0 B9R1.6 C=C(C)C1=CC=NC=C1 MC111872 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.6 C=C(F)C1=CC=CC=C1 MC102770 [0,0,0,0,0,0|1,0,2]=3 2 B9R1.6 CC(=O)C1=CC=CC=C1 MC41221 [0,0,0,0,0,0|0,0,2]=2 3 B9R1.6 CC(=O)C1=CC=CN=C1 CS18256 [0,0,0,0,0,0|1,0,2]=3 4 B9R1.6 CC(=O)C1=CC=CN=N1 MC444225 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.6 CC(=O)C1=CC=NC=C1 CS22535 [0,0,0,0,0,0|1,0,2]=3 6 B9R1.6 CC(=O)C1=CN=CN=C1 MC444371 [0,0,0,0,0,0|2,0,2]=4 7 B9R1.6 CC(=O)C1=CN=NC=C1 MC444309 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.6 CC(=O)C1=NC=CC=C1 CS18611 [0,0,0,0,0,0|1,0,2]=3 9 B9R1.6 CC(=O)C1=NC=CC=N1 MC444159 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.6 CC(=O)C1=NC=CN=C1 CS19346 [0,0,0,0,0,0|2,0,2]=4 11 B9R1.6 CC(=O)C1=NC=NC=C1 MC442362 [0,0,0,0,0,0|2,0,2]=4 12 B9R1.6 CC(Br)C1=CC=CC=C1 MC40570 [0,0,0,0,0,0|1,0,0]=1 13 B9R1.6 CC(C)C1=NC=CC=C1 CS21621 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 CC(N)C1=CC=CC=C1 CS10551 [0,0,0,0,0,0|1,0,0]=1 15 B9R1.6 CC(N)C1=CC=CC=C1 MC20344 [0,0,0,0,0,0|1,0,0]=1 16 B9R1.6 CC(N)C1=CN=CN=C1 MC102354 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.6 CC(N)C1=CN=CN=C1 MC104062 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.6 CC(N)C1=CN=CN=C1 MC105298 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.6 CC(N)C1=CN=NC=C1 MC103837 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.6 CC(N)C1=NC=CC=C1 CS15370 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.6 CC(N)C1=NC=CC=C1 CS20271 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.6 CC(N)C1=NC=CC=N1 MC431305 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.6 CC(N)C1=NC=CN=C1 CS12997 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.6 CC(N)C1=NC=NC=C1 MC103926 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.6 CC(O)C1=CC=CC=C1 MC20383 [0,0,0,0,0,0|0,0,0]=0 26 B9R1.6 CC(O)C1=NC=CC=C1 CS20801 [0,0,0,0,0,0|1,0,0]=1 27 B9R1.6 CC(O)C1=NC=CC=C1 MC20310 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.6 CN(C)C1=CC=CC=C1 MC40906 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.6 CN(C)C1=CC=NC=C1 CS13386 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 CN(C)C1=CN=CN=C1 MC442270 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.6 C[PH](=O)C1=CC=CC=C1 CS16386 [0,0,0,0,0,0|1,0,1]=2 32 B9R1.6 ClC(Cl)C1=CC=CC=C1 MC40608 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.6 FC(F)C1=CC=CC=C1 MC41442 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.6 FC(F)C1=CC=CN=C1 MC429164 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 FC(F)C1=CC=NC=C1 MC429159 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.6 FC(F)C1=NC=CC=C1 MC429160 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.6 N=C(N)C1=CC=CC=C1 CS14830 [0,0,0,0,0,0|2,0,1]=3 38 B9R1.6 N=C(N)C1=CN=CC=C1 CS19487 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.6 N=C(N)C1=NC=CC=C1 CS19100 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.6 NC(=O)C1=CC=CC=C1 CS10962 [0,0,0,0,0,0|1,0,2]=3 41 B9R1.6 NC(=O)C1=CC=NC=C1 CS13721 [0,0,0,0,0,0|2,0,2]=4 42 B9R1.6 NC(=O)C1=NC=CC=C1 CS11910 [0,0,0,0,0,0|2,0,2]=4 43 B9R1.6 NC(=S)C1=CC=CC=C1 MC20863 [0,0,0,0,0,0|1,1,1]=3 44 B9R1.6 O=C(Cl)C1=CC=CC=C1 MC40435 [0,0,0,0,0,0|1,0,2]=3 45 B9R1.6 O=C(Cl)C1=NC=CC=C1 CS11857 [0,0,0,0,0,0|2,0,2]=4 46 B9R1.6 O=C(O)C1=CC=CC=C1 MC40233 [0,0,0,0,0,0|1,0,1]=2 47 B9R1.6 O=C(O)C1=CC=CN=C1 MC41633 [0,0,0,0,0,0|2,0,1]=3 48 B9R1.6 O=C(O)C1=CC=CN=N1 CS19741 [0,0,0,0,0,0|3,0,1]=4 49 B9R1.6 O=C(O)C1=CN=CN=C1 CS17525 [0,0,0,0,0,0|3,0,1]=4 50 B9R1.6 O=C(O)C1=CN=NC=C1 MC41706 [0,0,0,0,0,0|3,0,1]=4 51 B9R1.6 O=C(O)C1=NC=CC=C1 CS13384 [0,0,0,0,0,0|2,0,1]=3 52 B9R1.6 O=C(O)C1=NC=CC=N1 CS18229 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.6 O=C(O)C1=NC=CN=C1 CS17531 [0,0,0,0,0,0|3,0,1]=4 54 B9R1.6 O=C(O)C1=NC=NC=C1 CS14129 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 MC41586 [0,0,0,0,0,0|2,0,1]=3 56 B9R1.6 O=[N+]([O-])C1=CC=CN=C1 CS22384 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.6 OB(O)C1=CC=CC=C1 CS19450 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.6 OB(O)C1=CC=CN=C1 CS17797 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.6 OB(O)C1=CC=NC=C1 CS22018 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.6 OB(O)C1=CN=CN=C1 CS15907 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.6 OB(O)C1=NC=CC=C1 MC20201 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.6 OB(O)C1=NC=NC=C1 MC20899 [0,0,0,0,0,0|4,0,0]=4 63 B8R1.2 BrCC1=CC=CN=N1 CS15758 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.2 BrCC1=CC=NC=C1 CS22459 [1,0,0,0,0,0|2,0,0]=3 65 B8R1.2 BrCC1=CC=NC=C1 MC111773 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.2 BrCC1=CN=CN=C1 CS17938 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.2 BrCC1=NC=CC=N1 MC110628 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 BrCC1=NC=CN=C1 MC115921 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.2 Br[Mg]c1cccnc1 MC121318 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.2 Br[Zn]c1ccccn1 MC121328 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.2 Br[Zn]c1cccnc1 MC121329 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 C#CC1=CC=CC=C1 CS19127 [1,0,0,0,0,0|0,0,2]=3 73 B8R1.2 C#CC1=CC=NC=C1 CS22825 [1,0,0,0,0,0|1,0,2]=4 74 B8R1.2 C#CC1=NC=CC=C1 CS21539 [1,0,0,0,0,0|1,0,2]=4 75 B8R1.2 CCC1=CC=CC=C1 MC41556 [1,0,0,0,0,0|0,0,0]=1 76 B8R1.2 CCC1=CC=CN=C1 CS22277 [1,0,0,0,0,0|1,0,0]=2 77 B8R1.2 CCC1=NC=CN=C1 CS21534 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.2 CNC1=CC=CC=C1 CS11792 [1,0,0,0,0,0|1,0,0]=2 79 B8R1.2 CNC1=CC=CN=C1 CS13856 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.2 CNC1=CC=NC=C1 MC41620 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.2 COC1=CC=CC=C1 MC41309 [1,0,0,0,0,0|1,0,0]=2 82 B8R1.2 COC1=CC=CN=C1 CS22348 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.2 COC1=CC=CN=N1 CS22347 [1,0,0,0,0,0|3,0,0]=4 84 B8R1.2 COC1=CC=NC=C1 CS19206 [1,0,0,0,0,0|2,0,0]=3 85 B8R1.2 COC1=CN=CN=C1 MC428182 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.2 COC1=CN=NC=C1 MC427243 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 COC1=NC=CC=C1 CS18780 [1,0,0,0,0,0|2,0,0]=3 88 B8R1.2 COC1=NC=CN=C1 CS17887 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.2 CSC1=CC=CC=C1 MC439137 [1,0,0,0,0,0|1,0,0]=2 90 B8R1.2 CSC1=NC=CC=C1 MC41628 [1,0,0,0,0,0|2,0,0]=3 91 B8R1.2 ClCC1=CC=CN=C1 CS19291 [1,0,0,0,0,0|2,0,0]=3 92 B8R1.2 ClCC1=CC=CN=N1 CS16004 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.2 ClCC1=CC=CN=N1 MC112985 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.2 ClCC1=CN=CN=C1 MC444367 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.2 ClCC1=NC=CC=C1 CS19289 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.2 ClCC1=NC=CC=N1 CS20902 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.2 ClCC1=NC=CN=C1 MC444156 [1,0,0,0,0,0|3,0,0]=4 98 B8R1.2 ICC1=CC=CC=C1 CS11000 [1,0,0,0,0,0|1,0,0]=2 99 B8R1.2 ICC1=CC=CN=C1 MC430640 [1,0,0,0,0,0|2,0,0]=3 100 B8R1.2 I[Zn]c1ccccc1 MC121332 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.2 N#CC1=CC=CC=C1 MC40623 [1,0,0,0,0,0|1,0,1]=3 102 B8R1.2 N#CC1=CC=NC=C1 MC427074 [1,0,0,0,0,0|2,0,1]=4 103 B8R1.2 N#CC1=CN=CC=C1 CS22263 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.2 N#CC1=NC=CC=C1 CS19642 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.2 N#Cc1ccccc1 CS13696 [1,0,0,0,0,0|1,0,1]=3 106 B8R1.2 NCC1=CC=CC=C1 MC40797 [1,0,0,0,0,0|1,0,0]=2 107 B8R1.2 NCC1=CC=CN=C1 CS14226 [1,0,0,0,0,0|2,0,0]=3 108 B8R1.2 NCC1=CC=CN=N1 MC444234 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.2 NCC1=CC=NC=C1 CS11906 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.2 NCC1=CC=NC=C1 CS19023 [1,0,0,0,0,0|2,0,0]=3 111 B8R1.2 NCC1=CN=CN=C1 MC444384 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.2 NCC1=CN=NC=C1 CS15014 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.2 NCC1=CN=NC=C1 CS15515 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.2 NCC1=CN=NC=C1 MC444324 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.2 NCC1=NC=CC=N1 CS21304 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.2 NCC1=NC=CC=N1 MC425460 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.2 NCC1=NC=CN=C1 CS19691 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.2 NCC1=NC=CN=C1 CS20245 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.2 NCC1=NC=NC=C1 MC444325 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.2 NNC1=CC=CC=C1 CS15210 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.2 NNC1=CC=CC=C1 MC427075 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.2 NNC1=CC=CN=C1 CS15491 [1,0,0,0,0,0|3,0,0]=4 123 B8R1.2 NNC1=CC=CN=C1 CS22308 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.2 NNC1=CC=NC=C1 MC20777 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.2 NNC1=NC=CC=C1 CS15589 [1,0,0,0,0,0|3,0,0]=4 126 B8R1.2 NNC1=NC=CC=C1 CS21573 [1,0,0,0,0,0|3,0,0]=4 127 B8R1.2 O=CC1=CN=CC=C1 CS19090 [1,0,0,0,0,0|1,0,2]=4 128 B8R1.2 O=CC1=NC=CC=C1 CS18610 [1,0,0,0,0,0|1,0,2]=4 129 B8R1.2 O=NC1=CC=CC=C1 MC33163 [1,0,0,0,0,0|1,0,1]=3 130 B8R1.2 OCC1=CC=CC=C1 MC40684 [1,0,0,0,0,0|0,0,0]=1 131 B8R1.2 OCC1=CC=CN=C1 CS22409 [1,0,0,0,0,0|1,0,0]=2 132 B8R1.2 OCC1=CC=CN=N1 CS21870 [1,0,0,0,0,0|2,0,0]=3 133 B8R1.2 OCC1=CC=NC=C1 CS19163 [1,0,0,0,0,0|1,0,0]=2 134 B8R1.2 OCC1=CN=CN=C1 MC444370 [1,0,0,0,0,0|2,0,0]=3 135 B8R1.2 OCC1=CN=NC=C1 MC444363 [1,0,0,0,0,0|2,0,0]=3 136 B8R1.2 OCC1=NC=CC=C1 CS19164 [1,0,0,0,0,0|1,0,0]=2 137 B8R1.2 OCC1=NC=CC=N1 CS19924 [1,0,0,0,0,0|2,0,0]=3 138 B8R1.2 OCC1=NC=CN=C1 CS21749 [1,0,0,0,0,0|2,0,0]=3 139 B8R1.2 OCC1=NC=NC=C1 CS11915 [1,0,0,0,0,0|2,0,0]=3 140 B8R1.2 SCC1=NC=CN=C1 MC110936 [1,0,0,0,0,0|2,1,0]=4 141 B10R1.13 C=C(C)C1=CC=C(O)C=C1 MC441020 [0,1,0,0,0,0|1,0,1]=3 142 B10R1.13 C=C(C)C1=CN=C(Cl)C=C1 MC107618 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 CS19447 [0,1,0,0,0,0|0,0,2]=3 144 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 CS17999 [0,1,0,0,0,0|1,0,2]=4 145 B10R1.13 CC(=O)C1=CC=C(C)C=C1 CS13558 [0,1,0,0,0,0|0,0,2]=3 146 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 CS20014 [0,1,0,0,0,0|0,0,2]=3 147 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 CS19687 [0,1,0,0,0,0|1,0,2]=4 148 B10R1.13 CC(=O)C1=CC=C(F)C=C1 CS14299 [0,1,0,0,0,0|0,0,2]=3 149 B10R1.13 CC(=O)C1=CC=C(F)N=C1 CS16982 [0,1,0,0,0,0|1,0,2]=4 150 B10R1.13 CC(=O)C1=CC=C(N)C=C1 MC20162 [0,1,0,0,0,0|0,0,2]=3 151 B10R1.13 CC(=O)C1=CC=C(O)C=C1 CS22884 [0,1,0,0,0,0|0,0,2]=3 152 B10R1.13 CC(=O)C1=CC=C(O)N=C1 CS12692 [0,1,0,0,0,0|1,0,2]=4 153 B10R1.13 CC(=O)C1=CN=C(C)C=C1 MC428167 [0,1,0,0,0,0|1,0,2]=4 154 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 CS16977 [0,1,0,0,0,0|1,0,2]=4 155 B10R1.13 CC(=O)C1=NC=C(C)C=C1 MC443649 [0,1,0,0,0,0|1,0,2]=4 156 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 CS16979 [0,1,0,0,0,0|1,0,2]=4 157 B10R1.13 CC(=O)C1=NC=C(F)C=C1 MC106404 [0,1,0,0,0,0|1,0,2]=4 158 B10R1.13 CC(=O)C1=NC=C(N)C=C1 MC442802 [0,1,0,0,0,0|1,0,2]=4 159 B10R1.13 CC(=O)c1ccc(I)cc1 MC433245 [0,1,0,0,0,0|0,0,2]=3 160 B10R1.13 CC(Br)C1=CC=C(F)C=C1 CS16140 [0,1,0,0,0,0|1,0,0]=2 161 B10R1.13 CC(C)C1=CC=C(Br)C=C1 CS19162 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.13 CC(C)C1=CC=C(Cl)N=N1 CS15951 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.13 CC(C)C1=CC=C(N)C=C1 CS22915 [0,1,0,0,0,0|1,0,0]=2 164 B10R1.13 CC(C)C1=CC=C(N)C=N1 CS22406 [0,1,0,0,0,0|2,0,0]=3 165 B10R1.13 CC(C)C1=CN=C(Br)C=C1 MC432364 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.13 CC(C)C1=CN=C(Cl)C=C1 MC107619 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.13 CC(C)C1=CN=C(Cl)N=C1 MC113225 [0,1,0,0,0,0|3,0,0]=4 168 B10R1.13 CC(C)C1=CN=C(N)C=C1 CS21752 [0,1,0,0,0,0|2,0,0]=3 169 B10R1.13 CC(C)C1=NC=C(Br)C=N1 MC441127 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS10540 [0,1,0,0,0,0|1,0,0]=2 171 B10R1.13 CC(N)C1=CC=C(Br)C=C1 CS20256 [0,1,0,0,0,0|1,0,0]=2 172 B10R1.13 CC(N)C1=CC=C(F)C=C1 CS19253 [0,1,0,0,0,0|1,0,0]=2 173 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC40832 [0,1,0,0,0,0|1,0,0]=2 174 B10R1.13 CC(N)C1=CC=C(F)C=C1 MC429424 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.13 CC(N)C1=CC=C(I)C=C1 MC113505 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.13 CC(N)C1=CC=C(N)C=C1 CS22422 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.13 CC(N)C1=CN=C(Cl)N=C1 MC444001 [0,1,0,0,0,0|3,0,0]=4 178 B10R1.13 CC(N)C1=NC=C(F)C=C1 CS16980 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.13 CC(N)C1=NC=C(F)C=C1 MC102962 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.13 CC(N)C1=NC=C(F)C=N1 MC104532 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.13 CC(N)c1ccc(Cl)cc1 MC433903 [0,1,0,0,0,0|1,0,0]=2 182 B10R1.13 CC(O)C1=CC=C(F)C=C1 MC33129 [0,1,0,0,0,0|0,0,0]=1 183 B10R1.13 CC(O)C1=CC=C(N)C=C1 MC40728 [0,1,0,0,0,0|0,0,0]=1 184 B10R1.13 CC1=CC=C(B(O)O)C=C1 CS10128 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.13 CC1=CC=C(B(O)O)C=N1 CS18413 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.13 CC1=CC=C(C(=N)N)C=C1 CS20439 [0,1,0,0,0,0|2,0,1]=4 187 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 MC40494 [0,1,0,0,0,0|1,0,2]=4 188 B10R1.13 CC1=CC=C(C(=O)O)C=C1 MC40304 [0,1,0,0,0,0|1,0,1]=3 189 B10R1.13 CC1=CC=C(C(N)=O)C=C1 CS11895 [0,1,0,0,0,0|1,0,2]=4 190 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 CS11896 [0,1,0,0,0,0|2,0,1]=4 191 B10R1.13 CC1=CC=C(S(N)=O)C=C1 CS18822 [0,1,0,0,0,0|2,0,1]=4 192 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS10458 [0,1,0,0,0,0|2,0,1]=4 193 B10R1.13 CC1=CN=C(C(=O)O)C=C1 CS17310 [0,1,0,0,0,0|2,0,1]=4 194 B10R1.13 CC1=NC=C(C(=O)O)C=C1 CS20324 [0,1,0,0,0,0|2,0,1]=4 195 B10R1.13 CC1=NC=C(C(C)N)C=N1 MC112001 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.13 CN(C)C1=CC=C(Br)C=C1 CS15132 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.13 CN(C)C1=CC=C(Br)N=C1 CS17769 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 MC20289 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.13 CN(C)C1=CC=C(I)C=C1 CS16430 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS16528 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.13 CN(C)C1=CC=C(O)C=C1 MC442505 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.13 CN(C)C1=NC=C(Br)C=C1 MC425751 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.13 CN(C)C1=NC=C(I)C=C1 CS16969 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.13 CN(C)C1=NC=C(N)C=C1 MC427118 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.13 CN(C)C1=NC=C(N)C=C1 MC427390 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.13 Cc1ccc(C(C)C)cc1 MC444976 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.13 FC(F)C1=CC=C(Br)C=C1 MC33151 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.13 FC(F)C1=CN=C(Br)C=C1 MC429307 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.13 FC(F)C1=CN=C(Cl)C=C1 MC429162 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.13 FC(F)C1=NC=C(Br)C=C1 MC429792 [0,1,0,0,0,0|3,0,0]=4 211 B10R1.13 FC1=CC=C(C(Cl)Cl)C=C1 MC33143 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 MC21022 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 CS20283 [0,1,0,0,0,0|2,0,1]=4 214 B10R1.13 N=C(N)C1=CC=C(F)C=C1 CS18318 [0,1,0,0,0,0|2,0,1]=4 215 B10R1.13 N=C(N)C1=CC=C(N)C=C1 CS21974 [0,1,0,0,0,0|2,0,1]=4 216 B10R1.13 NC(=O)C1=CC=C(F)C=C1 CS10426 [0,1,0,0,0,0|1,0,2]=4 217 B10R1.13 NC(=S)C1=CC=C(O)C=C1 CS20343 [0,1,0,0,0,0|1,1,1]=4 218 B10R1.13 NC1=CC=C(B(O)O)C=C1 CS19513 [0,1,0,0,0,0|2,0,0]=3 219 B10R1.13 NC1=CC=C(B(O)O)C=C1 MC442888 [0,1,0,0,0,0|2,0,0]=3 220 B10R1.13 NC1=CC=C(B(O)O)C=N1 MC21015 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.13 NC1=CC=C(C(=O)O)C=C1 MC40224 [0,1,0,0,0,0|1,0,1]=3 222 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 CS22580 [0,1,0,0,0,0|1,0,2]=4 223 B10R1.13 NC1=CC=C(C(F)F)C=C1 CS17592 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.13 NC1=CC=C(C(F)F)N=C1 CS16709 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 MC40934 [0,1,0,0,0,0|2,0,1]=4 226 B10R1.13 NC1=CN=C(C(=O)O)C=C1 CS19367 [0,1,0,0,0,0|2,0,1]=4 227 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CS19354 [0,1,0,0,0,0|2,0,1]=4 228 B10R1.13 O=C(Cl)C1=CC=C(Br)C=C1 MC40440 [0,1,0,0,0,0|1,0,2]=4 229 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 MC40474 [0,1,0,0,0,0|1,0,2]=4 230 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 MC433701 [0,1,0,0,0,0|1,0,2]=4 231 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 CS20082 [0,1,0,0,0,0|1,0,1]=3 232 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 CS15821 [0,1,0,0,0,0|1,0,1]=3 233 B10R1.13 O=C(O)C1=CC=C(F)C=C1 MC40280 [0,1,0,0,0,0|1,0,1]=3 234 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS20135 [0,1,0,0,0,0|1,0,1]=3 235 B10R1.13 O=C(O)C1=CC=C(O)C=C1 CS22885 [0,1,0,0,0,0|1,0,1]=3 236 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 CS22092 [0,1,0,0,0,0|2,0,1]=4 237 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 CS22101 [0,1,0,0,0,0|2,0,1]=4 238 B10R1.13 O=C(O)C1=CN=C(F)C=C1 CS18891 [0,1,0,0,0,0|2,0,1]=4 239 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CS19189 [0,1,0,0,0,0|2,0,1]=4 240 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 CS22033 [0,1,0,0,0,0|2,0,1]=4 241 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 CS19376 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.13 O=C(O)C1=NC=C(F)C=C1 CS10387 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.13 O=C(O)C1=NC=C(I)C=C1 CS10412 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CS22997 [0,1,0,0,0,0|2,0,1]=4 245 B10R1.13 O=C([O-])C1=CC=C(Br)C=C1 MC40334 [0,1,0,0,0,0|1,0,2]=4 246 B10R1.13 O=C([O-])C1=CC=C(Cl)C=C1 MC40337 [0,1,0,0,0,0|1,0,2]=4 247 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 MC40351 [0,1,0,0,0,0|1,0,2]=4 248 B10R1.13 O=C1C=CC(C(F)F)=CN1 MC432336 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 CS18786 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 CS22843 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 CS19234 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 MC41207 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.13 O=[N+]([O-])c1ccc(Cl)cc1 MC41577 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.13 OB(O)C1=CC=C(Br)C=C1 CS19222 [0,1,0,0,0,0|2,0,0]=3 255 B10R1.13 OB(O)C1=CC=C(Br)N=C1 CS17585 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 CS19227 [0,1,0,0,0,0|2,0,0]=3 257 B10R1.13 OB(O)C1=CC=C(Cl)N=C1 CS17598 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.13 OB(O)C1=CC=C(F)C=C1 CS23000 [0,1,0,0,0,0|2,0,0]=3 259 B10R1.13 OB(O)C1=CC=C(I)C=C1 CS22011 [0,1,0,0,0,0|2,0,0]=3 260 B10R1.13 OB(O)C1=CC=C(O)C=C1 CS19452 [0,1,0,0,0,0|2,0,0]=3 261 B10R1.13 OB(O)C1=CC=C(S)C=C1 MC20067 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.13 OB(O)C1=CN=C(F)C=C1 MC20431 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.13 OB(O)C1=NC=C(F)C=C1 MC100358 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.13 OC1=CC=C(C(F)F)C=C1 CS15692 [0,1,0,0,0,0|2,0,0]=3 265 B10R1.13 OC1=CC=C(C(F)F)N=C1 MC429310 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.15 C#CC(O)C1=CC=NC=C1 CS16716 [0,1,0,0,0,0|1,0,1]=3 267 B10R1.15 C=C(C#N)C1=CC=CC=C1 MC106124 [0,1,0,0,0,0|1,0,2]=4 268 B10R1.15 C=C(CBr)C1=CC=CC=C1 CS20091 [0,1,0,0,0,0|1,0,1]=3 269 B10R1.15 C=CC(N)C1=CC=CC=C1 MC102512 [0,1,0,0,0,0|1,0,1]=3 270 B10R1.15 CC(CN)C1=CC=CC=C1 CS10909 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.15 CC(CN)c1ccccc1 MC110750 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.15 CC(NO)c1ccccc1 MC103844 [0,1,0,0,0,0|0,0,0]=1 273 B10R1.15 CC(NO)c1ccccc1 MC103845 [0,1,0,0,0,0|0,0,0]=1 274 B10R1.15 CCC(C)C1=CC=CC=C1 CS11947 [0,1,0,0,0,0|1,0,0]=2 275 B10R1.15 CCC(C)C1=CC=CC=C1 MC433489 [0,1,0,0,0,0|1,0,0]=2 276 B10R1.15 CCC(N)C1=CC=CC=C1 MC20337 [0,1,0,0,0,0|1,0,0]=2 277 B10R1.15 CCC(N)C1=NC=CN=C1 MC104764 [0,1,0,0,0,0|3,0,0]=4 278 B10R1.15 CN(C=O)C1=CC=CC=C1 CS11793 [0,1,0,0,0,0|1,0,1]=3 279 B10R1.15 COC(=N)C1=NC=CC=C1 MC106728 [0,1,0,0,0,0|2,0,1]=4 280 B10R1.15 COC(=O)C1=CC=CC=C1 MC40065 [0,1,0,0,0,0|0,0,2]=3 281 B10R1.15 COC(=O)C1=CC=NC=C1 CS18945 [0,1,0,0,0,0|1,0,2]=4 282 B10R1.15 COC(=O)C1=CN=CC=C1 CS19425 [0,1,0,0,0,0|1,0,2]=4 283 B10R1.15 COC(=O)C1=NC=CC=C1 CS19684 [0,1,0,0,0,0|1,0,2]=4 284 B10R1.15 C\C(=C\Br)C1=CC=NC=C1 MC111870 [0,1,0,0,0,0|2,0,1]=4 285 B10R1.15 FC(CBr)C1=CC=CC=C1 MC102769 [0,1,0,0,0,0|1,0,0]=2 286 B10R1.15 N#CC(N)C1=CC=CC=C1 MC31161 [0,1,0,0,0,0|1,0,1]=3 287 B10R1.15 NC(CO)C1=CC=CC=C1 CS10553 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.15 NC(CO)C1=CC=CC=C1 CS10555 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.15 NC(CO)C1=CC=CC=C1 CS15860 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.15 NC(CO)C1=NC=CC=C1 MC111155 [0,1,0,0,0,0|2,0,0]=3 291 B10R1.15 NCC(=O)C1=CC=CC=C1 CS10874 [0,1,0,0,0,0|0,0,2]=3 292 B10R1.15 NCC(=O)C1=NC=CC=C1 MC33498 [0,1,0,0,0,0|1,0,2]=4 293 B10R1.15 NCC(O)C1=CC=CC=C1 CS20485 [0,1,0,0,0,0|0,0,0]=1 294 B10R1.15 NCC(O)C1=CC=CC=C1 MC444625 [0,1,0,0,0,0|0,0,0]=1 295 B10R1.15 NCC(O)C1=CC=CN=C1 MC103058 [0,1,0,0,0,0|1,0,0]=2 296 B10R1.15 NCC(O)C1=NC=CC=C1 MC33503 [0,1,0,0,0,0|1,0,0]=2 297 B10R1.15 NNC(=O)C1=CC=CC=C1 CS10971 [0,1,0,0,0,0|1,0,2]=4 298 B10R1.15 O=C(CBr)C1=CC=CC=C1 CS19274 [0,1,0,0,0,0|0,0,2]=3 299 B10R1.15 O=C(CBr)C1=CC=CN=C1 MC42216 [0,1,0,0,0,0|1,0,2]=4 300 B10R1.15 O=C(CBr)C1=CC=NC=C1 CS20175 [0,1,0,0,0,0|1,0,2]=4 301 B10R1.15 O=C(CCl)C1=CC=CC=C1 MC20159 [0,1,0,0,0,0|0,0,2]=3 302 B10R1.15 O=C(CI)C1=CC=CC=C1 MC433244 [0,1,0,0,0,0|0,0,2]=3 303 B10R1.15 OC(CBr)C1=CC=CC=C1 CS18840 [0,1,0,0,0,0|0,0,0]=1 304 B10R1.15 OC(CCl)C1=CC=CN=C1 MC103059 [0,1,0,0,0,0|1,0,0]=2 305 B10R1.15 OCC(F)C1=CC=CC=C1 MC430923 [0,1,0,0,0,0|1,0,0]=2 306 B10R1.15 O\N=C(/Cl)C1=NC=CC=C1 CS14803 [0,1,0,0,0,0|2,0,1]=4 307 B10R1.28 CC(C)(C)C1=CC=CC=C1 MC41559 [0,1,0,0,0,0|1,0,0]=2 308 B10R1.28 CC(C)(C)C1=CC=CN=C1 MC430933 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.28 CC(C)(C)C1=CC=NC=C1 CS10123 [0,1,0,0,0,0|2,0,0]=3 310 B10R1.28 CC(C)(N)C1=NC=CC=C1 MC430649 [0,1,0,0,0,0|2,0,0]=3 311 B10R1.28 CC(C)(O)C1=NC=CC=C1 MC443311 [0,1,0,0,0,0|1,0,0]=2 312 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 MC100403 [0,1,0,0,0,0|1,0,1]=3 313 B10R1.28 CS(=O)(=O)C1=CC=NC=C1 MC33441 [0,1,0,0,0,0|2,0,1]=4 314 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 CS12052 [0,1,0,0,0,0|2,0,0]=3 315 B10R1.28 C[Si](C)(C)C1=NC=CC=C1 MC445195 [0,1,0,0,0,0|2,1,0]=4 316 B10R1.28 C[Si](C)(Cl)C1=CC=CC=C1 CS11135 [0,1,0,0,0,0|1,1,0]=3 317 B10R1.28 FC(F)(F)C1=CC=CC=C1 MC41418 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.28 FC(F)(F)C1=CC=CN=C1 CS21890 [0,1,0,0,0,0|3,0,0]=4 319 B10R1.28 FC(F)(F)C1=CC=NC=C1 MC429599 [0,1,0,0,0,0|3,0,0]=4 320 B10R1.28 FC(F)(F)C1=NC=CC=C1 CS19017 [0,1,0,0,0,0|3,0,0]=4 321 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 CS10507 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.28 O=P(Cl)(Cl)C1=CC=CC=C1 MC20369 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 CS15426 [0,1,0,0,0,0|3,0,0]=4 324 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 MC111106 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 CS19698 [0,1,0,0,0,0|2,0,1]=4 326 B10R1.28 O[B-](O)(O)C1=CC=CC=N1 MC425358 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.61 BrC1=C(C(Br)Br)C=CN=C1 MC427535 [0,1,0,0,0,0|3,0,0]=4 328 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 CS18866 [0,1,0,0,0,0|0,0,2]=3 329 B10R1.61 CC(=O)C1=C(C)C=CC=C1 CS19710 [0,1,0,0,0,0|0,0,2]=3 330 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 MC41234 [0,1,0,0,0,0|0,0,2]=3 331 B10R1.61 CC(=O)C1=C(F)C=CC=C1 CS15490 [0,1,0,0,0,0|0,0,2]=3 332 B10R1.61 CC(=O)C1=C(F)C=NC=C1 MC113260 [0,1,0,0,0,0|1,0,2]=4 333 B10R1.61 CC(=O)C1=C(N)C=CC=C1 CS19948 [0,1,0,0,0,0|0,0,2]=3 334 B10R1.61 CC(=O)C1=C(N)C=NC=C1 MC427146 [0,1,0,0,0,0|1,0,2]=4 335 B10R1.61 CC(=O)C1=C(O)C=CC=C1 CS15026 [0,1,0,0,0,0|0,0,2]=3 336 B10R1.61 CC(=O)C1=C(O)C=NC=C1 MC427306 [0,1,0,0,0,0|1,0,2]=4 337 B10R1.61 CC(=O)C1=CC=CN=C1Br CS18506 [0,1,0,0,0,0|1,0,2]=4 338 B10R1.61 CC(=O)C1=CC=CN=C1Cl CS18365 [0,1,0,0,0,0|1,0,2]=4 339 B10R1.61 CC(=O)C1=CC=CN=C1O MC427454 [0,1,0,0,0,0|1,0,2]=4 340 B10R1.61 CC(=O)C1=NC=CC=C1Br CS16209 [0,1,0,0,0,0|1,0,2]=4 341 B10R1.61 CC(=O)C1=NC=CC=C1Cl MC425055 [0,1,0,0,0,0|1,0,2]=4 342 B10R1.61 CC(=O)C1=NC=CC=C1F CS16198 [0,1,0,0,0,0|1,0,2]=4 343 B10R1.61 CC(=O)C1=NC=CC=C1O CS14450 [0,1,0,0,0,0|1,0,2]=4 344 B10R1.61 CC(C)C1=C(Br)C=CC=C1 CS19988 [0,1,0,0,0,0|1,0,0]=2 345 B10R1.61 CC(C)C1=CN=CN=C1Cl CS15913 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.61 CC(C)C1=NC=CC=C1Br MC441304 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.61 CC(C)C1=NC=CC=C1N MC445692 [0,1,0,0,0,0|2,0,0]=3 348 B10R1.61 CC(N)C1=C(Br)C=CC=C1 CS20301 [0,1,0,0,0,0|1,0,0]=2 349 B10R1.61 CC(N)C1=C(F)C=CC=C1 CS20318 [0,1,0,0,0,0|1,0,0]=2 350 B10R1.61 CC(N)C1=C(F)C=CC=C1 MC429423 [0,1,0,0,0,0|1,0,0]=2 351 B10R1.61 CC(N)C1=NC=CC=C1F MC430350 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 CS13547 [0,1,0,0,0,0|0,0,0]=1 353 B10R1.61 CC(O)C1=C(F)C=CC=C1 CS15513 [0,1,0,0,0,0|0,0,0]=1 354 B10R1.61 CC(O)C1=C(F)C=CC=C1 MC33138 [0,1,0,0,0,0|0,0,0]=1 355 B10R1.61 CC1=C(B(O)O)C=CC=C1 CS20397 [0,1,0,0,0,0|2,0,0]=3 356 B10R1.61 CC1=C(B(O)O)C=CN=C1 CS17377 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.61 CC1=C(B(O)O)C=NC=C1 CS19509 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.61 CC1=C(C(=O)O)C=CC=C1 CS19823 [0,1,0,0,0,0|1,0,1]=3 359 B10R1.61 CC1=C(C(=O)O)C=CC=N1 CS18975 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.61 CC1=C(C(=O)O)C=CN=C1 CS22360 [0,1,0,0,0,0|2,0,1]=4 361 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 MC41522 [0,1,0,0,0,0|2,0,1]=4 362 B10R1.61 CC1=CC=CN=C1C(=O)O CS19680 [0,1,0,0,0,0|2,0,1]=4 363 B10R1.61 CC1=CC=NC=C1C(=O)O CS22976 [0,1,0,0,0,0|2,0,1]=4 364 B10R1.61 CC1=CC=NC=C1C(=O)O CS22977 [0,1,0,0,0,0|2,0,1]=4 365 B10R1.61 CC1=NC=CC=C1B(O)O CS16939 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.61 CC1=NC=CC=C1B(O)O MC430534 [0,1,0,0,0,0|3,0,0]=4 367 B10R1.61 CN(C)C1=C(Br)C=CC=C1 MC20183 [0,1,0,0,0,0|2,0,0]=3 368 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 MC20288 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.61 CN(C)C1=C(F)C=CC=C1 MC20285 [0,1,0,0,0,0|2,0,0]=3 370 B10R1.61 CN(C)C1=C(O)C=CC=C1 CS14782 [0,1,0,0,0,0|2,0,0]=3 371 B10R1.61 CN(C)C1=CC=CC=C1N CS14204 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.61 Cc1ccccc1C(C)Br MC106119 [0,1,0,0,0,0|1,0,0]=2 373 B10R1.61 FC(F)C1=C(Br)C=CN=C1 MC429545 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.61 FC(F)C1=C(Br)C=NC=C1 MC429163 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.61 FC(F)C1=C(Cl)C=CN=C1 MC432239 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.61 FC(F)C1=NC=CC=C1Br MC430238 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 CS20174 [0,1,0,0,0,0|1,0,2]=4 378 B10R1.61 NC(=O)C1=C(F)C=CC=C1 MC41021 [0,1,0,0,0,0|1,0,2]=4 379 B10R1.61 NC(=O)C1=C(I)C=CC=C1 MC433808 [0,1,0,0,0,0|1,0,2]=4 380 B10R1.61 NC(=O)C1=C(O)C=CC=C1 CS11941 [0,1,0,0,0,0|1,0,2]=4 381 B10R1.61 NC1=C(B(O)O)C=CC=C1 CS19508 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.61 NC1=C(C(=O)O)C=CC=N1 CS21827 [0,1,0,0,0,0|2,0,1]=4 383 B10R1.61 NC1=C(C(=O)O)C=CN=C1 CS17968 [0,1,0,0,0,0|2,0,1]=4 384 B10R1.61 NC1=C(C(=O)O)C=CN=C1 CS21908 [0,1,0,0,0,0|2,0,1]=4 385 B10R1.61 NC1=C(C(F)F)C=CC=C1 MC429268 [0,1,0,0,0,0|2,0,0]=3 386 B10R1.61 NC1=C([N+](=O)[O-])C=CC=C1 MC40933 [0,1,0,0,0,0|2,0,1]=4 387 B10R1.61 NC1=CC=CN=C1C(=O)O CS17409 [0,1,0,0,0,0|2,0,1]=4 388 B10R1.61 NC1=CC=CN=C1C(=O)O CS19360 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.61 NC1=CC=NC=C1C(=O)O CS21982 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.61 NC1=NC=CC=C1B(O)O MC115224 [0,1,0,0,0,0|3,0,0]=4 391 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 MC40438 [0,1,0,0,0,0|1,0,2]=4 392 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 MC40472 [0,1,0,0,0,0|1,0,2]=4 393 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 CS19188 [0,1,0,0,0,0|1,0,2]=4 394 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 CS16216 [0,1,0,0,0,0|1,0,1]=3 395 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 CS22916 [0,1,0,0,0,0|2,0,1]=4 396 B10R1.61 O=C(O)C1=C(Br)N=CC=C1 CS22912 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 CS16220 [0,1,0,0,0,0|2,0,1]=4 398 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 CS18848 [0,1,0,0,0,0|2,0,1]=4 399 B10R1.61 O=C(O)C1=C(F)C=CC=C1 CS10366 [0,1,0,0,0,0|1,0,1]=3 400 B10R1.61 O=C(O)C1=C(F)C=NC=C1 CS19033 [0,1,0,0,0,0|2,0,1]=4 401 B10R1.61 O=C(O)C1=C(F)N=CC=C1 CS18890 [0,1,0,0,0,0|2,0,1]=4 402 B10R1.61 O=C(O)C1=C(I)C=CC=C1 CS20137 [0,1,0,0,0,0|1,0,1]=3 403 B10R1.61 O=C(O)C1=C(I)N=CC=C1 MC443233 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.61 O=C(O)C1=C(O)C=CC=C1 MC40289 [0,1,0,0,0,0|1,0,1]=3 405 B10R1.61 O=C(O)C1=C(O)C=NC=C1 CS22995 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.61 O=C(O)C1=C(S)C=CC=C1 MC40297 [0,1,0,0,0,0|1,0,1]=3 407 B10R1.61 O=C(O)C1=CC=CNC1=O CS19183 [0,1,0,0,0,0|2,0,1]=4 408 B10R1.61 O=C(O)C1=CN=CC=C1Br MC10387 [0,1,0,0,0,0|2,0,1]=4 409 B10R1.61 O=C(O)C1=CN=CC=C1Cl CS18850 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.61 O=C(O)C1=CN=CC=C1I MC442349 [0,1,0,0,0,0|2,0,1]=4 411 B10R1.61 O=C(O)C1=CN=CC=C1O CS15271 [0,1,0,0,0,0|2,0,1]=4 412 B10R1.61 O=C(O)C1=NC=CC=C1Br CS22914 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.61 O=C(O)C1=NC=CC=C1Cl CS15072 [0,1,0,0,0,0|2,0,1]=4 414 B10R1.61 O=C(O)C1=NC=CC=C1F CS18754 [0,1,0,0,0,0|2,0,1]=4 415 B10R1.61 O=C(O)C1=NC=CC=C1I CS12162 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.61 O=C(O)C1=NC=CC=C1O CS22996 [0,1,0,0,0,0|2,0,1]=4 417 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 MC40335 [0,1,0,0,0,0|1,0,2]=4 418 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 MC40349 [0,1,0,0,0,0|1,0,2]=4 419 B10R1.61 O=C1NC=CC=C1B(O)O MC425356 [0,1,0,0,0,0|3,0,0]=4 420 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=C1 CS22913 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 CS21724 [0,1,0,0,0,0|2,0,1]=4 422 B10R1.61 O=[N+]([O-])c1ccccc1F MC41584 [0,1,0,0,0,0|2,0,1]=4 423 B10R1.61 O=[N+]([O-])c1ccccc1F MC433531 [0,1,0,0,0,0|2,0,1]=4 424 B10R1.61 O=[N+]([O-])c1ccccc1I MC41585 [0,1,0,0,0,0|2,0,1]=4 425 B10R1.61 OB(O)C1=C(Br)C=CC=C1 CS21842 [0,1,0,0,0,0|2,0,0]=3 426 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 CS19224 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.61 OB(O)C1=C(Cl)C=CN=C1 MC442779 [0,1,0,0,0,0|3,0,0]=4 428 B10R1.61 OB(O)C1=C(F)C=CC=C1 CS16291 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.61 OB(O)C1=C(F)C=NC=C1 MC107139 [0,1,0,0,0,0|3,0,0]=4 430 B10R1.61 OB(O)C1=C(I)C=CC=C1 MC443194 [0,1,0,0,0,0|2,0,0]=3 431 B10R1.61 OB(O)C1=C(O)C=CC=C1 CS21880 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.61 OB(O)C1=C(S)C=CC=C1 MC100433 [0,1,0,0,0,0|2,0,0]=3 433 B10R1.61 OB(O)C1=CC=CN=C1Cl CS17594 [0,1,0,0,0,0|3,0,0]=4 434 B10R1.61 OB(O)C1=CC=CN=C1F MC425357 [0,1,0,0,0,0|3,0,0]=4 435 B10R1.61 OB(O)C1=NC=CC=C1F MC431350 [0,1,0,0,0,0|3,0,0]=4 436 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 CS14839 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 MC113271 [0,1,0,0,0,0|2,0,1]=4 438 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 CS18865 [0,1,0,0,0,0|0,0,2]=3 439 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 CS18282 [0,1,0,0,0,0|1,0,2]=4 440 B10R1.113 CC(=O)C1=CC(C)=CN=C1 CS16656 [0,1,0,0,0,0|1,0,2]=4 441 B10R1.113 CC(=O)C1=CC(C)=NC=C1 CS18206 [0,1,0,0,0,0|1,0,2]=4 442 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 CS19798 [0,1,0,0,0,0|0,0,2]=3 443 B10R1.113 CC(=O)C1=CC(Cl)=CN=C1 MC116273 [0,1,0,0,0,0|1,0,2]=4 444 B10R1.113 CC(=O)C1=CC(F)=CC=C1 CS19067 [0,1,0,0,0,0|0,0,2]=3 445 B10R1.113 CC(=O)C1=CC(F)=CN=C1 MC443199 [0,1,0,0,0,0|1,0,2]=4 446 B10R1.113 CC(=O)C1=CC(I)=CC=C1 MC33049 [0,1,0,0,0,0|0,0,2]=3 447 B10R1.113 CC(=O)C1=CC(N)=CC=C1 CS19441 [0,1,0,0,0,0|0,0,2]=3 448 B10R1.113 CC(=O)C1=CC(O)=CC=C1 CS18681 [0,1,0,0,0,0|0,0,2]=3 449 B10R1.113 CC(=O)C1=CC=CC(C)=C1 CS19159 [0,1,0,0,0,0|0,0,2]=3 450 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 CS17202 [0,1,0,0,0,0|1,0,2]=4 451 B10R1.113 CC(=O)C1=NC(C)=CC=C1 CS18426 [0,1,0,0,0,0|1,0,2]=4 452 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 MC441210 [0,1,0,0,0,0|1,0,2]=4 453 B10R1.113 CC(=O)C1=NC=CC(F)=C1 MC430529 [0,1,0,0,0,0|1,0,2]=4 454 B10R1.113 CC(C)C1=CC(N)=NC=N1 MC425906 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.113 CC(C)C1=CC=CC(Br)=N1 MC434005 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.113 CC(C)C1=CC=CC(N)=N1 MC425411 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 MC431795 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.113 CC(C)c1cccc(Br)c1 MC433484 [0,1,0,0,0,0|1,0,0]=2 459 B10R1.113 CC(N)C1=CC(Cl)=NC=C1 MC105378 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.113 CC(N)C1=CC(F)=CC=C1 CS19312 [0,1,0,0,0,0|1,0,0]=2 461 B10R1.113 CC(N)C1=CC(F)=CC=C1 CS19671 [0,1,0,0,0,0|1,0,0]=2 462 B10R1.113 CC(N)C1=CC(F)=CC=C1 CS20262 [0,1,0,0,0,0|1,0,0]=2 463 B10R1.113 CC(N)C1=CC(F)=CC=C1 MC429421 [0,1,0,0,0,0|1,0,0]=2 464 B10R1.113 CC(N)C1=CC(F)=CN=C1 MC106300 [0,1,0,0,0,0|2,0,0]=3 465 B10R1.113 CC(N)C1=CC=CC(N)=C1 MC116025 [0,1,0,0,0,0|1,0,0]=2 466 B10R1.113 CC(N)C1=CC=CC(O)=C1 MC431437 [0,1,0,0,0,0|1,0,0]=2 467 B10R1.113 CC(O)C1=CC(Br)=CC=C1 MC40729 [0,1,0,0,0,0|0,0,0]=1 468 B10R1.113 CC(O)C1=CC(F)=CC=C1 MC433887 [0,1,0,0,0,0|0,0,0]=1 469 B10R1.113 CC(O)C1=CC(F)=NC=C1 MC432297 [0,1,0,0,0,0|1,0,0]=2 470 B10R1.113 CC(O)C1=CC(N)=CC=C1 CS21787 [0,1,0,0,0,0|0,0,0]=1 471 B10R1.113 CC(O)C1=CC(N)=NC=C1 MC425261 [0,1,0,0,0,0|1,0,0]=2 472 B10R1.113 CC(O)C1=NC(Br)=CC=C1 CS14015 [0,1,0,0,0,0|1,0,0]=2 473 B10R1.113 CC1=CC(B(O)O)=CC=C1 CS10529 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.113 CC1=CC(B(O)O)=NC=C1 MC106710 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.113 CC1=CC(C(=O)O)=CN=C1 CS20319 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.113 CC1=CC(C(=O)O)=NC=C1 CS22984 [0,1,0,0,0,0|2,0,1]=4 477 B10R1.113 CC1=CC(C(C)N)=CC=C1 CS17345 [0,1,0,0,0,0|1,0,0]=2 478 B10R1.113 CC1=CC=CC(B(O)O)=N1 MC106708 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.113 CC1=CC=CC(C(=N)N)=C1 CS20438 [0,1,0,0,0,0|2,0,1]=4 480 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 MC20748 [0,1,0,0,0,0|1,0,2]=4 481 B10R1.113 CC1=CC=CC(C(=O)O)=C1 CS19799 [0,1,0,0,0,0|1,0,1]=3 482 B10R1.113 CC1=CC=CC(C(=O)O)=N1 CS16317 [0,1,0,0,0,0|2,0,1]=4 483 B10R1.113 CC1=CC=CC(C(O)=S)=C1 MC433710 [0,1,0,0,0,0|1,0,1]=3 484 B10R1.113 CC1=CN=CC(B(O)O)=C1 CS19510 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.113 CC1=NC=CC(B(O)O)=C1 CS18378 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.113 CC1=NC=CC(C(=O)O)=C1 CS19546 [0,1,0,0,0,0|2,0,1]=4 487 B10R1.113 CC1=NC=CC(C(C)N)=C1 MC110560 [0,1,0,0,0,0|2,0,0]=3 488 B10R1.113 CN(C)C1=CC(Br)=CC=C1 MC40867 [0,1,0,0,0,0|2,0,0]=3 489 B10R1.113 CN(C)C1=CC(Br)=NC=C1 CS14908 [0,1,0,0,0,0|3,0,0]=4 490 B10R1.113 CN(C)C1=CC(Cl)=CC=C1 MC40885 [0,1,0,0,0,0|2,0,0]=3 491 B10R1.113 CN(C)C1=CC(Cl)=NC=C1 MC441248 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.113 CN(C)C1=CC(F)=NC=C1 MC33464 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.113 CN(C)C1=NC(Br)=CC=C1 MC442251 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.113 CN(C)C1=NC=CC(Br)=C1 CS14905 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.113 CN(C)C1=NC=CC(Cl)=C1 MC33456 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.113 FC(F)C1=CC(Br)=NC=C1 MC429161 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.113 FC(F)C1=CC(Cl)=NC=C1 MC431456 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.113 FC(F)C1=CC=CC(Br)=C1 CS12583 [0,1,0,0,0,0|2,0,0]=3 499 B10R1.113 FC(F)C1=CC=CC(Br)=N1 MC432512 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.113 FC(F)C1=CN=CC(Br)=C1 MC430250 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.113 FC(F)C1=NC=CC(Br)=C1 CS17095 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.113 FC(F)C1=NC=CC(Cl)=C1 MC430833 [0,1,0,0,0,0|3,0,0]=4 503 B10R1.113 Fc1cccc(C(F)F)c1 MC433518 [0,1,0,0,0,0|2,0,0]=3 504 B10R1.113 N=C(N)C1=CC(Br)=CC=C1 CS20273 [0,1,0,0,0,0|2,0,1]=4 505 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 CS22167 [0,1,0,0,0,0|1,0,2]=4 506 B10R1.113 NC(=O)C1=CC(N)=CC=C1 MC433795 [0,1,0,0,0,0|1,0,2]=4 507 B10R1.113 NC1=CC(C(=O)O)=CN=C1 CS22022 [0,1,0,0,0,0|2,0,1]=4 508 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CS15431 [0,1,0,0,0,0|2,0,1]=4 509 B10R1.113 NC1=CC(C(F)F)=CC=C1 MC429089 [0,1,0,0,0,0|2,0,0]=3 510 B10R1.113 NC1=CC(C(F)F)=NC=C1 MC432405 [0,1,0,0,0,0|3,0,0]=4 511 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 CS22379 [0,1,0,0,0,0|2,0,1]=4 512 B10R1.113 NC1=CC=CC(B(O)O)=C1 CS11047 [0,1,0,0,0,0|2,0,0]=3 513 B10R1.113 NC1=CC=CC(B(O)O)=C1 CS18152 [0,1,0,0,0,0|2,0,0]=3 514 B10R1.113 NC1=CC=CC(B(O)O)=C1 CS19512 [0,1,0,0,0,0|2,0,0]=3 515 B10R1.113 NC1=CC=CC(B(O)O)=C1 MC20897 [0,1,0,0,0,0|2,0,0]=3 516 B10R1.113 NC1=CC=CC(C(=O)O)=C1 CS13396 [0,1,0,0,0,0|1,0,1]=3 517 B10R1.113 NC1=CC=CC(C(=O)O)=N1 CS19355 [0,1,0,0,0,0|2,0,1]=4 518 B10R1.113 NC1=CN=CC(B(O)O)=C1 CS16642 [0,1,0,0,0,0|3,0,0]=4 519 B10R1.113 NC1=CN=CC(B(O)O)=C1 MC113284 [0,1,0,0,0,0|3,0,0]=4 520 B10R1.113 NC1=NC=CC(B(O)O)=C1 CS17593 [0,1,0,0,0,0|3,0,0]=4 521 B10R1.113 NC1=NC=CC(B(O)O)=C1 MC102864 [0,1,0,0,0,0|3,0,0]=4 522 B10R1.113 NC1=NC=CC(C(=O)O)=C1 CS23021 [0,1,0,0,0,0|2,0,1]=4 523 B10R1.113 NC1=NC=CC(C(F)F)=C1 MC102708 [0,1,0,0,0,0|3,0,0]=4 524 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 MC40439 [0,1,0,0,0,0|1,0,2]=4 525 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 MC40449 [0,1,0,0,0,0|1,0,2]=4 526 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 MC40473 [0,1,0,0,0,0|1,0,2]=4 527 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 CS15122 [0,1,0,0,0,0|1,0,1]=3 528 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 MC20488 [0,1,0,0,0,0|2,0,1]=4 529 B10R1.113 O=C(O)C1=CC(Cl)=CC=C1 CS14882 [0,1,0,0,0,0|1,0,1]=3 530 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 CS18845 [0,1,0,0,0,0|2,0,1]=4 531 B10R1.113 O=C(O)C1=CC(F)=CC=C1 CS10368 [0,1,0,0,0,0|1,0,1]=3 532 B10R1.113 O=C(O)C1=CC(F)=NC=C1 CS18886 [0,1,0,0,0,0|2,0,1]=4 533 B10R1.113 O=C(O)C1=CC(I)=CC=C1 CS10375 [0,1,0,0,0,0|1,0,1]=3 534 B10R1.113 O=C(O)C1=CC(O)=CC=C1 CS19800 [0,1,0,0,0,0|1,0,1]=3 535 B10R1.113 O=C(O)C1=CC(S)=CC=C1 MC20304 [0,1,0,0,0,0|1,0,1]=3 536 B10R1.113 O=C(O)C1=CN=CC(Br)=C1 CS22040 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.113 O=C(O)C1=CN=CC(Cl)=C1 CS18852 [0,1,0,0,0,0|2,0,1]=4 538 B10R1.113 O=C(O)C1=CN=CC(F)=C1 CS22934 [0,1,0,0,0,0|2,0,1]=4 539 B10R1.113 O=C(O)C1=CN=CC(O)=C1 CS22067 [0,1,0,0,0,0|2,0,1]=4 540 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 CS22087 [0,1,0,0,0,0|2,0,1]=4 541 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 CS21854 [0,1,0,0,0,0|2,0,1]=4 542 B10R1.113 O=C(O)C1=NC(F)=CC=C1 CS14295 [0,1,0,0,0,0|2,0,1]=4 543 B10R1.113 O=C(O)C1=NC(O)=CC=C1 CS22114 [0,1,0,0,0,0|2,0,1]=4 544 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 CS14122 [0,1,0,0,0,0|2,0,1]=4 545 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 CS14963 [0,1,0,0,0,0|2,0,1]=4 546 B10R1.113 O=C(O)C1=NC=CC(F)=C1 CS17501 [0,1,0,0,0,0|2,0,1]=4 547 B10R1.113 O=C(O)C1=NC=CC(I)=C1 CS17506 [0,1,0,0,0,0|2,0,1]=4 548 B10R1.113 O=C(O)C1=NC=CC(O)=C1 CS22894 [0,1,0,0,0,0|2,0,1]=4 549 B10R1.113 O=C([O-])C1=CC(Cl)=CC=C1 MC40336 [0,1,0,0,0,0|1,0,2]=4 550 B10R1.113 O=C([O-])C1=CC(F)=CC=C1 MC40350 [0,1,0,0,0,0|1,0,2]=4 551 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=C1 CS20650 [0,1,0,0,0,0|2,0,1]=4 552 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=C1 CS20664 [0,1,0,0,0,0|2,0,1]=4 553 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 CS20684 [0,1,0,0,0,0|2,0,1]=4 554 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 CS19240 [0,1,0,0,0,0|2,0,1]=4 555 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 CS22383 [0,1,0,0,0,0|2,0,1]=4 556 B10R1.113 OB(O)C1=CC(Br)=CC=C1 CS19219 [0,1,0,0,0,0|2,0,0]=3 557 B10R1.113 OB(O)C1=CC(Br)=NC=C1 CS21411 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 CS22999 [0,1,0,0,0,0|2,0,0]=3 559 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 MC442588 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.113 OB(O)C1=CC(Cl)=NC=C1 CS17595 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.113 OB(O)C1=CC(F)=CC=C1 CS21930 [0,1,0,0,0,0|2,0,0]=3 562 B10R1.113 OB(O)C1=CC(F)=NC=C1 CS17610 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.113 OB(O)C1=CC(O)=CC=C1 MC440047 [0,1,0,0,0,0|2,0,0]=3 564 B10R1.113 OB(O)C1=CC(O)=CN=C1 MC114947 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.113 OB(O)C1=CC(O)=NC=C1 MC114099 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.113 OB(O)C1=CN=CC(Br)=C1 MC21126 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.113 OC1=CC(C(F)F)=CC=C1 MC432160 [0,1,0,0,0,0|2,0,0]=3 568 B10R2.6 C1=CC=C(C2CO2)C=C1 MC20326 [0,0,0,1,0,0|0,0,0]=1 569 B10R2.6 C1=CC=C(C2CO2)C=C1 MC445226 [0,0,0,1,0,0|0,0,0]=1 570 B8R1.7 CC(=O)C1=CC=CO1 CS18634 [0,0,0,0,1,0|1,0,2]=4 571 B8R1.7 CC(=O)C1=CC=CS1 CS19387 [0,0,0,0,1,0|1,0,2]=4 572 B8R1.7 CC(=O)C1=CSC=C1 CS18739 [0,0,0,0,1,0|1,0,2]=4 573 B8R1.7 CC(C)C1=CC=CO1 MC428131 [0,0,0,0,1,0|2,0,0]=3 574 B8R1.7 CC(C)C1=NC=CN1 CS21624 [0,0,0,0,1,0|3,0,0]=4 575 B8R1.7 CC(N)C1=NC=CS1 MC446644 [0,0,0,0,1,0|3,0,0]=4 576 B8R1.7 CC(O)C1=CN=CS1 MC116219 [0,0,0,0,1,0|2,0,0]=3 577 B8R1.7 CC(O)[C-]1C=CC=C1 MC440406 [0,0,0,0,1,0|0,0,1]=2 578 B8R1.7 CC(O)[C-]1C=CC=C1 MC440409 [0,0,0,0,1,0|0,0,1]=2 579 B8R1.7 O=C(O)C1=CC=CN1 CS17766 [0,0,0,0,1,0|2,0,1]=4 580 B8R1.7 O=C(O)C1=CC=CO1 CS16202 [0,0,0,0,1,0|2,0,1]=4 581 B8R1.7 O=C(O)C1=CC=CS1 MC41710 [0,0,0,0,1,0|2,0,1]=4 582 B8R1.7 O=C(O)C1=CNC=C1 CS16294 [0,0,0,0,1,0|2,0,1]=4 583 B8R1.7 O=C(O)C1=COC=C1 CS14540 [0,0,0,0,1,0|2,0,1]=4 584 B8R1.7 O=C(O)C1=CSC=C1 CS22727 [0,0,0,0,1,0|2,0,1]=4 585 B8R1.7 OB(O)C1=CC=CN1 MC113759 [0,0,0,0,1,0|3,0,0]=4 586 B8R1.7 OB(O)C1=CC=CO1 CS22587 [0,0,0,0,1,0|3,0,0]=4 587 B8R1.7 OB(O)C1=CC=CS1 CS22584 [0,0,0,0,1,0|3,0,0]=4 588 B8R1.7 OB(O)C1=CNC=C1 MC113852 [0,0,0,0,1,0|3,0,0]=4 589 B8R1.7 OB(O)C1=COC=C1 CS15915 [0,0,0,0,1,0|3,0,0]=4 590 B8R1.7 OB(O)C1=CSC=C1 CS22585 [0,0,0,0,1,0|3,0,0]=4 591 B10R1.18 BrC(Br)=CC1=CC=CC=C1 CS16193 [0,0,0,0,0,1|2,0,1]=4 592 B10R1.18 CC(=O)CC1=CC=CN=C1 MC102696 [0,0,0,0,0,1|1,0,2]=4 593 B10R1.18 CC(=O)CC1=CC=NC=C1 CS20988 [0,0,0,0,0,1|1,0,2]=4 594 B10R1.18 CC(=O)CC1=NC=CC=C1 CS20802 [0,0,0,0,0,1|1,0,2]=4 595 B10R1.18 CC(=O)NC1=CC=CC=C1 MC34102 [0,0,0,0,0,1|0,0,2]=3 596 B10R1.18 CC(Br)CC1=CC=CC=C1 MC41813 [0,0,0,0,0,1|1,0,0]=2 597 B10R1.18 CC(C)NC1=CC=CC=C1 CS11787 [0,0,0,0,0,1|1,0,0]=2 598 B10R1.18 CC(C)OC1=CC=CC=C1 MC41360 [0,0,0,0,0,1|1,0,0]=2 599 B10R1.18 FC(F)OC1=CC=CC=C1 MC41385 [0,0,0,0,0,1|2,0,0]=3 600 B10R1.18 FC(F)OC1=NC=CC=C1 MC116213 [0,0,0,0,0,1|3,0,0]=4 601 B10R1.18 FC(F)SC1=CC=CC=C1 MC428027 [0,0,0,0,0,1|2,0,0]=3 602 B10R1.18 NC(=O)NC1=CC=CC=C1 CS10533 [0,0,0,0,0,1|1,0,2]=4 603 B10R1.18 NC(=O)OC1=CC=CC=C1 MC428148 [0,0,0,0,0,1|1,0,2]=4 604 B10R1.18 O=C(Cl)OC1=CC=CC=C1 CS18823 [0,0,0,0,0,1|1,0,2]=4 605 B10R1.18 O=C(O)CC1=CC=CN=C1 CS20325 [0,0,0,0,0,1|2,0,1]=4 606 B10R1.18 O=C(O)CC1=CC=NC=C1 CS20327 [0,0,0,0,0,1|2,0,1]=4 607 B10R1.18 O=C(O)CC1=CC=NC=C1 MC41632 [0,0,0,0,0,1|2,0,1]=4 608 B10R1.18 O=C(O)CC1=NC=CC=C1 MC41631 [0,0,0,0,0,1|2,0,1]=4 609 B10R1.18 O=C([O-])CC1=CC=CC=C1 MC34448 [0,0,0,0,0,1|1,0,2]=4 610 B7R1.3 BrC1=CC=CC=C1 MC41456 [2,0,0,0,0,0|1,0,0]=3 611 B7R1.3 BrC1=CC=CN=C1 CS19218 [2,0,0,0,0,0|2,0,0]=4 612 B7R1.3 BrC1=CC=NC=C1 CS13376 [2,0,0,0,0,0|2,0,0]=4 613 B7R1.3 BrC1=NC=CC=C1 CS17815 [2,0,0,0,0,0|2,0,0]=4 614 B7R1.3 CC1=CC=CN=C1 MC107850 [2,0,0,0,0,0|1,0,0]=3 615 B7R1.3 CC1=CC=CN=N1 CS22374 [2,0,0,0,0,0|2,0,0]=4 616 B7R1.3 CC1=CC=NC=C1 MC31239 [2,0,0,0,0,0|1,0,0]=3 617 B7R1.3 CC1=CC=NC=C1 MC41625 [2,0,0,0,0,0|1,0,0]=3 618 B7R1.3 CC1=CN=CN=C1 CS18851 [2,0,0,0,0,0|2,0,0]=4 619 B7R1.3 CC1=CN=NC=C1 CS22983 [2,0,0,0,0,0|2,0,0]=4 620 B7R1.3 CC1=NC=CC=C1 MC41623 [2,0,0,0,0,0|1,0,0]=3 621 B7R1.3 CC1=NC=NC=C1 CS19795 [2,0,0,0,0,0|2,0,0]=4 622 B7R1.3 C[N+]1=CC=CC=C1 CS17683 [2,0,0,0,0,0|1,0,0]=3 623 B7R1.3 ClC1=CC=CC=C1 MC41469 [2,0,0,0,0,0|1,0,0]=3 624 B7R1.3 ClC1=CC=NC=C1 CS13378 [2,0,0,0,0,0|2,0,0]=4 625 B7R1.3 ClC1=NC=CC=C1 MC20672 [2,0,0,0,0,0|2,0,0]=4 626 B7R1.3 FC1=CC=CC=C1 MC41489 [2,0,0,0,0,0|1,0,0]=3 627 B7R1.3 FC1=CC=CN=C1 MC20006 [2,0,0,0,0,0|2,0,0]=4 628 B7R1.3 FC1=CC=NC=C1 MC429573 [2,0,0,0,0,0|2,0,0]=4 629 B7R1.3 FC1=CC=NC=C1 MC433050 [2,0,0,0,0,0|2,0,0]=4 630 B7R1.3 FC1=NC=CC=C1 MC20005 [2,0,0,0,0,0|2,0,0]=4 631 B7R1.3 F[N+]1=CC=CC=C1 MC426120 [2,0,0,0,0,0|2,0,0]=4 632 B7R1.3 F[N+]1=CC=CC=C1 MC429468 [2,0,0,0,0,0|2,0,0]=4 633 B7R1.3 IC1=CC=CC=C1 CS19958 [2,0,0,0,0,0|1,0,0]=3 634 B7R1.3 IC1=NC=CC=C1 CS14565 [2,0,0,0,0,0|2,0,0]=4 635 B7R1.3 NC1=CC=CC=C1 MC40851 [2,0,0,0,0,0|1,0,0]=3 636 B7R1.3 NC1=CC=CN=C1 CS19073 [2,0,0,0,0,0|2,0,0]=4 637 B7R1.3 NC1=CC=NC=C1 MC20017 [2,0,0,0,0,0|2,0,0]=4 638 B7R1.3 NC1=NC=CC=C1 MC41600 [2,0,0,0,0,0|2,0,0]=4 639 B7R1.3 O=C1C=CC=CN1 CS18724 [2,0,0,0,0,0|1,0,1]=4 640 B7R1.3 OC1=CC=CC=C1 MC41210 [2,0,0,0,0,0|0,0,0]=2 641 B7R1.3 OC1=CC=CN=C1 CS17813 [2,0,0,0,0,0|1,0,0]=3 642 B7R1.3 OC1=CC=NC=C1 CS19216 [2,0,0,0,0,0|1,0,0]=3 643 B7R1.3 OC1=CN=CN=C1 CS10407 [2,0,0,0,0,0|2,0,0]=4 644 B7R1.3 OC1=CN=NC=C1 CS17666 [2,0,0,0,0,0|2,0,0]=4 645 B7R1.3 OC1=NC=CC=C1 CS21602 [2,0,0,0,0,0|1,0,0]=3 646 B7R1.3 OC1=NC=CC=N1 CS14246 [2,0,0,0,0,0|2,0,0]=4 647 B7R1.3 OC1=NC=CC=N1 CS16090 [2,0,0,0,0,0|2,0,0]=4 648 B7R1.3 OC1=NC=CC=N1 MC41651 [2,0,0,0,0,0|2,0,0]=4 649 B7R1.3 OC1=NC=CN=C1 CS21601 [2,0,0,0,0,0|2,0,0]=4 650 B7R1.3 OC1=NC=NC=C1 CS15728 [2,0,0,0,0,0|2,0,0]=4 651 B7R1.3 PC1=CC=CC=C1 MC444841 [2,0,0,0,0,0|1,0,0]=3 652 B7R1.3 [S-]C1=CC=CC=C1 MC41417 [2,0,0,0,0,0|0,1,0]=3 653 B9R1.1 BrCC1=CC=C(Br)C=C1 CS19166 [1,1,0,0,0,0|1,0,0]=3 654 B9R1.1 BrCC1=CC=C(I)C=C1 CS20172 [1,1,0,0,0,0|1,0,0]=3 655 B9R1.1 BrCC1=CN=C(Br)C=C1 MC430652 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.1 Br[Mg]c1ccc(Br)cc1 MC116037 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.1 C#CC1=CC=C(Br)C=C1 MC440298 [1,1,0,0,0,0|0,0,2]=4 658 B9R1.1 C#CC1=CC=C(C)C=C1 CS21552 [1,1,0,0,0,0|0,0,2]=4 659 B9R1.1 C#CC1=CC=C(Cl)C=C1 MC440300 [1,1,0,0,0,0|0,0,2]=4 660 B9R1.1 C#CC1=CC=C(F)C=C1 MC429574 [1,1,0,0,0,0|0,0,2]=4 661 B9R1.1 C#CC1=CC=C(I)C=C1 MC443225 [1,1,0,0,0,0|0,0,2]=4 662 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [1,1,0,0,0,0|0,0,2]=4 663 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [1,1,0,0,0,0|0,0,2]=4 664 B9R1.1 CC1=CC=C(C#N)C=C1 CS19807 [1,1,0,0,0,0|1,0,1]=4 665 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [1,1,0,0,0,0|0,0,2]=4 666 B9R1.1 CC1=CC=C(CBr)C=C1 CS22969 [1,1,0,0,0,0|1,0,0]=3 667 B9R1.1 CC1=CC=C(CCl)C=C1 MC40603 [1,1,0,0,0,0|1,0,0]=3 668 B9R1.1 CC1=CC=C(CN)C=C1 CS22970 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [1,1,0,0,0,0|0,0,0]=2 670 B9R1.1 CC1=CC=C(CO)C=N1 MC21041 [1,1,0,0,0,0|1,0,0]=3 671 B9R1.1 CC1=CC=C(NN)C=C1 CS19576 [1,1,0,0,0,0|2,0,0]=4 672 B9R1.1 CC1=CN=C(CCl)C=C1 MC115829 [1,1,0,0,0,0|2,0,0]=4 673 B9R1.1 CC1=CN=C(CN)C=C1 CS18319 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.1 CC1=CN=C(CO)C=N1 CS12383 [1,1,0,0,0,0|2,0,0]=4 675 B9R1.1 CC1=CN=C(CO)N=C1 MC102095 [1,1,0,0,0,0|2,0,0]=4 676 B9R1.1 CC1=NC=C(CO)C=N1 CS13969 [1,1,0,0,0,0|2,0,0]=4 677 B9R1.1 CCC1=CC=C(Br)C=C1 CS10865 [1,1,0,0,0,0|0,0,0]=2 678 B9R1.1 CCC1=CC=C(F)C=C1 MC20965 [1,1,0,0,0,0|0,0,0]=2 679 B9R1.1 CCC1=CC=C(I)C=C1 MC20189 [1,1,0,0,0,0|0,0,0]=2 680 B9R1.1 CCC1=CC=C(N)C=C1 MC40912 [1,1,0,0,0,0|0,0,0]=2 681 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [1,1,0,0,0,0|0,0,0]=2 682 B9R1.1 CCC1=CN=C(Br)C=C1 CS13124 [1,1,0,0,0,0|1,0,0]=3 683 B9R1.1 CCC1=CN=C(Br)C=N1 MC443464 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.1 CCC1=CN=C(C)C=C1 MC20566 [1,1,0,0,0,0|1,0,0]=3 685 B9R1.1 CCC1=CN=C(Cl)N=C1 MC444395 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.1 CCC1=CN=C(N)N=C1 CS14255 [1,1,0,0,0,0|2,0,0]=4 687 B9R1.1 CCC1=NC=C(Br)C=C1 CS12376 [1,1,0,0,0,0|1,0,0]=3 688 B9R1.1 CCC1=NC=C(Br)C=N1 CS13125 [1,1,0,0,0,0|2,0,0]=4 689 B9R1.1 CCC1=NC=C(N)C=N1 MC444378 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.1 CNC1=CC=C(Cl)C=C1 MC40891 [1,1,0,0,0,0|1,0,0]=3 691 B9R1.1 CNC1=CC=C(F)C=C1 MC40919 [1,1,0,0,0,0|1,0,0]=3 692 B9R1.1 CNC1=CC=C(I)C=C1 CS22906 [1,1,0,0,0,0|1,0,0]=3 693 B9R1.1 CNC1=NC=C(Br)C=C1 CS10304 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.1 CNC1=NC=C(N)C=C1 MC33484 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.1 COC1=CC=C(Br)C=C1 MC41310 [1,1,0,0,0,0|1,0,0]=3 696 B9R1.1 COC1=CC=C(Cl)C=C1 MC41327 [1,1,0,0,0,0|1,0,0]=3 697 B9R1.1 COC1=CC=C(F)C=C1 MC30345 [1,1,0,0,0,0|1,0,0]=3 698 B9R1.1 COC1=CC=C(I)C=C1 MC41342 [1,1,0,0,0,0|1,0,0]=3 699 B9R1.1 COC1=CC=C(N)C=C1 CS18580 [1,1,0,0,0,0|1,0,0]=3 700 B9R1.1 COC1=CC=C(N)C=N1 CS19527 [1,1,0,0,0,0|2,0,0]=4 701 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [1,1,0,0,0,0|1,0,0]=3 702 B9R1.1 COC1=CC=C(O)C=N1 CS19503 [1,1,0,0,0,0|2,0,0]=4 703 B9R1.1 COC1=CC=C(S)C=C1 MC20380 [1,1,0,0,0,0|1,0,0]=3 704 B9R1.1 COC1=CC=[N+]([O-])C=C1 CS18613 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.1 COC1=CN=C(Br)C=C1 CS13470 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.1 COC1=CN=C(F)C=C1 MC442697 [1,1,0,0,0,0|2,0,0]=4 707 B9R1.1 COC1=CN=C(N)C=C1 CS17791 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.1 COC1=NC=C(Br)C=C1 CS22030 [1,1,0,0,0,0|2,0,0]=4 709 B9R1.1 COC1=NC=C(C)C=C1 CS21644 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.1 COC1=NC=C(Cl)C=C1 CS17976 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.1 COC1=NC=C(F)C=C1 MC20598 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.1 COC1=NC=C(I)C=C1 CS21641 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.1 COC1=NC=C(N)C=C1 MC33494 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [1,1,0,0,0,0|1,0,0]=3 715 B9R1.1 CSC1=CN=C(Br)C=C1 MC430574 [1,1,0,0,0,0|2,0,0]=4 716 B9R1.1 ClC1=CC=C(CBr)C=C1 MC40527 [1,1,0,0,0,0|1,0,0]=3 717 B9R1.1 ClC1=CN=C(CBr)C=C1 CS16112 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.1 ClC1=CN=C(CBr)C=C1 CS17526 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.1 ClC1=NC=C(CBr)C=C1 MC430654 [1,1,0,0,0,0|2,0,0]=4 720 B9R1.1 ClCC1=CC=C(Br)C=C1 CS19167 [1,1,0,0,0,0|1,0,0]=3 721 B9R1.1 ClCC1=CC=C(Cl)C=C1 CS19806 [1,1,0,0,0,0|1,0,0]=3 722 B9R1.1 FC1=CC=C(CBr)C=C1 CS19071 [1,1,0,0,0,0|1,0,0]=3 723 B9R1.1 FC1=CC=C(CCl)C=C1 MC429572 [1,1,0,0,0,0|1,0,0]=3 724 B9R1.1 FC1=CN=C(CBr)C=C1 MC430066 [1,1,0,0,0,0|2,0,0]=4 725 B9R1.1 FC1=CN=C(CBr)C=C1 MC432544 [1,1,0,0,0,0|2,0,0]=4 726 B9R1.1 FC1=NC=C(CBr)C=C1 CS13268 [1,1,0,0,0,0|2,0,0]=4 727 B9R1.1 N#CC1=CC=C(Br)C=C1 CS19210 [1,1,0,0,0,0|1,0,1]=4 728 B9R1.1 N#CC1=CC=C(Cl)C=C1 CS19211 [1,1,0,0,0,0|1,0,1]=4 729 B9R1.1 N#CC1=CC=C(F)C=C1 CS18637 [1,1,0,0,0,0|1,0,1]=4 730 B9R1.1 N#CC1=CC=C(I)C=C1 CS22010 [1,1,0,0,0,0|1,0,1]=4 731 B9R1.1 N#CC1=CC=C(N)C=C1 CS13395 [1,1,0,0,0,0|1,0,1]=4 732 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [1,1,0,0,0,0|1,0,1]=4 733 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [1,1,0,0,0,0|0,0,2]=4 734 B9R1.1 NC1=CC=C(CO)C=C1 MC33175 [1,1,0,0,0,0|0,0,0]=2 735 B9R1.1 NC1=CC=C(CO)C=N1 MC425278 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.1 NC1=CN=C(CO)C=C1 MC33467 [1,1,0,0,0,0|1,0,0]=3 737 B9R1.1 NCC1=CC=C(Br)C=C1 CS19587 [1,1,0,0,0,0|1,0,0]=3 738 B9R1.1 NCC1=CC=C(Br)N=C1 CS11090 [1,1,0,0,0,0|2,0,0]=4 739 B9R1.1 NCC1=CC=C(Cl)C=C1 MC33031 [1,1,0,0,0,0|1,0,0]=3 740 B9R1.1 NCC1=CC=C(Cl)N=C1 CS16390 [1,1,0,0,0,0|2,0,0]=4 741 B9R1.1 NCC1=CC=C(F)C=C1 CS18721 [1,1,0,0,0,0|1,0,0]=3 742 B9R1.1 NCC1=CC=C(I)C=C1 MC40836 [1,1,0,0,0,0|1,0,0]=3 743 B9R1.1 NCC1=CC=C(I)C=C1 MC40837 [1,1,0,0,0,0|1,0,0]=3 744 B9R1.1 NCC1=CC=C(N)C=N1 CS10590 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [1,1,0,0,0,0|1,0,0]=3 746 B9R1.1 NCC1=CN=C(F)C=C1 MC104517 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.1 NCC1=NC=C(F)C=C1 CS16554 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.1 NCC1=NC=C(F)C=C1 MC430168 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.1 NCC1=NC=C(F)C=C1 MC430169 [1,1,0,0,0,0|2,0,0]=4 750 B9R1.1 NNC1=CC=C(Br)C=C1 CS15342 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.1 NNC1=CC=C(Cl)C=C1 CS13495 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.1 NNC1=CC=C(Cl)C=C1 CS17312 [1,1,0,0,0,0|2,0,0]=4 753 B9R1.1 NNC1=CC=C(F)C=C1 CS22006 [1,1,0,0,0,0|2,0,0]=4 754 B9R1.1 NNC1=CC=C(N)C=C1 MC430700 [1,1,0,0,0,0|2,0,0]=4 755 B9R1.1 O=C1C=CC(CO)=CN1 CS19816 [1,1,0,0,0,0|1,0,0]=3 756 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [1,1,0,0,0,0|0,0,2]=4 757 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [1,1,0,0,0,0|0,0,2]=4 758 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [1,1,0,0,0,0|0,0,2]=4 759 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [1,1,0,0,0,0|0,0,2]=4 760 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [1,1,0,0,0,0|0,0,2]=4 761 B9R1.1 OCC1=CC=C(Br)C=C1 CS19378 [1,1,0,0,0,0|0,0,0]=2 762 B9R1.1 OCC1=CC=C(Cl)C=C1 CS19353 [1,1,0,0,0,0|0,0,0]=2 763 B9R1.1 OCC1=CC=C(F)C=C1 MC40711 [1,1,0,0,0,0|0,0,0]=2 764 B9R1.1 OCC1=CC=C(F)N=C1 MC429931 [1,1,0,0,0,0|1,0,0]=3 765 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [1,1,0,0,0,0|0,0,0]=2 766 B9R1.1 OCC1=CN=C(Cl)C=C1 MC20657 [1,1,0,0,0,0|1,0,0]=3 767 B9R1.1 OCC1=CN=C(Cl)N=C1 MC444180 [1,1,0,0,0,0|2,0,0]=4 768 B9R1.1 OCC1=NC=C(Br)C=C1 CS23005 [1,1,0,0,0,0|1,0,0]=3 769 B9R1.1 OCC1=NC=C(Br)C=N1 MC104533 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.1 OCC1=NC=C(Cl)C=C1 CS21758 [1,1,0,0,0,0|1,0,0]=3 771 B9R1.1 OCC1=NC=C(Cl)C=N1 MC104698 [1,1,0,0,0,0|2,0,0]=4 772 B9R1.1 OCC1=NC=C(Cl)N=C1 CS14569 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.1 OCC1=NC=C(F)C=C1 CS10382 [1,1,0,0,0,0|1,0,0]=3 774 B9R1.1 OCC1=NC=C(F)C=N1 MC103703 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.2 BrCC1=CC(I)=CC=C1 MC40562 [1,1,0,0,0,0|1,0,0]=3 776 B9R1.2 BrCC1=CC=CC(Br)=C1 CS19344 [1,1,0,0,0,0|1,0,0]=3 777 B9R1.2 BrCC1=CC=CC(Br)=N1 MC425531 [1,1,0,0,0,0|2,0,0]=4 778 B9R1.2 Br[Mg]c1cccc(Br)c1 MC116039 [1,1,0,0,0,0|2,0,0]=4 779 B9R1.2 C#CC1=CC(F)=CC=C1 CS20642 [1,1,0,0,0,0|0,0,2]=4 780 B9R1.2 C#CC1=CC=CC(Br)=C1 MC440366 [1,1,0,0,0,0|0,0,2]=4 781 B9R1.2 C#CC1=CC=CC(N)=C1 CS10819 [1,1,0,0,0,0|0,0,2]=4 782 B9R1.2 C#CC1=CC=CC(O)=C1 CS22325 [1,1,0,0,0,0|0,0,2]=4 783 B9R1.2 C=NC1=CC(C)=CC=C1 MC111025 [1,1,0,0,0,0|1,0,1]=4 784 B9R1.2 CC1=CC(CCl)=NC=C1 CS15442 [1,1,0,0,0,0|2,0,0]=4 785 B9R1.2 CC1=CC(CN)=CC=C1 CS19644 [1,1,0,0,0,0|1,0,0]=3 786 B9R1.2 CC1=CC(CO)=NC=C1 CS11126 [1,1,0,0,0,0|1,0,0]=3 787 B9R1.2 CC1=CC(CO)=NC=N1 MC103804 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.2 CC1=CC(NN)=CC=C1 CS19574 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.2 CC1=CC=CC(C#N)=C1 CS19778 [1,1,0,0,0,0|1,0,1]=4 790 B9R1.2 CC1=CC=CC(C=O)=C1 MC41127 [1,1,0,0,0,0|0,0,2]=4 791 B9R1.2 CC1=CC=CC(CBr)=N1 MC41602 [1,1,0,0,0,0|2,0,0]=4 792 B9R1.2 CC1=CC=CC(CCl)=C1 MC40602 [1,1,0,0,0,0|1,0,0]=3 793 B9R1.2 CC1=CC=CC(CF)=C1 MC433869 [1,1,0,0,0,0|1,0,0]=3 794 B9R1.2 CC1=CC=CC(CN)=N1 CS18414 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.2 CC1=CC=CC(CO)=N1 MC20920 [1,1,0,0,0,0|1,0,0]=3 796 B9R1.2 CC1=CN=CC(CCl)=C1 CS14445 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.2 CC1=CN=CC(CO)=N1 CS15787 [1,1,0,0,0,0|2,0,0]=4 798 B9R1.2 CC1=NC(CO)=NC=C1 MC444189 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.2 CC1=NC=CC(CN)=C1 MC443686 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.2 CCC1=CC(=O)N=CN1 MC106508 [1,1,0,0,0,0|2,0,0]=4 801 B9R1.2 CCC1=CC(Cl)=NC=N1 MC106509 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.2 CCC1=CC=CC(Br)=C1 MC30292 [1,1,0,0,0,0|0,0,0]=2 803 B9R1.2 CCC1=CC=CC(Br)=N1 CS15322 [1,1,0,0,0,0|1,0,0]=3 804 B9R1.2 CCC1=CC=CC(C)=C1 MC425590 [1,1,0,0,0,0|0,0,0]=2 805 B9R1.2 CCC1=CC=CC(N)=C1 MC433319 [1,1,0,0,0,0|0,0,0]=2 806 B9R1.2 CCC1=CC=C[N+]([O-])=C1 MC427174 [1,1,0,0,0,0|1,0,0]=3 807 B9R1.2 CCC1=CN=CC(Br)=C1 CS11907 [1,1,0,0,0,0|1,0,0]=3 808 B9R1.2 CCC1=NC=CC(N)=C1 MC105214 [1,1,0,0,0,0|1,0,0]=3 809 B9R1.2 CNC1=CC(Br)=CC=C1 CS22185 [1,1,0,0,0,0|1,0,0]=3 810 B9R1.2 CNC1=CC(Br)=CC=C1 MC40876 [1,1,0,0,0,0|1,0,0]=3 811 B9R1.2 CNC1=CC(Br)=CN=C1 MC443556 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.2 CNC1=CC(Br)=NC=C1 MC442736 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.2 CNC1=CC(Cl)=CC=C1 MC20486 [1,1,0,0,0,0|1,0,0]=3 814 B9R1.2 CNC1=CC(N)=CC=C1 CS16640 [1,1,0,0,0,0|1,0,0]=3 815 B9R1.2 CNC1=CC=CC(O)=C1 MC442233 [1,1,0,0,0,0|1,0,0]=3 816 B9R1.2 CNC1=NC=CC(Br)=C1 MC33481 [1,1,0,0,0,0|2,0,0]=4 817 B9R1.2 CNC1=NC=CC(Cl)=C1 MC430266 [1,1,0,0,0,0|2,0,0]=4 818 B9R1.2 CNC1=NC=CC(N)=C1 CS16967 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.2 COC1=CC(=O)NC=C1 CS12334 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.2 COC1=CC(Br)=NC=C1 CS16230 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.2 COC1=CC(Cl)=NC=C1 CS19311 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.2 COC1=CC(F)=NC=C1 CS14826 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.2 COC1=CC(N)=NC=C1 CS19522 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.2 COC1=CC=CC(Br)=N1 CS14301 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.2 COC1=CC=CC(Cl)=C1 CS19894 [1,1,0,0,0,0|1,0,0]=3 826 B9R1.2 COC1=CC=CC(Cl)=N1 CS13826 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.2 COC1=CC=CC(F)=C1 CS19929 [1,1,0,0,0,0|1,0,0]=3 828 B9R1.2 COC1=CC=CC(F)=N1 CS13652 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.2 COC1=CC=CC(I)=N1 CS18075 [1,1,0,0,0,0|2,0,0]=4 830 B9R1.2 COC1=CC=CC(N)=C1 CS19943 [1,1,0,0,0,0|1,0,0]=3 831 B9R1.2 COC1=CC=CC(N)=N1 CS13845 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.2 COC1=CC=CC(O)=C1 CS18747 [1,1,0,0,0,0|1,0,0]=3 833 B9R1.2 COC1=CC=CC(O)=N1 MC428307 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.2 COC1=CC=C[N+]([O-])=C1 CS22349 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.2 COC1=CN=CC(Br)=C1 MC427397 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.2 COC1=CN=CC(N)=C1 CS19973 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.2 COC1=CN=CC(O)=C1 CS17819 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.2 COC1=NC(C)=CC=C1 CS15396 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.2 COC1=NC=CC(Br)=C1 CS22650 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.2 COC1=NC=CC(C)=C1 CS21637 [1,1,0,0,0,0|2,0,0]=4 841 B9R1.2 COC1=NC=CC(Cl)=C1 CS19313 [1,1,0,0,0,0|2,0,0]=4 842 B9R1.2 COC1=NC=CC(F)=C1 CS11908 [1,1,0,0,0,0|2,0,0]=4 843 B9R1.2 COC1=NC=CC(I)=C1 CS19594 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.2 COC1=NC=CC(N)=C1 CS19525 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.2 COC1=NC=CC(O)=C1 MC115931 [1,1,0,0,0,0|2,0,0]=4 846 B9R1.2 CSC1=CC(N)=CC=C1 MC20570 [1,1,0,0,0,0|1,0,0]=3 847 B9R1.2 CSC1=CC=CC(Br)=N1 MC442232 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.2 CSC1=NC=CC(Cl)=C1 CS12493 [1,1,0,0,0,0|2,0,0]=4 849 B9R1.2 ClC1=CC(CBr)=NC=C1 MC111259 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.2 ClC1=CC=CC(CBr)=C1 CS22235 [1,1,0,0,0,0|1,0,0]=3 851 B9R1.2 ClC1=CN=CC(CBr)=C1 MC107431 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.2 ClCC1=CC(Br)=CC=C1 MC40579 [1,1,0,0,0,0|1,0,0]=3 853 B9R1.2 ClCC1=CC(Cl)=CC=C1 MC40582 [1,1,0,0,0,0|1,0,0]=3 854 B9R1.2 ClCC1=CC=CC(Br)=N1 MC425483 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.2 ClCC1=CN=CC(Br)=C1 MC425679 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.2 FC1=CC=CC(CBr)=C1 MC40552 [1,1,0,0,0,0|1,0,0]=3 857 B9R1.2 FC1=CC=CC(CCl)=C1 CS19068 [1,1,0,0,0,0|1,0,0]=3 858 B9R1.2 FCC1=CC=CC(F)=C1 MC433530 [1,1,0,0,0,0|1,0,0]=3 859 B9R1.2 N#CC1=CC(Br)=CC=C1 CS19865 [1,1,0,0,0,0|1,0,1]=4 860 B9R1.2 N#CC1=CC(Cl)=CC=C1 CS19319 [1,1,0,0,0,0|1,0,1]=4 861 B9R1.2 N#CC1=CC(F)=CC=C1 MC20044 [1,1,0,0,0,0|1,0,1]=4 862 B9R1.2 N#CC1=CC(I)=CC=C1 MC33186 [1,1,0,0,0,0|1,0,1]=4 863 B9R1.2 N#CC1=CC(N)=CC=C1 CS13394 [1,1,0,0,0,0|1,0,1]=4 864 B9R1.2 N#CC1=CC(O)=CC=C1 CS19377 [1,1,0,0,0,0|1,0,1]=4 865 B9R1.2 NC1=CC(CO)=NC=C1 MC33483 [1,1,0,0,0,0|1,0,0]=3 866 B9R1.2 NC1=CC(CO)=NC=N1 MC121194 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.2 NC1=CC(CO)=NC=N1 MC425257 [1,1,0,0,0,0|2,0,0]=4 868 B9R1.2 NC1=CC=CC(CO)=C1 CS18821 [1,1,0,0,0,0|0,0,0]=2 869 B9R1.2 NC1=CC=CC(CO)=N1 CS16612 [1,1,0,0,0,0|1,0,0]=3 870 B9R1.2 NC1=CN=CC(CO)=C1 CS22079 [1,1,0,0,0,0|1,0,0]=3 871 B9R1.2 NC1=NC=CC(CCl)=C1 MC431205 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.2 NC1=NC=CC(CO)=C1 CS17807 [1,1,0,0,0,0|1,0,0]=3 873 B9R1.2 NC1=NC=CC(CO)=N1 CS21291 [1,1,0,0,0,0|2,0,0]=4 874 B9R1.2 NCC1=CC(Br)=CC=C1 CS19652 [1,1,0,0,0,0|1,0,0]=3 875 B9R1.2 NCC1=CC(Br)=CC=C1 MC40798 [1,1,0,0,0,0|1,0,0]=3 876 B9R1.2 NCC1=CC(Br)=CN=C1 MC106753 [1,1,0,0,0,0|2,0,0]=4 877 B9R1.2 NCC1=CC(Br)=NC=C1 CS17247 [1,1,0,0,0,0|2,0,0]=4 878 B9R1.2 NCC1=CC(Cl)=CC=C1 MC33134 [1,1,0,0,0,0|1,0,0]=3 879 B9R1.2 NCC1=CC(Cl)=NC=C1 CS16037 [1,1,0,0,0,0|2,0,0]=4 880 B9R1.2 NCC1=CC(F)=CC=C1 MC33025 [1,1,0,0,0,0|1,0,0]=3 881 B9R1.2 NCC1=CC(F)=CN=C1 MC431591 [1,1,0,0,0,0|2,0,0]=4 882 B9R1.2 NCC1=CC(F)=NC=C1 MC116260 [1,1,0,0,0,0|2,0,0]=4 883 B9R1.2 NCC1=CC(I)=CC=C1 CS22330 [1,1,0,0,0,0|1,0,0]=3 884 B9R1.2 NCC1=CC(N)=NC=C1 CS17453 [1,1,0,0,0,0|2,0,0]=4 885 B9R1.2 NCC1=CN=CC(N)=C1 MC33458 [1,1,0,0,0,0|2,0,0]=4 886 B9R1.2 NCC1=NC(Br)=CC=C1 CS10635 [1,1,0,0,0,0|2,0,0]=4 887 B9R1.2 NCC1=NC(Br)=CC=C1 MC425058 [1,1,0,0,0,0|2,0,0]=4 888 B9R1.2 NCC1=NC(F)=CC=C1 CS13193 [1,1,0,0,0,0|2,0,0]=4 889 B9R1.2 NCC1=NC=CC(Br)=C1 CS12824 [1,1,0,0,0,0|2,0,0]=4 890 B9R1.2 NCC1=NC=CC(Br)=C1 CS15559 [1,1,0,0,0,0|2,0,0]=4 891 B9R1.2 NCC1=NC=CC(Cl)=C1 MC113773 [1,1,0,0,0,0|2,0,0]=4 892 B9R1.2 NNC1=CC(Br)=CC=C1 CS19465 [1,1,0,0,0,0|2,0,0]=4 893 B9R1.2 NNC1=CC(Cl)=CC=C1 CS19479 [1,1,0,0,0,0|2,0,0]=4 894 B9R1.2 NNC1=CC(F)=CC=C1 CS19485 [1,1,0,0,0,0|2,0,0]=4 895 B9R1.2 O=CC1=CC(Br)=CC=C1 CS18958 [1,1,0,0,0,0|0,0,2]=4 896 B9R1.2 O=CC1=CC(Cl)=CC=C1 MC20579 [1,1,0,0,0,0|0,0,2]=4 897 B9R1.2 O=CC1=CC(F)=CC=C1 CS22298 [1,1,0,0,0,0|0,0,2]=4 898 B9R1.2 O=CC1=CC(I)=CC=C1 CS20132 [1,1,0,0,0,0|0,0,2]=4 899 B9R1.2 O=CC1=CC(O)=CC=C1 MC20422 [1,1,0,0,0,0|0,0,2]=4 900 B9R1.2 OC1=CC(CBr)=CC=C1 MC425573 [1,1,0,0,0,0|1,0,0]=3 901 B9R1.2 OCC1=CC(Br)=CN=C1 CS18272 [1,1,0,0,0,0|1,0,0]=3 902 B9R1.2 OCC1=CC(Br)=NC=C1 CS19256 [1,1,0,0,0,0|1,0,0]=3 903 B9R1.2 OCC1=CC(F)=CC=C1 CS19069 [1,1,0,0,0,0|0,0,0]=2 904 B9R1.2 OCC1=CC(F)=CN=C1 MC430713 [1,1,0,0,0,0|1,0,0]=3 905 B9R1.2 OCC1=CC(F)=NC=C1 CS21547 [1,1,0,0,0,0|1,0,0]=3 906 B9R1.2 OCC1=CC(O)=CC=C1 MC40720 [1,1,0,0,0,0|0,0,0]=2 907 B9R1.2 OCC1=NC(Br)=CC=C1 CS23004 [1,1,0,0,0,0|1,0,0]=3 908 B9R1.2 OCC1=NC(Cl)=CC=C1 CS10667 [1,1,0,0,0,0|1,0,0]=3 909 B9R1.2 OCC1=NC(Cl)=CC=C1 CS19907 [1,1,0,0,0,0|1,0,0]=3 910 B9R1.2 OCC1=NC(Cl)=CN=C1 CS16124 [1,1,0,0,0,0|2,0,0]=4 911 B9R1.2 OCC1=NC(F)=CC=C1 MC430488 [1,1,0,0,0,0|1,0,0]=3 912 B9R1.2 OCC1=NC=CC(Br)=C1 CS18696 [1,1,0,0,0,0|1,0,0]=3 913 B9R1.2 OCC1=NC=CC(Cl)=C1 MC20517 [1,1,0,0,0,0|1,0,0]=3 914 B9R1.2 OCC1=NC=CC(O)=C1 CS17612 [1,1,0,0,0,0|1,0,0]=3 915 B9R1.2 OCC1=NC=NC(Cl)=C1 MC444425 [1,1,0,0,0,0|2,0,0]=4 916 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [1,1,0,0,0,0|0,0,0]=2 917 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [1,1,0,0,0,0|1,0,0]=3 918 B9R1.8 CCCC1=CC=CN=C1 CS22402 [1,1,0,0,0,0|1,0,0]=3 919 B9R1.8 CCNC1=CC=CC=C1 MC40913 [1,1,0,0,0,0|0,0,0]=2 920 B9R1.8 CCOC1=NC=CC=C1 CS18732 [1,1,0,0,0,0|1,0,0]=3 921 B9R1.8 CCOC1=NC=CN=C1 CS21524 [1,1,0,0,0,0|2,0,0]=4 922 B9R1.8 CNCC1=CC=CC=C1 MC10559 [1,1,0,0,0,0|0,0,0]=2 923 B9R1.8 CNCC1=CC=CC=C1 MC20323 [1,1,0,0,0,0|0,0,0]=2 924 B9R1.8 CNCC1=CC=CC=C1 MC21006 [1,1,0,0,0,0|0,0,0]=2 925 B9R1.8 CNCC1=CC=CN=C1 CS18846 [1,1,0,0,0,0|1,0,0]=3 926 B9R1.8 CNCC1=CN=CN=C1 MC103834 [1,1,0,0,0,0|2,0,0]=4 927 B9R1.8 COCC1=NC=CC=C1 CS20909 [1,1,0,0,0,0|1,0,0]=3 928 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [1,1,0,0,0,0|0,0,0]=2 929 B9R1.8 ClCCC1=CC=NC=C1 CS17913 [1,1,0,0,0,0|1,0,0]=3 930 B9R1.8 FCCC1=CC=CC=C1 MC41557 [1,1,0,0,0,0|0,0,0]=2 931 B9R1.8 N#CCC1=CC=CN=C1 CS18407 [1,1,0,0,0,0|1,0,1]=4 932 B9R1.8 N#CCC1=CC=NC=C1 CS20239 [1,1,0,0,0,0|1,0,1]=4 933 B9R1.8 N#CCC1=NC=CC=C1 CS18926 [1,1,0,0,0,0|1,0,1]=4 934 B9R1.8 NCCC1=CC=CC=C1 MC40983 [1,1,0,0,0,0|0,0,0]=2 935 B9R1.8 NCCC1=CC=CN=C1 CS21892 [1,1,0,0,0,0|1,0,0]=3 936 B9R1.8 NCCC1=NC=CC=C1 CS14064 [1,1,0,0,0,0|1,0,0]=3 937 B9R1.8 NCCC1=NC=NC=C1 MC104796 [1,1,0,0,0,0|2,0,0]=4 938 B9R1.8 NNCC1=CC=CC=C1 CS11006 [1,1,0,0,0,0|1,0,0]=3 939 B9R1.8 NNCC1=CC=CC=C1 CS12127 [1,1,0,0,0,0|1,0,0]=3 940 B9R1.8 NNCC1=CC=CN=C1 MC111189 [1,1,0,0,0,0|2,0,0]=4 941 B9R1.8 NNCC1=CC=CN=C1 MC111240 [1,1,0,0,0,0|2,0,0]=4 942 B9R1.8 NNCC1=CC=NC=C1 MC111241 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.8 NNCC1=NC=CC=C1 MC111239 [1,1,0,0,0,0|2,0,0]=4 944 B9R1.8 NOCC1=CC=CC=C1 CS14063 [1,1,0,0,0,0|0,0,0]=2 945 B9R1.8 O=C=NC1=CC=CC=C1 MC41051 [1,1,0,0,0,0|0,0,2]=4 946 B9R1.8 O=CCC1=CC=CN=C1 MC106360 [1,1,0,0,0,0|1,0,1]=4 947 B9R1.8 O=CCC1=CC=NC=C1 MC106357 [1,1,0,0,0,0|1,0,1]=4 948 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [1,1,0,0,0,0|0,0,2]=4 949 B9R1.8 O=COC1=CC=CC=C1 MC40136 [1,1,0,0,0,0|0,0,2]=4 950 B9R1.8 OCCC1=CC=CC=C1 MC40745 [1,1,0,0,0,0|0,0,0]=2 951 B9R1.8 OCCC1=CN=CN=C1 CS12401 [1,1,0,0,0,0|2,0,0]=4 952 B9R1.8 ONCC1=CC=CC=C1 CS11753 [1,1,0,0,0,0|0,0,0]=2 953 B9R1.15 BrCC1=C(Br)C=CC=C1 MC20808 [1,1,0,0,0,0|1,0,0]=3 954 B9R1.15 BrCC1=C(I)C=CC=C1 MC40561 [1,1,0,0,0,0|1,0,0]=3 955 B9R1.15 C#CC1=C(Cl)C=CC=C1 CS20629 [1,1,0,0,0,0|0,0,2]=4 956 B9R1.15 C#CC1=C(N)C=CC=C1 CS21537 [1,1,0,0,0,0|0,0,2]=4 957 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [1,1,0,0,0,0|0,0,2]=4 958 B9R1.15 C=CC1=C(Br)C=CC=C1 CS18853 [1,1,0,0,0,0|0,0,2]=4 959 B9R1.15 C=CC1=C(Cl)C=CC=C1 CS19873 [1,1,0,0,0,0|0,0,2]=4 960 B9R1.15 CC1=C(CBr)C=CC=C1 CS14791 [1,1,0,0,0,0|1,0,0]=3 961 B9R1.15 CC1=C(CBr)C=NC=C1 CS17496 [1,1,0,0,0,0|2,0,0]=4 962 B9R1.15 CC1=C(CCl)C=NC=C1 MC104833 [1,1,0,0,0,0|2,0,0]=4 963 B9R1.15 CC1=C(CN)C=CC=C1 MC33216 [1,1,0,0,0,0|1,0,0]=3 964 B9R1.15 CC1=C(CN)C=NC=C1 CS20204 [1,1,0,0,0,0|2,0,0]=4 965 B9R1.15 CC1=C(CO)C=NC=C1 MC443666 [1,1,0,0,0,0|1,0,0]=3 966 B9R1.15 CC1=C(NN)C=CC=C1 CS19575 [1,1,0,0,0,0|2,0,0]=4 967 B9R1.15 CC1=C(NN)C=CC=C1 MC20365 [1,1,0,0,0,0|2,0,0]=4 968 B9R1.15 CC1=CC=CC=C1C=O CS19114 [1,1,0,0,0,0|0,0,2]=4 969 B9R1.15 CC1=CC=CN=C1CCl CS15725 [1,1,0,0,0,0|2,0,0]=4 970 B9R1.15 CC1=CC=CN=C1CO CS19225 [1,1,0,0,0,0|1,0,0]=3 971 B9R1.15 CC1=NC=CC=C1CCl MC104832 [1,1,0,0,0,0|2,0,0]=4 972 B9R1.15 CC1=NC=CC=C1CN MC102930 [1,1,0,0,0,0|2,0,0]=4 973 B9R1.15 CC1=NC=CC=C1CO CS20145 [1,1,0,0,0,0|1,0,0]=3 974 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [1,1,0,0,0,0|0,0,0]=2 975 B9R1.15 CCC1=C(Br)C=CN=C1 MC427078 [1,1,0,0,0,0|1,0,0]=3 976 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [1,1,0,0,0,0|0,0,0]=2 977 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [1,1,0,0,0,0|0,0,0]=2 978 B9R1.15 CCC1=NC=CC=C1Br MC105746 [1,1,0,0,0,0|1,0,0]=3 979 B9R1.15 CCC1=NC=CN=C1Cl CS21430 [1,1,0,0,0,0|2,0,0]=4 980 B9R1.15 CCC1=NC=NC=C1F CS19573 [1,1,0,0,0,0|2,0,0]=4 981 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [1,1,0,0,0,0|1,0,0]=3 982 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [1,1,0,0,0,0|1,0,0]=3 983 B9R1.15 CNC1=C(N)C=NC=C1 MC10330 [1,1,0,0,0,0|2,0,0]=4 984 B9R1.15 CNC1=CC=CC=C1N CS22302 [1,1,0,0,0,0|1,0,0]=3 985 B9R1.15 CNC1=NC=CC=C1Br CS17281 [1,1,0,0,0,0|2,0,0]=4 986 B9R1.15 CNC1=NC=CC=C1Cl MC33482 [1,1,0,0,0,0|2,0,0]=4 987 B9R1.15 CNC1=NC=CC=C1N MC427393 [1,1,0,0,0,0|2,0,0]=4 988 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [1,1,0,0,0,0|1,0,0]=3 989 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [1,1,0,0,0,0|2,0,0]=4 990 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [1,1,0,0,0,0|2,0,0]=4 991 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [1,1,0,0,0,0|2,0,0]=4 992 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [1,1,0,0,0,0|2,0,0]=4 994 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [1,1,0,0,0,0|1,0,0]=3 995 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [1,1,0,0,0,0|2,0,0]=4 996 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [1,1,0,0,0,0|1,0,0]=3 997 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [1,1,0,0,0,0|2,0,0]=4 998 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [1,1,0,0,0,0|1,0,0]=3 1000 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [1,1,0,0,0,0|2,0,0]=4 1001 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [1,1,0,0,0,0|2,0,0]=4 1002 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [1,1,0,0,0,0|1,0,0]=3 1003 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [1,1,0,0,0,0|2,0,0]=4 1004 B9R1.15 COC1=CC=CN=C1Br CS19255 [1,1,0,0,0,0|2,0,0]=4 1005 B9R1.15 COC1=CC=CN=C1Cl CS19305 [1,1,0,0,0,0|2,0,0]=4 1006 B9R1.15 COC1=CC=CN=C1F CS13044 [1,1,0,0,0,0|2,0,0]=4 1007 B9R1.15 COC1=CC=CN=C1N CS17216 [1,1,0,0,0,0|2,0,0]=4 1008 B9R1.15 COC1=NC=CC=C1Br CS19258 [1,1,0,0,0,0|2,0,0]=4 1009 B9R1.15 COC1=NC=CC=C1C MC33438 [1,1,0,0,0,0|2,0,0]=4 1010 B9R1.15 COC1=NC=CC=C1Cl CS18705 [1,1,0,0,0,0|2,0,0]=4 1011 B9R1.15 COC1=NC=CC=C1F CS19564 [1,1,0,0,0,0|2,0,0]=4 1012 B9R1.15 COC1=NC=CC=C1I CS13512 [1,1,0,0,0,0|2,0,0]=4 1013 B9R1.15 COC1=NC=CC=C1N CS19526 [1,1,0,0,0,0|2,0,0]=4 1014 B9R1.15 CSC1=C(Br)C=CN=C1 MC430535 [1,1,0,0,0,0|2,0,0]=4 1015 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [1,1,0,0,0,0|1,0,0]=3 1016 B9R1.15 ClC1=C(CBr)C=CC=C1 CS19190 [1,1,0,0,0,0|1,0,0]=3 1017 B9R1.15 ClC1=CC=CN=C1CBr MC116292 [1,1,0,0,0,0|2,0,0]=4 1018 B9R1.15 ClCC1=C(Cl)C=CC=C1 CS19964 [1,1,0,0,0,0|1,0,0]=3 1019 B9R1.15 ClCC1=CC=CC=C1Br MC30029 [1,1,0,0,0,0|1,0,0]=3 1020 B9R1.15 FC1=C(CBr)C=CC=C1 CS21562 [1,1,0,0,0,0|1,0,0]=3 1021 B9R1.15 FC1=C(CCl)C=CC=C1 MC40597 [1,1,0,0,0,0|1,0,0]=3 1022 B9R1.15 FC1=CC=CN=C1CBr MC430869 [1,1,0,0,0,0|2,0,0]=4 1023 B9R1.15 FC1=CC=CN=C1CCl MC425766 [1,1,0,0,0,0|2,0,0]=4 1024 B9R1.15 FC1=NC=CC=C1CBr MC430634 [1,1,0,0,0,0|2,0,0]=4 1025 B9R1.15 FC1=NC=CC=C1CCl MC429652 [1,1,0,0,0,0|2,0,0]=4 1026 B9R1.15 N#CC1=C(Br)C=CC=C1 MC20182 [1,1,0,0,0,0|1,0,1]=4 1027 B9R1.15 N#CC1=C(F)C=CC=C1 CS18285 [1,1,0,0,0,0|1,0,1]=4 1028 B9R1.15 N#CC1=C(I)C=CC=C1 CS21883 [1,1,0,0,0,0|1,0,1]=4 1029 B9R1.15 N#CC1=C(N)C=CC=C1 CS13393 [1,1,0,0,0,0|1,0,1]=4 1030 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [1,1,0,0,0,0|1,0,1]=4 1031 B9R1.15 NC1=C(C=O)C=CC=C1 MC20756 [1,1,0,0,0,0|0,0,2]=4 1032 B9R1.15 NC1=C(CO)C=CC=C1 CS19122 [1,1,0,0,0,0|0,0,0]=2 1033 B9R1.15 NC1=NC=CC=C1CO CS13983 [1,1,0,0,0,0|1,0,0]=3 1034 B9R1.15 NCC1=C(Br)C=CC=C1 CS19534 [1,1,0,0,0,0|1,0,0]=3 1035 B9R1.15 NCC1=C(Br)C=NC=C1 CS17629 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.15 NCC1=C(F)C=CC=C1 MC40826 [1,1,0,0,0,0|1,0,0]=3 1037 B9R1.15 NCC1=C(F)C=NC=C1 MC116263 [1,1,0,0,0,0|2,0,0]=4 1038 B9R1.15 NCC1=C(F)C=NC=C1 MC431082 [1,1,0,0,0,0|2,0,0]=4 1039 B9R1.15 NCC1=C(N)C=CC=C1 MC40796 [1,1,0,0,0,0|1,0,0]=3 1040 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [1,1,0,0,0,0|1,0,0]=3 1041 B9R1.15 NCC1=NC=CC=C1Cl MC114379 [1,1,0,0,0,0|2,0,0]=4 1042 B9R1.15 NCC1=NC=CC=C1F MC104008 [1,1,0,0,0,0|2,0,0]=4 1043 B9R1.15 NCC1=NC=CC=C1O MC443567 [1,1,0,0,0,0|2,0,0]=4 1044 B9R1.15 NNC1=C(Br)C=CC=C1 CS19466 [1,1,0,0,0,0|2,0,0]=4 1045 B9R1.15 NNC1=C(Cl)C=CC=C1 CS19478 [1,1,0,0,0,0|2,0,0]=4 1046 B9R1.15 NNC1=C(F)C=CC=C1 CS23033 [1,1,0,0,0,0|2,0,0]=4 1047 B9R1.15 NNC1=C(F)C=CC=C1 MC33086 [1,1,0,0,0,0|2,0,0]=4 1048 B9R1.15 O=CC1=C(Br)C=CC=C1 CS19251 [1,1,0,0,0,0|0,0,2]=4 1049 B9R1.15 O=CC1=C(F)C=CC=C1 CS21560 [1,1,0,0,0,0|0,0,2]=4 1050 B9R1.15 O=CC1=C(I)C=CC=C1 CS20131 [1,1,0,0,0,0|0,0,2]=4 1051 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [1,1,0,0,0,0|0,0,2]=4 1052 B9R1.15 OCC1=C(Br)C=CC=C1 CS18828 [1,1,0,0,0,0|0,0,0]=2 1053 B9R1.15 OCC1=C(Br)C=NC=C1 CS12881 [1,1,0,0,0,0|1,0,0]=3 1054 B9R1.15 OCC1=C(Cl)C=CC=C1 CS21494 [1,1,0,0,0,0|0,0,0]=2 1055 B9R1.15 OCC1=C(Cl)C=CN=C1 CS17105 [1,1,0,0,0,0|1,0,0]=3 1056 B9R1.15 OCC1=C(F)C=CC=C1 MC33139 [1,1,0,0,0,0|0,0,0]=2 1057 B9R1.15 OCC1=C(I)C=CC=C1 CS19102 [1,1,0,0,0,0|0,0,0]=2 1058 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [1,1,0,0,0,0|0,0,0]=2 1059 B9R1.15 OCC1=CC=CN=C1Cl CS14328 [1,1,0,0,0,0|1,0,0]=3 1060 B9R1.15 OCC1=CC=CN=C1F CS18697 [1,1,0,0,0,0|1,0,0]=3 1061 B9R1.15 OCC1=CN=CN=C1Cl MC444026 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.15 OCC1=NC=CC=C1Br MC431297 [1,1,0,0,0,0|1,0,0]=3 1063 B9R1.15 OCC1=NC=CC=C1Br MC431298 [1,1,0,0,0,0|1,0,0]=3 1064 B9R1.15 OCC1=NC=CC=C1Cl CS17318 [1,1,0,0,0,0|1,0,0]=3 1065 B9R1.15 OCC1=NC=CC=C1F MC430870 [1,1,0,0,0,0|1,0,0]=3 1066 B9R1.15 OCC1=NC=CC=C1O MC20200 [1,1,0,0,0,0|1,0,0]=3 1067 B9R1.15 OCC1=NC=CN=C1Cl MC444258 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.35 CC(N)C1=CSC(Cl)=C1 MC104598 [0,1,0,0,1,0|2,0,0]=4 1069 B9R1.35 CC(O)C1=CN(C)C=N1 MC103373 [0,1,0,0,1,0|2,0,0]=4 1070 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 MC10315 [0,1,0,0,0,1|0,0,2]=4 1071 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 CS22844 [0,1,0,0,0,1|0,0,2]=4 1072 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 MC428013 [0,1,0,0,0,1|0,0,2]=4 1073 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 MC33116 [0,1,0,0,0,1|0,0,2]=4 1074 B11R1.20 CC(=O)OC1=CC=C(Br)C=C1 MC40002 [0,1,0,0,0,1|0,0,2]=4 1075 B11R1.20 CC(=O)OC1=CC=C(F)C=C1 MC20138 [0,1,0,0,0,1|0,0,2]=4 1076 B11R1.20 CC(=O)OC1=CC=C(I)C=C1 MC103137 [0,1,0,0,0,1|0,0,2]=4 1077 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 MC433485 [0,1,0,0,0,1|1,0,0]=3 1078 B11R1.20 CC(C)NC1=CC=C(Br)C=C1 MC443740 [0,1,0,0,0,1|1,0,0]=3 1079 B11R1.20 CC(C)NC1=CC=C(F)C=C1 CS22842 [0,1,0,0,0,1|1,0,0]=3 1080 B11R1.20 CC(C)OC1=CC=C(N)C=C1 CS10912 [0,1,0,0,0,1|1,0,0]=3 1081 B11R1.20 CC(C)OC1=CC=C(O)C=C1 MC443483 [0,1,0,0,0,1|1,0,0]=3 1082 B11R1.20 CC(C)OC1=CN=C(Br)C=C1 MC443766 [0,1,0,0,0,1|2,0,0]=4 1083 B11R1.20 CC(C)SC1=CC=C(O)C=C1 MC112512 [0,1,0,0,0,1|1,0,0]=3 1084 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 CS21084 [0,1,0,0,0,1|1,0,1]=4 1085 B11R1.20 CC1=CC=C(OC(F)F)C=C1 MC41389 [0,1,0,0,0,1|2,0,0]=4 1086 B11R1.20 FC(F)OC1=CC=C(Cl)C=C1 MC41382 [0,1,0,0,0,1|2,0,0]=4 1087 B11R1.20 FC(F)OC1=CC=C(I)C=C1 MC41388 [0,1,0,0,0,1|2,0,0]=4 1088 B11R1.20 FC(F)Oc1ccc(Br)cc1 CS19168 [0,1,0,0,0,1|2,0,0]=4 1089 B11R1.20 FC1=CC=C(OC(F)F)C=C1 MC431385 [0,1,0,0,0,1|2,0,0]=4 1090 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 CS21002 [0,1,0,0,0,1|1,0,1]=4 1091 B11R1.20 NC1=CC=C(OC(F)F)C=C1 CS13962 [0,1,0,0,0,1|2,0,0]=4 1092 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 CS20812 [0,1,0,0,0,1|1,0,1]=4 1093 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 MC40158 [0,1,0,0,0,1|1,0,1]=4 1094 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 CS10817 [0,1,0,0,0,1|1,0,1]=4 1095 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 CS20852 [0,1,0,0,0,1|1,0,1]=4 1096 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 MC40180 [0,1,0,0,0,1|1,0,1]=4 1097 B11R1.20 O=C(O)CC1=CC=C(S)C=C1 MC40184 [0,1,0,0,0,1|1,0,1]=4 1098 B11R1.20 OC1=CC=C(OC(F)F)C=C1 MC41182 [0,1,0,0,0,1|2,0,0]=4 1099 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 CS19083 [0,1,0,0,0,1|1,0,1]=4 1100 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 MC443670 [0,1,0,0,0,1|1,0,0]=3 1101 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 CS10890 [0,1,0,0,0,1|1,0,1]=4 1102 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 CS14544 [0,1,0,0,0,1|1,0,1]=4 1103 B11R1.36 CC(C)C(=O)C1=CC=CN=C1 MC429968 [0,1,0,0,0,1|2,0,0]=4 1104 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 CS11192 [0,1,0,0,0,1|1,0,1]=4 1105 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 CS14083 [0,1,0,0,0,1|1,0,1]=4 1106 B11R1.36 NC(C(=O)O)c1ccccc1 MC438102 [0,1,0,0,0,1|1,0,1]=4 1107 B11R1.36 NC(C(=O)O)c1ccccc1 MC438103 [0,1,0,0,0,1|1,0,1]=4 1108 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 CS10861 [0,1,0,0,0,1|1,0,1]=4 1109 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 CS10862 [0,1,0,0,0,1|1,0,1]=4 1110 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 CS15279 [0,1,0,0,0,1|1,0,1]=4 1111 B11R1.40 C#CC(O)CC1=CC=CC=C1 MC425691 [0,1,0,0,0,1|0,0,1]=3 1112 B11R1.40 CC(C#N)NC1=CC=CC=C1 MC428132 [0,1,0,0,0,1|1,0,0]=3 1113 B11R1.40 CCC(=O)CC1=CC=CC=C1 MC41289 [0,1,0,0,0,1|0,0,2]=4 1114 B11R1.40 NC(CO)CC1=CC=CC=C1 CS21216 [0,1,0,0,0,1|1,0,0]=3 1115 B11R1.40 NC(CO)CC1=CC=CC=C1 MC425862 [0,1,0,0,0,1|1,0,0]=3 1116 B11R1.40 O=C(CO)CC1=CC=CC=C1 MC107738 [0,1,0,0,0,1|0,0,2]=4 1117 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 MC10294 [0,1,0,0,0,1|0,0,2]=4 1118 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 MC10318 [0,1,0,0,0,1|0,0,2]=4 1119 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 MC427446 [0,1,0,0,0,1|0,0,2]=4 1120 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 CS21203 [0,1,0,0,0,1|0,0,2]=4 1121 B11R1.86 CC(=O)OC1=C(C)C=CC=C1 MC40007 [0,1,0,0,0,1|0,0,2]=4 1122 B11R1.86 CC(=S)NC1=C(Br)C=CC=C1 MC427451 [0,1,0,0,0,1|0,1,1]=4 1123 B11R1.86 CC(C)OC1=C(N)C=CC=C1 CS13469 [0,1,0,0,0,1|1,0,0]=3 1124 B11R1.86 CC(C)OC1=NC=CC=C1Cl MC103348 [0,1,0,0,0,1|2,0,0]=4 1125 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 CS21083 [0,1,0,0,0,1|1,0,1]=4 1126 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 MC41371 [0,1,0,0,0,1|2,0,0]=4 1127 B11R1.86 FC(F)OC1=C(I)C=CC=C1 MC41387 [0,1,0,0,0,1|2,0,0]=4 1128 B11R1.86 NC1=C(CC(=O)O)C=CC=C1 CS20995 [0,1,0,0,0,1|1,0,1]=4 1129 B11R1.86 NC1=C(OC(F)F)C=CC=C1 MC40902 [0,1,0,0,0,1|2,0,0]=4 1130 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 CS20809 [0,1,0,0,0,1|1,0,1]=4 1131 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 CS20826 [0,1,0,0,0,1|1,0,1]=4 1132 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 MC429403 [0,1,0,0,0,1|1,0,1]=4 1133 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 CS20849 [0,1,0,0,0,1|1,0,1]=4 1134 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 CS20941 [0,1,0,0,0,1|1,0,1]=4 1135 B11R1.86 OC1=C(OC(F)F)C=CC=C1 MC431136 [0,1,0,0,0,1|2,0,0]=4 1136 B11R1.157 CC(=O)CC1=CC(Br)=CC=C1 CS22187 [0,1,0,0,0,1|0,0,2]=4 1137 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 MC33114 [0,1,0,0,0,1|0,0,2]=4 1138 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 CS22093 [0,1,0,0,0,1|0,0,2]=4 1139 B11R1.157 CC(=O)OC1=CC(Br)=CC=C1 MC40001 [0,1,0,0,0,1|0,0,2]=4 1140 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 MC40008 [0,1,0,0,0,1|0,0,2]=4 1141 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 MC40004 [0,1,0,0,0,1|0,0,2]=4 1142 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 MC443308 [0,1,0,0,0,1|1,0,0]=3 1143 B11R1.157 CC(C)OC1=CC(Br)=NC=C1 MC430482 [0,1,0,0,0,1|2,0,0]=4 1144 B11R1.157 CC(C)OC1=CC=CC(Br)=N1 MC431254 [0,1,0,0,0,1|2,0,0]=4 1145 B11R1.157 CC(C)OC1=CC=CC(O)=C1 MC112598 [0,1,0,0,0,1|1,0,0]=3 1146 B11R1.157 CN(C)CC1=CC=CC(O)=C1 MC425485 [0,1,0,0,0,1|2,0,0]=4 1147 B11R1.157 Cc1cccc(CC(=O)O)c1 MC433961 [0,1,0,0,0,1|1,0,1]=4 1148 B11R1.157 FC(F)OC1=CC(Br)=CC=C1 MC41372 [0,1,0,0,0,1|2,0,0]=4 1149 B11R1.157 NC1=CC(OC(F)F)=CC=C1 CS13961 [0,1,0,0,0,1|2,0,0]=4 1150 B11R1.157 NC1=CC(SC(F)F)=CC=C1 MC430927 [0,1,0,0,0,1|2,0,0]=4 1151 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 CS21911 [0,1,0,0,0,1|1,0,1]=4 1152 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 CS10775 [0,1,0,0,0,1|1,0,1]=4 1153 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 CS21923 [0,1,0,0,0,1|1,0,1]=4 1154 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 MC40173 [0,1,0,0,0,1|1,0,1]=4 1155 B11R1.157 O=C(O)CC1=CC(I)=CC=C1 CS20851 [0,1,0,0,0,1|1,0,1]=4 1156 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 CS20944 [0,1,0,0,0,1|1,0,1]=4 1157 B11R1.157 OC1=CC(OC(F)F)=CC=C1 MC431656 [0,1,0,0,0,1|2,0,0]=4 1158 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 CS11014 [0,1,0,0,0,1|2,0,0]=4 1159 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 MC20424 [0,1,0,0,0,1|2,0,0]=4 1160 B11R1.509 FC(F)(F)OC1=CC=CC=C1 MC41392 [0,1,0,0,0,1|2,0,0]=4 1161 B11R1.509 FC(F)(F)SC1=CC=CC=C1 MC41394 [0,1,0,0,0,1|2,0,0]=4 1162 B11R1.3 C#CC1=CC=C(B(O)O)C=C1 MC442854 [0,2,0,0,0,0|2,0,0]=4 1163 B11R1.3 C#Cc1ccc(C(=O)O)cc1 CS17809 [0,2,0,0,0,0|1,0,1]=4 1164 B11R1.3 C(C)(N)C1=CC=C(OC)C=C1 MC20521 [0,2,0,0,0,0|1,0,0]=3 1165 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 MC20903 [0,2,0,0,0,0|1,0,1]=4 1166 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 MC425378 [0,2,0,0,0,0|1,0,1]=4 1167 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 CS18730 [0,2,0,0,0,0|0,0,2]=4 1168 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 CS12193 [0,2,0,0,0,0|0,0,2]=4 1169 B11R1.3 CC(C)C1=CC=C(CBr)C=C1 CS14001 [0,2,0,0,0,0|1,0,0]=3 1170 B11R1.3 CC(N)C1=CC=C(C#N)C=C1 CS17346 [0,2,0,0,0,0|1,0,0]=3 1171 B11R1.3 CC(O)C1=CC=C(C#N)C=C1 CS10987 [0,2,0,0,0,0|0,0,0]=2 1172 B11R1.3 CCC1=CC=C(B(O)O)C=C1 CS10550 [0,2,0,0,0,0|2,0,0]=4 1173 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CS13406 [0,2,0,0,0,0|1,0,1]=4 1174 B11R1.3 CN(C)C1=CC=C(C#N)C=C1 MC40651 [0,2,0,0,0,0|2,0,0]=4 1175 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 CS13401 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 MC20232 [0,2,0,0,0,0|1,0,1]=4 1177 B11R1.3 COC1=CC=C(B(O)O)C=C1 CS10530 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.3 COC1=CC=C(C(C)=O)C=C1 MC41262 [0,2,0,0,0,0|0,0,2]=4 1179 B11R1.3 COC1=CC=C(C(C)C)C=C1 MC41346 [0,2,0,0,0,0|1,0,0]=3 1180 B11R1.3 COC1=CC=C(C(C)N)C=C1 CS13954 [0,2,0,0,0,0|1,0,0]=3 1181 B11R1.3 COC1=CC=C(N(C)C)C=C1 MC20811 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.3 FC(F)C1=CC=C(CBr)C=C1 MC432592 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 CS20162 [0,2,0,0,0,0|2,0,0]=4 1184 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 CS21997 [0,2,0,0,0,0|1,0,1]=4 1185 B11R1.3 N#CC1=CC=C(C(F)F)C=C1 MC433129 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 MC20325 [0,2,0,0,0,0|1,0,1]=4 1187 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 CS10519 [0,2,0,0,0,0|1,0,1]=4 1188 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 MC10316 [0,2,0,0,0,0|1,0,1]=4 1189 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 CS20829 [0,2,0,0,0,0|1,0,1]=4 1190 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 CS20945 [0,2,0,0,0,0|1,0,1]=4 1191 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 CS20264 [0,2,0,0,0,0|2,0,0]=4 1192 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 CS20792 [0,2,0,0,0,0|1,0,1]=4 1193 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 CS20345 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.3 OCC1=CC=C(B(O)O)C=C1 CS20400 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.3 OCC1=CC=C(C(F)F)C=C1 MC102249 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 CS19038 [0,2,0,0,0,0|1,0,0]=3 1197 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 CS20810 [0,2,0,0,0,0|1,0,0]=3 1198 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 MC40938 [0,2,0,0,0,0|1,0,0]=3 1199 B11R1.19 CC(C)(C)C1=CC=C(O)C=C1 CS16411 [0,2,0,0,0,0|1,0,0]=3 1200 B11R1.19 CC(C)(N)C1=NC=C(Br)C=C1 MC102695 [0,2,0,0,0,0|2,0,0]=4 1201 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 CS14403 [0,2,0,0,0,0|0,0,0]=2 1202 B11R1.19 CC(C)(O)C1=CC=C(Br)N=C1 MC106089 [0,2,0,0,0,0|1,0,0]=3 1203 B11R1.19 CC(C)(O)C1=CC=C(N)N=C1 MC21168 [0,2,0,0,0,0|1,0,0]=3 1204 B11R1.19 CC(C)(O)C1=NC=C(Br)C=C1 CS16019 [0,2,0,0,0,0|1,0,0]=3 1205 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 MC30310 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 CS12653 [0,2,0,0,0,0|2,0,0]=4 1207 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC102832 [0,2,0,0,0,0|2,0,0]=4 1208 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC107660 [0,2,0,0,0,0|2,0,0]=4 1209 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC111069 [0,2,0,0,0,0|2,0,0]=4 1210 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC111070 [0,2,0,0,0,0|2,0,0]=4 1211 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC114003 [0,2,0,0,0,0|2,0,0]=4 1212 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC115790 [0,2,0,0,0,0|2,0,0]=4 1213 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC20639 [0,2,0,0,0,0|2,0,0]=4 1214 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC20805 [0,2,0,0,0,0|2,0,0]=4 1215 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC33259 [0,2,0,0,0,0|2,0,0]=4 1216 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC425317 [0,2,0,0,0,0|2,0,0]=4 1217 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 MC425323 [0,2,0,0,0,0|2,0,0]=4 1218 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 CS10464 [0,2,0,0,0,0|1,0,1]=4 1219 B11R1.19 CS(=O)(=O)C1=CC=C(Cl)C=C1 CS16414 [0,2,0,0,0,0|1,0,1]=4 1220 B11R1.19 CS(=O)(=O)C1=CC=C(F)C=C1 CS20302 [0,2,0,0,0,0|1,0,1]=4 1221 B11R1.19 CS(=O)(=O)C1=CC=C(N)C=C1 CS20413 [0,2,0,0,0,0|1,0,1]=4 1222 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 CS20393 [0,2,0,0,0,0|1,0,1]=4 1223 B11R1.19 C[Si](C)(C)c1ccc(F)cc1 MC433556 [0,2,0,0,0,0|1,1,0]=4 1224 B11R1.19 Cc1ccc(S(=O)(=O)O)cc1 MC436139 [0,2,0,0,0,0|2,0,0]=4 1225 B11R1.19 FC(F)(Br)c1ccc(Cl)cc1 MC430822 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 CS14293 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.19 FC(F)(F)C1=CC=C(Cl)C=C1 MC41436 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.19 FC(F)(F)C1=CC=C(I)C=C1 CS10287 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.19 FC(F)(F)C1=CC=C(S)C=C1 MC41416 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 CS19920 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 CS10421 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 CS18679 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.19 O=S(=O)(O)C1=CC=C(Cl)C=C1 CS19082 [0,2,0,0,0,0|2,0,0]=4 1234 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 CS20124 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 MC30347 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 MC41231 [0,2,0,0,0,0|0,0,2]=4 1237 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 MC41229 [0,2,0,0,0,0|0,0,2]=4 1238 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 CS20410 [0,2,0,0,0,0|0,0,2]=4 1239 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 MC41240 [0,2,0,0,0,0|0,0,2]=4 1240 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 CS21693 [0,2,0,0,0,0|0,0,2]=4 1241 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 CS15561 [0,2,0,0,0,0|0,0,2]=4 1242 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 CS10715 [0,2,0,0,0,0|0,0,2]=4 1243 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 CS18939 [0,2,0,0,0,0|0,0,2]=4 1244 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 CS22282 [0,2,0,0,0,0|0,0,2]=4 1245 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 CS16308 [0,2,0,0,0,0|0,0,2]=4 1246 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 CS10813 [0,2,0,0,0,0|0,0,2]=4 1247 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 CS10863 [0,2,0,0,0,0|0,0,2]=4 1248 B11R1.21 CC(=O)c1ccc(Br)c(Br)c1 MC433228 [0,2,0,0,0,0|0,0,2]=4 1249 B11R1.21 CC(=O)c1ccc(Cl)c(F)c1 MC433221 [0,2,0,0,0,0|0,0,2]=4 1250 B11R1.21 CC(=O)c1ccc(Cl)c(N)c1 MC433203 [0,2,0,0,0,0|0,0,2]=4 1251 B11R1.21 CC(=O)c1ccc(F)c(F)c1 CS19019 [0,2,0,0,0,0|0,0,2]=4 1252 B11R1.21 CC(=O)c1ccc(F)c(N)c1 MC433205 [0,2,0,0,0,0|0,0,2]=4 1253 B11R1.21 CC(C)C1=CC(I)=C(N)C=C1 MC112792 [0,2,0,0,0,0|1,0,0]=3 1254 B11R1.21 CC(C)C1=CC(O)=C(I)C=C1 MC443561 [0,2,0,0,0,0|1,0,0]=3 1255 B11R1.21 CC(C)C1=CC=C(N)C(N)=C1 MC107237 [0,2,0,0,0,0|1,0,0]=3 1256 B11R1.21 CC(N)C1=CC(F)=C(Cl)C=C1 CS14514 [0,2,0,0,0,0|1,0,0]=3 1257 B11R1.21 CC(N)C1=CC(F)=C(Cl)C=C1 MC106197 [0,2,0,0,0,0|1,0,0]=3 1258 B11R1.21 CC(O)C1=CC(F)=C(F)C=C1 MC40732 [0,2,0,0,0,0|0,0,0]=2 1259 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 CS20811 [0,2,0,0,0,0|1,0,1]=4 1260 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 MC433136 [0,2,0,0,0,0|1,0,1]=4 1261 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 CS20467 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 CS21076 [0,2,0,0,0,0|1,0,1]=4 1263 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 MC20279 [0,2,0,0,0,0|2,0,0]=4 1264 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 CS20828 [0,2,0,0,0,0|1,0,1]=4 1265 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 CS19324 [0,2,0,0,0,0|1,0,1]=4 1266 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 CS20351 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 CS21927 [0,2,0,0,0,0|1,0,1]=4 1268 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 CS20353 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 CS14298 [0,2,0,0,0,0|1,0,1]=4 1270 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 CS21937 [0,2,0,0,0,0|1,0,1]=4 1271 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 CS21906 [0,2,0,0,0,0|1,0,1]=4 1272 B11R1.21 CC1=C(N)C=C(C(C)C)C=C1 MC433331 [0,2,0,0,0,0|1,0,0]=3 1273 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 CS21001 [0,2,0,0,0,0|1,0,1]=4 1274 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 MC442887 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 CS20943 [0,2,0,0,0,0|1,0,1]=4 1276 B11R1.21 CC1=C(O)C=C(C(C)C)C=C1 MC20541 [0,2,0,0,0,0|1,0,0]=3 1277 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 MC441420 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 CS20947 [0,2,0,0,0,0|1,0,1]=4 1279 B11R1.21 CN(C)C1=CC(F)=C(I)C=C1 MC442229 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.21 FC(F)C1=CC(Br)=C(Cl)C=C1 MC432572 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 MC40225 [0,2,0,0,0,0|1,0,1]=4 1282 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 MC33100 [0,2,0,0,0,0|1,0,1]=4 1283 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 CS20206 [0,2,0,0,0,0|1,0,1]=4 1284 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 CS20228 [0,2,0,0,0,0|1,0,1]=4 1285 B11R1.21 NC1=C(F)C=CC(B(O)O)=C1 MC442908 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 CS10439 [0,2,0,0,0,0|1,0,1]=4 1287 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 MC10142 [0,2,0,0,0,0|1,0,1]=4 1288 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 MC31156 [0,2,0,0,0,0|1,0,1]=4 1289 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 CS20381 [0,2,0,0,0,0|1,0,1]=4 1290 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 CS20332 [0,2,0,0,0,0|1,0,1]=4 1291 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 CS10491 [0,2,0,0,0,0|1,0,1]=4 1292 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl MC20248 [0,2,0,0,0,0|1,0,1]=4 1293 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 MC433643 [0,2,0,0,0,0|1,0,1]=4 1294 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 CS19835 [0,2,0,0,0,0|1,0,1]=4 1295 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 CS21914 [0,2,0,0,0,0|1,0,1]=4 1296 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 CS16354 [0,2,0,0,0,0|1,0,1]=4 1297 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 MC40236 [0,2,0,0,0,0|1,0,1]=4 1298 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 CS14672 [0,2,0,0,0,0|1,0,1]=4 1299 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 CS19962 [0,2,0,0,0,0|1,0,1]=4 1300 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 CS20110 [0,2,0,0,0,0|1,0,1]=4 1301 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 CS21990 [0,2,0,0,0,0|1,0,1]=4 1302 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 CS19967 [0,2,0,0,0,0|1,0,1]=4 1303 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 CS20015 [0,2,0,0,0,0|1,0,1]=4 1304 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 CS22285 [0,2,0,0,0,0|1,0,1]=4 1305 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 MC40282 [0,2,0,0,0,0|1,0,1]=4 1306 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 MC441218 [0,2,0,0,0,0|1,0,1]=4 1307 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 MC434062 [0,2,0,0,0,0|1,0,1]=4 1308 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 CS12746 [0,2,0,0,0,0|1,0,1]=4 1309 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 MC441219 [0,2,0,0,0,0|1,0,1]=4 1310 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 CS22662 [0,2,0,0,0,0|1,0,1]=4 1311 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CS20111 [0,2,0,0,0,0|1,0,1]=4 1312 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 MC40283 [0,2,0,0,0,0|1,0,1]=4 1313 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 CS18380 [0,2,0,0,0,0|1,0,1]=4 1314 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 CS20259 [0,2,0,0,0,0|1,0,1]=4 1315 B11R1.21 OB(O)C1=CC(Br)=C(Cl)C=C1 MC41811 [0,2,0,0,0,0|2,0,0]=4 1316 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 CS18935 [0,2,0,0,0,0|2,0,0]=4 1317 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 CS18946 [0,2,0,0,0,0|2,0,0]=4 1318 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 CS13191 [0,2,0,0,0,0|2,0,0]=4 1319 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 CS18957 [0,2,0,0,0,0|2,0,0]=4 1320 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 MC441708 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 CS16283 [0,2,0,0,0,0|2,0,0]=4 1322 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 MC441422 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.22 CC(C#N)C1=CC=C(Br)C=C1 MC427374 [0,2,0,0,0,0|1,0,0]=3 1324 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC103018 [0,2,0,0,0,0|1,0,0]=3 1325 B11R1.22 CC(CN)C1=CC=C(Br)C=C1 MC427281 [0,2,0,0,0,0|1,0,0]=3 1326 B11R1.22 CC(CN)C1=CC=C(O)C=C1 MC116255 [0,2,0,0,0,0|1,0,0]=3 1327 B11R1.22 CC(NN)C1=CC=C(Cl)C=C1 MC110625 [0,2,0,0,0,0|1,0,0]=3 1328 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 CS22698 [0,2,0,0,0,0|0,0,2]=4 1329 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 CS22795 [0,2,0,0,0,0|0,0,2]=4 1330 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 CS22846 [0,2,0,0,0,0|0,0,2]=4 1331 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 CS15690 [0,2,0,0,0,0|0,0,2]=4 1332 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 CS18281 [0,2,0,0,0,0|1,0,0]=3 1333 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 CS15303 [0,2,0,0,0,0|0,0,2]=4 1334 B11R1.22 COC(=O)C1=CC=C(C)C=C1 MC40114 [0,2,0,0,0,0|0,0,2]=4 1335 B11R1.22 COC(=O)C1=CC=C(F)C=C1 CS20841 [0,2,0,0,0,0|0,0,2]=4 1336 B11R1.22 COC(=O)C1=CC=C(I)C=C1 CS20853 [0,2,0,0,0,0|0,0,2]=4 1337 B11R1.22 COC(=O)C1=CC=C(N)C=C1 CS20990 [0,2,0,0,0,0|0,0,2]=4 1338 B11R1.22 COC(=O)C1=CC=C(O)C=C1 CS19446 [0,2,0,0,0,0|0,0,2]=4 1339 B11R1.22 FC1=CC=C(C(Br)CBr)C=C1 MC430994 [0,2,0,0,0,0|1,0,0]=3 1340 B11R1.22 NC(CO)C1=NC=C(F)C=C1 MC114776 [0,2,0,0,0,0|2,0,0]=4 1341 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 CS10839 [0,2,0,0,0,0|0,0,2]=4 1342 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 CS20894 [0,2,0,0,0,0|0,0,2]=4 1343 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 MC431262 [0,2,0,0,0,0|0,0,0]=2 1344 B11R1.22 N\C(=N/O)C1=CC=C(Br)C=C1 MC428196 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 MC41822 [0,2,0,0,0,0|1,0,1]=4 1346 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 CS19445 [0,2,0,0,0,0|0,0,2]=4 1347 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 MC433210 [0,2,0,0,0,0|0,0,2]=4 1348 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 CS20678 [0,2,0,0,0,0|0,0,2]=4 1349 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 CS10771 [0,2,0,0,0,0|0,0,2]=4 1350 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 CS14324 [0,2,0,0,0,0|0,0,2]=4 1351 B11R1.22 O=C(CCl)C1=CC=C(F)C=C1 MC41236 [0,2,0,0,0,0|0,0,2]=4 1352 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 MC442284 [0,2,0,0,0,0|0,0,0]=2 1353 B11R1.166 CC(=O)C1=C(Br)C=C(F)C=C1 MC41228 [0,2,0,0,0,0|0,0,2]=4 1354 B11R1.166 CC(=O)C1=C(Br)C=C(N)C=C1 MC433202 [0,2,0,0,0,0|0,0,2]=4 1355 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 CS21355 [0,2,0,0,0,0|0,0,2]=4 1356 B11R1.166 CC(=O)C1=C(C)C=C(F)C=C1 MC41255 [0,2,0,0,0,0|0,0,2]=4 1357 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 CS14036 [0,2,0,0,0,0|0,0,2]=4 1358 B11R1.166 CC(=O)C1=C(Cl)C=C(Cl)C=C1 CS21093 [0,2,0,0,0,0|0,0,2]=4 1359 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 CS21444 [0,2,0,0,0,0|0,0,2]=4 1360 B11R1.166 CC(=O)C1=C(Cl)C=C(N)C=C1 MC425453 [0,2,0,0,0,0|0,0,2]=4 1361 B11R1.166 CC(=O)C1=C(Cl)C=C(O)C=C1 CS20824 [0,2,0,0,0,0|0,0,2]=4 1362 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 CS20682 [0,2,0,0,0,0|0,0,2]=4 1363 B11R1.166 CC(=O)C1=C(F)C=C(C)C=C1 MC430999 [0,2,0,0,0,0|0,0,2]=4 1364 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 CS22739 [0,2,0,0,0,0|0,0,2]=4 1365 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 CS19013 [0,2,0,0,0,0|0,0,2]=4 1366 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 CS16419 [0,2,0,0,0,0|0,0,2]=4 1367 B11R1.166 CC(=O)C1=C(N)C=C(F)C=C1 MC431781 [0,2,0,0,0,0|0,0,2]=4 1368 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 CS22645 [0,2,0,0,0,0|0,0,2]=4 1369 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 MC10406 [0,2,0,0,0,0|0,0,2]=4 1370 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 MC10405 [0,2,0,0,0,0|0,0,2]=4 1371 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 CS20409 [0,2,0,0,0,0|0,0,2]=4 1372 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 CS19678 [0,2,0,0,0,0|0,0,2]=4 1373 B11R1.166 CC(N)C1=C(F)C=C(Br)C=C1 MC106556 [0,2,0,0,0,0|1,0,0]=3 1374 B11R1.166 CC(O)C1=C(Cl)C=C(Cl)C=C1 MC40730 [0,2,0,0,0,0|0,0,0]=2 1375 B11R1.166 CC(O)C1=NC=C(Br)C=C1F MC431737 [0,2,0,0,0,0|1,0,0]=3 1376 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 CS10504 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.166 CC1=C(B(O)O)C=CC(O)=C1 MC21132 [0,2,0,0,0,0|2,0,0]=4 1378 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 CS15606 [0,2,0,0,0,0|1,0,1]=4 1379 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 CS22749 [0,2,0,0,0,0|1,0,1]=4 1380 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 CS21999 [0,2,0,0,0,0|1,0,1]=4 1381 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 CS18188 [0,2,0,0,0,0|1,0,1]=4 1382 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 CS12971 [0,2,0,0,0,0|1,0,1]=4 1383 B11R1.166 CC1=C(C(C)N)C=CC(F)=C1 MC112478 [0,2,0,0,0,0|1,0,0]=3 1384 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 CS21362 [0,2,0,0,0,0|1,0,1]=4 1385 B11R1.166 CC1=CC(Br)=C(C(C)N)C=C1 MC112224 [0,2,0,0,0,0|1,0,0]=3 1386 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 CS20463 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 CS21071 [0,2,0,0,0,0|1,0,1]=4 1388 B11R1.166 CC1=CC(C)=C(C(F)F)C=C1 MC433526 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.166 CC1=CC(Cl)=C(B(O)O)C=C1 CS13719 [0,2,0,0,0,0|2,0,0]=4 1390 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 CS21449 [0,2,0,0,0,0|1,0,1]=4 1391 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 CS20350 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 CS20842 [0,2,0,0,0,0|1,0,1]=4 1393 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 CS13976 [0,2,0,0,0,0|1,0,1]=4 1394 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 MC115738 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 CS20948 [0,2,0,0,0,0|1,0,1]=4 1396 B11R1.166 ClC1=CC(Cl)=C(C(Cl)Cl)C=C1 MC40610 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 CS20180 [0,2,0,0,0,0|1,0,1]=4 1398 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 CS20207 [0,2,0,0,0,0|1,0,1]=4 1399 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 CS21809 [0,2,0,0,0,0|1,0,1]=4 1400 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 CS21253 [0,2,0,0,0,0|1,0,1]=4 1401 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 CS12851 [0,2,0,0,0,0|1,0,1]=4 1402 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 CS10414 [0,2,0,0,0,0|1,0,1]=4 1403 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 CS20227 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 CS22593 [0,2,0,0,0,0|1,0,1]=4 1405 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 CS21072 [0,2,0,0,0,0|1,0,1]=4 1406 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 CS19824 [0,2,0,0,0,0|1,0,1]=4 1407 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 CS21353 [0,2,0,0,0,0|1,0,1]=4 1408 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 CS15275 [0,2,0,0,0,0|1,0,1]=4 1409 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 CS10220 [0,2,0,0,0,0|1,0,1]=4 1410 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 CS14611 [0,2,0,0,0,0|1,0,1]=4 1411 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 MC40252 [0,2,0,0,0,0|1,0,1]=4 1412 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 CS20109 [0,2,0,0,0,0|1,0,1]=4 1413 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 CS21987 [0,2,0,0,0,0|1,0,1]=4 1414 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 MC40253 [0,2,0,0,0,0|1,0,1]=4 1415 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 MC40267 [0,2,0,0,0,0|1,0,1]=4 1416 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 CS21546 [0,2,0,0,0,0|1,0,1]=4 1417 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 CS10370 [0,2,0,0,0,0|1,0,1]=4 1418 B11R1.166 O=C(O)C1=C(F)C=C(S)C=C1 MC106336 [0,2,0,0,0,0|1,0,1]=4 1419 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 CS22743 [0,2,0,0,0,0|1,0,1]=4 1420 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 CS14997 [0,2,0,0,0,0|1,0,1]=4 1421 B11R1.166 O=C(O)C1=C(I)C=C(O)C=C1 MC442268 [0,2,0,0,0,0|1,0,1]=4 1422 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 MC30324 [0,2,0,0,0,0|1,0,1]=4 1423 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 CS14628 [0,2,0,0,0,0|1,0,1]=4 1424 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 CS14175 [0,2,0,0,0,0|1,0,1]=4 1425 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 MC33215 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.166 OB(O)C1=C(Br)C=C(F)C=C1 MC431331 [0,2,0,0,0,0|2,0,0]=4 1427 B11R1.166 OB(O)C1=C(Cl)C=C(Cl)C=C1 CS15602 [0,2,0,0,0,0|2,0,0]=4 1428 B11R1.166 OB(O)C1=C(Cl)C=C(F)C=C1 MC20275 [0,2,0,0,0,0|2,0,0]=4 1429 B11R1.166 OB(O)C1=C(Cl)C=C(O)C=C1 MC442907 [0,2,0,0,0,0|2,0,0]=4 1430 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 MC20270 [0,2,0,0,0,0|2,0,0]=4 1431 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 CS22948 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.166 OB(O)C1=C(F)C=C(O)C=C1 MC441701 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.166 OB(O)C1=C(O)C=C(Cl)C=C1 MC442026 [0,2,0,0,0,0|2,0,0]=4 1434 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 MC441697 [0,2,0,0,0,0|2,0,0]=4 1435 B11R1.7 C#CC(C)(O)C1=CC=CC=C1 MC425780 [0,2,0,0,0,0|0,0,0]=2 1436 B11R1.7 CC(Br)(CBr)C1=CC=NC=C1 MC111871 [0,2,0,0,0,0|2,0,0]=4 1437 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 MC106429 [0,2,0,0,0,0|1,0,0]=3 1438 B11R1.7 NCC(F)(F)C1=NC=CC=C1 MC104009 [0,2,0,0,0,0|2,0,0]=4 1439 B11R1.7 OCC(F)(F)C1=CC=CC=C1 MC430789 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.12 CCP(CC)c1ccccc1 MC444851 [0,2,0,0,0,0|2,0,0]=4 1441 B11R1.12 CNC(CO)C1=CC=CC=C1 CS17955 [0,2,0,0,0,0|0,0,0]=2 1442 B11R1.12 COC(OC)C1=NC=NC=C1 CS18195 [0,2,0,0,0,0|2,0,0]=4 1443 B11R1.12 COC(OC)c1ccccc1 CS10959 [0,2,0,0,0,0|0,0,0]=2 1444 B11R1.12 COP(OC)C1=CC=CC=C1 MC444856 [0,2,0,0,0,0|1,0,0]=3 1445 B11R1.12 NCC(CO)C1=CC=CC=C1 MC105854 [0,2,0,0,0,0|0,0,0]=2 1446 B11R1.12 NCC(CO)C1=CC=CC=C1 MC105855 [0,2,0,0,0,0|0,0,0]=2 1447 B11R1.12 OCC(CO)C1=CC=CC=C1 CS21198 [0,2,0,0,0,0|0,0,0]=2 1448 B11R1.16 CC(N=C=O)C1=CC=CC=C1 MC20438 [0,2,0,0,0,0|0,0,1]=3 1449 B11R1.16 CN(CCN)C1=CC=CC=C1 CS11704 [0,2,0,0,0,0|2,0,0]=4 1450 B11R1.16 CNCC(C)C1=CC=CC=C1 MC446681 [0,2,0,0,0,0|1,0,0]=3 1451 B11R1.16 CNCC(O)C1=CC=CC=C1 MC446674 [0,2,0,0,0,0|0,0,0]=2 1452 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CS10995 [0,2,0,0,0,0|0,0,2]=4 1453 B11R1.16 NC(CCO)C1=CC=CC=C1 CS18735 [0,2,0,0,0,0|1,0,0]=3 1454 B11R1.16 NC(CCO)C1=CC=CC=C1 CS21217 [0,2,0,0,0,0|1,0,0]=3 1455 B11R1.16 O=C(CCCl)C1=CC=CC=C1 MC41279 [0,2,0,0,0,0|0,0,2]=4 1456 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS10897 [0,2,0,0,0,0|0,0,0]=2 1457 B11R1.16 OC(CCCl)C1=CC=CC=C1 CS22197 [0,2,0,0,0,0|0,0,0]=2 1458 B11R1.16 OC(CCCl)C1=CC=CC=C1 MC20313 [0,2,0,0,0,0|0,0,0]=2 1459 B11R1.23 CCC(=O)C1=CC(Br)=CC=C1 MC41278 [0,2,0,0,0,0|0,0,2]=4 1460 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 MC41280 [0,2,0,0,0,0|0,0,2]=4 1461 B11R1.23 CCC(=O)C1=CC(F)=CC=C1 MC41284 [0,2,0,0,0,0|0,0,2]=4 1462 B11R1.23 CCC(=O)C1=CC(N)=CC=C1 MC433258 [0,2,0,0,0,0|0,0,2]=4 1463 B11R1.23 CCC(N)C1=CC(Br)=CN=C1 MC112156 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.23 COC(=O)C1=CC(Br)=CC=C1 CS20038 [0,2,0,0,0,0|0,0,2]=4 1465 B11R1.23 COC(=O)C1=CC(C)=CC=C1 MC40113 [0,2,0,0,0,0|0,0,2]=4 1466 B11R1.23 COC(=O)C1=CC(Cl)=CC=C1 CS11622 [0,2,0,0,0,0|0,0,2]=4 1467 B11R1.23 COC(=O)C1=CC(F)=CC=C1 MC40102 [0,2,0,0,0,0|0,0,2]=4 1468 B11R1.23 COC(=O)C1=CC(I)=CC=C1 CS19204 [0,2,0,0,0,0|0,0,2]=4 1469 B11R1.23 COC(=O)C1=CC(N)=CC=C1 MC40055 [0,2,0,0,0,0|0,0,2]=4 1470 B11R1.23 COC(=O)C1=CC(O)=CC=C1 CS13404 [0,2,0,0,0,0|0,0,2]=4 1471 B11R1.23 COC(=O)C1=CC(S)=CC=C1 MC100369 [0,2,0,0,0,0|0,0,2]=4 1472 B11R1.23 NC(CO)C1=CC(I)=CC=C1 MC103511 [0,2,0,0,0,0|1,0,0]=3 1473 B11R1.23 NCC(O)C1=CC(Br)=CC=C1 MC111476 [0,2,0,0,0,0|0,0,0]=2 1474 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 MC41245 [0,2,0,0,0,0|0,0,2]=4 1475 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 CS19056 [0,2,0,0,0,0|0,0,2]=4 1476 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 CS15383 [0,2,0,0,0,0|0,0,2]=4 1477 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 MC433217 [0,2,0,0,0,0|0,0,2]=4 1478 B11R1.23 O=C(CCl)C1=CC(Cl)=CC=C1 MC20163 [0,2,0,0,0,0|0,0,2]=4 1479 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 MC20584 [0,2,0,0,0,0|1,0,1]=4 1480 B11R1.23 OC(CBr)C1=CC(Br)=CC=C1 MC111475 [0,2,0,0,0,0|0,0,0]=2 1481 B11R1.222 CC(CO)C1=C(Cl)C=CC=C1 MC111290 [0,2,0,0,0,0|0,0,0]=2 1482 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 CS15813 [0,2,0,0,0,0|0,0,2]=4 1483 B11R1.222 CCC(=O)C1=C(N)C=CC=C1 MC430440 [0,2,0,0,0,0|0,0,2]=4 1484 B11R1.222 CCC(C)C1=C(N)C=CC=C1 CS21765 [0,2,0,0,0,0|1,0,0]=3 1485 B11R1.222 CCC(N)C1=C(C)C=CC=C1 CS14530 [0,2,0,0,0,0|1,0,0]=3 1486 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 CS20442 [0,2,0,0,0,0|0,0,2]=4 1487 B11R1.222 CNC(=O)C1=C(S)C=CC=C1 MC42220 [0,2,0,0,0,0|0,0,2]=4 1488 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 MC20192 [0,2,0,0,0,0|0,0,2]=4 1489 B11R1.222 COC(=O)C1=C(F)C=CC=C1 CS11605 [0,2,0,0,0,0|0,0,2]=4 1490 B11R1.222 COC(=O)C1=C(I)C=CC=C1 CS15277 [0,2,0,0,0,0|0,0,2]=4 1491 B11R1.222 COC(=O)C1=C(N)C=CC=C1 CS13618 [0,2,0,0,0,0|0,0,2]=4 1492 B11R1.222 COC(=O)C1=C(S)C=CC=C1 MC40110 [0,2,0,0,0,0|0,0,2]=4 1493 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 CS15388 [0,2,0,0,0,0|0,0,2]=4 1494 B11R1.222 NCC(O)C1=C(F)C=CC=C1 MC431432 [0,2,0,0,0,0|0,0,0]=2 1495 B11R1.222 NCC(O)C1=C(I)C=CC=C1 CS17962 [0,2,0,0,0,0|0,0,0]=2 1496 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 CS14555 [0,2,0,0,0,0|0,0,2]=4 1497 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 MC41230 [0,2,0,0,0,0|0,0,2]=4 1498 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 CS11942 [0,2,0,0,0,0|1,0,1]=4 1499 B11R1.87 CC(C)(C)C1=C(F)C=CC=C1 MC107238 [0,2,0,0,0,0|1,0,0]=3 1500 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 CS21769 [0,2,0,0,0,0|1,0,0]=3 1501 B11R1.87 CC(C)(C)C1=C(O)C=CC=C1 CS21771 [0,2,0,0,0,0|1,0,0]=3 1502 B11R1.87 CC(C)(C)C1=NC=CC=C1O MC431053 [0,2,0,0,0,0|2,0,0]=4 1503 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 MC434015 [0,2,0,0,0,0|1,0,0]=3 1504 B11R1.87 CC1=C(C(F)(F)F)C=CC=C1 MC20049 [0,2,0,0,0,0|2,0,0]=4 1505 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 MC114477 [0,2,0,0,0,0|1,0,1]=4 1506 B11R1.87 FC(F)(F)C1=C(Br)C=CC=C1 MC41425 [0,2,0,0,0,0|2,0,0]=4 1507 B11R1.87 FC(F)(F)C1=C(Cl)C=CC=C1 MC41435 [0,2,0,0,0,0|2,0,0]=4 1508 B11R1.87 FC(F)(F)C1=C(I)C=CC=C1 MC429593 [0,2,0,0,0,0|2,0,0]=4 1509 B11R1.87 FC(F)(F)C1=C(S)C=CC=C1 MC41414 [0,2,0,0,0,0|2,0,0]=4 1510 B11R1.87 FC1=C(C(F)(F)F)C=CC=C1 CS19918 [0,2,0,0,0,0|2,0,0]=4 1511 B11R1.87 NC1=C(C(F)(F)F)C=CC=C1 CS19388 [0,2,0,0,0,0|2,0,0]=4 1512 B11R1.87 NC1=C(S(=O)(=O)O)C=CC=C1 MC40408 [0,2,0,0,0,0|2,0,0]=4 1513 B11R1.87 O=S(=O)(O)C1=C(I)C=CC=C1 MC40422 [0,2,0,0,0,0|2,0,0]=4 1514 B11R1.87 OC1=C(C(F)(F)F)C=CC=C1 CS14396 [0,2,0,0,0,0|2,0,0]=4 1515 B11R1.155 CC(C)(C)C1=CC(=O)C=CN1 MC106379 [0,2,0,0,0,0|2,0,0]=4 1516 B11R1.155 CC(C)(C)C1=CC(=O)C=CO1 MC106378 [0,2,0,0,0,0|2,0,0]=4 1517 B11R1.155 CC(C)(C)C1=CC(Br)=NC=C1 MC430325 [0,2,0,0,0,0|2,0,0]=4 1518 B11R1.155 CC(C)(C)C1=CC(Cl)=NC=C1 MC432172 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 MC442358 [0,2,0,0,0,0|1,0,0]=3 1520 B11R1.155 CC(C)(C)C1=CC=CC(Br)=N1 MC106553 [0,2,0,0,0,0|2,0,0]=4 1521 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 CS11182 [0,2,0,0,0,0|1,0,0]=3 1522 B11R1.155 CC(C)(C)C1=CC=CC(O)=N1 MC429684 [0,2,0,0,0,0|2,0,0]=4 1523 B11R1.155 CC(C)(C)C1=NC=CC(Br)=C1 MC33358 [0,2,0,0,0,0|2,0,0]=4 1524 B11R1.155 CC(C)(N)C1=CC(Br)=CN=C1 MC105194 [0,2,0,0,0,0|2,0,0]=4 1525 B11R1.155 CC(C)(N)C1=NC(Br)=CC=C1 MC111294 [0,2,0,0,0,0|2,0,0]=4 1526 B11R1.155 CC(C)(O)C1=CC=CC(O)=C1 MC105736 [0,2,0,0,0,0|0,0,0]=2 1527 B11R1.155 CC(C)(O)C1=NC(Br)=CC=C1 CS16576 [0,2,0,0,0,0|1,0,0]=3 1528 B11R1.155 CC1=CC=CC(C(F)(F)F)=C1 MC20050 [0,2,0,0,0,0|2,0,0]=4 1529 B11R1.155 CS(=O)(=O)C1=CC=CC(Br)=C1 CS10461 [0,2,0,0,0,0|1,0,1]=4 1530 B11R1.155 CS(=O)(=O)C1=CC=CC(F)=C1 CS16715 [0,2,0,0,0,0|1,0,1]=4 1531 B11R1.155 CS(=O)(=O)C1=CC=CC(N)=C1 MC40930 [0,2,0,0,0,0|1,0,1]=4 1532 B11R1.155 FC(F)(F)C1=CC(Cl)=CC=C1 MC20166 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.155 FC(F)(F)C1=CC(I)=CC=C1 MC429604 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.155 FC(F)(F)C1=CC=CC(Br)=C1 CS19045 [0,2,0,0,0,0|2,0,0]=4 1535 B11R1.155 FC(F)(F)C1=CC=CC(S)=C1 MC41415 [0,2,0,0,0,0|2,0,0]=4 1536 B11R1.155 FC1=CC=CC(C(F)(F)F)=C1 CS19919 [0,2,0,0,0,0|2,0,0]=4 1537 B11R1.155 NC1=CC(C(F)(F)F)=CC=C1 CS16403 [0,2,0,0,0,0|2,0,0]=4 1538 B11R1.155 OC1=CC(C(F)(F)F)=CC=C1 CS16405 [0,2,0,0,0,0|2,0,0]=4 1539 B11R1.53 C#CC1=C(B(O)O)C=CC=C1 MC442883 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 CS16516 [0,2,0,0,0,0|1,0,1]=4 1541 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 CS21523 [0,2,0,0,0,0|0,0,2]=4 1542 B11R1.53 CC(C)C1=C(C=O)C=CC=C1 MC441019 [0,2,0,0,0,0|1,0,0]=3 1543 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 MC103557 [0,2,0,0,0,0|1,0,0]=3 1544 B11R1.53 CCC1=C(B(O)O)C=CC=C1 CS20466 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 CS15281 [0,2,0,0,0,0|1,0,1]=4 1546 B11R1.53 COC1=C(B(O)O)C=CC=C1 CS20142 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.53 COC1=C(C(=O)O)C=CC=C1 CS15086 [0,2,0,0,0,0|1,0,1]=4 1548 B11R1.53 COC1=C(C(C)=O)C=CC=C1 MC41261 [0,2,0,0,0,0|0,0,2]=4 1549 B11R1.53 COC1=C(C(C)N)C=CC=C1 CS15754 [0,2,0,0,0,0|1,0,0]=3 1550 B11R1.53 N#CC1=C(B(O)O)C=CC=C1 MC21127 [0,2,0,0,0,0|2,0,0]=4 1551 B11R1.53 N#CC1=C(C(=O)O)C=CC=C1 MC40261 [0,2,0,0,0,0|1,0,1]=4 1552 B11R1.53 N#CC1=C(C(Cl)Cl)C=CC=C1 MC40640 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.53 NCC1=C(B(O)O)C=CC=C1 CS20890 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.53 O=CC1=C(B(O)O)C=CC=C1 CS10453 [0,2,0,0,0,0|2,0,0]=4 1555 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 CS13542 [0,2,0,0,0,0|1,0,1]=4 1556 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 CS15613 [0,2,0,0,0,0|2,0,0]=4 1557 B11R1.53 OB(O)C1=C(CBr)C=CC=C1 MC31222 [0,2,0,0,0,0|2,0,0]=4 1558 B11R1.53 OCC1=C(B(O)O)C=CC=C1 MC20276 [0,2,0,0,0,0|2,0,0]=4 1559 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F CS13264 [0,2,0,0,0,0|0,0,2]=4 1560 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O CS15783 [0,2,0,0,0,0|0,0,2]=4 1561 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl MC41246 [0,2,0,0,0,0|0,0,2]=4 1562 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F MC41237 [0,2,0,0,0,0|0,0,2]=4 1563 B11R1.156 CC(=O)C1=C(F)C=CC=C1F CS18713 [0,2,0,0,0,0|0,0,2]=4 1564 B11R1.156 CC(=O)C1=C(F)C=CC=C1O CS19423 [0,2,0,0,0,0|0,0,2]=4 1565 B11R1.156 CC(=O)C1=C(O)C=CC=C1O CS21180 [0,2,0,0,0,0|0,0,2]=4 1566 B11R1.156 CC(C)C1=C(O)C=CC=C1N MC442273 [0,2,0,0,0,0|1,0,0]=3 1567 B11R1.156 CC(N)C1=C(F)C=NC=C1F MC429825 [0,2,0,0,0,0|2,0,0]=4 1568 B11R1.156 CC(O)C1=C(F)C=CC=C1F MC40731 [0,2,0,0,0,0|0,0,0]=2 1569 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O CS21386 [0,2,0,0,0,0|1,0,1]=4 1570 B11R1.156 CC1=CC=CC(C)=C1B(O)O CS21186 [0,2,0,0,0,0|2,0,0]=4 1571 B11R1.156 CC1=CC=CC(C)=C1C(=O)O CS10891 [0,2,0,0,0,0|1,0,1]=4 1572 B11R1.156 CC1=CC=CC(Cl)=C1B(O)O MC431113 [0,2,0,0,0,0|2,0,0]=4 1573 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O CS20825 [0,2,0,0,0,0|1,0,1]=4 1574 B11R1.156 CC1=CC=CC(F)=C1B(O)O MC430080 [0,2,0,0,0,0|2,0,0]=4 1575 B11R1.156 CC1=CC=CC(F)=C1C(=O)O CS21875 [0,2,0,0,0,0|1,0,1]=4 1576 B11R1.156 CC1=CC=CC(N)=C1C(=O)O CS20994 [0,2,0,0,0,0|1,0,1]=4 1577 B11R1.156 CC1=CC=CC(O)=C1C(=O)O CS21594 [0,2,0,0,0,0|1,0,1]=4 1578 B11R1.156 NC1=C(C(=O)O)C(Br)=CC=C1 CS13923 [0,2,0,0,0,0|1,0,1]=4 1579 B11R1.156 NC1=C(C(=O)O)C(Cl)=CC=C1 CS10413 [0,2,0,0,0,0|1,0,1]=4 1580 B11R1.156 NC1=C(C(=O)O)C(F)=CC=C1 CS14367 [0,2,0,0,0,0|1,0,1]=4 1581 B11R1.156 NC1=C(C(=O)O)C(O)=CC=C1 CS15536 [0,2,0,0,0,0|1,0,1]=4 1582 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br MC40265 [0,2,0,0,0,0|1,0,1]=4 1583 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Cl CS19832 [0,2,0,0,0,0|1,0,1]=4 1584 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F CS21839 [0,2,0,0,0,0|1,0,1]=4 1585 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O MC442376 [0,2,0,0,0,0|1,0,1]=4 1586 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl CS19900 [0,2,0,0,0,0|1,0,1]=4 1587 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F CS19955 [0,2,0,0,0,0|1,0,1]=4 1588 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O MC442377 [0,2,0,0,0,0|1,0,1]=4 1589 B11R1.156 O=C(O)C1=C(F)C=CC=C1F CS21799 [0,2,0,0,0,0|1,0,1]=4 1590 B11R1.156 O=C(O)C1=C(F)C=CC=C1I CS21556 [0,2,0,0,0,0|1,0,1]=4 1591 B11R1.156 O=C(O)C1=C(F)C=CC=C1O MC433134 [0,2,0,0,0,0|1,0,1]=4 1592 B11R1.156 O=C(O)C1=C(O)C=CC=C1O CS14109 [0,2,0,0,0,0|1,0,1]=4 1593 B11R1.156 OB(O)C1=C(Br)C=CC=C1F CS21840 [0,2,0,0,0,0|2,0,0]=4 1594 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl MC425375 [0,2,0,0,0,0|2,0,0]=4 1595 B11R1.156 OB(O)C1=C(Cl)C=CC=C1F MC31118 [0,2,0,0,0,0|2,0,0]=4 1596 B11R1.156 OB(O)C1=C(Cl)C=CC=C1O MC441444 [0,2,0,0,0,0|2,0,0]=4 1597 B11R1.156 OB(O)C1=C(F)C=CC=C1F MC429414 [0,2,0,0,0,0|2,0,0]=4 1598 B11R1.156 OB(O)C1=C(F)C=CC=C1O MC441419 [0,2,0,0,0,0|2,0,0]=4 1599 B11R1.156 OB(O)C1=C(O)C=CC=C1O MC114335 [0,2,0,0,0,0|2,0,0]=4 1600 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 MC33077 [0,2,0,0,0,0|0,0,2]=4 1601 B11R1.159 CC(=O)C1=C(Cl)C(Cl)=CC=C1 CS21018 [0,2,0,0,0,0|0,0,2]=4 1602 B11R1.159 CC(=O)C1=C(Cl)C(F)=CC=C1 MC41235 [0,2,0,0,0,0|0,0,2]=4 1603 B11R1.159 CC(=O)C1=C(F)C(Br)=CC=C1 MC20204 [0,2,0,0,0,0|0,0,2]=4 1604 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 MC31073 [0,2,0,0,0,0|0,0,2]=4 1605 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 MC442382 [0,2,0,0,0,0|0,0,2]=4 1606 B11R1.159 CC(=O)C1=C(N)C(F)=CC=C1 MC443630 [0,2,0,0,0,0|0,0,2]=4 1607 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 CS20991 [0,2,0,0,0,0|0,0,2]=4 1608 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 CS20407 [0,2,0,0,0,0|0,0,2]=4 1609 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 CS13325 [0,2,0,0,0,0|0,0,2]=4 1610 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 CS10781 [0,2,0,0,0,0|0,0,2]=4 1611 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 CS15701 [0,2,0,0,0,0|0,0,2]=4 1612 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 CS20939 [0,2,0,0,0,0|0,0,2]=4 1613 B11R1.159 CC(=O)c1cccc(Br)c1N MC433201 [0,2,0,0,0,0|0,0,2]=4 1614 B11R1.159 CC(C)C1=C(O)C(O)=CC=C1 MC443613 [0,2,0,0,0,0|1,0,0]=3 1615 B11R1.159 CC(C)C1=CC=CC(Br)=C1O MC442830 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.159 CC(C)C1=CC=CC(Cl)=C1O MC441235 [0,2,0,0,0,0|1,0,0]=3 1617 B11R1.159 CC(C)C1=CC=CC(O)=C1F MC442499 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.159 CC1=C(C(=O)O)C=CC=C1Br CS10774 [0,2,0,0,0,0|1,0,1]=4 1619 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl CS22209 [0,2,0,0,0,0|1,0,1]=4 1620 B11R1.159 CC1=C(C(=O)O)C=CC=C1F CS20846 [0,2,0,0,0,0|1,0,1]=4 1621 B11R1.159 CC1=C(C(=O)O)C=CC=C1I MC20967 [0,2,0,0,0,0|1,0,1]=4 1622 B11R1.159 CC1=C(C(=O)O)C=CC=C1N CS20997 [0,2,0,0,0,0|1,0,1]=4 1623 B11R1.159 CC1=C(C(=O)O)C=CC=C1O CS20942 [0,2,0,0,0,0|1,0,1]=4 1624 B11R1.159 CC1=CC=CC(B(O)O)=C1Cl MC441448 [0,2,0,0,0,0|2,0,0]=4 1625 B11R1.159 CC1=CC=CC(B(O)O)=C1F MC441506 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.159 CC1=CC=CC(B(O)O)=C1O MC442851 [0,2,0,0,0,0|2,0,0]=4 1627 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br CS10769 [0,2,0,0,0,0|1,0,1]=4 1628 B11R1.159 CC1=CC=CC(C(=O)O)=C1C CS21070 [0,2,0,0,0,0|1,0,1]=4 1629 B11R1.159 CC1=CC=CC(C(=O)O)=C1F CS21867 [0,2,0,0,0,0|1,0,1]=4 1630 B11R1.159 CC1=CC=CC(C(=O)O)=C1I CS21611 [0,2,0,0,0,0|1,0,1]=4 1631 B11R1.159 CC1=CC=CC(C(=O)O)=C1N CS21804 [0,2,0,0,0,0|1,0,1]=4 1632 B11R1.159 CC1=CC=CC(C(=O)O)=C1O CS16085 [0,2,0,0,0,0|1,0,1]=4 1633 B11R1.159 CC1=CC=CC(C(C)C)=C1N MC428273 [0,2,0,0,0,0|1,0,0]=3 1634 B11R1.159 NC1=C(C(=O)O)C=CC=C1Br CS20178 [0,2,0,0,0,0|1,0,1]=4 1635 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl CS20200 [0,2,0,0,0,0|1,0,1]=4 1636 B11R1.159 NC1=C(C(=O)O)C=CC=C1F CS10428 [0,2,0,0,0,0|1,0,1]=4 1637 B11R1.159 NC1=C(C(=O)O)C=CC=C1I CS14916 [0,2,0,0,0,0|1,0,1]=4 1638 B11R1.159 NC1=C(C(=O)O)C=CC=C1O CS20329 [0,2,0,0,0,0|1,0,1]=4 1639 B11R1.159 NC1=CC=CC(C(=O)O)=C1Cl CS18598 [0,2,0,0,0,0|1,0,1]=4 1640 B11R1.159 NC1=CC=CC(C(=O)O)=C1F CS20007 [0,2,0,0,0,0|1,0,1]=4 1641 B11R1.159 NC1=CC=CC(C(=O)O)=C1N CS13398 [0,2,0,0,0,0|1,0,1]=4 1642 B11R1.159 NC1=CC=CC(C(=O)O)=C1O CS20331 [0,2,0,0,0,0|1,0,1]=4 1643 B11R1.159 O=C(O)C1=C(Br)C(Br)=CC=C1 CS14427 [0,2,0,0,0,0|1,0,1]=4 1644 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 MC429659 [0,2,0,0,0,0|1,0,1]=4 1645 B11R1.159 O=C(O)C1=C(Br)C(Cl)=CC=C1 MC433592 [0,2,0,0,0,0|1,0,1]=4 1646 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 CS21833 [0,2,0,0,0,0|1,0,1]=4 1647 B11R1.159 O=C(O)C1=C(Br)C(O)=CC=C1 MC442312 [0,2,0,0,0,0|1,0,1]=4 1648 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 CS14400 [0,2,0,0,0,0|1,0,1]=4 1649 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 MC433645 [0,2,0,0,0,0|1,0,1]=4 1650 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 CS19950 [0,2,0,0,0,0|1,0,1]=4 1651 B11R1.159 O=C(O)C1=C(Cl)C(O)=CC=C1 CS14808 [0,2,0,0,0,0|1,0,1]=4 1652 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 CS21913 [0,2,0,0,0,0|1,0,1]=4 1653 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 CS19960 [0,2,0,0,0,0|1,0,1]=4 1654 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 MC30136 [0,2,0,0,0,0|1,0,1]=4 1655 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 CS12733 [0,2,0,0,0,0|1,0,1]=4 1656 B11R1.159 O=C(O)C1=C(F)C(O)=CC=C1 MC20266 [0,2,0,0,0,0|1,0,1]=4 1657 B11R1.159 O=C(O)C1=C(I)C(Cl)=CC=C1 CS15350 [0,2,0,0,0,0|1,0,1]=4 1658 B11R1.159 O=C(O)C1=C(I)C(F)=CC=C1 CS14251 [0,2,0,0,0,0|1,0,1]=4 1659 B11R1.159 O=C(O)C1=C(I)C(O)=CC=C1 MC442215 [0,2,0,0,0,0|1,0,1]=4 1660 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 CS19729 [0,2,0,0,0,0|1,0,1]=4 1661 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 CS22246 [0,2,0,0,0,0|1,0,1]=4 1662 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 CS10372 [0,2,0,0,0,0|1,0,1]=4 1663 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 MC20146 [0,2,0,0,0,0|1,0,1]=4 1664 B11R1.159 OB(O)C1=C(Cl)C(Cl)=CC=C1 MC441433 [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.159 OB(O)C1=C(Cl)C(F)=CC=C1 MC103588 [0,2,0,0,0,0|2,0,0]=4 1666 B11R1.159 OB(O)C1=C(F)C(Br)=CC=C1 CS14021 [0,2,0,0,0,0|2,0,0]=4 1667 B11R1.159 OB(O)C1=C(F)C(Cl)=CC=C1 CS18944 [0,2,0,0,0,0|2,0,0]=4 1668 B11R1.159 OB(O)C1=C(F)C(F)=CC=C1 CS22947 [0,2,0,0,0,0|2,0,0]=4 1669 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 MC441449 [0,2,0,0,0,0|2,0,0]=4 1670 B11R1.159 OB(O)C1=C(O)C(Cl)=CC=C1 MC442852 [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.159 OB(O)C1=C(O)C(F)=CC=C1 MC442425 [0,2,0,0,0,0|2,0,0]=4 1672 B11R1.167 C=C(C)C1=C(Cl)C=CC(Br)=C1 MC111656 [0,2,0,0,0,0|1,0,1]=4 1673 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 CS14948 [0,2,0,0,0,0|0,0,2]=4 1674 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 MC10476 [0,2,0,0,0,0|0,0,2]=4 1675 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 MC41256 [0,2,0,0,0,0|0,0,2]=4 1676 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 MC33032 [0,2,0,0,0,0|0,0,2]=4 1677 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 CS21139 [0,2,0,0,0,0|0,0,2]=4 1678 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 CS10721 [0,2,0,0,0,0|0,0,2]=4 1679 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=C1 CS12150 [0,2,0,0,0,0|0,0,2]=4 1680 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 MC41254 [0,2,0,0,0,0|0,0,2]=4 1681 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 CS18839 [0,2,0,0,0,0|0,0,2]=4 1682 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 MC41223 [0,2,0,0,0,0|0,0,2]=4 1683 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 MC442384 [0,2,0,0,0,0|0,0,2]=4 1684 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 MC10366 [0,2,0,0,0,0|0,0,2]=4 1685 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 CS12985 [0,2,0,0,0,0|0,0,2]=4 1686 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 CS12192 [0,2,0,0,0,0|0,0,2]=4 1687 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 CS15935 [0,2,0,0,0,0|0,0,2]=4 1688 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 MC10135 [0,2,0,0,0,0|0,0,2]=4 1689 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 CS13715 [0,2,0,0,0,0|0,0,2]=4 1690 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 CS20840 [0,2,0,0,0,0|0,0,2]=4 1691 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 MC33295 [0,2,0,0,0,0|0,0,2]=4 1692 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 CS19932 [0,2,0,0,0,0|0,0,2]=4 1693 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 MC443460 [0,2,0,0,0,0|1,0,0]=3 1694 B11R1.167 CC(C)C1=C(O)C=CC(Cl)=C1 MC442236 [0,2,0,0,0,0|1,0,0]=3 1695 B11R1.167 CC(C)N1C=C(Br)C=CC1=O MC443448 [0,2,0,0,0,0|2,0,0]=4 1696 B11R1.167 CC(C)c1cc(Br)ccc1Cl MC111654 [0,2,0,0,0,0|1,0,0]=3 1697 B11R1.167 CC(N)C1=C(Br)C=CC(Cl)=C1 MC112227 [0,2,0,0,0,0|1,0,0]=3 1698 B11R1.167 CC(N)C1=C(Br)C=CC(F)=C1 MC112228 [0,2,0,0,0,0|1,0,0]=3 1699 B11R1.167 CC(O)C1=C(F)C=CC(Br)=C1 CS12149 [0,2,0,0,0,0|0,0,0]=2 1700 B11R1.167 CC(O)C1=C(O)C=CC(Br)=C1 MC107819 [0,2,0,0,0,0|0,0,0]=2 1701 B11R1.167 CC(O)C1=CC(Br)=CN=C1Cl MC111360 [0,2,0,0,0,0|1,0,0]=3 1702 B11R1.167 CC(O)C1=CC(Br)=CN=C1F MC430805 [0,2,0,0,0,0|1,0,0]=3 1703 B11R1.167 CC1=C(B(O)O)C=C(Cl)C=C1 CS22046 [0,2,0,0,0,0|2,0,0]=4 1704 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 CS20805 [0,2,0,0,0,0|1,0,1]=4 1705 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 CS10331 [0,2,0,0,0,0|1,0,1]=4 1706 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 CS22055 [0,2,0,0,0,0|1,0,1]=4 1707 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 CS14966 [0,2,0,0,0,0|1,0,1]=4 1708 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 CS21678 [0,2,0,0,0,0|1,0,1]=4 1709 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 CS10400 [0,2,0,0,0,0|1,0,1]=4 1710 B11R1.167 CC1=C(C(C)C)C=C(Br)C=C1 MC443582 [0,2,0,0,0,0|1,0,0]=3 1711 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 CS20464 [0,2,0,0,0,0|2,0,0]=4 1712 B11R1.167 CC1=CC(B(O)O)=C(Cl)C=C1 MC441518 [0,2,0,0,0,0|2,0,0]=4 1713 B11R1.167 CC1=CC(B(O)O)=C(F)C=C1 MC441713 [0,2,0,0,0,0|2,0,0]=4 1714 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 MC441699 [0,2,0,0,0,0|2,0,0]=4 1715 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 CS10772 [0,2,0,0,0,0|1,0,1]=4 1716 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 CS21075 [0,2,0,0,0,0|1,0,1]=4 1717 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 CS19779 [0,2,0,0,0,0|1,0,1]=4 1718 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 MC40284 [0,2,0,0,0,0|1,0,1]=4 1719 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 CS21612 [0,2,0,0,0,0|1,0,1]=4 1720 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 CS20992 [0,2,0,0,0,0|1,0,1]=4 1721 B11R1.167 FC(F)C1=C(Br)C=CC(Br)=C1 MC432456 [0,2,0,0,0,0|2,0,0]=4 1722 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 CS20261 [0,2,0,0,0,0|1,0,1]=4 1723 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 CS20202 [0,2,0,0,0,0|1,0,1]=4 1724 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 CS21817 [0,2,0,0,0,0|1,0,1]=4 1725 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 CS20231 [0,2,0,0,0,0|1,0,1]=4 1726 B11R1.167 NC1=CC(B(O)O)=C(Cl)C=C1 MC107122 [0,2,0,0,0,0|2,0,0]=4 1727 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 CS18210 [0,2,0,0,0,0|1,0,1]=4 1728 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 CS20208 [0,2,0,0,0,0|1,0,1]=4 1729 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 MC30241 [0,2,0,0,0,0|1,0,1]=4 1730 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 CS16234 [0,2,0,0,0,0|1,0,1]=4 1731 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 CS19808 [0,2,0,0,0,0|1,0,1]=4 1732 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 CS19830 [0,2,0,0,0,0|1,0,1]=4 1733 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 CS19846 [0,2,0,0,0,0|1,0,1]=4 1734 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 MC433609 [0,2,0,0,0,0|1,0,1]=4 1735 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 CS10221 [0,2,0,0,0,0|1,0,1]=4 1736 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 CS19898 [0,2,0,0,0,0|1,0,1]=4 1737 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 MC429399 [0,2,0,0,0,0|1,0,1]=4 1738 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 MC433624 [0,2,0,0,0,0|1,0,1]=4 1739 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 CS21466 [0,2,0,0,0,0|1,0,1]=4 1740 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 CS22027 [0,2,0,0,0,0|1,0,1]=4 1741 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 MC40254 [0,2,0,0,0,0|1,0,1]=4 1742 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 MC31113 [0,2,0,0,0,0|1,0,1]=4 1743 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 CS20031 [0,2,0,0,0,0|1,0,1]=4 1744 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 CS10371 [0,2,0,0,0,0|1,0,1]=4 1745 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 CS10237 [0,2,0,0,0,0|1,0,1]=4 1746 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 MC40257 [0,2,0,0,0,0|1,0,1]=4 1747 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 CS14765 [0,2,0,0,0,0|1,0,1]=4 1748 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 MC433663 [0,2,0,0,0,0|1,0,1]=4 1749 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 CS16232 [0,2,0,0,0,0|1,0,1]=4 1750 B11R1.167 O=C(O)C1=C(O)C=CC(Cl)=C1 CS14141 [0,2,0,0,0,0|1,0,1]=4 1751 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 CS10374 [0,2,0,0,0,0|1,0,1]=4 1752 B11R1.167 O=C(O)C1=C(S)C=CC(Br)=C1 MC115165 [0,2,0,0,0,0|1,0,1]=4 1753 B11R1.167 OB(O)C1=C(Cl)C=CC(F)=C1 MC441703 [0,2,0,0,0,0|2,0,0]=4 1754 B11R1.167 OB(O)C1=C(Cl)C=CC(O)=C1 MC441700 [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.167 OB(O)C1=C(F)C=CC(Cl)=C1 MC429569 [0,2,0,0,0,0|2,0,0]=4 1756 B11R1.167 OB(O)C1=C(F)C=CC(F)=C1 CS22949 [0,2,0,0,0,0|2,0,0]=4 1757 B11R1.167 OB(O)C1=C(F)C=CC(O)=C1 MC441423 [0,2,0,0,0,0|2,0,0]=4 1758 B11R1.167 OB(O)C1=C(O)C=CC(Cl)=C1 MC425732 [0,2,0,0,0,0|2,0,0]=4 1759 B11R1.167 OB(O)C1=C(O)C=CC(F)=C1 MC441421 [0,2,0,0,0,0|2,0,0]=4 1760 B11R1.167 OC1=C(C(F)F)C=C(F)C=C1 MC431902 [0,2,0,0,0,0|2,0,0]=4 1761 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 MC111196 [0,2,0,0,0,0|0,0,2]=4 1762 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 CS11107 [0,2,0,0,0,0|0,0,2]=4 1763 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 CS10716 [0,2,0,0,0,0|0,0,2]=4 1764 B11R1.74 CC(=O)C1=CC(Cl)=CC(F)=C1 MC41238 [0,2,0,0,0,0|0,0,2]=4 1765 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 MC30105 [0,2,0,0,0,0|0,0,2]=4 1766 B11R1.74 CC(=O)c1cc(Br)cc(Br)c1 MC433229 [0,2,0,0,0,0|0,0,2]=4 1767 B11R1.74 CC(N)C1=CC(Cl)=CC(Cl)=C1 MC429090 [0,2,0,0,0,0|1,0,0]=3 1768 B11R1.74 CC(N)C1=CC(Cl)=CC(F)=C1 CS17358 [0,2,0,0,0,0|1,0,0]=3 1769 B11R1.74 CC(N)C1=CC(F)=CC(F)=C1 CS14526 [0,2,0,0,0,0|1,0,0]=3 1770 B11R1.74 CC(N)C1=CC(F)=CC(F)=C1 MC429422 [0,2,0,0,0,0|1,0,0]=3 1771 B11R1.74 CC(O)C1=CC(F)=CC(F)=C1 MC433886 [0,2,0,0,0,0|0,0,0]=2 1772 B11R1.74 CC1=CC(B(O)O)=CC(Br)=C1 MC31203 [0,2,0,0,0,0|2,0,0]=4 1773 B11R1.74 CC1=CC(B(O)O)=CC(Cl)=C1 CS15680 [0,2,0,0,0,0|2,0,0]=4 1774 B11R1.74 CC1=CC(B(O)O)=CC(F)=C1 MC441546 [0,2,0,0,0,0|2,0,0]=4 1775 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=C1 CS12399 [0,2,0,0,0,0|1,0,1]=4 1776 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=C1 CS15533 [0,2,0,0,0,0|1,0,1]=4 1777 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 CS14703 [0,2,0,0,0,0|1,0,1]=4 1778 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 CS22319 [0,2,0,0,0,0|1,0,1]=4 1779 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 CS20468 [0,2,0,0,0,0|2,0,0]=4 1780 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 CS21904 [0,2,0,0,0,0|1,0,1]=4 1781 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 MC433670 [0,2,0,0,0,0|1,0,1]=4 1782 B11R1.74 CC1=CC(N)=CC(C(=O)O)=C1 MC20267 [0,2,0,0,0,0|1,0,1]=4 1783 B11R1.74 FC1=CC(Br)=CC(C(F)F)=C1 MC111768 [0,2,0,0,0,0|2,0,0]=4 1784 B11R1.74 NC1=CC(Br)=CC(C(=O)O)=C1 CS22075 [0,2,0,0,0,0|1,0,1]=4 1785 B11R1.74 NC1=CC(F)=CC(C(=O)O)=C1 CS10981 [0,2,0,0,0,0|1,0,1]=4 1786 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 MC433642 [0,2,0,0,0,0|1,0,1]=4 1787 B11R1.74 NC1=CC(O)=CC(C(=O)O)=C1 CS22078 [0,2,0,0,0,0|1,0,1]=4 1788 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CS19812 [0,2,0,0,0,0|1,0,1]=4 1789 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 CS12668 [0,2,0,0,0,0|1,0,1]=4 1790 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 CS21917 [0,2,0,0,0,0|1,0,1]=4 1791 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 MC20185 [0,2,0,0,0,0|1,0,1]=4 1792 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 MC40243 [0,2,0,0,0,0|1,0,1]=4 1793 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 CS14664 [0,2,0,0,0,0|1,0,1]=4 1794 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 MC33092 [0,2,0,0,0,0|1,0,1]=4 1795 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 CS22224 [0,2,0,0,0,0|1,0,1]=4 1796 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 MC30103 [0,2,0,0,0,0|1,0,1]=4 1797 B11R1.74 O=C(O)C1=CC(F)=CC(I)=C1 MC433681 [0,2,0,0,0,0|1,0,1]=4 1798 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 CS14447 [0,2,0,0,0,0|1,0,1]=4 1799 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 MC433664 [0,2,0,0,0,0|1,0,1]=4 1800 B11R1.74 O=C(O)C1=CC(O)=CC(I)=C1 MC442504 [0,2,0,0,0,0|1,0,1]=4 1801 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 MC20481 [0,2,0,0,0,0|1,0,1]=4 1802 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 MC31024 [0,2,0,0,0,0|2,0,0]=4 1803 B11R1.74 OB(O)C1=CC(Br)=CC(F)=C1 MC441508 [0,2,0,0,0,0|2,0,0]=4 1804 B11R1.74 OB(O)C1=CC(Cl)=CC(F)=C1 CS22222 [0,2,0,0,0,0|2,0,0]=4 1805 B11R1.74 OB(O)C1=CC(Cl)=CC(O)=C1 MC442032 [0,2,0,0,0,0|2,0,0]=4 1806 B11R1.74 OB(O)C1=CC(F)=CC(F)=C1 CS18961 [0,2,0,0,0,0|2,0,0]=4 1807 B11R1.74 OB(O)C1=CC(F)=CC(O)=C1 MC441542 [0,2,0,0,0,0|2,0,0]=4 1808 B11R1.74 OB(O)c1cc(Cl)cc(Cl)c1 MC440551 [0,2,0,0,0,0|2,0,0]=4 1809 B11R1.266 C#CC1=CC=CC(B(O)O)=C1 MC443462 [0,2,0,0,0,0|2,0,0]=4 1810 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 MC33169 [0,2,0,0,0,0|0,0,2]=4 1811 B11R1.266 CC(=O)c1cccc(CCl)c1 MC30280 [0,2,0,0,0,0|0,0,2]=4 1812 B11R1.266 CC(C)C1=CC(C#N)=NC=C1 MC102219 [0,2,0,0,0,0|2,0,0]=4 1813 B11R1.266 CC(C)C1=CC=CC(C#N)=N1 MC103606 [0,2,0,0,0,0|2,0,0]=4 1814 B11R1.266 CC(C)C1=CC=CC(CBr)=C1 MC103558 [0,2,0,0,0,0|1,0,0]=3 1815 B11R1.266 CCC1=CC=CC(B(O)O)=C1 MC433905 [0,2,0,0,0,0|2,0,0]=4 1816 B11R1.266 CN(C)C1=CC(CBr)=CC=C1 MC430239 [0,2,0,0,0,0|2,0,0]=4 1817 B11R1.266 COC1=CC(C(C)N)=NC=C1 MC112203 [0,2,0,0,0,0|2,0,0]=4 1818 B11R1.266 COC1=CC(N(C)C)=CC=C1 MC445041 [0,2,0,0,0,0|2,0,0]=4 1819 B11R1.266 COC1=CC=CC(B(O)O)=C1 CS20399 [0,2,0,0,0,0|2,0,0]=4 1820 B11R1.266 COC1=CC=CC(C(=O)O)=C1 MC40298 [0,2,0,0,0,0|1,0,1]=4 1821 B11R1.266 FC(F)C1=CC=CC(CBr)=C1 MC430414 [0,2,0,0,0,0|2,0,0]=4 1822 B11R1.266 N#CC1=CC=CC(B(O)O)=C1 CS20161 [0,2,0,0,0,0|2,0,0]=4 1823 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 MC433634 [0,2,0,0,0,0|1,0,1]=4 1824 B11R1.266 NCC1=CC=CC(B(O)O)=C1 MC442898 [0,2,0,0,0,0|2,0,0]=4 1825 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 CS21006 [0,2,0,0,0,0|1,0,1]=4 1826 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 MC30291 [0,2,0,0,0,0|1,0,1]=4 1827 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 CS18966 [0,2,0,0,0,0|1,0,1]=4 1828 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 CS21920 [0,2,0,0,0,0|1,0,1]=4 1829 B11R1.266 O=CC1=CC=CC(B(O)O)=C1 CS20263 [0,2,0,0,0,0|2,0,0]=4 1830 B11R1.266 O=Cc1cccc(C(F)F)c1 MC432454 [0,2,0,0,0,0|2,0,0]=4 1831 B11R1.266 OB(O)C1=CC(CBr)=CC=C1 CS20344 [0,2,0,0,0,0|2,0,0]=4 1832 B11R1.266 OCC1=CC=CC(B(O)O)=C1 CS21893 [0,2,0,0,0,0|2,0,0]=4 1833 B9R2.50 C1=CC=C2CCC2=C1 CS19267 [1,0,0,1,0,0|0,0,0]=2 1834 B11R2.4 NC1CC1C2=CC=CC=C2 MC100890 [0,0,0,1,0,1|1,0,0]=3 1835 B11R2.4 NC1CC1C2=CC=CC=C2 MC106461 [0,0,0,1,0,1|1,0,0]=3 1836 B11R2.10 BrC1=CC2=CC=CC=C2C1 CS21490 [0,0,0,1,0,1|1,0,1]=4 1837 B11R2.10 BrC1=NC2=C(C=CC=C2)O1 MC442524 [0,0,0,1,0,1|1,0,1]=4 1838 B11R2.10 CC1=CC2=CC=CC=C2C1 CS11052 [0,0,0,1,0,1|1,0,1]=4 1839 B11R2.10 CC1=CC2=CC=CC=C2N1 CS18563 [0,0,0,1,0,1|1,0,1]=4 1840 B11R2.10 CC1=NC2=C(C=CC=C2)N1 CS15288 [0,0,0,1,0,1|1,0,1]=4 1841 B11R2.10 CC1=NC2=C(C=CC=C2)O1 MC31235 [0,0,0,1,0,1|0,0,1]=3 1842 B11R2.10 CC1=NC2=C(C=CC=C2)S1 CS21687 [0,0,0,1,0,1|0,1,1]=4 1843 B11R2.10 CC1=NC2=NC=CC=C2O1 MC445727 [0,0,0,1,0,1|1,0,1]=4 1844 B11R2.10 CC1CC2=CC=CC=C2N1 MC105455 [0,0,0,1,0,1|1,0,0]=3 1845 B11R2.10 CC1CC2=CC=CC=C2N1 MC445120 [0,0,0,1,0,1|1,0,0]=3 1846 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 MC31172 [0,0,0,1,0,1|1,0,1]=4 1847 B11R2.10 NC1=NC2=C(C=CC=C2)O1 MC31149 [0,0,0,1,0,1|1,0,1]=4 1848 B11R2.10 NC1CC2=CC=CC=C2C1 CS19882 [0,0,0,1,0,1|1,0,0]=3 1849 B11R2.10 NN1CC2=CC=CC=C2C1 MC442461 [0,0,0,1,0,1|2,0,0]=4 1850 B11R2.10 O=C1CC2=C(C=CC=C2)O1 MC20944 [0,0,0,1,0,1|0,0,2]=4 1851 B11R2.10 O=C1CC2=CC=CC=C2C1 CS16080 [0,0,0,1,0,1|0,0,2]=4 1852 B11R2.10 O=C1CC2=CC=CC=C2N1 CS15184 [0,0,0,1,0,1|0,0,2]=4 1853 B11R2.10 O=C1NC2=C(C=CC=C2)O1 CS15190 [0,0,0,1,0,1|1,0,1]=4 1854 B11R2.10 O=C1OC2=C(C=CC=C2)O1 CS10973 [0,0,0,1,0,1|1,0,1]=4 1855 B11R2.10 OC1=NC2=C(C=CC=C2)N1 CS20242 [0,0,0,1,0,1|1,0,1]=4 1856 B11R2.10 OC1CC2=CC=CC=C2C1 CS21608 [0,0,0,1,0,1|0,0,0]=2 1857 B11R2.10 ON1CC2=CC=CC=C2C1 MC41790 [0,0,0,1,0,1|1,0,0]=3 1858 B11R2.10 SC1=NC2=C(C=CC=C2)O1 MC20463 [0,0,0,1,0,1|1,0,1]=4 1859 B11R2.238 C1=CC=C(CC2CN2)C=C1 CS19482 [0,0,0,1,0,1|1,0,0]=3 1860 B11R2.238 C1=CC=C(SC2CC2)C=C1 MC20576 [0,0,0,1,0,1|1,0,0]=3 1861 B11R2.34 BrC1=CC=C(C2CC2)C=C1 CS22811 [0,1,0,1,0,0|1,0,0]=3 1862 B11R2.34 BrC1=NC=C(C2CC2)C=C1 MC442244 [0,1,0,1,0,0|2,0,0]=4 1863 B11R2.34 CC1=CC=C(C2CO2)C=C1 MC112355 [0,1,0,1,0,0|0,0,0]=2 1864 B11R2.34 NC1=CC=C(C2CC2)C=C1 CS17100 [0,1,0,1,0,0|1,0,0]=3 1865 B11R2.1 BrC1=COC2=C1C=CC=C2 CS20626 [0,1,0,1,0,0|1,0,1]=4 1866 B11R2.1 CC1=CCC2=CC=CC=C12 MC106180 [0,1,0,1,0,0|1,0,1]=4 1867 B11R2.1 CC1=CNC2=CC=CC=C12 CS11030 [0,1,0,1,0,0|1,0,1]=4 1868 B11R2.1 CC1=COC2=C1C=CC=C2 MC30270 [0,1,0,1,0,0|0,0,1]=3 1869 B11R2.1 CC1=NNC2=CC=CC=C21 CS17372 [0,1,0,1,0,0|1,0,1]=4 1870 B11R2.1 CC1=NOC2=C1C=CC=C2 CS22352 [0,1,0,1,0,0|0,0,1]=3 1871 B11R2.1 CN1C=CC2=CC=CC=C21 CS11026 [0,1,0,1,0,0|2,0,0]=4 1872 B11R2.1 ClC1=COC2=C1C=CC=C2 MC114725 [0,1,0,1,0,0|1,0,1]=4 1873 B11R2.1 ClC1=NOC2=C1C=CC=C2 CS19970 [0,1,0,1,0,0|1,0,1]=4 1874 B11R2.1 NC1=NOC2=C1C=CC=C2 CS20240 [0,1,0,1,0,0|1,0,1]=4 1875 B11R2.1 NC1CCC2=CC=CC=C21 CS16005 [0,1,0,1,0,0|1,0,0]=3 1876 B11R2.1 NC1CCC2=CC=CC=C21 CS19275 [0,1,0,1,0,0|1,0,0]=3 1877 B11R2.1 NC1CCC2=CC=CC=C21 CS19803 [0,1,0,1,0,0|1,0,0]=3 1878 B11R2.1 NC1CCC2=CC=CC=C21 CS20307 [0,1,0,1,0,0|1,0,0]=3 1879 B11R2.1 NC1CCC2=CC=CC=C21 MC425841 [0,1,0,1,0,0|1,0,0]=3 1880 B11R2.1 NC1COC2=NC=CC=C21 MC443539 [0,1,0,1,0,0|2,0,0]=4 1881 B11R2.1 O=C1CCC2=CC=CC=C12 CS18668 [0,1,0,1,0,0|0,0,2]=4 1882 B11R2.1 O=C1COC2=C1C=CC=C2 CS20787 [0,1,0,1,0,0|0,0,2]=4 1883 B11R2.1 O=C1CSC2=C1C=CC=C2 CS20606 [0,1,0,1,0,0|0,0,2]=4 1884 B11R2.1 O=C1NCC2=CC=CC=C12 CS11515 [0,1,0,1,0,0|0,0,2]=4 1885 B11R2.1 O=C1OCC2=CC=CC=C12 CS11853 [0,1,0,1,0,0|0,0,2]=4 1886 B11R2.1 OC1=NOC2=C1C=CC=C2 MC442249 [0,1,0,1,0,0|1,0,1]=4 1887 B11R2.1 OC1CCC2=CC=CN=C21 CS10573 [0,1,0,1,0,0|1,0,0]=3 1888 B11R2.1 ON1N=NC2=C1C=CC=C2 CS19338 [0,1,0,1,0,0|2,0,0]=4 1889 B11R2.1 ON1N=NC2=C1C=CC=C2 CS22993 [0,1,0,1,0,0|2,0,0]=4 1890 B11R2.40 BrC1(C2=NC=CC=C2)CC1 MC431657 [0,1,0,1,0,0|2,0,0]=4 1891 B11R2.40 NC1(C2=CC=CC=C2)CC1 MC425296 [0,1,0,1,0,0|1,0,0]=3 1892 B11R2.40 NC1(C2=NC=CC=C2)CC1 MC115574 [0,1,0,1,0,0|2,0,0]=4 1893 B11R2.55 BrC1=NC=CC=C1C2CC2 CS16928 [0,1,0,1,0,0|2,0,0]=4 1894 B11R2.55 ClC1=C(C2CO2)C=CC=C1 MC427453 [0,1,0,1,0,0|0,0,0]=2 1895 B11R2.55 ClC1=NC=CC=C1C2CC2 MC430628 [0,1,0,1,0,0|2,0,0]=4 1896 B11R2.55 NC1=C(C2CC2)C=NC=C1 CS17282 [0,1,0,1,0,0|2,0,0]=4 1897 B11R2.35 BrC1=CC(C2CC2)=CN=C1 MC442247 [0,1,0,1,0,0|2,0,0]=4 1898 B11R2.35 BrC1=CC=CC(C2CO2)=C1 MC111470 [0,1,0,1,0,0|0,0,0]=2 1899 B11R2.35 BrC1=NC(C2CC2)=CC=C1 MC442245 [0,1,0,1,0,0|2,0,0]=4 1900 B11R2.35 ClC1=CC=CC(C2CO2)=C1 MC42002 [0,1,0,1,0,0|0,0,0]=2 1901 B7R1.1 BrCC1=CC=CS1 MC111260 [1,0,0,0,1,0|2,0,0]=4 1902 B7R1.1 BrCC1=COC=C1 MC111404 [1,0,0,0,1,0|2,0,0]=4 1903 B7R1.1 CCC1=NC=CN1 CS21533 [1,0,0,0,1,0|2,0,0]=4 1904 B7R1.1 CCN1C=CC=N1 CS20681 [1,0,0,0,1,0|2,0,0]=4 1905 B7R1.1 COC1=CSC=C1 CS22351 [1,0,0,0,1,0|2,0,0]=4 1906 B7R1.1 ClCC1=CC=CO1 CS13429 [1,0,0,0,1,0|2,0,0]=4 1907 B7R1.1 NCC1=CC=CN1 CS14874 [1,0,0,0,1,0|2,0,0]=4 1908 B7R1.1 NCC1=CC=CO1 MC41689 [1,0,0,0,1,0|2,0,0]=4 1909 B7R1.1 NCC1=CC=CS1 CS22783 [1,0,0,0,1,0|2,0,0]=4 1910 B7R1.1 NCC1=CSC=C1 CS22417 [1,0,0,0,1,0|2,0,0]=4 1911 B7R1.1 OCC1=CC=CO1 MC41687 [1,0,0,0,1,0|1,0,0]=3 1912 B7R1.1 OCC1=CC=NO1 CS15343 [1,0,0,0,1,0|2,0,0]=4 1913 B7R1.1 OCC1=CN=CS1 CS16191 [1,0,0,0,1,0|2,0,0]=4 1914 B7R1.1 OCC1=CNN=C1 CS20094 [1,0,0,0,1,0|2,0,0]=4 1915 B7R1.1 OCC1=COC=C1 CS22303 [1,0,0,0,1,0|1,0,0]=3 1916 B7R1.1 OCC1=CON=C1 MC104808 [1,0,0,0,1,0|2,0,0]=4 1917 B7R1.1 OCC1=CSC=C1 CS18039 [1,0,0,0,1,0|1,0,0]=3 1918 B7R1.1 OCC1=CSC=N1 CS22892 [1,0,0,0,1,0|2,0,0]=4 1919 B7R1.1 OCC1=NC=CS1 MC113802 [1,0,0,0,1,0|2,0,0]=4 1920 B7R1.1 OCN1C=CC=N1 CS11902 [1,0,0,0,1,0|2,0,0]=4 1921 B11R1.91 CC(=O)COC1=CC=CC=C1 MC433248 [0,0,0,0,0,2|0,0,2]=4 1922 B11R1.91 CN(C)CCC1=CC=CC=C1 MC446671 [0,0,0,0,0,2|2,0,0]=4 1923 B11R1.91 O=C(O)C#CC1=CC=CC=C1 CS10957 [0,0,0,0,0,2|1,0,1]=4 1924 B11R1.91 O=C(O)CNc1ccccc1 MC439073 [0,0,0,0,0,2|1,0,1]=4 1925 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 MC40211 [0,0,0,0,0,2|1,0,1]=4 1926 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 MC442565 [0,0,0,0,0,2|2,0,0]=4