752813 [1,0,0,1,0,0|2,0,0]=4 12438 B11R2.106 Nc1cccc2c1OCC2 Amb7990030 [1,0,0,1,0,0|2,0,0]=4 12439 B11R2.106 Nc1cccc2c1SCC2 Amb18831218 [1,0,0,1,0,0|2,0,0]=4 12440 B11R2.106 Nc1cccc2c1SCN2 Amb27273023 [1,0,0,1,0,0|2,0,0]=4 12441 B11R2.106 Nc1ccnc2c1CCC2 Amb21864970 [1,0,0,1,0,0|2,0,0]=4 12442 B11R2.106 Nc1cncc2c1CCC2 Amb26424742 [1,0,0,1,0,0|2,0,0]=4 12443 B11R2.106 Nc1cncc2c1CNC2 Amb22491551 [1,0,0,1,0,0|2,0,0]=4 12444 B11R2.106 O=C1C=CC=C2CCCN12 Amb27483026 [1,0,0,1,0,0|2,0,0]=4 12445 B11R2.106 O=C1C=CC=C2NCCN12 Amb20171620 [1,0,0,1,0,0|2,0,0]=4 12446 B11R2.106 O=C1NC=CC2=C1CCN2 Amb24696478 [1,0,0,1,0,0|2,0,0]=4 12447 B11R2.106 O=c1cccc2n1CCN2 Amb22228272 [1,0,0,1,0,0|2,0,0]=4 12448 B11R2.106 Oc1cccc2c1CCC2 Amb10844833 [1,0,0,1,0,0|1,0,0]=3 12449 B11R2.106 Oc1cccc2c1CCN2 Amb18124453 [1,0,0,1,0,0|1,0,0]=3 12450 B11R2.106 Oc1cccc2c1CCN2 Amb33552627 [1,0,0,1,0,0|1,0,0]=3 12451 B11R2.106 Oc1cccc2c1CCO2 Amb26621958 [1,0,0,1,0,0|2,0,0]=4 12452 B11R2.106 Oc1cccc2c1CCS2 Amb18644525 [1,0,0,1,0,0|2,0,0]=4 12453 B11R2.106 Oc1cccc2c1CNC2 Amb20241438 [1,0,0,1,0,0|1,0,0]=3 12454 B11R2.106 Oc1cccc2c1CNC2 Amb25324336 [1,0,0,1,0,0|1,0,0]=3 12455 B11R2.106 Oc1cccc2c1OCC2 Amb22264532 [1,0,0,1,0,0|2,0,0]=4 12456 B11R2.106 Oc1cccc2c1SCC2 Amb18644528 [1,0,0,1,0,0|2,0,0]=4 12457 B11R2.106 Oc1ccnc2c1CCN2 Amb24183701 [1,0,0,1,0,0|2,0,0]=4 12458 B11R2.106 Oc1nccc2c1CCN2 Amb31031200 [1,0,0,1,0,0|2,0,0]=4 12459 B11R2.106 Sc1cccc2c1CCC2 Amb33145452 [1,0,0,1,0,0|1,0,0]=3 12460 B11R2.106 Sc1cccc2c1OCC2 Amb33416983 [1,0,0,1,0,0|2,0,0]=4 12461 B11R2.106 Sc1ccnc2c1CCC2 Amb27857483 [1,0,0,1,0,0|2,0,0]=4 12462 B11R2.106 [O-][n+]1cccc2c1CCC2 Amb20668418 [1,0,0,1,0,0|2,0,0]=4 12463 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [1,0,0,1,0,0|1,0,1]=4 12464 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [1,0,0,1,0,0|1,0,0]=3 12465 B11R2.988 CNC1Cc2ccccc21 Amb28315966 [1,0,0,1,0,0|1,0,0]=3 12466 B11R2.988 COC1Cc2ccccc21 Amb24455687 [1,0,0,1,0,0|2,0,0]=4 12467 B11R2.988 NCC1Cc2ccccc21 Amb10609227 [1,0,0,1,0,0|1,0,0]=3 12468 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [1,0,0,1,0,0|2,0,0]=4 12469 B11R2.988 SCC1Cc2ccccc21 Amb27866792 [1,0,0,1,0,0|2,0,0]=4 12470 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [1,0,0,1,0,0|2,0,0]=4 12471 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [1,0,0,1,0,0|1,0,1]=4 12472 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [1,0,0,1,0,0|1,0,1]=4 12473 B11R2.1 CC1CCc2ccccc21 Amb28050187 [1,0,0,1,0,0|1,0,0]=3 12474 B11R2.1 CC1CCc2cccnc21 Amb28050279 [1,0,0,1,0,0|2,0,0]=4 12475 B11R2.1 CC1CNc2ccccc21 Amb20241016 [1,0,0,1,0,0|2,0,0]=4 12476 B11R2.1 CC1CNc2ccccc21 Amb9197981 [1,0,0,1,0,0|2,0,0]=4 12477 B11R2.1 CC1COc2ccccc21 Amb27617216 [1,0,0,1,0,0|2,0,0]=4 12478 B11R2.1 CC1NCc2ccccc21 Amb20623497 [1,0,0,1,0,0|2,0,0]=4 12479 B11R2.1 CC1NCc2ccccc21 Amb32751285 [1,0,0,1,0,0|2,0,0]=4 12480 B11R2.1 CC1OCc2ccccc21 Amb25913589 [1,0,0,1,0,0|2,0,0]=4 12481 B11R2.1 CN1CCc2ccccc21 Amb15691717 [1,0,0,1,0,0|0,0,0]=2 12482 B11R2.1 CN1CCc2cccnc21 Amb28434380 [1,0,0,1,0,0|1,0,0]=3 12483 B11R2.1 CN1CCc2cnccc21 Amb25836379 [1,0,0,1,0,0|1,0,0]=3 12484 B11R2.1 CN1CCc2cnncc21 Amb2609876 [1,0,0,1,0,0|2,0,0]=4 12485 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [1,0,0,1,0,0|2,0,0]=4 12486 B11R2.1 C[C@@H]1NCc2ccccc21 Amb32668091 [1,0,0,1,0,0|2,0,0]=4 12487 B11R2.1 C[C@H]1CNc2ccccc21 Amb27222357 [1,0,0,1,0,0|2,0,0]=4 12488 B11R2.1 C[C@H]1NCc2ccccc21 Amb28206726 [1,0,0,1,0,0|2,0,0]=4 12489 B11R2.1 C[C@H]1NCc2ccccc21 Amb32667894 [1,0,0,1,0,0|2,0,0]=4 12490 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [1,0,0,1,0,0|2,0,0]=4 12491 B11R2.1 Cn1ccc2ccccc21 Amb6297777 [1,0,0,1,0,0|0,0,2]=4 12492 B11R2.1 Cn1cnc2ccccc21 Amb6364694 [1,0,0,1,0,0|1,0,1]=4 12493 B11R2.1 Cn1ncc2ccccc21 Amb4009871 [1,0,0,1,0,0|1,0,1]=4 12494 B11R2.1 Cn1nnc2ccccc21 Amb4009873 [1,0,0,1,0,0|2,0,0]=4 12495 B11R2.1 NC1CCc2ccccc21 Amb1158023 [1,0,0,1,0,0|2,0,0]=4 12496 B11R2.1 NC1CCc2ccccc21 Amb16233857 [1,0,0,1,0,0|2,0,0]=4 12497 B11R2.1 NC1CCc2ccccc21 Amb24078253 [1,0,0,1,0,0|2,0,0]=4 12498 B11R2.1 NC1CCc2ccccc21 Amb9677422 [1,0,0,1,0,0|2,0,0]=4 12499 B11R2.1 NN1CCc2ccccc21 Amb2691266 [1,0,0,1,0,0|1,0,0]=3 12500 B11R2.1 NN1CCc2ccccc21 Amb836793 [1,0,0,1,0,0|1,0,0]=3 12501 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [1,0,0,1,0,0|2,0,0]=4 12502 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [1,0,0,1,0,0|2,0,0]=4 12503 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [1,0,0,1,0,0|2,0,0]=4 12504 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [1,0,0,1,0,0|2,0,0]=4 12505 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [1,0,0,1,0,0|2,0,0]=4 12506 B11R2.1 OC1CCc2ccccc21 Amb9703194 [1,0,0,1,0,0|2,0,0]=4 12507 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [1,0,0,1,0,0|2,0,0]=4 12508 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [1,0,0,1,0,0|2,0,0]=4 12509 B11R2.1 SC1CCc2ccccc21 Amb9208023 [1,0,0,1,0,0|2,0,0]=4 12510 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [1,0,0,1,0,0|2,0,0]=4 12511 B11R2.4 BrC1C[C@H]1c2ccccc2 Amb27392259 [1,0,0,1,0,0|2,0,0]=4 12512 B11R2.4 Br[C@@H]1C[C@@H]1c2ccccc2 Amb28383883 [1,0,0,1,0,0|2,0,0]=4 12513 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [1,0,0,1,0,0|2,0,0]=4 12514 B11R2.4 CC1CC1c2ccncc2 Amb2694644 [1,0,0,1,0,0|2,0,0]=4 12515 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [1,0,0,1,0,0|2,0,0]=4 12516 B11R2.4 CN1C[C@@H]1c2ccccc2 Amb33621244 [1,0,0,1,0,0|0,0,0]=2 12517 B11R2.4 CN1C[C@H]1c2ccccc2 Amb33621243 [1,0,0,1,0,0|0,0,0]=2 12518 B11R2.4 CN1OC1c2ccccn2 Amb24586710 [1,0,0,1,0,0|2,0,0]=4 12519 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [1,0,0,1,0,0|2,0,0]=4 12520 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [1,0,0,1,0,0|2,0,0]=4 12521 B11R2.4 Cl[C@H]1C[C@@H]1c2ccccc2 Amb28142329 [1,0,0,1,0,0|2,0,0]=4 12522 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [1,0,0,1,0,0|2,0,0]=4 12523 B11R2.4 NC1CC1c2ccccc2 Amb33548983 [1,0,0,1,0,0|2,0,0]=4 12524 B11R2.4 NC1CC1c2ccccc2 Amb9284785 [1,0,0,1,0,0|2,0,0]=4 12525 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [1,0,0,1,0,0|1,0,0]=3 12526 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [1,0,0,1,0,0|2,0,0]=4 12527 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [1,0,0,1,0,0|2,0,0]=4 12528 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [1,0,0,1,0,0|2,0,0]=4 12529 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [1,0,0,1,0,0|2,0,0]=4 12530 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb2720223 [1,0,0,1,0,0|2,0,0]=4 12531 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb8387302 [1,0,0,1,0,0|2,0,0]=4 12532 B11R2.4 N[C@H]1CC1c2ccccc2 Amb34916480 [1,0,0,1,0,0|2,0,0]=4 12533 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [1,0,0,1,0,0|2,0,0]=4 12534 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb597420 [1,0,0,1,0,0|2,0,0]=4 12535 B11R2.4 N[C@H]1C[C@H]1c2ccccc2 Amb33806281 [1,0,0,1,0,0|2,0,0]=4 12536 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [1,0,0,1,0,0|2,0,0]=4 12537 B11R2.4 O[C@@H]1C[C@@H]1c2ccccc2 Amb27486613 [1,0,0,1,0,0|2,0,0]=4 12538 B11R2.4 O[C@H]1C[C@H]1c2ccccc2 Amb27972540 [1,0,0,1,0,0|2,0,0]=4 12539 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [1,0,0,1,0,0|1,0,1]=4 12540 B11R2.238 c1cc(CC2CC2)ccn1 Amb28050219 [1,0,0,1,0,0|2,0,0]=4 12541 B11R2.238 c1cc(CC2CO2)ccn1 Amb24677560 [1,0,0,1,0,0|2,0,0]=4 12542 B11R2.238 c1ccc(CC2CC2)cc1 Amb22490220 [1,0,0,1,0,0|1,0,0]=3 12543 B11R2.238 c1ccc(CC2CO2)cc1 Amb3940775 [1,0,0,1,0,0|1,0,0]=3 12544 B11R2.238 c1ccc(CC2CO2)nc1 Amb24649901 [1,0,0,1,0,0|2,0,0]=4 12545 B11R2.238 c1ccc(C[C@@H]2CO2)cc1 Amb25916397 [1,0,0,1,0,0|1,0,0]=3 12546 B11R2.238 c1ccc(C[C@H]2CN2)cc1 Amb15690958 [1,0,0,1,0,0|0,0,0]=2 12547 B11R2.238 c1ccc(C[C@H]2CO2)cc1 Amb27150158 [1,0,0,1,0,0|1,0,0]=3 12548 B11R2.238 c1ccc(NC2CC2)cc1 Amb18270529 [1,0,0,1,0,0|2,0,0]=4 12549 B11R2.238 c1ccc(NC2CC2)cc1 Amb32663098 [1,0,0,1,0,0|2,0,0]=4 12550 B11R2.238 c1ccc(SC2CC2)cc1 Amb8514420 [1,0,0,1,0,0|2,0,0]=4 12551 B11R2.238 c1cncc(CC2CO2)c1 Amb28397057 [1,0,0,1,0,0|2,0,0]=4 12552 B11R2.239 c1cc(C2CCC2)ccn1 Amb22898826 [1,0,0,1,0,0|2,0,0]=4 12553 B11R2.239 c1cc(C2CNC2)ccn1 Amb19516821 [1,0,0,1,0,0|1,0,0]=3 12554 B11R2.239 c1cc(C2CNC2)ccn1 Amb20620350 [1,0,0,1,0,0|1,0,0]=3 12555 B11R2.239 c1cc(C2CNC2)ncn1 Amb23401381 [1,0,0,1,0,0|2,0,0]=4 12556 B11R2.239 c1cc(C2CNC2)ncn1 Amb26509224 [1,0,0,1,0,0|2,0,0]=4 12557 B11R2.239 c1cc(C2CNC2)ncn1 Amb28990041 [1,0,0,1,0,0|2,0,0]=4 12558 B11R2.239 c1cc(C2COC2)ccn1 Amb27623779 [1,0,0,1,0,0|2,0,0]=4 12559 B11R2.239 c1ccc(C2CCC2)cc1 Amb27466141 [1,0,0,1,0,0|1,0,0]=3 12560 B11R2.239 c1ccc(C2CCC2)nc1 Amb27796341 [1,0,0,1,0,0|2,0,0]=4 12561 B11R2.239 c1ccc(C2CCN2)cc1 Amb34912959 [1,0,0,1,0,0|2,0,0]=4 12562 B11R2.239 c1ccc(C2CCN2)cc1 Amb6893889 [1,0,0,1,0,0|2,0,0]=4 12563 B11R2.239 c1ccc(C2CCS2)cc1 Amb27839415 [1,0,0,1,0,0|2,0,0]=4 12564 B11R2.239 c1ccc(C2CNC2)cc1 Amb10603719 [1,0,0,1,0,0|0,0,0]=2 12565 B11R2.239 c1ccc(C2CNC2)cc1 Amb4124710 [1,0,0,1,0,0|0,0,0]=2 12566 B11R2.239 c1ccc(C2CNC2)nc1 Amb15695195 [1,0,0,1,0,0|1,0,0]=3 12567 B11R2.239 c1ccc(C2CNC2)nc1 Amb19516701 [1,0,0,1,0,0|1,0,0]=3 12568 B11R2.239 c1ccc(C2CNC2)nc1 Amb32410214 [1,0,0,1,0,0|1,0,0]=3 12569 B11R2.239 c1ccc(C2COC2)nc1 Amb24100566 [1,0,0,1,0,0|2,0,0]=4 12570 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [1,0,0,1,0,0|2,0,0]=4 12571 B11R2.239 c1ccc([C@H]2CCN2)cc1 Amb27874787 [1,0,0,1,0,0|2,0,0]=4 12572 B11R2.239 c1cnc(C2CNC2)cn1 Amb26946675 [1,0,0,1,0,0|2,0,0]=4 12573 B11R2.239 c1cnc(C2CNC2)nc1 Amb25935062 [1,0,0,1,0,0|2,0,0]=4 12574 B11R2.239 c1cnc(C2CNC2)nc1 Amb30868005 [1,0,0,1,0,0|2,0,0]=4 12575 B11R2.239 c1cnc(C2CNC2)nc1 Amb32412175 [1,0,0,1,0,0|2,0,0]=4 12576 B11R2.239 c1cncc(C2CNC2)c1 Amb19516797 [1,0,0,1,0,0|1,0,0]=3 12577 B11R2.239 c1cncc(C2CNC2)c1 Amb20620349 [1,0,0,1,0,0|1,0,0]=3 12578 B11R2.239 c1cncc(C2CNC2)c1 Amb32410212 [1,0,0,1,0,0|1,0,0]=3 12579 B11R2.239 c1ncc(C2CNC2)cn1 Amb26369795 [1,0,0,1,0,0|2,0,0]=4 12580 B11R2.239 c1ncc(C2CNC2)cn1 Amb34931999 [1,0,0,1,0,0|2,0,0]=4 12581 B11R2.18 c1cc2c(o1)CCNCC2 Amb18832361 [0,0,0,1,1,0|2,0,0]=4 12582 B11R2.18 c1cc2c(s1)CCNCC2 Amb18831055 [0,0,0,1,1,0|2,0,0]=4 12583 B11R2.36 CN1C=C2C=CC=C2CC1 Amb27445244 [0,0,0,1,1,0|1,0,0]=3 12584 B11R2.36 CN1CCc2ccsc2C1 Amb25706732 [0,0,0,1,1,0|2,0,0]=4 12585 B11R2.36 CN1CCc2sccc2C1 Amb24071584 [0,0,0,1,1,0|2,0,0]=4 12586 B11R2.115 Brc1ccsc1CC2CO2 Amb25274664 [0,0,0,1,1,0|2,0,0]=4 12587 B11R2.459 Brc1ccsc1C2CNC2 Amb25047446 [0,0,0,1,1,0|1,0,0]=3 12588 B11R2.459 Brc1occc1C2CCC2 Amb13884536 [0,0,0,1,1,0|2,0,0]=4 12589 B11R2.459 Brc1sccc1C2CCC2 Amb13884514 [0,0,0,1,1,0|2,0,0]=4 12590 B11R2.459 Cc1ccoc1C2CNC2 Amb33343554 [0,0,0,1,1,0|2,0,0]=4 12591 B11R2.459 Cc1ccsc1C2CNC2 Amb24636265 [0,0,0,1,1,0|2,0,0]=4 12592 B11R2.459 Cc1cocc1C2CNC2 Amb27637660 [0,0,0,1,1,0|2,0,0]=4 12593 B11R2.459 Cc1cscc1C2CNC2 Amb25066788 [0,0,0,1,1,0|2,0,0]=4 12594 B11R2.459 Cc1occc1C2CNC2 Amb33275134 [0,0,0,1,1,0|2,0,0]=4 12595 B11R2.459 Cc1sccc1C2CNC2 Amb28047675 [0,0,0,1,1,0|2,0,0]=4 12596 B11R2.459 Clc1ccsc1C2CNC2 Amb27760311 [0,0,0,1,1,0|1,1,0]=4 12597 B11R2.459 Clc1sccc1C2CNC2 Amb27838825 [0,0,0,1,1,0|1,1,0]=4 12598 B11R2.459 Cn1cccc1C2CNC2 Amb25861272 [0,0,0,1,1,0|2,0,0]=4 12599 B13R2.2294 C1=CC=C2CCCCCC(=C1)N2 Amb28074161 [0,0,0,1,0,1|2,0,0]=4 12600 B13R2.32 BrC1CCc2ccccc2C1Br Amb4020672 [0,1,0,1,0,0|2,0,0]=4 12601 B13R2.32 C=C1c2ccccc2CCN1C Amb25111593 [0,1,0,1,0,0|1,0,0]=3 12602 B13R2.32 CC1=C(C)c2ccccc2CC1 Amb31292547 [0,1,0,1,0,0|2,0,0]=4 12603 B13R2.32 CC1CCc2ccccc2C1=O Amb6357464 [0,1,0,1,0,0|2,0,0]=4 12604 B13R2.32 CC1CCc2ccccc2C1Br Amb25106373 [0,1,0,1,0,0|1,0,0]=3 12605 B13R2.32 CC1CCc2ccccc2C1N Amb30584820 [0,1,0,1,0,0|2,0,0]=4 12606 B13R2.32 CC1CCc2ccccc2C1N Amb9782750 [0,1,0,1,0,0|2,0,0]=4 12607 B13R2.32 CC1CCc2ccccc2C1O Amb18800659 [0,1,0,1,0,0|2,0,0]=4 12608 B13R2.32 CC1CCc2ccccc2N1N Amb18829618 [0,1,0,1,0,0|2,0,0]=4 12609 B13R2.32 CC1CCc2ccccc2[C@H]1O Amb28194260 [0,1,0,1,0,0|2,0,0]=4 12610 B13R2.32 CC1c2ccccc2CCN1C Amb28434667 [0,1,0,1,0,0|1,0,0]=3 12611 B13R2.32 CN1C(=O)C=CC2=C1CCNC2 Amb28320376 [0,1,0,1,0,0|2,0,0]=4 12612 B13R2.32 CN1CCc2ccccc2C1=O Amb27958468 [0,1,0,1,0,0|1,0,0]=3 12613 B13R2.32 CN1CCc2ccccc2C1=S Amb27190769 [0,1,0,1,0,0|1,0,0]=3 12614 B13R2.32 CN1CCc2ccccc2C1O Amb27193085 [0,1,0,1,0,0|1,0,0]=3 12615 B13R2.32 CN1CCc2ncccc2C1=O Amb27649099 [0,1,0,1,0,0|2,0,0]=4 12616 B13R2.32 CN1NCc2ccccc2C1=O Amb24556524 [0,1,0,1,0,0|2,0,0]=4 12617 B13R2.32 CN1NCc2ccccc2C1=O Amb32652549 [0,1,0,1,0,0|2,0,0]=4 12618 B13R2.32 C[C@@H]1CCc2ccccc2[C@@H]1N Amb27461977 [0,1,0,1,0,0|2,0,0]=4 12619 B13R2.32 C[C@@H]1CCc2ccccc2[C@H]1O Amb28061859 [0,1,0,1,0,0|2,0,0]=4 12620 B13R2.32 Cc1c(F)ccc2c1CCNC2 Amb28076176 [0,1,0,1,0,0|1,0,0]=3 12621 B13R2.32 Cc1c(N)ccc2c1CCNC2 Amb27423359 [0,1,0,1,0,0|1,0,0]=3 12622 B13R2.32 Cc1c(O)ccc2c1CCCC2 Amb1834563 [0,1,0,1,0,0|2,0,0]=4 12623 B13R2.32 Cc1ccc2c(c1Br)CCCN2 Amb33620610 [0,1,0,1,0,0|2,0,0]=4 12624 B13R2.32 Cc1ccc2c(c1Br)NCCC2 Amb27233109 [0,1,0,1,0,0|2,0,0]=4 12625 B13R2.32 Cc1ccc2c(c1C)CCOC2 Amb25104740 [0,1,0,1,0,0|2,0,0]=4 12626 B13R2.32 Cc1ccc2c(c1F)CCNC2 Amb27792299 [0,1,0,1,0,0|0,1,0]=3 12627 B13R2.32 Cc1ccc2c(c1N)CCNC2 Amb23453063 [0,1,0,1,0,0|1,0,0]=3 12628 B13R2.32 Clc1ccc2c(c1Br)CNCC2 Amb33394673 [0,1,0,1,0,0|2,0,0]=4 12629 B13R2.32 Clc1ccc2c(c1Br)CNCC2 Amb33482771 [0,1,0,1,0,0|2,0,0]=4 12630 B13R2.32 Clc1ccc2c(c1Br)NCCC2 Amb25175937 [0,1,0,1,0,0|2,0,0]=4 12631 B13R2.32 Clc1ccc2c(c1Cl)CCNC2 Amb13952578 [0,1,0,1,0,0|0,1,0]=3 12632 B13R2.32 Clc1ccc2c(c1Cl)CCNC2 Amb7807617 [0,1,0,1,0,0|0,1,0]=3 12633 B13R2.32 Fc1c(Br)ccc2c1CCNC2 Amb27625511 [0,1,0,1,0,0|0,1,0]=3 12634 B13R2.32 Fc1c(Br)ccc2c1CCNC2 Amb33527026 [0,1,0,1,0,0|0,1,0]=3 12635 B13R2.32 Fc1c(Cl)ccc2c1CCNC2 Amb28060838 [0,1,0,1,0,0|0,1,0]=3 12636 B13R2.32 Fc1ccc2c(c1Br)CNCC2 Amb24594512 [0,1,0,1,0,0|2,0,0]=4 12637 B13R2.32 Fc1ccc2c(c1Br)CNCC2 Amb28822138 [0,1,0,1,0,0|2,0,0]=4 12638 B13R2.32 Fc1ccc2c(c1F)CCNC2 Amb22059293 [0,1,0,1,0,0|0,1,0]=3 12639 B13R2.32 Fc1ccc2c(c1F)CCNC2 Amb33249770 [0,1,0,1,0,0|0,1,0]=3 12640 B13R2.32 NN1CCc2ccccc2C1=O Amb18118349 [0,1,0,1,0,0|2,0,0]=4 12641 B13R2.32 Nc1c(F)ccc2c1CCNC2 Amb27259619 [0,1,0,1,0,0|1,0,0]=3 12642 B13R2.32 Nc1c(O)ccc2c1CCNC2 Amb27635458 [0,1,0,1,0,0|1,0,0]=3 12643 B13R2.32 Nc1c(S)ccc2c1CCCC2 Amb18273535 [0,1,0,1,0,0|2,0,0]=4 12644 B13R2.32 Nc1ccc2c(c1N)CCCC2 Amb18645717 [0,1,0,1,0,0|2,0,0]=4 12645 B13R2.32 Nc1ccc2c(c1N)CCNC2 Amb25375891 [0,1,0,1,0,0|1,0,0]=3 12646 B13R2.32 Nc1ccc2c(c1S)CCCC2 Amb27858860 [0,1,0,1,0,0|2,0,0]=4 12647 B13R2.32 O=C1c2ccccc2CCN1O Amb27165147 [0,1,0,1,0,0|2,0,0]=4 12648 B13R2.32 Oc1ccc2c(c1Br)CCCO2 Amb27219091 [0,1,0,1,0,0|2,0,0]=4 12649 B13R2.32 Oc1ccc2c(c1Br)CCNC2 Amb24483628 [0,1,0,1,0,0|0,0,0]=2 12650 B13R2.32 Oc1ccc2c(c1F)CCCC2 Amb26639325 [0,1,0,1,0,0|1,1,0]=4 12651 B13R2.32 Oc1ccc2c(c1F)CCNC2 Amb26012926 [0,1,0,1,0,0|0,1,0]=3 12652 B13R2.32 Oc1ccc2c(c1F)CCNC2 Amb33732583 [0,1,0,1,0,0|0,1,0]=3 12653 B13R2.32 Oc1ccc2c(c1O)CCCC2 Amb25807529 [0,1,0,1,0,0|2,0,0]=4 12654 B13R2.32 Oc1ccc2c(c1O)CCNC2 Amb27413739 [0,1,0,1,0,0|1,0,0]=3 12655 B13R2.54 CCC1Cc2c(F)cccc2N1 Amb27625147 [0,1,0,1,0,0|1,1,0]=4 12656 B13R2.54 CCC1Cc2c(N)cccc2O1 Amb25047469 [0,1,0,1,0,0|2,0,0]=4 12657 B13R2.54 CCC1Cc2c(O)cccc2N1 Amb28286762 [0,1,0,1,0,0|2,0,0]=4 12658 B13R2.54 CCN1Cc2cccc(Br)c2C1 Amb28366240 [0,1,0,1,0,0|2,0,0]=4 12659 B13R2.54 CNC1Cc2cccc(F)c2C1 Amb27259913 [0,1,0,1,0,0|0,1,0]=3 12660 B13R2.54 CNc1nc2c(Br)cccc2s1 Amb10879774 [0,1,0,1,0,0|1,0,1]=4 12661 B13R2.54 CNc1nc2cccc(Br)c2o1 Amb17572122 [0,1,0,1,0,0|1,0,1]=4 12662 B13R2.54 ClCC1Cc2cccc(Br)c2C1 Amb27826441 [0,1,0,1,0,0|2,0,0]=4 12663 B13R2.54 NCC1Cc2cccc(Br)c2C1 Amb25159963 [0,1,0,1,0,0|2,0,0]=4 12664 B13R2.54 OCC1Cc2c(Br)cccc2O1 Amb22751578 [0,1,0,1,0,0|2,0,0]=4 12665 B13R2.154 NC1CC1c2cccc(F)c2Br Amb25272635 [0,1,0,1,0,0|2,0,0]=4 12666 B13R2.154 NC1CC1c2cccc(O)c2Br Amb33386758 [0,1,0,1,0,0|2,0,0]=4 12667 B13R2.154 N[C@@H]1C[C@H]1c2cccc(F)c2Br Amb33450495 [0,1,0,1,0,0|2,0,0]=4 12668 B13R2.154 N[C@@H]1C[C@H]1c2cccc(O)c2Br Amb33386751 [0,1,0,1,0,0|2,0,0]=4 12669 B13R2.162 CC1CCc2cccc(Br)c2O1 Amb25243321 [0,1,0,1,0,0|2,0,0]=4 12670 B13R2.162 CC1CCc2cccc(Cl)c2N1 Amb18062229 [0,1,0,1,0,0|2,0,0]=4 12671 B13R2.162 CC1CCc2cccc(F)c2N1 Amb18062234 [0,1,0,1,0,0|2,0,0]=4 12672 B13R2.162 CC1CCc2cccc(N)c2C1 Amb27750847 [0,1,0,1,0,0|2,0,0]=4 12673 B13R2.162 CC1CCc2cccc(N)c2N1 Amb27756555 [0,1,0,1,0,0|2,0,0]=4 12674 B13R2.162 CC1CCc2cccc(O)c2N1 Amb6891807 [0,1,0,1,0,0|2,0,0]=4 12675 B13R2.162 CC1CCc2cccc(O)c2N1 Amb9703457 [0,1,0,1,0,0|2,0,0]=4 12676 B13R2.162 CC1CNc2cccc(Br)c2C1 Amb18160047 [0,1,0,1,0,0|2,0,0]=4 12677 B13R2.162 CC1Cc2c(Br)cccc2CN1 Amb26856570 [0,1,0,1,0,0|0,0,0]=2 12678 B13R2.162 CC1Cc2c(Cl)cccc2CN1 Amb17400899 [0,1,0,1,0,0|0,1,0]=3 12679 B13R2.162 CC1Cc2c(F)cccc2CN1 Amb17400183 [0,1,0,1,0,0|0,1,0]=3 12680 B13R2.162 CC1Cc2c(N)cccc2CN1 Amb18351862 [0,1,0,1,0,0|1,0,0]=3 12681 B13R2.162 CN1CCc2cccc(Br)c2C1 Amb17970987 [0,1,0,1,0,0|1,0,0]=3 12682 B13R2.162 CN1CCc2cccc(O)c2C1 Amb18645882 [0,1,0,1,0,0|1,0,0]=3 12683 B13R2.162 C[C@@H]1Cc2c(Br)cccc2CN1 Amb27221634 [0,1,0,1,0,0|0,0,0]=2 12684 B13R2.162 C[C@@H]1Cc2c(Cl)cccc2CN1 Amb27946106 [0,1,0,1,0,0|0,1,0]=3 12685 B13R2.162 C[C@H]1CCc2cccc(F)c2N1 Amb27196384 [0,1,0,1,0,0|2,0,0]=4 12686 B13R2.162 C[C@H]1CCc2cccc(O)c2N1 Amb28187401 [0,1,0,1,0,0|2,0,0]=4 12687 B13R2.162 Cc1cccc2c1CC(C)NC2 Amb5735583 [0,1,0,1,0,0|1,0,0]=3 12688 B13R2.162 Cc1cccc2c1CC(N)CC2 Amb17470426 [0,1,0,1,0,0|2,0,0]=4 12689 B13R2.162 Cc1cccc2c1CN(C)CC2 Amb17970965 [0,1,0,1,0,0|1,0,0]=3 12690 B13R2.162 Cc1cccc2c1NC(C)CC2 Amb18559685 [0,1,0,1,0,0|2,0,0]=4 12691 B13R2.162 Cc1cccc2c1N[C@@H](C)CC2 Amb28124628 [0,1,0,1,0,0|2,0,0]=4 12692 B13R2.162 NC1CCc2cccc(Br)c2C1 Amb22492761 [0,1,0,1,0,0|1,0,0]=3 12693 B13R2.162 NC1CCc2cccc(Cl)c2C1 Amb2383261 [0,1,0,1,0,0|1,1,0]=4 12694 B13R2.162 NC1CCc2cccc(F)c2C1 Amb17470458 [0,1,0,1,0,0|1,1,0]=4 12695 B13R2.162 NC1CCc2cccc(O)c2C1 Amb27470772 [0,1,0,1,0,0|2,0,0]=4 12696 B13R2.162 NC1COc2cccc(Br)c2C1 Amb18747760 [0,1,0,1,0,0|2,0,0]=4 12697 B13R2.162 NC1COc2cccc(Br)c2C1 Amb30584992 [0,1,0,1,0,0|2,0,0]=4 12698 B13R2.162 N[C@@H]1CCc2cccc(Br)c2C1 Amb22225381 [0,1,0,1,0,0|1,0,0]=3 12699 B13R2.162 N[C@@H]1CCc2cccc(O)c2C1 Amb27258095 [0,1,0,1,0,0|2,0,0]=4 12700 B13R2.162 N[C@H]1CCc2cccc(F)c2C1 Amb27460172 [0,1,0,1,0,0|1,1,0]=4 12701 B13R2.162 Nc1cccc2c1CC(=O)NC2 Amb25253813 [0,1,0,1,0,0|1,0,1]=4 12702 B13R2.162 Nc1cccc2c1CC(N)CC2 Amb27794677 [0,1,0,1,0,0|2,0,0]=4 12703 B13R2.162 Nc1cccc2c1CC(O)CC2 Amb20241445 [0,1,0,1,0,0|2,0,0]=4 12704 B13R2.162 Nc1cccc2c1C[C@@H](O)CC2 Amb27955902 [0,1,0,1,0,0|2,0,0]=4 12705 B13R2.162 O=C1CCc2cccc(Br)c2C1 Amb2695315 [0,1,0,1,0,0|1,0,1]=4 12706 B13R2.162 O=C1Cc2c(F)cccc2CN1 Amb28138543 [0,1,0,1,0,0|0,1,1]=4 12707 B13R2.162 O=C1NCc2cccc(Br)c2N1 Amb27778685 [0,1,0,1,0,0|1,0,1]=4 12708 B13R2.162 O=C1NCc2cccc(Br)c2O1 Amb33620613 [0,1,0,1,0,0|1,0,1]=4 12709 B13R2.162 OC1CCc2cccc(Br)c2C1 Amb27770773 [0,1,0,1,0,0|1,0,0]=3 12710 B13R2.162 Oc1cccc2c1C[C@H](O)CC2 Amb27260442 [0,1,0,1,0,0|2,0,0]=4 12711 B13R2.3022 Brc1c(I)cccc1C2CCN2 Amb27945805 [0,1,0,1,0,0|2,0,0]=4 12712 B13R2.3022 Brc1ccnc(C2CCC2)c1Br Amb24319919 [0,1,0,1,0,0|2,0,0]=4 12713 B13R2.3022 Brc1nccc(C2CCC2)c1Br Amb24319822 [0,1,0,1,0,0|2,0,0]=4 12714 B13R2.3022 Cc1c(Br)cccc1C2CNC2 Amb26056189 [0,1,0,1,0,0|1,0,0]=3 12715 B13R2.3022 Cc1c(F)cccc1C2CNC2 Amb25144046 [0,1,0,1,0,0|1,0,0]=3 12716 B13R2.3022 Cc1cccc(C2CNC2)c1C Amb25087732 [0,1,0,1,0,0|1,0,0]=3 12717 B13R2.3022 Cc1cccc(C2CNC2)c1Cl Amb28195287 [0,1,0,1,0,0|0,1,0]=3 12718 B13R2.3022 Cc1cccc(C2CNC2)c1F Amb25945304 [0,1,0,1,0,0|0,1,0]=3 12719 B13R2.3022 Cc1cccc(C2CNC2)c1N Amb27786186 [0,1,0,1,0,0|1,0,0]=3 12720 B13R2.3022 Cc1cccc(C2CNC2)c1O Amb27244915 [0,1,0,1,0,0|1,0,0]=3 12721 B13R2.3022 Clc1cccc(C2CCN2)c1Br Amb27171368 [0,1,0,1,0,0|2,0,0]=4 12722 B13R2.3022 Clc1cccc(C2CNC2)c1Cl Amb25780787 [0,1,0,1,0,0|0,1,0]=3 12723 B13R2.3022 Clc1cccc([C@@H]2CCN2)c1Br Amb28126976 [0,1,0,1,0,0|2,0,0]=4 12724 B13R2.3022 Clc1cccc([C@H]2CCN2)c1Br Amb27807580 [0,1,0,1,0,0|2,0,0]=4 12725 B13R2.3022 Clc1nccc(C2CCC2)c1Br Amb24318893 [0,1,0,1,0,0|2,0,0]=4 12726 B13R2.3022 Fc1c(Br)cccc1C2CNC2 Amb27152998 [0,1,0,1,0,0|0,1,0]=3 12727 B13R2.3022 Fc1c(C2CNC2)ccnc1Cl Amb27669013 [0,1,0,1,0,0|1,1,0]=4 12728 B13R2.3022 Fc1c(Cl)cccc1C2CCC2 Amb32695967 [0,1,0,1,0,0|1,1,0]=4 12729 B13R2.3022 Fc1c(Cl)cccc1C2CNC2 Amb24484210 [0,1,0,1,0,0|0,1,0]=3 12730 B13R2.3022 Fc1cccc(C2CCN2)c1Br Amb28119108 [0,1,0,1,0,0|2,0,0]=4 12731 B13R2.3022 Fc1cccc(C2CNC2)c1Br Amb26316721 [0,1,0,1,0,0|0,0,0]=2 12732 B13R2.3022 Fc1cccc(C2CNC2)c1Cl Amb25719403 [0,1,0,1,0,0|0,1,0]=3 12733 B13R2.3022 Fc1cccc(C2CNC2)c1F Amb27231678 [0,1,0,1,0,0|0,1,0]=3 12734 B13R2.3022 Fc1nccc(C2CCC2)c1Br Amb24318946 [0,1,0,1,0,0|2,0,0]=4 12735 B13R2.3022 Nc1c(I)cncc1C2CNC2 Amb27647673 [0,1,0,1,0,0|2,0,0]=4 12736 B13R2.3022 Nc1ccnc(C2CCC2)c1Br Amb24319964 [0,1,0,1,0,0|2,0,0]=4 12737 B13R2.3022 Nc1nccc(C2CCC2)c1Br Amb24319851 [0,1,0,1,0,0|2,0,0]=4 12738 B13R2.3022 Oc1c(Br)cccc1C2CNC2 Amb25730068 [0,1,0,1,0,0|1,0,0]=3 12739 B13R2.3022 Oc1c(Cl)cccc1C2CNC2 Amb26548333 [0,1,0,1,0,0|1,0,0]=3 12740 B13R2.3022 Oc1c(F)cccc1C2CNC2 Amb25335410 [0,1,0,1,0,0|1,0,0]=3 12741 B13R2.3022 Oc1cccc(C2CCN2)c1Br Amb27171305 [0,1,0,1,0,0|2,0,0]=4 12742 B13R2.3022 Oc1cccc(C2CNC2)c1Br Amb33386749 [0,1,0,1,0,0|0,0,0]=2 12743 B13R2.3022 Oc1cccc(C2CNC2)c1O Amb26478416 [0,1,0,1,0,0|1,0,0]=3 12744 B13R2.3022 Oc1cccc([C@@H]2CCN2)c1Br Amb27237191 [0,1,0,1,0,0|2,0,0]=4 12745 B13R2.4820 Brc1cccc2c1CCCCN2 Amb2383459 [0,1,0,1,0,0|1,0,0]=3 12746 B13R2.4820 Brc1cccc2c1CCCNC2 Amb25759245 [0,1,0,1,0,0|0,0,0]=2 12747 B13R2.4820 Brc1cccc2c1CCCNC2 Amb30585031 [0,1,0,1,0,0|0,0,0]=2 12748 B13R2.4820 Brc1cccc2c1CCNCC2 Amb25034823 [0,1,0,1,0,0|0,0,0]=2 12749 B13R2.4820 Brc1cccc2c1CNCCC2 Amb18160017 [0,1,0,1,0,0|1,0,0]=3 12750 B13R2.4820 Brc1cccc2c1CNCCO2 Amb27272704 [0,1,0,1,0,0|2,0,0]=4 12751 B13R2.4820 Brc1cccc2c1CNCCO2 Amb28963353 [0,1,0,1,0,0|2,0,0]=4 12752 B13R2.4820 Brc1cccc2c1COCCN2 Amb35752929 [0,1,0,1,0,0|2,0,0]=4 12753 B13R2.4820 Brc1cccc2c1NCCCC2 Amb22001547 [0,1,0,1,0,0|1,0,0]=3 12754 B13R2.4820 Brc1cccc2c1NCCNC2 Amb17580635 [0,1,0,1,0,0|0,0,0]=2 12755 B13R2.4820 Brc1cccc2c1OCCCC2 Amb18161064 [0,1,0,1,0,0|1,0,0]=3 12756 B13R2.4820 Brc1cccc2c1OCCCN2 Amb17572164 [0,1,0,1,0,0|2,0,0]=4 12757 B13R2.4820 Brc1cccc2c1OCCCO2 Amb28396747 [0,1,0,1,0,0|2,0,0]=4 12758 B13R2.4820 Brc1cccc2c1OCCNC2 Amb25059014 [0,1,0,1,0,0|0,0,0]=2 12759 B13R2.4820 Brc1cccc2c1OCCNC2 Amb33552979 [0,1,0,1,0,0|0,0,0]=2 12760 B13R2.4820 Brc1cccc2c1SCCCC2 Amb18522289 [0,1,0,1,0,0|1,0,0]=3 12761 B13R2.4820 Brc1cccc2c1SCCCN2 Amb29889562 [0,1,0,1,0,0|2,0,0]=4 12762 B13R2.4820 Brc1ccnc2c1CCCCC2 Amb25312464 [0,1,0,1,0,0|2,0,0]=4 12763 B13R2.4820 Brc1nccc2c1CCCNC2 Amb27804263 [0,1,0,1,0,0|1,0,0]=3 12764 B13R2.4820 Cc1cccc2c1CCCNC2 Amb27487349 [0,1,0,1,0,0|1,0,0]=3 12765 B13R2.4820 Cc1cccc2c1NCCCC2 Amb26457623 [0,1,0,1,0,0|2,0,0]=4 12766 B13R2.4820 Cc1cccc2c1NCCCC2 Amb33457641 [0,1,0,1,0,0|2,0,0]=4 12767 B13R2.4820 Cc1cccc2c1NCCNC2 Amb17578182 [0,1,0,1,0,0|1,0,0]=3 12768 B13R2.4820 Cc1cccc2c1OCCNC2 Amb10075222 [0,1,0,1,0,0|1,0,0]=3 12769 B13R2.4820 Clc1cccc2c1CCCCN2 Amb2383458 [0,1,0,1,0,0|1,1,0]=4 12770 B13R2.4820 Clc1cccc2c1CCNCC2 Amb26988678 [0,1,0,1,0,0|0,1,0]=3 12771 B13R2.4820 Clc1cccc2c1CNCCC2 Amb27791841 [0,1,0,1,0,0|1,1,0]=4 12772 B13R2.4820 Clc1cccc2c1NCCCC2 Amb2383474 [0,1,0,1,0,0|1,1,0]=4 12773 B13R2.4820 Clc1cccc2c1NCCNC2 Amb19888394 [0,1,0,1,0,0|0,1,0]=3 12774 B13R2.4820 Clc1cccc2c1NCCNC2 Amb19889642 [0,1,0,1,0,0|0,1,0]=3 12775 B13R2.4820 Clc1cccc2c1OCCCC2 Amb25121076 [0,1,0,1,0,0|1,1,0]=4 12776 B13R2.4820 Clc1nccc2c1CCCNC2 Amb27213698 [0,1,0,1,0,0|1,1,0]=4 12777 B13R2.4820 Clc1nccc2c1OCCNC2 Amb27591623 [0,1,0,1,0,0|1,1,0]=4 12778 B13R2.4820 Fc1cccc2c1CCCNC2 Amb27670190 [0,1,0,1,0,0|0,1,0]=3 12779 B13R2.4820 Fc1cccc2c1CNCCC2 Amb23512638 [0,1,0,1,0,0|1,1,0]=4 12780 B13R2.4820 Fc1cccc2c1NCCCC2 Amb2383473 [0,1,0,1,0,0|1,1,0]=4 12781 B13R2.4820 Fc1cccc2c1OCCNC2 Amb20528417 [0,1,0,1,0,0|0,1,0]=3 12782 B13R2.4820 Fc1cccc2c1OCCNC2 Amb28600207 [0,1,0,1,0,0|0,1,0]=3 12783 B13R2.4820 Nc1cccc2c1CCCCC2 Amb27862508 [0,1,0,1,0,0|2,0,0]=4 12784 B13R2.4820 Nc1cccc2c1CNCCC2 Amb28132985 [0,1,0,1,0,0|2,0,0]=4 12785 B13R2.4820 Nc1cccc2c1NCCCC2 Amb27202057 [0,1,0,1,0,0|2,0,0]=4 12786 B13R2.4820 Nc1cccc2c1OCCCC2 Amb18829225 [0,1,0,1,0,0|2,0,0]=4 12787 B13R2.4820 Nc1cccc2c1OCCOC2 Amb17570104 [0,1,0,1,0,0|2,0,0]=4 12788 B13R2.4820 Nc1cccc2c1SCCCC2 Amb18824603 [0,1,0,1,0,0|2,0,0]=4 12789 B13R2.4820 Nc1cncc2c1CCNCC2 Amb28053137 [0,1,0,1,0,0|2,0,0]=4 12790 B13R2.4820 Oc1cccc2c1CCNCC2 Amb26359830 [0,1,0,1,0,0|1,0,0]=3 12791 B13R2.5180 CC1NCc2c1ccc(N)c2Br Amb18160602 [0,1,0,1,0,0|2,0,0]=4 12792 B13R2.5180 Cc1c(O)ccc2c1CCN2C Amb27221943 [0,1,0,1,0,0|1,0,0]=3 12793 B13R2.5180 Cc1ccc2c(c1Br)CCC2=O Amb22443796 [0,1,0,1,0,0|2,0,0]=4 12794 B13R2.5180 Cc1ccc2c(c1Br)CC[C@H]2N Amb28185992 [0,1,0,1,0,0|2,0,0]=4 12795 B13R2.5180 Cc1ccc2c(cnn2C)c1Br Amb10070866 [0,1,0,1,0,0|1,0,1]=4 12796 B13R2.5180 NC1CCc2c1ccc(Cl)c2Br Amb27393096 [0,1,0,1,0,0|2,0,0]=4 12797 B13R2.5180 NC1CCc2c1ccc(F)c2Br Amb24483818 [0,1,0,1,0,0|2,0,0]=4 12798 B13R2.5180 NC1CCc2c1ccc(F)c2Br Amb28653090 [0,1,0,1,0,0|2,0,0]=4 12799 B13R2.5180 NC1CCc2c1ccc(I)c2Br Amb27166666 [0,1,0,1,0,0|2,0,0]=4 12800 B13R2.5180 NC1CCc2c1ccc(O)c2Br Amb28244111 [0,1,0,1,0,0|2,0,0]=4 12801 B13R2.5180 N[C@@H]1CCc2c1ccc(Cl)c2Br Amb27397602 [0,1,0,1,0,0|2,0,0]=4 12802 B13R2.5180 N[C@@H]1CCc2c1ccc(O)c2Br Amb27854336 [0,1,0,1,0,0|2,0,0]=4 12803 B13R2.5180 N[C@H]1CCc2c1ccc(Br)c2Br Amb28144202 [0,1,0,1,0,0|2,0,0]=4 12804 B13R2.5180 O=C1CCc2c1ccc(Cl)c2Br Amb23440401 [0,1,0,1,0,0|2,0,0]=4 12805 B13R2.5180 O=C1CCc2c1ccc(F)c2Br Amb28196366 [0,1,0,1,0,0|2,0,0]=4 12806 B13R2.5325 Cc1c(Br)cccc1CC2CO2 Amb32698749 [0,1,0,1,0,0|2,0,0]=4 12807 B13R2.5325 Cc1c(Cl)cccc1CC2CO2 Amb32698726 [0,1,0,1,0,0|2,0,0]=4 12808 B13R2.5325 Cc1c(F)cccc1CC2CO2 Amb33428407 [0,1,0,1,0,0|2,0,0]=4 12809 B13R2.5325 Cc1cccc(CC2CO2)c1C Amb25898873 [0,1,0,1,0,0|2,0,0]=4 12810 B13R2.5325 Cc1cccc(CC2CO2)c1F Amb33324717 [0,1,0,1,0,0|1,1,0]=4 12811 B13R2.5325 Clc1c(Br)cccc1CC2CO2 Amb32698750 [0,1,0,1,0,0|1,1,0]=4 12812 B13R2.5325 Clc1cccc(CC2CO2)c1Cl Amb26352246 [0,1,0,1,0,0|1,1,0]=4 12813 B13R2.5325 Fc1c(Br)cccc1CC2CO2 Amb26590127 [0,1,0,1,0,0|1,1,0]=4 12814 B13R2.5325 Fc1c(Cl)cccc1CC2CO2 Amb32698728 [0,1,0,1,0,0|1,1,0]=4 12815 B13R2.5325 Fc1cccc(CC2CO2)c1Br Amb33450547 [0,1,0,1,0,0|1,0,0]=3 12816 B13R2.5325 Fc1cccc(CC2CO2)c1F Amb25690720 [0,1,0,1,0,0|1,1,0]=4 12817 B13R2.5325 Fc1cccc(OC2CC2)c1Br Amb27482858 [0,1,0,1,0,0|2,0,0]=4 12818 B13R2.5325 Nc1c(O)cccc1CC2CC2 Amb27243866 [0,1,0,1,0,0|2,0,0]=4 12819 B13R2.5325 Nc1cccc(OC2CC2)c1Br Amb27402647 [0,1,0,1,0,0|2,0,0]=4 12820 B13R2.5325 Oc1c(Cl)cccc1CC2CC2 Amb27175660 [0,1,0,1,0,0|2,0,0]=4 12821 B13R2.5325 Oc1cccc(CC2CC2)c1Cl Amb28145879 [0,1,0,1,0,0|1,1,0]=4 12822 B13R2.43 CCC1Cc2cc(O)ccc2N1 Amb2697112 [0,1,0,1,0,0|2,0,0]=4 12823 B13R2.43 CNC1Cc2ccc(F)cc2C1 Amb22234585 [0,1,0,1,0,0|1,0,0]=3 12824 B13R2.43 CNC1Cc2ccc(O)cc2C1 Amb27642683 [0,1,0,1,0,0|1,0,0]=3 12825 B13R2.43 COC1Cc2ccc(N)cc2C1 Amb27416685 [0,1,0,1,0,0|2,0,0]=4 12826 B13R2.155 CC1CCc2ccc(Br)cc2O1 Amb25376042 [0,1,0,1,0,0|2,0,0]=4 12827 B13R2.155 CC1CCc2ccc(Cl)cc2N1 Amb18559687 [0,1,0,1,0,0|2,0,0]=4 12828 B13R2.155 CC1CCc2ccc(F)cc2N1 Amb24092085 [0,1,0,1,0,0|2,0,0]=4 12829 B13R2.155 CC1CCc2ccc(I)cc2N1 Amb27653407 [0,1,0,1,0,0|2,0,0]=4 12830 B13R2.155 CC1CCc2ccc(O)cc2C1 Amb27762544 [0,1,0,1,0,0|2,0,0]=4 12831 B13R2.155 CN1CCc2ccc(Cl)cc2C1 Amb17970797 [0,1,0,1,0,0|1,0,0]=3 12832 B13R2.155 CN1CCc2ccc(N)cc2C1 Amb17138548 [0,1,0,1,0,0|1,0,0]=3 12833 B13R2.155 CN1CCc2ccc(O)cc2C1 Amb17843850 [0,1,0,1,0,0|1,0,0]=3 12834 B13R2.155 CN1CCc2ncc(Br)cc2C1 Amb27798497 [0,1,0,1,0,0|2,0,0]=4 12835 B13R2.155 CN1CCc2ncc(N)cc2C1 Amb10602798 [0,1,0,1,0,0|2,0,0]=4 12836 B13R2.155 CN1CCc2ncc(O)cc2C1 Amb24418524 [0,1,0,1,0,0|2,0,0]=4 12837 B13R2.155 C[C@@H]1CCc2ccc(Cl)cc2N1 Amb27960920 [0,1,0,1,0,0|2,0,0]=4 12838 B13R2.155 C[C@H]1CCc2ccc(Br)cc2N1 Amb27621123 [0,1,0,1,0,0|2,0,0]=4 12839 B13R2.155 C[C@H]1CCc2ccc(N)cc2N1 Amb27771013 [0,1,0,1,0,0|2,0,0]=4 12840 B13R2.155 Cc1ccc2c(c1)CC(C)CC2 Amb25946876 [0,1,0,1,0,0|2,0,0]=4 12841 B13R2.155 Cc1ccc2c(c1)NC(C)CC2 Amb9870467 [0,1,0,1,0,0|2,0,0]=4 12842 B13R2.155 Cc1ccc2c(c1)N[C@@H](C)CC2 Amb28205560 [0,1,0,1,0,0|2,0,0]=4 12843 B13R2.155 Cc1ccc2c(c1)N[C@H](C)CC2 Amb27621539 [0,1,0,1,0,0|2,0,0]=4 12844 B13R2.328 Brc1cc(Br)c2c(c1)CCCN2 Amb18239818 [0,1,0,1,0,0|2,0,0]=4 12845 B13R2.328 Brc1cc(Br)c2c(c1)CCCO2 Amb30016385 [0,1,0,1,0,0|2,0,0]=4 12846 B13R2.328 Brc1cc(Br)c2c(c1)NCCC2 Amb35721033 [0,1,0,1,0,0|2,0,0]=4 12847 B13R2.328 Brc1cc(I)cc2c1OCCC2 Amb30016386 [0,1,0,1,0,0|2,0,0]=4 12848 B13R2.328 CC1CC(C)c2ccccc2N1 Amb26967461 [0,1,0,1,0,0|2,0,0]=4 12849 B13R2.328 CC1CC(N)c2ccccc2O1 Amb32666312 [0,1,0,1,0,0|2,0,0]=4 12850 B13R2.328 CC1CC(N)c2ccccc2O1 Amb9398792 [0,1,0,1,0,0|2,0,0]=4 12851 B13R2.328 CC1CC(O)c2ccccc2O1 Amb24669760 [0,1,0,1,0,0|2,0,0]=4 12852 B13R2.328 CC1CN(C)Cc2ccccc21 Amb17971060 [0,1,0,1,0,0|1,0,0]=3 12853 B13R2.328 CN1CC(=O)c2ccccc2C1 Amb30584907 [0,1,0,1,0,0|1,0,1]=4 12854 B13R2.328 CN1CC(=O)c2ccccc2C1 Amb9783329 [0,1,0,1,0,0|1,0,1]=4 12855 B13R2.328 CN1Cc2ccccc2C(N)C1 Amb25775088 [0,1,0,1,0,0|1,0,0]=3 12856 B13R2.328 CN1Cc2ccccc2C(O)C1 Amb22547514 [0,1,0,1,0,0|1,0,0]=3 12857 B13R2.328 CN1Cc2ncccc2C(N)C1 Amb18829156 [0,1,0,1,0,0|2,0,0]=4 12858 B13R2.328 C[C@@H]1C[C@@H](C)c2ccccc2N1 Amb27446578 [0,1,0,1,0,0|2,0,0]=4 12859 B13R2.328 C[C@@H]1C[C@@H](N)c2ccccc2O1 Amb26008330 [0,1,0,1,0,0|2,0,0]=4 12860 B13R2.328 C[C@@H]1C[C@@H](N)c2ccccc2O1 Amb32661709 [0,1,0,1,0,0|2,0,0]=4 12861 B13R2.328 C[C@@H]1C[C@@H](O)c2ccccc2O1 Amb24579780 [0,1,0,1,0,0|2,0,0]=4 12862 B13R2.328 C[C@@H]1C[C@H](N)c2ccccc2O1 Amb25175782 [0,1,0,1,0,0|2,0,0]=4 12863 B13R2.328 C[C@@H]1C[C@H](N)c2ccccc2O1 Amb32661736 [0,1,0,1,0,0|2,0,0]=4 12864 B13R2.328 C[C@@H]1C[C@H](O)c2ccccc2N1 Amb27238767 [0,1,0,1,0,0|2,0,0]=4 12865 B13R2.328 C[C@@H]1C[C@H](O)c2ccccc2O1 Amb26849920 [0,1,0,1,0,0|2,0,0]=4 12866 B13R2.328 C[C@@H]1Cc2ccccc2[C@@H](O)C1 Amb27438494 [0,1,0,1,0,0|2,0,0]=4 12867 B13R2.328 C[C@@H]1Cc2ccccc2[C@H](O)C1 Amb28344692 [0,1,0,1,0,0|2,0,0]=4 12868 B13R2.328 C[C@H]1CC(O)c2ccccc2O1 Amb28350093 [0,1,0,1,0,0|2,0,0]=4 12869 B13R2.328 C[C@H]1C[C@@H](C)Nc2ccccc21 Amb33330460 [0,1,0,1,0,0|2,0,0]=4 12870 B13R2.328 C[C@H]1C[C@@H](O)c2ccccc2O1 Amb25317640 [0,1,0,1,0,0|2,0,0]=4 12871 B13R2.328 C[C@H]1Cc2ccccc2[C@@H](O)C1 Amb28435717 [0,1,0,1,0,0|2,0,0]=4 12872 B13R2.328 Cc1cc(Br)c2c(c1)CCCN2 Amb1128856 [0,1,0,1,0,0|2,0,0]=4 12873 B13R2.328 Cc1cc(Br)c2c(c1)CCNC2 Amb28243840 [0,1,0,1,0,0|2,0,0]=4 12874 B13R2.328 Cc1cc(Br)c2c(c1)CNCC2 Amb33532363 [0,1,0,1,0,0|0,0,0]=2 12875 B13R2.328 Cc1cc(Br)cc2c1CCNC2 Amb26617309 [0,1,0,1,0,0|1,0,0]=3 12876 B13R2.328 Cc1cc(C)c2c(c1)CNCC2 Amb33552998 [0,1,0,1,0,0|1,0,0]=3 12877 B13R2.328 Cc1cc(C)c2c(c1)COCC2 Amb25076719 [0,1,0,1,0,0|2,0,0]=4 12878 B13R2.328 Cc1cc(C)c2c(n1)CNCC2 Amb18829593 [0,1,0,1,0,0|2,0,0]=4 12879 B13R2.328 Cc1cc(Cl)c2c(c1)CNCC2 Amb35715404 [0,1,0,1,0,0|0,1,0]=3 12880 B13R2.328 Cc1cc(Cl)cc2c1CCNC2 Amb24053180 [0,1,0,1,0,0|1,0,0]=3 12881 B13R2.328 Cc1cc(N)c2c(c1)CCCC2 Amb17101139 [0,1,0,1,0,0|2,0,0]=4 12882 B13R2.328 Clc1cc(Br)c2c(c1)CCCN2 Amb18229635 [0,1,0,1,0,0|2,0,0]=4 12883 B13R2.328 Clc1cc(Br)c2c(c1)CCNC2 Amb25042307 [0,1,0,1,0,0|2,0,0]=4 12884 B13R2.328 Clc1cc(Br)c2c(c1)CNCC2 Amb25721825 [0,1,0,1,0,0|0,0,0]=2 12885 B13R2.328 Clc1cc(Br)c2c(c1)COCO2 Amb28384792 [0,1,0,1,0,0|2,0,0]=4 12886 B13R2.328 Clc1cc(Br)c2c(c1)NCCC2 Amb27167549 [0,1,0,1,0,0|2,0,0]=4 12887 B13R2.328 Clc1cc(Br)cc2c1CCNC2 Amb25141795 [0,1,0,1,0,0|0,1,0]=3 12888 B13R2.328 Clc1cc(Br)cc2c1CCNC2 Amb33339280 [0,1,0,1,0,0|0,1,0]=3 12889 B13R2.328 Clc1cc(Cl)c2c(c1)CNCC2 Amb2383369 [0,1,0,1,0,0|0,1,0]=3 12890 B13R2.328 Clc1cc(Cl)c2c(c1)CNCC2 Amb33549931 [0,1,0,1,0,0|0,1,0]=3 12891 B13R2.328 Fc1cc(Br)c2c(c1)CCCO2 Amb26022282 [0,1,0,1,0,0|2,0,0]=4 12892 B13R2.328 Fc1cc(Br)c2c(c1)CCNC2 Amb26639022 [0,1,0,1,0,0|2,0,0]=4 12893 B13R2.328 Fc1cc(Br)c2c(c1)CCNC2 Amb28963372 [0,1,0,1,0,0|2,0,0]=4 12894 B13R2.328 Fc1cc(Br)c2c(c1)CNCC2 Amb27762721 [0,1,0,1,0,0|0,0,0]=2 12895 B13R2.328 Fc1cc(Br)c2c(c1)CNCC2 Amb33483795 [0,1,0,1,0,0|0,0,0]=2 12896 B13R2.328 Fc1cc(Br)cc2c1CCNC2 Amb18943941 [0,1,0,1,0,0|0,1,0]=3 12897 B13R2.328 Fc1cc(Br)cc2c1CCNC2 Amb20668974 [0,1,0,1,0,0|0,1,0]=3 12898 B13R2.328 Fc1cc(Cl)c2c(c1)CNCC2 Amb24470869 [0,1,0,1,0,0|0,1,0]=3 12899 B13R2.328 Fc1cc(Cl)c2c(c1)CNCC2 Amb32661686 [0,1,0,1,0,0|0,1,0]=3 12900 B13R2.328 Fc1cc(Cl)cc2c1CCNC2 Amb27968430 [0,1,0,1,0,0|0,1,0]=3 12901 B13R2.328 Fc1cc(Cl)cc2c1CCNC2 Amb32661590 [0,1,0,1,0,0|0,1,0]=3 12902 B13R2.328 Fc1cc(F)c2c(c1)CNCC2 Amb2383370 [0,1,0,1,0,0|0,1,0]=3 12903 B13R2.328 Nc1cc(Br)c2c(c1)CCCN2 Amb18758352 [0,1,0,1,0,0|2,0,0]=4 12904 B13R2.328 Nc1cc(Br)c2c(c1)CCCO2 Amb18160339 [0,1,0,1,0,0|2,0,0]=4 12905 B13R2.328 Nc1cc(Br)c2c(c1)CCCS2 Amb18724148 [0,1,0,1,0,0|2,0,0]=4 12906 B13R2.328 Nc1cc(Cl)cc2c1CCNC2 Amb19108892 [0,1,0,1,0,0|1,0,0]=3 12907 B13R2.328 Nc1cc(I)c2c(c1)CNCC2 Amb26391460 [0,1,0,1,0,0|0,1,0]=3 12908 B13R2.328 O=C1C=C(O)C2=C(CNCC2)N1 Amb23559879 [0,1,0,1,0,0|2,0,0]=4 12909 B13R2.328 Oc1cc(Br)c2c(c1)CCNC2 Amb25230200 [0,1,0,1,0,0|2,0,0]=4 12910 B13R2.328 Oc1cc(Br)c2c(c1)CCNC2 Amb33483396 [0,1,0,1,0,0|2,0,0]=4 12911 B13R2.328 Sc1cc(Br)c2c(c1)CCCO2 Amb35706211 [0,1,0,1,0,0|2,0,0]=4 12912 B13R2.3742 Cc1cc(Br)c2c(c1)C(=O)CC2 Amb22753544 [0,1,0,1,0,0|2,0,0]=4 12913 B13R2.3742 Cc1cc(Br)c2c(c1)C(O)CC2 Amb27757448 [0,1,0,1,0,0|2,0,0]=4 12914 B13R2.3742 Cc1cc(Br)c2cnn(C)c2c1 Amb10070867 [0,1,0,1,0,0|1,0,1]=4 12915 B13R2.3742 Cc1cc(Br)c2ncn(C)c2c1 Amb21971786 [0,1,0,1,0,0|1,0,1]=4 12916 B13R2.3742 Cc1cc(N)c2c(n1)N(C)CC2 Amb1804733 [0,1,0,1,0,0|2,0,0]=4 12917 B13R2.3742 Cn1ncc2c(Br)cc(Cl)cc21 Amb23403273 [0,1,0,1,0,0|1,0,1]=4 12918 B13R2.3742 Cn1nnc2c(Br)cc(F)cc21 Amb33874215 [0,1,0,1,0,0|2,0,0]=4 12919 B13R2.3742 N[C@@H]1CCc2c(Br)cc(Br)cc21 Amb28252130 [0,1,0,1,0,0|2,0,0]=4 12920 B13R2.3742 N[C@@H]1CCc2c(Br)cc(Cl)cc21 Amb27616655 [0,1,0,1,0,0|2,0,0]=4 12921 B13R2.3742 N[C@@H]1CCc2c(Br)cc(O)cc21 Amb27263744 [0,1,0,1,0,0|2,0,0]=4 12922 B13R2.3742 N[C@H]1CCc2c(Br)cc(Cl)cc21 Amb27471021 [0,1,0,1,0,0|2,0,0]=4 12923 B13R2.3742 Nc1cc(Br)c2c(c1)C(N)CC2 Amb27832595 [0,1,0,1,0,0|2,0,0]=4 12924 B13R2.3742 O=C1CCc2c(Br)cc(Br)cc21 Amb21857861 [0,1,0,1,0,0|2,0,0]=4 12925 B13R2.3742 O=C1CCc2c(Br)cc(Cl)cc21 Amb22059768 [0,1,0,1,0,0|2,0,0]=4 12926 B13R2.3742 O=C1CCc2c(Br)cc(F)cc21 Amb16232965 [0,1,0,1,0,0|2,0,0]=4 12927 B13R2.3742 O=C1CCc2c(Br)cc(O)cc21 Amb27405714 [0,1,0,1,0,0|2,0,0]=4 12928 B13R2.5399 Cc1ccc(C2CC2N)c(Br)c1 Amb28243795 [0,1,0,1,0,0|2,0,0]=4 12929 B13R2.5399 Cc1ccc([C@@H]2C[C@H]2N)c(Br)c1 Amb33450443 [0,1,0,1,0,0|2,0,0]=4 12930 B13R2.5399 NC1CC1c2ccc(Cl)cc2Br Amb25693897 [0,1,0,1,0,0|2,0,0]=4 12931 B13R2.5399 NC1CC1c2ccc(F)cc2Br Amb25334178 [0,1,0,1,0,0|2,0,0]=4 12932 B13R2.5399 N[C@@H]1C[C@H]1c2ccc(Cl)cc2Br Amb33478310 [0,1,0,1,0,0|2,0,0]=4 12933 B13R2.5399 N[C@@H]1C[C@H]1c2ccc(F)cc2Br Amb33336267 [0,1,0,1,0,0|2,0,0]=4 12934 B13R2.5400 Brc1cc(I)ccc1NC2CC2 Amb27758291 [0,1,0,1,0,0|2,0,0]=4 12935 B13R2.5400 Brc1ccc(NC2CC2)c(Br)c1 Amb27466871 [0,1,0,1,0,0|2,0,0]=4 12936 B13R2.5400 Brc1ccc(OC2CC2)c(Br)c1 Amb28288905 [0,1,0,1,0,0|2,0,0]=4 12937 B13R2.5400 Cc1cc(Br)ccc1CC2CO2 Amb33435294 [0,1,0,1,0,0|2,0,0]=4 12938 B13R2.5400 Cc1cc(Cl)ccc1CC2CO2 Amb33261935 [0,1,0,1,0,0|2,0,0]=4 12939 B13R2.5400 Cc1cc(F)ccc1CC2CO2 Amb24743162 [0,1,0,1,0,0|2,0,0]=4 12940 B13R2.5400 Cc1ccc(CC2CO2)c(Br)c1 Amb33450470 [0,1,0,1,0,0|1,0,0]=3 12941 B13R2.5400 Cc1ccc(CC2CO2)c(C)c1 Amb25742620 [0,1,0,1,0,0|2,0,0]=4 12942 B13R2.5400 Cc1ccc(CC2CO2)c(Cl)c1 Amb32698723 [0,1,0,1,0,0|1,1,0]=4 12943 B13R2.5400 Cc1ccc(CC2CO2)c(F)c1 Amb33223895 [0,1,0,1,0,0|1,1,0]=4 12944 B13R2.5400 Cc1ccc(CC2CO2)c(O)c1 Amb28381217 [0,1,0,1,0,0|2,0,0]=4 12945 B13R2.5400 Cc1ccc(NC2CC2)c(Br)c1 Amb26639243 [0,1,0,1,0,0|2,0,0]=4 12946 B13R2.5400 Clc1cc(Br)ccc1CC2CO2 Amb33334571 [0,1,0,1,0,0|1,1,0]=4 12947 B13R2.5400 Clc1ccc(CC2CO2)c(Br)c1 Amb33478485 [0,1,0,1,0,0|1,0,0]=3 12948 B13R2.5400 Clc1ccc(CC2CO2)c(Cl)c1 Amb25679974 [0,1,0,1,0,0|1,1,0]=4 12949 B13R2.5400 Clc1ccc(SC2CC2)c(Br)c1 Amb28326245 [0,1,0,1,0,0|2,0,0]=4 12950 B13R2.5400 Fc1cc(Br)ccc1CC2CO2 Amb33476973 [0,1,0,1,0,0|1,1,0]=4 12951 B13R2.5400 Fc1cc(Cl)ccc1CC2CO2 Amb25898872 [0,1,0,1,0,0|1,1,0]=4 12952 B13R2.5400 Fc1ccc(CC2CO2)c(Br)c1 Amb33336609 [0,1,0,1,0,0|1,0,0]=3 12953 B13R2.5400 Fc1ccc(CC2CO2)c(Cl)c1 Amb33257716 [0,1,0,1,0,0|1,1,0]=4 12954 B13R2.5400 Fc1ccc(CC2CO2)c(F)c1 Amb24653474 [0,1,0,1,0,0|1,1,0]=4 12955 B13R2.5400 Fc1ccc(OC2CC2)c(Br)c1 Amb27848956 [0,1,0,1,0,0|2,0,0]=4 12956 B13R2.5400 Nc1ccc(NC2CC2)c(Br)c1 Amb18956504 [0,1,0,1,0,0|2,0,0]=4 12957 B13R2.5400 Nc1ccc(OC2CC2)c(Br)c1 Amb26078249 [0,1,0,1,0,0|2,0,0]=4 12958 B13R2.5400 Nc1ccc(SC2CC2)c(Br)c1 Amb27394004 [0,1,0,1,0,0|2,0,0]=4 12959 B13R2.5400 Oc1cc(Br)ccc1CC2CC2 Amb27614579 [0,1,0,1,0,0|2,0,0]=4 12960 B13R2.13518 Brc1cc(Br)c(C2CCC2)cn1 Amb20617524 [0,1,0,1,0,0|2,0,0]=4 12961 B13R2.13518 Cc1cc(Br)ccc1C2CNC2 Amb25148733 [0,1,0,1,0,0|1,0,0]=3 12962 B13R2.13518 Cc1cc(Cl)ccc1C2CNC2 Amb24484087 [0,1,0,1,0,0|1,0,0]=3 12963 B13R2.13518 Cc1cc(Cl)ncc1C2CNC2 Amb27614349 [0,1,0,1,0,0|2,0,0]=4 12964 B13R2.13518 Cc1cc(F)ccc1C2CNC2 Amb27805662 [0,1,0,1,0,0|1,0,0]=3 12965 B13R2.13518 Cc1cc(F)ncc1C2CNC2 Amb27607229 [0,1,0,1,0,0|2,0,0]=4 12966 B13R2.13518 Cc1cc(N)ncc1C2CNC2 Amb27446441 [0,1,0,1,0,0|2,0,0]=4 12967 B13R2.13518 Cc1cc(O)ccc1C2CNC2 Amb27816973 [0,1,0,1,0,0|1,0,0]=3 12968 B13R2.13518 Cc1cc(O)ncc1C2CNC2 Amb27817825 [0,1,0,1,0,0|2,0,0]=4 12969 B13R2.13518 Cc1ccc(C2CCN2)c(Br)c1 Amb27814358 [0,1,0,1,0,0|2,0,0]=4 12970 B13R2.13518 Cc1ccc(C2CNC2)c(Br)c1 Amb25771873 [0,1,0,1,0,0|0,0,0]=2 12971 B13R2.13518 Cc1ccc(C2CNC2)c(C)c1 Amb18563530 [0,1,0,1,0,0|1,0,0]=3 12972 B13R2.13518 Cc1ccc(C2CNC2)c(Cl)c1 Amb25320754 [0,1,0,1,0,0|0,1,0]=3 12973 B13R2.13518 Cc1ccc(C2CNC2)c(Cl)n1 Amb25238624 [0,1,0,1,0,0|1,1,0]=4 12974 B13R2.13518 Cc1ccc(C2CNC2)c(F)c1 Amb25116967 [0,1,0,1,0,0|0,1,0]=3 12975 B13R2.13518 Cc1ccc(C2CNC2)c(N)c1 Amb28291394 [0,1,0,1,0,0|1,0,0]=3 12976 B13R2.13518 Cc1ccc(C2CNC2)c(O)c1 Amb24484167 [0,1,0,1,0,0|1,0,0]=3 12977 B13R2.13518 Clc1cc(Br)ccc1C2CNC2 Amb24468852 [0,1,0,1,0,0|0,1,0]=3 12978 B13R2.13518 Clc1cc(Cl)c(C2CNC2)cn1 Amb25784766 [0,1,0,1,0,0|1,1,0]=4 12979 B13R2.13518 Clc1ccc(C2CCN2)c(Br)c1 Amb27441792 [0,1,0,1,0,0|2,0,0]=4 12980 B13R2.13518 Clc1ccc(C2CNC2)c(Br)c1 Amb28135517 [0,1,0,1,0,0|0,0,0]=2 12981 B13R2.13518 Clc1ccc(C2CNC2)c(Cl)c1 Amb18066341 [0,1,0,1,0,0|0,1,0]=3 12982 B13R2.13518 Clc1ccc(C2CNC2)c(Cl)n1 Amb28388321 [0,1,0,1,0,0|1,1,0]=4 12983 B13R2.13518 Clc1ccc([C@@H]2CCN2)c(Br)c1 Amb27394463 [0,1,0,1,0,0|2,0,0]=4 12984 B13R2.13518 Clc1cnc(C2CNC2)c(Cl)c1 Amb24737327 [0,1,0,1,0,0|1,1,0]=4 12985 B13R2.13518 Fc1cc(Br)ccc1C2CNC2 Amb27455488 [0,1,0,1,0,0|0,1,0]=3 12986 B13R2.13518 Fc1cc(Br)ccc1C2COC2 Amb25287456 [0,1,0,1,0,0|1,1,0]=4 12987 B13R2.13518 Fc1cc(Br)cnc1C2CNC2 Amb27248086 [0,1,0,1,0,0|1,1,0]=4 12988 B13R2.13518 Fc1cc(Cl)ccc1C2CCC2 Amb32695925 [0,1,0,1,0,0|1,1,0]=4 12989 B13R2.13518 Fc1cc(Cl)ccc1C2CNC2 Amb25336441 [0,1,0,1,0,0|0,1,0]=3 12990 B13R2.13518 Fc1cc(I)ccc1C2CNC2 Amb27616808 [0,1,0,1,0,0|0,1,0]=3 12991 B13R2.13518 Fc1ccc(C2CCN2)c(Br)c1 Amb27389525 [0,1,0,1,0,0|2,0,0]=4 12992 B13R2.13518 Fc1ccc(C2CNC2)c(Br)c1 Amb26431139 [0,1,0,1,0,0|0,0,0]=2 12993 B13R2.13518 Fc1ccc(C2CNC2)c(Cl)c1 Amb24601342 [0,1,0,1,0,0|0,1,0]=3 12994 B13R2.13518 Fc1ccc(C2CNC2)c(F)c1 Amb18563894 [0,1,0,1,0,0|0,1,0]=3 12995 B13R2.13518 Fc1ccc(C2CNC2)c(I)c1 Amb28123225 [0,1,0,1,0,0|0,1,0]=3 12996 B13R2.13518 Nc1cc(Cl)ccc1C2CNC2 Amb27754578 [0,1,0,1,0,0|1,0,0]=3 12997 B13R2.13518 Nc1ccc(C2CNC2)c(Cl)c1 Amb27616734 [0,1,0,1,0,0|0,1,0]=3 12998 B13R2.13518 Oc1cc(Br)ccc1C2CNC2 Amb25798151 [0,1,0,1,0,0|1,0,0]=3 12999 B13R2.13518 Oc1cc(Cl)ccc1C2CNC2 Amb25962650 [0,1,0,1,0,0|1,0,0]=3 13000 B13R2.13518 Oc1cc(F)ccc1C2CNC2 Amb27616762 [0,1,0,1,0,0|1,0,0]=3 13001 B13R2.13518 Oc1ccc(C2CNC2)c(Cl)c1 Amb28385512 [0,1,0,1,0,0|0,1,0]=3 13002 B13R2.13518 Oc1ccc(C2CNC2)c(Cl)n1 Amb27247741 [0,1,0,1,0,0|1,1,0]=4 13003 B13R2.13518 Oc1ccc(C2CNC2)c(F)c1 Amb24484211 [0,1,0,1,0,0|0,1,0]=3 13004 B13R2.13518 Oc1ccc(C2CNC2)c(O)c1 Amb25684219 [0,1,0,1,0,0|1,0,0]=3 13005 B13R2.1 CCCC1CNc2ccccc21 Amb25882717 [0,1,0,1,0,0|2,0,0]=4 13006 B13R2.1 CNCC1C=Cc2ccccc21 Amb27463630 [0,1,0,1,0,0|1,0,0]=3 13007 B13R2.1 CNCC1CCc2ccccc21 Amb17470428 [0,1,0,1,0,0|1,0,0]=3 13008 B13R2.1 CNCC1CNc2ccccc21 Amb27864740 [0,1,0,1,0,0|1,0,0]=3 13009 B13R2.1 CNCC1COc2ccccc21 Amb23586279 [0,1,0,1,0,0|1,0,0]=3 13010 B13R2.1 CNCC1OCc2ccccc21 Amb34915058 [0,1,0,1,0,0|1,0,0]=3 13011 B13R2.1 CNCc1coc2ccccc12 Amb19649828 [0,1,0,1,0,0|1,0,1]=4 13012 B13R2.1 CNCc1csc2ccccc12 Amb18286790 [0,1,0,1,0,0|1,0,1]=4 13013 B13R2.1 CNCc1csc2ccccc12 Amb9147582 [0,1,0,1,0,0|1,0,1]=4 13014 B13R2.1 COCC1CSc2ccccc21 Amb27410794 [0,1,0,1,0,0|2,0,0]=4 13015 B13R2.1 COCC1NCc2ccccc21 Amb27457641 [0,1,0,1,0,0|2,0,0]=4 13016 B13R2.1 NNCC1CCc2ccccc21 Amb26474283 [0,1,0,1,0,0|2,0,0]=4 13017 B13R2.1 ONCC1CCc2ccccc21 Amb33146411 [0,1,0,1,0,0|2,0,0]=4 13018 B13R2.33 BrC1CCc2ccccc2CC1 Amb32653931 [0,1,0,1,0,0|2,0,0]=4 13019 B13R2.33 NC1CCc2ccccc2CC1 Amb26494515 [0,1,0,1,0,0|2,0,0]=4 13020 B13R2.33 NC1CCc2ccccc2CC1 Amb32662946 [0,1,0,1,0,0|2,0,0]=4 13021 B13R2.33 NC1CCc2ccccc2OC1 Amb28458276 [0,1,0,1,0,0|2,0,0]=4 13022 B13R2.33 NC1CCc2ccccc2OC1 Amb32652091 [0,1,0,1,0,0|2,0,0]=4 13023 B13R2.33 O=C1CCc2ccccc2CC1 Amb6359959 [0,1,0,1,0,0|2,0,0]=4 13024 B13R2.33 O=C1CCc2ccccc2OC1 Amb26925695 [0,1,0,1,0,0|2,0,0]=4 13025 B13R2.33 OC1CCc2ccccc2CC1 Amb25958001 [0,1,0,1,0,0|2,0,0]=4 13026 B13R2.33 OC1CCc2ccccc2NC1 Amb26078245 [0,1,0,1,0,0|2,0,0]=4 13027 B13R2.33 OC1CCc2ccccc2OC1 Amb27178603 [0,1,0,1,0,0|2,0,0]=4 13028 B13R2.45 CC1c2ccccc2CC1NN Amb29855809 [0,1,0,1,0,0|2,0,0]=4 13029 B13R2.45 CC1c2ccccc2CC1NO Amb29855874 [0,1,0,1,0,0|2,0,0]=4 13030 B13R2.45 CCC1Cc2ccccc2C1=O Amb4605959 [0,1,0,1,0,0|2,0,0]=4 13031 B13R2.45 CCC1Cc2ccccc2C1Br Amb27588452 [0,1,0,1,0,0|1,0,0]=3 13032 B13R2.45 CCC1Cc2ccccc2C1Cl Amb18186760 [0,1,0,1,0,0|1,1,0]=4 13033 B13R2.45 CCC1Oc2ccccc2C1N Amb26844209 [0,1,0,1,0,0|2,0,0]=4 13034 B13R2.45 CC[C@@H]1Cc2ccccc2C1=O Amb27262889 [0,1,0,1,0,0|2,0,0]=4 13035 B13R2.45 CC[C@@H]1Nc2ccccc2[C@@H]1C Amb27965504 [0,1,0,1,0,0|2,0,0]=4 13036 B13R2.45 CNC1Cc2ccccc2C1C Amb29855873 [0,1,0,1,0,0|1,0,0]=3 13037 B13R2.45 CNC1Cc2ccccc2C1O Amb18645898 [0,1,0,1,0,0|1,0,0]=3 13038 B13R2.45 CN[C@@H]1Cc2ccccc2[C@H]1O Amb24056611 [0,1,0,1,0,0|1,0,0]=3 13039 B13R2.45 CN[C@H]1Cc2ccccc2[C@@H]1O Amb9133996 [0,1,0,1,0,0|1,0,0]=3 13040 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,1,0,1,0,0|2,0,0]=4 13041 B13R2.45 COC1Cc2ccccc2C1Cl Amb27178097 [0,1,0,1,0,0|1,1,0]=4 13042 B13R2.45 COC1Cc2ccccc2C1N Amb1140146 [0,1,0,1,0,0|2,0,0]=4 13043 B13R2.45 COC1Cc2ccccc2C1N Amb32656099 [0,1,0,1,0,0|2,0,0]=4 13044 B13R2.45 COC1Cc2ccccc2C1O Amb18800787 [0,1,0,1,0,0|2,0,0]=4 13045 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1Cl Amb27637752 [0,1,0,1,0,0|1,1,0]=4 13046 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1O Amb27443198 [0,1,0,1,0,0|2,0,0]=4 13047 B13R2.45 CO[C@@H]1Cc2ccccc2[C@H]1N Amb27238773 [0,1,0,1,0,0|2,0,0]=4 13048 B13R2.45 CO[C@H]1Cc2ccccc2[C@@H]1Cl Amb28051829 [0,1,0,1,0,0|1,1,0]=4 13049 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb24567956 [0,1,0,1,0,0|2,0,0]=4 13050 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb32656192 [0,1,0,1,0,0|2,0,0]=4 13051 B13R2.45 CSC1Cc2ccccc2C1=O Amb28054308 [0,1,0,1,0,0|2,0,0]=4 13052 B13R2.45 CSC1Cc2ccccc2C1O Amb28127814 [0,1,0,1,0,0|2,0,0]=4 13053 B13R2.57 BrCC1CCc2ccccc2C1 Amb22342463 [0,1,0,1,0,0|2,0,0]=4 13054 B13R2.57 BrCC1CCc2ccccc2N1 Amb28385156 [0,1,0,1,0,0|2,0,0]=4 13055 B13R2.57 BrCC1CCc2ccccc2O1 Amb10067609 [0,1,0,1,0,0|2,0,0]=4 13056 B13R2.57 C=NN1CCc2ccccc2C1 Amb27831186 [0,1,0,1,0,0|1,0,1]=4 13057 B13R2.57 CCC1CCc2ccccc2C1 Amb25062921 [0,1,0,1,0,0|2,0,0]=4 13058 B13R2.57 CCC1CCc2ccccc2N1 Amb20624014 [0,1,0,1,0,0|2,0,0]=4 13059 B13R2.57 CCC1CNc2ccccc2C1 Amb5746016 [0,1,0,1,0,0|2,0,0]=4 13060 B13R2.57 CCC1CNc2ccccc2N1 Amb17468271 [0,1,0,1,0,0|2,0,0]=4 13061 B13R2.57 CCC1CNc2ccccc2O1 Amb17097654 [0,1,0,1,0,0|2,0,0]=4 13062 B13R2.57 CCC1CNc2ccccc2S1 Amb17308082 [0,1,0,1,0,0|2,0,0]=4 13063 B13R2.57 CCC1COc2ccccc2N1 Amb17570081 [0,1,0,1,0,0|2,0,0]=4 13064 B13R2.57 CCC1Cc2ccccc2CN1 Amb18947349 [0,1,0,1,0,0|2,0,0]=4 13065 B13R2.57 CCN1CCc2ncccc2C1 Amb27659792 [0,1,0,1,0,0|2,0,0]=4 13066 B13R2.57 CCN1CNc2ccccc2C1 Amb27631435 [0,1,0,1,0,0|2,0,0]=4 13067 B13R2.57 CC[C@@H]1CCc2ccccc2S1 Amb27808538 [0,1,0,1,0,0|2,0,0]=4 13068 B13R2.57 CNC1=Nc2ccccc2CC1 Amb26443433 [0,1,0,1,0,0|1,0,0]=3 13069 B13R2.57 CNC1=Nc2ccccc2CN1 Amb27477971 [0,1,0,1,0,0|1,0,1]=4 13070 B13R2.57 CNC1=Nc2ccccc2CS1 Amb27616677 [0,1,0,1,0,0|1,0,1]=4 13071 B13R2.57 CNC1CCc2ccccc2C1 Amb22002469 [0,1,0,1,0,0|1,0,0]=3 13072 B13R2.57 CNC1CCc2ccccc2C1 Amb9223264 [0,1,0,1,0,0|1,0,0]=3 13073 B13R2.57 CNC1CCc2cccnc2C1 Amb27876709 [0,1,0,1,0,0|2,0,0]=4 13074 B13R2.57 CNC1CNc2ccccc2C1 Amb27441098 [0,1,0,1,0,0|1,0,0]=3 13075 B13R2.57 CNC1COc2ccccc2C1 Amb27643392 [0,1,0,1,0,0|1,0,0]=3 13076 B13R2.57 CNC1CSc2ccccc2C1 Amb28143150 [0,1,0,1,0,0|1,0,0]=3 13077 B13R2.57 CN[C@@H]1CNc2ccccc2C1 Amb22745775 [0,1,0,1,0,0|1,0,0]=3 13078 B13R2.57 CN[C@@H]1CNc2ccccc2C1 Amb32405732 [0,1,0,1,0,0|1,0,0]=3 13079 B13R2.57 CN[C@H]1CNc2ccccc2C1 Amb22232573 [0,1,0,1,0,0|1,0,0]=3 13080 B13R2.57 COC1=Nc2ccccc2CC1 Amb27179706 [0,1,0,1,0,0|2,0,0]=4 13081 B13R2.57 COC1CNc2ccccc2C1 Amb27878523 [0,1,0,1,0,0|2,0,0]=4 13082 B13R2.57 ClCC1CCc2ccccc2O1 Amb22490731 [0,1,0,1,0,0|2,0,0]=4 13083 B13R2.57 ClC[C@H]1CCc2ccccc2O1 Amb27400325 [0,1,0,1,0,0|2,0,0]=4 13084 B13R2.57 ICC1CCc2ccccc2C1 Amb24483732 [0,1,0,1,0,0|2,0,0]=4 13085 B13R2.57 ICC1CCc2ccccc2N1 Amb27613016 [0,1,0,1,0,0|2,0,0]=4 13086 B13R2.57 NCC1=Cc2ccccc2CC1 Amb18063880 [0,1,0,1,0,0|2,0,0]=4 13087 B13R2.57 NCC1CCc2ccccc2C1 Amb17470427 [0,1,0,1,0,0|2,0,0]=4 13088 B13R2.57 NCC1CCc2ccccc2C1 Amb19515414 [0,1,0,1,0,0|2,0,0]=4 13089 B13R2.57 NCC1CCc2ccccc2N1 Amb1128864 [0,1,0,1,0,0|2,0,0]=4 13090 B13R2.57 NCC1CCc2ccccc2N1 Amb32644510 [0,1,0,1,0,0|2,0,0]=4 13091 B13R2.57 NCC1CCc2ccccc2N1 Amb33529815 [0,1,0,1,0,0|2,0,0]=4 13092 B13R2.57 NCC1CCc2ccccc2O1 Amb24105807 [0,1,0,1,0,0|2,0,0]=4 13093 B13R2.57 NCC1CCc2ccccc2O1 Amb30634299 [0,1,0,1,0,0|2,0,0]=4 13094 B13R2.57 NC[C@@H]1CCc2ccccc2O1 Amb22746822 [0,1,0,1,0,0|2,0,0]=4 13095 B13R2.57 NC[C@@H]1CCc2ccccc2O1 Amb24681124 [0,1,0,1,0,0|2,0,0]=4 13096 B13R2.57 NC[C@H]1CCc2ccccc2O1 Amb22225387 [0,1,0,1,0,0|2,0,0]=4 13097 B13R2.57 NC[C@H]1CCc2ccccc2O1 Amb33870992 [0,1,0,1,0,0|2,0,0]=4 13098 B13R2.57 NNC1CCc2ccccc2N1 Amb27644642 [0,1,0,1,0,0|2,0,0]=4 13099 B13R2.57 NNC1COc2ccccc2C1 Amb25027393 [0,1,0,1,0,0|2,0,0]=4 13100 B13R2.57 O=NN1CCc2ccccc2C1 Amb22372302 [0,1,0,1,0,0|2,0,0]=4 13101 B13R2.57 OCC1CCc2ccccc2C1 Amb6360166 [0,1,0,1,0,0|2,0,0]=4 13102 B13R2.57 OCC1CCc2ccccc2N1 Amb21856776 [0,1,0,1,0,0|2,0,0]=4 13103 B13R2.57 OCC1CCc2ccccc2O1 Amb2724973 [0,1,0,1,0,0|2,0,0]=4 13104 B13R2.57 OC[C@@H]1CCc2ccccc2O1 Amb27467407 [0,1,0,1,0,0|2,0,0]=4 13105 B13R2.57 OC[C@H]1CCc2ccccc2O1 Amb27391113 [0,1,0,1,0,0|2,0,0]=4 13106 B13R2.67 c1ccc2c(c1)CCCCCC2 Amb6359536 [0,1,0,1,0,0|2,0,0]=4 13107 B13R2.67 c1ccc2c(c1)CCCCCN2 Amb19148899 [0,1,0,1,0,0|2,0,0]=4 13108 B13R2.67 c1ccc2c(c1)CCCCCN2 Amb24665820 [0,1,0,1,0,0|2,0,0]=4 13109 B13R2.67 c1ccc2c(c1)CCCCCS2 Amb27608014 [0,1,0,1,0,0|2,0,0]=4 13110 B13R2.67 c1ccc2c(c1)CCCCNC2 Amb27616673 [0,1,0,1,0,0|2,0,0]=4 13111 B13R2.67 c1ccc2c(c1)CCCNCC2 Amb28246443 [0,1,0,1,0,0|1,0,0]=3 13112 B13R2.67 c1ccc2c(c1)CNCCCN2 Amb24183951 [0,1,0,1,0,0|2,0,0]=4 13113 B13R2.67 c1ccc2c(c1)CNCCCO2 Amb5750868 [0,1,0,1,0,0|2,0,0]=4 13114 B13R2.67 c1ccc2c(c1)NCCCCN2 Amb10606982 [0,1,0,1,0,0|2,0,0]=4 13115 B13R2.67 c1ccc2c(c1)NCCCCS2 Amb27407135 [0,1,0,1,0,0|2,0,0]=4 13116 B13R2.92 CNc1ccccc1C2CC2C Amb27230006 [0,1,0,1,0,0|2,0,0]=4 13117 B13R2.92 CNc1ccccc1[C@@H]2C[C@@H]2C Amb27210914 [0,1,0,1,0,0|2,0,0]=4 13118 B13R2.92 CNc1ccccc1[C@H]2C[C@@H]2C Amb27793126 [0,1,0,1,0,0|2,0,0]=4 13119 B13R2.573 CN1CCc2c(CCl)ccnc21 Amb27654167 [0,1,0,1,0,0|1,1,0]=4 13120 B13R2.573 CN1CCc2c(CN)cccc21 Amb23585991 [0,1,0,1,0,0|1,0,0]=3 13121 B13R2.573 CN1CCc2c(CO)ccnc21 Amb28076027 [0,1,0,1,0,0|2,0,0]=4 13122 B13R2.573 COc1cccc2c1CCN2C Amb17673961 [0,1,0,1,0,0|1,0,0]=3 13123 B13R2.573 Cn1ccc2c(CBr)cccc21 Amb23412017 [0,1,0,1,0,0|0,0,2]=4 13124 B13R2.573 Cn1ncc2c(CBr)cccc21 Amb13890500 [0,1,0,1,0,0|1,0,1]=4 13125 B13R2.573 Cn1ncc2c(CBr)cccc21 Amb32412247 [0,1,0,1,0,0|1,0,1]=4 13126 B13R2.621 BrCc1ccccc1OC2CC2 Amb25876156 [0,1,0,1,0,0|2,0,0]=4 13127 B13R2.621 C#Cc1ccccc1CC2CO2 Amb33374292 [0,1,0,1,0,0|2,0,0]=4 13128 B13R2.621 CCc1ccccc1CC2CO2 Amb26500050 [0,1,0,1,0,0|2,0,0]=4 13129 B13R2.621 COc1ccccc1CC2CO2 Amb2608070 [0,1,0,1,0,0|2,0,0]=4 13130 B13R2.621 CSc1ccccc1CC2CO2 Amb32698718 [0,1,0,1,0,0|2,0,0]=4 13131 B13R2.621 N#Cc1ccccc1CC2CO2 Amb33204309 [0,1,0,1,0,0|2,0,0]=4 13132 B13R2.1613 BrCc1cccc2c1CCCC2 Amb27463163 [0,1,0,1,0,0|1,0,0]=3 13133 B13R2.1613 BrCc1cccc2c1CCOC2 Amb32650562 [0,1,0,1,0,0|1,0,0]=3 13134 B13R2.1613 C#Cc1cccc2c1CCCC2 Amb18787636 [0,1,0,1,0,0|2,0,0]=4 13135 B13R2.1613 C#Cc1ccnc2c1CCNC2 Amb27157149 [0,1,0,1,0,0|2,0,0]=4 13136 B13R2.1613 C=Cc1cccc2c1CCCC2 Amb26459941 [0,1,0,1,0,0|2,0,0]=4 13137 B13R2.1613 C=Cc1ccnc2c1CCNC2 Amb27223394 [0,1,0,1,0,0|2,0,0]=4 13138 B13R2.1613 CCc1cccc2c1CCNC2 Amb18947410 [0,1,0,1,0,0|1,0,0]=3 13139 B13R2.1613 COc1cccc2c1CCCC2 Amb17673064 [0,1,0,1,0,0|2,0,0]=4 13140 B13R2.1613 COc1cccc2c1CCNC2 Amb22229990 [0,1,0,1,0,0|1,0,0]=3 13141 B13R2.1613 COc1cccc2c1CCNC2 Amb2383352 [0,1,0,1,0,0|1,0,0]=3 13142 B13R2.1613 COc1cccc2c1CCOC2 Amb25187463 [0,1,0,1,0,0|2,0,0]=4 13143 B13R2.1613 COc1ccnc2c1CCNC2 Amb28146065 [0,1,0,1,0,0|2,0,0]=4 13144 B13R2.1613 COc1nccc2c1CCNC2 Amb28289165 [0,1,0,1,0,0|2,0,0]=4 13145 B13R2.1613 ClCc1cccc2c1CCCC2 Amb24390811 [0,1,0,1,0,0|1,1,0]=4 13146 B13R2.1613 ClCc1cccc2c1CCOC2 Amb25951068 [0,1,0,1,0,0|1,1,0]=4 13147 B13R2.1613 N#Cc1cccc2c1CCCC2 Amb22494806 [0,1,0,1,0,0|2,0,0]=4 13148 B13R2.1613 N#Cc1cccc2c1CCNC2 Amb22585546 [0,1,0,1,0,0|1,0,0]=3 13149 B13R2.1613 N#Cc1cccc2c1CCNC2 Amb2383356 [0,1,0,1,0,0|1,0,0]=3 13150 B13R2.1613 N#Cc1cccc2c1CCOC2 Amb27641211 [0,1,0,1,0,0|2,0,0]=4 13151 B13R2.1613 NCc1cccc2c1CCCC2 Amb25187497 [0,1,0,1,0,0|2,0,0]=4 13152 B13R2.1613 NCc1cccc2c1CCCC2 Amb33734453 [0,1,0,1,0,0|2,0,0]=4 13153 B13R2.1613 NCc1cccc2c1CCNC2 Amb26970774 [0,1,0,1,0,0|1,0,0]=3 13154 B13R2.1613 NCc1cccc2c1CCNC2 Amb30585035 [0,1,0,1,0,0|1,0,0]=3 13155 B13R2.1613 NCc1cccc2c1CCOC2 Amb27946757 [0,1,0,1,0,0|2,0,0]=4 13156 B13R2.1613 NNc1cccc2c1CCCC2 Amb10609195 [0,1,0,1,0,0|2,0,0]=4 13157 B13R2.1613 NNc1cccc2c1CCCC2 Amb6242385 [0,1,0,1,0,0|2,0,0]=4 13158 B13R2.1613 NOc1cccc2c1CCCC2 Amb26876460 [0,1,0,1,0,0|2,0,0]=4 13159 B13R2.1613 O=Cc1cccc2c1CCCC2 Amb18645373 [0,1,0,1,0,0|2,0,0]=4 13160 B13R2.1613 O=Cc1cccc2c1CCOC2 Amb18829763 [0,1,0,1,0,0|2,0,0]=4 13161 B13R2.1613 OCc1cccc2c1CCCC2 Amb22235944 [0,1,0,1,0,0|2,0,0]=4 13162 B13R2.1613 OCc1cccc2c1CCOC2 Amb25353854 [0,1,0,1,0,0|2,0,0]=4 13163 B13R2.1613 SCc1cccc2c1CCCC2 Amb33316126 [0,1,0,1,0,0|2,0,0]=4 13164 B13R2.1613 [C-]#[N+]c1cccc2c1CCCC2 Amb32797404 [0,1,0,1,0,0|2,0,0]=4 13165 B13R2.1613 [NH3+]Nc1cccc2c1CCCC2 Amb2407107 [0,1,0,1,0,0|2,0,0]=4 13166 B13R2.2528 BrCc1ccccc1N2CCC2 Amb27608150 [0,1,0,1,0,0|2,0,0]=4 13167 B13R2.2528 C#Cc1ccccc1C2CNC2 Amb33204018 [0,1,0,1,0,0|1,0,0]=3 13168 B13R2.2528 C#Cc1cccnc1C2CNC2 Amb27410429 [0,1,0,1,0,0|2,0,0]=4 13169 B13R2.2528 C#Cc1ccncc1C2CNC2 Amb24623116 [0,1,0,1,0,0|2,0,0]=4 13170 B13R2.2528 C#Cc1cnccc1C2CNC2 Amb28367745 [0,1,0,1,0,0|2,0,0]=4 13171 B13R2.2528 C#Cc1ncccc1C2CNC2 Amb25985719 [0,1,0,1,0,0|2,0,0]=4 13172 B13R2.2528 C=Cc1cccnc1C2CNC2 Amb27951010 [0,1,0,1,0,0|2,0,0]=4 13173 B13R2.2528 C=Cc1ccncc1C2CNC2 Amb27953032 [0,1,0,1,0,0|2,0,0]=4 13174 B13R2.2528 C=Cc1cnccc1C2CNC2 Amb27945823 [0,1,0,1,0,0|2,0,0]=4 13175 B13R2.2528 C=Cc1ncccc1C2CNC2 Amb24471338 [0,1,0,1,0,0|2,0,0]=4 13176 B13R2.2528 CCc1ccccc1C2CNC2 Amb25806190 [0,1,0,1,0,0|1,0,0]=3 13177 B13R2.2528 COc1ccccc1C2CNC2 Amb18563580 [0,1,0,1,0,0|1,0,0]=3 13178 B13R2.2528 COc1ccccc1C2COC2 Amb28205363 [0,1,0,1,0,0|2,0,0]=4 13179 B13R2.2528 COc1cccnc1C2CNC2 Amb24484207 [0,1,0,1,0,0|2,0,0]=4 13180 B13R2.2528 COc1ccncc1C2CNC2 Amb28399385 [0,1,0,1,0,0|2,0,0]=4 13181 B13R2.2528 COc1ncccc1C2CNC2 Amb28141909 [0,1,0,1,0,0|2,0,0]=4 13182 B13R2.2528 CSc1ccccc1C2CNC2 Amb27616923 [0,1,0,1,0,0|1,0,0]=3 13183 B13R2.2528 N#Cc1ccccc1C2CNC2 Amb26627757 [0,1,0,1,0,0|1,0,0]=3 13184 B13R2.2528 N#Cc1ccccc1C2COC2 Amb27872804 [0,1,0,1,0,0|2,0,0]=4 13185 B13R2.2528 N#Cc1ncccc1C2CNC2 Amb27228882 [0,1,0,1,0,0|2,0,0]=4 13186 B13R2.2528 NCc1ccccc1C2CCC2 Amb25048615 [0,1,0,1,0,0|2,0,0]=4 13187 B13R2.2528 O=Cc1ccccc1C2CCC2 Amb24713030 [0,1,0,1,0,0|2,0,0]=4 13188 B13R2.2528 O=Cc1ccccc1C2CSC2 Amb28196618 [0,1,0,1,0,0|2,0,0]=4 13189 B13R2.2528 OCc1ccccc1C2CCC2 Amb24439851 [0,1,0,1,0,0|2,0,0]=4 13190 B13R2.216 CN1CC(c2ccccc2N)C1 Amb27813569 [0,1,0,1,0,0|1,0,0]=3 13191 B13R2.216 CN1CC(c2ccccc2O)C1 Amb28053131 [0,1,0,1,0,0|1,0,0]=3 13192 B13R2.216 Cc1ccccc1C2CC(=O)C2 Amb19286389 [0,1,0,1,0,0|2,0,0]=4 13193 B13R2.216 Cc1ccccc1C2CC(N)C2 Amb19148955 [0,1,0,1,0,0|2,0,0]=4 13194 B13R2.216 Cc1ccccc1C2CC(N)C2 Amb9497090 [0,1,0,1,0,0|2,0,0]=4 13195 B13R2.216 Cc1ccccc1C2CC(S)C2 Amb32788511 [0,1,0,1,0,0|2,0,0]=4 13196 B13R2.216 Cc1ccccc1[C@H]2C[C@H](N)C2 Amb24624964 [0,1,0,1,0,0|2,0,0]=4 13197 B13R2.216 Cc1ccccc1[C@H]2C[C@H](N)C2 Amb33172741 [0,1,0,1,0,0|2,0,0]=4 13198 B13R2.216 Fc1ccccc1C2CC(S)C2 Amb32788106 [0,1,0,1,0,0|1,1,0]=4 13199 B13R2.216 NC1CC(c2ccccc2Br)C1 Amb33548170 [0,1,0,1,0,0|1,0,0]=3 13200 B13R2.216 NC1CC(c2ccccc2Br)C1 Amb9497091 [0,1,0,1,0,0|1,0,0]=3 13201 B13R2.216 NC1CC(c2ccccc2Cl)C1 Amb19374604 [0,1,0,1,0,0|1,1,0]=4 13202 B13R2.216 NC1CC(c2ccccc2Cl)C1 Amb9497078 [0,1,0,1,0,0|1,1,0]=4 13203 B13R2.216 NC1CC(c2ccccc2F)C1 Amb19373545 [0,1,0,1,0,0|1,1,0]=4 13204 B13R2.216 NC1CC(c2ccccc2F)C1 Amb9497084 [0,1,0,1,0,0|1,1,0]=4 13205 B13R2.216 N[C@H]1C[C@H](c2ccccc2Cl)C1 Amb24683487 [0,1,0,1,0,0|1,1,0]=4 13206 B13R2.216 N[C@H]1C[C@H](c2ccccc2Cl)C1 Amb33473657 [0,1,0,1,0,0|1,1,0]=4 13207 B13R2.216 N[C@H]1C[C@H](c2ccccc2F)C1 Amb25159862 [0,1,0,1,0,0|1,1,0]=4 13208 B13R2.216 N[C@H]1C[C@H](c2ccccc2F)C1 Amb33473636 [0,1,0,1,0,0|1,1,0]=4 13209 B13R2.216 O=C1CC(c2ccccc2Br)C1 Amb20622984 [0,1,0,1,0,0|1,0,0]=3 13210 B13R2.216 O=C1CC(c2ccccc2Br)N1 Amb28141377 [0,1,0,1,0,0|2,0,0]=4 13211 B13R2.216 O=C1CC(c2ccccc2Cl)C1 Amb20622983 [0,1,0,1,0,0|1,1,0]=4 13212 B13R2.216 O=C1CC(c2ccccc2F)C1 Amb19286390 [0,1,0,1,0,0|1,1,0]=4 13213 B13R2.216 OC1CC(c2ccccc2Br)C1 Amb27946357 [0,1,0,1,0,0|1,0,0]=3 13214 B13R2.216 OC1CC(c2ccccc2Cl)C1 Amb19057039 [0,1,0,1,0,0|1,1,0]=4 13215 B13R2.216 OC1CC(c2ccccc2F)C1 Amb18792758 [0,1,0,1,0,0|1,1,0]=4 13216 B13R2.216 O[C@H]1C[C@@H](c2ccccc2Cl)C1 Amb25933889 [0,1,0,1,0,0|1,1,0]=4 13217 B13R2.216 O[C@H]1C[C@@H](c2ccccc2F)C1 Amb26957371 [0,1,0,1,0,0|1,1,0]=4 13218 B13R2.216 O[C@H]1C[C@H](c2ccccc2F)C1 Amb33803924 [0,1,0,1,0,0|1,1,0]=4 13219 B13R2.216 SC1CC(c2ccccc2Br)C1 Amb32788435 [0,1,0,1,0,0|1,0,0]=3 13220 B13R2.216 SC1CC(c2ccccc2Cl)C1 Amb32788551 [0,1,0,1,0,0|1,1,0]=4 13221 B13R2.222 CC1(C)CCc2ccccc2N1 Amb33527122 [0,1,0,1,0,0|2,0,0]=4 13222 B13R2.222 CC1(C)CCc2ccccc2N1 Amb33544066 [0,1,0,1,0,0|2,0,0]=4 13223 B13R2.222 CC1(C)CCc2ccccc2O1 Amb4477178 [0,1,0,1,0,0|2,0,0]=4 13224 B13R2.222 CC1(N)CCc2ccccc2C1 Amb18943712 [0,1,0,1,0,0|2,0,0]=4 13225 B13R2.222 CC1(N)CCc2ccccc2C1 Amb33620958 [0,1,0,1,0,0|2,0,0]=4 13226 B13R2.222 CC1(O)CCc2ccccc2C1 Amb18792426 [0,1,0,1,0,0|2,0,0]=4 13227 B13R2.377 Cc1ccccc1CC2OC2Cl Amb28125202 [0,1,0,1,0,0|2,0,0]=4 13228 B13R2.377 NC1CC1Cc2ccccc2Br Amb27796569 [0,1,0,1,0,0|1,0,0]=3 13229 B13R2.435 CC(=O)C1Cc2ccccc2C1 Amb10071756 [0,1,0,1,0,0|2,0,0]=4 13230 B13R2.435 CC(=O)C1Cc2ccccc2N1 Amb28423109 [0,1,0,1,0,0|2,0,0]=4 13231 B13R2.435 CC(=O)C1Cc2ccccc2O1 Amb23586288 [0,1,0,1,0,0|2,0,0]=4 13232 B13R2.435 CC(C)C1Cc2ccccc2N1 Amb18560784 [0,1,0,1,0,0|2,0,0]=4 13233 B13R2.435 CC(F)C1Cc2ccccc2N1 Amb27791329 [0,1,0,1,0,0|2,0,0]=4 13234 B13R2.435 CC(N)C1Cc2ccccc2C1 Amb25790175 [0,1,0,1,0,0|2,0,0]=4 13235 B13R2.435 CC(N)C1Cc2ccccc2O1 Amb18645904 [0,1,0,1,0,0|2,0,0]=4 13236 B13R2.435 CC(O)C1Cc2ccccc2O1 Amb27977019 [0,1,0,1,0,0|2,0,0]=4 13237 B13R2.435 CN(C)C1Cc2ccccc2C1 Amb16230021 [0,1,0,1,0,0|1,0,0]=3 13238 B13R2.435 CN(C)C1Cc2ccccc2C1 Amb21959611 [0,1,0,1,0,0|1,0,0]=3 13239 B13R2.435 C[C@@H](N)C1Cc2ccccc2C1 Amb27413870 [0,1,0,1,0,0|2,0,0]=4 13240 B13R2.435 C[C@@H](N)C1Cc2ccccc2O1 Amb25118306 [0,1,0,1,0,0|2,0,0]=4 13241 B13R2.435 C[C@@H](O)C1Cc2ccccc2C1 Amb26901996 [0,1,0,1,0,0|2,0,0]=4 13242 B13R2.435 C[C@H](N)C1Cc2ccccc2C1 Amb26505867 [0,1,0,1,0,0|2,0,0]=4 13243 B13R2.435 C[C@H](N)C1Cc2ccccc2O1 Amb27252904 [0,1,0,1,0,0|2,0,0]=4 13244 B13R2.435 C[C@H](O)C1Cc2ccccc2C1 Amb24377688 [0,1,0,1,0,0|2,0,0]=4 13245 B13R2.435 C[C@H](O)C1Cc2ccccc2O1 Amb28314024 [0,1,0,1,0,0|2,0,0]=4 13246 B13R2.435 C[C@H](O)[C@@H]1Cc2ccccc2N1 Amb27642314 [0,1,0,1,0,0|2,0,0]=4 13247 B13R2.435 C[C@H](O)[C@@H]1Cc2ccccc2O1 Amb27472521 [0,1,0,1,0,0|2,0,0]=4 13248 B13R2.3571 CC1(N)CC1c2ccccc2Br Amb28132963 [0,1,0,1,0,0|1,0,0]=3 13249 B13R2.3571 CC1(N)CC1c2ccccc2O Amb28053001 [0,1,0,1,0,0|2,0,0]=4 13250 B13R2.3571 Cc1ccccc1C2CC2(C)N Amb27876817 [0,1,0,1,0,0|2,0,0]=4 13251 B13R2.3587 Brc1ccccc1CCC2CO2 Amb28127052 [0,1,0,1,0,0|1,0,0]=3 13252 B13R2.3587 Brc1ccccc1CNC2CC2 Amb6249959 [0,1,0,1,0,0|1,0,0]=3 13253 B13R2.3587 Brc1ccccc1NCC2CC2 Amb9423083 [0,1,0,1,0,0|1,0,0]=3 13254 B13R2.3587 Brc1ccccc1OCC2CC2 Amb9423180 [0,1,0,1,0,0|1,0,0]=3 13255 B13R2.3587 Brc1ccccc1OCC2CO2 Amb6279338 [0,1,0,1,0,0|1,0,0]=3 13256 B13R2.3587 Brc1cccnc1NCC2CC2 Amb18979323 [0,1,0,1,0,0|2,0,0]=4 13257 B13R2.3587 Brc1cccnc1OCC2CC2 Amb25863182 [0,1,0,1,0,0|2,0,0]=4 13258 B13R2.3587 Brc1cccnc1SC[C@H]2CO2 Amb28070493 [0,1,0,1,0,0|2,0,0]=4 13259 B13R2.3587 Brc1cnccc1CNC2CC2 Amb24626860 [0,1,0,1,0,0|2,0,0]=4 13260 B13R2.3587 Brc1cnccc1OCC2CC2 Amb24702207 [0,1,0,1,0,0|2,0,0]=4 13261 B13R2.3587 Brc1ncccc1OCC2CC2 Amb26314174 [0,1,0,1,0,0|2,0,0]=4 13262 B13R2.3587 Cc1ccccc1CCC2CO2 Amb27404266 [0,1,0,1,0,0|2,0,0]=4 13263 B13R2.3587 Cc1ccccc1CNC2CC2 Amb1116359 [0,1,0,1,0,0|2,0,0]=4 13264 B13R2.3587 Cc1ccccc1NCC2CC2 Amb9423101 [0,1,0,1,0,0|2,0,0]=4 13265 B13R2.3587 Cc1ccccc1OCC2CO2 Amb1651061 [0,1,0,1,0,0|2,0,0]=4 13266 B13R2.3587 Cc1ccccc1OC[C@@H]2CO2 Amb10071086 [0,1,0,1,0,0|2,0,0]=4 13267 B13R2.3587 Cc1ccccc1OC[C@H]2CO2 Amb10071085 [0,1,0,1,0,0|2,0,0]=4 13268 B13R2.3587 Cc1ccccc1SCC2CO2 Amb18796317 [0,1,0,1,0,0|2,0,0]=4 13269 B13R2.3587 Clc1ccccc1CCC2CO2 Amb27647321 [0,1,0,1,0,0|1,1,0]=4 13270 B13R2.3587 Clc1ccccc1CNC2CC2 Amb33527595 [0,1,0,1,0,0|1,1,0]=4 13271 B13R2.3587 Clc1ccccc1CNC2CC2 Amb6456038 [0,1,0,1,0,0|1,1,0]=4 13272 B13R2.3587 Clc1ccccc1NCC2CC2 Amb2383312 [0,1,0,1,0,0|1,1,0]=4 13273 B13R2.3587 Clc1ccccc1NCC2CC2 Amb24079957 [0,1,0,1,0,0|1,1,0]=4 13274 B13R2.3587 Clc1ccccc1OCC2CC2 Amb26349476 [0,1,0,1,0,0|1,1,0]=4 13275 B13R2.3587 Clc1ccccc1OCC2CO2 Amb9703520 [0,1,0,1,0,0|1,1,0]=4 13276 B13R2.3587 Clc1ccccc1OC[C@@H]2CO2 Amb27661562 [0,1,0,1,0,0|1,1,0]=4 13277 B13R2.3587 Fc1ccccc1CCC2CO2 Amb27748623 [0,1,0,1,0,0|1,1,0]=4 13278 B13R2.3587 Fc1ccccc1CNC2CC2 Amb22551475 [0,1,0,1,0,0|1,1,0]=4 13279 B13R2.3587 Fc1ccccc1CNC2CC2 Amb6356060 [0,1,0,1,0,0|1,1,0]=4 13280 B13R2.3587 Fc1ccccc1NCC2CC2 Amb9423086 [0,1,0,1,0,0|1,1,0]=4 13281 B13R2.3587 Fc1ccccc1OCC2CO2 Amb6662683 [0,1,0,1,0,0|1,1,0]=4 13282 B13R2.3587 Fc1ccccc1OC[C@@H]2CO2 Amb26326923 [0,1,0,1,0,0|1,1,0]=4 13283 B13R2.3587 Fc1ccccc1SC[C@@H]2CO2 Amb28255298 [0,1,0,1,0,0|1,1,0]=4 13284 B13R2.3587 Ic1ccccc1NCC2CC2 Amb9423119 [0,1,0,1,0,0|1,1,0]=4 13285 B13R2.3587 Nc1ccccc1CNC2CC2 Amb18973319 [0,1,0,1,0,0|2,0,0]=4 13286 B13R2.3587 Nc1ccccc1NCC2CC2 Amb9205245 [0,1,0,1,0,0|2,0,0]=4 13287 B13R2.3587 Nc1ccccc1OCC2CC2 Amb6680936 [0,1,0,1,0,0|2,0,0]=4 13288 B13R2.3587 Nc1ccccc1OCC2CC2 Amb6760609 [0,1,0,1,0,0|2,0,0]=4 13289 B13R2.3587 Nc1ccccc1SCC2CC2 Amb6760568 [0,1,0,1,0,0|2,0,0]=4 13290 B13R2.3587 Nc1ccccc1SCC2CC2 Amb9423231 [0,1,0,1,0,0|2,0,0]=4 13291 B13R2.3587 Oc1ccccc1CCC2CC2 Amb22752470 [0,1,0,1,0,0|2,0,0]=4 13292 B13R2.3587 Oc1ccccc1CNC2CC2 Amb1117096 [0,1,0,1,0,0|2,0,0]=4 13293 B13R2.3587 Oc1ccccc1OCC2CC2 Amb9423370 [0,1,0,1,0,0|2,0,0]=4 13294 B13R2.4848 CC1(C)CCc2c(O)cccc21 Amb18126341 [0,1,0,1,0,0|2,0,0]=4 13295 B13R2.4848 CC1(C)CNc2c(Br)cccc21 Amb18896987 [0,1,0,1,0,0|2,0,0]=4 13296 B13R2.4848 CC1(C)NCc2c(Br)cccc21 Amb18159989 [0,1,0,1,0,0|2,0,0]=4 13297 B13R2.4848 CC1(F)CCc2c(F)cccc21 Amb27846929 [0,1,0,1,0,0|1,1,0]=4 13298 B13R2.4848 CC1(F)CCc2c(O)cccc21 Amb27229409 [0,1,0,1,0,0|2,0,0]=4 13299 B13R2.4848 CC1(N)CCc2c(Br)cccc21 Amb27480895 [0,1,0,1,0,0|1,0,0]=3 13300 B13R2.4848 CC1(N)CCc2c(Cl)cccc21 Amb25997750 [0,1,0,1,0,0|1,1,0]=4 13301 B13R2.4848 CC1(N)CCc2c(F)cccc21 Amb25705304 [0,1,0,1,0,0|1,1,0]=4 13302 B13R2.4848 CC1(O)CCc2c(F)cccc21 Amb27807904 [0,1,0,1,0,0|1,1,0]=4 13303 B13R2.4848 Cc1cccc2c1CCC2(C)F Amb27259645 [0,1,0,1,0,0|2,0,0]=4 13304 B13R2.4848 Cc1cccc2c1CCC2(C)N Amb25280096 [0,1,0,1,0,0|2,0,0]=4 13305 B13R2.4848 FC1(F)CCc2c(Br)cccc21 Amb25996758 [0,1,0,1,0,0|2,0,0]=4 13306 B13R2.4848 O=S1(=O)CCc2c(Br)cccc21 Amb28368469 [0,1,0,1,0,0|2,0,0]=4 13307 B13R2.5179 CC1CCc2c(Br)cccc2N1 Amb27494999 [0,1,0,1,0,0|1,0,0]=3 13308 B13R2.5179 CC1CCc2c(Br)cccc2O1 Amb35744982 [0,1,0,1,0,0|1,0,0]=3 13309 B13R2.5179 CC1CCc2c(F)cccc2N1 Amb27248570 [0,1,0,1,0,0|1,1,0]=4 13310 B13R2.5179 CC1CCc2c(I)cccc2N1 Amb27436213 [0,1,0,1,0,0|1,1,0]=4 13311 B13R2.5179 CC1CCc2c(N)cccc2C1 Amb27842246 [0,1,0,1,0,0|2,0,0]=4 13312 B13R2.5179 CC1CCc2c(N)cccc2N1 Amb27762679 [0,1,0,1,0,0|2,0,0]=4 13313 B13R2.5179 CC1CCc2c(O)cccc2N1 Amb26847892 [0,1,0,1,0,0|2,0,0]=4 13314 B13R2.5179 CC1CCc2c(O)cccc2O1 Amb28246099 [0,1,0,1,0,0|2,0,0]=4 13315 B13R2.5179 CC1CNc2c(Br)cccc2C1 Amb5745992 [0,1,0,1,0,0|2,0,0]=4 13316 B13R2.5179 CC1COc2c(Br)cccc2N1 Amb17572161 [0,1,0,1,0,0|2,0,0]=4 13317 B13R2.5179 CC1Cc2cccc(Br)c2CN1 Amb25696856 [0,1,0,1,0,0|2,0,0]=4 13318 B13R2.5179 CN1CCc2c(Br)cccc2C1 Amb18463329 [0,1,0,1,0,0|0,0,0]=2 13319 B13R2.5179 CN1CCc2c(F)cccc2C1 Amb18463077 [0,1,0,1,0,0|0,1,0]=3 13320 B13R2.5179 CN1CCc2c(N)cccc2C1 Amb10610145 [0,1,0,1,0,0|1,0,0]=3 13321 B13R2.5179 CN1CCc2c(N)cccc2C1 Amb10610171 [0,1,0,1,0,0|1,0,0]=3 13322 B13R2.5179 CN1CCc2c(N)cccc2C1 Amb18943825 [0,1,0,1,0,0|1,0,0]=3 13323 B13R2.5179 CN1CCc2c(N)cncc2C1 Amb18829154 [0,1,0,1,0,0|2,0,0]=4 13324 B13R2.5179 CN1CCc2c(O)cccc2C1 Amb18645883 [0,1,0,1,0,0|1,0,0]=3 13325 B13R2.5179 C[C@@H]1CCc2c(Br)cccc2N1 Amb27206677 [0,1,0,1,0,0|1,0,0]=3 13326 B13R2.5179 C[C@@H]1CCc2c(O)cccc2N1 Amb27196380 [0,1,0,1,0,0|2,0,0]=4 13327 B13R2.5179 C[C@H]1CCc2c(Br)cccc2N1 Amb27166746 [0,1,0,1,0,0|1,0,0]=3 13328 B13R2.5179 C[C@H]1Cc2cccc(Br)c2CN1 Amb27951334 [0,1,0,1,0,0|2,0,0]=4 13329 B13R2.5179 Cc1cccc2c1CCC(=O)C2 Amb2695354 [0,1,0,1,0,0|2,0,0]=4 13330 B13R2.5179 Cc1cccc2c1CCC(N)C2 Amb27494018 [0,1,0,1,0,0|2,0,0]=4 13331 B13R2.5179 Cc1cccc2c1CCN(C)C2 Amb17970712 [0,1,0,1,0,0|1,0,0]=3 13332 B13R2.5179 Cc1cccc2c1CC[C@@H](N)C2 Amb27850554 [0,1,0,1,0,0|2,0,0]=4 13333 B13R2.5179 Cc1cccc2c1CC[C@H](N)C2 Amb27252044 [0,1,0,1,0,0|2,0,0]=4 13334 B13R2.5179 Cc1cccc2c1OCN(C)C2 Amb2611266 [0,1,0,1,0,0|2,0,0]=4 13335 B13R2.5179 NC1CCc2c(F)cccc2C1 Amb2383255 [0,1,0,1,0,0|1,1,0]=4 13336 B13R2.5179 NC1CCc2c(O)cccc2C1 Amb18645874 [0,1,0,1,0,0|2,0,0]=4 13337 B13R2.5179 NC1CNc2c(Br)cccc2C1 Amb25265680 [0,1,0,1,0,0|2,0,0]=4 13338 B13R2.5179 NC1COc2c(Br)cccc2C1 Amb2383396 [0,1,0,1,0,0|2,0,0]=4 13339 B13R2.5179 N[C@@H]1CCc2c(Cl)cccc2C1 Amb27596607 [0,1,0,1,0,0|1,1,0]=4 13340 B13R2.5179 N[C@@H]1CCc2c(S)cccc2C1 Amb27882705 [0,1,0,1,0,0|2,0,0]=4 13341 B13R2.5179 N[C@@H]1CNc2c(Br)cccc2C1 Amb28322022 [0,1,0,1,0,0|2,0,0]=4 13342 B13R2.5179 N[C@H]1CCc2c(O)cccc2C1 Amb28255369 [0,1,0,1,0,0|2,0,0]=4 13343 B13R2.5179 N[C@H]1COc2c(Br)cccc2C1 Amb27587476 [0,1,0,1,0,0|2,0,0]=4 13344 B13R2.5179 Nc1cccc2c1CCC(=O)C2 Amb4296877 [0,1,0,1,0,0|2,0,0]=4 13345 B13R2.5179 Nc1cccc2c1CCC(O)C2 Amb27623336 [0,1,0,1,0,0|2,0,0]=4 13346 B13R2.5179 O=C1CCc2c(Br)cccc2C1 Amb2695317 [0,1,0,1,0,0|1,0,0]=3 13347 B13R2.5179 O=C1CCc2c(Br)cccc2N1 Amb20075766 [0,1,0,1,0,0|2,0,0]=4 13348 B13R2.5179 O=C1CCc2c(Br)cccc2O1 Amb28246109 [0,1,0,1,0,0|2,0,0]=4 13349 B13R2.5179 O=C1CCc2c(Cl)cccc2C1 Amb4296959 [0,1,0,1,0,0|1,1,0]=4 13350 B13R2.5179 O=C1CCc2c(O)cccc2C1 Amb4296961 [0,1,0,1,0,0|2,0,0]=4 13351 B13R2.5179 O=C1CNc2c(Br)cccc2C1 Amb27163244 [0,1,0,1,0,0|2,0,0]=4 13352 B13R2.5179 O=C1COc2c(Br)cccc2C1 Amb15692701 [0,1,0,1,0,0|2,0,0]=4 13353 B13R2.5179 O=C1Cc2cccc(Br)c2CN1 Amb26375844 [0,1,0,1,0,0|2,0,0]=4 13354 B13R2.5179 OC1CCc2c(Cl)cccc2C1 Amb28398520 [0,1,0,1,0,0|1,1,0]=4 13355 B13R2.5179 OC1CNc2c(Br)cccc2C1 Amb27615209 [0,1,0,1,0,0|2,0,0]=4 13356 B13R2.5179 Oc1cccc2c1CCC(O)C2 Amb18646063 [0,1,0,1,0,0|2,0,0]=4 13357 B13R2.9 CCC1CNc2c(Br)cccc21 Amb25285156 [0,1,0,1,0,0|1,0,0]=3 13358 B13R2.9 CCC1CNc2c(C)cccc21 Amb18561137 [0,1,0,1,0,0|2,0,0]=4 13359 B13R2.9 CCC1CNc2c(Cl)cccc21 Amb18063418 [0,1,0,1,0,0|1,1,0]=4 13360 B13R2.9 CCC1CNc2c(F)cccc21 Amb18063417 [0,1,0,1,0,0|1,1,0]=4 13361 B13R2.9 CCC1CNc2c(N)cccc21 Amb32658305 [0,1,0,1,0,0|2,0,0]=4 13362 B13R2.9 CCC1NCc2c(Br)cccc21 Amb18160004 [0,1,0,1,0,0|1,0,0]=3 13363 B13R2.9 CCC1NCc2c(C)cccc21 Amb27792406 [0,1,0,1,0,0|2,0,0]=4 13364 B13R2.9 CCN1CCc2c(C)cccc21 Amb25669760 [0,1,0,1,0,0|1,0,0]=3 13365 B13R2.9 CCN1CCc2c(Cl)cccc21 Amb27451815 [0,1,0,1,0,0|0,1,0]=3 13366 B13R2.9 CCN1CCc2c(F)cccc21 Amb27649950 [0,1,0,1,0,0|0,1,0]=3 13367 B13R2.9 CCN1CCc2c(N)cccc21 Amb18669649 [0,1,0,1,0,0|1,0,0]=3 13368 B13R2.9 CCN1CCc2c(O)cccc21 Amb17594055 [0,1,0,1,0,0|1,0,0]=3 13369 B13R2.9 CCn1ccc2c(Br)cccc21 Amb26581122 [0,1,0,1,0,0|0,0,2]=4 13370 B13R2.9 CCn1cnc2c(Br)cccc21 Amb27962435 [0,1,0,1,0,0|1,0,1]=4 13371 B13R2.9 CCn1ncc2c(Br)cccc21 Amb26392546 [0,1,0,1,0,0|1,0,1]=4 13372 B13R2.9 CCn1nnc2c(Br)cccc21 Amb35749237 [0,1,0,1,0,0|2,0,0]=4 13373 B13R2.9 CNC1CCc2c(Br)cccc21 Amb28287212 [0,1,0,1,0,0|0,0,0]=2 13374 B13R2.9 CNC1CCc2c(Br)cncc21 Amb27641941 [0,1,0,1,0,0|1,0,0]=3 13375 B13R2.9 CNC1COc2c(F)cccc21 Amb9372633 [0,1,0,1,0,0|0,1,0]=3 13376 B13R2.9 Cc1cccc2c1CCC2CN Amb17232389 [0,1,0,1,0,0|2,0,0]=4 13377 B13R2.9 Fc1cccc2c1CCC2CCl Amb27856783 [0,1,0,1,0,0|1,1,0]=4 13378 B13R2.9 N#CC1CCc2c(Br)cccc21 Amb27796295 [0,1,0,1,0,0|1,0,1]=4 13379 B13R2.9 N#CC1CNc2c(Br)cccc21 Amb18063497 [0,1,0,1,0,0|2,0,0]=4 13380 B13R2.9 NCC1CCc2c(Br)cccc21 Amb27614754 [0,1,0,1,0,0|1,0,0]=3 13381 B13R2.9 NCC1CCc2c(Cl)cccc21 Amb17233877 [0,1,0,1,0,0|1,1,0]=4 13382 B13R2.9 NCC1CCc2c(F)cccc21 Amb17232534 [0,1,0,1,0,0|1,1,0]=4 13383 B13R2.9 NCC1CCc2c(O)cccc21 Amb27607267 [0,1,0,1,0,0|2,0,0]=4 13384 B13R2.9 NCC1CNc2c(Br)cccc21 Amb18063054 [0,1,0,1,0,0|2,0,0]=4 13385 B13R2.9 NCC1COc2c(Br)cccc21 Amb27448411 [0,1,0,1,0,0|2,0,0]=4 13386 B13R2.9 NNC1CCc2c(F)cccc21 Amb24502049 [0,1,0,1,0,0|1,1,0]=4 13387 B13R2.9 NNC1CCc2c(F)cccc21 Amb32663213 [0,1,0,1,0,0|1,1,0]=4 13388 B13R2.9 OCC1CNc2c(Br)cccc21 Amb18560961 [0,1,0,1,0,0|2,0,0]=4 13389 B13R2.9 OC[C@H]1NCc2c(Br)cccc21 Amb27615333 [0,1,0,1,0,0|2,0,0]=4 13390 B13R2.9 ONC1CCc2c(F)cccc21 Amb28061116 [0,1,0,1,0,0|1,1,0]=4 13391 B13R2.18 Brc1ccccc1C2CCCC2 Amb18760094 [0,1,0,1,0,0|1,0,0]=3 13392 B13R2.18 Brc1ccccc1C2CCCN2 Amb17659160 [0,1,0,1,0,0|1,0,0]=3 13393 B13R2.18 Brc1ccccc1C2CCCN2 Amb20626046 [0,1,0,1,0,0|1,0,0]=3 13394 B13R2.18 Brc1ccccc1C2CCCN2 Amb2237168 [0,1,0,1,0,0|1,0,0]=3 13395 B13R2.18 Brc1ccccc1C2CCNC2 Amb18571277 [0,1,0,1,0,0|0,0,0]=2 13396 B13R2.18 Brc1ccccc1C2CCNC2 Amb30588526 [0,1,0,1,0,0|0,0,0]=2 13397 B13R2.18 Brc1ccccc1C2CCOC2 Amb20617119 [0,1,0,1,0,0|1,0,0]=3 13398 B13R2.18 Brc1ccccc1C2CNCO2 Amb18571585 [0,1,0,1,0,0|0,0,0]=2 13399 B13R2.18 Brc1ccccc1C2NCCO2 Amb18571581 [0,1,0,1,0,0|2,0,0]=4 13400 B13R2.18 Brc1ccccc1C2OCCO2 Amb3939651 [0,1,0,1,0,0|2,0,0]=4 13401 B13R2.18 Brc1ccccc1N2CCCC2 Amb19959459 [0,1,0,1,0,0|1,0,0]=3 13402 B13R2.18 Brc1ccccc1[C@@H]2CCCN2 Amb8397166 [0,1,0,1,0,0|1,0,0]=3 13403 B13R2.18 Brc1ccccc1[C@H]2CCCN2 Amb8397167 [0,1,0,1,0,0|1,0,0]=3 13404 B13R2.18 Brc1ccccc1[C@H]2CCNC2 Amb27390200 [0,1,0,1,0,0|0,0,0]=2 13405 B13R2.18 Brc1cccnc1C2CCCC2 Amb24320673 [0,1,0,1,0,0|2,0,0]=4 13406 B13R2.18 Brc1cccnc1C2CCCN2 Amb26078105 [0,1,0,1,0,0|2,0,0]=4 13407 B13R2.18 Brc1cccnc1C2CCNC2 Amb26066704 [0,1,0,1,0,0|1,0,0]=3 13408 B13R2.18 Brc1cccnc1N2CCCC2 Amb19959596 [0,1,0,1,0,0|2,0,0]=4 13409 B13R2.18 Brc1cccnc1N2CCCC2 Amb34164440 [0,1,0,1,0,0|2,0,0]=4 13410 B13R2.18 Brc1cccnc1N2CCSC2 Amb25693374 [0,1,0,1,0,0|2,0,0]=4 13411 B13R2.18 Brc1cccnc1[C@H]2CCCN2 Amb28437212 [0,1,0,1,0,0|2,0,0]=4 13412 B13R2.18 Brc1ccncc1C2CCCC2 Amb20617517 [0,1,0,1,0,0|2,0,0]=4 13413 B13R2.18 Brc1ccncc1C2CCCN2 Amb27272648 [0,1,0,1,0,0|2,0,0]=4 13414 B13R2.18 Brc1ccncc1N2CCSC2 Amb26611584 [0,1,0,1,0,0|2,0,0]=4 13415 B13R2.18 Brc1cnccc1C2CCCN2 Amb24097518 [0,1,0,1,0,0|2,0,0]=4 13416 B13R2.18 Brc1cnccc1C2CCNC2 Amb24082791 [0,1,0,1,0,0|1,0,0]=3 13417 B13R2.18 Brc1cnccc1N2CCSC2 Amb24358935 [0,1,0,1,0,0|2,0,0]=4 13418 B13R2.18 Brc1ncccc1C2CCCN2 Amb3789775 [0,1,0,1,0,0|2,0,0]=4 13419 B13R2.18 Brc1ncccc1C2CCNC2 Amb25301377 [0,1,0,1,0,0|1,0,0]=3 13420 B13R2.18 Brc1ncccc1N2CCCC2 Amb24076783 [0,1,0,1,0,0|2,0,0]=4 13421 B13R2.18 Brc1ncccc1N2CCSC2 Amb27405002 [0,1,0,1,0,0|2,0,0]=4 13422 B13R2.18 Cc1ccccc1C2=CCNC2 Amb22059719 [0,1,0,1,0,0|1,0,1]=4 13423 B13R2.18 Cc1ccccc1C2=CCNC2 Amb30584972 [0,1,0,1,0,0|1,0,1]=4 13424 B13R2.18 Cc1ccccc1C2=NNCC2 Amb25697316 [0,1,0,1,0,0|2,0,0]=4 13425 B13R2.18 Cc1ccccc1C2CCCC2 Amb28385527 [0,1,0,1,0,0|2,0,0]=4 13426 B13R2.18 Cc1ccccc1C2CCCN2 Amb20668068 [0,1,0,1,0,0|2,0,0]=4 13427 B13R2.18 Cc1ccccc1C2CCCN2 Amb9715198 [0,1,0,1,0,0|2,0,0]=4 13428 B13R2.18 Cc1ccccc1C2CCNC2 Amb13952285 [0,1,0,1,0,0|1,0,0]=3 13429 B13R2.18 Cc1ccccc1C2CCNC2 Amb24094033 [0,1,0,1,0,0|1,0,0]=3 13430 B13R2.18 Cc1ccccc1C2CNCO2 Amb18563576 [0,1,0,1,0,0|1,0,0]=3 13431 B13R2.18 Cc1ccccc1N2CCCC2 Amb24418554 [0,1,0,1,0,0|2,0,0]=4 13432 B13R2.18 Cc1ccccc1[C@@H]2CCCN2 Amb24117100 [0,1,0,1,0,0|2,0,0]=4 13433 B13R2.18 Cc1ccccc1[C@H]2CCCN2 Amb24714734 [0,1,0,1,0,0|2,0,0]=4 13434 B13R2.18 Cc1ccccc1[C@H]2CCNC2 Amb27230875 [0,1,0,1,0,0|1,0,0]=3 13435 B13R2.18 Cc1cccnc1C2CCNC2 Amb27389163 [0,1,0,1,0,0|2,0,0]=4 13436 B13R2.18 Cc1ccncc1C2CCNC2 Amb24471679 [0,1,0,1,0,0|2,0,0]=4 13437 B13R2.18 Cc1cnccc1C2CCNC2 Amb25737168 [0,1,0,1,0,0|2,0,0]=4 13438 B13R2.18 Cc1ncccc1C2CCNC2 Amb23586023 [0,1,0,1,0,0|2,0,0]=4 13439 B13R2.18 Clc1ccccc1C2CCCN2 Amb19887240 [0,1,0,1,0,0|1,1,0]=4 13440 B13R2.18 Clc1ccccc1C2CCCN2 Amb9713718 [0,1,0,1,0,0|1,1,0]=4 13441 B13R2.18 Clc1ccccc1C2CCNC2 Amb10068901 [0,1,0,1,0,0|0,1,0]=3 13442 B13R2.18 Clc1ccccc1C2CCNC2 Amb10602146 [0,1,0,1,0,0|0,1,0]=3 13443 B13R2.18 Clc1ccccc1C2CCNC2 Amb19958389 [0,1,0,1,0,0|0,1,0]=3 13444 B13R2.18 Clc1ccccc1C2CNCO2 Amb18564263 [0,1,0,1,0,0|0,1,0]=3 13445 B13R2.18 Clc1ccccc1N2CCCC2 Amb18268600 [0,1,0,1,0,0|1,1,0]=4 13446 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb24062899 [0,1,0,1,0,0|1,1,0]=4 13447 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb8397172 [0,1,0,1,0,0|1,1,0]=4 13448 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb24078711 [0,1,0,1,0,0|1,1,0]=4 13449 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb8397173 [0,1,0,1,0,0|1,1,0]=4 13450 B13R2.18 Clc1cccnc1C2CCNC2 Amb18823440 [0,1,0,1,0,0|1,1,0]=4 13451 B13R2.18 Clc1ccncc1C2CCNC2 Amb18823442 [0,1,0,1,0,0|1,1,0]=4 13452 B13R2.18 Clc1cnccc1C2CCNC2 Amb18823441 [0,1,0,1,0,0|1,1,0]=4 13453 B13R2.18 Clc1ncccc1C2CCNC2 Amb26873372 [0,1,0,1,0,0|1,1,0]=4 13454 B13R2.18 Fc1ccccc1C2=CCNC2 Amb22059720 [0,1,0,1,0,0|0,1,1]=4 13455 B13R2.18 Fc1ccccc1C2=CCNC2 Amb30585028 [0,1,0,1,0,0|0,1,1]=4 13456 B13R2.18 Fc1ccccc1C2CCCN2 Amb2693808 [0,1,0,1,0,0|1,1,0]=4 13457 B13R2.18 Fc1ccccc1C2CCCN2 Amb3788174 [0,1,0,1,0,0|1,1,0]=4 13458 B13R2.18 Fc1ccccc1C2CCNC2 Amb19351410 [0,1,0,1,0,0|0,1,0]=3 13459 B13R2.18 Fc1ccccc1C2CCNC2 Amb8009464 [0,1,0,1,0,0|0,1,0]=3 13460 B13R2.18 Fc1ccccc1C2CNCO2 Amb18563791 [0,1,0,1,0,0|0,1,0]=3 13461 B13R2.18 Fc1ccccc1[C@@H]2CCCN2 Amb24094371 [0,1,0,1,0,0|1,1,0]=4 13462 B13R2.18 Fc1ccccc1[C@@H]2CCNC2 Amb24094222 [0,1,0,1,0,0|0,1,0]=3 13463 B13R2.18 Fc1ccccc1[C@H]2CCCN2 Amb24099980 [0,1,0,1,0,0|1,1,0]=4 13464 B13R2.18 Fc1ccccc1[C@H]2CCNC2 Amb24099973 [0,1,0,1,0,0|0,1,0]=3 13465 B13R2.18 Fc1cccnc1C2CCNC2 Amb26517447 [0,1,0,1,0,0|1,1,0]=4 13466 B13R2.18 Fc1cnccc1C2CCNC2 Amb24758349 [0,1,0,1,0,0|1,1,0]=4 13467 B13R2.18 Fc1ncccc1C2CCNC2 Amb18827733 [0,1,0,1,0,0|1,1,0]=4 13468 B13R2.18 Ic1ccccc1C2CCCN2 Amb9713257 [0,1,0,1,0,0|1,1,0]=4 13469 B13R2.18 Ic1ccccc1[C@@H]2CCCN2 Amb27750769 [0,1,0,1,0,0|1,1,0]=4 13470 B13R2.18 Ic1ccccc1[C@H]2CCCN2 Amb27389454 [0,1,0,1,0,0|1,1,0]=4 13471 B13R2.18 Ic1ccccc1[C@H]2CCNC2 Amb27263845 [0,1,0,1,0,0|0,1,0]=3 13472 B13R2.18 Nc1ccccc1C2CCCC2 Amb17106959 [0,1,0,1,0,0|2,0,0]=4 13473 B13R2.18 Nc1ccccc1C2CCCN2 Amb18064028 [0,1,0,1,0,0|2,0,0]=4 13474 B13R2.18 Nc1ccccc1C2CCNC2 Amb27412916 [0,1,0,1,0,0|1,0,0]=3 13475 B13R2.18 Nc1ccccc1C2CCOC2 Amb20617120 [0,1,0,1,0,0|2,0,0]=4 13476 B13R2.18 Nc1ccccc1N2CCCC2 Amb24053263 [0,1,0,1,0,0|2,0,0]=4 13477 B13R2.18 Nc1ccccc1N2CCCC2 Amb420192 [0,1,0,1,0,0|2,0,0]=4 13478 B13R2.18 Nc1ccccc1N2CCCC2 Amb716884 [0,1,0,1,0,0|2,0,0]=4 13479 B13R2.18 Nc1ccccc1[C@@H]2CCCN2 Amb27259054 [0,1,0,1,0,0|2,0,0]=4 13480 B13R2.18 Nc1ccccc1[C@H]2CCNC2 Amb27390596 [0,1,0,1,0,0|1,0,0]=3 13481 B13R2.18 Nc1ccncc1C2CCNC2 Amb27168603 [0,1,0,1,0,0|2,0,0]=4 13482 B13R2.18 Nc1cnccc1C2CCNC2 Amb27214120 [0,1,0,1,0,0|2,0,0]=4 13483 B13R2.18 O=C1C=CC=CN1C2CCNC2 Amb18038062 [0,1,0,1,0,0|2,0,0]=4 13484 B13R2.18 Oc1ccccc1C2CCCC2 Amb3939129 [0,1,0,1,0,0|2,0,0]=4 13485 B13R2.18 Oc1ccccc1C2CCCN2 Amb18560469 [0,1,0,1,0,0|2,0,0]=4 13486 B13R2.18 Oc1ccccc1C2CCCN2 Amb30633924 [0,1,0,1,0,0|2,0,0]=4 13487 B13R2.18 Oc1ccccc1C2CCCO2 Amb18646054 [0,1,0,1,0,0|2,0,0]=4 13488 B13R2.18 Oc1ccccc1C2CCNC2 Amb18062861 [0,1,0,1,0,0|1,0,0]=3 13489 B13R2.18 Oc1ccccc1C2CCOC2 Amb20617121 [0,1,0,1,0,0|2,0,0]=4 13490 B13R2.18 Oc1ccccc1N2CCCC2 Amb2725401 [0,1,0,1,0,0|2,0,0]=4 13491 B13R2.18 Oc1ccccc1[C@H]2CCCN2 Amb27975756 [0,1,0,1,0,0|2,0,0]=4 13492 B13R2.18 Oc1cccnc1C2CCNC2 Amb27190722 [0,1,0,1,0,0|2,0,0]=4 13493 B13R2.18 Sc1ccccc1C2CCCC2 Amb27840644 [0,1,0,1,0,0|2,0,0]=4 13494 B13R2.18 Sc1ccccc1[C@@H]2CCCN2 Amb27644204 [0,1,0,1,0,0|2,0,0]=4 13495 B13R2.18 Sc1ncccc1C2CCNC2 Amb28122891 [0,1,0,1,0,0|2,0,0]=4 13496 B13R2.26 BrCCC1Cc2ccccc2C1 Amb26508757 [0,1,0,1,0,0|2,0,0]=4 13497 B13R2.26 CCCC1=Cc2ccccc2C1 Amb15692407 [0,1,0,1,0,0|2,0,0]=4 13498 B13R2.26 CCCC1Cc2ccccc2N1 Amb27464141 [0,1,0,1,0,0|2,0,0]=4 13499 B13R2.26 CCCC1Nc2ccccc2N1 Amb27831400 [0,1,0,1,0,0|2,0,0]=4 13500 B13R2.26 CCNC1Cc2ccccc2C1 Amb2182885 [0,1,0,1,0,0|1,0,0]=3 13501 B13R2.26 CCNC1Cc2ccccc2C1 Amb2209241 [0,1,0,1,0,0|1,0,0]=3 13502 B13R2.26 CNCC1Cc2ccccc2C1 Amb27390766 [0,1,0,1,0,0|1,0,0]=3 13503 B13R2.26 CNCC1Cc2ccccc2N1 Amb28347865 [0,1,0,1,0,0|1,0,0]=3 13504 B13R2.26 CNCC1Cc2ccccc2O1 Amb3941164 [0,1,0,1,0,0|1,0,0]=3 13505 B13R2.26 CNCC1Cc2ccccc2S1 Amb27245558 [0,1,0,1,0,0|1,0,0]=3 13506 B13R2.26 CNCc1cc2ccccc2o1 Amb10813873 [0,1,0,1,0,0|1,0,1]=4 13507 B13R2.26 CNCc1cc2ccccc2o1 Amb5494061 [0,1,0,1,0,0|1,0,1]=4 13508 B13R2.26 CNCc1cc2ccccc2s1 Amb1792462 [0,1,0,1,0,0|1,0,1]=4 13509 B13R2.26 CNCc1cc2ccccc2s1 Amb6344858 [0,1,0,1,0,0|1,0,1]=4 13510 B13R2.26 CNCc1nc2ccccc2o1 Amb6316127 [0,1,0,1,0,0|1,0,1]=4 13511 B13R2.26 CNCc1nc2ccccc2s1 Amb21959881 [0,1,0,1,0,0|1,0,1]=4 13512 B13R2.26 CNCc1nc2ccccc2s1 Amb440118 [0,1,0,1,0,0|1,0,1]=4 13513 B13R2.26 COCC1Cc2ccccc2N1 Amb25148607 [0,1,0,1,0,0|2,0,0]=4 13514 B13R2.26 C\C=C\C1Cc2ccccc2N1 Amb24636958 [0,1,0,1,0,0|2,0,0]=4 13515 B13R2.26 ClCOC1Cc2ccccc2C1 Amb28436832 [0,1,0,1,0,0|2,0,0]=4 13516 B13R2.26 NCCC1Cc2ccccc2C1 Amb17334539 [0,1,0,1,0,0|2,0,0]=4 13517 B13R2.26 NCCC1Cc2ccccc2C1 Amb33536790 [0,1,0,1,0,0|2,0,0]=4 13518 B13R2.26 NCCC1Cc2ccccc2O1 Amb18829251 [0,1,0,1,0,0|2,0,0]=4 13519 B13R2.26 NCCC1Cc2ccccc2O1 Amb33330257 [0,1,0,1,0,0|2,0,0]=4 13520 B13R2.26 NCCC1Cc2ccccc2S1 Amb18194202 [0,1,0,1,0,0|2,0,0]=4 13521 B13R2.26 NNCC1Cc2ccccc2C1 Amb25763204 [0,1,0,1,0,0|2,0,0]=4 13522 B13R2.26 NNCC1Cc2ccccc2S1 Amb27633135 [0,1,0,1,0,0|2,0,0]=4 13523 B13R2.26 O=CNC1Cc2ccccc2C1 Amb27955819 [0,1,0,1,0,0|1,0,1]=4 13524 B13R2.26 OCCC1Cc2ccccc2C1 Amb17334570 [0,1,0,1,0,0|2,0,0]=4 13525 B13R2.26 OCCC1Cc2ccccc2N1 Amb25228077 [0,1,0,1,0,0|2,0,0]=4 13526 B13R2.26 ONCC1Cc2ccccc2C1 Amb33143935 [0,1,0,1,0,0|2,0,0]=4 13527 B13R2.26 SCCC1Cc2ccccc2C1 Amb33342308 [0,1,0,1,0,0|2,0,0]=4 13528 B13R2.215 CC1CCN1c2ccccc2N Amb27494292 [0,1,0,1,0,0|2,0,0]=4 13529 B13R2.215 CC1CCN1c2ccncc2Br Amb27750315 [0,1,0,1,0,0|2,0,0]=4 13530 B13R2.215 CC1CCN1c2ncccc2Br Amb28348012 [0,1,0,1,0,0|2,0,0]=4 13531 B13R2.215 CN1CCC1c2ccccc2O Amb27229151 [0,1,0,1,0,0|1,0,0]=3 13532 B13R2.215 Cc1ccccc1C2CCC2O Amb27953632 [0,1,0,1,0,0|2,0,0]=4 13533 B13R2.215 NC1CCC1c2ccccc2Br Amb27784958 [0,1,0,1,0,0|1,0,0]=3 13534 B13R2.215 NC1CCC1c2ccccc2Cl Amb19374439 [0,1,0,1,0,0|1,1,0]=4 13535 B13R2.215 NC1CCC1c2ccccc2Cl Amb30584929 [0,1,0,1,0,0|1,1,0]=4 13536 B13R2.215 O=C1CCC1c2ccccc2Br Amb27946874 [0,1,0,1,0,0|1,0,1]=4 13537 B13R2.215 O=C1CCN1c2ccccc2Br Amb24493723 [0,1,0,1,0,0|2,0,0]=4 13538 B13R2.215 OC1CCC1c2ccccc2Cl Amb19374436 [0,1,0,1,0,0|1,1,0]=4 13539 B13R2.215 OC1CCC1c2ccccc2F Amb25699978 [0,1,0,1,0,0|1,1,0]=4 13540 B13R2.215 OC1CCC1c2cccnc2Br Amb32944345 [0,1,0,1,0,0|2,0,0]=4 13541 B13R2.215 Oc1ccccc1C2CCC2O Amb33212900 [0,1,0,1,0,0|2,0,0]=4 13542 B13R2.342 Brc1cccc2c1NCCC2Br Amb26650023 [0,1,0,1,0,0|2,0,0]=4 13543 B13R2.342 Brc1cccc2c1NCCC2I Amb24754407 [0,1,0,1,0,0|2,0,0]=4 13544 B13R2.342 Brc1cccc2c1OCCC2I Amb28053083 [0,1,0,1,0,0|2,0,0]=4 13545 B13R2.342 Brc1cccc2c1SCCC2Br Amb24493532 [0,1,0,1,0,0|2,0,0]=4 13546 B13R2.342 Brc1cccc2c1SCCC2I Amb27186777 [0,1,0,1,0,0|2,0,0]=4 13547 B13R2.342 CC1CCNc2c(Br)cccc21 Amb24423447 [0,1,0,1,0,0|1,0,0]=3 13548 B13R2.342 CC1CCNc2c(Cl)cccc21 Amb24455755 [0,1,0,1,0,0|1,1,0]=4 13549 B13R2.342 CC1CCNc2c(F)cccc21 Amb25699202 [0,1,0,1,0,0|1,1,0]=4 13550 B13R2.342 CC1CCNc2c(O)cccc21 Amb27856811 [0,1,0,1,0,0|2,0,0]=4 13551 B13R2.342 CC1CCNc2c(O)cccc21 Amb30585036 [0,1,0,1,0,0|2,0,0]=4 13552 B13R2.342 CC1CCOc2c(N)cccc21 Amb28053005 [0,1,0,1,0,0|2,0,0]=4 13553 B13R2.342 CC1CCOc2c(O)cccc21 Amb27872999 [0,1,0,1,0,0|2,0,0]=4 13554 B13R2.342 CC1CNCc2c(Cl)cccc21 Amb18648573 [0,1,0,1,0,0|1,1,0]=4 13555 B13R2.342 CC1CNCc2c(F)cccc21 Amb24531591 [0,1,0,1,0,0|1,1,0]=4 13556 B13R2.342 CC1NCCc2c(Br)cccc21 Amb22059236 [0,1,0,1,0,0|0,0,0]=2 13557 B13R2.342 CC1NCCc2c(N)cccc21 Amb26518764 [0,1,0,1,0,0|1,0,0]=3 13558 B13R2.342 CC1NCCc2c(O)cccc21 Amb24546272 [0,1,0,1,0,0|1,0,0]=3 13559 B13R2.342 CN1CCCC2=C1C=CNC2=O Amb27433506 [0,1,0,1,0,0|2,0,0]=4 13560 B13R2.342 CN1CCCc2c(Br)cccc21 Amb23586165 [0,1,0,1,0,0|0,0,0]=2 13561 B13R2.342 CN1CCCc2c(O)cccc21 Amb11032489 [0,1,0,1,0,0|1,0,0]=3 13562 B13R2.342 CN1CCNc2c(Br)cccc21 Amb27649711 [0,1,0,1,0,0|0,0,0]=2 13563 B13R2.342 CN1CCNc2c(Cl)cccc21 Amb22495007 [0,1,0,1,0,0|0,1,0]=3 13564 B13R2.342 CN1CCNc2c(F)cccc21 Amb18827739 [0,1,0,1,0,0|0,1,0]=3 13565 B13R2.342 CN1CCOc2c(Br)cccc21 Amb17572159 [0,1,0,1,0,0|0,0,0]=2 13566 B13R2.342 CN1CCOc2c(Cl)cccc21 Amb17570383 [0,1,0,1,0,0|0,1,0]=3 13567 B13R2.342 CN1CCOc2c(F)cccc21 Amb17570115 [0,1,0,1,0,0|0,1,0]=3 13568 B13R2.342 CN1CCOc2c(N)cccc21 Amb17570098 [0,1,0,1,0,0|1,0,0]=3 13569 B13R2.342 CN1CCOc2c(O)cccc21 Amb27192062 [0,1,0,1,0,0|1,0,0]=3 13570 B13R2.342 C[C@@H]1NCCc2c(Br)cccc21 Amb27162384 [0,1,0,1,0,0|0,0,0]=2 13571 B13R2.342 C[C@H]1NCCc2c(Br)cccc21 Amb27248602 [0,1,0,1,0,0|0,0,0]=2 13572 B13R2.342 Cc1cccc2c1CCCC2C Amb22347908 [0,1,0,1,0,0|2,0,0]=4 13573 B13R2.342 Cc1cccc2c1CCCC2N Amb26027315 [0,1,0,1,0,0|2,0,0]=4 13574 B13R2.342 Cc1cccc2c1CCCC2N Amb31289677 [0,1,0,1,0,0|2,0,0]=4 13575 B13R2.342 Cc1cccc2c1CCC[C@@H]2N Amb25132142 [0,1,0,1,0,0|2,0,0]=4 13576 B13R2.342 Cc1cccc2c1CCC[C@H]2N Amb25921684 [0,1,0,1,0,0|2,0,0]=4 13577 B13R2.342 Cc1cccc2c1CCNC2=O Amb17400086 [0,1,0,1,0,0|1,0,1]=4 13578 B13R2.342 Cc1cccc2c1CCNC2C Amb5735622 [0,1,0,1,0,0|1,0,0]=3 13579 B13R2.342 Cc1cccc2c1CCN[C@H]2C Amb27752182 [0,1,0,1,0,0|1,0,0]=3 13580 B13R2.342 Cc1cccc2c1CNCC2C Amb27879149 [0,1,0,1,0,0|2,0,0]=4 13581 B13R2.342 Cc1cccc2c1NCCC2C Amb9782721 [0,1,0,1,0,0|2,0,0]=4 13582 B13R2.342 Cc1cccc2c1NCCN2C Amb25328009 [0,1,0,1,0,0|1,0,0]=3 13583 B13R2.342 Cc1cccc2c1OCCN2C Amb17570086 [0,1,0,1,0,0|1,0,0]=3 13584 B13R2.342 ClC1CCNc2c(Br)cccc21 Amb24564842 [0,1,0,1,0,0|2,0,0]=4 13585 B13R2.342 ClC1CCSc2c(Br)cccc21 Amb25938446 [0,1,0,1,0,0|2,0,0]=4 13586 B13R2.342 FC1CCCc2c(Br)cccc21 Amb27242792 [0,1,0,1,0,0|1,0,0]=3 13587 B13R2.342 NC1CCCc2c(Br)cccc21 Amb23440365 [0,1,0,1,0,0|1,0,0]=3 13588 B13R2.342 NC1CCCc2c(Br)cccc21 Amb25890687 [0,1,0,1,0,0|1,0,0]=3 13589 B13R2.342 NC1CCCc2c(Br)cncc21 Amb25154351 [0,1,0,1,0,0|2,0,0]=4 13590 B13R2.342 NC1CCCc2c(Cl)cccc21 Amb2383247 [0,1,0,1,0,0|1,1,0]=4 13591 B13R2.342 NC1CCCc2c(F)cccc21 Amb22002615 [0,1,0,1,0,0|1,1,0]=4 13592 B13R2.342 NC1CCCc2c(F)cccc21 Amb2383248 [0,1,0,1,0,0|1,1,0]=4 13593 B13R2.342 NC1CCCc2c(O)cccc21 Amb18645876 [0,1,0,1,0,0|2,0,0]=4 13594 B13R2.342 NC1CCNc2c(Br)cccc21 Amb25036563 [0,1,0,1,0,0|2,0,0]=4 13595 B13R2.342 NC1CCOc2c(Br)cccc21 Amb22586333 [0,1,0,1,0,0|2,0,0]=4 13596 B13R2.342 NC1CCOc2c(Br)cccc21 Amb2383373 [0,1,0,1,0,0|2,0,0]=4 13597 B13R2.342 NC1CSCc2c(Br)cccc21 Amb27196077 [0,1,0,1,0,0|2,0,0]=4 13598 B13R2.342 N[C@@H]1CCCc2c(Br)cccc21 Amb28246420 [0,1,0,1,0,0|1,0,0]=3 13599 B13R2.342 N[C@@H]1CCCc2c(Cl)cccc21 Amb27751952 [0,1,0,1,0,0|1,1,0]=4 13600 B13R2.342 N[C@@H]1CCCc2c(O)cccc21 Amb13953016 [0,1,0,1,0,0|2,0,0]=4 13601 B13R2.342 N[C@@H]1CCOc2c(Br)cccc21 Amb23440393 [0,1,0,1,0,0|2,0,0]=4 13602 B13R2.342 N[C@@H]1CCOc2c(Br)cccc21 Amb26457739 [0,1,0,1,0,0|2,0,0]=4 13603 B13R2.342 N[C@@H]1CSCc2c(Br)cccc21 Amb27405497 [0,1,0,1,0,0|2,0,0]=4 13604 B13R2.342 N[C@H]1CCCc2c(Br)cccc21 Amb25034693 [0,1,0,1,0,0|1,0,0]=3 13605 B13R2.342 N[C@H]1CCCc2c(Br)cccc21 Amb33813742 [0,1,0,1,0,0|1,0,0]=3 13606 B13R2.342 N[C@H]1CCCc2c(Cl)cccc21 Amb26860753 [0,1,0,1,0,0|1,1,0]=4 13607 B13R2.342 N[C@H]1CCCc2c(F)cccc21 Amb26963664 [0,1,0,1,0,0|1,1,0]=4 13608 B13R2.342 N[C@H]1CCOc2c(Br)cccc21 Amb26372432 [0,1,0,1,0,0|2,0,0]=4 13609 B13R2.342 N[C@H]1CCOc2c(Br)cccc21 Amb33623213 [0,1,0,1,0,0|2,0,0]=4 13610 B13R2.342 N[C@H]1COCc2c(Br)cccc21 Amb27253114 [0,1,0,1,0,0|2,0,0]=4 13611 B13R2.342 Nc1cccc2c1CCCC2N Amb28044340 [0,1,0,1,0,0|2,0,0]=4 13612 B13R2.342 Nc1cccc2c1CCC[C@H]2N Amb27166870 [0,1,0,1,0,0|2,0,0]=4 13613 B13R2.342 Nc1cccc2c1CCNC2=O Amb22496660 [0,1,0,1,0,0|1,0,1]=4 13614 B13R2.342 Nc1cccc2c1CCNC2=O Amb27597949 [0,1,0,1,0,0|1,0,1]=4 13615 B13R2.342 O=C1CCCc2c(Br)cccc21 Amb7101506 [0,1,0,1,0,0|1,0,1]=4 13616 B13R2.342 O=C1CCNc2c(Br)cccc21 Amb18753478 [0,1,0,1,0,0|2,0,0]=4 13617 B13R2.342 O=C1CCOc2c(Br)cccc21 Amb8843607 [0,1,0,1,0,0|2,0,0]=4 13618 B13R2.342 O=C1CCSc2c(Br)cccc21 Amb8996650 [0,1,0,1,0,0|2,0,0]=4 13619 B13R2.342 O=C1NCCc2c(Br)cccc21 Amb22002114 [0,1,0,1,0,0|0,0,1]=3 13620 B13R2.342 O=C1NCCc2c(Br)cncc21 Amb24058272 [0,1,0,1,0,0|1,0,1]=4 13621 B13R2.342 O=C1NCCc2c(Cl)cccc21 Amb6308386 [0,1,0,1,0,0|0,1,1]=4 13622 B13R2.342 O=C1NCCc2c(F)cccc21 Amb6308385 [0,1,0,1,0,0|0,1,1]=4 13623 B13R2.342 O=C1NCCc2c(I)cccc21 Amb24330771 [0,1,0,1,0,0|0,1,1]=4 13624 B13R2.342 O=C1NCCc2c(O)cccc21 Amb6306668 [0,1,0,1,0,0|1,0,1]=4 13625 B13R2.342 OC1CCCc2c(Br)cccc21 Amb22500943 [0,1,0,1,0,0|1,0,0]=3 13626 B13R2.342 OC1CCCc2c(Br)cncc21 Amb26506912 [0,1,0,1,0,0|2,0,0]=4 13627 B13R2.342 OC1CCCc2c(F)cccc21 Amb25719778 [0,1,0,1,0,0|1,1,0]=4 13628 B13R2.342 OC1CCNc2c(Br)cccc21 Amb24413000 [0,1,0,1,0,0|2,0,0]=4 13629 B13R2.342 OC1CCSc2c(Br)cccc21 Amb25346323 [0,1,0,1,0,0|2,0,0]=4 13630 B13R2.342 OC1CSCc2c(Br)cccc21 Amb28250582 [0,1,0,1,0,0|2,0,0]=4 13631 B13R2.342 O[C@@H]1CCCc2c(Cl)cccc21 Amb27878156 [0,1,0,1,0,0|1,1,0]=4 13632 B13R2.342 O[C@@H]1CCCc2c(F)cccc21 Amb27470913 [0,1,0,1,0,0|1,1,0]=4 13633 B13R2.342 O[C@@H]1CCOc2c(Br)cccc21 Amb26841176 [0,1,0,1,0,0|2,0,0]=4 13634 B13R2.342 O[C@H]1CCCc2c(Br)cccc21 Amb25848497 [0,1,0,1,0,0|1,0,0]=3 13635 B13R2.342 O[C@H]1CCOc2c(Br)cccc21 Amb27807025 [0,1,0,1,0,0|2,0,0]=4 13636 B13R2.342 O[C@H]1CSCc2c(Br)cccc21 Amb27833149 [0,1,0,1,0,0|2,0,0]=4 13637 B13R2.342 Oc1cccc2c1CCCC2O Amb6357372 [0,1,0,1,0,0|2,0,0]=4 13638 B13R2.342 Oc1cccc2c1CCC[C@@H]2O Amb13953015 [0,1,0,1,0,0|2,0,0]=4 13639 B13R2.342 S=C1NCCc2c(Br)cccc21 Amb27393786 [0,1,0,1,0,0|0,0,1]=3 13640 B13R2.342 SC1CCNc2c(Br)cccc21 Amb26457944 [0,1,0,1,0,0|2,0,0]=4 13641 B13R2.342 SC1CCOc2c(Br)cccc21 Amb28251700 [0,1,0,1,0,0|2,0,0]=4 13642 B13R2.567 CCC1CC1c2ccccc2N Amb27845524 [0,1,0,1,0,0|2,0,0]=4 13643 B13R2.567 Cc1ccccc1C2CC2CN Amb17232379 [0,1,0,1,0,0|2,0,0]=4 13644 B13R2.567 Cc1ccccc1[C@@H]2C[C@H]2CN Amb25251137 [0,1,0,1,0,0|2,0,0]=4 13645 B13R2.567 NCC1CC1c2ccccc2Br Amb17568203 [0,1,0,1,0,0|1,0,0]=3 13646 B13R2.567 NCC1CC1c2ccccc2Cl Amb17233870 [0,1,0,1,0,0|1,1,0]=4 13647 B13R2.567 NCC1CC1c2ccccc2F Amb17232528 [0,1,0,1,0,0|1,1,0]=4 13648 B13R2.567 NCC1CC1c2ccccc2O Amb27855492 [0,1,0,1,0,0|2,0,0]=4 13649 B13R2.567 NCC1CC1c2cccnc2Br Amb33387863 [0,1,0,1,0,0|2,0,0]=4 13650 B13R2.567 NCC1CC1c2ccncc2Br Amb33451110 [0,1,0,1,0,0|2,0,0]=4 13651 B13R2.567 NCC1CC1c2ncccc2Br Amb33336381 [0,1,0,1,0,0|2,0,0]=4 13652 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2Br Amb25264940 [0,1,0,1,0,0|1,0,0]=3 13653 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2Cl Amb27494539 [0,1,0,1,0,0|1,1,0]=4 13654 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2F Amb25204987 [0,1,0,1,0,0|1,1,0]=4 13655 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2O Amb26958612 [0,1,0,1,0,0|2,0,0]=4 13656 B13R2.567 NC[C@@H]1C[C@H]1c2cccnc2Br Amb33387861 [0,1,0,1,0,0|2,0,0]=4 13657 B13R2.567 NC[C@@H]1C[C@H]1c2ccncc2Br Amb33388652 [0,1,0,1,0,0|2,0,0]=4 13658 B13R2.567 NC[C@@H]1C[C@H]1c2ncccc2Br Amb33336378 [0,1,0,1,0,0|2,0,0]=4 13659 B13R2.567 OCC1CC1c2ccccc2Br Amb17605545 [0,1,0,1,0,0|1,0,0]=3 13660 B13R2.567 OCC1CC1c2ccccc2Cl Amb17605562 [0,1,0,1,0,0|1,1,0]=4 13661 B13R2.567 OCC1CC1c2ccccc2F Amb17605538 [0,1,0,1,0,0|1,1,0]=4 13662 B13R2.567 OCC1OC1c2ccccc2Br Amb33298972 [0,1,0,1,0,0|2,0,0]=4 13663 B13R2.1028 CCCCC1Cc2ccccc21 Amb17758498 [0,1,0,1,0,0|2,0,0]=4 13664 B13R2.1028 CCCNC1Cc2ccccc21 Amb27752888 [0,1,0,1,0,0|2,0,0]=4 13665 B13R2.1028 CCNCC1Cc2ccccc21 Amb18289168 [0,1,0,1,0,0|1,0,0]=3 13666 B13R2.1028 O=CNCC1Cc2ccccc21 Amb28045219 [0,1,0,1,0,0|1,0,1]=4 13667 B13R2.5225 Brc1ccccc1CC2CNC2 Amb32670848 [0,1,0,1,0,0|0,0,0]=2 13668 B13R2.5225 Brc1ccccc1CC2CNC2 Amb33802124 [0,1,0,1,0,0|0,0,0]=2 13669 B13R2.5225 Brc1ccccc1CC2CNC2 Amb6263742 [0,1,0,1,0,0|0,0,0]=2 13670 B13R2.5225 Brc1ccccc1CC2COC2 Amb26507378 [0,1,0,1,0,0|1,0,0]=3 13671 B13R2.5225 Brc1ccccc1NC2CCC2 Amb27172688 [0,1,0,1,0,0|1,0,0]=3 13672 B13R2.5225 Brc1ccccc1NC2CCC2 Amb33465389 [0,1,0,1,0,0|1,0,0]=3 13673 B13R2.5225 Brc1ccccc1NC2CNC2 Amb28142947 [0,1,0,1,0,0|0,0,0]=2 13674 B13R2.5225 Brc1ccccc1OC2CCC2 Amb26050015 [0,1,0,1,0,0|1,0,0]=3 13675 B13R2.5225 Brc1ccccc1OC2CNC2 Amb18964278 [0,1,0,1,0,0|0,0,0]=2 13676 B13R2.5225 Brc1cccnc1CC2CNC2 Amb25680251 [0,1,0,1,0,0|1,0,0]=3 13677 B13R2.5225 Brc1cccnc1NC2CCC2 Amb18286238 [0,1,0,1,0,0|2,0,0]=4 13678 B13R2.5225 Brc1cccnc1OC2CCC2 Amb19374405 [0,1,0,1,0,0|2,0,0]=4 13679 B13R2.5225 Brc1cccnc1OC2CNC2 Amb22642185 [0,1,0,1,0,0|1,0,0]=3 13680 B13R2.5225 Brc1cccnc1OC2COC2 Amb24381319 [0,1,0,1,0,0|2,0,0]=4 13681 B13R2.5225 Brc1cnccc1CC2CNC2 Amb33431048 [0,1,0,1,0,0|1,0,0]=3 13682 B13R2.5225 Brc1cnccc1NC2CNC2 Amb28424288 [0,1,0,1,0,0|1,0,0]=3 13683 B13R2.5225 Brc1cnccc1OC2CCC2 Amb24321013 [0,1,0,1,0,0|2,0,0]=4 13684 B13R2.5225 Brc1cnccc1OC2CNC2 Amb24428543 [0,1,0,1,0,0|1,0,0]=3 13685 B13R2.5225 Brc1cnccc1OC2COC2 Amb26034211 [0,1,0,1,0,0|2,0,0]=4 13686 B13R2.5225 Brc1cnccc1SC2COC2 Amb27412801 [0,1,0,1,0,0|2,0,0]=4 13687 B13R2.5225 Brc1ncccc1CC2CNC2 Amb33387811 [0,1,0,1,0,0|1,0,0]=3 13688 B13R2.5225 Brc1ncccc1NC2CSC2 Amb27787988 [0,1,0,1,0,0|2,0,0]=4 13689 B13R2.5225 Brc1ncccc1OC2CCC2 Amb24319483 [0,1,0,1,0,0|2,0,0]=4 13690 B13R2.5225 Brc1ncccc1OC2CNC2 Amb33388122 [0,1,0,1,0,0|1,0,0]=3 13691 B13R2.5225 Cc1ccccc1CC2CCN2 Amb27864423 [0,1,0,1,0,0|1,0,0]=3 13692 B13R2.5225 Cc1ccccc1CC2CNC2 Amb1123650 [0,1,0,1,0,0|1,0,0]=3 13693 B13R2.5225 Cc1ccccc1CC2CNC2 Amb32667411 [0,1,0,1,0,0|1,0,0]=3 13694 B13R2.5225 Cc1ccccc1NC2CCC2 Amb18800584 [0,1,0,1,0,0|2,0,0]=4 13695 B13R2.5225 Cc1ccccc1NC2COC2 Amb27401648 [0,1,0,1,0,0|2,0,0]=4 13696 B13R2.5225 Cc1ccccc1OC2CNC2 Amb10607982 [0,1,0,1,0,0|1,0,0]=3 13697 B13R2.5225 Cc1ccccc1OC2CNC2 Amb13949199 [0,1,0,1,0,0|1,0,0]=3 13698 B13R2.5225 Cc1cccnc1CC2CNC2 Amb33428996 [0,1,0,1,0,0|2,0,0]=4 13699 B13R2.5225 Cc1cccnc1OC2CNC2 Amb25347964 [0,1,0,1,0,0|2,0,0]=4 13700 B13R2.5225 Cc1cccnc1SC2CNC2 Amb29879838 [0,1,0,1,0,0|2,0,0]=4 13701 B13R2.5225 Cc1ccncc1CC2CNC2 Amb33377028 [0,1,0,1,0,0|2,0,0]=4 13702 B13R2.5225 Cc1ccncc1OC2CNC2 Amb33377414 [0,1,0,1,0,0|2,0,0]=4 13703 B13R2.5225 Cc1cnccc1CC2CNC2 Amb33414476 [0,1,0,1,0,0|2,0,0]=4 13704 B13R2.5225 Cc1cnccc1OC2CNC2 Amb24423209 [0,1,0,1,0,0|2,0,0]=4 13705 B13R2.5225 Cc1ncccc1CC2CNC2 Amb32879581 [0,1,0,1,0,0|2,0,0]=4 13706 B13R2.5225 Cc1ncccc1NC2CNC2 Amb28070221 [0,1,0,1,0,0|2,0,0]=4 13707 B13R2.5225 Cc1ncccc1OC2CNC2 Amb25045513 [0,1,0,1,0,0|2,0,0]=4 13708 B13R2.5225 Clc1ccccc1CC2CNC2 Amb1123759 [0,1,0,1,0,0|0,1,0]=3 13709 B13R2.5225 Clc1ccccc1CC2CNC2 Amb19375526 [0,1,0,1,0,0|0,1,0]=3 13710 B13R2.5225 Clc1ccccc1CC2COC2 Amb32456054 [0,1,0,1,0,0|1,1,0]=4 13711 B13R2.5225 Clc1ccccc1NC2CCC2 Amb18809691 [0,1,0,1,0,0|1,1,0]=4 13712 B13R2.5225 Clc1ccccc1OC2CNC2 Amb15701253 [0,1,0,1,0,0|0,1,0]=3 13713 B13R2.5225 Clc1ccccc1OC2CNC2 Amb22587088 [0,1,0,1,0,0|0,1,0]=3 13714 B13R2.5225 Clc1ccccc1SC2CCC2 Amb27426669 [0,1,0,1,0,0|1,1,0]=4 13715 B13R2.5225 Clc1cccnc1SC2CNC2 Amb28122316 [0,1,0,1,0,0|1,1,0]=4 13716 B13R2.5225 Clc1cnccc1CC2CNC2 Amb26372134 [0,1,0,1,0,0|1,1,0]=4 13717 B13R2.5225 Clc1cnccc1NC2CNC2 Amb27251928 [0,1,0,1,0,0|1,1,0]=4 13718 B13R2.5225 Clc1cnccc1OC2CNC2 Amb25774838 [0,1,0,1,0,0|1,1,0]=4 13719 B13R2.5225 Clc1ncccc1CC2CNC2 Amb33456520 [0,1,0,1,0,0|1,1,0]=4 13720 B13R2.5225 Clc1ncccc1OC2CNC2 Amb33257697 [0,1,0,1,0,0|1,1,0]=4 13721 B13R2.5225 Fc1ccccc1CC2CCN2 Amb27491866 [0,1,0,1,0,0|0,1,0]=3 13722 B13R2.5225 Fc1ccccc1CC2CNC2 Amb19341850 [0,1,0,1,0,0|0,1,0]=3 13723 B13R2.5225 Fc1ccccc1CC2CNC2 Amb6242144 [0,1,0,1,0,0|0,1,0]=3 13724 B13R2.5225 Fc1ccccc1NC2CCC2 Amb18957040 [0,1,0,1,0,0|1,1,0]=4 13725 B13R2.5225 Fc1ccccc1NC2CNC2 Amb28384339 [0,1,0,1,0,0|0,1,0]=3 13726 B13R2.5225 Fc1ccccc1OC2CCC2 Amb27178584 [0,1,0,1,0,0|1,1,0]=4 13727 B13R2.5225 Fc1ccccc1OC2CNC2 Amb15701588 [0,1,0,1,0,0|0,1,0]=3 13728 B13R2.5225 Fc1ccccc1OC2CNC2 Amb22587383 [0,1,0,1,0,0|0,1,0]=3 13729 B13R2.5225 Fc1ccccc1SC2CNC2 Amb19068216 [0,1,0,1,0,0|0,1,0]=3 13730 B13R2.5225 Fc1cccnc1CC2CNC2 Amb33419140 [0,1,0,1,0,0|1,1,0]=4 13731 B13R2.5225 Fc1cccnc1OC2CNC2 Amb27650891 [0,1,0,1,0,0|1,1,0]=4 13732 B13R2.5225 Fc1cnccc1CC2CNC2 Amb33317693 [0,1,0,1,0,0|1,1,0]=4 13733 B13R2.5225 Fc1cnccc1NC2CNC2 Amb30036671 [0,1,0,1,0,0|1,1,0]=4 13734 B13R2.5225 Fc1cnccc1OC2CNC2 Amb33317418 [0,1,0,1,0,0|1,1,0]=4 13735 B13R2.5225 Fc1ncccc1CC2CNC2 Amb33377943 [0,1,0,1,0,0|1,1,0]=4 13736 B13R2.5225 Fc1ncccc1NC2CNC2 Amb35725087 [0,1,0,1,0,0|1,1,0]=4 13737 B13R2.5225 Fc1ncccc1OC2CNC2 Amb33376793 [0,1,0,1,0,0|1,1,0]=4 13738 B13R2.5225 Ic1ccccc1CC2COC2 Amb28319567 [0,1,0,1,0,0|1,1,0]=4 13739 B13R2.5225 Ic1ccccc1CN2CCC2 Amb27809205 [0,1,0,1,0,0|1,1,0]=4 13740 B13R2.5225 Ic1ccccc1NC2CCC2 Amb27872049 [0,1,0,1,0,0|1,1,0]=4 13741 B13R2.5225 Ic1ccccc1NC2CSC2 Amb28281413 [0,1,0,1,0,0|1,1,0]=4 13742 B13R2.5225 Ic1ccccc1OC2CCC2 Amb27451595 [0,1,0,1,0,0|1,1,0]=4 13743 B13R2.5225 Ic1ccccc1OC2CNC2 Amb21956452 [0,1,0,1,0,0|0,1,0]=3 13744 B13R2.5225 Nc1ccccc1CC2COC2 Amb32456050 [0,1,0,1,0,0|2,0,0]=4 13745 B13R2.5225 Nc1ccccc1NC2CCC2 Amb18286237 [0,1,0,1,0,0|2,0,0]=4 13746 B13R2.5225 Nc1ccccc1OC2CCC2 Amb18284764 [0,1,0,1,0,0|2,0,0]=4 13747 B13R2.5225 Nc1ccccc1OC2COC2 Amb19892916 [0,1,0,1,0,0|2,0,0]=4 13748 B13R2.5225 Nc1ccccc1SC2CCC2 Amb27635180 [0,1,0,1,0,0|2,0,0]=4 13749 B13R2.5225 Nc1cccnc1OC2CNC2 Amb23597624 [0,1,0,1,0,0|2,0,0]=4 13750 B13R2.5225 Nc1cnccc1SC2CNC2 Amb18805344 [0,1,0,1,0,0|2,0,0]=4 13751 B13R2.5225 Oc1ccccc1CC2CNC2 Amb25275687 [0,1,0,1,0,0|1,0,0]=3 13752 B13R2.5225 Oc1ccccc1CN2CCC2 Amb27406556 [0,1,0,1,0,0|2,0,0]=4 13753 B13R2.5225 Oc1ccccc1OC2CCC2 Amb26617792 [0,1,0,1,0,0|2,0,0]=4 13754 B13R2.5225 Oc1ccccc1OC2CNC2 Amb33195780 [0,1,0,1,0,0|1,0,0]=3 13755 B13R2.2959 CCCC1(N)Cc2ccccc21 Amb27469683 [0,1,0,1,0,0|2,0,0]=4 13756 B13R2.3097 Cc1ccccc1C(N)C2CC2 Amb30869581 [0,1,0,1,0,0|2,0,0]=4 13757 B13R2.3097 Cc1ccccc1C(N)C2CC2 Amb3788158 [0,1,0,1,0,0|2,0,0]=4 13758 B13R2.3097 Cc1ccccc1C(O)C2CC2 Amb17232415 [0,1,0,1,0,0|2,0,0]=4 13759 B13R2.3097 NC(c1ccccc1Cl)C2CC2 Amb17233873 [0,1,0,1,0,0|1,1,0]=4 13760 B13R2.3097 NC(c1ccccc1F)C2CC2 Amb17232530 [0,1,0,1,0,0|1,1,0]=4 13761 B13R2.3097 NC(c1cccnc1Br)C2CC2 Amb23454984 [0,1,0,1,0,0|2,0,0]=4 13762 B13R2.3097 NC(c1cnccc1Br)C2CC2 Amb27770240 [0,1,0,1,0,0|2,0,0]=4 13763 B13R2.3097 N[C@@H](c1ccccc1Br)C2CC2 Amb27390046 [0,1,0,1,0,0|1,0,0]=3 13764 B13R2.3097 N[C@@H](c1ccccc1Cl)C2CC2 Amb27468644 [0,1,0,1,0,0|1,1,0]=4 13765 B13R2.3097 N[C@@H](c1ccccc1F)C2CC2 Amb22406378 [0,1,0,1,0,0|1,1,0]=4 13766 B13R2.3097 N[C@@H](c1ccccc1F)C2CC2 Amb25113412 [0,1,0,1,0,0|1,1,0]=4 13767 B13R2.3097 N[C@@H](c1ccccc1I)C2CC2 Amb27974820 [0,1,0,1,0,0|1,1,0]=4 13768 B13R2.3097 N[C@@H](c1ncccc1Br)C2CC2 Amb28383177 [0,1,0,1,0,0|2,0,0]=4 13769 B13R2.3097 N[C@H](c1ccccc1F)C2CC2 Amb22406379 [0,1,0,1,0,0|1,1,0]=4 13770 B13R2.3097 N[C@H](c1ccccc1F)C2CC2 Amb26399464 [0,1,0,1,0,0|1,1,0]=4 13771 B13R2.3097 N[C@H](c1cccnc1Br)C2CC2 Amb28135472 [0,1,0,1,0,0|2,0,0]=4 13772 B13R2.3097 N[C@H](c1ncccc1Br)C2CC2 Amb27962852 [0,1,0,1,0,0|2,0,0]=4 13773 B13R2.3097 Nc1ccccc1C(F)C2CC2 Amb28315177 [0,1,0,1,0,0|2,0,0]=4 13774 B13R2.3097 Nc1ccccc1C(N)C2CC2 Amb28059875 [0,1,0,1,0,0|2,0,0]=4 13775 B13R2.3097 O=C(c1ccccc1Br)C2CC2 Amb17343204 [0,1,0,1,0,0|1,0,1]=4 13776 B13R2.3097 OC(c1ccccc1Br)C2CC2 Amb24625121 [0,1,0,1,0,0|1,0,0]=3 13777 B13R2.3097 OC(c1ccccc1Cl)C2CC2 Amb17233964 [0,1,0,1,0,0|1,1,0]=4 13778 B13R2.3097 OC(c1ccccc1F)C2CC2 Amb17232579 [0,1,0,1,0,0|1,1,0]=4 13779 B13R2.3097 OC(c1cccnc1Br)C2CC2 Amb35629580 [0,1,0,1,0,0|2,0,0]=4 13780 B13R2.3097 O[C@H](c1ccccc1F)C2CC2 Amb24182072 [0,1,0,1,0,0|1,1,0]=4 13781 B13R2.3569 CC1(c2ccccc2Br)CCC1 Amb26905686 [0,1,0,1,0,0|1,0,0]=3 13782 B13R2.3569 CC1(c2ccccc2Br)CCO1 Amb26908669 [0,1,0,1,0,0|2,0,0]=4 13783 B13R2.3569 CC1(c2ccccc2Br)CNC1 Amb27479077 [0,1,0,1,0,0|0,0,0]=2 13784 B13R2.3569 CC1(c2ccccc2Cl)CCC1 Amb27864236 [0,1,0,1,0,0|1,1,0]=4 13785 B13R2.3569 CC1(c2ccccc2Cl)CNC1 Amb18564191 [0,1,0,1,0,0|0,1,0]=3 13786 B13R2.3569 CC1(c2ccccc2F)CCC1 Amb25951842 [0,1,0,1,0,0|1,1,0]=4 13787 B13R2.3569 CC1(c2ccccc2F)CNC1 Amb18563684 [0,1,0,1,0,0|0,1,0]=3 13788 B13R2.3569 CC1(c2ccccc2F)CNC1 Amb32737485 [0,1,0,1,0,0|0,1,0]=3 13789 B13R2.3569 CC1(c2ccccc2I)CCC1 Amb28071435 [0,1,0,1,0,0|1,1,0]=4 13790 B13R2.3569 CC1(c2ccccc2O)COC1 Amb22295892 [0,1,0,1,0,0|2,0,0]=4 13791 B13R2.3569 Cc1ccccc1C2(C)CCC2 Amb24636942 [0,1,0,1,0,0|2,0,0]=4 13792 B13R2.3569 Cc1ccccc1C2(C)CNC2 Amb18563525 [0,1,0,1,0,0|1,0,0]=3 13793 B13R2.3569 Cc1ccccc1C2(N)CCC2 Amb28555682 [0,1,0,1,0,0|2,0,0]=4 13794 B13R2.3569 Cc1ccccc1C2(N)CCC2 Amb9211467 [0,1,0,1,0,0|2,0,0]=4 13795 B13R2.3569 Cc1ccccc1C2(N)COC2 Amb27460238 [0,1,0,1,0,0|2,0,0]=4 13796 B13R2.3569 Cc1ccccc1C2(O)CNC2 Amb25323719 [0,1,0,1,0,0|1,0,0]=3 13797 B13R2.3569 Cc1ccccc1C2(O)CNC2 Amb32651860 [0,1,0,1,0,0|1,0,0]=3 13798 B13R2.3569 Cc1ccccc1C2(O)COC2 Amb27770908 [0,1,0,1,0,0|2,0,0]=4 13799 B13R2.3569 Cc1ccccc1C2(O)CSC2 Amb27399593 [0,1,0,1,0,0|2,0,0]=4 13800 B13R2.3569 Cc1cccnc1C2(O)CNC2 Amb33360240 [0,1,0,1,0,0|2,0,0]=4 13801 B13R2.3569 Cc1ccncc1C2(O)CNC2 Amb26517200 [0,1,0,1,0,0|2,0,0]=4 13802 B13R2.3569 Cc1cnccc1C2(O)CNC2 Amb33426441 [0,1,0,1,0,0|2,0,0]=4 13803 B13R2.3569 Cc1ncccc1C2(O)CNC2 Amb33224562 [0,1,0,1,0,0|2,0,0]=4 13804 B13R2.3569 Fc1ccccc1C2(F)CNC2 Amb24425207 [0,1,0,1,0,0|0,1,0]=3 13805 B13R2.3569 Fc1ccccc1C2(F)CNC2 Amb32941830 [0,1,0,1,0,0|0,1,0]=3 13806 B13R2.3569 NC1(c2ccccc2Br)CCC1 Amb18948441 [0,1,0,1,0,0|1,0,0]=3 13807 B13R2.3569 NC1(c2ccccc2Br)CCC1 Amb19892796 [0,1,0,1,0,0|1,0,0]=3 13808 B13R2.3569 NC1(c2ccccc2Br)COC1 Amb27879660 [0,1,0,1,0,0|1,0,0]=3 13809 B13R2.3569 NC1(c2ccccc2Br)COC1 Amb28989495 [0,1,0,1,0,0|1,0,0]=3 13810 B13R2.3569 NC1(c2ccccc2Cl)CCC1 Amb18279451 [0,1,0,1,0,0|1,1,0]=4 13811 B13R2.3569 NC1(c2ccccc2Cl)CCC1 Amb19892631 [0,1,0,1,0,0|1,1,0]=4 13812 B13R2.3569 NC1(c2ccccc2F)CCC1 Amb19892633 [0,1,0,1,0,0|1,1,0]=4 13813 B13R2.3569 NC1(c2ccccc2F)CCC1 Amb5754031 [0,1,0,1,0,0|1,1,0]=4 13814 B13R2.3569 NC1(c2ccccc2F)COC1 Amb19892674 [0,1,0,1,0,0|1,1,0]=4 13815 B13R2.3569 NC1(c2ccccc2F)COC1 Amb24518551 [0,1,0,1,0,0|1,1,0]=4 13816 B13R2.3569 NC1(c2ccccc2O)CCC1 Amb25719491 [0,1,0,1,0,0|2,0,0]=4 13817 B13R2.3569 NC1(c2cccnc2Br)CCC1 Amb33388142 [0,1,0,1,0,0|2,0,0]=4 13818 B13R2.3569 NC1(c2ccncc2Br)CCC1 Amb24757458 [0,1,0,1,0,0|2,0,0]=4 13819 B13R2.3569 NC1(c2ncccc2Br)CCC1 Amb27401294 [0,1,0,1,0,0|2,0,0]=4 13820 B13R2.3569 Nc1ccccc1C2(F)CCC2 Amb27633604 [0,1,0,1,0,0|2,0,0]=4 13821 B13R2.3569 Nc1ccccc1C2(N)CCC2 Amb26986303 [0,1,0,1,0,0|2,0,0]=4 13822 B13R2.3569 Nc1ncccc1C2(O)CNC2 Amb28186894 [0,1,0,1,0,0|2,0,0]=4 13823 B13R2.3569 OC1(c2ccccc2Br)CNC1 Amb28061274 [0,1,0,1,0,0|0,0,0]=2 13824 B13R2.3569 OC1(c2ccccc2Cl)CCC1 Amb26352361 [0,1,0,1,0,0|1,1,0]=4 13825 B13R2.3569 OC1(c2ccccc2Cl)CNC1 Amb27649353 [0,1,0,1,0,0|0,1,0]=3 13826 B13R2.3569 OC1(c2ccccc2Cl)COC1 Amb29871342 [0,1,0,1,0,0|1,1,0]=4 13827 B13R2.3569 OC1(c2ccccc2Cl)CSC1 Amb28248344 [0,1,0,1,0,0|1,1,0]=4 13828 B13R2.3569 OC1(c2ccccc2F)CCC1 Amb28048628 [0,1,0,1,0,0|1,1,0]=4 13829 B13R2.3569 OC1(c2ccccc2F)CNC1 Amb25738686 [0,1,0,1,0,0|0,1,0]=3 13830 B13R2.3569 OC1(c2ccccc2F)CNC1 Amb35749556 [0,1,0,1,0,0|0,1,0]=3 13831 B13R2.3569 OC1(c2ccccc2F)COC1 Amb35658910 [0,1,0,1,0,0|1,1,0]=4 13832 B13R2.3569 OC1(c2cccnc2Br)CCC1 Amb22752677 [0,1,0,1,0,0|2,0,0]=4 13833 B13R2.3569 OC1(c2cccnc2Br)CNC1 Amb33389451 [0,1,0,1,0,0|1,0,0]=3 13834 B13R2.3569 OC1(c2cccnc2Br)COC1 Amb35604571 [0,1,0,1,0,0|2,0,0]=4 13835 B13R2.3569 OC1(c2cccnc2Br)CSC1 Amb35670271 [0,1,0,1,0,0|2,0,0]=4 13836 B13R2.3569 OC1(c2cccnc2Cl)CNC1 Amb33257382 [0,1,0,1,0,0|1,1,0]=4 13837 B13R2.3569 OC1(c2cccnc2Cl)CNC1 Amb33733640 [0,1,0,1,0,0|1,1,0]=4 13838 B13R2.3569 OC1(c2cccnc2F)CNC1 Amb33377164 [0,1,0,1,0,0|1,1,0]=4 13839 B13R2.3569 OC1(c2cccnc2F)CNC1 Amb35749764 [0,1,0,1,0,0|1,1,0]=4 13840 B13R2.3569 OC1(c2cccnc2F)CNC1 Amb35789586 [0,1,0,1,0,0|1,1,0]=4 13841 B13R2.3569 OC1(c2ccncc2Br)CCC1 Amb22752678 [0,1,0,1,0,0|2,0,0]=4 13842 B13R2.3569 OC1(c2ccncc2Br)CNC1 Amb33388632 [0,1,0,1,0,0|1,0,0]=3 13843 B13R2.3569 OC1(c2ccncc2Cl)CNC1 Amb33413777 [0,1,0,1,0,0|1,1,0]=4 13844 B13R2.3569 OC1(c2ccncc2F)CNC1 Amb25340112 [0,1,0,1,0,0|1,1,0]=4 13845 B13R2.3569 OC1(c2ncccc2Br)CNC1 Amb33336353 [0,1,0,1,0,0|1,0,0]=3 13846 B13R2.3569 OC1(c2ncccc2F)CNC1 Amb33358859 [0,1,0,1,0,0|1,1,0]=4 13847 B13R2.3569 Oc1ccccc1C2(O)CNC2 Amb33195799 [0,1,0,1,0,0|1,0,0]=3 13848 B13R2.3569 Oc1ccccc1C2(O)COC2 Amb25992625 [0,1,0,1,0,0|2,0,0]=4 13849 B13R2.3570 CC1CC1(N)c2ccccc2Br Amb27805597 [0,1,0,1,0,0|1,0,0]=3 13850 B13R2.3570 CC1CC1(N)c2ccccc2O Amb27242608 [0,1,0,1,0,0|2,0,0]=4 13851 B13R2.3570 CC1CC1(O)c2ccccc2Br Amb28146579 [0,1,0,1,0,0|1,0,0]=3 13852 B13R2.3570 CC1CC1(O)c2ccncc2Br Amb27785869 [0,1,0,1,0,0|2,0,0]=4 13853 B13R2.4818 Brc1cccc2c1C(Br)CCN2 Amb27218608 [0,1,0,1,0,0|2,0,0]=4 13854 B13R2.4818 Brc1cccc2c1C(Br)CCO2 Amb24719572 [0,1,0,1,0,0|2,0,0]=4 13855 B13R2.4818 Brc1cccc2c1C(Br)CCS2 Amb27650420 [0,1,0,1,0,0|2,0,0]=4 13856 B13R2.4818 Brc1cccc2c1C(I)CCN2 Amb28053219 [0,1,0,1,0,0|2,0,0]=4 13857 B13R2.4818 Brc1cccc2c1C(I)CCS2 Amb28071507 [0,1,0,1,0,0|2,0,0]=4 13858 B13R2.4818 CC1CNCc2cccc(Cl)c21 Amb18648574 [0,1,0,1,0,0|0,1,0]=3 13859 B13R2.4818 CC1CNCc2cccc(F)c21 Amb27426903 [0,1,0,1,0,0|0,1,0]=3 13860 B13R2.4818 CC1CNCc2cccc(N)c21 Amb18355178 [0,1,0,1,0,0|1,0,0]=3 13861 B13R2.4818 CC1NCCc2cccc(Br)c21 Amb25707530 [0,1,0,1,0,0|2,0,0]=4 13862 B13R2.4818 CN1CCCc2cccc(Br)c21 Amb18159824 [0,1,0,1,0,0|2,0,0]=4 13863 B13R2.4818 C[C@@H]1NCCc2cccc(Br)c21 Amb27615335 [0,1,0,1,0,0|2,0,0]=4 13864 B13R2.4818 C[C@H]1NCCc2cccc(Br)c21 Amb27968392 [0,1,0,1,0,0|2,0,0]=4 13865 B13R2.4818 Cc1cccc2c1C(C)CCC2 Amb25314391 [0,1,0,1,0,0|2,0,0]=4 13866 B13R2.4818 Cc1cccc2c1C(C)CNC2 Amb28254564 [0,1,0,1,0,0|1,0,0]=3 13867 B13R2.4818 Cc1cccc2c1C(N)CCC2 Amb27160386 [0,1,0,1,0,0|2,0,0]=4 13868 B13R2.4818 Cc1cccc2c1C(N)CCC2 Amb35788629 [0,1,0,1,0,0|2,0,0]=4 13869 B13R2.4818 Cc1cccc2c1C(O)CCC2 Amb28321519 [0,1,0,1,0,0|2,0,0]=4 13870 B13R2.4818 Cc1cccc2c1[C@@H](N)COC2 Amb27949986 [0,1,0,1,0,0|2,0,0]=4 13871 B13R2.4818 Cc1ccnc2c1C(O)CNC2 Amb18828799 [0,1,0,1,0,0|2,0,0]=4 13872 B13R2.4818 ClC1CCNc2cccc(Br)c21 Amb26423877 [0,1,0,1,0,0|2,0,0]=4 13873 B13R2.4818 ClC1CCSc2cccc(Br)c21 Amb27211070 [0,1,0,1,0,0|2,0,0]=4 13874 B13R2.4818 NC1CCCc2cccc(Br)c21 Amb22500451 [0,1,0,1,0,0|1,0,0]=3 13875 B13R2.4818 NC1CCCc2cccc(F)c21 Amb22295835 [0,1,0,1,0,0|1,1,0]=4 13876 B13R2.4818 NC1CCCc2cccc(F)c21 Amb35788633 [0,1,0,1,0,0|1,1,0]=4 13877 B13R2.4818 NC1CCNc2cccc(Br)c21 Amb18749925 [0,1,0,1,0,0|2,0,0]=4 13878 B13R2.4818 NC1CCOc2cccc(Br)c21 Amb18160369 [0,1,0,1,0,0|2,0,0]=4 13879 B13R2.4818 NC1CCSc2cccc(Br)c21 Amb24395220 [0,1,0,1,0,0|2,0,0]=4 13880 B13R2.4818 NC1COCc2cccc(Br)c21 Amb27770940 [0,1,0,1,0,0|1,0,0]=3 13881 B13R2.4818 NC1COCc2cccc(Cl)c21 Amb27204479 [0,1,0,1,0,0|1,1,0]=4 13882 B13R2.4818 NC1COCc2cccc(O)c21 Amb27225909 [0,1,0,1,0,0|2,0,0]=4 13883 B13R2.4818 N[C@@H]1CCCc2cccc(Br)c21 Amb27761878 [0,1,0,1,0,0|1,0,0]=3 13884 B13R2.4818 N[C@@H]1COCc2cccc(Cl)c21 Amb27622214 [0,1,0,1,0,0|1,1,0]=4 13885 B13R2.4818 N[C@@H]1COCc2cccc(F)c21 Amb27800893 [0,1,0,1,0,0|1,1,0]=4 13886 B13R2.4818 N[C@H]1CCCc2cccc(Br)c21 Amb27441736 [0,1,0,1,0,0|1,0,0]=3 13887 B13R2.4818 N[C@H]1CCCc2cccc(Cl)c21 Amb28250880 [0,1,0,1,0,0|1,1,0]=4 13888 B13R2.4818 N[C@H]1CCCc2cccc(S)c21 Amb27658888 [0,1,0,1,0,0|2,0,0]=4 13889 B13R2.4818 N[C@H]1CCNc2cccc(Br)c21 Amb27190932 [0,1,0,1,0,0|2,0,0]=4 13890 B13R2.4818 N[C@H]1COCc2cccc(Br)c21 Amb27390669 [0,1,0,1,0,0|1,0,0]=3 13891 B13R2.4818 Nc1cccc2c1C(N)CCC2 Amb26846138 [0,1,0,1,0,0|2,0,0]=4 13892 B13R2.4818 Nc1cccc2c1C(N)CCC2 Amb28653057 [0,1,0,1,0,0|2,0,0]=4 13893 B13R2.4818 Nc1cccc2c1[C@H](N)CCC2 Amb27490859 [0,1,0,1,0,0|2,0,0]=4 13894 B13R2.4818 O=C1CCCc2cccc(Br)c21 Amb8388747 [0,1,0,1,0,0|1,0,1]=4 13895 B13R2.4818 OC1CCCc2cccc(Br)c21 Amb8388746 [0,1,0,1,0,0|1,0,0]=3 13896 B13R2.4818 OC1CCNc2cccc(Br)c21 Amb24493402 [0,1,0,1,0,0|2,0,0]=4 13897 B13R2.4818 OC1CCSc2cccc(Br)c21 Amb26555331 [0,1,0,1,0,0|2,0,0]=4 13898 B13R2.4818 Oc1cccc2c1C(F)CNC2 Amb28129440 [0,1,0,1,0,0|1,0,0]=3 13899 B13R2.4818 Oc1cccc2c1C(O)CNC2 Amb27795276 [0,1,0,1,0,0|1,0,0]=3 13900 B13R2.4818 SC1CCNc2cccc(Br)c21 Amb27813536 [0,1,0,1,0,0|2,0,0]=4 13901 B13R2.4818 SC1CCOc2cccc(Br)c21 Amb25212736 [0,1,0,1,0,0|2,0,0]=4 13902 B13R2.4857 CC1CC(=O)c2cccc(Br)c21 Amb9748160 [0,1,0,1,0,0|2,0,0]=4 13903 B13R2.4857 CC1CC(N)c2cccc(Br)c21 Amb6705570 [0,1,0,1,0,0|2,0,0]=4 13904 B13R2.4857 CN1NC(=O)c2c(Br)cccc21 Amb28366293 [0,1,0,1,0,0|1,0,1]=4 13905 B13R2.4857 Cc1nn(C)c2cccc(Br)c12 Amb10070865 [0,1,0,1,0,0|1,0,1]=4 13906 B13R2.4857 Cn1nc(Br)c2c(Br)cccc21 Amb28123577 [0,1,0,1,0,0|1,0,1]=4 13907 B13R2.4857 Cn1nc(N)c2c(Br)cccc21 Amb22736263 [0,1,0,1,0,0|1,0,1]=4 13908 B13R2.4857 NC1CC(=O)c2cccc(Br)c21 Amb17472098 [0,1,0,1,0,0|2,0,0]=4 13909 B13R2.4857 N[C@@H]1CC(=O)c2cccc(Br)c21 Amb27439593 [0,1,0,1,0,0|2,0,0]=4 13910 B13R2.4857 N[C@H]1CC(=O)c2cccc(Br)c21 Amb27623954 [0,1,0,1,0,0|2,0,0]=4 13911 B13R2.103 CNC1(C)Cc2ccccc2C1 Amb27479886 [0,1,0,1,0,0|1,0,0]=3 13912 B13R2.217 Cc1ccccc1CC2(F)CC2 Amb28199166 [0,1,0,1,0,0|2,0,0]=4 13913 B13R2.217 Cc1ccccc1CC2(N)CC2 Amb17622182 [0,1,0,1,0,0|2,0,0]=4 13914 B13R2.217 Cc1ccccc1CC2(N)CC2 Amb5737540 [0,1,0,1,0,0|2,0,0]=4 13915 B13R2.217 Cc1ccccc1CC2(O)CC2 Amb18798127 [0,1,0,1,0,0|2,0,0]=4 13916 B13R2.217 NC1(Cc2ccccc2Br)CC1 Amb18964865 [0,1,0,1,0,0|1,0,0]=3 13917 B13R2.217 NC1(Cc2ccccc2Br)CC1 Amb28555733 [0,1,0,1,0,0|1,0,0]=3 13918 B13R2.217 NC1(Cc2ccccc2Cl)CC1 Amb5737549 [0,1,0,1,0,0|1,1,0]=4 13919 B13R2.217 NC1(Cc2ccccc2F)CC1 Amb5737543 [0,1,0,1,0,0|1,1,0]=4 13920 B13R2.217 NC1(Cc2ccccc2O)CC1 Amb25777150 [0,1,0,1,0,0|2,0,0]=4 13921 B13R2.217 NC1(Cc2cccnc2Br)CC1 Amb33387795 [0,1,0,1,0,0|2,0,0]=4 13922 B13R2.217 NC1(Cc2ccncc2Br)CC1 Amb33244345 [0,1,0,1,0,0|2,0,0]=4 13923 B13R2.217 NC1(Cc2ncccc2Br)CC1 Amb27417022 [0,1,0,1,0,0|2,0,0]=4 13924 B13R2.217 OC1(Cc2ccccc2Br)CC1 Amb27208582 [0,1,0,1,0,0|1,0,0]=3 13925 B13R2.217 OC1(Cc2ccccc2Cl)CC1 Amb18325306 [0,1,0,1,0,0|1,1,0]=4 13926 B13R2.217 OC1(Cc2ccccc2F)CC1 Amb18798542 [0,1,0,1,0,0|1,1,0]=4 13927 B13R2.217 OC1(Cc2cccnc2Br)CC1 Amb33388179 [0,1,0,1,0,0|2,0,0]=4 13928 B13R2.217 OC1(Cc2ccncc2Br)CC1 Amb33388688 [0,1,0,1,0,0|2,0,0]=4 13929 B13R2.217 OC1(Cc2ncccc2Br)CC1 Amb33336395 [0,1,0,1,0,0|2,0,0]=4 13930 B13R2.217 Oc1ccccc1CC2(O)CC2 Amb26364704 [0,1,0,1,0,0|2,0,0]=4 13931 B13R2.369 CC1Cc2ccccc2CN1C Amb18463472 [0,1,0,1,0,0|1,0,0]=3 13932 B13R2.369 CC1Cc2ccccc2CN1N Amb28291347 [0,1,0,1,0,0|2,0,0]=4 13933 B13R2.369 CC1Cc2ccccc2NC1C Amb27174199 [0,1,0,1,0,0|2,0,0]=4 13934 B13R2.369 CC1Nc2ccccc2CC1O Amb27467455 [0,1,0,1,0,0|2,0,0]=4 13935 B13R2.369 CC1Oc2ccccc2CC1N Amb18645891 [0,1,0,1,0,0|2,0,0]=4 13936 B13R2.369 CC1Oc2ccccc2CC1N Amb33743347 [0,1,0,1,0,0|2,0,0]=4 13937 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,1,0,1,0,0|1,0,1]=4 13938 B13R2.369 C[C@H]1Cc2ccccc2N[C@H]1C Amb27637741 [0,1,0,1,0,0|2,0,0]=4 13939 B13R2.369 C[C@H]1Nc2ccccc2C[C@@H]1O Amb28286665 [0,1,0,1,0,0|2,0,0]=4 13940 B13R2.369 C[C@H]1Nc2ccccc2C[C@H]1O Amb27463085 [0,1,0,1,0,0|2,0,0]=4 13941 B13R2.369 C[C@H]1Oc2ccccc2C[C@@H]1N Amb27214189 [0,1,0,1,0,0|2,0,0]=4 13942 B13R2.369 C[C@H]1Oc2ccccc2C[C@H]1N Amb27847520 [0,1,0,1,0,0|2,0,0]=4 13943 B13R2.4825 CC1Cc2c(Br)cccc2C1=O Amb16187179 [0,1,0,1,0,0|2,0,0]=4 13944 B13R2.4825 CC1Cc2c(Br)cccc2C1Cl Amb27641540 [0,1,0,1,0,0|2,0,0]=4 13945 B13R2.4825 CC1Cc2c(Br)cccc2C1O Amb27975559 [0,1,0,1,0,0|2,0,0]=4 13946 B13R2.4825 CN1C(=O)Cc2c(Br)cccc21 Amb10067623 [0,1,0,1,0,0|0,0,1]=3 13947 B13R2.4825 CN1C(=O)Cc2c(Cl)cccc21 Amb28244286 [0,1,0,1,0,0|0,1,1]=4 13948 B13R2.4825 CN1C(=O)Cc2c(N)cccc21 Amb26854239 [0,1,0,1,0,0|1,0,1]=4 13949 B13R2.4825 CN1C(=O)Nc2c(Br)cccc21 Amb22586607 [0,1,0,1,0,0|1,0,1]=4 13950 B13R2.4825 CN1C(=O)Oc2c(Br)cccc21 Amb18547407 [0,1,0,1,0,0|1,0,1]=4 13951 B13R2.4825 CN1C(=S)Nc2c(Br)cccc21 Amb22584180 [0,1,0,1,0,0|1,0,1]=4 13952 B13R2.4825 Cc1cc2c(Br)cccc2n1C Amb18761491 [0,1,0,1,0,0|0,0,2]=4 13953 B13R2.4825 Cc1cccc2c1CC(=S)N2C Amb28244236 [0,1,0,1,0,0|1,0,1]=4 13954 B13R2.4825 Cc1nc2c(Br)cccc2n1C Amb23412393 [0,1,0,1,0,0|1,0,1]=4 13955 B13R2.4825 Cn1c(Br)nc2c(Br)cccc21 Amb25995166 [0,1,0,1,0,0|1,0,1]=4 13956 B13R2.4825 Cn1c(Cl)nc2c(Br)cccc21 Amb22736038 [0,1,0,1,0,0|1,0,1]=4 13957 B13R2.4825 NC1Cc2c(Br)cccc2C1=O Amb27632732 [0,1,0,1,0,0|2,0,0]=4 13958 B13R2.4825 O=C1c2cccc(Br)c2CC1I Amb24659630 [0,1,0,1,0,0|2,0,0]=4 13959 B13R2.15272 CC[C@@H](O)C1Cc2ccccc21 Amb27177476 [0,1,0,1,0,0|2,0,0]=4 13960 B13R2.15272 CNC(=O)C1Cc2ccccc21 Amb27166885 [0,1,0,1,0,0|1,0,1]=4 13961 B13R2.15272 CNC(C)C1Cc2ccccc21 Amb26590734 [0,1,0,1,0,0|1,0,0]=3 13962 B13R2.174 Brc1ccc(Br)c(C2CCC2)c1 Amb27649129 [0,1,0,1,0,0|1,0,0]=3 13963 B13R2.174 Brc1ccc(Br)c([C@H]2CCN2)c1 Amb27868635 [0,1,0,1,0,0|2,0,0]=4 13964 B13R2.174 Cc1ccc(Br)c(C2CCN2)c1 Amb33477525 [0,1,0,1,0,0|2,0,0]=4 13965 B13R2.174 Cc1ccc(Br)c(C2CNC2)c1 Amb33477494 [0,1,0,1,0,0|0,0,0]=2 13966 B13R2.174 Cc1ccc(Br)cc1C2CNC2 Amb27148730 [0,1,0,1,0,0|1,0,0]=3 13967 B13R2.174 Cc1ccc(C)c(C2CNC2)c1 Amb18563529 [0,1,0,1,0,0|1,0,0]=3 13968 B13R2.174 Cc1ccc(Cl)c(C2CNC2)c1 Amb27227924 [0,1,0,1,0,0|0,1,0]=3 13969 B13R2.174 Cc1ccc(Cl)cc1C2CNC2 Amb24737334 [0,1,0,1,0,0|1,0,0]=3 13970 B13R2.174 Cc1ccc(F)c(C2CCC2)c1 Amb32685667 [0,1,0,1,0,0|1,1,0]=4 13971 B13R2.174 Cc1ccc(F)c(C2CNC2)c1 Amb26632994 [0,1,0,1,0,0|0,1,0]=3 13972 B13R2.174 Cc1ccc(F)cc1C2CCC2 Amb32685018 [0,1,0,1,0,0|2,0,0]=4 13973 B13R2.174 Cc1ccc(F)cc1C2CNC2 Amb27476137 [0,1,0,1,0,0|1,0,0]=3 13974 B13R2.174 Cc1ccc(O)c(C2CNC2)c1 Amb25965997 [0,1,0,1,0,0|1,0,0]=3 13975 B13R2.174 Cc1cnc(F)c(C2CNC2)c1 Amb27243845 [0,1,0,1,0,0|1,1,0]=4 13976 B13R2.174 Clc1cc(C2CNC2)c(Br)cn1 Amb24459736 [0,1,0,1,0,0|1,0,0]=3 13977 B13R2.174 Clc1cc(C2CNC2)c(Cl)cn1 Amb24537720 [0,1,0,1,0,0|1,1,0]=4 13978 B13R2.174 Clc1ccc(Br)c(C2CCN2)c1 Amb28078273 [0,1,0,1,0,0|2,0,0]=4 13979 B13R2.174 Clc1ccc(Br)c(C2CNC2)c1 Amb27230023 [0,1,0,1,0,0|0,0,0]=2 13980 B13R2.174 Clc1ccc(Br)c([C@H]2CCN2)c1 Amb27393143 [0,1,0,1,0,0|2,0,0]=4 13981 B13R2.174 Clc1ccc(Br)cc1C2CNC2 Amb25775840 [0,1,0,1,0,0|0,1,0]=3 13982 B13R2.174 Clc1ccc(Cl)c(C2CNC2)c1 Amb25667573 [0,1,0,1,0,0|0,1,0]=3 13983 B13R2.174 Clc1ccc(Cl)c(C2CNC2)n1 Amb28121476 [0,1,0,1,0,0|1,1,0]=4 13984 B13R2.174 Clc1ncc(Br)cc1C2CNC2 Amb27750878 [0,1,0,1,0,0|1,1,0]=4 13985 B13R2.174 Fc1ccc(Br)c(C2CCN2)c1 Amb25148830 [0,1,0,1,0,0|2,0,0]=4 13986 B13R2.174 Fc1ccc(Br)c(C2CNC2)c1 Amb25890618 [0,1,0,1,0,0|0,0,0]=2 13987 B13R2.174 Fc1ccc(Br)c([C@@H]2CCN2)c1 Amb27400565 [0,1,0,1,0,0|2,0,0]=4 13988 B13R2.174 Fc1ccc(Br)cc1C2CNC2 Amb28196371 [0,1,0,1,0,0|0,1,0]=3 13989 B13R2.174 Fc1ccc(Cl)c(C2CNC2)c1 Amb26494416 [0,1,0,1,0,0|0,1,0]=3 13990 B13R2.174 Fc1ccc(Cl)cc1C2CCC2 Amb32695984 [0,1,0,1,0,0|1,1,0]=4 13991 B13R2.174 Fc1ccc(Cl)cc1C2CNC2 Amb24400540 [0,1,0,1,0,0|0,1,0]=3 13992 B13R2.174 Fc1ccc(F)c(C2CNC2)c1 Amb18563889 [0,1,0,1,0,0|0,1,0]=3 13993 B13R2.174 Fc1ccc(I)c(C2CNC2)c1 Amb27482723 [0,1,0,1,0,0|0,1,0]=3 13994 B13R2.174 Fc1cnc(Cl)c(C2CNC2)c1 Amb26517556 [0,1,0,1,0,0|1,1,0]=4 13995 B13R2.174 Fc1ncc(Br)cc1C2CNC2 Amb33478043 [0,1,0,1,0,0|1,1,0]=4 13996 B13R2.174 Fc1ncc(Cl)cc1C2CNC2 Amb26056811 [0,1,0,1,0,0|1,1,0]=4 13997 B13R2.174 Nc1ccc(Cl)cc1C2CCC2 Amb27793142 [0,1,0,1,0,0|2,0,0]=4 13998 B13R2.174 Oc1ccc(Br)c(C2CCN2)c1 Amb24451178 [0,1,0,1,0,0|2,0,0]=4 13999 B13R2.174 Oc1ccc(Br)c(C2CNC2)c1 Amb26352547 [0,1,0,1,0,0|0,0,0]=2 14000 B13R2.174 Oc1ccc(Br)c([C@@H]2CCN2)c1 Amb27646684 [0,1,0,1,0,0|2,0,0]=4 14001 B13R2.174 Oc1ccc(Br)cc1C2CNC2 Amb26372450 [0,1,0,1,0,0|1,0,0]=3 14002 B13R2.174 Oc1ccc(Cl)cc1C2CNC2 Amb26517466 [0,1,0,1,0,0|1,0,0]=3 14003 B13R2.174 Oc1ccc(F)cc1C2CNC2 Amb25100874 [0,1,0,1,0,0|1,0,0]=3 14004 B13R2.174 Oc1ccc(I)cc1C2CNC2 Amb27958470 [0,1,0,1,0,0|1,0,0]=3 14005 B13R2.174 Oc1ccc(O)c(C2CNC2)c1 Amb25337560 [0,1,0,1,0,0|1,0,0]=3 14006 B13R2.174 Oc1ncc(Cl)cc1C2CNC2 Amb28139009 [0,1,0,1,0,0|2,0,0]=4 14007 B13R2.175 Brc1ccc(I)cc1NC2CC2 Amb27444494 [0,1,0,1,0,0|2,0,0]=4 14008 B13R2.175 Cc1ccc(Br)c(CC2CO2)c1 Amb33477552 [0,1,0,1,0,0|1,0,0]=3 14009 B13R2.175 Cc1ccc(Br)cc1CC2CO2 Amb33450339 [0,1,0,1,0,0|2,0,0]=4 14010 B13R2.175 Cc1ccc(C)c(CC2CO2)c1 Amb25674091 [0,1,0,1,0,0|2,0,0]=4 14011 B13R2.175 Cc1ccc(Cl)c(CC2CO2)c1 Amb24339197 [0,1,0,1,0,0|1,1,0]=4 14012 B13R2.175 Cc1ccc(Cl)cc1CC2CO2 Amb32698724 [0,1,0,1,0,0|2,0,0]=4 14013 B13R2.175 Cc1ccc(F)c(CC2CO2)c1 Amb25247698 [0,1,0,1,0,0|1,1,0]=4 14014 B13R2.175 Cc1ccc(F)cc1CC2CO2 Amb26858089 [0,1,0,1,0,0|2,0,0]=4 14015 B13R2.175 Cc1ccc(O)c(CC2CO2)c1 Amb28246566 [0,1,0,1,0,0|2,0,0]=4 14016 B13R2.175 Clc1cc(CC2CO2)c(Br)cn1 Amb33478132 [0,1,0,1,0,0|2,0,0]=4 14017 B13R2.175 Clc1ccc(Br)c(CC2CO2)c1 Amb33478245 [0,1,0,1,0,0|1,0,0]=3 14018 B13R2.175 Clc1ccc(Br)cc1CC2CO2 Amb33450533 [0,1,0,1,0,0|1,1,0]=4 14019 B13R2.175 Clc1ccc(Cl)c(CC2CO2)c1 Amb24743160 [0,1,0,1,0,0|1,1,0]=4 14020 B13R2.175 Fc1ccc(Br)c(CC2CO2)c1 Amb33008770 [0,1,0,1,0,0|1,0,0]=3 14021 B13R2.175 Fc1ccc(Br)cc1CC2CO2 Amb27807038 [0,1,0,1,0,0|1,1,0]=4 14022 B13R2.175 Fc1ccc(Cl)c(CC2CO2)c1 Amb24354734 [0,1,0,1,0,0|1,1,0]=4 14023 B13R2.175 Fc1ccc(Cl)cc1CC2CO2 Amb32698729 [0,1,0,1,0,0|1,1,0]=4 14024 B13R2.175 Fc1ccc(F)c(CC2CO2)c1 Amb27411614 [0,1,0,1,0,0|1,1,0]=4 14025 B13R2.175 Nc1ccc(O)cc1CC2CC2 Amb27781048 [0,1,0,1,0,0|2,0,0]=4 14026 B13R2.175 Oc1ccc(F)cc1CC2CC2 Amb27614310 [0,1,0,1,0,0|2,0,0]=4 14027 B13R2.175 Oc1ccc(I)c(CC2CC2)c1 Amb27463076 [0,1,0,1,0,0|1,1,0]=4 14028 B13R2.371 Brc1ccc(Br)c2c1CCCN2 Amb25149786 [0,1,0,1,0,0|2,0,0]=4 14029 B13R2.371 Cc1ccc(Br)c2c1CCNC2 Amb27201852 [0,1,0,1,0,0|1,0,0]=3 14030 B13R2.371 Cc1ccc(Br)c2c1NCCC2 Amb9672462 [0,1,0,1,0,0|2,0,0]=4 14031 B13R2.371 Cc1ccc(C)c2c1CCOC2 Amb28250895 [0,1,0,1,0,0|2,0,0]=4 14032 B13R2.371 Cc1ccc(F)c2c1CCNC2 Amb27152196 [0,1,0,1,0,0|1,0,0]=3 14033 B13R2.371 Cc1ccc(N)c2c1CCCC2 Amb22751124 [0,1,0,1,0,0|2,0,0]=4 14034 B13R2.371 Cc1ccc(N)c2c1CCNC2 Amb26990067 [0,1,0,1,0,0|1,0,0]=3 14035 B13R2.371 Cc1ccc(O)c2c1CCCC2 Amb17594041 [0,1,0,1,0,0|2,0,0]=4 14036 B13R2.371 Clc1ccc(Br)c2c1CCCN2 Amb26426881 [0,1,0,1,0,0|2,0,0]=4 14037 B13R2.371 Clc1ccc(Br)c2c1CCNC2 Amb25804520 [0,1,0,1,0,0|0,1,0]=3 14038 B13R2.371 Clc1ccc(Br)c2c1CNCC2 Amb33530132 [0,1,0,1,0,0|0,0,0]=2 14039 B13R2.371 Clc1ccc(Br)c2c1NCCC2 Amb26373547 [0,1,0,1,0,0|2,0,0]=4 14040 B13R2.371 Clc1ccc(Br)c2c1NCCC2 Amb33249686 [0,1,0,1,0,0|2,0,0]=4 14041 B13R2.371 Clc1ccc(Cl)c2c1CCNC2 Amb21929262 [0,1,0,1,0,0|0,1,0]=3 14042 B13R2.371 Clc1ccc(Cl)c2c1CCNC2 Amb27865836 [0,1,0,1,0,0|0,1,0]=3 14043 B13R2.371 Clc1ncc(Br)c2c1CCCC2 Amb27421532 [0,1,0,1,0,0|2,0,0]=4 14044 B13R2.371 Fc1ccc(Br)c2c1CCCN2 Amb26867828 [0,1,0,1,0,0|2,0,0]=4 14045 B13R2.371 Fc1ccc(Br)c2c1CCCO2 Amb28139804 [0,1,0,1,0,0|2,0,0]=4 14046 B13R2.371 Fc1ccc(Br)c2c1CCNC2 Amb26646431 [0,1,0,1,0,0|0,1,0]=3 14047 B13R2.371 Fc1ccc(Br)c2c1CNCC2 Amb25152612 [0,1,0,1,0,0|0,0,0]=2 14048 B13R2.371 Fc1ccc(Br)c2c1NCCC2 Amb9417958 [0,1,0,1,0,0|2,0,0]=4 14049 B13R2.371 Fc1ccc(F)c2c1CCNC2 Amb18943942 [0,1,0,1,0,0|0,1,0]=3 14050 B13R2.371 Fc1ccc(F)c2c1CCNC2 Amb33549930 [0,1,0,1,0,0|0,1,0]=3 14051 B13R2.371 Nc1ccc(Br)c2c1CCCC2 Amb25130533 [0,1,0,1,0,0|1,0,0]=3 14052 B13R2.371 Nc1ccc(Br)c2c1CCCC2 Amb33483339 [0,1,0,1,0,0|1,0,0]=3 14053 B13R2.371 Nc1ccc(Br)c2c1CNCC2 Amb21964433 [0,1,0,1,0,0|0,0,0]=2 14054 B13R2.371 Nc1ccc(Cl)c2c1CCCC2 Amb18648570 [0,1,0,1,0,0|1,1,0]=4 14055 B13R2.371 Nc1ccc(N)c2c1CCCC2 Amb27878778 [0,1,0,1,0,0|2,0,0]=4 14056 B13R2.371 Nc1ccc(O)c2c1CCCC2 Amb18645865 [0,1,0,1,0,0|2,0,0]=4 14057 B13R2.371 Nc1ccc(O)c2c1CCNC2 Amb28434852 [0,1,0,1,0,0|1,0,0]=3 14058 B13R2.371 Nc1ncc(Br)c2c1CCCC2 Amb27665348 [0,1,0,1,0,0|2,0,0]=4 14059 B13R2.371 O=C1NC=C(Br)C2=C1CCCC2 Amb26342050 [0,1,0,1,0,0|2,0,0]=4 14060 B13R2.371 Oc1ccc(Br)c2c1CCCC2 Amb27389221 [0,1,0,1,0,0|1,0,0]=3 14061 B13R2.371 Oc1ccc(Cl)c2c1CCCC2 Amb28243899 [0,1,0,1,0,0|1,1,0]=4 14062 B13R2.371 Oc1ccc(F)c2c1CCNC2 Amb26994113 [0,1,0,1,0,0|1,0,0]=3 14063 B13R2.371 Oc1ccc(F)c2c1CNCC2 Amb27864445 [0,1,0,1,0,0|0,1,0]=3 14064 B13R2.371 Oc1ccc(O)c2c1CCCC2 Amb18646026 [0,1,0,1,0,0|2,0,0]=4 14065 B13R2.371 Oc1ccc(S)c2c1CCCC2 Amb27261975 [0,1,0,1,0,0|2,0,0]=4 14066 B13R2.371 S=C1NC=C(Br)C2=C1CCCC2 Amb27441559 [0,1,0,1,0,0|2,0,0]=4 14067 B13R2.3127 Cc1ccc(Br)c(C2CC2N)c1 Amb33477480 [0,1,0,1,0,0|2,0,0]=4 14068 B13R2.3127 Cc1ccc(Br)c([C@@H]2C[C@H]2N)c1 Amb33477249 [0,1,0,1,0,0|2,0,0]=4 14069 B13R2.3127 NC1CC1c2cc(Cl)ccc2Br Amb25035169 [0,1,0,1,0,0|2,0,0]=4 14070 B13R2.3127 NC1CC1c2cc(F)ccc2Br Amb25122234 [0,1,0,1,0,0|2,0,0]=4 14071 B13R2.3127 NC1CC1c2cc(O)ccc2Br Amb33241258 [0,1,0,1,0,0|2,0,0]=4 14072 B13R2.3127 N[C@@H]1C[C@H]1c2cc(Cl)ccc2Br Amb33477925 [0,1,0,1,0,0|2,0,0]=4 14073 B13R2.3127 N[C@@H]1C[C@H]1c2cc(F)ccc2Br Amb33008253 [0,1,0,1,0,0|2,0,0]=4 14074 B13R2.3127 N[C@@H]1C[C@H]1c2cc(O)ccc2Br Amb33478622 [0,1,0,1,0,0|2,0,0]=4 14075 B13R2.3683 CC1CCc2cc(Br)ccc2N1 Amb18745512 [0,1,0,1,0,0|2,0,0]=4 14076 B13R2.3683 CC1CCc2cc(Br)ccc2O1 Amb26386817 [0,1,0,1,0,0|2,0,0]=4 14077 B13R2.3683 CC1CCc2cc(Cl)ccc2N1 Amb18559690 [0,1,0,1,0,0|2,0,0]=4 14078 B13R2.3683 CC1CCc2cc(F)ccc2N1 Amb593415 [0,1,0,1,0,0|2,0,0]=4 14079 B13R2.3683 CC1CCc2cc(F)ccc2O1 Amb32640413 [0,1,0,1,0,0|2,0,0]=4 14080 B13R2.3683 CC1CCc2cc(O)ccc2N1 Amb18645887 [0,1,0,1,0,0|2,0,0]=4 14081 B13R2.3683 CC1CCc2cc(O)ccc2O1 Amb27164642 [0,1,0,1,0,0|2,0,0]=4 14082 B13R2.3683 CN1CCC2=C(C=CC(=O)N2)C1 Amb23450143 [0,1,0,1,0,0|2,0,0]=4 14083 B13R2.3683 CN1CCc2cc(Br)ccc2C1 Amb18463348 [0,1,0,1,0,0|1,0,0]=3 14084 B13R2.3683 CN1CCc2cc(Br)ccc2S1 Amb26964315 [0,1,0,1,0,0|1,0,0]=3 14085 B13R2.3683 CN1CCc2cc(Cl)ccc2C1 Amb18463149 [0,1,0,1,0,0|1,0,0]=3 14086 B13R2.3683 CN1CCc2cc(N)ccc2C1 Amb18351560 [0,1,0,1,0,0|1,0,0]=3 14087 B13R2.3683 CN1CCc2cc(N)ccc2C1 Amb30625061 [0,1,0,1,0,0|1,0,0]=3 14088 B13R2.3683 CN1CCc2cc(N)cnc2C1 Amb24513620 [0,1,0,1,0,0|2,0,0]=4 14089 B13R2.3683 CN1CCc2cc(O)ccc2C1 Amb17843848 [0,1,0,1,0,0|1,0,0]=3 14090 B13R2.3683 C[C@@H]1CCc2cc(Br)ccc2N1 Amb22751677 [0,1,0,1,0,0|2,0,0]=4 14091 B13R2.3683 C[C@@H]1CCc2cc(N)ccc2N1 Amb27273064 [0,1,0,1,0,0|2,0,0]=4 14092 B13R2.3683 C[C@H]1CCc2cc(F)ccc2N1 Amb20241601 [0,1,0,1,0,0|2,0,0]=4 14093 B13R2.3683 C[C@H]1CCc2cc(I)ccc2N1 Amb28043925 [0,1,0,1,0,0|2,0,0]=4 14094 B13R2.3683 Cc1ccc2c(c1)CCC(C)N2 Amb18559689 [0,1,0,1,0,0|2,0,0]=4 14095 B13R2.3683 Cc1ccc2c(c1)CC[C@@H](C)N2 Amb26065564 [0,1,0,1,0,0|2,0,0]=4 14096 B13R2.3683 NN1CCc2cc(O)ccc2C1 Amb33725254 [0,1,0,1,0,0|2,0,0]=4 14097 B13R2.5151 CN1CCN2C(=O)C=CC(N)=C12 Amb18828300 [0,1,0,1,0,0|2,0,0]=4 14098 B13R2.5151 CN1CCc2c(Cl)ccc(Br)c21 Amb28044883 [0,1,0,1,0,0|0,1,0]=3 14099 B13R2.5151 Cc1ccc(Br)c2c1C(=O)CC2 Amb22288801 [0,1,0,1,0,0|2,0,0]=4 14100 B13R2.5151 Cc1ccc(Br)c2c1C(N)CC2 Amb24445980 [0,1,0,1,0,0|2,0,0]=4 14101 B13R2.5151 Cc1ccc(Br)c2c1[C@@H](N)CC2 Amb27403626 [0,1,0,1,0,0|2,0,0]=4 14102 B13R2.5151 Cc1ccc(Br)c2c1[C@H](N)CC2 Amb28383456 [0,1,0,1,0,0|2,0,0]=4 14103 B13R2.5151 Cc1ccc(Br)c2cnn(C)c12 Amb10070868 [0,1,0,1,0,0|1,0,1]=4 14104 B13R2.5151 Cc1ccc(C)c2c1CCC2C Amb25891956 [0,1,0,1,0,0|2,0,0]=4 14105 B13R2.5151 Cn1ccc2c(Br)ccc(F)c21 Amb23402226 [0,1,0,1,0,0|0,0,2]=4 14106 B13R2.5151 Cn1nnc2c(Br)ccc(Br)c21 Amb23541029 [0,1,0,1,0,0|2,0,0]=4 14107 B13R2.5151 Fc1ccc(Br)c2c1C(Br)CC2 Amb28321452 [0,1,0,1,0,0|2,0,0]=4 14108 B13R2.5151 Fc1ccc(Br)c2c1C(Cl)CC2 Amb27835147 [0,1,0,1,0,0|2,0,0]=4 14109 B13R2.5151 NC1CCc2c(Br)ccc(Br)c21 Amb27653536 [0,1,0,1,0,0|2,0,0]=4 14110 B13R2.5151 N[C@@H]1CCc2c(Br)ccc(Cl)c21 Amb27482582 [0,1,0,1,0,0|2,0,0]=4 14111 B13R2.5151 N[C@@H]1CCc2c(Br)ccc(I)c21 Amb28323126 [0,1,0,1,0,0|2,0,0]=4 14112 B13R2.5151 Nc1ccc(Br)c2c1C(=O)CC2 Amb27168078 [0,1,0,1,0,0|2,0,0]=4 14113 B13R2.5151 Nc1ccc(Br)c2c1[C@H](N)CC2 Amb28313660 [0,1,0,1,0,0|2,0,0]=4 14114 B13R2.5151 O=C1CCc2c(Br)ccc(Br)c21 Amb27852455 [0,1,0,1,0,0|2,0,0]=4 14115 B13R2.5151 O=C1CCc2c(Br)ccc(Cl)c21 Amb25804693 [0,1,0,1,0,0|2,0,0]=4 14116 B13R2.5151 O=C1CCc2c(Br)ccc(F)c21 Amb21964856 [0,1,0,1,0,0|2,0,0]=4 14117 B13R2.5151 O=C1CCc2c(Br)ccc(I)c21 Amb27482830 [0,1,0,1,0,0|2,0,0]=4 14118 B13R2.5151 O=C1CCc2c(Br)ccc(O)c21 Amb8479259 [0,1,0,1,0,0|2,0,0]=4 14119 B13R2.402 Brc1cccc(Br)c1NC2CC2 Amb27458259 [0,1,0,1,0,0|2,0,0]=4 14120 B13R2.402 Cc1cccc(Br)c1NC2CC2 Amb35721342 [0,1,0,1,0,0|2,0,0]=4 14121 B13R2.402 Cc1cccc(C)c1CC2CO2 Amb32698716 [0,1,0,1,0,0|2,0,0]=4 14122 B13R2.402 Cc1cccc(Cl)c1CC2CO2 Amb33259708 [0,1,0,1,0,0|1,1,0]=4 14123 B13R2.402 Cc1cccc(F)c1CC2CO2 Amb33143167 [0,1,0,1,0,0|1,1,0]=4 14124 B13R2.402 Clc1cccc(Br)c1CC2CO2 Amb25129261 [0,1,0,1,0,0|1,0,0]=3 14125 B13R2.402 Clc1cccc(Br)c1OC2CC2 Amb28048849 [0,1,0,1,0,0|2,0,0]=4 14126 B13R2.402 Clc1cccc(Cl)c1CC2CO2 Amb32698714 [0,1,0,1,0,0|1,1,0]=4 14127 B13R2.402 Fc1cccc(Br)c1CC2CO2 Amb32698727 [0,1,0,1,0,0|1,0,0]=3 14128 B13R2.402 Fc1cccc(Br)c1OC2CC2 Amb27412444 [0,1,0,1,0,0|2,0,0]=4 14129 B13R2.402 Fc1cccc(Cl)c1CC2CO2 Amb24464577 [0,1,0,1,0,0|1,1,0]=4 14130 B13R2.402 Fc1cccc(F)c1CC2CO2 Amb27408672 [0,1,0,1,0,0|1,1,0]=4 14131 B13R2.402 Nc1cccc(Br)c1NC2CC2 Amb32708757 [0,1,0,1,0,0|2,0,0]=4 14132 B13R2.402 Nc1cccc(Br)c1OC2CC2 Amb26620536 [0,1,0,1,0,0|2,0,0]=4 14133 B13R2.402 Nc1cccc(O)c1CC2CC2 Amb28291348 [0,1,0,1,0,0|2,0,0]=4 14134 B13R2.402 O=C1C=CC=C(Br)N1CC2CC2 Amb28207960 [0,1,0,1,0,0|2,0,0]=4 14135 B13R2.402 Oc1cccc(F)c1CC2CC2 Amb27175589 [0,1,0,1,0,0|1,1,0]=4 14136 B13R2.3490 Brc1ccnc(Br)c1C2CCC2 Amb24319976 [0,1,0,1,0,0|2,0,0]=4 14137 B13R2.3490 Cc1cccc(C)c1C2CNC2 Amb27751431 [0,1,0,1,0,0|1,0,0]=3 14138 B13R2.3490 Cc1cccc(Cl)c1C2CNC2 Amb27601544 [0,1,0,1,0,0|0,1,0]=3 14139 B13R2.3490 Cc1cccc(F)c1C2CNC2 Amb33143458 [0,1,0,1,0,0|0,1,0]=3 14140 B13R2.3490 Clc1cccc(Br)c1C2CCN2 Amb33337610 [0,1,0,1,0,0|2,0,0]=4 14141 B13R2.3490 Clc1cccc(Br)c1C2CNC2 Amb25945331 [0,1,0,1,0,0|0,0,0]=2 14142 B13R2.3490 Clc1cccc(Cl)c1C2CNC2 Amb28185905 [0,1,0,1,0,0|0,1,0]=3 14143 B13R2.3490 Clc1cncc(Cl)c1C2CNC2 Amb27462113 [0,1,0,1,0,0|1,1,0]=4 14144 B13R2.3490 Fc1cccc(Br)c1C2CCC2 Amb32658667 [0,1,0,1,0,0|1,0,0]=3 14145 B13R2.3490 Fc1cccc(Br)c1C2CCN2 Amb27150478 [0,1,0,1,0,0|2,0,0]=4 14146 B13R2.3490 Fc1cccc(Br)c1C2CNC2 Amb26066738 [0,1,0,1,0,0|0,0,0]=2 14147 B13R2.3490 Fc1cccc(Cl)c1C2CNC2 Amb18564352 [0,1,0,1,0,0|0,1,0]=3 14148 B13R2.3490 Fc1cccc(F)c1C2CNC2 Amb24484353 [0,1,0,1,0,0|0,1,0]=3 14149 B13R2.3490 Fc1cncc(F)c1C2CNC2 Amb32882303 [0,1,0,1,0,0|1,1,0]=4 14150 B13R2.3490 Fc1nccc(I)c1C2CNC2 Amb27239653 [0,1,0,1,0,0|1,1,0]=4 14151 B13R2.3490 Nc1cccc(Br)c1C2CCN2 Amb27807585 [0,1,0,1,0,0|2,0,0]=4 14152 B13R2.3490 Nc1cccc(Br)c1N2CCC2 Amb35638507 [0,1,0,1,0,0|2,0,0]=4 14153 B13R2.3490 Nc1cccc(Br)c1[C@@H]2CCN2 Amb27600225 [0,1,0,1,0,0|2,0,0]=4 14154 B13R2.3490 Nc1cccc(Cl)c1C2CCC2 Amb27793143 [0,1,0,1,0,0|1,1,0]=4 14155 B13R2.3490 Nc1nccc(Br)c1C2CCC2 Amb24319977 [0,1,0,1,0,0|2,0,0]=4 14156 B13R2.3490 Oc1cccc(Br)c1C2CCN2 Amb25687503 [0,1,0,1,0,0|2,0,0]=4 14157 B13R2.3490 Oc1cccc(Br)c1C2CNC2 Amb33331538 [0,1,0,1,0,0|0,0,0]=2 14158 B13R2.3490 Oc1cccc(Br)c1[C@H]2CCN2 Amb27784193 [0,1,0,1,0,0|2,0,0]=4 14159 B13R2.3490 Oc1cccc(Cl)c1C2CNC2 Amb26850165 [0,1,0,1,0,0|0,1,0]=3 14160 B13R2.3490 Oc1cccc(F)c1C2CNC2 Amb27591613 [0,1,0,1,0,0|0,1,0]=3 14161 B13R2.3490 Oc1cccc(O)c1C2CNC2 Amb27175781 [0,1,0,1,0,0|1,0,0]=3 14162 B13R2.5332 NC1CC1c2c(Cl)cccc2Br Amb33337346 [0,1,0,1,0,0|2,0,0]=4 14163 B13R2.5332 NC1CC1c2c(F)cccc2Br Amb25991802 [0,1,0,1,0,0|2,0,0]=4 14164 B13R2.5332 NC1CC1c2c(O)cccc2Br Amb33431136 [0,1,0,1,0,0|2,0,0]=4 14165 B13R2.5332 N[C@@H]1C[C@H]1c2c(Cl)cccc2Br Amb33336193 [0,1,0,1,0,0|2,0,0]=4 14166 B13R2.5332 N[C@@H]1C[C@H]1c2c(F)cccc2Br Amb33210009 [0,1,0,1,0,0|2,0,0]=4 14167 B13R2.5332 N[C@@H]1C[C@H]1c2c(F)cccc2Br Amb33429985 [0,1,0,1,0,0|2,0,0]=4 14168 B13R2.5332 N[C@@H]1C[C@H]1c2c(O)cccc2Br Amb33431127 [0,1,0,1,0,0|2,0,0]=4 14169 B13R3.28 c1ccc2c(c1)NCC3CC23 Amb28189406 [0,0,0,2,0,0|2,0,0]=4 14170 B13R3.5756 c1ccc2c(c1)CC3(CC3)N2 Amb18831466 [0,0,0,2,0,0|2,0,0]=4 14171 B13R3.5756 c1ccc2c(c1)CC3(CO3)C2 Amb27878326 [0,0,0,2,0,0|2,0,0]=4 14172 B13R3.355 Oc1cccc2c1C3CC3C2 Amb28284890 [0,0,0,2,0,0|2,0,0]=4 14173 B13R3.370 Brc1cccc2c1CC3OC23 Amb27650156 [0,0,0,2,0,0|1,0,0]=3 14174 B13R3.370 Clc1cccc2c1CC3OC23 Amb2383735 [0,0,0,2,0,0|1,1,0]=4 14175 B9R1.33 BrCCc1ccsc1Br Amb27793997 [1,0,0,0,1,0|2,0,0]=4 14176 B9R1.33 BrCCc1sccc1Br Amb25804548 [1,0,0,0,1,0|2,0,0]=4 14177 B9R1.33 CCCc1cccn1C Amb27259846 [1,0,0,0,1,0|2,0,0]=4 14178 B9R1.33 CCCc1ccsc1C Amb26622189 [1,0,0,0,1,0|2,0,0]=4 14179 B9R1.33 CCCc1cscc1Br Amb27813226 [1,0,0,0,1,0|1,0,0]=3 14180 B9R1.33 CCCc1ncsc1Br Amb20617307 [1,0,0,0,1,0|2,0,0]=4 14181 B9R1.33 CCCc1scnc1Br Amb20617257 [1,0,0,0,1,0|2,0,0]=4 14182 B9R1.33 CCCn1cccc1C Amb27186235 [1,0,0,0,1,0|2,0,0]=4 14183 B9R1.33 CCCn1ccnc1Br Amb17401245 [1,0,0,0,1,0|2,0,0]=4 14184 B9R1.33 CCCn1nccc1Br Amb22893515 [1,0,0,0,1,0|2,0,0]=4 14185 B9R1.33 CCOc1cscc1Br Amb28052744 [1,0,0,0,1,0|2,0,0]=4 14186 B9R1.33 CCSc1cscc1Br Amb27224266 [1,0,0,0,1,0|2,0,0]=4 14187 B9R1.33 CCSc1sccc1Br Amb28202686 [1,0,0,0,1,0|2,0,0]=4 14188 B9R1.33 CNCc1cccn1C Amb6332084 [1,0,0,0,1,0|2,0,0]=4 14189 B9R1.33 CNCc1ccoc1Br Amb6572344 [1,0,0,0,1,0|1,0,0]=3 14190 B9R1.33 CNCc1ccoc1C Amb10610125 [1,0,0,0,1,0|2,0,0]=4 14191 B9R1.33 CNCc1ccoc1C Amb6572127 [1,0,0,0,1,0|2,0,0]=4 14192 B9R1.33 CNCc1ccoc1Cl Amb27466276 [1,0,0,0,1,0|1,1,0]=4 14193 B9R1.33 CNCc1ccsc1Br Amb6572162 [1,0,0,0,1,0|1,0,0]=3 14194 B9R1.33 CNCc1ccsc1Cl Amb28249031 [1,0,0,0,1,0|1,1,0]=4 14195 B9R1.33 CNCc1cscc1Br Amb22756061 [1,0,0,0,1,0|1,0,0]=3 14196 B9R1.33 CNCc1cscc1Br Amb6572120 [1,0,0,0,1,0|1,0,0]=3 14197 B9R1.33 CNCc1cscc1C Amb25259691 [1,0,0,0,1,0|2,0,0]=4 14198 B9R1.33 CNCc1ncsc1Br Amb35661062 [1,0,0,0,1,0|2,0,0]=4 14199 B9R1.33 CNCc1nscc1Br Amb35637864 [1,0,0,0,1,0|2,0,0]=4 14200 B9R1.33 CNCc1occc1C Amb6572132 [1,0,0,0,1,0|2,0,0]=4 14201 B9R1.33 CNCc1sccc1Br Amb16230502 [1,0,0,0,1,0|1,0,0]=3 14202 B9R1.33 CNCc1sccc1Br Amb20623997 [1,0,0,0,1,0|1,0,0]=3 14203 B9R1.33 CNCc1sccc1C Amb5729070 [1,0,0,0,1,0|2,0,0]=4 14204 B9R1.33 CNCc1sccc1C Amb837566 [1,0,0,0,1,0|2,0,0]=4 14205 B9R1.33 CNCc1sccc1Cl Amb26950450 [1,0,0,0,1,0|1,1,0]=4 14206 B9R1.33 CNCc1sccc1I Amb27866188 [1,0,0,0,1,0|1,1,0]=4 14207 B9R1.33 COCc1ccoc1Br Amb33430480 [1,0,0,0,1,0|2,0,0]=4 14208 B9R1.33 COCc1occc1Br Amb28204905 [1,0,0,0,1,0|2,0,0]=4 14209 B9R1.33 COCc1sccc1Br Amb27222407 [1,0,0,0,1,0|2,0,0]=4 14210 B9R1.33 CSCc1ccsc1Br Amb28366398 [1,0,0,0,1,0|2,0,0]=4 14211 B9R1.33 CSCc1sccc1Br Amb28062716 [1,0,0,0,1,0|2,0,0]=4 14212 B9R1.33 Cc1ccoc1CCN Amb18832814 [1,0,0,0,1,0|2,0,0]=4 14213 B9R1.33 Cc1ccsc1CCN Amb2592465 [1,0,0,0,1,0|2,0,0]=4 14214 B9R1.33 Cc1ccsc1CCN Amb33291373 [1,0,0,0,1,0|2,0,0]=4 14215 B9R1.33 Cc1ccsc1CCN Amb8503271 [1,0,0,0,1,0|2,0,0]=4 14216 B9R1.33 Cc1cocc1CCN Amb18832813 [1,0,0,0,1,0|2,0,0]=4 14217 B9R1.33 Cc1cscc1CCN Amb20529271 [1,0,0,0,1,0|2,0,0]=4 14218 B9R1.33 Cc1occc1CCN Amb18832810 [1,0,0,0,1,0|2,0,0]=4 14219 B9R1.33 Cc1sccc1CCN Amb18202674 [1,0,0,0,1,0|2,0,0]=4 14220 B9R1.33 ClCCc1cscc1Br Amb27656174 [1,0,0,0,1,0|2,0,0]=4 14221 B9R1.33 ClCCc1occc1Br Amb27399521 [1,0,0,0,1,0|2,0,0]=4 14222 B9R1.33 ClCCc1sccc1Br Amb26973740 [1,0,0,0,1,0|2,0,0]=4 14223 B9R1.33 Cn1cccc1CCN Amb7796008 [1,0,0,0,1,0|2,0,0]=4 14224 B9R1.33 NCCc1ccsc1Br Amb18176174 [1,0,0,0,1,0|1,0,0]=3 14225 B9R1.33 NCCc1ccsc1F Amb18202047 [1,0,0,0,1,0|1,1,0]=4 14226 B9R1.33 NCCc1occc1Br Amb18186835 [1,0,0,0,1,0|1,0,0]=3 14227 B9R1.33 NCCc1occc1Cl Amb18202348 [1,0,0,0,1,0|1,1,0]=4 14228 B9R1.33 NCCc1occc1F Amb27786685 [1,0,0,0,1,0|1,1,0]=4 14229 B9R1.33 NCCc1sccc1Br Amb18956643 [1,0,0,0,1,0|1,0,0]=3 14230 B9R1.33 NCCc1sccc1Cl Amb26482982 [1,0,0,0,1,0|1,1,0]=4 14231 B9R1.33 NCCc1sccc1F Amb27491721 [1,0,0,0,1,0|1,1,0]=4 14232 B9R1.33 NCCc1scnc1Br Amb18176354 [1,0,0,0,1,0|2,0,0]=4 14233 B9R1.33 NNCc1sccc1Br Amb26000654 [1,0,0,0,1,0|2,0,0]=4 14234 B9R1.33 NOCc1ccsc1Br Amb27773184 [1,0,0,0,1,0|2,0,0]=4 14235 B9R1.33 NOCc1sccc1Br Amb24372190 [1,0,0,0,1,0|2,0,0]=4 14236 B9R1.33 OCCc1ccsc1Br Amb28203635 [1,0,0,0,1,0|2,0,0]=4 14237 B9R1.33 OCCc1cscc1Br Amb27838493 [1,0,0,0,1,0|2,0,0]=4 14238 B9R1.33 OCCc1occc1Br Amb26397345 [1,0,0,0,1,0|2,0,0]=4 14239 B9R1.33 OCCc1sccc1Br Amb28076288 [1,0,0,0,1,0|2,0,0]=4 14240 B9R1.33 ONCc1cscc1Br Amb27956535 [1,0,0,0,1,0|2,0,0]=4 14241 B9R1.33 ONCc1sccc1Br Amb27205540 [1,0,0,0,1,0|2,0,0]=4 14242 B9R1.33 SCCc1sccc1Br Amb33387983 [1,0,0,0,1,0|2,0,0]=4 14243 B9R1.12 CCCCc1ccco1 Amb10070290 [1,0,0,0,1,0|2,0,0]=4 14244 B9R1.12 CCCCc1cccs1 Amb4477470 [1,0,0,0,1,0|2,0,0]=4 14245 B9R1.12 CCCCc1ccsc1 Amb17779303 [1,0,0,0,1,0|2,0,0]=4 14246 B9R1.12 CNCCc1ccco1 Amb17399803 [1,0,0,0,1,0|1,0,0]=3 14247 B9R1.12 CNCCc1cccs1 Amb6712648 [1,0,0,0,1,0|1,0,0]=3 14248 B9R1.12 CNCCc1ccno1 Amb28368791 [1,0,0,0,1,0|2,0,0]=4 14249 B9R1.12 CNCCc1ccns1 Amb28073506 [1,0,0,0,1,0|2,0,0]=4 14250 B9R1.12 CNCCc1ccoc1 Amb25682417 [1,0,0,0,1,0|1,0,0]=3 14251 B9R1.12 CNCCc1ccon1 Amb25078186 [1,0,0,0,1,0|2,0,0]=4 14252 B9R1.12 CNCCc1ccsc1 Amb8853652 [1,0,0,0,1,0|1,0,0]=3 14253 B9R1.12 CNCCc1cnco1 Amb33415561 [1,0,0,0,1,0|2,0,0]=4 14254 B9R1.12 CNCCc1cncs1 Amb26877308 [1,0,0,0,1,0|2,0,0]=4 14255 B9R1.12 CNCCc1cnsc1 Amb30020095 [1,0,0,0,1,0|2,0,0]=4 14256 B9R1.12 CNCCc1cscn1 Amb8009872 [1,0,0,0,1,0|2,0,0]=4 14257 B9R1.12 CNCCc1ncco1 Amb18222315 [1,0,0,0,1,0|2,0,0]=4 14258 B9R1.12 CNCCc1nccs1 Amb8009874 [1,0,0,0,1,0|2,0,0]=4 14259 B9R1.12 CNCCn1cccc1 Amb18994357 [1,0,0,0,1,0|1,0,0]=3 14260 B9R1.12 CNCCn1cccn1 Amb18299424 [1,0,0,0,1,0|2,0,0]=4 14261 B9R1.12 CNCCn1cccn1 Amb33801434 [1,0,0,0,1,0|2,0,0]=4 14262 B9R1.12 CNCCn1ccnc1 Amb22586829 [1,0,0,0,1,0|2,0,0]=4 14263 B9R1.12 CNCCn1ccnc1 Amb5559946 [1,0,0,0,1,0|2,0,0]=4 14264 B9R1.12 CNNCc1ccco1 Amb27463559 [1,0,0,0,1,0|2,0,0]=4 14265 B9R1.12 COCCC1=CC=CC1 Amb27806849 [1,0,0,0,1,0|1,0,1]=4 14266 B9R1.12 COCCc1ccsc1 Amb27843682 [1,0,0,0,1,0|2,0,0]=4 14267 B9R1.12 CSCCc1ccco1 Amb27438612 [1,0,0,0,1,0|2,0,0]=4 14268 B9R1.12 CSCCc1cccs1 Amb27443874 [1,0,0,0,1,0|2,0,0]=4 14269 B9R1.12 NNCCc1cccs1 Amb6242818 [1,0,0,0,1,0|2,0,0]=4 14270 B9R1.12 NNCCc1ccsc1 Amb6744631 [1,0,0,0,1,0|2,0,0]=4