0 B11R2.1 BrC1=CCc2ccccc21 Amb26318514 [0,0,0,0,0,0|2,0,0]=2 1 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [0,0,0,0,0,0|2,0,1]=3 2 B11R2.1 Brc1ccc2ccccn12 Amb18061677 [0,0,0,0,0,0|3,0,1]=4 3 B11R2.1 Brc1cnc2ccccn12 Amb2389876 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.1 Brc1cnn2ccccc12 Amb2389879 [0,0,0,0,0,0|4,0,0]=4 5 B11R2.1 Brc1coc2ccccc12 Amb6344810 [0,0,0,0,0,0|3,0,0]=3 6 B11R2.1 Brc1coc2cccnc12 Amb18187782 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.1 Brc1coc2ccncc12 Amb18187801 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.1 Brc1coc2cnccc12 Amb26912398 [0,0,0,0,0,0|4,0,0]=4 9 B11R2.1 Brc1coc2ncccc12 Amb18811362 [0,0,0,0,0,0|4,0,0]=4 10 B11R2.1 Brc1csc2ccccc12 Amb2720075 [0,0,0,0,0,0|3,0,0]=3 11 B11R2.1 Brc1csc2cccnc12 Amb10070411 [0,0,0,0,0,0|4,0,0]=4 12 B11R2.1 Brc1csc2ccncc12 Amb10070410 [0,0,0,0,0,0|4,0,0]=4 13 B11R2.1 Brc1csc2cnccc12 Amb10070409 [0,0,0,0,0,0|4,0,0]=4 14 B11R2.1 Brc1csc2ncccc12 Amb10070408 [0,0,0,0,0,0|4,0,0]=4 15 B11R2.1 Brc1ncc2ccccn12 Amb21926789 [0,0,0,0,0,0|3,0,1]=4 16 B11R2.1 Brc1ncn2ccccc12 Amb20669228 [0,0,0,0,0,0|3,0,1]=4 17 B11R2.1 Brc1nnc2ccccn12 Amb19517088 [0,0,0,0,0,0|4,0,0]=4 18 B11R2.1 Brc1noc2ccccc12 Amb18187786 [0,0,0,0,0,0|3,0,0]=3 19 B11R2.1 Brc1noc2cnccc12 Amb27229155 [0,0,0,0,0,0|4,0,0]=4 20 B11R2.1 Brc1noc2ncccc12 Amb2390009 [0,0,0,0,0,0|4,0,0]=4 21 B11R2.1 Brc1nsc2ccccc12 Amb18769624 [0,0,0,0,0,0|3,0,0]=3 22 B11R2.1 Brc1nsc2ccncc12 Amb23452758 [0,0,0,0,0,0|4,0,0]=4 23 B11R2.1 Brc1snc2ccccc12 Amb22496211 [0,0,0,0,0,0|2,1,0]=3 24 B11R2.1 Brn1nnc2ccccc21 Amb28050260 [0,0,0,0,0,0|4,0,0]=4 25 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,0,0,0|2,0,0]=2 26 B11R2.1 C=C1CCc2cccnc21 Amb28289851 [0,0,0,0,0,0|3,0,0]=3 27 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [0,0,0,0,0,0|3,0,0]=3 28 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [0,0,0,0,0,0|2,0,0]=2 29 B11R2.1 CC1=CCc2cccnc21 Amb27838911 [0,0,0,0,0,0|3,0,0]=3 30 B11R2.1 CC1C=Cc2ccccc21 Amb17844052 [0,0,0,0,0,0|2,0,2]=4 31 B11R2.1 CC1CCc2ccccc21 Amb28050187 [0,0,0,0,0,0|2,0,1]=3 32 B11R2.1 CC1CCc2cccnc21 Amb28050279 [0,0,0,0,0,0|3,0,1]=4 33 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,0,0,0|3,0,1]=4 34 B11R2.1 CC1CNc2ccccc21 Amb9197981 [0,0,0,0,0,0|3,0,1]=4 35 B11R2.1 CC1COc2ccccc21 Amb27617216 [0,0,0,0,0,0|3,0,1]=4 36 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,0,0,0|2,0,1]=3 37 B11R2.1 CC1NCc2ccccc21 Amb32751285 [0,0,0,0,0,0|2,0,1]=3 38 B11R2.1 CC1OCc2ccccc21 Amb25913589 [0,0,0,0,0,0|1,0,1]=2 39 B11R2.1 CN1CCc2ccccc21 Amb15691717 [0,0,0,0,0,0|3,0,0]=3 40 B11R2.1 CN1CCc2cccnc21 Amb28434380 [0,0,0,0,0,0|4,0,0]=4 41 B11R2.1 CN1CCc2cnccc21 Amb25836379 [0,0,0,0,0,0|4,0,0]=4 42 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,0,0,0|2,0,1]=3 43 B11R2.1 C[C@@H]1NCc2ccccc21 Amb32668091 [0,0,0,0,0,0|2,0,1]=3 44 B11R2.1 C[C@H]1CNc2ccccc21 Amb27222357 [0,0,0,0,0,0|3,0,1]=4 45 B11R2.1 C[C@H]1NCc2ccccc21 Amb28206726 [0,0,0,0,0,0|2,0,1]=3 46 B11R2.1 C[C@H]1NCc2ccccc21 Amb32667894 [0,0,0,0,0,0|2,0,1]=3 47 B11R2.1 C[n+]1coc2ccccc21 Amb27961147 [0,0,0,0,0,0|4,0,0]=4 48 B11R2.1 Cc1ccc2ccccn12 Amb28126713 [0,0,0,0,0,0|3,0,1]=4 49 B11R2.1 Cc1cnc2ccccn12 Amb21960684 [0,0,0,0,0,0|4,0,0]=4 50 B11R2.1 Cc1coc2ccccc12 Amb2684177 [0,0,0,0,0,0|3,0,0]=3 51 B11R2.1 Cc1csc2ccccc12 Amb2689330 [0,0,0,0,0,0|3,0,0]=3 52 B11R2.1 Cc1ncc2ccccn12 Amb1153642 [0,0,0,0,0,0|3,0,1]=4 53 B11R2.1 Cc1ncn2ccccc12 Amb10070139 [0,0,0,0,0,0|3,0,1]=4 54 B11R2.1 Cc1nnc2ccccn12 Amb21962429 [0,0,0,0,0,0|4,0,0]=4 55 B11R2.1 Cc1nnc2ccccn12 Amb22276084 [0,0,0,0,0,0|4,0,0]=4 56 B11R2.1 Cc1noc2ccccc12 Amb445022 [0,0,0,0,0,0|3,0,0]=3 57 B11R2.1 Cc1noc2cccnc12 Amb28385491 [0,0,0,0,0,0|4,0,0]=4 58 B11R2.1 Cc1noc2ccncc12 Amb25760745 [0,0,0,0,0,0|4,0,0]=4 59 B11R2.1 Cc1noc2cnccc12 Amb22741026 [0,0,0,0,0,0|4,0,0]=4 60 B11R2.1 Cc1nsc2ccccc12 Amb26599921 [0,0,0,0,0,0|3,0,0]=3 61 B11R2.1 Cc1nsc2ncccc12 Amb22494028 [0,0,0,0,0,0|4,0,0]=4 62 B11R2.1 Cc1onc2ccccc12 Amb4120114 [0,0,0,0,0,0|2,0,0]=2 63 B11R2.1 ClC1=NN=C2C=CC=CC12 Amb2389874 [0,0,0,0,0,0|3,0,1]=4 64 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [0,0,0,0,0,0|2,0,1]=3 65 B11R2.1 ClC1CCc2cccnc21 Amb28128210 [0,0,0,0,0,0|3,0,1]=4 66 B11R2.1 ClC1COc2ccccc21 Amb27233528 [0,0,0,0,0,0|3,0,1]=4 67 B11R2.1 Clc1ccc2ccccn12 Amb27618437 [0,0,0,0,0,0|3,0,1]=4 68 B11R2.1 Clc1cnn2ccccc12 Amb22899794 [0,0,0,0,0,0|4,0,0]=4 69 B11R2.1 Clc1coc2ccccc12 Amb21963868 [0,0,0,0,0,0|3,0,0]=3 70 B11R2.1 Clc1csc2ccccc12 Amb5494165 [0,0,0,0,0,0|3,0,0]=3 71 B11R2.1 Clc1csc2cccnc12 Amb25721818 [0,0,0,0,0,0|4,0,0]=4 72 B11R2.1 Clc1nnc2ccccn12 Amb5751343 [0,0,0,0,0,0|4,0,0]=4 73 B11R2.1 Clc1noc2ccccc12 Amb2724801 [0,0,0,0,0,0|3,0,0]=3 74 B11R2.1 Clc1noc2cccnc12 Amb25194814 [0,0,0,0,0,0|4,0,0]=4 75 B11R2.1 Clc1noc2ncccc12 Amb2389843 [0,0,0,0,0,0|4,0,0]=4 76 B11R2.1 Clc1nsc2ccccc12 Amb1105427 [0,0,0,0,0,0|3,0,0]=3 77 B11R2.1 Clc1nsc2cccnc12 Amb35789699 [0,0,0,0,0,0|4,0,0]=4 78 B11R2.1 Clc1nsc2cnccc12 Amb35789173 [0,0,0,0,0,0|4,0,0]=4 79 B11R2.1 Clc1nsc2ncccc12 Amb24099964 [0,0,0,0,0,0|4,0,0]=4 80 B11R2.1 Clc1snc2ccccc12 Amb13952486 [0,0,0,0,0,0|2,1,0]=3 81 B11R2.1 Clc1snc2ncccc12 Amb23401170 [0,0,0,0,0,0|3,1,0]=4 82 B11R2.1 Cln1ccc2ccccc21 Amb28050191 [0,0,0,0,0,0|3,0,1]=4 83 B11R2.1 Cln1cnc2ccccc21 Amb24351571 [0,0,0,0,0,0|4,0,0]=4 84 B11R2.1 Cln1nnc2ccccc21 Amb10067847 [0,0,0,0,0,0|4,0,0]=4 85 B11R2.1 Cn1ccc2ccccc21 Amb6297777 [0,0,0,0,0,0|3,0,1]=4 86 B11R2.1 Cn1cnc2ccccc21 Amb6364694 [0,0,0,0,0,0|4,0,0]=4 87 B11R2.1 Cn1ncc2ccccc21 Amb4009871 [0,0,0,0,0,0|3,0,1]=4 88 B11R2.1 Cn1nnc2ccccc21 Amb4009873 [0,0,0,0,0,0|4,0,0]=4 89 B11R2.1 FC1NCc2ccccc21 Amb28197417 [0,0,0,0,0,0|2,0,1]=3 90 B11R2.1 Fc1csc2ccccc12 Amb27667159 [0,0,0,0,0,0|3,0,0]=3 91 B11R2.1 Fc1noc2ccccc12 Amb35642438 [0,0,0,0,0,0|3,0,0]=3 92 B11R2.1 Fc1snc2ccccc12 Amb30034029 [0,0,0,0,0,0|2,1,0]=3 93 B11R2.1 IC1CCc2cccnc21 Amb32685580 [0,0,0,0,0,0|3,0,1]=4 94 B11R2.1 IC1N=Nc2ccccc21 Amb26516914 [0,0,0,0,0,0|3,0,1]=4 95 B11R2.1 Ic1cnc2ccccn12 Amb8467865 [0,0,0,0,0,0|4,0,0]=4 96 B11R2.1 Ic1cnn2ccccc12 Amb22585935 [0,0,0,0,0,0|4,0,0]=4 97 B11R2.1 Ic1coc2ccccc12 Amb24622374 [0,0,0,0,0,0|3,0,0]=3 98 B11R2.1 Ic1csc2ccccc12 Amb22002561 [0,0,0,0,0,0|3,0,0]=3 99 B11R2.1 Ic1csc2cccnc12 Amb27613200 [0,0,0,0,0,0|4,0,0]=4 100 B11R2.1 Ic1ncc2ccccn12 Amb25204219 [0,0,0,0,0,0|3,0,1]=4 101 B11R2.1 Ic1ncn2ccccc12 Amb24481085 [0,0,0,0,0,0|3,0,1]=4 102 B11R2.1 Ic1nnn2ccccc12 Amb26568390 [0,0,0,0,0,0|4,0,0]=4 103 B11R2.1 Ic1snc2ccccc12 Amb27406455 [0,0,0,0,0,0|2,1,0]=3 104 B11R2.1 In1nnc2ccccc21 Amb28315637 [0,0,0,0,0,0|4,0,0]=4 105 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [0,0,0,0,0,0|2,0,0]=2 106 B11R2.1 NC1=NCc2ccccc21 Amb534105 [0,0,0,0,0,0|2,0,0]=2 107 B11R2.1 NC1=NCc2ncccc21 Amb28397871 [0,0,0,0,0,0|3,0,0]=3 108 B11R2.1 NC1C=Cc2ccccc21 Amb17470367 [0,0,0,0,0,0|2,0,2]=4 109 B11R2.1 NC1CCc2ccccc21 Amb1158023 [0,0,0,0,0,0|2,0,1]=3 110 B11R2.1 NC1CCc2ccccc21 Amb16233857 [0,0,0,0,0,0|2,0,1]=3 111 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,0,0,0|2,0,1]=3 112 B11R2.1 NC1CCc2ccccc21 Amb9677422 [0,0,0,0,0,0|2,0,1]=3 113 B11R2.1 NC1CCc2cccnc21 Amb22436792 [0,0,0,0,0,0|3,0,1]=4 114 B11R2.1 NC1CCc2ccncc21 Amb24738463 [0,0,0,0,0,0|3,0,1]=4 115 B11R2.1 NC1CCc2cnccc21 Amb22900659 [0,0,0,0,0,0|3,0,1]=4 116 B11R2.1 NC1CCc2ncccc21 Amb21858247 [0,0,0,0,0,0|3,0,1]=4 117 B11R2.1 NC1CCc2ncccc21 Amb22490383 [0,0,0,0,0,0|3,0,1]=4 118 B11R2.1 NC1COc2ccccc21 Amb13951643 [0,0,0,0,0,0|3,0,1]=4 119 B11R2.1 NC1COc2ccccc21 Amb2383232 [0,0,0,0,0,0|3,0,1]=4 120 B11R2.1 NC1CSc2ccccc21 Amb33531788 [0,0,0,0,0,0|3,0,1]=4 121 B11R2.1 NN1CCc2ccccc21 Amb2691266 [0,0,0,0,0,0|3,0,0]=3 122 B11R2.1 NN1CCc2ccccc21 Amb836793 [0,0,0,0,0,0|3,0,0]=3 123 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [0,0,0,0,0,0|2,0,1]=3 124 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [0,0,0,0,0,0|2,0,1]=3 125 B11R2.1 N[C@@H]1CCc2cccnc21 Amb22748121 [0,0,0,0,0,0|3,0,1]=4 126 B11R2.1 N[C@@H]1CCc2cnccc21 Amb26498012 [0,0,0,0,0,0|3,0,1]=4 127 B11R2.1 N[C@@H]1CCc2ncccc21 Amb27461409 [0,0,0,0,0,0|3,0,1]=4 128 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,0,0,0|3,0,1]=4 129 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,0,0,0|3,0,1]=4 130 B11R2.1 N[C@@H]1CSc2ccccc21 Amb27192844 [0,0,0,0,0,0|3,0,1]=4 131 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,0,0,0|2,0,1]=3 132 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [0,0,0,0,0,0|2,0,1]=3 133 B11R2.1 N[C@H]1CCc2cccnc21 Amb26398859 [0,0,0,0,0,0|3,0,1]=4 134 B11R2.1 N[C@H]1CCc2cccnc21 Amb33872522 [0,0,0,0,0,0|3,0,1]=4 135 B11R2.1 N[C@H]1CCc2cnccc21 Amb27173220 [0,0,0,0,0,0|3,0,1]=4 136 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,0,0,0|3,0,1]=4 137 B11R2.1 N[C@H]1COc2ccccc21 Amb33813746 [0,0,0,0,0,0|3,0,1]=4 138 B11R2.1 N[C@H]1COc2ccccc21 Amb33872471 [0,0,0,0,0,0|3,0,1]=4 139 B11R2.1 N[C@H]1CSc2ccccc21 Amb27487071 [0,0,0,0,0,0|3,0,1]=4 140 B11R2.1 Nc1ccc2ccccn12 Amb18061678 [0,0,0,0,0,0|3,0,1]=4 141 B11R2.1 Nc1ccn2ccccc12 Amb28119363 [0,0,0,0,0,0|3,0,1]=4 142 B11R2.1 Nc1cnc2ccccn12 Amb22276158 [0,0,0,0,0,0|4,0,0]=4 143 B11R2.1 Nc1cnc2ccccn12 Amb33544829 [0,0,0,0,0,0|4,0,0]=4 144 B11R2.1 Nc1cnn2ccccc12 Amb18203165 [0,0,0,0,0,0|4,0,0]=4 145 B11R2.1 Nc1cnn2ccccc12 Amb21964646 [0,0,0,0,0,0|4,0,0]=4 146 B11R2.1 Nc1cnn2ccccc12 Amb22755063 [0,0,0,0,0,0|4,0,0]=4 147 B11R2.1 Nc1coc2ccccc12 Amb24371464 [0,0,0,0,0,0|3,0,0]=3 148 B11R2.1 Nc1coc2cccnc12 Amb24742644 [0,0,0,0,0,0|4,0,0]=4 149 B11R2.1 Nc1coc2ccncc12 Amb27813427 [0,0,0,0,0,0|4,0,0]=4 150 B11R2.1 Nc1coc2cnccc12 Amb27633514 [0,0,0,0,0,0|4,0,0]=4 151 B11R2.1 Nc1coc2ncccc12 Amb18522246 [0,0,0,0,0,0|4,0,0]=4 152 B11R2.1 Nc1csc2ccccc12 Amb13890519 [0,0,0,0,0,0|3,0,0]=3 153 B11R2.1 Nc1csc2ccccc12 Amb19957699 [0,0,0,0,0,0|3,0,0]=3 154 B11R2.1 Nc1csc2cccnc12 Amb10070407 [0,0,0,0,0,0|4,0,0]=4 155 B11R2.1 Nc1csc2ccncc12 Amb10070406 [0,0,0,0,0,0|4,0,0]=4 156 B11R2.1 Nc1csc2cnccc12 Amb10067625 [0,0,0,0,0,0|4,0,0]=4 157 B11R2.1 Nc1csc2ncccc12 Amb10070405 [0,0,0,0,0,0|4,0,0]=4 158 B11R2.1 Nc1ncc2ccccn12 Amb22740154 [0,0,0,0,0,0|3,0,1]=4 159 B11R2.1 Nc1ncn2ccccc12 Amb23560066 [0,0,0,0,0,0|3,0,1]=4 160 B11R2.1 Nc1nnc2ccccn12 Amb19891300 [0,0,0,0,0,0|4,0,0]=4 161 B11R2.1 Nc1nnc2ccccn12 Amb6316209 [0,0,0,0,0,0|4,0,0]=4 162 B11R2.1 Nc1noc2ccccc12 Amb1323334 [0,0,0,0,0,0|3,0,0]=3 163 B11R2.1 Nc1noc2cccnc12 Amb18124445 [0,0,0,0,0,0|4,0,0]=4 164 B11R2.1 Nc1noc2ccncc12 Amb18203127 [0,0,0,0,0,0|4,0,0]=4 165 B11R2.1 Nc1noc2cnccc12 Amb18642986 [0,0,0,0,0,0|4,0,0]=4 166 B11R2.1 Nc1noc2ncccc12 Amb3593292 [0,0,0,0,0,0|4,0,0]=4 167 B11R2.1 Nc1nsc2ccccc12 Amb1147286 [0,0,0,0,0,0|3,0,0]=3 168 B11R2.1 Nc1nsc2ccccc12 Amb32665266 [0,0,0,0,0,0|3,0,0]=3 169 B11R2.1 Nc1nsc2ccncc12 Amb18201622 [0,0,0,0,0,0|4,0,0]=4 170 B11R2.1 Nc1nsc2ncccc12 Amb18201396 [0,0,0,0,0,0|4,0,0]=4 171 B11R2.1 Nc1onc2ccccc12 Amb21857107 [0,0,0,0,0,0|2,0,0]=2 172 B11R2.1 Nc1onc2ccncc12 Amb28245657 [0,0,0,0,0,0|3,0,0]=3 173 B11R2.1 Nc1onc2cnccc12 Amb27186474 [0,0,0,0,0,0|3,0,0]=3 174 B11R2.1 Nc1snc2ccccc12 Amb33542957 [0,0,0,0,0,0|2,1,0]=3 175 B11R2.1 Nc1snc2cccnc12 Amb20670991 [0,0,0,0,0,0|3,1,0]=4 176 B11R2.1 Nc1snc2cnccc12 Amb23401171 [0,0,0,0,0,0|3,1,0]=4 177 B11R2.1 Nc1snc2ncccc12 Amb10975921 [0,0,0,0,0,0|3,1,0]=4 178 B11R2.1 Nn1ccc2ccccc21 Amb16233739 [0,0,0,0,0,0|3,0,1]=4 179 B11R2.1 Nn1cnc2ccccc21 Amb443894 [0,0,0,0,0,0|4,0,0]=4 180 B11R2.1 Nn1ncc2ccccc21 Amb8630394 [0,0,0,0,0,0|3,0,1]=4 181 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [0,0,0,0,0,0|1,0,1]=2 182 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [0,0,0,0,0,0|1,0,0]=1 183 B11R2.1 O=C1CCc2cccnc21 Amb10602809 [0,0,0,0,0,0|2,0,0]=2 184 B11R2.1 O=C1CCc2ccncc21 Amb22491415 [0,0,0,0,0,0|2,0,0]=2 185 B11R2.1 O=C1CCc2ccncc21 Amb5719663 [0,0,0,0,0,0|2,0,0]=2 186 B11R2.1 O=C1CCc2cnccc21 Amb22235532 [0,0,0,0,0,0|2,0,0]=2 187 B11R2.1 O=C1CCc2cnccc21 Amb5719882 [0,0,0,0,0,0|2,0,0]=2 188 B11R2.1 O=C1CCc2ncccc21 Amb22275948 [0,0,0,0,0,0|2,0,0]=2 189 B11R2.1 O=C1CCc2ncccc21 Amb2695094 [0,0,0,0,0,0|2,0,0]=2 190 B11R2.1 O=C1CCc2ncncc21 Amb18832515 [0,0,0,0,0,0|3,0,0]=3 191 B11R2.1 O=C1CN=C2NC=CC=C12 Amb22491902 [0,0,0,0,0,0|3,0,0]=3 192 B11R2.1 O=C1CNc2cccc[n+]21 Amb32664845 [0,0,0,0,0,0|3,0,0]=3 193 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [0,0,0,0,0,0|2,0,0]=2 194 B11R2.1 O=C1COc2ccccc21 Amb33534383 [0,0,0,0,0,0|2,0,0]=2 195 B11R2.1 O=C1COc2cccnc21 Amb22372216 [0,0,0,0,0,0|3,0,0]=3 196 B11R2.1 O=C1COc2cnccc21 Amb20242099 [0,0,0,0,0,0|3,0,0]=3 197 B11R2.1 O=C1COc2cnccc21 Amb22728783 [0,0,0,0,0,0|3,0,0]=3 198 B11R2.1 O=C1COc2ncccc21 Amb20242022 [0,0,0,0,0,0|3,0,0]=3 199 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [0,0,0,0,0,0|2,0,0]=2 200 B11R2.1 O=C1CSc2cnccc21 Amb27265724 [0,0,0,0,0,0|3,0,0]=3 201 B11R2.1 O=C1CSc2ncccc21 Amb27153117 [0,0,0,0,0,0|3,0,0]=3 202 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,0,0,0|1,0,1]=2 203 B11R2.1 O=C1N=Cc2ccncc21 Amb28252569 [0,0,0,0,0,0|2,0,1]=3 204 B11R2.1 O=C1N=NC2=CC=CCN12 Amb26849349 [0,0,0,0,0,0|3,0,1]=4 205 B11R2.1 O=C1N=Nc2ccncc21 Amb28399448 [0,0,0,0,0,0|3,0,0]=3 206 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [0,0,0,0,0,0|2,0,1]=3 207 B11R2.1 O=C1NCC2=C1CC=CC2 Amb30869337 [0,0,0,0,0,0|1,0,2]=3 208 B11R2.1 O=C1NCC2C=CN=CC12 Amb32674569 [0,0,0,0,0,0|2,0,2]=4 209 B11R2.1 O=C1NCc2ccccc21 Amb773532 [0,0,0,0,0,0|1,0,0]=1 210 B11R2.1 O=C1NCc2cccnc21 Amb22276754 [0,0,0,0,0,0|2,0,0]=2 211 B11R2.1 O=C1NCc2ccncc21 Amb22388464 [0,0,0,0,0,0|2,0,0]=2 212 B11R2.1 O=C1NCc2ccncc21 Amb32675690 [0,0,0,0,0,0|2,0,0]=2 213 B11R2.1 O=C1NCc2cnccc21 Amb23455305 [0,0,0,0,0,0|2,0,0]=2 214 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [0,0,0,0,0,0|2,0,0]=2 215 B11R2.1 O=C1NCc2nccnc21 Amb32419114 [0,0,0,0,0,0|3,0,0]=3 216 B11R2.1 O=C1NCc2ncncc21 Amb27254107 [0,0,0,0,0,0|3,0,0]=3 217 B11R2.1 O=C1NN=C2C=CC=CN12 Amb18012675 [0,0,0,0,0,0|3,0,0]=3 218 B11R2.1 O=C1NN=C2C=CC=NN12 Amb27807806 [0,0,0,0,0,0|4,0,0]=4 219 B11R2.1 O=C1NN=C2C=NC=CN12 Amb23401333 [0,0,0,0,0,0|4,0,0]=4 220 B11R2.1 O=C1NN=C2N=CC=CN12 Amb22496213 [0,0,0,0,0,0|4,0,0]=4 221 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [0,0,0,0,0,0|2,0,0]=2 222 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [0,0,0,0,0,0|3,0,0]=3 223 B11R2.1 O=C1NNc2cnccc21 Amb21857177 [0,0,0,0,0,0|3,0,0]=3 224 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [0,0,0,0,0,0|3,0,0]=3 225 B11R2.1 O=C1NNc2nccnc21 Amb27471979 [0,0,0,0,0,0|4,0,0]=4 226 B11R2.1 O=C1NNc2ncncc21 Amb24062015 [0,0,0,0,0,0|4,0,0]=4 227 B11R2.1 O=C1NOc2cnccc21 Amb22494128 [0,0,0,0,0,0|3,0,0]=3 228 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [0,0,0,0,0,0|2,0,0]=2 229 B11R2.1 O=C1OCC2=C1CCCC2 Amb28050216 [0,0,0,0,0,0|0,0,4]=4 230 B11R2.1 O=C1OCC2=C1NCSC2 Amb26907512 [0,0,0,0,0,0|2,0,2]=4 231 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [0,0,0,0,0,0|0,0,0]=0 232 B11R2.1 O=C1OCc2cccnc21 Amb24081817 [0,0,0,0,0,0|1,0,0]=1 233 B11R2.1 O=C1OCc2ccncc21 Amb22732365 [0,0,0,0,0,0|1,0,0]=1 234 B11R2.1 O=C1OCc2ncccc21 Amb2612059 [0,0,0,0,0,0|1,0,0]=1 235 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [0,0,0,0,0,0|1,0,0]=1 236 B11R2.1 O=C1SCC2=NC=CCN12 Amb28384758 [0,0,0,0,0,0|2,1,1]=4 237 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [0,0,0,0,0,0|0,1,0]=1 238 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [0,0,0,0,0,0|1,1,0]=2 239 B11R2.1 O=c1nsc2ncccc12 Amb2759329 [0,0,0,0,0,0|3,0,0]=3 240 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [0,0,0,0,0,0|2,0,1]=3 241 B11R2.1 OB1OCc2ccccc21 Amb1027843 [0,0,0,0,0,0|1,0,1]=2 242 B11R2.1 OB1OCc2ccncc21 Amb26317440 [0,0,0,0,0,0|2,0,1]=3 243 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,0,0,0|1,0,3]=4 244 B11R2.1 OC1CCc2ccccc21 Amb9703194 [0,0,0,0,0,0|1,0,2]=3 245 B11R2.1 OC1CCc2cccnc21 Amb19958431 [0,0,0,0,0,0|2,0,2]=4 246 B11R2.1 OC1CCc2ncccc21 Amb16231393 [0,0,0,0,0,0|2,0,2]=4 247 B11R2.1 OC1COc2ccccc21 Amb33548779 [0,0,0,0,0,0|2,0,2]=4 248 B11R2.1 OC1CSc2ccccc21 Amb27174921 [0,0,0,0,0,0|2,0,2]=4 249 B11R2.1 OC1N=Cc2ccccc21 Amb27631731 [0,0,0,0,0,0|1,0,3]=4 250 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,0,0,0|0,0,2]=2 251 B11R2.1 OC1OCc2ncccc21 Amb27853463 [0,0,0,0,0,0|1,0,2]=3 252 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [0,0,0,0,0,0|1,0,2]=3 253 B11R2.1 O[C@@H]1CCc2cnccc21 Amb33715207 [0,0,0,0,0,0|2,0,2]=4 254 B11R2.1 O[C@@H]1CCc2ncccc21 Amb24511690 [0,0,0,0,0,0|2,0,2]=4 255 B11R2.1 O[C@@H]1COc2ccccc21 Amb27191568 [0,0,0,0,0,0|2,0,2]=4 256 B11R2.1 O[C@@H]1CSc2ccccc21 Amb28315859 [0,0,0,0,0,0|2,0,2]=4 257 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [0,0,0,0,0,0|1,0,2]=3 258 B11R2.1 O[C@H]1CCc2cccnc21 Amb26350485 [0,0,0,0,0,0|2,0,2]=4 259 B11R2.1 O[C@H]1CCc2ncccc21 Amb26530510 [0,0,0,0,0,0|2,0,2]=4 260 B11R2.1 O[C@H]1COc2ccccc21 Amb27946875 [0,0,0,0,0,0|2,0,2]=4 261 B11R2.1 Oc1cnc2ccccn12 Amb24074110 [0,0,0,0,0,0|3,0,1]=4 262 B11R2.1 Oc1cnn2ccccc12 Amb25359066 [0,0,0,0,0,0|3,0,1]=4 263 B11R2.1 Oc1coc2ccccc12 Amb24097480 [0,0,0,0,0,0|2,0,1]=3 264 B11R2.1 Oc1coc2cccnc12 Amb21963453 [0,0,0,0,0,0|3,0,1]=4 265 B11R2.1 Oc1coc2cccnc12 Amb33996728 [0,0,0,0,0,0|3,0,1]=4 266 B11R2.1 Oc1csc2ccccc12 Amb4009443 [0,0,0,0,0,0|2,0,1]=3 267 B11R2.1 Oc1csc2cnccc12 Amb32669775 [0,0,0,0,0,0|3,0,1]=4 268 B11R2.1 Oc1csc2ncccc12 Amb26464103 [0,0,0,0,0,0|3,0,1]=4 269 B11R2.1 Oc1nnc2ccccn12 Amb2389927 [0,0,0,0,0,0|3,0,1]=4 270 B11R2.1 Oc1noc2ccccc12 Amb2725155 [0,0,0,0,0,0|2,0,1]=3 271 B11R2.1 Oc1noc2ccncc12 Amb28458158 [0,0,0,0,0,0|3,0,1]=4 272 B11R2.1 Oc1noc2cnccc12 Amb10975477 [0,0,0,0,0,0|3,0,1]=4 273 B11R2.1 Oc1noc2ncccc12 Amb2611982 [0,0,0,0,0,0|3,0,1]=4 274 B11R2.1 Oc1nsc2ccccc12 Amb22166851 [0,0,0,0,0,0|2,0,1]=3 275 B11R2.1 On1ccc2ccccc21 Amb27243885 [0,0,0,0,0,0|2,0,2]=4 276 B11R2.1 On1cnc2ccccc21 Amb28318444 [0,0,0,0,0,0|3,0,1]=4 277 B11R2.1 On1nnc2ccccc21 Amb1151367 [0,0,0,0,0,0|3,0,1]=4 278 B11R2.1 On1nnc2ccccc21 Amb2719788 [0,0,0,0,0,0|3,0,1]=4 279 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [0,0,0,0,0,0|2,1,0]=3 280 B11R2.1 S=C1NC=C2C=CC=CN12 Amb18042920 [0,0,0,0,0,0|2,1,1]=4 281 B11R2.1 S=C1NN=C2C=CC=CN12 Amb19113815 [0,0,0,0,0,0|3,1,0]=4 282 B11R2.1 S=C1SSc2ncccc21 Amb19650658 [0,0,0,0,0,0|2,2,0]=4 283 B11R2.1 S=c1nnc2ccccc12 Amb24082861 [0,0,0,0,0,0|2,1,0]=3 284 B11R2.1 SC1CCc2ccccc21 Amb9208023 [0,0,0,0,0,0|1,1,1]=3 285 B11R2.1 SC1CCc2cccnc21 Amb24071779 [0,0,0,0,0,0|2,1,1]=4 286 B11R2.1 SC1CSc2ccccc21 Amb32788664 [0,0,0,0,0,0|2,1,1]=4 287 B11R2.1 Sc1cnn2ccccc12 Amb33147196 [0,0,0,0,0,0|3,1,0]=4 288 B11R2.1 Sc1coc2ccccc12 Amb24061893 [0,0,0,0,0,0|2,1,0]=3 289 B11R2.1 Sc1csc2ccccc12 Amb24396652 [0,0,0,0,0,0|2,1,0]=3 290 B11R2.1 Sc1ncn2ccccc12 Amb23560018 [0,0,0,0,0,0|2,1,1]=4 291 B11R2.1 Sc1nnc2ccccn12 Amb1104122 [0,0,0,0,0,0|3,1,0]=4 292 B11R2.1 Sc1nsc2ccccc12 Amb1136898 [0,0,0,0,0,0|2,1,0]=3 293 B11R2.1 [N-]=[N+]1ONc2ccccc21 Amb21953654 [0,0,0,0,0,0|3,0,0]=3 294 B11R2.1 [NH3+]C1=NCc2ccccc21 Amb4239931 [0,0,0,0,0,0|2,0,0]=2 295 B11R2.1 [O-][n+]1csc2ccccc21 Amb27767988 [0,0,0,0,0,0|3,0,1]=4 296 B11R2.1 [O-][n+]1onc2ccccc21 Amb656681 [0,0,0,0,0,0|2,0,1]=3 297 B11R2.1 [O-][n+]1onc2cccnc21 Amb25742661 [0,0,0,0,0,0|3,0,1]=4 298 B11R2.1 [O-][n+]1onc2ncccc21 Amb26390782 [0,0,0,0,0,0|3,0,1]=4 299 B11R2.1 [O-]c1csc2cccc[n+]12 Amb24309273 [0,0,0,0,0,0|3,0,1]=4 300 B11R2.1 [O-]c1noc2ncccc12 Amb2611978 [0,0,0,0,0,0|3,0,1]=4 301 B10R2.7 C1=CC2=CCN=C2C=N1 Amb27423395 [1,0,0,0,0,0|3,0,0]=4 302 B10R2.7 C1=CC2=COCN2C=N1 Amb26943866 [1,0,0,0,0,0|2,0,0]=3 303 B10R2.7 C1=CC2=CSCN2C=N1 Amb25713479 [1,0,0,0,0,0|2,1,0]=4 304 B10R2.7 C1=CC2=NCC=C2C=N1 Amb27423430 [1,0,0,0,0,0|3,0,0]=4 305 B10R2.7 C1=CNC2=CCSC2=C1 Amb28318140 [1,0,0,0,0,0|3,0,0]=4 306 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [1,0,0,0,0,0|1,0,0]=2 307 B10R2.7 C1=Cc2cnccc2C1 Amb27945600 [1,0,0,0,0,0|2,0,0]=3 308 B10R2.7 C1=NCc2cccnc21 Amb27250387 [1,0,0,0,0,0|2,0,0]=3 309 B10R2.7 C1=Nc2cccnc2C1 Amb24099986 [1,0,0,0,0,0|3,0,0]=4 310 B10R2.7 C1=Nc2ccncc2C1 Amb27950602 [1,0,0,0,0,0|3,0,0]=4 311 B10R2.7 [c+]1sc2ccccc2s1 Amb17760631 [1,0,0,0,0,0|3,0,0]=4 312 B10R2.7 b1oc2ccccc2o1 Amb22731069 [1,0,0,0,0,0|3,0,0]=4 313 B10R2.7 c1cc2c(cn1)CCN2 Amb19515489 [1,0,0,0,0,0|3,0,0]=4 314 B10R2.7 c1cc2c(cn1)CCN2 Amb22372217 [1,0,0,0,0,0|3,0,0]=4 315 B10R2.7 c1cc2c(cn1)CCO2 Amb24101562 [1,0,0,0,0,0|3,0,0]=4 316 B10R2.7 c1cc2c(cn1)CNC2 Amb10067652 [1,0,0,0,0,0|2,0,1]=4 317 B10R2.7 c1cc2c(cn1)CNC2 Amb20242101 [1,0,0,0,0,0|2,0,1]=4 318 B10R2.7 c1cc2c(cn1)CNC2 Amb2696535 [1,0,0,0,0,0|2,0,1]=4 319 B10R2.7 c1cc2c(cn1)COC2 Amb24738431 [1,0,0,0,0,0|1,0,1]=3 320 B10R2.7 c1cc2c(cn1)COC2 Amb30625050 [1,0,0,0,0,0|1,0,1]=3 321 B10R2.7 c1cc2c(cn1)N=NC2 Amb28254527 [1,0,0,0,0,0|3,0,0]=4 322 B10R2.7 c1cc2c(cn1)NCC2 Amb19516033 [1,0,0,0,0,0|3,0,0]=4 323 B10R2.7 c1cc2c(cn1)NCC2 Amb22495003 [1,0,0,0,0,0|3,0,0]=4 324 B10R2.7 c1cc2c(cn1)NCC2 Amb23412122 [1,0,0,0,0,0|3,0,0]=4 325 B10R2.7 c1cc2ccoc2cn1 Amb10067356 [1,0,0,0,0,0|3,0,0]=4 326 B10R2.7 c1cc2ccsc2cn1 Amb10067355 [1,0,0,0,0,0|3,0,0]=4 327 B10R2.7 c1cc2ccsc2cn1 Amb24066968 [1,0,0,0,0,0|3,0,0]=4 328 B10R2.7 c1cc2occc2cn1 Amb19895064 [1,0,0,0,0,0|3,0,0]=4 329 B10R2.7 c1cc2oncc2cn1 Amb27764807 [1,0,0,0,0,0|3,0,0]=4 330 B10R2.7 c1cc2sccc2cn1 Amb32664779 [1,0,0,0,0,0|3,0,0]=4 331 B10R2.7 c1cc2sccc2cn1 Amb8383970 [1,0,0,0,0,0|3,0,0]=4 332 B10R2.7 c1cc2sncc2cn1 Amb27763388 [1,0,0,0,0,0|3,0,0]=4 333 B10R2.7 c1cc[n+]2c(c1)OCC2 Amb22364467 [1,0,0,0,0,0|3,0,0]=4 334 B10R2.7 c1ccc2[se]ccc2c1 Amb8515166 [1,0,0,0,0,0|2,0,0]=3 335 B10R2.7 c1ccc2c(c1)CCC2 Amb6608915 [1,0,0,0,0,0|1,0,1]=3 336 B10R2.7 c1ccc2c(c1)CCN2 Amb1869493 [1,0,0,0,0,0|2,0,0]=3 337 B10R2.7 c1ccc2c(c1)CCO2 Amb2687295 [1,0,0,0,0,0|2,0,0]=3 338 B10R2.7 c1ccc2c(c1)CNC2 Amb33527370 [1,0,0,0,0,0|1,0,1]=3 339 B10R2.7 c1ccc2c(c1)CNC2 Amb33544332 [1,0,0,0,0,0|1,0,1]=3 340 B10R2.7 c1ccc2c(c1)CNN2 Amb8386538 [1,0,0,0,0,0|2,0,0]=3 341 B10R2.7 c1ccc2c(c1)COC2 Amb2780010 [1,0,0,0,0,0|0,0,1]=2 342 B10R2.7 c1ccc2c(c1)CPC2 Amb27217940 [1,0,0,0,0,0|1,0,1]=3 343 B10R2.7 c1ccc2c(c1)CSC2 Amb21962922 [1,0,0,0,0,0|0,1,1]=3 344 B10R2.7 c1ccc2c(c1)N=S=N2 Amb17755407 [1,0,0,0,0,0|2,1,0]=4 345 B10R2.7 c1ccc2c(c1)N=[Se]=N2 Amb17683892 [1,0,0,0,0,0|2,1,0]=4 346 B10R2.7 c1ccc2c(c1)NCO2 Amb28050014 [1,0,0,0,0,0|3,0,0]=4 347 B10R2.7 c1ccc2c(c1)OCO2 Amb2684576 [1,0,0,0,0,0|3,0,0]=4 348 B10R2.7 c1ccc2c(c1)OSO2 Amb28050023 [1,0,0,0,0,0|2,1,0]=4 349 B10R2.7 c1ccc2c(c1)SCS2 Amb26548649 [1,0,0,0,0,0|3,0,0]=4 350 B10R2.7 c1ccc2cscc2c1 Amb24066379 [1,0,0,0,0,0|0,1,1]=3 351 B10R2.7 c1ccc2n[se]nc2c1 Amb534261 [1,0,0,0,0,0|2,1,0]=4 352 B10R2.7 c1ccc2nonc2c1 Amb2724589 [1,0,0,0,0,0|2,0,0]=3 353 B10R2.7 c1ccc2nscc2c1 Amb25336989 [1,0,0,0,0,0|1,1,0]=3 354 B10R2.7 c1ccc2nsnc2c1 Amb1395747 [1,0,0,0,0,0|2,1,0]=4 355 B10R2.7 c1ccc2occc2c1 Amb2725466 [1,0,0,0,0,0|2,0,0]=3 356 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [1,0,0,0,0,0|3,0,0]=4 357 B10R2.7 c1ccc2oncc2c1 Amb1233398 [1,0,0,0,0,0|2,0,0]=3 358 B10R2.7 c1ccc2sccc2c1 Amb2782006 [1,0,0,0,0,0|2,0,0]=3 359 B10R2.7 c1ccc2scnc2c1 Amb2609954 [1,0,0,0,0,0|3,0,0]=4 360 B10R2.7 c1ccc2snnc2c1 Amb2612181 [1,0,0,0,0,0|3,0,0]=4 361 B10R2.7 c1ccn2cccc2c1 Amb10605601 [1,0,0,0,0,0|2,0,1]=4 362 B10R2.7 c1ccn2ccnc2c1 Amb2235938 [1,0,0,0,0,0|3,0,0]=4 363 B10R2.7 c1ccn2ccnc2c1 Amb8629968 [1,0,0,0,0,0|3,0,0]=4 364 B10R2.7 c1ccn2cncc2c1 Amb10070943 [1,0,0,0,0,0|2,0,1]=4 365 B10R2.7 c1ccn2cnnc2c1 Amb17597649 [1,0,0,0,0,0|3,0,0]=4 366 B10R2.7 c1ccn2cnnc2c1 Amb22042412 [1,0,0,0,0,0|3,0,0]=4 367 B10R2.7 c1ccn2nccc2c1 Amb10604230 [1,0,0,0,0,0|3,0,0]=4 368 B10R2.7 c1ccn2nncc2c1 Amb4011283 [1,0,0,0,0,0|3,0,0]=4 369 B10R2.7 c1cnc2c(c1)CCC2 Amb8386888 [1,0,0,0,0,0|2,0,1]=4 370 B10R2.7 c1cnc2c(c1)CCN2 Amb32406061 [1,0,0,0,0,0|3,0,0]=4 371 B10R2.7 c1cnc2c(c1)CCN2 Amb6751887 [1,0,0,0,0,0|3,0,0]=4 372 B10R2.7 c1cnc2c(c1)CCO2 Amb25337454 [1,0,0,0,0,0|3,0,0]=4 373 B10R2.7 c1cnc2c(c1)CCS2 Amb8439003 [1,0,0,0,0,0|3,0,0]=4 374 B10R2.7 c1cnc2c(c1)CNC2 Amb20671408 [1,0,0,0,0,0|2,0,1]=4 375 B10R2.7 c1cnc2c(c1)CNC2 Amb22489863 [1,0,0,0,0,0|2,0,1]=4 376 B10R2.7 c1cnc2c(c1)CNC2 Amb2696534 [1,0,0,0,0,0|2,0,1]=4 377 B10R2.7 c1cnc2c(c1)CNC2 Amb33172747 [1,0,0,0,0,0|2,0,1]=4 378 B10R2.7 c1cnc2c(c1)CNC2 Amb33172763 [1,0,0,0,0,0|2,0,1]=4 379 B10R2.7 c1cnc2c(c1)CNC2 Amb8630212 [1,0,0,0,0,0|2,0,1]=4 380 B10R2.7 c1cnc2c(c1)COC2 Amb24467517 [1,0,0,0,0,0|1,0,1]=3 381 B10R2.7 c1cnc2c(c1)NCC2 Amb18833005 [1,0,0,0,0,0|3,0,0]=4 382 B10R2.7 c1cnc2c(c1)NCC2 Amb33069019 [1,0,0,0,0,0|3,0,0]=4 383 B10R2.7 c1cnc2c(c1)OCC2 Amb23455396 [1,0,0,0,0,0|3,0,0]=4 384 B10R2.7 c1cnc2cc[se]c2c1 Amb2611539 [1,0,0,0,0,0|3,0,0]=4 385 B10R2.7 c1cnc2ccoc2c1 Amb16185654 [1,0,0,0,0,0|3,0,0]=4 386 B10R2.7 c1cnc2ccoc2c1 Amb30585174 [1,0,0,0,0,0|3,0,0]=4 387 B10R2.7 c1cnc2ccsc2c1 Amb10070404 [1,0,0,0,0,0|3,0,0]=4 388 B10R2.7 c1cnc2cnsc2c1 Amb27185797 [1,0,0,0,0,0|3,0,0]=4 389 B10R2.7 c1cnc2conc2c1 Amb26001309 [1,0,0,0,0,0|2,0,0]=3 390 B10R2.7 c1cnc2cscc2c1 Amb27955126 [1,0,0,0,0,0|1,1,1]=4 391 B10R2.7 c1cnc2nonc2c1 Amb28364864 [1,0,0,0,0,0|3,0,0]=4 392 B10R2.7 c1cnc2occc2c1 Amb21963452 [1,0,0,0,0,0|3,0,0]=4 393 B10R2.7 c1cnc2oncc2c1 Amb27954714 [1,0,0,0,0,0|3,0,0]=4 394 B10R2.7 c1cnc2sccc2c1 Amb10070403 [1,0,0,0,0,0|3,0,0]=4 395 B10R2.7 c1ncc2conc2n1 Amb26370588 [1,0,0,0,0,0|3,0,0]=4 396 B12R2.1 BrCC1CCc2ccccc21 Amb22500999 [0,1,0,0,0,0|2,0,1]=4 397 B12R2.1 BrCc1coc2ccccc12 Amb23401826 [0,1,0,0,0,0|3,0,0]=4 398 B12R2.1 BrCc1csc2ccccc12 Amb10609548 [0,1,0,0,0,0|3,0,0]=4 399 B12R2.1 BrCc1noc2ccccc12 Amb8390314 [0,1,0,0,0,0|3,0,0]=4 400 B12R2.1 BrCc1nsc2ccccc12 Amb26026453 [0,1,0,0,0,0|3,0,0]=4 401 B12R2.1 BrCc1onc2ccccc12 Amb28182496 [0,1,0,0,0,0|2,0,0]=3 402 B12R2.1 C#CC1=CCc2ccccc21 Amb25921455 [0,1,0,0,0,0|2,0,0]=3 403 B12R2.1 C#CC1CCc2ccccc21 Amb28203681 [0,1,0,0,0,0|2,0,1]=4 404 B12R2.1 C#Cc1coc2ccccc12 Amb27468515 [0,1,0,0,0,0|3,0,0]=4 405 B12R2.1 C=CC1CCc2ccccc21 Amb33145111 [0,1,0,0,0,0|2,0,1]=4 406 B12R2.1 C=CC1OCc2ccccc21 Amb8392579 [0,1,0,0,0,0|1,0,1]=3 407 B12R2.1 C=CN1CCc2ccccc21 Amb28323569 [0,1,0,0,0,0|3,0,0]=4 408 B12R2.1 C=Cc1csc2ccccc12 Amb27409855 [0,1,0,0,0,0|3,0,0]=4 409 B12R2.1 C=Cc1onc2ccccc12 Amb27208307 [0,1,0,0,0,0|2,0,0]=3 410 B12R2.1 CCC1=CCc2ccccc21 Amb27227340 [0,1,0,0,0,0|2,0,0]=3 411 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,0,0,0|2,0,1]=4 412 B12R2.1 CCC1NCc2ccccc21 Amb30584702 [0,1,0,0,0,0|2,0,1]=4 413 B12R2.1 CCc1coc2ccccc12 Amb27792683 [0,1,0,0,0,0|3,0,0]=4 414 B12R2.1 CNC1CCc2ccccc21 Amb9705483 [0,1,0,0,0,0|2,0,1]=4 415 B12R2.1 CNc1coc2ccccc12 Amb26039834 [0,1,0,0,0,0|3,0,0]=4 416 B12R2.1 CNc1csc2ccccc12 Amb23403655 [0,1,0,0,0,0|3,0,0]=4 417 B12R2.1 CNc1noc2ccccc12 Amb28346874 [0,1,0,0,0,0|3,0,0]=4 418 B12R2.1 CNc1nsc2ccccc12 Amb26975049 [0,1,0,0,0,0|3,0,0]=4 419 B12R2.1 CNc1nsc2ccccc12 Amb32666797 [0,1,0,0,0,0|3,0,0]=4 420 B12R2.1 COC1=CCc2ccccc21 Amb17778910 [0,1,0,0,0,0|1,0,1]=3 421 B12R2.1 COC1CCc2ccccc21 Amb25880282 [0,1,0,0,0,0|1,0,2]=4 422 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,0,0,0|0,0,2]=3 423 B12R2.1 COc1csc2ccccc12 Amb28320302 [0,1,0,0,0,0|2,0,1]=4 424 B12R2.1 COc1noc2ccccc12 Amb23571257 [0,1,0,0,0,0|2,0,1]=4 425 B12R2.1 CSc1nsc2ccccc12 Amb28323593 [0,1,0,0,0,0|2,1,0]=4 426 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [0,1,0,0,0,0|2,0,1]=4 427 B12R2.1 C\C=C1\CNc2ccccc21 Amb27967275 [0,1,0,0,0,0|3,0,0]=4 428 B12R2.1 ClCC1CCc2ccccc21 Amb22500998 [0,1,0,0,0,0|2,0,1]=4 429 B12R2.1 ClCc1coc2ccccc12 Amb5716310 [0,1,0,0,0,0|3,0,0]=4 430 B12R2.1 ClCc1csc2ccccc12 Amb7808742 [0,1,0,0,0,0|3,0,0]=4 431 B12R2.1 ClCc1noc2ccccc12 Amb28141425 [0,1,0,0,0,0|3,0,0]=4 432 B12R2.1 ClCc1onc2ccccc12 Amb35781905 [0,1,0,0,0,0|2,0,0]=3 433 B12R2.1 FCC1NCc2ccccc21 Amb27211089 [0,1,0,0,0,0|2,0,1]=4 434 B12R2.1 FCc1coc2ccccc12 Amb27186252 [0,1,0,0,0,0|3,0,0]=4 435 B12R2.1 N#CC1=CCc2ccccc21 Amb17231929 [0,1,0,0,0,0|2,0,0]=3 436 B12R2.1 N#CC1CCc2ccccc21 Amb33528298 [0,1,0,0,0,0|2,0,1]=4 437 B12R2.1 N#CN1CCc2ccccc21 Amb24484539 [0,1,0,0,0,0|3,0,0]=4 438 B12R2.1 N#C[IH2]1OCc2ccccc21 Amb22489904 [0,1,0,0,0,0|2,0,0]=3 439 B12R2.1 N#Cc1coc2ccccc12 Amb10808759 [0,1,0,0,0,0|3,0,0]=4 440 B12R2.1 N#Cc1csc2ccccc12 Amb18182421 [0,1,0,0,0,0|3,0,0]=4 441 B12R2.1 N#Cc1nsc2ccccc12 Amb18126255 [0,1,0,0,0,0|3,0,0]=4 442 B12R2.1 N#Cc1onc2cccnc12 Amb26001275 [0,1,0,0,0,0|3,0,0]=4 443 B12R2.1 NCC1=CCc2ccccc21 Amb18560208 [0,1,0,0,0,0|2,0,0]=3 444 B12R2.1 NCC1CCc2ccccc21 Amb22500956 [0,1,0,0,0,0|2,0,1]=4 445 B12R2.1 NCC1CCc2ccccc21 Amb8950115 [0,1,0,0,0,0|2,0,1]=4 446 B12R2.1 NCC1OCc2ccccc21 Amb28067348 [0,1,0,0,0,0|1,0,1]=3 447 B12R2.1 NCC1OCc2ccccc21 Amb28872331 [0,1,0,0,0,0|1,0,1]=3 448 B12R2.1 NCc1coc2ccccc12 Amb19373967 [0,1,0,0,0,0|3,0,0]=4 449 B12R2.1 NCc1coc2ccccc12 Amb19649824 [0,1,0,0,0,0|3,0,0]=4 450 B12R2.1 NCc1csc2ccccc12 Amb2723184 [0,1,0,0,0,0|3,0,0]=4 451 B12R2.1 NCc1csc2ccccc12 Amb3941423 [0,1,0,0,0,0|3,0,0]=4 452 B12R2.1 NCc1noc2ccccc12 Amb33531498 [0,1,0,0,0,0|3,0,0]=4 453 B12R2.1 NCc1noc2ccccc12 Amb33536485 [0,1,0,0,0,0|3,0,0]=4 454 B12R2.1 NCc1nsc2ccccc12 Amb18646122 [0,1,0,0,0,0|3,0,0]=4 455 B12R2.1 NCc1nsc2ccccc12 Amb28872324 [0,1,0,0,0,0|3,0,0]=4 456 B12R2.1 NNC1CCc2ccccc21 Amb6250083 [0,1,0,0,0,0|2,0,1]=4 457 B12R2.1 NNc1coc2ccccc12 Amb35704215 [0,1,0,0,0,0|3,0,0]=4 458 B12R2.1 NNc1nsc2ccccc12 Amb1115216 [0,1,0,0,0,0|3,0,0]=4 459 B12R2.1 NNc1snc2ccccc12 Amb27664497 [0,1,0,0,0,0|2,1,0]=4 460 B12R2.1 N\N=C1/CCc2ccccc21 Amb33734274 [0,1,0,0,0,0|2,0,0]=3 461 B12R2.1 N\N=C1/COc2ccccc21 Amb27862558 [0,1,0,0,0,0|3,0,0]=4 462 B12R2.1 N\N=C1\CCc2ccccc21 Amb2384463 [0,1,0,0,0,0|2,0,0]=3 463 B12R2.1 N\N=C1\CSc2ccccc21 Amb27395953 [0,1,0,0,0,0|3,0,0]=4 464 B12R2.1 O=CC1C=Nc2ccccc21 Amb21952746 [0,1,0,0,0,0|2,0,1]=4 465 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,0,0,0|1,0,1]=3 466 B12R2.1 O=CC1CCc2ncccc21 Amb27620030 [0,1,0,0,0,0|2,0,1]=4 467 B12R2.1 O=CC1CSc2ccccc21 Amb27456947 [0,1,0,0,0,0|2,0,1]=4 468 B12R2.1 O=CC1OCc2ccccc21 Amb27225913 [0,1,0,0,0,0|0,0,1]=2 469 B12R2.1 O=C[C@@H]1CCc2ccccc21 Amb28319720 [0,1,0,0,0,0|1,0,1]=3 470 B12R2.1 O=C[C@H]1CCc2ccccc21 Amb27164668 [0,1,0,0,0,0|1,0,1]=3 471 B12R2.1 O=Cc1ccc2ccccn12 Amb18559296 [0,1,0,0,0,0|2,0,1]=4 472 B12R2.1 O=Cc1ccn2ccccc12 Amb24089168 [0,1,0,0,0,0|2,0,1]=4 473 B12R2.1 O=Cc1cnc2ccccn12 Amb9901908 [0,1,0,0,0,0|3,0,0]=4 474 B12R2.1 O=Cc1cnn2ccccc12 Amb18124776 [0,1,0,0,0,0|3,0,0]=4 475 B12R2.1 O=Cc1coc2ccccc12 Amb10844786 [0,1,0,0,0,0|2,0,0]=3 476 B12R2.1 O=Cc1coc2cccnc12 Amb22495093 [0,1,0,0,0,0|3,0,0]=4 477 B12R2.1 O=Cc1coc2ccncc12 Amb18202345 [0,1,0,0,0,0|3,0,0]=4 478 B12R2.1 O=Cc1coc2cnccc12 Amb22495092 [0,1,0,0,0,0|3,0,0]=4 479 B12R2.1 O=Cc1coc2ncccc12 Amb18202347 [0,1,0,0,0,0|3,0,0]=4 480 B12R2.1 O=Cc1csc2ccccc12 Amb1157901 [0,1,0,0,0,0|2,0,0]=3 481 B12R2.1 O=Cc1csc2cccnc12 Amb18662694 [0,1,0,0,0,0|3,0,0]=4 482 B12R2.1 O=Cc1csc2ccncc12 Amb18139569 [0,1,0,0,0,0|3,0,0]=4 483 B12R2.1 O=Cc1csc2cnccc12 Amb18135843 [0,1,0,0,0,0|3,0,0]=4 484 B12R2.1 O=Cc1csc2ncccc12 Amb18139558 [0,1,0,0,0,0|3,0,0]=4 485 B12R2.1 O=Cc1ncc2ccccn12 Amb18124774 [0,1,0,0,0,0|2,0,1]=4 486 B12R2.1 O=Cc1ncn2ccccc12 Amb18559503 [0,1,0,0,0,0|2,0,1]=4 487 B12R2.1 O=Cc1nnc2ccccn12 Amb23450391 [0,1,0,0,0,0|3,0,0]=4 488 B12R2.1 O=Cc1nnn2ccccc12 Amb18202317 [0,1,0,0,0,0|3,0,0]=4 489 B12R2.1 O=Cc1noc2cccnc12 Amb27633323 [0,1,0,0,0,0|3,0,0]=4 490 B12R2.1 O=Cc1noc2ccncc12 Amb27963151 [0,1,0,0,0,0|3,0,0]=4 491 B12R2.1 O=Cc1noc2ncccc12 Amb18202280 [0,1,0,0,0,0|3,0,0]=4 492 B12R2.1 O=Cc1nsc2ccncc12 Amb18199776 [0,1,0,0,0,0|3,0,0]=4 493 B12R2.1 O=Cc1nsc2ncccc12 Amb18199775 [0,1,0,0,0,0|3,0,0]=4 494 B12R2.1 O=Cc1occ2ccccc12 Amb27793276 [0,1,0,0,0,0|0,0,1]=2 495 B12R2.1 O=Cc1onc2ccccc12 Amb18831437 [0,1,0,0,0,0|1,0,0]=2 496 B12R2.1 O=Cc1snc2ccccc12 Amb26948515 [0,1,0,0,0,0|1,1,0]=3 497 B12R2.1 O=Cn1nnc2ccccc21 Amb3374289 [0,1,0,0,0,0|3,0,0]=4 498 B12R2.1 O=NN1CCc2ccccc21 Amb17689298 [0,1,0,0,0,0|2,0,0]=3 499 B12R2.1 O=Nc1ccc2ccccn12 Amb28203842 [0,1,0,0,0,0|2,0,1]=4 500 B12R2.1 O=Nn1cnc2ccccc21 Amb26451421 [0,1,0,0,0,0|3,0,0]=4 501 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,0,0,0|1,0,2]=4 502 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,0,0,0|1,0,2]=4 503 B12R2.1 OCc1coc2ccccc12 Amb10572402 [0,1,0,0,0,0|2,0,1]=4 504 B12R2.1 OCc1csc2ccccc12 Amb2723182 [0,1,0,0,0,0|2,0,1]=4 505 B12R2.1 OCc1noc2ccccc12 Amb22498744 [0,1,0,0,0,0|2,0,1]=4 506 B12R2.1 OCc1occ2ccccc12 Amb28345290 [0,1,0,0,0,0|0,0,2]=3 507 B12R2.1 OCc1onc2ccccc12 Amb35781902 [0,1,0,0,0,0|1,0,1]=3 508 B12R2.1 OCc1snc2ccccc12 Amb27839871 [0,1,0,0,0,0|1,1,1]=4 509 B12R2.1 ONc1csc2ccccc12 Amb27638522 [0,1,0,0,0,0|2,0,1]=4 510 B12R2.1 ONc1snc2ccccc12 Amb28365603 [0,1,0,0,0,0|1,1,1]=4 511 B12R2.1 O\N=C1/CCc2ccccc21 Amb4016236 [0,1,0,0,0,0|1,0,1]=3 512 B12R2.1 O\N=C1/COc2ccccc21 Amb19650724 [0,1,0,0,0,0|2,0,1]=4 513 B12R2.1 O\N=C1/NCc2ccccc21 Amb24746464 [0,1,0,0,0,0|1,0,1]=3 514 B12R2.1 O\N=C1\COc2ccccc21 Amb27840218 [0,1,0,0,0,0|2,0,1]=4 515 B12R2.1 SCC1CCc2ccccc21 Amb33144588 [0,1,0,0,0,0|1,1,1]=4 516 B12R2.1 SCc1coc2ccccc12 Amb24405838 [0,1,0,0,0,0|2,1,0]=4 517 B12R2.1 SCc1csc2ccccc12 Amb3429654 [0,1,0,0,0,0|2,1,0]=4 518 B12R2.1 [C-]#[N+]C1CCc2ccccc21 Amb2688965 [0,1,0,0,0,0|2,0,1]=4 519 B12R2.1 [C-]#[N+][C@@H]1CCc2ccccc21 Amb2688966 [0,1,0,0,0,0|2,0,1]=4 520 B12R2.1 [C-]#[N+]c1csc2ccccc12 Amb33313010 [0,1,0,0,0,0|3,0,0]=4 521 B12R2.1 [N-]=[N+]=C1N=Nc2ccccc21 Amb27441838 [0,1,0,0,0,0|3,0,0]=4 522 B12R2.18 BN1c2ccccc2CC1C Amb27445828 [0,1,0,0,0,0|3,0,0]=4 523 B12R2.18 Brc1sc2ccccc2c1Br Amb21858144 [0,1,0,0,0,0|3,0,0]=4 524 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [0,1,0,0,0,0|3,0,0]=4 525 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,1,0,0,0,0|1,0,0]=2 526 B12R2.18 C=C1Cc2ccccc2C1C Amb30007059 [0,1,0,0,0,0|2,0,1]=4 527 B12R2.18 C=C1c2ccccc2OC1O Amb27197539 [0,1,0,0,0,0|3,0,0]=4 528 B12R2.18 C=C1c2ccccc2SC1O Amb27775969 [0,1,0,0,0,0|3,0,0]=4 529 B12R2.18 CC1=C(C)c2ccccc2C1 Amb21948330 [0,1,0,0,0,0|2,0,0]=3 530 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,1,0,0,0,0|2,0,1]=4 531 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [0,1,0,0,0,0|1,0,0]=2 532 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [0,1,0,0,0,0|2,0,1]=4 533 B12R2.18 CC1Cc2ccccc2C1N Amb17232033 [0,1,0,0,0,0|2,0,1]=4 534 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [0,1,0,0,0,0|2,0,1]=4 535 B12R2.18 CC1Cc2ccccc2C1O Amb27228534 [0,1,0,0,0,0|1,0,2]=4 536 B12R2.18 CC1Cc2ccccc2N1C Amb5718020 [0,1,0,0,0,0|3,0,0]=4 537 B12R2.18 CC1Cc2ccccc2N1N Amb6298689 [0,1,0,0,0,0|3,0,0]=4 538 B12R2.18 CC1Cc2ccccc2N1N Amb8629624 [0,1,0,0,0,0|3,0,0]=4 539 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [0,1,0,0,0,0|2,0,0]=3 540 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [0,1,0,0,0,0|2,0,0]=3 541 B12R2.18 CC1c2ccccc2CC1Br Amb29887209 [0,1,0,0,0,0|2,0,1]=4 542 B12R2.18 CC1c2ccccc2CC1Cl Amb29887229 [0,1,0,0,0,0|2,0,1]=4 543 B12R2.18 CC1c2ccccc2CC1N Amb18124847 [0,1,0,0,0,0|2,0,1]=4 544 B12R2.18 CC1c2ccccc2CC1N Amb32666792 [0,1,0,0,0,0|2,0,1]=4 545 B12R2.18 CC1c2ccccc2CC1O Amb20622729 [0,1,0,0,0,0|2,0,1]=4 546 B12R2.18 CC1c2ccccc2CC1S Amb30007058 [0,1,0,0,0,0|2,0,1]=4 547 B12R2.18 CC1c2ccccc2CN1O Amb28399442 [0,1,0,0,0,0|2,0,1]=4 548 B12R2.18 CN1C(=O)Cc2ccccc21 Amb1398903 [0,1,0,0,0,0|3,0,0]=4 549 B12R2.18 CN1C(=S)Cc2ccccc21 Amb8389728 [0,1,0,0,0,0|3,0,0]=4 550 B12R2.18 CN1Cc2ccccc2C1=O Amb4006345 [0,1,0,0,0,0|1,0,0]=2 551 B12R2.18 CN1Cc2cnccc2C1=O Amb28062941 [0,1,0,0,0,0|2,0,0]=3 552 B12R2.18 CN1Nc2ccccc2C1=N Amb27646089 [0,1,0,0,0,0|3,0,0]=4 553 B12R2.18 CN1Oc2ccccc2C1=O Amb27760365 [0,1,0,0,0,0|2,0,0]=3 554 B12R2.18 CN1Sc2ccccc2C1=O Amb27218159 [0,1,0,0,0,0|2,0,0]=3 555 B12R2.18 CN1Sc2ccccc2C1=S Amb22347590 [0,1,0,0,0,0|2,1,0]=4 556 B12R2.18 CN1Sc2ccccc2S1=O Amb27878898 [0,1,0,0,0,0|3,0,0]=4 557 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1O Amb27663152 [0,1,0,0,0,0|1,0,2]=4 558 B12R2.18 C[C@@H]1Cc2ccccc2[C@H]1N Amb27440506 [0,1,0,0,0,0|2,0,1]=4 559 B12R2.18 C[C@@H]1c2ccccc2C[C@H]1N Amb27817400 [0,1,0,0,0,0|2,0,1]=4 560 B12R2.18 C[C@H]1Cc2ccccc2[C@@H]1N Amb27850448 [0,1,0,0,0,0|2,0,1]=4 561 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb28723654 [0,1,0,0,0,0|2,0,1]=4 562 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb32666899 [0,1,0,0,0,0|2,0,1]=4 563 B12R2.18 Cc1c(Br)oc2ccccc12 Amb24451202 [0,1,0,0,0,0|3,0,0]=4 564 B12R2.18 Cc1c(I)sc2ccccc12 Amb26042872 [0,1,0,0,0,0|3,0,0]=4 565 B12R2.18 Cc1c(N)oc2ccccc12 Amb18202306 [0,1,0,0,0,0|3,0,0]=4 566 B12R2.18 Cc1c(O)oc2ccccc12 Amb33310521 [0,1,0,0,0,0|3,0,0]=4 567 B12R2.18 Cc1c2ccccc2nn1C Amb23437154 [0,1,0,0,0,0|3,0,0]=4 568 B12R2.18 Cc1c2ccccc2nn1N Amb2612189 [0,1,0,0,0,0|3,0,0]=4 569 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,1,0,0,0,0|3,0,0]=4 570 B12R2.18 Cc1oc2ccccc2c1C Amb8516959 [0,1,0,0,0,0|3,0,0]=4 571 B12R2.18 Cc1sc2ccccc2c1Br Amb10975969 [0,1,0,0,0,0|3,0,0]=4 572 B12R2.18 Cc1sc2ccccc2c1I Amb25247275 [0,1,0,0,0,0|3,0,0]=4 573 B12R2.18 Clc1c(Br)oc2ccccc12 Amb28284723 [0,1,0,0,0,0|3,0,0]=4 574 B12R2.18 Clc1oc2ccccc2c1Br Amb33433284 [0,1,0,0,0,0|3,0,0]=4 575 B12R2.18 Clc1sc2ccccc2c1Br Amb27792393 [0,1,0,0,0,0|3,0,0]=4 576 B12R2.18 Clc1sc2ccccc2c1Cl Amb20669291 [0,1,0,0,0,0|3,0,0]=4 577 B12R2.18 Cn1nc2ccccc2c1Br Amb25909805 [0,1,0,0,0,0|3,0,0]=4 578 B12R2.18 Cn1nc2ccccc2c1Cl Amb28434884 [0,1,0,0,0,0|3,0,0]=4 579 B12R2.18 Cn1nc2ccccc2c1I Amb22494609 [0,1,0,0,0,0|3,0,0]=4 580 B12R2.18 Cn1nc2ccccc2c1N Amb24084319 [0,1,0,0,0,0|3,0,0]=4 581 B12R2.18 Cn1nc2ccccc2c1S Amb33310612 [0,1,0,0,0,0|2,1,0]=4 582 B12R2.18 F[C@H]1c2ccccc2C[C@@H]1Br Amb27268524 [0,1,0,0,0,0|2,0,1]=4 583 B12R2.18 F[C@H]1c2ccccc2C[C@H]1Br Amb28130458 [0,1,0,0,0,0|2,0,1]=4 584 B12R2.18 Fc1sc2ccccc2c1Br Amb28323565 [0,1,0,0,0,0|3,0,0]=4 585 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [0,1,0,0,0,0|3,0,0]=4 586 B12R2.18 NC1=Nc2ccccc2S1=O Amb27875514 [0,1,0,0,0,0|3,0,0]=4 587 B12R2.18 NC1C(=O)Cc2ccccc21 Amb25949607 [0,1,0,0,0,0|2,0,1]=4 588 B12R2.18 NC1C(=O)Cc2ccccc21 Amb35788430 [0,1,0,0,0,0|2,0,1]=4 589 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [0,1,0,0,0,0|1,0,0]=2 590 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [0,1,0,0,0,0|1,0,0]=2 591 B12R2.18 NC1Cc2ccccc2C1N Amb13953204 [0,1,0,0,0,0|2,0,1]=4 592 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [0,1,0,0,0,0|1,0,2]=4 593 B12R2.18 NC1Cc2ccccc2C1O Amb2383051 [0,1,0,0,0,0|1,0,2]=4 594 B12R2.18 NC1Cc2cccnc2C1=O Amb25922720 [0,1,0,0,0,0|2,0,0]=3 595 B12R2.18 NC1c2ccccc2CC1Cl Amb4021194 [0,1,0,0,0,0|2,0,1]=4 596 B12R2.18 NC1c2ccccc2CC1F Amb24459876 [0,1,0,0,0,0|2,0,1]=4 597 B12R2.18 NC1c2ccccc2CC1F Amb32664161 [0,1,0,0,0,0|2,0,1]=4 598 B12R2.18 NC1c2ccccc2CC1O Amb9781652 [0,1,0,0,0,0|2,0,1]=4 599 B12R2.18 NN1C(=O)Cc2ccccc21 Amb10560115 [0,1,0,0,0,0|3,0,0]=4 600 B12R2.18 NN1Cc2ccccc2C1=O Amb28652918 [0,1,0,0,0,0|1,0,0]=2 601 B12R2.18 N[C@@H]1C(=O)Cc2ccccc21 Amb27202727 [0,1,0,0,0,0|2,0,1]=4 602 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [0,1,0,0,0,0|1,0,2]=4 603 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1F Amb27493415 [0,1,0,0,0,0|2,0,1]=4 604 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb25911961 [0,1,0,0,0,0|2,0,1]=4 605 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [0,1,0,0,0,0|1,0,2]=4 606 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [0,1,0,0,0,0|1,0,2]=4 607 B12R2.18 N[C@@H]1c2ccccc2C[C@@H]1O Amb2720522 [0,1,0,0,0,0|2,0,1]=4 608 B12R2.18 N[C@@H]1c2ccccc2C[C@H]1O Amb10842210 [0,1,0,0,0,0|2,0,1]=4 609 B12R2.18 N[C@@H]1c2ccccc2C[C@H]1O Amb32665023 [0,1,0,0,0,0|2,0,1]=4 610 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1N Amb27881687 [0,1,0,0,0,0|2,0,1]=4 611 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [0,1,0,0,0,0|1,0,2]=4 612 B12R2.18 N[C@H]1c2ccccc2C[C@@H]1O Amb10842191 [0,1,0,0,0,0|2,0,1]=4 613 B12R2.18 N[C@H]1c2ccccc2C[C@@H]1O Amb32665024 [0,1,0,0,0,0|2,0,1]=4 614 B12R2.18 N[C@H]1c2ccccc2C[C@H]1F Amb32664629 [0,1,0,0,0,0|2,0,1]=4 615 B12R2.18 N[C@H]1c2ccccc2C[C@H]1F Amb32664630 [0,1,0,0,0,0|2,0,1]=4 616 B12R2.18 N[C@H]1c2ccccc2C[C@H]1N Amb22745804 [0,1,0,0,0,0|2,0,1]=4 617 B12R2.18 N[C@H]1c2ccccc2C[C@H]1O Amb17779311 [0,1,0,0,0,0|2,0,1]=4 618 B12R2.18 Nc1c(Br)sc2ccccc12 Amb18135010 [0,1,0,0,0,0|3,0,0]=4 619 B12R2.18 Nc1sc2ccccc2c1Br Amb18135037 [0,1,0,0,0,0|3,0,0]=4 620 B12R2.18 Nc1sc2ccccc2c1N Amb27823311 [0,1,0,0,0,0|3,0,0]=4 621 B12R2.18 O=C1C(=S)Nc2ccccc21 Amb17594053 [0,1,0,0,0,0|2,0,0]=3 622 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,1,0,0,0,0|1,0,1]=3 623 B12R2.18 O=C1C(Cl)=Nc2ccccc21 Amb17594117 [0,1,0,0,0,0|2,0,0]=3 624 B12R2.18 O=C1Cc2ccccc2C1=O Amb2694764 [0,1,0,0,0,0|1,0,0]=2 625 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,1,0,0,0,0|2,0,1]=4 626 B12R2.18 O=C1Cc2ccccc2C1Cl Amb27159145 [0,1,0,0,0,0|2,0,1]=4 627 B12R2.18 O=C1Cc2ccccc2N1O Amb17940424 [0,1,0,0,0,0|2,0,1]=4 628 B12R2.18 O=C1N=C2C=CC=CN2C1=O Amb18528339 [0,1,0,0,0,0|3,0,0]=4 629 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [0,1,0,0,0,0|2,0,0]=3 630 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [0,1,0,0,0,0|2,1,0]=4 631 B12R2.18 O=C1Nc2ncccc2C1=O Amb10976067 [0,1,0,0,0,0|3,0,0]=4 632 B12R2.18 O=C1Oc2ccccc2C1=O Amb9783305 [0,1,0,0,0,0|2,0,0]=3 633 B12R2.18 O=C1Sc2ccccc2C1=O Amb2608884 [0,1,0,0,0,0|2,0,0]=3 634 B12R2.18 O=C1c2ccccc2CC1Br Amb2724122 [0,1,0,0,0,0|1,0,0]=2 635 B12R2.18 O=C1c2ccccc2CC1Cl Amb4402396 [0,1,0,0,0,0|1,0,0]=2 636 B12R2.18 O=C1c2ccccc2CC1F Amb17593723 [0,1,0,0,0,0|1,0,0]=2 637 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [0,1,0,0,0,0|1,0,0]=2 638 B12R2.18 O=C1c2cccnc2CN1Cl Amb27172064 [0,1,0,0,0,0|2,0,0]=3 639 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [0,1,0,0,0,0|1,0,2]=4 640 B12R2.18 OC1c2ccccc2CC1Br Amb1159074 [0,1,0,0,0,0|1,0,2]=4 641 B12R2.18 OC1c2ccccc2CC1F Amb24423988 [0,1,0,0,0,0|1,0,2]=4 642 B12R2.18 OC1c2ccccc2CC1S Amb27397064 [0,1,0,0,0,0|1,0,2]=4 643 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1F Amb27428306 [0,1,0,0,0,0|2,0,1]=4 644 B12R2.18 O[C@@H]1Cc2ccccc2[C@H]1O Amb10982589 [0,1,0,0,0,0|1,0,2]=4 645 B12R2.18 O[C@@H]1c2ccccc2CC1Br Amb27176336 [0,1,0,0,0,0|1,0,2]=4 646 B12R2.18 O[C@@H]1c2ccccc2C[C@@H]1Cl Amb8394042 [0,1,0,0,0,0|1,0,2]=4 647 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Br Amb28053369 [0,1,0,0,0,0|1,0,2]=4 648 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Cl Amb24519428 [0,1,0,0,0,0|1,0,2]=4 649 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1F Amb27228144 [0,1,0,0,0,0|1,0,2]=4 650 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Cl Amb28052052 [0,1,0,0,0,0|2,0,1]=4 651 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1O Amb27427979 [0,1,0,0,0,0|1,0,2]=4 652 B12R2.18 O[C@H]1c2ccccc2CC1Br Amb25061997 [0,1,0,0,0,0|1,0,2]=4 653 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Br Amb8629277 [0,1,0,0,0,0|1,0,2]=4 654 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Cl Amb26565760 [0,1,0,0,0,0|1,0,2]=4 655 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Br Amb27446678 [0,1,0,0,0,0|1,0,2]=4 656 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Cl Amb2609427 [0,1,0,0,0,0|1,0,2]=4 657 B12R2.18 O[C@H]1c2ccccc2C[C@H]1F Amb25176954 [0,1,0,0,0,0|1,0,2]=4 658 B12R2.18 Oc1sc2ccccc2c1O Amb27966224 [0,1,0,0,0,0|2,0,1]=4 659 B12R2.18 [NH3+]C1c2ccccc2CC1O Amb33512943 [0,1,0,0,0,0|2,0,1]=4 660 B12R2.132 BrC1CCc2ccc(I)cc21 Amb28143847 [0,1,0,0,0,0|2,0,1]=4 661 B12R2.132 Brc1ccc2c(c1)C(Br)CC2 Amb24707166 [0,1,0,0,0,0|2,0,1]=4 662 B12R2.132 Brc1ccc2nsc(I)c2c1 Amb32758835 [0,1,0,0,0,0|2,1,0]=4 663 B12R2.132 Brc1ccc2occ(Br)c2c1 Amb2723640 [0,1,0,0,0,0|3,0,0]=4 664 B12R2.132 CC1=CCc2ccc(C)cc21 Amb27949310 [0,1,0,0,0,0|2,0,0]=3 665 B12R2.132 CC1NCc2ccc(Br)cc21 Amb25693070 [0,1,0,0,0,0|2,0,1]=4 666 B12R2.132 CN1CCc2ccc(Br)cc21 Amb25087238 [0,1,0,0,0,0|3,0,0]=4 667 B12R2.132 CN1CCc2ccc(N)cc21 Amb6683381 [0,1,0,0,0,0|3,0,0]=4 668 B12R2.132 C[C@@H]1NCc2ccc(I)cc21 Amb27945710 [0,1,0,0,0,0|2,0,1]=4 669 B12R2.132 C[C@H]1NCc2ccc(Br)cc21 Amb24642891 [0,1,0,0,0,0|2,0,1]=4 670 B12R2.132 Cc1cc2c(cn1)OCC2=O Amb22728381 [0,1,0,0,0,0|3,0,0]=4 671 B12R2.132 Cc1ccc2c(c1)B(O)OC2 Amb25777120 [0,1,0,0,0,0|1,0,1]=3 672 B12R2.132 Cc1ccc2c(c1)C(=O)CC2 Amb2781670 [0,1,0,0,0,0|1,0,0]=2 673 B12R2.132 Cc1ccc2c(c1)C(=O)CN2 Amb18202305 [0,1,0,0,0,0|2,0,0]=3 674 B12R2.132 Cc1ccc2c(c1)C(=O)CO2 Amb6683471 [0,1,0,0,0,0|2,0,0]=3 675 B12R2.132 Cc1ccc2c(c1)C(=O)CS2 Amb18199752 [0,1,0,0,0,0|2,0,0]=3 676 B12R2.132 Cc1ccc2c(c1)C(=O)NC2 Amb19517084 [0,1,0,0,0,0|1,0,0]=2 677 B12R2.132 Cc1ccc2c(c1)C(=O)NN2 Amb19748512 [0,1,0,0,0,0|2,0,0]=3 678 B12R2.132 Cc1ccc2c(c1)C(=O)OC2 Amb24060123 [0,1,0,0,0,0|0,0,0]=1 679 B12R2.132 Cc1ccc2c(c1)C(=O)SN2 Amb32673864 [0,1,0,0,0,0|1,1,0]=3 680 B12R2.132 Cc1ccc2c(c1)C(Cl)CC2 Amb8630737 [0,1,0,0,0,0|2,0,1]=4 681 B12R2.132 Cc1ccc2c(c1)C(N)CC2 Amb19301139 [0,1,0,0,0,0|2,0,1]=4 682 B12R2.132 Cc1ccc2c(c1)C(N)CC2 Amb8630795 [0,1,0,0,0,0|2,0,1]=4 683 B12R2.132 Cc1ccc2c(c1)C(O)CC2 Amb17087924 [0,1,0,0,0,0|1,0,2]=4 684 B12R2.132 Cc1ccc2c(c1)C(S)CC2 Amb26657199 [0,1,0,0,0,0|1,1,1]=4 685 B12R2.132 Cc1ccc2c(c1)[C@H](N)CC2 Amb25367187 [0,1,0,0,0,0|2,0,1]=4 686 B12R2.132 Cc1ccc2c(n1)C(=O)CC2 Amb26880481 [0,1,0,0,0,0|2,0,0]=3 687 B12R2.132 Cc1ccc2no[n+]([O-])c2c1 Amb619826 [0,1,0,0,0,0|2,0,1]=4 688 B12R2.132 Cc1ccc2nsc(N)c2c1 Amb27646636 [0,1,0,0,0,0|2,1,0]=4 689 B12R2.132 Cc1ccc2occ(Br)c2c1 Amb26345721 [0,1,0,0,0,0|3,0,0]=4 690 B12R2.132 Cc1ccc2occ(C)c2c1 Amb23440813 [0,1,0,0,0,0|3,0,0]=4 691 B12R2.132 Cc1ccc2occ(O)c2c1 Amb33299851 [0,1,0,0,0,0|2,0,1]=4 692 B12R2.132 Cc1ccc2onc(C)c2c1 Amb9792959 [0,1,0,0,0,0|3,0,0]=4 693 B12R2.132 Cc1ccc2onc(Cl)c2c1 Amb21857028 [0,1,0,0,0,0|3,0,0]=4 694 B12R2.132 Cc1ccc2onc(N)c2c1 Amb21857108 [0,1,0,0,0,0|3,0,0]=4 695 B12R2.132 Cc1ccc2scc(N)c2c1 Amb23402527 [0,1,0,0,0,0|3,0,0]=4 696 B12R2.132 Cc1ccc2snc(C)c2c1 Amb28130078 [0,1,0,0,0,0|3,0,0]=4 697 B12R2.132 Cc1ccc2snc(Cl)c2c1 Amb25377318 [0,1,0,0,0,0|3,0,0]=4 698 B12R2.132 Cc1cnc2c(c1)C(=O)NN2 Amb27209989 [0,1,0,0,0,0|3,0,0]=4 699 B12R2.132 Cc1coc2ccc(Br)cc12 Amb5722044 [0,1,0,0,0,0|3,0,0]=4 700 B12R2.132 Cc1coc2ccc(Cl)cc12 Amb20622396 [0,1,0,0,0,0|3,0,0]=4 701 B12R2.132 Cc1coc2ccc(F)cc12 Amb20622399 [0,1,0,0,0,0|3,0,0]=4 702 B12R2.132 Cc1coc2ccc(N)cc12 Amb28383907 [0,1,0,0,0,0|3,0,0]=4 703 B12R2.132 Cc1coc2ccc(O)cc12 Amb18124872 [0,1,0,0,0,0|3,0,0]=4 704 B12R2.132 Cc1csc2ccc(Br)cc12 Amb10068740 [0,1,0,0,0,0|3,0,0]=4 705 B12R2.132 Cc1csc2ccc(Cl)cc12 Amb2686206 [0,1,0,0,0,0|3,0,0]=4 706 B12R2.132 Cc1csc2ccc(F)cc12 Amb2688192 [0,1,0,0,0,0|3,0,0]=4 707 B12R2.132 Cc1csc2ccc(I)cc12 Amb27612912 [0,1,0,0,0,0|3,0,0]=4 708 B12R2.132 Cc1csc2ccc(N)cc12 Amb25151209 [0,1,0,0,0,0|3,0,0]=4 709 B12R2.132 Cc1csc2ccc(O)cc12 Amb18126407 [0,1,0,0,0,0|3,0,0]=4 710 B12R2.132 Cc1ncc2c(n1)C(=O)CC2 Amb27849098 [0,1,0,0,0,0|3,0,0]=4 711 B12R2.132 Cc1noc2ccc(Br)cc12 Amb22751636 [0,1,0,0,0,0|3,0,0]=4 712 B12R2.132 Cc1noc2ccc(Cl)cc12 Amb25887102 [0,1,0,0,0,0|3,0,0]=4 713 B12R2.132 Cc1noc2ccc(I)cc12 Amb28255880 [0,1,0,0,0,0|3,0,0]=4 714 B12R2.132 Cc1noc2ccc(N)cc12 Amb6674808 [0,1,0,0,0,0|3,0,0]=4 715 B12R2.132 Cc1noc2ccc(O)cc12 Amb22497507 [0,1,0,0,0,0|3,0,0]=4 716 B12R2.132 Cc1nsc2ccc(Br)cc12 Amb25893499 [0,1,0,0,0,0|3,0,0]=4 717 B12R2.132 Cc1nsc2ccc(Cl)cc12 Amb2614503 [0,1,0,0,0,0|3,0,0]=4 718 B12R2.132 Cc1nsc2ccc(O)cc12 Amb18126421 [0,1,0,0,0,0|3,0,0]=4 719 B12R2.132 Cc1onc2ccc(Cl)cc12 Amb22751074 [0,1,0,0,0,0|2,0,0]=3 720 B12R2.132 Clc1ccc2c(c1)C(Br)CC2 Amb33538443 [0,1,0,0,0,0|2,0,1]=4 721 B12R2.132 Clc1ccc2c(c1)C(Cl)CC2 Amb8630756 [0,1,0,0,0,0|2,0,1]=4 722 B12R2.132 Clc1ccc2occ(Br)c2c1 Amb25742477 [0,1,0,0,0,0|3,0,0]=4 723 B12R2.132 Clc1ccc2onc(Cl)c2c1 Amb20171048 [0,1,0,0,0,0|3,0,0]=4 724 B12R2.132 Clc1ccc2scc(Cl)c2c1 Amb28436176 [0,1,0,0,0,0|3,0,0]=4 725 B12R2.132 Clc1ccc2snc(Cl)c2c1 Amb26929022 [0,1,0,0,0,0|3,0,0]=4 726 B12R2.132 Clc1coc2ccc(Br)cc12 Amb18159965 [0,1,0,0,0,0|3,0,0]=4 727 B12R2.132 Clc1csc2ccc(Br)cc12 Amb28204991 [0,1,0,0,0,0|3,0,0]=4 728 B12R2.132 Clc1noc2ccc(Br)cc12 Amb10603816 [0,1,0,0,0,0|3,0,0]=4 729 B12R2.132 Clc1noc2ccc(I)cc12 Amb24488103 [0,1,0,0,0,0|3,0,0]=4 730 B12R2.132 Clc1nsc2ccc(Br)cc12 Amb25237269 [0,1,0,0,0,0|3,0,0]=4 731 B12R2.132 FC1CCc2ccc(Br)cc21 Amb27445274 [0,1,0,0,0,0|2,0,1]=4 732 B12R2.132 FC1CCc2ccc(Cl)cc21 Amb27441335 [0,1,0,0,0,0|2,0,1]=4 733 B12R2.132 Fc1ccc2c(c1)C(Br)CC2 Amb33538444 [0,1,0,0,0,0|2,0,1]=4 734 B12R2.132 Fc1ccc2c(c1)C(Cl)CC2 Amb17087975 [0,1,0,0,0,0|2,0,1]=4 735 B12R2.132 Fc1ccc2occ(Br)c2c1 Amb28044734 [0,1,0,0,0,0|3,0,0]=4 736 B12R2.132 Fc1ccc2onc(Cl)c2c1 Amb19959271 [0,1,0,0,0,0|3,0,0]=4 737 B12R2.132 Fc1ccc2scc(Br)c2c1 Amb27754561 [0,1,0,0,0,0|3,0,0]=4 738 B12R2.132 Fc1ccc2scc(Cl)c2c1 Amb27878551 [0,1,0,0,0,0|3,0,0]=4 739 B12R2.132 Fc1ccc2snc(Cl)c2c1 Amb32710025 [0,1,0,0,0,0|3,0,0]=4 740 B12R2.132 N=C1OCc2ccc(F)cc21 Amb32992879 [0,1,0,0,0,0|1,0,0]=2 741 B12R2.132 NC1=CN2C(=O)NC=C2C=C1 Amb25290888 [0,1,0,0,0,0|2,0,1]=4 742 B12R2.132 NC1=CN2C(=O)NN=C2C=C1 Amb18201987 [0,1,0,0,0,0|3,0,0]=4 743 B12R2.132 NC1=NCc2ccc(F)cc21 Amb19374948 [0,1,0,0,0,0|2,0,0]=3 744 B12R2.132 NC1=NCc2ccc(F)cc21 Amb28285357 [0,1,0,0,0,0|2,0,0]=3 745 B12R2.132 NC1CCc2ccc(Br)cc21 Amb22277084 [0,1,0,0,0,0|2,0,1]=4 746 B12R2.132 NC1CCc2ccc(Br)cc21 Amb2383225 [0,1,0,0,0,0|2,0,1]=4 747 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb21964442 [0,1,0,0,0,0|2,0,1]=4 748 B12R2.132 NC1CCc2ccc(Cl)cc21 Amb2383223 [0,1,0,0,0,0|2,0,1]=4 749 B12R2.132 NC1CCc2ccc(F)cc21 Amb19373327 [0,1,0,0,0,0|2,0,1]=4 750 B12R2.132 NC1CCc2ccc(F)cc21 Amb2383224 [0,1,0,0,0,0|2,0,1]=4 751 B12R2.132 NC1CCc2ccc(I)cc21 Amb28240959 [0,1,0,0,0,0|2,0,1]=4 752 B12R2.132 NC1CCc2ccc(O)cc21 Amb20241032 [0,1,0,0,0,0|2,0,1]=4 753 B12R2.132 NN1CCc2ccc(F)cc21 Amb18125382 [0,1,0,0,0,0|3,0,0]=4 754 B12R2.132 N[C@@H]1CCc2ccc(Br)cc21 Amb25890526 [0,1,0,0,0,0|2,0,1]=4 755 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb16233798 [0,1,0,0,0,0|2,0,1]=4 756 B12R2.132 N[C@@H]1CCc2ccc(F)cc21 Amb22388617 [0,1,0,0,0,0|2,0,1]=4 757 B12R2.132 N[C@@H]1CCc2ccc(O)cc21 Amb10608774 [0,1,0,0,0,0|2,0,1]=4 758 B12R2.132 N[C@@H]1CCc2ccc(O)cc21 Amb30869373 [0,1,0,0,0,0|2,0,1]=4 759 B12R2.132 N[C@H]1CCc2ccc(Br)cc21 Amb27441142 [0,1,0,0,0,0|2,0,1]=4 760 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb22288710 [0,1,0,0,0,0|2,0,1]=4 761 B12R2.132 N[C@H]1CCc2ccc(F)cc21 Amb26976221 [0,1,0,0,0,0|2,0,1]=4 762 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb19929575 [0,1,0,0,0,0|2,0,1]=4 763 B12R2.132 N[C@H]1CCc2ccc(O)cc21 Amb33623226 [0,1,0,0,0,0|2,0,1]=4 764 B12R2.132 Nc1cc2c(cn1)CNC2=O Amb28051675 [0,1,0,0,0,0|2,0,0]=3 765 B12R2.132 Nc1ccc2c(c1)B(O)OC2 Amb10068944 [0,1,0,0,0,0|1,0,1]=3 766 B12R2.132 Nc1ccc2c(c1)B(O)OC2 Amb21963523 [0,1,0,0,0,0|1,0,1]=3 767 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,0,0,0|1,0,0]=2 768 B12R2.132 Nc1ccc2c(c1)C(=O)CN2 Amb27963196 [0,1,0,0,0,0|2,0,0]=3 769 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,0,0,0|2,0,0]=3 770 B12R2.132 Nc1ccc2c(c1)C(=O)CS2 Amb18199702 [0,1,0,0,0,0|2,0,0]=3 771 B12R2.132 Nc1ccc2c(c1)C(=O)NC2 Amb9490509 [0,1,0,0,0,0|1,0,0]=2 772 B12R2.132 Nc1ccc2c(c1)C(=O)NN2 Amb21959377 [0,1,0,0,0,0|2,0,0]=3 773 B12R2.132 Nc1ccc2c(c1)C(=O)NO2 Amb21963754 [0,1,0,0,0,0|2,0,0]=3 774 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 Amb1042312 [0,1,0,0,0,0|0,0,0]=1 775 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 Amb32653314 [0,1,0,0,0,0|0,0,0]=1 776 B12R2.132 Nc1ccc2c(c1)C(F)CC2 Amb27808587 [0,1,0,0,0,0|2,0,1]=4 777 B12R2.132 Nc1ccc2c(c1)C(N)CC2 Amb26642909 [0,1,0,0,0,0|2,0,1]=4 778 B12R2.132 Nc1ccc2c(c1)C(O)CC2 Amb22490266 [0,1,0,0,0,0|1,0,2]=4 779 B12R2.132 Nc1ccc2c(c1)[C@@H](N)CC2 Amb19889682 [0,1,0,0,0,0|2,0,1]=4 780 B12R2.132 Nc1ccc2c(c1)[C@H](N)CC2 Amb19889681 [0,1,0,0,0,0|2,0,1]=4 781 B12R2.132 Nc1ccc2scc(Br)c2c1 Amb27762421 [0,1,0,0,0,0|3,0,0]=4 782 B12R2.132 Nc1ccc2scc(O)c2c1 Amb27965442 [0,1,0,0,0,0|2,0,1]=4 783 B12R2.132 Nc1ccc2snc(Cl)c2c1 Amb27791464 [0,1,0,0,0,0|3,0,0]=4 784 B12R2.132 Nc1ccc2snc(N)c2c1 Amb24519100 [0,1,0,0,0,0|3,0,0]=4 785 B12R2.132 Nc1cnc2c(c1)C(=O)CC2 Amb18202261 [0,1,0,0,0,0|2,0,0]=3 786 B12R2.132 Nc1coc2ccc(O)cc12 Amb18831353 [0,1,0,0,0,0|3,0,0]=4 787 B12R2.132 Nc1csc2ccc(Br)cc12 Amb23403633 [0,1,0,0,0,0|3,0,0]=4 788 B12R2.132 Nc1csc2ccc(Cl)cc12 Amb23403647 [0,1,0,0,0,0|3,0,0]=4 789 B12R2.132 Nc1csc2ccc(F)cc12 Amb23403639 [0,1,0,0,0,0|3,0,0]=4 790 B12R2.132 Nc1csc2ccc(O)cc12 Amb32708792 [0,1,0,0,0,0|3,0,0]=4 791 B12R2.132 Nc1ncc2c(n1)C(=O)NC2 Amb18201983 [0,1,0,0,0,0|3,0,0]=4 792 B12R2.132 Nc1noc2ccc(Br)cc12 Amb7990124 [0,1,0,0,0,0|3,0,0]=4 793 B12R2.132 Nc1noc2ccc(Cl)cc12 Amb23437119 [0,1,0,0,0,0|3,0,0]=4 794 B12R2.132 Nc1noc2ccc(F)cc12 Amb17739833 [0,1,0,0,0,0|3,0,0]=4 795 B12R2.132 Nc1noc2ccc(I)cc12 Amb23437123 [0,1,0,0,0,0|3,0,0]=4 796 B12R2.132 Nc1noc2ccc(O)cc12 Amb23402948 [0,1,0,0,0,0|3,0,0]=4 797 B12R2.132 Nc1nsc2ccc(Br)cc12 Amb19957749 [0,1,0,0,0,0|3,0,0]=4 798 B12R2.132 Nc1nsc2ccc(Cl)cc12 Amb18649045 [0,1,0,0,0,0|3,0,0]=4 799 B12R2.132 Nc1nsc2ccc(F)cc12 Amb27843689 [0,1,0,0,0,0|3,0,0]=4 800 B12R2.132 Nc1nsc2ccc(I)cc12 Amb26015003 [0,1,0,0,0,0|3,0,0]=4 801 B12R2.132 Nc1nsc2ccc(O)cc12 Amb28129921 [0,1,0,0,0,0|3,0,0]=4 802 B12R2.132 Nc1onc2ccc(Cl)cc12 Amb28125853 [0,1,0,0,0,0|2,0,0]=3 803 B12R2.132 Nc1snc2ccc(Br)cc12 Amb22496210 [0,1,0,0,0,0|2,1,0]=4 804 B12R2.132 Nc1snc2ccc(Cl)cc12 Amb4301561 [0,1,0,0,0,0|2,1,0]=4 805 B12R2.132 O=C1C=Cc2ccc(O)cc21 Amb25237100 [0,1,0,0,0,0|1,0,1]=3 806 B12R2.132 O=C1CCc2ccc(Br)cc21 Amb2383532 [0,1,0,0,0,0|1,0,0]=2 807 B12R2.132 O=C1CCc2ccc(Br)nc21 Amb26576678 [0,1,0,0,0,0|2,0,0]=3 808 B12R2.132 O=C1CCc2ccc(Cl)cc21 Amb2383530 [0,1,0,0,0,0|1,0,0]=2 809 B12R2.132 O=C1CCc2ccc(Cl)nc21 Amb16233495 [0,1,0,0,0,0|2,0,0]=3 810 B12R2.132 O=C1CCc2ccc(F)cc21 Amb2383531 [0,1,0,0,0,0|1,0,0]=2 811 B12R2.132 O=C1CCc2ccc(I)cc21 Amb10603865 [0,1,0,0,0,0|1,0,0]=2 812 B12R2.132 O=C1CCc2ccc(O)cc21 Amb2612891 [0,1,0,0,0,0|1,0,0]=2 813 B12R2.132 O=C1CCc2cnc(Cl)cc21 Amb27480692 [0,1,0,0,0,0|2,0,0]=3 814 B12R2.132 O=C1CCc2ncc(Br)cc21 Amb26316408 [0,1,0,0,0,0|2,0,0]=3 815 B12R2.132 O=C1CCc2ncc(Cl)cc21 Amb28076097 [0,1,0,0,0,0|2,0,0]=3 816 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb18772113 [0,1,0,0,0,0|2,0,0]=3 817 B12R2.132 O=C1CNc2ccc(F)cc21 Amb18831267 [0,1,0,0,0,0|2,0,0]=3 818 B12R2.132 O=C1COc2ccc(Br)cc21 Amb33534386 [0,1,0,0,0,0|2,0,0]=3 819 B12R2.132 O=C1COc2ccc(Cl)cc21 Amb2383540 [0,1,0,0,0,0|2,0,0]=3 820 B12R2.132 O=C1COc2ccc(Cl)nc21 Amb28322790 [0,1,0,0,0,0|3,0,0]=4 821 B12R2.132 O=C1COc2ccc(F)cc21 Amb33534384 [0,1,0,0,0,0|2,0,0]=3 822 B12R2.132 O=C1COc2ccc(O)cc21 Amb24061522 [0,1,0,0,0,0|2,0,0]=3 823 B12R2.132 O=C1COc2cnc(Cl)cc21 Amb25189287 [0,1,0,0,0,0|3,0,0]=4 824 B12R2.132 O=C1COc2ncc(Br)cc21 Amb25678464 [0,1,0,0,0,0|3,0,0]=4 825 B12R2.132 O=C1COc2ncc(F)cc21 Amb26463984 [0,1,0,0,0,0|3,0,0]=4 826 B12R2.132 O=C1CSc2ccc(Br)cc21 Amb18159426 [0,1,0,0,0,0|2,0,0]=3 827 B12R2.132 O=C1CSc2ccc(Cl)cc21 Amb18822608 [0,1,0,0,0,0|2,0,0]=3 828 B12R2.132 O=C1CSc2ccc(I)cc21 Amb27246724 [0,1,0,0,0,0|2,0,0]=3 829 B12R2.132 O=C1N=Cc2ccc(I)cc21 Amb22015255 [0,1,0,0,0,0|1,0,1]=3 830 B12R2.132 O=C1N=Cc2ccc(O)cc21 Amb22015254 [0,1,0,0,0,0|1,0,1]=3 831 B12R2.132 O=C1NCc2ccc(Br)cc21 Amb19516102 [0,1,0,0,0,0|1,0,0]=2 832 B12R2.132 O=C1NCc2ccc(Cl)cc21 Amb20241173 [0,1,0,0,0,0|1,0,0]=2 833 B12R2.132 O=C1NCc2ccc(F)cc21 Amb20171614 [0,1,0,0,0,0|1,0,0]=2 834 B12R2.132 O=C1NCc2ccc(I)cc21 Amb21963095 [0,1,0,0,0,0|1,0,0]=2 835 B12R2.132 O=C1NCc2ccc(O)cc21 Amb15690702 [0,1,0,0,0,0|1,0,0]=2 836 B12R2.132 O=C1NCc2cnc(Cl)cc21 Amb25859073 [0,1,0,0,0,0|2,0,0]=3 837 B12R2.132 O=C1NCc2ncc(Br)cc21 Amb22276347 [0,1,0,0,0,0|2,0,0]=3 838 B12R2.132 O=C1NN=C2C=CC(Br)=CN12 Amb18770525 [0,1,0,0,0,0|3,0,0]=4 839 B12R2.132 O=C1NN=C2C=CC(Cl)=CN12 Amb24598642 [0,1,0,0,0,0|3,0,0]=4 840 B12R2.132 O=C1NNc2cc[n+]([O-])cc21 Amb28437152 [0,1,0,0,0,0|3,0,0]=4 841 B12R2.132 O=C1NNc2ccc(Br)cc21 Amb22008691 [0,1,0,0,0,0|2,0,0]=3 842 B12R2.132 O=C1NNc2ccc(Cl)cc21 Amb20460273 [0,1,0,0,0,0|2,0,0]=3 843 B12R2.132 O=C1NNc2ncc(Br)cc21 Amb19514957 [0,1,0,0,0,0|3,0,0]=4 844 B12R2.132 O=C1NOc2ccc(Br)cc21 Amb21858197 [0,1,0,0,0,0|2,0,0]=3 845 B12R2.132 O=C1NOc2ccc(F)cc21 Amb21857209 [0,1,0,0,0,0|2,0,0]=3 846 B12R2.132 O=C1NOc2ccc(O)cc21 Amb24440443 [0,1,0,0,0,0|2,0,0]=3 847 B12R2.132 O=C1NSc2ccc(Br)cc21 Amb24628235 [0,1,0,0,0,0|2,0,0]=3 848 B12R2.132 O=C1NSc2ccc(Cl)cc21 Amb19131194 [0,1,0,0,0,0|2,0,0]=3 849 B12R2.132 O=C1NSc2ccc(F)cc21 Amb24372116 [0,1,0,0,0,0|2,0,0]=3 850 B12R2.132 O=C1OCc2ccc(Br)cc21 Amb2692670 [0,1,0,0,0,0|0,0,0]=1 851 B12R2.132 O=C1OCc2ccc(Cl)nc21 Amb27764081 [0,1,0,0,0,0|1,0,0]=2 852 B12R2.132 O=C1OCc2ccc(F)cc21 Amb16232663 [0,1,0,0,0,0|0,0,0]=1 853 B12R2.132 O=C1OCc2ccc(I)cc21 Amb2692671 [0,1,0,0,0,0|0,0,0]=1 854 B12R2.132 O=C1OCc2ccc(O)cc21 Amb5718516 [0,1,0,0,0,0|0,0,0]=1 855 B12R2.132 O=C1OCc2ncc(Br)cc21 Amb25291807 [0,1,0,0,0,0|1,0,0]=2 856 B12R2.132 O=C1OCc2ncc(Cl)cc21 Amb22755903 [0,1,0,0,0,0|1,0,0]=2 857 B12R2.132 O=C1ONc2ccc(Br)cc21 Amb28119155 [0,1,0,0,0,0|1,0,0]=2 858 B12R2.132 O=C1ONc2ccc(Cl)cc21 Amb22263320 [0,1,0,0,0,0|1,0,0]=2 859 B12R2.132 O=C1ONc2ccc(F)cc21 Amb26974015 [0,1,0,0,0,0|1,0,0]=2 860 B12R2.132 O=C1SNc2ccc(F)cc21 Amb32673853 [0,1,0,0,0,0|1,1,0]=3 861 B12R2.132 OB1OCc2ccc(Cl)cc21 Amb25330321 [0,1,0,0,0,0|1,0,1]=3 862 B12R2.132 OB1OCc2ccc(F)cc21 Amb22497413 [0,1,0,0,0,0|1,0,1]=3 863 B12R2.132 OB1OCc2ccc(O)cc21 Amb21964578 [0,1,0,0,0,0|1,0,1]=3 864 B12R2.132 OB1OCc2ccc(S)cc21 Amb33715325 [0,1,0,0,0,0|1,0,1]=3 865 B12R2.132 OC1CCc2ccc(Br)cc21 Amb17779324 [0,1,0,0,0,0|1,0,2]=4 866 B12R2.132 OC1CCc2ccc(Cl)cc21 Amb8630738 [0,1,0,0,0,0|1,0,2]=4 867 B12R2.132 OC1CCc2ccc(F)cc21 Amb17087925 [0,1,0,0,0,0|1,0,2]=4 868 B12R2.132 OC1OCc2ccc(Br)cc21 Amb22751581 [0,1,0,0,0,0|0,0,2]=3 869 B12R2.132 O[C@@H]1CCc2ccc(I)cc21 Amb28369043 [0,1,0,0,0,0|1,0,2]=4 870 B12R2.132 Oc1ccc2c(c1)C(S)CC2 Amb32788617 [0,1,0,0,0,0|1,1,1]=4 871 B12R2.132 Oc1ccc2c(c1)[C@H](O)CC2 Amb35615861 [0,1,0,0,0,0|1,0,2]=4 872 B12R2.132 Oc1ccc2occ(Cl)c2c1 Amb27445869 [0,1,0,0,0,0|3,0,0]=4 873 B12R2.132 Oc1ccc2occ(O)c2c1 Amb27974579 [0,1,0,0,0,0|2,0,1]=4 874 B12R2.132 Oc1ccc2onc(I)c2c1 Amb27432705 [0,1,0,0,0,0|3,0,0]=4 875 B12R2.132 Oc1ccc2scc(Br)c2c1 Amb25114462 [0,1,0,0,0,0|3,0,0]=4 876 B12R2.132 Oc1noc2ccc(Cl)cc12 Amb3430957 [0,1,0,0,0,0|2,0,1]=4 877 B12R2.132 Oc1noc2ccc(I)cc12 Amb26022475 [0,1,0,0,0,0|2,0,1]=4 878 B12R2.132 SC1CCc2ccc(Br)cc21 Amb25150782 [0,1,0,0,0,0|1,1,1]=4 879 B12R2.132 Sc1csc2ccc(Br)cc12 Amb27795186 [0,1,0,0,0,0|2,1,0]=4 880 B12R2.132 Sc1noc2ccc(Br)cc12 Amb22047670 [0,1,0,0,0,0|2,1,0]=4 881 B12R2.132 [O-][n+]1onc2ccc(Br)cc21 Amb624729 [0,1,0,0,0,0|2,0,1]=4 882 B12R2.132 [O-][n+]1onc2ccc(Cl)cc21 Amb627791 [0,1,0,0,0,0|2,0,1]=4 883 B12R2.196 Brc1csc2c(Br)cccc12 Amb28052826 [0,1,0,0,0,0|3,0,0]=4 884 B12R2.196 CC1=CCc2c(F)cccc21 Amb25114614 [0,1,0,0,0,0|2,0,0]=3 885 B12R2.196 CC1NCc2c(Cl)cccc21 Amb27780174 [0,1,0,0,0,0|2,0,1]=4 886 B12R2.196 CC1NCc2c(N)cccc21 Amb27764050 [0,1,0,0,0,0|2,0,1]=4 887 B12R2.196 CN1CCc2c(N)cccc21 Amb18669647 [0,1,0,0,0,0|3,0,0]=4 888 B12R2.196 CN1CCc2c(O)cccc21 Amb17593716 [0,1,0,0,0,0|3,0,0]=4 889 B12R2.196 C[C@@H]1NCc2c(F)cccc21 Amb27823682 [0,1,0,0,0,0|2,0,1]=4 890 B12R2.196 C[C@@H]1NCc2c(I)cccc21 Amb27237017 [0,1,0,0,0,0|2,0,1]=4 891 B12R2.196 C[C@H]1NCc2c(Br)cccc21 Amb28284902 [0,1,0,0,0,0|2,0,1]=4 892 B12R2.196 Cc1cccc2c(Br)coc12 Amb27868647 [0,1,0,0,0,0|3,0,0]=4 893 B12R2.196 Cc1cccc2c(Br)csc12 Amb26965893 [0,1,0,0,0,0|3,0,0]=4 894 B12R2.196 Cc1cccc2c(Cl)nsc12 Amb28368750 [0,1,0,0,0,0|3,0,0]=4 895 B12R2.196 Cc1cccc2c(N)csc12 Amb23402529 [0,1,0,0,0,0|3,0,0]=4 896 B12R2.196 Cc1cccc2c(N)noc12 Amb23402947 [0,1,0,0,0,0|3,0,0]=4 897 B12R2.196 Cc1cccc2c(N)onc12 Amb27223997 [0,1,0,0,0,0|2,0,0]=3 898 B12R2.196 Cc1cccc2c(O)noc12 Amb2725209 [0,1,0,0,0,0|2,0,1]=4 899 B12R2.196 Cc1cccc2c1CCC2=O Amb4605923 [0,1,0,0,0,0|1,0,0]=2 900 B12R2.196 Cc1cccc2c1CCC2Cl Amb17087981 [0,1,0,0,0,0|2,0,1]=4 901 B12R2.196 Cc1cccc2c1CCC2F Amb28208696 [0,1,0,0,0,0|2,0,1]=4 902 B12R2.196 Cc1cccc2c1CCC2N Amb19514831 [0,1,0,0,0,0|2,0,1]=4 903 B12R2.196 Cc1cccc2c1CCC2N Amb9735877 [0,1,0,0,0,0|2,0,1]=4 904 B12R2.196 Cc1cccc2c1CCC2O Amb17087931 [0,1,0,0,0,0|1,0,2]=4 905 B12R2.196 Cc1cccc2c1CCN2C Amb28365675 [0,1,0,0,0,0|3,0,0]=4 906 B12R2.196 Cc1cccc2c1CC[C@@H]2N Amb31289668 [0,1,0,0,0,0|2,0,1]=4 907 B12R2.196 Cc1cccc2c1CC[C@H]2N Amb26934915 [0,1,0,0,0,0|2,0,1]=4 908 B12R2.196 Cc1cccc2c1CNC2=O Amb22229850 [0,1,0,0,0,0|1,0,0]=2 909 B12R2.196 Cc1cccc2c1CNC2C Amb27663354 [0,1,0,0,0,0|2,0,1]=4 910 B12R2.196 Cc1cccc2c1CN[C@@H]2C Amb27858274 [0,1,0,0,0,0|2,0,1]=4 911 B12R2.196 Cc1cccc2c1COB2O Amb24591278 [0,1,0,0,0,0|1,0,1]=3 912 B12R2.196 Cc1cccc2c1COC2=O Amb16231379 [0,1,0,0,0,0|0,0,0]=1 913 B12R2.196 Cc1cccc2c1NCC2=O Amb18831418 [0,1,0,0,0,0|2,0,0]=3 914 B12R2.196 Cc1cccc2c1NSC2=O Amb32673862 [0,1,0,0,0,0|1,1,0]=3 915 B12R2.196 Cc1cccc2c1OCC2=O Amb33534388 [0,1,0,0,0,0|2,0,0]=3 916 B12R2.196 Cc1cccc2c1ONC2=O Amb21857149 [0,1,0,0,0,0|2,0,0]=3 917 B12R2.196 Cc1cccc2c1SCC2=O Amb18199753 [0,1,0,0,0,0|2,0,0]=3 918 B12R2.196 Cc1cccc2c1SNC2=O Amb27966170 [0,1,0,0,0,0|2,0,0]=3 919 B12R2.196 Cc1cccc2c1no[n+]2[O-] Amb10552729 [0,1,0,0,0,0|2,0,1]=4 920 B12R2.196 Cc1ccnc2c1CNC2=O Amb35749501 [0,1,0,0,0,0|2,0,0]=3 921 B12R2.196 Cc1coc2c(Br)cccc12 Amb28245157 [0,1,0,0,0,0|3,0,0]=4 922 B12R2.196 Cc1coc2c(I)cccc12 Amb27823712 [0,1,0,0,0,0|3,0,0]=4 923 B12R2.196 Cc1coc2c(O)cccc12 Amb27948727 [0,1,0,0,0,0|3,0,0]=4 924 B12R2.196 Cc1csc2c(Br)cccc12 Amb22500032 [0,1,0,0,0,0|3,0,0]=4 925 B12R2.196 Cc1csc2c(N)cccc12 Amb18645930 [0,1,0,0,0,0|3,0,0]=4 926 B12R2.196 Cc1csc2c(O)cccc12 Amb24097251 [0,1,0,0,0,0|3,0,0]=4 927 B12R2.196 Cc1nccc2c1OCC2=O Amb27228818 [0,1,0,0,0,0|3,0,0]=4 928 B12R2.196 Cc1noc2c(Br)cccc12 Amb26373010 [0,1,0,0,0,0|3,0,0]=4 929 B12R2.196 Cc1noc2c(C)cccc12 Amb27618942 [0,1,0,0,0,0|3,0,0]=4 930 B12R2.196 Cc1noc2c(Cl)cccc12 Amb26421958 [0,1,0,0,0,0|3,0,0]=4 931 B12R2.196 Cc1nsc2c(Br)cccc12 Amb24432090 [0,1,0,0,0,0|3,0,0]=4 932 B12R2.196 Cc1nsc2c(C)cccc12 Amb24549331 [0,1,0,0,0,0|3,0,0]=4 933 B12R2.196 ClC1CCc2c(Br)cccc21 Amb22059235 [0,1,0,0,0,0|2,0,1]=4 934 B12R2.196 Clc1cccc2c(Br)noc12 Amb26887681 [0,1,0,0,0,0|3,0,0]=4 935 B12R2.196 Clc1cccc2c1CCC2Cl Amb17087984 [0,1,0,0,0,0|2,0,1]=4 936 B12R2.196 Clc1coc2c(Br)cccc12 Amb18745466 [0,1,0,0,0,0|3,0,0]=4 937 B12R2.196 Clc1noc2c(Br)cccc12 Amb22233561 [0,1,0,0,0,0|3,0,0]=4 938 B12R2.196 Clc1nsc2c(Br)cccc12 Amb32710062 [0,1,0,0,0,0|3,0,0]=4 939 B12R2.196 Clc1nsc2c(Cl)cccc12 Amb24517140 [0,1,0,0,0,0|3,0,0]=4 940 B12R2.196 FC1CCc2c(Br)cccc21 Amb27816681 [0,1,0,0,0,0|2,0,1]=4 941 B12R2.196 FC1CCc2c(Cl)cccc21 Amb27794950 [0,1,0,0,0,0|2,0,1]=4 942 B12R2.196 Fc1cccc2c(Br)coc12 Amb28364458 [0,1,0,0,0,0|3,0,0]=4 943 B12R2.196 Fc1cccc2c(Br)csc12 Amb25973316 [0,1,0,0,0,0|3,0,0]=4 944 B12R2.196 Fc1cccc2c(Br)noc12 Amb25147906 [0,1,0,0,0,0|3,0,0]=4 945 B12R2.196 Fc1cccc2c(Cl)nsc12 Amb32710043 [0,1,0,0,0,0|3,0,0]=4 946 B12R2.196 Fc1cccc2c1CCC2Br Amb20623563 [0,1,0,0,0,0|2,0,1]=4 947 B12R2.196 Fc1cccc2c1CCC2Cl Amb33538441 [0,1,0,0,0,0|2,0,1]=4 948 B12R2.196 Fc1cccc2c1CCC2S Amb27643018 [0,1,0,0,0,0|1,1,1]=4 949 B12R2.196 NC1=CC=CN2C(=O)NN=C12 Amb27840264 [0,1,0,0,0,0|3,0,0]=4 950 B12R2.196 NC1CCc2c(Br)cccc21 Amb19342600 [0,1,0,0,0,0|2,0,1]=4 951 B12R2.196 NC1CCc2c(Br)cccc21 Amb6683470 [0,1,0,0,0,0|2,0,1]=4 952 B12R2.196 NC1CCc2c(Cl)cccc21 Amb10609924 [0,1,0,0,0,0|2,0,1]=4 953 B12R2.196 NC1CCc2c(Cl)cccc21 Amb2383228 [0,1,0,0,0,0|2,0,1]=4 954 B12R2.196 NC1CCc2c(F)cccc21 Amb10609944 [0,1,0,0,0,0|2,0,1]=4 955 B12R2.196 NC1CCc2c(F)cccc21 Amb9735878 [0,1,0,0,0,0|2,0,1]=4 956 B12R2.196 NC1CCc2c(O)cccc21 Amb32661676 [0,1,0,0,0,0|2,0,1]=4 957 B12R2.196 NC1CCc2c(O)cccc21 Amb9725461 [0,1,0,0,0,0|2,0,1]=4 958 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb22288665 [0,1,0,0,0,0|2,0,1]=4 959 B12R2.196 N[C@@H]1CCc2c(Br)cccc21 Amb27230466 [0,1,0,0,0,0|2,0,1]=4 960 B12R2.196 N[C@@H]1CCc2c(Cl)cccc21 Amb13953028 [0,1,0,0,0,0|2,0,1]=4 961 B12R2.196 N[C@@H]1CCc2c(Cl)cccc21 Amb31289675 [0,1,0,0,0,0|2,0,1]=4 962 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22288666 [0,1,0,0,0,0|2,0,1]=4 963 B12R2.196 N[C@@H]1CCc2c(F)cccc21 Amb22746050 [0,1,0,0,0,0|2,0,1]=4 964 B12R2.196 N[C@@H]1CCc2c(O)cccc21 Amb2699155 [0,1,0,0,0,0|2,0,1]=4 965 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb22288709 [0,1,0,0,0,0|2,0,1]=4 966 B12R2.196 N[C@H]1CCc2c(Br)cccc21 Amb27794553 [0,1,0,0,0,0|2,0,1]=4 967 B12R2.196 N[C@H]1CCc2c(Cl)cccc21 Amb13953027 [0,1,0,0,0,0|2,0,1]=4 968 B12R2.196 N[C@H]1CCc2c(Cl)cccc21 Amb33457339 [0,1,0,0,0,0|2,0,1]=4 969 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb16233799 [0,1,0,0,0,0|2,0,1]=4 970 B12R2.196 N[C@H]1CCc2c(F)cccc21 Amb22388651 [0,1,0,0,0,0|2,0,1]=4 971 B12R2.196 N[C@H]1CCc2c(I)cccc21 Amb27945476 [0,1,0,0,0,0|2,0,1]=4 972 B12R2.196 N[C@H]1CCc2c(O)cccc21 Amb2699154 [0,1,0,0,0,0|2,0,1]=4 973 B12R2.196 N[C@H]1CCc2c(S)cccc21 Amb27461350 [0,1,0,0,0,0|2,0,1]=4 974 B12R2.196 Nc1cccc2c(=O)nnc12 Amb24082852 [0,1,0,0,0,0|2,0,0]=3 975 B12R2.196 Nc1cccc2c(Br)coc12 Amb17571389 [0,1,0,0,0,0|3,0,0]=4 976 B12R2.196 Nc1cccc2c(Br)csc12 Amb25893328 [0,1,0,0,0,0|3,0,0]=4 977 B12R2.196 Nc1cccc2c(Cl)noc12 Amb27224270 [0,1,0,0,0,0|3,0,0]=4 978 B12R2.196 Nc1cccc2c1C=NC2=O Amb28456561 [0,1,0,0,0,0|1,0,1]=3 979 B12R2.196 Nc1cccc2c1CCC2=O Amb10067615 [0,1,0,0,0,0|1,0,0]=2 980 B12R2.196 Nc1cccc2c1CC[C@@H]2N Amb28145068 [0,1,0,0,0,0|2,0,1]=4 981 B12R2.196 Nc1cccc2c1CNC2=O Amb9677786 [0,1,0,0,0,0|1,0,0]=2 982 B12R2.196 Nc1cccc2c1COB2O Amb27176247 [0,1,0,0,0,0|1,0,1]=3 983 B12R2.196 Nc1cccc2c1COC2=O Amb5718521 [0,1,0,0,0,0|0,0,0]=1 984 B12R2.196 Nc1cccc2c1CSC2=O Amb28055839 [0,1,0,0,0,0|0,1,0]=2 985 B12R2.196 Nc1cccc2c1OCC2=O Amb18202194 [0,1,0,0,0,0|2,0,0]=3 986 B12R2.196 Nc1cccc2c1SCC2=O Amb18199701 [0,1,0,0,0,0|2,0,0]=3 987 B12R2.196 Nc1cccc2c1no[n+]2[O-] Amb17740139 [0,1,0,0,0,0|2,0,1]=4 988 B12R2.196 Nc1csc2c(Br)cccc12 Amb23402524 [0,1,0,0,0,0|3,0,0]=4 989 B12R2.196 Nc1csc2c(Cl)cccc12 Amb23403636 [0,1,0,0,0,0|3,0,0]=4 990 B12R2.196 Nc1csc2c(F)cccc12 Amb23402525 [0,1,0,0,0,0|3,0,0]=4 991 B12R2.196 Nc1csc2c(N)cccc12 Amb32708791 [0,1,0,0,0,0|3,0,0]=4 992 B12R2.196 Nc1nccc2c1CNC2=O Amb18831351 [0,1,0,0,0,0|2,0,0]=3 993 B12R2.196 Nc1noc2c(Br)cccc12 Amb22495985 [0,1,0,0,0,0|3,0,0]=4 994 B12R2.196 Nc1noc2c(F)cccc12 Amb22057523 [0,1,0,0,0,0|3,0,0]=4 995 B12R2.196 Nc1noc2c(I)cccc12 Amb23402958 [0,1,0,0,0,0|3,0,0]=4 996 B12R2.196 Nc1noc2c(O)cccc12 Amb23402969 [0,1,0,0,0,0|3,0,0]=4 997 B12R2.196 Nc1nsc2c(Cl)cccc12 Amb24366043 [0,1,0,0,0,0|3,0,0]=4 998 B12R2.196 Nc1nsc2c(F)cccc12 Amb26507952 [0,1,0,0,0,0|3,0,0]=4 999 B12R2.196 O=C1C=CCN2C(=O)OC[C@@H]12 Amb27184128 [0,1,0,0,0,0|1,0,2]=4 1000 B12R2.196 O=C1C=CCN2C(=O)OC[C@H]12 Amb27858374 [0,1,0,0,0,0|1,0,2]=4 1001 B12R2.196 O=C1CCN2C(=O)C=CC=C12 Amb28322040 [0,1,0,0,0,0|2,0,0]=3 1002 B12R2.196 O=C1CCOC2=C1COC2=O Amb17593840 [0,1,0,0,0,0|1,0,2]=4 1003 B12R2.196 O=C1CCc2c(Br)cccc21 Amb6683468 [0,1,0,0,0,0|1,0,0]=2 1004 B12R2.196 O=C1CCc2c(Br)cncc21 Amb27968458 [0,1,0,0,0,0|2,0,0]=3 1005 B12R2.196 O=C1CCc2c(Cl)cccc21 Amb2383535 [0,1,0,0,0,0|1,0,0]=2 1006 B12R2.196 O=C1CCc2c(Cl)ccnc21 Amb28399347 [0,1,0,0,0,0|2,0,0]=3 1007 B12R2.196 O=C1CCc2c(F)cccc21 Amb2383536 [0,1,0,0,0,0|1,0,0]=2 1008 B12R2.196 O=C1CCc2c(O)cccc21 Amb1158068 [0,1,0,0,0,0|1,0,0]=2 1009 B12R2.196 O=C1CN=C2C(Cl)=CC=CN12 Amb29850759 [0,1,0,0,0,0|3,0,0]=4 1010 B12R2.196 O=C1CNc2c(F)cccc21 Amb18201774 [0,1,0,0,0,0|2,0,0]=3 1011 B12R2.196 O=C1COc2c(Br)cccc21 Amb33534390 [0,1,0,0,0,0|2,0,0]=3 1012 B12R2.196 O=C1COc2c(Cl)cccc21 Amb33534389 [0,1,0,0,0,0|2,0,0]=3 1013 B12R2.196 O=C1COc2c(F)cccc21 Amb2383546 [0,1,0,0,0,0|2,0,0]=3 1014 B12R2.196 O=C1COc2c(O)cccc21 Amb22490978 [0,1,0,0,0,0|2,0,0]=3 1015 B12R2.196 O=C1CSc2c(Br)cccc21 Amb18159421 [0,1,0,0,0,0|2,0,0]=3 1016 B12R2.196 O=C1CSc2c(Cl)cccc21 Amb18822582 [0,1,0,0,0,0|2,0,0]=3 1017 B12R2.196 O=C1CSc2c(F)cccc21 Amb23597480 [0,1,0,0,0,0|2,0,0]=3 1018 B12R2.196 O=C1NCc2c(Br)cccc21 Amb15693064 [0,1,0,0,0,0|1,0,0]=2 1019 B12R2.196 O=C1NCc2c(Br)ccnc21 Amb28344622 [0,1,0,0,0,0|2,0,0]=3 1020 B12R2.196 O=C1NCc2c(Br)cncc21 Amb25961944 [0,1,0,0,0,0|2,0,0]=3 1021 B12R2.196 O=C1NCc2c(Cl)cccc21 Amb21858351 [0,1,0,0,0,0|1,0,0]=2 1022 B12R2.196 O=C1NCc2c(Cl)ccnc21 Amb28400699 [0,1,0,0,0,0|2,0,0]=3 1023 B12R2.196 O=C1NCc2c(F)cccc21 Amb22008629 [0,1,0,0,0,0|1,0,0]=2 1024 B12R2.196 O=C1NCc2c(O)cccc21 Amb21858279 [0,1,0,0,0,0|1,0,0]=2 1025 B12R2.196 O=C1NCc2c1ccnc2Cl Amb27476367 [0,1,0,0,0,0|2,0,0]=3 1026 B12R2.196 O=C1NNc2c(Br)cccc21 Amb22170435 [0,1,0,0,0,0|2,0,0]=3 1027 B12R2.196 O=C1NNc2c(F)cccc21 Amb22738649 [0,1,0,0,0,0|2,0,0]=3 1028 B12R2.196 O=C1NOc2c(Cl)cccc21 Amb22489850 [0,1,0,0,0,0|2,0,0]=3 1029 B12R2.196 O=C1NOc2c(F)cccc21 Amb21857207 [0,1,0,0,0,0|2,0,0]=3 1030 B12R2.196 O=C1NOc2c(I)cccc21 Amb27813751 [0,1,0,0,0,0|2,0,0]=3 1031 B12R2.196 O=C1NSc2c(Br)cccc21 Amb32710021 [0,1,0,0,0,0|2,0,0]=3 1032 B12R2.196 O=C1NSc2c(Cl)cccc21 Amb26570552 [0,1,0,0,0,0|2,0,0]=3 1033 B12R2.196 O=C1NSc2c(F)cccc21 Amb27670276 [0,1,0,0,0,0|2,0,0]=3 1034 B12R2.196 O=C1NSc2c1ccc[n+]2[O-] Amb27666349 [0,1,0,0,0,0|3,0,0]=4 1035 B12R2.196 O=C1OCc2c(Br)cccc21 Amb6296519 [0,1,0,0,0,0|0,0,0]=1 1036 B12R2.196 O=C1OCc2c(Cl)cccc21 Amb16232645 [0,1,0,0,0,0|0,0,0]=1 1037 B12R2.196 O=C1OCc2c(F)cccc21 Amb22756851 [0,1,0,0,0,0|0,0,0]=1 1038 B12R2.196 O=C1SNc2c(F)cccc21 Amb32673867 [0,1,0,0,0,0|1,1,0]=3 1039 B12R2.196 OB1OCc2c(Br)cccc21 Amb27153180 [0,1,0,0,0,0|1,0,1]=3 1040 B12R2.196 OB1OCc2c(Cl)cccc21 Amb26322413 [0,1,0,0,0,0|1,0,1]=3 1041 B12R2.196 OB1OCc2c(F)cccc21 Amb28200971 [0,1,0,0,0,0|1,0,1]=3 1042 B12R2.196 OB1OCc2c(O)cccc21 Amb25319915 [0,1,0,0,0,0|1,0,1]=3 1043 B12R2.196 OC1CCc2c(Br)cccc21 Amb20171517 [0,1,0,0,0,0|1,0,2]=4 1044 B12R2.196 OC1CCc2c(Cl)cccc21 Amb17087934 [0,1,0,0,0,0|1,0,2]=4 1045 B12R2.196 OC1CCc2c(F)cccc21 Amb17087933 [0,1,0,0,0,0|1,0,2]=4 1046 B12R2.196 O[C@@H]1CCc2c(Br)cccc21 Amb22756414 [0,1,0,0,0,0|1,0,2]=4 1047 B12R2.196 O[C@@H]1CCc2c(Cl)cccc21 Amb13953026 [0,1,0,0,0,0|1,0,2]=4 1048 B12R2.196 O[C@@H]1CCc2c(F)cccc21 Amb24432762 [0,1,0,0,0,0|1,0,2]=4 1049 B12R2.196 O[C@H]1CCc2c(Br)cccc21 Amb27596691 [0,1,0,0,0,0|1,0,2]=4 1050 B12R2.196 O[C@H]1CCc2c(Cl)cccc21 Amb13953025 [0,1,0,0,0,0|1,0,2]=4 1051 B12R2.196 O[C@H]1CCc2c(F)cccc21 Amb27664626 [0,1,0,0,0,0|1,0,2]=4 1052 B12R2.196 Oc1cccc2c(Cl)coc12 Amb28368780 [0,1,0,0,0,0|3,0,0]=4 1053 B12R2.196 Oc1cccc2c1CCC2S Amb32788536 [0,1,0,0,0,0|1,1,1]=4 1054 B12R2.196 Oc1cccc2c1CCN2O Amb27971133 [0,1,0,0,0,0|2,0,1]=4 1055 B12R2.196 SC1CCc2c(Br)cccc21 Amb24352616 [0,1,0,0,0,0|1,1,1]=4 1056 B12R2.196 Sc1csc2c(Br)cccc12 Amb27174387 [0,1,0,0,0,0|2,1,0]=4 1057 B12R2.196 Sc1csc2c(Cl)cccc12 Amb27847193 [0,1,0,0,0,0|2,1,0]=4 1058 B12R2.203 Brc1cccc2occ(Br)c12 Amb27953022 [0,1,0,0,0,0|3,0,0]=4 1059 B12R2.203 Brc1cccc2onc(Br)c12 Amb28423953 [0,1,0,0,0,0|3,0,0]=4 1060 B12R2.203 Brc1cccc2scc(Br)c12 Amb28287812 [0,1,0,0,0,0|3,0,0]=4 1061 B12R2.203 Brc1cccc2scc(I)c12 Amb28255791 [0,1,0,0,0,0|3,0,0]=4 1062 B12R2.203 CC1=CCc2cccc(C)c21 Amb27951780 [0,1,0,0,0,0|2,0,0]=3 1063 B12R2.203 CC1NCc2cccc(F)c21 Amb27960934 [0,1,0,0,0,0|2,0,1]=4 1064 B12R2.203 CC1NCc2cccc(I)c21 Amb27447843 [0,1,0,0,0,0|2,0,1]=4 1065 B12R2.203 CC1OCc2ccnc(Cl)c21 Amb27593859 [0,1,0,0,0,0|2,0,1]=4 1066 B12R2.203 CN1CCc2cccc(Br)c21 Amb18770838 [0,1,0,0,0,0|3,0,0]=4 1067 B12R2.203 CN1CCc2cccc(Cl)c21 Amb27946984 [0,1,0,0,0,0|3,0,0]=4 1068 B12R2.203 CN1CCc2cccc(N)c21 Amb18202211 [0,1,0,0,0,0|3,0,0]=4 1069 B12R2.203 C[C@@H]1NCc2cccc(Br)c21 Amb27248669 [0,1,0,0,0,0|2,0,1]=4 1070 B12R2.203 C[C@@H]1NCc2cccc(O)c21 Amb27264570 [0,1,0,0,0,0|2,0,1]=4 1071 B12R2.203 Cc1cccc2c1B(O)OC2 Amb25726432 [0,1,0,0,0,0|1,0,1]=3 1072 B12R2.203 Cc1cccc2c1C(=N)NN2 Amb24413143 [0,1,0,0,0,0|3,0,0]=4 1073 B12R2.203 Cc1cccc2c1C(=O)CC2 Amb16232631 [0,1,0,0,0,0|1,0,0]=2 1074 B12R2.203 Cc1cccc2c1C(=O)CO2 Amb18202264 [0,1,0,0,0,0|2,0,0]=3 1075 B12R2.203 Cc1cccc2c1C(=O)CS2 Amb18199755 [0,1,0,0,0,0|2,0,0]=3 1076 B12R2.203 Cc1cccc2c1C(=O)NC2 Amb22230158 [0,1,0,0,0,0|1,0,0]=2 1077 B12R2.203 Cc1cccc2c1C(=O)OC2 Amb2608975 [0,1,0,0,0,0|0,0,0]=1 1078 B12R2.203 Cc1cccc2c1C(=O)SN2 Amb32673870 [0,1,0,0,0,0|1,1,0]=3 1079 B12R2.203 Cc1cccc2c1C(N)CC2 Amb26554001 [0,1,0,0,0,0|2,0,1]=4 1080 B12R2.203 Cc1cccc2c1C(O)CC2 Amb22886909 [0,1,0,0,0,0|1,0,2]=4 1081 B12R2.203 Cc1cccc2c1N(N)CC2 Amb27966297 [0,1,0,0,0,0|3,0,0]=4 1082 B12R2.203 Cc1cccc2c1[C@H](N)CC2 Amb24398373 [0,1,0,0,0,0|2,0,1]=4 1083 B12R2.203 Cc1cccc2no[n+]([O-])c12 Amb23402229 [0,1,0,0,0,0|2,0,1]=4 1084 B12R2.203 Cc1cccc2noc(N)c12 Amb28436541 [0,1,0,0,0,0|2,0,0]=3 1085 B12R2.203 Cc1cccc2occ(Br)c12 Amb18176125 [0,1,0,0,0,0|3,0,0]=4 1086 B12R2.203 Cc1cccc2onc(N)c12 Amb21857265 [0,1,0,0,0,0|3,0,0]=4 1087 B12R2.203 Cc1cccc2onc(O)c12 Amb21857266 [0,1,0,0,0,0|2,0,1]=4 1088 B12R2.203 Cc1cccc2scc(Br)c12 Amb28368810 [0,1,0,0,0,0|3,0,0]=4 1089 B12R2.203 Cc1cccc2scc(Cl)c12 Amb22498045 [0,1,0,0,0,0|3,0,0]=4 1090 B12R2.203 Cc1cccc2scc(N)c12 Amb23402526 [0,1,0,0,0,0|3,0,0]=4 1091 B12R2.203 Cc1cccc2snc(Br)c12 Amb24334877 [0,1,0,0,0,0|3,0,0]=4 1092 B12R2.203 Cc1ccnc2c1C(=O)NN2 Amb22494155 [0,1,0,0,0,0|3,0,0]=4 1093 B12R2.203 Cc1coc2cccc(Br)c12 Amb18773208 [0,1,0,0,0,0|3,0,0]=4 1094 B12R2.203 Cc1coc2cccc(N)c12 Amb18202307 [0,1,0,0,0,0|3,0,0]=4 1095 B12R2.203 Cc1csc2cccc(Br)c12 Amb28128399 [0,1,0,0,0,0|3,0,0]=4 1096 B12R2.203 Cc1csc2cccc(Cl)c12 Amb27273547 [0,1,0,0,0,0|3,0,0]=4 1097 B12R2.203 Cc1csc2cccc(O)c12 Amb18126406 [0,1,0,0,0,0|3,0,0]=4 1098 B12R2.203 Cc1ncnc2c1C(=O)CC2 Amb18202260 [0,1,0,0,0,0|3,0,0]=4 1099 B12R2.203 Cc1noc2cccc(Br)c12 Amb18772114 [0,1,0,0,0,0|3,0,0]=4 1100 B12R2.203 Cc1noc2cccc(O)c12 Amb18124945 [0,1,0,0,0,0|3,0,0]=4 1101 B12R2.203 Cc1nsc2cccc(Br)c12 Amb18747251 [0,1,0,0,0,0|3,0,0]=4 1102 B12R2.203 Cc1nsc2cccc(O)c12 Amb27861019 [0,1,0,0,0,0|3,0,0]=4 1103 B12R2.203 Cc1onc2c1C(=O)NC=C2 Amb26866332 [0,1,0,0,0,0|3,0,0]=4 1104 B12R2.203 Cc1onc2ccnc(Cl)c12 Amb27172514 [0,1,0,0,0,0|3,0,0]=4 1105 B12R2.203 Clc1cccc2occ(Br)c12 Amb18745540 [0,1,0,0,0,0|3,0,0]=4 1106 B12R2.203 Clc1cccc2onc(Br)c12 Amb26420905 [0,1,0,0,0,0|3,0,0]=4 1107 B12R2.203 Clc1cccc2onc(Cl)c12 Amb22276075 [0,1,0,0,0,0|3,0,0]=4 1108 B12R2.203 Clc1cccc2snc(Cl)c12 Amb22468735 [0,1,0,0,0,0|3,0,0]=4 1109 B12R2.203 Clc1coc2cccc(Br)c12 Amb18745475 [0,1,0,0,0,0|3,0,0]=4 1110 B12R2.203 Clc1noc2cccc(Br)c12 Amb22496080 [0,1,0,0,0,0|3,0,0]=4 1111 B12R2.203 Clc1nsc2cccc(Br)c12 Amb32710058 [0,1,0,0,0,0|3,0,0]=4 1112 B12R2.203 FC1CCc2cccc(Br)c21 Amb27816661 [0,1,0,0,0,0|2,0,1]=4 1113 B12R2.203 Fc1cccc2onc(Cl)c12 Amb21857206 [0,1,0,0,0,0|3,0,0]=4 1114 B12R2.203 Fc1cccc2scc(Br)c12 Amb24679290 [0,1,0,0,0,0|3,0,0]=4 1115 B12R2.203 Fc1cccc2snc(Cl)c12 Amb32710041 [0,1,0,0,0,0|3,0,0]=4 1116 B12R2.203 NC1CCc2cccc(Br)c21 Amb24667972 [0,1,0,0,0,0|2,0,1]=4 1117 B12R2.203 NC1CCc2cccc(Br)c21 Amb30869304 [0,1,0,0,0,0|2,0,1]=4 1118 B12R2.203 NC1CCc2cccc(Cl)c21 Amb26980827 [0,1,0,0,0,0|2,0,1]=4 1119 B12R2.203 NC1CCc2cccc(F)c21 Amb25279315 [0,1,0,0,0,0|2,0,1]=4 1120 B12R2.203 NC1CCc2cccc(I)c21 Amb27167666 [0,1,0,0,0,0|2,0,1]=4 1121 B12R2.203 NC1CCc2cccc(O)c21 Amb25800015 [0,1,0,0,0,0|2,0,1]=4 1122 B12R2.203 N[C@@H]1CCc2cccc(Br)c21 Amb27945487 [0,1,0,0,0,0|2,0,1]=4 1123 B12R2.203 N[C@@H]1CCc2cccc(F)c21 Amb26872264 [0,1,0,0,0,0|2,0,1]=4 1124 B12R2.203 N[C@@H]1CCc2cccc(O)c21 Amb24700449 [0,1,0,0,0,0|2,0,1]=4 1125 B12R2.203 N[C@H]1CCc2cccc(F)c21 Amb25861404 [0,1,0,0,0,0|2,0,1]=4 1126 B12R2.203 N[C@H]1CCc2cccc(F)c21 Amb33872248 [0,1,0,0,0,0|2,0,1]=4 1127 B12R2.203 N[C@H]1CCc2cccc(O)c21 Amb25068419 [0,1,0,0,0,0|2,0,1]=4 1128 B12R2.203 Nc1cccc2c1B(O)OC2 Amb26326569 [0,1,0,0,0,0|1,0,1]=3 1129 B12R2.203 Nc1cccc2c1C(=O)CC2 Amb10603890 [0,1,0,0,0,0|1,0,0]=2 1130 B12R2.203 Nc1cccc2c1C(=O)CO2 Amb27969163 [0,1,0,0,0,0|2,0,0]=3 1131 B12R2.203 Nc1cccc2c1C(=O)NC2 Amb2372743 [0,1,0,0,0,0|1,0,0]=2 1132 B12R2.203 Nc1cccc2c1C(=O)OC2 Amb16232974 [0,1,0,0,0,0|0,0,0]=1 1133 B12R2.203 Nc1cccc2c1C(F)CC2 Amb27229221 [0,1,0,0,0,0|2,0,1]=4 1134 B12R2.203 Nc1cccc2c1C(O)CC2 Amb28364281 [0,1,0,0,0,0|1,0,2]=4 1135 B12R2.203 Nc1cccc2onc(Cl)c12 Amb28053226 [0,1,0,0,0,0|3,0,0]=4 1136 B12R2.203 Nc1cccc2onc(N)c12 Amb27796374 [0,1,0,0,0,0|3,0,0]=4 1137 B12R2.203 Nc1cccc2scc(Br)c12 Amb26391250 [0,1,0,0,0,0|3,0,0]=4 1138 B12R2.203 Nc1csc2cccc(Cl)c12 Amb23403646 [0,1,0,0,0,0|3,0,0]=4 1139 B12R2.203 Nc1csc2cccc(F)c12 Amb23403637 [0,1,0,0,0,0|3,0,0]=4 1140 B12R2.203 Nc1csc2cccc(O)c12 Amb28321077 [0,1,0,0,0,0|3,0,0]=4 1141 B12R2.203 Nc1nccc2c1C(=O)NC2 Amb18202155 [0,1,0,0,0,0|2,0,0]=3 1142 B12R2.203 Nc1noc2cccc(Br)c12 Amb10975859 [0,1,0,0,0,0|3,0,0]=4 1143 B12R2.203 Nc1noc2cccc(Cl)c12 Amb8840665 [0,1,0,0,0,0|3,0,0]=4 1144 B12R2.203 Nc1noc2cccc(F)c12 Amb2606144 [0,1,0,0,0,0|3,0,0]=4 1145 B12R2.203 Nc1noc2cccc(I)c12 Amb8630007 [0,1,0,0,0,0|3,0,0]=4 1146 B12R2.203 Nc1noc2cccc(O)c12 Amb23402967 [0,1,0,0,0,0|3,0,0]=4 1147 B12R2.203 Nc1nsc2cccc(Br)c12 Amb27492963 [0,1,0,0,0,0|3,0,0]=4 1148 B12R2.203 Nc1nsc2cccc(Cl)c12 Amb25689849 [0,1,0,0,0,0|3,0,0]=4 1149 B12R2.203 Nc1nsc2cccc(F)c12 Amb24551862 [0,1,0,0,0,0|3,0,0]=4 1150 B12R2.203 Nc1nsc2cccc(I)c12 Amb27866290 [0,1,0,0,0,0|3,0,0]=4 1151 B12R2.203 Nc1onc2cccc(Br)c12 Amb27399642 [0,1,0,0,0,0|2,0,0]=3 1152 B12R2.203 O=C1C=Cc2cccc(O)c21 Amb25232216 [0,1,0,0,0,0|1,0,1]=3 1153 B12R2.203 O=C1CCc2cccc(Br)c21 Amb16232616 [0,1,0,0,0,0|1,0,0]=2 1154 B12R2.203 O=C1CCc2cccc(Cl)c21 Amb6296539 [0,1,0,0,0,0|1,0,0]=2 1155 B12R2.203 O=C1CCc2cccc(F)c21 Amb10603926 [0,1,0,0,0,0|1,0,0]=2 1156 B12R2.203 O=C1CCc2cccc(O)c21 Amb6296368 [0,1,0,0,0,0|1,0,0]=2 1157 B12R2.203 O=C1CCc2cccc(S)c21 Amb27949135 [0,1,0,0,0,0|1,0,0]=2 1158 B12R2.203 O=C1CCc2ccnc(Cl)c21 Amb27465299 [0,1,0,0,0,0|2,0,0]=3 1159 B12R2.203 O=C1CCc2cncc(Br)c21 Amb28284910 [0,1,0,0,0,0|2,0,0]=3 1160 B12R2.203 O=C1CCc2nccc(F)c21 Amb28079333 [0,1,0,0,0,0|2,0,0]=3 1161 B12R2.203 O=C1COc2cccc(Br)c21 Amb16233082 [0,1,0,0,0,0|2,0,0]=3 1162 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,0,0,0|2,0,0]=3 1163 B12R2.203 O=C1COc2cccc(F)c21 Amb10840768 [0,1,0,0,0,0|2,0,0]=3 1164 B12R2.203 O=C1COc2cccc(O)c21 Amb18125055 [0,1,0,0,0,0|2,0,0]=3 1165 B12R2.203 O=C1COc2cncc(Cl)c21 Amb28059960 [0,1,0,0,0,0|3,0,0]=4 1166 B12R2.203 O=C1CSc2cccc(Cl)c21 Amb18822610 [0,1,0,0,0,0|2,0,0]=3 1167 B12R2.203 O=C1CSc2cccc(I)c21 Amb27239169 [0,1,0,0,0,0|2,0,0]=3 1168 B12R2.203 O=C1CSc2cccc(O)c21 Amb28436434 [0,1,0,0,0,0|2,0,0]=3 1169 B12R2.203 O=C1N=Cc2cccc(Cl)c21 Amb22015253 [0,1,0,0,0,0|1,0,1]=3 1170 B12R2.203 O=C1N=Cc2cccc(I)c21 Amb22015271 [0,1,0,0,0,0|1,0,1]=3 1171 B12R2.203 O=C1NCc2cccc(Br)c21 Amb21858350 [0,1,0,0,0,0|1,0,0]=2 1172 B12R2.203 O=C1NCc2cccc(Cl)c21 Amb21963125 [0,1,0,0,0,0|1,0,0]=2 1173 B12R2.203 O=C1NCc2cccc(F)c21 Amb23401773 [0,1,0,0,0,0|1,0,0]=2 1174 B12R2.203 O=C1NCc2cccc(I)c21 Amb21963325 [0,1,0,0,0,0|1,0,0]=2 1175 B12R2.203 O=C1NCc2cccc(O)c21 Amb22008617 [0,1,0,0,0,0|1,0,0]=2 1176 B12R2.203 O=C1NCc2ccnc(Cl)c21 Amb18199148 [0,1,0,0,0,0|2,0,0]=3 1177 B12R2.203 O=C1NCc2nccc(Br)c21 Amb28138758 [0,1,0,0,0,0|2,0,0]=3 1178 B12R2.203 O=C1NCc2ncnc(Cl)c21 Amb27654138 [0,1,0,0,0,0|3,0,0]=4 1179 B12R2.203 O=C1NCc2ncnc(O)c21 Amb27200145 [0,1,0,0,0,0|3,0,0]=4 1180 B12R2.203 O=C1NN=C2C=CC=C(Br)N12 Amb26855898 [0,1,0,0,0,0|3,0,0]=4 1181 B12R2.203 O=C1NNc2cccc(Br)c21 Amb22497381 [0,1,0,0,0,0|2,0,0]=3 1182 B12R2.203 O=C1NNc2cccc(Cl)c21 Amb19373186 [0,1,0,0,0,0|2,0,0]=3 1183 B12R2.203 O=C1NOc2cccc(Br)c21 Amb22494926 [0,1,0,0,0,0|2,0,0]=3 1184 B12R2.203 O=C1NOc2cccc(F)c21 Amb21857210 [0,1,0,0,0,0|2,0,0]=3 1185 B12R2.203 O=C1NSc2cccc(Br)c21 Amb32710018 [0,1,0,0,0,0|2,0,0]=3 1186 B12R2.203 O=C1NSc2cccc(Cl)c21 Amb27445101 [0,1,0,0,0,0|2,0,0]=3 1187 B12R2.203 O=C1NSc2cccc(F)c21 Amb24756929 [0,1,0,0,0,0|2,0,0]=3 1188 B12R2.203 O=C1OCc2ccc[n+]([O-])c21 Amb26616903 [0,1,0,0,0,0|1,0,0]=2 1189 B12R2.203 O=C1OCc2cccc(F)c21 Amb4016876 [0,1,0,0,0,0|0,0,0]=1 1190 B12R2.203 O=C1OCc2cccc(I)c21 Amb28124350 [0,1,0,0,0,0|0,0,0]=1 1191 B12R2.203 O=C1OCc2cccc(O)c21 Amb25152698 [0,1,0,0,0,0|0,0,0]=1 1192 B12R2.203 O=C1ONc2cccc(F)c21 Amb27840267 [0,1,0,0,0,0|1,0,0]=2 1193 B12R2.203 OB1OCc2cccc(F)c21 Amb26858878 [0,1,0,0,0,0|1,0,1]=3 1194 B12R2.203 OB1OCc2cccc(O)c21 Amb24396270 [0,1,0,0,0,0|1,0,1]=3 1195 B12R2.203 OC1CCc2cccc(Br)c21 Amb24439435 [0,1,0,0,0,0|1,0,2]=4 1196 B12R2.203 OC1CCc2cccc(Cl)c21 Amb27243919 [0,1,0,0,0,0|1,0,2]=4 1197 B12R2.203 OC1CCc2cccc(F)c21 Amb27953673 [0,1,0,0,0,0|1,0,2]=4 1198 B12R2.203 OC1OCc2cccc(F)c21 Amb27766595 [0,1,0,0,0,0|0,0,2]=3 1199 B12R2.203 Oc1cccc2c1C(S)CC2 Amb32788786 [0,1,0,0,0,0|1,1,1]=4 1200 B12R2.203 Oc1cccc2onc(Cl)c12 Amb18647236 [0,1,0,0,0,0|3,0,0]=4 1201 B12R2.203 Oc1cccc2scc(Br)c12 Amb25051256 [0,1,0,0,0,0|3,0,0]=4 1202 B12R2.203 Oc1cccc2scc(Cl)c12 Amb24606514 [0,1,0,0,0,0|3,0,0]=4 1203 B12R2.612 Brc1ccc2c(Br)csc2c1 Amb27162342 [0,1,0,0,0,0|3,0,0]=4 1204 B12R2.612 C=C1CCc2cc(Br)ccc21 Amb22229945 [0,1,0,0,0,0|2,0,0]=3 1205 B12R2.612 C=C1CCc2cc(Cl)ccc21 Amb24369315 [0,1,0,0,0,0|2,0,0]=3 1206 B12R2.612 C=C1CCc2cc(O)ccc21 Amb26965176 [0,1,0,0,0,0|2,0,0]=3 1207 B12R2.612 CC1=CCc2cc(Br)ccc21 Amb27231603 [0,1,0,0,0,0|2,0,0]=3 1208 B12R2.612 CC1=CCc2cc(Cl)ccc21 Amb27849462 [0,1,0,0,0,0|2,0,0]=3 1209 B12R2.612 CC1NCc2cc(Br)ccc21 Amb19516198 [0,1,0,0,0,0|2,0,1]=4 1210 B12R2.612 CC1NCc2cc(Br)ccc21 Amb20242991 [0,1,0,0,0,0|2,0,1]=4 1211 B12R2.612 CN1CCc2cc(Br)ccc21 Amb6572183 [0,1,0,0,0,0|3,0,0]=4 1212 B12R2.612 CN1CCc2cc(Cl)ccc21 Amb28365676 [0,1,0,0,0,0|3,0,0]=4 1213 B12R2.612 CN1CCc2cc(F)ccc21 Amb27158016 [0,1,0,0,0,0|3,0,0]=4 1214 B12R2.612 CN1CCc2cc(I)ccc21 Amb28410463 [0,1,0,0,0,0|3,0,0]=4 1215 B12R2.612 CN1CCc2cc(N)ccc21 Amb13952548 [0,1,0,0,0,0|3,0,0]=4 1216 B12R2.612 CN1CCc2cc(N)ccc21 Amb6572184 [0,1,0,0,0,0|3,0,0]=4 1217 B12R2.612 CN1CCc2cc(O)ccc21 Amb24606547 [0,1,0,0,0,0|3,0,0]=4 1218 B12R2.612 CN1CCc2cc(O)ccc21 Amb30584782 [0,1,0,0,0,0|3,0,0]=4 1219 B12R2.612 CN1CCc2cc(S)ccc21 Amb33224927 [0,1,0,0,0,0|3,0,0]=4 1220 B12R2.612 CN1NCc2cc(N)ccc21 Amb27804058 [0,1,0,0,0,0|3,0,0]=4 1221 B12R2.612 C[C@@H]1NCc2cc(Br)ccc21 Amb24561131 [0,1,0,0,0,0|2,0,1]=4 1222 B12R2.612 C[C@@H]1NCc2cc(F)ccc21 Amb27405980 [0,1,0,0,0,0|2,0,1]=4 1223 B12R2.612 C[C@H]1NCc2cc(Br)ccc21 Amb20242968 [0,1,0,0,0,0|2,0,1]=4 1224 B12R2.612 Cc1cc2c(cn1)C(=O)CC2 Amb22756135 [0,1,0,0,0,0|2,0,0]=3 1225 B12R2.612 Cc1ccc2c(Br)noc2c1 Amb27623612 [0,1,0,0,0,0|3,0,0]=4 1226 B12R2.612 Cc1ccc2c(C)csc2c1 Amb26552219 [0,1,0,0,0,0|3,0,0]=4 1227 B12R2.612 Cc1ccc2c(C)noc2c1 Amb22802464 [0,1,0,0,0,0|3,0,0]=4 1228 B12R2.612 Cc1ccc2c(C)nsc2c1 Amb27642675 [0,1,0,0,0,0|3,0,0]=4 1229 B12R2.612 Cc1ccc2c(Cl)noc2c1 Amb21857009 [0,1,0,0,0,0|3,0,0]=4 1230 B12R2.612 Cc1ccc2c(Cl)nsc2c1 Amb28135895 [0,1,0,0,0,0|3,0,0]=4 1231 B12R2.612 Cc1ccc2c(N)csc2c1 Amb23402528 [0,1,0,0,0,0|3,0,0]=4 1232 B12R2.612 Cc1ccc2c(N)noc2c1 Amb23437117 [0,1,0,0,0,0|3,0,0]=4 1233 B12R2.612 Cc1ccc2c(N)nsc2c1 Amb27843690 [0,1,0,0,0,0|3,0,0]=4 1234 B12R2.612 Cc1ccc2c(N)onc2c1 Amb27613141 [0,1,0,0,0,0|2,0,0]=3 1235 B12R2.612 Cc1ccc2c(N)onc2n1 Amb17101089 [0,1,0,0,0,0|3,0,0]=4 1236 B12R2.612 Cc1ccc2c(O)noc2c1 Amb22015153 [0,1,0,0,0,0|2,0,1]=4 1237 B12R2.612 Cc1ccc2c(c1)CCC2=O Amb6667023 [0,1,0,0,0,0|1,0,0]=2 1238 B12R2.612 Cc1ccc2c(c1)CCC2Br Amb27841519 [0,1,0,0,0,0|2,0,1]=4 1239 B12R2.612 Cc1ccc2c(c1)CCC2F Amb27958885 [0,1,0,0,0,0|2,0,1]=4 1240 B12R2.612 Cc1ccc2c(c1)CCC2N Amb10609950 [0,1,0,0,0,0|2,0,1]=4 1241 B12R2.612 Cc1ccc2c(c1)CCC2N Amb6667024 [0,1,0,0,0,0|2,0,1]=4 1242 B12R2.612 Cc1ccc2c(c1)CCC2O Amb21964865 [0,1,0,0,0,0|1,0,2]=4 1243 B12R2.612 Cc1ccc2c(c1)CC[C@@H]2O Amb25892517 [0,1,0,0,0,0|1,0,2]=4 1244 B12R2.612 Cc1ccc2c(c1)CC[C@H]2N Amb26346414 [0,1,0,0,0,0|2,0,1]=4 1245 B12R2.612 Cc1ccc2c(c1)CC[C@H]2O Amb27668855 [0,1,0,0,0,0|1,0,2]=4 1246 B12R2.612 Cc1ccc2c(c1)CNC2=O Amb20248676 [0,1,0,0,0,0|1,0,0]=2 1247 B12R2.612 Cc1ccc2c(c1)CN[C@H]2C Amb27219153 [0,1,0,0,0,0|2,0,1]=4 1248 B12R2.612 Cc1ccc2c(c1)COB2O Amb25771094 [0,1,0,0,0,0|1,0,1]=3 1249 B12R2.612 Cc1ccc2c(c1)COC2=O Amb16232630 [0,1,0,0,0,0|0,0,0]=1 1250 B12R2.612 Cc1ccc2c(c1)OCC2=O Amb18202265 [0,1,0,0,0,0|2,0,0]=3 1251 B12R2.612 Cc1ccc2c(c1)SCC2=O Amb18199754 [0,1,0,0,0,0|2,0,0]=3 1252 B12R2.612 Cc1ccc2c(c1)SNC2=O Amb26942754 [0,1,0,0,0,0|2,0,0]=3 1253 B12R2.612 Cc1ccc2c(c1)no[n+]2[O-] Amb2724586 [0,1,0,0,0,0|2,0,1]=4 1254 B12R2.612 Cc1ccc2c(n1)COC2=O Amb27841821 [0,1,0,0,0,0|1,0,0]=2 1255 B12R2.612 Cc1ccc2c(n1)NNC2=O Amb24432148 [0,1,0,0,0,0|3,0,0]=4 1256 B12R2.612 Cc1cnc2c(c1)COC2=O Amb27858354 [0,1,0,0,0,0|1,0,0]=2 1257 B12R2.612 Cc1coc2cc(Br)ccc12 Amb28074278 [0,1,0,0,0,0|3,0,0]=4 1258 B12R2.612 Cc1csc2cc(Br)ccc12 Amb25133721 [0,1,0,0,0,0|3,0,0]=4 1259 B12R2.612 Cc1csc2cc(Cl)ccc12 Amb20620743 [0,1,0,0,0,0|3,0,0]=4 1260 B12R2.612 Cc1csc2cc(F)ccc12 Amb27965848 [0,1,0,0,0,0|3,0,0]=4 1261 B12R2.612 Cc1csc2cc(O)ccc12 Amb28202170 [0,1,0,0,0,0|3,0,0]=4 1262 B12R2.612 Cc1ncc2c(n1)CNC2=O Amb27473259 [0,1,0,0,0,0|3,0,0]=4 1263 B12R2.612 Cc1ncc2c(n1)COC2=O Amb32670706 [0,1,0,0,0,0|2,0,0]=3 1264 B12R2.612 Cc1noc2cc(Br)ccc12 Amb20241143 [0,1,0,0,0,0|3,0,0]=4 1265 B12R2.612 Cc1noc2cc(Cl)ccc12 Amb24611798 [0,1,0,0,0,0|3,0,0]=4 1266 B12R2.612 Cc1noc2cc(N)ccc12 Amb18202255 [0,1,0,0,0,0|3,0,0]=4 1267 B12R2.612 Cc1noc2cc(N)ccc12 Amb32666739 [0,1,0,0,0,0|3,0,0]=4 1268 B12R2.612 Cc1noc2cc(O)ccc12 Amb18124943 [0,1,0,0,0,0|3,0,0]=4 1269 B12R2.612 Cc1nsc2cc(Cl)ccc12 Amb20252165 [0,1,0,0,0,0|3,0,0]=4 1270 B12R2.612 Cc1nsc2cc(F)ccc12 Amb26919037 [0,1,0,0,0,0|3,0,0]=4 1271 B12R2.612 Cc1nsc2cc(O)ccc12 Amb27802547 [0,1,0,0,0,0|3,0,0]=4 1272 B12R2.612 ClC1CCc2cc(Br)ccc21 Amb22001687 [0,1,0,0,0,0|2,0,1]=4 1273 B12R2.612 Clc1ccc2c(Br)coc2c1 Amb18160080 [0,1,0,0,0,0|3,0,0]=4 1274 B12R2.612 Clc1ccc2c(Br)noc2c1 Amb28187169 [0,1,0,0,0,0|3,0,0]=4 1275 B12R2.612 Clc1ccc2c(Cl)csc2c1 Amb27751229 [0,1,0,0,0,0|3,0,0]=4 1276 B12R2.612 Clc1ccc2c(Cl)noc2c1 Amb21963464 [0,1,0,0,0,0|3,0,0]=4 1277 B12R2.612 Clc1ccc2c(Cl)nsc2c1 Amb24463597 [0,1,0,0,0,0|3,0,0]=4 1278 B12R2.612 Clc1ccc2c(c1)CCC2Br Amb25890551 [0,1,0,0,0,0|2,0,1]=4 1279 B12R2.612 Clc1ccc2c(c1)CCC2Cl Amb25351129 [0,1,0,0,0,0|2,0,1]=4 1280 B12R2.612 Clc1coc2cc(Br)ccc12 Amb18745541 [0,1,0,0,0,0|3,0,0]=4 1281 B12R2.612 Clc1csc2cc(Br)ccc12 Amb27815801 [0,1,0,0,0,0|3,0,0]=4 1282 B12R2.612 Clc1csc2cc(I)ccc12 Amb28048641 [0,1,0,0,0,0|3,0,0]=4 1283 B12R2.612 Clc1noc2cc(Br)ccc12 Amb22235402 [0,1,0,0,0,0|3,0,0]=4 1284 B12R2.612 Clc1noc2cc(I)ccc12 Amb27653374 [0,1,0,0,0,0|3,0,0]=4 1285 B12R2.612 Clc1nsc2cc(Br)ccc12 Amb26622369 [0,1,0,0,0,0|3,0,0]=4 1286 B12R2.612 FC1CCc2cc(Br)ccc21 Amb27873591 [0,1,0,0,0,0|2,0,1]=4 1287 B12R2.612 Fc1ccc2c(Br)noc2c1 Amb26331474 [0,1,0,0,0,0|3,0,0]=4 1288 B12R2.612 Fc1ccc2c(Cl)noc2c1 Amb19959270 [0,1,0,0,0,0|3,0,0]=4 1289 B12R2.612 Fc1ccc2c(Cl)nsc2c1 Amb24586607 [0,1,0,0,0,0|3,0,0]=4 1290 B12R2.612 Fc1ccc2c(c1)CCC2F Amb27229156 [0,1,0,0,0,0|2,0,1]=4 1291 B12R2.612 Fc1ccc2c(c1)CCC2S Amb27783747 [0,1,0,0,0,0|1,1,1]=4 1292 B12R2.612 N=C1C=CC2=C(N)NNC2=C1 Amb24392472 [0,1,0,0,0,0|3,0,0]=4 1293 B12R2.612 NC1=CC2=NNC(=O)N2C=C1 Amb26017887 [0,1,0,0,0,0|3,0,0]=4 1294 B12R2.612 NC1=NCc2cc(Cl)ccc21 Amb25724500 [0,1,0,0,0,0|2,0,0]=3 1295 B12R2.612 NC1=NCc2cc(Cl)ccc21 Amb32653438 [0,1,0,0,0,0|2,0,0]=3 1296 B12R2.612 NC1CCc2cc(Br)ccc21 Amb10609946 [0,1,0,0,0,0|2,0,1]=4 1297 B12R2.612 NC1CCc2cc(Br)ccc21 Amb9721669 [0,1,0,0,0,0|2,0,1]=4 1298 B12R2.612 NC1CCc2cc(Cl)ccc21 Amb10609861 [0,1,0,0,0,0|2,0,1]=4 1299 B12R2.612 NC1CCc2cc(Cl)ccc21 Amb9720607 [0,1,0,0,0,0|2,0,1]=4 1300 B12R2.612 NC1CCc2cc(F)ccc21 Amb10609896 [0,1,0,0,0,0|2,0,1]=4 1301 B12R2.612 NC1CCc2cc(F)ccc21 Amb9720606 [0,1,0,0,0,0|2,0,1]=4 1302 B12R2.612 NN1CCc2cc(Br)ccc21 Amb27642736 [0,1,0,0,0,0|3,0,0]=4 1303 B12R2.612 NN1CCc2cc(Cl)ccc21 Amb27762701 [0,1,0,0,0,0|3,0,0]=4 1304 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745142 [0,1,0,0,0,0|2,0,1]=4 1305 B12R2.612 N[C@@H]1CCc2cc(Br)ccc21 Amb22745143 [0,1,0,0,0,0|2,0,1]=4 1306 B12R2.612 N[C@@H]1CCc2cc(Cl)ccc21 Amb13953032 [0,1,0,0,0,0|2,0,1]=4 1307 B12R2.612 N[C@@H]1CCc2cc(Cl)ccc21 Amb30634245 [0,1,0,0,0,0|2,0,1]=4 1308 B12R2.612 N[C@@H]1CCc2cc(F)ccc21 Amb22288667 [0,1,0,0,0,0|2,0,1]=4 1309 B12R2.612 N[C@H]1CCc2cc(Br)ccc21 Amb27828530 [0,1,0,0,0,0|2,0,1]=4 1310 B12R2.612 N[C@H]1CCc2cc(Br)ccc21 Amb33801825 [0,1,0,0,0,0|2,0,1]=4 1311 B12R2.612 N[C@H]1CCc2cc(Cl)ccc21 Amb13953031 [0,1,0,0,0,0|2,0,1]=4 1312 B12R2.612 N[C@H]1CCc2cc(Cl)ccc21 Amb33813741 [0,1,0,0,0,0|2,0,1]=4 1313 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb13953037 [0,1,0,0,0,0|2,0,1]=4 1314 B12R2.612 N[C@H]1CCc2cc(F)ccc21 Amb22270166 [0,1,0,0,0,0|2,0,1]=4 1315 B12R2.612 N[C@H]1CCc2cc(O)ccc21 Amb27780089 [0,1,0,0,0,0|2,0,1]=4 1316 B12R2.612 N[C@H]1CCc2cc(S)ccc21 Amb27251554 [0,1,0,0,0,0|2,0,1]=4 1317 B12R2.612 Nc1ccc2c(Br)noc2c1 Amb27959055 [0,1,0,0,0,0|3,0,0]=4 1318 B12R2.612 Nc1ccc2c(Cl)coc2c1 Amb27446794 [0,1,0,0,0,0|3,0,0]=4 1319 B12R2.612 Nc1ccc2c(Cl)noc2c1 Amb27755390 [0,1,0,0,0,0|3,0,0]=4 1320 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,0,0,0|1,0,0]=2 1321 B12R2.612 Nc1ccc2c(c1)CCC2N Amb13952222 [0,1,0,0,0,0|2,0,1]=4 1322 B12R2.612 Nc1ccc2c(c1)CCC2N Amb28652833 [0,1,0,0,0,0|2,0,1]=4 1323 B12R2.612 Nc1ccc2c(c1)CCC2S Amb32788307 [0,1,0,0,0,0|1,1,1]=4 1324 B12R2.612 Nc1ccc2c(c1)CC[C@@H]2N Amb28437314 [0,1,0,0,0,0|2,0,1]=4 1325 B12R2.612 Nc1ccc2c(c1)CNC2=O Amb16233788 [0,1,0,0,0,0|1,0,0]=2 1326 B12R2.612 Nc1ccc2c(c1)COB2O Amb26860830 [0,1,0,0,0,0|1,0,1]=3 1327 B12R2.612 Nc1ccc2c(c1)COC2=O Amb1101070 [0,1,0,0,0,0|0,0,0]=1 1328 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb21964765 [0,1,0,0,0,0|2,0,0]=3 1329 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb22008653 [0,1,0,0,0,0|2,0,0]=3 1330 B12R2.612 Nc1ccc2c(c1)NOC2=O Amb27404538 [0,1,0,0,0,0|1,0,0]=2 1331 B12R2.612 Nc1ccc2c(c1)OCC2=O Amb26332312 [0,1,0,0,0,0|2,0,0]=3 1332 B12R2.612 Nc1ccc2c(c1)ONC2=O Amb28399452 [0,1,0,0,0,0|2,0,0]=3 1333 B12R2.612 Nc1ccc2c(c1)SNC2=O Amb33548429 [0,1,0,0,0,0|2,0,0]=3 1334 B12R2.612 Nc1cnc2c(c1)CNC2=O Amb32927035 [0,1,0,0,0,0|2,0,0]=3 1335 B12R2.612 Nc1cnc2c(c1)CNC2=O Amb32992767 [0,1,0,0,0,0|2,0,0]=3 1336 B12R2.612 Nc1csc2cc(Cl)ccc12 Amb23403635 [0,1,0,0,0,0|3,0,0]=4 1337 B12R2.612 Nc1csc2cc(O)ccc12 Amb25825529 [0,1,0,0,0,0|3,0,0]=4 1338 B12R2.612 Nc1ncc2c(n1)CCC2=O Amb18202147 [0,1,0,0,0,0|3,0,0]=4 1339 B12R2.612 Nc1ncc2c(n1)CNC2=O Amb23503820 [0,1,0,0,0,0|3,0,0]=4 1340 B12R2.612 Nc1noc2cc(Br)ccc12 Amb9677652 [0,1,0,0,0,0|3,0,0]=4 1341 B12R2.612 Nc1noc2cc(Cl)ccc12 Amb21965135 [0,1,0,0,0,0|3,0,0]=4 1342 B12R2.612 Nc1noc2cc(F)ccc12 Amb19957543 [0,1,0,0,0,0|3,0,0]=4 1343 B12R2.612 Nc1noc2cc(I)ccc12 Amb22754620 [0,1,0,0,0,0|3,0,0]=4 1344 B12R2.612 Nc1nsc2cc(Br)ccc12 Amb22496226 [0,1,0,0,0,0|3,0,0]=4 1345 B12R2.612 Nc1nsc2cc(Cl)ccc12 Amb18649046 [0,1,0,0,0,0|3,0,0]=4 1346 B12R2.612 Nc1nsc2cc(I)ccc12 Amb27617319 [0,1,0,0,0,0|3,0,0]=4 1347 B12R2.612 Nc1nsc2cc(O)ccc12 Amb27240205 [0,1,0,0,0,0|3,0,0]=4 1348 B12R2.612 Nc1snc2cc(Br)ccc12 Amb28126557 [0,1,0,0,0,0|2,1,0]=4 1349 B12R2.612 Nc1snc2cc(Cl)ccc12 Amb27776777 [0,1,0,0,0,0|2,1,0]=4 1350 B12R2.612 O=C1C=CC2=C(NNC2=O)O1 Amb24595650 [0,1,0,0,0,0|3,0,0]=4 1351 B12R2.612 O=C1CCc2cc(Br)ccc21 Amb2685276 [0,1,0,0,0,0|1,0,0]=2 1352 B12R2.612 O=C1CCc2cc(Br)cnc21 Amb27765421 [0,1,0,0,0,0|2,0,0]=3 1353 B12R2.612 O=C1CCc2cc(Cl)ccc21 Amb2686124 [0,1,0,0,0,0|1,0,0]=2 1354 B12R2.612 O=C1CCc2cc(Cl)cnc21 Amb24486389 [0,1,0,0,0,0|2,0,0]=3 1355 B12R2.612 O=C1CCc2cc(Cl)ncc21 Amb33803372 [0,1,0,0,0,0|2,0,0]=3 1356 B12R2.612 O=C1CCc2cc(F)ccc21 Amb2688113 [0,1,0,0,0,0|1,0,0]=2 1357 B12R2.612 O=C1CCc2cc(I)ccc21 Amb10602519 [0,1,0,0,0,0|1,0,0]=2 1358 B12R2.612 O=C1CCc2cc(O)ccc21 Amb2610677 [0,1,0,0,0,0|1,0,0]=2 1359 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,0,0,0|1,0,0]=2 1360 B12R2.612 O=C1CCc2nc(Br)ccc21 Amb24434829 [0,1,0,0,0,0|2,0,0]=3 1361 B12R2.612 O=C1CCc2nc(Cl)ccc21 Amb27262008 [0,1,0,0,0,0|2,0,0]=3 1362 B12R2.612 O=C1CCc2nc(O)ccc21 Amb24434633 [0,1,0,0,0,0|2,0,0]=3 1363 B12R2.612 O=C1CCc2nc(O)ncc21 Amb18202016 [0,1,0,0,0,0|3,0,0]=4 1364 B12R2.612 O=C1CNc2cc(Br)ccc21 Amb27623314 [0,1,0,0,0,0|2,0,0]=3 1365 B12R2.612 O=C1COc2cc(Br)ccc21 Amb10070946 [0,1,0,0,0,0|2,0,0]=3 1366 B12R2.612 O=C1COc2cc(Br)cnc21 Amb24575031 [0,1,0,0,0,0|3,0,0]=4 1367 B12R2.612 O=C1COc2cc(Br)cnc21 Amb32652703 [0,1,0,0,0,0|3,0,0]=4 1368 B12R2.612 O=C1COc2cc(Cl)ccc21 Amb10070947 [0,1,0,0,0,0|2,0,0]=3 1369 B12R2.612 O=C1COc2cc(F)ccc21 Amb10840769 [0,1,0,0,0,0|2,0,0]=3 1370 B12R2.612 O=C1COc2cc(I)ccc21 Amb16233079 [0,1,0,0,0,0|2,0,0]=3 1371 B12R2.612 O=C1COc2cc(O)ccc21 Amb1155533 [0,1,0,0,0,0|2,0,0]=3 1372 B12R2.612 O=C1CSc2cc(Br)ccc21 Amb26632914 [0,1,0,0,0,0|2,0,0]=3 1373 B12R2.612 O=C1CSc2cc(Cl)ccc21 Amb4062420 [0,1,0,0,0,0|2,0,0]=3 1374 B12R2.612 O=C1CSc2cc(I)ccc21 Amb27441580 [0,1,0,0,0,0|2,0,0]=3 1375 B12R2.612 O=C1N=Cc2cc(F)ccc21 Amb22001920 [0,1,0,0,0,0|1,0,1]=3 1376 B12R2.612 O=C1N=Cc2cc(I)ccc21 Amb22015264 [0,1,0,0,0,0|1,0,1]=3 1377 B12R2.612 O=C1N=Cc2cc(O)ccc21 Amb22015151 [0,1,0,0,0,0|1,0,1]=3 1378 B12R2.612 O=C1NCc2cc(Br)ccc21 Amb10602848 [0,1,0,0,0,0|1,0,0]=2 1379 B12R2.612 O=C1NCc2cc(Br)cnc21 Amb22276367 [0,1,0,0,0,0|2,0,0]=3 1380 B12R2.612 O=C1NCc2cc(Br)ncc21 Amb25286745 [0,1,0,0,0,0|2,0,0]=3 1381 B12R2.612 O=C1NCc2cc(Cl)ccc21 Amb13883708 [0,1,0,0,0,0|1,0,0]=2 1382 B12R2.612 O=C1NCc2cc(F)ccc21 Amb22371476 [0,1,0,0,0,0|1,0,0]=2 1383 B12R2.612 O=C1NCc2cc(F)ccc21 Amb33716954 [0,1,0,0,0,0|1,0,0]=2 1384 B12R2.612 O=C1NCc2cc(I)ccc21 Amb21963157 [0,1,0,0,0,0|1,0,0]=2 1385 B12R2.612 O=C1NCc2cc(O)ccc21 Amb21857015 [0,1,0,0,0,0|1,0,0]=2 1386 B12R2.612 O=C1NCc2nc(Br)ccc21 Amb26373127 [0,1,0,0,0,0|2,0,0]=3 1387 B12R2.612 O=C1NCc2nc(Cl)ccc21 Amb22736834 [0,1,0,0,0,0|2,0,0]=3 1388 B12R2.612 O=C1NCc2nc(Cl)cnc21 Amb27663715 [0,1,0,0,0,0|3,0,0]=4 1389 B12R2.612 O=C1NCc2nc(O)ncc21 Amb28135830 [0,1,0,0,0,0|3,0,0]=4 1390 B12R2.612 O=C1NN=C2C=C(Br)C=CN12 Amb24645289 [0,1,0,0,0,0|3,0,0]=4 1391 B12R2.612 O=C1NNc2cc(Cl)ccc21 Amb22491677 [0,1,0,0,0,0|2,0,0]=3 1392 B12R2.612 O=C1NNc2cc(Cl)ncc21 Amb25312441 [0,1,0,0,0,0|3,0,0]=4 1393 B12R2.612 O=C1NNc2cc(F)ccc21 Amb21864861 [0,1,0,0,0,0|2,0,0]=3 1394 B12R2.612 O=C1NOc2cc(Br)ccc21 Amb21856452 [0,1,0,0,0,0|2,0,0]=3 1395 B12R2.612 O=C1NOc2cc(Cl)ccc21 Amb22015207 [0,1,0,0,0,0|2,0,0]=3 1396 B12R2.612 O=C1NOc2cc(O)ccc21 Amb24427281 [0,1,0,0,0,0|2,0,0]=3 1397 B12R2.612 O=C1NSc2cc(Br)ccc21 Amb25863424 [0,1,0,0,0,0|2,0,0]=3 1398 B12R2.612 O=C1NSc2cc(Cl)ccc21 Amb19131195 [0,1,0,0,0,0|2,0,0]=3 1399 B12R2.612 O=C1NSc2cc(F)ccc21 Amb17933791 [0,1,0,0,0,0|2,0,0]=3 1400 B12R2.612 O=C1OCc2cc(Br)ccc21 Amb2617435 [0,1,0,0,0,0|0,0,0]=1 1401 B12R2.612 O=C1OCc2cc(Br)cnc21 Amb28044982 [0,1,0,0,0,0|1,0,0]=2 1402 B12R2.612 O=C1OCc2cc(Cl)ccc21 Amb16232644 [0,1,0,0,0,0|0,0,0]=1 1403 B12R2.612 O=C1OCc2cc(Cl)cnc21 Amb28073368 [0,1,0,0,0,0|1,0,0]=2 1404 B12R2.612 O=C1OCc2cc(Cl)ncc21 Amb24083559 [0,1,0,0,0,0|1,0,0]=2 1405 B12R2.612 O=C1OCc2cc(F)ccc21 Amb16232978 [0,1,0,0,0,0|0,0,0]=1 1406 B12R2.612 O=C1OCc2cc(I)ccc21 Amb16232979 [0,1,0,0,0,0|0,0,0]=1 1407 B12R2.612 O=C1OCc2cc(I)ncc21 Amb27823715 [0,1,0,0,0,0|1,0,0]=2 1408 B12R2.612 O=C1OCc2cc(O)ccc21 Amb5718517 [0,1,0,0,0,0|0,0,0]=1 1409 B12R2.612 O=C1OCc2nc(Cl)ncc21 Amb27755463 [0,1,0,0,0,0|2,0,0]=3 1410 B12R2.612 O=C1ONc2cc(Cl)ccc21 Amb26858350 [0,1,0,0,0,0|1,0,0]=2 1411 B12R2.612 O=C1ONc2cc(F)ccc21 Amb27488717 [0,1,0,0,0,0|1,0,0]=2 1412 B12R2.612 O=C1SNc2cc(F)ccc21 Amb32673866 [0,1,0,0,0,0|1,1,0]=3 1413 B12R2.612 O=s1cnc2cc(Cl)ccc21 Amb33513192 [0,1,0,0,0,0|3,0,0]=4 1414 B12R2.612 OB1OCc2cc(Cl)ccc21 Amb24271171 [0,1,0,0,0,0|1,0,1]=3 1415 B12R2.612 OB1OCc2cc(F)ccc21 Amb33544070 [0,1,0,0,0,0|1,0,1]=3 1416 B12R2.612 OB1OCc2cc(O)ccc21 Amb24665939 [0,1,0,0,0,0|1,0,1]=3 1417 B12R2.612 OB1OCc2nc(Br)ccc21 Amb33511846 [0,1,0,0,0,0|2,0,1]=4 1418 B12R2.612 OB1OCc2nc(Cl)ccc21 Amb33511845 [0,1,0,0,0,0|2,0,1]=4 1419 B12R2.612 OB1OCc2nc(F)ccc21 Amb33511847 [0,1,0,0,0,0|2,0,1]=4 1420 B12R2.612 OC1CCc2cc(Br)ccc21 Amb7990025 [0,1,0,0,0,0|1,0,2]=4 1421 B12R2.612 OC1CCc2cc(Cl)ccc21 Amb22001631 [0,1,0,0,0,0|1,0,2]=4 1422 B12R2.612 OC1CCc2cc(F)ccc21 Amb22756387 [0,1,0,0,0,0|1,0,2]=4 1423 B12R2.612 OC1OCc2cc(Cl)ccc21 Amb22751579 [0,1,0,0,0,0|0,0,2]=3 1424 B12R2.612 O[C@@H]1CCc2cc(Br)ccc21 Amb22886733 [0,1,0,0,0,0|1,0,2]=4 1425 B12R2.612 O[C@@H]1CCc2cc(Cl)ccc21 Amb13953029 [0,1,0,0,0,0|1,0,2]=4 1426 B12R2.612 O[C@@H]1CCc2cc(F)ccc21 Amb13953035 [0,1,0,0,0,0|1,0,2]=4 1427 B12R2.612 O[C@@H]1CCc2cc(I)ccc21 Amb25969174 [0,1,0,0,0,0|1,0,2]=4 1428 B12R2.612 O[C@H]1CCc2cc(Br)ccc21 Amb24420879 [0,1,0,0,0,0|1,0,2]=4 1429 B12R2.612 O[C@H]1CCc2cc(Cl)ccc21 Amb13953030 [0,1,0,0,0,0|1,0,2]=4 1430 B12R2.612 O[C@H]1CCc2cc(F)ccc21 Amb13953033 [0,1,0,0,0,0|1,0,2]=4 1431 B12R2.612 O[C@H]1CCc2cc(I)ccc21 Amb27649441 [0,1,0,0,0,0|1,0,2]=4 1432 B12R2.612 Oc1ccc2c(Br)csc2c1 Amb32708787 [0,1,0,0,0,0|3,0,0]=4 1433 B12R2.612 Oc1ccc2c(Cl)noc2c1 Amb27663451 [0,1,0,0,0,0|3,0,0]=4 1434 B12R2.612 Oc1ccc2c(O)coc2c1 Amb24061705 [0,1,0,0,0,0|2,0,1]=4 1435 B12R2.612 Oc1ccc2c(c1)CCC2S Amb32788820 [0,1,0,0,0,0|1,1,1]=4 1436 B12R2.612 Oc1ccc2c(c1)CC[C@@H]2O Amb28045712 [0,1,0,0,0,0|1,0,2]=4 1437 B12R2.612 Oc1ccc2c(c1)CC[C@H]2O Amb28292539 [0,1,0,0,0,0|1,0,2]=4 1438 B12R2.612 Oc1csc2cc(Br)ccc12 Amb28199014 [0,1,0,0,0,0|2,0,1]=4 1439 B12R2.612 Oc1csc2cc(F)ccc12 Amb27799987 [0,1,0,0,0,0|2,0,1]=4 1440 B12R2.612 Oc1noc2cc(Br)ccc12 Amb10975705 [0,1,0,0,0,0|2,0,1]=4 1441 B12R2.612 Oc1noc2cc(I)ccc12 Amb26622191 [0,1,0,0,0,0|2,0,1]=4 1442 B12R2.612 S=C1NOc2cc(Cl)ccc21 Amb28135755 [0,1,0,0,0,0|2,1,0]=4 1443 B12R2.612 SC1CCc2cc(Br)ccc21 Amb25821808 [0,1,0,0,0,0|1,1,1]=4 1444 B12R2.612 SC1CCc2cc(Cl)ccc21 Amb24639650 [0,1,0,0,0,0|1,1,1]=4 1445 B12R2.612 [O-][n+]1onc2cc(Cl)ccc21 Amb1040378 [0,1,0,0,0,0|2,0,1]=4 1446 B12R2.2028 BrC1CC(Br)c2ccccc21 Amb28136954 [0,1,0,0,0,0|2,0,1]=4 1447 B12R2.2028 C=C1CC(O)c2ccncc21 Amb25863928 [0,1,0,0,0,0|3,0,0]=4 1448 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [0,1,0,0,0,0|1,0,1]=3 1449 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,1,0,0,0,0|0,0,1]=2 1450 B12R2.2028 CC1=CC(=O)c2ccccc21 Amb9783432 [0,1,0,0,0,0|1,0,1]=3 1451 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [0,1,0,0,0,0|2,0,0]=3 1452 B12R2.2028 CC1C=C(Cl)c2ccccc21 Amb17778911 [0,1,0,0,0,0|2,0,0]=3 1453 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,1,0,0,0,0|1,0,0]=2 1454 B12R2.2028 CC1CC(Cl)c2ccccc21 Amb27413208 [0,1,0,0,0,0|2,0,1]=4 1455 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,1,0,0,0,0|2,0,1]=4 1456 B12R2.2028 CC1CC(N)c2ccccc21 Amb6705561 [0,1,0,0,0,0|2,0,1]=4 1457 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,1,0,0,0,0|1,1,1]=4 1458 B12R2.2028 CC1CN(C)c2ccccc21 Amb5718018 [0,1,0,0,0,0|3,0,0]=4 1459 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,1,0,0,0,0|1,0,0]=2 1460 B12R2.2028 CC1NC(=S)c2ccccc21 Amb27962483 [0,1,0,0,0,0|1,1,0]=3 1461 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,1,0,0,0,0|2,0,1]=4 1462 B12R2.2028 CC1NN(C)c2ccccc21 Amb27222813 [0,1,0,0,0,0|3,0,0]=4 1463 B12R2.2028 CC1OB(O)c2ccccc21 Amb25893330 [0,1,0,0,0,0|1,0,1]=3 1464 B12R2.2028 CC1OC(=O)c2cccnc21 Amb26847130 [0,1,0,0,0,0|1,0,0]=2 1465 B12R2.2028 CN1CC(N)c2ccccc21 Amb26601033 [0,1,0,0,0,0|3,0,0]=4 1466 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,1,0,0,0,0|2,0,0]=3 1467 B12R2.2028 CN1NC(=O)c2cccnc21 Amb19314984 [0,1,0,0,0,0|3,0,0]=4 1468 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [0,1,0,0,0,0|2,1,0]=4 1469 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,1,0,0,0,0|1,1,0]=3 1470 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,0,0,0|1,0,0]=2 1471 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccccc21 Amb27623223 [0,1,0,0,0,0|1,0,2]=4 1472 B12R2.2028 C[C@@H]1N[C@@H](C)c2ccccc21 Amb27788108 [0,1,0,0,0,0|2,0,1]=4 1473 B12R2.2028 C[C@@H]1N[C@@H](C)c2ccccc21 Amb35788409 [0,1,0,0,0,0|2,0,1]=4 1474 B12R2.2028 C[C@@H]1OC(=O)c2ccccc21 Amb25892505 [0,1,0,0,0,0|0,0,0]=1 1475 B12R2.2028 C[C@@H]1OC(O)c2ccccc21 Amb26648832 [0,1,0,0,0,0|0,0,2]=3 1476 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,0,0,0|1,0,0]=2 1477 B12R2.2028 C[C@H]1O[C@@H](O)c2ccccc21 Amb28142292 [0,1,0,0,0,0|0,0,2]=3 1478 B12R2.2028 Cc1cn(Br)c2ccccc12 Amb28286948 [0,1,0,0,0,0|3,0,0]=4 1479 B12R2.2028 Cc1cn(C)c2ccccc12 Amb842585 [0,1,0,0,0,0|3,0,0]=4 1480 B12R2.2028 Cc1nn(C)c2ccccc12 Amb22491231 [0,1,0,0,0,0|3,0,0]=4 1481 B12R2.2028 Cc1nn(N)c2ccccc12 Amb27859143 [0,1,0,0,0,0|3,0,0]=4 1482 B12R2.2028 Cc1oc(C)c2cnccc12 Amb24760345 [0,1,0,0,0,0|2,0,1]=4 1483 B12R2.2028 Clc1sc(Cl)c2ccccc12 Amb26355866 [0,1,0,0,0,0|1,1,1]=4 1484 B12R2.2028 Cn1cc(Br)c2ccccc21 Amb9210485 [0,1,0,0,0,0|3,0,0]=4 1485 B12R2.2028 Cn1cc(Cl)c2ccccc21 Amb28066534 [0,1,0,0,0,0|3,0,0]=4 1486 B12R2.2028 Cn1cc(N)c2ccccc21 Amb18064415 [0,1,0,0,0,0|3,0,0]=4 1487 B12R2.2028 Cn1cc(N)c2ccccc21 Amb33620933 [0,1,0,0,0,0|3,0,0]=4 1488 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [0,1,0,0,0,0|2,0,1]=4 1489 B12R2.2028 Cn1cc(S)c2ccccc21 Amb25721189 [0,1,0,0,0,0|2,1,0]=4 1490 B12R2.2028 Cn1nc(Br)c2ccccc21 Amb10604243 [0,1,0,0,0,0|3,0,0]=4 1491 B12R2.2028 Cn1nc(I)c2ccccc21 Amb10608014 [0,1,0,0,0,0|3,0,0]=4 1492 B12R2.2028 Cn1nc(N)c2ccccc21 Amb9677805 [0,1,0,0,0,0|3,0,0]=4 1493 B12R2.2028 N=C1NC(=N)c2ccccc21 Amb4410671 [0,1,0,0,0,0|2,0,1]=4 1494 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,1,0,0,0,0|1,0,1]=3 1495 B12R2.2028 N=C1NC(=S)c2ccccc21 Amb27268465 [0,1,0,0,0,0|1,1,1]=4 1496 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [0,1,0,0,0,0|1,0,1]=3 1497 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,1,0,0,0,0|1,0,0]=2 1498 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,0,0,0|1,0,0]=2 1499 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,1,0,0,0,0|2,0,1]=4 1500 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,1,0,0,0,0|2,0,1]=4 1501 B12R2.2028 NC1CC(O)c2ccccc21 Amb17470387 [0,1,0,0,0,0|1,0,2]=4 1502 B12R2.2028 NC1CC(S)c2ccccc21 Amb32788269 [0,1,0,0,0,0|1,1,1]=4 1503 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,1,0,0,0,0|1,0,0]=2 1504 B12R2.2028 NC1NC(N)c2ccccc21 Amb25887101 [0,1,0,0,0,0|2,0,1]=4 1505 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,1,0,0,0,0|1,0,0]=2 1506 B12R2.2028 N[C@@H]1C[C@@H](N)c2ccccc21 Amb27627309 [0,1,0,0,0,0|2,0,1]=4 1507 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,1,0,0,0,0|1,0,2]=4 1508 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,1,0,0,0,0|1,0,2]=4 1509 B12R2.2028 N[C@H]1C[C@@H](N)c2ccccc21 Amb27468638 [0,1,0,0,0,0|2,0,1]=4 1510 B12R2.2028 N[C@H]1C[C@@H](O)c2ccccc21 Amb27810799 [0,1,0,0,0,0|1,0,2]=4 1511 B12R2.2028 O=C1C=[N+]([O-])c2ccccc21 Amb17843025 [0,1,0,0,0,0|2,0,0]=3 1512 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [0,1,0,0,0,0|1,0,1]=3 1513 B12R2.2028 O=C1CC(=O)c2ncccc21 Amb28324367 [0,1,0,0,0,0|2,0,1]=4 1514 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,1,0,0,0,0|1,0,0]=2 1515 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,1,0,0,0,0|1,0,0]=2 1516 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,1,0,0,0,0|1,0,0]=2 1517 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,1,0,0,0,0|1,0,0]=2 1518 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,1,0,0,0,0|1,0,0]=2 1519 B12R2.2028 O=C1CC(O)c2cccnc21 Amb22750353 [0,1,0,0,0,0|2,0,0]=3 1520 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [0,1,0,0,0,0|1,0,1]=3 1521 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [0,1,0,0,0,0|1,0,1]=3 1522 B12R2.2028 O=C1NC(=O)c2cnccc21 Amb2609991 [0,1,0,0,0,0|2,0,1]=4 1523 B12R2.2028 O=C1NC(=O)c2ncccc21 Amb2384085 [0,1,0,0,0,0|2,0,1]=4 1524 B12R2.2028 O=C1NC(Br)=C2C=CC=CN12 Amb27623626 [0,1,0,0,0,0|2,0,1]=4 1525 B12R2.2028 O=C1NC(F)c2ccccc21 Amb27165216 [0,1,0,0,0,0|1,0,0]=2 1526 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [0,1,0,0,0,0|1,0,0]=2 1527 B12R2.2028 O=C1OB(O)c2cccnc21 Amb25694435 [0,1,0,0,0,0|2,0,0]=3 1528 B12R2.2028 O=C1OC(=O)c2ccccc21 Amb17748796 [0,1,0,0,0,0|0,0,1]=2 1529 B12R2.2028 O=C1OC(=O)c2cnccc21 Amb2609992 [0,1,0,0,0,0|1,0,1]=3 1530 B12R2.2028 O=C1OC(=O)c2ncccc21 Amb1106402 [0,1,0,0,0,0|1,0,1]=3 1531 B12R2.2028 O=C1OC(=O)c2nccnc21 Amb1075395 [0,1,0,0,0,0|2,0,1]=4 1532 B12R2.2028 O=C1OC(Br)c2ccccc21 Amb2685476 [0,1,0,0,0,0|0,0,0]=1 1533 B12R2.2028 O=C1OC(Cl)c2ccccc21 Amb6297233 [0,1,0,0,0,0|0,0,0]=1 1534 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [0,1,0,0,0,0|0,0,0]=1 1535 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [0,1,0,0,0,0|0,0,0]=1 1536 B12R2.2028 O=C1OC(O)c2ccncc21 Amb28240212 [0,1,0,0,0,0|1,0,0]=2 1537 B12R2.2028 O=C1OC(O)c2cnccc21 Amb24426049 [0,1,0,0,0,0|1,0,0]=2 1538 B12R2.2028 O=C1OS(=O)c2ccccc21 Amb27755534 [0,1,0,0,0,0|1,0,0]=2 1539 B12R2.2028 O=C1O[IH2](Cl)c2ccccc21 Amb26012976 [0,1,0,0,0,0|1,0,0]=2 1540 B12R2.2028 O=C1O[IH2](O)c2ccccc21 Amb33548934 [0,1,0,0,0,0|1,0,0]=2 1541 B12R2.2028 O=C1SC(=O)c2ccccc21 Amb2610321 [0,1,0,0,0,0|0,1,1]=3 1542 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [0,1,0,0,0,0|0,1,0]=2 1543 B12R2.2028 O=C1[CH-]C(=O)[n+]2ccccc21 Amb27823426 [0,1,0,0,0,0|2,0,1]=4 1544 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb28990952 [0,1,0,0,0,0|1,0,1]=3 1545 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb6365847 [0,1,0,0,0,0|1,0,1]=3 1546 B12R2.2028 O=c1ns(=O)c2ccccc12 Amb4138643 [0,1,0,0,0,0|2,0,0]=3 1547 B12R2.2028 OB1OC(O)c2ccccc21 Amb27425186 [0,1,0,0,0,0|1,0,1]=3 1548 B12R2.2028 OC1CC(O)c2ccccc21 Amb1110942 [0,1,0,0,0,0|1,0,2]=4 1549 B12R2.2028 OC1NC(=S)c2ccccc21 Amb28198939 [0,1,0,0,0,0|1,1,0]=3 1550 B12R2.2028 OC1NC(O)c2ccccc21 Amb24441685 [0,1,0,0,0,0|1,0,2]=4 1551 B12R2.2028 OC1OC(O)c2ccccc21 Amb27455100 [0,1,0,0,0,0|0,0,2]=3 1552 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc21 Amb17938072 [0,1,0,0,0,0|1,0,2]=4 1553 B12R2.2028 O[C@H]1C[C@H](O)c2ccccc21 Amb10068281 [0,1,0,0,0,0|1,0,2]=4 1554 B12R2.2028 S=C1NC(=S)c2ccccc21 Amb28241299 [0,1,0,0,0,0|1,1,1]=4 1555 B12R2.2403 CC1(C)CCc2ccccc21 Amb24657207 [0,1,0,0,0,0|2,0,1]=4 1556 B12R2.2403 CC1(C)NCc2ccccc21 Amb23439228 [0,1,0,0,0,0|2,0,1]=4 1557 B12R2.2403 CC1(C)OCc2ccccc21 Amb23558274 [0,1,0,0,0,0|1,0,1]=3 1558 B12R2.2403 CC1(C)OCc2cnccc21 Amb25048441 [0,1,0,0,0,0|2,0,1]=4 1559 B12R2.2403 CC1(F)CCc2ccccc21 Amb27958822 [0,1,0,0,0,0|2,0,1]=4 1560 B12R2.2403 CC1(N)CCc2ccccc21 Amb32664163 [0,1,0,0,0,0|2,0,1]=4 1561 B12R2.2403 CC1(N)CCc2ccccc21 Amb9676193 [0,1,0,0,0,0|2,0,1]=4 1562 B12R2.2403 CC1(O)CCc2ccccc21 Amb9676017 [0,1,0,0,0,0|1,0,2]=4 1563 B12R2.2403 C[Si]1(C)OCc2ccccc21 Amb22167083 [0,1,0,0,0,0|1,1,0]=3 1564 B12R2.2403 FC1(F)CCc2ccccc21 Amb28434831 [0,1,0,0,0,0|2,0,1]=4 1565 B12R2.2403 N=S1(=O)CCc2ccccc21 Amb32666887 [0,1,0,0,0,0|2,0,0]=3 1566 B12R2.2403 NC1(O)CCc2ccccc21 Amb2699122 [0,1,0,0,0,0|1,0,2]=4 1567 B12R2.2403 N[C@@]1(O)CCc2ccccc21 Amb28072855 [0,1,0,0,0,0|1,0,2]=4 1568 B12R2.2403 O=S1(=O)C=Cc2ccccc21 Amb6356379 [0,1,0,0,0,0|2,0,1]=4 1569 B12R2.2403 O=S1(=O)CCc2ccccc21 Amb5719001 [0,1,0,0,0,0|2,0,0]=3 1570 B12R2.2403 O=S1(=O)N=Nc2ccccc21 Amb25191174 [0,1,0,0,0,0|3,0,0]=4 1571 B12R2.2403 O=S1(=O)NCc2ccccc21 Amb2695161 [0,1,0,0,0,0|2,0,0]=3 1572 B12R2.2403 O=S1(=O)OCc2ccccc21 Amb4034604 [0,1,0,0,0,0|1,0,0]=2 1573 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [0,0,1,0,0,0|3,0,0]=4 1574 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,1,0,0,0|1,0,1]=3 1575 B10R1.15 C#CC(=O)c1ccccn1 Amb28120737 [0,0,1,0,0,0|2,0,1]=4 1576 B10R1.15 C#CC(=O)c1cccnc1 Amb27272672 [0,0,1,0,0,0|2,0,1]=4 1577 B10R1.15 C#CC(=O)c1ccncc1 Amb27235537 [0,0,1,0,0,0|2,0,1]=4 1578 B10R1.15 C=C(C#N)c1ccccc1 Amb17231856 [0,0,1,0,0,0|3,0,0]=4 1579 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [0,0,1,0,0,0|3,0,0]=4 1580 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [0,0,1,0,0,0|3,0,0]=4 1581 B10R1.15 C=C(CC)c1ccccn1 Amb24467663 [0,0,1,0,0,0|3,0,0]=4 1582 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [0,0,1,0,0,0|3,0,0]=4 1583 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [0,0,1,0,0,0|3,0,0]=4 1584 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [0,0,1,0,0,0|3,0,0]=4 1585 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [0,0,1,0,0,0|3,0,0]=4 1586 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [0,0,1,0,0,0|2,0,0]=3 1587 B10R1.15 C=C(OC)c1ccccn1 Amb28141881 [0,0,1,0,0,0|2,0,0]=3 1588 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [0,0,1,0,0,0|2,0,1]=4 1589 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [0,0,1,0,0,0|1,0,1]=3 1590 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [0,0,1,0,0,0|2,0,1]=4 1591 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [0,0,1,0,0,0|2,0,1]=4 1592 B10R1.15 C=CC(=O)c1ccncc1 Amb24482055 [0,0,1,0,0,0|2,0,1]=4 1593 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [0,0,1,0,0,0|2,0,1]=4 1594 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [0,0,1,0,0,0|2,0,1]=4 1595 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [0,0,1,0,0,0|2,0,1]=4 1596 B10R1.15 CCC(=N)c1ccccn1 Amb28182447 [0,0,1,0,0,0|3,0,0]=4 1597 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,0,1,0,0,0|1,0,0]=2 1598 B10R1.15 CCC(=O)c1ccccn1 Amb6301470 [0,0,1,0,0,0|2,0,0]=3 1599 B10R1.15 CCC(=O)c1cccnc1 Amb8386799 [0,0,1,0,0,0|2,0,0]=3 1600 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [0,0,1,0,0,0|2,0,0]=3 1601 B10R1.15 CCC(=O)c1ccncn1 Amb25737542 [0,0,1,0,0,0|3,0,0]=4 1602 B10R1.15 CCC(=O)c1cnccn1 Amb22235242 [0,0,1,0,0,0|3,0,0]=4 1603 B10R1.15 CCC(=O)c1cncnc1 Amb24082134 [0,0,1,0,0,0|3,0,0]=4 1604 B10R1.15 CCC(=O)c1ncccn1 Amb22236265 [0,0,1,0,0,0|3,0,0]=4 1605 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [0,0,1,0,0,0|2,0,1]=4 1606 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [0,0,1,0,0,0|2,0,1]=4 1607 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [0,0,1,0,0,0|2,0,1]=4 1608 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [0,0,1,0,0,0|2,0,1]=4 1609 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [0,0,1,0,0,0|2,0,1]=4 1610 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [0,0,1,0,0,0|1,0,2]=4 1611 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [0,0,1,0,0,0|1,1,1]=4 1612 B10R1.15 CCN(N)c1ccccc1 Amb836839 [0,0,1,0,0,0|3,0,0]=4 1613 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [0,0,1,0,0,0|3,0,0]=4 1614 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [0,0,1,0,0,0|2,0,0]=3 1615 B10R1.15 CCS(=O)c1ccccn1 Amb28049400 [0,0,1,0,0,0|3,0,0]=4 1616 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [0,0,1,0,0,0|2,0,1]=4 1617 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [0,0,1,0,0,0|2,0,1]=4 1618 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [0,0,1,0,0,0|2,0,1]=4 1619 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [0,0,1,0,0,0|1,0,2]=4 1620 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [0,0,1,0,0,0|2,0,1]=4 1621 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [0,0,1,0,0,0|2,0,1]=4 1622 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [0,0,1,0,0,0|2,0,1]=4 1623 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [0,0,1,0,0,0|2,0,1]=4 1624 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [0,0,1,0,0,0|1,0,2]=4 1625 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,1,0,0,0|2,0,0]=3 1626 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [0,0,1,0,0,0|2,0,0]=3 1627 B10R1.15 CNC(=N)c1cccnc1 Amb32667420 [0,0,1,0,0,0|3,0,0]=4 1628 B10R1.15 CNC(=O)C1=CC=CNC1 Amb27252063 [0,0,1,0,0,0|2,0,1]=4 1629 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,0,1,0,0,0|1,0,0]=2 1630 B10R1.15 CNC(=O)c1ccccn1 Amb6892873 [0,0,1,0,0,0|2,0,0]=3 1631 B10R1.15 CNC(=O)c1cccnc1 Amb3886560 [0,0,1,0,0,0|2,0,0]=3 1632 B10R1.15 CNC(=O)c1ccncc1 Amb26328844 [0,0,1,0,0,0|2,0,0]=3 1633 B10R1.15 CNC(=O)c1ccncn1 Amb27589630 [0,0,1,0,0,0|3,0,0]=4 1634 B10R1.15 CNC(=O)c1ncccn1 Amb25985661 [0,0,1,0,0,0|3,0,0]=4 1635 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,1,0,0,0|1,1,0]=3 1636 B10R1.15 CNC(=S)c1cccnc1 Amb27877638 [0,0,1,0,0,0|2,1,0]=4 1637 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [0,0,1,0,0,0|2,0,1]=4 1638 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [0,0,1,0,0,0|2,0,1]=4 1639 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [0,0,1,0,0,0|3,0,0]=4 1640 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [0,0,1,0,0,0|2,0,1]=4 1641 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [0,0,1,0,0,0|2,0,1]=4 1642 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [0,0,1,0,0,0|1,0,0]=2 1643 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [0,0,1,0,0,0|1,0,0]=2 1644 B10R1.15 COC(=N)c1cccnn1 Amb27618556 [0,0,1,0,0,0|3,0,0]=4 1645 B10R1.15 COC(=N)c1cnccn1 Amb10071951 [0,0,1,0,0,0|3,0,0]=4 1646 B10R1.15 COC(=O)C1=CC=CNC1 Amb28042598 [0,0,1,0,0,0|1,0,1]=3 1647 B10R1.15 COC(=O)N1C=CC=CC1 Amb2697197 [0,0,1,0,0,0|1,0,1]=3 1648 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,0,1,0,0,0|0,0,0]=1 1649 B10R1.15 COC(=O)c1ccccn1 Amb2721020 [0,0,1,0,0,0|1,0,0]=2 1650 B10R1.15 COC(=O)c1cccnc1 Amb1212078 [0,0,1,0,0,0|1,0,0]=2 1651 B10R1.15 COC(=O)c1cccnc1 Amb22741138 [0,0,1,0,0,0|1,0,0]=2 1652 B10R1.15 COC(=O)c1cccnn1 Amb21960450 [0,0,1,0,0,0|2,0,0]=3 1653 B10R1.15 COC(=O)c1ccncc1 Amb6608958 [0,0,1,0,0,0|1,0,0]=2 1654 B10R1.15 COC(=O)c1ccncn1 Amb7101502 [0,0,1,0,0,0|2,0,0]=3 1655 B10R1.15 COC(=O)c1ccnnc1 Amb17935713 [0,0,1,0,0,0|2,0,0]=3 1656 B10R1.15 COC(=O)c1cnccn1 Amb2455964 [0,0,1,0,0,0|2,0,0]=3 1657 B10R1.15 COC(=O)c1cnccn1 Amb33620824 [0,0,1,0,0,0|2,0,0]=3 1658 B10R1.15 COC(=O)c1cncnc1 Amb5492761 [0,0,1,0,0,0|2,0,0]=3 1659 B10R1.15 COC(=O)c1ncccn1 Amb7101492 [0,0,1,0,0,0|2,0,0]=3 1660 B10R1.15 COC(=O)c1nccnn1 Amb25327432 [0,0,1,0,0,0|3,0,0]=4 1661 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,1,0,0,0|0,1,0]=2 1662 B10R1.15 COC(C)c1ccccc1 Amb23568513 [0,0,1,0,0,0|1,0,1]=3 1663 B10R1.15 CON(C)c1ccccn1 Amb27804447 [0,0,1,0,0,0|3,0,0]=4 1664 B10R1.15 COS(=O)c1ccccc1 Amb2689327 [0,0,1,0,0,0|1,0,0]=2 1665 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,1,0,0,0|1,1,0]=3 1666 B10R1.15 CSC(=O)c1ccccn1 Amb1487227 [0,0,1,0,0,0|1,1,0]=3 1667 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,1,0,0,0|0,2,0]=3 1668 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [0,0,1,0,0,0|2,0,1]=4 1669 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [0,0,1,0,0,0|2,0,1]=4 1670 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [0,0,1,0,0,0|2,0,1]=4 1671 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [0,0,1,0,0,0|2,0,1]=4 1672 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [0,0,1,0,0,0|3,0,0]=4 1673 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [0,0,1,0,0,0|3,0,0]=4 1674 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [0,0,1,0,0,0|3,0,0]=4 1675 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [0,0,1,0,0,0|3,0,0]=4 1676 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [0,0,1,0,0,0|3,0,0]=4 1677 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [0,0,1,0,0,0|3,0,0]=4 1678 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [0,0,1,0,0,0|3,0,0]=4 1679 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [0,0,1,0,0,0|2,0,0]=3 1680 B10R1.15 C\C=C(/C)c1ccncc1 Amb24103190 [0,0,1,0,0,0|3,0,0]=4 1681 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [0,0,1,0,0,0|2,0,0]=3 1682 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [0,0,1,0,0,0|2,0,0]=3 1683 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [0,0,1,0,0,0|2,0,0]=3 1684 B10R1.15 C\C=C(\C)c1cccnc1 Amb27260271 [0,0,1,0,0,0|3,0,0]=4 1685 B10R1.15 C\N=C(/N)c1cccnc1 Amb21970335 [0,0,1,0,0,0|3,0,0]=4 1686 B10R1.15 C\N=C(\C)c1ccccn1 Amb24433259 [0,0,1,0,0,0|3,0,0]=4 1687 B10R1.15 C\N=C(\N)c1cccnc1 Amb28555473 [0,0,1,0,0,0|3,0,0]=4 1688 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [0,0,1,0,0,0|3,0,0]=4 1689 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [0,0,1,0,0,0|2,0,0]=3 1690 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [0,0,1,0,0,0|3,0,0]=4 1691 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [0,0,1,0,0,0|2,0,0]=3 1692 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,1,0,0,0|2,0,0]=3 1693 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,0,1,0,0,0|2,0,0]=3 1694 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [0,0,1,0,0,0|3,0,0]=4 1695 B10R1.15 NCC(=O)c1ccccn1 Amb18832469 [0,0,1,0,0,0|3,0,0]=4 1696 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [0,0,1,0,0,0|3,0,0]=4 1697 B10R1.15 NCC(=O)c1cccnc1 Amb22277079 [0,0,1,0,0,0|3,0,0]=4 1698 B10R1.15 NCC(=O)c1cccnc1 Amb22754018 [0,0,1,0,0,0|3,0,0]=4 1699 B10R1.15 NCC(=O)c1ccncc1 Amb18832471 [0,0,1,0,0,0|3,0,0]=4 1700 B10R1.15 NCC(=O)c1ccncc1 Amb22002046 [0,0,1,0,0,0|3,0,0]=4 1701 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [0,0,1,0,0,0|3,0,0]=4 1702 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,1,0,0,0|2,0,0]=3 1703 B10R1.15 NNC(=O)c1ccccn1 Amb1208395 [0,0,1,0,0,0|3,0,0]=4 1704 B10R1.15 NNC(=O)c1cccnc1 Amb1786962 [0,0,1,0,0,0|3,0,0]=4 1705 B10R1.15 NNC(=O)c1ccncc1 Amb6335257 [0,0,1,0,0,0|3,0,0]=4 1706 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [0,0,1,0,0,0|2,1,0]=4 1707 B10R1.15 NNS(=O)c1ccccc1 Amb27428863 [0,0,1,0,0,0|3,0,0]=4 1708 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [0,0,1,0,0,0|3,0,0]=4 1709 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [0,0,1,0,0,0|3,0,0]=4 1710 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [0,0,1,0,0,0|3,0,0]=4 1711 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [0,0,1,0,0,0|3,0,0]=4 1712 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [0,0,1,0,0,0|3,0,0]=4 1713 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [0,0,1,0,0,0|3,0,0]=4 1714 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,0,1,0,0,0|2,0,0]=3 1715 B10R1.15 O=C(CBr)c1ccccn1 Amb1980867 [0,0,1,0,0,0|3,0,0]=4 1716 B10R1.15 O=C(CBr)c1ccccn1 Amb2684941 [0,0,1,0,0,0|3,0,0]=4 1717 B10R1.15 O=C(CBr)c1cccnc1 Amb1981330 [0,0,1,0,0,0|3,0,0]=4 1718 B10R1.15 O=C(CBr)c1cccnc1 Amb2684942 [0,0,1,0,0,0|3,0,0]=4 1719 B10R1.15 O=C(CBr)c1ccncc1 Amb1981329 [0,0,1,0,0,0|3,0,0]=4 1720 B10R1.15 O=C(CBr)c1ccncc1 Amb2684943 [0,0,1,0,0,0|3,0,0]=4 1721 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,0,1,0,0,0|2,0,0]=3 1722 B10R1.15 O=C(CCl)c1ccccn1 Amb33329358 [0,0,1,0,0,0|3,0,0]=4 1723 B10R1.15 O=C(CCl)c1ccccn1 Amb33545115 [0,0,1,0,0,0|3,0,0]=4 1724 B10R1.15 O=C(CCl)c1cccnc1 Amb22371841 [0,0,1,0,0,0|3,0,0]=4 1725 B10R1.15 O=C(CCl)c1cccnc1 Amb7172585 [0,0,1,0,0,0|3,0,0]=4 1726 B10R1.15 O=C(CCl)c1ccncc1 Amb22371842 [0,0,1,0,0,0|3,0,0]=4 1727 B10R1.15 O=C(CCl)c1ccncc1 Amb3319289 [0,0,1,0,0,0|3,0,0]=4 1728 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,0,1,0,0,0|2,0,0]=3 1729 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,1,0,0,0|2,0,0]=3 1730 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,0,1,0,0,0|2,0,0]=3 1731 B10R1.15 O=C(CO)c1ccccn1 Amb18063640 [0,0,1,0,0,0|3,0,0]=4 1732 B10R1.15 O=C(CO)c1cccnc1 Amb18063681 [0,0,1,0,0,0|3,0,0]=4 1733 B10R1.15 O=C(CO)c1ccncc1 Amb18063686 [0,0,1,0,0,0|3,0,0]=4 1734 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,0,1,0,0,0|2,0,0]=3 1735 B10R1.15 O=C(NCl)c1cccnc1 Amb26039027 [0,0,1,0,0,0|3,0,0]=4 1736 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [0,0,1,0,0,0|2,0,0]=3 1737 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [0,0,1,0,0,0|2,0,0]=3 1738 B10R1.15 O=C(NO)c1ccccn1 Amb6268699 [0,0,1,0,0,0|3,0,0]=4 1739 B10R1.15 O=C(NO)c1cccnc1 Amb33532633 [0,0,1,0,0,0|3,0,0]=4 1740 B10R1.15 O=C(NO)c1ccncc1 Amb6270440 [0,0,1,0,0,0|3,0,0]=4 1741 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [0,0,1,0,0,0|2,0,0]=3 1742 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [0,0,1,0,0,0|2,0,0]=3 1743 B10R1.15 O=C(OCl)c1cnccn1 Amb27776207 [0,0,1,0,0,0|3,0,0]=4 1744 B10R1.15 O=C(OO)c1cccnc1 Amb24094187 [0,0,1,0,0,0|2,0,0]=3 1745 B10R1.15 O=C(OO)c1ccncc1 Amb24066209 [0,0,1,0,0,0|2,0,0]=3 1746 B10R1.15 O=C(O[K])c1cccnc1 Amb3150242 [0,0,1,0,0,0|2,0,0]=3 1747 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [0,0,1,0,0,0|2,0,0]=3 1748 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [0,0,1,0,0,0|2,0,0]=3 1749 B10R1.15 O=CC(=O)c1ccccn1 Amb25066902 [0,0,1,0,0,0|3,0,0]=4 1750 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [0,0,1,0,0,0|3,0,0]=4 1751 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [0,0,1,0,0,0|3,0,0]=4 1752 B10R1.15 O=S(O[Na])c1ccccc1 Amb6365754 [0,0,1,0,0,0|2,0,0]=3 1753 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [0,0,1,0,0,0|3,0,0]=4 1754 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [0,0,1,0,0,0|3,0,0]=4 1755 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [0,0,1,0,0,0|2,0,1]=4 1756 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [0,0,1,0,0,0|2,1,0]=4 1757 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,0,1,0,0,0|2,0,0]=3 1758 B10R1.16 C=CCNC1=CC(=O)CC1 Amb28437148 [0,0,1,0,0,0|2,0,1]=4 1759 B10R1.16 Cc1cc(\C=C\C=O)no1 Amb33316704 [0,0,1,0,0,0|3,0,0]=4 1760 B10R1.16 O=C\C=C/C1=CC(=O)OC1 Amb18643212 [0,0,1,0,0,0|1,0,0]=2 1761 B10R1.17 BrCCCc1ccccc1 Amb2721516 [0,0,1,0,0,0|2,0,1]=4 1762 B10R1.17 BrCOCc1ccccc1 Amb27410470 [0,0,1,0,0,0|1,0,1]=3 1763 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,1,0,0,0|3,0,0]=4 1764 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,0,1,0,0,0|2,0,0]=3 1765 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [0,0,1,0,0,0|3,0,0]=4 1766 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [0,0,1,0,0,0|3,0,0]=4 1767 B10R1.17 C#CCCc1ccccc1 Amb6336492 [0,0,1,0,0,0|2,0,1]=4 1768 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,1,0,0,0|2,0,1]=4 1769 B10R1.17 C=CCCc1ccccc1 Amb2721241 [0,0,1,0,0,0|2,0,0]=3 1770 B10R1.17 C=CCCc1ccccn1 Amb25337662 [0,0,1,0,0,0|3,0,0]=4 1771 B10R1.17 C=CCCc1cccnc1 Amb24477186 [0,0,1,0,0,0|3,0,0]=4 1772 B10R1.17 C=CCNc1ccccc1 Amb2720315 [0,0,1,0,0,0|3,0,0]=4 1773 B10R1.17 C=CCOc1ccccc1 Amb2842273 [0,0,1,0,0,0|3,0,0]=4 1774 B10R1.17 C=CCSc1ccccc1 Amb3836099 [0,0,1,0,0,0|3,0,0]=4 1775 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,1,0,0,0|1,0,0]=2 1776 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [0,0,1,0,0,0|2,0,1]=4 1777 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,0,1,0,0,0|2,0,1]=4 1778 B10R1.17 CCCCc1ccccc1 Amb6608912 [0,0,1,0,0,0|2,0,1]=4 1779 B10R1.17 CCNCc1ccccc1 Amb3699539 [0,0,1,0,0,0|2,0,1]=4 1780 B10R1.17 CCOCc1ccccc1 Amb9787555 [0,0,1,0,0,0|1,0,1]=3 1781 B10R1.17 CCOCc1ccccn1 Amb27267027 [0,0,1,0,0,0|2,0,1]=4 1782 B10R1.17 CCOCc1ccncc1 Amb27255285 [0,0,1,0,0,0|2,0,1]=4 1783 B10R1.17 CCOSc1ccccc1 Amb28049338 [0,0,1,0,0,0|2,0,1]=4 1784 B10R1.17 CCSCc1ccccc1 Amb9787636 [0,0,1,0,0,0|1,1,1]=4 1785 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,1,0,0,0|3,0,0]=4 1786 B10R1.17 CNCCc1ccccc1 Amb33545919 [0,0,1,0,0,0|3,0,0]=4 1787 B10R1.17 CNNCc1ccccc1 Amb26859422 [0,0,1,0,0,0|3,0,0]=4 1788 B10R1.17 CNNCc1ccccc1 Amb33328543 [0,0,1,0,0,0|3,0,0]=4 1789 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,1,0,0,0|2,0,0]=3 1790 B10R1.17 CNOCc1ccccc1 Amb32412803 [0,0,1,0,0,0|2,0,0]=3 1791 B10R1.17 COCCc1ccccc1 Amb4020014 [0,0,1,0,0,0|3,0,0]=4 1792 B10R1.17 CONCc1ccccc1 Amb26432339 [0,0,1,0,0,0|3,0,0]=4 1793 B10R1.17 CSCCc1ccccc1 Amb26586093 [0,0,1,0,0,0|3,0,0]=4 1794 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [0,0,1,0,0,0|3,0,0]=4 1795 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,0,1,0,0,0|2,0,0]=3 1796 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,1,0,0,0|3,0,0]=4 1797 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [0,0,1,0,0,0|3,0,0]=4 1798 B10R1.17 ClCCCc1ccccc1 Amb3941487 [0,0,1,0,0,0|2,0,1]=4 1799 B10R1.17 ClCOCc1ccccc1 Amb2684626 [0,0,1,0,0,0|1,0,1]=3 1800 B10R1.17 ClCOCc1ccccn1 Amb27834619 [0,0,1,0,0,0|2,0,1]=4 1801 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,1,0,0,0|1,1,1]=4 1802 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [0,0,1,0,0,0|3,0,0]=4 1803 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb2613089 [0,0,1,0,0,0|3,0,0]=4 1804 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,1,0,0,0|2,0,1]=4 1805 B10R1.17 ICOCc1ccccc1 Amb28348666 [0,0,1,0,0,0|1,0,1]=3 1806 B10R1.17 N#CCCc1ccccc1 Amb33551192 [0,0,1,0,0,0|2,0,1]=4 1807 B10R1.17 N#CNCc1ccccc1 Amb27257452 [0,0,1,0,0,0|2,0,1]=4 1808 B10R1.17 N#CSCc1ccccc1 Amb2611897 [0,0,1,0,0,0|1,1,1]=4 1809 B10R1.17 N=CC#Cc1ccccc1 Amb27848552 [0,0,1,0,0,0|2,0,1]=4 1810 B10R1.17 NCCCc1ccccc1 Amb844788 [0,0,1,0,0,0|2,0,1]=4 1811 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,1,0,0,0|3,0,0]=4 1812 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,1,0,0,0|3,0,0]=4 1813 B10R1.17 NNCCc1ccccc1 Amb33552804 [0,0,1,0,0,0|3,0,0]=4 1814 B10R1.17 NOCCc1ccccc1 Amb2899735 [0,0,1,0,0,0|3,0,0]=4 1815 B10R1.17 NOCCc1ccccc1 Amb6308543 [0,0,1,0,0,0|3,0,0]=4 1816 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [0,0,1,0,0,0|1,0,1]=3 1817 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [0,0,1,0,0,0|2,0,1]=4 1818 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [0,0,1,0,0,0|2,0,1]=4 1819 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [0,0,1,0,0,0|1,0,1]=3 1820 B10R1.17 O=CC#Cc1cccnc1 Amb25950612 [0,0,1,0,0,0|2,0,1]=4 1821 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,0,1,0,0,0|1,0,0]=2 1822 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,1,0,0,0|2,0,0]=3 1823 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,1,0,0,0|2,0,0]=3 1824 B10R1.17 O=CCCc1ccncc1 Amb8388451 [0,0,1,0,0,0|2,0,0]=3 1825 B10R1.17 O=CCCc1ccncn1 Amb26958514 [0,0,1,0,0,0|3,0,0]=4 1826 B10R1.17 O=CCCc1cnccn1 Amb25876683 [0,0,1,0,0,0|3,0,0]=4 1827 B10R1.17 O=CCCc1cncnc1 Amb24657168 [0,0,1,0,0,0|3,0,0]=4 1828 B10R1.17 O=CCCc1ncccn1 Amb24056162 [0,0,1,0,0,0|3,0,0]=4 1829 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,0,1,0,0,0|2,0,0]=3 1830 B10R1.17 O=CCOc1ccccn1 Amb27823582 [0,0,1,0,0,0|3,0,0]=4 1831 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,1,0,0,0|2,0,0]=3 1832 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,1,0,0,0|1,0,0]=2 1833 B10R1.17 O=CNCc1ccccn1 Amb22370826 [0,0,1,0,0,0|2,0,0]=3 1834 B10R1.17 O=CNCc1cccnc1 Amb2694543 [0,0,1,0,0,0|2,0,0]=3 1835 B10R1.17 O=CNCc1ncccn1 Amb27638889 [0,0,1,0,0,0|3,0,0]=4 1836 B10R1.17 O=CNNc1ccccc1 Amb2721099 [0,0,1,0,0,0|2,0,0]=3 1837 B10R1.17 O=CNNc1ccncc1 Amb26560692 [0,0,1,0,0,0|3,0,0]=4 1838 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,0,1,0,0,0|0,0,0]=1 1839 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,0,1,0,0,0|1,0,0]=2 1840 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,1,0,0,0|1,0,1]=3 1841 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [0,0,1,0,0,0|1,0,1]=3 1842 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [0,0,1,0,0,0|2,0,1]=4 1843 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [0,0,1,0,0,0|2,0,1]=4 1844 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [0,0,1,0,0,0|2,0,1]=4 1845 B10R1.17 OCCCc1ccccc1 Amb3939054 [0,0,1,0,0,0|1,0,2]=4 1846 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,1,0,0,0|0,0,2]=3 1847 B10R1.17 OCSCc1ccccc1 Amb27839241 [0,0,1,0,0,0|0,1,2]=4 1848 B10R1.17 ONCCc1ccccc1 Amb33544180 [0,0,1,0,0,0|2,0,1]=4 1849 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [0,0,1,0,0,0|2,0,1]=4 1850 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,1,0,0,0|1,1,1]=4 1851 B10R1.17 SCCCc1ccccc1 Amb6255807 [0,0,1,0,0,0|1,1,1]=4 1852 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,1,0,0,0|3,0,0]=4 1853 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [0,0,1,0,0,0|3,0,0]=4 1854 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,1,0,0,0|2,0,1]=4 1855 B10R1.20 BrCc1ccccc1CBr Amb3940203 [0,0,1,0,0,0|2,0,1]=4 1856 B10R1.20 C#Cc1ccccc1C=C Amb24589634 [0,0,1,0,0,0|2,0,1]=4 1857 B10R1.20 C#Cc1ccccc1C=O Amb10070109 [0,0,1,0,0,0|1,0,1]=3 1858 B10R1.20 C#Cc1ccccc1CBr Amb20620864 [0,0,1,0,0,0|2,0,1]=4 1859 B10R1.20 C#Cc1ccccc1CC Amb19944513 [0,0,1,0,0,0|2,0,1]=4 1860 B10R1.20 C#Cc1ccccc1CCl Amb25934165 [0,0,1,0,0,0|2,0,1]=4 1861 B10R1.20 C#Cc1ccccc1CN Amb22494657 [0,0,1,0,0,0|2,0,1]=4 1862 B10R1.20 C#Cc1ccccc1CO Amb22337205 [0,0,1,0,0,0|1,0,1]=3 1863 B10R1.20 C#Cc1ccccc1CS Amb33373851 [0,0,1,0,0,0|1,1,1]=4 1864 B10R1.20 C#Cc1cccnc1C=O Amb28050204 [0,0,1,0,0,0|2,0,1]=4 1865 B10R1.20 C#Cc1cccnc1CO Amb28197611 [0,0,1,0,0,0|2,0,1]=4 1866 B10R1.20 C#Cc1ccncc1C=O Amb26458729 [0,0,1,0,0,0|2,0,1]=4 1867 B10R1.20 C#Cc1cnccc1CO Amb24479326 [0,0,1,0,0,0|2,0,1]=4 1868 B10R1.20 C#Cc1ncccc1C=O Amb24571192 [0,0,1,0,0,0|2,0,1]=4 1869 B10R1.20 C#Cc1ncccc1CO Amb24479260 [0,0,1,0,0,0|2,0,1]=4 1870 B10R1.20 C=C=C1C=CC=C\C1=C\O Amb24480633 [0,0,1,0,0,0|1,0,2]=4 1871 B10R1.20 C=Cc1ccccc1C#N Amb17593361 [0,0,1,0,0,0|2,0,1]=4 1872 B10R1.20 C=Cc1ccccc1C=C Amb17689476 [0,0,1,0,0,0|2,0,1]=4 1873 B10R1.20 C=Cc1ccccc1C=O Amb18124354 [0,0,1,0,0,0|1,0,1]=3 1874 B10R1.20 C=Cc1ccccc1CBr Amb17674261 [0,0,1,0,0,0|2,0,0]=3 1875 B10R1.20 C=Cc1ccccc1CC Amb8394031 [0,0,1,0,0,0|2,0,0]=3 1876 B10R1.20 C=Cc1ccccc1CN Amb27798696 [0,0,1,0,0,0|2,0,0]=3 1877 B10R1.20 C=Cc1ccccc1CO Amb22899778 [0,0,1,0,0,0|1,0,0]=2 1878 B10R1.20 C=Cc1ccccc1NC Amb22751065 [0,0,1,0,0,0|3,0,0]=4 1879 B10R1.20 C=Cc1ccccc1SC Amb24667723 [0,0,1,0,0,0|3,0,0]=4 1880 B10R1.20 C=Cc1cccnc1C=O Amb27755829 [0,0,1,0,0,0|2,0,1]=4 1881 B10R1.20 C=Cc1cccnc1CC Amb27945545 [0,0,1,0,0,0|3,0,0]=4 1882 B10R1.20 C=Cc1cccnc1CO Amb26494523 [0,0,1,0,0,0|2,0,0]=3 1883 B10R1.20 C=Cc1ccncc1C=O Amb24479320 [0,0,1,0,0,0|2,0,1]=4 1884 B10R1.20 C=Cc1ccncc1CCl Amb24479525 [0,0,1,0,0,0|3,0,0]=4 1885 B10R1.20 C=Cc1ccncc1CO Amb26347965 [0,0,1,0,0,0|2,0,0]=3 1886 B10R1.20 C=Cc1cnccc1C=O Amb24462934 [0,0,1,0,0,0|2,0,1]=4 1887 B10R1.20 C=Cc1cnccc1CC Amb28068933 [0,0,1,0,0,0|3,0,0]=4 1888 B10R1.20 C=Cc1cnccc1CO Amb28364361 [0,0,1,0,0,0|2,0,0]=3 1889 B10R1.20 CCc1ccccc1C#N Amb2687777 [0,0,1,0,0,0|2,0,1]=4 1890 B10R1.20 CCc1ccccc1C=O Amb3941572 [0,0,1,0,0,0|1,0,0]=2 1891 B10R1.20 CCc1ccccc1CBr Amb18330955 [0,0,1,0,0,0|2,0,1]=4 1892 B10R1.20 CCc1ccccc1CC Amb10842201 [0,0,1,0,0,0|2,0,1]=4 1893 B10R1.20 CCc1ccccc1CCl Amb17470396 [0,0,1,0,0,0|2,0,1]=4 1894 B10R1.20 CCc1ccccc1CN Amb17470370 [0,0,1,0,0,0|2,0,1]=4 1895 B10R1.20 CCc1ccccc1CO Amb9826072 [0,0,1,0,0,0|1,0,1]=3 1896 B10R1.20 CCc1ccccc1CS Amb24465267 [0,0,1,0,0,0|1,1,1]=4 1897 B10R1.20 CCc1ccccc1NC Amb6713224 [0,0,1,0,0,0|3,0,0]=4 1898 B10R1.20 CCc1ccccc1NN Amb17767382 [0,0,1,0,0,0|3,0,0]=4 1899 B10R1.20 CCc1ccccc1NN Amb2234480 [0,0,1,0,0,0|3,0,0]=4 1900 B10R1.20 CCc1ccccc1OC Amb6296210 [0,0,1,0,0,0|3,0,0]=4 1901 B10R1.20 CCc1ccccc1ON Amb24480929 [0,0,1,0,0,0|3,0,0]=4 1902 B10R1.20 CCc1ccccc1SC Amb24376653 [0,0,1,0,0,0|3,0,0]=4 1903 B10R1.20 CCc1ccccc1[Mg]Br Amb6300437 [0,0,1,0,0,0|3,0,0]=4 1904 B10R1.20 CCc1ccccc1[Zn]I Amb22000449 [0,0,1,0,0,0|3,0,0]=4 1905 B10R1.20 CCc1cccnc1CO Amb28047686 [0,0,1,0,0,0|2,0,1]=4 1906 B10R1.20 CCc1ccncc1C=O Amb18203105 [0,0,1,0,0,0|2,0,0]=3 1907 B10R1.20 CCc1ncccc1CO Amb24437893 [0,0,1,0,0,0|2,0,1]=4 1908 B10R1.20 CNc1ccccc1C=O Amb18124457 [0,0,1,0,0,0|2,0,0]=3 1909 B10R1.20 CNc1ccccc1CN Amb18958547 [0,0,1,0,0,0|3,0,0]=4 1910 B10R1.20 CNc1ccccc1CO Amb8389944 [0,0,1,0,0,0|2,0,0]=3 1911 B10R1.20 CNc1ccccc1CS Amb27646108 [0,0,1,0,0,0|2,1,0]=4 1912 B10R1.20 CNc1cccnc1C=O Amb27268644 [0,0,1,0,0,0|3,0,0]=4 1913 B10R1.20 CNc1ccncc1CO Amb26600198 [0,0,1,0,0,0|3,0,0]=4 1914 B10R1.20 CNc1cnccc1C=O Amb22750826 [0,0,1,0,0,0|3,0,0]=4 1915 B10R1.20 CNc1cnccc1CO Amb27265568 [0,0,1,0,0,0|3,0,0]=4 1916 B10R1.20 CNc1ncccc1C=O Amb22586770 [0,0,1,0,0,0|3,0,0]=4 1917 B10R1.20 CNc1ncccc1C=O Amb2721809 [0,0,1,0,0,0|3,0,0]=4 1918 B10R1.20 CNc1ncccc1CO Amb2795551 [0,0,1,0,0,0|3,0,0]=4 1919 B10R1.20 COc1ccccc1C=O Amb1880863 [0,0,1,0,0,0|2,0,0]=3 1920 B10R1.20 COc1ccccc1CBr Amb8835463 [0,0,1,0,0,0|3,0,0]=4 1921 B10R1.20 COc1ccccc1CCl Amb3939729 [0,0,1,0,0,0|3,0,0]=4 1922 B10R1.20 COc1ccccc1CN Amb19958154 [0,0,1,0,0,0|3,0,0]=4 1923 B10R1.20 COc1ccccc1CN Amb932836 [0,0,1,0,0,0|3,0,0]=4 1924 B10R1.20 COc1ccccc1CO Amb2793149 [0,0,1,0,0,0|2,0,0]=3 1925 B10R1.20 COc1ccccc1CS Amb17399984 [0,0,1,0,0,0|2,1,0]=4 1926 B10R1.20 COc1cccnc1C=O Amb8010840 [0,0,1,0,0,0|3,0,0]=4 1927 B10R1.20 COc1cccnc1CO Amb10603147 [0,0,1,0,0,0|3,0,0]=4 1928 B10R1.20 COc1ccncc1C=O Amb8010905 [0,0,1,0,0,0|3,0,0]=4 1929 B10R1.20 COc1ccncc1CO Amb23401172 [0,0,1,0,0,0|3,0,0]=4 1930 B10R1.20 COc1cnccc1C=O Amb21964576 [0,0,1,0,0,0|3,0,0]=4 1931 B10R1.20 COc1cnccc1CO Amb23401173 [0,0,1,0,0,0|3,0,0]=4 1932 B10R1.20 COc1ncccc1C=O Amb4561135 [0,0,1,0,0,0|3,0,0]=4 1933 B10R1.20 COc1ncccc1CO Amb10975545 [0,0,1,0,0,0|3,0,0]=4 1934 B10R1.20 CSc1ccccc1C=O Amb4007735 [0,0,1,0,0,0|2,0,0]=3 1935 B10R1.20 CSc1ccccc1CBr Amb27248235 [0,0,1,0,0,0|3,0,0]=4 1936 B10R1.20 CSc1ccccc1CCl Amb5722854 [0,0,1,0,0,0|3,0,0]=4 1937 B10R1.20 CSc1ccccc1CN Amb2724691 [0,0,1,0,0,0|3,0,0]=4 1938 B10R1.20 CSc1ccccc1CO Amb1398891 [0,0,1,0,0,0|2,0,0]=3 1939 B10R1.20 CSc1ccccc1CS Amb32876636 [0,0,1,0,0,0|2,1,0]=4 1940 B10R1.20 CSc1cccnc1C=O Amb18644575 [0,0,1,0,0,0|3,0,0]=4 1941 B10R1.20 CSc1ccncc1C=O Amb18644574 [0,0,1,0,0,0|3,0,0]=4 1942 B10R1.20 CSc1cnccc1C=O Amb24480462 [0,0,1,0,0,0|3,0,0]=4 1943 B10R1.20 CSc1ncccc1CO Amb24329376 [0,0,1,0,0,0|3,0,0]=4 1944 B10R1.20 ClCc1ccccc1CCl Amb2609431 [0,0,1,0,0,0|2,0,1]=4 1945 B10R1.20 FCc1ccccc1CBr Amb24757121 [0,0,1,0,0,0|2,0,1]=4 1946 B10R1.20 ICc1ccccc1CI Amb28123979 [0,0,1,0,0,0|2,0,1]=4 1947 B10R1.20 N#Cc1ccccc1C=O Amb3939853 [0,0,1,0,0,0|1,0,1]=3 1948 B10R1.20 N#Cc1ccccc1CBr Amb6364710 [0,0,1,0,0,0|2,0,1]=4 1949 B10R1.20 N#Cc1ccccc1CCl Amb1625494 [0,0,1,0,0,0|2,0,1]=4 1950 B10R1.20 N#Cc1ccccc1CF Amb27812215 [0,0,1,0,0,0|2,0,1]=4 1951 B10R1.20 N#Cc1ccccc1CI Amb26460053 [0,0,1,0,0,0|2,0,1]=4 1952 B10R1.20 N#Cc1ccccc1CN Amb6298722 [0,0,1,0,0,0|2,0,1]=4 1953 B10R1.20 N#Cc1ccccc1CO Amb8855280 [0,0,1,0,0,0|1,0,1]=3 1954 B10R1.20 N#Cc1ccccc1CS Amb17498636 [0,0,1,0,0,0|1,1,1]=4 1955 B10R1.20 N#Cc1cccnc1C=O Amb18832523 [0,0,1,0,0,0|2,0,1]=4 1956 B10R1.20 N#Cc1ccncc1C=O Amb21857117 [0,0,1,0,0,0|2,0,1]=4 1957 B10R1.20 N#Cc1ccncc1CO Amb18124410 [0,0,1,0,0,0|2,0,1]=4 1958 B10R1.20 N#Cc1ncccc1C=O Amb8386283 [0,0,1,0,0,0|2,0,1]=4 1959 B10R1.20 N#Cc1ncccc1CO Amb6307646 [0,0,1,0,0,0|2,0,1]=4 1960 B10R1.20 NCc1ccccc1C=O Amb6298662 [0,0,1,0,0,0|1,0,0]=2 1961 B10R1.20 NCc1ccccc1CBr Amb22500530 [0,0,1,0,0,0|2,0,1]=4 1962 B10R1.20 NCc1ccccc1CCl Amb18125910 [0,0,1,0,0,0|2,0,1]=4 1963 B10R1.20 NCc1ccccc1CN Amb10576322 [0,0,1,0,0,0|2,0,1]=4 1964 B10R1.20 NCc1ccccc1CN Amb6739879 [0,0,1,0,0,0|2,0,1]=4 1965 B10R1.20 NCc1ccccc1CO Amb22494785 [0,0,1,0,0,0|1,0,1]=3 1966 B10R1.20 NCc1ccccc1CO Amb6739960 [0,0,1,0,0,0|1,0,1]=3 1967 B10R1.20 NCc1ccccc1NN Amb28132659 [0,0,1,0,0,0|3,0,0]=4 1968 B10R1.20 NNc1ccccc1C=O Amb18643074 [0,0,1,0,0,0|2,0,0]=3 1969 B10R1.20 NNc1ccccc1CBr Amb27613734 [0,0,1,0,0,0|3,0,0]=4 1970 B10R1.20 NNc1ccccc1CCl Amb27964616 [0,0,1,0,0,0|3,0,0]=4 1971 B10R1.20 NNc1ccccc1CO Amb27469533 [0,0,1,0,0,0|2,0,0]=3 1972 B10R1.20 NNc1ncccc1CO Amb27949894 [0,0,1,0,0,0|3,0,0]=4 1973 B10R1.20 O=C=C1C=CC=C\C1=C\O Amb28322716 [0,0,1,0,0,0|0,0,2]=3 1974 B10R1.20 O=Cc1ccccc1C=O Amb535689 [0,0,1,0,0,0|0,0,2]=3 1975 B10R1.20 O=Cc1ccccc1CBr Amb26405182 [0,0,1,0,0,0|1,0,0]=2 1976 B10R1.20 O=Cc1ccccc1CF Amb27770451 [0,0,1,0,0,0|1,0,0]=2 1977 B10R1.20 O=Cc1ccccc1CO Amb18643059 [0,0,1,0,0,0|0,0,0]=1 1978 B10R1.20 O=Cc1ccccc1N=O Amb17593428 [0,0,1,0,0,0|1,0,1]=3 1979 B10R1.20 O=Cc1cnccc1CCl Amb27174864 [0,0,1,0,0,0|2,0,0]=3 1980 B10R1.20 O=Cc1ncccc1CBr Amb27831021 [0,0,1,0,0,0|2,0,0]=3 1981 B10R1.20 O=Cc1ncccc1CCl Amb27751856 [0,0,1,0,0,0|2,0,0]=3 1982 B10R1.20 O=Cc1ncccc1CO Amb22754917 [0,0,1,0,0,0|1,0,0]=2 1983 B10R1.20 O=Nc1ccccc1CO Amb17593472 [0,0,1,0,0,0|1,0,0]=2 1984 B10R1.20 OCc1ccccc1CBr Amb22235289 [0,0,1,0,0,0|1,0,1]=3 1985 B10R1.20 OCc1ccccc1CO Amb8387731 [0,0,1,0,0,0|0,0,2]=3 1986 B10R1.20 OCc1ccccc1NO Amb27836150 [0,0,1,0,0,0|1,0,1]=3 1987 B10R1.20 OCc1ccccc1SO Amb27839336 [0,0,1,0,0,0|1,0,1]=3 1988 B10R1.20 OCc1cccnc1CO Amb19958106 [0,0,1,0,0,0|1,0,2]=4 1989 B10R1.20 OCc1cccnc1CO Amb20240787 [0,0,1,0,0,0|1,0,2]=4 1990 B10R1.20 OCc1ccncc1CO Amb22406292 [0,0,1,0,0,0|1,0,2]=4 1991 B10R1.20 OCc1ccncc1CO Amb29083311 [0,0,1,0,0,0|1,0,2]=4 1992 B10R1.20 OCc1ncccc1CBr Amb27794371 [0,0,1,0,0,0|2,0,1]=4 1993 B10R1.20 SCc1ccccc1CS Amb17779777 [0,0,1,0,0,0|0,2,1]=4 1994 B10R1.20 [C-]#[N+]c1ccccc1C=O Amb28074653 [0,0,1,0,0,0|2,0,0]=3 1995 B10R1.20 [C-]#[N+]c1ccccc1CC Amb2235911 [0,0,1,0,0,0|3,0,0]=4 1996 B10R1.20 [C-]#[N+]c1ccccc1CI Amb27808668 [0,0,1,0,0,0|3,0,0]=4 1997 B10R1.20 [SiH3]Oc1ccccc1CBr Amb27597062 [0,0,1,0,0,0|3,0,0]=4 1998 B10R1.29 C=CCCC1=CCCC1=O Amb27959467 [0,0,1,0,0,0|1,0,2]=4 1999 B10R1.29 C=CCOC1=CCCC1=O Amb28194672 [0,0,1,0,0,0|2,0,1]=4 2000 B10R1.29 C=C\C=C\N1CCCC1=O Amb27263091 [0,0,1,0,0,0|2,0,1]=4 2001 B10R1.29 C=C\C=C\N1CCOC1=O Amb27483591 [0,0,1,0,0,0|1,0,1]=3 2002 B10R1.29 Cc1occc1\C=C\C=O Amb33358783 [0,0,1,0,0,0|2,0,1]=4 2003 B10R1.29 Cc1oncc1\C=C\C=O Amb33361406 [0,0,1,0,0,0|3,0,0]=4 2004 B10R1.61 C=C(Br)c1ccccc1C Amb27449132 [0,0,1,0,0,0|2,0,0]=3 2005 B10R1.61 C=C(C)c1ccccc1Br Amb25797043 [0,0,1,0,0,0|3,0,0]=4 2006 B10R1.61 C=C(C)c1ccccc1C Amb22043466 [0,0,1,0,0,0|2,0,0]=3 2007 B10R1.61 C=C(C)c1ccccc1Cl Amb24720539 [0,0,1,0,0,0|3,0,0]=4 2008 B10R1.61 C=C(C)c1ccccc1F Amb27838932 [0,0,1,0,0,0|3,0,0]=4 2009 B10R1.61 C=C(C)c1ccccc1N Amb3940451 [0,0,1,0,0,0|3,0,0]=4 2010 B10R1.61 C=C(C)c1ccccc1O Amb18124426 [0,0,1,0,0,0|3,0,0]=4 2011 B10R1.61 C=C(C)c1cccnc1C Amb26012595 [0,0,1,0,0,0|3,0,0]=4 2012 B10R1.61 C=C(C)c1ccncc1C Amb32641687 [0,0,1,0,0,0|3,0,0]=4 2013 B10R1.61 C=C(C)c1cnccc1C Amb32641669 [0,0,1,0,0,0|3,0,0]=4 2014 B10R1.61 C=C(C)c1ncccc1C Amb32641671 [0,0,1,0,0,0|3,0,0]=4 2015 B10R1.61 C=C(Cl)c1ncccc1C Amb27642806 [0,0,1,0,0,0|3,0,0]=4 2016 B10R1.61 CC(=O)C1=CC=CNC1=O Amb18263217 [0,0,1,0,0,0|3,0,0]=4 2017 B10R1.61 CC(=O)C1=CC=COC1=O Amb26018895 [0,0,1,0,0,0|3,0,0]=4 2018 B10R1.61 CC(=O)C1=CCC=CN1C Amb27816898 [0,0,1,0,0,0|2,0,1]=4 2019 B10R1.61 CC(=O)C1=CNC=CC1=O Amb22522167 [0,0,1,0,0,0|3,0,0]=4 2020 B10R1.61 CC(=O)c1cccc[n+]1C Amb32455992 [0,0,1,0,0,0|2,0,0]=3 2021 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [0,0,1,0,0,0|2,0,0]=3 2022 B10R1.61 CC(=O)c1ccccc1C Amb2792441 [0,0,1,0,0,0|1,0,0]=2 2023 B10R1.61 CC(=O)c1ccccc1Cl Amb2685746 [0,0,1,0,0,0|2,0,0]=3 2024 B10R1.61 CC(=O)c1ccccc1F Amb2688005 [0,0,1,0,0,0|2,0,0]=3 2025 B10R1.61 CC(=O)c1ccccc1I Amb8517635 [0,0,1,0,0,0|2,0,0]=3 2026 B10R1.61 CC(=O)c1ccccc1N Amb2725478 [0,0,1,0,0,0|2,0,0]=3 2027 B10R1.61 CC(=O)c1ccccc1N Amb6296708 [0,0,1,0,0,0|2,0,0]=3 2028 B10R1.61 CC(=O)c1ccccc1O Amb2792764 [0,0,1,0,0,0|2,0,0]=3 2029 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [0,0,1,0,0,0|2,0,0]=3 2030 B10R1.61 CC(=O)c1cccnc1Br Amb10602206 [0,0,1,0,0,0|3,0,0]=4 2031 B10R1.61 CC(=O)c1cccnc1C Amb18832502 [0,0,1,0,0,0|2,0,0]=3 2032 B10R1.61 CC(=O)c1cccnc1Cl Amb6384399 [0,0,1,0,0,0|3,0,0]=4 2033 B10R1.61 CC(=O)c1cccnc1F Amb2447597 [0,0,1,0,0,0|3,0,0]=4 2034 B10R1.61 CC(=O)c1cccnc1N Amb6384452 [0,0,1,0,0,0|3,0,0]=4 2035 B10R1.61 CC(=O)c1cccnc1O Amb18832396 [0,0,1,0,0,0|3,0,0]=4 2036 B10R1.61 CC(=O)c1ccncc1Br Amb21858252 [0,0,1,0,0,0|3,0,0]=4 2037 B10R1.61 CC(=O)c1ccncc1C Amb25757892 [0,0,1,0,0,0|2,0,0]=3 2038 B10R1.61 CC(=O)c1ccncc1Cl Amb22494032 [0,0,1,0,0,0|3,0,0]=4 2039 B10R1.61 CC(=O)c1ccncc1F Amb10603317 [0,0,1,0,0,0|3,0,0]=4 2040 B10R1.61 CC(=O)c1ccncc1I Amb24638217 [0,0,1,0,0,0|3,0,0]=4 2041 B10R1.61 CC(=O)c1ccncc1N Amb29083603 [0,0,1,0,0,0|3,0,0]=4 2042 B10R1.61 CC(=O)c1ccncc1N Amb8386717 [0,0,1,0,0,0|3,0,0]=4 2043 B10R1.61 CC(=O)c1ccncc1O Amb18643112 [0,0,1,0,0,0|3,0,0]=4 2044 B10R1.61 CC(=O)c1ccncc1S Amb27215298 [0,0,1,0,0,0|3,0,0]=4 2045 B10R1.61 CC(=O)c1cnccc1Br Amb26868083 [0,0,1,0,0,0|3,0,0]=4 2046 B10R1.61 CC(=O)c1cnccc1C Amb21964244 [0,0,1,0,0,0|2,0,0]=3 2047 B10R1.61 CC(=O)c1cnccc1C Amb3319273 [0,0,1,0,0,0|2,0,0]=3 2048 B10R1.61 CC(=O)c1cnccc1Cl Amb27405519 [0,0,1,0,0,0|3,0,0]=4 2049 B10R1.61 CC(=O)c1cnccc1F Amb22233738 [0,0,1,0,0,0|3,0,0]=4 2050 B10R1.61 CC(=O)c1cnccc1N Amb23401918 [0,0,1,0,0,0|3,0,0]=4 2051 B10R1.61 CC(=O)c1cncnc1C Amb23399587 [0,0,1,0,0,0|3,0,0]=4 2052 B10R1.61 CC(=O)c1ncccc1Br Amb19959407 [0,0,1,0,0,0|3,0,0]=4 2053 B10R1.61 CC(=O)c1ncccc1C Amb10067752 [0,0,1,0,0,0|2,0,0]=3 2054 B10R1.61 CC(=O)c1ncccc1Cl Amb22233858 [0,0,1,0,0,0|3,0,0]=4 2055 B10R1.61 CC(=O)c1ncccc1F Amb8396921 [0,0,1,0,0,0|3,0,0]=4 2056 B10R1.61 CC(=O)c1ncccc1I Amb23402738 [0,0,1,0,0,0|3,0,0]=4 2057 B10R1.61 CC(=O)c1ncccc1N Amb2695009 [0,0,1,0,0,0|3,0,0]=4 2058 B10R1.61 CC(=O)c1ncccc1O Amb16233269 [0,0,1,0,0,0|3,0,0]=4 2059 B10R1.61 CC(=O)c1nccnc1C Amb2684259 [0,0,1,0,0,0|3,0,0]=4 2060 B10R1.61 CC(=S)c1ccccc1I Amb28315750 [0,0,1,0,0,0|2,1,0]=4 2061 B10R1.61 CC(O)c1cccc[n+]1C Amb4011603 [0,0,1,0,0,0|2,0,1]=4 2062 B10R1.61 CC(O)c1ccccc1Br Amb4020060 [0,0,1,0,0,0|2,0,1]=4 2063 B10R1.61 CC(O)c1ccccc1Cl Amb6296141 [0,0,1,0,0,0|2,0,1]=4 2064 B10R1.61 CC(O)c1ccccc1F Amb9748272 [0,0,1,0,0,0|2,0,1]=4 2065 B10R1.61 CC(O)c1ccccc1N Amb10609794 [0,0,1,0,0,0|2,0,1]=4 2066 B10R1.61 CC(O)c1ccccc1O Amb6705780 [0,0,1,0,0,0|2,0,1]=4 2067 B10R1.61 CC1=C(C(=O)O)SC=CO1 Amb24480390 [0,0,1,0,0,0|2,0,0]=3 2068 B10R1.61 CC1=CCC=CC1C(=O)O Amb3940519 [0,0,1,0,0,0|0,0,2]=3 2069 B10R1.61 CN1C=CCC=C1C(N)=O Amb27238003 [0,0,1,0,0,0|2,0,1]=4 2070 B10R1.61 CS(=O)c1ccccc1Br Amb19891620 [0,0,1,0,0,0|3,0,0]=4 2071 B10R1.61 CS(=O)c1ccccc1F Amb10839323 [0,0,1,0,0,0|3,0,0]=4 2072 B10R1.61 CS(=O)c1ccccc1I Amb19930098 [0,0,1,0,0,0|3,0,0]=4 2073 B10R1.61 CS(=O)c1ccccc1N Amb18945203 [0,0,1,0,0,0|3,0,0]=4 2074 B10R1.61 CS(=O)c1ccccc1O Amb2420338 [0,0,1,0,0,0|3,0,0]=4 2075 B10R1.61 C[C@@H](O)c1ccccc1Br Amb8517146 [0,0,1,0,0,0|2,0,1]=4 2076 B10R1.61 C[C@@H](O)c1ccccc1Cl Amb6893448 [0,0,1,0,0,0|2,0,1]=4 2077 B10R1.61 C[C@@H](O)c1ccccc1F Amb10838298 [0,0,1,0,0,0|2,0,1]=4 2078 B10R1.61 C[C@@H](O)c1ccccc1O Amb27664097 [0,0,1,0,0,0|2,0,1]=4 2079 B10R1.61 C[C@H](O)c1ccccc1Br Amb4605835 [0,0,1,0,0,0|2,0,1]=4 2080 B10R1.61 C[C@H](O)c1ccccc1Cl Amb6893447 [0,0,1,0,0,0|2,0,1]=4 2081 B10R1.61 C[C@H](O)c1ccccc1F Amb10838300 [0,0,1,0,0,0|2,0,1]=4 2082 B10R1.61 C[C@H](O)c1ccccc1N Amb26350508 [0,0,1,0,0,0|2,0,1]=4 2083 B10R1.61 C[C@H](O)c1ccccc1O Amb24476869 [0,0,1,0,0,0|2,0,1]=4 2084 B10R1.61 C[n+]1ccccc1C(=O)O Amb22450577 [0,0,1,0,0,0|1,0,0]=2 2085 B10R1.61 C[n+]1ccccc1C(=O)[O-] Amb21855915 [0,0,1,0,0,0|1,0,1]=3 2086 B10R1.61 C[n+]1ccccc1C(N)=O Amb2610083 [0,0,1,0,0,0|2,0,0]=3 2087 B10R1.61 C\C(O)=C1\N=CC=CC1=O Amb27956145 [0,0,1,0,0,0|3,0,0]=4 2088 B10R1.61 Cc1ccccc1B(O)O Amb2447081 [0,0,1,0,0,0|1,0,1]=3 2089 B10R1.61 Cc1ccccc1C(=N)N Amb10607001 [0,0,1,0,0,0|2,0,0]=3 2090 B10R1.61 Cc1ccccc1C(=N)N Amb2696284 [0,0,1,0,0,0|2,0,0]=3 2091 B10R1.61 Cc1ccccc1C(=O)Br Amb17844075 [0,0,1,0,0,0|1,0,0]=2 2092 B10R1.61 Cc1ccccc1C(=O)Cl Amb3939039 [0,0,1,0,0,0|1,0,0]=2 2093 B10R1.61 Cc1ccccc1C(=O)O Amb2609023 [0,0,1,0,0,0|0,0,0]=1 2094 B10R1.61 Cc1ccccc1C(Br)Br Amb27159722 [0,0,1,0,0,0|2,0,1]=4 2095 B10R1.61 Cc1ccccc1C(C)Br Amb9210658 [0,0,1,0,0,0|2,0,1]=4 2096 B10R1.61 Cc1ccccc1C(C)C Amb22347915 [0,0,1,0,0,0|2,0,1]=4 2097 B10R1.61 Cc1ccccc1C(C)Cl Amb9205040 [0,0,1,0,0,0|2,0,1]=4 2098 B10R1.61 Cc1ccccc1C(C)N Amb17935796 [0,0,1,0,0,0|2,0,1]=4 2099 B10R1.61 Cc1ccccc1C(C)N Amb9745709 [0,0,1,0,0,0|2,0,1]=4 2100 B10R1.61 Cc1ccccc1C(C)O Amb6705766 [0,0,1,0,0,0|1,0,1]=3 2101 B10R1.61 Cc1ccccc1C(C)S Amb9208032 [0,0,1,0,0,0|1,1,1]=4 2102 B10R1.61 Cc1ccccc1C(N)=O Amb2720842 [0,0,1,0,0,0|1,0,0]=2 2103 B10R1.61 Cc1ccccc1C(N)=S Amb6550210 [0,0,1,0,0,0|1,1,0]=3 2104 B10R1.61 Cc1ccccc1C(O)=S Amb20242952 [0,0,1,0,0,0|0,1,0]=2 2105 B10R1.61 Cc1ccccc1C(O)O Amb26909320 [0,0,1,0,0,0|0,0,2]=3 2106 B10R1.61 Cc1ccccc1N(C)C Amb8516605 [0,0,1,0,0,0|3,0,0]=4 2107 B10R1.61 Cc1ccccc1N(C)N Amb17231896 [0,0,1,0,0,0|3,0,0]=4 2108 B10R1.61 Cc1ccccc1S(=O)O Amb24093011 [0,0,1,0,0,0|1,0,0]=2 2109 B10R1.61 Cc1ccccc1S(=O)O Amb27431820 [0,0,1,0,0,0|1,0,0]=2 2110 B10R1.61 Cc1ccccc1S(=O)[O-] Amb19944452 [0,0,1,0,0,0|1,0,1]=3 2111 B10R1.61 Cc1ccccc1S(=O)[O-] Amb35749750 [0,0,1,0,0,0|1,0,1]=3 2112 B10R1.61 Cc1ccccc1[C@@H](C)N Amb22288649 [0,0,1,0,0,0|2,0,1]=4 2113 B10R1.61 Cc1ccccc1[C@@H](C)N Amb6893586 [0,0,1,0,0,0|2,0,1]=4 2114 B10R1.61 Cc1ccccc1[C@@H](C)O Amb6893585 [0,0,1,0,0,0|1,0,1]=3 2115 B10R1.61 Cc1ccccc1[C@H](C)N Amb16233865 [0,0,1,0,0,0|2,0,1]=4 2116 B10R1.61 Cc1ccccc1[C@H](C)N Amb34915232 [0,0,1,0,0,0|2,0,1]=4 2117 B10R1.61 Cc1ccccc1[C@H](C)N Amb6893587 [0,0,1,0,0,0|2,0,1]=4 2118 B10R1.61 Cc1ccccc1[C@H](C)O Amb6893584 [0,0,1,0,0,0|1,0,1]=3 2119 B10R1.61 Cc1ccccc1[N+](=O)[O-] Amb6608792 [0,0,1,0,0,0|1,0,1]=3 2120 B10R1.61 Cc1ccccc1[SiH](O)O Amb27959519 [0,0,1,0,0,0|0,1,1]=3 2121 B10R1.61 Cc1cccnc1B(O)O Amb8395990 [0,0,1,0,0,0|2,0,1]=4 2122 B10R1.61 Cc1cccnc1B([O-])O Amb22169334 [0,0,1,0,0,0|2,0,1]=4 2123 B10R1.61 Cc1cccnc1C(=N)N Amb22235898 [0,0,1,0,0,0|3,0,0]=4 2124 B10R1.61 Cc1cccnc1C(=N)N Amb24182047 [0,0,1,0,0,0|3,0,0]=4 2125 B10R1.61 Cc1cccnc1C(=O)Cl Amb18947043 [0,0,1,0,0,0|2,0,0]=3 2126 B10R1.61 Cc1cccnc1C(=O)O Amb21964439 [0,0,1,0,0,0|1,0,0]=2 2127 B10R1.61 Cc1cccnc1C(=O)O Amb2689642 [0,0,1,0,0,0|1,0,0]=2 2128 B10R1.61 Cc1cccnc1C(C)O Amb26959122 [0,0,1,0,0,0|2,0,1]=4 2129 B10R1.61 Cc1cccnc1C(N)=O Amb5722196 [0,0,1,0,0,0|2,0,0]=3 2130 B10R1.61 Cc1cccnc1C(N)=S Amb18795589 [0,0,1,0,0,0|2,1,0]=4 2131 B10R1.61 Cc1cccnc1N(=O)=O Amb20621854 [0,0,1,0,0,0|2,0,1]=4 2132 B10R1.61 Cc1cccnc1S(=O)O Amb32992430 [0,0,1,0,0,0|2,0,0]=3 2133 B10R1.61 Cc1cccnc1S(=O)[O-] Amb32992513 [0,0,1,0,0,0|2,0,1]=4 2134 B10R1.61 Cc1cccnc1[C@@H](C)O Amb24406429 [0,0,1,0,0,0|2,0,1]=4 2135 B10R1.61 Cc1cccnc1[C@H](C)O Amb25305108 [0,0,1,0,0,0|2,0,1]=4 2136 B10R1.61 Cc1cccnc1[N+](=O)[O-] Amb2570119 [0,0,1,0,0,0|2,0,1]=4 2137 B10R1.61 Cc1ccncc1B(O)O Amb9766219 [0,0,1,0,0,0|2,0,1]=4 2138 B10R1.61 Cc1ccncc1C(=N)N Amb16231235 [0,0,1,0,0,0|3,0,0]=4 2139 B10R1.61 Cc1ccncc1C(=N)N Amb28282724 [0,0,1,0,0,0|3,0,0]=4 2140 B10R1.61 Cc1ccncc1C(=O)Cl Amb16230802 [0,0,1,0,0,0|2,0,0]=3 2141 B10R1.61 Cc1ccncc1C(=O)O Amb1102435 [0,0,1,0,0,0|1,0,0]=2 2142 B10R1.61 Cc1ccncc1C(=O)O Amb2725643 [0,0,1,0,0,0|1,0,0]=2 2143 B10R1.61 Cc1ccncc1C(C)O Amb22059811 [0,0,1,0,0,0|2,0,1]=4 2144 B10R1.61 Cc1ccncc1C(N)=O Amb2609600 [0,0,1,0,0,0|2,0,0]=3 2145 B10R1.61 Cc1ccncc1C(N)=S Amb16231234 [0,0,1,0,0,0|2,1,0]=4 2146 B10R1.61 Cc1ccncc1N(=O)=O Amb20621660 [0,0,1,0,0,0|2,0,1]=4 2147 B10R1.61 Cc1ccncc1S(=O)[O-] Amb32754804 [0,0,1,0,0,0|2,0,1]=4 2148 B10R1.61 Cc1ccncc1[C@@H](C)O Amb26941307 [0,0,1,0,0,0|2,0,1]=4 2149 B10R1.61 Cc1ccncc1[C@H](C)O Amb26006042 [0,0,1,0,0,0|2,0,1]=4 2150 B10R1.61 Cc1ccncc1[N+](=O)[O-] Amb2794496 [0,0,1,0,0,0|2,0,1]=4 2151 B10R1.61 Cc1ccnnc1C(=O)O Amb22276547 [0,0,1,0,0,0|2,0,0]=3 2152 B10R1.61 Cc1cnccc1B(O)O Amb10576222 [0,0,1,0,0,0|2,0,1]=4 2153 B10R1.61 Cc1cnccc1B(O)O Amb13887039 [0,0,1,0,0,0|2,0,1]=4 2154 B10R1.61 Cc1cnccc1C(=N)N Amb27823577 [0,0,1,0,0,0|3,0,0]=4 2155 B10R1.61 Cc1cnccc1C(=N)N Amb32409434 [0,0,1,0,0,0|3,0,0]=4 2156 B10R1.61 Cc1cnccc1C(=O)Cl Amb27838876 [0,0,1,0,0,0|2,0,0]=3 2157 B10R1.61 Cc1cnccc1C(=O)O Amb1950722 [0,0,1,0,0,0|1,0,0]=2 2158 B10R1.61 Cc1cnccc1C(=O)O Amb22490345 [0,0,1,0,0,0|1,0,0]=2 2159 B10R1.61 Cc1cnccc1C(C)O Amb25966495 [0,0,1,0,0,0|2,0,1]=4 2160 B10R1.61 Cc1cnccc1C(N)=O Amb33542976 [0,0,1,0,0,0|2,0,0]=3 2161 B10R1.61 Cc1cnccc1C(N)=S Amb26501773 [0,0,1,0,0,0|2,1,0]=4 2162 B10R1.61 Cc1cnccc1N(=O)=O Amb20621691 [0,0,1,0,0,0|2,0,1]=4 2163 B10R1.61 Cc1cnccc1S(=O)O Amb32992439 [0,0,1,0,0,0|2,0,0]=3 2164 B10R1.61 Cc1cnccc1S(=O)[O-] Amb32992516 [0,0,1,0,0,0|2,0,1]=4 2165 B10R1.61 Cc1cnccc1[C@@H](C)O Amb25713575 [0,0,1,0,0,0|2,0,1]=4 2166 B10R1.61 Cc1cnccc1[C@H](C)O Amb24706964 [0,0,1,0,0,0|2,0,1]=4 2167 B10R1.61 Cc1cnccc1[N+](=O)[O-] Amb22167759 [0,0,1,0,0,0|2,0,1]=4 2168 B10R1.61 Cc1cnccc1[N+](=O)[O-] Amb2610790 [0,0,1,0,0,0|2,0,1]=4 2169 B10R1.61 Cc1cncnc1C(=O)Cl Amb27847149 [0,0,1,0,0,0|3,0,0]=4 2170 B10R1.61 Cc1cncnc1C(=O)O Amb22497343 [0,0,1,0,0,0|2,0,0]=3 2171 B10R1.61 Cc1cnncc1C(=O)O Amb18832259 [0,0,1,0,0,0|2,0,0]=3 2172 B10R1.61 Cc1ncccc1B(O)O Amb10072041 [0,0,1,0,0,0|2,0,1]=4 2173 B10R1.61 Cc1ncccc1B(O)O Amb8396838 [0,0,1,0,0,0|2,0,1]=4 2174 B10R1.61 Cc1ncccc1C(=N)N Amb18851710 [0,0,1,0,0,0|3,0,0]=4 2175 B10R1.61 Cc1ncccc1C(=O)Cl Amb16230804 [0,0,1,0,0,0|2,0,0]=3 2176 B10R1.61 Cc1ncccc1C(=O)O Amb19514954 [0,0,1,0,0,0|1,0,0]=2 2177 B10R1.61 Cc1ncccc1C(=O)O Amb2613015 [0,0,1,0,0,0|1,0,0]=2 2178 B10R1.61 Cc1ncccc1C(C)O Amb27146830 [0,0,1,0,0,0|2,0,1]=4 2179 B10R1.61 Cc1ncccc1C(N)=O Amb16231197 [0,0,1,0,0,0|2,0,0]=3 2180 B10R1.61 Cc1ncccc1C(N)=S Amb18215645 [0,0,1,0,0,0|2,1,0]=4 2181 B10R1.61 Cc1ncccc1N(=O)=O Amb20621693 [0,0,1,0,0,0|2,0,1]=4 2182 B10R1.61 Cc1ncccc1N(=O)=O Amb20621694 [0,0,1,0,0,0|2,0,1]=4 2183 B10R1.61 Cc1ncccc1S(=O)[O-] Amb32755784 [0,0,1,0,0,0|2,0,1]=4 2184 B10R1.61 Cc1ncccc1[C@@H](C)O Amb32880128 [0,0,1,0,0,0|2,0,1]=4 2185 B10R1.61 Cc1ncccc1[C@H](C)O Amb32880607 [0,0,1,0,0,0|2,0,1]=4 2186 B10R1.61 Cc1ncccc1[N+](=O)[O-] Amb6751872 [0,0,1,0,0,0|2,0,1]=4 2187 B10R1.61 Cc1ncccc1[N+](=O)[O-] Amb8384508 [0,0,1,0,0,0|2,0,1]=4 2188 B10R1.61 Cc1nccnc1C(=O)O Amb8011545 [0,0,1,0,0,0|2,0,0]=3 2189 B10R1.61 Cc1ncncc1C(=O)Cl Amb27881729 [0,0,1,0,0,0|3,0,0]=4 2190 B10R1.61 Cc1ncncc1C(=O)O Amb2783847 [0,0,1,0,0,0|2,0,0]=3 2191 B10R1.61 Cc1ncncc1C(N)=O Amb23400376 [0,0,1,0,0,0|3,0,0]=4 2192 B10R1.61 Cc1nnccc1C(=O)O Amb18832267 [0,0,1,0,0,0|2,0,0]=3 2193 B10R1.61 Cc1nncnc1C(=O)O Amb24480904 [0,0,1,0,0,0|3,0,0]=4 2194 B10R1.61 N=C(N)c1ccccc1Br Amb2695923 [0,0,1,0,0,0|3,0,0]=4 2195 B10R1.61 N=C(N)c1ccccc1Br Amb33552522 [0,0,1,0,0,0|3,0,0]=4 2196 B10R1.61 N=C(N)c1ccccc1Cl Amb2696044 [0,0,1,0,0,0|3,0,0]=4 2197 B10R1.61 N=C(N)c1ccccc1Cl Amb2783778 [0,0,1,0,0,0|3,0,0]=4 2198 B10R1.61 N=C(N)c1ccccc1F Amb2696613 [0,0,1,0,0,0|3,0,0]=4 2199 B10R1.61 N=C(N)c1ccccc1F Amb2699659 [0,0,1,0,0,0|3,0,0]=4 2200 B10R1.61 N=C(N)c1ccccc1F Amb28555477 [0,0,1,0,0,0|3,0,0]=4 2201 B10R1.61 N=C(N)c1ccccc1I Amb2700569 [0,0,1,0,0,0|3,0,0]=4 2202 B10R1.61 N=C(N)c1ccccc1N Amb24559098 [0,0,1,0,0,0|3,0,0]=4 2203 B10R1.61 N=C(N)c1ccccc1O Amb2696249 [0,0,1,0,0,0|3,0,0]=4 2204 B10R1.61 N=C(N)c1ccccc1O Amb8630174 [0,0,1,0,0,0|3,0,0]=4 2205 B10R1.61 N=C(N)c1ccccc1S Amb27465157 [0,0,1,0,0,0|3,0,0]=4 2206 B10R1.61 NC(=O)C1=COC=CC1=O Amb26392241 [0,0,1,0,0,0|3,0,0]=4 2207 B10R1.61 NC(=O)c1cccc[n+]1[O-] Amb2611966 [0,0,1,0,0,0|3,0,0]=4 2208 B10R1.61 NC(=O)c1ccccc1Br Amb2684949 [0,0,1,0,0,0|2,0,0]=3 2209 B10R1.61 NC(=O)c1ccccc1Cl Amb2611996 [0,0,1,0,0,0|2,0,0]=3 2210 B10R1.61 NC(=O)c1ccccc1F Amb1221270 [0,0,1,0,0,0|2,0,0]=3 2211 B10R1.61 NC(=O)c1ccccc1I Amb2384520 [0,0,1,0,0,0|2,0,0]=3 2212 B10R1.61 NC(=O)c1ccccc1N Amb1212111 [0,0,1,0,0,0|2,0,0]=3 2213 B10R1.61 NC(=O)c1ccccc1O Amb1935248 [0,0,1,0,0,0|2,0,0]=3 2214 B10R1.61 NC(=O)c1ccccc1S Amb6256729 [0,0,1,0,0,0|2,0,0]=3 2215 B10R1.61 NC(=O)c1cccnc1Br Amb2609526 [0,0,1,0,0,0|3,0,0]=4 2216 B10R1.61 NC(=O)c1cccnc1Cl Amb1239475 [0,0,1,0,0,0|3,0,0]=4 2217 B10R1.61 NC(=O)c1cccnc1F Amb16231205 [0,0,1,0,0,0|3,0,0]=4 2218 B10R1.61 NC(=O)c1cccnc1I Amb28315909 [0,0,1,0,0,0|3,0,0]=4 2219 B10R1.61 NC(=O)c1cccnc1N Amb13951562 [0,0,1,0,0,0|3,0,0]=4 2220 B10R1.61 NC(=O)c1cccnc1N Amb8833945 [0,0,1,0,0,0|3,0,0]=4 2221 B10R1.61 NC(=O)c1cccnc1O Amb18643213 [0,0,1,0,0,0|3,0,0]=4 2222 B10R1.61 NC(=O)c1cccnc1S Amb1131765 [0,0,1,0,0,0|3,0,0]=4 2223 B10R1.61 NC(=O)c1ccncc1Br Amb19957712 [0,0,1,0,0,0|3,0,0]=4 2224 B10R1.61 NC(=O)c1ccncc1Cl Amb22490741 [0,0,1,0,0,0|3,0,0]=4 2225 B10R1.61 NC(=O)c1ccncc1F Amb20241733 [0,0,1,0,0,0|3,0,0]=4 2226 B10R1.61 NC(=O)c1ccncc1I Amb25204440 [0,0,1,0,0,0|3,0,0]=4 2227 B10R1.61 NC(=O)c1ccncc1N Amb10069339 [0,0,1,0,0,0|3,0,0]=4 2228 B10R1.61 NC(=O)c1ccncc1N Amb19374970 [0,0,1,0,0,0|3,0,0]=4 2229 B10R1.61 NC(=O)c1ccncc1N Amb30588533 [0,0,1,0,0,0|3,0,0]=4 2230 B10R1.61 NC(=O)c1ccncc1O Amb23401565 [0,0,1,0,0,0|3,0,0]=4 2231 B10R1.61 NC(=O)c1ccncc1S Amb25263979 [0,0,1,0,0,0|3,0,0]=4 2232 B10R1.61 NC(=O)c1cnccc1Cl Amb33544011 [0,0,1,0,0,0|3,0,0]=4 2233 B10R1.61 NC(=O)c1cnccc1F Amb26979844 [0,0,1,0,0,0|3,0,0]=4 2234 B10R1.61 NC(=O)c1cnccc1N Amb21927713 [0,0,1,0,0,0|3,0,0]=4 2235 B10R1.61 NC(=O)c1cnccc1N Amb8396942 [0,0,1,0,0,0|3,0,0]=4 2236 B10R1.61 NC(=O)c1cnccc1O Amb5493990 [0,0,1,0,0,0|3,0,0]=4 2237 B10R1.61 NC(=O)c1cnccc1S Amb27862502 [0,0,1,0,0,0|3,0,0]=4 2238 B10R1.61 NC(=O)c1ncccc1Cl Amb23399605 [0,0,1,0,0,0|3,0,0]=4 2239 B10R1.61 NC(=O)c1ncccc1F Amb23412448 [0,0,1,0,0,0|3,0,0]=4 2240 B10R1.61 NC(=O)c1ncccc1N Amb2700629 [0,0,1,0,0,0|3,0,0]=4 2241 B10R1.61 NC(=O)c1ncccc1O Amb6600564 [0,0,1,0,0,0|3,0,0]=4 2242 B10R1.61 NC(=O)c1ncccc1S Amb25114764 [0,0,1,0,0,0|3,0,0]=4 2243 B10R1.61 NC(=S)c1ccccc1Br Amb2685503 [0,0,1,0,0,0|2,1,0]=4 2244 B10R1.61 NC(=S)c1ccccc1Cl Amb2686480 [0,0,1,0,0,0|2,1,0]=4 2245 B10R1.61 NC(=S)c1ccccc1F Amb1264600 [0,0,1,0,0,0|2,1,0]=4 2246 B10R1.61 NC(=S)c1ccccc1I Amb19889459 [0,0,1,0,0,0|2,1,0]=4 2247 B10R1.61 NC(=S)c1ccccc1N Amb1217775 [0,0,1,0,0,0|2,1,0]=4 2248 B10R1.61 NC(=S)c1ccccc1O Amb33538948 [0,0,1,0,0,0|2,1,0]=4 2249 B10R1.61 NC(O)c1ccccc1O Amb27596246 [0,0,1,0,0,0|2,0,1]=4 2250 B10R1.61 N\C(S)=C1\C=CC=CC1=O Amb33512975 [0,0,1,0,0,0|2,1,0]=4 2251 B10R1.61 Nc1ccccc1B(O)O Amb2455634 [0,0,1,0,0,0|2,0,1]=4 2252 B10R1.61 Nc1ccccc1B(O)O Amb2455781 [0,0,1,0,0,0|2,0,1]=4 2253 B10R1.61 Nc1ccccc1C(=O)O Amb1933714 [0,0,1,0,0,0|1,0,0]=2 2254 B10R1.61 Nc1ccccc1C(=S)[S-] Amb28285398 [0,0,1,0,0,0|1,2,0]=4 2255 B10R1.61 Nc1ccccc1N(=O)=O Amb20621758 [0,0,1,0,0,0|2,0,1]=4 2256 B10R1.61 Nc1ccccc1S(=O)[O-] Amb32754879 [0,0,1,0,0,0|2,0,1]=4 2257 B10R1.61 Nc1ccccc1[N+](=O)[O-] Amb22277145 [0,0,1,0,0,0|2,0,1]=4 2258 B10R1.61 Nc1ccccc1[N+](=O)[O-] Amb383742 [0,0,1,0,0,0|2,0,1]=4 2259 B10R1.61 Nc1ccccc1[SH](=O)=O Amb28118825 [0,0,1,0,0,0|2,0,1]=4 2260 B10R1.61 Nc1cccnc1C(=O)O Amb22276123 [0,0,1,0,0,0|2,0,0]=3 2261 B10R1.61 Nc1cccnc1C(=O)O Amb2609539 [0,0,1,0,0,0|2,0,0]=3 2262 B10R1.61 Nc1ccncc1C(=O)O Amb10982498 [0,0,1,0,0,0|2,0,0]=3 2263 B10R1.61 Nc1ccncc1C(=O)O Amb2404894 [0,0,1,0,0,0|2,0,0]=3 2264 B10R1.61 Nc1ccnnc1C(=O)O Amb8439486 [0,0,1,0,0,0|3,0,0]=4 2265 B10R1.61 Nc1cnccc1C(=O)O Amb1058763 [0,0,1,0,0,0|2,0,0]=3 2266 B10R1.61 Nc1cncnc1C(=O)O Amb5751296 [0,0,1,0,0,0|3,0,0]=4 2267 B10R1.61 Nc1ncccc1C(=O)O Amb535151 [0,0,1,0,0,0|2,0,0]=3 2268 B10R1.61 Nc1nccnc1C(=O)O Amb1148690 [0,0,1,0,0,0|3,0,0]=4 2269 B10R1.61 Nc1ncncc1C(=O)O Amb33544311 [0,0,1,0,0,0|3,0,0]=4 2270 B10R1.61 Nc1nnccc1C(=O)O Amb2695218 [0,0,1,0,0,0|3,0,0]=4 2271 B10R1.61 O=C(Cl)C1=CC=COC1=O Amb24428929 [0,0,1,0,0,0|3,0,0]=4 2272 B10R1.61 O=C(Cl)C1=COC=CC1=S Amb26866338 [0,0,1,0,0,0|3,0,0]=4 2273 B10R1.61 O=C(Cl)c1ccccc1Br Amb2684955 [0,0,1,0,0,0|2,0,0]=3 2274 B10R1.61 O=C(Cl)c1ccccc1Cl Amb3939030 [0,0,1,0,0,0|2,0,0]=3 2275 B10R1.61 O=C(Cl)c1ccccc1F Amb2688032 [0,0,1,0,0,0|2,0,0]=3 2276 B10R1.61 O=C(Cl)c1ccccc1I Amb3939135 [0,0,1,0,0,0|2,0,0]=3 2277 B10R1.61 O=C(Cl)c1ccccc1O Amb6743363 [0,0,1,0,0,0|2,0,0]=3 2278 B10R1.61 O=C(Cl)c1ccccc1S Amb25770152 [0,0,1,0,0,0|2,0,0]=3 2279 B10R1.61 O=C(Cl)c1cccnc1Br Amb26583421 [0,0,1,0,0,0|3,0,0]=4 2280 B10R1.61 O=C(Cl)c1cccnc1Cl Amb2778162 [0,0,1,0,0,0|3,0,0]=4 2281 B10R1.61 O=C(Cl)c1cccnc1F Amb16230805 [0,0,1,0,0,0|3,0,0]=4 2282 B10R1.61 O=C(Cl)c1cccnc1O Amb24371117 [0,0,1,0,0,0|3,0,0]=4 2283 B10R1.61 O=C(Cl)c1cccnc1S Amb19930039 [0,0,1,0,0,0|3,0,0]=4 2284 B10R1.61 O=C(Cl)c1ccncc1Br Amb24668867 [0,0,1,0,0,0|3,0,0]=4 2285 B10R1.61 O=C(Cl)c1ccncc1Br Amb32663165 [0,0,1,0,0,0|3,0,0]=4 2286 B10R1.61 O=C(Cl)c1ccncc1Cl Amb24117133 [0,0,1,0,0,0|3,0,0]=4 2287 B10R1.61 O=C(Cl)c1cnccc1Cl Amb16230803 [0,0,1,0,0,0|3,0,0]=4 2288 B10R1.61 O=C(Cl)c1cnccc1F Amb27653512 [0,0,1,0,0,0|3,0,0]=4 2289 B10R1.61 O=C(Cl)c1cnccc1O Amb27778038 [0,0,1,0,0,0|3,0,0]=4 2290 B10R1.61 O=C(Cl)c1ncccc1Cl Amb27945622 [0,0,1,0,0,0|3,0,0]=4 2291 B10R1.61 O=C(Cl)c1ncccc1O Amb25939920 [0,0,1,0,0,0|3,0,0]=4 2292 B10R1.61 O=C(O)C1=CC=CNC1=O Amb18832138 [0,0,1,0,0,0|2,0,0]=3 2293 B10R1.61 O=C(O)C1=CC=CNC1=S Amb18799572 [0,0,1,0,0,0|2,0,0]=3 2294 B10R1.61 O=C(O)C1=CC=COC1=O Amb19894956 [0,0,1,0,0,0|2,0,0]=3 2295 B10R1.61 O=C(O)C1=CC=NNC1=O Amb18643481 [0,0,1,0,0,0|3,0,0]=4 2296 B10R1.61 O=C(O)C1=CN=CNC1=O Amb18279550 [0,0,1,0,0,0|3,0,0]=4 2297 B10R1.61 O=C(O)C1=CNC=CC1=O Amb22489507 [0,0,1,0,0,0|2,0,0]=3 2298 B10R1.61 O=C(O)C1=CNC=NC1=O Amb20630296 [0,0,1,0,0,0|3,0,0]=4 2299 B10R1.61 O=C(O)C1=CNN=CC1=O Amb18202917 [0,0,1,0,0,0|3,0,0]=4 2300 B10R1.61 O=C(O)C1=NC=CNC1=O Amb21936458 [0,0,1,0,0,0|3,0,0]=4 2301 B10R1.61 O=C(O)c1cccc[n+]1[O-] Amb2609997 [0,0,1,0,0,0|2,0,0]=3 2302 B10R1.61 O=C(O)c1ccccc1Br Amb6365362 [0,0,1,0,0,0|1,0,0]=2 2303 B10R1.61 O=C(O)c1ccccc1Cl Amb1935156 [0,0,1,0,0,0|1,0,0]=2 2304 B10R1.61 O=C(O)c1ccccc1F Amb2688022 [0,0,1,0,0,0|1,0,0]=2 2305 B10R1.61 O=C(O)c1ccccc1I Amb6446255 [0,0,1,0,0,0|1,0,0]=2 2306 B10R1.61 O=C(O)c1ccccc1O Amb1912504 [0,0,1,0,0,0|1,0,0]=2 2307 B10R1.61 O=C(O)c1ccccc1S Amb901970 [0,0,1,0,0,0|1,0,0]=2 2308 B10R1.61 O=C(O)c1cccnc1Br Amb2447561 [0,0,1,0,0,0|2,0,0]=3 2309 B10R1.61 O=C(O)c1cccnc1Cl Amb745876 [0,0,1,0,0,0|2,0,0]=3 2310 B10R1.61 O=C(O)c1cccnc1F Amb2447268 [0,0,1,0,0,0|2,0,0]=3 2311 B10R1.61 O=C(O)c1cccnc1I Amb33529189 [0,0,1,0,0,0|2,0,0]=3 2312 B10R1.61 O=C(O)c1cccnc1O Amb1950661 [0,0,1,0,0,0|2,0,0]=3 2313 B10R1.61 O=C(O)c1cccnc1S Amb1210101 [0,0,1,0,0,0|2,0,0]=3 2314 B10R1.61 O=C(O)c1ccncc1Br Amb1094019 [0,0,1,0,0,0|2,0,0]=3 2315 B10R1.61 O=C(O)c1ccncc1Cl Amb2447292 [0,0,1,0,0,0|2,0,0]=3 2316 B10R1.61 O=C(O)c1ccncc1F Amb10840476 [0,0,1,0,0,0|2,0,0]=3 2317 B10R1.61 O=C(O)c1ccncc1F Amb2447421 [0,0,1,0,0,0|2,0,0]=3 2318 B10R1.61 O=C(O)c1ccncc1I Amb2610033 [0,0,1,0,0,0|2,0,0]=3 2319 B10R1.61 O=C(O)c1ccncc1O Amb2609529 [0,0,1,0,0,0|2,0,0]=3 2320 B10R1.61 O=C(O)c1ccncc1S Amb18644719 [0,0,1,0,0,0|2,0,0]=3 2321 B10R1.61 O=C(O)c1ccnnc1Br Amb27209034 [0,0,1,0,0,0|3,0,0]=4 2322 B10R1.61 O=C(O)c1ccnnc1Cl Amb20240930 [0,0,1,0,0,0|3,0,0]=4 2323 B10R1.61 O=C(O)c1ccnnc1S Amb33551102 [0,0,1,0,0,0|3,0,0]=4 2324 B10R1.61 O=C(O)c1cnccc1Br Amb21927781 [0,0,1,0,0,0|2,0,0]=3 2325 B10R1.61 O=C(O)c1cnccc1Br Amb30647471 [0,0,1,0,0,0|2,0,0]=3 2326 B10R1.61 O=C(O)c1cnccc1Br Amb6297661 [0,0,1,0,0,0|2,0,0]=3 2327 B10R1.61 O=C(O)c1cnccc1Cl Amb2610789 [0,0,1,0,0,0|2,0,0]=3 2328 B10R1.61 O=C(O)c1cnccc1F Amb17942817 [0,0,1,0,0,0|2,0,0]=3 2329 B10R1.61 O=C(O)c1cnccc1I Amb2610811 [0,0,1,0,0,0|2,0,0]=3 2330 B10R1.61 O=C(O)c1cnccc1I Amb33457296 [0,0,1,0,0,0|2,0,0]=3 2331 B10R1.61 O=C(O)c1cnccc1O Amb1420333 [0,0,1,0,0,0|2,0,0]=3 2332 B10R1.61 O=C(O)c1cnccc1S Amb2612001 [0,0,1,0,0,0|2,0,0]=3 2333 B10R1.61 O=C(O)c1cnccn1=O Amb22388358 [0,0,1,0,0,0|3,0,0]=4 2334 B10R1.61 O=C(O)c1cncnc1Br Amb25187297 [0,0,1,0,0,0|3,0,0]=4 2335 B10R1.61 O=C(O)c1cncnc1Cl Amb22494597 [0,0,1,0,0,0|3,0,0]=4 2336 B10R1.61 O=C(O)c1cncnc1F Amb26982938 [0,0,1,0,0,0|3,0,0]=4 2337 B10R1.61 O=C(O)c1cncnc1O Amb16735285 [0,0,1,0,0,0|3,0,0]=4 2338 B10R1.61 O=C(O)c1cnncc1Br Amb27793823 [0,0,1,0,0,0|3,0,0]=4 2339 B10R1.61 O=C(O)c1ncccc1Br Amb2447560 [0,0,1,0,0,0|2,0,0]=3 2340 B10R1.61 O=C(O)c1ncccc1Br Amb33379069 [0,0,1,0,0,0|2,0,0]=3 2341 B10R1.61 O=C(O)c1ncccc1Cl Amb2610115 [0,0,1,0,0,0|2,0,0]=3 2342 B10R1.61 O=C(O)c1ncccc1F Amb2447510 [0,0,1,0,0,0|2,0,0]=3 2343 B10R1.61 O=C(O)c1ncccc1I Amb10602322 [0,0,1,0,0,0|2,0,0]=3 2344 B10R1.61 O=C(O)c1ncccc1O Amb2610788 [0,0,1,0,0,0|2,0,0]=3 2345 B10R1.61 O=C(O)c1ncccc1S Amb18644720 [0,0,1,0,0,0|2,0,0]=3 2346 B10R1.61 O=C(O)c1nccnc1Br Amb2797938 [0,0,1,0,0,0|3,0,0]=4 2347 B10R1.61 O=C(O)c1nccnc1Cl Amb2694780 [0,0,1,0,0,0|3,0,0]=4 2348 B10R1.61 O=C(O)c1nccnc1I Amb19957728 [0,0,1,0,0,0|3,0,0]=4 2349 B10R1.61 O=C(O)c1nccnc1O Amb2695554 [0,0,1,0,0,0|3,0,0]=4 2350 B10R1.61 O=C(O)c1nccnc1S Amb33531396 [0,0,1,0,0,0|3,0,0]=4 2351 B10R1.61 O=C(O)c1ncncc1Br Amb4443270 [0,0,1,0,0,0|3,0,0]=4 2352 B10R1.61 O=C(O)c1ncncc1Cl Amb5751295 [0,0,1,0,0,0|3,0,0]=4 2353 B10R1.61 O=C(O)c1ncncc1F Amb27630158 [0,0,1,0,0,0|3,0,0]=4 2354 B10R1.61 O=C(O)c1nnccc1Cl Amb27803878 [0,0,1,0,0,0|3,0,0]=4 2355 B10R1.61 O=C(O)c1nnccc1F Amb27214211 [0,0,1,0,0,0|3,0,0]=4 2356 B10R1.61 O=C(O)c1nnccc1O Amb26479954 [0,0,1,0,0,0|3,0,0]=4 2357 B10R1.61 O=C([O-])c1ccccc1Cl Amb2610308 [0,0,1,0,0,0|1,0,1]=3 2358 B10R1.61 O=C([O-])c1ccccc1F Amb8397063 [0,0,1,0,0,0|1,0,1]=3 2359 B10R1.61 O=C([O-])c1ccccc1O Amb20246478 [0,0,1,0,0,0|1,0,1]=3 2360 B10R1.61 O=C([O-])c1ccccc1O Amb22338523 [0,0,1,0,0,0|1,0,1]=3 2361 B10R1.61 O=C([O-])c1ccccc1O Amb22732059 [0,0,1,0,0,0|1,0,1]=3 2362 B10R1.61 O=C([O-])c1ccccc1O Amb6383226 [0,0,1,0,0,0|1,0,1]=3 2363 B10R1.61 O=C([O-])c1ccccc1O Amb8485790 [0,0,1,0,0,0|1,0,1]=3 2364 B10R1.61 O=C([O-])c1cccnc1O Amb2609528 [0,0,1,0,0,0|2,0,1]=4 2365 B10R1.61 O=C([O-])c1cccnc1[S-] Amb33512985 [0,0,1,0,0,0|2,0,1]=4 2366 B10R1.61 O=C([O-])c1ccncc1Br Amb2611944 [0,0,1,0,0,0|2,0,1]=4 2367 B10R1.61 O=C([O-])c1cnccc1O Amb2609530 [0,0,1,0,0,0|2,0,1]=4 2368 B10R1.61 O=C([O-])c1ncccc1Br Amb17610074 [0,0,1,0,0,0|2,0,1]=4 2369 B10R1.61 O=N(=O)c1ccccc1Br Amb6365761 [0,0,1,0,0,0|2,0,1]=4 2370 B10R1.61 O=N(=O)c1ccccc1Cl Amb20621781 [0,0,1,0,0,0|2,0,1]=4 2371 B10R1.61 O=N(=O)c1ccccc1F Amb20621321 [0,0,1,0,0,0|2,0,1]=4 2372 B10R1.61 O=N(=O)c1ccccc1I Amb20621837 [0,0,1,0,0,0|2,0,1]=4 2373 B10R1.61 O=N(=O)c1ccccc1O Amb8396530 [0,0,1,0,0,0|2,0,1]=4 2374 B10R1.61 O=S(Cl)c1ccccc1Cl Amb25286319 [0,0,1,0,0,0|3,0,0]=4 2375 B10R1.61 O=S(Cl)c1ccccc1F Amb25371664 [0,0,1,0,0,0|3,0,0]=4 2376 B10R1.61 O=S(O)c1ccccc1F Amb26866329 [0,0,1,0,0,0|2,0,0]=3 2377 B10R1.61 O=S(O)c1cccnc1Cl Amb32753676 [0,0,1,0,0,0|3,0,0]=4 2378 B10R1.61 O=S(O)c1cccnc1F Amb32753691 [0,0,1,0,0,0|3,0,0]=4 2379 B10R1.61 O=S(O)c1ncccc1Cl Amb32992446 [0,0,1,0,0,0|3,0,0]=4 2380 B10R1.61 O=S([O-])c1ccccc1Br Amb19944407 [0,0,1,0,0,0|2,0,1]=4 2381 B10R1.61 O=S([O-])c1ccccc1Cl Amb19944419 [0,0,1,0,0,0|2,0,1]=4 2382 B10R1.61 O=S([O-])c1ccccc1F Amb19944444 [0,0,1,0,0,0|2,0,1]=4 2383 B10R1.61 O=S([O-])c1ccccc1O Amb32755496 [0,0,1,0,0,0|2,0,1]=4 2384 B10R1.61 O=[N+]([O-])c1ccccc1Br Amb2685353 [0,0,1,0,0,0|2,0,1]=4 2385 B10R1.61 O=[N+]([O-])c1ccccc1Cl Amb2609935 [0,0,1,0,0,0|2,0,1]=4 2386 B10R1.61 O=[N+]([O-])c1ccccc1F Amb2688251 [0,0,1,0,0,0|2,0,1]=4 2387 B10R1.61 O=[N+]([O-])c1ccccc1I Amb1151956 [0,0,1,0,0,0|2,0,1]=4 2388 B10R1.61 O=[N+]([O-])c1ccccc1O Amb6387467 [0,0,1,0,0,0|2,0,1]=4 2389 B10R1.61 O=[N+]([O-])c1ccccc1S Amb2519390 [0,0,1,0,0,0|2,0,1]=4 2390 B10R1.61 O=[N+]([O-])c1ccccc1[O-] Amb24309051 [0,0,1,0,0,0|2,0,1]=4 2391 B10R1.61 O=[N+]([O-])c1ccccc1[O-] Amb4014315 [0,0,1,0,0,0|2,0,1]=4 2392 B10R1.61 OB(O)c1ccccc1Br Amb6366157 [0,0,1,0,0,0|2,0,1]=4 2393 B10R1.61 OB(O)c1ccccc1Cl Amb2383486 [0,0,1,0,0,0|2,0,1]=4 2394 B10R1.61 OB(O)c1ccccc1F Amb2447092 [0,0,1,0,0,0|2,0,1]=4 2395 B10R1.61 OB(O)c1ccccc1I Amb16234273 [0,0,1,0,0,0|2,0,1]=4 2396 B10R1.61 OB(O)c1ccccc1O Amb2447024 [0,0,1,0,0,0|2,0,1]=4 2397 B10R1.61 OB(O)c1ccccc1S Amb19958291 [0,0,1,0,0,0|2,0,1]=4 2398 B10R1.61 OC(=S)c1ccccc1O Amb22734424 [0,0,1,0,0,0|1,1,0]=3 2399 B10R1.61 OC(O)c1ccccc1Cl Amb28050633 [0,0,1,0,0,0|1,0,2]=4 2400 B10R1.61 Oc1ccccc1C(=S)S Amb4021959 [0,0,1,0,0,0|1,2,0]=4 2401 B10R1.78 O=C1C=CC=CCCCC1 Amb22342438 [0,0,1,0,0,0|1,0,2]=4 2402 B10R1.187 CN\C=C1/C(=O)COC1=O Amb28132061 [0,0,1,0,0,0|2,0,1]=4 2403 B10R1.257 C=CC1CCC(=O)\C1=C/O Amb24619613 [0,0,1,0,0,0|2,0,1]=4 2404 B12R3.12 c1ccc2c(c1)CC3OC23 Amb1131588 [0,0,0,1,0,0|1,0,2]=4 2405 B12R3.12 c1ccc2c(c1)C[C@@H]3O[C@H]23 Amb6893758 [0,0,0,1,0,0|1,0,2]=4 2406 B12R3.12 c1ccc2c(c1)nc3nc32 Amb27774849 [0,0,0,1,0,0|3,0,0]=4 2407 B12R3.12 c1ccc2c3n(cc2c1)C3 Amb27781391 [0,0,0,1,0,0|2,0,1]=4 2408 B12R3.12 c1ccc2c3n(cc2c1)N3 Amb28282754 [0,0,0,1,0,0|2,0,1]=4 2409 B12R3.278 C1=CN2COC3=C2C=C1C3 Amb27862160 [0,0,0,1,0,0|2,0,0]=3 2410 B12R3.1604 C1=CN2C=C3OCC(=C13)C2 Amb24100739 [0,0,0,1,0,0|2,0,1]=4 2411 B10R2.32 O=C1C=Cc2cccn21 Amb27409386 [0,0,0,0,1,0|2,0,1]=4 2412 B10R2.32 O=C1CCC2C=CC=C12 Amb9836335 [0,0,0,0,1,0|1,0,1]=3 2413 B10R2.32 O=C1CCc2ccoc21 Amb27246670 [0,0,0,0,1,0|2,0,0]=3 2414 B10R2.32 O=C1CCc2ccsc21 Amb18203008 [0,0,0,0,1,0|2,0,0]=3 2415 B10R2.32 O=C1CCc2cocc21 Amb28133170 [0,0,0,0,1,0|2,0,0]=3 2416 B10R2.32 O=C1CCc2conc21 Amb28135012 [0,0,0,0,1,0|3,0,0]=4 2417 B10R2.32 O=C1CCc2cscc21 Amb18203009 [0,0,0,0,1,0|2,0,0]=3 2418 B10R2.32 O=C1CCc2occc21 Amb6740010 [0,0,0,0,1,0|2,0,0]=3 2419 B10R2.32 O=C1CCc2oncc21 Amb27966150 [0,0,0,0,1,0|3,0,0]=4 2420 B10R2.32 O=C1CCc2sccc21 Amb2232897 [0,0,0,0,1,0|2,0,0]=3 2421 B10R2.32 O=C1CCn2cccc21 Amb1154029 [0,0,0,0,1,0|2,0,0]=3 2422 B10R2.32 O=C1CCn2ccnc21 Amb24070855 [0,0,0,0,1,0|3,0,0]=4 2423 B10R2.32 O=C1CCn2cncc21 Amb21962075 [0,0,0,0,1,0|3,0,0]=4 2424 B10R2.32 O=C1CCn2cncc21 Amb22497288 [0,0,0,0,1,0|3,0,0]=4 2425 B10R2.32 O=C1CCn2nccc21 Amb24079525 [0,0,0,0,1,0|3,0,0]=4 2426 B10R2.32 O=C1CNc2ccoc21 Amb18832975 [0,0,0,0,1,0|3,0,0]=4 2427 B10R2.32 O=C1CNc2ccsc21 Amb18202968 [0,0,0,0,1,0|3,0,0]=4 2428 B10R2.32 O=C1CNc2cocc21 Amb18832972 [0,0,0,0,1,0|3,0,0]=4 2429 B10R2.32 O=C1CNc2cscc21 Amb18202966 [0,0,0,0,1,0|3,0,0]=4 2430 B10R2.32 O=C1CNc2occc21 Amb18832976 [0,0,0,0,1,0|3,0,0]=4 2431 B10R2.32 O=C1CNc2sccc21 Amb18202969 [0,0,0,0,1,0|3,0,0]=4 2432 B10R2.32 O=C1COc2cscc21 Amb18202878 [0,0,0,0,1,0|3,0,0]=4 2433 B10R2.32 O=C1CSc2cscc21 Amb18830736 [0,0,0,0,1,0|3,0,0]=4 2434 B10R2.32 O=C1NCc2ccoc21 Amb18832974 [0,0,0,0,1,0|2,0,0]=3 2435 B10R2.32 O=C1NCc2ccsc21 Amb18202967 [0,0,0,0,1,0|2,0,0]=3 2436 B10R2.32 O=C1NCc2nccn21 Amb18832967 [0,0,0,0,1,0|3,0,0]=4 2437 B10R2.32 O=C1NCc2occc21 Amb28367896 [0,0,0,0,1,0|2,0,0]=3 2438 B10R2.32 O=C1NCc2oncc21 Amb18203329 [0,0,0,0,1,0|3,0,0]=4 2439 B10R2.32 O=C1NNc2sccc21 Amb28061946 [0,0,0,0,1,0|3,0,0]=4 2440 B10R2.32 O=C1OCC2C=CCN12 Amb27860561 [0,0,0,0,1,0|1,0,2]=4 2441 B10R2.32 O=C1OC[C@@H]2C=CCN12 Amb27249491 [0,0,0,0,1,0|1,0,2]=4 2442 B10R2.32 O=C1OC[C@H]2C=CC[C@@H]12 Amb22350436 [0,0,0,0,1,0|0,0,3]=4 2443 B10R2.32 O=C1OCc2conc21 Amb35751406 [0,0,0,0,1,0|2,0,0]=3 2444 B10R2.32 O=C1OCc2nonc21 Amb22741127 [0,0,0,0,1,0|3,0,0]=4 2445 B10R2.320 BrC1Cc2ccccc21 Amb8395938 [0,0,0,0,1,0|1,0,1]=3 2446 B10R2.320 CC1=Cc2ccccc21 Amb27838637 [0,0,0,0,1,0|1,0,1]=3 2447 B10R2.320 CC1Cc2ccccc21 Amb17778870 [0,0,0,0,1,0|1,0,1]=3 2448 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [0,0,0,0,1,0|1,0,1]=3 2449 B10R2.320 ClC1Cc2ccccc21 Amb17778800 [0,0,0,0,1,0|1,0,1]=3 2450 B10R2.320 FC1=Cc2ccccc21 Amb28053263 [0,0,0,0,1,0|1,0,1]=3 2451 B10R2.320 FC1Cc2ccccc21 Amb26861975 [0,0,0,0,1,0|1,0,1]=3 2452 B10R2.320 IC1=Cc2ccccc21 Amb28041016 [0,0,0,0,1,0|1,0,1]=3 2453 B10R2.320 IC1Cc2ccccc21 Amb27465878 [0,0,0,0,1,0|1,0,1]=3 2454 B10R2.320 NC1=Cc2ccccc21 Amb26390616 [0,0,0,0,1,0|1,0,1]=3 2455 B10R2.320 NC1Cc2ccccc21 Amb26866193 [0,0,0,0,1,0|1,0,1]=3 2456 B10R2.320 NC1Cc2ccccc21 Amb33552087 [0,0,0,0,1,0|1,0,1]=3 2457 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [0,0,0,0,1,0|0,0,0]=1 2458 B10R2.320 O=C1Nc2ccccc21 Amb28436763 [0,0,0,0,1,0|1,0,0]=2 2459 B10R2.320 O=C1Sc2ncccc21 Amb28342602 [0,0,0,0,1,0|1,1,0]=3 2460 B10R2.320 OC1Cc2ccccc21 Amb17778676 [0,0,0,0,1,0|0,0,2]=3 2461 B10R2.320 [NH3+]C1Cc2ccccc21 Amb17778877 [0,0,0,0,1,0|1,0,1]=3 2462 B12R2.24 BrC1=Cc2ccccc2CC1 Amb25726468 [0,0,0,0,0,1|2,0,0]=3 2463 B12R2.24 BrC1=Cc2ccccc2OC1 Amb27841536 [0,0,0,0,0,1|3,0,0]=4 2464 B12R2.24 BrC1CCc2ccccc2C1 Amb13952699 [0,0,0,0,0,1|2,0,1]=4 2465 B12R2.24 BrC1Cc2ccccc2CO1 Amb28048803 [0,0,0,0,0,1|1,0,1]=3 2466 B12R2.24 Brc1cc2ccccc2cn1 Amb8438943 [0,0,0,0,0,1|2,0,1]=4 2467 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [0,0,0,0,0,1|2,0,1]=4 2468 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [0,0,0,0,0,1|2,0,1]=4 2469 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [0,0,0,0,0,1|3,0,0]=4 2470 B12R2.24 Brc1cnc2ccccc2n1 Amb33538649 [0,0,0,0,0,1|3,0,0]=4 2471 B12R2.24 Brc1ncc2ccccc2n1 Amb23399840 [0,0,0,0,0,1|2,0,1]=4 2472 B12R2.24 Brc1nnc2ccccc2n1 Amb18773542 [0,0,0,0,0,1|3,0,0]=4 2473 B12R2.24 C=C1CCc2ccccc2O1 Amb27210216 [0,0,0,0,0,1|2,0,0]=3 2474 B12R2.24 C=C1CCc2ncccc2C1 Amb35702581 [0,0,0,0,0,1|3,0,0]=4 2475 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [0,0,0,0,0,1|2,0,0]=3 2476 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [0,0,0,0,0,1|2,0,0]=3 2477 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [0,0,0,0,0,1|3,0,0]=4 2478 B12R2.24 CC1=Nc2ccccc2CN1 Amb6892861 [0,0,0,0,0,1|2,0,0]=3 2479 B12R2.24 CC1=Nc2ccccc2CO1 Amb27391671 [0,0,0,0,0,1|1,0,0]=2 2480 B12R2.24 CC1=Nc2ccccc2NC1 Amb27244163 [0,0,0,0,0,1|3,0,0]=4 2481 B12R2.24 CC1=Nc2ccccc2SC1 Amb10976510 [0,0,0,0,0,1|3,0,0]=4 2482 B12R2.24 CC1CCc2ccccc2C1 Amb27232124 [0,0,0,0,0,1|2,0,1]=4 2483 B12R2.24 CC1CCc2ccccc2N1 Amb2792500 [0,0,0,0,0,1|2,0,1]=4 2484 B12R2.24 CC1CCc2ccccc2N1 Amb6773975 [0,0,0,0,0,1|2,0,1]=4 2485 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,0,0,0,0,1|2,0,1]=4 2486 B12R2.24 CC1Cc2ccccc2CN1 Amb4125575 [0,0,0,0,0,1|2,0,1]=4 2487 B12R2.24 CC1Cc2ccccc2CO1 Amb27490040 [0,0,0,0,0,1|1,0,1]=3 2488 B12R2.24 CN1CCc2ccccc2C1 Amb22001820 [0,0,0,0,0,1|3,0,0]=4 2489 B12R2.24 CN1CCc2ccccc2C1 Amb2581727 [0,0,0,0,0,1|3,0,0]=4 2490 B12R2.24 CN1Cc2ccccc2CN1 Amb9677363 [0,0,0,0,0,1|3,0,0]=4 2491 B12R2.24 CN1Cc2ccccc2CO1 Amb27850763 [0,0,0,0,0,1|2,0,0]=3 2492 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [0,0,0,0,0,1|2,0,1]=4 2493 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [0,0,0,0,0,1|2,0,1]=4 2494 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [0,0,0,0,0,1|2,0,1]=4 2495 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [0,0,0,0,0,1|2,0,1]=4 2496 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [0,0,0,0,0,1|3,0,0]=4 2497 B12R2.24 Cc1cnc2ccccc2n1 Amb4026338 [0,0,0,0,0,1|3,0,0]=4 2498 B12R2.24 Cc1nnc2ccccc2n1 Amb9824915 [0,0,0,0,0,1|3,0,0]=4 2499 B12R2.24 ClC1=Nc2ccccc2SC1 Amb6761149 [0,0,0,0,0,1|3,0,0]=4 2500 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [0,0,0,0,0,1|2,0,1]=4 2501 B12R2.24 Clc1cc2ccccc2cn1 Amb10071462 [0,0,0,0,0,1|2,0,1]=4 2502 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [0,0,0,0,0,1|2,0,1]=4 2503 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [0,0,0,0,0,1|2,0,1]=4 2504 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [0,0,0,0,0,1|3,0,0]=4 2505 B12R2.24 Clc1cnc2ccccc2n1 Amb2371875 [0,0,0,0,0,1|3,0,0]=4 2506 B12R2.24 Clc1ncc2ccccc2n1 Amb6316147 [0,0,0,0,0,1|2,0,1]=4 2507 B12R2.24 Clc1nnc2ccccc2n1 Amb25824203 [0,0,0,0,0,1|3,0,0]=4 2508 B12R2.24 FC1=Cc2ccccc2CC1 Amb26441264 [0,0,0,0,0,1|2,0,0]=3 2509 B12R2.24 FC1CCc2ccccc2O1 Amb27668649 [0,0,0,0,0,1|2,0,1]=4 2510 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [0,0,0,0,0,1|2,0,1]=4 2511 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [0,0,0,0,0,1|2,0,1]=4 2512 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [0,0,0,0,0,1|3,0,0]=4 2513 B12R2.24 Fc1nnc2ccccc2n1 Amb35653818 [0,0,0,0,0,1|3,0,0]=4 2514 B12R2.24 IC1CCc2ccccc2C1 Amb33714903 [0,0,0,0,0,1|2,0,1]=4 2515 B12R2.24 Ic1cc2ccccc2cn1 Amb22170100 [0,0,0,0,0,1|2,0,1]=4 2516 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [0,0,0,0,0,1|2,0,1]=4 2517 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [0,0,0,0,0,1|2,0,1]=4 2518 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [0,0,0,0,0,1|3,0,0]=4 2519 B12R2.24 Ic1cnc2ccccc2n1 Amb24084425 [0,0,0,0,0,1|3,0,0]=4 2520 B12R2.24 Ic1ncc2ccccc2n1 Amb27229523 [0,0,0,0,0,1|2,0,1]=4 2521 B12R2.24 N=C1C=c2ccccc2=NC1 Amb24061571 [0,0,0,0,0,1|3,0,0]=4 2522 B12R2.24 NC1=Cc2ccccc2NC1 Amb25079184 [0,0,0,0,0,1|3,0,0]=4 2523 B12R2.24 NC1=Nc2ccccc2CC1 Amb2373583 [0,0,0,0,0,1|2,0,0]=3 2524 B12R2.24 NC1=Nc2ccccc2CN1 Amb18644339 [0,0,0,0,0,1|2,0,0]=3 2525 B12R2.24 NC1=Nc2ccccc2CS1 Amb28057142 [0,0,0,0,0,1|1,1,0]=3 2526 B12R2.24 NC1=Nc2ccccc2NN1 Amb27846252 [0,0,0,0,0,1|3,0,0]=4 2527 B12R2.24 NC1=Nc2ccccc2NS1 Amb27632409 [0,0,0,0,0,1|2,1,0]=4 2528 B12R2.24 NC1=Nc2ccccc2OC1 Amb18124903 [0,0,0,0,0,1|3,0,0]=4 2529 B12R2.24 NC1=Nc2ccccc2SC1 Amb19136101 [0,0,0,0,0,1|3,0,0]=4 2530 B12R2.24 NC1=Nc2ccccc2SC1 Amb1918677 [0,0,0,0,0,1|3,0,0]=4 2531 B12R2.24 NC1CCc2ccccc2C1 Amb13952050 [0,0,0,0,0,1|2,0,1]=4 2532 B12R2.24 NC1CCc2ccccc2C1 Amb2383251 [0,0,0,0,0,1|2,0,1]=4 2533 B12R2.24 NN1CCc2ccccc2C1 Amb17232046 [0,0,0,0,0,1|3,0,0]=4 2534 B12R2.24 NN1CCc2ccccc2C1 Amb22495461 [0,0,0,0,0,1|3,0,0]=4 2535 B12R2.24 N[C@@H]1CCc2ccccc2C1 Amb25113422 [0,0,0,0,0,1|2,0,1]=4 2536 B12R2.24 N[C@H]1CCc2ccccc2C1 Amb8383954 [0,0,0,0,0,1|2,0,1]=4 2537 B12R2.24 Nc1cc2ccccc2cn1 Amb2722858 [0,0,0,0,0,1|2,0,1]=4 2538 B12R2.24 Nc1cc2ccccc2nn1 Amb8438995 [0,0,0,0,0,1|3,0,0]=4 2539 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [0,0,0,0,0,1|2,0,1]=4 2540 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [0,0,0,0,0,1|2,0,1]=4 2541 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [0,0,0,0,0,1|2,0,1]=4 2542 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [0,0,0,0,0,1|3,0,0]=4 2543 B12R2.24 Nc1cnc2ccccc2n1 Amb4135072 [0,0,0,0,0,1|3,0,0]=4 2544 B12R2.24 Nc1ncc2ccccc2n1 Amb8631314 [0,0,0,0,0,1|2,0,1]=4 2545 B12R2.24 Nc1nnc2ccccc2n1 Amb8630454 [0,0,0,0,0,1|3,0,0]=4 2546 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,0,0,0,0,1|1,0,1]=3 2547 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,0,0,0,0,1|2,0,0]=3 2548 B12R2.24 O=C1C=C2C=CC=CN2CC1 Amb27883588 [0,0,0,0,0,1|2,0,0]=3 2549 B12R2.24 O=C1C=C2C=CC=NC2=CN1 Amb27239109 [0,0,0,0,0,1|2,0,1]=4 2550 B12R2.24 O=C1C=C2N=CC=CC2=CN1 Amb27642614 [0,0,0,0,0,1|2,0,1]=4 2551 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,0,0,0,0,1|1,0,1]=3 2552 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,0,0,0,0,1|1,0,1]=3 2553 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,0,0,0,0,1|1,0,1]=3 2554 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [0,0,0,0,0,1|1,0,1]=3 2555 B12R2.24 O=C1C=Cc2cccnc2N1 Amb22001403 [0,0,0,0,0,1|2,0,1]=4 2556 B12R2.24 O=C1C=Cc2ccncc2N1 Amb22493786 [0,0,0,0,0,1|2,0,1]=4 2557 B12R2.24 O=C1C=Cc2ccncc2O1 Amb24395883 [0,0,0,0,0,1|2,0,1]=4 2558 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [0,0,0,0,0,1|2,0,1]=4 2559 B12R2.24 O=C1C=Cc2ncccc2N1 Amb21856966 [0,0,0,0,0,1|2,0,1]=4 2560 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,0,0,0,0,1|2,0,0]=3 2561 B12R2.24 O=C1C=Nc2cccnc2N1 Amb20461570 [0,0,0,0,0,1|3,0,0]=4 2562 B12R2.24 O=C1C=Nc2ccncc2N1 Amb18016830 [0,0,0,0,0,1|3,0,0]=4 2563 B12R2.24 O=C1CCN2C=CC=CC2=N1 Amb17749056 [0,0,0,0,0,1|2,0,0]=3 2564 B12R2.24 O=C1CCc2ccccc2C1 Amb2383557 [0,0,0,0,0,1|1,0,0]=2 2565 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [0,0,0,0,0,1|1,0,0]=2 2566 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [0,0,0,0,0,1|1,0,0]=2 2567 B12R2.24 O=C1CCc2cccnc2N1 Amb21960778 [0,0,0,0,0,1|2,0,0]=3 2568 B12R2.24 O=C1CCc2ccncc2N1 Amb26603762 [0,0,0,0,0,1|2,0,0]=3 2569 B12R2.24 O=C1CCc2cnccc2N1 Amb22899719 [0,0,0,0,0,1|2,0,0]=3 2570 B12R2.24 O=C1CCc2cncnc2C1 Amb24554237 [0,0,0,0,0,1|3,0,0]=4 2571 B12R2.24 O=C1CCc2cncnc2N1 Amb27959197 [0,0,0,0,0,1|3,0,0]=4 2572 B12R2.24 O=C1CCc2cncnc2O1 Amb25685469 [0,0,0,0,0,1|3,0,0]=4 2573 B12R2.24 O=C1CCc2ncccc2C1 Amb7969886 [0,0,0,0,0,1|2,0,0]=3 2574 B12R2.24 O=C1CCc2ncccc2N1 Amb25095800 [0,0,0,0,0,1|2,0,0]=3 2575 B12R2.24 O=C1CCc2ncncc2C1 Amb22494044 [0,0,0,0,0,1|3,0,0]=4 2576 B12R2.24 O=C1CN2C=CC=CC2=NN1 Amb18537629 [0,0,0,0,0,1|3,0,0]=4 2577 B12R2.24 O=C1CNc2ccccc2C1 Amb18202302 [0,0,0,0,0,1|2,0,0]=3 2578 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [0,0,0,0,0,1|2,0,0]=3 2579 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,0,0,0,0,1|2,0,0]=3 2580 B12R2.24 O=C1CNc2ccncc2N1 Amb18025377 [0,0,0,0,0,1|3,0,0]=4 2581 B12R2.24 O=C1CNc2cnccc2N1 Amb18202157 [0,0,0,0,0,1|3,0,0]=4 2582 B12R2.24 O=C1CNc2ncccc2N1 Amb17948510 [0,0,0,0,0,1|3,0,0]=4 2583 B12R2.24 O=C1COc2ccccc2C1 Amb15692703 [0,0,0,0,0,1|2,0,0]=3 2584 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [0,0,0,0,0,1|2,0,0]=3 2585 B12R2.24 O=C1COc2ccccc2O1 Amb2759474 [0,0,0,0,0,1|2,0,0]=3 2586 B12R2.24 O=C1COc2cccnc2N1 Amb592999 [0,0,0,0,0,1|3,0,0]=4 2587 B12R2.24 O=C1COc2ccncc2N1 Amb13890254 [0,0,0,0,0,1|3,0,0]=4 2588 B12R2.24 O=C1COc2cnccc2N1 Amb22899221 [0,0,0,0,0,1|3,0,0]=4 2589 B12R2.24 O=C1COc2ncccc2N1 Amb9824130 [0,0,0,0,0,1|3,0,0]=4 2590 B12R2.24 O=C1CSc2ccccc2C1 Amb22231635 [0,0,0,0,0,1|2,0,0]=3 2591 B12R2.24 O=C1CSc2ccccc2N1 Amb1007458 [0,0,0,0,0,1|2,0,0]=3 2592 B12R2.24 O=C1CSc2cccnc2N1 Amb24563510 [0,0,0,0,0,1|3,0,0]=4 2593 B12R2.24 O=C1CSc2ccncc2N1 Amb20622817 [0,0,0,0,0,1|3,0,0]=4 2594 B12R2.24 O=C1CSc2ncccc2N1 Amb29083254 [0,0,0,0,0,1|3,0,0]=4 2595 B12R2.24 O=C1CSc2ncccc2N1 Amb7172747 [0,0,0,0,0,1|3,0,0]=4 2596 B12R2.24 O=C1C[n+]2ccccc2CO1 Amb2613487 [0,0,0,0,0,1|1,0,0]=2 2597 B12R2.24 O=C1Cc2ccccc2CN1 Amb33544470 [0,0,0,0,0,1|1,0,0]=2 2598 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,0,0,0,0,1|0,0,0]=1 2599 B12R2.24 O=C1Cc2cccnc2CN1 Amb24513882 [0,0,0,0,0,1|2,0,0]=3 2600 B12R2.24 O=C1Cc2ccncc2CN1 Amb25760054 [0,0,0,0,0,1|2,0,0]=3 2601 B12R2.24 O=C1Cc2cnccc2CN1 Amb26484645 [0,0,0,0,0,1|2,0,0]=3 2602 B12R2.24 O=C1Cc2ncccc2CN1 Amb27145917 [0,0,0,0,0,1|2,0,0]=3 2603 B12R2.24 O=C1Cc2nccnc2CN1 Amb24414115 [0,0,0,0,0,1|3,0,0]=4 2604 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [0,0,0,0,0,1|1,0,1]=3 2605 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [0,0,0,0,0,1|1,0,1]=3 2606 B12R2.24 O=C1NCc2ccccc2O1 Amb27468708 [0,0,0,0,0,1|1,0,0]=2 2607 B12R2.24 O=C1NCc2cccnc2N1 Amb27593444 [0,0,0,0,0,1|2,0,0]=3 2608 B12R2.24 O=C1NCc2nccnc2N1 Amb24486067 [0,0,0,0,0,1|3,0,0]=4 2609 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,0,0,0,0,1|0,0,0]=1 2610 B12R2.24 O=C1Nc2cccnc2CO1 Amb32692993 [0,0,0,0,0,1|1,0,0]=2 2611 B12R2.24 O=C1Nc2ccncc2CO1 Amb33625067 [0,0,0,0,0,1|1,0,0]=2 2612 B12R2.24 O=C1Nc2cnccc2CO1 Amb28118259 [0,0,0,0,0,1|1,0,0]=2 2613 B12R2.24 O=C1Nc2ncccc2CO1 Amb24634652 [0,0,0,0,0,1|1,0,0]=2 2614 B12R2.24 O=S1Cc2ccccc2CO1 Amb27495622 [0,0,0,0,0,1|1,0,0]=2 2615 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [0,0,0,0,0,1|2,0,1]=4 2616 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [0,0,0,0,0,1|2,0,1]=4 2617 B12R2.24 OC1=Nc2ccccc2OC1 Amb22330533 [0,0,0,0,0,1|2,0,1]=4 2618 B12R2.24 OC1CCc2ccccc2C1 Amb2721268 [0,0,0,0,0,1|1,0,2]=4 2619 B12R2.24 OC1CCc2ccccc2N1 Amb27209313 [0,0,0,0,0,1|1,0,2]=4 2620 B12R2.24 OC1CCc2ccccc2O1 Amb22230405 [0,0,0,0,0,1|1,0,2]=4 2621 B12R2.24 OC1Cc2ccccc2CO1 Amb17593730 [0,0,0,0,0,1|0,0,2]=3 2622 B12R2.24 O[C@@H]1CCc2ccccc2C1 Amb25043599 [0,0,0,0,0,1|1,0,2]=4 2623 B12R2.24 O[C@H]1CCc2ccccc2C1 Amb25149682 [0,0,0,0,0,1|1,0,2]=4 2624 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [0,0,0,0,0,1|1,0,2]=4 2625 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [0,0,0,0,0,1|1,0,2]=4 2626 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [0,0,0,0,0,1|2,0,1]=4 2627 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [0,0,0,0,0,1|2,0,1]=4 2628 B12R2.24 Oc1nnc2ccccc2n1 Amb27445418 [0,0,0,0,0,1|2,0,1]=4 2629 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [0,0,0,0,0,1|1,1,1]=4 2630 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [0,0,0,0,0,1|2,1,0]=4 2631 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,0,0,0,0,1|1,1,0]=3 2632 B12R2.24 S=C1COc2ccccc2N1 Amb10070958 [0,0,0,0,0,1|2,1,0]=4 2633 B12R2.24 S=C1CSc2ccccc2N1 Amb1147064 [0,0,0,0,0,1|2,1,0]=4 2634 B12R2.24 S=C1NCc2ccccc2N1 Amb9810735 [0,0,0,0,0,1|1,1,0]=3 2635 B12R2.24 S=C1Nc2ccccc2CO1 Amb27782447 [0,0,0,0,0,1|0,1,0]=2 2636 B12R2.24 S=C1Nc2ccccc2CS1 Amb19221474 [0,0,0,0,0,1|0,2,0]=3 2637 B12R2.24 S=C1OCc2ccccc2O1 Amb28060956 [0,0,0,0,0,1|0,1,0]=2 2638 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [0,0,0,0,0,1|2,1,0]=4 2639 B12R2.24 SC1=Nc2ccccc2CS1 Amb444027 [0,0,0,0,0,1|0,2,0]=3 2640 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [0,0,0,0,0,1|1,1,1]=4 2641 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [0,0,0,0,0,1|1,1,1]=4 2642 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [0,0,0,0,0,1|1,1,1]=4 2643 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [0,0,0,0,0,1|2,1,0]=4 2644 B12R2.24 Sc1cnc2ccccc2n1 Amb837074 [0,0,0,0,0,1|2,1,0]=4 2645 B12R2.24 Sc1ncc2ccccc2n1 Amb27229522 [0,0,0,0,0,1|1,1,1]=4 2646 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [0,0,0,0,0,1|2,0,1]=4 2647 B12R2.24 [O-][N+]1=CCc2ccccc2C1 Amb27823747 [0,0,0,0,0,1|2,0,1]=4 2648 B12R2.24 [O-][N+]1=Cc2ccccc2CC1 Amb27869931 [0,0,0,0,0,1|2,0,1]=4 2649 B12R2.586 Fc1ccc2cccccc12 Amb25111096 [0,0,0,0,0,1|2,0,1]=4 2650 B12R2.586 O=C1CCC2=C1C=CCCC2 Amb27605676 [0,0,0,0,0,1|1,0,2]=4 2651 B12R2.586 O=C1CCC2=C1CC=CC=C2 Amb27599449 [0,0,0,0,0,1|1,0,0]=2 2652 B12R2.586 O=C1CCC2=CC=CCC=C12 Amb28074670 [0,0,0,0,0,1|1,0,0]=2 2653 B12R2.586 O=C1CCC2=CCC=CC=C12 Amb28386613 [0,0,0,0,0,1|1,0,0]=2 2654 B12R2.1081 BrC1=C2C=CC=CN2CC=C1 Amb17835330 [0,0,0,0,0,1|3,0,0]=4 2655 B12R2.1081 BrC1=CCOc2ccccc21 Amb28385954 [0,0,0,0,0,1|2,0,0]=3 2656 B12R2.1081 BrC1CCCc2ccccc21 Amb8384413 [0,0,0,0,0,1|2,0,1]=4 2657 B12R2.1081 BrC1CCNc2ccccc21 Amb26657292 [0,0,0,0,0,1|2,0,1]=4 2658 B12R2.1081 BrC1CCOc2ccccc21 Amb9210662 [0,0,0,0,0,1|2,0,1]=4 2659 B12R2.1081 BrC1NCCc2ccccc21 Amb27176472 [0,0,0,0,0,1|2,0,1]=4 2660 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,0,0,0,0,1|1,0,1]=3 2661 B12R2.1081 Brc1cccc2ccccc12 Amb2795757 [0,0,0,0,0,1|2,0,1]=4 2662 B12R2.1081 Brc1ccnc2ccccc12 Amb2447564 [0,0,0,0,0,1|2,0,1]=4 2663 B12R2.1081 Brc1cncc2ccccc12 Amb6364997 [0,0,0,0,0,1|2,0,1]=4 2664 B12R2.1081 Brc1cnnc2ccccc12 Amb33548752 [0,0,0,0,0,1|3,0,0]=4 2665 B12R2.1081 Brc1nccc2ccccc12 Amb2609661 [0,0,0,0,0,1|2,0,1]=4 2666 B12R2.1081 Brc1ncnc2ccccc12 Amb10602647 [0,0,0,0,0,1|2,0,1]=4 2667 B12R2.1081 Brc1nncc2ccccc12 Amb33531650 [0,0,0,0,0,1|2,0,1]=4 2668 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [0,0,0,0,0,1|2,0,1]=4 2669 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,0,0,0,0,1|2,0,0]=3 2670 B12R2.1081 C=C1CCCc2cccnc21 Amb33164017 [0,0,0,0,0,1|3,0,0]=4 2671 B12R2.1081 C=C1CCNc2ccccc21 Amb27596012 [0,0,0,0,0,1|2,0,0]=3 2672 B12R2.1081 C=C1CCOc2ccccc21 Amb26360090 [0,0,0,0,0,1|2,0,0]=3 2673 B12R2.1081 C=C1NC=Cc2ccccc21 Amb27186378 [0,0,0,0,0,1|2,0,1]=4 2674 B12R2.1081 CC1=CCCc2ccccc21 Amb2439915 [0,0,0,0,0,1|2,0,0]=3 2675 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,0,0,0,0,1|2,0,0]=3 2676 B12R2.1081 CC1=NCCc2ccccc21 Amb17940779 [0,0,0,0,0,1|2,0,0]=3 2677 B12R2.1081 CC1=NCCc2ccccc21 Amb33446974 [0,0,0,0,0,1|2,0,0]=3 2678 B12R2.1081 CC1=NCCc2ccccc21 Amb8517423 [0,0,0,0,0,1|2,0,0]=3 2679 B12R2.1081 CC1=NCCc2ncccc21 Amb22751775 [0,0,0,0,0,1|3,0,0]=4 2680 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,0,0,0,0,1|2,0,1]=4 2681 B12R2.1081 CC1CCNc2ccccc21 Amb7969716 [0,0,0,0,0,1|2,0,1]=4 2682 B12R2.1081 CC1CCNc2ccccc21 Amb9782720 [0,0,0,0,0,1|2,0,1]=4 2683 B12R2.1081 CC1CCOc2ccccc21 Amb28194294 [0,0,0,0,0,1|2,0,1]=4 2684 B12R2.1081 CC1CNCc2ccccc21 Amb17399906 [0,0,0,0,0,1|2,0,1]=4 2685 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,0,0,0,0,1|2,0,1]=4 2686 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,0,0,0,0,1|1,0,1]=3 2687 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,0,0,0,0,1|2,0,1]=4 2688 B12R2.1081 CC1NCCc2ccccc21 Amb5735598 [0,0,0,0,0,1|2,0,1]=4 2689 B12R2.1081 CC1OCNc2ccccc21 Amb28118766 [0,0,0,0,0,1|1,0,1]=3 2690 B12R2.1081 CN1CCCc2ccccc21 Amb15692645 [0,0,0,0,0,1|3,0,0]=4 2691 B12R2.1081 CN1CCNc2ccccc21 Amb19957895 [0,0,0,0,0,1|3,0,0]=4 2692 B12R2.1081 CN1CCNc2ccccc21 Amb2383679 [0,0,0,0,0,1|3,0,0]=4 2693 B12R2.1081 CN1CCOc2ccccc21 Amb10569245 [0,0,0,0,0,1|3,0,0]=4 2694 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb30594264 [0,0,0,0,0,1|2,0,1]=4 2695 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,0,0,0,0,1|2,0,1]=4 2696 B12R2.1081 C[C@H]1NCCc2ccccc21 Amb28186683 [0,0,0,0,0,1|2,0,1]=4 2697 B12R2.1081 Cc1cccc2ccccc12 Amb6608819 [0,0,0,0,0,1|2,0,1]=4 2698 B12R2.1081 Cc1ccnc2ccccc12 Amb6608646 [0,0,0,0,0,1|2,0,1]=4 2699 B12R2.1081 Cc1cncc2ccccc12 Amb15691609 [0,0,0,0,0,1|2,0,1]=4 2700 B12R2.1081 Cc1cnnc2ccccc12 Amb21964128 [0,0,0,0,0,1|3,0,0]=4 2701 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,0,0,0,0,1|2,0,1]=4 2702 B12R2.1081 Cc1ncnc2ccccc12 Amb10573340 [0,0,0,0,0,1|2,0,1]=4 2703 B12R2.1081 Cc1nncc2ccccc12 Amb22499677 [0,0,0,0,0,1|2,0,1]=4 2704 B12R2.1081 ClC1=CCOc2ccccc21 Amb27194523 [0,0,0,0,0,1|2,0,0]=3 2705 B12R2.1081 ClC1CCCc2ccccc21 Amb9204490 [0,0,0,0,0,1|2,0,1]=4 2706 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,0,0,0,0,1|2,0,1]=4 2707 B12R2.1081 ClC1CCOc2ccccc21 Amb33529009 [0,0,0,0,0,1|2,0,1]=4 2708 B12R2.1081 ClC1CCSc2ccccc21 Amb33529010 [0,0,0,0,0,1|2,0,1]=4 2709 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,0,0,0,0,1|1,0,1]=3 2710 B12R2.1081 ClC1CSCc2ccccc21 Amb27454843 [0,0,0,0,0,1|1,1,1]=4 2711 B12R2.1081 Clc1ccnc2ccccc12 Amb1033000 [0,0,0,0,0,1|2,0,1]=4 2712 B12R2.1081 Clc1cncc2ccccc12 Amb8438946 [0,0,0,0,0,1|2,0,1]=4 2713 B12R2.1081 Clc1cnnc2ccccc12 Amb28990887 [0,0,0,0,0,1|3,0,0]=4 2714 B12R2.1081 Clc1cnnc2ccccc12 Amb8394534 [0,0,0,0,0,1|3,0,0]=4 2715 B12R2.1081 Clc1nccc2ccccc12 Amb2196515 [0,0,0,0,0,1|2,0,1]=4 2716 B12R2.1081 Clc1ncnc2ccccc12 Amb1107717 [0,0,0,0,0,1|2,0,1]=4 2717 B12R2.1081 Clc1nncc2ccccc12 Amb22723369 [0,0,0,0,0,1|2,0,1]=4 2718 B12R2.1081 Clc1nncc2ccccc12 Amb415171 [0,0,0,0,0,1|2,0,1]=4 2719 B12R2.1081 FC1=CCCc2ccccc21 Amb27482090 [0,0,0,0,0,1|2,0,0]=3 2720 B12R2.1081 FC1CCNc2ccccc21 Amb28079527 [0,0,0,0,0,1|2,0,1]=4 2721 B12R2.1081 FC1CNCc2ccccc21 Amb10841578 [0,0,0,0,0,1|2,0,1]=4 2722 B12R2.1081 Fc1cccc2ccccc12 Amb2688247 [0,0,0,0,0,1|2,0,1]=4 2723 B12R2.1081 Fc1ccnc2ccccc12 Amb10067580 [0,0,0,0,0,1|2,0,1]=4 2724 B12R2.1081 Fc1cncc2ccccc12 Amb22396493 [0,0,0,0,0,1|2,0,1]=4 2725 B12R2.1081 Fc1cncc2ccccc12 Amb6296546 [0,0,0,0,0,1|2,0,1]=4 2726 B12R2.1081 Fc1nccc2ccccc12 Amb24673352 [0,0,0,0,0,1|2,0,1]=4 2727 B12R2.1081 Fc1ncnc2ccccc12 Amb20669977 [0,0,0,0,0,1|2,0,1]=4 2728 B12R2.1081 IC1CCCc2ccccc21 Amb33714900 [0,0,0,0,0,1|2,0,1]=4 2729 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,0,0,0,0,1|2,0,1]=4 2730 B12R2.1081 IC1CCOc2ccccc21 Amb28060969 [0,0,0,0,0,1|2,0,1]=4 2731 B12R2.1081 Ic1cccc2ccccc12 Amb4605973 [0,0,0,0,0,1|2,0,1]=4 2732 B12R2.1081 Ic1ccnc2ccccc12 Amb5492738 [0,0,0,0,0,1|2,0,1]=4 2733 B12R2.1081 Ic1cncc2ccccc12 Amb2609665 [0,0,0,0,0,1|2,0,1]=4 2734 B12R2.1081 Ic1nccc2ccccc12 Amb2609664 [0,0,0,0,0,1|2,0,1]=4 2735 B12R2.1081 Ic1ncnc2ccccc12 Amb2795821 [0,0,0,0,0,1|2,0,1]=4 2736 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,0,0,0,0,1|2,0,1]=4 2737 B12R2.1081 NC1CCCc2ccccc21 Amb5716841 [0,0,0,0,0,1|2,0,1]=4 2738 B12R2.1081 NC1CCCc2ccccc21 Amb6334842 [0,0,0,0,0,1|2,0,1]=4 2739 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,0,0,0,0,1|2,0,1]=4 2740 B12R2.1081 NC1CCNc2ccccc21 Amb2700188 [0,0,0,0,0,1|2,0,1]=4 2741 B12R2.1081 NC1CCOc2ccccc21 Amb5717381 [0,0,0,0,0,1|2,0,1]=4 2742 B12R2.1081 NC1CCOc2ccccc21 Amb8333718 [0,0,0,0,0,1|2,0,1]=4 2743 B12R2.1081 NC1CCSc2ccccc21 Amb6891903 [0,0,0,0,0,1|2,0,1]=4 2744 B12R2.1081 NC1CCSc2ccccc21 Amb9703514 [0,0,0,0,0,1|2,0,1]=4 2745 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,0,0,0,0,1|2,0,1]=4 2746 B12R2.1081 NC1COCc2ccccc21 Amb10067658 [0,0,0,0,0,1|1,0,1]=3 2747 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,0,0,0,0,1|1,0,1]=3 2748 B12R2.1081 NC1CSCc2ccccc21 Amb10067686 [0,0,0,0,0,1|1,1,1]=4 2749 B12R2.1081 NC1CSCc2ccccc21 Amb9620859 [0,0,0,0,0,1|1,1,1]=4 2750 B12R2.1081 NN1CCCc2ccccc21 Amb33172813 [0,0,0,0,0,1|3,0,0]=4 2751 B12R2.1081 NN1CCCc2ccccc21 Amb836811 [0,0,0,0,0,1|3,0,0]=4 2752 B12R2.1081 NN1CCOc2ccccc21 Amb18125145 [0,0,0,0,0,1|3,0,0]=4 2753 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb10844952 [0,0,0,0,0,1|2,0,1]=4 2754 B12R2.1081 N[C@@H]1CCNc2ccccc21 Amb26012444 [0,0,0,0,0,1|2,0,1]=4 2755 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb13953038 [0,0,0,0,0,1|2,0,1]=4 2756 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,0,0,0,0,1|2,0,1]=4 2757 B12R2.1081 N[C@@H]1CCSc2ccccc21 Amb13952927 [0,0,0,0,0,1|2,0,1]=4 2758 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,0,0,0,0,1|2,0,1]=4 2759 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb8383429 [0,0,0,0,0,1|2,0,1]=4 2760 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,0,0,0,0,1|2,0,1]=4 2761 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb13953039 [0,0,0,0,0,1|2,0,1]=4 2762 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,0,0,0,0,1|2,0,1]=4 2763 B12R2.1081 N[C@H]1CCSc2ccccc21 Amb13952928 [0,0,0,0,0,1|2,0,1]=4 2764 B12R2.1081 N[C@H]1COCc2ccccc21 Amb27839884 [0,0,0,0,0,1|1,0,1]=3 2765 B12R2.1081 Nc1cccc2ccccc12 Amb1935098 [0,0,0,0,0,1|2,0,1]=4 2766 B12R2.1081 Nc1ccnc2ccccc12 Amb1102727 [0,0,0,0,0,1|2,0,1]=4 2767 B12R2.1081 Nc1ccnc2ccccc12 Amb7969523 [0,0,0,0,0,1|2,0,1]=4 2768 B12R2.1081 Nc1cncc2ccccc12 Amb22276925 [0,0,0,0,0,1|2,0,1]=4 2769 B12R2.1081 Nc1cncc2ccccc12 Amb2610662 [0,0,0,0,0,1|2,0,1]=4 2770 B12R2.1081 Nc1cnnc2ccccc12 Amb4408462 [0,0,0,0,0,1|3,0,0]=4 2771 B12R2.1081 Nc1nccc2ccccc12 Amb2609973 [0,0,0,0,0,1|2,0,1]=4 2772 B12R2.1081 Nc1nccc2ccccc12 Amb32663180 [0,0,0,0,0,1|2,0,1]=4 2773 B12R2.1081 Nc1ncnc2ccccc12 Amb1154616 [0,0,0,0,0,1|2,0,1]=4 2774 B12R2.1081 Nc1nncc2ccccc12 Amb9378095 [0,0,0,0,0,1|2,0,1]=4 2775 B12R2.1081 Nc1nnnc2ccccc12 Amb23592273 [0,0,0,0,0,1|3,0,0]=4 2776 B12R2.1081 O=C1C=CC=C2SC=CC=C12 Amb28253344 [0,0,0,0,0,1|2,0,1]=4 2777 B12R2.1081 O=C1C=CCC2=CNCC=C12 Amb28055909 [0,0,0,0,0,1|2,0,1]=4 2778 B12R2.1081 O=C1C=CCc2ccccc21 Amb2388336 [0,0,0,0,0,1|1,0,0]=2 2779 B12R2.1081 O=C1C=CN=C2C=CC=CN12 Amb18035151 [0,0,0,0,0,1|2,0,1]=4 2780 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,0,0,0,0,1|1,0,1]=3 2781 B12R2.1081 O=C1C=CNc2cccnc21 Amb22489921 [0,0,0,0,0,1|2,0,1]=4 2782 B12R2.1081 O=C1C=CNc2ccncc21 Amb20623103 [0,0,0,0,0,1|2,0,1]=4 2783 B12R2.1081 O=C1C=CNc2cnccc21 Amb22055906 [0,0,0,0,0,1|2,0,1]=4 2784 B12R2.1081 O=C1C=CNc2ncccc21 Amb22490480 [0,0,0,0,0,1|2,0,1]=4 2785 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,0,0,0,0,1|1,0,1]=3 2786 B12R2.1081 O=C1C=COc2cccnc21 Amb32671309 [0,0,0,0,0,1|2,0,1]=4 2787 B12R2.1081 O=C1C=COc2cnccc21 Amb33484174 [0,0,0,0,0,1|2,0,1]=4 2788 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,0,0,0,0,1|1,0,1]=3 2789 B12R2.1081 O=C1C=CSc2ncccc21 Amb27490810 [0,0,0,0,0,1|2,0,1]=4 2790 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,0,0,0,0,1|2,0,0]=3 2791 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,0,0,0,0,1|1,0,1]=3 2792 B12R2.1081 O=C1CCC[n+]2ccccc21 Amb16191924 [0,0,0,0,0,1|2,0,0]=3 2793 B12R2.1081 O=C1CCC[n+]2ccccc21 Amb2613491 [0,0,0,0,0,1|2,0,0]=3 2794 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,0,0,0,0,1|1,0,0]=2 2795 B12R2.1081 O=C1CCCc2cccnc21 Amb8393834 [0,0,0,0,0,1|2,0,0]=3 2796 B12R2.1081 O=C1CCCc2ccncc21 Amb19888360 [0,0,0,0,0,1|2,0,0]=3 2797 B12R2.1081 O=C1CCCc2ccncc21 Amb22727966 [0,0,0,0,0,1|2,0,0]=3 2798 B12R2.1081 O=C1CCCc2cnccc21 Amb10603887 [0,0,0,0,0,1|2,0,0]=3 2799 B12R2.1081 O=C1CCCc2cnccc21 Amb20621086 [0,0,0,0,0,1|2,0,0]=3 2800 B12R2.1081 O=C1CCCc2ncccc21 Amb19515604 [0,0,0,0,0,1|2,0,0]=3 2801 B12R2.1081 O=C1CCCc2ncccc21 Amb2695282 [0,0,0,0,0,1|2,0,0]=3 2802 B12R2.1081 O=C1CCCc2nccnc21 Amb25152857 [0,0,0,0,0,1|3,0,0]=4 2803 B12R2.1081 O=C1CCCc2ncncc21 Amb21965046 [0,0,0,0,0,1|3,0,0]=4 2804 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,0,0,0,0,1|1,0,0]=2 2805 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,0,0,0,0,1|1,0,0]=2 2806 B12R2.1081 O=C1CCNc2cccnc21 Amb27954552 [0,0,0,0,0,1|2,0,0]=3 2807 B12R2.1081 O=C1CCNc2ncccc21 Amb16233465 [0,0,0,0,0,1|2,0,0]=3 2808 B12R2.1081 O=C1CCNc2ncccc21 Amb33532494 [0,0,0,0,0,1|2,0,0]=3 2809 B12R2.1081 O=C1CCOc2ccccc21 Amb1153759 [0,0,0,0,0,1|1,0,0]=2 2810 B12R2.1081 O=C1CCOc2cccnc21 Amb33544080 [0,0,0,0,0,1|2,0,0]=3 2811 B12R2.1081 O=C1CCOc2cnccc21 Amb33742663 [0,0,0,0,0,1|2,0,0]=3 2812 B12R2.1081 O=C1CCOc2ncccc21 Amb24061183 [0,0,0,0,0,1|2,0,0]=3 2813 B12R2.1081 O=C1CCSc2ccccc21 Amb1151631 [0,0,0,0,0,1|1,0,0]=2 2814 B12R2.1081 O=C1CCSc2ncccc21 Amb27267960 [0,0,0,0,0,1|2,0,0]=3 2815 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,0,0,0,0,1|1,0,0]=2 2816 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,0,0,0,0,1|1,0,0]=2 2817 B12R2.1081 O=C1CNCc2ncccc21 Amb18202251 [0,0,0,0,0,1|2,0,0]=3 2818 B12R2.1081 O=C1CNCc2ncncc21 Amb18202159 [0,0,0,0,0,1|3,0,0]=4 2819 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,0,0,0,0,1|2,0,0]=3 2820 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,0,0,0,0,1|2,0,0]=3 2821 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,0,0,0,0,1|0,0,0]=1 2822 B12R2.1081 O=C1COCc2cccnc21 Amb27964992 [0,0,0,0,0,1|1,0,0]=2 2823 B12R2.1081 O=C1COCc2ncccc21 Amb25152848 [0,0,0,0,0,1|1,0,0]=2 2824 B12R2.1081 O=C1COCc2ncncc21 Amb18202030 [0,0,0,0,0,1|2,0,0]=3 2825 B12R2.1081 O=C1CSCc2ccccc21 Amb2733969 [0,0,0,0,0,1|0,1,0]=2 2826 B12R2.1081 O=C1CSCc2cnccc21 Amb27974060 [0,0,0,0,0,1|1,1,0]=3 2827 B12R2.1081 O=C1CSCc2ncncc21 Amb18827726 [0,0,0,0,0,1|2,1,0]=4 2828 B12R2.1081 O=C1N=CN=C2C=CC=CN12 Amb27843723 [0,0,0,0,0,1|2,0,1]=4 2829 B12R2.1081 O=C1N=CNc2ncccc21 Amb19957598 [0,0,0,0,0,1|2,0,1]=4 2830 B12R2.1081 O=C1N=NC=C2NC=CC=C12 Amb19515546 [0,0,0,0,0,1|2,0,1]=4 2831 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,0,0,0,0,1|2,0,0]=3 2832 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,0,0,0,0,1|1,0,1]=3 2833 B12R2.1081 O=C1NC=Cc2cccnc21 Amb19958600 [0,0,0,0,0,1|2,0,1]=4 2834 B12R2.1081 O=C1NC=Cc2ccncc21 Amb21960470 [0,0,0,0,0,1|2,0,1]=4 2835 B12R2.1081 O=C1NC=Cc2ccncc21 Amb22496100 [0,0,0,0,0,1|2,0,1]=4 2836 B12R2.1081 O=C1NC=Cc2ccncc21 Amb33421959 [0,0,0,0,0,1|2,0,1]=4 2837 B12R2.1081 O=C1NC=Cc2cnccc21 Amb20241097 [0,0,0,0,0,1|2,0,1]=4 2838 B12R2.1081 O=C1NC=Cc2ncccc21 Amb19882327 [0,0,0,0,0,1|2,0,1]=4 2839 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [0,0,0,0,0,1|1,0,1]=3 2840 B12R2.1081 O=C1NC=Nc2ccncc21 Amb22001741 [0,0,0,0,0,1|2,0,1]=4 2841 B12R2.1081 O=C1NC=Nc2cnccc21 Amb19957554 [0,0,0,0,0,1|2,0,1]=4 2842 B12R2.1081 O=C1NC=Nc2ncccc21 Amb18026152 [0,0,0,0,0,1|2,0,1]=4 2843 B12R2.1081 O=C1NCCc2ccccc21 Amb2502473 [0,0,0,0,0,1|1,0,0]=2 2844 B12R2.1081 O=C1NCCc2cccnc21 Amb22234340 [0,0,0,0,0,1|2,0,0]=3 2845 B12R2.1081 O=C1NCCc2ccncc21 Amb18202262 [0,0,0,0,0,1|2,0,0]=3 2846 B12R2.1081 O=C1NCCc2ccncc21 Amb35750745 [0,0,0,0,0,1|2,0,0]=3 2847 B12R2.1081 O=C1NCCc2ncccc21 Amb22002362 [0,0,0,0,0,1|2,0,0]=3 2848 B12R2.1081 O=C1NCCc2ncncc21 Amb28068894 [0,0,0,0,0,1|3,0,0]=4 2849 B12R2.1081 O=C1NCNc2ccncc21 Amb24419756 [0,0,0,0,0,1|2,0,0]=3 2850 B12R2.1081 O=C1NCSc2ccccc21 Amb27646438 [0,0,0,0,0,1|1,0,0]=2 2851 B12R2.1081 O=C1NN=Cc2ccccc21 Amb19338634 [0,0,0,0,0,1|1,0,1]=3 2852 B12R2.1081 O=C1NN=Cc2cccnc21 Amb19336036 [0,0,0,0,0,1|2,0,1]=4 2853 B12R2.1081 O=C1NN=Cc2cnccc21 Amb23557709 [0,0,0,0,0,1|2,0,1]=4 2854 B12R2.1081 O=C1NN=Cc2ncccc21 Amb19278034 [0,0,0,0,0,1|2,0,1]=4 2855 B12R2.1081 O=C1NN=Nc2ccccc21 Amb17933278 [0,0,0,0,0,1|2,0,0]=3 2856 B12R2.1081 O=C1NN=Nc2cccnc21 Amb25787175 [0,0,0,0,0,1|3,0,0]=4 2857 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,0,0,0,0,1|1,0,0]=2 2858 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,0,0,0,0,1|1,0,0]=2 2859 B12R2.1081 O=C1NNCc2ncccc21 Amb27823289 [0,0,0,0,0,1|2,0,0]=3 2860 B12R2.1081 O=C1NOCc2ccccc21 Amb26878656 [0,0,0,0,0,1|0,0,0]=1 2861 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,0,0,0,0,1|0,0,1]=2 2862 B12R2.1081 O=C1OC=Cc2cccnc21 Amb19323216 [0,0,0,0,0,1|1,0,1]=3 2863 B12R2.1081 O=C1OC=Cc2ncncc21 Amb24119967 [0,0,0,0,0,1|2,0,1]=4 2864 B12R2.1081 O=C1OC=Nc2ccccc21 Amb26019177 [0,0,0,0,0,1|0,0,1]=2 2865 B12R2.1081 O=C1OCCc2ccccc21 Amb16232507 [0,0,0,0,0,1|0,0,0]=1 2866 B12R2.1081 O=C1OCCc2ccncc21 Amb22372215 [0,0,0,0,0,1|1,0,0]=2 2867 B12R2.1081 O=C1OCCc2cnccc21 Amb27879707 [0,0,0,0,0,1|1,0,0]=2 2868 B12R2.1081 O=C1ON=Cc2ccccc21 Amb27628760 [0,0,0,0,0,1|0,0,1]=2 2869 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,0,0,0,0,1|0,1,0]=2 2870 B12R2.1081 O=S1CCNc2ccccc21 Amb1106281 [0,0,0,0,0,1|2,0,0]=3 2871 B12R2.1081 O=S1CCOc2ccccc21 Amb33189180 [0,0,0,0,0,1|2,0,0]=3 2872 B12R2.1081 OB1OCCc2ccccc21 Amb10070693 [0,0,0,0,0,1|1,0,1]=3 2873 B12R2.1081 OC1=C2C=CC=CN2CC=C1 Amb17835332 [0,0,0,0,0,1|2,0,1]=4 2874 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,0,0,0,0,1|2,0,1]=4 2875 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [0,0,0,0,0,1|0,0,1]=2 2876 B12R2.1081 OC1CCCc2ccccc21 Amb9702810 [0,0,0,0,0,1|1,0,2]=4 2877 B12R2.1081 OC1CCNc2ccccc21 Amb10553386 [0,0,0,0,0,1|1,0,2]=4 2878 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,0,0,0,0,1|1,0,2]=4 2879 B12R2.1081 OC1CCOc2ccccc21 Amb2719725 [0,0,0,0,0,1|1,0,2]=4 2880 B12R2.1081 OC1CCSc2ccccc21 Amb9748233 [0,0,0,0,0,1|1,0,2]=4 2881 B12R2.1081 OC1CNCc2ccccc21 Amb16233378 [0,0,0,0,0,1|1,0,2]=4 2882 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,0,0,0,0,1|1,0,2]=4 2883 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,0,0,0,0,1|0,0,2]=3 2884 B12R2.1081 OC1CSCc2ccccc21 Amb9619601 [0,0,0,0,0,1|0,1,2]=4 2885 B12R2.1081 OC1OCCc2ccccc21 Amb27860258 [0,0,0,0,0,1|0,0,2]=3 2886 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,0,0,0,0,1|1,0,2]=4 2887 B12R2.1081 O[C@@H]1CCOc2ccccc21 Amb561634 [0,0,0,0,0,1|1,0,2]=4 2888 B12R2.1081 O[C@@H]1CCSc2ccccc21 Amb13952924 [0,0,0,0,0,1|1,0,2]=4 2889 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,0,0,0,0,1|0,0,2]=3 2890 B12R2.1081 O[C@@H]1CSCc2ccccc21 Amb27836959 [0,0,0,0,0,1|0,1,2]=4 2891 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [0,0,0,0,0,1|1,0,2]=4 2892 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,0,0,0,0,1|1,0,2]=4 2893 B12R2.1081 O[C@H]1CCOc2ccccc21 Amb2609035 [0,0,0,0,0,1|1,0,2]=4 2894 B12R2.1081 O[C@H]1CCSc2ccccc21 Amb13952926 [0,0,0,0,0,1|1,0,2]=4 2895 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,0,0,0,0,1|1,0,2]=4 2896 B12R2.1081 Oc1cccc2ccccc12 Amb2609031 [0,0,0,0,0,1|1,0,2]=4 2897 B12R2.1081 Oc1ccnc2ccccc12 Amb2719646 [0,0,0,0,0,1|1,0,2]=4 2898 B12R2.1081 Oc1cncc2ccccc12 Amb10553148 [0,0,0,0,0,1|1,0,2]=4 2899 B12R2.1081 Oc1cncc2ccccc12 Amb21964404 [0,0,0,0,0,1|1,0,2]=4 2900 B12R2.1081 Oc1cnnc2ccccc12 Amb2371264 [0,0,0,0,0,1|2,0,1]=4 2901 B12R2.1081 Oc1cnnc2ccccc12 Amb482495 [0,0,0,0,0,1|2,0,1]=4 2902 B12R2.1081 Oc1nccc2ccccc12 Amb2610663 [0,0,0,0,0,1|1,0,2]=4 2903 B12R2.1081 Oc1ncnc2ccccc12 Amb6335374 [0,0,0,0,0,1|1,0,2]=4 2904 B12R2.1081 Oc1nncc2ccccc12 Amb4138464 [0,0,0,0,0,1|1,0,2]=4 2905 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [0,0,0,0,0,1|1,1,1]=4 2906 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [0,0,0,0,0,1|2,1,0]=4 2907 B12R2.1081 S=C1NC=Nc2ccccc21 Amb18015575 [0,0,0,0,0,1|1,1,1]=4 2908 B12R2.1081 S=C1NCCc2ccccc21 Amb2725056 [0,0,0,0,0,1|1,1,0]=3 2909 B12R2.1081 S=C1NN=Cc2ccccc21 Amb18043134 [0,0,0,0,0,1|1,1,1]=4 2910 B12R2.1081 SC1CCCc2ccccc21 Amb9208036 [0,0,0,0,0,1|1,1,1]=4 2911 B12R2.1081 SC1CCNc2ccccc21 Amb26423876 [0,0,0,0,0,1|1,1,1]=4 2912 B12R2.1081 SC1CCOc2ccccc21 Amb9208037 [0,0,0,0,0,1|1,1,1]=4 2913 B12R2.1081 SC1CCSc2ccccc21 Amb9208043 [0,0,0,0,0,1|1,1,1]=4 2914 B12R2.1081 SC1COCc2ccccc21 Amb28349489 [0,0,0,0,0,1|0,1,1]=3 2915 B12R2.1081 SC1CSCc2ccccc21 Amb32788444 [0,0,0,0,0,1|0,2,1]=4 2916 B12R2.1081 Sc1cccc2ccccc12 Amb8516722 [0,0,0,0,0,1|1,1,1]=4 2917 B12R2.1081 Sc1ccnc2ccccc12 Amb10603792 [0,0,0,0,0,1|1,1,1]=4 2918 B12R2.1081 Sc1cnnc2ccccc12 Amb2371342 [0,0,0,0,0,1|2,1,0]=4 2919 B12R2.1081 Sc1nccc2ccccc12 Amb5716285 [0,0,0,0,0,1|1,1,1]=4 2920 B12R2.1081 Sc1ncnc2ccccc12 Amb1104189 [0,0,0,0,0,1|1,1,1]=4 2921 B12R2.1081 Sc1nncc2ccccc12 Amb1149056 [0,0,0,0,0,1|1,1,1]=4 2922 B12R2.1081 Sc1nnnc2ccccc12 Amb2606147 [0,0,0,0,0,1|2,1,0]=4 2923 B12R2.1081 [Mg+]c1cccc2ccccc12 Amb22044005 [0,0,0,0,0,1|2,0,1]=4 2924 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,0,0,0,0,1|2,0,1]=4 2925 B12R2.1081 [S-]c1cccc2ccccc12 Amb33513016 [0,0,0,0,0,1|1,1,1]=4 2926 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [1,0,1,0,0,0|1,0,1]=4 2927 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [1,0,1,0,0,0|1,0,0]=3 2928 B9R1.6 C=C(C)c1ccccn1 Amb25077592 [1,0,1,0,0,0|2,0,0]=4 2929 B9R1.6 C=C(C)c1cccnc1 Amb26389581 [1,0,1,0,0,0|2,0,0]=4 2930 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [1,0,1,0,0,0|2,0,0]=4 2931 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [1,0,1,0,0,0|1,0,1]=4 2932 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [1,0,1,0,0,0|1,0,1]=4 2933 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [1,0,1,0,0,0|2,0,0]=4 2934 B9R1.6 CC(=O)C1C=CC=CN1 Amb27849933 [1,0,1,0,0,0|1,0,1]=4 2935 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [1,0,1,0,0,0|0,0,0]=2 2936 B9R1.6 CC(=O)c1ccccn1 Amb932786 [1,0,1,0,0,0|1,0,0]=3 2937 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [1,0,1,0,0,0|1,0,0]=3 2938 B9R1.6 CC(=O)c1cccnn1 Amb20242017 [1,0,1,0,0,0|2,0,0]=4 2939 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [1,0,1,0,0,0|1,0,0]=3 2940 B9R1.6 CC(=O)c1ccncn1 Amb19959228 [1,0,1,0,0,0|2,0,0]=4 2941 B9R1.6 CC(=O)c1ccnnc1 Amb19958070 [1,0,1,0,0,0|2,0,0]=4 2942 B9R1.6 CC(=O)c1cnccn1 Amb2684281 [1,0,1,0,0,0|2,0,0]=4 2943 B9R1.6 CC(=O)c1cncnc1 Amb8631038 [1,0,1,0,0,0|2,0,0]=4 2944 B9R1.6 CC(=O)c1ncccn1 Amb33534997 [1,0,1,0,0,0|2,0,0]=4 2945 B9R1.6 CC(Br)c1ccccc1 Amb5716854 [1,0,1,0,0,0|1,0,1]=4 2946 B9R1.6 CC(C)c1ccccc1 Amb2793016 [1,0,1,0,0,0|1,0,1]=4 2947 B9R1.6 CC(C)c1ccccc1 Amb33524021 [1,0,1,0,0,0|1,0,1]=4 2948 B9R1.6 CC(Cl)c1ccccc1 Amb5716855 [1,0,1,0,0,0|1,0,1]=4 2949 B9R1.6 CC(N)c1ccccc1 Amb5716844 [1,0,1,0,0,0|1,0,1]=4 2950 B9R1.6 CC(O)c1ccccc1 Amb3940114 [1,0,1,0,0,0|0,0,2]=4 2951 B9R1.6 CC(S)c1ccccc1 Amb6256013 [1,0,1,0,0,0|0,1,1]=4 2952 B9R1.6 CN(C)c1ccccc1 Amb2793014 [1,0,1,0,0,0|2,0,0]=4 2953 B9R1.6 CN(N)c1ccccc1 Amb1153615 [1,0,1,0,0,0|2,0,0]=4 2954 B9R1.6 CN(N)c1ccccc1 Amb22754142 [1,0,1,0,0,0|2,0,0]=4 2955 B9R1.6 CN(N)c1ccccc1 Amb33172726 [1,0,1,0,0,0|2,0,0]=4 2956 B9R1.6 CN(N)c1ccccc1 Amb9677307 [1,0,1,0,0,0|2,0,0]=4 2957 B9R1.6 CN(O)c1ccccc1 Amb28245898 [1,0,1,0,0,0|1,0,1]=4 2958 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [1,0,1,0,0,0|2,0,0]=4 2959 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [1,0,1,0,0,0|1,0,0]=3 2960 B9R1.6 CS(=O)c1ccccn1 Amb24562247 [1,0,1,0,0,0|2,0,0]=4 2961 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [1,0,1,0,0,0|1,0,1]=4 2962 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [1,0,1,0,0,0|1,0,1]=4 2963 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [1,0,1,0,0,0|1,0,1]=4 2964 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [1,0,1,0,0,0|0,0,2]=4 2965 B9R1.6 C[C@@H](S)c1ccccc1 Amb28069838 [1,0,1,0,0,0|0,1,1]=4 2966 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [1,0,1,0,0,0|1,0,1]=4 2967 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [1,0,1,0,0,0|0,0,2]=4 2968 B9R1.6 C[C@H](S)c1ccccc1 Amb25935694 [1,0,1,0,0,0|0,1,1]=4 2969 B9R1.6 C[S+](C)c1ccccc1 Amb27958149 [1,0,1,0,0,0|2,0,0]=4 2970 B9R1.6 C[Si](C)c1ccccc1 Amb33781101 [1,0,1,0,0,0|1,1,0]=4 2971 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [1,0,1,0,0,0|2,0,0]=4 2972 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [1,0,1,0,0,0|2,0,0]=4 2973 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [1,0,1,0,0,0|2,0,0]=4 2974 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [1,0,1,0,0,0|2,0,0]=4 2975 B9R1.6 NC(=O)[n+]1ccccc1 Amb27806689 [1,0,1,0,0,0|2,0,0]=4 2976 B9R1.6 NC(=O)c1ccc[nH+]c1 Amb8465811 [1,0,1,0,0,0|2,0,0]=4 2977 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [1,0,1,0,0,0|1,0,0]=3 2978 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [1,0,1,0,0,0|2,0,0]=4 2979 B9R1.6 NC(=O)c1cccnc1 Amb2609940 [1,0,1,0,0,0|2,0,0]=4 2980 B9R1.6 NC(=O)c1ccncc1 Amb5721989 [1,0,1,0,0,0|2,0,0]=4 2981 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [1,0,1,0,0,0|1,1,0]=4 2982 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [1,0,1,0,0,0|2,0,0]=4 2983 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [1,0,1,0,0,0|1,0,0]=3 2984 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [1,0,1,0,0,0|2,0,0]=4 2985 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [1,0,1,0,0,0|1,0,0]=3 2986 B9R1.6 O=C(Cl)c1ccccn1 Amb22492448 [1,0,1,0,0,0|2,0,0]=4 2987 B9R1.6 O=C(Cl)c1ccccn1 Amb2690341 [1,0,1,0,0,0|2,0,0]=4 2988 B9R1.6 O=C(Cl)c1ccccn1 Amb3939534 [1,0,1,0,0,0|2,0,0]=4 2989 B9R1.6 O=C(Cl)c1cccnc1 Amb33531191 [1,0,1,0,0,0|2,0,0]=4 2990 B9R1.6 O=C(Cl)c1cccnc1 Amb839669 [1,0,1,0,0,0|2,0,0]=4 2991 B9R1.6 O=C(Cl)c1ccncc1 Amb2707217 [1,0,1,0,0,0|2,0,0]=4 2992 B9R1.6 O=C(Cl)c1ccncc1 Amb2720189 [1,0,1,0,0,0|2,0,0]=4 2993 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [1,0,1,0,0,0|1,0,0]=3 2994 B9R1.6 O=C(O)C1=CCOC=C1 Amb27860440 [1,0,1,0,0,0|1,0,1]=4 2995 B9R1.6 O=C(O)C1C=CCC=C1 Amb17593268 [1,0,1,0,0,0|0,0,2]=4 2996 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [1,0,1,0,0,0|0,0,0]=2 2997 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [1,0,1,0,0,0|0,0,0]=2 2998 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [1,0,1,0,0,0|0,0,0]=2 2999 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [1,0,1,0,0,0|0,0,0]=2 3000 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [1,0,1,0,0,0|1,0,0]=3 3001 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [1,0,1,0,0,0|1,0,0]=3 3002 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [1,0,1,0,0,0|1,0,0]=3 3003 B9R1.6 O=C(O)c1cccnn1 Amb33544461 [1,0,1,0,0,0|2,0,0]=4 3004 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [1,0,1,0,0,0|1,0,0]=3 3005 B9R1.6 O=C(O)c1ccncn1 Amb1102414 [1,0,1,0,0,0|2,0,0]=4 3006 B9R1.6 O=C(O)c1ccnnc1 Amb2691390 [1,0,1,0,0,0|2,0,0]=4 3007 B9R1.6 O=C(O)c1cnccn1 Amb2455963 [1,0,1,0,0,0|2,0,0]=4 3008 B9R1.6 O=C(O)c1cncnc1 Amb24099331 [1,0,1,0,0,0|2,0,0]=4 3009 B9R1.6 O=C(O)c1cncnc1 Amb33527289 [1,0,1,0,0,0|2,0,0]=4 3010 B9R1.6 O=C(O)c1ncccn1 Amb19330380 [1,0,1,0,0,0|2,0,0]=4 3011 B9R1.6 O=C(O)c1ncccn1 Amb2720395 [1,0,1,0,0,0|2,0,0]=4 3012 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [1,0,1,0,0,0|0,1,0]=3 3013 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [1,0,1,0,0,0|0,0,1]=3 3014 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [1,0,1,0,0,0|0,0,1]=3 3015 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [1,0,1,0,0,0|0,0,1]=3 3016 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [1,0,1,0,0,0|0,0,1]=3 3017 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [1,0,1,0,0,0|0,0,1]=3 3018 B9R1.6 O=C([O-])c1ccccn1 Amb22058087 [1,0,1,0,0,0|1,0,1]=4 3019 B9R1.6 O=C([O-])c1ccccn1 Amb22734923 [1,0,1,0,0,0|1,0,1]=4 3020 B9R1.6 O=C([O-])c1ccccn1 Amb8393579 [1,0,1,0,0,0|1,0,1]=4 3021 B9R1.6 O=C([O-])c1ccccn1 Amb8393582 [1,0,1,0,0,0|1,0,1]=4 3022 B9R1.6 O=C([O-])c1ccncc1 Amb22730239 [1,0,1,0,0,0|1,0,1]=4 3023 B9R1.6 O=I(=O)c1ccccc1 Amb9679129 [1,0,1,0,0,0|1,0,1]=4 3024 B9R1.6 O=S(Cl)c1ccccc1 Amb13881360 [1,0,1,0,0,0|2,0,0]=4 3025 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [1,0,1,0,0,0|1,0,0]=3 3026 B9R1.6 O=S(O)c1cccnc1 Amb24062548 [1,0,1,0,0,0|2,0,0]=4 3027 B9R1.6 O=S(O)c1cccnc1 Amb32674890 [1,0,1,0,0,0|2,0,0]=4 3028 B9R1.6 O=S([O-])c1ccccc1 Amb2684569 [1,0,1,0,0,0|1,0,1]=4 3029 B9R1.6 O=S([O-])c1ccccc1 Amb28536248 [1,0,1,0,0,0|1,0,1]=4 3030 B9R1.6 O=[N+]([O-])c1ccccc1 Amb2793077 [1,0,1,0,0,0|1,0,1]=4 3031 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [1,0,1,0,0,0|1,0,0]=3 3032 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [1,0,1,0,0,0|1,0,0]=3 3033 B9R1.6 OB(O)c1ccccc1 Amb22587706 [1,0,1,0,0,0|1,0,1]=4 3034 B9R1.6 OB(O)c1ccccc1 Amb6365485 [1,0,1,0,0,0|1,0,1]=4 3035 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [1,0,1,0,0,0|0,1,0]=3 3036 B9R1.6 OC(=S)c1cccnc1 Amb22731908 [1,0,1,0,0,0|1,1,0]=4 3037 B9R1.6 OP(O)c1ccccc1 Amb2684568 [1,0,1,0,0,0|1,0,1]=4 3038 B9R1.6 O[C@@H](Br)c1ccccc1 Amb27233551 [1,0,1,0,0,0|1,0,1]=4 3039 B9R1.6 O[C@@H](Cl)c1ccccc1 Amb28119929 [1,0,1,0,0,0|1,0,1]=4 3040 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [1,0,1,0,0,0|1,1,0]=4 3041 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [1,0,1,0,0,0|0,2,0]=4 3042 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,1,0,0,0|1,0,1]=4 3043 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [1,0,1,0,0,0|1,0,1]=4 3044 B9R1.8 C#COc1ccccc1 Amb27194589 [1,0,1,0,0,0|1,0,1]=4 3045 B9R1.8 C#NCc1ccccc1 Amb31132452 [1,0,1,0,0,0|1,0,1]=4 3046 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [1,0,1,0,0,0|2,0,0]=4 3047 B9R1.8 C=CCc1ccccc1 Amb2599341 [1,0,1,0,0,0|1,0,0]=3 3048 B9R1.8 C=CCc1cccnc1 Amb24477831 [1,0,1,0,0,0|2,0,0]=4 3049 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,1,0,0,0|1,0,0]=3 3050 B9R1.8 C=COc1cccnc1 Amb24085952 [1,0,1,0,0,0|2,0,0]=4 3051 B9R1.8 C=CSc1ccccc1 Amb8387516 [1,0,1,0,0,0|1,1,0]=4 3052 B9R1.8 C=NCc1ccccc1 Amb28256747 [1,0,1,0,0,0|1,0,0]=3 3053 B9R1.8 C=NCc1ccncc1 Amb27758185 [1,0,1,0,0,0|2,0,0]=4 3054 B9R1.8 CC#Cc1ccccc1 Amb8513696 [1,0,1,0,0,0|1,0,1]=4 3055 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,1,0,0,0|1,0,1]=4 3056 B9R1.8 CCNc1ccccc1 Amb3940127 [1,0,1,0,0,0|2,0,0]=4 3057 B9R1.8 CCOc1ccccc1 Amb2842270 [1,0,1,0,0,0|1,0,1]=4 3058 B9R1.8 CCSc1ccccc1 Amb2687929 [1,0,1,0,0,0|2,0,0]=4 3059 B9R1.8 CNCc1ccccc1 Amb3699562 [1,0,1,0,0,0|1,0,1]=4 3060 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,1,0,0,0|2,0,0]=4 3061 B9R1.8 CNNc1ccccc1 Amb27969267 [1,0,1,0,0,0|2,0,0]=4 3062 B9R1.8 COCc1ccccc1 Amb2782562 [1,0,1,0,0,0|0,0,1]=3 3063 B9R1.8 COCc1ccccn1 Amb4017561 [1,0,1,0,0,0|1,0,1]=4 3064 B9R1.8 CSSc1ccccc1 Amb4008371 [1,0,1,0,0,0|1,1,0]=4 3065 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,1,0,0,0|1,0,1]=4 3066 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [1,0,1,0,0,0|1,0,0]=3 3067 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [1,0,1,0,0,0|1,0,0]=3 3068 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [1,0,1,0,0,0|2,0,0]=4 3069 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [1,0,1,0,0,0|1,0,0]=3 3070 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [1,0,1,0,0,0|2,0,0]=4 3071 B9R1.8 ClCCc1ccccc1 Amb535682 [1,0,1,0,0,0|1,0,1]=4 3072 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,1,0,0,0|1,0,1]=4 3073 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,1,0,0,0|1,0,1]=4 3074 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,1,0,0,0|1,0,1]=4 3075 B9R1.8 ICCc1ccccc1 Amb8515353 [1,0,1,0,0,0|1,0,1]=4 3076 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,1,0,0,0|1,0,1]=4 3077 B9R1.8 N#CCc1ccccc1 Amb3598087 [1,0,1,0,0,0|1,0,1]=4 3078 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,1,0,0,0|1,0,1]=4 3079 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,1,0,0,0|1,0,1]=4 3080 B9R1.8 NCCc1ccccc1 Amb2792829 [1,0,1,0,0,0|1,0,1]=4 3081 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,1,0,0,0|1,0,1]=4 3082 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,1,0,0,0|2,0,0]=4 3083 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,1,0,0,0|2,0,0]=4 3084 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,1,0,0,0|2,0,0]=4 3085 B9R1.8 NNCc1ccccc1 Amb8513062 [1,0,1,0,0,0|2,0,0]=4 3086 B9R1.8 NNCc1ccccc1 Amb9826089 [1,0,1,0,0,0|2,0,0]=4 3087 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,1,0,0,0|1,0,0]=3 3088 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,1,0,0,0|1,0,0]=3 3089 B9R1.8 NOCc1ccccc1 Amb6600539 [1,0,1,0,0,0|1,0,0]=3 3090 B9R1.8 NOCc1ccccn1 Amb18642195 [1,0,1,0,0,0|2,0,0]=4 3091 B9R1.8 NOCc1ccccn1 Amb32663271 [1,0,1,0,0,0|2,0,0]=4 3092 B9R1.8 NOCc1cccnc1 Amb24074265 [1,0,1,0,0,0|2,0,0]=4 3093 B9R1.8 NOCc1cccnc1 Amb33546939 [1,0,1,0,0,0|2,0,0]=4 3094 B9R1.8 NOCc1ccncc1 Amb22397036 [1,0,1,0,0,0|2,0,0]=4 3095 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,1,0,0,0|2,0,0]=4 3096 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [1,0,1,0,0,0|2,0,0]=4 3097 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [1,0,1,0,0,0|2,0,0]=4 3098 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [1,0,1,0,0,0|1,0,1]=4 3099 B9R1.8 O=CCc1ccccc1 Amb3939950 [1,0,1,0,0,0|0,0,0]=2 3100 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,1,0,0,0|1,0,0]=3 3101 B9R1.8 O=CCc1cccnc1 Amb8011002 [1,0,1,0,0,0|1,0,0]=3 3102 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,1,0,0,0|1,0,0]=3 3103 B9R1.8 O=CCc1cnccn1 Amb25124492 [1,0,1,0,0,0|2,0,0]=4 3104 B9R1.8 O=CCc1cncnc1 Amb24634482 [1,0,1,0,0,0|2,0,0]=4 3105 B9R1.8 O=CCc1ncccn1 Amb24061341 [1,0,1,0,0,0|2,0,0]=4 3106 B9R1.8 O=CNc1ccccc1 Amb2613772 [1,0,1,0,0,0|1,0,0]=3 3107 B9R1.8 O=CNc1ccccn1 Amb3319168 [1,0,1,0,0,0|2,0,0]=4 3108 B9R1.8 O=CNc1cccnc1 Amb4019648 [1,0,1,0,0,0|2,0,0]=4 3109 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,1,0,0,0|0,0,0]=2 3110 B9R1.8 O=C\C=C1\C=CC=CN1 Amb24068319 [1,0,1,0,0,0|1,0,1]=4 3111 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [1,0,1,0,0,0|1,1,0]=4 3112 B9R1.8 OCCc1ccccc1 Amb2793058 [1,0,1,0,0,0|0,0,2]=4 3113 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,1,0,0,0|1,0,1]=4 3114 B9R1.8 ONCc1ccccc1 Amb9825936 [1,0,1,0,0,0|1,0,1]=4 3115 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [1,0,1,0,0,0|2,0,0]=4 3116 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,1,0,0,0|2,0,0]=4 3117 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,1,0,0,0|1,1,0]=4 3118 B9R1.8 SCCc1ccccc1 Amb6255605 [1,0,1,0,0,0|0,1,1]=4 3119 B9R1.8 SSCc1ccccc1 Amb27646980 [1,0,1,0,0,0|0,2,0]=4 3120 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,1,0,0,0|1,0,1]=4 3121 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,1,0,0,0|2,0,0]=4 3122 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,1,0,0,0|1,0,1]=4 3123 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [1,0,1,0,0,0|1,0,0]=3 3124 B9R1.7 C=CCC1=CC(=O)CC1 Amb28396895 [1,0,1,0,0,0|1,0,1]=4 3125 B9R1.7 C=C\C=C1\CCC(=O)N1 Amb26642001 [1,0,1,0,0,0|2,0,0]=4 3126 B9R1.7 C=C\C=C1\CCC(=O)O1 Amb27488468 [1,0,1,0,0,0|2,0,0]=4 3127 B9R1.12 C=C\C=C\c1cccs1 Amb26418485 [1,0,1,0,0,0|2,0,0]=4 3128 B9R1.12 C=C\C=C\c1ccsc1 Amb26569661 [1,0,1,0,0,0|0,1,1]=4 3129 B9R1.12 O=C\C=C\c1ccoc1 Amb33136412 [1,0,1,0,0,0|1,0,1]=4 3130 B9R1.12 O=C\C=C\c1ccon1 Amb33197559 [1,0,1,0,0,0|2,0,0]=4 3131 B9R1.15 Bc1ccccc1CN Amb27463133 [1,0,1,0,0,0|2,0,0]=4 3132 B9R1.15 BrCc1ccccc1Br Amb1152530 [1,0,1,0,0,0|2,0,0]=4 3133 B9R1.15 BrCc1ccccc1I Amb8397039 [1,0,1,0,0,0|2,0,0]=4 3134 B9R1.15 C#Cc1ccccc1C Amb8394567 [1,0,1,0,0,0|1,0,1]=4 3135 B9R1.15 C#Cc1ccccc1O Amb10603592 [1,0,1,0,0,0|1,0,1]=4 3136 B9R1.15 C=Cc1ccccc1Br Amb6365618 [1,0,1,0,0,0|2,0,0]=4 3137 B9R1.15 C=Cc1ccccc1C Amb2695476 [1,0,1,0,0,0|1,0,0]=3 3138 B9R1.15 C=Cc1ccccc1Cl Amb3940227 [1,0,1,0,0,0|2,0,0]=4 3139 B9R1.15 C=Cc1ccccc1F Amb3940550 [1,0,1,0,0,0|2,0,0]=4 3140 B9R1.15 C=Cc1ccccc1I Amb8384620 [1,0,1,0,0,0|2,0,0]=4 3141 B9R1.15 C=Cc1ccccc1N Amb17593221 [1,0,1,0,0,0|2,0,0]=4 3142 B9R1.15 C=Cc1ccccc1N Amb21857764 [1,0,1,0,0,0|2,0,0]=4 3143 B9R1.15 C=Cc1ccccc1O Amb17593227 [1,0,1,0,0,0|1,0,0]=3 3144 B9R1.15 C=Cc1cccnc1C Amb24432711 [1,0,1,0,0,0|2,0,0]=4 3145 B9R1.15 C=Cc1ccncc1C Amb26856969 [1,0,1,0,0,0|2,0,0]=4 3146 B9R1.15 C=Cc1ccncc1O Amb25358569 [1,0,1,0,0,0|2,0,0]=4 3147 B9R1.15 C=Cc1cnccc1C Amb27860156 [1,0,1,0,0,0|2,0,0]=4 3148 B9R1.15 C=Cc1ncccc1C Amb28120463 [1,0,1,0,0,0|2,0,0]=4 3149 B9R1.15 CC1C=CNC=C1C=O Amb27872192 [1,0,1,0,0,0|1,0,1]=4 3150 B9R1.15 CCC1=CNC=CC1=O Amb24062648 [1,0,1,0,0,0|2,0,0]=4 3151 B9R1.15 CCN1C=CC=CC1=O Amb22359913 [1,0,1,0,0,0|2,0,0]=4 3152 B9R1.15 CCc1ccccc1Br Amb3939183 [1,0,1,0,0,0|2,0,0]=4 3153 B9R1.15 CCc1ccccc1C Amb8397274 [1,0,1,0,0,0|1,0,1]=4 3154 B9R1.15 CCc1ccccc1Cl Amb2685897 [1,0,1,0,0,0|2,0,0]=4 3155 B9R1.15 CCc1ccccc1F Amb10840487 [1,0,1,0,0,0|2,0,0]=4 3156 B9R1.15 CCc1ccccc1I Amb2688848 [1,0,1,0,0,0|2,0,0]=4 3157 B9R1.15 CCc1ccccc1N Amb2792823 [1,0,1,0,0,0|2,0,0]=4 3158 B9R1.15 CCc1ccccc1O Amb3939546 [1,0,1,0,0,0|1,0,1]=4 3159 B9R1.15 CCc1ccccc1S Amb2687958 [1,0,1,0,0,0|1,1,0]=4 3160 B9R1.15 CN1C=CC=CC1C=O Amb27797982 [1,0,1,0,0,0|1,0,1]=4 3161 B9R1.15 CNc1ccccc1C Amb22236040 [1,0,1,0,0,0|2,0,0]=4 3162 B9R1.15 CNc1ccccc1C Amb2689512 [1,0,1,0,0,0|2,0,0]=4 3163 B9R1.15 CNc1ccccc1O Amb6336644 [1,0,1,0,0,0|2,0,0]=4 3164 B9R1.15 COc1ccccc1C Amb8513241 [1,0,1,0,0,0|2,0,0]=4 3165 B9R1.15 COc1ccccc1O Amb3939629 [1,0,1,0,0,0|2,0,0]=4 3166 B9R1.15 CSc1ccccc1C Amb10571827 [1,0,1,0,0,0|2,0,0]=4 3167 B9R1.15 CSc1ccccc1O Amb2688795 [1,0,1,0,0,0|2,0,0]=4 3168 B9R1.15 C[n+]1ccccc1C=O Amb27862804 [1,0,1,0,0,0|1,0,0]=3 3169 B9R1.15 Cc1ccccc1C#N Amb4123103 [1,0,1,0,0,0|1,0,1]=4 3170 B9R1.15 Cc1ccccc1C=O Amb2725485 [1,0,1,0,0,0|0,0,0]=2 3171 B9R1.15 Cc1ccccc1CBr Amb3939708 [1,0,1,0,0,0|1,0,1]=4 3172 B9R1.15 Cc1ccccc1CCl Amb2792896 [1,0,1,0,0,0|1,0,1]=4 3173 B9R1.15 Cc1ccccc1CN Amb1651810 [1,0,1,0,0,0|1,0,1]=4 3174 B9R1.15 Cc1ccccc1CN Amb24065797 [1,0,1,0,0,0|1,0,1]=4 3175 B9R1.15 Cc1ccccc1CO Amb837463 [1,0,1,0,0,0|0,0,1]=3 3176 B9R1.15 Cc1ccccc1CS Amb2726199 [1,0,1,0,0,0|0,1,1]=4 3177 B9R1.15 Cc1ccccc1N=O Amb22233124 [1,0,1,0,0,0|1,0,0]=3 3178 B9R1.15 Cc1ccccc1NN Amb1039461 [1,0,1,0,0,0|2,0,0]=4 3179 B9R1.15 Cc1ccccc1NN Amb1208830 [1,0,1,0,0,0|2,0,0]=4 3180 B9R1.15 Cc1ccccc1NN Amb22489459 [1,0,1,0,0,0|2,0,0]=4 3181 B9R1.15 Cc1ccccc1NO Amb21961958 [1,0,1,0,0,0|1,0,0]=3 3182 B9R1.15 Cc1ccccc1[Mg]Cl Amb22338469 [1,0,1,0,0,0|2,0,0]=4 3183 B9R1.15 Cc1ccccc1[N+]#N Amb27170151 [1,0,1,0,0,0|2,0,0]=4 3184 B9R1.15 Cc1ccccc1[NH2+]O Amb24113085 [1,0,1,0,0,0|1,0,0]=3 3185 B9R1.15 Cc1ccccc1[Ni]Cl Amb33611502 [1,0,1,0,0,0|2,0,0]=4 3186 B9R1.15 Cc1cccnc1C=O Amb2447573 [1,0,1,0,0,0|1,0,0]=3 3187 B9R1.15 Cc1cccnc1CO Amb22233995 [1,0,1,0,0,0|1,0,1]=4 3188 B9R1.15 Cc1cccnc1CO Amb2695614 [1,0,1,0,0,0|1,0,1]=4 3189 B9R1.15 Cc1ccncc1C=O Amb2447575 [1,0,1,0,0,0|1,0,0]=3 3190 B9R1.15 Cc1ccncc1CO Amb19892286 [1,0,1,0,0,0|1,0,1]=4 3191 B9R1.15 Cc1ccnnc1C=O Amb8010974 [1,0,1,0,0,0|2,0,0]=4 3192 B9R1.15 Cc1cnccc1C=O Amb2694741 [1,0,1,0,0,0|1,0,0]=3 3193 B9R1.15 Cc1cnccc1CO Amb2695451 [1,0,1,0,0,0|1,0,1]=4 3194 B9R1.15 Cc1cnccc1NO Amb27652342 [1,0,1,0,0,0|2,0,0]=4 3195 B9R1.15 Cc1cncnc1C=O Amb8010971 [1,0,1,0,0,0|2,0,0]=4 3196 B9R1.15 Cc1cnncc1C=O Amb8010978 [1,0,1,0,0,0|2,0,0]=4 3197 B9R1.15 Cc1ncccc1C=O Amb10602118 [1,0,1,0,0,0|1,0,0]=3 3198 B9R1.15 Cc1ncccc1CO Amb33533075 [1,0,1,0,0,0|1,0,1]=4 3199 B9R1.15 Cc1nccnc1C=O Amb8010980 [1,0,1,0,0,0|2,0,0]=4 3200 B9R1.15 Cc1ncncc1C=O Amb8010973 [1,0,1,0,0,0|2,0,0]=4 3201 B9R1.15 Cc1nnccc1C=O Amb8010977 [1,0,1,0,0,0|2,0,0]=4 3202 B9R1.15 ClCc1ccccc1Br Amb5395415 [1,0,1,0,0,0|2,0,0]=4 3203 B9R1.15 ClCc1ccccc1Cl Amb1691713 [1,0,1,0,0,0|2,0,0]=4 3204 B9R1.15 Clc1ccccc1CBr Amb2685772 [1,0,1,0,0,0|2,0,0]=4 3205 B9R1.15 Clc1ccccc1CI Amb33546475 [1,0,1,0,0,0|2,0,0]=4 3206 B9R1.15 FCc1ccccc1Br Amb25762101 [1,0,1,0,0,0|2,0,0]=4 3207 B9R1.15 Fc1ccccc1CBr Amb2688042 [1,0,1,0,0,0|2,0,0]=4 3208 B9R1.15 Fc1ccccc1CCl Amb6364744 [1,0,1,0,0,0|2,0,0]=4 3209 B9R1.15 Fc1ccccc1CS Amb2691866 [1,0,1,0,0,0|1,1,0]=4 3210 B9R1.15 N#Cc1ccccc1O Amb1803244 [1,0,1,0,0,0|1,0,1]=4 3211 B9R1.15 N#[N+]c1ccccc1O Amb28125164 [1,0,1,0,0,0|2,0,0]=4 3212 B9R1.15 N=C1C=CC=C\C1=C\Br Amb27607660 [1,0,1,0,0,0|2,0,0]=4 3213 B9R1.15 N=Cc1ccccc1Cl Amb26046361 [1,0,1,0,0,0|2,0,0]=4 3214 B9R1.15 N=Cc1ccccc1O Amb28382612 [1,0,1,0,0,0|1,0,0]=3 3215 B9R1.15 NCC1=CC=CNC1=O Amb18043158 [1,0,1,0,0,0|2,0,0]=4 3216 B9R1.15 NCC1=CC=CNC1=O Amb22054312 [1,0,1,0,0,0|2,0,0]=4 3217 B9R1.15 NCc1ccccc1Br Amb4037050 [1,0,1,0,0,0|2,0,0]=4 3218 B9R1.15 NCc1ccccc1Br Amb6365738 [1,0,1,0,0,0|2,0,0]=4 3219 B9R1.15 NCc1ccccc1Cl Amb19958655 [1,0,1,0,0,0|2,0,0]=4 3220 B9R1.15 NCc1ccccc1Cl Amb932820 [1,0,1,0,0,0|2,0,0]=4 3221 B9R1.15 NCc1ccccc1F Amb2780405 [1,0,1,0,0,0|2,0,0]=4 3222 B9R1.15 NCc1ccccc1F Amb535712 [1,0,1,0,0,0|2,0,0]=4 3223 B9R1.15 NCc1ccccc1I Amb8397048 [1,0,1,0,0,0|2,0,0]=4 3224 B9R1.15 NCc1ccccc1N Amb3941688 [1,0,1,0,0,0|2,0,0]=4 3225 B9R1.15 NCc1ccccc1N Amb8631266 [1,0,1,0,0,0|2,0,0]=4 3226 B9R1.15 NCc1ccccc1O Amb1111172 [1,0,1,0,0,0|1,0,1]=4 3227 B9R1.15 NCc1ccccc1O Amb13951900 [1,0,1,0,0,0|1,0,1]=4 3228 B9R1.15 NCc1ccccc1O Amb30594500 [1,0,1,0,0,0|1,0,1]=4 3229 B9R1.15 NCc1ccccc1S Amb27487957 [1,0,1,0,0,0|1,1,0]=4 3230 B9R1.15 NNc1ccccc1O Amb25827397 [1,0,1,0,0,0|2,0,0]=4 3231 B9R1.15 N[n+]1ccccc1CO Amb27839504 [1,0,1,0,0,0|2,0,0]=4 3232 B9R1.15 Nc1ccccc1C=O Amb30634288 [1,0,1,0,0,0|1,0,0]=3 3233 B9R1.15 Nc1ccccc1C=O Amb6307282 [1,0,1,0,0,0|1,0,0]=3 3234 B9R1.15 Nc1ccccc1CCl Amb6740281 [1,0,1,0,0,0|2,0,0]=4 3235 B9R1.15 Nc1ccccc1CF Amb19515970 [1,0,1,0,0,0|2,0,0]=4 3236 B9R1.15 Nc1ccccc1CO Amb1808337 [1,0,1,0,0,0|1,0,0]=3 3237 B9R1.15 Nc1ccccc1CS Amb27787743 [1,0,1,0,0,0|1,1,0]=4 3238 B9R1.15 Nc1ccccc1N=O Amb27216714 [1,0,1,0,0,0|2,0,0]=4 3239 B9R1.15 Nc1cccnc1C=O Amb2697303 [1,0,1,0,0,0|2,0,0]=4 3240 B9R1.15 Nc1cccnc1CO Amb2697304 [1,0,1,0,0,0|2,0,0]=4 3241 B9R1.15 Nc1ccncc1C=O Amb1094063 [1,0,1,0,0,0|2,0,0]=4 3242 B9R1.15 Nc1ccncc1C=O Amb19929570 [1,0,1,0,0,0|2,0,0]=4 3243 B9R1.15 Nc1ccncc1C=O Amb33622703 [1,0,1,0,0,0|2,0,0]=4 3244 B9R1.15 Nc1ccncc1C=O Amb33869903 [1,0,1,0,0,0|2,0,0]=4 3245 B9R1.15 Nc1ccncc1CO Amb2697298 [1,0,1,0,0,0|2,0,0]=4 3246 B9R1.15 Nc1cnccc1C=O Amb21963531 [1,0,1,0,0,0|2,0,0]=4 3247 B9R1.15 Nc1cnccc1C=O Amb2697296 [1,0,1,0,0,0|2,0,0]=4 3248 B9R1.15 Nc1cnccc1CO Amb2697302 [1,0,1,0,0,0|2,0,0]=4 3249 B9R1.15 Nc1ncccc1C=O Amb1090876 [1,0,1,0,0,0|2,0,0]=4 3250 B9R1.15 Nc1ncccc1CO Amb2608577 [1,0,1,0,0,0|2,0,0]=4 3251 B9R1.15 O=C1C=CNC=C1CBr Amb27970389 [1,0,1,0,0,0|2,0,0]=4 3252 B9R1.15 O=C1C=CNN=C1CO Amb28351522 [1,0,1,0,0,0|2,0,0]=4 3253 B9R1.15 O=C1NC=CC=C1CBr Amb18925116 [1,0,1,0,0,0|2,0,0]=4 3254 B9R1.15 O=C1NC=CC=C1CO Amb18922455 [1,0,1,0,0,0|1,0,0]=3 3255 B9R1.15 O=C1NC=NC=C1CO Amb27228831 [1,0,1,0,0,0|2,0,0]=4 3256 B9R1.15 O=CC1=CC=CNC1=O Amb18832973 [1,0,1,0,0,0|1,0,1]=4 3257 B9R1.15 O=Cc1cccc[n+]1[O-] Amb27434444 [1,0,1,0,0,0|1,0,1]=4 3258 B9R1.15 O=Cc1ccccc1Br Amb2684948 [1,0,1,0,0,0|1,0,0]=3 3259 B9R1.15 O=Cc1ccccc1Cl Amb2387351 [1,0,1,0,0,0|1,0,0]=3 3260 B9R1.15 O=Cc1ccccc1F Amb2688017 [1,0,1,0,0,0|1,0,0]=3 3261 B9R1.15 O=Cc1ccccc1I Amb1207354 [1,0,1,0,0,0|1,0,0]=3 3262 B9R1.15 O=Cc1ccccc1O Amb2792756 [1,0,1,0,0,0|0,0,0]=2 3263 B9R1.15 O=Cc1ccccc1S Amb18643290 [1,0,1,0,0,0|0,1,0]=3 3264 B9R1.15 O=Cc1cccnc1Br Amb2234596 [1,0,1,0,0,0|2,0,0]=4 3265 B9R1.15 O=Cc1cccnc1Cl Amb2418601 [1,0,1,0,0,0|2,0,0]=4 3266 B9R1.15 O=Cc1cccnc1F Amb2447351 [1,0,1,0,0,0|2,0,0]=4 3267 B9R1.15 O=Cc1cccnc1O Amb18642078 [1,0,1,0,0,0|1,0,0]=3 3268 B9R1.15 O=Cc1ccncc1Br Amb2447417 [1,0,1,0,0,0|2,0,0]=4 3269 B9R1.15 O=Cc1ccncc1Cl Amb22728978 [1,0,1,0,0,0|2,0,0]=4 3270 B9R1.15 O=Cc1ccncc1Cl Amb2797644 [1,0,1,0,0,0|2,0,0]=4 3271 B9R1.15 O=Cc1ccncc1Cl Amb34911645 [1,0,1,0,0,0|2,0,0]=4 3272 B9R1.15 O=Cc1ccncc1F Amb33544828 [1,0,1,0,0,0|2,0,0]=4 3273 B9R1.15 O=Cc1ccncc1I Amb27959180 [1,0,1,0,0,0|2,0,0]=4 3274 B9R1.15 O=Cc1ccncc1O Amb2697950 [1,0,1,0,0,0|1,0,0]=3 3275 B9R1.15 O=Cc1cnccc1Br Amb13890400 [1,0,1,0,0,0|2,0,0]=4 3276 B9R1.15 O=Cc1cnccc1Br Amb22491437 [1,0,1,0,0,0|2,0,0]=4 3277 B9R1.15 O=Cc1cnccc1Br Amb2447416 [1,0,1,0,0,0|2,0,0]=4 3278 B9R1.15 O=Cc1cnccc1Cl Amb10067841 [1,0,1,0,0,0|2,0,0]=4 3279 B9R1.15 O=Cc1cnccc1Cl Amb22491113 [1,0,1,0,0,0|2,0,0]=4 3280 B9R1.15 O=Cc1cnccc1F Amb20247834 [1,0,1,0,0,0|2,0,0]=4 3281 B9R1.15 O=Cc1cnccc1O Amb20247827 [1,0,1,0,0,0|1,0,0]=3 3282 B9R1.15 O=Cc1ncccc1Br Amb2447550 [1,0,1,0,0,0|2,0,0]=4 3283 B9R1.15 O=Cc1ncccc1Cl Amb10602299 [1,0,1,0,0,0|2,0,0]=4 3284 B9R1.15 O=Cc1ncccc1F Amb2447518 [1,0,1,0,0,0|2,0,0]=4 3285 B9R1.15 O=Cc1ncccc1O Amb22495285 [1,0,1,0,0,0|1,0,0]=3 3286 B9R1.15 O=Cc1ncccc1O Amb2691308 [1,0,1,0,0,0|1,0,0]=3 3287 B9R1.15 O=Cc1nccnc1O Amb28285120 [1,0,1,0,0,0|2,0,0]=4 3288 B9R1.15 O=Nc1ccccc1Cl Amb27252949 [1,0,1,0,0,0|2,0,0]=4 3289 B9R1.15 O=Nc1ccccc1O Amb17593255 [1,0,1,0,0,0|1,0,0]=3 3290 B9R1.15 O=Nc1ncccc1O Amb27267943 [1,0,1,0,0,0|2,0,0]=4 3291 B9R1.15 OCC1=CC=CNC1=S Amb25210908 [1,0,1,0,0,0|1,1,0]=4 3292 B9R1.15 OCc1ccccc1Br Amb3939081 [1,0,1,0,0,0|1,0,0]=3 3293 B9R1.15 OCc1ccccc1Cl Amb837338 [1,0,1,0,0,0|1,0,0]=3 3294 B9R1.15 OCc1ccccc1F Amb837270 [1,0,1,0,0,0|1,0,0]=3 3295 B9R1.15 OCc1ccccc1I Amb6373404 [1,0,1,0,0,0|1,0,0]=3 3296 B9R1.15 OCc1ccccc1O Amb3940117 [1,0,1,0,0,0|0,0,1]=3 3297 B9R1.15 OCc1ccccc1S Amb2689068 [1,0,1,0,0,0|0,1,0]=3 3298 B9R1.15 OCc1cccnc1Br Amb4561110 [1,0,1,0,0,0|2,0,0]=4 3299 B9R1.15 OCc1cccnc1Cl Amb2722986 [1,0,1,0,0,0|2,0,0]=4 3300 B9R1.15 OCc1cccnc1F Amb10603593 [1,0,1,0,0,0|2,0,0]=4 3301 B9R1.15 OCc1cccnc1O Amb20247914 [1,0,1,0,0,0|1,0,1]=4 3302 B9R1.15 OCc1ccncc1Br Amb19958216 [1,0,1,0,0,0|2,0,0]=4 3303 B9R1.15 OCc1ccncc1Cl Amb8630898 [1,0,1,0,0,0|2,0,0]=4 3304 B9R1.15 OCc1ccncc1F Amb13887027 [1,0,1,0,0,0|2,0,0]=4 3305 B9R1.15 OCc1ccncc1I Amb23447040 [1,0,1,0,0,0|2,0,0]=4 3306 B9R1.15 OCc1ccncc1O Amb8439447 [1,0,1,0,0,0|1,0,1]=4 3307 B9R1.15 OCc1cnccc1Br Amb19958695 [1,0,1,0,0,0|2,0,0]=4 3308 B9R1.15 OCc1cnccc1Br Amb20671165 [1,0,1,0,0,0|2,0,0]=4 3309 B9R1.15 OCc1cnccc1Br Amb31205724 [1,0,1,0,0,0|2,0,0]=4 3310 B9R1.15 OCc1cnccc1Cl Amb10068416 [1,0,1,0,0,0|2,0,0]=4 3311 B9R1.15 OCc1cnccc1Cl Amb22233797 [1,0,1,0,0,0|2,0,0]=4 3312 B9R1.15 OCc1cnccc1F Amb25147035 [1,0,1,0,0,0|2,0,0]=4 3313 B9R1.15 OCc1cnccc1F Amb30633187 [1,0,1,0,0,0|2,0,0]=4 3314 B9R1.15 OCc1cnccc1I Amb27603031 [1,0,1,0,0,0|2,0,0]=4 3315 B9R1.15 OCc1ncccc1Br Amb13882830 [1,0,1,0,0,0|2,0,0]=4 3316 B9R1.15 OCc1ncccc1Cl Amb15695291 [1,0,1,0,0,0|2,0,0]=4 3317 B9R1.15 OCc1ncccc1F Amb2723486 [1,0,1,0,0,0|2,0,0]=4 3318 B9R1.15 OCc1ncccc1I Amb23447033 [1,0,1,0,0,0|2,0,0]=4 3319 B9R1.15 OCc1ncccc1O Amb2611945 [1,0,1,0,0,0|1,0,1]=4 3320 B9R1.15 OCc1ncccc1O Amb8384342 [1,0,1,0,0,0|1,0,1]=4 3321 B9R1.15 ONc1ccccc1Cl Amb24093632 [1,0,1,0,0,0|2,0,0]=4 3322 B9R1.15 ONc1ccccc1I Amb22230990 [1,0,1,0,0,0|2,0,0]=4 3323 B9R1.15 Oc1ccccc1CBr Amb18129657 [1,0,1,0,0,0|1,0,1]=4 3324 B9R1.15 Oc1ccccc1CCl Amb17477840 [1,0,1,0,0,0|1,0,1]=4 3325 B9R1.15 Oc1ccccc1CS Amb25188976 [1,0,1,0,0,0|0,1,1]=4 3326 B9R1.15 SCc1ccccc1Br Amb2691875 [1,0,1,0,0,0|1,1,0]=4 3327 B9R1.15 SCc1ccccc1Cl Amb6255353 [1,0,1,0,0,0|1,1,0]=4 3328 B9R1.15 Sc1ccccc1CBr Amb27482544 [1,0,1,0,0,0|1,1,0]=4 3329 B9R1.15 [C-]#[N+]c1ccccc1C Amb2689613 [1,0,1,0,0,0|2,0,0]=4 3330 B9R1.15 [O-][n+]1ccccc1CO Amb17615558 [1,0,1,0,0,0|1,0,1]=4 3331 B9R1.33 C=CCC1=CCOC1=O Amb27420914 [1,0,1,0,0,0|0,0,1]=3 3332 B9R1.33 C=CCC1=CCSC1=O Amb27462412 [1,0,1,0,0,0|0,1,1]=4 3333 B9R1.33 C=C\C=C1\CCCC1=O Amb25735080 [1,0,1,0,0,0|1,0,1]=4 3334 B9R1.33 C\C=C\C1=CCCC1=O Amb26002515 [1,0,1,0,0,0|1,0,1]=4 3335 B9R1.132 C=CC1=C(C)C(=O)NC1 Amb27768773 [1,0,1,0,0,0|1,0,1]=4 3336 B9R1.27 N\C=C1\C(=O)COC1=O Amb25209582 [1,0,1,0,0,0|2,0,0]=4 3337 B9R1.27 O=CC1=C(O)COC1=O Amb27751398 [1,0,1,0,0,0|2,0,0]=4 3338 B9R1.14 C=Cc1cscc1C=C Amb27202321 [1,0,1,0,0,0|0,1,1]=4 3339 B11R1.7 CCS(=N)(=O)c1ccccc1 Amb27948141 [0,1,1,0,0,0|2,0,0]=4 3340 B11R1.7 CCS(=N)(=O)c1ccccc1 Amb33456347 [0,1,1,0,0,0|2,0,0]=4 3341 B11R1.7 CCS(=O)(=O)c1ccccc1 Amb2687930 [0,1,1,0,0,0|2,0,0]=4 3342 B11R1.7 CC[S@](=N)(=O)c1ccccc1 Amb33743997 [0,1,1,0,0,0|2,0,0]=4 3343 B11R1.7 CN=S(C)(=O)c1ccccc1 Amb9826001 [0,1,1,0,0,0|2,0,0]=4 3344 B11R1.7 CNP(=O)(O)c1ccccc1 Amb28343794 [0,1,1,0,0,0|2,0,0]=4 3345 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [0,1,1,0,0,0|2,0,0]=4 3346 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [0,1,1,0,0,0|0,0,2]=4 3347 B11R1.7 COP(=O)(O)c1ccccc1 Amb25953611 [0,1,1,0,0,0|1,0,0]=3 3348 B11R1.7 COP(C)(=O)c1ccccc1 Amb6365870 [0,1,1,0,0,0|1,0,0]=3 3349 B11R1.7 COP(O)(=S)c1ccccc1 Amb8392131 [0,1,1,0,0,0|1,0,1]=4 3350 B11R1.7 COS(=O)(=O)c1ccccc1 Amb2793093 [0,1,1,0,0,0|1,0,0]=3 3351 B11R1.7 COS(=O)(=O)c1ccccn1 Amb26477444 [0,1,1,0,0,0|2,0,0]=4 3352 B11R1.7 COS(=O)(=O)c1cccnc1 Amb24466050 [0,1,1,0,0,0|2,0,0]=4 3353 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [0,1,1,0,0,0|1,1,0]=4 3354 B11R1.12 CCC(=C=O)c1ccccn1 Amb26359789 [0,1,1,0,0,0|2,0,0]=4 3355 B11R1.12 CCC(C=O)c1ccccc1 Amb17138422 [0,1,1,0,0,0|1,0,1]=4 3356 B11R1.12 CCN(N=O)c1ccccc1 Amb17618581 [0,1,1,0,0,0|2,0,0]=4 3357 B11R1.12 CC[C@@H](C=O)c1ccccc1 Amb27169433 [0,1,1,0,0,0|1,0,1]=4 3358 B11R1.12 CC\C(=N/O)c1ccccc1 Amb3367838 [0,1,1,0,0,0|1,0,1]=4 3359 B11R1.12 COC(C#N)c1ccccc1 Amb26595696 [0,1,1,0,0,0|1,0,1]=4 3360 B11R1.12 COC(C=O)c1cccnc1 Amb27665895 [0,1,1,0,0,0|1,0,1]=4 3361 B11R1.12 COC(C=O)c1ccncc1 Amb28368633 [0,1,1,0,0,0|1,0,1]=4 3362 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [0,1,1,0,0,0|1,0,1]=4 3363 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [0,1,1,0,0,0|1,0,1]=4 3364 B11R1.12 COC(CI)c1ccccc1 Amb25998600 [0,1,1,0,0,0|1,0,1]=4 3365 B11R1.12 COC(CN)c1ccccc1 Amb10609834 [0,1,1,0,0,0|1,0,1]=4 3366 B11R1.12 COC(CN)c1ccccc1 Amb6892239 [0,1,1,0,0,0|1,0,1]=4 3367 B11R1.12 COC(CO)c1ccccc1 Amb3939163 [0,1,1,0,0,0|0,0,2]=4 3368 B11R1.12 COC(OC)c1ccccc1 Amb6297219 [0,1,1,0,0,0|0,0,2]=4 3369 B11R1.12 COP(OC)c1ccccc1 Amb6365796 [0,1,1,0,0,0|1,0,1]=4 3370 B11R1.12 CO[C@@H](CBr)c1ccccc1 Amb28428431 [0,1,1,0,0,0|1,0,1]=4 3371 B11R1.12 CO[C@@H](CN)c1ccccc1 Amb28249989 [0,1,1,0,0,0|1,0,1]=4 3372 B11R1.12 CO[C@H](C=O)c1ccccc1 Amb27455008 [0,1,1,0,0,0|0,0,1]=3 3373 B11R1.12 CO[C@H](CO)c1ccccc1 Amb10807423 [0,1,1,0,0,0|0,0,2]=4 3374 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [0,1,1,0,0,0|0,1,1]=4 3375 B11R1.12 C\C=C(/C#N)c1ccccc1 Amb17231965 [0,1,1,0,0,0|2,0,0]=4 3376 B11R1.12 C\C=C(/C=O)c1ccncc1 Amb24418258 [0,1,1,0,0,0|2,0,0]=4 3377 B11R1.12 C\C=C(/CC)c1ccccc1 Amb26588977 [0,1,1,0,0,0|2,0,0]=4 3378 B11R1.12 C\C=C(\CC)c1ccccc1 Amb26421595 [0,1,1,0,0,0|2,0,0]=4 3379 B11R1.12 C\C=C(\CCl)c1ccccc1 Amb27413555 [0,1,1,0,0,0|2,0,0]=4 3380 B11R1.12 C\N=C(/NC)c1ccccc1 Amb8487310 [0,1,1,0,0,0|2,0,0]=4 3381 B11R1.12 C\N=C(/SC)c1ccccc1 Amb32718735 [0,1,1,0,0,0|1,1,0]=4 3382 B11R1.12 O=C=C(C=O)c1ccccc1 Amb27643622 [0,1,1,0,0,0|2,0,0]=4 3383 B11R1.12 O=C\C(=C/O)c1ccccc1 Amb10576572 [0,1,1,0,0,0|2,0,0]=4 3384 B11R1.12 O=C\C(=C\Br)c1ccccc1 Amb24634608 [0,1,1,0,0,0|2,0,0]=4 3385 B11R1.12 O=C\C(=C\Cl)c1ccccc1 Amb17594154 [0,1,1,0,0,0|2,0,0]=4 3386 B11R1.12 O=C\C(=C\O)c1ccccc1 Amb25092916 [0,1,1,0,0,0|2,0,0]=4 3387 B11R1.12 O=C\C(=C\S)c1ccccc1 Amb27622186 [0,1,1,0,0,0|2,0,0]=4 3388 B11R1.12 O=C\C(=N/O)c1ccccc1 Amb28345218 [0,1,1,0,0,0|2,0,0]=4 3389 B11R1.12 O=C\C(=N\O)c1ccccc1 Amb26580467 [0,1,1,0,0,0|2,0,0]=4 3390 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,1,1,0,0,0|1,0,1]=4 3391 B11R1.16 C#COC(=O)c1ccccc1 Amb25084221 [0,1,1,0,0,0|0,0,1]=3 3392 B11R1.16 C=C(CCBr)c1ccccc1 Amb27646402 [0,1,1,0,0,0|2,0,0]=4 3393 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,1,1,0,0,0|2,0,0]=4 3394 B11R1.16 C=C(CCCl)c1ccccc1 Amb28120007 [0,1,1,0,0,0|2,0,0]=4 3395 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,1,1,0,0,0|2,0,0]=4 3396 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,1,1,0,0,0|1,0,0]=3 3397 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,1,0,0,0|1,0,1]=4 3398 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,1,1,0,0,0|0,0,1]=3 3399 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,1,1,0,0,0|1,0,0]=3 3400 B11R1.16 CC(OCCl)c1ccccc1 Amb27852517 [0,1,1,0,0,0|1,0,1]=4 3401 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,1,1,0,0,0|1,0,0]=3 3402 B11R1.16 CCCC(=O)c1ccccn1 Amb6301471 [0,1,1,0,0,0|2,0,0]=4 3403 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,1,1,0,0,0|2,0,0]=4 3404 B11R1.16 CCCC(=O)c1ccncc1 Amb22235246 [0,1,1,0,0,0|2,0,0]=4 3405 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [0,1,1,0,0,0|2,0,0]=4 3406 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,1,1,0,0,0|1,0,0]=3 3407 B11R1.16 CCNC(=O)c1ccccn1 Amb8439146 [0,1,1,0,0,0|2,0,0]=4 3408 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,1,1,0,0,0|1,1,0]=4 3409 B11R1.16 CCNS(=O)c1ccccc1 Amb27261568 [0,1,1,0,0,0|2,0,0]=4 3410 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,1,1,0,0,0|1,0,0]=3 3411 B11R1.16 CCOC(=N)c1ccccc1 Amb33527262 [0,1,1,0,0,0|1,0,0]=3 3412 B11R1.16 CCOC(=N)c1cccnc1 Amb18179379 [0,1,1,0,0,0|2,0,0]=4 3413 B11R1.16 CCOC(=N)c1ccncc1 Amb18179378 [0,1,1,0,0,0|2,0,0]=4 3414 B11R1.16 CCOC(=O)C1=CC=CCC1 Amb32644787 [0,1,1,0,0,0|0,0,2]=4 3415 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,1,1,0,0,0|0,0,0]=2 3416 B11R1.16 CCOC(=O)c1ccccn1 Amb3940414 [0,1,1,0,0,0|1,0,0]=3 3417 B11R1.16 CCOC(=O)c1cccnc1 Amb3940120 [0,1,1,0,0,0|1,0,0]=3 3418 B11R1.16 CCOC(=O)c1ccncc1 Amb1210124 [0,1,1,0,0,0|1,0,0]=3 3419 B11R1.16 CCOC(=O)c1ccncc1 Amb33140921 [0,1,1,0,0,0|1,0,0]=3 3420 B11R1.16 CCOC(=O)c1ccncn1 Amb8383933 [0,1,1,0,0,0|2,0,0]=4 3421 B11R1.16 CCOC(=O)c1ccnnc1 Amb8383938 [0,1,1,0,0,0|2,0,0]=4 3422 B11R1.16 CCOC(=O)c1cnccn1 Amb8428068 [0,1,1,0,0,0|2,0,0]=4 3423 B11R1.16 CCOC(=O)c1cncnc1 Amb8439525 [0,1,1,0,0,0|2,0,0]=4 3424 B11R1.16 CCOC(=O)c1ncccn1 Amb19930079 [0,1,1,0,0,0|2,0,0]=4 3425 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb5720188 [0,1,1,0,0,0|1,0,0]=3 3426 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,1,0,0,0|1,0,1]=4 3427 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [0,1,1,0,0,0|0,0,2]=4 3428 B11R1.16 CCON(C)c1ccccc1 Amb27234596 [0,1,1,0,0,0|2,0,0]=4 3429 B11R1.16 CCO[PH](=O)c1ccccc1 Amb10601587 [0,1,1,0,0,0|1,0,0]=3 3430 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,1,1,0,0,0|0,1,0]=3 3431 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [0,1,1,0,0,0|2,0,0]=4 3432 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [0,1,1,0,0,0|2,0,0]=4 3433 B11R1.16 CC\[S+]=C(/N)c1ccccc1 Amb27236829 [0,1,1,0,0,0|1,1,0]=4 3434 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,1,1,0,0,0|1,0,0]=3 3435 B11R1.16 CNCC(=O)c1ccccn1 Amb31094252 [0,1,1,0,0,0|2,0,0]=4 3436 B11R1.16 CNCC(=O)c1cccnc1 Amb27146952 [0,1,1,0,0,0|2,0,0]=4 3437 B11R1.16 CNCC(=O)c1ccncc1 Amb31094250 [0,1,1,0,0,0|2,0,0]=4 3438 B11R1.16 CNNC(=O)c1ccncc1 Amb28434923 [0,1,1,0,0,0|2,0,0]=4 3439 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,1,1,0,0,0|0,0,0]=2 3440 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [0,1,1,0,0,0|2,0,0]=4 3441 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [0,1,1,0,0,0|2,0,0]=4 3442 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,1,1,0,0,0|0,0,0]=2 3443 B11R1.16 COCC(=O)c1ccccn1 Amb10607921 [0,1,1,0,0,0|1,0,0]=3 3444 B11R1.16 COCC(=O)c1cnccn1 Amb27973329 [0,1,1,0,0,0|2,0,0]=4 3445 B11R1.16 COCC(=O)c1ncccn1 Amb27883002 [0,1,1,0,0,0|2,0,0]=4 3446 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [0,1,1,0,0,0|1,0,1]=4 3447 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [0,1,1,0,0,0|1,0,1]=4 3448 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [0,1,1,0,0,0|1,0,1]=4 3449 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,1,0,0,0|0,0,2]=4 3450 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,1,0,0,0|0,1,1]=4 3451 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [0,1,1,0,0,0|1,0,1]=4 3452 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,1,0,0,0|1,0,1]=4 3453 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [0,1,1,0,0,0|0,0,2]=4 3454 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,1,1,0,0,0|0,0,0]=2 3455 B11R1.16 CONC(=O)c1cncnc1 Amb28314753 [0,1,1,0,0,0|2,0,0]=4 3456 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,1,1,0,0,0|1,0,1]=4 3457 B11R1.16 CO\N=C(/N)c1ccccc1 Amb18224270 [0,1,1,0,0,0|1,0,0]=3 3458 B11R1.16 CO\N=C(/N)c1ccccn1 Amb18224284 [0,1,1,0,0,0|2,0,0]=4 3459 B11R1.16 CO\N=C(/N)c1cccnc1 Amb18224285 [0,1,1,0,0,0|2,0,0]=4 3460 B11R1.16 CO\N=C(/N)c1ccncc1 Amb18224286 [0,1,1,0,0,0|2,0,0]=4 3461 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,1,1,0,0,0|0,1,0]=3 3462 B11R1.16 CS\N=C(\N)c1ccccc1 Amb28365468 [0,1,1,0,0,0|1,1,0]=4 3463 B11R1.16 C\C(=C/CBr)c1ccccc1 Amb28384582 [0,1,1,0,0,0|2,0,0]=4 3464 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [0,1,1,0,0,0|2,0,0]=4 3465 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [0,1,1,0,0,0|2,0,0]=4 3466 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,1,0,0,0|1,0,0]=3 3467 B11R1.16 C\C=C\C(=O)c1cccnc1 Amb25712944 [0,1,1,0,0,0|2,0,0]=4 3468 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,1,0,0,0|1,0,1]=4 3469 B11R1.16 N#CNC(=O)c1ccccc1 Amb4007087 [0,1,1,0,0,0|1,0,1]=4 3470 B11R1.16 N=C=NC(=O)c1ccccc1 Amb28127436 [0,1,1,0,0,0|1,0,1]=4 3471 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [0,1,1,0,0,0|1,0,1]=4 3472 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,1,1,0,0,0|1,0,0]=3 3473 B11R1.16 NCCC(=O)c1ccccn1 Amb18121375 [0,1,1,0,0,0|2,0,0]=4 3474 B11R1.16 NCCC(=O)c1cccnc1 Amb18121496 [0,1,1,0,0,0|2,0,0]=4 3475 B11R1.16 NCCC(=O)c1ccncc1 Amb18639595 [0,1,1,0,0,0|2,0,0]=4 3476 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,1,0,0,0|2,0,0]=4 3477 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,1,0,0,0|2,0,0]=4 3478 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,1,1,0,0,0|1,0,0]=3 3479 B11R1.16 N\N=C\C(=O)c1ccccc1 Amb9824983 [0,1,1,0,0,0|2,0,0]=4 3480 B11R1.16 O=C(C=C=S)c1ccccc1 Amb27227059 [0,1,1,0,0,0|1,0,1]=4 3481 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,1,1,0,0,0|1,0,0]=3 3482 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,1,1,0,0,0|1,0,0]=3 3483 B11R1.16 O=C(CCCl)c1ccncc1 Amb24117884 [0,1,1,0,0,0|2,0,0]=4 3484 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,1,1,0,0,0|1,0,0]=3 3485 B11R1.16 O=C(CCO)c1ccccn1 Amb26484243 [0,1,1,0,0,0|2,0,0]=4 3486 B11R1.16 O=C(CCO)c1cccnc1 Amb26017511 [0,1,1,0,0,0|2,0,0]=4 3487 B11R1.16 O=C(CCO)c1ccncc1 Amb24544067 [0,1,1,0,0,0|2,0,0]=4 3488 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,1,1,0,0,0|1,0,0]=3 3489 B11R1.16 O=C(N=C=S)c1ccccc1 Amb2092776 [0,1,1,0,0,0|1,0,1]=4 3490 B11R1.16 O=C(NC#P)c1ccccc1 Amb28245816 [0,1,1,0,0,0|1,0,1]=4 3491 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [0,1,1,0,0,0|1,0,0]=3 3492 B11R1.16 O=C(NCCl)c1cccnc1 Amb27974129 [0,1,1,0,0,0|2,0,0]=4 3493 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,1,1,0,0,0|1,0,0]=3 3494 B11R1.16 O=C(NCO)c1cccnc1 Amb6358137 [0,1,1,0,0,0|2,0,0]=4 3495 B11R1.16 O=C(NO[K])c1ccccc1 Amb33457787 [0,1,1,0,0,0|1,0,0]=3 3496 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,1,1,0,0,0|0,0,0]=2 3497 B11R1.16 O=C(OCCl)c1cccnc1 Amb28343065 [0,1,1,0,0,0|1,0,0]=3 3498 B11R1.16 O=C(OCF)c1ccccc1 Amb27485928 [0,1,1,0,0,0|0,0,0]=2 3499 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,1,1,0,0,0|0,0,0]=2 3500 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,1,1,0,0,0|0,0,0]=2 3501 B11R1.16 O=C(SCCl)c1ccccc1 Amb28458380 [0,1,1,0,0,0|0,1,0]=3 3502 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [0,1,1,0,0,0|1,0,1]=4 3503 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [0,1,1,0,0,0|1,0,1]=4 3504 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [0,1,1,0,0,0|1,0,1]=4 3505 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [0,1,1,0,0,0|1,0,1]=4 3506 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,1,1,0,0,0|2,0,0]=4 3507 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,1,0,0,0|1,0,1]=4 3508 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [0,1,1,0,0,0|1,0,1]=4 3509 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,1,1,0,0,0|1,0,1]=4 3510 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,1,1,0,0,0|0,0,1]=3 3511 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [0,1,1,0,0,0|1,0,1]=4 3512 B11R1.16 O=S(CCCl)c1ccccc1 Amb9158149 [0,1,1,0,0,0|2,0,0]=4 3513 B11R1.16 O=S(CCO)c1ccccc1 Amb27411411 [0,1,1,0,0,0|2,0,0]=4 3514 B11R1.16 OCOB(O)c1ccccc1 Amb33512956 [0,1,1,0,0,0|1,0,1]=4 3515 B11R1.16 OC\C=C(\Br)c1ccccc1 Amb28284946 [0,1,1,0,0,0|2,0,0]=4 3516 B11R1.16 [N-]=[N+]=CC(=O)c1ccccc1 Amb16233231 [0,1,1,0,0,0|2,0,0]=4 3517 B11R1.16 [N-]=[N+]=NC(=O)c1ccccc1 Amb8938214 [0,1,1,0,0,0|2,0,0]=4 3518 B11R1.22 C#CC(=O)c1ccc(C)cc1 Amb27617443 [0,1,1,0,0,0|1,0,1]=4 3519 B11R1.22 C#CC(=O)c1ccc(Cl)cc1 Amb25720663 [0,1,1,0,0,0|1,0,1]=4 3520 B11R1.22 C#CC(=O)c1ccc(F)cc1 Amb24447227 [0,1,1,0,0,0|1,0,1]=4 3521 B11R1.22 C#CC(=O)c1ccc(N)cc1 Amb24488157 [0,1,1,0,0,0|1,0,1]=4 3522 B11R1.22 C=C(CC)c1ccc(Br)cc1 Amb20668394 [0,1,1,0,0,0|2,0,0]=4 3523 B11R1.22 C=C(CC)c1ccc(F)cc1 Amb27803524 [0,1,1,0,0,0|2,0,0]=4 3524 B11R1.22 C=C(OC)c1ccc(Br)cc1 Amb25325540 [0,1,1,0,0,0|1,0,0]=3 3525 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [0,1,1,0,0,0|1,0,1]=4 3526 B11R1.22 C=CC(=O)c1ccc(C)cc1 Amb18063916 [0,1,1,0,0,0|1,0,1]=4 3527 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [0,1,1,0,0,0|1,0,1]=4 3528 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [0,1,1,0,0,0|1,0,1]=4 3529 B11R1.22 C=CC(=O)c1ccc(N)cc1 Amb27253822 [0,1,1,0,0,0|1,0,1]=4 3530 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [0,1,1,0,0,0|1,0,1]=4 3531 B11R1.22 CCC(=O)c1ccc(Br)cc1 Amb267378 [0,1,1,0,0,0|1,0,0]=3 3532 B11R1.22 CCC(=O)c1ccc(Br)cn1 Amb26439328 [0,1,1,0,0,0|2,0,0]=4 3533 B11R1.22 CCC(=O)c1ccc(Br)nc1 Amb23446252 [0,1,1,0,0,0|2,0,0]=4 3534 B11R1.22 CCC(=O)c1ccc(C)cc1 Amb5740248 [0,1,1,0,0,0|1,0,0]=3 3535 B11R1.22 CCC(=O)c1ccc(C)cn1 Amb22898827 [0,1,1,0,0,0|2,0,0]=4 3536 B11R1.22 CCC(=O)c1ccc(C)nc1 Amb28381139 [0,1,1,0,0,0|2,0,0]=4 3537 B11R1.22 CCC(=O)c1ccc(Cl)cc1 Amb6365763 [0,1,1,0,0,0|1,0,0]=3 3538 B11R1.22 CCC(=O)c1ccc(Cl)cn1 Amb27869319 [0,1,1,0,0,0|2,0,0]=4 3539 B11R1.22 CCC(=O)c1ccc(Cl)nc1 Amb2700285 [0,1,1,0,0,0|2,0,0]=4 3540 B11R1.22 CCC(=O)c1ccc(F)cc1 Amb2688408 [0,1,1,0,0,0|1,0,0]=3 3541 B11R1.22 CCC(=O)c1ccc(F)cn1 Amb25759749 [0,1,1,0,0,0|2,0,0]=4 3542 B11R1.22 CCC(=O)c1ccc(F)nc1 Amb26443332 [0,1,1,0,0,0|2,0,0]=4 3543 B11R1.22 CCC(=O)c1ccc(I)cc1 Amb6244842 [0,1,1,0,0,0|1,0,0]=3 3544 B11R1.22 CCC(=O)c1ccc(I)nc1 Amb23446977 [0,1,1,0,0,0|2,0,0]=4 3545 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb2610525 [0,1,1,0,0,0|1,0,0]=3 3546 B11R1.22 CCC(=O)c1ccc(N)cc1 Amb34896232 [0,1,1,0,0,0|1,0,0]=3 3547 B11R1.22 CCC(=O)c1ccc(N)cn1 Amb28058320 [0,1,1,0,0,0|2,0,0]=4 3548 B11R1.22 CCC(=O)c1ccc(N)nc1 Amb23446324 [0,1,1,0,0,0|2,0,0]=4 3549 B11R1.22 CCC(=O)c1ccc(O)cc1 Amb1336085 [0,1,1,0,0,0|1,0,0]=3 3550 B11R1.22 CCC(=O)c1ccc(O)nc1 Amb23446708 [0,1,1,0,0,0|2,0,0]=4 3551 B11R1.22 CCS(=O)c1ccc(Cl)cc1 Amb27215747 [0,1,1,0,0,0|2,0,0]=4 3552 B11R1.22 CNC(=N)c1ccc(Br)cc1 Amb27175134 [0,1,1,0,0,0|2,0,0]=4 3553 B11R1.22 CNC(=N)c1ccc(C)cc1 Amb8480217 [0,1,1,0,0,0|2,0,0]=4 3554 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 Amb18799400 [0,1,1,0,0,0|2,0,0]=4 3555 B11R1.22 CNC(=O)C1=COC(=O)C=C1 Amb27982783 [0,1,1,0,0,0|2,0,0]=4 3556 B11R1.22 CNC(=O)c1ccc(Br)cc1 Amb1232931 [0,1,1,0,0,0|1,0,0]=3 3557 B11R1.22 CNC(=O)c1ccc(Br)cn1 Amb10068169 [0,1,1,0,0,0|2,0,0]=4 3558 B11R1.22 CNC(=O)c1ccc(Br)nc1 Amb19959847 [0,1,1,0,0,0|2,0,0]=4 3559 B11R1.22 CNC(=O)c1ccc(C)cc1 Amb2721101 [0,1,1,0,0,0|1,0,0]=3 3560 B11R1.22 CNC(=O)c1ccc(C)cn1 Amb25151403 [0,1,1,0,0,0|2,0,0]=4 3561 B11R1.22 CNC(=O)c1ccc(Cl)cc1 Amb2707199 [0,1,1,0,0,0|1,0,0]=3 3562 B11R1.22 CNC(=O)c1ccc(Cl)cn1 Amb27601396 [0,1,1,0,0,0|2,0,0]=4 3563 B11R1.22 CNC(=O)c1ccc(Cl)nc1 Amb2106608 [0,1,1,0,0,0|2,0,0]=4 3564 B11R1.22 CNC(=O)c1ccc(F)cc1 Amb3886603 [0,1,1,0,0,0|1,0,0]=3 3565 B11R1.22 CNC(=O)c1ccc(F)cn1 Amb27607820 [0,1,1,0,0,0|2,0,0]=4 3566 B11R1.22 CNC(=O)c1ccc(I)cc1 Amb1230427 [0,1,1,0,0,0|1,0,0]=3 3567 B11R1.22 CNC(=O)c1ccc(I)cn1 Amb27268655 [0,1,1,0,0,0|2,0,0]=4 3568 B11R1.22 CNC(=O)c1ccc(N)cc1 Amb6334818 [0,1,1,0,0,0|1,0,0]=3 3569 B11R1.22 CNC(=O)c1ccc(N)cn1 Amb25923162 [0,1,1,0,0,0|2,0,0]=4 3570 B11R1.22 CNC(=O)c1ccc(N)nc1 Amb18946779 [0,1,1,0,0,0|2,0,0]=4 3571 B11R1.22 CNC(=O)c1ccc(O)cc1 Amb6671651 [0,1,1,0,0,0|1,0,0]=3 3572 B11R1.22 CNC(=O)c1ccc(O)cn1 Amb19895115 [0,1,1,0,0,0|2,0,0]=4 3573 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [0,1,1,0,0,0|1,0,0]=3 3574 B11R1.22 CNC(=S)c1ccc(Cl)cc1 Amb28436657 [0,1,1,0,0,0|1,1,0]=4 3575 B11R1.22 CNC(=S)c1ccc(O)cc1 Amb28056735 [0,1,1,0,0,0|1,1,0]=4 3576 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [0,1,1,0,0,0|2,0,0]=4 3577 B11R1.22 COC(=N)C1=CNC(=O)C=C1 Amb35593408 [0,1,1,0,0,0|2,0,0]=4 3578 B11R1.22 COC(=N)c1ccc(Br)cn1 Amb28383542 [0,1,1,0,0,0|2,0,0]=4 3579 B11R1.22 COC(=N)c1ccc(C)cc1 Amb22269339 [0,1,1,0,0,0|1,0,0]=3 3580 B11R1.22 COC(=N)c1ccc(C)cc1 Amb28049833 [0,1,1,0,0,0|1,0,0]=3 3581 B11R1.22 COC(=N)c1ccc(C)nc1 Amb28120090 [0,1,1,0,0,0|2,0,0]=4 3582 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb18180239 [0,1,1,0,0,0|1,0,0]=3 3583 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb22736537 [0,1,1,0,0,0|1,0,0]=3 3584 B11R1.22 COC(=N)c1ccc(Cl)nc1 Amb27164086 [0,1,1,0,0,0|2,0,0]=4 3585 B11R1.22 COC(=N)c1ccc(I)cc1 Amb27954227 [0,1,1,0,0,0|1,0,0]=3 3586 B11R1.22 COC(=N)c1ccc(I)cn1 Amb27193795 [0,1,1,0,0,0|2,0,0]=4 3587 B11R1.22 COC(=N)c1ccc(O)cc1 Amb18181685 [0,1,1,0,0,0|1,0,0]=3 3588 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb18182832 [0,1,1,0,0,0|1,0,0]=3 3589 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb19372931 [0,1,1,0,0,0|1,0,0]=3 3590 B11R1.22 COC(=O)C1=CNC(=O)N=C1 Amb21964436 [0,1,1,0,0,0|2,0,0]=4 3591 B11R1.22 COC(=O)C1=COC(=O)C=C1 Amb18796753 [0,1,1,0,0,0|1,0,0]=3 3592 B11R1.22 COC(=O)C1=COC(O)C=C1 Amb26633793 [0,1,1,0,0,0|1,0,1]=4 3593 B11R1.22 COC(=O)C1=NNC(=O)C=C1 Amb18372542 [0,1,1,0,0,0|2,0,0]=4 3594 B11R1.22 COC(=O)C1C=CC(=O)C=C1 Amb26644097 [0,1,1,0,0,0|0,0,1]=3 3595 B11R1.22 COC(=O)c1cc[n+](C)cc1 Amb4005009 [0,1,1,0,0,0|1,0,0]=3 3596 B11R1.22 COC(=O)c1cc[n+]([O-])cc1 Amb4017366 [0,1,1,0,0,0|1,0,0]=3 3597 B11R1.22 COC(=O)c1ccc(Br)cc1 Amb1394975 [0,1,1,0,0,0|0,0,0]=2 3598 B11R1.22 COC(=O)c1ccc(Br)cn1 Amb6366095 [0,1,1,0,0,0|1,0,0]=3 3599 B11R1.22 COC(=O)c1ccc(Br)nc1 Amb2684085 [0,1,1,0,0,0|1,0,0]=3 3600 B11R1.22 COC(=O)c1ccc(Br)nn1 Amb22277068 [0,1,1,0,0,0|2,0,0]=4 3601 B11R1.22 COC(=O)c1ccc(C)cc1 Amb1210121 [0,1,1,0,0,0|0,0,0]=2 3602 B11R1.22 COC(=O)c1ccc(C)cn1 Amb19958650 [0,1,1,0,0,0|1,0,0]=3 3603 B11R1.22 COC(=O)c1ccc(C)nc1 Amb2691851 [0,1,1,0,0,0|1,0,0]=3 3604 B11R1.22 COC(=O)c1ccc(C)nn1 Amb17798484 [0,1,1,0,0,0|2,0,0]=4 3605 B11R1.22 COC(=O)c1ccc(Cl)cc1 Amb2726180 [0,1,1,0,0,0|0,0,0]=2 3606 B11R1.22 COC(=O)c1ccc(Cl)cn1 Amb15695243 [0,1,1,0,0,0|1,0,0]=3 3607 B11R1.22 COC(=O)c1ccc(Cl)cn1 Amb22751028 [0,1,1,0,0,0|1,0,0]=3 3608 B11R1.22 COC(=O)c1ccc(Cl)nc1 Amb2720451 [0,1,1,0,0,0|1,0,0]=3 3609 B11R1.22 COC(=O)c1ccc(Cl)nn1 Amb5720085 [0,1,1,0,0,0|2,0,0]=4 3610 B11R1.22 COC(=O)c1ccc(F)cc1 Amb2227542 [0,1,1,0,0,0|0,0,0]=2 3611 B11R1.22 COC(=O)c1ccc(F)cn1 Amb19930069 [0,1,1,0,0,0|1,0,0]=3 3612 B11R1.22 COC(=O)c1ccc(F)nc1 Amb8393047 [0,1,1,0,0,0|1,0,0]=3 3613 B11R1.22 COC(=O)c1ccc(F)nn1 Amb22750322 [0,1,1,0,0,0|2,0,0]=4 3614 B11R1.22 COC(=O)c1ccc(I)cc1 Amb2411582 [0,1,1,0,0,0|0,0,0]=2 3615 B11R1.22 COC(=O)c1ccc(I)cn1 Amb4561071 [0,1,1,0,0,0|1,0,0]=3 3616 B11R1.22 COC(=O)c1ccc(I)nc1 Amb22057831 [0,1,1,0,0,0|1,0,0]=3 3617 B11R1.22 COC(=O)c1ccc(N)cc1 Amb1215269 [0,1,1,0,0,0|0,0,0]=2 3618 B11R1.22 COC(=O)c1ccc(N)cc1 Amb2726185 [0,1,1,0,0,0|0,0,0]=2 3619 B11R1.22 COC(=O)c1ccc(N)cn1 Amb10603994 [0,1,1,0,0,0|1,0,0]=3 3620 B11R1.22 COC(=O)c1ccc(N)nc1 Amb2413102 [0,1,1,0,0,0|1,0,0]=3 3621 B11R1.22 COC(=O)c1ccc(N)nn1 Amb22492029 [0,1,1,0,0,0|2,0,0]=4 3622 B11R1.22 COC(=O)c1ccc(N)nn1 Amb33534948 [0,1,1,0,0,0|2,0,0]=4 3623 B11R1.22 COC(=O)c1ccc(O)cc1 Amb534309 [0,1,1,0,0,0|0,0,0]=2 3624 B11R1.22 COC(=O)c1ccc(O)cn1 Amb2236633 [0,1,1,0,0,0|1,0,0]=3 3625 B11R1.22 COC(=O)c1ccc(O)nc1 Amb5638116 [0,1,1,0,0,0|1,0,0]=3 3626 B11R1.22 COC(=O)c1ccc(O)nn1 Amb21811761 [0,1,1,0,0,0|2,0,0]=4 3627 B11R1.22 COC(=O)c1ccc(S)cc1 Amb341395 [0,1,1,0,0,0|0,0,0]=2 3628 B11R1.22 COC(=O)c1ccc(S)nc1 Amb23446717 [0,1,1,0,0,0|1,0,0]=3 3629 B11R1.22 COC(=O)c1ccc([O-])cc1 Amb6296112 [0,1,1,0,0,0|0,0,0]=2 3630 B11R1.22 COC(=O)c1cnc(Br)cn1 Amb10603997 [0,1,1,0,0,0|2,0,0]=4 3631 B11R1.22 COC(=O)c1cnc(Br)nc1 Amb22751737 [0,1,1,0,0,0|2,0,0]=4 3632 B11R1.22 COC(=O)c1cnc(C)cn1 Amb2689525 [0,1,1,0,0,0|2,0,0]=4 3633 B11R1.22 COC(=O)c1cnc(C)nc1 Amb13892051 [0,1,1,0,0,0|2,0,0]=4 3634 B11R1.22 COC(=O)c1cnc(Cl)cn1 Amb8386522 [0,1,1,0,0,0|2,0,0]=4 3635 B11R1.22 COC(=O)c1cnc(Cl)nc1 Amb2725044 [0,1,1,0,0,0|2,0,0]=4 3636 B11R1.22 COC(=O)c1cnc(F)cn1 Amb24096170 [0,1,1,0,0,0|2,0,0]=4 3637 B11R1.22 COC(=O)c1cnc(F)nc1 Amb27872497 [0,1,1,0,0,0|2,0,0]=4 3638 B11R1.22 COC(=O)c1cnc(N)cn1 Amb17608285 [0,1,1,0,0,0|2,0,0]=4 3639 B11R1.22 COC(=O)c1cnc(N)cn1 Amb21960728 [0,1,1,0,0,0|2,0,0]=4 3640 B11R1.22 COC(=O)c1cnc(N)nc1 Amb7172638 [0,1,1,0,0,0|2,0,0]=4 3641 B11R1.22 COC(=O)c1cnc(O)cn1 Amb1093992 [0,1,1,0,0,0|2,0,0]=4 3642 B11R1.22 COC(=O)c1ncc(Br)cn1 Amb33549337 [0,1,1,0,0,0|2,0,0]=4 3643 B11R1.22 COC(=O)c1ncc(C)cn1 Amb22304676 [0,1,1,0,0,0|2,0,0]=4 3644 B11R1.22 COC(=O)c1ncc(Cl)cn1 Amb22886749 [0,1,1,0,0,0|2,0,0]=4 3645 B11R1.22 COC(=O)c1ncc(F)cn1 Amb22263818 [0,1,1,0,0,0|2,0,0]=4 3646 B11R1.22 COC(=O)c1ncc(N)cn1 Amb16231456 [0,1,1,0,0,0|2,0,0]=4 3647 B11R1.22 COC(=O)c1ncc(N)cn1 Amb22899758 [0,1,1,0,0,0|2,0,0]=4 3648 B11R1.22 COC(=O)c1ncc(N)cn1 Amb32409392 [0,1,1,0,0,0|2,0,0]=4 3649 B11R1.22 COC(=O)c1ncc(O)cn1 Amb25697454 [0,1,1,0,0,0|2,0,0]=4 3650 B11R1.22 COC(=S)c1ccc(O)cc1 Amb28381287 [0,1,1,0,0,0|0,1,0]=3 3651 B11R1.22 COC(C)c1ccc(Br)cc1 Amb9173692 [0,1,1,0,0,0|1,0,1]=4 3652 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [0,1,1,0,0,0|1,0,1]=4 3653 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [0,1,1,0,0,0|1,0,1]=4 3654 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [0,1,1,0,0,0|1,0,1]=4 3655 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [0,1,1,0,0,0|1,0,1]=4 3656 B11R1.22 COC(Cl)c1ccc(Cl)cc1 Amb27863573 [0,1,1,0,0,0|1,0,1]=4 3657 B11R1.22 COC(O)c1ccc(Cl)cc1 Amb28125744 [0,1,1,0,0,0|0,0,2]=4 3658 B11R1.22 COS(=O)c1ccc(C)cc1 Amb22230928 [0,1,1,0,0,0|1,0,0]=3 3659 B11R1.22 CO[C@@H](C)c1ccc(Br)cc1 Amb27783049 [0,1,1,0,0,0|1,0,1]=4 3660 B11R1.22 CO[C@@H](C)c1ccc(F)cc1 Amb27263640 [0,1,1,0,0,0|1,0,1]=4 3661 B11R1.22 CSC(=N)c1ccc(Cl)cc1 Amb2736622 [0,1,1,0,0,0|1,1,0]=4 3662 B11R1.22 CSC(=O)[n+]1ccc(N)cc1 Amb28072965 [0,1,1,0,0,0|1,1,0]=4 3663 B11R1.22 CSC(=O)c1ccc(N)cc1 Amb27831413 [0,1,1,0,0,0|0,1,0]=3 3664 B11R1.22 CSC(=S)c1ccc(N)cc1 Amb28187106 [0,1,1,0,0,0|0,2,0]=4 3665 B11R1.22 C\C=C(/O)c1ccc(F)cc1 Amb24100278 [0,1,1,0,0,0|1,0,1]=4 3666 B11R1.22 Cc1ccc(C(=O)C#N)cc1 Amb17231996 [0,1,1,0,0,0|2,0,0]=4 3667 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb10067935 [0,1,1,0,0,0|2,0,0]=4 3668 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb2609863 [0,1,1,0,0,0|2,0,0]=4 3669 B11R1.22 Cc1ccc(C(=O)CBr)cc1 Amb1981331 [0,1,1,0,0,0|2,0,0]=4 3670 B11R1.22 Cc1ccc(C(=O)CCl)cc1 Amb1105496 [0,1,1,0,0,0|2,0,0]=4 3671 B11R1.22 Cc1ccc(C(=O)CF)cc1 Amb24084136 [0,1,1,0,0,0|2,0,0]=4 3672 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb2693534 [0,1,1,0,0,0|2,0,0]=4 3673 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb33513193 [0,1,1,0,0,0|2,0,0]=4 3674 B11R1.22 Cc1ccc(C(=O)CN)cc1 Amb5739530 [0,1,1,0,0,0|2,0,0]=4 3675 B11R1.22 Cc1ccc(C(=O)CO)cc1 Amb5638929 [0,1,1,0,0,0|2,0,0]=4 3676 B11R1.22 Cc1ccc(C(=O)CS)cc1 Amb17400215 [0,1,1,0,0,0|2,0,0]=4 3677 B11R1.22 Cc1ccc(C(=O)C[NH3+])cc1 Amb10606218 [0,1,1,0,0,0|2,0,0]=4 3678 B11R1.22 Cc1ccc(C(=O)NN)cc1 Amb6355393 [0,1,1,0,0,0|2,0,0]=4 3679 B11R1.22 Cc1ccc(C(=O)NO)cc1 Amb6444120 [0,1,1,0,0,0|2,0,0]=4 3680 B11R1.22 Cc1ccc(S(=O)O[Na])cc1 Amb6365748 [0,1,1,0,0,0|2,0,0]=4 3681 B11R1.22 N#CC(=O)c1ccc(Br)cc1 Amb3991577 [0,1,1,0,0,0|2,0,0]=4 3682 B11R1.22 N#CC(=O)c1ccc(Cl)cc1 Amb17939433 [0,1,1,0,0,0|2,0,0]=4 3683 B11R1.22 N#CC(=O)c1ccc(F)cc1 Amb17232050 [0,1,1,0,0,0|2,0,0]=4 3684 B11R1.22 N#CC(=O)c1ccc(I)cc1 Amb22495535 [0,1,1,0,0,0|2,0,0]=4 3685 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb1811968 [0,1,1,0,0,0|2,0,0]=4 3686 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb2728641 [0,1,1,0,0,0|2,0,0]=4 3687 B11R1.22 NCC(=O)c1ccc(Br)cc1 Amb3940739 [0,1,1,0,0,0|2,0,0]=4 3688 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb1208662 [0,1,1,0,0,0|2,0,0]=4 3689 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb2370537 [0,1,1,0,0,0|2,0,0]=4 3690 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb1419069 [0,1,1,0,0,0|2,0,0]=4 3691 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb5739537 [0,1,1,0,0,0|2,0,0]=4 3692 B11R1.22 NCC(=O)c1ccc(F)cc1 Amb6384072 [0,1,1,0,0,0|2,0,0]=4 3693 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [0,1,1,0,0,0|2,0,0]=4 3694 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb25876415 [0,1,1,0,0,0|2,0,0]=4 3695 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb17593762 [0,1,1,0,0,0|2,0,0]=4 3696 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [0,1,1,0,0,0|2,0,0]=4 3697 B11R1.22 NNC(=O)c1ccc(Br)cc1 Amb1207367 [0,1,1,0,0,0|2,0,0]=4 3698 B11R1.22 NNC(=O)c1ccc(Cl)cc1 Amb1209335 [0,1,1,0,0,0|2,0,0]=4 3699 B11R1.22 NNC(=O)c1ccc(F)cc1 Amb1104475 [0,1,1,0,0,0|2,0,0]=4 3700 B11R1.22 NNC(=O)c1ccc(I)cc1 Amb1788092 [0,1,1,0,0,0|2,0,0]=4 3701 B11R1.22 NNC(=O)c1ccc(N)cc1 Amb6335760 [0,1,1,0,0,0|2,0,0]=4 3702 B11R1.22 NNC(=O)c1ccc(O)cc1 Amb1212100 [0,1,1,0,0,0|2,0,0]=4 3703 B11R1.22 NOC(=O)c1ccc(Cl)cc1 Amb24539350 [0,1,1,0,0,0|1,0,0]=3 3704 B11R1.22 Nc1ccc(C(=O)C=O)cc1 Amb28341792 [0,1,1,0,0,0|2,0,0]=4 3705 B11R1.22 Nc1ccc(C(=O)CBr)cc1 Amb8631324 [0,1,1,0,0,0|2,0,0]=4 3706 B11R1.22 Nc1ccc(C(=O)CCl)cc1 Amb9782884 [0,1,1,0,0,0|2,0,0]=4 3707 B11R1.22 Nc1ccc(C(=O)CO)cc1 Amb28255444 [0,1,1,0,0,0|2,0,0]=4 3708 B11R1.22 O=C(CBr)c1ccc(Br)cc1 Amb6337421 [0,1,1,0,0,0|2,0,0]=4 3709 B11R1.22 O=C(CBr)c1ccc(Cl)cc1 Amb2505006 [0,1,1,0,0,0|2,0,0]=4 3710 B11R1.22 O=C(CBr)c1ccc(F)cc1 Amb1885038 [0,1,1,0,0,0|2,0,0]=4 3711 B11R1.22 O=C(CBr)c1ccc(I)cc1 Amb2612426 [0,1,1,0,0,0|2,0,0]=4 3712 B11R1.22 O=C(CBr)c1ccc(O)cc1 Amb6297896 [0,1,1,0,0,0|2,0,0]=4 3713 B11R1.22 O=C(CCl)c1ccc(Br)cc1 Amb1103620 [0,1,1,0,0,0|2,0,0]=4 3714 B11R1.22 O=C(CCl)c1ccc(Cl)cc1 Amb6608728 [0,1,1,0,0,0|2,0,0]=4 3715 B11R1.22 O=C(CCl)c1ccc(F)cc1 Amb1221364 [0,1,1,0,0,0|2,0,0]=4 3716 B11R1.22 O=C(CCl)c1ccc(I)cc1 Amb420189 [0,1,1,0,0,0|2,0,0]=4 3717 B11R1.22 O=C(CCl)c1ccc(O)cc1 Amb1218323 [0,1,1,0,0,0|2,0,0]=4 3718 B11R1.22 O=C(CF)c1ccc(Br)cc1 Amb26595064 [0,1,1,0,0,0|2,0,0]=4 3719 B11R1.22 O=C(CF)c1ccc(Cl)cc1 Amb10603324 [0,1,1,0,0,0|2,0,0]=4 3720 B11R1.22 O=C(CF)c1ccc(F)cc1 Amb22490651 [0,1,1,0,0,0|2,0,0]=4 3721 B11R1.22 O=C(CI)c1ccc(Br)cc1 Amb23579956 [0,1,1,0,0,0|2,0,0]=4 3722 B11R1.22 O=C(CO)c1ccc(Br)cc1 Amb2726212 [0,1,1,0,0,0|2,0,0]=4 3723 B11R1.22 O=C(CO)c1ccc(Cl)cc1 Amb2736179 [0,1,1,0,0,0|2,0,0]=4 3724 B11R1.22 O=C(CO)c1ccc(F)cc1 Amb2740436 [0,1,1,0,0,0|2,0,0]=4 3725 B11R1.22 O=C(CO)c1ccc(I)cc1 Amb5638978 [0,1,1,0,0,0|2,0,0]=4 3726 B11R1.22 O=C(CS)c1ccc(Br)cc1 Amb17407556 [0,1,1,0,0,0|2,0,0]=4 3727 B11R1.22 O=C(CS)c1ccc(Cl)cc1 Amb17401093 [0,1,1,0,0,0|2,0,0]=4 3728 B11R1.22 O=C(CS)c1ccc(F)cc1 Amb17400324 [0,1,1,0,0,0|2,0,0]=4 3729 B11R1.22 O=C(NO)c1ccc(Br)cc1 Amb6444119 [0,1,1,0,0,0|2,0,0]=4 3730 B11R1.22 O=C(NO)c1ccc(Cl)cc1 Amb6264774 [0,1,1,0,0,0|2,0,0]=4 3731 B11R1.22 O=C(NO)c1ccc(F)cc1 Amb6271764 [0,1,1,0,0,0|2,0,0]=4 3732 B11R1.22 O=C(NO)c1ccc(I)cc1 Amb7756049 [0,1,1,0,0,0|2,0,0]=4 3733 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb10067934 [0,1,1,0,0,0|2,0,0]=4 3734 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb8391398 [0,1,1,0,0,0|2,0,0]=4 3735 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb10067933 [0,1,1,0,0,0|2,0,0]=4 3736 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb4479326 [0,1,1,0,0,0|2,0,0]=4 3737 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb2688344 [0,1,1,0,0,0|2,0,0]=4 3738 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb9826943 [0,1,1,0,0,0|2,0,0]=4 3739 B11R1.22 O=CC(=O)c1ccc(I)cc1 Amb28455510 [0,1,1,0,0,0|2,0,0]=4 3740 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb10069044 [0,1,1,0,0,0|2,0,0]=4 3741 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb6373643 [0,1,1,0,0,0|2,0,0]=4 3742 B11R1.22 [CH2]c1ccc(C(=O)OC)cc1 Amb35825242 [0,1,1,0,0,0|0,0,0]=2 3743 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb24113825 [0,1,1,0,0,0|2,0,0]=4 3744 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb6366127 [0,1,1,0,0,0|2,0,0]=4 3745 B11R1.22 [NH3+]CC(=O)c1ccc(Cl)cc1 Amb33513069 [0,1,1,0,0,0|2,0,0]=4 3746 B11R1.22 [NH3+]CC(=O)c1ccc(Cl)cc1 Amb3987034 [0,1,1,0,0,0|2,0,0]=4 3747 B11R1.22 [NH3+]CC(=O)c1ccc(F)cc1 Amb4014040 [0,1,1,0,0,0|2,0,0]=4 3748 B11R1.22 [NH3+]CC(=O)c1ccc(F)cc1 Amb4324947 [0,1,1,0,0,0|2,0,0]=4 3749 B11R1.23 C#CC(=O)c1cccc(Cl)c1 Amb25687191 [0,1,1,0,0,0|1,0,1]=4 3750 B11R1.23 C#CC(=O)c1cccc(N)c1 Amb24550417 [0,1,1,0,0,0|1,0,1]=4 3751 B11R1.23 C=C(CC)c1cccc(Br)c1 Amb27953527 [0,1,1,0,0,0|2,0,0]=4 3752 B11R1.23 C=C(CC)c1cccc(F)c1 Amb28141758 [0,1,1,0,0,0|2,0,0]=4 3753 B11R1.23 C=CC(=O)c1cccc(Br)c1 Amb26372631 [0,1,1,0,0,0|1,0,1]=4 3754 B11R1.23 C=CC(=O)c1cccc(C)c1 Amb25861091 [0,1,1,0,0,0|1,0,1]=4 3755 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [0,1,1,0,0,0|1,0,1]=4 3756 B11R1.23 C=CC(=O)c1cccc(F)c1 Amb26460816 [0,1,1,0,0,0|1,0,1]=4 3757 B11R1.23 C=CC(=O)c1cccc(I)c1 Amb28136092 [0,1,1,0,0,0|1,0,1]=4 3758 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [0,1,1,0,0,0|1,0,1]=4 3759 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [0,1,1,0,0,0|1,0,1]=4 3760 B11R1.23 CCC(=O)C1=CC(=O)NC=C1 Amb27471883 [0,1,1,0,0,0|2,0,0]=4 3761 B11R1.23 CCC(=O)c1cc(C)ccn1 Amb20247623 [0,1,1,0,0,0|2,0,0]=4 3762 B11R1.23 CCC(=O)c1cc(Cl)ccn1 Amb7172618 [0,1,1,0,0,0|2,0,0]=4 3763 B11R1.23 CCC(=O)c1cccc(Br)c1 Amb1233199 [0,1,1,0,0,0|1,0,0]=3 3764 B11R1.23 CCC(=O)c1cccc(Br)n1 Amb27603923 [0,1,1,0,0,0|2,0,0]=4 3765 B11R1.23 CCC(=O)c1cccc(C)c1 Amb33534981 [0,1,1,0,0,0|1,0,0]=3 3766 B11R1.23 CCC(=O)c1cccc(C)n1 Amb24182056 [0,1,1,0,0,0|2,0,0]=4 3767 B11R1.23 CCC(=O)c1cccc(Cl)c1 Amb2686437 [0,1,1,0,0,0|1,0,0]=3 3768 B11R1.23 CCC(=O)c1cccc(F)c1 Amb2688407 [0,1,1,0,0,0|1,0,0]=3 3769 B11R1.23 CCC(=O)c1cccc(I)c1 Amb27230465 [0,1,1,0,0,0|1,0,0]=3 3770 B11R1.23 CCC(=O)c1cccc(N)c1 Amb3429288 [0,1,1,0,0,0|1,0,0]=3 3771 B11R1.23 CCC(=O)c1cccc(N)n1 Amb25314535 [0,1,1,0,0,0|2,0,0]=4 3772 B11R1.23 CCC(=O)c1cccc(O)c1 Amb8387616 [0,1,1,0,0,0|1,0,0]=3 3773 B11R1.23 CCC(=O)c1ccnc(C)c1 Amb28184697 [0,1,1,0,0,0|2,0,0]=4 3774 B11R1.23 CCC(=O)c1ccnc(Cl)c1 Amb6301673 [0,1,1,0,0,0|2,0,0]=4 3775 B11R1.23 CCC(=O)c1cncc(Br)c1 Amb23450052 [0,1,1,0,0,0|2,0,0]=4 3776 B11R1.23 CCC(=O)c1cncc(F)c1 Amb18791535 [0,1,1,0,0,0|2,0,0]=4 3777 B11R1.23 CCS(=O)c1cccc(Br)c1 Amb27593385 [0,1,1,0,0,0|2,0,0]=4 3778 B11R1.23 CNC(=N)c1cccc(Br)c1 Amb27484944 [0,1,1,0,0,0|2,0,0]=4 3779 B11R1.23 CNC(=N)c1cccc(F)c1 Amb27395007 [0,1,1,0,0,0|2,0,0]=4 3780 B11R1.23 CNC(=O)C1=CC(=O)NC=C1 Amb27169726 [0,1,1,0,0,0|2,0,0]=4 3781 B11R1.23 CNC(=O)c1cc(Br)ccn1 Amb25312186 [0,1,1,0,0,0|2,0,0]=4 3782 B11R1.23 CNC(=O)c1cc(C)ccn1 Amb26907343 [0,1,1,0,0,0|2,0,0]=4 3783 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb1216582 [0,1,1,0,0,0|2,0,0]=4 3784 B11R1.23 CNC(=O)c1cc(Cl)ccn1 Amb17611087 [0,1,1,0,0,0|2,0,0]=4 3785 B11R1.23 CNC(=O)c1cc(I)ccn1 Amb27877595 [0,1,1,0,0,0|2,0,0]=4 3786 B11R1.23 CNC(=O)c1cc(N)ccn1 Amb33531654 [0,1,1,0,0,0|2,0,0]=4 3787 B11R1.23 CNC(=O)c1cc(O)ccn1 Amb22755769 [0,1,1,0,0,0|2,0,0]=4 3788 B11R1.23 CNC(=O)c1ccc[n+](C)c1 Amb27827345 [0,1,1,0,0,0|2,0,0]=4 3789 B11R1.23 CNC(=O)c1ccc[n+](C)c1 Amb29846115 [0,1,1,0,0,0|2,0,0]=4 3790 B11R1.23 CNC(=O)c1cccc(Br)c1 Amb3887216 [0,1,1,0,0,0|1,0,0]=3 3791 B11R1.23 CNC(=O)c1cccc(Br)n1 Amb19959848 [0,1,1,0,0,0|2,0,0]=4 3792 B11R1.23 CNC(=O)c1cccc(C)n1 Amb8333372 [0,1,1,0,0,0|2,0,0]=4 3793 B11R1.23 CNC(=O)c1cccc(Cl)n1 Amb10877696 [0,1,1,0,0,0|2,0,0]=4 3794 B11R1.23 CNC(=O)c1cccc(F)c1 Amb3886602 [0,1,1,0,0,0|1,0,0]=3 3795 B11R1.23 CNC(=O)c1cccc(F)n1 Amb27176229 [0,1,1,0,0,0|2,0,0]=4 3796 B11R1.23 CNC(=O)c1cccc(I)c1 Amb6403460 [0,1,1,0,0,0|1,0,0]=3 3797 B11R1.23 CNC(=O)c1cccc(N)c1 Amb1212262 [0,1,1,0,0,0|1,0,0]=3 3798 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [0,1,1,0,0,0|1,0,0]=3 3799 B11R1.23 CNC(=O)c1cccc(N)n1 Amb18946961 [0,1,1,0,0,0|2,0,0]=4 3800 B11R1.23 CNC(=O)c1cccc(O)c1 Amb6671640 [0,1,1,0,0,0|1,0,0]=3 3801 B11R1.23 CNC(=O)c1ccnc(Br)c1 Amb15691039 [0,1,1,0,0,0|2,0,0]=4 3802 B11R1.23 CNC(=O)c1ccnc(Cl)c1 Amb6667937 [0,1,1,0,0,0|2,0,0]=4 3803 B11R1.23 CNC(=O)c1ccnc(F)c1 Amb18787496 [0,1,1,0,0,0|2,0,0]=4 3804 B11R1.23 CNC(=O)c1ccnc(N)c1 Amb33529707 [0,1,1,0,0,0|2,0,0]=4 3805 B11R1.23 CNC(=O)c1cncc(N)c1 Amb23452695 [0,1,1,0,0,0|2,0,0]=4 3806 B11R1.23 COC(=N)c1cc(C)ccn1 Amb27216643 [0,1,1,0,0,0|2,0,0]=4 3807 B11R1.23 COC(=N)c1cccc(Br)c1 Amb24420410 [0,1,1,0,0,0|1,0,0]=3 3808 B11R1.23 COC(=N)c1cccc(C)n1 Amb27476072 [0,1,1,0,0,0|2,0,0]=4 3809 B11R1.23 COC(=N)c1ccnc(F)c1 Amb27462629 [0,1,1,0,0,0|2,0,0]=4 3810 B11R1.23 COC(=N)c1cncc(Br)c1 Amb27607653 [0,1,1,0,0,0|2,0,0]=4 3811 B11R1.23 COC(=O)C1=CC(=N)NC=C1 Amb19281876 [0,1,1,0,0,0|1,0,0]=3 3812 B11R1.23 COC(=O)C1=CC(=O)C=NN1 Amb24359096 [0,1,1,0,0,0|2,0,0]=4 3813 B11R1.23 COC(=O)C1=CC(=O)CC=N1 Amb27409531 [0,1,1,0,0,0|1,0,1]=4 3814 B11R1.23 COC(=O)C1=CC(=O)N=CN1 Amb22497602 [0,1,1,0,0,0|2,0,0]=4 3815 B11R1.23 COC(=O)C1=CC(=O)NN=C1 Amb22235613 [0,1,1,0,0,0|2,0,0]=4 3816 B11R1.23 COC(=O)C1=CC=CC(=O)N1 Amb21963502 [0,1,1,0,0,0|1,0,0]=3 3817 B11R1.23 COC(=O)C1=NC(=O)NC=C1 Amb22275937 [0,1,1,0,0,0|2,0,0]=4 3818 B11R1.23 COC(=O)C1=NC=CC(=O)N1 Amb27795334 [0,1,1,0,0,0|2,0,0]=4 3819 B11R1.23 COC(=O)c1c[n+]([O-])ccn1 Amb10552567 [0,1,1,0,0,0|2,0,0]=4 3820 B11R1.23 COC(=O)c1cc(Br)ccn1 Amb33544830 [0,1,1,0,0,0|1,0,0]=3 3821 B11R1.23 COC(=O)c1cc(Br)ncn1 Amb22752399 [0,1,1,0,0,0|2,0,0]=4 3822 B11R1.23 COC(=O)c1cc(C)ccn1 Amb21963460 [0,1,1,0,0,0|1,0,0]=3 3823 B11R1.23 COC(=O)c1cc(C)cnn1 Amb24183592 [0,1,1,0,0,0|2,0,0]=4 3824 B11R1.23 COC(=O)c1cc(C)ncn1 Amb22233997 [0,1,1,0,0,0|2,0,0]=4 3825 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb22489514 [0,1,1,0,0,0|1,0,0]=3 3826 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb2425400 [0,1,1,0,0,0|1,0,0]=3 3827 B11R1.23 COC(=O)c1cc(Cl)ccn1 Amb6565037 [0,1,1,0,0,0|1,0,0]=3 3828 B11R1.23 COC(=O)c1cc(Cl)ncn1 Amb20241221 [0,1,1,0,0,0|2,0,0]=4 3829 B11R1.23 COC(=O)c1cc(F)ccn1 Amb21857845 [0,1,1,0,0,0|1,0,0]=3 3830 B11R1.23 COC(=O)c1cc(F)ncn1 Amb27192376 [0,1,1,0,0,0|2,0,0]=4 3831 B11R1.23 COC(=O)c1cc(I)ccn1 Amb10072115 [0,1,1,0,0,0|1,0,0]=3 3832 B11R1.23 COC(=O)c1cc(N)ccn1 Amb33874132 [0,1,1,0,0,0|1,0,0]=3 3833 B11R1.23 COC(=O)c1cc(N)ccn1 Amb8386827 [0,1,1,0,0,0|1,0,0]=3 3834 B11R1.23 COC(=O)c1cc(N)ncn1 Amb21963300 [0,1,1,0,0,0|2,0,0]=4 3835 B11R1.23 COC(=O)c1cc(O)ccn1 Amb10603787 [0,1,1,0,0,0|1,0,0]=3 3836 B11R1.23 COC(=O)c1cc(O)ccn1 Amb22754537 [0,1,1,0,0,0|1,0,0]=3 3837 B11R1.23 COC(=O)c1cc(O)cnn1 Amb35789870 [0,1,1,0,0,0|2,0,0]=4 3838 B11R1.23 COC(=O)c1ccc[n+](C)c1 Amb2610524 [0,1,1,0,0,0|1,0,0]=3 3839 B11R1.23 COC(=O)c1ccc[n+]([O-])c1 Amb2611955 [0,1,1,0,0,0|1,0,0]=3 3840 B11R1.23 COC(=O)c1cccc(Br)c1 Amb3939648 [0,1,1,0,0,0|0,0,0]=2 3841 B11R1.23 COC(=O)c1cccc(Br)n1 Amb2684088 [0,1,1,0,0,0|1,0,0]=3 3842 B11R1.23 COC(=O)c1cccc(C)c1 Amb2726160 [0,1,1,0,0,0|0,0,0]=2 3843 B11R1.23 COC(=O)c1cccc(C)n1 Amb2694578 [0,1,1,0,0,0|1,0,0]=3 3844 B11R1.23 COC(=O)c1cccc(Cl)c1 Amb6365788 [0,1,1,0,0,0|0,0,0]=2 3845 B11R1.23 COC(=O)c1cccc(Cl)n1 Amb1197599 [0,1,1,0,0,0|1,0,0]=3 3846 B11R1.23 COC(=O)c1cccc(F)c1 Amb2689435 [0,1,1,0,0,0|0,0,0]=2 3847 B11R1.23 COC(=O)c1cccc(F)n1 Amb16231928 [0,1,1,0,0,0|1,0,0]=3 3848 B11R1.23 COC(=O)c1cccc(I)c1 Amb4009338 [0,1,1,0,0,0|0,0,0]=2 3849 B11R1.23 COC(=O)c1cccc(I)n1 Amb6565078 [0,1,1,0,0,0|1,0,0]=3 3850 B11R1.23 COC(=O)c1cccc(N)c1 Amb22001392 [0,1,1,0,0,0|0,0,0]=2 3851 B11R1.23 COC(=O)c1cccc(N)c1 Amb6358036 [0,1,1,0,0,0|0,0,0]=2 3852 B11R1.23 COC(=O)c1cccc(N)n1 Amb32992412 [0,1,1,0,0,0|1,0,0]=3 3853 B11R1.23 COC(=O)c1cccc(N)n1 Amb8630858 [0,1,1,0,0,0|1,0,0]=3 3854 B11R1.23 COC(=O)c1cccc(O)c1 Amb6355858 [0,1,1,0,0,0|0,0,0]=2 3855 B11R1.23 COC(=O)c1cccc(S)c1 Amb17617595 [0,1,1,0,0,0|0,0,0]=2 3856 B11R1.23 COC(=O)c1cccc(S)n1 Amb27211042 [0,1,1,0,0,0|1,0,0]=3 3857 B11R1.23 COC(=O)c1ccnc(Br)c1 Amb6565027 [0,1,1,0,0,0|1,0,0]=3 3858 B11R1.23 COC(=O)c1ccnc(Br)n1 Amb21964601 [0,1,1,0,0,0|2,0,0]=4 3859 B11R1.23 COC(=O)c1ccnc(C)c1 Amb19944358 [0,1,1,0,0,0|1,0,0]=3 3860 B11R1.23 COC(=O)c1ccnc(C)c1 Amb35789118 [0,1,1,0,0,0|1,0,0]=3 3861 B11R1.23 COC(=O)c1ccnc(C)n1 Amb20171561 [0,1,1,0,0,0|2,0,0]=4 3862 B11R1.23 COC(=O)c1ccnc(Cl)c1 Amb4477428 [0,1,1,0,0,0|1,0,0]=3 3863 B11R1.23 COC(=O)c1ccnc(Cl)n1 Amb33544512 [0,1,1,0,0,0|2,0,0]=4 3864 B11R1.23 COC(=O)c1ccnc(F)c1 Amb16231929 [0,1,1,0,0,0|1,0,0]=3 3865 B11R1.23 COC(=O)c1ccnc(F)n1 Amb25249346 [0,1,1,0,0,0|2,0,0]=4 3866 B11R1.23 COC(=O)c1ccnc(I)c1 Amb6565067 [0,1,1,0,0,0|1,0,0]=3 3867 B11R1.23 COC(=O)c1ccnc(N)c1 Amb842441 [0,1,1,0,0,0|1,0,0]=3 3868 B11R1.23 COC(=O)c1ccnc(N)n1 Amb22275936 [0,1,1,0,0,0|2,0,0]=4 3869 B11R1.23 COC(=O)c1ccnc(O)c1 Amb22741052 [0,1,1,0,0,0|1,0,0]=3 3870 B11R1.23 COC(=O)c1ccnc(O)c1 Amb35749332 [0,1,1,0,0,0|1,0,0]=3 3871 B11R1.23 COC(=O)c1ccnc(S)c1 Amb2612003 [0,1,1,0,0,0|1,0,0]=3 3872 B11R1.23 COC(=O)c1cncc(Br)c1 Amb2446343 [0,1,1,0,0,0|1,0,0]=3 3873 B11R1.23 COC(=O)c1cncc(Br)n1 Amb19958092 [0,1,1,0,0,0|2,0,0]=4 3874 B11R1.23 COC(=O)c1cncc(C)c1 Amb2689445 [0,1,1,0,0,0|1,0,0]=3 3875 B11R1.23 COC(=O)c1cncc(C)n1 Amb22236001 [0,1,1,0,0,0|2,0,0]=4 3876 B11R1.23 COC(=O)c1cncc(Cl)c1 Amb10603998 [0,1,1,0,0,0|1,0,0]=3 3877 B11R1.23 COC(=O)c1cncc(Cl)n1 Amb10067228 [0,1,1,0,0,0|2,0,0]=4 3878 B11R1.23 COC(=O)c1cncc(F)c1 Amb10606907 [0,1,1,0,0,0|1,0,0]=3 3879 B11R1.23 COC(=O)c1cncc(F)n1 Amb32676656 [0,1,1,0,0,0|2,0,0]=4 3880 B11R1.23 COC(=O)c1cncc(I)c1 Amb13887026 [0,1,1,0,0,0|1,0,0]=3 3881 B11R1.23 COC(=O)c1cncc(I)n1 Amb27791422 [0,1,1,0,0,0|2,0,0]=4 3882 B11R1.23 COC(=O)c1cncc(N)c1 Amb22756402 [0,1,1,0,0,0|1,0,0]=3 3883 B11R1.23 COC(=O)c1cncc(N)c1 Amb2695659 [0,1,1,0,0,0|1,0,0]=3 3884 B11R1.23 COC(=O)c1cncc(N)n1 Amb33544052 [0,1,1,0,0,0|2,0,0]=4 3885 B11R1.23 COC(=O)c1cncc(O)c1 Amb17739876 [0,1,1,0,0,0|1,0,0]=3 3886 B11R1.23 COC(=O)c1cncc(O)c1 Amb580916 [0,1,1,0,0,0|1,0,0]=3 3887 B11R1.23 COC(=O)c1cnnc(Cl)c1 Amb10604004 [0,1,1,0,0,0|2,0,0]=4 3888 B11R1.23 COC(=O)c1nccc(Br)n1 Amb22001872 [0,1,1,0,0,0|2,0,0]=4 3889 B11R1.23 COC(=O)c1nccc(C)n1 Amb21857157 [0,1,1,0,0,0|2,0,0]=4 3890 B11R1.23 COC(=O)c1nccc(Cl)n1 Amb20617427 [0,1,1,0,0,0|2,0,0]=4 3891 B11R1.23 COC(=O)c1nccc(F)n1 Amb26057594 [0,1,1,0,0,0|2,0,0]=4 3892 B11R1.23 COC(=O)c1nccc(N)n1 Amb10067821 [0,1,1,0,0,0|2,0,0]=4 3893 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [0,1,1,0,0,0|1,0,1]=4 3894 B11R1.23 COC(C)c1cccc(N)c1 Amb13952800 [0,1,1,0,0,0|1,0,1]=4 3895 B11R1.23 COC(O)c1cccc(Cl)c1 Amb27775876 [0,1,1,0,0,0|0,0,2]=4 3896 B11R1.23 COS(=O)c1cccc(Br)c1 Amb28368070 [0,1,1,0,0,0|1,0,0]=3 3897 B11R1.23 CSC(=N)c1cccc(Br)c1 Amb28061907 [0,1,1,0,0,0|1,1,0]=4 3898 B11R1.23 C\C=C(/C)c1cccc(F)c1 Amb25837290 [0,1,1,0,0,0|2,0,0]=4 3899 B11R1.23 C\C=C(/C)c1cccc(O)c1 Amb28074810 [0,1,1,0,0,0|2,0,0]=4 3900 B11R1.23 C\C=C(\C)c1cccc(F)c1 Amb26422978 [0,1,1,0,0,0|2,0,0]=4 3901 B11R1.23 Cc1cccc(C(=O)C#N)c1 Amb17231995 [0,1,1,0,0,0|2,0,0]=4 3902 B11R1.23 Cc1cccc(C(=O)C=O)c1 Amb24055227 [0,1,1,0,0,0|2,0,0]=4 3903 B11R1.23 Cc1cccc(C(=O)CBr)c1 Amb5395410 [0,1,1,0,0,0|2,0,0]=4 3904 B11R1.23 Cc1cccc(C(=O)CCl)c1 Amb18806064 [0,1,1,0,0,0|2,0,0]=4 3905 B11R1.23 Cc1cccc(C(=O)CF)c1 Amb24084129 [0,1,1,0,0,0|2,0,0]=4 3906 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb10976904 [0,1,1,0,0,0|2,0,0]=4 3907 B11R1.23 Cc1cccc(C(=O)CN)c1 Amb20171473 [0,1,1,0,0,0|2,0,0]=4 3908 B11R1.23 Cc1cccc(C(=O)CO)c1 Amb18182731 [0,1,1,0,0,0|2,0,0]=4 3909 B11R1.23 Cc1cccc(C(=O)NN)c1 Amb6336466 [0,1,1,0,0,0|2,0,0]=4 3910 B11R1.23 Cc1cccc(C(=O)NO)c1 Amb6258947 [0,1,1,0,0,0|2,0,0]=4 3911 B11R1.23 N#CC(=O)c1cccc(Br)c1 Amb22269768 [0,1,1,0,0,0|2,0,0]=4 3912 B11R1.23 N#CC(=O)c1cccc(Cl)c1 Amb6297070 [0,1,1,0,0,0|2,0,0]=4 3913 B11R1.23 N#CC(=O)c1cccc(F)c1 Amb17232049 [0,1,1,0,0,0|2,0,0]=4 3914 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [0,1,1,0,0,0|2,0,0]=4 3915 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb2693526 [0,1,1,0,0,0|2,0,0]=4 3916 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [0,1,1,0,0,0|2,0,0]=4 3917 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb2693527 [0,1,1,0,0,0|2,0,0]=4 3918 B11R1.23 NCC(=O)c1cccc(F)c1 Amb10840040 [0,1,1,0,0,0|2,0,0]=4 3919 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [0,1,1,0,0,0|2,0,0]=4 3920 B11R1.23 NCC(=O)c1cccc(N)c1 Amb27209101 [0,1,1,0,0,0|2,0,0]=4 3921 B11R1.23 NCC(=O)c1cccc(O)c1 Amb17593761 [0,1,1,0,0,0|2,0,0]=4 3922 B11R1.23 NCC(=O)c1cccc(O)c1 Amb33801517 [0,1,1,0,0,0|2,0,0]=4 3923 B11R1.23 NNC(=O)c1cccc(Br)c1 Amb1906809 [0,1,1,0,0,0|2,0,0]=4 3924 B11R1.23 NNC(=O)c1cccc(Cl)c1 Amb1207384 [0,1,1,0,0,0|2,0,0]=4 3925 B11R1.23 NNC(=O)c1cccc(F)c1 Amb1129033 [0,1,1,0,0,0|2,0,0]=4 3926 B11R1.23 NNC(=O)c1cccc(I)c1 Amb6402804 [0,1,1,0,0,0|2,0,0]=4 3927 B11R1.23 NNC(=O)c1cccc(N)c1 Amb2712415 [0,1,1,0,0,0|2,0,0]=4 3928 B11R1.23 NNC(=O)c1cccc(O)c1 Amb1208719 [0,1,1,0,0,0|2,0,0]=4 3929 B11R1.23 Nc1cccc(C(=O)CCl)c1 Amb27613503 [0,1,1,0,0,0|2,0,0]=4 3930 B11R1.23 O=C(CBr)c1cccc(Br)c1 Amb2685384 [0,1,1,0,0,0|2,0,0]=4 3931 B11R1.23 O=C(CBr)c1cccc(Cl)c1 Amb1224657 [0,1,1,0,0,0|2,0,0]=4 3932 B11R1.23 O=C(CBr)c1cccc(F)c1 Amb33533061 [0,1,1,0,0,0|2,0,0]=4 3933 B11R1.23 O=C(CBr)c1cccc(I)c1 Amb1885036 [0,1,1,0,0,0|2,0,0]=4 3934 B11R1.23 O=C(CBr)c1cccc(O)c1 Amb1981340 [0,1,1,0,0,0|2,0,0]=4 3935 B11R1.23 O=C(CCl)c1cccc(Br)c1 Amb17345812 [0,1,1,0,0,0|2,0,0]=4 3936 B11R1.23 O=C(CCl)c1cccc(Cl)c1 Amb8393232 [0,1,1,0,0,0|2,0,0]=4 3937 B11R1.23 O=C(CCl)c1cccc(F)c1 Amb10873159 [0,1,1,0,0,0|2,0,0]=4 3938 B11R1.23 O=C(CF)c1cccc(Br)c1 Amb27786161 [0,1,1,0,0,0|2,0,0]=4 3939 B11R1.23 O=C(CF)c1cccc(Cl)c1 Amb25714827 [0,1,1,0,0,0|2,0,0]=4 3940 B11R1.23 O=C(CF)c1cccc(F)c1 Amb23454840 [0,1,1,0,0,0|2,0,0]=4 3941 B11R1.23 O=C(CI)c1cccc(F)c1 Amb33483673 [0,1,1,0,0,0|2,0,0]=4 3942 B11R1.23 O=C(CO)c1cccc(Br)c1 Amb24579747 [0,1,1,0,0,0|2,0,0]=4 3943 B11R1.23 O=C(CO)c1cccc(Cl)c1 Amb18185666 [0,1,1,0,0,0|2,0,0]=4 3944 B11R1.23 O=C(CO)c1cccc(F)c1 Amb18182894 [0,1,1,0,0,0|2,0,0]=4 3945 B11R1.23 O=C(CO)c1cccc(I)c1 Amb33623872 [0,1,1,0,0,0|2,0,0]=4 3946 B11R1.23 O=C(NO)c1cccc(Br)c1 Amb6275747 [0,1,1,0,0,0|2,0,0]=4 3947 B11R1.23 O=C(NO)c1cccc(Cl)c1 Amb6265167 [0,1,1,0,0,0|2,0,0]=4 3948 B11R1.23 O=C(NO)c1cccc(F)c1 Amb6267435 [0,1,1,0,0,0|2,0,0]=4 3949 B11R1.23 O=C(NO)c1cccc(O)c1 Amb6270436 [0,1,1,0,0,0|2,0,0]=4 3950 B11R1.23 O=C(OO)c1cccc(Cl)c1 Amb6365645 [0,1,1,0,0,0|1,0,0]=3 3951 B11R1.23 O=C(O[Na])c1cc(I)ccn1 Amb21955171 [0,1,1,0,0,0|2,0,0]=4 3952 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb10067951 [0,1,1,0,0,0|2,0,0]=4 3953 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb20671217 [0,1,1,0,0,0|2,0,0]=4 3954 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb10067952 [0,1,1,0,0,0|2,0,0]=4 3955 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb18126569 [0,1,1,0,0,0|2,0,0]=4 3956 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10605526 [0,1,1,0,0,0|2,0,0]=4 3957 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10982490 [0,1,1,0,0,0|2,0,0]=4 3958 B11R1.23 O=CC(=O)c1cccc(O)c1 Amb18125054 [0,1,1,0,0,0|2,0,0]=4 3959 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,1,1,0,0,0|1,0,1]=4 3960 B11R1.36 C=C(C)C(=O)c1ccccc1 Amb17593661 [0,1,1,0,0,0|1,0,0]=3 3961 B11R1.36 C=C(C)C(=O)c1ccccn1 Amb27648526 [0,1,1,0,0,0|2,0,0]=4 3962 B11R1.36 C=C(C)C(=O)c1cccnc1 Amb25139926 [0,1,1,0,0,0|2,0,0]=4 3963 B11R1.36 C=C(C)C(=O)c1ccncc1 Amb24413658 [0,1,1,0,0,0|2,0,0]=4 3964 B11R1.36 C=C(Cl)C(=O)c1ccccc1 Amb28075337 [0,1,1,0,0,0|1,0,1]=4 3965 B11R1.36 C=C(c1ccccc1)C(C)C Amb27803525 [0,1,1,0,0,0|2,0,0]=4 3966 B11R1.36 C=C(c1ccccc1)C(C)Cl Amb27407746 [0,1,1,0,0,0|2,0,0]=4 3967 B11R1.36 CC(=O)C(=O)c1ccccc1 Amb2099500 [0,1,1,0,0,0|1,0,0]=3 3968 B11R1.36 CC(=O)C(=O)c1ccccn1 Amb26880304 [0,1,1,0,0,0|2,0,0]=4 3969 B11R1.36 CC(=O)C(=O)c1cccnc1 Amb25152863 [0,1,1,0,0,0|2,0,0]=4 3970 B11R1.36 CC(=O)C(=O)c1ccncc1 Amb26074229 [0,1,1,0,0,0|2,0,0]=4 3971 B11R1.36 CC(Br)C(=O)c1ccccc1 Amb9732279 [0,1,1,0,0,0|1,0,0]=3 3972 B11R1.36 CC(Br)C(=O)c1ccccn1 Amb22500042 [0,1,1,0,0,0|2,0,0]=4 3973 B11R1.36 CC(C)=C(C)c1ccccc1 Amb2780673 [0,1,1,0,0,0|2,0,0]=4 3974 B11R1.36 CC(C)C(=O)c1ccccc1 Amb4605986 [0,1,1,0,0,0|1,0,0]=3 3975 B11R1.36 CC(C)C(=O)c1ccccn1 Amb534902 [0,1,1,0,0,0|2,0,0]=4 3976 B11R1.36 CC(C)C(=O)c1cccnc1 Amb10607959 [0,1,1,0,0,0|2,0,0]=4 3977 B11R1.36 CC(C)C(=O)c1ccncc1 Amb19374024 [0,1,1,0,0,0|2,0,0]=4 3978 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [0,1,1,0,0,0|2,0,0]=4 3979 B11R1.36 CC(Cl)C(=O)c1ccccc1 Amb477908 [0,1,1,0,0,0|1,0,0]=3 3980 B11R1.36 CC(F)C(=O)c1ccccc1 Amb10603603 [0,1,1,0,0,0|1,0,0]=3 3981 B11R1.36 CC(N)C(=O)c1ccccc1 Amb6543419 [0,1,1,0,0,0|1,0,0]=3 3982 B11R1.36 CC(N)C(=O)c1ccccn1 Amb18201931 [0,1,1,0,0,0|2,0,0]=4 3983 B11R1.36 CC(N)C(=O)c1cccnc1 Amb18201928 [0,1,1,0,0,0|2,0,0]=4 3984 B11R1.36 CC(N)C(=O)c1ccncc1 Amb18201927 [0,1,1,0,0,0|2,0,0]=4 3985 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [0,1,1,0,0,0|1,0,0]=3 3986 B11R1.36 CC(O)C(=O)c1ccccn1 Amb26880601 [0,1,1,0,0,0|2,0,0]=4 3987 B11R1.36 CC(O)C(=O)c1cccnc1 Amb25712989 [0,1,1,0,0,0|2,0,0]=4 3988 B11R1.36 CC(O)C(=O)c1ccncc1 Amb28367025 [0,1,1,0,0,0|2,0,0]=4 3989 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [0,1,1,0,0,0|1,0,0]=3 3990 B11R1.36 CC(S)C(=O)c1ccccn1 Amb27828931 [0,1,1,0,0,0|2,0,0]=4 3991 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [0,1,1,0,0,0|2,0,0]=4 3992 B11R1.36 CN(C)C(=O)c1ccccc1 Amb33513268 [0,1,1,0,0,0|1,0,0]=3 3993 B11R1.36 CN(C)C(=O)c1ccccc1 Amb3886594 [0,1,1,0,0,0|1,0,0]=3 3994 B11R1.36 CN(C)C(=O)c1cccnc1 Amb3886597 [0,1,1,0,0,0|2,0,0]=4 3995 B11R1.36 CN(C)C(=O)c1ccncc1 Amb8343640 [0,1,1,0,0,0|2,0,0]=4 3996 B11R1.36 CN(C)C(=S)c1ccccc1 Amb2733763 [0,1,1,0,0,0|1,1,0]=4 3997 B11R1.36 CN(N)C(=N)c1ccccc1 Amb10870953 [0,1,1,0,0,0|2,0,0]=4 3998 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [0,1,1,0,0,0|1,0,0]=3 3999 B11R1.36 CN(N)C(=O)c1ccccn1 Amb27238080 [0,1,1,0,0,0|2,0,0]=4 4000 B11R1.36 CN(N)C(=O)c1cccnc1 Amb839670 [0,1,1,0,0,0|2,0,0]=4 4001 B11R1.36 CN(N)C(=S)c1ccccc1 Amb26880376 [0,1,1,0,0,0|1,1,0]=4 4002 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [0,1,1,0,0,0|1,0,0]=3 4003 B11R1.36 CN(O)C(=O)c1ccccn1 Amb10572675 [0,1,1,0,0,0|2,0,0]=4 4004 B11R1.36 CN(O)C(=O)c1ccncc1 Amb27949143 [0,1,1,0,0,0|2,0,0]=4 4005 B11R1.36 C[C@@H](Br)C(=O)c1ccccc1 Amb27176347 [0,1,1,0,0,0|1,0,0]=3 4006 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [0,1,1,0,0,0|1,0,0]=3 4007 B11R1.36 C[C@@H](N)C(=O)c1cccnc1 Amb30024811 [0,1,1,0,0,0|2,0,0]=4 4008 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [0,1,1,0,0,0|1,0,0]=3 4009 B11R1.36 C[C@H](N)C(=O)c1cccnc1 Amb33131781 [0,1,1,0,0,0|2,0,0]=4 4010 B11R1.36 C\C(Br)=C(/C)c1ccccc1 Amb4035425 [0,1,1,0,0,0|2,0,0]=4 4011 B11R1.36 C\[N+]([O-])=C(/N)c1ccccc1 Amb27949093 [0,1,1,0,0,0|2,0,0]=4 4012 B11R1.36 C\[N+]([O-])=C(\N)c1ccccc1 Amb33621249 [0,1,1,0,0,0|2,0,0]=4 4013 B11R1.36 N=C(N)C(=O)c1ccccc1 Amb27654024 [0,1,1,0,0,0|2,0,0]=4 4014 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,1,1,0,0,0|2,0,0]=4 4015 B11R1.36 NC(=S)C(=O)c1ccccc1 Amb6892994 [0,1,1,0,0,0|2,0,0]=4 4016 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [0,1,1,0,0,0|2,0,0]=4 4017 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [0,1,1,0,0,0|2,0,0]=4 4018 B11R1.36 O=C([O-])C(=O)c1ccccc1 Amb33204524 [0,1,1,0,0,0|2,0,0]=4 4019 B11R1.36 O=C(c1ccccc1)C(Br)Br Amb17940392 [0,1,1,0,0,0|2,0,0]=4 4020 B11R1.36 O=C(c1ccccc1)C(Cl)Cl Amb8513102 [0,1,1,0,0,0|2,0,0]=4 4021 B11R1.36 O=C(c1ccccc1)C(F)Br Amb24104059 [0,1,1,0,0,0|2,0,0]=4 4022 B11R1.36 O=C(c1ccccc1)C(F)F Amb9826858 [0,1,1,0,0,0|2,0,0]=4 4023 B11R1.36 O=C(c1ccccc1)C(O)Cl Amb24528115 [0,1,1,0,0,0|2,0,0]=4 4024 B11R1.36 O=C(c1ccccc1)C(O)O Amb8392241 [0,1,1,0,0,0|2,0,0]=4 4025 B11R1.222 C#CC(=O)c1ccccc1Br Amb27391927 [0,1,1,0,0,0|1,0,1]=4 4026 B11R1.222 C#CC(=O)c1ccccc1C Amb28399059 [0,1,1,0,0,0|1,0,1]=4 4027 B11R1.222 C#CC(=O)c1ccccc1Cl Amb25872974 [0,1,1,0,0,0|1,0,1]=4 4028 B11R1.222 C#CC(=O)c1ccccc1F Amb27868130 [0,1,1,0,0,0|1,0,1]=4 4029 B11R1.222 C#CC(=O)c1ccccc1N Amb24351123 [0,1,1,0,0,0|1,0,1]=4 4030 B11R1.222 C=CC(=O)c1ccccc1Br Amb26333627 [0,1,1,0,0,0|1,0,1]=4 4031 B11R1.222 C=CC(=O)c1ccccc1C Amb28144593 [0,1,1,0,0,0|1,0,1]=4 4032 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [0,1,1,0,0,0|1,0,1]=4 4033 B11R1.222 C=CC(=O)c1ccccc1F Amb27883395 [0,1,1,0,0,0|1,0,1]=4 4034 B11R1.222 C=CC(=O)c1ccccc1N Amb26987473 [0,1,1,0,0,0|1,0,1]=4 4035 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [0,1,1,0,0,0|1,0,1]=4 4036 B11R1.222 CCC(=O)C1=CC=CNC1=O Amb35744761 [0,1,1,0,0,0|2,0,0]=4 4037 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [0,1,1,0,0,0|1,0,0]=3 4038 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [0,1,1,0,0,0|1,0,0]=3 4039 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [0,1,1,0,0,0|1,0,0]=3 4040 B11R1.222 CCC(=O)c1ccccc1F Amb4605916 [0,1,1,0,0,0|1,0,0]=3 4041 B11R1.222 CCC(=O)c1ccccc1I Amb26353010 [0,1,1,0,0,0|1,0,0]=3 4042 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [0,1,1,0,0,0|1,0,0]=3 4043 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [0,1,1,0,0,0|1,0,0]=3 4044 B11R1.222 CCC(=O)c1cccnc1C Amb28041295 [0,1,1,0,0,0|2,0,0]=4 4045 B11R1.222 CCC(=O)c1cccnc1Cl Amb10976561 [0,1,1,0,0,0|2,0,0]=4 4046 B11R1.222 CCC(=O)c1cccnc1F Amb25723783 [0,1,1,0,0,0|2,0,0]=4 4047 B11R1.222 CCC(=O)c1cccnc1N Amb8386846 [0,1,1,0,0,0|2,0,0]=4 4048 B11R1.222 CCC(=O)c1ccncc1C Amb28062284 [0,1,1,0,0,0|2,0,0]=4 4049 B11R1.222 CCC(=O)c1ccncc1F Amb23455228 [0,1,1,0,0,0|2,0,0]=4 4050 B11R1.222 CCC(=O)c1ccncc1N Amb23401919 [0,1,1,0,0,0|2,0,0]=4 4051 B11R1.222 CCC(=O)c1cnccc1Cl Amb27781101 [0,1,1,0,0,0|2,0,0]=4 4052 B11R1.222 CCC(=O)c1cnccc1N Amb25293482 [0,1,1,0,0,0|2,0,0]=4 4053 B11R1.222 CCC(=O)c1ncccc1C Amb28251777 [0,1,1,0,0,0|2,0,0]=4 4054 B11R1.222 CCC(=O)c1ncccc1F Amb23412453 [0,1,1,0,0,0|2,0,0]=4 4055 B11R1.222 CCC(=O)c1ncccc1N Amb24433161 [0,1,1,0,0,0|2,0,0]=4 4056 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [0,1,1,0,0,0|2,0,0]=4 4057 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [0,1,1,0,0,0|2,0,0]=4 4058 B11R1.222 CNC(=N)c1ccccc1Cl Amb28652842 [0,1,1,0,0,0|2,0,0]=4 4059 B11R1.222 CNC(=O)C1=CNC=CC1=O Amb25980915 [0,1,1,0,0,0|2,0,0]=4 4060 B11R1.222 CNC(=O)c1ccccc1Br Amb2625865 [0,1,1,0,0,0|1,0,0]=3 4061 B11R1.222 CNC(=O)c1ccccc1C Amb2613120 [0,1,1,0,0,0|1,0,0]=3 4062 B11R1.222 CNC(=O)c1ccccc1I Amb2754649 [0,1,1,0,0,0|1,0,0]=3 4063 B11R1.222 CNC(=O)c1ccccc1N Amb6541338 [0,1,1,0,0,0|1,0,0]=3 4064 B11R1.222 CNC(=O)c1ccccc1N Amb6773994 [0,1,1,0,0,0|1,0,0]=3 4065 B11R1.222 CNC(=O)c1ccccc1O Amb534308 [0,1,1,0,0,0|1,0,0]=3 4066 B11R1.222 CNC(=O)c1cccnc1Br Amb28184490 [0,1,1,0,0,0|2,0,0]=4 4067 B11R1.222 CNC(=O)c1cccnc1Cl Amb6252044 [0,1,1,0,0,0|2,0,0]=4 4068 B11R1.222 CNC(=O)c1cccnc1N Amb16233797 [0,1,1,0,0,0|2,0,0]=4 4069 B11R1.222 CNC(=O)c1cccnc1O Amb18125363 [0,1,1,0,0,0|2,0,0]=4 4070 B11R1.222 CNC(=O)c1ccncc1Br Amb28074145 [0,1,1,0,0,0|2,0,0]=4 4071 B11R1.222 CNC(=O)c1ccncc1Cl Amb27976491 [0,1,1,0,0,0|2,0,0]=4 4072 B11R1.222 CNC(=O)c1ccncc1N Amb23556941 [0,1,1,0,0,0|2,0,0]=4 4073 B11R1.222 CNC(=O)c1cnccc1N Amb22263729 [0,1,1,0,0,0|2,0,0]=4 4074 B11R1.222 CNC(=O)c1ncccc1C Amb24413396 [0,1,1,0,0,0|2,0,0]=4 4075 B11R1.222 CNC(=O)c1ncccc1Cl Amb28127963 [0,1,1,0,0,0|2,0,0]=4 4076 B11R1.222 CNC(=S)c1ccccc1F Amb27412514 [0,1,1,0,0,0|1,1,0]=4 4077 B11R1.222 CNC(=S)c1ccccc1N Amb26845442 [0,1,1,0,0,0|1,1,0]=4 4078 B11R1.222 CNC(=S)c1ccccc1O Amb27215302 [0,1,1,0,0,0|1,1,0]=4 4079 B11R1.222 COC(=N)C1=CC=CNC1=O Amb19650675 [0,1,1,0,0,0|2,0,0]=4 4080 B11R1.222 COC(=N)c1ccccc1C Amb27146037 [0,1,1,0,0,0|1,0,0]=3 4081 B11R1.222 COC(=N)c1ccccc1Cl Amb18180241 [0,1,1,0,0,0|1,0,0]=3 4082 B11R1.222 COC(=N)c1ccccc1F Amb18065389 [0,1,1,0,0,0|1,0,0]=3 4083 B11R1.222 COC(=N)c1ccccc1O Amb25729105 [0,1,1,0,0,0|1,0,0]=3 4084 B11R1.222 COC(=N)c1cnccc1C Amb27832808 [0,1,1,0,0,0|2,0,0]=4 4085 B11R1.222 COC(=O)C1=C(Br)C=CCN1 Amb28365512 [0,1,1,0,0,0|1,0,1]=4 4086 B11R1.222 COC(=O)C1=C(C)NC=CC1 Amb27490951 [0,1,1,0,0,0|1,0,1]=4 4087 B11R1.222 COC(=O)C1=C(O)C=CCC1 Amb17593845 [0,1,1,0,0,0|0,0,2]=4 4088 B11R1.222 COC(=O)C1=CC=CNC1=O Amb19894701 [0,1,1,0,0,0|1,0,0]=3 4089 B11R1.222 COC(=O)C1=CC=CNC1=S Amb33551128 [0,1,1,0,0,0|1,0,0]=3 4090 B11R1.222 COC(=O)C1=CC=COC1=O Amb19894704 [0,1,1,0,0,0|1,0,0]=3 4091 B11R1.222 COC(=O)C1=CC=NNC1=O Amb21857256 [0,1,1,0,0,0|2,0,0]=4 4092 B11R1.222 COC(=O)C1=CN=CNC1=O Amb19887177 [0,1,1,0,0,0|2,0,0]=4 4093 B11R1.222 COC(=O)C1=COC=CC1=O Amb27658839 [0,1,1,0,0,0|1,0,0]=3 4094 B11R1.222 COC(=O)C1N=CC=CC1=N Amb34915821 [0,1,1,0,0,0|1,0,1]=4 4095 B11R1.222 COC(=O)C1OC=CC=C1O Amb27234013 [0,1,1,0,0,0|1,0,1]=4 4096 B11R1.222 COC(=O)c1cccc[n+]1C Amb27880886 [0,1,1,0,0,0|1,0,0]=3 4097 B11R1.222 COC(=O)c1cccc[n+]1[O-] Amb10573355 [0,1,1,0,0,0|1,0,0]=3 4098 B11R1.222 COC(=O)c1ccccc1Br Amb2725116 [0,1,1,0,0,0|0,0,0]=2 4099 B11R1.222 COC(=O)c1ccccc1C Amb2726227 [0,1,1,0,0,0|0,0,0]=2 4100 B11R1.222 COC(=O)c1ccccc1Cl Amb2700777 [0,1,1,0,0,0|0,0,0]=2 4101 B11R1.222 COC(=O)c1ccccc1F Amb2689434 [0,1,1,0,0,0|0,0,0]=2 4102 B11R1.222 COC(=O)c1ccccc1I Amb2689458 [0,1,1,0,0,0|0,0,0]=2 4103 B11R1.222 COC(=O)c1ccccc1N Amb1229837 [0,1,1,0,0,0|0,0,0]=2 4104 B11R1.222 COC(=O)c1ccccc1N Amb22741062 [0,1,1,0,0,0|0,0,0]=2 4105 B11R1.222 COC(=O)c1ccccc1O Amb1200750 [0,1,1,0,0,0|0,0,0]=2 4106 B11R1.222 COC(=O)c1ccccc1S Amb2689742 [0,1,1,0,0,0|0,0,0]=2 4107 B11R1.222 COC(=O)c1cccnc1Br Amb4561101 [0,1,1,0,0,0|1,0,0]=3 4108 B11R1.222 COC(=O)c1cccnc1C Amb8396132 [0,1,1,0,0,0|1,0,0]=3 4109 B11R1.222 COC(=O)c1cccnc1Cl Amb1241121 [0,1,1,0,0,0|1,0,0]=3 4110 B11R1.222 COC(=O)c1cccnc1F Amb8393046 [0,1,1,0,0,0|1,0,0]=3 4111 B11R1.222 COC(=O)c1cccnc1I Amb10070314 [0,1,1,0,0,0|1,0,0]=3 4112 B11R1.222 COC(=O)c1cccnc1N Amb1049688 [0,1,1,0,0,0|1,0,0]=3 4113 B11R1.222 COC(=O)c1cccnc1O Amb10601402 [0,1,1,0,0,0|1,0,0]=3 4114 B11R1.222 COC(=O)c1cccnc1S Amb22282222 [0,1,1,0,0,0|1,0,0]=3 4115 B11R1.222 COC(=O)c1cccnc1S Amb686046 [0,1,1,0,0,0|1,0,0]=3 4116 B11R1.222 COC(=O)c1ccncc1Br Amb10606114 [0,1,1,0,0,0|1,0,0]=3 4117 B11R1.222 COC(=O)c1ccncc1C Amb2694740 [0,1,1,0,0,0|1,0,0]=3 4118 B11R1.222 COC(=O)c1ccncc1Cl Amb8630940 [0,1,1,0,0,0|1,0,0]=3 4119 B11R1.222 COC(=O)c1ccncc1F Amb22411142 [0,1,1,0,0,0|1,0,0]=3 4120 B11R1.222 COC(=O)c1ccncc1I Amb10602323 [0,1,1,0,0,0|1,0,0]=3 4121 B11R1.222 COC(=O)c1ccncc1N Amb2440807 [0,1,1,0,0,0|1,0,0]=3 4122 B11R1.222 COC(=O)c1ccncc1O Amb33321485 [0,1,1,0,0,0|1,0,0]=3 4123 B11R1.222 COC(=O)c1ccncc1O Amb5559272 [0,1,1,0,0,0|1,0,0]=3 4124 B11R1.222 COC(=O)c1ccnnc1N Amb22523474 [0,1,1,0,0,0|2,0,0]=4 4125 B11R1.222 COC(=O)c1cnccc1Br Amb31204789 [0,1,1,0,0,0|1,0,0]=3 4126 B11R1.222 COC(=O)c1cnccc1C Amb16230838 [0,1,1,0,0,0|1,0,0]=3 4127 B11R1.222 COC(=O)c1cnccc1Cl Amb10603776 [0,1,1,0,0,0|1,0,0]=3 4128 B11R1.222 COC(=O)c1cnccc1Cl Amb19957887 [0,1,1,0,0,0|1,0,0]=3 4129 B11R1.222 COC(=O)c1cnccc1F Amb27974486 [0,1,1,0,0,0|1,0,0]=3 4130 B11R1.222 COC(=O)c1cnccc1I Amb26870074 [0,1,1,0,0,0|1,0,0]=3 4131 B11R1.222 COC(=O)c1cnccc1N Amb2697344 [0,1,1,0,0,0|1,0,0]=3 4132 B11R1.222 COC(=O)c1cnccc1O Amb2697989 [0,1,1,0,0,0|1,0,0]=3 4133 B11R1.222 COC(=O)c1cncnc1Br Amb22496090 [0,1,1,0,0,0|2,0,0]=4 4134 B11R1.222 COC(=O)c1cncnc1C Amb23401793 [0,1,1,0,0,0|2,0,0]=4 4135 B11R1.222 COC(=O)c1cncnc1Cl Amb22262999 [0,1,1,0,0,0|2,0,0]=4 4136 B11R1.222 COC(=O)c1cncnc1F Amb27192375 [0,1,1,0,0,0|2,0,0]=4 4137 B11R1.222 COC(=O)c1cncnc1N Amb19957748 [0,1,1,0,0,0|2,0,0]=4 4138 B11R1.222 COC(=O)c1cncnc1O Amb2699795 [0,1,1,0,0,0|2,0,0]=4 4139 B11R1.222 COC(=O)c1cnncc1C Amb22406186 [0,1,1,0,0,0|2,0,0]=4 4140 B11R1.222 COC(=O)c1cnncc1O Amb27636460 [0,1,1,0,0,0|2,0,0]=4 4141 B11R1.222 COC(=O)c1ncccc1Br Amb10975828 [0,1,1,0,0,0|1,0,0]=3 4142 B11R1.222 COC(=O)c1ncccc1C Amb16233270 [0,1,1,0,0,0|1,0,0]=3 4143 B11R1.222 COC(=O)c1ncccc1C Amb22886637 [0,1,1,0,0,0|1,0,0]=3 4144 B11R1.222 COC(=O)c1ncccc1Cl Amb19957514 [0,1,1,0,0,0|1,0,0]=3 4145 B11R1.222 COC(=O)c1ncccc1F Amb10602313 [0,1,1,0,0,0|1,0,0]=3 4146 B11R1.222 COC(=O)c1ncccc1I Amb2612017 [0,1,1,0,0,0|1,0,0]=3 4147 B11R1.222 COC(=O)c1ncccc1N Amb5720886 [0,1,1,0,0,0|1,0,0]=3 4148 B11R1.222 COC(=O)c1ncccc1O Amb2417381 [0,1,1,0,0,0|1,0,0]=3 4149 B11R1.222 COC(=O)c1ncccc1S Amb27171461 [0,1,1,0,0,0|1,0,0]=3 4150 B11R1.222 COC(=O)c1nccnc1Br Amb2797939 [0,1,1,0,0,0|2,0,0]=4 4151 B11R1.222 COC(=O)c1nccnc1C Amb21962549 [0,1,1,0,0,0|2,0,0]=4 4152 B11R1.222 COC(=O)c1nccnc1Cl Amb2696637 [0,1,1,0,0,0|2,0,0]=4 4153 B11R1.222 COC(=O)c1nccnc1F Amb26866309 [0,1,1,0,0,0|2,0,0]=4 4154 B11R1.222 COC(=O)c1nccnc1I Amb19958598 [0,1,1,0,0,0|2,0,0]=4 4155 B11R1.222 COC(=O)c1nccnc1N Amb1157799 [0,1,1,0,0,0|2,0,0]=4 4156 B11R1.222 COC(=O)c1nccnc1O Amb2695550 [0,1,1,0,0,0|2,0,0]=4 4157 B11R1.222 COC(=O)c1ncncc1Br Amb10603996 [0,1,1,0,0,0|2,0,0]=4 4158 B11R1.222 COC(=O)c1ncncc1C Amb27636420 [0,1,1,0,0,0|2,0,0]=4 4159 B11R1.222 COC(=O)c1ncncc1Cl Amb26655959 [0,1,1,0,0,0|2,0,0]=4 4160 B11R1.222 COC(=O)c1ncncc1F Amb28129857 [0,1,1,0,0,0|2,0,0]=4 4161 B11R1.222 COC(=O)c1ncncc1I Amb27171316 [0,1,1,0,0,0|2,0,0]=4 4162 B11R1.222 COC(=O)c1ncncc1N Amb27852807 [0,1,1,0,0,0|2,0,0]=4 4163 B11R1.222 COC(=S)c1ccccc1O Amb22232674 [0,1,1,0,0,0|0,1,0]=3 4164 B11R1.222 COC(C)c1ccccc1O Amb18125398 [0,1,1,0,0,0|1,0,1]=4 4165 B11R1.222 COC(O)c1ccccc1Cl Amb27651946 [0,1,1,0,0,0|0,0,2]=4 4166 B11R1.222 CON(C)c1ccccc1N Amb9492138 [0,1,1,0,0,0|2,0,0]=4 4167 B11R1.222 CSC(=N)c1ccccc1O Amb28122445 [0,1,1,0,0,0|1,1,0]=4 4168 B11R1.222 C\C=C(/C)c1ccccc1N Amb18124838 [0,1,1,0,0,0|2,0,0]=4 4169 B11R1.222 C\C=C(/C)c1ccccc1O Amb18124922 [0,1,1,0,0,0|2,0,0]=4 4170 B11R1.222 C\C=C(\C)c1ccccc1N Amb28422952 [0,1,1,0,0,0|2,0,0]=4 4171 B11R1.222 C\N=C(/C)c1ccccc1O Amb27591596 [0,1,1,0,0,0|2,0,0]=4 4172 B11R1.222 C\N=C(\C)c1ccccc1O Amb27426431 [0,1,1,0,0,0|2,0,0]=4 4173 B11R1.222 C\N=C(\F)c1ccccc1O Amb28132410 [0,1,1,0,0,0|2,0,0]=4 4174 B11R1.222 Cc1ccccc1C(=O)C#N Amb16231820 [0,1,1,0,0,0|2,0,0]=4 4175 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [0,1,1,0,0,0|2,0,0]=4 4176 B11R1.222 Cc1ccccc1C(=O)CBr Amb2792913 [0,1,1,0,0,0|2,0,0]=4 4177 B11R1.222 Cc1ccccc1C(=O)CCl Amb18185586 [0,1,1,0,0,0|2,0,0]=4 4178 B11R1.222 Cc1ccccc1C(=O)CF Amb25807621 [0,1,1,0,0,0|2,0,0]=4 4179 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [0,1,1,0,0,0|2,0,0]=4 4180 B11R1.222 Cc1ccccc1C(=O)CN Amb2693529 [0,1,1,0,0,0|2,0,0]=4 4181 B11R1.222 Cc1ccccc1C(=O)CO Amb18182730 [0,1,1,0,0,0|2,0,0]=4 4182 B11R1.222 Cc1ccccc1C(=O)NN Amb6355883 [0,1,1,0,0,0|2,0,0]=4 4183 B11R1.222 Cc1ccccc1C(=O)NO Amb6278426 [0,1,1,0,0,0|2,0,0]=4 4184 B11R1.222 N#CC(=O)c1ccccc1Br Amb22269824 [0,1,1,0,0,0|2,0,0]=4 4185 B11R1.222 N#CC(=O)c1ccccc1Cl Amb6383873 [0,1,1,0,0,0|2,0,0]=4 4186 B11R1.222 N#CC(=O)c1ccccc1F Amb17232048 [0,1,1,0,0,0|2,0,0]=4 4187 B11R1.222 N#CC(=O)c1ccccc1I Amb22367991 [0,1,1,0,0,0|2,0,0]=4 4188 B11R1.222 N#CC(=O)c1ccccc1N Amb27487371 [0,1,1,0,0,0|2,0,0]=4 4189 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [0,1,1,0,0,0|2,0,0]=4 4190 B11R1.222 NCC(=O)c1ccccc1Br Amb8383857 [0,1,1,0,0,0|2,0,0]=4 4191 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [0,1,1,0,0,0|2,0,0]=4 4192 B11R1.222 NCC(=O)c1ccccc1Cl Amb8383856 [0,1,1,0,0,0|2,0,0]=4 4193 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [0,1,1,0,0,0|2,0,0]=4 4194 B11R1.222 NCC(=O)c1ccccc1F Amb8383855 [0,1,1,0,0,0|2,0,0]=4 4195 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [0,1,1,0,0,0|2,0,0]=4 4196 B11R1.222 NCC(=O)c1ccccc1O Amb32664086 [0,1,1,0,0,0|2,0,0]=4 4197 B11R1.222 NCC(=O)c1ccccc1O Amb33801554 [0,1,1,0,0,0|2,0,0]=4 4198 B11R1.222 NNC(=O)c1ccccc1Br Amb6366604 [0,1,1,0,0,0|2,0,0]=4 4199 B11R1.222 NNC(=O)c1ccccc1Cl Amb6335230 [0,1,1,0,0,0|2,0,0]=4 4200 B11R1.222 NNC(=O)c1ccccc1F Amb1104489 [0,1,1,0,0,0|2,0,0]=4 4201 B11R1.222 NNC(=O)c1ccccc1F Amb33313449 [0,1,1,0,0,0|2,0,0]=4 4202 B11R1.222 NNC(=O)c1ccccc1I Amb6317927 [0,1,1,0,0,0|2,0,0]=4 4203 B11R1.222 NNC(=O)c1ccccc1N Amb1775193 [0,1,1,0,0,0|2,0,0]=4 4204 B11R1.222 NNC(=O)c1ccccc1O Amb1796080 [0,1,1,0,0,0|2,0,0]=4 4205 B11R1.222 Nc1ccccc1C(=O)NO Amb3094175 [0,1,1,0,0,0|2,0,0]=4 4206 B11R1.222 O=C(CBr)c1ccccc1Br Amb1106771 [0,1,1,0,0,0|2,0,0]=4 4207 B11R1.222 O=C(CBr)c1ccccc1Cl Amb2608538 [0,1,1,0,0,0|2,0,0]=4 4208 B11R1.222 O=C(CBr)c1ccccc1F Amb1106770 [0,1,1,0,0,0|2,0,0]=4 4209 B11R1.222 O=C(CBr)c1ccccc1I Amb22737619 [0,1,1,0,0,0|2,0,0]=4 4210 B11R1.222 O=C(CBr)c1ccccc1O Amb4418417 [0,1,1,0,0,0|2,0,0]=4 4211 B11R1.222 O=C(CCl)c1ccccc1Cl Amb18330058 [0,1,1,0,0,0|2,0,0]=4 4212 B11R1.222 O=C(CCl)c1ccccc1F Amb18807753 [0,1,1,0,0,0|2,0,0]=4 4213 B11R1.222 O=C(CCl)c1ccccc1O Amb2209413 [0,1,1,0,0,0|2,0,0]=4 4214 B11R1.222 O=C(CF)c1ccccc1Br Amb22489704 [0,1,1,0,0,0|2,0,0]=4 4215 B11R1.222 O=C(CF)c1ccccc1Cl Amb23454835 [0,1,1,0,0,0|2,0,0]=4 4216 B11R1.222 O=C(CF)c1ccccc1F Amb23454839 [0,1,1,0,0,0|2,0,0]=4 4217 B11R1.222 O=C(CO)c1ccccc1Br Amb24639690 [0,1,1,0,0,0|2,0,0]=4 4218 B11R1.222 O=C(CO)c1ccccc1Cl Amb18185665 [0,1,1,0,0,0|2,0,0]=4 4219 B11R1.222 O=C(CO)c1ccccc1F Amb18182895 [0,1,1,0,0,0|2,0,0]=4 4220 B11R1.222 O=C(CO)c1ccccc1I Amb33623873 [0,1,1,0,0,0|2,0,0]=4 4221 B11R1.222 O=C(CO)c1ccccc1O Amb18125347 [0,1,1,0,0,0|2,0,0]=4 4222 B11R1.222 O=C(NO)c1ccccc1Br Amb6269839 [0,1,1,0,0,0|2,0,0]=4 4223 B11R1.222 O=C(NO)c1ccccc1Cl Amb6259829 [0,1,1,0,0,0|2,0,0]=4 4224 B11R1.222 O=C(NO)c1ccccc1F Amb6269743 [0,1,1,0,0,0|2,0,0]=4 4225 B11R1.222 O=C(NO)c1ccccc1O Amb2504335 [0,1,1,0,0,0|2,0,0]=4 4226 B11R1.222 O=CC(=O)c1ccccc1Br Amb18131520 [0,1,1,0,0,0|2,0,0]=4 4227 B11R1.222 O=CC(=O)c1ccccc1Cl Amb18126568 [0,1,1,0,0,0|2,0,0]=4 4228 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [0,1,1,0,0,0|2,0,0]=4 4229 B11R1.222 O=CC(=O)c1ccccc1F Amb22011841 [0,1,1,0,0,0|2,0,0]=4 4230 B11R1.222 O=CC(=O)c1ccccc1O Amb25269559 [0,1,1,0,0,0|2,0,0]=4 4231 B11R1.222 [Li]OC(=O)c1ccccc1O Amb3150540 [0,1,1,0,0,0|1,0,0]=3 4232 B11R1.27 C=CCCNC1=CC(=O)OC1 Amb28254532 [0,1,1,0,0,0|0,0,2]=4 4233 B11R1.27 C=C\C=C\CC1COC(=O)N1 Amb28118383 [0,1,1,0,0,0|1,0,1]=4 4234 B11R1.27 C=C\C=C\C[C@@H]1COC(=O)N1 Amb28047310 [0,1,1,0,0,0|1,0,1]=4 4235 B11R1.27 C=C\C=C\C[C@H]1COC(=O)N1 Amb27234718 [0,1,1,0,0,0|1,0,1]=4 4236 B11R1.39 C=CC(=O)\C=C1\CCC(=O)N1 Amb25678215 [0,1,1,0,0,0|2,0,0]=4 4237 B11R1.75 C=C(C)C#CC1=CC(=O)OC1 Amb27848905 [0,1,1,0,0,0|0,0,2]=4 4238 B11R1.75 CC(=O)\C=C/C1=CC(=O)CC1 Amb28351395 [0,1,1,0,0,0|1,0,1]=4 4239 B11R1.230 O=C\C=C\C1=CC(=O)OC1O Amb28457571 [0,1,1,0,0,0|1,0,0]=3 4240 B11R1.1 C=CCCc1ccc(Br)cc1 Amb6298956 [0,1,1,0,0,0|2,0,0]=4 4241 B11R1.1 C=CCCc1ccc(C)cc1 Amb6299000 [0,1,1,0,0,0|2,0,0]=4 4242 B11R1.1 C=CCCc1ccc(F)cc1 Amb2721507 [0,1,1,0,0,0|2,0,0]=4 4243 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,1,0,0,0|2,0,0]=4 4244 B11R1.1 C=COCc1ccc(Br)cc1 Amb28046575 [0,1,1,0,0,0|1,0,0]=3 4245 B11R1.1 C=COCc1ccc(Cl)cc1 Amb27976232 [0,1,1,0,0,0|1,0,0]=3 4246 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [0,1,1,0,0,0|1,0,1]=4 4247 B11R1.1 CCOCc1ccc(C)cc1 Amb33733834 [0,1,1,0,0,0|1,0,1]=4 4248 B11R1.1 CCOCc1ccc(Cl)cc1 Amb25977812 [0,1,1,0,0,0|1,0,1]=4 4249 B11R1.1 CCOCc1ccc(F)cc1 Amb30594745 [0,1,1,0,0,0|1,0,1]=4 4250 B11R1.1 CCOCc1ccc(N)cc1 Amb1125782 [0,1,1,0,0,0|1,0,1]=4 4251 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [0,1,1,0,0,0|1,0,1]=4 4252 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,1,0,0,0|2,0,0]=4 4253 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,1,0,0,0|2,0,0]=4 4254 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [0,1,1,0,0,0|1,0,0]=3 4255 B11R1.1 Cc1ccc(CCC=O)cn1 Amb28124472 [0,1,1,0,0,0|2,0,0]=4 4256 B11R1.1 Cc1ccc(CN=C=O)cc1 Amb3939296 [0,1,1,0,0,0|1,0,1]=4 4257 B11R1.1 Cc1ccc(CNC=O)cc1 Amb1916037 [0,1,1,0,0,0|1,0,0]=3 4258 B11R1.1 Cc1ccc(COCCl)cc1 Amb27833050 [0,1,1,0,0,0|1,0,1]=4 4259 B11R1.1 Cc1ccc(NNC=O)cc1 Amb2721110 [0,1,1,0,0,0|2,0,0]=4 4260 B11R1.1 Cc1ccc(OCC=O)cc1 Amb5731821 [0,1,1,0,0,0|2,0,0]=4 4261 B11R1.1 Cc1ccc(SCC=O)cc1 Amb17082904 [0,1,1,0,0,0|2,0,0]=4 4262 B11R1.1 Cc1ccc(\C=C/C=O)cc1 Amb27268490 [0,1,1,0,0,0|1,0,1]=4 4263 B11R1.1 Cc1ccc(\C=C\C=O)cc1 Amb17232009 [0,1,1,0,0,0|1,0,1]=4 4264 B11R1.1 ClCOCc1ccc(Cl)cc1 Amb28458528 [0,1,1,0,0,0|1,0,1]=4 4265 B11R1.1 Fc1ccc(COCCl)cc1 Amb27436932 [0,1,1,0,0,0|1,0,1]=4 4266 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [0,1,1,0,0,0|1,0,0]=3 4267 B11R1.1 Nc1ccc(CN=C=O)cc1 Amb28346898 [0,1,1,0,0,0|1,0,1]=4 4268 B11R1.1 Nc1ccc(C\C=C\Br)cc1 Amb27217330 [0,1,1,0,0,0|2,0,0]=4 4269 B11R1.1 Nc1ccc(NCC=O)cc1 Amb27607100 [0,1,1,0,0,0|2,0,0]=4 4270 B11R1.1 Nc1ccc(SCC=O)cc1 Amb30012112 [0,1,1,0,0,0|2,0,0]=4 4271 B11R1.1 O=C=NCc1ccc(Br)cc1 Amb3939390 [0,1,1,0,0,0|1,0,1]=4 4272 B11R1.1 O=C=NCc1ccc(Cl)cc1 Amb5750718 [0,1,1,0,0,0|1,0,1]=4 4273 B11R1.1 O=C=NCc1ccc(F)cc1 Amb3939292 [0,1,1,0,0,0|1,0,1]=4 4274 B11R1.1 O=CC#Cc1ccc(Br)cc1 Amb18115173 [0,1,1,0,0,0|1,0,1]=4 4275 B11R1.1 O=CC#Cc1ccc(F)cc1 Amb18117287 [0,1,1,0,0,0|1,0,1]=4 4276 B11R1.1 O=CC#Cc1ccc(O)cc1 Amb18117760 [0,1,1,0,0,0|1,0,1]=4 4277 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [0,1,1,0,0,0|1,0,0]=3 4278 B11R1.1 O=CCCc1ccc(Br)cn1 Amb24704728 [0,1,1,0,0,0|2,0,0]=4 4279 B11R1.1 O=CCCc1ccc(Br)nc1 Amb33388882 [0,1,1,0,0,0|2,0,0]=4 4280 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [0,1,1,0,0,0|1,0,0]=3 4281 B11R1.1 O=CCCc1ccc(Cl)cn1 Amb26462754 [0,1,1,0,0,0|2,0,0]=4 4282 B11R1.1 O=CCCc1ccc(Cl)nc1 Amb33220658 [0,1,1,0,0,0|2,0,0]=4 4283 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [0,1,1,0,0,0|1,0,0]=3 4284 B11R1.1 O=CCCc1ccc(F)nc1 Amb33225081 [0,1,1,0,0,0|2,0,0]=4 4285 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [0,1,1,0,0,0|1,0,0]=3 4286 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [0,1,1,0,0,0|1,0,0]=3 4287 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [0,1,1,0,0,0|1,0,0]=3 4288 B11R1.1 O=CCOc1ccc(Cl)cc1 Amb5731836 [0,1,1,0,0,0|2,0,0]=4 4289 B11R1.1 O=CCOc1ccc(F)cc1 Amb5731822 [0,1,1,0,0,0|2,0,0]=4 4290 B11R1.1 O=CCOc1ccc(I)cc1 Amb27640919 [0,1,1,0,0,0|2,0,0]=4 4291 B11R1.1 O=CCSc1ccc(Br)cc1 Amb17082907 [0,1,1,0,0,0|2,0,0]=4 4292 B11R1.1 O=CCSc1ccc(Cl)cc1 Amb17082906 [0,1,1,0,0,0|2,0,0]=4 4293 B11R1.1 O=CCSc1ccc(F)cc1 Amb17082905 [0,1,1,0,0,0|2,0,0]=4 4294 B11R1.1 O=CNCc1ccc(Br)cc1 Amb27410847 [0,1,1,0,0,0|1,0,0]=3 4295 B11R1.1 O=CNCc1ccc(Br)cn1 Amb27176625 [0,1,1,0,0,0|2,0,0]=4 4296 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,1,0,0,0|1,0,0]=3 4297 B11R1.1 O=CNCc1ccc(Cl)nc1 Amb27468718 [0,1,1,0,0,0|2,0,0]=4 4298 B11R1.1 O=CNCc1ccc(F)cn1 Amb27840373 [0,1,1,0,0,0|2,0,0]=4 4299 B11R1.1 O=CNNc1ccc(Br)cc1 Amb25147924 [0,1,1,0,0,0|2,0,0]=4 4300 B11R1.1 O=COCc1ccc(Cl)nc1 Amb27451108 [0,1,1,0,0,0|1,0,0]=3 4301 B11R1.1 O=C\C=C\c1ccc(Br)cc1 Amb1787168 [0,1,1,0,0,0|1,0,1]=4 4302 B11R1.1 O=C\C=C\c1ccc(Cl)cc1 Amb34005096 [0,1,1,0,0,0|1,0,1]=4 4303 B11R1.1 O=C\C=C\c1ccc(F)cc1 Amb6296447 [0,1,1,0,0,0|1,0,1]=4 4304 B11R1.1 O=C\C=C\c1ccc(O)cc1 Amb6296905 [0,1,1,0,0,0|1,0,1]=4 4305 B11R1.1 O=C\N=C\c1ccc(O)cc1 Amb26557720 [0,1,1,0,0,0|1,0,1]=4 4306 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,1,0,0,0|2,0,0]=4 4307 B11R1.17 CCOCc1ccccc1Br Amb22227882 [0,1,1,0,0,0|1,0,1]=4 4308 B11R1.17 CCOCc1ccccc1N Amb6245712 [0,1,1,0,0,0|1,0,1]=4 4309 B11R1.17 CCOCc1ccccc1O Amb10560038 [0,1,1,0,0,0|1,0,1]=4 4310 B11R1.17 C\C=C\Cc1ccccc1O Amb3940146 [0,1,1,0,0,0|2,0,0]=4 4311 B11R1.17 Cc1ccccc1C#CC=O Amb18635840 [0,1,1,0,0,0|1,0,1]=4 4312 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [0,1,1,0,0,0|1,0,0]=3 4313 B11R1.17 Cc1ccccc1CN=C=O Amb3941010 [0,1,1,0,0,0|1,0,1]=4 4314 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,1,0,0,0|1,0,0]=3 4315 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,1,0,0,0|0,0,0]=2 4316 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [0,1,1,0,0,0|2,0,0]=4 4317 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,1,0,0,0|2,0,0]=4 4318 B11R1.17 Cc1ccccc1\C=C\C=O Amb17232007 [0,1,1,0,0,0|1,0,1]=4 4319 B11R1.17 Cc1ccncc1CCC=O Amb27971665 [0,1,1,0,0,0|2,0,0]=4 4320 B11R1.17 Cc1ccncc1CNC=O Amb28044503 [0,1,1,0,0,0|2,0,0]=4 4321 B11R1.17 Cc1cnccc1CCC=O Amb33426427 [0,1,1,0,0,0|2,0,0]=4 4322 B11R1.17 Cc1cnccc1CNC=O Amb27639891 [0,1,1,0,0,0|2,0,0]=4 4323 B11R1.17 Cc1ncccc1CCC=O Amb32879664 [0,1,1,0,0,0|2,0,0]=4 4324 B11R1.17 Fc1ccccc1COCCl Amb27654557 [0,1,1,0,0,0|1,0,1]=4 4325 B11R1.17 Nc1ccccc1COCS Amb27659006 [0,1,1,0,0,0|0,1,1]=4 4326 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [0,1,1,0,0,0|1,0,1]=4 4327 B11R1.17 O=C=NCc1ccccc1Br Amb25251434 [0,1,1,0,0,0|1,0,1]=4 4328 B11R1.17 O=C=NCc1ccccc1Cl Amb2720550 [0,1,1,0,0,0|1,0,1]=4 4329 B11R1.17 O=C=NCc1ccccc1F Amb3939408 [0,1,1,0,0,0|1,0,1]=4 4330 B11R1.17 O=CC#Cc1ccccc1F Amb18117458 [0,1,1,0,0,0|1,0,1]=4 4331 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,1,0,0,0|1,0,0]=3 4332 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,1,0,0,0|1,0,0]=3 4333 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,1,0,0,0|1,0,0]=3 4334 B11R1.17 O=CCCc1ccccc1O Amb22228954 [0,1,1,0,0,0|1,0,0]=3 4335 B11R1.17 O=CCCc1cccnc1Br Amb33388081 [0,1,1,0,0,0|2,0,0]=4 4336 B11R1.17 O=CCCc1cccnc1Cl Amb33052730 [0,1,1,0,0,0|2,0,0]=4 4337 B11R1.17 O=CCCc1cccnc1F Amb33377143 [0,1,1,0,0,0|2,0,0]=4 4338 B11R1.17 O=CCCc1ccncc1Br Amb33243315 [0,1,1,0,0,0|2,0,0]=4 4339 B11R1.17 O=CCCc1ccncc1Cl Amb27617324 [0,1,1,0,0,0|2,0,0]=4 4340 B11R1.17 O=CCCc1ccncc1F Amb25677089 [0,1,1,0,0,0|2,0,0]=4 4341 B11R1.17 O=CCCc1ncccc1Br Amb27153362 [0,1,1,0,0,0|2,0,0]=4 4342 B11R1.17 O=CCCc1ncccc1F Amb27878559 [0,1,1,0,0,0|2,0,0]=4 4343 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,1,0,0,0|2,0,0]=4 4344 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [0,1,1,0,0,0|2,0,0]=4 4345 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,1,0,0,0|2,0,0]=4 4346 B11R1.17 O=CCOc1ccccc1I Amb27871520 [0,1,1,0,0,0|2,0,0]=4 4347 B11R1.17 O=CCOc1ccccc1O Amb27176428 [0,1,1,0,0,0|2,0,0]=4 4348 B11R1.17 O=CCSc1ccccc1Br Amb26008308 [0,1,1,0,0,0|2,0,0]=4 4349 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,1,0,0,0|2,0,0]=4 4350 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,1,0,0,0|2,0,0]=4 4351 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,1,0,0,0|1,0,0]=3 4352 B11R1.17 O=CNCc1ncccc1Cl Amb27953157 [0,1,1,0,0,0|2,0,0]=4 4353 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,1,1,0,0,0|1,0,1]=4 4354 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [0,1,1,0,0,0|1,0,1]=4 4355 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [0,1,1,0,0,0|1,0,1]=4 4356 B11R1.17 O=C\C=C\c1ccccc1O Amb842565 [0,1,1,0,0,0|1,0,1]=4 4357 B11R1.17 O=C\C=C\c1ccccc1S Amb28422741 [0,1,1,0,0,0|1,0,1]=4 4358 B11R1.17 O=C\N=C\c1ccccc1O Amb24422424 [0,1,1,0,0,0|1,0,1]=4 4359 B11R1.24 C=CCCc1cccc(Br)c1 Amb6298948 [0,1,1,0,0,0|2,0,0]=4 4360 B11R1.24 C=CCCc1cccc(Cl)c1 Amb6298971 [0,1,1,0,0,0|2,0,0]=4 4361 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,1,0,0,0|2,0,0]=4 4362 B11R1.24 CCOCc1cccc(Br)c1 Amb23512545 [0,1,1,0,0,0|1,0,1]=4 4363 B11R1.24 CCOCc1cccc(Cl)c1 Amb24486866 [0,1,1,0,0,0|1,0,1]=4 4364 B11R1.24 CCOCc1cccc(N)c1 Amb6244214 [0,1,1,0,0,0|1,0,1]=4 4365 B11R1.24 CCOCc1cccc(O)c1 Amb23443319 [0,1,1,0,0,0|1,0,1]=4 4366 B11R1.24 CNOCc1cccc(I)c1 Amb32412842 [0,1,1,0,0,0|2,0,0]=4 4367 B11R1.24 Cc1cc(CCC=O)ccn1 Amb27208272 [0,1,1,0,0,0|2,0,0]=4 4368 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [0,1,1,0,0,0|1,0,0]=3 4369 B11R1.24 Cc1cccc(CCC=O)n1 Amb27949575 [0,1,1,0,0,0|2,0,0]=4 4370 B11R1.24 Cc1cccc(CN=C=O)c1 Amb3939295 [0,1,1,0,0,0|1,0,1]=4 4371 B11R1.24 Cc1cccc(CNC=O)c1 Amb27752387 [0,1,1,0,0,0|1,0,0]=3 4372 B11R1.24 Cc1cccc(OCC=O)c1 Amb5731820 [0,1,1,0,0,0|2,0,0]=4 4373 B11R1.24 Cc1cccc(SCC=O)c1 Amb17082932 [0,1,1,0,0,0|2,0,0]=4 4374 B11R1.24 Cc1cccc(\C=C\C=O)c1 Amb17232008 [0,1,1,0,0,0|1,0,1]=4 4375 B11R1.24 Cc1ccnc(CCC=O)c1 Amb33317814 [0,1,1,0,0,0|2,0,0]=4 4376 B11R1.24 Cc1cncc(CCC=O)c1 Amb33531659 [0,1,1,0,0,0|2,0,0]=4 4377 B11R1.24 ClCOCc1cccc(Br)c1 Amb27489432 [0,1,1,0,0,0|1,0,1]=4 4378 B11R1.24 O=C=NCc1cccc(Br)c1 Amb17090280 [0,1,1,0,0,0|1,0,1]=4 4379 B11R1.24 O=C=NCc1cccc(Cl)c1 Amb17090264 [0,1,1,0,0,0|1,0,1]=4 4380 B11R1.24 O=C=NCc1cccc(F)c1 Amb3939409 [0,1,1,0,0,0|1,0,1]=4 4381 B11R1.24 O=CC#Cc1cccc(Cl)c1 Amb27238485 [0,1,1,0,0,0|1,0,1]=4 4382 B11R1.24 O=CC#Cc1cccc(F)c1 Amb18117776 [0,1,1,0,0,0|1,0,1]=4 4383 B11R1.24 O=CCCC1=CC(=O)NC=C1 Amb27485952 [0,1,1,0,0,0|2,0,0]=4 4384 B11R1.24 O=CCCc1cc(F)ccn1 Amb33325519 [0,1,1,0,0,0|2,0,0]=4 4385 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [0,1,1,0,0,0|1,0,0]=3 4386 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [0,1,1,0,0,0|1,0,0]=3 4387 B11R1.24 O=CCCc1cccc(Cl)n1 Amb24511743 [0,1,1,0,0,0|2,0,0]=4 4388 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [0,1,1,0,0,0|1,0,0]=3 4389 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,1,0,0,0|1,0,0]=3 4390 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [0,1,1,0,0,0|1,0,0]=3 4391 B11R1.24 O=CCCc1ccnc(Cl)c1 Amb24619570 [0,1,1,0,0,0|2,0,0]=4 4392 B11R1.24 O=CCCc1cncc(Br)c1 Amb28348525 [0,1,1,0,0,0|2,0,0]=4 4393 B11R1.24 O=CCCc1cncc(F)c1 Amb25923216 [0,1,1,0,0,0|2,0,0]=4 4394 B11R1.24 O=CCOc1cccc(Br)c1 Amb17099951 [0,1,1,0,0,0|2,0,0]=4 4395 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,1,0,0,0|2,0,0]=4 4396 B11R1.24 O=CCOc1cccc(I)c1 Amb27838178 [0,1,1,0,0,0|2,0,0]=4 4397 B11R1.24 O=CCSc1cccc(Br)c1 Amb25978639 [0,1,1,0,0,0|2,0,0]=4 4398 B11R1.24 O=CCSc1cccc(Cl)c1 Amb17082942 [0,1,1,0,0,0|2,0,0]=4 4399 B11R1.24 O=CCSc1cccc(F)c1 Amb26942694 [0,1,1,0,0,0|2,0,0]=4 4400 B11R1.24 O=CNCC1=CC(=O)NC=C1 Amb28067246 [0,1,1,0,0,0|2,0,0]=4 4401 B11R1.24 O=CNCc1cccc(Br)c1 Amb27780723 [0,1,1,0,0,0|1,0,0]=3 4402 B11R1.24 O=CNCc1cccc(O)c1 Amb18179387 [0,1,1,0,0,0|1,0,0]=3 4403 B11R1.24 O=CNCc1cncc(F)c1 Amb24528856 [0,1,1,0,0,0|2,0,0]=4 4404 B11R1.24 O=C\C=C\c1cccc(Br)c1 Amb17240826 [0,1,1,0,0,0|1,0,1]=4 4405 B11R1.24 O=C\C=C\c1cccc(Cl)c1 Amb16193215 [0,1,1,0,0,0|1,0,1]=4 4406 B11R1.24 O=C\C=C\c1cccc(F)c1 Amb17232063 [0,1,1,0,0,0|1,0,1]=4 4407 B11R1.24 O=C\C=C\c1cccc(O)c1 Amb17334281 [0,1,1,0,0,0|1,0,1]=4 4408 B11R1.28 BrCCOCc1ccccc1 Amb3941567 [0,1,1,0,0,0|1,0,1]=4 4409 B11R1.28 C#CCOCc1ccccc1 Amb8517297 [0,1,1,0,0,0|1,0,1]=4 4410 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [0,1,1,0,0,0|2,0,0]=4 4411 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [0,1,1,0,0,0|2,0,0]=4 4412 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [0,1,1,0,0,0|2,0,0]=4 4413 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [0,1,1,0,0,0|2,0,0]=4 4414 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [0,1,1,0,0,0|2,0,0]=4 4415 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,1,0,0,0|1,0,0]=3 4416 B11R1.28 C=CCO[BrH]c1ccccc1 Amb27001649 [0,1,1,0,0,0|2,0,0]=4 4417 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [0,1,1,0,0,0|1,0,0]=3 4418 B11R1.28 CCNOCc1ccccc1 Amb25923077 [0,1,1,0,0,0|1,0,1]=4 4419 B11R1.28 CCOCCc1ccccc1 Amb4035236 [0,1,1,0,0,0|1,0,1]=4 4420 B11R1.28 CCOCOc1ccccc1 Amb28388170 [0,1,1,0,0,0|1,0,1]=4 4421 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,1,0,0,0|1,0,1]=4 4422 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [0,1,1,0,0,0|2,0,0]=4 4423 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [0,1,1,0,0,0|2,0,0]=4 4424 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [0,1,1,0,0,0|2,0,0]=4 4425 B11R1.28 ClCCOCc1ccccc1 Amb8391048 [0,1,1,0,0,0|1,0,1]=4 4426 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [0,1,1,0,0,0|2,0,0]=4 4427 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [0,1,1,0,0,0|2,0,0]=4 4428 B11R1.28 Cl\C=C\COc1ccccc1 Amb27668260 [0,1,1,0,0,0|2,0,0]=4 4429 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,1,0,0,0|1,0,1]=4 4430 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [0,1,1,0,0,0|2,0,0]=4 4431 B11R1.28 N#CCOCc1ccccc1 Amb4011553 [0,1,1,0,0,0|1,0,1]=4 4432 B11R1.28 N#CNOCc1ccccc1 Amb27245690 [0,1,1,0,0,0|1,0,1]=4 4433 B11R1.28 N#C\C=C\Cc1ccccc1 Amb28255392 [0,1,1,0,0,0|2,0,0]=4 4434 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,1,0,0,0|1,0,1]=4 4435 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,1,0,0,0|1,0,1]=4 4436 B11R1.28 NCCOCc1ccccc1 Amb28524733 [0,1,1,0,0,0|1,0,1]=4 4437 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [0,1,1,0,0,0|2,0,0]=4 4438 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,1,0,0,0|0,0,2]=4 4439 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [0,1,1,0,0,0|2,0,0]=4 4440 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,1,0,0,0|1,0,1]=4 4441 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,1,0,0,0|1,0,1]=4 4442 B11R1.28 O=C=NCSc1ccccc1 Amb27839732 [0,1,1,0,0,0|1,0,1]=4 4443 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [0,1,1,0,0,0|1,0,1]=4 4444 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [0,1,1,0,0,0|1,0,0]=3 4445 B11R1.28 O=CCCCc1ccccn1 Amb22897023 [0,1,1,0,0,0|2,0,0]=4 4446 B11R1.28 O=CCCCc1cccnc1 Amb24099514 [0,1,1,0,0,0|2,0,0]=4 4447 B11R1.28 O=CCCCc1ccncc1 Amb24099515 [0,1,1,0,0,0|2,0,0]=4 4448 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [0,1,1,0,0,0|1,0,0]=3 4449 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,1,0,0,0|1,0,0]=3 4450 B11R1.28 O=CCCSc1ccncc1 Amb27671141 [0,1,1,0,0,0|2,0,0]=4 4451 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,1,0,0,0|1,0,0]=3 4452 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [0,1,1,0,0,0|0,0,0]=2 4453 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,1,0,0,0|0,1,0]=3 4454 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [0,1,1,0,0,0|0,0,0]=2 4455 B11R1.28 O=CN\N=C/c1ccccc1 Amb2612268 [0,1,1,0,0,0|1,0,1]=4 4456 B11R1.28 O=COCCc1ccccc1 Amb6357955 [0,1,1,0,0,0|0,0,0]=2 4457 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [0,1,1,0,0,0|1,0,0]=3 4458 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [0,1,1,0,0,0|1,0,0]=3 4459 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [0,1,1,0,0,0|1,0,1]=4 4460 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,1,0,0,0|1,0,1]=4 4461 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,1,0,0,0|2,0,0]=4 4462 B11R1.28 O=S=CNCc1ccccc1 Amb27166552 [0,1,1,0,0,0|1,0,0]=3 4463 B11R1.28 OCCOCc1ccccc1 Amb3939139 [0,1,1,0,0,0|0,0,2]=4 4464 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [0,1,1,0,0,0|1,0,1]=4 4465 B11R1.28 SCCOCc1ccccc1 Amb27457406 [0,1,1,0,0,0|0,1,1]=4 4466 B11R1.40 C=C(C=O)Cc1ccccc1 Amb8392633 [0,1,1,0,0,0|1,0,0]=3 4467 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,1,0,0,0|2,0,0]=4 4468 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [0,1,1,0,0,0|2,0,0]=4 4469 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [0,1,1,0,0,0|2,0,0]=4 4470 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [0,1,1,0,0,0|2,0,0]=4 4471 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,1,0,0,0|2,0,0]=4 4472 B11R1.40 C=CN(C)Cc1ccccc1 Amb27777024 [0,1,1,0,0,0|2,0,0]=4 4473 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [0,1,1,0,0,0|2,0,0]=4 4474 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [0,1,1,0,0,0|1,0,0]=3 4475 B11R1.40 CC(C=O)Cc1ccccn1 Amb28196427 [0,1,1,0,0,0|2,0,0]=4 4476 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [0,1,1,0,0,0|2,0,0]=4 4477 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,1,0,0,0|2,0,0]=4 4478 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,1,0,0,0|2,0,0]=4 4479 B11R1.40 CN(C=O)Cc1ccccc1 Amb27795680 [0,1,1,0,0,0|1,0,0]=3 4480 B11R1.40 CN(C=O)Cc1ccncc1 Amb27262023 [0,1,1,0,0,0|2,0,0]=4 4481 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,1,1,0,0,0|2,0,0]=4 4482 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,1,0,0,0|2,0,0]=4 4483 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [0,1,1,0,0,0|1,0,1]=4 4484 B11R1.40 Cl\C=C(\Cl)Cc1ccccc1 Amb27657562 [0,1,1,0,0,0|2,0,0]=4 4485 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [0,1,1,0,0,0|1,0,0]=3 4486 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,1,0,0,0|1,0,0]=3 4487 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,1,1,0,0,0|2,0,0]=4 4488 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [0,1,1,0,0,0|1,0,0]=3 4489 B11R1.40 O=CC(Cl)Cc1cccnc1 Amb27866890 [0,1,1,0,0,0|2,0,0]=4 4490 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [0,1,1,0,0,0|1,0,0]=3 4491 B11R1.40 O=CC(O)Cc1ccccn1 Amb28345542 [0,1,1,0,0,0|2,0,0]=4 4492 B11R1.40 O=CN(O)Cc1ccccc1 Amb27873557 [0,1,1,0,0,0|1,0,0]=3 4493 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [0,1,1,0,0,0|1,0,0]=3 4494 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [0,1,1,0,0,0|1,0,0]=3 4495 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [0,1,1,0,0,0|1,0,0]=3 4496 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [0,1,1,0,0,0|1,0,1]=4 4497 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [0,1,1,0,0,0|1,0,1]=4 4498 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [0,1,1,0,0,0|1,0,1]=4 4499 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [0,1,1,0,0,0|1,0,1]=4 4500 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [0,1,1,0,0,0|1,0,1]=4 4501 B11R1.40 O=NN(O)Cc1ccccc1 Amb28131432 [0,1,1,0,0,0|2,0,0]=4 4502 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [0,1,1,0,0,0|2,0,0]=4 4503 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [0,1,1,0,0,0|2,0,0]=4 4504 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [0,1,1,0,0,0|1,0,0]=3 4505 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [0,1,1,0,0,0|0,0,1]=3 4506 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,1,0,0,0|2,0,0]=4 4507 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,1,0,0,0|1,1,0]=4 4508 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [0,1,1,0,0,0|1,0,1]=4 4509 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [0,1,1,0,0,0|1,0,0]=3 4510 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,1,1,0,0,0|2,0,0]=4 4511 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,1,1,0,0,0|2,0,0]=4 4512 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,1,1,0,0,0|2,0,0]=4 4513 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [0,1,1,0,0,0|2,0,0]=4 4514 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,1,0,0,0|2,0,0]=4 4515 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [0,1,1,0,0,0|2,0,0]=4 4516 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [0,1,1,0,0,0|2,0,0]=4 4517 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,1,0,0,0|1,0,0]=3 4518 B11R1.91 CC(=O)NCc1ccccn1 Amb3358089 [0,1,1,0,0,0|2,0,0]=4 4519 B11R1.91 CC(=O)NCc1ccccn1 Amb6892496 [0,1,1,0,0,0|2,0,0]=4 4520 B11R1.91 CC(=O)NCc1ccncc1 Amb2694533 [0,1,1,0,0,0|2,0,0]=4 4521 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [0,1,1,0,0,0|2,0,0]=4 4522 B11R1.91 CC(=O)OC[n+]1ccccc1 Amb27259021 [0,1,1,0,0,0|1,0,0]=3 4523 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [0,1,1,0,0,0|0,0,0]=2 4524 B11R1.91 CC(=O)OCc1ccccn1 Amb9780355 [0,1,1,0,0,0|1,0,0]=3 4525 B11R1.91 CC(=O)OCc1cccnc1 Amb8388631 [0,1,1,0,0,0|1,0,0]=3 4526 B11R1.91 CC(=O)OCc1ncccn1 Amb22756932 [0,1,1,0,0,0|2,0,0]=4 4527 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [0,1,1,0,0,0|1,0,0]=3 4528 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [0,1,1,0,0,0|0,1,0]=3 4529 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,1,1,0,0,0|1,0,1]=4 4530 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [0,1,1,0,0,0|1,0,1]=4 4531 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,1,1,0,0,0|2,0,0]=4 4532 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,1,0,0,0|1,1,0]=4 4533 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [0,1,1,0,0,0|2,0,0]=4 4534 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [0,1,1,0,0,0|2,0,0]=4 4535 B11R1.91 CC(C)OCc1ccccc1 Amb3988003 [0,1,1,0,0,0|1,0,1]=4 4536 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [0,1,1,0,0,0|1,0,0]=3 4537 B11R1.91 ClC(Cl)OCc1ccccc1 Amb28244766 [0,1,1,0,0,0|1,0,1]=4 4538 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [0,1,1,0,0,0|2,0,0]=4 4539 B11R1.91 N=C(/N)SCc1ccccc1 Amb20655654 [0,1,1,0,0,0|1,1,0]=4 4540 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [0,1,1,0,0,0|2,0,0]=4 4541 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [0,1,1,0,0,0|2,0,0]=4 4542 B11R1.91 N=C(N)NCc1ccccc1 Amb22370878 [0,1,1,0,0,0|2,0,0]=4 4543 B11R1.91 N=C(N)NCc1ccccc1 Amb602728 [0,1,1,0,0,0|2,0,0]=4 4544 B11R1.91 N=C(N)NCc1ccccc1 Amb7990388 [0,1,1,0,0,0|2,0,0]=4 4545 B11R1.91 N=C(N)OCc1ccccc1 Amb6773970 [0,1,1,0,0,0|1,0,0]=3 4546 B11R1.91 N=C(N)SCc1ccccc1 Amb20676044 [0,1,1,0,0,0|1,1,0]=4 4547 B11R1.91 N=C(N)SCc1ccccc1 Amb2609643 [0,1,1,0,0,0|1,1,0]=4 4548 B11R1.91 N=C(N)SCc1ccccc1 Amb6296081 [0,1,1,0,0,0|1,1,0]=4 4549 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,1,0,0,0|1,1,0]=4 4550 B11R1.91 NC(=O)C#Cc1ccccc1 Amb2778971 [0,1,1,0,0,0|1,0,1]=4 4551 B11R1.91 NC(=O)CC[n+]1ccccc1 Amb4010710 [0,1,1,0,0,0|2,0,0]=4 4552 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [0,1,1,0,0,0|1,0,0]=3 4553 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,1,1,0,0,0|2,0,0]=4 4554 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,1,1,0,0,0|2,0,0]=4 4555 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [0,1,1,0,0,0|2,0,0]=4 4556 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [0,1,1,0,0,0|2,0,0]=4 4557 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [0,1,1,0,0,0|2,0,0]=4 4558 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,1,0,0,0|1,0,0]=3 4559 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [0,1,1,0,0,0|2,0,0]=4 4560 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [0,1,1,0,0,0|2,0,0]=4 4561 B11R1.91 NC(=O)NCc1ccncc1 Amb6658828 [0,1,1,0,0,0|2,0,0]=4 4562 B11R1.91 NC(=O)NNc1ccccc1 Amb32409481 [0,1,1,0,0,0|2,0,0]=4 4563 B11R1.91 NC(=O)NSc1ccccc1 Amb27974234 [0,1,1,0,0,0|2,0,0]=4 4564 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [0,1,1,0,0,0|0,0,0]=2 4565 B11R1.91 NC(=O)OCc1cccnc1 Amb26464124 [0,1,1,0,0,0|1,0,0]=3 4566 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [0,1,1,0,0,0|0,1,0]=3 4567 B11R1.91 NC(=O)SCc1ccccn1 Amb28145815 [0,1,1,0,0,0|1,1,0]=4 4568 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [0,1,1,0,0,0|1,0,1]=4 4569 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [0,1,1,0,0,0|1,0,1]=4 4570 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [0,1,1,0,0,0|1,0,1]=4 4571 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [0,1,1,0,0,0|1,0,1]=4 4572 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,1,0,0,0|1,1,0]=4 4573 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,1,0,0,0|1,1,0]=4 4574 B11R1.91 NC(=S)NCc1ccccc1 Amb32644733 [0,1,1,0,0,0|1,1,0]=4 4575 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,1,0,0,0|2,0,0]=4 4576 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,1,0,0,0|2,0,0]=4 4577 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [0,1,1,0,0,0|1,0,0]=3 4578 B11R1.91 O=C(Cl)CCc1ccccn1 Amb2696649 [0,1,1,0,0,0|2,0,0]=4 4579 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [0,1,1,0,0,0|2,0,0]=4 4580 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [0,1,1,0,0,0|2,0,0]=4 4581 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [0,1,1,0,0,0|2,0,0]=4 4582 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [0,1,1,0,0,0|0,0,0]=2 4583 B11R1.91 O=C(Cl)OCc1ccccn1 Amb33297000 [0,1,1,0,0,0|1,0,0]=3 4584 B11R1.91 O=C(Cl)OCc1cccnc1 Amb25852784 [0,1,1,0,0,0|1,0,0]=3 4585 B11R1.91 O=C(Cl)OCc1cccnc1 Amb33465543 [0,1,1,0,0,0|1,0,0]=3 4586 B11R1.91 O=C(Cl)OCc1ccncc1 Amb24559531 [0,1,1,0,0,0|1,0,0]=3 4587 B11R1.91 O=C(Cl)OCc1cnccn1 Amb33297299 [0,1,1,0,0,0|2,0,0]=4 4588 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [0,1,1,0,0,0|1,0,1]=4 4589 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [0,1,1,0,0,0|0,0,0]=2 4590 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [0,1,1,0,0,0|1,0,1]=4 4591 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [0,1,1,0,0,0|2,0,0]=4 4592 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [0,1,1,0,0,0|1,0,0]=3 4593 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [0,1,1,0,0,0|2,0,0]=4 4594 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [0,1,1,0,0,0|2,0,0]=4 4595 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [0,1,1,0,0,0|2,0,0]=4 4596 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [0,1,1,0,0,0|2,0,0]=4 4597 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [0,1,1,0,0,0|2,0,0]=4 4598 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [0,1,1,0,0,0|2,0,0]=4 4599 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [0,1,1,0,0,0|2,0,0]=4 4600 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [0,1,1,0,0,0|2,0,0]=4 4601 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [0,1,1,0,0,0|2,0,0]=4 4602 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [0,1,1,0,0,0|1,0,1]=4 4603 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [0,1,1,0,0,0|1,0,1]=4 4604 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [0,1,1,0,0,0|1,0,1]=4 4605 B11R1.91 O=C([O-])CCc1ccccn1 Amb32882485 [0,1,1,0,0,0|2,0,0]=4 4606 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [0,1,1,0,0,0|2,0,0]=4 4607 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [0,1,1,0,0,0|2,0,0]=4 4608 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [0,1,1,0,0,0|2,0,0]=4 4609 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [0,1,1,0,0,0|1,0,1]=4 4610 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [0,1,1,0,0,0|1,0,1]=4 4611 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [0,1,1,0,0,0|2,0,0]=4 4612 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [0,1,1,0,0,0|2,0,0]=4 4613 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [0,1,1,0,0,0|2,0,0]=4 4614 B11R1.91 O=S([O-])NCc1ccccc1 Amb22641608 [0,1,1,0,0,0|2,0,0]=4 4615 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [0,1,1,0,0,0|2,0,0]=4 4616 B11R1.91 O=[N+]([O-])NCc1ccccc1 Amb26560440 [0,1,1,0,0,0|2,0,0]=4 4617 B11R1.91 O=[N+]([O-])O[Hg]c1ccccc1 Amb22732287 [0,1,1,0,0,0|2,0,0]=4 4618 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [0,1,1,0,0,0|2,0,0]=4 4619 B11R1.91 S=C(Cl)NCc1ccccc1 Amb28436734 [0,1,1,0,0,0|1,1,0]=4 4620 B11R1.91 S=C(S)NCc1ccccc1 Amb26372903 [0,1,1,0,0,0|1,1,0]=4 4621 B11R1.91 S=C([S-])NCc1ccccc1 Amb33249792 [0,1,1,0,0,0|1,1,0]=4 4622 B11R1.37 C#Cc1cc(C)ccc1CO Amb27456656 [0,1,1,0,0,0|1,0,1]=4 4623 B11R1.37 C#Cc1cc(Cl)ccc1CO Amb27665452 [0,1,1,0,0,0|1,0,1]=4 4624 B11R1.37 C#Cc1cc(F)ccc1C=O Amb24084111 [0,1,1,0,0,0|1,0,1]=4 4625 B11R1.37 C#Cc1ccc(Cl)cc1C=O Amb24484746 [0,1,1,0,0,0|1,0,1]=4 4626 B11R1.37 C#Cc1ccc(F)cc1C=O Amb22735443 [0,1,1,0,0,0|1,0,1]=4 4627 B11R1.37 C=Cc1cc(C)ccc1C=O Amb26925052 [0,1,1,0,0,0|1,0,1]=4 4628 B11R1.37 C=Cc1cc(C)ccc1CN Amb27951217 [0,1,1,0,0,0|2,0,0]=4 4629 B11R1.37 C=Cc1cc(Cl)ccc1C=O Amb24582460 [0,1,1,0,0,0|1,0,1]=4 4630 B11R1.37 C=Cc1cc(F)ccc1C=O Amb25148029 [0,1,1,0,0,0|1,0,1]=4 4631 B11R1.37 C=Cc1cc(F)cnc1CO Amb27217617 [0,1,1,0,0,0|2,0,0]=4 4632 B11R1.37 C=Cc1ccc(C)nc1CO Amb27764133 [0,1,1,0,0,0|2,0,0]=4 4633 B11R1.37 C=Cc1ccc(Cl)cc1C=O Amb26636359 [0,1,1,0,0,0|1,0,1]=4 4634 B11R1.37 C=Cc1ccc(F)cc1C=O Amb25733416 [0,1,1,0,0,0|1,0,1]=4 4635 B11R1.37 C=Cc1ccc(F)nc1CO Amb25676347 [0,1,1,0,0,0|2,0,0]=4 4636 B11R1.37 C=Cc1ccc(N)nc1CO Amb25711316 [0,1,1,0,0,0|2,0,0]=4 4637 B11R1.37 C=Cc1ccc(O)cc1C=O Amb26343785 [0,1,1,0,0,0|1,0,1]=4 4638 B11R1.37 C=Cc1cnc(C)cc1CO Amb25777042 [0,1,1,0,0,0|2,0,0]=4 4639 B11R1.37 C=Cc1cnc(F)cc1CO Amb24598707 [0,1,1,0,0,0|2,0,0]=4 4640 B11R1.37 C=Cc1cnc(N)cc1CO Amb24405123 [0,1,1,0,0,0|2,0,0]=4 4641 B11R1.37 C=Cc1ncc(C)cc1CO Amb28044811 [0,1,1,0,0,0|2,0,0]=4 4642 B11R1.37 CCc1cc(Br)ccc1C=O Amb18769300 [0,1,1,0,0,0|1,0,0]=3 4643 B11R1.37 CCc1cc(Br)ccc1CO Amb25923130 [0,1,1,0,0,0|1,0,1]=4 4644 B11R1.37 CCc1cc(Br)cnc1C=O Amb27861063 [0,1,1,0,0,0|2,0,0]=4 4645 B11R1.37 CCc1cc(C)ccc1CO Amb25687350 [0,1,1,0,0,0|1,0,1]=4 4646 B11R1.37 CCc1cc(Cl)ccc1C=O Amb26319283 [0,1,1,0,0,0|1,0,0]=3 4647 B11R1.37 CCc1cc(Cl)ccc1CO Amb27151545 [0,1,1,0,0,0|1,0,1]=4 4648 B11R1.37 CCc1cc(F)ccc1C=O Amb35707033 [0,1,1,0,0,0|1,0,0]=3 4649 B11R1.37 CCc1cc(F)ccc1CO Amb27961192 [0,1,1,0,0,0|1,0,1]=4 4650 B11R1.37 CCc1cc(I)ccc1CO Amb25808072 [0,1,1,0,0,0|1,0,1]=4 4651 B11R1.37 CCc1cc(N)ccc1CO Amb26330514 [0,1,1,0,0,0|1,0,1]=4 4652 B11R1.37 CCc1cc(O)ccc1C=O Amb24084028 [0,1,1,0,0,0|1,0,0]=3 4653 B11R1.37 CCc1cc(O)ccc1CO Amb24725399 [0,1,1,0,0,0|1,0,1]=4 4654 B11R1.37 CCc1ccc(Br)cc1C=O Amb20670432 [0,1,1,0,0,0|1,0,0]=3 4655 B11R1.37 CCc1ccc(Br)cc1CO Amb25260745 [0,1,1,0,0,0|1,0,1]=4 4656 B11R1.37 CCc1ccc(C)cc1CO Amb27653360 [0,1,1,0,0,0|1,0,1]=4 4657 B11R1.37 CCc1ccc(F)cc1C=O Amb27965518 [0,1,1,0,0,0|1,0,0]=3 4658 B11R1.37 CCc1ccc(I)cc1CO Amb24571951 [0,1,1,0,0,0|1,0,1]=4 4659 B11R1.37 CCc1nc(C)ccc1C=O Amb27185974 [0,1,1,0,0,0|2,0,0]=4 4660 B11R1.37 CCc1nc(C)ccc1C=O Amb32410411 [0,1,1,0,0,0|2,0,0]=4 4661 B11R1.37 CCc1nc(O)ccc1C=O Amb28131632 [0,1,1,0,0,0|2,0,0]=4 4662 B11R1.37 CNc1cc(Cl)ccc1CO Amb24590225 [0,1,1,0,0,0|2,0,0]=4 4663 B11R1.37 CNc1ccc(C)cc1C=O Amb24071552 [0,1,1,0,0,0|2,0,0]=4 4664 B11R1.37 CNc1ccc(Cl)cc1CO Amb10069184 [0,1,1,0,0,0|2,0,0]=4 4665 B11R1.37 CNc1ccc(F)cc1C=O Amb23401982 [0,1,1,0,0,0|2,0,0]=4 4666 B11R1.37 COc1cc(Br)ccc1C=O Amb9025347 [0,1,1,0,0,0|2,0,0]=4 4667 B11R1.37 COc1cc(Br)ccc1CO Amb9025876 [0,1,1,0,0,0|2,0,0]=4 4668 B11R1.37 COc1cc(C)ccc1C=O Amb2721829 [0,1,1,0,0,0|2,0,0]=4 4669 B11R1.37 COc1cc(C)ccc1CO Amb2689141 [0,1,1,0,0,0|2,0,0]=4 4670 B11R1.37 COc1cc(Cl)ccc1C=O Amb18806820 [0,1,1,0,0,0|2,0,0]=4 4671 B11R1.37 COc1cc(F)ccc1C=O Amb2688143 [0,1,1,0,0,0|2,0,0]=4 4672 B11R1.37 COc1cc(F)ccc1CO Amb22229765 [0,1,1,0,0,0|2,0,0]=4 4673 B11R1.37 COc1cc(I)ccc1C=O Amb24394974 [0,1,1,0,0,0|2,0,0]=4 4674 B11R1.37 COc1cc(I)ccc1CO Amb25113637 [0,1,1,0,0,0|2,0,0]=4 4675 B11R1.37 COc1cc(N)ccc1CO Amb28436813 [0,1,1,0,0,0|2,0,0]=4 4676 B11R1.37 COc1cc(O)ccc1C=O Amb1230574 [0,1,1,0,0,0|2,0,0]=4 4677 B11R1.37 COc1cc(O)ccc1CO Amb9788673 [0,1,1,0,0,0|2,0,0]=4 4678 B11R1.37 COc1ccc(Br)cc1C=O Amb1880434 [0,1,1,0,0,0|2,0,0]=4 4679 B11R1.37 COc1ccc(Br)cc1CO Amb1154413 [0,1,1,0,0,0|2,0,0]=4 4680 B11R1.37 COc1ccc(C)cc1C=O Amb1215596 [0,1,1,0,0,0|2,0,0]=4 4681 B11R1.37 COc1ccc(C)cc1CO Amb1110443 [0,1,1,0,0,0|2,0,0]=4 4682 B11R1.37 COc1ccc(Cl)cc1C=O Amb6424172 [0,1,1,0,0,0|2,0,0]=4 4683 B11R1.37 COc1ccc(Cl)cc1CO Amb3939479 [0,1,1,0,0,0|2,0,0]=4 4684 B11R1.37 COc1ccc(F)cc1C=O Amb3939415 [0,1,1,0,0,0|2,0,0]=4 4685 B11R1.37 COc1ccc(F)cc1CO Amb8983231 [0,1,1,0,0,0|2,0,0]=4 4686 B11R1.37 COc1ccc(I)cc1C=O Amb6296502 [0,1,1,0,0,0|2,0,0]=4 4687 B11R1.37 COc1ccc(N)cc1C=O Amb18201744 [0,1,1,0,0,0|2,0,0]=4 4688 B11R1.37 COc1ccc(N)cc1CO Amb9214974 [0,1,1,0,0,0|2,0,0]=4 4689 B11R1.37 COc1ccc(O)cc1C=O Amb6329141 [0,1,1,0,0,0|2,0,0]=4 4690 B11R1.37 COc1ccc(O)cc1CO Amb25198159 [0,1,1,0,0,0|2,0,0]=4 4691 B11R1.37 CSc1cc(Br)ccc1C=O Amb20668000 [0,1,1,0,0,0|2,0,0]=4 4692 B11R1.37 CSc1cc(Br)ccc1CO Amb28365406 [0,1,1,0,0,0|2,0,0]=4 4693 B11R1.37 CSc1cc(C)ccc1C=O Amb25678644 [0,1,1,0,0,0|2,0,0]=4 4694 B11R1.37 CSc1cc(Cl)ccc1CO Amb27223028 [0,1,1,0,0,0|2,0,0]=4 4695 B11R1.37 CSc1ccc(Br)cc1C=O Amb25857544 [0,1,1,0,0,0|2,0,0]=4 4696 B11R1.37 CSc1ccc(Br)cc1CO Amb27871163 [0,1,1,0,0,0|2,0,0]=4 4697 B11R1.37 CSc1ccc(C)cc1C=O Amb18126454 [0,1,1,0,0,0|2,0,0]=4 4698 B11R1.37 CSc1ccc(C)cc1CO Amb23571788 [0,1,1,0,0,0|2,0,0]=4 4699 B11R1.37 CSc1ccc(Cl)cc1C=O Amb25783772 [0,1,1,0,0,0|2,0,0]=4 4700 B11R1.37 CSc1ccc(Cl)cc1CO Amb25083356 [0,1,1,0,0,0|2,0,0]=4 4701 B11R1.37 CSc1ccc(F)cc1C=O Amb25145748 [0,1,1,0,0,0|2,0,0]=4 4702 B11R1.37 CSc1ccc(F)cc1CO Amb27971908 [0,1,1,0,0,0|2,0,0]=4 4703 B11R1.37 CSc1ccc(I)cc1C=O Amb34911606 [0,1,1,0,0,0|2,0,0]=4 4704 B11R1.37 CSc1ccc(O)cc1C=O Amb28200192 [0,1,1,0,0,0|2,0,0]=4 4705 B11R1.37 Cc1cc(C=O)c(CCl)cn1 Amb28198932 [0,1,1,0,0,0|2,0,0]=4 4706 B11R1.37 Cc1cc(C=O)c(CO)cn1 Amb22754948 [0,1,1,0,0,0|1,0,0]=3 4707 B11R1.37 Cc1cc(CCl)c(C=O)cn1 Amb26064659 [0,1,1,0,0,0|2,0,0]=4 4708 B11R1.37 Cc1cc(CO)c(C=O)cn1 Amb22754934 [0,1,1,0,0,0|1,0,0]=3 4709 B11R1.37 Cc1ccc(C#N)c(C=O)c1 Amb26480032 [0,1,1,0,0,0|1,0,1]=4 4710 B11R1.37 Cc1ccc(C=O)c(C#N)c1 Amb22899173 [0,1,1,0,0,0|1,0,1]=4 4711 B11R1.37 Cc1ccc(C=O)c(C=O)c1 Amb18124887 [0,1,1,0,0,0|0,0,2]=4 4712 B11R1.37 Cc1ccc(C=O)c(CCl)n1 Amb24627470 [0,1,1,0,0,0|2,0,0]=4 4713 B11R1.37 Cc1ccc(C=O)c(NN)c1 Amb24528039 [0,1,1,0,0,0|2,0,0]=4 4714 B11R1.37 Cc1ccc(CCl)c(C=O)n1 Amb27964299 [0,1,1,0,0,0|2,0,0]=4 4715 B11R1.37 Cc1ccc(CO)c(C#N)c1 Amb27591559 [0,1,1,0,0,0|1,0,1]=4 4716 B11R1.37 Cc1ccc(CO)c(NN)c1 Amb24712542 [0,1,1,0,0,0|2,0,0]=4 4717 B11R1.37 Cc1ccc(NN)c(CO)c1 Amb25980293 [0,1,1,0,0,0|2,0,0]=4 4718 B11R1.37 Cc1cnc(C=O)c(CCl)c1 Amb25242845 [0,1,1,0,0,0|2,0,0]=4 4719 B11R1.37 Cc1cnc(CCl)c(C=O)c1 Amb27424085 [0,1,1,0,0,0|2,0,0]=4 4720 B11R1.37 N#Cc1cc(Br)ccc1C=O Amb21963490 [0,1,1,0,0,0|1,0,1]=4 4721 B11R1.37 N#Cc1cc(Br)ccc1CO Amb26905193 [0,1,1,0,0,0|1,0,1]=4 4722 B11R1.37 N#Cc1cc(Cl)ccc1C=O Amb22001845 [0,1,1,0,0,0|1,0,1]=4 4723 B11R1.37 N#Cc1cc(Cl)ccc1CO Amb28250064 [0,1,1,0,0,0|1,0,1]=4 4724 B11R1.37 N#Cc1cc(F)ccc1C=O Amb10066926 [0,1,1,0,0,0|1,0,1]=4 4725 B11R1.37 N#Cc1cc(F)ccc1CO Amb27389751 [0,1,1,0,0,0|1,0,1]=4 4726 B11R1.37 N#Cc1cc(I)ccc1CO Amb26079645 [0,1,1,0,0,0|1,0,1]=4 4727 B11R1.37 N#Cc1cc(N)ccc1CO Amb27206645 [0,1,1,0,0,0|1,0,1]=4 4728 B11R1.37 N#Cc1cc(O)ccc1C=O Amb27400238 [0,1,1,0,0,0|1,0,1]=4 4729 B11R1.37 N#Cc1cc(O)ccc1CO Amb28141973 [0,1,1,0,0,0|1,0,1]=4 4730 B11R1.37 N#Cc1ccc(Br)cc1C=O Amb21964809 [0,1,1,0,0,0|1,0,1]=4 4731 B11R1.37 N#Cc1ccc(Cl)cc1C=O Amb22753139 [0,1,1,0,0,0|1,0,1]=4 4732 B11R1.37 N#Cc1ccc(Cl)cc1CO Amb25374942 [0,1,1,0,0,0|1,0,1]=4 4733 B11R1.37 N#Cc1ccc(F)cc1C=O Amb20076033 [0,1,1,0,0,0|1,0,1]=4 4734 B11R1.37 N#Cc1ccc(F)cc1CO Amb10841653 [0,1,1,0,0,0|1,0,1]=4 4735 B11R1.37 N#Cc1ccc(O)cc1C=O Amb27249453 [0,1,1,0,0,0|1,0,1]=4 4736 B11R1.37 N#Cc1ccc(O)cc1CO Amb27476208 [0,1,1,0,0,0|1,0,1]=4 4737 B11R1.37 NCc1cc(F)ccc1CO Amb27606552 [0,1,1,0,0,0|1,0,1]=4 4738 B11R1.37 NNc1cc(Br)ccc1C=O Amb26571448 [0,1,1,0,0,0|2,0,0]=4 4739 B11R1.37 NNc1cc(Br)ccc1CO Amb26974734 [0,1,1,0,0,0|2,0,0]=4 4740 B11R1.37 NNc1cc(Cl)ccc1C=O Amb27968008 [0,1,1,0,0,0|2,0,0]=4 4741 B11R1.37 NNc1cc(Cl)ccc1CO Amb27793910 [0,1,1,0,0,0|2,0,0]=4 4742 B11R1.37 NNc1cc(F)ccc1C=O Amb27209993 [0,1,1,0,0,0|2,0,0]=4 4743 B11R1.37 NNc1cc(I)ccc1C=O Amb28388973 [0,1,1,0,0,0|2,0,0]=4 4744 B11R1.37 NNc1cc(I)ccc1CO Amb24528105 [0,1,1,0,0,0|2,0,0]=4 4745 B11R1.37 NNc1cc(O)ccc1C=O Amb24527833 [0,1,1,0,0,0|2,0,0]=4 4746 B11R1.37 NNc1cc(O)ccc1CO Amb27642579 [0,1,1,0,0,0|2,0,0]=4 4747 B11R1.37 NNc1cc(S)ccc1C=O Amb25338418 [0,1,1,0,0,0|2,0,0]=4 4748 B11R1.37 NNc1cc(S)ccc1CO Amb27877052 [0,1,1,0,0,0|2,0,0]=4 4749 B11R1.37 NNc1ccc(Br)cc1C=O Amb25971149 [0,1,1,0,0,0|2,0,0]=4 4750 B11R1.37 NNc1ccc(Br)cc1CO Amb27670209 [0,1,1,0,0,0|2,0,0]=4 4751 B11R1.37 NNc1ccc(Cl)cc1C=O Amb26896701 [0,1,1,0,0,0|2,0,0]=4 4752 B11R1.37 NNc1ccc(F)cc1C=O Amb25254619 [0,1,1,0,0,0|2,0,0]=4 4753 B11R1.37 NNc1ccc(F)cc1CO Amb27423705 [0,1,1,0,0,0|2,0,0]=4 4754 B11R1.37 NNc1ccc(S)cc1C=O Amb24603411 [0,1,1,0,0,0|2,0,0]=4 4755 B11R1.37 Nc1ccc(CO)c(CO)c1 Amb28723817 [0,1,1,0,0,0|0,0,2]=4 4756 B11R1.37 O=Cc1cc(Br)ccc1CBr Amb25147961 [0,1,1,0,0,0|1,0,0]=3 4757 B11R1.37 O=Cc1cc(Cl)ccc1CBr Amb21961401 [0,1,1,0,0,0|1,0,0]=3 4758 B11R1.37 O=Cc1cc(Cl)ccc1N=O Amb27974047 [0,1,1,0,0,0|1,0,1]=4 4759 B11R1.37 O=Cc1cc(F)ccc1CBr Amb22735660 [0,1,1,0,0,0|1,0,0]=3 4760 B11R1.37 O=Cc1ccc(Br)cc1C=O Amb27252975 [0,1,1,0,0,0|0,0,2]=4 4761 B11R1.37 O=Cc1ccc(Br)cc1CBr Amb25856860 [0,1,1,0,0,0|1,0,0]=3 4762 B11R1.37 O=Cc1ccc(Cl)cc1C=O Amb18126570 [0,1,1,0,0,0|0,0,2]=4 4763 B11R1.37 O=Cc1ccc(F)cc1CBr Amb22735658 [0,1,1,0,0,0|1,0,0]=3 4764 B11R1.37 O=Cc1ccc(O)cc1C=O Amb28319367 [0,1,1,0,0,0|0,0,2]=4 4765 B11R1.37 OCc1cc(Br)ccc1CBr Amb24469220 [0,1,1,0,0,0|1,0,1]=4 4766 B11R1.37 OCc1cc(Cl)ccc1CBr Amb26609055 [0,1,1,0,0,0|1,0,1]=4 4767 B11R1.37 OCc1cc(F)ccc1CBr Amb25068334 [0,1,1,0,0,0|1,0,1]=4 4768 B11R1.37 OCc1ccc(Br)cc1CBr Amb27823165 [0,1,1,0,0,0|1,0,1]=4 4769 B11R1.37 OCc1ccc(Br)cc1CO Amb22886732 [0,1,1,0,0,0|0,0,2]=4 4770 B11R1.37 OCc1ccc(Cl)cc1CO Amb22754532 [0,1,1,0,0,0|0,0,2]=4 4771 B11R1.37 OCc1ccc(I)cc1CBr Amb28196536 [0,1,1,0,0,0|1,0,1]=4 4772 B11R1.41 C#Cc1ccccc1CC=O Amb24356607 [0,1,1,0,0,0|1,0,1]=4 4773 B11R1.41 C#Cc1ccccc1CCO Amb28292134 [0,1,1,0,0,0|1,0,1]=4 4774 B11R1.41 C#Cc1ccccc1CNO Amb33314772 [0,1,1,0,0,0|1,0,1]=4 4775 B11R1.41 C#Cc1ccccc1COC Amb27273609 [0,1,1,0,0,0|1,0,1]=4 4776 B11R1.41 C#Cc1ccccc1CON Amb26631058 [0,1,1,0,0,0|1,0,1]=4 4777 B11R1.41 C=CCc1ccccc1C=O Amb18124788 [0,1,1,0,0,0|1,0,0]=3 4778 B11R1.41 C=CCc1ccccc1CBr Amb25799496 [0,1,1,0,0,0|2,0,0]=4 4779 B11R1.41 C=CCc1ccccc1CC Amb22000373 [0,1,1,0,0,0|2,0,0]=4 4780 B11R1.41 C=CCc1ccccc1CO Amb10604897 [0,1,1,0,0,0|1,0,0]=3 4781 B11R1.41 C=CCc1cccnc1CO Amb28066661 [0,1,1,0,0,0|2,0,0]=4 4782 B11R1.41 C=COc1ccccc1C=O Amb26334217 [0,1,1,0,0,0|1,0,1]=4 4783 B11R1.41 C=COc1ccccc1CBr Amb27441078 [0,1,1,0,0,0|2,0,0]=4 4784 B11R1.41 C=Cc1ccccc1CC#N Amb26643171 [0,1,1,0,0,0|2,0,0]=4 4785 B11R1.41 C=Cc1ccccc1CCN Amb27468637 [0,1,1,0,0,0|2,0,0]=4 4786 B11R1.41 C=Cc1ccccc1CCO Amb25148236 [0,1,1,0,0,0|1,0,0]=3 4787 B11R1.41 C=Cc1ccccc1COC Amb25234064 [0,1,1,0,0,0|1,0,0]=3 4788 B11R1.41 C=Cc1ccccc1NC=O Amb27856053 [0,1,1,0,0,0|1,0,1]=4 4789 B11R1.41 C=Cc1ccccc1OCC Amb26635795 [0,1,1,0,0,0|2,0,0]=4 4790 B11R1.41 C=Cc1cnccc1CCO Amb28185468 [0,1,1,0,0,0|2,0,0]=4 4791 B11R1.41 CCCc1ccccc1CO Amb25148384 [0,1,1,0,0,0|1,0,1]=4 4792 B11R1.41 CCNc1ccccc1C=O Amb18125011 [0,1,1,0,0,0|1,0,0]=3 4793 B11R1.41 CCOc1ccccc1C=O Amb845365 [0,1,1,0,0,0|1,0,0]=3 4794 B11R1.41 CCOc1ccccc1CO Amb3546826 [0,1,1,0,0,0|1,0,1]=4 4795 B11R1.41 CCOc1ccncc1C=O Amb21959251 [0,1,1,0,0,0|2,0,0]=4 4796 B11R1.41 CCOc1cnccc1C=O Amb26974721 [0,1,1,0,0,0|2,0,0]=4 4797 B11R1.41 CCOc1ncccc1C=O Amb4561136 [0,1,1,0,0,0|2,0,0]=4 4798 B11R1.41 CCSc1ccccc1C=O Amb18126446 [0,1,1,0,0,0|1,0,0]=3 4799 B11R1.41 CCSc1ncccc1C=O Amb28369162 [0,1,1,0,0,0|2,0,0]=4 4800 B11R1.41 CCc1ccccc1CC=O Amb24100449 [0,1,1,0,0,0|1,0,0]=3 4801 B11R1.41 CCc1ccccc1CCO Amb22365060 [0,1,1,0,0,0|1,0,1]=4 4802 B11R1.41 CCc1ccccc1CNO Amb26610242 [0,1,1,0,0,0|1,0,1]=4 4803 B11R1.41 CCc1ccccc1CON Amb28047388 [0,1,1,0,0,0|1,0,1]=4 4804 B11R1.41 CCc1ccccc1N=C=O Amb2093119 [0,1,1,0,0,0|1,0,1]=4 4805 B11R1.41 CCc1ccccc1N=S=O Amb22411324 [0,1,1,0,0,0|2,0,0]=4 4806 B11R1.41 CCc1ccccc1NC=O Amb17940309 [0,1,1,0,0,0|1,0,0]=3 4807 B11R1.41 CCc1ccccc1\C=N\N Amb27758119 [0,1,1,0,0,0|2,0,0]=4 4808 B11R1.41 CNCc1ccccc1CO Amb6739980 [0,1,1,0,0,0|1,0,1]=4 4809 B11R1.41 CNc1ccccc1CCO Amb20246815 [0,1,1,0,0,0|2,0,0]=4 4810 B11R1.41 CNc1ccccc1COC Amb18292436 [0,1,1,0,0,0|2,0,0]=4 4811 B11R1.41 COCc1ccccc1C#N Amb6273717 [0,1,1,0,0,0|1,0,1]=4 4812 B11R1.41 COCc1ccccc1C=O Amb18644422 [0,1,1,0,0,0|0,0,0]=2 4813 B11R1.41 COCc1ccccc1CBr Amb26868657 [0,1,1,0,0,0|1,0,1]=4 4814 B11R1.41 COCc1ccccc1CI Amb27421603 [0,1,1,0,0,0|1,0,1]=4 4815 B11R1.41 COCc1ccccc1CN Amb1135743 [0,1,1,0,0,0|1,0,1]=4 4816 B11R1.41 COCc1ccccc1CO Amb24069032 [0,1,1,0,0,0|0,0,2]=4 4817 B11R1.41 COCc1ccccc1CS Amb26371095 [0,1,1,0,0,0|0,1,1]=4 4818 B11R1.41 COCc1ccccc1NN Amb18791509 [0,1,1,0,0,0|2,0,0]=4 4819 B11R1.41 COSc1ccccc1C=O Amb28074650 [0,1,1,0,0,0|1,0,0]=3 4820 B11R1.41 COc1ccccc1CC=O Amb9782680 [0,1,1,0,0,0|2,0,0]=4 4821 B11R1.41 COc1ccccc1CCO Amb3939092 [0,1,1,0,0,0|2,0,0]=4 4822 B11R1.41 COc1ccccc1CNO Amb23449445 [0,1,1,0,0,0|2,0,0]=4 4823 B11R1.41 COc1ccccc1CON Amb17091435 [0,1,1,0,0,0|2,0,0]=4 4824 B11R1.41 COc1ccccc1CON Amb21929115 [0,1,1,0,0,0|2,0,0]=4 4825 B11R1.41 COc1ccccc1NC=O Amb4016519 [0,1,1,0,0,0|2,0,0]=4 4826 B11R1.41 COc1ccccc1OCO Amb27835885 [0,1,1,0,0,0|2,0,0]=4 4827 B11R1.41 CSCc1ccccc1CO Amb28401109 [0,1,1,0,0,0|0,1,1]=4 4828 B11R1.41 CSc1ccccc1CC=O Amb33465834 [0,1,1,0,0,0|2,0,0]=4 4829 B11R1.41 CSc1ccccc1CCO Amb25305735 [0,1,1,0,0,0|2,0,0]=4 4830 B11R1.41 CSc1ccccc1CNO Amb33266282 [0,1,1,0,0,0|2,0,0]=4 4831 B11R1.41 CSc1ccccc1CON Amb33465867 [0,1,1,0,0,0|2,0,0]=4 4832 B11R1.41 N#CCc1ccccc1CO Amb18644330 [0,1,1,0,0,0|1,0,1]=4 4833 B11R1.41 N#CNc1ccccc1CO Amb28396999 [0,1,1,0,0,0|1,0,1]=4 4834 B11R1.41 N#COc1ccccc1C=O Amb25700946 [0,1,1,0,0,0|1,0,1]=4 4835 B11R1.41 N#CSc1ccccc1C=O Amb9782886 [0,1,1,0,0,0|1,0,1]=4 4836 B11R1.41 N#Cc1ccccc1CC=O Amb27945754 [0,1,1,0,0,0|1,0,1]=4 4837 B11R1.41 N#Cc1ccccc1CCO Amb13883613 [0,1,1,0,0,0|1,0,1]=4 4838 B11R1.41 N#Cc1ccccc1CNO Amb26025983 [0,1,1,0,0,0|1,0,1]=4 4839 B11R1.41 N#Cc1ccccc1CON Amb26371077 [0,1,1,0,0,0|1,0,1]=4 4840 B11R1.41 NCCc1ccccc1CO Amb25727716 [0,1,1,0,0,0|1,0,1]=4 4841 B11R1.41 NCc1ccccc1CC=O Amb28203985 [0,1,1,0,0,0|1,0,0]=3 4842 B11R1.41 O=C=Nc1ccccc1CCl Amb10607046 [0,1,1,0,0,0|1,0,1]=4 4843 B11R1.41 O=CCc1ccccc1C=O Amb17593688 [0,1,1,0,0,0|0,0,1]=3 4844 B11R1.41 O=Cc1ccccc1CCBr Amb16231602 [0,1,1,0,0,0|1,0,0]=3 4845 B11R1.41 O=Cc1ccccc1CCCl Amb17594227 [0,1,1,0,0,0|1,0,0]=3 4846 B11R1.41 O=Cc1ccccc1CCF Amb22739039 [0,1,1,0,0,0|1,0,0]=3 4847 B11R1.41 O=Cc1ccccc1CCO Amb17593729 [0,1,1,0,0,0|0,0,0]=2 4848 B11R1.41 O=Cc1ccccc1OCCl Amb27878777 [0,1,1,0,0,0|1,0,0]=3 4849 B11R1.41 OCCc1ccccc1CO Amb17593783 [0,1,1,0,0,0|0,0,2]=4 4850 B11R1.41 OCc1ccccc1CCCl Amb24079845 [0,1,1,0,0,0|1,0,1]=4 4851 B11R1.41 [N-]=[N+]=Nc1ccccc1C=O Amb25075225 [0,1,1,0,0,0|2,0,0]=4 4852 B11R1.41 [N-]=[N+]=Nc1ccccc1CO Amb27403539 [0,1,1,0,0,0|2,0,0]=4 4853 B11R1.53 C#Cc1ccccc1C(=O)O Amb10068419 [0,1,1,0,0,0|1,0,1]=4 4854 B11R1.53 C#Cc1ccccc1C(C)=O Amb28254619 [0,1,1,0,0,0|1,0,1]=4 4855 B11R1.53 C#Cc1ccccc1C(N)=O Amb23411992 [0,1,1,0,0,0|1,0,1]=4 4856 B11R1.53 C#Cc1ccccc1[C@@H](C)O Amb33204049 [0,1,1,0,0,0|1,0,1]=4 4857 B11R1.53 C#Cc1ccccc1[C@H](C)O Amb33204048 [0,1,1,0,0,0|1,0,1]=4 4858 B11R1.53 C=C(Br)c1ccccc1CN Amb27754019 [0,1,1,0,0,0|2,0,0]=4 4859 B11R1.53 C=Cc1ccccc1B(O)O Amb2456067 [0,1,1,0,0,0|2,0,0]=4 4860 B11R1.53 C=Cc1ccccc1C(=O)O Amb16185425 [0,1,1,0,0,0|1,0,1]=4 4861 B11R1.53 C=Cc1ccccc1C(C)=O Amb17593659 [0,1,1,0,0,0|1,0,1]=4 4862 B11R1.53 C=Cc1ccccc1C(C)C Amb33143434 [0,1,1,0,0,0|2,0,0]=4 4863 B11R1.53 C=Cc1ccccc1[C@H](C)O Amb28369031 [0,1,1,0,0,0|1,0,0]=3 4864 B11R1.53 C=Cc1ncccc1C(C)O Amb27856685 [0,1,1,0,0,0|2,0,0]=4 4865 B11R1.53 CC(=O)c1ccccc1C#N Amb33544453 [0,1,1,0,0,0|1,0,1]=4 4866 B11R1.53 CC(=O)c1ccccc1CCl Amb20620742 [0,1,1,0,0,0|1,0,0]=3 4867 B11R1.53 CC(=O)c1ccccc1CN Amb6297683 [0,1,1,0,0,0|1,0,0]=3 4868 B11R1.53 CC(=O)c1ccccc1CO Amb24452681 [0,1,1,0,0,0|0,0,0]=2 4869 B11R1.53 CC(=O)c1ccccc1N=O Amb25695758 [0,1,1,0,0,0|1,0,1]=4 4870 B11R1.53 CC(=O)c1ccccc1NN Amb28075149 [0,1,1,0,0,0|2,0,0]=4 4871 B11R1.53 CC(=O)c1cccnc1CCl Amb27823091 [0,1,1,0,0,0|2,0,0]=4 4872 B11R1.53 CC(=O)c1cccnc1CO Amb25802853 [0,1,1,0,0,0|1,0,0]=3 4873 B11R1.53 CC(C)c1ccccc1C=O Amb2688999 [0,1,1,0,0,0|1,0,0]=3 4874 B11R1.53 CC(C)c1ccccc1CO Amb17470394 [0,1,1,0,0,0|1,0,1]=4 4875 B11R1.53 CC(C)c1cccnc1C=O Amb28146756 [0,1,1,0,0,0|2,0,0]=4 4876 B11R1.53 CC(C)c1cnccc1C=O Amb18202072 [0,1,1,0,0,0|2,0,0]=4 4877 B11R1.53 CC(C)c1ncccc1C=O Amb18202076 [0,1,1,0,0,0|2,0,0]=4 4878 B11R1.53 CC(O)c1ccccc1C#N Amb22500568 [0,1,1,0,0,0|1,0,1]=4 4879 B11R1.53 CC(O)c1ccccc1C=O Amb27876336 [0,1,1,0,0,0|0,0,0]=2 4880 B11R1.53 CC(O)c1ccccc1CF Amb27965729 [0,1,1,0,0,0|1,0,1]=4 4881 B11R1.53 CC(O)c1ccccc1CN Amb26994771 [0,1,1,0,0,0|1,0,1]=4 4882 B11R1.53 CC(O)c1ccccc1CO Amb22295876 [0,1,1,0,0,0|0,0,2]=4 4883 B11R1.53 CC(O)c1ccccc1N=O Amb28239203 [0,1,1,0,0,0|1,0,0]=3 4884 B11R1.53 CC[n+]1ccccc1C(C)=O Amb32455993 [0,1,1,0,0,0|2,0,0]=4 4885 B11R1.53 CCc1ccccc1C(=N)N Amb2696662 [0,1,1,0,0,0|2,0,0]=4 4886 B11R1.53 CCc1ccccc1C(=O)O Amb3940731 [0,1,1,0,0,0|1,0,0]=3 4887 B11R1.53 CCc1ccccc1C(C)=O Amb17470383 [0,1,1,0,0,0|1,0,0]=3 4888 B11R1.53 CCc1ccccc1C(C)O Amb28365408 [0,1,1,0,0,0|1,0,1]=4 4889 B11R1.53 CCc1ccccc1C(N)=O Amb33539272 [0,1,1,0,0,0|1,0,0]=3 4890 B11R1.53 CCc1ccccc1C(N)=S Amb18798477 [0,1,1,0,0,0|1,1,0]=4 4891 B11R1.53 CCc1ccccc1N(=O)=O Amb20621814 [0,1,1,0,0,0|2,0,0]=4 4892 B11R1.53 CCc1ccccc1S(=O)[O-] Amb26619415 [0,1,1,0,0,0|2,0,0]=4 4893 B11R1.53 CCc1ccccc1[C@@H](C)O Amb25891117 [0,1,1,0,0,0|1,0,1]=4 4894 B11R1.53 CCc1ccccc1[C@H](C)O Amb25369346 [0,1,1,0,0,0|1,0,1]=4 4895 B11R1.53 CCc1cccnc1C(=O)O Amb30584721 [0,1,1,0,0,0|2,0,0]=4 4896 B11R1.53 CCc1cccnc1C(C)=O Amb23412441 [0,1,1,0,0,0|2,0,0]=4 4897 B11R1.53 CCc1ccncc1C(=O)O Amb18201753 [0,1,1,0,0,0|2,0,0]=4 4898 B11R1.53 CCc1cnccc1C(=O)Cl Amb28052755 [0,1,1,0,0,0|2,0,0]=4 4899 B11R1.53 CCc1cnccc1C(=O)O Amb21857954 [0,1,1,0,0,0|2,0,0]=4 4900 B11R1.53 CCc1cnccc1C(=O)O Amb30584719 [0,1,1,0,0,0|2,0,0]=4 4901 B11R1.53 CCc1cnccc1C(C)=O Amb22059616 [0,1,1,0,0,0|2,0,0]=4 4902 B11R1.53 CCc1ncccc1C(=O)O Amb18201760 [0,1,1,0,0,0|2,0,0]=4 4903 B11R1.53 CCc1ncccc1C(C)=O Amb25152759 [0,1,1,0,0,0|2,0,0]=4 4904 B11R1.53 CN(C)c1ccccc1C=O Amb2687441 [0,1,1,0,0,0|2,0,0]=4 4905 B11R1.53 CN(C)c1ccccc1CO Amb9207258 [0,1,1,0,0,0|2,0,0]=4 4906 B11R1.53 CNc1ccccc1C(=O)O Amb1209109 [0,1,1,0,0,0|2,0,0]=4 4907 B11R1.53 CNc1ccccc1C(C)=O Amb22057822 [0,1,1,0,0,0|2,0,0]=4 4908 B11R1.53 CNc1ccccc1C(N)=O Amb1209391 [0,1,1,0,0,0|2,0,0]=4 4909 B11R1.53 CNc1ccccc1[C@@H](C)O Amb27816181 [0,1,1,0,0,0|2,0,0]=4 4910 B11R1.53 COc1ccccc1C(=O)Cl Amb3429823 [0,1,1,0,0,0|2,0,0]=4 4911 B11R1.53 COc1ccccc1C(=O)F Amb27860257 [0,1,1,0,0,0|2,0,0]=4 4912 B11R1.53 COc1ccccc1C(=O)O Amb2592793 [0,1,1,0,0,0|2,0,0]=4 4913 B11R1.53 COc1ccccc1C(C)=O Amb2209367 [0,1,1,0,0,0|2,0,0]=4 4914 B11R1.53 COc1ccccc1C(C)O Amb2689207 [0,1,1,0,0,0|2,0,0]=4 4915 B11R1.53 COc1ccccc1C(N)=O Amb3564650 [0,1,1,0,0,0|2,0,0]=4 4916 B11R1.53 COc1ccccc1[C@@H](C)O Amb6893452 [0,1,1,0,0,0|2,0,0]=4 4917 B11R1.53 COc1ccccc1[C@H](C)O Amb6893451 [0,1,1,0,0,0|2,0,0]=4 4918 B11R1.53 CS(=O)c1ccccc1C=O Amb18126524 [0,1,1,0,0,0|1,0,1]=4 4919 B11R1.53 CSc1ccccc1C(=O)Cl Amb10879591 [0,1,1,0,0,0|2,0,0]=4 4920 B11R1.53 CSc1ccccc1C(=O)O Amb6357476 [0,1,1,0,0,0|2,0,0]=4 4921 B11R1.53 CSc1ccccc1C(C)=O Amb18180109 [0,1,1,0,0,0|2,0,0]=4 4922 B11R1.53 CSc1ccccc1C(C)O Amb26658669 [0,1,1,0,0,0|2,0,0]=4 4923 B11R1.53 CSc1ccccc1C(N)=O Amb3709825 [0,1,1,0,0,0|2,0,0]=4 4924 B11R1.53 CSc1ccccc1[C@@H](C)O Amb25711192 [0,1,1,0,0,0|2,0,0]=4 4925 B11R1.53 CSc1ccccc1[C@H](C)O Amb25251706 [0,1,1,0,0,0|2,0,0]=4 4926 B11R1.53 C[C@@H](O)c1ccccc1C#N Amb24591202 [0,1,1,0,0,0|1,0,1]=4 4927 B11R1.53 C[C@H](O)c1ccccc1C#N Amb25360537 [0,1,1,0,0,0|1,0,1]=4 4928 B11R1.53 C\C=C1/C=CC=C/C1=C(/C)O Amb27848191 [0,1,1,0,0,0|1,0,1]=4 4929 B11R1.53 C\C=C1\C=CC=C\C1=C(\C)O Amb27875406 [0,1,1,0,0,0|1,0,1]=4 4930 B11R1.53 N#Cc1ccccc1C(=O)Cl Amb16231897 [0,1,1,0,0,0|1,0,1]=4 4931 B11R1.53 N#Cc1ccccc1C(=O)O Amb1971492 [0,1,1,0,0,0|1,0,1]=4 4932 B11R1.53 N#Cc1ccccc1C(=O)[O-] Amb33512930 [0,1,1,0,0,0|1,0,1]=4 4933 B11R1.53 N#Cc1ccccc1C(N)=O Amb2720723 [0,1,1,0,0,0|1,0,1]=4 4934 B11R1.53 N#Cc1ccccc1C(N)O Amb27975749 [0,1,1,0,0,0|1,0,1]=4 4935 B11R1.53 N#[N+]c1ccccc1C(N)=O Amb27412391 [0,1,1,0,0,0|2,0,0]=4 4936 B11R1.53 N=C(N)c1ccccc1CN Amb32674104 [0,1,1,0,0,0|2,0,0]=4 4937 B11R1.53 N=C(N)c1ncccc1CO Amb18177176 [0,1,1,0,0,0|2,0,0]=4 4938 B11R1.53 N=Cc1ccccc1C(=O)O Amb27413879 [0,1,1,0,0,0|1,0,1]=4 4939 B11R1.53 NC(=O)c1ccccc1C=O Amb25865237 [0,1,1,0,0,0|0,0,2]=4 4940 B11R1.53 NC(=O)c1ccccc1CBr Amb21857553 [0,1,1,0,0,0|1,0,0]=3 4941 B11R1.53 NC(=O)c1ccccc1CCl Amb24381160 [0,1,1,0,0,0|1,0,0]=3 4942 B11R1.53 NC(=O)c1ccccc1CO Amb9421543 [0,1,1,0,0,0|0,0,0]=2 4943 B11R1.53 NC(=O)c1cccnc1CBr Amb27217115 [0,1,1,0,0,0|2,0,0]=4 4944 B11R1.53 NC(=O)c1cccnc1CO Amb24062358 [0,1,1,0,0,0|1,0,0]=3 4945 B11R1.53 NC(=O)c1cnccc1CBr Amb27176896 [0,1,1,0,0,0|2,0,0]=4 4946 B11R1.53 NC(=O)c1ncccc1CO Amb28365426 [0,1,1,0,0,0|1,0,0]=3 4947 B11R1.53 NC(=O)c1nccnc1CO Amb25892911 [0,1,1,0,0,0|2,0,0]=4 4948 B11R1.53 NCc1ccccc1C(=O)O Amb1092013 [0,1,1,0,0,0|1,0,0]=3 4949 B11R1.53 NCc1ccccc1C(=O)O Amb21955326 [0,1,1,0,0,0|1,0,0]=3 4950 B11R1.53 NCc1ccccc1C(N)=O Amb6276827 [0,1,1,0,0,0|1,0,0]=3 4951 B11R1.53 NCc1ccccc1C(N)=S Amb18251874 [0,1,1,0,0,0|1,1,0]=4 4952 B11R1.53 NCc1ccccc1[N+](=O)[O-] Amb6365872 [0,1,1,0,0,0|2,0,0]=4 4953 B11R1.53 NCc1ccccc1[N+](=O)[O-] Amb6478892 [0,1,1,0,0,0|2,0,0]=4 4954 B11R1.53 NCc1cccnc1C(=O)O Amb27823098 [0,1,1,0,0,0|2,0,0]=4 4955 B11R1.53 NCc1ncccc1C(=O)O Amb22499256 [0,1,1,0,0,0|2,0,0]=4 4956 B11R1.53 NCc1ncccc1C(=O)O Amb33482698 [0,1,1,0,0,0|2,0,0]=4 4957 B11R1.53 NNc1ccccc1C(=O)O Amb1202653 [0,1,1,0,0,0|2,0,0]=4 4958 B11R1.53 NNc1ccccc1C(=O)O Amb2235199 [0,1,1,0,0,0|2,0,0]=4 4959 B11R1.53 NNc1ccccc1C(N)=O Amb18179392 [0,1,1,0,0,0|2,0,0]=4 4960 B11R1.53 O=C(Br)c1ccccc1CBr Amb10071454 [0,1,1,0,0,0|1,0,0]=3 4961 B11R1.53 O=C(Cl)c1ccccc1CCl Amb8389212 [0,1,1,0,0,0|1,0,0]=3 4962 B11R1.53 O=C(Cl)c1ccccc1SCl Amb26627839 [0,1,1,0,0,0|2,0,0]=4 4963 B11R1.53 O=C(Cl)c1ccccc1[Se]Cl Amb2612752 [0,1,1,0,0,0|2,0,0]=4 4964 B11R1.53 O=C(O)c1ccccc1CBr Amb1935113 [0,1,1,0,0,0|1,0,0]=3 4965 B11R1.53 O=C(O)c1ccccc1CCl Amb6892775 [0,1,1,0,0,0|1,0,0]=3 4966 B11R1.53 O=C(O)c1ccccc1CF Amb25109949 [0,1,1,0,0,0|1,0,0]=3 4967 B11R1.53 O=C(O)c1ccccc1CO Amb33529359 [0,1,1,0,0,0|0,0,0]=2 4968 B11R1.53 O=C(O)c1ccccc1CS Amb17498634 [0,1,1,0,0,0|0,1,0]=3 4969 B11R1.53 O=C(O)c1ccccc1NO Amb26512688 [0,1,1,0,0,0|1,0,0]=3 4970 B11R1.53 O=C(O)c1ccccc1SCl Amb28136748 [0,1,1,0,0,0|2,0,0]=4 4971 B11R1.53 O=C(O)c1cccnc1CBr Amb25772981 [0,1,1,0,0,0|2,0,0]=4 4972 B11R1.53 O=C(O)c1cccnc1CO Amb18125525 [0,1,1,0,0,0|1,0,0]=3 4973 B11R1.53 O=C(O)c1cccnc1CS Amb27870464 [0,1,1,0,0,0|1,1,0]=4 4974 B11R1.53 O=C(O)c1cccnc1NO Amb28284908 [0,1,1,0,0,0|2,0,0]=4 4975 B11R1.53 O=C(O)c1ccncc1CCl Amb28365801 [0,1,1,0,0,0|2,0,0]=4 4976 B11R1.53 O=C(O)c1ncccc1CCl Amb27624348 [0,1,1,0,0,0|2,0,0]=4 4977 B11R1.53 O=C(O)c1ncccc1CO Amb18288555 [0,1,1,0,0,0|1,0,0]=3 4978 B11R1.53 O=C(O)c1nccnc1CO Amb22371935 [0,1,1,0,0,0|2,0,0]=4 4979 B11R1.53 O=C([O-])c1cccnc1CO Amb32698242 [0,1,1,0,0,0|1,0,0]=3 4980 B11R1.53 O=C([O-])c1ncccc1CO Amb33457665 [0,1,1,0,0,0|1,0,0]=3 4981 B11R1.53 O=C=C1C=CC=C\C1=[N+](/[O-])O Amb26032679 [0,1,1,0,0,0|1,0,1]=4 4982 B11R1.53 O=Cc1ccccc1B(O)O Amb2447093 [0,1,1,0,0,0|1,0,0]=3 4983 B11R1.53 O=Cc1ccccc1C(=O)O Amb2568292 [0,1,1,0,0,0|0,0,1]=3 4984 B11R1.53 O=Cc1ccccc1C(F)F Amb20670365 [0,1,1,0,0,0|1,0,0]=3 4985 B11R1.53 O=Cc1ccccc1N(=O)=O Amb20621765 [0,1,1,0,0,0|1,0,1]=4 4986 B11R1.53 O=Cc1ccccc1S(=O)O Amb27823415 [0,1,1,0,0,0|1,0,0]=3 4987 B11R1.53 O=Cc1ccccc1[N+](=O)[O-] Amb2611310 [0,1,1,0,0,0|1,0,1]=4 4988 B11R1.53 O=Cc1ccccc1[SH](=O)=O Amb27226994 [0,1,1,0,0,0|1,0,1]=4 4989 B11R1.53 O=Cc1cccnc1B(O)O Amb26905276 [0,1,1,0,0,0|2,0,0]=4 4990 B11R1.53 O=Cc1cccnc1C(=O)O Amb33544128 [0,1,1,0,0,0|1,0,1]=4 4991 B11R1.53 O=Cc1cccnc1C(F)F Amb25714209 [0,1,1,0,0,0|2,0,0]=4 4992 B11R1.53 O=Cc1ccncc1C(=O)O Amb7172756 [0,1,1,0,0,0|1,0,1]=4 4993 B11R1.53 O=Cc1ccncc1C(F)F Amb25794129 [0,1,1,0,0,0|2,0,0]=4 4994 B11R1.53 O=Cc1cnccc1B(O)O Amb13887038 [0,1,1,0,0,0|2,0,0]=4 4995 B11R1.53 O=Cc1cnccc1C(=O)O Amb23559759 [0,1,1,0,0,0|1,0,1]=4 4996 B11R1.53 O=Cc1cnccc1C(F)F Amb25793471 [0,1,1,0,0,0|2,0,0]=4 4997 B11R1.53 O=Cc1ncccc1B(O)O Amb27227116 [0,1,1,0,0,0|2,0,0]=4 4998 B11R1.53 O=Cc1ncccc1C(=O)O Amb22001968 [0,1,1,0,0,0|1,0,1]=4 4999 B11R1.53 O=Cc1ncccc1C(=O)O Amb32721603 [0,1,1,0,0,0|1,0,1]=4 5000 B11R1.53 O=Cc1ncccc1C(F)F Amb24054055 [0,1,1,0,0,0|2,0,0]=4 5001 B11R1.53 O=N(=O)c1ccccc1CCl Amb20621788 [0,1,1,0,0,0|2,0,0]=4 5002 B11R1.53 O=Nc1ccccc1C(=O)O Amb17593754 [0,1,1,0,0,0|1,0,1]=4 5003 B11R1.53 O=S([O-])c1ccccc1CCl Amb32754855 [0,1,1,0,0,0|2,0,0]=4 5004 B11R1.53 O=[IH2]c1ccccc1C(=O)O Amb9809713 [0,1,1,0,0,0|1,0,1]=4 5005 B11R1.53 O=[N+]([O-])c1ccccc1CBr Amb3939715 [0,1,1,0,0,0|2,0,0]=4 5006 B11R1.53 O=[N+]([O-])c1ccccc1CCl Amb32662878 [0,1,1,0,0,0|2,0,0]=4 5007 B11R1.53 O=[N+]([O-])c1ccccc1CF Amb24459711 [0,1,1,0,0,0|2,0,0]=4 5008 B11R1.53 O=[N+]([O-])c1ccccc1CO Amb837434 [0,1,1,0,0,0|1,0,0]=3 5009 B11R1.53 O=[N+]([O-])c1ccccc1CS Amb24606509 [0,1,1,0,0,0|1,1,0]=4 5010 B11R1.53 O=[N+]([O-])c1ccccc1NO Amb28137672 [0,1,1,0,0,0|2,0,0]=4 5011 B11R1.53 O=[N+]([O-])c1cccnc1CO Amb26943868 [0,1,1,0,0,0|2,0,0]=4 5012 B11R1.53 O=[N+]([O-])c1ccncc1CO Amb28045704 [0,1,1,0,0,0|2,0,0]=4 5013 B11R1.53 O=[N+]([O-])c1cnccc1CO Amb23399883 [0,1,1,0,0,0|2,0,0]=4 5014 B11R1.53 O=[N+]([O-])c1ncccc1CO Amb24520678 [0,1,1,0,0,0|2,0,0]=4 5015 B11R1.53 OCc1ccccc1B(O)O Amb3941032 [0,1,1,0,0,0|1,0,1]=4 5016 B11R1.53 OCc1ccccc1C(F)F Amb22735500 [0,1,1,0,0,0|1,0,1]=4 5017 B11R1.53 [C-]#[N+]c1ccccc1C(=O)O Amb28125730 [0,1,1,0,0,0|2,0,0]=4 5018 B11R1.53 [C-]#[N+]c1ccccc1C(C)=O Amb25920986 [0,1,1,0,0,0|2,0,0]=4 5019 B11R1.53 [NH3+]Nc1ccccc1C(=O)O Amb6365989 [0,1,1,0,0,0|2,0,0]=4 5020 B11R1.265 C#Cc1c(C)cccc1CO Amb28284750 [0,1,1,0,0,0|1,0,1]=4 5021 B11R1.265 C#Cc1cccc(F)c1C=O Amb27201269 [0,1,1,0,0,0|1,0,1]=4 5022 B11R1.265 C#Cc1cccc(N)c1CO Amb27753131 [0,1,1,0,0,0|1,0,1]=4 5023 B11R1.265 C=Cc1c(CO)ccnc1C Amb27217624 [0,1,1,0,0,0|2,0,0]=4 5024 B11R1.265 C=Cc1c(CO)ccnc1F Amb24487008 [0,1,1,0,0,0|2,0,0]=4 5025 B11R1.265 C=Cc1c(F)cccc1C=O Amb25729201 [0,1,1,0,0,0|1,0,1]=4 5026 B11R1.265 C=Cc1c(N)cccc1CO Amb27221270 [0,1,1,0,0,0|1,0,0]=3 5027 B11R1.265 C=Cc1cccc(C)c1CO Amb28190335 [0,1,1,0,0,0|1,0,0]=3 5028 B11R1.265 C=Cc1cncc(F)c1CO Amb26471723 [0,1,1,0,0,0|2,0,0]=4 5029 B11R1.265 C=Cc1nccc(C)c1CO Amb25922796 [0,1,1,0,0,0|2,0,0]=4 5030 B11R1.265 CCc1c(Br)cccc1C=O Amb18769305 [0,1,1,0,0,0|1,0,0]=3 5031 B11R1.265 CCc1c(Br)cncc1C=O Amb27223853 [0,1,1,0,0,0|2,0,0]=4 5032 B11R1.265 CCc1c(C)cncc1C=O Amb27441463 [0,1,1,0,0,0|2,0,0]=4 5033 B11R1.265 CCc1c(Cl)cccc1CO Amb28185578 [0,1,1,0,0,0|1,0,1]=4 5034 B11R1.265 CCc1c(F)cccc1C=O Amb28059639 [0,1,1,0,0,0|1,0,0]=3 5035 B11R1.265 CCc1c(F)cccc1CO Amb28321208 [0,1,1,0,0,0|1,0,1]=4 5036 B11R1.265 CCc1c(N)cccc1CO Amb28069010 [0,1,1,0,0,0|1,0,1]=4 5037 B11R1.265 CCc1cccc(Br)c1C=O Amb20248672 [0,1,1,0,0,0|1,0,0]=3 5038 B11R1.265 CCc1cccc(Br)c1CO Amb27951038 [0,1,1,0,0,0|1,0,1]=4 5039 B11R1.265 CCc1cccc(C)c1C=O Amb17470384 [0,1,1,0,0,0|1,0,0]=3 5040 B11R1.265 CCc1cccc(C)c1CO Amb17470393 [0,1,1,0,0,0|1,0,1]=4 5041 B11R1.265 CCc1cccc(Cl)c1C=O Amb27621927 [0,1,1,0,0,0|1,0,0]=3 5042 B11R1.265 CCc1cccc(F)c1C=O Amb27614172 [0,1,1,0,0,0|1,0,0]=3 5043 B11R1.265 CCc1cccc(F)c1CO Amb24538110 [0,1,1,0,0,0|1,0,1]=4 5044 B11R1.265 CCc1cccc(O)c1C=O Amb22228815 [0,1,1,0,0,0|1,0,0]=3 5045 B11R1.265 CCc1ccnc(C)c1C=O Amb22749392 [0,1,1,0,0,0|2,0,0]=4 5046 B11R1.265 CCc1ccnc(N)c1C=O Amb33512708 [0,1,1,0,0,0|2,0,0]=4 5047 B11R1.265 CCc1cncc(N)c1C=O Amb27762891 [0,1,1,0,0,0|2,0,0]=4 5048 B11R1.265 CNc1c(C)cccc1C=O Amb27252053 [0,1,1,0,0,0|2,0,0]=4 5049 B11R1.265 CNc1c(C)cccc1CO Amb10068095 [0,1,1,0,0,0|2,0,0]=4 5050 B11R1.265 CNc1cccc(O)c1C=O Amb28077575 [0,1,1,0,0,0|2,0,0]=4 5051 B11R1.265 COc1c(Br)cccc1C=O Amb10602255 [0,1,1,0,0,0|2,0,0]=4 5052 B11R1.265 COc1c(Br)cccc1CO Amb10071373 [0,1,1,0,0,0|2,0,0]=4 5053 B11R1.265 COc1c(C)cccc1C=O Amb5559733 [0,1,1,0,0,0|2,0,0]=4 5054 B11R1.265 COc1c(C)cccc1CO Amb22751268 [0,1,1,0,0,0|2,0,0]=4 5055 B11R1.265 COc1c(Cl)cccc1C=O Amb19957542 [0,1,1,0,0,0|2,0,0]=4 5056 B11R1.265 COc1c(Cl)cccc1CO Amb24088513 [0,1,1,0,0,0|2,0,0]=4 5057 B11R1.265 COc1c(F)cccc1C=O Amb16233201 [0,1,1,0,0,0|2,0,0]=4 5058 B11R1.265 COc1c(F)cccc1CO Amb19957982 [0,1,1,0,0,0|2,0,0]=4 5059 B11R1.265 COc1c(I)cccc1C=O Amb27453687 [0,1,1,0,0,0|2,0,0]=4 5060 B11R1.265 COc1c(I)cccc1CO Amb25857436 [0,1,1,0,0,0|2,0,0]=4 5061 B11R1.265 COc1c(N)cccc1C=O Amb24447419 [0,1,1,0,0,0|2,0,0]=4 5062 B11R1.265 COc1c(N)cccc1CO Amb27244689 [0,1,1,0,0,0|2,0,0]=4 5063 B11R1.265 COc1c(O)cccc1C=O Amb33544321 [0,1,1,0,0,0|2,0,0]=4 5064 B11R1.265 COc1c(O)cccc1CO Amb25340477 [0,1,1,0,0,0|2,0,0]=4 5065 B11R1.265 COc1cccc(Br)c1C=O Amb19889861 [0,1,1,0,0,0|2,0,0]=4 5066 B11R1.265 COc1cccc(Br)c1CO Amb22737590 [0,1,1,0,0,0|2,0,0]=4 5067 B11R1.265 COc1cccc(C)c1C=O Amb6760023 [0,1,1,0,0,0|2,0,0]=4 5068 B11R1.265 COc1cccc(C)c1CO Amb22500689 [0,1,1,0,0,0|2,0,0]=4 5069 B11R1.265 COc1cccc(Cl)c1C=O Amb6717808 [0,1,1,0,0,0|2,0,0]=4 5070 B11R1.265 COc1cccc(Cl)c1CO Amb7776033 [0,1,1,0,0,0|2,0,0]=4 5071 B11R1.265 COc1cccc(F)c1C=O Amb2404871 [0,1,1,0,0,0|2,0,0]=4 5072 B11R1.265 COc1cccc(F)c1CO Amb6298051 [0,1,1,0,0,0|2,0,0]=4 5073 B11R1.265 COc1cccc(I)c1CO Amb20248940 [0,1,1,0,0,0|2,0,0]=4 5074 B11R1.265 COc1cccc(N)c1CO Amb22751283 [0,1,1,0,0,0|2,0,0]=4 5075 B11R1.265 COc1cccc(O)c1C=O Amb5717413 [0,1,1,0,0,0|2,0,0]=4 5076 B11R1.265 COc1cccc(O)c1CO Amb6297620 [0,1,1,0,0,0|2,0,0]=4 5077 B11R1.265 CSc1c(Br)cccc1C=O Amb34911506 [0,1,1,0,0,0|2,0,0]=4 5078 B11R1.265 CSc1c(Br)cccc1CO Amb34911508 [0,1,1,0,0,0|2,0,0]=4 5079 B11R1.265 CSc1c(Cl)cccc1C=O Amb24670218 [0,1,1,0,0,0|2,0,0]=4 5080 B11R1.265 CSc1cccc(Br)c1C=O Amb27669481 [0,1,1,0,0,0|2,0,0]=4 5081 B11R1.265 CSc1cccc(Br)c1CO Amb27444391 [0,1,1,0,0,0|2,0,0]=4 5082 B11R1.265 CSc1cccc(Cl)c1C=O Amb24056468 [0,1,1,0,0,0|2,0,0]=4 5083 B11R1.265 CSc1cccc(Cl)c1CO Amb24456199 [0,1,1,0,0,0|2,0,0]=4 5084 B11R1.265 CSc1cccc(F)c1C=O Amb24607760 [0,1,1,0,0,0|2,0,0]=4 5085 B11R1.265 Cc1cccc(C#N)c1C=O Amb26853723 [0,1,1,0,0,0|1,0,1]=4 5086 B11R1.265 Cc1cccc(C#N)c1CO Amb28347897 [0,1,1,0,0,0|1,0,1]=4 5087 B11R1.265 Cc1cccc(C=O)c1C#N Amb22498075 [0,1,1,0,0,0|1,0,1]=4 5088 B11R1.265 Cc1cccc(C=O)c1C=O Amb10068387 [0,1,1,0,0,0|0,0,2]=4 5089 B11R1.265 Cc1cccc(C=O)c1NN Amb24640780 [0,1,1,0,0,0|2,0,0]=4 5090 B11R1.265 Cc1cccc(CO)c1C#N Amb26887245 [0,1,1,0,0,0|1,0,1]=4 5091 B11R1.265 Cc1cccc(CO)c1CO Amb24376104 [0,1,1,0,0,0|0,0,2]=4 5092 B11R1.265 Cc1cccc(CO)c1NN Amb25075543 [0,1,1,0,0,0|2,0,0]=4 5093 B11R1.265 Cc1ccnc(C=O)c1CCl Amb28060928 [0,1,1,0,0,0|2,0,0]=4 5094 B11R1.265 Cc1ccnc(CCl)c1C=O Amb27646749 [0,1,1,0,0,0|2,0,0]=4 5095 B11R1.265 Cc1cncc(C=O)c1CCl Amb25963943 [0,1,1,0,0,0|2,0,0]=4 5096 B11R1.265 Cc1cncc(CCl)c1C=O Amb25249406 [0,1,1,0,0,0|2,0,0]=4 5097 B11R1.265 Cc1nccc(C=O)c1CCl Amb26567642 [0,1,1,0,0,0|2,0,0]=4 5098 B11R1.265 Cc1nccc(CCl)c1C=O Amb27861144 [0,1,1,0,0,0|2,0,0]=4 5099 B11R1.265 N#Cc1c(Br)cccc1C=O Amb22753140 [0,1,1,0,0,0|1,0,1]=4 5100 B11R1.265 N#Cc1c(Br)cccc1CO Amb25312185 [0,1,1,0,0,0|1,0,1]=4 5101 B11R1.265 N#Cc1c(Cl)cccc1C=O Amb13883601 [0,1,1,0,0,0|1,0,1]=4 5102 B11R1.265 N#Cc1c(Cl)cccc1CO Amb27648676 [0,1,1,0,0,0|1,0,1]=4 5103 B11R1.265 N#Cc1c(F)cccc1C=O Amb28129681 [0,1,1,0,0,0|1,0,1]=4 5104 B11R1.265 N#Cc1cccc(Br)c1C=O Amb26645723 [0,1,1,0,0,0|1,0,1]=4 5105 B11R1.265 N#Cc1cccc(Br)c1CO Amb25784616 [0,1,1,0,0,0|1,0,1]=4 5106 B11R1.265 N#Cc1cccc(Cl)c1C=O Amb20242163 [0,1,1,0,0,0|1,0,1]=4 5107 B11R1.265 N#Cc1cccc(F)c1C=O Amb10602099 [0,1,1,0,0,0|1,0,1]=4 5108 B11R1.265 N#Cc1cccc(F)c1CO Amb27823299 [0,1,1,0,0,0|1,0,1]=4 5109 B11R1.265 N#Cc1cccc(O)c1C=O Amb22011621 [0,1,1,0,0,0|1,0,1]=4 5110 B11R1.265 N#Cc1cccc(O)c1CO Amb25151217 [0,1,1,0,0,0|1,0,1]=4 5111 B11R1.265 NCc1c(O)cccc1C=O Amb27256723 [0,1,1,0,0,0|1,0,0]=3 5112 B11R1.265 NNc1c(Br)cccc1C=O Amb27665767 [0,1,1,0,0,0|2,0,0]=4 5113 B11R1.265 NNc1c(Br)cccc1CO Amb28289719 [0,1,1,0,0,0|2,0,0]=4 5114 B11R1.265 NNc1c(Cl)cccc1C=O Amb26416494 [0,1,1,0,0,0|2,0,0]=4 5115 B11R1.265 NNc1c(Cl)cccc1CO Amb27237197 [0,1,1,0,0,0|2,0,0]=4 5116 B11R1.265 NNc1c(F)cccc1C=O Amb28196060 [0,1,1,0,0,0|2,0,0]=4 5117 B11R1.265 NNc1c(I)cccc1C=O Amb26023235 [0,1,1,0,0,0|2,0,0]=4 5118 B11R1.265 NNc1c(I)cccc1CO Amb25238002 [0,1,1,0,0,0|2,0,0]=4 5119 B11R1.265 NNc1c(O)cccc1C=O Amb24608926 [0,1,1,0,0,0|2,0,0]=4 5120 B11R1.265 NNc1c(O)cccc1CO Amb27623415 [0,1,1,0,0,0|2,0,0]=4 5121 B11R1.265 NNc1c(S)cccc1C=O Amb25224747 [0,1,1,0,0,0|2,0,0]=4 5122 B11R1.265 NNc1cccc(Br)c1C=O Amb25217742 [0,1,1,0,0,0|2,0,0]=4 5123 B11R1.265 NNc1cccc(Br)c1CO Amb24665937 [0,1,1,0,0,0|2,0,0]=4 5124 B11R1.265 NNc1cccc(F)c1C=O Amb24527814 [0,1,1,0,0,0|2,0,0]=4 5125 B11R1.265 NNc1cccc(F)c1CO Amb27423699 [0,1,1,0,0,0|2,0,0]=4 5126 B11R1.265 NNc1cccc(I)c1CO Amb26629699 [0,1,1,0,0,0|2,0,0]=4 5127 B11R1.265 NNc1cccc(O)c1C=O Amb28208665 [0,1,1,0,0,0|2,0,0]=4 5128 B11R1.265 NNc1cccc(S)c1C=O Amb28133610 [0,1,1,0,0,0|2,0,0]=4 5129 B11R1.265 Nc1cccc(CO)c1CO Amb22751282 [0,1,1,0,0,0|0,0,2]=4 5130 B11R1.265 Nc1nccc(CO)c1C=O Amb24549855 [0,1,1,0,0,0|1,0,0]=3 5131 B11R1.265 O=Cc1c(Br)cccc1CBr Amb27390095 [0,1,1,0,0,0|1,0,0]=3 5132 B11R1.265 O=Cc1c(Cl)cccc1CBr Amb21961423 [0,1,1,0,0,0|1,0,0]=3 5133 B11R1.265 O=Cc1c(F)cccc1CBr Amb22739414 [0,1,1,0,0,0|1,0,0]=3 5134 B11R1.265 O=Cc1c(O)cccc1CCl Amb28193755 [0,1,1,0,0,0|1,0,0]=3 5135 B11R1.265 O=Cc1c(O)cncc1CCl Amb27783842 [0,1,1,0,0,0|2,0,0]=4 5136 B11R1.265 O=Cc1c(O)cncc1CO Amb28365533 [0,1,1,0,0,0|1,0,0]=3 5137 B11R1.265 O=Cc1cccc(Br)c1CBr Amb26332039 [0,1,1,0,0,0|1,0,0]=3 5138 B11R1.265 O=Cc1cccc(Cl)c1C=O Amb25071890 [0,1,1,0,0,0|0,0,2]=4 5139 B11R1.265 O=Cc1cccc(F)c1C=O Amb20241831 [0,1,1,0,0,0|0,0,2]=4 5140 B11R1.265 O=Cc1cccc(F)c1CBr Amb22735656 [0,1,1,0,0,0|1,0,0]=3 5141 B11R1.265 O=Cc1cncc(F)c1CO Amb27441558 [0,1,1,0,0,0|1,0,0]=3 5142 B11R1.265 OCc1c(Br)cccc1CBr Amb27393614 [0,1,1,0,0,0|1,0,1]=4 5143 B11R1.265 OCc1c(Cl)cccc1CBr Amb25782225 [0,1,1,0,0,0|1,0,1]=4 5144 B11R1.265 OCc1cccc(Br)c1CBr Amb26066742 [0,1,1,0,0,0|1,0,1]=4 5145 B11R1.265 OCc1cccc(Br)c1CO Amb23401602 [0,1,1,0,0,0|0,0,2]=4 5146 B11R1.265 OCc1cccc(F)c1CBr Amb27870671 [0,1,1,0,0,0|1,0,1]=4 5147 B11R1.265 OCc1cccc(F)c1CF Amb27638247 [0,1,1,0,0,0|1,0,1]=4 5148 B11R1.265 OCc1cccc(O)c1CO Amb26909745 [0,1,1,0,0,0|0,0,2]=4 5149 B11R1.265 [*]Oc1cccc(Br)c1C=O Amb33716480 [0,1,1,0,0,0|2,0,0]=4 5150 B11R1.180 C=CCN\C=C1\CCOC1=O Amb27668936 [0,1,1,0,0,0|0,0,2]=4 5151 B11R1.465 C=C\C=C\N1C(=O)CCC1=O Amb25188549 [0,1,1,0,0,0|2,0,0]=4 5152 B11R1.87 Cc1ccccc1C(C)(C)O Amb9676790 [0,1,1,0,0,0|1,0,1]=4 5153 B11R1.87 Cc1ccccc1S(=O)(=O)Br Amb27768337 [0,1,1,0,0,0|1,0,1]=4 5154 B11R1.87 Cc1ccccc1S(=O)(=O)Cl Amb3939761 [0,1,1,0,0,0|1,0,1]=4 5155 B11R1.87 Cc1ccccc1S(=O)(=O)F Amb24419009 [0,1,1,0,0,0|1,0,1]=4 5156 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb20618615 [0,1,1,0,0,0|1,0,0]=3 5157 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb30594720 [0,1,1,0,0,0|1,0,0]=3 5158 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb33718793 [0,1,1,0,0,0|1,0,0]=3 5159 B11R1.87 Cc1ccccc1S(=O)(=O)O Amb33871604 [0,1,1,0,0,0|1,0,0]=3 5160 B11R1.87 Cc1ccccc1S(C)(=N)=O Amb32667812 [0,1,1,0,0,0|2,0,0]=4 5161 B11R1.87 Cc1ccccc1S(C)(=O)=O Amb8389999 [0,1,1,0,0,0|1,0,1]=4 5162 B11R1.87 Cc1ccccc1S(N)(=O)=O Amb2725549 [0,1,1,0,0,0|1,0,1]=4 5163 B11R1.87 Cc1cccnc1S(=O)(=O)O Amb30594709 [0,1,1,0,0,0|2,0,0]=4 5164 B11R1.87 Cc1ccncc1S(=O)(=O)O Amb2748001 [0,1,1,0,0,0|2,0,0]=4 5165 B11R1.87 Cc1cnccc1S(=O)(=O)O Amb10602338 [0,1,1,0,0,0|2,0,0]=4 5166 B11R1.87 Nc1ccccc1P(=O)(O)O Amb5494115 [0,1,1,0,0,0|2,0,0]=4 5167 B11R1.87 Nc1ccccc1S(=O)(=O)O Amb8426900 [0,1,1,0,0,0|2,0,0]=4 5168 B11R1.87 Nc1ccccc1[As](=O)(O)O Amb10071073 [0,1,1,0,0,0|2,0,0]=4 5169 B11R1.87 O=S(=O)(O)c1ccccc1F Amb20618605 [0,1,1,0,0,0|2,0,0]=4 5170 B11R1.87 O=S(=O)(O)c1ccccc1I Amb10842144 [0,1,1,0,0,0|2,0,0]=4 5171 B11R1.87 O=S(=O)(O)c1ccccc1O Amb17594378 [0,1,1,0,0,0|2,0,0]=4 5172 B11R1.156 C=C(C)c1c(C)cccc1C Amb27423379 [0,1,1,0,0,0|2,0,0]=4 5173 B11R1.156 C=C(C)c1c(C)cccc1O Amb27823429 [0,1,1,0,0,0|2,0,0]=4 5174 B11R1.156 CC(=O)C1=C(C)C=CNC1=O Amb23511926 [0,1,1,0,0,0|2,0,0]=4 5175 B11R1.156 CC(=O)C1=C(C)OC=CC1=O Amb26642969 [0,1,1,0,0,0|2,0,0]=4 5176 B11R1.156 CC(=O)c1c(Br)cccc1Br Amb23412431 [0,1,1,0,0,0|2,0,0]=4 5177 B11R1.156 CC(=O)c1c(Br)cccc1I Amb22737613 [0,1,1,0,0,0|2,0,0]=4 5178 B11R1.156 CC(=O)c1c(C)cccc1C Amb6298575 [0,1,1,0,0,0|1,0,0]=3 5179 B11R1.156 CC(=O)c1c(C)cccc1Cl Amb26002431 [0,1,1,0,0,0|1,0,0]=3 5180 B11R1.156 CC(=O)c1c(C)cccc1F Amb22500700 [0,1,1,0,0,0|1,0,0]=3 5181 B11R1.156 CC(=O)c1c(C)cccc1N Amb18124991 [0,1,1,0,0,0|1,0,0]=3 5182 B11R1.156 CC(=O)c1c(C)cccc1O Amb18125108 [0,1,1,0,0,0|1,0,0]=3 5183 B11R1.156 CC(=O)c1c(C)ccnc1F Amb27489427 [0,1,1,0,0,0|2,0,0]=4 5184 B11R1.156 CC(=O)c1c(C)cncc1C Amb18202066 [0,1,1,0,0,0|2,0,0]=4 5185 B11R1.156 CC(=O)c1c(C)cncc1Cl Amb28384069 [0,1,1,0,0,0|2,0,0]=4 5186 B11R1.156 CC(=O)c1c(Cl)cccc1Br Amb24061046 [0,1,1,0,0,0|2,0,0]=4 5187 B11R1.156 CC(=O)c1c(Cl)cccc1Cl Amb2686784 [0,1,1,0,0,0|2,0,0]=4 5188 B11R1.156 CC(=O)c1c(F)cccc1Br Amb19958768 [0,1,1,0,0,0|2,0,0]=4 5189 B11R1.156 CC(=O)c1c(F)cccc1Cl Amb2685918 [0,1,1,0,0,0|2,0,0]=4 5190 B11R1.156 CC(=O)c1c(F)cccc1F Amb1657285 [0,1,1,0,0,0|2,0,0]=4 5191 B11R1.156 CC(=O)c1c(F)cccc1I Amb27476628 [0,1,1,0,0,0|2,0,0]=4 5192 B11R1.156 CC(=O)c1c(N)cccc1Br Amb21857144 [0,1,1,0,0,0|2,0,0]=4 5193 B11R1.156 CC(=O)c1c(N)cccc1Cl Amb26061428 [0,1,1,0,0,0|2,0,0]=4 5194 B11R1.156 CC(=O)c1c(N)cccc1F Amb22500713 [0,1,1,0,0,0|2,0,0]=4 5195 B11R1.156 CC(=O)c1c(N)cccc1F Amb33446972 [0,1,1,0,0,0|2,0,0]=4 5196 B11R1.156 CC(=O)c1c(O)cccc1Br Amb19895172 [0,1,1,0,0,0|2,0,0]=4 5197 B11R1.156 CC(=O)c1c(O)cccc1Cl Amb3428659 [0,1,1,0,0,0|2,0,0]=4 5198 B11R1.156 CC(=O)c1c(O)cccc1F Amb8397099 [0,1,1,0,0,0|2,0,0]=4 5199 B11R1.156 CC(=O)c1c(O)cccc1O Amb2609021 [0,1,1,0,0,0|2,0,0]=4 5200 B11R1.156 CC1=C(C(=O)O)C(=O)N=CN1 Amb25727909 [0,1,1,0,0,0|2,0,0]=4 5201 B11R1.156 CC1=C(C(=O)O)C(=O)NC=C1 Amb18538482 [0,1,1,0,0,0|1,0,0]=3 5202 B11R1.156 CC1=C(C(=O)O)C(C)C=CN1 Amb28071713 [0,1,1,0,0,0|1,0,1]=4 5203 B11R1.156 C[n+]1cccc(O)c1C(N)=O Amb3940689 [0,1,1,0,0,0|2,0,0]=4 5204 B11R1.156 Cc1cccc(Br)c1C(=O)Cl Amb19891063 [0,1,1,0,0,0|1,0,0]=3 5205 B11R1.156 Cc1cccc(Br)c1C(=O)O Amb6366145 [0,1,1,0,0,0|0,0,0]=2 5206 B11R1.156 Cc1cccc(Br)c1C(N)=O Amb23437320 [0,1,1,0,0,0|1,0,0]=3 5207 B11R1.156 Cc1cccc(Br)c1C(O)=S Amb27465547 [0,1,1,0,0,0|0,1,0]=3 5208 B11R1.156 Cc1cccc(Br)c1N(=O)=O Amb6365728 [0,1,1,0,0,0|1,0,1]=4 5209 B11R1.156 Cc1cccc(Br)c1[N+](=O)[O-] Amb2685369 [0,1,1,0,0,0|1,0,1]=4 5210 B11R1.156 Cc1cccc(C)c1B(O)O Amb3939287 [0,1,1,0,0,0|1,0,1]=4 5211 B11R1.156 Cc1cccc(C)c1C(=N)N Amb2695867 [0,1,1,0,0,0|2,0,0]=4 5212 B11R1.156 Cc1cccc(C)c1C(=O)F Amb25992551 [0,1,1,0,0,0|1,0,0]=3 5213 B11R1.156 Cc1cccc(C)c1C(=O)O Amb2612269 [0,1,1,0,0,0|0,0,0]=2 5214 B11R1.156 Cc1cccc(C)c1C(C)O Amb6298843 [0,1,1,0,0,0|1,0,1]=4 5215 B11R1.156 Cc1cccc(C)c1C(N)=O Amb2778248 [0,1,1,0,0,0|1,0,0]=3 5216 B11R1.156 Cc1cccc(C)c1C(N)=S Amb26032371 [0,1,1,0,0,0|1,1,0]=4 5217 B11R1.156 Cc1cccc(C)c1C(O)=S Amb27156742 [0,1,1,0,0,0|0,1,0]=3 5218 B11R1.156 Cc1cccc(C)c1N(=O)=O Amb20621145 [0,1,1,0,0,0|1,0,1]=4 5219 B11R1.156 Cc1cccc(C)c1S(=O)O Amb32992462 [0,1,1,0,0,0|1,0,0]=3 5220 B11R1.156 Cc1cccc(C)c1S(=O)[O-] Amb32992548 [0,1,1,0,0,0|1,0,1]=4 5221 B11R1.156 Cc1cccc(C)c1[C@@H](C)O Amb26944728 [0,1,1,0,0,0|1,0,1]=4 5222 B11R1.156 Cc1cccc(C)c1[C@H](C)O Amb25794607 [0,1,1,0,0,0|1,0,1]=4 5223 B11R1.156 Cc1cccc(Cl)c1B(O)O Amb27949137 [0,1,1,0,0,0|1,0,1]=4 5224 B11R1.156 Cc1cccc(Cl)c1C(=N)N Amb2696050 [0,1,1,0,0,0|2,0,0]=4 5225 B11R1.156 Cc1cccc(Cl)c1C(=O)Cl Amb19888086 [0,1,1,0,0,0|1,0,0]=3 5226 B11R1.156 Cc1cccc(Cl)c1C(=O)O Amb2686194 [0,1,1,0,0,0|0,0,0]=2 5227 B11R1.156 Cc1cccc(Cl)c1C(C)O Amb28366394 [0,1,1,0,0,0|1,0,1]=4 5228 B11R1.156 Cc1cccc(Cl)c1C(N)=O Amb3429850 [0,1,1,0,0,0|1,0,0]=3 5229 B11R1.156 Cc1cccc(Cl)c1C(N)=S Amb28397260 [0,1,1,0,0,0|1,1,0]=4 5230 B11R1.156 Cc1cccc(Cl)c1N(=O)=O Amb20621805 [0,1,1,0,0,0|1,0,1]=4 5231 B11R1.156 Cc1cccc(Cl)c1S(=O)[O-] Amb32754538 [0,1,1,0,0,0|1,0,1]=4 5232 B11R1.156 Cc1cccc(Cl)c1[C@@H](C)O Amb33259385 [0,1,1,0,0,0|1,0,1]=4 5233 B11R1.156 Cc1cccc(Cl)c1[C@H](C)O Amb33259390 [0,1,1,0,0,0|1,0,1]=4 5234 B11R1.156 Cc1cccc(Cl)c1[N+](=O)[O-] Amb6296510 [0,1,1,0,0,0|1,0,1]=4 5235 B11R1.156 Cc1cccc(F)c1B(O)O Amb20075928 [0,1,1,0,0,0|1,0,1]=4 5236 B11R1.156 Cc1cccc(F)c1C(=N)N Amb33148302 [0,1,1,0,0,0|2,0,0]=4 5237 B11R1.156 Cc1cccc(F)c1C(=O)Cl Amb19890589 [0,1,1,0,0,0|1,0,0]=3 5238 B11R1.156 Cc1cccc(F)c1C(=O)O Amb33544415 [0,1,1,0,0,0|0,0,0]=2 5239 B11R1.156 Cc1cccc(F)c1C(N)=O Amb22500701 [0,1,1,0,0,0|1,0,0]=3 5240 B11R1.156 Cc1cccc(F)c1C(N)=S Amb28284905 [0,1,1,0,0,0|1,1,0]=4 5241 B11R1.156 Cc1cccc(F)c1C(O)=S Amb24599765 [0,1,1,0,0,0|0,1,0]=3 5242 B11R1.156 Cc1cccc(F)c1N(=O)=O Amb20621367 [0,1,1,0,0,0|1,0,1]=4 5243 B11R1.156 Cc1cccc(F)c1S(=O)[O-] Amb27167270 [0,1,1,0,0,0|1,0,1]=4 5244 B11R1.156 Cc1cccc(F)c1[C@@H](C)O Amb33225686 [0,1,1,0,0,0|1,0,1]=4 5245 B11R1.156 Cc1cccc(F)c1[C@H](C)O Amb33273563 [0,1,1,0,0,0|1,0,1]=4 5246 B11R1.156 Cc1cccc(F)c1[N+](=O)[O-] Amb10606378 [0,1,1,0,0,0|1,0,1]=4 5247 B11R1.156 Cc1cccc(I)c1B(O)O Amb27393728 [0,1,1,0,0,0|1,0,1]=4 5248 B11R1.156 Cc1cccc(I)c1C(=O)Cl Amb28240849 [0,1,1,0,0,0|1,0,0]=3 5249 B11R1.156 Cc1cccc(I)c1C(=O)O Amb6297500 [0,1,1,0,0,0|0,0,0]=2 5250 B11R1.156 Cc1cccc(I)c1C(N)=O Amb27393570 [0,1,1,0,0,0|1,0,0]=3 5251 B11R1.156 Cc1cccc(I)c1C(O)=S Amb25315406 [0,1,1,0,0,0|0,1,0]=3 5252 B11R1.156 Cc1cccc(I)c1[N+](=O)[O-] Amb25055627 [0,1,1,0,0,0|1,0,1]=4 5253 B11R1.156 Cc1cccc(N)c1C(=O)Cl Amb21961744 [0,1,1,0,0,0|1,0,0]=3 5254 B11R1.156 Cc1cccc(N)c1C(=O)O Amb2782003 [0,1,1,0,0,0|0,0,0]=2 5255 B11R1.156 Cc1cccc(N)c1C(=O)[O-] Amb33512952 [0,1,1,0,0,0|0,0,1]=3 5256 B11R1.156 Cc1cccc(N)c1C(N)=O Amb1125986 [0,1,1,0,0,0|1,0,0]=3 5257 B11R1.156 Cc1cccc(N)c1C(N)=S Amb27400223 [0,1,1,0,0,0|1,1,0]=4 5258 B11R1.156 Cc1cccc(N)c1N(=O)=O Amb20621652 [0,1,1,0,0,0|1,0,1]=4 5259 B11R1.156 Cc1cccc(N)c1S(C)=O Amb27475597 [0,1,1,0,0,0|2,0,0]=4 5260 B11R1.156 Cc1cccc(O)c1B(O)O Amb25864286 [0,1,1,0,0,0|1,0,1]=4 5261 B11R1.156 Cc1cccc(O)c1C(=N)N Amb27823137 [0,1,1,0,0,0|2,0,0]=4 5262 B11R1.156 Cc1cccc(O)c1C(=O)O Amb6298569 [0,1,1,0,0,0|0,0,0]=2 5263 B11R1.156 Cc1cccc(O)c1C(=S)S Amb28282199 [0,1,1,0,0,0|0,2,0]=4 5264 B11R1.156 Cc1cccc(O)c1C(N)=O Amb22500875 [0,1,1,0,0,0|1,0,0]=3 5265 B11R1.156 Cc1cccc(O)c1C(O)=S Amb27256635 [0,1,1,0,0,0|0,1,0]=3 5266 B11R1.156 Cc1cccc(O)c1N(=O)=O Amb20620285 [0,1,1,0,0,0|1,0,1]=4 5267 B11R1.156 Cc1cccc(O)c1[N+](=O)[O-] Amb8384881 [0,1,1,0,0,0|1,0,1]=4 5268 B11R1.156 Cc1cccc(S)c1C(=O)O Amb18126520 [0,1,1,0,0,0|0,0,0]=2 5269 B11R1.156 Cc1cccc(S)c1[N+](=O)[O-] Amb25775276 [0,1,1,0,0,0|1,0,1]=4 5270 B11R1.156 Cc1ccnc(Br)c1C(=O)Cl Amb27796536 [0,1,1,0,0,0|2,0,0]=4 5271 B11R1.156 Cc1ccnc(C)c1C(=O)O Amb2695128 [0,1,1,0,0,0|1,0,0]=3 5272 B11R1.156 Cc1ccnc(C)c1C(=O)O Amb8385362 [0,1,1,0,0,0|1,0,0]=3 5273 B11R1.156 Cc1ccnc(Cl)c1C(=O)Cl Amb17621529 [0,1,1,0,0,0|2,0,0]=4 5274 B11R1.156 Cc1ccnc(Cl)c1C(=O)O Amb19889580 [0,1,1,0,0,0|1,0,0]=3 5275 B11R1.156 Cc1ccnc(Cl)c1C(N)=O Amb20241250 [0,1,1,0,0,0|2,0,0]=4 5276 B11R1.156 Cc1ccnc(Cl)c1S(=O)O Amb32992483 [0,1,1,0,0,0|2,0,0]=4 5277 B11R1.156 Cc1ccnc(F)c1C(=O)O Amb25983166 [0,1,1,0,0,0|1,0,0]=3 5278 B11R1.156 Cc1ccnc(N)c1C(=O)O Amb10807422 [0,1,1,0,0,0|1,0,0]=3 5279 B11R1.156 Cc1ccnc(N)c1C(=O)O Amb30584661 [0,1,1,0,0,0|1,0,0]=3 5280 B11R1.156 Cc1ccnc(N)c1C(N)=O Amb32456015 [0,1,1,0,0,0|2,0,0]=4 5281 B11R1.156 Cc1ccnc(O)c1C(=O)O Amb17621632 [0,1,1,0,0,0|1,0,0]=3 5282 B11R1.156 Cc1ccnc(O)c1C(N)=O Amb25721570 [0,1,1,0,0,0|2,0,0]=4 5283 B11R1.156 Cc1ccnc(S)c1C(=O)O Amb27250078 [0,1,1,0,0,0|1,0,0]=3 5284 B11R1.156 Cc1ccnc(S)c1C(N)=O Amb20247542 [0,1,1,0,0,0|2,0,0]=4 5285 B11R1.156 Cc1cncc(Br)c1C(=O)O Amb18770710 [0,1,1,0,0,0|1,0,0]=3 5286 B11R1.156 Cc1cncc(C)c1C(=O)O Amb10602201 [0,1,1,0,0,0|1,0,0]=3 5287 B11R1.156 Cc1cncc(C)c1C(=O)O Amb33295197 [0,1,1,0,0,0|1,0,0]=3 5288 B11R1.156 Cc1cncc(Cl)c1C(=O)O Amb18198382 [0,1,1,0,0,0|1,0,0]=3 5289 B11R1.156 Cc1cncc(O)c1C(=O)O Amb18201191 [0,1,1,0,0,0|1,0,0]=3 5290 B11R1.156 Cc1cnnc(Br)c1C(=O)O Amb18770070 [0,1,1,0,0,0|2,0,0]=4 5291 B11R1.156 Cc1nccc(Cl)c1C(=O)O Amb8387544 [0,1,1,0,0,0|1,0,0]=3 5292 B11R1.156 Cc1nccc(N)c1C(=O)O Amb25688444 [0,1,1,0,0,0|1,0,0]=3 5293 B11R1.156 Cc1nccc(O)c1C(=O)O Amb22491762 [0,1,1,0,0,0|1,0,0]=3 5294 B11R1.156 Cc1ncnc(C)c1C(=O)O Amb8011299 [0,1,1,0,0,0|2,0,0]=4 5295 B11R1.156 Cc1ncnc(Cl)c1C(=O)O Amb24593267 [0,1,1,0,0,0|2,0,0]=4 5296 B11R1.156 Cc1ncnc(N)c1C(=O)O Amb24488224 [0,1,1,0,0,0|2,0,0]=4 5297 B11R1.156 NC(=O)c1c(Br)cccc1Br Amb23412430 [0,1,1,0,0,0|2,0,0]=4 5298 B11R1.156 NC(=O)c1c(Br)cccc1I Amb26935819 [0,1,1,0,0,0|2,0,0]=4 5299 B11R1.156 NC(=O)c1c(Cl)cccc1Br Amb27435591 [0,1,1,0,0,0|2,0,0]=4 5300 B11R1.156 NC(=O)c1c(Cl)cccc1Cl Amb2609953 [0,1,1,0,0,0|2,0,0]=4 5301 B11R1.156 NC(=O)c1c(Cl)cccc1I Amb22232874 [0,1,1,0,0,0|2,0,0]=4 5302 B11R1.156 NC(=O)c1c(F)cccc1Br Amb16185874 [0,1,1,0,0,0|2,0,0]=4 5303 B11R1.156 NC(=O)c1c(F)cccc1Cl Amb2685934 [0,1,1,0,0,0|2,0,0]=4 5304 B11R1.156 NC(=O)c1c(F)cccc1F Amb2687050 [0,1,1,0,0,0|2,0,0]=4 5305 B11R1.156 NC(=O)c1c(F)cccc1I Amb27393635 [0,1,1,0,0,0|2,0,0]=4 5306 B11R1.156 NC(=O)c1c(N)cccc1Br Amb23401038 [0,1,1,0,0,0|2,0,0]=4 5307 B11R1.156 NC(=O)c1c(N)cccc1Cl Amb18126738 [0,1,1,0,0,0|2,0,0]=4 5308 B11R1.156 NC(=O)c1c(N)cccc1F Amb2684410 [0,1,1,0,0,0|2,0,0]=4 5309 B11R1.156 NC(=O)c1c(N)cccc1I Amb26995912 [0,1,1,0,0,0|2,0,0]=4 5310 B11R1.156 NC(=O)c1c(N)cccc1N Amb26445714 [0,1,1,0,0,0|2,0,0]=4 5311 B11R1.156 NC(=O)c1c(O)cccc1Br Amb25376948 [0,1,1,0,0,0|2,0,0]=4 5312 B11R1.156 NC(=O)c1c(O)cccc1Cl Amb27792106 [0,1,1,0,0,0|2,0,0]=4 5313 B11R1.156 NC(=O)c1c(O)cccc1F Amb24091708 [0,1,1,0,0,0|2,0,0]=4 5314 B11R1.156 NC(=O)c1c(O)cccc1I Amb27215330 [0,1,1,0,0,0|2,0,0]=4 5315 B11R1.156 NC(=O)c1c(O)cccc1O Amb6298857 [0,1,1,0,0,0|2,0,0]=4 5316 B11R1.156 Nc1cccc(Br)c1C(=O)Cl Amb27633127 [0,1,1,0,0,0|2,0,0]=4 5317 B11R1.156 Nc1cccc(Br)c1C(=O)O Amb6308306 [0,1,1,0,0,0|1,0,0]=3 5318 B11R1.156 Nc1cccc(Cl)c1C(=O)O Amb1039017 [0,1,1,0,0,0|1,0,0]=3 5319 B11R1.156 Nc1cccc(Cl)c1C(=O)O Amb22283047 [0,1,1,0,0,0|1,0,0]=3 5320 B11R1.156 Nc1cccc(F)c1C(=O)O Amb2684411 [0,1,1,0,0,0|1,0,0]=3 5321 B11R1.156 Nc1cccc(F)c1C(=O)[O-] Amb33512984 [0,1,1,0,0,0|1,0,1]=4 5322 B11R1.156 Nc1cccc(I)c1C(=O)O Amb8629778 [0,1,1,0,0,0|1,0,0]=3 5323 B11R1.156 Nc1cccc(O)c1C(=O)O Amb18644549 [0,1,1,0,0,0|1,0,0]=3 5324 B11R1.156 Nc1cccc(S)c1C(=O)O Amb24445234 [0,1,1,0,0,0|1,0,0]=3 5325 B11R1.156 Nc1ccnc(Br)c1C(=O)O Amb23401949 [0,1,1,0,0,0|2,0,0]=4 5326 B11R1.156 Nc1ccnc(Cl)c1C(=O)O Amb23401948 [0,1,1,0,0,0|2,0,0]=4 5327 B11R1.156 Nc1cncc(Br)c1C(=O)O Amb21961712 [0,1,1,0,0,0|2,0,0]=4 5328 B11R1.156 Nc1cncc(Cl)c1C(=O)O Amb26943876 [0,1,1,0,0,0|2,0,0]=4 5329 B11R1.156 Nc1cncc(F)c1C(=O)O Amb27646862 [0,1,1,0,0,0|2,0,0]=4 5330 B11R1.156 Nc1nccc(Cl)c1C(=O)O Amb21963384 [0,1,1,0,0,0|2,0,0]=4 5331 B11R1.156 Nc1nccc(F)c1C(=O)O Amb26554480 [0,1,1,0,0,0|2,0,0]=4 5332 B11R1.156 O=C(Cl)c1c(Br)cccc1Br Amb25682485 [0,1,1,0,0,0|2,0,0]=4 5333 B11R1.156 O=C(Cl)c1c(Br)cccc1I Amb25921508 [0,1,1,0,0,0|2,0,0]=4 5334 B11R1.156 O=C(Cl)c1c(Cl)cccc1Br Amb2685001 [0,1,1,0,0,0|2,0,0]=4 5335 B11R1.156 O=C(Cl)c1c(Cl)cccc1Cl Amb3939089 [0,1,1,0,0,0|2,0,0]=4 5336 B11R1.156 O=C(Cl)c1c(Cl)cccc1I Amb27482834 [0,1,1,0,0,0|2,0,0]=4 5337 B11R1.156 O=C(Cl)c1c(F)cccc1Br Amb8397060 [0,1,1,0,0,0|2,0,0]=4 5338 B11R1.156 O=C(Cl)c1c(F)cccc1Cl Amb2685965 [0,1,1,0,0,0|2,0,0]=4 5339 B11R1.156 O=C(Cl)c1c(F)cccc1F Amb535710 [0,1,1,0,0,0|2,0,0]=4 5340 B11R1.156 O=C(Cl)c1c(F)cccc1I Amb16232713 [0,1,1,0,0,0|2,0,0]=4 5341 B11R1.156 O=C(Cl)c1c(O)cccc1Br Amb28286688 [0,1,1,0,0,0|2,0,0]=4 5342 B11R1.156 O=C(Cl)c1c(O)cccc1Cl Amb24665648 [0,1,1,0,0,0|2,0,0]=4 5343 B11R1.156 O=C(F)c1c(Cl)cccc1Cl Amb24577893 [0,1,1,0,0,0|2,0,0]=4 5344 B11R1.156 O=C(F)c1c(F)cccc1F Amb26495107 [0,1,1,0,0,0|2,0,0]=4 5345 B11R1.156 O=C(O)C1=C(I)C=CNC1=O Amb24678000 [0,1,1,0,0,0|2,0,0]=4 5346 B11R1.156 O=C(O)c1c(Br)cccc1Br Amb2609567 [0,1,1,0,0,0|1,0,0]=3 5347 B11R1.156 O=C(O)c1c(Br)cccc1I Amb22228686 [0,1,1,0,0,0|1,0,0]=3 5348 B11R1.156 O=C(O)c1c(Br)ccnc1Br Amb23412238 [0,1,1,0,0,0|2,0,0]=4 5349 B11R1.156 O=C(O)c1c(Br)ccnc1Cl Amb26917858 [0,1,1,0,0,0|2,0,0]=4 5350 B11R1.156 O=C(O)c1c(Br)ccnc1F Amb27876653 [0,1,1,0,0,0|2,0,0]=4 5351 B11R1.156 O=C(O)c1c(Br)ccnc1O Amb28186084 [0,1,1,0,0,0|2,0,0]=4 5352 B11R1.156 O=C(O)c1c(Br)cncc1Br Amb20620926 [0,1,1,0,0,0|2,0,0]=4 5353 B11R1.156 O=C(O)c1c(Br)cncc1I Amb28070458 [0,1,1,0,0,0|2,0,0]=4 5354 B11R1.156 O=C(O)c1c(Cl)cccc1Br Amb2684994 [0,1,1,0,0,0|1,0,0]=3 5355 B11R1.156 O=C(O)c1c(Cl)cccc1Cl Amb535704 [0,1,1,0,0,0|1,0,0]=3 5356 B11R1.156 O=C(O)c1c(Cl)cccc1I Amb22233816 [0,1,1,0,0,0|1,0,0]=3 5357 B11R1.156 O=C(O)c1c(Cl)ccnc1Br Amb24451059 [0,1,1,0,0,0|2,0,0]=4 5358 B11R1.156 O=C(O)c1c(Cl)ccnc1Cl Amb6751859 [0,1,1,0,0,0|2,0,0]=4 5359 B11R1.156 O=C(O)c1c(Cl)ccnc1F Amb25829525 [0,1,1,0,0,0|2,0,0]=4 5360 B11R1.156 O=C(O)c1c(Cl)cncc1Br Amb27631437 [0,1,1,0,0,0|2,0,0]=4 5361 B11R1.156 O=C(O)c1c(Cl)cncc1Cl Amb2686872 [0,1,1,0,0,0|2,0,0]=4 5362 B11R1.156 O=C(O)c1c(F)cccc1Br Amb2685188 [0,1,1,0,0,0|1,0,0]=3 5363 B11R1.156 O=C(O)c1c(F)cccc1Cl Amb2685950 [0,1,1,0,0,0|1,0,0]=3 5364 B11R1.156 O=C(O)c1c(F)cccc1F Amb534282 [0,1,1,0,0,0|1,0,0]=3 5365 B11R1.156 O=C(O)c1c(F)cccc1I Amb2688125 [0,1,1,0,0,0|1,0,0]=3 5366 B11R1.156 O=C(O)c1c(F)cccc1S Amb25045824 [0,1,1,0,0,0|1,0,0]=3 5367 B11R1.156 O=C(O)c1c(F)ccnc1Br Amb24399958 [0,1,1,0,0,0|2,0,0]=4 5368 B11R1.156 O=C(O)c1c(F)ccnc1Cl Amb22235871 [0,1,1,0,0,0|2,0,0]=4 5369 B11R1.156 O=C(O)c1c(F)ccnc1F Amb8389953 [0,1,1,0,0,0|2,0,0]=4 5370 B11R1.156 O=C(O)c1c(F)ccnc1I Amb28384652 [0,1,1,0,0,0|2,0,0]=4 5371 B11R1.156 O=C(O)c1c(F)ccnc1O Amb26532620 [0,1,1,0,0,0|2,0,0]=4 5372 B11R1.156 O=C(O)c1c(F)cncc1Br Amb20247164 [0,1,1,0,0,0|2,0,0]=4 5373 B11R1.156 O=C(O)c1c(F)cncc1Cl Amb21964673 [0,1,1,0,0,0|2,0,0]=4 5374 B11R1.156 O=C(O)c1c(F)cncc1F Amb8010832 [0,1,1,0,0,0|2,0,0]=4 5375 B11R1.156 O=C(O)c1c(F)cncc1I Amb26894638 [0,1,1,0,0,0|2,0,0]=4 5376 B11R1.156 O=C(O)c1c(I)cccc1I Amb26350232 [0,1,1,0,0,0|1,0,0]=3 5377 B11R1.156 O=C(O)c1c(I)ccnc1Cl Amb4560934 [0,1,1,0,0,0|2,0,0]=4 5378 B11R1.156 O=C(O)c1c(I)ccnc1F Amb10603599 [0,1,1,0,0,0|2,0,0]=4 5379 B11R1.156 O=C(O)c1c(I)cncc1I Amb27843645 [0,1,1,0,0,0|2,0,0]=4 5380 B11R1.156 O=C(O)c1c(O)cccc1Br Amb10842167 [0,1,1,0,0,0|1,0,0]=3 5381 B11R1.156 O=C(O)c1c(O)cccc1Cl Amb33531272 [0,1,1,0,0,0|1,0,0]=3 5382 B11R1.156 O=C(O)c1c(O)cccc1F Amb2688417 [0,1,1,0,0,0|1,0,0]=3 5383 B11R1.156 O=C(O)c1c(O)cccc1I Amb22737636 [0,1,1,0,0,0|1,0,0]=3 5384 B11R1.156 O=C(O)c1c(O)cccc1O Amb534793 [0,1,1,0,0,0|1,0,0]=3 5385 B11R1.156 O=C(O)c1c(O)cccc1S Amb28244781 [0,1,1,0,0,0|1,0,0]=3 5386 B11R1.156 O=C(O)c1c(O)ccnc1Br Amb10070849 [0,1,1,0,0,0|2,0,0]=4 5387 B11R1.156 O=C(O)c1c(O)cncc1F Amb25348423 [0,1,1,0,0,0|2,0,0]=4 5388 B11R1.156 O=C(O)c1c(O)cncc1O Amb27965725 [0,1,1,0,0,0|2,0,0]=4 5389 B11R1.156 O=C(O)c1c(S)cccc1Br Amb18133856 [0,1,1,0,0,0|1,0,0]=3 5390 B11R1.156 O=C(O)c1c(S)cccc1I Amb24395228 [0,1,1,0,0,0|1,0,0]=3 5391 B11R1.156 O=C(O)c1c(S)cccc1S Amb27657798 [0,1,1,0,0,0|1,0,0]=3 5392 B11R1.156 O=C([O-])c1c(Cl)cccc1Cl Amb16185733 [0,1,1,0,0,0|1,0,1]=4 5393 B11R1.156 O=C([O-])c1c(F)cccc1F Amb8397069 [0,1,1,0,0,0|1,0,1]=4 5394 B11R1.156 [2H]c1cccc([2H])c1C(=O)O Amb22325326 [0,1,1,0,0,0|1,0,0]=3 5395 B11R1.156 [NH3+]c1cccc(F)c1C(=O)O Amb22641606 [0,1,1,0,0,0|1,0,0]=3 5396 B11R1.159 CC(=O)C1=C(C)C(=O)NC=C1 Amb27831707 [0,1,1,0,0,0|2,0,0]=4 5397 B11R1.159 CC(=O)C1=CC=CC(=O)C1=O Amb25099532 [0,1,1,0,0,0|2,0,0]=4 5398 B11R1.159 CC(=O)c1cccc(Br)c1Br Amb22388344 [0,1,1,0,0,0|2,0,0]=4 5399 B11R1.159 CC(=O)c1cccc(Br)c1C Amb22749778 [0,1,1,0,0,0|1,0,0]=3 5400 B11R1.159 CC(=O)c1cccc(Br)c1Cl Amb24056465 [0,1,1,0,0,0|2,0,0]=4 5401 B11R1.159 CC(=O)c1cccc(Br)c1F Amb8397102 [0,1,1,0,0,0|2,0,0]=4 5402 B11R1.159 CC(=O)c1cccc(Br)c1I Amb22388346 [0,1,1,0,0,0|2,0,0]=4 5403 B11R1.159 CC(=O)c1cccc(Br)c1N Amb8383849 [0,1,1,0,0,0|2,0,0]=4 5404 B11R1.159 CC(=O)c1cccc(Br)c1O Amb19895168 [0,1,1,0,0,0|2,0,0]=4 5405 B11R1.159 CC(=O)c1cccc(C)c1Br Amb22749800 [0,1,1,0,0,0|2,0,0]=4 5406 B11R1.159 CC(=O)c1cccc(C)c1C Amb17232041 [0,1,1,0,0,0|1,0,0]=3 5407 B11R1.159 CC(=O)c1cccc(C)c1Cl Amb24439010 [0,1,1,0,0,0|2,0,0]=4 5408 B11R1.159 CC(=O)c1cccc(C)c1F Amb24055916 [0,1,1,0,0,0|2,0,0]=4 5409 B11R1.159 CC(=O)c1cccc(C)c1I Amb27156870 [0,1,1,0,0,0|2,0,0]=4 5410 B11R1.159 CC(=O)c1cccc(C)c1N Amb18124985 [0,1,1,0,0,0|2,0,0]=4 5411 B11R1.159 CC(=O)c1cccc(C)c1O Amb1489192 [0,1,1,0,0,0|2,0,0]=4 5412 B11R1.159 CC(=O)c1cccc(Cl)c1Br Amb22737646 [0,1,1,0,0,0|2,0,0]=4 5413 B11R1.159 CC(=O)c1cccc(Cl)c1C Amb17334749 [0,1,1,0,0,0|1,0,0]=3 5414 B11R1.159 CC(=O)c1cccc(Cl)c1Cl Amb2726181 [0,1,1,0,0,0|2,0,0]=4 5415 B11R1.159 CC(=O)c1cccc(Cl)c1F Amb10807869 [0,1,1,0,0,0|2,0,0]=4 5416 B11R1.159 CC(=O)c1cccc(Cl)c1N Amb22831092 [0,1,1,0,0,0|2,0,0]=4 5417 B11R1.159 CC(=O)c1cccc(Cl)c1O Amb844172 [0,1,1,0,0,0|2,0,0]=4 5418 B11R1.159 CC(=O)c1cccc(F)c1Br Amb22388343 [0,1,1,0,0,0|2,0,0]=4 5419 B11R1.159 CC(=O)c1cccc(F)c1C Amb22047668 [0,1,1,0,0,0|1,0,0]=3 5420 B11R1.159 CC(=O)c1cccc(F)c1Cl Amb20171471 [0,1,1,0,0,0|2,0,0]=4 5421 B11R1.159 CC(=O)c1cccc(F)c1F Amb2687033 [0,1,1,0,0,0|2,0,0]=4 5422 B11R1.159 CC(=O)c1cccc(F)c1N Amb22500712 [0,1,1,0,0,0|2,0,0]=4 5423 B11R1.159 CC(=O)c1cccc(F)c1O Amb10603316 [0,1,1,0,0,0|2,0,0]=4 5424 B11R1.159 CC(=O)c1cccc(I)c1Br Amb22388345 [0,1,1,0,0,0|2,0,0]=4 5425 B11R1.159 CC(=O)c1cccc(I)c1Cl Amb25922927 [0,1,1,0,0,0|2,0,0]=4 5426 B11R1.159 CC(=O)c1cccc(I)c1F Amb26648997 [0,1,1,0,0,0|2,0,0]=4 5427 B11R1.159 CC(=O)c1cccc(I)c1N Amb24416564 [0,1,1,0,0,0|2,0,0]=4 5428 B11R1.159 CC(=O)c1cccc(N)c1Br Amb25116979 [0,1,1,0,0,0|2,0,0]=4 5429 B11R1.159 CC(=O)c1cccc(N)c1C Amb22001728 [0,1,1,0,0,0|1,0,0]=3 5430 B11R1.159 CC(=O)c1cccc(N)c1F Amb23401088 [0,1,1,0,0,0|2,0,0]=4 5431 B11R1.159 CC(=O)c1cccc(N)c1N Amb24351134 [0,1,1,0,0,0|2,0,0]=4 5432 B11R1.159 CC(=O)c1cccc(N)c1O Amb32653166 [0,1,1,0,0,0|2,0,0]=4 5433 B11R1.159 CC(=O)c1cccc(N)c1O Amb6297076 [0,1,1,0,0,0|2,0,0]=4 5434 B11R1.159 CC(=O)c1cccc(N)c1O Amb8391120 [0,1,1,0,0,0|2,0,0]=4 5435 B11R1.159 CC(=O)c1cccc(O)c1Br Amb20240870 [0,1,1,0,0,0|2,0,0]=4 5436 B11R1.159 CC(=O)c1cccc(O)c1C Amb22752432 [0,1,1,0,0,0|1,0,0]=3 5437 B11R1.159 CC(=O)c1cccc(O)c1Cl Amb18126735 [0,1,1,0,0,0|2,0,0]=4 5438 B11R1.159 CC(=O)c1cccc(O)c1F Amb22735577 [0,1,1,0,0,0|2,0,0]=4 5439 B11R1.159 CC(=O)c1cccc(O)c1N Amb18125233 [0,1,1,0,0,0|2,0,0]=4 5440 B11R1.159 CC(=O)c1cccc(O)c1O Amb10603302 [0,1,1,0,0,0|2,0,0]=4 5441 B11R1.159 CC(=O)c1ccnc(C)c1C Amb8439143 [0,1,1,0,0,0|2,0,0]=4 5442 B11R1.159 CC(=O)c1ccnc(Cl)c1C Amb26353885 [0,1,1,0,0,0|2,0,0]=4 5443 B11R1.159 CC(=O)c1cncc(Br)c1C Amb28386253 [0,1,1,0,0,0|2,0,0]=4 5444 B11R1.159 CC(=O)c1cncc(C)c1C Amb26616883 [0,1,1,0,0,0|2,0,0]=4 5445 B11R1.159 CC(=O)c1cncc(O)c1C Amb28292640 [0,1,1,0,0,0|2,0,0]=4 5446 B11R1.159 CC(=O)c1nccc(Cl)c1C Amb27494017 [0,1,1,0,0,0|2,0,0]=4 5447 B11R1.159 CC1=C(C(=O)O)C=CNC1=O Amb18201188 [0,1,1,0,0,0|1,0,0]=3 5448 B11R1.159 CC1=CNC=C(C(=O)O)C1=O Amb18644554 [0,1,1,0,0,0|2,0,0]=4 5449 B11R1.159 CN1C(=O)C=CC=C1C(=O)Cl Amb25028067 [0,1,1,0,0,0|2,0,0]=4 5450 B11R1.159 CN1C(=O)C=CC=C1C(=O)O Amb18644552 [0,1,1,0,0,0|1,0,0]=3 5451 B11R1.159 CN1C(=O)C=CC=C1C(N)=O Amb22494719 [0,1,1,0,0,0|2,0,0]=4 5452 B11R1.159 CN1C(=O)N=CC=C1C(=O)O Amb27847157 [0,1,1,0,0,0|2,0,0]=4 5453 B11R1.159 CN1C=CC=C(C(=O)O)C1=N Amb25692700 [0,1,1,0,0,0|2,0,0]=4 5454 B11R1.159 CN1C=CC=C(C(=O)O)C1=O Amb18038520 [0,1,1,0,0,0|2,0,0]=4 5455 B11R1.159 Cc1c(Br)cccc1B(O)O Amb26348867 [0,1,1,0,0,0|1,0,1]=4 5456 B11R1.159 Cc1c(Br)cccc1C(=N)N Amb25050579 [0,1,1,0,0,0|2,0,0]=4 5457 B11R1.159 Cc1c(Br)cccc1C(=O)Cl Amb10071933 [0,1,1,0,0,0|1,0,0]=3 5458 B11R1.159 Cc1c(Br)cccc1C(=O)O Amb2685317 [0,1,1,0,0,0|0,0,0]=2 5459 B11R1.159 Cc1c(Br)cccc1C(N)=O Amb22500180 [0,1,1,0,0,0|1,0,0]=3 5460 B11R1.159 Cc1c(Br)cccc1C(N)=S Amb26932121 [0,1,1,0,0,0|1,1,0]=4 5461 B11R1.159 Cc1c(Br)cccc1S(=O)[O-] Amb28314443 [0,1,1,0,0,0|1,0,1]=4 5462 B11R1.159 Cc1c(Br)cccc1[C@@H](C)O Amb33389329 [0,1,1,0,0,0|1,0,1]=4 5463 B11R1.159 Cc1c(Br)cccc1[C@H](C)O Amb33389333 [0,1,1,0,0,0|1,0,1]=4 5464 B11R1.159 Cc1c(Br)cccc1[N+](=O)[O-] Amb2781391 [0,1,1,0,0,0|1,0,1]=4 5465 B11R1.159 Cc1c(Br)ccnc1C(=O)O Amb22235363 [0,1,1,0,0,0|1,0,0]=3 5466 B11R1.159 Cc1c(Br)cncc1C(=O)O Amb33549170 [0,1,1,0,0,0|1,0,0]=3 5467 B11R1.159 Cc1c(Br)cncc1C(N)=O Amb2796183 [0,1,1,0,0,0|2,0,0]=4 5468 B11R1.159 Cc1c(C(=O)O)ccnc1Br Amb26926306 [0,1,1,0,0,0|1,0,0]=3 5469 B11R1.159 Cc1c(C(=O)O)ccnc1Cl Amb21857079 [0,1,1,0,0,0|1,0,0]=3 5470 B11R1.159 Cc1c(C(=O)O)ccnc1F Amb25060588 [0,1,1,0,0,0|1,0,0]=3 5471 B11R1.159 Cc1c(C(N)=O)ccnc1Cl Amb25087082 [0,1,1,0,0,0|2,0,0]=4 5472 B11R1.159 Cc1c(Cl)cccc1B(O)O Amb8839223 [0,1,1,0,0,0|1,0,1]=4 5473 B11R1.159 Cc1c(Cl)cccc1C(=N)N Amb2696069 [0,1,1,0,0,0|2,0,0]=4 5474 B11R1.159 Cc1c(Cl)cccc1C(=O)Cl Amb19891035 [0,1,1,0,0,0|1,0,0]=3 5475 B11R1.159 Cc1c(Cl)cccc1C(=O)O Amb6366012 [0,1,1,0,0,0|0,0,0]=2 5476 B11R1.159 Cc1c(Cl)cccc1C(C)O Amb26981735 [0,1,1,0,0,0|1,0,1]=4 5477 B11R1.159 Cc1c(Cl)cccc1C(N)=O Amb17334782 [0,1,1,0,0,0|1,0,0]=3 5478 B11R1.159 Cc1c(Cl)cccc1C(O)=S Amb26611312 [0,1,1,0,0,0|0,1,0]=3 5479 B11R1.159 Cc1c(Cl)cccc1N(=O)=O Amb6365760 [0,1,1,0,0,0|1,0,1]=4 5480 B11R1.159 Cc1c(Cl)cccc1S(=O)[O-] Amb19944421 [0,1,1,0,0,0|1,0,1]=4 5481 B11R1.159 Cc1c(Cl)cccc1[N+](=O)[O-] Amb2686305 [0,1,1,0,0,0|1,0,1]=4 5482 B11R1.159 Cc1c(Cl)ccnc1C(=O)O Amb22295947 [0,1,1,0,0,0|1,0,0]=3 5483 B11R1.159 Cc1c(Cl)ccnc1C(N)=O Amb27193540 [0,1,1,0,0,0|2,0,0]=4 5484 B11R1.159 Cc1c(Cl)cncc1C(=O)O Amb2796174 [0,1,1,0,0,0|1,0,0]=3 5485 B11R1.159 Cc1c(Cl)cncc1C(N)=O Amb2796182 [0,1,1,0,0,0|2,0,0]=4 5486 B11R1.159 Cc1c(F)cccc1B(O)O Amb18796749 [0,1,1,0,0,0|1,0,1]=4 5487 B11R1.159 Cc1c(F)cccc1C(=N)N Amb33428035 [0,1,1,0,0,0|2,0,0]=4 5488 B11R1.159 Cc1c(F)cccc1C(=O)Cl Amb10838420 [0,1,1,0,0,0|1,0,0]=3 5489 B11R1.159 Cc1c(F)cccc1C(=O)O Amb3940032 [0,1,1,0,0,0|0,0,0]=2 5490 B11R1.159 Cc1c(F)cccc1C(C)O Amb27254195 [0,1,1,0,0,0|1,0,1]=4 5491 B11R1.159 Cc1c(F)cccc1C(N)=O Amb22493880 [0,1,1,0,0,0|1,0,0]=3 5492 B11R1.159 Cc1c(F)cccc1C(N)=S Amb26948654 [0,1,1,0,0,0|1,1,0]=4 5493 B11R1.159 Cc1c(F)cccc1C(O)=S Amb27823459 [0,1,1,0,0,0|0,1,0]=3 5494 B11R1.159 Cc1c(F)cccc1N(=O)=O Amb20621368 [0,1,1,0,0,0|1,0,1]=4 5495 B11R1.159 Cc1c(F)cccc1S(=O)[O-] Amb26506078 [0,1,1,0,0,0|1,0,1]=4 5496 B11R1.159 Cc1c(F)cccc1[C@@H](C)O Amb33372720 [0,1,1,0,0,0|1,0,1]=4 5497 B11R1.159 Cc1c(F)cccc1[C@H](C)O Amb33372718 [0,1,1,0,0,0|1,0,1]=4 5498 B11R1.159 Cc1c(F)cccc1[N+](=O)[O-] Amb2688274 [0,1,1,0,0,0|1,0,1]=4 5499 B11R1.159 Cc1c(F)ccnc1C(=O)O Amb25152788 [0,1,1,0,0,0|1,0,0]=3 5500 B11R1.159 Cc1c(I)cccc1B(O)O Amb27782356 [0,1,1,0,0,0|1,0,1]=4 5501 B11R1.159 Cc1c(I)cccc1C(=O)Cl Amb27239829 [0,1,1,0,0,0|1,0,0]=3 5502 B11R1.159 Cc1c(I)cccc1C(=O)O Amb2688855 [0,1,1,0,0,0|0,0,0]=2 5503 B11R1.159 Cc1c(I)cccc1C(N)=O Amb23491823 [0,1,1,0,0,0|1,0,0]=3 5504 B11R1.159 Cc1c(I)cccc1[N+](=O)[O-] Amb6306639 [0,1,1,0,0,0|1,0,1]=4 5505 B11R1.159 Cc1c(N)cccc1B(O)O Amb30869302 [0,1,1,0,0,0|1,0,1]=4 5506 B11R1.159 Cc1c(N)cccc1C(=O)O Amb3618855 [0,1,1,0,0,0|0,0,0]=2 5507 B11R1.159 Cc1c(N)cccc1C(=O)[O-] Amb33512950 [0,1,1,0,0,0|0,0,1]=3 5508 B11R1.159 Cc1c(N)cccc1C(C)O Amb27600757 [0,1,1,0,0,0|1,0,1]=4 5509 B11R1.159 Cc1c(N)cccc1C(N)=O Amb1101136 [0,1,1,0,0,0|1,0,0]=3 5510 B11R1.159 Cc1c(N)cccc1C(N)=S Amb27879826 [0,1,1,0,0,0|1,1,0]=4 5511 B11R1.159 Cc1c(N)cccc1C(O)=S Amb25863584 [0,1,1,0,0,0|0,1,0]=3 5512 B11R1.159 Cc1c(N)cccc1N(=O)=O Amb20621646 [0,1,1,0,0,0|1,0,1]=4 5513 B11R1.159 Cc1c(N)cccc1[N+](=O)[O-] Amb2609958 [0,1,1,0,0,0|1,0,1]=4 5514 B11R1.159 Cc1c(N)ccnc1C(=O)O Amb22522203 [0,1,1,0,0,0|1,0,0]=3 5515 B11R1.159 Cc1c(N)cncc1C(=O)O Amb2796176 [0,1,1,0,0,0|1,0,0]=3 5516 B11R1.159 Cc1c(O)cccc1B(O)O Amb25373981 [0,1,1,0,0,0|1,0,1]=4 5517 B11R1.159 Cc1c(O)cccc1C(=N)N Amb27839931 [0,1,1,0,0,0|2,0,0]=4 5518 B11R1.159 Cc1c(O)cccc1C(=O)Cl Amb24433257 [0,1,1,0,0,0|1,0,0]=3 5519 B11R1.159 Cc1c(O)cccc1C(=O)O Amb8384204 [0,1,1,0,0,0|0,0,0]=2 5520 B11R1.159 Cc1c(O)cccc1C(=O)[O-] Amb33512958 [0,1,1,0,0,0|0,0,1]=3 5521 B11R1.159 Cc1c(O)cccc1C(N)=S Amb27494767 [0,1,1,0,0,0|1,1,0]=4 5522 B11R1.159 Cc1c(O)cccc1C(O)=S Amb25359964 [0,1,1,0,0,0|0,1,0]=3 5523 B11R1.159 Cc1c(O)cccc1N(=O)=O Amb20621680 [0,1,1,0,0,0|1,0,1]=4 5524 B11R1.159 Cc1c(O)cccc1[N+](=O)[O-] Amb2721248 [0,1,1,0,0,0|1,0,1]=4 5525 B11R1.159 Cc1c(O)ccnc1C(=O)O Amb17615567 [0,1,1,0,0,0|1,0,0]=3 5526 B11R1.159 Cc1c(O)cncc1C(=O)O Amb25032540 [0,1,1,0,0,0|1,0,0]=3 5527 B11R1.159 Cc1c(O)ncnc1C(=O)O Amb19958666 [0,1,1,0,0,0|2,0,0]=4 5528 B11R1.159 Cc1c(S)cccc1C(=O)O Amb24487895 [0,1,1,0,0,0|0,0,0]=2 5529 B11R1.159 Cc1cccc(B(O)O)c1C Amb3939377 [0,1,1,0,0,0|1,0,1]=4 5530 B11R1.159 Cc1cccc(C(=N)N)c1C Amb2696679 [0,1,1,0,0,0|2,0,0]=4 5531 B11R1.159 Cc1cccc(C(=O)Cl)c1Br Amb19891061 [0,1,1,0,0,0|2,0,0]=4 5532 B11R1.159 Cc1cccc(C(=O)Cl)c1C Amb2726164 [0,1,1,0,0,0|1,0,0]=3 5533 B11R1.159 Cc1cccc(C(=O)Cl)c1Cl Amb19891040 [0,1,1,0,0,0|2,0,0]=4 5534 B11R1.159 Cc1cccc(C(=O)Cl)c1N Amb25892472 [0,1,1,0,0,0|2,0,0]=4 5535 B11R1.159 Cc1cccc(C(=O)O)[n+]1[O-] Amb1078520 [0,1,1,0,0,0|2,0,0]=4 5536 B11R1.159 Cc1cccc(C(=O)O)c1Br Amb2685314 [0,1,1,0,0,0|1,0,0]=3 5537 B11R1.159 Cc1cccc(C(=O)O)c1C Amb1207390 [0,1,1,0,0,0|0,0,0]=2 5538 B11R1.159 Cc1cccc(C(=O)O)c1Cl Amb2686192 [0,1,1,0,0,0|1,0,0]=3 5539 B11R1.159 Cc1cccc(C(=O)O)c1F Amb2735902 [0,1,1,0,0,0|1,0,0]=3 5540 B11R1.159 Cc1cccc(C(=O)O)c1I Amb1129052 [0,1,1,0,0,0|1,0,0]=3 5541 B11R1.159 Cc1cccc(C(=O)O)c1N Amb6358183 [0,1,1,0,0,0|1,0,0]=3 5542 B11R1.159 Cc1cccc(C(=O)O)c1O Amb6355878 [0,1,1,0,0,0|1,0,0]=3 5543 B11R1.159 Cc1cccc(C(=O)O)c1S Amb18126519 [0,1,1,0,0,0|1,0,0]=3 5544 B11R1.159 Cc1cccc(C(=O)[O-])c1O Amb10067431 [0,1,1,0,0,0|1,0,1]=4 5545 B11R1.159 Cc1cccc(C(C)O)c1C Amb16231821 [0,1,1,0,0,0|1,0,1]=4 5546 B11R1.159 Cc1cccc(C(N)=O)c1Br Amb21961825 [0,1,1,0,0,0|2,0,0]=4 5547 B11R1.159 Cc1cccc(C(N)=O)c1C Amb2726175 [0,1,1,0,0,0|1,0,0]=3 5548 B11R1.159 Cc1cccc(C(N)=O)c1F Amb20242781 [0,1,1,0,0,0|2,0,0]=4 5549 B11R1.159 Cc1cccc(C(N)=O)c1I Amb11480320 [0,1,1,0,0,0|2,0,0]=4 5550 B11R1.159 Cc1cccc(C(N)=O)c1N Amb1115779 [0,1,1,0,0,0|2,0,0]=4 5551 B11R1.159 Cc1cccc(C(N)=O)c1O Amb6671846 [0,1,1,0,0,0|2,0,0]=4 5552 B11R1.159 Cc1cccc(C(N)=S)c1C Amb18792710 [0,1,1,0,0,0|1,1,0]=4 5553 B11R1.159 Cc1cccc(C(O)=S)c1C Amb27663349 [0,1,1,0,0,0|0,1,0]=3 5554 B11R1.159 Cc1cccc(S(=O)O)c1F Amb27944385 [0,1,1,0,0,0|2,0,0]=4 5555 B11R1.159 Cc1cccc(S(=O)[O-])c1C Amb33069642 [0,1,1,0,0,0|1,0,1]=4 5556 B11R1.159 Cc1cccc([C@@H](C)O)c1C Amb29856727 [0,1,1,0,0,0|1,0,1]=4 5557 B11R1.159 Cc1cccc([C@H](C)O)c1C Amb29856726 [0,1,1,0,0,0|1,0,1]=4 5558 B11R1.159 Cc1cccc([N+](=O)[O-])c1C Amb4037120 [0,1,1,0,0,0|1,0,1]=4 5559 B11R1.159 Cc1ccnc(C(=O)O)c1N Amb25891433 [0,1,1,0,0,0|2,0,0]=4 5560 B11R1.159 Cc1ccnc(C(=O)O)c1O Amb25359831 [0,1,1,0,0,0|2,0,0]=4 5561 B11R1.159 Cc1ccnc(C(=O)O)c1O Amb32671475 [0,1,1,0,0,0|2,0,0]=4 5562 B11R1.159 Cc1cncc(C(=O)O)c1Br Amb25923254 [0,1,1,0,0,0|2,0,0]=4 5563 B11R1.159 Cc1cncc(C(=O)O)c1C Amb24433875 [0,1,1,0,0,0|1,0,0]=3 5564 B11R1.159 Cc1cncc(C(=O)O)c1Cl Amb25064626 [0,1,1,0,0,0|2,0,0]=4 5565 B11R1.159 Cc1cncc(C(=O)O)c1F Amb27232688 [0,1,1,0,0,0|2,0,0]=4 5566 B11R1.159 Cc1nccc(C(=O)O)c1Br Amb18171437 [0,1,1,0,0,0|2,0,0]=4 5567 B11R1.159 Cc1nccc(C(=O)O)c1C Amb24101629 [0,1,1,0,0,0|1,0,0]=3 5568 B11R1.159 Cc1nccc(C(=O)O)c1Cl Amb18198383 [0,1,1,0,0,0|2,0,0]=4 5569 B11R1.159 Cc1nccc(C(=O)O)c1F Amb18830927 [0,1,1,0,0,0|2,0,0]=4 5570 B11R1.159 Cc1nccc(C(=O)O)c1N Amb18201419 [0,1,1,0,0,0|2,0,0]=4 5571 B11R1.159 Cc1nccc(C(=O)O)c1O Amb18125511 [0,1,1,0,0,0|2,0,0]=4 5572 B11R1.159 Cc1nccc(C(=O)O)c1O Amb35788655 [0,1,1,0,0,0|2,0,0]=4 5573 B11R1.159 Cc1ncnc(C(=O)O)c1C Amb18201457 [0,1,1,0,0,0|2,0,0]=4 5574 B11R1.159 N=C1C=CC=C(C(=O)O)C1=N Amb27849034 [0,1,1,0,0,0|1,0,0]=3 5575 B11R1.159 NC(=O)c1cccc(Br)c1Cl Amb24483938 [0,1,1,0,0,0|2,0,0]=4 5576 B11R1.159 NC(=O)c1cccc(Br)c1F Amb16185959 [0,1,1,0,0,0|2,0,0]=4 5577 B11R1.159 NC(=O)c1cccc(Br)c1I Amb27606491 [0,1,1,0,0,0|2,0,0]=4 5578 B11R1.159 NC(=O)c1cccc(Br)c1N Amb18938136 [0,1,1,0,0,0|2,0,0]=4 5579 B11R1.159 NC(=O)c1cccc(Br)c1O Amb22501164 [0,1,1,0,0,0|2,0,0]=4 5580 B11R1.159 NC(=O)c1cccc(Cl)c1Br Amb19888114 [0,1,1,0,0,0|2,0,0]=4 5581 B11R1.159 NC(=O)c1cccc(Cl)c1Cl Amb2726211 [0,1,1,0,0,0|2,0,0]=4 5582 B11R1.159 NC(=O)c1cccc(Cl)c1F Amb2779420 [0,1,1,0,0,0|2,0,0]=4 5583 B11R1.159 NC(=O)c1cccc(Cl)c1I Amb25149015 [0,1,1,0,0,0|2,0,0]=4 5584 B11R1.159 NC(=O)c1cccc(Cl)c1N Amb18126739 [0,1,1,0,0,0|2,0,0]=4 5585 B11R1.159 NC(=O)c1cccc(Cl)c1O Amb25173632 [0,1,1,0,0,0|2,0,0]=4 5586 B11R1.159 NC(=O)c1cccc(F)c1Cl Amb2685932 [0,1,1,0,0,0|2,0,0]=4 5587 B11R1.159 NC(=O)c1cccc(F)c1F Amb2687049 [0,1,1,0,0,0|2,0,0]=4 5588 B11R1.159 NC(=O)c1cccc(F)c1I Amb25890741 [0,1,1,0,0,0|2,0,0]=4 5589 B11R1.159 NC(=O)c1cccc(F)c1N Amb18280274 [0,1,1,0,0,0|2,0,0]=4 5590 B11R1.159 NC(=O)c1cccc(I)c1Br Amb26938725 [0,1,1,0,0,0|2,0,0]=4 5591 B11R1.159 NC(=O)c1cccc(I)c1Cl Amb27245043 [0,1,1,0,0,0|2,0,0]=4 5592 B11R1.159 NC(=O)c1cccc(I)c1F Amb23402051 [0,1,1,0,0,0|2,0,0]=4 5593 B11R1.159 NC(=O)c1cccc(I)c1N Amb25780415 [0,1,1,0,0,0|2,0,0]=4 5594 B11R1.159 NC(=O)c1cccc(I)c1O Amb27600668 [0,1,1,0,0,0|2,0,0]=4 5595 B11R1.159 NC(=O)c1cccc(N)c1Br Amb26917813 [0,1,1,0,0,0|2,0,0]=4 5596 B11R1.159 NC(=O)c1cccc(N)c1Cl Amb26873377 [0,1,1,0,0,0|2,0,0]=4 5597 B11R1.159 NC(=O)c1cccc(N)c1F Amb23437240 [0,1,1,0,0,0|2,0,0]=4 5598 B11R1.159 NC(=O)c1cccc(N)c1N Amb22490733 [0,1,1,0,0,0|2,0,0]=4 5599 B11R1.159 NC(=O)c1cccc(N)c1N Amb8388410 [0,1,1,0,0,0|2,0,0]=4 5600 B11R1.159 NC(=O)c1cccc(O)c1Br Amb28368390 [0,1,1,0,0,0|2,0,0]=4 5601 B11R1.159 NC(=O)c1cccc(O)c1Cl Amb27398023 [0,1,1,0,0,0|2,0,0]=4 5602 B11R1.159 NC(=O)c1cccc(O)c1F Amb24084164 [0,1,1,0,0,0|2,0,0]=4 5603 B11R1.159 NC(=O)c1cccc(O)c1I Amb25095926 [0,1,1,0,0,0|2,0,0]=4 5604 B11R1.159 NC(=O)c1cccc(O)c1N Amb22500704 [0,1,1,0,0,0|2,0,0]=4 5605 B11R1.159 NC(=O)c1cccc(O)c1O Amb25783945 [0,1,1,0,0,0|2,0,0]=4 5606 B11R1.159 NC1=C(C(=O)O)C=CNC1=O Amb18200856 [0,1,1,0,0,0|2,0,0]=4 5607 B11R1.159 Nc1c(Br)cccc1C(=O)Cl Amb27397591 [0,1,1,0,0,0|2,0,0]=4 5608 B11R1.159 Nc1c(Br)cccc1C(=O)O Amb2724966 [0,1,1,0,0,0|1,0,0]=3 5609 B11R1.159 Nc1c(Br)cncc1C(=O)O Amb16231949 [0,1,1,0,0,0|2,0,0]=4 5610 B11R1.159 Nc1c(Br)cncc1C(=O)O Amb33330853 [0,1,1,0,0,0|2,0,0]=4 5611 B11R1.159 Nc1c(C(=O)O)ccc[n+]1[O-] Amb27207845 [0,1,1,0,0,0|2,0,0]=4 5612 B11R1.159 Nc1c(C(=O)O)ccnc1Br Amb23557559 [0,1,1,0,0,0|2,0,0]=4 5613 B11R1.159 Nc1c(C(=O)O)ccnc1Cl Amb21963396 [0,1,1,0,0,0|2,0,0]=4 5614 B11R1.159 Nc1c(C(=O)O)ccnc1F Amb26494419 [0,1,1,0,0,0|2,0,0]=4 5615 B11R1.159 Nc1c(C(=O)O)ccnc1S Amb18198916 [0,1,1,0,0,0|2,0,0]=4 5616 B11R1.159 Nc1c(Cl)cccc1C(=O)Cl Amb26853722 [0,1,1,0,0,0|2,0,0]=4 5617 B11R1.159 Nc1c(Cl)cccc1C(=O)O Amb1223239 [0,1,1,0,0,0|1,0,0]=3 5618 B11R1.159 Nc1c(Cl)ccnc1C(=O)O Amb27464699 [0,1,1,0,0,0|2,0,0]=4 5619 B11R1.159 Nc1c(Cl)cncc1C(=O)O Amb16231950 [0,1,1,0,0,0|2,0,0]=4 5620 B11R1.159 Nc1c(F)cccc1C(=O)O Amb2608596 [0,1,1,0,0,0|1,0,0]=3 5621 B11R1.159 Nc1c(F)ccnc1C(=O)O Amb25976565 [0,1,1,0,0,0|2,0,0]=4 5622 B11R1.159 Nc1c(F)cncc1C(=O)O Amb22498564 [0,1,1,0,0,0|2,0,0]=4 5623 B11R1.159 Nc1c(I)cccc1C(=O)O Amb7784298 [0,1,1,0,0,0|1,0,0]=3 5624 B11R1.159 Nc1c(I)cncc1C(=O)O Amb22498559 [0,1,1,0,0,0|2,0,0]=4 5625 B11R1.159 Nc1c(O)cccc1C(=O)O Amb4418489 [0,1,1,0,0,0|1,0,0]=3 5626 B11R1.159 Nc1c(O)cccc1C(=O)O Amb6296629 [0,1,1,0,0,0|1,0,0]=3 5627 B11R1.159 Nc1c(S)cccc1C(=O)O Amb18938265 [0,1,1,0,0,0|1,0,0]=3 5628 B11R1.159 Nc1cccc(C(=O)Cl)c1Br Amb25288987 [0,1,1,0,0,0|2,0,0]=4 5629 B11R1.159 Nc1cccc(C(=O)Cl)c1I Amb28048811 [0,1,1,0,0,0|2,0,0]=4 5630 B11R1.159 Nc1cccc(C(=O)O)c1Br Amb10842077 [0,1,1,0,0,0|1,0,0]=3 5631 B11R1.159 Nc1cccc(C(=O)O)c1Cl Amb6296789 [0,1,1,0,0,0|1,0,0]=3 5632 B11R1.159 Nc1cccc(C(=O)O)c1F Amb6298253 [0,1,1,0,0,0|1,0,0]=3 5633 B11R1.159 Nc1cccc(C(=O)O)c1I Amb10842076 [0,1,1,0,0,0|1,0,0]=3 5634 B11R1.159 Nc1cccc(C(=O)O)c1N Amb1094141 [0,1,1,0,0,0|1,0,0]=3 5635 B11R1.159 Nc1cccc(C(=O)O)c1N Amb22283993 [0,1,1,0,0,0|1,0,0]=3 5636 B11R1.159 Nc1cccc(C(=O)O)c1O Amb1043752 [0,1,1,0,0,0|1,0,0]=3 5637 B11R1.159 Nc1cccc(C(=O)O)c1S Amb24710021 [0,1,1,0,0,0|1,0,0]=3 5638 B11R1.159 Nc1ccnc(C(=O)O)c1Br Amb26568178 [0,1,1,0,0,0|2,0,0]=4 5639 B11R1.159 Nc1ccnc(C(=O)O)c1Cl Amb2697545 [0,1,1,0,0,0|2,0,0]=4 5640 B11R1.159 Nc1ccnc(C(=O)O)c1Cl Amb33620571 [0,1,1,0,0,0|2,0,0]=4 5641 B11R1.159 Nc1ccnc(C(=O)O)c1F Amb26575255 [0,1,1,0,0,0|2,0,0]=4 5642 B11R1.159 Nc1ccnc(C(=O)O)c1N Amb27172292 [0,1,1,0,0,0|2,0,0]=4 5643 B11R1.159 Nc1ccnc(C(=O)O)c1O Amb27186184 [0,1,1,0,0,0|2,0,0]=4 5644 B11R1.159 Nc1cncc(C(=O)O)c1Br Amb27769161 [0,1,1,0,0,0|2,0,0]=4 5645 B11R1.159 Nc1cncc(C(=O)O)c1Cl Amb25681892 [0,1,1,0,0,0|2,0,0]=4 5646 B11R1.159 Nc1cncc(C(=O)O)c1F Amb27864484 [0,1,1,0,0,0|2,0,0]=4 5647 B11R1.159 Nc1cncc(C(=O)O)c1N Amb25715266 [0,1,1,0,0,0|2,0,0]=4 5648 B11R1.159 Nc1nccc(C(=O)O)c1Br Amb26867994 [0,1,1,0,0,0|2,0,0]=4 5649 B11R1.159 Nc1nccc(C(=O)O)c1Cl Amb26328860 [0,1,1,0,0,0|2,0,0]=4 5650 B11R1.159 Nc1nccc(C(=O)O)c1F Amb25891413 [0,1,1,0,0,0|2,0,0]=4 5651 B11R1.159 Nc1nccc(C(=O)O)c1N Amb17097726 [0,1,1,0,0,0|2,0,0]=4 5652 B11R1.159 Nc1nccc(C(=O)O)c1N Amb28652871 [0,1,1,0,0,0|2,0,0]=4 5653 B11R1.159 O=C(Cl)c1cccc(Br)c1Cl Amb19891050 [0,1,1,0,0,0|2,0,0]=4 5654 B11R1.159 O=C(Cl)c1cccc(Br)c1F Amb10841630 [0,1,1,0,0,0|2,0,0]=4 5655 B11R1.159 O=C(Cl)c1cccc(Br)c1I Amb28071262 [0,1,1,0,0,0|2,0,0]=4 5656 B11R1.159 O=C(Cl)c1cccc(Br)c1O Amb27230332 [0,1,1,0,0,0|2,0,0]=4 5657 B11R1.159 O=C(Cl)c1cccc(Cl)c1Br Amb5717846 [0,1,1,0,0,0|2,0,0]=4 5658 B11R1.159 O=C(Cl)c1cccc(Cl)c1Cl Amb3939567 [0,1,1,0,0,0|2,0,0]=4 5659 B11R1.159 O=C(Cl)c1cccc(Cl)c1F Amb2685966 [0,1,1,0,0,0|2,0,0]=4 5660 B11R1.159 O=C(Cl)c1cccc(Cl)c1I Amb25679035 [0,1,1,0,0,0|2,0,0]=4 5661 B11R1.159 O=C(Cl)c1cccc(F)c1Br Amb10841629 [0,1,1,0,0,0|2,0,0]=4 5662 B11R1.159 O=C(Cl)c1cccc(F)c1Cl Amb19888084 [0,1,1,0,0,0|2,0,0]=4 5663 B11R1.159 O=C(Cl)c1cccc(F)c1F Amb2687084 [0,1,1,0,0,0|2,0,0]=4 5664 B11R1.159 O=C(Cl)c1cccc(F)c1I Amb28072552 [0,1,1,0,0,0|2,0,0]=4 5665 B11R1.159 O=C(Cl)c1cccc(I)c1Br Amb27258019 [0,1,1,0,0,0|2,0,0]=4 5666 B11R1.159 O=C(Cl)c1cccc(I)c1Cl Amb25691464 [0,1,1,0,0,0|2,0,0]=4 5667 B11R1.159 O=C(Cl)c1cccc(I)c1F Amb26421605 [0,1,1,0,0,0|2,0,0]=4 5668 B11R1.159 O=C(Cl)c1cccc(O)c1Br Amb25270679 [0,1,1,0,0,0|2,0,0]=4 5669 B11R1.159 O=C(Cl)c1cccc(O)c1Cl Amb28062958 [0,1,1,0,0,0|2,0,0]=4 5670 B11R1.159 O=C(Cl)c1cccc(O)c1F Amb28195871 [0,1,1,0,0,0|2,0,0]=4 5671 B11R1.159 O=C(F)c1cccc(Cl)c1F Amb10839928 [0,1,1,0,0,0|2,0,0]=4 5672 B11R1.159 O=C(O)C1=C(O)C(=O)C=CO1 Amb27400361 [0,1,1,0,0,0|2,0,0]=4 5673 B11R1.159 O=C(O)C1=C(O)C(=O)NC=C1 Amb18200553 [0,1,1,0,0,0|2,0,0]=4 5674 B11R1.159 O=C(O)C1=CC=CC(=O)N1O Amb19959009 [0,1,1,0,0,0|2,0,0]=4 5675 B11R1.159 O=C(O)C1=CC=CC(=S)N1O Amb28124200 [0,1,1,0,0,0|2,0,0]=4 5676 B11R1.159 O=C(O)C1=CC=CN(O)C1=O Amb18038305 [0,1,1,0,0,0|2,0,0]=4 5677 B11R1.159 O=C(O)C1=CNC=C(Cl)C1=O Amb25893323 [0,1,1,0,0,0|2,0,0]=4 5678 B11R1.159 O=C(O)C1=CNC=C(I)C1=O Amb28207203 [0,1,1,0,0,0|2,0,0]=4 5679 B11R1.159 O=C(O)c1cccc(=O)n1O Amb22227966 [0,1,1,0,0,0|2,0,0]=4 5680 B11R1.159 O=C(O)c1cccc(Br)[n+]1[O-] Amb24634518 [0,1,1,0,0,0|2,0,0]=4 5681 B11R1.159 O=C(O)c1cccc(Br)c1Br Amb22228260 [0,1,1,0,0,0|1,0,0]=3 5682 B11R1.159 O=C(O)c1cccc(Br)c1Cl Amb16231626 [0,1,1,0,0,0|1,0,0]=3 5683 B11R1.159 O=C(O)c1cccc(Br)c1F Amb2685189 [0,1,1,0,0,0|1,0,0]=3 5684 B11R1.159 O=C(O)c1cccc(Br)c1I Amb20634419 [0,1,1,0,0,0|1,0,0]=3 5685 B11R1.159 O=C(O)c1cccc(Br)c1O Amb6298168 [0,1,1,0,0,0|1,0,0]=3 5686 B11R1.159 O=C(O)c1cccc(Cl)c1Br Amb19888103 [0,1,1,0,0,0|1,0,0]=3 5687 B11R1.159 O=C(O)c1cccc(Cl)c1Cl Amb1207372 [0,1,1,0,0,0|1,0,0]=3 5688 B11R1.159 O=C(O)c1cccc(Cl)c1F Amb2447457 [0,1,1,0,0,0|1,0,0]=3 5689 B11R1.159 O=C(O)c1cccc(Cl)c1I Amb20076024 [0,1,1,0,0,0|1,0,0]=3 5690 B11R1.159 O=C(O)c1cccc(Cl)c1O Amb7764649 [0,1,1,0,0,0|1,0,0]=3 5691 B11R1.159 O=C(O)c1cccc(Cl)c1S Amb18650043 [0,1,1,0,0,0|1,0,0]=3 5692 B11R1.159 O=C(O)c1cccc(F)c1Br Amb2685187 [0,1,1,0,0,0|1,0,0]=3 5693 B11R1.159 O=C(O)c1cccc(F)c1Cl Amb2685947 [0,1,1,0,0,0|1,0,0]=3 5694 B11R1.159 O=C(O)c1cccc(F)c1F Amb2687070 [0,1,1,0,0,0|1,0,0]=3 5695 B11R1.159 O=C(O)c1cccc(F)c1I Amb8397074 [0,1,1,0,0,0|1,0,0]=3 5696 B11R1.159 O=C(O)c1cccc(F)c1O Amb33528918 [0,1,1,0,0,0|1,0,0]=3 5697 B11R1.159 O=C(O)c1cccc(F)c1S Amb18947820 [0,1,1,0,0,0|1,0,0]=3 5698 B11R1.159 O=C(O)c1cccc(I)c1Br Amb10976054 [0,1,1,0,0,0|1,0,0]=3 5699 B11R1.159 O=C(O)c1cccc(I)c1Cl Amb22166862 [0,1,1,0,0,0|1,0,0]=3 5700 B11R1.159 O=C(O)c1cccc(I)c1F Amb8628761 [0,1,1,0,0,0|1,0,0]=3 5701 B11R1.159 O=C(O)c1cccc(I)c1I Amb25733022 [0,1,1,0,0,0|1,0,0]=3 5702 B11R1.159 O=C(O)c1cccc(I)c1O Amb25890548 [0,1,1,0,0,0|1,0,0]=3 5703 B11R1.159 O=C(O)c1cccc(O)c1Br Amb18171413 [0,1,1,0,0,0|1,0,0]=3 5704 B11R1.159 O=C(O)c1cccc(O)c1Cl Amb22001548 [0,1,1,0,0,0|1,0,0]=3 5705 B11R1.159 O=C(O)c1cccc(O)c1F Amb2697884 [0,1,1,0,0,0|1,0,0]=3 5706 B11R1.159 O=C(O)c1cccc(O)c1I Amb25890501 [0,1,1,0,0,0|1,0,0]=3 5707 B11R1.159 O=C(O)c1cccc(O)c1O Amb2721163 [0,1,1,0,0,0|1,0,0]=3 5708 B11R1.159 O=C(O)c1cccc(O)c1S Amb25920759 [0,1,1,0,0,0|1,0,0]=3 5709 B11R1.159 O=C(O)c1cccc(S)c1Br Amb28284809 [0,1,1,0,0,0|1,0,0]=3 5710 B11R1.159 O=C(O)c1cccc(S)c1Cl Amb24334625 [0,1,1,0,0,0|1,0,0]=3 5711 B11R1.159 O=C(O)c1cccc(S)c1F Amb26480110 [0,1,1,0,0,0|1,0,0]=3 5712 B11R1.159 O=C(O)c1cccc(S)c1I Amb26470770 [0,1,1,0,0,0|1,0,0]=3 5713 B11R1.159 O=C(O)c1cccc(S)c1O Amb18647320 [0,1,1,0,0,0|1,0,0]=3 5714 B11R1.159 O=C(O)c1cccc(S)c1S Amb27878723 [0,1,1,0,0,0|1,0,0]=3 5715 B11R1.159 O=C(O)c1ccnc(Br)c1Br Amb10071175 [0,1,1,0,0,0|2,0,0]=4 5716 B11R1.159 O=C(O)c1ccnc(Br)c1Cl Amb21856442 [0,1,1,0,0,0|2,0,0]=4 5717 B11R1.159 O=C(O)c1ccnc(Br)c1F Amb22235587 [0,1,1,0,0,0|2,0,0]=4 5718 B11R1.159 O=C(O)c1ccnc(Br)c1O Amb27606297 [0,1,1,0,0,0|2,0,0]=4 5719 B11R1.159 O=C(O)c1ccnc(Cl)c1Br Amb19929475 [0,1,1,0,0,0|2,0,0]=4 5720 B11R1.159 O=C(O)c1ccnc(Cl)c1Cl Amb6384156 [0,1,1,0,0,0|2,0,0]=4 5721 B11R1.159 O=C(O)c1ccnc(Cl)c1F Amb2686006 [0,1,1,0,0,0|2,0,0]=4 5722 B11R1.159 O=C(O)c1ccnc(Cl)c1I Amb26409336 [0,1,1,0,0,0|2,0,0]=4 5723 B11R1.159 O=C(O)c1ccnc(Cl)c1O Amb33542977 [0,1,1,0,0,0|2,0,0]=4 5724 B11R1.159 O=C(O)c1ccnc(F)c1Br Amb28123222 [0,1,1,0,0,0|2,0,0]=4 5725 B11R1.159 O=C(O)c1ccnc(F)c1Cl Amb8390110 [0,1,1,0,0,0|2,0,0]=4 5726 B11R1.159 O=C(O)c1ccnc(F)c1F Amb8390115 [0,1,1,0,0,0|2,0,0]=4 5727 B11R1.159 O=C(O)c1ccnc(F)c1I Amb27879005 [0,1,1,0,0,0|2,0,0]=4 5728 B11R1.159 O=C(O)c1ccnc(O)c1Br Amb25028146 [0,1,1,0,0,0|2,0,0]=4 5729 B11R1.159 O=C(O)c1ccnc(O)c1Cl Amb26977343 [0,1,1,0,0,0|2,0,0]=4 5730 B11R1.159 O=C(O)c1ccnc(O)c1F Amb25152815 [0,1,1,0,0,0|2,0,0]=4 5731 B11R1.159 O=C(O)c1cncc(Br)c1Cl Amb22491791 [0,1,1,0,0,0|2,0,0]=4 5732 B11R1.159 O=C(O)c1cncc(Br)c1F Amb27438113 [0,1,1,0,0,0|2,0,0]=4 5733 B11R1.159 O=C(O)c1cncc(Br)c1I Amb22263318 [0,1,1,0,0,0|2,0,0]=4 5734 B11R1.159 O=C(O)c1cncc(Br)c1O Amb19958699 [0,1,1,0,0,0|2,0,0]=4 5735 B11R1.159 O=C(O)c1cncc(Cl)c1Br Amb28061317 [0,1,1,0,0,0|2,0,0]=4 5736 B11R1.159 O=C(O)c1cncc(Cl)c1Cl Amb10071909 [0,1,1,0,0,0|2,0,0]=4 5737 B11R1.159 O=C(O)c1cncc(Cl)c1F Amb26434224 [0,1,1,0,0,0|2,0,0]=4 5738 B11R1.159 O=C(O)c1cncc(F)c1Br Amb26654714 [0,1,1,0,0,0|2,0,0]=4 5739 B11R1.159 O=C(O)c1cncc(F)c1Cl Amb22546698 [0,1,1,0,0,0|2,0,0]=4 5740 B11R1.159 O=C(O)c1cncc(F)c1F Amb28286957 [0,1,1,0,0,0|2,0,0]=4 5741 B11R1.159 O=C(O)c1cncc(F)c1I Amb27445156 [0,1,1,0,0,0|2,0,0]=4 5742 B11R1.159 O=C(O)c1cncc(F)c1O Amb24099314 [0,1,1,0,0,0|2,0,0]=4 5743 B11R1.159 O=C(O)c1cncc(I)c1Cl Amb28249025 [0,1,1,0,0,0|2,0,0]=4 5744 B11R1.159 O=C(O)c1cncc(I)c1F Amb25249248 [0,1,1,0,0,0|2,0,0]=4 5745 B11R1.159 O=C(O)c1cncc(O)c1Br Amb24505564 [0,1,1,0,0,0|2,0,0]=4 5746 B11R1.159 O=C(O)c1cncc(O)c1F Amb27431960 [0,1,1,0,0,0|2,0,0]=4 5747 B11R1.159 O=C(O)c1nccc(Br)c1Br Amb28143202 [0,1,1,0,0,0|2,0,0]=4 5748 B11R1.159 O=C(O)c1nccc(Br)c1Cl Amb25246210 [0,1,1,0,0,0|2,0,0]=4 5749 B11R1.159 O=C(O)c1nccc(Br)c1F Amb26004041 [0,1,1,0,0,0|2,0,0]=4 5750 B11R1.159 O=C(O)c1nccc(Br)c1I Amb28398039 [0,1,1,0,0,0|2,0,0]=4 5751 B11R1.159 O=C(O)c1nccc(Br)c1O Amb27617463 [0,1,1,0,0,0|2,0,0]=4 5752 B11R1.159 O=C(O)c1nccc(Br)c1O Amb35749343 [0,1,1,0,0,0|2,0,0]=4 5753 B11R1.159 O=C(O)c1nccc(Cl)c1Br Amb25996578 [0,1,1,0,0,0|2,0,0]=4 5754 B11R1.159 O=C(O)c1nccc(Cl)c1Cl Amb21963505 [0,1,1,0,0,0|2,0,0]=4 5755 B11R1.159 O=C(O)c1nccc(Cl)c1F Amb22491070 [0,1,1,0,0,0|2,0,0]=4 5756 B11R1.159 O=C(O)c1nccc(Cl)c1O Amb22057869 [0,1,1,0,0,0|2,0,0]=4 5757 B11R1.159 O=C(O)c1nccc(F)c1Br Amb25028147 [0,1,1,0,0,0|2,0,0]=4 5758 B11R1.159 O=C(O)c1nccc(F)c1Cl Amb26980826 [0,1,1,0,0,0|2,0,0]=4 5759 B11R1.159 O=C(O)c1nccc(F)c1F Amb24511721 [0,1,1,0,0,0|2,0,0]=4 5760 B11R1.159 O=C(O)c1nccc(F)c1I Amb24707897 [0,1,1,0,0,0|2,0,0]=4 5761 B11R1.159 O=C(O)c1nccc(F)c1O Amb25352096 [0,1,1,0,0,0|2,0,0]=4 5762 B11R1.159 O=C(O)c1nccc(I)c1F Amb26900285 [0,1,1,0,0,0|2,0,0]=4 5763 B11R1.159 O=C(O)c1nccc(O)c1Br Amb25208591 [0,1,1,0,0,0|2,0,0]=4 5764 B11R1.159 O=C(O)c1nccc(O)c1Cl Amb27617270 [0,1,1,0,0,0|2,0,0]=4 5765 B11R1.159 O=C(O)c1nccc(O)c1O Amb24740856 [0,1,1,0,0,0|2,0,0]=4 5766 B11R1.159 O=C([O-])c1cccc(Cl)c1F Amb33513117 [0,1,1,0,0,0|1,0,1]=4 5767 B11R1.159 O=C([O-])c1cccc(F)c1F Amb33513007 [0,1,1,0,0,0|1,0,1]=4 5768 B11R1.159 [NH3+]c1cccc(C(=O)O)c1O Amb22641593 [0,1,1,0,0,0|1,0,0]=3 5769 B11R1.166 C=C(C)c1ccc(N)cc1C Amb17107087 [0,1,1,0,0,0|2,0,0]=4 5770 B11R1.166 CC(=O)C1=C(C)NC(=O)C=C1 Amb21927044 [0,1,1,0,0,0|2,0,0]=4 5771 B11R1.166 CC(=O)c1ccc(Br)cc1Br Amb1206776 [0,1,1,0,0,0|2,0,0]=4 5772 B11R1.166 CC(=O)c1ccc(Br)cc1C Amb17339932 [0,1,1,0,0,0|1,0,0]=3 5773 B11R1.166 CC(=O)c1ccc(Br)cc1Cl Amb8383576 [0,1,1,0,0,0|2,0,0]=4 5774 B11R1.166 CC(=O)c1ccc(Br)cc1F Amb16185897 [0,1,1,0,0,0|2,0,0]=4 5775 B11R1.166 CC(=O)c1ccc(Br)cc1I Amb26849547 [0,1,1,0,0,0|2,0,0]=4 5776 B11R1.166 CC(=O)c1ccc(Br)cc1N Amb19958083 [0,1,1,0,0,0|2,0,0]=4 5777 B11R1.166 CC(=O)c1ccc(Br)cc1O Amb2508446 [0,1,1,0,0,0|2,0,0]=4 5778 B11R1.166 CC(=O)c1ccc(C)cc1Br Amb33549192 [0,1,1,0,0,0|2,0,0]=4 5779 B11R1.166 CC(=O)c1ccc(C)cc1C Amb6356939 [0,1,1,0,0,0|1,0,0]=3 5780 B11R1.166 CC(=O)c1ccc(C)cc1Cl Amb25151553 [0,1,1,0,0,0|2,0,0]=4 5781 B11R1.166 CC(=O)c1ccc(C)cc1F Amb33546811 [0,1,1,0,0,0|2,0,0]=4 5782 B11R1.166 CC(=O)c1ccc(C)cc1N Amb18124989 [0,1,1,0,0,0|2,0,0]=4 5783 B11R1.166 CC(=O)c1ccc(C)cc1O Amb1673131 [0,1,1,0,0,0|2,0,0]=4 5784 B11R1.166 CC(=O)c1ccc(C)nc1C Amb6254973 [0,1,1,0,0,0|2,0,0]=4 5785 B11R1.166 CC(=O)c1ccc(Cl)cc1Br Amb10576545 [0,1,1,0,0,0|2,0,0]=4 5786 B11R1.166 CC(=O)c1ccc(Cl)cc1C Amb17334751 [0,1,1,0,0,0|1,0,0]=3 5787 B11R1.166 CC(=O)c1ccc(Cl)cc1Cl Amb3940077 [0,1,1,0,0,0|2,0,0]=4 5788 B11R1.166 CC(=O)c1ccc(Cl)cc1F Amb2684178 [0,1,1,0,0,0|2,0,0]=4 5789 B11R1.166 CC(=O)c1ccc(Cl)cc1N Amb22490706 [0,1,1,0,0,0|2,0,0]=4 5790 B11R1.166 CC(=O)c1ccc(Cl)cc1N Amb22498971 [0,1,1,0,0,0|2,0,0]=4 5791 B11R1.166 CC(=O)c1ccc(Cl)cc1O Amb2612557 [0,1,1,0,0,0|2,0,0]=4 5792 B11R1.166 CC(=O)c1ccc(Cl)nc1C Amb2432588 [0,1,1,0,0,0|2,0,0]=4 5793 B11R1.166 CC(=O)c1ccc(F)cc1Br Amb2685171 [0,1,1,0,0,0|2,0,0]=4 5794 B11R1.166 CC(=O)c1ccc(F)cc1C Amb18796669 [0,1,1,0,0,0|1,0,0]=3 5795 B11R1.166 CC(=O)c1ccc(F)cc1Cl Amb1661967 [0,1,1,0,0,0|2,0,0]=4 5796 B11R1.166 CC(=O)c1ccc(F)cc1F Amb1694905 [0,1,1,0,0,0|2,0,0]=4 5797 B11R1.166 CC(=O)c1ccc(F)cc1N Amb10601949 [0,1,1,0,0,0|2,0,0]=4 5798 B11R1.166 CC(=O)c1ccc(F)cc1N Amb32990139 [0,1,1,0,0,0|2,0,0]=4 5799 B11R1.166 CC(=O)c1ccc(F)cc1O Amb2688103 [0,1,1,0,0,0|2,0,0]=4 5800 B11R1.166 CC(=O)c1ccc(F)nc1C Amb26480055 [0,1,1,0,0,0|2,0,0]=4 5801 B11R1.166 CC(=O)c1ccc(I)cc1C Amb28368470 [0,1,1,0,0,0|1,0,0]=3 5802 B11R1.166 CC(=O)c1ccc(I)cc1Cl Amb27230220 [0,1,1,0,0,0|2,0,0]=4 5803 B11R1.166 CC(=O)c1ccc(I)cc1F Amb24727241 [0,1,1,0,0,0|2,0,0]=4 5804 B11R1.166 CC(=O)c1ccc(I)cc1N Amb22498970 [0,1,1,0,0,0|2,0,0]=4 5805 B11R1.166 CC(=O)c1ccc(I)cc1O Amb22001987 [0,1,1,0,0,0|2,0,0]=4 5806 B11R1.166 CC(=O)c1ccc(N)cc1Br Amb25296862 [0,1,1,0,0,0|2,0,0]=4 5807 B11R1.166 CC(=O)c1ccc(N)cc1C Amb18124992 [0,1,1,0,0,0|1,0,0]=3 5808 B11R1.166 CC(=O)c1ccc(N)cc1Cl Amb18126635 [0,1,1,0,0,0|2,0,0]=4 5809 B11R1.166 CC(=O)c1ccc(N)cc1F Amb22232886 [0,1,1,0,0,0|2,0,0]=4 5810 B11R1.166 CC(=O)c1ccc(N)cc1N Amb28076104 [0,1,1,0,0,0|2,0,0]=4 5811 B11R1.166 CC(=O)c1ccc(N)cc1O Amb2722861 [0,1,1,0,0,0|2,0,0]=4 5812 B11R1.166 CC(=O)c1ccc(N)nc1C Amb27246730 [0,1,1,0,0,0|2,0,0]=4 5813 B11R1.166 CC(=O)c1ccc(O)cc1Br Amb6297034 [0,1,1,0,0,0|2,0,0]=4 5814 B11R1.166 CC(=O)c1ccc(O)cc1C Amb3940079 [0,1,1,0,0,0|1,0,0]=3 5815 B11R1.166 CC(=O)c1ccc(O)cc1Cl Amb2699513 [0,1,1,0,0,0|2,0,0]=4 5816 B11R1.166 CC(=O)c1ccc(O)cc1F Amb8386515 [0,1,1,0,0,0|2,0,0]=4 5817 B11R1.166 CC(=O)c1ccc(O)cc1N Amb24061068 [0,1,1,0,0,0|2,0,0]=4 5818 B11R1.166 CC(=O)c1ccc(O)cc1O Amb1811488 [0,1,1,0,0,0|2,0,0]=4 5819 B11R1.166 CC(=O)c1ccc(S)cc1N Amb28369027 [0,1,1,0,0,0|2,0,0]=4 5820 B11R1.166 CC(=O)c1cnc(Br)cc1C Amb26373252 [0,1,1,0,0,0|2,0,0]=4 5821 B11R1.166 CC(=O)c1cnc(C)cc1C Amb28312990 [0,1,1,0,0,0|2,0,0]=4 5822 B11R1.166 CC(=O)c1cnc(Cl)cc1C Amb28182547 [0,1,1,0,0,0|2,0,0]=4 5823 B11R1.166 CC(=O)c1cnc(F)cc1C Amb28187249 [0,1,1,0,0,0|2,0,0]=4 5824 B11R1.166 CC(=O)c1cnc(N)cc1C Amb26855129 [0,1,1,0,0,0|2,0,0]=4 5825 B11R1.166 CC(=O)c1ncc(Br)cc1C Amb22499353 [0,1,1,0,0,0|2,0,0]=4 5826 B11R1.166 CC(=O)c1ncc(C)cc1C Amb25028058 [0,1,1,0,0,0|2,0,0]=4 5827 B11R1.166 CC(=O)c1ncc(Cl)cc1C Amb26549196 [0,1,1,0,0,0|2,0,0]=4 5828 B11R1.166 CC(=O)c1ncc(F)cc1C Amb28255582 [0,1,1,0,0,0|2,0,0]=4 5829 B11R1.166 CC(=O)c1ncc(N)cc1C Amb27621498 [0,1,1,0,0,0|2,0,0]=4 5830 B11R1.166 CC(=O)c1ncc(O)cc1C Amb23403508 [0,1,1,0,0,0|2,0,0]=4 5831 B11R1.166 CC1=C(C(=O)O)C=CC(=O)N1 Amb22491681 [0,1,1,0,0,0|1,0,0]=3 5832 B11R1.166 CC1=CC(=O)C(C(=O)O)=CN1 Amb19516671 [0,1,1,0,0,0|2,0,0]=4 5833 B11R1.166 CC1=CC(=O)C(C(=O)O)=CO1 Amb26381688 [0,1,1,0,0,0|2,0,0]=4 5834 B11R1.166 CC1=CC(=O)NC=C1C(=O)O Amb18125521 [0,1,1,0,0,0|1,0,0]=3 5835 B11R1.166 CC1=CC(=O)NN=C1C(=O)O Amb27157949 [0,1,1,0,0,0|2,0,0]=4 5836 B11R1.166 CC1=CC(=S)NC=C1C(=O)O Amb23446897 [0,1,1,0,0,0|1,0,0]=3 5837 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 Amb18529760 [0,1,1,0,0,0|2,0,0]=4 5838 B11R1.166 CC1=CC=C(C(=O)O)C(=S)N1 Amb19747249 [0,1,1,0,0,0|2,0,0]=4 5839 B11R1.166 C[n+]1cc(S)ccc1C(=O)O Amb2612021 [0,1,1,0,0,0|1,0,0]=3 5840 B11R1.166 Cc1cc(=O)occ1C(=O)O Amb8010070 [0,1,1,0,0,0|1,0,0]=3 5841 B11R1.166 Cc1cc(Br)c(C(=O)O)cn1 Amb22494598 [0,1,1,0,0,0|2,0,0]=4 5842 B11R1.166 Cc1cc(Br)ccc1B(O)O Amb21856485 [0,1,1,0,0,0|1,0,1]=4 5843 B11R1.166 Cc1cc(Br)ccc1C(=N)N Amb10066931 [0,1,1,0,0,0|2,0,0]=4 5844 B11R1.166 Cc1cc(Br)ccc1C(=N)N Amb2695979 [0,1,1,0,0,0|2,0,0]=4 5845 B11R1.166 Cc1cc(Br)ccc1C(=O)O Amb3939977 [0,1,1,0,0,0|0,0,0]=2 5846 B11R1.166 Cc1cc(Br)ccc1C(N)=O Amb9494688 [0,1,1,0,0,0|1,0,0]=3 5847 B11R1.166 Cc1cc(Br)ccc1C(N)=S Amb21959349 [0,1,1,0,0,0|1,1,0]=4 5848 B11R1.166 Cc1cc(Br)ccc1N(=O)=O Amb20620587 [0,1,1,0,0,0|1,0,1]=4 5849 B11R1.166 Cc1cc(Br)ccc1S(=O)[O-] Amb27976430 [0,1,1,0,0,0|1,0,1]=4 5850 B11R1.166 Cc1cc(Br)ccc1[C@@H](C)O Amb25149345 [0,1,1,0,0,0|1,0,1]=4 5851 B11R1.166 Cc1cc(Br)ccc1[C@H](C)O Amb26333762 [0,1,1,0,0,0|1,0,1]=4 5852 B11R1.166 Cc1cc(Br)ccc1[N+](=O)[O-] Amb2610549 [0,1,1,0,0,0|1,0,1]=4 5853 B11R1.166 Cc1cc(Br)cnc1C(=O)Cl Amb27845535 [0,1,1,0,0,0|2,0,0]=4 5854 B11R1.166 Cc1cc(Br)cnc1C(=O)O Amb33549168 [0,1,1,0,0,0|1,0,0]=3 5855 B11R1.166 Cc1cc(Br)cnc1C(=O)[O-] Amb30594542 [0,1,1,0,0,0|1,0,1]=4 5856 B11R1.166 Cc1cc(Br)cnc1C(N)=O Amb25775274 [0,1,1,0,0,0|2,0,0]=4 5857 B11R1.166 Cc1cc(Br)ncc1C(=O)O Amb23579240 [0,1,1,0,0,0|1,0,0]=3 5858 B11R1.166 Cc1cc(C)c(C(=O)O)cn1 Amb21960081 [0,1,1,0,0,0|1,0,0]=3 5859 B11R1.166 Cc1cc(C)c(C(=O)O)cn1 Amb2609636 [0,1,1,0,0,0|1,0,0]=3 5860 B11R1.166 Cc1cc(C)c(C(N)=O)cn1 Amb2610092 [0,1,1,0,0,0|2,0,0]=4 5861 B11R1.166 Cc1cc(Cl)c(C(=O)O)cn1 Amb10602695 [0,1,1,0,0,0|2,0,0]=4 5862 B11R1.166 Cc1cc(Cl)ccc1B(O)O Amb2447261 [0,1,1,0,0,0|1,0,1]=4 5863 B11R1.166 Cc1cc(Cl)ccc1C(=N)N Amb2696071 [0,1,1,0,0,0|2,0,0]=4 5864 B11R1.166 Cc1cc(Cl)ccc1C(=O)Cl Amb19888087 [0,1,1,0,0,0|1,0,0]=3 5865 B11R1.166 Cc1cc(Cl)ccc1C(=O)F Amb25114726 [0,1,1,0,0,0|1,0,0]=3 5866 B11R1.166 Cc1cc(Cl)ccc1C(=O)O Amb2686195 [0,1,1,0,0,0|0,0,0]=2 5867 B11R1.166 Cc1cc(Cl)ccc1C(C)O Amb27592480 [0,1,1,0,0,0|1,0,1]=4 5868 B11R1.166 Cc1cc(Cl)ccc1C(N)=O Amb17334784 [0,1,1,0,0,0|1,0,0]=3 5869 B11R1.166 Cc1cc(Cl)ccc1C(N)=S Amb10789229 [0,1,1,0,0,0|1,1,0]=4 5870 B11R1.166 Cc1cc(Cl)ccc1C(O)=S Amb26484370 [0,1,1,0,0,0|0,1,0]=3 5871 B11R1.166 Cc1cc(Cl)ccc1S(=O)[O-] Amb27789499 [0,1,1,0,0,0|1,0,1]=4 5872 B11R1.166 Cc1cc(Cl)ccc1[C@@H](C)O Amb33261424 [0,1,1,0,0,0|1,0,1]=4 5873 B11R1.166 Cc1cc(Cl)ccc1[C@H](C)O Amb33261422 [0,1,1,0,0,0|1,0,1]=4 5874 B11R1.166 Cc1cc(Cl)ccc1[N+](=O)[O-] Amb8396654 [0,1,1,0,0,0|1,0,1]=4 5875 B11R1.166 Cc1cc(Cl)cnc1C(=O)O Amb10602904 [0,1,1,0,0,0|1,0,0]=3 5876 B11R1.166 Cc1cc(Cl)cnc1C(N)=O Amb27434413 [0,1,1,0,0,0|2,0,0]=4 5877 B11R1.166 Cc1cc(Cl)cnc1S(=O)O Amb32992485 [0,1,1,0,0,0|2,0,0]=4 5878 B11R1.166 Cc1cc(Cl)ncc1C(=O)O Amb19895187 [0,1,1,0,0,0|1,0,0]=3 5879 B11R1.166 Cc1cc(Cl)ncc1C(N)=O Amb28410575 [0,1,1,0,0,0|2,0,0]=4 5880 B11R1.166 Cc1cc(Cl)ncc1S(=O)O Amb32992486 [0,1,1,0,0,0|2,0,0]=4 5881 B11R1.166 Cc1cc(F)ccc1B(O)O Amb2447264 [0,1,1,0,0,0|1,0,1]=4 5882 B11R1.166 Cc1cc(F)ccc1C(=N)N Amb26961128 [0,1,1,0,0,0|2,0,0]=4 5883 B11R1.166 Cc1cc(F)ccc1C(=O)Cl Amb10839396 [0,1,1,0,0,0|1,0,0]=3 5884 B11R1.166 Cc1cc(F)ccc1C(=O)O Amb8393513 [0,1,1,0,0,0|0,0,0]=2 5885 B11R1.166 Cc1cc(F)ccc1C(C)O Amb18796757 [0,1,1,0,0,0|1,0,1]=4 5886 B11R1.166 Cc1cc(F)ccc1C(N)=O Amb22738269 [0,1,1,0,0,0|1,0,0]=3 5887 B11R1.166 Cc1cc(F)ccc1C(N)=S Amb22043725 [0,1,1,0,0,0|1,1,0]=4 5888 B11R1.166 Cc1cc(F)ccc1C(O)=S Amb24701278 [0,1,1,0,0,0|0,1,0]=3 5889 B11R1.166 Cc1cc(F)ccc1N(=O)=O Amb20621614 [0,1,1,0,0,0|1,0,1]=4 5890 B11R1.166 Cc1cc(F)ccc1S(=O)Cl Amb18066296 [0,1,1,0,0,0|2,0,0]=4 5891 B11R1.166 Cc1cc(F)ccc1S(=O)O Amb18564007 [0,1,1,0,0,0|1,0,0]=3 5892 B11R1.166 Cc1cc(F)ccc1S(=O)[O-] Amb19944448 [0,1,1,0,0,0|1,0,1]=4 5893 B11R1.166 Cc1cc(F)ccc1[C@@H](C)O Amb26500303 [0,1,1,0,0,0|1,0,1]=4 5894 B11R1.166 Cc1cc(F)ccc1[C@H](C)O Amb26346376 [0,1,1,0,0,0|1,0,1]=4 5895 B11R1.166 Cc1cc(F)ccc1[N+](=O)[O-] Amb2688278 [0,1,1,0,0,0|1,0,1]=4 5896 B11R1.166 Cc1cc(F)cnc1C(=O)O Amb22750183 [0,1,1,0,0,0|1,0,0]=3 5897 B11R1.166 Cc1cc(F)ncc1C(=O)O Amb13890368 [0,1,1,0,0,0|1,0,0]=3 5898 B11R1.166 Cc1cc(I)ccc1C(=O)O Amb22756850 [0,1,1,0,0,0|0,0,0]=2 5899 B11R1.166 Cc1cc(I)ccc1C(N)=O Amb25040087 [0,1,1,0,0,0|1,0,0]=3 5900 B11R1.166 Cc1cc(I)ccc1C(O)=S Amb27785720 [0,1,1,0,0,0|0,1,0]=3 5901 B11R1.166 Cc1cc(I)ccc1[N+](=O)[O-] Amb22058823 [0,1,1,0,0,0|1,0,1]=4 5902 B11R1.166 Cc1cc(N)c(C(=O)O)cn1 Amb10602601 [0,1,1,0,0,0|2,0,0]=4 5903 B11R1.166 Cc1cc(N)ccc1B(O)O Amb27647545 [0,1,1,0,0,0|1,0,1]=4 5904 B11R1.166 Cc1cc(N)ccc1C(=O)O Amb8439105 [0,1,1,0,0,0|0,0,0]=2 5905 B11R1.166 Cc1cc(N)ccc1C(N)=O Amb18279467 [0,1,1,0,0,0|1,0,0]=3 5906 B11R1.166 Cc1cc(N)ccc1C(N)=S Amb27617350 [0,1,1,0,0,0|1,1,0]=4 5907 B11R1.166 Cc1cc(N)ccc1C(O)=S Amb26396181 [0,1,1,0,0,0|0,1,0]=3 5908 B11R1.166 Cc1cc(N)ccc1N(=O)=O Amb20621845 [0,1,1,0,0,0|1,0,1]=4 5909 B11R1.166 Cc1cc(N)ccc1[N+](=O)[O-] Amb6316121 [0,1,1,0,0,0|1,0,1]=4 5910 B11R1.166 Cc1cc(N)cnc1C(=O)O Amb26505843 [0,1,1,0,0,0|1,0,0]=3 5911 B11R1.166 Cc1cc(N)cnc1C(=O)O Amb33620558 [0,1,1,0,0,0|1,0,0]=3 5912 B11R1.166 Cc1cc(N)ncc1C(=O)O Amb16231944 [0,1,1,0,0,0|1,0,0]=3 5913 B11R1.166 Cc1cc(O)c(C(=O)O)cn1 Amb8390913 [0,1,1,0,0,0|2,0,0]=4 5914 B11R1.166 Cc1cc(O)ccc1B(O)O Amb2456010 [0,1,1,0,0,0|1,0,1]=4 5915 B11R1.166 Cc1cc(O)ccc1C(=N)N Amb27781547 [0,1,1,0,0,0|2,0,0]=4 5916 B11R1.166 Cc1cc(O)ccc1C(=O)Cl Amb26399126 [0,1,1,0,0,0|1,0,0]=3 5917 B11R1.166 Cc1cc(O)ccc1C(=O)O Amb6297546 [0,1,1,0,0,0|0,0,0]=2 5918 B11R1.166 Cc1cc(O)ccc1C(C)O Amb18055440 [0,1,1,0,0,0|1,0,1]=4 5919 B11R1.166 Cc1cc(O)ccc1C(N)=O Amb18554169 [0,1,1,0,0,0|1,0,0]=3 5920 B11R1.166 Cc1cc(O)ccc1C(N)=S Amb28188559 [0,1,1,0,0,0|1,1,0]=4 5921 B11R1.166 Cc1cc(O)ccc1C(O)=S Amb28118695 [0,1,1,0,0,0|0,1,0]=3 5922 B11R1.166 Cc1cc(O)ccc1N(=O)=O Amb20621850 [0,1,1,0,0,0|1,0,1]=4 5923 B11R1.166 Cc1cc(O)ccc1[N+](=O)[O-] Amb426752 [0,1,1,0,0,0|1,0,1]=4 5924 B11R1.166 Cc1cc(O)cnc1C(=O)O Amb23437564 [0,1,1,0,0,0|1,0,0]=3 5925 B11R1.166 Cc1cc(O)cnc1C(N)=O Amb23403507 [0,1,1,0,0,0|2,0,0]=4 5926 B11R1.166 Cc1cc(S)ccc1C(=O)O Amb25884179 [0,1,1,0,0,0|0,0,0]=2 5927 B11R1.166 Cc1cc(S)ccc1[N+](=O)[O-] Amb28292816 [0,1,1,0,0,0|1,0,1]=4 5928 B11R1.166 Cc1ccc(B(O)O)c(C)c1 Amb33527305 [0,1,1,0,0,0|1,0,1]=4 5929 B11R1.166 Cc1ccc(C(=N)N)c(C)c1 Amb2695865 [0,1,1,0,0,0|2,0,0]=4 5930 B11R1.166 Cc1ccc(C(=O)Cl)c(Br)c1 Amb19891062 [0,1,1,0,0,0|2,0,0]=4 5931 B11R1.166 Cc1ccc(C(=O)Cl)c(C)c1 Amb17773436 [0,1,1,0,0,0|1,0,0]=3 5932 B11R1.166 Cc1ccc(C(=O)Cl)c(Cl)c1 Amb10070857 [0,1,1,0,0,0|2,0,0]=4 5933 B11R1.166 Cc1ccc(C(=O)Cl)c(F)c1 Amb19890528 [0,1,1,0,0,0|2,0,0]=4 5934 B11R1.166 Cc1ccc(C(=O)Cl)c(N)c1 Amb25106699 [0,1,1,0,0,0|2,0,0]=4 5935 B11R1.166 Cc1ccc(C(=O)Cl)c(O)c1 Amb6743396 [0,1,1,0,0,0|2,0,0]=4 5936 B11R1.166 Cc1ccc(C(=O)O)[n+]([O-])c1 Amb25951257 [0,1,1,0,0,0|2,0,0]=4 5937 B11R1.166 Cc1ccc(C(=O)O)c(Br)c1 Amb2685315 [0,1,1,0,0,0|1,0,0]=3 5938 B11R1.166 Cc1ccc(C(=O)O)c(Br)n1 Amb22752846 [0,1,1,0,0,0|2,0,0]=4 5939 B11R1.166 Cc1ccc(C(=O)O)c(C)c1 Amb3940029 [0,1,1,0,0,0|0,0,0]=2 5940 B11R1.166 Cc1ccc(C(=O)O)c(C)n1 Amb6254972 [0,1,1,0,0,0|1,0,0]=3 5941 B11R1.166 Cc1ccc(C(=O)O)c(Cl)c1 Amb10071244 [0,1,1,0,0,0|1,0,0]=3 5942 B11R1.166 Cc1ccc(C(=O)O)c(Cl)n1 Amb2720217 [0,1,1,0,0,0|2,0,0]=4 5943 B11R1.166 Cc1ccc(C(=O)O)c(F)c1 Amb8396213 [0,1,1,0,0,0|1,0,0]=3 5944 B11R1.166 Cc1ccc(C(=O)O)c(F)n1 Amb24423018 [0,1,1,0,0,0|2,0,0]=4 5945 B11R1.166 Cc1ccc(C(=O)O)c(I)c1 Amb4451333 [0,1,1,0,0,0|1,0,0]=3 5946 B11R1.166 Cc1ccc(C(=O)O)c(N)c1 Amb2726205 [0,1,1,0,0,0|1,0,0]=3 5947 B11R1.166 Cc1ccc(C(=O)O)c(N)c1 Amb32665268 [0,1,1,0,0,0|1,0,0]=3 5948 B11R1.166 Cc1ccc(C(=O)O)c(N)n1 Amb8385706 [0,1,1,0,0,0|2,0,0]=4 5949 B11R1.166 Cc1ccc(C(=O)O)c(O)c1 Amb2691963 [0,1,1,0,0,0|1,0,0]=3 5950 B11R1.166 Cc1ccc(C(=O)O)c(O)n1 Amb2725657 [0,1,1,0,0,0|2,0,0]=4 5951 B11R1.166 Cc1ccc(C(=O)O)c(S)c1 Amb18948052 [0,1,1,0,0,0|1,0,0]=3 5952 B11R1.166 Cc1ccc(C(=O)O)c([O-])c1 Amb8466413 [0,1,1,0,0,0|1,0,0]=3 5953 B11R1.166 Cc1ccc(C(C)O)c(C)c1 Amb1110404 [0,1,1,0,0,0|1,0,1]=4 5954 B11R1.166 Cc1ccc(C(N)=O)c(Br)c1 Amb17340166 [0,1,1,0,0,0|2,0,0]=4 5955 B11R1.166 Cc1ccc(C(N)=O)c(C)c1 Amb8997749 [0,1,1,0,0,0|1,0,0]=3 5956 B11R1.166 Cc1ccc(C(N)=O)c(Cl)c1 Amb19531831 [0,1,1,0,0,0|2,0,0]=4 5957 B11R1.166 Cc1ccc(C(N)=O)c(F)c1 Amb20667845 [0,1,1,0,0,0|2,0,0]=4 5958 B11R1.166 Cc1ccc(C(N)=O)c(I)c1 Amb23001182 [0,1,1,0,0,0|2,0,0]=4 5959 B11R1.166 Cc1ccc(C(N)=O)c(N)c1 Amb2726241 [0,1,1,0,0,0|2,0,0]=4 5960 B11R1.166 Cc1ccc(C(N)=O)c(O)c1 Amb1230548 [0,1,1,0,0,0|2,0,0]=4 5961 B11R1.166 Cc1ccc(C(N)=S)c(C)c1 Amb426038 [0,1,1,0,0,0|1,1,0]=4 5962 B11R1.166 Cc1ccc(C(O)=S)c(C)c1 Amb27476311 [0,1,1,0,0,0|0,1,0]=3 5963 B11R1.166 Cc1ccc(N(=O)=O)c(C)c1 Amb20621126 [0,1,1,0,0,0|1,0,1]=4 5964 B11R1.166 Cc1ccc(S(=O)Cl)c(C)c1 Amb18066212 [0,1,1,0,0,0|2,0,0]=4 5965 B11R1.166 Cc1ccc(S(=O)O)c(C)c1 Amb18563920 [0,1,1,0,0,0|1,0,0]=3 5966 B11R1.166 Cc1ccc(S(=O)O)c(F)c1 Amb35697445 [0,1,1,0,0,0|2,0,0]=4 5967 B11R1.166 Cc1ccc(S(=O)O)c(N)c1 Amb27617293 [0,1,1,0,0,0|2,0,0]=4 5968 B11R1.166 Cc1ccc(S(=O)[O-])c(C)c1 Amb24386169 [0,1,1,0,0,0|1,0,1]=4 5969 B11R1.166 Cc1ccc([C@@H](C)O)c(C)c1 Amb6893589 [0,1,1,0,0,0|1,0,1]=4 5970 B11R1.166 Cc1ccc([C@H](C)O)c(C)c1 Amb6893588 [0,1,1,0,0,0|1,0,1]=4 5971 B11R1.166 Cc1cnc(C(=O)O)c(Br)c1 Amb19895186 [0,1,1,0,0,0|2,0,0]=4 5972 B11R1.166 Cc1cnc(C(=O)O)c(C)c1 Amb19895227 [0,1,1,0,0,0|1,0,0]=3 5973 B11R1.166 Cc1cnc(C(=O)O)c(C)c1 Amb32687534 [0,1,1,0,0,0|1,0,0]=3 5974 B11R1.166 Cc1cnc(C(=O)O)c(C)n1 Amb21856880 [0,1,1,0,0,0|2,0,0]=4 5975 B11R1.166 Cc1cnc(C(=O)O)c(F)c1 Amb22491025 [0,1,1,0,0,0|2,0,0]=4 5976 B11R1.166 Cc1cnc(C(=O)O)c(I)c1 Amb27635502 [0,1,1,0,0,0|2,0,0]=4 5977 B11R1.166 Cc1cnc(C(=O)O)c(N)c1 Amb24691597 [0,1,1,0,0,0|2,0,0]=4 5978 B11R1.166 Cc1cnc(C(=O)O)c(O)c1 Amb23400039 [0,1,1,0,0,0|2,0,0]=4 5979 B11R1.166 Cc1cnc(C(=O)O)c(O)c1 Amb28872322 [0,1,1,0,0,0|2,0,0]=4 5980 B11R1.166 Cc1cnc(C(=O)O)c(S)c1 Amb27607674 [0,1,1,0,0,0|2,0,0]=4 5981 B11R1.166 Cc1nc(Br)ccc1C(=O)O Amb22491682 [0,1,1,0,0,0|1,0,0]=3 5982 B11R1.166 Cc1nc(Br)cnc1C(=O)O Amb25116628 [0,1,1,0,0,0|2,0,0]=4 5983 B11R1.166 Cc1nc(Cl)ccc1C(=O)O Amb21856832 [0,1,1,0,0,0|1,0,0]=3 5984 B11R1.166 Cc1nc(Cl)ncc1C(=O)O Amb16185644 [0,1,1,0,0,0|2,0,0]=4 5985 B11R1.166 Cc1nc(F)ccc1C(=O)Br Amb27795247 [0,1,1,0,0,0|2,0,0]=4 5986 B11R1.166 Cc1nc(F)ccc1C(=O)O Amb8393045 [0,1,1,0,0,0|1,0,0]=3 5987 B11R1.166 Cc1nc(F)ccc1S(=O)O Amb32992467 [0,1,1,0,0,0|2,0,0]=4 5988 B11R1.166 Cc1nc(F)ncc1C(=O)O Amb27229148 [0,1,1,0,0,0|2,0,0]=4 5989 B11R1.166 Cc1nc(I)ccc1C(=O)O Amb23537326 [0,1,1,0,0,0|1,0,0]=3 5990 B11R1.166 Cc1nc(N)ccc1C(=O)O Amb10842138 [0,1,1,0,0,0|1,0,0]=3 5991 B11R1.166 Cc1nc(N)cnc1C(=O)O Amb27603451 [0,1,1,0,0,0|2,0,0]=4 5992 B11R1.166 Cc1nc(N)ncc1C(=O)O Amb2697600 [0,1,1,0,0,0|2,0,0]=4 5993 B11R1.166 Cc1nc(S)ncc1C(=O)O Amb2422986 [0,1,1,0,0,0|2,0,0]=4 5994 B11R1.166 Cc1ncc(C(=O)O)c(C)n1 Amb841881 [0,1,1,0,0,0|2,0,0]=4 5995 B11R1.166 NC(=O)c1ccc(Br)cc1Br Amb23527373 [0,1,1,0,0,0|2,0,0]=4 5996 B11R1.166 NC(=O)c1ccc(Br)cc1Cl Amb9672238 [0,1,1,0,0,0|2,0,0]=4 5997 B11R1.166 NC(=O)c1ccc(Br)cc1F Amb6275783 [0,1,1,0,0,0|2,0,0]=4 5998 B11R1.166 NC(=O)c1ccc(Br)cc1I Amb25692684 [0,1,1,0,0,0|2,0,0]=4 5999 B11R1.166 NC(=O)c1ccc(Br)cc1N Amb10240730 [0,1,1,0,0,0|2,0,0]=4 6000 B11R1.166 NC(=O)c1ccc(Br)cc1O Amb24065862 [0,1,1,0,0,0|2,0,0]=4 6001 B11R1.166 NC(=O)c1ccc(Cl)cc1Br Amb22467150 [0,1,1,0,0,0|2,0,0]=4 6002 B11R1.166 NC(=O)c1ccc(Cl)cc1Cl Amb2781971 [0,1,1,0,0,0|2,0,0]=4 6003 B11R1.166 NC(=O)c1ccc(Cl)cc1F Amb8998364 [0,1,1,0,0,0|2,0,0]=4 6004 B11R1.166 NC(=O)c1ccc(Cl)cc1I Amb11480317 [0,1,1,0,0,0|2,0,0]=4 6005 B11R1.166 NC(=O)c1ccc(Cl)cc1N Amb1111810 [0,1,1,0,0,0|2,0,0]=4 6006 B11R1.166 NC(=O)c1ccc(Cl)cc1O Amb6671844 [0,1,1,0,0,0|2,0,0]=4 6007 B11R1.166 NC(=O)c1ccc(F)cc1Br Amb6279442 [0,1,1,0,0,0|2,0,0]=4 6008 B11R1.166 NC(=O)c1ccc(F)cc1Cl Amb2107852 [0,1,1,0,0,0|2,0,0]=4 6009 B11R1.166 NC(=O)c1ccc(F)cc1F Amb931352 [0,1,1,0,0,0|2,0,0]=4 6010 B11R1.166 NC(=O)c1ccc(F)cc1I Amb11480321 [0,1,1,0,0,0|2,0,0]=4 6011 B11R1.166 NC(=O)c1ccc(F)cc1N Amb10240726 [0,1,1,0,0,0|2,0,0]=4 6012 B11R1.166 NC(=O)c1ccc(F)cc1S Amb28293352 [0,1,1,0,0,0|2,0,0]=4 6013 B11R1.166 NC(=O)c1ccc(I)cc1Br Amb26513589 [0,1,1,0,0,0|2,0,0]=4 6014 B11R1.166 NC(=O)c1ccc(I)cc1Cl Amb23491838 [0,1,1,0,0,0|2,0,0]=4 6015 B11R1.166 NC(=O)c1ccc(I)cc1N Amb24382290 [0,1,1,0,0,0|2,0,0]=4 6016 B11R1.166 NC(=O)c1ccc(N)cc1Br Amb21980127 [0,1,1,0,0,0|2,0,0]=4 6017 B11R1.166 NC(=O)c1ccc(N)cc1Cl Amb1112128 [0,1,1,0,0,0|2,0,0]=4 6018 B11R1.166 NC(=O)c1ccc(N)cc1F Amb13952695 [0,1,1,0,0,0|2,0,0]=4 6019 B11R1.166 NC(=O)c1ccc(N)cc1I Amb26968257 [0,1,1,0,0,0|2,0,0]=4 6020 B11R1.166 NC(=O)c1ccc(N)cc1O Amb22235499 [0,1,1,0,0,0|2,0,0]=4 6021 B11R1.166 NC(=O)c1ccc(O)cc1Br Amb26018143 [0,1,1,0,0,0|2,0,0]=4 6022 B11R1.166 NC(=O)c1ccc(O)cc1Cl Amb18057546 [0,1,1,0,0,0|2,0,0]=4 6023 B11R1.166 NC(=O)c1ccc(O)cc1F Amb23402006 [0,1,1,0,0,0|2,0,0]=4 6024 B11R1.166 NC(=O)c1ccc(O)cc1I Amb25148729 [0,1,1,0,0,0|2,0,0]=4 6025 B11R1.166 NC(=O)c1ccc(O)cc1N Amb24106111 [0,1,1,0,0,0|2,0,0]=4 6026 B11R1.166 NC(=O)c1ccc(O)cc1O Amb6297903 [0,1,1,0,0,0|2,0,0]=4 6027 B11R1.166 NC1=CC(=O)NC=C1C(=O)O Amb18200854 [0,1,1,0,0,0|2,0,0]=4 6028 B11R1.166 Nc1cc(Br)ccc1C(=O)Cl Amb24664173 [0,1,1,0,0,0|2,0,0]=4 6029 B11R1.166 Nc1cc(Br)ccc1C(=O)O Amb6296449 [0,1,1,0,0,0|1,0,0]=3 6030 B11R1.166 Nc1cc(Br)cnc1C(=O)O Amb13889733 [0,1,1,0,0,0|2,0,0]=4 6031 B11R1.166 Nc1cc(Br)cnc1C(=O)O Amb23439154 [0,1,1,0,0,0|2,0,0]=4 6032 B11R1.166 Nc1cc(Cl)c(C(=O)O)cn1 Amb22752803 [0,1,1,0,0,0|2,0,0]=4 6033 B11R1.166 Nc1cc(Cl)ccc1C(=O)Cl Amb22736497 [0,1,1,0,0,0|2,0,0]=4 6034 B11R1.166 Nc1cc(Cl)ccc1C(=O)O Amb2684369 [0,1,1,0,0,0|1,0,0]=3 6035 B11R1.166 Nc1cc(Cl)cnc1C(=O)O Amb22234450 [0,1,1,0,0,0|2,0,0]=4 6036 B11R1.166 Nc1cc(Cl)cnc1C(=O)O Amb22406105 [0,1,1,0,0,0|2,0,0]=4 6037 B11R1.166 Nc1cc(Cl)ncc1C(=O)O Amb22011717 [0,1,1,0,0,0|2,0,0]=4 6038 B11R1.166 Nc1cc(F)c(C(=O)O)cn1 Amb28251563 [0,1,1,0,0,0|2,0,0]=4 6039 B11R1.166 Nc1cc(F)ccc1C(=O)O Amb1229908 [0,1,1,0,0,0|1,0,0]=3 6040 B11R1.166 Nc1cc(F)ccc1C(=O)O Amb22234003 [0,1,1,0,0,0|1,0,0]=3 6041 B11R1.166 Nc1cc(F)ccc1C(=O)[O-] Amb33512983 [0,1,1,0,0,0|1,0,1]=4 6042 B11R1.166 Nc1cc(F)cnc1C(=O)O Amb18830810 [0,1,1,0,0,0|2,0,0]=4 6043 B11R1.166 Nc1cc(F)ncc1C(=O)O Amb26642000 [0,1,1,0,0,0|2,0,0]=4 6044 B11R1.166 Nc1cc(I)ccc1C(=O)O Amb8629779 [0,1,1,0,0,0|1,0,0]=3 6045 B11R1.166 Nc1cc(O)ccc1C(=O)O Amb18125508 [0,1,1,0,0,0|1,0,0]=3 6046 B11R1.166 Nc1ccc(C(=O)Cl)c(Br)c1 Amb27165957 [0,1,1,0,0,0|2,0,0]=4 6047 B11R1.166 Nc1ccc(C(=O)Cl)c(Cl)c1 Amb27470842 [0,1,1,0,0,0|2,0,0]=4 6048 B11R1.166 Nc1ccc(C(=O)Cl)c(I)c1 Amb26866975 [0,1,1,0,0,0|2,0,0]=4 6049 B11R1.166 Nc1ccc(C(=O)F)c(F)c1 Amb27492996 [0,1,1,0,0,0|2,0,0]=4 6050 B11R1.166 Nc1ccc(C(=O)O)c(Br)c1 Amb18657903 [0,1,1,0,0,0|1,0,0]=3 6051 B11R1.166 Nc1ccc(C(=O)O)c(Br)c1 Amb33527621 [0,1,1,0,0,0|1,0,0]=3 6052 B11R1.166 Nc1ccc(C(=O)O)c(Cl)c1 Amb10631465 [0,1,1,0,0,0|1,0,0]=3 6053 B11R1.166 Nc1ccc(C(=O)O)c(Cl)c1 Amb845544 [0,1,1,0,0,0|1,0,0]=3 6054 B11R1.166 Nc1ccc(C(=O)O)c(Cl)n1 Amb27803891 [0,1,1,0,0,0|2,0,0]=4 6055 B11R1.166 Nc1ccc(C(=O)O)c(F)c1 Amb3427847 [0,1,1,0,0,0|1,0,0]=3 6056 B11R1.166 Nc1ccc(C(=O)O)c(F)n1 Amb25188766 [0,1,1,0,0,0|2,0,0]=4 6057 B11R1.166 Nc1ccc(C(=O)O)c(I)c1 Amb13953193 [0,1,1,0,0,0|1,0,0]=3 6058 B11R1.166 Nc1ccc(C(=O)O)c(N)c1 Amb18944997 [0,1,1,0,0,0|1,0,0]=3 6059 B11R1.166 Nc1ccc(C(=O)O)c(N)c1 Amb6297656 [0,1,1,0,0,0|1,0,0]=3 6060 B11R1.166 Nc1ccc(C(=O)O)c(N)n1 Amb22755942 [0,1,1,0,0,0|2,0,0]=4 6061 B11R1.166 Nc1ccc(C(=O)O)c(O)c1 Amb1215242 [0,1,1,0,0,0|1,0,0]=3 6062 B11R1.166 Nc1ccc(C(=O)O)c(O)n1 Amb25794144 [0,1,1,0,0,0|2,0,0]=4 6063 B11R1.166 Nc1ccc(C(=O)O)c(S)c1 Amb22330588 [0,1,1,0,0,0|1,0,0]=3 6064 B11R1.166 Nc1ccc(C(=O)[O-])c(O)c1 Amb3940936 [0,1,1,0,0,0|1,0,1]=4 6065 B11R1.166 Nc1cnc(C(=O)O)c(Br)c1 Amb28284919 [0,1,1,0,0,0|2,0,0]=4 6066 B11R1.166 Nc1cnc(C(=O)O)c(F)c1 Amb26644008 [0,1,1,0,0,0|2,0,0]=4 6067 B11R1.166 Nc1cnc(C(=O)O)c(O)c1 Amb27984701 [0,1,1,0,0,0|2,0,0]=4 6068 B11R1.166 Nc1nc(Br)ccc1C(=O)O Amb19958162 [0,1,1,0,0,0|2,0,0]=4 6069 B11R1.166 Nc1nc(Cl)ccc1C(=O)O Amb10975244 [0,1,1,0,0,0|2,0,0]=4 6070 B11R1.166 Nc1nc(F)ccc1C(=O)O Amb25893102 [0,1,1,0,0,0|2,0,0]=4 6071 B11R1.166 Nc1nc(O)ccc1C(=O)O Amb24429544 [0,1,1,0,0,0|2,0,0]=4 6072 B11R1.166 O=C(Cl)c1ccc(Br)cc1Br Amb19890987 [0,1,1,0,0,0|2,0,0]=4 6073 B11R1.166 O=C(Cl)c1ccc(Br)cc1Cl Amb9672137 [0,1,1,0,0,0|2,0,0]=4 6074 B11R1.166 O=C(Cl)c1ccc(Br)cc1F Amb6743402 [0,1,1,0,0,0|2,0,0]=4 6075 B11R1.166 O=C(Cl)c1ccc(Br)cc1I Amb25978576 [0,1,1,0,0,0|2,0,0]=4 6076 B11R1.166 O=C(Cl)c1ccc(Br)cc1O Amb25921428 [0,1,1,0,0,0|2,0,0]=4 6077 B11R1.166 O=C(Cl)c1ccc(Cl)cc1Br Amb19891049 [0,1,1,0,0,0|2,0,0]=4 6078 B11R1.166 O=C(Cl)c1ccc(Cl)cc1Cl Amb2725606 [0,1,1,0,0,0|2,0,0]=4 6079 B11R1.166 O=C(Cl)c1ccc(Cl)cc1F Amb2685968 [0,1,1,0,0,0|2,0,0]=4 6080 B11R1.166 O=C(Cl)c1ccc(Cl)cc1O Amb6743392 [0,1,1,0,0,0|2,0,0]=4 6081 B11R1.166 O=C(Cl)c1ccc(F)cc1Br Amb6743367 [0,1,1,0,0,0|2,0,0]=4 6082 B11R1.166 O=C(Cl)c1ccc(F)cc1Cl Amb2685963 [0,1,1,0,0,0|2,0,0]=4 6083 B11R1.166 O=C(Cl)c1ccc(F)cc1F Amb2687085 [0,1,1,0,0,0|2,0,0]=4 6084 B11R1.166 O=C(Cl)c1ccc(F)cc1I Amb22738939 [0,1,1,0,0,0|2,0,0]=4 6085 B11R1.166 O=C(Cl)c1ccc(I)cc1Br Amb28186473 [0,1,1,0,0,0|2,0,0]=4 6086 B11R1.166 O=C(Cl)c1ccc(I)cc1Cl Amb24126347 [0,1,1,0,0,0|2,0,0]=4 6087 B11R1.166 O=C(Cl)c1ccc(I)cc1F Amb27393498 [0,1,1,0,0,0|2,0,0]=4 6088 B11R1.166 O=C(Cl)c1ccc(O)cc1Br Amb26318391 [0,1,1,0,0,0|2,0,0]=4 6089 B11R1.166 O=C(Cl)c1ccc(O)cc1F Amb27453509 [0,1,1,0,0,0|2,0,0]=4 6090 B11R1.166 O=C(F)c1ccc(Br)cc1Cl Amb27804184 [0,1,1,0,0,0|2,0,0]=4 6091 B11R1.166 O=C(F)c1ccc(Cl)cc1F Amb26322718 [0,1,1,0,0,0|2,0,0]=4 6092 B11R1.166 O=C(F)c1ccc(F)cc1Cl Amb25311807 [0,1,1,0,0,0|2,0,0]=4 6093 B11R1.166 O=C(O)C1=CC=C(Cl)NC1=O Amb33548217 [0,1,1,0,0,0|2,0,0]=4 6094 B11R1.166 O=C(O)C1=CC=C(O)NC1=O Amb22235158 [0,1,1,0,0,0|2,0,0]=4 6095 B11R1.166 O=C(O)c1ccc(Br)cc1Br Amb10069353 [0,1,1,0,0,0|1,0,0]=3 6096 B11R1.166 O=C(O)c1ccc(Br)cc1Cl Amb3939978 [0,1,1,0,0,0|1,0,0]=3 6097 B11R1.166 O=C(O)c1ccc(Br)cc1F Amb1229903 [0,1,1,0,0,0|1,0,0]=3 6098 B11R1.166 O=C(O)c1ccc(Br)cc1I Amb16231633 [0,1,1,0,0,0|1,0,0]=3 6099 B11R1.166 O=C(O)c1ccc(Br)cc1O Amb33528931 [0,1,1,0,0,0|1,0,0]=3 6100 B11R1.166 O=C(O)c1ccc(Br)cc1S Amb20622936 [0,1,1,0,0,0|1,0,0]=3 6101 B11R1.166 O=C(O)c1ccc(Br)nc1Br Amb16231966 [0,1,1,0,0,0|2,0,0]=4 6102 B11R1.166 O=C(O)c1ccc(Br)nc1Cl Amb13889829 [0,1,1,0,0,0|2,0,0]=4 6103 B11R1.166 O=C(O)c1ccc(Br)nc1F Amb25790475 [0,1,1,0,0,0|2,0,0]=4 6104 B11R1.166 O=C(O)c1ccc(Br)nc1O Amb26849872 [0,1,1,0,0,0|2,0,0]=4 6105 B11R1.166 O=C(O)c1ccc(Cl)cc1Br Amb2684993 [0,1,1,0,0,0|1,0,0]=3 6106 B11R1.166 O=C(O)c1ccc(Cl)cc1Cl Amb1933216 [0,1,1,0,0,0|1,0,0]=3 6107 B11R1.166 O=C(O)c1ccc(Cl)cc1F Amb1228486 [0,1,1,0,0,0|1,0,0]=3 6108 B11R1.166 O=C(O)c1ccc(Cl)cc1I Amb1125469 [0,1,1,0,0,0|1,0,0]=3 6109 B11R1.166 O=C(O)c1ccc(Cl)cc1O Amb3940316 [0,1,1,0,0,0|1,0,0]=3 6110 B11R1.166 O=C(O)c1ccc(Cl)cc1S Amb18280981 [0,1,1,0,0,0|1,0,0]=3 6111 B11R1.166 O=C(O)c1ccc(Cl)nc1Cl Amb534995 [0,1,1,0,0,0|2,0,0]=4 6112 B11R1.166 O=C(O)c1ccc(Cl)nc1F Amb22234583 [0,1,1,0,0,0|2,0,0]=4 6113 B11R1.166 O=C(O)c1ccc(Cl)nc1O Amb21856158 [0,1,1,0,0,0|2,0,0]=4 6114 B11R1.166 O=C(O)c1ccc(F)cc1Br Amb1228455 [0,1,1,0,0,0|1,0,0]=3 6115 B11R1.166 O=C(O)c1ccc(F)cc1Cl Amb2685948 [0,1,1,0,0,0|1,0,0]=3 6116 B11R1.166 O=C(O)c1ccc(F)cc1F Amb2687071 [0,1,1,0,0,0|1,0,0]=3 6117 B11R1.166 O=C(O)c1ccc(F)cc1I Amb1130134 [0,1,1,0,0,0|1,0,0]=3 6118 B11R1.166 O=C(O)c1ccc(F)cc1O Amb33531195 [0,1,1,0,0,0|1,0,0]=3 6119 B11R1.166 O=C(O)c1ccc(F)cc1S Amb2371919 [0,1,1,0,0,0|1,0,0]=3 6120 B11R1.166 O=C(O)c1ccc(F)nc1Br Amb26855874 [0,1,1,0,0,0|2,0,0]=4 6121 B11R1.166 O=C(O)c1ccc(F)nc1Cl Amb21964648 [0,1,1,0,0,0|2,0,0]=4 6122 B11R1.166 O=C(O)c1ccc(F)nc1F Amb2447583 [0,1,1,0,0,0|2,0,0]=4 6123 B11R1.166 O=C(O)c1ccc(F)nc1I Amb27663272 [0,1,1,0,0,0|2,0,0]=4 6124 B11R1.166 O=C(O)c1ccc(F)nc1O Amb27246860 [0,1,1,0,0,0|2,0,0]=4 6125 B11R1.166 O=C(O)c1ccc(I)cc1Br Amb16231627 [0,1,1,0,0,0|1,0,0]=3 6126 B11R1.166 O=C(O)c1ccc(I)cc1Cl Amb845610 [0,1,1,0,0,0|1,0,0]=3 6127 B11R1.166 O=C(O)c1ccc(I)cc1F Amb8628258 [0,1,1,0,0,0|1,0,0]=3 6128 B11R1.166 O=C(O)c1ccc(I)cc1I Amb25891482 [0,1,1,0,0,0|1,0,0]=3 6129 B11R1.166 O=C(O)c1ccc(I)cc1O Amb33532095 [0,1,1,0,0,0|1,0,0]=3 6130 B11R1.166 O=C(O)c1ccc(I)cc1S Amb25922904 [0,1,1,0,0,0|1,0,0]=3 6131 B11R1.166 O=C(O)c1ccc(O)cc1Br Amb22492055 [0,1,1,0,0,0|1,0,0]=3 6132 B11R1.166 O=C(O)c1ccc(O)cc1Cl Amb19894796 [0,1,1,0,0,0|1,0,0]=3 6133 B11R1.166 O=C(O)c1ccc(O)cc1Cl Amb2720213 [0,1,1,0,0,0|1,0,0]=3 6134 B11R1.166 O=C(O)c1ccc(O)cc1F Amb6296326 [0,1,1,0,0,0|1,0,0]=3 6135 B11R1.166 O=C(O)c1ccc(O)cc1O Amb1934138 [0,1,1,0,0,0|1,0,0]=3 6136 B11R1.166 O=C(O)c1ccc(O)cc1S Amb28068121 [0,1,1,0,0,0|1,0,0]=3 6137 B11R1.166 O=C(O)c1ccc(O)nc1Cl Amb8630411 [0,1,1,0,0,0|2,0,0]=4 6138 B11R1.166 O=C(O)c1ccc(S)cc1Cl Amb18280754 [0,1,1,0,0,0|1,0,0]=3 6139 B11R1.166 O=C(O)c1ccc(S)cc1F Amb25106908 [0,1,1,0,0,0|1,0,0]=3 6140 B11R1.166 O=C(O)c1ccc(S)cc1I Amb26851539 [0,1,1,0,0,0|1,0,0]=3 6141 B11R1.166 O=C(O)c1ccc(S)cc1O Amb26966998 [0,1,1,0,0,0|1,0,0]=3 6142 B11R1.166 O=C(O)c1cnc(Br)cc1Br Amb21963404 [0,1,1,0,0,0|2,0,0]=4 6143 B11R1.166 O=C(O)c1cnc(Br)cc1Cl Amb22728815 [0,1,1,0,0,0|2,0,0]=4 6144 B11R1.166 O=C(O)c1cnc(Br)cc1F Amb22235315 [0,1,1,0,0,0|2,0,0]=4 6145 B11R1.166 O=C(O)c1cnc(Br)cc1I Amb24532489 [0,1,1,0,0,0|2,0,0]=4 6146 B11R1.166 O=C(O)c1cnc(Cl)cc1Br Amb22899057 [0,1,1,0,0,0|2,0,0]=4 6147 B11R1.166 O=C(O)c1cnc(Cl)cc1Cl Amb2609523 [0,1,1,0,0,0|2,0,0]=4 6148 B11R1.166 O=C(O)c1cnc(Cl)cc1I Amb25217594 [0,1,1,0,0,0|2,0,0]=4 6149 B11R1.166 O=C(O)c1cnc(F)cc1Br Amb26965667 [0,1,1,0,0,0|2,0,0]=4 6150 B11R1.166 O=C(O)c1cnc(F)cc1Cl Amb25152836 [0,1,1,0,0,0|2,0,0]=4 6151 B11R1.166 O=C(O)c1cnc(F)cc1F Amb8389954 [0,1,1,0,0,0|2,0,0]=4 6152 B11R1.166 O=C(O)c1cnc(F)cc1I Amb26452579 [0,1,1,0,0,0|2,0,0]=4 6153 B11R1.166 O=C(O)c1cnc(F)cc1O Amb24738558 [0,1,1,0,0,0|2,0,0]=4 6154 B11R1.166 O=C(O)c1cnc(I)cc1F Amb28143180 [0,1,1,0,0,0|2,0,0]=4 6155 B11R1.166 O=C(O)c1cnc(I)cc1O Amb28200537 [0,1,1,0,0,0|2,0,0]=4 6156 B11R1.166 O=C(O)c1cnc(O)cc1Cl Amb21963416 [0,1,1,0,0,0|2,0,0]=4 6157 B11R1.166 O=C(O)c1cnc(O)cc1F Amb26593444 [0,1,1,0,0,0|2,0,0]=4 6158 B11R1.166 O=C(O)c1cnc(O)cc1O Amb2773495 [0,1,1,0,0,0|2,0,0]=4 6159 B11R1.166 O=C(O)c1ncc(Br)cc1Br Amb10602192 [0,1,1,0,0,0|2,0,0]=4 6160 B11R1.166 O=C(O)c1ncc(Br)cc1Cl Amb10842154 [0,1,1,0,0,0|2,0,0]=4 6161 B11R1.166 O=C(O)c1ncc(Br)cc1F Amb10840679 [0,1,1,0,0,0|2,0,0]=4 6162 B11R1.166 O=C(O)c1ncc(Br)cc1O Amb20241848 [0,1,1,0,0,0|2,0,0]=4 6163 B11R1.166 O=C(O)c1ncc(Br)cc1O Amb32680458 [0,1,1,0,0,0|2,0,0]=4 6164 B11R1.166 O=C(O)c1ncc(Cl)cc1Br Amb10842145 [0,1,1,0,0,0|2,0,0]=4 6165 B11R1.166 O=C(O)c1ncc(Cl)cc1Cl Amb2610029 [0,1,1,0,0,0|2,0,0]=4 6166 B11R1.166 O=C(O)c1ncc(Cl)cc1F Amb10840678 [0,1,1,0,0,0|2,0,0]=4 6167 B11R1.166 O=C(O)c1ncc(Cl)cc1O Amb28461116 [0,1,1,0,0,0|2,0,0]=4 6168 B11R1.166 O=C(O)c1ncc(F)cc1Br Amb19895368 [0,1,1,0,0,0|2,0,0]=4 6169 B11R1.166 O=C(O)c1ncc(F)cc1Cl Amb19894424 [0,1,1,0,0,0|2,0,0]=4 6170 B11R1.166 O=C(O)c1ncc(F)cc1F Amb10603657 [0,1,1,0,0,0|2,0,0]=4 6171 B11R1.166 O=C(O)c1ncc(F)cc1I Amb26566279 [0,1,1,0,0,0|2,0,0]=4 6172 B11R1.166 O=C(O)c1ncc(F)cc1O Amb25831206 [0,1,1,0,0,0|2,0,0]=4 6173 B11R1.166 O=C(O)c1ncc(I)cc1F Amb27597460 [0,1,1,0,0,0|2,0,0]=4 6174 B11R1.166 O=C(O)c1ncc(O)cc1Br Amb24356225 [0,1,1,0,0,0|2,0,0]=4 6175 B11R1.166 O=C(O)c1ncc(O)cc1F Amb27668860 [0,1,1,0,0,0|2,0,0]=4 6176 B11R1.166 O=C([O-])c1ccc(F)cc1Cl Amb32653070 [0,1,1,0,0,0|1,0,1]=4 6177 B11R1.166 O=C([O-])c1ccc(F)cc1F Amb8397066 [0,1,1,0,0,0|1,0,1]=4 6178 B11R1.166 O=C1C=C(O)C(C(=O)O)=CN1 Amb18200554 [0,1,1,0,0,0|2,0,0]=4 6179 B11R1.166 O=C1C=CC(C(=O)O)=C(Br)N1 Amb26527431 [0,1,1,0,0,0|2,0,0]=4 6180 B11R1.166 O=C1C=CC(C(=O)O)=C(F)N1 Amb25983402 [0,1,1,0,0,0|2,0,0]=4 6181 B11R1.166 O=S(O)c1ccc(Br)cc1Cl Amb27203719 [0,1,1,0,0,0|2,0,0]=4 6182 B11R1.166 O=S(O)c1ccc(Cl)cc1Cl Amb32667338 [0,1,1,0,0,0|2,0,0]=4 6183 B11R1.166 O=S(O)c1ccc(F)cc1F Amb18862927 [0,1,1,0,0,0|2,0,0]=4 6184 B11R1.167 CC(=O)C1=CC(=O)C=CC1=O Amb25347519 [0,1,1,0,0,0|2,0,0]=4 6185 B11R1.167 CC(=O)c1c[n+]([O-])ccc1C Amb27848307 [0,1,1,0,0,0|2,0,0]=4 6186 B11R1.167 CC(=O)c1cc(Br)ccc1Br Amb6298596 [0,1,1,0,0,0|2,0,0]=4 6187 B11R1.167 CC(=O)c1cc(Br)ccc1C Amb33533265 [0,1,1,0,0,0|1,0,0]=3 6188 B11R1.167 CC(=O)c1cc(Br)ccc1Cl Amb6297577 [0,1,1,0,0,0|2,0,0]=4 6189 B11R1.167 CC(=O)c1cc(Br)ccc1F Amb10603335 [0,1,1,0,0,0|2,0,0]=4 6190 B11R1.167 CC(=O)c1cc(Br)ccc1I Amb22898870 [0,1,1,0,0,0|2,0,0]=4 6191 B11R1.167 CC(=O)c1cc(Br)ccc1N Amb18131680 [0,1,1,0,0,0|2,0,0]=4 6192 B11R1.167 CC(=O)c1cc(Br)ccc1O Amb1233024 [0,1,1,0,0,0|2,0,0]=4 6193 B11R1.167 CC(=O)c1cc(Br)cnc1C Amb23401868 [0,1,1,0,0,0|2,0,0]=4 6194 B11R1.167 CC(=O)c1cc(Br)cnc1C Amb35750878 [0,1,1,0,0,0|2,0,0]=4 6195 B11R1.167 CC(=O)c1cc(C)ccc1Br Amb8427146 [0,1,1,0,0,0|2,0,0]=4 6196 B11R1.167 CC(=O)c1cc(C)ccc1C Amb6356940 [0,1,1,0,0,0|1,0,0]=3 6197 B11R1.167 CC(=O)c1cc(C)ccc1Cl Amb8427145 [0,1,1,0,0,0|2,0,0]=4 6198 B11R1.167 CC(=O)c1cc(C)ccc1F Amb8397101 [0,1,1,0,0,0|2,0,0]=4 6199 B11R1.167 CC(=O)c1cc(C)ccc1I Amb25775991 [0,1,1,0,0,0|2,0,0]=4 6200 B11R1.167 CC(=O)c1cc(C)ccc1N Amb18124987 [0,1,1,0,0,0|2,0,0]=4 6201 B11R1.167 CC(=O)c1cc(C)ccc1O Amb6323798 [0,1,1,0,0,0|2,0,0]=4 6202 B11R1.167 CC(=O)c1cc(C)cnc1C Amb26910707 [0,1,1,0,0,0|2,0,0]=4 6203 B11R1.167 CC(=O)c1cc(Cl)ccc1Br Amb19958373 [0,1,1,0,0,0|2,0,0]=4 6204 B11R1.167 CC(=O)c1cc(Cl)ccc1C Amb17334750 [0,1,1,0,0,0|1,0,0]=3 6205 B11R1.167 CC(=O)c1cc(Cl)ccc1Cl Amb1648831 [0,1,1,0,0,0|2,0,0]=4 6206 B11R1.167 CC(=O)c1cc(Cl)ccc1F Amb10607085 [0,1,1,0,0,0|2,0,0]=4 6207 B11R1.167 CC(=O)c1cc(Cl)ccc1I Amb24445269 [0,1,1,0,0,0|2,0,0]=4 6208 B11R1.167 CC(=O)c1cc(Cl)ccc1N Amb10603304 [0,1,1,0,0,0|2,0,0]=4 6209 B11R1.167 CC(=O)c1cc(Cl)ccc1O Amb1656443 [0,1,1,0,0,0|2,0,0]=4 6210 B11R1.167 CC(=O)c1cc(Cl)ncc1C Amb24442362 [0,1,1,0,0,0|2,0,0]=4 6211 B11R1.167 CC(=O)c1cc(F)ccc1Br Amb16231711 [0,1,1,0,0,0|2,0,0]=4 6212 B11R1.167 CC(=O)c1cc(F)ccc1C Amb18181711 [0,1,1,0,0,0|1,0,0]=3 6213 B11R1.167 CC(=O)c1cc(F)ccc1Cl Amb8396790 [0,1,1,0,0,0|2,0,0]=4 6214 B11R1.167 CC(=O)c1cc(F)ccc1F Amb1651628 [0,1,1,0,0,0|2,0,0]=4 6215 B11R1.167 CC(=O)c1cc(F)ccc1I Amb8393597 [0,1,1,0,0,0|2,0,0]=4 6216 B11R1.167 CC(=O)c1cc(F)ccc1N Amb33533575 [0,1,1,0,0,0|2,0,0]=4 6217 B11R1.167 CC(=O)c1cc(F)ccc1O Amb1639929 [0,1,1,0,0,0|2,0,0]=4 6218 B11R1.167 CC(=O)c1cc(F)ccc1S Amb28351397 [0,1,1,0,0,0|2,0,0]=4 6219 B11R1.167 CC(=O)c1cc(I)ccc1Br Amb27168880 [0,1,1,0,0,0|2,0,0]=4 6220 B11R1.167 CC(=O)c1cc(I)ccc1C Amb25305787 [0,1,1,0,0,0|1,0,0]=3 6221 B11R1.167 CC(=O)c1cc(I)ccc1Cl Amb25132894 [0,1,1,0,0,0|2,0,0]=4 6222 B11R1.167 CC(=O)c1cc(I)ccc1F Amb10840843 [0,1,1,0,0,0|2,0,0]=4 6223 B11R1.167 CC(=O)c1cc(I)ccc1N Amb22057889 [0,1,1,0,0,0|2,0,0]=4 6224 B11R1.167 CC(=O)c1cc(I)cnc1C Amb23400968 [0,1,1,0,0,0|2,0,0]=4 6225 B11R1.167 CC(=O)c1cc(N)ccc1Br Amb21858570 [0,1,1,0,0,0|2,0,0]=4 6226 B11R1.167 CC(=O)c1cc(N)ccc1C Amb19878046 [0,1,1,0,0,0|1,0,0]=3 6227 B11R1.167 CC(=O)c1cc(N)ccc1F Amb28652931 [0,1,1,0,0,0|2,0,0]=4 6228 B11R1.167 CC(=O)c1cc(N)ccc1F Amb4477311 [0,1,1,0,0,0|2,0,0]=4 6229 B11R1.167 CC(=O)c1cc(N)ccc1N Amb26512045 [0,1,1,0,0,0|2,0,0]=4 6230 B11R1.167 CC(=O)c1cc(N)ccc1O Amb2697318 [0,1,1,0,0,0|2,0,0]=4 6231 B11R1.167 CC(=O)c1cc(N)cnc1C Amb23400970 [0,1,1,0,0,0|2,0,0]=4 6232 B11R1.167 CC(=O)c1cc(O)ccc1Br Amb22886920 [0,1,1,0,0,0|2,0,0]=4 6233 B11R1.167 CC(=O)c1cc(O)ccc1C Amb22752390 [0,1,1,0,0,0|1,0,0]=3 6234 B11R1.167 CC(=O)c1cc(O)ccc1Cl Amb18126736 [0,1,1,0,0,0|2,0,0]=4 6235 B11R1.167 CC(=O)c1cc(O)ccc1F Amb8397098 [0,1,1,0,0,0|2,0,0]=4 6236 B11R1.167 CC(=O)c1cc(O)ccc1I Amb25891801 [0,1,1,0,0,0|2,0,0]=4 6237 B11R1.167 CC(=O)c1cc(O)ccc1N Amb21964114 [0,1,1,0,0,0|2,0,0]=4 6238 B11R1.167 CC(=O)c1cc(O)ccc1O Amb1299878 [0,1,1,0,0,0|2,0,0]=4 6239 B11R1.167 CC(=O)c1cc(O)cnc1C Amb23400416 [0,1,1,0,0,0|2,0,0]=4 6240 B11R1.167 CC1=C(C(=O)O)NC(=O)C=C1 Amb18125522 [0,1,1,0,0,0|1,0,0]=3 6241 B11R1.167 CC1=CNC(=N)C=C1C(=O)O Amb24532996 [0,1,1,0,0,0|1,0,0]=3 6242 B11R1.167 CC1=CNC(=O)C(C(=O)O)=C1 Amb18947810 [0,1,1,0,0,0|2,0,0]=4 6243 B11R1.167 CC1=CNC(=O)C=C1C(=O)O Amb18201203 [0,1,1,0,0,0|1,0,0]=3 6244 B11R1.167 CC1=COC(=O)C(C(=O)O)=C1 Amb27614427 [0,1,1,0,0,0|2,0,0]=4 6245 B11R1.167 CC1=NNC(=O)C=C1C(=O)O Amb26893178 [0,1,1,0,0,0|2,0,0]=4 6246 B11R1.167 CN1C=CC(=N)C(C(=O)O)=C1 Amb27607673 [0,1,1,0,0,0|2,0,0]=4 6247 B11R1.167 CN1C=CC(=O)C(C(=O)O)=C1 Amb21811937 [0,1,1,0,0,0|2,0,0]=4 6248 B11R1.167 CN1C=CC(=S)C=C1C(=O)O Amb27983668 [0,1,1,0,0,0|1,0,0]=3 6249 B11R1.167 Cc1[nH+]cc(Cl)cc1C(=O)O Amb24113236 [0,1,1,0,0,0|1,0,0]=3 6250 B11R1.167 Cc1cc(C(=O)O)c(Br)cn1 Amb18770697 [0,1,1,0,0,0|2,0,0]=4 6251 B11R1.167 Cc1cc(C(=O)O)c(C)cn1 Amb25172790 [0,1,1,0,0,0|1,0,0]=3 6252 B11R1.167 Cc1cc(C(=O)O)c(C)cn1 Amb33329092 [0,1,1,0,0,0|1,0,0]=3 6253 B11R1.167 Cc1cc(C(=O)O)c(C)nn1 Amb5757305 [0,1,1,0,0,0|2,0,0]=4 6254 B11R1.167 Cc1cc(C(=O)O)c(Cl)cn1 Amb22235316 [0,1,1,0,0,0|2,0,0]=4 6255 B11R1.167 Cc1cc(C(=O)O)c(F)cn1 Amb18830926 [0,1,1,0,0,0|2,0,0]=4 6256 B11R1.167 Cc1cc(C(=O)O)c(N)cn1 Amb18201420 [0,1,1,0,0,0|2,0,0]=4 6257 B11R1.167 Cc1cc(C(=O)O)c(N)cn1 Amb22405967 [0,1,1,0,0,0|2,0,0]=4 6258 B11R1.167 Cc1cc(C(=O)O)c(O)cn1 Amb22587559 [0,1,1,0,0,0|2,0,0]=4 6259 B11R1.167 Cc1cc[n+](C)cc1C(N)=O Amb2609644 [0,1,1,0,0,0|2,0,0]=4 6260 B11R1.167 Cc1cc[n+](C)cc1C(N)=O Amb33804058 [0,1,1,0,0,0|2,0,0]=4 6261 B11R1.167 Cc1cc[n+]([O-])cc1C(=O)O Amb17843890 [0,1,1,0,0,0|1,0,0]=3 6262 B11R1.167 Cc1cc[n+]([O-])cc1C(N)=O Amb17843889 [0,1,1,0,0,0|2,0,0]=4 6263 B11R1.167 Cc1ccc(Br)c(C(=O)Cl)c1 Amb8384795 [0,1,1,0,0,0|2,0,0]=4 6264 B11R1.167 Cc1ccc(Br)c(C(=O)O)c1 Amb2685316 [0,1,1,0,0,0|1,0,0]=3 6265 B11R1.167 Cc1ccc(Br)c(C(=O)O)n1 Amb21962442 [0,1,1,0,0,0|2,0,0]=4 6266 B11R1.167 Cc1ccc(Br)c(C(=O)O)n1 Amb31204727 [0,1,1,0,0,0|2,0,0]=4 6267 B11R1.167 Cc1ccc(Br)cc1B(O)O Amb21856472 [0,1,1,0,0,0|1,0,1]=4 6268 B11R1.167 Cc1ccc(Br)cc1C(=N)N Amb25761254 [0,1,1,0,0,0|2,0,0]=4 6269 B11R1.167 Cc1ccc(Br)cc1C(=O)Cl Amb19888810 [0,1,1,0,0,0|1,0,0]=3 6270 B11R1.167 Cc1ccc(Br)cc1C(=O)O Amb2610499 [0,1,1,0,0,0|0,0,0]=2 6271 B11R1.167 Cc1ccc(Br)cc1C(C)O Amb27856457 [0,1,1,0,0,0|1,0,1]=4 6272 B11R1.167 Cc1ccc(Br)cc1C(N)=O Amb22491784 [0,1,1,0,0,0|1,0,0]=3 6273 B11R1.167 Cc1ccc(Br)cc1C(N)=S Amb26330106 [0,1,1,0,0,0|1,1,0]=4 6274 B11R1.167 Cc1ccc(Br)cc1N(=O)=O Amb6364894 [0,1,1,0,0,0|1,0,1]=4 6275 B11R1.167 Cc1ccc(Br)cc1S(=O)[O-] Amb26405337 [0,1,1,0,0,0|1,0,1]=4 6276 B11R1.167 Cc1ccc(Br)cc1[C@@H](C)O Amb27456457 [0,1,1,0,0,0|1,0,1]=4 6277 B11R1.167 Cc1ccc(Br)cc1[C@H](C)O Amb25356090 [0,1,1,0,0,0|1,0,1]=4 6278 B11R1.167 Cc1ccc(Br)cc1[N+](=O)[O-] Amb2731358 [0,1,1,0,0,0|1,0,1]=4 6279 B11R1.167 Cc1ccc(Br)nc1C(=O)O Amb33549279 [0,1,1,0,0,0|1,0,0]=3 6280 B11R1.167 Cc1ccc(Br)nc1C(N)=O Amb27807494 [0,1,1,0,0,0|2,0,0]=4 6281 B11R1.167 Cc1ccc(C)c(B(O)O)c1 Amb3939378 [0,1,1,0,0,0|1,0,1]=4 6282 B11R1.167 Cc1ccc(C)c(C(=N)N)c1 Amb2695866 [0,1,1,0,0,0|2,0,0]=4 6283 B11R1.167 Cc1ccc(C)c(C(=O)Cl)c1 Amb6743388 [0,1,1,0,0,0|1,0,0]=3 6284 B11R1.167 Cc1ccc(C)c(C(=O)O)c1 Amb6335835 [0,1,1,0,0,0|0,0,0]=2 6285 B11R1.167 Cc1ccc(C)c(C(=O)O)n1 Amb18125241 [0,1,1,0,0,0|1,0,0]=3 6286 B11R1.167 Cc1ccc(C)c(C(=O)O)n1 Amb33482660 [0,1,1,0,0,0|1,0,0]=3 6287 B11R1.167 Cc1ccc(C)c(C(C)O)c1 Amb1110380 [0,1,1,0,0,0|1,0,1]=4 6288 B11R1.167 Cc1ccc(C)c(C(N)=O)c1 Amb3747623 [0,1,1,0,0,0|1,0,0]=3 6289 B11R1.167 Cc1ccc(C)c(C(N)=S)c1 Amb17232569 [0,1,1,0,0,0|1,1,0]=4 6290 B11R1.167 Cc1ccc(C)c(C(O)=S)c1 Amb27236265 [0,1,1,0,0,0|0,1,0]=3 6291 B11R1.167 Cc1ccc(C)c(N(=O)=O)c1 Amb20621120 [0,1,1,0,0,0|1,0,1]=4 6292 B11R1.167 Cc1ccc(C)c(S(=O)Cl)c1 Amb18564460 [0,1,1,0,0,0|2,0,0]=4 6293 B11R1.167 Cc1ccc(C)c(S(=O)O)c1 Amb18065476 [0,1,1,0,0,0|1,0,0]=3 6294 B11R1.167 Cc1ccc(C)c(S(=O)[O-])c1 Amb28068363 [0,1,1,0,0,0|1,0,1]=4 6295 B11R1.167 Cc1ccc(C)c([C@@H](C)O)c1 Amb6893605 [0,1,1,0,0,0|1,0,1]=4 6296 B11R1.167 Cc1ccc(C)c([C@H](C)O)c1 Amb6893604 [0,1,1,0,0,0|1,0,1]=4 6297 B11R1.167 Cc1ccc(C)c([N+](=O)[O-])c1 Amb4016418 [0,1,1,0,0,0|1,0,1]=4 6298 B11R1.167 Cc1ccc(Cl)c(C(=O)Cl)c1 Amb19891039 [0,1,1,0,0,0|2,0,0]=4 6299 B11R1.167 Cc1ccc(Cl)c(C(=O)O)c1 Amb2686193 [0,1,1,0,0,0|1,0,0]=3 6300 B11R1.167 Cc1ccc(Cl)c(C(=O)O)n1 Amb22002135 [0,1,1,0,0,0|2,0,0]=4 6301 B11R1.167 Cc1ccc(Cl)c(C(N)=O)c1 Amb22043941 [0,1,1,0,0,0|2,0,0]=4 6302 B11R1.167 Cc1ccc(Cl)cc1B(O)O Amb2447262 [0,1,1,0,0,0|1,0,1]=4 6303 B11R1.167 Cc1ccc(Cl)cc1C(=N)N Amb2696073 [0,1,1,0,0,0|2,0,0]=4 6304 B11R1.167 Cc1ccc(Cl)cc1C(=O)Cl Amb19891038 [0,1,1,0,0,0|1,0,0]=3 6305 B11R1.167 Cc1ccc(Cl)cc1C(=O)O Amb2686197 [0,1,1,0,0,0|0,0,0]=2 6306 B11R1.167 Cc1ccc(Cl)cc1C(C)O Amb17322834 [0,1,1,0,0,0|1,0,1]=4 6307 B11R1.167 Cc1ccc(Cl)cc1C(N)=O Amb17334783 [0,1,1,0,0,0|1,0,0]=3 6308 B11R1.167 Cc1ccc(Cl)cc1C(N)=S Amb10789227 [0,1,1,0,0,0|1,1,0]=4 6309 B11R1.167 Cc1ccc(Cl)cc1C(O)=S Amb24358360 [0,1,1,0,0,0|0,1,0]=3 6310 B11R1.167 Cc1ccc(Cl)cc1S(=O)Cl Amb28199636 [0,1,1,0,0,0|2,0,0]=4 6311 B11R1.167 Cc1ccc(Cl)cc1S(=O)[O-] Amb27479556 [0,1,1,0,0,0|1,0,1]=4 6312 B11R1.167 Cc1ccc(Cl)cc1[N+](=O)[O-] Amb17674340 [0,1,1,0,0,0|1,0,1]=4 6313 B11R1.167 Cc1ccc(Cl)nc1C(=O)O Amb18825385 [0,1,1,0,0,0|1,0,0]=3 6314 B11R1.167 Cc1ccc(F)c(C(=O)Cl)c1 Amb2684162 [0,1,1,0,0,0|2,0,0]=4 6315 B11R1.167 Cc1ccc(F)c(C(=O)O)c1 Amb2684161 [0,1,1,0,0,0|1,0,0]=3 6316 B11R1.167 Cc1ccc(F)c(C(=O)O)n1 Amb19895374 [0,1,1,0,0,0|2,0,0]=4 6317 B11R1.167 Cc1ccc(F)c(C(N)=O)c1 Amb18799450 [0,1,1,0,0,0|2,0,0]=4 6318 B11R1.167 Cc1ccc(F)cc1B(O)O Amb2447267 [0,1,1,0,0,0|1,0,1]=4 6319 B11R1.167 Cc1ccc(F)cc1C(=N)N Amb22304681 [0,1,1,0,0,0|2,0,0]=4 6320 B11R1.167 Cc1ccc(F)cc1C(=N)N Amb2696601 [0,1,1,0,0,0|2,0,0]=4 6321 B11R1.167 Cc1ccc(F)cc1C(=O)Cl Amb2688195 [0,1,1,0,0,0|1,0,0]=3 6322 B11R1.167 Cc1ccc(F)cc1C(=O)O Amb1229971 [0,1,1,0,0,0|0,0,0]=2 6323 B11R1.167 Cc1ccc(F)cc1C(C)O Amb18181871 [0,1,1,0,0,0|1,0,1]=4 6324 B11R1.167 Cc1ccc(F)cc1C(N)=O Amb2688183 [0,1,1,0,0,0|1,0,0]=3 6325 B11R1.167 Cc1ccc(F)cc1C(N)=S Amb18183551 [0,1,1,0,0,0|1,1,0]=4 6326 B11R1.167 Cc1ccc(F)cc1C(O)=S Amb25709802 [0,1,1,0,0,0|0,1,0]=3 6327 B11R1.167 Cc1ccc(F)cc1N(=O)=O Amb8386181 [0,1,1,0,0,0|1,0,1]=4 6328 B11R1.167 Cc1ccc(F)cc1S(=O)Cl Amb27203726 [0,1,1,0,0,0|2,0,0]=4 6329 B11R1.167 Cc1ccc(F)cc1S(=O)[O-] Amb19944449 [0,1,1,0,0,0|1,0,1]=4 6330 B11R1.167 Cc1ccc(F)cc1[C@@H](C)O Amb26868414 [0,1,1,0,0,0|1,0,1]=4 6331 B11R1.167 Cc1ccc(F)cc1[C@H](C)O Amb26352099 [0,1,1,0,0,0|1,0,1]=4 6332 B11R1.167 Cc1ccc(F)cc1[N+](=O)[O-] Amb2688276 [0,1,1,0,0,0|1,0,1]=4 6333 B11R1.167 Cc1ccc(I)c(C(=O)Cl)c1 Amb24581143 [0,1,1,0,0,0|2,0,0]=4 6334 B11R1.167 Cc1ccc(I)c(C(=O)O)c1 Amb2688854 [0,1,1,0,0,0|1,0,0]=3 6335 B11R1.167 Cc1ccc(I)c(C(=O)O)n1 Amb28040736 [0,1,1,0,0,0|2,0,0]=4 6336 B11R1.167 Cc1ccc(I)c(C(N)=O)c1 Amb2760421 [0,1,1,0,0,0|2,0,0]=4 6337 B11R1.167 Cc1ccc(I)cc1B(O)O Amb25883554 [0,1,1,0,0,0|1,0,1]=4 6338 B11R1.167 Cc1ccc(I)cc1C(=O)Cl Amb27463184 [0,1,1,0,0,0|1,0,0]=3 6339 B11R1.167 Cc1ccc(I)cc1C(=O)O Amb17835261 [0,1,1,0,0,0|0,0,0]=2 6340 B11R1.167 Cc1ccc(I)cc1C(N)=O Amb25325852 [0,1,1,0,0,0|1,0,0]=3 6341 B11R1.167 Cc1ccc(I)cc1C(O)=S Amb26596351 [0,1,1,0,0,0|0,1,0]=3 6342 B11R1.167 Cc1ccc(I)cc1N(=O)=O Amb20621475 [0,1,1,0,0,0|1,0,1]=4 6343 B11R1.167 Cc1ccc(I)cc1[N+](=O)[O-] Amb2725837 [0,1,1,0,0,0|1,0,1]=4 6344 B11R1.167 Cc1ccc(N)c(C(=O)O)c1 Amb1353188 [0,1,1,0,0,0|1,0,0]=3 6345 B11R1.167 Cc1ccc(N)c(C(=O)O)n1 Amb23439084 [0,1,1,0,0,0|2,0,0]=4 6346 B11R1.167 Cc1ccc(N)c(C(N)=O)c1 Amb33530720 [0,1,1,0,0,0|2,0,0]=4 6347 B11R1.167 Cc1ccc(N)c(S(=O)O)c1 Amb28325030 [0,1,1,0,0,0|2,0,0]=4 6348 B11R1.167 Cc1ccc(N)cc1B(O)O Amb25024216 [0,1,1,0,0,0|1,0,1]=4 6349 B11R1.167 Cc1ccc(N)cc1C(=O)Cl Amb25064753 [0,1,1,0,0,0|1,0,0]=3 6350 B11R1.167 Cc1ccc(N)cc1C(=O)O Amb2716204 [0,1,1,0,0,0|0,0,0]=2 6351 B11R1.167 Cc1ccc(N)cc1C(N)=O Amb18278770 [0,1,1,0,0,0|1,0,0]=3 6352 B11R1.167 Cc1ccc(N)cc1C(O)=S Amb27223137 [0,1,1,0,0,0|0,1,0]=3 6353 B11R1.167 Cc1ccc(N)cc1N(=O)=O Amb20620335 [0,1,1,0,0,0|1,0,1]=4 6354 B11R1.167 Cc1ccc(N)cc1S(=O)O Amb27765307 [0,1,1,0,0,0|1,0,0]=3 6355 B11R1.167 Cc1ccc(N)cc1S(=O)[O-] Amb32755578 [0,1,1,0,0,0|1,0,1]=4 6356 B11R1.167 Cc1ccc(N)cc1S(C)=O Amb27791845 [0,1,1,0,0,0|2,0,0]=4 6357 B11R1.167 Cc1ccc(N)cc1[N+](=O)[O-] Amb2609957 [0,1,1,0,0,0|1,0,1]=4 6358 B11R1.167 Cc1ccc(N)nc1C(=O)O Amb25994311 [0,1,1,0,0,0|1,0,0]=3 6359 B11R1.167 Cc1ccc(N)nc1C(N)=O Amb27654863 [0,1,1,0,0,0|2,0,0]=4 6360 B11R1.167 Cc1ccc(O)c(C(=O)O)c1 Amb3429668 [0,1,1,0,0,0|1,0,0]=3 6361 B11R1.167 Cc1ccc(O)c(C(=O)O)n1 Amb33547036 [0,1,1,0,0,0|2,0,0]=4 6362 B11R1.167 Cc1ccc(O)c(C(N)=O)c1 Amb6671843 [0,1,1,0,0,0|2,0,0]=4 6363 B11R1.167 Cc1ccc(O)cc1B(O)O Amb22490176 [0,1,1,0,0,0|1,0,1]=4 6364 B11R1.167 Cc1ccc(O)cc1C(=O)Cl Amb28122910 [0,1,1,0,0,0|1,0,0]=3 6365 B11R1.167 Cc1ccc(O)cc1C(=O)O Amb8384398 [0,1,1,0,0,0|0,0,0]=2 6366 B11R1.167 Cc1ccc(O)cc1C(N)=O Amb25892519 [0,1,1,0,0,0|1,0,0]=3 6367 B11R1.167 Cc1ccc(O)cc1N(=O)=O Amb20621833 [0,1,1,0,0,0|1,0,1]=4 6368 B11R1.167 Cc1ccc(O)cc1[N+](=O)[O-] Amb2721270 [0,1,1,0,0,0|1,0,1]=4 6369 B11R1.167 Cc1ccc(O)nc1C(=O)O Amb17593822 [0,1,1,0,0,0|1,0,0]=3 6370 B11R1.167 Cc1ccc(S)c(C(=O)O)c1 Amb18280213 [0,1,1,0,0,0|1,0,0]=3 6371 B11R1.167 Cc1ccc(S)cc1C(=O)O Amb25310962 [0,1,1,0,0,0|0,0,0]=2 6372 B11R1.167 Cc1ccc(S)cc1[N+](=O)[O-] Amb26904010 [0,1,1,0,0,0|1,0,1]=4 6373 B11R1.167 Cc1ccc([O-])cc1[N+](=O)[O-] Amb24309053 [0,1,1,0,0,0|1,0,1]=4 6374 B11R1.167 Cc1cnc(Br)cc1C(=O)O Amb25940162 [0,1,1,0,0,0|1,0,0]=3 6375 B11R1.167 Cc1cnc(C)c(C(=O)Cl)c1 Amb27259939 [0,1,1,0,0,0|2,0,0]=4 6376 B11R1.167 Cc1cnc(C)c(C(=O)O)c1 Amb18201737 [0,1,1,0,0,0|1,0,0]=3 6377 B11R1.167 Cc1cnc(C)c(C(=O)O)n1 Amb21963728 [0,1,1,0,0,0|2,0,0]=4 6378 B11R1.167 Cc1cnc(Cl)c(C(=O)O)c1 Amb13883502 [0,1,1,0,0,0|2,0,0]=4 6379 B11R1.167 Cc1cnc(Cl)cc1C(=O)Cl Amb27842448 [0,1,1,0,0,0|2,0,0]=4 6380 B11R1.167 Cc1cnc(Cl)cc1C(=O)O Amb26356253 [0,1,1,0,0,0|1,0,0]=3 6381 B11R1.167 Cc1cnc(Cl)nc1C(=O)O Amb21964430 [0,1,1,0,0,0|2,0,0]=4 6382 B11R1.167 Cc1cnc(F)c(C(=O)O)c1 Amb22489997 [0,1,1,0,0,0|2,0,0]=4 6383 B11R1.167 Cc1cnc(F)cc1C(=O)O Amb25831026 [0,1,1,0,0,0|1,0,0]=3 6384 B11R1.167 Cc1cnc(I)c(C(=O)O)c1 Amb27646762 [0,1,1,0,0,0|2,0,0]=4 6385 B11R1.167 Cc1cnc(N)c(C(=O)O)c1 Amb10602227 [0,1,1,0,0,0|2,0,0]=4 6386 B11R1.167 Cc1cnc(N)nc1C(=O)O Amb28059423 [0,1,1,0,0,0|2,0,0]=4 6387 B11R1.167 Cc1cnc(O)nc1C(=O)O Amb27445806 [0,1,1,0,0,0|2,0,0]=4 6388 B11R1.167 Cc1ncc(Br)cc1C(=O)O Amb21857129 [0,1,1,0,0,0|1,0,0]=3 6389 B11R1.167 Cc1ncc(Br)cc1C(N)=O Amb23401867 [0,1,1,0,0,0|2,0,0]=4 6390 B11R1.167 Cc1ncc(C)c(C(=O)O)n1 Amb25831147 [0,1,1,0,0,0|2,0,0]=4 6391 B11R1.167 Cc1ncc(Cl)cc1C(=O)Cl Amb19930038 [0,1,1,0,0,0|2,0,0]=4 6392 B11R1.167 Cc1ncc(Cl)cc1C(=O)O Amb17597688 [0,1,1,0,0,0|1,0,0]=3 6393 B11R1.167 Cc1ncc(Cl)cc1C(N)=O Amb23580658 [0,1,1,0,0,0|2,0,0]=4 6394 B11R1.167 Cc1ncc(Cl)nc1C(=O)O Amb27469870 [0,1,1,0,0,0|2,0,0]=4 6395 B11R1.167 Cc1ncc(F)cc1C(=O)O Amb26953012 [0,1,1,0,0,0|1,0,0]=3 6396 B11R1.167 Cc1ncc(I)cc1C(=O)O Amb23412010 [0,1,1,0,0,0|1,0,0]=3 6397 B11R1.167 Cc1ncc(N)cc1C(=O)O Amb18278790 [0,1,1,0,0,0|1,0,0]=3 6398 B11R1.167 Cc1ncc(N)cc1C(N)=O Amb10610591 [0,1,1,0,0,0|2,0,0]=4 6399 B11R1.167 Cc1ncc(O)cc1C(N)=O Amb23400412 [0,1,1,0,0,0|2,0,0]=4 6400 B11R1.167 Cn1ccc(=S)c(C(=O)O)c1 Amb2612011 [0,1,1,0,0,0|2,0,0]=4 6401 B11R1.167 NC(=O)c1cc(Br)ccc1Br Amb6760127 [0,1,1,0,0,0|2,0,0]=4 6402 B11R1.167 NC(=O)c1cc(Br)ccc1Cl Amb6754226 [0,1,1,0,0,0|2,0,0]=4 6403 B11R1.167 NC(=O)c1cc(Br)ccc1F Amb6265948 [0,1,1,0,0,0|2,0,0]=4 6404 B11R1.167 NC(=O)c1cc(Br)ccc1I Amb6760128 [0,1,1,0,0,0|2,0,0]=4 6405 B11R1.167 NC(=O)c1cc(Br)ccc1N Amb9199833 [0,1,1,0,0,0|2,0,0]=4 6406 B11R1.167 NC(=O)c1cc(Br)ccc1O Amb4035341 [0,1,1,0,0,0|2,0,0]=4 6407 B11R1.167 NC(=O)c1cc(Br)ccc1S Amb28135267 [0,1,1,0,0,0|2,0,0]=4 6408 B11R1.167 NC(=O)c1cc(Cl)ccc1Br Amb6760126 [0,1,1,0,0,0|2,0,0]=4 6409 B11R1.167 NC(=O)c1cc(Cl)ccc1Cl Amb3429855 [0,1,1,0,0,0|2,0,0]=4 6410 B11R1.167 NC(=O)c1cc(Cl)ccc1F Amb6365913 [0,1,1,0,0,0|2,0,0]=4 6411 B11R1.167 NC(=O)c1cc(Cl)ccc1I Amb2760423 [0,1,1,0,0,0|2,0,0]=4 6412 B11R1.167 NC(=O)c1cc(Cl)ccc1N Amb1114376 [0,1,1,0,0,0|2,0,0]=4 6413 B11R1.167 NC(=O)c1cc(Cl)ccc1O Amb1211940 [0,1,1,0,0,0|2,0,0]=4 6414 B11R1.167 NC(=O)c1cc(F)ccc1Br Amb6262798 [0,1,1,0,0,0|2,0,0]=4 6415 B11R1.167 NC(=O)c1cc(F)ccc1Cl Amb2685933 [0,1,1,0,0,0|2,0,0]=4 6416 B11R1.167 NC(=O)c1cc(F)ccc1F Amb931410 [0,1,1,0,0,0|2,0,0]=4 6417 B11R1.167 NC(=O)c1cc(F)ccc1I Amb25798257 [0,1,1,0,0,0|2,0,0]=4 6418 B11R1.167 NC(=O)c1cc(F)ccc1N Amb8387464 [0,1,1,0,0,0|2,0,0]=4 6419 B11R1.167 NC(=O)c1cc(F)ccc1O Amb18057849 [0,1,1,0,0,0|2,0,0]=4 6420 B11R1.167 NC(=O)c1cc(I)ccc1Br Amb10788621 [0,1,1,0,0,0|2,0,0]=4 6421 B11R1.167 NC(=O)c1cc(I)ccc1Cl Amb6754227 [0,1,1,0,0,0|2,0,0]=4 6422 B11R1.167 NC(=O)c1cc(I)ccc1F Amb25365079 [0,1,1,0,0,0|2,0,0]=4 6423 B11R1.167 NC(=O)c1cc(I)ccc1I Amb6754231 [0,1,1,0,0,0|2,0,0]=4 6424 B11R1.167 NC(=O)c1cc(I)ccc1O Amb24756472 [0,1,1,0,0,0|2,0,0]=4 6425 B11R1.167 NC(=O)c1cc(N)ccc1Br Amb10767183 [0,1,1,0,0,0|2,0,0]=4 6426 B11R1.167 NC(=O)c1cc(N)ccc1Br Amb9859637 [0,1,1,0,0,0|2,0,0]=4 6427 B11R1.167 NC(=O)c1cc(N)ccc1Cl Amb1118157 [0,1,1,0,0,0|2,0,0]=4 6428 B11R1.167 NC(=O)c1cc(N)ccc1F Amb1137829 [0,1,1,0,0,0|2,0,0]=4 6429 B11R1.167 NC(=O)c1cc(N)ccc1I Amb26348866 [0,1,1,0,0,0|2,0,0]=4 6430 B11R1.167 NC(=O)c1cc(N)ccc1O Amb18947692 [0,1,1,0,0,0|2,0,0]=4 6431 B11R1.167 NC(=O)c1cc(O)ccc1Cl Amb27490891 [0,1,1,0,0,0|2,0,0]=4 6432 B11R1.167 NC(=O)c1cc(O)ccc1F Amb24432738 [0,1,1,0,0,0|2,0,0]=4 6433 B11R1.167 NC(=O)c1cc(O)ccc1I Amb27230103 [0,1,1,0,0,0|2,0,0]=4 6434 B11R1.167 NC(=O)c1cc(O)ccc1N Amb18278807 [0,1,1,0,0,0|2,0,0]=4 6435 B11R1.167 NC(=O)c1cc(S)ccc1Br Amb28410646 [0,1,1,0,0,0|2,0,0]=4 6436 B11R1.167 NC1=CNC(=O)C(C(=O)O)=C1 Amb18065076 [0,1,1,0,0,0|2,0,0]=4 6437 B11R1.167 Nc1cc(C(=O)O)c(Br)cn1 Amb20242860 [0,1,1,0,0,0|2,0,0]=4 6438 B11R1.167 Nc1cc(C(=O)O)c(Cl)cn1 Amb25336447 [0,1,1,0,0,0|2,0,0]=4 6439 B11R1.167 Nc1cc(C(=O)O)c(F)cn1 Amb25892508 [0,1,1,0,0,0|2,0,0]=4 6440 B11R1.167 Nc1cc(C(=O)O)c(N)cn1 Amb25891598 [0,1,1,0,0,0|2,0,0]=4 6441 B11R1.167 Nc1ccc(Br)c(C(=O)Cl)c1 Amb25114906 [0,1,1,0,0,0|2,0,0]=4 6442 B11R1.167 Nc1ccc(Br)c(C(=O)O)c1 Amb6298248 [0,1,1,0,0,0|1,0,0]=3 6443 B11R1.167 Nc1ccc(Br)c(C(=O)O)n1 Amb19958986 [0,1,1,0,0,0|2,0,0]=4 6444 B11R1.167 Nc1ccc(Br)cc1C(=O)Cl Amb25890550 [0,1,1,0,0,0|2,0,0]=4 6445 B11R1.167 Nc1ccc(Br)cc1C(=O)O Amb6364862 [0,1,1,0,0,0|1,0,0]=3 6446 B11R1.167 Nc1ccc(Br)nc1C(=O)O Amb21964060 [0,1,1,0,0,0|2,0,0]=4 6447 B11R1.167 Nc1ccc(Cl)c(C(=O)Cl)c1 Amb26927676 [0,1,1,0,0,0|2,0,0]=4 6448 B11R1.167 Nc1ccc(Cl)c(C(=O)O)c1 Amb2684371 [0,1,1,0,0,0|1,0,0]=3 6449 B11R1.167 Nc1ccc(Cl)c(C(=O)O)n1 Amb6701945 [0,1,1,0,0,0|2,0,0]=4 6450 B11R1.167 Nc1ccc(Cl)cc1C(=O)Cl Amb5751311 [0,1,1,0,0,0|2,0,0]=4 6451 B11R1.167 Nc1ccc(Cl)cc1C(=O)O Amb1353189 [0,1,1,0,0,0|1,0,0]=3 6452 B11R1.167 Nc1ccc(Cl)cc1C(=O)O Amb2695796 [0,1,1,0,0,0|1,0,0]=3 6453 B11R1.167 Nc1ccc(Cl)nc1C(=O)O Amb17739943 [0,1,1,0,0,0|2,0,0]=4 6454 B11R1.167 Nc1ccc(Cl)nc1C(=O)O Amb22405925 [0,1,1,0,0,0|2,0,0]=4 6455 B11R1.167 Nc1ccc(F)c(C(=O)Cl)c1 Amb10840267 [0,1,1,0,0,0|2,0,0]=4 6456 B11R1.167 Nc1ccc(F)c(C(=O)O)c1 Amb2684412 [0,1,1,0,0,0|1,0,0]=3 6457 B11R1.167 Nc1ccc(F)c(C(=O)O)n1 Amb25243335 [0,1,1,0,0,0|2,0,0]=4 6458 B11R1.167 Nc1ccc(F)cc1C(=O)O Amb1104986 [0,1,1,0,0,0|1,0,0]=3 6459 B11R1.167 Nc1ccc(I)c(C(=O)Cl)c1 Amb27597632 [0,1,1,0,0,0|2,0,0]=4 6460 B11R1.167 Nc1ccc(I)cc1C(=O)Cl Amb24636809 [0,1,1,0,0,0|2,0,0]=4 6461 B11R1.167 Nc1ccc(I)cc1C(=O)O Amb1233201 [0,1,1,0,0,0|1,0,0]=3 6462 B11R1.167 Nc1ccc(N)c(C(=O)O)c1 Amb4139702 [0,1,1,0,0,0|1,0,0]=3 6463 B11R1.167 Nc1ccc(N)c(C(=O)O)c1 Amb6874952 [0,1,1,0,0,0|1,0,0]=3 6464 B11R1.167 Nc1ccc(O)c(C(=O)O)c1 Amb1072203 [0,1,1,0,0,0|1,0,0]=3 6465 B11R1.167 Nc1ccc(O)c(C(=O)O)c1 Amb24081346 [0,1,1,0,0,0|1,0,0]=3 6466 B11R1.167 Nc1ccc(O)c(C(=O)[O-])c1 Amb19958949 [0,1,1,0,0,0|1,0,1]=4 6467 B11R1.167 Nc1ccc(O)cc1C(=O)O Amb534955 [0,1,1,0,0,0|1,0,0]=3 6468 B11R1.167 Nc1ccc(S)c(C(=O)O)c1 Amb20620211 [0,1,1,0,0,0|1,0,0]=3 6469 B11R1.167 Nc1ccc(S)cc1C(=O)O Amb27614432 [0,1,1,0,0,0|1,0,0]=3 6470 B11R1.167 Nc1cnc(Br)c(C(=O)O)c1 Amb23586145 [0,1,1,0,0,0|2,0,0]=4 6471 B11R1.167 Nc1cnc(Br)cc1C(=O)O Amb21964483 [0,1,1,0,0,0|2,0,0]=4 6472 B11R1.167 Nc1cnc(Cl)c(C(=O)O)c1 Amb10601436 [0,1,1,0,0,0|2,0,0]=4 6473 B11R1.167 Nc1cnc(Cl)cc1C(=O)O Amb8396909 [0,1,1,0,0,0|2,0,0]=4 6474 B11R1.167 Nc1cnc(F)c(C(=O)O)c1 Amb26897310 [0,1,1,0,0,0|2,0,0]=4 6475 B11R1.167 Nc1cnc(F)cc1C(=O)O Amb2697483 [0,1,1,0,0,0|2,0,0]=4 6476 B11R1.167 Nc1cnc(I)cc1C(=O)O Amb24615744 [0,1,1,0,0,0|2,0,0]=4 6477 B11R1.167 Nc1cnc(O)cc1C(=O)O Amb18831042 [0,1,1,0,0,0|2,0,0]=4 6478 B11R1.167 Nc1ncc(Br)cc1C(=O)O Amb19516408 [0,1,1,0,0,0|2,0,0]=4 6479 B11R1.167 Nc1ncc(Br)cc1C(=O)O Amb3918884 [0,1,1,0,0,0|2,0,0]=4 6480 B11R1.167 Nc1ncc(Cl)cc1C(=O)O Amb7172900 [0,1,1,0,0,0|2,0,0]=4 6481 B11R1.167 Nc1ncc(F)cc1C(=O)O Amb13889725 [0,1,1,0,0,0|2,0,0]=4 6482 B11R1.167 Nc1ncc(I)cc1C(=O)O Amb17621453 [0,1,1,0,0,0|2,0,0]=4 6483 B11R1.167 Nc1ncc(O)cc1C(=O)O Amb26399098 [0,1,1,0,0,0|2,0,0]=4 6484 B11R1.167 Nc1ncc(O)cc1C(=O)O Amb28652872 [0,1,1,0,0,0|2,0,0]=4 6485 B11R1.167 O=C(Cl)c1cc(Br)ccc1Cl Amb2685002 [0,1,1,0,0,0|2,0,0]=4 6486 B11R1.167 O=C(Cl)c1cc(Br)ccc1F Amb6743403 [0,1,1,0,0,0|2,0,0]=4 6487 B11R1.167 O=C(Cl)c1cc(Br)ccc1I Amb2704478 [0,1,1,0,0,0|2,0,0]=4 6488 B11R1.167 O=C(Cl)c1cc(Br)ccc1O Amb25877910 [0,1,1,0,0,0|2,0,0]=4 6489 B11R1.167 O=C(Cl)c1cc(Cl)ccc1Cl Amb33533479 [0,1,1,0,0,0|2,0,0]=4 6490 B11R1.167 O=C(Cl)c1cc(Cl)ccc1F Amb2685969 [0,1,1,0,0,0|2,0,0]=4 6491 B11R1.167 O=C(Cl)c1cc(Cl)ccc1O Amb6743397 [0,1,1,0,0,0|2,0,0]=4 6492 B11R1.167 O=C(Cl)c1cc(F)ccc1Br Amb6743368 [0,1,1,0,0,0|2,0,0]=4 6493 B11R1.167 O=C(Cl)c1cc(F)ccc1Cl Amb2685964 [0,1,1,0,0,0|2,0,0]=4 6494 B11R1.167 O=C(Cl)c1cc(F)ccc1F Amb2687086 [0,1,1,0,0,0|2,0,0]=4 6495 B11R1.167 O=C(Cl)c1cc(I)ccc1Br Amb24461783 [0,1,1,0,0,0|2,0,0]=4 6496 B11R1.167 O=C(Cl)c1cc(I)ccc1Cl Amb3598175 [0,1,1,0,0,0|2,0,0]=4 6497 B11R1.167 O=C(Cl)c1cc(I)ccc1F Amb6297611 [0,1,1,0,0,0|2,0,0]=4 6498 B11R1.167 O=C(Cl)c1cc(I)ccc1I Amb20179399 [0,1,1,0,0,0|2,0,0]=4 6499 B11R1.167 O=C(Cl)c1cc(I)ccc1O Amb28398100 [0,1,1,0,0,0|2,0,0]=4 6500 B11R1.167 O=C(Cl)c1cc(O)ccc1F Amb27402123 [0,1,1,0,0,0|2,0,0]=4 6501 B11R1.167 O=C(Cl)c1cc(O)ccc1O Amb27170728 [0,1,1,0,0,0|2,0,0]=4 6502 B11R1.167 O=C(F)c1cc(Cl)ccc1Cl Amb26966971 [0,1,1,0,0,0|2,0,0]=4 6503 B11R1.167 O=C(O)C1=CC(Br)=CNC1=O Amb33549749 [0,1,1,0,0,0|2,0,0]=4 6504 B11R1.167 O=C(O)C1=CC(Br)=CNC1=S Amb19304462 [0,1,1,0,0,0|2,0,0]=4 6505 B11R1.167 O=C(O)c1cc(Br)ccc1Br Amb3941526 [0,1,1,0,0,0|1,0,0]=3 6506 B11R1.167 O=C(O)c1cc(Br)ccc1Cl Amb264314 [0,1,1,0,0,0|1,0,0]=3 6507 B11R1.167 O=C(O)c1cc(Br)ccc1F Amb1233202 [0,1,1,0,0,0|1,0,0]=3 6508 B11R1.167 O=C(O)c1cc(Br)ccc1I Amb1107594 [0,1,1,0,0,0|1,0,0]=3 6509 B11R1.167 O=C(O)c1cc(Br)ccc1O Amb1934189 [0,1,1,0,0,0|1,0,0]=3 6510 B11R1.167 O=C(O)c1cc(Br)ccc1S Amb18134858 [0,1,1,0,0,0|1,0,0]=3 6511 B11R1.167 O=C(O)c1cc(Br)cnc1Br Amb2725005 [0,1,1,0,0,0|2,0,0]=4 6512 B11R1.167 O=C(O)c1cc(Br)cnc1Cl Amb3427759 [0,1,1,0,0,0|2,0,0]=4 6513 B11R1.167 O=C(O)c1cc(Br)cnc1F Amb6297692 [0,1,1,0,0,0|2,0,0]=4 6514 B11R1.167 O=C(O)c1cc(Br)cnc1O Amb535747 [0,1,1,0,0,0|2,0,0]=4 6515 B11R1.167 O=C(O)c1cc(Br)cnc1S Amb33538642 [0,1,1,0,0,0|2,0,0]=4 6516 B11R1.167 O=C(O)c1cc(Br)ncc1Br Amb7990140 [0,1,1,0,0,0|2,0,0]=4 6517 B11R1.167 O=C(O)c1cc(Br)ncc1Cl Amb21857928 [0,1,1,0,0,0|2,0,0]=4 6518 B11R1.167 O=C(O)c1cc(Br)ncc1F Amb13890395 [0,1,1,0,0,0|2,0,0]=4 6519 B11R1.167 O=C(O)c1cc(Br)ncc1O Amb22499548 [0,1,1,0,0,0|2,0,0]=4 6520 B11R1.167 O=C(O)c1cc(Cl)cc[n+]1[O-] Amb27400265 [0,1,1,0,0,0|2,0,0]=4 6521 B11R1.167 O=C(O)c1cc(Cl)ccc1Br Amb845609 [0,1,1,0,0,0|1,0,0]=3 6522 B11R1.167 O=C(O)c1cc(Cl)ccc1Cl Amb2099522 [0,1,1,0,0,0|1,0,0]=3 6523 B11R1.167 O=C(O)c1cc(Cl)ccc1F Amb1229906 [0,1,1,0,0,0|1,0,0]=3 6524 B11R1.167 O=C(O)c1cc(Cl)ccc1I Amb1133362 [0,1,1,0,0,0|1,0,0]=3 6525 B11R1.167 O=C(O)c1cc(Cl)ccc1O Amb3941495 [0,1,1,0,0,0|1,0,0]=3 6526 B11R1.167 O=C(O)c1cc(Cl)ccc1S Amb18279260 [0,1,1,0,0,0|1,0,0]=3 6527 B11R1.167 O=C(O)c1cc(Cl)cnc1Br Amb10603561 [0,1,1,0,0,0|2,0,0]=4 6528 B11R1.167 O=C(O)c1cc(Cl)cnc1Cl Amb3427844 [0,1,1,0,0,0|2,0,0]=4 6529 B11R1.167 O=C(O)c1cc(Cl)cnc1F Amb8393043 [0,1,1,0,0,0|2,0,0]=4 6530 B11R1.167 O=C(O)c1cc(Cl)ncc1Br Amb33548844 [0,1,1,0,0,0|2,0,0]=4 6531 B11R1.167 O=C(O)c1cc(Cl)ncc1Cl Amb3427783 [0,1,1,0,0,0|2,0,0]=4 6532 B11R1.167 O=C(O)c1cc(Cl)ncc1F Amb16231959 [0,1,1,0,0,0|2,0,0]=4 6533 B11R1.167 O=C(O)c1cc(Cl)ncc1O Amb19516096 [0,1,1,0,0,0|2,0,0]=4 6534 B11R1.167 O=C(O)c1cc(F)ccc1Br Amb1228485 [0,1,1,0,0,0|1,0,0]=3 6535 B11R1.167 O=C(O)c1cc(F)ccc1Cl Amb2685949 [0,1,1,0,0,0|1,0,0]=3 6536 B11R1.167 O=C(O)c1cc(F)ccc1F Amb1214894 [0,1,1,0,0,0|1,0,0]=3 6537 B11R1.167 O=C(O)c1cc(F)ccc1I Amb5721972 [0,1,1,0,0,0|1,0,0]=3 6538 B11R1.167 O=C(O)c1cc(F)ccc1O Amb2688416 [0,1,1,0,0,0|1,0,0]=3 6539 B11R1.167 O=C(O)c1cc(F)ccc1S Amb10838443 [0,1,1,0,0,0|1,0,0]=3 6540 B11R1.167 O=C(O)c1cc(F)cnc1Br Amb20241794 [0,1,1,0,0,0|2,0,0]=4 6541 B11R1.167 O=C(O)c1cc(F)cnc1Cl Amb2447673 [0,1,1,0,0,0|2,0,0]=4 6542 B11R1.167 O=C(O)c1cc(F)cnc1F Amb8390118 [0,1,1,0,0,0|2,0,0]=4 6543 B11R1.167 O=C(O)c1cc(F)cnc1I Amb26530486 [0,1,1,0,0,0|2,0,0]=4 6544 B11R1.167 O=C(O)c1cc(F)cnc1O Amb8393044 [0,1,1,0,0,0|2,0,0]=4 6545 B11R1.167 O=C(O)c1cc(F)ncc1Br Amb22738569 [0,1,1,0,0,0|2,0,0]=4 6546 B11R1.167 O=C(O)c1cc(F)ncc1Cl Amb20242008 [0,1,1,0,0,0|2,0,0]=4 6547 B11R1.167 O=C(O)c1cc(F)ncc1F Amb8390121 [0,1,1,0,0,0|2,0,0]=4 6548 B11R1.167 O=C(O)c1cc(F)ncc1O Amb24620476 [0,1,1,0,0,0|2,0,0]=4 6549 B11R1.167 O=C(O)c1cc(I)ccc1Br Amb1785330 [0,1,1,0,0,0|1,0,0]=3 6550 B11R1.167 O=C(O)c1cc(I)ccc1Cl Amb2686131 [0,1,1,0,0,0|1,0,0]=3 6551 B11R1.167 O=C(O)c1cc(I)ccc1F Amb2688124 [0,1,1,0,0,0|1,0,0]=3 6552 B11R1.167 O=C(O)c1cc(I)ccc1I Amb6848402 [0,1,1,0,0,0|1,0,0]=3 6553 B11R1.167 O=C(O)c1cc(I)ccc1O Amb3940317 [0,1,1,0,0,0|1,0,0]=3 6554 B11R1.167 O=C(O)c1cc(I)ccc1S Amb27166774 [0,1,1,0,0,0|1,0,0]=3 6555 B11R1.167 O=C(O)c1cc(I)cnc1Br Amb22263224 [0,1,1,0,0,0|2,0,0]=4 6556 B11R1.167 O=C(O)c1cc(I)cnc1Cl Amb3205429 [0,1,1,0,0,0|2,0,0]=4 6557 B11R1.167 O=C(O)c1cc(I)cnc1F Amb24652730 [0,1,1,0,0,0|2,0,0]=4 6558 B11R1.167 O=C(O)c1cc(I)cnc1O Amb9677759 [0,1,1,0,0,0|2,0,0]=4 6559 B11R1.167 O=C(O)c1cc(I)ncc1F Amb26894837 [0,1,1,0,0,0|2,0,0]=4 6560 B11R1.167 O=C(O)c1cc(O)ccc1Br Amb6297119 [0,1,1,0,0,0|1,0,0]=3 6561 B11R1.167 O=C(O)c1cc(O)ccc1Cl Amb6297059 [0,1,1,0,0,0|1,0,0]=3 6562 B11R1.167 O=C(O)c1cc(O)ccc1F Amb2684159 [0,1,1,0,0,0|1,0,0]=3 6563 B11R1.167 O=C(O)c1cc(O)ccc1I Amb17938038 [0,1,1,0,0,0|1,0,0]=3 6564 B11R1.167 O=C(O)c1cc(O)ccc1O Amb33779430 [0,1,1,0,0,0|1,0,0]=3 6565 B11R1.167 O=C(O)c1cc(O)ccc1O Amb6491145 [0,1,1,0,0,0|1,0,0]=3 6566 B11R1.167 O=C(O)c1cc(O)ccc1S Amb27390277 [0,1,1,0,0,0|1,0,0]=3 6567 B11R1.167 O=C(O)c1cc(O)cnc1Cl Amb18127133 [0,1,1,0,0,0|2,0,0]=4 6568 B11R1.167 O=C(O)c1cc(O)cnc1O Amb8009492 [0,1,1,0,0,0|2,0,0]=4 6569 B11R1.167 O=C(O)c1cc(O)ncc1Br Amb10070313 [0,1,1,0,0,0|2,0,0]=4 6570 B11R1.167 O=C(O)c1cc(O)ncc1Cl Amb25144003 [0,1,1,0,0,0|2,0,0]=4 6571 B11R1.167 O=C(O)c1cc(S)ccc1Br Amb27248662 [0,1,1,0,0,0|1,0,0]=3 6572 B11R1.167 O=C(O)c1cc(S)ccc1Cl Amb20623491 [0,1,1,0,0,0|1,0,0]=3 6573 B11R1.167 O=C(O)c1cc(S)ccc1F Amb25152849 [0,1,1,0,0,0|1,0,0]=3 6574 B11R1.167 O=C(O)c1cc(S)ccc1I Amb26931773 [0,1,1,0,0,0|1,0,0]=3 6575 B11R1.167 O=C(O)c1cc(S)ccc1O Amb26481378 [0,1,1,0,0,0|1,0,0]=3 6576 B11R1.167 O=C(O)c1cc(S)ccc1S Amb25288094 [0,1,1,0,0,0|1,0,0]=3 6577 B11R1.167 O=C(O)c1cc(S)ncc1Cl Amb27980976 [0,1,1,0,0,0|2,0,0]=4 6578 B11R1.167 O=C(O)c1nc(Br)ccc1Br Amb19959856 [0,1,1,0,0,0|2,0,0]=4 6579 B11R1.167 O=C(O)c1nc(Br)ccc1Cl Amb21856413 [0,1,1,0,0,0|2,0,0]=4 6580 B11R1.167 O=C(O)c1nc(Br)ccc1F Amb21963438 [0,1,1,0,0,0|2,0,0]=4 6581 B11R1.167 O=C(O)c1nc(Br)ccc1O Amb19958147 [0,1,1,0,0,0|2,0,0]=4 6582 B11R1.167 O=C(O)c1nc(Cl)ccc1Br Amb10070774 [0,1,1,0,0,0|2,0,0]=4 6583 B11R1.167 O=C(O)c1nc(Cl)ccc1Cl Amb1153040 [0,1,1,0,0,0|2,0,0]=4 6584 B11R1.167 O=C(O)c1nc(Cl)ccc1F Amb16231986 [0,1,1,0,0,0|2,0,0]=4 6585 B11R1.167 O=C(O)c1nc(Cl)ccc1O Amb25760648 [0,1,1,0,0,0|2,0,0]=4 6586 B11R1.167 O=C(O)c1nc(F)ccc1Br Amb21964207 [0,1,1,0,0,0|2,0,0]=4 6587 B11R1.167 O=C(O)c1nc(F)ccc1Cl Amb24648694 [0,1,1,0,0,0|2,0,0]=4 6588 B11R1.167 O=C(O)c1nc(F)ccc1F Amb8390117 [0,1,1,0,0,0|2,0,0]=4 6589 B11R1.167 O=C(O)c1nc(F)ccc1I Amb25258545 [0,1,1,0,0,0|2,0,0]=4 6590 B11R1.167 O=C(O)c1nc(F)ccc1O Amb25151163 [0,1,1,0,0,0|2,0,0]=4 6591 B11R1.167 O=C(O)c1nc(I)ccc1F Amb26894643 [0,1,1,0,0,0|2,0,0]=4 6592 B11R1.167 O=C(O)c1nc(O)ccc1Br Amb21857412 [0,1,1,0,0,0|2,0,0]=4 6593 B11R1.167 O=C(O)c1nc(O)ccc1Cl Amb660214 [0,1,1,0,0,0|2,0,0]=4 6594 B11R1.167 O=C(S)c1cc(Br)ccc1O Amb27864996 [0,1,1,0,0,0|1,1,0]=4 6595 B11R1.167 O=C([O-])c1cc(Br)ccc1O Amb22495805 [0,1,1,0,0,0|1,0,1]=4 6596 B11R1.167 O=C([O-])c1cc(Cl)ccc1F Amb33513119 [0,1,1,0,0,0|1,0,1]=4 6597 B11R1.167 O=C([O-])c1cc(F)ccc1Cl Amb30588513 [0,1,1,0,0,0|1,0,1]=4 6598 B11R1.167 O=C([O-])c1cc(F)ccc1F Amb10840960 [0,1,1,0,0,0|1,0,1]=4 6599 B11R1.167 O=C([O-])c1cc(O)ccc1O Amb9825417 [0,1,1,0,0,0|1,0,1]=4 6600 B11R1.167 O=C1C=C(C(=O)O)C(Br)=CN1 Amb18769458 [0,1,1,0,0,0|2,0,0]=4 6601 B11R1.167 O=C1C=C(C(=O)O)C(O)=CN1 Amb20242309 [0,1,1,0,0,0|2,0,0]=4 6602 B11R1.167 O=C1C=CC(F)=C(C(=O)O)N1 Amb22015213 [0,1,1,0,0,0|2,0,0]=4 6603 B11R1.167 O=C1C=CN(O)C(C(=O)O)=C1 Amb27861943 [0,1,1,0,0,0|2,0,0]=4 6604 B11R1.167 O=S(O)c1cc(Cl)ccc1F Amb18224869 [0,1,1,0,0,0|2,0,0]=4 6605 B11R1.167 O=S(O)c1cc(F)ccc1F Amb18862925 [0,1,1,0,0,0|2,0,0]=4 6606 B11R1.123 C\C=C\C1COC(=O)\C1=C/Cl Amb28320726 [0,1,1,0,0,0|0,0,2]=4 6607 B11R1.425 C=C[C@H]1\C(=C\Cl)C(=O)O[C@H]1C Amb28244863 [0,1,1,0,0,0|1,0,1]=4 6608 B11R1.471 C=CC1COC(=O)\C1=C(/C)Cl Amb8391218 [0,1,1,0,0,0|0,0,2]=4 6609 B11R2.10 BrC1=Cc2ccccc2C1 Amb8517387 [1,1,0,0,0,0|1,0,0]=3 6610 B11R2.10 BrC1=Nc2ccccc2C1 Amb27877570 [1,1,0,0,0,0|2,0,0]=4 6611 B11R2.10 BrC1Cc2ccccc2C1 Amb9675743 [1,1,0,0,0,0|1,0,1]=4 6612 B11R2.10 Brc1cc2ccccc2o1 Amb2723106 [1,1,0,0,0,0|2,0,0]=4 6613 B11R2.10 Brc1cc2ccccc2s1 Amb2723178 [1,1,0,0,0,0|2,0,0]=4 6614 B11R2.10 CC1=Cc2ccccc2C1 Amb15692403 [1,1,0,0,0,0|1,0,0]=3 6615 B11R2.10 CC1Cc2ccccc2C1 Amb20248354 [1,1,0,0,0,0|1,0,1]=4 6616 B11R2.10 CC1Cc2ccccc2N1 Amb9703084 [1,1,0,0,0,0|2,0,0]=4 6617 B11R2.10 CC1Cc2ccccc2O1 Amb6374258 [1,1,0,0,0,0|2,0,0]=4 6618 B11R2.10 C[C@@H]1Cc2ccccc2N1 Amb23439109 [1,1,0,0,0,0|2,0,0]=4 6619 B11R2.10 C[C@H]1Cc2ccccc2N1 Amb25294551 [1,1,0,0,0,0|2,0,0]=4 6620 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [1,1,0,0,0,0|2,0,0]=4 6621 B11R2.10 Cc1cc2ccccc2s1 Amb2237023 [1,1,0,0,0,0|2,0,0]=4 6622 B11R2.10 ClC1=Cc2ccccc2C1 Amb22752069 [1,1,0,0,0,0|1,0,0]=3 6623 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [1,1,0,0,0,0|2,0,0]=4 6624 B11R2.10 Cln1cc2ccccc2n1 Amb2609846 [1,1,0,0,0,0|2,0,0]=4 6625 B11R2.10 Cn1cc2ccccc2c1 Amb28313764 [1,1,0,0,0,0|1,0,1]=4 6626 B11R2.10 Cn1cc2ccccc2n1 Amb2609633 [1,1,0,0,0,0|2,0,0]=4 6627 B11R2.10 FC1Cc2ccccc2C1 Amb27751084 [1,1,0,0,0,0|1,0,1]=4 6628 B11R2.10 IC1Cc2ccccc2C1 Amb23401305 [1,1,0,0,0,0|1,0,1]=4 6629 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [1,1,0,0,0,0|2,0,0]=4 6630 B11R2.10 Ic1cc2ccccc2s1 Amb22896395 [1,1,0,0,0,0|2,0,0]=4 6631 B11R2.10 N=C1Cc2ccccc2N1 Amb26636218 [1,1,0,0,0,0|2,0,0]=4 6632 B11R2.10 N=C1Cc2ccccc2N1 Amb32661573 [1,1,0,0,0,0|2,0,0]=4 6633 B11R2.10 N=C1Cc2ccccc2S1 Amb28135700 [1,1,0,0,0,0|2,0,0]=4 6634 B11R2.10 NC1Cc2ccccc2C1 Amb2182881 [1,1,0,0,0,0|1,0,1]=4 6635 B11R2.10 NC1Cc2ccccc2C1 Amb2720222 [1,1,0,0,0,0|1,0,1]=4 6636 B11R2.10 NC1Cc2ccccc2N1 Amb8397236 [1,1,0,0,0,0|2,0,0]=4 6637 B11R2.10 NN1Cc2ccccc2C1 Amb22586451 [1,1,0,0,0,0|1,0,1]=4 6638 B11R2.10 NN1Cc2ccccc2C1 Amb836832 [1,1,0,0,0,0|1,0,1]=4 6639 B11R2.10 Nc1cc2ccccc2s1 Amb17593717 [1,1,0,0,0,0|2,0,0]=4 6640 B11R2.10 Nn1cc2ccccc2n1 Amb24479670 [1,1,0,0,0,0|2,0,0]=4 6641 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [1,1,0,0,0,0|2,0,0]=4 6642 B11R2.10 O=C1C=C2C=CC=CN2C1 Amb28126717 [1,1,0,0,0,0|2,0,0]=4 6643 B11R2.10 O=C1Cc2ccccc2C1 Amb1227714 [1,1,0,0,0,0|1,0,1]=4 6644 B11R2.10 O=C1Cc2ccccc2N1 Amb1351379 [1,1,0,0,0,0|2,0,0]=4 6645 B11R2.10 O=C1Cc2ccccc2O1 Amb2781615 [1,1,0,0,0,0|2,0,0]=4 6646 B11R2.10 OC1Cc2ccccc2C1 Amb3940105 [1,1,0,0,0,0|1,0,1]=4 6647 B11R2.10 OC1Cc2ccccc2O1 Amb27410400 [1,1,0,0,0,0|2,0,0]=4 6648 B11R2.10 Oc1cc2ccccc2s1 Amb24518934 [1,1,0,0,0,0|2,0,0]=4 6649 B11R2.10 S=C1Cc2ccccc2N1 Amb1153150 [1,1,0,0,0,0|2,0,0]=4 6650 B11R2.10 SC1Cc2ccccc2C1 Amb9675741 [1,1,0,0,0,0|1,0,1]=4 6651 B11R2.10 Sc1cc2ccccc2s1 Amb24105482 [1,1,0,0,0,0|2,0,0]=4 6652 B11R2.10 [NH3+]C1Cc2ccccc2C1 Amb24113669 [1,1,0,0,0,0|1,0,1]=4 6653 B11R2.10 [NH3+]C1Cc2ccccc2C1 Amb6366004 [1,1,0,0,0,0|1,0,1]=4 6654 B11R2.36 Brc1ccc2c(c1)C=CC2 Amb2383763 [1,1,0,0,0,0|1,0,0]=3 6655 B11R2.36 Brc1ccc2c(c1)CC=C2 Amb22002296 [1,1,0,0,0,0|1,0,0]=3 6656 B11R2.36 Brc1ccc2c(c1)CCC2 Amb7768208 [1,1,0,0,0,0|1,0,1]=4 6657 B11R2.36 Brc1ccc2c(c1)CCN2 Amb20668480 [1,1,0,0,0,0|2,0,0]=4 6658 B11R2.36 Brc1ccc2c(c1)CCN2 Amb6366148 [1,1,0,0,0,0|2,0,0]=4 6659 B11R2.36 Brc1ccc2c(c1)CCO2 Amb2685123 [1,1,0,0,0,0|2,0,0]=4 6660 B11R2.36 Brc1ccc2c(c1)CCS2 Amb18770992 [1,1,0,0,0,0|2,0,0]=4 6661 B11R2.36 Brc1ccc2c(c1)CNC2 Amb19957819 [1,1,0,0,0,0|1,0,1]=4 6662 B11R2.36 Brc1ccc2c(c1)CNC2 Amb8629707 [1,1,0,0,0,0|1,0,1]=4 6663 B11R2.36 Brc1ccc2c(c1)COC2 Amb19038164 [1,1,0,0,0,0|0,0,1]=3 6664 B11R2.36 Brc1ccc2c(c1)NCC2 Amb10603002 [1,1,0,0,0,0|2,0,0]=4 6665 B11R2.36 Brc1ccc2c(c1)NCC2 Amb2383428 [1,1,0,0,0,0|2,0,0]=4 6666 B11R2.36 Brc1ccc2c(c1)OCC2 Amb22002410 [1,1,0,0,0,0|2,0,0]=4 6667 B11R2.36 Brc1ccc2ccoc2c1 Amb16192026 [1,1,0,0,0,0|2,0,0]=4 6668 B11R2.36 Brc1ccc2ccsc2c1 Amb10975970 [1,1,0,0,0,0|2,0,0]=4 6669 B11R2.36 Brc1ccc2cnoc2c1 Amb18187784 [1,1,0,0,0,0|2,0,0]=4 6670 B11R2.36 Brc1ccc2cnsc2c1 Amb18770292 [1,1,0,0,0,0|2,0,0]=4 6671 B11R2.36 Brc1ccc2conc2c1 Amb25336471 [1,1,0,0,0,0|1,0,0]=3 6672 B11R2.36 Brc1ccc2cscc2c1 Amb21858239 [1,1,0,0,0,0|0,1,1]=4 6673 B11R2.36 Brc1ccc2csnc2c1 Amb22735785 [1,1,0,0,0,0|1,1,0]=4 6674 B11R2.36 Brc1ccc2nocc2c1 Amb18187781 [1,1,0,0,0,0|1,0,0]=3 6675 B11R2.36 Brc1ccc2nonc2c1 Amb2723145 [1,1,0,0,0,0|2,0,0]=4 6676 B11R2.36 Brc1ccc2nscc2c1 Amb19958165 [1,1,0,0,0,0|1,1,0]=4 6677 B11R2.36 Brc1ccc2occc2c1 Amb2694966 [1,1,0,0,0,0|2,0,0]=4 6678 B11R2.36 Brc1ccc2oncc2c1 Amb19957546 [1,1,0,0,0,0|2,0,0]=4 6679 B11R2.36 Brc1ccc2sccc2c1 Amb2447430 [1,1,0,0,0,0|2,0,0]=4 6680 B11R2.36 Brc1ccc2sncc2c1 Amb22584104 [1,1,0,0,0,0|2,0,0]=4 6681 B11R2.36 Brc1cnc2c(c1)COC2 Amb18187526 [1,1,0,0,0,0|1,0,1]=4 6682 B11R2.36 Cc1ccc2c(c1)C=CC2 Amb24062964 [1,1,0,0,0,0|1,0,0]=3 6683 B11R2.36 Cc1ccc2c(c1)CC=C2 Amb28204212 [1,1,0,0,0,0|1,0,0]=3 6684 B11R2.36 Cc1ccc2c(c1)CCC2 Amb17231880 [1,1,0,0,0,0|1,0,1]=4 6685 B11R2.36 Cc1ccc2c(c1)CCN2 Amb1108847 [1,1,0,0,0,0|2,0,0]=4 6686 B11R2.36 Cc1ccc2c(c1)CCN2 Amb22500480 [1,1,0,0,0,0|2,0,0]=4 6687 B11R2.36 Cc1ccc2c(c1)CCO2 Amb2447310 [1,1,0,0,0,0|2,0,0]=4 6688 B11R2.36 Cc1ccc2c(c1)CNC2 Amb22230013 [1,1,0,0,0,0|1,0,1]=4 6689 B11R2.36 Cc1ccc2c(c1)CNC2 Amb22899515 [1,1,0,0,0,0|1,0,1]=4 6690 B11R2.36 Cc1ccc2c(c1)NCC2 Amb19305323 [1,1,0,0,0,0|2,0,0]=4 6691 B11R2.36 Cc1ccc2c(c1)NCC2 Amb2383431 [1,1,0,0,0,0|2,0,0]=4 6692 B11R2.36 Cc1ccc2ccoc2c1 Amb22039412 [1,1,0,0,0,0|2,0,0]=4 6693 B11R2.36 Cc1ccc2ccsc2c1 Amb10603775 [1,1,0,0,0,0|2,0,0]=4 6694 B11R2.36 Cc1ccc2cnoc2c1 Amb22002117 [1,1,0,0,0,0|2,0,0]=4 6695 B11R2.36 Cc1ccc2nocc2c1 Amb28124034 [1,1,0,0,0,0|1,0,0]=3 6696 B11R2.36 Cc1ccc2nonc2c1 Amb2447426 [1,1,0,0,0,0|2,0,0]=4 6697 B11R2.36 Cc1ccc2nscc2c1 Amb27160735 [1,1,0,0,0,0|1,1,0]=4 6698 B11R2.36 Cc1ccc2occc2c1 Amb22751743 [1,1,0,0,0,0|2,0,0]=4 6699 B11R2.36 Cc1ccc2oncc2c1 Amb27975667 [1,1,0,0,0,0|2,0,0]=4 6700 B11R2.36 Cc1ccc2sccc2c1 Amb2689331 [1,1,0,0,0,0|2,0,0]=4 6701 B11R2.36 Clc1ccc2c(c1)C=CC2 Amb2383761 [1,1,0,0,0,0|1,0,0]=3 6702 B11R2.36 Clc1ccc2c(c1)CC=C2 Amb26349302 [1,1,0,0,0,0|1,0,0]=3 6703 B11R2.36 Clc1ccc2c(c1)CCC2 Amb17232111 [1,1,0,0,0,0|1,0,1]=4 6704 B11R2.36 Clc1ccc2c(c1)CCN2 Amb1108036 [1,1,0,0,0,0|2,0,0]=4 6705 B11R2.36 Clc1ccc2c(c1)CCN2 Amb19958436 [1,1,0,0,0,0|2,0,0]=4 6706 B11R2.36 Clc1ccc2c(c1)CCO2 Amb22498241 [1,1,0,0,0,0|2,0,0]=4 6707 B11R2.36 Clc1ccc2c(c1)CNC2 Amb10067200 [1,1,0,0,0,0|1,0,1]=4 6708 B11R2.36 Clc1ccc2c(c1)CNC2 Amb33544555 [1,1,0,0,0,0|1,0,1]=4 6709 B11R2.36 Clc1ccc2c(c1)COC2 Amb28187548 [1,1,0,0,0,0|0,0,1]=3 6710 B11R2.36 Clc1ccc2c(c1)NCC2 Amb10603046 [1,1,0,0,0,0|2,0,0]=4 6711 B11R2.36 Clc1ccc2c(c1)NCC2 Amb2383426 [1,1,0,0,0,0|2,0,0]=4 6712 B11R2.36 Clc1ccc2c(n1)COC2 Amb22498628 [1,1,0,0,0,0|1,0,1]=4 6713 B11R2.36 Clc1ccc2ccsc2c1 Amb24091106 [1,1,0,0,0,0|2,0,0]=4 6714 B11R2.36 Clc1ccc2cnoc2c1 Amb24073976 [1,1,0,0,0,0|2,0,0]=4 6715 B11R2.36 Clc1ccc2cnsc2c1 Amb26451436 [1,1,0,0,0,0|2,0,0]=4 6716 B11R2.36 Clc1ccc2conc2c1 Amb22751080 [1,1,0,0,0,0|1,0,0]=3 6717 B11R2.36 Clc1ccc2nocc2c1 Amb10571862 [1,1,0,0,0,0|1,0,0]=3 6718 B11R2.36 Clc1ccc2nonc2c1 Amb2724594 [1,1,0,0,0,0|2,0,0]=4 6719 B11R2.36 Clc1ccc2nscc2c1 Amb22496026 [1,1,0,0,0,0|1,1,0]=4 6720 B11R2.36 Clc1ccc2occc2c1 Amb20248132 [1,1,0,0,0,0|2,0,0]=4 6721 B11R2.36 Clc1ccc2oncc2c1 Amb22495862 [1,1,0,0,0,0|2,0,0]=4 6722 B11R2.36 Clc1ccc2sccc2c1 Amb8629060 [1,1,0,0,0,0|2,0,0]=4 6723 B11R2.36 Clc1ccc2sncc2c1 Amb27596077 [1,1,0,0,0,0|2,0,0]=4 6724 B11R2.36 Clc1cnc2c(c1)CC=C2 Amb27453570 [1,1,0,0,0,0|2,0,0]=4 6725 B11R2.36 Fc1ccc2c(c1)C=CC2 Amb2383762 [1,1,0,0,0,0|1,0,0]=3 6726 B11R2.36 Fc1ccc2c(c1)CC=C2 Amb25927316 [1,1,0,0,0,0|1,0,0]=3 6727 B11R2.36 Fc1ccc2c(c1)CCC2 Amb17231894 [1,1,0,0,0,0|1,0,1]=4 6728 B11R2.36 Fc1ccc2c(c1)CCN2 Amb1108170 [1,1,0,0,0,0|2,0,0]=4 6729 B11R2.36 Fc1ccc2c(c1)CCN2 Amb22500825 [1,1,0,0,0,0|2,0,0]=4 6730 B11R2.36 Fc1ccc2c(c1)CCO2 Amb10841652 [1,1,0,0,0,0|2,0,0]=4 6731 B11R2.36 Fc1ccc2c(c1)CNC2 Amb19888352 [1,1,0,0,0,0|1,0,1]=4 6732 B11R2.36 Fc1ccc2c(c1)CNC2 Amb8629709 [1,1,0,0,0,0|1,0,1]=4 6733 B11R2.36 Fc1ccc2c(c1)NCC2 Amb22500603 [1,1,0,0,0,0|2,0,0]=4 6734 B11R2.36 Fc1ccc2c(c1)NCC2 Amb2383427 [1,1,0,0,0,0|2,0,0]=4 6735 B11R2.36 Fc1ccc2ccoc2c1 Amb27636754 [1,1,0,0,0,0|2,0,0]=4 6736 B11R2.36 Fc1ccc2cnsc2c1 Amb27154037 [1,1,0,0,0,0|2,0,0]=4 6737 B11R2.36 Fc1ccc2nonc2c1 Amb28457267 [1,1,0,0,0,0|2,0,0]=4 6738 B11R2.36 Fc1ccc2occc2c1 Amb20241175 [1,1,0,0,0,0|2,0,0]=4 6739 B11R2.36 Fc1ccc2oncc2c1 Amb22495874 [1,1,0,0,0,0|2,0,0]=4 6740 B11R2.36 Fc1ccc2sccc2c1 Amb19958720 [1,1,0,0,0,0|2,0,0]=4 6741 B11R2.36 Fc1ccc2sncc2c1 Amb24554887 [1,1,0,0,0,0|2,0,0]=4 6742 B11R2.36 Ic1ccc2c(c1)C=CC2 Amb25313198 [1,1,0,0,0,0|1,0,0]=3 6743 B11R2.36 Ic1ccc2c(c1)CCC2 Amb33528871 [1,1,0,0,0,0|1,0,1]=4 6744 B11R2.36 Ic1ccc2c(c1)CCO2 Amb2455961 [1,1,0,0,0,0|2,0,0]=4 6745 B11R2.36 Ic1ccc2c(c1)CNC2 Amb22002217 [1,1,0,0,0,0|1,0,1]=4 6746 B11R2.36 Ic1ccc2c(c1)CNC2 Amb34912935 [1,1,0,0,0,0|1,0,1]=4 6747 B11R2.36 Ic1ccc2c(c1)COC2 Amb26352569 [1,1,0,0,0,0|0,0,1]=3 6748 B11R2.36 Ic1ccc2c(c1)NCC2 Amb2383433 [1,1,0,0,0,0|2,0,0]=4 6749 B11R2.36 Ic1ccc2c(c1)OCC2 Amb27974776 [1,1,0,0,0,0|2,0,0]=4 6750 B11R2.36 Ic1ccc2ccoc2c1 Amb23401822 [1,1,0,0,0,0|2,0,0]=4 6751 B11R2.36 Ic1ccc2cnoc2c1 Amb27656210 [1,1,0,0,0,0|2,0,0]=4 6752 B11R2.36 Ic1ccc2nonc2c1 Amb24390714 [1,1,0,0,0,0|2,0,0]=4 6753 B11R2.36 Ic1ccc2occc2c1 Amb23401832 [1,1,0,0,0,0|2,0,0]=4 6754 B11R2.36 Ic1ccc2oncc2c1 Amb24392287 [1,1,0,0,0,0|2,0,0]=4 6755 B11R2.36 Ic1ccc2sccc2c1 Amb24062930 [1,1,0,0,0,0|2,0,0]=4 6756 B11R2.36 Ic1ccc2sncc2c1 Amb25888317 [1,1,0,0,0,0|2,0,0]=4 6757 B11R2.36 Nc1ccc2c(c1)CCC2 Amb22235535 [1,1,0,0,0,0|1,0,1]=4 6758 B11R2.36 Nc1ccc2c(c1)CCC2 Amb3940106 [1,1,0,0,0,0|1,0,1]=4 6759 B11R2.36 Nc1ccc2c(c1)CCN2 Amb22586673 [1,1,0,0,0,0|2,0,0]=4 6760 B11R2.36 Nc1ccc2c(c1)CCN2 Amb8397237 [1,1,0,0,0,0|2,0,0]=4 6761 B11R2.36 Nc1ccc2c(c1)CCO2 Amb1125736 [1,1,0,0,0,0|2,0,0]=4 6762 B11R2.36 Nc1ccc2c(c1)CCO2 Amb6239359 [1,1,0,0,0,0|2,0,0]=4 6763 B11R2.36 Nc1ccc2c(c1)CNC2 Amb19373944 [1,1,0,0,0,0|1,0,1]=4 6764 B11R2.36 Nc1ccc2c(c1)CNC2 Amb20241970 [1,1,0,0,0,0|1,0,1]=4 6765 B11R2.36 Nc1ccc2c(c1)CNC2 Amb29083429 [1,1,0,0,0,0|1,0,1]=4 6766 B11R2.36 Nc1ccc2c(c1)CNC2 Amb32652905 [1,1,0,0,0,0|1,0,1]=4 6767 B11R2.36 Nc1ccc2c(c1)CNC2 Amb32665265 [1,1,0,0,0,0|1,0,1]=4 6768 B11R2.36 Nc1ccc2c(c1)CNN2 Amb27768757 [1,1,0,0,0,0|2,0,0]=4 6769 B11R2.36 Nc1ccc2c(c1)COC2 Amb3941285 [1,1,0,0,0,0|0,0,1]=3 6770 B11R2.36 Nc1ccc2c(c1)N=NC2 Amb22493911 [1,1,0,0,0,0|2,0,0]=4 6771 B11R2.36 Nc1ccc2c(c1)NCC2 Amb16184047 [1,1,0,0,0,0|2,0,0]=4 6772 B11R2.36 Nc1ccc2c(c1)NCC2 Amb8397238 [1,1,0,0,0,0|2,0,0]=4 6773 B11R2.36 Nc1ccc2c(c1)OCC2 Amb33544801 [1,1,0,0,0,0|2,0,0]=4 6774 B11R2.36 Nc1ccc2ccoc2c1 Amb18137748 [1,1,0,0,0,0|2,0,0]=4 6775 B11R2.36 Nc1ccc2ccoc2c1 Amb32661636 [1,1,0,0,0,0|2,0,0]=4 6776 B11R2.36 Nc1ccc2ccsc2c1 Amb30633689 [1,1,0,0,0,0|2,0,0]=4 6777 B11R2.36 Nc1ccc2ccsc2c1 Amb8439505 [1,1,0,0,0,0|2,0,0]=4 6778 B11R2.36 Nc1ccc2cnoc2c1 Amb10603847 [1,1,0,0,0,0|2,0,0]=4 6779 B11R2.36 Nc1ccc2cnsc2c1 Amb24060601 [1,1,0,0,0,0|2,0,0]=4 6780 B11R2.36 Nc1ccc2conc2c1 Amb28208739 [1,1,0,0,0,0|1,0,0]=3 6781 B11R2.36 Nc1ccc2csnc2c1 Amb22736287 [1,1,0,0,0,0|1,1,0]=4 6782 B11R2.36 Nc1ccc2nocc2c1 Amb18832516 [1,1,0,0,0,0|1,0,0]=3 6783 B11R2.36 Nc1ccc2nonc2c1 Amb35753061 [1,1,0,0,0,0|2,0,0]=4 6784 B11R2.36 Nc1ccc2nonc2c1 Amb9173946 [1,1,0,0,0,0|2,0,0]=4 6785 B11R2.36 Nc1ccc2nscc2c1 Amb22736327 [1,1,0,0,0,0|1,1,0]=4 6786 B11R2.36 Nc1ccc2occc2c1 Amb2425577 [1,1,0,0,0,0|2,0,0]=4 6787 B11R2.36 Nc1ccc2oncc2c1 Amb21927333 [1,1,0,0,0,0|2,0,0]=4 6788 B11R2.36 Nc1ccc2sccc2c1 Amb33526381 [1,1,0,0,0,0|2,0,0]=4 6789 B11R2.36 Nc1ccc2sccc2c1 Amb482302 [1,1,0,0,0,0|2,0,0]=4 6790 B11R2.36 Nc1ccc2sncc2c1 Amb17621839 [1,1,0,0,0,0|2,0,0]=4 6791 B11R2.36 Nc1cnc2c(c1)COC2 Amb18832457 [1,1,0,0,0,0|1,0,1]=4 6792 B11R2.36 O=C1C=CC2=CNNC2=C1 Amb22489531 [1,1,0,0,0,0|2,0,0]=4 6793 B11R2.36 O=C1C=Cc2nocc2C1 Amb27962578 [1,1,0,0,0,0|1,0,1]=4 6794 B11R2.36 Oc1ccc2c(c1)C=CC2 Amb18124353 [1,1,0,0,0,0|1,0,0]=3 6795 B11R2.36 Oc1ccc2c(c1)CCC2 Amb3939555 [1,1,0,0,0,0|1,0,1]=4 6796 B11R2.36 Oc1ccc2c(c1)CCN2 Amb22501081 [1,1,0,0,0,0|2,0,0]=4 6797 B11R2.36 Oc1ccc2c(c1)CCN2 Amb22501082 [1,1,0,0,0,0|2,0,0]=4 6798 B11R2.36 Oc1ccc2c(c1)CCN2 Amb2697092 [1,1,0,0,0,0|2,0,0]=4 6799 B11R2.36 Oc1ccc2c(c1)CCO2 Amb8388337 [1,1,0,0,0,0|2,0,0]=4 6800 B11R2.36 Oc1ccc2c(c1)CNC2 Amb10067194 [1,1,0,0,0,0|1,0,1]=4 6801 B11R2.36 Oc1ccc2c(c1)CNC2 Amb22899626 [1,1,0,0,0,0|1,0,1]=4 6802 B11R2.36 Oc1ccc2c(c1)CNC2 Amb31307854 [1,1,0,0,0,0|1,0,1]=4 6803 B11R2.36 Oc1ccc2c(c1)COC2 Amb18643058 [1,1,0,0,0,0|0,0,1]=3 6804 B11R2.36 Oc1ccc2c(c1)NCC2 Amb18124454 [1,1,0,0,0,0|2,0,0]=4 6805 B11R2.36 Oc1ccc2c(c1)OCC2 Amb18643055 [1,1,0,0,0,0|2,0,0]=4 6806 B11R2.36 Oc1ccc2ccoc2c1 Amb18124404 [1,1,0,0,0,0|2,0,0]=4 6807 B11R2.36 Oc1ccc2ccsc2c1 Amb18644429 [1,1,0,0,0,0|2,0,0]=4 6808 B11R2.36 Oc1ccc2cnoc2c1 Amb10603075 [1,1,0,0,0,0|2,0,0]=4 6809 B11R2.36 Oc1ccc2cnsc2c1 Amb24466965 [1,1,0,0,0,0|2,0,0]=4 6810 B11R2.36 Oc1ccc2csnc2c1 Amb27389693 [1,1,0,0,0,0|1,1,0]=4 6811 B11R2.36 Oc1ccc2nonc2c1 Amb6572430 [1,1,0,0,0,0|2,0,0]=4 6812 B11R2.36 Oc1ccc2occc2c1 Amb16185813 [1,1,0,0,0,0|2,0,0]=4 6813 B11R2.36 Oc1ccc2oncc2c1 Amb23403626 [1,1,0,0,0,0|2,0,0]=4 6814 B11R2.36 Oc1ccc2sccc2c1 Amb18644430 [1,1,0,0,0,0|2,0,0]=4 6815 B11R2.36 Oc1ccc2sncc2c1 Amb18125219 [1,1,0,0,0,0|2,0,0]=4 6816 B11R2.36 Oc1cnc2c(c1)COC2 Amb33715188 [1,1,0,0,0,0|1,0,1]=4 6817 B11R2.36 Sc1ccc2c(c1)CCC2 Amb2371083 [1,1,0,0,0,0|1,0,1]=4 6818 B11R2.36 Sc1ccc2c(c1)CCO2 Amb7773594 [1,1,0,0,0,0|2,0,0]=4 6819 B11R2.36 Sc1ccc2c(c1)CNC2 Amb27612976 [1,1,0,0,0,0|1,0,1]=4 6820 B11R2.36 Sc1ccc2c(c1)COC2 Amb18177226 [1,1,0,0,0,0|0,0,1]=3 6821 B11R2.36 Sc1ccc2occc2c1 Amb24089279 [1,1,0,0,0,0|2,0,0]=4 6822 B11R2.106 Brc1cccc2c1CC=C2 Amb20247104 [1,1,0,0,0,0|1,0,0]=3 6823 B11R2.106 Brc1cccc2c1CCC2 Amb18812699 [1,1,0,0,0,0|1,0,1]=4 6824 B11R2.106 Brc1cccc2c1CCN2 Amb18048701 [1,1,0,0,0,0|2,0,0]=4 6825 B11R2.106 Brc1cccc2c1CCN2 Amb2383418 [1,1,0,0,0,0|2,0,0]=4 6826 B11R2.106 Brc1cccc2c1CCO2 Amb22054550 [1,1,0,0,0,0|2,0,0]=4 6827 B11R2.106 Brc1cccc2c1CNC2 Amb10067202 [1,1,0,0,0,0|1,0,1]=4 6828 B11R2.106 Brc1cccc2c1CNC2 Amb19515794 [1,1,0,0,0,0|1,0,1]=4 6829 B11R2.106 Brc1cccc2c1COC2 Amb28073852 [1,1,0,0,0,0|0,0,1]=3 6830 B11R2.106 Brc1cccc2c1NCC2 Amb1128232 [1,1,0,0,0,0|2,0,0]=4 6831 B11R2.106 Brc1cccc2c1NCC2 Amb22498225 [1,1,0,0,0,0|2,0,0]=4 6832 B11R2.106 Brc1cccc2c1OCC2 Amb18187519 [1,1,0,0,0,0|2,0,0]=4 6833 B11R2.106 Brc1cccc2c1SCC2 Amb18770997 [1,1,0,0,0,0|2,0,0]=4 6834 B11R2.106 Brc1cccc2ccoc12 Amb10069261 [1,1,0,0,0,0|2,0,0]=4 6835 B11R2.106 Brc1cccc2ccsc12 Amb6572040 [1,1,0,0,0,0|2,0,0]=4 6836 B11R2.106 Brc1cccc2cnoc12 Amb19149301 [1,1,0,0,0,0|2,0,0]=4 6837 B11R2.106 Brc1cccc2cnsc12 Amb18771333 [1,1,0,0,0,0|2,0,0]=4 6838 B11R2.106 Brc1cccc2conc12 Amb18187785 [1,1,0,0,0,0|1,0,0]=3 6839 B11R2.106 Brc1cccc2nonc12 Amb25146444 [1,1,0,0,0,0|2,0,0]=4 6840 B11R2.106 Brc1cccc2occc12 Amb16192002 [1,1,0,0,0,0|2,0,0]=4 6841 B11R2.106 Brc1cccc2oncc12 Amb18187792 [1,1,0,0,0,0|2,0,0]=4 6842 B11R2.106 Brc1cccc2sccc12 Amb2447607 [1,1,0,0,0,0|2,0,0]=4 6843 B11R2.106 Brc1cccc2sncc12 Amb24331358 [1,1,0,0,0,0|2,0,0]=4 6844 B11R2.106 Cc1cccc2c1C=CC2 Amb22232331 [1,1,0,0,0,0|1,0,0]=3 6845 B11R2.106 Cc1cccc2c1CC=C2 Amb22406488 [1,1,0,0,0,0|1,0,0]=3 6846 B11R2.106 Cc1cccc2c1CCC2 Amb17231881 [1,1,0,0,0,0|1,0,1]=4 6847 B11R2.106 Cc1cccc2c1CCN2 Amb21857789 [1,1,0,0,0,0|2,0,0]=4 6848 B11R2.106 Cc1cccc2c1CCN2 Amb2383422 [1,1,0,0,0,0|2,0,0]=4 6849 B11R2.106 Cc1cccc2c1CNC2 Amb23403689 [1,1,0,0,0,0|1,0,1]=4 6850 B11R2.106 Cc1cccc2c1CNC2 Amb32412173 [1,1,0,0,0,0|1,0,1]=4 6851 B11R2.106 Cc1cccc2c1CNC2 Amb9783181 [1,1,0,0,0,0|1,0,1]=4 6852 B11R2.106 Cc1cccc2c1N=NC2 Amb28435446 [1,1,0,0,0,0|2,0,0]=4 6853 B11R2.106 Cc1cccc2c1NCC2 Amb1108032 [1,1,0,0,0,0|2,0,0]=4 6854 B11R2.106 Cc1cccc2c1NCC2 Amb33551674 [1,1,0,0,0,0|2,0,0]=4 6855 B11R2.106 Cc1cccc2ccoc12 Amb2444982 [1,1,0,0,0,0|2,0,0]=4 6856 B11R2.106 Cc1cccc2ccsc12 Amb19419751 [1,1,0,0,0,0|2,0,0]=4 6857 B11R2.106 Cc1cccc2cnsc12 Amb26622206 [1,1,0,0,0,0|2,0,0]=4 6858 B11R2.106 Cc1cccc2csnc12 Amb27445105 [1,1,0,0,0,0|1,1,0]=4 6859 B11R2.106 Cc1cccc2nonc12 Amb2778456 [1,1,0,0,0,0|2,0,0]=4 6860 B11R2.106 Cc1cccc2nscc12 Amb24517093 [1,1,0,0,0,0|1,1,0]=4 6861 B11R2.106 Cc1cccc2sccc12 Amb21856961 [1,1,0,0,0,0|2,0,0]=4 6862 B11R2.106 Cc1cccc2sncc12 Amb24428918 [1,1,0,0,0,0|2,0,0]=4 6863 B11R2.106 Clc1cccc2c1C=CC2 Amb27237036 [1,1,0,0,0,0|1,0,0]=3 6864 B11R2.106 Clc1cccc2c1CC=C2 Amb2383766 [1,1,0,0,0,0|1,0,0]=3 6865 B11R2.106 Clc1cccc2c1CC=N2 Amb24078938 [1,1,0,0,0,0|2,0,0]=4 6866 B11R2.106 Clc1cccc2c1CCC2 Amb17232112 [1,1,0,0,0,0|1,0,1]=4 6867 B11R2.106 Clc1cccc2c1CCN2 Amb20630553 [1,1,0,0,0,0|2,0,0]=4 6868 B11R2.106 Clc1cccc2c1CCN2 Amb2383416 [1,1,0,0,0,0|2,0,0]=4 6869 B11R2.106 Clc1cccc2c1CCO2 Amb8389512 [1,1,0,0,0,0|2,0,0]=4 6870 B11R2.106 Clc1cccc2c1CNC2 Amb15690753 [1,1,0,0,0,0|1,0,1]=4 6871 B11R2.106 Clc1cccc2c1CNC2 Amb18831049 [1,1,0,0,0,0|1,0,1]=4 6872 B11R2.106 Clc1cccc2c1NCC2 Amb10199852 [1,1,0,0,0,0|2,0,0]=4 6873 B11R2.106 Clc1cccc2c1NCC2 Amb1107936 [1,1,0,0,0,0|2,0,0]=4 6874 B11R2.106 Clc1cccc2c1OCC2 Amb20620687 [1,1,0,0,0,0|2,0,0]=4 6875 B11R2.106 Clc1cccc2ccoc12 Amb21856195 [1,1,0,0,0,0|2,0,0]=4 6876 B11R2.106 Clc1cccc2ccsc12 Amb19516069 [1,1,0,0,0,0|2,0,0]=4 6877 B11R2.106 Clc1cccc2cnoc12 Amb22751081 [1,1,0,0,0,0|2,0,0]=4 6878 B11R2.106 Clc1cccc2cnsc12 Amb28049336 [1,1,0,0,0,0|2,0,0]=4 6879 B11R2.106 Clc1cccc2csnc12 Amb27837779 [1,1,0,0,0,0|1,1,0]=4 6880 B11R2.106 Clc1cccc2nocc12 Amb27758905 [1,1,0,0,0,0|1,0,0]=3 6881 B11R2.106 Clc1cccc2nonc12 Amb1076554 [1,1,0,0,0,0|2,0,0]=4 6882 B11R2.106 Clc1cccc2nscc12 Amb27224886 [1,1,0,0,0,0|1,1,0]=4 6883 B11R2.106 Clc1cccc2oncc12 Amb22497808 [1,1,0,0,0,0|2,0,0]=4 6884 B11R2.106 Clc1cccc2sccc12 Amb22586109 [1,1,0,0,0,0|2,0,0]=4 6885 B11R2.106 Clc1cccc2sncc12 Amb24645158 [1,1,0,0,0,0|2,0,0]=4 6886 B11R2.106 Clc1cncc2cocc12 Amb25679260 [1,1,0,0,0,0|1,0,1]=4 6887 B11R2.106 Fc1cccc2c1CC=C2 Amb2383767 [1,1,0,0,0,0|1,0,0]=3 6888 B11R2.106 Fc1cccc2c1CCC2 Amb17231895 [1,1,0,0,0,0|1,0,1]=4 6889 B11R2.106 Fc1cccc2c1CCN2 Amb10602729 [1,1,0,0,0,0|2,0,0]=4 6890 B11R2.106 Fc1cccc2c1CCN2 Amb2383417 [1,1,0,0,0,0|2,0,0]=4 6891 B11R2.106 Fc1cccc2c1CNC2 Amb15690752 [1,1,0,0,0,0|1,0,1]=4 6892 B11R2.106 Fc1cccc2c1CNC2 Amb8011543 [1,1,0,0,0,0|1,0,1]=4 6893 B11R2.106 Fc1cccc2c1NCC2 Amb1108731 [1,1,0,0,0,0|2,0,0]=4 6894 B11R2.106 Fc1cccc2c1NCC2 Amb22500604 [1,1,0,0,0,0|2,0,0]=4 6895 B11R2.106 Fc1cccc2c1OCC2 Amb23399921 [1,1,0,0,0,0|2,0,0]=4 6896 B11R2.106 Fc1cccc2ccoc12 Amb22372186 [1,1,0,0,0,0|2,0,0]=4 6897 B11R2.106 Fc1cccc2ccsc12 Amb22234737 [1,1,0,0,0,0|2,0,0]=4 6898 B11R2.106 Fc1cccc2cnoc12 Amb33493352 [1,1,0,0,0,0|2,0,0]=4 6899 B11R2.106 Fc1cccc2cnsc12 Amb26452227 [1,1,0,0,0,0|2,0,0]=4 6900 B11R2.106 Fc1cccc2nonc12 Amb17614386 [1,1,0,0,0,0|2,0,0]=4 6901 B11R2.106 Fc1cccc2occc12 Amb20241435 [1,1,0,0,0,0|2,0,0]=4 6902 B11R2.106 Fc1cccc2oncc12 Amb22497809 [1,1,0,0,0,0|2,0,0]=4 6903 B11R2.106 Fc1cccc2sccc12 Amb20171578 [1,1,0,0,0,0|2,0,0]=4 6904 B11R2.106 Ic1cccc2c1CCC2 Amb22494907 [1,1,0,0,0,0|1,0,1]=4 6905 B11R2.106 Ic1cccc2c1CCN2 Amb2383424 [1,1,0,0,0,0|2,0,0]=4 6906 B11R2.106 Ic1cccc2c1CCO2 Amb23399919 [1,1,0,0,0,0|2,0,0]=4 6907 B11R2.106 Ic1cccc2c1CNC2 Amb27242966 [1,1,0,0,0,0|1,0,1]=4 6908 B11R2.106 Ic1cccc2c1OCC2 Amb7990028 [1,1,0,0,0,0|2,0,0]=4 6909 B11R2.106 Ic1cccc2ccoc12 Amb23401835 [1,1,0,0,0,0|2,0,0]=4 6910 B11R2.106 Ic1cccc2ccsc12 Amb26974076 [1,1,0,0,0,0|2,0,0]=4 6911 B11R2.106 Ic1cccc2cnsc12 Amb25325115 [1,1,0,0,0,0|2,0,0]=4 6912 B11R2.106 Nc1cccc2c1CC=C2 Amb24539420 [1,1,0,0,0,0|1,0,0]=3 6913 B11R2.106 Nc1cccc2c1CCC2 Amb10068703 [1,1,0,0,0,0|1,0,1]=4 6914 B11R2.106 Nc1cccc2c1CCC2 Amb33456125 [1,1,0,0,0,0|1,0,1]=4 6915 B11R2.106 Nc1cccc2c1CCN2 Amb17569955 [1,1,0,0,0,0|2,0,0]=4 6916 B11R2.106 Nc1cccc2c1CCO2 Amb16233744 [1,1,0,0,0,0|2,0,0]=4 6917 B11R2.106 Nc1cccc2c1CNC2 Amb10067193 [1,1,0,0,0,0|1,0,1]=4 6918 B11R2.106 Nc1cccc2c1CNC2 Amb20241528 [1,1,0,0,0,0|1,0,1]=4 6919 B11R2.106 Nc1cccc2c1COC2 Amb18124450 [1,1,0,0,0,0|0,0,1]=3 6920 B11R2.106 Nc1cccc2c1NCC2 Amb17569956 [1,1,0,0,0,0|2,0,0]=4 6921 B11R2.106 Nc1cccc2c1NCC2 Amb22752813 [1,1,0,0,0,0|2,0,0]=4 6922 B11R2.106 Nc1cccc2c1OCC2 Amb7990030 [1,1,0,0,0,0|2,0,0]=4 6923 B11R2.106 Nc1cccc2c1SCC2 Amb18831218 [1,1,0,0,0,0|2,0,0]=4 6924 B11R2.106 Nc1cccc2ccoc12 Amb15772371 [1,1,0,0,0,0|2,0,0]=4 6925 B11R2.106 Nc1cccc2ccoc12 Amb31291351 [1,1,0,0,0,0|2,0,0]=4 6926 B11R2.106 Nc1cccc2ccsc12 Amb17570001 [1,1,0,0,0,0|2,0,0]=4 6927 B11R2.106 Nc1cccc2ccsc12 Amb28555542 [1,1,0,0,0,0|2,0,0]=4 6928 B11R2.106 Nc1cccc2cnoc12 Amb22233975 [1,1,0,0,0,0|2,0,0]=4 6929 B11R2.106 Nc1cccc2cnsc12 Amb18201818 [1,1,0,0,0,0|2,0,0]=4 6930 B11R2.106 Nc1cccc2conc12 Amb18203159 [1,1,0,0,0,0|1,0,0]=3 6931 B11R2.106 Nc1cccc2csnc12 Amb22736384 [1,1,0,0,0,0|1,1,0]=4 6932 B11R2.106 Nc1cccc2nocc12 Amb18203157 [1,1,0,0,0,0|1,0,0]=3 6933 B11R2.106 Nc1cccc2nonc12 Amb33527271 [1,1,0,0,0,0|2,0,0]=4 6934 B11R2.106 Nc1cccc2nscc12 Amb22736314 [1,1,0,0,0,0|1,1,0]=4 6935 B11R2.106 Nc1cccc2occc12 Amb17569954 [1,1,0,0,0,0|2,0,0]=4 6936 B11R2.106 Nc1cccc2occc12 Amb35750149 [1,1,0,0,0,0|2,0,0]=4 6937 B11R2.106 Nc1cccc2oncc12 Amb22495450 [1,1,0,0,0,0|2,0,0]=4 6938 B11R2.106 Nc1cccc2sccc12 Amb22499707 [1,1,0,0,0,0|2,0,0]=4 6939 B11R2.106 Nc1cccc2sccc12 Amb8439504 [1,1,0,0,0,0|2,0,0]=4 6940 B11R2.106 O=C1C=CC=C2CC=CN12 Amb27438668 [1,1,0,0,0,0|2,0,0]=4 6941 B11R2.106 Oc1cccc2c1C=CC2 Amb26875548 [1,1,0,0,0,0|1,0,0]=3 6942 B11R2.106 Oc1cccc2c1CCC2 Amb10844833 [1,1,0,0,0,0|1,0,1]=4 6943 B11R2.106 Oc1cccc2c1CCN2 Amb18124453 [1,1,0,0,0,0|2,0,0]=4 6944 B11R2.106 Oc1cccc2c1CCN2 Amb33552627 [1,1,0,0,0,0|2,0,0]=4 6945 B11R2.106 Oc1cccc2c1CCO2 Amb26621958 [1,1,0,0,0,0|2,0,0]=4 6946 B11R2.106 Oc1cccc2c1CCS2 Amb18644525 [1,1,0,0,0,0|2,0,0]=4 6947 B11R2.106 Oc1cccc2c1CNC2 Amb20241438 [1,1,0,0,0,0|1,0,1]=4 6948 B11R2.106 Oc1cccc2c1CNC2 Amb25324336 [1,1,0,0,0,0|1,0,1]=4 6949 B11R2.106 Oc1cccc2c1NON2 Amb27756384 [1,1,0,0,0,0|2,0,0]=4 6950 B11R2.106 Oc1cccc2c1OCC2 Amb22264532 [1,1,0,0,0,0|2,0,0]=4 6951 B11R2.106 Oc1cccc2c1SCC2 Amb18644528 [1,1,0,0,0,0|2,0,0]=4 6952 B11R2.106 Oc1cccc2ccoc12 Amb10070901 [1,1,0,0,0,0|2,0,0]=4 6953 B11R2.106 Oc1cccc2ccsc12 Amb18644431 [1,1,0,0,0,0|2,0,0]=4 6954 B11R2.106 Oc1cccc2cnoc12 Amb15701577 [1,1,0,0,0,0|2,0,0]=4 6955 B11R2.106 Oc1cccc2cnsc12 Amb28198574 [1,1,0,0,0,0|2,0,0]=4 6956 B11R2.106 Oc1cccc2csnc12 Amb27882576 [1,1,0,0,0,0|1,1,0]=4 6957 B11R2.106 Oc1cccc2nonc12 Amb4139677 [1,1,0,0,0,0|2,0,0]=4 6958 B11R2.106 Oc1cccc2nscc12 Amb28315796 [1,1,0,0,0,0|1,1,0]=4 6959 B11R2.106 Oc1cccc2occc12 Amb18124403 [1,1,0,0,0,0|2,0,0]=4 6960 B11R2.106 Oc1cccc2oncc12 Amb23437223 [1,1,0,0,0,0|2,0,0]=4 6961 B11R2.106 Oc1cccc2sccc12 Amb18125084 [1,1,0,0,0,0|2,0,0]=4 6962 B11R2.106 Oc1cccc2sncc12 Amb24331356 [1,1,0,0,0,0|2,0,0]=4 6963 B11R2.106 Sc1cccc2c1CCC2 Amb33145452 [1,1,0,0,0,0|1,0,1]=4 6964 B11R2.106 Sc1cccc2c1OCC2 Amb33416983 [1,1,0,0,0,0|2,0,0]=4 6965 B11R2.8 C=C1Cc2sccc2C1=O Amb18561540 [0,1,0,0,1,0|2,0,0]=4 6966 B11R2.8 CC1Cc2sccc2C1=O Amb18063800 [0,1,0,0,1,0|2,0,0]=4 6967 B11R2.8 NC1Cc2sccc2C1=O Amb18831125 [0,1,0,0,1,0|2,0,0]=4 6968 B11R2.8 NC1Cn2cccc2C1=O Amb27768616 [0,1,0,0,1,0|2,0,0]=4 6969 B11R2.8 O=C1Cn2cccc2C1=O Amb27409623 [0,1,0,0,1,0|2,0,0]=4 6970 B11R2.8 O=C1c2ccsc2CC1Br Amb8485551 [0,1,0,0,1,0|2,0,0]=4 6971 B11R2.8 O=C1c2sccc2C[C@H]1O Amb27453565 [0,1,0,0,1,0|2,0,0]=4 6972 B11R2.60 Cc1ccc2n1CCC2=O Amb28201116 [0,1,0,0,1,0|2,0,0]=4 6973 B11R2.60 Cc1csc2c1COC2=O Amb25794641 [0,1,0,0,1,0|1,0,0]=3 6974 B11R2.60 Cn1ccc2c1CCC2=O Amb18832503 [0,1,0,0,1,0|2,0,0]=4 6975 B11R2.60 O=C1CCc2c(Cl)csc21 Amb5719888 [0,1,0,0,1,0|2,0,0]=4 6976 B11R2.60 O=C1CCc2c1csc2Br Amb18769999 [0,1,0,0,1,0|2,0,0]=4 6977 B11R2.60 O=C1NCc2c(Br)csc21 Amb27218650 [0,1,0,0,1,0|2,0,0]=4 6978 B11R2.66 C=C1CC2=C(C1)C(=O)OC2 Amb27476528 [0,1,0,0,1,0|0,0,2]=4 6979 B11R2.66 Cc1cc2c(o1)C(=O)NC2 Amb18832407 [0,1,0,0,1,0|2,0,0]=4 6980 B11R2.66 Cc1cc2c(o1)CCC2=O Amb18832478 [0,1,0,0,1,0|2,0,0]=4 6981 B11R2.66 Cc1cc2c(s1)C(=O)CC2 Amb28200406 [0,1,0,0,1,0|2,0,0]=4 6982 B11R2.66 Cc1cc2c(s1)C(=O)NC2 Amb18831123 [0,1,0,0,1,0|2,0,0]=4 6983 B11R2.66 Cc1cc2c(s1)CCC2=O Amb18201229 [0,1,0,0,1,0|2,0,0]=4 6984 B11R2.66 Nc1cc2c(o1)C(=O)NC2 Amb18832264 [0,1,0,0,1,0|2,0,0]=4 6985 B11R2.66 Nc1cc2c(s1)C(=O)NC2 Amb18831013 [0,1,0,0,1,0|2,0,0]=4 6986 B11R2.66 Nc1cc2c(s1)CCC2=O Amb18687935 [0,1,0,0,1,0|2,0,0]=4 6987 B11R2.66 Nc1cc2n(c1)CCC2=O Amb28241727 [0,1,0,0,1,0|2,0,0]=4 6988 B11R2.66 O=C1CCc2cc(Br)oc21 Amb18810384 [0,1,0,0,1,0|2,0,0]=4 6989 B11R2.66 O=C1CCc2cc(Cl)oc21 Amb27962964 [0,1,0,0,1,0|2,0,0]=4 6990 B11R2.66 O=C1CCc2cc(Cl)sc21 Amb5720031 [0,1,0,0,1,0|2,0,0]=4 6991 B11R2.66 O=C1CCc2oc(Br)cc21 Amb18810385 [0,1,0,0,1,0|2,0,0]=4 6992 B11R2.66 O=C1CCc2sc(Br)cc21 Amb18770007 [0,1,0,0,1,0|2,0,0]=4 6993 B11R2.66 O=C1CCc2sc(Cl)cc21 Amb20669513 [0,1,0,0,1,0|2,0,0]=4 6994 B11R2.66 O=C1CCn2cc(Br)cc21 Amb27755550 [0,1,0,0,1,0|2,0,0]=4 6995 B11R2.66 O=C1NCc2cc(Br)oc21 Amb18787300 [0,1,0,0,1,0|2,0,0]=4 6996 B11R2.66 O=C1NCc2cc(Br)sc21 Amb18769398 [0,1,0,0,1,0|2,0,0]=4 6997 B11R2.66 O=C1OCc2cc(Br)sc21 Amb26050194 [0,1,0,0,1,0|1,0,0]=3 6998 B11R2.67 Cc1ccn2c1C(=O)CC2 Amb6298423 [0,1,0,0,1,0|2,0,0]=4 6999 B11R2.67 Cc1csc2c1C(=O)CC2 Amb28049883 [0,1,0,0,1,0|2,0,0]=4 7000 B11R2.67 Cn1ccc2c1C(=O)CC2 Amb28050183 [0,1,0,0,1,0|2,0,0]=4 7001 B11R2.67 O=C1CCn2ccc(O)c21 Amb28067773 [0,1,0,0,1,0|2,0,0]=4 7002 B11R2.202 CC1CC(=O)c2cccn21 Amb25713030 [0,1,0,0,1,0|2,0,0]=4 7003 B11R2.202 CC1CC(=O)n2cccc21 Amb27667117 [0,1,0,0,1,0|2,0,0]=4 7004 B11R2.202 CC1OC(=O)c2sccc21 Amb27481075 [0,1,0,0,1,0|1,0,0]=3 7005 B11R2.202 NC1CC(=O)c2cscc21 Amb18831124 [0,1,0,0,1,0|2,0,0]=4 7006 B11R2.202 NC1CC(=O)c2sccc21 Amb17902397 [0,1,0,0,1,0|2,0,0]=4 7007 B11R2.202 NC1CC(=O)c2sccc21 Amb25059089 [0,1,0,0,1,0|2,0,0]=4 7008 B11R2.202 O=C1CC(Cl)c2cccn21 Amb28126964 [0,1,0,0,1,0|2,0,0]=4 7009 B11R2.202 O=C1OC(=O)c2cscc21 Amb22898802 [0,1,0,0,1,0|1,0,1]=4 7010 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [0,1,0,0,1,0|0,0,0]=2 7011 B11R2.54 C[C@H]1c2ccccc2[C@@H]1O Amb27484595 [0,1,0,0,1,0|0,0,2]=4 7012 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [0,1,0,0,1,0|0,0,1]=3 7013 B11R2.54 O=C1c2ccccc2C1Cl Amb21948336 [0,1,0,0,1,0|0,0,0]=2 7014 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [0,1,0,0,1,0|0,0,0]=2 7015 B11R2.54 O[C@H]1c2ccccc2[C@H]1O Amb27406819 [0,1,0,0,1,0|0,0,2]=4 7016 B11R2.59 CC1(C)Cc2ccccc21 Amb17844031 [0,1,0,0,1,0|1,0,1]=4 7017 B11R2.59 CC1(N)Cc2ccccc21 Amb27434919 [0,1,0,0,1,0|1,0,1]=4 7018 B11R2.59 CC1(N)Cc2ccccc21 Amb32665064 [0,1,0,0,1,0|1,0,1]=4 7019 B11R2.59 CC1(O)Cc2ccccc21 Amb17844000 [0,1,0,0,1,0|0,0,2]=4 7020 B11R2.59 ClC1(Cl)Cc2ccccc21 Amb17778864 [0,1,0,0,1,0|1,0,1]=4 7021 B11R2.59 [2H]C1(O)Cc2ccccc21 Amb17778677 [0,1,0,0,1,0|0,0,2]=4 7022 B11R2.104 C=C1CC2=C1C=CNC2=O Amb27843350 [0,1,0,0,1,0|2,0,0]=4 7023 B11R2.104 Cc1cccc2c1CC2=O Amb17843957 [0,1,0,0,1,0|0,0,0]=2 7024 B11R2.104 NC1Cc2c(O)cccc21 Amb27186102 [0,1,0,0,1,0|1,0,1]=4 7025 B11R2.117 Cc1ccc2c(c1)C(=O)C2 Amb17843960 [0,1,0,0,1,0|0,0,0]=2 7026 B11R2.117 Cc1cnc2c(c1)C(=O)N2 Amb28074141 [0,1,0,0,1,0|2,0,0]=4 7027 B11R2.117 F[C@@H]1Cc2ccc(Br)cc21 Amb27485919 [0,1,0,0,1,0|1,0,1]=4 7028 B11R2.117 NC1Cc2ccc(Br)cc21 Amb28326330 [0,1,0,0,1,0|1,0,1]=4 7029 B11R2.117 O=C1Cc2ccc(Cl)cc21 Amb28253954 [0,1,0,0,1,0|0,0,0]=2 7030 B11R2.117 O=C1Cc2ccc(F)cc21 Amb25729418 [0,1,0,0,1,0|0,0,0]=2 7031 B11R2.117 OC1Cc2ccc(Cl)cc21 Amb28207165 [0,1,0,0,1,0|0,0,2]=4 7032 B11R2.117 OC1Cc2ccc(F)cc21 Amb27198002 [0,1,0,0,1,0|0,0,2]=4 7033 B11R2.363 Cc1ccc2c(c1)CC2=O Amb17843959 [0,1,0,0,1,0|0,0,0]=2 7034 B11R2.363 Cc1ccc2c(n1)NC2=O Amb28120096 [0,1,0,0,1,0|2,0,0]=4 7035 B11R2.363 O=C1Cc2c[n+]([O-])ccc21 Amb27227171 [0,1,0,0,1,0|1,0,0]=3 7036 B11R2.363 O=C1Cc2cc(Br)ccc21 Amb27839410 [0,1,0,0,1,0|0,0,0]=2 7037 B11R2.363 O=C1Cc2cc(O)ccc21 Amb27802518 [0,1,0,0,1,0|0,0,0]=2 7038 B11R2.468 Cc1cccc2c1C(=O)C2 Amb27770444 [0,1,0,0,1,0|0,0,0]=2 7039 B11R2.468 NC1Cc2cccc(Cl)c21 Amb26033897 [0,1,0,0,1,0|1,0,1]=4 7040 B11R2.468 O=C1Cc2cccc(Br)c21 Amb17843975 [0,1,0,0,1,0|0,0,0]=2 7041 B11R2.468 O=C1Cc2cccc(Cl)c21 Amb21948281 [0,1,0,0,1,0|0,0,0]=2 7042 B11R2.468 O=C1Cc2cccc(F)c21 Amb17778729 [0,1,0,0,1,0|0,0,0]=2 7043 B11R2.468 OC1Cc2cccc(Cl)c21 Amb28350295 [0,1,0,0,1,0|0,0,2]=4 7044 B11R2.468 OC1Cc2cccc(F)c21 Amb17778679 [0,1,0,0,1,0|0,0,2]=4 7045 B11R2.988 C=CC1Cc2ccccc21 Amb17778869 [0,1,0,0,1,0|1,0,1]=4 7046 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [0,1,0,0,1,0|1,0,1]=4 7047 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,1,0,0,1,0|1,0,1]=4 7048 B11R2.988 CNC1Cc2ccccc21 Amb28315966 [0,1,0,0,1,0|1,0,1]=4 7049 B11R2.988 COC1=Cc2ccccc21 Amb27267205 [0,1,0,0,1,0|0,0,2]=4 7050 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,1,0,0,1,0|0,0,2]=4 7051 B11R2.988 N#CC1=Cc2ccccc21 Amb22227852 [0,1,0,0,1,0|1,0,1]=4 7052 B11R2.988 N#CC1Cc2ccccc21 Amb2778424 [0,1,0,0,1,0|1,0,1]=4 7053 B11R2.988 NCC1Cc2ccccc21 Amb10609227 [0,1,0,0,1,0|1,0,1]=4 7054 B11R2.988 O=CC1Cc2ccccc21 Amb16230472 [0,1,0,0,1,0|0,0,1]=3 7055 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [0,1,0,0,1,0|0,0,2]=4 7056 B11R2.988 O\N=C1/Cc2ccccc21 Amb3862130 [0,1,0,0,1,0|0,0,1]=3 7057 B11R2.988 SCC1Cc2ccccc21 Amb27866792 [0,1,0,0,1,0|0,1,1]=4 7058 B13R2.32 C=C1C(=O)C=Cc2ccccc21 Amb27270865 [0,1,0,0,0,1|1,0,1]=4 7059 B13R2.32 C=C1CCc2ccccc2C1=O Amb18561613 [0,1,0,0,0,1|2,0,0]=4 7060 B13R2.32 CC1=C(C)c2ccccc2CC1 Amb31292547 [0,1,0,0,0,1|2,0,0]=4 7061 B13R2.32 CC1=C(C)c2ccccc2CN1 Amb27392086 [0,1,0,0,0,1|2,0,0]=4 7062 B13R2.32 CC1=C2C=CC=CC2=CNC1=O Amb27857230 [0,1,0,0,0,1|1,0,1]=4 7063 B13R2.32 CC1C(=O)CCc2ccccc21 Amb4605911 [0,1,0,0,0,1|1,0,0]=3 7064 B13R2.32 CN1C(=O)C=Cc2ccccc21 Amb19116112 [0,1,0,0,0,1|1,0,1]=4 7065 B13R2.32 CN1C(=O)CCc2ccccc21 Amb17322846 [0,1,0,0,0,1|1,0,0]=3 7066 B13R2.32 CN1C(=O)CNc2ccccc21 Amb8471882 [0,1,0,0,0,1|2,0,0]=4 7067 B13R2.32 CN1C(=O)COc2ccccc21 Amb1351378 [0,1,0,0,0,1|2,0,0]=4 7068 B13R2.32 CN1C(=O)CSc2ccccc21 Amb3484441 [0,1,0,0,0,1|2,0,0]=4 7069 B13R2.32 CN1C(=O)NCc2ccccc21 Amb28243973 [0,1,0,0,0,1|1,0,0]=3 7070 B13R2.32 CN1C(=O)NCc2cccnc21 Amb27949163 [0,1,0,0,0,1|2,0,0]=4 7071 B13R2.32 CN1C(=O)NCc2ncccc21 Amb27600581 [0,1,0,0,0,1|2,0,0]=4 7072 B13R2.32 CN1C(=S)CCc2ccccc21 Amb28185012 [0,1,0,0,0,1|1,1,0]=4 7073 B13R2.32 Cn1c(=O)cnc2ccccc21 Amb2612192 [0,1,0,0,0,1|2,0,0]=4 7074 B13R2.32 N=C1C(=O)C=Cc2ccccc21 Amb27227038 [0,1,0,0,0,1|1,0,1]=4 7075 B13R2.32 NC1C(=O)CCc2ccccc21 Amb27481724 [0,1,0,0,0,1|1,0,0]=3 7076 B13R2.32 NC1C(=O)NCc2ccccc21 Amb21857372 [0,1,0,0,0,1|1,0,0]=3 7077 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22436817 [0,1,0,0,0,1|1,0,0]=3 7078 B13R2.32 NC1C(=O)OCc2ccccc21 Amb25275532 [0,1,0,0,0,1|0,0,0]=2 7079 B13R2.32 O=C1C=Cc2ccccc2C1=O Amb534349 [0,1,0,0,0,1|1,0,1]=4 7080 B13R2.32 O=C1C=Cc2ccccc2C1=S Amb27177701 [0,1,0,0,0,1|1,0,1]=4 7081 B13R2.32 O=C1C=Cc2ccccc2N1O Amb22723451 [0,1,0,0,0,1|1,0,1]=4 7082 B13R2.32 O=C1CCc2ccccc2C1=O Amb28200177 [0,1,0,0,0,1|1,0,0]=3 7083 B13R2.32 O=C1CCc2ccccc2C1Cl Amb27484080 [0,1,0,0,0,1|1,0,0]=3 7084 B13R2.32 O=C1CCc2ccccc2C1F Amb25092927 [0,1,0,0,0,1|1,0,0]=3 7085 B13R2.32 O=C1CCc2ccccc2N1O Amb1099957 [0,1,0,0,0,1|1,0,0]=3 7086 B13R2.32 O=C1COc2ccccc2N1O Amb2423861 [0,1,0,0,0,1|2,0,0]=4 7087 B13R2.32 O=C1N=Cc2ccccc2N1O Amb28248668 [0,1,0,0,0,1|1,0,1]=4 7088 B13R2.32 O=C1NC=C2C=CC=CC2=C1F Amb25269874 [0,1,0,0,0,1|1,0,1]=4 7089 B13R2.32 O=C1OCc2ccccc2C1=O Amb24633619 [0,1,0,0,0,1|0,0,0]=2 7090 B13R2.57 CNC1=Nc2ccccc2CC1 Amb26443433 [0,1,0,0,0,1|2,0,0]=4 7091 B13R2.57 CNC1=Nc2ccccc2CN1 Amb27477971 [0,1,0,0,0,1|2,0,0]=4 7092 B13R2.57 CNC1=Nc2ccccc2CS1 Amb27616677 [0,1,0,0,0,1|1,1,0]=4 7093 B13R2.57 COC1=Nc2ccccc2CC1 Amb27179706 [0,1,0,0,0,1|1,0,1]=4 7094 B13R2.57 CSC1=NCc2ccccc2N1 Amb10976190 [0,1,0,0,0,1|1,1,0]=4 7095 B13R2.57 CSC1=NCc2ccccc2N1 Amb24678310 [0,1,0,0,0,1|1,1,0]=4 7096 B13R2.57 CSC1=[NH+]c2ccccc2CN1 Amb9810736 [0,1,0,0,0,1|1,1,0]=4 7097 B13R2.57 ClCC1=CCc2ccccc2O1 Amb27642028 [0,1,0,0,0,1|2,0,0]=4 7098 B13R2.57 Cl\C=C1\CCc2ccccc2C1 Amb27843521 [0,1,0,0,0,1|2,0,0]=4 7099 B13R2.57 N#CC1=NCc2ccccc2N1 Amb19866560 [0,1,0,0,0,1|2,0,0]=4 7100 B13R2.57 NCC1=Cc2ccccc2CC1 Amb18063880 [0,1,0,0,0,1|2,0,0]=4 7101 B13R2.57 NCC1=Nc2ccccc2CN1 Amb19335807 [0,1,0,0,0,1|2,0,0]=4 7102 B13R2.57 NCC1=Nc2ccccc2CN1 Amb26497988 [0,1,0,0,0,1|2,0,0]=4 7103 B13R2.57 NCC1Cc2ccccc2CO1 Amb22232904 [0,1,0,0,0,1|1,0,1]=4 7104 B13R2.57 NC[C@@H]1Cc2ccccc2CO1 Amb32668257 [0,1,0,0,0,1|1,0,1]=4 7105 B13R2.57 N\N=C1\CCc2ccccc2C1 Amb28317518 [0,1,0,0,0,1|2,0,0]=4 7106 B13R2.57 O=CC1=CNc2ccccc2C1 Amb25152519 [0,1,0,0,0,1|2,0,0]=4 7107 B13R2.57 O=CC1=COc2ccccc2O1 Amb25348637 [0,1,0,0,0,1|2,0,0]=4 7108 B13R2.57 O=CC1=CSc2ccccc2S1 Amb28239532 [0,1,0,0,0,1|2,0,0]=4 7109 B13R2.57 O=CC1=Cc2ccccc2OC1 Amb1158025 [0,1,0,0,0,1|2,0,0]=4 7110 B13R2.57 O=CC1=Cc2ccccc2SS1 Amb27409512 [0,1,0,0,0,1|1,1,0]=4 7111 B13R2.57 O=CC1CCc2ccccc2C1 Amb18645362 [0,1,0,0,0,1|1,0,1]=4 7112 B13R2.57 O=CC1CCc2ccccc2O1 Amb24436100 [0,1,0,0,0,1|1,0,1]=4 7113 B13R2.57 O=C[C@@H]1CCc2ccccc2O1 Amb27493050 [0,1,0,0,0,1|1,0,1]=4 7114 B13R2.57 O=C[C@H]1CCc2ccccc2O1 Amb26899040 [0,1,0,0,0,1|1,0,1]=4 7115 B13R2.57 O=Cc1cc2ccccc2cn1 Amb8010573 [0,1,0,0,0,1|1,0,1]=4 7116 B13R2.57 O=Cc1ccc2ccccc2c1 Amb3939951 [0,1,0,0,0,1|1,0,1]=4 7117 B13R2.57 O=Cc1ccc2ccccc2n1 Amb533663 [0,1,0,0,0,1|1,0,1]=4 7118 B13R2.57 O=Cc1cnc2ccccc2c1 Amb1995106 [0,1,0,0,0,1|2,0,0]=4 7119 B13R2.57 O=Cc1cnc2ccccc2n1 Amb6315572 [0,1,0,0,0,1|2,0,0]=4 7120 B13R2.57 O=NN1CCc2ccccc2C1 Amb22372302 [0,1,0,0,0,1|2,0,0]=4 7121 B13R2.57 O=Nc1ccc2ccccc2c1 Amb27170669 [0,1,0,0,0,1|1,0,1]=4 7122 B13R2.57 OCC1Cc2ccccc2CO1 Amb22642212 [0,1,0,0,0,1|0,0,2]=4 7123 B13R2.57 OC[C@@H]1Cc2ccccc2CO1 Amb32668348 [0,1,0,0,0,1|0,0,2]=4 7124 B13R2.57 O\N=C1\CCc2ccccc2C1 Amb27223803 [0,1,0,0,0,1|1,0,1]=4 7125 B13R2.155 CC1=CC2=CC(=O)NC=C2C=C1 Amb22371048 [0,1,0,0,0,1|1,0,1]=4 7126 B13R2.155 Cc1ccc2c(c1)CC(=O)CC2 Amb4296963 [0,1,0,0,0,1|1,0,0]=3 7127 B13R2.155 Cc1ccc2c(c1)CC(=O)CS2 Amb27616697 [0,1,0,0,0,1|2,0,0]=4 7128 B13R2.155 Cc1ccc2c(c1)CC(=O)NC2 Amb28287804 [0,1,0,0,0,1|1,0,0]=3 7129 B13R2.155 Cc1ccc2c(c1)N=C(N)SC2 Amb27974135 [0,1,0,0,0,1|1,1,0]=4 7130 B13R2.155 Cc1ccc2c(c1)NC(=O)C=C2 Amb21857833 [0,1,0,0,0,1|1,0,1]=4 7131 B13R2.155 Cc1ccc2c(c1)NC(=O)CC2 Amb17470423 [0,1,0,0,0,1|1,0,0]=3 7132 B13R2.155 Cc1ccc2c(c1)NC(=O)CN2 Amb9769140 [0,1,0,0,0,1|2,0,0]=4 7133 B13R2.155 Cc1ccc2c(c1)NC(=O)CO2 Amb1950694 [0,1,0,0,0,1|2,0,0]=4 7134 B13R2.155 Cc1ccc2c(c1)NC(=O)CS2 Amb24485699 [0,1,0,0,0,1|2,0,0]=4 7135 B13R2.155 Cc1ccc2c(c1)NC(=O)N=C2 Amb24468183 [0,1,0,0,0,1|1,0,1]=4 7136 B13R2.155 Cc1ccc2c(c1)NC(=O)OC2 Amb24495816 [0,1,0,0,0,1|0,0,0]=2 7137 B13R2.155 Cc1ccc2c(c1)OC(=O)C=C2 Amb18511476 [0,1,0,0,0,1|1,0,1]=4 7138 B13R2.155 Cc1ccc2c(c1)OC(=O)CC2 Amb27975901 [0,1,0,0,0,1|1,0,0]=3 7139 B13R2.155 Cc1ccc2c(c1)OC(=O)NC2 Amb27967408 [0,1,0,0,0,1|1,0,0]=3 7140 B13R2.155 Cc1ccc2c(c1)OC(=O)OC2 Amb27861046 [0,1,0,0,0,1|0,0,0]=2 7141 B13R2.155 Cc1ccc2c(n1)NC(=O)CC2 Amb22756140 [0,1,0,0,0,1|2,0,0]=4 7142 B13R2.155 Cc1cnc2c(c1)CC(=O)CC2 Amb27426898 [0,1,0,0,0,1|2,0,0]=4 7143 B13R2.155 Fc1ccc2c(c1)OC(=S)NC2 Amb27967444 [0,1,0,0,0,1|1,1,0]=4 7144 B13R2.155 NC1=Nc2cc(F)ccc2CN1 Amb27645333 [0,1,0,0,0,1|2,0,0]=4 7145 B13R2.155 Nc1cc2c(cn1)CCC(=O)N2 Amb27246871 [0,1,0,0,0,1|2,0,0]=4 7146 B13R2.155 Nc1ccc2c(c1)CC(=O)NC2 Amb28196694 [0,1,0,0,0,1|1,0,0]=3 7147 B13R2.155 Nc1ccc2c(c1)NC(=O)C=C2 Amb18545106 [0,1,0,0,0,1|1,0,1]=4 7148 B13R2.155 Nc1ccc2c(c1)NC(=O)C=N2 Amb19789097 [0,1,0,0,0,1|2,0,0]=4 7149 B13R2.155 Nc1ccc2c(c1)NC(=O)CC2 Amb6315612 [0,1,0,0,0,1|1,0,0]=3 7150 B13R2.155 Nc1ccc2c(c1)NC(=O)CN2 Amb18829408 [0,1,0,0,0,1|2,0,0]=4 7151 B13R2.155 Nc1ccc2c(c1)NC(=O)CN2 Amb8631306 [0,1,0,0,0,1|2,0,0]=4 7152 B13R2.155 Nc1ccc2c(c1)NC(=O)CO2 Amb1102026 [0,1,0,0,0,1|2,0,0]=4 7153 B13R2.155 Nc1ccc2c(c1)NC(=O)CS2 Amb6324634 [0,1,0,0,0,1|2,0,0]=4 7154 B13R2.155 Nc1ccc2c(c1)NC(=O)NC2 Amb22754754 [0,1,0,0,0,1|1,0,0]=3 7155 B13R2.155 Nc1ccc2c(c1)NC(=O)OC2 Amb25765690 [0,1,0,0,0,1|0,0,0]=2 7156 B13R2.155 Nc1ccc2c(c1)OC(=O)C=C2 Amb19130409 [0,1,0,0,0,1|1,0,1]=4 7157 B13R2.155 O=C1C=C2C=C(Br)C=CC2=CN1 Amb22371047 [0,1,0,0,0,1|1,0,1]=4 7158 B13R2.155 O=C1C=C2C=C(Cl)C=CC2=CN1 Amb24723301 [0,1,0,0,0,1|1,0,1]=4 7159 B13R2.155 O=C1C=Cc2ccc(Br)cc2N1 Amb20248087 [0,1,0,0,0,1|1,0,1]=4 7160 B13R2.155 O=C1C=Cc2ccc(Br)cc2O1 Amb26841310 [0,1,0,0,0,1|1,0,1]=4 7161 B13R2.155 O=C1C=Cc2ccc(Cl)cc2N1 Amb19894727 [0,1,0,0,0,1|1,0,1]=4 7162 B13R2.155 O=C1C=Cc2ccc(F)cc2N1 Amb23412015 [0,1,0,0,0,1|1,0,1]=4 7163 B13R2.155 O=C1C=Cc2ccc(F)cc2O1 Amb24736406 [0,1,0,0,0,1|1,0,1]=4 7164 B13R2.155 O=C1C=Cc2ccc(I)cc2O1 Amb26420862 [0,1,0,0,0,1|1,0,1]=4 7165 B13R2.155 O=C1C=Cc2ccc(O)cc2N1 Amb18645438 [0,1,0,0,0,1|1,0,1]=4 7166 B13R2.155 O=C1C=Cc2ccc(O)cc2O1 Amb18511480 [0,1,0,0,0,1|1,0,1]=4 7167 B13R2.155 O=C1C=Cc2ccc(S)cc2O1 Amb27963071 [0,1,0,0,0,1|1,0,1]=4 7168 B13R2.155 O=C1C=Nc2ccc(Br)cc2N1 Amb19789102 [0,1,0,0,0,1|2,0,0]=4 7169 B13R2.155 O=C1C=Nc2ccc(Cl)cc2N1 Amb19889641 [0,1,0,0,0,1|2,0,0]=4 7170 B13R2.155 O=C1C=Nc2ccc(I)cc2N1 Amb25178643 [0,1,0,0,0,1|2,0,0]=4 7171 B13R2.155 O=C1CCc2ccc(Br)cc2C1 Amb2695318 [0,1,0,0,0,1|1,0,0]=3 7172 B13R2.155 O=C1CCc2ccc(Br)cc2N1 Amb8496592 [0,1,0,0,0,1|1,0,0]=3 7173 B13R2.155 O=C1CCc2ccc(Cl)cc2C1 Amb4296960 [0,1,0,0,0,1|1,0,0]=3 7174 B13R2.155 O=C1CCc2ccc(Cl)cc2N1 Amb8393602 [0,1,0,0,0,1|1,0,0]=3 7175 B13R2.155 O=C1CCc2ccc(Cl)nc2N1 Amb24426076 [0,1,0,0,0,1|2,0,0]=4 7176 B13R2.155 O=C1CCc2ccc(F)cc2C1 Amb2695308 [0,1,0,0,0,1|1,0,0]=3 7177 B13R2.155 O=C1CCc2ccc(F)cc2N1 Amb9147577 [0,1,0,0,0,1|1,0,0]=3 7178 B13R2.155 O=C1CCc2ccc(I)cc2C1 Amb28244060 [0,1,0,0,0,1|1,0,0]=3 7179 B13R2.155 O=C1CCc2ccc(I)cc2N1 Amb22490797 [0,1,0,0,0,1|1,0,0]=3 7180 B13R2.155 O=C1CCc2ccc(O)cc2C1 Amb4296962 [0,1,0,0,0,1|1,0,0]=3 7181 B13R2.155 O=C1CCc2ccc(O)cc2N1 Amb535725 [0,1,0,0,0,1|1,0,0]=3 7182 B13R2.155 O=C1CCc2ccc(O)cc2O1 Amb5717908 [0,1,0,0,0,1|1,0,0]=3 7183 B13R2.155 O=C1CCc2ncc(Br)cc2N1 Amb27770085 [0,1,0,0,0,1|2,0,0]=4 7184 B13R2.155 O=C1CCc2ncc(Cl)cc2C1 Amb26948649 [0,1,0,0,0,1|2,0,0]=4 7185 B13R2.155 O=C1CCc2ncc(F)cc2N1 Amb27668880 [0,1,0,0,0,1|2,0,0]=4 7186 B13R2.155 O=C1CNc2ccc(Br)cc2C1 Amb18160330 [0,1,0,0,0,1|2,0,0]=4 7187 B13R2.155 O=C1CNc2ccc(Br)cc2N1 Amb6277350 [0,1,0,0,0,1|2,0,0]=4 7188 B13R2.155 O=C1CNc2ccc(Cl)cc2N1 Amb2685871 [0,1,0,0,0,1|2,0,0]=4 7189 B13R2.155 O=C1CNc2ccc(Cl)cc2O1 Amb2234255 [0,1,0,0,0,1|2,0,0]=4 7190 B13R2.155 O=C1CNc2ccc(F)cc2N1 Amb18827930 [0,1,0,0,0,1|2,0,0]=4 7191 B13R2.155 O=C1CNc2ccc(O)cc2O1 Amb28060911 [0,1,0,0,0,1|2,0,0]=4 7192 B13R2.155 O=C1COc2ccc(Br)cc2C1 Amb22001903 [0,1,0,0,0,1|2,0,0]=4 7193 B13R2.155 O=C1COc2ccc(Br)cc2N1 Amb185669 [0,1,0,0,0,1|2,0,0]=4 7194 B13R2.155 O=C1COc2ccc(Cl)cc2N1 Amb1156028 [0,1,0,0,0,1|2,0,0]=4 7195 B13R2.155 O=C1COc2ccc(F)cc2N1 Amb6316179 [0,1,0,0,0,1|2,0,0]=4 7196 B13R2.155 O=C1COc2ccc(I)cc2C1 Amb22498280 [0,1,0,0,0,1|2,0,0]=4 7197 B13R2.155 O=C1COc2ccc(O)cc2N1 Amb17217469 [0,1,0,0,0,1|2,0,0]=4 7198 B13R2.155 O=C1COc2ccc(O)cc2O1 Amb27229107 [0,1,0,0,0,1|2,0,0]=4 7199 B13R2.155 O=C1COc2ccc(S)cc2N1 Amb518685 [0,1,0,0,0,1|2,0,0]=4 7200 B13R2.155 O=C1CSc2ccc(Br)cc2N1 Amb18246599 [0,1,0,0,0,1|2,0,0]=4 7201 B13R2.155 O=C1CSc2ccc(Cl)cc2N1 Amb21984834 [0,1,0,0,0,1|2,0,0]=4 7202 B13R2.155 O=C1CSc2ccc(F)cc2N1 Amb24097301 [0,1,0,0,0,1|2,0,0]=4 7203 B13R2.155 O=C1CSc2ccc(O)cc2N1 Amb18243807 [0,1,0,0,0,1|2,0,0]=4 7204 B13R2.155 O=C1CSc2ccc(S)cc2N1 Amb27851469 [0,1,0,0,0,1|2,0,0]=4 7205 B13R2.155 O=C1Cc2cc(Br)ccc2CN1 Amb25799361 [0,1,0,0,0,1|1,0,0]=3 7206 B13R2.155 O=C1Cc2cc(O)ccc2CN1 Amb2697278 [0,1,0,0,0,1|1,0,0]=3 7207 B13R2.155 O=C1N=Cc2ccc(Br)cc2N1 Amb21963258 [0,1,0,0,0,1|1,0,1]=4 7208 B13R2.155 O=C1NCc2ccc(Br)cc2N1 Amb15693525 [0,1,0,0,0,1|1,0,0]=3 7209 B13R2.155 O=C1NCc2ccc(Br)cc2O1 Amb33741881 [0,1,0,0,0,1|1,0,0]=3 7210 B13R2.155 O=C1NCc2ccc(O)cc2O1 Amb26575833 [0,1,0,0,0,1|1,0,0]=3 7211 B13R2.155 O=C1Nc2cc(Br)ccc2CO1 Amb16233697 [0,1,0,0,0,1|0,0,0]=2 7212 B13R2.155 O=C1Nc2cc(Cl)ccc2CO1 Amb28384815 [0,1,0,0,0,1|0,0,0]=2 7213 B13R2.155 O=C1Nc2cc(Cl)ncc2CO1 Amb33620596 [0,1,0,0,0,1|1,0,0]=3 7214 B13R2.155 O=C1Nc2cc(F)ccc2CO1 Amb27796197 [0,1,0,0,0,1|0,0,0]=2 7215 B13R2.155 O=C1OCc2ccc(Br)cc2O1 Amb32698541 [0,1,0,0,0,1|0,0,0]=2 7216 B13R2.155 O=C1OCc2ccc(Cl)cc2O1 Amb32698539 [0,1,0,0,0,1|0,0,0]=2 7217 B13R2.155 O=C1OCc2ccc(F)cc2O1 Amb25350783 [0,1,0,0,0,1|0,0,0]=2 7218 B13R2.155 O=c1ccc2ccc(Cl)cc2o1 Amb5717858 [0,1,0,0,0,1|1,0,1]=4 7219 B13R2.155 OC1=Nc2cc(F)ccc2CC1 Amb22731752 [0,1,0,0,0,1|1,0,1]=4 7220 B13R2.155 OC1=Nc2cc(O)ccc2CC1 Amb2453777 [0,1,0,0,0,1|1,0,1]=4 7221 B13R2.162 CC1=CC=CC2=CNC(=O)C=C12 Amb23401154 [0,1,0,0,0,1|1,0,1]=4 7222 B13R2.162 CC1=CC=CN2CCC(=O)N=C12 Amb22411656 [0,1,0,0,0,1|2,0,0]=4 7223 B13R2.162 Cc1cccc2c1CC(=O)CC2 Amb4296974 [0,1,0,0,0,1|1,0,0]=3 7224 B13R2.162 Cc1cccc2c1NC(=O)C=C2 Amb18546019 [0,1,0,0,0,1|1,0,1]=4 7225 B13R2.162 Cc1cccc2c1NC(=O)CC2 Amb17545221 [0,1,0,0,0,1|1,0,0]=3 7226 B13R2.162 Cc1cccc2c1NC(=O)CN2 Amb27948420 [0,1,0,0,0,1|2,0,0]=4 7227 B13R2.162 Cc1cccc2c1NC(=O)CO2 Amb21961863 [0,1,0,0,0,1|2,0,0]=4 7228 B13R2.162 Cc1cccc2c1NC(=O)CS2 Amb21979905 [0,1,0,0,0,1|2,0,0]=4 7229 B13R2.162 Cc1cccc2c1NC(=O)OC2 Amb28325965 [0,1,0,0,0,1|0,0,0]=2 7230 B13R2.162 Cc1cccc2c1NC(=S)SC2 Amb28363853 [0,1,0,0,0,1|0,2,0]=4 7231 B13R2.162 Cc1cccc2c1OC(=O)C=C2 Amb28429789 [0,1,0,0,0,1|1,0,1]=4 7232 B13R2.162 Cc1cccc2c1OC(=O)CN2 Amb27199429 [0,1,0,0,0,1|2,0,0]=4 7233 B13R2.162 Cc1cccc2c1OC(=O)NC2 Amb28317854 [0,1,0,0,0,1|1,0,0]=3 7234 B13R2.162 Cc1cccc2c1OC(=O)OC2 Amb28077328 [0,1,0,0,0,1|0,0,0]=2 7235 B13R2.162 Cc1ccnc2c1NC(=O)OC2 Amb32692995 [0,1,0,0,0,1|1,0,0]=3 7236 B13R2.162 Fc1cccc2c1NC(=S)NC2 Amb27842327 [0,1,0,0,0,1|1,1,0]=4 7237 B13R2.162 Nc1cccc2c1CC(=O)CC2 Amb10603934 [0,1,0,0,0,1|1,0,0]=3 7238 B13R2.162 Nc1cccc2c1CC(=O)NC2 Amb25253813 [0,1,0,0,0,1|1,0,0]=3 7239 B13R2.162 Nc1cccc2c1NC(=O)C=C2 Amb18645297 [0,1,0,0,0,1|1,0,1]=4 7240 B13R2.162 Nc1cccc2c1NC(=O)C=C2 Amb22548256 [0,1,0,0,0,1|1,0,1]=4 7241 B13R2.162 Nc1cccc2c1NC(=O)CC2 Amb18061623 [0,1,0,0,0,1|1,0,0]=3 7242 B13R2.162 Nc1cccc2c1NC(=O)CO2 Amb10842123 [0,1,0,0,0,1|2,0,0]=4 7243 B13R2.162 Nc1cccc2c1NC(=O)NC2 Amb26558526 [0,1,0,0,0,1|1,0,0]=3 7244 B13R2.162 Nc1cccc2c1NC(=O)OC2 Amb25068928 [0,1,0,0,0,1|0,0,0]=2 7245 B13R2.162 Nc1cccc2c1OC(=O)C=C2 Amb18547323 [0,1,0,0,0,1|1,0,1]=4 7246 B13R2.162 Nc1cccc2c1OC(=O)NC2 Amb27237730 [0,1,0,0,0,1|1,0,0]=3 7247 B13R2.162 Nc1ccnc2c1CC(=O)CC2 Amb28368246 [0,1,0,0,0,1|2,0,0]=4 7248 B13R2.162 O=C1C=CC2=CC=CC(=O)C2=C1 Amb27256369 [0,1,0,0,0,1|1,0,1]=4 7249 B13R2.162 O=C1C=Cc2cccc(Br)c2N1 Amb17933211 [0,1,0,0,0,1|1,0,1]=4 7250 B13R2.162 O=C1C=Cc2cccc(Br)c2O1 Amb19957580 [0,1,0,0,0,1|1,0,1]=4 7251 B13R2.162 O=C1C=Cc2cccc(Cl)c2O1 Amb28073885 [0,1,0,0,0,1|1,0,1]=4 7252 B13R2.162 O=C1C=Cc2cccc(F)c2N1 Amb18546026 [0,1,0,0,0,1|1,0,1]=4 7253 B13R2.162 O=C1C=Cc2cccc(F)c2O1 Amb27272596 [0,1,0,0,0,1|1,0,1]=4 7254 B13R2.162 O=C1C=Cc2cccc(I)c2N1 Amb24579898 [0,1,0,0,0,1|1,0,1]=4 7255 B13R2.162 O=C1C=Cc2cccc(I)c2O1 Amb25206611 [0,1,0,0,0,1|1,0,1]=4 7256 B13R2.162 O=C1C=Cc2cccc(O)c2N1 Amb18038432 [0,1,0,0,0,1|1,0,1]=4 7257 B13R2.162 O=C1C=Cc2cccc(O)c2O1 Amb18645571 [0,1,0,0,0,1|1,0,1]=4 7258 B13R2.162 O=C1C=Nc2cccc(Br)c2N1 Amb21963796 [0,1,0,0,0,1|2,0,0]=4 7259 B13R2.162 O=C1CCc2cccc(Br)c2C1 Amb2695315 [0,1,0,0,0,1|1,0,0]=3 7260 B13R2.162 O=C1CCc2cccc(Br)c2N1 Amb17545216 [0,1,0,0,0,1|1,0,0]=3 7261 B13R2.162 O=C1CCc2cccc(Cl)c2C1 Amb4296973 [0,1,0,0,0,1|1,0,0]=3 7262 B13R2.162 O=C1CCc2cccc(Cl)c2N1 Amb17545212 [0,1,0,0,0,1|1,0,0]=3 7263 B13R2.162 O=C1CCc2cccc(F)c2C1 Amb4296954 [0,1,0,0,0,1|1,0,0]=3 7264 B13R2.162 O=C1CCc2cccc(F)c2N1 Amb8393601 [0,1,0,0,0,1|1,0,0]=3 7265 B13R2.162 O=C1CCc2cccc(F)c2O1 Amb27751736 [0,1,0,0,0,1|1,0,0]=3 7266 B13R2.162 O=C1CCc2cccc(O)c2C1 Amb2725292 [0,1,0,0,0,1|1,0,0]=3 7267 B13R2.162 O=C1CCc2cccc(O)c2N1 Amb15690696 [0,1,0,0,0,1|1,0,0]=3 7268 B13R2.162 O=C1CCc2ccnc(Cl)c2N1 Amb27219092 [0,1,0,0,0,1|2,0,0]=4 7269 B13R2.162 O=C1CNc2cccc(Cl)c2N1 Amb26959247 [0,1,0,0,0,1|2,0,0]=4 7270 B13R2.162 O=C1CNc2cccc(F)c2N1 Amb33548031 [0,1,0,0,0,1|2,0,0]=4 7271 B13R2.162 O=C1COc2cccc(Br)c2N1 Amb26352590 [0,1,0,0,0,1|2,0,0]=4 7272 B13R2.162 O=C1COc2cccc(Cl)c2N1 Amb26548332 [0,1,0,0,0,1|2,0,0]=4 7273 B13R2.162 O=C1COc2cccc(F)c2N1 Amb20075679 [0,1,0,0,0,1|2,0,0]=4 7274 B13R2.162 O=C1COc2cccc(O)c2N1 Amb33543974 [0,1,0,0,0,1|2,0,0]=4 7275 B13R2.162 O=C1CSc2cccc(Cl)c2N1 Amb21968526 [0,1,0,0,0,1|2,0,0]=4 7276 B13R2.162 O=C1Cc2c(F)cccc2CN1 Amb28138543 [0,1,0,0,0,1|1,0,0]=3 7277 B13R2.162 O=C1N=Cc2cccc(Cl)c2N1 Amb27153655 [0,1,0,0,0,1|1,0,1]=4 7278 B13R2.162 O=C1NCc2cccc(Br)c2N1 Amb27778685 [0,1,0,0,0,1|1,0,0]=3 7279 B13R2.162 O=C1NCc2cccc(Br)c2O1 Amb33620613 [0,1,0,0,0,1|1,0,0]=3 7280 B13R2.162 O=C1NCc2cccc(Cl)c2O1 Amb33229149 [0,1,0,0,0,1|1,0,0]=3 7281 B13R2.162 O=C1NCc2cccc(O)c2O1 Amb25287566 [0,1,0,0,0,1|1,0,0]=3 7282 B13R2.162 O=C1Nc2c(Br)cccc2CO1 Amb33624019 [0,1,0,0,0,1|0,0,0]=2 7283 B13R2.162 O=C1Nc2c(Cl)cccc2CO1 Amb26423588 [0,1,0,0,0,1|0,0,0]=2 7284 B13R2.162 O=C1Nc2c(F)cccc2CO1 Amb26536007 [0,1,0,0,0,1|0,0,0]=2 7285 B13R2.162 O=C1Nc2c(I)cccc2CO1 Amb25969335 [0,1,0,0,0,1|0,0,0]=2 7286 B13R2.162 O=C1OCc2cccc(O)c2O1 Amb27964323 [0,1,0,0,0,1|0,0,0]=2 7287 B13R2.162 O=c1ccc2cccc(Br)c2o1 Amb22230172 [0,1,0,0,0,1|1,0,1]=4 7288 B13R2.222 CC1(C)Nc2ccccc2CO1 Amb10603494 [0,1,0,0,0,1|1,0,1]=4 7289 B13R2.222 CC1(C)OCc2ccccc2O1 Amb27968638 [0,1,0,0,0,1|1,0,1]=4 7290 B13R2.222 O=S1(=O)CCc2ccccc2N1 Amb25974856 [0,1,0,0,0,1|2,0,0]=4 7291 B13R2.222 O=S1(=O)Cc2ccccc2CN1 Amb27474865 [0,1,0,0,0,1|2,0,0]=4 7292 B13R2.328 C=C1NC(=O)Nc2ccccc21 Amb25150937 [0,1,0,0,0,1|1,0,1]=4 7293 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [0,1,0,0,0,1|0,0,1]=3 7294 B13R2.328 CC1=C2C=CC=CC2=CC(=O)N1 Amb22371049 [0,1,0,0,0,1|1,0,1]=4 7295 B13R2.328 CC1=C2C=CC=CC2=NC(=O)N1 Amb22493795 [0,1,0,0,0,1|1,0,1]=4 7296 B13R2.328 CC1=CC(=O)Cc2ccccc21 Amb28287006 [0,1,0,0,0,1|1,0,1]=4 7297 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [0,1,0,0,0,1|1,0,1]=4 7298 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [0,1,0,0,0,1|1,0,1]=4 7299 B13R2.328 CC1=Cc2ccccc2C(=O)O1 Amb20247502 [0,1,0,0,0,1|1,0,1]=4 7300 B13R2.328 CC1=Nc2ccccc2C(=O)O1 Amb18800494 [0,1,0,0,0,1|1,0,1]=4 7301 B13R2.328 CC1CC(=O)Cc2ccccc21 Amb17594002 [0,1,0,0,0,1|1,0,0]=3 7302 B13R2.328 CC1CC(=O)Nc2ccccc21 Amb17836212 [0,1,0,0,0,1|1,0,0]=3 7303 B13R2.328 CC1CC(Br)=Cc2ccccc21 Amb27770920 [0,1,0,0,0,1|2,0,0]=4 7304 B13R2.328 CC1NC(=O)Cc2ccccc21 Amb23454628 [0,1,0,0,0,1|1,0,0]=3 7305 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [0,1,0,0,0,1|1,0,0]=3 7306 B13R2.328 CC1OC(=O)Nc2nnccc21 Amb27752087 [0,1,0,0,0,1|2,0,0]=4 7307 B13R2.328 CC1SC(N)=Nc2ccccc21 Amb27668842 [0,1,0,0,0,1|1,1,0]=4 7308 B13R2.328 CN1CC(=O)Nc2ccccc21 Amb21864918 [0,1,0,0,0,1|2,0,0]=4 7309 B13R2.328 C[C@H]1Cc2ccccc2C(O)O1 Amb28127151 [0,1,0,0,0,1|1,0,1]=4 7310 B13R2.328 Cc1nc2ccccc2c(=O)o1 Amb1216866 [0,1,0,0,0,1|1,0,1]=4 7311 B13R2.328 NC1=C2C=CC=CC2=CC(=O)N1 Amb24511574 [0,1,0,0,0,1|1,0,1]=4 7312 B13R2.328 NC1=C2C=CC=CC2=NC(=O)N1 Amb22015224 [0,1,0,0,0,1|1,0,1]=4 7313 B13R2.328 NC1=CC(=O)Nc2ccccc21 Amb18645325 [0,1,0,0,0,1|1,0,1]=4 7314 B13R2.328 NC1=CC(=O)Oc2ccccc21 Amb18645456 [0,1,0,0,0,1|1,0,1]=4 7315 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb10607650 [0,1,0,0,0,1|1,0,0]=3 7316 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [0,1,0,0,0,1|1,0,0]=3 7317 B13R2.328 Nc1nc2ccccc2c(=O)o1 Amb24081051 [0,1,0,0,0,1|1,0,1]=4 7318 B13R2.328 O=C1C=C(Br)c2ccccc2N1 Amb21520307 [0,1,0,0,0,1|1,0,1]=4 7319 B13R2.328 O=C1C=C(Br)c2ccccc2O1 Amb20248285 [0,1,0,0,0,1|1,0,1]=4 7320 B13R2.328 O=C1C=C(Cl)c2ccccc2N1 Amb19516664 [0,1,0,0,0,1|1,0,1]=4 7321 B13R2.328 O=C1C=C(Cl)c2ccccc2O1 Amb20414537 [0,1,0,0,0,1|1,0,1]=4 7322 B13R2.328 O=C1C=C(F)c2ccccc2N1 Amb26375660 [0,1,0,0,0,1|1,0,1]=4 7323 B13R2.328 O=C1C=C(I)c2ccccc2O1 Amb27442019 [0,1,0,0,0,1|1,0,1]=4 7324 B13R2.328 O=C1C=C(O)c2ccccc2N1 Amb18002636 [0,1,0,0,0,1|1,0,1]=4 7325 B13R2.328 O=C1C=C(O)c2ccccc2O1 Amb18372000 [0,1,0,0,0,1|1,0,1]=4 7326 B13R2.328 O=C1C=C(O)c2ccccc2S1 Amb19517275 [0,1,0,0,0,1|1,0,1]=4 7327 B13R2.328 O=C1C=C(S)c2ccccc2O1 Amb24446596 [0,1,0,0,0,1|1,0,1]=4 7328 B13R2.328 O=C1C=C([O-])c2ccccc2N1 Amb22731733 [0,1,0,0,0,1|1,0,1]=4 7329 B13R2.328 O=C1C=C2C=CC=CC2=C(Br)N1 Amb26067798 [0,1,0,0,0,1|1,0,1]=4 7330 B13R2.328 O=C1C=C2C=CC=CC2=C(I)N1 Amb27624963 [0,1,0,0,0,1|1,0,1]=4 7331 B13R2.328 O=C1CC(=O)c2ccccc2N1 Amb22263121 [0,1,0,0,0,1|1,0,1]=4 7332 B13R2.328 O=C1CC(=O)c2ccccc2O1 Amb19748567 [0,1,0,0,0,1|1,0,1]=4 7333 B13R2.328 O=C1CC(O)c2ccccc2N1 Amb27592921 [0,1,0,0,0,1|1,0,0]=3 7334 B13R2.328 O=C1CC(O)c2ccccc2O1 Amb8385084 [0,1,0,0,0,1|1,0,0]=3 7335 B13R2.328 O=C1Cc2ccccc2C(=O)N1 Amb1221580 [0,1,0,0,0,1|1,0,1]=4 7336 B13R2.328 O=C1Cc2ccccc2C(=O)O1 Amb1157145 [0,1,0,0,0,1|0,0,1]=3 7337 B13R2.328 O=C1Cc2ccccc2C(=S)N1 Amb17843901 [0,1,0,0,0,1|1,0,1]=4 7338 B13R2.328 O=C1Cc2cccnc2C(=O)O1 Amb33309586 [0,1,0,0,0,1|1,0,1]=4 7339 B13R2.328 O=C1Cc2cccnc2C(=O)O1 Amb33329093 [0,1,0,0,0,1|1,0,1]=4 7340 B13R2.328 O=C1N=C(Cl)c2ccccc2N1 Amb22371858 [0,1,0,0,0,1|1,0,1]=4 7341 B13R2.328 O=C1N=[N+]([O-])c2ccccc2N1 Amb20527610 [0,1,0,0,0,1|2,0,0]=4 7342 B13R2.328 O=C1NB(O)c2ccccc2N1 Amb25315057 [0,1,0,0,0,1|2,0,0]=4 7343 B13R2.328 O=C1NC(=O)c2ccccc2N1 Amb18005794 [0,1,0,0,0,1|1,0,1]=4 7344 B13R2.328 O=C1NC(=O)c2ccccc2O1 Amb20243206 [0,1,0,0,0,1|1,0,1]=4 7345 B13R2.328 O=C1NC(=O)c2ccccc2S1 Amb22036855 [0,1,0,0,0,1|1,0,1]=4 7346 B13R2.328 O=C1NC(=S)c2ccccc2O1 Amb27870853 [0,1,0,0,0,1|1,0,1]=4 7347 B13R2.328 O=C1Nc2ccccc2C(=O)O1 Amb18183505 [0,1,0,0,0,1|0,0,1]=3 7348 B13R2.328 O=C1Nc2ncccc2C(=O)O1 Amb19325140 [0,1,0,0,0,1|1,0,1]=4 7349 B13R2.328 O=C1Nc2ncccc2C(O)N1 Amb27622157 [0,1,0,0,0,1|2,0,0]=4 7350 B13R2.328 O=C1OC(Cl)=Cc2ccccc21 Amb27786314 [0,1,0,0,0,1|1,0,1]=4 7351 B13R2.328 O=C1OC(O)=Nc2ccccc21 Amb22569820 [0,1,0,0,0,1|0,0,2]=4 7352 B13R2.328 OC1Cc2ccccc2C(O)O1 Amb27477468 [0,1,0,0,0,1|0,0,2]=4 7353 B13R2.369 C=C1C=C2C=CC=CC2=CC1=O Amb27175861 [0,1,0,0,0,1|1,0,1]=4 7354 B13R2.369 C=C1Nc2ccccc2OC1=O Amb25996357 [0,1,0,0,0,1|2,0,0]=4 7355 B13R2.369 CC1=Cc2ccccc2NC1=O Amb19115338 [0,1,0,0,0,1|1,0,1]=4 7356 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,1,0,0,0,1|1,0,1]=4 7357 B13R2.369 CC1=Nc2ccccc2NC1=O Amb18368610 [0,1,0,0,0,1|2,0,0]=4 7358 B13R2.369 CC1=Nc2ccccc2OC1=O Amb27482974 [0,1,0,0,0,1|2,0,0]=4 7359 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,1,0,0,0,1|1,0,1]=4 7360 B13R2.369 CC1Cc2ccccc2CC1=O Amb28321881 [0,1,0,0,0,1|1,0,0]=3 7361 B13R2.369 CC1Cc2ccccc2NC1=O Amb10604462 [0,1,0,0,0,1|1,0,0]=3 7362 B13R2.369 CC1Cc2ccncc2NC1=O Amb27227915 [0,1,0,0,0,1|2,0,0]=4 7363 B13R2.369 CC1Cc2ncccc2NC1=O Amb28122873 [0,1,0,0,0,1|2,0,0]=4 7364 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,1,0,0,0,1|2,0,0]=4 7365 B13R2.369 CC1Nc2ccccc2OC1=O Amb17217247 [0,1,0,0,0,1|2,0,0]=4 7366 B13R2.369 CC1Oc2ccccc2NC1=O Amb2568450 [0,1,0,0,0,1|2,0,0]=4 7367 B13R2.369 CC1Sc2ccccc2CC1=O Amb27836849 [0,1,0,0,0,1|2,0,0]=4 7368 B13R2.369 CC1Sc2ccccc2NC1=O Amb2714505 [0,1,0,0,0,1|2,0,0]=4 7369 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,1,0,0,0,1|1,0,0]=3 7370 B13R2.369 CN1Cc2ccccc2NC1=O Amb6198737 [0,1,0,0,0,1|1,0,0]=3 7371 B13R2.369 CN1Cc2ccccc2OC1=O Amb28244326 [0,1,0,0,0,1|1,0,0]=3 7372 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,1,0,0,0,1|2,0,0]=4 7373 B13R2.369 N=C1Nc2ccccc2NC1=O Amb19804517 [0,1,0,0,0,1|2,0,0]=4 7374 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,1,0,0,0,1|2,0,0]=4 7375 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,1,0,0,0,1|1,0,1]=4 7376 B13R2.369 NC1Cc2ccccc2NC1=O Amb10975380 [0,1,0,0,0,1|1,0,0]=3 7377 B13R2.369 NC1Cc2ccccc2NC1=O Amb2196732 [0,1,0,0,0,1|1,0,0]=3 7378 B13R2.369 NC1Cc2ccccc2NC1=O Amb6353803 [0,1,0,0,0,1|1,0,0]=3 7379 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,1,0,0,0,1|1,0,0]=3 7380 B13R2.369 NC1Cc2cccnc2NC1=O Amb23571829 [0,1,0,0,0,1|2,0,0]=4 7381 B13R2.369 NC1Cc2cccnc2NC1=O Amb30291382 [0,1,0,0,0,1|2,0,0]=4 7382 B13R2.369 NC1Cc2cnccc2NC1=O Amb20241350 [0,1,0,0,0,1|2,0,0]=4 7383 B13R2.369 NC1Cc2cnccc2NC1=O Amb30046355 [0,1,0,0,0,1|2,0,0]=4 7384 B13R2.369 NC1Cc2ncccc2NC1=O Amb20241349 [0,1,0,0,0,1|2,0,0]=4 7385 B13R2.369 NN1Cc2ccccc2NC1=O Amb28076843 [0,1,0,0,0,1|1,0,0]=3 7386 B13R2.369 O=C1Cc2ccccc2CC1Cl Amb28458358 [0,1,0,0,0,1|1,0,0]=3 7387 B13R2.369 O=C1Cc2ccccc2CN1O Amb27607094 [0,1,0,0,0,1|1,0,0]=3 7388 B13R2.369 O=C1Cc2ccccc2OC1=O Amb22755081 [0,1,0,0,0,1|1,0,0]=3 7389 B13R2.369 O=C1N=C2C=CC=CC2=CC1Cl Amb22015161 [0,1,0,0,0,1|1,0,1]=4 7390 B13R2.369 O=C1Nc2ccccc2C=C1Br Amb20247010 [0,1,0,0,0,1|1,0,1]=4 7391 B13R2.369 O=C1Nc2ccccc2C=C1Cl Amb21857147 [0,1,0,0,0,1|1,0,1]=4 7392 B13R2.369 O=C1Nc2ccccc2C=C1F Amb22547229 [0,1,0,0,0,1|1,0,1]=4 7393 B13R2.369 O=C1Nc2ccccc2C=C1O Amb20619410 [0,1,0,0,0,1|1,0,1]=4 7394 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,1,0,0,0,1|1,0,0]=3 7395 B13R2.369 O=C1Nc2ccccc2CC1O Amb22899290 [0,1,0,0,0,1|1,0,0]=3 7396 B13R2.369 O=C1Nc2ccccc2NC1=O Amb18545062 [0,1,0,0,0,1|2,0,0]=4 7397 B13R2.369 O=C1Nc2ccccc2NC1=S Amb19654259 [0,1,0,0,0,1|2,0,0]=4 7398 B13R2.369 O=C1Nc2ccccc2OC1=O Amb19650977 [0,1,0,0,0,1|2,0,0]=4 7399 B13R2.369 O=C1Nc2ccccc2OC1Br Amb33328763 [0,1,0,0,0,1|2,0,0]=4 7400 B13R2.369 O=C1Nc2ccccc2OC1O Amb9824611 [0,1,0,0,0,1|2,0,0]=4 7401 B13R2.369 O=C1Nc2ccccc2SC1=O Amb27949655 [0,1,0,0,0,1|2,0,0]=4 7402 B13R2.369 O=C1Nc2ccccc2SC1O Amb28243913 [0,1,0,0,0,1|2,0,0]=4 7403 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,1,0,0,0,1|1,0,1]=4 7404 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,1,0,0,0,1|1,0,1]=4 7405 B13R2.369 O=C1Oc2ccccc2C=C1O Amb18511465 [0,1,0,0,0,1|1,0,1]=4 7406 B13R2.369 O=C1Oc2ccccc2C=C1S Amb27173626 [0,1,0,0,0,1|1,0,1]=4 7407 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,1,0,0,0,1|2,0,0]=4 7408 B13R2.369 O=C1Oc2ccccc2N=C1O Amb22494623 [0,1,0,0,0,1|2,0,0]=4 7409 B13R2.369 O=C1Oc2ccccc2NC1=S Amb27947432 [0,1,0,0,0,1|2,0,0]=4 7410 B13R2.369 O=C1Oc2ccccc2NC1Cl Amb27444661 [0,1,0,0,0,1|2,0,0]=4 7411 B13R2.369 O=C1Oc2ccccc2NC1O Amb27767886 [0,1,0,0,0,1|2,0,0]=4 7412 B13R2.369 O=C1Sc2ccccc2C=C1Br Amb19886583 [0,1,0,0,0,1|1,0,1]=4 7413 B13R2.369 O=C1Sc2ccccc2C=C1Cl Amb22347336 [0,1,0,0,0,1|1,0,1]=4 7414 B13R2.369 O=C1Sc2ccccc2C=C1F Amb22641706 [0,1,0,0,0,1|1,0,1]=4 7415 B13R2.369 O=C1Sc2ccccc2NC1Cl Amb27984888 [0,1,0,0,0,1|2,0,0]=4 7416 B13R2.3683 CC1=CC2=CNC(=O)C=C2C=C1 Amb26015179 [0,1,0,0,0,1|1,0,1]=4 7417 B13R2.3683 CC1OCc2cc(O)ccc2O1 Amb27849941 [0,1,0,0,0,1|1,0,1]=4 7418 B13R2.3683 Cc1cc2c(cn1)CC(=O)NC2 Amb28187368 [0,1,0,0,0,1|2,0,0]=4 7419 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)N2 Amb18546035 [0,1,0,0,0,1|1,0,1]=4 7420 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)O2 Amb18511482 [0,1,0,0,0,1|1,0,1]=4 7421 B13R2.3683 Cc1ccc2c(c1)C=NC(=O)N2 Amb24741810 [0,1,0,0,0,1|1,0,1]=4 7422 B13R2.3683 Cc1ccc2c(c1)CCC(=O)C2 Amb2695341 [0,1,0,0,0,1|1,0,0]=3 7423 B13R2.3683 Cc1ccc2c(c1)CCC(=O)N2 Amb17545227 [0,1,0,0,0,1|1,0,0]=3 7424 B13R2.3683 Cc1ccc2c(c1)CCC(=O)O2 Amb21928518 [0,1,0,0,0,1|1,0,0]=3 7425 B13R2.3683 Cc1ccc2c(c1)CNC(=O)C2 Amb22499417 [0,1,0,0,0,1|1,0,0]=3 7426 B13R2.3683 Cc1ccc2c(c1)CNC(=O)N2 Amb27481990 [0,1,0,0,0,1|1,0,0]=3 7427 B13R2.3683 Cc1ccc2c(c1)COC(=O)N2 Amb24375241 [0,1,0,0,0,1|0,0,0]=2 7428 B13R2.3683 Cc1ccc2c(c1)COC(=O)O2 Amb28208598 [0,1,0,0,0,1|0,0,0]=2 7429 B13R2.3683 Cc1ccc2c(c1)NCC(=O)C2 Amb25159769 [0,1,0,0,0,1|2,0,0]=4 7430 B13R2.3683 Cc1ccc2c(c1)OCC(=O)N2 Amb6331646 [0,1,0,0,0,1|2,0,0]=4 7431 B13R2.3683 Cc1ccc2c(c1)SCC(=O)N2 Amb2666629 [0,1,0,0,0,1|2,0,0]=4 7432 B13R2.3683 Cc1ccc2c(n1)CCC(=O)C2 Amb26859407 [0,1,0,0,0,1|2,0,0]=4 7433 B13R2.3683 Cc1cnc2c(c1)CCC(=O)N2 Amb13890063 [0,1,0,0,0,1|2,0,0]=4 7434 B13R2.3683 NC1=Nc2ccc(Cl)cc2CN1 Amb27658863 [0,1,0,0,0,1|2,0,0]=4 7435 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)N2 Amb18545101 [0,1,0,0,0,1|1,0,1]=4 7436 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)O2 Amb18943698 [0,1,0,0,0,1|1,0,1]=4 7437 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)O2 Amb22732663 [0,1,0,0,0,1|1,0,1]=4 7438 B13R2.3683 Nc1ccc2c(c1)C=CC(=O)S2 Amb18825000 [0,1,0,0,0,1|1,0,1]=4 7439 B13R2.3683 Nc1ccc2c(c1)CCC(=O)N2 Amb1071171 [0,1,0,0,0,1|1,0,0]=3 7440 B13R2.3683 Nc1ccc2c(c1)CNC(=O)N2 Amb26480084 [0,1,0,0,0,1|1,0,0]=3 7441 B13R2.3683 Nc1ccc2c(c1)CNC(=O)O2 Amb28054876 [0,1,0,0,0,1|1,0,0]=3 7442 B13R2.3683 Nc1ccc2c(c1)COC(=O)N2 Amb27623296 [0,1,0,0,0,1|0,0,0]=2 7443 B13R2.3683 Nc1ccc2c(c1)N=CC(=O)N2 Amb22233899 [0,1,0,0,0,1|2,0,0]=4 7444 B13R2.3683 Nc1ccc2c(c1)OCC(=O)N2 Amb3428059 [0,1,0,0,0,1|2,0,0]=4 7445 B13R2.3683 Nc1ccc2c(c1)SCC(=O)N2 Amb18648376 [0,1,0,0,0,1|2,0,0]=4 7446 B13R2.3683 O=C1C=C2C=CC(Cl)=CC2=CN1 Amb22491672 [0,1,0,0,0,1|1,0,1]=4 7447 B13R2.3683 O=C1C=C2C=CC(Cl)=CC2=NN1 Amb26872706 [0,1,0,0,0,1|2,0,0]=4 7448 B13R2.3683 O=C1C=CC2=CC(=O)C=CC2=C1 Amb17778320 [0,1,0,0,0,1|1,0,1]=4 7449 B13R2.3683 O=C1C=Cc2cc(Br)ccc2N1 Amb17933294 [0,1,0,0,0,1|1,0,1]=4 7450 B13R2.3683 O=C1C=Cc2cc(Br)ccc2O1 Amb19957650 [0,1,0,0,0,1|1,0,1]=4 7451 B13R2.3683 O=C1C=Cc2cc(Cl)ccc2N1 Amb18044542 [0,1,0,0,0,1|1,0,1]=4 7452 B13R2.3683 O=C1C=Cc2cc(F)ccc2N1 Amb17933800 [0,1,0,0,0,1|1,0,1]=4 7453 B13R2.3683 O=C1C=Cc2cc(I)ccc2O1 Amb27462170 [0,1,0,0,0,1|1,0,1]=4 7454 B13R2.3683 O=C1C=Cc2cc(O)ccc2N1 Amb18645437 [0,1,0,0,0,1|1,0,1]=4 7455 B13R2.3683 O=C1C=Cc2cc(O)ccc2O1 Amb18511478 [0,1,0,0,0,1|1,0,1]=4 7456 B13R2.3683 O=C1C=Cc2cc(O)ccc2S1 Amb28253939 [0,1,0,0,0,1|1,0,1]=4 7457 B13R2.3683 O=C1C=Nc2cc(Br)ccc2N1 Amb20241318 [0,1,0,0,0,1|2,0,0]=4 7458 B13R2.3683 O=C1C=Nc2cc(Cl)ccc2N1 Amb19957505 [0,1,0,0,0,1|2,0,0]=4 7459 B13R2.3683 O=C1C=Nc2cc(F)ccc2N1 Amb19957557 [0,1,0,0,0,1|2,0,0]=4 7460 B13R2.3683 O=C1CCC2=C(C=CC(=O)N2)C1 Amb25072696 [0,1,0,0,0,1|2,0,0]=4 7461 B13R2.3683 O=C1CCc2cc(Br)ccc2C1 Amb2383560 [0,1,0,0,0,1|1,0,0]=3 7462 B13R2.3683 O=C1CCc2cc(Br)ccc2N1 Amb33532847 [0,1,0,0,0,1|1,0,0]=3 7463 B13R2.3683 O=C1CCc2cc(Br)ccc2O1 Amb10603027 [0,1,0,0,0,1|1,0,0]=3 7464 B13R2.3683 O=C1CCc2cc(Br)cnc2N1 Amb10603013 [0,1,0,0,0,1|2,0,0]=4 7465 B13R2.3683 O=C1CCc2cc(Cl)ccc2C1 Amb2383559 [0,1,0,0,0,1|1,0,0]=3 7466 B13R2.3683 O=C1CCc2cc(Cl)ccc2N1 Amb8384586 [0,1,0,0,0,1|1,0,0]=3 7467 B13R2.3683 O=C1CCc2cc(Cl)cnc2N1 Amb27616373 [0,1,0,0,0,1|2,0,0]=4 7468 B13R2.3683 O=C1CCc2cc(F)ccc2C1 Amb2383561 [0,1,0,0,0,1|1,0,0]=3 7469 B13R2.3683 O=C1CCc2cc(F)ccc2N1 Amb6892637 [0,1,0,0,0,1|1,0,0]=3 7470 B13R2.3683 O=C1CCc2cc(F)cnc2N1 Amb13890065 [0,1,0,0,0,1|2,0,0]=4 7471 B13R2.3683 O=C1CCc2cc(I)ccc2N1 Amb33549345 [0,1,0,0,0,1|1,0,0]=3 7472 B13R2.3683 O=C1CCc2cc(I)ccc2O1 Amb27616956 [0,1,0,0,0,1|1,0,0]=3 7473 B13R2.3683 O=C1CCc2cc(O)ccc2C1 Amb4297088 [0,1,0,0,0,1|1,0,0]=3 7474 B13R2.3683 O=C1CCc2cc(O)ccc2N1 Amb2371818 [0,1,0,0,0,1|1,0,0]=3 7475 B13R2.3683 O=C1CCc2cc(O)ccc2O1 Amb24097420 [0,1,0,0,0,1|1,0,0]=3 7476 B13R2.3683 O=C1CCc2cc(S)ccc2N1 Amb1111574 [0,1,0,0,0,1|1,0,0]=3 7477 B13R2.3683 O=C1CCc2nc(Br)ccc2C1 Amb27647628 [0,1,0,0,0,1|2,0,0]=4 7478 B13R2.3683 O=C1CCc2nc(Cl)ccc2N1 Amb25685202 [0,1,0,0,0,1|2,0,0]=4 7479 B13R2.3683 O=C1CNc2cc(Br)ccc2N1 Amb33549313 [0,1,0,0,0,1|2,0,0]=4 7480 B13R2.3683 O=C1CNc2cc(Cl)ccc2C1 Amb27756454 [0,1,0,0,0,1|2,0,0]=4 7481 B13R2.3683 O=C1CNc2cc(F)ccc2C1 Amb24438628 [0,1,0,0,0,1|2,0,0]=4 7482 B13R2.3683 O=C1CNc2cc(F)ccc2O1 Amb27791254 [0,1,0,0,0,1|2,0,0]=4 7483 B13R2.3683 O=C1CNc2cc(O)ccc2N1 Amb24737314 [0,1,0,0,0,1|2,0,0]=4 7484 B13R2.3683 O=C1COc2cc(Br)ccc2C1 Amb21964898 [0,1,0,0,0,1|2,0,0]=4 7485 B13R2.3683 O=C1COc2cc(Br)ccc2N1 Amb5846258 [0,1,0,0,0,1|2,0,0]=4 7486 B13R2.3683 O=C1COc2cc(Cl)ccc2N1 Amb6353686 [0,1,0,0,0,1|2,0,0]=4 7487 B13R2.3683 O=C1COc2cc(F)ccc2N1 Amb10975233 [0,1,0,0,0,1|2,0,0]=4 7488 B13R2.3683 O=C1COc2cc(I)ccc2N1 Amb19958155 [0,1,0,0,0,1|2,0,0]=4 7489 B13R2.3683 O=C1COc2cc(O)ccc2C1 Amb28054310 [0,1,0,0,0,1|2,0,0]=4 7490 B13R2.3683 O=C1COc2cc(O)ccc2N1 Amb17217473 [0,1,0,0,0,1|2,0,0]=4 7491 B13R2.3683 O=C1CSc2cc(Br)ccc2N1 Amb2666630 [0,1,0,0,0,1|2,0,0]=4 7492 B13R2.3683 O=C1CSc2cc(Cl)ccc2N1 Amb1152575 [0,1,0,0,0,1|2,0,0]=4 7493 B13R2.3683 O=C1CSc2cc(F)ccc2N1 Amb21968560 [0,1,0,0,0,1|2,0,0]=4 7494 B13R2.3683 O=C1CSc2cc(O)ccc2N1 Amb2612672 [0,1,0,0,0,1|2,0,0]=4 7495 B13R2.3683 O=C1CSc2cc(O)ccc2O1 Amb2667797 [0,1,0,0,0,1|2,0,0]=4 7496 B13R2.3683 O=C1Cc2ccc(Br)cc2CN1 Amb19957763 [0,1,0,0,0,1|1,0,0]=3 7497 B13R2.3683 O=C1Cc2ccc(F)cc2CN1 Amb28281827 [0,1,0,0,0,1|1,0,0]=3 7498 B13R2.3683 O=C1Cc2ccc(O)cc2CN1 Amb18645799 [0,1,0,0,0,1|1,0,0]=3 7499 B13R2.3683 O=C1N=Cc2cc(Br)ccc2N1 Amb21858215 [0,1,0,0,0,1|1,0,1]=4 7500 B13R2.3683 O=C1N=Nc2cc(Cl)ccc2N1 Amb27947280 [0,1,0,0,0,1|2,0,0]=4 7501 B13R2.3683 O=C1NCc2cc(Br)ccc2N1 Amb22436821 [0,1,0,0,0,1|1,0,0]=3 7502 B13R2.3683 O=C1NCc2cc(Br)ccc2O1 Amb21858217 [0,1,0,0,0,1|1,0,0]=3 7503 B13R2.3683 O=C1NCc2cc(Br)cnc2N1 Amb27638935 [0,1,0,0,0,1|2,0,0]=4 7504 B13R2.3683 O=C1NCc2cc(Cl)ccc2N1 Amb28367256 [0,1,0,0,0,1|1,0,0]=3 7505 B13R2.3683 O=C1NCc2cc(O)ccc2N1 Amb8383586 [0,1,0,0,0,1|1,0,0]=3 7506 B13R2.3683 O=C1NCc2cc(O)ccc2O1 Amb28140847 [0,1,0,0,0,1|1,0,0]=3 7507 B13R2.3683 O=C1Nc2ccc(Br)cc2CO1 Amb6752026 [0,1,0,0,0,1|0,0,0]=2 7508 B13R2.3683 O=C1Nc2ccc(Cl)cc2CO1 Amb27210820 [0,1,0,0,0,1|0,0,0]=2 7509 B13R2.3683 O=C1Nc2ccc(Cl)nc2CO1 Amb32692994 [0,1,0,0,0,1|1,0,0]=3 7510 B13R2.3683 O=C1Nc2ccc(F)cc2CO1 Amb26458035 [0,1,0,0,0,1|0,0,0]=2 7511 B13R2.3683 O=C1Nc2ccc(I)cc2CO1 Amb27150232 [0,1,0,0,0,1|0,0,0]=2 7512 B13R2.3683 O=C1Nc2ncc(Br)cc2CO1 Amb10975393 [0,1,0,0,0,1|1,0,0]=3 7513 B13R2.3683 O=C1Nc2ncc(O)cc2CO1 Amb32993872 [0,1,0,0,0,1|1,0,0]=3 7514 B13R2.3683 O=C1OCc2cc(Br)ccc2O1 Amb32698536 [0,1,0,0,0,1|0,0,0]=2 7515 B13R2.3683 O=C1OCc2cc(Cl)ccc2O1 Amb32698537 [0,1,0,0,0,1|0,0,0]=2 7516 B13R2.3683 O=C1OCc2cc(F)ccc2O1 Amb27816763 [0,1,0,0,0,1|0,0,0]=2 7517 B13R2.3683 OC1=Nc2ccc(Cl)cc2CC1 Amb22330532 [0,1,0,0,0,1|1,0,1]=4 7518 B13R2.3683 S=C1NCc2cc(Cl)ccc2O1 Amb27827391 [0,1,0,0,0,1|1,1,0]=4 7519 B13R2.3683 [NH3+]c1ccc2c(c1)C=CC(=O)O2 Amb24113859 [0,1,0,0,0,1|1,0,1]=4 7520 B13R2.5179 CC1=CC=CC2=CC(=O)NC=C12 Amb22011731 [0,1,0,0,0,1|1,0,1]=4 7521 B13R2.5179 Cc1cccc2c1C=CC(=O)O2 Amb27449737 [0,1,0,0,0,1|1,0,1]=4 7522 B13R2.5179 Cc1cccc2c1CCC(=O)C2 Amb2695354 [0,1,0,0,0,1|1,0,0]=3 7523 B13R2.5179 Cc1cccc2c1CCC(=O)N2 Amb17470424 [0,1,0,0,0,1|1,0,0]=3 7524 B13R2.5179 Cc1cccc2c1CNC(=O)N2 Amb28385127 [0,1,0,0,0,1|1,0,0]=3 7525 B13R2.5179 Cc1cccc2c1CNC(N)=N2 Amb27974101 [0,1,0,0,0,1|2,0,0]=4 7526 B13R2.5179 Cc1cccc2c1COC(=O)N2 Amb28242939 [0,1,0,0,0,1|0,0,0]=2 7527 B13R2.5179 Cc1cccc2c1NCC(=O)N2 Amb18829720 [0,1,0,0,0,1|2,0,0]=4 7528 B13R2.5179 Cc1cccc2c1OCC(=O)N2 Amb17570068 [0,1,0,0,0,1|2,0,0]=4 7529 B13R2.5179 Cc1cccc2c1SCC(=O)N2 Amb27175585 [0,1,0,0,0,1|2,0,0]=4 7530 B13R2.5179 Fc1cccc2c1CNC(S)=N2 Amb2735904 [0,1,0,0,0,1|1,1,0]=4 7531 B13R2.5179 Fc1cccc2c1COC(=S)N2 Amb27813547 [0,1,0,0,0,1|0,1,0]=3 7532 B13R2.5179 Nc1cccc2c1C=CC(=O)N2 Amb22500953 [0,1,0,0,0,1|1,0,1]=4 7533 B13R2.5179 Nc1cccc2c1CCC(=O)C2 Amb4296877 [0,1,0,0,0,1|1,0,0]=3 7534 B13R2.5179 Nc1cccc2c1CCC(=O)N2 Amb17505562 [0,1,0,0,0,1|1,0,0]=3 7535 B13R2.5179 Nc1cccc2c1CNC(=O)N2 Amb26864042 [0,1,0,0,0,1|1,0,0]=3 7536 B13R2.5179 Nc1cccc2c1COC(=O)N2 Amb33624017 [0,1,0,0,0,1|0,0,0]=2 7537 B13R2.5179 Nc1cccc2c1COC(=O)O2 Amb27864251 [0,1,0,0,0,1|0,0,0]=2 7538 B13R2.5179 Nc1cccc2c1OCC(=O)N2 Amb10068365 [0,1,0,0,0,1|2,0,0]=4 7539 B13R2.5179 Nc1cccc2c1SCC(=O)N2 Amb18648377 [0,1,0,0,0,1|2,0,0]=4 7540 B13R2.5179 O=C1C=C2C=CC=C(Br)C2=CN1 Amb22371046 [0,1,0,0,0,1|1,0,1]=4 7541 B13R2.5179 O=C1C=Cc2c(Br)cccc2N1 Amb22263039 [0,1,0,0,0,1|1,0,1]=4 7542 B13R2.5179 O=C1C=Cc2c(Br)cccc2O1 Amb24682464 [0,1,0,0,0,1|1,0,1]=4 7543 B13R2.5179 O=C1C=Cc2c(Cl)cccc2O1 Amb24368459 [0,1,0,0,0,1|1,0,1]=4 7544 B13R2.5179 O=C1C=Cc2c(F)cccc2O1 Amb24675426 [0,1,0,0,0,1|1,0,1]=4 7545 B13R2.5179 O=C1C=Cc2c(I)cccc2O1 Amb27635036 [0,1,0,0,0,1|1,0,1]=4 7546 B13R2.5179 O=C1C=Cc2c(O)cccc2N1 Amb17933814 [0,1,0,0,0,1|1,0,1]=4 7547 B13R2.5179 O=C1C=Nc2c(Br)cccc2N1 Amb26895498 [0,1,0,0,0,1|2,0,0]=4 7548 B13R2.5179 O=C1CCC2=C(F)C=CNC2=N1 Amb25680920 [0,1,0,0,0,1|2,0,0]=4 7549 B13R2.5179 O=C1CCc2c(Br)cccc2C1 Amb2695317 [0,1,0,0,0,1|1,0,0]=3 7550 B13R2.5179 O=C1CCc2c(Br)cccc2N1 Amb20075766 [0,1,0,0,0,1|1,0,0]=3 7551 B13R2.5179 O=C1CCc2c(Br)cccc2O1 Amb28246109 [0,1,0,0,0,1|1,0,0]=3 7552 B13R2.5179 O=C1CCc2c(Cl)cccc2C1 Amb4296959 [0,1,0,0,0,1|1,0,0]=3 7553 B13R2.5179 O=C1CCc2c(Cl)cccc2N1 Amb17470647 [0,1,0,0,0,1|1,0,0]=3 7554 B13R2.5179 O=C1CCc2c(F)cccc2N1 Amb17470457 [0,1,0,0,0,1|1,0,0]=3 7555 B13R2.5179 O=C1CCc2c(O)cccc2C1 Amb4296961 [0,1,0,0,0,1|1,0,0]=3 7556 B13R2.5179 O=C1CCc2c(O)cccc2N1 Amb3205445 [0,1,0,0,0,1|1,0,0]=3 7557 B13R2.5179 O=C1CCc2c(O)cccc2O1 Amb27482210 [0,1,0,0,0,1|1,0,0]=3 7558 B13R2.5179 O=C1CCc2c(O)ccnc2N1 Amb27219528 [0,1,0,0,0,1|2,0,0]=4 7559 B13R2.5179 O=C1CNc2c(Br)cccc2C1 Amb27163244 [0,1,0,0,0,1|2,0,0]=4 7560 B13R2.5179 O=C1CNc2c(Cl)cccc2N1 Amb18823461 [0,1,0,0,0,1|2,0,0]=4 7561 B13R2.5179 O=C1COc2c(Br)cccc2C1 Amb15692701 [0,1,0,0,0,1|2,0,0]=4 7562 B13R2.5179 O=C1COc2c(Br)cccc2N1 Amb17572141 [0,1,0,0,0,1|2,0,0]=4 7563 B13R2.5179 O=C1COc2c(Cl)cccc2C1 Amb22498279 [0,1,0,0,0,1|2,0,0]=4 7564 B13R2.5179 O=C1COc2c(Cl)cccc2N1 Amb1094037 [0,1,0,0,0,1|2,0,0]=4 7565 B13R2.5179 O=C1COc2c(F)cccc2C1 Amb27260708 [0,1,0,0,0,1|2,0,0]=4 7566 B13R2.5179 O=C1COc2c(F)cccc2N1 Amb17570109 [0,1,0,0,0,1|2,0,0]=4 7567 B13R2.5179 O=C1COc2c(I)cccc2N1 Amb22586344 [0,1,0,0,0,1|2,0,0]=4 7568 B13R2.5179 O=C1CSc2c(Br)cccc2N1 Amb26567855 [0,1,0,0,0,1|2,0,0]=4 7569 B13R2.5179 O=C1CSc2c(Cl)cccc2N1 Amb26455707 [0,1,0,0,0,1|2,0,0]=4 7570 B13R2.5179 O=C1CSc2c(O)cccc2N1 Amb27446622 [0,1,0,0,0,1|2,0,0]=4 7571 B13R2.5179 O=C1Cc2cccc(Br)c2CN1 Amb26375844 [0,1,0,0,0,1|1,0,0]=3 7572 B13R2.5179 O=C1Cc2cccc(O)c2CN1 Amb24417800 [0,1,0,0,0,1|1,0,0]=3 7573 B13R2.5179 O=C1Cc2cccc(O)c2CO1 Amb26031052 [0,1,0,0,0,1|0,0,0]=2 7574 B13R2.5179 O=C1N=Cc2c(Cl)cccc2N1 Amb24532716 [0,1,0,0,0,1|1,0,1]=4 7575 B13R2.5179 O=C1NCc2c(Br)cccc2N1 Amb27393557 [0,1,0,0,0,1|1,0,0]=3 7576 B13R2.5179 O=C1NCc2c(Br)cccc2O1 Amb33483912 [0,1,0,0,0,1|1,0,0]=3 7577 B13R2.5179 O=C1NCc2c(Cl)ccnc2N1 Amb25039222 [0,1,0,0,0,1|2,0,0]=4 7578 B13R2.5179 O=C1NCc2c(F)cccc2N1 Amb28435230 [0,1,0,0,0,1|1,0,0]=3 7579 B13R2.5179 O=C1NCc2c(O)cccc2N1 Amb26964696 [0,1,0,0,0,1|1,0,0]=3 7580 B13R2.5179 O=C1NCc2c(O)cccc2O1 Amb22491592 [0,1,0,0,0,1|1,0,0]=3 7581 B13R2.5179 O=C1Nc2cccc(Br)c2CO1 Amb25045511 [0,1,0,0,0,1|0,0,0]=2 7582 B13R2.5179 O=C1Nc2cccc(Cl)c2CO1 Amb28246075 [0,1,0,0,0,1|0,0,0]=2 7583 B13R2.5179 O=C1Nc2cccc(F)c2CO1 Amb26638353 [0,1,0,0,0,1|0,0,0]=2 7584 B13R2.5179 O=C1OCc2c(F)cccc2O1 Amb26617650 [0,1,0,0,0,1|0,0,0]=2 7585 B13R2.346 O=C1C=CC=C2C=CC(=O)C2=C1 Amb27814589 [0,1,0,0,0,1|1,0,1]=4 7586 B13R2.383 CC1C=CC=CC2=C1CCC2=O Amb27389477 [0,1,0,0,0,1|1,0,0]=3 7587 B13R2.383 CC1CCC=CC2=C1COC2=O Amb27390720 [0,1,0,0,0,1|0,0,2]=4 7588 B13R2.2093 O=Cc1ccc-2cccccc12 Amb18048460 [0,1,0,0,0,1|1,0,1]=4 7589 B13R2.3031 CC1=CCC2=C(C=C1)C(=O)CC2 Amb27802558 [0,1,0,0,0,1|1,0,0]=3 7590 B13R2.3757 CC12C=CC=CC=C1CCC2=O Amb27176104 [0,1,0,0,0,1|1,0,1]=4 7591 B13R2.4745 CC1CC2=C(C=CC=CC2)C1=O Amb27219313 [0,1,0,0,0,1|1,0,0]=3 7592 B13R2.4745 O=C1C=C2C=CC=CC=C2C1=O Amb27754142 [0,1,0,0,0,1|1,0,1]=4 7593 B13R2.4849 O=C1C=CC=C2C(=O)C=CC2=C1 Amb21948155 [0,1,0,0,0,1|1,0,1]=4 7594 B13R2.4849 O=C1C=CCC2=C(CCC2=O)C1 Amb27177920 [0,1,0,0,0,1|1,0,1]=4 7595 B13R2.342 C=C1CCCc2c(O)cccc21 Amb27802622 [0,1,0,0,0,1|2,0,0]=4 7596 B13R2.342 Cc1cccc2c1C=NNC2=O Amb27623526 [0,1,0,0,0,1|1,0,1]=4 7597 B13R2.342 Cc1cccc2c1CCCC2=O Amb17087874 [0,1,0,0,0,1|1,0,0]=3 7598 B13R2.342 Cc1cccc2c1CCNC2=O Amb17400086 [0,1,0,0,0,1|1,0,0]=3 7599 B13R2.342 Cc1cccc2c1COCC2N Amb27237509 [0,1,0,0,0,1|1,0,1]=4 7600 B13R2.342 Cc1cccc2c1N=CNC2=O Amb19515172 [0,1,0,0,0,1|1,0,1]=4 7601 B13R2.342 Cc1cccc2c1NC=CC2=O Amb18177632 [0,1,0,0,0,1|1,0,1]=4 7602 B13R2.342 Cc1cccc2c1NCCC2=O Amb18062582 [0,1,0,0,0,1|1,0,0]=3 7603 B13R2.342 Cc1cccc2c1NCOC2=O Amb27462047 [0,1,0,0,0,1|0,0,0]=2 7604 B13R2.342 Cc1cccc2c1OC=CC2=O Amb22901115 [0,1,0,0,0,1|1,0,1]=4 7605 B13R2.342 Cc1cccc2c1OCCC2=O Amb33552806 [0,1,0,0,0,1|1,0,0]=3 7606 B13R2.342 Cc1cccc2c1SC=CC2=O Amb18548450 [0,1,0,0,0,1|1,0,1]=4 7607 B13R2.342 Cc1cccc2c1SCCC2=O Amb18180837 [0,1,0,0,0,1|1,0,0]=3 7608 B13R2.342 N=C1CCCc2c(N)cccc21 Amb27393584 [0,1,0,0,0,1|2,0,0]=4 7609 B13R2.342 N[C@@H]1COCc2c(F)cccc21 Amb27619682 [0,1,0,0,0,1|1,0,1]=4 7610 B13R2.342 N[C@@H]1COCc2c(I)cccc21 Amb27168076 [0,1,0,0,0,1|1,0,1]=4 7611 B13R2.342 N[C@H]1COCc2c(Br)cccc21 Amb27253114 [0,1,0,0,0,1|1,0,1]=4 7612 B13R2.342 N[C@H]1COCc2c(Cl)cccc21 Amb27593891 [0,1,0,0,0,1|1,0,1]=4 7613 B13R2.342 N[C@H]1COCc2c(F)cccc21 Amb27640081 [0,1,0,0,0,1|1,0,1]=4 7614 B13R2.342 Nc1cccc2c1C=CNC2=O Amb22276994 [0,1,0,0,0,1|1,0,1]=4 7615 B13R2.342 Nc1cccc2c1C=COC2=O Amb18645434 [0,1,0,0,0,1|0,0,1]=3 7616 B13R2.342 Nc1cccc2c1C=NNC2=O Amb18645459 [0,1,0,0,0,1|1,0,1]=4 7617 B13R2.342 Nc1cccc2c1CCNC2=O Amb22496660 [0,1,0,0,0,1|1,0,0]=3 7618 B13R2.342 Nc1cccc2c1CCNC2=O Amb27597949 [0,1,0,0,0,1|1,0,0]=3 7619 B13R2.342 Nc1cccc2c1CCOC2=O Amb24089240 [0,1,0,0,0,1|0,0,0]=2 7620 B13R2.342 Nc1cccc2c1COC[C@H]2N Amb28244003 [0,1,0,0,0,1|1,0,1]=4 7621 B13R2.342 Nc1cccc2c1NC=NC2=O Amb25074510 [0,1,0,0,0,1|1,0,1]=4 7622 B13R2.342 Nc1cccc2c1OCCC2=O Amb17570075 [0,1,0,0,0,1|1,0,0]=3 7623 B13R2.342 Nc1cccc2c1SCCC2=O Amb18194418 [0,1,0,0,0,1|1,0,0]=3 7624 B13R2.342 Nc1cncc2c1CCNC2=O Amb35746342 [0,1,0,0,0,1|2,0,0]=4 7625 B13R2.342 Nc1cncc2c1CCNC2=O Amb35747091 [0,1,0,0,0,1|2,0,0]=4 7626 B13R2.342 O=C1C=CNc2c(Br)cccc21 Amb19372996 [0,1,0,0,0,1|1,0,1]=4 7627 B13R2.342 O=C1C=CNc2c(F)cccc21 Amb18798176 [0,1,0,0,0,1|1,0,1]=4 7628 B13R2.342 O=C1C=COc2c(Br)cccc21 Amb27481107 [0,1,0,0,0,1|1,0,1]=4 7629 B13R2.342 O=C1C=CSc2c(O)cccc21 Amb27175944 [0,1,0,0,0,1|1,0,1]=4 7630 B13R2.342 O=C1C=NNc2c(Br)cccc21 Amb23559900 [0,1,0,0,0,1|2,0,0]=4 7631 B13R2.342 O=C1C=NNc2c(F)cccc21 Amb23559968 [0,1,0,0,0,1|2,0,0]=4 7632 B13R2.342 O=C1C=NNc2c(I)cccc21 Amb23559972 [0,1,0,0,0,1|2,0,0]=4 7633 B13R2.342 O=C1C=NNc2c(O)cccc21 Amb27177549 [0,1,0,0,0,1|2,0,0]=4 7634 B13R2.342 O=C1CCCc2c(Br)cccc21 Amb7101506 [0,1,0,0,0,1|1,0,0]=3 7635 B13R2.342 O=C1CCCc2c(Br)cncc21 Amb27162368 [0,1,0,0,0,1|2,0,0]=4 7636 B13R2.342 O=C1CCCc2c(Cl)cccc21 Amb2383554 [0,1,0,0,0,1|1,0,0]=3 7637 B13R2.342 O=C1CCCc2c(Cl)ccnc21 Amb22754632 [0,1,0,0,0,1|2,0,0]=4 7638 B13R2.342 O=C1CCCc2c(F)cccc21 Amb2383555 [0,1,0,0,0,1|1,0,0]=3 7639 B13R2.342 O=C1CCCc2c(I)cccc21 Amb16233081 [0,1,0,0,0,1|1,0,0]=3 7640 B13R2.342 O=C1CCCc2c(O)cccc21 Amb2779886 [0,1,0,0,0,1|1,0,0]=3 7641 B13R2.342 O=C1CCCc2c(O)cncc21 Amb27977713 [0,1,0,0,0,1|2,0,0]=4 7642 B13R2.342 O=C1CCNc2c(Br)cccc21 Amb18753478 [0,1,0,0,0,1|1,0,0]=3 7643 B13R2.342 O=C1CCNc2c(Cl)cccc21 Amb1773286 [0,1,0,0,0,1|1,0,0]=3 7644 B13R2.342 O=C1CCNc2c(F)cccc21 Amb8630008 [0,1,0,0,0,1|1,0,0]=3 7645 B13R2.342 O=C1CCNc2c(I)cccc21 Amb27813318 [0,1,0,0,0,1|1,0,0]=3 7646 B13R2.342 O=C1CCOc2c(Br)cccc21 Amb8843607 [0,1,0,0,0,1|1,0,0]=3 7647 B13R2.342 O=C1CCOc2c(Cl)cccc21 Amb8843606 [0,1,0,0,0,1|1,0,0]=3 7648 B13R2.342 O=C1CCOc2c(F)cccc21 Amb33552655 [0,1,0,0,0,1|1,0,0]=3 7649 B13R2.342 O=C1CCSc2c(Br)cccc21 Amb8996650 [0,1,0,0,0,1|1,0,0]=3 7650 B13R2.342 O=C1CCSc2c(Cl)cccc21 Amb33529314 [0,1,0,0,0,1|1,0,0]=3 7651 B13R2.342 O=C1CCSc2c(F)cccc21 Amb483268 [0,1,0,0,0,1|1,0,0]=3 7652 B13R2.342 O=C1CCSc2c(I)cccc21 Amb25875081 [0,1,0,0,0,1|1,0,0]=3 7653 B13R2.342 O=C1CCSc2c(O)cccc21 Amb27982292 [0,1,0,0,0,1|1,0,0]=3 7654 B13R2.342 O=C1CSCc2c(F)cccc21 Amb22157287 [0,1,0,0,0,1|0,1,0]=3 7655 B13R2.342 O=C1N=CNc2c(Br)cccc21 Amb19957594 [0,1,0,0,0,1|1,0,1]=4 7656 B13R2.342 O=C1N=CNc2c(F)cccc21 Amb21857673 [0,1,0,0,0,1|1,0,1]=4 7657 B13R2.342 O=C1NC=Cc2c(Br)cccc21 Amb18755034 [0,1,0,0,0,1|1,0,1]=4 7658 B13R2.342 O=C1NC=Cc2c(Cl)cccc21 Amb19100716 [0,1,0,0,0,1|1,0,1]=4 7659 B13R2.342 O=C1NC=Cc2c(F)cccc21 Amb19100712 [0,1,0,0,0,1|1,0,1]=4 7660 B13R2.342 O=C1NC=Cc2c(I)cccc21 Amb23401166 [0,1,0,0,0,1|1,0,1]=4 7661 B13R2.342 O=C1NC=Cc2c(O)cccc21 Amb18645441 [0,1,0,0,0,1|1,0,1]=4 7662 B13R2.342 O=C1NC=Nc2c(Br)cccc21 Amb19514404 [0,1,0,0,0,1|1,0,1]=4 7663 B13R2.342 O=C1NC=Nc2c(F)cccc21 Amb20243323 [0,1,0,0,0,1|1,0,1]=4 7664 B13R2.342 O=C1NC=Nc2c(F)cccc21 Amb31207202 [0,1,0,0,0,1|1,0,1]=4 7665 B13R2.342 O=C1NC=Nc2c(I)cccc21 Amb20240938 [0,1,0,0,0,1|1,0,1]=4 7666 B13R2.342 O=C1NC=Nc2c(O)cccc21 Amb28069020 [0,1,0,0,0,1|1,0,1]=4 7667 B13R2.342 O=C1NC=Nc2c(S)cccc21 Amb28368717 [0,1,0,0,0,1|1,0,1]=4 7668 B13R2.342 O=C1NCCN2C(=O)C=CC=C12 Amb27446666 [0,1,0,0,0,1|2,0,0]=4 7669 B13R2.342 O=C1NCCc2c(Br)cccc21 Amb22002114 [0,1,0,0,0,1|1,0,0]=3 7670 B13R2.342 O=C1NCCc2c(Br)cncc21 Amb24058272 [0,1,0,0,0,1|2,0,0]=4 7671 B13R2.342 O=C1NCCc2c(Cl)cccc21 Amb6308386 [0,1,0,0,0,1|1,0,0]=3 7672 B13R2.342 O=C1NCCc2c(Cl)cncc21 Amb27267896 [0,1,0,0,0,1|2,0,0]=4 7673 B13R2.342 O=C1NCCc2c(F)cccc21 Amb6308385 [0,1,0,0,0,1|1,0,0]=3 7674 B13R2.342 O=C1NCCc2c(I)cccc21 Amb24330771 [0,1,0,0,0,1|1,0,0]=3 7675 B13R2.342 O=C1NCCc2c(O)cccc21 Amb6306668 [0,1,0,0,0,1|1,0,0]=3 7676 B13R2.342 O=C1NCCc2c1ccnc2Cl Amb28410167 [0,1,0,0,0,1|2,0,0]=4 7677 B13R2.342 O=C1NN=Cc2c(Cl)cccc21 Amb27966203 [0,1,0,0,0,1|1,0,1]=4 7678 B13R2.342 O=C1NN=Cc2c(F)cccc21 Amb26444875 [0,1,0,0,0,1|1,0,1]=4 7679 B13R2.342 O=C1NN=Cc2c(O)cccc21 Amb25773416 [0,1,0,0,0,1|1,0,1]=4 7680 B13R2.342 O=C1NN=Nc2c(Cl)cccc21 Amb26049916 [0,1,0,0,0,1|2,0,0]=4 7681 B13R2.342 O=C1OCCc2c(I)cccc21 Amb28243036 [0,1,0,0,0,1|0,0,0]=2 7682 B13R2.342 O=C1OCNc2c(F)cccc21 Amb27791861 [0,1,0,0,0,1|0,0,0]=2 7683 B13R2.342 O=C1OCOc2c(Br)cccc21 Amb24077635 [0,1,0,0,0,1|0,0,0]=2 7684 B13R2.342 O=C1OCOc2c(F)cccc21 Amb24077631 [0,1,0,0,0,1|0,0,0]=2 7685 B13R2.342 O=c1ccoc2c(Cl)cccc12 Amb1159444 [0,1,0,0,0,1|1,0,1]=4 7686 B13R2.342 S=C1NCCc2c(Br)cccc21 Amb27393786 [0,1,0,0,0,1|1,1,0]=4 7687 B13R2.371 C=C1CCC(C)c2ccccc21 Amb27254513 [0,1,0,0,0,1|2,0,0]=4 7688 B13R2.371 CC1=CCC(C)c2ccccc21 Amb27800693 [0,1,0,0,0,1|2,0,0]=4 7689 B13R2.371 CC1=NCC(C)c2ccccc21 Amb8384389 [0,1,0,0,0,1|2,0,0]=4 7690 B13R2.371 CC1=NNC(=O)c2ccccc21 Amb19132657 [0,1,0,0,0,1|1,0,1]=4 7691 B13R2.371 CC1=NOC(=O)c2ccccc21 Amb21927595 [0,1,0,0,0,1|0,0,1]=3 7692 B13R2.371 CC1CCC(=O)c2ccccc21 Amb2721256 [0,1,0,0,0,1|1,0,0]=3 7693 B13R2.371 CC1CCC(=O)c2ccncc21 Amb27265836 [0,1,0,0,0,1|2,0,0]=4 7694 B13R2.371 CC1CCC(=O)c2cnccc21 Amb27470815 [0,1,0,0,0,1|2,0,0]=4 7695 B13R2.371 CC1CNC(=O)c2ccccc21 Amb17400088 [0,1,0,0,0,1|1,0,0]=3 7696 B13R2.371 CC1COB(O)c2ccccc21 Amb27435966 [0,1,0,0,0,1|1,0,1]=4 7697 B13R2.371 CC1SCC(=O)c2ccccc21 Amb28285936 [0,1,0,0,0,1|0,1,0]=3 7698 B13R2.371 CN1C=CC(=O)c2ccccc21 Amb18048473 [0,1,0,0,0,1|1,0,1]=4 7699 B13R2.371 CN1C=NC(=O)c2ccccc21 Amb22752698 [0,1,0,0,0,1|1,0,1]=4 7700 B13R2.371 CN1CCC(=O)c2ccccc21 Amb18560299 [0,1,0,0,0,1|1,0,0]=3 7701 B13R2.371 CN1CNC(=O)c2ccccc21 Amb27754082 [0,1,0,0,0,1|1,0,0]=3 7702 B13R2.371 CN1N=CC(=O)c2ccccc21 Amb26626061 [0,1,0,0,0,1|2,0,0]=4 7703 B13R2.371 CN1NCC(=O)c2ccccc21 Amb27177499 [0,1,0,0,0,1|2,0,0]=4 7704 B13R2.371 C[C@@H]1CCC(=O)c2ccccc21 Amb27974633 [0,1,0,0,0,1|1,0,0]=3 7705 B13R2.371 C[C@@H]1CCC(=O)c2ncccc21 Amb27974090 [0,1,0,0,0,1|2,0,0]=4 7706 B13R2.371 C[C@@H]1SCC(=O)c2ccccc21 Amb28202184 [0,1,0,0,0,1|0,1,0]=3 7707 B13R2.371 Cn1ccc(=O)c2ccccc21 Amb4009128 [0,1,0,0,0,1|1,0,1]=4 7708 B13R2.371 N=C1C=CC(Cl)c2ccccc21 Amb28121168 [0,1,0,0,0,1|2,0,0]=4 7709 B13R2.371 NC1=CNC(=O)c2ccccc21 Amb17933163 [0,1,0,0,0,1|1,0,1]=4 7710 B13R2.371 NC1=CNC(=O)c2ccccc21 Amb22728356 [0,1,0,0,0,1|1,0,1]=4 7711 B13R2.371 NC1=NNC(=O)c2ccccc21 Amb18645470 [0,1,0,0,0,1|1,0,1]=4 7712 B13R2.371 NC1CCC(=O)c2ccccc21 Amb20624438 [0,1,0,0,0,1|1,0,0]=3 7713 B13R2.371 NC1CCC(=O)c2ccccc21 Amb9782218 [0,1,0,0,0,1|1,0,0]=3 7714 B13R2.371 NC1CNC(=O)c2ncccc21 Amb18829367 [0,1,0,0,0,1|2,0,0]=4 7715 B13R2.371 N[C@@H]1CCC(=O)c2ccccc21 Amb27634837 [0,1,0,0,0,1|1,0,0]=3 7716 B13R2.371 O=C1C=CC(=O)c2ccccc21 Amb8513654 [0,1,0,0,0,1|1,0,1]=4 7717 B13R2.371 O=C1C=CN(O)c2ccccc21 Amb27176075 [0,1,0,0,0,1|1,0,1]=4 7718 B13R2.371 O=C1CCC(=O)c2ccccc21 Amb24054332 [0,1,0,0,0,1|1,0,0]=3 7719 B13R2.371 O=C1CCC(=O)c2ncccc21 Amb25940184 [0,1,0,0,0,1|2,0,0]=4 7720 B13R2.371 O=C1CCC(O)c2ccccc21 Amb22170418 [0,1,0,0,0,1|1,0,0]=3 7721 B13R2.371 O=C1CC[C@H](O)c2ccccc21 Amb24690507 [0,1,0,0,0,1|1,0,0]=3 7722 B13R2.371 O=C1CN=C(Cl)c2ccccc21 Amb28077322 [0,1,0,0,0,1|1,0,1]=4 7723 B13R2.371 O=C1CNC(=O)c2ccccc21 Amb22372293 [0,1,0,0,0,1|1,0,0]=3 7724 B13R2.371 O=C1CNC(=O)c2ncccc21 Amb18829831 [0,1,0,0,0,1|2,0,0]=4 7725 B13R2.371 O=C1COC(=O)c2ccccc21 Amb24078409 [0,1,0,0,0,1|0,0,0]=2 7726 B13R2.371 O=C1COC(O)c2ccccc21 Amb27948576 [0,1,0,0,0,1|0,0,0]=2 7727 B13R2.371 O=C1CSC(Cl)c2ccccc21 Amb18636498 [0,1,0,0,0,1|0,1,0]=3 7728 B13R2.371 O=C1N=CN(O)c2ccccc21 Amb22752699 [0,1,0,0,0,1|1,0,1]=4 7729 B13R2.371 O=C1NC=C(Br)c2ccccc21 Amb19929872 [0,1,0,0,0,1|1,0,1]=4 7730 B13R2.371 O=C1NC=C(Cl)c2ccccc21 Amb21858248 [0,1,0,0,0,1|1,0,1]=4 7731 B13R2.371 O=C1NC=C(I)c2ccccc21 Amb22498229 [0,1,0,0,0,1|1,0,1]=4 7732 B13R2.371 O=C1NCC(Br)c2ccccc21 Amb32658887 [0,1,0,0,0,1|1,0,0]=3 7733 B13R2.371 O=C1NCC(Cl)c2ccccc21 Amb25992409 [0,1,0,0,0,1|1,0,0]=3 7734 B13R2.371 O=C1NCC(O)c2ccccc21 Amb17615447 [0,1,0,0,0,1|1,0,0]=3 7735 B13R2.371 O=C1NN=C(Br)c2ccccc21 Amb24468810 [0,1,0,0,0,1|1,0,1]=4 7736 B13R2.371 O=C1NN=C(Cl)c2ccccc21 Amb19665276 [0,1,0,0,0,1|1,0,1]=4 7737 B13R2.371 O=C1NNC(=O)c2ccccc21 Amb18800603 [0,1,0,0,0,1|1,0,1]=4 7738 B13R2.371 O=C1OCC(Cl)c2ccccc21 Amb27165775 [0,1,0,0,0,1|0,0,0]=2 7739 B13R2.371 O=C1OCC(O)c2ccccc21 Amb27978275 [0,1,0,0,0,1|0,0,0]=2 7740 B13R2.371 O=S1CC[C@H](O)c2ccccc21 Amb28292126 [0,1,0,0,0,1|2,0,0]=4 7741 B13R2.1613 BrCC1=CCCc2ccccc21 Amb27178526 [0,1,0,0,0,1|2,0,0]=4 7742 B13R2.1613 BrCC1OCCc2ccccc21 Amb19373964 [0,1,0,0,0,1|1,0,1]=4 7743 B13R2.1613 CCC1=NCCc2ccccc21 Amb25035624 [0,1,0,0,0,1|2,0,0]=4 7744 B13R2.1613 CNC1=NCCc2ccccc21 Amb28240971 [0,1,0,0,0,1|2,0,0]=4 7745 B13R2.1613 CNC1OCCc2ccccc21 Amb27462176 [0,1,0,0,0,1|1,0,1]=4 7746 B13R2.1613 COC1=CCCc2ccccc21 Amb8392114 [0,1,0,0,0,1|1,0,1]=4 7747 B13R2.1613 COC1=NCCc2ccccc21 Amb24665738 [0,1,0,0,0,1|1,0,1]=4 7748 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [0,1,0,0,0,1|0,0,2]=4 7749 B13R2.1613 ClCC1=CCCc2ccccc21 Amb28423479 [0,1,0,0,0,1|2,0,0]=4 7750 B13R2.1613 ClCC1=NCCc2ccccc21 Amb17506200 [0,1,0,0,0,1|2,0,0]=4 7751 B13R2.1613 ClCC1=NCCc2ccccc21 Amb506434 [0,1,0,0,0,1|2,0,0]=4 7752 B13R2.1613 ClCC1COCc2ccccc21 Amb27409444 [0,1,0,0,0,1|1,0,1]=4 7753 B13R2.1613 ClCC1OCCc2ccccc21 Amb25238351 [0,1,0,0,0,1|1,0,1]=4 7754 B13R2.1613 ICC1OCCc2ccccc21 Amb27769994 [0,1,0,0,0,1|1,0,1]=4 7755 B13R2.1613 N#CC1=CCCc2ccccc21 Amb17232153 [0,1,0,0,0,1|2,0,0]=4 7756 B13R2.1613 N#CC1=CCOc2ccccc21 Amb17232199 [0,1,0,0,0,1|2,0,0]=4 7757 B13R2.1613 N#CC1OCCc2ccccc21 Amb4084976 [0,1,0,0,0,1|1,0,1]=4 7758 B13R2.1613 NCC1=CCCc2ccccc21 Amb2699521 [0,1,0,0,0,1|2,0,0]=4 7759 B13R2.1613 NCC1=CCOc2ccccc21 Amb18063317 [0,1,0,0,0,1|2,0,0]=4 7760 B13R2.1613 NCC1=NCCc2ccccc21 Amb29848147 [0,1,0,0,0,1|2,0,0]=4 7761 B13R2.1613 NCC1COCc2ccccc21 Amb27828233 [0,1,0,0,0,1|1,0,1]=4 7762 B13R2.1613 NCC1COCc2ccccc21 Amb33743519 [0,1,0,0,0,1|1,0,1]=4 7763 B13R2.1613 NCC1OCCc2ccccc21 Amb4241964 [0,1,0,0,0,1|1,0,1]=4 7764 B13R2.1613 NCC1OCCc2ccccc21 Amb6565445 [0,1,0,0,0,1|1,0,1]=4 7765 B13R2.1613 NNC1=NCCc2ccccc21 Amb18126292 [0,1,0,0,0,1|2,0,0]=4 7766 B13R2.1613 N\N=C1\CCCc2ccccc21 Amb27664746 [0,1,0,0,0,1|2,0,0]=4 7767 B13R2.1613 O=CC1=CCCc2ccccc21 Amb18645053 [0,1,0,0,0,1|1,0,0]=3 7768 B13R2.1613 O=CC1C=CCc2ccccc21 Amb25152354 [0,1,0,0,0,1|1,0,1]=4 7769 B13R2.1613 O=CC1CCCc2ccccc21 Amb18787961 [0,1,0,0,0,1|1,0,1]=4 7770 B13R2.1613 O=CC1CCOc2ccccc21 Amb20622857 [0,1,0,0,0,1|1,0,1]=4 7771 B13R2.1613 O=CC1COCc2ccccc21 Amb25992611 [0,1,0,0,0,1|0,0,1]=3 7772 B13R2.1613 O=CC1NCCc2ccccc21 Amb28125733 [0,1,0,0,0,1|1,0,1]=4 7773 B13R2.1613 O=CC1OCCc2ccccc21 Amb18645642 [0,1,0,0,0,1|0,0,1]=3 7774 B13R2.1613 O=CN1CCCc2ccccc21 Amb2701277 [0,1,0,0,0,1|2,0,0]=4 7775 B13R2.1613 O=C[C@H]1OCCc2ccccc21 Amb28144164 [0,1,0,0,0,1|0,0,1]=3 7776 B13R2.1613 O=Cc1cccc2ccccc12 Amb2792749 [0,1,0,0,0,1|1,0,1]=4 7777 B13R2.1613 O=Cc1ccnc2ccccc12 Amb1266160 [0,1,0,0,0,1|1,0,1]=4 7778 B13R2.1613 O=Cc1cncc2ccccc12 Amb6572006 [0,1,0,0,0,1|1,0,1]=4 7779 B13R2.1613 O=Cc1nccc2ccccc12 Amb8010574 [0,1,0,0,0,1|1,0,1]=4 7780 B13R2.1613 O=Cc1ncnc2ccccc12 Amb21963279 [0,1,0,0,0,1|1,0,1]=4 7781 B13R2.1613 O=Nc1nccc2ccccc12 Amb27847659 [0,1,0,0,0,1|1,0,1]=4 7782 B13R2.1613 O=Nc1ncnc2ccccc12 Amb28051690 [0,1,0,0,0,1|1,0,1]=4 7783 B13R2.1613 O=Nc1nncc2ccccc12 Amb27186201 [0,1,0,0,0,1|1,0,1]=4 7784 B13R2.1613 OCC1=CCOc2ccccc21 Amb28292189 [0,1,0,0,0,1|1,0,1]=4 7785 B13R2.1613 OCC1=CNCc2ccccc21 Amb27228922 [0,1,0,0,0,1|1,0,1]=4 7786 B13R2.1613 OCC1COCc2ccccc21 Amb27652931 [0,1,0,0,0,1|0,0,2]=4 7787 B13R2.1613 OCC1OCCc2ccccc21 Amb1094003 [0,1,0,0,0,1|0,0,2]=4 7788 B13R2.1613 O\N=C1/CCCc2ccccc21 Amb22727930 [0,1,0,0,0,1|1,0,1]=4 7789 B13R2.1613 O\N=C1/CCNc2ccccc21 Amb27240399 [0,1,0,0,0,1|1,0,1]=4 7790 B13R2.1613 O\N=C1/CCOc2ccccc21 Amb19372590 [0,1,0,0,0,1|1,0,1]=4 7791 B13R2.1613 O\N=C1/CCOc2ccccc21 Amb33715894 [0,1,0,0,0,1|1,0,1]=4 7792 B13R2.1613 O\N=C1/CCSc2ccccc21 Amb22366070 [0,1,0,0,0,1|1,0,1]=4 7793 B13R2.1613 O\N=C1\CCCc2ccccc21 Amb6296018 [0,1,0,0,0,1|1,0,1]=4 7794 B13R2.1613 O\N=C1\CCOc2ccccc21 Amb26409966 [0,1,0,0,0,1|1,0,1]=4 7795 B13R2.1613 O\N=C1\CSCc2ccccc21 Amb27426833 [0,1,0,0,0,1|0,1,1]=4 7796 B13R2.1613 SCC1OCCc2ccccc21 Amb25152461 [0,1,0,0,0,1|0,1,1]=4 7797 B13R2.1613 [NH3+]CC1OCCc2ccccc21 Amb5363177 [0,1,0,0,0,1|1,0,1]=4 7798 B13R2.3122 CC1(C)OCNc2ccccc21 Amb25690942 [0,1,0,0,0,1|1,0,1]=4 7799 B13R2.3122 N=S1(=O)CCNc2ccccc21 Amb32992703 [0,1,0,0,0,1|2,0,0]=4 7800 B13R2.3122 N=S1(=O)CCOc2ccccc21 Amb32992878 [0,1,0,0,0,1|2,0,0]=4 7801 B13R2.3122 O=S1(=O)CCNc2ccccc21 Amb493873 [0,1,0,0,0,1|2,0,0]=4 7802 B13R2.3122 O=S1(=O)CCOc2ccccc21 Amb25067727 [0,1,0,0,0,1|2,0,0]=4 7803 B13R2.3122 O=S1(=O)NCNc2ccccc21 Amb1420757 [0,1,0,0,0,1|2,0,0]=4 7804 B13R2.4818 CC1=CCOc2cccc(N)c21 Amb27658773 [0,1,0,0,0,1|2,0,0]=4 7805 B13R2.4818 Cc1cccc2c1C(=O)C=CO2 Amb27638796 [0,1,0,0,0,1|1,0,1]=4 7806 B13R2.4818 Cc1cccc2c1C(=O)CCC2 Amb22230186 [0,1,0,0,0,1|1,0,0]=3 7807 B13R2.4818 Cc1cccc2c1C(=O)CCN2 Amb18829956 [0,1,0,0,0,1|1,0,0]=3 7808 B13R2.4818 Cc1cccc2c1C(=O)CCO2 Amb18829762 [0,1,0,0,0,1|1,0,0]=3 7809 B13R2.4818 Cc1cccc2c1C(=O)CCS2 Amb18824838 [0,1,0,0,0,1|1,0,0]=3 7810 B13R2.4818 Cc1cccc2c1C(=O)NC=N2 Amb22499098 [0,1,0,0,0,1|1,0,1]=4 7811 B13R2.4818 Cc1cccc2c1C(=O)NCC2 Amb18563086 [0,1,0,0,0,1|1,0,0]=3 7812 B13R2.4818 Cc1cccc2c1C(=O)NN=C2 Amb27795144 [0,1,0,0,0,1|1,0,1]=4 7813 B13R2.4818 Cc1cccc2c1[C@@H](N)COC2 Amb27949986 [0,1,0,0,0,1|1,0,1]=4 7814 B13R2.4818 Cc1ccnc2c1C(=O)CCC2 Amb18829937 [0,1,0,0,0,1|2,0,0]=4 7815 B13R2.4818 Cc1ccnc2c1C(=O)CCN2 Amb16233479 [0,1,0,0,0,1|2,0,0]=4 7816 B13R2.4818 Cc1ccnc2c1C(=O)CNC2 Amb18829721 [0,1,0,0,0,1|2,0,0]=4 7817 B13R2.4818 Cc1ncnc2c1C(=O)COC2 Amb18829009 [0,1,0,0,0,1|2,0,0]=4 7818 B13R2.4818 NC1COCc2cccc(Br)c21 Amb27770940 [0,1,0,0,0,1|1,0,1]=4 7819 B13R2.4818 NC1COCc2cccc(Cl)c21 Amb27204479 [0,1,0,0,0,1|1,0,1]=4 7820 B13R2.4818 NC1COCc2cccc(O)c21 Amb27225909 [0,1,0,0,0,1|1,0,1]=4 7821 B13R2.4818 N[C@@H]1COCc2cccc(Cl)c21 Amb27622214 [0,1,0,0,0,1|1,0,1]=4 7822 B13R2.4818 N[C@@H]1COCc2cccc(F)c21 Amb27800893 [0,1,0,0,0,1|1,0,1]=4 7823 B13R2.4818 N[C@H]1COCc2cccc(Br)c21 Amb27390669 [0,1,0,0,0,1|1,0,1]=4 7824 B13R2.4818 Nc1cccc2c1C(=O)CCC2 Amb22491494 [0,1,0,0,0,1|1,0,0]=3 7825 B13R2.4818 Nc1cccc2c1C(=O)CCN2 Amb27950978 [0,1,0,0,0,1|1,0,0]=3 7826 B13R2.4818 Nc1cccc2c1C(=O)N=CN2 Amb22489697 [0,1,0,0,0,1|1,0,1]=4 7827 B13R2.4818 Nc1cccc2c1C(=O)NCC2 Amb18064242 [0,1,0,0,0,1|1,0,0]=3 7828 B13R2.4818 O=C1C=CNC2=C1C(=O)CCC2 Amb24513619 [0,1,0,0,0,1|2,0,0]=4 7829 B13R2.4818 O=C1C=NNc2cccc(Br)c21 Amb23559906 [0,1,0,0,0,1|2,0,0]=4 7830 B13R2.4818 O=C1CCCc2cccc(Br)c21 Amb8388747 [0,1,0,0,0,1|1,0,0]=3 7831 B13R2.4818 O=C1CCCc2cccc(Cl)c21 Amb13883634 [0,1,0,0,0,1|1,0,0]=3 7832 B13R2.4818 O=C1CCCc2cccc(F)c21 Amb10603941 [0,1,0,0,0,1|1,0,0]=3 7833 B13R2.4818 O=C1CCCc2cccc(I)c21 Amb16233089 [0,1,0,0,0,1|1,0,0]=3 7834 B13R2.4818 O=C1CCCc2cccc(O)c21 Amb18645630 [0,1,0,0,0,1|1,0,0]=3 7835 B13R2.4818 O=C1CCCc2cccc(S)c21 Amb28145964 [0,1,0,0,0,1|1,0,0]=3 7836 B13R2.4818 O=C1CCNc2cccc(Br)c21 Amb18753485 [0,1,0,0,0,1|1,0,0]=3 7837 B13R2.4818 O=C1CCNc2cccc(Cl)c21 Amb18823866 [0,1,0,0,0,1|1,0,0]=3 7838 B13R2.4818 O=C1CCNc2cccc(F)c21 Amb28072837 [0,1,0,0,0,1|1,0,0]=3 7839 B13R2.4818 O=C1CCNc2cccc(I)c21 Amb25716066 [0,1,0,0,0,1|1,0,0]=3 7840 B13R2.4818 O=C1CCOc2cccc(Br)c21 Amb16233097 [0,1,0,0,0,1|1,0,0]=3 7841 B13R2.4818 O=C1CCOc2cccc(Cl)c21 Amb16233096 [0,1,0,0,0,1|1,0,0]=3 7842 B13R2.4818 O=C1CCOc2cccc(F)c21 Amb16233077 [0,1,0,0,0,1|1,0,0]=3 7843 B13R2.4818 O=C1CCOc2cccc(O)c21 Amb27855395 [0,1,0,0,0,1|1,0,0]=3 7844 B13R2.4818 O=C1CCOc2cccc(S)c21 Amb27815330 [0,1,0,0,0,1|1,0,0]=3 7845 B13R2.4818 O=C1CCSc2cccc(Br)c21 Amb25121325 [0,1,0,0,0,1|1,0,0]=3 7846 B13R2.4818 O=C1CCSc2cccc(Cl)c21 Amb18811413 [0,1,0,0,0,1|1,0,0]=3 7847 B13R2.4818 O=C1CCSc2cccc(F)c21 Amb24183291 [0,1,0,0,0,1|1,0,0]=3 7848 B13R2.4818 O=C1CCSc2cccc(I)c21 Amb25315433 [0,1,0,0,0,1|1,0,0]=3 7849 B13R2.4818 O=C1COCc2cccc(Cl)c21 Amb24081478 [0,1,0,0,0,1|0,0,0]=2 7850 B13R2.4818 O=C1COCc2cccc(I)c21 Amb25096376 [0,1,0,0,0,1|0,0,0]=2 7851 B13R2.4818 O=C1COCc2cccc(O)c21 Amb28388764 [0,1,0,0,0,1|0,0,0]=2 7852 B13R2.4818 O=C1N=CNc2cccc(F)c21 Amb19958984 [0,1,0,0,0,1|1,0,1]=4 7853 B13R2.4818 O=C1NC=Cc2cccc(Br)c21 Amb19100753 [0,1,0,0,0,1|1,0,1]=4 7854 B13R2.4818 O=C1NC=Cc2cccc(Cl)c21 Amb19100715 [0,1,0,0,0,1|1,0,1]=4 7855 B13R2.4818 O=C1NC=Cc2cccc(F)c21 Amb19100710 [0,1,0,0,0,1|1,0,1]=4 7856 B13R2.4818 O=C1NC=Cc2cccc(I)c21 Amb25238850 [0,1,0,0,0,1|1,0,1]=4 7857 B13R2.4818 O=C1NC=Cc2cccc(O)c21 Amb19100708 [0,1,0,0,0,1|1,0,1]=4 7858 B13R2.4818 O=C1NC=Nc2cccc(Br)c21 Amb20243346 [0,1,0,0,0,1|1,0,1]=4 7859 B13R2.4818 O=C1NC=Nc2cccc(Cl)c21 Amb19375292 [0,1,0,0,0,1|1,0,1]=4 7860 B13R2.4818 O=C1NC=Nc2cccc(I)c21 Amb20243335 [0,1,0,0,0,1|1,0,1]=4 7861 B13R2.4818 O=C1NC=Nc2cccc(O)c21 Amb27593256 [0,1,0,0,0,1|1,0,1]=4 7862 B13R2.4818 O=C1NCCc2cccc(Br)c21 Amb18065023 [0,1,0,0,0,1|1,0,0]=3 7863 B13R2.4818 O=C1NCCc2cccc(Cl)c21 Amb18563088 [0,1,0,0,0,1|1,0,0]=3 7864 B13R2.4818 O=C1NCCc2cccc(F)c21 Amb18563087 [0,1,0,0,0,1|1,0,0]=3 7865 B13R2.4818 O=C1NCCc2cccc(O)c21 Amb22754565 [0,1,0,0,0,1|1,0,0]=3 7866 B13R2.4818 O=C1NCCc2ccnc(Cl)c21 Amb18823459 [0,1,0,0,0,1|2,0,0]=4 7867 B13R2.4818 O=C1NN=Cc2cccc(Cl)c21 Amb22170156 [0,1,0,0,0,1|1,0,1]=4 7868 B13R2.4818 O=C1NN=Cc2cccc(F)c21 Amb25198237 [0,1,0,0,0,1|1,0,1]=4 7869 B13R2.4818 O=C1NN=Cc2cccc(O)c21 Amb32658725 [0,1,0,0,0,1|1,0,1]=4 7870 B13R2.4818 O=C1OCCc2cccc(Br)c21 Amb28139703 [0,1,0,0,0,1|0,0,0]=2 7871 B13R2.4818 O=C1OCCc2cccc(I)c21 Amb28125794 [0,1,0,0,0,1|0,0,0]=2 7872 B13R2.4818 O=C1OCCc2cccc(O)c21 Amb10604225 [0,1,0,0,0,1|0,0,0]=2 7873 B13R2.4818 O=C1OCOc2cccc(Br)c21 Amb24077632 [0,1,0,0,0,1|0,0,0]=2 7874 B13R2.4818 O=C1OCOc2cccc(F)c21 Amb24077628 [0,1,0,0,0,1|0,0,0]=2 7875 B13R2.1 BrCCC1=CCc2ccccc21 Amb27808546 [0,2,0,0,0,0|2,0,0]=4 7876 B13R2.1 BrCCc1onc2ccccc12 Amb28051589 [0,2,0,0,0,0|2,0,0]=4 7877 B13R2.1 CNCC1OCc2ccccc21 Amb34915058 [0,2,0,0,0,0|1,0,1]=4 7878 B13R2.1 CN\N=C1\CCc2ccccc21 Amb28122233 [0,2,0,0,0,0|2,0,0]=4 7879 B13R2.1 CO\N=C1\CCc2ccccc21 Amb22752143 [0,2,0,0,0,0|1,0,1]=4 7880 B13R2.1 N#CCc1occ2ccccc12 Amb34916675 [0,2,0,0,0,0|1,0,1]=4 7881 B13R2.1 NCCC1=CCc2ccccc21 Amb19149344 [0,2,0,0,0,0|2,0,0]=4 7882 B13R2.1 NCCC1=CCc2ccccc21 Amb21811903 [0,2,0,0,0,0|2,0,0]=4 7883 B13R2.1 NCCC1OCc2ccccc21 Amb18829221 [0,2,0,0,0,0|1,0,1]=4 7884 B13R2.1 NCCc1onc2ccccc12 Amb18829745 [0,2,0,0,0,0|2,0,0]=4 7885 B13R2.1 NC\C=C1/CCc2ccccc21 Amb27482953 [0,2,0,0,0,0|2,0,0]=4 7886 B13R2.1 NOCc1occ2ccccc12 Amb25319347 [0,2,0,0,0,0|0,0,2]=4 7887 B13R2.1 O=C=NC1CCc2ccccc21 Amb27635843 [0,2,0,0,0,0|1,0,1]=4 7888 B13R2.1 O=C=N[C@H]1CCc2ccccc21 Amb10807458 [0,2,0,0,0,0|1,0,1]=4 7889 B13R2.1 O=C=Nc1csc2ccccc12 Amb18279280 [0,2,0,0,0,0|2,0,0]=4 7890 B13R2.1 O=CCC1CCc2ccccc21 Amb26865434 [0,2,0,0,0,0|1,0,1]=4 7891 B13R2.1 O=CCc1csc2ccccc12 Amb25736591 [0,2,0,0,0,0|2,0,0]=4 7892 B13R2.1 O=CN[C@@H]1CCc2ccccc21 Amb27478053 [0,2,0,0,0,0|1,0,1]=4 7893 B13R2.1 O=C\C=C1/CCc2ccccc21 Amb28397447 [0,2,0,0,0,0|1,0,0]=3 7894 B13R2.1 O\N=C/c1occ2ccccc12 Amb27490828 [0,2,0,0,0,0|0,0,2]=4 7895 B13R2.1 [N-]=[N+]=NC1=CCc2ccccc21 Amb27967235 [0,2,0,0,0,0|2,0,0]=4 7896 B13R2.9 Cc1cccc2c(C=O)coc12 Amb18830292 [0,2,0,0,0,0|2,0,0]=4 7897 B13R2.9 Cc1cccc2c(C=O)csc12 Amb18141108 [0,2,0,0,0,0|2,0,0]=4 7898 B13R2.9 Cc1cccc2c1CC=C2C#N Amb17232152 [0,2,0,0,0,0|2,0,0]=4 7899 B13R2.9 Cc1cccc2c1CC=C2CN Amb18063347 [0,2,0,0,0,0|2,0,0]=4 7900 B13R2.9 N#CC1=CCc2c(Cl)cccc21 Amb17233162 [0,2,0,0,0,0|2,0,0]=4 7901 B13R2.9 N#CC1=CCc2c(F)cccc21 Amb17232282 [0,2,0,0,0,0|2,0,0]=4 7902 B13R2.9 NCC1=CCc2c(Cl)cccc21 Amb18063348 [0,2,0,0,0,0|2,0,0]=4 7903 B13R2.9 NCC1=CCc2c(F)cccc21 Amb18561071 [0,2,0,0,0,0|2,0,0]=4 7904 B13R2.9 NCc1occ2c(N)cccc12 Amb24473273 [0,2,0,0,0,0|1,0,1]=4 7905 B13R2.9 N\N=C1\CCc2c(Cl)cccc21 Amb27660367 [0,2,0,0,0,0|2,0,0]=4 7906 B13R2.9 Nc1cccc2c(C=O)csc12 Amb32708800 [0,2,0,0,0,0|2,0,0]=4 7907 B13R2.9 Nc1cccc2c(CO)occ12 Amb28044164 [0,2,0,0,0,0|0,0,2]=4 7908 B13R2.9 O=Cc1coc2c(Br)cccc12 Amb18754982 [0,2,0,0,0,0|2,0,0]=4 7909 B13R2.9 O=Cc1csc2c(Br)cccc12 Amb28250348 [0,2,0,0,0,0|2,0,0]=4 7910 B13R2.9 O\N=C1\CCc2c(O)cccc21 Amb27660439 [0,2,0,0,0,0|1,0,1]=4 7911 B13R2.72 CC(=O)C1CCc2ccccc21 Amb24400099 [0,2,0,0,0,0|1,0,1]=4 7912 B13R2.72 CC(=O)N1CCc2ccccc21 Amb6357858 [0,2,0,0,0,0|2,0,0]=4 7913 B13R2.72 CC(=O)N1OCc2ccccc21 Amb27756375 [0,2,0,0,0,0|1,0,0]=3 7914 B13R2.72 CC(=O)[C@@H]1CCc2ccccc21 Amb25834379 [0,2,0,0,0,0|1,0,1]=4 7915 B13R2.72 CC(=O)c1coc2ccccc12 Amb19887568 [0,2,0,0,0,0|2,0,0]=4 7916 B13R2.72 CC(=O)c1csc2ccccc12 Amb33528908 [0,2,0,0,0,0|2,0,0]=4 7917 B13R2.72 CC(=O)c1noc2ccccc12 Amb25723786 [0,2,0,0,0,0|2,0,0]=4 7918 B13R2.72 CC(=O)c1occ2ccccc12 Amb18199846 [0,2,0,0,0,0|0,0,1]=3 7919 B13R2.72 CC(=O)c1onc2ccccc12 Amb27209683 [0,2,0,0,0,0|1,0,0]=3 7920 B13R2.72 CC(=O)c1onc2cccnc12 Amb18829867 [0,2,0,0,0,0|2,0,0]=4 7921 B13R2.72 CC(=O)c1onc2ncccc12 Amb27144320 [0,2,0,0,0,0|2,0,0]=4 7922 B13R2.72 CC(C)=C1ONc2ccccc21 Amb27209784 [0,2,0,0,0,0|2,0,0]=4 7923 B13R2.72 CC(C)c1onc2ccccc12 Amb27666336 [0,2,0,0,0,0|2,0,0]=4 7924 B13R2.72 CC(N)C1OCc2ccccc21 Amb33745574 [0,2,0,0,0,0|1,0,1]=4 7925 B13R2.72 CC(O)C1=CCc2ccccc21 Amb28244189 [0,2,0,0,0,0|1,0,1]=4 7926 B13R2.72 CC(O)c1occ2ccccc12 Amb25899169 [0,2,0,0,0,0|0,0,2]=4 7927 B13R2.72 CS(=O)C1CCc2ccccc21 Amb26912150 [0,2,0,0,0,0|1,0,1]=4 7928 B13R2.72 C[C@@H](N)C1OCc2ccccc21 Amb33747720 [0,2,0,0,0,0|1,0,1]=4 7929 B13R2.72 C[C@H](N)C1OCc2ccccc21 Amb33731424 [0,2,0,0,0,0|1,0,1]=4 7930 B13R2.72 ClC(Cl)=C1CCc2ccccc21 Amb27603380 [0,2,0,0,0,0|2,0,0]=4 7931 B13R2.72 NC(=O)C1CCc2ccccc21 Amb4035852 [0,2,0,0,0,0|1,0,1]=4 7932 B13R2.72 NC(=O)N1CCc2ccccc21 Amb1124478 [0,2,0,0,0,0|2,0,0]=4 7933 B13R2.72 NC(=O)[C@@H]1CCc2ccccc21 Amb27460722 [0,2,0,0,0,0|1,0,1]=4 7934 B13R2.72 NC(=O)c1coc2ccccc12 Amb23401825 [0,2,0,0,0,0|2,0,0]=4 7935 B13R2.72 NC(=O)c1csc2ccccc12 Amb18808969 [0,2,0,0,0,0|2,0,0]=4 7936 B13R2.72 NC(=O)c1nsc2ccccc12 Amb16677288 [0,2,0,0,0,0|2,0,0]=4 7937 B13R2.72 O=C(Cl)C1NCc2ccccc21 Amb27623703 [0,2,0,0,0,0|1,0,1]=4 7938 B13R2.72 O=C(Cl)N1CCc2ccccc21 Amb20670451 [0,2,0,0,0,0|2,0,0]=4 7939 B13R2.72 O=C(Cl)c1coc2ccccc12 Amb9677570 [0,2,0,0,0,0|2,0,0]=4 7940 B13R2.72 O=C(Cl)c1csc2ccccc12 Amb2723179 [0,2,0,0,0,0|2,0,0]=4 7941 B13R2.72 O=C(Cl)c1nsc2ccccc12 Amb27198478 [0,2,0,0,0,0|2,0,0]=4 7942 B13R2.72 O=C(O)C1=CCc2ccccc21 Amb2691224 [0,2,0,0,0,0|1,0,0]=3 7943 B13R2.72 O=C(O)C1CCc2ccccc21 Amb18538487 [0,2,0,0,0,0|1,0,1]=4 7944 B13R2.72 O=C(O)C1NCc2ccccc21 Amb22491461 [0,2,0,0,0,0|1,0,1]=4 7945 B13R2.72 O=C(O)C1NCc2ccccc21 Amb2699615 [0,2,0,0,0,0|1,0,1]=4 7946 B13R2.72 O=C(O)C1OCc2ccccc21 Amb18829056 [0,2,0,0,0,0|0,0,1]=3 7947 B13R2.72 O=C(O)[C@@H]1CCc2ccccc21 Amb24729539 [0,2,0,0,0,0|1,0,1]=4 7948 B13R2.72 O=C(O)[C@@H]1NCc2ccccc21 Amb22748827 [0,2,0,0,0,0|1,0,1]=4 7949 B13R2.72 O=C(O)[C@@H]1NCc2ccccc21 Amb30869293 [0,2,0,0,0,0|1,0,1]=4 7950 B13R2.72 O=C(O)[C@H]1CCc2ccccc21 Amb24470066 [0,2,0,0,0,0|1,0,1]=4 7951 B13R2.72 O=C(O)[C@H]1NCc2ccccc21 Amb25200954 [0,2,0,0,0,0|1,0,1]=4 7952 B13R2.72 O=C(O)[C@H]1NCc2ccccc21 Amb33872272 [0,2,0,0,0,0|1,0,1]=4 7953 B13R2.72 O=C(O)c1coc2ccccc12 Amb6355909 [0,2,0,0,0,0|2,0,0]=4 7954 B13R2.72 O=C(O)c1csc2ccccc12 Amb6335606 [0,2,0,0,0,0|2,0,0]=4 7955 B13R2.72 O=C(O)c1noc2ccccc12 Amb1994153 [0,2,0,0,0,0|2,0,0]=4 7956 B13R2.72 O=C(O)c1nsc2ccccc12 Amb33542908 [0,2,0,0,0,0|2,0,0]=4 7957 B13R2.72 O=C(O)c1occ2ccccc12 Amb6357074 [0,2,0,0,0,0|0,0,1]=3 7958 B13R2.72 O=C(O)c1onc2ccccc12 Amb2725091 [0,2,0,0,0,0|1,0,0]=3 7959 B13R2.72 O=C(O)c1onc2cccnc12 Amb27186314 [0,2,0,0,0,0|2,0,0]=4 7960 B13R2.72 O=C(O)c1onc2ncccc12 Amb18829102 [0,2,0,0,0,0|2,0,0]=4 7961 B13R2.72 O=C(O)c1snc2ccccc12 Amb17594585 [0,2,0,0,0,0|1,1,0]=4 7962 B13R2.72 O=S([O-])c1csc2ccccc12 Amb27462813 [0,2,0,0,0,0|2,0,0]=4 7963 B13R2.72 O=[N+]([O-])c1csc2ccccc12 Amb5720588 [0,2,0,0,0,0|2,0,0]=4 7964 B13R2.72 OB(O)C1=CCc2ccccc21 Amb24487374 [0,2,0,0,0,0|1,0,1]=4 7965 B13R2.135 CC1=C(C#N)c2ccccc2C1 Amb17778902 [0,2,0,0,0,0|2,0,0]=4 7966 B13R2.135 CC1Cc2ccccc2N1N=O Amb17618597 [0,2,0,0,0,0|2,0,0]=4 7967 B13R2.135 CC1Cc2ccccc2\C1=N/O Amb27425215 [0,2,0,0,0,0|1,0,1]=4 7968 B13R2.135 Cc1oc2ccccc2c1C=O Amb1003032 [0,2,0,0,0,0|2,0,0]=4 7969 B13R2.135 Cc1sc2ccccc2c1C=O Amb10569109 [0,2,0,0,0,0|2,0,0]=4 7970 B13R2.135 Cn1cc2ccccc2c1C=O Amb27265953 [0,2,0,0,0,0|1,0,1]=4 7971 B13R2.135 Cn1nc2ccccc2c1C=O Amb2723782 [0,2,0,0,0,0|2,0,0]=4 7972 B13R2.135 N#CC1=C(N)Cc2ccccc21 Amb5720180 [0,2,0,0,0,0|2,0,0]=4 7973 B13R2.135 Nc1oc2ccccc2c1C=O Amb18830101 [0,2,0,0,0,0|2,0,0]=4 7974 B13R2.135 Nc1sc2ccccc2c1C=O Amb18825001 [0,2,0,0,0,0|2,0,0]=4 7975 B13R2.135 O=C1Cc2ccccc2\C1=C\O Amb28122463 [0,2,0,0,0,0|1,0,1]=4 7976 B13R2.135 O=CC1=C2C=CC=CN2CC1=O Amb28255458 [0,2,0,0,0,0|2,0,0]=4 7977 B13R2.135 O=Cc1c(Br)sc2ccccc12 Amb18661020 [0,2,0,0,0,0|2,0,0]=4 7978 B13R2.135 O=Cc1c(Cl)oc2ccccc12 Amb33527349 [0,2,0,0,0,0|2,0,0]=4 7979 B13R2.135 O=Cc1c(Cl)sc2ccccc12 Amb18675050 [0,2,0,0,0,0|2,0,0]=4 7980 B13R2.135 O=Cc1c(I)sc2ccccc12 Amb27230314 [0,2,0,0,0,0|2,0,0]=4 7981 B13R2.135 O=Cc1c(S)sc2ccccc12 Amb27636510 [0,2,0,0,0,0|2,0,0]=4 7982 B13R2.662 CCC1OCc2cc(O)ccc21 Amb28351483 [0,2,0,0,0,0|1,0,1]=4 7983 B13R2.662 CCc1onc2cc(C)ccc12 Amb27492893 [0,2,0,0,0,0|2,0,0]=4 7984 B13R2.662 Cc1ccc2c(C=O)coc2c1 Amb18830294 [0,2,0,0,0,0|2,0,0]=4 7985 B13R2.662 Cc1ccc2c(C=O)csc2c1 Amb18141106 [0,2,0,0,0,0|2,0,0]=4 7986 B13R2.662 Cc1ccc2c(c1)CCN2C=O Amb27638530 [0,2,0,0,0,0|2,0,0]=4 7987 B13R2.662 Cc1ccc2c(c1)CCN2N=O Amb27963229 [0,2,0,0,0,0|2,0,0]=4 7988 B13R2.662 N#Cc1onc2cc(Cl)ccc12 Amb24544526 [0,2,0,0,0,0|2,0,0]=4 7989 B13R2.662 NCC1=CCc2cc(F)ccc21 Amb27966120 [0,2,0,0,0,0|2,0,0]=4 7990 B13R2.662 NCC1=CCc2cc(O)ccc21 Amb27613169 [0,2,0,0,0,0|2,0,0]=4 7991 B13R2.662 NCc1occ2cc(N)ccc12 Amb25801828 [0,2,0,0,0,0|1,0,1]=4 7992 B13R2.662 NCc1onc2cc(Br)ccc12 Amb27261597 [0,2,0,0,0,0|2,0,0]=4 7993 B13R2.662 NCc1onc2cc(Cl)ccc12 Amb28437307 [0,2,0,0,0,0|2,0,0]=4 7994 B13R2.662 NCc1onc2cc(F)ccc12 Amb27168172 [0,2,0,0,0,0|2,0,0]=4 7995 B13R2.662 N\N=C1\CCc2cc(Br)ccc21 Amb27607283 [0,2,0,0,0,0|2,0,0]=4 7996 B13R2.662 Nc1ccc2c(CO)occ2c1 Amb25899082 [0,2,0,0,0,0|0,0,2]=4 7997 B13R2.662 Nc1ccc2c(c1)CC\C2=N/O Amb28456150 [0,2,0,0,0,0|1,0,1]=4 7998 B13R2.662 O=CC1CCc2cc(Br)ccc21 Amb27664115 [0,2,0,0,0,0|1,0,1]=4 7999 B13R2.662 O=CC1CCc2cc(O)ccc21 Amb27244498 [0,2,0,0,0,0|1,0,1]=4 8000 B13R2.662 O=CN1CCc2cc(F)ccc21 Amb27437955 [0,2,0,0,0,0|2,0,0]=4 8001 B13R2.662 O=Cc1coc2cc(Br)ccc12 Amb18754953 [0,2,0,0,0,0|2,0,0]=4 8002 B13R2.662 O=Cc1coc2cc(I)ccc12 Amb28241034 [0,2,0,0,0,0|2,0,0]=4 8003 B13R2.662 O=Cc1csc2cc(Br)ccc12 Amb22751331 [0,2,0,0,0,0|2,0,0]=4 8004 B13R2.662 O=Cc1csc2cc(O)ccc12 Amb32708802 [0,2,0,0,0,0|2,0,0]=4 8005 B13R2.662 O=Cc1noc2cc(Br)ccc12 Amb24435419 [0,2,0,0,0,0|2,0,0]=4 8006 B13R2.662 O=Cc1noc2cc(Cl)ccc12 Amb28400099 [0,2,0,0,0,0|2,0,0]=4 8007 B13R2.662 O=Cc1noc2cc(F)ccc12 Amb27194972 [0,2,0,0,0,0|2,0,0]=4 8008 B13R2.662 O=Cc1nsc2cc(Br)ccc12 Amb28256793 [0,2,0,0,0,0|2,0,0]=4 8009 B13R2.662 O=Cc1nsc2cc(Cl)ccc12 Amb27178476 [0,2,0,0,0,0|2,0,0]=4 8010 B13R2.662 O=Cc1onc2cc(Br)ccc12 Amb33129219 [0,2,0,0,0,0|1,0,0]=3 8011 B13R2.662 O=NN1CCc2cc(Cl)ccc21 Amb27613025 [0,2,0,0,0,0|2,0,0]=4 8012 B13R2.662 OCC1OCc2cc(Br)ccc21 Amb27263070 [0,2,0,0,0,0|0,0,2]=4 8013 B13R2.662 O\N=C1\CCc2cc(Br)ccc21 Amb27389361 [0,2,0,0,0,0|1,0,1]=4 8014 B13R2.662 O\N=C1\CCc2cc(F)ccc21 Amb27948184 [0,2,0,0,0,0|1,0,1]=4 8015 B13R2.2091 CNc1onc2cccc(N)c12 Amb27946042 [0,2,0,0,0,0|2,0,0]=4 8016 B13R2.2091 Cc1cccc2coc(CN)c12 Amb27865184 [0,2,0,0,0,0|1,0,1]=4 8017 B13R2.2091 N#CC1=CCc2cccc(Br)c21 Amb28042633 [0,2,0,0,0,0|2,0,0]=4 8018 B13R2.2091 NCc1occ2cccc(N)c12 Amb27755395 [0,2,0,0,0,0|1,0,1]=4 8019 B13R2.2091 O=Cc1coc2cccc(Br)c12 Amb18754948 [0,2,0,0,0,0|2,0,0]=4 8020 B13R2.2091 O=Cc1coc2cccc(F)c12 Amb18829084 [0,2,0,0,0,0|2,0,0]=4 8021 B13R2.2091 O=Cc1csc2cccc(O)c12 Amb32708797 [0,2,0,0,0,0|2,0,0]=4 8022 B13R2.2091 O=Cc1occ2cccc(Cl)c12 Amb27948019 [0,2,0,0,0,0|0,0,1]=3 8023 B13R2.2091 O=Cc1onc2cccc(Br)c12 Amb33129213 [0,2,0,0,0,0|1,0,0]=3 8024 B13R2.2091 O=Nc1csc2cccc(O)c12 Amb27445739 [0,2,0,0,0,0|2,0,0]=4 8025 B13R2.2091 OCc1occ2cccc(O)c12 Amb28244293 [0,2,0,0,0,0|0,0,2]=4 8026 B13R2.2091 O\N=C1\CCc2cccc(O)c21 Amb27637814 [0,2,0,0,0,0|1,0,1]=4 8027 B13R2.2136 CCc1onc2ccc(Cl)cc12 Amb4376417 [0,2,0,0,0,0|2,0,0]=4 8028 B13R2.2136 CNc1onc2ccc(N)cc12 Amb27762760 [0,2,0,0,0,0|2,0,0]=4 8029 B13R2.2136 CNc1onc2ccc(O)cc12 Amb28348756 [0,2,0,0,0,0|2,0,0]=4 8030 B13R2.2136 COC1OCc2ccc(Br)cc21 Amb22751584 [0,2,0,0,0,0|0,0,2]=4 8031 B13R2.2136 Cc1ccc2c(c1)C(C#N)=CC2 Amb17232151 [0,2,0,0,0,0|2,0,0]=4 8032 B13R2.2136 Cc1ccc2c(c1)C(CN)=CC2 Amb18561040 [0,2,0,0,0,0|2,0,0]=4 8033 B13R2.2136 Cc1ccc2c(c1)\C(=N/O)CC2 Amb27177453 [0,2,0,0,0,0|1,0,1]=4 8034 B13R2.2136 Cc1ccc2scc(C=O)c2c1 Amb18674903 [0,2,0,0,0,0|2,0,0]=4 8035 B13R2.2136 N#CC1=CCc2ccc(Cl)cc21 Amb17233161 [0,2,0,0,0,0|2,0,0]=4 8036 B13R2.2136 N#CC1=CCc2ccc(F)cc21 Amb17232281 [0,2,0,0,0,0|2,0,0]=4 8037 B13R2.2136 N#Cc1onc2ccc(Cl)cc12 Amb25279379 [0,2,0,0,0,0|2,0,0]=4 8038 B13R2.2136 N#Cc1onc2ccc(F)cc12 Amb24517188 [0,2,0,0,0,0|2,0,0]=4 8039 B13R2.2136 NCC1=CCc2ccc(Br)cc21 Amb18063343 [0,2,0,0,0,0|2,0,0]=4 8040 B13R2.2136 NCC1=CCc2ccc(Cl)cc21 Amb18561070 [0,2,0,0,0,0|2,0,0]=4 8041 B13R2.2136 NCC1=CCc2ccc(F)cc21 Amb18063341 [0,2,0,0,0,0|2,0,0]=4 8042 B13R2.2136 N\N=C1/CCc2ccc(N)cc21 Amb27453551 [0,2,0,0,0,0|2,0,0]=4 8043 B13R2.2136 N\N=C1\CCc2ccc(Cl)cc21 Amb28256431 [0,2,0,0,0,0|2,0,0]=4 8044 B13R2.2136 Nc1ccc2occ(C=O)c2c1 Amb18830132 [0,2,0,0,0,0|2,0,0]=4 8045 B13R2.2136 Nc1ccc2onc(C=O)c2c1 Amb18829842 [0,2,0,0,0,0|2,0,0]=4 8046 B13R2.2136 Nc1ccc2scc(C=O)c2c1 Amb28244136 [0,2,0,0,0,0|2,0,0]=4 8047 B13R2.2136 O=Cc1coc2ccc(Br)cc12 Amb18754944 [0,2,0,0,0,0|2,0,0]=4 8048 B13R2.2136 O=Cc1coc2ccc(F)cc12 Amb18829085 [0,2,0,0,0,0|2,0,0]=4 8049 B13R2.2136 O=Cc1csc2ccc(Br)cc12 Amb2723531 [0,2,0,0,0,0|2,0,0]=4 8050 B13R2.2136 O=Cc1csc2ccc(Cl)cc12 Amb2725906 [0,2,0,0,0,0|2,0,0]=4 8051 B13R2.2136 O=Cc1csc2ccc(F)cc12 Amb18137038 [0,2,0,0,0,0|2,0,0]=4 8052 B13R2.2136 O=Cc1csc2ccc(O)cc12 Amb25956312 [0,2,0,0,0,0|2,0,0]=4 8053 B13R2.2136 O=Cc1noc2ccc(Br)cc12 Amb33738130 [0,2,0,0,0,0|2,0,0]=4 8054 B13R2.2136 O=Cc1nsc2ccc(Br)cc12 Amb27977760 [0,2,0,0,0,0|2,0,0]=4 8055 B13R2.2136 O=Cc1onc2ccc(Cl)cc12 Amb33129214 [0,2,0,0,0,0|1,0,0]=3 8056 B13R2.2136 O=Cc1onc2ccc(F)cc12 Amb33129215 [0,2,0,0,0,0|1,0,0]=3 8057 B13R2.2136 O=Cc1snc2ccc(Br)cc12 Amb26417559 [0,2,0,0,0,0|1,1,0]=4 8058 B13R2.2136 O\N=C1\CCc2ccc(Cl)cc21 Amb27398300 [0,2,0,0,0,0|1,0,1]=4 8059 B13R2.2531 CC1(C=O)CCc2ccccc21 Amb25835066 [0,2,0,0,0,0|1,0,1]=4 8060 B13R2.2931 C=C1OC(CN)c2ccccc21 Amb28240872 [0,2,0,0,0,0|1,0,0]=3 8061 B13R2.2931 CC1C=C(C#N)c2ccccc21 Amb17232154 [0,2,0,0,0,0|2,0,0]=4 8062 B13R2.2931 CCC1CC(=O)c2ccccc21 Amb17232326 [0,2,0,0,0,0|1,0,0]=3 8063 B13R2.2931 CCC1NC(=O)c2ccccc21 Amb27785371 [0,2,0,0,0,0|1,0,0]=3 8064 B13R2.2931 CCC1NC(=S)c2ccccc21 Amb28435590 [0,2,0,0,0,0|1,1,0]=4 8065 B13R2.2931 CC[C@H]1OC(O)c2ccccc21 Amb27805063 [0,2,0,0,0,0|0,0,2]=4 8066 B13R2.2931 CNC1=NC(=O)c2ccccc21 Amb25295230 [0,2,0,0,0,0|1,0,1]=4 8067 B13R2.2931 COC1=CC(C)c2ccccc21 Amb17778898 [0,2,0,0,0,0|1,0,1]=4 8068 B13R2.2931 COC1C=C(C)c2ccccc21 Amb17844048 [0,2,0,0,0,0|2,0,0]=4 8069 B13R2.2931 COC1CC(=O)c2ccccc21 Amb26625933 [0,2,0,0,0,0|1,0,0]=3 8070 B13R2.2931 COC1OC(=O)c2ccccc21 Amb2611631 [0,2,0,0,0,0|0,0,0]=2 8071 B13R2.2931 CO[IH2]1OC(=O)c2ccccc21 Amb27393085 [0,2,0,0,0,0|1,0,0]=3 8072 B13R2.2931 C\C=C1/NC(=O)c2ccccc21 Amb27770785 [0,2,0,0,0,0|1,0,1]=4 8073 B13R2.2931 C\C=C1\NC(=O)c2ccccc21 Amb28052972 [0,2,0,0,0,0|1,0,1]=4 8074 B13R2.2931 Cn1cc(C=O)c2ccccc21 Amb1147112 [0,2,0,0,0,0|2,0,0]=4 8075 B13R2.2931 Cn1nc(C=O)c2ccccc21 Amb2723099 [0,2,0,0,0,0|2,0,0]=4 8076 B13R2.2931 N#CC1CC(=O)c2ccccc21 Amb17400022 [0,2,0,0,0,0|1,0,0]=3 8077 B13R2.2931 N#CC1OC(=O)c2ccccc21 Amb19889006 [0,2,0,0,0,0|0,0,0]=2 8078 B13R2.2931 N#C[IH2]1OC(=O)c2ccccc21 Amb10071693 [0,2,0,0,0,0|1,0,0]=3 8079 B13R2.2931 NCC1CC(=O)c2ccccc21 Amb17400089 [0,2,0,0,0,0|1,0,0]=3 8080 B13R2.2931 NCC1OB(O)c2ccccc21 Amb26919312 [0,2,0,0,0,0|1,0,1]=4 8081 B13R2.2931 NCC1OB(O)c2ccccc21 Amb28653081 [0,2,0,0,0,0|1,0,1]=4 8082 B13R2.2931 NCC1OC(=O)c2ccccc21 Amb27601246 [0,2,0,0,0,0|0,0,0]=2 8083 B13R2.2931 NC[C@@H]1OB(O)c2ccccc21 Amb27254271 [0,2,0,0,0,0|1,0,1]=4 8084 B13R2.2931 N\N=C1/CC(=O)c2ccccc21 Amb22520537 [0,2,0,0,0,0|1,0,1]=4 8085 B13R2.2931 N\N=C1/NC(=O)c2ccccc21 Amb25891935 [0,2,0,0,0,0|1,0,1]=4 8086 B13R2.2931 O=C1CC(CBr)c2ccccc21 Amb22489708 [0,2,0,0,0,0|1,0,0]=3 8087 B13R2.2931 O=C1C[C@H](CO)c2ccccc21 Amb27199082 [0,2,0,0,0,0|1,0,0]=3 8088 B13R2.2931 O=C1C\C(=N\O)c2ccccc21 Amb26992256 [0,2,0,0,0,0|1,0,1]=4 8089 B13R2.2931 O=C1N\C(=N\O)c2ccccc21 Amb21811521 [0,2,0,0,0,0|1,0,1]=4 8090 B13R2.2931 O=C1OC(CI)c2ccccc21 Amb28188727 [0,2,0,0,0,0|0,0,0]=2 8091 B13R2.2931 O=C1OC(CO)c2ccccc21 Amb27175627 [0,2,0,0,0,0|0,0,0]=2 8092 B13R2.2931 O=C1ON(CO)c2ccccc21 Amb27178555 [0,2,0,0,0,0|1,0,0]=3 8093 B13R2.2931 O=CN1NC(=O)c2ccccc21 Amb27167808 [0,2,0,0,0,0|2,0,0]=4 8094 B13R2.2931 O=Cc1cn(O)c2ccccc12 Amb18830112 [0,2,0,0,0,0|2,0,0]=4 8095 B13R2.2931 O=Cc1sc(Cl)c2ccccc12 Amb22751324 [0,2,0,0,0,0|0,1,1]=4 8096 B13R2.2931 O=NC1=CC(=O)c2ccccc21 Amb28074744 [0,2,0,0,0,0|1,0,1]=4 8097 B13R2.45 CC1=C(C#N)Cc2ccccc21 Amb17778901 [0,2,0,0,0,0|2,0,0]=4 8098 B13R2.45 CC1=C(C=O)Cc2ccccc21 Amb25276375 [0,2,0,0,0,0|2,0,0]=4 8099 B13R2.45 CCC1=Cc2ccccc2C1=O Amb27177754 [0,2,0,0,0,0|1,0,1]=4 8100 B13R2.45 CCC1Cc2ccccc2C1=O Amb4605959 [0,2,0,0,0,0|1,0,0]=3 8101 B13R2.45 CCC1Cc2cccnc2C1=O Amb22750354 [0,2,0,0,0,0|2,0,0]=4 8102 B13R2.45 CCC1Nc2ccccc2C1=O Amb17594018 [0,2,0,0,0,0|2,0,0]=4 8103 B13R2.45 CCC1Oc2ccccc2C1=O Amb24061517 [0,2,0,0,0,0|2,0,0]=4 8104 B13R2.45 CCC1Sc2ccccc2C1=O Amb27612959 [0,2,0,0,0,0|2,0,0]=4 8105 B13R2.45 CCN1Cc2ccccc2C1=O Amb27400274 [0,2,0,0,0,0|1,0,0]=3 8106 B13R2.45 CCN1Cc2ccncc2C1=O Amb27228910 [0,2,0,0,0,0|2,0,0]=4 8107 B13R2.45 CCN1Nc2ccccc2C1=O Amb26871870 [0,2,0,0,0,0|2,0,0]=4 8108 B13R2.45 CCN1Sc2ccccc2C1=O Amb27977546 [0,2,0,0,0,0|2,0,0]=4 8109 B13R2.45 CC[C@@H]1Cc2ccccc2C1=O Amb27262889 [0,2,0,0,0,0|1,0,0]=3 8110 B13R2.45 COC1=Nc2ccccc2C1=O Amb28122389 [0,2,0,0,0,0|2,0,0]=4 8111 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,2,0,0,0,0|1,0,0]=3 8112 B13R2.45 CSC1Cc2ccccc2C1=O Amb28054308 [0,2,0,0,0,0|1,0,0]=3 8113 B13R2.45 C\C=C1/Cc2ccccc2C1=O Amb28076573 [0,2,0,0,0,0|1,0,0]=3 8114 B13R2.45 N#CC1=C(N)c2ccccc2C1 Amb9786087 [0,2,0,0,0,0|2,0,0]=4 8115 B13R2.45 N#CC1Cc2ccccc2C1=O Amb4012296 [0,2,0,0,0,0|1,0,0]=3 8116 B13R2.45 N#CC1Oc2ccccc2C1=O Amb18830409 [0,2,0,0,0,0|2,0,0]=4 8117 B13R2.45 NCC1=Cc2ccccc2C1=O Amb27466253 [0,2,0,0,0,0|1,0,1]=4 8118 B13R2.45 NCC1Cc2ccccc2C1=O Amb27857480 [0,2,0,0,0,0|1,0,0]=3 8119 B13R2.45 N\C=C1/Cc2ccccc2C1=O Amb26398787 [0,2,0,0,0,0|1,0,0]=3 8120 B13R2.45 N\C=C1\Cc2ccccc2C1=O Amb24553059 [0,2,0,0,0,0|1,0,0]=3 8121 B13R2.45 N\C=C1\Nc2ccccc2C1=O Amb2637551 [0,2,0,0,0,0|2,0,0]=4 8122 B13R2.45 N\C=C1\Sc2ccccc2C1=O Amb27959187 [0,2,0,0,0,0|2,0,0]=4 8123 B13R2.45 N\N=C1\Oc2ccccc2C1=O Amb28351488 [0,2,0,0,0,0|2,0,0]=4 8124 B13R2.45 O=C1C(CO)=Cc2ccccc21 Amb27805332 [0,2,0,0,0,0|1,0,1]=4 8125 B13R2.45 O=C1\C(=C/[O-])Cc2ccccc21 Amb28241911 [0,2,0,0,0,0|1,0,0]=3 8126 B13R2.45 O=C1\C(=C\Cl)Cc2ccccc21 Amb27865662 [0,2,0,0,0,0|1,0,0]=3 8127 B13R2.45 O=C1\C(=C\O)Nc2ccccc21 Amb27175913 [0,2,0,0,0,0|2,0,0]=4 8128 B13R2.45 O=C1\C(=C\[O-])Cc2ccccc21 Amb20669424 [0,2,0,0,0,0|1,0,0]=3 8129 B13R2.45 O=C1\C(=N/O)Cc2ccccc21 Amb2610323 [0,2,0,0,0,0|1,0,0]=3 8130 B13R2.45 O=C1\C(=N/O)Cc2cccnc21 Amb28198617 [0,2,0,0,0,0|2,0,0]=4 8131 B13R2.45 O=C1\C(=N\O)Cc2ccccc21 Amb22348033 [0,2,0,0,0,0|1,0,0]=3 8132 B13R2.45 O=C1c2ccccc2CN1CO Amb28188217 [0,2,0,0,0,0|1,0,0]=3 8133 B13R2.45 O=CC1Cc2cccnc2C1=O Amb33356129 [0,2,0,0,0,0|2,0,0]=4 8134 B13R2.45 O=CC1Sc2ccccc2C1=O Amb26578767 [0,2,0,0,0,0|2,0,0]=4 8135 B13R2.45 [N-]=[N+]=C1Cc2ccccc2C1=O Amb17593950 [0,2,0,0,0,0|1,0,0]=3 8136 B13R2.243 CC1(C)Cc2ccccc2C1=O Amb16191937 [0,2,0,0,0,0|1,0,0]=3 8137 B13R2.243 CC1(C)Nc2ccccc2C1=O Amb18829945 [0,2,0,0,0,0|2,0,0]=4 8138 B13R2.243 CC1(C)Oc2ccccc2C1=O Amb26849546 [0,2,0,0,0,0|2,0,0]=4 8139 B13R2.243 CC1(O)Cc2ccccc2C1=O Amb17778835 [0,2,0,0,0,0|1,0,0]=3 8140 B13R2.243 C[C@@]1(F)Cc2ccccc2C1=O Amb28253981 [0,2,0,0,0,0|1,0,0]=3 8141 B13R2.243 C[C@@]1(O)Cc2ccccc2C1=O Amb2612712 [0,2,0,0,0,0|1,0,0]=3 8142 B13R2.243 C[C@]1(F)Cc2ccccc2C1=O Amb28253952 [0,2,0,0,0,0|1,0,0]=3 8143 B13R2.243 C[C@]1(O)Cc2ccccc2C1=O Amb27175939 [0,2,0,0,0,0|1,0,0]=3 8144 B13R2.243 O=C1c2ccccc2CC1(Br)Br Amb2615303 [0,2,0,0,0,0|1,0,0]=3 8145 B13R2.243 O=C1c2ccccc2CC1(Cl)Cl Amb27855278 [0,2,0,0,0,0|1,0,0]=3 8146 B13R2.243 O=C1c2ccccc2CC1(F)F Amb22491976 [0,2,0,0,0,0|1,0,0]=3 8147 B13R2.3028 C=C1Cc2ccc(Br)cc2C1=O Amb18063783 [0,2,0,0,0,0|1,0,0]=3 8148 B13R2.3028 C=C1Cc2ccc(C)cc2C1=O Amb18561519 [0,2,0,0,0,0|1,0,0]=3 8149 B13R2.3028 C=C1Cc2ccc(Cl)cc2C1=O Amb18063782 [0,2,0,0,0,0|1,0,0]=3 8150 B13R2.3028 C=C1Cc2ccc(F)cc2C1=O Amb18063781 [0,2,0,0,0,0|1,0,0]=3 8151 B13R2.3028 CC1=Cc2ccc(Cl)cc2C1=O Amb22753539 [0,2,0,0,0,0|1,0,1]=4 8152 B13R2.3028 CC1Cc2ccc(Br)cc2C1=O Amb18063798 [0,2,0,0,0,0|1,0,0]=3 8153 B13R2.3028 CC1Cc2ccc(Cl)cc2C1=O Amb17233769 [0,2,0,0,0,0|1,0,0]=3 8154 B13R2.3028 CC1Cc2ccc(F)cc2C1=O Amb13883761 [0,2,0,0,0,0|1,0,0]=3 8155 B13R2.3028 CC1Cc2ccc(N)cc2C1=O Amb24442350 [0,2,0,0,0,0|1,0,0]=3 8156 B13R2.3028 CC1Oc2ccc(Br)cc2C1=O Amb25683716 [0,2,0,0,0,0|2,0,0]=4 8157 B13R2.3028 CC1Oc2ccc(Cl)cc2C1=O Amb19068160 [0,2,0,0,0,0|2,0,0]=4 8158 B13R2.3028 CC1Oc2ccc(F)cc2C1=O Amb18798518 [0,2,0,0,0,0|2,0,0]=4 8159 B13R2.3028 CC1Oc2ccc(N)cc2C1=O Amb33310032 [0,2,0,0,0,0|2,0,0]=4 8160 B13R2.3028 CN1Cc2ccc(Br)cc2C1=O Amb22500789 [0,2,0,0,0,0|1,0,0]=3 8161 B13R2.3028 CN1Cc2ccc(Cl)cc2C1=O Amb22500792 [0,2,0,0,0,0|1,0,0]=3 8162 B13R2.3028 CN1Cc2ccc(F)cc2C1=N Amb26563450 [0,2,0,0,0,0|2,0,0]=4 8163 B13R2.3028 CN1Cc2ccc(F)cc2C1=N Amb35788932 [0,2,0,0,0,0|2,0,0]=4 8164 B13R2.3028 CN1Cc2ccc(F)cc2C1=O Amb22500798 [0,2,0,0,0,0|1,0,0]=3 8165 B13R2.3028 CN1Cc2ccc(I)cc2C1=O Amb22500801 [0,2,0,0,0,0|1,0,0]=3 8166 B13R2.3028 CN1Cc2ccc(N)cc2C1=O Amb17483271 [0,2,0,0,0,0|1,0,0]=3 8167 B13R2.3028 CN1Cc2ccc(O)cc2C1=O Amb23443235 [0,2,0,0,0,0|1,0,0]=3 8168 B13R2.3028 CN1Cc2ncc(O)cc2C1=O Amb22886926 [0,2,0,0,0,0|2,0,0]=4 8169 B13R2.3028 CN1Nc2ccc(Cl)cc2C1=O Amb28315105 [0,2,0,0,0,0|2,0,0]=4 8170 B13R2.3028 CN1Oc2ccc(Br)cc2C1=O Amb24757038 [0,2,0,0,0,0|2,0,0]=4 8171 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)N2 Amb6355801 [0,2,0,0,0,0|2,0,0]=4 8172 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)O2 Amb27177687 [0,2,0,0,0,0|2,0,0]=4 8173 B13R2.3028 Cc1ccc2c(c1)C(=O)C(Br)C2 Amb17088027 [0,2,0,0,0,0|1,0,0]=3 8174 B13R2.3028 Cc1ccc2c(c1)C(=O)C(C)C2 Amb33547614 [0,2,0,0,0,0|1,0,0]=3 8175 B13R2.3028 Cc1ccc2c(c1)C(=O)C(Cl)=N2 Amb17594603 [0,2,0,0,0,0|2,0,0]=4 8176 B13R2.3028 Cc1ccc2c(c1)C(=O)C(N)C2 Amb17470417 [0,2,0,0,0,0|1,0,0]=3 8177 B13R2.3028 Cc1ccc2c(c1)C(=O)C(O)C2 Amb27606101 [0,2,0,0,0,0|1,0,0]=3 8178 B13R2.3028 NC1Cc2ccc(Br)cc2C1=O Amb27492751 [0,2,0,0,0,0|1,0,0]=3 8179 B13R2.3028 NC1Cc2ccc(Cl)cc2C1=O Amb17470643 [0,2,0,0,0,0|1,0,0]=3 8180 B13R2.3028 NC1Cc2ccc(F)cc2C1=O Amb17470452 [0,2,0,0,0,0|1,0,0]=3 8181 B13R2.3028 NN1Cc2ccc(Br)cc2C1=O Amb24395092 [0,2,0,0,0,0|1,0,0]=3 8182 B13R2.3028 NN1Cc2ccc(F)cc2C1=O Amb26493211 [0,2,0,0,0,0|1,0,0]=3 8183 B13R2.3028 Nc1ccc2c(c1)C(=O)C(=O)N2 Amb6298390 [0,2,0,0,0,0|2,0,0]=4 8184 B13R2.3028 O=C1C(Br)=Cc2ccc(Br)cc21 Amb28138101 [0,2,0,0,0,0|1,0,1]=4 8185 B13R2.3028 O=C1C(Cl)=Nc2ccc(Br)cc21 Amb4430940 [0,2,0,0,0,0|2,0,0]=4 8186 B13R2.3028 O=C1C(O)=Nc2ccc(Br)cc21 Amb1351906 [0,2,0,0,0,0|2,0,0]=4 8187 B13R2.3028 O=C1C(O)=Nc2ccc(F)cc21 Amb19860944 [0,2,0,0,0,0|2,0,0]=4 8188 B13R2.3028 O=C1Nc2ccc(Br)cc2C1=O Amb6364736 [0,2,0,0,0,0|2,0,0]=4 8189 B13R2.3028 O=C1Nc2ccc(Cl)cc2C1=O Amb6335221 [0,2,0,0,0,0|2,0,0]=4 8190 B13R2.3028 O=C1Nc2ccc(F)cc2C1=O Amb6315494 [0,2,0,0,0,0|2,0,0]=4 8191 B13R2.3028 O=C1Nc2ccc(I)cc2C1=O Amb1038277 [0,2,0,0,0,0|2,0,0]=4 8192 B13R2.3028 O=C1Nc2ccc(O)cc2C1=O Amb33544078 [0,2,0,0,0,0|2,0,0]=4 8193 B13R2.3028 O=C1Sc2ccc(Cl)cc2C1=O Amb27606006 [0,2,0,0,0,0|2,0,0]=4 8194 B13R2.3028 O=C1c2cc(Br)ccc2CC1Br Amb26995810 [0,2,0,0,0,0|1,0,0]=3 8195 B13R2.3028 O=C1c2cc(Br)ccc2OC1Br Amb22735818 [0,2,0,0,0,0|2,0,0]=4 8196 B13R2.3028 O=C1c2cc(Cl)ccc2CC1Br Amb17088029 [0,2,0,0,0,0|1,0,0]=3 8197 B13R2.3028 O=C1c2cc(Cl)ccc2CC1Cl Amb27827399 [0,2,0,0,0,0|1,0,0]=3 8198 B13R2.3028 O=C1c2cc(Cl)ccc2CN1Cl Amb27640153 [0,2,0,0,0,0|1,0,0]=3 8199 B13R2.3028 O=C1c2cc(F)ccc2CC1Br Amb17088028 [0,2,0,0,0,0|1,0,0]=3 8200 B13R2.3028 O=C1c2cc(F)ccc2CC1I Amb24471390 [0,2,0,0,0,0|1,0,0]=3 8201 B13R2.3028 O=C1c2cc(F)ccc2CN1Cl Amb27240647 [0,2,0,0,0,0|1,0,0]=3 8202 B13R2.3028 O=C1c2cc(F)ccc2OC1Br Amb22735496 [0,2,0,0,0,0|2,0,0]=4 8203 B13R2.3085 C=C1c2ccccc2C(O)C1C Amb27615507 [0,2,0,0,0,0|2,0,0]=4 8204 B13R2.3085 CC1=C(C)c2ccccc2C1=O Amb27177578 [0,2,0,0,0,0|1,0,1]=4 8205 B13R2.3085 CC1=C(N)c2ccccc2C1=O Amb28127184 [0,2,0,0,0,0|1,0,1]=4 8206 B13R2.3085 CC1C(=N)c2ccccc2C1=O Amb27177779 [0,2,0,0,0,0|1,0,1]=4 8207 B13R2.3085 CC1C(=O)c2ccccc2C1=O Amb4009534 [0,2,0,0,0,0|1,0,1]=4 8208 B13R2.3085 CC1C(=O)c2ccccc2C1Cl Amb27865661 [0,2,0,0,0,0|1,0,0]=3 8209 B13R2.3085 CC1C(N)c2ccccc2S1=O Amb18805328 [0,2,0,0,0,0|2,0,0]=4 8210 B13R2.3085 CC1c2ccccc2C(=O)C1O Amb27770302 [0,2,0,0,0,0|1,0,0]=3 8211 B13R2.3085 CN1C(=O)C(=O)c2ccccc21 Amb6335574 [0,2,0,0,0,0|2,0,0]=4 8212 B13R2.3085 CN1C(=O)c2ccccc2C1=O Amb5794489 [0,2,0,0,0,0|1,0,1]=4 8213 B13R2.3085 CN1C(=O)c2ccccc2C1O Amb1155091 [0,2,0,0,0,0|1,0,0]=3 8214 B13R2.3085 CN1C(=O)c2cccnc2C1O Amb27834316 [0,2,0,0,0,0|2,0,0]=4 8215 B13R2.3085 CN1C(=O)c2ncccc2C1N Amb28076098 [0,2,0,0,0,0|2,0,0]=4 8216 B13R2.3085 CN1c2ccccc2C(=O)C1O Amb27164622 [0,2,0,0,0,0|2,0,0]=4 8217 B13R2.3085 C[C@@H]1C(=O)c2ccccc2[C@H]1C Amb27195793 [0,2,0,0,0,0|1,0,0]=3 8218 B13R2.3085 N=C1C(=O)c2ccccc2C1=O Amb27176138 [0,2,0,0,0,0|1,0,1]=4 8219 B13R2.3085 N=C1c2ccccc2C(=O)C1N Amb27860216 [0,2,0,0,0,0|1,0,1]=4 8220 B13R2.3085 NC1C(=O)c2ccccc2C1=O Amb18645446 [0,2,0,0,0,0|1,0,1]=4 8221 B13R2.3085 NC1C(=O)c2ccccc2C1O Amb25700423 [0,2,0,0,0,0|1,0,0]=3 8222 B13R2.3085 NC1c2ccccc2C(=O)C1Cl Amb27856270 [0,2,0,0,0,0|1,0,0]=3 8223 B13R2.3085 NC1c2ccccc2C(=O)C1O Amb28293154 [0,2,0,0,0,0|1,0,0]=3 8224 B13R2.3085 NN1C(=O)c2ccccc2C1=O Amb1151859 [0,2,0,0,0,0|1,0,1]=4 8225 B13R2.3085 N[C@H]1c2ccccc2C(=O)[C@@H]1Br Amb27626955 [0,2,0,0,0,0|1,0,0]=3 8226 B13R2.3085 O=C1C(=O)N(Cl)c2ccccc21 Amb2720848 [0,2,0,0,0,0|2,0,0]=4 8227 B13R2.3085 O=C1C(=O)N(O)c2ccccc21 Amb27177861 [0,2,0,0,0,0|2,0,0]=4 8228 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [0,2,0,0,0,0|1,0,1]=4 8229 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [0,2,0,0,0,0|1,0,1]=4 8230 B13R2.3085 O=C1c2ccccc2C(=O)C1Br Amb10071900 [0,2,0,0,0,0|1,0,1]=4 8231 B13R2.3085 O=C1c2ccccc2C(=O)C1Cl Amb19988287 [0,2,0,0,0,0|1,0,1]=4 8232 B13R2.3085 O=C1c2ccccc2C(=O)N1Br Amb6296045 [0,2,0,0,0,0|1,0,1]=4 8233 B13R2.3085 O=C1c2ccccc2C(=O)N1O Amb1351864 [0,2,0,0,0,0|1,0,1]=4 8234 B13R2.3085 O=C1c2ccccc2C(=O)N1[K] Amb21520437 [0,2,0,0,0,0|1,0,1]=4 8235 B13R2.4825 C=C1Cc2c(Br)cccc2C1=O Amb18063784 [0,2,0,0,0,0|1,0,0]=3 8236 B13R2.4825 C=C1Cc2c(C)cccc2C1=O Amb18063786 [0,2,0,0,0,0|1,0,0]=3 8237 B13R2.4825 C=C1Cc2c(Cl)cccc2C1=O Amb18063771 [0,2,0,0,0,0|1,0,0]=3 8238 B13R2.4825 C=C1Cc2c(F)cccc2C1=O Amb18063726 [0,2,0,0,0,0|1,0,0]=3 8239 B13R2.4825 CC1=Cc2c(F)cccc2C1=O Amb28202100 [0,2,0,0,0,0|1,0,1]=4 8240 B13R2.4825 CC1Cc2c(Br)cccc2C1=O Amb16187179 [0,2,0,0,0,0|1,0,0]=3 8241 B13R2.4825 CC1Cc2c(Cl)cccc2C1=O Amb17233770 [0,2,0,0,0,0|1,0,0]=3 8242 B13R2.4825 CC1Cc2c(F)cccc2C1=O Amb17232465 [0,2,0,0,0,0|1,0,0]=3 8243 B13R2.4825 CC1Oc2c(Cl)cccc2C1=O Amb18325737 [0,2,0,0,0,0|2,0,0]=4 8244 B13R2.4825 CC1Oc2c(F)cccc2C1=O Amb18798517 [0,2,0,0,0,0|2,0,0]=4 8245 B13R2.4825 CC1Oc2c(N)cccc2C1=O Amb33310033 [0,2,0,0,0,0|2,0,0]=4 8246 B13R2.4825 CN1Cc2c(Br)cccc2C1=O Amb15693066 [0,2,0,0,0,0|1,0,0]=3 8247 B13R2.4825 CN1Cc2c(Cl)cccc2C1=O Amb22500797 [0,2,0,0,0,0|1,0,0]=3 8248 B13R2.4825 CN1Cc2c(Cl)ccnc2C1=O Amb32680087 [0,2,0,0,0,0|2,0,0]=4 8249 B13R2.4825 CN1Cc2c(F)cccc2C1=O Amb22500794 [0,2,0,0,0,0|1,0,0]=3 8250 B13R2.4825 CN1Cc2c(F)ccnc2C1=O Amb32680116 [0,2,0,0,0,0|2,0,0]=4 8251 B13R2.4825 CN1Cc2c(I)cccc2C1=O Amb22500803 [0,2,0,0,0,0|1,0,0]=3 8252 B13R2.4825 CN1Cc2c(N)cccc2C1=O Amb17483371 [0,2,0,0,0,0|1,0,0]=3 8253 B13R2.4825 CN1Cc2c(O)cccc2C1=O Amb27813579 [0,2,0,0,0,0|1,0,0]=3 8254 B13R2.4825 CN1Oc2c(Br)cccc2C1=O Amb27225165 [0,2,0,0,0,0|2,0,0]=4 8255 B13R2.4825 Cc1cccc2c1CC(Br)C2=O Amb17088033 [0,2,0,0,0,0|1,0,0]=3 8256 B13R2.4825 Cc1cccc2c1CC(C)C2=O Amb17232325 [0,2,0,0,0,0|1,0,0]=3 8257 B13R2.4825 Cc1cccc2c1CC(N)C2=O Amb17470418 [0,2,0,0,0,0|1,0,0]=3 8258 B13R2.4825 Cc1cccc2c1CC(O)C2=O Amb27948632 [0,2,0,0,0,0|1,0,0]=3 8259 B13R2.4825 Cc1cccc2c1NC(=O)C2=O Amb6315565 [0,2,0,0,0,0|2,0,0]=4 8260 B13R2.4825 Cc1cccc2c1OC(C)C2=O Amb18798089 [0,2,0,0,0,0|2,0,0]=4 8261 B13R2.4825 NC1Cc2c(Br)cccc2C1=O Amb27632732 [0,2,0,0,0,0|1,0,0]=3 8262 B13R2.4825 NC1Cc2c(Cl)cccc2C1=O Amb17470644 [0,2,0,0,0,0|1,0,0]=3 8263 B13R2.4825 NC1Cc2c(Cl)cccc2C1=O Amb32652405 [0,2,0,0,0,0|1,0,0]=3 8264 B13R2.4825 NC1Cc2c(F)cccc2C1=O Amb17470453 [0,2,0,0,0,0|1,0,0]=3 8265 B13R2.4825 NN1Cc2c(F)cccc2C1=O Amb28437129 [0,2,0,0,0,0|1,0,0]=3 8266 B13R2.4825 NN1Cc2c(I)cccc2C1=O Amb27841530 [0,2,0,0,0,0|1,0,0]=3 8267 B13R2.4825 Nc1cccc2c1NC(=O)C2=O Amb27243910 [0,2,0,0,0,0|2,0,0]=4 8268 B13R2.4825 O=C1Cc2c(F)cccc2C1=O Amb28127142 [0,2,0,0,0,0|1,0,0]=3 8269 B13R2.4825 O=C1Nc2c(Br)cccc2C1=O Amb1103377 [0,2,0,0,0,0|2,0,0]=4 8270 B13R2.4825 O=C1Nc2c(Cl)cccc2C1=O Amb6486658 [0,2,0,0,0,0|2,0,0]=4 8271 B13R2.4825 O=C1Nc2c(F)cccc2C1=O Amb6549905 [0,2,0,0,0,0|2,0,0]=4 8272 B13R2.4825 O=C1Nc2c(I)cccc2C1=O Amb33543163 [0,2,0,0,0,0|2,0,0]=4 8273 B13R2.4825 O=C1Nc2c(O)cccc2C1=O Amb27590902 [0,2,0,0,0,0|2,0,0]=4 8274 B13R2.4825 O=C1Sc2c(Br)cccc2C1=O Amb27624710 [0,2,0,0,0,0|2,0,0]=4 8275 B13R2.4825 O=C1Sc2c(Cl)cccc2C1=O Amb28435410 [0,2,0,0,0,0|2,0,0]=4 8276 B13R2.4825 O=C1c2cccc(Br)c2CC1I Amb24659630 [0,2,0,0,0,0|1,0,0]=3 8277 B13R2.4825 O=C1c2cccc(Br)c2OC1Br Amb22737718 [0,2,0,0,0,0|2,0,0]=4 8278 B13R2.4825 O=C1c2cccc(Cl)c2CC1Br Amb17088036 [0,2,0,0,0,0|1,0,0]=3 8279 B13R2.4825 O=C1c2cccc(Cl)c2CN1Cl Amb27239742 [0,2,0,0,0,0|1,0,0]=3 8280 B13R2.4825 O=C1c2cccc(F)c2CC1Br Amb17088035 [0,2,0,0,0,0|1,0,0]=3 8281 B13R2.4825 O=C1c2cccc(F)c2CC1Cl Amb27649349 [0,2,0,0,0,0|1,0,0]=3 8282 B13R2.4825 O=C1c2cccc(F)c2CC1O Amb27854296 [0,2,0,0,0,0|1,0,0]=3 8283 B13R2.4825 O=C1c2cccc(F)c2CN1Br Amb28251274 [0,2,0,0,0,0|1,0,0]=3 8284 B13R2.4825 O=C1c2cccc(F)c2OC1Br Amb22739459 [0,2,0,0,0,0|2,0,0]=4 8285 B13R2.4856 CC1Cc2cccc(Br)c2C1=O Amb20620513 [0,2,0,0,0,0|1,0,0]=3 8286 B13R2.4856 CC1Cc2cccc(Cl)c2C1=O Amb20620748 [0,2,0,0,0,0|1,0,0]=3 8287 B13R2.4856 CC1Cc2cccc(F)c2C1=O Amb20621294 [0,2,0,0,0,0|1,0,0]=3 8288 B13R2.4856 CC1Cc2cccc(I)c2C1=O Amb27241092 [0,2,0,0,0,0|1,0,0]=3 8289 B13R2.4856 CN1Cc2cccc(Br)c2C1=O Amb22500799 [0,2,0,0,0,0|1,0,0]=3 8290 B13R2.4856 CN1Cc2cccc(Cl)c2C1=O Amb22500796 [0,2,0,0,0,0|1,0,0]=3 8291 B13R2.4856 CN1Cc2cccc(F)c2C1=O Amb22500793 [0,2,0,0,0,0|1,0,0]=3 8292 B13R2.4856 CN1Cc2cccc(I)c2C1=O Amb22500802 [0,2,0,0,0,0|1,0,0]=3 8293 B13R2.4856 CN1Cc2cccc(N)c2C1=O Amb22737063 [0,2,0,0,0,0|1,0,0]=3 8294 B13R2.4856 CN1Nc2cccc(Br)c2C1=O Amb26932474 [0,2,0,0,0,0|2,0,0]=4 8295 B13R2.4856 Cc1cccc2c1C(=O)C(=O)N2 Amb4140113 [0,2,0,0,0,0|2,0,0]=4 8296 B13R2.4856 Cc1cccc2c1C(=O)C(C)C2 Amb27176168 [0,2,0,0,0,0|1,0,0]=3 8297 B13R2.4856 Cc1cccc2c1C(=O)C(Cl)=N2 Amb17594602 [0,2,0,0,0,0|2,0,0]=4 8298 B13R2.4856 NN1Cc2cccc(Cl)c2C1=O Amb28255477 [0,2,0,0,0,0|1,0,0]=3 8299 B13R2.4856 NN1Cc2cccc(F)c2C1=O Amb27470930 [0,2,0,0,0,0|1,0,0]=3 8300 B13R2.4856 NN1Cc2cccc(I)c2C1=O Amb27950559 [0,2,0,0,0,0|1,0,0]=3 8301 B13R2.4856 Nc1cccc2c1C(=O)C(=O)N2 Amb27974583 [0,2,0,0,0,0|2,0,0]=4 8302 B13R2.4856 O=C1C(Cl)=Nc2cccc(Cl)c21 Amb17595294 [0,2,0,0,0,0|2,0,0]=4 8303 B13R2.4856 O=C1Nc2cccc(Br)c2C1=O Amb6374120 [0,2,0,0,0,0|2,0,0]=4 8304 B13R2.4856 O=C1Nc2cccc(Cl)c2C1=O Amb4017458 [0,2,0,0,0,0|2,0,0]=4 8305 B13R2.4856 O=C1Nc2cccc(F)c2C1=O Amb8397161 [0,2,0,0,0,0|2,0,0]=4 8306 B13R2.4856 O=C1Nc2cccc(I)c2C1=O Amb8629770 [0,2,0,0,0,0|2,0,0]=4 8307 B13R2.4856 O=C1c2c(Br)cccc2OC1Br Amb22737719 [0,2,0,0,0,0|2,0,0]=4 8308 B13R2.4856 O=C1c2c(Cl)cccc2CN1Br Amb27450272 [0,2,0,0,0,0|1,0,0]=3 8309 B13R2.4856 O=C1c2c(F)cccc2CC1Br Amb28185911 [0,2,0,0,0,0|1,0,0]=3 8310 B13R2.4856 O=C1c2c(F)cccc2CC1I Amb25864339 [0,2,0,0,0,0|1,0,0]=3 8311 B13R2.4856 O=C1c2c(F)cccc2OC1Br Amb22735515 [0,2,0,0,0,0|2,0,0]=4 8312 B13R2.4856 O=C1c2c(I)cccc2CN1Br Amb27463063 [0,2,0,0,0,0|1,0,0]=3 8313 B13R2.5190 CC1=C(C)c2ccc(N)cc2C1 Amb27233481 [0,2,0,0,0,0|2,0,0]=4 8314 B13R2.5190 CC1=Cc2cc(O)ccc2C1=O Amb27177971 [0,2,0,0,0,0|1,0,1]=4 8315 B13R2.5190 CC1Cc2cc(Br)ccc2C1=O Amb20620512 [0,2,0,0,0,0|1,0,0]=3 8316 B13R2.5190 CC1Cc2cc(Cl)ccc2C1=O Amb20620749 [0,2,0,0,0,0|1,0,0]=3 8317 B13R2.5190 CC1Cc2cc(F)ccc2C1=O Amb8390791 [0,2,0,0,0,0|1,0,0]=3 8318 B13R2.5190 CC1Cc2cc(N)ccc2C1=O Amb25062276 [0,2,0,0,0,0|1,0,0]=3 8319 B13R2.5190 CC1Cc2cc(O)ccc2C1=O Amb2708656 [0,2,0,0,0,0|1,0,0]=3 8320 B13R2.5190 CC1Oc2cc(Cl)ccc2C1=O Amb27239410 [0,2,0,0,0,0|2,0,0]=4 8321 B13R2.5190 CC1Oc2cc(F)ccc2C1=O Amb33550779 [0,2,0,0,0,0|2,0,0]=4 8322 B13R2.5190 CC1Sc2cc(F)ccc2C1=O Amb27419853 [0,2,0,0,0,0|2,0,0]=4 8323 B13R2.5190 CN1Cc2cc(Br)ccc2C1=O Amb15693065 [0,2,0,0,0,0|1,0,0]=3 8324 B13R2.5190 CN1Cc2cc(Br)cnc2C1=O Amb22886762 [0,2,0,0,0,0|2,0,0]=4 8325 B13R2.5190 CN1Cc2cc(Cl)ccc2C1=O Amb22500795 [0,2,0,0,0,0|1,0,0]=3 8326 B13R2.5190 CN1Cc2cc(F)ccc2C1=O Amb22500804 [0,2,0,0,0,0|1,0,0]=3 8327 B13R2.5190 CN1Cc2cc(I)ccc2C1=O Amb22500800 [0,2,0,0,0,0|1,0,0]=3 8328 B13R2.5190 CN1Cc2cc(N)ccc2C1=O Amb21960556 [0,2,0,0,0,0|1,0,0]=3 8329 B13R2.5190 CN1Cc2cc(O)ccc2C1=O Amb18645797 [0,2,0,0,0,0|1,0,0]=3 8330 B13R2.5190 CN1Nc2cc(Br)ccc2C1=O Amb27603585 [0,2,0,0,0,0|2,0,0]=4 8331 B13R2.5190 CN1Nc2cc(Cl)ccc2C1=O Amb27241381 [0,2,0,0,0,0|2,0,0]=4 8332 B13R2.5190 Cc1ccc2c(c1)CC(N)C2=O Amb24388963 [0,2,0,0,0,0|1,0,0]=3 8333 B13R2.5190 Cc1ccc2c(c1)N=C(Cl)C2=O Amb17594604 [0,2,0,0,0,0|2,0,0]=4 8334 B13R2.5190 Cc1ccc2c(c1)NC(=O)C2=O Amb1887200 [0,2,0,0,0,0|2,0,0]=4 8335 B13R2.5190 Cc1ccc2c(c1)OC(C)C2=O Amb26868636 [0,2,0,0,0,0|2,0,0]=4 8336 B13R2.5190 Cc1ccc2c(c1)SC(=O)C2=O Amb28144149 [0,2,0,0,0,0|2,0,0]=4 8337 B13R2.5190 NC1Cc2cc(Cl)ccc2C1=O Amb27632482 [0,2,0,0,0,0|1,0,0]=3 8338 B13R2.5190 NC1Cc2cc(F)ccc2C1=O Amb27644345 [0,2,0,0,0,0|1,0,0]=3 8339 B13R2.5190 NC1Cc2cc(O)ccc2C1=O Amb24635608 [0,2,0,0,0,0|1,0,0]=3 8340 B13R2.5190 O=C1C(Cl)=Nc2cc(Cl)ccc21 Amb17595295 [0,2,0,0,0,0|2,0,0]=4 8341 B13R2.5190 O=C1Cc2cc(F)ccc2C1=O Amb27416492 [0,2,0,0,0,0|1,0,0]=3 8342 B13R2.5190 O=C1Nc2cc(Br)ccc2C1=O Amb6374119 [0,2,0,0,0,0|2,0,0]=4 8343 B13R2.5190 O=C1Nc2cc(Cl)ccc2C1=O Amb2786130 [0,2,0,0,0,0|2,0,0]=4 8344 B13R2.5190 O=C1Nc2cc(F)ccc2C1=O Amb1155086 [0,2,0,0,0,0|2,0,0]=4 8345 B13R2.5190 O=C1Nc2cc(I)ccc2C1=O Amb8629769 [0,2,0,0,0,0|2,0,0]=4 8346 B13R2.5190 O=C1Nc2cc(O)ccc2C1=O Amb6306510 [0,2,0,0,0,0|2,0,0]=4 8347 B13R2.5190 O=C1Sc2cc(Br)ccc2C1=O Amb26472295 [0,2,0,0,0,0|2,0,0]=4 8348 B13R2.5190 O=C1c2ccc(Br)cc2CC1Br Amb27593381 [0,2,0,0,0,0|1,0,0]=3 8349 B13R2.5190 O=C1c2ccc(Br)cc2CC1Cl Amb27760781 [0,2,0,0,0,0|1,0,0]=3 8350 B13R2.5190 O=C1c2ccc(Br)cc2CC1I Amb25315411 [0,2,0,0,0,0|1,0,0]=3 8351 B13R2.5190 O=C1c2ccc(Br)cc2OC1Br Amb22735817 [0,2,0,0,0,0|2,0,0]=4 8352 B13R2.5190 O=C1c2ccc(F)cc2CC1O Amb28120472 [0,2,0,0,0,0|1,0,0]=3 8353 B13R2.5190 O=C1c2ccc(F)cc2CN1Br Amb27400991 [0,2,0,0,0,0|1,0,0]=3 8354 B13R2.5190 O=C1c2ccc(F)cc2OC1Br Amb22739426 [0,2,0,0,0,0|2,0,0]=4 8355 B13R2.5190 O=C1c2ccc(I)cc2CN1Cl Amb28048543 [0,2,0,0,0,0|1,0,0]=3 8356 B13R2.669 C=Cc1ccc2c(c1)B(O)OC2 Amb26024814 [0,2,0,0,0,0|1,0,1]=4 8357 B13R2.669 C=Cc1ccc2c(c1)C(=O)NO2 Amb24497710 [0,2,0,0,0,0|2,0,0]=4 8358 B13R2.669 CCc1ccc2c(c1)C(=O)CC2 Amb17087888 [0,2,0,0,0,0|1,0,0]=3 8359 B13R2.669 CCc1ccc2c(c1)C(=O)CN2 Amb18829949 [0,2,0,0,0,0|2,0,0]=4 8360 B13R2.669 CCc1ccc2c(c1)C(=O)CO2 Amb9372571 [0,2,0,0,0,0|2,0,0]=4 8361 B13R2.669 CCc1ccc2c(c1)C(=O)CS2 Amb18824834 [0,2,0,0,0,0|2,0,0]=4 8362 B13R2.669 CCc1ccc2c(c1)C(=O)OC2 Amb27603450 [0,2,0,0,0,0|0,0,0]=2 8363 B13R2.669 CNc1ccc2c(c1)C(=O)NC2 Amb27178926 [0,2,0,0,0,0|1,0,0]=3 8364 B13R2.669 COc1ccc2c(c1)B(O)OC2 Amb27213215 [0,2,0,0,0,0|1,0,1]=4 8365 B13R2.669 COc1ccc2c(c1)C(=O)C=C2 Amb27596573 [0,2,0,0,0,0|1,0,1]=4 8366 B13R2.669 COc1ccc2c(c1)C(=O)CC2 Amb2383533 [0,2,0,0,0,0|1,0,0]=3 8367 B13R2.669 COc1ccc2c(c1)C(=O)CN2 Amb18829473 [0,2,0,0,0,0|2,0,0]=4 8368 B13R2.669 COc1ccc2c(c1)C(=O)CO2 Amb33534387 [0,2,0,0,0,0|2,0,0]=4 8369 B13R2.669 COc1ccc2c(c1)C(=O)CS2 Amb18824510 [0,2,0,0,0,0|2,0,0]=4 8370 B13R2.669 COc1ccc2c(c1)C(=O)NC2 Amb17942823 [0,2,0,0,0,0|1,0,0]=3 8371 B13R2.669 COc1ccc2c(c1)C(=O)OC2 Amb2692666 [0,2,0,0,0,0|0,0,0]=2 8372 B13R2.669 COc1ccc2c(c1)C(=S)CC2 Amb27450892 [0,2,0,0,0,0|1,1,0]=4 8373 B13R2.669 COc1ccc2c(c1)C(C)=CC2 Amb32671214 [0,2,0,0,0,0|2,0,0]=4 8374 B13R2.669 COc1ccc2noc(C)c2c1 Amb27756411 [0,2,0,0,0,0|2,0,0]=4 8375 B13R2.669 COc1ccc2noc(N)c2c1 Amb27391652 [0,2,0,0,0,0|2,0,0]=4 8376 B13R2.669 COc1cnc2c(c1)C(=O)OC2 Amb27641863 [0,2,0,0,0,0|1,0,0]=3 8377 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 Amb22336964 [0,2,0,0,0,0|1,0,0]=3 8378 B13R2.669 Cc1onc2ccc(C#N)cc12 Amb28280806 [0,2,0,0,0,0|2,0,0]=4 8379 B13R2.669 Cc1onc2ccc(C=O)cc12 Amb18830114 [0,2,0,0,0,0|2,0,0]=4 8380 B13R2.669 N#Cc1ccc2c(c1)B(O)OC2 Amb26650119 [0,2,0,0,0,0|1,0,1]=4 8381 B13R2.669 N#Cc1ccc2c(c1)C(=O)CC2 Amb8388405 [0,2,0,0,0,0|1,0,0]=3 8382 B13R2.669 N#Cc1ccc2c(c1)C(=O)CO2 Amb24089256 [0,2,0,0,0,0|2,0,0]=4 8383 B13R2.669 N#Cc1ccc2c(c1)C(=O)N=N2 Amb28455623 [0,2,0,0,0,0|2,0,0]=4 8384 B13R2.669 N#Cc1ccc2c(c1)C(=O)NC2 Amb20171554 [0,2,0,0,0,0|1,0,0]=3 8385 B13R2.669 N#Cc1ccc2c(c1)C(=O)OC2 Amb16232977 [0,2,0,0,0,0|0,0,0]=2 8386 B13R2.669 N#Cc1ccc2noc(N)c2c1 Amb28119927 [0,2,0,0,0,0|2,0,0]=4 8387 B13R2.669 N#Cc1cnc2c(c1)C(=O)CC2 Amb27815678 [0,2,0,0,0,0|2,0,0]=4 8388 B13R2.669 NCc1ccc2c(c1)B(O)OC2 Amb25152395 [0,2,0,0,0,0|1,0,1]=4 8389 B13R2.669 NCc1ccc2c(c1)C(=O)CC2 Amb22169416 [0,2,0,0,0,0|1,0,0]=3 8390 B13R2.669 NCc1ccc2c(c1)C(=O)N=N2 Amb28207283 [0,2,0,0,0,0|2,0,0]=4 8391 B13R2.669 NCc1ccc2c(c1)C(=O)NC2 Amb21961256 [0,2,0,0,0,0|1,0,0]=3 8392 B13R2.669 NCc1ccc2c(c1)C(=O)NC2 Amb22500432 [0,2,0,0,0,0|1,0,0]=3 8393 B13R2.669 NNc1ccc2c(c1)C(=O)OC2 Amb6752518 [0,2,0,0,0,0|0,0,0]=2 8394 B13R2.669 O=C1NCc2ccc(CO)cc21 Amb27966225 [0,2,0,0,0,0|1,0,0]=3 8395 B13R2.669 O=Cc1ccc2c(c1)B(O)OC2 Amb24713438 [0,2,0,0,0,0|1,0,1]=4 8396 B13R2.669 O=Cc1ccc2c(c1)C(=O)N=C2 Amb22015325 [0,2,0,0,0,0|1,0,1]=4 8397 B13R2.669 O=Cc1ccc2c(c1)C(=O)NO2 Amb25860944 [0,2,0,0,0,0|2,0,0]=4 8398 B13R2.669 O=Cc1ccc2c(c1)C(=O)OC2 Amb28397991 [0,2,0,0,0,0|0,0,0]=2 8399 B13R2.669 OCc1ccc2c(c1)B(O)OC2 Amb24403094 [0,2,0,0,0,0|1,0,1]=4 8400 B13R2.3742 Cc1cc(Br)c2c(c1)C(=O)CC2 Amb22753544 [0,2,0,0,0,0|1,0,0]=3 8401 B13R2.3742 Cc1cc(Br)c2c(c1)C(=O)CO2 Amb9372558 [0,2,0,0,0,0|2,0,0]=4 8402 B13R2.3742 Cc1cc(Br)c2c(c1)C(=O)NC2 Amb27222561 [0,2,0,0,0,0|1,0,0]=3 8403 B13R2.3742 Cc1cc(Br)c2c(c1)C(=O)NS2 Amb32710029 [0,2,0,0,0,0|2,0,0]=4 8404 B13R2.3742 Cc1cc(Br)cc2c1CCC2=O Amb26372546 [0,2,0,0,0,0|1,0,0]=3 8405 B13R2.3742 Cc1cc(Br)nc2c1CCC2=O Amb22750320 [0,2,0,0,0,0|2,0,0]=4 8406 B13R2.3742 Cc1cc(C)c2c(c1)C(=O)CC2 Amb18787958 [0,2,0,0,0,0|1,0,0]=3 8407 B13R2.3742 Cc1cc(C)c2c(c1)C(=O)SN2 Amb32673863 [0,2,0,0,0,0|1,1,0]=4 8408 B13R2.3742 Cc1cc(Cl)c2c(c1)C(=O)CC2 Amb22753086 [0,2,0,0,0,0|1,0,0]=3 8409 B13R2.3742 Cc1cc(Cl)c2c(c1)C(=O)CO2 Amb18325738 [0,2,0,0,0,0|2,0,0]=4 8410 B13R2.3742 Cc1cc(Cl)cc2c1CCC2=O Amb22753083 [0,2,0,0,0,0|1,0,0]=3 8411 B13R2.3742 Cc1cc(Cl)cc2c1OCC2=O Amb9372547 [0,2,0,0,0,0|2,0,0]=4 8412 B13R2.3742 Cc1cc(Cl)nc2c1CCC2=O Amb22750314 [0,2,0,0,0,0|2,0,0]=4 8413 B13R2.3742 Cc1cc(F)c2c(c1)C(=O)CC2 Amb27175536 [0,2,0,0,0,0|1,0,0]=3 8414 B13R2.3742 Cc1cc(F)cc2c1CCC2=O Amb16232966 [0,2,0,0,0,0|1,0,0]=3 8415 B13R2.3742 Cc1cc(F)cc2c1SCC2=O Amb18823726 [0,2,0,0,0,0|2,0,0]=4 8416 B13R2.3742 Cc1cc(I)c2c(c1)C(=O)CC2 Amb27641250 [0,2,0,0,0,0|1,0,0]=3 8417 B13R2.3742 Cc1cc(I)cc2c1ONC2=O Amb28280629 [0,2,0,0,0,0|2,0,0]=4 8418 B13R2.3742 Cc1cc(N)c2c(c1)C(=O)CC2 Amb28047069 [0,2,0,0,0,0|1,0,0]=3 8419 B13R2.3742 Cc1cc(N)c2c(c1)C(=O)NC2 Amb27984124 [0,2,0,0,0,0|1,0,0]=3 8420 B13R2.3742 Cc1cc(N)cc2c1CCC2=O Amb27831965 [0,2,0,0,0,0|1,0,0]=3 8421 B13R2.3742 Cc1cc(O)c2c(c1)C(=O)CC2 Amb28203321 [0,2,0,0,0,0|1,0,0]=3 8422 B13R2.3742 Cc1cc(O)cc2c1CCC2=O Amb26953189 [0,2,0,0,0,0|1,0,0]=3 8423 B13R2.3742 Nc1cc(Br)c2c(c1)C(=O)OC2 Amb18160598 [0,2,0,0,0,0|0,0,0]=2 8424 B13R2.3742 Nc1cc(Br)cc2c1CCC2=O Amb27171338 [0,2,0,0,0,0|1,0,0]=3 8425 B13R2.3742 Nc1cc(Br)cc2c1COC2=O Amb18160600 [0,2,0,0,0,0|0,0,0]=2 8426 B13R2.3742 Nc1cc(Cl)c2c(c1)B(O)OC2 Amb27393632 [0,2,0,0,0,0|1,0,1]=4 8427 B13R2.3742 Nc1cc(Cl)c2c(c1)C(=O)CC2 Amb28137749 [0,2,0,0,0,0|1,0,0]=3 8428 B13R2.3742 Nc1cc(Cl)c2c(c1)C(=O)CO2 Amb27398495 [0,2,0,0,0,0|2,0,0]=4 8429 B13R2.3742 Nc1cc(Cl)c2c(c1)C(=O)OC2 Amb25844711 [0,2,0,0,0,0|0,0,0]=2 8430 B13R2.3742 Nc1cc(Cl)cc2c1COB2O Amb27399520 [0,2,0,0,0,0|1,0,1]=4 8431 B13R2.3742 Nc1cc(Cl)cc2c1COC2=O Amb25770522 [0,2,0,0,0,0|0,0,0]=2 8432 B13R2.3742 Nc1cc(F)c2c(c1)C(=O)NC2 Amb21963052 [0,2,0,0,0,0|1,0,0]=3 8433 B13R2.3742 Nc1cc(F)cc2c1C=NC2=O Amb22015262 [0,2,0,0,0,0|1,0,1]=4 8434 B13R2.3742 Nc1cc(F)cc2c1CCC2=O Amb27166212 [0,2,0,0,0,0|1,0,0]=3 8435 B13R2.3742 Nc1cc(F)cc2c1CNC2=O Amb21963139 [0,2,0,0,0,0|1,0,0]=3 8436 B13R2.3742 Nc1cc(F)cc2c1COC2=O Amb22495706 [0,2,0,0,0,0|0,0,0]=2 8437 B13R2.3742 Nc1cc(F)cc2c1OCC2=O Amb27799930 [0,2,0,0,0,0|2,0,0]=4 8438 B13R2.3742 Nc1cc(N)c2c(c1)C(=O)N=N2 Amb28321450 [0,2,0,0,0,0|2,0,0]=4 8439 B13R2.3742 O=C1CCc2c(Br)cc(Br)cc21 Amb21857861 [0,2,0,0,0,0|1,0,0]=3 8440 B13R2.3742 O=C1CCc2c(Br)cc(Cl)cc21 Amb22059768 [0,2,0,0,0,0|1,0,0]=3 8441 B13R2.3742 O=C1CCc2c(Br)cc(F)cc21 Amb16232965 [0,2,0,0,0,0|1,0,0]=3 8442 B13R2.3742 O=C1CCc2c(Br)cc(O)cc21 Amb27405714 [0,2,0,0,0,0|1,0,0]=3 8443 B13R2.3742 O=C1CCc2c(Cl)cc(Br)cc21 Amb22735963 [0,2,0,0,0,0|1,0,0]=3 8444 B13R2.3742 O=C1CCc2c(Cl)cc(Cl)cc21 Amb2383534 [0,2,0,0,0,0|1,0,0]=3 8445 B13R2.3742 O=C1CCc2c(Cl)cc(F)cc21 Amb16232967 [0,2,0,0,0,0|1,0,0]=3 8446 B13R2.3742 O=C1CCc2c(Cl)cc(O)cc21 Amb24488653 [0,2,0,0,0,0|1,0,0]=3 8447 B13R2.3742 O=C1CCc2c(F)cc(Br)cc21 Amb33538423 [0,2,0,0,0,0|1,0,0]=3 8448 B13R2.3742 O=C1CCc2c(F)cc(Cl)cc21 Amb24485649 [0,2,0,0,0,0|1,0,0]=3 8449 B13R2.3742 O=C1CCc2c(F)cc(F)cc21 Amb2383537 [0,2,0,0,0,0|1,0,0]=3 8450 B13R2.3742 O=C1CCc2c(F)cc(O)cc21 Amb24117123 [0,2,0,0,0,0|1,0,0]=3 8451 B13R2.3742 O=C1CCc2c(I)cc(I)cc21 Amb27871397 [0,2,0,0,0,0|1,0,0]=3 8452 B13R2.3742 O=C1CCc2c(O)cc(F)cc21 Amb26023606 [0,2,0,0,0,0|1,0,0]=3 8453 B13R2.3742 O=C1CCc2c(O)cc(I)cc21 Amb27226036 [0,2,0,0,0,0|1,0,0]=3 8454 B13R2.3742 O=C1COc2c(Br)cc(Br)cc21 Amb24537638 [0,2,0,0,0,0|2,0,0]=4 8455 B13R2.3742 O=C1COc2c(Br)cc(Cl)cc21 Amb9372578 [0,2,0,0,0,0|2,0,0]=4 8456 B13R2.3742 O=C1COc2c(Cl)cc(Br)cc21 Amb33531627 [0,2,0,0,0,0|2,0,0]=4 8457 B13R2.3742 O=C1COc2c(Cl)cc(Cl)cc21 Amb2383544 [0,2,0,0,0,0|2,0,0]=4 8458 B13R2.3742 O=C1COc2c(Cl)cc(O)cc21 Amb27175602 [0,2,0,0,0,0|2,0,0]=4 8459 B13R2.3742 O=C1COc2c(F)cc(Br)cc21 Amb9372559 [0,2,0,0,0,0|2,0,0]=4 8460 B13R2.3742 O=C1COc2c(F)cc(Cl)cc21 Amb25381152 [0,2,0,0,0,0|2,0,0]=4 8461 B13R2.3742 O=C1COc2c(F)cc(F)cc21 Amb2383547 [0,2,0,0,0,0|2,0,0]=4 8462 B13R2.3742 O=C1N=Cc2c(Br)cc(O)cc21 Amb22015261 [0,2,0,0,0,0|1,0,1]=4 8463 B13R2.3742 O=C1N=Cc2c(Cl)cc(Cl)cc21 Amb22015256 [0,2,0,0,0,0|1,0,1]=4 8464 B13R2.3742 O=C1NC(=O)C2=C(N1)C(=O)OC2 Amb19653954 [0,2,0,0,0,0|2,0,0]=4 8465 B13R2.3742 O=C1NCc2c(Br)cc(O)cc21 Amb21963134 [0,2,0,0,0,0|1,0,0]=3 8466 B13R2.3742 O=C1NCc2c(Cl)cc(Cl)cc21 Amb21963127 [0,2,0,0,0,0|1,0,0]=3 8467 B13R2.3742 O=C1NCc2c(Cl)cc(F)cc21 Amb27221892 [0,2,0,0,0,0|1,0,0]=3 8468 B13R2.3742 O=C1NCc2c1cc(Cl)nc2Cl Amb24090952 [0,2,0,0,0,0|2,0,0]=4 8469 B13R2.3742 O=C1NNc2c(Cl)cc(Br)cc21 Amb27620209 [0,2,0,0,0,0|2,0,0]=4 8470 B13R2.3742 O=C1NNc2c(F)cc(F)cc21 Amb28366623 [0,2,0,0,0,0|2,0,0]=4 8471 B13R2.3742 O=C1NSc2c(Br)cc(Cl)cc21 Amb32710034 [0,2,0,0,0,0|2,0,0]=4 8472 B13R2.3742 O=C1OCc2c(Br)cc(F)cc21 Amb26961814 [0,2,0,0,0,0|0,0,0]=2 8473 B13R2.3742 O=C1OCc2c(Cl)cc(Cl)cc21 Amb27748854 [0,2,0,0,0,0|0,0,0]=2 8474 B13R2.3742 O=C1OCc2c(Cl)cc(F)cc21 Amb27396140 [0,2,0,0,0,0|0,0,0]=2 8475 B13R2.3742 O=C1OCc2c(Cl)nc(Cl)nc21 Amb21964791 [0,2,0,0,0,0|2,0,0]=4 8476 B13R2.3742 O=C1OCc2c(F)cc(Br)cc21 Amb27241196 [0,2,0,0,0,0|0,0,0]=2 8477 B13R2.3742 O=C1OCc2c(F)cc(Cl)cc21 Amb27968462 [0,2,0,0,0,0|0,0,0]=2 8478 B13R2.3742 O=C1OCc2c(F)cc(F)cc21 Amb27813650 [0,2,0,0,0,0|0,0,0]=2 8479 B13R2.3742 O=C1OCc2c(O)cc(O)cc21 Amb27842084 [0,2,0,0,0,0|0,0,0]=2 8480 B13R2.3742 OB1OCc2c(F)cc(F)cc21 Amb27478680 [0,2,0,0,0,0|1,0,1]=4 8481 B13R2.3790 Cc1c(Br)ccc2c1C(=O)CC2 Amb25726858 [0,2,0,0,0,0|1,0,0]=3 8482 B13R2.3790 Cc1c(Br)ccc2c1C(=O)CO2 Amb28071647 [0,2,0,0,0,0|2,0,0]=4 8483 B13R2.3790 Cc1c(Br)ccc2c1C(=O)NC2 Amb25720162 [0,2,0,0,0,0|1,0,0]=3 8484 B13R2.3790 Cc1c(Br)ccc2c1C(=O)NS2 Amb32710036 [0,2,0,0,0,0|2,0,0]=4 8485 B13R2.3790 Cc1c(Cl)ccc2c1C(=O)CC2 Amb22753088 [0,2,0,0,0,0|1,0,0]=3 8486 B13R2.3790 Cc1c(Cl)ccc2c1C(=O)CO2 Amb27830518 [0,2,0,0,0,0|2,0,0]=4 8487 B13R2.3790 Cc1c(Cl)ccc2c1C(=O)OC2 Amb28244240 [0,2,0,0,0,0|0,0,0]=2 8488 B13R2.3790 Cc1c(F)ccc2c1C(=O)CS2 Amb18192648 [0,2,0,0,0,0|2,0,0]=4 8489 B13R2.3790 Cc1c(F)ccc2c1C(=O)NC2 Amb27770980 [0,2,0,0,0,0|1,0,0]=3 8490 B13R2.3790 Cc1c(I)ccc2c1C(=O)CC2 Amb27212996 [0,2,0,0,0,0|1,0,0]=3 8491 B13R2.3790 Cc1c(N)ccc2c1B(O)OC2 Amb24493060 [0,2,0,0,0,0|1,0,1]=4 8492 B13R2.3790 Cc1c(O)ccc2c1C(=O)NC2 Amb21926769 [0,2,0,0,0,0|1,0,0]=3 8493 B13R2.3790 Cc1c(O)ccc2c1C(=O)OC2 Amb27589810 [0,2,0,0,0,0|0,0,0]=2 8494 B13R2.3790 Cc1ccc2c(c1Br)C(=O)CC2 Amb26322349 [0,2,0,0,0,0|1,0,0]=3 8495 B13R2.3790 Cc1ccc2c(c1C)B(O)OC2 Amb27642162 [0,2,0,0,0,0|1,0,1]=4 8496 B13R2.3790 Cc1ccc2c(c1C)C(=O)CC2 Amb22301507 [0,2,0,0,0,0|1,0,0]=3 8497 B13R2.3790 Cc1ccc2c(c1C)C(=O)CS2 Amb18824835 [0,2,0,0,0,0|2,0,0]=4 8498 B13R2.3790 Cc1ccc2c(c1Cl)C(=O)CC2 Amb27389356 [0,2,0,0,0,0|1,0,0]=3 8499 B13R2.3790 Cc1ccc2c(c1F)C(=O)CC2 Amb28401511 [0,2,0,0,0,0|1,0,0]=3 8500 B13R2.3790 Cc1ccc2c(c1F)C(=O)NS2 Amb32710011 [0,2,0,0,0,0|2,0,0]=4 8501 B13R2.3790 Cc1ncc2c(c1F)C(=O)NC2 Amb18827929 [0,2,0,0,0,0|2,0,0]=4 8502 B13R2.3790 Cc1ncc2c(c1N)C(=O)NC2 Amb18829373 [0,2,0,0,0,0|2,0,0]=4 8503 B13R2.3790 Cc1ncc2c(c1O)C(=O)CC2 Amb27243826 [0,2,0,0,0,0|2,0,0]=4 8504 B13R2.3790 Cc1ncc2c(c1O)C(=O)OC2 Amb17594095 [0,2,0,0,0,0|1,0,0]=3 8505 B13R2.3790 NC1=C2C(=O)NCC2=CNC1=O Amb18828555 [0,2,0,0,0,0|2,0,0]=4 8506 B13R2.3790 Nc1c(Br)ccc2c1C(=O)OC2 Amb2693269 [0,2,0,0,0,0|0,0,0]=2 8507 B13R2.3790 Nc1c(F)ccc2c1C(=O)OC2 Amb25891933 [0,2,0,0,0,0|0,0,0]=2 8508 B13R2.3790 Nc1c(O)ccc2c1C(=O)CC2 Amb2612885 [0,2,0,0,0,0|1,0,0]=3 8509 B13R2.3790 Nc1ccc2c(c1Br)C(=O)CC2 Amb20240997 [0,2,0,0,0,0|1,0,0]=3 8510 B13R2.3790 Nc1ccc2c(c1F)C(=O)NC2 Amb21858950 [0,2,0,0,0,0|1,0,0]=3 8511 B13R2.3790 Nc1ccc2c(c1N)C(=O)OC2 Amb10559384 [0,2,0,0,0,0|0,0,0]=2 8512 B13R2.3790 O=C1CCc2ccc(Br)c(Cl)c21 Amb27948027 [0,2,0,0,0,0|1,0,0]=3 8513 B13R2.3790 O=C1CCc2ccc(Br)c(F)c21 Amb26003851 [0,2,0,0,0,0|1,0,0]=3 8514 B13R2.3790 O=C1CCc2ccc(Br)c(O)c21 Amb27654141 [0,2,0,0,0,0|1,0,0]=3 8515 B13R2.3790 O=C1CCc2ccc(Cl)c(Br)c21 Amb25898667 [0,2,0,0,0,0|1,0,0]=3 8516 B13R2.3790 O=C1CCc2ccc(Cl)c(Cl)c21 Amb20240998 [0,2,0,0,0,0|1,0,0]=3 8517 B13R2.3790 O=C1CCc2ccc(Cl)c(F)c21 Amb20240986 [0,2,0,0,0,0|1,0,0]=3 8518 B13R2.3790 O=C1CCc2ccc(Cl)c(I)c21 Amb27178395 [0,2,0,0,0,0|1,0,0]=3 8519 B13R2.3790 O=C1CCc2ccc(F)c(Br)c21 Amb23440348 [0,2,0,0,0,0|1,0,0]=3 8520 B13R2.3790 O=C1CCc2ccc(F)c(Cl)c21 Amb25073179 [0,2,0,0,0,0|1,0,0]=3 8521 B13R2.3790 O=C1CCc2ccc(F)c(F)c21 Amb22230024 [0,2,0,0,0,0|1,0,0]=3 8522 B13R2.3790 O=C1CCc2ccc(I)c(Br)c21 Amb27961224 [0,2,0,0,0,0|1,0,0]=3 8523 B13R2.3790 O=C1CCc2ccc(I)c(O)c21 Amb27264834 [0,2,0,0,0,0|1,0,0]=3 8524 B13R2.3790 O=C1CCc2ccc(O)c(Cl)c21 Amb27253025 [0,2,0,0,0,0|1,0,0]=3 8525 B13R2.3790 O=C1COc2ccc(O)c(O)c21 Amb27593380 [0,2,0,0,0,0|2,0,0]=4 8526 B13R2.3790 O=C1NCc2ccc(Br)c(F)c21 Amb27247464 [0,2,0,0,0,0|1,0,0]=3 8527 B13R2.3790 O=C1NCc2ccc(Cl)c(Br)c21 Amb27641080 [0,2,0,0,0,0|1,0,0]=3 8528 B13R2.3790 O=C1NCc2ccc(F)c(I)c21 Amb24090656 [0,2,0,0,0,0|1,0,0]=3 8529 B13R2.3790 O=C1NSc2ccc(F)c(Cl)c21 Amb32710015 [0,2,0,0,0,0|2,0,0]=4 8530 B13R2.3790 O=C1OCc2ccc(Br)c(Cl)c21 Amb28244242 [0,2,0,0,0,0|0,0,0]=2 8531 B13R2.3790 O=C1OCc2ccc(O)c(Br)c21 Amb18160304 [0,2,0,0,0,0|0,0,0]=2 8532 B13R2.3791 CC1(C)OCc2ccc(O)cc21 Amb27657996 [0,2,0,0,0,0|1,0,1]=4 8533 B13R2.3791 Nc1ccc2c(c1)S(=O)(=O)CC2 Amb5720473 [0,2,0,0,0,0|2,0,0]=4 8534 B13R2.3791 Nc1ccc2c(c1)S(=O)(=O)NC2 Amb22170456 [0,2,0,0,0,0|2,0,0]=4 8535 B13R2.3791 O=S1(=O)CCc2ccc(Br)cc21 Amb25134983 [0,2,0,0,0,0|2,0,0]=4 8536 B13R2.3791 O=S1(=O)CCc2ccc(I)cc21 Amb27603596 [0,2,0,0,0,0|2,0,0]=4 8537 B13R2.3791 O=S1(=O)NCc2ccc(Br)cc21 Amb22886728 [0,2,0,0,0,0|2,0,0]=4 8538 B13R2.5187 C=C1CC(=O)c2cc(C)ccc21 Amb27828815 [0,2,0,0,0,0|1,0,1]=4 8539 B13R2.5187 C=C1CC(O)c2cc(F)ccc21 Amb28138418 [0,2,0,0,0,0|2,0,0]=4 8540 B13R2.5187 C=C1NC(=O)c2cc(Cl)ccc21 Amb28285631 [0,2,0,0,0,0|1,0,1]=4 8541 B13R2.5187 CC1=CC(N)c2ccc(C)cc21 Amb9783436 [0,2,0,0,0,0|2,0,0]=4 8542 B13R2.5187 CC1CC(=O)c2cc(Br)ccc21 Amb6705554 [0,2,0,0,0,0|1,0,0]=3 8543 B13R2.5187 CC1CC(=O)c2cc(Cl)ccc21 Amb6705553 [0,2,0,0,0,0|1,0,0]=3 8544 B13R2.5187 CC1CC(=O)c2cc(F)ccc21 Amb6705552 [0,2,0,0,0,0|1,0,0]=3 8545 B13R2.5187 CC1CC(=O)c2ccc(Cl)cc21 Amb22753082 [0,2,0,0,0,0|1,0,0]=3 8546 B13R2.5187 CC1CC(=O)c2ccc(F)cc21 Amb25698030 [0,2,0,0,0,0|1,0,0]=3 8547 B13R2.5187 CC1CC(=O)c2ccc(O)cc21 Amb2811362 [0,2,0,0,0,0|1,0,0]=3 8548 B13R2.5187 CC1NC(=O)c2cc(Br)ccc21 Amb33716192 [0,2,0,0,0,0|1,0,0]=3 8549 B13R2.5187 CC1NC(=O)c2cc(Cl)ccc21 Amb27813355 [0,2,0,0,0,0|1,0,0]=3 8550 B13R2.5187 CC1NC(=O)c2cc(F)ccc21 Amb27777625 [0,2,0,0,0,0|1,0,0]=3 8551 B13R2.5187 CC1NC(=O)c2cc(N)ccc21 Amb28067805 [0,2,0,0,0,0|1,0,0]=3 8552 B13R2.5187 CC1NC(=O)c2ccc(Cl)cc21 Amb26559218 [0,2,0,0,0,0|1,0,0]=3 8553 B13R2.5187 CC1NC(=O)c2ccc(F)cc21 Amb28246003 [0,2,0,0,0,0|1,0,0]=3 8554 B13R2.5187 CC1OB(O)c2ccc(F)cc21 Amb27770942 [0,2,0,0,0,0|1,0,1]=4 8555 B13R2.5187 CC1OC(=O)c2cc(Br)ccc21 Amb18159717 [0,2,0,0,0,0|0,0,0]=2 8556 B13R2.5187 CC1OC(=O)c2cc(O)ccc21 Amb28351484 [0,2,0,0,0,0|0,0,0]=2 8557 B13R2.5187 CC1OC(=O)c2ccc(Br)cc21 Amb25871714 [0,2,0,0,0,0|0,0,0]=2 8558 B13R2.5187 CN1CC(=O)c2cc(Br)ccc21 Amb18160225 [0,2,0,0,0,0|2,0,0]=4 8559 B13R2.5187 CN1CC(=O)c2cc(N)ccc21 Amb18829714 [0,2,0,0,0,0|2,0,0]=4 8560 B13R2.5187 CN1SC(=O)c2cc(N)ccc21 Amb28398179 [0,2,0,0,0,0|1,1,0]=4 8561 B13R2.5187 C[C@H]1CC(=O)c2cc(O)ccc21 Amb27781977 [0,2,0,0,0,0|1,0,0]=3 8562 B13R2.5187 C[C@H]1NC(=O)c2cc(N)ccc21 Amb27178087 [0,2,0,0,0,0|1,0,0]=3 8563 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2=O Amb27177623 [0,2,0,0,0,0|1,0,1]=4 8564 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2C Amb6705551 [0,2,0,0,0,0|1,0,0]=3 8565 B13R2.5187 Cc1ccc2c(c1)C(=O)CC2N Amb17470419 [0,2,0,0,0,0|1,0,0]=3 8566 B13R2.5187 Cc1ccc2c(c1)C(=O)C[C@H]2N Amb27405716 [0,2,0,0,0,0|1,0,0]=3 8567 B13R2.5187 Cc1ccc2c(c1)C(=O)NC2=O Amb33529184 [0,2,0,0,0,0|1,0,1]=4 8568 B13R2.5187 Cc1ccc2c(c1)C(=O)OC2=O Amb6297275 [0,2,0,0,0,0|0,0,1]=3 8569 B13R2.5187 Cc1ccc2c(c1)C(=O)OC2F Amb27614542 [0,2,0,0,0,0|0,0,0]=2 8570 B13R2.5187 Cc1ccc2c(c1)C(C)CC2=O Amb2697081 [0,2,0,0,0,0|1,0,0]=3 8571 B13R2.5187 Cc1ccc2c(c1)C(N)CC2=O Amb17470421 [0,2,0,0,0,0|1,0,0]=3 8572 B13R2.5187 Cc1ccc2c(c1)C(O)OC2=O Amb18936180 [0,2,0,0,0,0|0,0,0]=2 8573 B13R2.5187 Cc1ccc2c(c1)[C@@H](N)CC2=O Amb27748435 [0,2,0,0,0,0|1,0,0]=3 8574 B13R2.5187 Cc1ccc2c(n1)C(=O)OC2=O Amb26943843 [0,2,0,0,0,0|1,0,1]=4 8575 B13R2.5187 Cc1cnc2c(c1)C(=O)OC2=O Amb28076115 [0,2,0,0,0,0|1,0,1]=4 8576 B13R2.5187 NC1=NC(=O)c2cc(Br)ccc21 Amb27970037 [0,2,0,0,0,0|1,0,1]=4 8577 B13R2.5187 NC1=NC(=O)c2cc(Cl)ccc21 Amb26636504 [0,2,0,0,0,0|1,0,1]=4 8578 B13R2.5187 NC1CC(=O)c2cc(Br)ccc21 Amb17472099 [0,2,0,0,0,0|1,0,0]=3 8579 B13R2.5187 NC1CC(=O)c2cc(Cl)ccc21 Amb17470645 [0,2,0,0,0,0|1,0,0]=3 8580 B13R2.5187 NC1CC(=O)c2cc(F)ccc21 Amb17470454 [0,2,0,0,0,0|1,0,0]=3 8581 B13R2.5187 NC1CC(=O)c2cc(I)ccc21 Amb28045730 [0,2,0,0,0,0|1,0,0]=3 8582 B13R2.5187 NC1CC(=O)c2ccc(Br)cc21 Amb17472097 [0,2,0,0,0,0|1,0,0]=3 8583 B13R2.5187 NC1CC(=O)c2ccc(Cl)cc21 Amb26637695 [0,2,0,0,0,0|1,0,0]=3 8584 B13R2.5187 NC1CC(=O)c2ccc(F)cc21 Amb17470456 [0,2,0,0,0,0|1,0,0]=3 8585 B13R2.5187 NC1CC(=O)c2ccc(O)cc21 Amb27408446 [0,2,0,0,0,0|1,0,0]=3 8586 B13R2.5187 NC1NC(=O)c2cc(Br)ccc21 Amb27223152 [0,2,0,0,0,0|1,0,0]=3 8587 B13R2.5187 N[C@@H]1CC(=O)c2cc(I)ccc21 Amb27461157 [0,2,0,0,0,0|1,0,0]=3 8588 B13R2.5187 N[C@@H]1CC(=O)c2ccc(F)cc21 Amb27459698 [0,2,0,0,0,0|1,0,0]=3 8589 B13R2.5187 N[C@H]1CC(=O)c2cc(Br)ccc21 Amb27950534 [0,2,0,0,0,0|1,0,0]=3 8590 B13R2.5187 N[C@H]1CC(=O)c2ccc(F)cc21 Amb27770626 [0,2,0,0,0,0|1,0,0]=3 8591 B13R2.5187 Nc1ccc2c(c1)C(=O)CC2=O Amb27876716 [0,2,0,0,0,0|1,0,1]=4 8592 B13R2.5187 Nc1ccc2c(c1)C(=O)NC2=O Amb6315501 [0,2,0,0,0,0|1,0,1]=4 8593 B13R2.5187 Nc1ccc2c(c1)C(=O)OC2=O Amb25256881 [0,2,0,0,0,0|0,0,1]=3 8594 B13R2.5187 Nc1ccc2c(c1)C(=O)OC2Br Amb23590103 [0,2,0,0,0,0|0,0,0]=2 8595 B13R2.5187 O=C1C=CC2=C(N1)C(=O)OC2=O Amb27790706 [0,2,0,0,0,0|1,0,1]=4 8596 B13R2.5187 O=C1CC(=O)c2cc(Br)ccc21 Amb26331546 [0,2,0,0,0,0|1,0,1]=4 8597 B13R2.5187 O=C1CC(=O)c2cc(O)ccc21 Amb24594676 [0,2,0,0,0,0|1,0,1]=4 8598 B13R2.5187 O=C1N=C(O)c2cc(Br)ccc21 Amb22015284 [0,2,0,0,0,0|1,0,1]=4 8599 B13R2.5187 O=C1NC(=O)c2cc(Br)ccc21 Amb6880855 [0,2,0,0,0,0|1,0,1]=4 8600 B13R2.5187 O=C1NC(=O)c2cc(Cl)ccc21 Amb17772222 [0,2,0,0,0,0|1,0,1]=4 8601 B13R2.5187 O=C1NC(=O)c2cc(F)ccc21 Amb20623908 [0,2,0,0,0,0|1,0,1]=4 8602 B13R2.5187 O=C1NC(=O)c2cc(O)ccc21 Amb18645754 [0,2,0,0,0,0|1,0,1]=4 8603 B13R2.5187 O=C1NC(O)c2ccc(Cl)cc21 Amb28205944 [0,2,0,0,0,0|1,0,0]=3 8604 B13R2.5187 O=C1NS(=O)c2cc(Br)ccc21 Amb26991350 [0,2,0,0,0,0|2,0,0]=4 8605 B13R2.5187 O=C1OC(=O)c2cc(Br)ccc21 Amb2685475 [0,2,0,0,0,0|0,0,1]=3 8606 B13R2.5187 O=C1OC(=O)c2cc(Cl)ccc21 Amb2686431 [0,2,0,0,0,0|0,0,1]=3 8607 B13R2.5187 O=C1OC(=O)c2cc(F)ccc21 Amb2236183 [0,2,0,0,0,0|0,0,1]=3 8608 B13R2.5187 O=C1OC(=O)c2cc(F)ncc21 Amb27478514 [0,2,0,0,0,0|1,0,1]=4 8609 B13R2.5187 O=C1OC(=O)c2cc(I)ccc21 Amb28293207 [0,2,0,0,0,0|0,0,1]=3 8610 B13R2.5187 O=C1OC(=O)c2cc(O)ccc21 Amb2823283 [0,2,0,0,0,0|0,0,1]=3 8611 B13R2.5187 O=C1OC(=O)c2nc(Br)ccc21 Amb28280264 [0,2,0,0,0,0|1,0,1]=4 8612 B13R2.5187 O=C1OC(=O)c2nc(Cl)ccc21 Amb27165139 [0,2,0,0,0,0|1,0,1]=4 8613 B13R2.5187 O=C1OC(=O)c2ncc(Br)cc21 Amb22754441 [0,2,0,0,0,0|1,0,1]=4 8614 B13R2.5187 O=C1OC(Br)c2cc(Br)ccc21 Amb24056792 [0,2,0,0,0,0|0,0,0]=2 8615 B13R2.5187 O=C1OC(Br)c2cc(Cl)ccc21 Amb27667904 [0,2,0,0,0,0|0,0,0]=2 8616 B13R2.5187 O=C1OC(Br)c2cc(F)ccc21 Amb24056808 [0,2,0,0,0,0|0,0,0]=2 8617 B13R2.5187 O=C1OC(Br)c2cc(I)ccc21 Amb27753873 [0,2,0,0,0,0|0,0,0]=2 8618 B13R2.5187 O=C1OC(Br)c2ccc(Br)cc21 Amb23590102 [0,2,0,0,0,0|0,0,0]=2 8619 B13R2.5187 O=C1OC(Br)c2ccc(F)cc21 Amb24056817 [0,2,0,0,0,0|0,0,0]=2 8620 B13R2.5187 O=C1OC(O)c2cc(Br)ccc21 Amb5722412 [0,2,0,0,0,0|0,0,0]=2 8621 B13R2.5187 O=C1OC(O)c2cc(Cl)ccc21 Amb18936147 [0,2,0,0,0,0|0,0,0]=2 8622 B13R2.5187 O=C1OC(O)c2cc(O)ccc21 Amb18272023 [0,2,0,0,0,0|0,0,0]=2 8623 B13R2.5187 O=C1OC(O)c2ccc(Br)cc21 Amb26608983 [0,2,0,0,0,0|0,0,0]=2 8624 B13R2.5187 O=C1OC(O)c2ccc(F)cc21 Amb26932757 [0,2,0,0,0,0|0,0,0]=2 8625 B13R2.11634 Cc1cc2c(cc1Br)C(=O)CC2 Amb23440398 [0,2,0,0,0,0|1,0,0]=3 8626 B13R2.11634 Cc1cc2c(cc1Br)CCC2=O Amb23440349 [0,2,0,0,0,0|1,0,0]=3 8627 B13R2.11634 Cc1cc2c(cc1Br)COC2=O Amb28244338 [0,2,0,0,0,0|0,0,0]=2 8628 B13R2.11634 Cc1cc2c(cc1C)B(O)OC2 Amb27664270 [0,2,0,0,0,0|1,0,1]=4 8629 B13R2.11634 Cc1cc2c(cc1C)C(=O)CO2 Amb9372553 [0,2,0,0,0,0|2,0,0]=4 8630 B13R2.11634 Cc1cc2c(cc1C)C(=O)CS2 Amb18824833 [0,2,0,0,0,0|2,0,0]=4 8631 B13R2.11634 Cc1cc2c(cc1Cl)C(=O)CC2 Amb22753089 [0,2,0,0,0,0|1,0,0]=3 8632 B13R2.11634 Cc1cc2c(cc1Cl)C(=O)NC2 Amb27171293 [0,2,0,0,0,0|1,0,0]=3 8633 B13R2.11634 Cc1cc2c(cc1Cl)CCC2=O Amb22753087 [0,2,0,0,0,0|1,0,0]=3 8634 B13R2.11634 Cc1cc2c(cc1Cl)CNC2=O Amb27273194 [0,2,0,0,0,0|1,0,0]=3 8635 B13R2.11634 Cc1cc2c(cc1Cl)COB2O Amb32664575 [0,2,0,0,0,0|1,0,1]=4 8636 B13R2.11634 Cc1cc2c(cc1Cl)COC2=O Amb28344482 [0,2,0,0,0,0|0,0,0]=2 8637 B13R2.11634 Cc1cc2c(cc1F)C(=O)CC2 Amb26947737 [0,2,0,0,0,0|1,0,0]=3 8638 B13R2.11634 Cc1cc2c(cc1F)C(=O)CS2 Amb18823727 [0,2,0,0,0,0|2,0,0]=4 8639 B13R2.11634 Cc1cc2c(cc1F)C(=O)NS2 Amb32710024 [0,2,0,0,0,0|2,0,0]=4 8640 B13R2.11634 Cc1cc2c(cc1F)SNC2=O Amb32710026 [0,2,0,0,0,0|2,0,0]=4 8641 B13R2.11634 Cc1cc2c(cc1N)C(=O)CC2 Amb27614539 [0,2,0,0,0,0|1,0,0]=3 8642 B13R2.11634 Cc1cc2c(cc1N)C(=O)NC2 Amb26517084 [0,2,0,0,0,0|1,0,0]=3 8643 B13R2.11634 Cc1cc2c(cc1N)COB2O Amb32669770 [0,2,0,0,0,0|1,0,1]=4 8644 B13R2.11634 Cc1cc2c(cc1O)C(=O)CC2 Amb27214121 [0,2,0,0,0,0|1,0,0]=3 8645 B13R2.11634 Cc1cc2c(cc1O)C(=O)NC2 Amb21926767 [0,2,0,0,0,0|1,0,0]=3 8646 B13R2.11634 Cc1cc2c(nc1Cl)CNC2=O Amb24645277 [0,2,0,0,0,0|2,0,0]=4 8647 B13R2.11634 Cc1nc2c(cc1Cl)CCC2=O Amb27879717 [0,2,0,0,0,0|2,0,0]=4 8648 B13R2.11634 Nc1cc2c(cc1Br)C(=O)CC2 Amb24468772 [0,2,0,0,0,0|1,0,0]=3 8649 B13R2.11634 Nc1cc2c(cc1Br)C(=O)OC2 Amb24525591 [0,2,0,0,0,0|0,0,0]=2 8650 B13R2.11634 Nc1cc2c(cc1Cl)C(=O)CC2 Amb27488721 [0,2,0,0,0,0|1,0,0]=3 8651 B13R2.11634 Nc1cc2c(cc1Cl)C(=O)NC2 Amb18823457 [0,2,0,0,0,0|1,0,0]=3 8652 B13R2.11634 Nc1cc2c(cc1Cl)C(=O)OC2 Amb18823048 [0,2,0,0,0,0|0,0,0]=2 8653 B13R2.11634 Nc1cc2c(cc1Cl)CCC2=O Amb27645249 [0,2,0,0,0,0|1,0,0]=3 8654 B13R2.11634 Nc1cc2c(cc1F)C(=O)CC2 Amb27265876 [0,2,0,0,0,0|1,0,0]=3 8655 B13R2.11634 Nc1cc2c(cc1F)CNC2=O Amb22372264 [0,2,0,0,0,0|1,0,0]=3 8656 B13R2.11634 Nc1cc2c(cc1I)CCC2=O Amb24616336 [0,2,0,0,0,0|1,0,0]=3 8657 B13R2.11634 Nc1cc2c(cc1N)C(=O)CC2 Amb27668938 [0,2,0,0,0,0|1,0,0]=3 8658 B13R2.11634 Nc1cc2c(cc1O)CNC2=O Amb26871237 [0,2,0,0,0,0|1,0,0]=3 8659 B13R2.11634 O=C1CCc2cc(Br)c(Br)cc21 Amb27458305 [0,2,0,0,0,0|1,0,0]=3 8660 B13R2.11634 O=C1CCc2cc(Br)c(Cl)cc21 Amb27871311 [0,2,0,0,0,0|1,0,0]=3 8661 B13R2.11634 O=C1CCc2cc(Br)c(F)cc21 Amb23440370 [0,2,0,0,0,0|1,0,0]=3 8662 B13R2.11634 O=C1CCc2cc(Cl)c(Br)cc21 Amb27392100 [0,2,0,0,0,0|1,0,0]=3 8663 B13R2.11634 O=C1CCc2cc(Cl)c(Cl)cc21 Amb8392927 [0,2,0,0,0,0|1,0,0]=3 8664 B13R2.11634 O=C1CCc2cc(Cl)c(F)cc21 Amb27616751 [0,2,0,0,0,0|1,0,0]=3 8665 B13R2.11634 O=C1CCc2cc(Cl)c(O)cc21 Amb25873279 [0,2,0,0,0,0|1,0,0]=3 8666 B13R2.11634 O=C1CCc2cc(F)c(Br)cc21 Amb22757418 [0,2,0,0,0,0|1,0,0]=3 8667 B13R2.11634 O=C1CCc2cc(F)c(Cl)cc21 Amb16232964 [0,2,0,0,0,0|1,0,0]=3 8668 B13R2.11634 O=C1CCc2cc(F)c(F)cc21 Amb8392928 [0,2,0,0,0,0|1,0,0]=3 8669 B13R2.11634 O=C1CCc2cc(F)c(I)cc21 Amb27467408 [0,2,0,0,0,0|1,0,0]=3 8670 B13R2.11634 O=C1CCc2cc(F)c(O)cc21 Amb16232969 [0,2,0,0,0,0|1,0,0]=3 8671 B13R2.11634 O=C1CCc2cc(I)c(Cl)cc21 Amb27452159 [0,2,0,0,0,0|1,0,0]=3 8672 B13R2.11634 O=C1CCc2cc(I)c(O)cc21 Amb27172809 [0,2,0,0,0,0|1,0,0]=3 8673 B13R2.11634 O=C1CCc2cc(O)c(Cl)cc21 Amb24626125 [0,2,0,0,0,0|1,0,0]=3 8674 B13R2.11634 O=C1CCc2cc(O)c(O)cc21 Amb21856870 [0,2,0,0,0,0|1,0,0]=3 8675 B13R2.11634 O=C1COc2cc(Br)c(Cl)cc21 Amb24389271 [0,2,0,0,0,0|2,0,0]=4 8676 B13R2.11634 O=C1COc2cc(Br)c(F)cc21 Amb22735743 [0,2,0,0,0,0|2,0,0]=4 8677 B13R2.11634 O=C1COc2cc(Cl)c(Br)cc21 Amb27608114 [0,2,0,0,0,0|2,0,0]=4 8678 B13R2.11634 O=C1COc2cc(Cl)c(Cl)cc21 Amb28131029 [0,2,0,0,0,0|2,0,0]=4 8679 B13R2.11634 O=C1COc2cc(Cl)c(F)cc21 Amb27607256 [0,2,0,0,0,0|2,0,0]=4 8680 B13R2.11634 O=C1COc2cc(Cl)c(O)cc21 Amb27871438 [0,2,0,0,0,0|2,0,0]=4 8681 B13R2.11634 O=C1COc2cc(F)c(Br)cc21 Amb24057304 [0,2,0,0,0,0|2,0,0]=4 8682 B13R2.11634 O=C1COc2cc(F)c(Cl)cc21 Amb28282788 [0,2,0,0,0,0|2,0,0]=4 8683 B13R2.11634 O=C1COc2cc(O)c(Br)cc21 Amb27622715 [0,2,0,0,0,0|2,0,0]=4 8684 B13R2.11634 O=C1NCc2cc(Cl)c(Cl)cc21 Amb24090613 [0,2,0,0,0,0|1,0,0]=3 8685 B13R2.11634 O=C1NCc2cc(Cl)c(F)cc21 Amb27600178 [0,2,0,0,0,0|1,0,0]=3 8686 B13R2.11634 O=C1NCc2cc(F)c(Br)cc21 Amb25896800 [0,2,0,0,0,0|1,0,0]=3 8687 B13R2.11634 O=C1NCc2cc(F)c(Cl)cc21 Amb33716942 [0,2,0,0,0,0|1,0,0]=3 8688 B13R2.11634 O=C1NCc2cc(F)c(F)cc21 Amb24090614 [0,2,0,0,0,0|1,0,0]=3 8689 B13R2.11634 O=C1NNc2cc(F)c(Br)cc21 Amb28424205 [0,2,0,0,0,0|2,0,0]=4 8690 B13R2.11634 O=C1NSc2cc(Br)c(F)cc21 Amb32710030 [0,2,0,0,0,0|2,0,0]=4 8691 B13R2.11634 O=C1NSc2cc(Cl)c(F)cc21 Amb32710007 [0,2,0,0,0,0|2,0,0]=4 8692 B13R2.11634 O=C1NSc2cc(F)c(Br)cc21 Amb32710031 [0,2,0,0,0,0|2,0,0]=4 8693 B13R2.11634 O=C1NSc2cc(F)c(F)cc21 Amb32710005 [0,2,0,0,0,0|2,0,0]=4 8694 B13R2.11634 O=C1OCc2nc(Cl)c(Cl)cc21 Amb24725969 [0,2,0,0,0,0|1,0,0]=3 8695 B13R2.11634 O=C1SNc2cc(F)c(F)cc21 Amb32673868 [0,2,0,0,0,0|1,1,0]=4 8696 B13R2.11634 OB1OCc2cc(Cl)c(F)cc21 Amb32664571 [0,2,0,0,0,0|1,0,1]=4 8697 B13R2.11634 OB1OCc2cc(F)c(F)cc21 Amb24606166 [0,2,0,0,0,0|1,0,1]=4 8698 B13R2.11634 OB1OCc2cc(O)c(F)cc21 Amb27814743 [0,2,0,0,0,0|1,0,1]=4 8699 B13R2.573 CCc1cccc2c(C)onc12 Amb28140646 [0,2,0,0,0,0|2,0,0]=4 8700 B13R2.573 CCc1cccc2c1CCC2=O Amb18797804 [0,2,0,0,0,0|1,0,0]=3 8701 B13R2.573 CCc1cccc2c1NCC2=O Amb18829954 [0,2,0,0,0,0|2,0,0]=4 8702 B13R2.573 CCc1cccc2c1NNC2=O Amb28460833 [0,2,0,0,0,0|2,0,0]=4 8703 B13R2.573 COc1cccc2c(C)onc12 Amb27632754 [0,2,0,0,0,0|2,0,0]=4 8704 B13R2.573 COc1cccc2c1C=CC2=O Amb27177922 [0,2,0,0,0,0|1,0,1]=4 8705 B13R2.573 COc1cccc2c1CCC2=O Amb33534377 [0,2,0,0,0,0|1,0,0]=3 8706 B13R2.573 COc1cccc2c1CCC2=S Amb28141816 [0,2,0,0,0,0|1,1,0]=4 8707 B13R2.573 COc1cccc2c1CNC2=O Amb20171621 [0,2,0,0,0,0|1,0,0]=3 8708 B13R2.573 COc1cccc2c1COB2O Amb27495717 [0,2,0,0,0,0|1,0,1]=4 8709 B13R2.573 COc1cccc2c1COC2=O Amb5717609 [0,2,0,0,0,0|0,0,0]=2 8710 B13R2.573 COc1cccc2c1NNC2=O Amb22235269 [0,2,0,0,0,0|2,0,0]=4 8711 B13R2.573 COc1cccc2c1OCC2=O Amb2383548 [0,2,0,0,0,0|2,0,0]=4 8712 B13R2.573 COc1cccc2c1ONC2=O Amb25697313 [0,2,0,0,0,0|2,0,0]=4 8713 B13R2.573 COc1cccc2c1SCC2=O Amb18824509 [0,2,0,0,0,0|2,0,0]=4 8714 B13R2.573 COc1cccc2c1SNC2=O Amb28133210 [0,2,0,0,0,0|2,0,0]=4 8715 B13R2.573 COc1nccc2c1COC2=O Amb27250581 [0,2,0,0,0,0|1,0,0]=3 8716 B13R2.573 N#Cc1cccc2c1CCC2=O Amb17843594 [0,2,0,0,0,0|1,0,0]=3 8717 B13R2.573 N#Cc1cccc2c1COB2O Amb27815396 [0,2,0,0,0,0|1,0,1]=4 8718 B13R2.573 N#Cc1cccc2c1COC2=O Amb6297104 [0,2,0,0,0,0|0,0,0]=2 8719 B13R2.573 NCc1cccc2c1CNC2=O Amb25775298 [0,2,0,0,0,0|1,0,0]=3 8720 B13R2.573 NCc1cccc2c1COC2=O Amb27748530 [0,2,0,0,0,0|0,0,0]=2 8721 B13R2.573 O=C1CCc2c(CCl)cccc21 Amb28290356 [0,2,0,0,0,0|1,0,0]=3 8722 B13R2.573 O=Cc1cccc2c1CCC2=O Amb18645281 [0,2,0,0,0,0|1,0,0]=3 8723 B13R2.573 O=Cc1cccc2c1CNC2=O Amb28366616 [0,2,0,0,0,0|1,0,0]=3 8724 B13R2.573 O=Cc1cccc2c1COC2=O Amb18829874 [0,2,0,0,0,0|0,0,0]=2 8725 B13R2.4848 Nc1cccc2c1CCS2(=O)=O Amb27836861 [0,2,0,0,0,0|2,0,0]=4 8726 B13R2.4848 O=S1(=O)CCc2c(Br)cccc21 Amb28368469 [0,2,0,0,0,0|2,0,0]=4 8727 B13R2.4857 CC1CC(=O)c2cccc(Br)c21 Amb9748160 [0,2,0,0,0,0|1,0,0]=3 8728 B13R2.4857 CC1NC(=O)c2c(F)cccc21 Amb28071561 [0,2,0,0,0,0|1,0,0]=3 8729 B13R2.4857 CC1NC(=O)c2cccc(F)c21 Amb27876878 [0,2,0,0,0,0|1,0,0]=3 8730 B13R2.4857 CC1OB(O)c2c(F)cccc21 Amb27946776 [0,2,0,0,0,0|1,0,1]=4 8731 B13R2.4857 CC1OC(=O)c2cccc(N)c21 Amb26583091 [0,2,0,0,0,0|0,0,0]=2 8732 B13R2.4857 CN1CC(=O)c2cccc(Br)c21 Amb18160222 [0,2,0,0,0,0|2,0,0]=4 8733 B13R2.4857 CN1CC(=O)c2cccc(N)c21 Amb18829719 [0,2,0,0,0,0|2,0,0]=4 8734 B13R2.4857 CN1NC(=O)c2c(Br)cccc21 Amb28366293 [0,2,0,0,0,0|2,0,0]=4 8735 B13R2.4857 CN1NC(=O)c2c(N)cccc21 Amb24564482 [0,2,0,0,0,0|2,0,0]=4 8736 B13R2.4857 C[C@H]1OC(=O)c2c(O)cccc21 Amb28243799 [0,2,0,0,0,0|0,0,0]=2 8737 B13R2.4857 Cc1cccc2c1C(=O)CC2N Amb27841742 [0,2,0,0,0,0|1,0,0]=3 8738 B13R2.4857 Cc1cccc2c1C(=O)N=C2N Amb25772837 [0,2,0,0,0,0|1,0,1]=4 8739 B13R2.4857 Cc1cccc2c1C(=O)NC2=O Amb17778631 [0,2,0,0,0,0|1,0,1]=4 8740 B13R2.4857 Cc1cccc2c1C(=O)NC2C Amb27804198 [0,2,0,0,0,0|1,0,0]=3 8741 B13R2.4857 Cc1cccc2c1C(=O)OC2=O Amb8516710 [0,2,0,0,0,0|0,0,1]=3 8742 B13R2.4857 Cc1cccc2c1C(=O)OC2O Amb17843912 [0,2,0,0,0,0|0,0,0]=2 8743 B13R2.4857 Cc1cccc2c1C(C)CC2=O Amb6705556 [0,2,0,0,0,0|1,0,0]=3 8744 B13R2.4857 Cc1cccc2c1C(N)CC2=O Amb17470420 [0,2,0,0,0,0|1,0,0]=3 8745 B13R2.4857 Cc1cccc2c1C(O)NC2=O Amb28290402 [0,2,0,0,0,0|1,0,0]=3 8746 B13R2.4857 Cc1cccc2c1[C@@H](N)CC2=O Amb28346785 [0,2,0,0,0,0|1,0,0]=3 8747 B13R2.4857 Cc1cccc2c1[C@H](N)CC2=O Amb27467470 [0,2,0,0,0,0|1,0,0]=3 8748 B13R2.4857 NC1CC(=O)c2c(O)cccc21 Amb28290472 [0,2,0,0,0,0|1,0,0]=3 8749 B13R2.4857 NC1CC(=O)c2cccc(Br)c21 Amb17472098 [0,2,0,0,0,0|1,0,0]=3 8750 B13R2.4857 NC1CC(=O)c2cccc(Cl)c21 Amb17470646 [0,2,0,0,0,0|1,0,0]=3 8751 B13R2.4857 NC1CC(=O)c2cccc(F)c21 Amb17470455 [0,2,0,0,0,0|1,0,0]=3 8752 B13R2.4857 NC1CC(=O)c2cccc(I)c21 Amb27178265 [0,2,0,0,0,0|1,0,0]=3 8753 B13R2.4857 N[C@@H]1CC(=O)c2cccc(Br)c21 Amb27439593 [0,2,0,0,0,0|1,0,0]=3 8754 B13R2.4857 N[C@@H]1CC(=O)c2cccc(F)c21 Amb27439654 [0,2,0,0,0,0|1,0,0]=3 8755 B13R2.4857 N[C@@H]1CC(=O)c2cccc(O)c21 Amb27830631 [0,2,0,0,0,0|1,0,0]=3 8756 B13R2.4857 N[C@H]1CC(=O)c2c(I)cccc21 Amb27800835 [0,2,0,0,0,0|1,0,0]=3 8757 B13R2.4857 N[C@H]1CC(=O)c2c(O)cccc21 Amb27799991 [0,2,0,0,0,0|1,0,0]=3 8758 B13R2.4857 N[C@H]1CC(=O)c2cccc(Br)c21 Amb27623954 [0,2,0,0,0,0|1,0,0]=3 8759 B13R2.4857 N[C@H]1CC(=O)c2cccc(F)c21 Amb27950054 [0,2,0,0,0,0|1,0,0]=3 8760 B13R2.4857 Nc1cccc2c1C(=O)CC2=O Amb18126283 [0,2,0,0,0,0|1,0,1]=4 8761 B13R2.4857 Nc1cccc2c1C(=O)CC2O Amb10975543 [0,2,0,0,0,0|1,0,0]=3 8762 B13R2.4857 Nc1cccc2c1C(=O)C[C@H]2N Amb27871389 [0,2,0,0,0,0|1,0,0]=3 8763 B13R2.4857 Nc1cccc2c1C(=O)NC2=O Amb1105112 [0,2,0,0,0,0|1,0,1]=4 8764 B13R2.4857 Nc1cccc2c1C(=O)OC2=O Amb22233088 [0,2,0,0,0,0|0,0,1]=3 8765 B13R2.4857 Nc1cccc2c1C(O)NC2=O Amb27759911 [0,2,0,0,0,0|1,0,0]=3 8766 B13R2.4857 Nc1cccc2c1[C@H](N)CC2=O Amb27459771 [0,2,0,0,0,0|1,0,0]=3 8767 B13R2.4857 O=C1CC(=O)c2c(Br)cccc21 Amb27840471 [0,2,0,0,0,0|1,0,1]=4 8768 B13R2.4857 O=C1CC(=O)c2c(Cl)cccc21 Amb17594638 [0,2,0,0,0,0|1,0,1]=4 8769 B13R2.4857 O=C1CC(=O)c2c(I)cccc21 Amb26406358 [0,2,0,0,0,0|1,0,1]=4 8770 B13R2.4857 O=C1NC(=O)c2c(Br)cccc21 Amb21864647 [0,2,0,0,0,0|1,0,1]=4 8771 B13R2.4857 O=C1NC(=O)c2c(Cl)cccc21 Amb5722101 [0,2,0,0,0,0|1,0,1]=4 8772 B13R2.4857 O=C1NC(=O)c2c(F)cccc21 Amb22728698 [0,2,0,0,0,0|1,0,1]=4 8773 B13R2.4857 O=C1NC(=O)c2c(I)cccc21 Amb27968681 [0,2,0,0,0,0|1,0,1]=4 8774 B13R2.4857 O=C1NC(=O)c2c(O)cccc21 Amb5721827 [0,2,0,0,0,0|1,0,1]=4 8775 B13R2.4857 O=C1NC(O)c2c(Br)cccc21 Amb25802010 [0,2,0,0,0,0|1,0,0]=3 8776 B13R2.4857 O=C1NC(O)c2c(Cl)cccc21 Amb28118483 [0,2,0,0,0,0|1,0,0]=3 8777 B13R2.4857 O=C1NC(O)c2cccc(Br)c21 Amb26065721 [0,2,0,0,0,0|1,0,0]=3 8778 B13R2.4857 O=C1NC(O)c2ccnc(Cl)c21 Amb22500326 [0,2,0,0,0,0|2,0,0]=4 8779 B13R2.4857 O=C1OC(=O)c2c(Br)cccc21 Amb8631528 [0,2,0,0,0,0|0,0,1]=3 8780 B13R2.4857 O=C1OC(=O)c2c(Cl)cccc21 Amb2684170 [0,2,0,0,0,0|0,0,1]=3 8781 B13R2.4857 O=C1OC(=O)c2c(F)cccc21 Amb2688403 [0,2,0,0,0,0|0,0,1]=3 8782 B13R2.4857 O=C1OC(=O)c2c(I)cccc21 Amb19886550 [0,2,0,0,0,0|0,0,1]=3 8783 B13R2.4857 O=C1OC(=O)c2c(O)cccc21 Amb3941657 [0,2,0,0,0,0|0,0,1]=3 8784 B13R2.4857 O=C1OC(=O)c2c1ccc[n+]2[O-] Amb24607849 [0,2,0,0,0,0|1,0,1]=4 8785 B13R2.4857 O=C1OC(Br)c2c(Br)cccc21 Amb8391573 [0,2,0,0,0,0|0,0,0]=2 8786 B13R2.4857 O=C1OC(Br)c2c(I)cccc21 Amb27642530 [0,2,0,0,0,0|0,0,0]=2 8787 B13R2.4857 O=C1OC(Br)c2cccc(Br)c21 Amb24056796 [0,2,0,0,0,0|0,0,0]=2 8788 B13R2.4857 O=C1OC(Br)c2cccc(F)c21 Amb24056819 [0,2,0,0,0,0|0,0,0]=2 8789 B13R2.4857 O=C1OC(O)c2c(I)cccc21 Amb28187003 [0,2,0,0,0,0|0,0,0]=2 8790 B13R2.4857 O=C1OC(O)c2cccc(Br)c21 Amb27394131 [0,2,0,0,0,0|0,0,0]=2 8791 B13R2.4857 O=C1OC(O)c2cccc(Cl)c21 Amb18935869 [0,2,0,0,0,0|0,0,0]=2 8792 B13R2.4857 O=C1OC(O)c2cccc(F)c21 Amb18936162 [0,2,0,0,0,0|0,0,0]=2 8793 B13R2.4857 O=C1OC(O)c2ccnc(Cl)c21 Amb33713448 [0,2,0,0,0,0|1,0,0]=3 8794 B13R2.5151 Cc1ccc(Br)c2c1C(=O)CC2 Amb22288801 [0,2,0,0,0,0|1,0,0]=3 8795 B13R2.5151 Cc1ccc(Br)c2c1C(=O)CO2 Amb35663103 [0,2,0,0,0,0|2,0,0]=4 8796 B13R2.5151 Cc1ccc(Br)c2c1C(=O)OC2 Amb22504499 [0,2,0,0,0,0|0,0,0]=2 8797 B13R2.5151 Cc1ccc(Br)c2c1CCC2=O Amb3939116 [0,2,0,0,0,0|1,0,0]=3 8798 B13R2.5151 Cc1ccc(Br)c2c1COC2=O Amb27217913 [0,2,0,0,0,0|0,0,0]=2 8799 B13R2.5151 Cc1ccc(Br)c2c1NNC2=O Amb27489325 [0,2,0,0,0,0|2,0,0]=4 8800 B13R2.5151 Cc1ccc(C)c2c1CCC2=O Amb9793570 [0,2,0,0,0,0|1,0,0]=3 8801 B13R2.5151 Cc1ccc(C)c2c1CNC2=O Amb22754525 [0,2,0,0,0,0|1,0,0]=3 8802 B13R2.5151 Cc1ccc(C)c2c1COC2=O Amb17778622 [0,2,0,0,0,0|0,0,0]=2 8803 B13R2.5151 Cc1ccc(C)c2c1NCC2=O Amb18829952 [0,2,0,0,0,0|2,0,0]=4 8804 B13R2.5151 Cc1ccc(C)c2c1SCC2=O Amb18824836 [0,2,0,0,0,0|2,0,0]=4 8805 B13R2.5151 Cc1ccc(Cl)c2c1C(=O)CO2 Amb9372585 [0,2,0,0,0,0|2,0,0]=4 8806 B13R2.5151 Cc1ccc(Cl)c2c1C(=O)NC2 Amb27450425 [0,2,0,0,0,0|1,0,0]=3 8807 B13R2.5151 Cc1ccc(Cl)c2c1CCC2=O Amb22753084 [0,2,0,0,0,0|1,0,0]=3 8808 B13R2.5151 Cc1ccc(Cl)c2c1CNC2=O Amb27162281 [0,2,0,0,0,0|1,0,0]=3 8809 B13R2.5151 Cc1ccc(Cl)c2c1NCC2=O Amb18823864 [0,2,0,0,0,0|2,0,0]=4 8810 B13R2.5151 Cc1ccc(F)c2c1B(O)OC2 Amb32664572 [0,2,0,0,0,0|1,0,1]=4 8811 B13R2.5151 Cc1ccc(F)c2c1C(=O)CC2 Amb8388295 [0,2,0,0,0,0|1,0,0]=3 8812 B13R2.5151 Cc1ccc(F)c2c1C(=O)CO2 Amb27644308 [0,2,0,0,0,0|2,0,0]=4 8813 B13R2.5151 Cc1ccc(F)c2c1CCC2=O Amb26475903 [0,2,0,0,0,0|1,0,0]=3 8814 B13R2.5151 Cc1ccc(F)c2c1SNC2=O Amb32710012 [0,2,0,0,0,0|2,0,0]=4 8815 B13R2.5151 Cc1ccc(I)c2c1C(=O)OC2 Amb27478693 [0,2,0,0,0,0|0,0,0]=2 8816 B13R2.5151 Cc1ccc(N)c2c1C(=O)CO2 Amb27263930 [0,2,0,0,0,0|2,0,0]=4 8817 B13R2.5151 Cc1ccc(O)c2c1C(=O)CC2 Amb4012877 [0,2,0,0,0,0|1,0,0]=3 8818 B13R2.5151 Cc1ccc(O)c2c1C(=O)OC2 Amb28199966 [0,2,0,0,0,0|0,0,0]=2 8819 B13R2.5151 Cc1ccc(O)c2c1CCC2=O Amb18645632 [0,2,0,0,0,0|1,0,0]=3 8820 B13R2.5151 Cc1onc2c1C(=O)C=CC2=O Amb24646551 [0,2,0,0,0,0|2,0,0]=4 8821 B13R2.5151 Nc1ccc(Br)c2c1C(=O)CC2 Amb27168078 [0,2,0,0,0,0|1,0,0]=3 8822 B13R2.5151 Nc1ccc(Br)c2c1C(=O)NC2 Amb22753938 [0,2,0,0,0,0|1,0,0]=3 8823 B13R2.5151 Nc1ccc(Br)c2c1CNC2=O Amb23399577 [0,2,0,0,0,0|1,0,0]=3 8824 B13R2.5151 Nc1ccc(Br)c2c1OCC2=O Amb27246362 [0,2,0,0,0,0|2,0,0]=4 8825 B13R2.5151 Nc1ccc(Cl)c2c1C(=O)CC2 Amb27470860 [0,2,0,0,0,0|1,0,0]=3 8826 B13R2.5151 Nc1ccc(Cl)c2c1C(=O)NC2 Amb33309518 [0,2,0,0,0,0|1,0,0]=3 8827 B13R2.5151 Nc1ccc(Cl)c2c1C(=O)OC2 Amb27665261 [0,2,0,0,0,0|0,0,0]=2 8828 B13R2.5151 Nc1ccc(Cl)c2c1CCC2=O Amb17470642 [0,2,0,0,0,0|1,0,0]=3 8829 B13R2.5151 Nc1ccc(F)c2c1B(O)OC2 Amb27390073 [0,2,0,0,0,0|1,0,1]=4 8830 B13R2.5151 Nc1ccc(F)c2c1CCC2=O Amb28076070 [0,2,0,0,0,0|1,0,0]=3 8831 B13R2.5151 Nc1ccc(F)c2c1COB2O Amb28187481 [0,2,0,0,0,0|1,0,1]=4 8832 B13R2.5151 O=C1CCc2c(Br)ccc(Br)c21 Amb27852455 [0,2,0,0,0,0|1,0,0]=3 8833 B13R2.5151 O=C1CCc2c(Br)ccc(Cl)c21 Amb25804693 [0,2,0,0,0,0|1,0,0]=3 8834 B13R2.5151 O=C1CCc2c(Br)ccc(F)c21 Amb21964856 [0,2,0,0,0,0|1,0,0]=3 8835 B13R2.5151 O=C1CCc2c(Br)ccc(I)c21 Amb27482830 [0,2,0,0,0,0|1,0,0]=3 8836 B13R2.5151 O=C1CCc2c(Br)ccc(O)c21 Amb8479259 [0,2,0,0,0,0|1,0,0]=3 8837 B13R2.5151 O=C1CCc2c(Cl)ccc(Br)c21 Amb25312028 [0,2,0,0,0,0|1,0,0]=3 8838 B13R2.5151 O=C1CCc2c(Cl)ccc(Cl)c21 Amb24367328 [0,2,0,0,0,0|1,0,0]=3 8839 B13R2.5151 O=C1CCc2c(Cl)ccc(F)c21 Amb27493881 [0,2,0,0,0,0|1,0,0]=3 8840 B13R2.5151 O=C1CCc2c(Cl)ccc(I)c21 Amb27259510 [0,2,0,0,0,0|1,0,0]=3 8841 B13R2.5151 O=C1CCc2c(Cl)ccc(O)c21 Amb18648692 [0,2,0,0,0,0|1,0,0]=3 8842 B13R2.5151 O=C1CCc2c(F)ccc(Br)c21 Amb21964879 [0,2,0,0,0,0|1,0,0]=3 8843 B13R2.5151 O=C1CCc2c(F)ccc(Cl)c21 Amb23440371 [0,2,0,0,0,0|1,0,0]=3 8844 B13R2.5151 O=C1CCc2c(F)ccc(F)c21 Amb18788732 [0,2,0,0,0,0|1,0,0]=3 8845 B13R2.5151 O=C1CCc2c(F)ccc(O)c21 Amb21964861 [0,2,0,0,0,0|1,0,0]=3 8846 B13R2.5151 O=C1CCc2c(O)ccc(Cl)c21 Amb2699520 [0,2,0,0,0,0|1,0,0]=3 8847 B13R2.5151 O=C1CCc2c(O)ccc(F)c21 Amb25827778 [0,2,0,0,0,0|1,0,0]=3 8848 B13R2.5151 O=C1CCc2c(O)ccc(O)c21 Amb28194889 [0,2,0,0,0,0|1,0,0]=3 8849 B13R2.5151 O=C1CNc2c(Cl)ccc(Cl)c21 Amb18787294 [0,2,0,0,0,0|2,0,0]=4 8850 B13R2.5151 O=C1COc2c(Cl)ccc(F)c21 Amb27201273 [0,2,0,0,0,0|2,0,0]=4 8851 B13R2.5151 O=C1COc2c(F)ccc(Cl)c21 Amb27218489 [0,2,0,0,0,0|2,0,0]=4 8852 B13R2.5151 O=C1NCc2c(Br)ccc(Cl)c21 Amb24384971 [0,2,0,0,0,0|1,0,0]=3 8853 B13R2.5151 O=C1NCc2c(F)ccc(F)c21 Amb24090579 [0,2,0,0,0,0|1,0,0]=3 8854 B13R2.5151 O=C1OCc2c(Br)ccc(Cl)c21 Amb28369864 [0,2,0,0,0,0|0,0,0]=2 8855 B13R2.5151 O=C1OCc2c(Br)ccc(O)c21 Amb18160307 [0,2,0,0,0,0|0,0,0]=2 8856 B13R2.5151 O=C1OCc2c(Cl)ccc(Cl)c21 Amb28058936 [0,2,0,0,0,0|0,0,0]=2 8857 B13R2.5151 O=C1OCc2c(Cl)ccc(O)c21 Amb26625765 [0,2,0,0,0,0|0,0,0]=2 8858 B13R2.5180 Cc1c(Br)ccc2c1CCC2=O Amb23440374 [0,2,0,0,0,0|1,0,0]=3 8859 B13R2.5180 Cc1c(Br)ccc2c1COC2=O Amb28244241 [0,2,0,0,0,0|0,0,0]=2 8860 B13R2.5180 Cc1c(Br)ccc2c1SNC2=O Amb32710035 [0,2,0,0,0,0|2,0,0]=4 8861 B13R2.5180 Cc1c(Cl)ccc2c1CCC2=O Amb22753085 [0,2,0,0,0,0|1,0,0]=3 8862 B13R2.5180 Cc1c(Cl)ccc2c1NCC2=O Amb18823865 [0,2,0,0,0,0|2,0,0]=4 8863 B13R2.5180 Cc1c(Cl)ccc2c1OCC2=O Amb27246363 [0,2,0,0,0,0|2,0,0]=4 8864 B13R2.5180 Cc1c(F)ccc2c1CCC2=O Amb26954617 [0,2,0,0,0,0|1,0,0]=3 8865 B13R2.5180 Cc1c(F)ccc2c1CNC2=O Amb27663422 [0,2,0,0,0,0|1,0,0]=3 8866 B13R2.5180 Cc1c(F)ccc2c1COB2O Amb28127041 [0,2,0,0,0,0|1,0,1]=4 8867 B13R2.5180 Cc1c(F)ccc2c1NNC2=O Amb27817364 [0,2,0,0,0,0|2,0,0]=4 8868 B13R2.5180 Cc1c(F)ccc2c1OCC2=O Amb27185922 [0,2,0,0,0,0|2,0,0]=4 8869 B13R2.5180 Cc1c(N)ccc2c1COB2O Amb32669773 [0,2,0,0,0,0|1,0,1]=4 8870 B13R2.5180 Cc1c(O)ccc2c1CCC2=O Amb25719572 [0,2,0,0,0,0|1,0,0]=3 8871 B13R2.5180 Cc1c(O)ccc2c1COC2=O Amb26883426 [0,2,0,0,0,0|0,0,0]=2 8872 B13R2.5180 Cc1c(O)ccc2c1OCC2=O Amb807568 [0,2,0,0,0,0|2,0,0]=4 8873 B13R2.5180 Cc1c(S)ccc2c1COC2=O Amb27876940 [0,2,0,0,0,0|0,0,0]=2 8874 B13R2.5180 Cc1ccc2c(c1Br)CCC2=O Amb22443796 [0,2,0,0,0,0|1,0,0]=3 8875 B13R2.5180 Cc1ccc2c(c1C)CCC2=O Amb18179973 [0,2,0,0,0,0|1,0,0]=3 8876 B13R2.5180 Cc1ccc2c(c1C)COB2O Amb28044172 [0,2,0,0,0,0|1,0,1]=4 8877 B13R2.5180 Cc1ccc2c(c1C)NCC2=O Amb18829951 [0,2,0,0,0,0|2,0,0]=4 8878 B13R2.5180 Cc1ccc2c(c1C)NSC2=O Amb32673871 [0,2,0,0,0,0|1,1,0]=4 8879 B13R2.5180 Cc1ccc2c(c1Cl)CCC2=O Amb24341762 [0,2,0,0,0,0|1,0,0]=3 8880 B13R2.5180 Cc1ccc2c(c1Cl)CNC2=O Amb28118600 [0,2,0,0,0,0|1,0,0]=3 8881 B13R2.5180 Cc1ccc2c(c1Cl)COB2O Amb34911489 [0,2,0,0,0,0|1,0,1]=4 8882 B13R2.5180 Cc1ccc2c(c1Cl)COC2=O Amb28195582 [0,2,0,0,0,0|0,0,0]=2 8883 B13R2.5180 Cc1ccc2c(c1F)CCC2=O Amb25891900 [0,2,0,0,0,0|1,0,0]=3 8884 B13R2.5180 Cc1ccc2c(c1F)SNC2=O Amb32710014 [0,2,0,0,0,0|2,0,0]=4 8885 B13R2.5180 Cc1ccc2c(c1N)CNC2=O Amb22886400 [0,2,0,0,0,0|1,0,0]=3 8886 B13R2.5180 Cc1ccc2c(c1N)COB2O Amb32669768 [0,2,0,0,0,0|1,0,1]=4 8887 B13R2.5180 Cc1ccc2c(c1N)OCC2=O Amb28140674 [0,2,0,0,0,0|2,0,0]=4 8888 B13R2.5180 Cc1ccc2c(c1O)COC2=O Amb27227157 [0,2,0,0,0,0|0,0,0]=2 8889 B13R2.5180 Cc1ncc2c(c1O)COC2=O Amb25063854 [0,2,0,0,0,0|1,0,0]=3 8890 B13R2.5180 Nc1c(Br)ccc2c1COC2=O Amb27970474 [0,2,0,0,0,0|0,0,0]=2 8891 B13R2.5180 Nc1c(F)ccc2c1CCC2=O Amb27267390 [0,2,0,0,0,0|1,0,0]=3 8892 B13R2.5180 Nc1c(O)ccc2c1CCC2=O Amb28254493 [0,2,0,0,0,0|1,0,0]=3 8893 B13R2.5180 Nc1ccc2c(c1Br)COC2=O Amb18160599 [0,2,0,0,0,0|0,0,0]=2 8894 B13R2.5180 Nc1ccc2c(c1F)CCC2=O Amb27468564 [0,2,0,0,0,0|1,0,0]=3 8895 B13R2.5180 Nc1ccc2c(c1N)CCC2=O Amb27482180 [0,2,0,0,0,0|1,0,0]=3 8896 B13R2.5180 O=C1CCc2c1ccc(Br)c2Cl Amb27647600 [0,2,0,0,0,0|1,0,0]=3 8897 B13R2.5180 O=C1CCc2c1ccc(Br)c2F Amb23440400 [0,2,0,0,0,0|1,0,0]=3 8898 B13R2.5180 O=C1CCc2c1ccc(Cl)c2Br Amb23440401 [0,2,0,0,0,0|1,0,0]=3 8899 B13R2.5180 O=C1CCc2c1ccc(Cl)c2Cl Amb18317081 [0,2,0,0,0,0|1,0,0]=3 8900 B13R2.5180 O=C1CCc2c1ccc(Cl)c2F Amb27490856 [0,2,0,0,0,0|1,0,0]=3 8901 B13R2.5180 O=C1CCc2c1ccc(F)c2Br Amb28196366 [0,2,0,0,0,0|1,0,0]=3 8902 B13R2.5180 O=C1CCc2c1ccc(F)c2Cl Amb24681003 [0,2,0,0,0,0|1,0,0]=3 8903 B13R2.5180 O=C1CCc2c1ccc(F)c2F Amb10602390 [0,2,0,0,0,0|1,0,0]=3 8904 B13R2.5180 O=C1CCc2c1ccc(F)c2O Amb27212805 [0,2,0,0,0,0|1,0,0]=3 8905 B13R2.5180 O=C1CCc2c1ccc(I)c2F Amb27790831 [0,2,0,0,0,0|1,0,0]=3 8906 B13R2.5180 O=C1CCc2c1ccc(I)c2O Amb27406523 [0,2,0,0,0,0|1,0,0]=3 8907 B13R2.5180 O=C1CCc2c1ccc(O)c2Cl Amb24697635 [0,2,0,0,0,0|1,0,0]=3 8908 B13R2.5180 O=C1CCc2c1ccc(O)c2F Amb26599963 [0,2,0,0,0,0|1,0,0]=3 8909 B13R2.5180 O=C1CCc2c1ccc(O)c2I Amb27860400 [0,2,0,0,0,0|1,0,0]=3 8910 B13R2.5180 O=C1CCc2c1ccc(O)c2O Amb20669531 [0,2,0,0,0,0|1,0,0]=3 8911 B13R2.5180 O=C1COc2c1ccc(Cl)c2Br Amb27185937 [0,2,0,0,0,0|2,0,0]=4 8912 B13R2.5180 O=C1COc2c1ccc(Cl)c2Cl Amb9372545 [0,2,0,0,0,0|2,0,0]=4 8913 B13R2.5180 O=C1COc2c1ccc(F)c2Br Amb24077391 [0,2,0,0,0,0|2,0,0]=4 8914 B13R2.5180 O=C1COc2c1ccc(F)c2Cl Amb27185912 [0,2,0,0,0,0|2,0,0]=4 8915 B13R2.5180 O=C1COc2c1ccc(F)c2F Amb18789164 [0,2,0,0,0,0|2,0,0]=4 8916 B13R2.5180 O=C1COc2c1ccc(I)c2F Amb22739483 [0,2,0,0,0,0|2,0,0]=4 8917 B13R2.5180 O=C1COc2c1ccc(O)c2O Amb2504869 [0,2,0,0,0,0|2,0,0]=4 8918 B13R2.5180 O=C1NCc2c1ccc(Br)c2Cl Amb27602492 [0,2,0,0,0,0|1,0,0]=3 8919 B13R2.5180 O=C1NCc2c1ccc(Cl)c2Br Amb27807503 [0,2,0,0,0,0|1,0,0]=3 8920 B13R2.5180 O=C1NCc2c1ccc(O)c2I Amb28203551 [0,2,0,0,0,0|1,0,0]=3 8921 B13R2.5180 O=C1NSc2c1ccc(Br)c2F Amb32710022 [0,2,0,0,0,0|2,0,0]=4 8922 B13R2.5180 O=C1NSc2c1ccc(F)c2Cl Amb32710013 [0,2,0,0,0,0|2,0,0]=4 8923 B13R2.5180 O=C1NSc2c1ccc(F)c2F Amb32710006 [0,2,0,0,0,0|2,0,0]=4 8924 B13R2.5180 O=C1OCc2c1ccc(Br)c2Br Amb25925839 [0,2,0,0,0,0|0,0,0]=2 8925 B13R2.5180 O=C1OCc2c1ccc(Br)c2Cl Amb27227307 [0,2,0,0,0,0|0,0,0]=2 8926 B13R2.5180 O=C1OCc2c1ccc(F)c2Cl Amb28256707 [0,2,0,0,0,0|0,0,0]=2 8927 B13R2.5180 O=C1OCc2c1ccc(O)c2Cl Amb25984028 [0,2,0,0,0,0|0,0,0]=2 8928 B13R2.5180 O=C1OCc2c1ccc(O)c2F Amb27812278 [0,2,0,0,0,0|0,0,0]=2 8929 B13R2.5180 OB1OCc2c1ccc(Cl)c2F Amb34911455 [0,2,0,0,0,0|1,0,1]=4 8930 B13R2.5180 OB1OCc2c1ccc(F)c2F Amb25816511 [0,2,0,0,0,0|1,0,1]=4 8931 B13R2.582 C#Cc1cccc2c1C(=O)NC2 Amb25702420 [0,2,0,0,0,0|1,0,0]=3 8932 B13R2.582 CCc1cccc2c1C(=O)CC2 Amb27254177 [0,2,0,0,0,0|1,0,0]=3 8933 B13R2.582 CNc1cccc2c1C(=O)NC2 Amb27651490 [0,2,0,0,0,0|1,0,0]=3 8934 B13R2.582 COc1cccc2c1B(O)OC2 Amb22495473 [0,2,0,0,0,0|1,0,1]=4 8935 B13R2.582 COc1cccc2c1C(=O)C=C2 Amb27490921 [0,2,0,0,0,0|1,0,1]=4 8936 B13R2.582 COc1cccc2c1C(=O)CC2 Amb16232658 [0,2,0,0,0,0|1,0,0]=3 8937 B13R2.582 COc1cccc2c1C(=O)CO2 Amb18829059 [0,2,0,0,0,0|2,0,0]=4 8938 B13R2.582 COc1cccc2c1C(=O)NC2 Amb22008619 [0,2,0,0,0,0|1,0,0]=3 8939 B13R2.582 COc1cccc2c1C(=O)NS2 Amb25959731 [0,2,0,0,0,0|2,0,0]=4 8940 B13R2.582 COc1cccc2c1C(=O)OC2 Amb25066913 [0,2,0,0,0,0|0,0,0]=2 8941 B13R2.582 COc1nccc2c1C(=O)NC2 Amb27636073 [0,2,0,0,0,0|2,0,0]=4 8942 B13R2.582 CSc1cccc2c1C(=O)CC2 Amb25362024 [0,2,0,0,0,0|1,0,0]=3 8943 B13R2.582 N#Cc1cccc2c1C(=O)CC2 Amb10602516 [0,2,0,0,0,0|1,0,0]=3 8944 B13R2.582 N#Cc1cccc2c1C(=O)NC2 Amb21963072 [0,2,0,0,0,0|1,0,0]=3 8945 B13R2.582 N#Cc1cccc2c1C(=O)OC2 Amb18830408 [0,2,0,0,0,0|0,0,0]=2 8946 B13R2.582 NCc1cccc2c1C(=O)OC2 Amb18829453 [0,2,0,0,0,0|0,0,0]=2 8947 B13R2.582 O=C1NCc2cccc(CO)c21 Amb21963130 [0,2,0,0,0,0|1,0,0]=3 8948 B13R2.582 O=C1OCc2cccc(CBr)c21 Amb28123569 [0,2,0,0,0,0|0,0,0]=2 8949 B13R2.582 O=C1OCc2cccc(CO)c21 Amb25842537 [0,2,0,0,0,0|0,0,0]=2 8950 B13R2.582 O=Cc1cccc2c1B(O)OC2 Amb26373890 [0,2,0,0,0,0|1,0,1]=4 8951 B13R2.582 O=Cc1cccc2c1C(=O)N=C2 Amb22015259 [0,2,0,0,0,0|1,0,1]=4 8952 B13R2.582 O=Cc1cccc2c1C(=O)NC2 Amb21963131 [0,2,0,0,0,0|1,0,0]=3 8953 B13R2.582 O=Cc1cccc2c1C(=O)OC2 Amb18829873 [0,2,0,0,0,0|0,0,0]=2 8954 B13R2.582 O=Cc1nccc2c1C(=O)NC2 Amb27163132 [0,2,0,0,0,0|2,0,0]=4 8955 B13R2.582 OB1OCc2cccc(CBr)c21 Amb26655144 [0,2,0,0,0,0|1,0,1]=4 8956 B13R2.582 OCc1cccc2c1B(O)OC2 Amb27800941 [0,2,0,0,0,0|1,0,1]=4 8957 B13R2.11642 CC1=CC2=C(C(=O)N1)C(=O)OC2 Amb19654031 [0,2,0,0,0,0|1,0,0]=3 8958 B13R2.11642 CC1=CC2=C(C(=O)OC2)C(=S)N1 Amb19815144 [0,2,0,0,0,0|1,0,0]=3 8959 B13R2.11642 Cc1cc(Br)cc2c1C(=O)CC2 Amb27642504 [0,2,0,0,0,0|1,0,0]=3 8960 B13R2.11642 Cc1cc(Br)cc2c1C(=O)OC2 Amb26375584 [0,2,0,0,0,0|0,0,0]=2 8961 B13R2.11642 Cc1cc(C)c2c(c1)CCC2=O Amb4026662 [0,2,0,0,0,0|1,0,0]=3 8962 B13R2.11642 Cc1cc(C)c2c(c1)CNC2=O Amb22229923 [0,2,0,0,0,0|1,0,0]=3 8963 B13R2.11642 Cc1cc(C)c2c(c1)NCC2=O Amb18829950 [0,2,0,0,0,0|2,0,0]=4 8964 B13R2.11642 Cc1cc(C)c2c(c1)NNC2=O Amb27245499 [0,2,0,0,0,0|2,0,0]=4 8965 B13R2.11642 Cc1cc(C)c2c(c1)OCC2=O Amb9372544 [0,2,0,0,0,0|2,0,0]=4 8966 B13R2.11642 Cc1cc(Cl)c2c(c1)CNC2=O Amb27240932 [0,2,0,0,0,0|1,0,0]=3 8967 B13R2.11642 Cc1cc(Cl)cc2c1C(=O)CC2 Amb22284817 [0,2,0,0,0,0|1,0,0]=3 8968 B13R2.11642 Cc1cc(Cl)cc2c1C(=O)NC2 Amb27748540 [0,2,0,0,0,0|1,0,0]=3 8969 B13R2.11642 Cc1cc(F)c2c(c1)CCC2=O Amb25891902 [0,2,0,0,0,0|1,0,0]=3 8970 B13R2.11642 Cc1cc(F)cc2c1B(O)OC2 Amb33330150 [0,2,0,0,0,0|1,0,1]=4 8971 B13R2.11642 Cc1cc(F)cc2c1C(=O)CC2 Amb22284819 [0,2,0,0,0,0|1,0,0]=3 8972 B13R2.11642 Cc1cc(I)c2c(c1)CCC2=O Amb27606570 [0,2,0,0,0,0|1,0,0]=3 8973 B13R2.11642 Cc1cc(N)c2c(c1)CCC2=O Amb27238622 [0,2,0,0,0,0|1,0,0]=3 8974 B13R2.11642 Cc1cc(O)c2c(c1)OCC2=O Amb5759074 [0,2,0,0,0,0|2,0,0]=4 8975 B13R2.11642 Cc1cc(O)cc2c1C(=O)CC2 Amb28127247 [0,2,0,0,0,0|1,0,0]=3 8976 B13R2.11642 Cc1cc(O)cc2c1C(=O)CO2 Amb806963 [0,2,0,0,0,0|2,0,0]=4 8977 B13R2.11642 Cc1cc2c(c(N)n1)C(=N)OC2 Amb2149060 [0,2,0,0,0,0|2,0,0]=4 8978 B13R2.11642 Cc1cc2c(c(N)n1)C(=O)NC2 Amb27482079 [0,2,0,0,0,0|2,0,0]=4 8979 B13R2.11642 Cc1cc2c(c(N)n1)C(=O)OC2 Amb2221429 [0,2,0,0,0,0|1,0,0]=3 8980 B13R2.11642 Nc1cc(Cl)c2c(c1)COB2O Amb27394267 [0,2,0,0,0,0|1,0,1]=4 8981 B13R2.11642 Nc1cc(F)c2c(c1)COB2O Amb27466173 [0,2,0,0,0,0|1,0,1]=4 8982 B13R2.11642 Nc1cc(F)cc2c1C(=O)CC2 Amb28346618 [0,2,0,0,0,0|1,0,0]=3 8983 B13R2.11642 Nc1cc(F)cc2c1C(=O)OC2 Amb27968705 [0,2,0,0,0,0|0,0,0]=2 8984 B13R2.11642 Nc1cc(O)c2c(c1)CCC2=O Amb28184345 [0,2,0,0,0,0|1,0,0]=3 8985 B13R2.11642 O=C1CCc2cc(Br)cc(Br)c21 Amb19889697 [0,2,0,0,0,0|1,0,0]=3 8986 B13R2.11642 O=C1CCc2cc(Br)cc(Cl)c21 Amb24424474 [0,2,0,0,0,0|1,0,0]=3 8987 B13R2.11642 O=C1CCc2cc(Br)cc(F)c21 Amb22001891 [0,2,0,0,0,0|1,0,0]=3 8988 B13R2.11642 O=C1CCc2cc(Cl)cc(Cl)c21 Amb18317087 [0,2,0,0,0,0|1,0,0]=3 8989 B13R2.11642 O=C1CCc2cc(Cl)cc(F)c21 Amb22491008 [0,2,0,0,0,0|1,0,0]=3 8990 B13R2.11642 O=C1CCc2cc(Cl)cc(O)c21 Amb27803857 [0,2,0,0,0,0|1,0,0]=3 8991 B13R2.11642 O=C1CCc2cc(F)cc(Br)c21 Amb22288805 [0,2,0,0,0,0|1,0,0]=3 8992 B13R2.11642 O=C1CCc2cc(F)cc(Cl)c21 Amb25933591 [0,2,0,0,0,0|1,0,0]=3 8993 B13R2.11642 O=C1CCc2cc(F)cc(F)c21 Amb20241000 [0,2,0,0,0,0|1,0,0]=3 8994 B13R2.11642 O=C1CCc2cc(F)cc(O)c21 Amb24425430 [0,2,0,0,0,0|1,0,0]=3 8995 B13R2.11642 O=C1CCc2cc(I)cc(O)c21 Amb28244121 [0,2,0,0,0,0|1,0,0]=3 8996 B13R2.11642 O=C1CCc2cc(O)cc(Br)c21 Amb27390084 [0,2,0,0,0,0|1,0,0]=3 8997 B13R2.11642 O=C1CCc2cc(O)cc(Cl)c21 Amb23440421 [0,2,0,0,0,0|1,0,0]=3 8998 B13R2.11642 O=C1CCc2cc(O)cc(F)c21 Amb27799620 [0,2,0,0,0,0|1,0,0]=3 8999 B13R2.11642 O=C1CNc2cc(Cl)cc(Cl)c21 Amb18787297 [0,2,0,0,0,0|2,0,0]=4 9000 B13R2.11642 O=C1COc2cc(Br)cc(Br)c21 Amb27226180 [0,2,0,0,0,0|2,0,0]=4 9001 B13R2.11642 O=C1COc2cc(Cl)cc(Cl)c21 Amb9486208 [0,2,0,0,0,0|2,0,0]=4 9002 B13R2.11642 O=C1COc2cc(F)cc(F)c21 Amb18183577 [0,2,0,0,0,0|2,0,0]=4 9003 B13R2.11642 O=C1COc2cc(O)cc(Cl)c21 Amb27759892 [0,2,0,0,0,0|2,0,0]=4 9004 B13R2.11642 O=C1COc2cc(O)cc(O)c21 Amb549308 [0,2,0,0,0,0|2,0,0]=4 9005 B13R2.11642 O=C1NCc2cc(Br)cc(Cl)c21 Amb28060616 [0,2,0,0,0,0|1,0,0]=3 9006 B13R2.11642 O=C1NCc2cc(Br)cc(F)c21 Amb13883829 [0,2,0,0,0,0|1,0,0]=3 9007 B13R2.11642 O=C1NCc2cc(Cl)cc(F)c21 Amb23401770 [0,2,0,0,0,0|1,0,0]=3 9008 B13R2.11642 O=C1NCc2cc(F)cc(Br)c21 Amb27852514 [0,2,0,0,0,0|1,0,0]=3 9009 B13R2.11642 O=C1NCc2cc(F)cc(Cl)c21 Amb28129662 [0,2,0,0,0,0|1,0,0]=3 9010 B13R2.11642 O=C1NCc2cc(F)cc(F)c21 Amb23401772 [0,2,0,0,0,0|1,0,0]=3 9011 B13R2.11642 O=C1NSc2cc(Br)cc(F)c21 Amb32710016 [0,2,0,0,0,0|2,0,0]=4 9012 B13R2.11642 O=C1NSc2cc(F)cc(F)c21 Amb32710008 [0,2,0,0,0,0|2,0,0]=4 9013 B13R2.11642 O=C1OCc2cc(Br)cc(Cl)c21 Amb25689173 [0,2,0,0,0,0|0,0,0]=2 9014 B13R2.11642 O=C1OCc2cc(Br)cc(F)c21 Amb23401774 [0,2,0,0,0,0|0,0,0]=2 9015 B13R2.11642 O=C1OCc2cc(Br)cc(O)c21 Amb27770919 [0,2,0,0,0,0|0,0,0]=2 9016 B13R2.11642 O=C1OCc2cc(Cl)cc(Br)c21 Amb25323802 [0,2,0,0,0,0|0,0,0]=2 9017 B13R2.11642 O=C1OCc2cc(F)cc(Br)c21 Amb28044083 [0,2,0,0,0,0|0,0,0]=2 9018 B13R2.11642 O=C1OCc2cc(F)cc(F)c21 Amb27649287 [0,2,0,0,0,0|0,0,0]=2 9019 B13R2.11642 OB1OCc2cc(Cl)cc(F)c21 Amb32664574 [0,2,0,0,0,0|1,0,1]=4 9020 B13R2.11642 OB1OCc2cc(F)cc(F)c21 Amb27840743 [0,2,0,0,0,0|1,0,1]=4 9021 B13R2.13023 CC1(C)OCc2cccc(O)c21 Amb28122417 [0,2,0,0,0,0|1,0,1]=4 9022 B13R2.2130 C#Cc1ccc2c(c1)CCC2=O Amb19944517 [0,2,0,0,0,0|1,0,0]=3 9023 B13R2.2130 C=Cc1ccc2c(c1)CCC2=O Amb25781430 [0,2,0,0,0,0|1,0,0]=3 9024 B13R2.2130 C=Cc1ccc2c(c1)COC2=O Amb26961777 [0,2,0,0,0,0|0,0,0]=2 9025 B13R2.2130 CCc1ccc2c(c1)CCC2=O Amb21856202 [0,2,0,0,0,0|1,0,0]=3 9026 B13R2.2130 CCc1ccc2c(c1)COC2=O Amb28348767 [0,2,0,0,0,0|0,0,0]=2 9027 B13R2.2130 CCc1ccc2c(c1)OCC2=O Amb28244072 [0,2,0,0,0,0|2,0,0]=4 9028 B13R2.2130 CCc1ccc2c(n1)CNC2=O Amb25243158 [0,2,0,0,0,0|2,0,0]=4 9029 B13R2.2130 CNc1ccc2c(c1)CCC2=O Amb27950597 [0,2,0,0,0,0|1,0,0]=3 9030 B13R2.2130 COc1ccc2c(c1)C=CC2=O Amb21962796 [0,2,0,0,0,0|1,0,1]=4 9031 B13R2.2130 COc1ccc2c(c1)C=NC2=O Amb22015142 [0,2,0,0,0,0|1,0,1]=4 9032 B13R2.2130 COc1ccc2c(c1)CCC2=O Amb540868 [0,2,0,0,0,0|1,0,0]=3 9033 B13R2.2130 COc1ccc2c(c1)CN=C2N Amb24627274 [0,2,0,0,0,0|2,0,0]=4 9034 B13R2.2130 COc1ccc2c(c1)CNC2=O Amb17942829 [0,2,0,0,0,0|1,0,0]=3 9035 B13R2.2130 COc1ccc2c(c1)COB2O Amb26612713 [0,2,0,0,0,0|1,0,1]=4 9036 B13R2.2130 COc1ccc2c(c1)COC2=O Amb5717601 [0,2,0,0,0,0|0,0,0]=2 9037 B13R2.2130 COc1ccc2c(c1)NOC2=O Amb27254126 [0,2,0,0,0,0|1,0,0]=3 9038 B13R2.2130 COc1ccc2c(c1)OCC2=O Amb2499974 [0,2,0,0,0,0|2,0,0]=4 9039 B13R2.2130 COc1ccc2c(c1)ONC2=O Amb25992644 [0,2,0,0,0,0|2,0,0]=4 9040 B13R2.2130 COc1ccc2c(c1)SNC2=O Amb27840521 [0,2,0,0,0,0|2,0,0]=4 9041 B13R2.2130 COc1ccc2c(n1)CCC2=O Amb21964782 [0,2,0,0,0,0|2,0,0]=4 9042 B13R2.2130 COc1cnc2c(c1)COC2=O Amb27946000 [0,2,0,0,0,0|1,0,0]=3 9043 B13R2.2130 CSc1ccc2c(c1)OCC2=O Amb27799962 [0,2,0,0,0,0|2,0,0]=4 9044 B13R2.2130 CSc1ccc2c(n1)CCC2=O Amb27445713 [0,2,0,0,0,0|2,0,0]=4 9045 B13R2.2130 Cc1onc2cc(C=O)ccc12 Amb35788601 [0,2,0,0,0,0|2,0,0]=4 9046 B13R2.2130 N#Cc1ccc2c(c1)CCC2=O Amb10602515 [0,2,0,0,0,0|1,0,0]=3 9047 B13R2.2130 N#Cc1ccc2c(c1)CNC2=O Amb20171555 [0,2,0,0,0,0|1,0,0]=3 9048 B13R2.2130 N#Cc1ccc2c(c1)COB2O Amb27770948 [0,2,0,0,0,0|1,0,1]=4 9049 B13R2.2130 N#Cc1ccc2c(c1)COC2=O Amb2613734 [0,2,0,0,0,0|0,0,0]=2 9050 B13R2.2130 N#Cc1ccc2c(c1)OCC2=O Amb25335402 [0,2,0,0,0,0|2,0,0]=4 9051 B13R2.2130 N#Cc1ccc2c(n1)CCC2=O Amb24487315 [0,2,0,0,0,0|2,0,0]=4 9052 B13R2.2130 N#Cc1cnc2c(c1)CCC2=O Amb25874931 [0,2,0,0,0,0|2,0,0]=4 9053 B13R2.2130 NCc1ccc2c(c1)CCC2=O Amb24764118 [0,2,0,0,0,0|1,0,0]=3 9054 B13R2.2130 NCc1ccc2c(c1)CCC2=O Amb32757684 [0,2,0,0,0,0|1,0,0]=3 9055 B13R2.2130 NCc1ccc2c(c1)CNC2=O Amb25797635 [0,2,0,0,0,0|1,0,0]=3 9056 B13R2.2130 NCc1ccc2c(c1)CNC2=O Amb28989569 [0,2,0,0,0,0|1,0,0]=3 9057 B13R2.2130 NCc1ccc2c(c1)COB2O Amb28243828 [0,2,0,0,0,0|1,0,1]=4 9058 B13R2.2130 NCc1ccc2c(c1)COB2O Amb33735047 [0,2,0,0,0,0|1,0,1]=4 9059 B13R2.2130 NNc1ccc2c(c1)CCC2=O Amb27962440 [0,2,0,0,0,0|1,0,0]=3 9060 B13R2.2130 NNc1ncc2c(n1)COC2=O Amb28047439 [0,2,0,0,0,0|2,0,0]=4 9061 B13R2.2130 O=C1CCc2cc(CO)ccc21 Amb27603199 [0,2,0,0,0,0|1,0,0]=3 9062 B13R2.2130 O=C1NCc2cc(CO)ccc21 Amb22008616 [0,2,0,0,0,0|1,0,0]=3 9063 B13R2.2130 O=C1OCc2cc(CBr)ccc21 Amb27416357 [0,2,0,0,0,0|0,0,0]=2 9064 B13R2.2130 O=Cc1ccc2c(c1)C=NC2=O Amb22015266 [0,2,0,0,0,0|1,0,1]=4 9065 B13R2.2130 O=Cc1ccc2c(c1)CCC2=O Amb22494852 [0,2,0,0,0,0|1,0,0]=3 9066 B13R2.2130 O=Cc1ccc2c(c1)CNC2=O Amb21963174 [0,2,0,0,0,0|1,0,0]=3 9067 B13R2.2130 O=Cc1ccc2c(c1)COB2O Amb27493111 [0,2,0,0,0,0|1,0,1]=4 9068 B13R2.2130 O=Cc1ccc2c(c1)non2=O Amb21955367 [0,2,0,0,0,0|2,0,0]=4 9069 B13R2.2130 OCc1ccc2c(c1)COB2O Amb25843669 [0,2,0,0,0,0|1,0,1]=4 9070 B13R2.2130 [C-]#[N+]c1ccc2c(c1)CCC2=O Amb27177864 [0,2,0,0,0,0|1,0,0]=3 9071 B13R2.3108 CC1(C)OCc2cc(N)ccc21 Amb27438000 [0,2,0,0,0,0|1,0,1]=4 9072 B13R2.3108 CC1(C)OCc2cc(O)ccc21 Amb27954033 [0,2,0,0,0,0|1,0,1]=4 9073 B13R2.3108 Nc1ccc2c(c1)CCS2(=O)=O Amb10074848 [0,2,0,0,0,0|2,0,0]=4 9074 B13R2.3108 Nc1ccc2c(c1)CNS2(=O)=O Amb26567790 [0,2,0,0,0,0|2,0,0]=4 9075 B13R2.3108 O=S1(=O)CCc2cc(Br)ccc21 Amb27595537 [0,2,0,0,0,0|2,0,0]=4 9076 B13R2.3108 O=S1(=O)NCc2cc(Br)ccc21 Amb22886731 [0,2,0,0,0,0|2,0,0]=4 9077 B13R2.3108 O=S1(=O)NCc2cc(Cl)ccc21 Amb27953130 [0,2,0,0,0,0|2,0,0]=4 9078 B13R2.3108 O=S1(=O)NCc2cc(F)ccc21 Amb10176927 [0,2,0,0,0,0|2,0,0]=4 9079 B13R2.3108 O=S1(=O)NCc2cc(O)ccc21 Amb26883368 [0,2,0,0,0,0|2,0,0]=4 9080 B13R2.12159 BrC1=CC(Br)(Br)c2ccccc21 Amb4036289 [0,2,0,0,0,0|2,0,0]=4 9081 B13R2.12159 CC1(C)CC(=O)c2ccccc21 Amb6739860 [0,2,0,0,0,0|1,0,0]=3 9082 B13R2.12159 CC1(C)NC(=O)c2ccccc21 Amb22899742 [0,2,0,0,0,0|1,0,0]=3 9083 B13R2.12159 CC1(C)OB(O)c2ccccc21 Amb16233581 [0,2,0,0,0,0|1,0,1]=4 9084 B13R2.12159 CC1(C)OC(=O)c2ccccc21 Amb17778630 [0,2,0,0,0,0|0,0,0]=2 9085 B13R2.12159 CC1(C)O[IH2](Cl)c2ccccc21 Amb21961271 [0,2,0,0,0,0|2,0,0]=4 9086 B13R2.12159 CC1(C)O[IH2](F)c2ccccc21 Amb24324964 [0,2,0,0,0,0|2,0,0]=4 9087 B13R2.12159 CC1(C)O[IH2](O)c2ccccc21 Amb26638216 [0,2,0,0,0,0|1,0,1]=4 9088 B13R2.12159 CC1(O)CC(=O)c2ncccc21 Amb22750340 [0,2,0,0,0,0|2,0,0]=4 9089 B13R2.12159 CC1(O)OC(=O)c2cccnc21 Amb26433704 [0,2,0,0,0,0|1,0,0]=3 9090 B13R2.12159 CC1=CC(C)(O)c2ccccc21 Amb17778887 [0,2,0,0,0,0|2,0,0]=4 9091 B13R2.12159 CC1NS(=O)(=O)c2ccccc21 Amb22497137 [0,2,0,0,0,0|2,0,0]=4 9092 B13R2.12159 CS1(=O)=NC(=O)c2ccccc21 Amb31251514 [0,2,0,0,0,0|2,0,0]=4 9093 B13R2.12159 ClC1=NC(Cl)(Cl)c2ccccc21 Amb2792742 [0,2,0,0,0,0|2,0,0]=4 9094 B13R2.12159 NC1=NC(Cl)(Cl)c2ccccc21 Amb27445173 [0,2,0,0,0,0|2,0,0]=4 9095 B13R2.12159 NC1CS(=O)(=O)c2ccccc21 Amb28555690 [0,2,0,0,0,0|2,0,0]=4 9096 B13R2.12159 NC1CS(=O)(=O)c2ccccc21 Amb9384198 [0,2,0,0,0,0|2,0,0]=4 9097 B13R2.12159 O=C1CC(F)(F)c2ccccc21 Amb28070042 [0,2,0,0,0,0|1,0,0]=3 9098 B13R2.12159 O=C1CS(=O)(=O)c2ccccc21 Amb8629508 [0,2,0,0,0,0|2,0,0]=4 9099 B13R2.12159 O=C1NS(=O)(=O)c2ccccc21 Amb22167826 [0,2,0,0,0,0|2,0,0]=4 9100 B13R2.12159 O=C1NS(=O)(=O)c2ccccc21 Amb535294 [0,2,0,0,0,0|2,0,0]=4 9101 B13R2.12159 O=C1OC(Cl)(Cl)c2ccccc21 Amb16233588 [0,2,0,0,0,0|0,0,0]=2 9102 B13R2.12159 O=C1OI(=O)(O)c2ccccc21 Amb3358706 [0,2,0,0,0,0|1,0,0]=3 9103 B13R2.12159 O=C1OS(=O)(=O)c2ccccc21 Amb2700804 [0,2,0,0,0,0|1,0,0]=3 9104 B13R2.12159 O=C1SS(=O)(=O)c2ccccc21 Amb3997253 [0,2,0,0,0,0|1,1,0]=4 9105 B13R2.12159 O=C1[N-]S(=O)(=O)c2ccccc21 Amb4316445 [0,2,0,0,0,0|2,0,0]=4 9106 B13R2.12159 O=C1[N-]S(=O)(=O)c2ccccc21 Amb495319 [0,2,0,0,0,0|2,0,0]=4 9107 B13R2.12159 O=S1(=O)CC(Br)c2ccccc21 Amb6472071 [0,2,0,0,0,0|2,0,0]=4 9108 B13R2.12159 O=S1(=O)CC(O)c2ccccc21 Amb21927660 [0,2,0,0,0,0|2,0,0]=4 9109 B13R2.12159 O=S1(=O)NC(O)c2ccccc21 Amb27396548 [0,2,0,0,0,0|2,0,0]=4 9110 B13R2.12159 O=S1(=O)OC(Cl)c2ccccc21 Amb6365032 [0,2,0,0,0,0|1,0,0]=3 9111 B9R0.46 C=C\C=C\CCC(=O)OC Amb10605293 [0,0,2,0,0,0|0,0,2]=4 9112 B9R0.46 C=C\C=C\CNC(=S)C=C Amb25760756 [0,0,2,0,0,0|1,1,0]=4 9113 B9R0.46 COC(=O)\C=C\C=C\C=O Amb18643494 [0,0,2,0,0,0|1,0,0]=3 9114 B9R0.46 COC(=O)\C=C\C=C\CBr Amb27801010 [0,0,2,0,0,0|1,0,1]=4 9115 B9R0.46 COC(=O)\C=C\C=C\CCl Amb27204912 [0,0,2,0,0,0|1,0,1]=4 9116 B9R0.46 C\C=C\C\C=C\C(=O)OC Amb27422431 [0,0,2,0,0,0|0,0,2]=4 9117 B9R0.2 CC(=O)\C=C\C=C\C=C\Cl Amb28125315 [0,0,2,0,0,0|2,0,0]=4 9118 B9R0.2 CCC\C=C\C=C\C(=O)O Amb32953792 [0,0,2,0,0,0|0,0,2]=4 9119 B9R0.2 CCS\C=C\C=C\C(=O)O Amb27471801 [0,0,2,0,0,0|1,0,1]=4 9120 B9R0.2 COC\C=C\C=C\C(=O)O Amb28058297 [0,0,2,0,0,0|1,0,1]=4 9121 B9R0.2 CO\C=C\C=C\CC(=O)O Amb27874074 [0,0,2,0,0,0|1,0,1]=4 9122 B9R0.2 C\C=C\C=C\C#CC(=O)O Amb17593444 [0,0,2,0,0,0|0,0,2]=4 9123 B9R0.2 C\C=C\C=C\C=C\C(=O)O Amb3987814 [0,0,2,0,0,0|0,0,0]=2 9124 B9R0.2 C\C=C\C=C\C=C\C(N)=O Amb27202742 [0,0,2,0,0,0|1,0,0]=3 9125 B9R0.2 C\C=C\C=C\CCC(=O)O Amb18643576 [0,0,2,0,0,0|0,0,2]=4 9126 B9R0.2 C\C=C\C=C\COC(C)=O Amb4035104 [0,0,2,0,0,0|0,0,2]=4 9127 B9R0.2 C\C=C\C=C\COC(N)=O Amb27968532 [0,0,2,0,0,0|1,0,1]=4 9128 B9R0.4 C=CCC\C(C)=C/C(=O)O Amb25242614 [0,0,2,0,0,0|0,0,2]=4 9129 B9R0.4 C=CCC\C(C)=C\C(=O)O Amb18643565 [0,0,2,0,0,0|0,0,2]=4 9130 B9R0.4 CC(=O)\C=C(C)/C=C/C=O Amb27471937 [0,0,2,0,0,0|2,0,0]=4 9131 B9R0.4 CC(\C=C\C=O)=C/C(=O)O Amb27663875 [0,0,2,0,0,0|1,0,0]=3 9132 B9R0.4 CC\C=C\C(C)=C\C(=O)O Amb35734787 [0,0,2,0,0,0|0,0,2]=4 9133 B9R0.18 C=CCNC(=O)OCC=C Amb25359097 [0,0,2,0,0,0|1,0,1]=4 9134 B9R0.18 C=CCOC(=O)OCC=C Amb17933999 [0,0,2,0,0,0|1,0,1]=4 9135 B9R0.45 C=C\C=C\C=C\C=C\C=O Amb27841284 [0,0,2,0,0,0|1,0,1]=4 9136 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [0,0,2,0,0,0|1,0,0]=3 9137 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [0,0,2,0,0,0|1,0,0]=3 9138 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [0,0,2,0,0,0|1,0,0]=3 9139 B9R0.45 CC\C=C\C=C\C=C\CO Amb28050682 [0,0,2,0,0,0|1,0,1]=4 9140 B9R0.45 CO\C=C\C=C\C=C\C=O Amb27169346 [0,0,2,0,0,0|2,0,0]=4 9141 B9R0.45 O=C\C=C\C=C\C=C\C=O Amb18643061 [0,0,2,0,0,0|0,0,2]=4 9142 B9R0.45 OC\C=C\C=C\C=C\CO Amb27630063 [0,0,2,0,0,0|0,0,2]=4 9143 B9R0.5 C=CCC(=O)OC\C=C\C Amb27430898 [0,0,2,0,0,0|0,0,2]=4 9144 B9R0.5 C=COC(=O)\C=C\C=C\C Amb17689054 [0,0,2,0,0,0|0,0,2]=4 9145 B9R0.5 C=C\C=C\CC(=O)OCC Amb32676427 [0,0,2,0,0,0|0,0,2]=4 9146 B9R0.5 C=C\C=C\NC(=O)OCC Amb27226165 [0,0,2,0,0,0|1,0,1]=4 9147 B9R0.5 CCOC(=O)\C=C\C=C\Br Amb10066940 [0,0,2,0,0,0|1,0,1]=4 9148 B9R0.5 C\C=C\C=C\C(=O)OCC Amb6297204 [0,0,2,0,0,0|0,0,2]=4 9149 B9R0.13 C=CCO\C(=C\C)C(=O)O Amb25312247 [0,0,2,0,0,0|1,0,1]=4 9150 B9R0.13 C\C=C\C=C(/CC)C(=O)O Amb18643598 [0,0,2,0,0,0|0,0,2]=4 9151 B9R0.13 C\C=C\C=C(\CC)C(=O)O Amb27419854 [0,0,2,0,0,0|0,0,2]=4 9152 B9R0.6 CC(\C=C\Br)=C(\C)C(=O)O Amb27622148 [0,0,2,0,0,0|1,0,1]=4 9153 B9R0.33 C=CCC(C(=C)C)C(=O)O Amb27410645 [0,0,2,0,0,0|0,0,2]=4 9154 B9R0.33 C=C\C=C(\C(=O)O)C(C)C Amb28050067 [0,0,2,0,0,0|0,0,2]=4 9155 B11R2.4 CC1=C(c2ccccc2)N1 Amb28194853 [0,0,1,1,0,0|2,0,0]=4 9156 B11R2.40 CC1(c2ccccc2)CO1 Amb7094910 [0,0,1,1,0,0|1,0,1]=4 9157 B11R2.40 ClC1(c2ccccc2)CO1 Amb27210141 [0,0,1,1,0,0|1,0,1]=4 9158 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [0,0,1,1,0,0|1,0,1]=4 9159 B11R2.20 C1=CCc2ccccc2C1 Amb8392372 [0,0,1,1,0,0|2,0,0]=4 9160 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [0,0,1,1,0,0|2,0,0]=4 9161 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [0,0,1,1,0,0|2,0,0]=4 9162 B11R2.20 C1=Cc2ccccc2CO1 Amb27473263 [0,0,1,1,0,0|1,0,0]=3 9163 B11R2.20 C1=NCc2ccccc2N1 Amb19374085 [0,0,1,1,0,0|2,0,0]=4 9164 B11R2.20 C1=Nc2ncccc2CO1 Amb27950837 [0,0,1,1,0,0|2,0,0]=4 9165 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [0,0,1,1,0,0|1,0,1]=4 9166 B11R2.20 c1ccc2c(c1)CNOC2 Amb25997729 [0,0,1,1,0,0|2,0,0]=4 9167 B11R2.20 c1ccc2c(c1)CNOC2 Amb28555648 [0,0,1,1,0,0|2,0,0]=4 9168 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [0,0,1,1,0,0|2,0,0]=4 9169 B11R2.55 Cc1ccccc1C2CO2 Amb1140946 [0,0,1,1,0,0|1,0,1]=4 9170 B11R2.55 Cc1ccccc1[C@@H]2CO2 Amb26498851 [0,0,1,1,0,0|1,0,1]=4 9171 B11R2.55 Cc1ccccc1[C@H]2CO2 Amb24478493 [0,0,1,1,0,0|1,0,1]=4 9172 B11R2.55 Oc1ccccc1C2=NO2 Amb28074741 [0,0,1,1,0,0|2,0,0]=4 9173 B13R3.274 O=C1c2ccccc2C3CC13 Amb24533047 [0,0,0,1,0,1|1,0,0]=3 9174 B13R3.274 OC1c2ccccc2C3OC13 Amb28343274 [0,0,0,1,0,1|0,0,2]=4 9175 B13R3.2083 COC12OC1c3ccccc32 Amb24334687 [0,1,0,1,0,0|0,0,2]=4 9176 B9R1.11 CCC(=O)c1ccco1 Amb844124 [0,0,1,0,1,0|2,0,0]=4 9177 B9R1.11 CCC(=O)c1cccs1 Amb2690591 [0,0,1,0,1,0|2,0,0]=4 9178 B9R1.11 CCC(=O)c1ccoc1 Amb27196907 [0,0,1,0,1,0|2,0,0]=4 9179 B9R1.11 CCC(=O)c1ccsc1 Amb6298062 [0,0,1,0,1,0|2,0,0]=4 9180 B9R1.11 CNC(=O)c1ccco1 Amb2612183 [0,0,1,0,1,0|2,0,0]=4 9181 B9R1.11 CNC(=O)c1cccs1 Amb2612184 [0,0,1,0,1,0|2,0,0]=4 9182 B9R1.11 CNC(=O)c1ccsc1 Amb2612185 [0,0,1,0,1,0|2,0,0]=4 9183 B9R1.11 COC(=N)c1cccs1 Amb17621680 [0,0,1,0,1,0|2,0,0]=4 9184 B9R1.11 COC(=N)c1ccoc1 Amb27837467 [0,0,1,0,1,0|2,0,0]=4 9185 B9R1.11 COC(=O)c1ccco1 Amb4302709 [0,0,1,0,1,0|1,0,0]=3 9186 B9R1.11 COC(=O)c1cccs1 Amb1911537 [0,0,1,0,1,0|1,0,0]=3 9187 B9R1.11 COC(=O)c1ccno1 Amb4450531 [0,0,1,0,1,0|2,0,0]=4 9188 B9R1.11 COC(=O)c1ccns1 Amb13883507 [0,0,1,0,1,0|2,0,0]=4 9189 B9R1.11 COC(=O)c1ccoc1 Amb33531546 [0,0,1,0,1,0|1,0,0]=3 9190 B9R1.11 COC(=O)c1ccsc1 Amb9245220 [0,0,1,0,1,0|1,0,0]=3 9191 B9R1.11 COC(=O)c1cnco1 Amb21520455 [0,0,1,0,1,0|2,0,0]=4 9192 B9R1.11 COC(=O)c1cncs1 Amb2455728 [0,0,1,0,1,0|2,0,0]=4 9193 B9R1.11 COC(=O)c1cnoc1 Amb22754239 [0,0,1,0,1,0|2,0,0]=4 9194 B9R1.11 COC(=O)c1cnsc1 Amb25705771 [0,0,1,0,1,0|2,0,0]=4 9195 B9R1.11 COC(=O)c1cocn1 Amb21857674 [0,0,1,0,1,0|2,0,0]=4 9196 B9R1.11 COC(=O)c1cscn1 Amb10067320 [0,0,1,0,1,0|2,0,0]=4 9197 B9R1.11 COC(=O)c1ncco1 Amb22001762 [0,0,1,0,1,0|2,0,0]=4 9198 B9R1.11 COC(=O)c1nccs1 Amb10807389 [0,0,1,0,1,0|2,0,0]=4 9199 B9R1.11 COC(=O)n1cccc1 Amb4477192 [0,0,1,0,1,0|1,0,0]=3 9200 B9R1.11 COC(=O)n1cccn1 Amb3373376 [0,0,1,0,1,0|2,0,0]=4 9201 B9R1.11 COC(=S)c1cccs1 Amb27782424 [0,0,1,0,1,0|1,1,0]=4 9202 B9R1.11 COC(=S)c1ccsc1 Amb27633360 [0,0,1,0,1,0|1,1,0]=4 9203 B9R1.11 O=C(O[Cu])c1cccs1 Amb13890298 [0,0,1,0,1,0|2,0,0]=4 9204 B9R1.11 O=C(O[Na])c1cccs1 Amb3150403 [0,0,1,0,1,0|2,0,0]=4 9205 B9R1.41 C=C1C=CC=C1C(C)=O Amb25861278 [0,0,1,0,1,0|1,0,1]=4 9206 B9R1.41 CC(=O)c1cccn1C Amb3940343 [0,0,1,0,1,0|2,0,0]=4 9207 B9R1.41 CC(=O)c1ccoc1C Amb28054842 [0,0,1,0,1,0|2,0,0]=4 9208 B9R1.41 CC(=O)c1occc1C Amb20668258 [0,0,1,0,1,0|2,0,0]=4 9209 B9R1.41 CC(=O)c1sccc1C Amb3940405 [0,0,1,0,1,0|2,0,0]=4 9210 B9R1.41 CC(=O)n1cccc1C Amb28285118 [0,0,1,0,1,0|2,0,0]=4 9211 B9R1.41 Cc1ccoc1C(=O)Cl Amb2725685 [0,0,1,0,1,0|2,0,0]=4 9212 B9R1.41 Cc1ccoc1C(=O)O Amb1156943 [0,0,1,0,1,0|1,0,0]=3 9213 B9R1.41 Cc1ccoc1C(N)=O Amb8998946 [0,0,1,0,1,0|2,0,0]=4 9214 B9R1.41 Cc1ccoc1S(=O)O Amb27209285 [0,0,1,0,1,0|2,0,0]=4 9215 B9R1.41 Cc1ccsc1C(=O)Cl Amb2689730 [0,0,1,0,1,0|2,0,0]=4 9216 B9R1.41 Cc1ccsc1C(=O)O Amb2695360 [0,0,1,0,1,0|1,0,0]=3 9217 B9R1.41 Cc1ccsc1C(=O)[O-] Amb15691659 [0,0,1,0,1,0|1,0,1]=4 9218 B9R1.41 Cc1ccsc1C(N)=O Amb8997731 [0,0,1,0,1,0|2,0,0]=4 9219 B9R1.41 Cc1cnoc1C(=O)O Amb10071410 [0,0,1,0,1,0|2,0,0]=4 9220 B9R1.41 Cc1cnsc1C(=O)O Amb8439091 [0,0,1,0,1,0|2,0,0]=4 9221 B9R1.41 Cc1cocc1C(=O)O Amb22886569 [0,0,1,0,1,0|1,0,0]=3 9222 B9R1.41 Cc1cocc1C(N)=O Amb27780012 [0,0,1,0,1,0|2,0,0]=4 9223 B9R1.41 Cc1conc1C(=O)O Amb33545063 [0,0,1,0,1,0|2,0,0]=4 9224 B9R1.41 Cc1cscc1C(=O)Cl Amb28145070 [0,0,1,0,1,0|2,0,0]=4 9225 B9R1.41 Cc1cscc1C(=O)O Amb20240802 [0,0,1,0,1,0|1,0,0]=3 9226 B9R1.41 Cc1cscc1C(N)=O Amb24699178 [0,0,1,0,1,0|2,0,0]=4 9227 B9R1.41 Cc1ncoc1C(=O)O Amb2723146 [0,0,1,0,1,0|2,0,0]=4 9228 B9R1.41 Cc1ncsc1C(=O)O Amb6336150 [0,0,1,0,1,0|2,0,0]=4 9229 B9R1.41 Cc1nocc1C(=O)O Amb2724897 [0,0,1,0,1,0|2,0,0]=4 9230 B9R1.41 Cc1nscc1C(=O)O Amb8010605 [0,0,1,0,1,0|2,0,0]=4 9231 B9R1.41 Cc1occc1C(=O)Cl Amb2782014 [0,0,1,0,1,0|2,0,0]=4 9232 B9R1.41 Cc1occc1C(=O)O Amb1102055 [0,0,1,0,1,0|1,0,0]=3 9233 B9R1.41 Cc1occc1C(N)=O Amb8858551 [0,0,1,0,1,0|2,0,0]=4 9234 B9R1.41 Cc1ocnc1C(=O)O Amb10067408 [0,0,1,0,1,0|2,0,0]=4 9235 B9R1.41 Cc1oncc1C(=O)O Amb2371765 [0,0,1,0,1,0|2,0,0]=4 9236 B9R1.41 Cc1sccc1C(=O)Cl Amb25320759 [0,0,1,0,1,0|2,0,0]=4 9237 B9R1.41 Cc1sccc1C(=O)O Amb2447618 [0,0,1,0,1,0|1,0,0]=3 9238 B9R1.41 Cc1sccc1C(N)=O Amb8496178 [0,0,1,0,1,0|2,0,0]=4 9239 B9R1.41 Cc1scnc1C(=O)O Amb10067521 [0,0,1,0,1,0|2,0,0]=4 9240 B9R1.41 Cc1sncc1C(=O)O Amb18202488 [0,0,1,0,1,0|2,0,0]=4 9241 B9R1.41 Cn1cccc1C(=O)O Amb1151288 [0,0,1,0,1,0|1,0,0]=3 9242 B9R1.41 Cn1cccc1C(N)=O Amb2604322 [0,0,1,0,1,0|2,0,0]=4 9243 B9R1.41 Cn1ccnc1C(=O)O Amb1107172 [0,0,1,0,1,0|2,0,0]=4 9244 B9R1.41 Cn1cncc1C(=O)O Amb2723356 [0,0,1,0,1,0|2,0,0]=4 9245 B9R1.41 Cn1nccc1C(=O)O Amb1068318 [0,0,1,0,1,0|2,0,0]=4 9246 B9R1.41 Nc1ccoc1C(=O)O Amb18832709 [0,0,1,0,1,0|2,0,0]=4 9247 B9R1.41 Nc1ccsc1C(=O)O Amb19888389 [0,0,1,0,1,0|2,0,0]=4 9248 B9R1.41 Nc1ccsc1C(=O)O Amb2695071 [0,0,1,0,1,0|2,0,0]=4 9249 B9R1.41 Nc1cscc1C(=O)O Amb10071408 [0,0,1,0,1,0|2,0,0]=4 9250 B9R1.41 Nc1sccc1C(=O)O Amb4296914 [0,0,1,0,1,0|2,0,0]=4 9251 B9R1.41 Nn1cccc1C(=O)O Amb28143308 [0,0,1,0,1,0|2,0,0]=4 9252 B9R1.41 O=C(O)C1=CC=CC1Cl Amb27780445 [0,0,1,0,1,0|1,0,1]=4 9253 B9R1.41 O=C(O)c1ccoc1Br Amb33544509 [0,0,1,0,1,0|2,0,0]=4 9254 B9R1.41 O=C(O)c1ccoc1Cl Amb25731243 [0,0,1,0,1,0|2,0,0]=4 9255 B9R1.41 O=C(O)c1ccoc1F Amb27241158 [0,0,1,0,1,0|2,0,0]=4 9256 B9R1.41 O=C(O)c1ccoc1I Amb25889545 [0,0,1,0,1,0|2,0,0]=4 9257 B9R1.41 O=C(O)c1ccsc1Br Amb2724056 [0,0,1,0,1,0|2,0,0]=4 9258 B9R1.41 O=C(O)c1ccsc1Cl Amb10576176 [0,0,1,0,1,0|2,0,0]=4 9259 B9R1.41 O=C(O)c1ccsc1F Amb2611690 [0,0,1,0,1,0|2,0,0]=4 9260 B9R1.41 O=C(O)c1ccsc1I Amb24741705 [0,0,1,0,1,0|2,0,0]=4 9261 B9R1.41 O=C(O)c1cocc1Br Amb27454338 [0,0,1,0,1,0|2,0,0]=4 9262 B9R1.41 O=C(O)c1cocc1Cl Amb18202241 [0,0,1,0,1,0|2,0,0]=4 9263 B9R1.41 O=C(O)c1cscc1Br Amb33548878 [0,0,1,0,1,0|2,0,0]=4 9264 B9R1.41 O=C(O)c1cscc1Cl Amb5720835 [0,0,1,0,1,0|2,0,0]=4 9265 B9R1.41 O=C(O)c1cscc1F Amb28364282 [0,0,1,0,1,0|2,0,0]=4 9266 B9R1.41 O=C(O)c1cscc1I Amb27235489 [0,0,1,0,1,0|2,0,0]=4 9267 B9R1.41 O=C(O)c1cscc1O Amb18124673 [0,0,1,0,1,0|2,0,0]=4 9268 B9R1.41 O=C(O)c1cscc1S Amb18126245 [0,0,1,0,1,0|2,0,0]=4 9269 B9R1.41 O=C(O)c1occc1Br Amb7990094 [0,0,1,0,1,0|2,0,0]=4 9270 B9R1.41 O=C(O)c1occc1Cl Amb18202245 [0,0,1,0,1,0|2,0,0]=4 9271 B9R1.41 O=C(O)c1occc1F Amb26497027 [0,0,1,0,1,0|2,0,0]=4 9272 B9R1.41 O=C(O)c1sccc1Br Amb2685506 [0,0,1,0,1,0|2,0,0]=4 9273 B9R1.41 O=C(O)c1sccc1Cl Amb2686485 [0,0,1,0,1,0|2,0,0]=4 9274 B9R1.41 O=C(O)c1sccc1F Amb33542984 [0,0,1,0,1,0|2,0,0]=4 9275 B9R1.41 O=C(O)c1sccc1I Amb2688890 [0,0,1,0,1,0|2,0,0]=4 9276 B9R1.41 O=C(O)c1sccc1O Amb10069920 [0,0,1,0,1,0|2,0,0]=4 9277 B9R1.50 O=C1C=CC=CCC=C1 Amb27260505 [0,0,1,0,1,0|0,0,2]=4 9278 B9R1.50 O=C1C=CC=CCCC1 Amb27164621 [0,0,1,0,1,0|0,0,2]=4 9279 B9R1.50 O=C1C=CCC=CCC1 Amb28207621 [0,0,1,0,1,0|0,0,2]=4 9280 B9R1.50 O=C1C=CCCC=CC1 Amb22365234 [0,0,1,0,1,0|0,0,2]=4 9281 B9R1.50 O=C1CC=CCC=CC1 Amb22365229 [0,0,1,0,1,0|0,0,2]=4 9282 B9R2.3 C1=NCc2ccsc21 Amb27828755 [1,0,0,0,1,0|2,0,0]=4 9283 B9R2.50 C1=Cc2ccccc21 Amb19515942 [1,0,0,0,1,0|0,0,1]=3 9284 B9R2.50 C1=Nc2ccncc21 Amb27490817 [1,0,0,0,1,0|2,0,0]=4 9285 B9R2.50 c1ccc2c(c1)CC2 Amb17778802 [1,0,0,0,1,0|0,0,1]=3 9286 B9R2.50 c1ccc2c(c1)CN2 Amb27460936 [1,0,0,0,1,0|1,0,0]=3 9287 B11R1.852 C=CC(=O)C1=CC=CC=CC1 Amb27854918 [0,0,1,0,0,1|1,0,1]=4 9288 B11R1.852 COC(=O)C1=C=NC=CC=C1 Amb24736682 [0,0,1,0,0,1|0,0,1]=3 9289 B11R1.852 COC(=O)C1=CC=C=CC=C1 Amb24060625 [0,0,1,0,0,1|0,0,0]=2 9290 B11R1.852 COC(=O)C1=CC=CC=CC1 Amb27229360 [0,0,1,0,0,1|0,0,0]=2 9291 B11R1.852 COC(=O)C1=CC=CC=CO1 Amb27227839 [0,0,1,0,0,1|0,0,0]=2 9292 B11R1.852 COC(=O)C1=CCC=CC=C1 Amb28315041 [0,0,1,0,0,1|0,0,0]=2 9293 B11R1.852 COC(=O)C1C=CC=CCC1 Amb26475872 [0,0,1,0,0,1|0,0,2]=4 9294 B11R1.852 COC(=O)N1C=CC=CC=N1 Amb24422879 [0,0,1,0,0,1|1,0,0]=3 9295 B11R1.852 COC(=O)N1C=CC=CCC1 Amb27476140 [0,0,1,0,0,1|1,0,1]=4 9296 B11R1.852 COC(=O)N1C=CCCC=C1 Amb27658838 [0,0,1,0,0,1|1,0,1]=4 9297 B11R1.852 O=C(NO)C1=CC=CC=CC1 Amb25225570 [0,0,1,0,0,1|2,0,0]=4 9298 B11R1.203 O=CCCC1C=CC=CC=C1 Amb27401095 [0,0,1,0,0,1|1,0,1]=4 9299 B11R1.51 COC1=CC=CCC=C1C=O Amb27401190 [0,0,1,0,0,1|2,0,0]=4 9300 B11R1.383 C#CC1=CC=CC=C(C=O)C1 Amb27471853 [0,0,1,0,0,1|1,0,1]=4 9301 B11R1.383 C=CC1=CC=CC=C(C=O)C1 Amb24509238 [0,0,1,0,0,1|1,0,1]=4 9302 B11R1.383 O=CC1=CC=CC=C(CO)C1 Amb27947288 [0,0,1,0,0,1|0,0,0]=2 9303 B11R1.383 OCC1=CC=CC=C(CO)C1 Amb27662229 [0,0,1,0,0,1|0,0,2]=4 9304 B11R1.383 OCC1=CC=CC=C(CO)O1 Amb28182623 [0,0,1,0,0,1|0,0,2]=4 9305 B11R1.86 CC(=N)Nc1ccccc1C Amb27644968 [0,0,1,0,0,1|2,0,0]=4 9306 B11R1.86 CC(=O)C[n+]1ccccc1C Amb2587647 [0,0,1,0,0,1|2,0,0]=4 9307 B11R1.86 CC(=O)Cc1ccccc1Br Amb6365737 [0,0,1,0,0,1|2,0,0]=4 9308 B11R1.86 CC(=O)Cc1ccccc1C Amb5751053 [0,0,1,0,0,1|1,0,0]=3 9309 B11R1.86 CC(=O)Cc1ccccc1Cl Amb2724208 [0,0,1,0,0,1|2,0,0]=4 9310 B11R1.86 CC(=O)Cc1ccccc1F Amb5751055 [0,0,1,0,0,1|2,0,0]=4 9311 B11R1.86 CC(=O)Cc1ccccc1I Amb24431271 [0,0,1,0,0,1|2,0,0]=4 9312 B11R1.86 CC(=O)Cc1ccccc1N Amb8439140 [0,0,1,0,0,1|2,0,0]=4 9313 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [0,0,1,0,0,1|2,0,0]=4 9314 B11R1.86 CC(=O)Cc1cccnc1C Amb32880144 [0,0,1,0,0,1|2,0,0]=4 9315 B11R1.86 CC(=O)Cc1ccncc1C Amb33172422 [0,0,1,0,0,1|2,0,0]=4 9316 B11R1.86 CC(=O)Cc1cnccc1C Amb33376248 [0,0,1,0,0,1|2,0,0]=4 9317 B11R1.86 CC(=O)Cc1ncccc1C Amb1995156 [0,0,1,0,0,1|2,0,0]=4 9318 B11R1.86 CC(=O)Nc1ccccc1Br Amb2611397 [0,0,1,0,0,1|2,0,0]=4 9319 B11R1.86 CC(=O)Nc1ccccc1C Amb6346350 [0,0,1,0,0,1|1,0,0]=3 9320 B11R1.86 CC(=O)Nc1ccccc1Cl Amb6349758 [0,0,1,0,0,1|2,0,0]=4 9321 B11R1.86 CC(=O)Nc1ccccc1F Amb2444091 [0,0,1,0,0,1|2,0,0]=4 9322 B11R1.86 CC(=O)Nc1ccccc1I Amb2652722 [0,0,1,0,0,1|2,0,0]=4 9323 B11R1.86 CC(=O)Nc1ccccc1N Amb1121033 [0,0,1,0,0,1|2,0,0]=4 9324 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [0,0,1,0,0,1|2,0,0]=4 9325 B11R1.86 CC(=O)Nc1ccccc1S Amb16186713 [0,0,1,0,0,1|2,0,0]=4 9326 B11R1.86 CC(=O)Nc1cccnc1C Amb22750736 [0,0,1,0,0,1|2,0,0]=4 9327 B11R1.86 CC(=O)Nc1ccncc1C Amb20248230 [0,0,1,0,0,1|2,0,0]=4 9328 B11R1.86 CC(=O)Nc1cnccc1C Amb5492735 [0,0,1,0,0,1|2,0,0]=4 9329 B11R1.86 CC(=O)Nc1ncccc1C Amb3361417 [0,0,1,0,0,1|2,0,0]=4 9330 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [0,0,1,0,0,1|2,0,0]=4 9331 B11R1.86 CC(=O)Oc1ccccc1Cl Amb3123033 [0,0,1,0,0,1|2,0,0]=4 9332 B11R1.86 CC(=O)Oc1ccccc1F Amb10605688 [0,0,1,0,0,1|2,0,0]=4 9333 B11R1.86 CC(=O)Oc1ccccc1I Amb10975213 [0,0,1,0,0,1|2,0,0]=4 9334 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [0,0,1,0,0,1|2,0,0]=4 9335 B11R1.86 CC(=O)Sc1ccccc1C Amb25189277 [0,0,1,0,0,1|1,0,0]=3 9336 B11R1.86 CC(=S)Nc1ccccc1C Amb26568449 [0,0,1,0,0,1|1,1,0]=4 9337 B11R1.86 Cc1cccc[n+]1CC(=O)O Amb26371547 [0,0,1,0,0,1|1,0,0]=3 9338 B11R1.86 Cc1cccc[n+]1CC(N)=O Amb10567653 [0,0,1,0,0,1|2,0,0]=4 9339 B11R1.86 Cc1ccccc1CC(=N)N Amb2696413 [0,0,1,0,0,1|2,0,0]=4 9340 B11R1.86 Cc1ccccc1CC(=N)N Amb33549015 [0,0,1,0,0,1|2,0,0]=4 9341 B11R1.86 Cc1ccccc1CC(=O)Cl Amb2690618 [0,0,1,0,0,1|1,0,0]=3 9342 B11R1.86 Cc1ccccc1CC(=O)O Amb2609430 [0,0,1,0,0,1|0,0,0]=2 9343 B11R1.86 Cc1ccccc1CC(C)O Amb17138429 [0,0,1,0,0,1|1,0,1]=4 9344 B11R1.86 Cc1ccccc1CC(N)=O Amb2107849 [0,0,1,0,0,1|1,0,0]=3 9345 B11R1.86 Cc1ccccc1CC(N)=S Amb6247953 [0,0,1,0,0,1|1,1,0]=4 9346 B11R1.86 Cc1ccccc1CN(C)O Amb33360855 [0,0,1,0,0,1|2,0,0]=4 9347 B11R1.86 Cc1ccccc1CS(=O)[O-] Amb32754239 [0,0,1,0,0,1|1,0,1]=4 9348 B11R1.86 Cc1ccccc1CS(C)=O Amb27261207 [0,0,1,0,0,1|2,0,0]=4 9349 B11R1.86 Cc1ccccc1C[C@@H](C)O Amb24432685 [0,0,1,0,0,1|1,0,1]=4 9350 B11R1.86 Cc1ccccc1C[C@H](C)O Amb33360564 [0,0,1,0,0,1|1,0,1]=4 9351 B11R1.86 Cc1ccccc1C[N+](=O)[O-] Amb33360172 [0,0,1,0,0,1|1,0,1]=4 9352 B11R1.86 Cc1ccccc1NC(=N)N Amb17505553 [0,0,1,0,0,1|2,0,0]=4 9353 B11R1.86 Cc1ccccc1NC(=N)N Amb9175311 [0,0,1,0,0,1|2,0,0]=4 9354 B11R1.86 Cc1ccccc1NC(N)=O Amb6357971 [0,0,1,0,0,1|1,0,0]=3 9355 B11R1.86 Cc1ccccc1NC(N)=S Amb1350449 [0,0,1,0,0,1|1,1,0]=4 9356 B11R1.86 Cc1ccccc1OC(=O)Cl Amb24055454 [0,0,1,0,0,1|1,0,0]=3 9357 B11R1.86 Cc1ccccc1OC(=S)Cl Amb24533218 [0,0,1,0,0,1|1,1,0]=4 9358 B11R1.86 Cc1ccccc1OC(N)=S Amb27657598 [0,0,1,0,0,1|1,1,0]=4 9359 B11R1.86 Cc1ccccc1SC(N)=O Amb27951930 [0,0,1,0,0,1|1,0,0]=3 9360 B11R1.86 Cc1cccnc1CC(=O)O Amb20247885 [0,0,1,0,0,1|1,0,0]=3 9361 B11R1.86 Cc1cccnc1CC(=O)O Amb22587588 [0,0,1,0,0,1|1,0,0]=3 9362 B11R1.86 Cc1cccnc1NC(N)=O Amb25708319 [0,0,1,0,0,1|2,0,0]=4 9363 B11R1.86 Cc1ccncc1CC(=O)O Amb18201752 [0,0,1,0,0,1|1,0,0]=3 9364 B11R1.86 Cc1ccncc1CC(=O)O Amb32666498 [0,0,1,0,0,1|1,0,0]=3 9365 B11R1.86 Cc1ccncc1CC(N)=O Amb27872481 [0,0,1,0,0,1|2,0,0]=4 9366 B11R1.86 Cc1ccncc1NC(=O)Cl Amb35625780 [0,0,1,0,0,1|2,0,0]=4 9367 B11R1.86 Cc1ccncc1OC(=O)Cl Amb33297323 [0,0,1,0,0,1|2,0,0]=4 9368 B11R1.86 Cc1cnccc1CC(=O)O Amb33249640 [0,0,1,0,0,1|1,0,0]=3 9369 B11R1.86 Cc1cnccc1CC(N)=O Amb28065792 [0,0,1,0,0,1|2,0,0]=4 9370 B11R1.86 Cc1cnccc1OC(=O)Cl Amb33297404 [0,0,1,0,0,1|2,0,0]=4 9371 B11R1.86 Cc1ncccc1CC(=O)O Amb18215698 [0,0,1,0,0,1|1,0,0]=3 9372 B11R1.86 Cc1ncccc1CC(=O)O Amb28652864 [0,0,1,0,0,1|1,0,0]=3 9373 B11R1.86 Cc1ncccc1CC(N)=O Amb27471982 [0,0,1,0,0,1|2,0,0]=4 9374 B11R1.86 Cc1ncccc1NC(=O)Cl Amb35625661 [0,0,1,0,0,1|2,0,0]=4 9375 B11R1.86 Cc1ncccc1NC(N)=O Amb28047100 [0,0,1,0,0,1|2,0,0]=4 9376 B11R1.86 Cc1ncccc1OC(=O)Cl Amb25303759 [0,0,1,0,0,1|2,0,0]=4 9377 B11R1.86 Cc1nccnc1CC(=O)O Amb18201468 [0,0,1,0,0,1|2,0,0]=4 9378 B11R1.86 Cc1ncncc1CC(=O)O Amb8009478 [0,0,1,0,0,1|2,0,0]=4 9379 B11R1.86 N=C1C=CC=CN1CC(=O)O Amb19888680 [0,0,1,0,0,1|2,0,0]=4 9380 B11R1.86 NC(=O)Cc1ccccc1Br Amb2754651 [0,0,1,0,0,1|2,0,0]=4 9381 B11R1.86 NC(=O)Cc1ccccc1Cl Amb33551592 [0,0,1,0,0,1|2,0,0]=4 9382 B11R1.86 NC(=O)Cc1ccccc1F Amb33551560 [0,0,1,0,0,1|2,0,0]=4 9383 B11R1.86 NC(=O)Cc1ccccc1I Amb24685113 [0,0,1,0,0,1|2,0,0]=4 9384 B11R1.86 NC(=O)Cc1ccccc1N Amb1116123 [0,0,1,0,0,1|2,0,0]=4 9385 B11R1.86 NC(=O)Cc1ccccc1O Amb4020853 [0,0,1,0,0,1|2,0,0]=4 9386 B11R1.86 NC(=O)Nc1ccccc1Br Amb1140530 [0,0,1,0,0,1|2,0,0]=4 9387 B11R1.86 NC(=O)Nc1ccccc1Cl Amb1131193 [0,0,1,0,0,1|2,0,0]=4 9388 B11R1.86 NC(=O)Nc1ccccc1F Amb1211836 [0,0,1,0,0,1|2,0,0]=4 9389 B11R1.86 NC(=O)Nc1ccccc1N Amb1114330 [0,0,1,0,0,1|2,0,0]=4 9390 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [0,0,1,0,0,1|2,0,0]=4 9391 B11R1.86 NC(=O)Oc1ccccc1O Amb27148270 [0,0,1,0,0,1|2,0,0]=4 9392 B11R1.86 Nc1ccccc1CC(=O)O Amb5519014 [0,0,1,0,0,1|1,0,0]=3 9393 B11R1.86 Nc1ncccc1CC(=O)O Amb21962140 [0,0,1,0,0,1|2,0,0]=4 9394 B11R1.86 Nc1ncccc1CC(=O)O Amb28652875 [0,0,1,0,0,1|2,0,0]=4 9395 B11R1.86 O=C(Cl)Cc1ccccc1Br Amb3939380 [0,0,1,0,0,1|2,0,0]=4 9396 B11R1.86 O=C(Cl)Cc1ccccc1Cl Amb6743385 [0,0,1,0,0,1|2,0,0]=4 9397 B11R1.86 O=C(Cl)Cc1ccccc1F Amb2608188 [0,0,1,0,0,1|2,0,0]=4 9398 B11R1.86 O=C(Cl)Cc1ccccc1I Amb28368335 [0,0,1,0,0,1|2,0,0]=4 9399 B11R1.86 O=C(Cl)Cc1ccccc1O Amb27477566 [0,0,1,0,0,1|2,0,0]=4 9400 B11R1.86 O=C(Cl)Nc1ccccc1Br Amb35636931 [0,0,1,0,0,1|2,0,0]=4 9401 B11R1.86 O=C(Cl)Nc1ccccc1Cl Amb27653292 [0,0,1,0,0,1|2,0,0]=4 9402 B11R1.86 O=C(Cl)Nc1ccccc1F Amb35637035 [0,0,1,0,0,1|2,0,0]=4 9403 B11R1.86 O=C(Cl)Nc1ccccc1I Amb35637031 [0,0,1,0,0,1|2,0,0]=4 9404 B11R1.86 O=C(Cl)Oc1ccccc1Br Amb28365355 [0,0,1,0,0,1|2,0,0]=4 9405 B11R1.86 O=C(Cl)Oc1ccccc1Cl Amb10844668 [0,0,1,0,0,1|2,0,0]=4 9406 B11R1.86 O=C(Cl)Oc1ccccc1F Amb26641132 [0,0,1,0,0,1|2,0,0]=4 9407 B11R1.86 O=C(Cl)Oc1ccccc1I Amb28313136 [0,0,1,0,0,1|2,0,0]=4 9408 B11R1.86 O=C(Cl)Sc1ccccc1Cl Amb32679650 [0,0,1,0,0,1|2,0,0]=4 9409 B11R1.86 O=C(Cl)Sc1ccccc1F Amb2688333 [0,0,1,0,0,1|2,0,0]=4 9410 B11R1.86 O=C(O)CC1=CC=CNC1=O Amb18925114 [0,0,1,0,0,1|2,0,0]=4 9411 B11R1.86 O=C(O)CC1=CNC=CC1=O Amb25684519 [0,0,1,0,0,1|2,0,0]=4 9412 B11R1.86 O=C(O)CN1C=CC=CC1=O Amb18536106 [0,0,1,0,0,1|2,0,0]=4 9413 B11R1.86 O=C(O)C[n+]1ccccc1O Amb27233666 [0,0,1,0,0,1|2,0,0]=4 9414 B11R1.86 O=C(O)Cc1ccccc1Br Amb1139894 [0,0,1,0,0,1|1,0,0]=3 9415 B11R1.86 O=C(O)Cc1ccccc1Cl Amb6365808 [0,0,1,0,0,1|1,0,0]=3 9416 B11R1.86 O=C(O)Cc1ccccc1F Amb2688300 [0,0,1,0,0,1|1,0,0]=3 9417 B11R1.86 O=C(O)Cc1ccccc1I Amb2754650 [0,0,1,0,0,1|1,0,0]=3 9418 B11R1.86 O=C(O)Cc1ccccc1O Amb2388914 [0,0,1,0,0,1|1,0,0]=3 9419 B11R1.86 O=C(O)Cc1ccccc1S Amb17616851 [0,0,1,0,0,1|1,0,0]=3 9420 B11R1.86 O=C(O)Cc1cccnc1Br Amb25834640 [0,0,1,0,0,1|2,0,0]=4 9421 B11R1.86 O=C(O)Cc1cccnc1Cl Amb8630440 [0,0,1,0,0,1|2,0,0]=4 9422 B11R1.86 O=C(O)Cc1cccnc1F Amb20247892 [0,0,1,0,0,1|2,0,0]=4 9423 B11R1.86 O=C(O)Cc1ccncc1Br Amb23586154 [0,0,1,0,0,1|2,0,0]=4 9424 B11R1.86 O=C(O)Cc1ccncc1Cl Amb18198379 [0,0,1,0,0,1|2,0,0]=4 9425 B11R1.86 O=C(O)Cc1ccncc1Cl Amb28872303 [0,0,1,0,0,1|2,0,0]=4 9426 B11R1.86 O=C(O)Cc1ccncc1F Amb24379723 [0,0,1,0,0,1|2,0,0]=4 9427 B11R1.86 O=C(O)Cc1cnccc1Cl Amb18198378 [0,0,1,0,0,1|2,0,0]=4 9428 B11R1.86 O=C(O)Cc1cnccc1Cl Amb28872302 [0,0,1,0,0,1|2,0,0]=4 9429 B11R1.86 O=C(O)Cc1cnccc1O Amb33547475 [0,0,1,0,0,1|2,0,0]=4 9430 B11R1.86 O=C(O)Cc1ncccc1Br Amb20247878 [0,0,1,0,0,1|2,0,0]=4 9431 B11R1.86 O=C(O)Cc1ncccc1Br Amb20247879 [0,0,1,0,0,1|2,0,0]=4 9432 B11R1.86 O=C(O)Cc1ncccc1Cl Amb19516058 [0,0,1,0,0,1|2,0,0]=4 9433 B11R1.86 O=C(O)Cc1ncccc1F Amb20247871 [0,0,1,0,0,1|2,0,0]=4 9434 B11R1.86 O=C(O)Cc1ncccc1F Amb33204428 [0,0,1,0,0,1|2,0,0]=4 9435 B11R1.86 O=C(O)Cc1ncccc1O Amb18125512 [0,0,1,0,0,1|2,0,0]=4 9436 B11R1.86 O=C(O)Cc1ncccc1O Amb20247882 [0,0,1,0,0,1|2,0,0]=4 9437 B11R1.86 O=S(O)Cc1ccccc1F Amb27640525 [0,0,1,0,0,1|2,0,0]=4 9438 B11R1.86 O=[PH](O)Oc1ccccc1O Amb28122429 [0,0,1,0,0,1|2,0,0]=4 9439 B11R1.143 CC(=O)C1=CC=CC=CC1=O Amb27470828 [0,0,1,0,0,1|2,0,0]=4 9440 B11R1.143 O=C(Cl)C1=CC=CC=CC1=O Amb27184116 [0,0,1,0,0,1|2,0,0]=4 9441 B11R1.143 O=C(O)C1C=CC=CNC1=O Amb25950015 [0,0,1,0,0,1|1,0,1]=4 9442 B11R1.497 NC(=O)C1=CC(=O)C=CC=C1 Amb25861229 [0,0,1,0,0,1|2,0,0]=4 9443 B11R1.101 O=C1C=CC=CC=CC=CC1 Amb26062133 [0,0,1,0,0,1|1,0,1]=4 9444 B13R2.33 C=C1CNc2ccccc2CO1 Amb27669840 [0,0,0,0,0,2|1,0,0]=3 9445 B13R2.33 CC1=NCc2ccccc2CN1 Amb25970914 [0,0,0,0,0,2|2,0,0]=4 9446 B13R2.33 O=C1C=Cc2ccccc2C=C1 Amb21952910 [0,0,0,0,0,2|1,0,1]=4 9447 B13R2.33 O=C1C=Cc2ccccc2CC1 Amb17593958 [0,0,0,0,0,2|1,0,0]=3 9448 B13R2.33 O=C1C=Cc2ccccc2CN1 Amb8630983 [0,0,0,0,0,2|1,0,0]=3 9449 B13R2.33 O=C1C=Cc2ccccc2OC1 Amb27175937 [0,0,0,0,0,2|1,0,1]=4 9450 B13R2.33 O=C1C=Nc2ccccc2C=N1 Amb22489908 [0,0,0,0,0,2|1,0,1]=4 9451 B13R2.33 O=C1C=Nc2ccccc2CN1 Amb27643583 [0,0,0,0,0,2|1,0,0]=3 9452 B13R2.33 O=C1CCc2ccccc2CC1 Amb6359959 [0,0,0,0,0,2|1,0,0]=3 9453 B13R2.33 O=C1CCc2ccccc2CN1 Amb610462 [0,0,0,0,0,2|1,0,0]=3 9454 B13R2.33 O=C1CCc2ccccc2OC1 Amb26925695 [0,0,0,0,0,2|1,0,0]=3 9455 B13R2.33 O=C1CCc2cccnc2CC1 Amb26546938 [0,0,0,0,0,2|2,0,0]=4 9456 B13R2.33 O=C1CCc2cccnc2CC1 Amb32663810 [0,0,0,0,0,2|2,0,0]=4 9457 B13R2.33 O=C1CNc2ccccc2CN1 Amb17620443 [0,0,0,0,0,2|1,0,0]=3 9458 B13R2.33 O=C1CNc2ccccc2NC1 Amb27416454 [0,0,0,0,0,2|2,0,0]=4 9459 B13R2.33 O=C1CNc2ncccc2CN1 Amb23580219 [0,0,0,0,0,2|2,0,0]=4 9460 B13R2.33 O=C1COc2ccccc2CN1 Amb2137257 [0,0,0,0,0,2|1,0,0]=3 9461 B13R2.33 O=C1COc2ccccc2SC1 Amb27616915 [0,0,0,0,0,2|2,0,0]=4 9462 B13R2.163 N=C1CCCc2ccccc2N1 Amb8507493 [0,0,0,0,0,2|2,0,0]=4 9463 B13R2.163 NC1=Nc2ccccc2SCC1 Amb348306 [0,0,0,0,0,2|2,0,0]=4 9464 B13R2.163 O=C1C=CNc2ccccc2N1 Amb17750236 [0,0,0,0,0,2|1,0,1]=4 9465 B13R2.163 O=C1CCCc2ccccc2C1 Amb6360022 [0,0,0,0,0,2|1,0,0]=3 9466 B13R2.163 O=C1CCCc2ccccc2N1 Amb1077569 [0,0,0,0,0,2|1,0,0]=3 9467 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,0,0,0,0,2|1,0,0]=3 9468 B13R2.163 O=C1CCCc2cccnc2N1 Amb21962431 [0,0,0,0,0,2|2,0,0]=4 9469 B13R2.163 O=C1CCCc2ccncc2N1 Amb28074006 [0,0,0,0,0,2|2,0,0]=4 9470 B13R2.163 O=C1CCCc2ncccc2N1 Amb28319382 [0,0,0,0,0,2|2,0,0]=4 9471 B13R2.163 O=C1CCNc2ccccc2C1 Amb18829955 [0,0,0,0,0,2|1,0,0]=3 9472 B13R2.163 O=C1CCNc2ccccc2N1 Amb1666975 [0,0,0,0,0,2|1,0,0]=3 9473 B13R2.163 O=C1CCNc2ccncc2N1 Amb28145954 [0,0,0,0,0,2|2,0,0]=4 9474 B13R2.163 O=C1CCNc2cnccc2N1 Amb18829381 [0,0,0,0,0,2|2,0,0]=4 9475 B13R2.163 O=C1CCNc2ncccc2N1 Amb19514879 [0,0,0,0,0,2|2,0,0]=4 9476 B13R2.163 O=C1CCOc2ccccc2C1 Amb24352115 [0,0,0,0,0,2|1,0,0]=3 9477 B13R2.163 O=C1CCOc2ccccc2N1 Amb10608982 [0,0,0,0,0,2|1,0,0]=3 9478 B13R2.163 O=C1CCSc2ccccc2C1 Amb25878594 [0,0,0,0,0,2|1,0,0]=3 9479 B13R2.163 O=C1CCSc2ccccc2N1 Amb1154582 [0,0,0,0,0,2|1,0,0]=3 9480 B13R2.163 O=C1CNCc2ccccc2N1 Amb17606145 [0,0,0,0,0,2|1,0,0]=3 9481 B13R2.163 O=C1CNCc2ccccc2N1 Amb28872408 [0,0,0,0,0,2|1,0,0]=3 9482 B13R2.163 O=C1CNCc2cccnc2N1 Amb25104741 [0,0,0,0,0,2|2,0,0]=4 9483 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [0,0,0,0,0,2|0,0,0]=2 9484 B13R2.163 O=C1Cc2ccccc2C=CN1 Amb9798874 [0,0,0,0,0,2|1,0,1]=4 9485 B13R2.163 O=C1Cc2ccccc2CCN1 Amb16203437 [0,0,0,0,0,2|1,0,0]=3 9486 B13R2.163 O=C1NCCc2ccccc2N1 Amb25869873 [0,0,0,0,0,2|1,0,0]=3 9487 B13R2.163 O=C1Nc2ccccc2C=NO1 Amb28255633 [0,0,0,0,0,2|0,0,1]=3 9488 B13R2.163 O=C1OC=Nc2ccccc2O1 Amb24376626 [0,0,0,0,0,2|0,0,1]=3 9489 B13R2.163 S=C1CCOc2ccccc2N1 Amb27974673 [0,0,0,0,0,2|1,1,0]=4 9490 B13R2.336 O=C1NC=CC2=CC=CC=C1C2 Amb27449234 [0,0,0,0,0,2|1,0,1]=4 9491 B13R2.5252 BrC1=CCCOc2ccccc21 Amb27649074 [0,0,0,0,0,2|2,0,0]=4 9492 B13R2.5252 C=C1CCCCc2ccccc21 Amb23400875 [0,0,0,0,0,2|2,0,0]=4 9493 B13R2.5252 C=C1CCCOc2ccccc21 Amb19316319 [0,0,0,0,0,2|2,0,0]=4 9494 B13R2.5252 CC1=CCCCc2ccccc21 Amb27986008 [0,0,0,0,0,2|2,0,0]=4 9495 B13R2.5252 CC1=CCCNc2ccccc21 Amb28077152 [0,0,0,0,0,2|2,0,0]=4 9496 B13R2.5252 O=C1C=CC=Cc2ccccc21 Amb22543219 [0,0,0,0,0,2|1,0,1]=4 9497 B13R2.5252 O=C1CCC=Cc2ccccc21 Amb27802729 [0,0,0,0,0,2|1,0,0]=3 9498 B13R2.5252 O=C1CCCCc2ccccc21 Amb1208402 [0,0,0,0,0,2|1,0,0]=3 9499 B13R2.5252 O=C1CCCNc2ccccc21 Amb2690546 [0,0,0,0,0,2|1,0,0]=3 9500 B13R2.5252 O=C1CCCNc2ncccc21 Amb24664337 [0,0,0,0,0,2|2,0,0]=4 9501 B13R2.5252 O=C1CCCOc2ccccc21 Amb33545871 [0,0,0,0,0,2|1,0,0]=3 9502 B13R2.5252 O=C1CCCSc2ccccc21 Amb33545887 [0,0,0,0,0,2|1,0,0]=3 9503 B13R2.5252 O=C1CCNCc2ccccc21 Amb22499160 [0,0,0,0,0,2|1,0,0]=3 9504 B13R2.5252 O=C1CCNCc2ccccc21 Amb32405167 [0,0,0,0,0,2|1,0,0]=3 9505 B13R2.5252 O=C1CCSCc2ccccc21 Amb27177930 [0,0,0,0,0,2|0,1,0]=3 9506 B13R2.5252 O=C1CNCCc2ccccc21 Amb27389469 [0,0,0,0,0,2|1,0,0]=3 9507 B13R2.5252 O=C1CSCCc2ccccc21 Amb20668935 [0,0,0,0,0,2|0,1,0]=3 9508 B13R2.5252 O=C1N=CCOc2ccccc21 Amb27481084 [0,0,0,0,0,2|1,0,0]=3 9509 B13R2.5252 O=C1NCC=Nc2ccccc21 Amb23592207 [0,0,0,0,0,2|1,0,0]=3 9510 B13R2.5252 O=C1NCCCc2ccccc21 Amb33544472 [0,0,0,0,0,2|1,0,0]=3 9511 B13R2.5252 O=C1NCCCc2cnccc21 Amb27755727 [0,0,0,0,0,2|2,0,0]=4 9512 B13R2.5252 O=C1NCCNc2ccccc21 Amb19958708 [0,0,0,0,0,2|1,0,0]=3 9513 B13R2.5252 O=C1NCCNc2cnccc21 Amb27208710 [0,0,0,0,0,2|2,0,0]=4 9514 B13R2.5252 O=C1NCCOc2ccccc21 Amb2445337 [0,0,0,0,0,2|1,0,0]=3 9515 B13R2.5252 O=C1NCCSc2ccccc21 Amb6360540 [0,0,0,0,0,2|1,0,0]=3 9516 B13R2.5252 O=C1NN=COc2ccccc21 Amb2416930 [0,0,0,0,0,2|1,0,1]=4 9517 B13R2.5252 O=C1OCCNc2ccncc21 Amb27770034 [0,0,0,0,0,2|1,0,0]=3 9518 B13R2.5252 O=S1CCCNc2ccccc21 Amb19337771 [0,0,0,0,0,2|2,0,0]=4