0 B10R1.17 BrCC#Cc1ccccc1 Amb26032687 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.17 BrCCCc1ccccc1 Amb2721516 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.17 BrCCCc1ccccn1 Amb27866171 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 BrCCCc1ccncc1 Amb32751195 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 BrCCCc1ccncn1 Amb33009087 [0,0,0,0,0,0|4,0,0]=4 7 B10R1.17 BrCCCc1cnccn1 Amb26516264 [0,0,0,0,0,0|4,0,0]=4 8 B10R1.17 BrCCCc1cncnc1 Amb25092294 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.17 BrCCCc1ncccn1 Amb33007113 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|1,0,0]=1 11 B10R1.17 BrCCOc1cccnc1 Amb33109804 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.17 BrCCOc1cccnc1 Amb9783592 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.17 BrCCSc1ccccc1 Amb6255409 [0,0,0,0,0,0|1,1,0]=2 14 B10R1.17 BrCCSc1ccncc1 Amb28206814 [0,0,0,0,0,0|2,1,0]=3 15 B10R1.17 BrCCSc1ccncc1 Amb32670844 [0,0,0,0,0,0|2,1,0]=3 16 B10R1.17 BrCCSc1ccncn1 Amb27235652 [0,0,0,0,0,0|3,1,0]=4 17 B10R1.17 BrCOCc1ccccc1 Amb27410470 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.17 BrC\C=C\c1ccccn1 Amb28365946 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [0,0,0,0,0,0|1,0,2]=3 23 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [0,0,0,0,0,0|1,1,2]=4 24 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.17 C#CCCc1ccccc1 Amb6336492 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.17 C#CCCc1ccccn1 Amb24571654 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.17 C#CCCc1cccnc1 Amb24085226 [0,0,0,0,0,0|3,0,1]=4 28 B10R1.17 C#CCCc1ccncc1 Amb24091331 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.17 C#CCNc1ccccn1 Amb18959521 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.17 C#CCNc1ccncc1 Amb18284709 [0,0,0,0,0,0|3,0,1]=4 31 B10R1.17 C#CCOC1C=CC=CO1 Amb27396950 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.17 C#CCOc1ccccc1 Amb839455 [0,0,0,0,0,0|1,0,1]=2 33 B10R1.17 C#CCOc1cccnc1 Amb22586592 [0,0,0,0,0,0|2,0,1]=3 34 B10R1.17 C#CCOc1ccncc1 Amb24117045 [0,0,0,0,0,0|2,0,1]=3 35 B10R1.17 C#CCOc1ncccn1 Amb24093879 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.17 C#CCSc1ccccc1 Amb3836098 [0,0,0,0,0,0|1,1,1]=3 37 B10R1.17 C#CCSc1ccncc1 Amb27809865 [0,0,0,0,0,0|2,1,1]=4 38 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|1,0,2]=3 40 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|2,0,2]=4 41 B10R1.17 C=CCCc1ccccc1 Amb2721241 [0,0,0,0,0,0|2,0,1]=3 42 B10R1.17 C=CCCc1ccccn1 Amb25337662 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.17 C=CCCc1cccnc1 Amb24477186 [0,0,0,0,0,0|3,0,1]=4 44 B10R1.17 C=CCNc1ccccc1 Amb2720315 [0,0,0,0,0,0|2,0,1]=3 45 B10R1.17 C=CCNc1cccnc1 Amb8394248 [0,0,0,0,0,0|3,0,1]=4 46 B10R1.17 C=CCOc1ccccc1 Amb2842273 [0,0,0,0,0,0|1,0,1]=2 47 B10R1.17 C=CCOc1cccnc1 Amb26643102 [0,0,0,0,0,0|2,0,1]=3 48 B10R1.17 C=CCOc1ccncc1 Amb25234559 [0,0,0,0,0,0|2,0,1]=3 49 B10R1.17 C=CCOc1cnccn1 Amb28050251 [0,0,0,0,0,0|3,0,1]=4 50 B10R1.17 C=CCSc1ccccc1 Amb3836099 [0,0,0,0,0,0|1,1,1]=3 51 B10R1.17 C=CC[Se]c1ccccn1 Amb24101157 [0,0,0,0,0,0|2,1,1]=4 52 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|3,0,1]=4 53 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [0,0,0,0,0,0|2,0,2]=4 54 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,0,0,0,0,0|2,0,2]=4 55 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [0,0,0,0,0,0|3,0,0]=3 59 B10R1.17 CCCCc1ccccc1 Amb6608912 [0,0,0,0,0,0|2,0,0]=2 60 B10R1.17 CCCCc1ccccn1 Amb8395993 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.17 CCCCc1cccnc1 Amb4037068 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.17 CCCCc1cccnn1 Amb22235740 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.17 CCCNc1ccccc1 Amb534130 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.17 CCCNc1cccnc1 Amb6686632 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.17 CCCNc1ccncc1 Amb6614447 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.17 CCCNc1ccnnc1 Amb23559651 [0,0,0,0,0,0|4,0,0]=4 68 B10R1.17 CCCNc1cncnc1 Amb28074211 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.17 CCCOc1ccccc1 Amb2842271 [0,0,0,0,0,0|1,0,0]=1 70 B10R1.17 CCCOc1cccnn1 Amb24062248 [0,0,0,0,0,0|3,0,0]=3 71 B10R1.17 CCCOc1cnccn1 Amb24061285 [0,0,0,0,0,0|3,0,0]=3 72 B10R1.17 CCCSc1ccccc1 Amb4014460 [0,0,0,0,0,0|1,1,0]=2 73 B10R1.17 CCCSc1ccccn1 Amb24733306 [0,0,0,0,0,0|2,1,0]=3 74 B10R1.17 CCCSc1ccncc1 Amb28126322 [0,0,0,0,0,0|2,1,0]=3 75 B10R1.17 CCCSc1ncccn1 Amb8334477 [0,0,0,0,0,0|3,1,0]=4 76 B10R1.17 CCNCc1ccccc1 Amb3699539 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.17 CCNCc1ccccn1 Amb2592098 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.17 CCNCc1cccnc1 Amb21972163 [0,0,0,0,0,0|4,0,0]=4 79 B10R1.17 CCNCc1cccnc1 Amb837759 [0,0,0,0,0,0|4,0,0]=4 80 B10R1.17 CCNCc1ccncc1 Amb1214646 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.17 CCOCc1ccccc1 Amb9787555 [0,0,0,0,0,0|3,0,0]=3 82 B10R1.17 CCOCc1ccccn1 Amb27267027 [0,0,0,0,0,0|4,0,0]=4 83 B10R1.17 CCOCc1ccncc1 Amb27255285 [0,0,0,0,0,0|4,0,0]=4 84 B10R1.17 CCOSc1ccccc1 Amb28049338 [0,0,0,0,0,0|2,1,0]=3 85 B10R1.17 CCSCc1ccccc1 Amb9787636 [0,0,0,0,0,0|3,0,0]=3 86 B10R1.17 CCSCc1ccccn1 Amb28124640 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.17 CCSCc1cccnc1 Amb26909883 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.17 CCSSc1ccccc1 Amb28057163 [0,0,0,0,0,0|2,1,0]=3 89 B10R1.17 CC\C=C/c1cccnc1 Amb24602371 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [0,0,0,0,0,0|2,0,1]=3 91 B10R1.17 CC\C=C\c1cccnc1 Amb28076152 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.17 CC\C=N/c1cccnc1 Amb28250076 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.17 CC\N=C\c1cccnc1 Amb26548619 [0,0,0,0,0,0|4,0,0]=4 95 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [0,0,0,0,0,0|3,0,1]=4 96 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|3,0,0]=3 98 B10R1.17 CNCCc1ccccc1 Amb33545919 [0,0,0,0,0,0|3,0,0]=3 99 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.17 CNCCc1ccccn1 Amb22167479 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.17 CNCCc1ccccn1 Amb6741463 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|4,0,0]=4 104 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|4,0,0]=4 105 B10R1.17 CNCCc1ccncc1 Amb19958269 [0,0,0,0,0,0|4,0,0]=4 106 B10R1.17 CNCCc1ccncc1 Amb2592519 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.17 CNNCc1ccccc1 Amb26859422 [0,0,0,0,0,0|4,0,0]=4 108 B10R1.17 CNNCc1ccccc1 Amb33328543 [0,0,0,0,0,0|4,0,0]=4 109 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|4,0,0]=4 110 B10R1.17 CNOCc1ccccc1 Amb32412803 [0,0,0,0,0,0|4,0,0]=4 111 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.17 COCC[n+]1ccccc1 Amb28125435 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.17 COCCc1ccccc1 Amb4020014 [0,0,0,0,0,0|3,0,0]=3 115 B10R1.17 COCCc1ccccn1 Amb4034583 [0,0,0,0,0,0|4,0,0]=4 116 B10R1.17 COCCc1ccncc1 Amb26565974 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.17 COCOc1ccccc1 Amb2608594 [0,0,0,0,0,0|2,0,0]=2 118 B10R1.17 COCOc1ccccn1 Amb27757113 [0,0,0,0,0,0|3,0,0]=3 119 B10R1.17 CONCc1ccccc1 Amb26432339 [0,0,0,0,0,0|4,0,0]=4 120 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.17 CSCCc1ccccc1 Amb26586093 [0,0,0,0,0,0|3,0,0]=3 123 B10R1.17 CSCCc1ccccn1 Amb24552366 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.17 CSCNc1ccccc1 Amb25992690 [0,0,0,0,0,0|3,0,0]=3 125 B10R1.17 CSCNc1ccccn1 Amb27972069 [0,0,0,0,0,0|4,0,0]=4 126 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|2,0,0]=2 127 B10R1.17 CSCOc1ccccn1 Amb27256230 [0,0,0,0,0,0|3,0,0]=3 128 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [0,0,0,0,0,0|3,0,1]=4 129 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,0,0,0,0,0|2,0,2]=4 130 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|1,1,2]=4 131 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [0,0,0,0,0,0|3,0,1]=4 132 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|2,0,1]=3 133 B10R1.17 ClCC#Cc1ccccn1 Amb28364721 [0,0,0,0,0,0|3,0,1]=4 134 B10R1.17 ClCCCc1ccccc1 Amb3941487 [0,0,0,0,0,0|2,0,0]=2 135 B10R1.17 ClCCCc1ccccn1 Amb32751196 [0,0,0,0,0,0|3,0,0]=3 136 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|3,0,0]=3 137 B10R1.17 ClCCCc1cccnc1 Amb32665795 [0,0,0,0,0,0|3,0,0]=3 138 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|3,0,0]=3 139 B10R1.17 ClCCCc1cnccn1 Amb27945611 [0,0,0,0,0,0|4,0,0]=4 140 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|2,0,0]=2 141 B10R1.17 ClCCNc1ccncc1 Amb27484998 [0,0,0,0,0,0|3,0,0]=3 142 B10R1.17 ClCCNc1ccncn1 Amb27218714 [0,0,0,0,0,0|4,0,0]=4 143 B10R1.17 ClCCNc1ncccn1 Amb28291384 [0,0,0,0,0,0|4,0,0]=4 144 B10R1.17 ClCCOc1ccccc1 Amb3940573 [0,0,0,0,0,0|1,0,0]=1 145 B10R1.17 ClCCOc1cccnc1 Amb19878080 [0,0,0,0,0,0|2,0,0]=2 146 B10R1.17 ClCCOc1ccncc1 Amb28384309 [0,0,0,0,0,0|2,0,0]=2 147 B10R1.17 ClCCSc1ccccc1 Amb2685910 [0,0,0,0,0,0|1,1,0]=2 148 B10R1.17 ClCCSc1ccccn1 Amb9305061 [0,0,0,0,0,0|2,1,0]=3 149 B10R1.17 ClCOCc1ccccc1 Amb2684626 [0,0,0,0,0,0|3,0,0]=3 150 B10R1.17 ClCOCc1ccccn1 Amb27834619 [0,0,0,0,0,0|4,0,0]=4 151 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|3,0,0]=3 152 B10R1.17 ClCSSc1ccccc1 Amb27865461 [0,0,0,0,0,0|2,1,0]=3 153 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [0,0,0,0,0,0|2,0,1]=3 154 B10R1.17 ClC\C=C\c1cccnc1 Amb26369517 [0,0,0,0,0,0|3,0,1]=4 155 B10R1.17 ClC\C=C\c1ccncc1 Amb27392424 [0,0,0,0,0,0|3,0,1]=4 156 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [0,0,0,0,0,0|1,0,2]=3 157 B10R1.17 Cl\C=N\Oc1ccccn1 Amb27430268 [0,0,0,0,0,0|3,0,1]=4 158 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|2,0,1]=3 159 B10R1.17 FCCNc1ccccc1 Amb26349791 [0,0,0,0,0,0|2,0,0]=2 160 B10R1.17 FCCNc1cccnn1 Amb27760749 [0,0,0,0,0,0|4,0,0]=4 161 B10R1.17 FCCNc1cnccn1 Amb27250878 [0,0,0,0,0,0|4,0,0]=4 162 B10R1.17 FCCSc1ccccn1 Amb28125479 [0,0,0,0,0,0|2,1,0]=3 163 B10R1.17 FCCSc1cccnn1 Amb28315982 [0,0,0,0,0,0|3,1,0]=4 164 B10R1.17 FCCSc1ccncc1 Amb27971685 [0,0,0,0,0,0|2,1,0]=3 165 B10R1.17 FCCSc1cnccn1 Amb27448378 [0,0,0,0,0,0|3,1,0]=4 166 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [0,0,0,0,0,0|2,0,1]=3 167 B10R1.17 ICC#Cc1ccccc1 Amb27262163 [0,0,0,0,0,0|2,0,1]=3 168 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|2,0,0]=2 169 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|1,0,0]=1 170 B10R1.17 ICCSc1ccccc1 Amb27458209 [0,0,0,0,0,0|1,1,0]=2 171 B10R1.17 ICOCc1ccccc1 Amb28348666 [0,0,0,0,0,0|3,0,0]=3 172 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|2,0,2]=4 173 B10R1.17 N#CCC[n+]1ccccc1 Amb28458262 [0,0,0,0,0,0|3,0,1]=4 174 B10R1.17 N#CCCc1ccccc1 Amb33551192 [0,0,0,0,0,0|2,0,1]=3 175 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|3,0,1]=4 176 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|3,0,1]=4 177 B10R1.17 N#CCCc1ccncc1 Amb2694189 [0,0,0,0,0,0|3,0,1]=4 178 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|2,0,1]=3 179 B10R1.17 N#CCNc1ccccn1 Amb22052191 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.17 N#CCNc1ccccn1 Amb32665267 [0,0,0,0,0,0|3,0,1]=4 181 B10R1.17 N#CCOc1ccccc1 Amb2725206 [0,0,0,0,0,0|1,0,1]=2 182 B10R1.17 N#CCOc1ccccn1 Amb2459771 [0,0,0,0,0,0|2,0,1]=3 183 B10R1.17 N#CCOc1cccnc1 Amb17399827 [0,0,0,0,0,0|2,0,1]=3 184 B10R1.17 N#CCOc1ncccn1 Amb28049749 [0,0,0,0,0,0|3,0,1]=4 185 B10R1.17 N#CCSc1ccccc1 Amb2690327 [0,0,0,0,0,0|1,1,1]=3 186 B10R1.17 N#CNCc1ccccc1 Amb27257452 [0,0,0,0,0,0|3,0,1]=4 187 B10R1.17 N#CSCc1ccccc1 Amb2611897 [0,0,0,0,0,0|3,0,1]=4 188 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|2,0,2]=4 189 B10R1.17 N=CC#Cc1ccccc1 Amb27848552 [0,0,0,0,0,0|2,0,2]=4 190 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|2,0,1]=3 191 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|2,0,1]=3 192 B10R1.17 NCC#Cc1ccccn1 Amb20668332 [0,0,0,0,0,0|3,0,1]=4 193 B10R1.17 NCC#Cc1ccccn1 Amb28245849 [0,0,0,0,0,0|3,0,1]=4 194 B10R1.17 NCC#Cc1cccnc1 Amb18281095 [0,0,0,0,0,0|3,0,1]=4 195 B10R1.17 NCC#Cc1cccnc1 Amb33534318 [0,0,0,0,0,0|3,0,1]=4 196 B10R1.17 NCCCc1ccccc1 Amb844788 [0,0,0,0,0,0|2,0,0]=2 197 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|3,0,0]=3 198 B10R1.17 NCCCc1ccccn1 Amb21954278 [0,0,0,0,0,0|3,0,0]=3 199 B10R1.17 NCCCc1cccnc1 Amb18363942 [0,0,0,0,0,0|3,0,0]=3 200 B10R1.17 NCCCc1cccnc1 Amb31188323 [0,0,0,0,0,0|3,0,0]=3 201 B10R1.17 NCCCc1cccnc1 Amb5735475 [0,0,0,0,0,0|3,0,0]=3 202 B10R1.17 NCCCc1ccncc1 Amb22490382 [0,0,0,0,0,0|3,0,0]=3 203 B10R1.17 NCCCc1ccncc1 Amb24099592 [0,0,0,0,0,0|3,0,0]=3 204 B10R1.17 NCCCc1ccncc1 Amb33535434 [0,0,0,0,0,0|3,0,0]=3 205 B10R1.17 NCCCc1ccncn1 Amb18981848 [0,0,0,0,0,0|4,0,0]=4 206 B10R1.17 NCCCc1ccncn1 Amb33527786 [0,0,0,0,0,0|4,0,0]=4 207 B10R1.17 NCCCc1ccnnc1 Amb23559549 [0,0,0,0,0,0|4,0,0]=4 208 B10R1.17 NCCCc1ccnnc1 Amb32826045 [0,0,0,0,0,0|4,0,0]=4 209 B10R1.17 NCCCc1cnccn1 Amb18832322 [0,0,0,0,0,0|4,0,0]=4 210 B10R1.17 NCCCc1cnccn1 Amb33550238 [0,0,0,0,0,0|4,0,0]=4 211 B10R1.17 NCCCc1cnccn1 Amb35788851 [0,0,0,0,0,0|4,0,0]=4 212 B10R1.17 NCCCc1cncnc1 Amb22751643 [0,0,0,0,0,0|4,0,0]=4 213 B10R1.17 NCCCc1cncnc1 Amb32661023 [0,0,0,0,0,0|4,0,0]=4 214 B10R1.17 NCCCc1cncnc1 Amb32664238 [0,0,0,0,0,0|4,0,0]=4 215 B10R1.17 NCCCc1ncccn1 Amb18064230 [0,0,0,0,0,0|4,0,0]=4 216 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|2,0,0]=2 217 B10R1.17 NCCNc1ccccc1 Amb2720312 [0,0,0,0,0,0|2,0,0]=2 218 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,0,0,0,0,0|3,0,0]=3 219 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,0,0,0,0,0|3,0,0]=3 220 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,0,0,0,0,0|3,0,0]=3 221 B10R1.17 NCCNc1cccnn1 Amb18298689 [0,0,0,0,0,0|4,0,0]=4 222 B10R1.17 NCCNc1cccnn1 Amb33042830 [0,0,0,0,0,0|4,0,0]=4 223 B10R1.17 NCCNc1ccncc1 Amb19887545 [0,0,0,0,0,0|3,0,0]=3 224 B10R1.17 NCCNc1ccncc1 Amb6279124 [0,0,0,0,0,0|3,0,0]=3 225 B10R1.17 NCCNc1ccncn1 Amb18973879 [0,0,0,0,0,0|4,0,0]=4 226 B10R1.17 NCCNc1cnccn1 Amb33526497 [0,0,0,0,0,0|4,0,0]=4 227 B10R1.17 NCCNc1cnccn1 Amb6892799 [0,0,0,0,0,0|4,0,0]=4 228 B10R1.17 NCCNc1ncccn1 Amb33526463 [0,0,0,0,0,0|4,0,0]=4 229 B10R1.17 NCCNc1ncccn1 Amb33529208 [0,0,0,0,0,0|4,0,0]=4 230 B10R1.17 NCCNc1ncccn1 Amb33545764 [0,0,0,0,0,0|4,0,0]=4 231 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|1,0,0]=1 232 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|1,0,0]=1 233 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,0,0,0,0,0|2,0,0]=2 234 B10R1.17 NCCOc1cccnc1 Amb9392843 [0,0,0,0,0,0|2,0,0]=2 235 B10R1.17 NCCOc1cccnn1 Amb18298723 [0,0,0,0,0,0|3,0,0]=3 236 B10R1.17 NCCOc1ccncc1 Amb18988858 [0,0,0,0,0,0|2,0,0]=2 237 B10R1.17 NCCOc1ccncc1 Amb22728098 [0,0,0,0,0,0|2,0,0]=2 238 B10R1.17 NCCOc1ccncn1 Amb18292252 [0,0,0,0,0,0|3,0,0]=3 239 B10R1.17 NCCOc1cnccn1 Amb18296473 [0,0,0,0,0,0|3,0,0]=3 240 B10R1.17 NCCOc1cncnc1 Amb26965029 [0,0,0,0,0,0|3,0,0]=3 241 B10R1.17 NCCOc1ncccn1 Amb18292247 [0,0,0,0,0,0|3,0,0]=3 242 B10R1.17 NCCSc1ccccc1 Amb6374305 [0,0,0,0,0,0|1,1,0]=2 243 B10R1.17 NCCSc1ccccc1 Amb6827055 [0,0,0,0,0,0|1,1,0]=2 244 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,0,0,0,0,0|2,1,0]=3 245 B10R1.17 NCCSc1ccccn1 Amb6370511 [0,0,0,0,0,0|2,1,0]=3 246 B10R1.17 NCCSc1ccccn1 Amb6844895 [0,0,0,0,0,0|2,1,0]=3 247 B10R1.17 NCCSc1cnccn1 Amb18251482 [0,0,0,0,0,0|3,1,0]=4 248 B10R1.17 NCCSc1ncccn1 Amb32662378 [0,0,0,0,0,0|3,1,0]=4 249 B10R1.17 NCCSc1ncccn1 Amb6680219 [0,0,0,0,0,0|3,1,0]=4 250 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|2,0,1]=3 251 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [0,0,0,0,0,0|2,0,1]=3 252 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|2,0,1]=3 253 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [0,0,0,0,0,0|2,0,1]=3 254 B10R1.17 NC\C=C\c1ccccn1 Amb18063261 [0,0,0,0,0,0|3,0,1]=4 255 B10R1.17 NC\C=C\c1cccnc1 Amb18063302 [0,0,0,0,0,0|3,0,1]=4 256 B10R1.17 NC\C=C\c1cccnc1 Amb31148908 [0,0,0,0,0,0|3,0,1]=4 257 B10R1.17 NC\C=C\c1ccncc1 Amb18062333 [0,0,0,0,0,0|3,0,1]=4 258 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|3,0,0]=3 259 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|3,0,0]=3 260 B10R1.17 NNCCc1ccccc1 Amb33552804 [0,0,0,0,0,0|3,0,0]=3 261 B10R1.17 NNCCc1ccccn1 Amb20669588 [0,0,0,0,0,0|4,0,0]=4 262 B10R1.17 NNCCc1ccccn1 Amb33528741 [0,0,0,0,0,0|4,0,0]=4 263 B10R1.17 NNCCc1ccncc1 Amb6248763 [0,0,0,0,0,0|4,0,0]=4 264 B10R1.17 NOCCc1ccccc1 Amb2899735 [0,0,0,0,0,0|3,0,0]=3 265 B10R1.17 NOCCc1ccccc1 Amb6308543 [0,0,0,0,0,0|3,0,0]=3 266 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|4,0,0]=4 267 B10R1.17 NOCCc1cccnc1 Amb25779030 [0,0,0,0,0,0|4,0,0]=4 268 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|4,0,0]=4 269 B10R1.17 N\N=C\Nc1ccccc1 Amb27770569 [0,0,0,0,0,0|3,0,1]=4 270 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [0,0,0,0,0,0|2,0,2]=4 271 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [0,0,0,0,0,0|1,0,3]=4 272 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,0,0,0,0,0|1,0,2]=3 273 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|2,0,2]=4 274 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|2,0,2]=4 275 B10R1.17 O=CCCc1ccncc1 Amb8388451 [0,0,0,0,0,0|2,0,2]=4 276 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,0,0,0,0,0|0,0,2]=2 277 B10R1.17 O=CCOc1ccccn1 Amb27823582 [0,0,0,0,0,0|1,0,2]=3 278 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|0,1,2]=3 279 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|2,0,2]=4 280 B10R1.17 O=CNNc1ccccc1 Amb2721099 [0,0,0,0,0,0|2,0,2]=4 281 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,0,0,0,0,0|2,0,2]=4 282 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,0,0,0,0,0|1,0,3]=4 283 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|1,0,3]=4 284 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [0,0,0,0,0,0|1,0,3]=4 285 B10R1.17 OCC#Cc1ccccc1 Amb534712 [0,0,0,0,0,0|1,0,1]=2 286 B10R1.17 OCC#Cc1ccccn1 Amb2227478 [0,0,0,0,0,0|2,0,1]=3 287 B10R1.17 OCC#Cc1cccnc1 Amb9777316 [0,0,0,0,0,0|2,0,1]=3 288 B10R1.17 OCC#Cc1ccncc1 Amb9777314 [0,0,0,0,0,0|2,0,1]=3 289 B10R1.17 OCC#Cc1cnccn1 Amb25965643 [0,0,0,0,0,0|3,0,1]=4 290 B10R1.17 OCC#Cc1cncnc1 Amb1086948 [0,0,0,0,0,0|3,0,1]=4 291 B10R1.17 OCC#Cc1ncccn1 Amb24068881 [0,0,0,0,0,0|3,0,1]=4 292 B10R1.17 OCCCC1=CCC=CC1 Amb22047467 [0,0,0,0,0,0|1,0,2]=3 293 B10R1.17 OCCCc1ccccc1 Amb3939054 [0,0,0,0,0,0|1,0,0]=1 294 B10R1.17 OCCCc1ccccn1 Amb22749323 [0,0,0,0,0,0|2,0,0]=2 295 B10R1.17 OCCCc1ccccn1 Amb3939333 [0,0,0,0,0,0|2,0,0]=2 296 B10R1.17 OCCCc1cccnc1 Amb2694598 [0,0,0,0,0,0|2,0,0]=2 297 B10R1.17 OCCCc1cccnc1 Amb33623848 [0,0,0,0,0,0|2,0,0]=2 298 B10R1.17 OCCCc1cccnn1 Amb27208115 [0,0,0,0,0,0|3,0,0]=3 299 B10R1.17 OCCCc1ccncc1 Amb3650114 [0,0,0,0,0,0|2,0,0]=2 300 B10R1.17 OCCCc1ccncn1 Amb24099660 [0,0,0,0,0,0|3,0,0]=3 301 B10R1.17 OCCCc1ccnnc1 Amb23559794 [0,0,0,0,0,0|3,0,0]=3 302 B10R1.17 OCCCc1cnccn1 Amb22499266 [0,0,0,0,0,0|3,0,0]=3 303 B10R1.17 OCCCc1cncnc1 Amb24063145 [0,0,0,0,0,0|3,0,0]=3 304 B10R1.17 OCCCc1ncccn1 Amb22499265 [0,0,0,0,0,0|3,0,0]=3 305 B10R1.17 OCCNc1ccccc1 Amb3940335 [0,0,0,0,0,0|1,0,0]=1 306 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|2,0,0]=2 307 B10R1.17 OCCNc1ccccn1 Amb2610537 [0,0,0,0,0,0|2,0,0]=2 308 B10R1.17 OCCNc1cccnc1 Amb18266115 [0,0,0,0,0,0|2,0,0]=2 309 B10R1.17 OCCNc1cccnn1 Amb18298692 [0,0,0,0,0,0|3,0,0]=3 310 B10R1.17 OCCNc1ccncc1 Amb6631563 [0,0,0,0,0,0|2,0,0]=2 311 B10R1.17 OCCNc1ccncn1 Amb18973688 [0,0,0,0,0,0|3,0,0]=3 312 B10R1.17 OCCNc1cnccn1 Amb6650910 [0,0,0,0,0,0|3,0,0]=3 313 B10R1.17 OCCNc1ncccn1 Amb6622896 [0,0,0,0,0,0|3,0,0]=3 314 B10R1.17 OCCNc1ncncn1 Amb26047058 [0,0,0,0,0,0|4,0,0]=4 315 B10R1.17 OCCOC1C=CC=CO1 Amb27829943 [0,0,0,0,0,0|1,0,1]=2 316 B10R1.17 OCCOC1C=CCCC1 Amb28126855 [0,0,0,0,0,0|0,0,4]=4 317 B10R1.17 OCCOC1CCC=CO1 Amb28345353 [0,0,0,0,0,0|1,0,3]=4 318 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|0,0,0]=0 319 B10R1.17 OCCOc1ccccn1 Amb23598433 [0,0,0,0,0,0|1,0,0]=1 320 B10R1.17 OCCOc1cccnc1 Amb19333986 [0,0,0,0,0,0|1,0,0]=1 321 B10R1.17 OCCSc1ccccn1 Amb2722740 [0,0,0,0,0,0|1,1,0]=2 322 B10R1.17 OCCSc1ncccn1 Amb33529079 [0,0,0,0,0,0|2,1,0]=3 323 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|2,0,0]=2 324 B10R1.17 OCSCc1ccccc1 Amb27839241 [0,0,0,0,0,0|2,0,0]=2 325 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [0,0,0,0,0,0|2,0,1]=3 326 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [0,0,0,0,0,0|2,0,1]=3 327 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [0,0,0,0,0,0|1,0,1]=2 328 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [0,0,0,0,0,0|2,0,1]=3 329 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,0,0,0,0,0|2,0,1]=3 330 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [0,0,0,0,0,0|2,0,1]=3 331 B10R1.17 OC\C=C\c1ccncn1 Amb27775610 [0,0,0,0,0,0|3,0,1]=4 332 B10R1.17 OC\C=C\c1cnccn1 Amb33429679 [0,0,0,0,0,0|3,0,1]=4 333 B10R1.17 OC\C=C\c1cncnc1 Amb27491218 [0,0,0,0,0,0|3,0,1]=4 334 B10R1.17 OC\C=C\c1ncccn1 Amb33270341 [0,0,0,0,0,0|3,0,1]=4 335 B10R1.17 ONCCc1ccccc1 Amb33544180 [0,0,0,0,0,0|2,0,0]=2 336 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [0,0,0,0,0,0|2,0,1]=3 337 B10R1.17 O\N=C\Cc1ccccn1 Amb27767920 [0,0,0,0,0,0|3,0,1]=4 338 B10R1.17 O\N=C\Cc1ccncc1 Amb28186073 [0,0,0,0,0,0|3,0,1]=4 339 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [0,0,0,0,0,0|2,0,1]=3 340 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|2,1,1]=4 341 B10R1.17 SCC#Cc1ccccc1 Amb27454293 [0,0,0,0,0,0|1,1,1]=3 342 B10R1.17 SCCCc1ccccc1 Amb6255807 [0,0,0,0,0,0|1,1,0]=2 343 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|2,1,0]=3 344 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|2,1,0]=3 345 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|2,1,0]=3 346 B10R1.17 SCCCc1ccncn1 Amb33267504 [0,0,0,0,0,0|3,1,0]=4 347 B10R1.17 SCCCc1cnccn1 Amb33429609 [0,0,0,0,0,0|3,1,0]=4 348 B10R1.17 SCCCc1cncnc1 Amb32875710 [0,0,0,0,0,0|3,1,0]=4 349 B10R1.17 SCCCc1ncccn1 Amb33269609 [0,0,0,0,0,0|3,1,0]=4 350 B10R1.17 SCCOc1ccccc1 Amb2794986 [0,0,0,0,0,0|0,1,0]=1 351 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|0,2,0]=2 352 B10R1.17 SCCSc1ccncn1 Amb28321647 [0,0,0,0,0,0|2,2,0]=4 353 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [0,0,0,0,0,0|1,1,1]=3 354 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|3,0,0]=3 355 B10R1.17 [C-]#[N+]CCc1ccccn1 Amb5456295 [0,0,0,0,0,0|4,0,0]=4 356 B10R1.17 [C-]#[N+]CCc1cccnc1 Amb33429418 [0,0,0,0,0,0|4,0,0]=4 357 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|4,0,0]=4 358 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [0,0,0,0,0,0|4,0,0]=4 359 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|2,0,0]=2 360 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 361 B9R1.8 BrCC[n+]1ccccc1 Amb2617784 [1,0,0,0,0,0|2,0,0]=3 362 B9R1.8 BrCC[n+]1ccccc1 Amb26365793 [1,0,0,0,0,0|2,0,0]=3 363 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,0]=3 364 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,0]=3 365 B9R1.8 BrCCc1cccnc1 Amb19069960 [1,0,0,0,0,0|2,0,0]=3 366 B9R1.8 BrCCc1cccnc1 Amb19372982 [1,0,0,0,0,0|2,0,0]=3 367 B9R1.8 BrCCc1ccncc1 Amb18326675 [1,0,0,0,0,0|2,0,0]=3 368 B9R1.8 BrCCc1ccncc1 Amb33313562 [1,0,0,0,0,0|2,0,0]=3 369 B9R1.8 BrCCc1ccncn1 Amb25681855 [1,0,0,0,0,0|3,0,0]=4 370 B9R1.8 BrCCc1cnccn1 Amb24652166 [1,0,0,0,0,0|3,0,0]=4 371 B9R1.8 BrCCc1cncnc1 Amb18327370 [1,0,0,0,0,0|3,0,0]=4 372 B9R1.8 BrCCc1ncccn1 Amb27813162 [1,0,0,0,0,0|3,0,0]=4 373 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,2]=4 374 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [1,0,0,0,0,0|1,0,2]=4 375 B9R1.8 C#CCc1ccccn1 Amb25759001 [1,0,0,0,0,0|2,0,1]=4 376 B9R1.8 C#CCc1cccnc1 Amb27219897 [1,0,0,0,0,0|2,0,1]=4 377 B9R1.8 C#CCc1ccncc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 378 B9R1.8 C#COc1ccccc1 Amb27194589 [1,0,0,0,0,0|0,0,2]=3 379 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|0,1,2]=4 380 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|1,0,2]=4 381 B9R1.8 C#NCc1ccccc1 Amb31132452 [1,0,0,0,0,0|2,0,0]=3 382 B9R1.8 C#NCc1ccccn1 Amb31132453 [1,0,0,0,0,0|3,0,0]=4 383 B9R1.8 C#NCc1cccnc1 Amb31132454 [1,0,0,0,0,0|3,0,0]=4 384 B9R1.8 C#NCc1ccncc1 Amb31132455 [1,0,0,0,0,0|3,0,0]=4 385 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [1,0,0,0,0,0|2,0,1]=4 386 B9R1.8 C=CCc1ccccc1 Amb2599341 [1,0,0,0,0,0|1,0,1]=3 387 B9R1.8 C=CCc1cccnc1 Amb24477831 [1,0,0,0,0,0|2,0,1]=4 388 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|0,0,2]=3 389 B9R1.8 C=COc1cccnc1 Amb24085952 [1,0,0,0,0,0|1,0,2]=4 390 B9R1.8 C=CSc1ccccc1 Amb8387516 [1,0,0,0,0,0|0,1,2]=4 391 B9R1.8 C=NCc1ccccc1 Amb28256747 [1,0,0,0,0,0|2,0,0]=3 392 B9R1.8 C=NCc1ccncc1 Amb27758185 [1,0,0,0,0,0|3,0,0]=4 393 B9R1.8 CC#Cc1ccccc1 Amb8513696 [1,0,0,0,0,0|1,0,1]=3 394 B9R1.8 CC#Cc1ccccn1 Amb25147069 [1,0,0,0,0,0|2,0,1]=4 395 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|2,0,0]=3 396 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|1,0,0]=2 397 B9R1.8 CCCc1ccccn1 Amb6366812 [1,0,0,0,0,0|2,0,0]=3 398 B9R1.8 CCCc1cccnc1 Amb2613018 [1,0,0,0,0,0|2,0,0]=3 399 B9R1.8 CCCc1cccnn1 Amb24447402 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.8 CCCc1ccncc1 Amb4017941 [1,0,0,0,0,0|2,0,0]=3 401 B9R1.8 CCCc1ccncn1 Amb24070638 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.8 CCCc1cnccn1 Amb2690413 [1,0,0,0,0,0|3,0,0]=4 403 B9R1.8 CCNc1ccccc1 Amb3940127 [1,0,0,0,0,0|1,0,0]=2 404 B9R1.8 CCNc1ccccn1 Amb6640743 [1,0,0,0,0,0|2,0,0]=3 405 B9R1.8 CCNc1cccnc1 Amb6686634 [1,0,0,0,0,0|2,0,0]=3 406 B9R1.8 CCNc1cccnn1 Amb18286130 [1,0,0,0,0,0|3,0,0]=4 407 B9R1.8 CCNc1ccncc1 Amb33545749 [1,0,0,0,0,0|2,0,0]=3 408 B9R1.8 CCNc1ccncn1 Amb18282107 [1,0,0,0,0,0|3,0,0]=4 409 B9R1.8 CCNc1ccnnc1 Amb23559704 [1,0,0,0,0,0|3,0,0]=4 410 B9R1.8 CCNc1cncnc1 Amb18270553 [1,0,0,0,0,0|3,0,0]=4 411 B9R1.8 CCNc1ncccn1 Amb6633030 [1,0,0,0,0,0|3,0,0]=4 412 B9R1.8 CCOc1ccccc1 Amb2842270 [1,0,0,0,0,0|0,0,0]=1 413 B9R1.8 CCOc1ccccn1 Amb2609960 [1,0,0,0,0,0|1,0,0]=2 414 B9R1.8 CCOc1cccnc1 Amb10573342 [1,0,0,0,0,0|1,0,0]=2 415 B9R1.8 CCOc1cccnn1 Amb19958352 [1,0,0,0,0,0|2,0,0]=3 416 B9R1.8 CCOc1ccncc1 Amb8396897 [1,0,0,0,0,0|1,0,0]=2 417 B9R1.8 CCOc1cnccn1 Amb8387604 [1,0,0,0,0,0|2,0,0]=3 418 B9R1.8 CCSc1ccccc1 Amb2687929 [1,0,0,0,0,0|0,1,0]=2 419 B9R1.8 CCSc1ccccn1 Amb26656831 [1,0,0,0,0,0|1,1,0]=3 420 B9R1.8 CCSc1ccncc1 Amb27766422 [1,0,0,0,0,0|1,1,0]=3 421 B9R1.8 CNCc1ccccc1 Amb3699562 [1,0,0,0,0,0|2,0,0]=3 422 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.8 CNCc1ccccn1 Amb3941148 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|3,0,0]=4 426 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|3,0,0]=4 428 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|3,0,0]=4 429 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|3,0,0]=4 430 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|2,0,0]=3 431 B9R1.8 CNNc1ccccc1 Amb27969267 [1,0,0,0,0,0|2,0,0]=3 432 B9R1.8 COCc1ccccc1 Amb2782562 [1,0,0,0,0,0|2,0,0]=3 433 B9R1.8 COCc1ccccn1 Amb4017561 [1,0,0,0,0,0|3,0,0]=4 434 B9R1.8 CSCc1ccccn1 Amb27837576 [1,0,0,0,0,0|3,0,0]=4 435 B9R1.8 CSCc1cccnc1 Amb24523080 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.8 CSSc1ccccc1 Amb4008371 [1,0,0,0,0,0|1,1,0]=3 437 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|2,0,0]=3 438 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [1,0,0,0,0,0|1,0,1]=3 439 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [1,0,0,0,0,0|1,0,1]=3 440 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [1,0,0,0,0,0|1,0,1]=3 441 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [1,0,0,0,0,0|2,0,1]=4 442 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [1,0,0,0,0,0|2,0,0]=3 443 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [1,0,0,0,0,0|3,0,0]=4 444 B9R1.8 ClCC[n+]1ccccc1 Amb28195087 [1,0,0,0,0,0|2,0,0]=3 445 B9R1.8 ClCCc1ccccc1 Amb535682 [1,0,0,0,0,0|1,0,0]=2 446 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,0]=3 447 B9R1.8 ClCCc1ccccn1 Amb19892295 [1,0,0,0,0,0|2,0,0]=3 448 B9R1.8 ClCCc1cccnc1 Amb24061504 [1,0,0,0,0,0|2,0,0]=3 449 B9R1.8 ClCCc1ccncc1 Amb23400891 [1,0,0,0,0,0|2,0,0]=3 450 B9R1.8 ClCCc1ccncc1 Amb9004339 [1,0,0,0,0,0|2,0,0]=3 451 B9R1.8 ClCCc1cnccn1 Amb33291299 [1,0,0,0,0,0|3,0,0]=4 452 B9R1.8 ClCCc1cncnc1 Amb24529105 [1,0,0,0,0,0|3,0,0]=4 453 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|1,0,0]=2 454 B9R1.8 ClCSc1ccccn1 Amb27603302 [1,0,0,0,0,0|2,1,0]=4 455 B9R1.8 ClCSc1ccncc1 Amb27185726 [1,0,0,0,0,0|2,1,0]=4 456 B9R1.8 ClNCc1cccnc1 Amb27951574 [1,0,0,0,0,0|3,0,0]=4 457 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,2]=4 458 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,2]=4 459 B9R1.8 IC#Cc1ccccc1 Amb26442219 [1,0,0,0,0,0|1,0,2]=4 460 B9R1.8 ICCc1ccccc1 Amb8515353 [1,0,0,0,0,0|1,0,0]=2 461 B9R1.8 ICCc1cccnc1 Amb33534604 [1,0,0,0,0,0|2,0,0]=3 462 B9R1.8 ICCc1ccncc1 Amb28383331 [1,0,0,0,0,0|2,0,0]=3 463 B9R1.8 ICCc1cnccn1 Amb29849698 [1,0,0,0,0,0|3,0,0]=4 464 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,2]=4 465 B9R1.8 N#CC[n+]1ccccc1 Amb2608894 [1,0,0,0,0,0|2,0,1]=4 466 B9R1.8 N#CCc1ccccc1 Amb3598087 [1,0,0,0,0,0|1,0,1]=3 467 B9R1.8 N#CCc1ccccn1 Amb845695 [1,0,0,0,0,0|2,0,1]=4 468 B9R1.8 N#CCc1cccnc1 Amb2695344 [1,0,0,0,0,0|2,0,1]=4 469 B9R1.8 N#CCc1ccncc1 Amb6661799 [1,0,0,0,0,0|2,0,1]=4 470 B9R1.8 N#CCc1ccncc1 Amb8516296 [1,0,0,0,0,0|2,0,1]=4 471 B9R1.8 N#CNc1ccccc1 Amb9783273 [1,0,0,0,0,0|2,0,1]=4 472 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|1,0,1]=3 473 B9R1.8 N#COc1ccccn1 Amb24364723 [1,0,0,0,0,0|2,0,1]=4 474 B9R1.8 N#CSc1ccccc1 Amb6892469 [1,0,0,0,0,0|1,1,1]=4 475 B9R1.8 N#C[Se]c1ccccc1 Amb2690321 [1,0,0,0,0,0|1,1,1]=4 476 B9R1.8 NCC[n+]1ccccc1 Amb27246156 [1,0,0,0,0,0|2,0,0]=3 477 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,0]=2 478 B9R1.8 NCCc1ccccc1 Amb2792829 [1,0,0,0,0,0|1,0,0]=2 479 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,0]=3 480 B9R1.8 NCCc1ccccn1 Amb24066975 [1,0,0,0,0,0|2,0,0]=3 481 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,0]=3 482 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,0]=3 483 B9R1.8 NCCc1cccnc1 Amb20241523 [1,0,0,0,0,0|2,0,0]=3 484 B9R1.8 NCCc1cccnc1 Amb8631307 [1,0,0,0,0,0|2,0,0]=3 485 B9R1.8 NCCc1cccnn1 Amb23592188 [1,0,0,0,0,0|3,0,0]=4 486 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,0]=3 487 B9R1.8 NCCc1ccncc1 Amb8631358 [1,0,0,0,0,0|2,0,0]=3 488 B9R1.8 NCCc1ccncn1 Amb22899210 [1,0,0,0,0,0|3,0,0]=4 489 B9R1.8 NCCc1ccncn1 Amb8009432 [1,0,0,0,0,0|3,0,0]=4 490 B9R1.8 NCCc1ccnnc1 Amb31217486 [1,0,0,0,0,0|3,0,0]=4 491 B9R1.8 NCCc1ccnnc1 Amb8009433 [1,0,0,0,0,0|3,0,0]=4 492 B9R1.8 NCCc1cnccn1 Amb10067912 [1,0,0,0,0,0|3,0,0]=4 493 B9R1.8 NCCc1cnccn1 Amb1995199 [1,0,0,0,0,0|3,0,0]=4 494 B9R1.8 NCCc1cnccn1 Amb22756001 [1,0,0,0,0,0|3,0,0]=4 495 B9R1.8 NCCc1cnccn1 Amb24066949 [1,0,0,0,0,0|3,0,0]=4 496 B9R1.8 NCCc1cnccn1 Amb30526944 [1,0,0,0,0,0|3,0,0]=4 497 B9R1.8 NCCc1cncnc1 Amb32667660 [1,0,0,0,0,0|3,0,0]=4 498 B9R1.8 NCCc1cncnc1 Amb8009434 [1,0,0,0,0,0|3,0,0]=4 499 B9R1.8 NCCc1cncnc1 Amb8631335 [1,0,0,0,0,0|3,0,0]=4 500 B9R1.8 NCCc1ncccn1 Amb17074351 [1,0,0,0,0,0|3,0,0]=4 501 B9R1.8 NCCc1ncccn1 Amb18199432 [1,0,0,0,0,0|3,0,0]=4 502 B9R1.8 NCCc1ncccn1 Amb23399636 [1,0,0,0,0,0|3,0,0]=4 503 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|2,0,0]=3 504 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|1,0,0]=2 505 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 506 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 507 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 508 B9R1.8 NNCc1ccccc1 Amb8513062 [1,0,0,0,0,0|2,0,0]=3 509 B9R1.8 NNCc1ccccc1 Amb9826089 [1,0,0,0,0,0|2,0,0]=3 510 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 511 B9R1.8 NNCc1ccccn1 Amb28984160 [1,0,0,0,0,0|3,0,0]=4 512 B9R1.8 NNCc1ccccn1 Amb6892424 [1,0,0,0,0,0|3,0,0]=4 513 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 514 B9R1.8 NNCc1cccnc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 515 B9R1.8 NNCc1cccnc1 Amb33551495 [1,0,0,0,0,0|3,0,0]=4 516 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 517 B9R1.8 NNCc1ccncc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 518 B9R1.8 NNCc1ccncc1 Amb2691315 [1,0,0,0,0,0|3,0,0]=4 519 B9R1.8 NNCc1ccncc1 Amb28984138 [1,0,0,0,0,0|3,0,0]=4 520 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 521 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 522 B9R1.8 NOCc1ccccc1 Amb6600539 [1,0,0,0,0,0|2,0,0]=3 523 B9R1.8 NOCc1ccccn1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 524 B9R1.8 NOCc1ccccn1 Amb32663271 [1,0,0,0,0,0|3,0,0]=4 525 B9R1.8 NOCc1cccnc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 526 B9R1.8 NOCc1cccnc1 Amb33546939 [1,0,0,0,0,0|3,0,0]=4 527 B9R1.8 NOCc1ccncc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 528 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|2,0,1]=4 529 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [1,0,0,0,0,0|2,0,1]=4 530 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [1,0,0,0,0,0|2,0,1]=4 531 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [1,0,0,0,0,0|1,0,2]=4 532 B9R1.8 O=CCc1ccccc1 Amb3939950 [1,0,0,0,0,0|0,0,2]=3 533 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,2]=4 534 B9R1.8 O=CCc1cccnc1 Amb8011002 [1,0,0,0,0,0|1,0,2]=4 535 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,2]=4 536 B9R1.8 O=CNc1ccccc1 Amb2613772 [1,0,0,0,0,0|1,0,2]=4 537 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|0,0,2]=3 538 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [1,0,0,0,0,0|2,0,1]=4 539 B9R1.8 OCC[n+]1ccccc1 Amb27839429 [1,0,0,0,0,0|1,0,0]=2 540 B9R1.8 OCCc1ccccc1 Amb2793058 [1,0,0,0,0,0|0,0,0]=1 541 B9R1.8 OCCc1ccccn1 Amb3939045 [1,0,0,0,0,0|1,0,0]=2 542 B9R1.8 OCCc1cccnc1 Amb2688750 [1,0,0,0,0,0|1,0,0]=2 543 B9R1.8 OCCc1cccnn1 Amb25086060 [1,0,0,0,0,0|2,0,0]=3 544 B9R1.8 OCCc1ccncc1 Amb3939219 [1,0,0,0,0,0|1,0,0]=2 545 B9R1.8 OCCc1ccncn1 Amb17593271 [1,0,0,0,0,0|2,0,0]=3 546 B9R1.8 OCCc1ccnnc1 Amb23559765 [1,0,0,0,0,0|2,0,0]=3 547 B9R1.8 OCCc1cnccn1 Amb2695474 [1,0,0,0,0,0|2,0,0]=3 548 B9R1.8 OCCc1cncnc1 Amb20240921 [1,0,0,0,0,0|2,0,0]=3 549 B9R1.8 OCCc1ncccn1 Amb22896758 [1,0,0,0,0,0|2,0,0]=3 550 B9R1.8 OCSc1ccccc1 Amb27776457 [1,0,0,0,0,0|0,1,0]=2 551 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,0]=2 552 B9R1.8 ONCc1ccccc1 Amb9825936 [1,0,0,0,0,0|1,0,0]=2 553 B9R1.8 ONCc1ccccn1 Amb28457793 [1,0,0,0,0,0|2,0,0]=3 554 B9R1.8 ONCc1ccccn1 Amb32680372 [1,0,0,0,0,0|2,0,0]=3 555 B9R1.8 ONCc1cccnc1 Amb25147084 [1,0,0,0,0,0|2,0,0]=3 556 B9R1.8 ONCc1ccncc1 Amb25851052 [1,0,0,0,0,0|2,0,0]=3 557 B9R1.8 ONCc1ccncn1 Amb23586394 [1,0,0,0,0,0|3,0,0]=4 558 B9R1.8 ONCc1cnccn1 Amb25936839 [1,0,0,0,0,0|3,0,0]=4 559 B9R1.8 ONCc1cncnc1 Amb28066281 [1,0,0,0,0,0|3,0,0]=4 560 B9R1.8 ONCc1ncccn1 Amb23586395 [1,0,0,0,0,0|3,0,0]=4 561 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [1,0,0,0,0,0|1,0,1]=3 562 B9R1.8 O\N=C/c1ccncc1 Amb9821776 [1,0,0,0,0,0|2,0,1]=4 563 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,1]=3 564 B9R1.8 O\N=C\c1ccccn1 Amb719680 [1,0,0,0,0,0|2,0,1]=4 565 B9R1.8 O\N=C\c1cccnc1 Amb3427823 [1,0,0,0,0,0|2,0,1]=4 566 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|2,0,1]=4 567 B9R1.8 O\N=N\c1ccccn1 Amb17940654 [1,0,0,0,0,0|3,0,0]=4 568 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 569 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,1]=4 570 B9R1.8 SCCc1ccccc1 Amb6255605 [1,0,0,0,0,0|0,1,0]=2 571 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|1,1,0]=3 572 B9R1.8 SCCc1cccnc1 Amb22008806 [1,0,0,0,0,0|1,1,0]=3 573 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|1,1,0]=3 574 B9R1.8 SCCc1ccncc1 Amb9800962 [1,0,0,0,0,0|1,1,0]=3 575 B9R1.8 SCCc1ccncn1 Amb33267506 [1,0,0,0,0,0|2,1,0]=4 576 B9R1.8 SCCc1cnccn1 Amb8392837 [1,0,0,0,0,0|2,1,0]=4 577 B9R1.8 SCCc1cncnc1 Amb32875711 [1,0,0,0,0,0|2,1,0]=4 578 B9R1.8 SCCc1ncccn1 Amb33270002 [1,0,0,0,0,0|2,1,0]=4 579 B9R1.8 SSCc1ccccc1 Amb27646980 [1,0,0,0,0,0|1,1,0]=3 580 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|2,0,0]=3 581 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|3,0,0]=4 582 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|3,0,0]=4 583 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|3,0,0]=4 584 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 585 B9R1.8 [N-]=[N+]=Nc1ccccc1 Amb6892570 [1,0,0,0,0,0|3,0,0]=4 586 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,0]=2 587 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [1,0,0,0,0,0|2,0,0]=3 588 B9R1.8 [O-][N+]#Cc1ccccc1 Amb25951967 [1,0,0,0,0,0|1,0,2]=4 589 B11R1.1 BrCC#Cc1ccc(Br)cc1 Amb25704336 [0,1,0,0,0,0|2,0,1]=4 590 B11R1.1 BrCC#Cc1ccc(I)cc1 Amb28241124 [0,1,0,0,0,0|2,0,1]=4 591 B11R1.1 BrCCCc1ccc(Br)cc1 Amb17104577 [0,1,0,0,0,0|2,0,0]=3 592 B11R1.1 BrCCCc1ccc(Br)cn1 Amb27945717 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.1 BrCCCc1ccc(Br)nc1 Amb27946967 [0,1,0,0,0,0|3,0,0]=4 594 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|2,0,0]=3 595 B11R1.1 BrCCOc1ccc(Br)cc1 Amb1106775 [0,1,0,0,0,0|1,0,0]=2 596 B11R1.1 BrCCOc1ccc(Br)nc1 Amb25716754 [0,1,0,0,0,0|2,0,0]=3 597 B11R1.1 BrCCOc1ccc(I)cc1 Amb602656 [0,1,0,0,0,0|1,0,0]=2 598 B11R1.1 BrCCSc1ccc(Br)cn1 Amb27229876 [0,1,0,0,0,0|2,1,0]=4 599 B11R1.1 BrC\C=C\c1ccc(Br)cc1 Amb28388511 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.1 Brc1ccc(C#CCI)cc1 Amb25891603 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.1 Brc1ccc(OCCI)cc1 Amb28365441 [0,1,0,0,0,0|1,0,0]=2 602 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|2,0,1]=4 603 B11R1.1 C#CCCc1ccc(C)cc1 Amb18634818 [0,1,0,0,0,0|2,0,1]=4 604 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|2,0,1]=4 605 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|2,0,1]=4 606 B11R1.1 C#CCCc1ccc(O)cc1 Amb26053114 [0,1,0,0,0,0|2,0,1]=4 607 B11R1.1 C#CCNc1ccc(Br)cc1 Amb27403970 [0,1,0,0,0,0|2,0,1]=4 608 B11R1.1 C#CCNc1ccc(C)cc1 Amb21953776 [0,1,0,0,0,0|2,0,1]=4 609 B11R1.1 C#CCNc1ccc(C)cc1 Amb33529603 [0,1,0,0,0,0|2,0,1]=4 610 B11R1.1 C#CCNc1ccc(Cl)cc1 Amb33330127 [0,1,0,0,0,0|2,0,1]=4 611 B11R1.1 C#CCNc1ccc(Cl)cc1 Amb4148888 [0,1,0,0,0,0|2,0,1]=4 612 B11R1.1 C#CCNc1ccc(F)cc1 Amb24070273 [0,1,0,0,0,0|2,0,1]=4 613 B11R1.1 C#CCNc1ccc(F)cc1 Amb33330129 [0,1,0,0,0,0|2,0,1]=4 614 B11R1.1 C#CCOc1ccc(Br)cc1 Amb33532765 [0,1,0,0,0,0|1,0,1]=3 615 B11R1.1 C#CCOc1ccc(Br)cn1 Amb24714311 [0,1,0,0,0,0|2,0,1]=4 616 B11R1.1 C#CCOc1ccc(Br)nc1 Amb25365808 [0,1,0,0,0,0|2,0,1]=4 617 B11R1.1 C#CCOc1ccc(C)cc1 Amb19373357 [0,1,0,0,0,0|1,0,1]=3 618 B11R1.1 C#CCOc1ccc(Cl)cc1 Amb5722320 [0,1,0,0,0,0|1,0,1]=3 619 B11R1.1 C#CCOc1ccc(F)cc1 Amb18182727 [0,1,0,0,0,0|1,0,1]=3 620 B11R1.1 C#CCOc1ccc(F)nc1 Amb27176238 [0,1,0,0,0,0|2,0,1]=4 621 B11R1.1 C#CCOc1ccc(I)cc1 Amb24476574 [0,1,0,0,0,0|1,0,1]=3 622 B11R1.1 C#CCOc1ccc(N)cc1 Amb13783679 [0,1,0,0,0,0|1,0,1]=3 623 B11R1.1 C#CCOc1ccc(N)cc1 Amb22587338 [0,1,0,0,0,0|1,0,1]=3 624 B11R1.1 C#CCOc1ccc(N)cn1 Amb23440814 [0,1,0,0,0,0|2,0,1]=4 625 B11R1.1 C#CCSc1ccc(Cl)cc1 Amb3836119 [0,1,0,0,0,0|1,1,1]=4 626 B11R1.1 C#CCSc1ccc(F)cc1 Amb18801035 [0,1,0,0,0,0|1,1,1]=4 627 B11R1.1 C#CCSc1ccc(O)cc1 Amb18792578 [0,1,0,0,0,0|1,1,1]=4 628 B11R1.1 C=CCCc1ccc(Br)cc1 Amb6298956 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.1 C=CCCc1ccc(C)cc1 Amb6299000 [0,1,0,0,0,0|2,0,1]=4 630 B11R1.1 C=CCCc1ccc(F)cc1 Amb2721507 [0,1,0,0,0,0|2,0,1]=4 631 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|2,0,1]=4 632 B11R1.1 C=CCNc1ccc(Br)cc1 Amb17306795 [0,1,0,0,0,0|2,0,1]=4 633 B11R1.1 C=CCNc1ccc(C)cc1 Amb17306868 [0,1,0,0,0,0|2,0,1]=4 634 B11R1.1 C=CCNc1ccc(F)cc1 Amb17306180 [0,1,0,0,0,0|2,0,1]=4 635 B11R1.1 C=CCNc1ccc(I)cc1 Amb17306247 [0,1,0,0,0,0|2,0,1]=4 636 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|2,0,1]=4 637 B11R1.1 C=CCOc1ccc(Br)cc1 Amb5722388 [0,1,0,0,0,0|1,0,1]=3 638 B11R1.1 C=CCOc1ccc(C)cc1 Amb3940652 [0,1,0,0,0,0|1,0,1]=3 639 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|1,0,1]=3 640 B11R1.1 C=CCOc1ccc(F)cc1 Amb27214032 [0,1,0,0,0,0|1,0,1]=3 641 B11R1.1 C=CCOc1ccc(F)nc1 Amb27176237 [0,1,0,0,0,0|2,0,1]=4 642 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|1,0,1]=3 643 B11R1.1 C=CCOc1ccc(I)nc1 Amb27598139 [0,1,0,0,0,0|2,0,1]=4 644 B11R1.1 C=CCOc1ccc(N)cc1 Amb2592767 [0,1,0,0,0,0|1,0,1]=3 645 B11R1.1 C=CCOc1ccc(N)cc1 Amb6541454 [0,1,0,0,0,0|1,0,1]=3 646 B11R1.1 C=CCOc1ccc(O)cc1 Amb2612084 [0,1,0,0,0,0|1,0,1]=3 647 B11R1.1 C=CCSc1ccc(Br)cc1 Amb4013518 [0,1,0,0,0,0|1,1,1]=4 648 B11R1.1 C=CCSc1ccc(C)cc1 Amb3836102 [0,1,0,0,0,0|1,1,1]=4 649 B11R1.1 C=CCSc1ccc(Cl)cc1 Amb3836125 [0,1,0,0,0,0|1,1,1]=4 650 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|1,1,1]=4 651 B11R1.1 C=CCSc1ccc(O)cc1 Amb8394315 [0,1,0,0,0,0|1,1,1]=4 652 B11R1.1 CCC#Cc1ccc(Br)cc1 Amb25891498 [0,1,0,0,0,0|2,0,1]=4 653 B11R1.1 CCC#Cc1ccc(C)cc1 Amb27855532 [0,1,0,0,0,0|2,0,1]=4 654 B11R1.1 CCC#Cc1ccc(Cl)cc1 Amb26578625 [0,1,0,0,0,0|2,0,1]=4 655 B11R1.1 CCC#Cc1ccc(F)cc1 Amb24730740 [0,1,0,0,0,0|2,0,1]=4 656 B11R1.1 CCC#Cc1ccc(I)cc1 Amb26996265 [0,1,0,0,0,0|2,0,1]=4 657 B11R1.1 CCC#Cc1ccc(N)cc1 Amb27960909 [0,1,0,0,0,0|2,0,1]=4 658 B11R1.1 CCC#Cc1ccc(O)cc1 Amb26631449 [0,1,0,0,0,0|2,0,1]=4 659 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [0,1,0,0,0,0|3,0,0]=4 660 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [0,1,0,0,0,0|3,0,0]=4 662 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb9825673 [0,1,0,0,0,0|3,0,0]=4 663 B11R1.1 CCCCc1ccc(Br)cc1 Amb3939176 [0,1,0,0,0,0|2,0,0]=3 664 B11R1.1 CCCCc1ccc(C)cc1 Amb22002059 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.1 CCCCc1ccc(Cl)cc1 Amb6365908 [0,1,0,0,0,0|2,0,0]=3 666 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.1 CCCCc1ccc(I)cc1 Amb2726236 [0,1,0,0,0,0|2,0,0]=3 668 B11R1.1 CCCCc1ccc(N)cc1 Amb2721121 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.1 CCCCc1ccc(N)cn1 Amb26866351 [0,1,0,0,0,0|3,0,0]=4 670 B11R1.1 CCCCc1ccc(N)nc1 Amb26477797 [0,1,0,0,0,0|3,0,0]=4 671 B11R1.1 CCCCc1ccc(O)cc1 Amb2778508 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.1 CCCCc1ccc(O)cn1 Amb25831110 [0,1,0,0,0,0|3,0,0]=4 673 B11R1.1 CCCCc1ccc(S)cc1 Amb2685702 [0,1,0,0,0,0|2,0,0]=3 674 B11R1.1 CCCNC1=CNC(=O)C=C1 Amb28045138 [0,1,0,0,0,0|3,0,0]=4 675 B11R1.1 CCCNc1ccc(Br)cc1 Amb29083384 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.1 CCCNc1ccc(Br)cc1 Amb4313508 [0,1,0,0,0,0|2,0,0]=3 677 B11R1.1 CCCNc1ccc(Br)cn1 Amb6629917 [0,1,0,0,0,0|3,0,0]=4 678 B11R1.1 CCCNc1ccc(Br)nc1 Amb27201574 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.1 CCCNc1ccc(C)cc1 Amb4313501 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.1 CCCNc1ccc(C)cn1 Amb6636195 [0,1,0,0,0,0|3,0,0]=4 681 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.1 CCCNc1ccc(Cl)cc1 Amb4313503 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.1 CCCNc1ccc(F)cc1 Amb4313509 [0,1,0,0,0,0|2,0,0]=3 684 B11R1.1 CCCNc1ccc(F)cn1 Amb18975389 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.1 CCCNc1ccc(I)cc1 Amb7784946 [0,1,0,0,0,0|2,0,0]=3 686 B11R1.1 CCCNc1ccc(N)cn1 Amb1113758 [0,1,0,0,0,0|3,0,0]=4 687 B11R1.1 CCCNc1ccc(N)nc1 Amb7767448 [0,1,0,0,0,0|3,0,0]=4 688 B11R1.1 CCCOC1=NNC(=S)C=C1 Amb27246771 [0,1,0,0,0,0|3,0,0]=4 689 B11R1.1 CCCOc1ccc(Br)cc1 Amb3428588 [0,1,0,0,0,0|1,0,0]=2 690 B11R1.1 CCCOc1ccc(Br)cn1 Amb19959351 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.1 CCCOc1ccc(Br)nc1 Amb20617679 [0,1,0,0,0,0|2,0,0]=3 692 B11R1.1 CCCOc1ccc(Br)nn1 Amb10599688 [0,1,0,0,0,0|3,0,0]=4 693 B11R1.1 CCCOc1ccc(C)cc1 Amb26409646 [0,1,0,0,0,0|1,0,0]=2 694 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [0,1,0,0,0,0|1,0,0]=2 695 B11R1.1 CCCOc1ccc(Cl)nc1 Amb28350575 [0,1,0,0,0,0|2,0,0]=3 696 B11R1.1 CCCOc1ccc(Cl)nn1 Amb8874791 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.1 CCCOc1ccc(F)nc1 Amb27656878 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.1 CCCOc1ccc(N)cc1 Amb1125044 [0,1,0,0,0,0|1,0,0]=2 699 B11R1.1 CCCOc1ccc(N)cc1 Amb32409662 [0,1,0,0,0,0|1,0,0]=2 700 B11R1.1 CCCOc1ccc(N)cn1 Amb8874533 [0,1,0,0,0,0|2,0,0]=3 701 B11R1.1 CCCOc1ccc(N)nc1 Amb8874527 [0,1,0,0,0,0|2,0,0]=3 702 B11R1.1 CCCOc1ccc(N)nn1 Amb10603877 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.1 CCCOc1ccc(O)cc1 Amb1810008 [0,1,0,0,0,0|1,0,0]=2 704 B11R1.1 CCCOc1ccc(O)cn1 Amb28344035 [0,1,0,0,0,0|2,0,0]=3 705 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [0,1,0,0,0,0|1,0,0]=2 706 B11R1.1 CCCOc1cnc(Br)cn1 Amb10599607 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.1 CCCOc1cnc(C)cn1 Amb26588588 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.1 CCCOc1cnc(Cl)nc1 Amb24321542 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.1 CCCOc1cnc(N)cn1 Amb28455505 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.1 CCCOc1cnc(N)nc1 Amb27233534 [0,1,0,0,0,0|3,0,0]=4 711 B11R1.1 CCCOc1ncc(Br)cn1 Amb13884716 [0,1,0,0,0,0|3,0,0]=4 712 B11R1.1 CCCOc1ncc(N)cn1 Amb18290432 [0,1,0,0,0,0|3,0,0]=4 713 B11R1.1 CCCSc1ccc(Br)cc1 Amb28184382 [0,1,0,0,0,0|1,1,0]=3 714 B11R1.1 CCCSc1ccc(C)cc1 Amb4035211 [0,1,0,0,0,0|1,1,0]=3 715 B11R1.1 CCCSc1ccc(Cl)cc1 Amb27466470 [0,1,0,0,0,0|1,1,0]=3 716 B11R1.1 CCCSc1ccc(F)cc1 Amb28365659 [0,1,0,0,0,0|1,1,0]=3 717 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [0,1,0,0,0,0|1,1,0]=3 718 B11R1.1 CCCSc1ccc(N)cc1 Amb6680313 [0,1,0,0,0,0|1,1,0]=3 719 B11R1.1 CCCSc1ccc(N)cn1 Amb6680309 [0,1,0,0,0,0|2,1,0]=4 720 B11R1.1 CCCSc1ccc(N)nc1 Amb6680319 [0,1,0,0,0,0|2,1,0]=4 721 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [0,1,0,0,0,0|1,1,0]=3 722 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [0,1,0,0,0,0|1,1,0]=3 723 B11R1.1 CCNCc1ccc(Br)cc1 Amb6864710 [0,1,0,0,0,0|3,0,0]=4 724 B11R1.1 CCNCc1ccc(Br)cc1 Amb837745 [0,1,0,0,0,0|3,0,0]=4 725 B11R1.1 CCNCc1ccc(C)cc1 Amb32667090 [0,1,0,0,0,0|3,0,0]=4 726 B11R1.1 CCNCc1ccc(C)cc1 Amb837583 [0,1,0,0,0,0|3,0,0]=4 727 B11R1.1 CCNCc1ccc(Cl)cc1 Amb6542591 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.1 CCNCc1ccc(Cl)cc1 Amb837762 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.1 CCNCc1ccc(F)cc1 Amb6864711 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.1 CCNCc1ccc(F)cc1 Amb838198 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.1 CCNCc1ccc(O)cc1 Amb13952053 [0,1,0,0,0,0|3,0,0]=4 732 B11R1.1 CCNCc1ccc(O)cc1 Amb6257941 [0,1,0,0,0,0|3,0,0]=4 733 B11R1.1 CCNCc1ccc(S)cc1 Amb27952729 [0,1,0,0,0,0|3,0,0]=4 734 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [0,1,0,0,0,0|3,0,0]=4 735 B11R1.1 CCOCc1ccc(C)cc1 Amb33733834 [0,1,0,0,0,0|3,0,0]=4 736 B11R1.1 CCOCc1ccc(Cl)cc1 Amb25977812 [0,1,0,0,0,0|3,0,0]=4 737 B11R1.1 CCOCc1ccc(F)cc1 Amb30594745 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.1 CCOCc1ccc(N)cc1 Amb1125782 [0,1,0,0,0,0|3,0,0]=4 739 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [0,1,0,0,0,0|3,0,0]=4 740 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [0,1,0,0,0,0|3,0,0]=4 741 B11R1.1 CCSCc1ccc(C)cc1 Amb24536616 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [0,1,0,0,0,0|3,0,0]=4 744 B11R1.1 CCSCc1ccc(N)cc1 Amb6680506 [0,1,0,0,0,0|3,0,0]=4 745 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [0,1,0,0,0,0|2,0,1]=4 746 B11R1.1 CC\C=C\c1ccc(Br)cc1 Amb26968483 [0,1,0,0,0,0|2,0,1]=4 747 B11R1.1 CC\N=C\c1ccc(O)cc1 Amb3777289 [0,1,0,0,0,0|3,0,0]=4 748 B11R1.1 CNCCc1ccc(Br)cc1 Amb9214717 [0,1,0,0,0,0|3,0,0]=4 749 B11R1.1 CNCCc1ccc(C)cc1 Amb8853647 [0,1,0,0,0,0|3,0,0]=4 750 B11R1.1 CNCCc1ccc(Cl)cc1 Amb32789565 [0,1,0,0,0,0|3,0,0]=4 751 B11R1.1 CNCCc1ccc(Cl)cc1 Amb5785545 [0,1,0,0,0,0|3,0,0]=4 752 B11R1.1 CNCCc1ccc(F)cc1 Amb33483732 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.1 CNCCc1ccc(F)cc1 Amb5785548 [0,1,0,0,0,0|3,0,0]=4 754 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.1 CNCCc1ccc(O)cc1 Amb15690577 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.1 CNCCc1ccc(O)cc1 Amb2698071 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.1 COCCc1ccc(Br)cc1 Amb6257601 [0,1,0,0,0,0|3,0,0]=4 758 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.1 COCCc1ccc(N)cc1 Amb1139224 [0,1,0,0,0,0|3,0,0]=4 760 B11R1.1 COCCc1ccc(N)cc1 Amb33551018 [0,1,0,0,0,0|3,0,0]=4 761 B11R1.1 COCCc1ccc(O)cc1 Amb3939657 [0,1,0,0,0,0|3,0,0]=4 762 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [0,1,0,0,0,0|2,0,0]=3 763 B11R1.1 COCOc1ccc(Br)nc1 Amb25891865 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.1 COCOc1ccc(Cl)cc1 Amb26860995 [0,1,0,0,0,0|2,0,0]=3 765 B11R1.1 COCOc1ccc(Cl)nc1 Amb22831876 [0,1,0,0,0,0|3,0,0]=4 766 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [0,1,0,0,0,0|2,0,0]=3 767 B11R1.1 COCOc1ccc(F)nc1 Amb22831877 [0,1,0,0,0,0|3,0,0]=4 768 B11R1.1 COCOc1ccc(I)cc1 Amb26900030 [0,1,0,0,0,0|2,0,0]=3 769 B11R1.1 COCOc1ccc(N)cc1 Amb33547964 [0,1,0,0,0,0|2,0,0]=3 770 B11R1.1 COCOc1ccc(N)cn1 Amb33128030 [0,1,0,0,0,0|3,0,0]=4 771 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [0,1,0,0,0,0|2,0,0]=3 772 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [0,1,0,0,0,0|2,1,0]=4 773 B11R1.1 CSCCc1ccc(C)cc1 Amb27404222 [0,1,0,0,0,0|3,0,0]=4 774 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|3,0,0]=4 775 B11R1.1 CSCOc1ccc(Cl)nc1 Amb27858393 [0,1,0,0,0,0|3,0,0]=4 776 B11R1.1 CSCOc1ccc(F)nc1 Amb28253342 [0,1,0,0,0,0|3,0,0]=4 777 B11R1.1 CSCSc1ccc(O)cc1 Amb27762489 [0,1,0,0,0,0|2,1,0]=4 778 B11R1.1 C[n+]1ccc(CCCO)cc1 Amb8394811 [0,1,0,0,0,0|2,0,0]=3 779 B11R1.1 C[n+]1ccc(NCCN)cc1 Amb28245279 [0,1,0,0,0,0|3,0,0]=4 780 B11R1.1 C\C=C\Oc1ccc(N)cc1 Amb27859329 [0,1,0,0,0,0|1,0,2]=4 781 B11R1.1 Cc1ccc(C#CCBr)cc1 Amb28285617 [0,1,0,0,0,0|2,0,1]=4 782 B11R1.1 Cc1ccc(C#CCCl)cc1 Amb18792612 [0,1,0,0,0,0|2,0,1]=4 783 B11R1.1 Cc1ccc(C#CCN)cc1 Amb18281200 [0,1,0,0,0,0|2,0,1]=4 784 B11R1.1 Cc1ccc(C#CCO)cc1 Amb33535072 [0,1,0,0,0,0|1,0,1]=3 785 B11R1.1 Cc1ccc(C#CCO)nc1 Amb27255237 [0,1,0,0,0,0|2,0,1]=4 786 B11R1.1 Cc1ccc(CCC#N)cc1 Amb17204297 [0,1,0,0,0,0|2,0,1]=4 787 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [0,1,0,0,0,0|1,0,2]=4 788 B11R1.1 Cc1ccc(CCCBr)cc1 Amb17104554 [0,1,0,0,0,0|2,0,0]=3 789 B11R1.1 Cc1ccc(CCCBr)cn1 Amb25910751 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.1 Cc1ccc(CCCBr)nc1 Amb33336287 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.1 Cc1ccc(CCCCl)cc1 Amb17104527 [0,1,0,0,0,0|2,0,0]=3 792 B11R1.1 Cc1ccc(CCCN)cc1 Amb844761 [0,1,0,0,0,0|2,0,0]=3 793 B11R1.1 Cc1ccc(CCCN)cn1 Amb25069217 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.1 Cc1ccc(CCCN)nc1 Amb25348517 [0,1,0,0,0,0|3,0,0]=4 795 B11R1.1 Cc1ccc(CCCO)cc1 Amb3372062 [0,1,0,0,0,0|1,0,0]=2 796 B11R1.1 Cc1ccc(CCCO)cn1 Amb24533220 [0,1,0,0,0,0|2,0,0]=3 797 B11R1.1 Cc1ccc(CCCO)nc1 Amb25073187 [0,1,0,0,0,0|2,0,0]=3 798 B11R1.1 Cc1ccc(CCCS)cc1 Amb17400220 [0,1,0,0,0,0|1,1,0]=3 799 B11R1.1 Cc1ccc(CCCS)cn1 Amb32877089 [0,1,0,0,0,0|2,1,0]=4 800 B11R1.1 Cc1ccc(CCCS)nc1 Amb33198012 [0,1,0,0,0,0|2,1,0]=4 801 B11R1.1 Cc1ccc(CCNN)cc1 Amb8842845 [0,1,0,0,0,0|3,0,0]=4 802 B11R1.1 Cc1ccc(CCON)cc1 Amb33373961 [0,1,0,0,0,0|3,0,0]=4 803 B11R1.1 Cc1ccc(CC[Mg]Br)cc1 Amb6300498 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.1 Cc1ccc(COCCl)cc1 Amb27833050 [0,1,0,0,0,0|3,0,0]=4 805 B11R1.1 Cc1ccc(NCC#N)cc1 Amb363741 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.1 Cc1ccc(NCCCl)cc1 Amb17334787 [0,1,0,0,0,0|2,0,0]=3 807 B11R1.1 Cc1ccc(NCCN)cc1 Amb17057746 [0,1,0,0,0,0|2,0,0]=3 808 B11R1.1 Cc1ccc(NCCN)nc1 Amb33548417 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.1 Cc1ccc(NCCN)nc1 Amb6265998 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.1 Cc1ccc(NCCO)cc1 Amb2721832 [0,1,0,0,0,0|1,0,0]=2 811 B11R1.1 Cc1ccc(NCCO)nc1 Amb6644779 [0,1,0,0,0,0|2,0,0]=3 812 B11R1.1 Cc1ccc(NCCO)nn1 Amb18975347 [0,1,0,0,0,0|3,0,0]=4 813 B11R1.1 Cc1ccc(OCC#N)cc1 Amb4017041 [0,1,0,0,0,0|1,0,1]=3 814 B11R1.1 Cc1ccc(OCC=O)cc1 Amb5731821 [0,1,0,0,0,0|0,0,2]=3 815 B11R1.1 Cc1ccc(OCCBr)cc1 Amb1397755 [0,1,0,0,0,0|1,0,0]=2 816 B11R1.1 Cc1ccc(OCCBr)cn1 Amb32988375 [0,1,0,0,0,0|2,0,0]=3 817 B11R1.1 Cc1ccc(OCCBr)nc1 Amb32685036 [0,1,0,0,0,0|2,0,0]=3 818 B11R1.1 Cc1ccc(OCCCl)cc1 Amb5559280 [0,1,0,0,0,0|1,0,0]=2 819 B11R1.1 Cc1ccc(OCCCl)nc1 Amb32685035 [0,1,0,0,0,0|2,0,0]=3 820 B11R1.1 Cc1ccc(OCCF)cn1 Amb28284620 [0,1,0,0,0,0|2,0,0]=3 821 B11R1.1 Cc1ccc(OCCN)cc1 Amb1101721 [0,1,0,0,0,0|1,0,0]=2 822 B11R1.1 Cc1ccc(OCCN)cn1 Amb18992842 [0,1,0,0,0,0|2,0,0]=3 823 B11R1.1 Cc1ccc(OCCN)nc1 Amb18296482 [0,1,0,0,0,0|2,0,0]=3 824 B11R1.1 Cc1ccc(OCCO)cc1 Amb2209347 [0,1,0,0,0,0|0,0,0]=1 825 B11R1.1 Cc1ccc(OCCO)cn1 Amb23455913 [0,1,0,0,0,0|1,0,0]=2 826 B11R1.1 Cc1ccc(OCCO)nc1 Amb26655226 [0,1,0,0,0,0|1,0,0]=2 827 B11R1.1 Cc1ccc(OCCS)cc1 Amb6261684 [0,1,0,0,0,0|0,1,0]=2 828 B11R1.1 Cc1ccc(OCC[NH3+])cc1 Amb3986072 [0,1,0,0,0,0|1,0,0]=2 829 B11R1.1 Cc1ccc(O\C=C/Cl)cc1 Amb27400345 [0,1,0,0,0,0|1,0,2]=4 830 B11R1.1 Cc1ccc(SCC#N)cc1 Amb2726052 [0,1,0,0,0,0|1,1,1]=4 831 B11R1.1 Cc1ccc(SCC=O)cc1 Amb17082904 [0,1,0,0,0,0|0,1,2]=4 832 B11R1.1 Cc1ccc(SCCBr)cc1 Amb6271838 [0,1,0,0,0,0|1,1,0]=3 833 B11R1.1 Cc1ccc(SCCCl)cc1 Amb1657286 [0,1,0,0,0,0|1,1,0]=3 834 B11R1.1 Cc1ccc(SCCN)cc1 Amb3358619 [0,1,0,0,0,0|1,1,0]=3 835 B11R1.1 Cc1ccc(SCCN)cc1 Amb6388803 [0,1,0,0,0,0|1,1,0]=3 836 B11R1.1 Cc1ccc(SCCO)cc1 Amb3939497 [0,1,0,0,0,0|0,1,0]=2 837 B11R1.1 Cc1ccc(SCCS)cc1 Amb13881735 [0,1,0,0,0,0|0,2,0]=3 838 B11R1.1 Cc1ccc(\C=C\CCl)cc1 Amb26620547 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [0,1,0,0,0,0|1,0,1]=3 841 B11R1.1 Cc1ccc(\C=C\CO)cn1 Amb33359222 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.1 Cc1ccc(\C=C\CO)nc1 Amb33359294 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.1 Cc1ccc(\C=N\CO)cc1 Amb27598320 [0,1,0,0,0,0|2,0,0]=3 844 B11R1.1 Cc1cnc(CCCO)cn1 Amb33376979 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.1 Cc1cnc(OCCN)cn1 Amb33376946 [0,1,0,0,0,0|3,0,0]=4 846 B11R1.1 Cc1cnc(SCCO)nc1 Amb18180265 [0,1,0,0,0,0|2,1,0]=4 847 B11R1.1 ClCC#Cc1ccc(Br)cc1 Amb35656652 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.1 ClCC#Cc1ccc(Cl)cc1 Amb18319781 [0,1,0,0,0,0|2,0,1]=4 849 B11R1.1 ClCC#Cc1ccc(I)cc1 Amb26622201 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.1 ClCCCc1ccc(Br)cc1 Amb17104549 [0,1,0,0,0,0|2,0,0]=3 851 B11R1.1 ClCCCc1ccc(Br)cn1 Amb25891857 [0,1,0,0,0,0|3,0,0]=4 852 B11R1.1 ClCCCc1ccc(Cl)cc1 Amb3429107 [0,1,0,0,0,0|2,0,0]=3 853 B11R1.1 ClCCCc1ccc(Cl)cn1 Amb32690843 [0,1,0,0,0,0|3,0,0]=4 854 B11R1.1 ClCCCc1ccc(I)cc1 Amb27163564 [0,1,0,0,0,0|2,0,0]=3 855 B11R1.1 ClCCNc1ccc(Br)cc1 Amb17346195 [0,1,0,0,0,0|2,0,0]=3 856 B11R1.1 ClCCNc1ccc(Cl)cc1 Amb17336182 [0,1,0,0,0,0|2,0,0]=3 857 B11R1.1 ClCCOc1ccc(Br)cc1 Amb8827992 [0,1,0,0,0,0|1,0,0]=2 858 B11R1.1 ClCCOc1ccc(Br)cn1 Amb27229095 [0,1,0,0,0,0|2,0,0]=3 859 B11R1.1 ClCCOc1ccc(Cl)cc1 Amb8627758 [0,1,0,0,0,0|1,0,0]=2 860 B11R1.1 ClCCOc1ccc(I)cc1 Amb9211195 [0,1,0,0,0,0|1,0,0]=2 861 B11R1.1 ClCCSc1ccc(Br)cc1 Amb8995012 [0,1,0,0,0,0|1,1,0]=3 862 B11R1.1 ClCCSc1ccc(Cl)cc1 Amb1154201 [0,1,0,0,0,0|1,1,0]=3 863 B11R1.1 ClCOCc1ccc(Cl)cc1 Amb28458528 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.1 ClCSCc1ccc(Cl)cc1 Amb25704966 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [0,1,0,0,0,0|2,0,1]=4 866 B11R1.1 Cl\C=C\Oc1ccc(Cl)cc1 Amb27878895 [0,1,0,0,0,0|1,0,2]=4 867 B11R1.1 Clc1ccc(C#CCBr)cc1 Amb24384136 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.1 Clc1ccc(C#CCI)cc1 Amb25353537 [0,1,0,0,0,0|2,0,1]=4 869 B11R1.1 Clc1ccc(CCCBr)cc1 Amb17104562 [0,1,0,0,0,0|2,0,0]=3 870 B11R1.1 Clc1ccc(CCCBr)cn1 Amb33388745 [0,1,0,0,0,0|3,0,0]=4 871 B11R1.1 Clc1ccc(CCCBr)nc1 Amb32690844 [0,1,0,0,0,0|3,0,0]=4 872 B11R1.1 Clc1ccc(CC[Mg]Br)cc1 Amb6300494 [0,1,0,0,0,0|3,0,0]=4 873 B11R1.1 Clc1ccc(OCCBr)cc1 Amb1151965 [0,1,0,0,0,0|1,0,0]=2 874 B11R1.1 Clc1ccc(OCCBr)cn1 Amb27166298 [0,1,0,0,0,0|2,0,0]=3 875 B11R1.1 Clc1ccc(OCCI)cc1 Amb25833023 [0,1,0,0,0,0|1,0,0]=2 876 B11R1.1 Clc1ccc(SCCBr)cc1 Amb6277932 [0,1,0,0,0,0|1,1,0]=3 877 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [0,1,0,0,0,0|2,0,1]=4 878 B11R1.1 FCC#Cc1ccc(Br)cc1 Amb27169324 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.1 FCC#Cc1ccc(Cl)cc1 Amb25825390 [0,1,0,0,0,0|2,0,1]=4 880 B11R1.1 FCC#Cc1ccc(F)cc1 Amb28041433 [0,1,0,0,0,0|2,0,1]=4 881 B11R1.1 FCC#Cc1ccc(I)cc1 Amb25353811 [0,1,0,0,0,0|2,0,1]=4 882 B11R1.1 FCCNc1ccc(Br)cc1 Amb27960248 [0,1,0,0,0,0|2,0,0]=3 883 B11R1.1 FCCNc1ccc(Cl)cn1 Amb27768120 [0,1,0,0,0,0|3,0,0]=4 884 B11R1.1 FCCOc1ccc(Br)cc1 Amb22227902 [0,1,0,0,0,0|1,0,0]=2 885 B11R1.1 FCCOc1ccc(Br)nc1 Amb27823487 [0,1,0,0,0,0|2,0,0]=3 886 B11R1.1 FCCOc1ccc(Cl)nc1 Amb27449157 [0,1,0,0,0,0|2,0,0]=3 887 B11R1.1 FCCOc1ccc(I)cc1 Amb22227565 [0,1,0,0,0,0|1,0,0]=2 888 B11R1.1 FCCOc1ccc(I)nc1 Amb27852981 [0,1,0,0,0,0|2,0,0]=3 889 B11R1.1 FCCOc1ccc(S)cc1 Amb23580141 [0,1,0,0,0,0|1,0,0]=2 890 B11R1.1 FCCOc1ncc(Br)cn1 Amb27491852 [0,1,0,0,0,0|3,0,0]=4 891 B11R1.1 FCCSc1ccc(Br)cc1 Amb28125377 [0,1,0,0,0,0|1,1,0]=3 892 B11R1.1 FCCSc1ccc(Cl)cn1 Amb27829222 [0,1,0,0,0,0|2,1,0]=4 893 B11R1.1 Fc1ccc(C#CCBr)cc1 Amb25737916 [0,1,0,0,0,0|2,0,1]=4 894 B11R1.1 Fc1ccc(C#CCCl)cc1 Amb18180184 [0,1,0,0,0,0|2,0,1]=4 895 B11R1.1 Fc1ccc(CCCBr)cc1 Amb17104556 [0,1,0,0,0,0|2,0,0]=3 896 B11R1.1 Fc1ccc(CCCBr)cn1 Amb33333192 [0,1,0,0,0,0|3,0,0]=4 897 B11R1.1 Fc1ccc(CCCBr)nc1 Amb33477021 [0,1,0,0,0,0|3,0,0]=4 898 B11R1.1 Fc1ccc(CCCCl)cc1 Amb17104529 [0,1,0,0,0,0|2,0,0]=3 899 B11R1.1 Fc1ccc(CCCS)cc1 Amb17400333 [0,1,0,0,0,0|1,1,0]=3 900 B11R1.1 Fc1ccc(CCCS)cn1 Amb33425099 [0,1,0,0,0,0|2,1,0]=4 901 B11R1.1 Fc1ccc(CCCS)nc1 Amb33315234 [0,1,0,0,0,0|2,1,0]=4 902 B11R1.1 Fc1ccc(CC[Mg]Br)cc1 Amb6300496 [0,1,0,0,0,0|3,0,0]=4 903 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|3,0,0]=4 904 B11R1.1 Fc1ccc(COCCl)cc1 Amb27436932 [0,1,0,0,0,0|3,0,0]=4 905 B11R1.1 Fc1ccc(CSCCl)cc1 Amb27984824 [0,1,0,0,0,0|3,0,0]=4 906 B11R1.1 Fc1ccc(NCCCl)cc1 Amb17334965 [0,1,0,0,0,0|2,0,0]=3 907 B11R1.1 Fc1ccc(NCCS)cc1 Amb24545874 [0,1,0,0,0,0|1,1,0]=3 908 B11R1.1 Fc1ccc(OCCBr)cc1 Amb1152775 [0,1,0,0,0,0|1,0,0]=2 909 B11R1.1 Fc1ccc(OCCBr)cn1 Amb26613405 [0,1,0,0,0,0|2,0,0]=3 910 B11R1.1 Fc1ccc(OCCCl)cc1 Amb8828433 [0,1,0,0,0,0|1,0,0]=2 911 B11R1.1 Fc1ccc(OCCS)cc1 Amb17232868 [0,1,0,0,0,0|0,1,0]=2 912 B11R1.1 Fc1ccc(SCCBr)cc1 Amb33532712 [0,1,0,0,0,0|1,1,0]=3 913 B11R1.1 Fc1ccc(SCCCl)cc1 Amb426863 [0,1,0,0,0,0|1,1,0]=3 914 B11R1.1 Fc1ccc(\C=C\CBr)cc1 Amb25923286 [0,1,0,0,0,0|2,0,1]=4 915 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.1 Fc1ccc(\C=C\CS)cc1 Amb33201386 [0,1,0,0,0,0|1,1,1]=4 917 B11R1.1 ICC#Cc1ccc(I)cc1 Amb27600694 [0,1,0,0,0,0|2,0,1]=4 918 B11R1.1 ICCOc1ccc(I)cc1 Amb28074249 [0,1,0,0,0,0|1,0,0]=2 919 B11R1.1 N#CCCc1ccc(Br)cc1 Amb2685460 [0,1,0,0,0,0|2,0,1]=4 920 B11R1.1 N#CCCc1ccc(Cl)cc1 Amb2686407 [0,1,0,0,0,0|2,0,1]=4 921 B11R1.1 N#CCCc1ccc(F)cc1 Amb17204299 [0,1,0,0,0,0|2,0,1]=4 922 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|2,0,1]=4 923 B11R1.1 N#CCCc1ccc(N)cc1 Amb26509671 [0,1,0,0,0,0|2,0,1]=4 924 B11R1.1 N#CCCc1ccc(O)cc1 Amb2688782 [0,1,0,0,0,0|2,0,1]=4 925 B11R1.1 N#CCCc1ccc(S)cc1 Amb27634330 [0,1,0,0,0,0|2,0,1]=4 926 B11R1.1 N#CCNc1ccc(Br)cc1 Amb33526942 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.1 N#CCNc1ccc(Cl)cc1 Amb32664421 [0,1,0,0,0,0|2,0,1]=4 928 B11R1.1 N#CCNc1ccc(Cl)cc1 Amb33526938 [0,1,0,0,0,0|2,0,1]=4 929 B11R1.1 N#CCNc1ccc(F)cc1 Amb33526944 [0,1,0,0,0,0|2,0,1]=4 930 B11R1.1 N#CCNc1ccc(O)cc1 Amb3992192 [0,1,0,0,0,0|2,0,1]=4 931 B11R1.1 N#CCOc1ccc(Br)cc1 Amb2761587 [0,1,0,0,0,0|1,0,1]=3 932 B11R1.1 N#CCOc1ccc(Cl)cc1 Amb2725205 [0,1,0,0,0,0|1,0,1]=3 933 B11R1.1 N#CCOc1ccc(Cl)cn1 Amb8439549 [0,1,0,0,0,0|2,0,1]=4 934 B11R1.1 N#CCOc1ccc(Cl)nc1 Amb25823494 [0,1,0,0,0,0|2,0,1]=4 935 B11R1.1 N#CCOc1ccc(F)cc1 Amb3428060 [0,1,0,0,0,0|1,0,1]=3 936 B11R1.1 N#CCOc1ccc(F)nc1 Amb25677155 [0,1,0,0,0,0|2,0,1]=4 937 B11R1.1 N#CCOc1ccc(I)cc1 Amb8830749 [0,1,0,0,0,0|1,0,1]=3 938 B11R1.1 N#CCOc1ccc(N)cc1 Amb421709 [0,1,0,0,0,0|1,0,1]=3 939 B11R1.1 N#CCOc1ccc(O)cc1 Amb33528797 [0,1,0,0,0,0|1,0,1]=3 940 B11R1.1 N#CCSc1ccc(Cl)cc1 Amb1156063 [0,1,0,0,0,0|1,1,1]=4 941 B11R1.1 N#CCSc1ccc(F)cc1 Amb1152494 [0,1,0,0,0,0|1,1,1]=4 942 B11R1.1 N#CCSc1ccc(N)cc1 Amb8903896 [0,1,0,0,0,0|1,1,1]=4 943 B11R1.1 NCC#Cc1ccc(Br)cc1 Amb18253475 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.1 NCC#Cc1ccc(Cl)cc1 Amb18950127 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.1 NCC#Cc1ccc(F)cc1 Amb18949804 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.1 NCC#Cc1ccc(I)cc1 Amb27602947 [0,1,0,0,0,0|2,0,1]=4 947 B11R1.1 NCC#Cc1ccc(O)cc1 Amb26622440 [0,1,0,0,0,0|2,0,1]=4 948 B11R1.1 NCCCN1C=CC(=O)C=C1 Amb18029471 [0,1,0,0,0,0|3,0,0]=4 949 B11R1.1 NCCCc1cc[n+]([O-])cc1 Amb25145870 [0,1,0,0,0,0|3,0,0]=4 950 B11R1.1 NCCCc1ccc(Br)cc1 Amb9304905 [0,1,0,0,0,0|2,0,0]=3 951 B11R1.1 NCCCc1ccc(Br)cn1 Amb26420926 [0,1,0,0,0,0|3,0,0]=4 952 B11R1.1 NCCCc1ccc(Br)nc1 Amb24453424 [0,1,0,0,0,0|3,0,0]=4 953 B11R1.1 NCCCc1ccc(Cl)cc1 Amb1092541 [0,1,0,0,0,0|2,0,0]=3 954 B11R1.1 NCCCc1ccc(Cl)cc1 Amb13952055 [0,1,0,0,0,0|2,0,0]=3 955 B11R1.1 NCCCc1ccc(Cl)cn1 Amb26843010 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.1 NCCCc1ccc(Cl)nc1 Amb25849321 [0,1,0,0,0,0|3,0,0]=4 957 B11R1.1 NCCCc1ccc(F)cc1 Amb28988628 [0,1,0,0,0,0|2,0,0]=3 958 B11R1.1 NCCCc1ccc(F)cc1 Amb5400261 [0,1,0,0,0,0|2,0,0]=3 959 B11R1.1 NCCCc1ccc(F)cn1 Amb33172702 [0,1,0,0,0,0|3,0,0]=4 960 B11R1.1 NCCCc1ccc(F)nc1 Amb26622803 [0,1,0,0,0,0|3,0,0]=4 961 B11R1.1 NCCCc1ccc(N)cc1 Amb17477693 [0,1,0,0,0,0|2,0,0]=3 962 B11R1.1 NCCCc1ccc(N)cc1 Amb34913304 [0,1,0,0,0,0|2,0,0]=3 963 B11R1.1 NCCCc1ccc(O)cc1 Amb2695306 [0,1,0,0,0,0|2,0,0]=3 964 B11R1.1 NCCCc1ccc(O)cc1 Amb33548453 [0,1,0,0,0,0|2,0,0]=3 965 B11R1.1 NCCCc1ccc(O)nc1 Amb26959474 [0,1,0,0,0,0|3,0,0]=4 966 B11R1.1 NCCNC1=CNC(=O)C=C1 Amb27603162 [0,1,0,0,0,0|3,0,0]=4 967 B11R1.1 NCCNc1ccc(Br)cc1 Amb17057752 [0,1,0,0,0,0|2,0,0]=3 968 B11R1.1 NCCNc1ccc(Br)cc1 Amb33802287 [0,1,0,0,0,0|2,0,0]=3 969 B11R1.1 NCCNc1ccc(Br)cn1 Amb6257612 [0,1,0,0,0,0|3,0,0]=4 970 B11R1.1 NCCNc1ccc(Br)cn1 Amb8631387 [0,1,0,0,0,0|3,0,0]=4 971 B11R1.1 NCCNc1ccc(Cl)cc1 Amb17057751 [0,1,0,0,0,0|2,0,0]=3 972 B11R1.1 NCCNc1ccc(Cl)cn1 Amb6259122 [0,1,0,0,0,0|3,0,0]=4 973 B11R1.1 NCCNc1ccc(F)cc1 Amb17845075 [0,1,0,0,0,0|2,0,0]=3 974 B11R1.1 NCCNc1ccc(F)cn1 Amb18291560 [0,1,0,0,0,0|3,0,0]=4 975 B11R1.1 NCCNc1ccc(F)nc1 Amb27840149 [0,1,0,0,0,0|3,0,0]=4 976 B11R1.1 NCCNc1ccc(I)cc1 Amb27478342 [0,1,0,0,0,0|2,0,0]=3 977 B11R1.1 NCCNc1ccc(N)cc1 Amb18298668 [0,1,0,0,0,0|2,0,0]=3 978 B11R1.1 NCCNc1ccc(N)cn1 Amb8332866 [0,1,0,0,0,0|3,0,0]=4 979 B11R1.1 NCCNc1ccc(O)cc1 Amb26372806 [0,1,0,0,0,0|2,0,0]=3 980 B11R1.1 NCCNc1ccc(O)cc1 Amb33620334 [0,1,0,0,0,0|2,0,0]=3 981 B11R1.1 NCCOc1ccc(Br)cc1 Amb1098668 [0,1,0,0,0,0|1,0,0]=2 982 B11R1.1 NCCOc1ccc(Br)cc1 Amb19338687 [0,1,0,0,0,0|1,0,0]=2 983 B11R1.1 NCCOc1ccc(Br)cn1 Amb18988876 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.1 NCCOc1ccc(Br)nc1 Amb33388870 [0,1,0,0,0,0|2,0,0]=3 985 B11R1.1 NCCOc1ccc(Cl)cc1 Amb1153919 [0,1,0,0,0,0|1,0,0]=2 986 B11R1.1 NCCOc1ccc(Cl)cc1 Amb836282 [0,1,0,0,0,0|1,0,0]=2 987 B11R1.1 NCCOc1ccc(Cl)cn1 Amb18988875 [0,1,0,0,0,0|2,0,0]=3 988 B11R1.1 NCCOc1ccc(Cl)cn1 Amb20631070 [0,1,0,0,0,0|2,0,0]=3 989 B11R1.1 NCCOc1ccc(Cl)nc1 Amb33261688 [0,1,0,0,0,0|2,0,0]=3 990 B11R1.1 NCCOc1ccc(F)cc1 Amb1102015 [0,1,0,0,0,0|1,0,0]=2 991 B11R1.1 NCCOc1ccc(F)cc1 Amb6760496 [0,1,0,0,0,0|1,0,0]=2 992 B11R1.1 NCCOc1ccc(F)cc1 Amb8503394 [0,1,0,0,0,0|1,0,0]=2 993 B11R1.1 NCCOc1ccc(F)cn1 Amb18296419 [0,1,0,0,0,0|2,0,0]=3 994 B11R1.1 NCCOc1ccc(F)nc1 Amb33425112 [0,1,0,0,0,0|2,0,0]=3 995 B11R1.1 NCCOc1ccc(I)cc1 Amb8838565 [0,1,0,0,0,0|1,0,0]=2 996 B11R1.1 NCCOc1ccc(I)nc1 Amb24707119 [0,1,0,0,0,0|2,0,0]=3 997 B11R1.1 NCCOc1ccc(N)cc1 Amb23401881 [0,1,0,0,0,0|1,0,0]=2 998 B11R1.1 NCCOc1ccc(N)cc1 Amb6369536 [0,1,0,0,0,0|1,0,0]=2 999 B11R1.1 NCCOc1ccc(N)cc1 Amb6878165 [0,1,0,0,0,0|1,0,0]=2 1000 B11R1.1 NCCOc1ccc(O)cc1 Amb18125536 [0,1,0,0,0,0|1,0,0]=2 1001 B11R1.1 NCCOc1ccc(O)cc1 Amb34913371 [0,1,0,0,0,0|1,0,0]=2 1002 B11R1.1 NCCOc1ncc(Br)cn1 Amb25743579 [0,1,0,0,0,0|3,0,0]=4 1003 B11R1.1 NCCOc1ncc(Cl)cn1 Amb27974133 [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.1 NCCSc1ccc(Br)cc1 Amb1105170 [0,1,0,0,0,0|1,1,0]=3 1005 B11R1.1 NCCSc1ccc(Br)cc1 Amb265577 [0,1,0,0,0,0|1,1,0]=3 1006 B11R1.1 NCCSc1ccc(Cl)cc1 Amb2236679 [0,1,0,0,0,0|1,1,0]=3 1007 B11R1.1 NCCSc1ccc(Cl)cc1 Amb6384759 [0,1,0,0,0,0|1,1,0]=3 1008 B11R1.1 NCCSc1ccc(Cl)cn1 Amb18252999 [0,1,0,0,0,0|2,1,0]=4 1009 B11R1.1 NCCSc1ccc(F)cc1 Amb3430826 [0,1,0,0,0,0|1,1,0]=3 1010 B11R1.1 NCCSc1ccc(F)cc1 Amb6256366 [0,1,0,0,0,0|1,1,0]=3 1011 B11R1.1 NCCSc1ccc(I)cc1 Amb25952689 [0,1,0,0,0,0|1,1,0]=3 1012 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [0,1,0,0,0,0|2,0,1]=4 1013 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb30584648 [0,1,0,0,0,0|2,0,1]=4 1014 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [0,1,0,0,0,0|2,0,1]=4 1015 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [0,1,0,0,0,0|2,0,1]=4 1016 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb33361954 [0,1,0,0,0,0|2,0,1]=4 1017 B11R1.1 NC\N=N\c1ccc(Br)cc1 Amb27257879 [0,1,0,0,0,0|3,0,0]=4 1018 B11R1.1 NNCCc1ccc(Br)cc1 Amb6243917 [0,1,0,0,0,0|3,0,0]=4 1019 B11R1.1 NNCCc1ccc(Cl)cc1 Amb6257002 [0,1,0,0,0,0|3,0,0]=4 1020 B11R1.1 NNCCc1ccc(F)cc1 Amb6245233 [0,1,0,0,0,0|3,0,0]=4 1021 B11R1.1 NNCCc1ccc(I)cc1 Amb27816617 [0,1,0,0,0,0|3,0,0]=4 1022 B11R1.1 NNCCc1ccc(O)cc1 Amb27802782 [0,1,0,0,0,0|3,0,0]=4 1023 B11R1.1 NOCCc1ccc(Br)cc1 Amb33241028 [0,1,0,0,0,0|3,0,0]=4 1024 B11R1.1 NOCCc1ccc(Cl)cc1 Amb28411635 [0,1,0,0,0,0|3,0,0]=4 1025 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|3,0,0]=4 1026 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|3,0,0]=4 1027 B11R1.1 Nc1ccc(C#CCBr)cc1 Amb25188870 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.1 Nc1ccc(C#CCCl)cc1 Amb26498093 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.1 Nc1ccc(C#CCF)cc1 Amb24554108 [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.1 Nc1ccc(C#CCI)cc1 Amb26983008 [0,1,0,0,0,0|2,0,1]=4 1031 B11R1.1 Nc1ccc(C#CCO)cc1 Amb22228978 [0,1,0,0,0,0|1,0,1]=3 1032 B11R1.1 Nc1ccc(C#CCO)cn1 Amb26859433 [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.1 Nc1ccc(CC#CO)cc1 Amb27662909 [0,1,0,0,0,0|1,0,2]=4 1034 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [0,1,0,0,0,0|1,0,2]=4 1035 B11R1.1 Nc1ccc(CCCBr)cc1 Amb27751175 [0,1,0,0,0,0|2,0,0]=3 1036 B11R1.1 Nc1ccc(CCCCl)cc1 Amb17477708 [0,1,0,0,0,0|2,0,0]=3 1037 B11R1.1 Nc1ccc(CCCO)cc1 Amb17477700 [0,1,0,0,0,0|1,0,0]=2 1038 B11R1.1 Nc1ccc(CCCO)cn1 Amb27598007 [0,1,0,0,0,0|2,0,0]=3 1039 B11R1.1 Nc1ccc(CCCS)cc1 Amb29854940 [0,1,0,0,0,0|1,1,0]=3 1040 B11R1.1 Nc1ccc(NCC=O)cc1 Amb27607100 [0,1,0,0,0,0|1,0,2]=4 1041 B11R1.1 Nc1ccc(NCCO)cc1 Amb2715786 [0,1,0,0,0,0|1,0,0]=2 1042 B11R1.1 Nc1ccc(NCCO)cc1 Amb34913368 [0,1,0,0,0,0|1,0,0]=2 1043 B11R1.1 Nc1ccc(NCCO)cn1 Amb7768137 [0,1,0,0,0,0|2,0,0]=3 1044 B11R1.1 Nc1ccc(NCCO)nc1 Amb24080718 [0,1,0,0,0,0|2,0,0]=3 1045 B11R1.1 Nc1ccc(NCCO)nc1 Amb7768146 [0,1,0,0,0,0|2,0,0]=3 1046 B11R1.1 Nc1ccc(NCCO)nn1 Amb27408724 [0,1,0,0,0,0|3,0,0]=4 1047 B11R1.1 Nc1ccc(OCCBr)cc1 Amb20620461 [0,1,0,0,0,0|1,0,0]=2 1048 B11R1.1 Nc1ccc(OCCBr)cc1 Amb842416 [0,1,0,0,0,0|1,0,0]=2 1049 B11R1.1 Nc1ccc(OCCF)cc1 Amb23579951 [0,1,0,0,0,0|1,0,0]=2 1050 B11R1.1 Nc1ccc(OCCO)cc1 Amb15740917 [0,1,0,0,0,0|0,0,0]=1 1051 B11R1.1 Nc1ccc(OCCO)cc1 Amb6702377 [0,1,0,0,0,0|0,0,0]=1 1052 B11R1.1 Nc1ccc(OCCO)cn1 Amb6680952 [0,1,0,0,0,0|1,0,0]=2 1053 B11R1.1 Nc1ccc(OCCO)nc1 Amb32992307 [0,1,0,0,0,0|1,0,0]=2 1054 B11R1.1 Nc1ccc(OCCO)nc1 Amb6680944 [0,1,0,0,0,0|1,0,0]=2 1055 B11R1.1 Nc1ccc(OCCS)cc1 Amb17504126 [0,1,0,0,0,0|0,1,0]=2 1056 B11R1.1 Nc1ccc(SCC=O)cc1 Amb30012112 [0,1,0,0,0,0|0,1,2]=4 1057 B11R1.1 Nc1ccc(SCCF)nc1 Amb27413275 [0,1,0,0,0,0|2,1,0]=4 1058 B11R1.1 Nc1ccc(SCCO)cc1 Amb8929761 [0,1,0,0,0,0|0,1,0]=2 1059 B11R1.1 Nc1ccc(SCCO)nc1 Amb8931856 [0,1,0,0,0,0|1,1,0]=3 1060 B11R1.1 Nc1ccc(SCCO)nn1 Amb27863008 [0,1,0,0,0,0|2,1,0]=4 1061 B11R1.1 Nc1cnc(OCCO)nc1 Amb18290429 [0,1,0,0,0,0|2,0,0]=3 1062 B11R1.1 Nc1ncc(CCCO)cn1 Amb22394981 [0,1,0,0,0,0|3,0,0]=4 1063 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [0,1,0,0,0,0|1,0,2]=4 1064 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [0,1,0,0,0,0|1,0,2]=4 1065 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [0,1,0,0,0,0|1,0,2]=4 1066 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [0,1,0,0,0,0|1,0,2]=4 1067 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [0,1,0,0,0,0|1,0,2]=4 1068 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [0,1,0,0,0,0|1,0,2]=4 1069 B11R1.1 O=CCOc1ccc(Cl)cc1 Amb5731836 [0,1,0,0,0,0|0,0,2]=3 1070 B11R1.1 O=CCOc1ccc(F)cc1 Amb5731822 [0,1,0,0,0,0|0,0,2]=3 1071 B11R1.1 O=CCOc1ccc(I)cc1 Amb27640919 [0,1,0,0,0,0|0,0,2]=3 1072 B11R1.1 O=CCSc1ccc(Br)cc1 Amb17082907 [0,1,0,0,0,0|0,1,2]=4 1073 B11R1.1 O=CCSc1ccc(Cl)cc1 Amb17082906 [0,1,0,0,0,0|0,1,2]=4 1074 B11R1.1 O=CCSc1ccc(F)cc1 Amb17082905 [0,1,0,0,0,0|0,1,2]=4 1075 B11R1.1 OCC#Cc1ccc(Br)cc1 Amb836640 [0,1,0,0,0,0|1,0,1]=3 1076 B11R1.1 OCC#Cc1ccc(Br)cn1 Amb5722058 [0,1,0,0,0,0|2,0,1]=4 1077 B11R1.1 OCC#Cc1ccc(Cl)cc1 Amb836709 [0,1,0,0,0,0|1,0,1]=3 1078 B11R1.1 OCC#Cc1ccc(F)cc1 Amb836583 [0,1,0,0,0,0|1,0,1]=3 1079 B11R1.1 OCC#Cc1ccc(I)cc1 Amb28320919 [0,1,0,0,0,0|1,0,1]=3 1080 B11R1.1 OCC#Cc1ccc(O)cc1 Amb28253753 [0,1,0,0,0,0|1,0,1]=3 1081 B11R1.1 OCCCc1ccc(Br)cc1 Amb13883587 [0,1,0,0,0,0|1,0,0]=2 1082 B11R1.1 OCCCc1ccc(Br)cn1 Amb25309177 [0,1,0,0,0,0|2,0,0]=3 1083 B11R1.1 OCCCc1ccc(Br)nc1 Amb21963678 [0,1,0,0,0,0|2,0,0]=3 1084 B11R1.1 OCCCc1ccc(Cl)cc1 Amb2724698 [0,1,0,0,0,0|1,0,0]=2 1085 B11R1.1 OCCCc1ccc(Cl)cn1 Amb32945510 [0,1,0,0,0,0|2,0,0]=3 1086 B11R1.1 OCCCc1ccc(Cl)nc1 Amb21963672 [0,1,0,0,0,0|2,0,0]=3 1087 B11R1.1 OCCCc1ccc(Cl)nn1 Amb28281925 [0,1,0,0,0,0|3,0,0]=4 1088 B11R1.1 OCCCc1ccc(F)cc1 Amb17089497 [0,1,0,0,0,0|1,0,0]=2 1089 B11R1.1 OCCCc1ccc(F)cn1 Amb33315556 [0,1,0,0,0,0|2,0,0]=3 1090 B11R1.1 OCCCc1ccc(F)nc1 Amb24085299 [0,1,0,0,0,0|2,0,0]=3 1091 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|1,0,0]=2 1092 B11R1.1 OCCCc1ccc(I)cn1 Amb27193498 [0,1,0,0,0,0|2,0,0]=3 1093 B11R1.1 OCCCc1ccc(O)cc1 Amb9825857 [0,1,0,0,0,0|1,0,0]=2 1094 B11R1.1 OCCCc1cnc(S)nc1 Amb22394982 [0,1,0,0,0,0|3,0,0]=4 1095 B11R1.1 OCCCc1ncc(Br)cn1 Amb33335102 [0,1,0,0,0,0|3,0,0]=4 1096 B11R1.1 OCCCc1ncc(S)cn1 Amb1971490 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.1 OCCNc1ccc(Br)cc1 Amb6712224 [0,1,0,0,0,0|1,0,0]=2 1098 B11R1.1 OCCNc1ccc(Br)cn1 Amb6649055 [0,1,0,0,0,0|2,0,0]=3 1099 B11R1.1 OCCNc1ccc(Cl)cc1 Amb6711989 [0,1,0,0,0,0|1,0,0]=2 1100 B11R1.1 OCCNc1ccc(Cl)cn1 Amb6641858 [0,1,0,0,0,0|2,0,0]=3 1101 B11R1.1 OCCNc1ccc(Cl)nn1 Amb843110 [0,1,0,0,0,0|3,0,0]=4 1102 B11R1.1 OCCNc1ccc(F)cc1 Amb6712341 [0,1,0,0,0,0|1,0,0]=2 1103 B11R1.1 OCCNc1ccc(F)cn1 Amb18975393 [0,1,0,0,0,0|2,0,0]=3 1104 B11R1.1 OCCNc1ccc(I)cc1 Amb7785103 [0,1,0,0,0,0|1,0,0]=2 1105 B11R1.1 OCCNc1ccc(O)cc1 Amb2697158 [0,1,0,0,0,0|1,0,0]=2 1106 B11R1.1 OCCNc1ncc(Br)cn1 Amb22233773 [0,1,0,0,0,0|3,0,0]=4 1107 B11R1.1 OCCOc1ccc(Br)cc1 Amb3939111 [0,1,0,0,0,0|0,0,0]=1 1108 B11R1.1 OCCOc1ccc(Br)cn1 Amb19515691 [0,1,0,0,0,0|1,0,0]=2 1109 B11R1.1 OCCOc1ccc(Cl)cc1 Amb2209356 [0,1,0,0,0,0|0,0,0]=1 1110 B11R1.1 OCCOc1ccc(Cl)cn1 Amb23598439 [0,1,0,0,0,0|1,0,0]=2 1111 B11R1.1 OCCOc1ccc(Cl)nn1 Amb6681175 [0,1,0,0,0,0|2,0,0]=3 1112 B11R1.1 OCCOc1ccc(F)cc1 Amb9370676 [0,1,0,0,0,0|0,0,0]=1 1113 B11R1.1 OCCOc1ccc(I)cc1 Amb9247649 [0,1,0,0,0,0|0,0,0]=1 1114 B11R1.1 OCCOc1ccc(O)cc1 Amb33528799 [0,1,0,0,0,0|0,0,0]=1 1115 B11R1.1 OCCSc1ccc(Br)cc1 Amb9247642 [0,1,0,0,0,0|0,1,0]=2 1116 B11R1.1 OCCSc1ccc(Cl)cc1 Amb3939208 [0,1,0,0,0,0|0,1,0]=2 1117 B11R1.1 OCCSc1ccc(Cl)cn1 Amb2722741 [0,1,0,0,0,0|1,1,0]=3 1118 B11R1.1 OCCSc1ccc(Cl)nn1 Amb9238467 [0,1,0,0,0,0|2,1,0]=4 1119 B11R1.1 OCCSc1cnc(Br)cn1 Amb27761852 [0,1,0,0,0,0|2,1,0]=4 1120 B11R1.1 OCCSc1ncc(Br)cn1 Amb27459943 [0,1,0,0,0,0|2,1,0]=4 1121 B11R1.1 OCCSc1ncc(F)cn1 Amb27836138 [0,1,0,0,0,0|2,1,0]=4 1122 B11R1.1 OC\C=C\c1ccc(Br)cc1 Amb5559245 [0,1,0,0,0,0|1,0,1]=3 1123 B11R1.1 OC\C=C\c1ccc(Br)nc1 Amb33388370 [0,1,0,0,0,0|2,0,1]=4 1124 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [0,1,0,0,0,0|1,0,1]=3 1125 B11R1.1 OC\C=C\c1ccc(Cl)nc1 Amb27980589 [0,1,0,0,0,0|2,0,1]=4 1126 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [0,1,0,0,0,0|1,0,1]=3 1127 B11R1.1 OC\C=C\c1ccc(F)cn1 Amb33317353 [0,1,0,0,0,0|2,0,1]=4 1128 B11R1.1 OC\C=C\c1ccc(F)nc1 Amb33425603 [0,1,0,0,0,0|2,0,1]=4 1129 B11R1.1 OC\C=C\c1ccc(O)cc1 Amb2445151 [0,1,0,0,0,0|1,0,1]=3 1130 B11R1.1 ONCCc1ccc(O)cc1 Amb27409616 [0,1,0,0,0,0|2,0,0]=3 1131 B11R1.1 O\N=C/Cc1ccc(O)cc1 Amb27833768 [0,1,0,0,0,0|2,0,1]=4 1132 B11R1.1 O\N=C\Cc1ccc(O)cc1 Amb25705671 [0,1,0,0,0,0|2,0,1]=4 1133 B11R1.1 O\N=C\Nc1ccc(Cl)cc1 Amb27606304 [0,1,0,0,0,0|2,0,1]=4 1134 B11R1.1 Oc1ccc(C#CCBr)cc1 Amb27617354 [0,1,0,0,0,0|2,0,1]=4 1135 B11R1.1 Oc1ccc(C#CCI)cc1 Amb25341074 [0,1,0,0,0,0|2,0,1]=4 1136 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|2,0,0]=3 1137 B11R1.1 Oc1ccc(CCCCl)cc1 Amb17477722 [0,1,0,0,0,0|2,0,0]=3 1138 B11R1.1 Oc1ccc(CCCS)cc1 Amb26880425 [0,1,0,0,0,0|1,1,0]=3 1139 B11R1.1 Oc1ccc(NCCF)cc1 Amb28070962 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.1 Oc1ccc(OCCBr)cc1 Amb8393912 [0,1,0,0,0,0|1,0,0]=2 1141 B11R1.1 Oc1ccc(OCCCl)cc1 Amb18126982 [0,1,0,0,0,0|1,0,0]=2 1142 B11R1.1 SCCCc1ccc(Br)cc1 Amb17407562 [0,1,0,0,0,0|1,1,0]=3 1143 B11R1.1 SCCCc1ccc(Br)cn1 Amb33477445 [0,1,0,0,0,0|2,1,0]=4 1144 B11R1.1 SCCCc1ccc(Br)nc1 Amb33389191 [0,1,0,0,0,0|2,1,0]=4 1145 B11R1.1 SCCCc1ccc(Cl)cc1 Amb17401097 [0,1,0,0,0,0|1,1,0]=3 1146 B11R1.1 SCCCc1ccc(Cl)cn1 Amb33058851 [0,1,0,0,0,0|2,1,0]=4 1147 B11R1.1 SCCCc1ccc(Cl)nc1 Amb33261724 [0,1,0,0,0,0|2,1,0]=4 1148 B11R1.1 SCCOc1ccc(Br)cc1 Amb6255894 [0,1,0,0,0,0|0,1,0]=2 1149 B11R1.1 SCCOc1ccc(Cl)cc1 Amb6255692 [0,1,0,0,0,0|0,1,0]=2 1150 B11R1.1 SCCOc1ccc(I)cc1 Amb27197400 [0,1,0,0,0,0|0,1,0]=2 1151 B11R1.1 SCCSc1ccc(Br)cc1 Amb28206773 [0,1,0,0,0,0|0,2,0]=3 1152 B11R1.1 SCCSc1ccc(Br)cn1 Amb28182483 [0,1,0,0,0,0|1,2,0]=4 1153 B11R1.1 SCCSc1ccc(Cl)cc1 Amb13881736 [0,1,0,0,0,0|0,2,0]=3 1154 B11R1.1 Sc1ccc(CCCCl)cc1 Amb27233376 [0,1,0,0,0,0|2,0,0]=3 1155 B11R1.1 [C-]#[N+]CCc1ccc(Br)cc1 Amb2685409 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.1 [C-]#[N+]CCc1ccc(C)cc1 Amb33203684 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.1 [C-]#[N+]CCc1ccc(Cl)cc1 Amb2686346 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.1 [C-]#[N+]CCc1ccc(F)cc1 Amb2688287 [0,1,0,0,0,0|3,0,0]=4 1159 B11R1.1 [O-][n+]1ccc(CCCCl)cc1 Amb27963925 [0,1,0,0,0,0|3,0,0]=4 1160 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,0]=3 1161 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.16 C#CCC(Br)c1ccccc1 Amb27841700 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.16 C#CCC(C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|2,0,1]=4 1164 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|2,0,1]=4 1165 B11R1.16 C#CCC(N)c1ccccc1 Amb6752054 [0,1,0,0,0,0|2,0,1]=4 1166 B11R1.16 C#CCC(O)c1ccccc1 Amb2721611 [0,1,0,0,0,0|2,0,1]=4 1167 B11R1.16 C#CCN(C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|2,0,1]=4 1168 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb28423448 [0,1,0,0,0,0|2,0,1]=4 1169 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb33871477 [0,1,0,0,0,0|2,0,1]=4 1170 B11R1.16 C=C(CCBr)c1ccccc1 Amb27646402 [0,1,0,0,0,0|2,0,0]=3 1171 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,1,0,0,0,0|2,0,0]=3 1172 B11R1.16 C=C(CCCl)c1ccccc1 Amb28120007 [0,1,0,0,0,0|2,0,0]=3 1173 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,1,0,0,0,0|2,0,0]=3 1174 B11R1.16 C=C(CCN)c1ccccn1 Amb33360278 [0,1,0,0,0,0|3,0,0]=4 1175 B11R1.16 C=C(CCN)c1cccnc1 Amb33360412 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.16 C=C(CCN)c1ccncc1 Amb33380624 [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|2,0,1]=4 1180 B11R1.16 C=CCC(Cl)c1ccccc1 Amb27232993 [0,1,0,0,0,0|2,0,1]=4 1181 B11R1.16 C=CCC(N)c1ccccc1 Amb17226687 [0,1,0,0,0,0|2,0,1]=4 1182 B11R1.16 C=CCC(O)c1ccccc1 Amb2389146 [0,1,0,0,0,0|2,0,1]=4 1183 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|1,1,1]=4 1184 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|2,0,1]=4 1185 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|2,0,1]=4 1186 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|2,0,1]=4 1187 B11R1.16 C=CC[C@H](N)c1ccccc1 Amb27253729 [0,1,0,0,0,0|2,0,1]=4 1188 B11R1.16 C=CC[C@H](O)c1ccccc1 Amb8392356 [0,1,0,0,0,0|2,0,1]=4 1189 B11R1.16 CC(CC#N)c1ccccc1 Amb17593643 [0,1,0,0,0,0|2,0,1]=4 1190 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [0,1,0,0,0,0|1,0,2]=4 1191 B11R1.16 CC(CCBr)c1ccccc1 Amb857802 [0,1,0,0,0,0|2,0,0]=3 1192 B11R1.16 CC(CCCl)c1ccccc1 Amb17232691 [0,1,0,0,0,0|2,0,0]=3 1193 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|2,0,0]=3 1194 B11R1.16 CC(CCN)c1ccccc1 Amb5739006 [0,1,0,0,0,0|2,0,0]=3 1195 B11R1.16 CC(CCN)c1ccccn1 Amb18981390 [0,1,0,0,0,0|3,0,0]=4 1196 B11R1.16 CC(CCN)c1cccnc1 Amb18293554 [0,1,0,0,0,0|3,0,0]=4 1197 B11R1.16 CC(CCN)c1ccncc1 Amb18293553 [0,1,0,0,0,0|3,0,0]=4 1198 B11R1.16 CC(CCN)c1ccncc1 Amb32652118 [0,1,0,0,0,0|3,0,0]=4 1199 B11R1.16 CC(CCO)c1ccccc1 Amb3938966 [0,1,0,0,0,0|1,0,0]=2 1200 B11R1.16 CC(CCO)c1ccncc1 Amb2694520 [0,1,0,0,0,0|2,0,0]=3 1201 B11R1.16 CC(CCS)c1ccccc1 Amb25866017 [0,1,0,0,0,0|1,1,0]=3 1202 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|3,0,0]=4 1203 B11R1.16 CC(CNO)c1ccccc1 Amb26657287 [0,1,0,0,0,0|2,0,0]=3 1204 B11R1.16 CC(CON)c1ccccc1 Amb28144909 [0,1,0,0,0,0|3,0,0]=4 1205 B11R1.16 CC(NCO)c1ccccc1 Amb27403352 [0,1,0,0,0,0|2,0,0]=3 1206 B11R1.16 CC(OCCl)c1ccccc1 Amb27852517 [0,1,0,0,0,0|3,0,0]=4 1207 B11R1.16 CC(\C=N\O)c1ccccc1 Amb4018201 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,1,0,0,0,0|2,0,0]=3 1209 B11R1.16 CCCC(=O)c1ccccn1 Amb6301471 [0,1,0,0,0,0|3,0,0]=4 1210 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,1,0,0,0,0|3,0,0]=4 1211 B11R1.16 CCCC(=O)c1ccncc1 Amb22235246 [0,1,0,0,0,0|3,0,0]=4 1212 B11R1.16 CCCC(Br)c1ccccc1 Amb8835450 [0,1,0,0,0,0|2,0,0]=3 1213 B11R1.16 CCCC(Br)c1ccccn1 Amb25675709 [0,1,0,0,0,0|3,0,0]=4 1214 B11R1.16 CCCC(C)c1ccccc1 Amb4017935 [0,1,0,0,0,0|2,0,0]=3 1215 B11R1.16 CCCC(Cl)c1ccccc1 Amb7766848 [0,1,0,0,0,0|2,0,0]=3 1216 B11R1.16 CCCC(N)c1ccccc1 Amb8503301 [0,1,0,0,0,0|2,0,0]=3 1217 B11R1.16 CCCC(N)c1ccccc1 Amb9729508 [0,1,0,0,0,0|2,0,0]=3 1218 B11R1.16 CCCC(N)c1ccccn1 Amb18984959 [0,1,0,0,0,0|3,0,0]=4 1219 B11R1.16 CCCC(N)c1cccnc1 Amb18984960 [0,1,0,0,0,0|3,0,0]=4 1220 B11R1.16 CCCC(N)c1ccncc1 Amb18984961 [0,1,0,0,0,0|3,0,0]=4 1221 B11R1.16 CCCC(N)c1ccncc1 Amb30982091 [0,1,0,0,0,0|3,0,0]=4 1222 B11R1.16 CCCC(O)c1ccccc1 Amb9748221 [0,1,0,0,0,0|2,0,0]=3 1223 B11R1.16 CCCC(O)c1ccccn1 Amb18179397 [0,1,0,0,0,0|3,0,0]=4 1224 B11R1.16 CCCC(O)c1cccnc1 Amb17232090 [0,1,0,0,0,0|3,0,0]=4 1225 B11R1.16 CCCC(S)c1ccccc1 Amb9208055 [0,1,0,0,0,0|2,0,0]=3 1226 B11R1.16 CCCN(C)c1ccccc1 Amb27176635 [0,1,0,0,0,0|2,0,0]=3 1227 B11R1.16 CCCN(C)c1ccncc1 Amb27176636 [0,1,0,0,0,0|3,0,0]=4 1228 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [0,1,0,0,0,0|1,1,0]=3 1229 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb16233791 [0,1,0,0,0,0|2,0,0]=3 1230 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|2,0,0]=3 1231 B11R1.16 CCC[C@@H](O)c1cccnc1 Amb28069903 [0,1,0,0,0,0|3,0,0]=4 1232 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|2,0,0]=3 1233 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|2,0,0]=3 1234 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|2,0,0]=3 1235 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,1,0,0,0,0|3,0,0]=4 1237 B11R1.16 CCNC(C)c1ccccc1 Amb1771733 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.16 CCNC(C)c1ccccc1 Amb6537886 [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.16 CCNS(=O)c1ccccc1 Amb27261568 [0,1,0,0,0,0|2,1,0]=4 1240 B11R1.16 CCN[C@@H](C)c1ccccc1 Amb27175162 [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,1,0,0,0,0|3,0,0]=4 1242 B11R1.16 CCOC(=N)c1ccccc1 Amb33527262 [0,1,0,0,0,0|3,0,0]=4 1243 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb5720188 [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,0,0,0,0|3,0,0]=4 1246 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.16 CCON(C)c1ccccc1 Amb27234596 [0,1,0,0,0,0|3,0,0]=4 1248 B11R1.16 CCO[PH](=O)c1ccccc1 Amb10601587 [0,1,0,0,0,0|3,0,0]=4 1249 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,1,0,0,0,0|3,0,0]=4 1250 B11R1.16 CCSC(C)c1ccccc1 Amb28145240 [0,1,0,0,0,0|3,0,0]=4 1251 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [0,1,0,0,0,0|2,0,1]=4 1252 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [0,1,0,0,0,0|2,0,1]=4 1253 B11R1.16 CC\[S+]=C(/N)c1ccccc1 Amb27236829 [0,1,0,0,0,0|3,0,0]=4 1254 B11R1.16 CN(CC#N)c1ccccc1 Amb5781397 [0,1,0,0,0,0|2,0,1]=4 1255 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|2,0,0]=3 1256 B11R1.16 CN(CCBr)c1ccncc1 Amb28240010 [0,1,0,0,0,0|3,0,0]=4 1257 B11R1.16 CN(CCCl)c1ccccc1 Amb17334788 [0,1,0,0,0,0|2,0,0]=3 1258 B11R1.16 CN(CCI)c1ccccc1 Amb28138218 [0,1,0,0,0,0|2,0,0]=3 1259 B11R1.16 CN(CCN)c1ccccc1 Amb13949227 [0,1,0,0,0,0|2,0,0]=3 1260 B11R1.16 CN(CCN)c1ccccc1 Amb2371516 [0,1,0,0,0,0|2,0,0]=3 1261 B11R1.16 CN(CCN)c1ccccc1 Amb59983 [0,1,0,0,0,0|2,0,0]=3 1262 B11R1.16 CN(CCN)c1ccccn1 Amb18302344 [0,1,0,0,0,0|3,0,0]=4 1263 B11R1.16 CN(CCN)c1ccccn1 Amb31188270 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.16 CN(CCO)c1cccc[nH+]1 Amb33512959 [0,1,0,0,0,0|2,0,0]=3 1265 B11R1.16 CN(CCO)c1ccccc1 Amb2720819 [0,1,0,0,0,0|1,0,0]=2 1266 B11R1.16 CN(CCO)c1ccccn1 Amb2445428 [0,1,0,0,0,0|2,0,0]=3 1267 B11R1.16 CN(CCO)c1cccnn1 Amb18182850 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.16 CN(CCO)c1ccncc1 Amb18179433 [0,1,0,0,0,0|2,0,0]=3 1269 B11R1.16 CN(CCO)c1ccncc1 Amb19373596 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.16 CN(CCO)c1cnccn1 Amb2445427 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.16 CN(CCO)c1ncccn1 Amb18182843 [0,1,0,0,0,0|3,0,0]=4 1272 B11R1.16 CN(CCS)c1ccccc1 Amb13881732 [0,1,0,0,0,0|1,1,0]=3 1273 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,1,0,0,0,0|3,0,0]=4 1274 B11R1.16 CNCC(C)c1ccccc1 Amb17619365 [0,1,0,0,0,0|3,0,0]=4 1275 B11R1.16 CNCC(C)c1ccccc1 Amb6355911 [0,1,0,0,0,0|3,0,0]=4 1276 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|3,0,0]=4 1277 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|3,0,0]=4 1278 B11R1.16 CNCC(O)c1ccccc1 Amb32405137 [0,1,0,0,0,0|3,0,0]=4 1279 B11R1.16 CNCC(O)c1ccccc1 Amb3939362 [0,1,0,0,0,0|3,0,0]=4 1280 B11R1.16 CNC[C@@H](C)c1ccccc1 Amb27253876 [0,1,0,0,0,0|3,0,0]=4 1281 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,1,0,0,0,0|3,0,0]=4 1282 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [0,1,0,0,0,0|3,0,0]=4 1283 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [0,1,0,0,0,0|3,0,0]=4 1284 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [0,1,0,0,0,0|3,0,0]=4 1285 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|3,0,0]=4 1286 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [0,1,0,0,0,0|3,0,0]=4 1288 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.16 CP(CC=O)c1ccccc1 Amb28241337 [0,1,0,0,0,0|1,0,2]=4 1291 B11R1.16 CP(CCCl)c1ccccc1 Amb28239778 [0,1,0,0,0,0|2,0,0]=3 1292 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,1,0,0,0,0|3,0,0]=4 1293 B11R1.16 CSCC(Cl)c1ccccc1 Amb27272993 [0,1,0,0,0,0|3,0,0]=4 1294 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|3,0,0]=4 1295 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|3,0,0]=4 1296 B11R1.16 CSC[C@H](N)c1ccccc1 Amb28397956 [0,1,0,0,0,0|3,0,0]=4 1297 B11R1.16 CSC[C@H](O)c1ccccc1 Amb28077783 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [0,1,0,0,0,0|1,0,2]=4 1299 B11R1.16 C[C@@H](CCN)c1ccccc1 Amb28285355 [0,1,0,0,0,0|2,0,0]=3 1300 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|1,0,0]=2 1301 B11R1.16 C\C(=C/CBr)c1ccccc1 Amb28384582 [0,1,0,0,0,0|2,0,1]=4 1302 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [0,1,0,0,0,0|2,0,1]=4 1303 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [0,1,0,0,0,0|1,0,1]=3 1304 B11R1.16 C\C(=C/CO)c1ccccn1 Amb24373086 [0,1,0,0,0,0|2,0,1]=4 1305 B11R1.16 C\C(=C\CO)c1cccnc1 Amb27191760 [0,1,0,0,0,0|2,0,1]=4 1306 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,0]=3 1307 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,0]=3 1308 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|2,0,1]=4 1309 B11R1.16 N#CCC(N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|2,0,1]=4 1310 B11R1.16 N#CCC(N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|2,0,1]=4 1311 B11R1.16 N#CCC(N)c1ccccc1 Amb33068991 [0,1,0,0,0,0|2,0,1]=4 1312 B11R1.16 N#CCC(O)c1ccccc1 Amb4407013 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,1,0,0,0,0|1,1,1]=4 1314 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb26346763 [0,1,0,0,0,0|2,0,1]=4 1315 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb32653409 [0,1,0,0,0,0|2,0,1]=4 1316 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb33212393 [0,1,0,0,0,0|2,0,1]=4 1317 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|2,0,1]=4 1318 B11R1.16 N#CC[C@H](N)c1ccccc1 Amb28398545 [0,1,0,0,0,0|2,0,1]=4 1319 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|2,0,1]=4 1320 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [0,1,0,0,0,0|1,0,2]=4 1321 B11R1.16 NC(CCCl)c1ccccc1 Amb27247405 [0,1,0,0,0,0|2,0,0]=3 1322 B11R1.16 NC(CCO)c1ccccc1 Amb1993953 [0,1,0,0,0,0|1,0,0]=2 1323 B11R1.16 NC(CCO)c1ccccn1 Amb18120551 [0,1,0,0,0,0|2,0,0]=3 1324 B11R1.16 NC(CCO)c1cccnc1 Amb2697495 [0,1,0,0,0,0|2,0,0]=3 1325 B11R1.16 NC(CCO)c1ccncc1 Amb2694579 [0,1,0,0,0,0|2,0,0]=3 1326 B11R1.16 NC(CCO)c1ccncc1 Amb28652905 [0,1,0,0,0,0|2,0,0]=3 1327 B11R1.16 NC(CCO)c1ccncn1 Amb25093068 [0,1,0,0,0,0|3,0,0]=4 1328 B11R1.16 NC(CCO)c1cnccn1 Amb22296969 [0,1,0,0,0,0|3,0,0]=4 1329 B11R1.16 NC(CCO)c1cncnc1 Amb27436559 [0,1,0,0,0,0|3,0,0]=4 1330 B11R1.16 NC(CCO)c1ncccn1 Amb33271428 [0,1,0,0,0,0|3,0,0]=4 1331 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.16 NCCC(=O)c1ccccn1 Amb18121375 [0,1,0,0,0,0|3,0,0]=4 1333 B11R1.16 NCCC(=O)c1cccnc1 Amb18121496 [0,1,0,0,0,0|3,0,0]=4 1334 B11R1.16 NCCC(=O)c1ccncc1 Amb18639595 [0,1,0,0,0,0|3,0,0]=4 1335 B11R1.16 NCCC(Br)c1ccccc1 Amb27643497 [0,1,0,0,0,0|2,0,0]=3 1336 B11R1.16 NCCC(F)c1ccccc1 Amb27760515 [0,1,0,0,0,0|2,0,0]=3 1337 B11R1.16 NCCC(F)c1ccccn1 Amb33360782 [0,1,0,0,0,0|3,0,0]=4 1338 B11R1.16 NCCC(F)c1cccnc1 Amb25936622 [0,1,0,0,0,0|3,0,0]=4 1339 B11R1.16 NCCC(F)c1ccncc1 Amb25329368 [0,1,0,0,0,0|3,0,0]=4 1340 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|2,0,0]=3 1341 B11R1.16 NCCC(N)c1cccnc1 Amb27489008 [0,1,0,0,0,0|3,0,0]=4 1342 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|2,0,0]=3 1343 B11R1.16 NCCC(O)c1ccccc1 Amb9782359 [0,1,0,0,0,0|2,0,0]=3 1344 B11R1.16 NCCC(O)c1ccccn1 Amb18121017 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.16 NCCC(O)c1cccnc1 Amb18639338 [0,1,0,0,0,0|3,0,0]=4 1346 B11R1.16 NCCC(O)c1ccncc1 Amb18121042 [0,1,0,0,0,0|3,0,0]=4 1347 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|1,1,0]=3 1348 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|1,1,0]=3 1349 B11R1.16 NCC[C@@H](N)c1ccncc1 Amb27205112 [0,1,0,0,0,0|3,0,0]=4 1350 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|2,0,0]=3 1351 B11R1.16 NCC[C@@H](O)c1ccccn1 Amb33360784 [0,1,0,0,0,0|3,0,0]=4 1352 B11R1.16 NCC[C@@H](O)c1cccnc1 Amb33360063 [0,1,0,0,0,0|3,0,0]=4 1353 B11R1.16 NCC[C@@H](O)c1ccncc1 Amb33225169 [0,1,0,0,0,0|3,0,0]=4 1354 B11R1.16 NCC[C@H](N)c1cccnc1 Amb27205253 [0,1,0,0,0,0|3,0,0]=4 1355 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|2,0,0]=3 1356 B11R1.16 NCC[C@H](O)c1ccccn1 Amb33360783 [0,1,0,0,0,0|3,0,0]=4 1357 B11R1.16 NCC[C@H](O)c1cccnc1 Amb33360062 [0,1,0,0,0,0|3,0,0]=4 1358 B11R1.16 NCC[C@H](O)c1ccncc1 Amb33380660 [0,1,0,0,0,0|3,0,0]=4 1359 B11R1.16 NN(CCO)c1ccccn1 Amb27656570 [0,1,0,0,0,0|2,0,0]=3 1360 B11R1.16 NN(CCO)c1ncccn1 Amb27752348 [0,1,0,0,0,0|3,0,0]=4 1361 B11R1.16 NNCC(O)c1ccccc1 Amb17232104 [0,1,0,0,0,0|3,0,0]=4 1362 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,1,0,0,0,0|3,0,0]=4 1363 B11R1.16 NOCC(O)c1ccccc1 Amb17334342 [0,1,0,0,0,0|3,0,0]=4 1364 B11R1.16 N[C@@H](CCO)c1ccccc1 Amb8384290 [0,1,0,0,0,0|1,0,0]=2 1365 B11R1.16 N[C@@H](CCO)c1ccccn1 Amb28457255 [0,1,0,0,0,0|2,0,0]=3 1366 B11R1.16 N[C@@H](CCO)c1cccnc1 Amb26920229 [0,1,0,0,0,0|2,0,0]=3 1367 B11R1.16 N[C@@H](CCO)c1ccncc1 Amb25131721 [0,1,0,0,0,0|2,0,0]=3 1368 B11R1.16 N[C@@H](CCO)c1cnccn1 Amb27654624 [0,1,0,0,0,0|3,0,0]=4 1369 B11R1.16 N[C@@H](CCO)c1cncnc1 Amb28383505 [0,1,0,0,0,0|3,0,0]=4 1370 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|1,0,0]=2 1371 B11R1.16 N[C@H](CCO)c1ccccc1 Amb8397180 [0,1,0,0,0,0|1,0,0]=2 1372 B11R1.16 N[C@H](CCO)c1ccccn1 Amb25789774 [0,1,0,0,0,0|2,0,0]=3 1373 B11R1.16 N[C@H](CCO)c1cccnc1 Amb26505375 [0,1,0,0,0,0|2,0,0]=3 1374 B11R1.16 N[C@H](CCO)c1cccnc1 Amb33803480 [0,1,0,0,0,0|2,0,0]=3 1375 B11R1.16 N[C@H](CCO)c1ccncc1 Amb25843798 [0,1,0,0,0,0|2,0,0]=3 1376 B11R1.16 N[C@H](CCO)c1ncccn1 Amb32716227 [0,1,0,0,0,0|3,0,0]=4 1377 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,1,0,0,0,0|2,0,0]=3 1378 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,1,0,0,0,0|2,0,0]=3 1379 B11R1.16 O=C(CCCl)c1ccncc1 Amb24117884 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,1,0,0,0,0|1,0,0]=2 1381 B11R1.16 O=C(CCO)c1ccccn1 Amb26484243 [0,1,0,0,0,0|2,0,0]=3 1382 B11R1.16 O=C(CCO)c1cccnc1 Amb26017511 [0,1,0,0,0,0|2,0,0]=3 1383 B11R1.16 O=C(CCO)c1ccncc1 Amb24544067 [0,1,0,0,0,0|2,0,0]=3 1384 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,1,0,0,0,0|1,1,0]=3 1385 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,1,0,0,0,0|2,0,0]=3 1387 B11R1.16 O=C(NCO)c1cccnc1 Amb6358137 [0,1,0,0,0,0|3,0,0]=4 1388 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.16 O=C(OCF)c1ccccc1 Amb27485928 [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,1,0,0,0,0|3,0,0]=4 1391 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,1,0,0,0,0|2,0,0]=3 1392 B11R1.16 O=C(SCCl)c1ccccc1 Amb28458380 [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,1,0,0,0,0|2,0,1]=4 1394 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,1,0,0,0,0|1,0,2]=4 1395 B11R1.16 O=S(CCCl)c1ccccc1 Amb9158149 [0,1,0,0,0,0|1,1,0]=3 1396 B11R1.16 O=S(CCO)c1ccccc1 Amb27411411 [0,1,0,0,0,0|0,1,0]=2 1397 B11R1.16 OC(CCBr)c1ccccc1 Amb26365753 [0,1,0,0,0,0|2,0,0]=3 1398 B11R1.16 OC(CCCl)c1ccccc1 Amb17611064 [0,1,0,0,0,0|2,0,0]=3 1399 B11R1.16 OCCC(Cl)c1ccccc1 Amb27823326 [0,1,0,0,0,0|1,0,0]=2 1400 B11R1.16 OCCC(F)c1ccccc1 Amb28460703 [0,1,0,0,0,0|1,0,0]=2 1401 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|1,0,0]=2 1402 B11R1.16 OCCC(O)c1ccccn1 Amb22756156 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.16 OCCC(O)c1cccnc1 Amb27257189 [0,1,0,0,0,0|2,0,0]=3 1404 B11R1.16 OCCC(O)c1ccncc1 Amb25760239 [0,1,0,0,0,0|2,0,0]=3 1405 B11R1.16 OCCC(O)c1cnccn1 Amb22298360 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [0,1,0,0,0,0|1,0,0]=2 1407 B11R1.16 OCC[C@@H](O)c1ccncc1 Amb27668896 [0,1,0,0,0,0|2,0,0]=3 1408 B11R1.16 OCC[C@H](O)c1ccccn1 Amb27394769 [0,1,0,0,0,0|2,0,0]=3 1409 B11R1.16 OCOB(O)c1ccccc1 Amb33512956 [0,1,0,0,0,0|2,0,0]=3 1410 B11R1.16 OC\C=C(\Br)c1ccccc1 Amb28284946 [0,1,0,0,0,0|1,0,1]=3 1411 B11R1.16 ONCC(O)c1ccccc1 Amb4009046 [0,1,0,0,0,0|2,0,0]=3 1412 B11R1.16 ONCC(O)c1ccccn1 Amb17334345 [0,1,0,0,0,0|3,0,0]=4 1413 B11R1.16 ONCC(O)c1cccnc1 Amb17334346 [0,1,0,0,0,0|3,0,0]=4 1414 B11R1.16 ONCC(O)c1ccncc1 Amb17334347 [0,1,0,0,0,0|3,0,0]=4 1415 B11R1.16 O[C@@H](CCCl)c1ccccc1 Amb17611058 [0,1,0,0,0,0|2,0,0]=3 1416 B11R1.16 O[C@H](CCBr)c1ccccc1 Amb27437857 [0,1,0,0,0,0|2,0,0]=3 1417 B11R1.16 O[C@H](CCCl)c1ccccc1 Amb2779830 [0,1,0,0,0,0|2,0,0]=3 1418 B11R1.16 O[C@H](CCI)c1ccccc1 Amb27603615 [0,1,0,0,0,0|2,0,0]=3 1419 B11R1.16 [C-]#[N+]CC(C)c1ccccc1 Amb2684685 [0,1,0,0,0,0|3,0,0]=4 1420 B11R1.16 [C-]#[N+]CC(F)c1ccccc1 Amb27441196 [0,1,0,0,0,0|3,0,0]=4 1421 B11R1.17 BrCC#Cc1ccccc1Br Amb25891657 [0,1,0,0,0,0|2,0,1]=4 1422 B11R1.17 BrCC#Cc1ccccc1I Amb28284901 [0,1,0,0,0,0|2,0,1]=4 1423 B11R1.17 BrCCCc1ccccc1Br Amb26341120 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.17 BrCCCc1cccnc1Br Amb33388172 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.17 BrCCCc1ccncc1Br Amb24416596 [0,1,0,0,0,0|3,0,0]=4 1426 B11R1.17 BrCCCc1ncccc1Br Amb26654973 [0,1,0,0,0,0|3,0,0]=4 1427 B11R1.17 BrCCOc1ccccc1Br Amb6280497 [0,1,0,0,0,0|1,0,0]=2 1428 B11R1.17 BrCCOc1cccnc1Br Amb32988374 [0,1,0,0,0,0|2,0,0]=3 1429 B11R1.17 BrCCSc1ncccc1Br Amb27754896 [0,1,0,0,0,0|2,1,0]=4 1430 B11R1.17 C#CCCc1ccccc1Br Amb3991957 [0,1,0,0,0,0|2,0,1]=4 1431 B11R1.17 C#CCCc1ccccc1C Amb18636111 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.17 C#CCCc1ccccc1O Amb28253821 [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.17 C#CCNc1ccccc1F Amb27441677 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.17 C#CCNc1ccccc1I Amb27597826 [0,1,0,0,0,0|2,0,1]=4 1437 B11R1.17 C#CCOc1ccccc1Br Amb6263893 [0,1,0,0,0,0|1,0,1]=3 1438 B11R1.17 C#CCOc1ccccc1C Amb19373366 [0,1,0,0,0,0|1,0,1]=3 1439 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,1,0,0,0,0|1,0,1]=3 1440 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,1,0,0,0,0|1,0,1]=3 1441 B11R1.17 C#CCOc1ccccc1I Amb27217813 [0,1,0,0,0,0|1,0,1]=3 1442 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,1,0,0,0,0|1,0,1]=3 1443 B11R1.17 C#CCOc1ccccc1N Amb8389695 [0,1,0,0,0,0|1,0,1]=3 1444 B11R1.17 C#CCOc1ccccc1O Amb8837375 [0,1,0,0,0,0|1,0,1]=3 1445 B11R1.17 C#CCOc1cccnc1Br Amb22642319 [0,1,0,0,0,0|2,0,1]=4 1446 B11R1.17 C#CCOc1ccncc1Br Amb26343092 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.17 C#CCOc1ccncc1Cl Amb32641603 [0,1,0,0,0,0|2,0,1]=4 1448 B11R1.17 C#CCOc1ccncc1I Amb32641605 [0,1,0,0,0,0|2,0,1]=4 1449 B11R1.17 C#CCOc1ncccc1Br Amb28074465 [0,1,0,0,0,0|2,0,1]=4 1450 B11R1.17 C#CCOc1ncccc1Cl Amb32641604 [0,1,0,0,0,0|2,0,1]=4 1451 B11R1.17 C#CCOc1ncccc1N Amb27872897 [0,1,0,0,0,0|2,0,1]=4 1452 B11R1.17 C#CCSc1ccccc1Br Amb28312974 [0,1,0,0,0,0|1,1,1]=4 1453 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,1,0,0,0,0|1,1,1]=4 1454 B11R1.17 C#CCSc1ccccc1N Amb6275344 [0,1,0,0,0,0|1,1,1]=4 1455 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|2,0,1]=4 1456 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|2,0,1]=4 1457 B11R1.17 C=CCNc1ccccc1C Amb4035723 [0,1,0,0,0,0|2,0,1]=4 1458 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|2,0,1]=4 1459 B11R1.17 C=CCNc1ccccc1I Amb28285324 [0,1,0,0,0,0|2,0,1]=4 1460 B11R1.17 C=CCNc1ccccc1S Amb27870731 [0,1,0,0,0,0|2,0,1]=4 1461 B11R1.17 C=CCOC1=CC=CNC1=O Amb18034612 [0,1,0,0,0,0|2,0,1]=4 1462 B11R1.17 C=CCOC1=COC=CC1=O Amb28253799 [0,1,0,0,0,0|2,0,1]=4 1463 B11R1.17 C=CCON1C=CC=CC1=O Amb22364567 [0,1,0,0,0,0|2,0,1]=4 1464 B11R1.17 C=CCOc1ccccc1Br Amb4422143 [0,1,0,0,0,0|1,0,1]=3 1465 B11R1.17 C=CCOc1ccccc1C Amb2721161 [0,1,0,0,0,0|1,0,1]=3 1466 B11R1.17 C=CCOc1ccccc1Cl Amb3940570 [0,1,0,0,0,0|1,0,1]=3 1467 B11R1.17 C=CCOc1ccccc1F Amb2688315 [0,1,0,0,0,0|1,0,1]=3 1468 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|1,0,1]=3 1469 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|1,0,1]=3 1470 B11R1.17 C=CCOc1ccccc1N Amb2721826 [0,1,0,0,0,0|1,0,1]=3 1471 B11R1.17 C=CCOc1ccccc1O Amb8837354 [0,1,0,0,0,0|1,0,1]=3 1472 B11R1.17 C=CCOc1cccnc1Br Amb27157328 [0,1,0,0,0,0|2,0,1]=4 1473 B11R1.17 C=CCOc1cccnc1Cl Amb28076128 [0,1,0,0,0,0|2,0,1]=4 1474 B11R1.17 C=CCOc1cccnc1I Amb28130489 [0,1,0,0,0,0|2,0,1]=4 1475 B11R1.17 C=CCOc1cccnc1N Amb10608175 [0,1,0,0,0,0|2,0,1]=4 1476 B11R1.17 C=CCOc1ccncc1N Amb27635701 [0,1,0,0,0,0|2,0,1]=4 1477 B11R1.17 C=CCOc1cnccc1Cl Amb27625282 [0,1,0,0,0,0|2,0,1]=4 1478 B11R1.17 C=CCOc1ncccc1Cl Amb27960947 [0,1,0,0,0,0|2,0,1]=4 1479 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|1,1,1]=4 1480 B11R1.17 C=CCSc1ccccc1C Amb25231651 [0,1,0,0,0,0|1,1,1]=4 1481 B11R1.17 C=CCSc1ccccc1Cl Amb27218500 [0,1,0,0,0,0|1,1,1]=4 1482 B11R1.17 C=CCSc1ccccc1F Amb28319358 [0,1,0,0,0,0|1,1,1]=4 1483 B11R1.17 C=CCSc1ccccc1N Amb433020 [0,1,0,0,0,0|1,1,1]=4 1484 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|1,1,1]=4 1485 B11R1.17 CCC#Cc1ccccc1Br Amb27879801 [0,1,0,0,0,0|2,0,1]=4 1486 B11R1.17 CCC#Cc1ccccc1C Amb25891559 [0,1,0,0,0,0|2,0,1]=4 1487 B11R1.17 CCC#Cc1ccccc1Cl Amb25198269 [0,1,0,0,0,0|2,0,1]=4 1488 B11R1.17 CCC#Cc1ccccc1F Amb26984263 [0,1,0,0,0,0|2,0,1]=4 1489 B11R1.17 CCC#Cc1ccccc1I Amb24447638 [0,1,0,0,0,0|2,0,1]=4 1490 B11R1.17 CCC#Cc1ccccc1N Amb24670207 [0,1,0,0,0,0|2,0,1]=4 1491 B11R1.17 CCC#Cc1ccccc1O Amb25320119 [0,1,0,0,0,0|2,0,1]=4 1492 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|2,0,0]=3 1494 B11R1.17 CCCCc1ccccc1C Amb25825024 [0,1,0,0,0,0|2,0,0]=3 1495 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|2,0,0]=3 1496 B11R1.17 CCCCc1ccccc1I Amb25955656 [0,1,0,0,0,0|2,0,0]=3 1497 B11R1.17 CCCCc1ccccc1N Amb4037102 [0,1,0,0,0,0|2,0,0]=3 1498 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|2,0,0]=3 1499 B11R1.17 CCCCc1cccnc1Br Amb33038909 [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.17 CCCCc1cccnc1N Amb8386853 [0,1,0,0,0,0|3,0,0]=4 1501 B11R1.17 CCCCc1ccncc1N Amb27666549 [0,1,0,0,0,0|3,0,0]=4 1502 B11R1.17 CCCCc1cnccc1N Amb25785815 [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.17 CCCCc1cnccc1O Amb33189016 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.17 CCCCc1ncccc1N Amb26848966 [0,1,0,0,0,0|3,0,0]=4 1505 B11R1.17 CCCCc1ncccc1O Amb27483034 [0,1,0,0,0,0|3,0,0]=4 1506 B11R1.17 CCCNc1ccccc1Br Amb6696451 [0,1,0,0,0,0|2,0,0]=3 1507 B11R1.17 CCCNc1ccccc1C Amb6701222 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.17 CCCNc1ccccc1Cl Amb4313502 [0,1,0,0,0,0|2,0,0]=3 1509 B11R1.17 CCCNc1ccccc1F Amb6697369 [0,1,0,0,0,0|2,0,0]=3 1510 B11R1.17 CCCNc1ccccc1N Amb440116 [0,1,0,0,0,0|2,0,0]=3 1511 B11R1.17 CCCNc1cccnc1F Amb35725083 [0,1,0,0,0,0|3,0,0]=4 1512 B11R1.17 CCCNc1ccncc1C Amb28437320 [0,1,0,0,0,0|3,0,0]=4 1513 B11R1.17 CCCNc1ccncc1N Amb9205187 [0,1,0,0,0,0|3,0,0]=4 1514 B11R1.17 CCCNc1cnccc1C Amb27436805 [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.17 CCCNc1cnccc1Cl Amb27814860 [0,1,0,0,0,0|3,0,0]=4 1516 B11R1.17 CCCNc1ncccc1C Amb18987728 [0,1,0,0,0,0|3,0,0]=4 1517 B11R1.17 CCCNc1ncccc1F Amb18300627 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.17 CCCNc1ncccc1N Amb20668081 [0,1,0,0,0,0|3,0,0]=4 1519 B11R1.17 CCCNc1ncccc1N Amb7767452 [0,1,0,0,0,0|3,0,0]=4 1520 B11R1.17 CCCOC1=CC=CNC1=O Amb18034627 [0,1,0,0,0,0|2,0,0]=3 1521 B11R1.17 CCCOC1=NC=CNC1=O Amb28312906 [0,1,0,0,0,0|3,0,0]=4 1522 B11R1.17 CCCOc1ccccc1Br Amb6267012 [0,1,0,0,0,0|1,0,0]=2 1523 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,1,0,0,0,0|1,0,0]=2 1524 B11R1.17 CCCOc1ccccc1I Amb27171983 [0,1,0,0,0,0|1,0,0]=2 1525 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,1,0,0,0,0|1,0,0]=2 1526 B11R1.17 CCCOc1ccccc1N Amb840073 [0,1,0,0,0,0|1,0,0]=2 1527 B11R1.17 CCCOc1ccccc1O Amb433886 [0,1,0,0,0,0|1,0,0]=2 1528 B11R1.17 CCCOc1ccccc1S Amb28399283 [0,1,0,0,0,0|1,0,0]=2 1529 B11R1.17 CCCOc1cccnc1Br Amb24321030 [0,1,0,0,0,0|2,0,0]=3 1530 B11R1.17 CCCOc1cccnc1C Amb27668969 [0,1,0,0,0,0|2,0,0]=3 1531 B11R1.17 CCCOc1cccnc1I Amb27477526 [0,1,0,0,0,0|2,0,0]=3 1532 B11R1.17 CCCOc1cccnc1N Amb9208357 [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.17 CCCOc1ccncc1Br Amb24320776 [0,1,0,0,0,0|2,0,0]=3 1534 B11R1.17 CCCOc1ccncc1N Amb8874526 [0,1,0,0,0,0|2,0,0]=3 1535 B11R1.17 CCCOc1cnccc1Cl Amb24055245 [0,1,0,0,0,0|2,0,0]=3 1536 B11R1.17 CCCOc1cnccc1N Amb24320961 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.17 CCCOc1ncccc1Br Amb19959527 [0,1,0,0,0,0|2,0,0]=3 1538 B11R1.17 CCCOc1ncccc1Cl Amb27962160 [0,1,0,0,0,0|2,0,0]=3 1539 B11R1.17 CCCOc1ncccc1N Amb8874532 [0,1,0,0,0,0|2,0,0]=3 1540 B11R1.17 CCCOc1ncccc1O Amb27645342 [0,1,0,0,0,0|2,0,0]=3 1541 B11R1.17 CCCOc1nccnc1C Amb27242253 [0,1,0,0,0,0|3,0,0]=4 1542 B11R1.17 CCCOc1nccnc1Cl Amb18183731 [0,1,0,0,0,0|3,0,0]=4 1543 B11R1.17 CCCOc1nccnc1F Amb32655985 [0,1,0,0,0,0|3,0,0]=4 1544 B11R1.17 CCCOc1nccnc1N Amb24533690 [0,1,0,0,0,0|3,0,0]=4 1545 B11R1.17 CCCOc1ncncc1Br Amb27814937 [0,1,0,0,0,0|3,0,0]=4 1546 B11R1.17 CCCOc1ncncc1N Amb23558041 [0,1,0,0,0,0|3,0,0]=4 1547 B11R1.17 CCCSc1ccccc1Br Amb28046780 [0,1,0,0,0,0|1,1,0]=3 1548 B11R1.17 CCCSc1ccccc1Cl Amb25957434 [0,1,0,0,0,0|1,1,0]=3 1549 B11R1.17 CCCSc1ccccc1F Amb27752807 [0,1,0,0,0,0|1,1,0]=3 1550 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,1,0,0,0,0|1,1,0]=3 1551 B11R1.17 CCCSc1ccccc1N Amb6276699 [0,1,0,0,0,0|1,1,0]=3 1552 B11R1.17 CCCSc1ccccc1S Amb26323053 [0,1,0,0,0,0|1,1,0]=3 1553 B11R1.17 CCCSc1ncccc1N Amb6680310 [0,1,0,0,0,0|2,1,0]=4 1554 B11R1.17 CCCSc1ncccc1O Amb33295106 [0,1,0,0,0,0|2,1,0]=4 1555 B11R1.17 CCNCc1ccccc1Br Amb28872271 [0,1,0,0,0,0|3,0,0]=4 1556 B11R1.17 CCNCc1ccccc1Br Amb6243296 [0,1,0,0,0,0|3,0,0]=4 1557 B11R1.17 CCNCc1ccccc1C Amb5785552 [0,1,0,0,0,0|3,0,0]=4 1558 B11R1.17 CCNCc1ccccc1C Amb6865250 [0,1,0,0,0,0|3,0,0]=4 1559 B11R1.17 CCNCc1ccccc1Cl Amb5785551 [0,1,0,0,0,0|3,0,0]=4 1560 B11R1.17 CCNCc1ccccc1Cl Amb6542581 [0,1,0,0,0,0|3,0,0]=4 1561 B11R1.17 CCNCc1ccccc1F Amb5785550 [0,1,0,0,0,0|3,0,0]=4 1562 B11R1.17 CCNCc1ccccc1F Amb6865249 [0,1,0,0,0,0|3,0,0]=4 1563 B11R1.17 CCNCc1ccccc1N Amb28973216 [0,1,0,0,0,0|3,0,0]=4 1564 B11R1.17 CCNCc1ccccc1N Amb7173571 [0,1,0,0,0,0|3,0,0]=4 1565 B11R1.17 CCNCc1ccccc1O Amb6257868 [0,1,0,0,0,0|3,0,0]=4 1566 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,1,0,0,0,0|3,0,0]=4 1567 B11R1.17 CCOCc1ccccc1N Amb6245712 [0,1,0,0,0,0|3,0,0]=4 1568 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,1,0,0,0,0|3,0,0]=4 1569 B11R1.17 CCSCc1ccccc1Br Amb22228180 [0,1,0,0,0,0|3,0,0]=4 1570 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [0,1,0,0,0,0|3,0,0]=4 1571 B11R1.17 CCSCc1ccccc1F Amb26622298 [0,1,0,0,0,0|3,0,0]=4 1572 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [0,1,0,0,0,0|2,0,1]=4 1574 B11R1.17 CC\N=C\c1ccccc1N Amb25991917 [0,1,0,0,0,0|3,0,0]=4 1575 B11R1.17 CN1C=CC=C\C1=N/CCO Amb27637720 [0,1,0,0,0,0|2,0,0]=3 1576 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|3,0,0]=4 1577 B11R1.17 CNCCc1ccccc1Br Amb33313471 [0,1,0,0,0,0|3,0,0]=4 1578 B11R1.17 CNCCc1ccccc1C Amb19959980 [0,1,0,0,0,0|3,0,0]=4 1579 B11R1.17 CNCCc1ccccc1C Amb8841496 [0,1,0,0,0,0|3,0,0]=4 1580 B11R1.17 CNCCc1ccccc1Cl Amb8853664 [0,1,0,0,0,0|3,0,0]=4 1581 B11R1.17 CNCCc1ccccc1F Amb6710685 [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.17 CNCCc1ccccc1O Amb30584750 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.17 COCCc1ccccc1Br Amb4021414 [0,1,0,0,0,0|3,0,0]=4 1585 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|3,0,0]=4 1586 B11R1.17 COCCc1ccccc1O Amb33552299 [0,1,0,0,0,0|3,0,0]=4 1587 B11R1.17 COCOC1=CC=CNC1=S Amb28428646 [0,1,0,0,0,0|3,0,0]=4 1588 B11R1.17 COCOc1cccc[n+]1[O-] Amb27858168 [0,1,0,0,0,0|3,0,0]=4 1589 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,1,0,0,0,0|2,0,0]=3 1590 B11R1.17 COCOc1ccccc1C Amb10559613 [0,1,0,0,0,0|2,0,0]=3 1591 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,1,0,0,0,0|2,0,0]=3 1592 B11R1.17 COCOc1ccccc1F Amb22546792 [0,1,0,0,0,0|2,0,0]=3 1593 B11R1.17 COCOc1ccccc1I Amb22284514 [0,1,0,0,0,0|2,0,0]=3 1594 B11R1.17 COCOc1ccccc1N Amb23599107 [0,1,0,0,0,0|2,0,0]=3 1595 B11R1.17 COCOc1cccnc1Cl Amb28041341 [0,1,0,0,0,0|3,0,0]=4 1596 B11R1.17 COCOc1cnccc1Br Amb32412226 [0,1,0,0,0,0|3,0,0]=4 1597 B11R1.17 COCOc1cnccc1Cl Amb25921402 [0,1,0,0,0,0|3,0,0]=4 1598 B11R1.17 COCOc1cnccc1I Amb24593865 [0,1,0,0,0,0|3,0,0]=4 1599 B11R1.17 COCSc1ccccc1Br Amb27605149 [0,1,0,0,0,0|2,1,0]=4 1600 B11R1.17 COCSc1ccccc1C Amb27775698 [0,1,0,0,0,0|2,1,0]=4 1601 B11R1.17 COCSc1ccccc1F Amb28282291 [0,1,0,0,0,0|2,1,0]=4 1602 B11R1.17 COCSc1ccccc1O Amb27754976 [0,1,0,0,0,0|2,1,0]=4 1603 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|3,0,0]=4 1604 B11R1.17 C\C=C/Oc1ccccc1O Amb28137745 [0,1,0,0,0,0|1,0,2]=4 1605 B11R1.17 Cc1ccccc1C#CCBr Amb25032502 [0,1,0,0,0,0|2,0,1]=4 1606 B11R1.17 Cc1ccccc1C#CCCl Amb18792614 [0,1,0,0,0,0|2,0,1]=4 1607 B11R1.17 Cc1ccccc1C#CCF Amb25026923 [0,1,0,0,0,0|2,0,1]=4 1608 B11R1.17 Cc1ccccc1C#CCI Amb28120130 [0,1,0,0,0,0|2,0,1]=4 1609 B11R1.17 Cc1ccccc1C#CCN Amb18949803 [0,1,0,0,0,0|2,0,1]=4 1610 B11R1.17 Cc1ccccc1C#CCO Amb25117588 [0,1,0,0,0,0|1,0,1]=3 1611 B11R1.17 Cc1ccccc1CCC#N Amb17204295 [0,1,0,0,0,0|2,0,1]=4 1612 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [0,1,0,0,0,0|1,0,2]=4 1613 B11R1.17 Cc1ccccc1CCCBr Amb17104552 [0,1,0,0,0,0|2,0,0]=3 1614 B11R1.17 Cc1ccccc1CCCCl Amb17104525 [0,1,0,0,0,0|2,0,0]=3 1615 B11R1.17 Cc1ccccc1CCCN Amb33743608 [0,1,0,0,0,0|2,0,0]=3 1616 B11R1.17 Cc1ccccc1CCCN Amb5735477 [0,1,0,0,0,0|2,0,0]=3 1617 B11R1.17 Cc1ccccc1CCCO Amb17089494 [0,1,0,0,0,0|1,0,0]=2 1618 B11R1.17 Cc1ccccc1CCCS Amb17400218 [0,1,0,0,0,0|1,1,0]=3 1619 B11R1.17 Cc1ccccc1CCNN Amb6242730 [0,1,0,0,0,0|3,0,0]=4 1620 B11R1.17 Cc1ccccc1CCON Amb26991554 [0,1,0,0,0,0|3,0,0]=4 1621 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|3,0,0]=4 1622 B11R1.17 Cc1ccccc1NCC#N Amb6714251 [0,1,0,0,0,0|2,0,1]=4 1623 B11R1.17 Cc1ccccc1NCCBr Amb27481681 [0,1,0,0,0,0|2,0,0]=3 1624 B11R1.17 Cc1ccccc1NCCCl Amb17334785 [0,1,0,0,0,0|2,0,0]=3 1625 B11R1.17 Cc1ccccc1NCCN Amb17057744 [0,1,0,0,0,0|2,0,0]=3 1626 B11R1.17 Cc1ccccc1NCCO Amb2720820 [0,1,0,0,0,0|1,0,0]=2 1627 B11R1.17 Cc1ccccc1OCC#N Amb4036310 [0,1,0,0,0,0|1,0,1]=3 1628 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [0,1,0,0,0,0|0,0,2]=3 1629 B11R1.17 Cc1ccccc1OCCBr Amb1105693 [0,1,0,0,0,0|1,0,0]=2 1630 B11R1.17 Cc1ccccc1OCCCl Amb5559281 [0,1,0,0,0,0|1,0,0]=2 1631 B11R1.17 Cc1ccccc1OCCF Amb26588103 [0,1,0,0,0,0|1,0,0]=2 1632 B11R1.17 Cc1ccccc1OCCN Amb1098984 [0,1,0,0,0,0|1,0,0]=2 1633 B11R1.17 Cc1ccccc1OCCN Amb2052283 [0,1,0,0,0,0|1,0,0]=2 1634 B11R1.17 Cc1ccccc1OCCO Amb2209345 [0,1,0,0,0,0|0,0,0]=1 1635 B11R1.17 Cc1ccccc1OCCS Amb6255243 [0,1,0,0,0,0|0,1,0]=2 1636 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,1,0,0,0,0|1,1,1]=4 1637 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|0,1,2]=4 1638 B11R1.17 Cc1ccccc1SCCF Amb27853875 [0,1,0,0,0,0|1,1,0]=3 1639 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,1,0,0,0,0|1,1,0]=3 1640 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|0,1,0]=2 1641 B11R1.17 Cc1ccccc1\C=C\CCl Amb27831983 [0,1,0,0,0,0|2,0,1]=4 1642 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [0,1,0,0,0,0|2,0,1]=4 1643 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [0,1,0,0,0,0|1,0,1]=3 1644 B11R1.17 Cc1cccnc1CCCBr Amb33451722 [0,1,0,0,0,0|3,0,0]=4 1645 B11R1.17 Cc1cccnc1CCCN Amb22886485 [0,1,0,0,0,0|3,0,0]=4 1646 B11R1.17 Cc1cccnc1CCCN Amb26458764 [0,1,0,0,0,0|3,0,0]=4 1647 B11R1.17 Cc1cccnc1CCCO Amb24685021 [0,1,0,0,0,0|2,0,0]=3 1648 B11R1.17 Cc1cccnc1CCCS Amb33360199 [0,1,0,0,0,0|2,1,0]=4 1649 B11R1.17 Cc1cccnc1NCCCl Amb27761712 [0,1,0,0,0,0|3,0,0]=4 1650 B11R1.17 Cc1cccnc1NCCN Amb10607838 [0,1,0,0,0,0|3,0,0]=4 1651 B11R1.17 Cc1cccnc1NCCS Amb27840266 [0,1,0,0,0,0|2,1,0]=4 1652 B11R1.17 Cc1cccnc1OCCN Amb18988881 [0,1,0,0,0,0|2,0,0]=3 1653 B11R1.17 Cc1cccnc1SCCBr Amb35616290 [0,1,0,0,0,0|2,1,0]=4 1654 B11R1.17 Cc1cccnc1SCCCl Amb18329822 [0,1,0,0,0,0|2,1,0]=4 1655 B11R1.17 Cc1cccnc1SCCN Amb18908765 [0,1,0,0,0,0|2,1,0]=4 1656 B11R1.17 Cc1cccnc1SCCO Amb18185610 [0,1,0,0,0,0|1,1,0]=3 1657 B11R1.17 Cc1cccnc1SCCS Amb29879779 [0,1,0,0,0,0|1,2,0]=4 1658 B11R1.17 Cc1cccnc1\C=C\CO Amb33428736 [0,1,0,0,0,0|2,0,1]=4 1659 B11R1.17 Cc1ccncc1CCCBr Amb25089629 [0,1,0,0,0,0|3,0,0]=4 1660 B11R1.17 Cc1ccncc1CCCBr Amb33743790 [0,1,0,0,0,0|3,0,0]=4 1661 B11R1.17 Cc1ccncc1CCCCl Amb27465644 [0,1,0,0,0,0|3,0,0]=4 1662 B11R1.17 Cc1ccncc1CCCN Amb26590860 [0,1,0,0,0,0|3,0,0]=4 1663 B11R1.17 Cc1ccncc1CCCO Amb25717118 [0,1,0,0,0,0|2,0,0]=3 1664 B11R1.17 Cc1ccncc1CCCS Amb33375260 [0,1,0,0,0,0|2,1,0]=4 1665 B11R1.17 Cc1ccncc1OCCBr Amb32988382 [0,1,0,0,0,0|2,0,0]=3 1666 B11R1.17 Cc1ccncc1OCCN Amb33377415 [0,1,0,0,0,0|2,0,0]=3 1667 B11R1.17 Cc1ccncc1\C=C\CO Amb33226224 [0,1,0,0,0,0|2,0,1]=4 1668 B11R1.17 Cc1cnccc1C#CCO Amb28125077 [0,1,0,0,0,0|2,0,1]=4 1669 B11R1.17 Cc1cnccc1CCCBr Amb24611779 [0,1,0,0,0,0|3,0,0]=4 1670 B11R1.17 Cc1cnccc1CCCN Amb25916323 [0,1,0,0,0,0|3,0,0]=4 1671 B11R1.17 Cc1cnccc1CCCO Amb10573523 [0,1,0,0,0,0|2,0,0]=3 1672 B11R1.17 Cc1cnccc1CCCS Amb33426104 [0,1,0,0,0,0|2,1,0]=4 1673 B11R1.17 Cc1cnccc1NCCN Amb8503377 [0,1,0,0,0,0|3,0,0]=4 1674 B11R1.17 Cc1cnccc1OCCN Amb27401371 [0,1,0,0,0,0|2,0,0]=3 1675 B11R1.17 Cc1cnccc1SCCO Amb27950192 [0,1,0,0,0,0|1,1,0]=3 1676 B11R1.17 Cc1cnccc1\C=C\CO Amb33414325 [0,1,0,0,0,0|2,0,1]=4 1677 B11R1.17 Cc1ncccc1CCCBr Amb33432593 [0,1,0,0,0,0|3,0,0]=4 1678 B11R1.17 Cc1ncccc1CCCN Amb26975097 [0,1,0,0,0,0|3,0,0]=4 1679 B11R1.17 Cc1ncccc1CCCO Amb24360630 [0,1,0,0,0,0|2,0,0]=3 1680 B11R1.17 Cc1ncccc1CCCS Amb32878313 [0,1,0,0,0,0|2,1,0]=4 1681 B11R1.17 Cc1ncccc1NCCN Amb28365662 [0,1,0,0,0,0|3,0,0]=4 1682 B11R1.17 Cc1ncccc1OCCBr Amb25046512 [0,1,0,0,0,0|2,0,0]=3 1683 B11R1.17 Cc1ncccc1OCCN Amb26447701 [0,1,0,0,0,0|2,0,0]=3 1684 B11R1.17 Cc1ncccc1OCCO Amb24101976 [0,1,0,0,0,0|1,0,0]=2 1685 B11R1.17 Cc1ncccc1\C=C\CO Amb32878967 [0,1,0,0,0,0|2,0,1]=4 1686 B11R1.17 Cc1nccnc1CCCO Amb33141633 [0,1,0,0,0,0|3,0,0]=4 1687 B11R1.17 Cc1nccnc1OCCN Amb26348201 [0,1,0,0,0,0|3,0,0]=4 1688 B11R1.17 Cc1ncncc1CCCO Amb33149098 [0,1,0,0,0,0|3,0,0]=4 1689 B11R1.17 Cc1ncncc1OCCN Amb32876685 [0,1,0,0,0,0|3,0,0]=4 1690 B11R1.17 ClCC#Cc1ccccc1Br Amb26460989 [0,1,0,0,0,0|2,0,1]=4 1691 B11R1.17 ClCC#Cc1ccccc1Cl Amb18319857 [0,1,0,0,0,0|2,0,1]=4 1692 B11R1.17 ClCC#Cc1ccccc1I Amb27764269 [0,1,0,0,0,0|2,0,1]=4 1693 B11R1.17 ClCCCc1ccccc1Br Amb26508575 [0,1,0,0,0,0|2,0,0]=3 1694 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|2,0,0]=3 1695 B11R1.17 ClCCCc1ccncc1Br Amb32689599 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.17 ClCCCc1ccncc1Cl Amb25344160 [0,1,0,0,0,0|3,0,0]=4 1697 B11R1.17 ClCCCc1ncccc1Br Amb25089986 [0,1,0,0,0,0|3,0,0]=4 1698 B11R1.17 ClCCCc1ncccc1Cl Amb32690847 [0,1,0,0,0,0|3,0,0]=4 1699 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,1,0,0,0,0|2,0,0]=3 1700 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,1,0,0,0,0|2,0,0]=3 1701 B11R1.17 ClCCNc1ccncc1Br Amb28050806 [0,1,0,0,0,0|3,0,0]=4 1702 B11R1.17 ClCCOc1ccccc1Br Amb4477181 [0,1,0,0,0,0|1,0,0]=2 1703 B11R1.17 ClCCOc1ccccc1Cl Amb8828429 [0,1,0,0,0,0|1,0,0]=2 1704 B11R1.17 ClCCSc1ccccc1Cl Amb8827948 [0,1,0,0,0,0|1,1,0]=3 1705 B11R1.17 ClCCSc1ccncc1Br Amb28123863 [0,1,0,0,0,0|2,1,0]=4 1706 B11R1.17 ClCCSc1ncccc1Br Amb28058208 [0,1,0,0,0,0|2,1,0]=4 1707 B11R1.17 ClCSCc1ccccc1Cl Amb28456984 [0,1,0,0,0,0|3,0,0]=4 1708 B11R1.17 ClC\C=C\c1ccccc1Cl Amb27592206 [0,1,0,0,0,0|2,0,1]=4 1709 B11R1.17 Clc1ccccc1C#CCBr Amb27807441 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.17 Clc1ccccc1C#CCI Amb24447633 [0,1,0,0,0,0|2,0,1]=4 1711 B11R1.17 Clc1ccccc1CCCBr Amb17104560 [0,1,0,0,0,0|2,0,0]=3 1712 B11R1.17 Clc1ccccc1OCCBr Amb1150980 [0,1,0,0,0,0|1,0,0]=2 1713 B11R1.17 Clc1ccccc1OCCI Amb28056714 [0,1,0,0,0,0|1,0,0]=2 1714 B11R1.17 Clc1ccccc1\C=C\CBr Amb8392445 [0,1,0,0,0,0|2,0,1]=4 1715 B11R1.17 Clc1cccnc1CCCBr Amb32690848 [0,1,0,0,0,0|3,0,0]=4 1716 B11R1.17 Clc1cccnc1SCCBr Amb27238474 [0,1,0,0,0,0|2,1,0]=4 1717 B11R1.17 Clc1cnccc1CCCBr Amb25851696 [0,1,0,0,0,0|3,0,0]=4 1718 B11R1.17 Clc1ncccc1CCCBr Amb33389022 [0,1,0,0,0,0|3,0,0]=4 1719 B11R1.17 Clc1ncccc1OCCBr Amb32988373 [0,1,0,0,0,0|2,0,0]=3 1720 B11R1.17 Cn1cccc\c1=N/CCO Amb24106772 [0,1,0,0,0,0|2,0,0]=3 1721 B11R1.17 FCC#Cc1ccccc1Br Amb25252787 [0,1,0,0,0,0|2,0,1]=4 1722 B11R1.17 FCC#Cc1ccccc1Cl Amb25330678 [0,1,0,0,0,0|2,0,1]=4 1723 B11R1.17 FCC#Cc1ccccc1F Amb26325960 [0,1,0,0,0,0|2,0,1]=4 1724 B11R1.17 FCC#Cc1ccccc1I Amb25027319 [0,1,0,0,0,0|2,0,1]=4 1725 B11R1.17 FCCNc1ccccc1Br Amb27596368 [0,1,0,0,0,0|2,0,0]=3 1726 B11R1.17 FCCNc1ccccc1Cl Amb27868080 [0,1,0,0,0,0|2,0,0]=3 1727 B11R1.17 FCCNc1ccncc1F Amb30035770 [0,1,0,0,0,0|3,0,0]=4 1728 B11R1.17 FCCNc1ncccc1Br Amb27249939 [0,1,0,0,0,0|3,0,0]=4 1729 B11R1.17 FCCOc1ccccc1Br Amb27391893 [0,1,0,0,0,0|1,0,0]=2 1730 B11R1.17 FCCOc1ccccc1I Amb28072521 [0,1,0,0,0,0|1,0,0]=2 1731 B11R1.17 FCCOc1cnccc1Br Amb27267251 [0,1,0,0,0,0|2,0,0]=3 1732 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,1,0,0,0,0|1,1,0]=3 1733 B11R1.17 Fc1ccccc1C#CCBr Amb27849801 [0,1,0,0,0,0|2,0,1]=4 1734 B11R1.17 Fc1ccccc1C#CCCl Amb18185585 [0,1,0,0,0,0|2,0,1]=4 1735 B11R1.17 Fc1ccccc1C#CCI Amb25998813 [0,1,0,0,0,0|2,0,1]=4 1736 B11R1.17 Fc1ccccc1CCCBr Amb17104555 [0,1,0,0,0,0|2,0,0]=3 1737 B11R1.17 Fc1ccccc1CCCCl Amb17104528 [0,1,0,0,0,0|2,0,0]=3 1738 B11R1.17 Fc1ccccc1CCCS Amb17400332 [0,1,0,0,0,0|1,1,0]=3 1739 B11R1.17 Fc1ccccc1COCCl Amb27654557 [0,1,0,0,0,0|3,0,0]=4 1740 B11R1.17 Fc1ccccc1NCCCl Amb17334964 [0,1,0,0,0,0|2,0,0]=3 1741 B11R1.17 Fc1ccccc1OCCBr Amb1103643 [0,1,0,0,0,0|1,0,0]=2 1742 B11R1.17 Fc1ccccc1OCCCl Amb8828428 [0,1,0,0,0,0|1,0,0]=2 1743 B11R1.17 Fc1ccccc1OCCS Amb6255864 [0,1,0,0,0,0|0,1,0]=2 1744 B11R1.17 Fc1ccccc1SCCCl Amb1154202 [0,1,0,0,0,0|1,1,0]=3 1745 B11R1.17 Fc1ccccc1SCCI Amb28364151 [0,1,0,0,0,0|1,1,0]=3 1746 B11R1.17 Fc1ccccc1\C=C\CCl Amb26495610 [0,1,0,0,0,0|2,0,1]=4 1747 B11R1.17 Fc1cccnc1CCCBr Amb33335708 [0,1,0,0,0,0|3,0,0]=4 1748 B11R1.17 Fc1cccnc1CCCS Amb33327465 [0,1,0,0,0,0|2,1,0]=4 1749 B11R1.17 Fc1cccnc1NCCCl Amb28207697 [0,1,0,0,0,0|3,0,0]=4 1750 B11R1.17 Fc1cnccc1CCCBr Amb24486812 [0,1,0,0,0,0|3,0,0]=4 1751 B11R1.17 Fc1cnccc1CCCS Amb33316480 [0,1,0,0,0,0|2,1,0]=4 1752 B11R1.17 Fc1cnccc1NCCCl Amb35655335 [0,1,0,0,0,0|3,0,0]=4 1753 B11R1.17 Fc1cnccc1SCCCl Amb30020411 [0,1,0,0,0,0|2,1,0]=4 1754 B11R1.17 Fc1ncccc1CCCBr Amb33450427 [0,1,0,0,0,0|3,0,0]=4 1755 B11R1.17 Fc1ncccc1CCCS Amb33376782 [0,1,0,0,0,0|2,1,0]=4 1756 B11R1.17 Fc1ncccc1OCCBr Amb32988377 [0,1,0,0,0,0|2,0,0]=3 1757 B11R1.17 ICC#Cc1ccccc1I Amb24509627 [0,1,0,0,0,0|2,0,1]=4 1758 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|2,0,1]=4 1759 B11R1.17 N#CCCc1ccccc1Cl Amb2686406 [0,1,0,0,0,0|2,0,1]=4 1760 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|2,0,1]=4 1761 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|2,0,1]=4 1762 B11R1.17 N#CCCc1ccccc1S Amb28208431 [0,1,0,0,0,0|2,0,1]=4 1763 B11R1.17 N#CCNc1ccccc1Br Amb6712133 [0,1,0,0,0,0|2,0,1]=4 1764 B11R1.17 N#CCNc1ccccc1Cl Amb6712355 [0,1,0,0,0,0|2,0,1]=4 1765 B11R1.17 N#CCNc1ccccc1F Amb6712545 [0,1,0,0,0,0|2,0,1]=4 1766 B11R1.17 N#CCNc1ccccc1N Amb2609638 [0,1,0,0,0,0|2,0,1]=4 1767 B11R1.17 N#CCNc1ccccc1O Amb28119295 [0,1,0,0,0,0|2,0,1]=4 1768 B11R1.17 N#CCOc1ccccc1Br Amb2720452 [0,1,0,0,0,0|1,0,1]=3 1769 B11R1.17 N#CCOc1ccccc1Cl Amb2686311 [0,1,0,0,0,0|1,0,1]=3 1770 B11R1.17 N#CCOc1ccccc1F Amb33532602 [0,1,0,0,0,0|1,0,1]=3 1771 B11R1.17 N#CCOc1ccccc1N Amb6251107 [0,1,0,0,0,0|1,0,1]=3 1772 B11R1.17 N#CCOc1cccnc1N Amb9208352 [0,1,0,0,0,0|2,0,1]=4 1773 B11R1.17 N#CCSc1ccccc1Br Amb8994901 [0,1,0,0,0,0|1,1,1]=4 1774 B11R1.17 N#CCSc1ccccc1Cl Amb6677759 [0,1,0,0,0,0|1,1,1]=4 1775 B11R1.17 N#CCSc1ccccc1F Amb6677732 [0,1,0,0,0,0|1,1,1]=4 1776 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,1,0,0,0,0|1,1,1]=4 1777 B11R1.17 NCC#Cc1ccccc1Br Amb25727777 [0,1,0,0,0,0|2,0,1]=4 1778 B11R1.17 NCC#Cc1ccccc1Cl Amb18281655 [0,1,0,0,0,0|2,0,1]=4 1779 B11R1.17 NCC#Cc1ccccc1F Amb18962138 [0,1,0,0,0,0|2,0,1]=4 1780 B11R1.17 NCC#Cc1ccccc1I Amb24454628 [0,1,0,0,0,0|2,0,1]=4 1781 B11R1.17 NCC#Cc1ccccc1N Amb26047782 [0,1,0,0,0,0|2,0,1]=4 1782 B11R1.17 NCCCN1C=CC=CC1=O Amb18535490 [0,1,0,0,0,0|3,0,0]=4 1783 B11R1.17 NCCCN1C=CC=CC1=O Amb19514396 [0,1,0,0,0,0|3,0,0]=4 1784 B11R1.17 NCCCc1ccccc1Br Amb33533965 [0,1,0,0,0,0|2,0,0]=3 1785 B11R1.17 NCCCc1ccccc1Br Amb9304915 [0,1,0,0,0,0|2,0,0]=3 1786 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|2,0,0]=3 1787 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|2,0,0]=3 1788 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|2,0,0]=3 1789 B11R1.17 NCCCc1ccccc1F Amb5735478 [0,1,0,0,0,0|2,0,0]=3 1790 B11R1.17 NCCCc1ccccc1I Amb27814275 [0,1,0,0,0,0|2,0,0]=3 1791 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|2,0,0]=3 1792 B11R1.17 NCCCc1ccccc1O Amb2695303 [0,1,0,0,0,0|2,0,0]=3 1793 B11R1.17 NCCCc1cccnc1Br Amb26330157 [0,1,0,0,0,0|3,0,0]=4 1794 B11R1.17 NCCCc1cccnc1Cl Amb26959473 [0,1,0,0,0,0|3,0,0]=4 1795 B11R1.17 NCCCc1cccnc1F Amb27595673 [0,1,0,0,0,0|3,0,0]=4 1796 B11R1.17 NCCCc1cccnc1N Amb28040866 [0,1,0,0,0,0|3,0,0]=4 1797 B11R1.17 NCCCc1cccnc1N Amb33249805 [0,1,0,0,0,0|3,0,0]=4 1798 B11R1.17 NCCCc1ccncc1Br Amb27644751 [0,1,0,0,0,0|3,0,0]=4 1799 B11R1.17 NCCCc1ccncc1Cl Amb23596508 [0,1,0,0,0,0|3,0,0]=4 1800 B11R1.17 NCCCc1ccncc1F Amb25111554 [0,1,0,0,0,0|3,0,0]=4 1801 B11R1.17 NCCCc1cnccc1F Amb27475861 [0,1,0,0,0,0|3,0,0]=4 1802 B11R1.17 NCCCc1cnccc1N Amb27850543 [0,1,0,0,0,0|3,0,0]=4 1803 B11R1.17 NCCCc1ncccc1Br Amb25771023 [0,1,0,0,0,0|3,0,0]=4 1804 B11R1.17 NCCCc1ncccc1F Amb25032548 [0,1,0,0,0,0|3,0,0]=4 1805 B11R1.17 NCCCc1ncccc1N Amb27825891 [0,1,0,0,0,0|3,0,0]=4 1806 B11R1.17 NCCCc1ncccc1O Amb25111600 [0,1,0,0,0,0|3,0,0]=4 1807 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,1,0,0,0,0|2,0,0]=3 1808 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,1,0,0,0,0|2,0,0]=3 1809 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,1,0,0,0,0|2,0,0]=3 1810 B11R1.17 NCCNc1ccccc1N Amb2794704 [0,1,0,0,0,0|2,0,0]=3 1811 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.17 NCCNc1cccnc1F Amb35725084 [0,1,0,0,0,0|3,0,0]=4 1813 B11R1.17 NCCNc1ncccc1I Amb27209343 [0,1,0,0,0,0|3,0,0]=4 1814 B11R1.17 NCCNc1ncccc1N Amb18991500 [0,1,0,0,0,0|3,0,0]=4 1815 B11R1.17 NCCOC1=CNC=CC1=O Amb27638354 [0,1,0,0,0,0|2,0,0]=3 1816 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,1,0,0,0,0|1,0,0]=2 1817 B11R1.17 NCCOc1ccccc1Br Amb5781215 [0,1,0,0,0,0|1,0,0]=2 1818 B11R1.17 NCCOc1ccccc1Cl Amb836407 [0,1,0,0,0,0|1,0,0]=2 1819 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,1,0,0,0,0|1,0,0]=2 1820 B11R1.17 NCCOc1ccccc1F Amb6859379 [0,1,0,0,0,0|1,0,0]=2 1821 B11R1.17 NCCOc1ccccc1N Amb18251366 [0,1,0,0,0,0|1,0,0]=2 1822 B11R1.17 NCCOc1cccnc1Br Amb33388121 [0,1,0,0,0,0|2,0,0]=3 1823 B11R1.17 NCCOc1cccnc1Cl Amb33257696 [0,1,0,0,0,0|2,0,0]=3 1824 B11R1.17 NCCOc1cccnc1F Amb33376794 [0,1,0,0,0,0|2,0,0]=3 1825 B11R1.17 NCCOc1ccncc1Br Amb24353235 [0,1,0,0,0,0|2,0,0]=3 1826 B11R1.17 NCCOc1ccncc1Cl Amb27759016 [0,1,0,0,0,0|2,0,0]=3 1827 B11R1.17 NCCOc1ccncc1F Amb33317419 [0,1,0,0,0,0|2,0,0]=3 1828 B11R1.17 NCCOc1ncccc1Br Amb18988886 [0,1,0,0,0,0|2,0,0]=3 1829 B11R1.17 NCCOc1ncccc1Cl Amb18988869 [0,1,0,0,0,0|2,0,0]=3 1830 B11R1.17 NCCOc1ncccc1Cl Amb20631069 [0,1,0,0,0,0|2,0,0]=3 1831 B11R1.17 NCCOc1ncccc1F Amb18996066 [0,1,0,0,0,0|2,0,0]=3 1832 B11R1.17 NCCOc1ncccc1F Amb32658022 [0,1,0,0,0,0|2,0,0]=3 1833 B11R1.17 NCCSc1cccc[n+]1[O-] Amb28318057 [0,1,0,0,0,0|2,1,0]=4 1834 B11R1.17 NCCSc1ccccc1F Amb6265436 [0,1,0,0,0,0|1,1,0]=3 1835 B11R1.17 NCCSc1ccccc1N Amb6761760 [0,1,0,0,0,0|1,1,0]=3 1836 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,1,0,0,0,0|1,1,0]=3 1837 B11R1.17 NCCSc1ncccc1N Amb18291324 [0,1,0,0,0,0|2,1,0]=4 1838 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,1,0,0,0,0|2,0,1]=4 1839 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [0,1,0,0,0,0|2,0,1]=4 1840 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [0,1,0,0,0,0|2,0,1]=4 1841 B11R1.17 NC\C=C\c1ccccc1O Amb27442155 [0,1,0,0,0,0|2,0,1]=4 1842 B11R1.17 NNCCc1ccccc1Cl Amb6243429 [0,1,0,0,0,0|3,0,0]=4 1843 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|3,0,0]=4 1844 B11R1.17 NNCCc1ccccc1F Amb6480211 [0,1,0,0,0,0|3,0,0]=4 1845 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|3,0,0]=4 1846 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|3,0,0]=4 1847 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|3,0,0]=4 1848 B11R1.17 NOCCc1ccccc1O Amb28063031 [0,1,0,0,0,0|3,0,0]=4 1849 B11R1.17 Nc1ccccc1C#CCBr Amb26511539 [0,1,0,0,0,0|2,0,1]=4 1850 B11R1.17 Nc1ccccc1C#CCCl Amb24462871 [0,1,0,0,0,0|2,0,1]=4 1851 B11R1.17 Nc1ccccc1C#CCF Amb24509437 [0,1,0,0,0,0|2,0,1]=4 1852 B11R1.17 Nc1ccccc1C#CCI Amb27859383 [0,1,0,0,0,0|2,0,1]=4 1853 B11R1.17 Nc1ccccc1C#CCO Amb22228947 [0,1,0,0,0,0|1,0,1]=3 1854 B11R1.17 Nc1ccccc1CCCCl Amb17477710 [0,1,0,0,0,0|2,0,0]=3 1855 B11R1.17 Nc1ccccc1CCCF Amb28059275 [0,1,0,0,0,0|2,0,0]=3 1856 B11R1.17 Nc1ccccc1CCCO Amb17477702 [0,1,0,0,0,0|1,0,0]=2 1857 B11R1.17 Nc1ccccc1COCS Amb27659006 [0,1,0,0,0,0|2,1,0]=4 1858 B11R1.17 Nc1ccccc1NCCO Amb404596 [0,1,0,0,0,0|1,0,0]=2 1859 B11R1.17 Nc1ccccc1NCCO Amb6891865 [0,1,0,0,0,0|1,0,0]=2 1860 B11R1.17 Nc1ccccc1NCCS Amb27794574 [0,1,0,0,0,0|1,1,0]=3 1861 B11R1.17 Nc1ccccc1OCCBr Amb34157677 [0,1,0,0,0,0|1,0,0]=2 1862 B11R1.17 Nc1ccccc1OCCBr Amb842426 [0,1,0,0,0,0|1,0,0]=2 1863 B11R1.17 Nc1ccccc1OCCCl Amb27474853 [0,1,0,0,0,0|1,0,0]=2 1864 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,1,0,0,0,0|1,0,0]=2 1865 B11R1.17 Nc1ccccc1OCCO Amb33734854 [0,1,0,0,0,0|0,0,0]=1 1866 B11R1.17 Nc1ccccc1OCCO Amb6702378 [0,1,0,0,0,0|0,0,0]=1 1867 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,1,0,0,0,0|1,1,0]=3 1868 B11R1.17 Nc1ccccc1SCCS Amb28137778 [0,1,0,0,0,0|0,2,0]=3 1869 B11R1.17 Nc1ccccc1\C=C\CO Amb34916231 [0,1,0,0,0,0|1,0,1]=3 1870 B11R1.17 Nc1cccnc1NCCF Amb28061770 [0,1,0,0,0,0|3,0,0]=4 1871 B11R1.17 Nc1cccnc1NCCO Amb7768142 [0,1,0,0,0,0|2,0,0]=3 1872 B11R1.17 Nc1cccnc1OCCO Amb6680945 [0,1,0,0,0,0|1,0,0]=2 1873 B11R1.17 Nc1cccnc1SCCF Amb28041886 [0,1,0,0,0,0|2,1,0]=4 1874 B11R1.17 Nc1ccncc1CCCCl Amb27989139 [0,1,0,0,0,0|3,0,0]=4 1875 B11R1.17 Nc1ccncc1CCCO Amb24355779 [0,1,0,0,0,0|2,0,0]=3 1876 B11R1.17 Nc1ccncc1NCCF Amb27478095 [0,1,0,0,0,0|3,0,0]=4 1877 B11R1.17 Nc1ccncc1NCCO Amb27857352 [0,1,0,0,0,0|2,0,0]=3 1878 B11R1.17 Nc1ccncc1OCCO Amb27840356 [0,1,0,0,0,0|1,0,0]=2 1879 B11R1.17 Nc1cnccc1NCCCl Amb27478063 [0,1,0,0,0,0|3,0,0]=4 1880 B11R1.17 Nc1cnccc1NCCO Amb33529127 [0,1,0,0,0,0|2,0,0]=3 1881 B11R1.17 Nc1cnccc1OCCO Amb7765179 [0,1,0,0,0,0|1,0,0]=2 1882 B11R1.17 Nc1cncnc1OCCO Amb26654876 [0,1,0,0,0,0|2,0,0]=3 1883 B11R1.17 Nc1ncccc1CCCO Amb13890002 [0,1,0,0,0,0|2,0,0]=3 1884 B11R1.17 Nc1ncccc1OCCF Amb26968457 [0,1,0,0,0,0|2,0,0]=3 1885 B11R1.17 Nc1ncccc1OCCO Amb7787230 [0,1,0,0,0,0|1,0,0]=2 1886 B11R1.17 Nc1nccnc1OCCO Amb27239352 [0,1,0,0,0,0|2,0,0]=3 1887 B11R1.17 Nc1nccnc1SCCO Amb27229777 [0,1,0,0,0,0|2,1,0]=4 1888 B11R1.17 Nc1ncncc1NCCO Amb27966226 [0,1,0,0,0,0|3,0,0]=4 1889 B11R1.17 O=C1C=CC=CN1CCCF Amb27882103 [0,1,0,0,0,0|3,0,0]=4 1890 B11R1.17 O=C1C=CC=CN1CCCO Amb18041289 [0,1,0,0,0,0|2,0,0]=3 1891 B11R1.17 O=C1C=CN=CN1CCCO Amb33530551 [0,1,0,0,0,0|3,0,0]=4 1892 B11R1.17 O=C1C=NC=CN1CCCO Amb28129138 [0,1,0,0,0,0|3,0,0]=4 1893 B11R1.17 O=C1N=CC=CN1CCCO Amb18177313 [0,1,0,0,0,0|3,0,0]=4 1894 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|1,0,2]=4 1895 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|1,0,2]=4 1896 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|1,0,2]=4 1897 B11R1.17 O=CCCc1ccccc1O Amb22228954 [0,1,0,0,0,0|1,0,2]=4 1898 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|0,0,2]=3 1899 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [0,1,0,0,0,0|0,0,2]=3 1900 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|0,0,2]=3 1901 B11R1.17 O=CCOc1ccccc1I Amb27871520 [0,1,0,0,0,0|0,0,2]=3 1902 B11R1.17 O=CCOc1ccccc1O Amb27176428 [0,1,0,0,0,0|0,0,2]=3 1903 B11R1.17 O=CCSc1ccccc1Br Amb26008308 [0,1,0,0,0,0|0,1,2]=4 1904 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|0,1,2]=4 1905 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|0,1,2]=4 1906 B11R1.17 OCC#Cc1ccccc1Br Amb836727 [0,1,0,0,0,0|1,0,1]=3 1907 B11R1.17 OCC#Cc1ccccc1Cl Amb836649 [0,1,0,0,0,0|1,0,1]=3 1908 B11R1.17 OCC#Cc1ccccc1F Amb836758 [0,1,0,0,0,0|1,0,1]=3 1909 B11R1.17 OCC#Cc1ccccc1I Amb24731810 [0,1,0,0,0,0|1,0,1]=3 1910 B11R1.17 OCC#Cc1ccccc1O Amb23412359 [0,1,0,0,0,0|1,0,1]=3 1911 B11R1.17 OCC#Cc1ccncc1F Amb27235696 [0,1,0,0,0,0|2,0,1]=4 1912 B11R1.17 OCC#Cc1cnccc1Cl Amb13889957 [0,1,0,0,0,0|2,0,1]=4 1913 B11R1.17 OCC#Cc1ncccc1F Amb27756123 [0,1,0,0,0,0|2,0,1]=4 1914 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|1,0,0]=2 1915 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|1,0,0]=2 1916 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|1,0,0]=2 1917 B11R1.17 OCCCc1ccccc1I Amb27246348 [0,1,0,0,0,0|1,0,0]=2 1918 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|1,0,0]=2 1919 B11R1.17 OCCCc1cccnc1Br Amb33388120 [0,1,0,0,0,0|2,0,0]=3 1920 B11R1.17 OCCCc1cccnc1Cl Amb32668114 [0,1,0,0,0,0|2,0,0]=3 1921 B11R1.17 OCCCc1cccnc1F Amb33377128 [0,1,0,0,0,0|2,0,0]=3 1922 B11R1.17 OCCCc1ccncc1Br Amb26577096 [0,1,0,0,0,0|2,0,0]=3 1923 B11R1.17 OCCCc1ccncc1Cl Amb23596495 [0,1,0,0,0,0|2,0,0]=3 1924 B11R1.17 OCCCc1ccncc1F Amb25825625 [0,1,0,0,0,0|2,0,0]=3 1925 B11R1.17 OCCCc1ccncc1O Amb27803932 [0,1,0,0,0,0|2,0,0]=3 1926 B11R1.17 OCCCc1cnccc1O Amb13889999 [0,1,0,0,0,0|2,0,0]=3 1927 B11R1.17 OCCCc1ncccc1Br Amb25273165 [0,1,0,0,0,0|2,0,0]=3 1928 B11R1.17 OCCCc1ncccc1Cl Amb32944661 [0,1,0,0,0,0|2,0,0]=3 1929 B11R1.17 OCCCc1ncccc1F Amb33418423 [0,1,0,0,0,0|2,0,0]=3 1930 B11R1.17 OCCCc1ncccc1O Amb18125538 [0,1,0,0,0,0|2,0,0]=3 1931 B11R1.17 OCCNc1ccccc1Br Amb6712178 [0,1,0,0,0,0|1,0,0]=2 1932 B11R1.17 OCCNc1ccccc1Cl Amb6712397 [0,1,0,0,0,0|1,0,0]=2 1933 B11R1.17 OCCNc1ccccc1F Amb6712587 [0,1,0,0,0,0|1,0,0]=2 1934 B11R1.17 OCCNc1ccncc1Br Amb27766939 [0,1,0,0,0,0|2,0,0]=3 1935 B11R1.17 OCCNc1ccncc1F Amb35737123 [0,1,0,0,0,0|2,0,0]=3 1936 B11R1.17 OCCNc1ncccc1Br Amb18292072 [0,1,0,0,0,0|2,0,0]=3 1937 B11R1.17 OCCNc1nccnc1Cl Amb2725329 [0,1,0,0,0,0|3,0,0]=4 1938 B11R1.17 OCCNc1nccnc1F Amb30018782 [0,1,0,0,0,0|3,0,0]=4 1939 B11R1.17 OCCOc1ccccc1Br Amb6702414 [0,1,0,0,0,0|0,0,0]=1 1940 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|0,0,0]=1 1941 B11R1.17 OCCOc1ccccc1F Amb9370651 [0,1,0,0,0,0|0,0,0]=1 1942 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|0,0,0]=1 1943 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|0,0,0]=1 1944 B11R1.17 OCCOc1cccnc1Cl Amb24486639 [0,1,0,0,0,0|1,0,0]=2 1945 B11R1.17 OCCOc1cccnc1O Amb25106031 [0,1,0,0,0,0|1,0,0]=2 1946 B11R1.17 OCCOc1ncccc1Br Amb23598436 [0,1,0,0,0,0|1,0,0]=2 1947 B11R1.17 OCCOc1ncccc1Cl Amb23598430 [0,1,0,0,0,0|1,0,0]=2 1948 B11R1.17 OCCOc1ncccc1O Amb13889705 [0,1,0,0,0,0|1,0,0]=2 1949 B11R1.17 OCCOc1nccnc1Cl Amb18183884 [0,1,0,0,0,0|2,0,0]=3 1950 B11R1.17 OCCOc1nccnc1F Amb35729093 [0,1,0,0,0,0|2,0,0]=3 1951 B11R1.17 OCCSc1ccccc1Br Amb2685464 [0,1,0,0,0,0|0,1,0]=2 1952 B11R1.17 OCCSc1ccccc1Cl Amb2686420 [0,1,0,0,0,0|0,1,0]=2 1953 B11R1.17 OCCSc1ccccc1F Amb2688392 [0,1,0,0,0,0|0,1,0]=2 1954 B11R1.17 OCCSc1ccccc1O Amb18177935 [0,1,0,0,0,0|0,1,0]=2 1955 B11R1.17 OCCSc1ccncc1F Amb30020309 [0,1,0,0,0,0|1,1,0]=3 1956 B11R1.17 OCCSc1ncccc1Cl Amb9238671 [0,1,0,0,0,0|1,1,0]=3 1957 B11R1.17 OCCSc1nccnc1F Amb35729432 [0,1,0,0,0,0|2,1,0]=4 1958 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [0,1,0,0,0,0|1,0,1]=3 1959 B11R1.17 OC\C=C\c1ccccc1Cl Amb8392444 [0,1,0,0,0,0|1,0,1]=3 1960 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [0,1,0,0,0,0|1,0,1]=3 1961 B11R1.17 OC\C=C\c1ccccc1O Amb33450068 [0,1,0,0,0,0|1,0,1]=3 1962 B11R1.17 OC\C=C\c1cccnc1Br Amb33387813 [0,1,0,0,0,0|2,0,1]=4 1963 B11R1.17 OC\C=C\c1cccnc1Cl Amb33262127 [0,1,0,0,0,0|2,0,1]=4 1964 B11R1.17 OC\C=C\c1cccnc1F Amb33377194 [0,1,0,0,0,0|2,0,1]=4 1965 B11R1.17 OC\C=C\c1ccncc1Br Amb33389509 [0,1,0,0,0,0|2,0,1]=4 1966 B11R1.17 OC\C=C\c1ccncc1Cl Amb33413772 [0,1,0,0,0,0|2,0,1]=4 1967 B11R1.17 OC\C=C\c1ccncc1F Amb33317171 [0,1,0,0,0,0|2,0,1]=4 1968 B11R1.17 OC\C=C\c1ncccc1F Amb33418873 [0,1,0,0,0,0|2,0,1]=4 1969 B11R1.17 OC\N=C\c1ccncc1O Amb27968146 [0,1,0,0,0,0|3,0,0]=4 1970 B11R1.17 Oc1ccccc1C#CCBr Amb26471032 [0,1,0,0,0,0|2,0,1]=4 1971 B11R1.17 Oc1ccccc1C#CCCl Amb27954200 [0,1,0,0,0,0|2,0,1]=4 1972 B11R1.17 Oc1ccccc1C#CCF Amb27494769 [0,1,0,0,0,0|2,0,1]=4 1973 B11R1.17 Oc1ccccc1C#CCI Amb27410610 [0,1,0,0,0,0|2,0,1]=4 1974 B11R1.17 Oc1ccccc1CCCBr Amb27667946 [0,1,0,0,0,0|2,0,0]=3 1975 B11R1.17 Oc1ccccc1CCCCl Amb17477721 [0,1,0,0,0,0|2,0,0]=3 1976 B11R1.17 Oc1ccccc1CCCS Amb26040563 [0,1,0,0,0,0|1,1,0]=3 1977 B11R1.17 Oc1ccccc1OCCCl Amb27595619 [0,1,0,0,0,0|1,0,0]=2 1978 B11R1.17 Oc1ccccc1OCCF Amb27601772 [0,1,0,0,0,0|1,0,0]=2 1979 B11R1.17 Oc1ccccc1\C=C/CBr Amb27759396 [0,1,0,0,0,0|2,0,1]=4 1980 B11R1.17 Oc1ccccc1\C=C\CCl Amb27848186 [0,1,0,0,0,0|2,0,1]=4 1981 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|1,1,0]=3 1982 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|1,1,0]=3 1983 B11R1.17 SCCCc1cccnc1Br Amb33388138 [0,1,0,0,0,0|2,1,0]=4 1984 B11R1.17 SCCCc1cccnc1Cl Amb33263115 [0,1,0,0,0,0|2,1,0]=4 1985 B11R1.17 SCCCc1ccncc1Br Amb33388696 [0,1,0,0,0,0|2,1,0]=4 1986 B11R1.17 SCCCc1ccncc1Cl Amb33413849 [0,1,0,0,0,0|2,1,0]=4 1987 B11R1.17 SCCCc1ncccc1Br Amb33336399 [0,1,0,0,0,0|2,1,0]=4 1988 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,1,0,0,0,0|0,1,0]=2 1989 B11R1.17 SCCOc1ccccc1Cl Amb6255607 [0,1,0,0,0,0|0,1,0]=2 1990 B11R1.17 SCCOc1ccccc1I Amb27761382 [0,1,0,0,0,0|0,1,0]=2 1991 B11R1.17 SCCSc1ccccc1Cl Amb27588702 [0,1,0,0,0,0|0,2,0]=3 1992 B11R1.17 [C-]#[N+]CCc1ccccc1Br Amb33387614 [0,1,0,0,0,0|3,0,0]=4 1993 B11R1.17 [C-]#[N+]CCc1ccccc1C Amb2689592 [0,1,0,0,0,0|3,0,0]=4 1994 B11R1.17 [C-]#[N+]CCc1ccccc1Cl Amb2686344 [0,1,0,0,0,0|3,0,0]=4 1995 B11R1.17 [C-]#[N+]CCc1ccccc1F Amb2688285 [0,1,0,0,0,0|3,0,0]=4 1996 B11R1.17 [O-][n+]1ccccc1CCCO Amb28384875 [0,1,0,0,0,0|2,0,0]=3 1997 B11R1.24 BrCC#Cc1cccc(Br)c1 Amb27960951 [0,1,0,0,0,0|2,0,1]=4 1998 B11R1.24 BrCC#Cc1cccc(I)c1 Amb25308173 [0,1,0,0,0,0|2,0,1]=4 1999 B11R1.24 BrCCCc1cccc(Br)c1 Amb17104576 [0,1,0,0,0,0|2,0,0]=3 2000 B11R1.24 BrCCCc1cccc(Br)n1 Amb33433525 [0,1,0,0,0,0|3,0,0]=4 2001 B11R1.24 BrCCCc1cncc(Br)c1 Amb28189670 [0,1,0,0,0,0|3,0,0]=4 2002 B11R1.24 BrCCOc1cccc(Br)c1 Amb1150981 [0,1,0,0,0,0|1,0,0]=2 2003 B11R1.24 BrCCOc1cncc(Br)c1 Amb26474247 [0,1,0,0,0,0|2,0,0]=3 2004 B11R1.24 BrCCSc1cccc(Br)c1 Amb27594209 [0,1,0,0,0,0|1,1,0]=3 2005 B11R1.24 BrC\C=C\c1cccc(Br)c1 Amb27401347 [0,1,0,0,0,0|2,0,1]=4 2006 B11R1.24 Brc1cccc(C#CCI)c1 Amb24447534 [0,1,0,0,0,0|2,0,1]=4 2007 B11R1.24 C#CCCc1cccc(Br)c1 Amb33451616 [0,1,0,0,0,0|2,0,1]=4 2008 B11R1.24 C#CCCc1cccc(C)c1 Amb33380572 [0,1,0,0,0,0|2,0,1]=4 2009 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|2,0,1]=4 2010 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|2,0,1]=4 2011 B11R1.24 C#CCCc1cccc(O)c1 Amb33312065 [0,1,0,0,0,0|2,0,1]=4 2012 B11R1.24 C#CCNc1cccc(Br)c1 Amb27838179 [0,1,0,0,0,0|2,0,1]=4 2013 B11R1.24 C#CCNc1cccc(C)c1 Amb27823265 [0,1,0,0,0,0|2,0,1]=4 2014 B11R1.24 C#CCNc1cccc(Cl)c1 Amb18800989 [0,1,0,0,0,0|2,0,1]=4 2015 B11R1.24 C#CCNc1cccc(F)c1 Amb24102181 [0,1,0,0,0,0|2,0,1]=4 2016 B11R1.24 C#CCNc1cccc(F)c1 Amb33330128 [0,1,0,0,0,0|2,0,1]=4 2017 B11R1.24 C#CCOc1cccc(Br)c1 Amb6257577 [0,1,0,0,0,0|1,0,1]=3 2018 B11R1.24 C#CCOc1cccc(Br)n1 Amb24370366 [0,1,0,0,0,0|2,0,1]=4 2019 B11R1.24 C#CCOc1cccc(C)c1 Amb19373318 [0,1,0,0,0,0|1,0,1]=3 2020 B11R1.24 C#CCOc1cccc(Cl)c1 Amb18183541 [0,1,0,0,0,0|1,0,1]=3 2021 B11R1.24 C#CCOc1cccc(F)c1 Amb18182728 [0,1,0,0,0,0|1,0,1]=3 2022 B11R1.24 C#CCOc1cccc(I)c1 Amb27779244 [0,1,0,0,0,0|1,0,1]=3 2023 B11R1.24 C#CCOc1cccc(N)c1 Amb13783680 [0,1,0,0,0,0|1,0,1]=3 2024 B11R1.24 C#CCOc1cccc(O)c1 Amb33528803 [0,1,0,0,0,0|1,0,1]=3 2025 B11R1.24 C#CCOc1ccnc(C)c1 Amb28122079 [0,1,0,0,0,0|2,0,1]=4 2026 B11R1.24 C#CCOc1ccnc(F)c1 Amb27823677 [0,1,0,0,0,0|2,0,1]=4 2027 B11R1.24 C#CCOc1cncc(N)c1 Amb28284916 [0,1,0,0,0,0|2,0,1]=4 2028 B11R1.24 C=CCCc1cccc(Br)c1 Amb6298948 [0,1,0,0,0,0|2,0,1]=4 2029 B11R1.24 C=CCCc1cccc(Cl)c1 Amb6298971 [0,1,0,0,0,0|2,0,1]=4 2030 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|2,0,1]=4 2031 B11R1.24 C=CCNc1cccc(Br)c1 Amb17306222 [0,1,0,0,0,0|2,0,1]=4 2032 B11R1.24 C=CCNc1cccc(C)c1 Amb17306547 [0,1,0,0,0,0|2,0,1]=4 2033 B11R1.24 C=CCNc1cccc(Cl)c1 Amb17307127 [0,1,0,0,0,0|2,0,1]=4 2034 B11R1.24 C=CCNc1cccc(F)c1 Amb17306228 [0,1,0,0,0,0|2,0,1]=4 2035 B11R1.24 C=CCNc1cccc(N)c1 Amb8394241 [0,1,0,0,0,0|2,0,1]=4 2036 B11R1.24 C=CCOc1cccc(Br)c1 Amb6263292 [0,1,0,0,0,0|1,0,1]=3 2037 B11R1.24 C=CCOc1cccc(Br)n1 Amb27804353 [0,1,0,0,0,0|2,0,1]=4 2038 B11R1.24 C=CCOc1cccc(C)n1 Amb25752190 [0,1,0,0,0,0|2,0,1]=4 2039 B11R1.24 C=CCOc1cccc(Cl)c1 Amb27223591 [0,1,0,0,0,0|1,0,1]=3 2040 B11R1.24 C=CCOc1cccc(N)c1 Amb2094493 [0,1,0,0,0,0|1,0,1]=3 2041 B11R1.24 C=CCOc1cccc(N)c1 Amb33527291 [0,1,0,0,0,0|1,0,1]=3 2042 B11R1.24 C=CCOc1cccc(O)c1 Amb8837461 [0,1,0,0,0,0|1,0,1]=3 2043 B11R1.24 C=CCOc1ccnc(N)c1 Amb27870562 [0,1,0,0,0,0|2,0,1]=4 2044 B11R1.24 C=CCOc1cncc(Br)c1 Amb25128103 [0,1,0,0,0,0|2,0,1]=4 2045 B11R1.24 C=CCOc1cncc(Cl)c1 Amb27849069 [0,1,0,0,0,0|2,0,1]=4 2046 B11R1.24 C=CCSc1cccc(Br)c1 Amb26071614 [0,1,0,0,0,0|1,1,1]=4 2047 B11R1.24 C=CCSc1cccc(Cl)c1 Amb26924103 [0,1,0,0,0,0|1,1,1]=4 2048 B11R1.24 C=CCSc1cccc(F)c1 Amb26648175 [0,1,0,0,0,0|1,1,1]=4 2049 B11R1.24 CCC#Cc1cccc(Br)c1 Amb27879679 [0,1,0,0,0,0|2,0,1]=4 2050 B11R1.24 CCC#Cc1cccc(C)c1 Amb28185115 [0,1,0,0,0,0|2,0,1]=4 2051 B11R1.24 CCC#Cc1cccc(Cl)c1 Amb27653230 [0,1,0,0,0,0|2,0,1]=4 2052 B11R1.24 CCC#Cc1cccc(F)c1 Amb28061236 [0,1,0,0,0,0|2,0,1]=4 2053 B11R1.24 CCC#Cc1cccc(I)c1 Amb27436600 [0,1,0,0,0,0|2,0,1]=4 2054 B11R1.24 CCC#Cc1cccc(N)c1 Amb26513950 [0,1,0,0,0,0|2,0,1]=4 2055 B11R1.24 CCC#Cc1cccc(O)c1 Amb25139990 [0,1,0,0,0,0|2,0,1]=4 2056 B11R1.24 CCCCC1=CC(=O)C=CS1 Amb27855025 [0,1,0,0,0,0|3,0,0]=4 2057 B11R1.24 CCCCC1=CC(=S)C=CN1 Amb28119415 [0,1,0,0,0,0|3,0,0]=4 2058 B11R1.24 CCCC[n+]1cccc(C)c1 Amb22411627 [0,1,0,0,0,0|3,0,0]=4 2059 B11R1.24 CCCC[n+]1cccc(C)c1 Amb24323548 [0,1,0,0,0,0|3,0,0]=4 2060 B11R1.24 CCCC[n+]1cccc(C)c1 Amb33934312 [0,1,0,0,0,0|3,0,0]=4 2061 B11R1.24 CCCCc1cc(Br)ccn1 Amb24083005 [0,1,0,0,0,0|3,0,0]=4 2062 B11R1.24 CCCCc1cc(N)ccn1 Amb30010808 [0,1,0,0,0,0|3,0,0]=4 2063 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|2,0,0]=3 2064 B11R1.24 CCCCc1cccc(C)c1 Amb22730119 [0,1,0,0,0,0|2,0,0]=3 2065 B11R1.24 CCCCc1cccc(Cl)c1 Amb26984112 [0,1,0,0,0,0|2,0,0]=3 2066 B11R1.24 CCCCc1cccc(F)c1 Amb27221595 [0,1,0,0,0,0|2,0,0]=3 2067 B11R1.24 CCCCc1cccc(F)n1 Amb28280759 [0,1,0,0,0,0|3,0,0]=4 2068 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|2,0,0]=3 2069 B11R1.24 CCCCc1cccc(N)c1 Amb17593719 [0,1,0,0,0,0|2,0,0]=3 2070 B11R1.24 CCCCc1cccc(N)n1 Amb18644442 [0,1,0,0,0,0|3,0,0]=4 2071 B11R1.24 CCCCc1cccc(O)c1 Amb26463186 [0,1,0,0,0,0|2,0,0]=3 2072 B11R1.24 CCCCc1ccnc(C)c1 Amb27176838 [0,1,0,0,0,0|3,0,0]=4 2073 B11R1.24 CCCCc1ccnc(Cl)c1 Amb27250650 [0,1,0,0,0,0|3,0,0]=4 2074 B11R1.24 CCCCc1ccnc(O)c1 Amb22749775 [0,1,0,0,0,0|3,0,0]=4 2075 B11R1.24 CCCCc1cncc(O)c1 Amb28383031 [0,1,0,0,0,0|3,0,0]=4 2076 B11R1.24 CCCCc1cncc(S)c1 Amb33276291 [0,1,0,0,0,0|3,0,0]=4 2077 B11R1.24 CCCNc1cc(Br)ccn1 Amb19959557 [0,1,0,0,0,0|3,0,0]=4 2078 B11R1.24 CCCNc1cc(N)ccn1 Amb17334314 [0,1,0,0,0,0|3,0,0]=4 2079 B11R1.24 CCCNc1cccc(Br)c1 Amb6696672 [0,1,0,0,0,0|2,0,0]=3 2080 B11R1.24 CCCNc1cccc(Br)n1 Amb22831396 [0,1,0,0,0,0|3,0,0]=4 2081 B11R1.24 CCCNc1cccc(Br)n1 Amb25145786 [0,1,0,0,0,0|3,0,0]=4 2082 B11R1.24 CCCNc1cccc(C)c1 Amb6684516 [0,1,0,0,0,0|2,0,0]=3 2083 B11R1.24 CCCNc1cccc(Cl)c1 Amb6695728 [0,1,0,0,0,0|2,0,0]=3 2084 B11R1.24 CCCNc1cccc(Cl)n1 Amb21958678 [0,1,0,0,0,0|3,0,0]=4 2085 B11R1.24 CCCNc1cccc(F)c1 Amb6695885 [0,1,0,0,0,0|2,0,0]=3 2086 B11R1.24 CCCNc1cccc(F)n1 Amb18973532 [0,1,0,0,0,0|3,0,0]=4 2087 B11R1.24 CCCNc1cccc(N)c1 Amb8825430 [0,1,0,0,0,0|2,0,0]=3 2088 B11R1.24 CCCNc1ccnc(Br)c1 Amb27432407 [0,1,0,0,0,0|3,0,0]=4 2089 B11R1.24 CCCNc1ccnc(C)c1 Amb27637577 [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.24 CCCNc1ccnc(Cl)c1 Amb27989155 [0,1,0,0,0,0|3,0,0]=4 2091 B11R1.24 CCCNc1ccnc(F)c1 Amb27263304 [0,1,0,0,0,0|3,0,0]=4 2092 B11R1.24 CCCOc1cc(Br)ccn1 Amb10599830 [0,1,0,0,0,0|2,0,0]=3 2093 B11R1.24 CCCOc1cc(N)ccn1 Amb18981543 [0,1,0,0,0,0|2,0,0]=3 2094 B11R1.24 CCCOc1cccc(Br)c1 Amb33532692 [0,1,0,0,0,0|1,0,0]=2 2095 B11R1.24 CCCOc1cccc(Br)n1 Amb10599306 [0,1,0,0,0,0|2,0,0]=3 2096 B11R1.24 CCCOc1cccc(C)c1 Amb10573406 [0,1,0,0,0,0|1,0,0]=2 2097 B11R1.24 CCCOc1cccc(Cl)c1 Amb25787001 [0,1,0,0,0,0|1,0,0]=2 2098 B11R1.24 CCCOc1cccc(F)c1 Amb25700428 [0,1,0,0,0,0|1,0,0]=2 2099 B11R1.24 CCCOc1cccc(I)c1 Amb27393748 [0,1,0,0,0,0|1,0,0]=2 2100 B11R1.24 CCCOc1cccc(N)c1 Amb1138945 [0,1,0,0,0,0|1,0,0]=2 2101 B11R1.24 CCCOc1cccc(N)n1 Amb2610093 [0,1,0,0,0,0|2,0,0]=3 2102 B11R1.24 CCCOc1cccc(O)c1 Amb8837439 [0,1,0,0,0,0|1,0,0]=2 2103 B11R1.24 CCCOc1cccc(S)c1 Amb26554006 [0,1,0,0,0,0|1,0,0]=2 2104 B11R1.24 CCCOc1ccnc(Br)c1 Amb10599900 [0,1,0,0,0,0|2,0,0]=3 2105 B11R1.24 CCCOc1ccnc(Cl)n1 Amb18803313 [0,1,0,0,0,0|3,0,0]=4 2106 B11R1.24 CCCOc1ccnc(F)n1 Amb35657244 [0,1,0,0,0,0|3,0,0]=4 2107 B11R1.24 CCCOc1ccnc(N)c1 Amb20617625 [0,1,0,0,0,0|2,0,0]=3 2108 B11R1.24 CCCOc1ccnc(N)n1 Amb25719528 [0,1,0,0,0,0|3,0,0]=4 2109 B11R1.24 CCCOc1ccnc(S)n1 Amb1935164 [0,1,0,0,0,0|3,0,0]=4 2110 B11R1.24 CCCOc1cncc(Br)c1 Amb19959579 [0,1,0,0,0,0|2,0,0]=3 2111 B11R1.24 CCCOc1cncc(Br)n1 Amb10600300 [0,1,0,0,0,0|3,0,0]=4 2112 B11R1.24 CCCOc1cncc(C)n1 Amb4018987 [0,1,0,0,0,0|3,0,0]=4 2113 B11R1.24 CCCOc1cncc(Cl)c1 Amb27593846 [0,1,0,0,0,0|2,0,0]=3 2114 B11R1.24 CCCOc1cncc(Cl)n1 Amb8874792 [0,1,0,0,0,0|3,0,0]=4 2115 B11R1.24 CCCOc1cncc(F)n1 Amb35700948 [0,1,0,0,0,0|3,0,0]=4 2116 B11R1.24 CCCOc1cncc(I)c1 Amb32685573 [0,1,0,0,0,0|2,0,0]=3 2117 B11R1.24 CCCOc1cncc(N)c1 Amb24320310 [0,1,0,0,0,0|2,0,0]=3 2118 B11R1.24 CCCOc1cncc(N)n1 Amb20617837 [0,1,0,0,0,0|3,0,0]=4 2119 B11R1.24 CCCOc1cncc(O)c1 Amb28118678 [0,1,0,0,0,0|2,0,0]=3 2120 B11R1.24 CCCOc1nccc(Br)n1 Amb10599666 [0,1,0,0,0,0|3,0,0]=4 2121 B11R1.24 CCCOc1nccc(Cl)n1 Amb24319622 [0,1,0,0,0,0|3,0,0]=4 2122 B11R1.24 CCCSc1cc(N)ccn1 Amb18293405 [0,1,0,0,0,0|2,1,0]=4 2123 B11R1.24 CCCSc1cccc(Br)c1 Amb24538191 [0,1,0,0,0,0|1,1,0]=3 2124 B11R1.24 CCCSc1cccc(C)c1 Amb28315009 [0,1,0,0,0,0|1,1,0]=3 2125 B11R1.24 CCCSc1cccc(C)n1 Amb28066111 [0,1,0,0,0,0|2,1,0]=4 2126 B11R1.24 CCCSc1cccc(Cl)c1 Amb25801816 [0,1,0,0,0,0|1,1,0]=3 2127 B11R1.24 CCCSc1cccc(Cl)n1 Amb28136140 [0,1,0,0,0,0|2,1,0]=4 2128 B11R1.24 CCCSc1cccc(F)n1 Amb18177984 [0,1,0,0,0,0|2,1,0]=4 2129 B11R1.24 CCCSc1cccc(N)c1 Amb18289141 [0,1,0,0,0,0|1,1,0]=3 2130 B11R1.24 CCCSc1cccc(N)n1 Amb26455919 [0,1,0,0,0,0|2,1,0]=4 2131 B11R1.24 CCCSc1cccc(S)c1 Amb26337168 [0,1,0,0,0,0|1,1,0]=3 2132 B11R1.24 CCCSc1ccnc(Cl)c1 Amb27461412 [0,1,0,0,0,0|2,1,0]=4 2133 B11R1.24 CCCSc1cncc(C)c1 Amb28365669 [0,1,0,0,0,0|2,1,0]=4 2134 B11R1.24 CCCSc1cncc(Cl)c1 Amb27240056 [0,1,0,0,0,0|2,1,0]=4 2135 B11R1.24 CCCSc1cncc(N)c1 Amb27176777 [0,1,0,0,0,0|2,1,0]=4 2136 B11R1.24 CCNCc1cccc(Br)c1 Amb13949217 [0,1,0,0,0,0|3,0,0]=4 2137 B11R1.24 CCNCc1cccc(Br)c1 Amb838402 [0,1,0,0,0,0|3,0,0]=4 2138 B11R1.24 CCNCc1cccc(C)c1 Amb6242953 [0,1,0,0,0,0|3,0,0]=4 2139 B11R1.24 CCNCc1cccc(Cl)c1 Amb29845814 [0,1,0,0,0,0|3,0,0]=4 2140 B11R1.24 CCNCc1cccc(Cl)c1 Amb6245035 [0,1,0,0,0,0|3,0,0]=4 2141 B11R1.24 CCNCc1cccc(F)c1 Amb435909 [0,1,0,0,0,0|3,0,0]=4 2142 B11R1.24 CCNCc1cccc(O)c1 Amb6260672 [0,1,0,0,0,0|3,0,0]=4 2143 B11R1.24 CCOCc1cccc(Br)c1 Amb23512545 [0,1,0,0,0,0|3,0,0]=4 2144 B11R1.24 CCOCc1cccc(Cl)c1 Amb24486866 [0,1,0,0,0,0|3,0,0]=4 2145 B11R1.24 CCOCc1cccc(N)c1 Amb6244214 [0,1,0,0,0,0|3,0,0]=4 2146 B11R1.24 CCOCc1cccc(O)c1 Amb23443319 [0,1,0,0,0,0|3,0,0]=4 2147 B11R1.24 CCSCc1cccc(Br)c1 Amb24476579 [0,1,0,0,0,0|3,0,0]=4 2148 B11R1.24 CCSCc1cccc(Cl)c1 Amb25891456 [0,1,0,0,0,0|3,0,0]=4 2149 B11R1.24 CCSCc1cccc(F)c1 Amb27406048 [0,1,0,0,0,0|3,0,0]=4 2150 B11R1.24 CCSCc1cccc(N)c1 Amb6680425 [0,1,0,0,0,0|3,0,0]=4 2151 B11R1.24 CC\C=C\c1cccc(O)c1 Amb16231489 [0,1,0,0,0,0|2,0,1]=4 2152 B11R1.24 CNCCc1cccc(Br)c1 Amb16230486 [0,1,0,0,0,0|3,0,0]=4 2153 B11R1.24 CNCCc1cccc(Br)c1 Amb28652826 [0,1,0,0,0,0|3,0,0]=4 2154 B11R1.24 CNCCc1cccc(C)c1 Amb16230487 [0,1,0,0,0,0|3,0,0]=4 2155 B11R1.24 CNCCc1cccc(Cl)c1 Amb5785537 [0,1,0,0,0,0|3,0,0]=4 2156 B11R1.24 CNCCc1cccc(F)c1 Amb8841505 [0,1,0,0,0,0|3,0,0]=4 2157 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|3,0,0]=4 2158 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|3,0,0]=4 2159 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|3,0,0]=4 2160 B11R1.24 COCOc1cccc(Br)c1 Amb25810590 [0,1,0,0,0,0|2,0,0]=3 2161 B11R1.24 COCOc1cccc(C)c1 Amb27169027 [0,1,0,0,0,0|2,0,0]=3 2162 B11R1.24 COCOc1cccc(Cl)c1 Amb24551706 [0,1,0,0,0,0|2,0,0]=3 2163 B11R1.24 COCOc1cccc(Cl)n1 Amb27167042 [0,1,0,0,0,0|3,0,0]=4 2164 B11R1.24 COCOc1cccc(F)c1 Amb21858121 [0,1,0,0,0,0|2,0,0]=3 2165 B11R1.24 COCOc1cccc(N)c1 Amb25096531 [0,1,0,0,0,0|2,0,0]=3 2166 B11R1.24 COCOc1cccc(O)c1 Amb26575320 [0,1,0,0,0,0|2,0,0]=3 2167 B11R1.24 COCOc1cncc(Br)c1 Amb25742269 [0,1,0,0,0,0|3,0,0]=4 2168 B11R1.24 COCSc1cccc(Br)c1 Amb27196993 [0,1,0,0,0,0|2,1,0]=4 2169 B11R1.24 CSCSc1cccc(C)c1 Amb27172833 [0,1,0,0,0,0|2,1,0]=4 2170 B11R1.24 CSCSc1cccc(O)c1 Amb28201670 [0,1,0,0,0,0|2,1,0]=4 2171 B11R1.24 Cc1cc(CCCBr)ccn1 Amb26334266 [0,1,0,0,0,0|3,0,0]=4 2172 B11R1.24 Cc1cc(CCCN)ccn1 Amb18201861 [0,1,0,0,0,0|3,0,0]=4 2173 B11R1.24 Cc1cc(CCCO)ccn1 Amb2694528 [0,1,0,0,0,0|2,0,0]=3 2174 B11R1.24 Cc1cc(CCCS)ccn1 Amb32732789 [0,1,0,0,0,0|2,1,0]=4 2175 B11R1.24 Cc1cc(NCCCl)ccn1 Amb28050822 [0,1,0,0,0,0|3,0,0]=4 2176 B11R1.24 Cc1cc(NCCO)ccn1 Amb27453034 [0,1,0,0,0,0|2,0,0]=3 2177 B11R1.24 Cc1cc(OCCN)ccn1 Amb25961559 [0,1,0,0,0,0|2,0,0]=3 2178 B11R1.24 Cc1cc(OCCN)ncn1 Amb18988884 [0,1,0,0,0,0|3,0,0]=4 2179 B11R1.24 Cc1cc(SCCO)ncn1 Amb18177938 [0,1,0,0,0,0|2,1,0]=4 2180 B11R1.24 Cc1cc(\C=C\CO)ccn1 Amb32733165 [0,1,0,0,0,0|2,0,1]=4 2181 B11R1.24 Cc1cccc(C#CCBr)c1 Amb27873356 [0,1,0,0,0,0|2,0,1]=4 2182 B11R1.24 Cc1cccc(C#CCCl)c1 Amb18792611 [0,1,0,0,0,0|2,0,1]=4 2183 B11R1.24 Cc1cccc(C#CCF)c1 Amb25947903 [0,1,0,0,0,0|2,0,1]=4 2184 B11R1.24 Cc1cccc(C#CCN)c1 Amb18949797 [0,1,0,0,0,0|2,0,1]=4 2185 B11R1.24 Cc1cccc(C#CCO)c1 Amb27654727 [0,1,0,0,0,0|1,0,1]=3 2186 B11R1.24 Cc1cccc(C#CCO)n1 Amb25169280 [0,1,0,0,0,0|2,0,1]=4 2187 B11R1.24 Cc1cccc(CCC#N)c1 Amb17204296 [0,1,0,0,0,0|2,0,1]=4 2188 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [0,1,0,0,0,0|1,0,2]=4 2189 B11R1.24 Cc1cccc(CCCBr)c1 Amb17104553 [0,1,0,0,0,0|2,0,0]=3 2190 B11R1.24 Cc1cccc(CCCBr)n1 Amb33336293 [0,1,0,0,0,0|3,0,0]=4 2191 B11R1.24 Cc1cccc(CCCCl)c1 Amb17104526 [0,1,0,0,0,0|2,0,0]=3 2192 B11R1.24 Cc1cccc(CCCN)c1 Amb844760 [0,1,0,0,0,0|2,0,0]=3 2193 B11R1.24 Cc1cccc(CCCN)n1 Amb8009830 [0,1,0,0,0,0|3,0,0]=4 2194 B11R1.24 Cc1cccc(CCCO)c1 Amb17089495 [0,1,0,0,0,0|1,0,0]=2 2195 B11R1.24 Cc1cccc(CCCO)n1 Amb2694519 [0,1,0,0,0,0|2,0,0]=3 2196 B11R1.24 Cc1cccc(CCCS)c1 Amb17400219 [0,1,0,0,0,0|1,1,0]=3 2197 B11R1.24 Cc1cccc(CCCS)n1 Amb33226187 [0,1,0,0,0,0|2,1,0]=4 2198 B11R1.24 Cc1cccc(CCNN)c1 Amb17399915 [0,1,0,0,0,0|3,0,0]=4 2199 B11R1.24 Cc1cccc(CCON)c1 Amb25704227 [0,1,0,0,0,0|3,0,0]=4 2200 B11R1.24 Cc1cccc(CC[Zn]Br)c1 Amb6300300 [0,1,0,0,0,0|3,0,0]=4 2201 B11R1.24 Cc1cccc(NCC#N)c1 Amb6706712 [0,1,0,0,0,0|2,0,1]=4 2202 B11R1.24 Cc1cccc(NCCBr)c1 Amb27839685 [0,1,0,0,0,0|2,0,0]=3 2203 B11R1.24 Cc1cccc(NCCCl)c1 Amb17334786 [0,1,0,0,0,0|2,0,0]=3 2204 B11R1.24 Cc1cccc(NCCN)c1 Amb17057745 [0,1,0,0,0,0|2,0,0]=3 2205 B11R1.24 Cc1cccc(NCCN)n1 Amb18970380 [0,1,0,0,0,0|3,0,0]=4 2206 B11R1.24 Cc1cccc(NCCN)n1 Amb19440303 [0,1,0,0,0,0|3,0,0]=4 2207 B11R1.24 Cc1cccc(NCCO)c1 Amb6706757 [0,1,0,0,0,0|1,0,0]=2 2208 B11R1.24 Cc1cccc(NCCO)n1 Amb18290373 [0,1,0,0,0,0|2,0,0]=3 2209 B11R1.24 Cc1cccc(OCC#N)c1 Amb5780889 [0,1,0,0,0,0|1,0,1]=3 2210 B11R1.24 Cc1cccc(OCC=O)c1 Amb5731820 [0,1,0,0,0,0|0,0,2]=3 2211 B11R1.24 Cc1cccc(OCCBr)c1 Amb1643479 [0,1,0,0,0,0|1,0,0]=2 2212 B11R1.24 Cc1cccc(OCCCl)c1 Amb9209776 [0,1,0,0,0,0|1,0,0]=2 2213 B11R1.24 Cc1cccc(OCCI)c1 Amb27260656 [0,1,0,0,0,0|1,0,0]=2 2214 B11R1.24 Cc1cccc(OCCN)c1 Amb1098983 [0,1,0,0,0,0|1,0,0]=2 2215 B11R1.24 Cc1cccc(OCCN)c1 Amb4008296 [0,1,0,0,0,0|1,0,0]=2 2216 B11R1.24 Cc1cccc(OCCN)n1 Amb18296490 [0,1,0,0,0,0|2,0,0]=3 2217 B11R1.24 Cc1cccc(OCCO)c1 Amb2209346 [0,1,0,0,0,0|0,0,0]=1 2218 B11R1.24 Cc1cccc(OCCO)n1 Amb22900069 [0,1,0,0,0,0|1,0,0]=2 2219 B11R1.24 Cc1cccc(OCCS)c1 Amb17232680 [0,1,0,0,0,0|0,1,0]=2 2220 B11R1.24 Cc1cccc(O\C=C\Cl)c1 Amb27471988 [0,1,0,0,0,0|1,0,2]=4 2221 B11R1.24 Cc1cccc(SCC#N)c1 Amb18788233 [0,1,0,0,0,0|1,1,1]=4 2222 B11R1.24 Cc1cccc(SCC=O)c1 Amb17082932 [0,1,0,0,0,0|0,1,2]=4 2223 B11R1.24 Cc1cccc(SCCBr)c1 Amb24753608 [0,1,0,0,0,0|1,1,0]=3 2224 B11R1.24 Cc1cccc(SCCCl)n1 Amb19059627 [0,1,0,0,0,0|2,1,0]=4 2225 B11R1.24 Cc1cccc(SCCN)c1 Amb17083043 [0,1,0,0,0,0|1,1,0]=3 2226 B11R1.24 Cc1cccc(\C=C\CN)c1 Amb18065182 [0,1,0,0,0,0|2,0,1]=4 2227 B11R1.24 Cc1cccc(\C=C\CO)c1 Amb23442940 [0,1,0,0,0,0|1,0,1]=3 2228 B11R1.24 Cc1cccc(\C=C\CO)n1 Amb33201938 [0,1,0,0,0,0|2,0,1]=4 2229 B11R1.24 Cc1ccnc(C#CCO)c1 Amb27244944 [0,1,0,0,0,0|2,0,1]=4 2230 B11R1.24 Cc1ccnc(CCCBr)c1 Amb33387659 [0,1,0,0,0,0|3,0,0]=4 2231 B11R1.24 Cc1ccnc(CCCN)c1 Amb18201862 [0,1,0,0,0,0|3,0,0]=4 2232 B11R1.24 Cc1ccnc(CCCN)c1 Amb22886487 [0,1,0,0,0,0|3,0,0]=4 2233 B11R1.24 Cc1ccnc(CCCO)c1 Amb26476245 [0,1,0,0,0,0|2,0,0]=3 2234 B11R1.24 Cc1ccnc(CCCS)c1 Amb33317781 [0,1,0,0,0,0|2,1,0]=4 2235 B11R1.24 Cc1ccnc(NCCN)c1 Amb10607842 [0,1,0,0,0,0|3,0,0]=4 2236 B11R1.24 Cc1ccnc(NCCO)c1 Amb18981411 [0,1,0,0,0,0|2,0,0]=3 2237 B11R1.24 Cc1ccnc(NCCO)c1 Amb19374562 [0,1,0,0,0,0|2,0,0]=3 2238 B11R1.24 Cc1ccnc(NCCO)n1 Amb19000715 [0,1,0,0,0,0|3,0,0]=4 2239 B11R1.24 Cc1ccnc(OCCN)c1 Amb18988887 [0,1,0,0,0,0|2,0,0]=3 2240 B11R1.24 Cc1ccnc(SCCN)c1 Amb18908763 [0,1,0,0,0,0|2,1,0]=4 2241 B11R1.24 Cc1ccnc(\C=C\CO)c1 Amb27650189 [0,1,0,0,0,0|2,0,1]=4 2242 B11R1.24 Cc1cncc(CCCBr)c1 Amb26606564 [0,1,0,0,0,0|3,0,0]=4 2243 B11R1.24 Cc1cncc(CCCN)c1 Amb24509275 [0,1,0,0,0,0|3,0,0]=4 2244 B11R1.24 Cc1cncc(CCCO)c1 Amb26350639 [0,1,0,0,0,0|2,0,0]=3 2245 B11R1.24 Cc1cncc(CCCS)c1 Amb33316889 [0,1,0,0,0,0|2,1,0]=4 2246 B11R1.24 Cc1cncc(OCCN)c1 Amb33317154 [0,1,0,0,0,0|2,0,0]=3 2247 B11R1.24 Cc1cncc(\C=C\CO)c1 Amb33317992 [0,1,0,0,0,0|2,0,1]=4 2248 B11R1.24 ClCC#Cc1cccc(Br)c1 Amb25132294 [0,1,0,0,0,0|2,0,1]=4 2249 B11R1.24 ClCC#Cc1cccc(Cl)c1 Amb19067004 [0,1,0,0,0,0|2,0,1]=4 2250 B11R1.24 ClCCCc1cccc(Br)c1 Amb17104548 [0,1,0,0,0,0|2,0,0]=3 2251 B11R1.24 ClCCCc1cccc(Cl)c1 Amb17104534 [0,1,0,0,0,0|2,0,0]=3 2252 B11R1.24 ClCCCc1cncc(Br)c1 Amb27478439 [0,1,0,0,0,0|3,0,0]=4 2253 B11R1.24 ClCCCc1cncc(Cl)c1 Amb32691049 [0,1,0,0,0,0|3,0,0]=4 2254 B11R1.24 ClCCNc1cccc(Br)c1 Amb17346197 [0,1,0,0,0,0|2,0,0]=3 2255 B11R1.24 ClCCNc1cccc(Cl)c1 Amb17336181 [0,1,0,0,0,0|2,0,0]=3 2256 B11R1.24 ClCCOc1cccc(Br)c1 Amb8828434 [0,1,0,0,0,0|1,0,0]=2 2257 B11R1.24 ClCCOc1cccc(Cl)c1 Amb9209777 [0,1,0,0,0,0|1,0,0]=2 2258 B11R1.24 ClCCOc1cccc(I)c1 Amb8838634 [0,1,0,0,0,0|1,0,0]=2 2259 B11R1.24 ClCCOc1cncc(Br)c1 Amb27617408 [0,1,0,0,0,0|2,0,0]=3 2260 B11R1.24 ClCCOc1cncc(Cl)c1 Amb28314125 [0,1,0,0,0,0|2,0,0]=3 2261 B11R1.24 ClCCSc1cccc(Br)c1 Amb25887053 [0,1,0,0,0,0|1,1,0]=3 2262 B11R1.24 ClCOCc1cccc(Br)c1 Amb27489432 [0,1,0,0,0,0|3,0,0]=4 2263 B11R1.24 Clc1cc(CCCBr)ccn1 Amb33435698 [0,1,0,0,0,0|3,0,0]=4 2264 B11R1.24 Clc1cccc(C#CCBr)c1 Amb24437476 [0,1,0,0,0,0|2,0,1]=4 2265 B11R1.24 Clc1cccc(C#CCI)c1 Amb25978158 [0,1,0,0,0,0|2,0,1]=4 2266 B11R1.24 Clc1cccc(CCCBr)c1 Amb17104561 [0,1,0,0,0,0|2,0,0]=3 2267 B11R1.24 Clc1cccc(CCCBr)n1 Amb33006851 [0,1,0,0,0,0|3,0,0]=4 2268 B11R1.24 Clc1cccc(OCCBr)c1 Amb1152965 [0,1,0,0,0,0|1,0,0]=2 2269 B11R1.24 Clc1cccc(SCCBr)c1 Amb27403537 [0,1,0,0,0,0|1,1,0]=3 2270 B11R1.24 Clc1ccnc(CCCBr)c1 Amb33432325 [0,1,0,0,0,0|3,0,0]=4 2271 B11R1.24 Clc1cncc(CCCBr)c1 Amb32691050 [0,1,0,0,0,0|3,0,0]=4 2272 B11R1.24 Clc1cncc(OCCBr)c1 Amb25886996 [0,1,0,0,0,0|2,0,0]=3 2273 B11R1.24 FCC#Cc1cccc(Br)c1 Amb25891530 [0,1,0,0,0,0|2,0,1]=4 2274 B11R1.24 FCC#Cc1cccc(Cl)c1 Amb26996249 [0,1,0,0,0,0|2,0,1]=4 2275 B11R1.24 FCC#Cc1cccc(F)c1 Amb27631331 [0,1,0,0,0,0|2,0,1]=4 2276 B11R1.24 FCCNc1cccc(Br)n1 Amb27753223 [0,1,0,0,0,0|3,0,0]=4 2277 B11R1.24 FCCNc1cccc(Cl)n1 Amb27425167 [0,1,0,0,0,0|3,0,0]=4 2278 B11R1.24 FCCNc1cncc(Br)c1 Amb27832901 [0,1,0,0,0,0|3,0,0]=4 2279 B11R1.24 FCCNc1cncc(Cl)c1 Amb35706905 [0,1,0,0,0,0|3,0,0]=4 2280 B11R1.24 FCCOc1cccc(Br)c1 Amb22227889 [0,1,0,0,0,0|1,0,0]=2 2281 B11R1.24 FCCOc1cccc(Cl)c1 Amb24659046 [0,1,0,0,0,0|1,0,0]=2 2282 B11R1.24 FCCOc1cccc(F)c1 Amb22232794 [0,1,0,0,0,0|1,0,0]=2 2283 B11R1.24 FCCOc1cccc(I)c1 Amb27823595 [0,1,0,0,0,0|1,0,0]=2 2284 B11R1.24 FCCOc1cncc(Br)c1 Amb28068366 [0,1,0,0,0,0|2,0,0]=3 2285 B11R1.24 FCCOc1nccc(Br)n1 Amb32938571 [0,1,0,0,0,0|3,0,0]=4 2286 B11R1.24 FCCSc1cccc(Br)c1 Amb28140426 [0,1,0,0,0,0|1,1,0]=3 2287 B11R1.24 Fc1cccc(C#CCBr)c1 Amb26964608 [0,1,0,0,0,0|2,0,1]=4 2288 B11R1.24 Fc1cccc(C#CCCl)c1 Amb18180185 [0,1,0,0,0,0|2,0,1]=4 2289 B11R1.24 Fc1cccc(C#CCI)c1 Amb25797661 [0,1,0,0,0,0|2,0,1]=4 2290 B11R1.24 Fc1cccc(CCCBr)c1 Amb22886712 [0,1,0,0,0,0|2,0,0]=3 2291 B11R1.24 Fc1cccc(CCCCl)c1 Amb18803316 [0,1,0,0,0,0|2,0,0]=3 2292 B11R1.24 Fc1cccc(CCCS)c1 Amb18065480 [0,1,0,0,0,0|1,1,0]=3 2293 B11R1.24 Fc1cccc(NCCCl)c1 Amb17334966 [0,1,0,0,0,0|2,0,0]=3 2294 B11R1.24 Fc1cccc(OCCBr)c1 Amb6255620 [0,1,0,0,0,0|1,0,0]=2 2295 B11R1.24 Fc1cccc(OCCCl)c1 Amb8828438 [0,1,0,0,0,0|1,0,0]=2 2296 B11R1.24 Fc1cccc(OCCS)c1 Amb17232867 [0,1,0,0,0,0|0,1,0]=2 2297 B11R1.24 Fc1cccc(SCCBr)c1 Amb26633460 [0,1,0,0,0,0|1,1,0]=3 2298 B11R1.24 Fc1ccnc(CCCBr)c1 Amb33384902 [0,1,0,0,0,0|3,0,0]=4 2299 B11R1.24 Fc1ccnc(CCCS)c1 Amb33325108 [0,1,0,0,0,0|2,1,0]=4 2300 B11R1.24 Fc1cncc(CCCBr)c1 Amb25923217 [0,1,0,0,0,0|3,0,0]=4 2301 B11R1.24 Fc1cncc(CCCS)c1 Amb33314006 [0,1,0,0,0,0|2,1,0]=4 2302 B11R1.24 ICC#Cc1cccc(I)c1 Amb24729732 [0,1,0,0,0,0|2,0,1]=4 2303 B11R1.24 N#CCCc1cccc(Br)c1 Amb2685459 [0,1,0,0,0,0|2,0,1]=4 2304 B11R1.24 N#CCCc1cccc(Cl)c1 Amb17204310 [0,1,0,0,0,0|2,0,1]=4 2305 B11R1.24 N#CCCc1cccc(F)c1 Amb10841716 [0,1,0,0,0,0|2,0,1]=4 2306 B11R1.24 N#CCCc1cccc(N)c1 Amb25929710 [0,1,0,0,0,0|2,0,1]=4 2307 B11R1.24 N#CCCc1cccc(O)c1 Amb2609108 [0,1,0,0,0,0|2,0,1]=4 2308 B11R1.24 N#CCNc1cccc(Br)c1 Amb6712240 [0,1,0,0,0,0|2,0,1]=4 2309 B11R1.24 N#CCNc1cccc(Cl)c1 Amb6711835 [0,1,0,0,0,0|2,0,1]=4 2310 B11R1.24 N#CCNc1cccc(F)c1 Amb6711894 [0,1,0,0,0,0|2,0,1]=4 2311 B11R1.24 N#CCOc1cccc(Br)c1 Amb5780906 [0,1,0,0,0,0|1,0,1]=3 2312 B11R1.24 N#CCOc1cccc(Cl)c1 Amb2725935 [0,1,0,0,0,0|1,0,1]=3 2313 B11R1.24 N#CCOc1cccc(F)c1 Amb6257740 [0,1,0,0,0,0|1,0,1]=3 2314 B11R1.24 N#CCOc1cccc(N)c1 Amb6246011 [0,1,0,0,0,0|1,0,1]=3 2315 B11R1.24 N#CCOc1cccc(O)c1 Amb8837476 [0,1,0,0,0,0|1,0,1]=3 2316 B11R1.24 N#CCOc1cncc(Br)c1 Amb26880272 [0,1,0,0,0,0|2,0,1]=4 2317 B11R1.24 N#CCOc1cncc(Cl)c1 Amb27882233 [0,1,0,0,0,0|2,0,1]=4 2318 B11R1.24 N#CCSc1cccc(Br)c1 Amb20642031 [0,1,0,0,0,0|1,1,1]=4 2319 B11R1.24 N#CCSc1cccc(Cl)c1 Amb18324763 [0,1,0,0,0,0|1,1,1]=4 2320 B11R1.24 N#CCSc1cccc(N)c1 Amb28319445 [0,1,0,0,0,0|1,1,1]=4 2321 B11R1.24 NCC#Cc1cccc(Br)c1 Amb26443230 [0,1,0,0,0,0|2,0,1]=4 2322 B11R1.24 NCC#Cc1cccc(Cl)c1 Amb18957240 [0,1,0,0,0,0|2,0,1]=4 2323 B11R1.24 NCC#Cc1cccc(F)c1 Amb18949810 [0,1,0,0,0,0|2,0,1]=4 2324 B11R1.24 NCC#Cc1cccc(F)c1 Amb28872278 [0,1,0,0,0,0|2,0,1]=4 2325 B11R1.24 NCC#Cc1cccc(I)c1 Amb28321027 [0,1,0,0,0,0|2,0,1]=4 2326 B11R1.24 NCC#Cc1cccc(N)c1 Amb28120131 [0,1,0,0,0,0|2,0,1]=4 2327 B11R1.24 NCC#Cc1cccc(O)c1 Amb25084990 [0,1,0,0,0,0|2,0,1]=4 2328 B11R1.24 NCCCc1cc(Cl)ccn1 Amb24432795 [0,1,0,0,0,0|3,0,0]=4 2329 B11R1.24 NCCCc1cc(F)ccn1 Amb26480133 [0,1,0,0,0,0|3,0,0]=4 2330 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|2,0,0]=3 2331 B11R1.24 NCCCc1cccc(Br)c1 Amb9304906 [0,1,0,0,0,0|2,0,0]=3 2332 B11R1.24 NCCCc1cccc(Br)n1 Amb25055843 [0,1,0,0,0,0|3,0,0]=4 2333 B11R1.24 NCCCc1cccc(Cl)c1 Amb13951536 [0,1,0,0,0,0|2,0,0]=3 2334 B11R1.24 NCCCc1cccc(Cl)c1 Amb5735480 [0,1,0,0,0,0|2,0,0]=3 2335 B11R1.24 NCCCc1cccc(Cl)n1 Amb27476115 [0,1,0,0,0,0|3,0,0]=4 2336 B11R1.24 NCCCc1cccc(F)c1 Amb13949159 [0,1,0,0,0,0|2,0,0]=3 2337 B11R1.24 NCCCc1cccc(F)c1 Amb9304903 [0,1,0,0,0,0|2,0,0]=3 2338 B11R1.24 NCCCc1cccc(I)c1 Amb26471163 [0,1,0,0,0,0|2,0,0]=3 2339 B11R1.24 NCCCc1cccc(N)c1 Amb17477694 [0,1,0,0,0,0|2,0,0]=3 2340 B11R1.24 NCCCc1cccc(O)c1 Amb17101314 [0,1,0,0,0,0|2,0,0]=3 2341 B11R1.24 NCCCc1cccc(O)c1 Amb33552047 [0,1,0,0,0,0|2,0,0]=3 2342 B11R1.24 NCCCc1cccc(O)c1 Amb33719034 [0,1,0,0,0,0|2,0,0]=3 2343 B11R1.24 NCCCc1ccnc(Cl)c1 Amb25340473 [0,1,0,0,0,0|3,0,0]=4 2344 B11R1.24 NCCCc1cncc(Br)c1 Amb25277365 [0,1,0,0,0,0|3,0,0]=4 2345 B11R1.24 NCCCc1cncc(F)c1 Amb25204369 [0,1,0,0,0,0|3,0,0]=4 2346 B11R1.24 NCCNC1=CC=CC(=O)N1 Amb27840014 [0,1,0,0,0,0|3,0,0]=4 2347 B11R1.24 NCCNc1cc(Cl)ccn1 Amb28188710 [0,1,0,0,0,0|3,0,0]=4 2348 B11R1.24 NCCNc1cc(N)ccn1 Amb18298681 [0,1,0,0,0,0|3,0,0]=4 2349 B11R1.24 NCCNc1cccc(Br)c1 Amb33530824 [0,1,0,0,0,0|2,0,0]=3 2350 B11R1.24 NCCNc1cccc(Cl)c1 Amb17057750 [0,1,0,0,0,0|2,0,0]=3 2351 B11R1.24 NCCNc1cccc(Cl)n1 Amb27163532 [0,1,0,0,0,0|3,0,0]=4 2352 B11R1.24 NCCNc1cccc(F)c1 Amb17057748 [0,1,0,0,0,0|2,0,0]=3 2353 B11R1.24 NCCNc1cccc(F)n1 Amb24072626 [0,1,0,0,0,0|3,0,0]=4 2354 B11R1.24 NCCNc1cccc(F)n1 Amb33456098 [0,1,0,0,0,0|3,0,0]=4 2355 B11R1.24 NCCNc1ccnc(Cl)c1 Amb27823717 [0,1,0,0,0,0|3,0,0]=4 2356 B11R1.24 NCCNc1cncc(Cl)c1 Amb35733489 [0,1,0,0,0,0|3,0,0]=4 2357 B11R1.24 NCCOc1cc(Cl)ccn1 Amb22236327 [0,1,0,0,0,0|2,0,0]=3 2358 B11R1.24 NCCOc1cc(F)ccn1 Amb26029612 [0,1,0,0,0,0|2,0,0]=3 2359 B11R1.24 NCCOc1cc(N)ccn1 Amb26355561 [0,1,0,0,0,0|2,0,0]=3 2360 B11R1.24 NCCOc1cccc(Br)c1 Amb10609758 [0,1,0,0,0,0|1,0,0]=2 2361 B11R1.24 NCCOc1cccc(Br)c1 Amb1111484 [0,1,0,0,0,0|1,0,0]=2 2362 B11R1.24 NCCOc1cccc(Br)n1 Amb26636283 [0,1,0,0,0,0|2,0,0]=3 2363 B11R1.24 NCCOc1cccc(Cl)c1 Amb1098576 [0,1,0,0,0,0|1,0,0]=2 2364 B11R1.24 NCCOc1cccc(Cl)c1 Amb6754200 [0,1,0,0,0,0|1,0,0]=2 2365 B11R1.24 NCCOc1cccc(Cl)n1 Amb27592136 [0,1,0,0,0,0|2,0,0]=3 2366 B11R1.24 NCCOc1cccc(F)c1 Amb1126100 [0,1,0,0,0,0|1,0,0]=2 2367 B11R1.24 NCCOc1cccc(F)c1 Amb7969602 [0,1,0,0,0,0|1,0,0]=2 2368 B11R1.24 NCCOc1cccc(N)c1 Amb18251365 [0,1,0,0,0,0|1,0,0]=2 2369 B11R1.24 NCCOc1cccc(O)c1 Amb24085157 [0,1,0,0,0,0|1,0,0]=2 2370 B11R1.24 NCCOc1cncc(Br)c1 Amb22275981 [0,1,0,0,0,0|2,0,0]=3 2371 B11R1.24 NCCOc1cncc(Br)c1 Amb22275982 [0,1,0,0,0,0|2,0,0]=3 2372 B11R1.24 NCCOc1cncc(Cl)c1 Amb27811513 [0,1,0,0,0,0|2,0,0]=3 2373 B11R1.24 NCCOc1cncc(Cl)c1 Amb33078990 [0,1,0,0,0,0|2,0,0]=3 2374 B11R1.24 NCCOc1cncc(Cl)n1 Amb26355566 [0,1,0,0,0,0|3,0,0]=4 2375 B11R1.24 NCCOc1cncc(F)c1 Amb28239867 [0,1,0,0,0,0|2,0,0]=3 2376 B11R1.24 NCCOc1cncc(F)n1 Amb29861735 [0,1,0,0,0,0|3,0,0]=4 2377 B11R1.24 NCCSc1cccc(Cl)c1 Amb17083052 [0,1,0,0,0,0|1,1,0]=3 2378 B11R1.24 NCCSc1cccc(O)c1 Amb27851974 [0,1,0,0,0,0|1,1,0]=3 2379 B11R1.24 NCCSc1cncc(Cl)c1 Amb28397242 [0,1,0,0,0,0|2,1,0]=4 2380 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [0,1,0,0,0,0|2,0,1]=4 2381 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [0,1,0,0,0,0|2,0,1]=4 2382 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [0,1,0,0,0,0|2,0,1]=4 2383 B11R1.24 NC\C=C\c1cccc(O)c1 Amb33474823 [0,1,0,0,0,0|2,0,1]=4 2384 B11R1.24 NNCCc1cccc(Br)c1 Amb17404394 [0,1,0,0,0,0|3,0,0]=4 2385 B11R1.24 NNCCc1cccc(Cl)c1 Amb17400340 [0,1,0,0,0,0|3,0,0]=4 2386 B11R1.24 NNCCc1cccc(F)c1 Amb32661220 [0,1,0,0,0,0|3,0,0]=4 2387 B11R1.24 NNCCc1cccc(F)c1 Amb6250670 [0,1,0,0,0,0|3,0,0]=4 2388 B11R1.24 NOCCc1cccc(Br)c1 Amb33450765 [0,1,0,0,0,0|3,0,0]=4 2389 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|3,0,0]=4 2390 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|3,0,0]=4 2391 B11R1.24 NOCCc1cccc(O)c1 Amb33310970 [0,1,0,0,0,0|3,0,0]=4 2392 B11R1.24 Nc1cc(CCCO)ccn1 Amb27598075 [0,1,0,0,0,0|2,0,0]=3 2393 B11R1.24 Nc1cc(NCCO)ccn1 Amb27406110 [0,1,0,0,0,0|2,0,0]=3 2394 B11R1.24 Nc1cc(NCCO)ncn1 Amb27862386 [0,1,0,0,0,0|3,0,0]=4 2395 B11R1.24 Nc1cccc(C#CCBr)c1 Amb27600972 [0,1,0,0,0,0|2,0,1]=4 2396 B11R1.24 Nc1cccc(C#CCF)c1 Amb28118643 [0,1,0,0,0,0|2,0,1]=4 2397 B11R1.24 Nc1cccc(C#CCO)c1 Amb22228962 [0,1,0,0,0,0|1,0,1]=3 2398 B11R1.24 Nc1cccc(CCCBr)c1 Amb27475647 [0,1,0,0,0,0|2,0,0]=3 2399 B11R1.24 Nc1cccc(CCCCl)c1 Amb17477709 [0,1,0,0,0,0|2,0,0]=3 2400 B11R1.24 Nc1cccc(CCCO)c1 Amb17477701 [0,1,0,0,0,0|1,0,0]=2 2401 B11R1.24 Nc1cccc(CCCO)n1 Amb28365425 [0,1,0,0,0,0|2,0,0]=3 2402 B11R1.24 Nc1cccc(CCCS)c1 Amb35672845 [0,1,0,0,0,0|1,1,0]=3 2403 B11R1.24 Nc1cccc(NCCS)c1 Amb27642458 [0,1,0,0,0,0|1,1,0]=3 2404 B11R1.24 Nc1cccc(OCCBr)c1 Amb27832160 [0,1,0,0,0,0|1,0,0]=2 2405 B11R1.24 Nc1cccc(OCCCl)c1 Amb10608112 [0,1,0,0,0,0|1,0,0]=2 2406 B11R1.24 Nc1cccc(OCCCl)c1 Amb22587140 [0,1,0,0,0,0|1,0,0]=2 2407 B11R1.24 Nc1cccc(OCCF)c1 Amb20669100 [0,1,0,0,0,0|1,0,0]=2 2408 B11R1.24 Nc1cccc(OCCO)c1 Amb2586519 [0,1,0,0,0,0|0,0,0]=1 2409 B11R1.24 Nc1cccc(OCCO)n1 Amb26552692 [0,1,0,0,0,0|1,0,0]=2 2410 B11R1.24 Nc1cccc(OCCS)c1 Amb17504035 [0,1,0,0,0,0|0,1,0]=2 2411 B11R1.24 Nc1cccc(SCCF)c1 Amb28423231 [0,1,0,0,0,0|1,1,0]=3 2412 B11R1.24 Nc1cccc(SCCO)c1 Amb18289366 [0,1,0,0,0,0|0,1,0]=2 2413 B11R1.24 Nc1ccnc(CCCO)c1 Amb26880305 [0,1,0,0,0,0|2,0,0]=3 2414 B11R1.24 Nc1ccnc(NCCO)n1 Amb26644015 [0,1,0,0,0,0|3,0,0]=4 2415 B11R1.24 Nc1ccnc(OCCO)c1 Amb18293320 [0,1,0,0,0,0|1,0,0]=2 2416 B11R1.24 Nc1cncc(NCCF)c1 Amb28127240 [0,1,0,0,0,0|3,0,0]=4 2417 B11R1.24 O=C1C=C(CCCO)C=CN1 Amb27240055 [0,1,0,0,0,0|2,0,0]=3 2418 B11R1.24 O=C1C=C(OCCO)C=NN1 Amb27206874 [0,1,0,0,0,0|2,0,0]=3 2419 B11R1.24 O=C1C=C(SCCO)N=CN1 Amb28347546 [0,1,0,0,0,0|2,1,0]=4 2420 B11R1.24 O=C1C=CC=C(C#CCO)N1 Amb27948341 [0,1,0,0,0,0|2,0,1]=4 2421 B11R1.24 O=C1C=COC(CCCO)=C1 Amb28074818 [0,1,0,0,0,0|2,0,0]=3 2422 B11R1.24 O=C1N=C(NCCO)C=CN1 Amb25866699 [0,1,0,0,0,0|3,0,0]=4 2423 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [0,1,0,0,0,0|1,0,2]=4 2424 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [0,1,0,0,0,0|1,0,2]=4 2425 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [0,1,0,0,0,0|1,0,2]=4 2426 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|1,0,2]=4 2427 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [0,1,0,0,0,0|1,0,2]=4 2428 B11R1.24 O=CCOc1cccc(Br)c1 Amb17099951 [0,1,0,0,0,0|0,0,2]=3 2429 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|0,0,2]=3 2430 B11R1.24 O=CCOc1cccc(I)c1 Amb27838178 [0,1,0,0,0,0|0,0,2]=3 2431 B11R1.24 O=CCOc1cncc(Cl)c1 Amb27868020 [0,1,0,0,0,0|1,0,2]=4 2432 B11R1.24 O=CCSc1cccc(Br)c1 Amb25978639 [0,1,0,0,0,0|0,1,2]=4 2433 B11R1.24 O=CCSc1cccc(Cl)c1 Amb17082942 [0,1,0,0,0,0|0,1,2]=4 2434 B11R1.24 O=CCSc1cccc(F)c1 Amb26942694 [0,1,0,0,0,0|0,1,2]=4 2435 B11R1.24 OCC#Cc1cccc(Br)c1 Amb836713 [0,1,0,0,0,0|1,0,1]=3 2436 B11R1.24 OCC#Cc1cccc(Br)n1 Amb27621640 [0,1,0,0,0,0|2,0,1]=4 2437 B11R1.24 OCC#Cc1cccc(Cl)c1 Amb836569 [0,1,0,0,0,0|1,0,1]=3 2438 B11R1.24 OCC#Cc1cccc(F)c1 Amb836624 [0,1,0,0,0,0|1,0,1]=3 2439 B11R1.24 OCC#Cc1cccc(I)c1 Amb25742450 [0,1,0,0,0,0|1,0,1]=3 2440 B11R1.24 OCC#Cc1cccc(O)c1 Amb24085233 [0,1,0,0,0,0|1,0,1]=3 2441 B11R1.24 OCCCc1cc(F)ccn1 Amb33325520 [0,1,0,0,0,0|2,0,0]=3 2442 B11R1.24 OCCCc1cccc(Br)c1 Amb17089515 [0,1,0,0,0,0|1,0,0]=2 2443 B11R1.24 OCCCc1cccc(Br)n1 Amb26354337 [0,1,0,0,0,0|2,0,0]=3 2444 B11R1.24 OCCCc1cccc(Cl)c1 Amb17089500 [0,1,0,0,0,0|1,0,0]=2 2445 B11R1.24 OCCCc1cccc(Cl)n1 Amb33222644 [0,1,0,0,0,0|2,0,0]=3 2446 B11R1.24 OCCCc1cccc(F)c1 Amb17605781 [0,1,0,0,0,0|1,0,0]=2 2447 B11R1.24 OCCCc1cccc(F)n1 Amb24546387 [0,1,0,0,0,0|2,0,0]=3 2448 B11R1.24 OCCCc1cccc(O)c1 Amb17089514 [0,1,0,0,0,0|1,0,0]=2 2449 B11R1.24 OCCCc1ccnc(Cl)c1 Amb26943153 [0,1,0,0,0,0|2,0,0]=3 2450 B11R1.24 OCCCc1cncc(Br)c1 Amb26018418 [0,1,0,0,0,0|2,0,0]=3 2451 B11R1.24 OCCCc1cncc(Cl)c1 Amb33213703 [0,1,0,0,0,0|2,0,0]=3 2452 B11R1.24 OCCCc1cncc(F)c1 Amb27860196 [0,1,0,0,0,0|2,0,0]=3 2453 B11R1.24 OCCNc1cc(Br)ncn1 Amb27408723 [0,1,0,0,0,0|3,0,0]=4 2454 B11R1.24 OCCNc1cc(Cl)ncn1 Amb679501 [0,1,0,0,0,0|3,0,0]=4 2455 B11R1.24 OCCNc1cc(I)ccn1 Amb27963022 [0,1,0,0,0,0|2,0,0]=3 2456 B11R1.24 OCCNc1cccc(Br)c1 Amb33526943 [0,1,0,0,0,0|1,0,0]=2 2457 B11R1.24 OCCNc1cccc(Br)n1 Amb28201319 [0,1,0,0,0,0|2,0,0]=3 2458 B11R1.24 OCCNc1cccc(Cl)c1 Amb6711876 [0,1,0,0,0,0|1,0,0]=2 2459 B11R1.24 OCCNc1cccc(Cl)n1 Amb21958722 [0,1,0,0,0,0|2,0,0]=3 2460 B11R1.24 OCCNc1cccc(F)c1 Amb6711934 [0,1,0,0,0,0|1,0,0]=2 2461 B11R1.24 OCCNc1cccc(F)n1 Amb18973531 [0,1,0,0,0,0|2,0,0]=3 2462 B11R1.24 OCCNc1ccnc(F)n1 Amb35677716 [0,1,0,0,0,0|3,0,0]=4 2463 B11R1.24 OCCNc1cncc(Br)c1 Amb23744553 [0,1,0,0,0,0|2,0,0]=3 2464 B11R1.24 OCCNc1cncc(Cl)c1 Amb35706904 [0,1,0,0,0,0|2,0,0]=3 2465 B11R1.24 OCCNc1cncc(Cl)n1 Amb18292859 [0,1,0,0,0,0|3,0,0]=4 2466 B11R1.24 OCCNc1cncc(F)n1 Amb29861539 [0,1,0,0,0,0|3,0,0]=4 2467 B11R1.24 OCCOc1cccc(Br)c1 Amb33527712 [0,1,0,0,0,0|0,0,0]=1 2468 B11R1.24 OCCOc1cccc(Br)n1 Amb28043278 [0,1,0,0,0,0|1,0,0]=2 2469 B11R1.24 OCCOc1cccc(Cl)c1 Amb33531543 [0,1,0,0,0,0|0,0,0]=1 2470 B11R1.24 OCCOc1cccc(Cl)n1 Amb26066814 [0,1,0,0,0,0|1,0,0]=2 2471 B11R1.24 OCCOc1cccc(F)c1 Amb9370687 [0,1,0,0,0,0|0,0,0]=1 2472 B11R1.24 OCCOc1cccc(I)c1 Amb9370547 [0,1,0,0,0,0|0,0,0]=1 2473 B11R1.24 OCCOc1ccnc(Cl)c1 Amb22059320 [0,1,0,0,0,0|1,0,0]=2 2474 B11R1.24 OCCOc1ccnc(Cl)n1 Amb18804288 [0,1,0,0,0,0|2,0,0]=3 2475 B11R1.24 OCCOc1ccnc(F)n1 Amb35658112 [0,1,0,0,0,0|2,0,0]=3 2476 B11R1.24 OCCOc1cncc(Br)c1 Amb2695312 [0,1,0,0,0,0|1,0,0]=2 2477 B11R1.24 OCCOc1cncc(Cl)c1 Amb25151315 [0,1,0,0,0,0|1,0,0]=2 2478 B11R1.24 OCCOc1cncc(Cl)n1 Amb6681174 [0,1,0,0,0,0|2,0,0]=3 2479 B11R1.24 OCCOc1cncc(F)n1 Amb32666604 [0,1,0,0,0,0|2,0,0]=3 2480 B11R1.24 OCCSc1cc(Br)ncn1 Amb27806522 [0,1,0,0,0,0|2,1,0]=4 2481 B11R1.24 OCCSc1cccc(Cl)c1 Amb2686421 [0,1,0,0,0,0|0,1,0]=2 2482 B11R1.24 OCCSc1cccc(F)c1 Amb2688393 [0,1,0,0,0,0|0,1,0]=2 2483 B11R1.24 OCCSc1cccc(S)c1 Amb27763842 [0,1,0,0,0,0|0,1,0]=2 2484 B11R1.24 OCCSc1ccnc(Cl)c1 Amb27831915 [0,1,0,0,0,0|1,1,0]=3 2485 B11R1.24 OCCSc1ccnc(F)n1 Amb35610854 [0,1,0,0,0,0|2,1,0]=4 2486 B11R1.24 OCCSc1cncc(Cl)n1 Amb9481975 [0,1,0,0,0,0|2,1,0]=4 2487 B11R1.24 OCCSc1cncc(F)n1 Amb35712100 [0,1,0,0,0,0|2,1,0]=4 2488 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [0,1,0,0,0,0|1,0,1]=3 2489 B11R1.24 OC\C=C\c1cccc(Br)n1 Amb20248560 [0,1,0,0,0,0|2,0,1]=4 2490 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [0,1,0,0,0,0|1,0,1]=3 2491 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [0,1,0,0,0,0|1,0,1]=3 2492 B11R1.24 OC\C=C\c1cccc(I)c1 Amb28322502 [0,1,0,0,0,0|1,0,1]=3 2493 B11R1.24 OC\C=C\c1cccc(O)c1 Amb33136411 [0,1,0,0,0,0|1,0,1]=3 2494 B11R1.24 OC\C=C\c1cncc(Br)c1 Amb31184380 [0,1,0,0,0,0|2,0,1]=4 2495 B11R1.24 OC\C=C\c1cncc(F)c1 Amb33196270 [0,1,0,0,0,0|2,0,1]=4 2496 B11R1.24 Oc1cccc(C#CCBr)c1 Amb24471318 [0,1,0,0,0,0|2,0,1]=4 2497 B11R1.24 Oc1cccc(C#CCCl)c1 Amb25891605 [0,1,0,0,0,0|2,0,1]=4 2498 B11R1.24 Oc1cccc(C#CCF)c1 Amb24427468 [0,1,0,0,0,0|2,0,1]=4 2499 B11R1.24 Oc1cccc(C#CCI)c1 Amb25793030 [0,1,0,0,0,0|2,0,1]=4 2500 B11R1.24 Oc1cccc(CCCBr)c1 Amb18657769 [0,1,0,0,0,0|2,0,0]=3 2501 B11R1.24 Oc1cccc(CCCCl)c1 Amb17477723 [0,1,0,0,0,0|2,0,0]=3 2502 B11R1.24 Oc1cccc(CCCS)c1 Amb33310794 [0,1,0,0,0,0|1,1,0]=3 2503 B11R1.24 Oc1cccc(OCCBr)c1 Amb27391138 [0,1,0,0,0,0|1,0,0]=2 2504 B11R1.24 Oc1cccc(OCCCl)c1 Amb27461339 [0,1,0,0,0,0|1,0,0]=2 2505 B11R1.24 SCCCc1cccc(Br)c1 Amb17407561 [0,1,0,0,0,0|1,1,0]=3 2506 B11R1.24 SCCCc1cccc(Br)n1 Amb33433835 [0,1,0,0,0,0|2,1,0]=4 2507 B11R1.24 SCCCc1cccc(Cl)c1 Amb17401096 [0,1,0,0,0,0|1,1,0]=3 2508 B11R1.24 SCCCc1cccc(Cl)n1 Amb33222717 [0,1,0,0,0,0|2,1,0]=4 2509 B11R1.24 SCCCc1cncc(Br)c1 Amb33389384 [0,1,0,0,0,0|2,1,0]=4 2510 B11R1.24 SCCOc1cccc(Br)c1 Amb6255895 [0,1,0,0,0,0|0,1,0]=2 2511 B11R1.24 SCCOc1cccc(Cl)c1 Amb6255391 [0,1,0,0,0,0|0,1,0]=2 2512 B11R1.24 SCCOc1cncc(Br)c1 Amb27753472 [0,1,0,0,0,0|1,1,0]=3 2513 B11R1.24 SCCSc1cccc(Cl)c1 Amb28398903 [0,1,0,0,0,0|0,2,0]=3 2514 B11R1.24 Sc1cccc(CCCBr)c1 Amb27192455 [0,1,0,0,0,0|2,0,0]=3 2515 B11R1.24 Sc1cccc(CCCCl)c1 Amb28196581 [0,1,0,0,0,0|2,0,0]=3 2516 B11R1.24 [C-]#[N+]CCc1cccc(Br)c1 Amb2685408 [0,1,0,0,0,0|3,0,0]=4 2517 B11R1.24 [C-]#[N+]CCc1cccc(C)c1 Amb2689593 [0,1,0,0,0,0|3,0,0]=4 2518 B11R1.24 [C-]#[N+]CCc1cccc(Cl)c1 Amb2686345 [0,1,0,0,0,0|3,0,0]=4 2519 B11R1.24 [C-]#[N+]CCc1cccc(F)c1 Amb2688286 [0,1,0,0,0,0|3,0,0]=4 2520 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [0,1,0,0,0,0|2,0,0]=3 2521 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|1,0,0]=2 2522 B11R1.28 BrCCCOc1cccnc1 Amb22900113 [0,1,0,0,0,0|2,0,0]=3 2523 B11R1.28 BrCCCSc1ccncc1 Amb27671139 [0,1,0,0,0,0|2,1,0]=4 2524 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|2,0,0]=3 2525 B11R1.28 BrCCOCc1ccccc1 Amb3941567 [0,1,0,0,0,0|1,0,0]=2 2526 B11R1.28 BrCCSCc1ccccc1 Amb9305028 [0,1,0,0,0,0|1,1,0]=3 2527 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|2,0,0]=3 2528 B11R1.28 Br[Mg]CCCc1ccccc1 Amb6300511 [0,1,0,0,0,0|2,0,0]=3 2529 B11R1.28 C#CCC#Cc1ccccc1 Amb16233222 [0,1,0,0,0,0|2,0,1]=4 2530 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|2,0,0]=3 2531 B11R1.28 C#CCCOc1ccccc1 Amb25885800 [0,1,0,0,0,0|1,0,0]=2 2532 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|2,0,1]=4 2533 B11R1.28 C#CCNCc1ccccc1 Amb4303989 [0,1,0,0,0,0|2,0,1]=4 2534 B11R1.28 C#CCOCc1ccccc1 Amb8517297 [0,1,0,0,0,0|1,0,1]=3 2535 B11R1.28 C#CCOCc1ccccn1 Amb24101369 [0,1,0,0,0,0|2,0,1]=4 2536 B11R1.28 C#CC\C=C\c1ccccc1 Amb33080774 [0,1,0,0,0,0|2,0,1]=4 2537 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|2,0,1]=4 2538 B11R1.28 C=C=CCNc1ccccc1 Amb27482470 [0,1,0,0,0,0|2,0,1]=4 2539 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|2,0,1]=4 2540 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [0,1,0,0,0,0|2,0,0]=3 2541 B11R1.28 C=CCCNc1ccccn1 Amb28318095 [0,1,0,0,0,0|3,0,0]=4 2542 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [0,1,0,0,0,0|1,0,0]=2 2543 B11R1.28 C=CCCOc1ccccn1 Amb27270190 [0,1,0,0,0,0|2,0,0]=3 2544 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [0,1,0,0,0,0|1,1,0]=3 2545 B11R1.28 C=CCCSc1ccccn1 Amb27270192 [0,1,0,0,0,0|2,1,0]=4 2546 B11R1.28 C=CCCSc1ccncc1 Amb27270198 [0,1,0,0,0,0|2,1,0]=4 2547 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [0,1,0,0,0,0|2,0,1]=4 2548 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [0,1,0,0,0,0|2,0,1]=4 2549 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|1,0,1]=3 2550 B11R1.28 C=CCO[BrH]c1ccccc1 Amb27001649 [0,1,0,0,0,0|1,0,1]=3 2551 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [0,1,0,0,0,0|2,0,1]=4 2552 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [0,1,0,0,0,0|2,0,1]=4 2553 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|1,0,1]=3 2554 B11R1.28 CC#CCOc1ccccn1 Amb25921581 [0,1,0,0,0,0|2,0,1]=4 2555 B11R1.28 CC#CCOc1cccnc1 Amb27835475 [0,1,0,0,0,0|2,0,1]=4 2556 B11R1.28 CCCC#Cc1ccccc1 Amb2721608 [0,1,0,0,0,0|2,0,0]=3 2557 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [0,1,0,0,0,0|3,0,0]=4 2558 B11R1.28 CCCCCc1ccccc1 Amb2722921 [0,1,0,0,0,0|2,0,0]=3 2559 B11R1.28 CCCCCc1ccccn1 Amb533507 [0,1,0,0,0,0|3,0,0]=4 2560 B11R1.28 CCCCCc1cccnc1 Amb17672949 [0,1,0,0,0,0|3,0,0]=4 2561 B11R1.28 CCCCCc1ccncc1 Amb17672950 [0,1,0,0,0,0|3,0,0]=4 2562 B11R1.28 CCCCNc1ccccc1 Amb3940154 [0,1,0,0,0,0|2,0,0]=3 2563 B11R1.28 CCCCNc1ccccn1 Amb6633041 [0,1,0,0,0,0|3,0,0]=4 2564 B11R1.28 CCCCNc1cccnc1 Amb6686633 [0,1,0,0,0,0|3,0,0]=4 2565 B11R1.28 CCCCNc1ccncc1 Amb6648934 [0,1,0,0,0,0|3,0,0]=4 2566 B11R1.28 CCCCOc1ccccc1 Amb2685665 [0,1,0,0,0,0|1,0,0]=2 2567 B11R1.28 CCCCOc1ccccn1 Amb4034584 [0,1,0,0,0,0|2,0,0]=3 2568 B11R1.28 CCCCOc1cccnc1 Amb25382997 [0,1,0,0,0,0|2,0,0]=3 2569 B11R1.28 CCCCSc1ccccc1 Amb3836105 [0,1,0,0,0,0|1,1,0]=3 2570 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|2,0,0]=3 2571 B11R1.28 CCCNCc1ccccc1 Amb6537999 [0,1,0,0,0,0|2,0,0]=3 2572 B11R1.28 CCCNCc1ccccn1 Amb19890306 [0,1,0,0,0,0|3,0,0]=4 2573 B11R1.28 CCCNCc1ccccn1 Amb19890563 [0,1,0,0,0,0|3,0,0]=4 2574 B11R1.28 CCCNCc1ccccn1 Amb2592504 [0,1,0,0,0,0|3,0,0]=4 2575 B11R1.28 CCCNCc1cccnc1 Amb19890575 [0,1,0,0,0,0|3,0,0]=4 2576 B11R1.28 CCCNCc1cccnc1 Amb6864723 [0,1,0,0,0,0|3,0,0]=4 2577 B11R1.28 CCCNCc1cccnc1 Amb838293 [0,1,0,0,0,0|3,0,0]=4 2578 B11R1.28 CCCNCc1ccncc1 Amb19890591 [0,1,0,0,0,0|3,0,0]=4 2579 B11R1.28 CCCNCc1ccncc1 Amb6864722 [0,1,0,0,0,0|3,0,0]=4 2580 B11R1.28 CCCNCc1ccncc1 Amb837657 [0,1,0,0,0,0|3,0,0]=4 2581 B11R1.28 CCCSCc1ccccc1 Amb27000631 [0,1,0,0,0,0|1,1,0]=3 2582 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [0,1,0,0,0,0|2,0,0]=3 2583 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|2,0,0]=3 2584 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [0,1,0,0,0,0|2,0,0]=3 2585 B11R1.28 CCC\N=C\c1cccnc1 Amb26446590 [0,1,0,0,0,0|3,0,0]=4 2586 B11R1.28 CCNCCc1ccccc1 Amb33551205 [0,1,0,0,0,0|2,0,0]=3 2587 B11R1.28 CCNCCc1ccccc1 Amb6244873 [0,1,0,0,0,0|2,0,0]=3 2588 B11R1.28 CCNCCc1ccccn1 Amb33527538 [0,1,0,0,0,0|3,0,0]=4 2589 B11R1.28 CCNCCc1ccncc1 Amb2592520 [0,1,0,0,0,0|3,0,0]=4 2590 B11R1.28 CCNOCc1ccccc1 Amb25923077 [0,1,0,0,0,0|2,0,0]=3 2591 B11R1.28 CCOCCc1ccccc1 Amb4035236 [0,1,0,0,0,0|2,0,0]=3 2592 B11R1.28 CCOCCc1ccccn1 Amb2722907 [0,1,0,0,0,0|3,0,0]=4 2593 B11R1.28 CCOCOc1ccccc1 Amb28388170 [0,1,0,0,0,0|1,0,0]=2 2594 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|3,0,0]=4 2595 B11R1.28 CCO\C=C\c1ccccc1 Amb4020955 [0,1,0,0,0,0|2,0,1]=4 2596 B11R1.28 CCO\C=N\c1ccccc1 Amb9786981 [0,1,0,0,0,0|2,0,1]=4 2597 B11R1.28 CCSCCc1ccccn1 Amb27988878 [0,1,0,0,0,0|3,0,0]=4 2598 B11R1.28 CCSCCc1cccnc1 Amb27988879 [0,1,0,0,0,0|3,0,0]=4 2599 B11R1.28 CCSCCc1ccncc1 Amb27988880 [0,1,0,0,0,0|3,0,0]=4 2600 B11R1.28 CCSCSc1ccccn1 Amb27272002 [0,1,0,0,0,0|2,1,0]=4 2601 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [0,1,0,0,0,0|2,0,1]=4 2602 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|2,0,0]=3 2603 B11R1.28 CNCCCc1ccccc1 Amb2721795 [0,1,0,0,0,0|2,0,0]=3 2604 B11R1.28 CNCCCc1ccccn1 Amb18312462 [0,1,0,0,0,0|3,0,0]=4 2605 B11R1.28 CNCCNc1ccccc1 Amb6825621 [0,1,0,0,0,0|2,0,0]=3 2606 B11R1.28 CNCCNc1ccccn1 Amb18313466 [0,1,0,0,0,0|3,0,0]=4 2607 B11R1.28 CNCCNc1ccccn1 Amb32757639 [0,1,0,0,0,0|3,0,0]=4 2608 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|1,0,0]=2 2609 B11R1.28 CNCCOc1ccccc1 Amb2691365 [0,1,0,0,0,0|1,0,0]=2 2610 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|1,1,0]=3 2611 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|1,1,0]=3 2612 B11R1.28 CNCCSc1ccccn1 Amb19024669 [0,1,0,0,0,0|2,1,0]=4 2613 B11R1.28 CNCCSc1ccccn1 Amb32662293 [0,1,0,0,0,0|2,1,0]=4 2614 B11R1.28 CNCCSc1ccncc1 Amb27671140 [0,1,0,0,0,0|2,1,0]=4 2615 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|2,0,1]=4 2616 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|1,0,1]=3 2617 B11R1.28 COCCCc1ccncn1 Amb23453461 [0,1,0,0,0,0|3,0,0]=4 2618 B11R1.28 COCCNc1ccccc1 Amb596066 [0,1,0,0,0,0|1,0,0]=2 2619 B11R1.28 COCCNc1cccnc1 Amb18268638 [0,1,0,0,0,0|2,0,0]=3 2620 B11R1.28 COCCNc1cccnn1 Amb19023323 [0,1,0,0,0,0|3,0,0]=4 2621 B11R1.28 COCCNc1ccncc1 Amb6632784 [0,1,0,0,0,0|2,0,0]=3 2622 B11R1.28 COCCNc1ccncn1 Amb18305870 [0,1,0,0,0,0|3,0,0]=4 2623 B11R1.28 COCCOc1ccccc1 Amb4018811 [0,1,0,0,0,0|0,0,0]=1 2624 B11R1.28 COCCOc1ccncn1 Amb26083446 [0,1,0,0,0,0|2,0,0]=3 2625 B11R1.28 COCCSc1ccccn1 Amb17760116 [0,1,0,0,0,0|1,1,0]=3 2626 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|2,0,0]=3 2627 B11R1.28 CONCCc1cccnc1 Amb27987592 [0,1,0,0,0,0|3,0,0]=4 2628 B11R1.28 CONCCc1ccncc1 Amb27987581 [0,1,0,0,0,0|3,0,0]=4 2629 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|0,0,2]=3 2630 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|1,1,0]=3 2631 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|1,1,0]=3 2632 B11R1.28 CSCCOc1ccccc1 Amb4020915 [0,1,0,0,0,0|0,1,0]=2 2633 B11R1.28 CSCCOc1ccccn1 Amb27988044 [0,1,0,0,0,0|1,1,0]=3 2634 B11R1.28 CSCCOc1cccnc1 Amb27492324 [0,1,0,0,0,0|1,1,0]=3 2635 B11R1.28 CSCCOc1ccncc1 Amb28387285 [0,1,0,0,0,0|1,1,0]=3 2636 B11R1.28 CSCCSc1ccccn1 Amb27988049 [0,1,0,0,0,0|1,2,0]=4 2637 B11R1.28 CSCCSc1ccncc1 Amb27988052 [0,1,0,0,0,0|1,2,0]=4 2638 B11R1.28 CSCNCc1ccccc1 Amb26414504 [0,1,0,0,0,0|2,1,0]=4 2639 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [0,1,0,0,0,0|1,1,1]=4 2640 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|2,0,1]=4 2641 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [0,1,0,0,0,0|2,0,1]=4 2642 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [0,1,0,0,0,0|1,0,1]=3 2643 B11R1.28 C\C=C\COc1cccnc1 Amb32668803 [0,1,0,0,0,0|2,0,1]=4 2644 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [0,1,0,0,0,0|2,0,1]=4 2645 B11R1.28 ClCCC#Cc1ccccn1 Amb25073108 [0,1,0,0,0,0|3,0,0]=4 2646 B11R1.28 ClCCC#Cc1cccnc1 Amb18792718 [0,1,0,0,0,0|3,0,0]=4 2647 B11R1.28 ClCCC#Cc1ccncc1 Amb27492908 [0,1,0,0,0,0|3,0,0]=4 2648 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [0,1,0,0,0,0|2,0,0]=3 2649 B11R1.28 ClCCCCc1ccncc1 Amb20622009 [0,1,0,0,0,0|3,0,0]=4 2650 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|1,0,0]=2 2651 B11R1.28 ClCCCOc1cccnc1 Amb27266776 [0,1,0,0,0,0|2,0,0]=3 2652 B11R1.28 ClCCCOc1ccncc1 Amb27671643 [0,1,0,0,0,0|2,0,0]=3 2653 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|1,1,0]=3 2654 B11R1.28 ClCCCSc1ccccn1 Amb9305059 [0,1,0,0,0,0|2,1,0]=4 2655 B11R1.28 ClCCNCc1ccccc1 Amb2880633 [0,1,0,0,0,0|2,0,0]=3 2656 B11R1.28 ClCCNCc1ccccc1 Amb4323279 [0,1,0,0,0,0|2,0,0]=3 2657 B11R1.28 ClCCNCc1ccccn1 Amb17334832 [0,1,0,0,0,0|3,0,0]=4 2658 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [0,1,0,0,0,0|3,0,0]=4 2659 B11R1.28 ClCCNCc1ccncc1 Amb17334834 [0,1,0,0,0,0|3,0,0]=4 2660 B11R1.28 ClCCOCc1ccccc1 Amb8391048 [0,1,0,0,0,0|1,0,0]=2 2661 B11R1.28 ClCCSCc1ccccc1 Amb9270911 [0,1,0,0,0,0|1,1,0]=3 2662 B11R1.28 ClCCSCc1ccccn1 Amb27492364 [0,1,0,0,0,0|2,1,0]=4 2663 B11R1.28 ClCCSCc1cccnc1 Amb27492362 [0,1,0,0,0,0|2,1,0]=4 2664 B11R1.28 ClCCSCc1ccncc1 Amb27492347 [0,1,0,0,0,0|2,1,0]=4 2665 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|2,0,0]=3 2666 B11R1.28 ClCC\C=C\c1cccnc1 Amb28367181 [0,1,0,0,0,0|3,0,0]=4 2667 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [0,1,0,0,0,0|3,0,0]=4 2668 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [0,1,0,0,0,0|1,1,1]=4 2669 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [0,1,0,0,0,0|2,0,1]=4 2670 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [0,1,0,0,0,0|2,0,1]=4 2671 B11R1.28 Cl\C=C\COc1ccccc1 Amb27668260 [0,1,0,0,0,0|1,0,1]=3 2672 B11R1.28 FCCCNc1ccncc1 Amb27448183 [0,1,0,0,0,0|3,0,0]=4 2673 B11R1.28 FCCCOc1ccncc1 Amb28387256 [0,1,0,0,0,0|2,0,0]=3 2674 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|2,0,0]=3 2675 B11R1.28 FCCSCc1ccccc1 Amb27271863 [0,1,0,0,0,0|1,1,0]=3 2676 B11R1.28 IC#CCOc1ccccc1 Amb27640774 [0,1,0,0,0,0|1,0,1]=3 2677 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|2,0,0]=3 2678 B11R1.28 ICCCOc1ccccc1 Amb27271705 [0,1,0,0,0,0|1,0,0]=2 2679 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|1,0,0]=2 2680 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [0,1,0,0,0,0|2,0,0]=3 2681 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [0,1,0,0,0,0|2,0,1]=4 2682 B11R1.28 N#CCC#Cc1ccccc1 Amb25705489 [0,1,0,0,0,0|2,0,1]=4 2683 B11R1.28 N#CCCC[n+]1ccccc1 Amb22339033 [0,1,0,0,0,0|3,0,0]=4 2684 B11R1.28 N#CCCCc1ccccc1 Amb6251750 [0,1,0,0,0,0|2,0,0]=3 2685 B11R1.28 N#CCCCc1ccccn1 Amb1102455 [0,1,0,0,0,0|3,0,0]=4 2686 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|2,0,0]=3 2687 B11R1.28 N#CCCNc1ccccn1 Amb26484394 [0,1,0,0,0,0|3,0,0]=4 2688 B11R1.28 N#CCCNc1cccnc1 Amb24085246 [0,1,0,0,0,0|3,0,0]=4 2689 B11R1.28 N#CCCNc1ccncc1 Amb27466233 [0,1,0,0,0,0|3,0,0]=4 2690 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|1,0,0]=2 2691 B11R1.28 N#CCCOc1ccccn1 Amb26517292 [0,1,0,0,0,0|2,0,0]=3 2692 B11R1.28 N#CCCOc1cccnc1 Amb27980134 [0,1,0,0,0,0|2,0,0]=3 2693 B11R1.28 N#CCCSc1ccccc1 Amb4018040 [0,1,0,0,0,0|1,1,0]=3 2694 B11R1.28 N#CCCSc1ccccn1 Amb6677794 [0,1,0,0,0,0|2,1,0]=4 2695 B11R1.28 N#CCNCc1ccccc1 Amb4477202 [0,1,0,0,0,0|2,0,1]=4 2696 B11R1.28 N#CCOCc1ccccc1 Amb4011553 [0,1,0,0,0,0|1,0,1]=3 2697 B11R1.28 N#CCSCc1ccccc1 Amb6677693 [0,1,0,0,0,0|1,1,1]=4 2698 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|2,0,1]=4 2699 B11R1.28 N#CC\C=C\c1ccccc1 Amb6268598 [0,1,0,0,0,0|2,0,1]=4 2700 B11R1.28 N#CNCCc1ccccc1 Amb27763256 [0,1,0,0,0,0|2,0,1]=4 2701 B11R1.28 N#CNOCc1ccccc1 Amb27245690 [0,1,0,0,0,0|2,0,1]=4 2702 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|2,0,0]=3 2703 B11R1.28 NCCCCc1ccccn1 Amb1102767 [0,1,0,0,0,0|3,0,0]=4 2704 B11R1.28 NCCCCc1cccnc1 Amb5735490 [0,1,0,0,0,0|3,0,0]=4 2705 B11R1.28 NCCCCc1ccncc1 Amb17991253 [0,1,0,0,0,0|3,0,0]=4 2706 B11R1.28 NCCCCc1ccncc1 Amb5735491 [0,1,0,0,0,0|3,0,0]=4 2707 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|2,0,0]=3 2708 B11R1.28 NCCCNc1ccccn1 Amb6260583 [0,1,0,0,0,0|3,0,0]=4 2709 B11R1.28 NCCCNc1cccnc1 Amb10607841 [0,1,0,0,0,0|3,0,0]=4 2710 B11R1.28 NCCCNc1ccncc1 Amb6261403 [0,1,0,0,0,0|3,0,0]=4 2711 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|1,0,0]=2 2712 B11R1.28 NCCCOc1ccccc1 Amb2606353 [0,1,0,0,0,0|1,0,0]=2 2713 B11R1.28 NCCCOc1ccccn1 Amb19020881 [0,1,0,0,0,0|2,0,0]=3 2714 B11R1.28 NCCCOc1cccnc1 Amb9392842 [0,1,0,0,0,0|2,0,0]=3 2715 B11R1.28 NCCCOc1ccncc1 Amb18308513 [0,1,0,0,0,0|2,0,0]=3 2716 B11R1.28 NCCCOc1ccncn1 Amb18308503 [0,1,0,0,0,0|3,0,0]=4 2717 B11R1.28 NCCCOc1cnccn1 Amb18308518 [0,1,0,0,0,0|3,0,0]=4 2718 B11R1.28 NCCCOc1cncnc1 Amb32876795 [0,1,0,0,0,0|3,0,0]=4 2719 B11R1.28 NCCCOc1ncccn1 Amb18308494 [0,1,0,0,0,0|3,0,0]=4 2720 B11R1.28 NCCCOc1ncccn1 Amb28555662 [0,1,0,0,0,0|3,0,0]=4 2721 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|1,1,0]=3 2722 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|1,1,0]=3 2723 B11R1.28 NCCCSc1ccccn1 Amb28960301 [0,1,0,0,0,0|2,1,0]=4 2724 B11R1.28 NCCCSc1ccccn1 Amb6667224 [0,1,0,0,0,0|2,1,0]=4 2725 B11R1.28 NCCNCc1ccccc1 Amb2725583 [0,1,0,0,0,0|2,0,0]=3 2726 B11R1.28 NCCNCc1ccccn1 Amb17091028 [0,1,0,0,0,0|3,0,0]=4 2727 B11R1.28 NCCNCc1ccccn1 Amb29844480 [0,1,0,0,0,0|3,0,0]=4 2728 B11R1.28 NCCNCc1cccnc1 Amb17091029 [0,1,0,0,0,0|3,0,0]=4 2729 B11R1.28 NCCNCc1cccnc1 Amb29844477 [0,1,0,0,0,0|3,0,0]=4 2730 B11R1.28 NCCNCc1ccncc1 Amb17091030 [0,1,0,0,0,0|3,0,0]=4 2731 B11R1.28 NCCNCc1ccncc1 Amb29844481 [0,1,0,0,0,0|3,0,0]=4 2732 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|1,0,0]=2 2733 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|1,0,0]=2 2734 B11R1.28 NCCOCc1ccccc1 Amb28524733 [0,1,0,0,0,0|1,0,0]=2 2735 B11R1.28 NCCOCc1ccccn1 Amb18181726 [0,1,0,0,0,0|2,0,0]=3 2736 B11R1.28 NCCOCc1ccncc1 Amb19020767 [0,1,0,0,0,0|2,0,0]=3 2737 B11R1.28 NCCPCc1ccccc1 Amb27990149 [0,1,0,0,0,0|2,0,0]=3 2738 B11R1.28 NCCSCc1ccccc1 Amb432271 [0,1,0,0,0,0|1,1,0]=3 2739 B11R1.28 NCCSCc1ccccc1 Amb6335199 [0,1,0,0,0,0|1,1,0]=3 2740 B11R1.28 NCCSCc1ccccn1 Amb6269451 [0,1,0,0,0,0|2,1,0]=4 2741 B11R1.28 NCCSCc1cccnc1 Amb6277252 [0,1,0,0,0,0|2,1,0]=4 2742 B11R1.28 NCCSSc1ccccn1 Amb17619715 [0,1,0,0,0,0|2,1,0]=4 2743 B11R1.28 NCCSSc1ccccn1 Amb22523455 [0,1,0,0,0,0|2,1,0]=4 2744 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [0,1,0,0,0,0|2,0,0]=3 2745 B11R1.28 NCC\C=C/c1cccnc1 Amb27391665 [0,1,0,0,0,0|3,0,0]=4 2746 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|2,0,0]=3 2747 B11R1.28 NCC\C=C\c1ccccn1 Amb24383569 [0,1,0,0,0,0|3,0,0]=4 2748 B11R1.28 NCC\C=C\c1cccnc1 Amb25061778 [0,1,0,0,0,0|3,0,0]=4 2749 B11R1.28 NCC\C=C\c1ccncc1 Amb24678309 [0,1,0,0,0,0|3,0,0]=4 2750 B11R1.28 NCC\N=C\c1ccccc1 Amb27760044 [0,1,0,0,0,0|2,0,0]=3 2751 B11R1.28 NCC\N=C\c1ccccn1 Amb28072854 [0,1,0,0,0,0|3,0,0]=4 2752 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [0,1,0,0,0,0|2,0,1]=4 2753 B11R1.28 NNCC#Cc1ccccc1 Amb27409247 [0,1,0,0,0,0|2,0,1]=4 2754 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|2,0,0]=3 2755 B11R1.28 NNCCCc1ccccc1 Amb6252219 [0,1,0,0,0,0|2,0,0]=3 2756 B11R1.28 NNCCCc1ccccn1 Amb27671029 [0,1,0,0,0,0|3,0,0]=4 2757 B11R1.28 NNCCCc1cccnc1 Amb18125323 [0,1,0,0,0,0|3,0,0]=4 2758 B11R1.28 NNCCCc1ccncc1 Amb27671030 [0,1,0,0,0,0|3,0,0]=4 2759 B11R1.28 NNCCNc1ccccc1 Amb28365488 [0,1,0,0,0,0|2,0,0]=3 2760 B11R1.28 NNCCOc1ccccc1 Amb2792851 [0,1,0,0,0,0|1,0,0]=2 2761 B11R1.28 NNCCOc1ccccc1 Amb33624872 [0,1,0,0,0,0|1,0,0]=2 2762 B11R1.28 NNCCOc1ccccc1 Amb9677389 [0,1,0,0,0,0|1,0,0]=2 2763 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [0,1,0,0,0,0|2,0,1]=4 2764 B11R1.28 NOCC#Cc1ccccc1 Amb26371096 [0,1,0,0,0,0|1,0,1]=3 2765 B11R1.28 NOCCCc1ccccc1 Amb2610651 [0,1,0,0,0,0|1,0,0]=2 2766 B11R1.28 NOCCCc1ccccn1 Amb17089546 [0,1,0,0,0,0|2,0,0]=3 2767 B11R1.28 NOCCCc1cccnc1 Amb17089547 [0,1,0,0,0,0|2,0,0]=3 2768 B11R1.28 NOCCCc1ccncc1 Amb17089548 [0,1,0,0,0,0|2,0,0]=3 2769 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|0,0,0]=1 2770 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|0,0,0]=1 2771 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|2,0,0]=3 2772 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [0,1,0,0,0,0|1,0,1]=3 2773 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [0,1,0,0,0,0|2,0,1]=4 2774 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|1,0,2]=4 2775 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|0,0,2]=3 2776 B11R1.28 O=C=NCSc1ccccc1 Amb27839732 [0,1,0,0,0,0|0,1,2]=4 2777 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [0,1,0,0,0,0|1,0,2]=4 2778 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [0,1,0,0,0,0|1,0,1]=3 2779 B11R1.28 O=CCCCc1ccccn1 Amb22897023 [0,1,0,0,0,0|2,0,1]=4 2780 B11R1.28 O=CCCCc1cccnc1 Amb24099514 [0,1,0,0,0,0|2,0,1]=4 2781 B11R1.28 O=CCCCc1ccncc1 Amb24099515 [0,1,0,0,0,0|2,0,1]=4 2782 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [0,1,0,0,0,0|0,0,1]=2 2783 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|0,1,1]=3 2784 B11R1.28 O=CCCSc1ccncc1 Amb27671141 [0,1,0,0,0,0|1,1,1]=4 2785 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|1,0,2]=4 2786 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [0,1,0,0,0,0|0,0,2]=3 2787 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|0,1,2]=4 2788 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [0,1,0,0,0,0|1,0,2]=4 2789 B11R1.28 O=COCCc1ccccc1 Amb6357955 [0,1,0,0,0,0|1,0,2]=4 2790 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,0|0,0,3]=4 2791 B11R1.28 OCC#CSc1ccccc1 Amb27641939 [0,1,0,0,0,0|0,1,1]=3 2792 B11R1.28 OCCC#Cc1ccccc1 Amb2721612 [0,1,0,0,0,0|1,0,0]=2 2793 B11R1.28 OCCC#Cc1ccccn1 Amb22749318 [0,1,0,0,0,0|2,0,0]=3 2794 B11R1.28 OCCC#Cc1cccnc1 Amb22749317 [0,1,0,0,0,0|2,0,0]=3 2795 B11R1.28 OCCC#Cc1ccncc1 Amb22749294 [0,1,0,0,0,0|2,0,0]=3 2796 B11R1.28 OCCC#Cc1cnccn1 Amb27272732 [0,1,0,0,0,0|3,0,0]=4 2797 B11R1.28 OCCC#Cc1cncnc1 Amb26989227 [0,1,0,0,0,0|3,0,0]=4 2798 B11R1.28 OCCC#Cc1ncccn1 Amb25374912 [0,1,0,0,0,0|3,0,0]=4 2799 B11R1.28 OCCCCc1ccccc1 Amb3939083 [0,1,0,0,0,0|1,0,0]=2 2800 B11R1.28 OCCCCc1ccccn1 Amb21520414 [0,1,0,0,0,0|2,0,0]=3 2801 B11R1.28 OCCCCc1cccnc1 Amb22732495 [0,1,0,0,0,0|2,0,0]=3 2802 B11R1.28 OCCCCc1ccncc1 Amb17740015 [0,1,0,0,0,0|2,0,0]=3 2803 B11R1.28 OCCCCc1cnccn1 Amb27269855 [0,1,0,0,0,0|3,0,0]=4 2804 B11R1.28 OCCCCc1ncccn1 Amb27989793 [0,1,0,0,0,0|3,0,0]=4 2805 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|1,0,0]=2 2806 B11R1.28 OCCCNc1ccccn1 Amb6627879 [0,1,0,0,0,0|2,0,0]=3 2807 B11R1.28 OCCCNc1ccncc1 Amb33527020 [0,1,0,0,0,0|2,0,0]=3 2808 B11R1.28 OCCCNc1ccncc1 Amb6651953 [0,1,0,0,0,0|2,0,0]=3 2809 B11R1.28 OCCCNc1ccncn1 Amb18305868 [0,1,0,0,0,0|3,0,0]=4 2810 B11R1.28 OCCCNc1cnccn1 Amb6622041 [0,1,0,0,0,0|3,0,0]=4 2811 B11R1.28 OCCCNc1cncnc1 Amb18267814 [0,1,0,0,0,0|3,0,0]=4 2812 B11R1.28 OCCCNc1ncccn1 Amb6613017 [0,1,0,0,0,0|3,0,0]=4 2813 B11R1.28 OCCCOc1ccccc1 Amb4476987 [0,1,0,0,0,0|0,0,0]=1 2814 B11R1.28 OCCCOc1ccccn1 Amb25383036 [0,1,0,0,0,0|1,0,0]=2 2815 B11R1.28 OCCCOc1cccnc1 Amb27266775 [0,1,0,0,0,0|1,0,0]=2 2816 B11R1.28 OCCCOc1cccnn1 Amb27674344 [0,1,0,0,0,0|2,0,0]=3 2817 B11R1.28 OCCCOc1ccncc1 Amb27266485 [0,1,0,0,0,0|1,0,0]=2 2818 B11R1.28 OCCCOc1ncccn1 Amb27989310 [0,1,0,0,0,0|2,0,0]=3 2819 B11R1.28 OCCCSc1ccccc1 Amb4018847 [0,1,0,0,0,0|0,1,0]=2 2820 B11R1.28 OCCCSc1ccccn1 Amb9370833 [0,1,0,0,0,0|1,1,0]=3 2821 B11R1.28 OCCCSc1cccnn1 Amb27271620 [0,1,0,0,0,0|2,1,0]=4 2822 B11R1.28 OCCCSc1ccncc1 Amb27271641 [0,1,0,0,0,0|1,1,0]=3 2823 B11R1.28 OCCCSc1cnccn1 Amb27269178 [0,1,0,0,0,0|2,1,0]=4 2824 B11R1.28 OCCC[SiH2]c1ccccc1 Amb27989504 [0,1,0,0,0,0|1,0,0]=2 2825 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|1,0,0]=2 2826 B11R1.28 OCCNCc1ccccc1 Amb6537902 [0,1,0,0,0,0|1,0,0]=2 2827 B11R1.28 OCCNCc1ccccn1 Amb2592506 [0,1,0,0,0,0|2,0,0]=3 2828 B11R1.28 OCCNCc1cccnc1 Amb2721834 [0,1,0,0,0,0|2,0,0]=3 2829 B11R1.28 OCCNCc1cccnn1 Amb27671491 [0,1,0,0,0,0|3,0,0]=4 2830 B11R1.28 OCCNCc1ccncc1 Amb4166438 [0,1,0,0,0,0|2,0,0]=3 2831 B11R1.28 OCCOCc1ccccc1 Amb3939139 [0,1,0,0,0,0|0,0,0]=1 2832 B11R1.28 OCCSCc1ccccc1 Amb2688740 [0,1,0,0,0,0|0,1,0]=2 2833 B11R1.28 OCCSCc1ccccn1 Amb9362966 [0,1,0,0,0,0|1,1,0]=3 2834 B11R1.28 OCCSCc1cccnc1 Amb9274166 [0,1,0,0,0,0|1,1,0]=3 2835 B11R1.28 OCCSCc1ccncc1 Amb9362981 [0,1,0,0,0,0|1,1,0]=3 2836 B11R1.28 OCCSCc1ccncn1 Amb28080016 [0,1,0,0,0,0|2,1,0]=4 2837 B11R1.28 OCCSCc1ncccn1 Amb18183594 [0,1,0,0,0,0|2,1,0]=4 2838 B11R1.28 OCCSSc1ccccn1 Amb27266803 [0,1,0,0,0,0|1,1,0]=3 2839 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [0,1,0,0,0,0|1,0,0]=2 2840 B11R1.28 OCC\C=N\c1ccccc1 Amb27805392 [0,1,0,0,0,0|1,0,0]=2 2841 B11R1.28 OCC\N=C\c1cccnc1 Amb28125720 [0,1,0,0,0,0|2,0,0]=3 2842 B11R1.28 OCC\N=C\c1ccncc1 Amb26406078 [0,1,0,0,0,0|2,0,0]=3 2843 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [0,1,0,0,0,0|1,0,1]=3 2844 B11R1.28 OC\C=C\Oc1ccccn1 Amb27823751 [0,1,0,0,0,0|1,0,1]=3 2845 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [0,1,0,0,0,0|0,1,1]=3 2846 B11R1.28 ONCCCc1ccccc1 Amb26650950 [0,1,0,0,0,0|1,0,0]=2 2847 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|0,0,0]=1 2848 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [0,1,0,0,0,0|1,0,1]=3 2849 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [0,1,0,0,0,0|1,0,2]=4 2850 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|1,0,2]=4 2851 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [0,1,0,0,0,0|1,0,2]=4 2852 B11R1.28 O\N=C\CNc1ccccn1 Amb26576146 [0,1,0,0,0,0|2,0,1]=4 2853 B11R1.28 S=C=NCCc1ccccc1 Amb6316073 [0,1,0,0,0,0|1,1,1]=4 2854 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|1,1,0]=3 2855 B11R1.28 SCCCCc1ccccn1 Amb18563822 [0,1,0,0,0,0|2,1,0]=4 2856 B11R1.28 SCCCCc1cccnc1 Amb18563823 [0,1,0,0,0,0|2,1,0]=4 2857 B11R1.28 SCCCCc1ccncc1 Amb18065469 [0,1,0,0,0,0|2,1,0]=4 2858 B11R1.28 SCCCOc1ccccc1 Amb6255479 [0,1,0,0,0,0|0,1,0]=2 2859 B11R1.28 SCCCSc1ccncc1 Amb27671142 [0,1,0,0,0,0|1,2,0]=4 2860 B11R1.28 SCCNCc1ccccc1 Amb4405222 [0,1,0,0,0,0|1,1,0]=3 2861 B11R1.28 SCCNCc1ccccn1 Amb27001186 [0,1,0,0,0,0|2,1,0]=4 2862 B11R1.28 SCCNCc1cccnc1 Amb27001194 [0,1,0,0,0,0|2,1,0]=4 2863 B11R1.28 SCCNCc1ccncc1 Amb27272069 [0,1,0,0,0,0|2,1,0]=4 2864 B11R1.28 SCCOCc1ccccc1 Amb27457406 [0,1,0,0,0,0|0,1,0]=2 2865 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [0,1,0,0,0,0|1,1,0]=3 2866 B11R1.28 [C-]#[N+]CCCc1ccccc1 Amb2690315 [0,1,0,0,0,0|2,0,0]=3 2867 B11R1.28 [C-]#[N+]CCOc1ccccc1 Amb27428630 [0,1,0,0,0,0|1,0,0]=2 2868 B11R1.28 [C-]#[N+]C\C=C\c1ccccc1 Amb33081342 [0,1,0,0,0,0|2,0,1]=4 2869 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|3,0,0]=4 2870 B11R1.28 [N-]=[N+]=NCNc1ccccc1 Amb27791942 [0,1,0,0,0,0|3,0,0]=4 2871 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|2,1,0]=4 2872 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [0,1,0,0,0,0|2,0,1]=4 2873 B11R1.40 C#CC(O)Cc1ccccc1 Amb8392589 [0,1,0,0,0,0|2,0,1]=4 2874 B11R1.40 C#C[C@H](N)Cc1ccccc1 Amb27468328 [0,1,0,0,0,0|2,0,1]=4 2875 B11R1.40 C=C(CBr)Cc1ccccc1 Amb27481590 [0,1,0,0,0,0|2,0,1]=4 2876 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [0,1,0,0,0,0|2,0,1]=4 2877 B11R1.40 C=C(CCl)Cc1ccccc1 Amb25185403 [0,1,0,0,0,0|2,0,1]=4 2878 B11R1.40 C=C(CCl)Sc1ccccc1 Amb27478090 [0,1,0,0,0,0|1,1,1]=4 2879 B11R1.40 C=C(CN)Cc1ccccc1 Amb26614383 [0,1,0,0,0,0|2,0,1]=4 2880 B11R1.40 C=C(CN)Sc1ccccc1 Amb27847529 [0,1,0,0,0,0|1,1,1]=4 2881 B11R1.40 C=C(CO)Sc1ccccc1 Amb27961782 [0,1,0,0,0,0|0,1,1]=3 2882 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [0,1,0,0,0,0|2,0,1]=4 2883 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [0,1,0,0,0,0|2,0,1]=4 2884 B11R1.40 C=CC(C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|2,0,1]=4 2885 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [0,1,0,0,0,0|2,0,1]=4 2886 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|2,0,1]=4 2887 B11R1.40 C=C[C@@H](C)Nc1ccccc1 Amb28241123 [0,1,0,0,0,0|2,0,1]=4 2888 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [0,1,0,0,0,0|2,0,1]=4 2889 B11R1.40 C=C[C@H](C)Nc1ccccc1 Amb27596585 [0,1,0,0,0,0|2,0,1]=4 2890 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [0,1,0,0,0,0|2,0,1]=4 2891 B11R1.40 CC(C#N)Nc1ccccc1 Amb17399903 [0,1,0,0,0,0|2,0,1]=4 2892 B11R1.40 CC(C#N)Oc1ccccc1 Amb5780982 [0,1,0,0,0,0|1,0,1]=3 2893 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,1,0,0,0,0|1,1,1]=4 2894 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [0,1,0,0,0,0|1,0,2]=4 2895 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|0,0,2]=3 2896 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|0,1,2]=4 2897 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,0]=3 2898 B11R1.40 CC(CBr)Oc1ccccc1 Amb17241866 [0,1,0,0,0,0|1,0,0]=2 2899 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [0,1,0,0,0,0|2,0,0]=3 2900 B11R1.40 CC(CCl)Oc1ccccc1 Amb17232796 [0,1,0,0,0,0|1,0,0]=2 2901 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|2,0,0]=3 2902 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [0,1,0,0,0,0|2,0,0]=3 2903 B11R1.40 CC(CN)Cc1ccccn1 Amb5743833 [0,1,0,0,0,0|3,0,0]=4 2904 B11R1.40 CC(CN)Cc1cccnc1 Amb5743834 [0,1,0,0,0,0|3,0,0]=4 2905 B11R1.40 CC(CN)Cc1ccncc1 Amb5743835 [0,1,0,0,0,0|3,0,0]=4 2906 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,1,0,0,0,0|2,0,0]=3 2907 B11R1.40 CC(CN)Oc1ccccc1 Amb3938897 [0,1,0,0,0,0|1,0,0]=2 2908 B11R1.40 CC(CN)Oc1ccccc1 Amb6365930 [0,1,0,0,0,0|1,0,0]=2 2909 B11R1.40 CC(CN)Oc1ccccn1 Amb22522747 [0,1,0,0,0,0|2,0,0]=3 2910 B11R1.40 CC(CN)Oc1cccnc1 Amb3941161 [0,1,0,0,0,0|2,0,0]=3 2911 B11R1.40 CC(CN)Oc1ccncc1 Amb26948680 [0,1,0,0,0,0|2,0,0]=3 2912 B11R1.40 CC(CN)Oc1ncccn1 Amb23589261 [0,1,0,0,0,0|3,0,0]=4 2913 B11R1.40 CC(CN)Sc1ccccc1 Amb17485971 [0,1,0,0,0,0|1,1,0]=3 2914 B11R1.40 CC(CN)Sc1ccccn1 Amb18992825 [0,1,0,0,0,0|2,1,0]=4 2915 B11R1.40 CC(CN)Sc1ccccn1 Amb32662232 [0,1,0,0,0,0|2,1,0]=4 2916 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [0,1,0,0,0,0|1,0,0]=2 2917 B11R1.40 CC(CO)Cc1ccccn1 Amb33745069 [0,1,0,0,0,0|2,0,0]=3 2918 B11R1.40 CC(CO)Cc1cccnc1 Amb28350489 [0,1,0,0,0,0|2,0,0]=3 2919 B11R1.40 CC(CO)Cc1ccncc1 Amb25374015 [0,1,0,0,0,0|2,0,0]=3 2920 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|1,0,0]=2 2921 B11R1.40 CC(CO)Nc1cnccn1 Amb9360475 [0,1,0,0,0,0|3,0,0]=4 2922 B11R1.40 CC(CO)Oc1ccccc1 Amb17232100 [0,1,0,0,0,0|0,0,0]=1 2923 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [0,1,0,0,0,0|3,0,0]=4 2924 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [0,1,0,0,0,0|3,0,0]=4 2925 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [0,1,0,0,0,0|3,0,0]=4 2926 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [0,1,0,0,0,0|2,0,1]=4 2927 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,1,0,0,0,0|2,0,1]=4 2928 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [0,1,0,0,0,0|1,0,1]=3 2929 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [0,1,0,0,0,0|1,1,1]=4 2930 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|2,0,0]=3 2931 B11R1.40 CCC(Br)Cc1ccccn1 Amb28285520 [0,1,0,0,0,0|3,0,0]=4 2932 B11R1.40 CCC(Br)Cc1ccncc1 Amb24353281 [0,1,0,0,0,0|3,0,0]=4 2933 B11R1.40 CCC(Br)Cc1ccncc1 Amb32758727 [0,1,0,0,0,0|3,0,0]=4 2934 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [0,1,0,0,0,0|2,0,0]=3 2935 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,1,0,0,0,0|1,0,0]=2 2936 B11R1.40 CCC(C)Oc1cccnc1 Amb27432375 [0,1,0,0,0,0|2,0,0]=3 2937 B11R1.40 CCC(C)Oc1cnccn1 Amb27176565 [0,1,0,0,0,0|3,0,0]=4 2938 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,1,0,0,0,0|1,1,0]=3 2939 B11R1.40 CCC(C)Sc1ccncc1 Amb27840194 [0,1,0,0,0,0|2,1,0]=4 2940 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|2,0,0]=3 2941 B11R1.40 CCC(Cl)Cc1ccncc1 Amb17477712 [0,1,0,0,0,0|3,0,0]=4 2942 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [0,1,0,0,0,0|2,0,0]=3 2943 B11R1.40 CCC(N)Cc1ccccn1 Amb7772139 [0,1,0,0,0,0|3,0,0]=4 2944 B11R1.40 CCC(N)Cc1cccnc1 Amb9428899 [0,1,0,0,0,0|3,0,0]=4 2945 B11R1.40 CCC(N)Cc1ccncc1 Amb9428894 [0,1,0,0,0,0|3,0,0]=4 2946 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [0,1,0,0,0,0|2,0,0]=3 2947 B11R1.40 CCC(O)Cc1ccccn1 Amb17477703 [0,1,0,0,0,0|3,0,0]=4 2948 B11R1.40 CCC(O)Cc1ccncc1 Amb17477704 [0,1,0,0,0,0|3,0,0]=4 2949 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [0,1,0,0,0,0|2,0,0]=3 2950 B11R1.40 CCN(N)Cc1ccccc1 Amb17232076 [0,1,0,0,0,0|3,0,0]=4 2951 B11R1.40 CC[C@@H](C)Oc1cnccn1 Amb27214151 [0,1,0,0,0,0|3,0,0]=4 2952 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|2,0,0]=3 2953 B11R1.40 CC[C@@H](N)Cc1ccccn1 Amb27471046 [0,1,0,0,0,0|3,0,0]=4 2954 B11R1.40 CC[C@@H](N)Cc1ccncc1 Amb27945734 [0,1,0,0,0,0|3,0,0]=4 2955 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|2,0,0]=3 2956 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [0,1,0,0,0,0|2,0,0]=3 2957 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|2,0,0]=3 2958 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [0,1,0,0,0,0|2,0,0]=3 2959 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [0,1,0,0,0,0|2,0,1]=4 2960 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [0,1,0,0,0,0|2,0,1]=4 2961 B11R1.40 CC\C(I)=C/c1ccccc1 Amb22641702 [0,1,0,0,0,0|2,0,1]=4 2962 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [0,1,0,0,0,0|2,0,1]=4 2963 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [0,1,0,0,0,0|2,0,1]=4 2964 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [0,1,0,0,0,0|3,0,0]=4 2965 B11R1.40 CNC(O)Cc1ccccc1 Amb34915471 [0,1,0,0,0,0|3,0,0]=4 2966 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [0,1,0,0,0,0|3,0,0]=4 2967 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [0,1,0,0,0,0|3,0,0]=4 2968 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,1,0,0,0,0|2,0,1]=4 2969 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|0,0,2]=3 2970 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [0,1,0,0,0,0|2,0,0]=3 2971 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [0,1,0,0,0,0|2,0,0]=3 2972 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|2,0,0]=3 2973 B11R1.40 C[C@@H](CN)Cc1ccccn1 Amb33727431 [0,1,0,0,0,0|3,0,0]=4 2974 B11R1.40 C[C@@H](CN)Cc1cccnc1 Amb33731721 [0,1,0,0,0,0|3,0,0]=4 2975 B11R1.40 C[C@@H](CN)Cc1ccncc1 Amb28313701 [0,1,0,0,0,0|3,0,0]=4 2976 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [0,1,0,0,0,0|1,0,0]=2 2977 B11R1.40 C[C@@H](CO)Cc1ccccn1 Amb33735563 [0,1,0,0,0,0|2,0,0]=3 2978 B11R1.40 C[C@@H](CO)Cc1cccnc1 Amb33741020 [0,1,0,0,0,0|2,0,0]=3 2979 B11R1.40 C[C@@H](CO)Cc1ccncc1 Amb33735386 [0,1,0,0,0,0|2,0,0]=3 2980 B11R1.40 C[C@@H](CO)Nc1ccncc1 Amb28137825 [0,1,0,0,0,0|2,0,0]=3 2981 B11R1.40 C[C@@H](CO)Nc1cnccn1 Amb28127948 [0,1,0,0,0,0|3,0,0]=4 2982 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [0,1,0,0,0,0|2,0,0]=3 2983 B11R1.40 C[C@H](CN)Cc1ccccn1 Amb33747428 [0,1,0,0,0,0|3,0,0]=4 2984 B11R1.40 C[C@H](CN)Cc1cccnc1 Amb33737491 [0,1,0,0,0,0|3,0,0]=4 2985 B11R1.40 C[C@H](CN)Cc1ccncc1 Amb24745496 [0,1,0,0,0,0|3,0,0]=4 2986 B11R1.40 C[C@H](CN)Oc1ccccc1 Amb27803833 [0,1,0,0,0,0|1,0,0]=2 2987 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|1,0,0]=2 2988 B11R1.40 C[C@H](CO)Cc1ccccn1 Amb33730468 [0,1,0,0,0,0|2,0,0]=3 2989 B11R1.40 C[C@H](CO)Cc1cccnc1 Amb33737852 [0,1,0,0,0,0|2,0,0]=3 2990 B11R1.40 C[C@H](CO)Cc1ccncc1 Amb33730461 [0,1,0,0,0,0|2,0,0]=3 2991 B11R1.40 C[C@H](CO)Oc1ccccc1 Amb28182636 [0,1,0,0,0,0|0,0,0]=1 2992 B11R1.40 C[SiH](CO)Cc1ccccc1 Amb27981860 [0,1,0,0,0,0|1,1,0]=3 2993 B11R1.40 C\C(=C/c1ccccc1)CBr Amb33136396 [0,1,0,0,0,0|2,0,1]=4 2994 B11R1.40 C\C(=C/c1ccccc1)CCl Amb33136471 [0,1,0,0,0,0|2,0,1]=4 2995 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [0,1,0,0,0,0|2,0,1]=4 2996 B11R1.40 C\C(=C/c1ccccc1)CO Amb9825840 [0,1,0,0,0,0|1,0,1]=3 2997 B11R1.40 C\C(=C/c1ccccc1)CS Amb33381244 [0,1,0,0,0,0|1,1,1]=4 2998 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [0,1,0,0,0,0|2,0,1]=4 2999 B11R1.40 C\C(=C\c1ccncc1)CO Amb27663027 [0,1,0,0,0,0|2,0,1]=4 3000 B11R1.40 C\C(=N\O)Nc1ccccc1 Amb2610722 [0,1,0,0,0,0|2,0,1]=4 3001 B11R1.40 C\N=C(\C)Oc1ccccc1 Amb27260339 [0,1,0,0,0,0|2,0,1]=4 3002 B11R1.40 ClCC(Cl)Oc1ccccn1 Amb27823328 [0,1,0,0,0,0|2,0,0]=3 3003 B11R1.40 ClC\C(Cl)=N\c1ccccc1 Amb27875115 [0,1,0,0,0,0|2,0,1]=4 3004 B11R1.40 Cl\C=C(/Cl)Oc1ccccc1 Amb34048810 [0,1,0,0,0,0|1,0,2]=4 3005 B11R1.40 Cl\C=C(\Cl)Oc1ccccc1 Amb25968444 [0,1,0,0,0,0|1,0,2]=4 3006 B11R1.40 FCC(Cl)Sc1ccccc1 Amb27607707 [0,1,0,0,0,0|1,1,0]=3 3007 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,0]=3 3008 B11R1.40 F\C(=C/c1ccccc1)CBr Amb27828070 [0,1,0,0,0,0|2,0,1]=4 3009 B11R1.40 F\C(=C\Cl)Oc1ccccc1 Amb27477898 [0,1,0,0,0,0|1,0,2]=4 3010 B11R1.40 N#CC(=O)Oc1ccccc1 Amb27813575 [0,1,0,0,0,0|1,0,2]=4 3011 B11R1.40 N#CC(Br)Cc1ccccc1 Amb1154191 [0,1,0,0,0,0|2,0,1]=4 3012 B11R1.40 N#CC(Cl)Cc1ccccc1 Amb1103676 [0,1,0,0,0,0|2,0,1]=4 3013 B11R1.40 N#CC(Cl)Sc1ccccc1 Amb27955178 [0,1,0,0,0,0|1,1,1]=4 3014 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,1,0,0,0,0|1,1,1]=4 3015 B11R1.40 N#CC(N)Cc1ccccc1 Amb6892763 [0,1,0,0,0,0|2,0,1]=4 3016 B11R1.40 N#CC(N)Cc1ccccc1 Amb9707863 [0,1,0,0,0,0|2,0,1]=4 3017 B11R1.40 N#C[C@@H](N)Cc1ccccc1 Amb17399902 [0,1,0,0,0,0|2,0,1]=4 3018 B11R1.40 N#C[C@H](N)Cc1ccccc1 Amb26366283 [0,1,0,0,0,0|2,0,1]=4 3019 B11R1.40 N=C(CCl)Cc1ccccc1 Amb27878974 [0,1,0,0,0,0|2,0,1]=4 3020 B11R1.40 N=C(CCl)Nc1ccccc1 Amb27234641 [0,1,0,0,0,0|2,0,1]=4 3021 B11R1.40 N=C(CCl)Sc1ccccc1 Amb29847983 [0,1,0,0,0,0|1,1,1]=4 3022 B11R1.40 N=C(CF)Nc1ccccc1 Amb27863862 [0,1,0,0,0,0|2,0,1]=4 3023 B11R1.40 N=C(CO)Nc1ccccc1 Amb28062227 [0,1,0,0,0,0|1,0,1]=3 3024 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|2,0,1]=4 3025 B11R1.40 N=C(NN)Oc1ccccc1 Amb27769041 [0,1,0,0,0,0|2,0,1]=4 3026 B11R1.40 NC(CBr)Cc1ccccc1 Amb26619555 [0,1,0,0,0,0|2,0,0]=3 3027 B11R1.40 NC(CCl)Cc1ccccc1 Amb28076898 [0,1,0,0,0,0|2,0,0]=3 3028 B11R1.40 NC(CO)Cc1ccccc1 Amb6739795 [0,1,0,0,0,0|1,0,0]=2 3029 B11R1.40 NC(CO)Cc1ccccn1 Amb17062682 [0,1,0,0,0,0|2,0,0]=3 3030 B11R1.40 NC(CO)Cc1ccccn1 Amb32729336 [0,1,0,0,0,0|2,0,0]=3 3031 B11R1.40 NC(CO)Cc1ccccn1 Amb32729407 [0,1,0,0,0,0|2,0,0]=3 3032 B11R1.40 NC(CO)Cc1cccnc1 Amb17062683 [0,1,0,0,0,0|2,0,0]=3 3033 B11R1.40 NC(CO)Cc1cccnc1 Amb28872296 [0,1,0,0,0,0|2,0,0]=3 3034 B11R1.40 NC(CO)Cc1cccnc1 Amb32729349 [0,1,0,0,0,0|2,0,0]=3 3035 B11R1.40 NC(CO)Cc1ccncc1 Amb17062684 [0,1,0,0,0,0|2,0,0]=3 3036 B11R1.40 NC(CO)Cc1ccncc1 Amb28872297 [0,1,0,0,0,0|2,0,0]=3 3037 B11R1.40 NC(CO)Cc1ccncc1 Amb32729350 [0,1,0,0,0,0|2,0,0]=3 3038 B11R1.40 NC(CO)Cc1ccncn1 Amb24099661 [0,1,0,0,0,0|3,0,0]=4 3039 B11R1.40 NC(CO)Cc1ccnnc1 Amb33230897 [0,1,0,0,0,0|3,0,0]=4 3040 B11R1.40 NC(CO)Cc1cnccn1 Amb25972735 [0,1,0,0,0,0|3,0,0]=4 3041 B11R1.40 NC(CO)Cc1cncnc1 Amb25963732 [0,1,0,0,0,0|3,0,0]=4 3042 B11R1.40 NC(CO)Cc1ncccn1 Amb26016013 [0,1,0,0,0,0|3,0,0]=4 3043 B11R1.40 NC(CS)Cc1ccccc1 Amb27401982 [0,1,0,0,0,0|1,1,0]=3 3044 B11R1.40 NC(CS)Sc1ccccn1 Amb27620439 [0,1,0,0,0,0|1,2,0]=4 3045 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|2,0,1]=4 3046 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [0,1,0,0,0,0|2,0,1]=4 3047 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [0,1,0,0,0,0|2,0,1]=4 3048 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [0,1,0,0,0,0|2,0,1]=4 3049 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|1,0,1]=3 3050 B11R1.40 NCC(=O)Oc1cccnc1 Amb27193825 [0,1,0,0,0,0|2,0,1]=4 3051 B11R1.40 NCC(N)Cc1ccccc1 Amb9380670 [0,1,0,0,0,0|2,0,0]=3 3052 B11R1.40 NCC(N)Cc1ccccn1 Amb27176304 [0,1,0,0,0,0|3,0,0]=4 3053 B11R1.40 NCC(O)C[n+]1ccccc1 Amb28071215 [0,1,0,0,0,0|3,0,0]=4 3054 B11R1.40 NCC(O)Cc1ccccc1 Amb2697590 [0,1,0,0,0,0|2,0,0]=3 3055 B11R1.40 NCC(O)Cc1ccccc1 Amb8630271 [0,1,0,0,0,0|2,0,0]=3 3056 B11R1.40 NCC(O)Cc1ccccn1 Amb18201349 [0,1,0,0,0,0|3,0,0]=4 3057 B11R1.40 NCC(O)Cc1cccnc1 Amb17232103 [0,1,0,0,0,0|3,0,0]=4 3058 B11R1.40 NCC(O)Cc1ccncc1 Amb18201350 [0,1,0,0,0,0|3,0,0]=4 3059 B11R1.40 NC[C@@H](N)Cc1ccccc1 Amb17619360 [0,1,0,0,0,0|2,0,0]=3 3060 B11R1.40 NC[C@@H](N)Cc1ccccn1 Amb27390029 [0,1,0,0,0,0|3,0,0]=4 3061 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|2,0,0]=3 3062 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb33456886 [0,1,0,0,0,0|2,0,0]=3 3063 B11R1.40 NC[C@H](N)Cc1ccccc1 Amb17619359 [0,1,0,0,0,0|2,0,0]=3 3064 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|2,0,0]=3 3065 B11R1.40 NNC(=O)Oc1ccccc1 Amb2737176 [0,1,0,0,0,0|2,0,1]=4 3066 B11R1.40 NNC(=S)Oc1ccccc1 Amb28248761 [0,1,0,0,0,0|2,0,1]=4 3067 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [0,1,0,0,0,0|2,0,1]=4 3068 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb27413229 [0,1,0,0,0,0|2,0,0]=3 3069 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb33624252 [0,1,0,0,0,0|2,0,0]=3 3070 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb534734 [0,1,0,0,0,0|1,0,0]=2 3071 B11R1.40 N[C@@H](CO)Cc1cccnc1 Amb27590328 [0,1,0,0,0,0|2,0,0]=3 3072 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [0,1,0,0,0,0|1,0,2]=4 3073 B11R1.40 N[C@H](CBr)Cc1ccccc1 Amb25923127 [0,1,0,0,0,0|2,0,0]=3 3074 B11R1.40 N[C@H](CO)Cc1ccccc1 Amb3939343 [0,1,0,0,0,0|1,0,0]=2 3075 B11R1.40 N[C@H](CO)Cc1ccccn1 Amb28365427 [0,1,0,0,0,0|2,0,0]=3 3076 B11R1.40 N[C@H](CO)Cc1ccncc1 Amb28368142 [0,1,0,0,0,0|2,0,0]=3 3077 B11R1.40 N[C@H](CS)Sc1ccccn1 Amb27629028 [0,1,0,0,0,0|1,2,0]=4 3078 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb18799378 [0,1,0,0,0,0|2,0,1]=4 3079 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb33743404 [0,1,0,0,0,0|2,0,1]=4 3080 B11R1.40 N\C(Cc1ccccc1)=N/O Amb1159399 [0,1,0,0,0,0|2,0,1]=4 3081 B11R1.40 N\C(Cc1ccccc1)=N\O Amb1106303 [0,1,0,0,0,0|2,0,1]=4 3082 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|2,0,1]=4 3083 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|2,0,1]=4 3084 B11R1.40 O=C(CBr)Oc1ccccc1 Amb3940897 [0,1,0,0,0,0|1,0,1]=3 3085 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|2,0,1]=4 3086 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [0,1,0,0,0,0|2,0,1]=4 3087 B11R1.40 O=C(CCl)Oc1ccccc1 Amb1914503 [0,1,0,0,0,0|1,0,1]=3 3088 B11R1.40 O=C(CCl)Oc1ccncc1 Amb27484110 [0,1,0,0,0,0|2,0,1]=4 3089 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|2,0,1]=4 3090 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|2,0,1]=4 3091 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,1]=3 3092 B11R1.40 O=C(CO)Nc1ccccn1 Amb5798132 [0,1,0,0,0,0|2,0,1]=4 3093 B11R1.40 O=C(CO)Nc1cccnc1 Amb5798134 [0,1,0,0,0,0|2,0,1]=4 3094 B11R1.40 O=C(CO)Nc1ccncc1 Amb5798135 [0,1,0,0,0,0|2,0,1]=4 3095 B11R1.40 O=C(CO)Oc1cccnc1 Amb28189046 [0,1,0,0,0,0|1,0,1]=3 3096 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,1,1]=4 3097 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [0,1,0,0,0,0|2,0,1]=4 3098 B11R1.40 O=C(NO)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|1,0,1]=3 3099 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [0,1,0,0,0,0|1,0,2]=4 3100 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [0,1,0,0,0,0|1,0,2]=4 3101 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [0,1,0,0,0,0|1,0,2]=4 3102 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [0,1,0,0,0,0|1,0,2]=4 3103 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [0,1,0,0,0,0|1,0,2]=4 3104 B11R1.40 OC(CBr)Cc1ccccc1 Amb17595843 [0,1,0,0,0,0|2,0,0]=3 3105 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|1,1,0]=3 3106 B11R1.40 OC(CCl)Cc1ccccc1 Amb4035193 [0,1,0,0,0,0|2,0,0]=3 3107 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|2,0,0]=3 3108 B11R1.40 OCC(Br)Cc1ccccc1 Amb27225418 [0,1,0,0,0,0|1,0,0]=2 3109 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|1,0,0]=2 3110 B11R1.40 OCC(O)Cc1ccccc1 Amb17593786 [0,1,0,0,0,0|1,0,0]=2 3111 B11R1.40 OCC(O)Cc1ccccn1 Amb26381861 [0,1,0,0,0,0|2,0,0]=3 3112 B11R1.40 OCC(O)Oc1ccccc1 Amb28344634 [0,1,0,0,0,0|0,0,0]=1 3113 B11R1.40 OCC(S)Cc1ccccc1 Amb28292008 [0,1,0,0,0,0|1,0,0]=2 3114 B11R1.40 OC[C@@H](Br)Cc1ccccc1 Amb26974518 [0,1,0,0,0,0|1,0,0]=2 3115 B11R1.40 OC[C@@H](Cl)Cc1ccccc1 Amb25984616 [0,1,0,0,0,0|1,0,0]=2 3116 B11R1.40 OC[C@H](F)Cc1ccccc1 Amb27756441 [0,1,0,0,0,0|1,0,0]=2 3117 B11R1.40 OC\C(Cl)=C/c1ccccc1 Amb27234634 [0,1,0,0,0,0|1,0,1]=3 3118 B11R1.40 ONC(=S)Nc1ccccc1 Amb9824829 [0,1,0,0,0,0|2,0,1]=4 3119 B11R1.40 O[C@@H](CBr)Cc1ccccc1 Amb28135916 [0,1,0,0,0,0|2,0,0]=3 3120 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|2,0,0]=3 3121 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|2,0,0]=3 3122 B11R1.40 O\N=C(/Cl)Cc1ccccc1 Amb33625234 [0,1,0,0,0,0|2,0,1]=4 3123 B11R1.40 O\N=C(/O)Cc1ccccc1 Amb19986986 [0,1,0,0,0,0|2,0,1]=4 3124 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [0,1,0,0,0,0|3,0,0]=4 3125 B11R1.40 [NH3+]C(CO)Cc1ccccc1 Amb33512954 [0,1,0,0,0,0|1,0,0]=2 3126 B11R1.91 C=C(Br)CNc1ccccc1 Amb4303983 [0,1,0,0,0,0|2,0,1]=4 3127 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [0,1,0,0,0,0|2,0,1]=4 3128 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [0,1,0,0,0,0|2,0,1]=4 3129 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|1,0,1]=3 3130 B11R1.91 C=C(C)COc1cccnc1 Amb27485111 [0,1,0,0,0,0|2,0,1]=4 3131 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [0,1,0,0,0,0|1,1,1]=4 3132 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|2,0,1]=4 3133 B11R1.91 C=C(Cl)CSc1ccccc1 Amb4013517 [0,1,0,0,0,0|1,1,1]=4 3134 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [0,1,0,0,0,0|2,0,1]=4 3135 B11R1.91 C=[ClH](C)COc1ccccc1 Amb28059898 [0,1,0,0,0,0|2,0,0]=3 3136 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [0,1,0,0,0,0|1,0,2]=4 3137 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|1,0,2]=4 3138 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [0,1,0,0,0,0|0,0,2]=3 3139 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [0,1,0,0,0,0|1,0,2]=4 3140 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [0,1,0,0,0,0|0,1,2]=4 3141 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [0,1,0,0,0,0|2,0,0]=3 3142 B11R1.91 CC(Br)CCc1cccnc1 Amb28401177 [0,1,0,0,0,0|3,0,0]=4 3143 B11R1.91 CC(Br)CNc1ccccc1 Amb28428528 [0,1,0,0,0,0|2,0,0]=3 3144 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,1,0,0,0,0|1,0,0]=2 3145 B11R1.91 CC(Br)CSc1ccccc1 Amb27628746 [0,1,0,0,0,0|1,1,0]=3 3146 B11R1.91 CC(Br)\C=C\c1ccccc1 Amb27401147 [0,1,0,0,0,0|2,0,1]=4 3147 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [0,1,0,0,0,0|1,0,2]=4 3148 B11R1.91 CC(C)CC[n+]1ccccc1 Amb27809209 [0,1,0,0,0,0|3,0,0]=4 3149 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [0,1,0,0,0,0|2,0,0]=3 3150 B11R1.91 CC(C)CCc1ccccn1 Amb27400236 [0,1,0,0,0,0|3,0,0]=4 3151 B11R1.91 CC(C)CNc1ccccc1 Amb28960302 [0,1,0,0,0,0|2,0,0]=3 3152 B11R1.91 CC(C)CNc1ccccc1 Amb4304155 [0,1,0,0,0,0|2,0,0]=3 3153 B11R1.91 CC(C)CNc1cccnc1 Amb33527398 [0,1,0,0,0,0|3,0,0]=4 3154 B11R1.91 CC(C)COc1ccccc1 Amb27668259 [0,1,0,0,0,0|1,0,0]=2 3155 B11R1.91 CC(C)COc1ccccn1 Amb27760645 [0,1,0,0,0,0|2,0,0]=3 3156 B11R1.91 CC(C)COc1cccnc1 Amb27836213 [0,1,0,0,0,0|2,0,0]=3 3157 B11R1.91 CC(C)COc1cnccn1 Amb25877190 [0,1,0,0,0,0|3,0,0]=4 3158 B11R1.91 CC(C)CSc1ccccc1 Amb4016673 [0,1,0,0,0,0|1,1,0]=3 3159 B11R1.91 CC(C)NCc1ccccc1 Amb4020804 [0,1,0,0,0,0|3,0,0]=4 3160 B11R1.91 CC(C)NCc1ccccc1 Amb6383293 [0,1,0,0,0,0|3,0,0]=4 3161 B11R1.91 CC(C)OCc1ccccc1 Amb3988003 [0,1,0,0,0,0|3,0,0]=4 3162 B11R1.91 CC(C)SCc1ccccc1 Amb25935134 [0,1,0,0,0,0|3,0,0]=4 3163 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [0,1,0,0,0,0|2,0,1]=4 3164 B11R1.91 CC(C)\C=C\c1ccccc1 Amb33620440 [0,1,0,0,0,0|2,0,1]=4 3165 B11R1.91 CC(C)\N=C\c1ccccc1 Amb4020035 [0,1,0,0,0,0|3,0,0]=4 3166 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [0,1,0,0,0,0|2,0,0]=3 3167 B11R1.91 CC(Cl)CCc1ccccn1 Amb27763955 [0,1,0,0,0,0|3,0,0]=4 3168 B11R1.91 CC(Cl)CNc1ccncc1 Amb27980943 [0,1,0,0,0,0|3,0,0]=4 3169 B11R1.91 CC(Cl)SCc1ccccc1 Amb27638041 [0,1,0,0,0,0|3,0,0]=4 3170 B11R1.91 CC(F)CNc1ccccc1 Amb27872143 [0,1,0,0,0,0|2,0,0]=3 3171 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [0,1,0,0,0,0|2,0,0]=3 3172 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [0,1,0,0,0,0|2,0,0]=3 3173 B11R1.91 CC(N)CCc1ccccn1 Amb17507327 [0,1,0,0,0,0|3,0,0]=4 3174 B11R1.91 CC(N)CCc1cccnc1 Amb17507328 [0,1,0,0,0,0|3,0,0]=4 3175 B11R1.91 CC(N)CCc1ccncc1 Amb17507329 [0,1,0,0,0,0|3,0,0]=4 3176 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,1,0,0,0,0|2,0,0]=3 3177 B11R1.91 CC(N)CNc1ccccn1 Amb18125324 [0,1,0,0,0,0|3,0,0]=4 3178 B11R1.91 CC(N)COc1ccccc1 Amb10609380 [0,1,0,0,0,0|1,0,0]=2 3179 B11R1.91 CC(N)COc1ccccc1 Amb9756346 [0,1,0,0,0,0|1,0,0]=2 3180 B11R1.91 CC(N)COc1cccnn1 Amb35727567 [0,1,0,0,0,0|3,0,0]=4 3181 B11R1.91 CC(N)COc1ccncn1 Amb35727568 [0,1,0,0,0,0|3,0,0]=4 3182 B11R1.91 CC(N)COc1cnccn1 Amb35727571 [0,1,0,0,0,0|3,0,0]=4 3183 B11R1.91 CC(N)COc1ncccn1 Amb28200899 [0,1,0,0,0,0|3,0,0]=4 3184 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,1,0,0,0,0|1,1,0]=3 3185 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,1,0,0,0,0|1,1,0]=3 3186 B11R1.91 CC(N)CSc1ccccn1 Amb22642666 [0,1,0,0,0,0|2,1,0]=4 3187 B11R1.91 CC(N)CSc1ccccn1 Amb32662174 [0,1,0,0,0,0|2,1,0]=4 3188 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [0,1,0,0,0,0|2,0,1]=4 3189 B11R1.91 CC(N)\N=N\c1ccccc1 Amb26948832 [0,1,0,0,0,0|3,0,0]=4 3190 B11R1.91 CC(O)C#Cc1ccccc1 Amb534711 [0,1,0,0,0,0|1,0,1]=3 3191 B11R1.91 CC(O)C#Cc1cccnc1 Amb9777317 [0,1,0,0,0,0|2,0,1]=4 3192 B11R1.91 CC(O)C#Cc1ccncc1 Amb9777315 [0,1,0,0,0,0|2,0,1]=4 3193 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [0,1,0,0,0,0|1,0,0]=2 3194 B11R1.91 CC(O)CCc1ccccn1 Amb17507263 [0,1,0,0,0,0|2,0,0]=3 3195 B11R1.91 CC(O)CCc1cccnc1 Amb17507264 [0,1,0,0,0,0|2,0,0]=3 3196 B11R1.91 CC(O)CCc1ccncc1 Amb17507265 [0,1,0,0,0,0|2,0,0]=3 3197 B11R1.91 CC(O)CCc1ccncn1 Amb27153327 [0,1,0,0,0,0|3,0,0]=4 3198 B11R1.91 CC(O)CCc1cnccn1 Amb26539825 [0,1,0,0,0,0|3,0,0]=4 3199 B11R1.91 CC(O)CCc1cncnc1 Amb27799657 [0,1,0,0,0,0|3,0,0]=4 3200 B11R1.91 CC(O)CCc1ncccn1 Amb27656314 [0,1,0,0,0,0|3,0,0]=4 3201 B11R1.91 CC(O)CNc1ccccc1 Amb6537763 [0,1,0,0,0,0|1,0,0]=2 3202 B11R1.91 CC(O)CNc1ccncc1 Amb9248479 [0,1,0,0,0,0|2,0,0]=3 3203 B11R1.91 CC(O)CNc1cnccn1 Amb2445430 [0,1,0,0,0,0|3,0,0]=4 3204 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [0,1,0,0,0,0|0,0,0]=1 3205 B11R1.91 CC(O)CPc1ccccc1 Amb27756306 [0,1,0,0,0,0|1,0,0]=2 3206 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|0,1,0]=2 3207 B11R1.91 CC(O)CSc1ccncc1 Amb27979111 [0,1,0,0,0,0|1,1,0]=3 3208 B11R1.91 CC(O)CSc1cnccn1 Amb27457141 [0,1,0,0,0,0|2,1,0]=4 3209 B11R1.91 CC(O)CSc1ncccn1 Amb18180264 [0,1,0,0,0,0|2,1,0]=4 3210 B11R1.91 CC(O)\C=C\c1ccccc1 Amb17593695 [0,1,0,0,0,0|1,0,1]=3 3211 B11R1.91 CC(O)\C=C\c1ccccn1 Amb576300 [0,1,0,0,0,0|2,0,1]=4 3212 B11R1.91 CC(O)\C=C\c1cccnc1 Amb25847379 [0,1,0,0,0,0|2,0,1]=4 3213 B11R1.91 CC(O)\C=C\c1ccncc1 Amb616107 [0,1,0,0,0,0|2,0,1]=4 3214 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [0,1,0,0,0,0|1,1,0]=3 3215 B11R1.91 CC(S)COc1ccccc1 Amb29854435 [0,1,0,0,0,0|0,1,0]=2 3216 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [0,1,0,0,0,0|3,0,0]=4 3217 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|3,0,0]=4 3218 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [0,1,0,0,0,0|2,0,0]=3 3219 B11R1.91 CN(O)CCc1ccncc1 Amb25684228 [0,1,0,0,0,0|3,0,0]=4 3220 B11R1.91 CN(O)\N=N\c1ccccc1 Amb27185830 [0,1,0,0,0,0|3,0,0]=4 3221 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [0,1,0,0,0,0|2,0,0]=3 3222 B11R1.91 C[C@@H](N)CCc1ccccn1 Amb25076768 [0,1,0,0,0,0|3,0,0]=4 3223 B11R1.91 C[C@@H](N)CCc1cccnc1 Amb27461341 [0,1,0,0,0,0|3,0,0]=4 3224 B11R1.91 C[C@@H](N)CCc1ccncc1 Amb24551017 [0,1,0,0,0,0|3,0,0]=4 3225 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,1,0,0,0,0|1,0,0]=2 3226 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb33083236 [0,1,0,0,0,0|2,0,1]=4 3227 B11R1.91 C[C@@H](O)C#Cc1ccccc1 Amb27865137 [0,1,0,0,0,0|1,0,1]=3 3228 B11R1.91 C[C@@H](O)C#Cc1ccccn1 Amb25299246 [0,1,0,0,0,0|2,0,1]=4 3229 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|1,0,0]=2 3230 B11R1.91 C[C@@H](O)CCc1ccccn1 Amb33360774 [0,1,0,0,0,0|2,0,0]=3 3231 B11R1.91 C[C@@H](O)CCc1cccnc1 Amb33360059 [0,1,0,0,0,0|2,0,0]=3 3232 B11R1.91 C[C@@H](O)CCc1ccncc1 Amb33380653 [0,1,0,0,0,0|2,0,0]=3 3233 B11R1.91 C[C@@H](O)CCc1ccncn1 Amb33268597 [0,1,0,0,0,0|3,0,0]=4 3234 B11R1.91 C[C@@H](O)CCc1cnccn1 Amb33359978 [0,1,0,0,0,0|3,0,0]=4 3235 B11R1.91 C[C@@H](O)CCc1cncnc1 Amb33149182 [0,1,0,0,0,0|3,0,0]=4 3236 B11R1.91 C[C@@H](O)CCc1ncccn1 Amb33270396 [0,1,0,0,0,0|3,0,0]=4 3237 B11R1.91 C[C@@H](O)CNc1ccccc1 Amb27400122 [0,1,0,0,0,0|1,0,0]=2 3238 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [0,1,0,0,0,0|0,0,0]=1 3239 B11R1.91 C[C@@H](O)CSc1ccccn1 Amb27812128 [0,1,0,0,0,0|1,1,0]=3 3240 B11R1.91 C[C@@H](O)\C=C\c1ccccc1 Amb32954507 [0,1,0,0,0,0|1,0,1]=3 3241 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [0,1,0,0,0,0|2,0,0]=3 3242 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [0,1,0,0,0,0|2,0,0]=3 3243 B11R1.91 C[C@H](N)CCc1ccccn1 Amb27655480 [0,1,0,0,0,0|3,0,0]=4 3244 B11R1.91 C[C@H](N)CCc1cccnc1 Amb27391591 [0,1,0,0,0,0|3,0,0]=4 3245 B11R1.91 C[C@H](N)CCc1ccncc1 Amb24715801 [0,1,0,0,0,0|3,0,0]=4 3246 B11R1.91 C[C@H](N)COc1ccccc1 Amb17232092 [0,1,0,0,0,0|1,0,0]=2 3247 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb32954166 [0,1,0,0,0,0|2,0,1]=4 3248 B11R1.91 C[C@H](O)C#Cc1ccccc1 Amb27823543 [0,1,0,0,0,0|1,0,1]=3 3249 B11R1.91 C[C@H](O)C#Cc1ccccn1 Amb27617410 [0,1,0,0,0,0|2,0,1]=4 3250 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|1,0,0]=2 3251 B11R1.91 C[C@H](O)CCc1ccccn1 Amb33360775 [0,1,0,0,0,0|2,0,0]=3 3252 B11R1.91 C[C@H](O)CCc1cccnc1 Amb33360413 [0,1,0,0,0,0|2,0,0]=3 3253 B11R1.91 C[C@H](O)CCc1ccncc1 Amb33380654 [0,1,0,0,0,0|2,0,0]=3 3254 B11R1.91 C[C@H](O)CCc1ccncn1 Amb33268662 [0,1,0,0,0,0|3,0,0]=4 3255 B11R1.91 C[C@H](O)CCc1cnccn1 Amb33359979 [0,1,0,0,0,0|3,0,0]=4 3256 B11R1.91 C[C@H](O)CCc1cncnc1 Amb33149415 [0,1,0,0,0,0|3,0,0]=4 3257 B11R1.91 C[C@H](O)CCc1ncccn1 Amb33270794 [0,1,0,0,0,0|3,0,0]=4 3258 B11R1.91 C[C@H](O)CNc1ncccn1 Amb27836469 [0,1,0,0,0,0|3,0,0]=4 3259 B11R1.91 C[C@H](O)CSc1cccnc1 Amb27978404 [0,1,0,0,0,0|1,1,0]=3 3260 B11R1.91 C[C@H](O)\C=C\c1ccccc1 Amb27405101 [0,1,0,0,0,0|1,0,1]=3 3261 B11R1.91 ClC(Cl)CSc1ccccc1 Amb28129316 [0,1,0,0,0,0|1,1,0]=3 3262 B11R1.91 ClC(Cl)OCc1ccccc1 Amb28244766 [0,1,0,0,0,0|3,0,0]=4 3263 B11R1.91 FC(Cl)CSc1ccccc1 Amb27847576 [0,1,0,0,0,0|1,1,0]=3 3264 B11R1.91 FC(F)C#Cc1ccccc1 Amb27617278 [0,1,0,0,0,0|2,0,1]=4 3265 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,1,0,0,0,0|2,0,0]=3 3266 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,1,0,0,0,0|2,0,0]=3 3267 B11R1.91 FC(F)CNc1cccnc1 Amb35751399 [0,1,0,0,0,0|3,0,0]=4 3268 B11R1.91 FC(F)CNc1ccncc1 Amb26058483 [0,1,0,0,0,0|3,0,0]=4 3269 B11R1.91 FC(F)CNc1ccncc1 Amb33528958 [0,1,0,0,0,0|3,0,0]=4 3270 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,1,0,0,0,0|1,0,0]=2 3271 B11R1.91 FC(F)COc1ccccn1 Amb25884399 [0,1,0,0,0,0|2,0,0]=3 3272 B11R1.91 FC(F)COc1cnccn1 Amb33612037 [0,1,0,0,0,0|3,0,0]=4 3273 B11R1.91 FC(F)COc1ncccn1 Amb33612038 [0,1,0,0,0,0|3,0,0]=4 3274 B11R1.91 FC(F)CSc1ccccn1 Amb28189880 [0,1,0,0,0,0|2,1,0]=4 3275 B11R1.91 FC(F)SCc1ccccc1 Amb7969851 [0,1,0,0,0,0|3,0,0]=4 3276 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [0,1,0,0,0,0|2,0,1]=4 3277 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [0,1,0,0,0,0|2,0,1]=4 3278 B11R1.91 N=C(N)COc1ccccc1 Amb2725000 [0,1,0,0,0,0|1,0,1]=3 3279 B11R1.91 N=C(N)COc1ccccc1 Amb33551040 [0,1,0,0,0,0|1,0,1]=3 3280 B11R1.91 N=C(N)CSc1ccccc1 Amb2726049 [0,1,0,0,0,0|1,1,1]=4 3281 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [0,1,0,0,0,0|1,0,2]=4 3282 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [0,1,0,0,0,0|1,0,2]=4 3283 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [0,1,0,0,0,0|0,0,2]=3 3284 B11R1.91 NC(=O)COc1ccccn1 Amb27878790 [0,1,0,0,0,0|1,0,2]=4 3285 B11R1.91 NC(=O)COc1cccnc1 Amb6739850 [0,1,0,0,0,0|1,0,2]=4 3286 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [0,1,0,0,0,0|0,1,2]=4 3287 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|1,1,1]=4 3288 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|0,1,1]=3 3289 B11R1.91 NC(=S)COc1cccnc1 Amb29848721 [0,1,0,0,0,0|1,1,1]=4 3290 B11R1.91 NC(=S)CSc1ccccc1 Amb6572429 [0,1,0,0,0,0|0,2,1]=4 3291 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [0,1,0,0,0,0|1,0,2]=4 3292 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [0,1,0,0,0,0|0,0,2]=3 3293 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [0,1,0,0,0,0|0,1,2]=4 3294 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [0,1,0,0,0,0|1,0,2]=4 3295 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [0,1,0,0,0,0|2,0,1]=4 3296 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [0,1,0,0,0,0|1,0,1]=3 3297 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [0,1,0,0,0,0|2,0,1]=4 3298 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [0,1,0,0,0,0|2,0,1]=4 3299 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [0,1,0,0,0,0|2,0,1]=4 3300 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|2,0,1]=4 3301 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|2,0,1]=4 3302 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [0,1,0,0,0,0|1,0,1]=3 3303 B11R1.91 O=C(O)CNc1ccccn1 Amb33549202 [0,1,0,0,0,0|2,0,1]=4 3304 B11R1.91 O=C(O)CNc1ccccn1 Amb4025757 [0,1,0,0,0,0|2,0,1]=4 3305 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [0,1,0,0,0,0|2,0,1]=4 3306 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [0,1,0,0,0,0|2,0,1]=4 3307 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [0,1,0,0,0,0|2,0,1]=4 3308 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [0,1,0,0,0,0|2,0,1]=4 3309 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|0,0,1]=2 3310 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|0,0,1]=2 3311 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [0,1,0,0,0,0|1,0,1]=3 3312 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [0,1,0,0,0,0|1,0,1]=3 3313 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [0,1,0,0,0,0|1,0,1]=3 3314 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [0,1,0,0,0,0|1,0,1]=3 3315 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [0,1,0,0,0,0|1,0,1]=3 3316 B11R1.91 O=C(O)COc1cccnn1 Amb2819556 [0,1,0,0,0,0|2,0,1]=4 3317 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [0,1,0,0,0,0|1,0,1]=3 3318 B11R1.91 O=C(O)COc1ccncn1 Amb26495531 [0,1,0,0,0,0|2,0,1]=4 3319 B11R1.91 O=C(O)COc1cnccn1 Amb26976070 [0,1,0,0,0,0|2,0,1]=4 3320 B11R1.91 O=C(O)COc1cncnc1 Amb8009333 [0,1,0,0,0,0|2,0,1]=4 3321 B11R1.91 O=C(O)COc1ncccn1 Amb8010398 [0,1,0,0,0,0|2,0,1]=4 3322 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|0,1,1]=3 3323 B11R1.91 O=C(O)CSc1ccccn1 Amb1130490 [0,1,0,0,0,0|1,1,1]=4 3324 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [0,1,0,0,0,0|1,1,1]=4 3325 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [0,1,0,0,0,0|1,1,1]=4 3326 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [0,1,0,0,0,0|1,0,2]=4 3327 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [0,1,0,0,0,0|1,0,2]=4 3328 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [0,1,0,0,0,0|1,0,2]=4 3329 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|1,0,2]=4 3330 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [0,1,0,0,0,0|1,0,2]=4 3331 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [0,1,0,0,0,0|0,0,2]=3 3332 B11R1.91 O=C([O-])COc1ccccn1 Amb30584712 [0,1,0,0,0,0|1,0,2]=4 3333 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [0,1,0,0,0,0|2,0,0]=3 3334 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [0,1,0,0,0,0|2,0,1]=4 3335 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [0,1,0,0,0,0|2,0,1]=4 3336 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|2,0,1]=4 3337 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [0,1,0,0,0,0|2,0,0]=3 3338 B11R1.91 OB(O)C#Cc1ccccc1 Amb25151882 [0,1,0,0,0,0|2,0,1]=4 3339 B11R1.91 OB(O)CCc1ccccc1 Amb2456045 [0,1,0,0,0,0|2,0,0]=3 3340 B11R1.91 OB(O)CCc1cccnc1 Amb25259201 [0,1,0,0,0,0|3,0,0]=4 3341 B11R1.91 OB(O)CCc1ccncc1 Amb28456641 [0,1,0,0,0,0|3,0,0]=4 3342 B11R1.91 OB(O)CSc1ccccc1 Amb27450702 [0,1,0,0,0,0|1,1,0]=3 3343 B11R1.91 OB(O)CSc1ccccn1 Amb22388601 [0,1,0,0,0,0|2,1,0]=4 3344 B11R1.91 OB(O)O[Hg]c1ccccc1 Amb22345921 [0,1,0,0,0,0|3,0,0]=4 3345 B11R1.91 OB(O)\C=C\c1ccccc1 Amb2447227 [0,1,0,0,0,0|2,0,1]=4 3346 B11R1.91 OC(Cl)CNc1ccccc1 Amb28291556 [0,1,0,0,0,0|1,0,0]=2 3347 B9R0.18 C=CC\C=C(\C)CCCO Amb27435598 [0,0,1,0,0,0|1,0,2]=4 3348 B9R0.18 C=C\C=C\C(C)OCCCl Amb24428942 [0,0,1,0,0,0|1,0,2]=4 3349 B9R0.45 C=CCC\C=C\CCCO Amb27485402 [0,0,1,0,0,0|1,0,2]=4 3350 B9R0.45 C=CC\C=C\CCCCO Amb28050717 [0,0,1,0,0,0|1,0,2]=4 3351 B9R0.45 C=C\C=C\CCCCCO Amb27242542 [0,0,1,0,0,0|1,0,2]=4 3352 B9R0.45 C\C=C\C=C/C=C/CCC Amb22641677 [0,0,1,0,0,0|2,0,1]=4 3353 B9R0.45 C\C=C\C=C\C=C\CCBr Amb28053636 [0,0,1,0,0,0|2,0,1]=4 3354 B9R0.45 C\C=C\C=C\C=C\CCCl Amb28195306 [0,0,1,0,0,0|2,0,1]=4 3355 B9R0.45 C\C=C\C\C=C\CCCO Amb27977518 [0,0,1,0,0,0|1,0,2]=4 3356 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [0,0,0,1,0,0|2,0,0]=3 3357 B11R2.1 Brc1coc2ccccc12 Amb6344810 [0,0,0,1,0,0|1,0,2]=4 3358 B11R2.1 Brc1noc2ccccc12 Amb18187786 [0,0,0,1,0,0|2,0,1]=4 3359 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|2,0,1]=4 3360 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [0,0,0,1,0,0|2,0,1]=4 3361 B11R2.1 CC1C=Cc2ccccc21 Amb17844052 [0,0,0,1,0,0|2,0,1]=4 3362 B11R2.1 CC1CCc2ccccc21 Amb28050187 [0,0,0,1,0,0|2,0,0]=3 3363 B11R2.1 CC1CCc2cccnc21 Amb28050279 [0,0,0,1,0,0|3,0,0]=4 3364 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|2,0,0]=3 3365 B11R2.1 CC1CNc2ccccc21 Amb9197981 [0,0,0,1,0,0|2,0,0]=3 3366 B11R2.1 CC1CNc2cnccc21 Amb33742877 [0,0,0,1,0,0|3,0,0]=4 3367 B11R2.1 CC1COc2ccccc21 Amb27617216 [0,0,0,1,0,0|1,0,0]=2 3368 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,1,0,0|3,0,0]=4 3369 B11R2.1 CC1NCc2ccccc21 Amb32751285 [0,0,0,1,0,0|3,0,0]=4 3370 B11R2.1 CC1OCc2ccccc21 Amb25913589 [0,0,0,1,0,0|3,0,0]=4 3371 B11R2.1 CN1CCc2ccccc21 Amb15691717 [0,0,0,1,0,0|3,0,0]=4 3372 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,1,0,0|3,0,0]=4 3373 B11R2.1 C[C@@H]1NCc2ccccc21 Amb32668091 [0,0,0,1,0,0|3,0,0]=4 3374 B11R2.1 C[C@H]1CNc2ccccc21 Amb27222357 [0,0,0,1,0,0|2,0,0]=3 3375 B11R2.1 C[C@H]1NCc2ccccc21 Amb28206726 [0,0,0,1,0,0|3,0,0]=4 3376 B11R2.1 C[C@H]1NCc2ccccc21 Amb32667894 [0,0,0,1,0,0|3,0,0]=4 3377 B11R2.1 C[n+]1coc2ccccc21 Amb27961147 [0,0,0,1,0,0|2,0,1]=4 3378 B11R2.1 Cc1coc2ccccc12 Amb2684177 [0,0,0,1,0,0|1,0,2]=4 3379 B11R2.1 Cc1noc2ccccc12 Amb445022 [0,0,0,1,0,0|2,0,1]=4 3380 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [0,0,0,1,0,0|2,0,0]=3 3381 B11R2.1 ClC1CCc2cccnc21 Amb28128210 [0,0,0,1,0,0|3,0,0]=4 3382 B11R2.1 ClC1COc2ccccc21 Amb27233528 [0,0,0,1,0,0|1,0,0]=2 3383 B11R2.1 Clc1coc2ccccc12 Amb21963868 [0,0,0,1,0,0|1,0,2]=4 3384 B11R2.1 Clc1noc2ccccc12 Amb2724801 [0,0,0,1,0,0|2,0,1]=4 3385 B11R2.1 FC1NCc2ccccc21 Amb28197417 [0,0,0,1,0,0|3,0,0]=4 3386 B11R2.1 Fc1noc2ccccc12 Amb35642438 [0,0,0,1,0,0|2,0,1]=4 3387 B11R2.1 IC1CCc2cccnc21 Amb32685580 [0,0,0,1,0,0|3,0,0]=4 3388 B11R2.1 IC1N=Nc2ccccc21 Amb26516914 [0,0,0,1,0,0|3,0,0]=4 3389 B11R2.1 Ic1coc2ccccc12 Amb24622374 [0,0,0,1,0,0|1,0,2]=4 3390 B11R2.1 NC1C=Cc2ccccc21 Amb17470367 [0,0,0,1,0,0|2,0,1]=4 3391 B11R2.1 NC1CCc2ccccc21 Amb1158023 [0,0,0,1,0,0|2,0,0]=3 3392 B11R2.1 NC1CCc2ccccc21 Amb16233857 [0,0,0,1,0,0|2,0,0]=3 3393 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|2,0,0]=3 3394 B11R2.1 NC1CCc2ccccc21 Amb9677422 [0,0,0,1,0,0|2,0,0]=3 3395 B11R2.1 NC1CCc2cccnc21 Amb22436792 [0,0,0,1,0,0|3,0,0]=4 3396 B11R2.1 NC1CCc2ccncc21 Amb24738463 [0,0,0,1,0,0|3,0,0]=4 3397 B11R2.1 NC1CCc2cnccc21 Amb22900659 [0,0,0,1,0,0|3,0,0]=4 3398 B11R2.1 NC1CCc2ncccc21 Amb21858247 [0,0,0,1,0,0|3,0,0]=4 3399 B11R2.1 NC1CCc2ncccc21 Amb22490383 [0,0,0,1,0,0|3,0,0]=4 3400 B11R2.1 NC1COc2ccccc21 Amb13951643 [0,0,0,1,0,0|1,0,0]=2 3401 B11R2.1 NC1COc2ccccc21 Amb2383232 [0,0,0,1,0,0|1,0,0]=2 3402 B11R2.1 NC1COc2cccnc21 Amb27628441 [0,0,0,1,0,0|2,0,0]=3 3403 B11R2.1 NC1COc2ccncc21 Amb27839161 [0,0,0,1,0,0|2,0,0]=3 3404 B11R2.1 NC1COc2cnccc21 Amb27251376 [0,0,0,1,0,0|2,0,0]=3 3405 B11R2.1 NC1COc2ncccc21 Amb25324317 [0,0,0,1,0,0|2,0,0]=3 3406 B11R2.1 NC1CSc2ccccc21 Amb33531788 [0,0,0,1,0,0|1,1,0]=3 3407 B11R2.1 NN1CCc2ccccc21 Amb2691266 [0,0,0,1,0,0|3,0,0]=4 3408 B11R2.1 NN1CCc2ccccc21 Amb836793 [0,0,0,1,0,0|3,0,0]=4 3409 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [0,0,0,1,0,0|2,0,0]=3 3410 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [0,0,0,1,0,0|2,0,0]=3 3411 B11R2.1 N[C@@H]1CCc2cccnc21 Amb22748121 [0,0,0,1,0,0|3,0,0]=4 3412 B11R2.1 N[C@@H]1CCc2cnccc21 Amb26498012 [0,0,0,1,0,0|3,0,0]=4 3413 B11R2.1 N[C@@H]1CCc2ncccc21 Amb27461409 [0,0,0,1,0,0|3,0,0]=4 3414 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|1,0,0]=2 3415 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|1,0,0]=2 3416 B11R2.1 N[C@@H]1COc2ncccc21 Amb28411341 [0,0,0,1,0,0|2,0,0]=3 3417 B11R2.1 N[C@@H]1CSc2ccccc21 Amb27192844 [0,0,0,1,0,0|1,1,0]=3 3418 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|2,0,0]=3 3419 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [0,0,0,1,0,0|2,0,0]=3 3420 B11R2.1 N[C@H]1CCc2cccnc21 Amb26398859 [0,0,0,1,0,0|3,0,0]=4 3421 B11R2.1 N[C@H]1CCc2cccnc21 Amb33872522 [0,0,0,1,0,0|3,0,0]=4 3422 B11R2.1 N[C@H]1CCc2cnccc21 Amb27173220 [0,0,0,1,0,0|3,0,0]=4 3423 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|1,0,0]=2 3424 B11R2.1 N[C@H]1COc2ccccc21 Amb33813746 [0,0,0,1,0,0|1,0,0]=2 3425 B11R2.1 N[C@H]1COc2ccccc21 Amb33872471 [0,0,0,1,0,0|1,0,0]=2 3426 B11R2.1 N[C@H]1CSc2ccccc21 Amb27487071 [0,0,0,1,0,0|1,1,0]=3 3427 B11R2.1 Nc1coc2ccccc12 Amb24371464 [0,0,0,1,0,0|1,0,2]=4 3428 B11R2.1 Nc1noc2ccccc12 Amb1323334 [0,0,0,1,0,0|2,0,1]=4 3429 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [0,0,0,1,0,0|1,0,2]=4 3430 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [0,0,0,1,0,0|1,0,2]=4 3431 B11R2.1 O=C1COc2ccccc21 Amb33534383 [0,0,0,1,0,0|0,0,2]=3 3432 B11R2.1 O=C1COc2cccnc21 Amb22372216 [0,0,0,1,0,0|1,0,2]=4 3433 B11R2.1 O=C1COc2cnccc21 Amb20242099 [0,0,0,1,0,0|1,0,2]=4 3434 B11R2.1 O=C1COc2cnccc21 Amb22728783 [0,0,0,1,0,0|1,0,2]=4 3435 B11R2.1 O=C1COc2ncccc21 Amb20242022 [0,0,0,1,0,0|1,0,2]=4 3436 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [0,0,0,1,0,0|0,1,2]=4 3437 B11R2.1 OB1OCc2ccccc21 Amb1027843 [0,0,0,1,0,0|3,0,0]=4 3438 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,1,0,0|1,0,1]=3 3439 B11R2.1 OC1CCc2ccccc21 Amb9703194 [0,0,0,1,0,0|1,0,0]=2 3440 B11R2.1 OC1CCc2cccnc21 Amb19958431 [0,0,0,1,0,0|2,0,0]=3 3441 B11R2.1 OC1CCc2ncccc21 Amb16231393 [0,0,0,1,0,0|2,0,0]=3 3442 B11R2.1 OC1COc2ccccc21 Amb33548779 [0,0,0,1,0,0|0,0,0]=1 3443 B11R2.1 OC1COc2ccncc21 Amb27598583 [0,0,0,1,0,0|1,0,0]=2 3444 B11R2.1 OC1CSc2ccccc21 Amb27174921 [0,0,0,1,0,0|0,1,0]=2 3445 B11R2.1 OC1N=Cc2ccccc21 Amb27631731 [0,0,0,1,0,0|2,0,0]=3 3446 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,1,0,0|2,0,0]=3 3447 B11R2.1 OC1OCc2ncccc21 Amb27853463 [0,0,0,1,0,0|3,0,0]=4 3448 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [0,0,0,1,0,0|1,0,0]=2 3449 B11R2.1 O[C@@H]1CCc2cnccc21 Amb33715207 [0,0,0,1,0,0|2,0,0]=3 3450 B11R2.1 O[C@@H]1CCc2ncccc21 Amb24511690 [0,0,0,1,0,0|2,0,0]=3 3451 B11R2.1 O[C@@H]1COc2ccccc21 Amb27191568 [0,0,0,1,0,0|0,0,0]=1 3452 B11R2.1 O[C@@H]1CSc2ccccc21 Amb28315859 [0,0,0,1,0,0|0,1,0]=2 3453 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [0,0,0,1,0,0|1,0,0]=2 3454 B11R2.1 O[C@H]1CCc2cccnc21 Amb26350485 [0,0,0,1,0,0|2,0,0]=3 3455 B11R2.1 O[C@H]1CCc2ncccc21 Amb26530510 [0,0,0,1,0,0|2,0,0]=3 3456 B11R2.1 O[C@H]1COc2ccccc21 Amb27946875 [0,0,0,1,0,0|0,0,0]=1 3457 B11R2.1 Oc1coc2ccccc12 Amb24097480 [0,0,0,1,0,0|0,0,2]=3 3458 B11R2.1 Oc1coc2cccnc12 Amb21963453 [0,0,0,1,0,0|1,0,2]=4 3459 B11R2.1 Oc1coc2cccnc12 Amb33996728 [0,0,0,1,0,0|1,0,2]=4 3460 B11R2.1 Oc1csc2ccccc12 Amb4009443 [0,0,0,1,0,0|0,1,2]=4 3461 B11R2.1 Oc1noc2ccccc12 Amb2725155 [0,0,0,1,0,0|1,0,1]=3 3462 B11R2.1 Oc1noc2ccncc12 Amb28458158 [0,0,0,1,0,0|2,0,1]=4 3463 B11R2.1 Oc1noc2cnccc12 Amb10975477 [0,0,0,1,0,0|2,0,1]=4 3464 B11R2.1 Oc1noc2ncccc12 Amb2611982 [0,0,0,1,0,0|2,0,1]=4 3465 B11R2.1 Oc1nsc2ccccc12 Amb22166851 [0,0,0,1,0,0|1,1,1]=4 3466 B11R2.1 On1ccc2ccccc21 Amb27243885 [0,0,0,1,0,0|2,0,1]=4 3467 B11R2.1 On1cnc2ccccc21 Amb28318444 [0,0,0,1,0,0|2,0,1]=4 3468 B11R2.1 On1nnc2ccccc21 Amb1151367 [0,0,0,1,0,0|3,0,0]=4 3469 B11R2.1 On1nnc2ccccc21 Amb2719788 [0,0,0,1,0,0|3,0,0]=4 3470 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [0,0,0,1,0,0|1,1,1]=4 3471 B11R2.1 SC1CCc2ccccc21 Amb9208023 [0,0,0,1,0,0|1,1,0]=3 3472 B11R2.1 SC1CCc2cccnc21 Amb24071779 [0,0,0,1,0,0|2,1,0]=4 3473 B11R2.1 SC1CSc2ccccc21 Amb32788664 [0,0,0,1,0,0|0,2,0]=3 3474 B11R2.1 Sc1coc2ccccc12 Amb24061893 [0,0,0,1,0,0|0,1,2]=4 3475 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,0]=3 3476 B11R2.4 BrC1CC1c2ccncc2 Amb27460923 [0,0,0,1,0,0|3,0,0]=4 3477 B11R2.4 BrC1C[C@H]1c2ccccc2 Amb27392259 [0,0,0,1,0,0|2,0,0]=3 3478 B11R2.4 Br[C@@H]1C[C@@H]1c2ccccc2 Amb28383883 [0,0,0,1,0,0|2,0,0]=3 3479 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,0]=3 3480 B11R2.4 Br[C@@H]1C[C@H]1c2cccnc2 Amb27190974 [0,0,0,1,0,0|3,0,0]=4 3481 B11R2.4 CC1CC1c2ccncc2 Amb2694644 [0,0,0,1,0,0|3,0,0]=4 3482 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|3,0,0]=4 3483 B11R2.4 CN1C[C@@H]1c2ccccc2 Amb33621244 [0,0,0,1,0,0|3,0,0]=4 3484 B11R2.4 CN1C[C@H]1c2ccccc2 Amb33621243 [0,0,0,1,0,0|3,0,0]=4 3485 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|3,0,0]=4 3486 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|3,0,0]=4 3487 B11R2.4 Cl[C@@H]1O[C@H]1c2ccccc2 Amb27845481 [0,0,0,1,0,0|3,0,0]=4 3488 B11R2.4 Cl[C@H]1C[C@@H]1c2ccccc2 Amb28142329 [0,0,0,1,0,0|2,0,0]=3 3489 B11R2.4 Cl[C@H]1O[C@H]1c2ccccc2 Amb27252240 [0,0,0,1,0,0|3,0,0]=4 3490 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|2,0,0]=3 3491 B11R2.4 NC1CC1c2ccccc2 Amb33548983 [0,0,0,1,0,0|2,0,0]=3 3492 B11R2.4 NC1CC1c2ccccc2 Amb9284785 [0,0,0,1,0,0|2,0,0]=3 3493 B11R2.4 NC1CC1c2ccccn2 Amb9677173 [0,0,0,1,0,0|3,0,0]=4 3494 B11R2.4 NC1CC1c2cccnc2 Amb33447000 [0,0,0,1,0,0|3,0,0]=4 3495 B11R2.4 NC1CC1c2cccnc2 Amb9677232 [0,0,0,1,0,0|3,0,0]=4 3496 B11R2.4 NC1CC1c2ccncc2 Amb9677222 [0,0,0,1,0,0|3,0,0]=4 3497 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|3,0,0]=4 3498 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|2,0,0]=3 3499 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|2,0,0]=3 3500 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|2,0,0]=3 3501 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|2,0,0]=3 3502 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb2720223 [0,0,0,1,0,0|2,0,0]=3 3503 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb8387302 [0,0,0,1,0,0|2,0,0]=3 3504 B11R2.4 N[C@@H]1C[C@H]1c2ccccn2 Amb33361299 [0,0,0,1,0,0|3,0,0]=4 3505 B11R2.4 N[C@@H]1C[C@H]1c2cccnc2 Amb26947679 [0,0,0,1,0,0|3,0,0]=4 3506 B11R2.4 N[C@@H]1C[C@H]1c2cccnc2 Amb33473670 [0,0,0,1,0,0|3,0,0]=4 3507 B11R2.4 N[C@@H]1C[C@H]1c2ccncc2 Amb33380669 [0,0,0,1,0,0|3,0,0]=4 3508 B11R2.4 N[C@H]1CC1c2ccccc2 Amb34916480 [0,0,0,1,0,0|2,0,0]=3 3509 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|2,0,0]=3 3510 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb597420 [0,0,0,1,0,0|2,0,0]=3 3511 B11R2.4 N[C@H]1C[C@@H]1c2cccnc2 Amb24604839 [0,0,0,1,0,0|3,0,0]=4 3512 B11R2.4 N[C@H]1C[C@H]1c2ccccc2 Amb33806281 [0,0,0,1,0,0|2,0,0]=3 3513 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|1,0,0]=2 3514 B11R2.4 O[C@@H]1C[C@@H]1c2ccccc2 Amb27486613 [0,0,0,1,0,0|1,0,0]=2 3515 B11R2.4 O[C@H]1C[C@H]1c2ccccc2 Amb27972540 [0,0,0,1,0,0|1,0,0]=2 3516 B11R2.20 C1=CC2=CCCC=C2C=N1 Amb24612787 [0,0,0,1,0,0|3,0,0]=4 3517 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [0,0,0,1,0,0|1,0,2]=4 3518 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [0,0,0,1,0,0|2,0,1]=4 3519 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [0,0,0,1,0,0|2,0,1]=4 3520 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [0,0,0,1,0,0|1,0,1]=3 3521 B11R2.20 C1=Cc2ccccc2SC1 Amb27494059 [0,0,0,1,0,0|1,1,1]=4 3522 B11R2.20 C1=NCCc2ccccc21 Amb10603654 [0,0,0,1,0,0|3,0,0]=4 3523 B11R2.20 C1=NCOc2ccncc21 Amb27945623 [0,0,0,1,0,0|3,0,0]=4 3524 B11R2.20 C1=NCOc2cnccc21 Amb27838869 [0,0,0,1,0,0|3,0,0]=4 3525 B11R2.20 C1=Nc2ccccc2NC1 Amb10174686 [0,0,0,1,0,0|2,0,1]=4 3526 B11R2.20 C1=Nc2ccccc2OC1 Amb28456926 [0,0,0,1,0,0|1,0,1]=3 3527 B11R2.20 C1=Nc2ccccc2SC1 Amb10976509 [0,0,0,1,0,0|1,1,1]=4 3528 B11R2.20 c1cc2c(cn1)CCCC2 Amb5399109 [0,0,0,1,0,0|3,0,0]=4 3529 B11R2.20 c1cc2c(cn1)CCCN2 Amb9174240 [0,0,0,1,0,0|3,0,0]=4 3530 B11R2.20 c1cc2c(cn1)CCCO2 Amb13889664 [0,0,0,1,0,0|2,0,0]=3 3531 B11R2.20 c1cc2c(cn1)NCCC2 Amb21864834 [0,0,0,1,0,0|3,0,0]=4 3532 B11R2.20 c1cc2c(cn1)NCCN2 Amb20622788 [0,0,0,1,0,0|3,0,0]=4 3533 B11R2.20 c1cc2c(cn1)NCCO2 Amb20622566 [0,0,0,1,0,0|2,0,0]=3 3534 B11R2.20 c1cc2c(cn1)NCCO2 Amb28555496 [0,0,0,1,0,0|2,0,0]=3 3535 B11R2.20 c1cc2c(cn1)NCCO2 Amb32661585 [0,0,0,1,0,0|2,0,0]=3 3536 B11R2.20 c1cc2c(cn1)NCCS2 Amb20667582 [0,0,0,1,0,0|2,1,0]=4 3537 B11R2.20 c1cc2c(cn1)OCCC2 Amb27618518 [0,0,0,1,0,0|2,0,0]=3 3538 B11R2.20 c1cc2c(cn1)OCCN2 Amb13890252 [0,0,0,1,0,0|2,0,0]=3 3539 B11R2.20 c1cc2c(cn1)SCCN2 Amb27972680 [0,0,0,1,0,0|2,1,0]=4 3540 B11R2.20 c1cc2c(nn1)NCCO2 Amb27965757 [0,0,0,1,0,0|3,0,0]=4 3541 B11R2.20 c1ccc2c(c1)CCCC2 Amb6608921 [0,0,0,1,0,0|2,0,0]=3 3542 B11R2.20 c1ccc2c(c1)CCCN2 Amb1869492 [0,0,0,1,0,0|2,0,0]=3 3543 B11R2.20 c1ccc2c(c1)CCCO2 Amb9677672 [0,0,0,1,0,0|1,0,0]=2 3544 B11R2.20 c1ccc2c(c1)CCNC2 Amb2383348 [0,0,0,1,0,0|3,0,0]=4 3545 B11R2.20 c1ccc2c(c1)CCNC2 Amb2720224 [0,0,0,1,0,0|3,0,0]=4 3546 B11R2.20 c1ccc2c(c1)CCNS2 Amb27421368 [0,0,0,1,0,0|2,1,0]=4 3547 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [0,0,0,1,0,0|3,0,0]=4 3548 B11R2.20 c1ccc2c(c1)CCSO2 Amb27965466 [0,0,0,1,0,0|2,0,0]=3 3549 B11R2.20 c1ccc2c(c1)CNCN2 Amb25147572 [0,0,0,1,0,0|3,0,0]=4 3550 B11R2.20 c1ccc2c(c1)CSCN2 Amb27412411 [0,0,0,1,0,0|3,0,0]=4 3551 B11R2.20 c1ccc2c(c1)NCCN2 Amb6537963 [0,0,0,1,0,0|2,0,0]=3 3552 B11R2.20 c1ccc2c(c1)NCCO2 Amb2371970 [0,0,0,1,0,0|1,0,0]=2 3553 B11R2.20 c1ccc2c(c1)NCCO2 Amb29844650 [0,0,0,1,0,0|1,0,0]=2 3554 B11R2.20 c1ccc2c(c1)NCCS2 Amb1104964 [0,0,0,1,0,0|1,1,0]=3 3555 B11R2.20 c1ccc2c(c1)OCCO2 Amb2722914 [0,0,0,1,0,0|0,0,0]=1 3556 B11R2.20 c1ccc2c(c1)OCCS2 Amb19374957 [0,0,0,1,0,0|0,1,0]=2 3557 B11R2.20 c1ccc2c(c1)SCCS2 Amb2781726 [0,0,0,1,0,0|0,2,0]=3 3558 B11R2.20 c1cnc2c(c1)CCCC2 Amb2390042 [0,0,0,1,0,0|3,0,0]=4 3559 B11R2.20 c1cnc2c(c1)CCCN2 Amb15692065 [0,0,0,1,0,0|3,0,0]=4 3560 B11R2.20 c1cnc2c(c1)CCCO2 Amb22753924 [0,0,0,1,0,0|2,0,0]=3 3561 B11R2.20 c1cnc2c(c1)CCCS2 Amb27442141 [0,0,0,1,0,0|2,1,0]=4 3562 B11R2.20 c1cnc2c(c1)NCCC2 Amb488375 [0,0,0,1,0,0|3,0,0]=4 3563 B11R2.20 c1cnc2c(c1)NCCN2 Amb10603351 [0,0,0,1,0,0|3,0,0]=4 3564 B11R2.20 c1cnc2c(c1)NCCO2 Amb13890253 [0,0,0,1,0,0|2,0,0]=3 3565 B11R2.20 c1cnc2c(c1)NCCS2 Amb19148121 [0,0,0,1,0,0|2,1,0]=4 3566 B11R2.20 c1cnc2c(c1)OCCC2 Amb13889663 [0,0,0,1,0,0|2,0,0]=3 3567 B11R2.20 c1cnc2c(c1)OCCN2 Amb2724103 [0,0,0,1,0,0|2,0,0]=3 3568 B11R2.20 c1cnc2c(c1)OCCO2 Amb13889670 [0,0,0,1,0,0|1,0,0]=2 3569 B11R2.238 C(=C1CC1)c2ccccc2 Amb19515480 [0,0,0,1,0,0|2,0,1]=4 3570 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [0,0,0,1,0,0|2,0,1]=4 3571 B11R2.238 c1cc(CC2CC2)ccn1 Amb28050219 [0,0,0,1,0,0|3,0,0]=4 3572 B11R2.238 c1cc(CC2CO2)ccn1 Amb24677560 [0,0,0,1,0,0|2,0,0]=3 3573 B11R2.238 c1cc(CC2CO2)ncn1 Amb33268585 [0,0,0,1,0,0|3,0,0]=4 3574 B11R2.238 c1cc(NC2CC2)ccn1 Amb6625922 [0,0,0,1,0,0|3,0,0]=4 3575 B11R2.238 c1ccc(CC2CC2)cc1 Amb22490220 [0,0,0,1,0,0|2,0,0]=3 3576 B11R2.238 c1ccc(CC2CO2)cc1 Amb3940775 [0,0,0,1,0,0|1,0,0]=2 3577 B11R2.238 c1ccc(CC2CO2)nc1 Amb24649901 [0,0,0,1,0,0|2,0,0]=3 3578 B11R2.238 c1ccc(C[C@@H]2CO2)cc1 Amb25916397 [0,0,0,1,0,0|1,0,0]=2 3579 B11R2.238 c1ccc(C[C@H]2CN2)cc1 Amb15690958 [0,0,0,1,0,0|2,0,0]=3 3580 B11R2.238 c1ccc(C[C@H]2CO2)cc1 Amb27150158 [0,0,0,1,0,0|1,0,0]=2 3581 B11R2.238 c1ccc(NC2CC2)cc1 Amb18270529 [0,0,0,1,0,0|2,0,0]=3 3582 B11R2.238 c1ccc(NC2CC2)cc1 Amb32663098 [0,0,0,1,0,0|2,0,0]=3 3583 B11R2.238 c1ccc(OC2CC2)nc1 Amb25697005 [0,0,0,1,0,0|2,0,0]=3 3584 B11R2.238 c1ccc(SC2CC2)cc1 Amb8514420 [0,0,0,1,0,0|1,1,0]=3 3585 B11R2.238 c1cnc(CC2CO2)cn1 Amb28240224 [0,0,0,1,0,0|3,0,0]=4 3586 B11R2.238 c1cnc(CC2CO2)nc1 Amb33270384 [0,0,0,1,0,0|3,0,0]=4 3587 B11R2.238 c1cncc(CC2CO2)c1 Amb28397057 [0,0,0,1,0,0|2,0,0]=3 3588 B11R2.238 c1cncc(NC2CC2)c1 Amb18270523 [0,0,0,1,0,0|3,0,0]=4 3589 B11R2.238 c1cncc(OC2CC2)c1 Amb28119516 [0,0,0,1,0,0|2,0,0]=3 3590 B11R2.238 c1ncc(CC2CO2)cn1 Amb24426064 [0,0,0,1,0,0|3,0,0]=4 3591 B11R2.239 C1=C(c2cccnc2)CC1 Amb32668896 [0,0,0,1,0,0|3,0,0]=4 3592 B11R2.239 c1cc(C2CCC2)ccn1 Amb22898826 [0,0,0,1,0,0|3,0,0]=4 3593 B11R2.239 c1cc(C2CCN2)ccn1 Amb26960403 [0,0,0,1,0,0|3,0,0]=4 3594 B11R2.239 c1ccc(C2CCC2)cc1 Amb27466141 [0,0,0,1,0,0|2,0,0]=3 3595 B11R2.239 c1ccc(C2CCC2)nc1 Amb27796341 [0,0,0,1,0,0|3,0,0]=4 3596 B11R2.239 c1ccc(C2CCN2)cc1 Amb34912959 [0,0,0,1,0,0|2,0,0]=3 3597 B11R2.239 c1ccc(C2CCN2)cc1 Amb6893889 [0,0,0,1,0,0|2,0,0]=3 3598 B11R2.239 c1ccc(C2CCN2)nc1 Amb25849292 [0,0,0,1,0,0|3,0,0]=4 3599 B11R2.239 c1ccc(C2CCS2)cc1 Amb27839415 [0,0,0,1,0,0|1,1,0]=3 3600 B11R2.239 c1ccc(C2CNC2)cc1 Amb10603719 [0,0,0,1,0,0|3,0,0]=4 3601 B11R2.239 c1ccc(C2CNC2)cc1 Amb4124710 [0,0,0,1,0,0|3,0,0]=4 3602 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [0,0,0,1,0,0|1,0,0]=2 3603 B11R2.239 c1ccc([C@H]2CCN2)cc1 Amb27874787 [0,0,0,1,0,0|2,0,0]=3 3604 B11R2.239 c1cncc(C2CCN2)c1 Amb8010869 [0,0,0,1,0,0|3,0,0]=4 3605 B11R2.239 c1cncc([C@H]2CCN2)c1 Amb27241453 [0,0,0,1,0,0|3,0,0]=4 3606 B11R2.988 C=CC1Cc2ccccc21 Amb17778869 [0,0,0,1,0,0|2,0,1]=4 3607 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [0,0,0,1,0,0|2,0,1]=4 3608 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|2,0,0]=3 3609 B11R2.988 CNC1Cc2ccccc21 Amb28315966 [0,0,0,1,0,0|3,0,0]=4 3610 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|3,0,0]=4 3611 B11R2.988 N#CC1Cc2ccccc21 Amb2778424 [0,0,0,1,0,0|2,0,1]=4 3612 B11R2.988 NCC1Cc2ccccc21 Amb10609227 [0,0,0,1,0,0|2,0,0]=3 3613 B11R2.988 O=CC1Cc2ccccc21 Amb16230472 [0,0,0,1,0,0|1,0,2]=4 3614 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [0,0,0,1,0,0|1,0,0]=2 3615 B11R2.988 O\N=C1/Cc2ccccc21 Amb3862130 [0,0,0,1,0,0|2,0,1]=4 3616 B11R2.988 SCC1Cc2ccccc21 Amb27866792 [0,0,0,1,0,0|1,1,0]=3 3617 B9R1.12 BrCCCc1ccco1 Amb17104550 [0,0,0,0,1,0|3,0,0]=4 3618 B9R1.12 BrCCCc1cccs1 Amb17104551 [0,0,0,0,1,0|3,0,0]=4 3619 B9R1.12 BrCCCc1ccoc1 Amb24593084 [0,0,0,0,1,0|3,0,0]=4 3620 B9R1.12 BrCCCc1ccsc1 Amb27837473 [0,0,0,0,1,0|3,0,0]=4 3621 B9R1.12 BrCCCn1cccc1 Amb10608810 [0,0,0,0,1,0|3,0,0]=4 3622 B9R1.12 BrCCSc1ccco1 Amb27817680 [0,0,0,0,1,0|2,1,0]=4 3623 B9R1.12 BrCCSc1cccs1 Amb6717251 [0,0,0,0,1,0|2,1,0]=4 3624 B9R1.12 C#CCOc1ccco1 Amb27239981 [0,0,0,0,1,0|2,0,1]=4 3625 B9R1.12 C#CCOn1cccc1 Amb27449049 [0,0,0,0,1,0|2,0,1]=4 3626 B9R1.12 CCCCc1ccco1 Amb10070290 [0,0,0,0,1,0|3,0,0]=4 3627 B9R1.12 CCCCc1cccs1 Amb4477470 [0,0,0,0,1,0|3,0,0]=4 3628 B9R1.12 CCCCc1ccsc1 Amb17779303 [0,0,0,0,1,0|3,0,0]=4 3629 B9R1.12 CCCNn1cccc1 Amb28401503 [0,0,0,0,1,0|3,0,0]=4 3630 B9R1.12 CCCOc1cccs1 Amb27167856 [0,0,0,0,1,0|2,0,0]=3 3631 B9R1.12 ClCCCc1ccco1 Amb8860563 [0,0,0,0,1,0|3,0,0]=4 3632 B9R1.12 ClCCCc1cccs1 Amb17104524 [0,0,0,0,1,0|3,0,0]=4 3633 B9R1.12 ClCCCc1ccoc1 Amb25720433 [0,0,0,0,1,0|3,0,0]=4 3634 B9R1.12 ClCCCc1ccsc1 Amb18797934 [0,0,0,0,1,0|3,0,0]=4 3635 B9R1.12 ClCCCn1cccc1 Amb21912596 [0,0,0,0,1,0|3,0,0]=4 3636 B9R1.12 ClCCOc1ccsc1 Amb27593871 [0,0,0,0,1,0|2,0,0]=3 3637 B9R1.12 FCCCn1cccc1 Amb24659970 [0,0,0,0,1,0|3,0,0]=4 3638 B9R1.12 FCCNn1cccc1 Amb27838516 [0,0,0,0,1,0|3,0,0]=4 3639 B9R1.12 FCCSc1cccs1 Amb27218429 [0,0,0,0,1,0|2,1,0]=4 3640 B9R1.12 ICCCc1cccs1 Amb27207015 [0,0,0,0,1,0|3,0,0]=4 3641 B9R1.12 ICCCn1cccc1 Amb28041769 [0,0,0,0,1,0|3,0,0]=4 3642 B9R1.12 NCCCc1ccco1 Amb534785 [0,0,0,0,1,0|3,0,0]=4 3643 B9R1.12 NCCCc1cccs1 Amb33529119 [0,0,0,0,1,0|3,0,0]=4 3644 B9R1.12 NCCCc1ccoc1 Amb25789662 [0,0,0,0,1,0|3,0,0]=4 3645 B9R1.12 NCCCc1ccsc1 Amb19373237 [0,0,0,0,1,0|3,0,0]=4 3646 B9R1.12 NCCCc1ccsc1 Amb9511216 [0,0,0,0,1,0|3,0,0]=4 3647 B9R1.12 NCCCn1cccc1 Amb5744329 [0,0,0,0,1,0|3,0,0]=4 3648 B9R1.12 NCCOc1ccco1 Amb33360919 [0,0,0,0,1,0|2,0,0]=3 3649 B9R1.12 NCCOc1cccs1 Amb26516140 [0,0,0,0,1,0|2,0,0]=3 3650 B9R1.12 NCCOc1ccoc1 Amb33360341 [0,0,0,0,1,0|2,0,0]=3 3651 B9R1.12 NCCOc1ccon1 Amb25177581 [0,0,0,0,1,0|3,0,0]=4 3652 B9R1.12 NCCOc1ccsc1 Amb33428875 [0,0,0,0,1,0|2,0,0]=3 3653 B9R1.12 NCCOc1cnco1 Amb33319567 [0,0,0,0,1,0|3,0,0]=4 3654 B9R1.12 NCCOc1cncs1 Amb33268053 [0,0,0,0,1,0|3,0,0]=4 3655 B9R1.12 NCCOc1cscn1 Amb33417307 [0,0,0,0,1,0|3,0,0]=4 3656 B9R1.12 NCCOc1nccs1 Amb18523783 [0,0,0,0,1,0|3,0,0]=4 3657 B9R1.12 NCCSc1ccco1 Amb28326221 [0,0,0,0,1,0|2,1,0]=4 3658 B9R1.12 NCCSc1cccs1 Amb6717253 [0,0,0,0,1,0|2,1,0]=4 3659 B9R1.12 O=CCOc1ccsc1 Amb27191888 [0,0,0,0,1,0|1,0,2]=4 3660 B9R1.12 OCC#Cc1ccco1 Amb28049071 [0,0,0,0,1,0|2,0,1]=4 3661 B9R1.12 OCC#Cc1ccoc1 Amb28126047 [0,0,0,0,1,0|2,0,1]=4 3662 B9R1.12 OCC#Cc1ccsc1 Amb24709250 [0,0,0,0,1,0|2,0,1]=4 3663 B9R1.12 OCCCc1ccco1 Amb8860560 [0,0,0,0,1,0|2,0,0]=3 3664 B9R1.12 OCCCc1cccs1 Amb17089493 [0,0,0,0,1,0|2,0,0]=3 3665 B9R1.12 OCCCc1ccns1 Amb27787342 [0,0,0,0,1,0|3,0,0]=4 3666 B9R1.12 OCCCc1ccoc1 Amb26505336 [0,0,0,0,1,0|2,0,0]=3 3667 B9R1.12 OCCCc1ccon1 Amb28399013 [0,0,0,0,1,0|3,0,0]=4 3668 B9R1.12 OCCCc1ccsc1 Amb17605794 [0,0,0,0,1,0|2,0,0]=3 3669 B9R1.12 OCCCc1cnco1 Amb27833401 [0,0,0,0,1,0|3,0,0]=4 3670 B9R1.12 OCCCc1cncs1 Amb26017292 [0,0,0,0,1,0|3,0,0]=4 3671 B9R1.12 OCCCc1cnoc1 Amb3941163 [0,0,0,0,1,0|3,0,0]=4 3672 B9R1.12 OCCCc1cnsc1 Amb30017333 [0,0,0,0,1,0|3,0,0]=4 3673 B9R1.12 OCCCc1cocn1 Amb27762837 [0,0,0,0,1,0|3,0,0]=4 3674 B9R1.12 OCCCc1cscn1 Amb24099813 [0,0,0,0,1,0|3,0,0]=4 3675 B9R1.12 OCCCc1nccs1 Amb25887194 [0,0,0,0,1,0|3,0,0]=4 3676 B9R1.12 OCCCn1cccc1 Amb17593298 [0,0,0,0,1,0|2,0,0]=3 3677 B9R1.12 OCCCn1cccn1 Amb33531607 [0,0,0,0,1,0|3,0,0]=4 3678 B9R1.12 OCCCn1ccnc1 Amb11012596 [0,0,0,0,1,0|3,0,0]=4 3679 B9R1.12 OCCCn1ccnc1 Amb33531544 [0,0,0,0,1,0|3,0,0]=4 3680 B9R1.12 OCCNc1ccco1 Amb27246618 [0,0,0,0,1,0|2,0,0]=3 3681 B9R1.12 OCCNc1cccs1 Amb27174142 [0,0,0,0,1,0|2,0,0]=3 3682 B9R1.12 OCCNc1nccs1 Amb6649646 [0,0,0,0,1,0|3,0,0]=4 3683 B9R1.12 OCCSc1ccco1 Amb27200113 [0,0,0,0,1,0|1,1,0]=3 3684 B9R1.12 OCCSc1ccsc1 Amb27958951 [0,0,0,0,1,0|1,1,0]=3 3685 B9R1.12 OCCSc1ncco1 Amb28139850 [0,0,0,0,1,0|2,1,0]=4 3686 B9R1.12 OC\C=C\c1ccco1 Amb837544 [0,0,0,0,1,0|2,0,1]=4 3687 B9R1.12 OC\C=C\c1cccs1 Amb23555588 [0,0,0,0,1,0|2,0,1]=4 3688 B9R1.12 OC\C=C\c1ccoc1 Amb33136449 [0,0,0,0,1,0|2,0,1]=4 3689 B9R1.12 OC\C=C\c1ccsc1 Amb33136405 [0,0,0,0,1,0|2,0,1]=4 3690 B9R1.12 OC\C=C\n1cccc1 Amb28049227 [0,0,0,0,1,0|2,0,1]=4 3691 B9R1.12 SCCCc1ccco1 Amb17399874 [0,0,0,0,1,0|2,1,0]=4 3692 B9R1.12 SCCCc1cccs1 Amb17400036 [0,0,0,0,1,0|2,1,0]=4 3693 B9R1.12 SCCCc1ccoc1 Amb33360329 [0,0,0,0,1,0|2,1,0]=4 3694 B9R1.12 SCCCc1ccsc1 Amb25180709 [0,0,0,0,1,0|2,1,0]=4 3695 B11R1.203 BrCCOC1C=CC=CC=C1 Amb28143705 [0,0,0,0,0,1|1,0,1]=3 3696 B8R0.1 C=CCC(=C)CCCO Amb27213958 [1,0,1,0,0,0|1,0,1]=4 3697 B8R0.1 C=CCCC(=C)CCO Amb27218611 [1,0,1,0,0,0|0,0,2]=4 3698 B8R0.1 C=CC\C=C(\C)CCO Amb27651848 [1,0,1,0,0,0|0,0,2]=4 3699 B8R0.1 C=C\C=C\C(=C)CC=O Amb26851275 [1,0,1,0,0,0|0,0,2]=4 3700 B8R0.1 C=C\C=C\C(=O)OCC Amb10552844 [1,0,1,0,0,0|1,0,0]=3 3701 B8R0.1 CCOC(=O)\C=C\C=O Amb18642570 [1,0,1,0,0,0|2,0,0]=4 3702 B8R0.1 C\C(=C/C=C/Cl)CCO Amb27233484 [1,0,1,0,0,0|1,0,1]=4 3703 B8R0.1 O=C\C=C/C(=O)CCO Amb27643576 [1,0,1,0,0,0|2,0,0]=4 3704 B8R0.4 C#C\C=C\C=C\CCO Amb28315560 [1,0,1,0,0,0|0,0,2]=4 3705 B8R0.4 C=C\C=C\C=C\CCC Amb22641675 [1,0,1,0,0,0|1,0,0]=3 3706 B8R0.4 CCC\C=C/C=C/C=O Amb27643510 [1,0,1,0,0,0|2,0,0]=4 3707 B8R0.4 CCC\C=C\C=C\C=O Amb8392848 [1,0,1,0,0,0|2,0,0]=4 3708 B8R0.4 CO\C=C\C=C\CCO Amb27660890 [1,0,1,0,0,0|1,0,1]=4 3709 B8R0.4 C\C=C\C=C=CCCO Amb27812339 [1,0,1,0,0,0|0,0,2]=4 3710 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [1,0,1,0,0,0|0,0,2]=4 3711 B8R0.4 C\C=C\C\C=C\CCO Amb27978414 [1,0,1,0,0,0|0,0,2]=4 3712 B8R0.4 OC\C=C\C=C\C=C\Cl Amb27878783 [1,0,1,0,0,0|1,0,1]=4 3713 B8R0.11 C=CB(C=C)OCCN Amb28203993 [1,0,1,0,0,0|2,0,0]=4 3714 B8R0.11 C=CC(C=C)=CCCO Amb27394777 [1,0,1,0,0,0|1,0,0]=3 3715 B8R0.22 C=CCC(C=C)CCO Amb27662197 [1,0,1,0,0,0|0,0,2]=4 3716 B8R1.2 BrCc1ccccc1 Amb3939707 [2,0,0,0,0,0|1,0,0]=3 3717 B8R1.2 BrCc1ccccn1 Amb3939990 [2,0,0,0,0,0|2,0,0]=4 3718 B8R1.2 BrCc1ccccn1 Amb8393294 [2,0,0,0,0,0|2,0,0]=4 3719 B8R1.2 BrCc1cccnc1 Amb3939989 [2,0,0,0,0,0|2,0,0]=4 3720 B8R1.2 BrCc1cccnc1 Amb9826052 [2,0,0,0,0,0|2,0,0]=4 3721 B8R1.2 BrCc1ccncc1 Amb3939991 [2,0,0,0,0,0|2,0,0]=4 3722 B8R1.2 BrCc1ccncc1 Amb9826062 [2,0,0,0,0,0|2,0,0]=4 3723 B8R1.2 Br[Se]c1ccccc1 Amb8514629 [2,0,0,0,0,0|1,1,0]=4 3724 B8R1.2 C#Cc1ccccc1 Amb2793084 [2,0,0,0,0,0|0,0,2]=4 3725 B8R1.2 C=Cc1ccccc1 Amb6608811 [2,0,0,0,0,0|0,0,2]=4 3726 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,1]=4 3727 B8R1.2 CCC1=CC=CNC1 Amb27643536 [2,0,0,0,0,0|1,0,1]=4 3728 B8R1.2 CC[n+]1ccccc1 Amb8516219 [2,0,0,0,0,0|1,0,0]=3 3729 B8R1.2 CC[n+]1ccccc1 Amb8516636 [2,0,0,0,0,0|1,0,0]=3 3730 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,0]=2 3731 B8R1.2 CCc1ccccn1 Amb6608978 [2,0,0,0,0,0|1,0,0]=3 3732 B8R1.2 CCc1cccnc1 Amb4037096 [2,0,0,0,0,0|1,0,0]=3 3733 B8R1.2 CCc1cccnn1 Amb28290156 [2,0,0,0,0,0|2,0,0]=4 3734 B8R1.2 CCc1ccncc1 Amb8513449 [2,0,0,0,0,0|1,0,0]=3 3735 B8R1.2 CCc1ccncn1 Amb20242304 [2,0,0,0,0,0|2,0,0]=4 3736 B8R1.2 CCc1cnccn1 Amb6374282 [2,0,0,0,0,0|2,0,0]=4 3737 B8R1.2 CCc1cncnc1 Amb24097063 [2,0,0,0,0,0|2,0,0]=4 3738 B8R1.2 CCc1ncccn1 Amb33544267 [2,0,0,0,0,0|2,0,0]=4 3739 B8R1.2 CNc1ccccc1 Amb2721038 [2,0,0,0,0,0|1,0,0]=3 3740 B8R1.2 CNc1ccccc1 Amb4037054 [2,0,0,0,0,0|1,0,0]=3 3741 B8R1.2 CNc1ccccn1 Amb3429849 [2,0,0,0,0,0|2,0,0]=4 3742 B8R1.2 CNc1cccnc1 Amb8396762 [2,0,0,0,0,0|2,0,0]=4 3743 B8R1.2 CNc1ccncc1 Amb2610661 [2,0,0,0,0,0|2,0,0]=4 3744 B8R1.2 COC1=CCC=CC1 Amb10842162 [2,0,0,0,0,0|0,0,2]=4 3745 B8R1.2 COc1ccccc1 Amb2842269 [2,0,0,0,0,0|0,0,0]=2 3746 B8R1.2 COc1ccccn1 Amb4037280 [2,0,0,0,0,0|1,0,0]=3 3747 B8R1.2 COc1cccnc1 Amb8517634 [2,0,0,0,0,0|1,0,0]=3 3748 B8R1.2 COc1cccnn1 Amb5751228 [2,0,0,0,0,0|2,0,0]=4 3749 B8R1.2 COc1ccncc1 Amb2609546 [2,0,0,0,0,0|1,0,0]=3 3750 B8R1.2 COc1ccncc1 Amb28991347 [2,0,0,0,0,0|1,0,0]=3 3751 B8R1.2 COc1ccncn1 Amb15692928 [2,0,0,0,0,0|2,0,0]=4 3752 B8R1.2 COc1ccnnc1 Amb21857844 [2,0,0,0,0,0|2,0,0]=4 3753 B8R1.2 COc1cnccn1 Amb2689275 [2,0,0,0,0,0|2,0,0]=4 3754 B8R1.2 COc1cncnc1 Amb8439425 [2,0,0,0,0,0|2,0,0]=4 3755 B8R1.2 COc1ncccn1 Amb2609513 [2,0,0,0,0,0|2,0,0]=4 3756 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,0]=3 3757 B8R1.2 CSc1ccccc1 Amb2690593 [2,0,0,0,0,0|0,1,0]=3 3758 B8R1.2 CSc1ccccn1 Amb8392843 [2,0,0,0,0,0|1,1,0]=4 3759 B8R1.2 CSc1cccnc1 Amb24087396 [2,0,0,0,0,0|1,1,0]=4 3760 B8R1.2 CSc1ccncc1 Amb24103013 [2,0,0,0,0,0|1,1,0]=4 3761 B8R1.2 ClCc1cc[nH+]cc1 Amb4258486 [2,0,0,0,0,0|2,0,0]=4 3762 B8R1.2 ClCc1ccccc1 Amb2792911 [2,0,0,0,0,0|1,0,0]=3 3763 B8R1.2 ClCc1ccccn1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 3764 B8R1.2 ClCc1ccccn1 Amb534985 [2,0,0,0,0,0|2,0,0]=4 3765 B8R1.2 ClCc1ccccn1 Amb6296082 [2,0,0,0,0,0|2,0,0]=4 3766 B8R1.2 ClCc1cccnc1 Amb2725600 [2,0,0,0,0,0|2,0,0]=4 3767 B8R1.2 ClCc1cccnc1 Amb534994 [2,0,0,0,0,0|2,0,0]=4 3768 B8R1.2 ClCc1ccncc1 Amb2715054 [2,0,0,0,0,0|2,0,0]=4 3769 B8R1.2 Cl[Se]c1ccccc1 Amb8513798 [2,0,0,0,0,0|1,1,0]=4 3770 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 3771 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 3772 B8R1.2 FCc1cccnc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 3773 B8R1.2 FCc1ccncc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 3774 B8R1.2 ICc1ccccc1 Amb4006861 [2,0,0,0,0,0|1,0,0]=3 3775 B8R1.2 ICc1ccccn1 Amb26963503 [2,0,0,0,0,0|2,0,0]=4 3776 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 3777 B8R1.2 ICc1cccnc1 Amb33527054 [2,0,0,0,0,0|2,0,0]=4 3778 B8R1.2 ICc1ccncc1 Amb33552994 [2,0,0,0,0,0|2,0,0]=4 3779 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|1,1,0]=4 3780 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 3781 B8R1.2 N#Cc1ccccc1 Amb2793082 [2,0,0,0,0,0|1,0,1]=4 3782 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|2,0,0]=4 3783 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 3784 B8R1.2 NCc1ccccc1 Amb2725314 [2,0,0,0,0,0|1,0,0]=3 3785 B8R1.2 NCc1ccccc1 Amb2792834 [2,0,0,0,0,0|1,0,0]=3 3786 B8R1.2 NCc1ccccc1 Amb6383294 [2,0,0,0,0,0|1,0,0]=3 3787 B8R1.2 NCc1ccccn1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 3788 B8R1.2 NCc1ccccn1 Amb2684477 [2,0,0,0,0,0|2,0,0]=4 3789 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 3790 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 3791 B8R1.2 NCc1cccnc1 Amb6383332 [2,0,0,0,0,0|2,0,0]=4 3792 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 3793 B8R1.2 NCc1ccncc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 3794 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|2,0,0]=4 3795 B8R1.2 NNc1ccccc1 Amb2793062 [2,0,0,0,0,0|2,0,0]=4 3796 B8R1.2 NNc1ccccc1 Amb8513467 [2,0,0,0,0,0|2,0,0]=4 3797 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|1,0,0]=3 3798 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|1,0,0]=3 3799 B8R1.2 NOc1ccccn1 Amb24101187 [2,0,0,0,0,0|2,0,0]=4 3800 B8R1.2 NOc1cccnc1 Amb27603515 [2,0,0,0,0,0|2,0,0]=4 3801 B8R1.2 NOc1ccncc1 Amb8386473 [2,0,0,0,0,0|2,0,0]=4 3802 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,1]=4 3803 B8R1.2 O=Cc1ccccc1 Amb2792754 [2,0,0,0,0,0|0,0,2]=4 3804 B8R1.2 O=Nc1ccccc1 Amb9785158 [2,0,0,0,0,0|1,0,1]=4 3805 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,1]=4 3806 B8R1.2 OCc1ccccc1 Amb3939216 [2,0,0,0,0,0|0,0,0]=2 3807 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|1,0,0]=3 3808 B8R1.2 OCc1ccccn1 Amb2610526 [2,0,0,0,0,0|1,0,0]=3 3809 B8R1.2 OCc1cccnc1 Amb2720347 [2,0,0,0,0,0|1,0,0]=3 3810 B8R1.2 OCc1cccnn1 Amb5282882 [2,0,0,0,0,0|2,0,0]=4 3811 B8R1.2 OCc1ccncc1 Amb24183964 [2,0,0,0,0,0|1,0,0]=3 3812 B8R1.2 OCc1ccncc1 Amb2720348 [2,0,0,0,0,0|1,0,0]=3 3813 B8R1.2 OCc1ccncn1 Amb7101500 [2,0,0,0,0,0|2,0,0]=4 3814 B8R1.2 OCc1ccnnc1 Amb21856410 [2,0,0,0,0,0|2,0,0]=4 3815 B8R1.2 OCc1cnccn1 Amb2723066 [2,0,0,0,0,0|2,0,0]=4 3816 B8R1.2 OCc1cncnc1 Amb8397262 [2,0,0,0,0,0|2,0,0]=4 3817 B8R1.2 OCc1ncccn1 Amb33531368 [2,0,0,0,0,0|2,0,0]=4 3818 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 3819 B8R1.2 ONc1ccncc1 Amb27829868 [2,0,0,0,0,0|2,0,0]=4 3820 B8R1.2 SCc1ccccc1 Amb6608752 [2,0,0,0,0,0|0,1,0]=3 3821 B8R1.2 SCc1ccccn1 Amb33542790 [2,0,0,0,0,0|1,1,0]=4 3822 B8R1.2 SCc1cccnc1 Amb21984718 [2,0,0,0,0,0|1,1,0]=4 3823 B8R1.2 SCc1ccncc1 Amb22008603 [2,0,0,0,0,0|1,1,0]=4 3824 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 3825 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 3826 B8R1.2 [NH3+]Cc1ccccc1 Amb8488224 [2,0,0,0,0,0|1,0,0]=3 3827 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 3828 B10R0.91 C\C=C\C=C\C(=O)NCCO Amb27269140 [0,1,1,0,0,0|2,0,0]=4 3829 B10R0.71 C=C\C=C/C=C/CCCCC Amb22546765 [0,1,1,0,0,0|2,0,0]=4 3830 B10R1.1 BrCCc1ccc(Br)cc1 Amb6296138 [1,1,0,0,0,0|1,0,0]=3 3831 B10R1.1 BrCCc1ccc(Br)cn1 Amb25187280 [1,1,0,0,0,0|2,0,0]=4 3832 B10R1.1 BrCCc1ccc(Br)nc1 Amb25941323 [1,1,0,0,0,0|2,0,0]=4 3833 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 3834 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,0]=3 3835 B10R1.1 C#CCc1ccc(Br)cc1 Amb26366342 [1,1,0,0,0,0|1,0,1]=4 3836 B10R1.1 C#CCc1ccc(C)cc1 Amb33359821 [1,1,0,0,0,0|1,0,1]=4 3837 B10R1.1 C#CCc1ccc(Cl)cc1 Amb26067166 [1,1,0,0,0,0|1,0,1]=4 3838 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|1,0,1]=4 3839 B10R1.1 C#CCc1ccc(I)cc1 Amb25921305 [1,1,0,0,0,0|1,0,1]=4 3840 B10R1.1 C#CCc1ccc(N)cc1 Amb26455672 [1,1,0,0,0,0|1,0,1]=4 3841 B10R1.1 C#CCc1ccc(O)cc1 Amb33079384 [1,1,0,0,0,0|1,0,1]=4 3842 B10R1.1 C#NCc1ccc(Br)cc1 Amb31112143 [1,1,0,0,0,0|2,0,0]=4 3843 B10R1.1 C#NCc1ccc(C)cc1 Amb31132460 [1,1,0,0,0,0|2,0,0]=4 3844 B10R1.1 C#NCc1ccc(Cl)cc1 Amb31111984 [1,1,0,0,0,0|2,0,0]=4 3845 B10R1.1 C#NCc1ccc(F)cc1 Amb31132462 [1,1,0,0,0,0|2,0,0]=4 3846 B10R1.1 C=CCc1ccc(Br)cc1 Amb6298955 [1,1,0,0,0,0|1,0,1]=4 3847 B10R1.1 C=CCc1ccc(C)cc1 Amb6298999 [1,1,0,0,0,0|1,0,1]=4 3848 B10R1.1 C=CCc1ccc(Cl)cc1 Amb6298977 [1,1,0,0,0,0|1,0,1]=4 3849 B10R1.1 C=CCc1ccc(F)cc1 Amb6299104 [1,1,0,0,0,0|1,0,1]=4 3850 B10R1.1 C=CCc1ccc(N)cc1 Amb27168671 [1,1,0,0,0,0|1,0,1]=4 3851 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|1,0,1]=4 3852 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|0,0,2]=4 3853 B10R1.1 C=COc1ccc(C)cc1 Amb17674188 [1,1,0,0,0,0|0,0,2]=4 3854 B10R1.1 C=COc1ccc(Cl)cc1 Amb28422277 [1,1,0,0,0,0|0,0,2]=4 3855 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|0,0,2]=4 3856 B10R1.1 C=COc1ccc(N)cc1 Amb2721808 [1,1,0,0,0,0|0,0,2]=4 3857 B10R1.1 CC#Cc1ccc(Br)cc1 Amb24524445 [1,1,0,0,0,0|1,0,1]=4 3858 B10R1.1 CC#Cc1ccc(Cl)cc1 Amb27199822 [1,1,0,0,0,0|1,0,1]=4 3859 B10R1.1 CCC[n+]1ccc(C)cc1 Amb28046442 [1,1,0,0,0,0|2,0,0]=4 3860 B10R1.1 CCCc1ccc(Br)cc1 Amb3939169 [1,1,0,0,0,0|1,0,0]=3 3861 B10R1.1 CCCc1ccc(Br)cn1 Amb24321438 [1,1,0,0,0,0|2,0,0]=4 3862 B10R1.1 CCCc1ccc(Br)nc1 Amb10600786 [1,1,0,0,0,0|2,0,0]=4 3863 B10R1.1 CCCc1ccc(C)cc1 Amb22227992 [1,1,0,0,0,0|1,0,0]=3 3864 B10R1.1 CCCc1ccc(C)cn1 Amb25985406 [1,1,0,0,0,0|2,0,0]=4 3865 B10R1.1 CCCc1ccc(F)cc1 Amb10845722 [1,1,0,0,0,0|1,0,0]=3 3866 B10R1.1 CCCc1ccc(I)cc1 Amb8976891 [1,1,0,0,0,0|1,0,0]=3 3867 B10R1.1 CCCc1ccc(N)cc1 Amb2721145 [1,1,0,0,0,0|1,0,0]=3 3868 B10R1.1 CCCc1ccc(N)cn1 Amb10600808 [1,1,0,0,0,0|2,0,0]=4 3869 B10R1.1 CCCc1ccc(N)nc1 Amb10600788 [1,1,0,0,0,0|2,0,0]=4 3870 B10R1.1 CCCc1ccc(O)cc1 Amb3939332 [1,1,0,0,0,0|1,0,0]=3 3871 B10R1.1 CCCc1ccc(O)cn1 Amb10553035 [1,1,0,0,0,0|2,0,0]=4 3872 B10R1.1 CCCc1ccc(O)nc1 Amb10600789 [1,1,0,0,0,0|2,0,0]=4 3873 B10R1.1 CCCc1ccc(S)cc1 Amb2690418 [1,1,0,0,0,0|1,0,0]=3 3874 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [1,1,0,0,0,0|1,0,0]=3 3875 B10R1.1 CCNc1ccc(Br)cc1 Amb4313300 [1,1,0,0,0,0|1,0,0]=3 3876 B10R1.1 CCNc1ccc(Br)cn1 Amb6624559 [1,1,0,0,0,0|2,0,0]=4 3877 B10R1.1 CCNc1ccc(Br)nc1 Amb27648588 [1,1,0,0,0,0|2,0,0]=4 3878 B10R1.1 CCNc1ccc(C)cc1 Amb4313293 [1,1,0,0,0,0|1,0,0]=3 3879 B10R1.1 CCNc1ccc(C)cn1 Amb6640922 [1,1,0,0,0,0|2,0,0]=4 3880 B10R1.1 CCNc1ccc(C)nc1 Amb28322511 [1,1,0,0,0,0|2,0,0]=4 3881 B10R1.1 CCNc1ccc(Cl)cc1 Amb32752525 [1,1,0,0,0,0|1,0,0]=3 3882 B10R1.1 CCNc1ccc(Cl)cc1 Amb4018546 [1,1,0,0,0,0|1,0,0]=3 3883 B10R1.1 CCNc1ccc(Cl)cn1 Amb6622107 [1,1,0,0,0,0|2,0,0]=4 3884 B10R1.1 CCNc1ccc(Cl)nc1 Amb24672881 [1,1,0,0,0,0|2,0,0]=4 3885 B10R1.1 CCNc1ccc(F)cc1 Amb1214999 [1,1,0,0,0,0|1,0,0]=3 3886 B10R1.1 CCNc1ccc(F)cc1 Amb33189232 [1,1,0,0,0,0|1,0,0]=3 3887 B10R1.1 CCNc1ccc(N)cc1 Amb33551705 [1,1,0,0,0,0|1,0,0]=3 3888 B10R1.1 CCNc1ccc(N)cc1 Amb7767528 [1,1,0,0,0,0|1,0,0]=3 3889 B10R1.1 CCNc1ccc(N)cn1 Amb22737072 [1,1,0,0,0,0|2,0,0]=4 3890 B10R1.1 CCNc1ccc(N)cn1 Amb33536653 [1,1,0,0,0,0|2,0,0]=4 3891 B10R1.1 CCNc1ccc(N)nc1 Amb7767524 [1,1,0,0,0,0|2,0,0]=4 3892 B10R1.1 CCNc1ccc(O)cc1 Amb28555423 [1,1,0,0,0,0|1,0,0]=3 3893 B10R1.1 CCNc1ccc(O)cc1 Amb9608869 [1,1,0,0,0,0|1,0,0]=3 3894 B10R1.1 CCNc1ccc(S)cc1 Amb27242310 [1,1,0,0,0,0|1,0,0]=3 3895 B10R1.1 CCON1C=CC(=O)C=N1 Amb27267091 [1,1,0,0,0,0|2,0,0]=4 3896 B10R1.1 CCOc1ccc(Br)cc1 Amb2691855 [1,1,0,0,0,0|0,0,0]=2 3897 B10R1.1 CCOc1ccc(Br)cn1 Amb2609596 [1,1,0,0,0,0|1,0,0]=3 3898 B10R1.1 CCOc1ccc(Br)nc1 Amb10070294 [1,1,0,0,0,0|1,0,0]=3 3899 B10R1.1 CCOc1ccc(Br)nn1 Amb10599626 [1,1,0,0,0,0|2,0,0]=4 3900 B10R1.1 CCOc1ccc(C)cc1 Amb4016279 [1,1,0,0,0,0|0,0,0]=2 3901 B10R1.1 CCOc1ccc(C)nc1 Amb24057171 [1,1,0,0,0,0|1,0,0]=3 3902 B10R1.1 CCOc1ccc(Cl)cc1 Amb2793039 [1,1,0,0,0,0|0,0,0]=2 3903 B10R1.1 CCOc1ccc(Cl)cn1 Amb2795153 [1,1,0,0,0,0|1,0,0]=3 3904 B10R1.1 CCOc1ccc(Cl)nc1 Amb15691050 [1,1,0,0,0,0|1,0,0]=3 3905 B10R1.1 CCOc1ccc(Cl)nn1 Amb6255321 [1,1,0,0,0,0|2,0,0]=4 3906 B10R1.1 CCOc1ccc(F)cc1 Amb2688289 [1,1,0,0,0,0|0,0,0]=2 3907 B10R1.1 CCOc1ccc(F)cn1 Amb21857676 [1,1,0,0,0,0|1,0,0]=3 3908 B10R1.1 CCOc1ccc(F)nc1 Amb26578473 [1,1,0,0,0,0|1,0,0]=3 3909 B10R1.1 CCOc1ccc(I)cc1 Amb6296147 [1,1,0,0,0,0|0,0,0]=2 3910 B10R1.1 CCOc1ccc(I)cn1 Amb10844711 [1,1,0,0,0,0|1,0,0]=3 3911 B10R1.1 CCOc1ccc(I)nc1 Amb24690931 [1,1,0,0,0,0|1,0,0]=3 3912 B10R1.1 CCOc1ccc(N)cc1 Amb1235495 [1,1,0,0,0,0|0,0,0]=2 3913 B10R1.1 CCOc1ccc(N)cc1 Amb32644735 [1,1,0,0,0,0|0,0,0]=2 3914 B10R1.1 CCOc1ccc(N)cc1 Amb6383245 [1,1,0,0,0,0|0,0,0]=2 3915 B10R1.1 CCOc1ccc(N)cn1 Amb1132257 [1,1,0,0,0,0|1,0,0]=3 3916 B10R1.1 CCOc1ccc(N)nc1 Amb6679799 [1,1,0,0,0,0|1,0,0]=3 3917 B10R1.1 CCOc1ccc(N)nn1 Amb19957599 [1,1,0,0,0,0|2,0,0]=4 3918 B10R1.1 CCOc1ccc(O)cc1 Amb1808385 [1,1,0,0,0,0|0,0,0]=2 3919 B10R1.1 CCOc1ccc(O)cn1 Amb18643366 [1,1,0,0,0,0|1,0,0]=3 3920 B10R1.1 CCOc1ccc(S)cc1 Amb459607 [1,1,0,0,0,0|0,0,0]=2 3921 B10R1.1 CCOc1cnc(Br)cn1 Amb10599257 [1,1,0,0,0,0|2,0,0]=4 3922 B10R1.1 CCOc1cnc(Br)nc1 Amb23440204 [1,1,0,0,0,0|2,0,0]=4 3923 B10R1.1 CCOc1cnc(Cl)nc1 Amb22234786 [1,1,0,0,0,0|2,0,0]=4 3924 B10R1.1 CCOc1cnc(N)cn1 Amb19894964 [1,1,0,0,0,0|2,0,0]=4 3925 B10R1.1 CCOc1cnc(N)nc1 Amb4005469 [1,1,0,0,0,0|2,0,0]=4 3926 B10R1.1 CCOc1ncc(Br)cn1 Amb2455917 [1,1,0,0,0,0|2,0,0]=4 3927 B10R1.1 CCOc1ncc(Cl)cn1 Amb22274169 [1,1,0,0,0,0|2,0,0]=4 3928 B10R1.1 CCOc1ncc(I)cn1 Amb27170130 [1,1,0,0,0,0|2,0,0]=4 3929 B10R1.1 CCOc1ncc(N)cn1 Amb18951527 [1,1,0,0,0,0|2,0,0]=4 3930 B10R1.1 CCSc1ccc(Br)cc1 Amb3939596 [1,1,0,0,0,0|0,1,0]=3 3931 B10R1.1 CCSc1ccc(Br)cn1 Amb20628984 [1,1,0,0,0,0|1,1,0]=4 3932 B10R1.1 CCSc1ccc(C)cc1 Amb3542302 [1,1,0,0,0,0|0,1,0]=3 3933 B10R1.1 CCSc1ccc(C)cn1 Amb25762078 [1,1,0,0,0,0|1,1,0]=4 3934 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [1,1,0,0,0,0|0,1,0]=3 3935 B10R1.1 CCSc1ccc(N)cc1 Amb13949222 [1,1,0,0,0,0|0,1,0]=3 3936 B10R1.1 CCSc1ccc(N)cc1 Amb2099645 [1,1,0,0,0,0|0,1,0]=3 3937 B10R1.1 CCSc1ccc(N)cn1 Amb33534196 [1,1,0,0,0,0|1,1,0]=4 3938 B10R1.1 CCSc1ccc(N)nc1 Amb6680296 [1,1,0,0,0,0|1,1,0]=4 3939 B10R1.1 CCSc1ccc(O)cc1 Amb17202382 [1,1,0,0,0,0|0,1,0]=3 3940 B10R1.1 CCSc1ccc(S)cc1 Amb2687964 [1,1,0,0,0,0|0,1,0]=3 3941 B10R1.1 CNCc1ccc(Br)cc1 Amb1209641 [1,1,0,0,0,0|2,0,0]=4 3942 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|2,0,0]=4 3943 B10R1.1 CNCc1ccc(C)cc1 Amb1241142 [1,1,0,0,0,0|2,0,0]=4 3944 B10R1.1 CNCc1ccc(C)cc1 Amb8503283 [1,1,0,0,0,0|2,0,0]=4 3945 B10R1.1 CNCc1ccc(Cl)cc1 Amb1648458 [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|2,0,0]=4 3947 B10R1.1 CNCc1ccc(F)cc1 Amb1105922 [1,1,0,0,0,0|2,0,0]=4 3948 B10R1.1 CNCc1ccc(F)cc1 Amb9677313 [1,1,0,0,0,0|2,0,0]=4 3949 B10R1.1 CNCc1ccc(N)cc1 Amb2691278 [1,1,0,0,0,0|2,0,0]=4 3950 B10R1.1 CNCc1ccc(O)cc1 Amb1116278 [1,1,0,0,0,0|2,0,0]=4 3951 B10R1.1 CNCc1ccc(O)cc1 Amb7969770 [1,1,0,0,0,0|2,0,0]=4 3952 B10R1.1 CNCc1ccc(O)cc1 Amb8428171 [1,1,0,0,0,0|2,0,0]=4 3953 B10R1.1 CNCc1ccc(S)cc1 Amb28079262 [1,1,0,0,0,0|2,0,0]=4 3954 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|2,0,0]=4 3955 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|2,0,0]=4 3956 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|2,0,0]=4 3957 B10R1.1 COCc1ccc(N)cc1 Amb1137167 [1,1,0,0,0,0|2,0,0]=4 3958 B10R1.1 COCc1ccc(O)cc1 Amb3939459 [1,1,0,0,0,0|2,0,0]=4 3959 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|2,0,0]=4 3960 B10R1.1 CON=C1C=CC(=O)C=C1 Amb3482963 [1,1,0,0,0,0|2,0,0]=4 3961 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|2,0,0]=4 3962 B10R1.1 CSCc1ccc(C)cc1 Amb16185125 [1,1,0,0,0,0|2,0,0]=4 3963 B10R1.1 CSCc1ccc(Cl)cc1 Amb4013182 [1,1,0,0,0,0|2,0,0]=4 3964 B10R1.1 CSCc1ccc(F)cc1 Amb27162448 [1,1,0,0,0,0|2,0,0]=4 3965 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|2,0,0]=4 3966 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|2,0,0]=4 3967 B10R1.1 C[n+]1ccc(CCF)cc1 Amb28197546 [1,1,0,0,0,0|2,0,0]=4 3968 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb34050082 [1,1,0,0,0,0|1,0,1]=4 3969 B10R1.1 C\C=C\c1ccc(N)cc1 Amb26370017 [1,1,0,0,0,0|1,0,1]=4 3970 B10R1.1 C\C=C\c1ccc(N)cc1 Amb32653072 [1,1,0,0,0,0|1,0,1]=4 3971 B10R1.1 C\C=N\c1ccc(Cl)cc1 Amb27173616 [1,1,0,0,0,0|1,0,1]=4 3972 B10R1.1 C\N=C\c1ccc(Cl)cc1 Amb26890786 [1,1,0,0,0,0|2,0,0]=4 3973 B10R1.1 Cc1cc[n+](CCF)cc1 Amb27396575 [1,1,0,0,0,0|2,0,0]=4 3974 B10R1.1 Cc1ccc(CC#N)cc1 Amb6251339 [1,1,0,0,0,0|1,0,1]=4 3975 B10R1.1 Cc1ccc(CC=O)cc1 Amb3941002 [1,1,0,0,0,0|0,0,2]=4 3976 B10R1.1 Cc1ccc(CCBr)cc1 Amb2685165 [1,1,0,0,0,0|1,0,0]=3 3977 B10R1.1 Cc1ccc(CCBr)cn1 Amb24066233 [1,1,0,0,0,0|2,0,0]=4 3978 B10R1.1 Cc1ccc(CCBr)cn1 Amb35789293 [1,1,0,0,0,0|2,0,0]=4 3979 B10R1.1 Cc1ccc(CCBr)nc1 Amb27489433 [1,1,0,0,0,0|2,0,0]=4 3980 B10R1.1 Cc1ccc(CCCl)cc1 Amb9004312 [1,1,0,0,0,0|1,0,0]=3 3981 B10R1.1 Cc1ccc(CCCl)cn1 Amb24658933 [1,1,0,0,0,0|2,0,0]=4 3982 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,0]=3 3983 B10R1.1 Cc1ccc(CCI)cn1 Amb28255765 [1,1,0,0,0,0|2,0,0]=4 3984 B10R1.1 Cc1ccc(CCI)nc1 Amb28195751 [1,1,0,0,0,0|2,0,0]=4 3985 B10R1.1 Cc1ccc(CCN)cc1 Amb1129454 [1,1,0,0,0,0|1,0,0]=3 3986 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,0]=3 3987 B10R1.1 Cc1ccc(CCN)cn1 Amb10610554 [1,1,0,0,0,0|2,0,0]=4 3988 B10R1.1 Cc1ccc(CCN)nc1 Amb24065042 [1,1,0,0,0,0|2,0,0]=4 3989 B10R1.1 Cc1ccc(CCN)nc1 Amb32663333 [1,1,0,0,0,0|2,0,0]=4 3990 B10R1.1 Cc1ccc(CCN)nc1 Amb8386308 [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.1 Cc1ccc(CCO)cc1 Amb3939097 [1,1,0,0,0,0|0,0,0]=2 3992 B10R1.1 Cc1ccc(CCO)cn1 Amb10603991 [1,1,0,0,0,0|1,0,0]=3 3993 B10R1.1 Cc1ccc(CCO)nc1 Amb2694542 [1,1,0,0,0,0|1,0,0]=3 3994 B10R1.1 Cc1ccc(CCS)cc1 Amb16183304 [1,1,0,0,0,0|0,1,0]=3 3995 B10R1.1 Cc1ccc(CCS)cn1 Amb24583128 [1,1,0,0,0,0|1,1,0]=4 3996 B10R1.1 Cc1ccc(CCS)nc1 Amb26979889 [1,1,0,0,0,0|1,1,0]=4 3997 B10R1.1 Cc1ccc(CNN)cc1 Amb1112560 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 3999 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|1,0,0]=3 4001 B10R1.1 Cc1ccc(CNO)cn1 Amb25305252 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.1 Cc1ccc(CNO)nc1 Amb25145636 [1,1,0,0,0,0|2,0,0]=4 4003 B10R1.1 Cc1ccc(CON)cc1 Amb1946246 [1,1,0,0,0,0|2,0,0]=4 4004 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 4005 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 4006 B10R1.1 Cc1ccc(NCN)cc1 Amb17117016 [1,1,0,0,0,0|2,0,0]=4 4007 B10R1.1 Cc1ccc(OC=O)cc1 Amb25248584 [1,1,0,0,0,0|0,0,2]=4 4008 B10R1.1 Cc1ccc(SCCl)cc1 Amb2694974 [1,1,0,0,0,0|1,1,0]=4 4009 B10R1.1 Cc1ccc(\C=N\O)cc1 Amb1152459 [1,1,0,0,0,0|1,0,1]=4 4010 B10R1.1 Cc1cnc(CCO)cn1 Amb25077347 [1,1,0,0,0,0|2,0,0]=4 4011 B10R1.1 ClCCc1ccc(Br)cc1 Amb8860568 [1,1,0,0,0,0|1,0,0]=3 4012 B10R1.1 ClCCc1ccc(Br)nc1 Amb27813093 [1,1,0,0,0,0|2,0,0]=4 4013 B10R1.1 ClCCc1ccc(Cl)cc1 Amb9004318 [1,1,0,0,0,0|1,0,0]=3 4014 B10R1.1 ClCCc1ccc(Cl)nc1 Amb25144552 [1,1,0,0,0,0|2,0,0]=4 4015 B10R1.1 ClCOc1ccc(Br)cc1 Amb26369456 [1,1,0,0,0,0|1,0,0]=3 4016 B10R1.1 ClCOc1ccc(Cl)cc1 Amb8513685 [1,1,0,0,0,0|1,0,0]=3 4017 B10R1.1 ClCOc1ccc(I)cc1 Amb26337011 [1,1,0,0,0,0|1,0,0]=3 4018 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [1,1,0,0,0,0|1,1,0]=4 4019 B10R1.1 ClCSc1ccc(Cl)cc1 Amb22351380 [1,1,0,0,0,0|1,1,0]=4 4020 B10R1.1 ClCSc1ccc(I)cc1 Amb26640379 [1,1,0,0,0,0|1,1,0]=4 4021 B10R1.1 Cl[Zn]Cc1ccc(Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 4022 B10R1.1 Clc1ccc(CCBr)cc1 Amb2685157 [1,1,0,0,0,0|1,0,0]=3 4023 B10R1.1 Clc1ccc(CCBr)cn1 Amb24741687 [1,1,0,0,0,0|2,0,0]=4 4024 B10R1.1 Clc1ccc(CCBr)nc1 Amb26370172 [1,1,0,0,0,0|2,0,0]=4 4025 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,0]=3 4026 B10R1.1 FCOc1ccc(Br)cc1 Amb25918920 [1,1,0,0,0,0|1,0,0]=3 4027 B10R1.1 FCSc1ccc(Br)cc1 Amb27239229 [1,1,0,0,0,0|1,1,0]=4 4028 B10R1.1 Fc1ccc(CCBr)cc1 Amb2685160 [1,1,0,0,0,0|1,0,0]=3 4029 B10R1.1 Fc1ccc(CCBr)cn1 Amb33332987 [1,1,0,0,0,0|2,0,0]=4 4030 B10R1.1 Fc1ccc(CCBr)nc1 Amb33452085 [1,1,0,0,0,0|2,0,0]=4 4031 B10R1.1 Fc1ccc(CCCl)cc1 Amb2685902 [1,1,0,0,0,0|1,0,0]=3 4032 B10R1.1 Fc1ccc(CCI)cc1 Amb28315757 [1,1,0,0,0,0|1,0,0]=3 4033 B10R1.1 Fc1ccc(CCS)cc1 Amb17400005 [1,1,0,0,0,0|0,1,0]=3 4034 B10R1.1 Fc1ccc(CCS)cn1 Amb33425100 [1,1,0,0,0,0|1,1,0]=4 4035 B10R1.1 Fc1ccc(CCS)nc1 Amb33315235 [1,1,0,0,0,0|1,1,0]=4 4036 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 4037 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 4038 B10R1.1 Fc1ccc(OCCl)cc1 Amb24538040 [1,1,0,0,0,0|1,0,0]=3 4039 B10R1.1 Fc1ccc(SCCl)cc1 Amb26585309 [1,1,0,0,0,0|1,1,0]=4 4040 B10R1.1 N#CCc1ccc(Br)cc1 Amb1130758 [1,1,0,0,0,0|1,0,1]=4 4041 B10R1.1 N#CCc1ccc(Cl)cc1 Amb1883007 [1,1,0,0,0,0|1,0,1]=4 4042 B10R1.1 N#CCc1ccc(F)cc1 Amb1154069 [1,1,0,0,0,0|1,0,1]=4 4043 B10R1.1 N#CCc1ccc(I)cc1 Amb3939808 [1,1,0,0,0,0|1,0,1]=4 4044 B10R1.1 N#CCc1ccc(N)cc1 Amb1215260 [1,1,0,0,0,0|1,0,1]=4 4045 B10R1.1 N#CCc1ccc(N)cc1 Amb6297246 [1,1,0,0,0,0|1,0,1]=4 4046 B10R1.1 N#CCc1ccc(O)cc1 Amb1154109 [1,1,0,0,0,0|1,0,1]=4 4047 B10R1.1 N#COc1ccc(N)cc1 Amb27438447 [1,1,0,0,0,0|1,0,1]=4 4048 B10R1.1 N#COc1ccc(O)cc1 Amb27255463 [1,1,0,0,0,0|1,0,1]=4 4049 B10R1.1 NCCC1=CNC(=O)C=C1 Amb18908312 [1,1,0,0,0,0|2,0,0]=4 4050 B10R1.1 NCCC1=CNC(=O)C=C1 Amb32652914 [1,1,0,0,0,0|2,0,0]=4 4051 B10R1.1 NCCC1=CNC(=O)C=C1 Amb32664228 [1,1,0,0,0,0|2,0,0]=4 4052 B10R1.1 NCCN1C=CC(=O)C=C1 Amb18534867 [1,1,0,0,0,0|2,0,0]=4 4053 B10R1.1 NCCc1cc[n+]([O-])cc1 Amb24471141 [1,1,0,0,0,0|2,0,0]=4 4054 B10R1.1 NCCc1ccc(Br)cc1 Amb10808111 [1,1,0,0,0,0|1,0,0]=3 4055 B10R1.1 NCCc1ccc(Br)cc1 Amb2685385 [1,1,0,0,0,0|1,0,0]=3 4056 B10R1.1 NCCc1ccc(Br)cc1 Amb3938967 [1,1,0,0,0,0|1,0,0]=3 4057 B10R1.1 NCCc1ccc(Br)cn1 Amb22751436 [1,1,0,0,0,0|2,0,0]=4 4058 B10R1.1 NCCc1ccc(Br)nc1 Amb22233813 [1,1,0,0,0,0|2,0,0]=4 4059 B10R1.1 NCCc1ccc(Cl)cc1 Amb1212558 [1,1,0,0,0,0|1,0,0]=3 4060 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,0]=3 4061 B10R1.1 NCCc1ccc(Cl)cn1 Amb22751421 [1,1,0,0,0,0|2,0,0]=4 4062 B10R1.1 NCCc1ccc(Cl)nc1 Amb19516101 [1,1,0,0,0,0|2,0,0]=4 4063 B10R1.1 NCCc1ccc(Cl)nc1 Amb31308448 [1,1,0,0,0,0|2,0,0]=4 4064 B10R1.1 NCCc1ccc(F)cc1 Amb1215262 [1,1,0,0,0,0|1,0,0]=3 4065 B10R1.1 NCCc1ccc(F)cn1 Amb22899431 [1,1,0,0,0,0|2,0,0]=4 4066 B10R1.1 NCCc1ccc(F)cn1 Amb8011392 [1,1,0,0,0,0|2,0,0]=4 4067 B10R1.1 NCCc1ccc(F)nc1 Amb25678845 [1,1,0,0,0,0|2,0,0]=4 4068 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,0]=3 4069 B10R1.1 NCCc1ccc(I)cc1 Amb28555584 [1,1,0,0,0,0|1,0,0]=3 4070 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,0]=3 4071 B10R1.1 NCCc1ccc(N)cc1 Amb4037003 [1,1,0,0,0,0|1,0,0]=3 4072 B10R1.1 NCCc1ccc(N)cn1 Amb27469582 [1,1,0,0,0,0|2,0,0]=4 4073 B10R1.1 NCCc1ccc(N)nc1 Amb32434775 [1,1,0,0,0,0|2,0,0]=4 4074 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,0]=3 4075 B10R1.1 NCCc1ccc(O)cc1 Amb33540244 [1,1,0,0,0,0|1,0,0]=3 4076 B10R1.1 NCCc1ccc(O)cc1 Amb533726 [1,1,0,0,0,0|1,0,0]=3 4077 B10R1.1 NCCc1ccc(O)cn1 Amb28399086 [1,1,0,0,0,0|2,0,0]=4 4078 B10R1.1 NCCc1ccc(O)cn1 Amb28555567 [1,1,0,0,0,0|2,0,0]=4 4079 B10R1.1 NNCc1ccc(Br)cc1 Amb1114984 [1,1,0,0,0,0|2,0,0]=4 4080 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 4081 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 4082 B10R1.1 NNCc1ccc(Cl)cc1 Amb1121233 [1,1,0,0,0,0|2,0,0]=4 4083 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 4084 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 4085 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 4086 B10R1.1 NNCc1ccc(F)cc1 Amb10841872 [1,1,0,0,0,0|2,0,0]=4 4087 B10R1.1 NNCc1ccc(F)cc1 Amb1112880 [1,1,0,0,0,0|2,0,0]=4 4088 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 4089 B10R1.1 NNCc1ccc(O)cc1 Amb27814030 [1,1,0,0,0,0|2,0,0]=4 4090 B10R1.1 NNCc1ccc(O)cc1 Amb32655872 [1,1,0,0,0,0|2,0,0]=4 4091 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 4092 B10R1.1 NOCc1ccc(Br)cc1 Amb8471896 [1,1,0,0,0,0|2,0,0]=4 4093 B10R1.1 NOCc1ccc(Cl)cc1 Amb10607411 [1,1,0,0,0,0|2,0,0]=4 4094 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 4095 B10R1.1 NOCc1ccc(F)cc1 Amb17091427 [1,1,0,0,0,0|2,0,0]=4 4096 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 4097 B10R1.1 NOCc1ccc(N)cc1 Amb28184708 [1,1,0,0,0,0|2,0,0]=4 4098 B10R1.1 NOCc1ccc(O)cc1 Amb8391701 [1,1,0,0,0,0|2,0,0]=4 4099 B10R1.1 Nc1ccc(CCBr)cc1 Amb17595296 [1,1,0,0,0,0|1,0,0]=3 4100 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,0]=3 4101 B10R1.1 Nc1ccc(CCO)cc1 Amb594608 [1,1,0,0,0,0|0,0,0]=2 4102 B10R1.1 Nc1ccc(CCO)cn1 Amb23446333 [1,1,0,0,0,0|1,0,0]=3 4103 B10R1.1 Nc1ccc(CCO)nc1 Amb24593512 [1,1,0,0,0,0|1,0,0]=3 4104 B10R1.1 Nc1ccc(OCF)cc1 Amb25887737 [1,1,0,0,0,0|1,0,0]=3 4105 B10R1.1 Nc1ccc(OCO)nc1 Amb33128029 [1,1,0,0,0,0|1,0,0]=3 4106 B10R1.1 Nc1ccc(SCCl)cc1 Amb25281595 [1,1,0,0,0,0|1,1,0]=4 4107 B10R1.1 Nc1ccc(\C=N\O)cc1 Amb28348427 [1,1,0,0,0,0|1,0,1]=4 4108 B10R1.1 Nc1ncc(CCO)cn1 Amb27173928 [1,1,0,0,0,0|2,0,0]=4 4109 B10R1.1 O=C1C=CC(CCO)=CO1 Amb27615745 [1,1,0,0,0,0|1,0,0]=3 4110 B10R1.1 O=C1C=CC(CCO)C=C1 Amb27770442 [1,1,0,0,0,0|0,0,1]=3 4111 B10R1.1 O=C1C=CN(CCBr)C=C1 Amb27233194 [1,1,0,0,0,0|2,0,0]=4 4112 B10R1.1 O=C1C=CN(CCCl)C=C1 Amb18177573 [1,1,0,0,0,0|2,0,0]=4 4113 B10R1.1 O=C1C=CN(CCS)C=C1 Amb28185809 [1,1,0,0,0,0|1,1,0]=4 4114 B10R1.1 O=C1N=CC(CCO)=CN1 Amb28555655 [1,1,0,0,0,0|2,0,0]=4 4115 B10R1.1 O=CCc1ccc(Br)cc1 Amb16230450 [1,1,0,0,0,0|0,0,2]=4 4116 B10R1.1 O=CCc1ccc(Cl)cc1 Amb10603161 [1,1,0,0,0,0|0,0,2]=4 4117 B10R1.1 O=CCc1ccc(F)cc1 Amb16230451 [1,1,0,0,0,0|0,0,2]=4 4118 B10R1.1 O=CCc1ccc(O)cc1 Amb9782679 [1,1,0,0,0,0|0,0,2]=4 4119 B10R1.1 OBCc1ccc(Cl)cc1 Amb28457057 [1,1,0,0,0,0|1,0,0]=3 4120 B10R1.1 OBCc1ccc(F)cc1 Amb27650835 [1,1,0,0,0,0|1,0,0]=3 4121 B10R1.1 OCCc1ccc(Br)cc1 Amb2726152 [1,1,0,0,0,0|0,0,0]=2 4122 B10R1.1 OCCc1ccc(Br)cn1 Amb21858814 [1,1,0,0,0,0|1,0,0]=3 4123 B10R1.1 OCCc1ccc(Br)nc1 Amb23569407 [1,1,0,0,0,0|1,0,0]=3 4124 B10R1.1 OCCc1ccc(Cl)cc1 Amb2780043 [1,1,0,0,0,0|0,0,0]=2 4125 B10R1.1 OCCc1ccc(Cl)cn1 Amb28424027 [1,1,0,0,0,0|1,0,0]=3 4126 B10R1.1 OCCc1ccc(Cl)nc1 Amb22752853 [1,1,0,0,0,0|1,0,0]=3 4127 B10R1.1 OCCc1ccc(F)cc1 Amb3939063 [1,1,0,0,0,0|0,0,0]=2 4128 B10R1.1 OCCc1ccc(F)cn1 Amb24426849 [1,1,0,0,0,0|1,0,0]=3 4129 B10R1.1 OCCc1ccc(F)nc1 Amb25063775 [1,1,0,0,0,0|1,0,0]=3 4130 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|0,0,0]=2 4131 B10R1.1 OCCc1ccc(I)nc1 Amb23446988 [1,1,0,0,0,0|1,0,0]=3 4132 B10R1.1 OCCc1ccc(O)cc1 Amb2725510 [1,1,0,0,0,0|0,0,0]=2 4133 B10R1.1 OCCc1ccc(S)nc1 Amb23446733 [1,1,0,0,0,0|1,0,0]=3 4134 B10R1.1 OCCc1cnc(F)nc1 Amb26851462 [1,1,0,0,0,0|2,0,0]=4 4135 B10R1.1 OCCc1cnc(O)nc1 Amb26957386 [1,1,0,0,0,0|2,0,0]=4 4136 B10R1.1 OCCc1cnc(S)nc1 Amb27755835 [1,1,0,0,0,0|2,0,0]=4 4137 B10R1.1 OCCc1ncc(Br)cn1 Amb22896759 [1,1,0,0,0,0|2,0,0]=4 4138 B10R1.1 OCCc1ncc(Cl)cn1 Amb27865986 [1,1,0,0,0,0|2,0,0]=4 4139 B10R1.1 OCCc1ncc(S)cn1 Amb1971491 [1,1,0,0,0,0|2,0,0]=4 4140 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|1,0,0]=3 4141 B10R1.1 ONCc1ccc(Br)cn1 Amb27666709 [1,1,0,0,0,0|2,0,0]=4 4142 B10R1.1 ONCc1ccc(Br)nc1 Amb33387357 [1,1,0,0,0,0|2,0,0]=4 4143 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|1,0,0]=3 4144 B10R1.1 ONCc1ccc(Cl)nc1 Amb33261190 [1,1,0,0,0,0|2,0,0]=4 4145 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|1,0,0]=3 4146 B10R1.1 ONCc1ccc(F)cn1 Amb32954386 [1,1,0,0,0,0|2,0,0]=4 4147 B10R1.1 ONCc1ccc(F)nc1 Amb33426960 [1,1,0,0,0,0|2,0,0]=4 4148 B10R1.1 ONCc1ccc(O)cc1 Amb23449449 [1,1,0,0,0,0|1,0,0]=3 4149 B10R1.1 ONCc1ccc(O)cn1 Amb27455725 [1,1,0,0,0,0|2,0,0]=4 4150 B10R1.1 O\N=C\c1ccc(Br)cc1 Amb1152409 [1,1,0,0,0,0|1,0,1]=4 4151 B10R1.1 O\N=C\c1ccc(Cl)cc1 Amb1152205 [1,1,0,0,0,0|1,0,1]=4 4152 B10R1.1 O\N=C\c1ccc(Cl)cc1 Amb33714742 [1,1,0,0,0,0|1,0,1]=4 4153 B10R1.1 O\N=C\c1ccc(F)cc1 Amb33623403 [1,1,0,0,0,0|1,0,1]=4 4154 B10R1.1 O\N=C\c1ccc(I)cc1 Amb4035593 [1,1,0,0,0,0|1,0,1]=4 4155 B10R1.1 O\N=C\c1ccc(O)cc1 Amb5722541 [1,1,0,0,0,0|1,0,1]=4 4156 B10R1.1 Oc1ccc(CCBr)cc1 Amb5718179 [1,1,0,0,0,0|1,0,0]=3 4157 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,0]=3 4158 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|0,1,0]=3 4159 B10R1.1 Oc1ccc(OCF)cc1 Amb27599328 [1,1,0,0,0,0|1,0,0]=3 4160 B10R1.1 Oc1ccc(SCCl)cc1 Amb25936639 [1,1,0,0,0,0|1,1,0]=4 4161 B10R1.1 SCCc1ccc(Br)cc1 Amb17404679 [1,1,0,0,0,0|0,1,0]=3 4162 B10R1.1 SCCc1ccc(Br)cn1 Amb33477443 [1,1,0,0,0,0|1,1,0]=4 4163 B10R1.1 SCCc1ccc(Br)nc1 Amb33389188 [1,1,0,0,0,0|1,1,0]=4 4164 B10R1.1 SCCc1ccc(Cl)cc1 Amb17400376 [1,1,0,0,0,0|0,1,0]=3 4165 B10R1.1 SCCc1ccc(Cl)cn1 Amb33058825 [1,1,0,0,0,0|1,1,0]=4 4166 B10R1.1 SCCc1ccc(Cl)nc1 Amb33261706 [1,1,0,0,0,0|1,1,0]=4 4167 B10R1.1 [C-]#[N+]Cc1ccc(Br)cc1 Amb2684960 [1,1,0,0,0,0|2,0,0]=4 4168 B10R1.1 [C-]#[N+]Cc1ccc(C)cc1 Amb1981066 [1,1,0,0,0,0|2,0,0]=4 4169 B10R1.1 [C-]#[N+]Cc1ccc(Cl)cc1 Amb2235910 [1,1,0,0,0,0|2,0,0]=4 4170 B10R1.1 [C-]#[N+]Cc1ccc(F)cc1 Amb1981065 [1,1,0,0,0,0|2,0,0]=4 4171 B10R1.4 BrCCc1ccccc1Br Amb19515770 [1,1,0,0,0,0|1,0,0]=3 4172 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,0]=3 4173 B10R1.4 BrCCc1cccnc1Br Amb33389472 [1,1,0,0,0,0|2,0,0]=4 4174 B10R1.4 BrCCc1ccncc1Br Amb33242646 [1,1,0,0,0,0|2,0,0]=4 4175 B10R1.4 BrCCc1ncccc1Br Amb33242278 [1,1,0,0,0,0|2,0,0]=4 4176 B10R1.4 C#CCc1ccccc1Br Amb33451964 [1,1,0,0,0,0|1,0,1]=4 4177 B10R1.4 C#CCc1ccccc1C Amb33449990 [1,1,0,0,0,0|1,0,1]=4 4178 B10R1.4 C#CCc1ccccc1Cl Amb33052524 [1,1,0,0,0,0|1,0,1]=4 4179 B10R1.4 C#CCc1ccccc1F Amb33456146 [1,1,0,0,0,0|1,0,1]=4 4180 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|1,0,1]=4 4181 B10R1.4 C#NCc1ccccc1Br Amb31112144 [1,1,0,0,0,0|2,0,0]=4 4182 B10R1.4 C#NCc1ccccc1C Amb31132458 [1,1,0,0,0,0|2,0,0]=4 4183 B10R1.4 C#NCc1ccccc1Cl Amb31111982 [1,1,0,0,0,0|2,0,0]=4 4184 B10R1.4 C#NCc1ccccc1F Amb31132461 [1,1,0,0,0,0|2,0,0]=4 4185 B10R1.4 C=CCc1ccccc1Br Amb26451399 [1,1,0,0,0,0|1,0,1]=4 4186 B10R1.4 C=CCc1ccccc1C Amb6298985 [1,1,0,0,0,0|1,0,1]=4 4187 B10R1.4 C=CCc1ccccc1Cl Amb6298963 [1,1,0,0,0,0|1,0,1]=4 4188 B10R1.4 C=CCc1ccccc1F Amb6299090 [1,1,0,0,0,0|1,0,1]=4 4189 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|1,0,1]=4 4190 B10R1.4 C=COc1ccccc1Cl Amb28126760 [1,1,0,0,0,0|0,0,2]=4 4191 B10R1.4 C=COc1ccccc1F Amb26369650 [1,1,0,0,0,0|0,0,2]=4 4192 B10R1.4 C=COc1ccccc1I Amb27234455 [1,1,0,0,0,0|0,0,2]=4 4193 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|0,0,2]=4 4194 B10R1.4 CC#Cc1ccccc1Cl Amb28384813 [1,1,0,0,0,0|1,0,1]=4 4195 B10R1.4 CCCN1C=CC=CC1=O Amb22730334 [1,1,0,0,0,0|2,0,0]=4 4196 B10R1.4 CCCN1C=CC=CC1=S Amb24480486 [1,1,0,0,0,0|2,0,0]=4 4197 B10R1.4 CCCc1ccccc1Br Amb26623759 [1,1,0,0,0,0|1,0,0]=3 4198 B10R1.4 CCCc1ccccc1C Amb22227985 [1,1,0,0,0,0|1,0,0]=3 4199 B10R1.4 CCCc1ccccc1Cl Amb28049677 [1,1,0,0,0,0|1,0,0]=3 4200 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|1,0,0]=3 4201 B10R1.4 CCCc1ccccc1N Amb2724372 [1,1,0,0,0,0|1,0,0]=3 4202 B10R1.4 CCCc1ccccc1O Amb2726171 [1,1,0,0,0,0|1,0,0]=3 4203 B10R1.4 CCCc1ccccc1S Amb32688038 [1,1,0,0,0,0|1,0,0]=3 4204 B10R1.4 CCCc1cccnc1Br Amb24319271 [1,1,0,0,0,0|2,0,0]=4 4205 B10R1.4 CCCc1cccnc1Cl Amb24319272 [1,1,0,0,0,0|2,0,0]=4 4206 B10R1.4 CCCc1cccnc1N Amb8386852 [1,1,0,0,0,0|2,0,0]=4 4207 B10R1.4 CCCc1cccnc1O Amb24319273 [1,1,0,0,0,0|2,0,0]=4 4208 B10R1.4 CCCc1ccncc1Br Amb24320559 [1,1,0,0,0,0|2,0,0]=4 4209 B10R1.4 CCCc1ccncc1N Amb18203088 [1,1,0,0,0,0|2,0,0]=4 4210 B10R1.4 CCCc1cnccc1Br Amb20617515 [1,1,0,0,0,0|2,0,0]=4 4211 B10R1.4 CCCc1cnccc1C Amb26366029 [1,1,0,0,0,0|2,0,0]=4 4212 B10R1.4 CCCc1cnccc1N Amb22522169 [1,1,0,0,0,0|2,0,0]=4 4213 B10R1.4 CCCc1cnccc1O Amb33189019 [1,1,0,0,0,0|2,0,0]=4 4214 B10R1.4 CCCc1ncccc1Br Amb24320669 [1,1,0,0,0,0|2,0,0]=4 4215 B10R1.4 CCCc1ncccc1C Amb28293496 [1,1,0,0,0,0|2,0,0]=4 4216 B10R1.4 CCCc1ncccc1Cl Amb27968734 [1,1,0,0,0,0|2,0,0]=4 4217 B10R1.4 CCCc1ncccc1N Amb18832434 [1,1,0,0,0,0|2,0,0]=4 4218 B10R1.4 CCCc1ncccc1O Amb24320670 [1,1,0,0,0,0|2,0,0]=4 4219 B10R1.4 CCNc1ccccc1Br Amb6696453 [1,1,0,0,0,0|1,0,0]=3 4220 B10R1.4 CCNc1ccccc1C Amb4037021 [1,1,0,0,0,0|1,0,0]=3 4221 B10R1.4 CCNc1ccccc1Cl Amb32651858 [1,1,0,0,0,0|1,0,0]=3 4222 B10R1.4 CCNc1ccccc1Cl Amb4313295 [1,1,0,0,0,0|1,0,0]=3 4223 B10R1.4 CCNc1ccccc1F Amb2688341 [1,1,0,0,0,0|1,0,0]=3 4224 B10R1.4 CCNc1ccccc1I Amb9203660 [1,1,0,0,0,0|1,0,0]=3 4225 B10R1.4 CCNc1ccccc1N Amb29847532 [1,1,0,0,0,0|1,0,0]=3 4226 B10R1.4 CCNc1ccccc1N Amb7767530 [1,1,0,0,0,0|1,0,0]=3 4227 B10R1.4 CCNc1ccccc1O Amb18643152 [1,1,0,0,0,0|1,0,0]=3 4228 B10R1.4 CCNc1cccnc1Br Amb27616234 [1,1,0,0,0,0|2,0,0]=4 4229 B10R1.4 CCNc1cccnc1C Amb27224954 [1,1,0,0,0,0|2,0,0]=4 4230 B10R1.4 CCNc1cccnc1F Amb35725079 [1,1,0,0,0,0|2,0,0]=4 4231 B10R1.4 CCNc1cccnc1N Amb23557979 [1,1,0,0,0,0|2,0,0]=4 4232 B10R1.4 CCNc1cccnc1O Amb30633550 [1,1,0,0,0,0|2,0,0]=4 4233 B10R1.4 CCNc1ccncc1Br Amb28386593 [1,1,0,0,0,0|2,0,0]=4 4234 B10R1.4 CCNc1ccncc1N Amb9205237 [1,1,0,0,0,0|2,0,0]=4 4235 B10R1.4 CCNc1cnccc1C Amb26957116 [1,1,0,0,0,0|2,0,0]=4 4236 B10R1.4 CCNc1cnccc1C Amb28555476 [1,1,0,0,0,0|2,0,0]=4 4237 B10R1.4 CCNc1ncccc1Br Amb18955277 [1,1,0,0,0,0|2,0,0]=4 4238 B10R1.4 CCNc1ncccc1C Amb33529830 [1,1,0,0,0,0|2,0,0]=4 4239 B10R1.4 CCNc1ncccc1F Amb18963791 [1,1,0,0,0,0|2,0,0]=4 4240 B10R1.4 CCNc1ncccc1N Amb10609970 [1,1,0,0,0,0|2,0,0]=4 4241 B10R1.4 CCNc1ncccc1N Amb8630465 [1,1,0,0,0,0|2,0,0]=4 4242 B10R1.4 CCOC1=CC=CNC1=O Amb18537475 [1,1,0,0,0,0|1,0,0]=3 4243 B10R1.4 CCOC1=CC=NNC1=O Amb27967585 [1,1,0,0,0,0|2,0,0]=4 4244 B10R1.4 CCOC1=NC=CNC1=O Amb23450342 [1,1,0,0,0,0|2,0,0]=4 4245 B10R1.4 CCON1C=CC=CC1=S Amb25257642 [1,1,0,0,0,0|1,0,0]=3 4246 B10R1.4 CCOc1ccccc1Br Amb4010257 [1,1,0,0,0,0|0,0,0]=2 4247 B10R1.4 CCOc1ccccc1C Amb9787457 [1,1,0,0,0,0|0,0,0]=2 4248 B10R1.4 CCOc1ccccc1Cl Amb9787476 [1,1,0,0,0,0|0,0,0]=2 4249 B10R1.4 CCOc1ccccc1F Amb2688288 [1,1,0,0,0,0|0,0,0]=2 4250 B10R1.4 CCOc1ccccc1I Amb19888234 [1,1,0,0,0,0|0,0,0]=2 4251 B10R1.4 CCOc1ccccc1N Amb840072 [1,1,0,0,0,0|0,0,0]=2 4252 B10R1.4 CCOc1ccccc1O Amb3939539 [1,1,0,0,0,0|0,0,0]=2 4253 B10R1.4 CCOc1ccccc1S Amb20242711 [1,1,0,0,0,0|0,0,0]=2 4254 B10R1.4 CCOc1cccnc1Br Amb33547876 [1,1,0,0,0,0|1,0,0]=3 4255 B10R1.4 CCOc1cccnc1C Amb24057152 [1,1,0,0,0,0|1,0,0]=3 4256 B10R1.4 CCOc1cccnc1Cl Amb9175211 [1,1,0,0,0,0|1,0,0]=3 4257 B10R1.4 CCOc1cccnc1F Amb26359800 [1,1,0,0,0,0|1,0,0]=3 4258 B10R1.4 CCOc1cccnc1I Amb25681793 [1,1,0,0,0,0|1,0,0]=3 4259 B10R1.4 CCOc1cccnc1N Amb1102343 [1,1,0,0,0,0|1,0,0]=3 4260 B10R1.4 CCOc1ccncc1Br Amb8438924 [1,1,0,0,0,0|1,0,0]=3 4261 B10R1.4 CCOc1ccncc1F Amb2610080 [1,1,0,0,0,0|1,0,0]=3 4262 B10R1.4 CCOc1ccncc1I Amb24536249 [1,1,0,0,0,0|1,0,0]=3 4263 B10R1.4 CCOc1ccncc1N Amb7765083 [1,1,0,0,0,0|1,0,0]=3 4264 B10R1.4 CCOc1cnccc1C Amb27810354 [1,1,0,0,0,0|1,0,0]=3 4265 B10R1.4 CCOc1cnccc1N Amb21857560 [1,1,0,0,0,0|1,0,0]=3 4266 B10R1.4 CCOc1cncnc1Cl Amb27634356 [1,1,0,0,0,0|2,0,0]=4 4267 B10R1.4 CCOc1cncnc1N Amb22641452 [1,1,0,0,0,0|2,0,0]=4 4268 B10R1.4 CCOc1ncccc1Br Amb20242466 [1,1,0,0,0,0|1,0,0]=3 4269 B10R1.4 CCOc1ncccc1Cl Amb8439534 [1,1,0,0,0,0|1,0,0]=3 4270 B10R1.4 CCOc1ncccc1I Amb6565054 [1,1,0,0,0,0|1,0,0]=3 4271 B10R1.4 CCOc1ncccc1N Amb1136817 [1,1,0,0,0,0|1,0,0]=3 4272 B10R1.4 CCOc1ncccc1O Amb19895105 [1,1,0,0,0,0|1,0,0]=3 4273 B10R1.4 CCOc1nccnc1Br Amb24524317 [1,1,0,0,0,0|2,0,0]=4 4274 B10R1.4 CCOc1nccnc1C Amb8384177 [1,1,0,0,0,0|2,0,0]=4 4275 B10R1.4 CCOc1nccnc1Cl Amb18797491 [1,1,0,0,0,0|2,0,0]=4 4276 B10R1.4 CCOc1nccnc1F Amb35729087 [1,1,0,0,0,0|2,0,0]=4 4277 B10R1.4 CCOc1nccnc1N Amb10601935 [1,1,0,0,0,0|2,0,0]=4 4278 B10R1.4 CCOc1ncncc1Br Amb27215130 [1,1,0,0,0,0|2,0,0]=4 4279 B10R1.4 CCOc1ncncc1N Amb23558036 [1,1,0,0,0,0|2,0,0]=4 4280 B10R1.4 CCOc1nnccc1N Amb27200716 [1,1,0,0,0,0|2,0,0]=4 4281 B10R1.4 CCPc1ccccc1N Amb27637691 [1,1,0,0,0,0|1,0,0]=3 4282 B10R1.4 CCSC1=CC=CNC1=O Amb24478310 [1,1,0,0,0,0|1,1,0]=4 4283 B10R1.4 CCSc1cccc[n+]1[O-] Amb26887542 [1,1,0,0,0,0|1,1,0]=4 4284 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,1,0,0,0,0|0,1,0]=3 4285 B10R1.4 CCSc1ccccc1C Amb27259108 [1,1,0,0,0,0|0,1,0]=3 4286 B10R1.4 CCSc1ccccc1Cl Amb26500521 [1,1,0,0,0,0|0,1,0]=3 4287 B10R1.4 CCSc1ccccc1F Amb24480376 [1,1,0,0,0,0|0,1,0]=3 4288 B10R1.4 CCSc1ccccc1N Amb10609429 [1,1,0,0,0,0|0,1,0]=3 4289 B10R1.4 CCSc1ccccc1N Amb6281496 [1,1,0,0,0,0|0,1,0]=3 4290 B10R1.4 CCSc1ccccc1O Amb33529393 [1,1,0,0,0,0|0,1,0]=3 4291 B10R1.4 CCSc1ccncc1Br Amb27975336 [1,1,0,0,0,0|1,1,0]=4 4292 B10R1.4 CCSc1ccncc1C Amb28386407 [1,1,0,0,0,0|1,1,0]=4 4293 B10R1.4 CCSc1ncccc1Br Amb25075348 [1,1,0,0,0,0|1,1,0]=4 4294 B10R1.4 CCSc1ncccc1C Amb26861471 [1,1,0,0,0,0|1,1,0]=4 4295 B10R1.4 CCSc1ncccc1I Amb32411437 [1,1,0,0,0,0|1,1,0]=4 4296 B10R1.4 CCSc1ncccc1N Amb6680288 [1,1,0,0,0,0|1,1,0]=4 4297 B10R1.4 CCSc1ncccc1O Amb10552831 [1,1,0,0,0,0|1,1,0]=4 4298 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|2,0,0]=4 4299 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|2,0,0]=4 4300 B10R1.4 CNCc1ccccc1C Amb6865246 [1,1,0,0,0,0|2,0,0]=4 4301 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|2,0,0]=4 4302 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|2,0,0]=4 4303 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|2,0,0]=4 4304 B10R1.4 CNCc1ccccc1N Amb20239390 [1,1,0,0,0,0|2,0,0]=4 4305 B10R1.4 CNCc1ccccc1N Amb7173572 [1,1,0,0,0,0|2,0,0]=4 4306 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|2,0,0]=4 4307 B10R1.4 CNCc1ccccc1O Amb7969802 [1,1,0,0,0,0|2,0,0]=4 4308 B10R1.4 COCc1ccccc1Br Amb8517636 [1,1,0,0,0,0|2,0,0]=4 4309 B10R1.4 COCc1ccccc1Cl Amb27425949 [1,1,0,0,0,0|2,0,0]=4 4310 B10R1.4 COCc1ccccc1F Amb28050262 [1,1,0,0,0,0|2,0,0]=4 4311 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|2,0,0]=4 4312 B10R1.4 COCc1ccccc1N Amb6249470 [1,1,0,0,0,0|2,0,0]=4 4313 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|2,0,0]=4 4314 B10R1.4 CSCc1ccccc1Br Amb4012755 [1,1,0,0,0,0|2,0,0]=4 4315 B10R1.4 CSCc1ccccc1Cl Amb27600716 [1,1,0,0,0,0|2,0,0]=4 4316 B10R1.4 CSCc1ccccc1F Amb27146597 [1,1,0,0,0,0|2,0,0]=4 4317 B10R1.4 CSCc1ccccc1I Amb26472202 [1,1,0,0,0,0|2,0,0]=4 4318 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|2,0,0]=4 4319 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|2,0,0]=4 4320 B10R1.4 C[n+]1ccccc1CCO Amb27173561 [1,1,0,0,0,0|1,0,0]=3 4321 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|1,0,1]=4 4322 B10R1.4 C\C=C\c1ccccc1O Amb3372048 [1,1,0,0,0,0|1,0,1]=4 4323 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|1,0,1]=4 4324 B10R1.4 C\N=C\c1ccccc1N Amb27619729 [1,1,0,0,0,0|2,0,0]=4 4325 B10R1.4 Cc1ccccc1CC#N Amb1651450 [1,1,0,0,0,0|1,0,1]=4 4326 B10R1.4 Cc1ccccc1CC=O Amb10844840 [1,1,0,0,0,0|0,0,2]=4 4327 B10R1.4 Cc1ccccc1CCBr Amb2685163 [1,1,0,0,0,0|1,0,0]=3 4328 B10R1.4 Cc1ccccc1CCCl Amb9004323 [1,1,0,0,0,0|1,0,0]=3 4329 B10R1.4 Cc1ccccc1CCI Amb27246006 [1,1,0,0,0,0|1,0,0]=3 4330 B10R1.4 Cc1ccccc1CCN Amb1212557 [1,1,0,0,0,0|1,0,0]=3 4331 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,0]=3 4332 B10R1.4 Cc1ccccc1CCO Amb3939095 [1,1,0,0,0,0|0,0,0]=2 4333 B10R1.4 Cc1ccccc1CCS Amb17399938 [1,1,0,0,0,0|0,1,0]=3 4334 B10R1.4 Cc1ccccc1CNN Amb1118964 [1,1,0,0,0,0|2,0,0]=4 4335 B10R1.4 Cc1ccccc1CNN Amb6892665 [1,1,0,0,0,0|2,0,0]=4 4336 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|1,0,0]=3 4337 B10R1.4 Cc1ccccc1CON Amb17091424 [1,1,0,0,0,0|2,0,0]=4 4338 B10R1.4 Cc1ccccc1CON Amb33715629 [1,1,0,0,0,0|2,0,0]=4 4339 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 4340 B10R1.4 Cc1ccccc1OCCl Amb27494113 [1,1,0,0,0,0|1,0,0]=3 4341 B10R1.4 Cc1ccccc1\C=N\O Amb1647706 [1,1,0,0,0,0|1,0,1]=4 4342 B10R1.4 Cc1cccnc1CCBr Amb24641164 [1,1,0,0,0,0|2,0,0]=4 4343 B10R1.4 Cc1cccnc1CCI Amb35711451 [1,1,0,0,0,0|2,0,0]=4 4344 B10R1.4 Cc1cccnc1CCN Amb1995200 [1,1,0,0,0,0|2,0,0]=4 4345 B10R1.4 Cc1cccnc1CCN Amb32662795 [1,1,0,0,0,0|2,0,0]=4 4346 B10R1.4 Cc1cccnc1CCN Amb32664156 [1,1,0,0,0,0|2,0,0]=4 4347 B10R1.4 Cc1cccnc1CCO Amb2694545 [1,1,0,0,0,0|1,0,0]=3 4348 B10R1.4 Cc1cccnc1CCS Amb33361011 [1,1,0,0,0,0|1,1,0]=4 4349 B10R1.4 Cc1cccnc1CNO Amb33429076 [1,1,0,0,0,0|2,0,0]=4 4350 B10R1.4 Cc1ccncc1CCBr Amb24693233 [1,1,0,0,0,0|2,0,0]=4 4351 B10R1.4 Cc1ccncc1CCCl Amb27875306 [1,1,0,0,0,0|2,0,0]=4 4352 B10R1.4 Cc1ccncc1CCN Amb18832435 [1,1,0,0,0,0|2,0,0]=4 4353 B10R1.4 Cc1ccncc1CCO Amb27467536 [1,1,0,0,0,0|1,0,0]=3 4354 B10R1.4 Cc1ccncc1CCS Amb33375261 [1,1,0,0,0,0|1,1,0]=4 4355 B10R1.4 Cc1ccncc1CNO Amb25135601 [1,1,0,0,0,0|2,0,0]=4 4356 B10R1.4 Cc1cnccc1CCBr Amb24548352 [1,1,0,0,0,0|2,0,0]=4 4357 B10R1.4 Cc1cnccc1CCN Amb22059435 [1,1,0,0,0,0|2,0,0]=4 4358 B10R1.4 Cc1cnccc1CCO Amb26539673 [1,1,0,0,0,0|1,0,0]=3 4359 B10R1.4 Cc1cnccc1CCS Amb25197336 [1,1,0,0,0,0|1,1,0]=4 4360 B10R1.4 Cc1cnccc1CNO Amb26925533 [1,1,0,0,0,0|2,0,0]=4 4361 B10R1.4 Cc1ncccc1CCBr Amb33432583 [1,1,0,0,0,0|2,0,0]=4 4362 B10R1.4 Cc1ncccc1CCN Amb18203091 [1,1,0,0,0,0|2,0,0]=4 4363 B10R1.4 Cc1ncccc1CCO Amb24061576 [1,1,0,0,0,0|1,0,0]=3 4364 B10R1.4 Cc1ncccc1CCS Amb32878314 [1,1,0,0,0,0|1,1,0]=4 4365 B10R1.4 Cc1ncccc1CNO Amb32880816 [1,1,0,0,0,0|2,0,0]=4 4366 B10R1.4 Cc1nccnc1CCO Amb2695470 [1,1,0,0,0,0|2,0,0]=4 4367 B10R1.4 Cc1ncncc1CCO Amb24063133 [1,1,0,0,0,0|2,0,0]=4 4368 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,0]=3 4369 B10R1.4 ClCCc1ccccc1Cl Amb8860565 [1,1,0,0,0,0|1,0,0]=3 4370 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,0]=3 4371 B10R1.4 ClCCc1cccnc1Cl Amb33329271 [1,1,0,0,0,0|2,0,0]=4 4372 B10R1.4 ClCCc1ccncc1Cl Amb27615771 [1,1,0,0,0,0|2,0,0]=4 4373 B10R1.4 ClCOc1ccccc1Br Amb26889271 [1,1,0,0,0,0|1,0,0]=3 4374 B10R1.4 ClCOc1ccccc1Cl Amb22227923 [1,1,0,0,0,0|1,0,0]=3 4375 B10R1.4 ClCOc1ccccc1I Amb28187723 [1,1,0,0,0,0|1,0,0]=3 4376 B10R1.4 ClCSc1ccccc1Br Amb25887879 [1,1,0,0,0,0|1,1,0]=4 4377 B10R1.4 ClCSc1ccccc1Cl Amb28137812 [1,1,0,0,0,0|1,1,0]=4 4378 B10R1.4 ClCSc1ccccc1I Amb27641365 [1,1,0,0,0,0|1,1,0]=4 4379 B10R1.4 Cl[Zn]Cc1ccccc1Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 4380 B10R1.4 Clc1ccccc1CCBr Amb2685155 [1,1,0,0,0,0|1,0,0]=3 4381 B10R1.4 Clc1cnccc1CCBr Amb25076266 [1,1,0,0,0,0|2,0,0]=4 4382 B10R1.4 Clc1ncccc1CCBr Amb33389001 [1,1,0,0,0,0|2,0,0]=4 4383 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,0]=3 4384 B10R1.4 Fc1ccccc1CCBr Amb2685159 [1,1,0,0,0,0|1,0,0]=3 4385 B10R1.4 Fc1ccccc1CCCl Amb8860569 [1,1,0,0,0,0|1,0,0]=3 4386 B10R1.4 Fc1ccccc1CCI Amb28248386 [1,1,0,0,0,0|1,0,0]=3 4387 B10R1.4 Fc1ccccc1CCS Amb17400004 [1,1,0,0,0,0|0,1,0]=3 4388 B10R1.4 Fc1ccccc1C[Mg]Cl Amb6300393 [1,1,0,0,0,0|2,0,0]=4 4389 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 4390 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,1,0,0,0,0|1,0,0]=3 4391 B10R1.4 Fc1ccccc1SCCl Amb27447816 [1,1,0,0,0,0|1,1,0]=4 4392 B10R1.4 Fc1cccnc1CCBr Amb33337356 [1,1,0,0,0,0|2,0,0]=4 4393 B10R1.4 Fc1cccnc1CCS Amb33327466 [1,1,0,0,0,0|1,1,0]=4 4394 B10R1.4 Fc1cnccc1CCBr Amb25172854 [1,1,0,0,0,0|2,0,0]=4 4395 B10R1.4 Fc1cnccc1CCS Amb33316476 [1,1,0,0,0,0|1,1,0]=4 4396 B10R1.4 Fc1ncccc1CCBr Amb33450421 [1,1,0,0,0,0|2,0,0]=4 4397 B10R1.4 Fc1ncccc1CCS Amb33376783 [1,1,0,0,0,0|1,1,0]=4 4398 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 4399 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 4400 B10R1.4 N#CCc1ccccc1F Amb2688304 [1,1,0,0,0,0|1,0,1]=4 4401 B10R1.4 N#CCc1ccccc1I Amb3939789 [1,1,0,0,0,0|1,0,1]=4 4402 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 4403 B10R1.4 N#CCc1ccccc1N Amb3997244 [1,1,0,0,0,0|1,0,1]=4 4404 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 4405 B10R1.4 N#CCc1ccccc1S Amb27490861 [1,1,0,0,0,0|1,0,1]=4 4406 B10R1.4 N#COc1ccccc1Br Amb27776524 [1,1,0,0,0,0|1,0,1]=4 4407 B10R1.4 N#COc1ccccc1Cl Amb27217590 [1,1,0,0,0,0|1,0,1]=4 4408 B10R1.4 N=C1C=CC=CN1CCO Amb18548415 [1,1,0,0,0,0|1,0,0]=3 4409 B10R1.4 N=CCc1ccccc1N Amb27175164 [1,1,0,0,0,0|1,0,1]=4 4410 B10R1.4 NCCN1C=CC=CC1=O Amb18535437 [1,1,0,0,0,0|2,0,0]=4 4411 B10R1.4 NCCN1C=CC=CC1=O Amb19514535 [1,1,0,0,0,0|2,0,0]=4 4412 B10R1.4 NCCN1C=CC=CC1=O Amb20668789 [1,1,0,0,0,0|2,0,0]=4 4413 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,0]=3 4414 B10R1.4 NCCc1ccccc1Br Amb4605963 [1,1,0,0,0,0|1,0,0]=3 4415 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,0]=3 4416 B10R1.4 NCCc1ccccc1Cl Amb2686343 [1,1,0,0,0,0|1,0,0]=3 4417 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,0]=3 4418 B10R1.4 NCCc1ccccc1F Amb421247 [1,1,0,0,0,0|1,0,0]=3 4419 B10R1.4 NCCc1ccccc1I Amb27796258 [1,1,0,0,0,0|1,0,0]=3 4420 B10R1.4 NCCc1ccccc1N Amb8631277 [1,1,0,0,0,0|1,0,0]=3 4421 B10R1.4 NCCc1ccccc1N Amb8631278 [1,1,0,0,0,0|1,0,0]=3 4422 B10R1.4 NCCc1ccccc1O Amb33549438 [1,1,0,0,0,0|1,0,0]=3 4423 B10R1.4 NCCc1ccccc1O Amb6246475 [1,1,0,0,0,0|1,0,0]=3 4424 B10R1.4 NCCc1cccnc1Br Amb25190186 [1,1,0,0,0,0|2,0,0]=4 4425 B10R1.4 NCCc1cccnc1Cl Amb24551153 [1,1,0,0,0,0|2,0,0]=4 4426 B10R1.4 NCCc1cccnc1Cl Amb33299325 [1,1,0,0,0,0|2,0,0]=4 4427 B10R1.4 NCCc1cccnc1F Amb24062493 [1,1,0,0,0,0|2,0,0]=4 4428 B10R1.4 NCCc1cccnc1N Amb25714008 [1,1,0,0,0,0|2,0,0]=4 4429 B10R1.4 NCCc1cccnc1O Amb26550960 [1,1,0,0,0,0|2,0,0]=4 4430 B10R1.4 NCCc1ccncc1Br Amb26565968 [1,1,0,0,0,0|2,0,0]=4 4431 B10R1.4 NCCc1ccncc1Cl Amb23596506 [1,1,0,0,0,0|2,0,0]=4 4432 B10R1.4 NCCc1ccncc1F Amb24383725 [1,1,0,0,0,0|2,0,0]=4 4433 B10R1.4 NCCc1ccncc1N Amb28423471 [1,1,0,0,0,0|2,0,0]=4 4434 B10R1.4 NCCc1cnccc1Br Amb27793514 [1,1,0,0,0,0|2,0,0]=4 4435 B10R1.4 NCCc1cnccc1F Amb25721852 [1,1,0,0,0,0|2,0,0]=4 4436 B10R1.4 NCCc1ncccc1Br Amb24183541 [1,1,0,0,0,0|2,0,0]=4 4437 B10R1.4 NCCc1ncccc1Cl Amb18200051 [1,1,0,0,0,0|2,0,0]=4 4438 B10R1.4 NCCc1ncccc1F Amb33537364 [1,1,0,0,0,0|2,0,0]=4 4439 B10R1.4 NCCc1ncccc1F Amb8011391 [1,1,0,0,0,0|2,0,0]=4 4440 B10R1.4 NCCc1ncccc1N Amb25915119 [1,1,0,0,0,0|2,0,0]=4 4441 B10R1.4 NCCc1ncccc1O Amb26588910 [1,1,0,0,0,0|2,0,0]=4 4442 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 4443 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 4444 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 4445 B10R1.4 NNCc1ccccc1Cl Amb4008405 [1,1,0,0,0,0|2,0,0]=4 4446 B10R1.4 NNCc1ccccc1Cl Amb5400451 [1,1,0,0,0,0|2,0,0]=4 4447 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 4448 B10R1.4 NNCc1ccccc1F Amb33553561 [1,1,0,0,0,0|2,0,0]=4 4449 B10R1.4 NNCc1ccccc1F Amb6247906 [1,1,0,0,0,0|2,0,0]=4 4450 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 4451 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 4452 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 4453 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 4454 B10R1.4 NOCc1ccccc1Cl Amb8471898 [1,1,0,0,0,0|2,0,0]=4 4455 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 4456 B10R1.4 NOCc1ccccc1F Amb8471897 [1,1,0,0,0,0|2,0,0]=4 4457 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 4458 B10R1.4 NOCc1ccccc1I Amb27445122 [1,1,0,0,0,0|2,0,0]=4 4459 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 4460 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,0]=3 4461 B10R1.4 Nc1ccccc1CCCl Amb28204640 [1,1,0,0,0,0|1,0,0]=3 4462 B10R1.4 Nc1ccccc1CCO Amb33733822 [1,1,0,0,0,0|0,0,0]=2 4463 B10R1.4 Nc1ccccc1CCO Amb4605841 [1,1,0,0,0,0|0,0,0]=2 4464 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,1,0,0,0,0|1,1,0]=4 4465 B10R1.4 Nc1ccccc1\C=N\O Amb2608949 [1,1,0,0,0,0|1,0,1]=4 4466 B10R1.4 Nc1cccnc1CCO Amb26398866 [1,1,0,0,0,0|1,0,0]=3 4467 B10R1.4 Nc1ccncc1CCF Amb26001806 [1,1,0,0,0,0|2,0,0]=4 4468 B10R1.4 Nc1ccncc1CCO Amb24062498 [1,1,0,0,0,0|1,0,0]=3 4469 B10R1.4 Nc1ncccc1CCCl Amb27256835 [1,1,0,0,0,0|2,0,0]=4 4470 B10R1.4 Nc1ncccc1CCO Amb21858404 [1,1,0,0,0,0|1,0,0]=3 4471 B10R1.4 O=C1C=CC=CN1CCBr Amb19514604 [1,1,0,0,0,0|2,0,0]=4 4472 B10R1.4 O=C1C=CC=CN1CCBr Amb33299911 [1,1,0,0,0,0|2,0,0]=4 4473 B10R1.4 O=C1C=CC=CN1CCCl Amb18787739 [1,1,0,0,0,0|2,0,0]=4 4474 B10R1.4 O=C1C=CC=CN1CCF Amb27426877 [1,1,0,0,0,0|2,0,0]=4 4475 B10R1.4 O=C1C=CC=CN1CCI Amb28254877 [1,1,0,0,0,0|2,0,0]=4 4476 B10R1.4 O=C1C=CC=CN1CCO Amb18041231 [1,1,0,0,0,0|1,0,0]=3 4477 B10R1.4 O=C1C=CC=NN1CCO Amb24591459 [1,1,0,0,0,0|2,0,0]=4 4478 B10R1.4 O=C1C=CN=CN1CCO Amb25263218 [1,1,0,0,0,0|2,0,0]=4 4479 B10R1.4 O=C1C=NC=CN1CCO Amb27206460 [1,1,0,0,0,0|2,0,0]=4 4480 B10R1.4 O=C1NC=CC=C1CCO Amb27241736 [1,1,0,0,0,0|1,0,0]=3 4481 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,2]=4 4482 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,2]=4 4483 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,2]=4 4484 B10R1.4 O=CCc1ccccc1O Amb6739922 [1,1,0,0,0,0|0,0,2]=4 4485 B10R1.4 O=COc1ccccc1Cl Amb27878912 [1,1,0,0,0,0|0,0,2]=4 4486 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|0,0,2]=4 4487 B10R1.4 O=c1ccccn1CCCl Amb22274576 [1,1,0,0,0,0|2,0,0]=4 4488 B10R1.4 OCCN1C=CC=CC1=S Amb25065240 [1,1,0,0,0,0|1,0,0]=3 4489 B10R1.4 OCCc1ccccc1Br Amb3939212 [1,1,0,0,0,0|0,0,0]=2 4490 B10R1.4 OCCc1ccccc1Cl Amb3939106 [1,1,0,0,0,0|0,0,0]=2 4491 B10R1.4 OCCc1ccccc1F Amb2688283 [1,1,0,0,0,0|0,0,0]=2 4492 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|0,0,0]=2 4493 B10R1.4 OCCc1ccccc1O Amb3940101 [1,1,0,0,0,0|0,0,0]=2 4494 B10R1.4 OCCc1cccnc1Br Amb27200606 [1,1,0,0,0,0|1,0,0]=3 4495 B10R1.4 OCCc1cccnc1Cl Amb28050705 [1,1,0,0,0,0|1,0,0]=3 4496 B10R1.4 OCCc1cccnc1F Amb24513826 [1,1,0,0,0,0|1,0,0]=3 4497 B10R1.4 OCCc1ccncc1Br Amb24482101 [1,1,0,0,0,0|1,0,0]=3 4498 B10R1.4 OCCc1ccncc1Cl Amb25890041 [1,1,0,0,0,0|1,0,0]=3 4499 B10R1.4 OCCc1ccncc1F Amb25776747 [1,1,0,0,0,0|1,0,0]=3 4500 B10R1.4 OCCc1cnccc1F Amb25865877 [1,1,0,0,0,0|1,0,0]=3 4501 B10R1.4 OCCc1ncccc1Br Amb22896751 [1,1,0,0,0,0|1,0,0]=3 4502 B10R1.4 OCCc1ncccc1Cl Amb28288389 [1,1,0,0,0,0|1,0,0]=3 4503 B10R1.4 OCCc1ncccc1F Amb26024787 [1,1,0,0,0,0|1,0,0]=3 4504 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|1,0,0]=3 4505 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|1,0,0]=3 4506 B10R1.4 ONCc1ccccc1Cl Amb32679300 [1,1,0,0,0,0|1,0,0]=3 4507 B10R1.4 ONCc1ccccc1F Amb27252972 [1,1,0,0,0,0|1,0,0]=3 4508 B10R1.4 ONCc1ccccc1O Amb25128279 [1,1,0,0,0,0|1,0,0]=3 4509 B10R1.4 ONCc1cccnc1Br Amb33387397 [1,1,0,0,0,0|2,0,0]=4 4510 B10R1.4 ONCc1cccnc1Cl Amb21847006 [1,1,0,0,0,0|2,0,0]=4 4511 B10R1.4 ONCc1cccnc1F Amb33378660 [1,1,0,0,0,0|2,0,0]=4 4512 B10R1.4 ONCc1ccncc1Br Amb33242569 [1,1,0,0,0,0|2,0,0]=4 4513 B10R1.4 ONCc1ccncc1Cl Amb33052755 [1,1,0,0,0,0|2,0,0]=4 4514 B10R1.4 ONCc1ccncc1F Amb33318031 [1,1,0,0,0,0|2,0,0]=4 4515 B10R1.4 ONCc1ncccc1Br Amb33485075 [1,1,0,0,0,0|2,0,0]=4 4516 B10R1.4 ONCc1ncccc1F Amb33420499 [1,1,0,0,0,0|2,0,0]=4 4517 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,1,0,0,0,0|1,0,1]=4 4518 B10R1.4 O\N=C/c1ccccc1Cl Amb28239726 [1,1,0,0,0,0|1,0,1]=4 4519 B10R1.4 O\N=C\c1ccccc1Br Amb33788652 [1,1,0,0,0,0|1,0,1]=4 4520 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [1,1,0,0,0,0|1,0,1]=4 4521 B10R1.4 O\N=C\c1ccccc1F Amb30585239 [1,1,0,0,0,0|1,0,1]=4 4522 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [1,1,0,0,0,0|1,0,1]=4 4523 B10R1.4 O\N=C\c1ccccc1O Amb6608695 [1,1,0,0,0,0|1,0,1]=4 4524 B10R1.4 Oc1ccccc1CCBr Amb33549255 [1,1,0,0,0,0|1,0,0]=3 4525 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,0]=3 4526 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|0,1,0]=3 4527 B10R1.4 Oc1ccccc1SCCl Amb28204207 [1,1,0,0,0,0|1,1,0]=4 4528 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|0,1,0]=3 4529 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|0,1,0]=3 4530 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|0,1,0]=3 4531 B10R1.4 SCCc1cccnc1Br Amb33388044 [1,1,0,0,0,0|1,1,0]=4 4532 B10R1.4 SCCc1cccnc1Cl Amb33257708 [1,1,0,0,0,0|1,1,0]=4 4533 B10R1.4 SCCc1ccncc1Br Amb33389013 [1,1,0,0,0,0|1,1,0]=4 4534 B10R1.4 SCCc1ccncc1Cl Amb33413845 [1,1,0,0,0,0|1,1,0]=4 4535 B10R1.4 SCCc1ncccc1Br Amb33336357 [1,1,0,0,0,0|1,1,0]=4 4536 B10R1.4 Sc1ccccc1CCBr Amb27450103 [1,1,0,0,0,0|1,0,0]=3 4537 B10R1.4 Sc1ccccc1CCCl Amb27776252 [1,1,0,0,0,0|1,0,0]=3 4538 B10R1.4 [C-]#[N+]Cc1ccccc1Br Amb3973085 [1,1,0,0,0,0|2,0,0]=4 4539 B10R1.4 [C-]#[N+]Cc1ccccc1C Amb2689349 [1,1,0,0,0,0|2,0,0]=4 4540 B10R1.4 [C-]#[N+]Cc1ccccc1Cl Amb2685776 [1,1,0,0,0,0|2,0,0]=4 4541 B10R1.4 [C-]#[N+]Cc1ccccc1F Amb2688050 [1,1,0,0,0,0|2,0,0]=4 4542 B10R1.4 [C-]#[N+]Cc1ccccc1O Amb28048077 [1,1,0,0,0,0|2,0,0]=4 4543 B10R1.4 [NH3+]CCc1ccccc1Cl Amb33512987 [1,1,0,0,0,0|1,0,0]=3 4544 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 4545 B10R1.4 [O-][n+]1ccccc1CCO Amb541137 [1,1,0,0,0,0|1,0,0]=3 4546 B10R1.10 BrCCc1cccc(Br)c1 Amb18048758 [1,1,0,0,0,0|1,0,0]=3 4547 B10R1.10 BrCCc1cccc(Br)n1 Amb33242100 [1,1,0,0,0,0|2,0,0]=4 4548 B10R1.10 BrCCc1cncc(Br)c1 Amb25147780 [1,1,0,0,0,0|2,0,0]=4 4549 B10R1.10 C#CCc1cccc(Br)c1 Amb27148208 [1,1,0,0,0,0|1,0,1]=4 4550 B10R1.10 C#CCc1cccc(C)c1 Amb33429151 [1,1,0,0,0,0|1,0,1]=4 4551 B10R1.10 C#CCc1cccc(Cl)c1 Amb26953104 [1,1,0,0,0,0|1,0,1]=4 4552 B10R1.10 C#CCc1cccc(F)c1 Amb27405697 [1,1,0,0,0,0|1,0,1]=4 4553 B10R1.10 C#CCc1cccc(I)c1 Amb26078060 [1,1,0,0,0,0|1,0,1]=4 4554 B10R1.10 C#CCc1cccc(O)c1 Amb33310924 [1,1,0,0,0,0|1,0,1]=4 4555 B10R1.10 C#NCc1cccc(Br)c1 Amb31112142 [1,1,0,0,0,0|2,0,0]=4 4556 B10R1.10 C#NCc1cccc(C)c1 Amb31132459 [1,1,0,0,0,0|2,0,0]=4 4557 B10R1.10 C#NCc1cccc(Cl)c1 Amb31111983 [1,1,0,0,0,0|2,0,0]=4 4558 B10R1.10 C#NCc1cccc(F)c1 Amb31132463 [1,1,0,0,0,0|2,0,0]=4 4559 B10R1.10 C=CCc1cccc(Br)c1 Amb6298947 [1,1,0,0,0,0|1,0,1]=4 4560 B10R1.10 C=CCc1cccc(C)c1 Amb2689628 [1,1,0,0,0,0|1,0,1]=4 4561 B10R1.10 C=CCc1cccc(Cl)c1 Amb2686405 [1,1,0,0,0,0|1,0,1]=4 4562 B10R1.10 C=CCc1cccc(F)c1 Amb2688385 [1,1,0,0,0,0|1,0,1]=4 4563 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|1,0,1]=4 4564 B10R1.10 C=CCc1cccc(N)c1 Amb32698606 [1,1,0,0,0,0|1,0,1]=4 4565 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|1,0,1]=4 4566 B10R1.10 C=COc1cccc(C)c1 Amb17674187 [1,1,0,0,0,0|0,0,2]=4 4567 B10R1.10 C=COc1cccc(F)c1 Amb27869917 [1,1,0,0,0,0|0,0,2]=4 4568 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|0,0,2]=4 4569 B10R1.10 CC#Cc1cccc(Br)c1 Amb22491725 [1,1,0,0,0,0|1,0,1]=4 4570 B10R1.10 CCCc1cc(Br)ccn1 Amb10599773 [1,1,0,0,0,0|2,0,0]=4 4571 B10R1.10 CCCc1cc(C)ccn1 Amb25844521 [1,1,0,0,0,0|2,0,0]=4 4572 B10R1.10 CCCc1cc(F)ccn1 Amb24318797 [1,1,0,0,0,0|2,0,0]=4 4573 B10R1.10 CCCc1cc(N)ccn1 Amb10599774 [1,1,0,0,0,0|2,0,0]=4 4574 B10R1.10 CCCc1cc(O)ccn1 Amb10599775 [1,1,0,0,0,0|2,0,0]=4 4575 B10R1.10 CCCc1cccc(Br)c1 Amb25736130 [1,1,0,0,0,0|1,0,0]=3 4576 B10R1.10 CCCc1cccc(Br)n1 Amb10600122 [1,1,0,0,0,0|2,0,0]=4 4577 B10R1.10 CCCc1cccc(C)c1 Amb22232362 [1,1,0,0,0,0|1,0,0]=3 4578 B10R1.10 CCCc1cccc(Cl)c1 Amb8393606 [1,1,0,0,0,0|1,0,0]=3 4579 B10R1.10 CCCc1cccc(Cl)n1 Amb27425089 [1,1,0,0,0,0|2,0,0]=4 4580 B10R1.10 CCCc1cccc(F)n1 Amb24319133 [1,1,0,0,0,0|2,0,0]=4 4581 B10R1.10 CCCc1cccc(N)c1 Amb18643014 [1,1,0,0,0,0|1,0,0]=3 4582 B10R1.10 CCCc1cccc(N)c1 Amb33172785 [1,1,0,0,0,0|1,0,0]=3 4583 B10R1.10 CCCc1cccc(N)n1 Amb2694190 [1,1,0,0,0,0|2,0,0]=4 4584 B10R1.10 CCCc1cccc(O)c1 Amb3941016 [1,1,0,0,0,0|1,0,0]=3 4585 B10R1.10 CCCc1cccc(O)n1 Amb10600153 [1,1,0,0,0,0|2,0,0]=4 4586 B10R1.10 CCCc1ccnc(Br)c1 Amb10599856 [1,1,0,0,0,0|2,0,0]=4 4587 B10R1.10 CCCc1ccnc(Cl)c1 Amb28125661 [1,1,0,0,0,0|2,0,0]=4 4588 B10R1.10 CCCc1ccnc(F)c1 Amb27812043 [1,1,0,0,0,0|2,0,0]=4 4589 B10R1.10 CCCc1ccnc(N)c1 Amb2694181 [1,1,0,0,0,0|2,0,0]=4 4590 B10R1.10 CCCc1ccnc(O)c1 Amb10599858 [1,1,0,0,0,0|2,0,0]=4 4591 B10R1.10 CCCc1cncc(Br)c1 Amb20617637 [1,1,0,0,0,0|2,0,0]=4 4592 B10R1.10 CCCc1cncc(C)c1 Amb27839178 [1,1,0,0,0,0|2,0,0]=4 4593 B10R1.10 CCCc1cncc(N)c1 Amb18832432 [1,1,0,0,0,0|2,0,0]=4 4594 B10R1.10 CCCc1cncc(O)c1 Amb20617709 [1,1,0,0,0,0|2,0,0]=4 4595 B10R1.10 CCCc1cncc(S)c1 Amb33276296 [1,1,0,0,0,0|2,0,0]=4 4596 B10R1.10 CCNc1cc(C)ccn1 Amb18283607 [1,1,0,0,0,0|2,0,0]=4 4597 B10R1.10 CCNc1cc(Cl)ccn1 Amb15692076 [1,1,0,0,0,0|2,0,0]=4 4598 B10R1.10 CCNc1cc(N)ccn1 Amb17334158 [1,1,0,0,0,0|2,0,0]=4 4599 B10R1.10 CCNc1ccc[n+]([O-])c1 Amb27770407 [1,1,0,0,0,0|2,0,0]=4 4600 B10R1.10 CCNc1cccc(Br)c1 Amb6696674 [1,1,0,0,0,0|1,0,0]=3 4601 B10R1.10 CCNc1cccc(Br)c1 Amb7969585 [1,1,0,0,0,0|1,0,0]=3 4602 B10R1.10 CCNc1cccc(Br)n1 Amb22271124 [1,1,0,0,0,0|2,0,0]=4 4603 B10R1.10 CCNc1cccc(Br)n1 Amb22411595 [1,1,0,0,0,0|2,0,0]=4 4604 B10R1.10 CCNc1cccc(C)c1 Amb4440919 [1,1,0,0,0,0|1,0,0]=3 4605 B10R1.10 CCNc1cccc(C)c1 Amb6540783 [1,1,0,0,0,0|1,0,0]=3 4606 B10R1.10 CCNc1cccc(C)n1 Amb10553057 [1,1,0,0,0,0|2,0,0]=4 4607 B10R1.10 CCNc1cccc(Cl)c1 Amb6695730 [1,1,0,0,0,0|1,0,0]=3 4608 B10R1.10 CCNc1cccc(F)c1 Amb10609458 [1,1,0,0,0,0|1,0,0]=3 4609 B10R1.10 CCNc1cccc(F)c1 Amb6695887 [1,1,0,0,0,0|1,0,0]=3 4610 B10R1.10 CCNc1cccc(F)n1 Amb18951804 [1,1,0,0,0,0|2,0,0]=4 4611 B10R1.10 CCNc1cccc(I)c1 Amb9203673 [1,1,0,0,0,0|1,0,0]=3 4612 B10R1.10 CCNc1cccc(N)c1 Amb8825439 [1,1,0,0,0,0|1,0,0]=3 4613 B10R1.10 CCNc1cccc(O)c1 Amb22168804 [1,1,0,0,0,0|1,0,0]=3 4614 B10R1.10 CCNc1cccc(O)c1 Amb6734927 [1,1,0,0,0,0|1,0,0]=3 4615 B10R1.10 CCNc1ccnc(Cl)c1 Amb13952186 [1,1,0,0,0,0|2,0,0]=4 4616 B10R1.10 CCNc1ccnc(N)c1 Amb27619768 [1,1,0,0,0,0|2,0,0]=4 4617 B10R1.10 CCNc1cncc(Cl)c1 Amb29849410 [1,1,0,0,0,0|2,0,0]=4 4618 B10R1.10 CCNc1cncc(O)c1 Amb27629206 [1,1,0,0,0,0|2,0,0]=4 4619 B10R1.10 CCOC1=CC(=O)NC=N1 Amb24356773 [1,1,0,0,0,0|2,0,0]=4 4620 B10R1.10 CCOC1=CC(=S)NC=N1 Amb24505286 [1,1,0,0,0,0|2,0,0]=4 4621 B10R1.10 CCOC1=NC(=S)NC=C1 Amb24480619 [1,1,0,0,0,0|2,0,0]=4 4622 B10R1.10 CCOc1cc(Br)ccn1 Amb10576613 [1,1,0,0,0,0|1,0,0]=3 4623 B10R1.10 CCOc1cc(Br)ncn1 Amb27462059 [1,1,0,0,0,0|2,0,0]=4 4624 B10R1.10 CCOc1cc(C)ccn1 Amb2795401 [1,1,0,0,0,0|1,0,0]=3 4625 B10R1.10 CCOc1cc(C)ncn1 Amb8386958 [1,1,0,0,0,0|2,0,0]=4 4626 B10R1.10 CCOc1cc(Cl)ccn1 Amb19957988 [1,1,0,0,0,0|1,0,0]=3 4627 B10R1.10 CCOc1cc(Cl)ncn1 Amb10576559 [1,1,0,0,0,0|2,0,0]=4 4628 B10R1.10 CCOc1cc(F)ccn1 Amb24317829 [1,1,0,0,0,0|1,0,0]=3 4629 B10R1.10 CCOc1cc(I)ccn1 Amb22498330 [1,1,0,0,0,0|1,0,0]=3 4630 B10R1.10 CCOc1cc(N)ccn1 Amb2610086 [1,1,0,0,0,0|1,0,0]=3 4631 B10R1.10 CCOc1cc(N)ncn1 Amb18854351 [1,1,0,0,0,0|2,0,0]=4 4632 B10R1.10 CCOc1ccc[n+]([O-])c1 Amb25206359 [1,1,0,0,0,0|1,0,0]=3 4633 B10R1.10 CCOc1cccc(Br)c1 Amb3938998 [1,1,0,0,0,0|0,0,0]=2 4634 B10R1.10 CCOc1cccc(Br)n1 Amb8438959 [1,1,0,0,0,0|1,0,0]=3 4635 B10R1.10 CCOc1cccc(C)n1 Amb2795402 [1,1,0,0,0,0|1,0,0]=3 4636 B10R1.10 CCOc1cccc(Cl)n1 Amb3939997 [1,1,0,0,0,0|1,0,0]=3 4637 B10R1.10 CCOc1cccc(F)c1 Amb2684175 [1,1,0,0,0,0|0,0,0]=2 4638 B10R1.10 CCOc1cccc(F)n1 Amb33537560 [1,1,0,0,0,0|1,0,0]=3 4639 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [1,1,0,0,0,0|0,0,0]=2 4640 B10R1.10 CCOc1cccc(N)c1 Amb1124598 [1,1,0,0,0,0|0,0,0]=2 4641 B10R1.10 CCOc1cccc(N)n1 Amb2609847 [1,1,0,0,0,0|1,0,0]=3 4642 B10R1.10 CCOc1cccc(N)n1 Amb32668102 [1,1,0,0,0,0|1,0,0]=3 4643 B10R1.10 CCOc1cccc(O)c1 Amb2720441 [1,1,0,0,0,0|0,0,0]=2 4644 B10R1.10 CCOc1cccc(O)n1 Amb28049436 [1,1,0,0,0,0|1,0,0]=3 4645 B10R1.10 CCOc1cccc(S)c1 Amb10070967 [1,1,0,0,0,0|0,0,0]=2 4646 B10R1.10 CCOc1ccnc(Br)c1 Amb8438933 [1,1,0,0,0,0|1,0,0]=3 4647 B10R1.10 CCOc1ccnc(C)c1 Amb24687076 [1,1,0,0,0,0|1,0,0]=3 4648 B10R1.10 CCOc1ccnc(C)n1 Amb2610087 [1,1,0,0,0,0|2,0,0]=4 4649 B10R1.10 CCOc1ccnc(Cl)c1 Amb8438934 [1,1,0,0,0,0|1,0,0]=3 4650 B10R1.10 CCOc1ccnc(Cl)n1 Amb2793543 [1,1,0,0,0,0|2,0,0]=4 4651 B10R1.10 CCOc1ccnc(F)c1 Amb15691032 [1,1,0,0,0,0|1,0,0]=3 4652 B10R1.10 CCOc1ccnc(F)n1 Amb35670272 [1,1,0,0,0,0|2,0,0]=4 4653 B10R1.10 CCOc1ccnc(I)c1 Amb27230249 [1,1,0,0,0,0|1,0,0]=3 4654 B10R1.10 CCOc1ccnc(N)c1 Amb2610118 [1,1,0,0,0,0|1,0,0]=3 4655 B10R1.10 CCOc1ccnc(N)n1 Amb21984141 [1,1,0,0,0,0|2,0,0]=4 4656 B10R1.10 CCOc1ccnc(O)c1 Amb8438990 [1,1,0,0,0,0|1,0,0]=3 4657 B10R1.10 CCOc1ccnc(O)n1 Amb2609554 [1,1,0,0,0,0|2,0,0]=4 4658 B10R1.10 CCOc1ccnc([O-])n1 Amb2609555 [1,1,0,0,0,0|2,0,0]=4 4659 B10R1.10 CCOc1cncc(Br)c1 Amb15691049 [1,1,0,0,0,0|1,0,0]=3 4660 B10R1.10 CCOc1cncc(Br)n1 Amb10600298 [1,1,0,0,0,0|2,0,0]=4 4661 B10R1.10 CCOc1cncc(C)c1 Amb24350527 [1,1,0,0,0,0|1,0,0]=3 4662 B10R1.10 CCOc1cncc(C)n1 Amb20621608 [1,1,0,0,0,0|2,0,0]=4 4663 B10R1.10 CCOc1cncc(Cl)n1 Amb6255033 [1,1,0,0,0,0|2,0,0]=4 4664 B10R1.10 CCOc1cncc(F)n1 Amb35700944 [1,1,0,0,0,0|2,0,0]=4 4665 B10R1.10 CCOc1cncc(I)c1 Amb26504467 [1,1,0,0,0,0|1,0,0]=3 4666 B10R1.10 CCOc1cncc(I)n1 Amb28050418 [1,1,0,0,0,0|2,0,0]=4 4667 B10R1.10 CCOc1cncc(N)c1 Amb8438993 [1,1,0,0,0,0|1,0,0]=3 4668 B10R1.10 CCOc1cncc(N)n1 Amb33544277 [1,1,0,0,0,0|2,0,0]=4 4669 B10R1.10 CCOc1cncc(O)c1 Amb23455720 [1,1,0,0,0,0|1,0,0]=3 4670 B10R1.10 CCOc1cnnc(Cl)c1 Amb22276390 [1,1,0,0,0,0|2,0,0]=4 4671 B10R1.10 CCOc1nccc(Br)n1 Amb10599662 [1,1,0,0,0,0|2,0,0]=4 4672 B10R1.10 CCOc1nccc(Cl)n1 Amb10597610 [1,1,0,0,0,0|2,0,0]=4 4673 B10R1.10 CCOc1nccc(I)n1 Amb27970253 [1,1,0,0,0,0|2,0,0]=4 4674 B10R1.10 CCOc1nccc(N)n1 Amb8438929 [1,1,0,0,0,0|2,0,0]=4 4675 B10R1.10 CCSc1cc(C)ccn1 Amb24480868 [1,1,0,0,0,0|1,1,0]=4 4676 B10R1.10 CCSc1cccc(Br)c1 Amb10067418 [1,1,0,0,0,0|0,1,0]=3 4677 B10R1.10 CCSc1cccc(C)c1 Amb25328608 [1,1,0,0,0,0|0,1,0]=3 4678 B10R1.10 CCSc1cccc(Cl)c1 Amb26318573 [1,1,0,0,0,0|0,1,0]=3 4679 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [1,1,0,0,0,0|0,1,0]=3 4680 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [1,1,0,0,0,0|0,1,0]=3 4681 B10R1.10 CCSc1cccc(N)n1 Amb27873535 [1,1,0,0,0,0|1,1,0]=4 4682 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [1,1,0,0,0,0|0,1,0]=3 4683 B10R1.10 CCSc1cccc(O)n1 Amb18644748 [1,1,0,0,0,0|1,1,0]=4 4684 B10R1.10 CCSc1ccnc(C)c1 Amb28252456 [1,1,0,0,0,0|1,1,0]=4 4685 B10R1.10 CCSc1ccnc(Cl)c1 Amb19149189 [1,1,0,0,0,0|1,1,0]=4 4686 B10R1.10 CNCc1cccc(Br)c1 Amb1114712 [1,1,0,0,0,0|2,0,0]=4 4687 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|2,0,0]=4 4688 B10R1.10 CNCc1cccc(C)c1 Amb33536586 [1,1,0,0,0,0|2,0,0]=4 4689 B10R1.10 CNCc1cccc(Cl)c1 Amb1648830 [1,1,0,0,0,0|2,0,0]=4 4690 B10R1.10 CNCc1cccc(F)c1 Amb1647905 [1,1,0,0,0,0|2,0,0]=4 4691 B10R1.10 CNCc1cccc(F)c1 Amb30625686 [1,1,0,0,0,0|2,0,0]=4 4692 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|2,0,0]=4 4693 B10R1.10 CNCc1cccc(N)c1 Amb7173577 [1,1,0,0,0,0|2,0,0]=4 4694 B10R1.10 CNCc1cccc(O)c1 Amb1131158 [1,1,0,0,0,0|2,0,0]=4 4695 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|2,0,0]=4 4696 B10R1.10 CNCc1cccc(S)c1 Amb27598823 [1,1,0,0,0,0|2,0,0]=4 4697 B10R1.10 CNNc1cccc(Cl)c1 Amb27445146 [1,1,0,0,0,0|2,0,0]=4 4698 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|2,0,0]=4 4699 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|2,0,0]=4 4700 B10R1.10 COCc1cccc(N)c1 Amb29847725 [1,1,0,0,0,0|2,0,0]=4 4701 B10R1.10 COCc1cccc(N)c1 Amb6250686 [1,1,0,0,0,0|2,0,0]=4 4702 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|2,0,0]=4 4703 B10R1.10 COCc1cccc(S)c1 Amb33226901 [1,1,0,0,0,0|2,0,0]=4 4704 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|2,0,0]=4 4705 B10R1.10 CSCc1cccc(Cl)c1 Amb27469155 [1,1,0,0,0,0|2,0,0]=4 4706 B10R1.10 CSCc1cccc(F)c1 Amb25978150 [1,1,0,0,0,0|2,0,0]=4 4707 B10R1.10 CSCc1cccc(I)c1 Amb32685575 [1,1,0,0,0,0|2,0,0]=4 4708 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|2,0,0]=4 4709 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|2,0,0]=4 4710 B10R1.10 C\C=C\c1cccc(N)c1 Amb27162745 [1,1,0,0,0,0|1,0,1]=4 4711 B10R1.10 C\N=C\c1cccc(C)c1 Amb24524529 [1,1,0,0,0,0|2,0,0]=4 4712 B10R1.10 C\N=C\c1cccc(O)c1 Amb19115409 [1,1,0,0,0,0|2,0,0]=4 4713 B10R1.10 Cc1cc(CCBr)ccn1 Amb33004944 [1,1,0,0,0,0|2,0,0]=4 4714 B10R1.10 Cc1cc(CCN)ccn1 Amb18203094 [1,1,0,0,0,0|2,0,0]=4 4715 B10R1.10 Cc1cc(CCN)ccn1 Amb33309646 [1,1,0,0,0,0|2,0,0]=4 4716 B10R1.10 Cc1cc(CCO)ccn1 Amb24568116 [1,1,0,0,0,0|1,0,0]=3 4717 B10R1.10 Cc1cc(CCS)ccn1 Amb32732786 [1,1,0,0,0,0|1,1,0]=4 4718 B10R1.10 Cc1cc(CNO)ccn1 Amb33449918 [1,1,0,0,0,0|2,0,0]=4 4719 B10R1.10 Cc1ccc[n+](CCO)c1 Amb27588939 [1,1,0,0,0,0|1,0,0]=3 4720 B10R1.10 Cc1cccc(CC#N)c1 Amb3939783 [1,1,0,0,0,0|1,0,1]=4 4721 B10R1.10 Cc1cccc(CC=O)c1 Amb16230453 [1,1,0,0,0,0|0,0,2]=4 4722 B10R1.10 Cc1cccc(CCBr)c1 Amb2685164 [1,1,0,0,0,0|1,0,0]=3 4723 B10R1.10 Cc1cccc(CCBr)n1 Amb2695438 [1,1,0,0,0,0|2,0,0]=4 4724 B10R1.10 Cc1cccc(CCBr)n1 Amb8630116 [1,1,0,0,0,0|2,0,0]=4 4725 B10R1.10 Cc1cccc(CCCl)c1 Amb18181942 [1,1,0,0,0,0|1,0,0]=3 4726 B10R1.10 Cc1cccc(CCI)c1 Amb26332327 [1,1,0,0,0,0|1,0,0]=3 4727 B10R1.10 Cc1cccc(CCN)c1 Amb1126573 [1,1,0,0,0,0|1,0,0]=3 4728 B10R1.10 Cc1cccc(CCN)c1 Amb13952645 [1,1,0,0,0,0|1,0,0]=3 4729 B10R1.10 Cc1cccc(CCN)n1 Amb1995202 [1,1,0,0,0,0|2,0,0]=4 4730 B10R1.10 Cc1cccc(CCN)n1 Amb33378982 [1,1,0,0,0,0|2,0,0]=4 4731 B10R1.10 Cc1cccc(CCN)n1 Amb33378983 [1,1,0,0,0,0|2,0,0]=4 4732 B10R1.10 Cc1cccc(CCO)c1 Amb3939096 [1,1,0,0,0,0|0,0,0]=2 4733 B10R1.10 Cc1cccc(CCO)n1 Amb8630091 [1,1,0,0,0,0|1,0,0]=3 4734 B10R1.10 Cc1cccc(CCS)c1 Amb17399939 [1,1,0,0,0,0|0,1,0]=3 4735 B10R1.10 Cc1cccc(CCS)n1 Amb24388552 [1,1,0,0,0,0|1,1,0]=4 4736 B10R1.10 Cc1cccc(CNN)c1 Amb1116333 [1,1,0,0,0,0|2,0,0]=4 4737 B10R1.10 Cc1cccc(CNN)c1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 4738 B10R1.10 Cc1cccc(CNN)c1 Amb33527910 [1,1,0,0,0,0|2,0,0]=4 4739 B10R1.10 Cc1cccc(CNO)c1 Amb25784359 [1,1,0,0,0,0|1,0,0]=3 4740 B10R1.10 Cc1cccc(CNO)n1 Amb33200760 [1,1,0,0,0,0|2,0,0]=4 4741 B10R1.10 Cc1cccc(CON)c1 Amb17091425 [1,1,0,0,0,0|2,0,0]=4 4742 B10R1.10 Cc1cccc(C[Zn]Cl)c1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 4743 B10R1.10 Cc1cccc(OCCl)c1 Amb27618304 [1,1,0,0,0,0|1,0,0]=3 4744 B10R1.10 Cc1cccc(SCCl)c1 Amb24423887 [1,1,0,0,0,0|1,1,0]=4 4745 B10R1.10 Cc1cccc(\C=N\O)c1 Amb18041948 [1,1,0,0,0,0|1,0,1]=4 4746 B10R1.10 Cc1ccnc(CCBr)c1 Amb26973853 [1,1,0,0,0,0|2,0,0]=4 4747 B10R1.10 Cc1ccnc(CCN)c1 Amb1995201 [1,1,0,0,0,0|2,0,0]=4 4748 B10R1.10 Cc1ccnc(CCO)c1 Amb25679639 [1,1,0,0,0,0|1,0,0]=3 4749 B10R1.10 Cc1ccnc(CCO)n1 Amb25943732 [1,1,0,0,0,0|2,0,0]=4 4750 B10R1.10 Cc1ccnc(CCS)c1 Amb33317782 [1,1,0,0,0,0|1,1,0]=4 4751 B10R1.10 Cc1ccnc(CNO)c1 Amb33316100 [1,1,0,0,0,0|2,0,0]=4 4752 B10R1.10 Cc1cncc(CCBr)c1 Amb24562207 [1,1,0,0,0,0|2,0,0]=4 4753 B10R1.10 Cc1cncc(CCN)c1 Amb18203095 [1,1,0,0,0,0|2,0,0]=4 4754 B10R1.10 Cc1cncc(CCO)c1 Amb2695472 [1,1,0,0,0,0|1,0,0]=3 4755 B10R1.10 Cc1cncc(CCO)n1 Amb26424098 [1,1,0,0,0,0|2,0,0]=4 4756 B10R1.10 Cc1cncc(CCS)c1 Amb33316890 [1,1,0,0,0,0|1,1,0]=4 4757 B10R1.10 Cc1cncc(CNO)c1 Amb33318691 [1,1,0,0,0,0|2,0,0]=4 4758 B10R1.10 ClCCc1cccc(Br)c1 Amb24502263 [1,1,0,0,0,0|1,0,0]=3 4759 B10R1.10 ClCCc1cccc(Cl)c1 Amb18185798 [1,1,0,0,0,0|1,0,0]=3 4760 B10R1.10 ClCCc1cccc(I)c1 Amb27771694 [1,1,0,0,0,0|1,0,0]=3 4761 B10R1.10 ClCOc1cccc(Br)c1 Amb26977241 [1,1,0,0,0,0|1,0,0]=3 4762 B10R1.10 ClCOc1cccc(Cl)c1 Amb24482267 [1,1,0,0,0,0|1,0,0]=3 4763 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [1,1,0,0,0,0|1,0,0]=3 4764 B10R1.10 ClCOc1cncc(Br)c1 Amb27472794 [1,1,0,0,0,0|2,0,0]=4 4765 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [1,1,0,0,0,0|1,1,0]=4 4766 B10R1.10 ClCSc1cccc(I)c1 Amb28041639 [1,1,0,0,0,0|1,1,0]=4 4767 B10R1.10 Cl[Zn]Cc1cccc(Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 4768 B10R1.10 Clc1cc(CCBr)ccn1 Amb33452116 [1,1,0,0,0,0|2,0,0]=4 4769 B10R1.10 Clc1cccc(CCBr)c1 Amb2685156 [1,1,0,0,0,0|1,0,0]=3 4770 B10R1.10 Clc1cccc(CCBr)n1 Amb33006804 [1,1,0,0,0,0|2,0,0]=4 4771 B10R1.10 Clc1cccc(CCI)c1 Amb27804535 [1,1,0,0,0,0|1,0,0]=3 4772 B10R1.10 Clc1ccnc(CCBr)c1 Amb33432278 [1,1,0,0,0,0|2,0,0]=4 4773 B10R1.10 Fc1cccc(CCBr)c1 Amb2688284 [1,1,0,0,0,0|1,0,0]=3 4774 B10R1.10 Fc1cccc(CCCl)c1 Amb9004325 [1,1,0,0,0,0|1,0,0]=3 4775 B10R1.10 Fc1cccc(CCI)c1 Amb25766475 [1,1,0,0,0,0|1,0,0]=3 4776 B10R1.10 Fc1cccc(CCS)c1 Amb17400006 [1,1,0,0,0,0|0,1,0]=3 4777 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 4778 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 4779 B10R1.10 Fc1cccc(OCCl)c1 Amb24401502 [1,1,0,0,0,0|1,0,0]=3 4780 B10R1.10 Fc1cccc(SCCl)c1 Amb26651935 [1,1,0,0,0,0|1,1,0]=4 4781 B10R1.10 Fc1ccnc(CCBr)c1 Amb33433794 [1,1,0,0,0,0|2,0,0]=4 4782 B10R1.10 Fc1ccnc(CCS)c1 Amb33325109 [1,1,0,0,0,0|1,1,0]=4 4783 B10R1.10 Fc1cncc(CCBr)c1 Amb25210409 [1,1,0,0,0,0|2,0,0]=4 4784 B10R1.10 Fc1cncc(CCCl)c1 Amb18797759 [1,1,0,0,0,0|2,0,0]=4 4785 B10R1.10 Fc1cncc(CCCl)c1 Amb33038080 [1,1,0,0,0,0|2,0,0]=4 4786 B10R1.10 Fc1cncc(CCS)c1 Amb33480664 [1,1,0,0,0,0|1,1,0]=4 4787 B10R1.10 Fc1cncc(OCCl)c1 Amb27830857 [1,1,0,0,0,0|2,0,0]=4 4788 B10R1.10 N#CCc1cccc(Br)c1 Amb1138679 [1,1,0,0,0,0|1,0,1]=4 4789 B10R1.10 N#CCc1cccc(Cl)c1 Amb1651451 [1,1,0,0,0,0|1,0,1]=4 4790 B10R1.10 N#CCc1cccc(F)c1 Amb528107 [1,1,0,0,0,0|1,0,1]=4 4791 B10R1.10 N#CCc1cccc(I)c1 Amb2688871 [1,1,0,0,0,0|1,0,1]=4 4792 B10R1.10 N#CCc1cccc(N)c1 Amb1215231 [1,1,0,0,0,0|1,0,1]=4 4793 B10R1.10 N#CCc1cccc(N)c1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 4794 B10R1.10 N#CCc1cccc(O)c1 Amb6298167 [1,1,0,0,0,0|1,0,1]=4 4795 B10R1.10 N#CCc1cccc(S)c1 Amb27265918 [1,1,0,0,0,0|1,0,1]=4 4796 B10R1.10 N#COc1cccc(Br)c1 Amb27795816 [1,1,0,0,0,0|1,0,1]=4 4797 B10R1.10 NCCC1=CC(=O)NC=C1 Amb22277083 [1,1,0,0,0,0|2,0,0]=4 4798 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22492307 [1,1,0,0,0,0|2,0,0]=4 4799 B10R1.10 NCCC1=CC=CC(=O)N1 Amb22587551 [1,1,0,0,0,0|2,0,0]=4 4800 B10R1.10 NCCc1cc(Br)ccn1 Amb25839315 [1,1,0,0,0,0|2,0,0]=4 4801 B10R1.10 NCCc1cc(Cl)ccn1 Amb26508063 [1,1,0,0,0,0|2,0,0]=4 4802 B10R1.10 NCCc1cc(F)ccn1 Amb27207092 [1,1,0,0,0,0|2,0,0]=4 4803 B10R1.10 NCCc1cccc(Br)c1 Amb22900947 [1,1,0,0,0,0|1,0,0]=3 4804 B10R1.10 NCCc1cccc(Br)c1 Amb6365736 [1,1,0,0,0,0|1,0,0]=3 4805 B10R1.10 NCCc1cccc(Br)n1 Amb21856983 [1,1,0,0,0,0|2,0,0]=4 4806 B10R1.10 NCCc1cccc(Cl)c1 Amb1212556 [1,1,0,0,0,0|1,0,0]=3 4807 B10R1.10 NCCc1cccc(Cl)n1 Amb21857735 [1,1,0,0,0,0|2,0,0]=4 4808 B10R1.10 NCCc1cccc(F)c1 Amb838765 [1,1,0,0,0,0|1,0,0]=3 4809 B10R1.10 NCCc1cccc(F)n1 Amb20669134 [1,1,0,0,0,0|2,0,0]=4 4810 B10R1.10 NCCc1cccc(I)c1 Amb25096322 [1,1,0,0,0,0|1,0,0]=3 4811 B10R1.10 NCCc1cccc(N)c1 Amb8631279 [1,1,0,0,0,0|1,0,0]=3 4812 B10R1.10 NCCc1cccc(N)c1 Amb8631364 [1,1,0,0,0,0|1,0,0]=3 4813 B10R1.10 NCCc1cccc(N)n1 Amb1100181 [1,1,0,0,0,0|2,0,0]=4 4814 B10R1.10 NCCc1cccc(O)c1 Amb2688778 [1,1,0,0,0,0|1,0,0]=3 4815 B10R1.10 NCCc1cccc(O)c1 Amb6243326 [1,1,0,0,0,0|1,0,0]=3 4816 B10R1.10 NCCc1cccc(O)c1 Amb6297567 [1,1,0,0,0,0|1,0,0]=3 4817 B10R1.10 NCCc1cccc(S)c1 Amb27862515 [1,1,0,0,0,0|1,0,0]=3 4818 B10R1.10 NCCc1cccn(=O)c1 Amb20621202 [1,1,0,0,0,0|2,0,0]=4 4819 B10R1.10 NCCc1ccnc(Br)c1 Amb26974330 [1,1,0,0,0,0|2,0,0]=4 4820 B10R1.10 NCCc1ccnc(Cl)c1 Amb26080294 [1,1,0,0,0,0|2,0,0]=4 4821 B10R1.10 NCCc1ccnc(F)c1 Amb25992462 [1,1,0,0,0,0|2,0,0]=4 4822 B10R1.10 NCCc1ccnc(N)c1 Amb28555504 [1,1,0,0,0,0|2,0,0]=4 4823 B10R1.10 NCCc1ccnc(N)c1 Amb33532630 [1,1,0,0,0,0|2,0,0]=4 4824 B10R1.10 NCCc1ccnc(O)c1 Amb32670801 [1,1,0,0,0,0|2,0,0]=4 4825 B10R1.10 NCCc1cncc(Br)c1 Amb27657044 [1,1,0,0,0,0|2,0,0]=4 4826 B10R1.10 NCCc1cncc(Cl)c1 Amb25889904 [1,1,0,0,0,0|2,0,0]=4 4827 B10R1.10 NCCc1cncc(F)c1 Amb18286591 [1,1,0,0,0,0|2,0,0]=4 4828 B10R1.10 NCCc1cncc(O)c1 Amb25744014 [1,1,0,0,0,0|2,0,0]=4 4829 B10R1.10 NNCc1cccc(Br)c1 Amb1119246 [1,1,0,0,0,0|2,0,0]=4 4830 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 4831 B10R1.10 NNCc1cccc(Br)c1 Amb33537274 [1,1,0,0,0,0|2,0,0]=4 4832 B10R1.10 NNCc1cccc(Cl)c1 Amb1111798 [1,1,0,0,0,0|2,0,0]=4 4833 B10R1.10 NNCc1cccc(Cl)c1 Amb13949121 [1,1,0,0,0,0|2,0,0]=4 4834 B10R1.10 NNCc1cccc(Cl)c1 Amb33714445 [1,1,0,0,0,0|2,0,0]=4 4835 B10R1.10 NNCc1cccc(F)c1 Amb1121411 [1,1,0,0,0,0|2,0,0]=4 4836 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 4837 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 4838 B10R1.10 NNCc1cccc(N)c1 Amb27810603 [1,1,0,0,0,0|2,0,0]=4 4839 B10R1.10 NNCc1cccc(O)c1 Amb3940160 [1,1,0,0,0,0|2,0,0]=4 4840 B10R1.10 NNCc1cccc(O)c1 Amb6336419 [1,1,0,0,0,0|2,0,0]=4 4841 B10R1.10 NOCc1cccc(Br)c1 Amb17091429 [1,1,0,0,0,0|2,0,0]=4 4842 B10R1.10 NOCc1cccc(Cl)c1 Amb17091428 [1,1,0,0,0,0|2,0,0]=4 4843 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 4844 B10R1.10 NOCc1cccc(F)c1 Amb17091426 [1,1,0,0,0,0|2,0,0]=4 4845 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 4846 B10R1.10 NOCc1cccc(I)c1 Amb27626521 [1,1,0,0,0,0|2,0,0]=4 4847 B10R1.10 NOCc1cccc(O)c1 Amb27476207 [1,1,0,0,0,0|2,0,0]=4 4848 B10R1.10 Nc1cc(CCCl)ccn1 Amb27256820 [1,1,0,0,0,0|2,0,0]=4 4849 B10R1.10 Nc1cc(CCO)ccn1 Amb33545323 [1,1,0,0,0,0|1,0,0]=3 4850 B10R1.10 Nc1cccc(CCF)c1 Amb26318675 [1,1,0,0,0,0|1,0,0]=3 4851 B10R1.10 Nc1cccc(CCO)c1 Amb21857105 [1,1,0,0,0,0|0,0,0]=2 4852 B10R1.10 Nc1cccc(CCO)n1 Amb24401500 [1,1,0,0,0,0|1,0,0]=3 4853 B10R1.10 Nc1ccnc(CCO)c1 Amb25027828 [1,1,0,0,0,0|1,0,0]=3 4854 B10R1.10 Nc1ccnc(CCO)n1 Amb24583224 [1,1,0,0,0,0|2,0,0]=4 4855 B10R1.10 O=C1C=CC=C(CCO)N1 Amb28049556 [1,1,0,0,0,0|1,0,0]=3 4856 B10R1.10 O=C1N=C(CCO)C=CN1 Amb24639313 [1,1,0,0,0,0|2,0,0]=4 4857 B10R1.10 O=C1N=CC=C(OCO)N1 Amb28252484 [1,1,0,0,0,0|2,0,0]=4 4858 B10R1.10 O=CCc1cccc(Br)c1 Amb16230449 [1,1,0,0,0,0|0,0,2]=4 4859 B10R1.10 O=CCc1cccc(Cl)c1 Amb10844835 [1,1,0,0,0,0|0,0,2]=4 4860 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,2]=4 4861 B10R1.10 O=CCc1cccc(O)c1 Amb17089543 [1,1,0,0,0,0|0,0,2]=4 4862 B10R1.10 OCCc1cc(Br)ccn1 Amb24065849 [1,1,0,0,0,0|1,0,0]=3 4863 B10R1.10 OCCc1cc(Cl)ccn1 Amb26631453 [1,1,0,0,0,0|1,0,0]=3 4864 B10R1.10 OCCc1cc(F)ccn1 Amb25032462 [1,1,0,0,0,0|1,0,0]=3 4865 B10R1.10 OCCc1cccc(Br)c1 Amb3939211 [1,1,0,0,0,0|0,0,0]=2 4866 B10R1.10 OCCc1cccc(Br)n1 Amb13883481 [1,1,0,0,0,0|1,0,0]=3 4867 B10R1.10 OCCc1cccc(Cl)c1 Amb3939105 [1,1,0,0,0,0|0,0,0]=2 4868 B10R1.10 OCCc1cccc(Cl)n1 Amb27478282 [1,1,0,0,0,0|1,0,0]=3 4869 B10R1.10 OCCc1cccc(F)c1 Amb3939215 [1,1,0,0,0,0|0,0,0]=2 4870 B10R1.10 OCCc1cccc(F)n1 Amb25076783 [1,1,0,0,0,0|1,0,0]=3 4871 B10R1.10 OCCc1cccc(I)c1 Amb24524319 [1,1,0,0,0,0|0,0,0]=2 4872 B10R1.10 OCCc1cccc(O)c1 Amb3940102 [1,1,0,0,0,0|0,0,0]=2 4873 B10R1.10 OCCc1cccc(S)c1 Amb27961582 [1,1,0,0,0,0|0,0,0]=2 4874 B10R1.10 OCCc1ccnc(Cl)c1 Amb22754705 [1,1,0,0,0,0|1,0,0]=3 4875 B10R1.10 OCCc1ccnc(F)c1 Amb27963558 [1,1,0,0,0,0|1,0,0]=3 4876 B10R1.10 OCCc1cncc(Br)c1 Amb25114229 [1,1,0,0,0,0|1,0,0]=3 4877 B10R1.10 OCCc1cncc(F)c1 Amb25872080 [1,1,0,0,0,0|1,0,0]=3 4878 B10R1.10 OCCc1nccc(O)n1 Amb24454001 [1,1,0,0,0,0|2,0,0]=4 4879 B10R1.10 OCNc1cccc(F)c1 Amb27168168 [1,1,0,0,0,0|1,0,0]=3 4880 B10R1.10 ONCc1cc(F)ccn1 Amb33415816 [1,1,0,0,0,0|2,0,0]=4 4881 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|1,0,0]=3 4882 B10R1.10 ONCc1cccc(Br)n1 Amb24647347 [1,1,0,0,0,0|2,0,0]=4 4883 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|1,0,0]=3 4884 B10R1.10 ONCc1cccc(Cl)n1 Amb33223269 [1,1,0,0,0,0|2,0,0]=4 4885 B10R1.10 ONCc1cccc(F)c1 Amb26060054 [1,1,0,0,0,0|1,0,0]=3 4886 B10R1.10 ONCc1cccc(I)c1 Amb28077250 [1,1,0,0,0,0|1,0,0]=3 4887 B10R1.10 ONCc1cccc(O)c1 Amb24524626 [1,1,0,0,0,0|1,0,0]=3 4888 B10R1.10 ONCc1cncc(Br)c1 Amb26848329 [1,1,0,0,0,0|2,0,0]=4 4889 B10R1.10 ONCc1cncc(F)c1 Amb33312713 [1,1,0,0,0,0|2,0,0]=4 4890 B10R1.10 O\N=C/c1cccc(Cl)c1 Amb28135506 [1,1,0,0,0,0|1,0,1]=4 4891 B10R1.10 O\N=C\c1cccc(Br)c1 Amb6297363 [1,1,0,0,0,0|1,0,1]=4 4892 B10R1.10 O\N=C\c1cccc(Cl)c1 Amb1776533 [1,1,0,0,0,0|1,0,1]=4 4893 B10R1.10 O\N=C\c1cccc(F)c1 Amb1152958 [1,1,0,0,0,0|1,0,1]=4 4894 B10R1.10 O\N=C\c1cccc(I)c1 Amb1831123 [1,1,0,0,0,0|1,0,1]=4 4895 B10R1.10 O\N=C\c1cccc(O)c1 Amb5837376 [1,1,0,0,0,0|1,0,1]=4 4896 B10R1.10 Oc1cccc(CCBr)c1 Amb18130690 [1,1,0,0,0,0|1,0,0]=3 4897 B10R1.10 Oc1cccc(CCF)c1 Amb27411445 [1,1,0,0,0,0|1,0,0]=3 4898 B10R1.10 Oc1cccc(CCI)c1 Amb27494566 [1,1,0,0,0,0|1,0,0]=3 4899 B10R1.10 Oc1cccc(CCS)c1 Amb33310795 [1,1,0,0,0,0|0,1,0]=3 4900 B10R1.10 Oc1cccc(SCCl)c1 Amb24368844 [1,1,0,0,0,0|1,1,0]=4 4901 B10R1.10 SCCc1cccc(Br)c1 Amb17404678 [1,1,0,0,0,0|0,1,0]=3 4902 B10R1.10 SCCc1cccc(Br)n1 Amb33433833 [1,1,0,0,0,0|1,1,0]=4 4903 B10R1.10 SCCc1cccc(Cl)c1 Amb17400375 [1,1,0,0,0,0|0,1,0]=3 4904 B10R1.10 SCCc1cccc(Cl)n1 Amb33222711 [1,1,0,0,0,0|1,1,0]=4 4905 B10R1.10 SCCc1cncc(Br)c1 Amb33389406 [1,1,0,0,0,0|1,1,0]=4 4906 B10R1.10 Sc1cccc(CCBr)c1 Amb27628134 [1,1,0,0,0,0|1,0,0]=3 4907 B10R1.10 [C-]#[N+]Cc1cccc(Br)c1 Amb3973086 [1,1,0,0,0,0|2,0,0]=4 4908 B10R1.10 [C-]#[N+]Cc1cccc(C)c1 Amb2689350 [1,1,0,0,0,0|2,0,0]=4 4909 B10R1.10 [C-]#[N+]Cc1cccc(Cl)c1 Amb2685777 [1,1,0,0,0,0|2,0,0]=4 4910 B10R1.10 [C-]#[N+]Cc1cccc(F)c1 Amb2688051 [1,1,0,0,0,0|2,0,0]=4 4911 B10R1.10 [NH3+]OCc1cccc(F)c1 Amb2424153 [1,1,0,0,0,0|2,0,0]=4 4912 B10R1.15 BP(CO)c1ccccc1 Amb27652937 [1,1,0,0,0,0|1,0,0]=3 4913 B10R1.15 B[PH](CO)c1ccccc1 Amb27826578 [1,1,0,0,0,0|1,0,0]=3 4914 B10R1.15 BrCC(Br)c1ccccc1 Amb8394124 [1,1,0,0,0,0|1,0,0]=3 4915 B10R1.15 C#CC(Br)c1ccccc1 Amb28121035 [1,1,0,0,0,0|1,0,1]=4 4916 B10R1.15 C#CC(C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|1,0,1]=4 4917 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|1,0,1]=4 4918 B10R1.15 C#CC(N)c1ccccc1 Amb33204420 [1,1,0,0,0,0|1,0,1]=4 4919 B10R1.15 C#CC(O)c1ccccc1 Amb2721623 [1,1,0,0,0,0|1,0,1]=4 4920 B10R1.15 C#C[C@@H](N)c1ccccc1 Amb27599946 [1,1,0,0,0,0|1,0,1]=4 4921 B10R1.15 C#C[C@@H](O)c1ccccc1 Amb10844978 [1,1,0,0,0,0|1,0,1]=4 4922 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|1,0,1]=4 4923 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [1,1,0,0,0,0|1,0,1]=4 4924 B10R1.15 C=C(CC)c1ccccn1 Amb24467663 [1,1,0,0,0,0|2,0,0]=4 4925 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [1,1,0,0,0,0|1,0,1]=4 4926 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [1,1,0,0,0,0|1,0,1]=4 4927 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [1,1,0,0,0,0|1,0,1]=4 4928 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [1,1,0,0,0,0|0,0,1]=3 4929 B10R1.15 C=C(CO)c1ccncc1 Amb25887623 [1,1,0,0,0,0|1,0,1]=4 4930 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [1,1,0,0,0,0|2,0,0]=4 4931 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [1,1,0,0,0,0|1,0,1]=4 4932 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [1,1,0,0,0,0|1,0,1]=4 4933 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [1,1,0,0,0,0|1,0,1]=4 4934 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|1,0,1]=4 4935 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|1,0,1]=4 4936 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|1,0,1]=4 4937 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [1,1,0,0,0,0|1,0,1]=4 4938 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|1,0,1]=4 4939 B10R1.15 CC(C#N)c1ccccc1 Amb2387010 [1,1,0,0,0,0|1,0,1]=4 4940 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [1,1,0,0,0,0|0,0,2]=4 4941 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [1,1,0,0,0,0|1,0,0]=3 4942 B10R1.15 CC(CBr)c1ccccn1 Amb27471389 [1,1,0,0,0,0|2,0,0]=4 4943 B10R1.15 CC(CBr)c1cccnc1 Amb33118517 [1,1,0,0,0,0|2,0,0]=4 4944 B10R1.15 CC(CBr)c1ccncc1 Amb26369737 [1,1,0,0,0,0|2,0,0]=4 4945 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [1,1,0,0,0,0|1,0,0]=3 4946 B10R1.15 CC(CCl)c1cccnc1 Amb24085112 [1,1,0,0,0,0|2,0,0]=4 4947 B10R1.15 CC(CCl)c1ccncc1 Amb27835971 [1,1,0,0,0,0|2,0,0]=4 4948 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [1,1,0,0,0,0|1,0,0]=3 4949 B10R1.15 CC(CI)c1ccccn1 Amb30010228 [1,1,0,0,0,0|2,0,0]=4 4950 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|1,0,0]=3 4951 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [1,1,0,0,0,0|1,0,0]=3 4952 B10R1.15 CC(CN)c1ccccn1 Amb33528304 [1,1,0,0,0,0|2,0,0]=4 4953 B10R1.15 CC(CN)c1cccnc1 Amb8950129 [1,1,0,0,0,0|2,0,0]=4 4954 B10R1.15 CC(CN)c1ccncc1 Amb32668866 [1,1,0,0,0,0|2,0,0]=4 4955 B10R1.15 CC(CN)c1ccncc1 Amb8950130 [1,1,0,0,0,0|2,0,0]=4 4956 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [1,1,0,0,0,0|0,0,0]=2 4957 B10R1.15 CC(CO)c1ccccn1 Amb22896757 [1,1,0,0,0,0|1,0,0]=3 4958 B10R1.15 CC(CO)c1cccnc1 Amb33745581 [1,1,0,0,0,0|1,0,0]=3 4959 B10R1.15 CC(CO)c1ccncc1 Amb24480432 [1,1,0,0,0,0|1,0,0]=3 4960 B10R1.15 CC(CO)c1cnccn1 Amb33746148 [1,1,0,0,0,0|2,0,0]=4 4961 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [1,1,0,0,0,0|0,1,0]=3 4962 B10R1.15 CC(CS)c1ccccn1 Amb29858764 [1,1,0,0,0,0|1,1,0]=4 4963 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [1,1,0,0,0,0|2,0,0]=4 4964 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [1,1,0,0,0,0|2,0,0]=4 4965 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [1,1,0,0,0,0|2,0,0]=4 4966 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [1,1,0,0,0,0|1,0,0]=3 4967 B10R1.15 CC(NO)c1ccccn1 Amb10605008 [1,1,0,0,0,0|2,0,0]=4 4968 B10R1.15 CC(NO)c1cccnc1 Amb10605009 [1,1,0,0,0,0|2,0,0]=4 4969 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [1,1,0,0,0,0|2,0,0]=4 4970 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|2,0,0]=4 4971 B10R1.15 CCC(=N)c1ccccn1 Amb28182447 [1,1,0,0,0,0|2,0,0]=4 4972 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [1,1,0,0,0,0|1,0,0]=3 4973 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [1,1,0,0,0,0|2,0,0]=4 4974 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [1,1,0,0,0,0|2,0,0]=4 4975 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,1,0,0,0,0|2,0,0]=4 4976 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [1,1,0,0,0,0|1,0,0]=3 4977 B10R1.15 CCC(Br)c1ccccn1 Amb27647660 [1,1,0,0,0,0|2,0,0]=4 4978 B10R1.15 CCC(Br)c1cccnc1 Amb24556035 [1,1,0,0,0,0|2,0,0]=4 4979 B10R1.15 CCC(Br)c1ccncc1 Amb27463363 [1,1,0,0,0,0|2,0,0]=4 4980 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [1,1,0,0,0,0|1,0,0]=3 4981 B10R1.15 CCC(C)c1ccccn1 Amb28145932 [1,1,0,0,0,0|2,0,0]=4 4982 B10R1.15 CCC(C)c1ccncc1 Amb26842817 [1,1,0,0,0,0|2,0,0]=4 4983 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [1,1,0,0,0,0|1,0,0]=3 4984 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|1,0,0]=3 4985 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [1,1,0,0,0,0|1,0,0]=3 4986 B10R1.15 CCC(N)c1ccccn1 Amb10607917 [1,1,0,0,0,0|2,0,0]=4 4987 B10R1.15 CCC(N)c1ccccn1 Amb22587075 [1,1,0,0,0,0|2,0,0]=4 4988 B10R1.15 CCC(N)c1cccnc1 Amb10607957 [1,1,0,0,0,0|2,0,0]=4 4989 B10R1.15 CCC(N)c1cccnc1 Amb30588534 [1,1,0,0,0,0|2,0,0]=4 4990 B10R1.15 CCC(N)c1ccncc1 Amb8009606 [1,1,0,0,0,0|2,0,0]=4 4991 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [1,1,0,0,0,0|1,0,0]=3 4992 B10R1.15 CCC(O)c1ccccn1 Amb26851902 [1,1,0,0,0,0|2,0,0]=4 4993 B10R1.15 CCC(O)c1cccnc1 Amb17231904 [1,1,0,0,0,0|2,0,0]=4 4994 B10R1.15 CCC(O)c1ccncc1 Amb16233288 [1,1,0,0,0,0|2,0,0]=4 4995 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [1,1,0,0,0,0|1,0,0]=3 4996 B10R1.15 CCN(C)c1ccccn1 Amb26564265 [1,1,0,0,0,0|2,0,0]=4 4997 B10R1.15 CCN(N)c1ccccc1 Amb836839 [1,1,0,0,0,0|1,0,0]=3 4998 B10R1.15 CCN(N)c1ccccn1 Amb18643189 [1,1,0,0,0,0|2,0,0]=4 4999 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [1,1,0,0,0,0|1,0,0]=3 5000 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,1,0,0,0,0|0,1,0]=3 5001 B10R1.15 CCS(=O)c1ccccn1 Amb28049400 [1,1,0,0,0,0|1,1,0]=4 5002 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [1,1,0,0,0,0|1,0,0]=3 5003 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|1,0,0]=3 5004 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [1,1,0,0,0,0|1,0,0]=3 5005 B10R1.15 CC[C@@H](N)c1ccccn1 Amb25797820 [1,1,0,0,0,0|2,0,0]=4 5006 B10R1.15 CC[C@@H](N)c1ccccn1 Amb30869540 [1,1,0,0,0,0|2,0,0]=4 5007 B10R1.15 CC[C@@H](N)c1ccncc1 Amb30647447 [1,1,0,0,0,0|2,0,0]=4 5008 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [1,1,0,0,0,0|1,0,0]=3 5009 B10R1.15 CC[C@@H](O)c1ccccn1 Amb25717055 [1,1,0,0,0,0|2,0,0]=4 5010 B10R1.15 CC[C@@H](O)c1cccnc1 Amb27161307 [1,1,0,0,0,0|2,0,0]=4 5011 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [1,1,0,0,0,0|1,0,0]=3 5012 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [1,1,0,0,0,0|1,0,0]=3 5013 B10R1.15 CC[C@H](C)c1ccccn1 Amb27407415 [1,1,0,0,0,0|2,0,0]=4 5014 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|1,0,0]=3 5015 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [1,1,0,0,0,0|1,0,0]=3 5016 B10R1.15 CC[C@H](N)c1ccccn1 Amb26961005 [1,1,0,0,0,0|2,0,0]=4 5017 B10R1.15 CC[C@H](N)c1ccccn1 Amb33802008 [1,1,0,0,0,0|2,0,0]=4 5018 B10R1.15 CC[C@H](N)c1ccccn1 Amb33872493 [1,1,0,0,0,0|2,0,0]=4 5019 B10R1.15 CC[C@H](N)c1cccnc1 Amb30647446 [1,1,0,0,0,0|2,0,0]=4 5020 B10R1.15 CC[C@H](N)c1ccncc1 Amb27404537 [1,1,0,0,0,0|2,0,0]=4 5021 B10R1.15 CC[C@H](N)c1ccncc1 Amb30647448 [1,1,0,0,0,0|2,0,0]=4 5022 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [1,1,0,0,0,0|1,0,0]=3 5023 B10R1.15 CC[C@H](O)c1ccccn1 Amb25910593 [1,1,0,0,0,0|2,0,0]=4 5024 B10R1.15 CC[C@H](O)c1cccnc1 Amb24432697 [1,1,0,0,0,0|2,0,0]=4 5025 B10R1.15 CC[C@H](O)c1ccncc1 Amb27861997 [1,1,0,0,0,0|2,0,0]=4 5026 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,1,0,0,0,0|2,0,0]=4 5027 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [1,1,0,0,0,0|2,0,0]=4 5028 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [1,1,0,0,0,0|2,0,0]=4 5029 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,1,0,0,0,0|2,0,0]=4 5030 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [1,1,0,0,0,0|2,0,0]=4 5031 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [1,1,0,0,0,0|2,0,0]=4 5032 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [1,1,0,0,0,0|2,0,0]=4 5033 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|2,0,0]=4 5034 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [1,1,0,0,0,0|2,0,0]=4 5035 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [1,1,0,0,0,0|2,0,0]=4 5036 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [1,1,0,0,0,0|2,0,0]=4 5037 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [1,1,0,0,0,0|2,0,0]=4 5038 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,1,0,0,0,0|2,0,0]=4 5039 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|2,0,0]=4 5040 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [1,1,0,0,0,0|1,1,0]=4 5041 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [1,1,0,0,0,0|1,0,0]=3 5042 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,1,0,0,0,0|2,0,0]=4 5043 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,1,0,0,0,0|2,0,0]=4 5044 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|0,0,2]=4 5045 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [1,1,0,0,0,0|1,0,0]=3 5046 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [1,1,0,0,0,0|1,0,0]=3 5047 B10R1.15 C[C@@H](CN)c1cccnc1 Amb33744398 [1,1,0,0,0,0|2,0,0]=4 5048 B10R1.15 C[C@@H](CN)c1ccncc1 Amb33727423 [1,1,0,0,0,0|2,0,0]=4 5049 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [1,1,0,0,0,0|0,0,0]=2 5050 B10R1.15 C[C@@H](CO)c1ccccn1 Amb28137345 [1,1,0,0,0,0|1,0,0]=3 5051 B10R1.15 C[C@@H](CO)c1cccnc1 Amb33746677 [1,1,0,0,0,0|1,0,0]=3 5052 B10R1.15 C[C@@H](CO)c1ccncc1 Amb33735556 [1,1,0,0,0,0|1,0,0]=3 5053 B10R1.15 C[C@@H](CO)c1cnccn1 Amb33748024 [1,1,0,0,0,0|2,0,0]=4 5054 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|2,0,0]=4 5055 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|1,0,0]=3 5056 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|1,0,0]=3 5057 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|2,0,0]=4 5058 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [1,1,0,0,0,0|2,0,0]=4 5059 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|0,0,2]=4 5060 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [1,1,0,0,0,0|1,0,0]=3 5061 B10R1.15 C[C@H](CN)c1cccnc1 Amb33740278 [1,1,0,0,0,0|2,0,0]=4 5062 B10R1.15 C[C@H](CN)c1ccncc1 Amb33747422 [1,1,0,0,0,0|2,0,0]=4 5063 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [1,1,0,0,0,0|0,0,0]=2 5064 B10R1.15 C[C@H](CO)c1cccnc1 Amb33738165 [1,1,0,0,0,0|1,0,0]=3 5065 B10R1.15 C[C@H](CO)c1ccncc1 Amb33730462 [1,1,0,0,0,0|1,0,0]=3 5066 B10R1.15 C[C@H](CO)c1cnccn1 Amb33744967 [1,1,0,0,0,0|2,0,0]=4 5067 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [1,1,0,0,0,0|2,0,0]=4 5068 B10R1.15 C[C@H](NO)c1cccnc1 Amb27242936 [1,1,0,0,0,0|2,0,0]=4 5069 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [1,1,0,0,0,0|2,0,0]=4 5070 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [1,1,0,0,0,0|2,0,0]=4 5071 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [1,1,0,0,0,0|1,0,1]=4 5072 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [1,1,0,0,0,0|1,0,1]=4 5073 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [1,1,0,0,0,0|1,0,1]=4 5074 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [1,1,0,0,0,0|1,0,1]=4 5075 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [1,1,0,0,0,0|1,0,1]=4 5076 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [1,1,0,0,0,0|1,0,1]=4 5077 B10R1.15 ClCC(Cl)c1ccccc1 Amb2720893 [1,1,0,0,0,0|1,0,0]=3 5078 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,0]=3 5079 B10R1.15 FC(CCl)c1ccccc1 Amb27596575 [1,1,0,0,0,0|1,0,0]=3 5080 B10R1.15 N#CC(Br)c1ccccc1 Amb9787616 [1,1,0,0,0,0|1,0,1]=4 5081 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|1,0,1]=4 5082 B10R1.15 N#CC(N)c1ccccc1 Amb3940545 [1,1,0,0,0,0|1,0,1]=4 5083 B10R1.15 N#CC(O)c1ccccc1 Amb3997186 [1,1,0,0,0,0|1,0,1]=4 5084 B10R1.15 N#CC([NH3+])c1ccccc1 Amb6365971 [1,1,0,0,0,0|1,0,1]=4 5085 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|1,0,1]=4 5086 B10R1.15 N#C[C@@H](N)c1ccccc1 Amb17399826 [1,1,0,0,0,0|1,0,1]=4 5087 B10R1.15 N#C[C@H](Cl)c1ccccc1 Amb27184041 [1,1,0,0,0,0|1,0,1]=4 5088 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|1,0,1]=4 5089 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [1,1,0,0,0,0|0,0,2]=4 5090 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [1,1,0,0,0,0|1,0,0]=3 5091 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [1,1,0,0,0,0|1,0,0]=3 5092 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [1,1,0,0,0,0|1,0,0]=3 5093 B10R1.15 NC(CF)c1cccnc1 Amb27251300 [1,1,0,0,0,0|2,0,0]=4 5094 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [1,1,0,0,0,0|0,0,0]=2 5095 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,1,0,0,0,0|1,0,0]=3 5096 B10R1.15 NC(CO)c1ccccn1 Amb18560041 [1,1,0,0,0,0|1,0,0]=3 5097 B10R1.15 NC(CO)c1cccnc1 Amb2683353 [1,1,0,0,0,0|1,0,0]=3 5098 B10R1.15 NC(CO)c1cccnc1 Amb32644753 [1,1,0,0,0,0|1,0,0]=3 5099 B10R1.15 NC(CO)c1cccnc1 Amb33548117 [1,1,0,0,0,0|1,0,0]=3 5100 B10R1.15 NC(CO)c1cccnn1 Amb27764341 [1,1,0,0,0,0|2,0,0]=4 5101 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,1,0,0,0,0|1,0,0]=3 5102 B10R1.15 NC(CO)c1ccncc1 Amb18561776 [1,1,0,0,0,0|1,0,0]=3 5103 B10R1.15 NC(CO)c1ccncn1 Amb25761050 [1,1,0,0,0,0|2,0,0]=4 5104 B10R1.15 NC(CO)c1ccnnc1 Amb27952935 [1,1,0,0,0,0|2,0,0]=4 5105 B10R1.15 NC(CO)c1cnccn1 Amb18832035 [1,1,0,0,0,0|2,0,0]=4 5106 B10R1.15 NC(CO)c1cncnc1 Amb28043089 [1,1,0,0,0,0|2,0,0]=4 5107 B10R1.15 NC(CO)c1ncccn1 Amb27452374 [1,1,0,0,0,0|2,0,0]=4 5108 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|1,0,1]=4 5109 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [1,1,0,0,0,0|1,0,1]=4 5110 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [1,1,0,0,0,0|1,0,0]=3 5111 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|1,0,0]=3 5112 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [1,1,0,0,0,0|1,0,0]=3 5113 B10R1.15 NCC(F)c1ccccn1 Amb24473175 [1,1,0,0,0,0|2,0,0]=4 5114 B10R1.15 NCC(F)c1cccnc1 Amb27405475 [1,1,0,0,0,0|2,0,0]=4 5115 B10R1.15 NCC(F)c1ccncc1 Amb27653637 [1,1,0,0,0,0|2,0,0]=4 5116 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|1,0,0]=3 5117 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [1,1,0,0,0,0|1,0,0]=3 5118 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [1,1,0,0,0,0|1,0,0]=3 5119 B10R1.15 NCC(N)c1ccncc1 Amb18063802 [1,1,0,0,0,0|2,0,0]=4 5120 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [1,1,0,0,0,0|1,0,0]=3 5121 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [1,1,0,0,0,0|1,0,0]=3 5122 B10R1.15 NCC(O)c1ccccn1 Amb1109027 [1,1,0,0,0,0|2,0,0]=4 5123 B10R1.15 NCC(O)c1ccccn1 Amb20622942 [1,1,0,0,0,0|2,0,0]=4 5124 B10R1.15 NCC(O)c1ccccn1 Amb6892508 [1,1,0,0,0,0|2,0,0]=4 5125 B10R1.15 NCC(O)c1cccnc1 Amb10068830 [1,1,0,0,0,0|2,0,0]=4 5126 B10R1.15 NCC(O)c1cccnc1 Amb8503375 [1,1,0,0,0,0|2,0,0]=4 5127 B10R1.15 NCC(O)c1cccnc1 Amb9703829 [1,1,0,0,0,0|2,0,0]=4 5128 B10R1.15 NCC(O)c1ccncc1 Amb22755845 [1,1,0,0,0,0|2,0,0]=4 5129 B10R1.15 NCC(O)c1ccncc1 Amb9703695 [1,1,0,0,0,0|2,0,0]=4 5130 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|1,0,0]=3 5131 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [1,1,0,0,0,0|1,0,0]=3 5132 B10R1.15 NC[C@@H](N)c1cccnc1 Amb28046917 [1,1,0,0,0,0|2,0,0]=4 5133 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|1,0,0]=3 5134 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [1,1,0,0,0,0|1,0,0]=3 5135 B10R1.15 NC[C@@H](O)c1ccccn1 Amb25052826 [1,1,0,0,0,0|2,0,0]=4 5136 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22744742 [1,1,0,0,0,0|2,0,0]=4 5137 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22748405 [1,1,0,0,0,0|2,0,0]=4 5138 B10R1.15 NC[C@@H](O)c1ccncc1 Amb24479579 [1,1,0,0,0,0|2,0,0]=4 5139 B10R1.15 NC[C@H](N)c1ccncc1 Amb27617070 [1,1,0,0,0,0|2,0,0]=4 5140 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [1,1,0,0,0,0|1,0,0]=3 5141 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [1,1,0,0,0,0|1,0,0]=3 5142 B10R1.15 NC[C@H](O)c1ccccn1 Amb24569794 [1,1,0,0,0,0|2,0,0]=4 5143 B10R1.15 NC[C@H](O)c1cccnc1 Amb23385336 [1,1,0,0,0,0|2,0,0]=4 5144 B10R1.15 NC[C@H](O)c1cccnc1 Amb25127978 [1,1,0,0,0,0|2,0,0]=4 5145 B10R1.15 NC[C@H](O)c1ccncc1 Amb27227500 [1,1,0,0,0,0|2,0,0]=4 5146 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [1,1,0,0,0,0|2,0,0]=4 5147 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [1,1,0,0,0,0|1,0,0]=3 5148 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,0]=3 5149 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,0]=3 5150 B10R1.15 N[C@@H](CF)c1cccnc1 Amb27237037 [1,1,0,0,0,0|2,0,0]=4 5151 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [1,1,0,0,0,0|0,0,0]=2 5152 B10R1.15 N[C@@H](CO)c1ccccn1 Amb28346863 [1,1,0,0,0,0|1,0,0]=3 5153 B10R1.15 N[C@@H](CO)c1ccccn1 Amb33483256 [1,1,0,0,0,0|1,0,0]=3 5154 B10R1.15 N[C@@H](CO)c1cccnc1 Amb25146409 [1,1,0,0,0,0|1,0,0]=3 5155 B10R1.15 N[C@@H](CO)c1ccncc1 Amb25146410 [1,1,0,0,0,0|1,0,0]=3 5156 B10R1.15 N[C@@H](CO)c1ccncn1 Amb27663518 [1,1,0,0,0,0|2,0,0]=4 5157 B10R1.15 N[C@@H](CO)c1cnccn1 Amb26458682 [1,1,0,0,0,0|2,0,0]=4 5158 B10R1.15 N[C@@H](CO)c1cncnc1 Amb24359874 [1,1,0,0,0,0|2,0,0]=4 5159 B10R1.15 N[C@@H](CO)c1ncccn1 Amb24686593 [1,1,0,0,0,0|2,0,0]=4 5160 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [1,1,0,0,0,0|1,0,0]=3 5161 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [1,1,0,0,0,0|1,0,0]=3 5162 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [1,1,0,0,0,0|1,0,0]=3 5163 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [1,1,0,0,0,0|0,0,0]=2 5164 B10R1.15 N[C@H](CO)c1ccccn1 Amb27617071 [1,1,0,0,0,0|1,0,0]=3 5165 B10R1.15 N[C@H](CO)c1ccccn1 Amb33483257 [1,1,0,0,0,0|1,0,0]=3 5166 B10R1.15 N[C@H](CO)c1cccnc1 Amb24712243 [1,1,0,0,0,0|1,0,0]=3 5167 B10R1.15 N[C@H](CO)c1ccncc1 Amb24714739 [1,1,0,0,0,0|1,0,0]=3 5168 B10R1.15 N[C@H](CO)c1ccncn1 Amb24504962 [1,1,0,0,0,0|2,0,0]=4 5169 B10R1.15 N[C@H](CO)c1cnccn1 Amb27977000 [1,1,0,0,0,0|2,0,0]=4 5170 B10R1.15 N[C@H](CO)c1cncnc1 Amb24333346 [1,1,0,0,0,0|2,0,0]=4 5171 B10R1.15 N[C@H](CO)c1ncccn1 Amb24478499 [1,1,0,0,0,0|2,0,0]=4 5172 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [1,1,0,0,0,0|1,0,1]=4 5173 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [1,1,0,0,0,0|1,0,1]=4 5174 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [1,1,0,0,0,0|1,0,1]=4 5175 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [1,1,0,0,0,0|1,0,1]=4 5176 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [1,1,0,0,0,0|1,0,1]=4 5177 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [1,1,0,0,0,0|1,0,1]=4 5178 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|1,0,1]=4 5179 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [1,1,0,0,0,0|0,0,1]=3 5180 B10R1.15 O=C(CO)c1ccccn1 Amb18063640 [1,1,0,0,0,0|1,0,1]=4 5181 B10R1.15 O=C(CO)c1cccnc1 Amb18063681 [1,1,0,0,0,0|1,0,1]=4 5182 B10R1.15 O=C(CO)c1ccncc1 Amb18063686 [1,1,0,0,0,0|1,0,1]=4 5183 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [1,1,0,0,0,0|0,1,1]=4 5184 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [1,1,0,0,0,0|1,0,1]=4 5185 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|0,0,2]=4 5186 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|0,0,2]=4 5187 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [1,1,0,0,0,0|0,0,2]=4 5188 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [1,1,0,0,0,0|0,0,2]=4 5189 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [1,1,0,0,0,0|0,0,2]=4 5190 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,1,0,0,0,0|1,1,0]=4 5191 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [1,1,0,0,0,0|0,1,0]=3 5192 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [1,1,0,0,0,0|1,0,0]=3 5193 B10R1.15 OC(CBr)c1ccccn1 Amb27623201 [1,1,0,0,0,0|2,0,0]=4 5194 B10R1.15 OC(CBr)c1ccncc1 Amb24099591 [1,1,0,0,0,0|2,0,0]=4 5195 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [1,1,0,0,0,0|1,0,0]=3 5196 B10R1.15 OC(CCl)c1ccccn1 Amb26455692 [1,1,0,0,0,0|2,0,0]=4 5197 B10R1.15 OC(CCl)c1cccnc1 Amb3319284 [1,1,0,0,0,0|2,0,0]=4 5198 B10R1.15 OC(CCl)c1ccncc1 Amb27470348 [1,1,0,0,0,0|2,0,0]=4 5199 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,0]=3 5200 B10R1.15 OC(CF)c1ccccn1 Amb25136249 [1,1,0,0,0,0|2,0,0]=4 5201 B10R1.15 OC(CF)c1cccnc1 Amb33360057 [1,1,0,0,0,0|2,0,0]=4 5202 B10R1.15 OC(CF)c1ccncc1 Amb33380647 [1,1,0,0,0,0|2,0,0]=4 5203 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [1,1,0,0,0,0|1,0,0]=3 5204 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [1,1,0,0,0,0|0,1,0]=3 5205 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [1,1,0,0,0,0|0,0,0]=2 5206 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [1,1,0,0,0,0|0,0,0]=2 5207 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|0,0,0]=2 5208 B10R1.15 OCC(F)c1ccncc1 Amb28384557 [1,1,0,0,0,0|1,0,0]=3 5209 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [1,1,0,0,0,0|0,0,0]=2 5210 B10R1.15 OCC(O)c1ccccn1 Amb4017599 [1,1,0,0,0,0|1,0,0]=3 5211 B10R1.15 OCC(O)c1cccnc1 Amb23538717 [1,1,0,0,0,0|1,0,0]=3 5212 B10R1.15 OCC(O)c1ccncc1 Amb23538718 [1,1,0,0,0,0|1,0,0]=3 5213 B10R1.15 OCC(O)c1ccncc1 Amb32656243 [1,1,0,0,0,0|1,0,0]=3 5214 B10R1.15 OCC(O)c1ccncn1 Amb33268587 [1,1,0,0,0,0|2,0,0]=4 5215 B10R1.15 OCC(O)c1cnccn1 Amb28079089 [1,1,0,0,0,0|2,0,0]=4 5216 B10R1.15 OCC(O)c1cncnc1 Amb28320860 [1,1,0,0,0,0|2,0,0]=4 5217 B10R1.15 OCC(O)c1ncccn1 Amb33270386 [1,1,0,0,0,0|2,0,0]=4 5218 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|0,0,0]=2 5219 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [1,1,0,0,0,0|0,0,0]=2 5220 B10R1.15 OC[C@@H](O)c1ccccn1 Amb26554033 [1,1,0,0,0,0|1,0,0]=3 5221 B10R1.15 OC[C@@H](O)c1cccnn1 Amb27839321 [1,1,0,0,0,0|2,0,0]=4 5222 B10R1.15 OC[C@@H](O)c1ccncc1 Amb28291407 [1,1,0,0,0,0|1,0,0]=3 5223 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [1,1,0,0,0,0|0,0,0]=2 5224 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [1,1,0,0,0,0|0,0,0]=2 5225 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [1,1,0,0,0,0|0,0,0]=2 5226 B10R1.15 OC[C@H](O)c1ccccn1 Amb27838863 [1,1,0,0,0,0|1,0,0]=3 5227 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [1,1,0,0,0,0|0,0,0]=2 5228 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,0]=3 5229 B10R1.15 O[C@@H](CBr)c1cccnc1 Amb27614899 [1,1,0,0,0,0|2,0,0]=4 5230 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [1,1,0,0,0,0|1,0,0]=3 5231 B10R1.15 O[C@@H](CCl)c1ccccn1 Amb28122883 [1,1,0,0,0,0|2,0,0]=4 5232 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,0]=3 5233 B10R1.15 O[C@@H](CF)c1ccccn1 Amb27839237 [1,1,0,0,0,0|2,0,0]=4 5234 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [1,1,0,0,0,0|0,1,0]=3 5235 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,0]=3 5236 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [1,1,0,0,0,0|1,0,0]=3 5237 B10R1.15 O[C@H](CCl)c1ccncc1 Amb27973641 [1,1,0,0,0,0|2,0,0]=4 5238 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,0]=3 5239 B10R1.15 O[C@H](CF)c1ccccn1 Amb27979963 [1,1,0,0,0,0|2,0,0]=4 5240 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [1,1,0,0,0,0|0,1,0]=3 5241 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [1,1,0,0,0,0|1,0,1]=4 5242 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [1,1,0,0,0,0|1,0,1]=4 5243 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [1,1,0,0,0,0|1,0,1]=4 5244 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [1,1,0,0,0,0|1,0,1]=4 5245 B10R1.15 [C-]#[N+]C(C)c1ccccc1 Amb2688979 [1,1,0,0,0,0|2,0,0]=4 5246 B10R1.15 [C-]#[N+][C@@H](C)c1ccccc1 Amb2684311 [1,1,0,0,0,0|2,0,0]=4 5247 B10R1.15 [C-]#[N+][C@H](C)c1ccccc1 Amb2684310 [1,1,0,0,0,0|2,0,0]=4 5248 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [1,1,0,0,0,0|1,0,1]=4 5249 B10R1.18 BrC(Br)Cc1ccccc1 Amb28049679 [1,1,0,0,0,0|1,0,0]=3 5250 B10R1.18 C=C(Br)Cc1ccccc1 Amb2685457 [1,1,0,0,0,0|1,0,1]=4 5251 B10R1.18 C=C(Cl)Cc1ccccc1 Amb27172505 [1,1,0,0,0,0|1,0,1]=4 5252 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [1,1,0,0,0,0|1,0,1]=4 5253 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|1,0,1]=4 5254 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [1,1,0,0,0,0|0,0,2]=4 5255 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [1,1,0,0,0,0|1,0,1]=4 5256 B10R1.18 CC(=O)Oc1cccnc1 Amb6297781 [1,1,0,0,0,0|1,0,1]=4 5257 B10R1.18 CC(=O)Oc1ccncc1 Amb22522585 [1,1,0,0,0,0|1,0,1]=4 5258 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|0,1,1]=4 5259 B10R1.18 CC(=S)Nc1ccccc1 Amb2613341 [1,1,0,0,0,0|1,0,1]=4 5260 B10R1.18 CC(=S)Oc1ccncc1 Amb27237851 [1,1,0,0,0,0|1,0,1]=4 5261 B10R1.18 CC(Br)Cc1ccccc1 Amb3940198 [1,1,0,0,0,0|1,0,0]=3 5262 B10R1.18 CC(Br)Cc1ccccn1 Amb27424955 [1,1,0,0,0,0|2,0,0]=4 5263 B10R1.18 CC(Br)Cc1ccncc1 Amb33506239 [1,1,0,0,0,0|2,0,0]=4 5264 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [1,1,0,0,0,0|1,0,1]=4 5265 B10R1.18 CC(C)C[n+]1ccccc1 Amb28189122 [1,1,0,0,0,0|2,0,0]=4 5266 B10R1.18 CC(C)Cc1ccccc1 Amb2778549 [1,1,0,0,0,0|1,0,0]=3 5267 B10R1.18 CC(C)Cc1ccccn1 Amb15691003 [1,1,0,0,0,0|2,0,0]=4 5268 B10R1.18 CC(C)Cc1cccnc1 Amb22043313 [1,1,0,0,0,0|2,0,0]=4 5269 B10R1.18 CC(C)Cc1ccncc1 Amb2613008 [1,1,0,0,0,0|2,0,0]=4 5270 B10R1.18 CC(C)Nc1ccccc1 Amb2720884 [1,1,0,0,0,0|1,0,0]=3 5271 B10R1.18 CC(C)Nc1ccccn1 Amb1104052 [1,1,0,0,0,0|2,0,0]=4 5272 B10R1.18 CC(C)Nc1cccnc1 Amb16231494 [1,1,0,0,0,0|2,0,0]=4 5273 B10R1.18 CC(C)Nc1cccnc1 Amb2382996 [1,1,0,0,0,0|2,0,0]=4 5274 B10R1.18 CC(C)Nc1ccncc1 Amb16231495 [1,1,0,0,0,0|2,0,0]=4 5275 B10R1.18 CC(C)Oc1ccccc1 Amb3429104 [1,1,0,0,0,0|0,0,0]=2 5276 B10R1.18 CC(C)Oc1ccccn1 Amb22304705 [1,1,0,0,0,0|1,0,0]=3 5277 B10R1.18 CC(C)Oc1cccnc1 Amb22898896 [1,1,0,0,0,0|1,0,0]=3 5278 B10R1.18 CC(C)Oc1ccncc1 Amb20242496 [1,1,0,0,0,0|1,0,0]=3 5279 B10R1.18 CC(C)Oc1cnccn1 Amb27623568 [1,1,0,0,0,0|2,0,0]=4 5280 B10R1.18 CC(C)Sc1ccccc1 Amb5721900 [1,1,0,0,0,0|0,1,0]=3 5281 B10R1.18 CC(Cl)Sc1ccncc1 Amb28045869 [1,1,0,0,0,0|1,1,0]=4 5282 B10R1.18 CC(N)Cc1ccccc1 Amb17608372 [1,1,0,0,0,0|1,0,0]=3 5283 B10R1.18 CC(N)Cc1ccccc1 Amb4079275 [1,1,0,0,0,0|1,0,0]=3 5284 B10R1.18 CC(N)Cc1ccccn1 Amb1995149 [1,1,0,0,0,0|2,0,0]=4 5285 B10R1.18 CC(N)Cc1cccnc1 Amb9712156 [1,1,0,0,0,0|2,0,0]=4 5286 B10R1.18 CC(N)Cc1ccncc1 Amb2592094 [1,1,0,0,0,0|2,0,0]=4 5287 B10R1.18 CC(O)CC1C=CC=CN1 Amb27431152 [1,1,0,0,0,0|1,0,1]=4 5288 B10R1.18 CC(O)C[n+]1ccccc1 Amb27213830 [1,1,0,0,0,0|1,0,0]=3 5289 B10R1.18 CC(O)Cc1ccccc1 Amb3940116 [1,1,0,0,0,0|0,0,0]=2 5290 B10R1.18 CC(O)Cc1ccccn1 Amb1995148 [1,1,0,0,0,0|1,0,0]=3 5291 B10R1.18 CC(O)Cc1cccnc1 Amb33530732 [1,1,0,0,0,0|1,0,0]=3 5292 B10R1.18 CC(O)Cc1ccncc1 Amb17477789 [1,1,0,0,0,0|1,0,0]=3 5293 B10R1.18 CC(O)Cc1ccncn1 Amb33474836 [1,1,0,0,0,0|2,0,0]=4 5294 B10R1.18 CC(O)Cc1cnccn1 Amb1995175 [1,1,0,0,0,0|2,0,0]=4 5295 B10R1.18 CC(O)Cc1cncnc1 Amb33465647 [1,1,0,0,0,0|2,0,0]=4 5296 B10R1.18 CC(O)Cc1ncccn1 Amb33295171 [1,1,0,0,0,0|2,0,0]=4 5297 B10R1.18 CC(O)Nc1ccccc1 Amb27771797 [1,1,0,0,0,0|1,0,0]=3 5298 B10R1.18 CC(O)Oc1ccccc1 Amb27838966 [1,1,0,0,0,0|0,0,0]=2 5299 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,1,0]=3 5300 B10R1.18 CN(C)Cc1ccccc1 Amb6608891 [1,1,0,0,0,0|2,0,0]=4 5301 B10R1.18 CN(C)Sc1ccccc1 Amb28388759 [1,1,0,0,0,0|1,1,0]=4 5302 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [1,1,0,0,0,0|2,0,0]=4 5303 B10R1.18 CN(O)Cc1ccccc1 Amb27149097 [1,1,0,0,0,0|1,0,0]=3 5304 B10R1.18 CN(O)Cc1ccccn1 Amb33361076 [1,1,0,0,0,0|2,0,0]=4 5305 B10R1.18 CN(O)Cc1cccnc1 Amb33429419 [1,1,0,0,0,0|2,0,0]=4 5306 B10R1.18 CN(O)Cc1ccncc1 Amb33380608 [1,1,0,0,0,0|2,0,0]=4 5307 B10R1.18 CP(C)Cc1ccccc1 Amb26928754 [1,1,0,0,0,0|2,0,0]=4 5308 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,1]=4 5309 B10R1.18 CS(=O)Nc1ccccc1 Amb27777995 [1,1,0,0,0,0|2,0,0]=4 5310 B10R1.18 C[C@@H](Br)Cc1ccccc1 Amb28182471 [1,1,0,0,0,0|1,0,0]=3 5311 B10R1.18 C[C@@H](Cl)Cc1ccccc1 Amb8389890 [1,1,0,0,0,0|1,0,0]=3 5312 B10R1.18 C[C@@H](I)Cc1ccccc1 Amb27199901 [1,1,0,0,0,0|1,0,0]=3 5313 B10R1.18 C[C@@H](N)Cc1ccccn1 Amb27754695 [1,1,0,0,0,0|2,0,0]=4 5314 B10R1.18 C[C@@H](N)Cc1cccnc1 Amb26602572 [1,1,0,0,0,0|2,0,0]=4 5315 B10R1.18 C[C@@H](N)Cc1ccncc1 Amb28044876 [1,1,0,0,0,0|2,0,0]=4 5316 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,0]=2 5317 B10R1.18 C[C@@H](O)Cc1ccccn1 Amb27839538 [1,1,0,0,0,0|1,0,0]=3 5318 B10R1.18 C[C@@H](O)Cc1cccnc1 Amb22896922 [1,1,0,0,0,0|1,0,0]=3 5319 B10R1.18 C[C@@H](O)Cc1ccncc1 Amb33380651 [1,1,0,0,0,0|1,0,0]=3 5320 B10R1.18 C[C@@H](O)Cc1ccncn1 Amb33268593 [1,1,0,0,0,0|2,0,0]=4 5321 B10R1.18 C[C@@H](O)Cc1cnccn1 Amb33359974 [1,1,0,0,0,0|2,0,0]=4 5322 B10R1.18 C[C@@H](O)Cc1cncnc1 Amb33149176 [1,1,0,0,0,0|2,0,0]=4 5323 B10R1.18 C[C@@H](O)Cc1ncccn1 Amb33270391 [1,1,0,0,0,0|2,0,0]=4 5324 B10R1.18 C[C@H](Br)Cc1ccccc1 Amb27484166 [1,1,0,0,0,0|1,0,0]=3 5325 B10R1.18 C[C@H](I)Cc1ccccc1 Amb27635996 [1,1,0,0,0,0|1,0,0]=3 5326 B10R1.18 C[C@H](N)Cc1ccccc1 Amb8395458 [1,1,0,0,0,0|1,0,0]=3 5327 B10R1.18 C[C@H](N)Cc1ccccn1 Amb24451425 [1,1,0,0,0,0|2,0,0]=4 5328 B10R1.18 C[C@H](N)Cc1cccnc1 Amb27145739 [1,1,0,0,0,0|2,0,0]=4 5329 B10R1.18 C[C@H](N)Cc1ccncc1 Amb28381274 [1,1,0,0,0,0|2,0,0]=4 5330 B10R1.18 C[C@H](O)Cc1ccccc1 Amb10068519 [1,1,0,0,0,0|0,0,0]=2 5331 B10R1.18 C[C@H](O)Cc1ccccn1 Amb26605951 [1,1,0,0,0,0|1,0,0]=3 5332 B10R1.18 C[C@H](O)Cc1cccnc1 Amb28041599 [1,1,0,0,0,0|1,0,0]=3 5333 B10R1.18 C[C@H](O)Cc1ccncc1 Amb33380652 [1,1,0,0,0,0|1,0,0]=3 5334 B10R1.18 C[C@H](O)Cc1ccncn1 Amb33268594 [1,1,0,0,0,0|2,0,0]=4 5335 B10R1.18 C[C@H](O)Cc1cnccn1 Amb33359975 [1,1,0,0,0,0|2,0,0]=4 5336 B10R1.18 C[C@H](O)Cc1cncnc1 Amb33149177 [1,1,0,0,0,0|2,0,0]=4 5337 B10R1.18 C[C@H](O)Cc1ncccn1 Amb33270392 [1,1,0,0,0,0|2,0,0]=4 5338 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|1,1,0]=4 5339 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|1,1,0]=4 5340 B10R1.18 C\C(O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,2]=4 5341 B10R1.18 C\[N+]([O-])=C/c1ccccc1 Amb3988092 [1,1,0,0,0,0|2,0,0]=4 5342 B10R1.18 C\[N+]([O-])=C\c1ccccc1 Amb2420785 [1,1,0,0,0,0|2,0,0]=4 5343 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,0]=3 5344 B10R1.18 ClC(Cl)Oc1ccccc1 Amb27758700 [1,1,0,0,0,0|1,0,0]=3 5345 B10R1.18 ClC(Cl)[SH2]c1ccccc1 Amb28396623 [1,1,0,0,0,0|1,1,0]=4 5346 B10R1.18 FC(F)Oc1ccccc1 Amb2687045 [1,1,0,0,0,0|1,0,0]=3 5347 B10R1.18 FC(F)Oc1ccccn1 Amb22236221 [1,1,0,0,0,0|2,0,0]=4 5348 B10R1.18 FC(F)Oc1cccnc1 Amb10610217 [1,1,0,0,0,0|2,0,0]=4 5349 B10R1.18 FC(F)Oc1ccncc1 Amb10610214 [1,1,0,0,0,0|2,0,0]=4 5350 B10R1.18 FC(F)Sc1ccccc1 Amb17232315 [1,1,0,0,0,0|1,1,0]=4 5351 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [1,1,0,0,0,0|1,0,1]=4 5352 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [1,1,0,0,0,0|1,0,1]=4 5353 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,1]=4 5354 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,2]=4 5355 B10R1.18 NC(=O)Oc1ccccc1 Amb4037283 [1,1,0,0,0,0|0,0,2]=4 5356 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,1,1]=4 5357 B10R1.18 NC(=S)Oc1ccccc1 Amb27453485 [1,1,0,0,0,0|0,1,1]=4 5358 B10R1.18 NC(N)Cc1ccccc1 Amb27823264 [1,1,0,0,0,0|1,0,0]=3 5359 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|0,0,0]=2 5360 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [1,1,0,0,0,0|1,0,1]=4 5361 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [1,1,0,0,0,0|0,0,2]=4 5362 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [1,1,0,0,0,0|0,0,2]=4 5363 B10R1.18 O=C(Cl)Oc1ccccc1 Amb6296594 [1,1,0,0,0,0|0,0,2]=4 5364 B10R1.18 O=C(O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|1,0,1]=4 5365 B10R1.18 O=C(O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|1,0,1]=4 5366 B10R1.18 O=C(O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|1,0,1]=4 5367 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [1,1,0,0,0,0|0,0,1]=3 5368 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [1,1,0,0,0,0|1,0,1]=4 5369 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [1,1,0,0,0,0|1,0,1]=4 5370 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [1,1,0,0,0,0|1,0,1]=4 5371 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [1,1,0,0,0,0|1,0,1]=4 5372 B10R1.18 O=C(O)Cc1ccncc1 Amb2720202 [1,1,0,0,0,0|1,0,1]=4 5373 B10R1.18 O=C(O)Cc1ccncc1 Amb3940535 [1,1,0,0,0,0|1,0,1]=4 5374 B10R1.18 O=C(O)Nc1ccccc1 Amb34916595 [1,1,0,0,0,0|1,0,1]=4 5375 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|0,0,2]=4 5376 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|0,0,2]=4 5377 B10R1.18 O=C([O-])Oc1ccccc1 Amb5540415 [1,1,0,0,0,0|0,0,2]=4 5378 B10R1.18 O=S(Cl)Cc1ccccc1 Amb28050330 [1,1,0,0,0,0|1,0,1]=4 5379 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [1,1,0,0,0,0|1,0,0]=3 5380 B10R1.18 O=S(O)Oc1ccccc1 Amb27964140 [1,1,0,0,0,0|1,0,0]=3 5381 B10R1.18 O=S([O-])Cc1ccccc1 Amb28430335 [1,1,0,0,0,0|1,0,1]=4 5382 B10R1.18 O=[N+]([O-])Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|1,0,1]=4 5383 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|1,0,0]=3 5384 B10R1.18 OB(O)Cc1ccccc1 Amb10071580 [1,1,0,0,0,0|1,0,0]=3 5385 B10R1.18 OB(O)Nc1ccccc1 Amb27630373 [1,1,0,0,0,0|2,0,0]=4 5386 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|0,0,1]=3 5387 B10R1.18 OC(Cl)Cc1ccccc1 Amb27228646 [1,1,0,0,0,0|0,0,0]=2 5388 B10R1.18 OC(Cl)Oc1ccccc1 Amb28255528 [1,1,0,0,0,0|0,0,0]=2 5389 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|0,0,0]=2 5390 B10R1.18 OC(O)Oc1ccccc1 Amb27790325 [1,1,0,0,0,0|0,0,0]=2 5391 B10R1.18 S=C(Cl)Cc1ccccc1 Amb28203639 [1,1,0,0,0,0|0,1,1]=4 5392 B10R1.18 S=C(Cl)Oc1ccccc1 Amb6365789 [1,1,0,0,0,0|0,1,1]=4 5393 B10R1.11 CC(CCO)c1ccco1 Amb27604308 [0,1,0,0,1,0|2,0,0]=4 5394 B10R1.11 CC(CCO)c1cccs1 Amb17232175 [0,1,0,0,1,0|2,0,0]=4 5395 B10R1.11 CC(CCO)c1ccsc1 Amb25676863 [0,1,0,0,1,0|2,0,0]=4 5396 B10R1.11 NC(CCO)c1ccco1 Amb18120550 [0,1,0,0,1,0|2,0,0]=4 5397 B10R1.11 NC(CCO)c1cccs1 Amb2408105 [0,1,0,0,1,0|2,0,0]=4 5398 B10R1.11 NC(CCO)c1ccoc1 Amb2697494 [0,1,0,0,1,0|2,0,0]=4 5399 B10R1.11 NC(CCO)c1ccsc1 Amb2408152 [0,1,0,0,1,0|2,0,0]=4 5400 B10R1.11 N[C@@H](CCO)c1ccco1 Amb26508556 [0,1,0,0,1,0|2,0,0]=4 5401 B10R1.11 N[C@@H](CCO)c1cccs1 Amb25835841 [0,1,0,0,1,0|2,0,0]=4 5402 B10R1.11 N[C@@H](CCO)c1ccoc1 Amb27644767 [0,1,0,0,1,0|2,0,0]=4 5403 B10R1.11 N[C@@H](CCO)c1ccsc1 Amb26068408 [0,1,0,0,1,0|2,0,0]=4 5404 B10R1.11 N[C@H](CCO)c1ccco1 Amb25887590 [0,1,0,0,1,0|2,0,0]=4 5405 B10R1.11 N[C@H](CCO)c1cccs1 Amb27593024 [0,1,0,0,1,0|2,0,0]=4 5406 B10R1.11 N[C@H](CCO)c1ccsc1 Amb25679671 [0,1,0,0,1,0|2,0,0]=4 5407 B10R1.11 O=C(CCO)c1cccs1 Amb18563468 [0,1,0,0,1,0|2,0,0]=4 5408 B10R1.11 OCCC(O)c1ccco1 Amb26495043 [0,1,0,0,1,0|2,0,0]=4 5409 B10R1.11 OCCC(O)c1cccs1 Amb18065453 [0,1,0,0,1,0|2,0,0]=4 5410 B10R1.11 OCCC(O)c1ccoc1 Amb27847544 [0,1,0,0,1,0|2,0,0]=4 5411 B10R1.11 OCC[C@H](O)c1cccs1 Amb28044388 [0,1,0,0,1,0|2,0,0]=4 5412 B10R1.16 CCCOc1cc(C)cs1 Amb27613201 [0,1,0,0,1,0|2,0,0]=4 5413 B10R1.16 Cc1cc(CCCO)cs1 Amb25797741 [0,1,0,0,1,0|2,0,0]=4 5414 B10R1.16 Cc1ccc(CCCO)o1 Amb17477780 [0,1,0,0,1,0|2,0,0]=4 5415 B10R1.16 Cc1ccc(CCCO)s1 Amb17605793 [0,1,0,0,1,0|2,0,0]=4 5416 B10R1.16 Cc1ccc(OCCN)o1 Amb33317587 [0,1,0,0,1,0|2,0,0]=4 5417 B10R1.16 Cc1ccc(OCCN)s1 Amb33375163 [0,1,0,0,1,0|2,0,0]=4 5418 B10R1.16 Cc1csc(CCCO)c1 Amb33373481 [0,1,0,0,1,0|2,0,0]=4 5419 B10R1.16 Cc1csc(OCCN)c1 Amb33373453 [0,1,0,0,1,0|2,0,0]=4 5420 B10R1.16 Cn1ccc(CCCO)c1 Amb18223708 [0,1,0,0,1,0|2,0,0]=4 5421 B10R1.16 NCCOc1cc(Br)co1 Amb33383070 [0,1,0,0,1,0|2,0,0]=4 5422 B10R1.16 NCCOc1cc(Br)cs1 Amb33388709 [0,1,0,0,1,0|2,0,0]=4 5423 B10R1.16 NCCOc1cc(Cl)cs1 Amb33058395 [0,1,0,0,1,0|2,0,0]=4 5424 B10R1.16 NCCOc1ccc(Br)o1 Amb33452236 [0,1,0,0,1,0|2,0,0]=4 5425 B10R1.16 NCCOc1ccc(Br)s1 Amb33008015 [0,1,0,0,1,0|2,0,0]=4 5426 B10R1.16 NCCOc1ccc(Cl)o1 Amb33259045 [0,1,0,0,1,0|2,0,0]=4 5427 B10R1.16 NCCOc1csc(Br)c1 Amb33433415 [0,1,0,0,1,0|2,0,0]=4 5428 B10R1.16 Nc1cc(OCCO)no1 Amb28052764 [0,1,0,0,1,0|2,0,0]=4 5429 B10R1.16 Nc1cnc(OCCO)s1 Amb27794227 [0,1,0,0,1,0|2,0,0]=4 5430 B10R1.16 OCCCc1cc(Br)co1 Amb26917079 [0,1,0,0,1,0|2,0,0]=4 5431 B10R1.16 OCCCc1cc(Br)cs1 Amb23537991 [0,1,0,0,1,0|2,0,0]=4 5432 B10R1.16 OCCCc1cc(Cl)cs1 Amb26938355 [0,1,0,0,1,0|2,0,0]=4 5433 B10R1.16 OCCCc1cc(I)co1 Amb27186786 [0,1,0,0,1,0|2,0,0]=4 5434 B10R1.16 OCCCc1ccc(Br)o1 Amb25800149 [0,1,0,0,1,0|2,0,0]=4 5435 B10R1.16 OCCCc1ccc(Br)s1 Amb25054989 [0,1,0,0,1,0|2,0,0]=4 5436 B10R1.16 OCCCc1ccc(Cl)o1 Amb26458673 [0,1,0,0,1,0|2,0,0]=4 5437 B10R1.16 OCCCc1ccc(Cl)s1 Amb18804618 [0,1,0,0,1,0|2,0,0]=4 5438 B10R1.16 OCCCc1coc(Br)c1 Amb26910291 [0,1,0,0,1,0|2,0,0]=4 5439 B10R1.16 OCCCc1csc(Br)c1 Amb33433594 [0,1,0,0,1,0|2,0,0]=4 5440 B10R1.16 OCCCc1csc(Cl)c1 Amb27836910 [0,1,0,0,1,0|2,0,0]=4 5441 B10R1.16 OCCNc1cc(Br)cs1 Amb27945888 [0,1,0,0,1,0|2,0,0]=4 5442 B10R1.16 OCCNc1ccc(Br)s1 Amb25041822 [0,1,0,0,1,0|2,0,0]=4 5443 B10R1.16 OCCNc1ccc(Cl)s1 Amb24524684 [0,1,0,0,1,0|2,0,0]=4 5444 B10R1.16 OCCNn1ccc(O)c1 Amb27484532 [0,1,0,0,1,0|2,0,0]=4 5445 B10R1.16 OCCSc1ccc(Cl)s1 Amb28286881 [0,1,0,0,1,0|1,1,0]=4 5446 B10R1.21 COCCOc1cccs1 Amb27263613 [0,1,0,0,1,0|1,0,0]=3 5447 B10R1.21 COCCOc1ccsc1 Amb26499890 [0,1,0,0,1,0|1,0,0]=3 5448 B10R1.21 COCCSc1cccs1 Amb27480231 [0,1,0,0,1,0|1,1,0]=4 5449 B10R1.21 ClCCOCc1cccs1 Amb18795876 [0,1,0,0,1,0|2,0,0]=4 5450 B10R1.21 N#CCCOc1ccsc1 Amb28141838 [0,1,0,0,1,0|2,0,0]=4 5451 B10R1.21 NCCCOc1ccco1 Amb33360903 [0,1,0,0,1,0|2,0,0]=4 5452 B10R1.21 NCCCOc1cccs1 Amb33360620 [0,1,0,0,1,0|2,0,0]=4 5453 B10R1.21 NCCCOc1ccoc1 Amb33360332 [0,1,0,0,1,0|2,0,0]=4 5454 B10R1.21 NCCCOc1ccsc1 Amb33428868 [0,1,0,0,1,0|2,0,0]=4 5455 B10R1.21 NNCCOc1cccs1 Amb27219467 [0,1,0,0,1,0|2,0,0]=4 5456 B10R1.21 NOCCCc1ccco1 Amb17089544 [0,1,0,0,1,0|2,0,0]=4 5457 B10R1.21 NOCCCc1cccs1 Amb17089545 [0,1,0,0,1,0|2,0,0]=4 5458 B10R1.21 NOCCCc1ccsc1 Amb33321651 [0,1,0,0,1,0|2,0,0]=4 5459 B10R1.21 OCCC#Cn1cccc1 Amb26486449 [0,1,0,0,1,0|2,0,0]=4 5460 B10R1.21 OCCCCc1ccco1 Amb17106038 [0,1,0,0,1,0|2,0,0]=4 5461 B10R1.21 OCCCCc1cccs1 Amb9004304 [0,1,0,0,1,0|2,0,0]=4 5462 B10R1.21 OCCCCc1ccsc1 Amb27475708 [0,1,0,0,1,0|2,0,0]=4 5463 B10R1.21 OCCCSc1ccco1 Amb28065299 [0,1,0,0,1,0|1,1,0]=4 5464 B10R1.21 OCCNCc1ccco1 Amb2592326 [0,1,0,0,1,0|2,0,0]=4 5465 B10R1.21 OCCNCc1cccs1 Amb838310 [0,1,0,0,1,0|2,0,0]=4 5466 B10R1.21 OCCNCc1ccsc1 Amb13951827 [0,1,0,0,1,0|2,0,0]=4 5467 B10R1.21 OCCNCc1ccsc1 Amb2592470 [0,1,0,0,1,0|2,0,0]=4 5468 B10R1.21 OCCSCc1ccsc1 Amb9511217 [0,1,0,0,1,0|1,1,0]=4 5469 B10R1.21 OCC\C=C\c1cccs1 Amb27197496 [0,1,0,0,1,0|2,0,0]=4 5470 B10R1.21 OCC\N=C\c1ccco1 Amb17593526 [0,1,0,0,1,0|2,0,0]=4 5471 B10R1.21 ONCCCc1ccsc1 Amb33322412 [0,1,0,0,1,0|2,0,0]=4 5472 B10R1.27 CC(CO)Cc1ccsc1 Amb27482569 [0,1,0,0,1,0|2,0,0]=4 5473 B10R1.27 CC(CO)Nc1ccsc1 Amb27771266 [0,1,0,0,1,0|2,0,0]=4 5474 B10R1.27 CC(CO)Sc1ccsc1 Amb27970532 [0,1,0,0,1,0|1,1,0]=4 5475 B10R1.27 C[C@H](CO)Cc1ccco1 Amb27839499 [0,1,0,0,1,0|2,0,0]=4 5476 B10R1.27 NC(CO)Cc1ccco1 Amb17062680 [0,1,0,0,1,0|2,0,0]=4 5477 B10R1.27 NC(CO)Cc1cccs1 Amb17062681 [0,1,0,0,1,0|2,0,0]=4 5478 B10R1.27 NC(CO)Cc1cccs1 Amb33330277 [0,1,0,0,1,0|2,0,0]=4 5479 B10R1.27 NC(CO)Cc1ccoc1 Amb24627260 [0,1,0,0,1,0|2,0,0]=4 5480 B10R1.27 NC(CO)Cc1ccsc1 Amb27413429 [0,1,0,0,1,0|2,0,0]=4 5481 B10R1.27 OCC(O)Cn1cccc1 Amb25066900 [0,1,0,0,1,0|2,0,0]=4 5482 B10R1.29 Cc1ccoc1CCCO Amb33343123 [0,1,0,0,1,0|2,0,0]=4 5483 B10R1.29 Cc1ccoc1OCCN Amb33342798 [0,1,0,0,1,0|2,0,0]=4 5484 B10R1.29 Cc1ccsc1CCCO Amb17477781 [0,1,0,0,1,0|2,0,0]=4 5485 B10R1.29 Cc1ccsc1OCCN Amb33202573 [0,1,0,0,1,0|2,0,0]=4 5486 B10R1.29 Cc1ccsc1SCCO Amb27191658 [0,1,0,0,1,0|1,1,0]=4 5487 B10R1.29 Cc1cocc1CCCO Amb27800767 [0,1,0,0,1,0|2,0,0]=4 5488 B10R1.29 Cc1cscc1CCCO Amb33213394 [0,1,0,0,1,0|2,0,0]=4 5489 B10R1.29 Cc1cscc1OCCBr Amb27666043 [0,1,0,0,1,0|2,0,0]=4 5490 B10R1.29 Cc1cscc1OCCN Amb33144803 [0,1,0,0,1,0|2,0,0]=4 5491 B10R1.29 Cc1occc1CCCO Amb33274327 [0,1,0,0,1,0|2,0,0]=4 5492 B10R1.29 Cc1occc1OCCN Amb33274284 [0,1,0,0,1,0|2,0,0]=4 5493 B10R1.29 Cn1cccc1CCCO Amb24446322 [0,1,0,0,1,0|2,0,0]=4 5494 B10R1.29 Cn1cccc1NCCO Amb26923252 [0,1,0,0,1,0|2,0,0]=4 5495 B10R1.29 Cn1cccc1OCCN Amb33203952 [0,1,0,0,1,0|2,0,0]=4 5496 B10R1.29 NCCOc1sccc1Br Amb33387967 [0,1,0,0,1,0|2,0,0]=4 5497 B10R1.29 NCCOc1sccc1Cl Amb33257969 [0,1,0,0,1,0|2,0,0]=4 5498 B10R1.29 OCCCc1ccsc1Br Amb25187302 [0,1,0,0,1,0|2,0,0]=4 5499 B10R1.29 OCCCc1ccsc1Cl Amb25772720 [0,1,0,0,1,0|2,0,0]=4 5500 B10R1.29 OCCCc1sccc1Br Amb24495718 [0,1,0,0,1,0|2,0,0]=4 5501 B10R1.29 OCCCc1sccc1Cl Amb27595656 [0,1,0,0,1,0|2,0,0]=4 5502 B10R1.29 OCCOn1nccc1O Amb27452077 [0,1,0,0,1,0|2,0,0]=4 5503 B10R1.66 CC(O)CC=C1C=CC=C1 Amb28197408 [0,1,0,0,1,0|1,0,0]=3 5504 B10R1.66 CC(O)CCc1ccco1 Amb9358376 [0,1,0,0,1,0|2,0,0]=4 5505 B10R1.66 CC(O)CCc1cccs1 Amb17507262 [0,1,0,0,1,0|2,0,0]=4 5506 B10R1.66 CC(O)CCc1ccoc1 Amb25766119 [0,1,0,0,1,0|2,0,0]=4 5507 B10R1.66 CC(O)CCc1ccsc1 Amb18799744 [0,1,0,0,1,0|2,0,0]=4 5508 B10R1.66 C[C@@H](O)CCc1ccco1 Amb27763861 [0,1,0,0,1,0|2,0,0]=4 5509 B10R1.66 C[C@@H](O)CCc1cccs1 Amb33360886 [0,1,0,0,1,0|2,0,0]=4 5510 B10R1.66 C[C@@H](O)CCc1ccoc1 Amb33360610 [0,1,0,0,1,0|2,0,0]=4 5511 B10R1.66 C[C@@H](O)CCc1ccsc1 Amb33428925 [0,1,0,0,1,0|2,0,0]=4 5512 B10R1.66 C[C@H](O)CCc1ccco1 Amb28321432 [0,1,0,0,1,0|2,0,0]=4 5513 B10R1.66 C[C@H](O)CCc1cccs1 Amb33360887 [0,1,0,0,1,0|2,0,0]=4 5514 B10R1.66 C[C@H](O)CCc1ccoc1 Amb33360611 [0,1,0,0,1,0|2,0,0]=4 5515 B10R1.66 C[C@H](O)CCc1ccsc1 Amb33428926 [0,1,0,0,1,0|2,0,0]=4 5516 B10R1.66 O=C(O)COc1ccco1 Amb28050105 [0,1,0,0,1,0|1,0,1]=4 5517 B10R1.66 O=C(O)COc1cccs1 Amb27233232 [0,1,0,0,1,0|1,0,1]=4 5518 B10R1.66 O=C(O)COc1ccoc1 Amb33360335 [0,1,0,0,1,0|1,0,1]=4 5519 B10R1.66 O=C(O)COc1ccsc1 Amb18126122 [0,1,0,0,1,0|1,0,1]=4 5520 B12R1.18 C#CCOC1=CC=CC=CC1=O Amb27828825 [0,1,0,0,0,1|1,0,1]=4 5521 B12R1.18 NCCNC1=CC=CC=CC1=O Amb27191827 [0,1,0,0,0,1|2,0,0]=4 5522 B12R1.18 O=C1C=CC=CC=C1SCCO Amb27853198 [0,1,0,0,0,1|0,1,0]=3 5523 B12R1.1 BrCCCCc1ccc(Br)cc1 Amb33801561 [0,2,0,0,0,0|2,0,0]=4 5524 B12R1.1 BrCCCOc1ccc(Br)cc1 Amb9209723 [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.1 BrCC\C=C\c1ccc(Br)cc1 Amb17175754 [0,2,0,0,0,0|2,0,0]=4 5526 B12R1.1 Brc1ccc(CCCCI)cc1 Amb34914019 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.1 C#CCCCc1ccc(Br)cc1 Amb33332210 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.1 C#CCCCc1ccc(Cl)cc1 Amb27967094 [0,2,0,0,0,0|2,0,0]=4 5529 B12R1.1 C#CCCCc1ccc(F)cc1 Amb27178486 [0,2,0,0,0,0|2,0,0]=4 5530 B12R1.1 C#CCCNc1ccc(Br)cc1 Amb27426594 [0,2,0,0,0,0|2,0,0]=4 5531 B12R1.1 C#CCCNc1ccc(C)cc1 Amb27229825 [0,2,0,0,0,0|2,0,0]=4 5532 B12R1.1 C#CCCOc1ccc(C)cc1 Amb27766777 [0,2,0,0,0,0|1,0,0]=3 5533 B12R1.1 C#CCCOc1ccc(C)cn1 Amb27969975 [0,2,0,0,0,0|2,0,0]=4 5534 B12R1.1 C#CCCOc1ccc(I)nc1 Amb28369613 [0,2,0,0,0,0|2,0,0]=4 5535 B12R1.1 C=CCCCc1ccc(Br)cc1 Amb33456175 [0,2,0,0,0,0|2,0,0]=4 5536 B12R1.1 C=CCCOc1ccc(Br)cc1 Amb33069058 [0,2,0,0,0,0|1,0,0]=3 5537 B12R1.1 C=CCCOc1ccc(Cl)cc1 Amb32664342 [0,2,0,0,0,0|1,0,0]=3 5538 B12R1.1 C=CCCOc1ccc(N)cc1 Amb24102791 [0,2,0,0,0,0|1,0,0]=3 5539 B12R1.1 C=CCCOc1ccc(O)cc1 Amb32410854 [0,2,0,0,0,0|1,0,0]=3 5540 B12R1.1 C=NCCNc1ccc(C)cc1 Amb27453488 [0,2,0,0,0,0|2,0,0]=4 5541 B12R1.1 C=NCCNc1ccc(Cl)cc1 Amb27865458 [0,2,0,0,0,0|2,0,0]=4 5542 B12R1.1 CCCC#Cc1ccc(C)cc1 Amb27494779 [0,2,0,0,0,0|2,0,0]=4 5543 B12R1.1 CCCC#Cc1ccc(Cl)cc1 Amb25936619 [0,2,0,0,0,0|2,0,0]=4 5544 B12R1.1 CCCC#Cc1ccc(F)cc1 Amb25977681 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.1 CCCC#Cc1ccc(I)cc1 Amb27248571 [0,2,0,0,0,0|2,0,0]=4 5546 B12R1.1 CCCC#Cc1ccc(N)cc1 Amb28196347 [0,2,0,0,0,0|2,0,0]=4 5547 B12R1.1 CCCC#Cc1ccc(O)cc1 Amb25282857 [0,2,0,0,0,0|2,0,0]=4 5548 B12R1.1 CCCCCc1ccc(Br)cc1 Amb2413171 [0,2,0,0,0,0|2,0,0]=4 5549 B12R1.1 CCCCCc1ccc(Cl)cc1 Amb2686308 [0,2,0,0,0,0|2,0,0]=4 5550 B12R1.1 CCCCCc1ccc(F)cc1 Amb2688281 [0,2,0,0,0,0|2,0,0]=4 5551 B12R1.1 CCCCCc1ccc(I)cc1 Amb2688867 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.1 CCCCCc1ccc(O)cc1 Amb2690078 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.1 CCCCNc1ccc(Br)cc1 Amb4313695 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.1 CCCCNc1ccc(C)cc1 Amb4313688 [0,2,0,0,0,0|2,0,0]=4 5555 B12R1.1 CCCCNc1ccc(Cl)cc1 Amb4313690 [0,2,0,0,0,0|2,0,0]=4 5556 B12R1.1 CCCCNc1ccc(F)cc1 Amb4313696 [0,2,0,0,0,0|2,0,0]=4 5557 B12R1.1 CCCCNc1ccc(I)cc1 Amb7759888 [0,2,0,0,0,0|2,0,0]=4 5558 B12R1.1 CCCCNc1ccc(O)cc1 Amb9608868 [0,2,0,0,0,0|2,0,0]=4 5559 B12R1.1 CCCCOc1ccc(Br)cc1 Amb2721157 [0,2,0,0,0,0|1,0,0]=3 5560 B12R1.1 CCCCOc1ccc(Br)cn1 Amb20242025 [0,2,0,0,0,0|2,0,0]=4 5561 B12R1.1 CCCCOc1ccc(Br)nc1 Amb33719147 [0,2,0,0,0,0|2,0,0]=4 5562 B12R1.1 CCCCOc1ccc(Cl)cc1 Amb9787615 [0,2,0,0,0,0|1,0,0]=3 5563 B12R1.1 CCCCOc1ccc(Cl)nc1 Amb32670792 [0,2,0,0,0,0|2,0,0]=4 5564 B12R1.1 CCCCOc1ccc(F)nc1 Amb32658400 [0,2,0,0,0,0|2,0,0]=4 5565 B12R1.1 CCCCOc1ccc(I)cc1 Amb19929171 [0,2,0,0,0,0|1,0,0]=3 5566 B12R1.1 CCCCOc1ccc(N)cc1 Amb1127017 [0,2,0,0,0,0|1,0,0]=3 5567 B12R1.1 CCCCOc1ccc(N)cn1 Amb33526924 [0,2,0,0,0,0|2,0,0]=4 5568 B12R1.1 CCCCOc1ccc(N)cn1 Amb4017541 [0,2,0,0,0,0|2,0,0]=4 5569 B12R1.1 CCCCOc1ccc(N)nc1 Amb8895013 [0,2,0,0,0,0|2,0,0]=4 5570 B12R1.1 CCCCOc1ccc(O)cc1 Amb3939308 [0,2,0,0,0,0|1,0,0]=3 5571 B12R1.1 CCCCSc1ccc(Br)cc1 Amb22227904 [0,2,0,0,0,0|1,1,0]=4 5572 B12R1.1 CCCCSc1ccc(N)cc1 Amb6543486 [0,2,0,0,0,0|1,1,0]=4 5573 B12R1.1 CCCNCc1ccc(Br)cc1 Amb19890387 [0,2,0,0,0,0|2,0,0]=4 5574 B12R1.1 CCCNCc1ccc(Br)cc1 Amb837679 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.1 CCCNCc1ccc(C)cc1 Amb1215690 [0,2,0,0,0,0|2,0,0]=4 5576 B12R1.1 CCCNCc1ccc(C)cc1 Amb19890384 [0,2,0,0,0,0|2,0,0]=4 5577 B12R1.1 CCCNCc1ccc(Cl)cc1 Amb10782093 [0,2,0,0,0,0|2,0,0]=4 5578 B12R1.1 CCCNCc1ccc(Cl)cc1 Amb838374 [0,2,0,0,0,0|2,0,0]=4 5579 B12R1.1 CCCNCc1ccc(F)cc1 Amb6864724 [0,2,0,0,0,0|2,0,0]=4 5580 B12R1.1 CCCNCc1ccc(F)cc1 Amb838017 [0,2,0,0,0,0|2,0,0]=4 5581 B12R1.1 CCCNCc1ccc(O)cc1 Amb2445168 [0,2,0,0,0,0|2,0,0]=4 5582 B12R1.1 CCCNCc1ccc(O)cc1 Amb6264703 [0,2,0,0,0,0|2,0,0]=4 5583 B12R1.1 CCCSCc1ccc(N)cc1 Amb6680628 [0,2,0,0,0,0|1,1,0]=4 5584 B12R1.1 CCC\C=C\c1ccc(Cl)cc1 Amb10566844 [0,2,0,0,0,0|2,0,0]=4 5585 B12R1.1 CCC\C=C\c1ccc(N)cc1 Amb27644670 [0,2,0,0,0,0|2,0,0]=4 5586 B12R1.1 CCC\N=C/c1ccc(F)cc1 Amb27598073 [0,2,0,0,0,0|2,0,0]=4 5587 B12R1.1 CCC\N=C\c1ccc(O)cc1 Amb2445167 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.1 CCNCCc1ccc(Br)cc1 Amb9214727 [0,2,0,0,0,0|2,0,0]=4 5589 B12R1.1 CCNCCc1ccc(C)cc1 Amb8853683 [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.1 CCNCCc1ccc(Cl)cc1 Amb5785546 [0,2,0,0,0,0|2,0,0]=4 5591 B12R1.1 CCNCCc1ccc(F)cc1 Amb5785549 [0,2,0,0,0,0|2,0,0]=4 5592 B12R1.1 CCNCCc1ccc(O)cc1 Amb15694900 [0,2,0,0,0,0|2,0,0]=4 5593 B12R1.1 CCOCOc1ccc(N)cn1 Amb33128031 [0,2,0,0,0,0|2,0,0]=4 5594 B12R1.1 CNCCCc1ccc(Br)cc1 Amb17104523 [0,2,0,0,0,0|2,0,0]=4 5595 B12R1.1 CNCCCc1ccc(C)cc1 Amb17104501 [0,2,0,0,0,0|2,0,0]=4 5596 B12R1.1 CNCCCc1ccc(Cl)cc1 Amb17104509 [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.1 CNCCCc1ccc(F)cc1 Amb17104503 [0,2,0,0,0,0|2,0,0]=4 5598 B12R1.1 CNCCOc1ccc(Br)cc1 Amb22166 [0,2,0,0,0,0|1,0,0]=3 5599 B12R1.1 CNCCOc1ccc(C)cc1 Amb1670236 [0,2,0,0,0,0|1,0,0]=3 5600 B12R1.1 CNCCOc1ccc(C)cc1 Amb2140580 [0,2,0,0,0,0|1,0,0]=3 5601 B12R1.1 CNCCOc1ccc(Cl)cc1 Amb397806 [0,2,0,0,0,0|1,0,0]=3 5602 B12R1.1 CNCCOc1ccc(F)cc1 Amb1156338 [0,2,0,0,0,0|1,0,0]=3 5603 B12R1.1 CNCCOc1ccc(F)cc1 Amb2094492 [0,2,0,0,0,0|1,0,0]=3 5604 B12R1.1 CNCCOc1ccc(N)cc1 Amb17232615 [0,2,0,0,0,0|1,0,0]=3 5605 B12R1.1 CNCCOc1ccc(N)cc1 Amb34912651 [0,2,0,0,0,0|1,0,0]=3 5606 B12R1.1 CNCCOc1ccc(O)cc1 Amb19507657 [0,2,0,0,0,0|1,0,0]=3 5607 B12R1.1 CNCCOc1ccc(O)cc1 Amb32789481 [0,2,0,0,0,0|1,0,0]=3 5608 B12R1.1 CNCCSc1ccc(C)cc1 Amb10608765 [0,2,0,0,0,0|1,1,0]=4 5609 B12R1.1 CNCCSc1ccc(C)cc1 Amb19892872 [0,2,0,0,0,0|1,1,0]=4 5610 B12R1.1 CNCCSc1ccc(Cl)cc1 Amb19024601 [0,2,0,0,0,0|1,1,0]=4 5611 B12R1.1 CNCCSc1ccc(Cl)cc1 Amb32662273 [0,2,0,0,0,0|1,1,0]=4 5612 B12R1.1 CNCCSc1ccc(F)cc1 Amb19024603 [0,2,0,0,0,0|1,1,0]=4 5613 B12R1.1 CNCCSc1ccc(F)cc1 Amb32662297 [0,2,0,0,0,0|1,1,0]=4 5614 B12R1.1 COCC#Cc1ccc(Br)cc1 Amb26470895 [0,2,0,0,0,0|1,0,1]=4 5615 B12R1.1 COCC#Cc1ccc(C)cc1 Amb27405766 [0,2,0,0,0,0|1,0,1]=4 5616 B12R1.1 COCC#Cc1ccc(Cl)cc1 Amb25898242 [0,2,0,0,0,0|1,0,1]=4 5617 B12R1.1 COCC#Cc1ccc(F)cc1 Amb25830550 [0,2,0,0,0,0|1,0,1]=4 5618 B12R1.1 COCC#Cc1ccc(I)cc1 Amb26519059 [0,2,0,0,0,0|1,0,1]=4 5619 B12R1.1 COCC#Cc1ccc(N)cc1 Amb27174432 [0,2,0,0,0,0|1,0,1]=4 5620 B12R1.1 COCC#Cc1ccc(O)cc1 Amb26325645 [0,2,0,0,0,0|1,0,1]=4 5621 B12R1.1 COCCNC1=CNC(=O)C=C1 Amb27792823 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.1 COCCNc1ccc(Br)cc1 Amb6712196 [0,2,0,0,0,0|1,0,0]=3 5623 B12R1.1 COCCNc1ccc(Br)cn1 Amb6648928 [0,2,0,0,0,0|2,0,0]=4 5624 B12R1.1 COCCNc1ccc(C)cc1 Amb6714070 [0,2,0,0,0,0|1,0,0]=3 5625 B12R1.1 COCCNc1ccc(C)cn1 Amb6614124 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.1 COCCNc1ccc(Cl)cc1 Amb6711958 [0,2,0,0,0,0|1,0,0]=3 5627 B12R1.1 COCCNc1ccc(F)cc1 Amb6712307 [0,2,0,0,0,0|1,0,0]=3 5628 B12R1.1 COCCNc1ccc(F)cn1 Amb18306369 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.1 COCCNc1ccc(F)nc1 Amb27187436 [0,2,0,0,0,0|2,0,0]=4 5630 B12R1.1 COCCNc1ccc(N)cc1 Amb10610074 [0,2,0,0,0,0|1,0,0]=3 5631 B12R1.1 COCCNc1ccc(N)cc1 Amb9205203 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.1 COCCNc1ccc(N)cn1 Amb33536610 [0,2,0,0,0,0|2,0,0]=4 5633 B12R1.1 COCCNc1ccc(N)nc1 Amb7767470 [0,2,0,0,0,0|2,0,0]=4 5634 B12R1.1 COCCOc1ccc(Br)cc1 Amb6260186 [0,2,0,0,0,0|0,0,0]=2 5635 B12R1.1 COCCOc1ccc(Br)cn1 Amb19349908 [0,2,0,0,0,0|1,0,0]=3 5636 B12R1.1 COCCOc1ccc(Br)nc1 Amb33972578 [0,2,0,0,0,0|1,0,0]=3 5637 B12R1.1 COCCOc1ccc(Cl)nn1 Amb6255751 [0,2,0,0,0,0|2,0,0]=4 5638 B12R1.1 COCCOc1ccc(F)cc1 Amb33546390 [0,2,0,0,0,0|0,0,0]=2 5639 B12R1.1 COCCOc1ccc(F)cn1 Amb19959844 [0,2,0,0,0,0|1,0,0]=3 5640 B12R1.1 COCCOc1ccc(F)nc1 Amb32412905 [0,2,0,0,0,0|1,0,0]=3 5641 B12R1.1 COCCOc1ccc(I)cc1 Amb32411259 [0,2,0,0,0,0|0,0,0]=2 5642 B12R1.1 COCCOc1ccc(N)cc1 Amb1995318 [0,2,0,0,0,0|0,0,0]=2 5643 B12R1.1 COCCOc1ccc(N)cc1 Amb2189147 [0,2,0,0,0,0|0,0,0]=2 5644 B12R1.1 COCCOc1ccc(N)cn1 Amb6249562 [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.1 COCCOc1ccc(N)nc1 Amb6679924 [0,2,0,0,0,0|1,0,0]=3 5646 B12R1.1 COCCOc1ccc(N)nn1 Amb33512651 [0,2,0,0,0,0|2,0,0]=4 5647 B12R1.1 COCCOc1ccc(O)cc1 Amb8837237 [0,2,0,0,0,0|0,0,0]=2 5648 B12R1.1 COCCOc1ccc(S)cc1 Amb28963355 [0,2,0,0,0,0|0,0,0]=2 5649 B12R1.1 COCCOc1cnc(Cl)nc1 Amb32411452 [0,2,0,0,0,0|2,0,0]=4 5650 B12R1.1 COCCOc1cnc(N)cn1 Amb19957730 [0,2,0,0,0,0|2,0,0]=4 5651 B12R1.1 COCCOc1cnc(N)nc1 Amb24085044 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.1 COCCOc1ncc(N)cn1 Amb19010076 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.1 COCCSc1ccc(N)cc1 Amb8930279 [0,2,0,0,0,0|0,1,0]=3 5654 B12R1.1 COCOCc1ccc(F)cc1 Amb28464086 [0,2,0,0,0,0|2,0,0]=4 5655 B12R1.1 COCOCc1ccc(N)cc1 Amb33547965 [0,2,0,0,0,0|2,0,0]=4 5656 B12R1.1 COCSCc1ccc(N)cc1 Amb17498310 [0,2,0,0,0,0|2,0,0]=4 5657 B12R1.1 CSCCNc1ccc(F)cc1 Amb18312643 [0,2,0,0,0,0|1,1,0]=4 5658 B12R1.1 CSCCNc1ccc(I)cc1 Amb27245585 [0,2,0,0,0,0|1,1,0]=4 5659 B12R1.1 CSCCNc1ccc(N)cc1 Amb27233343 [0,2,0,0,0,0|1,1,0]=4 5660 B12R1.1 CSCCOc1ccc(Br)cc1 Amb32414282 [0,2,0,0,0,0|0,1,0]=3 5661 B12R1.1 CSCCOc1ccc(N)cc1 Amb17504112 [0,2,0,0,0,0|0,1,0]=3 5662 B12R1.1 C\C=C\COc1ccc(Br)cc1 Amb9727095 [0,2,0,0,0,0|1,0,1]=4 5663 B12R1.1 C\C=C\COc1ccc(C)cc1 Amb27586223 [0,2,0,0,0,0|1,0,1]=4 5664 B12R1.1 Cc1ccc(C#CCCCl)cc1 Amb18796083 [0,2,0,0,0,0|2,0,0]=4 5665 B12R1.1 Cc1ccc(C#CCCO)cc1 Amb18792225 [0,2,0,0,0,0|1,0,0]=3 5666 B12R1.1 Cc1ccc(C#CCCO)cn1 Amb28288814 [0,2,0,0,0,0|2,0,0]=4 5667 B12R1.1 Cc1ccc(CCCC#N)cc1 Amb17232302 [0,2,0,0,0,0|2,0,0]=4 5668 B12R1.1 Cc1ccc(CCCC=O)cc1 Amb17089167 [0,2,0,0,0,0|1,0,1]=4 5669 B12R1.1 Cc1ccc(CCCCBr)cc1 Amb34914027 [0,2,0,0,0,0|2,0,0]=4 5670 B12R1.1 Cc1ccc(CCCCCl)cc1 Amb17139047 [0,2,0,0,0,0|2,0,0]=4 5671 B12R1.1 Cc1ccc(CCCCI)cc1 Amb34914017 [0,2,0,0,0,0|2,0,0]=4 5672 B12R1.1 Cc1ccc(CCCCN)cc1 Amb5735494 [0,2,0,0,0,0|2,0,0]=4 5673 B12R1.1 Cc1ccc(CCCCO)cc1 Amb16183285 [0,2,0,0,0,0|1,0,0]=3 5674 B12R1.1 Cc1ccc(CCCCS)cc1 Amb17400847 [0,2,0,0,0,0|1,1,0]=4 5675 B12R1.1 Cc1ccc(CCCON)cc1 Amb17089551 [0,2,0,0,0,0|1,0,0]=3 5676 B12R1.1 Cc1ccc(CNCCCl)cc1 Amb17335658 [0,2,0,0,0,0|2,0,0]=4 5677 B12R1.1 Cc1ccc(CNCCN)cc1 Amb9174051 [0,2,0,0,0,0|2,0,0]=4 5678 B12R1.1 Cc1ccc(CNCCO)cc1 Amb6864509 [0,2,0,0,0,0|1,0,0]=3 5679 B12R1.1 Cc1ccc(CNCCO)cc1 Amb838343 [0,2,0,0,0,0|1,0,0]=3 5680 B12R1.1 Cc1ccc(COCCN)cc1 Amb17061816 [0,2,0,0,0,0|1,0,0]=3 5681 B12R1.1 Cc1ccc(CSCCCl)cc1 Amb21988400 [0,2,0,0,0,0|1,1,0]=4 5682 B12R1.1 Cc1ccc(CSCCN)cc1 Amb436545 [0,2,0,0,0,0|1,1,0]=4 5683 B12R1.1 Cc1ccc(CSCCO)cc1 Amb9273829 [0,2,0,0,0,0|0,1,0]=3 5684 B12R1.1 Cc1ccc(NCCC#N)cc1 Amb1643630 [0,2,0,0,0,0|2,0,0]=4 5685 B12R1.1 Cc1ccc(NCCCN)cc1 Amb17057723 [0,2,0,0,0,0|2,0,0]=4 5686 B12R1.1 Cc1ccc(NCCCO)cc1 Amb17306885 [0,2,0,0,0,0|1,0,0]=3 5687 B12R1.1 Cc1ccc(OCCC#N)cc1 Amb6329691 [0,2,0,0,0,0|1,0,0]=3 5688 B12R1.1 Cc1ccc(OCCC=O)cc1 Amb5731761 [0,2,0,0,0,0|0,0,1]=3 5689 B12R1.1 Cc1ccc(OCCCBr)cc1 Amb2795768 [0,2,0,0,0,0|1,0,0]=3 5690 B12R1.1 Cc1ccc(OCCCCl)cc1 Amb6244757 [0,2,0,0,0,0|1,0,0]=3 5691 B12R1.1 Cc1ccc(OCCCN)cc1 Amb1108458 [0,2,0,0,0,0|1,0,0]=3 5692 B12R1.1 Cc1ccc(OCCCN)cc1 Amb34202383 [0,2,0,0,0,0|1,0,0]=3 5693 B12R1.1 Cc1ccc(OCCCN)cn1 Amb19024858 [0,2,0,0,0,0|2,0,0]=4 5694 B12R1.1 Cc1ccc(OCCCN)nc1 Amb18308511 [0,2,0,0,0,0|2,0,0]=4 5695 B12R1.1 Cc1ccc(OCCCO)cc1 Amb9370515 [0,2,0,0,0,0|0,0,0]=2 5696 B12R1.1 Cc1ccc(OCCCS)cc1 Amb10813402 [0,2,0,0,0,0|0,1,0]=3 5697 B12R1.1 Cc1ccc(OCCNN)cc1 Amb1117290 [0,2,0,0,0,0|1,0,0]=3 5698 B12R1.1 Cc1ccc(OCCNO)cc1 Amb17088416 [0,2,0,0,0,0|0,0,0]=2 5699 B12R1.1 Cc1ccc(OCCON)cc1 Amb17088290 [0,2,0,0,0,0|0,0,0]=2 5700 B12R1.1 Cc1ccc(OC\C=C/Cl)cc1 Amb28365557 [0,2,0,0,0,0|1,0,1]=4 5701 B12R1.1 Cc1ccc(O\C=C\CO)cc1 Amb28455048 [0,2,0,0,0,0|0,0,1]=3 5702 B12R1.1 Cc1ccc(SCCC#N)cc1 Amb1634502 [0,2,0,0,0,0|1,1,0]=4 5703 B12R1.1 Cc1ccc(SCCC=O)cc1 Amb17082944 [0,2,0,0,0,0|0,1,1]=4 5704 B12R1.1 Cc1ccc(SCCCN)cc1 Amb21984206 [0,2,0,0,0,0|1,1,0]=4 5705 B12R1.1 Cc1ccc(SCCCN)cc1 Amb6261863 [0,2,0,0,0,0|1,1,0]=4 5706 B12R1.1 Cc1ccc(\C=C\CCBr)cc1 Amb17142004 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.1 Cc1ccc(\C=C\CCCl)cc1 Amb17233776 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.1 Cc1ccc(\C=C\CCN)cc1 Amb17138533 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.1 Cc1ccc(\C=N\CCCl)cc1 Amb26371790 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.1 ClCCC#Cc1ccc(Br)cc1 Amb35656653 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.1 ClCCC#Cc1ccc(Cl)cc1 Amb18322032 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.1 ClCCCCc1ccc(Br)cc1 Amb17160233 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.1 ClCCCCc1ccc(Cl)cc1 Amb17139904 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.1 ClCCCOc1ccc(Br)cc1 Amb1127124 [0,2,0,0,0,0|1,0,0]=3 5715 B12R1.1 ClCCCOc1ccc(Cl)cc1 Amb1138390 [0,2,0,0,0,0|1,0,0]=3 5716 B12R1.1 ClCCCSc1ccc(Br)cc1 Amb4006803 [0,2,0,0,0,0|1,1,0]=4 5717 B12R1.1 ClCC\C=C\c1ccc(Br)cc1 Amb17258088 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.1 ClCC\C=C\c1ccc(Cl)cc1 Amb17237225 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.1 Cl\C=C\COc1ccc(Cl)cc1 Amb6334883 [0,2,0,0,0,0|1,0,1]=4 5720 B12R1.1 Clc1ccc(CCCCBr)cc1 Amb32665821 [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.1 Clc1ccc(CCCCI)cc1 Amb34914018 [0,2,0,0,0,0|2,0,0]=4 5722 B12R1.1 Clc1ccc(OCCCBr)cc1 Amb1154145 [0,2,0,0,0,0|1,0,0]=3 5723 B12R1.1 Clc1ccc(OCCCI)cc1 Amb2725683 [0,2,0,0,0,0|1,0,0]=3 5724 B12R1.1 Clc1ccc(\C=C\CCBr)cc1 Amb17159818 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.1 Fc1ccc(C#CCCCl)cc1 Amb19057037 [0,2,0,0,0,0|2,0,0]=4 5726 B12R1.1 Fc1ccc(CCCCBr)cc1 Amb20671699 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.1 Fc1ccc(CCCCCl)cc1 Amb17139159 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.1 Fc1ccc(CCCCI)cc1 Amb34914020 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.1 Fc1ccc(CCCCS)cc1 Amb17401040 [0,2,0,0,0,0|1,1,0]=4 5730 B12R1.1 Fc1ccc(CSCCCl)cc1 Amb21988508 [0,2,0,0,0,0|1,1,0]=4 5731 B12R1.1 Fc1ccc(NCCCCl)cc1 Amb28121086 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.1 Fc1ccc(OCCCBr)cc1 Amb2600502 [0,2,0,0,0,0|1,0,0]=3 5733 B12R1.1 Fc1ccc(OCCCCl)cc1 Amb1152973 [0,2,0,0,0,0|1,0,0]=3 5734 B12R1.1 Fc1ccc(OCCCS)cc1 Amb6256060 [0,2,0,0,0,0|0,1,0]=3 5735 B12R1.1 Fc1ccc(OC\C=C\Cl)cc1 Amb27229704 [0,2,0,0,0,0|1,0,1]=4 5736 B12R1.1 Fc1ccc(SCCCBr)cc1 Amb8828257 [0,2,0,0,0,0|1,1,0]=4 5737 B12R1.1 Fc1ccc(\C=C\CCBr)cc1 Amb17142520 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.1 Fc1ccc(\C=C\CCCl)cc1 Amb17234149 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.1 Fc1ccc(\C=C\CCS)cc1 Amb33201176 [0,2,0,0,0,0|1,1,0]=4 5740 B12R1.1 N#CCCCc1ccc(Br)cc1 Amb17246438 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.1 N#CCCCc1ccc(Cl)cc1 Amb17233649 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.1 N#CCCCc1ccc(F)cc1 Amb17232424 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.1 N#CCCCc1ccc(N)cc1 Amb18645390 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.1 N#CCCCc1ccc(O)cc1 Amb18645494 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.1 N#CCCNc1ccc(Br)cc1 Amb1149927 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.1 N#CCCNc1ccc(Cl)cc1 Amb1647287 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.1 N#CCCNc1ccc(F)cc1 Amb1103894 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.1 N#CCCNc1ccc(I)cc1 Amb9202490 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.1 N#CCCOc1ccc(Br)cc1 Amb6278733 [0,2,0,0,0,0|1,0,0]=3 5750 B12R1.1 N#CCCOc1ccc(Cl)cc1 Amb2782081 [0,2,0,0,0,0|1,0,0]=3 5751 B12R1.1 N#CCCOc1ccc(F)cc1 Amb6273641 [0,2,0,0,0,0|1,0,0]=3 5752 B12R1.1 N#CCCSc1ccc(Cl)cc1 Amb2782036 [0,2,0,0,0,0|1,1,0]=4 5753 B12R1.1 N#CCCSc1ccc(F)cc1 Amb417362 [0,2,0,0,0,0|1,1,0]=4 5754 B12R1.1 N#CCCSc1ccc(O)cc1 Amb28243804 [0,2,0,0,0,0|1,1,0]=4 5755 B12R1.1 NCCC#Cc1ccc(Br)cc1 Amb35605463 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.1 NCCC#Cc1ccc(Cl)cc1 Amb27642251 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.1 NCCCCc1ccc(Br)cc1 Amb17195656 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.1 NCCCCc1ccc(Cl)cc1 Amb18015291 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.1 NCCCCc1ccc(Cl)cc1 Amb5735503 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.1 NCCCCc1ccc(F)cc1 Amb5735496 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.1 NCCCCc1ccc(I)cc1 Amb34912661 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.1 NCCCCc1ccc(O)cc1 Amb18828233 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.1 NCCCCc1ccc(O)cc1 Amb24117946 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.1 NCCCNc1ccc(Br)cc1 Amb17057730 [0,2,0,0,0,0|2,0,0]=4 5765 B12R1.1 NCCCNc1ccc(Cl)cc1 Amb17057729 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.1 NCCCNc1ccc(F)cc1 Amb17057726 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.1 NCCCNc1ccc(F)cc1 Amb32718813 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.1 NCCCNc1ccc(O)cc1 Amb27792819 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.1 NCCCOc1ccc(Br)cc1 Amb6273629 [0,2,0,0,0,0|1,0,0]=3 5770 B12R1.1 NCCCOc1ccc(Br)cn1 Amb18308516 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.1 NCCCOc1ccc(Br)nc1 Amb33389184 [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.1 NCCCOc1ccc(Cl)cc1 Amb2721951 [0,2,0,0,0,0|1,0,0]=3 5773 B12R1.1 NCCCOc1ccc(Cl)cc1 Amb6760502 [0,2,0,0,0,0|1,0,0]=3 5774 B12R1.1 NCCCOc1ccc(Cl)cn1 Amb19020898 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.1 NCCCOc1ccc(Cl)nc1 Amb33261720 [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.1 NCCCOc1ccc(F)cc1 Amb1108272 [0,2,0,0,0,0|1,0,0]=3 5777 B12R1.1 NCCCOc1ccc(F)cc1 Amb6760508 [0,2,0,0,0,0|1,0,0]=3 5778 B12R1.1 NCCCOc1ccc(F)cn1 Amb18308523 [0,2,0,0,0,0|2,0,0]=4 5779 B12R1.1 NCCCOc1ccc(F)nc1 Amb33425103 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.1 NCCCOc1ccc(I)nc1 Amb33447002 [0,2,0,0,0,0|2,0,0]=4 5781 B12R1.1 NCCCOc1ccc(O)cc1 Amb33171970 [0,2,0,0,0,0|1,0,0]=3 5782 B12R1.1 NCCCSc1ccc(Br)cc1 Amb8994750 [0,2,0,0,0,0|1,1,0]=4 5783 B12R1.1 NCCCSc1ccc(Cl)cc1 Amb21984207 [0,2,0,0,0,0|1,1,0]=4 5784 B12R1.1 NCCCSc1ccc(Cl)cc1 Amb6276730 [0,2,0,0,0,0|1,1,0]=4 5785 B12R1.1 NCCCSc1ccc(F)cc1 Amb162071 [0,2,0,0,0,0|1,1,0]=4 5786 B12R1.1 NCCCSc1ccc(F)cc1 Amb2370740 [0,2,0,0,0,0|1,1,0]=4 5787 B12R1.1 NCCNCc1ccc(Br)cc1 Amb19012729 [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.1 NCCNCc1ccc(Cl)cc1 Amb10075508 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.1 NCCNCc1ccc(Cl)cc1 Amb29844474 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.1 NCCNCc1ccc(F)cc1 Amb10075507 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.1 NCCNCc1ccc(F)cc1 Amb29844476 [0,2,0,0,0,0|2,0,0]=4 5792 B12R1.1 NCCOCc1ccc(Br)cc1 Amb17061822 [0,2,0,0,0,0|1,0,0]=3 5793 B12R1.1 NCCOCc1ccc(Br)cc1 Amb31306656 [0,2,0,0,0,0|1,0,0]=3 5794 B12R1.1 NCCOCc1ccc(Cl)cc1 Amb6372391 [0,2,0,0,0,0|1,0,0]=3 5795 B12R1.1 NCCOCc1ccc(Cl)cc1 Amb6872147 [0,2,0,0,0,0|1,0,0]=3 5796 B12R1.1 NCCOCc1ccc(F)cc1 Amb17061819 [0,2,0,0,0,0|1,0,0]=3 5797 B12R1.1 NCCSCc1ccc(Br)cc1 Amb6271826 [0,2,0,0,0,0|1,1,0]=4 5798 B12R1.1 NCCSCc1ccc(Cl)cc1 Amb1214895 [0,2,0,0,0,0|1,1,0]=4 5799 B12R1.1 NCCSCc1ccc(Cl)cc1 Amb9677295 [0,2,0,0,0,0|1,1,0]=4 5800 B12R1.1 NCCSCc1ccc(F)cc1 Amb4477394 [0,2,0,0,0,0|1,1,0]=4 5801 B12R1.1 NCCSCc1ccc(F)cc1 Amb6384538 [0,2,0,0,0,0|1,1,0]=4 5802 B12R1.1 NCCSCc1ccc(I)cc1 Amb33321459 [0,2,0,0,0,0|1,1,0]=4 5803 B12R1.1 NCC\C=C\c1ccc(Br)cc1 Amb17142136 [0,2,0,0,0,0|2,0,0]=4 5804 B12R1.1 NCC\C=C\c1ccc(Br)cc1 Amb30584899 [0,2,0,0,0,0|2,0,0]=4 5805 B12R1.1 NCC\C=C\c1ccc(Cl)cc1 Amb17139018 [0,2,0,0,0,0|2,0,0]=4 5806 B12R1.1 NCC\C=C\c1ccc(F)cc1 Amb17138587 [0,2,0,0,0,0|2,0,0]=4 5807 B12R1.1 NCC\N=C\c1ccc(Cl)cc1 Amb25238653 [0,2,0,0,0,0|2,0,0]=4 5808 B12R1.1 NNCCCc1ccc(Br)cc1 Amb33332201 [0,2,0,0,0,0|2,0,0]=4 5809 B12R1.1 NNCCCc1ccc(F)cc1 Amb33319704 [0,2,0,0,0,0|2,0,0]=4 5810 B12R1.1 NNCCOc1ccc(Br)cc1 Amb17407555 [0,2,0,0,0,0|1,0,0]=3 5811 B12R1.1 NNCCOc1ccc(Cl)cc1 Amb2282443 [0,2,0,0,0,0|1,0,0]=3 5812 B12R1.1 NNCCOc1ccc(Cl)cc1 Amb2370789 [0,2,0,0,0,0|1,0,0]=3 5813 B12R1.1 NNCCOc1ccc(F)cc1 Amb17400323 [0,2,0,0,0,0|1,0,0]=3 5814 B12R1.1 NOCC#Cc1ccc(F)cc1 Amb24661686 [0,2,0,0,0,0|1,0,1]=4 5815 B12R1.1 NOCCCc1ccc(Br)cc1 Amb17089579 [0,2,0,0,0,0|1,0,0]=3 5816 B12R1.1 NOCCCc1ccc(Cl)cc1 Amb17089560 [0,2,0,0,0,0|1,0,0]=3 5817 B12R1.1 NOCCCc1ccc(F)cc1 Amb17089553 [0,2,0,0,0,0|1,0,0]=3 5818 B12R1.1 NOCCCc1ccc(O)cc1 Amb17089576 [0,2,0,0,0,0|1,0,0]=3 5819 B12R1.1 NOCCNc1ccc(Br)cn1 Amb32413025 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.1 NOCCOc1ccc(Br)cc1 Amb17088299 [0,2,0,0,0,0|0,0,0]=2 5821 B12R1.1 NOCCOc1ccc(Cl)cc1 Amb17088296 [0,2,0,0,0,0|0,0,0]=2 5822 B12R1.1 NOCCOc1ccc(F)cc1 Amb17088293 [0,2,0,0,0,0|0,0,0]=2 5823 B12R1.1 NOC\C=C\c1ccc(F)cc1 Amb33203068 [0,2,0,0,0,0|1,0,1]=4 5824 B12R1.1 Nc1ccc(C#CCCO)cc1 Amb27790887 [0,2,0,0,0,0|1,0,0]=3 5825 B12R1.1 Nc1ccc(CCCCO)cc1 Amb18828232 [0,2,0,0,0,0|1,0,0]=3 5826 B12R1.1 Nc1ccc(CNCCO)cc1 Amb34915874 [0,2,0,0,0,0|1,0,0]=3 5827 B12R1.1 Nc1ccc(COCCO)cc1 Amb6681027 [0,2,0,0,0,0|0,0,0]=2 5828 B12R1.1 Nc1ccc(NCCCO)cn1 Amb8997312 [0,2,0,0,0,0|2,0,0]=4 5829 B12R1.1 Nc1ccc(NCCCO)nc1 Amb8997319 [0,2,0,0,0,0|2,0,0]=4 5830 B12R1.1 Nc1ccc(OCCCBr)cc1 Amb16230364 [0,2,0,0,0,0|1,0,0]=3 5831 B12R1.1 Nc1ccc(OCCCO)cc1 Amb8842571 [0,2,0,0,0,0|0,0,0]=2 5832 B12R1.1 Nc1ccc(OCCCO)cn1 Amb8842573 [0,2,0,0,0,0|1,0,0]=3 5833 B12R1.1 Nc1ccc(OCCCO)nc1 Amb8842582 [0,2,0,0,0,0|1,0,0]=3 5834 B12R1.1 Nc1ccc(OCCCS)cc1 Amb17504082 [0,2,0,0,0,0|0,1,0]=3 5835 B12R1.1 Nc1ccc(SCCCO)cc1 Amb33528193 [0,2,0,0,0,0|0,1,0]=3 5836 B12R1.1 Nc1ccc(S\C=C/CO)cc1 Amb27876550 [0,2,0,0,0,0|0,1,1]=4 5837 B12R1.1 Nc1cnc(OCCCO)nc1 Amb19010081 [0,2,0,0,0,0|2,0,0]=4 5838 B12R1.1 O=CCCCc1ccc(Br)cc1 Amb17089176 [0,2,0,0,0,0|1,0,1]=4 5839 B12R1.1 O=CCCCc1ccc(Cl)cc1 Amb17089175 [0,2,0,0,0,0|1,0,1]=4 5840 B12R1.1 O=CCCCc1ccc(F)cc1 Amb17089174 [0,2,0,0,0,0|1,0,1]=4 5841 B12R1.1 O=CCCCc1ccc(O)cc1 Amb33359533 [0,2,0,0,0,0|1,0,1]=4 5842 B12R1.1 O=CCCOc1ccc(Cl)cc1 Amb5731776 [0,2,0,0,0,0|0,0,1]=3 5843 B12R1.1 O=CCCOc1ccc(F)cc1 Amb5731762 [0,2,0,0,0,0|0,0,1]=3 5844 B12R1.1 O=CCCSc1ccc(Br)cc1 Amb17082947 [0,2,0,0,0,0|0,1,1]=4 5845 B12R1.1 O=CCCSc1ccc(Cl)cc1 Amb17082946 [0,2,0,0,0,0|0,1,1]=4 5846 B12R1.1 O=CCCSc1ccc(F)cc1 Amb17082945 [0,2,0,0,0,0|0,1,1]=4 5847 B12R1.1 OCC=C=Cc1ccc(F)cc1 Amb27653190 [0,2,0,0,0,0|1,0,1]=4 5848 B12R1.1 OCCC#Cc1ccc(Br)cc1 Amb35626016 [0,2,0,0,0,0|1,0,0]=3 5849 B12R1.1 OCCCCc1ccc(Br)cc1 Amb17089159 [0,2,0,0,0,0|1,0,0]=3 5850 B12R1.1 OCCCCc1ccc(Cl)cc1 Amb17089158 [0,2,0,0,0,0|1,0,0]=3 5851 B12R1.1 OCCCCc1ccc(F)cc1 Amb17089157 [0,2,0,0,0,0|1,0,0]=3 5852 B12R1.1 OCCCCc1ccc(O)cc1 Amb8439668 [0,2,0,0,0,0|1,0,0]=3 5853 B12R1.1 OCCCNc1ccc(Br)cc1 Amb17306798 [0,2,0,0,0,0|1,0,0]=3 5854 B12R1.1 OCCCNc1ccc(Br)cn1 Amb6629283 [0,2,0,0,0,0|2,0,0]=4 5855 B12R1.1 OCCCNc1ccc(Cl)cc1 Amb17307252 [0,2,0,0,0,0|1,0,0]=3 5856 B12R1.1 OCCCNc1ccc(F)cc1 Amb17306196 [0,2,0,0,0,0|1,0,0]=3 5857 B12R1.1 OCCCNc1ccc(I)cc1 Amb17306250 [0,2,0,0,0,0|1,0,0]=3 5858 B12R1.1 OCCCOc1ccc(Br)cc1 Amb9370654 [0,2,0,0,0,0|0,0,0]=2 5859 B12R1.1 OCCCOc1ccc(Br)cn1 Amb33249780 [0,2,0,0,0,0|1,0,0]=3 5860 B12R1.1 OCCCOc1ccc(Cl)cc1 Amb9248109 [0,2,0,0,0,0|0,0,0]=2 5861 B12R1.1 OCCCOc1ccc(F)cc1 Amb1109753 [0,2,0,0,0,0|0,0,0]=2 5862 B12R1.1 OCCCOc1ccc(I)cc1 Amb9247650 [0,2,0,0,0,0|0,0,0]=2 5863 B12R1.1 OCCCSc1ccc(Br)cc1 Amb9246689 [0,2,0,0,0,0|0,1,0]=3 5864 B12R1.1 OCCCSc1ccc(Cl)cc1 Amb9246615 [0,2,0,0,0,0|0,1,0]=3 5865 B12R1.1 OCCCSc1ccc(F)cc1 Amb9246741 [0,2,0,0,0,0|0,1,0]=3 5866 B12R1.1 OCCNCc1ccc(Br)cc1 Amb6857145 [0,2,0,0,0,0|1,0,0]=3 5867 B12R1.1 OCCNCc1ccc(Br)cc1 Amb8598766 [0,2,0,0,0,0|1,0,0]=3 5868 B12R1.1 OCCNCc1ccc(Br)cn1 Amb24080720 [0,2,0,0,0,0|2,0,0]=4 5869 B12R1.1 OCCNCc1ccc(Br)nc1 Amb21861807 [0,2,0,0,0,0|2,0,0]=4 5870 B12R1.1 OCCNCc1ccc(Cl)cc1 Amb6383150 [0,2,0,0,0,0|1,0,0]=3 5871 B12R1.1 OCCNCc1ccc(Cl)cc1 Amb837738 [0,2,0,0,0,0|1,0,0]=3 5872 B12R1.1 OCCNCc1ccc(Cl)nc1 Amb21861815 [0,2,0,0,0,0|2,0,0]=4 5873 B12R1.1 OCCNCc1ccc(Cl)nc1 Amb21988407 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.1 OCCNCc1ccc(F)cc1 Amb5837372 [0,2,0,0,0,0|1,0,0]=3 5875 B12R1.1 OCCNCc1ccc(F)cc1 Amb838081 [0,2,0,0,0,0|1,0,0]=3 5876 B12R1.1 OCCNCc1ccc(O)cc1 Amb7757010 [0,2,0,0,0,0|1,0,0]=3 5877 B12R1.1 OCCOCc1ccc(Cl)cc1 Amb2421036 [0,2,0,0,0,0|0,0,0]=2 5878 B12R1.1 OCCSCc1ccc(Br)cc1 Amb3568984 [0,2,0,0,0,0|0,1,0]=3 5879 B12R1.1 OCCSCc1ccc(Cl)nc1 Amb9362940 [0,2,0,0,0,0|1,1,0]=4 5880 B12R1.1 OCCSCc1ccc(F)cc1 Amb3568981 [0,2,0,0,0,0|0,1,0]=3 5881 B12R1.1 OCC\C=C\c1ccc(F)cc1 Amb24763739 [0,2,0,0,0,0|1,0,0]=3 5882 B12R1.1 OCC\N=C\c1ccc(O)cc1 Amb3354838 [0,2,0,0,0,0|1,0,0]=3 5883 B12R1.1 OC\C=C\Cc1ccc(Cl)cc1 Amb27662231 [0,2,0,0,0,0|1,0,1]=4 5884 B12R1.1 ONCCCc1ccc(Br)cc1 Amb33332152 [0,2,0,0,0,0|1,0,0]=3 5885 B12R1.1 ONCCCc1ccc(F)cc1 Amb33424314 [0,2,0,0,0,0|1,0,0]=3 5886 B12R1.1 ONCCOc1ccc(Br)cc1 Amb17088425 [0,2,0,0,0,0|0,0,0]=2 5887 B12R1.1 ONCCOc1ccc(Cl)cc1 Amb17088422 [0,2,0,0,0,0|0,0,0]=2 5888 B12R1.1 ONCCOc1ccc(F)cc1 Amb17088419 [0,2,0,0,0,0|0,0,0]=2 5889 B12R1.1 ONC\C=C\c1ccc(F)cc1 Amb33327071 [0,2,0,0,0,0|1,0,1]=4 5890 B12R1.1 SCCCCc1ccc(Br)cc1 Amb17411242 [0,2,0,0,0,0|1,1,0]=4 5891 B12R1.1 SCCCCc1ccc(Cl)cc1 Amb17402392 [0,2,0,0,0,0|1,1,0]=4 5892 B12R1.1 SCCCOc1ccc(Br)cc1 Amb17258959 [0,2,0,0,0,0|0,1,0]=3 5893 B12R1.1 SCCCOc1ccc(Cl)cc1 Amb6663456 [0,2,0,0,0,0|0,1,0]=3 5894 B12R1.1 [C-]#[N+]CCCc1ccc(Br)cc1 Amb33332146 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.1 [C-]#[N+]CCCc1ccc(F)cc1 Amb26583428 [0,2,0,0,0,0|2,0,0]=4 5896 B12R1.1 [C-]#[N+]CCSc1ccc(Cl)cc1 Amb28400683 [0,2,0,0,0,0|1,1,0]=4 5897 B12R1.1 [C-]#[N+]CCSc1ccc(F)cc1 Amb27857303 [0,2,0,0,0,0|1,1,0]=4 5898 B12R1.16 C=C(CCC)c1ccc(C)cc1 Amb27639357 [0,2,0,0,0,0|2,0,0]=4 5899 B12R1.16 C=C(CCN)c1ccc(Br)cc1 Amb33451499 [0,2,0,0,0,0|2,0,0]=4 5900 B12R1.16 C=C(CCN)c1ccc(C)cc1 Amb33318535 [0,2,0,0,0,0|2,0,0]=4 5901 B12R1.16 C=C(CCN)c1ccc(Cl)cc1 Amb33052824 [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.16 C=C(CCN)c1ccc(F)cc1 Amb33375942 [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.16 C=C(CCN)c1ccc(O)cc1 Amb33268370 [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.16 C=C(CCO)c1ccc(Cl)cc1 Amb25760753 [0,2,0,0,0,0|1,0,0]=3 5905 B12R1.16 C=C(CCO)c1ccc(F)cc1 Amb27471973 [0,2,0,0,0,0|1,0,0]=3 5906 B12R1.16 CC(CCBr)c1ccc(Cl)cc1 Amb17259616 [0,2,0,0,0,0|2,0,0]=4 5907 B12R1.16 CC(CCBr)c1ccc(F)cc1 Amb17249285 [0,2,0,0,0,0|2,0,0]=4 5908 B12R1.16 CC(CCCl)c1ccc(Br)cc1 Amb17259618 [0,2,0,0,0,0|2,0,0]=4 5909 B12R1.16 CC(CCCl)c1ccc(Cl)cc1 Amb17237597 [0,2,0,0,0,0|2,0,0]=4 5910 B12R1.16 CC(CCCl)c1ccc(F)cc1 Amb17234366 [0,2,0,0,0,0|2,0,0]=4 5911 B12R1.16 CC(CCN)c1ccc(Br)cc1 Amb5739016 [0,2,0,0,0,0|2,0,0]=4 5912 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb5739015 [0,2,0,0,0,0|2,0,0]=4 5914 B12R1.16 CC(CCN)c1ccc(F)cc1 Amb5739014 [0,2,0,0,0,0|2,0,0]=4 5915 B12R1.16 CC(CCN)c1ccc(O)cc1 Amb33269858 [0,2,0,0,0,0|2,0,0]=4 5916 B12R1.16 CC(CCO)c1ccc(Br)cc1 Amb17248426 [0,2,0,0,0,0|1,0,0]=3 5917 B12R1.16 CC(CCO)c1ccc(Cl)cc1 Amb17234157 [0,2,0,0,0,0|1,0,0]=3 5918 B12R1.16 CC(CCO)c1ccc(F)cc1 Amb17232668 [0,2,0,0,0,0|1,0,0]=3 5919 B12R1.16 CC(CCS)c1ccc(F)cc1 Amb33423592 [0,2,0,0,0,0|1,1,0]=4 5920 B12R1.16 CC(CNO)c1ccc(F)cc1 Amb33274590 [0,2,0,0,0,0|2,0,0]=4 5921 B12R1.16 CCCC(=O)c1ccc(Br)cc1 Amb2567820 [0,2,0,0,0,0|2,0,0]=4 5922 B12R1.16 CCCC(=O)c1ccc(C)cc1 Amb3940678 [0,2,0,0,0,0|2,0,0]=4 5923 B12R1.16 CCCC(=O)c1ccc(Cl)cc1 Amb1679791 [0,2,0,0,0,0|2,0,0]=4 5924 B12R1.16 CCCC(=O)c1ccc(F)cc1 Amb4020581 [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.16 CCCC(=O)c1ccc(I)cc1 Amb4013959 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.16 CCCC(=O)c1ccc(N)cc1 Amb2684368 [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.16 CCCC(=O)c1ccc(O)cc1 Amb1033062 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.16 CCCC(Br)c1ccc(Br)cc1 Amb27976372 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.16 CCCC(C)c1ccc(O)cc1 Amb17594074 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.16 CCCC(Cl)c1ccc(C)cc1 Amb17139051 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.16 CCCC(Cl)c1ccc(Cl)cc1 Amb17139906 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.16 CCCC(Cl)c1ccc(F)cc1 Amb17139162 [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.16 CCCC(N)c1ccc(Br)cc1 Amb6255527 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.16 CCCC(N)c1ccc(C)cc1 Amb6256136 [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb9717984 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.16 CCCC(N)c1ccc(F)cc1 Amb9717477 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.16 CCCC(N)c1ccc(N)cc1 Amb27476459 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.16 CCCC(N)c1ccc(S)cc1 Amb27214632 [0,2,0,0,0,0|2,0,0]=4 5941 B12R1.16 CCCC(O)c1ccc(Br)cc1 Amb4011737 [0,2,0,0,0,0|2,0,0]=4 5942 B12R1.16 CCCC(O)c1ccc(C)cc1 Amb4035735 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.16 CCCC(O)c1ccc(Cl)cc1 Amb4035851 [0,2,0,0,0,0|2,0,0]=4 5944 B12R1.16 CCCC(O)c1ccc(F)cc1 Amb4036341 [0,2,0,0,0,0|2,0,0]=4 5945 B12R1.16 CCCC(O)c1ccc(O)cc1 Amb27226065 [0,2,0,0,0,0|2,0,0]=4 5946 B12R1.16 CCCC(S)c1ccc(Cl)cc1 Amb32788871 [0,2,0,0,0,0|2,0,0]=4 5947 B12R1.16 CCCN(C)c1ccc(Cl)cc1 Amb27804750 [0,2,0,0,0,0|2,0,0]=4 5948 B12R1.16 CCCN(C)c1ccc(F)cc1 Amb27653560 [0,2,0,0,0,0|2,0,0]=4 5949 B12R1.16 CCCN(C)c1ccc(O)cc1 Amb28064673 [0,2,0,0,0,0|2,0,0]=4 5950 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,2,0,0,0,0|1,1,0]=4 5951 B12R1.16 CCC[C@@H](N)c1ccc(C)cc1 Amb27259101 [0,2,0,0,0,0|2,0,0]=4 5952 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,2,0,0,0,0|2,0,0]=4 5953 B12R1.16 CCC[C@@H](O)c1ccc(Cl)cc1 Amb27834099 [0,2,0,0,0,0|2,0,0]=4 5954 B12R1.16 CCC[C@H](N)c1ccc(Br)cc1 Amb27871377 [0,2,0,0,0,0|2,0,0]=4 5955 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,2,0,0,0,0|2,0,0]=4 5956 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,2,0,0,0,0|2,0,0]=4 5957 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb27461355 [0,2,0,0,0,0|2,0,0]=4 5958 B12R1.16 CCC[C@H](O)c1ccc(Br)cc1 Amb27752379 [0,2,0,0,0,0|2,0,0]=4 5959 B12R1.16 CN(CCCl)c1ccc(Br)cc1 Amb17351918 [0,2,0,0,0,0|2,0,0]=4 5960 B12R1.16 CN(CCCl)c1ccc(Cl)cc1 Amb17338057 [0,2,0,0,0,0|2,0,0]=4 5961 B12R1.16 CN(CCCl)c1ccc(F)cc1 Amb17335952 [0,2,0,0,0,0|2,0,0]=4 5962 B12R1.16 CN(CCCl)c1ccc(N)cc1 Amb27592197 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.16 CN(CCF)c1ccc(F)cc1 Amb28185618 [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.16 CN(CCN)c1ccc(Br)cc1 Amb17059648 [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.16 CN(CCN)c1ccc(Cl)cc1 Amb17059647 [0,2,0,0,0,0|2,0,0]=4 5966 B12R1.16 CN(CCN)c1ccc(F)cc1 Amb17059644 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.16 CN(CCN)c1ccc(I)cc1 Amb27762292 [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.16 CN(CCO)c1ccc(Br)cc1 Amb17344450 [0,2,0,0,0,0|1,0,0]=3 5970 B12R1.16 CN(CCO)c1ccc(Br)cn1 Amb17610089 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.16 CN(CCO)c1ccc(Cl)cc1 Amb17335812 [0,2,0,0,0,0|1,0,0]=3 5972 B12R1.16 CN(CCO)c1ccc(F)cc1 Amb17334764 [0,2,0,0,0,0|1,0,0]=3 5973 B12R1.16 CN(CCO)c1ccc(N)cc1 Amb7765984 [0,2,0,0,0,0|1,0,0]=3 5974 B12R1.16 CN(CCO)c1ccc(N)cn1 Amb5786812 [0,2,0,0,0,0|2,0,0]=4 5975 B12R1.16 CN(CCO)c1ccc(N)nc1 Amb8997326 [0,2,0,0,0,0|2,0,0]=4 5976 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,2,0,0,0,0|2,0,0]=4 5977 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.16 C[C@H](CCO)c1ccc(Cl)cc1 Amb28125864 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.16 C\C(=C/CO)c1ccc(Cl)cc1 Amb27815981 [0,2,0,0,0,0|1,0,1]=4 5980 B12R1.16 Cc1ccc(C(=O)CCBr)cc1 Amb4066426 [0,2,0,0,0,0|2,0,0]=4 5981 B12R1.16 Cc1ccc(C(=O)CCCl)cc1 Amb4464622 [0,2,0,0,0,0|2,0,0]=4 5982 B12R1.16 Cc1ccc(C(=O)CCN)cc1 Amb17194471 [0,2,0,0,0,0|2,0,0]=4 5983 B12R1.16 Cc1ccc(C(=O)CCO)cc1 Amb18563614 [0,2,0,0,0,0|1,0,0]=3 5984 B12R1.16 Cc1ccc(C(=O)CCO)cn1 Amb28324319 [0,2,0,0,0,0|2,0,0]=4 5985 B12R1.16 Cc1ccc(C(=O)CCS)cc1 Amb17400836 [0,2,0,0,0,0|1,1,0]=4 5986 B12R1.16 Cc1ccc(C(=O)NCO)cc1 Amb2793597 [0,2,0,0,0,0|2,0,0]=4 5987 B12R1.16 Cc1ccc(C(C)CCBr)cc1 Amb857803 [0,2,0,0,0,0|2,0,0]=4 5988 B12R1.16 Cc1ccc(C(C)CCCl)cc1 Amb17233970 [0,2,0,0,0,0|2,0,0]=4 5989 B12R1.16 Cc1ccc(C(C)CCN)cc1 Amb5739007 [0,2,0,0,0,0|2,0,0]=4 5990 B12R1.16 Cc1ccc(C(C)CCO)cc1 Amb17232490 [0,2,0,0,0,0|1,0,0]=3 5991 B12R1.16 Cc1ccc(C(F)CCN)cc1 Amb26912355 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.16 Cc1ccc(C(N)CCO)cc1 Amb17103955 [0,2,0,0,0,0|1,0,0]=3 5993 B12R1.16 Cc1ccc(C(N)CCO)cn1 Amb28397868 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.16 Cc1ccc(C(N)CCO)nc1 Amb25743140 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.16 Cc1ccc(C(O)CCCl)cc1 Amb17194565 [0,2,0,0,0,0|2,0,0]=4 5996 B12R1.16 Cc1ccc(C(O)CCN)cc1 Amb17079132 [0,2,0,0,0,0|2,0,0]=4 5997 B12R1.16 Cc1ccc(C(O)CCO)cc1 Amb18563722 [0,2,0,0,0,0|1,0,0]=3 5998 B12R1.16 Cc1ccc(C(O)CNO)cc1 Amb17334704 [0,2,0,0,0,0|2,0,0]=4 5999 B12R1.16 Cc1ccc(N(C)CCCl)cc1 Amb17335672 [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.16 Cc1ccc(N(C)CCN)cc1 Amb13893182 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.16 Cc1ccc(N(C)CCO)cc1 Amb17334645 [0,2,0,0,0,0|1,0,0]=3 6002 B12R1.16 Cc1ccc([C@@H](N)CCO)cc1 Amb19888370 [0,2,0,0,0,0|1,0,0]=3 6003 B12R1.16 Cc1ccc([C@@H](N)CCO)cc1 Amb23399704 [0,2,0,0,0,0|1,0,0]=3 6004 B12R1.16 Cc1ccc([C@@H](N)CCO)nc1 Amb25719468 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.16 Cc1ccc([C@@H](O)CCCl)cc1 Amb28365650 [0,2,0,0,0,0|2,0,0]=4 6006 B12R1.16 Cc1ccc([C@@H](O)CCN)cc1 Amb25996449 [0,2,0,0,0,0|2,0,0]=4 6007 B12R1.16 Cc1ccc([C@H](N)CCN)cc1 Amb28056003 [0,2,0,0,0,0|2,0,0]=4 6008 B12R1.16 Cc1ccc([C@H](N)CCO)cc1 Amb19887704 [0,2,0,0,0,0|1,0,0]=3 6009 B12R1.16 Cc1ccc([C@H](N)CCO)nc1 Amb26547290 [0,2,0,0,0,0|2,0,0]=4 6010 B12R1.16 Cc1ccc([C@H](O)CCN)cc1 Amb28123207 [0,2,0,0,0,0|2,0,0]=4 6011 B12R1.16 ClCCC(Br)c1ccc(Cl)cc1 Amb25089461 [0,2,0,0,0,0|2,0,0]=4 6012 B12R1.16 Clc1ccc(C(Br)CCBr)cc1 Amb22001093 [0,2,0,0,0,0|2,0,0]=4 6013 B12R1.16 FC(CCCl)c1ccc(Br)cc1 Amb27872465 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.16 NC(CCO)c1ccc(Br)cc1 Amb2683232 [0,2,0,0,0,0|1,0,0]=3 6015 B12R1.16 NC(CCO)c1ccc(Br)cc1 Amb8631678 [0,2,0,0,0,0|1,0,0]=3 6016 B12R1.16 NC(CCO)c1ccc(Br)cn1 Amb24540520 [0,2,0,0,0,0|2,0,0]=4 6017 B12R1.16 NC(CCO)c1ccc(Br)nc1 Amb26935097 [0,2,0,0,0,0|2,0,0]=4 6018 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,2,0,0,0,0|1,0,0]=3 6019 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb1993959 [0,2,0,0,0,0|1,0,0]=3 6020 B12R1.16 NC(CCO)c1ccc(Cl)cn1 Amb25865504 [0,2,0,0,0,0|2,0,0]=4 6021 B12R1.16 NC(CCO)c1ccc(Cl)nc1 Amb28128011 [0,2,0,0,0,0|2,0,0]=4 6022 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb2683230 [0,2,0,0,0,0|1,0,0]=3 6023 B12R1.16 NC(CCO)c1ccc(F)cn1 Amb24713297 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.16 NC(CCO)c1ccc(F)nc1 Amb24760895 [0,2,0,0,0,0|2,0,0]=4 6025 B12R1.16 NC(CCO)c1ccc(I)cc1 Amb28398110 [0,2,0,0,0,0|1,0,0]=3 6026 B12R1.16 NC(CCO)c1ccc(O)cc1 Amb27781361 [0,2,0,0,0,0|1,0,0]=3 6027 B12R1.16 NCCC(=O)c1ccc(Br)cc1 Amb17195655 [0,2,0,0,0,0|2,0,0]=4 6028 B12R1.16 NCCC(=O)c1ccc(Cl)cc1 Amb17194559 [0,2,0,0,0,0|2,0,0]=4 6029 B12R1.16 NCCC(=O)c1ccc(F)cc1 Amb17108934 [0,2,0,0,0,0|2,0,0]=4 6030 B12R1.16 NCCC(=O)c1ccc(O)cc1 Amb27266111 [0,2,0,0,0,0|2,0,0]=4 6031 B12R1.16 NCCC(F)c1ccc(Br)cc1 Amb25255565 [0,2,0,0,0,0|2,0,0]=4 6032 B12R1.16 NCCC(F)c1ccc(Cl)cc1 Amb27756577 [0,2,0,0,0,0|2,0,0]=4 6033 B12R1.16 NCCC(F)c1ccc(F)cc1 Amb28062015 [0,2,0,0,0,0|2,0,0]=4 6034 B12R1.16 NCCC(F)c1ccc(O)cc1 Amb27481950 [0,2,0,0,0,0|2,0,0]=4 6035 B12R1.16 NCCC(N)c1ccc(O)cc1 Amb27850065 [0,2,0,0,0,0|2,0,0]=4 6036 B12R1.16 NCCC(O)c1ccc(Br)cc1 Amb17079141 [0,2,0,0,0,0|2,0,0]=4 6037 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb17079140 [0,2,0,0,0,0|2,0,0]=4 6038 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [0,2,0,0,0,0|2,0,0]=4 6039 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb17079139 [0,2,0,0,0,0|2,0,0]=4 6040 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [0,2,0,0,0,0|2,0,0]=4 6041 B12R1.16 NCCC(O)c1ccc(I)cc1 Amb27187555 [0,2,0,0,0,0|2,0,0]=4 6042 B12R1.16 NCCC(O)c1ccc(O)cc1 Amb18251886 [0,2,0,0,0,0|2,0,0]=4 6043 B12R1.16 NCCS(=O)c1ccc(Br)cc1 Amb18290919 [0,2,0,0,0,0|1,1,0]=4 6044 B12R1.16 NCCS(=O)c1ccc(I)cc1 Amb25315872 [0,2,0,0,0,0|1,1,0]=4 6045 B12R1.16 NCC[C@@H](N)c1ccc(I)cc1 Amb27880603 [0,2,0,0,0,0|2,0,0]=4 6046 B12R1.16 NCC[C@@H](O)c1ccc(Br)cc1 Amb33451500 [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.16 NCC[C@@H](O)c1ccc(Cl)cc1 Amb28240508 [0,2,0,0,0,0|2,0,0]=4 6048 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [0,2,0,0,0,0|2,0,0]=4 6049 B12R1.16 NCC[C@@H](O)c1ccc(O)cc1 Amb33269541 [0,2,0,0,0,0|2,0,0]=4 6050 B12R1.16 NCC[C@H](N)c1ccc(Cl)cc1 Amb28196691 [0,2,0,0,0,0|2,0,0]=4 6051 B12R1.16 NCC[C@H](N)c1ccc(I)cc1 Amb27629698 [0,2,0,0,0,0|2,0,0]=4 6052 B12R1.16 NCC[C@H](O)c1ccc(Br)cc1 Amb33451906 [0,2,0,0,0,0|2,0,0]=4 6053 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [0,2,0,0,0,0|2,0,0]=4 6054 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [0,2,0,0,0,0|2,0,0]=4 6055 B12R1.16 NCC[C@H](O)c1ccc(O)cc1 Amb33269539 [0,2,0,0,0,0|2,0,0]=4 6056 B12R1.16 N[C@@H](CCO)c1ccc(Br)cc1 Amb8631672 [0,2,0,0,0,0|1,0,0]=3 6057 B12R1.16 N[C@@H](CCO)c1ccc(Br)cn1 Amb24399312 [0,2,0,0,0,0|2,0,0]=4 6058 B12R1.16 N[C@@H](CCO)c1ccc(Br)nc1 Amb26332053 [0,2,0,0,0,0|2,0,0]=4 6059 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,2,0,0,0,0|1,0,0]=3 6060 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,2,0,0,0,0|1,0,0]=3 6061 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cn1 Amb25368193 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.16 N[C@@H](CCO)c1ccc(Cl)nc1 Amb24361595 [0,2,0,0,0,0|2,0,0]=4 6063 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.16 N[C@@H](CCO)c1ccc(F)nc1 Amb24370788 [0,2,0,0,0,0|2,0,0]=4 6065 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,2,0,0,0,0|1,0,0]=3 6066 B12R1.16 N[C@@H](CCO)c1ccc(S)cc1 Amb27413141 [0,2,0,0,0,0|1,0,0]=3 6067 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,2,0,0,0,0|1,0,0]=3 6068 B12R1.16 N[C@H](CCO)c1ccc(Br)cn1 Amb25035262 [0,2,0,0,0,0|2,0,0]=4 6069 B12R1.16 N[C@H](CCO)c1ccc(Br)nc1 Amb24759936 [0,2,0,0,0,0|2,0,0]=4 6070 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.16 N[C@H](CCO)c1ccc(Cl)cn1 Amb25859241 [0,2,0,0,0,0|2,0,0]=4 6072 B12R1.16 N[C@H](CCO)c1ccc(Cl)nc1 Amb25722664 [0,2,0,0,0,0|2,0,0]=4 6073 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,2,0,0,0,0|1,0,0]=3 6074 B12R1.16 N[C@H](CCO)c1ccc(F)nc1 Amb24715237 [0,2,0,0,0,0|2,0,0]=4 6075 B12R1.16 N[C@H](CCO)c1ccc(O)cn1 Amb27751960 [0,2,0,0,0,0|2,0,0]=4 6076 B12R1.16 N[C@H](CCO)c1ccc(O)nc1 Amb27212947 [0,2,0,0,0,0|2,0,0]=4 6077 B12R1.16 Nc1ccc(C(=O)CCCl)cc1 Amb17202006 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.16 Nc1ccc(C(N)CCO)cc1 Amb19887602 [0,2,0,0,0,0|1,0,0]=3 6079 B12R1.16 Nc1ccc(C(N)CCO)cc1 Amb8631339 [0,2,0,0,0,0|1,0,0]=3 6080 B12R1.16 Nc1ccc([C@@H](N)CCO)cc1 Amb31289320 [0,2,0,0,0,0|1,0,0]=3 6081 B12R1.16 Nc1ccc([C@@H](N)CCO)cc1 Amb8631338 [0,2,0,0,0,0|1,0,0]=3 6082 B12R1.16 Nc1ccc([C@@H](N)CCO)nc1 Amb27961479 [0,2,0,0,0,0|2,0,0]=4 6083 B12R1.16 Nc1ccc([C@H](N)CCO)cn1 Amb28341758 [0,2,0,0,0,0|2,0,0]=4 6084 B12R1.16 O=C(CCBr)c1ccc(Br)cc1 Amb17437866 [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.16 O=C(CCBr)c1ccc(Cl)cc1 Amb4034399 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.16 O=C(CCBr)c1ccc(F)cc1 Amb17437867 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.16 O=C(CCBr)c1ccc(I)cc1 Amb27619702 [0,2,0,0,0,0|2,0,0]=4 6088 B12R1.16 O=C(CCBr)c1ccc(O)cc1 Amb26352653 [0,2,0,0,0,0|2,0,0]=4 6089 B12R1.16 O=C(CCCl)c1ccc(Br)cc1 Amb6298829 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.16 O=C(CCCl)c1ccc(Cl)cc1 Amb2724275 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.16 O=C(CCCl)c1ccc(F)cc1 Amb1233062 [0,2,0,0,0,0|2,0,0]=4 6092 B12R1.16 O=C(CCCl)c1ccc(O)cc1 Amb18552996 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.16 O=C(CCCl)c1ccc(S)cc1 Amb27259811 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.16 O=C(CCO)c1ccc(Br)cc1 Amb18069914 [0,2,0,0,0,0|1,0,0]=3 6095 B12R1.16 O=C(CCO)c1ccc(Cl)cc1 Amb18564305 [0,2,0,0,0,0|1,0,0]=3 6096 B12R1.16 O=C(CCO)c1ccc(F)cc1 Amb1111123 [0,2,0,0,0,0|1,0,0]=3 6097 B12R1.16 O=C(CCO)c1ccc(O)cc1 Amb8399058 [0,2,0,0,0,0|1,0,0]=3 6098 B12R1.16 O=C(CCS)c1ccc(Br)cc1 Amb17411234 [0,2,0,0,0,0|1,1,0]=4 6099 B12R1.16 O=C(CCS)c1ccc(Cl)cc1 Amb17402391 [0,2,0,0,0,0|1,1,0]=4 6100 B12R1.16 O=C(CCS)c1ccc(F)cc1 Amb17401021 [0,2,0,0,0,0|1,1,0]=4 6101 B12R1.16 O=C(NCO)c1ccc(Cl)cc1 Amb2793594 [0,2,0,0,0,0|2,0,0]=4 6102 B12R1.16 O=C(NCO)c1ccc(F)cc1 Amb2793598 [0,2,0,0,0,0|2,0,0]=4 6103 B12R1.16 O=S(CCCl)c1ccc(Br)cc1 Amb9677472 [0,2,0,0,0,0|1,1,0]=4 6104 B12R1.16 O=S(CCCl)c1ccc(Cl)cc1 Amb9677437 [0,2,0,0,0,0|1,1,0]=4 6105 B12R1.16 O=S(CCF)c1ccc(F)cc1 Amb27407396 [0,2,0,0,0,0|1,1,0]=4 6106 B12R1.16 O=S(CCO)c1ccc(Cl)cc1 Amb25969463 [0,2,0,0,0,0|0,1,0]=3 6107 B12R1.16 OC(CCBr)c1ccc(Br)cc1 Amb32676367 [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.16 OC(CCBr)c1ccc(Cl)cc1 Amb32676368 [0,2,0,0,0,0|2,0,0]=4 6109 B12R1.16 OC(CCBr)c1ccc(F)cc1 Amb32676369 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.16 OC(CCCl)c1ccc(Br)cc1 Amb17196599 [0,2,0,0,0,0|2,0,0]=4 6111 B12R1.16 OC(CCCl)c1ccc(Cl)cc1 Amb17194897 [0,2,0,0,0,0|2,0,0]=4 6112 B12R1.16 OC(CCCl)c1ccc(F)cc1 Amb17194592 [0,2,0,0,0,0|2,0,0]=4 6113 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [0,2,0,0,0,0|2,0,0]=4 6114 B12R1.16 OC(CCS)c1ccc(F)cc1 Amb28066032 [0,2,0,0,0,0|1,1,0]=4 6115 B12R1.16 OCCC(Cl)c1ccc(F)cc1 Amb27880878 [0,2,0,0,0,0|1,0,0]=3 6116 B12R1.16 OCCC(F)c1ccc(Br)cc1 Amb27491853 [0,2,0,0,0,0|1,0,0]=3 6117 B12R1.16 OCCC(F)c1ccc(Cl)cc1 Amb28188244 [0,2,0,0,0,0|1,0,0]=3 6118 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,2,0,0,0,0|1,0,0]=3 6119 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,2,0,0,0,0|1,0,0]=3 6120 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,2,0,0,0,0|1,0,0]=3 6121 B12R1.16 ONCC(O)c1ccc(Br)cc1 Amb17345007 [0,2,0,0,0,0|2,0,0]=4 6122 B12R1.16 ONCC(O)c1ccc(Cl)cc1 Amb17335949 [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.16 ONCC(O)c1ccc(F)cc1 Amb17334838 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.16 ONCC(O)c1ccc(O)cc1 Amb17334758 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.16 O[C@@H](CCCl)c1ccc(Cl)cc1 Amb27178138 [0,2,0,0,0,0|2,0,0]=4 6126 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [0,2,0,0,0,0|2,0,0]=4 6127 B12R1.16 O[C@@H](CCI)c1ccc(F)cc1 Amb16233257 [0,2,0,0,0,0|2,0,0]=4 6128 B12R1.21 C=C(Br)COc1ccc(C)cc1 Amb27436097 [0,2,0,0,0,0|1,0,1]=4 6129 B12R1.21 C=C(Br)COc1ccc(I)cc1 Amb27601637 [0,2,0,0,0,0|1,0,1]=4 6130 B12R1.21 C=C(Br)COc1ccc(N)cc1 Amb18971535 [0,2,0,0,0,0|1,0,1]=4 6131 B12R1.21 C=C(C)COc1ccc(Br)cc1 Amb6268759 [0,2,0,0,0,0|1,0,1]=4 6132 B12R1.21 C=C(C)COc1ccc(C)cc1 Amb27662937 [0,2,0,0,0,0|1,0,1]=4 6133 B12R1.21 C=C(C)COc1ccc(F)cc1 Amb2444928 [0,2,0,0,0,0|1,0,1]=4 6134 B12R1.21 C=C(C)COc1ccc(N)cc1 Amb2081541 [0,2,0,0,0,0|1,0,1]=4 6135 B12R1.21 C=C(C)COc1ccc(N)cc1 Amb9172210 [0,2,0,0,0,0|1,0,1]=4 6136 B12R1.21 C=C(C)COc1ccc(O)cc1 Amb8837285 [0,2,0,0,0,0|1,0,1]=4 6137 B12R1.21 C=C(Cl)COc1ccc(Br)cc1 Amb6265854 [0,2,0,0,0,0|1,0,1]=4 6138 B12R1.21 C=C(Cl)COc1ccc(I)cc1 Amb27806181 [0,2,0,0,0,0|1,0,1]=4 6139 B12R1.21 C=C(Cl)COc1ccc(O)cc1 Amb8837283 [0,2,0,0,0,0|1,0,1]=4 6140 B12R1.21 C=C(F)COc1ccc(Br)cc1 Amb23570540 [0,2,0,0,0,0|1,0,1]=4 6141 B12R1.21 CC(=O)COc1ccc(Cl)cc1 Amb1094739 [0,2,0,0,0,0|0,0,2]=4 6142 B12R1.21 CC(=O)COc1ccc(F)cc1 Amb9269853 [0,2,0,0,0,0|0,0,2]=4 6143 B12R1.21 CC(=O)COc1ccc(I)cc1 Amb26363908 [0,2,0,0,0,0|0,0,2]=4 6144 B12R1.21 CC(=O)COc1ccc(N)cc1 Amb17110083 [0,2,0,0,0,0|0,0,2]=4 6145 B12R1.21 CC(Br)CCc1ccc(F)cc1 Amb27404173 [0,2,0,0,0,0|2,0,0]=4 6146 B12R1.21 CC(C)CCc1ccc(Br)cc1 Amb2226924 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.21 CC(C)CCc1ccc(N)cc1 Amb9299174 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.21 CC(C)CCc1ccc(O)cc1 Amb3939486 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.21 CC(C)CNc1ccc(Br)cc1 Amb6696487 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb20669276 [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb6695926 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.21 CC(C)CNc1ccc(F)cc1 Amb6696720 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.21 CC(C)CNc1ccc(I)cc1 Amb7785056 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.21 CC(C)CNc1ccc(N)cc1 Amb9205219 [0,2,0,0,0,0|2,0,0]=4 6155 B12R1.21 CC(C)COc1ccc(Br)cc1 Amb6665064 [0,2,0,0,0,0|1,0,0]=3 6156 B12R1.21 CC(C)COc1ccc(Br)cn1 Amb28290282 [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.21 CC(C)COc1ccc(Cl)cc1 Amb25667205 [0,2,0,0,0,0|1,0,0]=3 6158 B12R1.21 CC(C)COc1ccc(F)cc1 Amb26074184 [0,2,0,0,0,0|1,0,0]=3 6159 B12R1.21 CC(C)COc1ccc(F)nc1 Amb24395753 [0,2,0,0,0,0|2,0,0]=4 6160 B12R1.21 CC(C)COc1ccc(I)nc1 Amb28127862 [0,2,0,0,0,0|2,0,0]=4 6161 B12R1.21 CC(C)COc1ccc(N)cc1 Amb1124176 [0,2,0,0,0,0|1,0,0]=3 6162 B12R1.21 CC(C)COc1ccc(N)cc1 Amb6541453 [0,2,0,0,0,0|1,0,0]=3 6163 B12R1.21 CC(C)COc1ccc(N)cn1 Amb6250797 [0,2,0,0,0,0|2,0,0]=4 6164 B12R1.21 CC(C)COc1ccc(N)nc1 Amb6679933 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.21 CC(C)COc1ccc(O)cc1 Amb8837235 [0,2,0,0,0,0|1,0,0]=3 6166 B12R1.21 CC(C)COc1ccc(O)cn1 Amb27175693 [0,2,0,0,0,0|2,0,0]=4 6167 B12R1.21 CC(C)COc1ccc(S)cc1 Amb27165240 [0,2,0,0,0,0|1,0,0]=3 6168 B12R1.21 CC(C)CSc1ccc(Br)cc1 Amb26372436 [0,2,0,0,0,0|1,1,0]=4 6169 B12R1.21 CC(C)CSc1ccc(Cl)cc1 Amb25133783 [0,2,0,0,0,0|1,1,0]=4 6170 B12R1.21 CC(C)CSc1ccc(F)cc1 Amb24760114 [0,2,0,0,0,0|1,1,0]=4 6171 B12R1.21 CC(C)CSc1ccc(O)cc1 Amb18321683 [0,2,0,0,0,0|1,1,0]=4 6172 B12R1.21 CC(F)COc1ccc(O)cc1 Amb27429179 [0,2,0,0,0,0|1,0,0]=3 6173 B12R1.21 CC(F)CSc1ccc(O)cc1 Amb28384761 [0,2,0,0,0,0|1,1,0]=4 6174 B12R1.21 CC(N)CCc1ccc(Br)cc1 Amb17991263 [0,2,0,0,0,0|2,0,0]=4 6175 B12R1.21 CC(N)CCc1ccc(Br)cc1 Amb5740113 [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.21 CC(N)CCc1ccc(Cl)cc1 Amb2721944 [0,2,0,0,0,0|2,0,0]=4 6177 B12R1.21 CC(N)CCc1ccc(F)cc1 Amb2721878 [0,2,0,0,0,0|2,0,0]=4 6178 B12R1.21 CC(N)CCc1ccc(I)cc1 Amb26399605 [0,2,0,0,0,0|2,0,0]=4 6179 B12R1.21 CC(N)CCc1ccc(I)cc1 Amb28600239 [0,2,0,0,0,0|2,0,0]=4 6180 B12R1.21 CC(N)CCc1ccc(N)cc1 Amb27267781 [0,2,0,0,0,0|2,0,0]=4 6181 B12R1.21 CC(N)CCc1ccc(O)cc1 Amb495539 [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.21 CC(N)CNc1ccc(Br)cc1 Amb27755338 [0,2,0,0,0,0|2,0,0]=4 6183 B12R1.21 CC(N)CNc1ccc(Cl)cc1 Amb25962673 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.21 CC(N)CNc1ccc(F)cc1 Amb25237265 [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.21 CC(N)COc1ccc(Br)cc1 Amb5724435 [0,2,0,0,0,0|1,0,0]=3 6186 B12R1.21 CC(N)COc1ccc(Br)cn1 Amb35727458 [0,2,0,0,0,0|2,0,0]=4 6187 B12R1.21 CC(N)COc1ccc(Cl)cc1 Amb17224217 [0,2,0,0,0,0|1,0,0]=3 6188 B12R1.21 CC(N)COc1ccc(Cl)cc1 Amb9756356 [0,2,0,0,0,0|1,0,0]=3 6189 B12R1.21 CC(N)COc1ccc(Cl)cn1 Amb35727456 [0,2,0,0,0,0|2,0,0]=4 6190 B12R1.21 CC(N)COc1ccc(F)cc1 Amb10609780 [0,2,0,0,0,0|1,0,0]=3 6191 B12R1.21 CC(N)COc1ccc(F)cc1 Amb1140862 [0,2,0,0,0,0|1,0,0]=3 6192 B12R1.21 CC(N)COc1ccc(F)cn1 Amb35727451 [0,2,0,0,0,0|2,0,0]=4 6193 B12R1.21 CC(N)COc1ccc(N)cc1 Amb27790650 [0,2,0,0,0,0|1,0,0]=3 6194 B12R1.21 CC(N)COc1ccc(O)cc1 Amb27817891 [0,2,0,0,0,0|1,0,0]=3 6195 B12R1.21 CC(N)CSc1ccc(Br)cc1 Amb18576934 [0,2,0,0,0,0|1,1,0]=4 6196 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb18066330 [0,2,0,0,0,0|1,1,0]=4 6197 B12R1.21 CC(N)CSc1ccc(Cl)cc1 Amb21988434 [0,2,0,0,0,0|1,1,0]=4 6198 B12R1.21 CC(N)CSc1ccc(F)cc1 Amb18564329 [0,2,0,0,0,0|1,1,0]=4 6199 B12R1.21 CC(N)CSc1ccc(F)cc1 Amb32662176 [0,2,0,0,0,0|1,1,0]=4 6200 B12R1.21 CC(N)CSc1ccc(O)cc1 Amb25350095 [0,2,0,0,0,0|1,1,0]=4 6201 B12R1.21 CC(O)C#Cc1ccc(Cl)cc1 Amb9777257 [0,2,0,0,0,0|1,0,1]=4 6202 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [0,2,0,0,0,0|1,0,0]=3 6203 B12R1.21 CC(O)CCc1ccc(Br)cn1 Amb26452215 [0,2,0,0,0,0|2,0,0]=4 6204 B12R1.21 CC(O)CCc1ccc(Br)nc1 Amb33388355 [0,2,0,0,0,0|2,0,0]=4 6205 B12R1.21 CC(O)CCc1ccc(Cl)cc1 Amb17507284 [0,2,0,0,0,0|1,0,0]=3 6206 B12R1.21 CC(O)CCc1ccc(Cl)cn1 Amb33220655 [0,2,0,0,0,0|2,0,0]=4 6207 B12R1.21 CC(O)CCc1ccc(Cl)nc1 Amb33261604 [0,2,0,0,0,0|2,0,0]=4 6208 B12R1.21 CC(O)CCc1ccc(F)cc1 Amb17507285 [0,2,0,0,0,0|1,0,0]=3 6209 B12R1.21 CC(O)CCc1ccc(F)cn1 Amb33474973 [0,2,0,0,0,0|2,0,0]=4 6210 B12R1.21 CC(O)CCc1ccc(F)nc1 Amb33426183 [0,2,0,0,0,0|2,0,0]=4 6211 B12R1.21 CC(O)CCc1ccc(I)cc1 Amb27669702 [0,2,0,0,0,0|1,0,0]=3 6212 B12R1.21 CC(O)CCc1ccc(N)cc1 Amb32671893 [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.21 CC(O)CCc1ccc(O)cc1 Amb1110722 [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.21 CC(O)CNc1ccc(Br)cc1 Amb17142609 [0,2,0,0,0,0|1,0,0]=3 6215 B12R1.21 CC(O)CNc1ccc(Cl)cc1 Amb17139127 [0,2,0,0,0,0|1,0,0]=3 6216 B12R1.21 CC(O)CNc1ccc(F)cc1 Amb17138651 [0,2,0,0,0,0|1,0,0]=3 6217 B12R1.21 CC(O)CNc1ccc(F)cn1 Amb18291208 [0,2,0,0,0,0|2,0,0]=4 6218 B12R1.21 CC(O)CNc1ccc(I)cc1 Amb28044330 [0,2,0,0,0,0|1,0,0]=3 6219 B12R1.21 CC(O)CNc1ccc(N)cn1 Amb9359005 [0,2,0,0,0,0|2,0,0]=4 6220 B12R1.21 CC(O)CNc1ccc(N)nc1 Amb9358996 [0,2,0,0,0,0|2,0,0]=4 6221 B12R1.21 CC(O)COc1ccc(Br)cn1 Amb27625283 [0,2,0,0,0,0|1,0,0]=3 6222 B12R1.21 CC(O)COc1ccc(F)cc1 Amb18806455 [0,2,0,0,0,0|0,0,0]=2 6223 B12R1.21 CC(O)COc1ccc(I)cc1 Amb25115077 [0,2,0,0,0,0|0,0,0]=2 6224 B12R1.21 CC(O)COc1ccc(I)nc1 Amb28293802 [0,2,0,0,0,0|1,0,0]=3 6225 B12R1.21 CC(O)CSc1ccc(Br)cc1 Amb27760869 [0,2,0,0,0,0|0,1,0]=3 6226 B12R1.21 CC(O)CSc1ccc(Cl)cc1 Amb2686422 [0,2,0,0,0,0|0,1,0]=3 6227 B12R1.21 CC(O)CSc1ccc(N)nc1 Amb18289455 [0,2,0,0,0,0|1,1,0]=4 6228 B12R1.21 CC(O)\C=C\c1ccc(Br)cc1 Amb26842748 [0,2,0,0,0,0|1,0,1]=4 6229 B12R1.21 CC(O)\C=C\c1ccc(Cl)cc1 Amb26363210 [0,2,0,0,0,0|1,0,1]=4 6230 B12R1.21 CC(O)\C=C\c1ccc(F)cc1 Amb26392384 [0,2,0,0,0,0|1,0,1]=4 6231 B12R1.21 CC(O)\C=C\c1ccc(N)cc1 Amb35622609 [0,2,0,0,0,0|1,0,1]=4 6232 B12R1.21 CC(S)CCc1ccc(O)cc1 Amb7784690 [0,2,0,0,0,0|1,1,0]=4 6233 B12R1.21 C[C@@H](Cl)COc1ccc(N)cc1 Amb27392394 [0,2,0,0,0,0|1,0,0]=3 6234 B12R1.21 C[C@@H](Cl)COc1ccc(O)cc1 Amb27400360 [0,2,0,0,0,0|1,0,0]=3 6235 B12R1.21 C[C@@H](N)CCc1ccc(Br)cc1 Amb33452296 [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.21 C[C@@H](N)CCc1ccc(Cl)cc1 Amb33262570 [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.21 C[C@@H](N)CCc1ccc(F)cc1 Amb27488653 [0,2,0,0,0,0|2,0,0]=4 6238 B12R1.21 C[C@@H](N)CCc1ccc(O)cc1 Amb2699174 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.21 C[C@@H](N)COc1ccc(Br)cc1 Amb18036080 [0,2,0,0,0,0|1,0,0]=3 6240 B12R1.21 C[C@@H](N)COc1ccc(Cl)cc1 Amb18538520 [0,2,0,0,0,0|1,0,0]=3 6241 B12R1.21 C[C@@H](N)COc1ccc(F)cc1 Amb9127959 [0,2,0,0,0,0|1,0,0]=3 6242 B12R1.21 C[C@@H](N)COc1ccc(I)cc1 Amb35687590 [0,2,0,0,0,0|1,0,0]=3 6243 B12R1.21 C[C@@H](N)COc1ccc(N)cc1 Amb27815098 [0,2,0,0,0,0|1,0,0]=3 6244 B12R1.21 C[C@@H](N)COc1ccc(O)cc1 Amb27882724 [0,2,0,0,0,0|1,0,0]=3 6245 B12R1.21 C[C@@H](O)C#Cc1ccc(F)cc1 Amb27214167 [0,2,0,0,0,0|1,0,1]=4 6246 B12R1.21 C[C@@H](O)CCc1ccc(Br)cc1 Amb33118743 [0,2,0,0,0,0|1,0,0]=3 6247 B12R1.21 C[C@@H](O)CCc1ccc(Br)cn1 Amb33477150 [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.21 C[C@@H](O)CCc1ccc(Br)nc1 Amb33388358 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.21 C[C@@H](O)CCc1ccc(Cl)cc1 Amb26323258 [0,2,0,0,0,0|1,0,0]=3 6250 B12R1.21 C[C@@H](O)CCc1ccc(Cl)nc1 Amb33261609 [0,2,0,0,0,0|2,0,0]=4 6251 B12R1.21 C[C@@H](O)CCc1ccc(F)cc1 Amb33376264 [0,2,0,0,0,0|1,0,0]=3 6252 B12R1.21 C[C@@H](O)CCc1ccc(F)cn1 Amb33316400 [0,2,0,0,0,0|2,0,0]=4 6253 B12R1.21 C[C@@H](O)CCc1ccc(F)nc1 Amb33426181 [0,2,0,0,0,0|2,0,0]=4 6254 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [0,2,0,0,0,0|1,0,0]=3 6255 B12R1.21 C[C@@H](O)CNc1ccc(Br)cc1 Amb28244267 [0,2,0,0,0,0|1,0,0]=3 6256 B12R1.21 C[C@@H](O)CNc1ccc(Br)cn1 Amb27762086 [0,2,0,0,0,0|2,0,0]=4 6257 B12R1.21 C[C@@H](O)CNc1ccc(Cl)cc1 Amb27490489 [0,2,0,0,0,0|1,0,0]=3 6258 B12R1.21 C[C@@H](O)CNc1ccc(I)cc1 Amb27478276 [0,2,0,0,0,0|1,0,0]=3 6259 B12R1.21 C[C@@H](O)COc1ccc(Br)cc1 Amb28244311 [0,2,0,0,0,0|0,0,0]=2 6260 B12R1.21 C[C@@H](O)COc1ccc(Cl)cc1 Amb28242499 [0,2,0,0,0,0|0,0,0]=2 6261 B12R1.21 C[C@@H](O)COc1ccc(F)cc1 Amb22351329 [0,2,0,0,0,0|0,0,0]=2 6262 B12R1.21 C[C@@H](O)CSc1ccc(Br)cc1 Amb27257079 [0,2,0,0,0,0|0,1,0]=3 6263 B12R1.21 C[C@@H](O)CSc1ccc(Br)cn1 Amb28369161 [0,2,0,0,0,0|1,1,0]=4 6264 B12R1.21 C[C@@H](O)\C=C\c1ccc(F)cc1 Amb33474738 [0,2,0,0,0,0|1,0,1]=4 6265 B12R1.21 C[C@H](N)CCc1ccc(Br)cc1 Amb27648985 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.21 C[C@H](N)CCc1ccc(Cl)cc1 Amb24702508 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.21 C[C@H](N)CCc1ccc(F)cc1 Amb24624091 [0,2,0,0,0,0|2,0,0]=4 6268 B12R1.21 C[C@H](N)CCc1ccc(O)cc1 Amb2699175 [0,2,0,0,0,0|2,0,0]=4 6269 B12R1.21 C[C@H](N)COc1ccc(I)cc1 Amb35687589 [0,2,0,0,0,0|1,0,0]=3 6270 B12R1.21 C[C@H](N)COc1ccc(O)cc1 Amb28119996 [0,2,0,0,0,0|1,0,0]=3 6271 B12R1.21 C[C@H](N)CSc1ccc(Br)cc1 Amb27453184 [0,2,0,0,0,0|1,1,0]=4 6272 B12R1.21 C[C@H](N)CSc1ccc(Cl)cc1 Amb27416370 [0,2,0,0,0,0|1,1,0]=4 6273 B12R1.21 C[C@H](N)CSc1ccc(F)cc1 Amb27416433 [0,2,0,0,0,0|1,1,0]=4 6274 B12R1.21 C[C@H](O)C#Cc1ccc(Cl)cc1 Amb27472763 [0,2,0,0,0,0|1,0,1]=4 6275 B12R1.21 C[C@H](O)CCc1ccc(Br)cc1 Amb33451473 [0,2,0,0,0,0|1,0,0]=3 6276 B12R1.21 C[C@H](O)CCc1ccc(Br)cn1 Amb33477146 [0,2,0,0,0,0|2,0,0]=4 6277 B12R1.21 C[C@H](O)CCc1ccc(Br)nc1 Amb33388361 [0,2,0,0,0,0|2,0,0]=4 6278 B12R1.21 C[C@H](O)CCc1ccc(Cl)cc1 Amb33052818 [0,2,0,0,0,0|1,0,0]=3 6279 B12R1.21 C[C@H](O)CCc1ccc(Cl)nc1 Amb33261606 [0,2,0,0,0,0|2,0,0]=4 6280 B12R1.21 C[C@H](O)CCc1ccc(F)cc1 Amb33376265 [0,2,0,0,0,0|1,0,0]=3 6281 B12R1.21 C[C@H](O)CCc1ccc(F)cn1 Amb33316401 [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.21 C[C@H](O)CCc1ccc(F)nc1 Amb33426182 [0,2,0,0,0,0|2,0,0]=4 6283 B12R1.21 C[C@H](O)CCc1ccc(O)cc1 Amb27433151 [0,2,0,0,0,0|1,0,0]=3 6284 B12R1.21 C[C@H](O)CNc1ccc(Br)cn1 Amb28283390 [0,2,0,0,0,0|2,0,0]=4 6285 B12R1.21 C[C@H](O)CNc1ccc(Cl)cc1 Amb27658434 [0,2,0,0,0,0|1,0,0]=3 6286 B12R1.21 C[C@H](O)CNc1ccc(Cl)cn1 Amb28316262 [0,2,0,0,0,0|2,0,0]=4 6287 B12R1.21 C[C@H](O)CNc1ccc(I)cc1 Amb27603771 [0,2,0,0,0,0|1,0,0]=3 6288 B12R1.21 C[C@H](O)COc1ccc(Cl)cc1 Amb28255397 [0,2,0,0,0,0|0,0,0]=2 6289 B12R1.21 C[C@H](O)COc1ccc(F)cc1 Amb22351296 [0,2,0,0,0,0|0,0,0]=2 6290 B12R1.21 C[C@H](O)\C=C\c1ccc(Br)cc1 Amb27495626 [0,2,0,0,0,0|1,0,1]=4 6291 B12R1.21 C[C@H](O)\C=C\c1ccc(F)cc1 Amb33080147 [0,2,0,0,0,0|1,0,1]=4 6292 B12R1.21 Cc1ccc(C#CC(C)O)cc1 Amb27240878 [0,2,0,0,0,0|1,0,1]=4 6293 B12R1.21 Cc1ccc(CCB(O)O)cc1 Amb26580701 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.21 Cc1ccc(CCC(=O)O)cc1 Amb1225383 [0,2,0,0,0,0|1,0,1]=4 6295 B12R1.21 Cc1ccc(CCC(C)N)cc1 Amb5740106 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [0,2,0,0,0,0|1,0,0]=3 6297 B12R1.21 Cc1ccc(CCC(C)O)cn1 Amb26430952 [0,2,0,0,0,0|2,0,0]=4 6298 B12R1.21 Cc1ccc(CCC(C)O)nc1 Amb26977119 [0,2,0,0,0,0|2,0,0]=4 6299 B12R1.21 Cc1ccc(CC[C@@H](C)N)cc1 Amb32953185 [0,2,0,0,0,0|2,0,0]=4 6300 B12R1.21 Cc1ccc(CC[C@@H](C)O)cc1 Amb27472608 [0,2,0,0,0,0|1,0,0]=3 6301 B12R1.21 Cc1ccc(CC[C@@H](C)O)cn1 Amb32877845 [0,2,0,0,0,0|2,0,0]=4 6302 B12R1.21 Cc1ccc(CC[C@@H](C)O)nc1 Amb33226164 [0,2,0,0,0,0|2,0,0]=4 6303 B12R1.21 Cc1ccc(CC[C@H](C)N)cc1 Amb26518763 [0,2,0,0,0,0|2,0,0]=4 6304 B12R1.21 Cc1ccc(CC[C@H](C)O)cc1 Amb33373954 [0,2,0,0,0,0|1,0,0]=3 6305 B12R1.21 Cc1ccc(CC[C@H](C)O)cn1 Amb32877847 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.21 Cc1ccc(CC[C@H](C)O)nc1 Amb33198472 [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.21 Cc1ccc(NCC(=O)O)cc1 Amb1106469 [0,2,0,0,0,0|1,0,1]=4 6308 B12R1.21 Cc1ccc(NCC(C)C)cc1 Amb32663758 [0,2,0,0,0,0|2,0,0]=4 6309 B12R1.21 Cc1ccc(NCC(C)C)cc1 Amb6700775 [0,2,0,0,0,0|2,0,0]=4 6310 B12R1.21 Cc1ccc(NCC(C)N)cc1 Amb22410806 [0,2,0,0,0,0|2,0,0]=4 6311 B12R1.21 Cc1ccc(NCC(C)O)cc1 Amb17138594 [0,2,0,0,0,0|1,0,0]=3 6312 B12R1.21 Cc1ccc(NCC(F)F)cc1 Amb16229928 [0,2,0,0,0,0|2,0,0]=4 6313 B12R1.21 Cc1ccc(NCC(O)O)cc1 Amb28385053 [0,2,0,0,0,0|1,0,0]=3 6314 B12R1.21 Cc1ccc(NC[C@H](C)O)cc1 Amb28342717 [0,2,0,0,0,0|1,0,0]=3 6315 B12R1.21 Cc1ccc(OCC(=O)Cl)cc1 Amb10880011 [0,2,0,0,0,0|0,0,2]=4 6316 B12R1.21 Cc1ccc(OCC(=O)O)cc1 Amb6336447 [0,2,0,0,0,0|0,0,1]=3 6317 B12R1.21 Cc1ccc(OCC(=O)O)cn1 Amb18991754 [0,2,0,0,0,0|1,0,1]=4 6318 B12R1.21 Cc1ccc(OCC(=O)O)nc1 Amb24359369 [0,2,0,0,0,0|1,0,1]=4 6319 B12R1.21 Cc1ccc(OCC(C)N)cc1 Amb9756349 [0,2,0,0,0,0|1,0,0]=3 6320 B12R1.21 Cc1ccc(OCC(C)N)cn1 Amb28077664 [0,2,0,0,0,0|2,0,0]=4 6321 B12R1.21 Cc1ccc(OCC(C)N)nc1 Amb35727435 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.21 Cc1ccc(OCC(C)O)nc1 Amb27752673 [0,2,0,0,0,0|1,0,0]=3 6323 B12R1.21 Cc1ccc(OCC(F)F)cc1 Amb27815990 [0,2,0,0,0,0|1,0,0]=3 6324 B12R1.21 Cc1ccc(OCC(N)=O)cc1 Amb6346004 [0,2,0,0,0,0|0,0,2]=4 6325 B12R1.21 Cc1ccc(OCC(N)=S)cc1 Amb5542109 [0,2,0,0,0,0|0,1,1]=4 6326 B12R1.21 Cc1ccc(OC[C@@H](C)N)cc1 Amb18538493 [0,2,0,0,0,0|1,0,0]=3 6327 B12R1.21 Cc1ccc(OC[C@H](C)O)cc1 Amb27177948 [0,2,0,0,0,0|0,0,0]=2 6328 B12R1.21 Cc1ccc(SCC(=O)O)cc1 Amb1197696 [0,2,0,0,0,0|0,1,1]=4 6329 B12R1.21 Cc1ccc(SCC(C)Cl)cc1 Amb27797299 [0,2,0,0,0,0|1,1,0]=4 6330 B12R1.21 Cc1ccc(SCC(C)N)cc1 Amb18564186 [0,2,0,0,0,0|1,1,0]=4 6331 B12R1.21 Cc1ccc(SCC(C)N)cc1 Amb21988435 [0,2,0,0,0,0|1,1,0]=4 6332 B12R1.21 Cc1ccc(SCC(C)O)cc1 Amb19054498 [0,2,0,0,0,0|0,1,0]=3 6333 B12R1.21 Cc1ccc(SC[C@@H](C)N)cc1 Amb27426658 [0,2,0,0,0,0|1,1,0]=4 6334 B12R1.21 Cc1ccc(\C=C\C(C)O)cc1 Amb24707156 [0,2,0,0,0,0|1,0,1]=4 6335 B12R1.21 FC(F)COc1ccc(Br)cn1 Amb27643433 [0,2,0,0,0,0|2,0,0]=4 6336 B12R1.21 FC(F)COc1ccc(Cl)cc1 Amb27882556 [0,2,0,0,0,0|1,0,0]=3 6337 B12R1.21 FC(F)COc1ccc(Cl)cn1 Amb32664866 [0,2,0,0,0,0|2,0,0]=4 6338 B12R1.21 FC(F)COc1ccc(Cl)nc1 Amb25892821 [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.21 FC(F)COc1ccc(I)cc1 Amb24056924 [0,2,0,0,0,0|1,0,0]=3 6340 B12R1.21 FC(F)COc1ccc(I)nc1 Amb27660440 [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.21 FC(F)CSc1ccc(Br)cc1 Amb28318349 [0,2,0,0,0,0|1,1,0]=4 6342 B12R1.21 FC(F)CSc1ccc(Cl)cc1 Amb28184796 [0,2,0,0,0,0|1,1,0]=4 6343 B12R1.21 Fc1ccc(NCC(F)F)cc1 Amb18795535 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.21 Fc1ccc(OCC(F)F)cc1 Amb28071875 [0,2,0,0,0,0|1,0,0]=3 6345 B12R1.21 Fc1ccc(SCC(F)F)cc1 Amb27178604 [0,2,0,0,0,0|1,1,0]=4 6346 B12R1.21 N=C(N)COc1ccc(Br)cc1 Amb6260282 [0,2,0,0,0,0|1,0,1]=4 6347 B12R1.21 N=C(N)COc1ccc(Br)cc1 Amb8626962 [0,2,0,0,0,0|1,0,1]=4 6348 B12R1.21 N=C(N)COc1ccc(Cl)cc1 Amb2697781 [0,2,0,0,0,0|1,0,1]=4 6349 B12R1.21 N=C(N)COc1ccc(Cl)cc1 Amb6259791 [0,2,0,0,0,0|1,0,1]=4 6350 B12R1.21 N=C(N)COc1ccc(F)cc1 Amb19894602 [0,2,0,0,0,0|1,0,1]=4 6351 B12R1.21 N=C(N)COc1ccc(F)cc1 Amb6268607 [0,2,0,0,0,0|1,0,1]=4 6352 B12R1.21 N=C(N)COc1ccc(N)cc1 Amb27810600 [0,2,0,0,0,0|1,0,1]=4 6353 B12R1.21 NC(=O)COc1ccc(Br)cc1 Amb6275646 [0,2,0,0,0,0|0,0,2]=4 6354 B12R1.21 NC(=O)COc1ccc(Cl)cc1 Amb2772617 [0,2,0,0,0,0|0,0,2]=4 6355 B12R1.21 NC(=O)COc1ccc(F)cc1 Amb2456996 [0,2,0,0,0,0|0,0,2]=4 6356 B12R1.21 NC(=O)COc1ccc(I)cc1 Amb173371 [0,2,0,0,0,0|0,0,2]=4 6357 B12R1.21 NC(=O)COc1ccc(N)cc1 Amb33536515 [0,2,0,0,0,0|0,0,2]=4 6358 B12R1.21 NC(=O)COc1ccc(O)cc1 Amb8837230 [0,2,0,0,0,0|0,0,2]=4 6359 B12R1.21 NC(=S)COc1ccc(Cl)cc1 Amb2770306 [0,2,0,0,0,0|0,1,1]=4 6360 B12R1.21 NC(=S)COc1ccc(F)cc1 Amb1106123 [0,2,0,0,0,0|0,1,1]=4 6361 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb30588024 [0,2,0,0,0,0|1,0,1]=4 6362 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb6315800 [0,2,0,0,0,0|1,0,1]=4 6363 B12R1.21 Nc1ccc(CCC(F)F)cc1 Amb27481936 [0,2,0,0,0,0|2,0,0]=4 6364 B12R1.21 Nc1ccc(NCC(=O)O)cc1 Amb18296058 [0,2,0,0,0,0|1,0,1]=4 6365 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb1034889 [0,2,0,0,0,0|0,0,1]=3 6366 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb2608856 [0,2,0,0,0,0|0,0,1]=3 6367 B12R1.21 Nc1ccc(OCC(F)F)cc1 Amb22280478 [0,2,0,0,0,0|1,0,0]=3 6368 B12R1.21 Nc1ccc(OCC(F)F)cc1 Amb6890876 [0,2,0,0,0,0|1,0,0]=3 6369 B12R1.21 Nc1ccc(OCC(F)F)cn1 Amb25993516 [0,2,0,0,0,0|2,0,0]=4 6370 B12R1.21 Nc1ccc(OCC(F)F)nc1 Amb22280516 [0,2,0,0,0,0|2,0,0]=4 6371 B12R1.21 Nc1ccc(OCC(F)F)nc1 Amb6891682 [0,2,0,0,0,0|2,0,0]=4 6372 B12R1.21 Nc1ccc(SCC(=O)O)cc1 Amb2684510 [0,2,0,0,0,0|0,1,1]=4 6373 B12R1.21 Nc1ccc(SCC(F)F)cc1 Amb19060393 [0,2,0,0,0,0|1,1,0]=4 6374 B12R1.21 O=C(Cl)COc1ccc(Br)cc1 Amb16186415 [0,2,0,0,0,0|0,0,2]=4 6375 B12R1.21 O=C(Cl)COc1ccc(Cl)cc1 Amb2716229 [0,2,0,0,0,0|0,0,2]=4 6376 B12R1.21 O=C(Cl)COc1ccc(F)cc1 Amb844299 [0,2,0,0,0,0|0,0,2]=4 6377 B12R1.21 O=C(Cl)COc1ccc(I)cc1 Amb28131033 [0,2,0,0,0,0|0,0,2]=4 6378 B12R1.21 O=C(O)CCc1ccc(Br)cc1 Amb1220330 [0,2,0,0,0,0|1,0,1]=4 6379 B12R1.21 O=C(O)CCc1ccc(Cl)cc1 Amb1093991 [0,2,0,0,0,0|1,0,1]=4 6380 B12R1.21 O=C(O)CCc1ccc(F)cc1 Amb1214879 [0,2,0,0,0,0|1,0,1]=4 6381 B12R1.21 O=C(O)CCc1ccc(I)cc1 Amb6297807 [0,2,0,0,0,0|1,0,1]=4 6382 B12R1.21 O=C(O)CCc1ccc(O)cc1 Amb533172 [0,2,0,0,0,0|1,0,1]=4 6383 B12R1.21 O=C(O)CCc1ccc(S)cc1 Amb6296145 [0,2,0,0,0,0|1,0,1]=4 6384 B12R1.21 O=C(O)CNc1ccc(Br)cc1 Amb1981434 [0,2,0,0,0,0|1,0,1]=4 6385 B12R1.21 O=C(O)CNc1ccc(Cl)cc1 Amb1486152 [0,2,0,0,0,0|1,0,1]=4 6386 B12R1.21 O=C(O)CNc1ccc(F)cc1 Amb840523 [0,2,0,0,0,0|1,0,1]=4 6387 B12R1.21 O=C(O)CNc1ccc(I)cc1 Amb4598598 [0,2,0,0,0,0|1,0,1]=4 6388 B12R1.21 O=C(O)CNc1ccc(O)cc1 Amb1950558 [0,2,0,0,0,0|1,0,1]=4 6389 B12R1.21 O=C(O)COc1ccc(Br)cc1 Amb6336449 [0,2,0,0,0,0|0,0,1]=3 6390 B12R1.21 O=C(O)COc1ccc(Br)cn1 Amb8439031 [0,2,0,0,0,0|1,0,1]=4 6391 B12R1.21 O=C(O)COc1ccc(Br)nc1 Amb32946300 [0,2,0,0,0,0|1,0,1]=4 6392 B12R1.21 O=C(O)COc1ccc(Cl)cc1 Amb1830178 [0,2,0,0,0,0|0,0,1]=3 6393 B12R1.21 O=C(O)COc1ccc(Cl)cn1 Amb33543498 [0,2,0,0,0,0|1,0,1]=4 6394 B12R1.21 O=C(O)COc1ccc(Cl)nc1 Amb28138011 [0,2,0,0,0,0|1,0,1]=4 6395 B12R1.21 O=C(O)COc1ccc(F)cc1 Amb1210357 [0,2,0,0,0,0|0,0,1]=3 6396 B12R1.21 O=C(O)COc1ccc(F)cn1 Amb24748685 [0,2,0,0,0,0|1,0,1]=4 6397 B12R1.21 O=C(O)COc1ccc(F)nc1 Amb26424670 [0,2,0,0,0,0|1,0,1]=4 6398 B12R1.21 O=C(O)COc1ccc(I)cc1 Amb1152251 [0,2,0,0,0,0|0,0,1]=3 6399 B12R1.21 O=C(O)COc1ccc(O)cc1 Amb2819510 [0,2,0,0,0,0|0,0,1]=3 6400 B12R1.21 O=C(O)CSc1ccc(Br)cc1 Amb1208368 [0,2,0,0,0,0|0,1,1]=4 6401 B12R1.21 O=C(O)CSc1ccc(Cl)cc1 Amb6335201 [0,2,0,0,0,0|0,1,1]=4 6402 B12R1.21 O=C(O)CSc1ccc(F)cc1 Amb1209262 [0,2,0,0,0,0|0,1,1]=4 6403 B12R1.21 O=C(O)CSc1ccc(O)cc1 Amb18291566 [0,2,0,0,0,0|0,1,1]=4 6404 B12R1.21 O=C([O-])COc1ccc(Cl)cc1 Amb8383883 [0,2,0,0,0,0|0,0,2]=4 6405 B12R1.21 O=C1C=CC(=NCC(=O)O)C=C1 Amb26847942 [0,2,0,0,0,0|1,0,1]=4 6406 B12R1.21 O=C1C=CN(OCC(=O)O)C=C1 Amb18647100 [0,2,0,0,0,0|1,0,1]=4 6407 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.21 Oc1ccc(OCC(F)F)cc1 Amb18795190 [0,2,0,0,0,0|1,0,0]=3 6409 B12R1.49 C=C(CO)Cc1ccc(Cl)cc1 Amb28249107 [0,2,0,0,0,0|1,0,1]=4 6410 B12R1.49 C=C(CO)Sc1ccc(C)cc1 Amb27451952 [0,2,0,0,0,0|0,1,1]=4 6411 B12R1.49 C=CC(C)Oc1ccc(Br)cc1 Amb25893737 [0,2,0,0,0,0|1,0,1]=4 6412 B12R1.49 C=CC(C)Oc1ccc(F)cc1 Amb27807106 [0,2,0,0,0,0|1,0,1]=4 6413 B12R1.49 C=CC(C)Oc1ccc(N)cc1 Amb18990276 [0,2,0,0,0,0|1,0,1]=4 6414 B12R1.49 C=CC(C)Oc1ccc(O)cc1 Amb18798279 [0,2,0,0,0,0|1,0,1]=4 6415 B12R1.49 CC(C#N)Oc1ccc(F)cc1 Amb5780975 [0,2,0,0,0,0|1,0,1]=4 6416 B12R1.49 CC(C#N)Oc1ccc(O)cc1 Amb18798180 [0,2,0,0,0,0|1,0,1]=4 6417 B12R1.49 CC(C=O)Oc1ccc(Br)cc1 Amb30020612 [0,2,0,0,0,0|0,0,2]=4 6418 B12R1.49 CC(C=O)Oc1ccc(Cl)cc1 Amb27619207 [0,2,0,0,0,0|0,0,2]=4 6419 B12R1.49 CC(C=O)Oc1ccc(F)cc1 Amb30020594 [0,2,0,0,0,0|0,0,2]=4 6420 B12R1.49 CC(C=O)Oc1ccc(I)cc1 Amb30020617 [0,2,0,0,0,0|0,0,2]=4 6421 B12R1.49 CC(CBr)Cc1ccc(Br)cc1 Amb25366059 [0,2,0,0,0,0|2,0,0]=4 6422 B12R1.49 CC(CBr)Cc1ccc(Cl)cc1 Amb25874244 [0,2,0,0,0,0|2,0,0]=4 6423 B12R1.49 CC(CBr)Cc1ccc(F)cc1 Amb25115291 [0,2,0,0,0,0|2,0,0]=4 6424 B12R1.49 CC(CBr)Cc1ccc(I)cc1 Amb26510549 [0,2,0,0,0,0|2,0,0]=4 6425 B12R1.49 CC(CBr)Cc1ccc(O)cc1 Amb25892811 [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.49 CC(CBr)Oc1ccc(Cl)cc1 Amb17261131 [0,2,0,0,0,0|1,0,0]=3 6427 B12R1.49 CC(CBr)Oc1ccc(F)cc1 Amb17250551 [0,2,0,0,0,0|1,0,0]=3 6428 B12R1.49 CC(CCl)Cc1ccc(Br)cc1 Amb27956125 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.49 CC(CCl)Cc1ccc(Cl)cc1 Amb26841031 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.49 CC(CCl)Cc1ccc(F)cc1 Amb27669774 [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.49 CC(CCl)Cc1ccc(I)cc1 Amb26040389 [0,2,0,0,0,0|2,0,0]=4 6432 B12R1.49 CC(CCl)Cc1ccc(O)cc1 Amb25892809 [0,2,0,0,0,0|2,0,0]=4 6433 B12R1.49 CC(CCl)Oc1ccc(Br)cc1 Amb17261134 [0,2,0,0,0,0|1,0,0]=3 6434 B12R1.49 CC(CCl)Oc1ccc(Cl)cc1 Amb17238291 [0,2,0,0,0,0|1,0,0]=3 6435 B12R1.49 CC(CCl)Oc1ccc(F)cc1 Amb17234615 [0,2,0,0,0,0|1,0,0]=3 6436 B12R1.49 CC(CN)Cc1ccc(Cl)cc1 Amb5743848 [0,2,0,0,0,0|2,0,0]=4 6437 B12R1.49 CC(CN)Cc1ccc(F)cc1 Amb5743841 [0,2,0,0,0,0|2,0,0]=4 6438 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,2,0,0,0,0|2,0,0]=4 6439 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,2,0,0,0,0|2,0,0]=4 6440 B12R1.49 CC(CN)Nc1ccc(I)cc1 Amb28322506 [0,2,0,0,0,0|2,0,0]=4 6441 B12R1.49 CC(CN)Nc1ccc(O)cc1 Amb27614615 [0,2,0,0,0,0|2,0,0]=4 6442 B12R1.49 CC(CN)Oc1ccc(Br)cc1 Amb33530518 [0,2,0,0,0,0|1,0,0]=3 6443 B12R1.49 CC(CN)Oc1ccc(Cl)cc1 Amb32666107 [0,2,0,0,0,0|1,0,0]=3 6444 B12R1.49 CC(CN)Oc1ccc(Cl)cc1 Amb33530519 [0,2,0,0,0,0|1,0,0]=3 6445 B12R1.49 CC(CN)Oc1ccc(F)cc1 Amb2089060 [0,2,0,0,0,0|1,0,0]=3 6446 B12R1.49 CC(CN)Oc1ccc(F)cc1 Amb3938898 [0,2,0,0,0,0|1,0,0]=3 6447 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb18992812 [0,2,0,0,0,0|1,1,0]=4 6448 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb19350751 [0,2,0,0,0,0|1,1,0]=4 6449 B12R1.49 CC(CN)Sc1ccc(Cl)cc1 Amb17485977 [0,2,0,0,0,0|1,1,0]=4 6450 B12R1.49 CC(CN)Sc1ccc(Cl)cc1 Amb32662227 [0,2,0,0,0,0|1,1,0]=4 6451 B12R1.49 CC(CN)Sc1ccc(F)cc1 Amb18992823 [0,2,0,0,0,0|1,1,0]=4 6452 B12R1.49 CC(CN)Sc1ccc(F)cc1 Amb32662234 [0,2,0,0,0,0|1,1,0]=4 6453 B12R1.49 CC(CO)Cc1ccc(Br)cc1 Amb27794524 [0,2,0,0,0,0|1,0,0]=3 6454 B12R1.49 CC(CO)Cc1ccc(Cl)cc1 Amb26398800 [0,2,0,0,0,0|1,0,0]=3 6455 B12R1.49 CC(CO)Cc1ccc(F)cc1 Amb26963530 [0,2,0,0,0,0|1,0,0]=3 6456 B12R1.49 CC(CO)Cc1ccc(F)nc1 Amb33749639 [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.49 CC(CO)Nc1ccc(Br)cn1 Amb9360478 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.49 CC(CO)Nc1ccc(Br)nc1 Amb27163924 [0,2,0,0,0,0|2,0,0]=4 6459 B12R1.49 CC(CO)Nc1ccc(Cl)cc1 Amb18290161 [0,2,0,0,0,0|1,0,0]=3 6460 B12R1.49 CC(CO)Nc1ccc(N)cc1 Amb9359036 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.49 CC(CO)Oc1ccc(Br)cc1 Amb17249278 [0,2,0,0,0,0|0,0,0]=2 6462 B12R1.49 CC(CO)Oc1ccc(Cl)cc1 Amb17234358 [0,2,0,0,0,0|0,0,0]=2 6463 B12R1.49 CC(CO)Oc1ccc(F)cc1 Amb17232741 [0,2,0,0,0,0|0,0,0]=2 6464 B12R1.49 CC(CO)Oc1ccc(I)cc1 Amb24379893 [0,2,0,0,0,0|0,0,0]=2 6465 B12R1.49 CC(CO)Oc1ccc(N)cc1 Amb27973348 [0,2,0,0,0,0|0,0,0]=2 6466 B12R1.49 CC(CO)Sc1ccc(Br)cc1 Amb23449854 [0,2,0,0,0,0|0,1,0]=3 6467 B12R1.49 CC(CO)Sc1ccc(O)cc1 Amb27272964 [0,2,0,0,0,0|0,1,0]=3 6468 B12R1.49 CC(Cc1ccc(Cl)cc1)NO Amb27751580 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.49 CC(Cc1ccc(F)cc1)NO Amb28255996 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.49 CCC(=O)Oc1ccc(Br)cc1 Amb3124761 [0,2,0,0,0,0|1,0,1]=4 6471 B12R1.49 CCC(=O)Oc1ccc(C)cc1 Amb26984286 [0,2,0,0,0,0|1,0,1]=4 6472 B12R1.49 CCC(=O)Oc1ccc(N)cc1 Amb18646257 [0,2,0,0,0,0|1,0,1]=4 6473 B12R1.49 CCC(=O)Oc1ccc(O)cc1 Amb18646456 [0,2,0,0,0,0|1,0,1]=4 6474 B12R1.49 CCC(C)Nc1ccc(Br)cc1 Amb6696561 [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.49 CCC(C)Nc1ccc(C)cc1 Amb6700867 [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.49 CCC(C)Nc1ccc(Cl)cc1 Amb6695985 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.49 CCC(C)Nc1ccc(F)cc1 Amb6696817 [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.49 CCC(C)Nc1ccc(N)cc1 Amb7767483 [0,2,0,0,0,0|2,0,0]=4 6479 B12R1.49 CCC(C)Oc1ccc(Br)cc1 Amb6740546 [0,2,0,0,0,0|1,0,0]=3 6480 B12R1.49 CCC(C)Oc1ccc(Br)nc1 Amb26477016 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.49 CCC(C)Oc1ccc(Cl)cc1 Amb8629128 [0,2,0,0,0,0|1,0,0]=3 6482 B12R1.49 CCC(C)Oc1ccc(I)cc1 Amb27753794 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.49 CCC(C)Oc1ccc(N)cc1 Amb9702228 [0,2,0,0,0,0|1,0,0]=3 6484 B12R1.49 CCC(C)Oc1ccc(N)cn1 Amb17093693 [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.49 CCC(C)Oc1ccc(N)nc1 Amb18969750 [0,2,0,0,0,0|2,0,0]=4 6486 B12R1.49 CCC(C)Oc1ccc(O)cc1 Amb8837279 [0,2,0,0,0,0|1,0,0]=3 6487 B12R1.49 CCC(Cl)Cc1ccc(C)cc1 Amb17477426 [0,2,0,0,0,0|2,0,0]=4 6488 B12R1.49 CCC(N)Cc1ccc(Br)cc1 Amb28555695 [0,2,0,0,0,0|2,0,0]=4 6489 B12R1.49 CCC(N)Cc1ccc(Br)cc1 Amb9428935 [0,2,0,0,0,0|2,0,0]=4 6490 B12R1.49 CCC(N)Cc1ccc(C)cc1 Amb9428909 [0,2,0,0,0,0|2,0,0]=4 6491 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [0,2,0,0,0,0|2,0,0]=4 6492 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb9428934 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.49 CCC(N)Cc1ccc(F)cc1 Amb28555694 [0,2,0,0,0,0|2,0,0]=4 6494 B12R1.49 CCC(N)Cc1ccc(F)cc1 Amb9428931 [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.49 CCC(N)Cc1ccc(O)cc1 Amb33552371 [0,2,0,0,0,0|2,0,0]=4 6497 B12R1.49 CCC(N)Cc1ccc(O)cc1 Amb9428939 [0,2,0,0,0,0|2,0,0]=4 6498 B12R1.49 CCC(O)Cc1ccc(Br)cc1 Amb17477579 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.49 CCC(O)Cc1ccc(C)cc1 Amb17138583 [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.49 CCC(O)Cc1ccc(Cl)cc1 Amb17139103 [0,2,0,0,0,0|2,0,0]=4 6501 B12R1.49 CCC(O)Cc1ccc(F)cc1 Amb17138637 [0,2,0,0,0,0|2,0,0]=4 6502 B12R1.49 CCC(O)Cc1ccc(N)cc1 Amb35588641 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.49 CCC(O)Cc1ccc(O)cc1 Amb28239277 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.49 CCC(O)Sc1ccc(C)cc1 Amb22228345 [0,2,0,0,0,0|1,1,0]=4 6505 B12R1.49 CC[C@@H](C)Cc1ccc(O)cc1 Amb27806960 [0,2,0,0,0,0|2,0,0]=4 6506 B12R1.49 CC[C@@H](N)Cc1ccc(Br)cc1 Amb27830392 [0,2,0,0,0,0|2,0,0]=4 6507 B12R1.49 CC[C@H](C)Cc1ccc(N)cc1 Amb27411906 [0,2,0,0,0,0|2,0,0]=4 6508 B12R1.49 CC[C@H](C)Cc1ccc(O)cc1 Amb27267991 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.49 CC[C@H](N)Cc1ccc(Br)cc1 Amb27840450 [0,2,0,0,0,0|2,0,0]=4 6510 B12R1.49 CC[C@H](N)Cc1ccc(C)cc1 Amb28203344 [0,2,0,0,0,0|2,0,0]=4 6511 B12R1.49 C[C@@H](CN)Cc1ccc(F)cc1 Amb33738467 [0,2,0,0,0,0|2,0,0]=4 6512 B12R1.49 C[C@@H](CN)Oc1ccc(Br)cc1 Amb27633164 [0,2,0,0,0,0|1,0,0]=3 6513 B12R1.49 C[C@@H](CN)Oc1ccc(Cl)cc1 Amb28600276 [0,2,0,0,0,0|1,0,0]=3 6514 B12R1.49 C[C@@H](CO)Cc1ccc(F)cc1 Amb27150747 [0,2,0,0,0,0|1,0,0]=3 6515 B12R1.49 C[C@@H](CO)Cc1ccc(F)nc1 Amb33738954 [0,2,0,0,0,0|2,0,0]=4 6516 B12R1.49 C[C@@H](CO)Nc1ccc(Br)cn1 Amb25369644 [0,2,0,0,0,0|2,0,0]=4 6517 B12R1.49 C[C@@H](CO)Nc1ccc(N)cn1 Amb27477782 [0,2,0,0,0,0|2,0,0]=4 6518 B12R1.49 C[C@@H](CO)Oc1ccc(Cl)cc1 Amb25179930 [0,2,0,0,0,0|0,0,0]=2 6519 B12R1.49 C[C@H](CN)Cc1ccc(F)cc1 Amb33737554 [0,2,0,0,0,0|2,0,0]=4 6520 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.49 C[C@H](CO)Cc1ccc(F)nc1 Amb33748168 [0,2,0,0,0,0|2,0,0]=4 6522 B12R1.49 C\C(=C\c1ccc(O)cc1)CO Amb27490394 [0,2,0,0,0,0|1,0,1]=4 6523 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [0,2,0,0,0,0|1,0,1]=4 6524 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [0,2,0,0,0,0|2,0,0]=4 6525 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [0,2,0,0,0,0|2,0,0]=4 6526 B12R1.49 Cc1ccc(CC(C)CN)cc1 Amb5743839 [0,2,0,0,0,0|2,0,0]=4 6527 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,2,0,0,0,0|1,0,0]=3 6528 B12R1.49 Cc1ccc(CC(C)CO)cn1 Amb28341927 [0,2,0,0,0,0|2,0,0]=4 6529 B12R1.49 Cc1ccc(CC(C)NO)cc1 Amb27602730 [0,2,0,0,0,0|2,0,0]=4 6530 B12R1.49 Cc1ccc(CC(Cl)CO)cc1 Amb28365747 [0,2,0,0,0,0|1,0,0]=3 6531 B12R1.49 Cc1ccc(CC(N)CN)cc1 Amb26983073 [0,2,0,0,0,0|2,0,0]=4 6532 B12R1.49 Cc1ccc(CC(N)CN)cc1 Amb32684625 [0,2,0,0,0,0|2,0,0]=4 6533 B12R1.49 Cc1ccc(CC(N)CO)cc1 Amb17062687 [0,2,0,0,0,0|1,0,0]=3 6534 B12R1.49 Cc1ccc(CC(N)CO)cc1 Amb28872400 [0,2,0,0,0,0|1,0,0]=3 6535 B12R1.49 Cc1ccc(CC(N)CO)cn1 Amb32879680 [0,2,0,0,0,0|2,0,0]=4 6536 B12R1.49 Cc1ccc(CC(N)CO)nc1 Amb33198853 [0,2,0,0,0,0|2,0,0]=4 6537 B12R1.49 Cc1ccc(CC(O)CCl)cc1 Amb4035233 [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.49 Cc1ccc(CC(O)CN)cc1 Amb17232550 [0,2,0,0,0,0|2,0,0]=4 6539 B12R1.49 Cc1ccc(CC(O)CO)cc1 Amb27840444 [0,2,0,0,0,0|1,0,0]=3 6540 B12R1.49 Cc1ccc(C[C@@H](C)CN)cc1 Amb33732141 [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,2,0,0,0,0|1,0,0]=3 6542 B12R1.49 Cc1ccc(C[C@@H](O)CO)cc1 Amb27458003 [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.49 Cc1ccc(C[C@H](C)CN)cc1 Amb33737241 [0,2,0,0,0,0|2,0,0]=4 6544 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,2,0,0,0,0|1,0,0]=3 6545 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [0,2,0,0,0,0|1,0,0]=3 6546 B12R1.49 Cc1ccc(NC(=O)CO)cc1 Amb33526618 [0,2,0,0,0,0|1,0,1]=4 6547 B12R1.49 Cc1ccc(NC(C)CN)cc1 Amb18646166 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.49 Cc1ccc(OC(=O)CN)cc1 Amb17334636 [0,2,0,0,0,0|1,0,1]=4 6549 B12R1.49 Cc1ccc(OC(=O)CN)cc1 Amb19115308 [0,2,0,0,0,0|1,0,1]=4 6550 B12R1.49 Cc1ccc(OC(=O)CO)cn1 Amb27426671 [0,2,0,0,0,0|1,0,1]=4 6551 B12R1.49 Cc1ccc(OC(C)C#N)cc1 Amb5780943 [0,2,0,0,0,0|1,0,1]=4 6552 B12R1.49 Cc1ccc(OC(C)C=O)cc1 Amb27827460 [0,2,0,0,0,0|0,0,2]=4 6553 B12R1.49 Cc1ccc(OC(C)CBr)cc1 Amb17248433 [0,2,0,0,0,0|1,0,0]=3 6554 B12R1.49 Cc1ccc(OC(C)CCl)cc1 Amb17234170 [0,2,0,0,0,0|1,0,0]=3 6555 B12R1.49 Cc1ccc(OC(C)CN)cc1 Amb2786584 [0,2,0,0,0,0|1,0,0]=3 6556 B12R1.49 Cc1ccc(OC(C)CO)cc1 Amb17232602 [0,2,0,0,0,0|0,0,0]=2 6557 B12R1.49 Cc1ccc(SC(C)CN)cc1 Amb17485974 [0,2,0,0,0,0|1,1,0]=4 6558 B12R1.49 Cc1ccc(SC(C)CO)nc1 Amb27465592 [0,2,0,0,0,0|1,1,0]=4 6559 B12R1.49 NC(CO)Cc1cc[n+]([O-])cc1 Amb27883106 [0,2,0,0,0,0|2,0,0]=4 6560 B12R1.49 NC(CO)Cc1ccc(Br)cc1 Amb17062713 [0,2,0,0,0,0|1,0,0]=3 6561 B12R1.49 NC(CO)Cc1ccc(Br)cn1 Amb26500211 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.49 NC(CO)Cc1ccc(Br)nc1 Amb25200151 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.49 NC(CO)Cc1ccc(Cl)cc1 Amb2719800 [0,2,0,0,0,0|1,0,0]=3 6564 B12R1.49 NC(CO)Cc1ccc(Cl)cc1 Amb30640025 [0,2,0,0,0,0|1,0,0]=3 6565 B12R1.49 NC(CO)Cc1ccc(Cl)cn1 Amb33220654 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.49 NC(CO)Cc1ccc(Cl)nc1 Amb27253397 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.49 NC(CO)Cc1ccc(F)cc1 Amb17062689 [0,2,0,0,0,0|1,0,0]=3 6568 B12R1.49 NC(CO)Cc1ccc(F)cc1 Amb28600205 [0,2,0,0,0,0|1,0,0]=3 6569 B12R1.49 NC(CO)Cc1ccc(F)cn1 Amb33315885 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.49 NC(CO)Cc1ccc(F)nc1 Amb33426219 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [0,2,0,0,0,0|1,0,0]=3 6572 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb33362381 [0,2,0,0,0,0|1,0,0]=3 6573 B12R1.49 NC(CO)Cc1ccc(O)cc1 Amb17062710 [0,2,0,0,0,0|1,0,0]=3 6574 B12R1.49 NC(CO)Cc1ccc(O)cc1 Amb32665844 [0,2,0,0,0,0|1,0,0]=3 6575 B12R1.49 NCC(=O)Oc1ccc(Br)cc1 Amb17344448 [0,2,0,0,0,0|1,0,1]=4 6576 B12R1.49 NCC(=O)Oc1ccc(Cl)cc1 Amb17335805 [0,2,0,0,0,0|1,0,1]=4 6577 B12R1.49 NCC(=O)Oc1ccc(F)cc1 Amb17334754 [0,2,0,0,0,0|1,0,1]=4 6578 B12R1.49 NCC(=O)Oc1ccc(O)cc1 Amb27758610 [0,2,0,0,0,0|1,0,1]=4 6579 B12R1.49 NCC(F)Cc1ccc(Br)cc1 Amb27258824 [0,2,0,0,0,0|2,0,0]=4 6580 B12R1.49 NCC(F)Cc1ccc(F)cc1 Amb27163091 [0,2,0,0,0,0|2,0,0]=4 6581 B12R1.49 NCC(O)Cc1ccc(Br)cc1 Amb17248849 [0,2,0,0,0,0|2,0,0]=4 6582 B12R1.49 NCC(O)Cc1ccc(Cl)cc1 Amb17234269 [0,2,0,0,0,0|2,0,0]=4 6583 B12R1.49 NCC(O)Cc1ccc(F)cc1 Amb17232703 [0,2,0,0,0,0|2,0,0]=4 6584 B12R1.49 NCC(O)Cc1ccc(I)cc1 Amb28454480 [0,2,0,0,0,0|2,0,0]=4 6585 B12R1.49 NCC(O)Cc1ccc(N)cc1 Amb27406793 [0,2,0,0,0,0|2,0,0]=4 6586 B12R1.49 NCC(O)Cc1ccc(O)cc1 Amb25876680 [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.49 NC[C@@H](N)Cc1ccc(Cl)cc1 Amb27389196 [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [0,2,0,0,0,0|1,0,0]=3 6589 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [0,2,0,0,0,0|1,0,0]=3 6590 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb31289679 [0,2,0,0,0,0|1,0,0]=3 6591 B12R1.49 N[C@@H](CO)Cc1ccc(O)cc1 Amb6357315 [0,2,0,0,0,0|1,0,0]=3 6592 B12R1.49 N[C@@H](CO)Cc1ccc(O)cc1 Amb8387636 [0,2,0,0,0,0|1,0,0]=3 6593 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [0,2,0,0,0,0|1,0,0]=3 6594 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [0,2,0,0,0,0|1,0,0]=3 6595 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [0,2,0,0,0,0|1,0,0]=3 6596 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [0,2,0,0,0,0|1,0,0]=3 6597 B12R1.49 N[C@H](CO)Cc1ccc(O)cc1 Amb1157858 [0,2,0,0,0,0|1,0,0]=3 6598 B12R1.49 N[C@H](CO)Cc1ccc(O)cc1 Amb8516110 [0,2,0,0,0,0|1,0,0]=3 6599 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [0,2,0,0,0,0|1,0,0]=3 6600 B12R1.49 Nc1ccc(NC(=O)CO)cc1 Amb8855205 [0,2,0,0,0,0|1,0,1]=4 6601 B12R1.49 Nc1ccc(OC(=O)CO)cc1 Amb24730945 [0,2,0,0,0,0|0,0,1]=3 6602 B12R1.49 O=C(CCl)Oc1ccc(Br)cc1 Amb22411419 [0,2,0,0,0,0|1,0,1]=4 6603 B12R1.49 O=C(CCl)Oc1ccc(O)cc1 Amb22232555 [0,2,0,0,0,0|1,0,1]=4 6604 B12R1.49 O=C(CO)Cc1ccc(Br)cc1 Amb18069830 [0,2,0,0,0,0|1,0,1]=4 6605 B12R1.49 O=C(CO)Cc1ccc(Cl)cc1 Amb18564300 [0,2,0,0,0,0|1,0,1]=4 6606 B12R1.49 O=C(CO)Cc1ccc(F)cc1 Amb18805789 [0,2,0,0,0,0|1,0,1]=4 6607 B12R1.49 O=C(CO)Nc1ccc(Br)cc1 Amb1111396 [0,2,0,0,0,0|1,0,1]=4 6608 B12R1.49 O=C(CO)Nc1ccc(Cl)cc1 Amb1111272 [0,2,0,0,0,0|1,0,1]=4 6609 B12R1.49 O=C(CO)Nc1ccc(F)cc1 Amb1110979 [0,2,0,0,0,0|1,0,1]=4 6610 B12R1.49 O=C(CO)Nc1ccc(I)cc1 Amb1110138 [0,2,0,0,0,0|1,0,1]=4 6611 B12R1.49 O=C(CO)Nc1ccc(O)cc1 Amb5798036 [0,2,0,0,0,0|1,0,1]=4 6612 B12R1.49 O=C(CO)Oc1ccc(Br)cc1 Amb28241802 [0,2,0,0,0,0|0,0,1]=3 6613 B12R1.49 O=C(CO)Oc1ccc(I)cc1 Amb27968914 [0,2,0,0,0,0|0,0,1]=3 6614 B12R1.49 O=C(NO)Oc1ccc(Cl)cc1 Amb27756205 [0,2,0,0,0,0|1,0,1]=4 6615 B12R1.49 OC(CCl)Cc1ccc(Br)cc1 Amb27416422 [0,2,0,0,0,0|2,0,0]=4 6616 B12R1.49 OCC(Cl)Cc1ccc(Cl)cc1 Amb27782418 [0,2,0,0,0,0|1,0,0]=3 6617 B12R1.49 OCC(O)Cc1ccc(Cl)cc1 Amb26318724 [0,2,0,0,0,0|1,0,0]=3 6618 B12R1.49 OCC(O)Cc1ccc(F)cc1 Amb27416534 [0,2,0,0,0,0|1,0,0]=3 6619 B12R1.49 OC[C@@H](F)Cc1ccc(F)cc1 Amb28455289 [0,2,0,0,0,0|1,0,0]=3 6620 B12R1.49 OC[C@@H](O)Cc1ccc(F)cc1 Amb27978223 [0,2,0,0,0,0|1,0,0]=3 6621 B12R1.49 OC[C@H](O)Cc1ccc(O)cc1 Amb28207388 [0,2,0,0,0,0|1,0,0]=3 6622 B12R1.69 BrCCCc1ccc(Br)cc1I Amb25248923 [0,2,0,0,0,0|2,0,0]=4 6623 B12R1.69 C#CCOc1ccc(Br)cc1C Amb25134248 [0,2,0,0,0,0|1,0,1]=4 6624 B12R1.69 C#CCOc1ccc(Br)cc1F Amb27951858 [0,2,0,0,0,0|1,0,1]=4 6625 B12R1.69 C#CCOc1ccc(Br)cc1N Amb27259463 [0,2,0,0,0,0|1,0,1]=4 6626 B12R1.69 C#CCOc1ccc(C)cc1Cl Amb18805199 [0,2,0,0,0,0|1,0,1]=4 6627 B12R1.69 C#CCOc1ccc(Cl)cc1Br Amb28129077 [0,2,0,0,0,0|1,0,1]=4 6628 B12R1.69 C#CCOc1ccc(Cl)cc1Cl Amb5722321 [0,2,0,0,0,0|1,0,1]=4 6629 B12R1.69 C#CCOc1ccc(Cl)cc1N Amb18809679 [0,2,0,0,0,0|1,0,1]=4 6630 B12R1.69 C#CCOc1ccc(F)cc1N Amb18286191 [0,2,0,0,0,0|1,0,1]=4 6631 B12R1.69 C#CCOc1ccc(F)cc1N Amb33549886 [0,2,0,0,0,0|1,0,1]=4 6632 B12R1.69 C#CCOc1ccc(N)cc1F Amb18961872 [0,2,0,0,0,0|1,0,1]=4 6633 B12R1.69 C=CCOc1ccc(Br)cc1Br Amb4422144 [0,2,0,0,0,0|1,0,1]=4 6634 B12R1.69 C=CCOc1ccc(Br)cc1C Amb27400844 [0,2,0,0,0,0|1,0,1]=4 6635 B12R1.69 C=CCOc1ccc(Br)cc1Cl Amb4013345 [0,2,0,0,0,0|1,0,1]=4 6636 B12R1.69 C=CCOc1ccc(Br)cc1F Amb27482572 [0,2,0,0,0,0|1,0,1]=4 6637 B12R1.69 C=CCOc1ccc(Br)cc1N Amb33548633 [0,2,0,0,0,0|1,0,1]=4 6638 B12R1.69 C=CCOc1ccc(C)cc1Br Amb6717110 [0,2,0,0,0,0|1,0,1]=4 6639 B12R1.69 C=CCOc1ccc(C)cc1N Amb17138556 [0,2,0,0,0,0|1,0,1]=4 6640 B12R1.69 C=CCOc1ccc(Cl)cc1Br Amb17259614 [0,2,0,0,0,0|1,0,1]=4 6641 B12R1.69 C=CCOc1ccc(Cl)cc1C Amb27448123 [0,2,0,0,0,0|1,0,1]=4 6642 B12R1.69 C=CCOc1ccc(Cl)cc1Cl Amb4016384 [0,2,0,0,0,0|1,0,1]=4 6643 B12R1.69 C=CCOc1ccc(Cl)cc1N Amb844282 [0,2,0,0,0,0|1,0,1]=4 6644 B12R1.69 C=CCOc1ccc(Cl)cc1O Amb27861307 [0,2,0,0,0,0|1,0,1]=4 6645 B12R1.69 C=CCOc1ccc(F)cc1Br Amb6278845 [0,2,0,0,0,0|1,0,1]=4 6646 B12R1.69 C=CCOc1ccc(F)cc1C Amb28321668 [0,2,0,0,0,0|1,0,1]=4 6647 B12R1.69 C=CCOc1ccc(F)cc1F Amb27604299 [0,2,0,0,0,0|1,0,1]=4 6648 B12R1.69 C=CCOc1ccc(F)cc1N Amb17232632 [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.69 C=CCOc1ccc(N)cc1C Amb27637464 [0,2,0,0,0,0|1,0,1]=4 6650 B12R1.69 C=CCOc1ccc(N)cc1Cl Amb17139077 [0,2,0,0,0,0|1,0,1]=4 6651 B12R1.69 C=CCOc1ccc(O)cc1C Amb27255458 [0,2,0,0,0,0|1,0,1]=4 6652 B12R1.69 C=CCOc1ccc(O)cc1O Amb27409625 [0,2,0,0,0,0|1,0,1]=4 6653 B12R1.69 CC1=CC(=O)N(CCCO)C=C1 Amb18041291 [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.69 CCCCc1ccc(I)cc1N Amb28287217 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.69 CCCCc1ccc(N)cc1C Amb26517027 [0,2,0,0,0,0|2,0,0]=4 6656 B12R1.69 CCCCc1ccc(N)cc1Cl Amb25858096 [0,2,0,0,0,0|2,0,0]=4 6657 B12R1.69 CCCCc1ccc(N)cc1N Amb28245267 [0,2,0,0,0,0|2,0,0]=4 6658 B12R1.69 CCCCc1ccc(N)cc1O Amb28250041 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.69 CCCCc1ccc(O)cc1F Amb28248864 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.69 CCCCc1ccc(O)cc1O Amb8393298 [0,2,0,0,0,0|2,0,0]=4 6661 B12R1.69 CCCNc1ccc(Br)cc1C Amb6690047 [0,2,0,0,0,0|2,0,0]=4 6662 B12R1.69 CCCNc1ccc(Br)cc1Cl Amb30584837 [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.69 CCCNc1ccc(Br)cc1Cl Amb9000418 [0,2,0,0,0,0|2,0,0]=4 6664 B12R1.69 CCCNc1ccc(Br)cc1N Amb7767450 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.69 CCCNc1ccc(C)cc1Br Amb6688269 [0,2,0,0,0,0|2,0,0]=4 6666 B12R1.69 CCCNc1ccc(C)cc1C Amb4313506 [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.69 CCCNc1ccc(C)cc1Cl Amb7780594 [0,2,0,0,0,0|2,0,0]=4 6668 B12R1.69 CCCNc1ccc(C)cc1N Amb9002761 [0,2,0,0,0,0|2,0,0]=4 6669 B12R1.69 CCCNc1ccc(Cl)cc1C Amb6610047 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.69 CCCNc1ccc(Cl)cc1Cl Amb6639162 [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.69 CCCNc1ccc(Cl)cc1F Amb9582472 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.69 CCCNc1ccc(Cl)cc1N Amb7767457 [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.69 CCCNc1ccc(F)cc1Cl Amb7808035 [0,2,0,0,0,0|2,0,0]=4 6674 B12R1.69 CCCNc1ccc(F)cc1F Amb6698329 [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.69 CCCNc1ccc(F)cc1I Amb27881381 [0,2,0,0,0,0|2,0,0]=4 6676 B12R1.69 CCCNc1ccc(F)cc1N Amb845869 [0,2,0,0,0,0|2,0,0]=4 6677 B12R1.69 CCCNc1ccc(I)cc1Br Amb27465186 [0,2,0,0,0,0|2,0,0]=4 6678 B12R1.69 CCCNc1ccc(I)cc1F Amb35597038 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.69 CCCNc1ccc(N)cc1F Amb845921 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.69 CCCNc1ccc(N)cc1I Amb27408784 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.69 CCCNc1ccc(O)cc1C Amb27614719 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.69 CCCNc1ccc(O)cc1Cl Amb35735282 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.69 CCCOC1=CNC(C)=CC1=O Amb19120152 [0,2,0,0,0,0|2,0,0]=4 6684 B12R1.69 CCCOC1=COC(C)=CC1=O Amb27761314 [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.69 CCCOc1ccc(Br)cc1C Amb25323749 [0,2,0,0,0,0|1,0,0]=3 6686 B12R1.69 CCCOc1ccc(Br)cc1Cl Amb28119263 [0,2,0,0,0,0|1,0,0]=3 6687 B12R1.69 CCCOc1ccc(Br)cc1F Amb10607074 [0,2,0,0,0,0|1,0,0]=3 6688 B12R1.69 CCCOc1ccc(Br)cc1N Amb8874531 [0,2,0,0,0,0|1,0,0]=3 6689 B12R1.69 CCCOc1ccc(Br)cc1S Amb25342159 [0,2,0,0,0,0|1,0,0]=3 6690 B12R1.69 CCCOc1ccc(C)cc1Br Amb6717096 [0,2,0,0,0,0|1,0,0]=3 6691 B12R1.69 CCCOc1ccc(C)cc1N Amb840315 [0,2,0,0,0,0|1,0,0]=3 6692 B12R1.69 CCCOc1ccc(C)cc1S Amb24688543 [0,2,0,0,0,0|1,0,0]=3 6693 B12R1.69 CCCOc1ccc(C)nc1I Amb28349704 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.69 CCCOc1ccc(Cl)cc1Br Amb17261136 [0,2,0,0,0,0|1,0,0]=3 6695 B12R1.69 CCCOc1ccc(Cl)cc1F Amb27468493 [0,2,0,0,0,0|1,0,0]=3 6696 B12R1.69 CCCOc1ccc(Cl)cc1N Amb840193 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.69 CCCOc1ccc(Cl)nc1I Amb27804907 [0,2,0,0,0,0|2,0,0]=4 6698 B12R1.69 CCCOc1ccc(F)cc1Br Amb6269501 [0,2,0,0,0,0|1,0,0]=3 6699 B12R1.69 CCCOc1ccc(F)cc1F Amb2782302 [0,2,0,0,0,0|1,0,0]=3 6700 B12R1.69 CCCOc1ccc(F)cc1N Amb8874529 [0,2,0,0,0,0|1,0,0]=3 6701 B12R1.69 CCCOc1ccc(F)cc1S Amb24640815 [0,2,0,0,0,0|1,0,0]=3 6702 B12R1.69 CCCOc1ccc(I)cc1N Amb18057209 [0,2,0,0,0,0|1,0,0]=3 6703 B12R1.69 CCCOc1ccc(I)cc1S Amb28289534 [0,2,0,0,0,0|1,0,0]=3 6704 B12R1.69 CCCOc1ccc(N)cc1Br Amb18293616 [0,2,0,0,0,0|1,0,0]=3 6705 B12R1.69 CCCOc1ccc(N)cc1C Amb21954722 [0,2,0,0,0,0|1,0,0]=3 6706 B12R1.69 CCCOc1ccc(N)cc1C Amb8439149 [0,2,0,0,0,0|1,0,0]=3 6707 B12R1.69 CCCOc1ccc(N)cc1Cl Amb1141135 [0,2,0,0,0,0|1,0,0]=3 6708 B12R1.69 CCCOc1ccc(N)cc1Cl Amb8627522 [0,2,0,0,0,0|1,0,0]=3 6709 B12R1.69 CCCOc1ccc(N)cc1F Amb8874525 [0,2,0,0,0,0|1,0,0]=3 6710 B12R1.69 CCCOc1ccc(N)cc1I Amb26950528 [0,2,0,0,0,0|1,0,0]=3 6711 B12R1.69 CCCOc1ccc(O)cc1Br Amb28244202 [0,2,0,0,0,0|1,0,0]=3 6712 B12R1.69 CCCOc1ccc(O)cc1Cl Amb17202481 [0,2,0,0,0,0|1,0,0]=3 6713 B12R1.69 CCCOc1ccc(O)cc1F Amb27783538 [0,2,0,0,0,0|1,0,0]=3 6714 B12R1.69 CCCOc1ccc(O)cc1S Amb26996271 [0,2,0,0,0,0|1,0,0]=3 6715 B12R1.69 CCCOc1ccc(S)cc1C Amb26644076 [0,2,0,0,0,0|1,0,0]=3 6716 B12R1.69 CCCOc1ccc(S)cc1Cl Amb25669642 [0,2,0,0,0,0|1,0,0]=3 6717 B12R1.69 CCCOc1ccc(S)cc1F Amb25359884 [0,2,0,0,0,0|1,0,0]=3 6718 B12R1.69 CCCOc1ncc(Br)cc1Br Amb24317465 [0,2,0,0,0,0|2,0,0]=4 6719 B12R1.69 CCCOc1ncc(Br)cc1C Amb19959834 [0,2,0,0,0,0|2,0,0]=4 6720 B12R1.69 CCCOc1ncc(Br)cc1N Amb18973562 [0,2,0,0,0,0|2,0,0]=4 6721 B12R1.69 CCCOc1ncc(C)cc1Br Amb28196302 [0,2,0,0,0,0|2,0,0]=4 6722 B12R1.69 CCCOc1ncc(C)cc1N Amb23003212 [0,2,0,0,0,0|2,0,0]=4 6723 B12R1.69 CCCOc1ncc(C)cc1O Amb28344036 [0,2,0,0,0,0|2,0,0]=4 6724 B12R1.69 CCCOc1ncc(Cl)cc1C Amb28343940 [0,2,0,0,0,0|2,0,0]=4 6725 B12R1.69 CCCOc1ncc(Cl)cc1N Amb24379735 [0,2,0,0,0,0|2,0,0]=4 6726 B12R1.69 CCCOc1ncc(Cl)cc1O Amb28344052 [0,2,0,0,0,0|2,0,0]=4 6727 B12R1.69 CCCOc1ncc(F)cc1N Amb25957135 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.69 CCCOc1ncc(N)cc1Br Amb27459565 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.69 CCCOc1ncc(N)cc1C Amb18991478 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.69 CCCOc1ncc(N)cc1Cl Amb27147226 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.69 CCCOc1ncc(N)cc1N Amb28239685 [0,2,0,0,0,0|2,0,0]=4 6732 B12R1.69 CCCOc1ncc(O)cc1C Amb28344054 [0,2,0,0,0,0|2,0,0]=4 6733 B12R1.69 CCCSc1ccc(N)cc1F Amb7783536 [0,2,0,0,0,0|1,1,0]=4 6734 B12R1.69 CCCSc1ccc(O)cc1Cl Amb27193044 [0,2,0,0,0,0|1,1,0]=4 6735 B12R1.69 COCOc1ccc(Br)cc1Br Amb27396048 [0,2,0,0,0,0|2,0,0]=4 6736 B12R1.69 COCOc1ccc(Br)cc1C Amb24485679 [0,2,0,0,0,0|2,0,0]=4 6737 B12R1.69 COCOc1ccc(Br)cc1Cl Amb25677213 [0,2,0,0,0,0|2,0,0]=4 6738 B12R1.69 COCOc1ccc(Br)cc1F Amb22034392 [0,2,0,0,0,0|2,0,0]=4 6739 B12R1.69 COCOc1ccc(Br)cc1N Amb27412398 [0,2,0,0,0,0|2,0,0]=4 6740 B12R1.69 COCOc1ccc(Br)cc1O Amb32412958 [0,2,0,0,0,0|2,0,0]=4 6741 B12R1.69 COCOc1ccc(C)cc1Br Amb20241784 [0,2,0,0,0,0|2,0,0]=4 6742 B12R1.69 COCOc1ccc(Cl)cc1C Amb28430312 [0,2,0,0,0,0|2,0,0]=4 6743 B12R1.69 COCOc1ccc(Cl)cc1Cl Amb24439524 [0,2,0,0,0,0|2,0,0]=4 6744 B12R1.69 COCOc1ccc(Cl)cc1F Amb25753343 [0,2,0,0,0,0|2,0,0]=4 6745 B12R1.69 COCOc1ccc(F)cc1Br Amb25934751 [0,2,0,0,0,0|2,0,0]=4 6746 B12R1.69 COCOc1ccc(F)cc1Cl Amb27827099 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.69 COCOc1ccc(F)cc1F Amb22546899 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.69 COCOc1ccc(F)cc1N Amb28043143 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.69 COCOc1ccc(N)cc1Cl Amb27627218 [0,2,0,0,0,0|2,0,0]=4 6750 B12R1.69 CSCOc1ccc(C)cc1I Amb27842958 [0,2,0,0,0,0|2,0,0]=4 6751 B12R1.69 CSCOc1ccc(Cl)cc1Cl Amb27245847 [0,2,0,0,0,0|2,0,0]=4 6752 B12R1.69 CSCOc1ccc(Cl)cc1F Amb28198477 [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.69 Cc1cc(Br)ccc1CCCBr Amb27642848 [0,2,0,0,0,0|2,0,0]=4 6754 B12R1.69 Cc1cc(Br)ccc1CCCCl Amb27200792 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.69 Cc1cc(Br)ccc1CCCN Amb17204538 [0,2,0,0,0,0|2,0,0]=4 6756 B12R1.69 Cc1cc(Br)ccc1CCCO Amb23537809 [0,2,0,0,0,0|1,0,0]=3 6757 B12R1.69 Cc1cc(Br)ccc1CCCS Amb33435451 [0,2,0,0,0,0|1,1,0]=4 6758 B12R1.69 Cc1cc(Br)ccc1NCCCl Amb17351916 [0,2,0,0,0,0|2,0,0]=4 6759 B12R1.69 Cc1cc(Br)ccc1NCCN Amb17091076 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.69 Cc1cc(Br)ccc1NCCO Amb6709137 [0,2,0,0,0,0|1,0,0]=3 6761 B12R1.69 Cc1cc(Br)ccc1OCC=O Amb17099968 [0,2,0,0,0,0|0,0,2]=4 6762 B12R1.69 Cc1cc(Br)ccc1OCCF Amb24487619 [0,2,0,0,0,0|1,0,0]=3 6763 B12R1.69 Cc1cc(Br)ccc1OCCN Amb5781251 [0,2,0,0,0,0|1,0,0]=3 6764 B12R1.69 Cc1cc(Br)ccc1OCCO Amb24483359 [0,2,0,0,0,0|0,0,0]=2 6765 B12R1.69 Cc1cc(Br)ccc1\C=C\CO Amb25160043 [0,2,0,0,0,0|1,0,1]=4 6766 B12R1.69 Cc1cc(Br)cnc1NCCO Amb21958721 [0,2,0,0,0,0|2,0,0]=4 6767 B12R1.69 Cc1cc(Br)cnc1OCCN Amb28144491 [0,2,0,0,0,0|2,0,0]=4 6768 B12R1.69 Cc1cc(Br)ncc1OCCO Amb28122182 [0,2,0,0,0,0|1,0,0]=3 6769 B12R1.69 Cc1cc(Cl)ccc1CCCBr Amb27623584 [0,2,0,0,0,0|2,0,0]=4 6770 B12R1.69 Cc1cc(Cl)ccc1CCCCl Amb25922222 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.69 Cc1cc(Cl)ccc1CCCN Amb17204337 [0,2,0,0,0,0|2,0,0]=4 6772 B12R1.69 Cc1cc(Cl)ccc1CCCO Amb27645295 [0,2,0,0,0,0|1,0,0]=3 6773 B12R1.69 Cc1cc(Cl)ccc1CCCS Amb33413534 [0,2,0,0,0,0|1,1,0]=4 6774 B12R1.69 Cc1cc(Cl)ccc1NCCCl Amb17338053 [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.69 Cc1cc(Cl)ccc1NCCN Amb17091059 [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.69 Cc1cc(Cl)ccc1NCCO Amb17305825 [0,2,0,0,0,0|1,0,0]=3 6777 B12R1.69 Cc1cc(Cl)ccc1OCC=O Amb19075146 [0,2,0,0,0,0|0,0,2]=4 6778 B12R1.69 Cc1cc(Cl)ccc1OCCBr Amb6277284 [0,2,0,0,0,0|1,0,0]=3 6779 B12R1.69 Cc1cc(Cl)ccc1OCCCl Amb8828443 [0,2,0,0,0,0|1,0,0]=3 6780 B12R1.69 Cc1cc(Cl)ccc1OCCN Amb6328850 [0,2,0,0,0,0|1,0,0]=3 6781 B12R1.69 Cc1cc(Cl)ccc1OCCO Amb9370701 [0,2,0,0,0,0|0,0,0]=2 6782 B12R1.69 Cc1cc(Cl)ccc1OCCS Amb17237590 [0,2,0,0,0,0|0,1,0]=3 6783 B12R1.69 Cc1cc(Cl)ccc1\C=C\CO Amb25324808 [0,2,0,0,0,0|1,0,1]=4 6784 B12R1.69 Cc1cc(Cl)cnc1NCCO Amb35669569 [0,2,0,0,0,0|2,0,0]=4 6785 B12R1.69 Cc1cc(Cl)cnc1OCCN Amb29854005 [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.69 Cc1cc(Cl)cnc1SCCO Amb35669563 [0,2,0,0,0,0|1,1,0]=4 6787 B12R1.69 Cc1cc(Cl)ncc1OCCO Amb27484544 [0,2,0,0,0,0|1,0,0]=3 6788 B12R1.69 Cc1cc(F)ccc1CCCBr Amb26325781 [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.69 Cc1cc(F)ccc1CCCCl Amb25840107 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.69 Cc1cc(F)ccc1CCCN Amb18295693 [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.69 Cc1cc(F)ccc1CCCO Amb25148633 [0,2,0,0,0,0|1,0,0]=3 6792 B12R1.69 Cc1cc(F)ccc1CCCS Amb33380162 [0,2,0,0,0,0|1,1,0]=4 6793 B12R1.69 Cc1cc(F)ccc1NCCCl Amb28121045 [0,2,0,0,0,0|2,0,0]=4 6794 B12R1.69 Cc1cc(F)ccc1OCC#N Amb25152357 [0,2,0,0,0,0|1,0,1]=4 6795 B12R1.69 Cc1cc(F)ccc1OCCF Amb27177456 [0,2,0,0,0,0|1,0,0]=3 6796 B12R1.69 Cc1cc(F)ccc1OCCN Amb27177455 [0,2,0,0,0,0|1,0,0]=3 6797 B12R1.69 Cc1cc(F)ccc1OCCS Amb27588480 [0,2,0,0,0,0|0,1,0]=3 6798 B12R1.69 Cc1cc(F)ccc1SCCN Amb17083029 [0,2,0,0,0,0|1,1,0]=4 6799 B12R1.69 Cc1cc(F)ccc1\C=C\CO Amb33448810 [0,2,0,0,0,0|1,0,1]=4 6800 B12R1.69 Cc1cc(I)ccc1CCCCl Amb27230838 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.69 Cc1cc(N)ccc1CCCBr Amb27616073 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.69 Cc1cc(N)ccc1CCCCl Amb24695776 [0,2,0,0,0,0|2,0,0]=4 6803 B12R1.69 Cc1cc(N)ccc1NCCF Amb27647272 [0,2,0,0,0,0|2,0,0]=4 6804 B12R1.69 Cc1cc(N)ccc1NCCN Amb18991506 [0,2,0,0,0,0|2,0,0]=4 6805 B12R1.69 Cc1cc(N)ccc1NCCO Amb8855787 [0,2,0,0,0,0|1,0,0]=3 6806 B12R1.69 Cc1cc(N)ccc1OCCF Amb25678791 [0,2,0,0,0,0|1,0,0]=3 6807 B12R1.69 Cc1cc(N)ccc1OCCO Amb8855931 [0,2,0,0,0,0|0,0,0]=2 6808 B12R1.69 Cc1cc(N)cnc1OCCO Amb18298667 [0,2,0,0,0,0|1,0,0]=3 6809 B12R1.69 Cc1cc(N)cnc1SCCO Amb18298672 [0,2,0,0,0,0|1,1,0]=4 6810 B12R1.69 Cc1cc(O)ccc1CCCCl Amb27623395 [0,2,0,0,0,0|2,0,0]=4 6811 B12R1.69 Cc1cc(O)ccc1CCCN Amb18554106 [0,2,0,0,0,0|2,0,0]=4 6812 B12R1.69 Cc1cc(O)ccc1NCCN Amb27953715 [0,2,0,0,0,0|2,0,0]=4 6813 B12R1.69 Cc1cc(O)ccc1OCCN Amb27635369 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.69 Cc1cc(S)ccc1CCCCl Amb24541029 [0,2,0,0,0,0|2,0,0]=4 6815 B12R1.69 Cc1ccc(CCCBr)c(Br)c1 Amb27625160 [0,2,0,0,0,0|2,0,0]=4 6816 B12R1.69 Cc1ccc(CCCBr)c(C)c1 Amb26429322 [0,2,0,0,0,0|2,0,0]=4 6817 B12R1.69 Cc1ccc(CCCBr)c(Cl)c1 Amb25798590 [0,2,0,0,0,0|2,0,0]=4 6818 B12R1.69 Cc1ccc(CCCBr)c(F)c1 Amb26066087 [0,2,0,0,0,0|2,0,0]=4 6819 B12R1.69 Cc1ccc(CCCBr)c(I)c1 Amb26611991 [0,2,0,0,0,0|2,0,0]=4 6820 B12R1.69 Cc1ccc(CCCBr)c(O)c1 Amb25194824 [0,2,0,0,0,0|2,0,0]=4 6821 B12R1.69 Cc1ccc(CCCBr)c(S)c1 Amb25920100 [0,2,0,0,0,0|2,0,0]=4 6822 B12R1.69 Cc1ccc(CCCCl)c(Br)c1 Amb28323252 [0,2,0,0,0,0|2,0,0]=4 6823 B12R1.69 Cc1ccc(CCCCl)c(Cl)c1 Amb27251170 [0,2,0,0,0,0|2,0,0]=4 6824 B12R1.69 Cc1ccc(CCCCl)c(F)c1 Amb27193303 [0,2,0,0,0,0|2,0,0]=4 6825 B12R1.69 Cc1ccc(CCCCl)c(I)c1 Amb27423548 [0,2,0,0,0,0|2,0,0]=4 6826 B12R1.69 Cc1ccc(CCCCl)c(O)c1 Amb26988904 [0,2,0,0,0,0|2,0,0]=4 6827 B12R1.69 Cc1ccc(CCCCl)c(S)c1 Amb27647047 [0,2,0,0,0,0|2,0,0]=4 6828 B12R1.69 Cc1ccc(CCCN)c(Br)c1 Amb17204537 [0,2,0,0,0,0|2,0,0]=4 6829 B12R1.69 Cc1ccc(CCCN)c(C)c1 Amb1215673 [0,2,0,0,0,0|2,0,0]=4 6830 B12R1.69 Cc1ccc(CCCN)c(C)c1 Amb32670630 [0,2,0,0,0,0|2,0,0]=4 6831 B12R1.69 Cc1ccc(CCCN)c(Cl)c1 Amb25159902 [0,2,0,0,0,0|2,0,0]=4 6832 B12R1.69 Cc1ccc(CCCN)c(F)c1 Amb25677595 [0,2,0,0,0,0|2,0,0]=4 6833 B12R1.69 Cc1ccc(CCCN)c(O)c1 Amb25776876 [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.69 Cc1ccc(CCCO)c(Br)c1 Amb23537990 [0,2,0,0,0,0|1,0,0]=3 6835 B12R1.69 Cc1ccc(CCCO)c(C)c1 Amb17400157 [0,2,0,0,0,0|1,0,0]=3 6836 B12R1.69 Cc1ccc(CCCO)c(Cl)c1 Amb25820255 [0,2,0,0,0,0|1,0,0]=3 6837 B12R1.69 Cc1ccc(CCCO)c(Cl)n1 Amb33260590 [0,2,0,0,0,0|2,0,0]=4 6838 B12R1.69 Cc1ccc(CCCO)c(F)c1 Amb25135641 [0,2,0,0,0,0|1,0,0]=3 6839 B12R1.69 Cc1ccc(CCCO)c(N)c1 Amb22233216 [0,2,0,0,0,0|1,0,0]=3 6840 B12R1.69 Cc1ccc(CCCO)c(O)c1 Amb26589790 [0,2,0,0,0,0|1,0,0]=3 6841 B12R1.69 Cc1ccc(CCCS)c(Br)c1 Amb33387491 [0,2,0,0,0,0|1,1,0]=4 6842 B12R1.69 Cc1ccc(CCCS)c(C)c1 Amb24497542 [0,2,0,0,0,0|1,1,0]=4 6843 B12R1.69 Cc1ccc(CCCS)c(Cl)c1 Amb33221379 [0,2,0,0,0,0|1,1,0]=4 6844 B12R1.69 Cc1ccc(CCCS)c(F)c1 Amb33324275 [0,2,0,0,0,0|1,1,0]=4 6845 B12R1.69 Cc1ccc(CCCS)c(O)c1 Amb33425273 [0,2,0,0,0,0|1,1,0]=4 6846 B12R1.69 Cc1ccc(NCCCl)c(Br)c1 Amb17351915 [0,2,0,0,0,0|2,0,0]=4 6847 B12R1.69 Cc1ccc(NCCCl)c(C)c1 Amb17335661 [0,2,0,0,0,0|2,0,0]=4 6848 B12R1.69 Cc1ccc(NCCF)c(C)c1 Amb27961326 [0,2,0,0,0,0|2,0,0]=4 6849 B12R1.69 Cc1ccc(NCCN)c(Br)c1 Amb17091075 [0,2,0,0,0,0|2,0,0]=4 6850 B12R1.69 Cc1ccc(NCCN)c(C)c1 Amb17057764 [0,2,0,0,0,0|2,0,0]=4 6851 B12R1.69 Cc1ccc(NCCO)c(Br)c1 Amb6708181 [0,2,0,0,0,0|1,0,0]=3 6852 B12R1.69 Cc1ccc(NCCO)c(C)c1 Amb6706815 [0,2,0,0,0,0|1,0,0]=3 6853 B12R1.69 Cc1ccc(NCCO)c(N)c1 Amb9002809 [0,2,0,0,0,0|1,0,0]=3 6854 B12R1.69 Cc1ccc(OCC#N)c(Br)c1 Amb5780908 [0,2,0,0,0,0|1,0,1]=4 6855 B12R1.69 Cc1ccc(OCC#N)c(C)c1 Amb5780868 [0,2,0,0,0,0|1,0,1]=4 6856 B12R1.69 Cc1ccc(OCC#N)c(Cl)c1 Amb18805466 [0,2,0,0,0,0|1,0,1]=4 6857 B12R1.69 Cc1ccc(OCC=O)c(Br)c1 Amb17099967 [0,2,0,0,0,0|0,0,2]=4 6858 B12R1.69 Cc1ccc(OCC=O)c(C)c1 Amb5731828 [0,2,0,0,0,0|0,0,2]=4 6859 B12R1.69 Cc1ccc(OCC=O)c(Cl)c1 Amb19069174 [0,2,0,0,0,0|0,0,2]=4 6860 B12R1.69 Cc1ccc(OCCBr)c(C)c1 Amb6272164 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.69 Cc1ccc(OCCBr)c(Cl)c1 Amb10608618 [0,2,0,0,0,0|1,0,0]=3 6862 B12R1.69 Cc1ccc(OCCCl)c(C)c1 Amb8828417 [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.69 Cc1ccc(OCCF)c(Br)c1 Amb27475775 [0,2,0,0,0,0|1,0,0]=3 6864 B12R1.69 Cc1ccc(OCCF)c(C)c1 Amb27983422 [0,2,0,0,0,0|1,0,0]=3 6865 B12R1.69 Cc1ccc(OCCF)c(N)c1 Amb26998373 [0,2,0,0,0,0|1,0,0]=3 6866 B12R1.69 Cc1ccc(OCCF)c(N)n1 Amb28203355 [0,2,0,0,0,0|2,0,0]=4 6867 B12R1.69 Cc1ccc(OCCN)c(Br)c1 Amb6315948 [0,2,0,0,0,0|1,0,0]=3 6868 B12R1.69 Cc1ccc(OCCN)c(C)c1 Amb1072012 [0,2,0,0,0,0|1,0,0]=3 6869 B12R1.69 Cc1ccc(OCCN)c(C)c1 Amb1215328 [0,2,0,0,0,0|1,0,0]=3 6870 B12R1.69 Cc1ccc(OCCN)c(C)n1 Amb27438698 [0,2,0,0,0,0|2,0,0]=4 6871 B12R1.69 Cc1ccc(OCCN)c(Cl)c1 Amb18994687 [0,2,0,0,0,0|1,0,0]=3 6872 B12R1.69 Cc1ccc(OCCN)c(Cl)n1 Amb33260544 [0,2,0,0,0,0|2,0,0]=4 6873 B12R1.69 Cc1ccc(OCCN)c(F)c1 Amb27147361 [0,2,0,0,0,0|1,0,0]=3 6874 B12R1.69 Cc1ccc(OCCN)c(I)n1 Amb25675702 [0,2,0,0,0,0|2,0,0]=4 6875 B12R1.69 Cc1ccc(OCCN)c(O)c1 Amb33425282 [0,2,0,0,0,0|1,0,0]=3 6876 B12R1.69 Cc1ccc(OCCO)c(C)c1 Amb9370616 [0,2,0,0,0,0|0,0,0]=2 6877 B12R1.69 Cc1ccc(OCCO)c(Cl)c1 Amb19070653 [0,2,0,0,0,0|0,0,0]=2 6878 B12R1.69 Cc1ccc(OCCO)c(N)c1 Amb9002970 [0,2,0,0,0,0|0,0,0]=2 6879 B12R1.69 Cc1ccc(OCCS)c(C)c1 Amb17233944 [0,2,0,0,0,0|0,1,0]=3 6880 B12R1.69 Cc1ccc(OCC[NH3+])c(C)c1 Amb34916632 [0,2,0,0,0,0|1,0,0]=3 6881 B12R1.69 Cc1ccc(SCCN)c(C)c1 Amb6256671 [0,2,0,0,0,0|1,1,0]=4 6882 B12R1.69 Cc1ccc(SCCO)c(Br)c1 Amb26613162 [0,2,0,0,0,0|0,1,0]=3 6883 B12R1.69 Cc1ccc(\C=C\CO)c(Br)c1 Amb28243139 [0,2,0,0,0,0|1,0,1]=4 6884 B12R1.69 Cc1ccc(\C=C\CO)c(C)c1 Amb27989228 [0,2,0,0,0,0|1,0,1]=4 6885 B12R1.69 Cc1ccc(\C=C\CO)c(Cl)c1 Amb35711132 [0,2,0,0,0,0|1,0,1]=4 6886 B12R1.69 Cc1ccc(\C=C\CO)c(F)c1 Amb33324286 [0,2,0,0,0,0|1,0,1]=4 6887 B12R1.69 Cc1ccc(\C=C\CO)c(O)c1 Amb28422712 [0,2,0,0,0,0|1,0,1]=4 6888 B12R1.69 Cc1cnc(NCCO)c(N)c1 Amb17209059 [0,2,0,0,0,0|2,0,0]=4 6889 B12R1.69 Cc1cnc(OCCO)c(Br)c1 Amb27949225 [0,2,0,0,0,0|1,0,0]=3 6890 B12R1.69 Cc1cnc(OCCO)c(N)c1 Amb24668278 [0,2,0,0,0,0|1,0,0]=3 6891 B12R1.69 ClCCCc1ccc(Br)cc1Br Amb24756782 [0,2,0,0,0,0|2,0,0]=4 6892 B12R1.69 ClCCCc1ccc(Br)cc1Cl Amb26491293 [0,2,0,0,0,0|2,0,0]=4 6893 B12R1.69 ClCCCc1ccc(Br)cc1I Amb26653620 [0,2,0,0,0,0|2,0,0]=4 6894 B12R1.69 ClCCCc1ccc(Cl)cc1Br Amb27965661 [0,2,0,0,0,0|2,0,0]=4 6895 B12R1.69 ClCCCc1ccc(Cl)cc1Cl Amb17477748 [0,2,0,0,0,0|2,0,0]=4 6896 B12R1.69 ClCCCc1ccc(I)cc1Br Amb27963012 [0,2,0,0,0,0|2,0,0]=4 6897 B12R1.69 ClCCNc1ccc(Cl)cc1Cl Amb17343163 [0,2,0,0,0,0|2,0,0]=4 6898 B12R1.69 ClCCOc1ccc(Br)cc1Cl Amb8828492 [0,2,0,0,0,0|1,0,0]=3 6899 B12R1.69 ClCCOc1ccc(Cl)cc1Cl Amb8828436 [0,2,0,0,0,0|1,0,0]=3 6900 B12R1.69 Clc1cc(Br)ccc1CCCBr Amb26652758 [0,2,0,0,0,0|2,0,0]=4 6901 B12R1.69 Clc1cc(Br)ccc1OCCBr Amb7765610 [0,2,0,0,0,0|1,0,0]=3 6902 B12R1.69 Clc1ccc(CCCBr)c(Cl)c1 Amb24064155 [0,2,0,0,0,0|2,0,0]=4 6903 B12R1.69 Clc1ccc(OCCBr)c(Br)c1 Amb1154146 [0,2,0,0,0,0|1,0,0]=3 6904 B12R1.69 Clc1ccc(OCCBr)c(Cl)c1 Amb1152303 [0,2,0,0,0,0|1,0,0]=3 6905 B12R1.69 Clc1ccc(OCCI)c(Cl)c1 Amb28422569 [0,2,0,0,0,0|1,0,0]=3 6906 B12R1.69 Clc1ccc(SCCBr)c(Cl)c1 Amb28075621 [0,2,0,0,0,0|1,1,0]=4 6907 B12R1.69 FCCNc1ccc(Br)cc1Br Amb27984467 [0,2,0,0,0,0|2,0,0]=4 6908 B12R1.69 FCCNc1ccc(Br)cc1Cl Amb27781425 [0,2,0,0,0,0|2,0,0]=4 6909 B12R1.69 FCCNc1ccc(Cl)cc1Cl Amb27800524 [0,2,0,0,0,0|2,0,0]=4 6910 B12R1.69 FCCNc1ccc(F)cc1F Amb27389205 [0,2,0,0,0,0|2,0,0]=4 6911 B12R1.69 FCCNc1ccc(I)cc1F Amb35589463 [0,2,0,0,0,0|2,0,0]=4 6912 B12R1.69 FCCOc1ccc(Br)cc1Cl Amb22470092 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.69 FCCOc1ccc(Cl)cc1Br Amb28125500 [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.69 FCCOc1ccc(F)cc1Cl Amb28381910 [0,2,0,0,0,0|1,0,0]=3 6915 B12R1.69 Fc1cc(Br)ccc1CCCBr Amb20075851 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.69 Fc1cc(Br)ccc1CCCCl Amb25770333 [0,2,0,0,0,0|2,0,0]=4 6917 B12R1.69 Fc1cc(Br)ccc1CCCS Amb33477370 [0,2,0,0,0,0|1,1,0]=4 6918 B12R1.69 Fc1cc(Br)ccc1OCCBr Amb9207739 [0,2,0,0,0,0|1,0,0]=3 6919 B12R1.69 Fc1cc(Br)ccc1OCCS Amb27761352 [0,2,0,0,0,0|0,1,0]=3 6920 B12R1.69 Fc1cc(Cl)ccc1CCCBr Amb27633944 [0,2,0,0,0,0|2,0,0]=4 6921 B12R1.69 Fc1cc(Cl)ccc1CCCCl Amb26424917 [0,2,0,0,0,0|2,0,0]=4 6922 B12R1.69 Fc1cc(Cl)ccc1CCCS Amb33052033 [0,2,0,0,0,0|1,1,0]=4 6923 B12R1.69 Fc1cc(Cl)ccc1OCCBr Amb27391802 [0,2,0,0,0,0|1,0,0]=3 6924 B12R1.69 Fc1cc(S)ccc1CCCBr Amb28133833 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.69 Fc1ccc(CCCBr)c(Br)c1 Amb24448383 [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.69 Fc1ccc(CCCBr)c(Cl)c1 Amb27254548 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.69 Fc1ccc(CCCBr)c(F)c1 Amb26433081 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.69 Fc1ccc(CCCCl)c(Br)c1 Amb27751483 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.69 Fc1ccc(CCCCl)c(Cl)c1 Amb27855924 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.69 Fc1ccc(CCCCl)c(F)c1 Amb19073200 [0,2,0,0,0,0|2,0,0]=4 6931 B12R1.69 Fc1ccc(CCCCl)c(I)c1 Amb27490051 [0,2,0,0,0,0|2,0,0]=4 6932 B12R1.69 Fc1ccc(CCCS)c(Br)c1 Amb33334158 [0,2,0,0,0,0|1,1,0]=4 6933 B12R1.69 Fc1ccc(CCCS)c(Cl)c1 Amb33258064 [0,2,0,0,0,0|1,1,0]=4 6934 B12R1.69 Fc1ccc(CCCS)c(F)c1 Amb25159701 [0,2,0,0,0,0|1,1,0]=4 6935 B12R1.69 Fc1ccc(OCCBr)c(Br)c1 Amb6274766 [0,2,0,0,0,0|1,0,0]=3 6936 B12R1.69 Fc1ccc(OCCBr)c(Cl)c1 Amb17263583 [0,2,0,0,0,0|1,0,0]=3 6937 B12R1.69 Fc1ccc(OCCBr)c(F)c1 Amb6255835 [0,2,0,0,0,0|1,0,0]=3 6938 B12R1.69 Fc1ccc(OCCCl)c(Cl)c1 Amb17240164 [0,2,0,0,0,0|1,0,0]=3 6939 B12R1.69 Fc1ccc(OCCCl)c(F)c1 Amb8828448 [0,2,0,0,0,0|1,0,0]=3 6940 B12R1.69 Fc1ccc(OCCS)c(Br)c1 Amb27218799 [0,2,0,0,0,0|0,1,0]=3 6941 B12R1.69 Fc1ccc(OCCS)c(Cl)c1 Amb17239148 [0,2,0,0,0,0|0,1,0]=3 6942 B12R1.69 Fc1ccc(OCCS)c(F)c1 Amb17234881 [0,2,0,0,0,0|0,1,0]=3 6943 B12R1.69 Fc1ccc(SCCBr)c(F)c1 Amb8996784 [0,2,0,0,0,0|1,1,0]=4 6944 B12R1.69 Fc1ccc(SCCCl)c(F)c1 Amb8995014 [0,2,0,0,0,0|1,1,0]=4 6945 B12R1.69 Fc1nc(Br)ccc1OCCBr Amb32988383 [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.69 N#CCOc1ccc(Br)cc1Br Amb6384256 [0,2,0,0,0,0|1,0,1]=4 6947 B12R1.69 N#CCOc1ccc(Br)cc1Cl Amb6384308 [0,2,0,0,0,0|1,0,1]=4 6948 B12R1.69 N#CCOc1ccc(Cl)cc1F Amb26651791 [0,2,0,0,0,0|1,0,1]=4 6949 B12R1.69 N#CCOc1ccc(F)cc1Cl Amb6384301 [0,2,0,0,0,0|1,0,1]=4 6950 B12R1.69 N#CCOc1ccc(F)cc1F Amb6384255 [0,2,0,0,0,0|1,0,1]=4 6951 B12R1.69 N#CCOc1ccc(N)cc1Cl Amb6268083 [0,2,0,0,0,0|1,0,1]=4 6952 B12R1.69 N#CCOc1ccc(N)cc1F Amb8886623 [0,2,0,0,0,0|1,0,1]=4 6953 B12R1.69 NCCCc1ccc(Br)cc1Cl Amb25897417 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.69 NCCCc1ccc(Br)cc1F Amb9304930 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.69 NCCCc1ccc(Br)cc1O Amb27644606 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.69 NCCCc1ccc(Cl)cc1Br Amb27250429 [0,2,0,0,0,0|2,0,0]=4 6957 B12R1.69 NCCCc1ccc(Cl)cc1Cl Amb9304921 [0,2,0,0,0,0|2,0,0]=4 6958 B12R1.69 NCCCc1ccc(Cl)cc1F Amb23315399 [0,2,0,0,0,0|2,0,0]=4 6959 B12R1.69 NCCCc1ccc(Cl)cc1O Amb25084560 [0,2,0,0,0,0|2,0,0]=4 6960 B12R1.69 NCCCc1ccc(F)cc1Br Amb9304914 [0,2,0,0,0,0|2,0,0]=4 6961 B12R1.69 NCCCc1ccc(F)cc1Cl Amb9304919 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.69 NCCCc1ccc(F)cc1F Amb17204313 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.69 NCCCc1ccc(O)cc1Cl Amb18556149 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.69 NCCCc1ccc(O)cc1F Amb27389254 [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.69 NCCCc1ccc(O)cc1O Amb18054814 [0,2,0,0,0,0|2,0,0]=4 6966 B12R1.69 NCCNc1ccc(Br)cc1Br Amb27416820 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.69 NCCNc1ccc(Cl)cc1Br Amb27416757 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.69 NCCNc1ccc(Cl)cc1Cl Amb17091081 [0,2,0,0,0,0|2,0,0]=4 6969 B12R1.69 NCCNc1ccc(Cl)cc1I Amb27416756 [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.69 NCCNc1ccc(F)cc1F Amb17057761 [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.69 NCCNc1ccc(I)cc1F Amb35597039 [0,2,0,0,0,0|2,0,0]=4 6972 B12R1.69 NCCNc1ccc(N)cc1F Amb18991505 [0,2,0,0,0,0|2,0,0]=4 6973 B12R1.69 NCCNc1ccc(O)cc1Cl Amb35735283 [0,2,0,0,0,0|2,0,0]=4 6974 B12R1.69 NCCOc1ccc(Br)cc1Br Amb17381668 [0,2,0,0,0,0|1,0,0]=3 6975 B12R1.69 NCCOc1ccc(Br)cc1Cl Amb5781232 [0,2,0,0,0,0|1,0,0]=3 6976 B12R1.69 NCCOc1ccc(Br)cc1F Amb9207748 [0,2,0,0,0,0|1,0,0]=3 6977 B12R1.69 NCCOc1ccc(Br)cc1O Amb33389601 [0,2,0,0,0,0|1,0,0]=3 6978 B12R1.69 NCCOc1ccc(Br)nc1Br Amb24712539 [0,2,0,0,0,0|2,0,0]=4 6979 B12R1.69 NCCOc1ccc(Cl)cc1Br Amb5781250 [0,2,0,0,0,0|1,0,0]=3 6980 B12R1.69 NCCOc1ccc(Cl)cc1Cl Amb534949 [0,2,0,0,0,0|1,0,0]=3 6981 B12R1.69 NCCOc1ccc(Cl)cc1F Amb25192665 [0,2,0,0,0,0|1,0,0]=3 6982 B12R1.69 NCCOc1ccc(Cl)cc1O Amb33260847 [0,2,0,0,0,0|1,0,0]=3 6983 B12R1.69 NCCOc1ccc(F)cc1Br Amb5781248 [0,2,0,0,0,0|1,0,0]=3 6984 B12R1.69 NCCOc1ccc(F)cc1Cl Amb2150774 [0,2,0,0,0,0|1,0,0]=3 6985 B12R1.69 NCCOc1ccc(F)cc1Cl Amb857218 [0,2,0,0,0,0|1,0,0]=3 6986 B12R1.69 NCCOc1ccc(F)cc1F Amb1139149 [0,2,0,0,0,0|1,0,0]=3 6987 B12R1.69 NCCOc1ccc(F)cc1F Amb19426831 [0,2,0,0,0,0|1,0,0]=3 6988 B12R1.69 NCCOc1ccc(N)cc1N Amb27650622 [0,2,0,0,0,0|1,0,0]=3 6989 B12R1.69 NCCOc1ccc(O)cc1Cl Amb33056626 [0,2,0,0,0,0|1,0,0]=3 6990 B12R1.69 NCCOc1ccc(O)cc1F Amb33376512 [0,2,0,0,0,0|1,0,0]=3 6991 B12R1.69 NCCOc1ccc(O)cc1O Amb33268971 [0,2,0,0,0,0|1,0,0]=3 6992 B12R1.69 NCCOc1cnc(Cl)cc1Cl Amb33259584 [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.69 NCCOc1ncc(Br)cc1F Amb28430643 [0,2,0,0,0,0|2,0,0]=4 6994 B12R1.69 NCCOc1ncc(Cl)cc1Cl Amb18296484 [0,2,0,0,0,0|2,0,0]=4 6995 B12R1.69 NCCOc1ncc(Cl)cc1Cl Amb20631072 [0,2,0,0,0,0|2,0,0]=4 6996 B12R1.69 NCCSc1ccc(Br)cc1N Amb18291323 [0,2,0,0,0,0|1,1,0]=4 6997 B12R1.69 NCCSc1ccc(N)cc1Br Amb28127135 [0,2,0,0,0,0|1,1,0]=4 6998 B12R1.69 Nc1cc(Br)ccc1CCCCl Amb27790897 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.69 Nc1cc(Br)ccc1NCCF Amb28366400 [0,2,0,0,0,0|2,0,0]=4 7000 B12R1.69 Nc1cc(Br)ccc1NCCO Amb7768140 [0,2,0,0,0,0|1,0,0]=3 7001 B12R1.69 Nc1cc(Br)ccc1OCCF Amb24758558 [0,2,0,0,0,0|1,0,0]=3 7002 B12R1.69 Nc1cc(Br)ccc1OCCO Amb6680947 [0,2,0,0,0,0|0,0,0]=2 7003 B12R1.69 Nc1cc(Br)cnc1NCCO Amb17209005 [0,2,0,0,0,0|2,0,0]=4 7004 B12R1.69 Nc1cc(Br)cnc1OCCO Amb18973561 [0,2,0,0,0,0|1,0,0]=3 7005 B12R1.69 Nc1cc(Br)cnc1SCCO Amb18973564 [0,2,0,0,0,0|1,1,0]=4 7006 B12R1.69 Nc1cc(Cl)ccc1CCCO Amb28346320 [0,2,0,0,0,0|1,0,0]=3 7007 B12R1.69 Nc1cc(Cl)ccc1NCCO Amb7768147 [0,2,0,0,0,0|1,0,0]=3 7008 B12R1.69 Nc1cc(Cl)ccc1OCCF Amb24487547 [0,2,0,0,0,0|1,0,0]=3 7009 B12R1.69 Nc1cc(Cl)ccc1OCCO Amb6702383 [0,2,0,0,0,0|0,0,0]=2 7010 B12R1.69 Nc1cc(Cl)cnc1NCCO Amb17208938 [0,2,0,0,0,0|2,0,0]=4 7011 B12R1.69 Nc1cc(Cl)cnc1OCCO Amb27151091 [0,2,0,0,0,0|1,0,0]=3 7012 B12R1.69 Nc1cc(F)ccc1CCCBr Amb27614017 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.69 Nc1cc(F)ccc1CCCCl Amb27614021 [0,2,0,0,0,0|2,0,0]=4 7014 B12R1.69 Nc1cc(F)ccc1OCCF Amb24437013 [0,2,0,0,0,0|1,0,0]=3 7015 B12R1.69 Nc1cc(F)ccc1OCCO Amb6680950 [0,2,0,0,0,0|0,0,0]=2 7016 B12R1.69 Nc1cc(F)cnc1NCCO Amb27959960 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.69 Nc1cc(F)cnc1OCCO Amb27959858 [0,2,0,0,0,0|1,0,0]=3 7018 B12R1.69 Nc1cc(I)ccc1CCCBr Amb27847294 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.69 Nc1cc(I)ccc1OCCO Amb25150025 [0,2,0,0,0,0|0,0,0]=2 7020 B12R1.69 Nc1cc(I)ccc1SCCO Amb28196227 [0,2,0,0,0,0|0,1,0]=3 7021 B12R1.69 Nc1cc(O)ccc1CCCBr Amb27442057 [0,2,0,0,0,0|2,0,0]=4 7022 B12R1.69 Nc1cc(O)ccc1CCCCl Amb27849133 [0,2,0,0,0,0|2,0,0]=4 7023 B12R1.69 Nc1cc(O)ccc1NCCO Amb28288398 [0,2,0,0,0,0|1,0,0]=3 7024 B12R1.69 Nc1ccc(CCCBr)c(Br)c1 Amb25243524 [0,2,0,0,0,0|2,0,0]=4 7025 B12R1.69 Nc1ccc(CCCBr)c(F)c1 Amb27877558 [0,2,0,0,0,0|2,0,0]=4 7026 B12R1.69 Nc1ccc(CCCBr)c(N)c1 Amb27462505 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.69 Nc1ccc(CCCCl)c(Br)c1 Amb27964587 [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.69 Nc1ccc(CCCCl)c(Cl)c1 Amb28196582 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.69 Nc1ccc(CCCCl)c(F)c1 Amb28286909 [0,2,0,0,0,0|2,0,0]=4 7030 B12R1.69 Nc1ccc(CCCCl)c(S)c1 Amb27616195 [0,2,0,0,0,0|2,0,0]=4 7031 B12R1.69 Nc1ccc(NCCO)c(F)c1 Amb7783383 [0,2,0,0,0,0|1,0,0]=3 7032 B12R1.69 Nc1ccc(OCCF)c(Br)c1 Amb32939660 [0,2,0,0,0,0|1,0,0]=3 7033 B12R1.69 Nc1ccc(OCCF)c(Cl)c1 Amb25866967 [0,2,0,0,0,0|1,0,0]=3 7034 B12R1.69 Nc1ccc(OCCF)c(F)c1 Amb25771296 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.69 Nc1ccc(OCCO)c(Br)c1 Amb18981633 [0,2,0,0,0,0|0,0,0]=2 7036 B12R1.69 Nc1ccc(OCCO)c(Cl)c1 Amb6702385 [0,2,0,0,0,0|0,0,0]=2 7037 B12R1.69 Nc1ccc(OCCO)c(F)c1 Amb7783488 [0,2,0,0,0,0|0,0,0]=2 7038 B12R1.69 Nc1ccc(OCCO)c(I)c1 Amb25035161 [0,2,0,0,0,0|0,0,0]=2 7039 B12R1.69 Nc1ccc(OCCO)c(N)c1 Amb22734340 [0,2,0,0,0,0|0,0,0]=2 7040 B12R1.69 Nc1ccc(OCCO)c(N)c1 Amb4027859 [0,2,0,0,0,0|0,0,0]=2 7041 B12R1.69 Nc1ccc(OCCO)c(N)c1 Amb6383324 [0,2,0,0,0,0|0,0,0]=2 7042 B12R1.69 Nc1ccc(SCCF)c(Br)c1 Amb27754657 [0,2,0,0,0,0|1,1,0]=4 7043 B12R1.69 Nc1ccc(SCCF)c(Cl)c1 Amb27263275 [0,2,0,0,0,0|1,1,0]=4 7044 B12R1.69 Nc1ccc(SCCO)c(Cl)c1 Amb8936074 [0,2,0,0,0,0|0,1,0]=3 7045 B12R1.69 Nc1ccc(SCCO)c(O)c1 Amb27770270 [0,2,0,0,0,0|0,1,0]=3 7046 B12R1.69 Nc1cnc(NCCO)c(Br)c1 Amb17213688 [0,2,0,0,0,0|2,0,0]=4 7047 B12R1.69 Nc1cnc(OCCO)c(Br)c1 Amb25882403 [0,2,0,0,0,0|1,0,0]=3 7048 B12R1.69 Nc1cnc(OCCO)c(Cl)c1 Amb25121631 [0,2,0,0,0,0|1,0,0]=3 7049 B12R1.69 Nc1cnc(OCCO)c(N)c1 Amb27616898 [0,2,0,0,0,0|1,0,0]=3 7050 B12R1.69 O=CCOc1ccc(Br)cc1Cl Amb17099944 [0,2,0,0,0,0|0,0,2]=4 7051 B12R1.69 O=CCOc1ccc(Cl)cc1Cl Amb4035219 [0,2,0,0,0,0|0,0,2]=4 7052 B12R1.69 O=CCOc1ccc(F)cc1Cl Amb18330025 [0,2,0,0,0,0|0,0,2]=4 7053 B12R1.69 O=CCOc1ccc(F)cc1F Amb18807299 [0,2,0,0,0,0|0,0,2]=4 7054 B12R1.69 OCC#Cc1ccc(Br)cc1F Amb32654824 [0,2,0,0,0,0|1,0,1]=4 7055 B12R1.69 OCC#Cc1ccc(Cl)cc1Cl Amb9777296 [0,2,0,0,0,0|1,0,1]=4 7056 B12R1.69 OCC#Cc1ccc(Cl)cc1F Amb2423467 [0,2,0,0,0,0|1,0,1]=4 7057 B12R1.69 OCC#Cc1ccc(F)cc1F Amb9777281 [0,2,0,0,0,0|1,0,1]=4 7058 B12R1.69 OCCCc1ccc(Br)cc1Cl Amb26481654 [0,2,0,0,0,0|1,0,0]=3 7059 B12R1.69 OCCCc1ccc(Br)cc1F Amb20171344 [0,2,0,0,0,0|1,0,0]=3 7060 B12R1.69 OCCCc1ccc(Br)cc1O Amb33389673 [0,2,0,0,0,0|1,0,0]=3 7061 B12R1.69 OCCCc1ccc(Cl)cc1Br Amb32944418 [0,2,0,0,0,0|1,0,0]=3 7062 B12R1.69 OCCCc1ccc(Cl)cc1Cl Amb17402981 [0,2,0,0,0,0|1,0,0]=3 7063 B12R1.69 OCCCc1ccc(Cl)cc1F Amb25720643 [0,2,0,0,0,0|1,0,0]=3 7064 B12R1.69 OCCCc1ccc(Cl)cc1O Amb33261476 [0,2,0,0,0,0|1,0,0]=3 7065 B12R1.69 OCCCc1ccc(F)cc1Br Amb24090111 [0,2,0,0,0,0|1,0,0]=3 7066 B12R1.69 OCCCc1ccc(F)cc1Cl Amb19072148 [0,2,0,0,0,0|1,0,0]=3 7067 B12R1.69 OCCCc1ccc(F)cc1F Amb17605787 [0,2,0,0,0,0|1,0,0]=3 7068 B12R1.69 OCCCc1ccc(F)cc1O Amb25106077 [0,2,0,0,0,0|1,0,0]=3 7069 B12R1.69 OCCCc1ccc(O)cc1Cl Amb25690683 [0,2,0,0,0,0|1,0,0]=3 7070 B12R1.69 OCCCc1ccc(O)cc1F Amb25281830 [0,2,0,0,0,0|1,0,0]=3 7071 B12R1.69 OCCCc1ccc(O)cc1O Amb18646882 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.69 OCCCc1cnc(Cl)cc1Cl Amb33259524 [0,2,0,0,0,0|2,0,0]=4 7073 B12R1.69 OCCNc1ccc(F)cc1F Amb6712905 [0,2,0,0,0,0|1,0,0]=3 7074 B12R1.69 OCCNc1ccc(F)cc1I Amb27881383 [0,2,0,0,0,0|1,0,0]=3 7075 B12R1.69 OCCNc1ccc(I)cc1F Amb35589462 [0,2,0,0,0,0|1,0,0]=3 7076 B12R1.69 OCCNc1cnc(Cl)cc1I Amb27478630 [0,2,0,0,0,0|2,0,0]=4 7077 B12R1.69 OCCNc1ncc(Br)cc1F Amb27977089 [0,2,0,0,0,0|2,0,0]=4 7078 B12R1.69 OCCNc1ncc(Cl)cc1F Amb19959550 [0,2,0,0,0,0|2,0,0]=4 7079 B12R1.69 OCCNc1ncc(F)cc1F Amb27837246 [0,2,0,0,0,0|2,0,0]=4 7080 B12R1.69 OCCOc1ccc(Br)cc1Cl Amb9245005 [0,2,0,0,0,0|0,0,0]=2 7081 B12R1.69 OCCOc1ccc(Cl)cc1Br Amb2712563 [0,2,0,0,0,0|0,0,0]=2 7082 B12R1.69 OCCOc1ccc(Cl)cc1Cl Amb1050772 [0,2,0,0,0,0|0,0,0]=2 7083 B12R1.69 OCCOc1ccc(Cl)cc1F Amb27614577 [0,2,0,0,0,0|0,0,0]=2 7084 B12R1.69 OCCOc1ccc(F)cc1Cl Amb17105030 [0,2,0,0,0,0|0,0,0]=2 7085 B12R1.69 OCCOc1ccc(F)cc1F Amb9274277 [0,2,0,0,0,0|0,0,0]=2 7086 B12R1.69 OCCOc1ccc(I)cc1Br Amb27242867 [0,2,0,0,0,0|0,0,0]=2 7087 B12R1.69 OCCOc1cnc(F)cc1Cl Amb27809244 [0,2,0,0,0,0|1,0,0]=3 7088 B12R1.69 OCCOc1ncc(Br)cc1Br Amb27593802 [0,2,0,0,0,0|1,0,0]=3 7089 B12R1.69 OCCOc1ncc(Br)cc1Cl Amb27454120 [0,2,0,0,0,0|1,0,0]=3 7090 B12R1.69 OCCOc1ncc(Br)cc1O Amb21959464 [0,2,0,0,0,0|1,0,0]=3 7091 B12R1.69 OCCSc1ccc(Cl)cc1Cl Amb2686952 [0,2,0,0,0,0|0,1,0]=3 7092 B12R1.69 OCCSc1ccc(F)cc1F Amb2687260 [0,2,0,0,0,0|0,1,0]=3 7093 B12R1.69 OCCSc1ncc(Br)cc1F Amb27977090 [0,2,0,0,0,0|1,1,0]=4 7094 B12R1.69 OC\C=C\c1ccc(Br)cc1Cl Amb33240476 [0,2,0,0,0,0|1,0,1]=4 7095 B12R1.69 OC\C=C\c1ccc(Br)cc1F Amb26961555 [0,2,0,0,0,0|1,0,1]=4 7096 B12R1.69 OC\C=C\c1ccc(Br)cc1O Amb33389592 [0,2,0,0,0,0|1,0,1]=4 7097 B12R1.69 OC\C=C\c1ccc(Cl)cc1Br Amb33451394 [0,2,0,0,0,0|1,0,1]=4 7098 B12R1.69 OC\C=C\c1ccc(Cl)cc1Cl Amb22499014 [0,2,0,0,0,0|1,0,1]=4 7099 B12R1.69 OC\C=C\c1ccc(Cl)cc1F Amb25697673 [0,2,0,0,0,0|1,0,1]=4 7100 B12R1.69 OC\C=C\c1ccc(Cl)cc1O Amb33260514 [0,2,0,0,0,0|1,0,1]=4 7101 B12R1.69 OC\C=C\c1ccc(F)cc1Br Amb33242604 [0,2,0,0,0,0|1,0,1]=4 7102 B12R1.69 OC\C=C\c1ccc(F)cc1Cl Amb27390354 [0,2,0,0,0,0|1,0,1]=4 7103 B12R1.69 OC\C=C\c1ccc(F)cc1F Amb23442759 [0,2,0,0,0,0|1,0,1]=4 7104 B12R1.69 OC\C=C\c1ccc(O)cc1Cl Amb33226011 [0,2,0,0,0,0|1,0,1]=4 7105 B12R1.69 OC\C=C\c1ccc(O)cc1F Amb35696348 [0,2,0,0,0,0|1,0,1]=4 7106 B12R1.69 OC\C=C\c1ccc(O)cc1O Amb33269718 [0,2,0,0,0,0|1,0,1]=4 7107 B12R1.69 Oc1cc(Br)ccc1CCCBr Amb27613860 [0,2,0,0,0,0|2,0,0]=4 7108 B12R1.69 Oc1cc(Br)ccc1CCCCl Amb28286872 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.69 Oc1cc(Br)ccc1CCCS Amb33389685 [0,2,0,0,0,0|1,1,0]=4 7110 B12R1.69 Oc1cc(Cl)ccc1CCCBr Amb24743949 [0,2,0,0,0,0|2,0,0]=4 7111 B12R1.69 Oc1cc(Cl)ccc1CCCS Amb33413683 [0,2,0,0,0,0|1,1,0]=4 7112 B12R1.69 Oc1cc(F)ccc1CCCBr Amb27877080 [0,2,0,0,0,0|2,0,0]=4 7113 B12R1.69 Oc1cc(F)ccc1CCCCl Amb28423941 [0,2,0,0,0,0|2,0,0]=4 7114 B12R1.69 Oc1cc(I)ccc1CCCBr Amb27230861 [0,2,0,0,0,0|2,0,0]=4 7115 B12R1.69 Oc1ccc(CCCBr)c(Cl)c1 Amb27428168 [0,2,0,0,0,0|2,0,0]=4 7116 B12R1.69 Oc1ccc(CCCBr)c(F)c1 Amb27965291 [0,2,0,0,0,0|2,0,0]=4 7117 B12R1.69 Oc1ccc(CCCBr)c(O)c1 Amb27462654 [0,2,0,0,0,0|2,0,0]=4 7118 B12R1.69 Oc1ccc(CCCCl)c(Br)c1 Amb27968276 [0,2,0,0,0,0|2,0,0]=4 7119 B12R1.69 Oc1ccc(CCCCl)c(Cl)c1 Amb27215608 [0,2,0,0,0,0|2,0,0]=4 7120 B12R1.69 Oc1ccc(CCCCl)c(F)c1 Amb27423574 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.69 Oc1ccc(CCCCl)c(I)c1 Amb27439362 [0,2,0,0,0,0|2,0,0]=4 7122 B12R1.69 Oc1ccc(CCCS)c(Cl)c1 Amb33057343 [0,2,0,0,0,0|1,1,0]=4 7123 B12R1.69 Oc1ccc(CCCS)c(F)c1 Amb33376506 [0,2,0,0,0,0|1,1,0]=4 7124 B12R1.69 Oc1ccc(CCCS)c(O)c1 Amb33268961 [0,2,0,0,0,0|1,1,0]=4 7125 B12R1.69 SCCCc1ccc(Br)cc1Cl Amb33485051 [0,2,0,0,0,0|1,1,0]=4 7126 B12R1.69 SCCCc1ccc(Cl)cc1Br Amb33478798 [0,2,0,0,0,0|1,1,0]=4 7127 B12R1.69 SCCCc1ccc(Cl)cc1Cl Amb26961727 [0,2,0,0,0,0|1,1,0]=4 7128 B12R1.69 SCCOc1ccc(Cl)cc1Cl Amb2794987 [0,2,0,0,0,0|0,1,0]=3 7129 B12R1.69 Sc1cc(Br)ccc1CCCBr Amb27445823 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.69 Sc1cc(Br)ccc1CCCCl Amb26894885 [0,2,0,0,0,0|2,0,0]=4 7131 B12R1.69 Sc1cc(Cl)ccc1CCCBr Amb27200568 [0,2,0,0,0,0|2,0,0]=4 7132 B12R1.69 Sc1cc(I)ccc1CCCBr Amb27441617 [0,2,0,0,0,0|2,0,0]=4 7133 B12R1.69 Sc1cc(I)ccc1CCCCl Amb27624810 [0,2,0,0,0,0|2,0,0]=4 7134 B12R1.69 Sc1ccc(CCCBr)c(Br)c1 Amb27796646 [0,2,0,0,0,0|2,0,0]=4 7135 B12R1.69 Sc1ccc(CCCBr)c(S)c1 Amb27813667 [0,2,0,0,0,0|2,0,0]=4 7136 B12R1.69 Sc1ccc(CCCCl)c(Br)c1 Amb26445164 [0,2,0,0,0,0|2,0,0]=4 7137 B12R1.71 C#CCOc1ccc(C=O)cc1 Amb1880437 [0,2,0,0,0,0|1,0,1]=4 7138 B12R1.71 C#CCOc1ccc(CN)cc1 Amb32652182 [0,2,0,0,0,0|1,0,1]=4 7139 B12R1.71 C#CCOc1ccc(CN)cc1 Amb33535591 [0,2,0,0,0,0|1,0,1]=4 7140 B12R1.71 C#CCOc1ccc(CO)cc1 Amb33527751 [0,2,0,0,0,0|1,0,1]=4 7141 B12R1.71 C#CCOc1ccc(NC)cc1 Amb18972060 [0,2,0,0,0,0|1,0,1]=4 7142 B12R1.71 C#CCOc1ccc(OC)cc1 Amb18800611 [0,2,0,0,0,0|1,0,1]=4 7143 B12R1.71 C#Cc1ccc(C#CCO)cc1 Amb27978539 [0,2,0,0,0,0|1,0,1]=4 7144 B12R1.71 C#Cc1ccc(CCCBr)cc1 Amb33432187 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.71 C#Cc1ccc(CCCC)cc1 Amb2722839 [0,2,0,0,0,0|2,0,0]=4 7146 B12R1.71 C#Cc1ccc(CCCN)cc1 Amb32877911 [0,2,0,0,0,0|2,0,0]=4 7147 B12R1.71 C#Cc1ccc(CCCO)cc1 Amb32882246 [0,2,0,0,0,0|1,0,0]=3 7148 B12R1.71 C#Cc1ccc(CCCS)cc1 Amb32881952 [0,2,0,0,0,0|1,1,0]=4 7149 B12R1.71 C#Cc1ccc(NCCO)cc1 Amb27981963 [0,2,0,0,0,0|1,0,0]=3 7150 B12R1.71 C#Cc1ccc(OCCC)cc1 Amb2722835 [0,2,0,0,0,0|1,0,0]=3 7151 B12R1.71 C#Cc1ccc(OCCC)nc1 Amb25260764 [0,2,0,0,0,0|2,0,0]=4 7152 B12R1.71 C#Cc1ccc(OCCN)cc1 Amb32882222 [0,2,0,0,0,0|1,0,0]=3 7153 B12R1.71 C#Cc1ccc(OCOC)cc1 Amb22387889 [0,2,0,0,0,0|2,0,0]=4 7154 B12R1.71 C#Cc1ccc(\C=C\CO)cc1 Amb33267354 [0,2,0,0,0,0|1,0,1]=4 7155 B12R1.71 C=CCOc1ccc(C#N)cc1 Amb6269982 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.71 C=CCOc1ccc(C=O)cc1 Amb1240568 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.71 C=CCOc1ccc(CN)cc1 Amb33528217 [0,2,0,0,0,0|1,0,1]=4 7158 B12R1.71 C=CCOc1ccc(CO)cc1 Amb33526741 [0,2,0,0,0,0|1,0,1]=4 7159 B12R1.71 C=CCOc1ccc(CS)cc1 Amb32788045 [0,2,0,0,0,0|1,0,1]=4 7160 B12R1.71 C=CCOc1ccc(OC)cc1 Amb4406979 [0,2,0,0,0,0|1,0,1]=4 7161 B12R1.71 C=Cc1ccc(CCCN)cc1 Amb33717616 [0,2,0,0,0,0|2,0,0]=4 7162 B12R1.71 C=Cc1ccc(NCCO)cc1 Amb28458549 [0,2,0,0,0,0|1,0,0]=3 7163 B12R1.71 C=Cc1ccc(\C=C\CO)cc1 Amb27836019 [0,2,0,0,0,0|1,0,1]=4 7164 B12R1.71 CCCCc1ccc(C#N)cc1 Amb2685606 [0,2,0,0,0,0|2,0,0]=4 7165 B12R1.71 CCCCc1ccc(C=O)cc1 Amb3939917 [0,2,0,0,0,0|2,0,0]=4 7166 B12R1.71 CCCCc1ccc(CBr)cc1 Amb24065906 [0,2,0,0,0,0|2,0,0]=4 7167 B12R1.71 CCCCc1ccc(CCl)cc1 Amb7777303 [0,2,0,0,0,0|2,0,0]=4 7168 B12R1.71 CCCCc1ccc(CN)cc1 Amb6357566 [0,2,0,0,0,0|2,0,0]=4 7169 B12R1.71 CCCCc1ccc(CO)cc1 Amb3939151 [0,2,0,0,0,0|2,0,0]=4 7170 B12R1.71 CCCCc1ccc(C[NH3+])cc1 Amb33513032 [0,2,0,0,0,0|2,0,0]=4 7171 B12R1.71 CCCCc1ccc(NC)cc1 Amb20623748 [0,2,0,0,0,0|2,0,0]=4 7172 B12R1.71 CCCCc1ccc(NC)cc1 Amb8951725 [0,2,0,0,0,0|2,0,0]=4 7173 B12R1.71 CCCCc1ccc(NN)cc1 Amb17949643 [0,2,0,0,0,0|2,0,0]=4 7174 B12R1.71 CCCCc1ccc(NN)cc1 Amb2234491 [0,2,0,0,0,0|2,0,0]=4 7175 B12R1.71 CCCCc1ccc([Mg]Br)cc1 Amb22000527 [0,2,0,0,0,0|2,0,0]=4 7176 B12R1.71 CCCNc1ccc(C#N)cc1 Amb6679338 [0,2,0,0,0,0|2,0,0]=4 7177 B12R1.71 CCCNc1ccc(CC)cc1 Amb6698788 [0,2,0,0,0,0|2,0,0]=4 7178 B12R1.71 CCCNc1ccc(CCl)cc1 Amb28366603 [0,2,0,0,0,0|2,0,0]=4 7179 B12R1.71 CCCNc1ccc(CN)cc1 Amb18800849 [0,2,0,0,0,0|2,0,0]=4 7180 B12R1.71 CCCNc1ccc(OC)cc1 Amb4313500 [0,2,0,0,0,0|2,0,0]=4 7181 B12R1.71 CCCOc1ccc(C#N)cc1 Amb2722817 [0,2,0,0,0,0|1,0,0]=3 7182 B12R1.71 CCCOc1ccc(C=O)cc1 Amb1073495 [0,2,0,0,0,0|1,0,0]=3 7183 B12R1.71 CCCOc1ccc(CCl)cc1 Amb6639502 [0,2,0,0,0,0|1,0,0]=3 7184 B12R1.71 CCCOc1ccc(CCl)nc1 Amb24065127 [0,2,0,0,0,0|2,0,0]=4 7185 B12R1.71 CCCOc1ccc(CN)cc1 Amb1136393 [0,2,0,0,0,0|1,0,0]=3 7186 B12R1.71 CCCOc1ccc(CN)cn1 Amb8874522 [0,2,0,0,0,0|2,0,0]=4 7187 B12R1.71 CCCOc1ccc(CO)cc1 Amb3548150 [0,2,0,0,0,0|1,0,0]=3 7188 B12R1.71 CCCOc1ccc(CO)cn1 Amb18788576 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.71 CCCOc1ccc(CS)cc1 Amb32788372 [0,2,0,0,0,0|1,0,0]=3 7190 B12R1.71 CCCOc1ccc(NC)cc1 Amb19032018 [0,2,0,0,0,0|1,0,0]=3 7191 B12R1.71 CCCOc1ccc(NN)cc1 Amb17232617 [0,2,0,0,0,0|1,0,0]=3 7192 B12R1.71 CCCOc1ccc(NN)cc1 Amb32582681 [0,2,0,0,0,0|1,0,0]=3 7193 B12R1.71 CCCSc1ccc(CO)cc1 Amb30590042 [0,2,0,0,0,0|1,1,0]=4 7194 B12R1.71 CCc1ccc(C#CCO)cc1 Amb18792228 [0,2,0,0,0,0|1,0,1]=4 7195 B12R1.71 CCc1ccc(CCCBr)cc1 Amb17104557 [0,2,0,0,0,0|2,0,0]=4 7196 B12R1.71 CCc1ccc(CCCCl)cc1 Amb17104530 [0,2,0,0,0,0|2,0,0]=4 7197 B12R1.71 CCc1ccc(CCCN)cc1 Amb5735479 [0,2,0,0,0,0|2,0,0]=4 7198 B12R1.71 CCc1ccc(CCCO)cc1 Amb17089498 [0,2,0,0,0,0|1,0,0]=3 7199 B12R1.71 CCc1ccc(CCCO)nc1 Amb33213087 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.71 CCc1ccc(CCCS)cc1 Amb17400844 [0,2,0,0,0,0|1,1,0]=4 7201 B12R1.71 CCc1ccc(NCCCl)cc1 Amb17335668 [0,2,0,0,0,0|2,0,0]=4 7202 B12R1.71 CCc1ccc(NCCN)cc1 Amb17057758 [0,2,0,0,0,0|2,0,0]=4 7203 B12R1.71 CCc1ccc(NCCO)cc1 Amb6713158 [0,2,0,0,0,0|1,0,0]=3 7204 B12R1.71 CCc1ccc(OCC=O)cc1 Amb5731831 [0,2,0,0,0,0|0,0,2]=4 7205 B12R1.71 CCc1ccc(OCCBr)cc1 Amb1353197 [0,2,0,0,0,0|1,0,0]=3 7206 B12R1.71 CCc1ccc(OCCCl)cc1 Amb8828423 [0,2,0,0,0,0|1,0,0]=3 7207 B12R1.71 CCc1ccc(OCCN)cc1 Amb1138492 [0,2,0,0,0,0|1,0,0]=3 7208 B12R1.71 CCc1ccc(OCCN)cc1 Amb4021767 [0,2,0,0,0,0|1,0,0]=3 7209 B12R1.71 CCc1ccc(OCCO)cc1 Amb9370640 [0,2,0,0,0,0|0,0,0]=2 7210 B12R1.71 CCc1ccc(OCCS)cc1 Amb17233943 [0,2,0,0,0,0|0,1,0]=3 7211 B12R1.71 CCc1ccc(SCCN)cc1 Amb17083025 [0,2,0,0,0,0|1,1,0]=4 7212 B12R1.71 CCc1ccc(\C=C\CO)cc1 Amb23442835 [0,2,0,0,0,0|1,0,1]=4 7213 B12R1.71 CNc1ccc(OCCN)cc1 Amb23400492 [0,2,0,0,0,0|1,0,0]=3 7214 B12R1.71 COCOc1ccc(C=O)cc1 Amb24103003 [0,2,0,0,0,0|2,0,0]=4 7215 B12R1.71 COc1ccc(C#CCO)cc1 Amb8392044 [0,2,0,0,0,0|1,0,1]=4 7216 B12R1.71 COc1ccc(CCCBr)cc1 Amb17104559 [0,2,0,0,0,0|2,0,0]=4 7217 B12R1.71 COc1ccc(CCCCl)cc1 Amb9004328 [0,2,0,0,0,0|2,0,0]=4 7218 B12R1.71 COc1ccc(CCCI)cc1 Amb33801571 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.71 COc1ccc(CCCN)cc1 Amb1092530 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.71 COc1ccc(CCCN)cc1 Amb13949143 [0,2,0,0,0,0|2,0,0]=4 7221 B12R1.71 COc1ccc(CCCO)cc1 Amb3939056 [0,2,0,0,0,0|1,0,0]=3 7222 B12R1.71 COc1ccc(CCCO)cn1 Amb33474576 [0,2,0,0,0,0|2,0,0]=4 7223 B12R1.71 COc1ccc(CCCO)nc1 Amb33204066 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.71 COc1ccc(CCCS)cc1 Amb17400951 [0,2,0,0,0,0|1,1,0]=4 7225 B12R1.71 COc1ccc(NCCCl)cc1 Amb17335808 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.71 COc1ccc(NCCN)cc1 Amb10604015 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.71 COc1ccc(NCCO)cc1 Amb6714233 [0,2,0,0,0,0|1,0,0]=3 7228 B12R1.71 COc1ccc(NCCO)cn1 Amb33527972 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.71 COc1ccc(NCCS)cc1 Amb27268333 [0,2,0,0,0,0|1,1,0]=4 7230 B12R1.71 COc1ccc(OCC#N)cc1 Amb2725936 [0,2,0,0,0,0|1,0,1]=4 7231 B12R1.71 COc1ccc(OCC=O)cc1 Amb5731834 [0,2,0,0,0,0|0,0,2]=4 7232 B12R1.71 COc1ccc(OCCBr)cc1 Amb1151010 [0,2,0,0,0,0|1,0,0]=3 7233 B12R1.71 COc1ccc(OCCCl)cc1 Amb2446473 [0,2,0,0,0,0|1,0,0]=3 7234 B12R1.71 COc1ccc(OCCN)cc1 Amb1063468 [0,2,0,0,0,0|1,0,0]=3 7235 B12R1.71 COc1ccc(OCCN)cc1 Amb2689175 [0,2,0,0,0,0|1,0,0]=3 7236 B12R1.71 COc1ccc(OCCN)cn1 Amb32954384 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.71 COc1ccc(OCCN)nc1 Amb33429297 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.71 COc1ccc(OCCO)cc1 Amb2209351 [0,2,0,0,0,0|0,0,0]=2 7239 B12R1.71 COc1ccc(OCCS)cc1 Amb6255797 [0,2,0,0,0,0|0,1,0]=3 7240 B12R1.71 COc1ccc(OCC[NH3+])cc1 Amb2722864 [0,2,0,0,0,0|1,0,0]=3 7241 B12R1.71 COc1ccc(SCCN)cc1 Amb22051707 [0,2,0,0,0,0|1,1,0]=4 7242 B12R1.71 COc1ccc(SCCN)cc1 Amb998172 [0,2,0,0,0,0|1,1,0]=4 7243 B12R1.71 COc1ccc(SCCO)cc1 Amb2689270 [0,2,0,0,0,0|0,1,0]=3 7244 B12R1.71 COc1ccc(\C=C/CO)cc1 Amb27668023 [0,2,0,0,0,0|1,0,1]=4 7245 B12R1.71 COc1ccc(\C=C\CO)cc1 Amb837391 [0,2,0,0,0,0|1,0,1]=4 7246 B12R1.71 CSc1ccc(C#CCO)cc1 Amb25228424 [0,2,0,0,0,0|1,0,1]=4 7247 B12R1.71 CSc1ccc(CCCBr)cc1 Amb33451150 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.71 CSc1ccc(CCCN)cc1 Amb18055313 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.71 CSc1ccc(CCCO)cc1 Amb18863034 [0,2,0,0,0,0|1,0,0]=3 7250 B12R1.71 CSc1ccc(CCCS)cc1 Amb31132713 [0,2,0,0,0,0|1,1,0]=4 7251 B12R1.71 CSc1ccc(NCCCl)cc1 Amb27800989 [0,2,0,0,0,0|2,0,0]=4 7252 B12R1.71 CSc1ccc(NCCF)cc1 Amb27949961 [0,2,0,0,0,0|2,0,0]=4 7253 B12R1.71 CSc1ccc(NCCN)cc1 Amb18243831 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.71 CSc1ccc(OCC#N)cc1 Amb22523395 [0,2,0,0,0,0|1,0,1]=4 7255 B12R1.71 CSc1ccc(OCCCl)cc1 Amb19148893 [0,2,0,0,0,0|1,0,0]=3 7256 B12R1.71 CSc1ccc(OCCN)cc1 Amb10243213 [0,2,0,0,0,0|1,0,0]=3 7257 B12R1.71 CSc1ccc(\C=C\CO)cc1 Amb33136408 [0,2,0,0,0,0|1,0,1]=4 7258 B12R1.71 FCCOc1ccc(CBr)cc1 Amb23580154 [0,2,0,0,0,0|1,0,0]=3 7259 B12R1.71 FCCOc1ccc(CCl)cc1 Amb31207832 [0,2,0,0,0,0|1,0,0]=3 7260 B12R1.71 N#CCOc1ccc(C#N)cc1 Amb6270405 [0,2,0,0,0,0|1,0,1]=4 7261 B12R1.71 N#CCOc1ccc(C=O)cc1 Amb1214880 [0,2,0,0,0,0|1,0,1]=4 7262 B12R1.71 N#CCOc1ccc(CBr)cc1 Amb8835528 [0,2,0,0,0,0|1,0,1]=4 7263 B12R1.71 N#CCOc1ccc(CCl)cc1 Amb6653842 [0,2,0,0,0,0|1,0,1]=4 7264 B12R1.71 N#CCOc1ccc(CN)cc1 Amb19373065 [0,2,0,0,0,0|1,0,1]=4 7265 B12R1.71 N#CCOc1ccc(CN)cc1 Amb9620826 [0,2,0,0,0,0|1,0,1]=4 7266 B12R1.71 N#CCOc1ccc(CO)cc1 Amb33527922 [0,2,0,0,0,0|1,0,1]=4 7267 B12R1.71 N#CCOc1ccc(CS)cc1 Amb32788396 [0,2,0,0,0,0|1,0,1]=4 7268 B12R1.71 N#Cc1ccc(C#CCO)cc1 Amb836704 [0,2,0,0,0,0|1,0,1]=4 7269 B12R1.71 N#Cc1ccc(CCCBr)cc1 Amb25851402 [0,2,0,0,0,0|2,0,0]=4 7270 B12R1.71 N#Cc1ccc(CCCCl)cc1 Amb27663895 [0,2,0,0,0,0|2,0,0]=4 7271 B12R1.71 N#Cc1ccc(CCCN)cc1 Amb25708502 [0,2,0,0,0,0|2,0,0]=4 7272 B12R1.71 N#Cc1ccc(CCCO)cc1 Amb13883607 [0,2,0,0,0,0|1,0,0]=3 7273 B12R1.71 N#Cc1ccc(CCCS)cc1 Amb33317543 [0,2,0,0,0,0|1,1,0]=4 7274 B12R1.71 N#Cc1ccc(NCCCl)cc1 Amb17335462 [0,2,0,0,0,0|2,0,0]=4 7275 B12R1.71 N#Cc1ccc(NCCN)cc1 Amb6679323 [0,2,0,0,0,0|2,0,0]=4 7276 B12R1.71 N#Cc1ccc(NCCO)cc1 Amb33526948 [0,2,0,0,0,0|1,0,0]=3 7277 B12R1.71 N#Cc1ccc(NCCO)cn1 Amb26321389 [0,2,0,0,0,0|2,0,0]=4 7278 B12R1.71 N#Cc1ccc(OCC=O)cc1 Amb18800495 [0,2,0,0,0,0|0,0,2]=4 7279 B12R1.71 N#Cc1ccc(OCCBr)cc1 Amb1107353 [0,2,0,0,0,0|1,0,0]=3 7280 B12R1.71 N#Cc1ccc(OCCF)nc1 Amb26558048 [0,2,0,0,0,0|2,0,0]=4 7281 B12R1.71 N#Cc1ccc(OCCI)cc1 Amb28206772 [0,2,0,0,0,0|1,0,0]=3 7282 B12R1.71 N#Cc1ccc(OCCN)cc1 Amb17562028 [0,2,0,0,0,0|1,0,0]=3 7283 B12R1.71 N#Cc1ccc(OCCN)cc1 Amb33548236 [0,2,0,0,0,0|1,0,0]=3 7284 B12R1.71 N#Cc1ccc(OCCN)nc1 Amb18988873 [0,2,0,0,0,0|2,0,0]=4 7285 B12R1.71 N#Cc1ccc(OCCO)cc1 Amb2761037 [0,2,0,0,0,0|0,0,0]=2 7286 B12R1.71 N#Cc1ccc(OCCO)nc1 Amb6681181 [0,2,0,0,0,0|1,0,0]=3 7287 B12R1.71 N#Cc1ccc(OCCO)nn1 Amb27640513 [0,2,0,0,0,0|2,0,0]=4 7288 B12R1.71 N#Cc1ccc(OCCS)cc1 Amb27770045 [0,2,0,0,0,0|0,1,0]=3 7289 B12R1.71 N#Cc1ccc(SCCO)cc1 Amb9238657 [0,2,0,0,0,0|0,1,0]=3 7290 B12R1.71 N#Cc1ccc(SCCO)nc1 Amb9238967 [0,2,0,0,0,0|1,1,0]=4 7291 B12R1.71 N#Cc1ccc(\C=C\CO)cc1 Amb33136409 [0,2,0,0,0,0|1,0,1]=4 7292 B12R1.71 N#Cc1cnc(OCCO)cn1 Amb28421809 [0,2,0,0,0,0|2,0,0]=4 7293 B12R1.71 N#Cc1ncc(OCCO)cn1 Amb27809243 [0,2,0,0,0,0|2,0,0]=4 7294 B12R1.71 N=Nc1ccc(NCCO)cc1 Amb26954590 [0,2,0,0,0,0|1,0,0]=3 7295 B12R1.71 NCCCc1ccc(CO)cc1 Amb17477572 [0,2,0,0,0,0|2,0,0]=4 7296 B12R1.71 NCc1ccc(CCCO)cc1 Amb23441994 [0,2,0,0,0,0|1,0,0]=3 7297 B12R1.71 NCc1ccc(NCCF)cc1 Amb27635567 [0,2,0,0,0,0|2,0,0]=4 7298 B12R1.71 NCc1ccc(NCCO)cc1 Amb5786733 [0,2,0,0,0,0|1,0,0]=3 7299 B12R1.71 NCc1ccc(OCCBr)cc1 Amb24094298 [0,2,0,0,0,0|1,0,0]=3 7300 B12R1.71 NCc1ccc(OCCF)cc1 Amb23580153 [0,2,0,0,0,0|1,0,0]=3 7301 B12R1.71 NCc1ccc(OCCO)cc1 Amb13951489 [0,2,0,0,0,0|0,0,0]=2 7302 B12R1.71 NCc1ccc(OCCO)cc1 Amb6680930 [0,2,0,0,0,0|0,0,0]=2 7303 B12R1.71 NNc1ccc(OCCBr)cc1 Amb27874315 [0,2,0,0,0,0|1,0,0]=3 7304 B12R1.71 O=Cc1ccc(C#CCO)cc1 Amb836735 [0,2,0,0,0,0|1,0,1]=4 7305 B12R1.71 O=Cc1ccc(CCCO)cc1 Amb18646079 [0,2,0,0,0,0|1,0,0]=3 7306 B12R1.71 O=Cc1ccc(NCCO)cc1 Amb8394240 [0,2,0,0,0,0|1,0,0]=3 7307 B12R1.71 O=Cc1ccc(OCCBr)cc1 Amb842388 [0,2,0,0,0,0|1,0,0]=3 7308 B12R1.71 O=Cc1ccc(OCCCl)cc1 Amb857538 [0,2,0,0,0,0|1,0,0]=3 7309 B12R1.71 O=Cc1ccc(OCCF)cc1 Amb23579953 [0,2,0,0,0,0|1,0,0]=3 7310 B12R1.71 O=Cc1ccc(OCCO)cc1 Amb857537 [0,2,0,0,0,0|0,0,0]=2 7311 B12R1.71 O=Cc1ccc(OCCO)nc1 Amb32668016 [0,2,0,0,0,0|1,0,0]=3 7312 B12R1.71 O=Cc1ccc(\C=C\CO)cc1 Amb27974046 [0,2,0,0,0,0|1,0,1]=4 7313 B12R1.71 O=Nc1ccc(NCCO)cc1 Amb27482840 [0,2,0,0,0,0|1,0,0]=3 7314 B12R1.71 OCC#Cc1ccc(CO)cc1 Amb18792413 [0,2,0,0,0,0|1,0,1]=4 7315 B12R1.71 OCCOc1ccc(CO)cc1 Amb6705839 [0,2,0,0,0,0|0,0,0]=2 7316 B12R1.71 OC\C=C\c1ccc(CO)cc1 Amb28064189 [0,2,0,0,0,0|1,0,1]=4 7317 B12R1.71 OCc1ccc(OCCF)cc1 Amb23580002 [0,2,0,0,0,0|1,0,0]=3 7318 B12R1.71 OCc1ccc(OCCF)cn1 Amb32652249 [0,2,0,0,0,0|2,0,0]=4 7319 B12R1.71 OCc1ccc(OCCF)cn1 Amb33526993 [0,2,0,0,0,0|2,0,0]=4 7320 B12R1.71 [C-]#[N+]c1ccc(CCCC)cc1 Amb3973095 [0,2,0,0,0,0|2,0,0]=4 7321 B12R1.385 BrCCCc1ccc(I)c(I)c1 Amb27813663 [0,2,0,0,0,0|2,0,0]=4 7322 B12R1.385 C#CCOc1ccc(Br)c(Cl)c1 Amb27645840 [0,2,0,0,0,0|1,0,1]=4 7323 B12R1.385 C#CCOc1ccc(Br)c(F)c1 Amb27163520 [0,2,0,0,0,0|1,0,1]=4 7324 B12R1.385 C#CCOc1ccc(C)c(C)c1 Amb18183414 [0,2,0,0,0,0|1,0,1]=4 7325 B12R1.385 C#CCOc1ccc(C)c(N)c1 Amb27187732 [0,2,0,0,0,0|1,0,1]=4 7326 B12R1.385 C#CCOc1ccc(Cl)c(C)c1 Amb18186754 [0,2,0,0,0,0|1,0,1]=4 7327 B12R1.385 C#CCOc1ccc(Cl)c(N)c1 Amb28061440 [0,2,0,0,0,0|1,0,1]=4 7328 B12R1.385 C#CCOc1ccc(F)c(Br)c1 Amb25894607 [0,2,0,0,0,0|1,0,1]=4 7329 B12R1.385 C#CCOc1ccc(F)c(F)c1 Amb18788730 [0,2,0,0,0,0|1,0,1]=4 7330 B12R1.385 C#CCOc1ccc(N)c(C)c1 Amb18961931 [0,2,0,0,0,0|1,0,1]=4 7331 B12R1.385 C=CCOc1ccc(Br)c(C)c1 Amb25883721 [0,2,0,0,0,0|1,0,1]=4 7332 B12R1.385 C=CCOc1ccc(Br)c(Cl)c1 Amb28292626 [0,2,0,0,0,0|1,0,1]=4 7333 B12R1.385 C=CCOc1ccc(Br)c(F)c1 Amb28189578 [0,2,0,0,0,0|1,0,1]=4 7334 B12R1.385 C=CCOc1ccc(C)c(C)c1 Amb26605820 [0,2,0,0,0,0|1,0,1]=4 7335 B12R1.385 C=CCOc1ccc(C)c(N)c1 Amb17138559 [0,2,0,0,0,0|1,0,1]=4 7336 B12R1.385 C=CCOc1ccc(Cl)c(C)c1 Amb25283208 [0,2,0,0,0,0|1,0,1]=4 7337 B12R1.385 C=CCOc1ccc(Cl)c(Cl)c1 Amb24361907 [0,2,0,0,0,0|1,0,1]=4 7338 B12R1.385 C=CCOc1ccc(Cl)c(N)c1 Amb17139076 [0,2,0,0,0,0|1,0,1]=4 7339 B12R1.385 C=CCOc1ccc(F)c(Br)c1 Amb25328171 [0,2,0,0,0,0|1,0,1]=4 7340 B12R1.385 C=CCOc1ccc(F)c(Cl)c1 Amb24543710 [0,2,0,0,0,0|1,0,1]=4 7341 B12R1.385 C=CCOc1ccc(I)c(C)c1 Amb27774623 [0,2,0,0,0,0|1,0,1]=4 7342 B12R1.385 C=CCOc1ccc(I)c(Cl)c1 Amb27599239 [0,2,0,0,0,0|1,0,1]=4 7343 B12R1.385 C=CCOc1ccc(N)c(C)c1 Amb17138560 [0,2,0,0,0,0|1,0,1]=4 7344 B12R1.385 C=CCOc1ccc(N)c(F)c1 Amb18991658 [0,2,0,0,0,0|1,0,1]=4 7345 B12R1.385 C=CCOc1ccc(N)c(N)c1 Amb24377079 [0,2,0,0,0,0|1,0,1]=4 7346 B12R1.385 C=CCOc1ccc(S)c(O)c1 Amb28202385 [0,2,0,0,0,0|1,0,1]=4 7347 B12R1.385 CCCCc1ccc(Br)c(Br)c1 Amb19944055 [0,2,0,0,0,0|2,0,0]=4 7348 B12R1.385 CCCCc1ccc(Br)c(N)c1 Amb28066068 [0,2,0,0,0,0|2,0,0]=4 7349 B12R1.385 CCCCc1ccc(C)c(N)c1 Amb24071080 [0,2,0,0,0,0|2,0,0]=4 7350 B12R1.385 CCCCc1ccc(Cl)c(Br)c1 Amb19944056 [0,2,0,0,0,0|2,0,0]=4 7351 B12R1.385 CCCCc1ccc(Cl)c(N)c1 Amb26490908 [0,2,0,0,0,0|2,0,0]=4 7352 B12R1.385 CCCCc1ccc(F)c(N)c1 Amb25892190 [0,2,0,0,0,0|2,0,0]=4 7353 B12R1.385 CCCCc1ccc(I)c(C)c1 Amb2726250 [0,2,0,0,0,0|2,0,0]=4 7354 B12R1.385 CCCCc1ccc(N)c(Br)c1 Amb19944049 [0,2,0,0,0,0|2,0,0]=4 7355 B12R1.385 CCCCc1ccc(N)c(C)c1 Amb2725556 [0,2,0,0,0,0|2,0,0]=4 7356 B12R1.385 CCCCc1ccc(N)c(Cl)c1 Amb27865500 [0,2,0,0,0,0|2,0,0]=4 7357 B12R1.385 CCCCc1ccc(N)c(I)c1 Amb26849329 [0,2,0,0,0,0|2,0,0]=4 7358 B12R1.385 CCCCc1ccc(N)c(N)c1 Amb18646137 [0,2,0,0,0,0|2,0,0]=4 7359 B12R1.385 CCCCc1ccc(N)c(S)c1 Amb18939301 [0,2,0,0,0,0|2,0,0]=4 7360 B12R1.385 CCCCc1ccc(O)c(C)c1 Amb24403254 [0,2,0,0,0,0|2,0,0]=4 7361 B12R1.385 CCCCc1ccc(O)c(Cl)c1 Amb26562777 [0,2,0,0,0,0|2,0,0]=4 7362 B12R1.385 CCCCc1ccc(O)c(O)c1 Amb22167996 [0,2,0,0,0,0|2,0,0]=4 7363 B12R1.385 CCCNc1ccc(Br)c(C)c1 Amb6691699 [0,2,0,0,0,0|2,0,0]=4 7364 B12R1.385 CCCNc1ccc(C)c(Br)c1 Amb17142401 [0,2,0,0,0,0|2,0,0]=4 7365 B12R1.385 CCCNc1ccc(C)c(C)c1 Amb33328942 [0,2,0,0,0,0|2,0,0]=4 7366 B12R1.385 CCCNc1ccc(C)c(C)c1 Amb4313504 [0,2,0,0,0,0|2,0,0]=4 7367 B12R1.385 CCCNc1ccc(C)c(Cl)c1 Amb33328911 [0,2,0,0,0,0|2,0,0]=4 7368 B12R1.385 CCCNc1ccc(C)c(Cl)c1 Amb6687850 [0,2,0,0,0,0|2,0,0]=4 7369 B12R1.385 CCCNc1ccc(C)c(O)c1 Amb28321168 [0,2,0,0,0,0|2,0,0]=4 7370 B12R1.385 CCCNc1ccc(Cl)c(C)c1 Amb27149944 [0,2,0,0,0,0|2,0,0]=4 7371 B12R1.385 CCCNc1ccc(Cl)c(C)c1 Amb33328912 [0,2,0,0,0,0|2,0,0]=4 7372 B12R1.385 CCCNc1ccc(Cl)c(Cl)c1 Amb30584829 [0,2,0,0,0,0|2,0,0]=4 7373 B12R1.385 CCCNc1ccc(Cl)c(Cl)c1 Amb4313514 [0,2,0,0,0,0|2,0,0]=4 7374 B12R1.385 CCCNc1ccc(Cl)c(O)c1 Amb27808716 [0,2,0,0,0,0|2,0,0]=4 7375 B12R1.385 CCCNc1ccc(F)c(Cl)c1 Amb7772586 [0,2,0,0,0,0|2,0,0]=4 7376 B12R1.385 CCCNc1ccc(F)c(F)c1 Amb6694998 [0,2,0,0,0,0|2,0,0]=4 7377 B12R1.385 CCCNc1ccc(N)c(N)c1 Amb27179602 [0,2,0,0,0,0|2,0,0]=4 7378 B12R1.385 CCCNc1ccc(O)c(Cl)c1 Amb27863348 [0,2,0,0,0,0|2,0,0]=4 7379 B12R1.385 CCCNc1ccc(O)c(F)c1 Amb28047172 [0,2,0,0,0,0|2,0,0]=4 7380 B12R1.385 CCCOc1cc(C)c(Br)cn1 Amb24525541 [0,2,0,0,0,0|2,0,0]=4 7381 B12R1.385 CCCOc1cc(C)c(N)cn1 Amb27460846 [0,2,0,0,0,0|2,0,0]=4 7382 B12R1.385 CCCOc1cc(N)c(Br)cn1 Amb24320371 [0,2,0,0,0,0|2,0,0]=4 7383 B12R1.385 CCCOc1cc(N)c(C)cn1 Amb27219667 [0,2,0,0,0,0|2,0,0]=4 7384 B12R1.385 CCCOc1ccc(Br)c(C)c1 Amb22001434 [0,2,0,0,0,0|1,0,0]=3 7385 B12R1.385 CCCOc1ccc(Br)c(C)n1 Amb19959831 [0,2,0,0,0,0|2,0,0]=4 7386 B12R1.385 CCCOc1ccc(Br)c(Cl)c1 Amb27615440 [0,2,0,0,0,0|1,0,0]=3 7387 B12R1.385 CCCOc1ccc(Br)c(F)c1 Amb22490083 [0,2,0,0,0,0|1,0,0]=3 7388 B12R1.385 CCCOc1ccc(Br)c(F)n1 Amb28142463 [0,2,0,0,0,0|2,0,0]=4 7389 B12R1.385 CCCOc1ccc(Br)c(N)c1 Amb23555865 [0,2,0,0,0,0|1,0,0]=3 7390 B12R1.385 CCCOc1ccc(C)c(Br)c1 Amb25890676 [0,2,0,0,0,0|1,0,0]=3 7391 B12R1.385 CCCOc1ccc(C)c(N)c1 Amb17138590 [0,2,0,0,0,0|1,0,0]=3 7392 B12R1.385 CCCOc1ccc(Cl)c(Br)c1 Amb27815619 [0,2,0,0,0,0|1,0,0]=3 7393 B12R1.385 CCCOc1ccc(Cl)c(C)c1 Amb27858142 [0,2,0,0,0,0|1,0,0]=3 7394 B12R1.385 CCCOc1ccc(Cl)c(N)c1 Amb17139123 [0,2,0,0,0,0|1,0,0]=3 7395 B12R1.385 CCCOc1ccc(F)c(Cl)c1 Amb27650105 [0,2,0,0,0,0|1,0,0]=3 7396 B12R1.385 CCCOc1ccc(F)c(F)c1 Amb25816178 [0,2,0,0,0,0|1,0,0]=3 7397 B12R1.385 CCCOc1ccc(F)c(O)c1 Amb28344053 [0,2,0,0,0,0|1,0,0]=3 7398 B12R1.385 CCCOc1ccc(I)c(C)c1 Amb27241094 [0,2,0,0,0,0|1,0,0]=3 7399 B12R1.385 CCCOc1ccc(N)c(Br)c1 Amb23556483 [0,2,0,0,0,0|1,0,0]=3 7400 B12R1.385 CCCOc1ccc(N)c(C)c1 Amb1134107 [0,2,0,0,0,0|1,0,0]=3 7401 B12R1.385 CCCOc1ccc(N)c(C)n1 Amb26623941 [0,2,0,0,0,0|2,0,0]=4 7402 B12R1.385 CCCOc1ccc(N)c(Cl)c1 Amb18986395 [0,2,0,0,0,0|1,0,0]=3 7403 B12R1.385 CCCOc1ccc(N)c(N)c1 Amb8393814 [0,2,0,0,0,0|1,0,0]=3 7404 B12R1.385 CCCOc1ccc(N)c(N)n1 Amb25694490 [0,2,0,0,0,0|2,0,0]=4 7405 B12R1.385 CCCOc1ccc(N)c(S)c1 Amb18939289 [0,2,0,0,0,0|1,0,0]=3 7406 B12R1.385 CCCOc1ccc(O)c(F)n1 Amb28142445 [0,2,0,0,0,0|2,0,0]=4 7407 B12R1.385 CCCOc1ccc(O)c(N)c1 Amb18056091 [0,2,0,0,0,0|1,0,0]=3 7408 B12R1.385 CCCOc1ccc(S)c(C)c1 Amb25861806 [0,2,0,0,0,0|1,0,0]=3 7409 B12R1.385 CCCOc1ccc(S)c(N)c1 Amb18939266 [0,2,0,0,0,0|1,0,0]=3 7410 B12R1.385 CCCSc1ccc(C)c(C)c1 Amb27833324 [0,2,0,0,0,0|1,1,0]=4 7411 B12R1.385 CCCSc1ccc(N)c(N)c1 Amb18648679 [0,2,0,0,0,0|1,1,0]=4 7412 B12R1.385 CCCSc1ccc(O)c(O)c1 Amb27972958 [0,2,0,0,0,0|1,1,0]=4 7413 B12R1.385 CN1N=C(OCCO)C=CC1=O Amb27662169 [0,2,0,0,0,0|2,0,0]=4 7414 B12R1.385 COCOc1ccc(Br)c(C)c1 Amb24493202 [0,2,0,0,0,0|2,0,0]=4 7415 B12R1.385 COCOc1ccc(Br)c(Cl)c1 Amb26949722 [0,2,0,0,0,0|2,0,0]=4 7416 B12R1.385 COCOc1ccc(Br)c(F)c1 Amb26398777 [0,2,0,0,0,0|2,0,0]=4 7417 B12R1.385 COCOc1ccc(C)c(Br)c1 Amb25272851 [0,2,0,0,0,0|2,0,0]=4 7418 B12R1.385 COCOc1ccc(C)c(C)c1 Amb28370295 [0,2,0,0,0,0|2,0,0]=4 7419 B12R1.385 COCOc1ccc(C)c(F)c1 Amb26585072 [0,2,0,0,0,0|2,0,0]=4 7420 B12R1.385 COCOc1ccc(C)c(N)c1 Amb27454157 [0,2,0,0,0,0|2,0,0]=4 7421 B12R1.385 COCOc1ccc(Cl)c(C)c1 Amb25697480 [0,2,0,0,0,0|2,0,0]=4 7422 B12R1.385 COCOc1ccc(Cl)c(F)c1 Amb27464912 [0,2,0,0,0,0|2,0,0]=4 7423 B12R1.385 COCOc1ccc(F)c(F)c1 Amb22641749 [0,2,0,0,0,0|2,0,0]=4 7424 B12R1.385 COCOc1ccc(F)c(O)c1 Amb27236309 [0,2,0,0,0,0|2,0,0]=4 7425 B12R1.385 COCOc1ccc(I)c(Br)c1 Amb27487200 [0,2,0,0,0,0|2,0,0]=4 7426 B12R1.385 COCOc1ccc(N)c(S)c1 Amb27265924 [0,2,0,0,0,0|2,0,0]=4 7427 B12R1.385 CSCOc1ccc(Cl)c(Cl)c1 Amb28200636 [0,2,0,0,0,0|2,0,0]=4 7428 B12R1.385 Cc1cc(CCCBr)ccc1Br Amb28286752 [0,2,0,0,0,0|2,0,0]=4 7429 B12R1.385 Cc1cc(CCCBr)ccc1Cl Amb26965876 [0,2,0,0,0,0|2,0,0]=4 7430 B12R1.385 Cc1cc(CCCBr)ccc1F Amb26340405 [0,2,0,0,0,0|2,0,0]=4 7431 B12R1.385 Cc1cc(CCCBr)ccc1I Amb28133816 [0,2,0,0,0,0|2,0,0]=4 7432 B12R1.385 Cc1cc(CCCBr)ccc1N Amb28323502 [0,2,0,0,0,0|2,0,0]=4 7433 B12R1.385 Cc1cc(CCCBr)ccc1S Amb26602406 [0,2,0,0,0,0|2,0,0]=4 7434 B12R1.385 Cc1cc(CCCCl)ccc1Cl Amb27445697 [0,2,0,0,0,0|2,0,0]=4 7435 B12R1.385 Cc1cc(CCCCl)ccc1F Amb25841123 [0,2,0,0,0,0|2,0,0]=4 7436 B12R1.385 Cc1cc(CCCCl)ccc1I Amb24605295 [0,2,0,0,0,0|2,0,0]=4 7437 B12R1.385 Cc1cc(CCCCl)ccc1N Amb27616078 [0,2,0,0,0,0|2,0,0]=4 7438 B12R1.385 Cc1cc(CCCCl)ccc1O Amb24637062 [0,2,0,0,0,0|2,0,0]=4 7439 B12R1.385 Cc1cc(CCCCl)ccc1S Amb25217669 [0,2,0,0,0,0|2,0,0]=4 7440 B12R1.385 Cc1cc(CCCN)ccc1Br Amb17204539 [0,2,0,0,0,0|2,0,0]=4 7441 B12R1.385 Cc1cc(CCCN)ccc1Cl Amb18554358 [0,2,0,0,0,0|2,0,0]=4 7442 B12R1.385 Cc1cc(CCCN)ccc1F Amb17232643 [0,2,0,0,0,0|2,0,0]=4 7443 B12R1.385 Cc1cc(CCCN)ccc1O Amb26038396 [0,2,0,0,0,0|2,0,0]=4 7444 B12R1.385 Cc1cc(CCCO)ccc1Br Amb33332633 [0,2,0,0,0,0|1,0,0]=3 7445 B12R1.385 Cc1cc(CCCO)ccc1Cl Amb24465130 [0,2,0,0,0,0|1,0,0]=3 7446 B12R1.385 Cc1cc(CCCO)ccc1F Amb18862775 [0,2,0,0,0,0|1,0,0]=3 7447 B12R1.385 Cc1cc(CCCO)ccc1O Amb24624666 [0,2,0,0,0,0|1,0,0]=3 7448 B12R1.385 Cc1cc(CCCO)cnc1Cl Amb33058927 [0,2,0,0,0,0|2,0,0]=4 7449 B12R1.385 Cc1cc(CCCS)ccc1Br Amb33332709 [0,2,0,0,0,0|1,1,0]=4 7450 B12R1.385 Cc1cc(CCCS)ccc1F Amb27144406 [0,2,0,0,0,0|1,1,0]=4 7451 B12R1.385 Cc1cc(NCCCl)ccc1Br Amb17351917 [0,2,0,0,0,0|2,0,0]=4 7452 B12R1.385 Cc1cc(NCCN)ccc1Br Amb17091077 [0,2,0,0,0,0|2,0,0]=4 7453 B12R1.385 Cc1cc(NCCN)ccc1O Amb27476632 [0,2,0,0,0,0|2,0,0]=4 7454 B12R1.385 Cc1cc(NCCO)ccc1Br Amb6709985 [0,2,0,0,0,0|1,0,0]=3 7455 B12R1.385 Cc1cc(NCCO)ccc1F Amb18301456 [0,2,0,0,0,0|1,0,0]=3 7456 B12R1.385 Cc1cc(NCCO)ncc1N Amb17213742 [0,2,0,0,0,0|2,0,0]=4 7457 B12R1.385 Cc1cc(OCC#N)ccc1Br Amb5780935 [0,2,0,0,0,0|1,0,1]=4 7458 B12R1.385 Cc1cc(OCC#N)ccc1Cl Amb5638541 [0,2,0,0,0,0|1,0,1]=4 7459 B12R1.385 Cc1cc(OCC=O)ccc1Br Amb17099969 [0,2,0,0,0,0|0,0,2]=4 7460 B12R1.385 Cc1cc(OCC=O)ccc1Cl Amb5731848 [0,2,0,0,0,0|0,0,2]=4 7461 B12R1.385 Cc1cc(OCC=O)ccc1F Amb27825819 [0,2,0,0,0,0|0,0,2]=4 7462 B12R1.385 Cc1cc(OCCBr)ccc1Br Amb24749067 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.385 Cc1cc(OCCBr)ccc1Cl Amb6667877 [0,2,0,0,0,0|1,0,0]=3 7464 B12R1.385 Cc1cc(OCCCl)ccc1Cl Amb9209788 [0,2,0,0,0,0|1,0,0]=3 7465 B12R1.385 Cc1cc(OCCF)ccc1Br Amb25136415 [0,2,0,0,0,0|1,0,0]=3 7466 B12R1.385 Cc1cc(OCCF)ccc1N Amb23579996 [0,2,0,0,0,0|1,0,0]=3 7467 B12R1.385 Cc1cc(OCCN)ccc1Br Amb5781252 [0,2,0,0,0,0|1,0,0]=3 7468 B12R1.385 Cc1cc(OCCN)ccc1Cl Amb1090468 [0,2,0,0,0,0|1,0,0]=3 7469 B12R1.385 Cc1cc(OCCN)ccc1Cl Amb6761740 [0,2,0,0,0,0|1,0,0]=3 7470 B12R1.385 Cc1cc(OCCN)ccc1F Amb18893580 [0,2,0,0,0,0|1,0,0]=3 7471 B12R1.385 Cc1cc(OCCN)ccc1N Amb18908681 [0,2,0,0,0,0|1,0,0]=3 7472 B12R1.385 Cc1cc(OCCN)cnc1Cl Amb33058953 [0,2,0,0,0,0|2,0,0]=4 7473 B12R1.385 Cc1cc(OCCN)ncc1Br Amb27669666 [0,2,0,0,0,0|2,0,0]=4 7474 B12R1.385 Cc1cc(OCCO)ccc1Cl Amb2209357 [0,2,0,0,0,0|0,0,0]=2 7475 B12R1.385 Cc1cc(OCCO)ccc1I Amb27255051 [0,2,0,0,0,0|0,0,0]=2 7476 B12R1.385 Cc1cc(OCCO)ccc1N Amb6702380 [0,2,0,0,0,0|0,0,0]=2 7477 B12R1.385 Cc1cc(OCCO)ncc1N Amb24668511 [0,2,0,0,0,0|1,0,0]=3 7478 B12R1.385 Cc1cc(OCCS)ccc1Cl Amb17237591 [0,2,0,0,0,0|0,1,0]=3 7479 B12R1.385 Cc1cc(SCCN)ccc1Cl Amb17083044 [0,2,0,0,0,0|1,1,0]=4 7480 B12R1.385 Cc1cc(SCCN)ccc1F Amb17083028 [0,2,0,0,0,0|1,1,0]=4 7481 B12R1.385 Cc1cc(SCCO)ccc1Br Amb28079082 [0,2,0,0,0,0|0,1,0]=3 7482 B12R1.385 Cc1cc(SCCO)ccc1N Amb33532252 [0,2,0,0,0,0|0,1,0]=3 7483 B12R1.385 Cc1cc(SCCO)ncc1Br Amb28043634 [0,2,0,0,0,0|1,1,0]=4 7484 B12R1.385 Cc1cc(SCCO)ncc1N Amb28457922 [0,2,0,0,0,0|1,1,0]=4 7485 B12R1.385 Cc1cc(\C=C\CO)ccc1Br Amb25133361 [0,2,0,0,0,0|1,0,1]=4 7486 B12R1.385 Cc1cc(\C=C\CO)ccc1F Amb33449467 [0,2,0,0,0,0|1,0,1]=4 7487 B12R1.385 Cc1ccc(CCCBr)cc1Br Amb24339560 [0,2,0,0,0,0|2,0,0]=4 7488 B12R1.385 Cc1ccc(CCCBr)cc1C Amb24488677 [0,2,0,0,0,0|2,0,0]=4 7489 B12R1.385 Cc1ccc(CCCBr)cc1Cl Amb25130714 [0,2,0,0,0,0|2,0,0]=4 7490 B12R1.385 Cc1ccc(CCCBr)cc1F Amb25870410 [0,2,0,0,0,0|2,0,0]=4 7491 B12R1.385 Cc1ccc(CCCBr)cc1I Amb25207303 [0,2,0,0,0,0|2,0,0]=4 7492 B12R1.385 Cc1ccc(CCCBr)cc1N Amb26419392 [0,2,0,0,0,0|2,0,0]=4 7493 B12R1.385 Cc1ccc(CCCBr)cc1O Amb27793911 [0,2,0,0,0,0|2,0,0]=4 7494 B12R1.385 Cc1ccc(CCCCl)cc1Br Amb26398510 [0,2,0,0,0,0|2,0,0]=4 7495 B12R1.385 Cc1ccc(CCCCl)cc1C Amb18325208 [0,2,0,0,0,0|2,0,0]=4 7496 B12R1.385 Cc1ccc(CCCCl)cc1Cl Amb24720204 [0,2,0,0,0,0|2,0,0]=4 7497 B12R1.385 Cc1ccc(CCCCl)cc1F Amb25152290 [0,2,0,0,0,0|2,0,0]=4 7498 B12R1.385 Cc1ccc(CCCCl)cc1I Amb27439344 [0,2,0,0,0,0|2,0,0]=4 7499 B12R1.385 Cc1ccc(CCCCl)cc1N Amb26424124 [0,2,0,0,0,0|2,0,0]=4 7500 B12R1.385 Cc1ccc(CCCCl)cc1O Amb26576220 [0,2,0,0,0,0|2,0,0]=4 7501 B12R1.385 Cc1ccc(CCCCl)cc1S Amb26004212 [0,2,0,0,0,0|2,0,0]=4 7502 B12R1.385 Cc1ccc(CCCN)cc1Br Amb17204536 [0,2,0,0,0,0|2,0,0]=4 7503 B12R1.385 Cc1ccc(CCCN)cc1C Amb8396299 [0,2,0,0,0,0|2,0,0]=4 7504 B12R1.385 Cc1ccc(CCCN)cc1Cl Amb17204338 [0,2,0,0,0,0|2,0,0]=4 7505 B12R1.385 Cc1ccc(CCCN)cc1F Amb22395115 [0,2,0,0,0,0|2,0,0]=4 7506 B12R1.385 Cc1ccc(CCCN)cc1O Amb25159897 [0,2,0,0,0,0|2,0,0]=4 7507 B12R1.385 Cc1ccc(CCCO)cc1Br Amb24664258 [0,2,0,0,0,0|1,0,0]=3 7508 B12R1.385 Cc1ccc(CCCO)cc1C Amb17605788 [0,2,0,0,0,0|1,0,0]=3 7509 B12R1.385 Cc1ccc(CCCO)cc1Cl Amb25899190 [0,2,0,0,0,0|1,0,0]=3 7510 B12R1.385 Cc1ccc(CCCO)cc1F Amb25265576 [0,2,0,0,0,0|1,0,0]=3 7511 B12R1.385 Cc1ccc(CCCO)cc1O Amb33427567 [0,2,0,0,0,0|1,0,0]=3 7512 B12R1.385 Cc1ccc(CCCS)cc1Br Amb33334567 [0,2,0,0,0,0|1,1,0]=4 7513 B12R1.385 Cc1ccc(CCCS)cc1C Amb25198296 [0,2,0,0,0,0|1,1,0]=4 7514 B12R1.385 Cc1ccc(CCCS)cc1F Amb33427334 [0,2,0,0,0,0|1,1,0]=4 7515 B12R1.385 Cc1ccc(CCCS)cc1O Amb33427535 [0,2,0,0,0,0|1,1,0]=4 7516 B12R1.385 Cc1ccc(NCCCl)cc1Br Amb17351914 [0,2,0,0,0,0|2,0,0]=4 7517 B12R1.385 Cc1ccc(NCCCl)cc1C Amb17335663 [0,2,0,0,0,0|2,0,0]=4 7518 B12R1.385 Cc1ccc(NCCCl)cc1Cl Amb17338054 [0,2,0,0,0,0|2,0,0]=4 7519 B12R1.385 Cc1ccc(NCCN)cc1Br Amb17091063 [0,2,0,0,0,0|2,0,0]=4 7520 B12R1.385 Cc1ccc(NCCN)cc1C Amb17091052 [0,2,0,0,0,0|2,0,0]=4 7521 B12R1.385 Cc1ccc(NCCN)cc1Cl Amb17091060 [0,2,0,0,0,0|2,0,0]=4 7522 B12R1.385 Cc1ccc(NCCO)cc1Br Amb17307023 [0,2,0,0,0,0|1,0,0]=3 7523 B12R1.385 Cc1ccc(NCCO)cc1C Amb6711821 [0,2,0,0,0,0|1,0,0]=3 7524 B12R1.385 Cc1ccc(NCCO)cc1Cl Amb6707927 [0,2,0,0,0,0|1,0,0]=3 7525 B12R1.385 Cc1ccc(NCCO)cc1O Amb8393230 [0,2,0,0,0,0|1,0,0]=3 7526 B12R1.385 Cc1ccc(OCC#N)cc1Br Amb28199666 [0,2,0,0,0,0|1,0,1]=4 7527 B12R1.385 Cc1ccc(OCC#N)cc1C Amb5780867 [0,2,0,0,0,0|1,0,1]=4 7528 B12R1.385 Cc1ccc(OCC=O)cc1C Amb5731823 [0,2,0,0,0,0|0,0,2]=4 7529 B12R1.385 Cc1ccc(OCC=O)cc1F Amb27465764 [0,2,0,0,0,0|0,0,2]=4 7530 B12R1.385 Cc1ccc(OCCBr)cc1Br Amb28199664 [0,2,0,0,0,0|1,0,0]=3 7531 B12R1.385 Cc1ccc(OCCBr)cc1C Amb840491 [0,2,0,0,0,0|1,0,0]=3 7532 B12R1.385 Cc1ccc(OCCCl)cc1C Amb8828432 [0,2,0,0,0,0|1,0,0]=3 7533 B12R1.385 Cc1ccc(OCCF)cc1C Amb27416791 [0,2,0,0,0,0|1,0,0]=3 7534 B12R1.385 Cc1ccc(OCCF)cc1N Amb25188189 [0,2,0,0,0,0|1,0,0]=3 7535 B12R1.385 Cc1ccc(OCCN)cc1Br Amb25896635 [0,2,0,0,0,0|1,0,0]=3 7536 B12R1.385 Cc1ccc(OCCN)cc1C Amb6355960 [0,2,0,0,0,0|1,0,0]=3 7537 B12R1.385 Cc1ccc(OCCN)cc1Cl Amb23441775 [0,2,0,0,0,0|1,0,0]=3 7538 B12R1.385 Cc1ccc(OCCN)cc1F Amb24341985 [0,2,0,0,0,0|1,0,0]=3 7539 B12R1.385 Cc1ccc(OCCN)cc1O Amb33427548 [0,2,0,0,0,0|1,0,0]=3 7540 B12R1.385 Cc1ccc(OCCO)cc1Br Amb24738236 [0,2,0,0,0,0|0,0,0]=2 7541 B12R1.385 Cc1ccc(OCCO)cc1C Amb9370667 [0,2,0,0,0,0|0,0,0]=2 7542 B12R1.385 Cc1ccc(OCCS)cc1C Amb2794985 [0,2,0,0,0,0|0,1,0]=3 7543 B12R1.385 Cc1ccc(SCCBr)cc1C Amb6278355 [0,2,0,0,0,0|1,1,0]=4 7544 B12R1.385 Cc1ccc(SCCN)cc1C Amb1105388 [0,2,0,0,0,0|1,1,0]=4 7545 B12R1.385 Cc1ccc(SCCN)cc1C Amb30711 [0,2,0,0,0,0|1,1,0]=4 7546 B12R1.385 Cc1ccc(SCCO)cc1Br Amb27481076 [0,2,0,0,0,0|0,1,0]=3 7547 B12R1.385 Cc1ccc(SCCO)cc1C Amb2687600 [0,2,0,0,0,0|0,1,0]=3 7548 B12R1.385 Cc1ccc(\C=C\CO)cc1Br Amb25331292 [0,2,0,0,0,0|1,0,1]=4 7549 B12R1.385 Cc1ccc(\C=C\CO)cc1C Amb27494401 [0,2,0,0,0,0|1,0,1]=4 7550 B12R1.385 Cc1ccc(\C=C\CO)cc1Cl Amb26877487 [0,2,0,0,0,0|1,0,1]=4 7551 B12R1.385 Cc1ccc(\C=C\CO)cc1F Amb28126070 [0,2,0,0,0,0|1,0,1]=4 7552 B12R1.385 Cc1ccc(\C=C\CO)cc1O Amb33310493 [0,2,0,0,0,0|1,0,1]=4 7553 B12R1.385 Cc1cnc(NCCO)cc1N Amb27389400 [0,2,0,0,0,0|2,0,0]=4 7554 B12R1.385 Cc1cnc(OCCO)cc1N Amb26022002 [0,2,0,0,0,0|1,0,0]=3 7555 B12R1.385 Cc1nc(NCCO)ccc1Br Amb26883715 [0,2,0,0,0,0|2,0,0]=4 7556 B12R1.385 Cc1nc(OCCN)ccc1Br Amb27450622 [0,2,0,0,0,0|2,0,0]=4 7557 B12R1.385 Cc1nc(OCCO)ccc1N Amb25793927 [0,2,0,0,0,0|1,0,0]=3 7558 B12R1.385 ClCCCc1ccc(Br)c(Br)c1 Amb27782042 [0,2,0,0,0,0|2,0,0]=4 7559 B12R1.385 ClCCCc1ccc(Cl)c(Cl)c1 Amb17477749 [0,2,0,0,0,0|2,0,0]=4 7560 B12R1.385 ClCCCc1ccc(I)c(Br)c1 Amb26575206 [0,2,0,0,0,0|2,0,0]=4 7561 B12R1.385 ClCCNc1ccc(Cl)c(Cl)c1 Amb17343162 [0,2,0,0,0,0|2,0,0]=4 7562 B12R1.385 ClCCOc1ccc(Cl)c(Cl)c1 Amb17247124 [0,2,0,0,0,0|1,0,0]=3 7563 B12R1.385 ClCCSc1ccc(Cl)c(Cl)c1 Amb27414055 [0,2,0,0,0,0|1,1,0]=4 7564 B12R1.385 Clc1cc(CCCBr)ccc1Br Amb27192634 [0,2,0,0,0,0|2,0,0]=4 7565 B12R1.385 Clc1ccc(CCCBr)cc1Cl Amb26461978 [0,2,0,0,0,0|2,0,0]=4 7566 B12R1.385 Clc1ccc(OCCBr)cc1Cl Amb17274514 [0,2,0,0,0,0|1,0,0]=3 7567 B12R1.385 Clc1ccc(SCCBr)cc1Cl Amb27476759 [0,2,0,0,0,0|1,1,0]=4 7568 B12R1.385 FCCNc1ccc(Br)c(I)c1 Amb28245116 [0,2,0,0,0,0|2,0,0]=4 7569 B12R1.385 FCCNc1ccc(I)c(Br)c1 Amb28423188 [0,2,0,0,0,0|2,0,0]=4 7570 B12R1.385 FCCOc1ccc(Br)c(F)c1 Amb26875101 [0,2,0,0,0,0|1,0,0]=3 7571 B12R1.385 FCCOc1ccc(Cl)c(Cl)c1 Amb27775324 [0,2,0,0,0,0|1,0,0]=3 7572 B12R1.385 FCCOc1ccc(Cl)c(F)c1 Amb28366659 [0,2,0,0,0,0|1,0,0]=3 7573 B12R1.385 FCCSc1ccc(Cl)c(Cl)c1 Amb27980107 [0,2,0,0,0,0|1,1,0]=4 7574 B12R1.385 Fc1cc(CCCBr)ccc1Br Amb27967653 [0,2,0,0,0,0|2,0,0]=4 7575 B12R1.385 Fc1cc(CCCBr)ccc1Cl Amb25046816 [0,2,0,0,0,0|2,0,0]=4 7576 B12R1.385 Fc1cc(CCCBr)ccc1I Amb28134075 [0,2,0,0,0,0|2,0,0]=4 7577 B12R1.385 Fc1cc(CCCBr)ccc1S Amb27204221 [0,2,0,0,0,0|2,0,0]=4 7578 B12R1.385 Fc1cc(CCCCl)ccc1Br Amb25351929 [0,2,0,0,0,0|2,0,0]=4 7579 B12R1.385 Fc1cc(CCCCl)ccc1Cl Amb24468477 [0,2,0,0,0,0|2,0,0]=4 7580 B12R1.385 Fc1cc(CCCCl)ccc1S Amb27963895 [0,2,0,0,0,0|2,0,0]=4 7581 B12R1.385 Fc1cc(CCCS)ccc1Br Amb33006238 [0,2,0,0,0,0|1,1,0]=4 7582 B12R1.385 Fc1cc(OCCBr)ccc1Cl Amb25244280 [0,2,0,0,0,0|1,0,0]=3 7583 B12R1.385 Fc1cc(OCCBr)cnc1Cl Amb32988379 [0,2,0,0,0,0|2,0,0]=4 7584 B12R1.385 Fc1cc(OCCS)ccc1Br Amb27203441 [0,2,0,0,0,0|0,1,0]=3 7585 B12R1.385 Fc1cc(OCCS)ccc1Cl Amb27413754 [0,2,0,0,0,0|0,1,0]=3 7586 B12R1.385 Fc1ccc(CCCBr)cc1Br Amb25699797 [0,2,0,0,0,0|2,0,0]=4 7587 B12R1.385 Fc1ccc(CCCBr)cc1Cl Amb24638891 [0,2,0,0,0,0|2,0,0]=4 7588 B12R1.385 Fc1ccc(CCCBr)cc1F Amb26061388 [0,2,0,0,0,0|2,0,0]=4 7589 B12R1.385 Fc1ccc(CCCCl)cc1Br Amb24389703 [0,2,0,0,0,0|2,0,0]=4 7590 B12R1.385 Fc1ccc(CCCCl)cc1Cl Amb27200303 [0,2,0,0,0,0|2,0,0]=4 7591 B12R1.385 Fc1ccc(CCCCl)cc1F Amb28341727 [0,2,0,0,0,0|2,0,0]=4 7592 B12R1.385 Fc1ccc(CCCS)cc1Br Amb33388230 [0,2,0,0,0,0|1,1,0]=4 7593 B12R1.385 Fc1ccc(CCCS)cc1Cl Amb28197743 [0,2,0,0,0,0|1,1,0]=4 7594 B12R1.385 Fc1ccc(CCCS)cc1F Amb26605763 [0,2,0,0,0,0|1,1,0]=4 7595 B12R1.385 Fc1ccc(NCCCl)cc1Cl Amb17338959 [0,2,0,0,0,0|2,0,0]=4 7596 B12R1.385 Fc1ccc(OCCBr)cc1Br Amb27251629 [0,2,0,0,0,0|1,0,0]=3 7597 B12R1.385 Fc1ccc(OCCBr)cc1Cl Amb28319432 [0,2,0,0,0,0|1,0,0]=3 7598 B12R1.385 Fc1ccc(OCCBr)cc1F Amb9417120 [0,2,0,0,0,0|1,0,0]=3 7599 B12R1.385 Fc1ccc(OCCCl)cc1F Amb9417117 [0,2,0,0,0,0|1,0,0]=3 7600 B12R1.385 Fc1ccc(OCCS)cc1F Amb17234882 [0,2,0,0,0,0|0,1,0]=3 7601 B12R1.385 Fc1ccc(SCCBr)cc1F Amb8857941 [0,2,0,0,0,0|1,1,0]=4 7602 B12R1.385 Fc1ccc(SCCCl)cc1F Amb8995013 [0,2,0,0,0,0|1,1,0]=4 7603 B12R1.385 N#CCOc1ccc(Br)c(F)c1 Amb24700032 [0,2,0,0,0,0|1,0,1]=4 7604 B12R1.385 N#CCOc1ccc(Cl)c(Cl)c1 Amb5780905 [0,2,0,0,0,0|1,0,1]=4 7605 B12R1.385 N#CCOc1ccc(Cl)c(F)c1 Amb33536164 [0,2,0,0,0,0|1,0,1]=4 7606 B12R1.385 N#CCOc1ccc(Cl)c(N)c1 Amb27763207 [0,2,0,0,0,0|1,0,1]=4 7607 B12R1.385 N#CCOc1ccc(F)c(Cl)c1 Amb23116906 [0,2,0,0,0,0|1,0,1]=4 7608 B12R1.385 N#CCOc1ccc(I)c(Cl)c1 Amb28351020 [0,2,0,0,0,0|1,0,1]=4 7609 B12R1.385 NC1=CN(CCCO)C=CC1=O Amb25141259 [0,2,0,0,0,0|2,0,0]=4 7610 B12R1.385 NCCCc1ccc(Br)c(Cl)c1 Amb25127779 [0,2,0,0,0,0|2,0,0]=4 7611 B12R1.385 NCCCc1ccc(Br)c(F)c1 Amb27262094 [0,2,0,0,0,0|2,0,0]=4 7612 B12R1.385 NCCCc1ccc(Br)c(O)c1 Amb26874149 [0,2,0,0,0,0|2,0,0]=4 7613 B12R1.385 NCCCc1ccc(Cl)c(Br)c1 Amb25331909 [0,2,0,0,0,0|2,0,0]=4 7614 B12R1.385 NCCCc1ccc(Cl)c(Cl)c1 Amb9304912 [0,2,0,0,0,0|2,0,0]=4 7615 B12R1.385 NCCCc1ccc(Cl)c(F)c1 Amb18821280 [0,2,0,0,0,0|2,0,0]=4 7616 B12R1.385 NCCCc1ccc(Cl)c(N)c1 Amb17477697 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.385 NCCCc1ccc(Cl)c(O)c1 Amb28397613 [0,2,0,0,0,0|2,0,0]=4 7618 B12R1.385 NCCCc1ccc(F)c(Br)c1 Amb9304909 [0,2,0,0,0,0|2,0,0]=4 7619 B12R1.385 NCCCc1ccc(F)c(Cl)c1 Amb17204345 [0,2,0,0,0,0|2,0,0]=4 7620 B12R1.385 NCCCc1ccc(F)c(F)c1 Amb17204314 [0,2,0,0,0,0|2,0,0]=4 7621 B12R1.385 NCCCc1ccc(F)c(F)c1 Amb28988589 [0,2,0,0,0,0|2,0,0]=4 7622 B12R1.385 NCCCc1ccc(F)c(N)c1 Amb27958751 [0,2,0,0,0,0|2,0,0]=4 7623 B12R1.385 NCCCc1ccc(F)c(O)c1 Amb26639467 [0,2,0,0,0,0|2,0,0]=4 7624 B12R1.385 NCCCc1ccc(O)c(Br)c1 Amb24483621 [0,2,0,0,0,0|2,0,0]=4 7625 B12R1.385 NCCCc1ccc(O)c(Cl)c1 Amb17509068 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.385 NCCCc1ccc(O)c(F)c1 Amb25960744 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.385 NCCCc1ccc(O)c(N)c1 Amb17477692 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.385 NCCCc1ccc(O)c(O)c1 Amb18827195 [0,2,0,0,0,0|2,0,0]=4 7629 B12R1.385 NCCCc1ccc(O)c(O)c1 Amb34913303 [0,2,0,0,0,0|2,0,0]=4 7630 B12R1.385 NCCNc1ccc(Cl)c(Cl)c1 Amb17091080 [0,2,0,0,0,0|2,0,0]=4 7631 B12R1.385 NCCNc1ccc(Cl)c(O)c1 Amb28119003 [0,2,0,0,0,0|2,0,0]=4 7632 B12R1.385 NCCNc1ccc(F)c(Cl)c1 Amb17057760 [0,2,0,0,0,0|2,0,0]=4 7633 B12R1.385 NCCNc1ccc(F)c(F)c1 Amb17057762 [0,2,0,0,0,0|2,0,0]=4 7634 B12R1.385 NCCNc1ccc(O)c(O)c1 Amb28140786 [0,2,0,0,0,0|2,0,0]=4 7635 B12R1.385 NCCOc1ccc(Br)c(Cl)c1 Amb27147463 [0,2,0,0,0,0|1,0,0]=3 7636 B12R1.385 NCCOc1ccc(Br)c(F)c1 Amb28064494 [0,2,0,0,0,0|1,0,0]=3 7637 B12R1.385 NCCOc1ccc(Cl)c(Br)c1 Amb25251177 [0,2,0,0,0,0|1,0,0]=3 7638 B12R1.385 NCCOc1ccc(Cl)c(Cl)c1 Amb21959595 [0,2,0,0,0,0|1,0,0]=3 7639 B12R1.385 NCCOc1ccc(Cl)c(Cl)c1 Amb5781221 [0,2,0,0,0,0|1,0,0]=3 7640 B12R1.385 NCCOc1ccc(Cl)c(F)c1 Amb25327059 [0,2,0,0,0,0|1,0,0]=3 7641 B12R1.385 NCCOc1ccc(Cl)c(F)c1 Amb28653082 [0,2,0,0,0,0|1,0,0]=3 7642 B12R1.385 NCCOc1ccc(F)c(Br)c1 Amb24385803 [0,2,0,0,0,0|1,0,0]=3 7643 B12R1.385 NCCOc1ccc(F)c(Cl)c1 Amb2198114 [0,2,0,0,0,0|1,0,0]=3 7644 B12R1.385 NCCOc1ccc(F)c(Cl)c1 Amb998025 [0,2,0,0,0,0|1,0,0]=3 7645 B12R1.385 NCCOc1ccc(F)c(F)c1 Amb19345444 [0,2,0,0,0,0|1,0,0]=3 7646 B12R1.385 NCCOc1ccc(F)c(F)c1 Amb9417099 [0,2,0,0,0,0|1,0,0]=3 7647 B12R1.385 NCCOc1ccc(O)c(Br)c1 Amb33389250 [0,2,0,0,0,0|1,0,0]=3 7648 B12R1.385 NCCOc1ccc(O)c(Cl)c1 Amb33261307 [0,2,0,0,0,0|1,0,0]=3 7649 B12R1.385 NCCOc1ccc(O)c(F)c1 Amb33420179 [0,2,0,0,0,0|1,0,0]=3 7650 B12R1.385 NCCOc1ccc(O)c(O)c1 Amb33379213 [0,2,0,0,0,0|1,0,0]=3 7651 B12R1.385 NCCOc1cnc(Cl)c(Cl)c1 Amb33260433 [0,2,0,0,0,0|2,0,0]=4 7652 B12R1.385 NCCSc1ccc(Cl)c(Cl)c1 Amb17083030 [0,2,0,0,0,0|1,1,0]=4 7653 B12R1.385 NCCSc1ccc(O)c(O)c1 Amb27232712 [0,2,0,0,0,0|1,1,0]=4 7654 B12R1.385 Nc1cc(CCCBr)ccc1Cl Amb27633297 [0,2,0,0,0,0|2,0,0]=4 7655 B12R1.385 Nc1cc(CCCBr)ccc1F Amb27851683 [0,2,0,0,0,0|2,0,0]=4 7656 B12R1.385 Nc1cc(CCCCl)ccc1Br Amb25981221 [0,2,0,0,0,0|2,0,0]=4 7657 B12R1.385 Nc1cc(CCCCl)ccc1Cl Amb17477718 [0,2,0,0,0,0|2,0,0]=4 7658 B12R1.385 Nc1cc(CCCCl)ccc1O Amb17477706 [0,2,0,0,0,0|2,0,0]=4 7659 B12R1.385 Nc1cc(CCCO)ccc1Cl Amb17477707 [0,2,0,0,0,0|1,0,0]=3 7660 B12R1.385 Nc1cc(CCCO)ccc1O Amb17477699 [0,2,0,0,0,0|1,0,0]=3 7661 B12R1.385 Nc1cc(NCCO)ccc1O Amb28141979 [0,2,0,0,0,0|1,0,0]=3 7662 B12R1.385 Nc1cc(OCCF)ccc1Cl Amb25895101 [0,2,0,0,0,0|1,0,0]=3 7663 B12R1.385 Nc1cc(OCCF)ccc1F Amb32939666 [0,2,0,0,0,0|1,0,0]=3 7664 B12R1.385 Nc1cc(SCCF)ccc1Cl Amb27975849 [0,2,0,0,0,0|1,1,0]=4 7665 B12R1.385 Nc1ccc(C#CCO)cc1Cl Amb28251263 [0,2,0,0,0,0|1,0,1]=4 7666 B12R1.385 Nc1ccc(CCCBr)cc1Br Amb27633981 [0,2,0,0,0,0|2,0,0]=4 7667 B12R1.385 Nc1ccc(CCCBr)cc1O Amb27633292 [0,2,0,0,0,0|2,0,0]=4 7668 B12R1.385 Nc1ccc(CCCCl)cc1Br Amb26905865 [0,2,0,0,0,0|2,0,0]=4 7669 B12R1.385 Nc1ccc(CCCCl)cc1F Amb27614025 [0,2,0,0,0,0|2,0,0]=4 7670 B12R1.385 Nc1ccc(OCCF)cc1Cl Amb27169815 [0,2,0,0,0,0|1,0,0]=3 7671 B12R1.385 Nc1ccc(OCCF)cc1F Amb25338875 [0,2,0,0,0,0|1,0,0]=3 7672 B12R1.385 Nc1ccc(OCCF)cc1O Amb32939655 [0,2,0,0,0,0|1,0,0]=3 7673 B12R1.385 Nc1ccc(OCCO)cc1Cl Amb18295590 [0,2,0,0,0,0|0,0,0]=2 7674 B12R1.385 Nc1ccc(OCCO)cc1N Amb26639559 [0,2,0,0,0,0|0,0,0]=2 7675 B12R1.385 Nc1ccc(OCCO)nc1N Amb25378486 [0,2,0,0,0,0|1,0,0]=3 7676 B12R1.385 Nc1ccc(SCCF)cc1F Amb27263276 [0,2,0,0,0,0|1,1,0]=4 7677 B12R1.385 Nc1ccc(SCCO)nc1N Amb27472865 [0,2,0,0,0,0|1,1,0]=4 7678 B12R1.385 Nc1nc(OCCO)ncc1F Amb27601677 [0,2,0,0,0,0|2,0,0]=4 7679 B12R1.385 O=C1C=CC(SCCO)=CC1=O Amb27662383 [0,2,0,0,0,0|0,1,0]=3 7680 B12R1.385 O=C1C=CC(\C=C\CO)=CC1=O Amb24631190 [0,2,0,0,0,0|1,0,1]=4 7681 B12R1.385 O=CCOc1ccc(Cl)c(Cl)c1 Amb5731861 [0,2,0,0,0,0|0,0,2]=4 7682 B12R1.385 O=CCOc1ccc(F)c(Cl)c1 Amb18330026 [0,2,0,0,0,0|0,0,2]=4 7683 B12R1.385 O=CCOc1ccc(F)c(F)c1 Amb18807300 [0,2,0,0,0,0|0,0,2]=4 7684 B12R1.385 O=CCOc1ccc(O)c(Cl)c1 Amb27828941 [0,2,0,0,0,0|0,0,2]=4 7685 B12R1.385 OCC#Cc1ccc(Br)c(F)c1 Amb32654826 [0,2,0,0,0,0|1,0,1]=4 7686 B12R1.385 OCC#Cc1ccc(F)c(Br)c1 Amb32654833 [0,2,0,0,0,0|1,0,1]=4 7687 B12R1.385 OCC#Cc1ccc(F)c(F)c1 Amb9777275 [0,2,0,0,0,0|1,0,1]=4 7688 B12R1.385 OCCCc1ccc(Br)c(Cl)c1 Amb33477310 [0,2,0,0,0,0|1,0,0]=3 7689 B12R1.385 OCCCc1ccc(Br)c(F)c1 Amb32945422 [0,2,0,0,0,0|1,0,0]=3 7690 B12R1.385 OCCCc1ccc(Br)c(I)c1 Amb27667215 [0,2,0,0,0,0|1,0,0]=3 7691 B12R1.385 OCCCc1ccc(Cl)c(Br)c1 Amb23560508 [0,2,0,0,0,0|1,0,0]=3 7692 B12R1.385 OCCCc1ccc(Cl)c(Cl)c1 Amb17402982 [0,2,0,0,0,0|1,0,0]=3 7693 B12R1.385 OCCCc1ccc(Cl)c(F)c1 Amb25863120 [0,2,0,0,0,0|1,0,0]=3 7694 B12R1.385 OCCCc1ccc(F)c(Br)c1 Amb26373422 [0,2,0,0,0,0|1,0,0]=3 7695 B12R1.385 OCCCc1ccc(F)c(Cl)c1 Amb18863384 [0,2,0,0,0,0|1,0,0]=3 7696 B12R1.385 OCCCc1ccc(F)c(F)c1 Amb18224422 [0,2,0,0,0,0|1,0,0]=3 7697 B12R1.385 OCCCc1ccc(I)c(O)c1 Amb27870723 [0,2,0,0,0,0|1,0,0]=3 7698 B12R1.385 OCCCc1ccc(O)c(Br)c1 Amb26056201 [0,2,0,0,0,0|1,0,0]=3 7699 B12R1.385 OCCCc1ccc(O)c(Cl)c1 Amb26908242 [0,2,0,0,0,0|1,0,0]=3 7700 B12R1.385 OCCCc1ccc(O)c(F)c1 Amb24378042 [0,2,0,0,0,0|1,0,0]=3 7701 B12R1.385 OCCCc1ccc(O)c(I)c1 Amb26883621 [0,2,0,0,0,0|1,0,0]=3 7702 B12R1.385 OCCCc1ccc(O)c(O)c1 Amb25946318 [0,2,0,0,0,0|1,0,0]=3 7703 B12R1.385 OCCCc1cnc(Cl)c(Cl)c1 Amb33260353 [0,2,0,0,0,0|2,0,0]=4 7704 B12R1.385 OCCNc1ccc(Cl)c(Cl)c1 Amb6710964 [0,2,0,0,0,0|1,0,0]=3 7705 B12R1.385 OCCNc1ccc(F)c(Cl)c1 Amb17305858 [0,2,0,0,0,0|1,0,0]=3 7706 B12R1.385 OCCNc1ccc(F)c(F)c1 Amb6711633 [0,2,0,0,0,0|1,0,0]=3 7707 B12R1.385 OCCNc1ccc(O)c(Cl)c1 Amb27403676 [0,2,0,0,0,0|1,0,0]=3 7708 B12R1.385 OCCOc1ccc(Cl)c(Cl)c1 Amb17105031 [0,2,0,0,0,0|0,0,0]=2 7709 B12R1.385 OCCOc1ccc(F)c(Br)c1 Amb27148924 [0,2,0,0,0,0|0,0,0]=2 7710 B12R1.385 OCCOc1ccc(F)c(Cl)c1 Amb27837392 [0,2,0,0,0,0|0,0,0]=2 7711 B12R1.385 OCCOc1ccc(F)c(F)c1 Amb9394746 [0,2,0,0,0,0|0,0,0]=2 7712 B12R1.385 OCCSc1ccc(Cl)c(Cl)c1 Amb2686954 [0,2,0,0,0,0|0,1,0]=3 7713 B12R1.385 OC\C=C\c1ccc(Br)c(Br)c1 Amb28123256 [0,2,0,0,0,0|1,0,1]=4 7714 B12R1.385 OC\C=C\c1ccc(Br)c(Cl)c1 Amb28387654 [0,2,0,0,0,0|1,0,1]=4 7715 B12R1.385 OC\C=C\c1ccc(Br)c(F)c1 Amb33451817 [0,2,0,0,0,0|1,0,1]=4 7716 B12R1.385 OC\C=C\c1ccc(Cl)c(Br)c1 Amb33451242 [0,2,0,0,0,0|1,0,1]=4 7717 B12R1.385 OC\C=C\c1ccc(Cl)c(Cl)c1 Amb23442815 [0,2,0,0,0,0|1,0,1]=4 7718 B12R1.385 OC\C=C\c1ccc(Cl)c(F)c1 Amb33136402 [0,2,0,0,0,0|1,0,1]=4 7719 B12R1.385 OC\C=C\c1ccc(F)c(Br)c1 Amb27648497 [0,2,0,0,0,0|1,0,1]=4 7720 B12R1.385 OC\C=C\c1ccc(F)c(Cl)c1 Amb27865700 [0,2,0,0,0,0|1,0,1]=4 7721 B12R1.385 OC\C=C\c1ccc(F)c(F)c1 Amb23555608 [0,2,0,0,0,0|1,0,1]=4 7722 B12R1.385 OC\C=C\c1ccc(O)c(Br)c1 Amb33478361 [0,2,0,0,0,0|1,0,1]=4 7723 B12R1.385 OC\C=C\c1ccc(O)c(Cl)c1 Amb33406395 [0,2,0,0,0,0|1,0,1]=4 7724 B12R1.385 OC\C=C\c1ccc(O)c(F)c1 Amb33359297 [0,2,0,0,0,0|1,0,1]=4 7725 B12R1.385 OC\C=C\c1ccc(O)c(O)c1 Amb33136453 [0,2,0,0,0,0|1,0,1]=4 7726 B12R1.385 Oc1cc(CCCBr)ccc1Br Amb26571784 [0,2,0,0,0,0|2,0,0]=4 7727 B12R1.385 Oc1cc(CCCBr)ccc1Cl Amb27209898 [0,2,0,0,0,0|2,0,0]=4 7728 B12R1.385 Oc1cc(CCCBr)ccc1I Amb27474845 [0,2,0,0,0,0|2,0,0]=4 7729 B12R1.385 Oc1cc(CCCBr)ccc1S Amb27423586 [0,2,0,0,0,0|2,0,0]=4 7730 B12R1.385 Oc1cc(CCCCl)ccc1Br Amb27613861 [0,2,0,0,0,0|2,0,0]=4 7731 B12R1.385 Oc1cc(CCCCl)ccc1Cl Amb27789043 [0,2,0,0,0,0|2,0,0]=4 7732 B12R1.385 Oc1cc(CCCCl)ccc1S Amb27200002 [0,2,0,0,0,0|2,0,0]=4 7733 B12R1.385 Oc1ccc(CCCBr)cc1Br Amb28129980 [0,2,0,0,0,0|2,0,0]=4 7734 B12R1.385 Oc1ccc(CCCBr)cc1Cl Amb26007162 [0,2,0,0,0,0|2,0,0]=4 7735 B12R1.385 Oc1ccc(CCCBr)cc1F Amb26005430 [0,2,0,0,0,0|2,0,0]=4 7736 B12R1.385 Oc1ccc(CCCBr)cc1O Amb25323902 [0,2,0,0,0,0|2,0,0]=4 7737 B12R1.385 Oc1ccc(CCCCl)cc1Br Amb26006131 [0,2,0,0,0,0|2,0,0]=4 7738 B12R1.385 Oc1ccc(CCCCl)cc1F Amb28287543 [0,2,0,0,0,0|2,0,0]=4 7739 B12R1.385 Oc1ccc(CCCCl)cc1I Amb27787504 [0,2,0,0,0,0|2,0,0]=4 7740 B12R1.385 Oc1ccc(CCCCl)cc1S Amb27423588 [0,2,0,0,0,0|2,0,0]=4 7741 B12R1.385 Oc1ccc(CCCS)cc1Br Amb33387399 [0,2,0,0,0,0|1,1,0]=4 7742 B12R1.385 Oc1ccc(CCCS)cc1Cl Amb33261354 [0,2,0,0,0,0|1,1,0]=4 7743 B12R1.385 Oc1ccc(CCCS)cc1F Amb33420819 [0,2,0,0,0,0|1,1,0]=4 7744 B12R1.385 Oc1ccc(CCCS)cc1O Amb33378708 [0,2,0,0,0,0|1,1,0]=4 7745 B12R1.385 SCCCc1ccc(Br)c(Cl)c1 Amb33477556 [0,2,0,0,0,0|1,1,0]=4 7746 B12R1.385 SCCCc1ccc(Cl)c(Br)c1 Amb33335786 [0,2,0,0,0,0|1,1,0]=4 7747 B12R1.385 SCCCc1ccc(Cl)c(Cl)c1 Amb26969986 [0,2,0,0,0,0|1,1,0]=4 7748 B12R1.385 SCCOc1ccc(Br)c(Cl)c1 Amb28121346 [0,2,0,0,0,0|0,1,0]=3 7749 B12R1.385 SCCOc1ccc(Cl)c(Cl)c1 Amb17245968 [0,2,0,0,0,0|0,1,0]=3 7750 B12R1.385 Sc1cc(CCCBr)ccc1Br Amb27246864 [0,2,0,0,0,0|2,0,0]=4 7751 B12R1.385 Sc1cc(CCCBr)ccc1Cl Amb27967964 [0,2,0,0,0,0|2,0,0]=4 7752 B12R1.385 Sc1cc(CCCBr)ccc1I Amb27423733 [0,2,0,0,0,0|2,0,0]=4 7753 B12R1.385 Sc1cc(CCCCl)ccc1Br Amb27438310 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.385 Sc1ccc(CCCBr)cc1Br Amb26442395 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.385 Sc1ccc(CCCBr)cc1I Amb27795079 [0,2,0,0,0,0|2,0,0]=4 7756 B12R1.385 Sc1ccc(CCCCl)cc1Br Amb27211266 [0,2,0,0,0,0|2,0,0]=4 7757 B12R1.3 C#C\C(=C\CO)c1ccccc1 Amb27829961 [0,2,0,0,0,0|1,0,1]=4 7758 B12R1.3 CCC(CCN)c1ccccc1 Amb5739026 [0,2,0,0,0,0|2,0,0]=4 7759 B12R1.3 CCC(CCO)c1ccccc1 Amb17232488 [0,2,0,0,0,0|1,0,0]=3 7760 B12R1.3 CCCC(C#N)c1ccccc1 Amb2720802 [0,2,0,0,0,0|2,0,0]=4 7761 B12R1.3 CCCC(C=O)c1ccccc1 Amb17594046 [0,2,0,0,0,0|2,0,0]=4 7762 B12R1.3 CCCC(CBr)c1ccccc1 Amb17247626 [0,2,0,0,0,0|2,0,0]=4 7763 B12R1.3 CCCC(CC)c1ccccc1 Amb9787575 [0,2,0,0,0,0|2,0,0]=4 7764 B12R1.3 CCCC(CCl)c1ccccc1 Amb17233968 [0,2,0,0,0,0|2,0,0]=4 7765 B12R1.3 CCCC(CN)c1ccccc1 Amb8950183 [0,2,0,0,0,0|2,0,0]=4 7766 B12R1.3 CCCC(CO)c1ccccc1 Amb17232487 [0,2,0,0,0,0|2,0,0]=4 7767 B12R1.3 CCCN(C#N)c1ccccc1 Amb27434318 [0,2,0,0,0,0|2,0,0]=4 7768 B12R1.3 CCC\C(=N\N)c1ccccc1 Amb27649935 [0,2,0,0,0,0|2,0,0]=4 7769 B12R1.3 CCC\C(=N\O)c1ccccc1 Amb27979178 [0,2,0,0,0,0|2,0,0]=4 7770 B12R1.3 CCN(CCCl)c1ccccc1 Amb8392941 [0,2,0,0,0,0|2,0,0]=4 7771 B12R1.3 CCN(CCN)c1ccccc1 Amb1136918 [0,2,0,0,0,0|2,0,0]=4 7772 B12R1.3 CCN(CCN)c1ccccc1 Amb33266057 [0,2,0,0,0,0|2,0,0]=4 7773 B12R1.3 CCN(CCO)c1ccccc1 Amb1208392 [0,2,0,0,0,0|1,0,0]=3 7774 B12R1.3 CCN(CCO)c1ccncc1 Amb18792801 [0,2,0,0,0,0|2,0,0]=4 7775 B12R1.3 CCN(CCS)c1ccccc1 Amb13881733 [0,2,0,0,0,0|1,1,0]=4 7776 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,2,0,0,0,0|1,0,0]=3 7777 B12R1.3 COC(CCN)c1ccccc1 Amb17334641 [0,2,0,0,0,0|2,0,0]=4 7778 B12R1.3 N#CC(CCO)c1ccccc1 Amb17334526 [0,2,0,0,0,0|1,0,0]=3 7779 B12R1.3 N#CC(CCO)c1ccccn1 Amb17334562 [0,2,0,0,0,0|2,0,0]=4 7780 B12R1.3 N#CC(CCO)c1cccnc1 Amb17334563 [0,2,0,0,0,0|2,0,0]=4 7781 B12R1.3 N#CC(CCO)c1ccncc1 Amb17334564 [0,2,0,0,0,0|2,0,0]=4 7782 B12R1.3 N#CC(NCO)c1ccccc1 Amb28125883 [0,2,0,0,0,0|2,0,0]=4 7783 B12R1.3 N#C\C(=C\CO)c1ccccc1 Amb27197973 [0,2,0,0,0,0|1,0,1]=4 7784 B12R1.3 NCC(CCO)c1ccccc1 Amb5494015 [0,2,0,0,0,0|1,0,0]=3 7785 B12R1.3 NCC(CCO)c1cccnc1 Amb17232607 [0,2,0,0,0,0|2,0,0]=4 7786 B12R1.3 NCC(CCO)c1ccncc1 Amb35789216 [0,2,0,0,0,0|2,0,0]=4 7787 B12R1.3 NCC(CCO)c1ccncc1 Amb35789737 [0,2,0,0,0,0|2,0,0]=4 7788 B12R1.3 NCCC(CN)c1ccccc1 Amb1111605 [0,2,0,0,0,0|2,0,0]=4 7789 B12R1.17 C=C(CCN)c1cccc(Br)c1 Amb33451466 [0,2,0,0,0,0|2,0,0]=4 7790 B12R1.17 C=C(CCN)c1cccc(C)c1 Amb33380570 [0,2,0,0,0,0|2,0,0]=4 7791 B12R1.17 C=C(CCN)c1cccc(Cl)c1 Amb33223582 [0,2,0,0,0,0|2,0,0]=4 7792 B12R1.17 C=C(CCN)c1cccc(F)c1 Amb33203777 [0,2,0,0,0,0|2,0,0]=4 7793 B12R1.17 C=C(CCN)c1cccc(O)c1 Amb33310864 [0,2,0,0,0,0|2,0,0]=4 7794 B12R1.17 CC(CCN)c1cccc(Br)c1 Amb30021557 [0,2,0,0,0,0|2,0,0]=4 7795 B12R1.17 CC(CCN)c1cccc(Cl)c1 Amb17234051 [0,2,0,0,0,0|2,0,0]=4 7796 B12R1.17 CC(CCN)c1cccc(F)c1 Amb17232650 [0,2,0,0,0,0|2,0,0]=4 7797 B12R1.17 CC(CCN)c1cccc(O)c1 Amb33311223 [0,2,0,0,0,0|2,0,0]=4 7798 B12R1.17 CC(CCO)c1cccc(Cl)c1 Amb17234166 [0,2,0,0,0,0|1,0,0]=3 7799 B12R1.17 CC(CCO)c1cccc(F)c1 Amb17232674 [0,2,0,0,0,0|1,0,0]=3 7800 B12R1.17 CCCC(=O)c1cccc(Br)c1 Amb17193987 [0,2,0,0,0,0|2,0,0]=4 7801 B12R1.17 CCCC(=O)c1cccc(C)c1 Amb3940677 [0,2,0,0,0,0|2,0,0]=4 7802 B12R1.17 CCCC(=O)c1cccc(Cl)c1 Amb17198744 [0,2,0,0,0,0|2,0,0]=4 7803 B12R1.17 CCCC(=O)c1cccc(F)c1 Amb17232581 [0,2,0,0,0,0|2,0,0]=4 7804 B12R1.17 CCCC(=O)c1cccc(N)c1 Amb33548311 [0,2,0,0,0,0|2,0,0]=4 7805 B12R1.17 CCCC(C)c1cccc(O)c1 Amb27229592 [0,2,0,0,0,0|2,0,0]=4 7806 B12R1.17 CCCC(Cl)c1cccc(Br)c1 Amb29880680 [0,2,0,0,0,0|2,0,0]=4 7807 B12R1.17 CCCC(Cl)c1cccc(Cl)c1 Amb27656221 [0,2,0,0,0,0|2,0,0]=4 7808 B12R1.17 CCCC(N)c1cccc(Br)c1 Amb28240805 [0,2,0,0,0,0|2,0,0]=4 7809 B12R1.17 CCCC(N)c1cccc(C)c1 Amb17232449 [0,2,0,0,0,0|2,0,0]=4 7810 B12R1.17 CCCC(N)c1cccc(C)c1 Amb32662396 [0,2,0,0,0,0|2,0,0]=4 7811 B12R1.17 CCCC(N)c1cccc(Cl)c1 Amb17234050 [0,2,0,0,0,0|2,0,0]=4 7812 B12R1.17 CCCC(N)c1cccc(F)c1 Amb17232649 [0,2,0,0,0,0|2,0,0]=4 7813 B12R1.17 CCCC(N)c1cccc(F)c1 Amb30982493 [0,2,0,0,0,0|2,0,0]=4 7814 B12R1.17 CCCC(N)c1cccc(I)c1 Amb27209580 [0,2,0,0,0,0|2,0,0]=4 7815 B12R1.17 CCCC(N)c1cccc(N)c1 Amb25891904 [0,2,0,0,0,0|2,0,0]=4 7816 B12R1.17 CCCC(O)c1cccc(Br)c1 Amb17248424 [0,2,0,0,0,0|2,0,0]=4 7817 B12R1.17 CCCC(O)c1cccc(C)c1 Amb17232484 [0,2,0,0,0,0|2,0,0]=4 7818 B12R1.17 CCCC(O)c1cccc(Cl)c1 Amb17234155 [0,2,0,0,0,0|2,0,0]=4 7819 B12R1.17 CCCC(O)c1cccc(F)c1 Amb17232673 [0,2,0,0,0,0|2,0,0]=4 7820 B12R1.17 CCCS(=O)c1cccc(N)c1 Amb27258884 [0,2,0,0,0,0|1,1,0]=4 7821 B12R1.17 CCC[C@@H](N)c1cccc(I)c1 Amb27814307 [0,2,0,0,0,0|2,0,0]=4 7822 B12R1.17 CCC[C@@H](O)c1cccc(Br)c1 Amb27176217 [0,2,0,0,0,0|2,0,0]=4 7823 B12R1.17 CCC[C@@H](O)c1cccc(F)c1 Amb28138837 [0,2,0,0,0,0|2,0,0]=4 7824 B12R1.17 CCC[C@H](N)c1cccc(C)c1 Amb28313719 [0,2,0,0,0,0|2,0,0]=4 7825 B12R1.17 CCC[C@H](N)c1cccc(Cl)c1 Amb28346844 [0,2,0,0,0,0|2,0,0]=4 7826 B12R1.17 CCC[C@H](N)c1cccc(F)c1 Amb27626030 [0,2,0,0,0,0|2,0,0]=4 7827 B12R1.17 CCC[C@H](N)c1cccc(N)c1 Amb28255487 [0,2,0,0,0,0|2,0,0]=4 7828 B12R1.17 CCC[C@H](O)c1cccc(Cl)c1 Amb27826760 [0,2,0,0,0,0|2,0,0]=4 7829 B12R1.17 CN(CCCl)c1cccc(Br)c1 Amb17351920 [0,2,0,0,0,0|2,0,0]=4 7830 B12R1.17 CN(CCCl)c1cccc(Cl)c1 Amb17338056 [0,2,0,0,0,0|2,0,0]=4 7831 B12R1.17 CN(CCCl)c1cccc(F)c1 Amb17335953 [0,2,0,0,0,0|2,0,0]=4 7832 B12R1.17 CN(CCF)c1cccc(N)c1 Amb27614743 [0,2,0,0,0,0|2,0,0]=4 7833 B12R1.17 CN(CCN)c1cccc(Br)c1 Amb17059773 [0,2,0,0,0,0|2,0,0]=4 7834 B12R1.17 CN(CCN)c1cccc(Cl)c1 Amb17059646 [0,2,0,0,0,0|2,0,0]=4 7835 B12R1.17 CN(CCN)c1cccc(F)c1 Amb17059643 [0,2,0,0,0,0|2,0,0]=4 7836 B12R1.17 CN(CCO)c1cc(Br)ccn1 Amb18160449 [0,2,0,0,0,0|2,0,0]=4 7837 B12R1.17 CN(CCO)c1cc(N)ccn1 Amb18981476 [0,2,0,0,0,0|2,0,0]=4 7838 B12R1.17 CN(CCO)c1cccc(Br)c1 Amb17344452 [0,2,0,0,0,0|1,0,0]=3 7839 B12R1.17 CN(CCO)c1cccc(Cl)c1 Amb17335811 [0,2,0,0,0,0|1,0,0]=3 7840 B12R1.17 CN(CCO)c1cccc(Cl)n1 Amb21957698 [0,2,0,0,0,0|2,0,0]=4 7841 B12R1.17 CN(CCO)c1cccc(F)c1 Amb17334765 [0,2,0,0,0,0|1,0,0]=3 7842 B12R1.17 CN(CCO)c1ccnc(Cl)c1 Amb27793967 [0,2,0,0,0,0|2,0,0]=4 7843 B12R1.17 CN(CCO)c1cncc(Br)c1 Amb23744740 [0,2,0,0,0,0|2,0,0]=4 7844 B12R1.17 C[C@H](CCO)c1cccc(Cl)c1 Amb28317668 [0,2,0,0,0,0|1,0,0]=3 7845 B12R1.17 C\C(=C/CO)c1cccc(Br)c1 Amb27248580 [0,2,0,0,0,0|1,0,1]=4 7846 B12R1.17 C\C(=C/CO)c1cccc(Cl)c1 Amb27628731 [0,2,0,0,0,0|1,0,1]=4 7847 B12R1.17 Cc1cc(C(N)CCO)ccn1 Amb25727723 [0,2,0,0,0,0|2,0,0]=4 7848 B12R1.17 Cc1cccc(C(=O)CCBr)c1 Amb26841200 [0,2,0,0,0,0|2,0,0]=4 7849 B12R1.17 Cc1cccc(C(=O)CCN)c1 Amb24700399 [0,2,0,0,0,0|2,0,0]=4 7850 B12R1.17 Cc1cccc(C(=O)CCO)c1 Amb25735228 [0,2,0,0,0,0|1,0,0]=3 7851 B12R1.17 Cc1cccc(C(=O)NCO)c1 Amb27616730 [0,2,0,0,0,0|2,0,0]=4 7852 B12R1.17 Cc1cccc(C(C)CCN)c1 Amb17232450 [0,2,0,0,0,0|2,0,0]=4 7853 B12R1.17 Cc1cccc(C(C)CCO)c1 Amb17232501 [0,2,0,0,0,0|1,0,0]=3 7854 B12R1.17 Cc1cccc(C(F)CCN)c1 Amb25043004 [0,2,0,0,0,0|2,0,0]=4 7855 B12R1.17 Cc1cccc(C(N)CCO)c1 Amb17103954 [0,2,0,0,0,0|1,0,0]=3 7856 B12R1.17 Cc1cccc(C(N)CCO)n1 Amb24697663 [0,2,0,0,0,0|2,0,0]=4 7857 B12R1.17 Cc1cccc(C(O)CCN)c1 Amb17232540 [0,2,0,0,0,0|2,0,0]=4 7858 B12R1.17 Cc1cccc(C(O)CCO)c1 Amb27404138 [0,2,0,0,0,0|1,0,0]=3 7859 B12R1.17 Cc1cccc(C(O)CNO)c1 Amb17334703 [0,2,0,0,0,0|2,0,0]=4 7860 B12R1.17 Cc1cccc(N(C)CCBr)c1 Amb27751471 [0,2,0,0,0,0|2,0,0]=4 7861 B12R1.17 Cc1cccc(N(C)CCCl)c1 Amb17335671 [0,2,0,0,0,0|2,0,0]=4 7862 B12R1.17 Cc1cccc(N(C)CCN)c1 Amb17059641 [0,2,0,0,0,0|2,0,0]=4 7863 B12R1.17 Cc1cccc(N(C)CCN)c1 Amb33446965 [0,2,0,0,0,0|2,0,0]=4 7864 B12R1.17 Cc1cccc(N(C)CCO)c1 Amb17334644 [0,2,0,0,0,0|1,0,0]=3 7865 B12R1.17 Cc1cccc(S(=O)CCN)c1 Amb18974528 [0,2,0,0,0,0|1,1,0]=4 7866 B12R1.17 Cc1cccc([C@@H](N)CCN)c1 Amb28131373 [0,2,0,0,0,0|2,0,0]=4 7867 B12R1.17 Cc1cccc([C@@H](N)CCO)c1 Amb19888371 [0,2,0,0,0,0|1,0,0]=3 7868 B12R1.17 Cc1cccc([C@@H](O)CCN)c1 Amb33203928 [0,2,0,0,0,0|2,0,0]=4 7869 B12R1.17 Cc1cccc([C@H](N)CCO)c1 Amb19887706 [0,2,0,0,0,0|1,0,0]=3 7870 B12R1.17 Cc1cccc([C@H](O)CCN)c1 Amb33203929 [0,2,0,0,0,0|2,0,0]=4 7871 B12R1.17 Cc1ccnc(C(N)CCO)c1 Amb28241513 [0,2,0,0,0,0|2,0,0]=4 7872 B12R1.17 Cc1cncc(C(N)CCO)c1 Amb26403753 [0,2,0,0,0,0|2,0,0]=4 7873 B12R1.17 NC(CCO)c1cc(Cl)ccn1 Amb27831878 [0,2,0,0,0,0|2,0,0]=4 7874 B12R1.17 NC(CCO)c1cc(F)ccn1 Amb33415611 [0,2,0,0,0,0|2,0,0]=4 7875 B12R1.17 NC(CCO)c1cc(O)ccn1 Amb27831428 [0,2,0,0,0,0|2,0,0]=4 7876 B12R1.17 NC(CCO)c1cccc(Br)c1 Amb18990231 [0,2,0,0,0,0|1,0,0]=3 7877 B12R1.17 NC(CCO)c1cccc(Br)c1 Amb30586495 [0,2,0,0,0,0|1,0,0]=3 7878 B12R1.17 NC(CCO)c1cccc(Br)n1 Amb27258995 [0,2,0,0,0,0|2,0,0]=4 7879 B12R1.17 NC(CCO)c1cccc(Cl)c1 Amb2417047 [0,2,0,0,0,0|1,0,0]=3 7880 B12R1.17 NC(CCO)c1cccc(Cl)n1 Amb28456655 [0,2,0,0,0,0|2,0,0]=4 7881 B12R1.17 NC(CCO)c1cccc(F)c1 Amb2697503 [0,2,0,0,0,0|1,0,0]=3 7882 B12R1.17 NC(CCO)c1cccc(O)c1 Amb19887678 [0,2,0,0,0,0|1,0,0]=3 7883 B12R1.17 NC(CCO)c1cccc(O)c1 Amb31307762 [0,2,0,0,0,0|1,0,0]=3 7884 B12R1.17 NC(CCO)c1ccnc(Cl)c1 Amb22296964 [0,2,0,0,0,0|2,0,0]=4 7885 B12R1.17 NC(CCO)c1ccnc(O)c1 Amb27254178 [0,2,0,0,0,0|2,0,0]=4 7886 B12R1.17 NC(CCO)c1cncc(Br)c1 Amb26880747 [0,2,0,0,0,0|2,0,0]=4 7887 B12R1.17 NC(CCO)c1cncc(Cl)c1 Amb28397860 [0,2,0,0,0,0|2,0,0]=4 7888 B12R1.17 NC(CCO)c1cncc(F)c1 Amb27881707 [0,2,0,0,0,0|2,0,0]=4 7889 B12R1.17 NCCC(=O)c1cccc(Br)c1 Amb18121501 [0,2,0,0,0,0|2,0,0]=4 7890 B12R1.17 NCCC(=O)c1cccc(Cl)c1 Amb26318502 [0,2,0,0,0,0|2,0,0]=4 7891 B12R1.17 NCCC(=O)c1cccc(F)c1 Amb27416316 [0,2,0,0,0,0|2,0,0]=4 7892 B12R1.17 NCCC(=O)c1cccc(O)c1 Amb27479943 [0,2,0,0,0,0|2,0,0]=4 7893 B12R1.17 NCCC(F)c1cccc(Br)c1 Amb33452141 [0,2,0,0,0,0|2,0,0]=4 7894 B12R1.17 NCCC(F)c1cccc(Cl)c1 Amb26051695 [0,2,0,0,0,0|2,0,0]=4 7895 B12R1.17 NCCC(F)c1cccc(F)c1 Amb28048483 [0,2,0,0,0,0|2,0,0]=4 7896 B12R1.17 NCCC(F)c1cccc(O)c1 Amb26987845 [0,2,0,0,0,0|2,0,0]=4 7897 B12R1.17 NCCC(N)c1cccc(Cl)c1 Amb28348609 [0,2,0,0,0,0|2,0,0]=4 7898 B12R1.17 NCCC(N)c1cccc(F)c1 Amb27629792 [0,2,0,0,0,0|2,0,0]=4 7899 B12R1.17 NCCC(O)c1cccc(Br)c1 Amb18121493 [0,2,0,0,0,0|2,0,0]=4 7900 B12R1.17 NCCC(O)c1cccc(Cl)c1 Amb17234260 [0,2,0,0,0,0|2,0,0]=4 7901 B12R1.17 NCCC(O)c1cccc(F)c1 Amb17232697 [0,2,0,0,0,0|2,0,0]=4 7902 B12R1.17 NCCC(O)c1cccc(I)c1 Amb24493265 [0,2,0,0,0,0|2,0,0]=4 7903 B12R1.17 NCCC(O)c1cccc(O)c1 Amb18251885 [0,2,0,0,0,0|2,0,0]=4 7904 B12R1.17 NCC[C@@H](O)c1cccc(Br)c1 Amb33451583 [0,2,0,0,0,0|2,0,0]=4 7905 B12R1.17 NCC[C@@H](O)c1cccc(Cl)c1 Amb25105024 [0,2,0,0,0,0|2,0,0]=4 7906 B12R1.17 NCC[C@@H](O)c1cccc(F)c1 Amb33316044 [0,2,0,0,0,0|2,0,0]=4 7907 B12R1.17 NCC[C@@H](O)c1cccc(O)c1 Amb33225571 [0,2,0,0,0,0|2,0,0]=4 7908 B12R1.17 NCC[C@H](N)c1cccc(Br)c1 Amb28057464 [0,2,0,0,0,0|2,0,0]=4 7909 B12R1.17 NCC[C@H](N)c1cccc(Cl)c1 Amb27788404 [0,2,0,0,0,0|2,0,0]=4 7910 B12R1.17 NCC[C@H](O)c1cccc(Br)c1 Amb33451586 [0,2,0,0,0,0|2,0,0]=4 7911 B12R1.17 NCC[C@H](O)c1cccc(Cl)c1 Amb28323010 [0,2,0,0,0,0|2,0,0]=4 7912 B12R1.17 NCC[C@H](O)c1cccc(F)c1 Amb33316043 [0,2,0,0,0,0|2,0,0]=4 7913 B12R1.17 NCC[C@H](O)c1cccc(O)c1 Amb33312067 [0,2,0,0,0,0|2,0,0]=4 7914 B12R1.17 N[C@@H](CCO)c1cc(O)ccn1 Amb27950107 [0,2,0,0,0,0|2,0,0]=4 7915 B12R1.17 N[C@@H](CCO)c1cccc(Br)c1 Amb8631673 [0,2,0,0,0,0|1,0,0]=3 7916 B12R1.17 N[C@@H](CCO)c1cccc(Br)c1 Amb8631674 [0,2,0,0,0,0|1,0,0]=3 7917 B12R1.17 N[C@@H](CCO)c1cccc(Cl)c1 Amb19888404 [0,2,0,0,0,0|1,0,0]=3 7918 B12R1.17 N[C@@H](CCO)c1cccc(Cl)c1 Amb30874077 [0,2,0,0,0,0|1,0,0]=3 7919 B12R1.17 N[C@@H](CCO)c1cccc(F)c1 Amb19888379 [0,2,0,0,0,0|1,0,0]=3 7920 B12R1.17 N[C@@H](CCO)c1cccc(F)n1 Amb27426755 [0,2,0,0,0,0|2,0,0]=4 7921 B12R1.17 N[C@@H](CCO)c1cccc(I)c1 Amb27248087 [0,2,0,0,0,0|1,0,0]=3 7922 B12R1.17 N[C@@H](CCO)c1cccc(O)c1 Amb19888375 [0,2,0,0,0,0|1,0,0]=3 7923 B12R1.17 N[C@@H](CCO)c1cccc(O)c1 Amb19929578 [0,2,0,0,0,0|1,0,0]=3 7924 B12R1.17 N[C@@H](CCO)c1cncc(Br)c1 Amb26343192 [0,2,0,0,0,0|2,0,0]=4 7925 B12R1.17 N[C@@H](CCO)c1cncc(Cl)c1 Amb27168640 [0,2,0,0,0,0|2,0,0]=4 7926 B12R1.17 N[C@H](CCO)c1cc(Br)ccn1 Amb28119080 [0,2,0,0,0,0|2,0,0]=4 7927 B12R1.17 N[C@H](CCO)c1cccc(Br)c1 Amb19887619 [0,2,0,0,0,0|1,0,0]=3 7928 B12R1.17 N[C@H](CCO)c1cccc(Br)c1 Amb19943918 [0,2,0,0,0,0|1,0,0]=3 7929 B12R1.17 N[C@H](CCO)c1cccc(Cl)c1 Amb19887652 [0,2,0,0,0,0|1,0,0]=3 7930 B12R1.17 N[C@H](CCO)c1cccc(F)c1 Amb19887668 [0,2,0,0,0,0|1,0,0]=3 7931 B12R1.17 N[C@H](CCO)c1cccc(F)c1 Amb19888995 [0,2,0,0,0,0|1,0,0]=3 7932 B12R1.17 N[C@H](CCO)c1cccc(I)c1 Amb28048810 [0,2,0,0,0,0|1,0,0]=3 7933 B12R1.17 N[C@H](CCO)c1cccc(O)c1 Amb33812400 [0,2,0,0,0,0|1,0,0]=3 7934 B12R1.17 N[C@H](CCO)c1cccc(S)c1 Amb27874125 [0,2,0,0,0,0|1,0,0]=3 7935 B12R1.17 N[C@H](CCO)c1cncc(Br)c1 Amb25758880 [0,2,0,0,0,0|2,0,0]=4 7936 B12R1.17 N[C@H](CCO)c1cncc(F)c1 Amb27968665 [0,2,0,0,0,0|2,0,0]=4 7937 B12R1.17 Nc1cc(C(N)CCO)ccn1 Amb27759964 [0,2,0,0,0,0|2,0,0]=4 7938 B12R1.17 Nc1cccc(C(=O)CCCl)c1 Amb27665899 [0,2,0,0,0,0|2,0,0]=4 7939 B12R1.17 Nc1cccc(C(N)CCO)c1 Amb19929590 [0,2,0,0,0,0|1,0,0]=3 7940 B12R1.17 Nc1cccc(C(N)CCO)c1 Amb22235814 [0,2,0,0,0,0|1,0,0]=3 7941 B12R1.17 Nc1cccc(C(N)CCO)n1 Amb27234618 [0,2,0,0,0,0|2,0,0]=4 7942 B12R1.17 Nc1cccc(S(=O)CCO)c1 Amb27197309 [0,2,0,0,0,0|0,1,0]=3 7943 B12R1.17 Nc1cccc([C@@H](N)CCO)c1 Amb8631340 [0,2,0,0,0,0|1,0,0]=3 7944 B12R1.17 Nc1cccc([C@H](N)CCO)n1 Amb27596609 [0,2,0,0,0,0|2,0,0]=4 7945 B12R1.17 Nc1cncc([C@H](N)CCO)c1 Amb27249799 [0,2,0,0,0,0|2,0,0]=4 7946 B12R1.17 O=C(CCBr)c1cccc(Br)c1 Amb17437897 [0,2,0,0,0,0|2,0,0]=4 7947 B12R1.17 O=C(CCBr)c1cccc(F)c1 Amb25669661 [0,2,0,0,0,0|2,0,0]=4 7948 B12R1.17 O=C(CCBr)c1cccc(I)c1 Amb26398515 [0,2,0,0,0,0|2,0,0]=4 7949 B12R1.17 O=C(CCBr)c1cccc(O)c1 Amb28187113 [0,2,0,0,0,0|2,0,0]=4 7950 B12R1.17 O=C(CCCl)c1cccc(Br)c1 Amb17351482 [0,2,0,0,0,0|2,0,0]=4 7951 B12R1.17 O=C(CCCl)c1cccc(Cl)c1 Amb25742498 [0,2,0,0,0,0|2,0,0]=4 7952 B12R1.17 O=C(CCCl)c1cccc(I)c1 Amb27488590 [0,2,0,0,0,0|2,0,0]=4 7953 B12R1.17 O=C(CCCl)c1cccc(O)c1 Amb26549170 [0,2,0,0,0,0|2,0,0]=4 7954 B12R1.17 O=C(CCI)c1cccc(Cl)c1 Amb27621668 [0,2,0,0,0,0|2,0,0]=4 7955 B12R1.17 O=C(CCO)c1cccc(Br)c1 Amb26883865 [0,2,0,0,0,0|1,0,0]=3 7956 B12R1.17 O=C(CCO)c1cccc(F)c1 Amb27163257 [0,2,0,0,0,0|1,0,0]=3 7957 B12R1.17 OCCC(O)c1ccnc(Cl)c1 Amb22298355 [0,2,0,0,0,0|2,0,0]=4 7958 B12R1.17 OCCC(O)c1cncc(Br)c1 Amb28455364 [0,2,0,0,0,0|2,0,0]=4 7959 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,2,0,0,0,0|1,0,0]=3 7960 B12R1.17 OCC[C@H](O)c1cccc(Cl)c1 Amb26561233 [0,2,0,0,0,0|1,0,0]=3 7961 B12R1.17 ONCC(O)c1cccc(Br)c1 Amb17345006 [0,2,0,0,0,0|2,0,0]=4 7962 B12R1.17 ONCC(O)c1cccc(Cl)c1 Amb17335948 [0,2,0,0,0,0|2,0,0]=4 7963 B12R1.17 ONCC(O)c1cccc(O)c1 Amb17334759 [0,2,0,0,0,0|2,0,0]=4 7964 B12R1.17 O[C@@H](CCCl)c1cccc(F)c1 Amb28365651 [0,2,0,0,0,0|2,0,0]=4 7965 B12R1.17 O[C@H](CCCl)c1cccc(F)c1 Amb28121134 [0,2,0,0,0,0|2,0,0]=4 7966 B12R1.30 C#CCCC(=O)c1ccccc1 Amb8869629 [0,2,0,0,0,0|2,0,0]=4 7967 B12R1.30 C#CCCC(C)c1ccccc1 Amb33081910 [0,2,0,0,0,0|2,0,0]=4 7968 B12R1.30 C#CCCC(N)c1ccccc1 Amb25959477 [0,2,0,0,0,0|2,0,0]=4 7969 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [0,2,0,0,0,0|2,0,0]=4 7970 B12R1.30 C#CCCN(C)c1ccccc1 Amb10559135 [0,2,0,0,0,0|2,0,0]=4 7971 B12R1.30 C=CCCC(=O)c1ccccc1 Amb9031540 [0,2,0,0,0,0|2,0,0]=4 7972 B12R1.30 C=CCCC(C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|2,0,0]=4 7973 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|2,0,0]=4 7974 B12R1.30 C=CCCC(O)c1ccccc1 Amb18800658 [0,2,0,0,0,0|2,0,0]=4 7975 B12R1.30 C=CCOC(=O)c1ccccc1 Amb4034453 [0,2,0,0,0,0|1,0,1]=4 7976 B12R1.30 CC(CCC#N)c1ccccc1 Amb18645228 [0,2,0,0,0,0|2,0,0]=4 7977 B12R1.30 CC(CCC=O)c1ccccc1 Amb18645711 [0,2,0,0,0,0|1,0,1]=4 7978 B12R1.30 CC(CCCBr)c1ccccc1 Amb33082370 [0,2,0,0,0,0|2,0,0]=4 7979 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,2,0,0,0,0|2,0,0]=4 7980 B12R1.30 CC(CCCO)c1ccccc1 Amb33213887 [0,2,0,0,0,0|1,0,0]=3 7981 B12R1.30 CC(CCCS)c1ccccc1 Amb33082130 [0,2,0,0,0,0|1,1,0]=4 7982 B12R1.30 CC(CCON)c1ccccc1 Amb33081860 [0,2,0,0,0,0|1,0,0]=3 7983 B12R1.30 CC(NCCCl)c1ccccc1 Amb17335659 [0,2,0,0,0,0|2,0,0]=4 7984 B12R1.30 CC(NCCN)c1ccccc1 Amb17091024 [0,2,0,0,0,0|2,0,0]=4 7985 B12R1.30 CC(NCCO)c1ccccc1 Amb2092663 [0,2,0,0,0,0|1,0,0]=3 7986 B12R1.30 CC(NCCO)c1ccccn1 Amb7809203 [0,2,0,0,0,0|2,0,0]=4 7987 B12R1.30 CC(NCCO)c1cccnc1 Amb7809201 [0,2,0,0,0,0|2,0,0]=4 7988 B12R1.30 CC(NCCO)c1ccncc1 Amb7809202 [0,2,0,0,0,0|2,0,0]=4 7989 B12R1.30 CC(OCCN)c1ccccc1 Amb6248427 [0,2,0,0,0,0|1,0,0]=3 7990 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,2,0,0,0,0|0,0,0]=2 7991 B12R1.30 CC(SCCN)c1ccccc1 Amb17500453 [0,2,0,0,0,0|1,1,0]=4 7992 B12R1.30 CC(\C=C\CO)c1ccccc1 Amb33042867 [0,2,0,0,0,0|1,0,1]=4 7993 B12R1.30 CCCCC(=O)c1ccccc1 Amb4605998 [0,2,0,0,0,0|2,0,0]=4 7994 B12R1.30 CCCCC(N)c1ccccc1 Amb9717704 [0,2,0,0,0,0|2,0,0]=4 7995 B12R1.30 CCCCC(O)c1ccccc1 Amb4034459 [0,2,0,0,0,0|2,0,0]=4 7996 B12R1.30 CCCCC(S)c1ccccc1 Amb32788793 [0,2,0,0,0,0|2,0,0]=4 7997 B12R1.30 CCCCN(N)c1ccccc1 Amb17226670 [0,2,0,0,0,0|2,0,0]=4 7998 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb28555742 [0,2,0,0,0,0|2,0,0]=4 7999 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb33276169 [0,2,0,0,0,0|2,0,0]=4 8000 B12R1.30 CCCC[C@@H](O)c1ccccc1 Amb30627576 [0,2,0,0,0,0|2,0,0]=4 8001 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb28555741 [0,2,0,0,0,0|2,0,0]=4 8002 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb33276167 [0,2,0,0,0,0|2,0,0]=4 8003 B12R1.30 CCCC[C@H](O)c1ccccc1 Amb28555740 [0,2,0,0,0,0|2,0,0]=4 8004 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,2,0,0,0,0|2,0,0]=4 8005 B12R1.30 CCCNC(C)c1ccccc1 Amb6335367 [0,2,0,0,0,0|2,0,0]=4 8006 B12R1.30 CCCNC(C)c1ccccc1 Amb9726952 [0,2,0,0,0,0|2,0,0]=4 8007 B12R1.30 CCCOC(=O)c1ccccc1 Amb6357116 [0,2,0,0,0,0|1,0,0]=3 8008 B12R1.30 CCCOC(=O)c1cccnc1 Amb1958081 [0,2,0,0,0,0|2,0,0]=4 8009 B12R1.30 CCC\C=C(\N)c1ccccc1 Amb27965051 [0,2,0,0,0,0|2,0,0]=4 8010 B12R1.30 CCC\N=C(/C)c1ccccc1 Amb17779516 [0,2,0,0,0,0|2,0,0]=4 8011 B12R1.30 CCNCC(C)c1ccccc1 Amb6729198 [0,2,0,0,0,0|2,0,0]=4 8012 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,2,0,0,0,0|2,0,0]=4 8013 B12R1.30 CCNCC(O)c1ccccc1 Amb9247502 [0,2,0,0,0,0|2,0,0]=4 8014 B12R1.30 CCOCC(=O)c1ccccc1 Amb9666077 [0,2,0,0,0,0|2,0,0]=4 8015 B12R1.30 CCOCC(N)c1ccccc1 Amb1125200 [0,2,0,0,0,0|2,0,0]=4 8016 B12R1.30 CCOC[C@@H](N)c1ccccc1 Amb17061646 [0,2,0,0,0,0|2,0,0]=4 8017 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747248 [0,2,0,0,0,0|2,0,0]=4 8018 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747836 [0,2,0,0,0,0|2,0,0]=4 8019 B12R1.30 CCSCC(=O)c1ccccc1 Amb2778943 [0,2,0,0,0,0|2,0,0]=4 8020 B12R1.30 CN(CCC#N)c1ccccc1 Amb6357793 [0,2,0,0,0,0|2,0,0]=4 8021 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664174 [0,2,0,0,0,0|2,0,0]=4 8022 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664423 [0,2,0,0,0,0|2,0,0]=4 8023 B12R1.30 CN(CCCCl)c1ccccc1 Amb17335669 [0,2,0,0,0,0|2,0,0]=4 8024 B12R1.30 CN(CCCN)c1ccccc1 Amb2786601 [0,2,0,0,0,0|2,0,0]=4 8025 B12R1.30 CN(CCCO)c1ccccc1 Amb9246590 [0,2,0,0,0,0|1,0,0]=3 8026 B12R1.30 CN(CCON)c1ccccc1 Amb17104857 [0,2,0,0,0,0|1,0,0]=3 8027 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,2,0,0,0,0|2,0,0]=4 8028 B12R1.30 CNCCC(=O)c1ccccc1 Amb8390832 [0,2,0,0,0,0|2,0,0]=4 8029 B12R1.30 CNCCC(C)c1ccccc1 Amb5739286 [0,2,0,0,0,0|2,0,0]=4 8030 B12R1.30 CNCCC(Cl)c1ccccc1 Amb8629327 [0,2,0,0,0,0|2,0,0]=4 8031 B12R1.30 CNCCC(O)c1ccccc1 Amb3939363 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.30 CNCCN(C)c1ccccc1 Amb6715077 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.30 COCCC(=O)c1ccccc1 Amb33538573 [0,2,0,0,0,0|1,0,0]=3 8034 B12R1.30 COCCC(Cl)c1ccccc1 Amb32686938 [0,2,0,0,0,0|1,0,0]=3 8035 B12R1.30 COCCC(N)c1ccccc1 Amb34912740 [0,2,0,0,0,0|1,0,0]=3 8036 B12R1.30 COCCC(N)c1cccnc1 Amb19025773 [0,2,0,0,0,0|2,0,0]=4 8037 B12R1.30 COCCC(N)c1cccnc1 Amb29932235 [0,2,0,0,0,0|2,0,0]=4 8038 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,2,0,0,0,0|1,0,0]=3 8039 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33620965 [0,2,0,0,0,0|1,0,0]=3 8040 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33738637 [0,2,0,0,0,0|1,0,0]=3 8041 B12R1.30 CSCCC(=O)c1ccccc1 Amb32683163 [0,2,0,0,0,0|1,1,0]=4 8042 B12R1.30 C[C@@H](NCCCl)c1ccccc1 Amb30621967 [0,2,0,0,0,0|2,0,0]=4 8043 B12R1.30 C[C@@H](NCCO)c1ccccc1 Amb2721786 [0,2,0,0,0,0|1,0,0]=3 8044 B12R1.30 C[C@H](NCCO)c1ccccc1 Amb2698698 [0,2,0,0,0,0|1,0,0]=3 8045 B12R1.30 C[NH2+]CCC(O)c1ccccc1 Amb33513043 [0,2,0,0,0,0|2,0,0]=4 8046 B12R1.30 C\C(=C/CCBr)c1ccccc1 Amb17246875 [0,2,0,0,0,0|2,0,0]=4 8047 B12R1.30 C\C(=C/CCCl)c1ccccc1 Amb17233775 [0,2,0,0,0,0|2,0,0]=4 8048 B12R1.30 C\C(=C/CCN)c1ccccc1 Amb17232384 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.30 C\C(=C/CCO)c1ccccc1 Amb28421884 [0,2,0,0,0,0|1,0,0]=3 8050 B12R1.30 C\C(=C\CCN)c1ccccc1 Amb27453270 [0,2,0,0,0,0|2,0,0]=4 8051 B12R1.30 C\C(=C\CCO)c1ccccc1 Amb27840638 [0,2,0,0,0,0|1,0,0]=3 8052 B12R1.30 N#CCCC(=O)c1ccccc1 Amb1672449 [0,2,0,0,0,0|2,0,0]=4 8053 B12R1.30 N#CCCC(N)c1ccccc1 Amb26967002 [0,2,0,0,0,0|2,0,0]=4 8054 B12R1.30 N#CCCC(N)c1ccccc1 Amb30584969 [0,2,0,0,0,0|2,0,0]=4 8055 B12R1.30 N#CCCC(O)c1ccccc1 Amb17232364 [0,2,0,0,0,0|2,0,0]=4 8056 B12R1.30 N#CCOC(=O)c1ccccc1 Amb8384344 [0,2,0,0,0,0|1,0,1]=4 8057 B12R1.30 N=C(NCCO)c1ccccc1 Amb26974089 [0,2,0,0,0,0|1,0,0]=3 8058 B12R1.30 NC(CCCO)c1ccccc1 Amb9783958 [0,2,0,0,0,0|1,0,0]=3 8059 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.30 NCCCC(O)c1ccccc1 Amb17079154 [0,2,0,0,0,0|2,0,0]=4 8061 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,2,0,0,0,0|2,0,0]=4 8062 B12R1.30 NCCNC(=O)c1ccccc1 Amb302802 [0,2,0,0,0,0|2,0,0]=4 8063 B12R1.30 NCCNC(=O)c1ccccc1 Amb6662646 [0,2,0,0,0,0|2,0,0]=4 8064 B12R1.30 NCCOC(=O)c1ccccc1 Amb10807731 [0,2,0,0,0,0|1,0,0]=3 8065 B12R1.30 NCCSC(=O)c1ccccc1 Amb3987898 [0,2,0,0,0,0|1,1,0]=4 8066 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,2,0,0,0,0|1,0,0]=3 8067 B12R1.30 O=C(C#CCO)c1ccccc1 Amb22495841 [0,2,0,0,0,0|1,0,1]=4 8068 B12R1.30 O=C(CCCBr)c1ccccc1 Amb17247624 [0,2,0,0,0,0|2,0,0]=4 8069 B12R1.30 O=C(CCCCl)c1ccccc1 Amb1229841 [0,2,0,0,0,0|2,0,0]=4 8070 B12R1.30 O=C(CCCO)c1ccccc1 Amb17334609 [0,2,0,0,0,0|1,0,0]=3 8071 B12R1.30 O=C(NCCCl)c1ccccc1 Amb2414312 [0,2,0,0,0,0|2,0,0]=4 8072 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,2,0,0,0,0|2,0,0]=4 8073 B12R1.30 O=C(NCCO)c1ccccc1 Amb4318140 [0,2,0,0,0,0|1,0,0]=3 8074 B12R1.30 O=C(NCCO)c1ccccn1 Amb1951218 [0,2,0,0,0,0|2,0,0]=4 8075 B12R1.30 O=C(NCCO)c1cccnc1 Amb4061596 [0,2,0,0,0,0|2,0,0]=4 8076 B12R1.30 O=C(NCCO)c1ccncc1 Amb3939184 [0,2,0,0,0,0|2,0,0]=4 8077 B12R1.30 O=C(NCCS)c1ccccc1 Amb26616512 [0,2,0,0,0,0|1,1,0]=4 8078 B12R1.30 O=C(OCCCl)c1ccccc1 Amb385414 [0,2,0,0,0,0|1,0,0]=3 8079 B12R1.30 O=C(OCCO)c1ccccc1 Amb1110468 [0,2,0,0,0,0|0,0,0]=2 8080 B12R1.30 OC(CCCCl)c1ccccc1 Amb17194564 [0,2,0,0,0,0|2,0,0]=4 8081 B12R1.30 OCC#CC(O)c1ccccc1 Amb776273 [0,2,0,0,0,0|1,0,1]=4 8082 B12R1.30 OCCCC(O)c1ccccc1 Amb17334675 [0,2,0,0,0,0|1,0,0]=3 8083 B12R1.30 OCCCC(O)c1cccnc1 Amb17619700 [0,2,0,0,0,0|2,0,0]=4 8084 B12R1.30 OCC\C=C(\O)c1ccncc1 Amb27766556 [0,2,0,0,0,0|2,0,0]=4 8085 B12R1.30 OC\C=C/C(O)c1ccccc1 Amb30621777 [0,2,0,0,0,0|1,0,1]=4 8086 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,2,0,0,0,0|1,0,1]=4 8087 B12R1.30 OC\C=C\[C@H](O)c1ccccc1 Amb28244279 [0,2,0,0,0,0|1,0,1]=4 8088 B12R1.30 S=C(NCCCl)c1ccccc1 Amb28118876 [0,2,0,0,0,0|2,0,0]=4 8089 B12R1.30 [C-]#[N+]CCC(C)c1ccccc1 Amb33081599 [0,2,0,0,0,0|2,0,0]=4 8090 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,2,0,0,0,0|2,0,0]=4 8091 B12R1.34 C=C(C(=O)CO)c1ccccc1 Amb27175970 [0,2,0,0,0,0|1,0,1]=4 8092 B12R1.34 C=C(CO)C(=C)c1ccccc1 Amb27432138 [0,2,0,0,0,0|1,0,1]=4 8093 B12R1.34 C=C(c1ccccc1)C(O)CC Amb27431432 [0,2,0,0,0,0|2,0,0]=4 8094 B12R1.34 CC(C(=O)CO)c1ccccc1 Amb28250155 [0,2,0,0,0,0|1,0,1]=4 8095 B12R1.34 CC(CBr)C(C)c1ccccc1 Amb33081859 [0,2,0,0,0,0|2,0,0]=4 8096 B12R1.34 CC(CCl)C(=O)c1ccccc1 Amb4006275 [0,2,0,0,0,0|2,0,0]=4 8097 B12R1.34 CC(CCl)C(C)c1ccccc1 Amb27592178 [0,2,0,0,0,0|2,0,0]=4 8098 B12R1.34 CC(CN)C(C)c1ccccc1 Amb18829124 [0,2,0,0,0,0|2,0,0]=4 8099 B12R1.34 CC(CN)C(F)c1ccccc1 Amb28048144 [0,2,0,0,0,0|2,0,0]=4 8100 B12R1.34 CC(CN)C(N)c1ccccc1 Amb28066263 [0,2,0,0,0,0|2,0,0]=4 8101 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.34 CC(CN)N(C)c1ccccc1 Amb1128364 [0,2,0,0,0,0|2,0,0]=4 8103 B12R1.34 CC(CN)N(C)c1ccccc1 Amb13949221 [0,2,0,0,0,0|2,0,0]=4 8104 B12R1.34 CC(CO)C(=O)c1ccccc1 Amb8392341 [0,2,0,0,0,0|1,0,0]=3 8105 B12R1.34 CC(CO)C(C)c1ccccc1 Amb26375616 [0,2,0,0,0,0|1,0,0]=3 8106 B12R1.34 CC(CO)C(C)c1cccnc1 Amb33745857 [0,2,0,0,0,0|2,0,0]=4 8107 B12R1.34 CC(CO)C(O)c1ccccn1 Amb27835987 [0,2,0,0,0,0|2,0,0]=4 8108 B12R1.34 CC(CO)N(O)c1ccccc1 Amb28065271 [0,2,0,0,0,0|1,0,0]=3 8109 B12R1.34 CC(CO)[C@H](C)c1ccccc1 Amb28207416 [0,2,0,0,0,0|1,0,0]=3 8110 B12R1.34 CC(c1ccccc1)C(F)CN Amb33082393 [0,2,0,0,0,0|2,0,0]=4 8111 B12R1.34 CC(c1ccccc1)C(N)CN Amb18972125 [0,2,0,0,0,0|2,0,0]=4 8112 B12R1.34 CC(c1ccccc1)C(N)CN Amb33537059 [0,2,0,0,0,0|2,0,0]=4 8113 B12R1.34 CC(c1ccccc1)C(N)CO Amb18975503 [0,2,0,0,0,0|1,0,0]=3 8114 B12R1.34 CC(c1ccccc1)C(N)CO Amb19349648 [0,2,0,0,0,0|1,0,0]=3 8115 B12R1.34 CC(c1ccccc1)C(O)CBr Amb33081873 [0,2,0,0,0,0|2,0,0]=4 8116 B12R1.34 CC(c1ccccc1)C(O)CCl Amb33081872 [0,2,0,0,0,0|2,0,0]=4 8117 B12R1.34 CC(c1ccccc1)C(O)CF Amb27416766 [0,2,0,0,0,0|2,0,0]=4 8118 B12R1.34 CC(c1ccccc1)C(O)CN Amb17232553 [0,2,0,0,0,0|2,0,0]=4 8119 B12R1.34 CC(c1ccccc1)C(O)CO Amb26021855 [0,2,0,0,0,0|1,0,0]=3 8120 B12R1.34 CC(c1ccccc1)[C@@H](C)CN Amb33738459 [0,2,0,0,0,0|2,0,0]=4 8121 B12R1.34 CC(c1ccccc1)[C@@H](C)CO Amb33746406 [0,2,0,0,0,0|1,0,0]=3 8122 B12R1.34 CC(c1ccccc1)[C@@H](N)CO Amb33081836 [0,2,0,0,0,0|1,0,0]=3 8123 B12R1.34 CC(c1ccccc1)[C@@H](O)CN Amb33081825 [0,2,0,0,0,0|2,0,0]=4 8124 B12R1.34 CC(c1ccccc1)[C@H](C)CN Amb33746913 [0,2,0,0,0,0|2,0,0]=4 8125 B12R1.34 CC(c1ccccc1)[C@H](C)CO Amb33727265 [0,2,0,0,0,0|1,0,0]=3 8126 B12R1.34 CC(c1ccccc1)[C@H](N)CO Amb33081833 [0,2,0,0,0,0|1,0,0]=3 8127 B12R1.34 CC(c1ccccc1)[C@H](O)CN Amb33081831 [0,2,0,0,0,0|2,0,0]=4 8128 B12R1.34 CC(c1cccnc1)[C@@H](C)CO Amb33736432 [0,2,0,0,0,0|2,0,0]=4 8129 B12R1.34 CC(c1cccnc1)[C@H](C)CO Amb33743120 [0,2,0,0,0,0|2,0,0]=4 8130 B12R1.34 CCC(Br)C(=O)c1ccccc1 Amb6673863 [0,2,0,0,0,0|2,0,0]=4 8131 B12R1.34 CCC(C)C(=O)c1ccccc1 Amb8850439 [0,2,0,0,0,0|2,0,0]=4 8132 B12R1.34 CCC(C)C(N)c1ccccc1 Amb30628584 [0,2,0,0,0,0|2,0,0]=4 8133 B12R1.34 CCC(C)[C@H](N)c1ccccc1 Amb27430422 [0,2,0,0,0,0|2,0,0]=4 8134 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,2,0,0,0,0|2,0,0]=4 8135 B12R1.34 CCC(F)C(=O)c1ccccc1 Amb26600904 [0,2,0,0,0,0|2,0,0]=4 8136 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb17138555 [0,2,0,0,0,0|2,0,0]=4 8137 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,2,0,0,0,0|2,0,0]=4 8138 B12R1.34 CCC(N)C(C)c1ccccc1 Amb18829127 [0,2,0,0,0,0|2,0,0]=4 8139 B12R1.34 CCC(N)C(C)c1ccccc1 Amb20623710 [0,2,0,0,0,0|2,0,0]=4 8140 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,2,0,0,0,0|2,0,0]=4 8141 B12R1.34 CCC(N)C(O)c1ccccc1 Amb9428998 [0,2,0,0,0,0|2,0,0]=4 8142 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,2,0,0,0,0|2,0,0]=4 8143 B12R1.34 CCC(O)C(O)c1ccccc1 Amb27163573 [0,2,0,0,0,0|2,0,0]=4 8144 B12R1.34 CCC(O)[C@H](C)c1ccccc1 Amb27981671 [0,2,0,0,0,0|2,0,0]=4 8145 B12R1.34 CC[C@@H](C)[C@H](O)c1ccccc1 Amb28321457 [0,2,0,0,0,0|2,0,0]=4 8146 B12R1.34 CC[C@@H](N)C(C)c1ccccc1 Amb29867804 [0,2,0,0,0,0|2,0,0]=4 8147 B12R1.34 CC[C@@H](N)C(O)c1ccccc1 Amb35602701 [0,2,0,0,0,0|2,0,0]=4 8148 B12R1.34 CC[C@@H](N)[C@@H](O)c1ccccc1 Amb27760494 [0,2,0,0,0,0|2,0,0]=4 8149 B12R1.34 CC[C@@H](O)C(C)c1ccccc1 Amb29852038 [0,2,0,0,0,0|2,0,0]=4 8150 B12R1.34 CC[C@@H](O)[C@@H](C)c1ccccc1 Amb27766563 [0,2,0,0,0,0|2,0,0]=4 8151 B12R1.34 CC[C@@H](O)[C@@H](O)c1ccccc1 Amb28293390 [0,2,0,0,0,0|2,0,0]=4 8152 B12R1.34 CC[C@@H](O)[C@H](O)c1ccccc1 Amb27835137 [0,2,0,0,0,0|2,0,0]=4 8153 B12R1.34 CC[C@H](N)C(C)c1ccccc1 Amb29867785 [0,2,0,0,0,0|2,0,0]=4 8154 B12R1.34 CC[C@H](N)C(O)c1ccccc1 Amb35601261 [0,2,0,0,0,0|2,0,0]=4 8155 B12R1.34 CC[C@H](N)[C@H](O)c1ccccc1 Amb28121117 [0,2,0,0,0,0|2,0,0]=4 8156 B12R1.34 CC[C@H](O)C(C)c1ccccc1 Amb29852039 [0,2,0,0,0,0|2,0,0]=4 8157 B12R1.34 CC[C@H](O)[C@H](N)c1ccccc1 Amb28292456 [0,2,0,0,0,0|2,0,0]=4 8158 B12R1.34 CC[C@H](O)[C@H](O)c1ccccc1 Amb27835888 [0,2,0,0,0,0|2,0,0]=4 8159 B12R1.34 CN(C(=O)CO)c1ccccc1 Amb5798072 [0,2,0,0,0,0|1,0,1]=4 8160 B12R1.34 C[C@@H](CO)C(=O)c1ccccc1 Amb27599400 [0,2,0,0,0,0|1,0,0]=3 8161 B12R1.34 C[C@@H](CO)N(O)c1ccccc1 Amb28188881 [0,2,0,0,0,0|1,0,0]=3 8162 B12R1.34 C[C@@H](CO)[C@@H](C)c1ccccc1 Amb27178556 [0,2,0,0,0,0|1,0,0]=3 8163 B12R1.34 C[C@@H](NO)[C@@H](O)c1ccccc1 Amb27770879 [0,2,0,0,0,0|2,0,0]=4 8164 B12R1.34 C[C@@H](c1ccccc1)[C@@H](O)CO Amb27763660 [0,2,0,0,0,0|1,0,0]=3 8165 B12R1.34 C[C@@H](c1ccccc1)[C@H](F)CO Amb27770738 [0,2,0,0,0,0|1,0,0]=3 8166 B12R1.34 C[C@H](CO)C(N)c1ccccc1 Amb27614720 [0,2,0,0,0,0|1,0,0]=3 8167 B12R1.34 C[C@H](NO)[C@@H](O)c1ccccc1 Amb28242677 [0,2,0,0,0,0|2,0,0]=4 8168 B12R1.34 C[C@H](c1ccccc1)[C@H](F)CO Amb27766616 [0,2,0,0,0,0|1,0,0]=3 8169 B12R1.34 NC(CO)C(N)c1ccccc1 Amb27430428 [0,2,0,0,0,0|1,0,0]=3 8170 B12R1.34 NC(CO)C(O)c1ccccc1 Amb4034588 [0,2,0,0,0,0|1,0,0]=3 8171 B12R1.34 NC(CO)C(O)c1ccccn1 Amb25736521 [0,2,0,0,0,0|2,0,0]=4 8172 B12R1.34 NC(CO)C(O)c1ccccn1 Amb30584998 [0,2,0,0,0,0|2,0,0]=4 8173 B12R1.34 NC(CO)C(O)c1cccnc1 Amb18826621 [0,2,0,0,0,0|2,0,0]=4 8174 B12R1.34 NC(CO)C(O)c1cccnc1 Amb32655984 [0,2,0,0,0,0|2,0,0]=4 8175 B12R1.34 NC(CO)C(O)c1ccncc1 Amb26322233 [0,2,0,0,0,0|2,0,0]=4 8176 B12R1.34 NC(CO)C(O)c1ccncc1 Amb30584999 [0,2,0,0,0,0|2,0,0]=4 8177 B12R1.34 NC(c1ccccc1)C(O)CO Amb18646773 [0,2,0,0,0,0|1,0,0]=3 8178 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,2,0,0,0,0|2,0,0]=4 8179 B12R1.34 N[C@@H](CO)[C@@H](O)c1ccccc1 Amb6298328 [0,2,0,0,0,0|1,0,0]=3 8180 B12R1.34 N[C@H](CO)[C@@H](Cl)c1ccccc1 Amb27791780 [0,2,0,0,0,0|1,0,0]=3 8181 B12R1.34 N[C@H](CO)[C@H](O)c1ccccc1 Amb8515836 [0,2,0,0,0,0|1,0,0]=3 8182 B12R1.34 N[C@H](c1ccccc1)[C@H](O)CO Amb27430365 [0,2,0,0,0,0|1,0,0]=3 8183 B12R1.34 O=C(CO)C(=O)c1ccccc1 Amb27178026 [0,2,0,0,0,0|1,0,1]=4 8184 B12R1.34 O=C(CO)N(O)c1ccccc1 Amb27588913 [0,2,0,0,0,0|1,0,1]=4 8185 B12R1.34 O=C(c1ccccc1)C(Br)CCl Amb17351480 [0,2,0,0,0,0|2,0,0]=4 8186 B12R1.34 O=C(c1ccccc1)C(Cl)CCl Amb17337895 [0,2,0,0,0,0|2,0,0]=4 8187 B12R1.34 O=C(c1ccccc1)C(F)CCl Amb28396582 [0,2,0,0,0,0|2,0,0]=4 8188 B12R1.34 O=C(c1ccccc1)C(O)CO Amb27175820 [0,2,0,0,0,0|1,0,0]=3 8189 B12R1.34 O=C(c1ccccc1)[C@H](O)CO Amb27227037 [0,2,0,0,0,0|1,0,0]=3 8190 B12R1.34 OC(CCl)C(F)c1ccccc1 Amb28343186 [0,2,0,0,0,0|2,0,0]=4 8191 B12R1.34 OC(CF)C(F)c1ccccc1 Amb28127891 [0,2,0,0,0,0|2,0,0]=4 8192 B12R1.34 OC(c1ccccc1)C(Cl)CCl Amb27623177 [0,2,0,0,0,0|2,0,0]=4 8193 B12R1.34 OCC(Br)C(Br)c1ccccc1 Amb27393982 [0,2,0,0,0,0|1,0,0]=3 8194 B12R1.34 OC[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27983838 [0,2,0,0,0,0|1,0,0]=3 8195 B12R1.34 OC[C@@H](O)[C@@H](O)c1ccccc1 Amb28244272 [0,2,0,0,0,0|1,0,0]=3 8196 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,2,0,0,0,0|1,0,0]=3 8197 B12R1.34 OC[C@H](O)[C@H](Cl)c1ccccc1 Amb27231781 [0,2,0,0,0,0|1,0,0]=3 8198 B12R1.34 OC\C(F)=C(\F)c1ccccc1 Amb27426618 [0,2,0,0,0,0|1,0,1]=4 8199 B12R1.34 O[C@@H](CCl)[C@@H](F)c1ccccc1 Amb28343033 [0,2,0,0,0,0|2,0,0]=4 8200 B12R1.34 O[C@@H](CF)[C@H](F)c1ccccc1 Amb27255180 [0,2,0,0,0,0|2,0,0]=4 8201 B12R1.34 O[C@H](CCl)[C@H](O)c1ccccc1 Amb27657548 [0,2,0,0,0,0|2,0,0]=4 8202 B12R1.34 [NH3+]C(CO)C(O)c1ccccc1 Amb33513059 [0,2,0,0,0,0|1,0,0]=3 8203 B12R1.39 B[P](C)(CCO)c1ccccc1 Amb27770875 [0,2,0,0,0,0|1,0,0]=3 8204 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,2,0,0,0,0|2,0,0]=4 8205 B12R1.39 CC(C)(CCCl)c1ccccc1 Amb27425237 [0,2,0,0,0,0|2,0,0]=4 8206 B12R1.39 CC(C)(CCN)c1ccccc1 Amb6740021 [0,2,0,0,0,0|2,0,0]=4 8207 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,2,0,0,0,0|1,0,0]=3 8208 B12R1.39 CC(C)(CCO)c1ccncc1 Amb27456693 [0,2,0,0,0,0|2,0,0]=4 8209 B12R1.39 CC(C)(CCS)c1ccccc1 Amb33176152 [0,2,0,0,0,0|1,1,0]=4 8210 B12R1.39 CC(C)(CNO)c1ccccc1 Amb33475500 [0,2,0,0,0,0|2,0,0]=4 8211 B12R1.39 CC(N)(CCF)c1ccccc1 Amb35711305 [0,2,0,0,0,0|2,0,0]=4 8212 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,2,0,0,0,0|1,0,0]=3 8213 B12R1.39 CC(O)(CCN)c1ccccc1 Amb17594116 [0,2,0,0,0,0|2,0,0]=4 8214 B12R1.39 CCCC(C)(C)c1ccccc1 Amb27231101 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.39 CCCC(C)(N)c1ccccc1 Amb9676775 [0,2,0,0,0,0|2,0,0]=4 8216 B12R1.39 CCCC(C)(O)c1ccccc1 Amb4019246 [0,2,0,0,0,0|2,0,0]=4 8217 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,2,0,0,0,0|1,1,0]=4 8218 B12R1.39 C[C@@](O)(CCO)c1ccccc1 Amb27179357 [0,2,0,0,0,0|1,0,0]=3 8219 B12R1.39 C[Si](C)(CCN)c1ccccc1 Amb27480080 [0,2,0,0,0,0|2,0,0]=4 8220 B12R1.39 FC(F)(CCBr)c1ccccc1 Amb33082218 [0,2,0,0,0,0|2,0,0]=4 8221 B12R1.39 FC(F)(CCCl)c1ccccc1 Amb27222842 [0,2,0,0,0,0|2,0,0]=4 8222 B12R1.39 FC(F)(CCS)c1ccccc1 Amb33082515 [0,2,0,0,0,0|1,1,0]=4 8223 B12R1.39 N=S(=O)(CCO)c1ccccc1 Amb27433169 [0,2,0,0,0,0|0,1,0]=3 8224 B12R1.39 NCCC(F)(F)c1ccccc1 Amb27249550 [0,2,0,0,0,0|2,0,0]=4 8225 B12R1.39 NCCP(=O)(O)c1ccccc1 Amb28343056 [0,2,0,0,0,0|2,0,0]=4 8226 B12R1.39 NCCS(=O)(=O)c1ccccc1 Amb5716090 [0,2,0,0,0,0|1,1,0]=4 8227 B12R1.39 NCCS(=O)(=O)c1ccccc1 Amb5742909 [0,2,0,0,0,0|1,1,0]=4 8228 B12R1.39 N[C@@](O)(CCO)c1ccccc1 Amb28064120 [0,2,0,0,0,0|1,0,0]=3 8229 B12R1.39 O=S(=O)(CCBr)c1ccccc1 Amb17106167 [0,2,0,0,0,0|1,1,0]=4 8230 B12R1.39 O=S(=O)(CCCl)c1ccccc1 Amb1034876 [0,2,0,0,0,0|1,1,0]=4 8231 B12R1.39 O=S(=O)(CCO)c1ccccn1 Amb27632652 [0,2,0,0,0,0|1,1,0]=4 8232 B12R1.39 O=S(=O)(CCO)c1ccncc1 Amb32657434 [0,2,0,0,0,0|1,1,0]=4 8233 B12R1.39 OCCC(F)(F)c1ccccc1 Amb27653210 [0,2,0,0,0,0|1,0,0]=3 8234 B12R1.39 OCCC(F)(F)c1ccccn1 Amb32814239 [0,2,0,0,0,0|2,0,0]=4 8235 B12R1.39 OCCC(F)(F)c1cccnc1 Amb33337730 [0,2,0,0,0,0|2,0,0]=4 8236 B12R1.39 OCCC(F)(F)c1ccncc1 Amb33218130 [0,2,0,0,0,0|2,0,0]=4 8237 B12R1.39 ONCC(F)(F)c1ccccc1 Amb33081926 [0,2,0,0,0,0|2,0,0]=4 8238 B12R1.107 C=C(CC(C)O)c1ccccc1 Amb27486292 [0,2,0,0,0,0|1,0,0]=3 8239 B12R1.107 CC(Br)CC(Br)c1ccccc1 Amb27267411 [0,2,0,0,0,0|2,0,0]=4 8240 B12R1.107 CC(Br)CC(C)c1ccccc1 Amb25273655 [0,2,0,0,0,0|2,0,0]=4 8241 B12R1.107 CC(C)CC(=O)c1ccccc1 Amb4017884 [0,2,0,0,0,0|2,0,0]=4 8242 B12R1.107 CC(C)CC(N)c1ccccc1 Amb6892355 [0,2,0,0,0,0|2,0,0]=4 8243 B12R1.107 CC(C)CC(N)c1ccccc1 Amb9703509 [0,2,0,0,0,0|2,0,0]=4 8244 B12R1.107 CC(C)CC(O)c1ccccc1 Amb1110402 [0,2,0,0,0,0|2,0,0]=4 8245 B12R1.107 CC(C)CC(S)c1ccccc1 Amb7784758 [0,2,0,0,0,0|2,0,0]=4 8246 B12R1.107 CC(C)CN(C)c1ccccc1 Amb17232437 [0,2,0,0,0,0|2,0,0]=4 8247 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,2,0,0,0,0|2,0,0]=4 8248 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb27175567 [0,2,0,0,0,0|2,0,0]=4 8249 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,2,0,0,0,0|2,0,0]=4 8250 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb27249677 [0,2,0,0,0,0|2,0,0]=4 8251 B12R1.107 CC(CC(=O)O)c1ccccc1 Amb1207393 [0,2,0,0,0,0|1,0,1]=4 8252 B12R1.107 CC(CN(C)O)c1ccccc1 Amb33081590 [0,2,0,0,0,0|2,0,0]=4 8253 B12R1.107 CC(C[C@@H](C)N)c1ccccc1 Amb33081852 [0,2,0,0,0,0|2,0,0]=4 8254 B12R1.107 CC(C[C@@H](C)O)c1ccccc1 Amb28207302 [0,2,0,0,0,0|1,0,0]=3 8255 B12R1.107 CC(C[C@H](C)N)c1ccccc1 Amb33081854 [0,2,0,0,0,0|2,0,0]=4 8256 B12R1.107 CC(C[C@H](C)O)c1ccccc1 Amb33081855 [0,2,0,0,0,0|1,0,0]=3 8257 B12R1.107 CC(Cl)CC(=O)c1ccccc1 Amb28042789 [0,2,0,0,0,0|2,0,0]=4 8258 B12R1.107 CC(Cl)CC(C)c1ccccc1 Amb27175543 [0,2,0,0,0,0|2,0,0]=4 8259 B12R1.107 CC(Cl)CC(Cl)c1ccccc1 Amb28068688 [0,2,0,0,0,0|2,0,0]=4 8260 B12R1.107 CC(Cl)CC(O)c1ccccc1 Amb27865488 [0,2,0,0,0,0|2,0,0]=4 8261 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,2,0,0,0,0|2,0,0]=4 8262 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.107 CC(N)CC(C)c1ccccc1 Amb27831891 [0,2,0,0,0,0|2,0,0]=4 8264 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,2,0,0,0,0|2,0,0]=4 8265 B12R1.107 CC(N)CN(C)c1ccccc1 Amb10610213 [0,2,0,0,0,0|2,0,0]=4 8266 B12R1.107 CC(N)CN(C)c1ccccc1 Amb1137929 [0,2,0,0,0,0|2,0,0]=4 8267 B12R1.107 CC(N)CS(=O)c1ccccc1 Amb27165944 [0,2,0,0,0,0|1,1,0]=4 8268 B12R1.107 CC(O)CC(=O)c1ccccc1 Amb27177964 [0,2,0,0,0,0|1,0,0]=3 8269 B12R1.107 CC(O)CC(C)c1ccccc1 Amb27651998 [0,2,0,0,0,0|1,0,0]=3 8270 B12R1.107 CC(O)CC(F)c1ccccc1 Amb27588281 [0,2,0,0,0,0|1,0,0]=3 8271 B12R1.107 CC(O)CC(O)c1ccccc1 Amb1110547 [0,2,0,0,0,0|1,0,0]=3 8272 B12R1.107 CC(O)CN(C)c1ccccc1 Amb17138595 [0,2,0,0,0,0|1,0,0]=3 8273 B12R1.107 CC(O)CP(C)c1ccccc1 Amb27615506 [0,2,0,0,0,0|1,0,0]=3 8274 B12R1.107 CC(O)C[C@@H](O)c1ccccc1 Amb27748936 [0,2,0,0,0,0|1,0,0]=3 8275 B12R1.107 CC(O)NC(=S)c1ccccc1 Amb27623264 [0,2,0,0,0,0|2,0,0]=4 8276 B12R1.107 CC(O)OC(C)c1ccccc1 Amb28455545 [0,2,0,0,0,0|2,0,0]=4 8277 B12R1.107 CC(O)\C=C(\Cl)c1ccccc1 Amb27451951 [0,2,0,0,0,0|1,0,1]=4 8278 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb10610413 [0,2,0,0,0,0|1,0,1]=4 8279 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb4598567 [0,2,0,0,0,0|1,0,1]=4 8280 B12R1.107 CN(CC(F)Cl)c1ccccc1 Amb28118828 [0,2,0,0,0,0|2,0,0]=4 8281 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 Amb10844379 [0,2,0,0,0,0|1,0,1]=4 8282 B12R1.107 C[C@@H](Cl)C[C@@H](Cl)c1ccccc1 Amb28202622 [0,2,0,0,0,0|2,0,0]=4 8283 B12R1.107 C[C@@H](N)C[C@@H](O)c1ccccc1 Amb27592173 [0,2,0,0,0,0|2,0,0]=4 8284 B12R1.107 C[C@@H](O)C[C@@H](C)c1ccccc1 Amb27457680 [0,2,0,0,0,0|1,0,0]=3 8285 B12R1.107 C[C@@H](O)C[C@@H](S)c1ccccc1 Amb27218944 [0,2,0,0,0,0|1,0,0]=3 8286 B12R1.107 C[C@H](CC(=O)O)c1ccccc1 Amb10844340 [0,2,0,0,0,0|1,0,1]=4 8287 B12R1.107 C[C@H](N)CN(C)c1ccccc1 Amb5782045 [0,2,0,0,0,0|2,0,0]=4 8288 B12R1.107 C[C@H](N)C[C@H](O)c1ccccc1 Amb27217333 [0,2,0,0,0,0|2,0,0]=4 8289 B12R1.107 C[C@H](O)CC(=O)c1ccccc1 Amb27178049 [0,2,0,0,0,0|1,0,0]=3 8290 B12R1.107 C[C@H](O)CN(C)c1ccccc1 Amb27615291 [0,2,0,0,0,0|1,0,0]=3 8291 B12R1.107 C[C@H](O)CN(C)c1ccncc1 Amb27458447 [0,2,0,0,0,0|2,0,0]=4 8292 B12R1.107 C[C@H](O)C[C@H](N)c1ccccc1 Amb27646110 [0,2,0,0,0,0|1,0,0]=3 8293 B12R1.107 C\C(=C\[C@H](C)O)c1ccccc1 Amb27650888 [0,2,0,0,0,0|1,0,1]=4 8294 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb8566722 [0,2,0,0,0,0|1,0,1]=4 8295 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb9730098 [0,2,0,0,0,0|1,0,1]=4 8296 B12R1.107 NC(CC(F)F)c1ccccc1 Amb18802187 [0,2,0,0,0,0|2,0,0]=4 8297 B12R1.107 NC(CC(F)F)c1ccccc1 Amb28872389 [0,2,0,0,0,0|2,0,0]=4 8298 B12R1.107 NN(CC(=O)O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|1,0,1]=4 8299 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8384247 [0,2,0,0,0,0|1,0,1]=4 8300 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8396895 [0,2,0,0,0,0|1,0,1]=4 8301 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb4296884 [0,2,0,0,0,0|1,0,1]=4 8302 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb6365358 [0,2,0,0,0,0|1,0,1]=4 8303 B12R1.107 O=C(CC(F)Cl)c1ccccc1 Amb27637711 [0,2,0,0,0,0|2,0,0]=4 8304 B12R1.107 O=C(O)CC(=S)c1ccccc1 Amb27433886 [0,2,0,0,0,0|1,0,1]=4 8305 B12R1.107 O=C(O)CC(Br)c1ccccc1 Amb2721208 [0,2,0,0,0,0|1,0,1]=4 8306 B12R1.107 O=C(O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|1,0,1]=4 8307 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [0,2,0,0,0,0|1,0,1]=4 8308 B12R1.107 O=C(O)CN(Cl)c1ccccc1 Amb27984830 [0,2,0,0,0,0|1,0,1]=4 8309 B12R1.107 O=C(O)CN(O)c1ccccc1 Amb27984844 [0,2,0,0,0,0|1,0,1]=4 8310 B12R1.107 O=C(O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|0,1,1]=4 8311 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [0,2,0,0,0,0|1,0,1]=4 8312 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [0,2,0,0,0,0|1,0,1]=4 8313 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [0,2,0,0,0,0|2,0,0]=4 8314 B12R1.308 C=C(CCN)c1ccccc1Br Amb33388000 [0,2,0,0,0,0|2,0,0]=4 8315 B12R1.308 C=C(CCN)c1ccccc1C Amb33362533 [0,2,0,0,0,0|2,0,0]=4 8316 B12R1.308 C=C(CCN)c1ccccc1Cl Amb33052606 [0,2,0,0,0,0|2,0,0]=4 8317 B12R1.308 C=C(CCN)c1ccccc1F Amb33361195 [0,2,0,0,0,0|2,0,0]=4 8318 B12R1.308 C=C(CCN)c1ccccc1O Amb33195783 [0,2,0,0,0,0|2,0,0]=4 8319 B12R1.308 C=C(CCO)c1ccccc1F Amb27980568 [0,2,0,0,0,0|1,0,0]=3 8320 B12R1.308 CC(CCN)c1ccccc1Br Amb33387586 [0,2,0,0,0,0|2,0,0]=4 8321 B12R1.308 CC(CCN)c1ccccc1Cl Amb17234048 [0,2,0,0,0,0|2,0,0]=4 8322 B12R1.308 CC(CCN)c1ccccc1F Amb17232646 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.308 CC(CCO)c1ccccc1Cl Amb17234164 [0,2,0,0,0,0|1,0,0]=3 8325 B12R1.308 CC(CCO)c1ccccc1F Amb17232671 [0,2,0,0,0,0|1,0,0]=3 8326 B12R1.308 CC(CCO)c1ccccc1N Amb28196373 [0,2,0,0,0,0|1,0,0]=3 8327 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,2,0,0,0,0|2,0,0]=4 8328 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,2,0,0,0,0|2,0,0]=4 8329 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,2,0,0,0,0|2,0,0]=4 8330 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,2,0,0,0,0|2,0,0]=4 8331 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,2,0,0,0,0|2,0,0]=4 8332 B12R1.308 CCCC(=O)c1ccccc1O Amb8629040 [0,2,0,0,0,0|2,0,0]=4 8333 B12R1.308 CCCC(C)c1ccccc1C Amb27244850 [0,2,0,0,0,0|2,0,0]=4 8334 B12R1.308 CCCC(C)c1ccccc1O Amb3939443 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.308 CCCC(Cl)c1ccccc1Cl Amb27808095 [0,2,0,0,0,0|2,0,0]=4 8336 B12R1.308 CCCC(N)c1ccccc1Br Amb27815075 [0,2,0,0,0,0|2,0,0]=4 8337 B12R1.308 CCCC(N)c1ccccc1C Amb17232446 [0,2,0,0,0,0|2,0,0]=4 8338 B12R1.308 CCCC(N)c1ccccc1C Amb32662363 [0,2,0,0,0,0|2,0,0]=4 8339 B12R1.308 CCCC(N)c1ccccc1Cl Amb17234047 [0,2,0,0,0,0|2,0,0]=4 8340 B12R1.308 CCCC(N)c1ccccc1F Amb17232645 [0,2,0,0,0,0|2,0,0]=4 8341 B12R1.308 CCCC(N)c1ccccc1F Amb30982461 [0,2,0,0,0,0|2,0,0]=4 8342 B12R1.308 CCCC(O)c1ccccc1C Amb17232483 [0,2,0,0,0,0|2,0,0]=4 8343 B12R1.308 CCCC(O)c1ccccc1Cl Amb17234154 [0,2,0,0,0,0|2,0,0]=4 8344 B12R1.308 CCCC(O)c1ccccc1F Amb17232666 [0,2,0,0,0,0|2,0,0]=4 8345 B12R1.308 CCCN(C)c1ccccc1N Amb8898676 [0,2,0,0,0,0|2,0,0]=4 8346 B12R1.308 CCC[C@@H](N)c1ccccc1C Amb27391198 [0,2,0,0,0,0|2,0,0]=4 8347 B12R1.308 CCC[C@@H](N)c1ccccc1Cl Amb27196196 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.308 CCC[C@@H](O)c1ccccc1F Amb28064219 [0,2,0,0,0,0|2,0,0]=4 8349 B12R1.308 CCC[C@H](N)c1ccccc1C Amb26841003 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.308 CCC[C@H](N)c1ccccc1F Amb27830664 [0,2,0,0,0,0|2,0,0]=4 8351 B12R1.308 CCC[C@H](N)c1ccccc1I Amb28401584 [0,2,0,0,0,0|2,0,0]=4 8352 B12R1.308 CCC[C@H](N)c1ccccc1O Amb28072846 [0,2,0,0,0,0|2,0,0]=4 8353 B12R1.308 CCC[C@H](N)c1ccccc1S Amb27816971 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.308 CCC[C@H](O)c1ccccc1Br Amb27661408 [0,2,0,0,0,0|2,0,0]=4 8355 B12R1.308 CCC[C@H](O)c1ccccc1Cl Amb28381799 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.308 CN(CCCl)c1ccccc1Br Amb17351919 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.308 CN(CCCl)c1ccccc1Cl Amb17338055 [0,2,0,0,0,0|2,0,0]=4 8358 B12R1.308 CN(CCCl)c1ccccc1F Amb17335951 [0,2,0,0,0,0|2,0,0]=4 8359 B12R1.308 CN(CCCl)c1ccccc1N Amb27863533 [0,2,0,0,0,0|2,0,0]=4 8360 B12R1.308 CN(CCF)c1ccccc1O Amb27853039 [0,2,0,0,0,0|2,0,0]=4 8361 B12R1.308 CN(CCI)c1ccccc1O Amb28078731 [0,2,0,0,0,0|2,0,0]=4 8362 B12R1.308 CN(CCN)c1ccccc1Br Amb17059772 [0,2,0,0,0,0|2,0,0]=4 8363 B12R1.308 CN(CCN)c1ccccc1Cl Amb17059645 [0,2,0,0,0,0|2,0,0]=4 8364 B12R1.308 CN(CCN)c1ccccc1F Amb17059642 [0,2,0,0,0,0|2,0,0]=4 8365 B12R1.308 CN(CCO)c1ccccc1Br Amb17344451 [0,2,0,0,0,0|1,0,0]=3 8366 B12R1.308 CN(CCO)c1ccccc1Cl Amb17335810 [0,2,0,0,0,0|1,0,0]=3 8367 B12R1.308 CN(CCO)c1ccccc1F Amb17334763 [0,2,0,0,0,0|1,0,0]=3 8368 B12R1.308 CN(CCO)c1ccccc1N Amb8997333 [0,2,0,0,0,0|1,0,0]=3 8369 B12R1.308 CN(CCO)c1ccccc1O Amb27256043 [0,2,0,0,0,0|1,0,0]=3 8370 B12R1.308 CN(CCO)c1cccnc1N Amb27666826 [0,2,0,0,0,0|2,0,0]=4 8371 B12R1.308 CN(CCO)c1ccncc1F Amb30020354 [0,2,0,0,0,0|2,0,0]=4 8372 B12R1.308 CN(CCO)c1ncccc1Br Amb25215188 [0,2,0,0,0,0|2,0,0]=4 8373 B12R1.308 CN(CCO)c1ncccc1N Amb8858230 [0,2,0,0,0,0|2,0,0]=4 8374 B12R1.308 C\C(=C/CO)c1ccccc1Cl Amb27416537 [0,2,0,0,0,0|1,0,1]=4 8375 B12R1.308 C\C(=C/CO)c1ccccc1O Amb27749760 [0,2,0,0,0,0|1,0,1]=4 8376 B12R1.308 Cc1ccccc1C(=O)CCBr Amb28119109 [0,2,0,0,0,0|2,0,0]=4 8377 B12R1.308 Cc1ccccc1C(=O)CCN Amb25062867 [0,2,0,0,0,0|2,0,0]=4 8378 B12R1.308 Cc1ccccc1C(=O)CCO Amb26555785 [0,2,0,0,0,0|1,0,0]=3 8379 B12R1.308 Cc1ccccc1C(C)CCN Amb17232447 [0,2,0,0,0,0|2,0,0]=4 8380 B12R1.308 Cc1ccccc1C(C)CCO Amb17232499 [0,2,0,0,0,0|1,0,0]=3 8381 B12R1.308 Cc1ccccc1C(F)CCN Amb25894968 [0,2,0,0,0,0|2,0,0]=4 8382 B12R1.308 Cc1ccccc1C(N)CCO Amb17103953 [0,2,0,0,0,0|1,0,0]=3 8383 B12R1.308 Cc1ccccc1C(O)CCN Amb17232539 [0,2,0,0,0,0|2,0,0]=4 8384 B12R1.308 Cc1ccccc1C(O)CCO Amb28195046 [0,2,0,0,0,0|1,0,0]=3 8385 B12R1.308 Cc1ccccc1C(O)CNO Amb17334702 [0,2,0,0,0,0|2,0,0]=4 8386 B12R1.308 Cc1ccccc1N(C)CCCl Amb17335670 [0,2,0,0,0,0|2,0,0]=4 8387 B12R1.308 Cc1ccccc1N(C)CCN Amb17059640 [0,2,0,0,0,0|2,0,0]=4 8388 B12R1.308 Cc1ccccc1N(C)CCO Amb17334643 [0,2,0,0,0,0|1,0,0]=3 8389 B12R1.308 Cc1ccccc1[C@@H](C)CCO Amb27981985 [0,2,0,0,0,0|1,0,0]=3 8390 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,2,0,0,0,0|1,0,0]=3 8391 B12R1.308 Cc1ccccc1[C@@H](O)CCN Amb33360572 [0,2,0,0,0,0|2,0,0]=4 8392 B12R1.308 Cc1ccccc1[C@H](N)CCO Amb27221061 [0,2,0,0,0,0|1,0,0]=3 8393 B12R1.308 Cc1ccccc1[C@H](O)CCN Amb33360573 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.308 Cc1cccnc1C(N)CCO Amb24488620 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.308 Cc1ccncc1C(N)CCO Amb28043162 [0,2,0,0,0,0|2,0,0]=4 8396 B12R1.308 Cc1ccncc1C(O)CCO Amb27860170 [0,2,0,0,0,0|2,0,0]=4 8397 B12R1.308 Cc1cnccc1C(N)CCO Amb27817450 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.308 Cc1cnccc1N(C)CCO Amb27978776 [0,2,0,0,0,0|2,0,0]=4 8399 B12R1.308 Cc1cnccc1[C@H](N)CCO Amb27437097 [0,2,0,0,0,0|2,0,0]=4 8400 B12R1.308 Cc1ncccc1C(N)CCO Amb27831972 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,2,0,0,0,0|1,0,0]=3 8402 B12R1.308 NC(CCO)c1ccccc1Cl Amb1993960 [0,2,0,0,0,0|1,0,0]=3 8403 B12R1.308 NC(CCO)c1ccccc1F Amb2408130 [0,2,0,0,0,0|1,0,0]=3 8404 B12R1.308 NC(CCO)c1ccccc1F Amb32664424 [0,2,0,0,0,0|1,0,0]=3 8405 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,2,0,0,0,0|1,0,0]=3 8406 B12R1.308 NC(CCO)c1cccnc1Br Amb24461552 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.308 NC(CCO)c1cccnc1Cl Amb22296967 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.308 NC(CCO)c1cccnc1F Amb26918437 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.308 NC(CCO)c1ccncc1Br Amb25212924 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.308 NC(CCO)c1ccncc1Cl Amb24655939 [0,2,0,0,0,0|2,0,0]=4 8411 B12R1.308 NC(CCO)c1ccncc1F Amb26958502 [0,2,0,0,0,0|2,0,0]=4 8412 B12R1.308 NC(CCO)c1ccncc1O Amb27596116 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.308 NC(CCO)c1cnccc1Cl Amb28314170 [0,2,0,0,0,0|2,0,0]=4 8414 B12R1.308 NC(CCO)c1cnccc1O Amb27411794 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.308 NC(CCO)c1ncccc1Br Amb25244942 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.308 NC(CCO)c1ncccc1F Amb27756387 [0,2,0,0,0,0|2,0,0]=4 8417 B12R1.308 NCCC(=O)c1ccccc1Br Amb33389465 [0,2,0,0,0,0|2,0,0]=4 8418 B12R1.308 NCCC(=O)c1ccccc1Cl Amb25709180 [0,2,0,0,0,0|2,0,0]=4 8419 B12R1.308 NCCC(=O)c1ccccc1Cl Amb32674762 [0,2,0,0,0,0|2,0,0]=4 8420 B12R1.308 NCCC(=O)c1ccccc1F Amb27881481 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.308 NCCC(=O)c1ccccc1N Amb21855941 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.308 NCCC(=O)c1ccccc1N Amb28555772 [0,2,0,0,0,0|2,0,0]=4 8423 B12R1.308 NCCC(=O)c1ccccc1N Amb32652605 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.308 NCCC(=O)c1ccccc1O Amb24346596 [0,2,0,0,0,0|2,0,0]=4 8425 B12R1.308 NCCC(F)c1ccccc1Br Amb25996777 [0,2,0,0,0,0|2,0,0]=4 8426 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,2,0,0,0,0|2,0,0]=4 8427 B12R1.308 NCCC(F)c1ccccc1F Amb25894969 [0,2,0,0,0,0|2,0,0]=4 8428 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.308 NCCC(N)c1ccccc1I Amb27788534 [0,2,0,0,0,0|2,0,0]=4 8430 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,2,0,0,0,0|2,0,0]=4 8431 B12R1.308 NCCC(O)c1ccccc1Cl Amb17234259 [0,2,0,0,0,0|2,0,0]=4 8432 B12R1.308 NCCC(O)c1ccccc1F Amb17232696 [0,2,0,0,0,0|2,0,0]=4 8433 B12R1.308 NCCC(O)c1ccccc1N Amb28249964 [0,2,0,0,0,0|2,0,0]=4 8434 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,2,0,0,0,0|2,0,0]=4 8435 B12R1.308 NCCS(=O)c1ccccc1F Amb18974522 [0,2,0,0,0,0|1,1,0]=4 8436 B12R1.308 NCCS(=O)c1ccccc1F Amb19373859 [0,2,0,0,0,0|1,1,0]=4 8437 B12R1.308 NCCS(=O)c1ccccc1O Amb27208586 [0,2,0,0,0,0|1,1,0]=4 8438 B12R1.308 NCC[C@@H](N)c1ccccc1Cl Amb27205254 [0,2,0,0,0,0|2,0,0]=4 8439 B12R1.308 NCC[C@@H](N)c1ccccc1I Amb27204878 [0,2,0,0,0,0|2,0,0]=4 8440 B12R1.308 NCC[C@@H](O)c1ccccc1Br Amb33387618 [0,2,0,0,0,0|2,0,0]=4 8441 B12R1.308 NCC[C@@H](O)c1ccccc1Cl Amb33052581 [0,2,0,0,0,0|2,0,0]=4 8442 B12R1.308 NCC[C@@H](O)c1ccccc1F Amb33361507 [0,2,0,0,0,0|2,0,0]=4 8443 B12R1.308 NCC[C@@H](O)c1ccccc1O Amb33196477 [0,2,0,0,0,0|2,0,0]=4 8444 B12R1.308 NCC[C@H](O)c1ccccc1Br Amb33387621 [0,2,0,0,0,0|2,0,0]=4 8445 B12R1.308 NCC[C@H](O)c1ccccc1Cl Amb33052779 [0,2,0,0,0,0|2,0,0]=4 8446 B12R1.308 NCC[C@H](O)c1ccccc1F Amb33361910 [0,2,0,0,0,0|2,0,0]=4 8447 B12R1.308 NCC[C@H](O)c1ccccc1O Amb33196476 [0,2,0,0,0,0|2,0,0]=4 8448 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,2,0,0,0,0|1,0,0]=3 8449 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,2,0,0,0,0|1,0,0]=3 8450 B12R1.308 N[C@@H](CCO)c1ccccc1F Amb27468716 [0,2,0,0,0,0|1,0,0]=3 8451 B12R1.308 N[C@@H](CCO)c1ccccc1I Amb27851414 [0,2,0,0,0,0|1,0,0]=3 8452 B12R1.308 N[C@@H](CCO)c1ccccc1O Amb28345683 [0,2,0,0,0,0|1,0,0]=3 8453 B12R1.308 N[C@@H](CCO)c1cccnc1Br Amb27864944 [0,2,0,0,0,0|2,0,0]=4 8454 B12R1.308 N[C@@H](CCO)c1cccnc1Cl Amb28344522 [0,2,0,0,0,0|2,0,0]=4 8455 B12R1.308 N[C@@H](CCO)c1cccnc1O Amb28057750 [0,2,0,0,0,0|2,0,0]=4 8456 B12R1.308 N[C@@H](CCO)c1cccnc1S Amb27590308 [0,2,0,0,0,0|2,0,0]=4 8457 B12R1.308 N[C@@H](CCO)c1ccncc1Cl Amb26471936 [0,2,0,0,0,0|2,0,0]=4 8458 B12R1.308 N[C@@H](CCO)c1ccncc1F Amb24423142 [0,2,0,0,0,0|2,0,0]=4 8459 B12R1.308 N[C@@H](CCO)c1ccncc1O Amb27655648 [0,2,0,0,0,0|2,0,0]=4 8460 B12R1.308 N[C@@H](CCO)c1cnccc1Br Amb27770052 [0,2,0,0,0,0|2,0,0]=4 8461 B12R1.308 N[C@@H](CCO)c1ncccc1Br Amb27801074 [0,2,0,0,0,0|2,0,0]=4 8462 B12R1.308 N[C@@H](CCO)c1ncccc1Cl Amb27391603 [0,2,0,0,0,0|2,0,0]=4 8463 B12R1.308 N[C@@H](CCO)c1ncccc1O Amb27970375 [0,2,0,0,0,0|2,0,0]=4 8464 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,2,0,0,0,0|1,0,0]=3 8465 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,2,0,0,0,0|1,0,0]=3 8466 B12R1.308 N[C@H](CCO)c1ccccc1F Amb25970063 [0,2,0,0,0,0|1,0,0]=3 8467 B12R1.308 N[C@H](CCO)c1ccccc1I Amb27411983 [0,2,0,0,0,0|1,0,0]=3 8468 B12R1.308 N[C@H](CCO)c1cccnc1Br Amb27259290 [0,2,0,0,0,0|2,0,0]=4 8469 B12R1.308 N[C@H](CCO)c1cccnc1Cl Amb27448311 [0,2,0,0,0,0|2,0,0]=4 8470 B12R1.308 N[C@H](CCO)c1ccncc1Cl Amb27857167 [0,2,0,0,0,0|2,0,0]=4 8471 B12R1.308 N[C@H](CCO)c1ccncc1F Amb25761821 [0,2,0,0,0,0|2,0,0]=4 8472 B12R1.308 N[C@H](CCO)c1ccncc1O Amb28397828 [0,2,0,0,0,0|2,0,0]=4 8473 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,2,0,0,0,0|1,0,0]=3 8474 B12R1.308 Nc1ccccc1[C@@H](N)CCO Amb8631341 [0,2,0,0,0,0|1,0,0]=3 8475 B12R1.308 Nc1ccncc1[C@H](N)CCO Amb27175330 [0,2,0,0,0,0|2,0,0]=4 8476 B12R1.308 Nc1cnccc1[C@@H](N)CCO Amb28067761 [0,2,0,0,0,0|2,0,0]=4 8477 B12R1.308 Nc1ncccc1C(N)CCO Amb28365610 [0,2,0,0,0,0|2,0,0]=4 8478 B12R1.308 Nc1ncccc1C(O)CCO Amb32669081 [0,2,0,0,0,0|2,0,0]=4 8479 B12R1.308 Nc1ncccc1[C@@H](N)CCO Amb27595974 [0,2,0,0,0,0|2,0,0]=4 8480 B12R1.308 O=C(CCBr)c1ccccc1Br Amb24695292 [0,2,0,0,0,0|2,0,0]=4 8481 B12R1.308 O=C(CCBr)c1ccccc1I Amb24696334 [0,2,0,0,0,0|2,0,0]=4 8482 B12R1.308 O=C(CCBr)c1ccccc1O Amb28322327 [0,2,0,0,0,0|2,0,0]=4 8483 B12R1.308 O=C(CCCl)c1ccccc1Cl Amb22229247 [0,2,0,0,0,0|2,0,0]=4 8484 B12R1.308 O=C(CCCl)c1ccccc1F Amb6301804 [0,2,0,0,0,0|2,0,0]=4 8485 B12R1.308 O=C(CCCl)c1ccccc1I Amb25796603 [0,2,0,0,0,0|2,0,0]=4 8486 B12R1.308 O=C(CCCl)c1ccccc1O Amb27470727 [0,2,0,0,0,0|2,0,0]=4 8487 B12R1.308 O=C(CCF)c1ccccc1Br Amb16231892 [0,2,0,0,0,0|2,0,0]=4 8488 B12R1.308 O=C(CCO)c1ccccc1Cl Amb27653159 [0,2,0,0,0,0|1,0,0]=3 8489 B12R1.308 O=C(CCO)c1ccccc1F Amb25159895 [0,2,0,0,0,0|1,0,0]=3 8490 B12R1.308 O=C(CCO)c1ccccc1O Amb27234354 [0,2,0,0,0,0|1,0,0]=3 8491 B12R1.308 O=C(NCO)c1ccccc1F Amb2793599 [0,2,0,0,0,0|2,0,0]=4 8492 B12R1.308 O=C(NCO)c1ccccc1O Amb6358947 [0,2,0,0,0,0|2,0,0]=4 8493 B12R1.308 OCCC(F)c1ccccc1Br Amb27421489 [0,2,0,0,0,0|1,0,0]=3 8494 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,2,0,0,0,0|1,0,0]=3 8495 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,2,0,0,0,0|1,0,0]=3 8496 B12R1.308 OCCC(O)c1cccnc1Cl Amb22298357 [0,2,0,0,0,0|2,0,0]=4 8497 B12R1.308 ONCC(O)c1ccccc1Cl Amb17335947 [0,2,0,0,0,0|2,0,0]=4 8498 B12R1.308 ONCC(O)c1ccccc1F Amb17334837 [0,2,0,0,0,0|2,0,0]=4 8499 B12R1.25 BrCCCc1cccc(Br)c1I Amb26532847 [0,2,0,0,0,0|2,0,0]=4 8500 B12R1.25 BrCCCc1cccc(I)c1Br Amb26907784 [0,2,0,0,0,0|2,0,0]=4 8501 B12R1.25 C#CCOc1cccc(C)c1C Amb18800358 [0,2,0,0,0,0|1,0,1]=4 8502 B12R1.25 C#CCOc1cccc(Cl)c1Cl Amb18333167 [0,2,0,0,0,0|1,0,1]=4 8503 B12R1.25 C#CCOc1cccc(N)c1C Amb18286186 [0,2,0,0,0,0|1,0,1]=4 8504 B12R1.25 C#CCOc1cccc(O)c1C Amb8837172 [0,2,0,0,0,0|1,0,1]=4 8505 B12R1.25 C=CCOc1cccc(C)c1F Amb28240665 [0,2,0,0,0,0|1,0,1]=4 8506 B12R1.25 C=CCOc1cccc(C)c1O Amb28243897 [0,2,0,0,0,0|1,0,1]=4 8507 B12R1.25 C=CCOc1cccc(Cl)c1Cl Amb28139646 [0,2,0,0,0,0|1,0,1]=4 8508 B12R1.25 C=CCOc1cccc(Cl)c1F Amb27205602 [0,2,0,0,0,0|1,0,1]=4 8509 B12R1.25 C=CCOc1cccc(F)c1F Amb27977696 [0,2,0,0,0,0|1,0,1]=4 8510 B12R1.25 C=CCOc1cccc(N)c1N Amb27814322 [0,2,0,0,0,0|1,0,1]=4 8511 B12R1.25 CC1=CC=CN(CCCO)C1=O Amb18041290 [0,2,0,0,0,0|2,0,0]=4 8512 B12R1.25 CCCCc1cccc(F)c1F Amb27475766 [0,2,0,0,0,0|2,0,0]=4 8513 B12R1.25 CCCCc1cccc(N)c1F Amb29869565 [0,2,0,0,0,0|2,0,0]=4 8514 B12R1.25 CCCNc1cccc(Br)c1Cl Amb29865088 [0,2,0,0,0,0|2,0,0]=4 8515 B12R1.25 CCCNc1cccc(Br)c1F Amb35642859 [0,2,0,0,0,0|2,0,0]=4 8516 B12R1.25 CCCNc1cccc(C)c1C Amb6700736 [0,2,0,0,0,0|2,0,0]=4 8517 B12R1.25 CCCNc1cccc(C)c1O Amb27751740 [0,2,0,0,0,0|2,0,0]=4 8518 B12R1.25 CCCNc1cccc(Cl)c1C Amb4313518 [0,2,0,0,0,0|2,0,0]=4 8519 B12R1.25 CCCNc1cccc(Cl)c1Cl Amb33329381 [0,2,0,0,0,0|2,0,0]=4 8520 B12R1.25 CCCNc1cccc(Cl)c1Cl Amb6631952 [0,2,0,0,0,0|2,0,0]=4 8521 B12R1.25 CCCNc1cccc(F)c1Cl Amb29864394 [0,2,0,0,0,0|2,0,0]=4 8522 B12R1.25 CCCNc1cccc(F)c1I Amb27591891 [0,2,0,0,0,0|2,0,0]=4 8523 B12R1.25 CCCNc1cccc(F)c1N Amb18968033 [0,2,0,0,0,0|2,0,0]=4 8524 B12R1.25 CCCNc1cccc(I)c1C Amb27760819 [0,2,0,0,0,0|2,0,0]=4 8525 B12R1.25 CCCOC1=C(C)C(=S)NC=C1 Amb27596982 [0,2,0,0,0,0|2,0,0]=4 8526 B12R1.25 CCCOC1=CC=CN(C)C1=O Amb19125994 [0,2,0,0,0,0|2,0,0]=4 8527 B12R1.25 CCCOc1ccc[n+]([O-])c1C Amb26489367 [0,2,0,0,0,0|2,0,0]=4 8528 B12R1.25 CCCOc1cccc(Br)c1N Amb24406179 [0,2,0,0,0,0|1,0,0]=3 8529 B12R1.25 CCCOc1cccc(C)c1C Amb25051268 [0,2,0,0,0,0|1,0,0]=3 8530 B12R1.25 CCCOc1cccc(C)c1Cl Amb28064846 [0,2,0,0,0,0|1,0,0]=3 8531 B12R1.25 CCCOc1cccc(C)c1I Amb33512236 [0,2,0,0,0,0|1,0,0]=3 8532 B12R1.25 CCCOc1cccc(C)c1N Amb9296663 [0,2,0,0,0,0|1,0,0]=3 8533 B12R1.25 CCCOc1cccc(Cl)c1Cl Amb27840687 [0,2,0,0,0,0|1,0,0]=3 8534 B12R1.25 CCCOc1cccc(Cl)c1F Amb27449039 [0,2,0,0,0,0|1,0,0]=3 8535 B12R1.25 CCCOc1cccc(Cl)c1N Amb26398550 [0,2,0,0,0,0|1,0,0]=3 8536 B12R1.25 CCCOc1cccc(F)c1F Amb10839414 [0,2,0,0,0,0|1,0,0]=3 8537 B12R1.25 CCCOc1cccc(F)c1N Amb18288907 [0,2,0,0,0,0|1,0,0]=3 8538 B12R1.25 CCCOc1cccc(N)c1C Amb9296464 [0,2,0,0,0,0|1,0,0]=3 8539 B12R1.25 CCCOc1cccc(N)c1N Amb28243820 [0,2,0,0,0,0|1,0,0]=3 8540 B12R1.25 CCCOc1cccc(O)c1F Amb28344026 [0,2,0,0,0,0|1,0,0]=3 8541 B12R1.25 CCCOc1cccc(O)c1N Amb27849945 [0,2,0,0,0,0|1,0,0]=3 8542 B12R1.25 CCCOc1cccc(O)c1O Amb25092908 [0,2,0,0,0,0|1,0,0]=3 8543 B12R1.25 CCCOc1cccc(S)c1N Amb18271336 [0,2,0,0,0,0|1,0,0]=3 8544 B12R1.25 CCCOc1ccnc(Cl)c1N Amb25337787 [0,2,0,0,0,0|2,0,0]=4 8545 B12R1.25 CCCOc1ccnc(O)c1N Amb33035418 [0,2,0,0,0,0|2,0,0]=4 8546 B12R1.25 CCCOc1nccc(C)c1N Amb24488646 [0,2,0,0,0,0|2,0,0]=4 8547 B12R1.25 CCCOc1nccc(N)c1Br Amb23455165 [0,2,0,0,0,0|2,0,0]=4 8548 B12R1.25 CCCOc1nccc(N)c1N Amb27223619 [0,2,0,0,0,0|2,0,0]=4 8549 B12R1.25 CCCOc1nccc(O)c1Cl Amb28073409 [0,2,0,0,0,0|2,0,0]=4 8550 B12R1.25 CCCSc1cccc(C)c1N Amb27608036 [0,2,0,0,0,0|1,1,0]=4 8551 B12R1.25 CN1C=CC=C(CCCO)C1=O Amb27651747 [0,2,0,0,0,0|2,0,0]=4 8552 B12R1.25 COCOc1cccc(C)c1F Amb27482279 [0,2,0,0,0,0|2,0,0]=4 8553 B12R1.25 COCOc1cccc(C)c1I Amb28127075 [0,2,0,0,0,0|2,0,0]=4 8554 B12R1.25 COCOc1cccc(C)c1O Amb27476261 [0,2,0,0,0,0|2,0,0]=4 8555 B12R1.25 COCOc1cccc(F)c1Br Amb24623278 [0,2,0,0,0,0|2,0,0]=4 8556 B12R1.25 COCOc1cccc(F)c1Cl Amb22546881 [0,2,0,0,0,0|2,0,0]=4 8557 B12R1.25 COCOc1cccc(F)c1F Amb22641752 [0,2,0,0,0,0|2,0,0]=4 8558 B12R1.25 COCOc1cccc(F)c1I Amb27448664 [0,2,0,0,0,0|2,0,0]=4 8559 B12R1.25 COCOc1cccc(O)c1F Amb27811367 [0,2,0,0,0,0|2,0,0]=4 8560 B12R1.25 Cc1c(Br)cccc1CCCBr Amb26532697 [0,2,0,0,0,0|2,0,0]=4 8561 B12R1.25 Cc1c(Br)cccc1CCCCl Amb24579173 [0,2,0,0,0,0|2,0,0]=4 8562 B12R1.25 Cc1c(Br)cccc1CCCN Amb27953077 [0,2,0,0,0,0|2,0,0]=4 8563 B12R1.25 Cc1c(Br)cccc1CCCO Amb32950654 [0,2,0,0,0,0|1,0,0]=3 8564 B12R1.25 Cc1c(Br)cccc1CCCS Amb33478017 [0,2,0,0,0,0|1,1,0]=4 8565 B12R1.25 Cc1c(Br)cccc1OCCN Amb24395348 [0,2,0,0,0,0|1,0,0]=3 8566 B12R1.25 Cc1c(Br)cccc1SCCO Amb26340906 [0,2,0,0,0,0|0,1,0]=3 8567 B12R1.25 Cc1c(Br)cccc1\C=C\CO Amb33476888 [0,2,0,0,0,0|1,0,1]=4 8568 B12R1.25 Cc1c(Cl)cccc1C#CCO Amb26996512 [0,2,0,0,0,0|1,0,1]=4 8569 B12R1.25 Cc1c(Cl)cccc1CCCBr Amb26914994 [0,2,0,0,0,0|2,0,0]=4 8570 B12R1.25 Cc1c(Cl)cccc1CCCCl Amb26444908 [0,2,0,0,0,0|2,0,0]=4 8571 B12R1.25 Cc1c(Cl)cccc1CCCN Amb17204335 [0,2,0,0,0,0|2,0,0]=4 8572 B12R1.25 Cc1c(Cl)cccc1NCCCl Amb17338051 [0,2,0,0,0,0|2,0,0]=4 8573 B12R1.25 Cc1c(Cl)cccc1NCCN Amb17091057 [0,2,0,0,0,0|2,0,0]=4 8574 B12R1.25 Cc1c(Cl)cccc1NCCO Amb6709042 [0,2,0,0,0,0|1,0,0]=3 8575 B12R1.25 Cc1c(Cl)cccc1OCCN Amb24454848 [0,2,0,0,0,0|1,0,0]=3 8576 B12R1.25 Cc1c(Cl)cccc1\C=C\CO Amb26883887 [0,2,0,0,0,0|1,0,1]=4 8577 B12R1.25 Cc1c(Cl)cncc1NCCO Amb35706639 [0,2,0,0,0,0|2,0,0]=4 8578 B12R1.25 Cc1c(F)cccc1CCCBr Amb27423786 [0,2,0,0,0,0|2,0,0]=4 8579 B12R1.25 Cc1c(F)cccc1CCCN Amb23442800 [0,2,0,0,0,0|2,0,0]=4 8580 B12R1.25 Cc1c(F)cccc1CCCO Amb23590885 [0,2,0,0,0,0|1,0,0]=3 8581 B12R1.25 Cc1c(F)cccc1CCCS Amb33428040 [0,2,0,0,0,0|1,1,0]=4 8582 B12R1.25 Cc1c(F)cccc1NCCN Amb18251978 [0,2,0,0,0,0|2,0,0]=4 8583 B12R1.25 Cc1c(F)cccc1NCCO Amb18980394 [0,2,0,0,0,0|1,0,0]=3 8584 B12R1.25 Cc1c(F)cccc1OCCN Amb27213694 [0,2,0,0,0,0|1,0,0]=3 8585 B12R1.25 Cc1c(F)cccc1\C=C\CO Amb32953976 [0,2,0,0,0,0|1,0,1]=4 8586 B12R1.25 Cc1c(F)ncnc1OCCO Amb35581491 [0,2,0,0,0,0|2,0,0]=4 8587 B12R1.25 Cc1c(I)cccc1CCCBr Amb27423171 [0,2,0,0,0,0|2,0,0]=4 8588 B12R1.25 Cc1c(I)cccc1CCCCl Amb27258155 [0,2,0,0,0,0|2,0,0]=4 8589 B12R1.25 Cc1c(N)cccc1CCCBr Amb27616071 [0,2,0,0,0,0|2,0,0]=4 8590 B12R1.25 Cc1c(N)cccc1CCCCl Amb26057433 [0,2,0,0,0,0|2,0,0]=4 8591 B12R1.25 Cc1c(N)cccc1OCCCl Amb27831404 [0,2,0,0,0,0|1,0,0]=3 8592 B12R1.25 Cc1c(N)cccc1OCCF Amb25238113 [0,2,0,0,0,0|1,0,0]=3 8593 B12R1.25 Cc1c(N)cccc1SCCF Amb28383268 [0,2,0,0,0,0|1,1,0]=4 8594 B12R1.25 Cc1c(N)cccc1SCCN Amb28046202 [0,2,0,0,0,0|1,1,0]=4 8595 B12R1.25 Cc1c(O)cccc1CCCBr Amb28198936 [0,2,0,0,0,0|2,0,0]=4 8596 B12R1.25 Cc1c(O)cccc1CCCCl Amb26617886 [0,2,0,0,0,0|2,0,0]=4 8597 B12R1.25 Cc1c(O)cccc1CCCN Amb27641492 [0,2,0,0,0,0|2,0,0]=4 8598 B12R1.25 Cc1c(S)cccc1CCCCl Amb26617895 [0,2,0,0,0,0|2,0,0]=4 8599 B12R1.25 Cc1cccc(CCCBr)c1Br Amb25248971 [0,2,0,0,0,0|2,0,0]=4 8600 B12R1.25 Cc1cccc(CCCBr)c1C Amb26621550 [0,2,0,0,0,0|2,0,0]=4 8601 B12R1.25 Cc1cccc(CCCBr)c1Cl Amb25922221 [0,2,0,0,0,0|2,0,0]=4 8602 B12R1.25 Cc1cccc(CCCBr)c1F Amb27200488 [0,2,0,0,0,0|2,0,0]=4 8603 B12R1.25 Cc1cccc(CCCBr)c1I Amb28133805 [0,2,0,0,0,0|2,0,0]=4 8604 B12R1.25 Cc1cccc(CCCBr)c1N Amb27624874 [0,2,0,0,0,0|2,0,0]=4 8605 B12R1.25 Cc1cccc(CCCBr)c1O Amb25269813 [0,2,0,0,0,0|2,0,0]=4 8606 B12R1.25 Cc1cccc(CCCBr)c1S Amb25195138 [0,2,0,0,0,0|2,0,0]=4 8607 B12R1.25 Cc1cccc(CCCCl)c1C Amb25862381 [0,2,0,0,0,0|2,0,0]=4 8608 B12R1.25 Cc1cccc(CCCCl)c1Cl Amb24656579 [0,2,0,0,0,0|2,0,0]=4 8609 B12R1.25 Cc1cccc(CCCCl)c1F Amb27438334 [0,2,0,0,0,0|2,0,0]=4 8610 B12R1.25 Cc1cccc(CCCCl)c1I Amb26989872 [0,2,0,0,0,0|2,0,0]=4 8611 B12R1.25 Cc1cccc(CCCCl)c1N Amb26644373 [0,2,0,0,0,0|2,0,0]=4 8612 B12R1.25 Cc1cccc(CCCCl)c1S Amb27793916 [0,2,0,0,0,0|2,0,0]=4 8613 B12R1.25 Cc1cccc(CCCN)c1Br Amb28127011 [0,2,0,0,0,0|2,0,0]=4 8614 B12R1.25 Cc1cccc(CCCN)c1C Amb17204309 [0,2,0,0,0,0|2,0,0]=4 8615 B12R1.25 Cc1cccc(CCCN)c1Cl Amb25677548 [0,2,0,0,0,0|2,0,0]=4 8616 B12R1.25 Cc1cccc(CCCN)c1F Amb25135172 [0,2,0,0,0,0|2,0,0]=4 8617 B12R1.25 Cc1cccc(CCCN)c1O Amb27809091 [0,2,0,0,0,0|2,0,0]=4 8618 B12R1.25 Cc1cccc(CCCO)c1Br Amb25159971 [0,2,0,0,0,0|1,0,0]=3 8619 B12R1.25 Cc1cccc(CCCO)c1C Amb23537989 [0,2,0,0,0,0|1,0,0]=3 8620 B12R1.25 Cc1cccc(CCCO)c1F Amb26487243 [0,2,0,0,0,0|1,0,0]=3 8621 B12R1.25 Cc1cccc(CCCO)c1O Amb24671286 [0,2,0,0,0,0|1,0,0]=3 8622 B12R1.25 Cc1cccc(CCCS)c1C Amb33314450 [0,2,0,0,0,0|1,1,0]=4 8623 B12R1.25 Cc1cccc(CCCS)c1F Amb33324234 [0,2,0,0,0,0|1,1,0]=4 8624 B12R1.25 Cc1cccc(NCCCl)c1C Amb17335666 [0,2,0,0,0,0|2,0,0]=4 8625 B12R1.25 Cc1cccc(NCCF)c1C Amb27263424 [0,2,0,0,0,0|2,0,0]=4 8626 B12R1.25 Cc1cccc(NCCN)c1C Amb17091054 [0,2,0,0,0,0|2,0,0]=4 8627 B12R1.25 Cc1cccc(NCCN)c1N Amb27258743 [0,2,0,0,0,0|2,0,0]=4 8628 B12R1.25 Cc1cccc(NCCO)c1Br Amb25046066 [0,2,0,0,0,0|1,0,0]=3 8629 B12R1.25 Cc1cccc(NCCO)c1C Amb6714046 [0,2,0,0,0,0|1,0,0]=3 8630 B12R1.25 Cc1cccc(OCC#N)c1C Amb5780866 [0,2,0,0,0,0|1,0,1]=4 8631 B12R1.25 Cc1cccc(OCC=O)c1C Amb5731827 [0,2,0,0,0,0|0,0,2]=4 8632 B12R1.25 Cc1cccc(OCC=O)c1F Amb27765287 [0,2,0,0,0,0|0,0,2]=4 8633 B12R1.25 Cc1cccc(OCCBr)c1C Amb6267787 [0,2,0,0,0,0|1,0,0]=3 8634 B12R1.25 Cc1cccc(OCCCl)c1C Amb9209774 [0,2,0,0,0,0|1,0,0]=3 8635 B12R1.25 Cc1cccc(OCCCl)c1F Amb27813908 [0,2,0,0,0,0|1,0,0]=3 8636 B12R1.25 Cc1cccc(OCCF)c1I Amb33512381 [0,2,0,0,0,0|1,0,0]=3 8637 B12R1.25 Cc1cccc(OCCF)c1N Amb24487580 [0,2,0,0,0,0|1,0,0]=3 8638 B12R1.25 Cc1cccc(OCCN)c1Br Amb26457225 [0,2,0,0,0,0|1,0,0]=3 8639 B12R1.25 Cc1cccc(OCCN)c1C Amb1138513 [0,2,0,0,0,0|1,0,0]=3 8640 B12R1.25 Cc1cccc(OCCN)c1Cl Amb24447813 [0,2,0,0,0,0|1,0,0]=3 8641 B12R1.25 Cc1cccc(OCCN)c1F Amb26028532 [0,2,0,0,0,0|1,0,0]=3 8642 B12R1.25 Cc1cccc(OCCO)c1C Amb9370634 [0,2,0,0,0,0|0,0,0]=2 8643 B12R1.25 Cc1cccc(OCCO)c1I Amb33512239 [0,2,0,0,0,0|0,0,0]=2 8644 B12R1.25 Cc1cccc(OCCO)c1N Amb9296605 [0,2,0,0,0,0|0,0,0]=2 8645 B12R1.25 Cc1cccc(OCCS)c1C Amb17233945 [0,2,0,0,0,0|0,1,0]=3 8646 B12R1.25 Cc1cccc(SCCF)c1N Amb27194312 [0,2,0,0,0,0|1,1,0]=4 8647 B12R1.25 Cc1cccc(SCCO)c1N Amb28397582 [0,2,0,0,0,0|0,1,0]=3 8648 B12R1.25 Cc1cccc(\C=C\CO)c1C Amb25139939 [0,2,0,0,0,0|1,0,1]=4 8649 B12R1.25 Cc1cccc(\C=C\CO)c1F Amb33080305 [0,2,0,0,0,0|1,0,1]=4 8650 B12R1.25 Cc1ccnc(NCCO)c1N Amb17213619 [0,2,0,0,0,0|2,0,0]=4 8651 B12R1.25 Cc1ccnc(OCCN)c1Br Amb27414152 [0,2,0,0,0,0|2,0,0]=4 8652 B12R1.25 Cc1ccnc(OCCO)c1N Amb24414249 [0,2,0,0,0,0|1,0,0]=3 8653 B12R1.25 Cc1nccc(OCCN)c1Cl Amb28366256 [0,2,0,0,0,0|2,0,0]=4 8654 B12R1.25 ClCCCc1cccc(Br)c1Br Amb26645554 [0,2,0,0,0,0|2,0,0]=4 8655 B12R1.25 ClCCCc1cccc(Br)c1Cl Amb26424047 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.25 ClCCCc1cccc(Cl)c1Br Amb28323419 [0,2,0,0,0,0|2,0,0]=4 8657 B12R1.25 ClCCCc1cccc(Cl)c1Cl Amb24367464 [0,2,0,0,0,0|2,0,0]=4 8658 B12R1.25 ClCCCc1cccc(I)c1Br Amb25208583 [0,2,0,0,0,0|2,0,0]=4 8659 B12R1.25 ClCCNc1cccc(Cl)c1Cl Amb17343166 [0,2,0,0,0,0|2,0,0]=4 8660 B12R1.25 ClCCOc1cccc(Cl)c1Cl Amb8828484 [0,2,0,0,0,0|1,0,0]=3 8661 B12R1.25 Clc1c(Br)cccc1CCCBr Amb26617921 [0,2,0,0,0,0|2,0,0]=4 8662 B12R1.25 Clc1cccc(CCCBr)c1Br Amb27192633 [0,2,0,0,0,0|2,0,0]=4 8663 B12R1.25 Clc1cccc(CCCBr)c1Cl Amb24730274 [0,2,0,0,0,0|2,0,0]=4 8664 B12R1.25 Clc1cccc(OCCBr)c1Cl Amb6279713 [0,2,0,0,0,0|1,0,0]=3 8665 B12R1.25 FCCNc1cccc(Br)c1Cl Amb35707465 [0,2,0,0,0,0|2,0,0]=4 8666 B12R1.25 FCCNc1cccc(Br)c1F Amb35649407 [0,2,0,0,0,0|2,0,0]=4 8667 B12R1.25 FCCNc1cccc(F)c1Cl Amb30016016 [0,2,0,0,0,0|2,0,0]=4 8668 B12R1.25 FCCOc1cccc(Cl)c1F Amb27479269 [0,2,0,0,0,0|1,0,0]=3 8669 B12R1.25 FCCOc1cccc(F)c1F Amb27765711 [0,2,0,0,0,0|1,0,0]=3 8670 B12R1.25 FCCOc1cccc(F)c1I Amb28204775 [0,2,0,0,0,0|1,0,0]=3 8671 B12R1.25 Fc1c(Br)cccc1CCCBr Amb27587461 [0,2,0,0,0,0|2,0,0]=4 8672 B12R1.25 Fc1c(Br)cccc1CCCCl Amb26328571 [0,2,0,0,0,0|2,0,0]=4 8673 B12R1.25 Fc1c(Br)cccc1CCCS Amb33387365 [0,2,0,0,0,0|1,1,0]=4 8674 B12R1.25 Fc1c(Cl)cccc1CCCBr Amb26066699 [0,2,0,0,0,0|2,0,0]=4 8675 B12R1.25 Fc1c(Cl)cccc1CCCCl Amb27148806 [0,2,0,0,0,0|2,0,0]=4 8676 B12R1.25 Fc1c(Cl)cccc1CCCS Amb33223264 [0,2,0,0,0,0|1,1,0]=4 8677 B12R1.25 Fc1c(Cl)cccc1OCCBr Amb27814112 [0,2,0,0,0,0|1,0,0]=3 8678 B12R1.25 Fc1c(Cl)cccc1OCCCl Amb28121439 [0,2,0,0,0,0|1,0,0]=3 8679 B12R1.25 Fc1c(I)cccc1CCCCl Amb27880875 [0,2,0,0,0,0|2,0,0]=4 8680 B12R1.25 Fc1c(S)cccc1CCCBr Amb27798714 [0,2,0,0,0,0|2,0,0]=4 8681 B12R1.25 Fc1c(S)cccc1CCCCl Amb27423556 [0,2,0,0,0,0|2,0,0]=4 8682 B12R1.25 Fc1cccc(CCCBr)c1Br Amb25039114 [0,2,0,0,0,0|2,0,0]=4 8683 B12R1.25 Fc1cccc(CCCBr)c1Cl Amb27978793 [0,2,0,0,0,0|2,0,0]=4 8684 B12R1.25 Fc1cccc(CCCBr)c1F Amb22001598 [0,2,0,0,0,0|2,0,0]=4 8685 B12R1.25 Fc1cccc(CCCBr)c1S Amb27423554 [0,2,0,0,0,0|2,0,0]=4 8686 B12R1.25 Fc1cccc(CCCCl)c1Br Amb24566065 [0,2,0,0,0,0|2,0,0]=4 8687 B12R1.25 Fc1cccc(CCCCl)c1Cl Amb28207499 [0,2,0,0,0,0|2,0,0]=4 8688 B12R1.25 Fc1cccc(CCCCl)c1F Amb19073202 [0,2,0,0,0,0|2,0,0]=4 8689 B12R1.25 Fc1cccc(CCCCl)c1I Amb27423482 [0,2,0,0,0,0|2,0,0]=4 8690 B12R1.25 Fc1cccc(CCCS)c1Br Amb33477648 [0,2,0,0,0,0|1,1,0]=4 8691 B12R1.25 Fc1cccc(CCCS)c1F Amb33427378 [0,2,0,0,0,0|1,1,0]=4 8692 B12R1.25 N#CCOc1cccc(Cl)c1Cl Amb5780899 [0,2,0,0,0,0|1,0,1]=4 8693 B12R1.25 N#CCOc1cccc(F)c1F Amb18177891 [0,2,0,0,0,0|1,0,1]=4 8694 B12R1.25 N#CCOc1cccc(N)c1Br Amb27450848 [0,2,0,0,0,0|1,0,1]=4 8695 B12R1.25 NC1=C(SCCO)C=CNC1=O Amb35675786 [0,2,0,0,0,0|1,1,0]=4 8696 B12R1.25 NC1=CC=CN(CCCO)C1=O Amb18295572 [0,2,0,0,0,0|2,0,0]=4 8697 B12R1.25 NCCCc1cccc(Br)c1Cl Amb26605865 [0,2,0,0,0,0|2,0,0]=4 8698 B12R1.25 NCCCc1cccc(Br)c1F Amb27450742 [0,2,0,0,0,0|2,0,0]=4 8699 B12R1.25 NCCCc1cccc(Br)c1O Amb25738591 [0,2,0,0,0,0|2,0,0]=4 8700 B12R1.25 NCCCc1cccc(Cl)c1Br Amb25320523 [0,2,0,0,0,0|2,0,0]=4 8701 B12R1.25 NCCCc1cccc(Cl)c1Cl Amb17204407 [0,2,0,0,0,0|2,0,0]=4 8702 B12R1.25 NCCCc1cccc(Cl)c1F Amb27768166 [0,2,0,0,0,0|2,0,0]=4 8703 B12R1.25 NCCCc1cccc(Cl)c1O Amb26940977 [0,2,0,0,0,0|2,0,0]=4 8704 B12R1.25 NCCCc1cccc(F)c1Br Amb25683566 [0,2,0,0,0,0|2,0,0]=4 8705 B12R1.25 NCCCc1cccc(F)c1Br Amb28465465 [0,2,0,0,0,0|2,0,0]=4 8706 B12R1.25 NCCCc1cccc(F)c1Cl Amb25957315 [0,2,0,0,0,0|2,0,0]=4 8707 B12R1.25 NCCCc1cccc(F)c1F Amb9524118 [0,2,0,0,0,0|2,0,0]=4 8708 B12R1.25 NCCCc1cccc(F)c1O Amb27251972 [0,2,0,0,0,0|2,0,0]=4 8709 B12R1.25 NCCCc1cccc(O)c1Br Amb27480867 [0,2,0,0,0,0|2,0,0]=4 8710 B12R1.25 NCCCc1cccc(O)c1Cl Amb26514553 [0,2,0,0,0,0|2,0,0]=4 8711 B12R1.25 NCCCc1cccc(O)c1F Amb25871603 [0,2,0,0,0,0|2,0,0]=4 8712 B12R1.25 NCCCc1cccc(O)c1O Amb24426748 [0,2,0,0,0,0|2,0,0]=4 8713 B12R1.25 NCCCc1cccc(O)c1O Amb34913247 [0,2,0,0,0,0|2,0,0]=4 8714 B12R1.25 NCCNc1cccc(Br)c1Cl Amb29865108 [0,2,0,0,0,0|2,0,0]=4 8715 B12R1.25 NCCNc1cccc(Br)c1F Amb27869212 [0,2,0,0,0,0|2,0,0]=4 8716 B12R1.25 NCCNc1cccc(Cl)c1Cl Amb17091084 [0,2,0,0,0,0|2,0,0]=4 8717 B12R1.25 NCCNc1cccc(F)c1Cl Amb29864395 [0,2,0,0,0,0|2,0,0]=4 8718 B12R1.25 NCCNc1cccc(F)c1N Amb18991513 [0,2,0,0,0,0|2,0,0]=4 8719 B12R1.25 NCCOc1cccc(Br)c1F Amb25841484 [0,2,0,0,0,0|1,0,0]=3 8720 B12R1.25 NCCOc1cccc(Br)c1O Amb33332941 [0,2,0,0,0,0|1,0,0]=3 8721 B12R1.25 NCCOc1cccc(Cl)c1Br Amb24686813 [0,2,0,0,0,0|1,0,0]=3 8722 B12R1.25 NCCOc1cccc(Cl)c1Cl Amb10609908 [0,2,0,0,0,0|1,0,0]=3 8723 B12R1.25 NCCOc1cccc(Cl)c1Cl Amb5781216 [0,2,0,0,0,0|1,0,0]=3 8724 B12R1.25 NCCOc1cccc(Cl)c1F Amb25330890 [0,2,0,0,0,0|1,0,0]=3 8725 B12R1.25 NCCOc1cccc(Cl)c1O Amb33057243 [0,2,0,0,0,0|1,0,0]=3 8726 B12R1.25 NCCOc1cccc(F)c1Br Amb26345510 [0,2,0,0,0,0|1,0,0]=3 8727 B12R1.25 NCCOc1cccc(F)c1Cl Amb27162117 [0,2,0,0,0,0|1,0,0]=3 8728 B12R1.25 NCCOc1cccc(F)c1F Amb19002179 [0,2,0,0,0,0|1,0,0]=3 8729 B12R1.25 NCCOc1cccc(F)c1O Amb27211118 [0,2,0,0,0,0|1,0,0]=3 8730 B12R1.25 NCCOc1cccc(O)c1Br Amb33386872 [0,2,0,0,0,0|1,0,0]=3 8731 B12R1.25 NCCOc1cccc(O)c1O Amb33267631 [0,2,0,0,0,0|1,0,0]=3 8732 B12R1.25 Nc1c(Br)cccc1CCCBr Amb25270390 [0,2,0,0,0,0|2,0,0]=4 8733 B12R1.25 Nc1c(Br)cccc1CCCCl Amb28133088 [0,2,0,0,0,0|2,0,0]=4 8734 B12R1.25 Nc1c(Br)cccc1OCCF Amb32939661 [0,2,0,0,0,0|1,0,0]=3 8735 B12R1.25 Nc1c(Br)cccc1OCCO Amb25895050 [0,2,0,0,0,0|0,0,0]=2 8736 B12R1.25 Nc1c(Br)cccc1SCCO Amb28256155 [0,2,0,0,0,0|0,1,0]=3 8737 B12R1.25 Nc1c(Cl)cccc1NCCO Amb27642520 [0,2,0,0,0,0|1,0,0]=3 8738 B12R1.25 Nc1c(Cl)cccc1OCCO Amb25800609 [0,2,0,0,0,0|0,0,0]=2 8739 B12R1.25 Nc1c(Cl)ncnc1OCCO Amb19002063 [0,2,0,0,0,0|2,0,0]=4 8740 B12R1.25 Nc1c(F)cccc1CCCBr Amb27963212 [0,2,0,0,0,0|2,0,0]=4 8741 B12R1.25 Nc1c(F)cccc1CCCCl Amb27614020 [0,2,0,0,0,0|2,0,0]=4 8742 B12R1.25 Nc1c(F)cccc1NCCF Amb28422165 [0,2,0,0,0,0|2,0,0]=4 8743 B12R1.25 Nc1c(F)cccc1NCCO Amb18968044 [0,2,0,0,0,0|1,0,0]=3 8744 B12R1.25 Nc1c(F)cccc1OCCO Amb18968080 [0,2,0,0,0,0|0,0,0]=2 8745 B12R1.25 Nc1c(F)ncnc1OCCO Amb33035729 [0,2,0,0,0,0|2,0,0]=4 8746 B12R1.25 Nc1c(I)cccc1CCCBr Amb27634248 [0,2,0,0,0,0|2,0,0]=4 8747 B12R1.25 Nc1c(NCCO)ccnc1O Amb35669769 [0,2,0,0,0,0|2,0,0]=4 8748 B12R1.25 Nc1c(O)cccc1CCCBr Amb27963108 [0,2,0,0,0,0|2,0,0]=4 8749 B12R1.25 Nc1c(OCCO)ccnc1Cl Amb33035270 [0,2,0,0,0,0|1,0,0]=3 8750 B12R1.25 Nc1c(OCCO)ccnc1O Amb33035366 [0,2,0,0,0,0|1,0,0]=3 8751 B12R1.25 Nc1c(S)cccc1CCCBr Amb28199233 [0,2,0,0,0,0|2,0,0]=4 8752 B12R1.25 Nc1c(S)cccc1CCCCl Amb27633721 [0,2,0,0,0,0|2,0,0]=4 8753 B12R1.25 Nc1cccc(CCCBr)c1Br Amb27793936 [0,2,0,0,0,0|2,0,0]=4 8754 B12R1.25 Nc1cccc(CCCBr)c1F Amb27851682 [0,2,0,0,0,0|2,0,0]=4 8755 B12R1.25 Nc1cccc(CCCBr)c1N Amb27209374 [0,2,0,0,0,0|2,0,0]=4 8756 B12R1.25 Nc1cccc(CCCBr)c1S Amb27846982 [0,2,0,0,0,0|2,0,0]=4 8757 B12R1.25 Nc1cccc(CCCCl)c1Br Amb26023355 [0,2,0,0,0,0|2,0,0]=4 8758 B12R1.25 Nc1cccc(CCCCl)c1F Amb27193834 [0,2,0,0,0,0|2,0,0]=4 8759 B12R1.25 Nc1cccc(CCCCl)c1S Amb28208570 [0,2,0,0,0,0|2,0,0]=4 8760 B12R1.25 Nc1cccc(OCCO)c1Br Amb28434490 [0,2,0,0,0,0|0,0,0]=2 8761 B12R1.25 Nc1cccc(SCCO)c1N Amb27394266 [0,2,0,0,0,0|0,1,0]=3 8762 B12R1.25 Nc1ccnc(OCCO)c1N Amb26375996 [0,2,0,0,0,0|1,0,0]=3 8763 B12R1.25 Nc1ncnc(OCCO)c1Br Amb27646186 [0,2,0,0,0,0|2,0,0]=4 8764 B12R1.25 O=C1C(Br)=CC=CN1CCCO Amb18543189 [0,2,0,0,0,0|2,0,0]=4 8765 B12R1.25 O=CCOc1cccc(Cl)c1Cl Amb5731859 [0,2,0,0,0,0|0,0,2]=4 8766 B12R1.25 OCC#Cc1cccc(Br)c1F Amb27257698 [0,2,0,0,0,0|1,0,1]=4 8767 B12R1.25 OCC#Cc1cccc(Cl)c1Cl Amb9777293 [0,2,0,0,0,0|1,0,1]=4 8768 B12R1.25 OCC#Cc1cccc(F)c1Br Amb27779237 [0,2,0,0,0,0|1,0,1]=4 8769 B12R1.25 OCC#Cc1cccc(F)c1F Amb25148503 [0,2,0,0,0,0|1,0,1]=4 8770 B12R1.25 OCCCc1cccc(Br)c1F Amb28244244 [0,2,0,0,0,0|1,0,0]=3 8771 B12R1.25 OCCCc1cccc(Br)c1O Amb33332585 [0,2,0,0,0,0|1,0,0]=3 8772 B12R1.25 OCCCc1cccc(Cl)c1Br Amb32950162 [0,2,0,0,0,0|1,0,0]=3 8773 B12R1.25 OCCCc1cccc(Cl)c1Cl Amb17605780 [0,2,0,0,0,0|1,0,0]=3 8774 B12R1.25 OCCCc1cccc(Cl)c1F Amb24402092 [0,2,0,0,0,0|1,0,0]=3 8775 B12R1.25 OCCCc1cccc(Cl)c1O Amb25098650 [0,2,0,0,0,0|1,0,0]=3 8776 B12R1.25 OCCCc1cccc(F)c1Br Amb25834826 [0,2,0,0,0,0|1,0,0]=3 8777 B12R1.25 OCCCc1cccc(F)c1Cl Amb25136399 [0,2,0,0,0,0|1,0,0]=3 8778 B12R1.25 OCCCc1cccc(F)c1F Amb18802844 [0,2,0,0,0,0|1,0,0]=3 8779 B12R1.25 OCCCc1cccc(F)c1O Amb24551042 [0,2,0,0,0,0|1,0,0]=3 8780 B12R1.25 OCCCc1cccc(O)c1Br Amb33386870 [0,2,0,0,0,0|1,0,0]=3 8781 B12R1.25 OCCCc1cccc(O)c1O Amb25063876 [0,2,0,0,0,0|1,0,0]=3 8782 B12R1.25 OCCNc1cccc(Br)c1F Amb35649406 [0,2,0,0,0,0|1,0,0]=3 8783 B12R1.25 OCCNc1cccc(Cl)c1Br Amb24271233 [0,2,0,0,0,0|1,0,0]=3 8784 B12R1.25 OCCNc1cccc(Cl)c1Cl Amb6742674 [0,2,0,0,0,0|1,0,0]=3 8785 B12R1.25 OCCOc1cccc(Cl)c1Cl Amb9245205 [0,2,0,0,0,0|0,0,0]=2 8786 B12R1.25 OCCOc1cccc(F)c1I Amb28317626 [0,2,0,0,0,0|0,0,0]=2 8787 B12R1.25 OCCOc1ncnc(F)c1Br Amb35611446 [0,2,0,0,0,0|2,0,0]=4 8788 B12R1.25 OCCSc1cccc(Cl)c1Cl Amb2686951 [0,2,0,0,0,0|0,1,0]=3 8789 B12R1.25 OC\C=C\c1cccc(Br)c1F Amb33386602 [0,2,0,0,0,0|1,0,1]=4 8790 B12R1.25 OC\C=C\c1cccc(Br)c1O Amb33332546 [0,2,0,0,0,0|1,0,1]=4 8791 B12R1.25 OC\C=C\c1cccc(Cl)c1Cl Amb23555632 [0,2,0,0,0,0|1,0,1]=4 8792 B12R1.25 OC\C=C\c1cccc(Cl)c1F Amb33261804 [0,2,0,0,0,0|1,0,1]=4 8793 B12R1.25 OC\C=C\c1cccc(Cl)c1O Amb33056880 [0,2,0,0,0,0|1,0,1]=4 8794 B12R1.25 OC\C=C\c1cccc(F)c1Br Amb33450558 [0,2,0,0,0,0|1,0,1]=4 8795 B12R1.25 OC\C=C\c1cccc(F)c1F Amb24593079 [0,2,0,0,0,0|1,0,1]=4 8796 B12R1.25 OC\C=C\c1cccc(F)c1O Amb33372345 [0,2,0,0,0,0|1,0,1]=4 8797 B12R1.25 OC\C=C\c1cccc(O)c1Br Amb33386836 [0,2,0,0,0,0|1,0,1]=4 8798 B12R1.25 OC\C=C\c1cccc(O)c1O Amb33268789 [0,2,0,0,0,0|1,0,1]=4 8799 B12R1.25 Oc1c(Br)cccc1CCCBr Amb27613859 [0,2,0,0,0,0|2,0,0]=4 8800 B12R1.25 Oc1c(Br)cccc1CCCS Amb33332605 [0,2,0,0,0,0|1,1,0]=4 8801 B12R1.25 Oc1c(Cl)cccc1CCCBr Amb24759296 [0,2,0,0,0,0|2,0,0]=4 8802 B12R1.25 Oc1c(Cl)cccc1CCCS Amb33057231 [0,2,0,0,0,0|1,1,0]=4 8803 B12R1.25 Oc1c(F)cccc1CCCBr Amb27423566 [0,2,0,0,0,0|2,0,0]=4 8804 B12R1.25 Oc1c(F)cccc1CCCCl Amb28134080 [0,2,0,0,0,0|2,0,0]=4 8805 B12R1.25 Oc1c(F)cccc1CCCS Amb33310588 [0,2,0,0,0,0|1,1,0]=4 8806 B12R1.25 Oc1c(I)cccc1CCCCl Amb27624175 [0,2,0,0,0,0|2,0,0]=4 8807 B12R1.25 Oc1cccc(CCCBr)c1Br Amb25325193 [0,2,0,0,0,0|2,0,0]=4 8808 B12R1.25 Oc1cccc(CCCBr)c1Cl Amb27428167 [0,2,0,0,0,0|2,0,0]=4 8809 B12R1.25 Oc1cccc(CCCBr)c1O Amb27192379 [0,2,0,0,0,0|2,0,0]=4 8810 B12R1.25 Oc1cccc(CCCCl)c1Br Amb24638371 [0,2,0,0,0,0|2,0,0]=4 8811 B12R1.25 Oc1cccc(CCCCl)c1Cl Amb27428169 [0,2,0,0,0,0|2,0,0]=4 8812 B12R1.25 Oc1cccc(CCCCl)c1F Amb27423572 [0,2,0,0,0,0|2,0,0]=4 8813 B12R1.25 Oc1cccc(CCCCl)c1O Amb27225085 [0,2,0,0,0,0|2,0,0]=4 8814 B12R1.25 Oc1cccc(CCCCl)c1S Amb27423587 [0,2,0,0,0,0|2,0,0]=4 8815 B12R1.25 Oc1cccc(CCCS)c1Br Amb33386847 [0,2,0,0,0,0|1,1,0]=4 8816 B12R1.25 Oc1cccc(CCCS)c1O Amb33267639 [0,2,0,0,0,0|1,1,0]=4 8817 B12R1.25 SCCCc1cccc(Cl)c1Cl Amb33057791 [0,2,0,0,0,0|1,1,0]=4 8818 B12R1.25 SCCOc1cccc(Cl)c1Cl Amb17245966 [0,2,0,0,0,0|0,1,0]=3 8819 B12R1.25 Sc1c(Br)cccc1CCCBr Amb27795311 [0,2,0,0,0,0|2,0,0]=4 8820 B12R1.25 Sc1c(Br)cccc1CCCCl Amb26905842 [0,2,0,0,0,0|2,0,0]=4 8821 B12R1.25 Sc1c(Cl)cccc1CCCBr Amb27200569 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.25 Sc1c(Cl)cccc1CCCCl Amb27199201 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.25 Sc1cccc(CCCBr)c1Br Amb27613897 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.25 Sc1cccc(CCCCl)c1Br Amb26952748 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.25 [NH3+]CCOc1cccc(Cl)c1Cl Amb2444251 [0,2,0,0,0,0|1,0,0]=3 8826 B12R1.121 C#CCOc1ccccc1C#N Amb6262307 [0,2,0,0,0,0|1,0,1]=4 8827 B12R1.121 C#CCOc1ccccc1C=O Amb6327007 [0,2,0,0,0,0|1,0,1]=4 8828 B12R1.121 C#CCOc1ccccc1CC Amb18183416 [0,2,0,0,0,0|1,0,1]=4 8829 B12R1.121 C#CCOc1ccccc1CCl Amb28239799 [0,2,0,0,0,0|1,0,1]=4 8830 B12R1.121 C#CCOc1ccccc1CN Amb19514977 [0,2,0,0,0,0|1,0,1]=4 8831 B12R1.121 C#CCOc1ccccc1CN Amb6718921 [0,2,0,0,0,0|1,0,1]=4 8832 B12R1.121 C#CCOc1ccccc1CO Amb3428108 [0,2,0,0,0,0|1,0,1]=4 8833 B12R1.121 C#CCOc1ccccc1CS Amb32788442 [0,2,0,0,0,0|1,0,1]=4 8834 B12R1.121 C#CCOc1ccccc1OC Amb18183490 [0,2,0,0,0,0|1,0,1]=4 8835 B12R1.121 C#CCOc1ccccc1SC Amb28199413 [0,2,0,0,0,0|1,0,1]=4 8836 B12R1.121 C#Cc1ccccc1C#CCO Amb27178552 [0,2,0,0,0,0|1,0,1]=4 8837 B12R1.121 C#Cc1ccccc1CCCBr Amb33386550 [0,2,0,0,0,0|2,0,0]=4 8838 B12R1.121 C#Cc1ccccc1CCCN Amb33314763 [0,2,0,0,0,0|2,0,0]=4 8839 B12R1.121 C#Cc1ccccc1CCCO Amb27978387 [0,2,0,0,0,0|1,0,0]=3 8840 B12R1.121 C#Cc1ccccc1CCCS Amb33373849 [0,2,0,0,0,0|1,1,0]=4 8841 B12R1.121 C#Cc1ccccc1OCCC Amb27457126 [0,2,0,0,0,0|1,0,0]=3 8842 B12R1.121 C#Cc1ccccc1OCCN Amb33373859 [0,2,0,0,0,0|1,0,0]=3 8843 B12R1.121 C#Cc1ccccc1\C=C\CO Amb33374286 [0,2,0,0,0,0|1,0,1]=4 8844 B12R1.121 C#Cc1cccnc1OCCN Amb27219108 [0,2,0,0,0,0|2,0,0]=4 8845 B12R1.121 C#Cc1cnccc1CCCO Amb24702653 [0,2,0,0,0,0|2,0,0]=4 8846 B12R1.121 C#Cc1ncccc1OCCC Amb26559105 [0,2,0,0,0,0|2,0,0]=4 8847 B12R1.121 C=CCOc1ccccc1C=O Amb1211891 [0,2,0,0,0,0|1,0,1]=4 8848 B12R1.121 C=CCOc1ccccc1CBr Amb30640043 [0,2,0,0,0,0|1,0,1]=4 8849 B12R1.121 C=CCOc1ccccc1CN Amb9620829 [0,2,0,0,0,0|1,0,1]=4 8850 B12R1.121 C=CCOc1ccccc1CO Amb33526645 [0,2,0,0,0,0|1,0,1]=4 8851 B12R1.121 C=CCOc1ccccc1CS Amb32788363 [0,2,0,0,0,0|1,0,1]=4 8852 B12R1.121 CCCCc1ccccc1C#N Amb27156264 [0,2,0,0,0,0|2,0,0]=4 8853 B12R1.121 CCCCc1ccccc1NN Amb3942594 [0,2,0,0,0,0|2,0,0]=4 8854 B12R1.121 CCCNc1ccccc1C#N Amb6716331 [0,2,0,0,0,0|2,0,0]=4 8855 B12R1.121 CCCNc1ccccc1CC Amb6698992 [0,2,0,0,0,0|2,0,0]=4 8856 B12R1.121 CCCNc1ccccc1CN Amb18800850 [0,2,0,0,0,0|2,0,0]=4 8857 B12R1.121 CCCNc1ccccc1OC Amb6688440 [0,2,0,0,0,0|2,0,0]=4 8858 B12R1.121 CCCOc1ccccc1C=O Amb1033069 [0,2,0,0,0,0|1,0,0]=3 8859 B12R1.121 CCCOc1ccccc1CCl Amb6622493 [0,2,0,0,0,0|1,0,0]=3 8860 B12R1.121 CCCOc1ccccc1CN Amb1141875 [0,2,0,0,0,0|1,0,0]=3 8861 B12R1.121 CCCOc1ccccc1CO Amb3542437 [0,2,0,0,0,0|1,0,0]=3 8862 B12R1.121 CCCOc1ccccc1NC Amb18316381 [0,2,0,0,0,0|1,0,0]=3 8863 B12R1.121 CCCOc1cccnc1NN Amb17207295 [0,2,0,0,0,0|2,0,0]=4 8864 B12R1.121 CCCOc1cnccc1CN Amb28984208 [0,2,0,0,0,0|2,0,0]=4 8865 B12R1.121 CCCOc1ncccc1C#N Amb8874795 [0,2,0,0,0,0|2,0,0]=4 8866 B12R1.121 CCCOc1ncccc1CN Amb8874521 [0,2,0,0,0,0|2,0,0]=4 8867 B12R1.121 CCCSc1ccccc1CCl Amb32697564 [0,2,0,0,0,0|1,1,0]=4 8868 B12R1.121 CCc1ccccc1C#CCO Amb24449940 [0,2,0,0,0,0|1,0,1]=4 8869 B12R1.121 CCc1ccccc1CCCBr Amb33451547 [0,2,0,0,0,0|2,0,0]=4 8870 B12R1.121 CCc1ccccc1CCCN Amb18310623 [0,2,0,0,0,0|2,0,0]=4 8871 B12R1.121 CCc1ccccc1CCCO Amb32950119 [0,2,0,0,0,0|1,0,0]=3 8872 B12R1.121 CCc1ccccc1CCCS Amb33198664 [0,2,0,0,0,0|1,1,0]=4 8873 B12R1.121 CCc1ccccc1NCCCl Amb17335667 [0,2,0,0,0,0|2,0,0]=4 8874 B12R1.121 CCc1ccccc1NCCF Amb27619590 [0,2,0,0,0,0|2,0,0]=4 8875 B12R1.121 CCc1ccccc1NCCO Amb4016393 [0,2,0,0,0,0|1,0,0]=3 8876 B12R1.121 CCc1ccccc1OCC#N Amb5780890 [0,2,0,0,0,0|1,0,1]=4 8877 B12R1.121 CCc1ccccc1OCC=O Amb5731829 [0,2,0,0,0,0|0,0,2]=4 8878 B12R1.121 CCc1ccccc1OCCBr Amb9024911 [0,2,0,0,0,0|1,0,0]=3 8879 B12R1.121 CCc1ccccc1OCCCl Amb8867419 [0,2,0,0,0,0|1,0,0]=3 8880 B12R1.121 CCc1ccccc1OCCN Amb5781212 [0,2,0,0,0,0|1,0,0]=3 8881 B12R1.121 CCc1ccccc1OCCO Amb9370573 [0,2,0,0,0,0|0,0,0]=2 8882 B12R1.121 CCc1ccccc1OCCS Amb17233941 [0,2,0,0,0,0|0,1,0]=3 8883 B12R1.121 CCc1ccccc1\C=C\CO Amb33171632 [0,2,0,0,0,0|1,0,1]=4 8884 B12R1.121 CNc1ccccc1CCCO Amb26445075 [0,2,0,0,0,0|1,0,0]=3 8885 B12R1.121 COCOc1ccccc1C=O Amb17594124 [0,2,0,0,0,0|2,0,0]=4 8886 B12R1.121 COc1ccccc1C#CCO Amb18180050 [0,2,0,0,0,0|1,0,1]=4 8887 B12R1.121 COc1ccccc1CCCBr Amb7089047 [0,2,0,0,0,0|2,0,0]=4 8888 B12R1.121 COc1ccccc1CCCCl Amb17104531 [0,2,0,0,0,0|2,0,0]=4 8889 B12R1.121 COc1ccccc1CCCN Amb2721871 [0,2,0,0,0,0|2,0,0]=4 8890 B12R1.121 COc1ccccc1CCCO Amb4019180 [0,2,0,0,0,0|1,0,0]=3 8891 B12R1.121 COc1ccccc1CCCS Amb17400949 [0,2,0,0,0,0|1,1,0]=4 8892 B12R1.121 COc1ccccc1NCCCl Amb17335806 [0,2,0,0,0,0|2,0,0]=4 8893 B12R1.121 COc1ccccc1NCCN Amb17057753 [0,2,0,0,0,0|2,0,0]=4 8894 B12R1.121 COc1ccccc1NCCO Amb6708268 [0,2,0,0,0,0|1,0,0]=3 8895 B12R1.121 COc1ccccc1OCC#N Amb2504984 [0,2,0,0,0,0|1,0,1]=4 8896 B12R1.121 COc1ccccc1OCC=O Amb5731832 [0,2,0,0,0,0|0,0,2]=4 8897 B12R1.121 COc1ccccc1OCCBr Amb836244 [0,2,0,0,0,0|1,0,0]=3 8898 B12R1.121 COc1ccccc1OCCCl Amb8828437 [0,2,0,0,0,0|1,0,0]=3 8899 B12R1.121 COc1ccccc1OCCN Amb1210085 [0,2,0,0,0,0|1,0,0]=3 8900 B12R1.121 COc1ccccc1OCCN Amb20241252 [0,2,0,0,0,0|1,0,0]=3 8901 B12R1.121 COc1ccccc1OCCN Amb6296355 [0,2,0,0,0,0|1,0,0]=3 8902 B12R1.121 COc1ccccc1OCCO Amb2209353 [0,2,0,0,0,0|0,0,0]=2 8903 B12R1.121 COc1ccccc1OCCS Amb17234095 [0,2,0,0,0,0|0,1,0]=3 8904 B12R1.121 COc1ccccc1OCC[NH3+] Amb33513060 [0,2,0,0,0,0|1,0,0]=3 8905 B12R1.121 COc1ccccc1SCCN Amb19024665 [0,2,0,0,0,0|1,1,0]=4 8906 B12R1.121 COc1ccccc1SCCO Amb2689268 [0,2,0,0,0,0|0,1,0]=3 8907 B12R1.121 COc1ccccc1\C=C\CO Amb1110152 [0,2,0,0,0,0|1,0,1]=4 8908 B12R1.121 COc1cccnc1CCCO Amb33080428 [0,2,0,0,0,0|2,0,0]=4 8909 B12R1.121 COc1cccnc1OCCN Amb33474262 [0,2,0,0,0,0|2,0,0]=4 8910 B12R1.121 COc1ncccc1CCCO Amb33079281 [0,2,0,0,0,0|2,0,0]=4 8911 B12R1.121 COc1ncccc1OCCN Amb33378290 [0,2,0,0,0,0|2,0,0]=4 8912 B12R1.121 CSc1ccccc1CCCBr Amb33240777 [0,2,0,0,0,0|2,0,0]=4 8913 B12R1.121 CSc1ccccc1CCCN Amb33079267 [0,2,0,0,0,0|2,0,0]=4 8914 B12R1.121 CSc1ccccc1CCCO Amb33079338 [0,2,0,0,0,0|1,0,0]=3 8915 B12R1.121 CSc1ccccc1CCCS Amb32876734 [0,2,0,0,0,0|1,1,0]=4 8916 B12R1.121 CSc1ccccc1NCCN Amb27597535 [0,2,0,0,0,0|2,0,0]=4 8917 B12R1.121 CSc1ccccc1OCC#N Amb22523372 [0,2,0,0,0,0|1,0,1]=4 8918 B12R1.121 CSc1ccccc1OCCN Amb22523348 [0,2,0,0,0,0|1,0,0]=3 8919 B12R1.121 CSc1ccccc1\C=C\CO Amb33465828 [0,2,0,0,0,0|1,0,1]=4 8920 B12R1.121 CSc1ncccc1OCCO Amb24105861 [0,2,0,0,0,0|1,0,0]=3 8921 B12R1.121 FCCOc1ccccc1CBr Amb31207745 [0,2,0,0,0,0|1,0,0]=3 8922 B12R1.121 FCCOc1ccccc1CCl Amb31207744 [0,2,0,0,0,0|1,0,0]=3 8923 B12R1.121 N#CCOc1ccccc1C#N Amb3992457 [0,2,0,0,0,0|1,0,1]=4 8924 B12R1.121 N#CCOc1ccccc1C=O Amb6333247 [0,2,0,0,0,0|1,0,1]=4 8925 B12R1.121 N#CCOc1ccccc1CO Amb6706309 [0,2,0,0,0,0|1,0,1]=4 8926 B12R1.121 N#CCOc1ccccc1CS Amb32788537 [0,2,0,0,0,0|1,0,1]=4 8927 B12R1.121 N#Cc1ccccc1C#CCO Amb836573 [0,2,0,0,0,0|1,0,1]=4 8928 B12R1.121 N#Cc1ccccc1CCCBr Amb27614096 [0,2,0,0,0,0|2,0,0]=4 8929 B12R1.121 N#Cc1ccccc1CCCCl Amb28365648 [0,2,0,0,0,0|2,0,0]=4 8930 B12R1.121 N#Cc1ccccc1CCCN Amb18251586 [0,2,0,0,0,0|2,0,0]=4 8931 B12R1.121 N#Cc1ccccc1CCCO Amb28437188 [0,2,0,0,0,0|1,0,0]=3 8932 B12R1.121 N#Cc1ccccc1CCCS Amb33204244 [0,2,0,0,0,0|1,1,0]=4 8933 B12R1.121 N#Cc1ccccc1NCCCl Amb17335460 [0,2,0,0,0,0|2,0,0]=4 8934 B12R1.121 N#Cc1ccccc1NCCO Amb6712054 [0,2,0,0,0,0|1,0,0]=3 8935 B12R1.121 N#Cc1ccccc1OCCBr Amb6255654 [0,2,0,0,0,0|1,0,0]=3 8936 B12R1.121 N#Cc1ccccc1OCCF Amb27950264 [0,2,0,0,0,0|1,0,0]=3 8937 B12R1.121 N#Cc1ccccc1OCCN Amb17740016 [0,2,0,0,0,0|1,0,0]=3 8938 B12R1.121 N#Cc1ccccc1OCCO Amb6256841 [0,2,0,0,0,0|0,0,0]=2 8939 B12R1.121 N#Cc1ccccc1\C=C\CO Amb18645181 [0,2,0,0,0,0|1,0,1]=4 8940 B12R1.121 N#Cc1cccnc1NCCO Amb6617388 [0,2,0,0,0,0|2,0,0]=4 8941 B12R1.121 N#Cc1cccnc1OCCN Amb30585362 [0,2,0,0,0,0|2,0,0]=4 8942 B12R1.121 N#Cc1ccncc1SCCO Amb18648381 [0,2,0,0,0,0|1,1,0]=4 8943 B12R1.121 N#Cc1ccnnc1OCCO Amb27200212 [0,2,0,0,0,0|2,0,0]=4 8944 B12R1.121 N#Cc1ncccc1NCCO Amb27398064 [0,2,0,0,0,0|2,0,0]=4 8945 B12R1.121 NCCOc1ccccc1CN Amb32737487 [0,2,0,0,0,0|1,0,0]=3 8946 B12R1.121 NCc1ccccc1NCCO Amb5786775 [0,2,0,0,0,0|1,0,0]=3 8947 B12R1.121 NCc1ccccc1OCCF Amb31207830 [0,2,0,0,0,0|1,0,0]=3 8948 B12R1.121 NCc1ccccc1OCCO Amb33527040 [0,2,0,0,0,0|0,0,0]=2 8949 B12R1.121 NCc1ccccc1OCCO Amb6702373 [0,2,0,0,0,0|0,0,0]=2 8950 B12R1.121 NCc1ccncc1NCCO Amb27754890 [0,2,0,0,0,0|2,0,0]=4 8951 B12R1.121 NCc1ccncc1OCCO Amb28984207 [0,2,0,0,0,0|1,0,0]=3 8952 B12R1.121 NCc1cnccc1NCCO Amb27883027 [0,2,0,0,0,0|2,0,0]=4 8953 B12R1.121 O=Cc1ccccc1OCCBr Amb2797414 [0,2,0,0,0,0|1,0,0]=3 8954 B12R1.121 O=Cc1ccccc1OCCCl Amb857546 [0,2,0,0,0,0|1,0,0]=3 8955 B12R1.121 O=Cc1ccccc1OCCF Amb31207828 [0,2,0,0,0,0|1,0,0]=3 8956 B12R1.121 O=Cc1ccccc1OCCO Amb857545 [0,2,0,0,0,0|0,0,0]=2 8957 B12R1.121 OCC#Cc1ccccc1CO Amb18792412 [0,2,0,0,0,0|1,0,1]=4 8958 B12R1.121 OCCNc1ncccc1CO Amb18106094 [0,2,0,0,0,0|2,0,0]=4 8959 B12R1.121 OC\C=C\c1ccccc1CO Amb27764799 [0,2,0,0,0,0|1,0,1]=4 8960 B12R1.121 OCc1ccccc1OCCF Amb31207756 [0,2,0,0,0,0|1,0,0]=3 8961 B12R1.125 C=C(Br)COc1ccccc1Cl Amb27175753 [0,2,0,0,0,0|1,0,1]=4 8962 B12R1.125 C=C(Br)COc1ccccc1I Amb28321049 [0,2,0,0,0,0|1,0,1]=4 8963 B12R1.125 C=C(C)COc1ccccc1Br Amb6273934 [0,2,0,0,0,0|1,0,1]=4 8964 B12R1.125 C=C(C)COc1ccccc1Cl Amb25831212 [0,2,0,0,0,0|1,0,1]=4 8965 B12R1.125 C=C(C)COc1ccccc1N Amb2081551 [0,2,0,0,0,0|1,0,1]=4 8966 B12R1.125 C=C(C)COc1ccccc1N Amb6740593 [0,2,0,0,0,0|1,0,1]=4 8967 B12R1.125 C=C(C)COc1ccccc1O Amb8837378 [0,2,0,0,0,0|1,0,1]=4 8968 B12R1.125 C=C(F)COc1ccccc1Br Amb23570547 [0,2,0,0,0,0|1,0,1]=4 8969 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,2,0,0,0,0|0,0,2]=4 8970 B12R1.125 CC(=O)COc1ccccc1F Amb9269602 [0,2,0,0,0,0|0,0,2]=4 8971 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,2,0,0,0,0|0,0,2]=4 8972 B12R1.125 CC(Br)CCc1ccccc1Cl Amb27425314 [0,2,0,0,0,0|2,0,0]=4 8973 B12R1.125 CC(C)CCc1ccccc1I Amb28244344 [0,2,0,0,0,0|2,0,0]=4 8974 B12R1.125 CC(C)CCc1ccccc1N Amb13951566 [0,2,0,0,0,0|2,0,0]=4 8975 B12R1.125 CC(C)CCc1ccccc1O Amb27972959 [0,2,0,0,0,0|2,0,0]=4 8976 B12R1.125 CC(C)CNc1ccccc1Br Amb6696377 [0,2,0,0,0,0|2,0,0]=4 8977 B12R1.125 CC(C)CNc1ccccc1Cl Amb6696853 [0,2,0,0,0,0|2,0,0]=4 8978 B12R1.125 CC(C)CNc1ccccc1F Amb6697273 [0,2,0,0,0,0|2,0,0]=4 8979 B12R1.125 CC(C)CNc1ccccc1I Amb7785761 [0,2,0,0,0,0|2,0,0]=4 8980 B12R1.125 CC(C)CNc1ccccc1N Amb7767494 [0,2,0,0,0,0|2,0,0]=4 8981 B12R1.125 CC(C)COC1=CC=CNC1=O Amb18034646 [0,2,0,0,0,0|2,0,0]=4 8982 B12R1.125 CC(C)COc1ccccc1Br Amb6271437 [0,2,0,0,0,0|1,0,0]=3 8983 B12R1.125 CC(C)COc1ccccc1Cl Amb24632680 [0,2,0,0,0,0|1,0,0]=3 8984 B12R1.125 CC(C)COc1ccccc1N Amb1137660 [0,2,0,0,0,0|1,0,0]=3 8985 B12R1.125 CC(C)COc1ccccc1N Amb2140563 [0,2,0,0,0,0|1,0,0]=3 8986 B12R1.125 CC(C)COc1ccccc1O Amb1016836 [0,2,0,0,0,0|1,0,0]=3 8987 B12R1.125 CC(C)COc1ccccc1S Amb25844615 [0,2,0,0,0,0|1,0,0]=3 8988 B12R1.125 CC(C)COc1cccnc1Br Amb27976379 [0,2,0,0,0,0|2,0,0]=4 8989 B12R1.125 CC(C)COc1cccnc1Cl Amb25751253 [0,2,0,0,0,0|2,0,0]=4 8990 B12R1.125 CC(C)COc1cccnc1N Amb9208362 [0,2,0,0,0,0|2,0,0]=4 8991 B12R1.125 CC(C)COc1ccncc1N Amb7765151 [0,2,0,0,0,0|2,0,0]=4 8992 B12R1.125 CC(C)COc1cnccc1N Amb25188159 [0,2,0,0,0,0|2,0,0]=4 8993 B12R1.125 CC(C)COc1ncccc1Br Amb27780761 [0,2,0,0,0,0|2,0,0]=4 8994 B12R1.125 CC(C)COc1ncccc1Cl Amb25667675 [0,2,0,0,0,0|2,0,0]=4 8995 B12R1.125 CC(C)COc1ncccc1N Amb6248859 [0,2,0,0,0,0|2,0,0]=4 8996 B12R1.125 CC(C)COc1ncccc1O Amb26061907 [0,2,0,0,0,0|2,0,0]=4 8997 B12R1.125 CC(C)CSc1ccccc1Br Amb24728137 [0,2,0,0,0,0|1,1,0]=4 8998 B12R1.125 CC(F)CCc1ccccc1O Amb27958749 [0,2,0,0,0,0|2,0,0]=4 8999 B12R1.125 CC(F)COc1ccccc1O Amb27958799 [0,2,0,0,0,0|1,0,0]=3 9000 B12R1.125 CC(F)CSc1ccccc1O Amb27958812 [0,2,0,0,0,0|1,1,0]=4 9001 B12R1.125 CC(N)CCc1ccccc1Br Amb9031766 [0,2,0,0,0,0|2,0,0]=4 9002 B12R1.125 CC(N)CCc1ccccc1Cl Amb2721943 [0,2,0,0,0,0|2,0,0]=4 9003 B12R1.125 CC(N)CCc1ccccc1F Amb9031774 [0,2,0,0,0,0|2,0,0]=4 9004 B12R1.125 CC(N)CCc1ccccc1O Amb17507315 [0,2,0,0,0,0|2,0,0]=4 9005 B12R1.125 CC(N)CNc1ccccc1Br Amb27399526 [0,2,0,0,0,0|2,0,0]=4 9006 B12R1.125 CC(N)CNc1ccccc1Cl Amb26923176 [0,2,0,0,0,0|2,0,0]=4 9007 B12R1.125 CC(N)CNc1ccccc1F Amb27756404 [0,2,0,0,0,0|2,0,0]=4 9008 B12R1.125 CC(N)COC1=CNC=CC1=O Amb27441354 [0,2,0,0,0,0|2,0,0]=4 9009 B12R1.125 CC(N)COc1ccccc1Br Amb17062516 [0,2,0,0,0,0|1,0,0]=3 9010 B12R1.125 CC(N)COc1ccccc1Cl Amb9756354 [0,2,0,0,0,0|1,0,0]=3 9011 B12R1.125 CC(N)COc1ccccc1F Amb1134402 [0,2,0,0,0,0|1,0,0]=3 9012 B12R1.125 CC(N)COc1ccccc1O Amb27814458 [0,2,0,0,0,0|1,0,0]=3 9013 B12R1.125 CC(N)COc1ccncc1Br Amb35727459 [0,2,0,0,0,0|2,0,0]=4 9014 B12R1.125 CC(N)COc1ccncc1Cl Amb35727455 [0,2,0,0,0,0|2,0,0]=4 9015 B12R1.125 CC(N)COc1ccncc1F Amb30020471 [0,2,0,0,0,0|2,0,0]=4 9016 B12R1.125 CC(N)COc1ncccc1Br Amb35727460 [0,2,0,0,0,0|2,0,0]=4 9017 B12R1.125 CC(N)COc1ncccc1Cl Amb35727454 [0,2,0,0,0,0|2,0,0]=4 9018 B12R1.125 CC(N)COc1ncccc1F Amb35727450 [0,2,0,0,0,0|2,0,0]=4 9019 B12R1.125 CC(N)CSc1ccccc1N Amb18648678 [0,2,0,0,0,0|1,1,0]=4 9020 B12R1.125 CC(O)C#Cc1ccccc1Cl Amb9777259 [0,2,0,0,0,0|1,0,1]=4 9021 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [0,2,0,0,0,0|1,0,0]=3 9022 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [0,2,0,0,0,0|1,0,0]=3 9023 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [0,2,0,0,0,0|1,0,0]=3 9024 B12R1.125 CC(O)CCc1ccccc1O Amb17507249 [0,2,0,0,0,0|1,0,0]=3 9025 B12R1.125 CC(O)CCc1cccnc1Br Amb33387779 [0,2,0,0,0,0|2,0,0]=4 9026 B12R1.125 CC(O)CCc1cccnc1Cl Amb33257367 [0,2,0,0,0,0|2,0,0]=4 9027 B12R1.125 CC(O)CCc1cccnc1F Amb33377666 [0,2,0,0,0,0|2,0,0]=4 9028 B12R1.125 CC(O)CCc1ccncc1Br Amb33242104 [0,2,0,0,0,0|2,0,0]=4 9029 B12R1.125 CC(O)CCc1ccncc1Cl Amb25053788 [0,2,0,0,0,0|2,0,0]=4 9030 B12R1.125 CC(O)CCc1ccncc1F Amb27946215 [0,2,0,0,0,0|2,0,0]=4 9031 B12R1.125 CC(O)CCc1ncccc1Br Amb26038236 [0,2,0,0,0,0|2,0,0]=4 9032 B12R1.125 CC(O)CCc1ncccc1F Amb33418875 [0,2,0,0,0,0|2,0,0]=4 9033 B12R1.125 CC(O)CNc1ccccc1Br Amb17142610 [0,2,0,0,0,0|1,0,0]=3 9034 B12R1.125 CC(O)CNc1ccccc1Cl Amb17139125 [0,2,0,0,0,0|1,0,0]=3 9035 B12R1.125 CC(O)CNc1ccccc1F Amb17138650 [0,2,0,0,0,0|1,0,0]=3 9036 B12R1.125 CC(O)CNc1ccccc1I Amb28410519 [0,2,0,0,0,0|1,0,0]=3 9037 B12R1.125 CC(O)CNc1ccccc1N Amb9359006 [0,2,0,0,0,0|1,0,0]=3 9038 B12R1.125 CC(O)CNc1ccncc1Br Amb27654861 [0,2,0,0,0,0|2,0,0]=4 9039 B12R1.125 CC(O)CNc1ncccc1F Amb18300637 [0,2,0,0,0,0|2,0,0]=4 9040 B12R1.125 CC(O)CNc1ncccc1I Amb28126250 [0,2,0,0,0,0|2,0,0]=4 9041 B12R1.125 CC(O)CNc1ncccc1N Amb9359001 [0,2,0,0,0,0|2,0,0]=4 9042 B12R1.125 CC(O)COc1ccccc1Cl Amb25337460 [0,2,0,0,0,0|0,0,0]=2 9043 B12R1.125 CC(O)COc1ccccc1F Amb18806458 [0,2,0,0,0,0|0,0,0]=2 9044 B12R1.125 CC(O)COc1ccccc1N Amb18971553 [0,2,0,0,0,0|0,0,0]=2 9045 B12R1.125 CC(O)COc1cccnc1Br Amb28241064 [0,2,0,0,0,0|1,0,0]=3 9046 B12R1.125 CC(O)COc1cccnc1F Amb27814862 [0,2,0,0,0,0|1,0,0]=3 9047 B12R1.125 CC(O)CSc1ccccc1Cl Amb27477548 [0,2,0,0,0,0|0,1,0]=3 9048 B12R1.125 CC(O)CSc1ccncc1N Amb18969622 [0,2,0,0,0,0|1,1,0]=4 9049 B12R1.125 CC(O)CSc1ncccc1N Amb18969623 [0,2,0,0,0,0|1,1,0]=4 9050 B12R1.125 CC(O)CSc1ncccc1O Amb18649167 [0,2,0,0,0,0|1,1,0]=4 9051 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [0,2,0,0,0,0|1,0,1]=4 9052 B12R1.125 CC(O)\C=C\c1ccccc1Cl Amb26073532 [0,2,0,0,0,0|1,0,1]=4 9053 B12R1.125 CC(O)\C=C\c1ccccc1F Amb26539993 [0,2,0,0,0,0|1,0,1]=4 9054 B12R1.125 C[C@@H](N)CCc1ccccc1Br Amb33242308 [0,2,0,0,0,0|2,0,0]=4 9055 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb24117939 [0,2,0,0,0,0|2,0,0]=4 9056 B12R1.125 C[C@@H](N)CCc1ccccc1Cl Amb32750188 [0,2,0,0,0,0|2,0,0]=4 9057 B12R1.125 C[C@@H](N)CCc1ccccc1F Amb27817738 [0,2,0,0,0,0|2,0,0]=4 9058 B12R1.125 C[C@@H](N)CCc1ccccc1O Amb27830642 [0,2,0,0,0,0|2,0,0]=4 9059 B12R1.125 C[C@@H](N)COc1ccccc1Br Amb18036081 [0,2,0,0,0,0|1,0,0]=3 9060 B12R1.125 C[C@@H](N)COc1ccccc1Cl Amb18538518 [0,2,0,0,0,0|1,0,0]=3 9061 B12R1.125 C[C@@H](N)COc1ccccc1F Amb18538499 [0,2,0,0,0,0|1,0,0]=3 9062 B12R1.125 C[C@@H](N)COc1ccccc1I Amb29850634 [0,2,0,0,0,0|1,0,0]=3 9063 B12R1.125 C[C@@H](N)CSc1ccccc1Br Amb27847418 [0,2,0,0,0,0|1,1,0]=4 9064 B12R1.125 C[C@@H](N)CSc1ccccc1Cl Amb28430384 [0,2,0,0,0,0|1,1,0]=4 9065 B12R1.125 C[C@@H](N)CSc1ccccc1F Amb27663015 [0,2,0,0,0,0|1,1,0]=4 9066 B12R1.125 C[C@@H](O)CCc1ccccc1Br Amb33387630 [0,2,0,0,0,0|1,0,0]=3 9067 B12R1.125 C[C@@H](O)CCc1ccccc1Cl Amb33052597 [0,2,0,0,0,0|1,0,0]=3 9068 B12R1.125 C[C@@H](O)CCc1ccccc1F Amb33361481 [0,2,0,0,0,0|1,0,0]=3 9069 B12R1.125 C[C@@H](O)CCc1ccccc1O Amb33196173 [0,2,0,0,0,0|1,0,0]=3 9070 B12R1.125 C[C@@H](O)CCc1cccnc1Br Amb33387786 [0,2,0,0,0,0|2,0,0]=4 9071 B12R1.125 C[C@@H](O)CCc1cccnc1Cl Amb33257027 [0,2,0,0,0,0|2,0,0]=4 9072 B12R1.125 C[C@@H](O)CCc1cccnc1F Amb33377664 [0,2,0,0,0,0|2,0,0]=4 9073 B12R1.125 C[C@@H](O)CCc1ccncc1Br Amb33388260 [0,2,0,0,0,0|2,0,0]=4 9074 B12R1.125 C[C@@H](O)CCc1ccncc1Cl Amb33413792 [0,2,0,0,0,0|2,0,0]=4 9075 B12R1.125 C[C@@H](O)CCc1ccncc1F Amb33317437 [0,2,0,0,0,0|2,0,0]=4 9076 B12R1.125 C[C@@H](O)CCc1ncccc1Br Amb33336091 [0,2,0,0,0,0|2,0,0]=4 9077 B12R1.125 C[C@@H](O)CCc1ncccc1F Amb33418795 [0,2,0,0,0,0|2,0,0]=4 9078 B12R1.125 C[C@@H](O)CNc1ccccc1Cl Amb27848418 [0,2,0,0,0,0|1,0,0]=3 9079 B12R1.125 C[C@@H](O)CNc1ccncc1Cl Amb28065728 [0,2,0,0,0,0|2,0,0]=4 9080 B12R1.125 C[C@@H](O)CNc1ncccc1F Amb28350986 [0,2,0,0,0,0|2,0,0]=4 9081 B12R1.125 C[C@@H](O)CNc1ncccc1I Amb27982845 [0,2,0,0,0,0|2,0,0]=4 9082 B12R1.125 C[C@@H](O)COc1ccccc1F Amb27754541 [0,2,0,0,0,0|0,0,0]=2 9083 B12R1.125 C[C@@H](O)COc1ccccc1I Amb35687744 [0,2,0,0,0,0|0,0,0]=2 9084 B12R1.125 C[C@@H](O)CSc1ccccc1O Amb27466695 [0,2,0,0,0,0|0,1,0]=3 9085 B12R1.125 C[C@H](N)CCc1ccccc1Br Amb27812499 [0,2,0,0,0,0|2,0,0]=4 9086 B12R1.125 C[C@H](N)CCc1ccccc1Cl Amb24470862 [0,2,0,0,0,0|2,0,0]=4 9087 B12R1.125 C[C@H](N)CCc1ccccc1F Amb26946665 [0,2,0,0,0,0|2,0,0]=4 9088 B12R1.125 C[C@H](N)CCc1ccccc1N Amb28201211 [0,2,0,0,0,0|2,0,0]=4 9089 B12R1.125 C[C@H](N)CCc1ccccc1O Amb25149919 [0,2,0,0,0,0|2,0,0]=4 9090 B12R1.125 C[C@H](N)COc1ccccc1I Amb29850633 [0,2,0,0,0,0|1,0,0]=3 9091 B12R1.125 C[C@H](O)CCc1ccccc1Br Amb33387628 [0,2,0,0,0,0|1,0,0]=3 9092 B12R1.125 C[C@H](O)CCc1ccccc1Cl Amb33052594 [0,2,0,0,0,0|1,0,0]=3 9093 B12R1.125 C[C@H](O)CCc1ccccc1F Amb33361482 [0,2,0,0,0,0|1,0,0]=3 9094 B12R1.125 C[C@H](O)CCc1ccccc1O Amb33196408 [0,2,0,0,0,0|1,0,0]=3 9095 B12R1.125 C[C@H](O)CCc1cccnc1Br Amb33387783 [0,2,0,0,0,0|2,0,0]=4 9096 B12R1.125 C[C@H](O)CCc1cccnc1Cl Amb33257023 [0,2,0,0,0,0|2,0,0]=4 9097 B12R1.125 C[C@H](O)CCc1cccnc1F Amb33377665 [0,2,0,0,0,0|2,0,0]=4 9098 B12R1.125 C[C@H](O)CCc1ccncc1Br Amb33388502 [0,2,0,0,0,0|2,0,0]=4 9099 B12R1.125 C[C@H](O)CCc1ccncc1Cl Amb33413788 [0,2,0,0,0,0|2,0,0]=4 9100 B12R1.125 C[C@H](O)CCc1ccncc1F Amb33317438 [0,2,0,0,0,0|2,0,0]=4 9101 B12R1.125 C[C@H](O)CCc1ncccc1Br Amb33337344 [0,2,0,0,0,0|2,0,0]=4 9102 B12R1.125 C[C@H](O)CCc1ncccc1F Amb33418796 [0,2,0,0,0,0|2,0,0]=4 9103 B12R1.125 C[C@H](O)CNc1ccccc1Br Amb27213619 [0,2,0,0,0,0|1,0,0]=3 9104 B12R1.125 C[C@H](O)CNc1ccccc1Cl Amb28244269 [0,2,0,0,0,0|1,0,0]=3 9105 B12R1.125 C[C@H](O)COc1ccccc1Br Amb28244310 [0,2,0,0,0,0|0,0,0]=2 9106 B12R1.125 C[C@H](O)COc1ccccc1I Amb35687743 [0,2,0,0,0,0|0,0,0]=2 9107 B12R1.125 C[C@H](O)CSc1ncccc1Cl Amb28244219 [0,2,0,0,0,0|1,1,0]=4 9108 B12R1.125 Cc1ccccc1CCC(=O)O Amb2689629 [0,2,0,0,0,0|1,0,1]=4 9109 B12R1.125 Cc1ccccc1CCC(C)Br Amb27647242 [0,2,0,0,0,0|2,0,0]=4 9110 B12R1.125 Cc1ccccc1CCC(C)C Amb8394140 [0,2,0,0,0,0|2,0,0]=4 9111 B12R1.125 Cc1ccccc1CCC(C)N Amb9031759 [0,2,0,0,0,0|2,0,0]=4 9112 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [0,2,0,0,0,0|1,0,0]=3 9113 B12R1.125 Cc1ccccc1CC[C@@H](C)N Amb33225585 [0,2,0,0,0,0|2,0,0]=4 9114 B12R1.125 Cc1ccccc1CC[C@@H](C)O Amb33360566 [0,2,0,0,0,0|1,0,0]=3 9115 B12R1.125 Cc1ccccc1CC[C@H](C)N Amb26611454 [0,2,0,0,0,0|2,0,0]=4 9116 B12R1.125 Cc1ccccc1CC[C@H](C)O Amb33360567 [0,2,0,0,0,0|1,0,0]=3 9117 B12R1.125 Cc1ccccc1NCC(=O)O Amb1258286 [0,2,0,0,0,0|1,0,1]=4 9118 B12R1.125 Cc1ccccc1NCC(C)C Amb6701131 [0,2,0,0,0,0|2,0,0]=4 9119 B12R1.125 Cc1ccccc1NCC(C)N Amb25913696 [0,2,0,0,0,0|2,0,0]=4 9120 B12R1.125 Cc1ccccc1NCC(C)O Amb17138592 [0,2,0,0,0,0|1,0,0]=3 9121 B12R1.125 Cc1ccccc1NCC(C)S Amb27658986 [0,2,0,0,0,0|1,1,0]=4 9122 B12R1.125 Cc1ccccc1OCC(=N)N Amb10610301 [0,2,0,0,0,0|1,0,1]=4 9123 B12R1.125 Cc1ccccc1OCC(=N)N Amb6274243 [0,2,0,0,0,0|1,0,1]=4 9124 B12R1.125 Cc1ccccc1OCC(=O)Cl Amb10880009 [0,2,0,0,0,0|0,0,2]=4 9125 B12R1.125 Cc1ccccc1OCC(=O)O Amb1215022 [0,2,0,0,0,0|0,0,1]=3 9126 B12R1.125 Cc1ccccc1OCC(C)N Amb9756347 [0,2,0,0,0,0|1,0,0]=3 9127 B12R1.125 Cc1ccccc1OCC(C)O Amb18182639 [0,2,0,0,0,0|0,0,0]=2 9128 B12R1.125 Cc1ccccc1OCC(N)=O Amb6334508 [0,2,0,0,0,0|0,0,2]=4 9129 B12R1.125 Cc1ccccc1OCC(N)=S Amb2589370 [0,2,0,0,0,0|0,1,1]=4 9130 B12R1.125 Cc1ccccc1OC[C@@H](C)N Amb18538491 [0,2,0,0,0,0|1,0,0]=3 9131 B12R1.125 Cc1ccccc1OC[C@@H](C)O Amb27225582 [0,2,0,0,0,0|0,0,0]=2 9132 B12R1.125 Cc1ccccc1SCC(=O)O Amb1205492 [0,2,0,0,0,0|0,1,1]=4 9133 B12R1.125 Cc1ccccc1SCC(C)C Amb25730826 [0,2,0,0,0,0|1,1,0]=4 9134 B12R1.125 Cc1ccccc1SCC(F)F Amb27647884 [0,2,0,0,0,0|1,1,0]=4 9135 B12R1.125 Cc1ccccc1SC[C@@H](C)N Amb27879389 [0,2,0,0,0,0|1,1,0]=4 9136 B12R1.125 Cc1ccccc1SC[C@H](C)O Amb28075850 [0,2,0,0,0,0|0,1,0]=3 9137 B12R1.125 Cc1ccccc1\C=C\C(C)O Amb27748478 [0,2,0,0,0,0|1,0,1]=4 9138 B12R1.125 Cc1cccnc1CCC(C)O Amb27663089 [0,2,0,0,0,0|2,0,0]=4 9139 B12R1.125 Cc1cccnc1CC[C@@H](C)O Amb33428756 [0,2,0,0,0,0|2,0,0]=4 9140 B12R1.125 Cc1cccnc1CC[C@H](C)O Amb33428790 [0,2,0,0,0,0|2,0,0]=4 9141 B12R1.125 Cc1cccnc1OCC(=O)O Amb25154207 [0,2,0,0,0,0|1,0,1]=4 9142 B12R1.125 Cc1cccnc1OCC(C)N Amb35727579 [0,2,0,0,0,0|2,0,0]=4 9143 B12R1.125 Cc1cccnc1SC[C@@H](C)O Amb35678706 [0,2,0,0,0,0|1,1,0]=4 9144 B12R1.125 Cc1cccnc1SC[C@H](C)O Amb35678705 [0,2,0,0,0,0|1,1,0]=4 9145 B12R1.125 Cc1ccncc1CCC(C)O Amb27149348 [0,2,0,0,0,0|2,0,0]=4 9146 B12R1.125 Cc1ccncc1CC[C@@H](C)O Amb33376701 [0,2,0,0,0,0|2,0,0]=4 9147 B12R1.125 Cc1ccncc1CC[C@H](C)O Amb33377430 [0,2,0,0,0,0|2,0,0]=4 9148 B12R1.125 Cc1ccncc1OCC(=O)O Amb32946290 [0,2,0,0,0,0|1,0,1]=4 9149 B12R1.125 Cc1cnccc1CCC(C)O Amb25986351 [0,2,0,0,0,0|2,0,0]=4 9150 B12R1.125 Cc1cnccc1CC[C@@H](C)O Amb33414171 [0,2,0,0,0,0|2,0,0]=4 9151 B12R1.125 Cc1cnccc1CC[C@H](C)O Amb33414328 [0,2,0,0,0,0|2,0,0]=4 9152 B12R1.125 Cc1cnccc1NCC(C)O Amb27776003 [0,2,0,0,0,0|2,0,0]=4 9153 B12R1.125 Cc1cnccc1OCC(=O)O Amb25705533 [0,2,0,0,0,0|1,0,1]=4 9154 B12R1.125 Cc1cnccc1OCC(C)N Amb35727439 [0,2,0,0,0,0|2,0,0]=4 9155 B12R1.125 Cc1ncccc1CCC(C)O Amb26342122 [0,2,0,0,0,0|2,0,0]=4 9156 B12R1.125 Cc1ncccc1CC[C@@H](C)O Amb32878985 [0,2,0,0,0,0|2,0,0]=4 9157 B12R1.125 Cc1ncccc1CC[C@H](C)O Amb32878987 [0,2,0,0,0,0|2,0,0]=4 9158 B12R1.125 Cc1ncccc1OCC(=O)O Amb24729073 [0,2,0,0,0,0|1,0,1]=4 9159 B12R1.125 FC(F)CNc1ccccc1Cl Amb18320405 [0,2,0,0,0,0|2,0,0]=4 9160 B12R1.125 FC(F)COc1ccccc1Br Amb22008304 [0,2,0,0,0,0|1,0,0]=3 9161 B12R1.125 FC(F)COc1ccccc1Cl Amb27439521 [0,2,0,0,0,0|1,0,0]=3 9162 B12R1.125 FC(F)COc1cccnc1Br Amb28047030 [0,2,0,0,0,0|2,0,0]=4 9163 B12R1.125 FC(F)COc1cccnc1Cl Amb27614712 [0,2,0,0,0,0|2,0,0]=4 9164 B12R1.125 FC(F)COc1ncccc1Cl Amb26653540 [0,2,0,0,0,0|2,0,0]=4 9165 B12R1.125 FC(F)CSc1ccccc1Br Amb10976061 [0,2,0,0,0,0|1,1,0]=4 9166 B12R1.125 Fc1ccccc1NCC(F)F Amb18795536 [0,2,0,0,0,0|2,0,0]=4 9167 B12R1.125 Fc1ccccc1OCC(F)F Amb28383314 [0,2,0,0,0,0|1,0,0]=3 9168 B12R1.125 Fc1ccccc1SCC(Cl)Cl Amb27977314 [0,2,0,0,0,0|1,1,0]=4 9169 B12R1.125 N=C(N)COc1ccccc1Cl Amb2726041 [0,2,0,0,0,0|1,0,1]=4 9170 B12R1.125 N=C(N)COc1ccccc1Cl Amb6280413 [0,2,0,0,0,0|1,0,1]=4 9171 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,2,0,0,0,0|0,0,2]=4 9172 B12R1.125 NC(=O)COc1ccccc1Cl Amb3738387 [0,2,0,0,0,0|0,0,2]=4 9173 B12R1.125 NC(=O)COc1ccccc1F Amb8335270 [0,2,0,0,0,0|0,0,2]=4 9174 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,2,0,0,0,0|0,0,2]=4 9175 B12R1.125 NC(=O)COc1ccccc1N Amb6662641 [0,2,0,0,0,0|0,0,2]=4 9176 B12R1.125 NC(=O)COc1ccccc1O Amb8505284 [0,2,0,0,0,0|0,0,2]=4 9177 B12R1.125 NC(=S)COc1ccccc1Br Amb6278086 [0,2,0,0,0,0|0,1,1]=4 9178 B12R1.125 NC(=S)COc1ccccc1Cl Amb2725937 [0,2,0,0,0,0|0,1,1]=4 9179 B12R1.125 NC(=S)COc1ccccc1F Amb6278328 [0,2,0,0,0,0|0,1,1]=4 9180 B12R1.125 Nc1ccccc1CCC(=O)O Amb17477727 [0,2,0,0,0,0|1,0,1]=4 9181 B12R1.125 Nc1ccccc1CCC(=O)O Amb24118035 [0,2,0,0,0,0|1,0,1]=4 9182 B12R1.125 Nc1ccccc1CCC(F)F Amb27958848 [0,2,0,0,0,0|2,0,0]=4 9183 B12R1.125 Nc1ccccc1NCS(=O)O Amb27986124 [0,2,0,0,0,0|2,0,0]=4 9184 B12R1.125 Nc1ccccc1OCC(=O)O Amb4065760 [0,2,0,0,0,0|0,0,1]=3 9185 B12R1.125 Nc1ccccc1OCC(=O)[O-] Amb21972214 [0,2,0,0,0,0|0,0,2]=4 9186 B12R1.125 Nc1ccccc1OCC(F)F Amb6889913 [0,2,0,0,0,0|1,0,0]=3 9187 B12R1.125 Nc1ccccc1SCC(=O)O Amb6267584 [0,2,0,0,0,0|0,1,1]=4 9188 B12R1.125 Nc1ccccc1SCC(F)F Amb6890376 [0,2,0,0,0,0|1,1,0]=4 9189 B12R1.125 Nc1cccnc1OCC(F)F Amb22059739 [0,2,0,0,0,0|2,0,0]=4 9190 B12R1.125 Nc1ccncc1OCC(F)F Amb28280174 [0,2,0,0,0,0|2,0,0]=4 9191 B12R1.125 Nc1cnccc1OCC(F)F Amb25864088 [0,2,0,0,0,0|2,0,0]=4 9192 B12R1.125 Nc1ncccc1OCC(F)F Amb18795193 [0,2,0,0,0,0|2,0,0]=4 9193 B12R1.125 O=C(Br)COc1ccccc1Cl Amb27481125 [0,2,0,0,0,0|0,0,2]=4 9194 B12R1.125 O=C(Cl)COc1ccccc1Br Amb16230053 [0,2,0,0,0,0|0,0,2]=4 9195 B12R1.125 O=C(Cl)COc1ccccc1Cl Amb16230049 [0,2,0,0,0,0|0,0,2]=4 9196 B12R1.125 O=C(Cl)COc1ccccc1F Amb10880012 [0,2,0,0,0,0|0,0,2]=4 9197 B12R1.125 O=C(O)CCc1ccccc1Br Amb2685458 [0,2,0,0,0,0|1,0,1]=4 9198 B12R1.125 O=C(O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|1,0,1]=4 9199 B12R1.125 O=C(O)CCc1ccccc1F Amb6336154 [0,2,0,0,0,0|1,0,1]=4 9200 B12R1.125 O=C(O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|1,0,1]=4 9201 B12R1.125 O=C(O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|1,0,1]=4 9202 B12R1.125 O=C(O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|1,0,1]=4 9203 B12R1.125 O=C(O)CNc1ccccc1Br Amb840526 [0,2,0,0,0,0|1,0,1]=4 9204 B12R1.125 O=C(O)CNc1ccccc1Cl Amb33528017 [0,2,0,0,0,0|1,0,1]=4 9205 B12R1.125 O=C(O)CNc1ccccc1F Amb840521 [0,2,0,0,0,0|1,0,1]=4 9206 B12R1.125 O=C(O)CNc1ccccc1O Amb842591 [0,2,0,0,0,0|1,0,1]=4 9207 B12R1.125 O=C(O)COC1=CC=CCC1=S Amb28366613 [0,2,0,0,0,0|0,0,2]=4 9208 B12R1.125 O=C(O)COC1=CC=CNC1=O Amb32946096 [0,2,0,0,0,0|1,0,1]=4 9209 B12R1.125 O=C(O)COC1=CNC=CC1=O Amb27985853 [0,2,0,0,0,0|1,0,1]=4 9210 B12R1.125 O=C(O)COC1=COC=CC1=O Amb27875124 [0,2,0,0,0,0|1,0,1]=4 9211 B12R1.125 O=C(O)COc1ccccc1Br Amb6364728 [0,2,0,0,0,0|0,0,1]=3 9212 B12R1.125 O=C(O)COc1ccccc1Cl Amb6336452 [0,2,0,0,0,0|0,0,1]=3 9213 B12R1.125 O=C(O)COc1ccccc1F Amb6335614 [0,2,0,0,0,0|0,0,1]=3 9214 B12R1.125 O=C(O)COc1ccccc1I Amb9339538 [0,2,0,0,0,0|0,0,1]=3 9215 B12R1.125 O=C(O)COc1ccccc1O Amb1030005 [0,2,0,0,0,0|0,0,1]=3 9216 B12R1.125 O=C(O)COc1cccnc1Br Amb9768119 [0,2,0,0,0,0|1,0,1]=4 9217 B12R1.125 O=C(O)COc1cccnc1Cl Amb32946272 [0,2,0,0,0,0|1,0,1]=4 9218 B12R1.125 O=C(O)COc1cccnc1F Amb32946301 [0,2,0,0,0,0|1,0,1]=4 9219 B12R1.125 O=C(O)COc1ccncc1Br Amb26428934 [0,2,0,0,0,0|1,0,1]=4 9220 B12R1.125 O=C(O)COc1ccncc1Cl Amb25877223 [0,2,0,0,0,0|1,0,1]=4 9221 B12R1.125 O=C(O)COc1ccncc1F Amb32797349 [0,2,0,0,0,0|1,0,1]=4 9222 B12R1.125 O=C(O)COc1ncccc1Br Amb27967686 [0,2,0,0,0,0|1,0,1]=4 9223 B12R1.125 O=C(O)COc1ncccc1F Amb28139994 [0,2,0,0,0,0|1,0,1]=4 9224 B12R1.125 O=C(O)CSc1ccccc1Br Amb1113386 [0,2,0,0,0,0|0,1,1]=4 9225 B12R1.125 O=C(O)CSc1ccccc1Cl Amb1105912 [0,2,0,0,0,0|0,1,1]=4 9226 B12R1.125 O=C(O)CSc1ccccc1F Amb1105913 [0,2,0,0,0,0|0,1,1]=4 9227 B12R1.125 O=C(O)CSc1ccccc1O Amb18294823 [0,2,0,0,0,0|0,1,1]=4 9228 B12R1.125 OB(O)CCc1ccccc1Br Amb27986176 [0,2,0,0,0,0|2,0,0]=4 9229 B12R1.125 OB(O)CCc1ccccc1Cl Amb27639202 [0,2,0,0,0,0|2,0,0]=4 9230 B12R1.125 OB(O)CCc1ccccc1F Amb26016822 [0,2,0,0,0,0|2,0,0]=4 9231 B12R1.125 Oc1ccccc1OCC(F)F Amb18795191 [0,2,0,0,0,0|1,0,0]=3 9232 B12R1.267 BrCCCCc1ccccc1Br Amb34914026 [0,2,0,0,0,0|2,0,0]=4 9233 B12R1.267 BrCCCOc1ccccc1Br Amb8517103 [0,2,0,0,0,0|1,0,0]=3 9234 B12R1.267 Brc1ccccc1CCCCI Amb34914024 [0,2,0,0,0,0|2,0,0]=4 9235 B12R1.267 C#CCCNc1ccccc1Br Amb28133302 [0,2,0,0,0,0|2,0,0]=4 9236 B12R1.267 C#CCCNc1ccccc1I Amb27401663 [0,2,0,0,0,0|2,0,0]=4 9237 B12R1.267 C#CCCOc1cccc[n+]1[O-] Amb27756032 [0,2,0,0,0,0|2,0,0]=4 9238 B12R1.267 C#CCCOc1ccccc1C Amb27397416 [0,2,0,0,0,0|1,0,0]=3 9239 B12R1.267 C#CCCOc1ccccc1I Amb27869109 [0,2,0,0,0,0|1,0,0]=3 9240 B12R1.267 C#CCCOc1ccccc1N Amb18290041 [0,2,0,0,0,0|1,0,0]=3 9241 B12R1.267 C#CCCOc1cccnc1F Amb27473097 [0,2,0,0,0,0|2,0,0]=4 9242 B12R1.267 C=CCCCc1ccccc1Br Amb32654215 [0,2,0,0,0,0|2,0,0]=4 9243 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,2,0,0,0,0|1,0,0]=3 9244 B12R1.267 C=CCCOc1cccnc1Br Amb20241441 [0,2,0,0,0,0|2,0,0]=4 9245 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,2,0,0,0,0|1,0,1]=4 9246 B12R1.267 CC#CCOc1ccccc1Br Amb28366470 [0,2,0,0,0,0|1,0,1]=4 9247 B12R1.267 CC#CCOc1ccccc1Cl Amb27470986 [0,2,0,0,0,0|1,0,1]=4 9248 B12R1.267 CCCC#Cc1ccccc1Br Amb25676440 [0,2,0,0,0,0|2,0,0]=4 9249 B12R1.267 CCCC#Cc1ccccc1C Amb27599818 [0,2,0,0,0,0|2,0,0]=4 9250 B12R1.267 CCCC#Cc1ccccc1Cl Amb26347731 [0,2,0,0,0,0|2,0,0]=4 9251 B12R1.267 CCCC#Cc1ccccc1F Amb27952893 [0,2,0,0,0,0|2,0,0]=4 9252 B12R1.267 CCCC#Cc1ccccc1I Amb26861404 [0,2,0,0,0,0|2,0,0]=4 9253 B12R1.267 CCCC#Cc1ccccc1N Amb25238355 [0,2,0,0,0,0|2,0,0]=4 9254 B12R1.267 CCCC#Cc1ccccc1O Amb26883333 [0,2,0,0,0,0|2,0,0]=4 9255 B12R1.267 CCCCNc1ccccc1Br Amb6696452 [0,2,0,0,0,0|2,0,0]=4 9256 B12R1.267 CCCCNc1ccccc1C Amb4016420 [0,2,0,0,0,0|2,0,0]=4 9257 B12R1.267 CCCCNc1ccccc1Cl Amb4313689 [0,2,0,0,0,0|2,0,0]=4 9258 B12R1.267 CCCCNc1ccccc1F Amb6697370 [0,2,0,0,0,0|2,0,0]=4 9259 B12R1.267 CCCCNc1ccccc1N Amb7767737 [0,2,0,0,0,0|2,0,0]=4 9260 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,2,0,0,0,0|2,0,0]=4 9261 B12R1.267 CCCCOC1=CC=CNC1=O Amb18034630 [0,2,0,0,0,0|2,0,0]=4 9262 B12R1.267 CCCCOc1ccccc1Br Amb6272446 [0,2,0,0,0,0|1,0,0]=3 9263 B12R1.267 CCCCOc1ccccc1N Amb1033054 [0,2,0,0,0,0|1,0,0]=3 9264 B12R1.267 CCCCOc1ccccc1O Amb8837327 [0,2,0,0,0,0|1,0,0]=3 9265 B12R1.267 CCCCOc1cccnc1Cl Amb20242808 [0,2,0,0,0,0|2,0,0]=4 9266 B12R1.267 CCCCOc1cccnc1N Amb9208363 [0,2,0,0,0,0|2,0,0]=4 9267 B12R1.267 CCCCOc1ccncc1N Amb8895012 [0,2,0,0,0,0|2,0,0]=4 9268 B12R1.267 CCCCOc1cnccc1N Amb33035436 [0,2,0,0,0,0|2,0,0]=4 9269 B12R1.267 CCCCOc1ncccc1Cl Amb24308905 [0,2,0,0,0,0|2,0,0]=4 9270 B12R1.267 CCCCOc1ncccc1N Amb8895018 [0,2,0,0,0,0|2,0,0]=4 9271 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,2,0,0,0,0|2,0,0]=4 9272 B12R1.267 CCCNCc1ccccc1Br Amb6272793 [0,2,0,0,0,0|2,0,0]=4 9273 B12R1.267 CCCNCc1ccccc1C Amb6276128 [0,2,0,0,0,0|2,0,0]=4 9274 B12R1.267 CCCNCc1ccccc1C Amb6865254 [0,2,0,0,0,0|2,0,0]=4 9275 B12R1.267 CCCNCc1ccccc1Cl Amb6271434 [0,2,0,0,0,0|2,0,0]=4 9276 B12R1.267 CCCNCc1ccccc1Cl Amb6542582 [0,2,0,0,0,0|2,0,0]=4 9277 B12R1.267 CCCNCc1ccccc1F Amb6258177 [0,2,0,0,0,0|2,0,0]=4 9278 B12R1.267 CCCNCc1ccccc1F Amb6865253 [0,2,0,0,0,0|2,0,0]=4 9279 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,2,0,0,0,0|2,0,0]=4 9280 B12R1.267 CCCNCc1ccccc1O Amb6281040 [0,2,0,0,0,0|2,0,0]=4 9281 B12R1.267 CCCSCc1ccccc1Br Amb22228182 [0,2,0,0,0,0|1,1,0]=4 9282 B12R1.267 CCC\N=C\c1ccccc1O Amb24408352 [0,2,0,0,0,0|2,0,0]=4 9283 B12R1.267 CCNCCc1ccccc1C Amb8841498 [0,2,0,0,0,0|2,0,0]=4 9284 B12R1.267 CCNCCc1ccccc1Cl Amb8853702 [0,2,0,0,0,0|2,0,0]=4 9285 B12R1.267 CCNCCc1ccccc1F Amb6693099 [0,2,0,0,0,0|2,0,0]=4 9286 B12R1.267 CCOCOc1ccccc1Br Amb32729439 [0,2,0,0,0,0|1,0,0]=3 9287 B12R1.267 CNCCCc1ccccc1Br Amb17605546 [0,2,0,0,0,0|2,0,0]=4 9288 B12R1.267 CNCCCc1ccccc1C Amb17104499 [0,2,0,0,0,0|2,0,0]=4 9289 B12R1.267 CNCCCc1ccccc1Cl Amb17104507 [0,2,0,0,0,0|2,0,0]=4 9290 B12R1.267 CNCCCc1ccccc1F Amb17104502 [0,2,0,0,0,0|2,0,0]=4 9291 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,2,0,0,0,0|2,0,0]=4 9292 B12R1.267 CNCCOc1ccccc1Br Amb7798227 [0,2,0,0,0,0|1,0,0]=3 9293 B12R1.267 CNCCOc1ccccc1Br Amb8597811 [0,2,0,0,0,0|1,0,0]=3 9294 B12R1.267 CNCCOc1ccccc1C Amb1222745 [0,2,0,0,0,0|1,0,0]=3 9295 B12R1.267 CNCCOc1ccccc1C Amb2140560 [0,2,0,0,0,0|1,0,0]=3 9296 B12R1.267 CNCCOc1ccccc1Cl Amb1669286 [0,2,0,0,0,0|1,0,0]=3 9297 B12R1.267 CNCCOc1ccccc1Cl Amb34914122 [0,2,0,0,0,0|1,0,0]=3 9298 B12R1.267 CNCCOc1ccccc1F Amb1669285 [0,2,0,0,0,0|1,0,0]=3 9299 B12R1.267 CNCCOc1ccccc1N Amb17232613 [0,2,0,0,0,0|1,0,0]=3 9300 B12R1.267 COCC#Cc1ccccc1Br Amb28041413 [0,2,0,0,0,0|1,0,1]=4 9301 B12R1.267 COCC#Cc1ccccc1C Amb27617757 [0,2,0,0,0,0|1,0,1]=4 9302 B12R1.267 COCC#Cc1ccccc1Cl Amb25693189 [0,2,0,0,0,0|1,0,1]=4 9303 B12R1.267 COCC#Cc1ccccc1F Amb26597466 [0,2,0,0,0,0|1,0,1]=4 9304 B12R1.267 COCC#Cc1ccccc1I Amb26047613 [0,2,0,0,0,0|1,0,1]=4 9305 B12R1.267 COCC#Cc1ccccc1N Amb28121010 [0,2,0,0,0,0|1,0,1]=4 9306 B12R1.267 COCC#Cc1ccccc1O Amb27861309 [0,2,0,0,0,0|1,0,1]=4 9307 B12R1.267 COCCNc1ccccc1Br Amb6712141 [0,2,0,0,0,0|1,0,0]=3 9308 B12R1.267 COCCNc1ccccc1C Amb595420 [0,2,0,0,0,0|1,0,0]=3 9309 B12R1.267 COCCNc1ccccc1Cl Amb6712363 [0,2,0,0,0,0|1,0,0]=3 9310 B12R1.267 COCCNc1ccccc1F Amb6712555 [0,2,0,0,0,0|1,0,0]=3 9311 B12R1.267 COCCNc1ccccc1I Amb7785821 [0,2,0,0,0,0|1,0,0]=3 9312 B12R1.267 COCCNc1ccccc1N Amb7767474 [0,2,0,0,0,0|1,0,0]=3 9313 B12R1.267 COCCNc1cccnc1C Amb28043479 [0,2,0,0,0,0|2,0,0]=4 9314 B12R1.267 COCCNc1cccnc1Cl Amb27257672 [0,2,0,0,0,0|2,0,0]=4 9315 B12R1.267 COCCNc1cccnc1F Amb35725094 [0,2,0,0,0,0|2,0,0]=4 9316 B12R1.267 COCCNc1ccncc1Br Amb28120814 [0,2,0,0,0,0|2,0,0]=4 9317 B12R1.267 COCCNc1ccncc1F Amb30036543 [0,2,0,0,0,0|2,0,0]=4 9318 B12R1.267 COCCNc1ccncc1N Amb33529101 [0,2,0,0,0,0|2,0,0]=4 9319 B12R1.267 COCCNc1ncccc1Br Amb27837386 [0,2,0,0,0,0|2,0,0]=4 9320 B12R1.267 COCCNc1ncccc1F Amb18314046 [0,2,0,0,0,0|2,0,0]=4 9321 B12R1.267 COCCNc1ncccc1I Amb27805975 [0,2,0,0,0,0|2,0,0]=4 9322 B12R1.267 COCCNc1ncccc1N Amb9205201 [0,2,0,0,0,0|2,0,0]=4 9323 B12R1.267 COCCOc1ccccc1Br Amb6263904 [0,2,0,0,0,0|0,0,0]=2 9324 B12R1.267 COCCOc1ccccc1I Amb32413960 [0,2,0,0,0,0|0,0,0]=2 9325 B12R1.267 COCCOc1ccccc1N Amb22492333 [0,2,0,0,0,0|0,0,0]=2 9326 B12R1.267 COCCOc1ccccc1N Amb840085 [0,2,0,0,0,0|0,0,0]=2 9327 B12R1.267 COCCOc1ccccc1O Amb8837338 [0,2,0,0,0,0|0,0,0]=2 9328 B12R1.267 COCCOc1cccnc1Cl Amb22642366 [0,2,0,0,0,0|1,0,0]=3 9329 B12R1.267 COCCOc1ccncc1N Amb7765148 [0,2,0,0,0,0|1,0,0]=3 9330 B12R1.267 COCCOc1cnccc1N Amb33035236 [0,2,0,0,0,0|1,0,0]=3 9331 B12R1.267 COCCOc1ncccc1Br Amb19448504 [0,2,0,0,0,0|1,0,0]=3 9332 B12R1.267 COCCOc1ncccc1N Amb6251609 [0,2,0,0,0,0|1,0,0]=3 9333 B12R1.267 COCCOc1nccnc1Cl Amb19072138 [0,2,0,0,0,0|2,0,0]=4 9334 B12R1.267 COCCOc1nccnc1N Amb35789317 [0,2,0,0,0,0|2,0,0]=4 9335 B12R1.267 COCCOc1ncncc1N Amb33035446 [0,2,0,0,0,0|2,0,0]=4 9336 B12R1.267 COCOCc1ccccc1Br Amb21964629 [0,2,0,0,0,0|2,0,0]=4 9337 B12R1.267 COCOCc1ccccc1F Amb28464076 [0,2,0,0,0,0|2,0,0]=4 9338 B12R1.267 CSCCNc1ccccc1Br Amb27875069 [0,2,0,0,0,0|1,1,0]=4 9339 B12R1.267 CSCCNc1ccccc1I Amb28044651 [0,2,0,0,0,0|1,1,0]=4 9340 B12R1.267 CSCCNc1ccccc1N Amb27863236 [0,2,0,0,0,0|1,1,0]=4 9341 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,2,0,0,0,0|1,0,1]=4 9342 B12R1.267 Cc1ccccc1C=C=CCO Amb28435849 [0,2,0,0,0,0|1,0,1]=4 9343 B12R1.267 Cc1ccccc1CCCC#N Amb24502058 [0,2,0,0,0,0|2,0,0]=4 9344 B12R1.267 Cc1ccccc1CCCC=O Amb18645710 [0,2,0,0,0,0|1,0,1]=4 9345 B12R1.267 Cc1ccccc1CCCCBr Amb34914032 [0,2,0,0,0,0|2,0,0]=4 9346 B12R1.267 Cc1ccccc1CCCCN Amb17991254 [0,2,0,0,0,0|2,0,0]=4 9347 B12R1.267 Cc1ccccc1CCCCN Amb5735492 [0,2,0,0,0,0|2,0,0]=4 9348 B12R1.267 Cc1ccccc1CCCCO Amb34913207 [0,2,0,0,0,0|1,0,0]=3 9349 B12R1.267 Cc1ccccc1CCCCS Amb18564154 [0,2,0,0,0,0|1,1,0]=4 9350 B12R1.267 Cc1ccccc1CCCON Amb17089549 [0,2,0,0,0,0|1,0,0]=3 9351 B12R1.267 Cc1ccccc1CNCCN Amb9174055 [0,2,0,0,0,0|2,0,0]=4 9352 B12R1.267 Cc1ccccc1CNCCO Amb6865192 [0,2,0,0,0,0|1,0,0]=3 9353 B12R1.267 Cc1ccccc1CNCCO Amb7757032 [0,2,0,0,0,0|1,0,0]=3 9354 B12R1.267 Cc1ccccc1COCCN Amb17061814 [0,2,0,0,0,0|1,0,0]=3 9355 B12R1.267 Cc1ccccc1CSCCN Amb844773 [0,2,0,0,0,0|1,1,0]=4 9356 B12R1.267 Cc1ccccc1NCCC#N Amb2794093 [0,2,0,0,0,0|2,0,0]=4 9357 B12R1.267 Cc1ccccc1NCCCF Amb27757671 [0,2,0,0,0,0|2,0,0]=4 9358 B12R1.267 Cc1ccccc1NCCCN Amb17057721 [0,2,0,0,0,0|2,0,0]=4 9359 B12R1.267 Cc1ccccc1NCCCO Amb17306598 [0,2,0,0,0,0|1,0,0]=3 9360 B12R1.267 Cc1ccccc1OCCC#N Amb1635755 [0,2,0,0,0,0|1,0,0]=3 9361 B12R1.267 Cc1ccccc1OCCC=O Amb5731759 [0,2,0,0,0,0|0,0,1]=3 9362 B12R1.267 Cc1ccccc1OCCCBr Amb2795769 [0,2,0,0,0,0|1,0,0]=3 9363 B12R1.267 Cc1ccccc1OCCCCl Amb1141955 [0,2,0,0,0,0|1,0,0]=3 9364 B12R1.267 Cc1ccccc1OCCCN Amb1136099 [0,2,0,0,0,0|1,0,0]=3 9365 B12R1.267 Cc1ccccc1OCCCO Amb9370674 [0,2,0,0,0,0|0,0,0]=2 9366 B12R1.267 Cc1ccccc1OCCCS Amb17233940 [0,2,0,0,0,0|0,1,0]=3 9367 B12R1.267 Cc1ccccc1OCCNN Amb2282444 [0,2,0,0,0,0|1,0,0]=3 9368 B12R1.267 Cc1ccccc1OCCNN Amb2370790 [0,2,0,0,0,0|1,0,0]=3 9369 B12R1.267 Cc1ccccc1OCCNO Amb17088414 [0,2,0,0,0,0|0,0,0]=2 9370 B12R1.267 Cc1ccccc1OCCON Amb17088288 [0,2,0,0,0,0|0,0,0]=2 9371 B12R1.267 Cc1ccccc1OC\C=C/Cl Amb27658979 [0,2,0,0,0,0|1,0,1]=4 9372 B12R1.267 Cc1ccccc1OC\C=C\Cl Amb27215119 [0,2,0,0,0,0|1,0,1]=4 9373 B12R1.267 Cc1ccccc1SCCC=O Amb18178931 [0,2,0,0,0,0|0,1,1]=4 9374 B12R1.267 Cc1ccccc1\C=C\CCBr Amb17246876 [0,2,0,0,0,0|2,0,0]=4 9375 B12R1.267 Cc1ccccc1\C=C\CCCl Amb17233777 [0,2,0,0,0,0|2,0,0]=4 9376 B12R1.267 Cc1ccccc1\C=C\CCN Amb17232386 [0,2,0,0,0,0|2,0,0]=4 9377 B12R1.267 Cc1ccccc1\C=C\CCO Amb27978430 [0,2,0,0,0,0|1,0,0]=3 9378 B12R1.267 Cc1cccnc1OCCCN Amb18308492 [0,2,0,0,0,0|2,0,0]=4 9379 B12R1.267 Cc1ccncc1CNCCO Amb32663033 [0,2,0,0,0,0|2,0,0]=4 9380 B12R1.267 Cc1ccncc1OCCCN Amb33377410 [0,2,0,0,0,0|2,0,0]=4 9381 B12R1.267 Cc1cnccc1NCCCO Amb27426567 [0,2,0,0,0,0|2,0,0]=4 9382 B12R1.267 Cc1cnccc1OCCCN Amb33429247 [0,2,0,0,0,0|2,0,0]=4 9383 B12R1.267 Cc1ncccc1OCCCN Amb33358632 [0,2,0,0,0,0|2,0,0]=4 9384 B12R1.267 ClCCCOc1ccccc1Br Amb6260781 [0,2,0,0,0,0|1,0,0]=3 9385 B12R1.267 ClCCCOc1ccccc1Cl Amb1135755 [0,2,0,0,0,0|1,0,0]=3 9386 B12R1.267 ClCCCSc1ccccc1Cl Amb6662701 [0,2,0,0,0,0|1,1,0]=4 9387 B12R1.267 ClCC\C=C\c1ccccc1Cl Amb17237226 [0,2,0,0,0,0|2,0,0]=4 9388 B12R1.267 Clc1ccccc1CCCCBr Amb34914033 [0,2,0,0,0,0|2,0,0]=4 9389 B12R1.267 Clc1ccccc1OCCCBr Amb8517138 [0,2,0,0,0,0|1,0,0]=3 9390 B12R1.267 Clc1ccccc1\C=C\CCBr Amb17258089 [0,2,0,0,0,0|2,0,0]=4 9391 B12R1.267 Fc1ccccc1C#CCCCl Amb19074251 [0,2,0,0,0,0|2,0,0]=4 9392 B12R1.267 Fc1ccccc1CCCCBr Amb34914037 [0,2,0,0,0,0|2,0,0]=4 9393 B12R1.267 Fc1ccccc1CCCCI Amb34914090 [0,2,0,0,0,0|2,0,0]=4 9394 B12R1.267 Fc1ccccc1CCCCS Amb18066143 [0,2,0,0,0,0|1,1,0]=4 9395 B12R1.267 Fc1ccccc1OCCCBr Amb7089048 [0,2,0,0,0,0|1,0,0]=3 9396 B12R1.267 Fc1ccccc1OCCCCl Amb1131839 [0,2,0,0,0,0|1,0,0]=3 9397 B12R1.267 Fc1ccccc1OCCCS Amb17234296 [0,2,0,0,0,0|0,1,0]=3 9398 B12R1.267 Fc1ccccc1\C=C\CCBr Amb17248420 [0,2,0,0,0,0|2,0,0]=4 9399 B12R1.267 Fc1ccccc1\C=C\CCCl Amb17234150 [0,2,0,0,0,0|2,0,0]=4 9400 B12R1.267 N#CCCCc1ccccc1Br Amb25732390 [0,2,0,0,0,0|2,0,0]=4 9401 B12R1.267 N#CCCCc1ccccc1Cl Amb28057145 [0,2,0,0,0,0|2,0,0]=4 9402 B12R1.267 N#CCCCc1ccccc1F Amb27394350 [0,2,0,0,0,0|2,0,0]=4 9403 B12R1.267 N#CCCNc1ccccc1Br Amb7094593 [0,2,0,0,0,0|2,0,0]=4 9404 B12R1.267 N#CCCNc1ccccc1Cl Amb2794094 [0,2,0,0,0,0|2,0,0]=4 9405 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,2,0,0,0,0|2,0,0]=4 9406 B12R1.267 N#CCCNc1ccccc1I Amb9202488 [0,2,0,0,0,0|2,0,0]=4 9407 B12R1.267 N#CCCNc1ccccc1O Amb4401572 [0,2,0,0,0,0|2,0,0]=4 9408 B12R1.267 N#CCCOc1cccc[n+]1[O-] Amb28043744 [0,2,0,0,0,0|2,0,0]=4 9409 B12R1.267 N#CCCOc1ccccc1Br Amb6263050 [0,2,0,0,0,0|1,0,0]=3 9410 B12R1.267 N#CCCOc1ccccc1Cl Amb356216 [0,2,0,0,0,0|1,0,0]=3 9411 B12R1.267 N#CCCOc1ccccc1F Amb1148995 [0,2,0,0,0,0|1,0,0]=3 9412 B12R1.267 N#CCCOc1ccccc1N Amb18971549 [0,2,0,0,0,0|1,0,0]=3 9413 B12R1.267 N#CCCSc1ccccc1F Amb2779413 [0,2,0,0,0,0|1,1,0]=4 9414 B12R1.267 N#CCCSc1ccccc1N Amb4477155 [0,2,0,0,0,0|1,1,0]=4 9415 B12R1.267 N#CCOCc1ccccc1F Amb27165383 [0,2,0,0,0,0|1,0,1]=4 9416 B12R1.267 NCCC#Cc1ccccc1F Amb28318487 [0,2,0,0,0,0|2,0,0]=4 9417 B12R1.267 NCCCCc1ccccc1Br Amb18069064 [0,2,0,0,0,0|2,0,0]=4 9418 B12R1.267 NCCCCc1ccccc1Cl Amb22904185 [0,2,0,0,0,0|2,0,0]=4 9419 B12R1.267 NCCCCc1ccccc1Cl Amb5735501 [0,2,0,0,0,0|2,0,0]=4 9420 B12R1.267 NCCCCc1ccccc1F Amb18524598 [0,2,0,0,0,0|2,0,0]=4 9421 B12R1.267 NCCCCc1ccccc1F Amb5735495 [0,2,0,0,0,0|2,0,0]=4 9422 B12R1.267 NCCCCc1ccccc1O Amb18828230 [0,2,0,0,0,0|2,0,0]=4 9423 B12R1.267 NCCCNc1ccccc1Br Amb27226464 [0,2,0,0,0,0|2,0,0]=4 9424 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,2,0,0,0,0|2,0,0]=4 9425 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,2,0,0,0,0|2,0,0]=4 9426 B12R1.267 NCCCNc1ccccc1F Amb32718812 [0,2,0,0,0,0|2,0,0]=4 9427 B12R1.267 NCCCOc1ccccc1Br Amb6267751 [0,2,0,0,0,0|1,0,0]=3 9428 B12R1.267 NCCCOc1ccccc1Cl Amb5731731 [0,2,0,0,0,0|1,0,0]=3 9429 B12R1.267 NCCCOc1ccccc1F Amb1107911 [0,2,0,0,0,0|1,0,0]=3 9430 B12R1.267 NCCCOc1ccccc1F Amb1221365 [0,2,0,0,0,0|1,0,0]=3 9431 B12R1.267 NCCCOc1ccccc1O Amb33226613 [0,2,0,0,0,0|1,0,0]=3 9432 B12R1.267 NCCCOc1cccnc1Br Amb33451406 [0,2,0,0,0,0|2,0,0]=4 9433 B12R1.267 NCCCOc1cccnc1Cl Amb33257706 [0,2,0,0,0,0|2,0,0]=4 9434 B12R1.267 NCCCOc1cccnc1F Amb33080042 [0,2,0,0,0,0|2,0,0]=4 9435 B12R1.267 NCCCOc1ccncc1Br Amb33452049 [0,2,0,0,0,0|2,0,0]=4 9436 B12R1.267 NCCCOc1ccncc1Cl Amb33261419 [0,2,0,0,0,0|2,0,0]=4 9437 B12R1.267 NCCCOc1ccncc1F Amb33317416 [0,2,0,0,0,0|2,0,0]=4 9438 B12R1.267 NCCCOc1ncccc1Br Amb18308525 [0,2,0,0,0,0|2,0,0]=4 9439 B12R1.267 NCCCOc1ncccc1F Amb19029670 [0,2,0,0,0,0|2,0,0]=4 9440 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,2,0,0,0,0|2,0,0]=4 9441 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,2,0,0,0,0|2,0,0]=4 9442 B12R1.267 NCCNCc1ccccc1Cl Amb29844472 [0,2,0,0,0,0|2,0,0]=4 9443 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,2,0,0,0,0|2,0,0]=4 9444 B12R1.267 NCCNCc1ccccc1F Amb29844475 [0,2,0,0,0,0|2,0,0]=4 9445 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,2,0,0,0,0|2,0,0]=4 9446 B12R1.267 NCCOCc1ccccc1Cl Amb6335301 [0,2,0,0,0,0|1,0,0]=3 9447 B12R1.267 NCCOCc1ccccc1Cl Amb6880857 [0,2,0,0,0,0|1,0,0]=3 9448 B12R1.267 NCCOCc1ccccc1F Amb17061817 [0,2,0,0,0,0|1,0,0]=3 9449 B12R1.267 NCCSCc1ccccc1Cl Amb844775 [0,2,0,0,0,0|1,1,0]=4 9450 B12R1.267 NCCSCc1ccccc1F Amb431326 [0,2,0,0,0,0|1,1,0]=4 9451 B12R1.267 NCCSCc1ccccc1F Amb9677309 [0,2,0,0,0,0|1,1,0]=4 9452 B12R1.267 NCC\C=C\c1ccccc1Cl Amb17233874 [0,2,0,0,0,0|2,0,0]=4 9453 B12R1.267 NCC\C=C\c1ccccc1F Amb17232531 [0,2,0,0,0,0|2,0,0]=4 9454 B12R1.267 NCC\C=C\c1ccccc1O Amb27965289 [0,2,0,0,0,0|2,0,0]=4 9455 B12R1.267 NCC\N=C\c1ccccc1Cl Amb28119784 [0,2,0,0,0,0|2,0,0]=4 9456 B12R1.267 NNCCOc1ccccc1Br Amb17407554 [0,2,0,0,0,0|1,0,0]=3 9457 B12R1.267 NNCCOc1ccccc1Cl Amb1114795 [0,2,0,0,0,0|1,0,0]=3 9458 B12R1.267 NNCCOc1ccccc1F Amb17400321 [0,2,0,0,0,0|1,0,0]=3 9459 B12R1.267 NOCC#Cc1ccccc1F Amb25773644 [0,2,0,0,0,0|1,0,1]=4 9460 B12R1.267 NOCCCc1ccccc1Cl Amb17089558 [0,2,0,0,0,0|1,0,0]=3 9461 B12R1.267 NOCCCc1ccccc1F Amb17089552 [0,2,0,0,0,0|1,0,0]=3 9462 B12R1.267 NOCCOc1ccccc1Br Amb17088297 [0,2,0,0,0,0|0,0,0]=2 9463 B12R1.267 NOCCOc1ccccc1Cl Amb17088294 [0,2,0,0,0,0|0,0,0]=2 9464 B12R1.267 NOCCOc1ccccc1F Amb17088291 [0,2,0,0,0,0|0,0,0]=2 9465 B12R1.267 Nc1ccccc1C#CCCO Amb27193050 [0,2,0,0,0,0|1,0,0]=3 9466 B12R1.267 Nc1ccccc1C\C=C\CO Amb28290910 [0,2,0,0,0,0|1,0,1]=4 9467 B12R1.267 Nc1ccccc1NCCCF Amb27656342 [0,2,0,0,0,0|2,0,0]=4 9468 B12R1.267 Nc1ccccc1NCCCO Amb8997320 [0,2,0,0,0,0|1,0,0]=3 9469 B12R1.267 Nc1ccccc1N\C=C\CO Amb27866483 [0,2,0,0,0,0|1,0,1]=4 9470 B12R1.267 Nc1ccccc1OCCCF Amb23539407 [0,2,0,0,0,0|1,0,0]=3 9471 B12R1.267 Nc1ccccc1OCCCO Amb8842578 [0,2,0,0,0,0|0,0,0]=2 9472 B12R1.267 Nc1ccccc1OC\C=C\Cl Amb18971536 [0,2,0,0,0,0|1,0,1]=4 9473 B12R1.267 Nc1ccccc1\N=C\CCO Amb25892253 [0,2,0,0,0,0|1,0,0]=3 9474 B12R1.267 Nc1cccnc1NCCCO Amb8997316 [0,2,0,0,0,0|2,0,0]=4 9475 B12R1.267 Nc1cccnc1OCCCO Amb8842581 [0,2,0,0,0,0|1,0,0]=3 9476 B12R1.267 Nc1ccncc1OCCCO Amb33035572 [0,2,0,0,0,0|1,0,0]=3 9477 B12R1.267 Nc1cnccc1NCCCO Amb8858224 [0,2,0,0,0,0|2,0,0]=4 9478 B12R1.267 Nc1cnccc1OCCCO Amb8842572 [0,2,0,0,0,0|1,0,0]=3 9479 B12R1.267 Nc1cnccc1SCCCO Amb8930653 [0,2,0,0,0,0|1,1,0]=4 9480 B12R1.267 Nc1cncnc1OCCCO Amb33035630 [0,2,0,0,0,0|2,0,0]=4 9481 B12R1.267 Nc1ncccc1NCCCO Amb28070508 [0,2,0,0,0,0|2,0,0]=4 9482 B12R1.267 Nc1ncccc1OCCCO Amb17206812 [0,2,0,0,0,0|1,0,0]=3 9483 B12R1.267 O=CCCCc1ccccc1Br Amb33451106 [0,2,0,0,0,0|1,0,1]=4 9484 B12R1.267 O=CCCCc1ccccc1Cl Amb32750392 [0,2,0,0,0,0|1,0,1]=4 9485 B12R1.267 O=CCCCc1ccccc1F Amb33474216 [0,2,0,0,0,0|1,0,1]=4 9486 B12R1.267 O=CCCCc1ccccc1O Amb18646065 [0,2,0,0,0,0|1,0,1]=4 9487 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|0,0,1]=3 9488 B12R1.267 O=CCCOc1ccccc1Cl Amb5731775 [0,2,0,0,0,0|0,0,1]=3 9489 B12R1.267 O=CCCSc1ccccc1Br Amb32682705 [0,2,0,0,0,0|0,1,1]=4 9490 B12R1.267 O=CCCSc1ccccc1Cl Amb18317016 [0,2,0,0,0,0|0,1,1]=4 9491 B12R1.267 O=CCCSc1ccccc1F Amb19045412 [0,2,0,0,0,0|0,1,1]=4 9492 B12R1.267 OCCC#Cc1ccccc1Cl Amb18796383 [0,2,0,0,0,0|1,0,0]=3 9493 B12R1.267 OCCCCc1ccccc1Br Amb34003425 [0,2,0,0,0,0|1,0,0]=3 9494 B12R1.267 OCCCCc1ccccc1Cl Amb4037443 [0,2,0,0,0,0|1,0,0]=3 9495 B12R1.267 OCCCCc1ccccc1F Amb34913201 [0,2,0,0,0,0|1,0,0]=3 9496 B12R1.267 OCCCNc1cccc[n+]1O Amb17308217 [0,2,0,0,0,0|2,0,0]=4 9497 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|1,0,0]=3 9498 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|1,0,0]=3 9499 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|1,0,0]=3 9500 B12R1.267 OCCCNc1ccccc1I Amb27395286 [0,2,0,0,0,0|1,0,0]=3 9501 B12R1.267 OCCCNc1ccncc1Cl Amb27586446 [0,2,0,0,0,0|2,0,0]=4 9502 B12R1.267 OCCCNc1ccncc1F Amb30020353 [0,2,0,0,0,0|2,0,0]=4 9503 B12R1.267 OCCCNc1ncccc1Br Amb19015766 [0,2,0,0,0,0|2,0,0]=4 9504 B12R1.267 OCCCNc1ncccc1Cl Amb6634671 [0,2,0,0,0,0|2,0,0]=4 9505 B12R1.267 OCCCNc1ncccc1I Amb27437129 [0,2,0,0,0,0|2,0,0]=4 9506 B12R1.267 OCCCOc1ccccc1Br Amb9247656 [0,2,0,0,0,0|0,0,0]=2 9507 B12R1.267 OCCCOc1ccccc1Cl Amb9247633 [0,2,0,0,0,0|0,0,0]=2 9508 B12R1.267 OCCCOc1ccccc1F Amb9370652 [0,2,0,0,0,0|0,0,0]=2 9509 B12R1.267 OCCNCc1ccccc1Br Amb9203175 [0,2,0,0,0,0|1,0,0]=3 9510 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|1,0,0]=3 9511 B12R1.267 OCCNCc1ccccc1Cl Amb2721952 [0,2,0,0,0,0|1,0,0]=3 9512 B12R1.267 OCCNCc1ccccc1F Amb2592100 [0,2,0,0,0,0|1,0,0]=3 9513 B12R1.267 OCCNCc1ccccc1F Amb6865191 [0,2,0,0,0,0|1,0,0]=3 9514 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|1,0,0]=3 9515 B12R1.267 OCCNCc1cccnc1Cl Amb24048984 [0,2,0,0,0,0|2,0,0]=4 9516 B12R1.267 OCCNCc1cccnc1Cl Amb28538933 [0,2,0,0,0,0|2,0,0]=4 9517 B12R1.267 OCCSCc1ccccc1F Amb3568982 [0,2,0,0,0,0|0,1,0]=3 9518 B12R1.267 OCC\N=C/c1ccccc1O Amb28122440 [0,2,0,0,0,0|1,0,0]=3 9519 B12R1.267 OCC\N=C\c1cccnc1Cl Amb30623475 [0,2,0,0,0,0|2,0,0]=4 9520 B12R1.267 ONCCOc1ccccc1Br Amb17088423 [0,2,0,0,0,0|0,0,0]=2 9521 B12R1.267 ONCCOc1ccccc1Cl Amb17088420 [0,2,0,0,0,0|0,0,0]=2 9522 B12R1.267 ONCCOc1ccccc1F Amb17088417 [0,2,0,0,0,0|0,0,0]=2 9523 B12R1.267 Oc1ccccc1\C=N\CCS Amb26317394 [0,2,0,0,0,0|1,1,0]=4 9524 B12R1.267 SCCCCc1ccccc1Br Amb18576923 [0,2,0,0,0,0|1,1,0]=4 9525 B12R1.267 SCCCCc1ccccc1Cl Amb18066299 [0,2,0,0,0,0|1,1,0]=4 9526 B12R1.267 SCCCNc1ccccc1S Amb27667794 [0,2,0,0,0,0|1,1,0]=4 9527 B12R1.267 SCCCOc1ccccc1Br Amb17258957 [0,2,0,0,0,0|0,1,0]=3 9528 B12R1.267 SCCCOc1ccccc1Cl Amb17237588 [0,2,0,0,0,0|0,1,0]=3 9529 B12R1.267 [C-]#[N+]CCOc1ccccc1C Amb28435228 [0,2,0,0,0,0|1,0,0]=3 9530 B12R1.267 [C-]#[N+]CCOc1ccccc1Cl Amb27958954 [0,2,0,0,0,0|1,0,0]=3 9531 B12R1.267 [C-]#[N+]CCOc1ccccc1O Amb27429201 [0,2,0,0,0,0|1,0,0]=3 9532 B12R1.267 [C-]#[N+]CCSc1ccccc1F Amb27660770 [0,2,0,0,0,0|1,1,0]=4 9533 B12R1.371 C=CC(C)Oc1ccccc1Cl Amb27949950 [0,2,0,0,0,0|1,0,1]=4 9534 B12R1.371 C=CC(C)Oc1ccccc1F Amb26015971 [0,2,0,0,0,0|1,0,1]=4 9535 B12R1.371 C=CC(C)Oc1ccccc1I Amb27793487 [0,2,0,0,0,0|1,0,1]=4 9536 B12R1.371 C=CC(C)Oc1ccccc1N Amb24100513 [0,2,0,0,0,0|1,0,1]=4 9537 B12R1.371 CC(C#N)Oc1ccccc1I Amb27830233 [0,2,0,0,0,0|1,0,1]=4 9538 B12R1.371 CC(C#N)Oc1ccccc1N Amb18283546 [0,2,0,0,0,0|1,0,1]=4 9539 B12R1.371 CC(C=O)Oc1ccccc1Br Amb30020613 [0,2,0,0,0,0|0,0,2]=4 9540 B12R1.371 CC(C=O)Oc1ccccc1F Amb35737124 [0,2,0,0,0,0|0,0,2]=4 9541 B12R1.371 CC(C=O)Oc1ccccc1I Amb30020615 [0,2,0,0,0,0|0,0,2]=4 9542 B12R1.371 CC(CBr)Cc1ccccc1Br Amb25040689 [0,2,0,0,0,0|2,0,0]=4 9543 B12R1.371 CC(CBr)Cc1ccccc1Cl Amb28043482 [0,2,0,0,0,0|2,0,0]=4 9544 B12R1.371 CC(CBr)Cc1ccccc1F Amb25741700 [0,2,0,0,0,0|2,0,0]=4 9545 B12R1.371 CC(CBr)Oc1ccccc1Cl Amb17261129 [0,2,0,0,0,0|1,0,0]=3 9546 B12R1.371 CC(CBr)Oc1ccccc1F Amb17250549 [0,2,0,0,0,0|1,0,0]=3 9547 B12R1.371 CC(CCl)Cc1ccccc1Br Amb26645125 [0,2,0,0,0,0|2,0,0]=4 9548 B12R1.371 CC(CCl)Cc1ccccc1Cl Amb25997478 [0,2,0,0,0,0|2,0,0]=4 9549 B12R1.371 CC(CCl)Cc1ccccc1F Amb25349982 [0,2,0,0,0,0|2,0,0]=4 9550 B12R1.371 CC(CCl)Oc1ccccc1Br Amb17261132 [0,2,0,0,0,0|1,0,0]=3 9551 B12R1.371 CC(CCl)Oc1ccccc1Cl Amb17238289 [0,2,0,0,0,0|1,0,0]=3 9552 B12R1.371 CC(CCl)Oc1ccccc1F Amb17234613 [0,2,0,0,0,0|1,0,0]=3 9553 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [0,2,0,0,0,0|2,0,0]=4 9554 B12R1.371 CC(CN)Cc1ccccc1Cl Amb5743846 [0,2,0,0,0,0|2,0,0]=4 9555 B12R1.371 CC(CN)Cc1ccccc1F Amb5743840 [0,2,0,0,0,0|2,0,0]=4 9556 B12R1.371 CC(CN)Nc1ccccc1Br Amb28118354 [0,2,0,0,0,0|2,0,0]=4 9557 B12R1.371 CC(CN)Oc1ccccc1Br Amb33530517 [0,2,0,0,0,0|1,0,0]=3 9558 B12R1.371 CC(CN)Oc1ccccc1Cl Amb19148877 [0,2,0,0,0,0|1,0,0]=3 9559 B12R1.371 CC(CN)Oc1ccccc1Cl Amb2607674 [0,2,0,0,0,0|1,0,0]=3 9560 B12R1.371 CC(CN)Oc1ccccc1F Amb18299438 [0,2,0,0,0,0|1,0,0]=3 9561 B12R1.371 CC(CN)Sc1ccccc1F Amb18992820 [0,2,0,0,0,0|1,1,0]=4 9562 B12R1.371 CC(CN)Sc1ccccc1N Amb18909296 [0,2,0,0,0,0|1,1,0]=4 9563 B12R1.371 CC(CO)CN1C=CC=CC1=O Amb27178441 [0,2,0,0,0,0|2,0,0]=4 9564 B12R1.371 CC(CO)Cc1ccccc1F Amb26508993 [0,2,0,0,0,0|1,0,0]=3 9565 B12R1.371 CC(CO)Cc1ccccc1O Amb28061434 [0,2,0,0,0,0|1,0,0]=3 9566 B12R1.371 CC(CO)Cc1ccncc1Cl Amb27485264 [0,2,0,0,0,0|2,0,0]=4 9567 B12R1.371 CC(CO)Cc1cnccc1N Amb27412840 [0,2,0,0,0,0|2,0,0]=4 9568 B12R1.371 CC(CO)Nc1ccccc1Cl Amb18971813 [0,2,0,0,0,0|1,0,0]=3 9569 B12R1.371 CC(CO)Nc1ccccc1I Amb28369198 [0,2,0,0,0,0|1,0,0]=3 9570 B12R1.371 CC(CO)Nc1ccncc1Cl Amb27967181 [0,2,0,0,0,0|2,0,0]=4 9571 B12R1.371 CC(CO)Nc1ncccc1I Amb25681220 [0,2,0,0,0,0|2,0,0]=4 9572 B12R1.371 CC(CO)Oc1ccccc1Br Amb17249276 [0,2,0,0,0,0|0,0,0]=2 9573 B12R1.371 CC(CO)Oc1ccccc1Cl Amb17234356 [0,2,0,0,0,0|0,0,0]=2 9574 B12R1.371 CC(CO)Oc1ccccc1F Amb17232739 [0,2,0,0,0,0|0,0,0]=2 9575 B12R1.371 CC(CO)Oc1ccccc1I Amb25828459 [0,2,0,0,0,0|0,0,0]=2 9576 B12R1.371 CC(CO)Sc1ccccc1Br Amb27755752 [0,2,0,0,0,0|0,1,0]=3 9577 B12R1.371 CC(CO)Sc1ccccc1O Amb27869464 [0,2,0,0,0,0|0,1,0]=3 9578 B12R1.371 CC(CO)Sc1ccncc1F Amb35737122 [0,2,0,0,0,0|1,1,0]=4 9579 B12R1.371 CC(CO)Sc1ncccc1Cl Amb27664031 [0,2,0,0,0,0|1,1,0]=4 9580 B12R1.371 CC(CO)Sc1ncccc1F Amb28347864 [0,2,0,0,0,0|1,1,0]=4 9581 B12R1.371 CC(Cc1ccccc1O)NO Amb28074598 [0,2,0,0,0,0|2,0,0]=4 9582 B12R1.371 CCC(=O)Oc1ccccc1Br Amb26609039 [0,2,0,0,0,0|1,0,1]=4 9583 B12R1.371 CCC(=O)Oc1ccccc1Cl Amb3123529 [0,2,0,0,0,0|1,0,1]=4 9584 B12R1.371 CCC(=O)Oc1ccccc1F Amb25039137 [0,2,0,0,0,0|1,0,1]=4 9585 B12R1.371 CCC(=O)Oc1ccccc1I Amb27752759 [0,2,0,0,0,0|1,0,1]=4 9586 B12R1.371 CCC(=O)Oc1ccccc1O Amb22167293 [0,2,0,0,0,0|1,0,1]=4 9587 B12R1.371 CCC(C)Cc1ccccc1O Amb27177732 [0,2,0,0,0,0|2,0,0]=4 9588 B12R1.371 CCC(C)Nc1ccccc1Br Amb6696460 [0,2,0,0,0,0|2,0,0]=4 9589 B12R1.371 CCC(C)Nc1ccccc1C Amb6701228 [0,2,0,0,0,0|2,0,0]=4 9590 B12R1.371 CCC(C)Nc1ccccc1Cl Amb6696915 [0,2,0,0,0,0|2,0,0]=4 9591 B12R1.371 CCC(C)Nc1ccccc1F Amb6697377 [0,2,0,0,0,0|2,0,0]=4 9592 B12R1.371 CCC(C)Nc1ccccc1I Amb7785642 [0,2,0,0,0,0|2,0,0]=4 9593 B12R1.371 CCC(C)Nc1ccccc1O Amb27760304 [0,2,0,0,0,0|2,0,0]=4 9594 B12R1.371 CCC(C)Oc1ccccc1C Amb28364230 [0,2,0,0,0,0|1,0,0]=3 9595 B12R1.371 CCC(C)Oc1ccccc1Cl Amb27175754 [0,2,0,0,0,0|1,0,0]=3 9596 B12R1.371 CCC(C)Oc1ccccc1N Amb9702145 [0,2,0,0,0,0|1,0,0]=3 9597 B12R1.371 CCC(C)Oc1cccnc1Cl Amb27493823 [0,2,0,0,0,0|2,0,0]=4 9598 B12R1.371 CCC(C)Oc1ccncc1N Amb18289484 [0,2,0,0,0,0|2,0,0]=4 9599 B12R1.371 CCC(C)Oc1cnccc1N Amb25978541 [0,2,0,0,0,0|2,0,0]=4 9600 B12R1.371 CCC(C)Oc1ncccc1N Amb17093706 [0,2,0,0,0,0|2,0,0]=4 9601 B12R1.371 CCC(C)Sc1ccccc1Br Amb27835038 [0,2,0,0,0,0|1,1,0]=4 9602 B12R1.371 CCC(Cl)Cc1ccccc1C Amb17477425 [0,2,0,0,0,0|2,0,0]=4 9603 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [0,2,0,0,0,0|2,0,0]=4 9604 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [0,2,0,0,0,0|2,0,0]=4 9605 B12R1.371 CCC(N)Cc1ccccc1Br Amb9428862 [0,2,0,0,0,0|2,0,0]=4 9606 B12R1.371 CCC(N)Cc1ccccc1C Amb9428910 [0,2,0,0,0,0|2,0,0]=4 9607 B12R1.371 CCC(N)Cc1ccccc1Cl Amb9428938 [0,2,0,0,0,0|2,0,0]=4 9608 B12R1.371 CCC(N)Cc1ccccc1F Amb9428867 [0,2,0,0,0,0|2,0,0]=4 9609 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [0,2,0,0,0,0|2,0,0]=4 9610 B12R1.371 CCC(O)Cc1ccccc1C Amb17138581 [0,2,0,0,0,0|2,0,0]=4 9611 B12R1.371 CCC(O)Cc1ccccc1Cl Amb17139101 [0,2,0,0,0,0|2,0,0]=4 9612 B12R1.371 CCC(O)Cc1ccccc1F Amb17138635 [0,2,0,0,0,0|2,0,0]=4 9613 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [0,2,0,0,0,0|2,0,0]=4 9614 B12R1.371 CCC(O)Sc1ccccc1C Amb22228394 [0,2,0,0,0,0|1,1,0]=4 9615 B12R1.371 CC[C@@H](C)Cc1ccccc1O Amb28243798 [0,2,0,0,0,0|2,0,0]=4 9616 B12R1.371 CC[C@@H](N)Cc1ccccc1Br Amb27459365 [0,2,0,0,0,0|2,0,0]=4 9617 B12R1.371 CC[C@@H](N)Cc1ccccc1Cl Amb27668323 [0,2,0,0,0,0|2,0,0]=4 9618 B12R1.371 C[C@@H](CN)Cc1ccccc1F Amb33731703 [0,2,0,0,0,0|2,0,0]=4 9619 B12R1.371 C[C@@H](CO)Cc1ccccc1Cl Amb28207131 [0,2,0,0,0,0|1,0,0]=3 9620 B12R1.371 C[C@@H](CO)Cc1ccccc1F Amb26956773 [0,2,0,0,0,0|1,0,0]=3 9621 B12R1.371 C[C@@H](CO)Nc1ncccc1Br Amb27589585 [0,2,0,0,0,0|2,0,0]=4 9622 B12R1.371 C[C@H](CN)Cc1ccccc1F Amb33747137 [0,2,0,0,0,0|2,0,0]=4 9623 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,2,0,0,0,0|1,0,0]=3 9624 B12R1.371 C[C@H](CO)Oc1ccccc1Cl Amb27405252 [0,2,0,0,0,0|0,0,0]=2 9625 B12R1.371 C[C@H](CO)Oc1ccccc1I Amb25150105 [0,2,0,0,0,0|0,0,0]=2 9626 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [0,2,0,0,0,0|1,0,1]=4 9627 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [0,2,0,0,0,0|2,0,0]=4 9628 B12R1.371 Cc1ccccc1CC(C)CCl Amb28422132 [0,2,0,0,0,0|2,0,0]=4 9629 B12R1.371 Cc1ccccc1CC(C)CN Amb5743837 [0,2,0,0,0,0|2,0,0]=4 9630 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,2,0,0,0,0|1,0,0]=3 9631 B12R1.371 Cc1ccccc1CC(N)CO Amb17062685 [0,2,0,0,0,0|1,0,0]=3 9632 B12R1.371 Cc1ccccc1CC(N)CO Amb33329338 [0,2,0,0,0,0|1,0,0]=3 9633 B12R1.371 Cc1ccccc1CC(O)CN Amb17232545 [0,2,0,0,0,0|2,0,0]=4 9634 B12R1.371 Cc1ccccc1CC(O)CN Amb32661067 [0,2,0,0,0,0|2,0,0]=4 9635 B12R1.371 Cc1ccccc1C[C@@H](C)CN Amb33747733 [0,2,0,0,0,0|2,0,0]=4 9636 B12R1.371 Cc1ccccc1C[C@@H](C)CO Amb33746673 [0,2,0,0,0,0|1,0,0]=3 9637 B12R1.371 Cc1ccccc1C[C@H](C)CN Amb33738932 [0,2,0,0,0,0|2,0,0]=4 9638 B12R1.371 Cc1ccccc1C[C@H](C)CO Amb33738161 [0,2,0,0,0,0|1,0,0]=3 9639 B12R1.371 Cc1ccccc1C[C@H](N)CO Amb26844931 [0,2,0,0,0,0|1,0,0]=3 9640 B12R1.371 Cc1ccccc1NC(=O)CO Amb1110662 [0,2,0,0,0,0|1,0,1]=4 9641 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,2,0,0,0,0|2,0,0]=4 9642 B12R1.371 Cc1ccccc1OC(=O)CN Amb17334634 [0,2,0,0,0,0|1,0,1]=4 9643 B12R1.371 Cc1ccccc1OC(=O)CN Amb19115306 [0,2,0,0,0,0|1,0,1]=4 9644 B12R1.371 Cc1ccccc1OC(C)C=O Amb27841630 [0,2,0,0,0,0|0,0,2]=4 9645 B12R1.371 Cc1ccccc1OC(C)CBr Amb17248431 [0,2,0,0,0,0|1,0,0]=3 9646 B12R1.371 Cc1ccccc1OC(C)CCl Amb17234168 [0,2,0,0,0,0|1,0,0]=3 9647 B12R1.371 Cc1ccccc1OC(C)CN Amb5781295 [0,2,0,0,0,0|1,0,0]=3 9648 B12R1.371 Cc1ccccc1OC(C)CO Amb17232600 [0,2,0,0,0,0|0,0,0]=2 9649 B12R1.371 Cc1cccnc1CC(N)CO Amb25751493 [0,2,0,0,0,0|2,0,0]=4 9650 B12R1.371 Cc1ccncc1CC(C)CO Amb27241561 [0,2,0,0,0,0|2,0,0]=4 9651 B12R1.371 Cc1ccncc1CC(N)CO Amb33377024 [0,2,0,0,0,0|2,0,0]=4 9652 B12R1.371 Cc1cnccc1CC(N)CO Amb24549921 [0,2,0,0,0,0|2,0,0]=4 9653 B12R1.371 Cc1cnccc1SC(C)CO Amb27664030 [0,2,0,0,0,0|1,1,0]=4 9654 B12R1.371 Cc1ncccc1CC(N)CO Amb26616316 [0,2,0,0,0,0|2,0,0]=4 9655 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [0,2,0,0,0,0|1,0,0]=3 9656 B12R1.371 NC(CO)Cc1ccccc1Cl Amb17062694 [0,2,0,0,0,0|1,0,0]=3 9657 B12R1.371 NC(CO)Cc1ccccc1F Amb17062688 [0,2,0,0,0,0|1,0,0]=3 9658 B12R1.371 NC(CO)Cc1ccccc1O Amb18827210 [0,2,0,0,0,0|1,0,0]=3 9659 B12R1.371 NC(CO)Cc1cccnc1Br Amb27790025 [0,2,0,0,0,0|2,0,0]=4 9660 B12R1.371 NC(CO)Cc1cccnc1Cl Amb25241685 [0,2,0,0,0,0|2,0,0]=4 9661 B12R1.371 NC(CO)Cc1cccnc1F Amb33377936 [0,2,0,0,0,0|2,0,0]=4 9662 B12R1.371 NC(CO)Cc1ccncc1Br Amb24542635 [0,2,0,0,0,0|2,0,0]=4 9663 B12R1.371 NC(CO)Cc1ccncc1Cl Amb25669679 [0,2,0,0,0,0|2,0,0]=4 9664 B12R1.371 NC(CO)Cc1ccncc1F Amb25261338 [0,2,0,0,0,0|2,0,0]=4 9665 B12R1.371 NC(CO)Cc1ncccc1Br Amb24581707 [0,2,0,0,0,0|2,0,0]=4 9666 B12R1.371 NC(CO)Cc1ncccc1F Amb33420859 [0,2,0,0,0,0|2,0,0]=4 9667 B12R1.371 NCC(=O)Oc1ccccc1Br Amb17344446 [0,2,0,0,0,0|1,0,1]=4 9668 B12R1.371 NCC(=O)Oc1ccccc1Cl Amb17335803 [0,2,0,0,0,0|1,0,1]=4 9669 B12R1.371 NCC(=O)Oc1ccccc1F Amb17334752 [0,2,0,0,0,0|1,0,1]=4 9670 B12R1.371 NCC(N)Cc1ccccc1F Amb27955290 [0,2,0,0,0,0|2,0,0]=4 9671 B12R1.371 NCC(O)Cc1ccccc1Br Amb18069447 [0,2,0,0,0,0|2,0,0]=4 9672 B12R1.371 NCC(O)Cc1ccccc1Cl Amb17234263 [0,2,0,0,0,0|2,0,0]=4 9673 B12R1.371 NCC(O)Cc1ccccc1Cl Amb32652702 [0,2,0,0,0,0|2,0,0]=4 9674 B12R1.371 NCC(O)Cc1ccccc1F Amb17232700 [0,2,0,0,0,0|2,0,0]=4 9675 B12R1.371 NCC(O)Cc1ccccc1O Amb26883501 [0,2,0,0,0,0|2,0,0]=4 9676 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [0,2,0,0,0,0|1,0,0]=3 9677 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [0,2,0,0,0,0|1,0,0]=3 9678 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [0,2,0,0,0,0|1,0,0]=3 9679 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [0,2,0,0,0,0|1,0,0]=3 9680 B12R1.371 Nc1ccncc1CC(N)CO Amb27467939 [0,2,0,0,0,0|2,0,0]=4 9681 B12R1.371 O=C(CCl)Oc1ccccc1O Amb17594841 [0,2,0,0,0,0|1,0,1]=4 9682 B12R1.371 O=C(CO)Cc1ccccc1Cl Amb18564303 [0,2,0,0,0,0|1,0,1]=4 9683 B12R1.371 O=C(CO)Nc1ccccc1Br Amb1109988 [0,2,0,0,0,0|1,0,1]=4 9684 B12R1.371 O=C(CO)Nc1ccccc1Cl Amb1111147 [0,2,0,0,0,0|1,0,1]=4 9685 B12R1.371 O=C(CO)Nc1ccccc1F Amb1109775 [0,2,0,0,0,0|1,0,1]=4 9686 B12R1.371 O=C(CO)Nc1ccccc1O Amb5798034 [0,2,0,0,0,0|1,0,1]=4 9687 B12R1.371 O=C(CO)OC1=CC=CNC1=O Amb27448658 [0,2,0,0,0,0|1,0,1]=4 9688 B12R1.371 O=C(CO)Oc1cccnc1Cl Amb27809295 [0,2,0,0,0,0|1,0,1]=4 9689 B12R1.371 OC\C(Cl)=C/c1ccccc1O Amb27256379 [0,2,0,0,0,0|1,0,1]=4 9690 B12R1.371 Oc1ccccc1CC(Cl)CCl Amb28313629 [0,2,0,0,0,0|2,0,0]=4 9691 B12R1.374 BrCCCc1cc(Br)ccc1I Amb27462500 [0,2,0,0,0,0|2,0,0]=4 9692 B12R1.374 BrCCOc1cc(Br)ccc1Br Amb10068285 [0,2,0,0,0,0|1,0,0]=3 9693 B12R1.374 C#CCOc1cc(C)ccc1Br Amb35666826 [0,2,0,0,0,0|1,0,1]=4 9694 B12R1.374 C#CCOc1cc(C)ccc1Cl Amb18809452 [0,2,0,0,0,0|1,0,1]=4 9695 B12R1.374 C#CCOc1cc(Cl)ccc1F Amb27977255 [0,2,0,0,0,0|1,0,1]=4 9696 B12R1.374 C#CCOc1cc(F)ccc1C Amb27231243 [0,2,0,0,0,0|1,0,1]=4 9697 B12R1.374 C#CCOc1cc(F)ccc1F Amb21963613 [0,2,0,0,0,0|1,0,1]=4 9698 B12R1.374 C#CCOc1cc(F)ccc1N Amb18286184 [0,2,0,0,0,0|1,0,1]=4 9699 B12R1.374 C#CCOc1cc(F)ccc1N Amb33549843 [0,2,0,0,0,0|1,0,1]=4 9700 B12R1.374 C#CCOc1cc(N)ccc1Br Amb27770893 [0,2,0,0,0,0|1,0,1]=4 9701 B12R1.374 C=CCOC1=CC(=O)C=CC1=O Amb25373844 [0,2,0,0,0,0|1,0,1]=4 9702 B12R1.374 C=CCOc1cc(Br)ccc1F Amb26412966 [0,2,0,0,0,0|1,0,1]=4 9703 B12R1.374 C=CCOc1cc(Br)ccc1O Amb27630363 [0,2,0,0,0,0|1,0,1]=4 9704 B12R1.374 C=CCOc1cc(C)ccc1Br Amb35663089 [0,2,0,0,0,0|1,0,1]=4 9705 B12R1.374 C=CCOc1cc(C)ccc1C Amb25882157 [0,2,0,0,0,0|1,0,1]=4 9706 B12R1.374 C=CCOc1cc(C)ccc1Cl Amb25871596 [0,2,0,0,0,0|1,0,1]=4 9707 B12R1.374 C=CCOc1cc(C)ccc1N Amb17138557 [0,2,0,0,0,0|1,0,1]=4 9708 B12R1.374 C=CCOc1cc(Cl)ccc1Cl Amb4422145 [0,2,0,0,0,0|1,0,1]=4 9709 B12R1.374 C=CCOc1cc(F)ccc1Br Amb24605603 [0,2,0,0,0,0|1,0,1]=4 9710 B12R1.374 C=CCOc1cc(N)ccc1C Amb17138558 [0,2,0,0,0,0|1,0,1]=4 9711 B12R1.374 C=CCOc1cc(N)ccc1Cl Amb23454613 [0,2,0,0,0,0|1,0,1]=4 9712 B12R1.374 C=CCOc1cc(N)ccc1N Amb27208923 [0,2,0,0,0,0|1,0,1]=4 9713 B12R1.374 C=CCOc1cc(O)ccc1Cl Amb18649015 [0,2,0,0,0,0|1,0,1]=4 9714 B12R1.374 CC1=CN(CCCO)C(=O)C=C1 Amb18041286 [0,2,0,0,0,0|2,0,0]=4 9715 B12R1.374 CCCCc1cc(Br)ccc1N Amb27812883 [0,2,0,0,0,0|2,0,0]=4 9716 B12R1.374 CCCCc1cc(C)ccc1O Amb27973016 [0,2,0,0,0,0|2,0,0]=4 9717 B12R1.374 CCCCc1cc(N)ccc1C Amb26961999 [0,2,0,0,0,0|2,0,0]=4 9718 B12R1.374 CCCCc1cc(N)ccc1Cl Amb25843846 [0,2,0,0,0,0|2,0,0]=4 9719 B12R1.374 CCCCc1cc(O)ccc1N Amb27657773 [0,2,0,0,0,0|2,0,0]=4 9720 B12R1.374 CCCNc1cc(Br)ccc1N Amb25738246 [0,2,0,0,0,0|2,0,0]=4 9721 B12R1.374 CCCNc1cc(C)ccc1C Amb4313517 [0,2,0,0,0,0|2,0,0]=4 9722 B12R1.374 CCCNc1cc(C)ccc1N Amb23114177 [0,2,0,0,0,0|2,0,0]=4 9723 B12R1.374 CCCNc1cc(Cl)ccc1C Amb6683517 [0,2,0,0,0,0|2,0,0]=4 9724 B12R1.374 CCCNc1cc(Cl)ccc1Cl Amb6647443 [0,2,0,0,0,0|2,0,0]=4 9725 B12R1.374 CCCNc1cc(Cl)ccc1I Amb30016029 [0,2,0,0,0,0|2,0,0]=4 9726 B12R1.374 CCCNc1cc(Cl)ccc1N Amb26025569 [0,2,0,0,0,0|2,0,0]=4 9727 B12R1.374 CCCNc1cc(Cl)ccc1O Amb27164011 [0,2,0,0,0,0|2,0,0]=4 9728 B12R1.374 CCCNc1cc(F)ccc1Cl Amb28384962 [0,2,0,0,0,0|2,0,0]=4 9729 B12R1.374 CCCNc1cc(F)ccc1F Amb6691519 [0,2,0,0,0,0|2,0,0]=4 9730 B12R1.374 CCCNc1cc(F)ccc1N Amb18989853 [0,2,0,0,0,0|2,0,0]=4 9731 B12R1.374 CCCNc1cc(I)ccc1C Amb27760818 [0,2,0,0,0,0|2,0,0]=4 9732 B12R1.374 CCCOc1cc(Br)ccc1F Amb24483694 [0,2,0,0,0,0|1,0,0]=3 9733 B12R1.374 CCCOc1cc(Br)ccc1N Amb24727840 [0,2,0,0,0,0|1,0,0]=3 9734 B12R1.374 CCCOc1cc(Br)ncc1C Amb28190515 [0,2,0,0,0,0|2,0,0]=4 9735 B12R1.374 CCCOc1cc(C)ccc1Br Amb35663090 [0,2,0,0,0,0|1,0,0]=3 9736 B12R1.374 CCCOc1cc(C)ccc1Cl Amb27466768 [0,2,0,0,0,0|1,0,0]=3 9737 B12R1.374 CCCOc1cc(C)ccc1F Amb21856655 [0,2,0,0,0,0|1,0,0]=3 9738 B12R1.374 CCCOc1cc(C)ccc1N Amb6266710 [0,2,0,0,0,0|1,0,0]=3 9739 B12R1.374 CCCOc1cc(Cl)ccc1N Amb18296228 [0,2,0,0,0,0|1,0,0]=3 9740 B12R1.374 CCCOc1cc(Cl)ccc1O Amb25282670 [0,2,0,0,0,0|1,0,0]=3 9741 B12R1.374 CCCOc1cc(F)ccc1Br Amb27623285 [0,2,0,0,0,0|1,0,0]=3 9742 B12R1.374 CCCOc1cc(F)ccc1N Amb1132322 [0,2,0,0,0,0|1,0,0]=3 9743 B12R1.374 CCCOc1cc(F)ccc1S Amb26651834 [0,2,0,0,0,0|1,0,0]=3 9744 B12R1.374 CCCOc1cc(N)ccc1C Amb9381478 [0,2,0,0,0,0|1,0,0]=3 9745 B12R1.374 CCCOc1cc(N)ccc1Cl Amb18649207 [0,2,0,0,0,0|1,0,0]=3 9746 B12R1.374 CCCOc1cc(N)ccc1N Amb28364725 [0,2,0,0,0,0|1,0,0]=3 9747 B12R1.374 CCCOc1cc(N)ncc1Br Amb27442557 [0,2,0,0,0,0|2,0,0]=4 9748 B12R1.374 CCCOc1cc(O)ccc1Cl Amb26463653 [0,2,0,0,0,0|1,0,0]=3 9749 B12R1.374 CCCOc1cc(O)ccc1N Amb24461245 [0,2,0,0,0,0|1,0,0]=3 9750 B12R1.374 CCCOc1cc(S)ccc1C Amb28399363 [0,2,0,0,0,0|1,0,0]=3 9751 B12R1.374 CCCOc1cc(S)ccc1F Amb25692041 [0,2,0,0,0,0|1,0,0]=3 9752 B12R1.374 CCCOc1nc(C)ccc1N Amb27668510 [0,2,0,0,0,0|2,0,0]=4 9753 B12R1.374 CCCOc1nc(C)ccc1O Amb32669725 [0,2,0,0,0,0|2,0,0]=4 9754 B12R1.374 CCCOc1nc(Cl)ccc1N Amb24436278 [0,2,0,0,0,0|2,0,0]=4 9755 B12R1.374 CCCOc1nc(F)ccc1N Amb33035463 [0,2,0,0,0,0|2,0,0]=4 9756 B12R1.374 CCCOc1nc(N)ccc1N Amb8889140 [0,2,0,0,0,0|2,0,0]=4 9757 B12R1.374 CCCOc1nc(O)ccc1N Amb8889924 [0,2,0,0,0,0|2,0,0]=4 9758 B12R1.374 CCCSc1cc(Br)ccc1N Amb27794183 [0,2,0,0,0,0|1,1,0]=4 9759 B12R1.374 CCCSc1cc(C)ccc1C Amb27649867 [0,2,0,0,0,0|1,1,0]=4 9760 B12R1.374 CCCSc1cc(Cl)ccc1Cl Amb26038787 [0,2,0,0,0,0|1,1,0]=4 9761 B12R1.374 CCCSc1cc(F)ccc1F Amb28185683 [0,2,0,0,0,0|1,1,0]=4 9762 B12R1.374 COCOc1cc(Br)ccc1C Amb26506766 [0,2,0,0,0,0|2,0,0]=4 9763 B12R1.374 COCOc1cc(Br)ccc1Cl Amb27247650 [0,2,0,0,0,0|2,0,0]=4 9764 B12R1.374 COCOc1cc(Br)ccc1F Amb27255632 [0,2,0,0,0,0|2,0,0]=4 9765 B12R1.374 COCOc1cc(Br)ccc1O Amb35788330 [0,2,0,0,0,0|2,0,0]=4 9766 B12R1.374 COCOc1cc(C)ccc1Br Amb30016168 [0,2,0,0,0,0|2,0,0]=4 9767 B12R1.374 COCOc1cc(Cl)ccc1Cl Amb27948670 [0,2,0,0,0,0|2,0,0]=4 9768 B12R1.374 COCOc1cc(Cl)ccc1F Amb28138338 [0,2,0,0,0,0|2,0,0]=4 9769 B12R1.374 COCOc1cc(Cl)ccc1N Amb27662698 [0,2,0,0,0,0|2,0,0]=4 9770 B12R1.374 COCOc1cc(F)ccc1Br Amb21856392 [0,2,0,0,0,0|2,0,0]=4 9771 B12R1.374 COCOc1cc(F)ccc1C Amb27264425 [0,2,0,0,0,0|2,0,0]=4 9772 B12R1.374 COCOc1cc(F)ccc1Cl Amb26332127 [0,2,0,0,0,0|2,0,0]=4 9773 B12R1.374 COCOc1cc(F)ccc1F Amb10607090 [0,2,0,0,0,0|2,0,0]=4 9774 B12R1.374 COCOc1cc(N)ccc1Br Amb27459422 [0,2,0,0,0,0|2,0,0]=4 9775 B12R1.374 CSCOc1cc(C)ccc1I Amb27261268 [0,2,0,0,0,0|2,0,0]=4 9776 B12R1.374 Cc1cc(OCCO)c(C)nn1 Amb27405260 [0,2,0,0,0,0|2,0,0]=4 9777 B12R1.374 Cc1ccc(Br)c(CCCBr)c1 Amb26645598 [0,2,0,0,0,0|2,0,0]=4 9778 B12R1.374 Cc1ccc(Br)c(CCCCl)c1 Amb28196523 [0,2,0,0,0,0|2,0,0]=4 9779 B12R1.374 Cc1ccc(Br)c(CCCN)c1 Amb26605852 [0,2,0,0,0,0|2,0,0]=4 9780 B12R1.374 Cc1ccc(Br)c(CCCO)c1 Amb33477903 [0,2,0,0,0,0|1,0,0]=3 9781 B12R1.374 Cc1ccc(Br)c(CCCS)c1 Amb33477913 [0,2,0,0,0,0|1,1,0]=4 9782 B12R1.374 Cc1ccc(Br)c(NCCO)c1 Amb27599653 [0,2,0,0,0,0|1,0,0]=3 9783 B12R1.374 Cc1ccc(Br)c(OCC#N)c1 Amb35663088 [0,2,0,0,0,0|1,0,1]=4 9784 B12R1.374 Cc1ccc(Br)c(OCC=O)c1 Amb35666597 [0,2,0,0,0,0|0,0,2]=4 9785 B12R1.374 Cc1ccc(Br)c(OCCBr)c1 Amb35602464 [0,2,0,0,0,0|1,0,0]=3 9786 B12R1.374 Cc1ccc(Br)c(OCCCl)c1 Amb35602463 [0,2,0,0,0,0|1,0,0]=3 9787 B12R1.374 Cc1ccc(Br)c(OCCF)c1 Amb35663354 [0,2,0,0,0,0|1,0,0]=3 9788 B12R1.374 Cc1ccc(Br)c(OCCN)c1 Amb27166651 [0,2,0,0,0,0|1,0,0]=3 9789 B12R1.374 Cc1ccc(Br)c(OCCO)c1 Amb30016163 [0,2,0,0,0,0|0,0,0]=2 9790 B12R1.374 Cc1ccc(Br)c(OCCS)c1 Amb35664907 [0,2,0,0,0,0|0,1,0]=3 9791 B12R1.374 Cc1ccc(Br)c(\C=C\CO)c1 Amb33477530 [0,2,0,0,0,0|1,0,1]=4 9792 B12R1.374 Cc1ccc(Br)cc1CCCBr Amb26951927 [0,2,0,0,0,0|2,0,0]=4 9793 B12R1.374 Cc1ccc(Br)cc1CCCCl Amb26846546 [0,2,0,0,0,0|2,0,0]=4 9794 B12R1.374 Cc1ccc(Br)cc1CCCN Amb26970083 [0,2,0,0,0,0|2,0,0]=4 9795 B12R1.374 Cc1ccc(Br)cc1CCCO Amb28318384 [0,2,0,0,0,0|1,0,0]=3 9796 B12R1.374 Cc1ccc(Br)cc1CCCS Amb25036393 [0,2,0,0,0,0|1,1,0]=4 9797 B12R1.374 Cc1ccc(Br)cc1NCCN Amb26883679 [0,2,0,0,0,0|2,0,0]=4 9798 B12R1.374 Cc1ccc(Br)cc1OCCN Amb24116411 [0,2,0,0,0,0|1,0,0]=3 9799 B12R1.374 Cc1ccc(Br)cc1\C=C\CO Amb33450354 [0,2,0,0,0,0|1,0,1]=4 9800 B12R1.374 Cc1ccc(C)c(C#CCO)c1 Amb18792227 [0,2,0,0,0,0|1,0,1]=4 9801 B12R1.374 Cc1ccc(C)c(CCCBr)c1 Amb24593678 [0,2,0,0,0,0|2,0,0]=4 9802 B12R1.374 Cc1ccc(C)c(CCCCl)c1 Amb18325129 [0,2,0,0,0,0|2,0,0]=4 9803 B12R1.374 Cc1ccc(C)c(CCCN)c1 Amb17204307 [0,2,0,0,0,0|2,0,0]=4 9804 B12R1.374 Cc1ccc(C)c(CCCO)c1 Amb17400156 [0,2,0,0,0,0|1,0,0]=3 9805 B12R1.374 Cc1ccc(C)c(CCCS)c1 Amb27147594 [0,2,0,0,0,0|1,1,0]=4 9806 B12R1.374 Cc1ccc(C)c(NCCCl)c1 Amb17335662 [0,2,0,0,0,0|2,0,0]=4 9807 B12R1.374 Cc1ccc(C)c(NCCN)c1 Amb17091051 [0,2,0,0,0,0|2,0,0]=4 9808 B12R1.374 Cc1ccc(C)c(NCCO)c1 Amb6714168 [0,2,0,0,0,0|1,0,0]=3 9809 B12R1.374 Cc1ccc(C)c(OCC#N)c1 Amb5780865 [0,2,0,0,0,0|1,0,1]=4 9810 B12R1.374 Cc1ccc(C)c(OCC=O)c1 Amb5731826 [0,2,0,0,0,0|0,0,2]=4 9811 B12R1.374 Cc1ccc(C)c(OCCBr)c1 Amb1105545 [0,2,0,0,0,0|1,0,0]=3 9812 B12R1.374 Cc1ccc(C)c(OCCCl)c1 Amb8828431 [0,2,0,0,0,0|1,0,0]=3 9813 B12R1.374 Cc1ccc(C)c(OCCN)c1 Amb1101722 [0,2,0,0,0,0|1,0,0]=3 9814 B12R1.374 Cc1ccc(C)c(OCCO)c1 Amb9370664 [0,2,0,0,0,0|0,0,0]=2 9815 B12R1.374 Cc1ccc(C)c(OCCS)c1 Amb6255873 [0,2,0,0,0,0|0,1,0]=3 9816 B12R1.374 Cc1ccc(C)c(SCCN)c1 Amb6269656 [0,2,0,0,0,0|1,1,0]=4 9817 B12R1.374 Cc1ccc(C)c(\C=C\CO)c1 Amb27174811 [0,2,0,0,0,0|1,0,1]=4 9818 B12R1.374 Cc1ccc(Cl)c(C#CCO)c1 Amb27984065 [0,2,0,0,0,0|1,0,1]=4 9819 B12R1.374 Cc1ccc(Cl)c(CCCBr)c1 Amb28458592 [0,2,0,0,0,0|2,0,0]=4 9820 B12R1.374 Cc1ccc(Cl)c(CCCCl)c1 Amb25242993 [0,2,0,0,0,0|2,0,0]=4 9821 B12R1.374 Cc1ccc(Cl)c(CCCN)c1 Amb18909370 [0,2,0,0,0,0|2,0,0]=4 9822 B12R1.374 Cc1ccc(Cl)c(CCCO)c1 Amb25074743 [0,2,0,0,0,0|1,0,0]=3 9823 B12R1.374 Cc1ccc(Cl)c(CCCS)c1 Amb33413736 [0,2,0,0,0,0|1,1,0]=4 9824 B12R1.374 Cc1ccc(Cl)c(OCCBr)c1 Amb8867463 [0,2,0,0,0,0|1,0,0]=3 9825 B12R1.374 Cc1ccc(Cl)c(OCCCl)c1 Amb9025041 [0,2,0,0,0,0|1,0,0]=3 9826 B12R1.374 Cc1ccc(Cl)c(OCCN)c1 Amb21959599 [0,2,0,0,0,0|1,0,0]=3 9827 B12R1.374 Cc1ccc(Cl)c(OCCN)c1 Amb9025059 [0,2,0,0,0,0|1,0,0]=3 9828 B12R1.374 Cc1ccc(Cl)c(OCCO)c1 Amb9274259 [0,2,0,0,0,0|0,0,0]=2 9829 B12R1.374 Cc1ccc(Cl)c(OCCS)c1 Amb17237592 [0,2,0,0,0,0|0,1,0]=3 9830 B12R1.374 Cc1ccc(Cl)c(\C=C\CO)c1 Amb33260492 [0,2,0,0,0,0|1,0,1]=4 9831 B12R1.374 Cc1ccc(Cl)cc1C#CCO Amb28124770 [0,2,0,0,0,0|1,0,1]=4 9832 B12R1.374 Cc1ccc(Cl)cc1CCCBr Amb24615762 [0,2,0,0,0,0|2,0,0]=4 9833 B12R1.374 Cc1ccc(Cl)cc1CCCCl Amb25952144 [0,2,0,0,0,0|2,0,0]=4 9834 B12R1.374 Cc1ccc(Cl)cc1CCCN Amb17204336 [0,2,0,0,0,0|2,0,0]=4 9835 B12R1.374 Cc1ccc(Cl)cc1NCCCl Amb17338052 [0,2,0,0,0,0|2,0,0]=4 9836 B12R1.374 Cc1ccc(Cl)cc1NCCN Amb17091058 [0,2,0,0,0,0|2,0,0]=4 9837 B12R1.374 Cc1ccc(Cl)cc1NCCO Amb6706402 [0,2,0,0,0,0|1,0,0]=3 9838 B12R1.374 Cc1ccc(Cl)cc1OCC#N Amb27873058 [0,2,0,0,0,0|1,0,1]=4 9839 B12R1.374 Cc1ccc(Cl)cc1OCCCl Amb27641822 [0,2,0,0,0,0|1,0,0]=3 9840 B12R1.374 Cc1ccc(Cl)cc1OCCF Amb27865176 [0,2,0,0,0,0|1,0,0]=3 9841 B12R1.374 Cc1ccc(Cl)cc1OCCN Amb18649214 [0,2,0,0,0,0|1,0,0]=3 9842 B12R1.374 Cc1ccc(Cl)cc1\C=C\CO Amb25721181 [0,2,0,0,0,0|1,0,1]=4 9843 B12R1.374 Cc1ccc(F)c(CCCBr)c1 Amb25876331 [0,2,0,0,0,0|2,0,0]=4 9844 B12R1.374 Cc1ccc(F)c(CCCCl)c1 Amb25250611 [0,2,0,0,0,0|2,0,0]=4 9845 B12R1.374 Cc1ccc(F)c(CCCN)c1 Amb28047637 [0,2,0,0,0,0|2,0,0]=4 9846 B12R1.374 Cc1ccc(F)c(CCCO)c1 Amb25148634 [0,2,0,0,0,0|1,0,0]=3 9847 B12R1.374 Cc1ccc(F)c(CCCS)c1 Amb33270316 [0,2,0,0,0,0|1,1,0]=4 9848 B12R1.374 Cc1ccc(F)c(OCC#N)c1 Amb25088280 [0,2,0,0,0,0|1,0,1]=4 9849 B12R1.374 Cc1ccc(F)c(OCC=O)c1 Amb28241692 [0,2,0,0,0,0|0,0,2]=4 9850 B12R1.374 Cc1ccc(F)c(OCCBr)c1 Amb27474666 [0,2,0,0,0,0|1,0,0]=3 9851 B12R1.374 Cc1ccc(F)c(OCCCl)c1 Amb28318027 [0,2,0,0,0,0|1,0,0]=3 9852 B12R1.374 Cc1ccc(F)c(OCCN)c1 Amb27474665 [0,2,0,0,0,0|1,0,0]=3 9853 B12R1.374 Cc1ccc(F)c(\C=C\CO)c1 Amb27834532 [0,2,0,0,0,0|1,0,1]=4 9854 B12R1.374 Cc1ccc(F)cc1CCCBr Amb26061387 [0,2,0,0,0,0|2,0,0]=4 9855 B12R1.374 Cc1ccc(F)cc1CCCCl Amb26330814 [0,2,0,0,0,0|2,0,0]=4 9856 B12R1.374 Cc1ccc(F)cc1CCCN Amb27592446 [0,2,0,0,0,0|2,0,0]=4 9857 B12R1.374 Cc1ccc(F)cc1CCCO Amb25886854 [0,2,0,0,0,0|1,0,0]=3 9858 B12R1.374 Cc1ccc(F)cc1CCCS Amb33199386 [0,2,0,0,0,0|1,1,0]=4 9859 B12R1.374 Cc1ccc(F)cc1NCCF Amb27799699 [0,2,0,0,0,0|2,0,0]=4 9860 B12R1.374 Cc1ccc(F)cc1OCC=O Amb28430393 [0,2,0,0,0,0|0,0,2]=4 9861 B12R1.374 Cc1ccc(F)cc1OCCN Amb24682325 [0,2,0,0,0,0|1,0,0]=3 9862 B12R1.374 Cc1ccc(F)cc1OCCS Amb28454492 [0,2,0,0,0,0|0,1,0]=3 9863 B12R1.374 Cc1ccc(F)cc1\C=C\CO Amb33358703 [0,2,0,0,0,0|1,0,1]=4 9864 B12R1.374 Cc1ccc(I)c(CCCBr)c1 Amb27654240 [0,2,0,0,0,0|2,0,0]=4 9865 B12R1.374 Cc1ccc(I)c(OCC#N)c1 Amb26399671 [0,2,0,0,0,0|1,0,1]=4 9866 B12R1.374 Cc1ccc(I)cc1CCCBr Amb26621066 [0,2,0,0,0,0|2,0,0]=4 9867 B12R1.374 Cc1ccc(I)cc1CCCCl Amb25959093 [0,2,0,0,0,0|2,0,0]=4 9868 B12R1.374 Cc1ccc(I)cc1OCCF Amb28194484 [0,2,0,0,0,0|1,0,0]=3 9869 B12R1.374 Cc1ccc(I)cc1OCCO Amb27973522 [0,2,0,0,0,0|0,0,0]=2 9870 B12R1.374 Cc1ccc(N)c(CCCBr)c1 Amb25952097 [0,2,0,0,0,0|2,0,0]=4 9871 B12R1.374 Cc1ccc(N)c(CCCCl)c1 Amb27616077 [0,2,0,0,0,0|2,0,0]=4 9872 B12R1.374 Cc1ccc(N)c(NCCN)c1 Amb27167275 [0,2,0,0,0,0|2,0,0]=4 9873 B12R1.374 Cc1ccc(N)c(NCCO)c1 Amb27257675 [0,2,0,0,0,0|1,0,0]=3 9874 B12R1.374 Cc1ccc(N)c(NCCO)n1 Amb17209129 [0,2,0,0,0,0|2,0,0]=4 9875 B12R1.374 Cc1ccc(N)c(OCCF)c1 Amb25948544 [0,2,0,0,0,0|1,0,0]=3 9876 B12R1.374 Cc1ccc(N)c(OCCO)c1 Amb6702384 [0,2,0,0,0,0|0,0,0]=2 9877 B12R1.374 Cc1ccc(N)c(OCCO)n1 Amb25968048 [0,2,0,0,0,0|1,0,0]=3 9878 B12R1.374 Cc1ccc(N)c(SCCN)c1 Amb27870339 [0,2,0,0,0,0|1,1,0]=4 9879 B12R1.374 Cc1ccc(N)cc1CCCBr Amb27616076 [0,2,0,0,0,0|2,0,0]=4 9880 B12R1.374 Cc1ccc(N)cc1OCCF Amb25063471 [0,2,0,0,0,0|1,0,0]=3 9881 B12R1.374 Cc1ccc(N)cc1SCCF Amb28203195 [0,2,0,0,0,0|1,1,0]=4 9882 B12R1.374 Cc1ccc(N)cc1SCCO Amb18993401 [0,2,0,0,0,0|0,1,0]=3 9883 B12R1.374 Cc1ccc(O)c(CCCBr)c1 Amb24558916 [0,2,0,0,0,0|2,0,0]=4 9884 B12R1.374 Cc1ccc(O)c(CCCCl)c1 Amb27200457 [0,2,0,0,0,0|2,0,0]=4 9885 B12R1.374 Cc1ccc(O)c(CCCN)c1 Amb18552860 [0,2,0,0,0,0|2,0,0]=4 9886 B12R1.374 Cc1ccc(O)c(CCCO)c1 Amb18646539 [0,2,0,0,0,0|1,0,0]=3 9887 B12R1.374 Cc1ccc(O)c(CCCS)c1 Amb33269437 [0,2,0,0,0,0|1,1,0]=4 9888 B12R1.374 Cc1ccc(O)c(NCCO)c1 Amb27223975 [0,2,0,0,0,0|1,0,0]=3 9889 B12R1.374 Cc1ccc(O)c(OCCN)c1 Amb33267916 [0,2,0,0,0,0|1,0,0]=3 9890 B12R1.374 Cc1ccc(O)c(SCCO)n1 Amb18649166 [0,2,0,0,0,0|1,1,0]=4 9891 B12R1.374 Cc1ccc(O)c(\C=C\CO)c1 Amb18646066 [0,2,0,0,0,0|1,0,1]=4 9892 B12R1.374 Cc1ccc(O)cc1CCCBr Amb28326332 [0,2,0,0,0,0|2,0,0]=4 9893 B12R1.374 Cc1ccc(O)cc1CCCCl Amb27965623 [0,2,0,0,0,0|2,0,0]=4 9894 B12R1.374 Cc1ccc(O)cc1CCCN Amb25777725 [0,2,0,0,0,0|2,0,0]=4 9895 B12R1.374 Cc1ccc(S)c(CCCBr)c1 Amb27624764 [0,2,0,0,0,0|2,0,0]=4 9896 B12R1.374 Cc1ccc(S)c(CCCCl)c1 Amb27246556 [0,2,0,0,0,0|2,0,0]=4 9897 B12R1.374 Cc1ccc(S)cc1CCCBr Amb25920102 [0,2,0,0,0,0|2,0,0]=4 9898 B12R1.374 Cc1ccc(S)cc1CCCCl Amb24610834 [0,2,0,0,0,0|2,0,0]=4 9899 B12R1.374 Cc1cnc(F)nc1OCCO Amb35742796 [0,2,0,0,0,0|2,0,0]=4 9900 B12R1.374 Cc1cnc(N)nc1OCCO Amb27460619 [0,2,0,0,0,0|2,0,0]=4 9901 B12R1.374 ClCCCc1cc(Br)ccc1Br Amb26938883 [0,2,0,0,0,0|2,0,0]=4 9902 B12R1.374 ClCCCc1cc(Br)ccc1Cl Amb27442173 [0,2,0,0,0,0|2,0,0]=4 9903 B12R1.374 ClCCCc1cc(Cl)ccc1Br Amb25714131 [0,2,0,0,0,0|2,0,0]=4 9904 B12R1.374 ClCCCc1cc(Cl)ccc1Cl Amb26079912 [0,2,0,0,0,0|2,0,0]=4 9905 B12R1.374 ClCCCc1cc(Cl)ccc1I Amb26617928 [0,2,0,0,0,0|2,0,0]=4 9906 B12R1.374 ClCCCc1cc(I)ccc1Br Amb26532857 [0,2,0,0,0,0|2,0,0]=4 9907 B12R1.374 ClCCNc1cc(Cl)ccc1Cl Amb17343164 [0,2,0,0,0,0|2,0,0]=4 9908 B12R1.374 ClCCOc1cc(Cl)ccc1Cl Amb8828413 [0,2,0,0,0,0|1,0,0]=3 9909 B12R1.374 ClCCSc1cc(Cl)ccc1Cl Amb434067 [0,2,0,0,0,0|1,1,0]=4 9910 B12R1.374 Clc1ccc(Br)c(CCCBr)c1 Amb25984343 [0,2,0,0,0,0|2,0,0]=4 9911 B12R1.374 Clc1ccc(Br)cc1CCCBr Amb27633998 [0,2,0,0,0,0|2,0,0]=4 9912 B12R1.374 Clc1ccc(Cl)c(CCCBr)c1 Amb26926828 [0,2,0,0,0,0|2,0,0]=4 9913 B12R1.374 Clc1ccc(Cl)c(OCCBr)c1 Amb1106064 [0,2,0,0,0,0|1,0,0]=3 9914 B12R1.374 Clc1ccc(I)c(CCCBr)c1 Amb26896800 [0,2,0,0,0,0|2,0,0]=4 9915 B12R1.374 FCCNc1cc(Br)ccc1I Amb27791394 [0,2,0,0,0,0|2,0,0]=4 9916 B12R1.374 FCCNc1cc(Cl)ccc1F Amb27477495 [0,2,0,0,0,0|2,0,0]=4 9917 B12R1.374 FCCNc1cc(Cl)ccc1I Amb35706566 [0,2,0,0,0,0|2,0,0]=4 9918 B12R1.374 FCCNc1cc(F)ccc1Br Amb27662624 [0,2,0,0,0,0|2,0,0]=4 9919 B12R1.374 FCCNc1cc(I)ccc1Br Amb28119464 [0,2,0,0,0,0|2,0,0]=4 9920 B12R1.374 FCCNc1cc(I)ccc1Cl Amb27666460 [0,2,0,0,0,0|2,0,0]=4 9921 B12R1.374 FCCOc1cc(Br)ccc1F Amb28127586 [0,2,0,0,0,0|1,0,0]=3 9922 B12R1.374 FCCOc1cc(Cl)ccc1Cl Amb27177428 [0,2,0,0,0,0|1,0,0]=3 9923 B12R1.374 FCCOc1cc(Cl)ccc1F Amb27756033 [0,2,0,0,0,0|1,0,0]=3 9924 B12R1.374 FCCOc1cc(F)ccc1Br Amb27753288 [0,2,0,0,0,0|1,0,0]=3 9925 B12R1.374 FCCOc1cc(F)ccc1F Amb28345100 [0,2,0,0,0,0|1,0,0]=3 9926 B12R1.374 Fc1ccc(Br)c(CCCBr)c1 Amb26840983 [0,2,0,0,0,0|2,0,0]=4 9927 B12R1.374 Fc1ccc(Br)c(CCCCl)c1 Amb24341770 [0,2,0,0,0,0|2,0,0]=4 9928 B12R1.374 Fc1ccc(Br)c(CCCS)c1 Amb33008797 [0,2,0,0,0,0|1,1,0]=4 9929 B12R1.374 Fc1ccc(Br)cc1CCCBr Amb25204237 [0,2,0,0,0,0|2,0,0]=4 9930 B12R1.374 Fc1ccc(Br)cc1CCCCl Amb28069965 [0,2,0,0,0,0|2,0,0]=4 9931 B12R1.374 Fc1ccc(Br)cc1CCCS Amb25778866 [0,2,0,0,0,0|1,1,0]=4 9932 B12R1.374 Fc1ccc(Br)cc1OCCCl Amb28321297 [0,2,0,0,0,0|1,0,0]=3 9933 B12R1.374 Fc1ccc(Cl)c(CCCBr)c1 Amb26410622 [0,2,0,0,0,0|2,0,0]=4 9934 B12R1.374 Fc1ccc(Cl)c(CCCCl)c1 Amb25796501 [0,2,0,0,0,0|2,0,0]=4 9935 B12R1.374 Fc1ccc(Cl)c(CCCS)c1 Amb33059181 [0,2,0,0,0,0|1,1,0]=4 9936 B12R1.374 Fc1ccc(Cl)c(OCCCl)c1 Amb27454503 [0,2,0,0,0,0|1,0,0]=3 9937 B12R1.374 Fc1ccc(Cl)cc1CCCBr Amb24441885 [0,2,0,0,0,0|2,0,0]=4 9938 B12R1.374 Fc1ccc(Cl)cc1CCCCl Amb26607500 [0,2,0,0,0,0|2,0,0]=4 9939 B12R1.374 Fc1ccc(Cl)cc1CCCS Amb28205387 [0,2,0,0,0,0|1,1,0]=4 9940 B12R1.374 Fc1ccc(F)c(CCCBr)c1 Amb24439123 [0,2,0,0,0,0|2,0,0]=4 9941 B12R1.374 Fc1ccc(F)c(CCCCl)c1 Amb19073201 [0,2,0,0,0,0|2,0,0]=4 9942 B12R1.374 Fc1ccc(F)c(CCCS)c1 Amb26035320 [0,2,0,0,0,0|1,1,0]=4 9943 B12R1.374 Fc1ccc(F)c(OCCBr)c1 Amb24483410 [0,2,0,0,0,0|1,0,0]=3 9944 B12R1.374 Fc1ccc(F)c(OCCS)c1 Amb27834968 [0,2,0,0,0,0|0,1,0]=3 9945 B12R1.374 Fc1ccc(F)c(SCCS)c1 Amb27594601 [0,2,0,0,0,0|0,2,0]=4 9946 B12R1.374 Fc1ccc(I)c(CCCBr)c1 Amb27439355 [0,2,0,0,0,0|2,0,0]=4 9947 B12R1.374 Fc1ccc(I)cc1CCCCl Amb27800287 [0,2,0,0,0,0|2,0,0]=4 9948 B12R1.374 Fc1ccc(S)cc1CCCBr Amb27263039 [0,2,0,0,0,0|2,0,0]=4 9949 B12R1.374 Fc1ccc(S)cc1CCCCl Amb27622872 [0,2,0,0,0,0|2,0,0]=4 9950 B12R1.374 N#CCOc1cc(Cl)ccc1Cl Amb5780876 [0,2,0,0,0,0|1,0,1]=4 9951 B12R1.374 N#CCOc1cc(Cl)ccc1F Amb28457968 [0,2,0,0,0,0|1,0,1]=4 9952 B12R1.374 N#CCOc1cc(F)ccc1Br Amb19892313 [0,2,0,0,0,0|1,0,1]=4 9953 B12R1.374 N#CCOc1cc(F)ccc1Cl Amb26551909 [0,2,0,0,0,0|1,0,1]=4 9954 B12R1.374 N#CCOc1cc(F)ccc1N Amb6245486 [0,2,0,0,0,0|1,0,1]=4 9955 B12R1.374 NC1=CN(CCCO)C(=O)C=C1 Amb18535272 [0,2,0,0,0,0|2,0,0]=4 9956 B12R1.374 NCCCc1cc(Br)ccc1Cl Amb25036212 [0,2,0,0,0,0|2,0,0]=4 9957 B12R1.374 NCCCc1cc(Br)ccc1F Amb9304922 [0,2,0,0,0,0|2,0,0]=4 9958 B12R1.374 NCCCc1cc(Br)ccc1N Amb27208273 [0,2,0,0,0,0|2,0,0]=4 9959 B12R1.374 NCCCc1cc(Br)ccc1O Amb26608950 [0,2,0,0,0,0|2,0,0]=4 9960 B12R1.374 NCCCc1cc(Cl)ccc1Br Amb25150112 [0,2,0,0,0,0|2,0,0]=4 9961 B12R1.374 NCCCc1cc(Cl)ccc1Cl Amb17204405 [0,2,0,0,0,0|2,0,0]=4 9962 B12R1.374 NCCCc1cc(Cl)ccc1F Amb18863289 [0,2,0,0,0,0|2,0,0]=4 9963 B12R1.374 NCCCc1cc(Cl)ccc1I Amb30015437 [0,2,0,0,0,0|2,0,0]=4 9964 B12R1.374 NCCCc1cc(Cl)ccc1N Amb25177280 [0,2,0,0,0,0|2,0,0]=4 9965 B12R1.374 NCCCc1cc(Cl)ccc1O Amb18909512 [0,2,0,0,0,0|2,0,0]=4 9966 B12R1.374 NCCCc1cc(F)ccc1Br Amb9304908 [0,2,0,0,0,0|2,0,0]=4 9967 B12R1.374 NCCCc1cc(F)ccc1Cl Amb18821281 [0,2,0,0,0,0|2,0,0]=4 9968 B12R1.374 NCCCc1cc(F)ccc1F Amb18980797 [0,2,0,0,0,0|2,0,0]=4 9969 B12R1.374 NCCCc1cc(F)ccc1O Amb18556316 [0,2,0,0,0,0|2,0,0]=4 9970 B12R1.374 NCCCc1cc(N)ccc1F Amb27201935 [0,2,0,0,0,0|2,0,0]=4 9971 B12R1.374 NCCCc1cc(O)ccc1Br Amb24537692 [0,2,0,0,0,0|2,0,0]=4 9972 B12R1.374 NCCCc1cc(O)ccc1Cl Amb25682654 [0,2,0,0,0,0|2,0,0]=4 9973 B12R1.374 NCCCc1cc(O)ccc1F Amb27808605 [0,2,0,0,0,0|2,0,0]=4 9974 B12R1.374 NCCCc1cc(O)ccc1O Amb26505313 [0,2,0,0,0,0|2,0,0]=4 9975 B12R1.374 NCCNc1cc(Br)ccc1F Amb24732633 [0,2,0,0,0,0|2,0,0]=4 9976 B12R1.374 NCCNc1cc(Br)ccc1N Amb27478399 [0,2,0,0,0,0|2,0,0]=4 9977 B12R1.374 NCCNc1cc(Cl)ccc1Cl Amb17091082 [0,2,0,0,0,0|2,0,0]=4 9978 B12R1.374 NCCNc1cc(Cl)ccc1F Amb18243910 [0,2,0,0,0,0|2,0,0]=4 9979 B12R1.374 NCCNc1cc(Cl)ccc1I Amb30016030 [0,2,0,0,0,0|2,0,0]=4 9980 B12R1.374 NCCNc1cc(F)ccc1F Amb18997936 [0,2,0,0,0,0|2,0,0]=4 9981 B12R1.374 NCCOc1cc(Br)ccc1Cl Amb26373500 [0,2,0,0,0,0|1,0,0]=3 9982 B12R1.374 NCCOc1cc(Br)ccc1F Amb28253153 [0,2,0,0,0,0|1,0,0]=3 9983 B12R1.374 NCCOc1cc(Br)ccc1O Amb33333604 [0,2,0,0,0,0|1,0,0]=3 9984 B12R1.374 NCCOc1cc(Br)cnc1Cl Amb33007803 [0,2,0,0,0,0|2,0,0]=4 9985 B12R1.374 NCCOc1cc(Br)cnc1F Amb33478573 [0,2,0,0,0,0|2,0,0]=4 9986 B12R1.374 NCCOc1cc(Cl)ccc1Br Amb25896544 [0,2,0,0,0,0|1,0,0]=3 9987 B12R1.374 NCCOc1cc(Cl)ccc1Cl Amb2446347 [0,2,0,0,0,0|1,0,0]=3 9988 B12R1.374 NCCOc1cc(Cl)ccc1F Amb18243938 [0,2,0,0,0,0|1,0,0]=3 9989 B12R1.374 NCCOc1cc(Cl)ccc1O Amb33261274 [0,2,0,0,0,0|1,0,0]=3 9990 B12R1.374 NCCOc1cc(Cl)cnc1F Amb33257886 [0,2,0,0,0,0|2,0,0]=4 9991 B12R1.374 NCCOc1cc(Cl)ncc1Br Amb33478214 [0,2,0,0,0,0|2,0,0]=4 9992 B12R1.374 NCCOc1cc(F)ccc1Br Amb25106321 [0,2,0,0,0,0|1,0,0]=3 9993 B12R1.374 NCCOc1cc(F)ccc1Cl Amb26654322 [0,2,0,0,0,0|1,0,0]=3 9994 B12R1.374 NCCOc1cc(F)ccc1F Amb18243555 [0,2,0,0,0,0|1,0,0]=3 9995 B12R1.374 NCCOc1cc(F)ccc1O Amb33379489 [0,2,0,0,0,0|1,0,0]=3 9996 B12R1.374 NCCOc1cc(O)ccc1Br Amb33387323 [0,2,0,0,0,0|1,0,0]=3 9997 B12R1.374 NCCOc1cc(O)ccc1F Amb27208594 [0,2,0,0,0,0|1,0,0]=3 9998 B12R1.374 NCCOc1cc(O)ccc1O Amb33268161 [0,2,0,0,0,0|1,0,0]=3 9999 B12R1.374 Nc1cc(NCCO)c(Br)cn1 Amb27190429 [0,2,0,0,0,0|2,0,0]=4 10000 B12R1.374 Nc1ccc(Br)c(CCCBr)c1 Amb24541058 [0,2,0,0,0,0|2,0,0]=4 10001 B12R1.374 Nc1ccc(Br)c(OCCF)c1 Amb26326461 [0,2,0,0,0,0|1,0,0]=3 10002 B12R1.374 Nc1ccc(Br)cc1CCCBr Amb26398043 [0,2,0,0,0,0|2,0,0]=4 10003 B12R1.374 Nc1ccc(Br)cc1CCCCl Amb26398045 [0,2,0,0,0,0|2,0,0]=4 10004 B12R1.374 Nc1ccc(Br)cc1NCCO Amb26880088 [0,2,0,0,0,0|1,0,0]=3 10005 B12R1.374 Nc1ccc(Br)cc1OCCF Amb32939658 [0,2,0,0,0,0|1,0,0]=3 10006 B12R1.374 Nc1ccc(Br)cc1OCCO Amb28186664 [0,2,0,0,0,0|0,0,0]=2 10007 B12R1.374 Nc1ccc(Cl)c(CCCCl)c1 Amb27966176 [0,2,0,0,0,0|2,0,0]=4 10008 B12R1.374 Nc1ccc(Cl)c(OCCF)c1 Amb25844731 [0,2,0,0,0,0|1,0,0]=3 10009 B12R1.374 Nc1ccc(Cl)c(SCCO)c1 Amb27827553 [0,2,0,0,0,0|0,1,0]=3 10010 B12R1.374 Nc1ccc(Cl)cc1CCCBr Amb27971067 [0,2,0,0,0,0|2,0,0]=4 10011 B12R1.374 Nc1ccc(Cl)cc1CCCO Amb27455752 [0,2,0,0,0,0|1,0,0]=3 10012 B12R1.374 Nc1ccc(Cl)cc1OCCF Amb24579905 [0,2,0,0,0,0|1,0,0]=3 10013 B12R1.374 Nc1ccc(Cl)cc1OCCO Amb18990920 [0,2,0,0,0,0|0,0,0]=2 10014 B12R1.374 Nc1ccc(Cl)nc1NCCO Amb28046885 [0,2,0,0,0,0|2,0,0]=4 10015 B12R1.374 Nc1ccc(Cl)nc1OCCO Amb26949190 [0,2,0,0,0,0|1,0,0]=3 10016 B12R1.374 Nc1ccc(Cl)nc1SCCO Amb27817489 [0,2,0,0,0,0|1,1,0]=4 10017 B12R1.374 Nc1ccc(F)c(CCCBr)c1 Amb27614019 [0,2,0,0,0,0|2,0,0]=4 10018 B12R1.374 Nc1ccc(F)cc1CCCBr Amb28286555 [0,2,0,0,0,0|2,0,0]=4 10019 B12R1.374 Nc1ccc(F)cc1CCCCl Amb27614023 [0,2,0,0,0,0|2,0,0]=4 10020 B12R1.374 Nc1ccc(F)cc1NCCF Amb27426829 [0,2,0,0,0,0|2,0,0]=4 10021 B12R1.374 Nc1ccc(F)cc1OCCF Amb25886660 [0,2,0,0,0,0|1,0,0]=3 10022 B12R1.374 Nc1ccc(F)cc1OCCO Amb6702381 [0,2,0,0,0,0|0,0,0]=2 10023 B12R1.374 Nc1ccc(F)cc1SCCO Amb18989905 [0,2,0,0,0,0|0,1,0]=3 10024 B12R1.374 Nc1ccc(I)cc1CCCCl Amb27209116 [0,2,0,0,0,0|2,0,0]=4 10025 B12R1.374 Nc1ccc(N)c(SCCO)c1 Amb27463144 [0,2,0,0,0,0|0,1,0]=3 10026 B12R1.374 Nc1ccc(O)c(CCCBr)c1 Amb27616173 [0,2,0,0,0,0|2,0,0]=4 10027 B12R1.374 Nc1ccc(O)c(CCCCl)c1 Amb27209802 [0,2,0,0,0,0|2,0,0]=4 10028 B12R1.374 Nc1ccc(O)cc1CCCCl Amb28196575 [0,2,0,0,0,0|2,0,0]=4 10029 B12R1.374 Nc1ccc(O)cc1CCCO Amb27411950 [0,2,0,0,0,0|1,0,0]=3 10030 B12R1.374 Nc1ccc(O)cc1OCCF Amb32939657 [0,2,0,0,0,0|1,0,0]=3 10031 B12R1.374 Nc1ccc(O)cc1SCCS Amb28072974 [0,2,0,0,0,0|0,2,0]=4 10032 B12R1.374 Nc1ccc(S)c(CCCCl)c1 Amb27445215 [0,2,0,0,0,0|2,0,0]=4 10033 B12R1.374 Nc1ccc(S)cc1CCCBr Amb28196004 [0,2,0,0,0,0|2,0,0]=4 10034 B12R1.374 Nc1ccc(S)cc1CCCCl Amb27616194 [0,2,0,0,0,0|2,0,0]=4 10035 B12R1.374 Nc1cnc(Cl)nc1OCCO Amb24459525 [0,2,0,0,0,0|2,0,0]=4 10036 B12R1.374 Nc1cnc(F)nc1OCCO Amb33035496 [0,2,0,0,0,0|2,0,0]=4 10037 B12R1.374 Nc1ncc(Cl)c(OCCO)n1 Amb27882528 [0,2,0,0,0,0|2,0,0]=4 10038 B12R1.374 Nc1ncc(F)c(OCCO)n1 Amb27865703 [0,2,0,0,0,0|2,0,0]=4 10039 B12R1.374 Nc1ncc(F)cc1CCCO Amb13889726 [0,2,0,0,0,0|2,0,0]=4 10040 B12R1.374 Nc1ncc(I)cc1CCCO Amb13890001 [0,2,0,0,0,0|2,0,0]=4 10041 B12R1.374 O=C1C=CC(=O)C(CCCO)=C1 Amb27177915 [0,2,0,0,0,0|1,0,0]=3 10042 B12R1.374 O=C1C=CC(=O)C(NCCO)=C1 Amb27230328 [0,2,0,0,0,0|1,0,0]=3 10043 B12R1.374 O=CCOc1cc(Cl)ccc1Cl Amb5731858 [0,2,0,0,0,0|0,0,2]=4 10044 B12R1.374 O=CCOc1cc(F)ccc1Br Amb27776004 [0,2,0,0,0,0|0,0,2]=4 10045 B12R1.374 O=CCOc1cc(F)ccc1Cl Amb27257466 [0,2,0,0,0,0|0,0,2]=4 10046 B12R1.374 O=CCOc1cc(F)ccc1F Amb28455954 [0,2,0,0,0,0|0,0,2]=4 10047 B12R1.374 OCC#Cc1cc(Cl)ccc1Cl Amb9777290 [0,2,0,0,0,0|1,0,1]=4 10048 B12R1.374 OCCCc1cc(Br)ccc1Cl Amb33386703 [0,2,0,0,0,0|1,0,0]=3 10049 B12R1.374 OCCCc1cc(Br)ccc1F Amb25669437 [0,2,0,0,0,0|1,0,0]=3 10050 B12R1.374 OCCCc1cc(Br)ccc1O Amb25931046 [0,2,0,0,0,0|1,0,0]=3 10051 B12R1.374 OCCCc1cc(Br)cnc1Cl Amb33007785 [0,2,0,0,0,0|2,0,0]=4 10052 B12R1.374 OCCCc1cc(Br)cnc1F Amb33478525 [0,2,0,0,0,0|2,0,0]=4 10053 B12R1.374 OCCCc1cc(Cl)ccc1Br Amb26497942 [0,2,0,0,0,0|1,0,0]=3 10054 B12R1.374 OCCCc1cc(Cl)ccc1Cl Amb26852629 [0,2,0,0,0,0|1,0,0]=3 10055 B12R1.374 OCCCc1cc(Cl)ccc1F Amb18863273 [0,2,0,0,0,0|1,0,0]=3 10056 B12R1.374 OCCCc1cc(Cl)ccc1I Amb32945190 [0,2,0,0,0,0|1,0,0]=3 10057 B12R1.374 OCCCc1cc(Cl)ccc1O Amb25762478 [0,2,0,0,0,0|1,0,0]=3 10058 B12R1.374 OCCCc1cc(Cl)cnc1F Amb33257899 [0,2,0,0,0,0|2,0,0]=4 10059 B12R1.374 OCCCc1cc(Cl)ncc1Br Amb33478191 [0,2,0,0,0,0|2,0,0]=4 10060 B12R1.374 OCCCc1cc(F)ccc1Br Amb26373423 [0,2,0,0,0,0|1,0,0]=3 10061 B12R1.374 OCCCc1cc(F)ccc1Cl Amb25271650 [0,2,0,0,0,0|1,0,0]=3 10062 B12R1.374 OCCCc1cc(F)ccc1F Amb17605791 [0,2,0,0,0,0|1,0,0]=3 10063 B12R1.374 OCCCc1cc(F)ccc1O Amb24377655 [0,2,0,0,0,0|1,0,0]=3 10064 B12R1.374 OCCCc1cc(F)cnc1Cl Amb13889729 [0,2,0,0,0,0|2,0,0]=4 10065 B12R1.374 OCCCc1cc(F)cnc1O Amb13889728 [0,2,0,0,0,0|2,0,0]=4 10066 B12R1.374 OCCCc1cc(I)ccc1F Amb27463082 [0,2,0,0,0,0|1,0,0]=3 10067 B12R1.374 OCCCc1cc(O)ccc1Br Amb33386709 [0,2,0,0,0,0|1,0,0]=3 10068 B12R1.374 OCCCc1cc(O)ccc1O Amb26347304 [0,2,0,0,0,0|1,0,0]=3 10069 B12R1.374 OCCNc1cc(Cl)ccc1Cl Amb6707812 [0,2,0,0,0,0|1,0,0]=3 10070 B12R1.374 OCCNc1cc(Cl)ccc1I Amb35706945 [0,2,0,0,0,0|1,0,0]=3 10071 B12R1.374 OCCNc1cc(Cl)ncc1Cl Amb32669175 [0,2,0,0,0,0|2,0,0]=4 10072 B12R1.374 OCCNc1cc(F)ccc1Br Amb27175199 [0,2,0,0,0,0|1,0,0]=3 10073 B12R1.374 OCCNc1cc(F)ccc1F Amb6709873 [0,2,0,0,0,0|1,0,0]=3 10074 B12R1.374 OCCNc1nc(Cl)ccc1Cl Amb27178608 [0,2,0,0,0,0|2,0,0]=4 10075 B12R1.374 OCCOc1cc(Br)ccc1Br Amb23412184 [0,2,0,0,0,0|0,0,0]=2 10076 B12R1.374 OCCOc1cc(Br)ccc1Cl Amb28042623 [0,2,0,0,0,0|0,0,0]=2 10077 B12R1.374 OCCOc1cc(Br)ccc1F Amb24271232 [0,2,0,0,0,0|0,0,0]=2 10078 B12R1.374 OCCOc1cc(Cl)ccc1Cl Amb9245009 [0,2,0,0,0,0|0,0,0]=2 10079 B12R1.374 OCCOc1cc(Cl)ccc1F Amb27451542 [0,2,0,0,0,0|0,0,0]=2 10080 B12R1.374 OCCOc1cc(Cl)nnc1Cl Amb27219978 [0,2,0,0,0,0|2,0,0]=4 10081 B12R1.374 OCCOc1nc(F)ncc1Br Amb35648910 [0,2,0,0,0,0|2,0,0]=4 10082 B12R1.374 OCCOc1nc(F)ncc1Cl Amb35677303 [0,2,0,0,0,0|2,0,0]=4 10083 B12R1.374 OCCSc1cc(Cl)ccc1F Amb28256513 [0,2,0,0,0,0|0,1,0]=3 10084 B12R1.374 OC\C=C\c1cc(Br)ccc1Cl Amb33451181 [0,2,0,0,0,0|1,0,1]=4 10085 B12R1.374 OC\C=C\c1cc(Br)ccc1F Amb25742275 [0,2,0,0,0,0|1,0,1]=4 10086 B12R1.374 OC\C=C\c1cc(Br)ccc1O Amb33333571 [0,2,0,0,0,0|1,0,1]=4 10087 B12R1.374 OC\C=C\c1cc(Cl)ccc1Br Amb33430058 [0,2,0,0,0,0|1,0,1]=4 10088 B12R1.374 OC\C=C\c1cc(Cl)ccc1Cl Amb23442825 [0,2,0,0,0,0|1,0,1]=4 10089 B12R1.374 OC\C=C\c1cc(Cl)ccc1F Amb28127857 [0,2,0,0,0,0|1,0,1]=4 10090 B12R1.374 OC\C=C\c1cc(Cl)ccc1O Amb18649021 [0,2,0,0,0,0|1,0,1]=4 10091 B12R1.374 OC\C=C\c1cc(F)ccc1Br Amb33430225 [0,2,0,0,0,0|1,0,1]=4 10092 B12R1.374 OC\C=C\c1cc(F)ccc1F Amb24082691 [0,2,0,0,0,0|1,0,1]=4 10093 B12R1.374 OC\C=C\c1cc(F)ccc1O Amb33379892 [0,2,0,0,0,0|1,0,1]=4 10094 B12R1.374 OC\C=C\c1cc(O)ccc1Br Amb33227874 [0,2,0,0,0,0|1,0,1]=4 10095 B12R1.374 OC\C=C\c1cc(O)ccc1O Amb33268530 [0,2,0,0,0,0|1,0,1]=4 10096 B12R1.374 Oc1ccc(Br)c(CCCBr)c1 Amb27971117 [0,2,0,0,0,0|2,0,0]=4 10097 B12R1.374 Oc1ccc(Br)c(CCCS)c1 Amb33387013 [0,2,0,0,0,0|1,1,0]=4 10098 B12R1.374 Oc1ccc(Br)cc1CCCCl Amb27638928 [0,2,0,0,0,0|2,0,0]=4 10099 B12R1.374 Oc1ccc(Br)cc1CCCS Amb33333973 [0,2,0,0,0,0|1,1,0]=4 10100 B12R1.374 Oc1ccc(Cl)cc1CCCBr Amb28286546 [0,2,0,0,0,0|2,0,0]=4 10101 B12R1.374 Oc1ccc(Cl)cc1CCCCl Amb28286547 [0,2,0,0,0,0|2,0,0]=4 10102 B12R1.374 Oc1ccc(Cl)cc1CCCS Amb33261242 [0,2,0,0,0,0|1,1,0]=4 10103 B12R1.374 Oc1ccc(F)c(CCCBr)c1 Amb27423567 [0,2,0,0,0,0|2,0,0]=4 10104 B12R1.374 Oc1ccc(F)cc1CCCBr Amb27423565 [0,2,0,0,0,0|2,0,0]=4 10105 B12R1.374 Oc1ccc(F)cc1CCCCl Amb27423571 [0,2,0,0,0,0|2,0,0]=4 10106 B12R1.374 Oc1ccc(F)cc1CCCS Amb33379205 [0,2,0,0,0,0|1,1,0]=4 10107 B12R1.374 Oc1ccc(F)cc1OCCCl Amb27974242 [0,2,0,0,0,0|1,0,0]=3 10108 B12R1.374 Oc1ccc(I)c(CCCCl)c1 Amb27263907 [0,2,0,0,0,0|2,0,0]=4 10109 B12R1.374 Oc1ccc(I)cc1CCCBr Amb27622483 [0,2,0,0,0,0|2,0,0]=4 10110 B12R1.374 Oc1ccc(O)c(CCCBr)c1 Amb26966089 [0,2,0,0,0,0|2,0,0]=4 10111 B12R1.374 Oc1ccc(O)c(CCCCl)c1 Amb27192380 [0,2,0,0,0,0|2,0,0]=4 10112 B12R1.374 Oc1ccc(O)c(CCCS)c1 Amb33268155 [0,2,0,0,0,0|1,1,0]=4 10113 B12R1.374 Oc1ccc(S)c(CCCBr)c1 Amb28323411 [0,2,0,0,0,0|2,0,0]=4 10114 B12R1.374 Oc1ccc(S)c(CCCCl)c1 Amb27796397 [0,2,0,0,0,0|2,0,0]=4 10115 B12R1.374 SCCCc1cc(Br)ccc1Cl Amb33386525 [0,2,0,0,0,0|1,1,0]=4 10116 B12R1.374 SCCCc1cc(Cl)ccc1Br Amb33478281 [0,2,0,0,0,0|1,1,0]=4 10117 B12R1.374 SCCOc1cc(Br)ccc1Cl Amb27835576 [0,2,0,0,0,0|0,1,0]=3 10118 B12R1.374 SCCOc1cc(Cl)ccc1Cl Amb17245965 [0,2,0,0,0,0|0,1,0]=3 10119 B12R1.374 Sc1ccc(Br)c(CCCBr)c1 Amb27614077 [0,2,0,0,0,0|2,0,0]=4 10120 B12R1.374 Sc1ccc(Br)c(CCCCl)c1 Amb26995163 [0,2,0,0,0,0|2,0,0]=4 10121 B12R1.374 Sc1ccc(Br)cc1CCCCl Amb25971086 [0,2,0,0,0,0|2,0,0]=4 10122 B12R1.374 Sc1ccc(Cl)cc1CCCCl Amb28435545 [0,2,0,0,0,0|2,0,0]=4 10123 B12R1.374 Sc1ccc(I)c(CCCBr)c1 Amb27423732 [0,2,0,0,0,0|2,0,0]=4 10124 B12R1.374 Sc1ccc(I)c(CCCCl)c1 Amb28368478 [0,2,0,0,0,0|2,0,0]=4 10125 B12R1.374 Sc1ccc(I)cc1CCCBr Amb27423731 [0,2,0,0,0,0|2,0,0]=4 10126 B12R1.374 Sc1ccc(I)cc1CCCCl Amb28368477 [0,2,0,0,0,0|2,0,0]=4 10127 B12R1.1631 BrCCCc1c(Br)cccc1I Amb28208339 [0,2,0,0,0,0|2,0,0]=4 10128 B12R1.1631 BrCCOc1c(Br)cccc1Br Amb6632263 [0,2,0,0,0,0|1,0,0]=3 10129 B12R1.1631 C#CCOc1c(C)cccc1C Amb17872264 [0,2,0,0,0,0|1,0,1]=4 10130 B12R1.1631 C#CCOc1c(C)cccc1Cl Amb28382931 [0,2,0,0,0,0|1,0,1]=4 10131 B12R1.1631 C#CCOc1c(Cl)cccc1Cl Amb2724157 [0,2,0,0,0,0|1,0,1]=4 10132 B12R1.1631 C#CCOc1c(F)cccc1F Amb27589097 [0,2,0,0,0,0|1,0,1]=4 10133 B12R1.1631 C=CCOc1c(Br)cccc1Br Amb27946036 [0,2,0,0,0,0|1,0,1]=4 10134 B12R1.1631 C=CCOc1c(C)cccc1Cl Amb28044119 [0,2,0,0,0,0|1,0,1]=4 10135 B12R1.1631 C=CCOc1c(C)cccc1N Amb27407078 [0,2,0,0,0,0|1,0,1]=4 10136 B12R1.1631 C=CCOc1c(Cl)cccc1Cl Amb25075776 [0,2,0,0,0,0|1,0,1]=4 10137 B12R1.1631 C=CCOc1c(F)cccc1F Amb22641482 [0,2,0,0,0,0|1,0,1]=4 10138 B12R1.1631 C=CCOc1c(N)cccc1F Amb28287242 [0,2,0,0,0,0|1,0,1]=4 10139 B12R1.1631 CC1=C(OCCN)C(=O)C=CN1 Amb27796330 [0,2,0,0,0,0|2,0,0]=4 10140 B12R1.1631 CCCCc1c(C)cccc1N Amb27812884 [0,2,0,0,0,0|2,0,0]=4 10141 B12R1.1631 CCCCc1c(N)cccc1Br Amb29889508 [0,2,0,0,0,0|2,0,0]=4 10142 B12R1.1631 CCCCc1c(O)cccc1O Amb27211987 [0,2,0,0,0,0|2,0,0]=4 10143 B12R1.1631 CCCNc1c(C)cccc1Br Amb35721344 [0,2,0,0,0,0|2,0,0]=4 10144 B12R1.1631 CCCNc1c(C)cccc1C Amb9174039 [0,2,0,0,0,0|2,0,0]=4 10145 B12R1.1631 CCCNc1c(C)cccc1Cl Amb27784256 [0,2,0,0,0,0|2,0,0]=4 10146 B12R1.1631 CCCNc1c(C)cccc1F Amb28423309 [0,2,0,0,0,0|2,0,0]=4 10147 B12R1.1631 CCCNc1c(C)cccc1N Amb24678901 [0,2,0,0,0,0|2,0,0]=4 10148 B12R1.1631 CCCNc1c(F)cccc1Br Amb27840814 [0,2,0,0,0,0|2,0,0]=4 10149 B12R1.1631 CCCNc1c(F)cccc1F Amb7784430 [0,2,0,0,0,0|2,0,0]=4 10150 B12R1.1631 CCCNc1c(N)cccc1Br Amb32708759 [0,2,0,0,0,0|2,0,0]=4 10151 B12R1.1631 CCCNc1c(N)cccc1F Amb22289420 [0,2,0,0,0,0|2,0,0]=4 10152 B12R1.1631 CCCOC1=C(C)OC=CC1=O Amb18035383 [0,2,0,0,0,0|2,0,0]=4 10153 B12R1.1631 CCCOc1c(Br)cccc1Br Amb26472880 [0,2,0,0,0,0|1,0,0]=3 10154 B12R1.1631 CCCOc1c(C)cccc1C Amb28047213 [0,2,0,0,0,0|1,0,0]=3 10155 B12R1.1631 CCCOc1c(C)cccc1Cl Amb28185653 [0,2,0,0,0,0|1,0,0]=3 10156 B12R1.1631 CCCOc1c(C)cccc1N Amb27233002 [0,2,0,0,0,0|1,0,0]=3 10157 B12R1.1631 CCCOc1c(N)cccc1Br Amb25258745 [0,2,0,0,0,0|1,0,0]=3 10158 B12R1.1631 CCCOc1c(N)cccc1Cl Amb840118 [0,2,0,0,0,0|1,0,0]=3 10159 B12R1.1631 CCCOc1c(N)cccc1Cl Amb8627521 [0,2,0,0,0,0|1,0,0]=3 10160 B12R1.1631 CCCOc1c(N)cccc1F Amb25678737 [0,2,0,0,0,0|1,0,0]=3 10161 B12R1.1631 CCCOc1c(N)cncc1Br Amb27472758 [0,2,0,0,0,0|2,0,0]=4 10162 B12R1.1631 CCCOc1c(N)cncc1Cl Amb25874815 [0,2,0,0,0,0|2,0,0]=4 10163 B12R1.1631 CCCOc1c(O)cccc1Br Amb22896497 [0,2,0,0,0,0|1,0,0]=3 10164 B12R1.1631 CCCOc1c(O)ccnc1C Amb17219248 [0,2,0,0,0,0|2,0,0]=4 10165 B12R1.1631 CCCSc1c(Cl)cccc1Cl Amb28455300 [0,2,0,0,0,0|1,1,0]=4 10166 B12R1.1631 CCCSc1c(N)cccc1Br Amb35591419 [0,2,0,0,0,0|1,1,0]=4 10167 B12R1.1631 CCCSc1c(N)cccc1F Amb27946345 [0,2,0,0,0,0|1,1,0]=4 10168 B12R1.1631 COCOc1c(Br)cccc1Br Amb25280184 [0,2,0,0,0,0|2,0,0]=4 10169 B12R1.1631 COCOc1c(C)cccc1C Amb28422599 [0,2,0,0,0,0|2,0,0]=4 10170 B12R1.1631 COCOc1c(Cl)cccc1Cl Amb24732716 [0,2,0,0,0,0|2,0,0]=4 10171 B12R1.1631 COCOc1c(F)cccc1Br Amb27652191 [0,2,0,0,0,0|2,0,0]=4 10172 B12R1.1631 COCOc1c(F)cccc1Cl Amb28400667 [0,2,0,0,0,0|2,0,0]=4 10173 B12R1.1631 CSCOc1c(Br)cccc1Br Amb27489108 [0,2,0,0,0,0|2,0,0]=4 10174 B12R1.1631 CSCOc1c(F)cccc1F Amb27261359 [0,2,0,0,0,0|2,0,0]=4 10175 B12R1.1631 Cc1cccc(Br)c1CCCBr Amb26532699 [0,2,0,0,0,0|2,0,0]=4 10176 B12R1.1631 Cc1cccc(Br)c1CCCCl Amb26424709 [0,2,0,0,0,0|2,0,0]=4 10177 B12R1.1631 Cc1cccc(Br)c1NCCF Amb35706683 [0,2,0,0,0,0|2,0,0]=4 10178 B12R1.1631 Cc1cccc(Br)c1NCCN Amb35721345 [0,2,0,0,0,0|2,0,0]=4 10179 B12R1.1631 Cc1cccc(Br)c1NCCO Amb35706949 [0,2,0,0,0,0|1,0,0]=3 10180 B12R1.1631 Cc1cccc(C)c1C#CCO Amb27853765 [0,2,0,0,0,0|1,0,1]=4 10181 B12R1.1631 Cc1cccc(C)c1CCCBr Amb26392428 [0,2,0,0,0,0|2,0,0]=4 10182 B12R1.1631 Cc1cccc(C)c1CCCCl Amb26656221 [0,2,0,0,0,0|2,0,0]=4 10183 B12R1.1631 Cc1cccc(C)c1CCCN Amb18251668 [0,2,0,0,0,0|2,0,0]=4 10184 B12R1.1631 Cc1cccc(C)c1CCCO Amb27217279 [0,2,0,0,0,0|1,0,0]=3 10185 B12R1.1631 Cc1cccc(C)c1CCCS Amb32726843 [0,2,0,0,0,0|1,1,0]=4 10186 B12R1.1631 Cc1cccc(C)c1NCCCl Amb17335665 [0,2,0,0,0,0|2,0,0]=4 10187 B12R1.1631 Cc1cccc(C)c1NCCN Amb17091053 [0,2,0,0,0,0|2,0,0]=4 10188 B12R1.1631 Cc1cccc(C)c1NCCO Amb17306428 [0,2,0,0,0,0|1,0,0]=3 10189 B12R1.1631 Cc1cccc(C)c1OCC#N Amb5780864 [0,2,0,0,0,0|1,0,1]=4 10190 B12R1.1631 Cc1cccc(C)c1OCC=O Amb5731825 [0,2,0,0,0,0|0,0,2]=4 10191 B12R1.1631 Cc1cccc(C)c1OCCBr Amb1648711 [0,2,0,0,0,0|1,0,0]=3 10192 B12R1.1631 Cc1cccc(C)c1OCCCl Amb8828410 [0,2,0,0,0,0|1,0,0]=3 10193 B12R1.1631 Cc1cccc(C)c1OCCF Amb28124342 [0,2,0,0,0,0|1,0,0]=3 10194 B12R1.1631 Cc1cccc(C)c1OCCN Amb6336754 [0,2,0,0,0,0|1,0,0]=3 10195 B12R1.1631 Cc1cccc(C)c1OCCN Amb6383665 [0,2,0,0,0,0|1,0,0]=3 10196 B12R1.1631 Cc1cccc(C)c1OCCO Amb9370596 [0,2,0,0,0,0|0,0,0]=2 10197 B12R1.1631 Cc1cccc(C)c1OCCS Amb6255104 [0,2,0,0,0,0|0,1,0]=3 10198 B12R1.1631 Cc1cccc(C)c1SCCBr Amb27264830 [0,2,0,0,0,0|1,1,0]=4 10199 B12R1.1631 Cc1cccc(C)c1SCCN Amb28137918 [0,2,0,0,0,0|1,1,0]=4 10200 B12R1.1631 Cc1cccc(C)c1SCCO Amb2687599 [0,2,0,0,0,0|0,1,0]=3 10201 B12R1.1631 Cc1cccc(C)c1\C=C\CO Amb33359467 [0,2,0,0,0,0|1,0,1]=4 10202 B12R1.1631 Cc1cccc(Cl)c1CCCBr Amb25922220 [0,2,0,0,0,0|2,0,0]=4 10203 B12R1.1631 Cc1cccc(Cl)c1CCCCl Amb25234260 [0,2,0,0,0,0|2,0,0]=4 10204 B12R1.1631 Cc1cccc(Cl)c1CCCN Amb26059714 [0,2,0,0,0,0|2,0,0]=4 10205 B12R1.1631 Cc1cccc(Cl)c1CCCN Amb32782496 [0,2,0,0,0,0|2,0,0]=4 10206 B12R1.1631 Cc1cccc(Cl)c1CCCO Amb25791304 [0,2,0,0,0,0|1,0,0]=3 10207 B12R1.1631 Cc1cccc(Cl)c1CCCS Amb33413820 [0,2,0,0,0,0|1,1,0]=4 10208 B12R1.1631 Cc1cccc(Cl)c1NCCF Amb27648002 [0,2,0,0,0,0|2,0,0]=4 10209 B12R1.1631 Cc1cccc(Cl)c1OCCBr Amb10608622 [0,2,0,0,0,0|1,0,0]=3 10210 B12R1.1631 Cc1cccc(Cl)c1OCCN Amb6369157 [0,2,0,0,0,0|1,0,0]=3 10211 B12R1.1631 Cc1cccc(Cl)c1OCCN Amb6859378 [0,2,0,0,0,0|1,0,0]=3 10212 B12R1.1631 Cc1cccc(Cl)c1OCCO Amb27762313 [0,2,0,0,0,0|0,0,0]=2 10213 B12R1.1631 Cc1cccc(Cl)c1\C=C\CO Amb33259733 [0,2,0,0,0,0|1,0,1]=4 10214 B12R1.1631 Cc1cccc(F)c1CCCBr Amb24637088 [0,2,0,0,0,0|2,0,0]=4 10215 B12R1.1631 Cc1cccc(F)c1CCCCl Amb27669873 [0,2,0,0,0,0|2,0,0]=4 10216 B12R1.1631 Cc1cccc(F)c1CCCN Amb27229462 [0,2,0,0,0,0|2,0,0]=4 10217 B12R1.1631 Cc1cccc(F)c1CCCO Amb33148581 [0,2,0,0,0,0|1,0,0]=3 10218 B12R1.1631 Cc1cccc(F)c1CCCS Amb33148308 [0,2,0,0,0,0|1,1,0]=4 10219 B12R1.1631 Cc1cccc(F)c1NCCN Amb27164797 [0,2,0,0,0,0|2,0,0]=4 10220 B12R1.1631 Cc1cccc(F)c1NCCO Amb27595906 [0,2,0,0,0,0|1,0,0]=3 10221 B12R1.1631 Cc1cccc(F)c1OCCN Amb24367943 [0,2,0,0,0,0|1,0,0]=3 10222 B12R1.1631 Cc1cccc(F)c1\C=C\CO Amb33143160 [0,2,0,0,0,0|1,0,1]=4 10223 B12R1.1631 Cc1cccc(I)c1CCCBr Amb28290904 [0,2,0,0,0,0|2,0,0]=4 10224 B12R1.1631 Cc1cccc(N)c1CCCBr Amb25223463 [0,2,0,0,0,0|2,0,0]=4 10225 B12R1.1631 Cc1cccc(N)c1NCCO Amb28244081 [0,2,0,0,0,0|1,0,0]=3 10226 B12R1.1631 Cc1cccc(N)c1OCCN Amb28188786 [0,2,0,0,0,0|1,0,0]=3 10227 B12R1.1631 Cc1cccc(N)c1OCCO Amb25324902 [0,2,0,0,0,0|0,0,0]=2 10228 B12R1.1631 Cc1cccc(N)c1SCCO Amb28244082 [0,2,0,0,0,0|0,1,0]=3 10229 B12R1.1631 Cc1cccc(O)c1CCCBr Amb28245942 [0,2,0,0,0,0|2,0,0]=4 10230 B12R1.1631 Cc1cccc(O)c1CCCCl Amb27199955 [0,2,0,0,0,0|2,0,0]=4 10231 B12R1.1631 Cc1cccc(S)c1CCCBr Amb27846993 [0,2,0,0,0,0|2,0,0]=4 10232 B12R1.1631 Cc1cccc(S)c1CCCCl Amb25961171 [0,2,0,0,0,0|2,0,0]=4 10233 B12R1.1631 Cc1cncc(C)c1OCCN Amb27849241 [0,2,0,0,0,0|2,0,0]=4 10234 B12R1.1631 Cc1nccc(Cl)c1OCCO Amb27186396 [0,2,0,0,0,0|1,0,0]=3 10235 B12R1.1631 ClCCCc1c(Br)cccc1Br Amb25208586 [0,2,0,0,0,0|2,0,0]=4 10236 B12R1.1631 ClCCCc1c(Br)cccc1I Amb26917468 [0,2,0,0,0,0|2,0,0]=4 10237 B12R1.1631 ClCCCc1c(Cl)cccc1Br Amb26599739 [0,2,0,0,0,0|2,0,0]=4 10238 B12R1.1631 ClCCCc1c(Cl)cccc1Cl Amb24341769 [0,2,0,0,0,0|2,0,0]=4 10239 B12R1.1631 ClCCOc1c(Br)cccc1Br Amb8828462 [0,2,0,0,0,0|1,0,0]=3 10240 B12R1.1631 ClCCOc1c(Cl)cccc1Cl Amb1152442 [0,2,0,0,0,0|1,0,0]=3 10241 B12R1.1631 Clc1cccc(Br)c1CCCBr Amb25986634 [0,2,0,0,0,0|2,0,0]=4 10242 B12R1.1631 Clc1cccc(Cl)c1CCCBr Amb24456278 [0,2,0,0,0,0|2,0,0]=4 10243 B12R1.1631 Clc1cccc(Cl)c1OCCBr Amb1152417 [0,2,0,0,0,0|1,0,0]=3 10244 B12R1.1631 FCCOc1c(Cl)cccc1Cl Amb28381914 [0,2,0,0,0,0|1,0,0]=3 10245 B12R1.1631 FCCOc1c(F)cccc1Cl Amb27946634 [0,2,0,0,0,0|1,0,0]=3 10246 B12R1.1631 Fc1cccc(Br)c1CCCBr Amb25312282 [0,2,0,0,0,0|2,0,0]=4 10247 B12R1.1631 Fc1cccc(Br)c1CCCCl Amb26617884 [0,2,0,0,0,0|2,0,0]=4 10248 B12R1.1631 Fc1cccc(Br)c1CCCS Amb33478531 [0,2,0,0,0,0|1,1,0]=4 10249 B12R1.1631 Fc1cccc(Br)c1OCCBr Amb22896607 [0,2,0,0,0,0|1,0,0]=3 10250 B12R1.1631 Fc1cccc(Cl)c1CCCBr Amb17104568 [0,2,0,0,0,0|2,0,0]=4 10251 B12R1.1631 Fc1cccc(Cl)c1CCCCl Amb17104540 [0,2,0,0,0,0|2,0,0]=4 10252 B12R1.1631 Fc1cccc(Cl)c1CCCS Amb17402978 [0,2,0,0,0,0|1,1,0]=4 10253 B12R1.1631 Fc1cccc(Cl)c1OCCCl Amb27830731 [0,2,0,0,0,0|1,0,0]=3 10254 B12R1.1631 Fc1cccc(F)c1CCCBr Amb25152621 [0,2,0,0,0,0|2,0,0]=4 10255 B12R1.1631 Fc1cccc(F)c1CCCCl Amb25189588 [0,2,0,0,0,0|2,0,0]=4 10256 B12R1.1631 Fc1cccc(F)c1CCCS Amb33314363 [0,2,0,0,0,0|1,1,0]=4 10257 B12R1.1631 Fc1cccc(F)c1OCCBr Amb26615147 [0,2,0,0,0,0|1,0,0]=3 10258 B12R1.1631 Fc1cccc(F)c1OCCCl Amb27254355 [0,2,0,0,0,0|1,0,0]=3 10259 B12R1.1631 Fc1cccc(S)c1CCCBr Amb28133830 [0,2,0,0,0,0|2,0,0]=4 10260 B12R1.1631 Fc1cccc(S)c1CCCCl Amb27423555 [0,2,0,0,0,0|2,0,0]=4 10261 B12R1.1631 N#CCOc1c(Cl)cccc1Cl Amb2725963 [0,2,0,0,0,0|1,0,1]=4 10262 B12R1.1631 NCCCc1c(Cl)cccc1Br Amb24447135 [0,2,0,0,0,0|2,0,0]=4 10263 B12R1.1631 NCCCc1c(Cl)cccc1Cl Amb32665389 [0,2,0,0,0,0|2,0,0]=4 10264 B12R1.1631 NCCCc1c(Cl)cccc1Cl Amb9304926 [0,2,0,0,0,0|2,0,0]=4 10265 B12R1.1631 NCCCc1c(F)cccc1Br Amb28127001 [0,2,0,0,0,0|2,0,0]=4 10266 B12R1.1631 NCCCc1c(F)cccc1Cl Amb22548235 [0,2,0,0,0,0|2,0,0]=4 10267 B12R1.1631 NCCCc1c(F)cccc1Cl Amb5735482 [0,2,0,0,0,0|2,0,0]=4 10268 B12R1.1631 NCCCc1c(F)cccc1F Amb18981388 [0,2,0,0,0,0|2,0,0]=4 10269 B12R1.1631 NCCCc1c(O)cccc1Br Amb33331524 [0,2,0,0,0,0|2,0,0]=4 10270 B12R1.1631 NCCCc1c(O)cccc1Cl Amb28365633 [0,2,0,0,0,0|2,0,0]=4 10271 B12R1.1631 NCCCc1c(O)cccc1F Amb25149830 [0,2,0,0,0,0|2,0,0]=4 10272 B12R1.1631 NCCCc1c(O)cccc1O Amb27238060 [0,2,0,0,0,0|2,0,0]=4 10273 B12R1.1631 NCCNc1c(F)cccc1F Amb17091087 [0,2,0,0,0,0|2,0,0]=4 10274 B12R1.1631 NCCNc1c(N)cccc1Br Amb35638510 [0,2,0,0,0,0|2,0,0]=4 10275 B12R1.1631 NCCNc1c(N)cccc1Cl Amb18991499 [0,2,0,0,0,0|2,0,0]=4 10276 B12R1.1631 NCCOc1c(Cl)cccc1Br Amb28075330 [0,2,0,0,0,0|1,0,0]=3 10277 B12R1.1631 NCCOc1c(Cl)cccc1Cl Amb29844657 [0,2,0,0,0,0|1,0,0]=3 10278 B12R1.1631 NCCOc1c(Cl)cccc1Cl Amb5781217 [0,2,0,0,0,0|1,0,0]=3 10279 B12R1.1631 NCCOc1c(Cl)cncc1Cl Amb27634119 [0,2,0,0,0,0|2,0,0]=4 10280 B12R1.1631 NCCOc1c(F)cccc1Br Amb25896405 [0,2,0,0,0,0|1,0,0]=3 10281 B12R1.1631 NCCOc1c(F)cccc1Cl Amb27199198 [0,2,0,0,0,0|1,0,0]=3 10282 B12R1.1631 NCCOc1c(F)cccc1F Amb22396841 [0,2,0,0,0,0|1,0,0]=3 10283 B12R1.1631 NCCOc1c(F)cncc1F Amb32880268 [0,2,0,0,0,0|2,0,0]=4 10284 B12R1.1631 NCCOc1c(O)cccc1Br Amb33336515 [0,2,0,0,0,0|1,0,0]=3 10285 B12R1.1631 NCCOc1c(O)cccc1Cl Amb33256217 [0,2,0,0,0,0|1,0,0]=3 10286 B12R1.1631 Nc1cccc(Br)c1CCCBr Amb27259767 [0,2,0,0,0,0|2,0,0]=4 10287 B12R1.1631 Nc1cccc(Br)c1CCCCl Amb24626552 [0,2,0,0,0,0|2,0,0]=4 10288 B12R1.1631 Nc1cccc(Br)c1NCCF Amb35638514 [0,2,0,0,0,0|2,0,0]=4 10289 B12R1.1631 Nc1cccc(Br)c1NCCO Amb35638513 [0,2,0,0,0,0|1,0,0]=3 10290 B12R1.1631 Nc1cccc(Br)c1OCCF Amb25898835 [0,2,0,0,0,0|1,0,0]=3 10291 B12R1.1631 Nc1cccc(Br)c1OCCO Amb25898836 [0,2,0,0,0,0|0,0,0]=2 10292 B12R1.1631 Nc1cccc(Br)c1SCCO Amb35591421 [0,2,0,0,0,0|0,1,0]=3 10293 B12R1.1631 Nc1cccc(Cl)c1OCCF Amb25108017 [0,2,0,0,0,0|1,0,0]=3 10294 B12R1.1631 Nc1cccc(Cl)c1OCCO Amb6680949 [0,2,0,0,0,0|0,0,0]=2 10295 B12R1.1631 Nc1cccc(Cl)c1SCCO Amb8935464 [0,2,0,0,0,0|0,1,0]=3 10296 B12R1.1631 Nc1cccc(F)c1CCCBr Amb27614018 [0,2,0,0,0,0|2,0,0]=4 10297 B12R1.1631 Nc1cccc(F)c1CCCCl Amb27614024 [0,2,0,0,0,0|2,0,0]=4 10298 B12R1.1631 Nc1cccc(F)c1OCCF Amb26375864 [0,2,0,0,0,0|1,0,0]=3 10299 B12R1.1631 Nc1cccc(F)c1OCCO Amb24729037 [0,2,0,0,0,0|0,0,0]=2 10300 B12R1.1631 Nc1cccc(N)c1CCCCl Amb27209712 [0,2,0,0,0,0|2,0,0]=4 10301 B12R1.1631 Nc1cccc(O)c1CCCCl Amb27625210 [0,2,0,0,0,0|2,0,0]=4 10302 B12R1.1631 Nc1cncc(Br)c1OCCO Amb27484727 [0,2,0,0,0,0|1,0,0]=3 10303 B12R1.1631 Nc1cncc(Cl)c1OCCO Amb26326966 [0,2,0,0,0,0|1,0,0]=3 10304 B12R1.1631 O=CCOc1c(Cl)cccc1Cl Amb5731860 [0,2,0,0,0,0|0,0,2]=4 10305 B12R1.1631 OCCCc1c(Cl)cccc1Br Amb25829173 [0,2,0,0,0,0|1,0,0]=3 10306 B12R1.1631 OCCCc1c(Cl)cccc1Cl Amb24356168 [0,2,0,0,0,0|1,0,0]=3 10307 B12R1.1631 OCCCc1c(Cl)cncc1Cl Amb27169545 [0,2,0,0,0,0|2,0,0]=4 10308 B12R1.1631 OCCCc1c(F)cccc1Br Amb33241224 [0,2,0,0,0,0|1,0,0]=3 10309 B12R1.1631 OCCCc1c(F)cccc1Cl Amb17089506 [0,2,0,0,0,0|1,0,0]=3 10310 B12R1.1631 OCCCc1c(F)cccc1F Amb24447301 [0,2,0,0,0,0|1,0,0]=3 10311 B12R1.1631 OCCCc1c(F)cncc1F Amb29876730 [0,2,0,0,0,0|2,0,0]=4 10312 B12R1.1631 OCCCc1c(O)cccc1Cl Amb24416761 [0,2,0,0,0,0|1,0,0]=3 10313 B12R1.1631 OCCCc1c(O)cccc1F Amb28119944 [0,2,0,0,0,0|1,0,0]=3 10314 B12R1.1631 OCCNc1c(F)cccc1Cl Amb28346199 [0,2,0,0,0,0|1,0,0]=3 10315 B12R1.1631 OCCOc1c(Cl)cccc1Cl Amb4018029 [0,2,0,0,0,0|0,0,0]=2 10316 B12R1.1631 OC\C=C\c1c(Cl)cccc1Br Amb33337614 [0,2,0,0,0,0|1,0,1]=4 10317 B12R1.1631 OC\C=C\c1c(Cl)cccc1Cl Amb33136403 [0,2,0,0,0,0|1,0,1]=4 10318 B12R1.1631 OC\C=C\c1c(F)cccc1Br Amb27666063 [0,2,0,0,0,0|1,0,1]=4 10319 B12R1.1631 OC\C=C\c1c(F)cccc1Cl Amb33136461 [0,2,0,0,0,0|1,0,1]=4 10320 B12R1.1631 OC\C=C\c1c(F)cccc1F Amb33136460 [0,2,0,0,0,0|1,0,1]=4 10321 B12R1.1631 OC\C=C\c1c(O)cccc1Br Amb33336191 [0,2,0,0,0,0|1,0,1]=4 10322 B12R1.1631 OC\C=C\c1c(O)cccc1Cl Amb33261069 [0,2,0,0,0,0|1,0,1]=4 10323 B12R1.1631 Oc1cccc(Br)c1CCCBr Amb25377434 [0,2,0,0,0,0|2,0,0]=4 10324 B12R1.1631 Oc1cccc(Br)c1CCCCl Amb24638372 [0,2,0,0,0,0|2,0,0]=4 10325 B12R1.1631 Oc1cccc(Br)c1CCCS Amb33336526 [0,2,0,0,0,0|1,1,0]=4 10326 B12R1.1631 Oc1cccc(Cl)c1CCCBr Amb27789042 [0,2,0,0,0,0|2,0,0]=4 10327 B12R1.1631 Oc1cccc(Cl)c1CCCCl Amb28202634 [0,2,0,0,0,0|2,0,0]=4 10328 B12R1.1631 Oc1cccc(Cl)c1CCCS Amb33256190 [0,2,0,0,0,0|1,1,0]=4 10329 B12R1.1631 Oc1cccc(F)c1CCCBr Amb27208811 [0,2,0,0,0,0|2,0,0]=4 10330 B12R1.1631 Oc1cccc(F)c1CCCCl Amb27423570 [0,2,0,0,0,0|2,0,0]=4 10331 B12R1.1631 Oc1cccc(S)c1CCCBr Amb28196039 [0,2,0,0,0,0|2,0,0]=4 10332 B12R1.1631 SCCCc1c(Cl)cccc1Br Amb33333768 [0,2,0,0,0,0|1,1,0]=4 10333 B12R1.1631 SCCCc1c(Cl)cccc1Cl Amb33258780 [0,2,0,0,0,0|1,1,0]=4 10334 B12R1.1631 SCCOc1c(Br)cccc1Br Amb27853476 [0,2,0,0,0,0|0,1,0]=3 10335 B12R1.1631 SCCOc1c(Cl)cccc1Cl Amb6663455 [0,2,0,0,0,0|0,1,0]=3 10336 B12R1.1631 Sc1cccc(Br)c1CCCCl Amb27259749 [0,2,0,0,0,0|2,0,0]=4 10337 B12R1.1631 Sc1cccc(Cl)c1CCCBr Amb27795116 [0,2,0,0,0,0|2,0,0]=4 10338 B12R1.1631 Sc1cccc(Cl)c1CCCCl Amb27239050 [0,2,0,0,0,0|2,0,0]=4 10339 B12R1.1778 CC1(CCCO)C=CC=CC1=O Amb27176175 [0,2,0,0,0,0|1,0,1]=4 10340 B12R1.28 BrCCCCc1cccc(Br)c1 Amb34914035 [0,2,0,0,0,0|2,0,0]=4 10341 B12R1.28 BrCCCOc1cccc(I)c1 Amb8838635 [0,2,0,0,0,0|1,0,0]=3 10342 B12R1.28 BrCCCOc1cncc(Br)c1 Amb32413612 [0,2,0,0,0,0|2,0,0]=4 10343 B12R1.28 BrCC\C=C\c1cccc(Br)c1 Amb29880592 [0,2,0,0,0,0|2,0,0]=4 10344 B12R1.28 C#CCCCc1cccc(Br)c1 Amb33433763 [0,2,0,0,0,0|2,0,0]=4 10345 B12R1.28 C#CCCNc1cccc(Cl)c1 Amb27816959 [0,2,0,0,0,0|2,0,0]=4 10346 B12R1.28 C#CCCNc1cccc(I)c1 Amb27591883 [0,2,0,0,0,0|2,0,0]=4 10347 B12R1.28 C#CCCOc1cccc(C)n1 Amb27982554 [0,2,0,0,0,0|2,0,0]=4 10348 B12R1.28 C#CCCOc1cccc(Cl)c1 Amb27455909 [0,2,0,0,0,0|1,0,0]=3 10349 B12R1.28 C#CCCOc1cccc(F)c1 Amb24706220 [0,2,0,0,0,0|1,0,0]=3 10350 B12R1.28 C#CCCSc1cccc(Br)c1 Amb28341287 [0,2,0,0,0,0|1,1,0]=4 10351 B12R1.28 C#CCCSc1cccc(Cl)c1 Amb28058150 [0,2,0,0,0,0|1,1,0]=4 10352 B12R1.28 C#CCCSc1cccc(O)c1 Amb27834380 [0,2,0,0,0,0|1,1,0]=4 10353 B12R1.28 C#CCOCc1cccc(C)c1 Amb27664452 [0,2,0,0,0,0|1,0,1]=4 10354 B12R1.28 C#CCOCc1cccc(N)c1 Amb24116425 [0,2,0,0,0,0|1,0,1]=4 10355 B12R1.28 C=CCCNc1cccc(Br)c1 Amb27589967 [0,2,0,0,0,0|2,0,0]=4 10356 B12R1.28 C=CCCNc1cccc(C)c1 Amb27789522 [0,2,0,0,0,0|2,0,0]=4 10357 B12R1.28 C=CCCNc1cccc(Cl)c1 Amb27470578 [0,2,0,0,0,0|2,0,0]=4 10358 B12R1.28 C=CCCNc1cccc(I)c1 Amb27250272 [0,2,0,0,0,0|2,0,0]=4 10359 B12R1.28 C=CCCOc1cccc(F)c1 Amb33474289 [0,2,0,0,0,0|1,0,0]=3 10360 B12R1.28 C=CCCOc1cccc(N)c1 Amb33545664 [0,2,0,0,0,0|1,0,0]=3 10361 B12R1.28 C=CCOCc1cccc(Br)c1 Amb30590522 [0,2,0,0,0,0|1,0,1]=4 10362 B12R1.28 CC#CCOc1cccc(Br)c1 Amb27412733 [0,2,0,0,0,0|1,0,1]=4 10363 B12R1.28 CC#CCOc1cccc(C)c1 Amb28071912 [0,2,0,0,0,0|1,0,1]=4 10364 B12R1.28 CC#CCOc1cccc(I)c1 Amb27749835 [0,2,0,0,0,0|1,0,1]=4 10365 B12R1.28 CCCC#Cc1cccc(C)c1 Amb26604761 [0,2,0,0,0,0|2,0,0]=4 10366 B12R1.28 CCCC#Cc1cccc(Cl)c1 Amb28124858 [0,2,0,0,0,0|2,0,0]=4 10367 B12R1.28 CCCC#Cc1cccc(F)c1 Amb25221923 [0,2,0,0,0,0|2,0,0]=4 10368 B12R1.28 CCCC#Cc1cccc(I)c1 Amb24604509 [0,2,0,0,0,0|2,0,0]=4 10369 B12R1.28 CCCC#Cc1cccc(N)c1 Amb25863654 [0,2,0,0,0,0|2,0,0]=4 10370 B12R1.28 CCCC#Cc1cccc(O)c1 Amb24568856 [0,2,0,0,0,0|2,0,0]=4 10371 B12R1.28 CCCCCc1cccc(F)c1 Amb22235097 [0,2,0,0,0,0|2,0,0]=4 10372 B12R1.28 CCCCCc1cccc(O)c1 Amb8388639 [0,2,0,0,0,0|2,0,0]=4 10373 B12R1.28 CCCCNc1cccc(Br)c1 Amb6696673 [0,2,0,0,0,0|2,0,0]=4 10374 B12R1.28 CCCCNc1cccc(C)c1 Amb6684517 [0,2,0,0,0,0|2,0,0]=4 10375 B12R1.28 CCCCNc1cccc(Cl)c1 Amb6695729 [0,2,0,0,0,0|2,0,0]=4 10376 B12R1.28 CCCCNc1cccc(F)c1 Amb6695886 [0,2,0,0,0,0|2,0,0]=4 10377 B12R1.28 CCCCNc1cccc(I)c1 Amb19232035 [0,2,0,0,0,0|2,0,0]=4 10378 B12R1.28 CCCCNc1cccc(I)c1 Amb7760185 [0,2,0,0,0,0|2,0,0]=4 10379 B12R1.28 CCCCOc1cc(Br)ccn1 Amb22276477 [0,2,0,0,0,0|2,0,0]=4 10380 B12R1.28 CCCCOc1cc(Cl)ccn1 Amb22276195 [0,2,0,0,0,0|2,0,0]=4 10381 B12R1.28 CCCCOc1cc(N)ccn1 Amb18798584 [0,2,0,0,0,0|2,0,0]=4 10382 B12R1.28 CCCCOc1cccc(Br)c1 Amb6665074 [0,2,0,0,0,0|1,0,0]=3 10383 B12R1.28 CCCCOc1cccc(Br)n1 Amb19959446 [0,2,0,0,0,0|2,0,0]=4 10384 B12R1.28 CCCCOc1cccc(N)c1 Amb1132055 [0,2,0,0,0,0|1,0,0]=3 10385 B12R1.28 CCCCOc1cccc(N)c1 Amb2140562 [0,2,0,0,0,0|1,0,0]=3 10386 B12R1.28 CCCCOc1cccc(O)c1 Amb3939658 [0,2,0,0,0,0|1,0,0]=3 10387 B12R1.28 CCCCOc1cccc([NH3+])c1 Amb22483190 [0,2,0,0,0,0|1,0,0]=3 10388 B12R1.28 CCCNCc1cccc(Br)c1 Amb1922696 [0,2,0,0,0,0|2,0,0]=4 10389 B12R1.28 CCCNCc1cccc(Br)c1 Amb6864727 [0,2,0,0,0,0|2,0,0]=4 10390 B12R1.28 CCCNCc1cccc(C)c1 Amb20673492 [0,2,0,0,0,0|2,0,0]=4 10391 B12R1.28 CCCNCc1cccc(C)c1 Amb6268946 [0,2,0,0,0,0|2,0,0]=4 10392 B12R1.28 CCCNCc1cccc(Cl)c1 Amb1923473 [0,2,0,0,0,0|2,0,0]=4 10393 B12R1.28 CCCNCc1cccc(Cl)c1 Amb6865252 [0,2,0,0,0,0|2,0,0]=4 10394 B12R1.28 CCCNCc1cccc(F)c1 Amb20673497 [0,2,0,0,0,0|2,0,0]=4 10395 B12R1.28 CCCNCc1cccc(F)c1 Amb6267755 [0,2,0,0,0,0|2,0,0]=4 10396 B12R1.28 CCCNCc1cccc(O)c1 Amb20673478 [0,2,0,0,0,0|2,0,0]=4 10397 B12R1.28 CCCNCc1cccc(O)c1 Amb6263095 [0,2,0,0,0,0|2,0,0]=4 10398 B12R1.28 CCCOCc1cccc(N)c1 Amb8874545 [0,2,0,0,0,0|1,0,0]=3 10399 B12R1.28 CCC\N=C\c1cccc(Br)c1 Amb27762898 [0,2,0,0,0,0|2,0,0]=4 10400 B12R1.28 CCNCCc1cccc(Br)c1 Amb17407066 [0,2,0,0,0,0|2,0,0]=4 10401 B12R1.28 CCNCCc1cccc(C)c1 Amb17193871 [0,2,0,0,0,0|2,0,0]=4 10402 B12R1.28 CCNCCc1cccc(Cl)c1 Amb5785538 [0,2,0,0,0,0|2,0,0]=4 10403 B12R1.28 CCNCCc1cccc(F)c1 Amb8841507 [0,2,0,0,0,0|2,0,0]=4 10404 B12R1.28 CCNCCc1cccc(N)c1 Amb18550383 [0,2,0,0,0,0|2,0,0]=4 10405 B12R1.28 CNCCCc1cccc(Br)c1 Amb17104522 [0,2,0,0,0,0|2,0,0]=4 10406 B12R1.28 CNCCCc1cccc(C)c1 Amb17104500 [0,2,0,0,0,0|2,0,0]=4 10407 B12R1.28 CNCCCc1cccc(Cl)c1 Amb17104508 [0,2,0,0,0,0|2,0,0]=4 10408 B12R1.28 CNCCCc1cccc(F)c1 Amb17605539 [0,2,0,0,0,0|2,0,0]=4 10409 B12R1.28 CNCCNc1cccc(Cl)c1 Amb19025283 [0,2,0,0,0,0|2,0,0]=4 10410 B12R1.28 CNCCNc1cccc(F)c1 Amb19025285 [0,2,0,0,0,0|2,0,0]=4 10411 B12R1.28 CNCCOc1cc(Cl)ccn1 Amb22236271 [0,2,0,0,0,0|2,0,0]=4 10412 B12R1.28 CNCCOc1cccc(Br)c1 Amb7760944 [0,2,0,0,0,0|1,0,0]=3 10413 B12R1.28 CNCCOc1cccc(C)c1 Amb1670237 [0,2,0,0,0,0|1,0,0]=3 10414 B12R1.28 CNCCOc1cccc(C)c1 Amb2140579 [0,2,0,0,0,0|1,0,0]=3 10415 B12R1.28 CNCCOc1cccc(Cl)c1 Amb1106194 [0,2,0,0,0,0|1,0,0]=3 10416 B12R1.28 CNCCOc1cccc(F)c1 Amb2132298 [0,2,0,0,0,0|1,0,0]=3 10417 B12R1.28 CNCCOc1cccc(F)c1 Amb857098 [0,2,0,0,0,0|1,0,0]=3 10418 B12R1.28 CNCCOc1cccc(N)c1 Amb17232614 [0,2,0,0,0,0|1,0,0]=3 10419 B12R1.28 COCC#Cc1cccc(Br)c1 Amb27621469 [0,2,0,0,0,0|1,0,1]=4 10420 B12R1.28 COCC#Cc1cccc(C)c1 Amb25125980 [0,2,0,0,0,0|1,0,1]=4 10421 B12R1.28 COCC#Cc1cccc(Cl)c1 Amb24436599 [0,2,0,0,0,0|1,0,1]=4 10422 B12R1.28 COCC#Cc1cccc(F)c1 Amb27221547 [0,2,0,0,0,0|1,0,1]=4 10423 B12R1.28 COCC#Cc1cccc(N)c1 Amb27868724 [0,2,0,0,0,0|1,0,1]=4 10424 B12R1.28 COCC#Cc1cccc(O)c1 Amb25156562 [0,2,0,0,0,0|1,0,1]=4 10425 B12R1.28 COCCNc1cc(C)ccn1 Amb18798581 [0,2,0,0,0,0|2,0,0]=4 10426 B12R1.28 COCCNc1cc(N)ccn1 Amb17334706 [0,2,0,0,0,0|2,0,0]=4 10427 B12R1.28 COCCNc1cccc(Br)c1 Amb6712246 [0,2,0,0,0,0|1,0,0]=3 10428 B12R1.28 COCCNc1cccc(Br)n1 Amb28364866 [0,2,0,0,0,0|2,0,0]=4 10429 B12R1.28 COCCNc1cccc(C)c1 Amb6706720 [0,2,0,0,0,0|1,0,0]=3 10430 B12R1.28 COCCNc1cccc(Cl)c1 Amb6711841 [0,2,0,0,0,0|1,0,0]=3 10431 B12R1.28 COCCNc1cccc(Cl)n1 Amb21958803 [0,2,0,0,0,0|2,0,0]=4 10432 B12R1.28 COCCNc1cccc(F)c1 Amb6711904 [0,2,0,0,0,0|1,0,0]=3 10433 B12R1.28 COCCNc1cccc(I)c1 Amb7763650 [0,2,0,0,0,0|1,0,0]=3 10434 B12R1.28 COCCNc1ccnc(Cl)c1 Amb27461639 [0,2,0,0,0,0|2,0,0]=4 10435 B12R1.28 COCCNc1ccnc(F)c1 Amb27412834 [0,2,0,0,0,0|2,0,0]=4 10436 B12R1.28 COCCNc1ccnc(N)c1 Amb26605518 [0,2,0,0,0,0|2,0,0]=4 10437 B12R1.28 COCCNc1cncc(Br)c1 Amb27416629 [0,2,0,0,0,0|2,0,0]=4 10438 B12R1.28 COCCNc1cncc(Cl)c1 Amb35706922 [0,2,0,0,0,0|2,0,0]=4 10439 B12R1.28 COCCNc1cncc(N)c1 Amb23454675 [0,2,0,0,0,0|2,0,0]=4 10440 B12R1.28 COCCOc1cc(Br)ccn1 Amb22276471 [0,2,0,0,0,0|1,0,0]=3 10441 B12R1.28 COCCOc1cc(Cl)ccn1 Amb22276482 [0,2,0,0,0,0|1,0,0]=3 10442 B12R1.28 COCCOc1cc(N)ccn1 Amb18799036 [0,2,0,0,0,0|1,0,0]=3 10443 B12R1.28 COCCOc1cccc(Br)c1 Amb6256783 [0,2,0,0,0,0|0,0,0]=2 10444 B12R1.28 COCCOc1cccc(Br)n1 Amb33495168 [0,2,0,0,0,0|1,0,0]=3 10445 B12R1.28 COCCOc1cccc(I)c1 Amb32414014 [0,2,0,0,0,0|0,0,0]=2 10446 B12R1.28 COCCOc1cccc(N)c1 Amb1995345 [0,2,0,0,0,0|0,0,0]=2 10447 B12R1.28 COCCOc1cccc(N)c1 Amb2189171 [0,2,0,0,0,0|0,0,0]=2 10448 B12R1.28 COCCOc1cccc(O)c1 Amb9211000 [0,2,0,0,0,0|0,0,0]=2 10449 B12R1.28 COCCOc1ccnc(Cl)c1 Amb32412903 [0,2,0,0,0,0|1,0,0]=3 10450 B12R1.28 COCCOc1ccnc(Cl)n1 Amb33530033 [0,2,0,0,0,0|2,0,0]=4 10451 B12R1.28 COCCOc1ccnc(N)n1 Amb28555828 [0,2,0,0,0,0|2,0,0]=4 10452 B12R1.28 COCCOc1cncc(Br)c1 Amb22276360 [0,2,0,0,0,0|1,0,0]=3 10453 B12R1.28 COCCOc1cnnc(Cl)c1 Amb22276559 [0,2,0,0,0,0|2,0,0]=4 10454 B12R1.28 COCCOc1nccc(Br)n1 Amb32938558 [0,2,0,0,0,0|2,0,0]=4 10455 B12R1.28 COCOCc1cccc(F)c1 Amb28464085 [0,2,0,0,0,0|2,0,0]=4 10456 B12R1.28 CSCCNc1cccc(Cl)c1 Amb27799357 [0,2,0,0,0,0|1,1,0]=4 10457 B12R1.28 CSCCNc1cccc(N)c1 Amb27975120 [0,2,0,0,0,0|1,1,0]=4 10458 B12R1.28 CSCCOc1cccc(N)c1 Amb17504021 [0,2,0,0,0,0|0,1,0]=3 10459 B12R1.28 C\C=C/COc1cccc(O)c1 Amb27409570 [0,2,0,0,0,0|1,0,1]=4 10460 B12R1.28 C\C=C\COc1cccc(C)c1 Amb27596496 [0,2,0,0,0,0|1,0,1]=4 10461 B12R1.28 C\C=C\COc1cccc(F)c1 Amb27794079 [0,2,0,0,0,0|1,0,1]=4 10462 B12R1.28 C\C=C\COc1cccc(I)c1 Amb28460870 [0,2,0,0,0,0|1,0,1]=4 10463 B12R1.28 Cc1cc(OCCCN)ccn1 Amb32954242 [0,2,0,0,0,0|2,0,0]=4 10464 B12R1.28 Cc1cccc(CCCC#N)c1 Amb25921744 [0,2,0,0,0,0|2,0,0]=4 10465 B12R1.28 Cc1cccc(CCCC=O)c1 Amb33474174 [0,2,0,0,0,0|1,0,1]=4 10466 B12R1.28 Cc1cccc(CCCCBr)c1 Amb34914030 [0,2,0,0,0,0|2,0,0]=4 10467 B12R1.28 Cc1cccc(CCCCI)c1 Amb34914023 [0,2,0,0,0,0|2,0,0]=4 10468 B12R1.28 Cc1cccc(CCCCN)c1 Amb5735493 [0,2,0,0,0,0|2,0,0]=4 10469 B12R1.28 Cc1cccc(CCCCO)c1 Amb34913399 [0,2,0,0,0,0|1,0,0]=3 10470 B12R1.28 Cc1cccc(CCCCO)n1 Amb23441243 [0,2,0,0,0,0|2,0,0]=4 10471 B12R1.28 Cc1cccc(CCCCS)c1 Amb18564155 [0,2,0,0,0,0|1,1,0]=4 10472 B12R1.28 Cc1cccc(CCCON)c1 Amb17089550 [0,2,0,0,0,0|1,0,0]=3 10473 B12R1.28 Cc1cccc(CNCCN)c1 Amb10075511 [0,2,0,0,0,0|2,0,0]=4 10474 B12R1.28 Cc1cccc(CNCCO)c1 Amb28872365 [0,2,0,0,0,0|1,0,0]=3 10475 B12R1.28 Cc1cccc(CNCCO)c1 Amb7757042 [0,2,0,0,0,0|1,0,0]=3 10476 B12R1.28 Cc1cccc(CNCCO)n1 Amb2592517 [0,2,0,0,0,0|2,0,0]=4 10477 B12R1.28 Cc1cccc(COCCN)c1 Amb17061815 [0,2,0,0,0,0|1,0,0]=3 10478 B12R1.28 Cc1cccc(CSCCN)c1 Amb6384541 [0,2,0,0,0,0|1,1,0]=4 10479 B12R1.28 Cc1cccc(CSCCN)c1 Amb844774 [0,2,0,0,0,0|1,1,0]=4 10480 B12R1.28 Cc1cccc(CSCCO)c1 Amb9273886 [0,2,0,0,0,0|0,1,0]=3 10481 B12R1.28 Cc1cccc(NCCC#N)c1 Amb1647378 [0,2,0,0,0,0|2,0,0]=4 10482 B12R1.28 Cc1cccc(NCCCN)c1 Amb17057722 [0,2,0,0,0,0|2,0,0]=4 10483 B12R1.28 Cc1cccc(OCCC#N)c1 Amb6666561 [0,2,0,0,0,0|1,0,0]=3 10484 B12R1.28 Cc1cccc(OCCC=O)c1 Amb5731760 [0,2,0,0,0,0|0,0,1]=3 10485 B12R1.28 Cc1cccc(OCCCBr)c1 Amb1675755 [0,2,0,0,0,0|1,0,0]=3 10486 B12R1.28 Cc1cccc(OCCCCl)c1 Amb1138744 [0,2,0,0,0,0|1,0,0]=3 10487 B12R1.28 Cc1cccc(OCCCN)c1 Amb1108604 [0,2,0,0,0,0|1,0,0]=3 10488 B12R1.28 Cc1cccc(OCCCN)c1 Amb1221739 [0,2,0,0,0,0|1,0,0]=3 10489 B12R1.28 Cc1cccc(OCCCN)n1 Amb19020907 [0,2,0,0,0,0|2,0,0]=4 10490 B12R1.28 Cc1cccc(OCCCO)c1 Amb9004309 [0,2,0,0,0,0|0,0,0]=2 10491 B12R1.28 Cc1cccc(OCCCS)c1 Amb6255373 [0,2,0,0,0,0|0,1,0]=3 10492 B12R1.28 Cc1cccc(OCCNN)c1 Amb17400212 [0,2,0,0,0,0|1,0,0]=3 10493 B12R1.28 Cc1cccc(OCCNO)c1 Amb17088415 [0,2,0,0,0,0|0,0,0]=2 10494 B12R1.28 Cc1cccc(OCCON)c1 Amb17088289 [0,2,0,0,0,0|0,0,0]=2 10495 B12R1.28 Cc1cccc(OC\C=C\Cl)c1 Amb28314535 [0,2,0,0,0,0|1,0,1]=4 10496 B12R1.28 Cc1cccc(SCCC#N)c1 Amb18790888 [0,2,0,0,0,0|1,1,0]=4 10497 B12R1.28 Cc1cccc(SCCC=O)c1 Amb17082972 [0,2,0,0,0,0|0,1,1]=4 10498 B12R1.28 Cc1cccc(SCCCN)c1 Amb17083071 [0,2,0,0,0,0|1,1,0]=4 10499 B12R1.28 Cc1cccc(\C=C\CCBr)c1 Amb17246877 [0,2,0,0,0,0|2,0,0]=4 10500 B12R1.28 Cc1cccc(\C=C\CCCl)c1 Amb17233778 [0,2,0,0,0,0|2,0,0]=4 10501 B12R1.28 Cc1cccc(\C=C\CCN)c1 Amb17232387 [0,2,0,0,0,0|2,0,0]=4 10502 B12R1.28 Cc1ccnc(OCCCN)c1 Amb18308526 [0,2,0,0,0,0|2,0,0]=4 10503 B12R1.28 Cc1cncc(OCCCN)c1 Amb33226787 [0,2,0,0,0,0|2,0,0]=4 10504 B12R1.28 ClCCC#Cc1cccc(Br)c1 Amb35656656 [0,2,0,0,0,0|2,0,0]=4 10505 B12R1.28 ClCCCNc1cccc(Cl)c1 Amb27759269 [0,2,0,0,0,0|2,0,0]=4 10506 B12R1.28 ClCCCOc1cccc(Br)c1 Amb1128139 [0,2,0,0,0,0|1,0,0]=3 10507 B12R1.28 ClCCCOc1cccc(Cl)c1 Amb1126449 [0,2,0,0,0,0|1,0,0]=3 10508 B12R1.28 ClCC\C=C\c1cccc(Br)c1 Amb29880786 [0,2,0,0,0,0|2,0,0]=4 10509 B12R1.28 ClCC\C=C\c1cccc(Cl)c1 Amb17237227 [0,2,0,0,0,0|2,0,0]=4 10510 B12R1.28 Clc1cccc(CCCCBr)c1 Amb32668134 [0,2,0,0,0,0|2,0,0]=4 10511 B12R1.28 Clc1cccc(OCCCBr)c1 Amb8517102 [0,2,0,0,0,0|1,0,0]=3 10512 B12R1.28 Clc1cccc(\C=C\CCBr)c1 Amb17258090 [0,2,0,0,0,0|2,0,0]=4 10513 B12R1.28 FCCCNc1cccc(I)c1 Amb28206460 [0,2,0,0,0,0|2,0,0]=4 10514 B12R1.28 FCCCOc1cc(Br)ccn1 Amb32411102 [0,2,0,0,0,0|2,0,0]=4 10515 B12R1.28 Fc1cccc(CCCCBr)c1 Amb34914038 [0,2,0,0,0,0|2,0,0]=4 10516 B12R1.28 Fc1cccc(CCCCS)c1 Amb18564294 [0,2,0,0,0,0|1,1,0]=4 10517 B12R1.28 Fc1cccc(CSCCCl)c1 Amb535067 [0,2,0,0,0,0|1,1,0]=4 10518 B12R1.28 Fc1cccc(OCCCBr)c1 Amb9209725 [0,2,0,0,0,0|1,0,0]=3 10519 B12R1.28 Fc1cccc(OCCCCl)c1 Amb1129297 [0,2,0,0,0,0|1,0,0]=3 10520 B12R1.28 Fc1cccc(OCCCS)c1 Amb17234297 [0,2,0,0,0,0|0,1,0]=3 10521 B12R1.28 Fc1cccc(\C=C\CCBr)c1 Amb17248421 [0,2,0,0,0,0|2,0,0]=4 10522 B12R1.28 Fc1cccc(\C=C\CCCl)c1 Amb17234151 [0,2,0,0,0,0|2,0,0]=4 10523 B12R1.28 N#CCCCc1cccc(Br)c1 Amb25890631 [0,2,0,0,0,0|2,0,0]=4 10524 B12R1.28 N#CCCCc1cccc(Cl)c1 Amb25891931 [0,2,0,0,0,0|2,0,0]=4 10525 B12R1.28 N#CCCCc1cccc(F)c1 Amb27412306 [0,2,0,0,0,0|2,0,0]=4 10526 B12R1.28 N#CCCCc1cccc(O)c1 Amb25982049 [0,2,0,0,0,0|2,0,0]=4 10527 B12R1.28 N#CCCNc1cccc(Br)c1 Amb7094568 [0,2,0,0,0,0|2,0,0]=4 10528 B12R1.28 N#CCCNc1cccc(Cl)c1 Amb1647289 [0,2,0,0,0,0|2,0,0]=4 10529 B12R1.28 N#CCCNc1cccc(F)c1 Amb8827880 [0,2,0,0,0,0|2,0,0]=4 10530 B12R1.28 N#CCCNc1cccc(O)c1 Amb17142902 [0,2,0,0,0,0|2,0,0]=4 10531 B12R1.28 N#CCCOc1cccc(Br)c1 Amb6261281 [0,2,0,0,0,0|1,0,0]=3 10532 B12R1.28 N#CCCOc1cccc(Cl)c1 Amb6256724 [0,2,0,0,0,0|1,0,0]=3 10533 B12R1.28 N#CCCOc1cccc(F)c1 Amb6261429 [0,2,0,0,0,0|1,0,0]=3 10534 B12R1.28 N#CCCOc1cncc(Cl)c1 Amb28434566 [0,2,0,0,0,0|2,0,0]=4 10535 B12R1.28 N#CCCSc1cccc(O)c1 Amb28189958 [0,2,0,0,0,0|1,1,0]=4 10536 B12R1.28 N#CCOCc1cccc(Cl)c1 Amb28248848 [0,2,0,0,0,0|1,0,1]=4 10537 B12R1.28 NCCC#Cc1cccc(Br)c1 Amb35605477 [0,2,0,0,0,0|2,0,0]=4 10538 B12R1.28 NCCC#Cc1cccc(F)c1 Amb28061681 [0,2,0,0,0,0|2,0,0]=4 10539 B12R1.28 NCCCCc1cccc(Br)c1 Amb18549204 [0,2,0,0,0,0|2,0,0]=4 10540 B12R1.28 NCCCCc1cccc(Cl)c1 Amb5735502 [0,2,0,0,0,0|2,0,0]=4 10541 B12R1.28 NCCCCc1cccc(F)c1 Amb18563815 [0,2,0,0,0,0|2,0,0]=4 10542 B12R1.28 NCCCCc1cccc(O)c1 Amb32954959 [0,2,0,0,0,0|2,0,0]=4 10543 B12R1.28 NCCCNc1cccc(Br)c1 Amb26015621 [0,2,0,0,0,0|2,0,0]=4 10544 B12R1.28 NCCCNc1cccc(Cl)c1 Amb17057728 [0,2,0,0,0,0|2,0,0]=4 10545 B12R1.28 NCCCNc1cccc(F)c1 Amb17057725 [0,2,0,0,0,0|2,0,0]=4 10546 B12R1.28 NCCCNc1cccc(F)c1 Amb33535186 [0,2,0,0,0,0|2,0,0]=4 10547 B12R1.28 NCCCOc1cc(Br)ccn1 Amb22276283 [0,2,0,0,0,0|2,0,0]=4 10548 B12R1.28 NCCCOc1cc(Cl)ccn1 Amb22276287 [0,2,0,0,0,0|2,0,0]=4 10549 B12R1.28 NCCCOc1cc(F)ccn1 Amb33325110 [0,2,0,0,0,0|2,0,0]=4 10550 B12R1.28 NCCCOc1cccc(Br)c1 Amb6273208 [0,2,0,0,0,0|1,0,0]=3 10551 B12R1.28 NCCCOc1cccc(Br)n1 Amb33241908 [0,2,0,0,0,0|2,0,0]=4 10552 B12R1.28 NCCCOc1cccc(Cl)c1 Amb6281701 [0,2,0,0,0,0|1,0,0]=3 10553 B12R1.28 NCCCOc1cccc(Cl)c1 Amb6760501 [0,2,0,0,0,0|1,0,0]=3 10554 B12R1.28 NCCCOc1cccc(Cl)n1 Amb33262576 [0,2,0,0,0,0|2,0,0]=4 10555 B12R1.28 NCCCOc1cccc(F)c1 Amb1140971 [0,2,0,0,0,0|1,0,0]=3 10556 B12R1.28 NCCCOc1cccc(F)c1 Amb30584827 [0,2,0,0,0,0|1,0,0]=3 10557 B12R1.28 NCCCOc1cccc(O)c1 Amb33474154 [0,2,0,0,0,0|1,0,0]=3 10558 B12R1.28 NCCCOc1ccnc(Cl)c1 Amb33052735 [0,2,0,0,0,0|2,0,0]=4 10559 B12R1.28 NCCCOc1cncc(Br)c1 Amb33451074 [0,2,0,0,0,0|2,0,0]=4 10560 B12R1.28 NCCCOc1cncc(F)c1 Amb33197137 [0,2,0,0,0,0|2,0,0]=4 10561 B12R1.28 NCCCSc1cccc(Cl)c1 Amb17083080 [0,2,0,0,0,0|1,1,0]=4 10562 B12R1.28 NCCNCc1cccc(Br)c1 Amb19005476 [0,2,0,0,0,0|2,0,0]=4 10563 B12R1.28 NCCNCc1cccc(Cl)c1 Amb10075509 [0,2,0,0,0,0|2,0,0]=4 10564 B12R1.28 NCCNCc1cccc(Cl)c1 Amb29844473 [0,2,0,0,0,0|2,0,0]=4 10565 B12R1.28 NCCNCc1cccc(F)c1 Amb10075489 [0,2,0,0,0,0|2,0,0]=4 10566 B12R1.28 NCCNCc1cccc(F)c1 Amb29844479 [0,2,0,0,0,0|2,0,0]=4 10567 B12R1.28 NCCNCc1cccc(O)c1 Amb19005503 [0,2,0,0,0,0|2,0,0]=4 10568 B12R1.28 NCCOCc1cccc(Br)c1 Amb17061821 [0,2,0,0,0,0|1,0,0]=3 10569 B12R1.28 NCCOCc1cccc(Cl)c1 Amb17061820 [0,2,0,0,0,0|1,0,0]=3 10570 B12R1.28 NCCOCc1cccc(Cl)c1 Amb33550341 [0,2,0,0,0,0|1,0,0]=3 10571 B12R1.28 NCCOCc1cccc(F)c1 Amb17061818 [0,2,0,0,0,0|1,0,0]=3 10572 B12R1.28 NCCSCc1cccc(Br)c1 Amb6270677 [0,2,0,0,0,0|1,1,0]=4 10573 B12R1.28 NCCSCc1cccc(Cl)c1 Amb6384537 [0,2,0,0,0,0|1,1,0]=4 10574 B12R1.28 NCCSCc1cccc(Cl)c1 Amb844820 [0,2,0,0,0,0|1,1,0]=4 10575 B12R1.28 NCCSCc1cccc(F)c1 Amb6263657 [0,2,0,0,0,0|1,1,0]=4 10576 B12R1.28 NCCSCc1cccc(I)c1 Amb28989359 [0,2,0,0,0,0|1,1,0]=4 10577 B12R1.28 NCC\C=C\c1cccc(Br)c1 Amb26564163 [0,2,0,0,0,0|2,0,0]=4 10578 B12R1.28 NCC\C=C\c1cccc(Cl)c1 Amb17233875 [0,2,0,0,0,0|2,0,0]=4 10579 B12R1.28 NCC\C=C\c1cccc(F)c1 Amb17232532 [0,2,0,0,0,0|2,0,0]=4 10580 B12R1.28 NNCCCc1cccc(Br)c1 Amb33263663 [0,2,0,0,0,0|2,0,0]=4 10581 B12R1.28 NNCCOc1cccc(Br)c1 Amb1116522 [0,2,0,0,0,0|1,0,0]=3 10582 B12R1.28 NNCCOc1cccc(Cl)c1 Amb17401092 [0,2,0,0,0,0|1,0,0]=3 10583 B12R1.28 NNCCOc1cccc(F)c1 Amb17400322 [0,2,0,0,0,0|1,0,0]=3 10584 B12R1.28 NOCC#Cc1cccc(F)c1 Amb24689943 [0,2,0,0,0,0|1,0,1]=4 10585 B12R1.28 NOCCCc1cccc(Br)c1 Amb17089578 [0,2,0,0,0,0|1,0,0]=3 10586 B12R1.28 NOCCCc1cccc(Cl)c1 Amb17089559 [0,2,0,0,0,0|1,0,0]=3 10587 B12R1.28 NOCCCc1cccc(O)c1 Amb17089577 [0,2,0,0,0,0|1,0,0]=3 10588 B12R1.28 NOCCOc1cccc(Br)c1 Amb17088298 [0,2,0,0,0,0|0,0,0]=2 10589 B12R1.28 NOCCOc1cccc(Cl)c1 Amb17088295 [0,2,0,0,0,0|0,0,0]=2 10590 B12R1.28 NOCCOc1cccc(F)c1 Amb17088292 [0,2,0,0,0,0|0,0,0]=2 10591 B12R1.28 Nc1cc(CSCCO)ccn1 Amb18311356 [0,2,0,0,0,0|1,1,0]=4 10592 B12R1.28 Nc1cccc(OCCCF)c1 Amb23539406 [0,2,0,0,0,0|1,0,0]=3 10593 B12R1.28 Nc1cccc(OCCCO)c1 Amb8868223 [0,2,0,0,0,0|0,0,0]=2 10594 B12R1.28 Nc1ccnc(OCCCO)c1 Amb18799037 [0,2,0,0,0,0|1,0,0]=3 10595 B12R1.28 O=C1C=CC=C(C#CCCO)N1 Amb27761155 [0,2,0,0,0,0|2,0,0]=4 10596 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|1,0,1]=4 10597 B12R1.28 O=CCCCc1cccc(Cl)c1 Amb33406790 [0,2,0,0,0,0|1,0,1]=4 10598 B12R1.28 O=CCCCc1cccc(F)c1 Amb33449550 [0,2,0,0,0,0|1,0,1]=4 10599 B12R1.28 O=CCCCc1cccc(O)c1 Amb33358761 [0,2,0,0,0,0|1,0,1]=4 10600 B12R1.28 O=CCCOc1cccc(I)c1 Amb33307154 [0,2,0,0,0,0|0,0,1]=3 10601 B12R1.28 O=CCCSc1cccc(Br)c1 Amb32682701 [0,2,0,0,0,0|0,1,1]=4 10602 B12R1.28 O=CCCSc1cccc(Cl)c1 Amb17082982 [0,2,0,0,0,0|0,1,1]=4 10603 B12R1.28 O=CCCSc1cccc(F)c1 Amb32682707 [0,2,0,0,0,0|0,1,1]=4 10604 B12R1.28 OCCC#Cc1cccc(Br)c1 Amb28044184 [0,2,0,0,0,0|1,0,0]=3 10605 B12R1.28 OCCCCc1cccc(Br)c1 Amb20668830 [0,2,0,0,0,0|1,0,0]=3 10606 B12R1.28 OCCCCc1cccc(Cl)c1 Amb32667642 [0,2,0,0,0,0|1,0,0]=3 10607 B12R1.28 OCCCCc1cccc(F)c1 Amb34913274 [0,2,0,0,0,0|1,0,0]=3 10608 B12R1.28 OCCCNc1cccc(Cl)c1 Amb17307144 [0,2,0,0,0,0|1,0,0]=3 10609 B12R1.28 OCCCNc1cccc(Cl)n1 Amb21958816 [0,2,0,0,0,0|2,0,0]=4 10610 B12R1.28 OCCCNc1cccc(F)c1 Amb17306246 [0,2,0,0,0,0|1,0,0]=3 10611 B12R1.28 OCCCNc1ccnc(F)c1 Amb27204977 [0,2,0,0,0,0|2,0,0]=4 10612 B12R1.28 OCCCNc1cncc(Br)c1 Amb24410008 [0,2,0,0,0,0|2,0,0]=4 10613 B12R1.28 OCCCNc1cncc(Cl)c1 Amb35706920 [0,2,0,0,0,0|2,0,0]=4 10614 B12R1.28 OCCCOc1cccc(Br)c1 Amb9370679 [0,2,0,0,0,0|0,0,0]=2 10615 B12R1.28 OCCCOc1cccc(Cl)c1 Amb9247635 [0,2,0,0,0,0|0,0,0]=2 10616 B12R1.28 OCCCOc1cccc(Cl)n1 Amb33140929 [0,2,0,0,0,0|1,0,0]=3 10617 B12R1.28 OCCCOc1cccc(F)c1 Amb9370688 [0,2,0,0,0,0|0,0,0]=2 10618 B12R1.28 OCCCOc1cccc(I)c1 Amb9370548 [0,2,0,0,0,0|0,0,0]=2 10619 B12R1.28 OCCCOc1cncc(Br)c1 Amb32411569 [0,2,0,0,0,0|1,0,0]=3 10620 B12R1.28 OCCCOc1cncc(Cl)n1 Amb33552576 [0,2,0,0,0,0|2,0,0]=4 10621 B12R1.28 OCCNCc1cccc(Br)c1 Amb6857164 [0,2,0,0,0,0|1,0,0]=3 10622 B12R1.28 OCCNCc1cccc(Br)c1 Amb8604245 [0,2,0,0,0,0|1,0,0]=3 10623 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|1,0,0]=3 10624 B12R1.28 OCCNCc1cccc(Cl)c1 Amb4303946 [0,2,0,0,0,0|1,0,0]=3 10625 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|1,0,0]=3 10626 B12R1.28 OCCNCc1cccc(F)c1 Amb2592101 [0,2,0,0,0,0|1,0,0]=3 10627 B12R1.28 OCCNCc1cccc(O)c1 Amb7757039 [0,2,0,0,0,0|1,0,0]=3 10628 B12R1.28 OCCNCc1ccnc(Br)c1 Amb21861822 [0,2,0,0,0,0|2,0,0]=4 10629 B12R1.28 OCCNCc1cncc(Br)c1 Amb31217550 [0,2,0,0,0,0|2,0,0]=4 10630 B12R1.28 OCCNCc1cncc(Br)c1 Amb33042705 [0,2,0,0,0,0|2,0,0]=4 10631 B12R1.28 OCCOCc1cccc(F)c1 Amb32664542 [0,2,0,0,0,0|0,0,0]=2 10632 B12R1.28 OCCSCc1cccc(F)c1 Amb3568983 [0,2,0,0,0,0|0,1,0]=3 10633 B12R1.28 OCC\N=C\c1cccc(F)c1 Amb27752368 [0,2,0,0,0,0|1,0,0]=3 10634 B12R1.28 ONCCCc1cccc(Br)c1 Amb33263671 [0,2,0,0,0,0|1,0,0]=3 10635 B12R1.28 ONCCOc1cccc(Br)c1 Amb17088424 [0,2,0,0,0,0|0,0,0]=2 10636 B12R1.28 ONCCOc1cccc(Cl)c1 Amb17088421 [0,2,0,0,0,0|0,0,0]=2 10637 B12R1.28 ONCCOc1cccc(F)c1 Amb17088418 [0,2,0,0,0,0|0,0,0]=2 10638 B12R1.28 SCCCCc1cccc(Br)c1 Amb18072286 [0,2,0,0,0,0|1,1,0]=4 10639 B12R1.28 SCCCCc1cccc(Cl)c1 Amb18565790 [0,2,0,0,0,0|1,1,0]=4 10640 B12R1.28 SCCCOc1cccc(Br)c1 Amb17258958 [0,2,0,0,0,0|0,1,0]=3 10641 B12R1.28 SCCCOc1cccc(Cl)c1 Amb17237589 [0,2,0,0,0,0|0,1,0]=3 10642 B12R1.28 [C-]#[N+]CCCc1cccc(Br)c1 Amb33435391 [0,2,0,0,0,0|2,0,0]=4 10643 B12R1.28 [C-]#[N+]CCOc1cccc(F)c1 Amb26973188 [0,2,0,0,0,0|1,0,0]=3 10644 B12R1.28 [C-]#[N+]CCSc1cccc(Br)c1 Amb27603490 [0,2,0,0,0,0|1,1,0]=4 10645 B12R1.28 [C-]#[N+]CCSc1cccc(C)c1 Amb27436923 [0,2,0,0,0,0|1,1,0]=4 10646 B12R1.28 [C-]#[N+]CCSc1cccc(Cl)c1 Amb27757227 [0,2,0,0,0,0|1,1,0]=4 10647 B12R1.28 [C-]#[N+]CCSc1cccc(F)c1 Amb27756477 [0,2,0,0,0,0|1,1,0]=4 10648 B12R1.50 C=CC(C)Oc1cccc(Cl)c1 Amb28430371 [0,2,0,0,0,0|1,0,1]=4 10649 B12R1.50 C=CC(C)Oc1cccc(N)c1 Amb18990275 [0,2,0,0,0,0|1,0,1]=4 10650 B12R1.50 CC(C#N)Oc1cccc(N)c1 Amb18283543 [0,2,0,0,0,0|1,0,1]=4 10651 B12R1.50 CC(C=O)Oc1cccc(Br)c1 Amb30020611 [0,2,0,0,0,0|0,0,2]=4 10652 B12R1.50 CC(C=O)Oc1cccc(F)c1 Amb30020587 [0,2,0,0,0,0|0,0,2]=4 10653 B12R1.50 CC(C=O)Oc1cccc(I)c1 Amb30020616 [0,2,0,0,0,0|0,0,2]=4 10654 B12R1.50 CC(CBr)Cc1cccc(Br)c1 Amb26855946 [0,2,0,0,0,0|2,0,0]=4 10655 B12R1.50 CC(CBr)Cc1cccc(Cl)c1 Amb25957906 [0,2,0,0,0,0|2,0,0]=4 10656 B12R1.50 CC(CBr)Cc1cccc(F)c1 Amb26363128 [0,2,0,0,0,0|2,0,0]=4 10657 B12R1.50 CC(CBr)Cc1cccc(O)c1 Amb24444691 [0,2,0,0,0,0|2,0,0]=4 10658 B12R1.50 CC(CBr)Oc1cccc(Br)c1 Amb17291821 [0,2,0,0,0,0|1,0,0]=3 10659 B12R1.50 CC(CBr)Oc1cccc(Cl)c1 Amb17261130 [0,2,0,0,0,0|1,0,0]=3 10660 B12R1.50 CC(CBr)Oc1cccc(F)c1 Amb17250550 [0,2,0,0,0,0|1,0,0]=3 10661 B12R1.50 CC(CCl)Cc1cccc(Br)c1 Amb24728303 [0,2,0,0,0,0|2,0,0]=4 10662 B12R1.50 CC(CCl)Cc1cccc(Cl)c1 Amb27455762 [0,2,0,0,0,0|2,0,0]=4 10663 B12R1.50 CC(CCl)Cc1cccc(F)c1 Amb26399593 [0,2,0,0,0,0|2,0,0]=4 10664 B12R1.50 CC(CCl)Cc1cccc(O)c1 Amb24537852 [0,2,0,0,0,0|2,0,0]=4 10665 B12R1.50 CC(CCl)Oc1cccc(Br)c1 Amb17261133 [0,2,0,0,0,0|1,0,0]=3 10666 B12R1.50 CC(CCl)Oc1cccc(Cl)c1 Amb17238290 [0,2,0,0,0,0|1,0,0]=3 10667 B12R1.50 CC(CCl)Oc1cccc(F)c1 Amb17234614 [0,2,0,0,0,0|1,0,0]=3 10668 B12R1.50 CC(CN)Cc1cccc(Br)c1 Amb18992227 [0,2,0,0,0,0|2,0,0]=4 10669 B12R1.50 CC(CN)Cc1cccc(Cl)c1 Amb5743847 [0,2,0,0,0,0|2,0,0]=4 10670 B12R1.50 CC(CN)Nc1cccc(Br)c1 Amb27860926 [0,2,0,0,0,0|2,0,0]=4 10671 B12R1.50 CC(CN)Nc1cccc(I)c1 Amb27861768 [0,2,0,0,0,0|2,0,0]=4 10672 B12R1.50 CC(CN)Nc1cccc(O)c1 Amb27212647 [0,2,0,0,0,0|2,0,0]=4 10673 B12R1.50 CC(CN)Oc1cccc(Br)c1 Amb33530520 [0,2,0,0,0,0|1,0,0]=3 10674 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb18299442 [0,2,0,0,0,0|1,0,0]=3 10675 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb33550099 [0,2,0,0,0,0|1,0,0]=3 10676 B12R1.50 CC(CN)Oc1cccc(F)c1 Amb18299439 [0,2,0,0,0,0|1,0,0]=3 10677 B12R1.50 CC(CN)Oc1cccc(I)c1 Amb28365540 [0,2,0,0,0,0|1,0,0]=3 10678 B12R1.50 CC(CN)Oc1cncc(Br)c1 Amb27867035 [0,2,0,0,0,0|2,0,0]=4 10679 B12R1.50 CC(CN)Sc1cccc(F)c1 Amb27403181 [0,2,0,0,0,0|1,1,0]=4 10680 B12R1.50 CC(CN)Sc1cccc(N)c1 Amb27469803 [0,2,0,0,0,0|1,1,0]=4 10681 B12R1.50 CC(CO)Cc1cccc(F)c1 Amb25228330 [0,2,0,0,0,0|1,0,0]=3 10682 B12R1.50 CC(CO)Cc1cncc(F)c1 Amb24654523 [0,2,0,0,0,0|2,0,0]=4 10683 B12R1.50 CC(CO)Nc1cccc(Br)c1 Amb18290175 [0,2,0,0,0,0|1,0,0]=3 10684 B12R1.50 CC(CO)Nc1cccc(F)c1 Amb18971844 [0,2,0,0,0,0|1,0,0]=3 10685 B12R1.50 CC(CO)Nc1cccc(N)n1 Amb28244023 [0,2,0,0,0,0|2,0,0]=4 10686 B12R1.50 CC(CO)Nc1cncc(Cl)c1 Amb35706924 [0,2,0,0,0,0|2,0,0]=4 10687 B12R1.50 CC(CO)Nc1cncc(F)c1 Amb27753610 [0,2,0,0,0,0|2,0,0]=4 10688 B12R1.50 CC(CO)Oc1cccc(Br)c1 Amb17249277 [0,2,0,0,0,0|0,0,0]=2 10689 B12R1.50 CC(CO)Oc1cccc(Cl)c1 Amb17234357 [0,2,0,0,0,0|0,0,0]=2 10690 B12R1.50 CC(CO)Oc1cccc(F)c1 Amb17232740 [0,2,0,0,0,0|0,0,0]=2 10691 B12R1.50 CC(CO)Oc1cccc(I)c1 Amb35640903 [0,2,0,0,0,0|0,0,0]=2 10692 B12R1.50 CC(CO)Oc1cncc(Br)c1 Amb35647390 [0,2,0,0,0,0|1,0,0]=3 10693 B12R1.50 CC(CO)Oc1cncc(Cl)c1 Amb35640909 [0,2,0,0,0,0|1,0,0]=3 10694 B12R1.50 CC(CO)Sc1cc(N)ccn1 Amb27412151 [0,2,0,0,0,0|1,1,0]=4 10695 B12R1.50 CC(CO)Sc1cccc(Br)n1 Amb28367915 [0,2,0,0,0,0|1,1,0]=4 10696 B12R1.50 CC(CO)Sc1cccc(Cl)n1 Amb27606562 [0,2,0,0,0,0|1,1,0]=4 10697 B12R1.50 CCC(=O)Oc1cccc(C)c1 Amb25198730 [0,2,0,0,0,0|1,0,1]=4 10698 B12R1.50 CCC(=O)Oc1cccc(Cl)c1 Amb25800916 [0,2,0,0,0,0|1,0,1]=4 10699 B12R1.50 CCC(=O)Oc1cccc(F)c1 Amb25153440 [0,2,0,0,0,0|1,0,1]=4 10700 B12R1.50 CCC(=O)Oc1cccc(O)c1 Amb22167292 [0,2,0,0,0,0|1,0,1]=4 10701 B12R1.50 CCC(C)Nc1cccc(Br)c1 Amb6696680 [0,2,0,0,0,0|2,0,0]=4 10702 B12R1.50 CCC(C)Nc1cccc(C)c1 Amb6684523 [0,2,0,0,0,0|2,0,0]=4 10703 B12R1.50 CCC(C)Nc1cccc(Cl)c1 Amb6695735 [0,2,0,0,0,0|2,0,0]=4 10704 B12R1.50 CCC(C)Nc1cccc(F)c1 Amb6695894 [0,2,0,0,0,0|2,0,0]=4 10705 B12R1.50 CCC(C)Nc1cccc(I)c1 Amb7785286 [0,2,0,0,0,0|2,0,0]=4 10706 B12R1.50 CCC(C)Nc1cccc(N)c1 Amb8825433 [0,2,0,0,0,0|2,0,0]=4 10707 B12R1.50 CCC(C)Oc1cc(N)ccn1 Amb18293585 [0,2,0,0,0,0|2,0,0]=4 10708 B12R1.50 CCC(C)Oc1cccc(Br)c1 Amb6740547 [0,2,0,0,0,0|1,0,0]=3 10709 B12R1.50 CCC(C)Oc1cccc(Cl)c1 Amb27757982 [0,2,0,0,0,0|1,0,0]=3 10710 B12R1.50 CCC(C)Oc1cccc(F)c1 Amb27879307 [0,2,0,0,0,0|1,0,0]=3 10711 B12R1.50 CCC(C)Oc1cccc(N)c1 Amb33552870 [0,2,0,0,0,0|1,0,0]=3 10712 B12R1.50 CCC(C)Oc1cccc(N)c1 Amb9778992 [0,2,0,0,0,0|1,0,0]=3 10713 B12R1.50 CCC(C)Oc1cccc(N)n1 Amb27155776 [0,2,0,0,0,0|2,0,0]=4 10714 B12R1.50 CCC(C)Oc1cccc(O)c1 Amb8837487 [0,2,0,0,0,0|1,0,0]=3 10715 B12R1.50 CCC(C)Sc1cccc(Cl)c1 Amb28382138 [0,2,0,0,0,0|1,1,0]=4 10716 B12R1.50 CCC(C)Sc1cccc(F)c1 Amb27651316 [0,2,0,0,0,0|1,1,0]=4 10717 B12R1.50 CCC(Cl)Cc1cccc(Br)c1 Amb17477597 [0,2,0,0,0,0|2,0,0]=4 10718 B12R1.50 CCC(Cl)Cc1cccc(F)c1 Amb19046367 [0,2,0,0,0,0|2,0,0]=4 10719 B12R1.50 CCC(N)Cc1cccc(C)c1 Amb9428906 [0,2,0,0,0,0|2,0,0]=4 10720 B12R1.50 CCC(N)Cc1cccc(Cl)c1 Amb9428876 [0,2,0,0,0,0|2,0,0]=4 10721 B12R1.50 CCC(N)Cc1cccc(F)c1 Amb9428915 [0,2,0,0,0,0|2,0,0]=4 10722 B12R1.50 CCC(N)Cc1cccc(N)c1 Amb27467745 [0,2,0,0,0,0|2,0,0]=4 10723 B12R1.50 CCC(O)Cc1cccc(Br)c1 Amb17477580 [0,2,0,0,0,0|2,0,0]=4 10724 B12R1.50 CCC(O)Cc1cccc(C)c1 Amb17138582 [0,2,0,0,0,0|2,0,0]=4 10725 B12R1.50 CCC(O)Cc1cccc(Cl)c1 Amb17139102 [0,2,0,0,0,0|2,0,0]=4 10726 B12R1.50 CCC(O)Cc1cccc(F)c1 Amb17138636 [0,2,0,0,0,0|2,0,0]=4 10727 B12R1.50 CCC(O)Cc1cccc(N)c1 Amb35620551 [0,2,0,0,0,0|2,0,0]=4 10728 B12R1.50 CCC(O)Sc1cccc(C)c1 Amb22228367 [0,2,0,0,0,0|1,1,0]=4 10729 B12R1.50 CC[C@@H](N)Cc1cccc(Cl)c1 Amb27950246 [0,2,0,0,0,0|2,0,0]=4 10730 B12R1.50 CC[C@H](C)Oc1cccc(O)c1 Amb24497029 [0,2,0,0,0,0|1,0,0]=3 10731 B12R1.50 CC[C@H](N)Cc1cccc(C)c1 Amb27178383 [0,2,0,0,0,0|2,0,0]=4 10732 B12R1.50 CC[C@H](N)Cc1cccc(F)c1 Amb27770954 [0,2,0,0,0,0|2,0,0]=4 10733 B12R1.50 C[C@@H](CO)Cc1cncc(F)c1 Amb33747389 [0,2,0,0,0,0|2,0,0]=4 10734 B12R1.50 C[C@@H](CO)Nc1cncc(Br)c1 Amb25962173 [0,2,0,0,0,0|2,0,0]=4 10735 B12R1.50 C[C@H](CO)Cc1cncc(F)c1 Amb33748184 [0,2,0,0,0,0|2,0,0]=4 10736 B12R1.50 C\C(=C\c1cccc(Br)c1)CO Amb27470680 [0,2,0,0,0,0|1,0,1]=4 10737 B12R1.50 C\C(=C\c1cccc(I)c1)CO Amb27668599 [0,2,0,0,0,0|1,0,1]=4 10738 B12R1.50 Cc1cc(CC(N)CO)ccn1 Amb33474488 [0,2,0,0,0,0|2,0,0]=4 10739 B12R1.50 Cc1cc(NC(C)CO)ccn1 Amb27244271 [0,2,0,0,0,0|2,0,0]=4 10740 B12R1.50 Cc1cccc(CC(=O)CO)c1 Amb18563612 [0,2,0,0,0,0|1,0,1]=4 10741 B12R1.50 Cc1cccc(CC(C)CBr)c1 Amb26022086 [0,2,0,0,0,0|2,0,0]=4 10742 B12R1.50 Cc1cccc(CC(C)CCl)c1 Amb26412261 [0,2,0,0,0,0|2,0,0]=4 10743 B12R1.50 Cc1cccc(CC(C)CN)c1 Amb5743838 [0,2,0,0,0,0|2,0,0]=4 10744 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,2,0,0,0,0|1,0,0]=3 10745 B12R1.50 Cc1cccc(CC(F)CN)c1 Amb27416521 [0,2,0,0,0,0|2,0,0]=4 10746 B12R1.50 Cc1cccc(CC(N)CO)c1 Amb17062686 [0,2,0,0,0,0|1,0,0]=3 10747 B12R1.50 Cc1cccc(CC(N)CO)c1 Amb28872399 [0,2,0,0,0,0|1,0,0]=3 10748 B12R1.50 Cc1cccc(CC(N)CO)n1 Amb25737795 [0,2,0,0,0,0|2,0,0]=4 10749 B12R1.50 Cc1cccc(CC(O)CN)c1 Amb17232548 [0,2,0,0,0,0|2,0,0]=4 10750 B12R1.50 Cc1cccc(CC(S)CO)c1 Amb27840605 [0,2,0,0,0,0|1,0,0]=3 10751 B12R1.50 Cc1cccc(C[C@@H](C)CN)c1 Amb33732120 [0,2,0,0,0,0|2,0,0]=4 10752 B12R1.50 Cc1cccc(C[C@@H](C)CO)c1 Amb33740504 [0,2,0,0,0,0|1,0,0]=3 10753 B12R1.50 Cc1cccc(C[C@@H](N)CO)c1 Amb24362986 [0,2,0,0,0,0|1,0,0]=3 10754 B12R1.50 Cc1cccc(C[C@H](C)CN)c1 Amb33746819 [0,2,0,0,0,0|2,0,0]=4 10755 B12R1.50 Cc1cccc(C[C@H](C)CO)c1 Amb33737856 [0,2,0,0,0,0|1,0,0]=3 10756 B12R1.50 Cc1cccc(C[C@H](O)CO)c1 Amb27653167 [0,2,0,0,0,0|1,0,0]=3 10757 B12R1.50 Cc1cccc(NC(=O)CO)c1 Amb5798029 [0,2,0,0,0,0|1,0,1]=4 10758 B12R1.50 Cc1cccc(NC(C)CO)c1 Amb18971818 [0,2,0,0,0,0|1,0,0]=3 10759 B12R1.50 Cc1cccc(N[C@@H](C)CO)n1 Amb28382912 [0,2,0,0,0,0|2,0,0]=4 10760 B12R1.50 Cc1cccc(OC(=O)CCl)c1 Amb9787242 [0,2,0,0,0,0|1,0,1]=4 10761 B12R1.50 Cc1cccc(OC(=O)CN)c1 Amb17334635 [0,2,0,0,0,0|1,0,1]=4 10762 B12R1.50 Cc1cccc(OC(=O)CN)c1 Amb19115307 [0,2,0,0,0,0|1,0,1]=4 10763 B12R1.50 Cc1cccc(OC(C)C#N)c1 Amb5780985 [0,2,0,0,0,0|1,0,1]=4 10764 B12R1.50 Cc1cccc(OC(C)CBr)c1 Amb17248432 [0,2,0,0,0,0|1,0,0]=3 10765 B12R1.50 Cc1cccc(OC(C)CCl)c1 Amb17234169 [0,2,0,0,0,0|1,0,0]=3 10766 B12R1.50 Cc1cccc(OC(C)CN)c1 Amb5781297 [0,2,0,0,0,0|1,0,0]=3 10767 B12R1.50 Cc1cccc(OC(C)CO)c1 Amb17232601 [0,2,0,0,0,0|0,0,0]=2 10768 B12R1.50 Cc1ccnc(CC(N)CO)c1 Amb33226945 [0,2,0,0,0,0|2,0,0]=4 10769 B12R1.50 Cc1cncc(CC(C)CO)c1 Amb27159035 [0,2,0,0,0,0|2,0,0]=4 10770 B12R1.50 Cc1cncc(CC(N)CO)c1 Amb25374367 [0,2,0,0,0,0|2,0,0]=4 10771 B12R1.50 Cc1cncc(C[C@@H](C)CO)c1 Amb33738961 [0,2,0,0,0,0|2,0,0]=4 10772 B12R1.50 Cc1cncc(C[C@H](C)CO)c1 Amb33748175 [0,2,0,0,0,0|2,0,0]=4 10773 B12R1.50 NC(CF)Cc1cccc(Cl)c1 Amb27804222 [0,2,0,0,0,0|2,0,0]=4 10774 B12R1.50 NC(CF)Cc1cccc(O)c1 Amb27635618 [0,2,0,0,0,0|2,0,0]=4 10775 B12R1.50 NC(CO)Cc1cc(F)ccn1 Amb33414559 [0,2,0,0,0,0|2,0,0]=4 10776 B12R1.50 NC(CO)Cc1cccc(Br)c1 Amb17062712 [0,2,0,0,0,0|1,0,0]=3 10777 B12R1.50 NC(CO)Cc1cccc(Br)n1 Amb27635360 [0,2,0,0,0,0|2,0,0]=4 10778 B12R1.50 NC(CO)Cc1cccc(Cl)c1 Amb17062695 [0,2,0,0,0,0|1,0,0]=3 10779 B12R1.50 NC(CO)Cc1cccc(Cl)n1 Amb33222329 [0,2,0,0,0,0|2,0,0]=4 10780 B12R1.50 NC(CO)Cc1cccc(F)c1 Amb33543823 [0,2,0,0,0,0|1,0,0]=3 10781 B12R1.50 NC(CO)Cc1cccc(O)c1 Amb17062711 [0,2,0,0,0,0|1,0,0]=3 10782 B12R1.50 NC(CO)Cc1cncc(Br)c1 Amb25896814 [0,2,0,0,0,0|2,0,0]=4 10783 B12R1.50 NC(CO)Cc1cncc(F)c1 Amb25861660 [0,2,0,0,0,0|2,0,0]=4 10784 B12R1.50 NCC(=O)Oc1cccc(Br)c1 Amb17344447 [0,2,0,0,0,0|1,0,1]=4 10785 B12R1.50 NCC(=O)Oc1cccc(Cl)c1 Amb17335804 [0,2,0,0,0,0|1,0,1]=4 10786 B12R1.50 NCC(=O)Oc1cccc(F)c1 Amb17334753 [0,2,0,0,0,0|1,0,1]=4 10787 B12R1.50 NCC(O)Cc1cccc(Br)c1 Amb17248846 [0,2,0,0,0,0|2,0,0]=4 10788 B12R1.50 NCC(O)Cc1cccc(Cl)c1 Amb17234266 [0,2,0,0,0,0|2,0,0]=4 10789 B12R1.50 NCC(O)Cc1cccc(F)c1 Amb18563898 [0,2,0,0,0,0|2,0,0]=4 10790 B12R1.50 NCC(O)Cc1cccc(O)c1 Amb25892760 [0,2,0,0,0,0|2,0,0]=4 10791 B12R1.50 N[C@@H](CO)Cc1cccc(F)c1 Amb27614706 [0,2,0,0,0,0|1,0,0]=3 10792 B12R1.50 N[C@@H](CO)Cc1cccc(O)c1 Amb27620894 [0,2,0,0,0,0|1,0,0]=3 10793 B12R1.50 N[C@H](CO)Cc1cccc(Br)c1 Amb26507618 [0,2,0,0,0,0|1,0,0]=3 10794 B12R1.50 N[C@H](CO)Cc1cccc(Cl)c1 Amb22233154 [0,2,0,0,0,0|1,0,0]=3 10795 B12R1.50 N[C@H](CO)Cc1cccc(Cl)c1 Amb33871627 [0,2,0,0,0,0|1,0,0]=3 10796 B12R1.50 N[C@H](CO)Cc1cccc(F)c1 Amb27490887 [0,2,0,0,0,0|1,0,0]=3 10797 B12R1.50 N[C@H](CO)Cc1cccc(O)c1 Amb22233156 [0,2,0,0,0,0|1,0,0]=3 10798 B12R1.50 Nc1cccc(NC(=O)CO)c1 Amb33545927 [0,2,0,0,0,0|1,0,1]=4 10799 B12R1.50 O=C(CCl)Oc1cccc(Cl)c1 Amb27178136 [0,2,0,0,0,0|1,0,1]=4 10800 B12R1.50 O=C(CO)Cc1cccc(Br)c1 Amb18572003 [0,2,0,0,0,0|1,0,1]=4 10801 B12R1.50 O=C(CO)Cc1cccc(Cl)c1 Amb18564304 [0,2,0,0,0,0|1,0,1]=4 10802 B12R1.50 O=C(CO)Nc1cccc(Br)c1 Amb5798053 [0,2,0,0,0,0|1,0,1]=4 10803 B12R1.50 O=C(CO)Nc1cccc(Cl)c1 Amb1110353 [0,2,0,0,0,0|1,0,1]=4 10804 B12R1.50 O=C(CO)Nc1cccc(F)c1 Amb1110282 [0,2,0,0,0,0|1,0,1]=4 10805 B12R1.50 O=C(CO)Nc1cccc(I)c1 Amb5798058 [0,2,0,0,0,0|1,0,1]=4 10806 B12R1.50 O=C(CO)Nc1cccc(O)c1 Amb5798035 [0,2,0,0,0,0|1,0,1]=4 10807 B12R1.50 O=C(CO)Oc1cccc(F)c1 Amb28043888 [0,2,0,0,0,0|0,0,1]=3 10808 B12R1.50 O=C(CO)Oc1cncc(Cl)c1 Amb28045662 [0,2,0,0,0,0|1,0,1]=4 10809 B12R1.50 O=C1N=CC=C(OC(O)CO)N1 Amb27215483 [0,2,0,0,0,0|2,0,0]=4 10810 B12R1.50 OC(CCl)Cc1cccc(Br)c1 Amb35591758 [0,2,0,0,0,0|2,0,0]=4 10811 B12R1.50 OCC(O)Cc1cccc(F)c1 Amb28138541 [0,2,0,0,0,0|1,0,0]=3 10812 B12R1.50 OC[C@H](O)Cc1cccc(F)c1 Amb27485894 [0,2,0,0,0,0|1,0,0]=3 10813 B12R1.100 BrCCCc1cc(Br)cc(Br)c1 Amb26608401 [0,2,0,0,0,0|2,0,0]=4 10814 B12R1.100 C#CCOc1cc(Br)cc(Br)c1 Amb34911167 [0,2,0,0,0,0|1,0,1]=4 10815 B12R1.100 C#CCOc1cc(C)cc(O)c1 Amb27234270 [0,2,0,0,0,0|1,0,1]=4 10816 B12R1.100 C#CCOc1cc(Cl)cc(Br)c1 Amb35638870 [0,2,0,0,0,0|1,0,1]=4 10817 B12R1.100 C#CCOc1cc(F)cc(Br)c1 Amb27604838 [0,2,0,0,0,0|1,0,1]=4 10818 B12R1.100 C#CCOc1cc(F)cc(F)c1 Amb18182666 [0,2,0,0,0,0|1,0,1]=4 10819 B12R1.100 C#CCOc1cc(F)cc(I)c1 Amb27826954 [0,2,0,0,0,0|1,0,1]=4 10820 B12R1.100 C=CCOc1cc(Cl)cc(Br)c1 Amb35638815 [0,2,0,0,0,0|1,0,1]=4 10821 B12R1.100 C=CCOc1cc(Cl)cc(Cl)c1 Amb25762862 [0,2,0,0,0,0|1,0,1]=4 10822 B12R1.100 C=CCOc1cc(F)cc(Br)c1 Amb27456956 [0,2,0,0,0,0|1,0,1]=4 10823 B12R1.100 CC1=CC(OCCN)=CC(=O)O1 Amb22642627 [0,2,0,0,0,0|2,0,0]=4 10824 B12R1.100 CC1=CC(OCCN)=CC(=O)O1 Amb35745894 [0,2,0,0,0,0|2,0,0]=4 10825 B12R1.100 CCCCc1cc(Br)cc(Br)c1 Amb19944051 [0,2,0,0,0,0|2,0,0]=4 10826 B12R1.100 CCCCc1cc(C)cc(C)c1 Amb20621114 [0,2,0,0,0,0|2,0,0]=4 10827 B12R1.100 CCCCc1cc(Cl)cc(Cl)c1 Amb27416544 [0,2,0,0,0,0|2,0,0]=4 10828 B12R1.100 CCCCc1cc(O)cc(O)c1 Amb24331632 [0,2,0,0,0,0|2,0,0]=4 10829 B12R1.100 CCCNc1cc(Br)cc(Br)c1 Amb35721402 [0,2,0,0,0,0|2,0,0]=4 10830 B12R1.100 CCCNc1cc(C)cc(C)c1 Amb4313516 [0,2,0,0,0,0|2,0,0]=4 10831 B12R1.100 CCCNc1cc(C)cc(F)c1 Amb28349512 [0,2,0,0,0,0|2,0,0]=4 10832 B12R1.100 CCCNc1cc(C)cc(I)c1 Amb35691308 [0,2,0,0,0,0|2,0,0]=4 10833 B12R1.100 CCCNc1cc(C)cc(N)c1 Amb27753298 [0,2,0,0,0,0|2,0,0]=4 10834 B12R1.100 CCCNc1cc(Cl)cc(Cl)c1 Amb4313515 [0,2,0,0,0,0|2,0,0]=4 10835 B12R1.100 CCCNc1cc(I)cc(I)c1 Amb35721004 [0,2,0,0,0,0|2,0,0]=4 10836 B12R1.100 CCCNc1cc(N)cc(F)c1 Amb18289354 [0,2,0,0,0,0|2,0,0]=4 10837 B12R1.100 CCCOc1cc(Br)cc(Br)c1 Amb28430218 [0,2,0,0,0,0|1,0,0]=3 10838 B12R1.100 CCCOc1cc(C)cc(Br)c1 Amb17506057 [0,2,0,0,0,0|1,0,0]=3 10839 B12R1.100 CCCOc1cc(C)cc(C)c1 Amb27800368 [0,2,0,0,0,0|1,0,0]=3 10840 B12R1.100 CCCOc1cc(C)cc(N)c1 Amb25345513 [0,2,0,0,0,0|1,0,0]=3 10841 B12R1.100 CCCOc1cc(Cl)cc(Br)c1 Amb28343851 [0,2,0,0,0,0|1,0,0]=3 10842 B12R1.100 CCCOc1cc(Cl)nc(Cl)c1 Amb27400683 [0,2,0,0,0,0|2,0,0]=4 10843 B12R1.100 CCCOc1cc(F)cc(Br)c1 Amb27646654 [0,2,0,0,0,0|1,0,0]=3 10844 B12R1.100 CCCOc1cc(F)cc(S)c1 Amb25976402 [0,2,0,0,0,0|1,0,0]=3 10845 B12R1.100 CCCOc1cc(N)cc(Cl)n1 Amb22276219 [0,2,0,0,0,0|2,0,0]=4 10846 B12R1.100 CCCOc1cc(N)cc(F)c1 Amb28072768 [0,2,0,0,0,0|1,0,0]=3 10847 B12R1.100 CCCOc1cc(N)cc(O)c1 Amb27864209 [0,2,0,0,0,0|1,0,0]=3 10848 B12R1.100 CCCOc1cc(O)cc(Cl)c1 Amb28344057 [0,2,0,0,0,0|1,0,0]=3 10849 B12R1.100 COCOc1cc(Br)cc(Br)c1 Amb25869263 [0,2,0,0,0,0|2,0,0]=4 10850 B12R1.100 COCOc1cc(Cl)cc(Br)c1 Amb34911310 [0,2,0,0,0,0|2,0,0]=4 10851 B12R1.100 COCOc1cc(F)cc(Br)c1 Amb27804401 [0,2,0,0,0,0|2,0,0]=4 10852 B12R1.100 COCOc1cc(F)cc(F)c1 Amb26647889 [0,2,0,0,0,0|2,0,0]=4 10853 B12R1.100 COCOc1cc(O)cc(F)c1 Amb27389761 [0,2,0,0,0,0|2,0,0]=4 10854 B12R1.100 Cc1cc(Br)cc(CCCCl)c1 Amb27445858 [0,2,0,0,0,0|2,0,0]=4 10855 B12R1.100 Cc1cc(Br)cc(CCCN)c1 Amb25851408 [0,2,0,0,0,0|2,0,0]=4 10856 B12R1.100 Cc1cc(Br)cc(CCCO)c1 Amb33431431 [0,2,0,0,0,0|1,0,0]=3 10857 B12R1.100 Cc1cc(Br)cc(CCCS)c1 Amb33431455 [0,2,0,0,0,0|1,1,0]=4 10858 B12R1.100 Cc1cc(Br)cc(OCCN)c1 Amb23590664 [0,2,0,0,0,0|1,0,0]=3 10859 B12R1.100 Cc1cc(Br)cc(\C=C\CO)c1 Amb33430335 [0,2,0,0,0,0|1,0,1]=4 10860 B12R1.100 Cc1cc(C)cc(CCCBr)c1 Amb26050658 [0,2,0,0,0,0|2,0,0]=4 10861 B12R1.100 Cc1cc(C)cc(CCCCl)c1 Amb19068163 [0,2,0,0,0,0|2,0,0]=4 10862 B12R1.100 Cc1cc(C)cc(CCCN)c1 Amb17204308 [0,2,0,0,0,0|2,0,0]=4 10863 B12R1.100 Cc1cc(C)cc(CCCO)c1 Amb18798360 [0,2,0,0,0,0|1,0,0]=3 10864 B12R1.100 Cc1cc(C)cc(CCCS)c1 Amb33377416 [0,2,0,0,0,0|1,1,0]=4 10865 B12R1.100 Cc1cc(C)cc(NCCCl)c1 Amb17335664 [0,2,0,0,0,0|2,0,0]=4 10866 B12R1.100 Cc1cc(C)cc(NCCN)c1 Amb17057763 [0,2,0,0,0,0|2,0,0]=4 10867 B12R1.100 Cc1cc(C)cc(NCCO)c1 Amb6712967 [0,2,0,0,0,0|1,0,0]=3 10868 B12R1.100 Cc1cc(C)cc(OCC#N)c1 Amb5780863 [0,2,0,0,0,0|1,0,1]=4 10869 B12R1.100 Cc1cc(C)cc(OCC=O)c1 Amb5731824 [0,2,0,0,0,0|0,0,2]=4 10870 B12R1.100 Cc1cc(C)cc(OCCBr)c1 Amb1153291 [0,2,0,0,0,0|1,0,0]=3 10871 B12R1.100 Cc1cc(C)cc(OCCCl)c1 Amb5559613 [0,2,0,0,0,0|1,0,0]=3 10872 B12R1.100 Cc1cc(C)cc(OCCF)c1 Amb27781426 [0,2,0,0,0,0|1,0,0]=3 10873 B12R1.100 Cc1cc(C)cc(OCCI)c1 Amb27870665 [0,2,0,0,0,0|1,0,0]=3 10874 B12R1.100 Cc1cc(C)cc(OCCN)c1 Amb1065358 [0,2,0,0,0,0|1,0,0]=3 10875 B12R1.100 Cc1cc(C)cc(OCCN)c1 Amb6761307 [0,2,0,0,0,0|1,0,0]=3 10876 B12R1.100 Cc1cc(C)cc(OCCO)c1 Amb2209348 [0,2,0,0,0,0|0,0,0]=2 10877 B12R1.100 Cc1cc(C)cc(OCCS)c1 Amb6255880 [0,2,0,0,0,0|0,1,0]=3 10878 B12R1.100 Cc1cc(C)cc(SCCN)c1 Amb18909241 [0,2,0,0,0,0|1,1,0]=4 10879 B12R1.100 Cc1cc(C)cc(SCCO)c1 Amb2687601 [0,2,0,0,0,0|0,1,0]=3 10880 B12R1.100 Cc1cc(C)cc(\C=C\CO)c1 Amb23555572 [0,2,0,0,0,0|1,0,1]=4 10881 B12R1.100 Cc1cc(C)nc(CCCO)c1 Amb27950611 [0,2,0,0,0,0|2,0,0]=4 10882 B12R1.100 Cc1cc(CCCO)cc(C)n1 Amb10573709 [0,2,0,0,0,0|2,0,0]=4 10883 B12R1.100 Cc1cc(CCCO)cc(Cl)n1 Amb33222298 [0,2,0,0,0,0|2,0,0]=4 10884 B12R1.100 Cc1cc(Cl)cc(CCCBr)c1 Amb26542198 [0,2,0,0,0,0|2,0,0]=4 10885 B12R1.100 Cc1cc(Cl)cc(CCCCl)c1 Amb27795204 [0,2,0,0,0,0|2,0,0]=4 10886 B12R1.100 Cc1cc(Cl)cc(CCCN)c1 Amb25282299 [0,2,0,0,0,0|2,0,0]=4 10887 B12R1.100 Cc1cc(Cl)cc(OCCN)c1 Amb24410300 [0,2,0,0,0,0|1,0,0]=3 10888 B12R1.100 Cc1cc(F)cc(CCCBr)c1 Amb24453699 [0,2,0,0,0,0|2,0,0]=4 10889 B12R1.100 Cc1cc(F)cc(CCCCl)c1 Amb26438541 [0,2,0,0,0,0|2,0,0]=4 10890 B12R1.100 Cc1cc(F)cc(CCCN)c1 Amb27810787 [0,2,0,0,0,0|2,0,0]=4 10891 B12R1.100 Cc1cc(F)cc(CCCO)c1 Amb25885068 [0,2,0,0,0,0|1,0,0]=3 10892 B12R1.100 Cc1cc(F)cc(CCCS)c1 Amb33342715 [0,2,0,0,0,0|1,1,0]=4 10893 B12R1.100 Cc1cc(F)cc(NCCO)c1 Amb27616825 [0,2,0,0,0,0|1,0,0]=3 10894 B12R1.100 Cc1cc(F)cc(OCCN)c1 Amb26017626 [0,2,0,0,0,0|1,0,0]=3 10895 B12R1.100 Cc1cc(F)cc(\C=C\CO)c1 Amb33343440 [0,2,0,0,0,0|1,0,1]=4 10896 B12R1.100 Cc1cc(I)cc(CCCCl)c1 Amb27423550 [0,2,0,0,0,0|2,0,0]=4 10897 B12R1.100 Cc1cc(I)cc(NCCF)c1 Amb35691127 [0,2,0,0,0,0|2,0,0]=4 10898 B12R1.100 Cc1cc(I)cc(NCCN)c1 Amb35691309 [0,2,0,0,0,0|2,0,0]=4 10899 B12R1.100 Cc1cc(N)cc(CCCBr)c1 Amb27616072 [0,2,0,0,0,0|2,0,0]=4 10900 B12R1.100 Cc1cc(N)cc(CCCCl)c1 Amb26952543 [0,2,0,0,0,0|2,0,0]=4 10901 B12R1.100 Cc1cc(N)cc(OCCO)c1 Amb25866723 [0,2,0,0,0,0|0,0,0]=2 10902 B12R1.100 Cc1cc(N)cc(OCCO)c1 Amb28600237 [0,2,0,0,0,0|0,0,0]=2 10903 B12R1.100 Cc1cc(O)cc(CCCBr)c1 Amb27646751 [0,2,0,0,0,0|2,0,0]=4 10904 B12R1.100 Cc1cc(O)cc(CCCN)c1 Amb28317912 [0,2,0,0,0,0|2,0,0]=4 10905 B12R1.100 Cc1cc(O)cc(OCC#N)c1 Amb28077533 [0,2,0,0,0,0|1,0,1]=4 10906 B12R1.100 Cc1cc(O)cc(OCCF)c1 Amb28195079 [0,2,0,0,0,0|1,0,0]=3 10907 B12R1.100 Cc1cc(OCCN)cc(Cl)n1 Amb33222309 [0,2,0,0,0,0|2,0,0]=4 10908 B12R1.100 Cc1cc(OCCO)nc(F)n1 Amb35718402 [0,2,0,0,0,0|2,0,0]=4 10909 B12R1.100 Cc1cc(S)cc(CCCCl)c1 Amb27193281 [0,2,0,0,0,0|2,0,0]=4 10910 B12R1.100 Cc1nc(Br)cc(OCCO)n1 Amb27757801 [0,2,0,0,0,0|2,0,0]=4 10911 B12R1.100 Cc1nc(N)cc(OCCO)n1 Amb28184606 [0,2,0,0,0,0|2,0,0]=4 10912 B12R1.100 ClCCCc1cc(Br)cc(Br)c1 Amb26056603 [0,2,0,0,0,0|2,0,0]=4 10913 B12R1.100 ClCCCc1cc(Br)cc(I)c1 Amb27968123 [0,2,0,0,0,0|2,0,0]=4 10914 B12R1.100 ClCCCc1cc(Cl)cc(Br)c1 Amb27225584 [0,2,0,0,0,0|2,0,0]=4 10915 B12R1.100 ClCCNc1cc(Cl)cc(Cl)c1 Amb17343165 [0,2,0,0,0,0|2,0,0]=4 10916 B12R1.100 ClCCOc1cc(Cl)cc(Br)c1 Amb35654702 [0,2,0,0,0,0|1,0,0]=3 10917 B12R1.100 ClCCOc1cc(Cl)cc(Cl)c1 Amb9486366 [0,2,0,0,0,0|1,0,0]=3 10918 B12R1.100 Clc1cc(Br)cc(OCCBr)c1 Amb35654703 [0,2,0,0,0,0|1,0,0]=3 10919 B12R1.100 Clc1cc(Cl)cc(CCCBr)c1 Amb27217928 [0,2,0,0,0,0|2,0,0]=4 10920 B12R1.100 Clc1cc(Cl)cc(OCCBr)c1 Amb9486368 [0,2,0,0,0,0|1,0,0]=3 10921 B12R1.100 FCCNc1cc(Br)cc(Br)c1 Amb35725569 [0,2,0,0,0,0|2,0,0]=4 10922 B12R1.100 FCCNc1cc(F)cc(Br)c1 Amb27483275 [0,2,0,0,0,0|2,0,0]=4 10923 B12R1.100 FCCNc1cc(I)cc(I)c1 Amb35725585 [0,2,0,0,0,0|2,0,0]=4 10924 B12R1.100 FCCOc1cc(Cl)cc(Br)c1 Amb33712154 [0,2,0,0,0,0|1,0,0]=3 10925 B12R1.100 FCCOc1cc(F)cc(Br)c1 Amb28244148 [0,2,0,0,0,0|1,0,0]=3 10926 B12R1.100 Fc1cc(Br)cc(CCCBr)c1 Amb25804673 [0,2,0,0,0,0|2,0,0]=4 10927 B12R1.100 Fc1cc(Br)cc(CCCCl)c1 Amb26554664 [0,2,0,0,0,0|2,0,0]=4 10928 B12R1.100 Fc1cc(Br)cc(CCCS)c1 Amb33334480 [0,2,0,0,0,0|1,1,0]=4 10929 B12R1.100 Fc1cc(Br)cc(OCCBr)c1 Amb24465729 [0,2,0,0,0,0|1,0,0]=3 10930 B12R1.100 Fc1cc(Br)cc(OCCS)c1 Amb28436623 [0,2,0,0,0,0|0,1,0]=3 10931 B12R1.100 Fc1cc(Cl)cc(CCCBr)c1 Amb27844422 [0,2,0,0,0,0|2,0,0]=4 10932 B12R1.100 Fc1cc(Cl)cc(CCCCl)c1 Amb27259745 [0,2,0,0,0,0|2,0,0]=4 10933 B12R1.100 Fc1cc(Cl)cc(CCCS)c1 Amb33257431 [0,2,0,0,0,0|1,1,0]=4 10934 B12R1.100 Fc1cc(F)cc(CCCBr)c1 Amb25034793 [0,2,0,0,0,0|2,0,0]=4 10935 B12R1.100 Fc1cc(F)cc(CCCCl)c1 Amb25152291 [0,2,0,0,0,0|2,0,0]=4 10936 B12R1.100 Fc1cc(F)cc(CCCS)c1 Amb33313138 [0,2,0,0,0,0|1,1,0]=4 10937 B12R1.100 Fc1cc(F)cc(OCCBr)c1 Amb28325555 [0,2,0,0,0,0|1,0,0]=3 10938 B12R1.100 Fc1cc(S)cc(CCCBr)c1 Amb27622871 [0,2,0,0,0,0|2,0,0]=4 10939 B12R1.100 Fc1cc(S)cc(CCCCl)c1 Amb27654254 [0,2,0,0,0,0|2,0,0]=4 10940 B12R1.100 N#CCOc1cc(Cl)cc(Br)c1 Amb33712153 [0,2,0,0,0,0|1,0,1]=4 10941 B12R1.100 N#CCOc1cc(Cl)cc(Cl)c1 Amb2725934 [0,2,0,0,0,0|1,0,1]=4 10942 B12R1.100 N#CCOc1cc(F)cc(Br)c1 Amb27642477 [0,2,0,0,0,0|1,0,1]=4 10943 B12R1.100 N#CCOc1cc(F)cc(F)c1 Amb18801188 [0,2,0,0,0,0|1,0,1]=4 10944 B12R1.100 NCCCc1cc(Cl)cc(Br)c1 Amb26372539 [0,2,0,0,0,0|2,0,0]=4 10945 B12R1.100 NCCCc1cc(Cl)cc(Cl)c1 Amb17204406 [0,2,0,0,0,0|2,0,0]=4 10946 B12R1.100 NCCCc1cc(F)cc(Br)c1 Amb25795729 [0,2,0,0,0,0|2,0,0]=4 10947 B12R1.100 NCCCc1cc(F)cc(Cl)c1 Amb25709208 [0,2,0,0,0,0|2,0,0]=4 10948 B12R1.100 NCCCc1cc(F)cc(F)c1 Amb18126758 [0,2,0,0,0,0|2,0,0]=4 10949 B12R1.100 NCCCc1cc(F)cc(I)c1 Amb28043408 [0,2,0,0,0,0|2,0,0]=4 10950 B12R1.100 NCCCc1cc(O)cc(Br)c1 Amb25045372 [0,2,0,0,0,0|2,0,0]=4 10951 B12R1.100 NCCCc1cc(O)cc(Cl)c1 Amb25710883 [0,2,0,0,0,0|2,0,0]=4 10952 B12R1.100 NCCCc1cc(O)cc(F)c1 Amb26489273 [0,2,0,0,0,0|2,0,0]=4 10953 B12R1.100 NCCCc1cc(O)cc(O)c1 Amb25113881 [0,2,0,0,0,0|2,0,0]=4 10954 B12R1.100 NCCNc1cc(Br)cc(Br)c1 Amb35721403 [0,2,0,0,0,0|2,0,0]=4 10955 B12R1.100 NCCNc1cc(Cl)cc(Cl)c1 Amb17091083 [0,2,0,0,0,0|2,0,0]=4 10956 B12R1.100 NCCNc1cc(I)cc(I)c1 Amb35721005 [0,2,0,0,0,0|2,0,0]=4 10957 B12R1.100 NCCNc1cc(N)cc(F)c1 Amb18991515 [0,2,0,0,0,0|2,0,0]=4 10958 B12R1.100 NCCOc1cc(Cl)cc(Br)c1 Amb25034906 [0,2,0,0,0,0|1,0,0]=3 10959 B12R1.100 NCCOc1cc(Cl)cc(Cl)c1 Amb5781222 [0,2,0,0,0,0|1,0,0]=3 10960 B12R1.100 NCCOc1cc(Cl)nc(Cl)c1 Amb33414003 [0,2,0,0,0,0|2,0,0]=4 10961 B12R1.100 NCCOc1cc(F)cc(Br)c1 Amb24389824 [0,2,0,0,0,0|1,0,0]=3 10962 B12R1.100 NCCOc1cc(F)cc(Cl)c1 Amb26640528 [0,2,0,0,0,0|1,0,0]=3 10963 B12R1.100 NCCOc1cc(F)cc(F)c1 Amb18997300 [0,2,0,0,0,0|1,0,0]=3 10964 B12R1.100 NCCOc1cc(F)cc(F)c1 Amb31192446 [0,2,0,0,0,0|1,0,0]=3 10965 B12R1.100 NCCSc1cc(Cl)cc(Cl)c1 Amb27865931 [0,2,0,0,0,0|1,1,0]=4 10966 B12R1.100 Nc1cc(Br)cc(CCCBr)c1 Amb27669877 [0,2,0,0,0,0|2,0,0]=4 10967 B12R1.100 Nc1cc(Br)cc(CCCCl)c1 Amb27847019 [0,2,0,0,0,0|2,0,0]=4 10968 B12R1.100 Nc1cc(Br)cc(OCCF)c1 Amb27847475 [0,2,0,0,0,0|1,0,0]=3 10969 B12R1.100 Nc1cc(Cl)cc(CCCBr)c1 Amb27633298 [0,2,0,0,0,0|2,0,0]=4 10970 B12R1.100 Nc1cc(Cl)cc(CCCCl)c1 Amb27462626 [0,2,0,0,0,0|2,0,0]=4 10971 B12R1.100 Nc1cc(Cl)nc(OCCO)c1 Amb27857082 [0,2,0,0,0,0|1,0,0]=3 10972 B12R1.100 Nc1cc(F)cc(CCCCl)c1 Amb27971146 [0,2,0,0,0,0|2,0,0]=4 10973 B12R1.100 Nc1cc(F)cc(OCCF)c1 Amb32939663 [0,2,0,0,0,0|1,0,0]=3 10974 B12R1.100 Nc1cc(F)cc(OCCO)c1 Amb25703510 [0,2,0,0,0,0|0,0,0]=2 10975 B12R1.100 Nc1cc(F)cc(SCCF)c1 Amb27622529 [0,2,0,0,0,0|1,1,0]=4 10976 B12R1.100 Nc1cc(O)cc(CCCBr)c1 Amb27616172 [0,2,0,0,0,0|2,0,0]=4 10977 B12R1.100 Nc1cc(OCCO)nc(N)n1 Amb28066617 [0,2,0,0,0,0|2,0,0]=4 10978 B12R1.100 Nc1cc(S)cc(CCCBr)c1 Amb27259728 [0,2,0,0,0,0|2,0,0]=4 10979 B12R1.100 O=CCOc1cc(Cl)cc(Br)c1 Amb35635452 [0,2,0,0,0,0|0,0,2]=4 10980 B12R1.100 O=CCOc1cc(Cl)cc(Cl)c1 Amb5731862 [0,2,0,0,0,0|0,0,2]=4 10981 B12R1.100 O=CCOc1cc(F)cc(Br)c1 Amb25827273 [0,2,0,0,0,0|0,0,2]=4 10982 B12R1.100 O=CCOc1cc(F)cc(F)c1 Amb18802837 [0,2,0,0,0,0|0,0,2]=4 10983 B12R1.100 OCC#Cc1cc(Cl)cc(Cl)c1 Amb9777272 [0,2,0,0,0,0|1,0,1]=4 10984 B12R1.100 OCCCc1cc(Cl)cc(Br)c1 Amb25150113 [0,2,0,0,0,0|1,0,0]=3 10985 B12R1.100 OCCCc1cc(Cl)cc(Cl)c1 Amb17605792 [0,2,0,0,0,0|1,0,0]=3 10986 B12R1.100 OCCCc1cc(Cl)nc(Cl)c1 Amb33258146 [0,2,0,0,0,0|2,0,0]=4 10987 B12R1.100 OCCCc1cc(F)cc(Br)c1 Amb24453157 [0,2,0,0,0,0|1,0,0]=3 10988 B12R1.100 OCCCc1cc(F)cc(Cl)c1 Amb24673776 [0,2,0,0,0,0|1,0,0]=3 10989 B12R1.100 OCCCc1cc(F)cc(F)c1 Amb24094063 [0,2,0,0,0,0|1,0,0]=3 10990 B12R1.100 OCCCc1cc(O)cc(O)c1 Amb24674121 [0,2,0,0,0,0|1,0,0]=3 10991 B12R1.100 OCCNc1cc(Br)cc(Br)c1 Amb35725568 [0,2,0,0,0,0|1,0,0]=3 10992 B12R1.100 OCCNc1cc(Cl)cc(Br)c1 Amb27829336 [0,2,0,0,0,0|1,0,0]=3 10993 B12R1.100 OCCNc1cc(Cl)cc(Cl)c1 Amb6710435 [0,2,0,0,0,0|1,0,0]=3 10994 B12R1.100 OCCNc1cc(F)cc(Br)c1 Amb27467107 [0,2,0,0,0,0|1,0,0]=3 10995 B12R1.100 OCCOc1cc(Br)nc(Br)c1 Amb27186064 [0,2,0,0,0,0|1,0,0]=3 10996 B12R1.100 OCCOc1cc(Cl)cc(Br)c1 Amb35646533 [0,2,0,0,0,0|0,0,0]=2 10997 B12R1.100 OCCOc1cc(Cl)cc(Cl)c1 Amb9281158 [0,2,0,0,0,0|0,0,0]=2 10998 B12R1.100 OCCOc1cc(F)cc(Br)c1 Amb25344156 [0,2,0,0,0,0|0,0,0]=2 10999 B12R1.100 OCCOc1cc(F)nc(F)n1 Amb35718286 [0,2,0,0,0,0|2,0,0]=4 11000 B12R1.100 OCCOc1cc(I)nc(I)c1 Amb27441965 [0,2,0,0,0,0|1,0,0]=3 11001 B12R1.100 OCCSc1cc(Cl)cc(Br)c1 Amb25680612 [0,2,0,0,0,0|0,1,0]=3 11002 B12R1.100 OCCSc1cc(Cl)cc(Cl)c1 Amb2686955 [0,2,0,0,0,0|0,1,0]=3 11003 B12R1.100 OCCSc1cc(F)cc(Cl)c1 Amb30982908 [0,2,0,0,0,0|0,1,0]=3 11004 B12R1.100 OC\C=C\c1cc(Br)cc(Br)c1 Amb27658308 [0,2,0,0,0,0|1,0,1]=4 11005 B12R1.100 OC\C=C\c1cc(Cl)cc(Br)c1 Amb33435590 [0,2,0,0,0,0|1,0,1]=4 11006 B12R1.100 OC\C=C\c1cc(Cl)cc(Cl)c1 Amb26597273 [0,2,0,0,0,0|1,0,1]=4 11007 B12R1.100 OC\C=C\c1cc(F)cc(Br)c1 Amb28385983 [0,2,0,0,0,0|1,0,1]=4 11008 B12R1.100 OC\C=C\c1cc(F)cc(Cl)c1 Amb33262259 [0,2,0,0,0,0|1,0,1]=4 11009 B12R1.100 OC\C=C\c1cc(F)cc(F)c1 Amb19889731 [0,2,0,0,0,0|1,0,1]=4 11010 B12R1.100 Oc1cc(Br)cc(CCCBr)c1 Amb27638927 [0,2,0,0,0,0|2,0,0]=4 11011 B12R1.100 Oc1cc(Br)cc(CCCCl)c1 Amb25981628 [0,2,0,0,0,0|2,0,0]=4 11012 B12R1.100 Oc1cc(Cl)cc(CCCBr)c1 Amb27848594 [0,2,0,0,0,0|2,0,0]=4 11013 B12R1.100 Oc1cc(F)cc(CCCBr)c1 Amb27423569 [0,2,0,0,0,0|2,0,0]=4 11014 B12R1.100 Oc1cc(O)cc(CCCCl)c1 Amb27192381 [0,2,0,0,0,0|2,0,0]=4 11015 B12R1.100 Oc1cc(S)cc(CCCBr)c1 Amb27647076 [0,2,0,0,0,0|2,0,0]=4 11016 B12R1.100 SCCCc1cc(Cl)cc(Br)c1 Amb33435641 [0,2,0,0,0,0|1,1,0]=4 11017 B12R1.100 SCCCc1cc(Cl)cc(Cl)c1 Amb33261437 [0,2,0,0,0,0|1,1,0]=4 11018 B12R1.100 SCCOc1cc(Cl)cc(Br)c1 Amb35638900 [0,2,0,0,0,0|0,1,0]=3 11019 B12R1.100 SCCOc1cc(Cl)cc(Cl)c1 Amb17245967 [0,2,0,0,0,0|0,1,0]=3 11020 B12R1.100 Sc1cc(Br)cc(CCCBr)c1 Amb27614076 [0,2,0,0,0,0|2,0,0]=4 11021 B12R1.100 Sc1cc(Cl)cc(CCCBr)c1 Amb27200570 [0,2,0,0,0,0|2,0,0]=4 11022 B12R1.100 Sc1cc(I)cc(CCCCl)c1 Amb27634016 [0,2,0,0,0,0|2,0,0]=4 11023 B12R1.226 C=C(Br)COc1cccc(Br)c1 Amb27666515 [0,2,0,0,0,0|1,0,1]=4 11024 B12R1.226 C=C(Br)COc1cccc(Cl)c1 Amb27238299 [0,2,0,0,0,0|1,0,1]=4 11025 B12R1.226 C=C(Br)COc1cccc(F)c1 Amb27469477 [0,2,0,0,0,0|1,0,1]=4 11026 B12R1.226 C=C(C)COc1cccc(Br)c1 Amb6264391 [0,2,0,0,0,0|1,0,1]=4 11027 B12R1.226 C=C(C)COc1cccc(N)c1 Amb2081546 [0,2,0,0,0,0|1,0,1]=4 11028 B12R1.226 C=C(C)COc1cccc(N)c1 Amb9172211 [0,2,0,0,0,0|1,0,1]=4 11029 B12R1.226 C=C(C)COc1cccc(O)c1 Amb8837493 [0,2,0,0,0,0|1,0,1]=4 11030 B12R1.226 C=C(Cl)COc1cccc(N)c1 Amb18290028 [0,2,0,0,0,0|1,0,1]=4 11031 B12R1.226 CC(=O)COc1cccc(Br)c1 Amb17226706 [0,2,0,0,0,0|0,0,2]=4 11032 B12R1.226 CC(=O)COc1cccc(I)c1 Amb27829069 [0,2,0,0,0,0|0,0,2]=4 11033 B12R1.226 CC(=O)COc1cccc(N)c1 Amb17110084 [0,2,0,0,0,0|0,0,2]=4 11034 B12R1.226 CC(Br)COc1cccc(F)c1 Amb27615301 [0,2,0,0,0,0|1,0,0]=3 11035 B12R1.226 CC(C)CCc1cccc(N)c1 Amb27143902 [0,2,0,0,0,0|2,0,0]=4 11036 B12R1.226 CC(C)CNc1cccc(Br)c1 Amb6696597 [0,2,0,0,0,0|2,0,0]=4 11037 B12R1.226 CC(C)CNc1cccc(Cl)c1 Amb28555675 [0,2,0,0,0,0|2,0,0]=4 11038 B12R1.226 CC(C)CNc1cccc(Cl)c1 Amb6695671 [0,2,0,0,0,0|2,0,0]=4 11039 B12R1.226 CC(C)CNc1cccc(F)c1 Amb6695788 [0,2,0,0,0,0|2,0,0]=4 11040 B12R1.226 CC(C)CNc1cccc(I)c1 Amb7785404 [0,2,0,0,0,0|2,0,0]=4 11041 B12R1.226 CC(C)CNc1cccc(O)c1 Amb6734803 [0,2,0,0,0,0|2,0,0]=4 11042 B12R1.226 CC(C)COc1cc(N)ccn1 Amb18981536 [0,2,0,0,0,0|2,0,0]=4 11043 B12R1.226 CC(C)COc1cccc(Br)c1 Amb6665073 [0,2,0,0,0,0|1,0,0]=3 11044 B12R1.226 CC(C)COc1cccc(Br)n1 Amb27958466 [0,2,0,0,0,0|2,0,0]=4 11045 B12R1.226 CC(C)COc1cccc(Cl)c1 Amb24484227 [0,2,0,0,0,0|1,0,0]=3 11046 B12R1.226 CC(C)COc1cccc(Cl)n1 Amb22432527 [0,2,0,0,0,0|2,0,0]=4 11047 B12R1.226 CC(C)COc1cccc(F)c1 Amb27976580 [0,2,0,0,0,0|1,0,0]=3 11048 B12R1.226 CC(C)COc1cccc(N)c1 Amb1133931 [0,2,0,0,0,0|1,0,0]=3 11049 B12R1.226 CC(C)COc1cccc(N)c1 Amb2140554 [0,2,0,0,0,0|1,0,0]=3 11050 B12R1.226 CC(C)COc1cccc(N)n1 Amb27593636 [0,2,0,0,0,0|2,0,0]=4 11051 B12R1.226 CC(C)COc1cccc(O)c1 Amb8837440 [0,2,0,0,0,0|1,0,0]=3 11052 B12R1.226 CC(C)COc1ccnc(Cl)c1 Amb26581136 [0,2,0,0,0,0|2,0,0]=4 11053 B12R1.226 CC(C)COc1cncc(Br)c1 Amb27883583 [0,2,0,0,0,0|2,0,0]=4 11054 B12R1.226 CC(C)CSc1cccc(Br)c1 Amb22227900 [0,2,0,0,0,0|1,1,0]=4 11055 B12R1.226 CC(C)CSc1cccc(F)c1 Amb27595407 [0,2,0,0,0,0|1,1,0]=4 11056 B12R1.226 CC(C)CSc1cccc(N)c1 Amb18289365 [0,2,0,0,0,0|1,1,0]=4 11057 B12R1.226 CC(C)CSc1cccc(O)c1 Amb25207683 [0,2,0,0,0,0|1,1,0]=4 11058 B12R1.226 CC(C)CSc1cccc(S)c1 Amb26936306 [0,2,0,0,0,0|1,1,0]=4 11059 B12R1.226 CC(Cl)CCc1cccc(Br)c1 Amb28059417 [0,2,0,0,0,0|2,0,0]=4 11060 B12R1.226 CC(Cl)CCc1cccc(Cl)c1 Amb27806924 [0,2,0,0,0,0|2,0,0]=4 11061 B12R1.226 CC(Cl)CNc1cccc(Cl)c1 Amb28366509 [0,2,0,0,0,0|2,0,0]=4 11062 B12R1.226 CC(Cl)COc1cccc(F)c1 Amb27878782 [0,2,0,0,0,0|1,0,0]=3 11063 B12R1.226 CC(F)COc1cccc(N)c1 Amb27440905 [0,2,0,0,0,0|1,0,0]=3 11064 B12R1.226 CC(F)COc1cccc(O)c1 Amb27238896 [0,2,0,0,0,0|1,0,0]=3 11065 B12R1.226 CC(N)CCc1cccc(Br)c1 Amb8869696 [0,2,0,0,0,0|2,0,0]=4 11066 B12R1.226 CC(N)CCc1cccc(Cl)c1 Amb9031773 [0,2,0,0,0,0|2,0,0]=4 11067 B12R1.226 CC(N)CCc1cccc(F)c1 Amb8869695 [0,2,0,0,0,0|2,0,0]=4 11068 B12R1.226 CC(N)CCc1cccc(O)c1 Amb18828241 [0,2,0,0,0,0|2,0,0]=4 11069 B12R1.226 CC(N)CNc1cccc(Br)c1 Amb25674799 [0,2,0,0,0,0|2,0,0]=4 11070 B12R1.226 CC(N)CNc1cccc(Cl)c1 Amb26422155 [0,2,0,0,0,0|2,0,0]=4 11071 B12R1.226 CC(N)CNc1cccc(F)c1 Amb26017767 [0,2,0,0,0,0|2,0,0]=4 11072 B12R1.226 CC(N)COc1cccc(Br)c1 Amb17062517 [0,2,0,0,0,0|1,0,0]=3 11073 B12R1.226 CC(N)COc1cccc(Cl)c1 Amb22642660 [0,2,0,0,0,0|1,0,0]=3 11074 B12R1.226 CC(N)COc1cccc(F)c1 Amb1142128 [0,2,0,0,0,0|1,0,0]=3 11075 B12R1.226 CC(N)CSc1cccc(Br)c1 Amb28143473 [0,2,0,0,0,0|1,1,0]=4 11076 B12R1.226 CC(N)CSc1cccc(Cl)c1 Amb18066336 [0,2,0,0,0,0|1,1,0]=4 11077 B12R1.226 CC(N)CSc1cccc(F)c1 Amb28386333 [0,2,0,0,0,0|1,1,0]=4 11078 B12R1.226 CC(N)CSc1cccc(N)c1 Amb27806846 [0,2,0,0,0,0|1,1,0]=4 11079 B12R1.226 CC(O)C#Cc1cccc(Br)c1 Amb9777261 [0,2,0,0,0,0|1,0,1]=4 11080 B12R1.226 CC(O)C#Cc1cccc(Cl)c1 Amb9777258 [0,2,0,0,0,0|1,0,1]=4 11081 B12R1.226 CC(O)C#Cc1cccc(F)c1 Amb9777255 [0,2,0,0,0,0|1,0,1]=4 11082 B12R1.226 CC(O)CCc1cc(F)ccn1 Amb33320294 [0,2,0,0,0,0|2,0,0]=4 11083 B12R1.226 CC(O)CCc1cccc(Br)c1 Amb27972790 [0,2,0,0,0,0|1,0,0]=3 11084 B12R1.226 CC(O)CCc1cccc(Br)n1 Amb33433159 [0,2,0,0,0,0|2,0,0]=4 11085 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [0,2,0,0,0,0|1,0,0]=3 11086 B12R1.226 CC(O)CCc1cccc(Cl)n1 Amb33480314 [0,2,0,0,0,0|2,0,0]=4 11087 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [0,2,0,0,0,0|1,0,0]=3 11088 B12R1.226 CC(O)CCc1cccc(N)c1 Amb27482979 [0,2,0,0,0,0|1,0,0]=3 11089 B12R1.226 CC(O)CCc1cccc(O)c1 Amb25251886 [0,2,0,0,0,0|1,0,0]=3 11090 B12R1.226 CC(O)CCc1cncc(Br)c1 Amb26013792 [0,2,0,0,0,0|2,0,0]=4 11091 B12R1.226 CC(O)CCc1cncc(F)c1 Amb26539372 [0,2,0,0,0,0|2,0,0]=4 11092 B12R1.226 CC(O)CNc1cccc(Br)c1 Amb17142611 [0,2,0,0,0,0|1,0,0]=3 11093 B12R1.226 CC(O)CNc1cccc(Cl)c1 Amb17139126 [0,2,0,0,0,0|1,0,0]=3 11094 B12R1.226 CC(O)CNc1cccc(F)c1 Amb17138652 [0,2,0,0,0,0|1,0,0]=3 11095 B12R1.226 CC(O)CNc1ccnc(Cl)c1 Amb27454399 [0,2,0,0,0,0|2,0,0]=4 11096 B12R1.226 CC(O)CNc1cncc(Br)c1 Amb26470634 [0,2,0,0,0,0|2,0,0]=4 11097 B12R1.226 CC(O)CNc1cncc(Cl)c1 Amb35706921 [0,2,0,0,0,0|2,0,0]=4 11098 B12R1.226 CC(O)CNc1cncc(F)c1 Amb27826221 [0,2,0,0,0,0|2,0,0]=4 11099 B12R1.226 CC(O)COc1cccc(Cl)c1 Amb28122899 [0,2,0,0,0,0|0,0,0]=2 11100 B12R1.226 CC(O)COc1cccc(F)c1 Amb18806456 [0,2,0,0,0,0|0,0,0]=2 11101 B12R1.226 CC(O)CSc1cccc(Br)c1 Amb27759812 [0,2,0,0,0,0|0,1,0]=3 11102 B12R1.226 CC(O)\C=C\c1cccc(Br)c1 Amb25098989 [0,2,0,0,0,0|1,0,1]=4 11103 B12R1.226 CC(O)\C=C\c1cccc(Cl)c1 Amb24590748 [0,2,0,0,0,0|1,0,1]=4 11104 B12R1.226 CC(O)\C=C\c1cccc(F)c1 Amb25730368 [0,2,0,0,0,0|1,0,1]=4 11105 B12R1.226 CC(O)\C=C\c1cccc(I)c1 Amb27644961 [0,2,0,0,0,0|1,0,1]=4 11106 B12R1.226 C[C@@H](N)CCc1cccc(Br)c1 Amb33450644 [0,2,0,0,0,0|2,0,0]=4 11107 B12R1.226 C[C@@H](N)CCc1cccc(Cl)c1 Amb33406773 [0,2,0,0,0,0|2,0,0]=4 11108 B12R1.226 C[C@@H](N)CCc1cccc(F)c1 Amb27412991 [0,2,0,0,0,0|2,0,0]=4 11109 B12R1.226 C[C@@H](N)CCc1cccc(N)c1 Amb27460201 [0,2,0,0,0,0|2,0,0]=4 11110 B12R1.226 C[C@@H](N)CCc1cccc(O)c1 Amb27435608 [0,2,0,0,0,0|2,0,0]=4 11111 B12R1.226 C[C@@H](N)COc1cccc(Br)c1 Amb18036076 [0,2,0,0,0,0|1,0,0]=3 11112 B12R1.226 C[C@@H](N)COc1cccc(Cl)c1 Amb18538519 [0,2,0,0,0,0|1,0,0]=3 11113 B12R1.226 C[C@@H](N)COc1cccc(F)c1 Amb18538500 [0,2,0,0,0,0|1,0,0]=3 11114 B12R1.226 C[C@@H](N)COc1cccc(I)c1 Amb30012129 [0,2,0,0,0,0|1,0,0]=3 11115 B12R1.226 C[C@@H](N)COc1cncc(Br)c1 Amb35714485 [0,2,0,0,0,0|2,0,0]=4 11116 B12R1.226 C[C@@H](N)COc1cncc(Cl)c1 Amb29850644 [0,2,0,0,0,0|2,0,0]=4 11117 B12R1.226 C[C@@H](O)CCc1cc(F)ccn1 Amb33320292 [0,2,0,0,0,0|2,0,0]=4 11118 B12R1.226 C[C@@H](O)CCc1cccc(Br)c1 Amb33451604 [0,2,0,0,0,0|1,0,0]=3 11119 B12R1.226 C[C@@H](O)CCc1cccc(Br)n1 Amb33433124 [0,2,0,0,0,0|2,0,0]=4 11120 B12R1.226 C[C@@H](O)CCc1cccc(Cl)c1 Amb33223349 [0,2,0,0,0,0|1,0,0]=3 11121 B12R1.226 C[C@@H](O)CCc1cccc(Cl)n1 Amb33222413 [0,2,0,0,0,0|2,0,0]=4 11122 B12R1.226 C[C@@H](O)CCc1cccc(F)c1 Amb33316033 [0,2,0,0,0,0|1,0,0]=3 11123 B12R1.226 C[C@@H](O)CCc1cccc(O)c1 Amb33310960 [0,2,0,0,0,0|1,0,0]=3 11124 B12R1.226 C[C@@H](O)CCc1cncc(Br)c1 Amb33476974 [0,2,0,0,0,0|2,0,0]=4 11125 B12R1.226 C[C@@H](O)CCc1cncc(F)c1 Amb33196286 [0,2,0,0,0,0|2,0,0]=4 11126 B12R1.226 C[C@@H](O)CNc1cccc(Br)c1 Amb28244268 [0,2,0,0,0,0|1,0,0]=3 11127 B12R1.226 C[C@@H](O)CNc1cccc(Cl)c1 Amb28249854 [0,2,0,0,0,0|1,0,0]=3 11128 B12R1.226 C[C@@H](O)CNc1cncc(Br)c1 Amb26658381 [0,2,0,0,0,0|2,0,0]=4 11129 B12R1.226 C[C@@H](O)CNc1cncc(Cl)c1 Amb35706923 [0,2,0,0,0,0|2,0,0]=4 11130 B12R1.226 C[C@@H](O)COc1cccc(F)c1 Amb28185209 [0,2,0,0,0,0|0,0,0]=2 11131 B12R1.226 C[C@@H](O)COc1cccc(I)c1 Amb28383962 [0,2,0,0,0,0|0,0,0]=2 11132 B12R1.226 C[C@@H](O)COc1cncc(F)c1 Amb27414974 [0,2,0,0,0,0|1,0,0]=3 11133 B12R1.226 C[C@@H](O)CSc1cccc(Cl)c1 Amb28244187 [0,2,0,0,0,0|0,1,0]=3 11134 B12R1.226 C[C@@H](O)CSc1cccc(F)c1 Amb27398997 [0,2,0,0,0,0|0,1,0]=3 11135 B12R1.226 C[C@H](N)CCc1cccc(Br)c1 Amb24683805 [0,2,0,0,0,0|2,0,0]=4 11136 B12R1.226 C[C@H](N)CCc1cccc(Cl)c1 Amb27788817 [0,2,0,0,0,0|2,0,0]=4 11137 B12R1.226 C[C@H](N)CCc1cccc(F)c1 Amb28429239 [0,2,0,0,0,0|2,0,0]=4 11138 B12R1.226 C[C@H](N)CCc1cccc(O)c1 Amb28282627 [0,2,0,0,0,0|2,0,0]=4 11139 B12R1.226 C[C@H](N)COc1cccc(I)c1 Amb30012127 [0,2,0,0,0,0|1,0,0]=3 11140 B12R1.226 C[C@H](N)COc1cncc(Br)c1 Amb35714484 [0,2,0,0,0,0|2,0,0]=4 11141 B12R1.226 C[C@H](N)COc1cncc(Cl)c1 Amb29850643 [0,2,0,0,0,0|2,0,0]=4 11142 B12R1.226 C[C@H](O)CCc1cc(F)ccn1 Amb33320293 [0,2,0,0,0,0|2,0,0]=4 11143 B12R1.226 C[C@H](O)CCc1cccc(Br)c1 Amb33451603 [0,2,0,0,0,0|1,0,0]=3 11144 B12R1.226 C[C@H](O)CCc1cccc(Br)n1 Amb33433163 [0,2,0,0,0,0|2,0,0]=4 11145 B12R1.226 C[C@H](O)CCc1cccc(Cl)c1 Amb33223330 [0,2,0,0,0,0|1,0,0]=3 11146 B12R1.226 C[C@H](O)CCc1cccc(Cl)n1 Amb33222412 [0,2,0,0,0,0|2,0,0]=4 11147 B12R1.226 C[C@H](O)CCc1cccc(F)c1 Amb33316035 [0,2,0,0,0,0|1,0,0]=3 11148 B12R1.226 C[C@H](O)CCc1cccc(O)c1 Amb33310962 [0,2,0,0,0,0|1,0,0]=3 11149 B12R1.226 C[C@H](O)CCc1cncc(Br)c1 Amb33478419 [0,2,0,0,0,0|2,0,0]=4 11150 B12R1.226 C[C@H](O)CCc1cncc(F)c1 Amb33196287 [0,2,0,0,0,0|2,0,0]=4 11151 B12R1.226 C[C@H](O)CNc1cccc(Cl)n1 Amb27260054 [0,2,0,0,0,0|2,0,0]=4 11152 B12R1.226 C[C@H](O)CNc1cncc(Br)c1 Amb26342037 [0,2,0,0,0,0|2,0,0]=4 11153 B12R1.226 C[C@H](O)CNc1cncc(Cl)c1 Amb35706925 [0,2,0,0,0,0|2,0,0]=4 11154 B12R1.226 C[C@H](O)COc1cccc(I)c1 Amb28066516 [0,2,0,0,0,0|0,0,0]=2 11155 B12R1.226 C[C@H](O)COc1cncc(Cl)c1 Amb27981234 [0,2,0,0,0,0|1,0,0]=3 11156 B12R1.226 C[C@H](O)COc1cncc(F)c1 Amb27863785 [0,2,0,0,0,0|1,0,0]=3 11157 B12R1.226 C[C@H](O)CSc1cccc(O)c1 Amb27832372 [0,2,0,0,0,0|0,1,0]=3 11158 B12R1.226 Cc1cc(CCC(C)O)ccn1 Amb33474901 [0,2,0,0,0,0|2,0,0]=4 11159 B12R1.226 Cc1cc(CC[C@@H](C)O)ccn1 Amb32732947 [0,2,0,0,0,0|2,0,0]=4 11160 B12R1.226 Cc1cc(CC[C@H](C)O)ccn1 Amb32732948 [0,2,0,0,0,0|2,0,0]=4 11161 B12R1.226 Cc1cc(NCC(C)O)ccn1 Amb28383551 [0,2,0,0,0,0|2,0,0]=4 11162 B12R1.226 Cc1cc(OCC(=O)O)ccn1 Amb24450470 [0,2,0,0,0,0|1,0,1]=4 11163 B12R1.226 Cc1cc(OCC(C)C)ccn1 Amb27187532 [0,2,0,0,0,0|2,0,0]=4 11164 B12R1.226 Cc1cc(OCC(C)N)ccn1 Amb35727441 [0,2,0,0,0,0|2,0,0]=4 11165 B12R1.226 Cc1cccc(CCB(O)O)c1 Amb25790748 [0,2,0,0,0,0|2,0,0]=4 11166 B12R1.226 Cc1cccc(CCC(=O)O)c1 Amb1106242 [0,2,0,0,0,0|1,0,1]=4 11167 B12R1.226 Cc1cccc(CCC(C)N)c1 Amb9031760 [0,2,0,0,0,0|2,0,0]=4 11168 B12R1.226 Cc1cccc(CCC(C)O)c1 Amb17507253 [0,2,0,0,0,0|1,0,0]=3 11169 B12R1.226 Cc1cccc(CCC(C)O)n1 Amb26048455 [0,2,0,0,0,0|2,0,0]=4 11170 B12R1.226 Cc1cccc(CCC(C)S)c1 Amb28141690 [0,2,0,0,0,0|1,1,0]=4 11171 B12R1.226 Cc1cccc(CC[C@@H](C)N)c1 Amb33171984 [0,2,0,0,0,0|2,0,0]=4 11172 B12R1.226 Cc1cccc(CC[C@@H](C)O)c1 Amb33203919 [0,2,0,0,0,0|1,0,0]=3 11173 B12R1.226 Cc1cccc(CC[C@@H](C)O)n1 Amb33199935 [0,2,0,0,0,0|2,0,0]=4 11174 B12R1.226 Cc1cccc(CC[C@H](C)N)c1 Amb24682488 [0,2,0,0,0,0|2,0,0]=4 11175 B12R1.226 Cc1cccc(CC[C@H](C)O)c1 Amb33203920 [0,2,0,0,0,0|1,0,0]=3 11176 B12R1.226 Cc1cccc(CC[C@H](C)O)n1 Amb33199936 [0,2,0,0,0,0|2,0,0]=4 11177 B12R1.226 Cc1cccc(NCC(=O)O)c1 Amb840514 [0,2,0,0,0,0|1,0,1]=4 11178 B12R1.226 Cc1cccc(NCC(C)C)c1 Amb6684427 [0,2,0,0,0,0|2,0,0]=4 11179 B12R1.226 Cc1cccc(NCC(C)N)c1 Amb27828202 [0,2,0,0,0,0|2,0,0]=4 11180 B12R1.226 Cc1cccc(NCC(C)O)c1 Amb17138593 [0,2,0,0,0,0|1,0,0]=3 11181 B12R1.226 Cc1cccc(OCC(=O)Cl)c1 Amb10880010 [0,2,0,0,0,0|0,0,2]=4 11182 B12R1.226 Cc1cccc(OCC(=O)O)c1 Amb6336446 [0,2,0,0,0,0|0,0,1]=3 11183 B12R1.226 Cc1cccc(OCC(=O)O)n1 Amb24389213 [0,2,0,0,0,0|1,0,1]=4 11184 B12R1.226 Cc1cccc(OCC(C)C)n1 Amb26376003 [0,2,0,0,0,0|2,0,0]=4 11185 B12R1.226 Cc1cccc(OCC(C)N)c1 Amb9756348 [0,2,0,0,0,0|1,0,0]=3 11186 B12R1.226 Cc1cccc(OCC(C)N)n1 Amb35727440 [0,2,0,0,0,0|2,0,0]=4 11187 B12R1.226 Cc1cccc(OCC(C)O)n1 Amb22900273 [0,2,0,0,0,0|1,0,0]=3 11188 B12R1.226 Cc1cccc(OCC(N)=O)c1 Amb6346003 [0,2,0,0,0,0|0,0,2]=4 11189 B12R1.226 Cc1cccc(OCC(N)=S)c1 Amb5542138 [0,2,0,0,0,0|0,1,1]=4 11190 B12R1.226 Cc1cccc(OC[C@@H](C)N)c1 Amb18538492 [0,2,0,0,0,0|1,0,0]=3 11191 B12R1.226 Cc1cccc(SCC(=O)O)c1 Amb5768509 [0,2,0,0,0,0|0,1,1]=4 11192 B12R1.226 Cc1cccc(SCC(C)C)c1 Amb27250481 [0,2,0,0,0,0|1,1,0]=4 11193 B12R1.226 Cc1cccc(SCC(C)N)c1 Amb18564187 [0,2,0,0,0,0|1,1,0]=4 11194 B12R1.226 Cc1cccc(SC[C@H](C)O)c1 Amb27837370 [0,2,0,0,0,0|0,1,0]=3 11195 B12R1.226 Cc1cccc(\C=C\C(C)O)c1 Amb25683937 [0,2,0,0,0,0|1,0,1]=4 11196 B12R1.226 Cc1ccnc(CCC(C)O)c1 Amb27664039 [0,2,0,0,0,0|2,0,0]=4 11197 B12R1.226 Cc1ccnc(CC[C@@H](C)O)c1 Amb33374489 [0,2,0,0,0,0|2,0,0]=4 11198 B12R1.226 Cc1ccnc(CC[C@H](C)O)c1 Amb33374500 [0,2,0,0,0,0|2,0,0]=4 11199 B12R1.226 Cc1ccnc(NC[C@H](C)O)c1 Amb28316261 [0,2,0,0,0,0|2,0,0]=4 11200 B12R1.226 Cc1ccnc(OCC(=O)O)c1 Amb25154209 [0,2,0,0,0,0|1,0,1]=4 11201 B12R1.226 Cc1ccnc(OCC(C)N)c1 Amb35727580 [0,2,0,0,0,0|2,0,0]=4 11202 B12R1.226 Cc1cncc(CCC(C)O)c1 Amb26373762 [0,2,0,0,0,0|2,0,0]=4 11203 B12R1.226 Cc1cncc(CC[C@@H](C)O)c1 Amb33318008 [0,2,0,0,0,0|2,0,0]=4 11204 B12R1.226 Cc1cncc(CC[C@H](C)O)c1 Amb33374472 [0,2,0,0,0,0|2,0,0]=4 11205 B12R1.226 Cc1cncc(OCC(=O)O)c1 Amb33317153 [0,2,0,0,0,0|1,0,1]=4 11206 B12R1.226 FC(F)CNc1cccc(Cl)c1 Amb18320416 [0,2,0,0,0,0|2,0,0]=4 11207 B12R1.226 FC(F)COc1cccc(Br)c1 Amb19148821 [0,2,0,0,0,0|1,0,0]=3 11208 B12R1.226 FC(F)COc1cccc(Cl)c1 Amb28073836 [0,2,0,0,0,0|1,0,0]=3 11209 B12R1.226 FC(F)COc1cccc(I)c1 Amb24056922 [0,2,0,0,0,0|1,0,0]=3 11210 B12R1.226 FC(F)COc1ccnc(Cl)c1 Amb25041409 [0,2,0,0,0,0|2,0,0]=4 11211 B12R1.226 FC(F)CSc1cccc(Br)c1 Amb22227888 [0,2,0,0,0,0|1,1,0]=4 11212 B12R1.226 Fc1cc(OCC(F)F)ccn1 Amb27168301 [0,2,0,0,0,0|2,0,0]=4 11213 B12R1.226 Fc1cccc(NCC(F)F)c1 Amb18795534 [0,2,0,0,0,0|2,0,0]=4 11214 B12R1.226 Fc1cccc(OCC(F)F)c1 Amb27247839 [0,2,0,0,0,0|1,0,0]=3 11215 B12R1.226 Fc1cccc(SCC(F)F)c1 Amb27187781 [0,2,0,0,0,0|1,1,0]=4 11216 B12R1.226 N=C(N)COc1cccc(Cl)c1 Amb6266509 [0,2,0,0,0,0|1,0,1]=4 11217 B12R1.226 N=C(N)COc1cccc(Cl)c1 Amb8626375 [0,2,0,0,0,0|1,0,1]=4 11218 B12R1.226 N=C(N)COc1cccc(F)c1 Amb6272872 [0,2,0,0,0,0|1,0,1]=4 11219 B12R1.226 N=C(N)COc1cccc(F)c1 Amb8627400 [0,2,0,0,0,0|1,0,1]=4 11220 B12R1.226 N=C(N)COc1cccc(N)c1 Amb27667472 [0,2,0,0,0,0|1,0,1]=4 11221 B12R1.226 NC(=O)COc1cccc(Br)c1 Amb192032 [0,2,0,0,0,0|0,0,2]=4 11222 B12R1.226 NC(=O)COc1cccc(Cl)c1 Amb2726046 [0,2,0,0,0,0|0,0,2]=4 11223 B12R1.226 NC(=O)COc1cccc(I)c1 Amb181273 [0,2,0,0,0,0|0,0,2]=4 11224 B12R1.226 NC(=O)COc1cccc(N)c1 Amb1112358 [0,2,0,0,0,0|0,0,2]=4 11225 B12R1.226 NC(=O)COc1cccc(O)c1 Amb9210998 [0,2,0,0,0,0|0,0,2]=4 11226 B12R1.226 Nc1cc(OCC(F)F)ccn1 Amb26059016 [0,2,0,0,0,0|2,0,0]=4 11227 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2684507 [0,2,0,0,0,0|1,0,1]=4 11228 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2692058 [0,2,0,0,0,0|1,0,1]=4 11229 B12R1.226 Nc1cccc(OCC(=O)O)c1 Amb839769 [0,2,0,0,0,0|0,0,1]=3 11230 B12R1.226 Nc1cccc(OCC(F)F)c1 Amb9769461 [0,2,0,0,0,0|1,0,0]=3 11231 B12R1.226 Nc1cccc(OCC(F)F)n1 Amb22157309 [0,2,0,0,0,0|2,0,0]=4 11232 B12R1.226 Nc1ccnc(OCC(F)F)c1 Amb25054272 [0,2,0,0,0,0|2,0,0]=4 11233 B12R1.226 O=C(Cl)COc1cccc(Br)c1 Amb16230149 [0,2,0,0,0,0|0,0,2]=4 11234 B12R1.226 O=C(Cl)COc1cccc(F)c1 Amb27406717 [0,2,0,0,0,0|0,0,2]=4 11235 B12R1.226 O=C(O)CCc1cccc(Br)c1 Amb1209216 [0,2,0,0,0,0|1,0,1]=4 11236 B12R1.226 O=C(O)CCc1cccc(Cl)c1 Amb1672952 [0,2,0,0,0,0|1,0,1]=4 11237 B12R1.226 O=C(O)CCc1cccc(F)c1 Amb1091868 [0,2,0,0,0,0|1,0,1]=4 11238 B12R1.226 O=C(O)CCc1cccc(I)c1 Amb16232982 [0,2,0,0,0,0|1,0,1]=4 11239 B12R1.226 O=C(O)CCc1cccc(O)c1 Amb2688781 [0,2,0,0,0,0|1,0,1]=4 11240 B12R1.226 O=C(O)CNc1cccc(Br)c1 Amb840527 [0,2,0,0,0,0|1,0,1]=4 11241 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb10609174 [0,2,0,0,0,0|1,0,1]=4 11242 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb840525 [0,2,0,0,0,0|1,0,1]=4 11243 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb19341704 [0,2,0,0,0,0|1,0,1]=4 11244 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb840522 [0,2,0,0,0,0|1,0,1]=4 11245 B12R1.226 O=C(O)COC1=CC(=O)NC=C1 Amb32946294 [0,2,0,0,0,0|1,0,1]=4 11246 B12R1.226 O=C(O)COc1cc(Br)ccn1 Amb18660970 [0,2,0,0,0,0|1,0,1]=4 11247 B12R1.226 O=C(O)COc1cc(Cl)ccn1 Amb2609896 [0,2,0,0,0,0|1,0,1]=4 11248 B12R1.226 O=C(O)COc1cc(F)ccn1 Amb33325484 [0,2,0,0,0,0|1,0,1]=4 11249 B12R1.226 O=C(O)COc1cccc(Br)c1 Amb6336684 [0,2,0,0,0,0|0,0,1]=3 11250 B12R1.226 O=C(O)COc1cccc(Br)n1 Amb33433825 [0,2,0,0,0,0|1,0,1]=4 11251 B12R1.226 O=C(O)COc1cccc(Cl)c1 Amb1211231 [0,2,0,0,0,0|0,0,1]=3 11252 B12R1.226 O=C(O)COc1cccc(Cl)n1 Amb28365549 [0,2,0,0,0,0|1,0,1]=4 11253 B12R1.226 O=C(O)COc1cccc(F)c1 Amb1102803 [0,2,0,0,0,0|0,0,1]=3 11254 B12R1.226 O=C(O)COc1cccc(I)c1 Amb4574102 [0,2,0,0,0,0|0,0,1]=3 11255 B12R1.226 O=C(O)COc1cccc(O)c1 Amb6360813 [0,2,0,0,0,0|0,0,1]=3 11256 B12R1.226 O=C(O)COc1ccnc(Br)c1 Amb18660965 [0,2,0,0,0,0|1,0,1]=4 11257 B12R1.226 O=C(O)COc1ccnc(Cl)c1 Amb25792389 [0,2,0,0,0,0|1,0,1]=4 11258 B12R1.226 O=C(O)COc1cncc(Br)c1 Amb33545391 [0,2,0,0,0,0|1,0,1]=4 11259 B12R1.226 O=C(O)COc1cncc(Cl)c1 Amb26875815 [0,2,0,0,0,0|1,0,1]=4 11260 B12R1.226 O=C(O)COc1cncc(F)c1 Amb25760871 [0,2,0,0,0,0|1,0,1]=4 11261 B12R1.226 O=C(O)CSc1cccc(Br)c1 Amb2372547 [0,2,0,0,0,0|0,1,1]=4 11262 B12R1.226 O=C(O)CSc1cccc(Cl)c1 Amb2794096 [0,2,0,0,0,0|0,1,1]=4 11263 B12R1.226 O=C(O)CSc1cccc(F)c1 Amb19887452 [0,2,0,0,0,0|0,1,1]=4 11264 B12R1.226 O=C(O)CSc1cccc(O)c1 Amb28385688 [0,2,0,0,0,0|0,1,1]=4 11265 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [0,2,0,0,0,0|2,0,0]=4 11266 B12R1.226 OB(O)CCc1cccc(O)c1 Amb27215942 [0,2,0,0,0,0|2,0,0]=4 11267 B12R1.226 Oc1cccc(OCC(F)F)c1 Amb18795192 [0,2,0,0,0,0|1,0,0]=3 11268 B12R1.382 C#CCOc1cccc(C#N)c1 Amb6266150 [0,2,0,0,0,0|1,0,1]=4 11269 B12R1.382 C#CCOc1cccc(C=O)c1 Amb3509752 [0,2,0,0,0,0|1,0,1]=4 11270 B12R1.382 C#CCOc1cccc(CN)c1 Amb18969289 [0,2,0,0,0,0|1,0,1]=4 11271 B12R1.382 C#CCOc1cccc(CN)c1 Amb28555698 [0,2,0,0,0,0|1,0,1]=4 11272 B12R1.382 C#CCOc1cccc(CO)c1 Amb3546824 [0,2,0,0,0,0|1,0,1]=4 11273 B12R1.382 C#CCOc1cccc(OC)c1 Amb18800612 [0,2,0,0,0,0|1,0,1]=4 11274 B12R1.382 C#Cc1cccc(CCCBr)c1 Amb33007106 [0,2,0,0,0,0|2,0,0]=4 11275 B12R1.382 C#Cc1cccc(CCCN)c1 Amb33267712 [0,2,0,0,0,0|2,0,0]=4 11276 B12R1.382 C#Cc1cccc(CCCO)c1 Amb24388502 [0,2,0,0,0,0|1,0,0]=3 11277 B12R1.382 C#Cc1cccc(CCCS)c1 Amb32875592 [0,2,0,0,0,0|1,1,0]=4 11278 B12R1.382 C#Cc1cccc(NCCF)c1 Amb27171747 [0,2,0,0,0,0|2,0,0]=4 11279 B12R1.382 C#Cc1cccc(OCCC)c1 Amb25997337 [0,2,0,0,0,0|1,0,0]=3 11280 B12R1.382 C#Cc1cccc(OCCC)n1 Amb24717122 [0,2,0,0,0,0|2,0,0]=4 11281 B12R1.382 C#Cc1cccc(OCCN)c1 Amb32875602 [0,2,0,0,0,0|1,0,0]=3 11282 B12R1.382 C#Cc1cccc(OCOC)c1 Amb27466461 [0,2,0,0,0,0|2,0,0]=4 11283 B12R1.382 C#Cc1cccc(\C=C\CO)c1 Amb33272787 [0,2,0,0,0,0|1,0,1]=4 11284 B12R1.382 C#Cc1cncc(OCCC)c1 Amb27464201 [0,2,0,0,0,0|2,0,0]=4 11285 B12R1.382 C#Cc1cncc(OCCN)c1 Amb24445474 [0,2,0,0,0,0|2,0,0]=4 11286 B12R1.382 C=CCOc1cccc(C#N)c1 Amb6279827 [0,2,0,0,0,0|1,0,1]=4 11287 B12R1.382 C=CCOc1cccc(C=O)c1 Amb1227717 [0,2,0,0,0,0|1,0,1]=4 11288 B12R1.382 C=CCOc1cccc(CO)c1 Amb33527963 [0,2,0,0,0,0|1,0,1]=4 11289 B12R1.382 C=CCOc1cccc(NC)c1 Amb23539741 [0,2,0,0,0,0|1,0,1]=4 11290 B12R1.382 C=Cc1cccc(NCCO)n1 Amb26347911 [0,2,0,0,0,0|2,0,0]=4 11291 B12R1.382 CCCNc1cccc(CN)c1 Amb27241497 [0,2,0,0,0,0|2,0,0]=4 11292 B12R1.382 CCCNc1cccc(NN)c1 Amb27645860 [0,2,0,0,0,0|2,0,0]=4 11293 B12R1.382 CCCNc1cccc(OC)c1 Amb4313520 [0,2,0,0,0,0|2,0,0]=4 11294 B12R1.382 CCCNc1cccc(SC)c1 Amb6687792 [0,2,0,0,0,0|2,0,0]=4 11295 B12R1.382 CCCOc1cc(CN)ccn1 Amb28872368 [0,2,0,0,0,0|2,0,0]=4 11296 B12R1.382 CCCOc1cc(CN)ccn1 Amb8874523 [0,2,0,0,0,0|2,0,0]=4 11297 B12R1.382 CCCOc1cccc(C#N)c1 Amb5761029 [0,2,0,0,0,0|1,0,0]=3 11298 B12R1.382 CCCOc1cccc(C#N)n1 Amb28318072 [0,2,0,0,0,0|2,0,0]=4 11299 B12R1.382 CCCOc1cccc(C=O)c1 Amb2589523 [0,2,0,0,0,0|1,0,0]=3 11300 B12R1.382 CCCOc1cccc(CBr)c1 Amb33528737 [0,2,0,0,0,0|1,0,0]=3 11301 B12R1.382 CCCOc1cccc(CN)c1 Amb10201546 [0,2,0,0,0,0|1,0,0]=3 11302 B12R1.382 CCCOc1cccc(CN)c1 Amb1135599 [0,2,0,0,0,0|1,0,0]=3 11303 B12R1.382 CCCOc1cccc(CO)c1 Amb3548881 [0,2,0,0,0,0|1,0,0]=3 11304 B12R1.382 CCCOc1cccc(CS)c1 Amb32788744 [0,2,0,0,0,0|1,0,0]=3 11305 B12R1.382 CCCOc1cccc(NN)c1 Amb17232618 [0,2,0,0,0,0|1,0,0]=3 11306 B12R1.382 CCCOc1cncc(C=O)c1 Amb32669061 [0,2,0,0,0,0|2,0,0]=4 11307 B12R1.382 CCCOc1cncc(NN)c1 Amb27607505 [0,2,0,0,0,0|2,0,0]=4 11308 B12R1.382 CCCSc1cccc(C#N)c1 Amb27970322 [0,2,0,0,0,0|1,1,0]=4 11309 B12R1.382 CCCSc1cccc(CCl)c1 Amb33734281 [0,2,0,0,0,0|1,1,0]=4 11310 B12R1.382 CCCSc1cccc(CO)c1 Amb30589050 [0,2,0,0,0,0|1,1,0]=4 11311 B12R1.382 CCc1cc(NCCO)ccn1 Amb28396715 [0,2,0,0,0,0|2,0,0]=4 11312 B12R1.382 CCc1cccc(CCCBr)c1 Amb33451072 [0,2,0,0,0,0|2,0,0]=4 11313 B12R1.382 CCc1cccc(CCCN)c1 Amb33474982 [0,2,0,0,0,0|2,0,0]=4 11314 B12R1.382 CCc1cccc(CCCO)c1 Amb33171465 [0,2,0,0,0,0|1,0,0]=3 11315 B12R1.382 CCc1cccc(CCCS)c1 Amb32874570 [0,2,0,0,0,0|1,1,0]=4 11316 B12R1.382 CCc1cccc(NCCF)c1 Amb27389206 [0,2,0,0,0,0|2,0,0]=4 11317 B12R1.382 CCc1cccc(OCC=O)c1 Amb5731830 [0,2,0,0,0,0|0,0,2]=4 11318 B12R1.382 CCc1cccc(OCCBr)c1 Amb1657338 [0,2,0,0,0,0|1,0,0]=3 11319 B12R1.382 CCc1cccc(OCCCl)c1 Amb8828481 [0,2,0,0,0,0|1,0,0]=3 11320 B12R1.382 CCc1cccc(OCCN)c1 Amb5358358 [0,2,0,0,0,0|1,0,0]=3 11321 B12R1.382 CCc1cccc(OCCO)c1 Amb9370543 [0,2,0,0,0,0|0,0,0]=2 11322 B12R1.382 CCc1cccc(OCCS)c1 Amb17233942 [0,2,0,0,0,0|0,1,0]=3 11323 B12R1.382 CCc1cccc(\C=C\CO)c1 Amb32875439 [0,2,0,0,0,0|1,0,1]=4 11324 B12R1.382 CNc1cc(OCCO)ccn1 Amb27203834 [0,2,0,0,0,0|1,0,0]=3 11325 B12R1.382 CNc1cc(OCCO)ncn1 Amb27389659 [0,2,0,0,0,0|2,0,0]=4 11326 B12R1.382 CNc1cccc(CCCO)c1 Amb8629050 [0,2,0,0,0,0|1,0,0]=3 11327 B12R1.382 CNc1cccc(NCCO)n1 Amb28288283 [0,2,0,0,0,0|2,0,0]=4 11328 B12R1.382 CNc1cccc(OCCO)n1 Amb27866934 [0,2,0,0,0,0|1,0,0]=3 11329 B12R1.382 CNc1cncc(OCCO)n1 Amb27639636 [0,2,0,0,0,0|2,0,0]=4 11330 B12R1.382 CNc1nccc(OCCO)n1 Amb27976550 [0,2,0,0,0,0|2,0,0]=4 11331 B12R1.382 COc1cc(CCCO)ccn1 Amb32730195 [0,2,0,0,0,0|2,0,0]=4 11332 B12R1.382 COc1cc(OCCN)ccn1 Amb33448622 [0,2,0,0,0,0|2,0,0]=4 11333 B12R1.382 COc1cccc(C#CCO)c1 Amb18180049 [0,2,0,0,0,0|1,0,1]=4 11334 B12R1.382 COc1cccc(CCCBr)c1 Amb33531075 [0,2,0,0,0,0|2,0,0]=4 11335 B12R1.382 COc1cccc(CCCCl)c1 Amb17104532 [0,2,0,0,0,0|2,0,0]=4 11336 B12R1.382 COc1cccc(CCCN)c1 Amb1092531 [0,2,0,0,0,0|2,0,0]=4 11337 B12R1.382 COc1cccc(CCCN)c1 Amb19429208 [0,2,0,0,0,0|2,0,0]=4 11338 B12R1.382 COc1cccc(CCCO)c1 Amb13883640 [0,2,0,0,0,0|1,0,0]=3 11339 B12R1.382 COc1cccc(CCCO)n1 Amb33429910 [0,2,0,0,0,0|2,0,0]=4 11340 B12R1.382 COc1cccc(CCCS)c1 Amb17400950 [0,2,0,0,0,0|1,1,0]=4 11341 B12R1.382 COc1cccc(NCCCl)c1 Amb17335807 [0,2,0,0,0,0|2,0,0]=4 11342 B12R1.382 COc1cccc(NCCN)c1 Amb17057754 [0,2,0,0,0,0|2,0,0]=4 11343 B12R1.382 COc1cccc(NCCO)c1 Amb6713990 [0,2,0,0,0,0|1,0,0]=3 11344 B12R1.382 COc1cccc(NCCO)n1 Amb27588479 [0,2,0,0,0,0|2,0,0]=4 11345 B12R1.382 COc1cccc(OCC#N)c1 Amb5780869 [0,2,0,0,0,0|1,0,1]=4 11346 B12R1.382 COc1cccc(OCC=O)c1 Amb5731833 [0,2,0,0,0,0|0,0,2]=4 11347 B12R1.382 COc1cccc(OCCBr)c1 Amb836270 [0,2,0,0,0,0|1,0,0]=3 11348 B12R1.382 COc1cccc(OCCCl)c1 Amb8828422 [0,2,0,0,0,0|1,0,0]=3 11349 B12R1.382 COc1cccc(OCCN)c1 Amb1135524 [0,2,0,0,0,0|1,0,0]=3 11350 B12R1.382 COc1cccc(OCCN)c1 Amb4021768 [0,2,0,0,0,0|1,0,0]=3 11351 B12R1.382 COc1cccc(OCCN)n1 Amb33473951 [0,2,0,0,0,0|2,0,0]=4 11352 B12R1.382 COc1cccc(OCCO)c1 Amb2209352 [0,2,0,0,0,0|0,0,0]=2 11353 B12R1.382 COc1cccc(OCCS)c1 Amb2794984 [0,2,0,0,0,0|0,1,0]=3 11354 B12R1.382 COc1cccc(SCCBr)c1 Amb6255470 [0,2,0,0,0,0|1,1,0]=4 11355 B12R1.382 COc1cccc(SCCN)c1 Amb6265863 [0,2,0,0,0,0|1,1,0]=4 11356 B12R1.382 COc1cccc(SCCO)c1 Amb2689269 [0,2,0,0,0,0|0,1,0]=3 11357 B12R1.382 COc1cccc(\C=C\CO)c1 Amb23442965 [0,2,0,0,0,0|1,0,1]=4 11358 B12R1.382 COc1ccnc(CCCO)c1 Amb33424530 [0,2,0,0,0,0|2,0,0]=4 11359 B12R1.382 COc1ccnc(OCCN)c1 Amb33424501 [0,2,0,0,0,0|2,0,0]=4 11360 B12R1.382 COc1cncc(CCCO)c1 Amb33276238 [0,2,0,0,0,0|2,0,0]=4 11361 B12R1.382 COc1cncc(OCCN)c1 Amb32874258 [0,2,0,0,0,0|2,0,0]=4 11362 B12R1.382 CSc1cccc(CCCBr)c1 Amb33451796 [0,2,0,0,0,0|2,0,0]=4 11363 B12R1.382 CSc1cccc(CCCN)c1 Amb33144879 [0,2,0,0,0,0|2,0,0]=4 11364 B12R1.382 CSc1cccc(CCCO)c1 Amb33149372 [0,2,0,0,0,0|1,0,0]=3 11365 B12R1.382 CSc1cccc(CCCS)c1 Amb33148184 [0,2,0,0,0,0|1,1,0]=4 11366 B12R1.382 CSc1cccc(NCCF)c1 Amb27241786 [0,2,0,0,0,0|2,0,0]=4 11367 B12R1.382 CSc1cccc(OCCN)c1 Amb33148192 [0,2,0,0,0,0|1,0,0]=3 11368 B12R1.382 CSc1cccc(\C=C\CO)c1 Amb33149408 [0,2,0,0,0,0|1,0,1]=4 11369 B12R1.382 FCCOc1cccc(CBr)c1 Amb23580156 [0,2,0,0,0,0|1,0,0]=3 11370 B12R1.382 FCCOc1cccc(CCl)c1 Amb31207831 [0,2,0,0,0,0|1,0,0]=3 11371 B12R1.382 N#CCOc1cccc(C=O)c1 Amb6275383 [0,2,0,0,0,0|1,0,1]=4 11372 B12R1.382 N#CCOc1cccc(CN)c1 Amb19373866 [0,2,0,0,0,0|1,0,1]=4 11373 B12R1.382 N#CCOc1cccc(CN)c1 Amb9620828 [0,2,0,0,0,0|1,0,1]=4 11374 B12R1.382 N#CCOc1cccc(CS)c1 Amb32788174 [0,2,0,0,0,0|1,0,1]=4 11375 B12R1.382 N#Cc1cc(OCCO)ccn1 Amb18788264 [0,2,0,0,0,0|1,0,0]=3 11376 B12R1.382 N#Cc1cccc(C#CCO)c1 Amb836764 [0,2,0,0,0,0|1,0,1]=4 11377 B12R1.382 N#Cc1cccc(CCCBr)c1 Amb25675608 [0,2,0,0,0,0|2,0,0]=4 11378 B12R1.382 N#Cc1cccc(CCCN)c1 Amb25217817 [0,2,0,0,0,0|2,0,0]=4 11379 B12R1.382 N#Cc1cccc(CCCO)c1 Amb17605790 [0,2,0,0,0,0|1,0,0]=3 11380 B12R1.382 N#Cc1cccc(CCCO)n1 Amb27270937 [0,2,0,0,0,0|2,0,0]=4 11381 B12R1.382 N#Cc1cccc(CCCS)c1 Amb33424357 [0,2,0,0,0,0|1,1,0]=4 11382 B12R1.382 N#Cc1cccc(NCCCl)c1 Amb17335461 [0,2,0,0,0,0|2,0,0]=4 11383 B12R1.382 N#Cc1cccc(NCCO)c1 Amb6712113 [0,2,0,0,0,0|1,0,0]=3 11384 B12R1.382 N#Cc1cccc(NCCO)n1 Amb27813030 [0,2,0,0,0,0|2,0,0]=4 11385 B12R1.382 N#Cc1cccc(OCC=O)c1 Amb18800496 [0,2,0,0,0,0|0,0,2]=4 11386 B12R1.382 N#Cc1cccc(OCCBr)c1 Amb6254993 [0,2,0,0,0,0|1,0,0]=3 11387 B12R1.382 N#Cc1cccc(OCCN)c1 Amb17562051 [0,2,0,0,0,0|1,0,0]=3 11388 B12R1.382 N#Cc1cccc(OCCO)c1 Amb6280681 [0,2,0,0,0,0|0,0,0]=2 11389 B12R1.382 N#Cc1cccc(OCCS)c1 Amb27652646 [0,2,0,0,0,0|0,1,0]=3 11390 B12R1.382 N#Cc1cccc(SCCF)c1 Amb28400326 [0,2,0,0,0,0|1,1,0]=4 11391 B12R1.382 N#Cc1cccc(SCCO)n1 Amb28249365 [0,2,0,0,0,0|1,1,0]=4 11392 B12R1.382 N#Cc1cccc(\C=C\CO)c1 Amb18645175 [0,2,0,0,0,0|1,0,1]=4 11393 B12R1.382 N#Cc1ccnc(OCCN)c1 Amb18296481 [0,2,0,0,0,0|2,0,0]=4 11394 B12R1.382 N#Cc1ccnc(OCCN)c1 Amb31304846 [0,2,0,0,0,0|2,0,0]=4 11395 B12R1.382 N#Cc1cncc(OCCO)n1 Amb27970999 [0,2,0,0,0,0|2,0,0]=4 11396 B12R1.382 N#Cc1nccc(OCCO)n1 Amb27594886 [0,2,0,0,0,0|2,0,0]=4 11397 B12R1.382 NCCOc1cccc(CO)c1 Amb18182646 [0,2,0,0,0,0|1,0,0]=3 11398 B12R1.382 NCc1cccc(NCCF)c1 Amb28208771 [0,2,0,0,0,0|2,0,0]=4 11399 B12R1.382 NCc1cccc(OCCF)c1 Amb23580157 [0,2,0,0,0,0|1,0,0]=3 11400 B12R1.382 NCc1ccnc(NCCO)c1 Amb19025121 [0,2,0,0,0,0|2,0,0]=4 11401 B12R1.382 NNc1cc(OCCO)ncn1 Amb28203376 [0,2,0,0,0,0|2,0,0]=4 11402 B12R1.382 NNc1cc(SCCO)ccn1 Amb28046619 [0,2,0,0,0,0|1,1,0]=4 11403 B12R1.382 O=Cc1cccc(C#CCO)c1 Amb836607 [0,2,0,0,0,0|1,0,1]=4 11404 B12R1.382 O=Cc1cccc(OCCBr)c1 Amb535884 [0,2,0,0,0,0|1,0,0]=3 11405 B12R1.382 O=Cc1cccc(OCCF)c1 Amb23579958 [0,2,0,0,0,0|1,0,0]=3 11406 B12R1.382 O=Cc1cccc(OCCO)c1 Amb857578 [0,2,0,0,0,0|0,0,0]=2 11407 B12R1.382 O=Cc1cccc(\C=C\CO)c1 Amb27980713 [0,2,0,0,0,0|1,0,1]=4 11408 B12R1.382 OCC#Cc1cccc(CO)c1 Amb18792414 [0,2,0,0,0,0|1,0,1]=4 11409 B12R1.382 OCCNc1cccc(CO)c1 Amb27178607 [0,2,0,0,0,0|1,0,0]=3 11410 B12R1.382 OCCOc1cccc(CO)c1 Amb6705986 [0,2,0,0,0,0|0,0,0]=2 11411 B12R1.382 OCc1cccc(OCCF)c1 Amb23580003 [0,2,0,0,0,0|1,0,0]=3 11412 B12R1.8 BrCCCCCc1ccccc1 Amb2685449 [0,2,0,0,0,0|2,0,0]=4 11413 B12R1.8 BrCCCCOc1ccccc1 Amb2795770 [0,2,0,0,0,0|1,0,0]=3 11414 B12R1.8 BrCCCCSc1ccccc1 Amb8855496 [0,2,0,0,0,0|1,1,0]=4 11415 B12R1.8 BrCCCOCc1ccccc1 Amb2722973 [0,2,0,0,0,0|1,0,0]=3 11416 B12R1.8 BrCCCSCc1ccccc1 Amb9305027 [0,2,0,0,0,0|1,1,0]=4 11417 B12R1.8 BrCCC\C=C\c1ccccc1 Amb33081215 [0,2,0,0,0,0|2,0,0]=4 11418 B12R1.8 BrCCOCCc1ccccc1 Amb9208563 [0,2,0,0,0,0|1,0,0]=3 11419 B12R1.8 C#CCCC#Cc1ccccc1 Amb8389991 [0,2,0,0,0,0|2,0,0]=4 11420 B12R1.8 C#CCCCCc1ccccc1 Amb18116407 [0,2,0,0,0,0|2,0,0]=4 11421 B12R1.8 C#CCCCNc1ccccc1 Amb28186421 [0,2,0,0,0,0|2,0,0]=4 11422 B12R1.8 C#CCCCOc1ccccc1 Amb32955621 [0,2,0,0,0,0|1,0,0]=3 11423 B12R1.8 C#CCCNCc1ccccc1 Amb26644765 [0,2,0,0,0,0|2,0,0]=4 11424 B12R1.8 C#CCCOCc1ccccc1 Amb27668798 [0,2,0,0,0,0|1,0,0]=3 11425 B12R1.8 C#CCC\C=C\c1ccccc1 Amb33081070 [0,2,0,0,0,0|2,0,0]=4 11426 B12R1.8 C#CCNCCc1ccccc1 Amb5262796 [0,2,0,0,0,0|2,0,0]=4 11427 B12R1.8 C#CCNOCc1ccccc1 Amb25282219 [0,2,0,0,0,0|1,0,1]=4 11428 B12R1.8 C=CCCC#Cc1ccccc1 Amb29867189 [0,2,0,0,0,0|2,0,0]=4 11429 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [0,2,0,0,0,0|2,0,0]=4 11430 B12R1.8 C=CCCNCc1ccccc1 Amb6384625 [0,2,0,0,0,0|2,0,0]=4 11431 B12R1.8 C=CCCOCc1ccccc1 Amb26862285 [0,2,0,0,0,0|1,0,0]=3 11432 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [0,2,0,0,0,0|2,0,0]=4 11433 B12R1.8 C=CCNCCc1ccccc1 Amb6683808 [0,2,0,0,0,0|2,0,0]=4 11434 B12R1.8 C=CCNOCc1ccccc1 Amb27234127 [0,2,0,0,0,0|1,0,1]=4 11435 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [0,2,0,0,0,0|1,0,1]=4 11436 B12R1.8 CC#CCCCc1ccccc1 Amb4035132 [0,2,0,0,0,0|2,0,0]=4 11437 B12R1.8 CC#CCCOc1ccccc1 Amb28319686 [0,2,0,0,0,0|1,0,0]=3 11438 B12R1.8 CCCCCCc1ccccc1 Amb6613187 [0,2,0,0,0,0|2,0,0]=4 11439 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [0,2,0,0,0,0|1,0,0]=3 11440 B12R1.8 CCCCCOc1ccccn1 Amb22546240 [0,2,0,0,0,0|2,0,0]=4 11441 B12R1.8 CCCCNCc1ccccc1 Amb2684625 [0,2,0,0,0,0|2,0,0]=4 11442 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [0,2,0,0,0,0|2,0,0]=4 11443 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [0,2,0,0,0,0|2,0,0]=4 11444 B12R1.8 CCCNCCc1ccccc1 Amb4358610 [0,2,0,0,0,0|2,0,0]=4 11445 B12R1.8 CCCNOCc1ccccc1 Amb26553937 [0,2,0,0,0,0|1,0,0]=3 11446 B12R1.8 CCCOCCc1ccccn1 Amb2694532 [0,2,0,0,0,0|2,0,0]=4 11447 B12R1.8 CCCO\N=C\c1cccnc1 Amb24068837 [0,2,0,0,0,0|2,0,0]=4 11448 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [0,2,0,0,0,0|2,0,0]=4 11449 B12R1.8 CCNCC#Cc1ccccc1 Amb18800149 [0,2,0,0,0,0|2,0,0]=4 11450 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [0,2,0,0,0,0|2,0,0]=4 11451 B12R1.8 CCNCCCc1ccccc1 Amb6247947 [0,2,0,0,0,0|2,0,0]=4 11452 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [0,2,0,0,0,0|1,0,0]=3 11453 B12R1.8 CCNCCOc1ccccc1 Amb6374462 [0,2,0,0,0,0|1,0,0]=3 11454 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [0,2,0,0,0,0|1,1,0]=4 11455 B12R1.8 CCNC\C=C\c1ccccc1 Amb6864716 [0,2,0,0,0,0|2,0,0]=4 11456 B12R1.8 CCNC\C=C\c1ccccc1 Amb837817 [0,2,0,0,0,0|2,0,0]=4 11457 B12R1.8 CCOCOCc1ccccc1 Amb27830530 [0,2,0,0,0,0|1,0,0]=3 11458 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [0,2,0,0,0,0|1,1,0]=4 11459 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [0,2,0,0,0,0|2,0,0]=4 11460 B12R1.8 CNCCCCc1ccccc1 Amb8841760 [0,2,0,0,0,0|2,0,0]=4 11461 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [0,2,0,0,0,0|2,0,0]=4 11462 B12R1.8 CNCCCOc1ccccc1 Amb30982582 [0,2,0,0,0,0|1,0,0]=3 11463 B12R1.8 CNCCCOc1ccccc1 Amb6893131 [0,2,0,0,0,0|1,0,0]=3 11464 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [0,2,0,0,0,0|1,1,0]=4 11465 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [0,2,0,0,0,0|1,1,0]=4 11466 B12R1.8 CNCCNCc1ccccc1 Amb9200691 [0,2,0,0,0,0|2,0,0]=4 11467 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [0,2,0,0,0,0|1,0,0]=3 11468 B12R1.8 CNCCOCc1ccccc1 Amb6374318 [0,2,0,0,0,0|1,0,0]=3 11469 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [0,2,0,0,0,0|1,1,0]=4 11470 B12R1.8 CNCC\C=C\c1ccccc1 Amb32954379 [0,2,0,0,0,0|2,0,0]=4 11471 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|1,0,0]=3 11472 B12R1.8 COCCNCc1ccccc1 Amb33387674 [0,2,0,0,0,0|1,0,0]=3 11473 B12R1.8 COCCNCc1ccccc1 Amb6410960 [0,2,0,0,0,0|1,0,0]=3 11474 B12R1.8 COCCNCc1ccccn1 Amb1663439 [0,2,0,0,0,0|2,0,0]=4 11475 B12R1.8 COCCNCc1ccccn1 Amb17622505 [0,2,0,0,0,0|2,0,0]=4 11476 B12R1.8 COCCNCc1cccnc1 Amb2592096 [0,2,0,0,0,0|2,0,0]=4 11477 B12R1.8 COCCNCc1cccnc1 Amb6865386 [0,2,0,0,0,0|2,0,0]=4 11478 B12R1.8 COCCNCc1ccncc1 Amb2592093 [0,2,0,0,0,0|2,0,0]=4 11479 B12R1.8 COCCNCc1ccncc1 Amb6865384 [0,2,0,0,0,0|2,0,0]=4 11480 B12R1.8 COCCOCc1ccccc1 Amb27467682 [0,2,0,0,0,0|0,0,0]=2 11481 B12R1.8 CONCCCc1ccccc1 Amb32411014 [0,2,0,0,0,0|1,0,0]=3 11482 B12R1.8 C\C=C\CCNc1ccccc1 Amb28119164 [0,2,0,0,0,0|2,0,0]=4 11483 B12R1.8 ClCC#CCCc1ccccc1 Amb27758730 [0,2,0,0,0,0|2,0,0]=4 11484 B12R1.8 ClCC#CCSc1ccccc1 Amb27657584 [0,2,0,0,0,0|1,1,0]=4 11485 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [0,2,0,0,0,0|2,0,0]=4 11486 B12R1.8 ClCCCCOc1ccccc1 Amb3940274 [0,2,0,0,0,0|1,0,0]=3 11487 B12R1.8 ClCCCCSc1ccccc1 Amb18331364 [0,2,0,0,0,0|1,1,0]=4 11488 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [0,2,0,0,0,0|2,0,0]=4 11489 B12R1.8 ClCCCNCc1ccccc1 Amb27857637 [0,2,0,0,0,0|2,0,0]=4 11490 B12R1.8 ClCCCOCc1ccccc1 Amb6255314 [0,2,0,0,0,0|1,0,0]=3 11491 B12R1.8 ClCCN=C=Nc1ccccc1 Amb27454840 [0,2,0,0,0,0|2,0,0]=4 11492 B12R1.8 ClCCNOCc1ccccc1 Amb27659332 [0,2,0,0,0,0|1,0,0]=3 11493 B12R1.8 ClCOCOCc1ccccc1 Amb27444693 [0,2,0,0,0,0|1,0,0]=3 11494 B12R1.8 ClC\C=C\CNc1ccccc1 Amb27806651 [0,2,0,0,0,0|2,0,0]=4 11495 B12R1.8 FCCCNCc1ccccc1 Amb27172983 [0,2,0,0,0,0|2,0,0]=4 11496 B12R1.8 FCCN\C=N\c1ccccc1 Amb26869476 [0,2,0,0,0,0|2,0,0]=4 11497 B12R1.8 ICCCCCc1ccccc1 Amb32411025 [0,2,0,0,0,0|2,0,0]=4 11498 B12R1.8 ICCCOCc1ccccc1 Amb26539397 [0,2,0,0,0,0|1,0,0]=3 11499 B12R1.8 N#CCCCCc1ccccc1 Amb8392139 [0,2,0,0,0,0|2,0,0]=4 11500 B12R1.8 N#CCCCOc1ccccc1 Amb446865 [0,2,0,0,0,0|1,0,0]=3 11501 B12R1.8 N#CCCCOc1ccccn1 Amb19374567 [0,2,0,0,0,0|2,0,0]=4 11502 B12R1.8 N#CCCNCc1ccccc1 Amb4244013 [0,2,0,0,0,0|2,0,0]=4 11503 B12R1.8 N#CCCNCc1ccccc1 Amb575385 [0,2,0,0,0,0|2,0,0]=4 11504 B12R1.8 N#CCCNNc1ccccc1 Amb17594020 [0,2,0,0,0,0|2,0,0]=4 11505 B12R1.8 N#CCCOCc1ccccc1 Amb6257990 [0,2,0,0,0,0|1,0,0]=3 11506 B12R1.8 N#CCCSCc1ccccc1 Amb4010928 [0,2,0,0,0,0|1,1,0]=4 11507 B12R1.8 N#CCC\C=C\c1ccccc1 Amb33081785 [0,2,0,0,0,0|2,0,0]=4 11508 B12R1.8 N#CCNCCc1ccccc1 Amb6711714 [0,2,0,0,0,0|2,0,0]=4 11509 B12R1.8 N#CCOCCc1ccccc1 Amb3992260 [0,2,0,0,0,0|1,0,1]=4 11510 B12R1.8 NCC#CCOc1ccccc1 Amb27165675 [0,2,0,0,0,0|1,0,0]=3 11511 B12R1.8 NCC#CCSc1ccccc1 Amb27865516 [0,2,0,0,0,0|1,1,0]=4 11512 B12R1.8 NCCC#CCc1ccccc1 Amb27640004 [0,2,0,0,0,0|2,0,0]=4 11513 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [0,2,0,0,0,0|2,0,0]=4 11514 B12R1.8 NCCCCOc1ccccc1 Amb482499 [0,2,0,0,0,0|1,0,0]=3 11515 B12R1.8 NCCCCOc1ccccc1 Amb9677454 [0,2,0,0,0,0|1,0,0]=3 11516 B12R1.8 NCCCCOc1cccnc1 Amb9392841 [0,2,0,0,0,0|2,0,0]=4 11517 B12R1.8 NCCCCSc1ccccc1 Amb32662392 [0,2,0,0,0,0|1,1,0]=4 11518 B12R1.8 NCCCCSc1ccccc1 Amb9391586 [0,2,0,0,0,0|1,1,0]=4 11519 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [0,2,0,0,0,0|2,0,0]=4 11520 B12R1.8 NCCCNCc1ccccc1 Amb6774034 [0,2,0,0,0,0|2,0,0]=4 11521 B12R1.8 NCCCOCc1ccccc1 Amb1217769 [0,2,0,0,0,0|1,0,0]=3 11522 B12R1.8 NCCCSCc1ccccc1 Amb6265633 [0,2,0,0,0,0|1,1,0]=4 11523 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [0,2,0,0,0,0|2,0,0]=4 11524 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,2,0,0,0,0|2,0,0]=4 11525 B12R1.8 NCCNOCc1ccccc1 Amb26336084 [0,2,0,0,0,0|1,0,0]=3 11526 B12R1.8 NCCNOCc1ccccc1 Amb32645664 [0,2,0,0,0,0|1,0,0]=3 11527 B12R1.8 NCCOCCc1ccccc1 Amb33547794 [0,2,0,0,0,0|1,0,0]=3 11528 B12R1.8 NCCOCCc1ccccc1 Amb7790966 [0,2,0,0,0,0|1,0,0]=3 11529 B12R1.8 NC\C=C\CCc1ccccc1 Amb32951855 [0,2,0,0,0,0|2,0,0]=4 11530 B12R1.8 NC\C=C\COc1ccccc1 Amb32428654 [0,2,0,0,0,0|1,0,0]=3 11531 B12R1.8 NNCCCOc1ccccc1 Amb19373220 [0,2,0,0,0,0|1,0,0]=3 11532 B12R1.8 NNCCCOc1ccccc1 Amb33624816 [0,2,0,0,0,0|1,0,0]=3 11533 B12R1.8 NNCCOCc1ccccc1 Amb27255784 [0,2,0,0,0,0|1,0,0]=3 11534 B12R1.8 NNCCOCc1ccccc1 Amb32668730 [0,2,0,0,0,0|1,0,0]=3 11535 B12R1.8 NOCCOCc1ccccc1 Amb26593148 [0,2,0,0,0,0|0,0,0]=2 11536 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [0,2,0,0,0,0|1,0,0]=3 11537 B12R1.8 O=C=NCCCc1ccccc1 Amb5750728 [0,2,0,0,0,0|1,0,1]=4 11538 B12R1.8 O=C=NCCOc1ccccc1 Amb13783673 [0,2,0,0,0,0|0,0,1]=3 11539 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|1,0,1]=4 11540 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|0,0,1]=3 11541 B12R1.8 O=CCCOCc1ccccc1 Amb8394259 [0,2,0,0,0,0|0,0,1]=3 11542 B12R1.8 O=CCCSCc1ccccc1 Amb18791178 [0,2,0,0,0,0|0,1,1]=4 11543 B12R1.8 O=CCC\C=C\c1ccccc1 Amb18645368 [0,2,0,0,0,0|1,0,1]=4 11544 B12R1.8 O=COC\C=C\c1ccccc1 Amb6357969 [0,2,0,0,0,0|1,0,1]=4 11545 B12R1.8 OCC#CCCc1ccccc1 Amb27853908 [0,2,0,0,0,0|1,0,0]=3 11546 B12R1.8 OCC#CCOc1ccccc1 Amb28244225 [0,2,0,0,0,0|0,0,0]=2 11547 B12R1.8 OCC#C\C=C\c1ccccc1 Amb27977863 [0,2,0,0,0,0|1,0,1]=4 11548 B12R1.8 OCCC#CCc1ccccc1 Amb27981786 [0,2,0,0,0,0|1,0,0]=3 11549 B12R1.8 OCCC#CSc1ccccc1 Amb27615563 [0,2,0,0,0,0|0,1,0]=3 11550 B12R1.8 OCCC=C=Cc1ccccc1 Amb27972290 [0,2,0,0,0,0|1,0,0]=3 11551 B12R1.8 OCCCC#Cc1ccccc1 Amb22730795 [0,2,0,0,0,0|1,0,0]=3 11552 B12R1.8 OCCCCOc1ccccc1 Amb9370678 [0,2,0,0,0,0|0,0,0]=2 11553 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|1,0,0]=3 11554 B12R1.8 OCCCNCc1ccccc1 Amb4017628 [0,2,0,0,0,0|1,0,0]=3 11555 B12R1.8 OCCCNCc1ccccn1 Amb33527209 [0,2,0,0,0,0|2,0,0]=4 11556 B12R1.8 OCCCNCc1cccnc1 Amb2114454 [0,2,0,0,0,0|2,0,0]=4 11557 B12R1.8 OCCCNCc1cccnc1 Amb33527208 [0,2,0,0,0,0|2,0,0]=4 11558 B12R1.8 OCCCNCc1ccncc1 Amb22588118 [0,2,0,0,0,0|2,0,0]=4 11559 B12R1.8 OCCCNCc1ccncc1 Amb6356097 [0,2,0,0,0,0|2,0,0]=4 11560 B12R1.8 OCCCOCc1ccccc1 Amb4035606 [0,2,0,0,0,0|0,0,0]=2 11561 B12R1.8 OCCCSCc1ccccc1 Amb6359471 [0,2,0,0,0,0|0,1,0]=3 11562 B12R1.8 OCCC\C=C\c1ccccc1 Amb33082089 [0,2,0,0,0,0|1,0,0]=3 11563 B12R1.8 OCCNCCc1ccccc1 Amb6711760 [0,2,0,0,0,0|1,0,0]=3 11564 B12R1.8 OCCNCCc1ccncc1 Amb1028249 [0,2,0,0,0,0|2,0,0]=4 11565 B12R1.8 OCCNOCc1ccccc1 Amb27658441 [0,2,0,0,0,0|0,0,0]=2 11566 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|1,0,0]=3 11567 B12R1.8 OCCOCCc1ccccc1 Amb18801040 [0,2,0,0,0,0|0,0,0]=2 11568 B12R1.8 OCCSCCc1ccccn1 Amb10608714 [0,2,0,0,0,0|1,1,0]=4 11569 B12R1.8 OCCSCCc1ccncc1 Amb8503796 [0,2,0,0,0,0|1,1,0]=4 11570 B12R1.8 OCOCOCc1ccccc1 Amb25803238 [0,2,0,0,0,0|0,0,0]=2 11571 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|1,0,1]=4 11572 B12R1.8 OC\C=C\C=C\c1ccccc1 Amb33081530 [0,2,0,0,0,0|1,0,1]=4 11573 B12R1.8 OC\C=C\CCc1ccccc1 Amb33082995 [0,2,0,0,0,0|1,0,0]=3 11574 B12R1.8 ONCCCCc1ccccc1 Amb32679349 [0,2,0,0,0,0|1,0,0]=3 11575 B12R1.8 ONCCCCc1ccccc1 Amb32679459 [0,2,0,0,0,0|1,0,0]=3 11576 B12R1.8 O\C=C/NCCc1ccccc1 Amb27975397 [0,2,0,0,0,0|1,0,1]=4 11577 B12R1.8 S=C=NCCCc1ccccc1 Amb5750753 [0,2,0,0,0,0|1,1,0]=4 11578 B12R1.8 S=C=NCCOc1ccccc1 Amb17233560 [0,2,0,0,0,0|0,1,0]=3 11579 B12R1.8 S=C=NCCSc1ccccc1 Amb2371165 [0,2,0,0,0,0|0,2,0]=4 11580 B12R1.8 SCCC\C=C\c1ccccc1 Amb33081102 [0,2,0,0,0,0|1,1,0]=4 11581 B12R1.8 [C-]#[N+]CCCCc1ccccc1 Amb2690273 [0,2,0,0,0,0|2,0,0]=4 11582 B12R1.8 [C-]#[N+]CCCOc1ccccc1 Amb33080522 [0,2,0,0,0,0|1,0,0]=3 11583 B12R1.8 [C-]#[N+]CC\C=C\c1ccccc1 Amb33081344 [0,2,0,0,0,0|2,0,0]=4 11584 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [0,2,0,0,0,0|2,0,0]=4 11585 B12R1.8 [N-]=[N+]=NCCOc1ccccc1 Amb18788168 [0,2,0,0,0,0|1,0,0]=3 11586 B12R1.8 [N-]=[N+]=NCOCc1ccccc1 Amb27863974 [0,2,0,0,0,0|2,0,0]=4 11587 B12R1.27 C#CC(C)CCc1ccccc1 Amb32951850 [0,2,0,0,0,0|2,0,0]=4 11588 B12R1.27 C#CC(O)C#Cc1ccccc1 Amb24544056 [0,2,0,0,0,0|1,0,1]=4 11589 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [0,2,0,0,0,0|1,0,0]=3 11590 B12R1.27 C#CC(O)CCc1ccccn1 Amb27651050 [0,2,0,0,0,0|2,0,0]=4 11591 B12R1.27 C#CC(O)CCc1cccnc1 Amb27760989 [0,2,0,0,0,0|2,0,0]=4 11592 B12R1.27 C#CC(O)CCc1ccncc1 Amb28063323 [0,2,0,0,0,0|2,0,0]=4 11593 B12R1.27 C#CC(O)CNc1ccccc1 Amb29875227 [0,2,0,0,0,0|1,0,0]=3 11594 B12R1.27 C#CC(O)\C=C\c1ccccc1 Amb3354803 [0,2,0,0,0,0|1,0,1]=4 11595 B12R1.27 C#C[C@H](O)COc1ccccc1 Amb27394834 [0,2,0,0,0,0|0,0,0]=2 11596 B12R1.27 C#C[C@H](O)\C=C\c1ccccc1 Amb28127146 [0,2,0,0,0,0|1,0,1]=4 11597 B12R1.27 C=C(CBr)CCc1ccccc1 Amb32951881 [0,2,0,0,0,0|2,0,0]=4 11598 B12R1.27 C=C(CCl)CCc1ccccc1 Amb32951884 [0,2,0,0,0,0|2,0,0]=4 11599 B12R1.27 C=C(CCl)CNc1ccccc1 Amb28245221 [0,2,0,0,0,0|2,0,0]=4 11600 B12R1.27 C=C(CN)CCc1ccccc1 Amb32954092 [0,2,0,0,0,0|2,0,0]=4 11601 B12R1.27 C=CC(O)CCc1ccccc1 Amb33082669 [0,2,0,0,0,0|1,0,0]=3 11602 B12R1.27 C=CC(O)\C=C\c1ccccc1 Amb27478521 [0,2,0,0,0,0|1,0,1]=4 11603 B12R1.27 C=C[C@H](O)C#Cc1ccccc1 Amb27660912 [0,2,0,0,0,0|1,0,1]=4 11604 B12R1.27 CC(C#N)CCc1ccccc1 Amb8950031 [0,2,0,0,0,0|2,0,0]=4 11605 B12R1.27 CC(C#N)CNc1ccccc1 Amb8867341 [0,2,0,0,0,0|2,0,0]=4 11606 B12R1.27 CC(C#N)COc1ccccc1 Amb9028581 [0,2,0,0,0,0|1,0,0]=3 11607 B12R1.27 CC(C#N)CSc1ccccc1 Amb4014426 [0,2,0,0,0,0|1,1,0]=4 11608 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [0,2,0,0,0,0|1,0,1]=4 11609 B12R1.27 CC(C=O)CCc1ccccc1 Amb4358580 [0,2,0,0,0,0|1,0,1]=4 11610 B12R1.27 CC(C=O)CSc1ccccc1 Amb17594629 [0,2,0,0,0,0|0,1,1]=4 11611 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|0,0,2]=4 11612 B12R1.27 CC(CBr)CCc1ccccc1 Amb32954572 [0,2,0,0,0,0|2,0,0]=4 11613 B12R1.27 CC(CBr)NCc1ccccc1 Amb28318958 [0,2,0,0,0,0|2,0,0]=4 11614 B12R1.27 CC(CCc1ccccc1)ON Amb32951848 [0,2,0,0,0,0|1,0,0]=3 11615 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,2,0,0,0,0|2,0,0]=4 11616 B12R1.27 CC(CN)CCc1ccccc1 Amb4358596 [0,2,0,0,0,0|2,0,0]=4 11617 B12R1.27 CC(CN)COc1ccccc1 Amb9029321 [0,2,0,0,0,0|1,0,0]=3 11618 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,2,0,0,0,0|2,0,0]=4 11619 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [0,2,0,0,0,0|1,0,0]=3 11620 B12R1.27 CC(CN)SCc1ccccc1 Amb19024833 [0,2,0,0,0,0|1,1,0]=4 11621 B12R1.27 CC(CO)CCc1ccccc1 Amb32413001 [0,2,0,0,0,0|1,0,0]=3 11622 B12R1.27 CC(CO)COc1ccccc1 Amb17232599 [0,2,0,0,0,0|0,0,0]=2 11623 B12R1.27 CC(CO)NCc1ccccc1 Amb2697658 [0,2,0,0,0,0|1,0,0]=3 11624 B12R1.27 CC(CO)NCc1ccccn1 Amb9359669 [0,2,0,0,0,0|2,0,0]=4 11625 B12R1.27 CC(CO)NCc1cccnc1 Amb9359842 [0,2,0,0,0,0|2,0,0]=4 11626 B12R1.27 CC(CO)NCc1ccncc1 Amb9359837 [0,2,0,0,0,0|2,0,0]=4 11627 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,2,0,0,0,0|0,0,0]=2 11628 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [0,2,0,0,0,0|1,0,0]=3 11629 B12R1.27 CC(COc1ccccc1)NN Amb33552558 [0,2,0,0,0,0|1,0,0]=3 11630 B12R1.27 CC(CS)NCc1ccccc1 Amb27606358 [0,2,0,0,0,0|1,1,0]=4 11631 B12R1.27 CC(\C=C\c1ccccc1)CBr Amb33080770 [0,2,0,0,0,0|2,0,0]=4 11632 B12R1.27 CC(\C=C\c1ccccc1)CN Amb33081132 [0,2,0,0,0,0|2,0,0]=4 11633 B12R1.27 CC(\C=C\c1ccccc1)ON Amb33080788 [0,2,0,0,0,0|1,0,1]=4 11634 B12R1.27 CC(\C=N\c1ccccc1)CO Amb20248421 [0,2,0,0,0,0|1,0,0]=3 11635 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [0,2,0,0,0,0|2,0,0]=4 11636 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [0,2,0,0,0,0|2,0,0]=4 11637 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [0,2,0,0,0,0|1,1,0]=4 11638 B12R1.27 CCC(=O)NOc1ccccc1 Amb27827163 [0,2,0,0,0,0|1,0,1]=4 11639 B12R1.27 CCC(=O)OCc1ccccc1 Amb6357157 [0,2,0,0,0,0|1,0,1]=4 11640 B12R1.27 CCC(=S)OCc1ccccc1 Amb28078330 [0,2,0,0,0,0|1,0,1]=4 11641 B12R1.27 CCC(C)NCc1ccccc1 Amb5729099 [0,2,0,0,0,0|2,0,0]=4 11642 B12R1.27 CCC(C)NCc1ccccc1 Amb837601 [0,2,0,0,0,0|2,0,0]=4 11643 B12R1.27 CCC(N)C#Cc1ccccc1 Amb27401916 [0,2,0,0,0,0|2,0,0]=4 11644 B12R1.27 CCC(N)CCc1ccccc1 Amb9031865 [0,2,0,0,0,0|2,0,0]=4 11645 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,2,0,0,0,0|2,0,0]=4 11646 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [0,2,0,0,0,0|1,0,0]=3 11647 B12R1.27 CCC(N)COc1ccccn1 Amb22522748 [0,2,0,0,0,0|2,0,0]=4 11648 B12R1.27 CCC(N)CSc1ccccc1 Amb17485970 [0,2,0,0,0,0|1,1,0]=4 11649 B12R1.27 CCC(O)C#Cc1ccccc1 Amb2721621 [0,2,0,0,0,0|1,0,1]=4 11650 B12R1.27 CCC(O)CCc1ccccc1 Amb17138574 [0,2,0,0,0,0|1,0,0]=3 11651 B12R1.27 CCC(O)CCc1cccnc1 Amb30584931 [0,2,0,0,0,0|2,0,0]=4 11652 B12R1.27 CCC(O)CNc1ccccc1 Amb13952005 [0,2,0,0,0,0|1,0,0]=3 11653 B12R1.27 CCC(O)CNc1ccncc1 Amb27595133 [0,2,0,0,0,0|2,0,0]=4 11654 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [0,2,0,0,0,0|1,0,1]=4 11655 B12R1.27 CC[C@@H](C)NCc1ccccc1 Amb28283155 [0,2,0,0,0,0|2,0,0]=4 11656 B12R1.27 CC[C@@H](O)CNc1ccccc1 Amb27793988 [0,2,0,0,0,0|1,0,0]=3 11657 B12R1.27 CC[C@H](N)C#Cc1ccccc1 Amb28076758 [0,2,0,0,0,0|2,0,0]=4 11658 B12R1.27 CC[C@H](N)CNc1ccccc1 Amb27965358 [0,2,0,0,0,0|2,0,0]=4 11659 B12R1.27 CC[C@H](O)CNc1ccccc1 Amb28071833 [0,2,0,0,0,0|1,0,0]=3 11660 B12R1.27 CC[C@H](O)\C=C\c1ccccc1 Amb27205385 [0,2,0,0,0,0|1,0,1]=4 11661 B12R1.27 CNC(C)CCc1ccccc1 Amb1138722 [0,2,0,0,0,0|2,0,0]=4 11662 B12R1.27 CNC(C)CSc1ccccc1 Amb32663529 [0,2,0,0,0,0|1,1,0]=4 11663 B12R1.27 CNC(C)CSc1ccccc1 Amb32664540 [0,2,0,0,0,0|1,1,0]=4 11664 B12R1.27 CN[C@H](C)CNc1ccccc1 Amb28076762 [0,2,0,0,0,0|2,0,0]=4 11665 B12R1.27 COC(=N)CSc1ccccc1 Amb29847972 [0,2,0,0,0,0|0,1,1]=4 11666 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [0,2,0,0,0,0|1,0,1]=4 11667 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [0,2,0,0,0,0|1,0,1]=4 11668 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [0,2,0,0,0,0|1,0,1]=4 11669 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [0,2,0,0,0,0|0,0,1]=3 11670 B12R1.27 COC(=O)COc1ccccn1 Amb24095859 [0,2,0,0,0,0|1,0,1]=4 11671 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [0,2,0,0,0,0|0,1,1]=4 11672 B12R1.27 COC(C)CNc1ccncc1 Amb27748266 [0,2,0,0,0,0|2,0,0]=4 11673 B12R1.27 COC(Cl)\C=C\c1ccccc1 Amb26371733 [0,2,0,0,0,0|1,0,1]=4 11674 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,2,0,0,0,0|1,1,0]=4 11675 B12R1.27 C[C@@H](C=O)OCc1ccccc1 Amb17609288 [0,2,0,0,0,0|0,0,2]=4 11676 B12R1.27 C[C@@H](CF)NCc1ccccc1 Amb28145925 [0,2,0,0,0,0|2,0,0]=4 11677 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,2,0,0,0,0|2,0,0]=4 11678 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|1,0,0]=3 11679 B12R1.27 C[C@@H](CO)OCc1ccccc1 Amb17609287 [0,2,0,0,0,0|0,0,0]=2 11680 B12R1.27 C[C@@H](CO)\N=C\c1ccccc1 Amb28190372 [0,2,0,0,0,0|1,0,0]=3 11681 B12R1.27 C[C@@H](\C=C\c1ccccc1)CO Amb27642008 [0,2,0,0,0,0|1,0,0]=3 11682 B12R1.27 C[C@H](C=O)ONc1ccccc1 Amb28239490 [0,2,0,0,0,0|0,0,2]=4 11683 B12R1.27 C[C@H](CF)NCc1ccccc1 Amb28066677 [0,2,0,0,0,0|2,0,0]=4 11684 B12R1.27 C[C@H](CN)NCc1ccccc1 Amb25861224 [0,2,0,0,0,0|2,0,0]=4 11685 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|1,0,0]=3 11686 B12R1.27 C\C(=C\Cc1ccccc1)CO Amb17594048 [0,2,0,0,0,0|1,0,1]=4 11687 B12R1.27 C\C(COc1ccccc1)=N\N Amb35672409 [0,2,0,0,0,0|1,0,1]=4 11688 B12R1.27 C\C(COc1ccccc1)=N\O Amb35672643 [0,2,0,0,0,0|0,0,1]=3 11689 B12R1.27 ClCC(Cl)\C=C\c1ccccc1 Amb25124868 [0,2,0,0,0,0|2,0,0]=4 11690 B12R1.27 Cl\C=C(\Cl)COc1ccccc1 Amb27228628 [0,2,0,0,0,0|1,0,1]=4 11691 B12R1.27 N#CC(Br)CCc1ccccc1 Amb26518843 [0,2,0,0,0,0|2,0,0]=4 11692 B12R1.27 N#CC(N)CCc1ccccc1 Amb18999188 [0,2,0,0,0,0|2,0,0]=4 11693 B12R1.27 N#CC(N)COc1ccccc1 Amb17076555 [0,2,0,0,0,0|1,0,0]=3 11694 B12R1.27 N#CC(O)\C=C\c1ccccc1 Amb28208386 [0,2,0,0,0,0|1,0,1]=4 11695 B12R1.27 N#C[C@@H](O)COc1ccccc1 Amb24474239 [0,2,0,0,0,0|0,0,0]=2 11696 B12R1.27 N#C[C@H](O)COc1ccccc1 Amb28461129 [0,2,0,0,0,0|0,0,0]=2 11697 B12R1.27 N=C(CO)OCc1ccccc1 Amb27598593 [0,2,0,0,0,0|0,0,1]=3 11698 B12R1.27 NC(CO)CCc1ccccc1 Amb18315307 [0,2,0,0,0,0|1,0,0]=3 11699 B12R1.27 NC(CO)CCc1ccccc1 Amb32753518 [0,2,0,0,0,0|1,0,0]=3 11700 B12R1.27 NC(CO)CCc1ccccn1 Amb18563729 [0,2,0,0,0,0|2,0,0]=4 11701 B12R1.27 NC(CO)CCc1cccnc1 Amb18563730 [0,2,0,0,0,0|2,0,0]=4 11702 B12R1.27 NC(CO)CCc1ccncc1 Amb18563732 [0,2,0,0,0,0|2,0,0]=4 11703 B12R1.27 NC(CO)CNc1ccccn1 Amb28194944 [0,2,0,0,0,0|2,0,0]=4 11704 B12R1.27 NC(CO)COc1ccccc1 Amb18563798 [0,2,0,0,0,0|0,0,0]=2 11705 B12R1.27 NC(\C=C\c1ccccc1)CO Amb32954713 [0,2,0,0,0,0|1,0,0]=3 11706 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|2,0,0]=4 11707 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [0,2,0,0,0,0|2,0,0]=4 11708 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,2,0,0,0,0|1,0,1]=4 11709 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,2,0,0,0,0|1,0,1]=4 11710 B12R1.27 NCC(Cl)\C=C\c1ccccc1 Amb27447294 [0,2,0,0,0,0|2,0,0]=4 11711 B12R1.27 NCC(F)CCc1ccccc1 Amb32953336 [0,2,0,0,0,0|2,0,0]=4 11712 B12R1.27 NCC(F)\C=C\c1ccccc1 Amb33081747 [0,2,0,0,0,0|2,0,0]=4 11713 B12R1.27 NCC(O)CCc1ccccc1 Amb18315280 [0,2,0,0,0,0|1,0,0]=3 11714 B12R1.27 NCC(O)CNc1ccccc1 Amb17138613 [0,2,0,0,0,0|1,0,0]=3 11715 B12R1.27 NCC(O)COc1ccccc1 Amb6365926 [0,2,0,0,0,0|0,0,0]=2 11716 B12R1.27 NCC(O)COc1ccccc1 Amb9710900 [0,2,0,0,0,0|0,0,0]=2 11717 B12R1.27 NCC(O)CSc1ccccc1 Amb6678669 [0,2,0,0,0,0|0,1,0]=3 11718 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb32953205 [0,2,0,0,0,0|1,0,1]=4 11719 B12R1.27 NC[C@@H](O)CCc1ccccc1 Amb32952383 [0,2,0,0,0,0|1,0,0]=3 11720 B12R1.27 NC[C@@H](O)COc1ccccc1 Amb22747719 [0,2,0,0,0,0|0,0,0]=2 11721 B12R1.27 NC[C@@H](O)\C=C\c1ccccc1 Amb33080765 [0,2,0,0,0,0|1,0,1]=4 11722 B12R1.27 NC[C@H](O)CCc1ccccc1 Amb33081741 [0,2,0,0,0,0|1,0,0]=3 11723 B12R1.27 NC[C@H](O)\C=C\c1ccccc1 Amb33080762 [0,2,0,0,0,0|1,0,1]=4 11724 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [0,2,0,0,0,0|0,0,2]=4 11725 B12R1.27 N[C@@H](CO)CCc1ccccc1 Amb32683468 [0,2,0,0,0,0|1,0,0]=3 11726 B12R1.27 N[C@@H](CO)CCc1ccccc1 Amb6308799 [0,2,0,0,0,0|1,0,0]=3 11727 B12R1.27 N[C@@H](CO)CNc1ccccc1 Amb27233028 [0,2,0,0,0,0|1,0,0]=3 11728 B12R1.27 N[C@@H](\C=C\c1ccccc1)CO Amb33081817 [0,2,0,0,0,0|1,0,0]=3 11729 B12R1.27 N[C@H](CO)CCc1ccccc1 Amb32683465 [0,2,0,0,0,0|1,0,0]=3 11730 B12R1.27 N[C@H](CO)CCc1ccccc1 Amb32683466 [0,2,0,0,0,0|1,0,0]=3 11731 B12R1.27 N[C@H](CO)OCc1ccccc1 Amb27633618 [0,2,0,0,0,0|0,0,0]=2 11732 B12R1.27 N[C@H](\C=C\c1ccccc1)CO Amb32953226 [0,2,0,0,0,0|1,0,0]=3 11733 B12R1.27 N\C(CCc1ccccc1)=N/O Amb1115853 [0,2,0,0,0,0|1,0,1]=4 11734 B12R1.27 N\C(CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|1,0,1]=4 11735 B12R1.27 N\C(COc1ccccc1)=N/O Amb6666310 [0,2,0,0,0,0|0,0,1]=3 11736 B12R1.27 N\C(CSc1ccccc1)=N/O Amb6677887 [0,2,0,0,0,0|0,1,1]=4 11737 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|2,0,0]=4 11738 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|1,0,0]=3 11739 B12R1.27 O=C(CBr)OCc1ccccc1 Amb2720586 [0,2,0,0,0,0|1,0,1]=4 11740 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [0,2,0,0,0,0|1,0,1]=4 11741 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|2,0,0]=4 11742 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|1,0,0]=3 11743 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [0,2,0,0,0,0|1,1,0]=4 11744 B12R1.27 O=C(CCl)OCc1ccccc1 Amb844249 [0,2,0,0,0,0|1,0,1]=4 11745 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,2,0,0,0,0|1,0,1]=4 11746 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|1,0,0]=3 11747 B12R1.27 O=C(CO)CCc1ccccn1 Amb18563673 [0,2,0,0,0,0|2,0,0]=4 11748 B12R1.27 O=C(CO)CCc1cccnc1 Amb18563674 [0,2,0,0,0,0|2,0,0]=4 11749 B12R1.27 O=C(CO)CCc1ccncc1 Amb18563675 [0,2,0,0,0,0|2,0,0]=4 11750 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|0,0,0]=2 11751 B12R1.27 O=C(CO)NCc1ccccc1 Amb1111331 [0,2,0,0,0,0|1,0,1]=4 11752 B12R1.27 O=C(CO)NNc1ccccc1 Amb27615381 [0,2,0,0,0,0|1,0,1]=4 11753 B12R1.27 O=C(CO)OCc1ccccc1 Amb3939223 [0,2,0,0,0,0|0,0,1]=3 11754 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [0,2,0,0,0,0|0,0,1]=3 11755 B12R1.27 O=C(COc1cccnc1)NO Amb28043772 [0,2,0,0,0,0|1,0,1]=4 11756 B12R1.27 O=C(CS)OCc1ccccc1 Amb9786411 [0,2,0,0,0,0|0,1,1]=4 11757 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [0,2,0,0,0,0|0,1,1]=4 11758 B12R1.27 O=C(NO)OCc1ccccc1 Amb2445312 [0,2,0,0,0,0|1,0,1]=4 11759 B12R1.27 OC(C#Cc1ccccc1)CCl Amb27592094 [0,2,0,0,0,0|1,0,1]=4 11760 B12R1.27 OC(C#Cc1ccccc1)CS Amb27664289 [0,2,0,0,0,0|1,0,1]=4 11761 B12R1.27 OC(CBr)CCc1ccccc1 Amb32951853 [0,2,0,0,0,0|1,0,0]=3 11762 B12R1.27 OC(CCl)CCc1ccccc1 Amb32954413 [0,2,0,0,0,0|1,0,0]=3 11763 B12R1.27 OC(CCl)CNc1ccccc1 Amb10565986 [0,2,0,0,0,0|1,0,0]=3 11764 B12R1.27 OC(CCl)COc1ccccc1 Amb9787566 [0,2,0,0,0,0|0,0,0]=2 11765 B12R1.27 OC(CCl)CSc1ccccc1 Amb32421552 [0,2,0,0,0,0|0,1,0]=3 11766 B12R1.27 OC(CF)CCc1ccccc1 Amb32954420 [0,2,0,0,0,0|1,0,0]=3 11767 B12R1.27 OC(CF)CNc1ccccc1 Amb26517065 [0,2,0,0,0,0|1,0,0]=3 11768 B12R1.27 OC(CF)COc1ccccc1 Amb32661710 [0,2,0,0,0,0|0,0,0]=2 11769 B12R1.27 OC(CF)CSc1ccccn1 Amb33495211 [0,2,0,0,0,0|1,1,0]=4 11770 B12R1.27 OC(CF)CSc1ccncc1 Amb33495210 [0,2,0,0,0,0|1,1,0]=4 11771 B12R1.27 OC(\C=C\c1ccccc1)CBr Amb33080783 [0,2,0,0,0,0|1,0,1]=4 11772 B12R1.27 OC(\C=C\c1ccccc1)CCl Amb26527861 [0,2,0,0,0,0|1,0,1]=4 11773 B12R1.27 OC(\C=C\c1ccccc1)CF Amb32953290 [0,2,0,0,0,0|1,0,1]=4 11774 B12R1.27 OCC(=S)OCc1ccccc1 Amb27835138 [0,2,0,0,0,0|0,0,1]=3 11775 B12R1.27 OCC(F)COc1ccccc1 Amb32661700 [0,2,0,0,0,0|0,0,0]=2 11776 B12R1.27 OCC(F)\C=C\c1ccccc1 Amb27593937 [0,2,0,0,0,0|1,0,0]=3 11777 B12R1.27 OCC(O)CCc1ccccc1 Amb17508778 [0,2,0,0,0,0|1,0,0]=3 11778 B12R1.27 OCC(O)CNc1ccccn1 Amb27265848 [0,2,0,0,0,0|2,0,0]=4 11779 B12R1.27 OCC(O)COc1ccccc1 Amb532993 [0,2,0,0,0,0|0,0,0]=2 11780 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb32953203 [0,2,0,0,0,0|1,0,0]=3 11781 B12R1.27 OC[C@@H](O)COc1ccccc1 Amb30621933 [0,2,0,0,0,0|0,0,0]=2 11782 B12R1.27 OC[C@@H](O)OCc1ccccc1 Amb28065346 [0,2,0,0,0,0|0,0,0]=2 11783 B12R1.27 OC[C@H](O)CNc1ccccc1 Amb27238799 [0,2,0,0,0,0|1,0,0]=3 11784 B12R1.27 OC[C@H](O)COc1ccccc1 Amb10982588 [0,2,0,0,0,0|0,0,0]=2 11785 B12R1.27 OC[C@H](O)\C=C\c1ccccc1 Amb28410835 [0,2,0,0,0,0|1,0,0]=3 11786 B12R1.27 O\N=C(/Cl)CCc1ccccc1 Amb32661748 [0,2,0,0,0,0|1,0,1]=4 11787 B12R1.27 [C-]#[N+]C(C)CCc1ccccc1 Amb2689630 [0,2,0,0,0,0|2,0,0]=4 11788 B12R1.27 [C-]#[N+]C(C)COc1ccccc1 Amb28385134 [0,2,0,0,0,0|1,0,0]=3 11789 B12R1.27 [NH3+]CC(=O)OCc1ccccc1 Amb4037912 [0,2,0,0,0,0|1,0,1]=4 11790 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [0,2,0,0,0,0|2,0,0]=4 11791 B12R1.32 C#CCC(N)Cc1ccccc1 Amb32652619 [0,2,0,0,0,0|2,0,0]=4 11792 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,2,0,0,0,0|2,0,0]=4 11793 B12R1.32 C=C(CCN)Cc1ccccc1 Amb32953132 [0,2,0,0,0,0|2,0,0]=4 11794 B12R1.32 C=CCC(C)Nc1ccccc1 Amb27794468 [0,2,0,0,0,0|2,0,0]=4 11795 B12R1.32 C=CCC(N)Cc1ccccc1 Amb32663713 [0,2,0,0,0,0|2,0,0]=4 11796 B12R1.32 C=CCC(N)Cc1ccccc1 Amb33538411 [0,2,0,0,0,0|2,0,0]=4 11797 B12R1.32 C=CCC(O)Cc1ccccc1 Amb18177786 [0,2,0,0,0,0|2,0,0]=4 11798 B12R1.32 CC#CC(C)Oc1ccccc1 Amb25964142 [0,2,0,0,0,0|1,0,1]=4 11799 B12R1.32 CC(CC#N)Nc1ccccc1 Amb17138511 [0,2,0,0,0,0|2,0,0]=4 11800 B12R1.32 CC(CC#N)Oc1ccccc1 Amb17232369 [0,2,0,0,0,0|1,0,0]=3 11801 B12R1.32 CC(CCN)Cc1ccccc1 Amb17232439 [0,2,0,0,0,0|2,0,0]=4 11802 B12R1.32 CC(CCN)Oc1ccccc1 Amb17232556 [0,2,0,0,0,0|1,0,0]=3 11803 B12R1.32 CC(CCO)Cc1ccccc1 Amb17232486 [0,2,0,0,0,0|1,0,0]=3 11804 B12R1.32 CC(CCO)Nc1ccccn1 Amb27433290 [0,2,0,0,0,0|2,0,0]=4 11805 B12R1.32 CC(CCO)Oc1ccccc1 Amb17232598 [0,2,0,0,0,0|0,0,0]=2 11806 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,2,0,0,0,0|1,0,0]=3 11807 B12R1.32 CC(CON)Cc1ccccc1 Amb32953166 [0,2,0,0,0,0|1,0,0]=3 11808 B12R1.32 CCCC(=O)Cc1ccccc1 Amb3940679 [0,2,0,0,0,0|2,0,0]=4 11809 B12R1.32 CCCC(=O)Nc1ccccc1 Amb5794989 [0,2,0,0,0,0|2,0,0]=4 11810 B12R1.32 CCCC(=O)Oc1ccccc1 Amb3103918 [0,2,0,0,0,0|1,0,0]=3 11811 B12R1.32 CCCC(C)Nc1ccccc1 Amb6685188 [0,2,0,0,0,0|2,0,0]=4 11812 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,2,0,0,0,0|2,0,0]=4 11813 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [0,2,0,0,0,0|2,0,0]=4 11814 B12R1.32 CCNC(=O)Oc1ccccc1 Amb2732291 [0,2,0,0,0,0|1,0,1]=4 11815 B12R1.32 CCNC(=S)Oc1ccccc1 Amb28077021 [0,2,0,0,0,0|1,0,1]=4 11816 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,2,0,0,0,0|2,0,0]=4 11817 B12R1.32 CC\N=C(\N)Oc1ccccc1 Amb25935972 [0,2,0,0,0,0|1,0,1]=4 11818 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,2,0,0,0,0|2,0,0]=4 11819 B12R1.32 CN(CCBr)Cc1ccccc1 Amb32882453 [0,2,0,0,0,0|2,0,0]=4 11820 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,2,0,0,0,0|2,0,0]=4 11821 B12R1.32 CN(CCCl)Cc1ccccc1 Amb3940690 [0,2,0,0,0,0|2,0,0]=4 11822 B12R1.32 CN(CCN)Cc1ccccc1 Amb5357836 [0,2,0,0,0,0|2,0,0]=4 11823 B12R1.32 CN(CCO)Cc1ccccc1 Amb3938987 [0,2,0,0,0,0|1,0,0]=3 11824 B12R1.32 CN(CCO)Cc1ccccn1 Amb9428674 [0,2,0,0,0,0|2,0,0]=4 11825 B12R1.32 CN(CCO)Cc1cccnc1 Amb9426484 [0,2,0,0,0,0|2,0,0]=4 11826 B12R1.32 CN(CCO)Cc1ccncc1 Amb9256486 [0,2,0,0,0,0|2,0,0]=4 11827 B12R1.32 CN(CCS)Cc1ccccc1 Amb13881720 [0,2,0,0,0,0|1,1,0]=4 11828 B12R1.32 CNCC(C)Cc1ccccc1 Amb19023878 [0,2,0,0,0,0|2,0,0]=4 11829 B12R1.32 CNCC(C)Nc1ccccc1 Amb27955315 [0,2,0,0,0,0|2,0,0]=4 11830 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,2,0,0,0,0|2,0,0]=4 11831 B12R1.32 CNCC(O)Cc1ccccc1 Amb17193901 [0,2,0,0,0,0|2,0,0]=4 11832 B12R1.32 CNCC(O)Cc1ccccc1 Amb32661172 [0,2,0,0,0,0|2,0,0]=4 11833 B12R1.32 COCC(=O)Cc1ccccc1 Amb9665963 [0,2,0,0,0,0|1,0,1]=4 11834 B12R1.32 COCC(=O)Nc1ccccc1 Amb3115714 [0,2,0,0,0,0|1,0,1]=4 11835 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,2,0,0,0,0|1,0,0]=3 11836 B12R1.32 COCC(C)Nc1cccnc1 Amb19024143 [0,2,0,0,0,0|2,0,0]=4 11837 B12R1.32 COCC(C)Nc1ccncc1 Amb6614428 [0,2,0,0,0,0|2,0,0]=4 11838 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,2,0,0,0,0|1,0,0]=3 11839 B12R1.32 COC[C@@H](C)Nc1ccccn1 Amb28398735 [0,2,0,0,0,0|2,0,0]=4 11840 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb3940159 [0,2,0,0,0,0|1,0,0]=3 11841 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb4037107 [0,2,0,0,0,0|1,0,0]=3 11842 B12R1.32 COC[C@H](N)Cc1ccccc1 Amb33871543 [0,2,0,0,0,0|1,0,0]=3 11843 B12R1.32 CONC(C)Cc1ccccc1 Amb28984063 [0,2,0,0,0,0|2,0,0]=4 11844 B12R1.32 C\C(=C/c1ccccc1)CCBr Amb18063581 [0,2,0,0,0,0|2,0,0]=4 11845 B12R1.32 C\C(=C/c1ccccc1)CCN Amb18063553 [0,2,0,0,0,0|2,0,0]=4 11846 B12R1.32 C\C(=C/c1ccccc1)CCO Amb27792195 [0,2,0,0,0,0|1,0,0]=3 11847 B12R1.32 C\C(=C/c1ccccc1)CCS Amb33381247 [0,2,0,0,0,0|1,1,0]=4 11848 B12R1.32 C\C(=C/c1ccccc1)CNO Amb33506732 [0,2,0,0,0,0|1,0,1]=4 11849 B12R1.32 C\C(=C/c1ccccc1)CON Amb33476431 [0,2,0,0,0,0|1,0,1]=4 11850 B12R1.32 C\C(=C\CO)Cc1ccccc1 Amb27852825 [0,2,0,0,0,0|1,0,1]=4 11851 B12R1.32 C\C(=C\c1ccccc1)CCBr Amb27445443 [0,2,0,0,0,0|2,0,0]=4 11852 B12R1.32 C\C(=C\c1ccccc1)CCN Amb27843446 [0,2,0,0,0,0|2,0,0]=4 11853 B12R1.32 N#CCC(=O)Oc1ccccc1 Amb18645449 [0,2,0,0,0,0|1,0,1]=4 11854 B12R1.32 N#CCC(O)Cc1ccccc1 Amb17232368 [0,2,0,0,0,0|2,0,0]=4 11855 B12R1.32 N#CC[C@@H](N)Cc1ccccc1 Amb27251534 [0,2,0,0,0,0|2,0,0]=4 11856 B12R1.32 NC(CCO)Cc1ccccc1 Amb28872403 [0,2,0,0,0,0|1,0,0]=3 11857 B12R1.32 NC(CCO)Cc1ccccc1 Amb8392175 [0,2,0,0,0,0|1,0,0]=3 11858 B12R1.32 NCCC(=O)Cc1ccccc1 Amb32954715 [0,2,0,0,0,0|2,0,0]=4 11859 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|2,0,0]=4 11860 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|2,0,0]=4 11861 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,2,0,0,0,0|1,0,0]=3 11862 B12R1.32 NCCC(=S)Nc1ccccc1 Amb27491751 [0,2,0,0,0,0|2,0,0]=4 11863 B12R1.32 NCCC(F)Cc1ccccc1 Amb32954290 [0,2,0,0,0,0|2,0,0]=4 11864 B12R1.32 NCCC(N)Cc1ccccc1 Amb33039576 [0,2,0,0,0,0|2,0,0]=4 11865 B12R1.32 NCCC(O)Cc1ccccc1 Amb17232552 [0,2,0,0,0,0|2,0,0]=4 11866 B12R1.32 NCCS(=O)Cc1ccccc1 Amb18306046 [0,2,0,0,0,0|1,1,0]=4 11867 B12R1.32 NCC[C@@H](O)Cc1ccccc1 Amb32953160 [0,2,0,0,0,0|2,0,0]=4 11868 B12R1.32 NCC[C@H](O)Cc1ccccc1 Amb32953161 [0,2,0,0,0,0|2,0,0]=4 11869 B12R1.32 NCC\C(Br)=C\c1ccccc1 Amb27770057 [0,2,0,0,0,0|2,0,0]=4 11870 B12R1.32 NCC\C(Cl)=C/c1ccccc1 Amb27881313 [0,2,0,0,0,0|2,0,0]=4 11871 B12R1.32 NCC\C(Cl)=C\c1ccccc1 Amb27843483 [0,2,0,0,0,0|2,0,0]=4 11872 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [0,2,0,0,0,0|0,0,1]=3 11873 B12R1.32 O=C(CCBr)Nc1ccccc1 Amb16191990 [0,2,0,0,0,0|2,0,0]=4 11874 B12R1.32 O=C(CCCl)Nc1ccccc1 Amb6458951 [0,2,0,0,0,0|2,0,0]=4 11875 B12R1.32 O=C(CCCl)Oc1ccccc1 Amb16230794 [0,2,0,0,0,0|1,0,0]=3 11876 B12R1.32 O=C(CCO)Nc1ccccc1 Amb9421562 [0,2,0,0,0,0|1,0,0]=3 11877 B12R1.32 O=C(CCS)Nc1ccccc1 Amb17305724 [0,2,0,0,0,0|1,1,0]=4 11878 B12R1.32 O=C(Cc1ccccc1)NCO Amb2720941 [0,2,0,0,0,0|1,0,1]=4 11879 B12R1.32 O=S(CCCl)Nc1ccccc1 Amb27607773 [0,2,0,0,0,0|1,1,0]=4 11880 B12R1.32 OCNC(=S)Cc1ccccc1 Amb27438465 [0,2,0,0,0,0|1,0,1]=4 11881 B12R1.32 OC\C=C(\Cl)Cc1ccccc1 Amb27841976 [0,2,0,0,0,0|1,0,1]=4 11882 B12R1.32 [C-]#[N+]CC(C)Oc1ccccc1 Amb28251447 [0,2,0,0,0,0|1,0,0]=3 11883 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,2,0,0,0,0|1,0,1]=4 11884 B12R1.252 C=C(C)COCc1ccccc1 Amb28062621 [0,2,0,0,0,0|1,0,1]=4 11885 B12R1.252 CC(=O)CCCc1ccccc1 Amb4358586 [0,2,0,0,0,0|1,0,1]=4 11886 B12R1.252 CC(=O)CCNc1ccccc1 Amb26422328 [0,2,0,0,0,0|1,0,1]=4 11887 B12R1.252 CC(=O)CCOc1ccccc1 Amb7777351 [0,2,0,0,0,0|0,0,1]=3 11888 B12R1.252 CC(=O)CCSc1ccccc1 Amb4020770 [0,2,0,0,0,0|0,1,1]=4 11889 B12R1.252 CC(=O)COCc1ccccc1 Amb3433615 [0,2,0,0,0,0|0,0,2]=4 11890 B12R1.252 CC(=O)CONc1ccccc1 Amb28243855 [0,2,0,0,0,0|0,0,2]=4 11891 B12R1.252 CC(Br)CCCc1ccccc1 Amb32951525 [0,2,0,0,0,0|2,0,0]=4 11892 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [0,2,0,0,0,0|1,1,0]=4 11893 B12R1.252 CC(Br)COCc1ccccc1 Amb27481240 [0,2,0,0,0,0|1,0,0]=3 11894 B12R1.252 CC(Br)C\C=C\c1ccccc1 Amb33080969 [0,2,0,0,0,0|2,0,0]=4 11895 B12R1.252 CC(C)CC#Cc1ccccc1 Amb27494575 [0,2,0,0,0,0|2,0,0]=4 11896 B12R1.252 CC(C)CCNc1ccccc1 Amb4016589 [0,2,0,0,0,0|2,0,0]=4 11897 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [0,2,0,0,0,0|1,0,0]=3 11898 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,2,0,0,0,0|2,0,0]=4 11899 B12R1.252 CC(C)CNCc1ccccc1 Amb6687359 [0,2,0,0,0,0|2,0,0]=4 11900 B12R1.252 CC(C)NCCc1ccccc1 Amb2111109 [0,2,0,0,0,0|2,0,0]=4 11901 B12R1.252 CC(C)NCCc1ccccc1 Amb6246148 [0,2,0,0,0,0|2,0,0]=4 11902 B12R1.252 CC(Cl)CNCc1ccccc1 Amb27656927 [0,2,0,0,0,0|2,0,0]=4 11903 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [0,2,0,0,0,0|2,0,0]=4 11904 B12R1.252 CC(N)CC#Cc1ccccc1 Amb25081198 [0,2,0,0,0,0|2,0,0]=4 11905 B12R1.252 CC(N)CCCc1ccccc1 Amb2721865 [0,2,0,0,0,0|2,0,0]=4 11906 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,2,0,0,0,0|2,0,0]=4 11907 B12R1.252 CC(N)CCOc1ccccc1 Amb7772215 [0,2,0,0,0,0|1,0,0]=3 11908 B12R1.252 CC(N)CCSc1ccccc1 Amb13881552 [0,2,0,0,0,0|1,1,0]=4 11909 B12R1.252 CC(N)COCc1ccccc1 Amb1124568 [0,2,0,0,0,0|1,0,0]=3 11910 B12R1.252 CC(N)CSCc1ccccc1 Amb18648554 [0,2,0,0,0,0|1,1,0]=4 11911 B12R1.252 CC(N)C\C=C\c1ccccc1 Amb25970039 [0,2,0,0,0,0|2,0,0]=4 11912 B12R1.252 CC(O)C#CCc1ccccc1 Amb28350208 [0,2,0,0,0,0|1,0,1]=4 11913 B12R1.252 CC(O)C#CSc1ccccc1 Amb27753084 [0,2,0,0,0,0|0,1,1]=4 11914 B12R1.252 CC(O)CC#Cc1cccnc1 Amb24464546 [0,2,0,0,0,0|2,0,0]=4 11915 B12R1.252 CC(O)CCCc1ccccc1 Amb17138575 [0,2,0,0,0,0|1,0,0]=3 11916 B12R1.252 CC(O)CCCc1cccnc1 Amb22292250 [0,2,0,0,0,0|2,0,0]=4 11917 B12R1.252 CC(O)CCNc1ccncc1 Amb27175757 [0,2,0,0,0,0|2,0,0]=4 11918 B12R1.252 CC(O)CCOc1ccccc1 Amb6298179 [0,2,0,0,0,0|0,0,0]=2 11919 B12R1.252 CC(O)CNCc1ccccc1 Amb837676 [0,2,0,0,0,0|1,0,0]=3 11920 B12R1.252 CC(O)CNCc1ccccn1 Amb5262446 [0,2,0,0,0,0|2,0,0]=4 11921 B12R1.252 CC(O)CNCc1cccnc1 Amb837686 [0,2,0,0,0,0|2,0,0]=4 11922 B12R1.252 CC(O)CNCc1ccncc1 Amb837763 [0,2,0,0,0,0|2,0,0]=4 11923 B12R1.252 CC(O)COCc1ccccc1 Amb4020574 [0,2,0,0,0,0|0,0,0]=2 11924 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb32954303 [0,2,0,0,0,0|1,0,0]=3 11925 B12R1.252 CC(O)C\C=N\c1ccccc1 Amb27948769 [0,2,0,0,0,0|1,0,0]=3 11926 B12R1.252 CC(O)C\N=C\c1cccnc1 Amb27981740 [0,2,0,0,0,0|2,0,0]=4 11927 B12R1.252 CC(O)\C=C\Sc1ccccc1 Amb28294251 [0,2,0,0,0,0|0,1,1]=4 11928 B12R1.252 CC(S)COCc1ccccc1 Amb32788346 [0,2,0,0,0,0|0,1,0]=3 11929 B12R1.252 CN(C)CCCc1ccccc1 Amb1085936 [0,2,0,0,0,0|2,0,0]=4 11930 B12R1.252 CN(C)CCNc1ccccc1 Amb6477740 [0,2,0,0,0,0|2,0,0]=4 11931 B12R1.252 CN(C)CCOc1ccccc1 Amb2876295 [0,2,0,0,0,0|1,0,0]=3 11932 B12R1.252 CN(C)CCOc1ccccn1 Amb24089708 [0,2,0,0,0,0|2,0,0]=4 11933 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [0,2,0,0,0,0|1,0,0]=3 11934 B12R1.252 CN(O)CCCc1ccccc1 Amb32951844 [0,2,0,0,0,0|1,0,0]=3 11935 B12R1.252 CN(O)C\C=C\c1ccccc1 Amb33081135 [0,2,0,0,0,0|1,0,1]=4 11936 B12R1.252 C[C@@H](N)CCCc1ccccc1 Amb33081452 [0,2,0,0,0,0|2,0,0]=4 11937 B12R1.252 C[C@@H](N)CCOc1ccccc1 Amb33081226 [0,2,0,0,0,0|1,0,0]=3 11938 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [0,2,0,0,0,0|1,0,0]=3 11939 B12R1.252 C[C@@H](N)C\C=C\c1ccccc1 Amb33080763 [0,2,0,0,0,0|2,0,0]=4 11940 B12R1.252 C[C@@H](O)CCCc1ccccc1 Amb33082320 [0,2,0,0,0,0|1,0,0]=3 11941 B12R1.252 C[C@@H](O)CCOc1ccccc1 Amb32951805 [0,2,0,0,0,0|0,0,0]=2 11942 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [0,2,0,0,0,0|0,0,0]=2 11943 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb32954522 [0,2,0,0,0,0|1,0,0]=3 11944 B12R1.252 C[C@H](N)CCCc1ccccc1 Amb32954284 [0,2,0,0,0,0|2,0,0]=4 11945 B12R1.252 C[C@H](N)CCOc1ccccc1 Amb32954086 [0,2,0,0,0,0|1,0,0]=3 11946 B12R1.252 C[C@H](N)COCc1ccccc1 Amb17061656 [0,2,0,0,0,0|1,0,0]=3 11947 B12R1.252 C[C@H](N)C\C=C\c1ccccc1 Amb33080767 [0,2,0,0,0,0|2,0,0]=4 11948 B12R1.252 C[C@H](O)CCCc1ccccc1 Amb32954841 [0,2,0,0,0,0|1,0,0]=3 11949 B12R1.252 C[C@H](O)CCOc1ccccc1 Amb32952875 [0,2,0,0,0,0|0,0,0]=2 11950 B12R1.252 C[C@H](O)CNCc1ccccc1 Amb27862492 [0,2,0,0,0,0|1,0,0]=3 11951 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [0,2,0,0,0,0|0,0,0]=2 11952 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb32954836 [0,2,0,0,0,0|1,0,0]=3 11953 B12R1.252 ClC(Cl)=CCOc1ccccc1 Amb29866947 [0,2,0,0,0,0|1,0,1]=4 11954 B12R1.252 FB(F)COCc1ccccc1 Amb27843535 [0,2,0,0,0,0|2,0,0]=4 11955 B12R1.252 FC(Cl)CNCc1ccccc1 Amb27407058 [0,2,0,0,0,0|2,0,0]=4 11956 B12R1.252 FC(F)CNCc1ccccc1 Amb16229911 [0,2,0,0,0,0|2,0,0]=4 11957 B12R1.252 N=C(N)CCCc1ccccc1 Amb6276737 [0,2,0,0,0,0|2,0,0]=4 11958 B12R1.252 N=C(N)CCOc1ccccc1 Amb6279642 [0,2,0,0,0,0|1,0,0]=3 11959 B12R1.252 N=C(N)COCc1ccccc1 Amb6266963 [0,2,0,0,0,0|1,0,1]=4 11960 B12R1.252 N=C(N)COCc1ccccc1 Amb8630424 [0,2,0,0,0,0|1,0,1]=4 11961 B12R1.252 NC(=O)CCCc1ccccc1 Amb3886649 [0,2,0,0,0,0|1,0,1]=4 11962 B12R1.252 NC(=O)CCNc1ccccc1 Amb453169 [0,2,0,0,0,0|1,0,1]=4 11963 B12R1.252 NC(=O)CCOc1ccccc1 Amb8997689 [0,2,0,0,0,0|0,0,1]=3 11964 B12R1.252 NC(=O)CCSc1ccccc1 Amb3836115 [0,2,0,0,0,0|0,1,1]=4 11965 B12R1.252 NC(=O)COCc1ccccc1 Amb8858432 [0,2,0,0,0,0|0,0,2]=4 11966 B12R1.252 NC(=S)CCCc1ccccc1 Amb6244938 [0,2,0,0,0,0|1,1,0]=4 11967 B12R1.252 NC(=S)CCOc1ccccc1 Amb5542247 [0,2,0,0,0,0|0,1,0]=3 11968 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,2,0,0,0,0|0,2,0]=4 11969 B12R1.252 NC(=S)COCc1ccccc1 Amb6276568 [0,2,0,0,0,0|0,1,1]=4 11970 B12R1.252 O=C(Cl)CCCc1ccccc1 Amb2792925 [0,2,0,0,0,0|1,0,1]=4 11971 B12R1.252 O=C(Cl)CCOc1ccccc1 Amb33528394 [0,2,0,0,0,0|0,0,1]=3 11972 B12R1.252 O=C(Cl)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|0,1,1]=4 11973 B12R1.252 O=C(Cl)COCc1ccccc1 Amb3939158 [0,2,0,0,0,0|0,0,2]=4 11974 B12R1.252 O=C(O)CC#Cc1ccccc1 Amb18296382 [0,2,0,0,0,0|1,0,1]=4 11975 B12R1.252 O=C(O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|1,0,0]=3 11976 B12R1.252 O=C(O)CCCc1ccccn1 Amb1099328 [0,2,0,0,0,0|2,0,0]=4 11977 B12R1.252 O=C(O)CCCc1ccccn1 Amb19356883 [0,2,0,0,0,0|2,0,0]=4 11978 B12R1.252 O=C(O)CCCc1cccnc1 Amb17232526 [0,2,0,0,0,0|2,0,0]=4 11979 B12R1.252 O=C(O)CCCc1cccnc1 Amb33529414 [0,2,0,0,0,0|2,0,0]=4 11980 B12R1.252 O=C(O)CCCc1cccnc1 Amb33541549 [0,2,0,0,0,0|2,0,0]=4 11981 B12R1.252 O=C(O)CCCc1ccncc1 Amb1099336 [0,2,0,0,0,0|2,0,0]=4 11982 B12R1.252 O=C(O)CCCc1ccncc1 Amb19929548 [0,2,0,0,0,0|2,0,0]=4 11983 B12R1.252 O=C(O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|1,0,0]=3 11984 B12R1.252 O=C(O)CCNc1ccccn1 Amb10609119 [0,2,0,0,0,0|2,0,0]=4 11985 B12R1.252 O=C(O)CCNc1ccccn1 Amb6258091 [0,2,0,0,0,0|2,0,0]=4 11986 B12R1.252 O=C(O)CCNc1cccnc1 Amb18269696 [0,2,0,0,0,0|2,0,0]=4 11987 B12R1.252 O=C(O)CCNc1ccncc1 Amb33456130 [0,2,0,0,0,0|2,0,0]=4 11988 B12R1.252 O=C(O)CCNc1ccncc1 Amb6280380 [0,2,0,0,0,0|2,0,0]=4 11989 B12R1.252 O=C(O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|0,0,0]=2 11990 B12R1.252 O=C(O)CCOc1cccnc1 Amb33527345 [0,2,0,0,0,0|1,0,0]=3 11991 B12R1.252 O=C(O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|0,1,0]=3 11992 B12R1.252 O=C(O)CCSc1ccccn1 Amb1133894 [0,2,0,0,0,0|1,1,0]=4 11993 B12R1.252 O=C(O)CNCc1ccccc1 Amb2720113 [0,2,0,0,0,0|1,0,1]=4 11994 B12R1.252 O=C(O)CNCc1ccccc1 Amb6357824 [0,2,0,0,0,0|1,0,1]=4 11995 B12R1.252 O=C(O)COCc1ccccc1 Amb3939856 [0,2,0,0,0,0|0,0,1]=3 11996 B12R1.252 O=C(O)COCc1ccccn1 Amb32680346 [0,2,0,0,0,0|1,0,1]=4 11997 B12R1.252 O=C(O)COCc1ccccn1 Amb33548165 [0,2,0,0,0,0|1,0,1]=4 11998 B12R1.252 O=C(O)COCc1cccnc1 Amb28653073 [0,2,0,0,0,0|1,0,1]=4 11999 B12R1.252 O=C(O)COCc1ccncc1 Amb13883046 [0,2,0,0,0,0|1,0,1]=4 12000 B12R1.252 O=C(O)COCc1ccncc1 Amb8010071 [0,2,0,0,0,0|1,0,1]=4 12001 B12R1.252 O=C(O)CSCc1ccccc1 Amb6357378 [0,2,0,0,0,0|0,1,1]=4 12002 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|1,0,1]=4 12003 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb6366026 [0,2,0,0,0,0|1,0,1]=4 12004 B12R1.252 O=C(O)C\C=C\c1ccccc1 Amb6280352 [0,2,0,0,0,0|1,0,1]=4 12005 B12R1.252 O=C(O)C\N=N\c1ccccc1 Amb27863405 [0,2,0,0,0,0|1,0,1]=4 12006 B12R1.252 O=C([O-])CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|1,0,1]=4 12007 B12R1.252 O=C([O-])CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|1,0,1]=4 12008 B12R1.252 O=S([O-])CCCc1ccccc1 Amb32755679 [0,2,0,0,0,0|1,0,1]=4 12009 B12R1.252 O=S([O-])CCOc1ccccc1 Amb32755206 [0,2,0,0,0,0|0,0,1]=3 12010 B12R1.252 O=[PH](O)CNCc1ccccc1 Amb28383469 [0,2,0,0,0,0|2,0,0]=4 12011 B12R1.252 OB(O)C\C=C\c1ccccc1 Amb26916741 [0,2,0,0,0,0|1,0,1]=4 12012 B12R1.43 C=C(Sc1ccccc1)C(C)O Amb27764800 [0,2,0,0,0,0|0,1,1]=4 12013 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [0,2,0,0,0,0|0,0,2]=4 12014 B12R1.43 CC(=O)C(Cl)Oc1ccccc1 Amb27878745 [0,2,0,0,0,0|0,0,2]=4 12015 B12R1.43 CC(C)C(=O)Oc1ccccc1 Amb3129550 [0,2,0,0,0,0|1,0,1]=4 12016 B12R1.43 CC(C)C(C)Nc1ccccc1 Amb6685131 [0,2,0,0,0,0|2,0,0]=4 12017 B12R1.43 CC(C)C(N)Cc1ccccc1 Amb17138565 [0,2,0,0,0,0|2,0,0]=4 12018 B12R1.43 CC(C)C(O)Cc1ccccc1 Amb17138584 [0,2,0,0,0,0|2,0,0]=4 12019 B12R1.43 CC(C)[C@@H](N)Cc1ccccc1 Amb27858881 [0,2,0,0,0,0|2,0,0]=4 12020 B12R1.43 CC(C)[C@@H](O)Cc1ccccc1 Amb28244375 [0,2,0,0,0,0|2,0,0]=4 12021 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 Amb27482555 [0,2,0,0,0,0|2,0,0]=4 12022 B12R1.43 CC(C)[C@H](N)Cc1ccccc1 Amb28127185 [0,2,0,0,0,0|2,0,0]=4 12023 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [0,2,0,0,0,0|1,0,1]=4 12024 B12R1.43 CC(Cl)C(Cl)Cc1ccccc1 Amb27947452 [0,2,0,0,0,0|2,0,0]=4 12025 B12R1.43 CC(Cl)C(Cl)Oc1ccccc1 Amb27882846 [0,2,0,0,0,0|1,0,0]=3 12026 B12R1.43 CC(F)C(N)Cc1ccccc1 Amb27489717 [0,2,0,0,0,0|2,0,0]=4 12027 B12R1.43 CC(N)C(=O)Oc1ccccc1 Amb17334632 [0,2,0,0,0,0|1,0,1]=4 12028 B12R1.43 CC(N)C(C)Nc1ccccc1 Amb18646160 [0,2,0,0,0,0|2,0,0]=4 12029 B12R1.43 CC(N)C(C)Oc1ccccc1 Amb18291409 [0,2,0,0,0,0|1,0,0]=3 12030 B12R1.43 CC(N)C(C)Sc1ccccc1 Amb18648553 [0,2,0,0,0,0|1,1,0]=4 12031 B12R1.43 CC(N)C(N)Cc1ccccc1 Amb28325649 [0,2,0,0,0,0|2,0,0]=4 12032 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,2,0,0,0,0|2,0,0]=4 12033 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb30584971 [0,2,0,0,0,0|2,0,0]=4 12034 B12R1.43 CC(Nc1ccccc1)C(=O)O Amb1213440 [0,2,0,0,0,0|1,0,1]=4 12035 B12R1.43 CC(Nc1ccccc1)C(F)F Amb27615367 [0,2,0,0,0,0|2,0,0]=4 12036 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,2,0,0,0,0|1,0,1]=4 12037 B12R1.43 CC(O)C(=O)Nc1ccccc1 Amb1230509 [0,2,0,0,0,0|1,0,1]=4 12038 B12R1.43 CC(O)C(=O)Sc1ccccc1 Amb27594805 [0,2,0,0,0,0|0,1,1]=4 12039 B12R1.43 CC(O)C(C)Cc1ccccc1 Amb17232485 [0,2,0,0,0,0|1,0,0]=3 12040 B12R1.43 CC(O)C(C)Cc1ccccn1 Amb24341829 [0,2,0,0,0,0|2,0,0]=4 12041 B12R1.43 CC(O)C(C)Cc1cccnc1 Amb27630237 [0,2,0,0,0,0|2,0,0]=4 12042 B12R1.43 CC(O)C(C)Cc1ccncc1 Amb25710238 [0,2,0,0,0,0|2,0,0]=4 12043 B12R1.43 CC(O)C(C)Oc1ccccc1 Amb18801039 [0,2,0,0,0,0|0,0,0]=2 12044 B12R1.43 CC(O)C(C)Sc1ccccc1 Amb27165940 [0,2,0,0,0,0|0,1,0]=3 12045 B12R1.43 CC(O)C(C)Sc1ccccn1 Amb27194272 [0,2,0,0,0,0|1,1,0]=4 12046 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,2,0,0,0,0|1,0,0]=3 12047 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb32661717 [0,2,0,0,0,0|1,0,0]=3 12048 B12R1.43 CC(O)C(O)Cc1ccccn1 Amb28281194 [0,2,0,0,0,0|2,0,0]=4 12049 B12R1.43 CC(O)[C@@H](C)Cc1cccnc1 Amb28455142 [0,2,0,0,0,0|2,0,0]=4 12050 B12R1.43 CC(O)[C@H](C)Cc1ccccc1 Amb27761643 [0,2,0,0,0,0|1,0,0]=3 12051 B12R1.43 CC(Oc1ccccc1)C(=O)Cl Amb3939464 [0,2,0,0,0,0|0,0,2]=4 12052 B12R1.43 CC(Oc1ccccc1)C(=O)O Amb9702438 [0,2,0,0,0,0|0,0,1]=3 12053 B12R1.43 CC(Oc1ccccc1)C(N)=O Amb3886659 [0,2,0,0,0,0|0,0,2]=4 12054 B12R1.43 CC(Oc1ccccc1)C(N)=S Amb17233851 [0,2,0,0,0,0|0,1,1]=4 12055 B12R1.43 CC(Oc1ccccc1)[C@@H](C)N Amb27177950 [0,2,0,0,0,0|1,0,0]=3 12056 B12R1.43 CC(Oc1ccccc1)[C@@H](C)O Amb27238389 [0,2,0,0,0,0|0,0,0]=2 12057 B12R1.43 CC(Oc1ccccc1)[C@H](C)O Amb27876377 [0,2,0,0,0,0|0,0,0]=2 12058 B12R1.43 CC(Oc1ccccn1)C(=O)O Amb26054640 [0,2,0,0,0,0|1,0,1]=4 12059 B12R1.43 CC(Oc1cccnc1)C(=O)O Amb9783585 [0,2,0,0,0,0|1,0,1]=4 12060 B12R1.43 CC(Sc1ccccc1)C(=O)O Amb9745732 [0,2,0,0,0,0|0,1,1]=4 12061 B12R1.43 CN(O)C(=O)Oc1ccccc1 Amb28125844 [0,2,0,0,0,0|1,0,1]=4 12062 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [0,2,0,0,0,0|1,0,1]=4 12063 B12R1.43 C[C@@H](Cl)[C@@H](C)Sc1ccccc1 Amb27947490 [0,2,0,0,0,0|1,1,0]=4 12064 B12R1.43 C[C@@H](N)C(O)Cc1ccccc1 Amb35618099 [0,2,0,0,0,0|2,0,0]=4 12065 B12R1.43 C[C@@H](N)[C@@H](C)Nc1ccccc1 Amb27394625 [0,2,0,0,0,0|2,0,0]=4 12066 B12R1.43 C[C@@H](Nc1ccccc1)C(=O)O Amb22801823 [0,2,0,0,0,0|1,0,1]=4 12067 B12R1.43 C[C@@H](O)[C@H](O)Cc1ccccc1 Amb28401092 [0,2,0,0,0,0|1,0,0]=3 12068 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)O Amb22736710 [0,2,0,0,0,0|0,0,1]=3 12069 B12R1.43 C[C@@H](Oc1cccnc1)C(=O)O Amb28288991 [0,2,0,0,0,0|1,0,1]=4 12070 B12R1.43 C[C@@H](Sc1ccccc1)C(=O)O Amb27425234 [0,2,0,0,0,0|0,1,1]=4 12071 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [0,2,0,0,0,0|1,0,1]=4 12072 B12R1.43 C[C@H](Cl)[C@@H](Cl)Oc1ccccc1 Amb28398482 [0,2,0,0,0,0|1,0,0]=3 12073 B12R1.43 C[C@H](N)C(=O)Oc1ccccc1 Amb28118920 [0,2,0,0,0,0|1,0,1]=4 12074 B12R1.43 C[C@H](N)C(O)Cc1ccccc1 Amb35738417 [0,2,0,0,0,0|2,0,0]=4 12075 B12R1.43 C[C@H](Nc1ccccc1)C(=O)O Amb24434019 [0,2,0,0,0,0|1,0,1]=4 12076 B12R1.43 C[C@H](Nc1ccccc1)[C@@H](C)O Amb27225799 [0,2,0,0,0,0|1,0,0]=3 12077 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 Amb27244706 [0,2,0,0,0,0|1,0,1]=4 12078 B12R1.43 C[C@H](O)[C@@H](C)Cc1ccccc1 Amb27207474 [0,2,0,0,0,0|1,0,0]=3 12079 B12R1.43 C[C@H](Oc1ccccc1)C(=O)O Amb22736711 [0,2,0,0,0,0|0,0,1]=3 12080 B12R1.43 C[C@H](Oc1ccccc1)C(N)=O Amb27431501 [0,2,0,0,0,0|0,0,2]=4 12081 B12R1.43 C[C@H](Oc1cccnc1)C(=O)O Amb28197526 [0,2,0,0,0,0|1,0,1]=4 12082 B12R1.43 C\C(=C/c1ccccc1)C(C)O Amb27762014 [0,2,0,0,0,0|1,0,1]=4 12083 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)O Amb32952077 [0,2,0,0,0,0|1,0,1]=4 12084 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)O Amb27589732 [0,2,0,0,0,0|1,0,1]=4 12085 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,2,0,0,0,0|0,0,2]=4 12086 B12R1.43 NC(Cc1ccccc1)B(O)O Amb27659344 [0,2,0,0,0,0|2,0,0]=4 12087 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [0,2,0,0,0,0|1,0,1]=4 12088 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [0,2,0,0,0,0|1,0,1]=4 12089 B12R1.43 NC(Cc1ccccc1)C(F)F Amb8391888 [0,2,0,0,0,0|2,0,0]=4 12090 B12R1.43 NC(Cc1ccccc1)[PH](=O)O Amb27254109 [0,2,0,0,0,0|2,0,0]=4 12091 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,2,0,0,0,0|2,0,0]=4 12092 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [0,2,0,0,0,0|1,0,1]=4 12093 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [0,2,0,0,0,0|1,0,1]=4 12094 B12R1.43 N[C@@H](Cc1ccccc1)C(F)F Amb27958847 [0,2,0,0,0,0|2,0,0]=4 12095 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [0,2,0,0,0,0|1,0,1]=4 12096 B12R1.43 O=C(O)C(=S)Oc1ccccc1 Amb27484078 [0,2,0,0,0,0|0,0,2]=4 12097 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [0,2,0,0,0,0|1,0,1]=4 12098 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|1,0,1]=4 12099 B12R1.43 O=C(O)C(Cl)Sc1ccccc1 Amb27797220 [0,2,0,0,0,0|0,1,1]=4 12100 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [0,2,0,0,0,0|1,0,1]=4 12101 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [0,2,0,0,0,0|1,0,1]=4 12102 B12R1.43 O=C(O)C(O)Oc1ccccc1 Amb27645391 [0,2,0,0,0,0|0,0,1]=3 12103 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|1,0,1]=4 12104 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|1,0,1]=4 12105 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [0,2,0,0,0,0|1,0,1]=4 12106 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [0,2,0,0,0,0|1,0,1]=4 12107 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [0,2,0,0,0,0|1,0,1]=4 12108 B12R1.43 OC(Cc1ccccc1)C(F)F Amb24665165 [0,2,0,0,0,0|2,0,0]=4 12109 B12R1.43 O[C@H](Cc1ccccc1)[C@H](F)Cl Amb27392395 [0,2,0,0,0,0|2,0,0]=4 12110 B12R1.118 C=CC(CO)Nc1ccccc1 Amb27655109 [0,2,0,0,0,0|1,0,0]=3 12111 B12R1.118 C=CC(CO)Nc1ccccn1 Amb27979996 [0,2,0,0,0,0|2,0,0]=4 12112 B12R1.118 C=C\C(=C/c1ccccc1)CO Amb27981982 [0,2,0,0,0,0|1,0,1]=4 12113 B12R1.118 CCC(C#N)Cc1ccccc1 Amb27243484 [0,2,0,0,0,0|2,0,0]=4 12114 B12R1.118 CCC(C#N)Oc1ccccc1 Amb18797968 [0,2,0,0,0,0|1,0,0]=3 12115 B12R1.118 CCC(C#N)Sc1ccccc1 Amb10565503 [0,2,0,0,0,0|1,1,0]=4 12116 B12R1.118 CCC(CBr)Cc1ccccc1 Amb32688650 [0,2,0,0,0,0|2,0,0]=4 12117 B12R1.118 CCC(CC)Oc1ccccn1 Amb24100574 [0,2,0,0,0,0|2,0,0]=4 12118 B12R1.118 CCC(CCl)Cc1ccccc1 Amb32688649 [0,2,0,0,0,0|2,0,0]=4 12119 B12R1.118 CCC(CF)Nc1ccccc1 Amb27664184 [0,2,0,0,0,0|2,0,0]=4 12120 B12R1.118 CCC(CN)Cc1ccccc1 Amb5743867 [0,2,0,0,0,0|2,0,0]=4 12121 B12R1.118 CCC(CN)Nc1ccccc1 Amb25982695 [0,2,0,0,0,0|2,0,0]=4 12122 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [0,2,0,0,0,0|1,0,0]=3 12123 B12R1.118 CCC(CO)Nc1ccccc1 Amb13952611 [0,2,0,0,0,0|1,0,0]=3 12124 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [0,2,0,0,0,0|2,0,0]=4 12125 B12R1.118 CC[C@@H](CO)Nc1ccccc1 Amb27175792 [0,2,0,0,0,0|1,0,0]=3 12126 B12R1.118 CC\C(=C\Cl)Oc1ccccc1 Amb27425338 [0,2,0,0,0,0|1,0,1]=4 12127 B12R1.118 CC\C(=C\c1ccccc1)CO Amb27860945 [0,2,0,0,0,0|1,0,1]=4 12128 B12R1.118 CNC(CN)Cc1ccccc1 Amb18800847 [0,2,0,0,0,0|2,0,0]=4 12129 B12R1.118 CNC(CO)Cc1ccccc1 Amb33536475 [0,2,0,0,0,0|1,0,0]=3 12130 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,2,0,0,0,0|1,0,0]=3 12131 B12R1.118 CN[C@H](CO)Cc1ccccc1 Amb33761130 [0,2,0,0,0,0|1,0,0]=3 12132 B12R1.118 COC(CBr)Cc1ccccc1 Amb32661729 [0,2,0,0,0,0|2,0,0]=4 12133 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,2,0,0,0,0|2,0,0]=4 12134 B12R1.118 COC(CO)Cc1ccccc1 Amb28963382 [0,2,0,0,0,0|1,0,0]=3 12135 B12R1.118 CO\C(=C\c1ccccc1)CO Amb27457627 [0,2,0,0,0,0|1,0,1]=4 12136 B12R1.118 C\C=C(\CO)Cc1ccccc1 Amb28242441 [0,2,0,0,0,0|1,0,1]=4 12137 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,2,0,0,0,0|1,0,0]=3 12138 B12R1.118 N#CC(CO)Cc1cccnc1 Amb23537654 [0,2,0,0,0,0|2,0,0]=4 12139 B12R1.118 N#CC(CO)Nc1ccccc1 Amb27784107 [0,2,0,0,0,0|1,0,0]=3 12140 B12R1.118 N#C\C(=C/c1ccccc1)CO Amb28322086 [0,2,0,0,0,0|1,0,1]=4 12141 B12R1.118 NCC(CO)Cc1ccccc1 Amb5744189 [0,2,0,0,0,0|1,0,0]=3 12142 B12R1.118 NCC(CO)Cc1ccccn1 Amb5744186 [0,2,0,0,0,0|2,0,0]=4 12143 B12R1.118 NCC(CO)Cc1cccnc1 Amb28872356 [0,2,0,0,0,0|2,0,0]=4 12144 B12R1.118 NCC(CO)Cc1cccnc1 Amb5744187 [0,2,0,0,0,0|2,0,0]=4 12145 B12R1.118 NCC(CO)Cc1ccncc1 Amb33379053 [0,2,0,0,0,0|2,0,0]=4 12146 B12R1.118 NCC(CO)Cc1ccncc1 Amb5744188 [0,2,0,0,0,0|2,0,0]=4 12147 B12R1.118 O=C\C(=C/O)Oc1ccccc1 Amb24625847 [0,2,0,0,0,0|0,0,2]=4 12148 B12R1.118 O=C\C(=C\c1ccccc1)CO Amb27769967 [0,2,0,0,0,0|1,0,1]=4 12149 B12R1.118 OCC(CO)Cc1ccccc1 Amb4018930 [0,2,0,0,0,0|1,0,0]=3 12150 B12R1.118 OCC(CO)Cc1ccccn1 Amb32416975 [0,2,0,0,0,0|2,0,0]=4 12151 B12R1.118 OCC(CO)Cc1ccncc1 Amb32416972 [0,2,0,0,0,0|2,0,0]=4 12152 B12R1.118 OCC(CO)Nc1ccncc1 Amb27464346 [0,2,0,0,0,0|2,0,0]=4 12153 B12R1.118 [C-]#[N+]C(CF)Cc1ccccc1 Amb27958640 [0,2,0,0,0,0|2,0,0]=4 12154 B12R1.194 CC(C)(C#N)Oc1ccccc1 Amb28435266 [0,2,0,0,0,0|1,0,1]=4 12155 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,2,0,0,0,0|0,0,2]=4 12156 B12R1.194 CC(C)(CBr)Cc1ccccc1 Amb27748554 [0,2,0,0,0,0|2,0,0]=4 12157 B12R1.194 CC(C)(CBr)Oc1ccccc1 Amb17248430 [0,2,0,0,0,0|1,0,0]=3 12158 B12R1.194 CC(C)(CCl)Cc1ccccc1 Amb26495593 [0,2,0,0,0,0|2,0,0]=4 12159 B12R1.194 CC(C)(CCl)Oc1ccccc1 Amb17234167 [0,2,0,0,0,0|1,0,0]=3 12160 B12R1.194 CC(C)(CCl)Sc1ccccc1 Amb28247918 [0,2,0,0,0,0|1,1,0]=4 12161 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb17333839 [0,2,0,0,0,0|2,0,0]=4 12162 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [0,2,0,0,0,0|2,0,0]=4 12163 B12R1.194 CC(C)(CN)Nc1ccccc1 Amb3969109 [0,2,0,0,0,0|2,0,0]=4 12164 B12R1.194 CC(C)(CN)Oc1ccccc1 Amb17074797 [0,2,0,0,0,0|1,0,0]=3 12165 B12R1.194 CC(C)(CN)Oc1ccccc1 Amb19515084 [0,2,0,0,0,0|1,0,0]=3 12166 B12R1.194 CC(C)(CO)Cc1ccccc1 Amb4021846 [0,2,0,0,0,0|1,0,0]=3 12167 B12R1.194 CC(C)(CO)Cc1ccccn1 Amb33360423 [0,2,0,0,0,0|2,0,0]=4 12168 B12R1.194 CC(C)(CO)Cc1cccnc1 Amb33360422 [0,2,0,0,0,0|2,0,0]=4 12169 B12R1.194 CC(C)(CO)Cc1ccncc1 Amb33380627 [0,2,0,0,0,0|2,0,0]=4 12170 B12R1.194 CC(C)(CO)Nc1ccccc1 Amb18269010 [0,2,0,0,0,0|1,0,0]=3 12171 B12R1.194 CC(C)(CO)Nc1ccncc1 Amb9360343 [0,2,0,0,0,0|2,0,0]=4 12172 B12R1.194 CC(C)(CO)Oc1ccccc1 Amb17232597 [0,2,0,0,0,0|0,0,0]=2 12173 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,2,0,0,0,0|2,0,0]=4 12174 B12R1.194 CC(F)(CN)Cc1ccccc1 Amb28120778 [0,2,0,0,0,0|2,0,0]=4 12175 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,2,0,0,0,0|1,0,0]=3 12176 B12R1.194 CC(N)(CO)Cc1ccccn1 Amb33360492 [0,2,0,0,0,0|2,0,0]=4 12177 B12R1.194 CC(N)(CO)Cc1cccnc1 Amb33360053 [0,2,0,0,0,0|2,0,0]=4 12178 B12R1.194 CC(N)(CO)Cc1ccncc1 Amb33380644 [0,2,0,0,0,0|2,0,0]=4 12179 B12R1.194 CC(O)(CCl)Cc1ccccc1 Amb28118919 [0,2,0,0,0,0|2,0,0]=4 12180 B12R1.194 CC(O)(CCl)Nc1ccccc1 Amb27406772 [0,2,0,0,0,0|2,0,0]=4 12181 B12R1.194 CC(O)(CN)Cc1ccccc1 Amb17082131 [0,2,0,0,0,0|2,0,0]=4 12182 B12R1.194 CC(O)(CO)Cc1ccccc1 Amb28138963 [0,2,0,0,0,0|1,0,0]=3 12183 B12R1.194 CC(S)(CN)Cc1ccccc1 Amb28141193 [0,2,0,0,0,0|2,0,0]=4 12184 B12R1.194 CCC(C)(C)Oc1ccccc1 Amb27967379 [0,2,0,0,0,0|1,0,0]=3 12185 B12R1.194 CCS(=O)(=O)Oc1ccccc1 Amb23496964 [0,2,0,0,0,0|2,0,0]=4 12186 B12R1.194 C[C@@](N)(CO)Cc1ccccc1 Amb26371721 [0,2,0,0,0,0|1,0,0]=3 12187 B12R1.194 C[C@](N)(CO)Cc1ccccc1 Amb28396546 [0,2,0,0,0,0|1,0,0]=3 12188 B12R1.194 C[Si](C)(CO)Cc1ccccc1 Amb27812279 [0,2,0,0,0,0|1,1,0]=4 12189 B12R1.194 NCC(F)(F)Cc1ccccc1 Amb25103781 [0,2,0,0,0,0|2,0,0]=4 12190 B12R1.194 NCC(F)(F)Sc1ccccc1 Amb27985839 [0,2,0,0,0,0|1,1,0]=4 12191 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [0,2,0,0,0,0|1,0,0]=3 12192 B12R1.194 OC[C@](F)(Cl)Cc1ccccc1 Amb27652930 [0,2,0,0,0,0|1,0,0]=3 12193 B12R1.891 CC(C)(C)CCc1ccccc1 Amb24470690 [0,2,0,0,0,0|2,0,0]=4 12194 B12R1.891 CC(C)(C)CNc1ccccc1 Amb10889788 [0,2,0,0,0,0|2,0,0]=4 12195 B12R1.891 CC(C)(C)CNc1ccccc1 Amb22394914 [0,2,0,0,0,0|2,0,0]=4 12196 B12R1.891 CC(C)(C)CSc1ccccc1 Amb27474882 [0,2,0,0,0,0|1,1,0]=4 12197 B12R1.891 CC(C)(F)CNc1ccccc1 Amb27857222 [0,2,0,0,0,0|2,0,0]=4 12198 B12R1.891 CC(C)(N)CCc1ccccc1 Amb17334588 [0,2,0,0,0,0|2,0,0]=4 12199 B12R1.891 CC(C)(N)CCc1ccccc1 Amb19373033 [0,2,0,0,0,0|2,0,0]=4 12200 B12R1.891 CC(C)(N)CNc1ccccc1 Amb18974263 [0,2,0,0,0,0|2,0,0]=4 12201 B12R1.891 CC(C)(N)COc1ccccc1 Amb17074732 [0,2,0,0,0,0|1,0,0]=3 12202 B12R1.891 CC(C)(N)COc1ccccn1 Amb22522749 [0,2,0,0,0,0|2,0,0]=4 12203 B12R1.891 CC(C)(N)CSc1ccccc1 Amb17485972 [0,2,0,0,0,0|1,1,0]=4 12204 B12R1.891 CC(C)(O)C#Cc1ccccc1 Amb535101 [0,2,0,0,0,0|1,0,1]=4 12205 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [0,2,0,0,0,0|1,0,0]=3 12206 B12R1.891 CC(C)(O)CCc1ccccn1 Amb31176214 [0,2,0,0,0,0|2,0,0]=4 12207 B12R1.891 CC(C)(O)CCc1cccnc1 Amb31176215 [0,2,0,0,0,0|2,0,0]=4 12208 B12R1.891 CC(C)(O)CCc1ccncc1 Amb31176216 [0,2,0,0,0,0|2,0,0]=4 12209 B12R1.891 CC(C)(O)CNc1ccccc1 Amb17138596 [0,2,0,0,0,0|1,0,0]=3 12210 B12R1.891 CC(C)(O)CNc1ccccn1 Amb27483906 [0,2,0,0,0,0|2,0,0]=4 12211 B12R1.891 CC(C)(O)COc1ccccc1 Amb18180107 [0,2,0,0,0,0|0,0,0]=2 12212 B12R1.891 CC(C)(O)COc1ccccn1 Amb28188020 [0,2,0,0,0,0|1,0,0]=3 12213 B12R1.891 CC(C)(O)\C=C\c1ccccc1 Amb32954377 [0,2,0,0,0,0|1,0,1]=4 12214 B12R1.891 FC(F)(F)CCc1ccccc1 Amb2691115 [0,2,0,0,0,0|2,0,0]=4 12215 B12R1.891 FC(F)(F)CNc1ccccc1 Amb33868633 [0,2,0,0,0,0|2,0,0]=4 12216 B12R1.891 FC(F)(F)CNc1ccccc1 Amb6706999 [0,2,0,0,0,0|2,0,0]=4 12217 B12R1.891 FC(F)(F)COc1ccccc1 Amb10840984 [0,2,0,0,0,0|1,0,0]=3 12218 B12R1.891 FC(F)(F)COc1ccccn1 Amb25760679 [0,2,0,0,0,0|2,0,0]=4 12219 B12R1.891 FC(F)(F)COc1cccnc1 Amb6892712 [0,2,0,0,0,0|2,0,0]=4 12220 B12R1.891 FC(F)(F)COc1ccncc1 Amb31203165 [0,2,0,0,0,0|2,0,0]=4 12221 B12R1.891 FC(F)(F)CSc1ccccc1 Amb17673273 [0,2,0,0,0,0|1,1,0]=4 12222 B12R1.891 O=P(O)(Cl)CCc1ccccc1 Amb28435339 [0,2,0,0,0,0|2,0,0]=4 12223 B12R1.891 O=P(O)(O)CCc1ccccc1 Amb9786423 [0,2,0,0,0,0|2,0,0]=4 12224 B12R1.891 O=S(=O)(O)CCc1ccccc1 Amb19866568 [0,2,0,0,0,0|2,0,0]=4 12225 B12R1.891 [2H]C([2H])(O)COc1ccccc1 Amb33330986 [0,2,0,0,0,0|0,0,0]=2 12226 B10R1.187 C=C1C=CC(=O)N1CCO Amb27614995 [0,0,1,1,0,0|2,0,0]=4 12227 B10R1.5 O=Cc1cccn1CCO Amb17116748 [0,0,1,1,0,0|2,0,0]=4 12228 B10R1.96 C=C=Cc1ccc(CO)o1 Amb27965704 [0,0,1,1,0,0|0,0,2]=4 12229 B10R1.96 OCc1ccc(\C=C\Br)o1 Amb33134984 [0,0,1,1,0,0|1,0,1]=4 12230 B10R1.172 C=Cc1cccc(CO)c1 Amb24405968 [0,0,1,1,0,0|1,0,1]=4 12231 B10R1.172 C=Cc1cccc(CO)n1 Amb26511253 [0,0,1,1,0,0|1,0,1]=4 12232 B10R1.176 O=CC1=CC(=O)C(O)CO1 Amb28239701 [0,0,1,1,0,0|2,0,0]=4 12233 B10R1.19 C=C1C=CC=CCC1CBr Amb27614357 [0,0,1,1,0,0|2,0,0]=4 12234 B10R2.6 c1cc(C2CC2)ccn1 Amb2694200 [1,0,0,1,0,0|2,0,0]=4 12235 B10R2.6 c1cc(C2CC2)ccn1 Amb31188309 [1,0,0,1,0,0|2,0,0]=4 12236 B10R2.6 c1cc(C2CN2)ccn1 Amb18221868 [1,0,0,1,0,0|2,0,0]=4 12237 B10R2.6 c1cc(C2CO2)ccn1 Amb17090250 [1,0,0,1,0,0|1,0,0]=3 12238 B10R2.6 c1cc(C2CO2)ncn1 Amb33269520 [1,0,0,1,0,0|2,0,0]=4 12239 B10R2.6 c1cc(C2CS2)ccn1 Amb27162542 [1,0,0,1,0,0|1,1,0]=4 12240 B10R2.6 c1cc([C@@H]2CO2)ccn1 Amb24103202 [1,0,0,1,0,0|1,0,0]=3 12241 B10R2.6 c1cc([C@@H]2CO2)ncn1 Amb26430648 [1,0,0,1,0,0|2,0,0]=4 12242 B10R2.6 c1cc([C@H]2CO2)ccn1 Amb24103149 [1,0,0,1,0,0|1,0,0]=3 12243 B10R2.6 c1cc([C@H]2CO2)ncn1 Amb27244298 [1,0,0,1,0,0|2,0,0]=4 12244 B10R2.6 c1ccc(C2CC2)cc1 Amb2780033 [1,0,0,1,0,0|1,0,0]=3 12245 B10R2.6 c1ccc(C2CC2)nc1 Amb27482994 [1,0,0,1,0,0|2,0,0]=4 12246 B10R2.6 c1ccc(C2CN2)cc1 Amb4114017 [1,0,0,1,0,0|1,0,0]=3 12247 B10R2.6 c1ccc(C2CN2)nc1 Amb18860383 [1,0,0,1,0,0|2,0,0]=4 12248 B10R2.6 c1ccc(C2CO2)cc1 Amb9702825 [1,0,0,1,0,0|0,0,0]=2 12249 B10R2.6 c1ccc(C2CO2)nc1 Amb17090248 [1,0,0,1,0,0|1,0,0]=3 12250 B10R2.6 c1ccc([C@@H]2CN2)cc1 Amb30633901 [1,0,0,1,0,0|1,0,0]=3 12251 B10R2.6 c1ccc([C@@H]2CO2)cc1 Amb8514797 [1,0,0,1,0,0|0,0,0]=2 12252 B10R2.6 c1ccc([C@@H]2CO2)nc1 Amb24481607 [1,0,0,1,0,0|1,0,0]=3 12253 B10R2.6 c1ccc([C@H]2CN2)cc1 Amb33871555 [1,0,0,1,0,0|1,0,0]=3 12254 B10R2.6 c1ccc([C@H]2CO2)cc1 Amb8628176 [1,0,0,1,0,0|0,0,0]=2 12255 B10R2.6 c1ccc([C@H]2CO2)nc1 Amb24101968 [1,0,0,1,0,0|1,0,0]=3 12256 B10R2.6 c1cnc(C2CO2)cn1 Amb25104129 [1,0,0,1,0,0|2,0,0]=4 12257 B10R2.6 c1cnc(C2CO2)nc1 Amb33270688 [1,0,0,1,0,0|2,0,0]=4 12258 B10R2.6 c1cnc([C@@H]2CO2)cn1 Amb24481608 [1,0,0,1,0,0|2,0,0]=4 12259 B10R2.6 c1cnc([C@@H]2CO2)nc1 Amb33269208 [1,0,0,1,0,0|2,0,0]=4 12260 B10R2.6 c1cnc([C@H]2CO2)cn1 Amb24481609 [1,0,0,1,0,0|2,0,0]=4 12261 B10R2.6 c1cnc([C@H]2CO2)nc1 Amb33269209 [1,0,0,1,0,0|2,0,0]=4 12262 B10R2.6 c1cncc(C2CC2)c1 Amb22235730 [1,0,0,1,0,0|2,0,0]=4 12263 B10R2.6 c1cncc(C2CN2)c1 Amb18221862 [1,0,0,1,0,0|2,0,0]=4 12264 B10R2.6 c1cncc(C2CO2)c1 Amb17090249 [1,0,0,1,0,0|1,0,0]=3 12265 B10R2.6 c1cncc([C@@H]2CO2)c1 Amb25758556 [1,0,0,1,0,0|1,0,0]=3 12266 B10R2.6 c1cncc([C@H]2CO2)c1 Amb28382282 [1,0,0,1,0,0|1,0,0]=3 12267 B10R2.6 c1ncc(C2CO2)cn1 Amb24657638 [1,0,0,1,0,0|2,0,0]=4 12268 B10R2.6 c1ncc([C@@H]2CO2)cn1 Amb32875961 [1,0,0,1,0,0|2,0,0]=4 12269 B10R2.6 c1ncc([C@H]2CO2)cn1 Amb32875997 [1,0,0,1,0,0|2,0,0]=4 12270 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [1,0,0,1,0,0|1,0,1]=4 12271 B10R2.7 b1oc2ccccc2o1 Amb22731069 [1,0,0,1,0,0|1,0,0]=3 12272 B10R2.7 b1oc2cccnc2o1 Amb27848527 [1,0,0,1,0,0|2,0,0]=4 12273 B10R2.7 c1cc2c(cn1)CCN2 Amb19515489 [1,0,0,1,0,0|2,0,0]=4 12274 B10R2.7 c1cc2c(cn1)CCN2 Amb22372217 [1,0,0,1,0,0|2,0,0]=4 12275 B10R2.7 c1cc2c(cn1)CCO2 Amb24101562 [1,0,0,1,0,0|1,0,0]=3 12276 B10R2.7 c1cc2c(cn1)NCC2 Amb19516033 [1,0,0,1,0,0|2,0,0]=4 12277 B10R2.7 c1cc2c(cn1)NCC2 Amb22495003 [1,0,0,1,0,0|2,0,0]=4 12278 B10R2.7 c1cc2c(cn1)NCC2 Amb23412122 [1,0,0,1,0,0|2,0,0]=4 12279 B10R2.7 c1cc[n+]2c(c1)OCC2 Amb22364467 [1,0,0,1,0,0|1,0,0]=3 12280 B10R2.7 c1ccc2c(c1)CCC2 Amb6608915 [1,0,0,1,0,0|1,0,0]=3 12281 B10R2.7 c1ccc2c(c1)CCN2 Amb1869493 [1,0,0,1,0,0|1,0,0]=3 12282 B10R2.7 c1ccc2c(c1)CCO2 Amb2687295 [1,0,0,1,0,0|0,0,0]=2 12283 B10R2.7 c1ccc2c(c1)CNC2 Amb33527370 [1,0,0,1,0,0|2,0,0]=4 12284 B10R2.7 c1ccc2c(c1)CNC2 Amb33544332 [1,0,0,1,0,0|2,0,0]=4 12285 B10R2.7 c1ccc2c(c1)CNN2 Amb8386538 [1,0,0,1,0,0|2,0,0]=4 12286 B10R2.7 c1ccc2c(c1)COC2 Amb2780010 [1,0,0,1,0,0|2,0,0]=4 12287 B10R2.7 c1ccc2c(c1)CPC2 Amb27217940 [1,0,0,1,0,0|2,0,0]=4 12288 B10R2.7 c1ccc2c(c1)CSC2 Amb21962922 [1,0,0,1,0,0|2,0,0]=4 12289 B10R2.7 c1ccc2c(c1)NCO2 Amb28050014 [1,0,0,1,0,0|1,0,0]=3 12290 B10R2.7 c1ccc2c(c1)OCO2 Amb2684576 [1,0,0,1,0,0|0,0,0]=2 12291 B10R2.7 c1ccc2c(c1)OSO2 Amb28050023 [1,0,0,1,0,0|1,0,0]=3 12292 B10R2.7 c1ccc2c(c1)SCS2 Amb26548649 [1,0,0,1,0,0|0,2,0]=4 12293 B10R2.7 c1ccc2occc2c1 Amb2725466 [1,0,0,1,0,0|0,0,2]=4 12294 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [1,0,0,1,0,0|1,0,1]=4 12295 B10R2.7 c1ccc2oncc2c1 Amb1233398 [1,0,0,1,0,0|1,0,1]=4 12296 B10R2.7 c1cnc2c(c1)CCC2 Amb8386888 [1,0,0,1,0,0|2,0,0]=4 12297 B10R2.7 c1cnc2c(c1)CCN2 Amb32406061 [1,0,0,1,0,0|2,0,0]=4 12298 B10R2.7 c1cnc2c(c1)CCN2 Amb6751887 [1,0,0,1,0,0|2,0,0]=4 12299 B10R2.7 c1cnc2c(c1)CCO2 Amb25337454 [1,0,0,1,0,0|1,0,0]=3 12300 B10R2.7 c1cnc2c(c1)CCS2 Amb8439003 [1,0,0,1,0,0|1,1,0]=4 12301 B10R2.7 c1cnc2c(c1)NCC2 Amb18833005 [1,0,0,1,0,0|2,0,0]=4 12302 B10R2.7 c1cnc2c(c1)NCC2 Amb33069019 [1,0,0,1,0,0|2,0,0]=4 12303 B10R2.7 c1cnc2c(c1)OCC2 Amb23455396 [1,0,0,1,0,0|1,0,0]=3 12304 B10R2.7 c1ncc2c(n1)OCC2 Amb27636198 [1,0,0,1,0,0|2,0,0]=4 12305 B10R2.320 BrC1Cc2ccccc21 Amb8395938 [1,0,0,1,0,0|1,0,0]=3 12306 B10R2.320 CC1=Cc2ccccc21 Amb27838637 [1,0,0,1,0,0|1,0,1]=4 12307 B10R2.320 CC1Cc2ccccc21 Amb17778870 [1,0,0,1,0,0|1,0,0]=3 12308 B10R2.320 ClC1Cc2ccccc21 Amb17778800 [1,0,0,1,0,0|1,0,0]=3 12309 B10R2.320 FC1Cc2ccccc21 Amb26861975 [1,0,0,1,0,0|1,0,0]=3 12310 B10R2.320 IC1Cc2ccccc21 Amb27465878 [1,0,0,1,0,0|1,0,0]=3 12311 B10R2.320 NC1Cc2ccccc21 Amb26866193 [1,0,0,1,0,0|1,0,0]=3 12312 B10R2.320 NC1Cc2ccccc21 Amb33552087 [1,0,0,1,0,0|1,0,0]=3 12313 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [1,0,0,1,0,0|0,0,2]=4 12314 B10R2.320 OC1Cc2ccccc21 Amb17778676 [1,0,0,1,0,0|0,0,0]=2 12315 B10R2.320 [NH3+]C1Cc2ccccc21 Amb17778877 [1,0,0,1,0,0|1,0,0]=3 12316 B10R2.408 c1cc2cc(c1)CNC2 Amb28197239 [1,0,0,1,0,0|2,0,0]=4 12317 B10R2.32 OC1CCc2ccsc21 Amb24675555 [0,0,0,1,1,0|2,0,0]=4 12318 B10R2.32 OC1CCc2cscc21 Amb18202846 [0,0,0,1,1,0|2,0,0]=4 12319 B10R2.32 OC1CCc2sccc21 Amb17087941 [0,0,0,1,1,0|2,0,0]=4 12320 B10R2.32 OC1CNc2ccoc21 Amb27165235 [0,0,0,1,1,0|2,0,0]=4 12321 B10R2.32 OC1CSc2ccsc21 Amb27978497 [0,0,0,1,1,0|1,1,0]=4 12322 B10R2.193 c1cc(CC2CO2)co1 Amb26386561 [0,0,0,1,1,0|2,0,0]=4 12323 B10R2.193 c1cc(CC2CO2)cs1 Amb24392264 [0,0,0,1,1,0|2,0,0]=4 12324 B10R2.193 c1coc(CC2CO2)c1 Amb27838490 [0,0,0,1,1,0|2,0,0]=4 12325 B10R2.193 c1csc(CC2CO2)c1 Amb26951226 [0,0,0,1,1,0|2,0,0]=4 12326 B12R2.41 C1=CC=C2NCCCN2C=C1 Amb27881573 [0,0,0,1,0,1|2,0,0]=4 12327 B12R2.41 C1=CC=C2NCCN=C2C=C1 Amb27250935 [0,0,0,1,0,1|2,0,0]=4 12328 B12R2.586 O[C@H]1CCC2=CC=CC=C[C@@H]21 Amb27420596 [0,0,0,1,0,1|1,0,0]=3 12329 B12R2.24 BrC1=Cc2ccccc2OC1 Amb27841536 [0,1,0,1,0,0|1,0,1]=4 12330 B12R2.24 BrC1CCc2ccccc2C1 Amb13952699 [0,1,0,1,0,0|2,0,0]=4 12331 B12R2.24 BrC1COc2ccccc2C1 Amb28202605 [0,1,0,1,0,0|1,0,0]=3 12332 B12R2.24 Brc1cc2c(cn1)NCCO2 Amb27638261 [0,1,0,1,0,0|2,0,0]=4 12333 B12R2.24 Brc1cc2c(cn1)OCCN2 Amb27633249 [0,1,0,1,0,0|2,0,0]=4 12334 B12R2.24 Brc1ccc2c(c1)C=CCO2 Amb22231978 [0,1,0,1,0,0|1,0,1]=4 12335 B12R2.24 Brc1ccc2c(c1)CCCC2 Amb6665353 [0,1,0,1,0,0|2,0,0]=4 12336 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb1090469 [0,1,0,1,0,0|2,0,0]=4 12337 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb6825616 [0,1,0,1,0,0|2,0,0]=4 12338 B12R2.24 Brc1ccc2c(c1)CCCO2 Amb33536169 [0,1,0,1,0,0|1,0,0]=3 12339 B12R2.24 Brc1ccc2c(c1)CCCS2 Amb18755837 [0,1,0,1,0,0|1,1,0]=4 12340 B12R2.24 Brc1ccc2c(c1)COCO2 Amb16231031 [0,1,0,1,0,0|2,0,0]=4 12341 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb10576260 [0,1,0,1,0,0|2,0,0]=4 12342 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb2383341 [0,1,0,1,0,0|2,0,0]=4 12343 B12R2.24 Brc1ccc2c(c1)NCCN2 Amb33549267 [0,1,0,1,0,0|2,0,0]=4 12344 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb21964574 [0,1,0,1,0,0|1,0,0]=3 12345 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [0,1,0,1,0,0|1,0,0]=3 12346 B12R2.24 Brc1ccc2c(c1)OCCC2 Amb23440336 [0,1,0,1,0,0|1,0,0]=3 12347 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [0,1,0,1,0,0|1,0,0]=3 12348 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb19958005 [0,1,0,1,0,0|1,0,0]=3 12349 B12R2.24 Brc1ccc2c(c1)OCCO2 Amb1152259 [0,1,0,1,0,0|0,0,0]=2 12350 B12R2.24 Brc1ccc2c(c1)OCOC2 Amb2723035 [0,1,0,1,0,0|2,0,0]=4 12351 B12R2.24 Brc1ccc2c(n1)NCCO2 Amb21864617 [0,1,0,1,0,0|2,0,0]=4 12352 B12R2.24 Brc1ccc2c(n1)OCCN2 Amb13890276 [0,1,0,1,0,0|2,0,0]=4 12353 B12R2.24 Brc1cnc2c(c1)CCCO2 Amb26431971 [0,1,0,1,0,0|2,0,0]=4 12354 B12R2.24 Brc1cnc2c(c1)NCCO2 Amb22756067 [0,1,0,1,0,0|2,0,0]=4 12355 B12R2.24 Brc1cnc2c(c1)OCCN2 Amb2724102 [0,1,0,1,0,0|2,0,0]=4 12356 B12R2.24 Brc1cnc2c(c1)OCCO2 Amb13889671 [0,1,0,1,0,0|1,0,0]=3 12357 B12R2.24 C=C1CCc2ccccc2O1 Amb27210216 [0,1,0,1,0,0|1,0,1]=4 12358 B12R2.24 CC1CCc2ccccc2C1 Amb27232124 [0,1,0,1,0,0|2,0,0]=4 12359 B12R2.24 CC1CCc2ccccc2N1 Amb2792500 [0,1,0,1,0,0|2,0,0]=4 12360 B12R2.24 CC1CCc2ccccc2N1 Amb6773975 [0,1,0,1,0,0|2,0,0]=4 12361 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,1,0,1,0,0|1,0,0]=3 12362 B12R2.24 CC1CNc2ccccc2C1 Amb5745971 [0,1,0,1,0,0|2,0,0]=4 12363 B12R2.24 CC1CNc2ccccc2N1 Amb4138615 [0,1,0,1,0,0|2,0,0]=4 12364 B12R2.24 CC1CNc2ccccc2O1 Amb17097653 [0,1,0,1,0,0|1,0,0]=3 12365 B12R2.24 CC1CNc2ccccc2O1 Amb5716804 [0,1,0,1,0,0|1,0,0]=3 12366 B12R2.24 CC1CNc2ccccc2S1 Amb9173896 [0,1,0,1,0,0|1,1,0]=4 12367 B12R2.24 CC1CNc2cccnc2O1 Amb27242027 [0,1,0,1,0,0|2,0,0]=4 12368 B12R2.24 CC1CNc2ccncc2O1 Amb27624896 [0,1,0,1,0,0|2,0,0]=4 12369 B12R2.24 CC1CNc2ncccc2O1 Amb24709310 [0,1,0,1,0,0|2,0,0]=4 12370 B12R2.24 CC1COc2ccccc2N1 Amb3427952 [0,1,0,1,0,0|1,0,0]=3 12371 B12R2.24 CC1COc2ccccc2O1 Amb27762394 [0,1,0,1,0,0|0,0,0]=2 12372 B12R2.24 CC1COc2cccnc2N1 Amb25137304 [0,1,0,1,0,0|2,0,0]=4 12373 B12R2.24 CC1COc2cnccc2N1 Amb28368592 [0,1,0,1,0,0|2,0,0]=4 12374 B12R2.24 CC1COc2ncccc2N1 Amb27808562 [0,1,0,1,0,0|2,0,0]=4 12375 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,1,0,1,0,0|1,1,0]=4 12376 B12R2.24 C[C@@H]1CNc2ccccc2C1 Amb27975495 [0,1,0,1,0,0|2,0,0]=4 12377 B12R2.24 C[C@@H]1CNc2ccccc2N1 Amb25992852 [0,1,0,1,0,0|2,0,0]=4 12378 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,1,0,1,0,0|2,0,0]=4 12379 B12R2.24 C[C@H]1COc2ccccc2N1 Amb28340950 [0,1,0,1,0,0|1,0,0]=3 12380 B12R2.24 Cc1cc2c(cn1)OCCN2 Amb27240015 [0,1,0,1,0,0|2,0,0]=4 12381 B12R2.24 Cc1ccc2c(c1)C=CCO2 Amb23441455 [0,1,0,1,0,0|1,0,1]=4 12382 B12R2.24 Cc1ccc2c(c1)CCCC2 Amb17673387 [0,1,0,1,0,0|2,0,0]=4 12383 B12R2.24 Cc1ccc2c(c1)CCCN2 Amb22499776 [0,1,0,1,0,0|2,0,0]=4 12384 B12R2.24 Cc1ccc2c(c1)CCCN2 Amb3940149 [0,1,0,1,0,0|2,0,0]=4 12385 B12R2.24 Cc1ccc2c(c1)CCCO2 Amb13951730 [0,1,0,1,0,0|1,0,0]=3 12386 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb1089737 [0,1,0,1,0,0|2,0,0]=4 12387 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb22000879 [0,1,0,1,0,0|2,0,0]=4 12388 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb22234866 [0,1,0,1,0,0|1,0,0]=3 12389 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [0,1,0,1,0,0|1,0,0]=3 12390 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [0,1,0,1,0,0|1,0,0]=3 12391 B12R2.24 Cc1ccc2c(c1)OCCO2 Amb22741143 [0,1,0,1,0,0|0,0,0]=2 12392 B12R2.24 Cc1ccc2c(c1)SCCN2 Amb22498966 [0,1,0,1,0,0|1,1,0]=4 12393 B12R2.24 Cc1ccc2c(n1)OCCN2 Amb22059721 [0,1,0,1,0,0|2,0,0]=4 12394 B12R2.24 Cc1cnc2c(c1)NCCO2 Amb22059623 [0,1,0,1,0,0|2,0,0]=4 12395 B12R2.24 Cc1cnc2c(c1)OCCN2 Amb24727299 [0,1,0,1,0,0|2,0,0]=4 12396 B12R2.24 Cc1ncc2c(n1)OCCO2 Amb25918150 [0,1,0,1,0,0|2,0,0]=4 12397 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,1,0,1,0,0|2,0,0]=4 12398 B12R2.24 Clc1cc2c(cn1)NCCO2 Amb4561024 [0,1,0,1,0,0|2,0,0]=4 12399 B12R2.24 Clc1cc2c(cn1)OCCN2 Amb24486945 [0,1,0,1,0,0|2,0,0]=4 12400 B12R2.24 Clc1cc2c(nn1)OCCO2 Amb22234512 [0,1,0,1,0,0|2,0,0]=4 12401 B12R2.24 Clc1ccc2c(c1)C=CCO2 Amb22586260 [0,1,0,1,0,0|1,0,1]=4 12402 B12R2.24 Clc1ccc2c(c1)CCCC2 Amb26632344 [0,1,0,1,0,0|2,0,0]=4 12403 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb1133229 [0,1,0,1,0,0|2,0,0]=4 12404 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb31291284 [0,1,0,1,0,0|2,0,0]=4 12405 B12R2.24 Clc1ccc2c(c1)CCCO2 Amb22498254 [0,1,0,1,0,0|1,0,0]=3 12406 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb10576261 [0,1,0,1,0,0|2,0,0]=4 12407 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb2383339 [0,1,0,1,0,0|2,0,0]=4 12408 B12R2.24 Clc1ccc2c(c1)NCCN2 Amb10605577 [0,1,0,1,0,0|2,0,0]=4 12409 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [0,1,0,1,0,0|1,0,0]=3 12410 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb2371893 [0,1,0,1,0,0|1,1,0]=4 12411 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb6892829 [0,1,0,1,0,0|1,1,0]=4 12412 B12R2.24 Clc1ccc2c(c1)OCCN2 Amb2792652 [0,1,0,1,0,0|1,0,0]=3 12413 B12R2.24 Clc1ccc2c(c1)OCCO2 Amb13951123 [0,1,0,1,0,0|0,0,0]=2 12414 B12R2.24 Clc1ccc2c(c1)SCCC2 Amb27171333 [0,1,0,1,0,0|1,1,0]=4 12415 B12R2.24 Clc1ccc2c(n1)NCCO2 Amb24509092 [0,1,0,1,0,0|2,0,0]=4 12416 B12R2.24 Clc1ccc2c(n1)OCCN2 Amb25922834 [0,1,0,1,0,0|2,0,0]=4 12417 B12R2.24 Clc1cnc2c(c1)NCCO2 Amb25347381 [0,1,0,1,0,0|2,0,0]=4 12418 B12R2.24 Clc1cnc2c(c1)OCCO2 Amb21959416 [0,1,0,1,0,0|1,0,0]=3 12419 B12R2.24 FC1CCc2ccccc2O1 Amb27668649 [0,1,0,1,0,0|1,0,0]=3 12420 B12R2.24 FC1COc2ccccc2C1 Amb28291388 [0,1,0,1,0,0|1,0,0]=3 12421 B12R2.24 Fc1ccc2c(c1)C=CCO2 Amb25770785 [0,1,0,1,0,0|1,0,1]=4 12422 B12R2.24 Fc1ccc2c(c1)CCCC2 Amb25891545 [0,1,0,1,0,0|2,0,0]=4 12423 B12R2.24 Fc1ccc2c(c1)CCCN2 Amb33526449 [0,1,0,1,0,0|2,0,0]=4 12424 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb22586301 [0,1,0,1,0,0|2,0,0]=4 12425 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb2383340 [0,1,0,1,0,0|2,0,0]=4 12426 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [0,1,0,1,0,0|1,0,0]=3 12427 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [0,1,0,1,0,0|1,0,0]=3 12428 B12R2.24 Fc1ccc2c(c1)NCCS2 Amb25713881 [0,1,0,1,0,0|1,1,0]=4 12429 B12R2.24 Fc1ccc2c(c1)OCC=C2 Amb24485991 [0,1,0,1,0,0|1,0,1]=4 12430 B12R2.24 Fc1ccc2c(c1)OCCC2 Amb25065166 [0,1,0,1,0,0|1,0,0]=3 12431 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [0,1,0,1,0,0|1,0,0]=3 12432 B12R2.24 Fc1ccc2c(c1)OCCO2 Amb22546380 [0,1,0,1,0,0|0,0,0]=2 12433 B12R2.24 Fc1ccc2c(c1)SCCC2 Amb25132871 [0,1,0,1,0,0|1,1,0]=4 12434 B12R2.24 Fc1ccc2c(c1)SCCN2 Amb28043545 [0,1,0,1,0,0|1,1,0]=4 12435 B12R2.24 Fc1ccc2c(n1)OCCN2 Amb27456428 [0,1,0,1,0,0|2,0,0]=4 12436 B12R2.24 Fc1cnc2c(c1)CCCO2 Amb13889669 [0,1,0,1,0,0|2,0,0]=4 12437 B12R2.24 IC1CCc2ccccc2C1 Amb33714903 [0,1,0,1,0,0|2,0,0]=4 12438 B12R2.24 IC1CNc2ccccc2C1 Amb27642673 [0,1,0,1,0,0|2,0,0]=4 12439 B12R2.24 Ic1ccc2c(c1)CCCC2 Amb27402117 [0,1,0,1,0,0|2,0,0]=4 12440 B12R2.24 Ic1ccc2c(c1)CCCN2 Amb7785094 [0,1,0,1,0,0|2,0,0]=4 12441 B12R2.24 Ic1ccc2c(c1)CCCO2 Amb22498253 [0,1,0,1,0,0|1,0,0]=3 12442 B12R2.24 Ic1ccc2c(c1)CCCS2 Amb28188388 [0,1,0,1,0,0|1,1,0]=4 12443 B12R2.24 Ic1ccc2c(c1)NCCC2 Amb2383346 [0,1,0,1,0,0|2,0,0]=4 12444 B12R2.24 Ic1ccc2c(c1)OCCO2 Amb2723025 [0,1,0,1,0,0|0,0,0]=2 12445 B12R2.24 Ic1ccc2c(c1)SCCC2 Amb27945711 [0,1,0,1,0,0|1,1,0]=4 12446 B12R2.24 Ic1ccc2c(n1)CCCO2 Amb21959447 [0,1,0,1,0,0|2,0,0]=4 12447 B12R2.24 Ic1ccc2c(n1)NCCO2 Amb21962491 [0,1,0,1,0,0|2,0,0]=4 12448 B12R2.24 Ic1ccc2c(n1)OCCN2 Amb13890275 [0,1,0,1,0,0|2,0,0]=4 12449 B12R2.24 Ic1ccc2c(n1)OCCO2 Amb13889672 [0,1,0,1,0,0|1,0,0]=3 12450 B12R2.24 Ic1cnc2c(c1)CCCO2 Amb21961014 [0,1,0,1,0,0|2,0,0]=4 12451 B12R2.24 Ic1cnc2c(c1)OCCO2 Amb13889674 [0,1,0,1,0,0|1,0,0]=3 12452 B12R2.24 NC1=Nc2ccccc2OC1 Amb18124903 [0,1,0,1,0,0|1,0,1]=4 12453 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|1,0,1]=4 12454 B12R2.24 NC1CCc2ccccc2C1 Amb13952050 [0,1,0,1,0,0|2,0,0]=4 12455 B12R2.24 NC1CCc2ccccc2C1 Amb2383251 [0,1,0,1,0,0|2,0,0]=4 12456 B12R2.24 NC1CNc2ccccc2C1 Amb2694925 [0,1,0,1,0,0|2,0,0]=4 12457 B12R2.24 NC1COc2ccccc2C1 Amb7969877 [0,1,0,1,0,0|1,0,0]=3 12458 B12R2.24 NC1COc2ccccc2C1 Amb9725226 [0,1,0,1,0,0|1,0,0]=3 12459 B12R2.24 NC1COc2ncccc2C1 Amb27482927 [0,1,0,1,0,0|2,0,0]=4 12460 B12R2.24 N[C@@H]1CCc2ccccc2C1 Amb25113422 [0,1,0,1,0,0|2,0,0]=4 12461 B12R2.24 N[C@@H]1COc2ccccc2C1 Amb23385337 [0,1,0,1,0,0|1,0,0]=3 12462 B12R2.24 N[C@@H]1COc2ccccc2C1 Amb24485980 [0,1,0,1,0,0|1,0,0]=3 12463 B12R2.24 N[C@H]1CCc2ccccc2C1 Amb8383954 [0,1,0,1,0,0|2,0,0]=4 12464 B12R2.24 N[C@H]1CNc2ccccc2C1 Amb27165152 [0,1,0,1,0,0|2,0,0]=4 12465 B12R2.24 N[C@H]1COc2ccccc2C1 Amb22756584 [0,1,0,1,0,0|1,0,0]=3 12466 B12R2.24 N[C@H]1COc2ccccc2C1 Amb28313694 [0,1,0,1,0,0|1,0,0]=3 12467 B12R2.24 N[C@H]1CSc2ccccc2C1 Amb27489034 [0,1,0,1,0,0|1,1,0]=4 12468 B12R2.24 Nc1cc2c(cn1)OCCC2 Amb18201906 [0,1,0,1,0,0|2,0,0]=4 12469 B12R2.24 Nc1cc2c(cn1)OCCC2 Amb28592533 [0,1,0,1,0,0|2,0,0]=4 12470 B12R2.24 Nc1cc2c(cn1)OCCO2 Amb26851752 [0,1,0,1,0,0|1,0,0]=3 12471 B12R2.24 Nc1cc2c(cn1)OCCO2 Amb32662956 [0,1,0,1,0,0|1,0,0]=3 12472 B12R2.24 Nc1ccc2c(c1)C=CCO2 Amb23441460 [0,1,0,1,0,0|1,0,1]=4 12473 B12R2.24 Nc1ccc2c(c1)CCCC2 Amb1084712 [0,1,0,1,0,0|2,0,0]=4 12474 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb17598307 [0,1,0,1,0,0|2,0,0]=4 12475 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb6296581 [0,1,0,1,0,0|2,0,0]=4 12476 B12R2.24 Nc1ccc2c(c1)CCCO2 Amb13952453 [0,1,0,1,0,0|1,0,0]=3 12477 B12R2.24 Nc1ccc2c(c1)CCCS2 Amb18828001 [0,1,0,1,0,0|1,1,0]=4 12478 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb17598306 [0,1,0,1,0,0|2,0,0]=4 12479 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb22494228 [0,1,0,1,0,0|2,0,0]=4 12480 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb8387429 [0,1,0,1,0,0|2,0,0]=4 12481 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [0,1,0,1,0,0|1,0,0]=3 12482 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb31308216 [0,1,0,1,0,0|1,0,0]=3 12483 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb8388114 [0,1,0,1,0,0|1,0,0]=3 12484 B12R2.24 Nc1ccc2c(c1)NCCS2 Amb13881705 [0,1,0,1,0,0|1,1,0]=4 12485 B12R2.24 Nc1ccc2c(c1)OCCC2 Amb25324386 [0,1,0,1,0,0|1,0,0]=3 12486 B12R2.24 Nc1ccc2c(c1)OCCN2 Amb8388115 [0,1,0,1,0,0|1,0,0]=3 12487 B12R2.24 Nc1ccc2c(c1)OCCO2 Amb2539754 [0,1,0,1,0,0|0,0,0]=2 12488 B12R2.24 Nc1ccc2c(c1)OCCO2 Amb373423 [0,1,0,1,0,0|0,0,0]=2 12489 B12R2.24 Nc1ccc2c(n1)OCCO2 Amb26845570 [0,1,0,1,0,0|1,0,0]=3 12490 B12R2.24 Nc1ccc2c(n1)OCCO2 Amb32662864 [0,1,0,1,0,0|1,0,0]=3 12491 B12R2.24 Nc1cnc2c(c1)CCCO2 Amb21961016 [0,1,0,1,0,0|2,0,0]=4 12492 B12R2.24 Nc1cnc2c(c1)OCCO2 Amb21959405 [0,1,0,1,0,0|1,0,0]=3 12493 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [0,1,0,1,0,0|1,0,1]=4 12494 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,1,0,1,0,0|1,0,1]=4 12495 B12R2.24 O=C1COc2ccccc2C1 Amb15692703 [0,1,0,1,0,0|0,0,2]=4 12496 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [0,1,0,1,0,0|0,0,2]=4 12497 B12R2.24 O=C1COc2ccccc2O1 Amb2759474 [0,1,0,1,0,0|0,0,1]=3 12498 B12R2.24 OC1=Nc2ccccc2OC1 Amb22330533 [0,1,0,1,0,0|0,0,1]=3 12499 B12R2.24 OC1C=Cc2ccccc2S1 Amb27394776 [0,1,0,1,0,0|1,0,1]=4 12500 B12R2.24 OC1CCc2ccccc2C1 Amb2721268 [0,1,0,1,0,0|1,0,0]=3 12501 B12R2.24 OC1CCc2ccccc2N1 Amb27209313 [0,1,0,1,0,0|1,0,0]=3 12502 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,1,0,1,0,0|1,0,0]=3 12503 B12R2.24 OC1CN=C2C=CC=CN2C1 Amb17773345 [0,1,0,1,0,0|2,0,0]=4 12504 B12R2.24 OC1CN=C2C=CC=CN2C1 Amb17873523 [0,1,0,1,0,0|2,0,0]=4 12505 B12R2.24 OC1CNc2ccccc2C1 Amb33313463 [0,1,0,1,0,0|1,0,0]=3 12506 B12R2.24 OC1CNc2ccccc2C1 Amb33544228 [0,1,0,1,0,0|1,0,0]=3 12507 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,1,0,1,0,0|1,0,0]=3 12508 B12R2.24 OC1COc2ccccc2C1 Amb22498287 [0,1,0,1,0,0|0,0,0]=2 12509 B12R2.24 OC1COc2ccccc2O1 Amb10552971 [0,1,0,1,0,0|0,0,0]=2 12510 B12R2.24 OC1Cc2ccccc2CO1 Amb17593730 [0,1,0,1,0,0|2,0,0]=4 12511 B12R2.24 O[C@@H]1CCc2ccccc2C1 Amb25043599 [0,1,0,1,0,0|1,0,0]=3 12512 B12R2.24 O[C@@H]1CNc2ccccc2C1 Amb24426871 [0,1,0,1,0,0|1,0,0]=3 12513 B12R2.24 O[C@@H]1COc2ccccc2C1 Amb28321438 [0,1,0,1,0,0|0,0,0]=2 12514 B12R2.24 O[C@H]1CCc2ccccc2C1 Amb25149682 [0,1,0,1,0,0|1,0,0]=3 12515 B12R2.24 O[C@H]1CNc2ccccc2C1 Amb27617395 [0,1,0,1,0,0|1,0,0]=3 12516 B12R2.24 Oc1ccc2c(c1)CCCC2 Amb2722872 [0,1,0,1,0,0|2,0,0]=4 12517 B12R2.24 Oc1ccc2c(c1)CCCN2 Amb2697247 [0,1,0,1,0,0|2,0,0]=4 12518 B12R2.24 Oc1ccc2c(c1)CCCO2 Amb18243510 [0,1,0,1,0,0|1,0,0]=3 12519 B12R2.24 Oc1ccc2c(c1)CCCS2 Amb28284889 [0,1,0,1,0,0|1,1,0]=4 12520 B12R2.24 Oc1ccc2c(c1)NCCC2 Amb8387435 [0,1,0,1,0,0|2,0,0]=4 12521 B12R2.24 Oc1ccc2c(c1)NCCO2 Amb2698246 [0,1,0,1,0,0|1,0,0]=3 12522 B12R2.24 Oc1ccc2c(c1)NCCS2 Amb27798921 [0,1,0,1,0,0|1,1,0]=4 12523 B12R2.24 Oc1ccc2c(c1)OCC=C2 Amb27804492 [0,1,0,1,0,0|1,0,1]=4 12524 B12R2.24 Oc1ccc2c(c1)OCCC2 Amb18125116 [0,1,0,1,0,0|1,0,0]=3 12525 B12R2.24 Oc1ccc2c(c1)OCCN2 Amb22495584 [0,1,0,1,0,0|1,0,0]=3 12526 B12R2.24 Oc1ccc2c(c1)OCCO2 Amb1157176 [0,1,0,1,0,0|0,0,0]=2 12527 B12R2.24 Oc1ccc2c(c1)OCCS2 Amb28381286 [0,1,0,1,0,0|0,1,0]=3 12528 B12R2.24 Oc1ccc2c(c1)SCCN2 Amb27617318 [0,1,0,1,0,0|1,1,0]=4 12529 B12R2.24 Oc1ccc2c(c1)SCCO2 Amb22584035 [0,1,0,1,0,0|0,1,0]=3 12530 B12R2.24 Oc1ccc2c(n1)OCCN2 Amb27946520 [0,1,0,1,0,0|2,0,0]=4 12531 B12R2.24 Oc1cnc2c(c1)CCCO2 Amb26037495 [0,1,0,1,0,0|2,0,0]=4 12532 B12R2.24 Oc1cnc2c(c1)OCCO2 Amb19959863 [0,1,0,1,0,0|1,0,0]=3 12533 B12R2.24 S=C1COc2ccccc2N1 Amb10070958 [0,1,0,1,0,0|0,1,1]=4 12534 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,1,0,1,0,0|1,1,0]=4 12535 B12R2.24 SC1COc2ccccc2C1 Amb25949570 [0,1,0,1,0,0|0,1,0]=3 12536 B12R2.24 Sc1ccc2c(c1)CCCC2 Amb33528920 [0,1,0,1,0,0|2,0,0]=4 12537 B12R2.24 Sc1ccc2c(c1)CCCO2 Amb18180108 [0,1,0,1,0,0|1,0,0]=3 12538 B12R2.24 Sc1ccc2c(c1)CCCS2 Amb24509702 [0,1,0,1,0,0|1,1,0]=4 12539 B12R2.24 Sc1ccc2c(c1)NCCO2 Amb18664649 [0,1,0,1,0,0|1,0,0]=3 12540 B12R2.24 Sc1ccc2c(c1)OCCO2 Amb2370522 [0,1,0,1,0,0|0,0,0]=2 12541 B12R2.79 Brc1ccc([C@@H]2C[C@H]2Br)cc1 Amb27190975 [0,1,0,1,0,0|2,0,0]=4 12542 B12R2.79 CC1CC1c2ccc(F)cc2 Amb24662198 [0,1,0,1,0,0|2,0,0]=4 12543 B12R2.79 C[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25911997 [0,1,0,1,0,0|2,0,0]=4 12544 B12R2.79 C[C@H]1C[C@@H]1c2ccc(O)cc2 Amb27640651 [0,1,0,1,0,0|2,0,0]=4 12545 B12R2.79 Cc1ccc(C2CC2Br)cc1 Amb28118459 [0,1,0,1,0,0|2,0,0]=4 12546 B12R2.79 Cc1ccc(C2CC2N)cc1 Amb32664274 [0,1,0,1,0,0|2,0,0]=4 12547 B12R2.79 Cc1ccc(C2CC2N)cc1 Amb9677209 [0,1,0,1,0,0|2,0,0]=4 12548 B12R2.79 Cc1ccc([C@@H]2C[C@@H]2Br)cc1 Amb27439070 [0,1,0,1,0,0|2,0,0]=4 12549 B12R2.79 Cc1ccc([C@@H]2C[C@H]2Br)cc1 Amb26389107 [0,1,0,1,0,0|2,0,0]=4 12550 B12R2.79 Cc1ccc([C@@H]2C[C@H]2N)cc1 Amb24100233 [0,1,0,1,0,0|2,0,0]=4 12551 B12R2.79 Cc1ccc([C@@H]2C[C@H]2N)cc1 Amb28721264 [0,1,0,1,0,0|2,0,0]=4 12552 B12R2.79 Clc1ccc(C2CC2Br)cc1 Amb23454925 [0,1,0,1,0,0|2,0,0]=4 12553 B12R2.79 Clc1ccc([C@@H]2C[C@H]2Br)cc1 Amb28363985 [0,1,0,1,0,0|2,0,0]=4 12554 B12R2.79 Clc1ccc([C@@H]2C[C@H]2Cl)cc1 Amb27231822 [0,1,0,1,0,0|2,0,0]=4 12555 B12R2.79 Fc1ccc(C2CC2Br)cc1 Amb23454928 [0,1,0,1,0,0|2,0,0]=4 12556 B12R2.79 Fc1ccc([C@@H]2C[C@@H]2Br)cc1 Amb27448438 [0,1,0,1,0,0|2,0,0]=4 12557 B12R2.79 Fc1ccc([C@@H]2C[C@@H]2Cl)cc1 Amb27818091 [0,1,0,1,0,0|2,0,0]=4 12558 B12R2.79 Fc1ccc([C@@H]2C[C@H]2Cl)cc1 Amb27788419 [0,1,0,1,0,0|2,0,0]=4 12559 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb19346488 [0,1,0,1,0,0|2,0,0]=4 12560 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb9677215 [0,1,0,1,0,0|2,0,0]=4 12561 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb19373427 [0,1,0,1,0,0|2,0,0]=4 12562 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb9677201 [0,1,0,1,0,0|2,0,0]=4 12563 B12R2.79 NC1CC1c2ccc(F)cc2 Amb19514916 [0,1,0,1,0,0|2,0,0]=4 12564 B12R2.79 NC1CC1c2ccc(F)cc2 Amb9677217 [0,1,0,1,0,0|2,0,0]=4 12565 B12R2.79 NC1CC1c2ccc(I)cc2 Amb27954289 [0,1,0,1,0,0|2,0,0]=4 12566 B12R2.79 NC1CC1c2ccc(O)cc2 Amb17568133 [0,1,0,1,0,0|2,0,0]=4 12567 B12R2.79 NC1CC1c2ccc(O)cc2 Amb28465287 [0,1,0,1,0,0|2,0,0]=4 12568 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb24763920 [0,1,0,1,0,0|2,0,0]=4 12569 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb27233381 [0,1,0,1,0,0|2,0,0]=4 12570 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb34915312 [0,1,0,1,0,0|2,0,0]=4 12571 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb26432902 [0,1,0,1,0,0|2,0,0]=4 12572 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb33473669 [0,1,0,1,0,0|2,0,0]=4 12573 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24655057 [0,1,0,1,0,0|2,0,0]=4 12574 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb33032248 [0,1,0,1,0,0|2,0,0]=4 12575 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24100231 [0,1,0,1,0,0|2,0,0]=4 12576 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb30628659 [0,1,0,1,0,0|2,0,0]=4 12577 B12R2.79 N[C@@H]1C[C@H]1c2ccc(O)cc2 Amb27630075 [0,1,0,1,0,0|2,0,0]=4 12578 B12R2.79 N[C@H]1C[C@@H]1c2ccc(F)cc2 Amb25168877 [0,1,0,1,0,0|2,0,0]=4 12579 B12R2.79 N[C@H]1C[C@@H]1c2ccc(O)cc2 Amb33806315 [0,1,0,1,0,0|2,0,0]=4 12580 B12R2.79 N[C@H]1C[C@H]1c2ccc(O)cc2 Amb34915834 [0,1,0,1,0,0|2,0,0]=4 12581 B12R2.79 OC1CC1c2ccc(Cl)cc2 Amb27847198 [0,1,0,1,0,0|1,0,0]=3 12582 B12R2.132 BrC1CCc2ccc(I)cc21 Amb28143847 [0,1,0,1,0,0|2,0,0]=4 12583 B12R2.132 Brc1ccc2c(c1)C(Br)CC2 Amb24707166 [0,1,0,1,0,0|2,0,0]=4 12584 B12R2.132 CC1CNc2ccc(Br)cc21 Amb18561153 [0,1,0,1,0,0|2,0,0]=4 12585 B12R2.132 CC1CNc2ccc(Cl)cc21 Amb18063404 [0,1,0,1,0,0|2,0,0]=4 12586 B12R2.132 CC1CNc2ccc(F)cc21 Amb18063403 [0,1,0,1,0,0|2,0,0]=4 12587 B12R2.132 CC1CNc2ccc(N)cc21 Amb32658292 [0,1,0,1,0,0|2,0,0]=4 12588 B12R2.132 CC1CNc2ccc(O)cc21 Amb32658310 [0,1,0,1,0,0|2,0,0]=4 12589 B12R2.132 CN1COc2ccc(O)cc21 Amb27806103 [0,1,0,1,0,0|2,0,0]=4 12590 B12R2.132 Cc1ccc2c(c1)C(=O)CO2 Amb6683471 [0,1,0,1,0,0|0,0,2]=4 12591 B12R2.132 Cc1ccc2c(c1)C(C)CN2 Amb17040660 [0,1,0,1,0,0|2,0,0]=4 12592 B12R2.132 Cc1ccc2c(c1)C(Cl)CC2 Amb8630737 [0,1,0,1,0,0|2,0,0]=4 12593 B12R2.132 Cc1ccc2c(c1)C(N)CC2 Amb19301139 [0,1,0,1,0,0|2,0,0]=4 12594 B12R2.132 Cc1ccc2c(c1)C(N)CC2 Amb8630795 [0,1,0,1,0,0|2,0,0]=4 12595 B12R2.132 Cc1ccc2c(c1)C(N)CO2 Amb20626372 [0,1,0,1,0,0|1,0,0]=3 12596 B12R2.132 Cc1ccc2c(c1)C(N)CO2 Amb9735883 [0,1,0,1,0,0|1,0,0]=3 12597 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,1,0,0|1,0,0]=3 12598 B12R2.132 Cc1ccc2c(c1)C(O)CO2 Amb28383453 [0,1,0,1,0,0|0,0,0]=2 12599 B12R2.132 Cc1ccc2c(c1)C(S)CC2 Amb26657199 [0,1,0,1,0,0|1,1,0]=4 12600 B12R2.132 Cc1ccc2c(c1)[C@H](N)CC2 Amb25367187 [0,1,0,1,0,0|2,0,0]=4 12601 B12R2.132 Cc1ccc2occ(O)c2c1 Amb33299851 [0,1,0,1,0,0|0,0,2]=4 12602 B12R2.132 Clc1ccc2c(c1)C(Br)CC2 Amb33538443 [0,1,0,1,0,0|2,0,0]=4 12603 B12R2.132 Clc1ccc2c(c1)C(Cl)CC2 Amb8630756 [0,1,0,1,0,0|2,0,0]=4 12604 B12R2.132 FC1CCc2ccc(Br)cc21 Amb27445274 [0,1,0,1,0,0|2,0,0]=4 12605 B12R2.132 FC1CCc2ccc(Cl)cc21 Amb27441335 [0,1,0,1,0,0|2,0,0]=4 12606 B12R2.132 Fc1ccc2c(c1)C(Br)CC2 Amb33538444 [0,1,0,1,0,0|2,0,0]=4 12607 B12R2.132 Fc1ccc2c(c1)C(Cl)CC2 Amb17087975 [0,1,0,1,0,0|2,0,0]=4 12608 B12R2.132 NC1CCc2ccc(Br)cc21 Amb22277084 [0,1,0,1,0,0|2,0,0]=4 12609 B12R2.132 NC1CCc2ccc(Br)cc21 Amb2383225 [0,1,0,1,0,0|2,0,0]=4 12610 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb21964442 [0,1,0,1,0,0|2,0,0]=4 12611 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb2383223 [0,1,0,1,0,0|2,0,0]=4 12612 B12R2.132 NC1CCc2ccc(F)cc21 Amb19373327 [0,1,0,1,0,0|2,0,0]=4 12613 B12R2.132 NC1CCc2ccc(F)cc21 Amb2383224 [0,1,0,1,0,0|2,0,0]=4 12614 B12R2.132 NC1CCc2ccc(I)cc21 Amb28240959 [0,1,0,1,0,0|2,0,0]=4 12615 B12R2.132 NC1CCc2ccc(O)cc21 Amb20241032 [0,1,0,1,0,0|2,0,0]=4 12616 B12R2.132 NC1CNc2ccc(F)cc21 Amb27209967 [0,1,0,1,0,0|2,0,0]=4 12617 B12R2.132 NC1COc2ccc(Br)cc21 Amb22751415 [0,1,0,1,0,0|1,0,0]=3 12618 B12R2.132 NC1COc2ccc(Br)cc21 Amb9735886 [0,1,0,1,0,0|1,0,0]=3 12619 B12R2.132 NC1COc2ccc(Cl)cc21 Amb20626373 [0,1,0,1,0,0|1,0,0]=3 12620 B12R2.132 NC1COc2ccc(Cl)cc21 Amb9735885 [0,1,0,1,0,0|1,0,0]=3 12621 B12R2.132 NC1COc2ccc(F)cc21 Amb33548698 [0,1,0,1,0,0|1,0,0]=3 12622 B12R2.132 NC1COc2ccc(F)cc21 Amb9735884 [0,1,0,1,0,0|1,0,0]=3 12623 B12R2.132 NC1CSc2ccc(Br)cc21 Amb33531789 [0,1,0,1,0,0|1,1,0]=4 12624 B12R2.132 N[C@@H]1CCc2ccc(Br)cc21 Amb25890526 [0,1,0,1,0,0|2,0,0]=4 12625 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb16233798 [0,1,0,1,0,0|2,0,0]=4 12626 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb22388617 [0,1,0,1,0,0|2,0,0]=4 12627 B12R2.132 N[C@@H]1CCc2ccc(O)cc21 Amb10608774 [0,1,0,1,0,0|2,0,0]=4 12628 B12R2.132 N[C@@H]1CCc2ccc(O)cc21 Amb30869373 [0,1,0,1,0,0|2,0,0]=4 12629 B12R2.132 N[C@@H]1COc2ccc(Br)cc21 Amb24756687 [0,1,0,1,0,0|1,0,0]=3 12630 B12R2.132 N[C@@H]1COc2ccc(F)cc21 Amb26978831 [0,1,0,1,0,0|1,0,0]=3 12631 B12R2.132 N[C@H]1CCc2ccc(Br)cc21 Amb27441142 [0,1,0,1,0,0|2,0,0]=4 12632 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb22288710 [0,1,0,1,0,0|2,0,0]=4 12633 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb26976221 [0,1,0,1,0,0|2,0,0]=4 12634 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb19929575 [0,1,0,1,0,0|2,0,0]=4 12635 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb33623226 [0,1,0,1,0,0|2,0,0]=4 12636 B12R2.132 N[C@H]1COc2ccc(Br)cc21 Amb26056285 [0,1,0,1,0,0|1,0,0]=3 12637 B12R2.132 N[C@H]1COc2ccc(F)cc21 Amb26944792 [0,1,0,1,0,0|1,0,0]=3 12638 B12R2.132 N[C@H]1COc2ccc(F)cc21 Amb31291288 [0,1,0,1,0,0|1,0,0]=3 12639 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,1,0,0|0,0,2]=4 12640 B12R2.132 Nc1ccc2c(c1)C(F)CC2 Amb27808587 [0,1,0,1,0,0|2,0,0]=4 12641 B12R2.132 Nc1ccc2c(c1)C(N)CC2 Amb26642909 [0,1,0,1,0,0|2,0,0]=4 12642 B12R2.132 Nc1ccc2c(c1)C(O)CC2 Amb22490266 [0,1,0,1,0,0|1,0,0]=3 12643 B12R2.132 Nc1ccc2c(c1)[C@@H](N)CC2 Amb19889682 [0,1,0,1,0,0|2,0,0]=4 12644 B12R2.132 Nc1ccc2c(c1)[C@H](N)CC2 Amb19889681 [0,1,0,1,0,0|2,0,0]=4 12645 B12R2.132 O=C1COc2ccc(Br)cc21 Amb33534386 [0,1,0,1,0,0|0,0,2]=4 12646 B12R2.132 O=C1COc2ccc(Cl)cc21 Amb2383540 [0,1,0,1,0,0|0,0,2]=4 12647 B12R2.132 O=C1COc2ccc(F)cc21 Amb33534384 [0,1,0,1,0,0|0,0,2]=4 12648 B12R2.132 O=C1COc2ccc(O)cc21 Amb24061522 [0,1,0,1,0,0|0,0,2]=4 12649 B12R2.132 OC1CCc2ccc(Br)cc21 Amb17779324 [0,1,0,1,0,0|1,0,0]=3 12650 B12R2.132 OC1CCc2ccc(Cl)cc21 Amb8630738 [0,1,0,1,0,0|1,0,0]=3 12651 B12R2.132 OC1CCc2ccc(Cl)nc21 Amb16233494 [0,1,0,1,0,0|2,0,0]=4 12652 B12R2.132 OC1CCc2ccc(F)cc21 Amb17087925 [0,1,0,1,0,0|1,0,0]=3 12653 B12R2.132 OC1COc2ccc(Br)cc21 Amb22059757 [0,1,0,1,0,0|0,0,0]=2 12654 B12R2.132 OC1OCc2ccc(Br)cc21 Amb22751581 [0,1,0,1,0,0|2,0,0]=4 12655 B12R2.132 O[C@@H]1CCc2ccc(I)cc21 Amb28369043 [0,1,0,1,0,0|1,0,0]=3 12656 B12R2.132 Oc1ccc2c(c1)C(O)CO2 Amb27262935 [0,1,0,1,0,0|0,0,0]=2 12657 B12R2.132 Oc1ccc2c(c1)C(S)CC2 Amb32788617 [0,1,0,1,0,0|1,1,0]=4 12658 B12R2.132 Oc1ccc2c(c1)[C@H](O)CC2 Amb35615861 [0,1,0,1,0,0|1,0,0]=3 12659 B12R2.132 Oc1ccc2c(c1)[C@H](O)CO2 Amb27750231 [0,1,0,1,0,0|0,0,0]=2 12660 B12R2.132 Oc1ccc2occ(O)c2c1 Amb27974579 [0,1,0,1,0,0|0,0,2]=4 12661 B12R2.132 Oc1noc2ccc(Cl)cc12 Amb3430957 [0,1,0,1,0,0|1,0,1]=4 12662 B12R2.132 Oc1noc2ccc(I)cc12 Amb26022475 [0,1,0,1,0,0|1,0,1]=4 12663 B12R2.132 SC1CCc2ccc(Br)cc21 Amb25150782 [0,1,0,1,0,0|1,1,0]=4 12664 B12R2.294 Brc1ccc(CC2CC2)cc1 Amb26855885 [0,1,0,1,0,0|2,0,0]=4 12665 B12R2.294 Brc1ccc(CC2CO2)cc1 Amb29880790 [0,1,0,1,0,0|1,0,0]=3 12666 B12R2.294 Brc1ccc(CC2CO2)cn1 Amb33388415 [0,1,0,1,0,0|2,0,0]=4 12667 B12R2.294 Brc1ccc(CC2CO2)nc1 Amb33477137 [0,1,0,1,0,0|2,0,0]=4 12668 B12R2.294 Brc1ccc(NC2CC2)cc1 Amb27873756 [0,1,0,1,0,0|2,0,0]=4 12669 B12R2.294 Brc1ccc(OC2CC2)cc1 Amb22227906 [0,1,0,1,0,0|1,0,0]=3 12670 B12R2.294 Brc1ccc(OC2CC2)cn1 Amb27597461 [0,1,0,1,0,0|2,0,0]=4 12671 B12R2.294 Brc1ccc(OC2CC2)nc1 Amb23538034 [0,1,0,1,0,0|2,0,0]=4 12672 B12R2.294 Brc1ccc(SC2CC2)cc1 Amb25942947 [0,1,0,1,0,0|1,1,0]=4 12673 B12R2.294 Cc1ccc(CC2CO2)cc1 Amb28076534 [0,1,0,1,0,0|1,0,0]=3 12674 B12R2.294 Cc1ccc(CC2CO2)cn1 Amb25139245 [0,1,0,1,0,0|2,0,0]=4 12675 B12R2.294 Cc1ccc(CC2CO2)nc1 Amb33198457 [0,1,0,1,0,0|2,0,0]=4 12676 B12R2.294 Cc1ccc(OC2CC2)cn1 Amb27214180 [0,1,0,1,0,0|2,0,0]=4 12677 B12R2.294 Clc1ccc(CC2CC2)cc1 Amb22751349 [0,1,0,1,0,0|2,0,0]=4 12678 B12R2.294 Clc1ccc(CC2CO2)cc1 Amb24712110 [0,1,0,1,0,0|1,0,0]=3 12679 B12R2.294 Clc1ccc(CC2CO2)cn1 Amb33261539 [0,1,0,1,0,0|2,0,0]=4 12680 B12R2.294 Clc1ccc(CC2CO2)nc1 Amb33058517 [0,1,0,1,0,0|2,0,0]=4 12681 B12R2.294 Clc1ccc(OC2CC2)cc1 Amb24406546 [0,1,0,1,0,0|1,0,0]=3 12682 B12R2.294 Clc1ccc(OC2CC2)cn1 Amb26631892 [0,1,0,1,0,0|2,0,0]=4 12683 B12R2.294 Clc1ccc(OC2CC2)nc1 Amb25106898 [0,1,0,1,0,0|2,0,0]=4 12684 B12R2.294 Clc1ccc(SC2CC2)cc1 Amb27759428 [0,1,0,1,0,0|1,1,0]=4 12685 B12R2.294 Fc1ccc(CC2CO2)cc1 Amb24390098 [0,1,0,1,0,0|1,0,0]=3 12686 B12R2.294 Fc1ccc(CC2CO2)cn1 Amb33425827 [0,1,0,1,0,0|2,0,0]=4 12687 B12R2.294 Fc1ccc(CC2CO2)nc1 Amb33315846 [0,1,0,1,0,0|2,0,0]=4 12688 B12R2.294 Fc1ccc(NC2CC2)cc1 Amb18267946 [0,1,0,1,0,0|2,0,0]=4 12689 B12R2.294 Fc1ccc(OC2CC2)cc1 Amb25829442 [0,1,0,1,0,0|1,0,0]=3 12690 B12R2.294 Fc1ccc(OC2CC2)cn1 Amb25151416 [0,1,0,1,0,0|2,0,0]=4 12691 B12R2.294 Fc1ccc(OC2CC2)nc1 Amb27240918 [0,1,0,1,0,0|2,0,0]=4 12692 B12R2.294 Fc1ccc(SC2CC2)cc1 Amb24591737 [0,1,0,1,0,0|1,1,0]=4 12693 B12R2.294 Ic1ccc(OC2CC2)cc1 Amb26611021 [0,1,0,1,0,0|1,0,0]=3 12694 B12R2.294 Nc1ccc(CC2CC2)cc1 Amb27251947 [0,1,0,1,0,0|2,0,0]=4 12695 B12R2.294 Nc1ccc(NC2CC2)cc1 Amb9205211 [0,1,0,1,0,0|2,0,0]=4 12696 B12R2.294 Nc1ccc(OC2CC2)cc1 Amb22011836 [0,1,0,1,0,0|1,0,0]=3 12697 B12R2.294 Nc1ccc(OC2CC2)cn1 Amb25143981 [0,1,0,1,0,0|2,0,0]=4 12698 B12R2.294 Nc1ccc(OC2CC2)nc1 Amb26597352 [0,1,0,1,0,0|2,0,0]=4 12699 B12R2.294 Oc1ccc(NC2CC2)cc1 Amb27207191 [0,1,0,1,0,0|2,0,0]=4 12700 B12R2.294 Oc1ccc(OC2CC2)cc1 Amb24738590 [0,1,0,1,0,0|1,0,0]=3 12701 B12R2.294 Oc1ccc(SC2CC2)cc1 Amb24487005 [0,1,0,1,0,0|1,1,0]=4 12702 B12R2.294 Sc1ccc(OC2CC2)cc1 Amb24484395 [0,1,0,1,0,0|1,0,0]=3 12703 B12R2.1175 C=C1C=CC2(C=C1)OCCO2 Amb25151338 [0,1,0,1,0,0|0,0,1]=3 12704 B12R2.1728 NCC1Cc2ccc(F)cc21 Amb26416833 [0,1,0,1,0,0|2,0,0]=4 12705 B12R2.2302 Brc1ccc(C2CCC2)cc1 Amb20617091 [0,1,0,1,0,0|2,0,0]=4 12706 B12R2.2302 Brc1ccc(C2CCN2)cc1 Amb27867157 [0,1,0,1,0,0|2,0,0]=4 12707 B12R2.2302 Brc1ccc(C2CCN2)cc1 Amb30666626 [0,1,0,1,0,0|2,0,0]=4 12708 B12R2.2302 Brc1ccc(C2CCO2)cc1 Amb24414336 [0,1,0,1,0,0|1,0,0]=3 12709 B12R2.2302 Brc1ccc(N2CCC2)cc1 Amb27257916 [0,1,0,1,0,0|2,0,0]=4 12710 B12R2.2302 Cc1ccc(C2CCN2)cc1 Amb28136157 [0,1,0,1,0,0|2,0,0]=4 12711 B12R2.2302 Cc1ccc([C@H]2CCN2)cc1 Amb28189081 [0,1,0,1,0,0|2,0,0]=4 12712 B12R2.2302 Clc1ccc(C2CCN2)cc1 Amb19370175 [0,1,0,1,0,0|2,0,0]=4 12713 B12R2.2302 Clc1ccc(C2CCN2)cc1 Amb22059427 [0,1,0,1,0,0|2,0,0]=4 12714 B12R2.2302 Clc1ccc(C2CCO2)cc1 Amb24369540 [0,1,0,1,0,0|1,0,0]=3 12715 B12R2.2302 Fc1ccc(C2=CCO2)cc1 Amb2719092 [0,1,0,1,0,0|1,0,1]=4 12716 B12R2.2302 Fc1ccc(C2CCN2)cc1 Amb9753209 [0,1,0,1,0,0|2,0,0]=4 12717 B12R2.2302 Fc1ccc([C@@H]2CCN2)cc1 Amb27788317 [0,1,0,1,0,0|2,0,0]=4 12718 B12R2.2302 Ic1ccc(C2CCC2)cc1 Amb35718448 [0,1,0,1,0,0|2,0,0]=4 12719 B12R2.2302 Ic1ccc(C2CCN2)cc1 Amb27795449 [0,1,0,1,0,0|2,0,0]=4 12720 B12R2.2302 Nc1ccc(C2CCC2)cc1 Amb33527984 [0,1,0,1,0,0|2,0,0]=4 12721 B12R2.2302 Nc1ccc(C2CCC2)cc1 Amb34932708 [0,1,0,1,0,0|2,0,0]=4 12722 B12R2.2302 Nc1ccc(C2CCN2)cc1 Amb25843764 [0,1,0,1,0,0|2,0,0]=4 12723 B12R2.2302 Nc1ccc(C2CCO2)cc1 Amb25705796 [0,1,0,1,0,0|1,0,0]=3 12724 B12R2.2302 Nc1ccc(N2CCC2)cc1 Amb33543789 [0,1,0,1,0,0|2,0,0]=4 12725 B12R2.2302 Oc1ccc(C2CCC2)cc1 Amb20617093 [0,1,0,1,0,0|2,0,0]=4 12726 B12R2.2302 Oc1ccc(C2CCN2)cc1 Amb24533045 [0,1,0,1,0,0|2,0,0]=4 12727 B12R2.2302 Oc1ccc(C2CCO2)cc1 Amb33231206 [0,1,0,1,0,0|1,0,0]=3 12728 B12R2.2302 Oc1ccc([C@@H]2CCN2)cc1 Amb28318514 [0,1,0,1,0,0|2,0,0]=4 12729 B12R2.2302 Sc1ccc([C@H]2CCN2)cc1 Amb27597984 [0,1,0,1,0,0|2,0,0]=4 12730 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [0,1,0,1,0,0|2,0,0]=4 12731 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [0,1,0,1,0,0|2,0,0]=4 12732 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [0,1,0,1,0,0|2,0,0]=4 12733 B12R2.2 C1=C(c2ccccc2)NCC1 Amb17938860 [0,1,0,1,0,0|2,0,0]=4 12734 B12R2.2 C1=NCCN1c2ccccc2 Amb22527125 [0,1,0,1,0,0|2,0,0]=4 12735 B12R2.2 c1cc(C2CNCO2)ccn1 Amb18065319 [0,1,0,1,0,0|2,0,0]=4 12736 B12R2.2 c1cc(C2NCCO2)ccn1 Amb17334300 [0,1,0,1,0,0|2,0,0]=4 12737 B12R2.2 c1cc(C2OCCO2)ccn1 Amb17334309 [0,1,0,1,0,0|1,0,0]=3 12738 B12R2.2 c1ccc(B2OCCO2)nc1 Amb22490930 [0,1,0,1,0,0|1,0,0]=3 12739 B12R2.2 c1ccc(C2=NCCC2)cc1 Amb1106418 [0,1,0,1,0,0|2,0,0]=4 12740 B12R2.2 c1ccc(C2=NCCN2)cc1 Amb3940399 [0,1,0,1,0,0|2,0,0]=4 12741 B12R2.2 c1ccc(C2=NCCO2)cc1 Amb18063911 [0,1,0,1,0,0|1,0,0]=3 12742 B12R2.2 c1ccc(C2=NCCO2)nc1 Amb24100586 [0,1,0,1,0,0|2,0,0]=4 12743 B12R2.2 c1ccc(C2=NNCC2)cc1 Amb25354740 [0,1,0,1,0,0|2,0,0]=4 12744 B12R2.2 c1ccc(C2=NOCN2)cc1 Amb28120203 [0,1,0,1,0,0|2,0,0]=4 12745 B12R2.2 c1ccc(C2CCCC2)cc1 Amb9787161 [0,1,0,1,0,0|2,0,0]=4 12746 B12R2.2 c1ccc(C2CCCN2)cc1 Amb10808365 [0,1,0,1,0,0|2,0,0]=4 12747 B12R2.2 c1ccc(C2CCCN2)cc1 Amb9702996 [0,1,0,1,0,0|2,0,0]=4 12748 B12R2.2 c1ccc(C2CCCO2)cc1 Amb17334283 [0,1,0,1,0,0|1,0,0]=3 12749 B12R2.2 c1ccc(C2CCC[NH2+]2)cc1 Amb33512932 [0,1,0,1,0,0|2,0,0]=4 12750 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10069263 [0,1,0,1,0,0|2,0,0]=4 12751 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10072809 [0,1,0,1,0,0|2,0,0]=4 12752 B12R2.2 c1ccc(C2CCNC2)cc1 Amb701982 [0,1,0,1,0,0|2,0,0]=4 12753 B12R2.2 c1ccc(C2CCOC2)nc1 Amb24320768 [0,1,0,1,0,0|2,0,0]=4 12754 B12R2.2 c1ccc(C2CCSC2)cc1 Amb4140293 [0,1,0,1,0,0|1,1,0]=4 12755 B12R2.2 c1ccc(C2CC[NH2+]C2)cc1 Amb4258873 [0,1,0,1,0,0|2,0,0]=4 12756 B12R2.2 c1ccc(C2CNCO2)cc1 Amb18065307 [0,1,0,1,0,0|1,0,0]=3 12757 B12R2.2 c1ccc(C2CNCO2)nc1 Amb18065316 [0,1,0,1,0,0|2,0,0]=4 12758 B12R2.2 c1ccc(C2NCCO2)cc1 Amb17334284 [0,1,0,1,0,0|1,0,0]=3 12759 B12R2.2 c1ccc(C2NCCO2)nc1 Amb17334298 [0,1,0,1,0,0|2,0,0]=4 12760 B12R2.2 c1ccc(C2NCCP2)cc1 Amb27606514 [0,1,0,1,0,0|2,0,0]=4 12761 B12R2.2 c1ccc(C2NCCS2)cc1 Amb3466213 [0,1,0,1,0,0|1,1,0]=4 12762 B12R2.2 c1ccc(C2OCCO2)cc1 Amb9786741 [0,1,0,1,0,0|0,0,0]=2 12763 B12R2.2 c1ccc(C2OCCO2)nc1 Amb17334307 [0,1,0,1,0,0|1,0,0]=3 12764 B12R2.2 c1ccc(C2SCCS2)cc1 Amb23401446 [0,1,0,1,0,0|0,2,0]=4 12765 B12R2.2 c1ccc(N2CCCC2)cc1 Amb8391946 [0,1,0,1,0,0|2,0,0]=4 12766 B12R2.2 c1ccc(N2CCNC2)cc1 Amb27785561 [0,1,0,1,0,0|2,0,0]=4 12767 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb20241933 [0,1,0,1,0,0|2,0,0]=4 12768 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb8397178 [0,1,0,1,0,0|2,0,0]=4 12769 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb19888399 [0,1,0,1,0,0|2,0,0]=4 12770 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb27617269 [0,1,0,1,0,0|2,0,0]=4 12771 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb20241932 [0,1,0,1,0,0|2,0,0]=4 12772 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb8397179 [0,1,0,1,0,0|2,0,0]=4 12773 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb19887561 [0,1,0,1,0,0|2,0,0]=4 12774 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb24183516 [0,1,0,1,0,0|2,0,0]=4 12775 B12R2.2 c1ccc([C@H]2COCN2)cc1 Amb25877610 [0,1,0,1,0,0|2,0,0]=4 12776 B12R2.2 c1cncc(C2=NCCO2)c1 Amb10813641 [0,1,0,1,0,0|2,0,0]=4 12777 B12R2.2 c1cncc(C2CCOC2)c1 Amb24320767 [0,1,0,1,0,0|2,0,0]=4 12778 B12R2.2 c1cncc(C2CNCO2)c1 Amb18065317 [0,1,0,1,0,0|2,0,0]=4 12779 B12R2.2 c1cncc(C2NCCO2)c1 Amb17334299 [0,1,0,1,0,0|2,0,0]=4 12780 B12R2.2 c1cncc(C2OCCO2)c1 Amb17334308 [0,1,0,1,0,0|1,0,0]=3 12781 B12R2.2 c1ncc(C2OCCO2)cn1 Amb25710715 [0,1,0,1,0,0|2,0,0]=4 12782 B12R2.22 BrC1CC(c2ccccc2)C1 Amb27798250 [0,1,0,1,0,0|2,0,0]=4 12783 B12R2.22 Br[C@H]1C[C@@H](c2ccccc2)C1 Amb27166116 [0,1,0,1,0,0|2,0,0]=4 12784 B12R2.22 ClC1CC(c2ccccc2)C1 Amb35733980 [0,1,0,1,0,0|2,0,0]=4 12785 B12R2.22 NC1CC(c2ccccc2)C1 Amb19514746 [0,1,0,1,0,0|2,0,0]=4 12786 B12R2.22 NC1CC(c2ccccc2)C1 Amb9496746 [0,1,0,1,0,0|2,0,0]=4 12787 B12R2.22 NC1CN(c2ccccc2)C1 Amb23598844 [0,1,0,1,0,0|2,0,0]=4 12788 B12R2.22 NC1CN(c2ccccc2)C1 Amb30869768 [0,1,0,1,0,0|2,0,0]=4 12789 B12R2.22 N[C@H]1C[C@@H](c2ccccc2)C1 Amb23439754 [0,1,0,1,0,0|2,0,0]=4 12790 B12R2.22 N[C@H]1C[C@@H](c2ccccc2)C1 Amb32653334 [0,1,0,1,0,0|2,0,0]=4 12791 B12R2.22 N[C@H]1C[C@H](c2ccccc2)C1 Amb23439755 [0,1,0,1,0,0|2,0,0]=4 12792 B12R2.22 N[C@H]1C[C@H](c2ccccc2)C1 Amb33473674 [0,1,0,1,0,0|2,0,0]=4 12793 B12R2.22 OC1CC(c2ccccc2)C1 Amb33550604 [0,1,0,1,0,0|1,0,0]=3 12794 B12R2.22 OC1CN(c2ccccc2)C1 Amb23598700 [0,1,0,1,0,0|1,0,0]=3 12795 B12R2.22 OC1CN(c2cccnc2)C1 Amb23598855 [0,1,0,1,0,0|2,0,0]=4 12796 B12R2.22 O[C@H]1C[C@@H](c2ccccc2)C1 Amb27839916 [0,1,0,1,0,0|1,0,0]=3 12797 B12R2.22 O[C@H]1C[C@@H](c2ccncc2)C1 Amb27258016 [0,1,0,1,0,0|2,0,0]=4 12798 B12R2.22 O[C@H]1C[C@H](c2ccccc2)C1 Amb25749083 [0,1,0,1,0,0|1,0,0]=3 12799 B12R2.22 O[C@H]1C[C@H](c2ccccn2)C1 Amb27839913 [0,1,0,1,0,0|2,0,0]=4 12800 B12R2.22 O[C@H]1C[C@H](c2ccncc2)C1 Amb27802818 [0,1,0,1,0,0|2,0,0]=4 12801 B12R2.22 SC1CC(c2ccccc2)C1 Amb24690234 [0,1,0,1,0,0|1,1,0]=4 12802 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,1,0,1,0,0|2,0,0]=4 12803 B12R2.27 BrC[C@@H]1C[C@H]1c2ccccc2 Amb26055377 [0,1,0,1,0,0|2,0,0]=4 12804 B12R2.27 BrC[C@@H]1O[C@H]1c2ccccc2 Amb28249045 [0,1,0,1,0,0|1,0,0]=3 12805 B12R2.27 C#CC1OC1c2ccccc2 Amb28254723 [0,1,0,1,0,0|1,0,1]=4 12806 B12R2.27 C=CC1CC1c2ccccc2 Amb26889126 [0,1,0,1,0,0|2,0,0]=4 12807 B12R2.27 CC[C@@H]1O[C@H]1c2ccccc2 Amb27768002 [0,1,0,1,0,0|1,0,0]=3 12808 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,1,0,1,0,0|2,0,0]=4 12809 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,1,0,1,0,0|2,0,0]=4 12810 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb28056101 [0,1,0,1,0,0|2,0,0]=4 12811 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb33309625 [0,1,0,1,0,0|2,0,0]=4 12812 B12R2.27 ClC[C@@H]1O[C@@H]1c2ccccc2 Amb28457544 [0,1,0,1,0,0|1,0,0]=3 12813 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,1,0,1,0,0|2,0,0]=4 12814 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,1,0,1,0,0|2,0,0]=4 12815 B12R2.27 N#C[C@H]1C[C@@H]1c2ccccc2 Amb27613258 [0,1,0,1,0,0|2,0,0]=4 12816 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,1,0,1,0,0|2,0,0]=4 12817 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,1,0,1,0,0|2,0,0]=4 12818 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,1,0,1,0,0|1,0,0]=3 12819 B12R2.27 NC[C@@H]1C[C@@H]1c2ccccc2 Amb34916191 [0,1,0,1,0,0|2,0,0]=4 12820 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,1,0,1,0,0|2,0,0]=4 12821 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb32661485 [0,1,0,1,0,0|2,0,0]=4 12822 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,1,0,1,0,0|2,0,0]=4 12823 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb32664390 [0,1,0,1,0,0|2,0,0]=4 12824 B12R2.27 NC[C@H]1C[C@H]1c2ccccc2 Amb34916190 [0,1,0,1,0,0|2,0,0]=4 12825 B12R2.27 NC[C@H]1O[C@@H]1c2ccccc2 Amb27188182 [0,1,0,1,0,0|1,0,0]=3 12826 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|1,0,1]=4 12827 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [0,1,0,1,0,0|1,0,1]=4 12828 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|1,0,1]=4 12829 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [0,1,0,1,0,0|0,0,2]=4 12830 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [0,1,0,1,0,0|1,0,1]=4 12831 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [0,1,0,1,0,0|1,0,1]=4 12832 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [0,1,0,1,0,0|0,0,2]=4 12833 B12R2.27 OCC1=C(c2ccccc2)N1 Amb28197190 [0,1,0,1,0,0|1,0,1]=4 12834 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,1,0,1,0,0|1,0,0]=3 12835 B12R2.27 OCC1CC1c2ccccn2 Amb23536863 [0,1,0,1,0,0|2,0,0]=4 12836 B12R2.27 OCC1CC1c2ccncc2 Amb23536862 [0,1,0,1,0,0|2,0,0]=4 12837 B12R2.27 OCC1C[C@@H]1c2ccccc2 Amb28182630 [0,1,0,1,0,0|1,0,0]=3 12838 B12R2.27 OCC1C[C@H]1c2ccccc2 Amb28207313 [0,1,0,1,0,0|1,0,0]=3 12839 B12R2.27 OCC1N=C1c2ccccc2 Amb26560371 [0,1,0,1,0,0|1,0,0]=3 12840 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,1,0,1,0,0|0,0,0]=2 12841 B12R2.27 OC[C@@H]1C[C@@H]1c2ccccc2 Amb25917153 [0,1,0,1,0,0|1,0,0]=3 12842 B12R2.27 OC[C@@H]1C[C@@H]1c2cccnc2 Amb22744875 [0,1,0,1,0,0|2,0,0]=4 12843 B12R2.27 OC[C@@H]1C[C@@H]1c2ccncc2 Amb27485910 [0,1,0,1,0,0|2,0,0]=4 12844 B12R2.27 OC[C@@H]1C[C@H]1c2ccccc2 Amb28146004 [0,1,0,1,0,0|1,0,0]=3 12845 B12R2.27 OC[C@@H]1C[C@H]1c2ccccn2 Amb27968717 [0,1,0,1,0,0|2,0,0]=4 12846 B12R2.27 OC[C@H]1C[C@@H]1c2ccccc2 Amb3634122 [0,1,0,1,0,0|1,0,0]=3 12847 B12R2.27 OC[C@H]1C[C@@H]1c2ccccn2 Amb27428354 [0,1,0,1,0,0|2,0,0]=4 12848 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,1,0,1,0,0|0,0,0]=2 12849 B12R2.27 OC[C@H]1O[C@H]1c2ccccc2 Amb27432251 [0,1,0,1,0,0|0,0,0]=2 12850 B12R2.116 CC1(c2ccccc2)CCN1 Amb27263594 [0,1,0,1,0,0|2,0,0]=4 12851 B12R2.116 CC1(c2ccccc2)CCO1 Amb22497354 [0,1,0,1,0,0|1,0,0]=3 12852 B12R2.116 CC1(c2ccccn2)CCO1 Amb32642016 [0,1,0,1,0,0|2,0,0]=4 12853 B12R2.116 CC1(c2cccnc2)CCO1 Amb32642010 [0,1,0,1,0,0|2,0,0]=4 12854 B12R2.116 CC1(c2ccncc2)CCO1 Amb32642022 [0,1,0,1,0,0|2,0,0]=4 12855 B12R2.116 NC1(c2ccccc2)CCC1 Amb2371533 [0,1,0,1,0,0|2,0,0]=4 12856 B12R2.116 NC1(c2ccccc2)CCC1 Amb453192 [0,1,0,1,0,0|2,0,0]=4 12857 B12R2.116 OC1(c2ccccc2)CCC1 Amb33544160 [0,1,0,1,0,0|2,0,0]=4 12858 B12R2.235 CC1(c2ccccc2)CC1Br Amb27184089 [0,1,0,1,0,0|2,0,0]=4 12859 B12R2.235 CC1(c2ccccc2)CC1N Amb18947391 [0,1,0,1,0,0|2,0,0]=4 12860 B12R2.235 CC1(c2ccccc2)CC1N Amb33549909 [0,1,0,1,0,0|2,0,0]=4 12861 B12R2.235 C[C@@]1(c2ccccc2)CC1Cl Amb27791824 [0,1,0,1,0,0|2,0,0]=4 12862 B12R2.235 C[C@@]1(c2ccccc2)C[C@@H]1Br Amb28053371 [0,1,0,1,0,0|2,0,0]=4 12863 B12R2.235 C[C@@]1(c2ccccc2)C[C@H]1Br Amb28053370 [0,1,0,1,0,0|2,0,0]=4 12864 B12R2.235 C[C@@]1(c2ccccc2)C[C@H]1Cl Amb28458446 [0,1,0,1,0,0|2,0,0]=4 12865 B12R2.235 NC1CC1(F)c2ccccc2 Amb32663945 [0,1,0,1,0,0|2,0,0]=4 12866 B12R2.235 NC1CC1(F)c2ccccc2 Amb8389488 [0,1,0,1,0,0|2,0,0]=4 12867 B12R2.931 BrCCC1Cc2ccccc21 Amb28060024 [0,1,0,1,0,0|2,0,0]=4 12868 B12R2.931 CCNC1Cc2ccccc21 Amb27840306 [0,1,0,1,0,0|2,0,0]=4 12869 B12R2.931 ClCCC1Cc2ccccc21 Amb27260584 [0,1,0,1,0,0|2,0,0]=4 12870 B12R2.931 N#CCC1Cc2ccccc21 Amb27780963 [0,1,0,1,0,0|2,0,0]=4 12871 B12R2.931 NCCC1=Cc2ccccc21 Amb27866978 [0,1,0,1,0,0|2,0,0]=4 12872 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,1,0,1,0,0|1,0,0]=3 12873 B12R2.1081 BrC1=CCOc2ccccc21 Amb28385954 [0,1,0,1,0,0|1,0,1]=4 12874 B12R2.1081 BrC1CCCc2ccccc21 Amb8384413 [0,1,0,1,0,0|2,0,0]=4 12875 B12R2.1081 BrC1CCNc2ccccc21 Amb26657292 [0,1,0,1,0,0|2,0,0]=4 12876 B12R2.1081 BrC1CCOc2ccccc21 Amb9210662 [0,1,0,1,0,0|1,0,0]=3 12877 B12R2.1081 BrC1NCCc2ccccc21 Amb27176472 [0,1,0,1,0,0|2,0,0]=4 12878 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,1,0,1,0,0|2,0,0]=4 12879 B12R2.1081 Brc1cccc2c1CCCC2 Amb5494140 [0,1,0,1,0,0|2,0,0]=4 12880 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,1,0,1,0,0|2,0,0]=4 12881 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,1,0,1,0,0|2,0,0]=4 12882 B12R2.1081 Brc1cccc2c1CCCO2 Amb24081434 [0,1,0,1,0,0|1,0,0]=3 12883 B12R2.1081 Brc1cccc2c1CCCS2 Amb28292948 [0,1,0,1,0,0|1,1,0]=4 12884 B12R2.1081 Brc1cccc2c1COCO2 Amb26565178 [0,1,0,1,0,0|2,0,0]=4 12885 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,1,0,1,0,0|2,0,0]=4 12886 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,1,0,1,0,0|2,0,0]=4 12887 B12R2.1081 Brc1cccc2c1NCCO2 Amb28075686 [0,1,0,1,0,0|1,0,0]=3 12888 B12R2.1081 Brc1cccc2c1NCCS2 Amb22491567 [0,1,0,1,0,0|1,1,0]=4 12889 B12R2.1081 Brc1cccc2c1OCCC2 Amb18769314 [0,1,0,1,0,0|1,0,0]=3 12890 B12R2.1081 Brc1cccc2c1OCCN2 Amb21964594 [0,1,0,1,0,0|1,0,0]=3 12891 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,1,0,1,0,0|1,0,0]=3 12892 B12R2.1081 Brc1cccc2c1OCCO2 Amb20171376 [0,1,0,1,0,0|0,0,0]=2 12893 B12R2.1081 Brc1cccc2c1SCCC2 Amb18161542 [0,1,0,1,0,0|1,1,0]=4 12894 B12R2.1081 Brc1cccc2c1SCCN2 Amb25715188 [0,1,0,1,0,0|1,1,0]=4 12895 B12R2.1081 Brc1ccnc2c1OCCN2 Amb25070632 [0,1,0,1,0,0|2,0,0]=4 12896 B12R2.1081 Brc1cncc2c1CCCO2 Amb28384757 [0,1,0,1,0,0|2,0,0]=4 12897 B12R2.1081 Brc1cncc2c1NCCO2 Amb13890267 [0,1,0,1,0,0|2,0,0]=4 12898 B12R2.1081 Brc1cncc2c1OCCN2 Amb23403699 [0,1,0,1,0,0|2,0,0]=4 12899 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,1,0,1,0,0|2,0,0]=4 12900 B12R2.1081 C=C1CCNc2ccccc21 Amb27596012 [0,1,0,1,0,0|2,0,0]=4 12901 B12R2.1081 C=C1CCOc2ccccc21 Amb26360090 [0,1,0,1,0,0|1,0,0]=3 12902 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|1,0,1]=4 12903 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,1,0,1,0,0|2,0,0]=4 12904 B12R2.1081 CC1CCNc2ccccc21 Amb7969716 [0,1,0,1,0,0|2,0,0]=4 12905 B12R2.1081 CC1CCNc2ccccc21 Amb9782720 [0,1,0,1,0,0|2,0,0]=4 12906 B12R2.1081 CC1CCOc2ccccc21 Amb28194294 [0,1,0,1,0,0|1,0,0]=3 12907 B12R2.1081 CC1CCOc2ccncc21 Amb28400483 [0,1,0,1,0,0|2,0,0]=4 12908 B12R2.1081 CC1CNCc2ccccc21 Amb17399906 [0,1,0,1,0,0|2,0,0]=4 12909 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|2,0,0]=4 12910 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,1,0,1,0,0|1,0,0]=3 12911 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,1,0,1,0,0|2,0,0]=4 12912 B12R2.1081 CC1NCCc2ccccc21 Amb5735598 [0,1,0,1,0,0|2,0,0]=4 12913 B12R2.1081 CC1OCNc2ccccc21 Amb28118766 [0,1,0,1,0,0|2,0,0]=4 12914 B12R2.1081 CN1CCCc2ccccc21 Amb15692645 [0,1,0,1,0,0|2,0,0]=4 12915 B12R2.1081 CN1CCNc2ccccc21 Amb19957895 [0,1,0,1,0,0|2,0,0]=4 12916 B12R2.1081 CN1CCNc2ccccc21 Amb2383679 [0,1,0,1,0,0|2,0,0]=4 12917 B12R2.1081 CN1CCOc2ccccc21 Amb10569245 [0,1,0,1,0,0|1,0,0]=3 12918 B12R2.1081 CN1CCOc2cccnc21 Amb27487663 [0,1,0,1,0,0|2,0,0]=4 12919 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb30594264 [0,1,0,1,0,0|2,0,0]=4 12920 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,1,0,1,0,0|2,0,0]=4 12921 B12R2.1081 C[C@H]1NCCc2ccccc21 Amb28186683 [0,1,0,1,0,0|2,0,0]=4 12922 B12R2.1081 Cc1cccc2c1CCCC2 Amb22731111 [0,1,0,1,0,0|2,0,0]=4 12923 B12R2.1081 Cc1cccc2c1CCCN2 Amb19957907 [0,1,0,1,0,0|2,0,0]=4 12924 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,1,0,1,0,0|2,0,0]=4 12925 B12R2.1081 Cc1cccc2c1CCCO2 Amb27169746 [0,1,0,1,0,0|1,0,0]=3 12926 B12R2.1081 Cc1cccc2c1CCCS2 Amb27447859 [0,1,0,1,0,0|1,1,0]=4 12927 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,1,0,1,0,0|2,0,0]=4 12928 B12R2.1081 Cc1cccc2c1NCCN2 Amb26362323 [0,1,0,1,0,0|2,0,0]=4 12929 B12R2.1081 Cc1cccc2c1NCCO2 Amb26399115 [0,1,0,1,0,0|1,0,0]=3 12930 B12R2.1081 Cc1cccc2c1NCCS2 Amb27794442 [0,1,0,1,0,0|1,1,0]=4 12931 B12R2.1081 Cc1cccc2c1OCCN2 Amb2383441 [0,1,0,1,0,0|1,0,0]=3 12932 B12R2.1081 Cc1ccnc2c1NCCO2 Amb27645441 [0,1,0,1,0,0|2,0,0]=4 12933 B12R2.1081 Cc1ccnc2c1OCCN2 Amb25114182 [0,1,0,1,0,0|2,0,0]=4 12934 B12R2.1081 ClC1=CCOc2ccccc21 Amb27194523 [0,1,0,1,0,0|1,0,1]=4 12935 B12R2.1081 ClC1CCCc2ccccc21 Amb9204490 [0,1,0,1,0,0|2,0,0]=4 12936 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,1,0,1,0,0|2,0,0]=4 12937 B12R2.1081 ClC1CCOc2ccccc21 Amb33529009 [0,1,0,1,0,0|1,0,0]=3 12938 B12R2.1081 ClC1CCSc2ccccc21 Amb33529010 [0,1,0,1,0,0|1,1,0]=4 12939 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,1,0,1,0,0|1,0,0]=3 12940 B12R2.1081 ClC1CSCc2ccccc21 Amb27454843 [0,1,0,1,0,0|1,1,0]=4 12941 B12R2.1081 Clc1cccc2c1CCCN2 Amb19957902 [0,1,0,1,0,0|2,0,0]=4 12942 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,1,0,1,0,0|2,0,0]=4 12943 B12R2.1081 Clc1cccc2c1CCCS2 Amb27184149 [0,1,0,1,0,0|1,1,0]=4 12944 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,1,0,1,0,0|2,0,0]=4 12945 B12R2.1081 Clc1cccc2c1NCCC2 Amb19373263 [0,1,0,1,0,0|2,0,0]=4 12946 B12R2.1081 Clc1cccc2c1NCCO2 Amb25991021 [0,1,0,1,0,0|1,0,0]=3 12947 B12R2.1081 Clc1cccc2c1OCC=C2 Amb22586336 [0,1,0,1,0,0|1,0,1]=4 12948 B12R2.1081 Clc1cccc2c1OCCC2 Amb27831935 [0,1,0,1,0,0|1,0,0]=3 12949 B12R2.1081 Clc1cccc2c1OCCN2 Amb2383435 [0,1,0,1,0,0|1,0,0]=3 12950 B12R2.1081 Clc1cccc2c1SCCC2 Amb28203721 [0,1,0,1,0,0|1,1,0]=4 12951 B12R2.1081 Clc1ccnc2c1NCCO2 Amb25765845 [0,1,0,1,0,0|2,0,0]=4 12952 B12R2.1081 Clc1ccnc2c1OCCO2 Amb13889675 [0,1,0,1,0,0|1,0,0]=3 12953 B12R2.1081 Clc1cncc2c1OCCN2 Amb25150559 [0,1,0,1,0,0|2,0,0]=4 12954 B12R2.1081 Clc1nccc2c1NCCO2 Amb21964225 [0,1,0,1,0,0|2,0,0]=4 12955 B12R2.1081 Clc1nccc2c1OCCN2 Amb22899316 [0,1,0,1,0,0|2,0,0]=4 12956 B12R2.1081 FC1CCNc2ccccc21 Amb28079527 [0,1,0,1,0,0|2,0,0]=4 12957 B12R2.1081 FC1CNCc2ccccc21 Amb10841578 [0,1,0,1,0,0|2,0,0]=4 12958 B12R2.1081 Fc1cccc2c1CCCN2 Amb19958505 [0,1,0,1,0,0|2,0,0]=4 12959 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,1,0,1,0,0|2,0,0]=4 12960 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,1,0,1,0,0|2,0,0]=4 12961 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,1,0,1,0,0|2,0,0]=4 12962 B12R2.1081 Fc1cccc2c1NCCN2 Amb27780389 [0,1,0,1,0,0|2,0,0]=4 12963 B12R2.1081 Fc1cccc2c1NCCO2 Amb18831161 [0,1,0,1,0,0|1,0,0]=3 12964 B12R2.1081 Fc1cccc2c1OCC=C2 Amb22586337 [0,1,0,1,0,0|1,0,1]=4 12965 B12R2.1081 Fc1cccc2c1OCCC2 Amb24554425 [0,1,0,1,0,0|1,0,0]=3 12966 B12R2.1081 Fc1cccc2c1OCCN2 Amb2383436 [0,1,0,1,0,0|1,0,0]=3 12967 B12R2.1081 Fc1cccc2c1OCCO2 Amb26877785 [0,1,0,1,0,0|0,0,0]=2 12968 B12R2.1081 Fc1cccc2c1SCCN2 Amb27849615 [0,1,0,1,0,0|1,1,0]=4 12969 B12R2.1081 IC1CCCc2ccccc21 Amb33714900 [0,1,0,1,0,0|2,0,0]=4 12970 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,1,0,1,0,0|2,0,0]=4 12971 B12R2.1081 IC1CCOc2ccccc21 Amb28060969 [0,1,0,1,0,0|1,0,0]=3 12972 B12R2.1081 Ic1cccc2c1CCCC2 Amb8839224 [0,1,0,1,0,0|2,0,0]=4 12973 B12R2.1081 Ic1cccc2c1OCCC2 Amb25875739 [0,1,0,1,0,0|1,0,0]=3 12974 B12R2.1081 Ic1cccc2c1OCCN2 Amb2383443 [0,1,0,1,0,0|1,0,0]=3 12975 B12R2.1081 Ic1cccc2c1OCCO2 Amb22499097 [0,1,0,1,0,0|0,0,0]=2 12976 B12R2.1081 Ic1ccnc2c1OCCO2 Amb13889673 [0,1,0,1,0,0|1,0,0]=3 12977 B12R2.1081 Ic1cncc2c1OCCC2 Amb13889665 [0,1,0,1,0,0|2,0,0]=4 12978 B12R2.1081 Ic1nccc2c1OCCO2 Amb27439493 [0,1,0,1,0,0|1,0,0]=3 12979 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,1,0,1,0,0|2,0,0]=4 12980 B12R2.1081 NC1CCCc2ccccc21 Amb5716841 [0,1,0,1,0,0|2,0,0]=4 12981 B12R2.1081 NC1CCCc2ccccc21 Amb6334842 [0,1,0,1,0,0|2,0,0]=4 12982 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,1,0,1,0,0|2,0,0]=4 12983 B12R2.1081 NC1CCNc2ccccc21 Amb2700188 [0,1,0,1,0,0|2,0,0]=4 12984 B12R2.1081 NC1CCOc2ccccc21 Amb5717381 [0,1,0,1,0,0|1,0,0]=3 12985 B12R2.1081 NC1CCOc2ccccc21 Amb8333718 [0,1,0,1,0,0|1,0,0]=3 12986 B12R2.1081 NC1CCOc2cccnc21 Amb21858508 [0,1,0,1,0,0|2,0,0]=4 12987 B12R2.1081 NC1CCOc2ncccc21 Amb25806168 [0,1,0,1,0,0|2,0,0]=4 12988 B12R2.1081 NC1CCOc2ncccc21 Amb33620939 [0,1,0,1,0,0|2,0,0]=4 12989 B12R2.1081 NC1CCSc2ccccc21 Amb6891903 [0,1,0,1,0,0|1,1,0]=4 12990 B12R2.1081 NC1CCSc2ccccc21 Amb9703514 [0,1,0,1,0,0|1,1,0]=4 12991 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,1,0,1,0,0|2,0,0]=4 12992 B12R2.1081 NC1COCc2ccccc21 Amb10067658 [0,1,0,1,0,0|1,0,0]=3 12993 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,1,0,1,0,0|1,0,0]=3 12994 B12R2.1081 NC1CSCc2ccccc21 Amb10067686 [0,1,0,1,0,0|1,1,0]=4 12995 B12R2.1081 NC1CSCc2ccccc21 Amb9620859 [0,1,0,1,0,0|1,1,0]=4 12996 B12R2.1081 NN1CCCc2ccccc21 Amb33172813 [0,1,0,1,0,0|2,0,0]=4 12997 B12R2.1081 NN1CCCc2ccccc21 Amb836811 [0,1,0,1,0,0|2,0,0]=4 12998 B12R2.1081 NN1CCOc2ccccc21 Amb18125145 [0,1,0,1,0,0|1,0,0]=3 12999 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb10844952 [0,1,0,1,0,0|2,0,0]=4 13000 B12R2.1081 N[C@@H]1CCNc2ccccc21 Amb26012444 [0,1,0,1,0,0|2,0,0]=4 13001 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb13953038 [0,1,0,1,0,0|1,0,0]=3 13002 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,1,0,1,0,0|1,0,0]=3 13003 B12R2.1081 N[C@@H]1CCSc2ccccc21 Amb13952927 [0,1,0,1,0,0|1,1,0]=4 13004 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,1,0,1,0,0|2,0,0]=4 13005 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb8383429 [0,1,0,1,0,0|2,0,0]=4 13006 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,1,0,1,0,0|2,0,0]=4 13007 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb13953039 [0,1,0,1,0,0|1,0,0]=3 13008 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,1,0,1,0,0|1,0,0]=3 13009 B12R2.1081 N[C@H]1CCOc2cccnc21 Amb26551067 [0,1,0,1,0,0|2,0,0]=4 13010 B12R2.1081 N[C@H]1CCSc2ccccc21 Amb13952928 [0,1,0,1,0,0|1,1,0]=4 13011 B12R2.1081 N[C@H]1COCc2ccccc21 Amb27839884 [0,1,0,1,0,0|1,0,0]=3 13012 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|1,0,1]=4 13013 B12R2.1081 Nc1cccc2c1CCCC2 Amb1088906 [0,1,0,1,0,0|2,0,0]=4 13014 B12R2.1081 Nc1cccc2c1CCCN2 Amb33543645 [0,1,0,1,0,0|2,0,0]=4 13015 B12R2.1081 Nc1cccc2c1CCCO2 Amb17570000 [0,1,0,1,0,0|1,0,0]=3 13016 B12R2.1081 Nc1cccc2c1CCCO2 Amb31291594 [0,1,0,1,0,0|1,0,0]=3 13017 B12R2.1081 Nc1cccc2c1CCCS2 Amb27868696 [0,1,0,1,0,0|1,1,0]=4 13018 B12R2.1081 Nc1cccc2c1COCO2 Amb17570009 [0,1,0,1,0,0|2,0,0]=4 13019 B12R2.1081 Nc1cccc2c1NCCC2 Amb2606143 [0,1,0,1,0,0|2,0,0]=4 13020 B12R2.1081 Nc1cccc2c1NCCN2 Amb27404509 [0,1,0,1,0,0|2,0,0]=4 13021 B12R2.1081 Nc1cccc2c1NCCO2 Amb16191975 [0,1,0,1,0,0|1,0,0]=3 13022 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|1,0,1]=4 13023 B12R2.1081 Nc1cccc2c1OCCC2 Amb17569999 [0,1,0,1,0,0|1,0,0]=3 13024 B12R2.1081 Nc1cccc2c1OCCC2 Amb28652885 [0,1,0,1,0,0|1,0,0]=3 13025 B12R2.1081 Nc1cccc2c1OCCN2 Amb10067597 [0,1,0,1,0,0|1,0,0]=3 13026 B12R2.1081 Nc1cccc2c1OCCO2 Amb10071734 [0,1,0,1,0,0|0,0,0]=2 13027 B12R2.1081 Nc1cccc2c1OCCO2 Amb8009549 [0,1,0,1,0,0|0,0,0]=2 13028 B12R2.1081 Nc1cccc2c1OCCS2 Amb17570122 [0,1,0,1,0,0|0,1,0]=3 13029 B12R2.1081 Nc1cccc2c1OCOC2 Amb17570008 [0,1,0,1,0,0|2,0,0]=4 13030 B12R2.1081 Nc1ccnc2c1NCCO2 Amb24485900 [0,1,0,1,0,0|2,0,0]=4 13031 B12R2.1081 Nc1ccnc2c1OCCO2 Amb13889678 [0,1,0,1,0,0|1,0,0]=3 13032 B12R2.1081 Nc1ncnc2c1OCCO2 Amb18201154 [0,1,0,1,0,0|2,0,0]=4 13033 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,1,0,1,0,0|1,0,1]=4 13034 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,1,0,1,0,0|1,0,1]=4 13035 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,1,0,1,0,0|1,0,1]=4 13036 B12R2.1081 O=C1CCOc2ccccc21 Amb1153759 [0,1,0,1,0,0|0,0,1]=3 13037 B12R2.1081 O=C1CCOc2cccnc21 Amb33544080 [0,1,0,1,0,0|1,0,1]=4 13038 B12R2.1081 O=C1CCOc2cnccc21 Amb33742663 [0,1,0,1,0,0|1,0,1]=4 13039 B12R2.1081 O=C1CCOc2ncccc21 Amb24061183 [0,1,0,1,0,0|1,0,1]=4 13040 B12R2.1081 O=C1CCSc2ccccc21 Amb1151631 [0,1,0,1,0,0|0,1,1]=4 13041 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,1,0,1,0,0|0,0,2]=4 13042 B12R2.1081 O=S1CCNc2ccccc21 Amb1106281 [0,1,0,1,0,0|1,0,1]=4 13043 B12R2.1081 O=S1CCOc2ccccc21 Amb33189180 [0,1,0,1,0,0|0,0,1]=3 13044 B12R2.1081 OB1OCCc2ccccc21 Amb10070693 [0,1,0,1,0,0|2,0,0]=4 13045 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [0,1,0,1,0,0|0,0,2]=4 13046 B12R2.1081 OC1C=CSc2ccccc21 Amb27980705 [0,1,0,1,0,0|0,1,1]=4 13047 B12R2.1081 OC1CCCc2ccccc21 Amb9702810 [0,1,0,1,0,0|1,0,0]=3 13048 B12R2.1081 OC1CCCc2cccnc21 Amb17935812 [0,1,0,1,0,0|2,0,0]=4 13049 B12R2.1081 OC1CCCc2cccnc21 Amb8397302 [0,1,0,1,0,0|2,0,0]=4 13050 B12R2.1081 OC1CCCc2cnccc21 Amb23399822 [0,1,0,1,0,0|2,0,0]=4 13051 B12R2.1081 OC1CCNc2ccccc21 Amb10553386 [0,1,0,1,0,0|1,0,0]=3 13052 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|1,0,0]=3 13053 B12R2.1081 OC1CCNc2ncccc21 Amb25931080 [0,1,0,1,0,0|2,0,0]=4 13054 B12R2.1081 OC1CCOc2ccccc21 Amb2719725 [0,1,0,1,0,0|0,0,0]=2 13055 B12R2.1081 OC1CCOc2cccnc21 Amb16233154 [0,1,0,1,0,0|1,0,0]=3 13056 B12R2.1081 OC1CCOc2cnccc21 Amb33733614 [0,1,0,1,0,0|1,0,0]=3 13057 B12R2.1081 OC1CCOc2ncccc21 Amb26071627 [0,1,0,1,0,0|1,0,0]=3 13058 B12R2.1081 OC1CCSc2ccccc21 Amb9748233 [0,1,0,1,0,0|0,1,0]=3 13059 B12R2.1081 OC1CNCc2ccccc21 Amb16233378 [0,1,0,1,0,0|1,0,0]=3 13060 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|1,0,0]=3 13061 B12R2.1081 OC1CNCc2ncccc21 Amb18201914 [0,1,0,1,0,0|2,0,0]=4 13062 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,1,0,1,0,0|0,0,0]=2 13063 B12R2.1081 OC1CSCc2ccccc21 Amb9619601 [0,1,0,1,0,0|0,1,0]=3 13064 B12R2.1081 OC1OCCc2ccccc21 Amb27860258 [0,1,0,1,0,0|1,0,0]=3 13065 B12R2.1081 ON1CC=Cc2ccccc21 Amb26600953 [0,1,0,1,0,0|1,0,1]=4 13066 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,1,0,1,0,0|0,0,1]=3 13067 B12R2.1081 O[C@@H]1CC=Cc2ccccc21 Amb8384066 [0,1,0,1,0,0|1,0,0]=3 13068 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,1,0,1,0,0|1,0,0]=3 13069 B12R2.1081 O[C@@H]1CCCc2cccnc21 Amb24062853 [0,1,0,1,0,0|2,0,0]=4 13070 B12R2.1081 O[C@@H]1CCCc2cnccc21 Amb28065163 [0,1,0,1,0,0|2,0,0]=4 13071 B12R2.1081 O[C@@H]1CCCc2ncccc21 Amb26874431 [0,1,0,1,0,0|2,0,0]=4 13072 B12R2.1081 O[C@@H]1CCOc2ccccc21 Amb561634 [0,1,0,1,0,0|0,0,0]=2 13073 B12R2.1081 O[C@@H]1CCSc2ccccc21 Amb13952924 [0,1,0,1,0,0|0,1,0]=3 13074 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,1,0,1,0,0|0,0,0]=2 13075 B12R2.1081 O[C@@H]1CSCc2ccccc21 Amb27836959 [0,1,0,1,0,0|0,1,0]=3 13076 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [0,1,0,1,0,0|1,0,1]=4 13077 B12R2.1081 O[C@H]1C=COc2ccccc21 Amb27589685 [0,1,0,1,0,0|0,0,1]=3 13078 B12R2.1081 O[C@H]1CC=Cc2ccccc21 Amb27804916 [0,1,0,1,0,0|1,0,0]=3 13079 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,1,0,1,0,0|1,0,0]=3 13080 B12R2.1081 O[C@H]1CCCc2cccnc21 Amb24083650 [0,1,0,1,0,0|2,0,0]=4 13081 B12R2.1081 O[C@H]1CCCc2cnccc21 Amb32698572 [0,1,0,1,0,0|2,0,0]=4 13082 B12R2.1081 O[C@H]1CCOc2ccccc21 Amb2609035 [0,1,0,1,0,0|0,0,0]=2 13083 B12R2.1081 O[C@H]1CCSc2ccccc21 Amb13952926 [0,1,0,1,0,0|0,1,0]=3 13084 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|1,0,0]=3 13085 B12R2.1081 Oc1cccc2c1CCCC2 Amb33550500 [0,1,0,1,0,0|2,0,0]=4 13086 B12R2.1081 Oc1cccc2c1CCCN2 Amb18124994 [0,1,0,1,0,0|2,0,0]=4 13087 B12R2.1081 Oc1cccc2c1CCCS2 Amb27628967 [0,1,0,1,0,0|1,1,0]=4 13088 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,1,0,1,0,0|2,0,0]=4 13089 B12R2.1081 Oc1cccc2c1OCC=C2 Amb27786332 [0,1,0,1,0,0|1,0,1]=4 13090 B12R2.1081 Oc1cccc2c1OCCC2 Amb25142441 [0,1,0,1,0,0|1,0,0]=3 13091 B12R2.1081 Oc1cccc2c1OCCO2 Amb2548386 [0,1,0,1,0,0|0,0,0]=2 13092 B12R2.1081 Oc1cccc2c1SCCC2 Amb24715725 [0,1,0,1,0,0|1,1,0]=4 13093 B12R2.1081 Oc1ccnc2c1OCCC2 Amb24455519 [0,1,0,1,0,0|2,0,0]=4 13094 B12R2.1081 Oc1ccnc2c1OCCO2 Amb13889680 [0,1,0,1,0,0|1,0,0]=3 13095 B12R2.1081 SC1CCCc2ccccc21 Amb9208036 [0,1,0,1,0,0|1,1,0]=4 13096 B12R2.1081 SC1CCNc2ccccc21 Amb26423876 [0,1,0,1,0,0|1,1,0]=4 13097 B12R2.1081 SC1CCOc2ccccc21 Amb9208037 [0,1,0,1,0,0|0,1,0]=3 13098 B12R2.1081 SC1CCSc2ccccc21 Amb9208043 [0,1,0,1,0,0|0,2,0]=4 13099 B12R2.1081 SC1COCc2ccccc21 Amb28349489 [0,1,0,1,0,0|0,1,0]=3 13100 B12R2.1081 SC1CSCc2ccccc21 Amb32788444 [0,1,0,1,0,0|0,2,0]=4 13101 B12R2.1081 Sc1cccc2c1CCCC2 Amb5494141 [0,1,0,1,0,0|2,0,0]=4 13102 B12R2.1081 Sc1cccc2c1OCCO2 Amb24688690 [0,1,0,1,0,0|0,0,0]=2 13103 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,1,0,1,0,0|2,0,0]=4 13104 B12R2.2028 BrC1CC(Br)c2ccccc21 Amb28136954 [0,1,0,1,0,0|2,0,0]=4 13105 B12R2.2028 C=C1CC(O)c2ccncc21 Amb25863928 [0,1,0,1,0,0|2,0,0]=4 13106 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [0,1,0,1,0,0|1,0,1]=4 13107 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,1,0,1,0,0|2,0,0]=4 13108 B12R2.2028 CC1CC(Cl)c2ccccc21 Amb27413208 [0,1,0,1,0,0|2,0,0]=4 13109 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,1,0,1,0,0|2,0,0]=4 13110 B12R2.2028 CC1CC(N)c2ccccc21 Amb6705561 [0,1,0,1,0,0|2,0,0]=4 13111 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,1,0,1,0,0|1,1,0]=4 13112 B12R2.2028 CC1CN(C)c2ccccc21 Amb5718018 [0,1,0,1,0,0|2,0,0]=4 13113 B12R2.2028 CN1CC(N)c2ccccc21 Amb26601033 [0,1,0,1,0,0|2,0,0]=4 13114 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|2,0,0]=4 13115 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccccc21 Amb27623223 [0,1,0,1,0,0|1,0,0]=3 13116 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccncc21 Amb25102087 [0,1,0,1,0,0|2,0,0]=4 13117 B12R2.2028 C[C@@H]1OC(O)c2ccccc21 Amb26648832 [0,1,0,1,0,0|2,0,0]=4 13118 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|2,0,0]=4 13119 B12R2.2028 C[C@H]1O[C@@H](O)c2ccccc21 Amb28142292 [0,1,0,1,0,0|2,0,0]=4 13120 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,1,0,1,0,0|2,0,0]=4 13121 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|2,0,0]=4 13122 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,1,0,1,0,0|2,0,0]=4 13123 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,1,0,1,0,0|2,0,0]=4 13124 B12R2.2028 NC1CC(O)c2ccccc21 Amb17470387 [0,1,0,1,0,0|1,0,0]=3 13125 B12R2.2028 NC1CC(S)c2ccccc21 Amb32788269 [0,1,0,1,0,0|1,1,0]=4 13126 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,1,0,1,0,0|2,0,0]=4 13127 B12R2.2028 N[C@@H]1C[C@@H](N)c2ccccc21 Amb27627309 [0,1,0,1,0,0|2,0,0]=4 13128 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,1,0,0|1,0,0]=3 13129 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,1,0,0|1,0,0]=3 13130 B12R2.2028 N[C@H]1C[C@@H](N)c2ccccc21 Amb27468638 [0,1,0,1,0,0|2,0,0]=4 13131 B12R2.2028 N[C@H]1C[C@@H](O)c2ccccc21 Amb27810799 [0,1,0,1,0,0|1,0,0]=3 13132 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,1,0,1,0,0|2,0,0]=4 13133 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,1,0,1,0,0|2,0,0]=4 13134 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,1,0,1,0,0|2,0,0]=4 13135 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,1,0,1,0,0|2,0,0]=4 13136 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,1,0,1,0,0|1,0,0]=3 13137 B12R2.2028 O=C1CC(O)c2cccnc21 Amb22750353 [0,1,0,1,0,0|2,0,0]=4 13138 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [0,1,0,1,0,0|2,0,0]=4 13139 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [0,1,0,1,0,0|2,0,0]=4 13140 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [0,1,0,1,0,0|2,0,0]=4 13141 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [0,1,0,1,0,0|2,0,0]=4 13142 B12R2.2028 OB1OC(O)c2ccccc21 Amb27425186 [0,1,0,1,0,0|2,0,0]=4 13143 B12R2.2028 OC1CC(O)c2ccccc21 Amb1110942 [0,1,0,1,0,0|1,0,0]=3 13144 B12R2.2028 OC1NC(=S)c2ccccc21 Amb28198939 [0,1,0,1,0,0|2,0,0]=4 13145 B12R2.2028 OC1NC(O)c2ccccc21 Amb24441685 [0,1,0,1,0,0|2,0,0]=4 13146 B12R2.2028 OC1OC(O)c2ccccc21 Amb27455100 [0,1,0,1,0,0|2,0,0]=4 13147 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc21 Amb17938072 [0,1,0,1,0,0|1,0,0]=3 13148 B12R2.2028 O[C@H]1C[C@H](O)c2ccccc21 Amb10068281 [0,1,0,1,0,0|1,0,0]=3 13149 B12R2.2047 C[C@H]1c2ccccc2[C@@H]1CO Amb28435749 [0,1,0,1,0,0|1,0,0]=3 13150 B12R2.2075 Br[C@@H](c1ccccc1)[C@@H]2CO2 Amb27204462 [0,1,0,1,0,0|1,0,0]=3 13151 B12R2.2075 C=C(c1ccccc1)C2CC2 Amb27856321 [0,1,0,1,0,0|2,0,0]=4 13152 B12R2.2075 CC(c1ccccc1)C2CO2 Amb33540219 [0,1,0,1,0,0|1,0,0]=3 13153 B12R2.2075 CC(c1ccccc1)[C@@H]2CO2 Amb33082137 [0,1,0,1,0,0|1,0,0]=3 13154 B12R2.2075 CC(c1ccccc1)[C@H]2CO2 Amb33082136 [0,1,0,1,0,0|1,0,0]=3 13155 B12R2.2075 CN(c1ccccc1)C2CC2 Amb26509274 [0,1,0,1,0,0|2,0,0]=4 13156 B12R2.2075 Cl[C@@H](c1ccccc1)[C@@H]2CO2 Amb27865491 [0,1,0,1,0,0|1,0,0]=3 13157 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,1,0,1,0,0|2,0,0]=4 13158 B12R2.2075 NC(c1ccccc1)C2CC2 Amb482312 [0,1,0,1,0,0|2,0,0]=4 13159 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb22406366 [0,1,0,1,0,0|2,0,0]=4 13160 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb26960416 [0,1,0,1,0,0|2,0,0]=4 13161 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22406367 [0,1,0,1,0,0|2,0,0]=4 13162 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22744981 [0,1,0,1,0,0|2,0,0]=4 13163 B12R2.2075 O=C(c1ccccc1)C2CC2 Amb4115715 [0,1,0,1,0,0|2,0,0]=4 13164 B12R2.2075 OC(c1ccccc1)C2CC2 Amb33534747 [0,1,0,1,0,0|2,0,0]=4 13165 B12R2.2075 OC(c1ccccc1)C2CO2 Amb27210172 [0,1,0,1,0,0|1,0,0]=3 13166 B12R2.2075 O[C@@H](c1ccccc1)C2CO2 Amb27839920 [0,1,0,1,0,0|1,0,0]=3 13167 B12R2.2075 O[C@H](c1ccccc1)C2CC2 Amb27955379 [0,1,0,1,0,0|2,0,0]=4 13168 B12R2.2075 O[C@H](c1ccccc1)C2CO2 Amb27593359 [0,1,0,1,0,0|1,0,0]=3 13169 B12R2.2075 O[C@H](c1ccccc1)[C@@H]2CO2 Amb27448761 [0,1,0,1,0,0|1,0,0]=3 13170 B12R2.2075 SC(c1ccccc1)C2CC2 Amb33537940 [0,1,0,1,0,0|2,0,0]=4 13171 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [0,1,0,1,0,0|2,0,0]=4 13172 B12R2.32 BrCC1Cc2ccccc2O1 Amb17040446 [0,1,0,1,0,0|1,0,0]=3 13173 B12R2.32 BrCC1Cc2ccccc2S1 Amb27826930 [0,1,0,1,0,0|1,1,0]=4 13174 B12R2.32 BrCc1cc2ccccc2o1 Amb9175042 [0,1,0,1,0,0|1,0,1]=4 13175 B12R2.32 BrCc1nc2ccccc2o1 Amb21856130 [0,1,0,1,0,0|1,0,1]=4 13176 B12R2.32 CCC1Cc2ccccc2N1 Amb27238349 [0,1,0,1,0,0|2,0,0]=4 13177 B12R2.32 CCC1Nc2ccccc2O1 Amb28046870 [0,1,0,1,0,0|1,0,0]=3 13178 B12R2.32 CC[n+]1cc2ccccc2o1 Amb4010969 [0,1,0,1,0,0|2,0,0]=4 13179 B12R2.32 CCc1cc2ccccc2o1 Amb6608886 [0,1,0,1,0,0|1,0,1]=4 13180 B12R2.32 CCc1nc2ccccc2o1 Amb5494065 [0,1,0,1,0,0|1,0,1]=4 13181 B12R2.32 ClCC1Cc2ccccc2C1 Amb27395181 [0,1,0,1,0,0|2,0,0]=4 13182 B12R2.32 ClCC1Cc2ccccc2O1 Amb33550114 [0,1,0,1,0,0|1,0,0]=3 13183 B12R2.32 ClCc1cc2ccccc2o1 Amb9004317 [0,1,0,1,0,0|1,0,1]=4 13184 B12R2.32 ClCc1nc2ccccc2o1 Amb436733 [0,1,0,1,0,0|1,0,1]=4 13185 B12R2.32 ICC1Cc2ccccc2C1 Amb27460286 [0,1,0,1,0,0|2,0,0]=4 13186 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,1,0,1,0,0|1,0,0]=3 13187 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [0,1,0,1,0,0|2,0,0]=4 13188 B12R2.32 NCC1Cc2ccccc2C1 Amb9675770 [0,1,0,1,0,0|2,0,0]=4 13189 B12R2.32 NCC1Cc2ccccc2O1 Amb2723363 [0,1,0,1,0,0|1,0,0]=3 13190 B12R2.32 NCC1Cc2ccccc2O1 Amb9717685 [0,1,0,1,0,0|1,0,0]=3 13191 B12R2.32 NCC1Oc2ccccc2O1 Amb24060644 [0,1,0,1,0,0|1,0,0]=3 13192 B12R2.32 NC[C@@H]1Cc2ccccc2N1 Amb27606056 [0,1,0,1,0,0|2,0,0]=4 13193 B12R2.32 NCc1cc2ccccc2o1 Amb6271209 [0,1,0,1,0,0|1,0,1]=4 13194 B12R2.32 NCc1cc2ccccc2o1 Amb9176345 [0,1,0,1,0,0|1,0,1]=4 13195 B12R2.32 NCc1nc2ccccc2o1 Amb1102725 [0,1,0,1,0,0|1,0,1]=4 13196 B12R2.32 NCc1nc2ccccc2o1 Amb8503469 [0,1,0,1,0,0|1,0,1]=4 13197 B12R2.32 O=CC1Oc2ccccc2O1 Amb27409489 [0,1,0,1,0,0|0,0,2]=4 13198 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,1,0,1,0,0|1,0,0]=3 13199 B12R2.32 OCC1Cc2ccccc2N1 Amb2724872 [0,1,0,1,0,0|1,0,0]=3 13200 B12R2.32 OCC1Cc2ccccc2O1 Amb9782879 [0,1,0,1,0,0|0,0,0]=2 13201 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|1,0,0]=3 13202 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|1,0,0]=3 13203 B12R2.32 OCc1cc2ccccc2o1 Amb1156663 [0,1,0,1,0,0|0,0,1]=3 13204 B12R2.32 OCc1cc2ccccc2s1 Amb2688765 [0,1,0,1,0,0|0,1,1]=4 13205 B12R2.32 OCc1cc2cnccc2o1 Amb23536096 [0,1,0,1,0,0|1,0,1]=4 13206 B12R2.32 OCc1nc2ccccc2o1 Amb9421672 [0,1,0,1,0,0|0,0,1]=3 13207 B12R2.32 OCc1nc2ccccc2s1 Amb6335235 [0,1,0,1,0,0|0,1,1]=4 13208 B12R2.32 ONC1Cc2ccccc2C1 Amb27648605 [0,1,0,1,0,0|2,0,0]=4 13209 B12R2.32 ONc1nc2ccccc2o1 Amb28127982 [0,1,0,1,0,0|1,0,1]=4 13210 B12R2.32 SCC1Cc2ccccc2C1 Amb33342304 [0,1,0,1,0,0|1,1,0]=4 13211 B12R2.32 SCc1cc2ccccc2o1 Amb32788142 [0,1,0,1,0,0|0,1,1]=4 13212 B12R2.115 Br[C@@H]1C[C@H]1c2ccccc2I Amb27618991 [0,1,0,1,0,0|2,0,0]=4 13213 B12R2.115 Brc1ccccc1[C@@H]2C[C@H]2Br Amb27253972 [0,1,0,1,0,0|2,0,0]=4 13214 B12R2.115 CC1CC1c2ccccc2O Amb28246506 [0,1,0,1,0,0|2,0,0]=4 13215 B12R2.115 Cc1ccccc1C2CC2Cl Amb27863768 [0,1,0,1,0,0|2,0,0]=4 13216 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,1,0,1,0,0|2,0,0]=4 13217 B12R2.115 Cc1ccccc1C2CC2N Amb9677208 [0,1,0,1,0,0|2,0,0]=4 13218 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,1,0,1,0,0|2,0,0]=4 13219 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb32663427 [0,1,0,1,0,0|2,0,0]=4 13220 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,1,0,1,0,0|2,0,0]=4 13221 B12R2.115 Clc1ccccc1[C@@H]2C[C@H]2Br Amb27814773 [0,1,0,1,0,0|2,0,0]=4 13222 B12R2.115 Fc1ccccc1[C@@H]2C[C@H]2Br Amb27592280 [0,1,0,1,0,0|2,0,0]=4 13223 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,1,0,1,0,0|2,0,0]=4 13224 B12R2.115 NC1CC1c2ccccc2Br Amb9677239 [0,1,0,1,0,0|2,0,0]=4 13225 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,1,0,1,0,0|2,0,0]=4 13226 B12R2.115 NC1CC1c2ccccc2Cl Amb9677226 [0,1,0,1,0,0|2,0,0]=4 13227 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,1,0,1,0,0|2,0,0]=4 13228 B12R2.115 NC1CC1c2ccccc2F Amb9677241 [0,1,0,1,0,0|2,0,0]=4 13229 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,1,0,1,0,0|2,0,0]=4 13230 B12R2.115 N[C@@H]1C[C@@H]1c2ccccc2F Amb34916223 [0,1,0,1,0,0|2,0,0]=4 13231 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Br Amb26055453 [0,1,0,1,0,0|2,0,0]=4 13232 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Br Amb33473602 [0,1,0,1,0,0|2,0,0]=4 13233 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,1,0,1,0,0|2,0,0]=4 13234 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb33473675 [0,1,0,1,0,0|2,0,0]=4 13235 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2F Amb26445730 [0,1,0,1,0,0|2,0,0]=4 13236 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2F Amb32663429 [0,1,0,1,0,0|2,0,0]=4 13237 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2O Amb33197211 [0,1,0,1,0,0|2,0,0]=4 13238 B12R2.196 CC1CNc2c(Br)cccc21 Amb26371262 [0,1,0,1,0,0|2,0,0]=4 13239 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,1,0,1,0,0|2,0,0]=4 13240 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,1,0,1,0,0|2,0,0]=4 13241 B12R2.196 CC1CNc2c(N)cccc21 Amb32658300 [0,1,0,1,0,0|2,0,0]=4 13242 B12R2.196 CC1COc2c(F)cccc21 Amb27410107 [0,1,0,1,0,0|1,0,0]=3 13243 B12R2.196 Cc1cccc2c(O)noc12 Amb2725209 [0,1,0,1,0,0|1,0,1]=4 13244 B12R2.196 Cc1cccc2c1CCC2Cl Amb17087981 [0,1,0,1,0,0|2,0,0]=4 13245 B12R2.196 Cc1cccc2c1CCC2F Amb28208696 [0,1,0,1,0,0|2,0,0]=4 13246 B12R2.196 Cc1cccc2c1CCC2N Amb19514831 [0,1,0,1,0,0|2,0,0]=4 13247 B12R2.196 Cc1cccc2c1CCC2N Amb9735877 [0,1,0,1,0,0|2,0,0]=4 13248 B12R2.196 Cc1cccc2c1CCC2O Amb17087931 [0,1,0,1,0,0|1,0,0]=3 13249 B12R2.196 Cc1cccc2c1CC[C@@H]2N Amb31289668 [0,1,0,1,0,0|2,0,0]=4 13250 B12R2.196 Cc1cccc2c1CC[C@H]2N Amb26934915 [0,1,0,1,0,0|2,0,0]=4 13251 B12R2.196 Cc1cccc2c1NCC2C Amb17040659 [0,1,0,1,0,0|2,0,0]=4 13252 B12R2.196 Cc1cccc2c1OCC2=O Amb33534388 [0,1,0,1,0,0|0,0,2]=4 13253 B12R2.196 Cc1cccc2c1OCC2N Amb9735888 [0,1,0,1,0,0|1,0,0]=3 13254 B12R2.196 Cc1cccc2c1OC[C@@H]2N Amb24589207 [0,1,0,1,0,0|1,0,0]=3 13255 B12R2.196 ClC1CCc2c(Br)cccc21 Amb22059235 [0,1,0,1,0,0|2,0,0]=4 13256 B12R2.196 Clc1cccc2c1CCC2Cl Amb17087984 [0,1,0,1,0,0|2,0,0]=4 13257 B12R2.196 FC1CCc2c(Br)cccc21 Amb27816681 [0,1,0,1,0,0|2,0,0]=4 13258 B12R2.196 FC1CCc2c(Cl)cccc21 Amb27794950 [0,1,0,1,0,0|2,0,0]=4 13259 B12R2.196 Fc1cccc2c1CCC2Br Amb20623563 [0,1,0,1,0,0|2,0,0]=4 13260 B12R2.196 Fc1cccc2c1CCC2Cl Amb33538441 [0,1,0,1,0,0|2,0,0]=4 13261 B12R2.196 Fc1cccc2c1CCC2S Amb27643018 [0,1,0,1,0,0|1,1,0]=4 13262 B12R2.196 NC1CCc2c(Br)cccc21 Amb19342600 [0,1,0,1,0,0|2,0,0]=4 13263 B12R2.196 NC1CCc2c(Br)cccc21 Amb6683470 [0,1,0,1,0,0|2,0,0]=4 13264 B12R2.196 NC1CCc2c(Cl)cccc21 Amb10609924 [0,1,0,1,0,0|2,0,0]=4 13265 B12R2.196 NC1CCc2c(Cl)cccc21 Amb2383228 [0,1,0,1,0,0|2,0,0]=4 13266 B12R2.196 NC1CCc2c(F)cccc21 Amb10609944 [0,1,0,1,0,0|2,0,0]=4 13267 B12R2.196 NC1CCc2c(F)cccc21 Amb9735878 [0,1,0,1,0,0|2,0,0]=4 13268 B12R2.196 NC1CCc2c(O)cccc21 Amb32661676 [0,1,0,1,0,0|2,0,0]=4 13269 B12R2.196 NC1CCc2c(O)cccc21 Amb9725461 [0,1,0,1,0,0|2,0,0]=4 13270 B12R2.196 NC1CNc2c(Cl)cccc21 Amb27445939 [0,1,0,1,0,0|2,0,0]=4 13271 B12R2.196 NC1COc2c(Br)cccc21 Amb31028992 [0,1,0,1,0,0|1,0,0]=3 13272 B12R2.196 NC1COc2c(Br)cccc21 Amb6683475 [0,1,0,1,0,0|1,0,0]=3 13273 B12R2.196 NC1COc2c(Cl)cccc21 Amb20626374 [0,1,0,1,0,0|1,0,0]=3 13274 B12R2.196 NC1COc2c(Cl)cccc21 Amb2383238 [0,1,0,1,0,0|1,0,0]=3 13275 B12R2.196 NC1COc2c(O)cccc21 Amb27873968 [0,1,0,1,0,0|1,0,0]=3 13276 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb22288665 [0,1,0,1,0,0|2,0,0]=4 13277 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb27230466 [0,1,0,1,0,0|2,0,0]=4 13278 B12R2.196 N[C@@H]1CCc2c(Cl)cccc21 Amb13953028 [0,1,0,1,0,0|2,0,0]=4 13279 B12R2.196 N[C@@H]1CCc2c(Cl)cccc21 Amb31289675 [0,1,0,1,0,0|2,0,0]=4 13280 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22288666 [0,1,0,1,0,0|2,0,0]=4 13281 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22746050 [0,1,0,1,0,0|2,0,0]=4 13282 B12R2.196 N[C@@H]1CCc2c(O)cccc21 Amb2699155 [0,1,0,1,0,0|2,0,0]=4 13283 B12R2.196 N[C@@H]1COc2c(Br)cccc21 Amb31028978 [0,1,0,1,0,0|1,0,0]=3 13284 B12R2.196 N[C@@H]1COc2c(Cl)cccc21 Amb30633907 [0,1,0,1,0,0|1,0,0]=3 13285 B12R2.196 N[C@@H]1COc2c(F)cccc21 Amb25060202 [0,1,0,1,0,0|1,0,0]=3 13286 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb22288709 [0,1,0,1,0,0|2,0,0]=4 13287 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb27794553 [0,1,0,1,0,0|2,0,0]=4 13288 B12R2.196 N[C@H]1CCc2c(Cl)cccc21 Amb13953027 [0,1,0,1,0,0|2,0,0]=4 13289 B12R2.196 N[C@H]1CCc2c(Cl)cccc21 Amb33457339 [0,1,0,1,0,0|2,0,0]=4 13290 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb16233799 [0,1,0,1,0,0|2,0,0]=4 13291 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb22388651 [0,1,0,1,0,0|2,0,0]=4 13292 B12R2.196 N[C@H]1CCc2c(I)cccc21 Amb27945476 [0,1,0,1,0,0|2,0,0]=4 13293 B12R2.196 N[C@H]1CCc2c(O)cccc21 Amb2699154 [0,1,0,1,0,0|2,0,0]=4 13294 B12R2.196 N[C@H]1CCc2c(S)cccc21 Amb27461350 [0,1,0,1,0,0|2,0,0]=4 13295 B12R2.196 N[C@H]1COc2c(Br)cccc21 Amb26395931 [0,1,0,1,0,0|1,0,0]=3 13296 B12R2.196 N[C@H]1COc2c(Cl)cccc21 Amb26433495 [0,1,0,1,0,0|1,0,0]=3 13297 B12R2.196 N[C@H]1COc2c(Cl)cccc21 Amb33872075 [0,1,0,1,0,0|1,0,0]=3 13298 B12R2.196 N[C@H]1COc2c(F)cccc21 Amb26478564 [0,1,0,1,0,0|1,0,0]=3 13299 B12R2.196 N[C@H]1COc2c(F)cccc21 Amb33872073 [0,1,0,1,0,0|1,0,0]=3 13300 B12R2.196 N[C@H]1COc2c(O)cccc21 Amb28145808 [0,1,0,1,0,0|1,0,0]=3 13301 B12R2.196 Nc1cccc2c1CC[C@@H]2N Amb28145068 [0,1,0,1,0,0|2,0,0]=4 13302 B12R2.196 Nc1cccc2c1OCC2=O Amb18202194 [0,1,0,1,0,0|0,0,2]=4 13303 B12R2.196 Nc1cccc2c1OC[C@@H]2N Amb27786360 [0,1,0,1,0,0|1,0,0]=3 13304 B12R2.196 O=C1COc2c(Br)cccc21 Amb33534390 [0,1,0,1,0,0|0,0,2]=4 13305 B12R2.196 O=C1COc2c(Cl)cccc21 Amb33534389 [0,1,0,1,0,0|0,0,2]=4 13306 B12R2.196 O=C1COc2c(F)cccc21 Amb2383546 [0,1,0,1,0,0|0,0,2]=4 13307 B12R2.196 O=C1COc2c(O)cccc21 Amb22490978 [0,1,0,1,0,0|0,0,2]=4 13308 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,1,0,0|1,0,0]=3 13309 B12R2.196 OC1CCc2c(Br)cncc21 Amb26337804 [0,1,0,1,0,0|2,0,0]=4 13310 B12R2.196 OC1CCc2c(Cl)cccc21 Amb17087934 [0,1,0,1,0,0|1,0,0]=3 13311 B12R2.196 OC1CCc2c(Cl)ccnc21 Amb19957874 [0,1,0,1,0,0|2,0,0]=4 13312 B12R2.196 OC1CCc2c(F)cccc21 Amb17087933 [0,1,0,1,0,0|1,0,0]=3 13313 B12R2.196 OC1COc2c(Br)cccc21 Amb22751583 [0,1,0,1,0,0|0,0,0]=2 13314 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,1,0,0|1,0,0]=3 13315 B12R2.196 O[C@@H]1CCc2c(Cl)cccc21 Amb13953026 [0,1,0,1,0,0|1,0,0]=3 13316 B12R2.196 O[C@@H]1CCc2c(Cl)ccnc21 Amb27969062 [0,1,0,1,0,0|2,0,0]=4 13317 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,1,0,0|1,0,0]=3 13318 B12R2.196 O[C@H]1CCc2c(Br)cccc21 Amb27596691 [0,1,0,1,0,0|1,0,0]=3 13319 B12R2.196 O[C@H]1CCc2c(Cl)cccc21 Amb13953025 [0,1,0,1,0,0|1,0,0]=3 13320 B12R2.196 O[C@H]1CCc2c(F)cccc21 Amb27664626 [0,1,0,1,0,0|1,0,0]=3 13321 B12R2.196 Oc1cccc2c1CCC2S Amb32788536 [0,1,0,1,0,0|1,1,0]=4 13322 B12R2.196 Oc1cccc2c1CCN2O Amb27971133 [0,1,0,1,0,0|2,0,0]=4 13323 B12R2.196 SC1CCc2c(Br)cccc21 Amb24352616 [0,1,0,1,0,0|1,1,0]=4 13324 B12R2.225 Brc1ccccc1CC2CO2 Amb25890766 [0,1,0,1,0,0|1,0,0]=3 13325 B12R2.225 Brc1ccccc1NC2CC2 Amb25922951 [0,1,0,1,0,0|2,0,0]=4 13326 B12R2.225 Brc1ccccc1OC2CC2 Amb25771923 [0,1,0,1,0,0|1,0,0]=3 13327 B12R2.225 Brc1ccccc1SC2CC2 Amb26505970 [0,1,0,1,0,0|1,1,0]=4 13328 B12R2.225 Brc1cccnc1CC2CO2 Amb33336088 [0,1,0,1,0,0|2,0,0]=4 13329 B12R2.225 Brc1cccnc1OC2CC2 Amb27963689 [0,1,0,1,0,0|2,0,0]=4 13330 B12R2.225 Brc1ccncc1OC2CC2 Amb25890502 [0,1,0,1,0,0|2,0,0]=4 13331 B12R2.225 Brc1cnccc1CC2CO2 Amb33388630 [0,1,0,1,0,0|2,0,0]=4 13332 B12R2.225 Brc1cnccc1OC2CC2 Amb28186461 [0,1,0,1,0,0|2,0,0]=4 13333 B12R2.225 Brc1ncccc1CC2CO2 Amb33387840 [0,1,0,1,0,0|2,0,0]=4 13334 B12R2.225 Brc1ncccc1OC2CC2 Amb28129826 [0,1,0,1,0,0|2,0,0]=4 13335 B12R2.225 Cc1ccccc1CC2CO2 Amb25122222 [0,1,0,1,0,0|1,0,0]=3 13336 B12R2.225 Cc1ccccc1NC2CC2 Amb27593469 [0,1,0,1,0,0|2,0,0]=4 13337 B12R2.225 Cc1cccnc1CC2CO2 Amb33428741 [0,1,0,1,0,0|2,0,0]=4 13338 B12R2.225 Cc1ccncc1CC2CO2 Amb25784408 [0,1,0,1,0,0|2,0,0]=4 13339 B12R2.225 Cc1cnccc1CC2CO2 Amb33424633 [0,1,0,1,0,0|2,0,0]=4 13340 B12R2.225 Cc1ncccc1CC2CO2 Amb32879704 [0,1,0,1,0,0|2,0,0]=4 13341 B12R2.225 Clc1ccccc1CC2CO2 Amb25094935 [0,1,0,1,0,0|1,0,0]=3 13342 B12R2.225 Clc1ccccc1OC2CC2 Amb27664627 [0,1,0,1,0,0|1,0,0]=3 13343 B12R2.225 Clc1ccncc1OC2CC2 Amb28285378 [0,1,0,1,0,0|2,0,0]=4 13344 B12R2.225 Clc1cnccc1CC2CO2 Amb33413587 [0,1,0,1,0,0|2,0,0]=4 13345 B12R2.225 Clc1cnccc1OC2CC2 Amb26551881 [0,1,0,1,0,0|2,0,0]=4 13346 B12R2.225 Clc1ncccc1CC2CO2 Amb33257354 [0,1,0,1,0,0|2,0,0]=4 13347 B12R2.225 Clc1ncccc1OC2CC2 Amb26600889 [0,1,0,1,0,0|2,0,0]=4 13348 B12R2.225 Fc1ccccc1CC2CO2 Amb27839801 [0,1,0,1,0,0|1,0,0]=3 13349 B12R2.225 Fc1ccccc1OC2CC2 Amb26871851 [0,1,0,1,0,0|1,0,0]=3 13350 B12R2.225 Fc1ccccc1SC2CC2 Amb24717992 [0,1,0,1,0,0|1,1,0]=4 13351 B12R2.225 Fc1cccnc1CC2CO2 Amb33418781 [0,1,0,1,0,0|2,0,0]=4 13352 B12R2.225 Fc1cccnc1OC2CC2 Amb25876743 [0,1,0,1,0,0|2,0,0]=4 13353 B12R2.225 Fc1cnccc1CC2CO2 Amb26637281 [0,1,0,1,0,0|2,0,0]=4 13354 B12R2.225 Fc1cnccc1OC2CC2 Amb26497990 [0,1,0,1,0,0|2,0,0]=4 13355 B12R2.225 Fc1ncccc1CC2CO2 Amb33377201 [0,1,0,1,0,0|2,0,0]=4 13356 B12R2.225 Ic1ccccc1OC2CC2 Amb25940708 [0,1,0,1,0,0|1,0,0]=3 13357 B12R2.225 Ic1ccncc1OC2CC2 Amb28187137 [0,1,0,1,0,0|2,0,0]=4 13358 B12R2.225 Nc1ccccc1CC2CC2 Amb24117001 [0,1,0,1,0,0|2,0,0]=4 13359 B12R2.225 Nc1ccccc1NC2CC2 Amb28960308 [0,1,0,1,0,0|2,0,0]=4 13360 B12R2.225 Nc1ccccc1NC2CC2 Amb9205213 [0,1,0,1,0,0|2,0,0]=4 13361 B12R2.225 Nc1ccccc1OC2CC2 Amb26322391 [0,1,0,1,0,0|1,0,0]=3 13362 B12R2.225 Nc1ccccc1SC2CC2 Amb25302953 [0,1,0,1,0,0|1,1,0]=4 13363 B12R2.225 Nc1cccnc1OC2CC2 Amb33035554 [0,1,0,1,0,0|2,0,0]=4 13364 B12R2.225 Nc1ccncc1OC2CC2 Amb25295329 [0,1,0,1,0,0|2,0,0]=4 13365 B12R2.225 Nc1cnccc1OC2CC2 Amb26852122 [0,1,0,1,0,0|2,0,0]=4 13366 B12R2.225 Oc1ccccc1CC2CC2 Amb22752448 [0,1,0,1,0,0|2,0,0]=4 13367 B12R2.225 Oc1ccccc1OC2CC2 Amb8390104 [0,1,0,1,0,0|1,0,0]=3 13368 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,1,0,1,0,0|2,0,0]=4 13369 B12R2.517 Brc1ccccc1C2CCN2 Amb27871922 [0,1,0,1,0,0|2,0,0]=4 13370 B12R2.517 Brc1ccccc1C2CCO2 Amb32992865 [0,1,0,1,0,0|1,0,0]=3 13371 B12R2.517 Brc1cnccc1C2CCO2 Amb25891761 [0,1,0,1,0,0|2,0,0]=4 13372 B12R2.517 Cc1ccccc1C2CCN2 Amb26505394 [0,1,0,1,0,0|2,0,0]=4 13373 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,1,0,1,0,0|2,0,0]=4 13374 B12R2.517 Clc1ccccc1[C@H]2CCN2 Amb27975768 [0,1,0,1,0,0|2,0,0]=4 13375 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,1,0,1,0,0|2,0,0]=4 13376 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,1,0,1,0,0|2,0,0]=4 13377 B12R2.517 Fc1ccccc1[C@H]2CCN2 Amb28072859 [0,1,0,1,0,0|2,0,0]=4 13378 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,1,0,1,0,0|2,0,0]=4 13379 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,1,0,1,0,0|2,0,0]=4 13380 B12R2.517 Nc1ccccc1C2CCC2 Amb31156619 [0,1,0,1,0,0|2,0,0]=4 13381 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,1,0,1,0,0|2,0,0]=4 13382 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,1,0,1,0,0|2,0,0]=4 13383 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,1,0,1,0,0|2,0,0]=4 13384 B12R2.517 Oc1ccccc1C2CCO2 Amb32641912 [0,1,0,1,0,0|1,0,0]=3 13385 B12R2.517 Sc1ccccc1C2CCN2 Amb27948429 [0,1,0,1,0,0|2,0,0]=4 13386 B12R2.80 C[C@@H]1C[C@H]1c2cccc(F)c2 Amb27423866 [0,1,0,1,0,0|2,0,0]=4 13387 B12R2.80 Cc1cccc(C2CC2N)c1 Amb9677177 [0,1,0,1,0,0|2,0,0]=4 13388 B12R2.80 Cc1cccc(C2CC2O)c1 Amb27225134 [0,1,0,1,0,0|1,0,0]=3 13389 B12R2.80 Cc1cccc([C@@H]2C[C@H]2Br)c1 Amb27478672 [0,1,0,1,0,0|2,0,0]=4 13390 B12R2.80 Cc1cccc([C@@H]2C[C@H]2N)c1 Amb24100230 [0,1,0,1,0,0|2,0,0]=4 13391 B12R2.80 Clc1cccc(C2CC2Cl)c1 Amb27237656 [0,1,0,1,0,0|2,0,0]=4 13392 B12R2.80 Clc1cccc([C@@H]2C[C@H]2Br)c1 Amb27220998 [0,1,0,1,0,0|2,0,0]=4 13393 B12R2.80 Fc1cccc(C2CC2Br)c1 Amb23454927 [0,1,0,1,0,0|2,0,0]=4 13394 B12R2.80 Fc1cccc([C@@H]2C[C@H]2Br)c1 Amb26438558 [0,1,0,1,0,0|2,0,0]=4 13395 B12R2.80 NC1CC1c2cccc(Br)c2 Amb19346489 [0,1,0,1,0,0|2,0,0]=4 13396 B12R2.80 NC1CC1c2cccc(Br)c2 Amb9677218 [0,1,0,1,0,0|2,0,0]=4 13397 B12R2.80 NC1CC1c2cccc(Cl)c2 Amb19374842 [0,1,0,1,0,0|2,0,0]=4 13398 B12R2.80 NC1CC1c2cccc(Cl)c2 Amb8389498 [0,1,0,1,0,0|2,0,0]=4 13399 B12R2.80 NC1CC1c2cccc(F)c2 Amb19514818 [0,1,0,1,0,0|2,0,0]=4 13400 B12R2.80 NC1CC1c2cccc(F)c2 Amb9677176 [0,1,0,1,0,0|2,0,0]=4 13401 B12R2.80 NC1CC1c2cccc(O)c2 Amb17568188 [0,1,0,1,0,0|2,0,0]=4 13402 B12R2.80 N[C@@H]1C[C@@H]1c2cccc(Cl)c2 Amb34915313 [0,1,0,1,0,0|2,0,0]=4 13403 B12R2.80 N[C@@H]1C[C@@H]1c2cccc(F)c2 Amb34916532 [0,1,0,1,0,0|2,0,0]=4 13404 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Br)c2 Amb25307909 [0,1,0,1,0,0|2,0,0]=4 13405 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Br)c2 Amb32663465 [0,1,0,1,0,0|2,0,0]=4 13406 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb25683521 [0,1,0,1,0,0|2,0,0]=4 13407 B12R2.80 N[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb33032246 [0,1,0,1,0,0|2,0,0]=4 13408 B12R2.80 N[C@@H]1C[C@H]1c2cccc(F)c2 Amb24100228 [0,1,0,1,0,0|2,0,0]=4 13409 B12R2.80 N[C@@H]1C[C@H]1c2cccc(F)c2 Amb33313468 [0,1,0,1,0,0|2,0,0]=4 13410 B12R2.80 N[C@@H]1C[C@H]1c2cccc(O)c2 Amb27196217 [0,1,0,1,0,0|2,0,0]=4 13411 B12R2.80 OC1CC1c2cccc(Cl)c2 Amb27965819 [0,1,0,1,0,0|1,0,0]=3 13412 B12R2.203 CC1CNc2cccc(Cl)c21 Amb28286836 [0,1,0,1,0,0|2,0,0]=4 13413 B12R2.203 Cc1cccc2c1C(=O)CO2 Amb18202264 [0,1,0,1,0,0|0,0,2]=4 13414 B12R2.203 Cc1cccc2c1C(N)CC2 Amb26554001 [0,1,0,1,0,0|2,0,0]=4 13415 B12R2.203 Cc1cccc2c1C(O)CC2 Amb22886909 [0,1,0,1,0,0|1,0,0]=3 13416 B12R2.203 Cc1cccc2c1[C@H](N)CC2 Amb24398373 [0,1,0,1,0,0|2,0,0]=4 13417 B12R2.203 Cc1cccc2onc(O)c12 Amb21857266 [0,1,0,1,0,0|1,0,1]=4 13418 B12R2.203 Cc1cncc2c1C(N)CO2 Amb28400979 [0,1,0,1,0,0|2,0,0]=4 13419 B12R2.203 FC1CCc2cccc(Br)c21 Amb27816661 [0,1,0,1,0,0|2,0,0]=4 13420 B12R2.203 NC1CCc2cccc(Br)c21 Amb24667972 [0,1,0,1,0,0|2,0,0]=4 13421 B12R2.203 NC1CCc2cccc(Br)c21 Amb30869304 [0,1,0,1,0,0|2,0,0]=4 13422 B12R2.203 NC1CCc2cccc(Cl)c21 Amb26980827 [0,1,0,1,0,0|2,0,0]=4 13423 B12R2.203 NC1CCc2cccc(F)c21 Amb25279315 [0,1,0,1,0,0|2,0,0]=4 13424 B12R2.203 NC1CCc2cccc(I)c21 Amb27167666 [0,1,0,1,0,0|2,0,0]=4 13425 B12R2.203 NC1CCc2cccc(O)c21 Amb25800015 [0,1,0,1,0,0|2,0,0]=4 13426 B12R2.203 NC1COc2cccc(Br)c21 Amb24428244 [0,1,0,1,0,0|1,0,0]=3 13427 B12R2.203 NC1COc2cccc(Cl)c21 Amb26033515 [0,1,0,1,0,0|1,0,0]=3 13428 B12R2.203 NC1COc2cccc(Cl)c21 Amb28872333 [0,1,0,1,0,0|1,0,0]=3 13429 B12R2.203 NC1COc2cccc(F)c21 Amb27657791 [0,1,0,1,0,0|1,0,0]=3 13430 B12R2.203 NC1COc2cccc(F)c21 Amb31291603 [0,1,0,1,0,0|1,0,0]=3 13431 B12R2.203 NC1COc2cccc(I)c21 Amb27202715 [0,1,0,1,0,0|1,0,0]=3 13432 B12R2.203 NC1COc2cccc(O)c21 Amb27426677 [0,1,0,1,0,0|1,0,0]=3 13433 B12R2.203 N[C@@H]1CCc2cccc(Br)c21 Amb27945487 [0,1,0,1,0,0|2,0,0]=4 13434 B12R2.203 N[C@@H]1CCc2cccc(F)c21 Amb26872264 [0,1,0,1,0,0|2,0,0]=4 13435 B12R2.203 N[C@@H]1CCc2cccc(O)c21 Amb24700449 [0,1,0,1,0,0|2,0,0]=4 13436 B12R2.203 N[C@@H]1COc2cccc(Br)c21 Amb27259296 [0,1,0,1,0,0|1,0,0]=3 13437 B12R2.203 N[C@@H]1COc2cccc(Cl)c21 Amb25335511 [0,1,0,1,0,0|1,0,0]=3 13438 B12R2.203 N[C@@H]1COc2cccc(F)c21 Amb24377677 [0,1,0,1,0,0|1,0,0]=3 13439 B12R2.203 N[C@@H]1COc2cccc(O)c21 Amb27860300 [0,1,0,1,0,0|1,0,0]=3 13440 B12R2.203 N[C@H]1CCc2cccc(F)c21 Amb25861404 [0,1,0,1,0,0|2,0,0]=4 13441 B12R2.203 N[C@H]1CCc2cccc(F)c21 Amb33872248 [0,1,0,1,0,0|2,0,0]=4 13442 B12R2.203 N[C@H]1CCc2cccc(O)c21 Amb25068419 [0,1,0,1,0,0|2,0,0]=4 13443 B12R2.203 N[C@H]1COc2cccc(Br)c21 Amb25322414 [0,1,0,1,0,0|1,0,0]=3 13444 B12R2.203 N[C@H]1COc2cccc(Cl)c21 Amb25923232 [0,1,0,1,0,0|1,0,0]=3 13445 B12R2.203 N[C@H]1COc2cccc(Cl)c21 Amb33872074 [0,1,0,1,0,0|1,0,0]=3 13446 B12R2.203 N[C@H]1COc2cccc(F)c21 Amb28291445 [0,1,0,1,0,0|1,0,0]=3 13447 B12R2.203 N[C@H]1COc2cccc(F)c21 Amb33872072 [0,1,0,1,0,0|1,0,0]=3 13448 B12R2.203 Nc1cccc2c1C(=O)CO2 Amb27969163 [0,1,0,1,0,0|0,0,2]=4 13449 B12R2.203 Nc1cccc2c1C(F)CC2 Amb27229221 [0,1,0,1,0,0|2,0,0]=4 13450 B12R2.203 Nc1cccc2c1C(O)CC2 Amb28364281 [0,1,0,1,0,0|1,0,0]=3 13451 B12R2.203 Nc1cccc2c1[C@@H](N)CO2 Amb27644692 [0,1,0,1,0,0|1,0,0]=3 13452 B12R2.203 O=C1COc2cccc(Br)c21 Amb16233082 [0,1,0,1,0,0|0,0,2]=4 13453 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,1,0,0|0,0,2]=4 13454 B12R2.203 O=C1COc2cccc(F)c21 Amb10840768 [0,1,0,1,0,0|0,0,2]=4 13455 B12R2.203 O=C1COc2cccc(O)c21 Amb18125055 [0,1,0,1,0,0|0,0,2]=4 13456 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,1,0,0|1,0,0]=3 13457 B12R2.203 OC1CCc2cccc(Cl)c21 Amb27243919 [0,1,0,1,0,0|1,0,0]=3 13458 B12R2.203 OC1CCc2cccc(F)c21 Amb27953673 [0,1,0,1,0,0|1,0,0]=3 13459 B12R2.203 OC1CSc2cccc(Br)c21 Amb27977724 [0,1,0,1,0,0|0,1,0]=3 13460 B12R2.203 OC1OCc2cccc(F)c21 Amb27766595 [0,1,0,1,0,0|2,0,0]=4 13461 B12R2.203 Oc1cccc2c1C(S)CC2 Amb32788786 [0,1,0,1,0,0|1,1,0]=4 13462 B12R2.612 CC1CNc2cc(Br)ccc21 Amb25103823 [0,1,0,1,0,0|2,0,0]=4 13463 B12R2.612 CC1CNc2cc(N)ccc21 Amb28397894 [0,1,0,1,0,0|2,0,0]=4 13464 B12R2.612 Cc1ccc2c(O)noc2c1 Amb22015153 [0,1,0,1,0,0|1,0,1]=4 13465 B12R2.612 Cc1ccc2c(c1)CCC2Br Amb27841519 [0,1,0,1,0,0|2,0,0]=4 13466 B12R2.612 Cc1ccc2c(c1)CCC2F Amb27958885 [0,1,0,1,0,0|2,0,0]=4 13467 B12R2.612 Cc1ccc2c(c1)CCC2N Amb10609950 [0,1,0,1,0,0|2,0,0]=4 13468 B12R2.612 Cc1ccc2c(c1)CCC2N Amb6667024 [0,1,0,1,0,0|2,0,0]=4 13469 B12R2.612 Cc1ccc2c(c1)CCC2O Amb21964865 [0,1,0,1,0,0|1,0,0]=3 13470 B12R2.612 Cc1ccc2c(c1)CC[C@@H]2O Amb25892517 [0,1,0,1,0,0|1,0,0]=3 13471 B12R2.612 Cc1ccc2c(c1)CC[C@H]2N Amb26346414 [0,1,0,1,0,0|2,0,0]=4 13472 B12R2.612 Cc1ccc2c(c1)CC[C@H]2O Amb27668855 [0,1,0,1,0,0|1,0,0]=3 13473 B12R2.612 Cc1ccc2c(c1)NCC2C Amb27760208 [0,1,0,1,0,0|2,0,0]=4 13474 B12R2.612 Cc1ccc2c(c1)OCC2=O Amb18202265 [0,1,0,1,0,0|0,0,2]=4 13475 B12R2.612 Cc1ccc2c(c1)OCC2N Amb27630034 [0,1,0,1,0,0|1,0,0]=3 13476 B12R2.612 Cc1ccc2c(c1)OC[C@@H]2N Amb25335510 [0,1,0,1,0,0|1,0,0]=3 13477 B12R2.612 Cc1ccc2c(n1)OCC2N Amb27972477 [0,1,0,1,0,0|2,0,0]=4 13478 B12R2.612 Cc1ccc2c(n1)OCC2O Amb27607216 [0,1,0,1,0,0|1,0,0]=3 13479 B12R2.612 ClC1CCc2cc(Br)ccc21 Amb22001687 [0,1,0,1,0,0|2,0,0]=4 13480 B12R2.612 Clc1ccc2c(c1)CCC2Br Amb25890551 [0,1,0,1,0,0|2,0,0]=4 13481 B12R2.612 Clc1ccc2c(c1)CCC2Cl Amb25351129 [0,1,0,1,0,0|2,0,0]=4 13482 B12R2.612 FC1CCc2cc(Br)ccc21 Amb27873591 [0,1,0,1,0,0|2,0,0]=4 13483 B12R2.612 Fc1ccc2c(c1)CCC2F Amb27229156 [0,1,0,1,0,0|2,0,0]=4 13484 B12R2.612 Fc1ccc2c(c1)CCC2S Amb27783747 [0,1,0,1,0,0|1,1,0]=4 13485 B12R2.612 NC1CCc2cc(Br)ccc21 Amb10609946 [0,1,0,1,0,0|2,0,0]=4 13486 B12R2.612 NC1CCc2cc(Br)ccc21 Amb9721669 [0,1,0,1,0,0|2,0,0]=4 13487 B12R2.612 NC1CCc2cc(Cl)ccc21 Amb10609861 [0,1,0,1,0,0|2,0,0]=4 13488 B12R2.612 NC1CCc2cc(Cl)ccc21 Amb9720607 [0,1,0,1,0,0|2,0,0]=4 13489 B12R2.612 NC1CCc2cc(F)ccc21 Amb10609896 [0,1,0,1,0,0|2,0,0]=4 13490 B12R2.612 NC1CCc2cc(F)ccc21 Amb9720606 [0,1,0,1,0,0|2,0,0]=4 13491 B12R2.612 NC1CNc2cc(Cl)ccc21 Amb27634347 [0,1,0,1,0,0|2,0,0]=4 13492 B12R2.612 NC1CNc2cc(F)ccc21 Amb27193911 [0,1,0,1,0,0|2,0,0]=4 13493 B12R2.612 NC1COc2cc(Br)ccc21 Amb19516088 [0,1,0,1,0,0|1,0,0]=3 13494 B12R2.612 NC1COc2cc(Br)ccc21 Amb21962144 [0,1,0,1,0,0|1,0,0]=3 13495 B12R2.612 NC1COc2cc(Cl)ccc21 Amb27812386 [0,1,0,1,0,0|1,0,0]=3 13496 B12R2.612 NC1COc2cc(Cl)ccc21 Amb31291604 [0,1,0,1,0,0|1,0,0]=3 13497 B12R2.612 NC1COc2cc(F)ccc21 Amb26356952 [0,1,0,1,0,0|1,0,0]=3 13498 B12R2.612 NC1COc2cc(F)ccc21 Amb30584660 [0,1,0,1,0,0|1,0,0]=3 13499 B12R2.612 NC1COc2cc(O)ccc21 Amb1131908 [0,1,0,1,0,0|1,0,0]=3 13500 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745142 [0,1,0,1,0,0|2,0,0]=4 13501 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745143 [0,1,0,1,0,0|2,0,0]=4 13502 B12R2.612 N[C@@H]1CCc2cc(Cl)ccc21 Amb13953032 [0,1,0,1,0,0|2,0,0]=4 13503 B12R2.612 N[C@@H]1CCc2cc(Cl)ccc21 Amb30634245 [0,1,0,1,0,0|2,0,0]=4 13504 B12R2.612 N[C@@H]1CCc2cc(F)ccc21 Amb22288667 [0,1,0,1,0,0|2,0,0]=4 13505 B12R2.612 N[C@@H]1COc2cc(Br)ccc21 Amb24462735 [0,1,0,1,0,0|1,0,0]=3 13506 B12R2.612 N[C@@H]1COc2cc(F)ccc21 Amb26888783 [0,1,0,1,0,0|1,0,0]=3 13507 B12R2.612 N[C@H]1CCc2cc(Br)ccc21 Amb27828530 [0,1,0,1,0,0|2,0,0]=4 13508 B12R2.612 N[C@H]1CCc2cc(Br)ccc21 Amb33801825 [0,1,0,1,0,0|2,0,0]=4 13509 B12R2.612 N[C@H]1CCc2cc(Cl)ccc21 Amb13953031 [0,1,0,1,0,0|2,0,0]=4 13510 B12R2.612 N[C@H]1CCc2cc(Cl)ccc21 Amb33813741 [0,1,0,1,0,0|2,0,0]=4 13511 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb13953037 [0,1,0,1,0,0|2,0,0]=4 13512 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb22270166 [0,1,0,1,0,0|2,0,0]=4 13513 B12R2.612 N[C@H]1CCc2cc(O)ccc21 Amb27780089 [0,1,0,1,0,0|2,0,0]=4 13514 B12R2.612 N[C@H]1CCc2cc(S)ccc21 Amb27251554 [0,1,0,1,0,0|2,0,0]=4 13515 B12R2.612 N[C@H]1COc2cc(Br)ccc21 Amb26020084 [0,1,0,1,0,0|1,0,0]=3 13516 B12R2.612 N[C@H]1COc2cc(Cl)ccc21 Amb28043128 [0,1,0,1,0,0|1,0,0]=3 13517 B12R2.612 N[C@H]1COc2cc(Cl)ccc21 Amb33872209 [0,1,0,1,0,0|1,0,0]=3 13518 B12R2.612 N[C@H]1COc2cc(F)ccc21 Amb26912168 [0,1,0,1,0,0|1,0,0]=3 13519 B12R2.612 N[C@H]1COc2cc(F)ccc21 Amb33872210 [0,1,0,1,0,0|1,0,0]=3 13520 B12R2.612 Nc1ccc2c(c1)CCC2N Amb13952222 [0,1,0,1,0,0|2,0,0]=4 13521 B12R2.612 Nc1ccc2c(c1)CCC2N Amb28652833 [0,1,0,1,0,0|2,0,0]=4 13522 B12R2.612 Nc1ccc2c(c1)CCC2S Amb32788307 [0,1,0,1,0,0|1,1,0]=4 13523 B12R2.612 Nc1ccc2c(c1)CC[C@@H]2N Amb28437314 [0,1,0,1,0,0|2,0,0]=4 13524 B12R2.612 Nc1ccc2c(c1)OCC2=O Amb26332312 [0,1,0,1,0,0|0,0,2]=4 13525 B12R2.612 O=C1COc2cc(Br)ccc21 Amb10070946 [0,1,0,1,0,0|0,0,2]=4 13526 B12R2.612 O=C1COc2cc(Cl)ccc21 Amb10070947 [0,1,0,1,0,0|0,0,2]=4 13527 B12R2.612 O=C1COc2cc(F)ccc21 Amb10840769 [0,1,0,1,0,0|0,0,2]=4 13528 B12R2.612 O=C1COc2cc(I)ccc21 Amb16233079 [0,1,0,1,0,0|0,0,2]=4 13529 B12R2.612 O=C1COc2cc(O)ccc21 Amb1155533 [0,1,0,1,0,0|0,0,2]=4 13530 B12R2.612 OC1CCc2cc(Br)ccc21 Amb7990025 [0,1,0,1,0,0|1,0,0]=3 13531 B12R2.612 OC1CCc2cc(Br)cnc21 Amb24451685 [0,1,0,1,0,0|2,0,0]=4 13532 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,1,0,0|1,0,0]=3 13533 B12R2.612 OC1CCc2cc(Cl)cnc21 Amb28203716 [0,1,0,1,0,0|2,0,0]=4 13534 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,1,0,0|1,0,0]=3 13535 B12R2.612 OC1COc2cc(Br)ccc21 Amb22751582 [0,1,0,1,0,0|0,0,0]=2 13536 B12R2.612 OC1COc2cc(Cl)ccc21 Amb33550780 [0,1,0,1,0,0|0,0,0]=2 13537 B12R2.612 OC1COc2cc(F)ccc21 Amb26371144 [0,1,0,1,0,0|0,0,0]=2 13538 B12R2.612 OC1OCc2cc(Cl)ccc21 Amb22751579 [0,1,0,1,0,0|2,0,0]=4 13539 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,1,0,0|1,0,0]=3 13540 B12R2.612 O[C@@H]1CCc2cc(Cl)ccc21 Amb13953029 [0,1,0,1,0,0|1,0,0]=3 13541 B12R2.612 O[C@@H]1CCc2cc(F)ccc21 Amb13953035 [0,1,0,1,0,0|1,0,0]=3 13542 B12R2.612 O[C@@H]1CCc2cc(I)ccc21 Amb25969174 [0,1,0,1,0,0|1,0,0]=3 13543 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,1,0,0|1,0,0]=3 13544 B12R2.612 O[C@H]1CCc2cc(Cl)ccc21 Amb13953030 [0,1,0,1,0,0|1,0,0]=3 13545 B12R2.612 O[C@H]1CCc2cc(F)ccc21 Amb13953033 [0,1,0,1,0,0|1,0,0]=3 13546 B12R2.612 O[C@H]1CCc2cc(I)ccc21 Amb27649441 [0,1,0,1,0,0|1,0,0]=3 13547 B12R2.612 Oc1ccc2c(O)coc2c1 Amb24061705 [0,1,0,1,0,0|0,0,2]=4 13548 B12R2.612 Oc1ccc2c(c1)CCC2S Amb32788820 [0,1,0,1,0,0|1,1,0]=4 13549 B12R2.612 Oc1ccc2c(c1)CC[C@@H]2O Amb28045712 [0,1,0,1,0,0|1,0,0]=3 13550 B12R2.612 Oc1ccc2c(c1)CC[C@H]2O Amb28292539 [0,1,0,1,0,0|1,0,0]=3 13551 B12R2.612 Oc1ccc2c(c1)OCC2O Amb9748288 [0,1,0,1,0,0|0,0,0]=2 13552 B12R2.612 Oc1ccc2c(c1)OCC2S Amb7784688 [0,1,0,1,0,0|0,1,0]=3 13553 B12R2.612 Oc1noc2cc(Br)ccc12 Amb10975705 [0,1,0,1,0,0|1,0,1]=4 13554 B12R2.612 Oc1noc2cc(I)ccc12 Amb26622191 [0,1,0,1,0,0|1,0,1]=4 13555 B12R2.612 SC1CCc2cc(Br)ccc21 Amb25821808 [0,1,0,1,0,0|1,1,0]=4 13556 B12R2.612 SC1CCc2cc(Cl)ccc21 Amb24639650 [0,1,0,1,0,0|1,1,0]=4 13557 B12R2.1286 Brc1cc(OC2CC2)ccn1 Amb26572934 [0,1,0,1,0,0|2,0,0]=4 13558 B12R2.1286 Brc1cccc(CC2CO2)c1 Amb29880791 [0,1,0,1,0,0|1,0,0]=3 13559 B12R2.1286 Brc1cccc(CC2CO2)n1 Amb33433194 [0,1,0,1,0,0|2,0,0]=4 13560 B12R2.1286 Brc1cccc(NC2CC2)c1 Amb24622562 [0,1,0,1,0,0|2,0,0]=4 13561 B12R2.1286 Brc1cccc(OC2CC2)c1 Amb22057669 [0,1,0,1,0,0|1,0,0]=3 13562 B12R2.1286 Brc1cccc(OC2CC2)n1 Amb24610576 [0,1,0,1,0,0|2,0,0]=4 13563 B12R2.1286 Brc1cccc(SC2CC2)c1 Amb22831516 [0,1,0,1,0,0|1,1,0]=4 13564 B12R2.1286 Brc1ccnc(OC2CC2)c1 Amb22276478 [0,1,0,1,0,0|2,0,0]=4 13565 B12R2.1286 Brc1cncc(CC2CO2)c1 Amb33389115 [0,1,0,1,0,0|2,0,0]=4 13566 B12R2.1286 Brc1cncc(OC2CC2)c1 Amb26995736 [0,1,0,1,0,0|2,0,0]=4 13567 B12R2.1286 Cc1cc(CC2CO2)ccn1 Amb32732932 [0,1,0,1,0,0|2,0,0]=4 13568 B12R2.1286 Cc1cccc(CC2CO2)c1 Amb27812633 [0,1,0,1,0,0|1,0,0]=3 13569 B12R2.1286 Cc1cccc(CC2CO2)n1 Amb33199921 [0,1,0,1,0,0|2,0,0]=4 13570 B12R2.1286 Cc1cccc(OC2CC2)n1 Amb28348509 [0,1,0,1,0,0|2,0,0]=4 13571 B12R2.1286 Cc1ccnc(CC2CO2)c1 Amb33318097 [0,1,0,1,0,0|2,0,0]=4 13572 B12R2.1286 Cc1cncc(CC2CO2)c1 Amb27666800 [0,1,0,1,0,0|2,0,0]=4 13573 B12R2.1286 Cc1cncc(OC2CC2)c1 Amb24717126 [0,1,0,1,0,0|2,0,0]=4 13574 B12R2.1286 Clc1cc(OC2CC2)ccn1 Amb26345152 [0,1,0,1,0,0|2,0,0]=4 13575 B12R2.1286 Clc1cccc(CC2CO2)c1 Amb27839788 [0,1,0,1,0,0|1,0,0]=3 13576 B12R2.1286 Clc1cccc(CC2CO2)n1 Amb33222675 [0,1,0,1,0,0|2,0,0]=4 13577 B12R2.1286 Clc1cccc(NC2CC2)c1 Amb18930890 [0,1,0,1,0,0|2,0,0]=4 13578 B12R2.1286 Clc1cccc(OC2CC2)c1 Amb27861916 [0,1,0,1,0,0|1,0,0]=3 13579 B12R2.1286 Clc1cccc(OC2CC2)n1 Amb24352134 [0,1,0,1,0,0|2,0,0]=4 13580 B12R2.1286 Clc1cncc(OC2CC2)c1 Amb25921473 [0,1,0,1,0,0|2,0,0]=4 13581 B12R2.1286 Fc1cc(OC2CC2)ccn1 Amb26459877 [0,1,0,1,0,0|2,0,0]=4 13582 B12R2.1286 Fc1cccc(CC2CO2)c1 Amb24558530 [0,1,0,1,0,0|1,0,0]=3 13583 B12R2.1286 Fc1cccc(NC2CC2)c1 Amb18270328 [0,1,0,1,0,0|2,0,0]=4 13584 B12R2.1286 Fc1cccc(OC2CC2)c1 Amb25798491 [0,1,0,1,0,0|1,0,0]=3 13585 B12R2.1286 Fc1cccc(OC2CC2)n1 Amb28074195 [0,1,0,1,0,0|2,0,0]=4 13586 B12R2.1286 Fc1ccnc(CC2CO2)c1 Amb33320272 [0,1,0,1,0,0|2,0,0]=4 13587 B12R2.1286 Fc1ccnc(OC2CC2)c1 Amb28364416 [0,1,0,1,0,0|2,0,0]=4 13588 B12R2.1286 Fc1cncc(CC2CO2)c1 Amb25211203 [0,1,0,1,0,0|2,0,0]=4 13589 B12R2.1286 Ic1cccc(OC2CC2)c1 Amb26006862 [0,1,0,1,0,0|1,0,0]=3 13590 B12R2.1286 Nc1cc(OC2CC2)ccn1 Amb26527574 [0,1,0,1,0,0|2,0,0]=4 13591 B12R2.1286 Nc1cccc(NC2CC2)c1 Amb33533212 [0,1,0,1,0,0|2,0,0]=4 13592 B12R2.1286 Nc1cccc(OC2CC2)c1 Amb22011837 [0,1,0,1,0,0|1,0,0]=3 13593 B12R2.1286 Nc1cccc(OC2CC2)c1 Amb33738815 [0,1,0,1,0,0|1,0,0]=3 13594 B12R2.1286 Nc1cccc(SC2CC2)c1 Amb27270830 [0,1,0,1,0,0|1,1,0]=4 13595 B12R2.1286 Nc1ccnc(OC2CC2)c1 Amb26611463 [0,1,0,1,0,0|2,0,0]=4 13596 B12R2.1286 Oc1cccc(NC2CC2)c1 Amb24464849 [0,1,0,1,0,0|2,0,0]=4 13597 B12R2.1286 Oc1cccc(OC2CC2)c1 Amb24085348 [0,1,0,1,0,0|1,0,0]=3 13598 B12R2.2038 NCC1Cc2cc(O)ccc21 Amb27468578 [0,1,0,1,0,0|2,0,0]=4 13599 B12R2.2313 Brc1cccc(C2CCC2)c1 Amb20617094 [0,1,0,1,0,0|2,0,0]=4 13600 B12R2.2313 Brc1cccc(C2CCN2)c1 Amb26655898 [0,1,0,1,0,0|2,0,0]=4 13601 B12R2.2313 Brc1cccc(C2CCN2)c1 Amb32718720 [0,1,0,1,0,0|2,0,0]=4 13602 B12R2.2313 Brc1cccc(C2CCO2)c1 Amb32641928 [0,1,0,1,0,0|1,0,0]=3 13603 B12R2.2313 Brc1cccc(N2CCC2)c1 Amb28068951 [0,1,0,1,0,0|2,0,0]=4 13604 B12R2.2313 Brc1cncc(C2CCO2)c1 Amb28286965 [0,1,0,1,0,0|2,0,0]=4 13605 B12R2.2313 Cc1cccc(C2CCN2)c1 Amb26857229 [0,1,0,1,0,0|2,0,0]=4 13606 B12R2.2313 Cc1cccc([C@H]2CCN2)c1 Amb27391622 [0,1,0,1,0,0|2,0,0]=4 13607 B12R2.2313 Clc1cccc(C2CCC2)c1 Amb35718450 [0,1,0,1,0,0|2,0,0]=4 13608 B12R2.2313 Clc1cccc(C2CCN2)c1 Amb27431952 [0,1,0,1,0,0|2,0,0]=4 13609 B12R2.2313 Clc1cccc([C@H]2CCN2)c1 Amb27655566 [0,1,0,1,0,0|2,0,0]=4 13610 B12R2.2313 Fc1cccc(C2CCN2)c1 Amb19375411 [0,1,0,1,0,0|2,0,0]=4 13611 B12R2.2313 Fc1cccc(C2CCN2)c1 Amb25273667 [0,1,0,1,0,0|2,0,0]=4 13612 B12R2.2313 Fc1cccc([C@H]2CCN2)c1 Amb27815082 [0,1,0,1,0,0|2,0,0]=4 13613 B12R2.2313 Ic1cccc(C2CCC2)c1 Amb35718451 [0,1,0,1,0,0|2,0,0]=4 13614 B12R2.2313 Nc1cccc(C2CCC2)c1 Amb20617095 [0,1,0,1,0,0|2,0,0]=4 13615 B12R2.2313 Nc1cccc(C2CCN2)c1 Amb25980808 [0,1,0,1,0,0|2,0,0]=4 13616 B12R2.2313 Nc1cccc(N2CCC2)c1 Amb27402439 [0,1,0,1,0,0|2,0,0]=4 13617 B12R2.2313 Oc1cccc(C2CCC2)c1 Amb20617090 [0,1,0,1,0,0|2,0,0]=4 13618 B12R2.2313 Oc1cccc(C2CCN2)c1 Amb24085164 [0,1,0,1,0,0|2,0,0]=4 13619 B12R2.2313 Oc1cccc(C2CCO2)c1 Amb32641927 [0,1,0,1,0,0|1,0,0]=3 13620 B12R2.2313 Oc1cccc([C@H]2CCN2)c1 Amb27593889 [0,1,0,1,0,0|2,0,0]=4 13621 B12R2.2313 Sc1cccc([C@H]2CCN2)c1 Amb27453457 [0,1,0,1,0,0|2,0,0]=4 13622 B12R2.1 BrCC1CCc2ccccc21 Amb22500999 [0,1,0,1,0,0|2,0,0]=4 13623 B12R2.1 BrCC1COc2ccccc21 Amb25063018 [0,1,0,1,0,0|1,0,0]=3 13624 B12R2.1 BrCc1coc2ccccc12 Amb23401826 [0,1,0,1,0,0|1,0,1]=4 13625 B12R2.1 BrCc1noc2ccccc12 Amb8390314 [0,1,0,1,0,0|1,0,1]=4 13626 B12R2.1 BrCc1onc2ccccc12 Amb28182496 [0,1,0,1,0,0|1,0,1]=4 13627 B12R2.1 C#CC1CCc2ccccc21 Amb28203681 [0,1,0,1,0,0|2,0,0]=4 13628 B12R2.1 C#CC1CSc2ccccc21 Amb27823678 [0,1,0,1,0,0|1,1,0]=4 13629 B12R2.1 C=CC1CCc2ccccc21 Amb33145111 [0,1,0,1,0,0|2,0,0]=4 13630 B12R2.1 C=CC1OCc2ccccc21 Amb8392579 [0,1,0,1,0,0|1,0,1]=4 13631 B12R2.1 CCC1CNc2ccccc21 Amb32661135 [0,1,0,1,0,0|2,0,0]=4 13632 B12R2.1 CCC1CNc2ccccc21 Amb9776196 [0,1,0,1,0,0|2,0,0]=4 13633 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|2,0,0]=4 13634 B12R2.1 CCC1NCc2ccccc21 Amb30584702 [0,1,0,1,0,0|2,0,0]=4 13635 B12R2.1 CCc1coc2ccccc12 Amb27792683 [0,1,0,1,0,0|1,0,1]=4 13636 B12R2.1 CNC1CCc2ccccc21 Amb9705483 [0,1,0,1,0,0|2,0,0]=4 13637 B12R2.1 CNC1CNc2ccccc21 Amb28125195 [0,1,0,1,0,0|2,0,0]=4 13638 B12R2.1 CNC1CSc2ccccc21 Amb9401070 [0,1,0,1,0,0|1,1,0]=4 13639 B12R2.1 COC1CCc2ccccc21 Amb25880282 [0,1,0,1,0,0|1,0,0]=3 13640 B12R2.1 COC1CNc2ccccc21 Amb27863100 [0,1,0,1,0,0|1,0,0]=3 13641 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,1,0,0|2,0,0]=4 13642 B12R2.1 COc1noc2ccccc12 Amb23571257 [0,1,0,1,0,0|1,0,1]=4 13643 B12R2.1 CSC1CNc2ccccc21 Amb28423543 [0,1,0,1,0,0|1,1,0]=4 13644 B12R2.1 ClCC1CCc2ccccc21 Amb22500998 [0,1,0,1,0,0|2,0,0]=4 13645 B12R2.1 ClCC1CSc2ccccc21 Amb27853344 [0,1,0,1,0,0|1,1,0]=4 13646 B12R2.1 ClCc1coc2ccccc12 Amb5716310 [0,1,0,1,0,0|1,0,1]=4 13647 B12R2.1 ClCc1noc2ccccc12 Amb28141425 [0,1,0,1,0,0|1,0,1]=4 13648 B12R2.1 ClCc1onc2ccccc12 Amb35781905 [0,1,0,1,0,0|1,0,1]=4 13649 B12R2.1 FCC1NCc2ccccc21 Amb27211089 [0,1,0,1,0,0|2,0,0]=4 13650 B12R2.1 FCc1coc2ccccc12 Amb27186252 [0,1,0,1,0,0|1,0,1]=4 13651 B12R2.1 N#CC1CCc2ccccc21 Amb33528298 [0,1,0,1,0,0|2,0,0]=4 13652 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|2,0,0]=4 13653 B12R2.1 N#CC1COc2ccccc21 Amb23586274 [0,1,0,1,0,0|1,0,0]=3 13654 B12R2.1 N#CC1CSc2ccccc21 Amb18126297 [0,1,0,1,0,0|1,1,0]=4 13655 B12R2.1 NCC1C=Cc2ccccc21 Amb17470375 [0,1,0,1,0,0|2,0,0]=4 13656 B12R2.1 NCC1CCc2ccccc21 Amb22500956 [0,1,0,1,0,0|2,0,0]=4 13657 B12R2.1 NCC1CCc2ccccc21 Amb8950115 [0,1,0,1,0,0|2,0,0]=4 13658 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|2,0,0]=4 13659 B12R2.1 NCC1CNc2ccccc21 Amb30588549 [0,1,0,1,0,0|2,0,0]=4 13660 B12R2.1 NCC1COc2ccccc21 Amb33545318 [0,1,0,1,0,0|1,0,0]=3 13661 B12R2.1 NCC1COc2ccccc21 Amb33549495 [0,1,0,1,0,0|1,0,0]=3 13662 B12R2.1 NCC1COc2cnccc21 Amb22756834 [0,1,0,1,0,0|2,0,0]=4 13663 B12R2.1 NCC1CSc2ccccc21 Amb26624065 [0,1,0,1,0,0|1,1,0]=4 13664 B12R2.1 NCC1OCc2ccccc21 Amb28067348 [0,1,0,1,0,0|1,0,0]=3 13665 B12R2.1 NCC1OCc2ccccc21 Amb28872331 [0,1,0,1,0,0|1,0,0]=3 13666 B12R2.1 NC[C@H]1COc2ccccc21 Amb28289255 [0,1,0,1,0,0|1,0,0]=3 13667 B12R2.1 NCc1coc2ccccc12 Amb19373967 [0,1,0,1,0,0|1,0,1]=4 13668 B12R2.1 NCc1coc2ccccc12 Amb19649824 [0,1,0,1,0,0|1,0,1]=4 13669 B12R2.1 NCc1noc2ccccc12 Amb33531498 [0,1,0,1,0,0|1,0,1]=4 13670 B12R2.1 NCc1noc2ccccc12 Amb33536485 [0,1,0,1,0,0|1,0,1]=4 13671 B12R2.1 NNC1CCc2ccccc21 Amb6250083 [0,1,0,1,0,0|2,0,0]=4 13672 B12R2.1 N\N=C1/COc2ccccc21 Amb27862558 [0,1,0,1,0,0|1,0,1]=4 13673 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|1,0,1]=4 13674 B12R2.1 O=CC1CSc2ccccc21 Amb27456947 [0,1,0,1,0,0|0,1,1]=4 13675 B12R2.1 O=CC1OCc2ccccc21 Amb27225913 [0,1,0,1,0,0|0,0,2]=4 13676 B12R2.1 O=C[C@@H]1CCc2ccccc21 Amb28319720 [0,1,0,1,0,0|1,0,1]=4 13677 B12R2.1 O=C[C@H]1CCc2ccccc21 Amb27164668 [0,1,0,1,0,0|1,0,1]=4 13678 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,1,0,0|1,0,0]=3 13679 B12R2.1 OCC1CCc2cccnc21 Amb26853721 [0,1,0,1,0,0|2,0,0]=4 13680 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|1,0,0]=3 13681 B12R2.1 OCC1CNc2ccccc21 Amb28652884 [0,1,0,1,0,0|1,0,0]=3 13682 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,1,0,0|0,0,0]=2 13683 B12R2.1 OCC1COc2cnccc21 Amb26498941 [0,1,0,1,0,0|1,0,0]=3 13684 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,1,0,0|0,1,0]=3 13685 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|1,0,0]=3 13686 B12R2.1 OCc1coc2ccccc12 Amb10572402 [0,1,0,1,0,0|0,0,1]=3 13687 B12R2.1 OCc1coc2cccnc12 Amb27811027 [0,1,0,1,0,0|1,0,1]=4 13688 B12R2.1 OCc1coc2ccncc12 Amb24514107 [0,1,0,1,0,0|1,0,1]=4 13689 B12R2.1 OCc1csc2ccccc12 Amb2723182 [0,1,0,1,0,0|0,1,1]=4 13690 B12R2.1 OCc1noc2ccccc12 Amb22498744 [0,1,0,1,0,0|0,0,1]=3 13691 B12R2.1 OCc1noc2cnccc12 Amb28436318 [0,1,0,1,0,0|1,0,1]=4 13692 B12R2.1 OCc1noc2ncccc12 Amb27450932 [0,1,0,1,0,0|1,0,1]=4 13693 B12R2.1 OCc1occ2ccccc12 Amb28345290 [0,1,0,1,0,0|0,0,1]=3 13694 B12R2.1 OCc1onc2ccccc12 Amb35781902 [0,1,0,1,0,0|0,0,1]=3 13695 B12R2.1 OCc1snc2ccccc12 Amb27839871 [0,1,0,1,0,0|0,1,1]=4 13696 B12R2.1 OCn1cnc2ccccc21 Amb1151978 [0,1,0,1,0,0|1,0,1]=4 13697 B12R2.1 OCn1ncc2ccccc21 Amb23441644 [0,1,0,1,0,0|2,0,0]=4 13698 B12R2.1 OCn1nnc2ccccc21 Amb1350546 [0,1,0,1,0,0|2,0,0]=4 13699 B12R2.1 ONC1CSc2ccccc21 Amb27223274 [0,1,0,1,0,0|0,1,0]=3 13700 B12R2.1 O\N=C1/CCc2ccccc21 Amb4016236 [0,1,0,1,0,0|1,0,1]=4 13701 B12R2.1 O\N=C1/COc2ccccc21 Amb19650724 [0,1,0,1,0,0|0,0,1]=3 13702 B12R2.1 O\N=C1\COc2ccccc21 Amb27840218 [0,1,0,1,0,0|0,0,1]=3 13703 B12R2.1 SCC1CCc2ccccc21 Amb33144588 [0,1,0,1,0,0|1,1,0]=4 13704 B12R2.1 SCC1COc2ccccc21 Amb27397263 [0,1,0,1,0,0|0,1,0]=3 13705 B12R2.1 SCc1coc2ccccc12 Amb24405838 [0,1,0,1,0,0|0,1,1]=4 13706 B12R2.1 [C-]#[N+]C1CCc2ccccc21 Amb2688965 [0,1,0,1,0,0|2,0,0]=4 13707 B12R2.1 [C-]#[N+][C@@H]1CCc2ccccc21 Amb2688966 [0,1,0,1,0,0|2,0,0]=4 13708 B12R2.11 BrC1CC1Cc2ccccc2 Amb27176533 [0,1,0,1,0,0|2,0,0]=4 13709 B12R2.11 Br[C@H]1C[C@@H]1Cc2ccccc2 Amb28287700 [0,1,0,1,0,0|2,0,0]=4 13710 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,1,0,0|2,0,0]=4 13711 B12R2.11 C[C@@H]1C[C@@H]1Nc2ccccc2 Amb28059383 [0,1,0,1,0,0|2,0,0]=4 13712 B12R2.11 Cl[C@@H]1C[C@@H]1Cc2ccccc2 Amb27640652 [0,1,0,1,0,0|2,0,0]=4 13713 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [0,1,0,1,0,0|2,0,0]=4 13714 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [0,1,0,1,0,0|2,0,0]=4 13715 B12R2.11 N[C@@H]1C[C@H]1Cc2ccccc2 Amb32953150 [0,1,0,1,0,0|2,0,0]=4 13716 B12R2.11 N[C@@H]1C[C@H]1Oc2ccccc2 Amb33347106 [0,1,0,1,0,0|1,0,0]=3 13717 B12R2.11 N[C@@H]1C[C@H]1Oc2cccnc2 Amb33347059 [0,1,0,1,0,0|2,0,0]=4 13718 B12R2.11 N[C@H]1C[C@@H]1Oc2ccccc2 Amb27494042 [0,1,0,1,0,0|1,0,0]=3 13719 B12R2.11 OC1O\C1=C/c2ccccc2 Amb27589709 [0,1,0,1,0,0|1,0,1]=4 13720 B12R2.23 CC1CCN1c2ccccc2 Amb28312828 [0,1,0,1,0,0|2,0,0]=4 13721 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,1,0,0|2,0,0]=4 13722 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,1,0,1,0,0|2,0,0]=4 13723 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,1,0,1,0,0|2,0,0]=4 13724 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,1,0,1,0,0|2,0,0]=4 13725 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb28594309 [0,1,0,1,0,0|2,0,0]=4 13726 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb32665507 [0,1,0,1,0,0|2,0,0]=4 13727 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,1,0,1,0,0|2,0,0]=4 13728 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb33447016 [0,1,0,1,0,0|2,0,0]=4 13729 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685232 [0,1,0,1,0,0|1,0,0]=3 13730 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685233 [0,1,0,1,0,0|1,0,0]=3 13731 B12R2.23 N[C@H]1CC[C@H]1c2ccccc2 Amb27789894 [0,1,0,1,0,0|2,0,0]=4 13732 B12R2.23 N[C@H]1CS[C@@H]1c2ccccc2 Amb28245857 [0,1,0,1,0,0|1,1,0]=4 13733 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|1,0,1]=4 13734 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|1,0,1]=4 13735 B12R2.23 O=C1CC[C@H]1c2ccccc2 Amb28253765 [0,1,0,1,0,0|1,0,1]=4 13736 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|0,0,2]=4 13737 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,1,0,1,0,0|1,0,0]=3 13738 B12R2.23 OC1CCC1c2cccnc2 Amb25997850 [0,1,0,1,0,0|2,0,0]=4 13739 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,0]=3 13740 B12R2.23 OC1CNC1c2cccnc2 Amb25145873 [0,1,0,1,0,0|2,0,0]=4 13741 B12R2.23 OC1COC1c2ccccc2 Amb26336587 [0,1,0,1,0,0|0,0,0]=2 13742 B12R2.23 OC1CSC1c2ccccc2 Amb27396136 [0,1,0,1,0,0|0,1,0]=3 13743 B12R2.23 O[C@@H]1CO[C@@H]1c2ccccc2 Amb32679855 [0,1,0,1,0,0|0,0,0]=2 13744 B12R2.23 O[C@@H]1CO[C@H]1c2ccccc2 Amb32679869 [0,1,0,1,0,0|0,0,0]=2 13745 B12R2.23 O[C@H]1CC[C@H]1c2ccccc2 Amb27816201 [0,1,0,1,0,0|1,0,0]=3 13746 B12R2.23 O[C@H]1CO[C@H]1c2ccccc2 Amb28345399 [0,1,0,1,0,0|0,0,0]=2 13747 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,1,0,0|1,1,0]=4 13748 B12R2.2057 C(#CC1CO1)c2ccccc2 Amb25309852 [0,1,0,1,0,0|1,0,0]=3 13749 B12R2.2057 C(=C\C1CO1)/c2ccccc2 Amb32954418 [0,1,0,1,0,0|1,0,0]=3 13750 B12R2.2057 C(=C\C1CO1)/c2ccncc2 Amb27818057 [0,1,0,1,0,0|2,0,0]=4 13751 B12R2.2057 C(=C\[C@@H]1CO1)/c2ccccc2 Amb33081122 [0,1,0,1,0,0|1,0,0]=3 13752 B12R2.2057 C(=C\[C@H]1CO1)/c2ccccc2 Amb33081121 [0,1,0,1,0,0|1,0,0]=3 13753 B12R2.2057 c1cc(SC[C@@H]2CO2)ccn1 Amb27425165 [0,1,0,1,0,0|1,1,0]=4 13754 B12R2.2057 c1cc(SC[C@H]2CO2)ccn1 Amb27589852 [0,1,0,1,0,0|1,1,0]=4 13755 B12R2.2057 c1ccc(CCC2CO2)cc1 Amb33540498 [0,1,0,1,0,0|1,0,0]=3 13756 B12R2.2057 c1ccc(CC[C@@H]2CO2)cc1 Amb32951908 [0,1,0,1,0,0|1,0,0]=3 13757 B12R2.2057 c1ccc(CC[C@H]2CO2)cc1 Amb33082099 [0,1,0,1,0,0|1,0,0]=3 13758 B12R2.2057 c1ccc(CNC2CC2)cc1 Amb19515725 [0,1,0,1,0,0|2,0,0]=4 13759 B12R2.2057 c1ccc(CNC2CC2)cc1 Amb6662862 [0,1,0,1,0,0|2,0,0]=4 13760 B12R2.2057 c1ccc(COC2CC2)cc1 Amb27481431 [0,1,0,1,0,0|1,0,0]=3 13761 B12R2.2057 c1ccc(COC2CO2)cc1 Amb26064453 [0,1,0,1,0,0|0,0,0]=2 13762 B12R2.2057 c1ccc(NCC2CC2)cc1 Amb2383311 [0,1,0,1,0,0|2,0,0]=4 13763 B12R2.2057 c1ccc(NCC2CO2)cc1 Amb27413107 [0,1,0,1,0,0|1,0,0]=3 13764 B12R2.2057 c1ccc(NCC2CO2)nc1 Amb28343184 [0,1,0,1,0,0|2,0,0]=4 13765 B12R2.2057 c1ccc(OCC2CC2)cc1 Amb22752457 [0,1,0,1,0,0|1,0,0]=3 13766 B12R2.2057 c1ccc(OCC2CC2)nc1 Amb24725808 [0,1,0,1,0,0|2,0,0]=4 13767 B12R2.2057 c1ccc(OCC2CO2)cc1 Amb9722480 [0,1,0,1,0,0|0,0,0]=2 13768 B12R2.2057 c1ccc(OC[C@@H]2CO2)cc1 Amb8389341 [0,1,0,1,0,0|0,0,0]=2 13769 B12R2.2057 c1ccc(SCC2CC2)cc1 Amb27485492 [0,1,0,1,0,0|1,1,0]=4 13770 B12R2.2057 c1ccc(SCC2CO2)cc1 Amb33534075 [0,1,0,1,0,0|0,1,0]=3 13771 B12R2.2057 c1ccc(SC[C@@H]2CO2)nc1 Amb27208275 [0,1,0,1,0,0|1,1,0]=4 13772 B12R2.2057 c1ccc(SC[C@H]2CO2)cc1 Amb27775617 [0,1,0,1,0,0|0,1,0]=3 13773 B12R2.2057 c1ccc(SC[C@H]2CO2)nc1 Amb28453705 [0,1,0,1,0,0|1,1,0]=4 13774 B12R2.2057 c1cncc(NCC2CO2)c1 Amb27483153 [0,1,0,1,0,0|2,0,0]=4 13775 B12R2.2057 c1cncc(OCC2CO2)c1 Amb27233095 [0,1,0,1,0,0|1,0,0]=3 13776 B12R2.2058 B1CC(Cc2ccccc2)C1 Amb25243383 [0,1,0,1,0,0|2,0,0]=4 13777 B12R2.2058 c1cc(CC2COC2)ccn1 Amb32456061 [0,1,0,1,0,0|2,0,0]=4 13778 B12R2.2058 c1cc(OC2CNC2)ccn1 Amb19373091 [0,1,0,1,0,0|2,0,0]=4 13779 B12R2.2058 c1cc(OC2CNC2)ccn1 Amb28063349 [0,1,0,1,0,0|2,0,0]=4 13780 B12R2.2058 c1cc(OC2COC2)ccn1 Amb34931990 [0,1,0,1,0,0|1,0,0]=3 13781 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb33552346 [0,1,0,1,0,0|2,0,0]=4 13782 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb7808794 [0,1,0,1,0,0|2,0,0]=4 13783 B12R2.2058 c1ccc(CC2CNC2)cc1 Amb1123190 [0,1,0,1,0,0|2,0,0]=4 13784 B12R2.2058 c1ccc(CC2CNC2)cc1 Amb19373673 [0,1,0,1,0,0|2,0,0]=4 13785 B12R2.2058 c1ccc(CC2COC2)cc1 Amb27602505 [0,1,0,1,0,0|1,0,0]=3 13786 B12R2.2058 c1ccc(CN2CCC2)cc1 Amb27391196 [0,1,0,1,0,0|2,0,0]=4 13787 B12R2.2058 c1ccc(NC2CCC2)cc1 Amb18283820 [0,1,0,1,0,0|2,0,0]=4 13788 B12R2.2058 c1ccc(NC2CNC2)cc1 Amb27252900 [0,1,0,1,0,0|2,0,0]=4 13789 B12R2.2058 c1ccc(NC2CNC2)cc1 Amb32686264 [0,1,0,1,0,0|2,0,0]=4 13790 B12R2.2058 c1ccc(NC2COC2)cc1 Amb33538163 [0,1,0,1,0,0|1,0,0]=3 13791 B12R2.2058 c1ccc(OC2CNC2)cc1 Amb15701497 [0,1,0,1,0,0|1,0,0]=3 13792 B12R2.2058 c1ccc(OC2CNC2)cc1 Amb19312256 [0,1,0,1,0,0|1,0,0]=3 13793 B12R2.2058 c1ccc(OC2CNC2)nc1 Amb22642174 [0,1,0,1,0,0|2,0,0]=4 13794 B12R2.2058 c1ccc(OC2CNC2)nc1 Amb32410916 [0,1,0,1,0,0|2,0,0]=4 13795 B12R2.2058 c1ccc(OC2CNC2)nc1 Amb33744055 [0,1,0,1,0,0|2,0,0]=4 13796 B12R2.2058 c1ccc(OC2COC2)nc1 Amb33609828 [0,1,0,1,0,0|1,0,0]=3 13797 B12R2.2058 c1ccc(SC2CCC2)cc1 Amb10976023 [0,1,0,1,0,0|1,1,0]=4 13798 B12R2.2058 c1ccc(SC2CNC2)cc1 Amb18798478 [0,1,0,1,0,0|1,1,0]=4 13799 B12R2.2058 c1ccc(SC2COC2)cc1 Amb25145934 [0,1,0,1,0,0|0,1,0]=3 13800 B12R2.2058 c1cncc(CC2COC2)c1 Amb32456059 [0,1,0,1,0,0|2,0,0]=4 13801 B12R2.2058 c1cncc(NC2COC2)c1 Amb27209461 [0,1,0,1,0,0|2,0,0]=4 13802 B12R2.2058 c1cncc(OC2CNC2)c1 Amb21956447 [0,1,0,1,0,0|2,0,0]=4 13803 B12R2.2058 c1cncc(OC2CNC2)c1 Amb22490470 [0,1,0,1,0,0|2,0,0]=4 13804 B12R2.18 C=C1c2ccccc2OC1O Amb27197539 [0,1,0,1,0,0|1,0,1]=4 13805 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,1,0,0|1,0,1]=4 13806 B12R2.18 CC1=Cc2ccccc2[C@H]1O Amb28319957 [0,1,0,1,0,0|1,0,1]=4 13807 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,1,0,1,0,0|1,0,1]=4 13808 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [0,1,0,1,0,0|2,0,0]=4 13809 B12R2.18 CC1Cc2ccccc2C1N Amb17232033 [0,1,0,1,0,0|2,0,0]=4 13810 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [0,1,0,1,0,0|2,0,0]=4 13811 B12R2.18 CC1Cc2ccccc2C1O Amb27228534 [0,1,0,1,0,0|1,0,0]=3 13812 B12R2.18 CC1Nc2ccccc2C1C Amb17593676 [0,1,0,1,0,0|2,0,0]=4 13813 B12R2.18 CC1Nc2ccccc2C1O Amb28076897 [0,1,0,1,0,0|1,0,0]=3 13814 B12R2.18 CC1Nc2ccccc2[C@H]1C Amb28341472 [0,1,0,1,0,0|2,0,0]=4 13815 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [0,1,0,1,0,0|0,0,2]=4 13816 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,1,0,1,0,0|1,0,0]=3 13817 B12R2.18 CC1Oc2ccccc2C1N Amb28974067 [0,1,0,1,0,0|1,0,0]=3 13818 B12R2.18 CC1Oc2cccnc2C1O Amb28141839 [0,1,0,1,0,0|1,0,0]=3 13819 B12R2.18 CC1Oc2cnccc2C1O Amb27764814 [0,1,0,1,0,0|1,0,0]=3 13820 B12R2.18 CC1Oc2ncccc2C1O Amb22372218 [0,1,0,1,0,0|1,0,0]=3 13821 B12R2.18 CC1c2ccccc2CC1Br Amb29887209 [0,1,0,1,0,0|2,0,0]=4 13822 B12R2.18 CC1c2ccccc2CC1Cl Amb29887229 [0,1,0,1,0,0|2,0,0]=4 13823 B12R2.18 CC1c2ccccc2CC1N Amb18124847 [0,1,0,1,0,0|2,0,0]=4 13824 B12R2.18 CC1c2ccccc2CC1N Amb32666792 [0,1,0,1,0,0|2,0,0]=4 13825 B12R2.18 CC1c2ccccc2CC1O Amb20622729 [0,1,0,1,0,0|2,0,0]=4 13826 B12R2.18 CC1c2ccccc2CC1S Amb30007058 [0,1,0,1,0,0|2,0,0]=4 13827 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1O Amb27663152 [0,1,0,1,0,0|1,0,0]=3 13828 B12R2.18 C[C@@H]1Cc2ccccc2[C@H]1N Amb27440506 [0,1,0,1,0,0|2,0,0]=4 13829 B12R2.18 C[C@@H]1Nc2ccccc2[C@H]1C Amb27205062 [0,1,0,1,0,0|2,0,0]=4 13830 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1N Amb28325929 [0,1,0,1,0,0|1,0,0]=3 13831 B12R2.18 C[C@@H]1Oc2cccnc2[C@@H]1O Amb28401114 [0,1,0,1,0,0|1,0,0]=3 13832 B12R2.18 C[C@@H]1c2ccccc2C[C@H]1N Amb27817400 [0,1,0,1,0,0|2,0,0]=4 13833 B12R2.18 C[C@H]1Cc2ccccc2[C@@H]1N Amb27850448 [0,1,0,1,0,0|2,0,0]=4 13834 B12R2.18 C[C@H]1Oc2cccnc2[C@@H]1O Amb28064079 [0,1,0,1,0,0|1,0,0]=3 13835 B12R2.18 C[C@H]1Oc2cnccc2[C@@H]1O Amb27430760 [0,1,0,1,0,0|1,0,0]=3 13836 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb28723654 [0,1,0,1,0,0|2,0,0]=4 13837 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb32666899 [0,1,0,1,0,0|2,0,0]=4 13838 B12R2.18 ClC1Oc2ccncc2C1Cl Amb27617496 [0,1,0,1,0,0|2,0,0]=4 13839 B12R2.18 Cl[C@H]1c2cnccc2O[C@@H]1Cl Amb28052079 [0,1,0,1,0,0|2,0,0]=4 13840 B12R2.18 F[C@H]1Oc2ccccc2[C@@H]1Cl Amb28385762 [0,1,0,1,0,0|1,0,0]=3 13841 B12R2.18 F[C@H]1c2ccccc2C[C@@H]1Br Amb27268524 [0,1,0,1,0,0|2,0,0]=4 13842 B12R2.18 F[C@H]1c2ccccc2C[C@H]1Br Amb28130458 [0,1,0,1,0,0|2,0,0]=4 13843 B12R2.18 NC1C(=O)Oc2ccccc21 Amb28240356 [0,1,0,1,0,0|1,0,1]=4 13844 B12R2.18 NC1Cc2ccccc2C1N Amb13953204 [0,1,0,1,0,0|2,0,0]=4 13845 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,1,0,0|1,0,0]=3 13846 B12R2.18 NC1Cc2ccccc2C1O Amb2383051 [0,1,0,1,0,0|1,0,0]=3 13847 B12R2.18 NC1c2ccccc2CC1Cl Amb4021194 [0,1,0,1,0,0|2,0,0]=4 13848 B12R2.18 NC1c2ccccc2CC1F Amb24459876 [0,1,0,1,0,0|2,0,0]=4 13849 B12R2.18 NC1c2ccccc2CC1F Amb32664161 [0,1,0,1,0,0|2,0,0]=4 13850 B12R2.18 NC1c2ccccc2CC1O Amb9781652 [0,1,0,1,0,0|2,0,0]=4 13851 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,1,0,0|1,0,0]=3 13852 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1F Amb27493415 [0,1,0,1,0,0|2,0,0]=4 13853 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb25911961 [0,1,0,1,0,0|2,0,0]=4 13854 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,1,0,0|1,0,0]=3 13855 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,1,0,0|1,0,0]=3 13856 B12R2.18 N[C@@H]1c2ccccc2C[C@@H]1O Amb2720522 [0,1,0,1,0,0|2,0,0]=4 13857 B12R2.18 N[C@@H]1c2ccccc2C[C@H]1O Amb10842210 [0,1,0,1,0,0|2,0,0]=4 13858 B12R2.18 N[C@@H]1c2ccccc2C[C@H]1O Amb32665023 [0,1,0,1,0,0|2,0,0]=4 13859 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1N Amb27881687 [0,1,0,1,0,0|2,0,0]=4 13860 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,1,0,0|1,0,0]=3 13861 B12R2.18 N[C@H]1c2ccccc2C[C@@H]1O Amb10842191 [0,1,0,1,0,0|2,0,0]=4 13862 B12R2.18 N[C@H]1c2ccccc2C[C@@H]1O Amb32665024 [0,1,0,1,0,0|2,0,0]=4 13863 B12R2.18 N[C@H]1c2ccccc2C[C@H]1F Amb32664629 [0,1,0,1,0,0|2,0,0]=4 13864 B12R2.18 N[C@H]1c2ccccc2C[C@H]1F Amb32664630 [0,1,0,1,0,0|2,0,0]=4 13865 B12R2.18 N[C@H]1c2ccccc2C[C@H]1N Amb22745804 [0,1,0,1,0,0|2,0,0]=4 13866 B12R2.18 N[C@H]1c2ccccc2C[C@H]1O Amb17779311 [0,1,0,1,0,0|2,0,0]=4 13867 B12R2.18 N[C@H]1c2ccccc2N[C@H]1O Amb27198050 [0,1,0,1,0,0|2,0,0]=4 13868 B12R2.18 O=C1Nc2ccccc2C1O Amb9748239 [0,1,0,1,0,0|1,0,1]=4 13869 B12R2.18 O=C1Oc2ccccc2C1Br Amb3939721 [0,1,0,1,0,0|1,0,1]=4 13870 B12R2.18 O=C1Sc2ccccc2C1O Amb27636570 [0,1,0,1,0,0|0,1,1]=4 13871 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,1,0,0|1,0,0]=3 13872 B12R2.18 OC1Cc2ccncc2C1O Amb27425157 [0,1,0,1,0,0|2,0,0]=4 13873 B12R2.18 OC1Oc2ccccc2C1O Amb27945780 [0,1,0,1,0,0|0,0,0]=2 13874 B12R2.18 OC1Sc2ccccc2C1O Amb27853727 [0,1,0,1,0,0|0,1,0]=3 13875 B12R2.18 OC1c2ccccc2CC1Br Amb1159074 [0,1,0,1,0,0|1,0,0]=3 13876 B12R2.18 OC1c2ccccc2CC1F Amb24423988 [0,1,0,1,0,0|1,0,0]=3 13877 B12R2.18 OC1c2ccccc2CC1S Amb27397064 [0,1,0,1,0,0|1,0,0]=3 13878 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1F Amb27428306 [0,1,0,1,0,0|2,0,0]=4 13879 B12R2.18 O[C@@H]1Cc2ccccc2[C@H]1O Amb10982589 [0,1,0,1,0,0|1,0,0]=3 13880 B12R2.18 O[C@@H]1Sc2ccccc2[C@H]1O Amb28344973 [0,1,0,1,0,0|0,1,0]=3 13881 B12R2.18 O[C@@H]1c2ccccc2CC1Br Amb27176336 [0,1,0,1,0,0|1,0,0]=3 13882 B12R2.18 O[C@@H]1c2ccccc2C[C@@H]1Cl Amb8394042 [0,1,0,1,0,0|1,0,0]=3 13883 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Br Amb28053369 [0,1,0,1,0,0|1,0,0]=3 13884 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Cl Amb24519428 [0,1,0,1,0,0|1,0,0]=3 13885 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1F Amb27228144 [0,1,0,1,0,0|1,0,0]=3 13886 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Cl Amb28052052 [0,1,0,1,0,0|2,0,0]=4 13887 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1O Amb27427979 [0,1,0,1,0,0|1,0,0]=3 13888 B12R2.18 O[C@H]1Oc2ccccc2[C@H]1O Amb27782441 [0,1,0,1,0,0|0,0,0]=2 13889 B12R2.18 O[C@H]1c2ccccc2CC1Br Amb25061997 [0,1,0,1,0,0|1,0,0]=3 13890 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Br Amb8629277 [0,1,0,1,0,0|1,0,0]=3 13891 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Cl Amb26565760 [0,1,0,1,0,0|1,0,0]=3 13892 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Br Amb27446678 [0,1,0,1,0,0|1,0,0]=3 13893 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Cl Amb2609427 [0,1,0,1,0,0|1,0,0]=3 13894 B12R2.18 O[C@H]1c2ccccc2C[C@H]1F Amb25176954 [0,1,0,1,0,0|1,0,0]=3 13895 B12R2.18 [NH3+]C1c2ccccc2CC1O Amb33512943 [0,1,0,1,0,0|2,0,0]=4 13896 B12R2.37 CC1C(N)C1c2ccccc2 Amb26503439 [0,1,0,1,0,0|2,0,0]=4 13897 B12R2.37 CC1C(N)C1c2ccccc2 Amb35751900 [0,1,0,1,0,0|2,0,0]=4 13898 B12R2.37 NC1C(N)C1c2ccccc2 Amb27791909 [0,1,0,1,0,0|2,0,0]=4 13899 B12R2.94 CC1(Cc2ccccc2)CO1 Amb26023524 [0,1,0,1,0,0|1,0,0]=3 13900 B12R2.94 CC1(Cc2ccccn2)CO1 Amb27749783 [0,1,0,1,0,0|2,0,0]=4 13901 B12R2.94 CC1(Nc2ccccc2)CC1 Amb27176430 [0,1,0,1,0,0|2,0,0]=4 13902 B12R2.94 ClC1(Sc2ccccc2)CC1 Amb27948044 [0,1,0,1,0,0|1,1,0]=4 13903 B12R2.94 FC1(Cc2ccccc2)CC1 Amb28326343 [0,1,0,1,0,0|2,0,0]=4 13904 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [0,1,0,1,0,0|2,0,0]=4 13905 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2607807 [0,1,0,1,0,0|2,0,0]=4 13906 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2721362 [0,1,0,1,0,0|2,0,0]=4 13907 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [0,1,0,1,0,0|2,0,0]=4 13908 B12R2.92 BrC1(Br)CC1c2ccccc2 Amb22363907 [0,1,0,1,0,0|2,0,0]=4 13909 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,1,0,1,0,0|2,0,0]=4 13910 B12R2.92 CC1(N)CC1c2ccccc2 Amb26359436 [0,1,0,1,0,0|2,0,0]=4 13911 B12R2.92 CC1(N)CC1c2ccccc2 Amb32661502 [0,1,0,1,0,0|2,0,0]=4 13912 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [0,1,0,1,0,0|2,0,0]=4 13913 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,1,0,1,0,0|2,0,0]=4 13914 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb28641944 [0,1,0,1,0,0|2,0,0]=4 13915 B12R2.92 C[C@@]1(O)C[C@H]1c2ccccc2 Amb33743331 [0,1,0,1,0,0|1,0,0]=3 13916 B12R2.92 ClC1(Cl)CC1c2ccccc2 Amb2686915 [0,1,0,1,0,0|2,0,0]=4 13917 B12R2.92 FC1(F)CC1c2ccccc2 Amb22227684 [0,1,0,1,0,0|2,0,0]=4 13918 B12R2.2403 CC1(C)CCc2ccccc21 Amb24657207 [0,1,0,1,0,0|2,0,0]=4 13919 B12R2.2403 CC1(C)CNc2ccccc21 Amb17232031 [0,1,0,1,0,0|2,0,0]=4 13920 B12R2.2403 CC1(C)CNc2ccccc21 Amb20630653 [0,1,0,1,0,0|2,0,0]=4 13921 B12R2.2403 CC1(C)COc2ccccc21 Amb26005281 [0,1,0,1,0,0|1,0,0]=3 13922 B12R2.2403 CC1(C)CSc2ccccc21 Amb27765267 [0,1,0,1,0,0|1,1,0]=4 13923 B12R2.2403 CC1(F)CCc2ccccc21 Amb27958822 [0,1,0,1,0,0|2,0,0]=4 13924 B12R2.2403 CC1(N)CCc2ccccc21 Amb32664163 [0,1,0,1,0,0|2,0,0]=4 13925 B12R2.2403 CC1(N)CCc2ccccc21 Amb9676193 [0,1,0,1,0,0|2,0,0]=4 13926 B12R2.2403 CC1(O)CCc2ccccc21 Amb9676017 [0,1,0,1,0,0|1,0,0]=3 13927 B12R2.2403 CC1(O)COc2ncccc21 Amb27803802 [0,1,0,1,0,0|1,0,0]=3 13928 B12R2.2403 FC1(F)CCc2ccccc21 Amb28434831 [0,1,0,1,0,0|2,0,0]=4 13929 B12R2.2403 FC1(F)CNc2ccccc21 Amb26606151 [0,1,0,1,0,0|2,0,0]=4 13930 B12R2.2403 NC1(O)CCc2ccccc21 Amb2699122 [0,1,0,1,0,0|1,0,0]=3 13931 B12R2.2403 N[C@@]1(O)CCc2ccccc21 Amb28072855 [0,1,0,1,0,0|1,0,0]=3 13932 B12R2.3190 CC(N)C1Cc2ccccc21 Amb33527560 [0,1,0,1,0,0|2,0,0]=4 13933 B12R2.3190 O=C(O)C1Cc2ccccc21 Amb4017188 [0,1,0,1,0,0|1,0,1]=4 13934 B12R3.12 c1ccc2c(c1)CC3OC23 Amb1131588 [0,0,0,2,0,0|1,0,0]=3 13935 B12R3.12 c1ccc2c(c1)C[C@@H]3O[C@H]23 Amb6893758 [0,0,0,2,0,0|1,0,0]=3 13936 B8R1.8 BrCCc1ccco1 Amb22752866 [1,0,0,0,1,0|2,0,0]=4 13937 B8R1.8 BrCCc1cccs1 Amb16234134 [1,0,0,0,1,0|2,0,0]=4 13938 B8R1.8 BrCCc1ccoc1 Amb19374721 [1,0,0,0,1,0|2,0,0]=4 13939 B8R1.8 BrCCc1ccsc1 Amb18325324 [1,0,0,0,1,0|2,0,0]=4 13940 B8R1.8 BrCCn1cccc1 Amb17933298 [1,0,0,0,1,0|2,0,0]=4 13941 B8R1.8 CCCc1ccco1 Amb10070288 [1,0,0,0,1,0|2,0,0]=4 13942 B8R1.8 CCCc1cccs1 Amb2690417 [1,0,0,0,1,0|2,0,0]=4 13943 B8R1.8 CCCc1ccsc1 Amb17689448 [1,0,0,0,1,0|2,0,0]=4 13944 B8R1.8 CCNc1ccco1 Amb27593280 [1,0,0,0,1,0|2,0,0]=4 13945 B8R1.8 CCOc1ncco1 Amb28196629 [1,0,0,0,1,0|2,0,0]=4 13946 B8R1.8 CCOc1nccs1 Amb2455931 [1,0,0,0,1,0|2,0,0]=4 13947 B8R1.8 CCOn1ccnc1 Amb2429214 [1,0,0,0,1,0|2,0,0]=4 13948 B8R1.8 CCSc1ccco1 Amb27667158 [1,0,0,0,1,0|1,1,0]=4 13949 B8R1.8 CCSc1cccs1 Amb17845323 [1,0,0,0,1,0|1,1,0]=4 13950 B8R1.8 CCSc1ccsc1 Amb27797484 [1,0,0,0,1,0|1,1,0]=4 13951 B8R1.8 C[SiH2]Oc1ccoc1 Amb27665817 [1,0,0,0,1,0|1,1,0]=4 13952 B8R1.8 ClCCc1cccs1 Amb9004334 [1,0,0,0,1,0|2,0,0]=4 13953 B8R1.8 ClCCc1ccoc1 Amb28381646 [1,0,0,0,1,0|2,0,0]=4 13954 B8R1.8 ClCCn1cccc1 Amb19944678 [1,0,0,0,1,0|2,0,0]=4 13955 B8R1.8 FCCn1cccc1 Amb27758353 [1,0,0,0,1,0|2,0,0]=4 13956 B8R1.8 ICCc1ccco1 Amb27224391 [1,0,0,0,1,0|2,0,0]=4 13957 B8R1.8 ICCn1cccc1 Amb9174999 [1,0,0,0,1,0|2,0,0]=4 13958 B8R1.8 NCCC1=CC=CC1 Amb27975816 [1,0,0,0,1,0|1,0,1]=4 13959 B8R1.8 NCCC1C=CC=C1 Amb27596137 [1,0,0,0,1,0|1,0,1]=4 13960 B8R1.8 NCC[c-]1cccc1 Amb28341069 [1,0,0,0,1,0|1,0,1]=4 13961 B8R1.8 NCCc1ccco1 Amb1080943 [1,0,0,0,1,0|2,0,0]=4 13962 B8R1.8 NCCc1ccco1 Amb22587649 [1,0,0,0,1,0|2,0,0]=4 13963 B8R1.8 NCCc1cccs1 Amb1073690 [1,0,0,0,1,0|2,0,0]=4 13964 B8R1.8 NCCc1cccs1 Amb6858256 [1,0,0,0,1,0|2,0,0]=4 13965 B8R1.8 NCCc1ccoc1 Amb18833105 [1,0,0,0,1,0|2,0,0]=4 13966 B8R1.8 NCCc1ccoc1 Amb31146576 [1,0,0,0,1,0|2,0,0]=4 13967 B8R1.8 NCCc1ccsc1 Amb2236392 [1,0,0,0,1,0|2,0,0]=4 13968 B8R1.8 NCCc1ccsc1 Amb8631337 [1,0,0,0,1,0|2,0,0]=4 13969 B8R1.8 NCCn1cccc1 Amb2422800 [1,0,0,0,1,0|2,0,0]=4 13970 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,0,0,0,1,0|0,0,1]=3 13971 B8R1.8 OCC[n+]1ccsc1 Amb24518966 [1,0,0,0,1,0|2,0,0]=4 13972 B8R1.8 OCCc1ccco1 Amb17089516 [1,0,0,0,1,0|1,0,0]=3 13973 B8R1.8 OCCc1cccs1 Amb2099445 [1,0,0,0,1,0|1,0,0]=3 13974 B8R1.8 OCCc1ccno1 Amb27164449 [1,0,0,0,1,0|2,0,0]=4 13975 B8R1.8 OCCc1ccns1 Amb23441022 [1,0,0,0,1,0|2,0,0]=4 13976 B8R1.8 OCCc1ccoc1 Amb25802261 [1,0,0,0,1,0|1,0,0]=3 13977 B8R1.8 OCCc1ccon1 Amb33198329 [1,0,0,0,1,0|2,0,0]=4 13978 B8R1.8 OCCc1ccsc1 Amb3939119 [1,0,0,0,1,0|1,0,0]=3 13979 B8R1.8 OCCc1ccsn1 Amb28453528 [1,0,0,0,1,0|2,0,0]=4 13980 B8R1.8 OCCc1cnco1 Amb33474917 [1,0,0,0,1,0|2,0,0]=4 13981 B8R1.8 OCCc1cncs1 Amb33544209 [1,0,0,0,1,0|2,0,0]=4 13982 B8R1.8 OCCc1cnoc1 Amb1971497 [1,0,0,0,1,0|2,0,0]=4 13983 B8R1.8 OCCc1cnsc1 Amb32945188 [1,0,0,0,1,0|2,0,0]=4 13984 B8R1.8 OCCc1cocn1 Amb17399797 [1,0,0,0,1,0|2,0,0]=4 13985 B8R1.8 OCCc1cscn1 Amb33548480 [1,0,0,0,1,0|2,0,0]=4 13986 B8R1.8 OCCc1ncco1 Amb27495611 [1,0,0,0,1,0|2,0,0]=4 13987 B8R1.8 OCCc1nccs1 Amb33547163 [1,0,0,0,1,0|2,0,0]=4 13988 B8R1.8 OCCn1cccc1 Amb9174997 [1,0,0,0,1,0|1,0,0]=3 13989 B8R1.8 OCCn1cccn1 Amb6382238 [1,0,0,0,1,0|2,0,0]=4 13990 B8R1.8 OCCn1ccnc1 Amb2688741 [1,0,0,0,1,0|2,0,0]=4 13991 B8R1.8 ONCc1ccco1 Amb23449450 [1,0,0,0,1,0|2,0,0]=4 13992 B8R1.8 ONCc1cccs1 Amb23449451 [1,0,0,0,1,0|2,0,0]=4 13993 B8R1.8 ONCc1ccoc1 Amb28059138 [1,0,0,0,1,0|2,0,0]=4 13994 B8R1.8 ONCc1ccsc1 Amb25994264 [1,0,0,0,1,0|2,0,0]=4 13995 B8R1.8 SCCc1ccco1 Amb24511324 [1,0,0,0,1,0|1,1,0]=4 13996 B8R1.8 SCCc1cccs1 Amb17399886 [1,0,0,0,1,0|1,1,0]=4 13997 B8R1.8 SCCc1ccoc1 Amb33360331 [1,0,0,0,1,0|1,1,0]=4 13998 B8R1.8 SCCc1ccsc1 Amb25300451 [1,0,0,0,1,0|1,1,0]=4 13999 B8R1.8 SCOc1ccco1 Amb28130026 [1,0,0,0,1,0|1,1,0]=4 14000 B12R1.329 NCCCC1=CC=CC=CC=C1 Amb26874815 [0,0,0,0,0,2|2,0,0]=4 14001 B12R1.329 OC\C=C\C1=CC=CC=CC=C1 Amb27980523 [0,0,0,0,0,2|1,0,1]=4