0 B7R1.3 BrC1=CC=CC=C1 MC41456 [0,0,0,0,0,0|2,0,0]=2 1 B7R1.3 BrC1=CC=CN=C1 CS19218 [0,0,0,0,0,0|3,0,0]=3 2 B7R1.3 BrC1=CC=NC=C1 CS13376 [0,0,0,0,0,0|1,0,0]=1 3 B7R1.3 BrC1=CN=CN=C1 CS22560 [0,0,0,0,0,0|4,0,0]=4 4 B7R1.3 BrC1=CN=NC=C1 MC427110 [0,0,0,0,0,0|2,0,0]=2 5 B7R1.3 BrC1=NC=CC=C1 CS17815 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.3 BrC1=NC=CC=N1 CS13369 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.3 BrC1=NC=CN=C1 CS15000 [0,0,0,0,0,0|4,0,0]=4 8 B7R1.3 BrC1=NC=NC=C1 MC106563 [0,0,0,0,0,0|2,0,0]=2 9 B7R1.3 CC1=CC=CN=C1 MC107850 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.3 CC1=CC=CN=N1 CS22374 [0,0,0,0,0,0|4,0,0]=4 11 B7R1.3 CC1=CC=NC=C1 MC31239 [0,0,0,0,0,0|1,0,0]=1 12 B7R1.3 CC1=CC=NC=C1 MC41625 [0,0,0,0,0,0|1,0,0]=1 13 B7R1.3 CC1=CN=CN=C1 CS18851 [0,0,0,0,0,0|4,0,0]=4 14 B7R1.3 CC1=CN=NC=C1 CS22983 [0,0,0,0,0,0|2,0,0]=2 15 B7R1.3 CC1=NC=CC=C1 MC41623 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.3 CC1=NC=NC=C1 CS19795 [0,0,0,0,0,0|2,0,0]=2 17 B7R1.3 C[N+]1=CC=CC=C1 CS17683 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 ClC1=CC=CC=C1 MC41469 [0,0,0,0,0,0|2,0,0]=2 19 B7R1.3 ClC1=CC=CN=N1 MC444264 [0,0,0,0,0,0|4,0,0]=4 20 B7R1.3 ClC1=CC=NC=C1 CS13378 [0,0,0,0,0,0|1,0,0]=1 21 B7R1.3 ClC1=CN=CN=C1 CS15471 [0,0,0,0,0,0|4,0,0]=4 22 B7R1.3 ClC1=CN=NC=C1 MC427202 [0,0,0,0,0,0|2,0,0]=2 23 B7R1.3 ClC1=NC=CC=C1 MC20672 [0,0,0,0,0,0|3,0,0]=3 24 B7R1.3 ClC1=NC=CC=N1 MC10446 [0,0,0,0,0,0|4,0,0]=4 25 B7R1.3 ClC1=NC=CN=C1 CS15454 [0,0,0,0,0,0|4,0,0]=4 26 B7R1.3 ClC1=NC=NC=C1 MC444346 [0,0,0,0,0,0|2,0,0]=2 27 B7R1.3 FC1=CC=CC=C1 MC41489 [0,0,0,0,0,0|2,0,0]=2 28 B7R1.3 FC1=CC=CN=C1 MC20006 [0,0,0,0,0,0|3,0,0]=3 29 B7R1.3 FC1=CC=NC=C1 MC429573 [0,0,0,0,0,0|1,0,0]=1 30 B7R1.3 FC1=CC=NC=C1 MC433050 [0,0,0,0,0,0|1,0,0]=1 31 B7R1.3 FC1=NC=CC=C1 MC20005 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 FC1=NC=CC=N1 MC429402 [0,0,0,0,0,0|4,0,0]=4 33 B7R1.3 FC1=NC=CN=C1 MC33147 [0,0,0,0,0,0|4,0,0]=4 34 B7R1.3 F[N+]1=CC=CC=C1 MC426120 [0,0,0,0,0,0|3,0,0]=3 35 B7R1.3 F[N+]1=CC=CC=C1 MC429468 [0,0,0,0,0,0|3,0,0]=3 36 B7R1.3 IC1=CC=CC=C1 CS19958 [0,0,0,0,0,0|2,0,0]=2 37 B7R1.3 IC1=CN=CN=C1 CS12325 [0,0,0,0,0,0|4,0,0]=4 38 B7R1.3 IC1=NC=CC=C1 CS14565 [0,0,0,0,0,0|3,0,0]=3 39 B7R1.3 IC1=NC=CC=N1 CS14968 [0,0,0,0,0,0|4,0,0]=4 40 B7R1.3 IC1=NC=CN=C1 MC425096 [0,0,0,0,0,0|4,0,0]=4 41 B7R1.3 IC1=NC=NC=C1 MC442584 [0,0,0,0,0,0|2,0,0]=2 42 B7R1.3 NC1=CC=CC=C1 MC40851 [0,0,0,0,0,0|1,0,0]=1 43 B7R1.3 NC1=CC=CN=C1 CS19073 [0,0,0,0,0,0|2,0,0]=2 44 B7R1.3 NC1=CC=CN=N1 CS18539 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.3 NC1=CC=CN=N1 CS19775 [0,0,0,0,0,0|3,0,0]=3 46 B7R1.3 NC1=CC=NC=C1 MC20017 [0,0,0,0,0,0|0,0,0]=0 47 B7R1.3 NC1=CN=CN=C1 CS18383 [0,0,0,0,0,0|3,0,0]=3 48 B7R1.3 NC1=CN=NC=C1 CS18154 [0,0,0,0,0,0|1,0,0]=1 49 B7R1.3 NC1=NC=CC=C1 MC41600 [0,0,0,0,0,0|2,0,0]=2 50 B7R1.3 NC1=NC=CC=N1 CS13370 [0,0,0,0,0,0|3,0,0]=3 51 B7R1.3 NC1=NC=CN=C1 CS16102 [0,0,0,0,0,0|3,0,0]=3 52 B7R1.3 NC1=NC=NC=C1 CS19707 [0,0,0,0,0,0|1,0,0]=1 53 B7R1.3 O=C1C=CC=CN1 CS18724 [0,0,0,0,0,0|3,0,0]=3 54 B7R1.3 O=C1C=CC=NN1 CS19793 [0,0,0,0,0,0|4,0,0]=4 55 B7R1.3 O=C1C=CCCC1 MC41883 [0,0,0,0,0,0|2,0,2]=4 56 B7R1.3 O=C1C=CCCN1 CS15771 [0,0,0,0,0,0|3,0,1]=4 57 B7R1.3 O=C1C=CCOC1 CS17023 [0,0,0,0,0,0|3,0,1]=4 58 B7R1.3 O=C1C=CN=CN1 CS19105 [0,0,0,0,0,0|2,0,0]=2 59 B7R1.3 O=C1C=CNN=C1 MC427203 [0,0,0,0,0,0|2,0,1]=3 60 B7R1.3 OC1=CC=CC=C1 MC41210 [0,0,0,0,0,0|2,0,0]=2 61 B7R1.3 OC1=CC=CN=C1 CS17813 [0,0,0,0,0,0|3,0,0]=3 62 B7R1.3 OC1=CC=NC=C1 CS19216 [0,0,0,0,0,0|1,0,0]=1 63 B7R1.3 OC1=CN=CN=C1 CS10407 [0,0,0,0,0,0|4,0,0]=4 64 B7R1.3 OC1=CN=NC=C1 CS17666 [0,0,0,0,0,0|2,0,0]=2 65 B7R1.3 OC1=NC=CC=C1 CS21602 [0,0,0,0,0,0|3,0,0]=3 66 B7R1.3 OC1=NC=CC=N1 CS14246 [0,0,0,0,0,0|4,0,0]=4 67 B7R1.3 OC1=NC=CC=N1 CS16090 [0,0,0,0,0,0|4,0,0]=4 68 B7R1.3 OC1=NC=CC=N1 MC41651 [0,0,0,0,0,0|4,0,0]=4 69 B7R1.3 OC1=NC=CN=C1 CS21601 [0,0,0,0,0,0|4,0,0]=4 70 B7R1.3 OC1=NC=NC=C1 CS15728 [0,0,0,0,0,0|2,0,0]=2 71 B7R1.3 PC1=CC=CC=C1 MC444841 [0,0,0,0,0,0|1,1,0]=2 72 B7R1.3 [S-]C1=CC=CC=C1 MC41417 [0,0,0,0,0,0|2,0,0]=2 73 B6R1.1 C1=CC=NC=C1 CS19760 [1,0,0,0,0,0|0,0,0]=1 74 B6R1.1 C1=CC=NC=C1 MC21088 [1,0,0,0,0,0|0,0,0]=1 75 B6R1.1 C1=CC=NC=C1 MC32204 [1,0,0,0,0,0|0,0,0]=1 76 B6R1.1 C1=CC=NC=C1 MC41630 [1,0,0,0,0,0|0,0,0]=1 77 B6R1.1 C1=CC=[NH+]C=C1 MC20763 [1,0,0,0,0,0|0,0,1]=2 78 B6R1.1 C1=CN=CC=N1 MC20792 [1,0,0,0,0,0|1,0,0]=2 79 B6R1.1 C1=CN=NC=C1 CS11905 [1,0,0,0,0,0|1,0,0]=2 80 B6R1.1 C1=NC=NC=N1 CS20497 [1,0,0,0,0,0|2,0,0]=3 81 B6R1.1 c1ccccc1 MC444977 [1,0,0,0,0,0|1,0,0]=2 82 B8R1.2 BrCC1=CC=NC=C1 CS22459 [0,1,0,0,0,0|1,0,0]=2 83 B8R1.2 BrCC1=CC=NC=C1 MC111773 [0,1,0,0,0,0|1,0,0]=2 84 B8R1.2 Br[Mg]c1cccnc1 MC121318 [0,1,0,0,0,0|3,0,0]=4 85 B8R1.2 Br[Zn]c1ccccn1 MC121328 [0,1,0,0,0,0|3,0,0]=4 86 B8R1.2 Br[Zn]c1cccnc1 MC121329 [0,1,0,0,0,0|3,0,0]=4 87 B8R1.2 C#CC1=CC=CC=C1 CS19127 [0,1,0,0,0,0|2,0,0]=3 88 B8R1.2 C#CC1=CC=NC=C1 CS22825 [0,1,0,0,0,0|1,0,0]=2 89 B8R1.2 C#CC1=NC=CC=C1 CS21539 [0,1,0,0,0,0|3,0,0]=4 90 B8R1.2 CCC1=CC=CC=C1 MC41556 [0,1,0,0,0,0|2,0,0]=3 91 B8R1.2 CCC1=CC=CN=C1 CS22277 [0,1,0,0,0,0|3,0,0]=4 92 B8R1.2 CNC1=CC=CC=C1 CS11792 [0,1,0,0,0,0|1,0,0]=2 93 B8R1.2 CNC1=CC=CN=C1 CS13856 [0,1,0,0,0,0|2,0,0]=3 94 B8R1.2 CNC1=CC=NC=C1 MC41620 [0,1,0,0,0,0|0,0,0]=1 95 B8R1.2 COC1=CC=CC=C1 MC41309 [0,1,0,0,0,0|2,0,0]=3 96 B8R1.2 COC1=CC=CN=C1 CS22348 [0,1,0,0,0,0|3,0,0]=4 97 B8R1.2 COC1=CC=NC=C1 CS19206 [0,1,0,0,0,0|1,0,0]=2 98 B8R1.2 COC1=CN=NC=C1 MC427243 [0,1,0,0,0,0|2,0,0]=3 99 B8R1.2 COC1=NC=CC=C1 CS18780 [0,1,0,0,0,0|3,0,0]=4 100 B8R1.2 CSC1=CC=CC=C1 MC439137 [0,1,0,0,0,0|2,0,0]=3 101 B8R1.2 CSC1=NC=CC=C1 MC41628 [0,1,0,0,0,0|3,0,0]=4 102 B8R1.2 ClCC1=CC=CN=C1 CS19291 [0,1,0,0,0,0|3,0,0]=4 103 B8R1.2 ClCC1=NC=CC=C1 CS19289 [0,1,0,0,0,0|3,0,0]=4 104 B8R1.2 ICC1=CC=CC=C1 CS11000 [0,1,0,0,0,0|2,0,0]=3 105 B8R1.2 ICC1=CC=CN=C1 MC430640 [0,1,0,0,0,0|3,0,0]=4 106 B8R1.2 I[Zn]c1ccccc1 MC121332 [0,1,0,0,0,0|2,0,0]=3 107 B8R1.2 N#CC1=CC=CC=C1 MC40623 [0,1,0,0,0,0|1,0,1]=3 108 B8R1.2 N#CC1=CC=NC=C1 MC427074 [0,1,0,0,0,0|0,0,1]=2 109 B8R1.2 N#CC1=CN=CC=C1 CS22263 [0,1,0,0,0,0|2,0,1]=4 110 B8R1.2 N#CC1=CN=NC=C1 MC444348 [0,1,0,0,0,0|1,0,1]=3 111 B8R1.2 N#CC1=NC=CC=C1 CS19642 [0,1,0,0,0,0|2,0,1]=4 112 B8R1.2 N#CC1=NC=NC=C1 CS12430 [0,1,0,0,0,0|1,0,1]=3 113 B8R1.2 N#Cc1ccccc1 CS13696 [0,1,0,0,0,0|1,0,1]=3 114 B8R1.2 NCC1=CC=CC=C1 MC40797 [0,1,0,0,0,0|1,0,0]=2 115 B8R1.2 NCC1=CC=CN=C1 CS14226 [0,1,0,0,0,0|2,0,0]=3 116 B8R1.2 NCC1=CC=CN=N1 MC444234 [0,1,0,0,0,0|3,0,0]=4 117 B8R1.2 NCC1=CC=NC=C1 CS11906 [0,1,0,0,0,0|0,0,0]=1 118 B8R1.2 NCC1=CC=NC=C1 CS19023 [0,1,0,0,0,0|0,0,0]=1 119 B8R1.2 NCC1=CN=CN=C1 MC444384 [0,1,0,0,0,0|3,0,0]=4 120 B8R1.2 NCC1=CN=NC=C1 CS15014 [0,1,0,0,0,0|1,0,0]=2 121 B8R1.2 NCC1=CN=NC=C1 CS15515 [0,1,0,0,0,0|1,0,0]=2 122 B8R1.2 NCC1=CN=NC=C1 MC444324 [0,1,0,0,0,0|1,0,0]=2 123 B8R1.2 NCC1=NC=CC=N1 CS21304 [0,1,0,0,0,0|3,0,0]=4 124 B8R1.2 NCC1=NC=CC=N1 MC425460 [0,1,0,0,0,0|3,0,0]=4 125 B8R1.2 NCC1=NC=CN=C1 CS19691 [0,1,0,0,0,0|3,0,0]=4 126 B8R1.2 NCC1=NC=CN=C1 CS20245 [0,1,0,0,0,0|3,0,0]=4 127 B8R1.2 NCC1=NC=NC=C1 MC444325 [0,1,0,0,0,0|1,0,0]=2 128 B8R1.2 NNC1=CC=CC=C1 CS15210 [0,1,0,0,0,0|1,0,0]=2 129 B8R1.2 NNC1=CC=CC=C1 MC427075 [0,1,0,0,0,0|1,0,0]=2 130 B8R1.2 NNC1=CC=CN=C1 CS15491 [0,1,0,0,0,0|2,0,0]=3 131 B8R1.2 NNC1=CC=CN=C1 CS22308 [0,1,0,0,0,0|2,0,0]=3 132 B8R1.2 NNC1=CC=NC=C1 MC20777 [0,1,0,0,0,0|0,0,0]=1 133 B8R1.2 NNC1=CN=CN=C1 MC104575 [0,1,0,0,0,0|3,0,0]=4 134 B8R1.2 NNC1=NC=CC=C1 CS15589 [0,1,0,0,0,0|2,0,0]=3 135 B8R1.2 NNC1=NC=CC=C1 CS21573 [0,1,0,0,0,0|2,0,0]=3 136 B8R1.2 NNC1=NC=CC=N1 MC425172 [0,1,0,0,0,0|3,0,0]=4 137 B8R1.2 NNC1=NC=CN=C1 MC444188 [0,1,0,0,0,0|3,0,0]=4 138 B8R1.2 O=CC1=CN=CC=C1 CS19090 [0,1,0,0,0,0|3,0,0]=4 139 B8R1.2 O=CC1=CN=NC=C1 MC444362 [0,1,0,0,0,0|2,0,0]=3 140 B8R1.2 O=CC1=NC=CC=C1 CS18610 [0,1,0,0,0,0|3,0,0]=4 141 B8R1.2 O=NC1=CC=CC=C1 MC33163 [0,1,0,0,0,0|1,0,1]=3 142 B8R1.2 OCC1=CC=CC=C1 MC40684 [0,1,0,0,0,0|2,0,0]=3 143 B8R1.2 OCC1=CC=CN=C1 CS22409 [0,1,0,0,0,0|3,0,0]=4 144 B8R1.2 OCC1=CC=NC=C1 CS19163 [0,1,0,0,0,0|1,0,0]=2 145 B8R1.2 OCC1=CN=NC=C1 MC444363 [0,1,0,0,0,0|2,0,0]=3 146 B8R1.2 OCC1=NC=CC=C1 CS19164 [0,1,0,0,0,0|3,0,0]=4 147 B8R1.2 OCC1=NC=NC=C1 CS11915 [0,1,0,0,0,0|2,0,0]=3 148 B8R1.3 BrC1=CC=C(Br)C=C1 MC41477 [0,1,0,0,0,0|2,0,0]=3 149 B8R1.3 BrC1=CC=C(I)C=C1 CS22911 [0,1,0,0,0,0|2,0,0]=3 150 B8R1.3 BrC1=CN=C(Br)C=C1 CS21792 [0,1,0,0,0,0|3,0,0]=4 151 B8R1.3 BrC1=CN=C(I)C=C1 CS22029 [0,1,0,0,0,0|3,0,0]=4 152 B8R1.3 BrC1=NC=C(I)C=C1 CS15803 [0,1,0,0,0,0|3,0,0]=4 153 B8R1.3 CC1=CC=C(Br)C=C1 MC20922 [0,1,0,0,0,0|2,0,0]=3 154 B8R1.3 CC1=CC=C(C)C=C1 MC41551 [0,1,0,0,0,0|2,0,0]=3 155 B8R1.3 CC1=CC=C(F)C=C1 MC41520 [0,1,0,0,0,0|2,0,0]=3 156 B8R1.3 CC1=CC=C(I)C=C1 MC445763 [0,1,0,0,0,0|2,0,0]=3 157 B8R1.3 CC1=CC=C(N)C=C1 CS11898 [0,1,0,0,0,0|1,0,0]=2 158 B8R1.3 CC1=CC=C(N)C=N1 CS19519 [0,1,0,0,0,0|2,0,0]=3 159 B8R1.3 CC1=CC=C(N)N=N1 MC444230 [0,1,0,0,0,0|3,0,0]=4 160 B8R1.3 CC1=CC=C(O)C=C1 MC41204 [0,1,0,0,0,0|2,0,0]=3 161 B8R1.3 CC1=CC=C(O)C=N1 CS19501 [0,1,0,0,0,0|3,0,0]=4 162 B8R1.3 CC1=CC=C([S-])C=C1 MC112796 [0,1,0,0,0,0|2,0,0]=3 163 B8R1.3 CC1=CN=C(Br)C=C1 CS21837 [0,1,0,0,0,0|3,0,0]=4 164 B8R1.3 CC1=CN=C(C)C=C1 CS21154 [0,1,0,0,0,0|3,0,0]=4 165 B8R1.3 CC1=CN=C(Cl)C=C1 CS19287 [0,1,0,0,0,0|3,0,0]=4 166 B8R1.3 CC1=CN=C(F)C=C1 CS21872 [0,1,0,0,0,0|3,0,0]=4 167 B8R1.3 CC1=CN=C(N)C=C1 CS21820 [0,1,0,0,0,0|2,0,0]=3 168 B8R1.3 CC1=CN=C(N)C=N1 CS18361 [0,1,0,0,0,0|3,0,0]=4 169 B8R1.3 CC1=CN=C(N)N=C1 CS21761 [0,1,0,0,0,0|3,0,0]=4 170 B8R1.3 CC1=CN=C(O)C=C1 CS16275 [0,1,0,0,0,0|3,0,0]=4 171 B8R1.3 CC1=CNC(=O)C=C1 CS21591 [0,1,0,0,0,0|3,0,0]=4 172 B8R1.3 CC1=NC=C(Br)C=C1 CS22031 [0,1,0,0,0,0|3,0,0]=4 173 B8R1.3 CC1=NC=C(F)C=C1 MC433052 [0,1,0,0,0,0|3,0,0]=4 174 B8R1.3 CC1=NC=C(I)C=C1 MC20376 [0,1,0,0,0,0|3,0,0]=4 175 B8R1.3 CC1=NC=C(N)C=N1 CS14284 [0,1,0,0,0,0|3,0,0]=4 176 B8R1.3 ClC1=CC=C(Br)C=C1 CS22677 [0,1,0,0,0,0|2,0,0]=3 177 B8R1.3 ClC1=CC=C(I)C=C1 CS19235 [0,1,0,0,0,0|2,0,0]=3 178 B8R1.3 ClC1=CN=C(Br)C=C1 CS17275 [0,1,0,0,0,0|3,0,0]=4 179 B8R1.3 ClC1=CN=C(Cl)C=C1 CS13779 [0,1,0,0,0,0|3,0,0]=4 180 B8R1.3 ClC1=CN=C(I)C=C1 CS18901 [0,1,0,0,0,0|3,0,0]=4 181 B8R1.3 ClC1=NC=C(Br)C=C1 CS14919 [0,1,0,0,0,0|3,0,0]=4 182 B8R1.3 ClC1=NC=C(I)C=C1 CS17315 [0,1,0,0,0,0|3,0,0]=4 183 B8R1.3 FC1=CC=C(Br)C=C1 MC20092 [0,1,0,0,0,0|2,0,0]=3 184 B8R1.3 FC1=CC=C(Cl)C=C1 CS20666 [0,1,0,0,0,0|2,0,0]=3 185 B8R1.3 FC1=CC=C(F)C=C1 MC41485 [0,1,0,0,0,0|2,0,0]=3 186 B8R1.3 FC1=CC=C(I)C=C1 CS22840 [0,1,0,0,0,0|2,0,0]=3 187 B8R1.3 FC1=CC=C(S)C=C1 MC20299 [0,1,0,0,0,0|2,0,0]=3 188 B8R1.3 FC1=CN=C(Br)C=C1 CS21836 [0,1,0,0,0,0|3,0,0]=4 189 B8R1.3 FC1=CN=C(Cl)C=C1 CS21851 [0,1,0,0,0,0|3,0,0]=4 190 B8R1.3 FC1=CN=C(I)C=C1 CS10383 [0,1,0,0,0,0|3,0,0]=4 191 B8R1.3 FC1=NC=C(Br)C=C1 CS22028 [0,1,0,0,0,0|3,0,0]=4 192 B8R1.3 FC1=NC=C(Cl)C=C1 CS17313 [0,1,0,0,0,0|3,0,0]=4 193 B8R1.3 FC1=NC=C(I)C=C1 CS17371 [0,1,0,0,0,0|3,0,0]=4 194 B8R1.3 IC1=CC=C(I)C=C1 CS19213 [0,1,0,0,0,0|2,0,0]=3 195 B8R1.3 NC1=CC=C(Br)C=C1 MC40858 [0,1,0,0,0,0|1,0,0]=2 196 B8R1.3 NC1=CC=C(Br)C=C1 MC40859 [0,1,0,0,0,0|1,0,0]=2 197 B8R1.3 NC1=CC=C(Br)N=C1 CS21910 [0,1,0,0,0,0|2,0,0]=3 198 B8R1.3 NC1=CC=C(Br)N=N1 CS10641 [0,1,0,0,0,0|3,0,0]=4 199 B8R1.3 NC1=CC=C(Cl)C=C1 CS18588 [0,1,0,0,0,0|1,0,0]=2 200 B8R1.3 NC1=CC=C(Cl)N=C1 CS21849 [0,1,0,0,0,0|2,0,0]=3 201 B8R1.3 NC1=CC=C(Cl)N=N1 CS15607 [0,1,0,0,0,0|3,0,0]=4 202 B8R1.3 NC1=CC=C(F)C=C1 CS19763 [0,1,0,0,0,0|1,0,0]=2 203 B8R1.3 NC1=CC=C(F)N=C1 CS22740 [0,1,0,0,0,0|2,0,0]=3 204 B8R1.3 NC1=CC=C(F)N=N1 CS17801 [0,1,0,0,0,0|3,0,0]=4 205 B8R1.3 NC1=CC=C(N)C=C1 CS18589 [0,1,0,0,0,0|1,0,0]=2 206 B8R1.3 NC1=CC=C(N)N=N1 CS12076 [0,1,0,0,0,0|3,0,0]=4 207 B8R1.3 NC1=CC=C(O)C=C1 MC41146 [0,1,0,0,0,0|1,0,0]=2 208 B8R1.3 NC1=CC=C(O)C=N1 CS13087 [0,1,0,0,0,0|2,0,0]=3 209 B8R1.3 NC1=CC=C(O)C=N1 CS18367 [0,1,0,0,0,0|2,0,0]=3 210 B8R1.3 NC1=CC=C(S)C=C1 MC20109 [0,1,0,0,0,0|1,0,0]=2 211 B8R1.3 NC1=CN=C(Br)N=C1 CS21412 [0,1,0,0,0,0|3,0,0]=4 212 B8R1.3 NC1=CN=C(Cl)N=C1 CS15662 [0,1,0,0,0,0|3,0,0]=4 213 B8R1.3 NC1=CN=C(F)N=C1 MC431546 [0,1,0,0,0,0|3,0,0]=4 214 B8R1.3 NC1=CN=C(N)C=C1 CS15186 [0,1,0,0,0,0|2,0,0]=3 215 B8R1.3 NC1=CN=C(N)N=C1 CS19880 [0,1,0,0,0,0|3,0,0]=4 216 B8R1.3 NC1=CN=C(O)C=C1 CS10211 [0,1,0,0,0,0|2,0,0]=3 217 B8R1.3 NC1=CN=C(O)C=C1 CS18129 [0,1,0,0,0,0|2,0,0]=3 218 B8R1.3 NC1=CN=C(O)N=C1 MC444379 [0,1,0,0,0,0|3,0,0]=4 219 B8R1.3 NC1=CNC(=O)C=C1 CS15177 [0,1,0,0,0,0|2,0,0]=3 220 B8R1.3 NC1=NC=C(Br)C=C1 CS21813 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.3 NC1=NC=C(Br)C=N1 CS21814 [0,1,0,0,0,0|3,0,0]=4 222 B8R1.3 NC1=NC=C(Br)N=C1 CS15187 [0,1,0,0,0,0|3,0,0]=4 223 B8R1.3 NC1=NC=C(Cl)C=C1 CS21816 [0,1,0,0,0,0|2,0,0]=3 224 B8R1.3 NC1=NC=C(Cl)C=N1 CS15629 [0,1,0,0,0,0|3,0,0]=4 225 B8R1.3 NC1=NC=C(Cl)N=C1 CS18243 [0,1,0,0,0,0|3,0,0]=4 226 B8R1.3 NC1=NC=C(F)C=C1 CS21818 [0,1,0,0,0,0|2,0,0]=3 227 B8R1.3 NC1=NC=C(F)C=N1 CS21760 [0,1,0,0,0,0|3,0,0]=4 228 B8R1.3 NC1=NC=C(I)C=C1 CS17736 [0,1,0,0,0,0|2,0,0]=3 229 B8R1.3 NC1=NC=C(O)C=N1 CS17222 [0,1,0,0,0,0|3,0,0]=4 230 B8R1.3 O=C1C=CC(=O)C=C1 CS20528 [0,1,0,0,0,0|2,0,0]=3 231 B8R1.3 O=C1C=CC(O)=CN1 CS15928 [0,1,0,0,0,0|3,0,0]=4 232 B8R1.3 OC1=CC=C(Br)C=C1 MC41163 [0,1,0,0,0,0|2,0,0]=3 233 B8R1.3 OC1=CC=C(Br)N=C1 CS14988 [0,1,0,0,0,0|3,0,0]=4 234 B8R1.3 OC1=CC=C(Cl)C=C1 CS22792 [0,1,0,0,0,0|2,0,0]=3 235 B8R1.3 OC1=CC=C(Cl)N=C1 CS21853 [0,1,0,0,0,0|3,0,0]=4 236 B8R1.3 OC1=CC=C(F)C=C1 MC41198 [0,1,0,0,0,0|2,0,0]=3 237 B8R1.3 OC1=CC=C(F)N=C1 CS14991 [0,1,0,0,0,0|3,0,0]=4 238 B8R1.3 OC1=CC=C(I)C=C1 MC20152 [0,1,0,0,0,0|2,0,0]=3 239 B8R1.3 OC1=CC=C(I)N=C1 MC107165 [0,1,0,0,0,0|3,0,0]=4 240 B8R1.3 OC1=CC=C(O)C=C1 MC41215 [0,1,0,0,0,0|2,0,0]=3 241 B8R1.3 OC1=CN=C(O)C=C1 CS21147 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.3 OC1=NC=C(Br)C=C1 CS22706 [0,1,0,0,0,0|3,0,0]=4 243 B8R1.3 OC1=NC=C(F)C=C1 MC429397 [0,1,0,0,0,0|3,0,0]=4 244 B8R1.3 OC1=NC=C(I)C=C1 CS13623 [0,1,0,0,0,0|3,0,0]=4 245 B8R1.3 SC1=CC=C(Br)C=C1 MC20198 [0,1,0,0,0,0|2,0,0]=3 246 B8R1.3 [O-][N+]1=CC=C(Br)C=C1 CS22699 [0,1,0,0,0,0|1,0,1]=3 247 B8R1.4 BrC1=CC(Br)=NC=C1 CS15110 [0,1,0,0,0,0|1,0,0]=2 248 B8R1.4 BrC1=CC(Br)=NC=N1 CS22500 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.4 BrC1=CC(I)=CC=C1 MC433479 [0,1,0,0,0,0|2,0,0]=3 250 B8R1.4 BrC1=CC(I)=CN=C1 CS13981 [0,1,0,0,0,0|3,0,0]=4 251 B8R1.4 BrC1=CC=CC(Br)=C1 CS19814 [0,1,0,0,0,0|2,0,0]=3 252 B8R1.4 BrC1=CC=CC(Br)=N1 CS21793 [0,1,0,0,0,0|3,0,0]=4 253 B8R1.4 BrC1=CN=CC(Br)=C1 CS21896 [0,1,0,0,0,0|3,0,0]=4 254 B8R1.4 BrC1=CN=NC(Br)=C1 MC33339 [0,1,0,0,0,0|2,0,0]=3 255 B8R1.4 BrC1=NC(Br)=NC=C1 CS10554 [0,1,0,0,0,0|2,0,0]=3 256 B8R1.4 BrC1=NC=CC(I)=C1 CS17279 [0,1,0,0,0,0|1,0,0]=2 257 B8R1.4 CC1=CC(=O)NN=C1 CS10446 [0,1,0,0,0,0|2,0,1]=4 258 B8R1.4 CC1=CC(Br)=NC=C1 CS19246 [0,1,0,0,0,0|1,0,0]=2 259 B8R1.4 CC1=CC(Br)=NC=N1 CS13070 [0,1,0,0,0,0|2,0,0]=3 260 B8R1.4 CC1=CC(C)=NC=N1 CS19849 [0,1,0,0,0,0|2,0,0]=3 261 B8R1.4 CC1=CC(Cl)=CC=C1 MC41511 [0,1,0,0,0,0|2,0,0]=3 262 B8R1.4 CC1=CC(Cl)=NC=C1 CS23009 [0,1,0,0,0,0|1,0,0]=2 263 B8R1.4 CC1=CC(Cl)=NC=N1 CS22963 [0,1,0,0,0,0|2,0,0]=3 264 B8R1.4 CC1=CC(F)=NC=C1 CS21868 [0,1,0,0,0,0|1,0,0]=2 265 B8R1.4 CC1=CC(N)=NC=C1 CS15630 [0,1,0,0,0,0|1,0,0]=2 266 B8R1.4 CC1=CC(N)=NC=N1 CS12473 [0,1,0,0,0,0|1,0,0]=2 267 B8R1.4 CC1=CC(O)=NC=C1 CS23034 [0,1,0,0,0,0|1,0,0]=2 268 B8R1.4 CC1=CC(O)=NC=N1 CS19796 [0,1,0,0,0,0|2,0,0]=3 269 B8R1.4 CC1=CC=CC(=O)N1 CS19499 [0,1,0,0,0,0|3,0,0]=4 270 B8R1.4 CC1=CC=CC(Br)=C1 CS19957 [0,1,0,0,0,0|2,0,0]=3 271 B8R1.4 CC1=CC=CC(Br)=N1 CS21841 [0,1,0,0,0,0|3,0,0]=4 272 B8R1.4 CC1=CC=CC(C)=C1 MC41550 [0,1,0,0,0,0|2,0,0]=3 273 B8R1.4 CC1=CC=CC(C)=N1 CS18597 [0,1,0,0,0,0|3,0,0]=4 274 B8R1.4 CC1=CC=CC(Cl)=N1 CS23010 [0,1,0,0,0,0|3,0,0]=4 275 B8R1.4 CC1=CC=CC(F)=C1 CS19910 [0,1,0,0,0,0|2,0,0]=3 276 B8R1.4 CC1=CC=CC(F)=N1 CS19330 [0,1,0,0,0,0|3,0,0]=4 277 B8R1.4 CC1=CC=CC(I)=C1 CS19968 [0,1,0,0,0,0|2,0,0]=3 278 B8R1.4 CC1=CC=CC(I)=N1 MC443163 [0,1,0,0,0,0|3,0,0]=4 279 B8R1.4 CC1=CC=CC(N)=C1 CS11698 [0,1,0,0,0,0|1,0,0]=2 280 B8R1.4 CC1=CC=CC(N)=N1 CS18078 [0,1,0,0,0,0|2,0,0]=3 281 B8R1.4 CC1=CC=CC(O)=C1 MC41203 [0,1,0,0,0,0|2,0,0]=3 282 B8R1.4 CC1=CC=CC(S)=C1 MC41411 [0,1,0,0,0,0|2,0,0]=3 283 B8R1.4 CC1=CC=C[N+]([O-])=C1 MC41624 [0,1,0,0,0,0|3,0,0]=4 284 B8R1.4 CC1=CN=CC(Br)=C1 CS19250 [0,1,0,0,0,0|3,0,0]=4 285 B8R1.4 CC1=CN=CC(Cl)=C1 CS13884 [0,1,0,0,0,0|3,0,0]=4 286 B8R1.4 CC1=CN=CC(F)=C1 CS19335 [0,1,0,0,0,0|3,0,0]=4 287 B8R1.4 CC1=CN=CC(I)=C1 MC429681 [0,1,0,0,0,0|3,0,0]=4 288 B8R1.4 CC1=CN=CC(N)=C1 CS14172 [0,1,0,0,0,0|2,0,0]=3 289 B8R1.4 CC1=CN=CC(N)=N1 CS21294 [0,1,0,0,0,0|3,0,0]=4 290 B8R1.4 CC1=CN=CC(O)=C1 CS14332 [0,1,0,0,0,0|3,0,0]=4 291 B8R1.4 CC1=CN=NC(C)=C1 MC41672 [0,1,0,0,0,0|2,0,0]=3 292 B8R1.4 CC1=CN=NC(Cl)=C1 MC444261 [0,1,0,0,0,0|2,0,0]=3 293 B8R1.4 CC1=CN=NC(N)=C1 MC427168 [0,1,0,0,0,0|2,0,0]=3 294 B8R1.4 CC1=NC(Br)=NC=C1 CS17649 [0,1,0,0,0,0|2,0,0]=3 295 B8R1.4 CC1=NC(Cl)=NC=C1 CS13591 [0,1,0,0,0,0|2,0,0]=3 296 B8R1.4 CC1=NC(O)=NC=C1 CS21586 [0,1,0,0,0,0|2,0,0]=3 297 B8R1.4 CC1=NC=CC(=O)N1 CS22425 [0,1,0,0,0,0|2,0,0]=3 298 B8R1.4 CC1=NC=CC(Br)=C1 CS13967 [0,1,0,0,0,0|1,0,0]=2 299 B8R1.4 CC1=NC=CC(Cl)=C1 CS14214 [0,1,0,0,0,0|1,0,0]=2 300 B8R1.4 CC1=NC=CC(Cl)=N1 CS22751 [0,1,0,0,0,0|2,0,0]=3 301 B8R1.4 CC1=NC=CC(F)=C1 CS15882 [0,1,0,0,0,0|1,0,0]=2 302 B8R1.4 CC1=NC=CC(I)=C1 CS22899 [0,1,0,0,0,0|1,0,0]=2 303 B8R1.4 CC1=NC=CC(N)=C1 CS19520 [0,1,0,0,0,0|0,0,0]=1 304 B8R1.4 CC1=NC=CC(N)=N1 CS13322 [0,1,0,0,0,0|1,0,0]=2 305 B8R1.4 CC1=NC=CC(O)=C1 CS22867 [0,1,0,0,0,0|1,0,0]=2 306 B8R1.4 CC1=NC=CC(O)=N1 CS15583 [0,1,0,0,0,0|2,0,0]=3 307 B8R1.4 ClC1=CC(Br)=NC=C1 CS13973 [0,1,0,0,0,0|1,0,0]=2 308 B8R1.4 ClC1=CC(Br)=NC=N1 MC442087 [0,1,0,0,0,0|2,0,0]=3 309 B8R1.4 ClC1=CC(Cl)=NC=C1 CS17291 [0,1,0,0,0,0|1,0,0]=2 310 B8R1.4 ClC1=CC(Cl)=NC=N1 CS21954 [0,1,0,0,0,0|2,0,0]=3 311 B8R1.4 ClC1=CC(I)=CC=C1 CS20663 [0,1,0,0,0,0|2,0,0]=3 312 B8R1.4 ClC1=CC(I)=NC=C1 CS15413 [0,1,0,0,0,0|1,0,0]=2 313 B8R1.4 ClC1=CC=CC(Br)=C1 CS22170 [0,1,0,0,0,0|2,0,0]=3 314 B8R1.4 ClC1=CC=CC(Br)=N1 CS14668 [0,1,0,0,0,0|3,0,0]=4 315 B8R1.4 ClC1=CC=CC(Cl)=N1 CS18899 [0,1,0,0,0,0|3,0,0]=4 316 B8R1.4 ClC1=CN=CC(Br)=C1 CS15808 [0,1,0,0,0,0|3,0,0]=4 317 B8R1.4 ClC1=CN=CC(Cl)=C1 CS14008 [0,1,0,0,0,0|3,0,0]=4 318 B8R1.4 ClC1=CN=NC(Cl)=C1 CS21984 [0,1,0,0,0,0|2,0,0]=3 319 B8R1.4 ClC1=NC(Cl)=NC=C1 CS22557 [0,1,0,0,0,0|2,0,0]=3 320 B8R1.4 ClC1=NC(I)=CC=C1 MC41607 [0,1,0,0,0,0|3,0,0]=4 321 B8R1.4 ClC1=NC=CC(Br)=C1 CS21986 [0,1,0,0,0,0|1,0,0]=2 322 B8R1.4 ClC1=NC=CC(Br)=N1 MC21047 [0,1,0,0,0,0|2,0,0]=3 323 B8R1.4 ClC1=NC=CC(I)=C1 CS22695 [0,1,0,0,0,0|1,0,0]=2 324 B8R1.4 ClC1=NC=NC(Cl)=N1 CS18930 [0,1,0,0,0,0|3,0,0]=4 325 B8R1.4 ClC1=NC=NC(I)=C1 MC442088 [0,1,0,0,0,0|2,0,0]=3 326 B8R1.4 FC1=CC(Br)=CN=C1 CS22034 [0,1,0,0,0,0|3,0,0]=4 327 B8R1.4 FC1=CC(Br)=NC=C1 CS14190 [0,1,0,0,0,0|1,0,0]=2 328 B8R1.4 FC1=CC(Cl)=NC=C1 CS17300 [0,1,0,0,0,0|1,0,0]=2 329 B8R1.4 FC1=CC(F)=NC=C1 CS19909 [0,1,0,0,0,0|1,0,0]=2 330 B8R1.4 FC1=CC(F)=NC=N1 MC41646 [0,1,0,0,0,0|2,0,0]=3 331 B8R1.4 FC1=CC(I)=CC=C1 CS18882 [0,1,0,0,0,0|2,0,0]=3 332 B8R1.4 FC1=CC(I)=CN=C1 CS18467 [0,1,0,0,0,0|3,0,0]=4 333 B8R1.4 FC1=CC=CC(Br)=C1 MC41467 [0,1,0,0,0,0|2,0,0]=3 334 B8R1.4 FC1=CC=CC(Br)=N1 CS13708 [0,1,0,0,0,0|3,0,0]=4 335 B8R1.4 FC1=CC=CC(Cl)=C1 MC41473 [0,1,0,0,0,0|2,0,0]=3 336 B8R1.4 FC1=CC=CC(Cl)=N1 CS18859 [0,1,0,0,0,0|3,0,0]=4 337 B8R1.4 FC1=CC=CC(F)=N1 CS18752 [0,1,0,0,0,0|3,0,0]=4 338 B8R1.4 FC1=CC=CC(S)=C1 MC20298 [0,1,0,0,0,0|2,0,0]=3 339 B8R1.4 FC1=CN=CC(Cl)=C1 CS19936 [0,1,0,0,0,0|3,0,0]=4 340 B8R1.4 FC1=CN=CC(F)=C1 CS13374 [0,1,0,0,0,0|3,0,0]=4 341 B8R1.4 FC1=NC(Br)=CC=C1 MC429392 [0,1,0,0,0,0|3,0,0]=4 342 B8R1.4 FC1=NC(Cl)=NC=C1 MC429933 [0,1,0,0,0,0|2,0,0]=3 343 B8R1.4 FC1=NC(F)=NC=C1 MC429251 [0,1,0,0,0,0|2,0,0]=3 344 B8R1.4 FC1=NC=CC(Br)=C1 CS17277 [0,1,0,0,0,0|1,0,0]=2 345 B8R1.4 FC1=NC=CC(Cl)=C1 CS14178 [0,1,0,0,0,0|1,0,0]=2 346 B8R1.4 FC1=NC=CC(I)=C1 CS13375 [0,1,0,0,0,0|1,0,0]=2 347 B8R1.4 IC1=CC=CC(I)=C1 MC433521 [0,1,0,0,0,0|2,0,0]=3 348 B8R1.4 IC1=CC=CC(I)=N1 CS18354 [0,1,0,0,0,0|3,0,0]=4 349 B8R1.4 NC1=CC(=O)NN=C1 MC104083 [0,1,0,0,0,0|1,0,1]=3 350 B8R1.4 NC1=CC(Br)=CC=C1 CS19169 [0,1,0,0,0,0|1,0,0]=2 351 B8R1.4 NC1=CC(Br)=CN=C1 CS22730 [0,1,0,0,0,0|2,0,0]=3 352 B8R1.4 NC1=CC(Br)=CN=N1 MC103242 [0,1,0,0,0,0|2,0,0]=3 353 B8R1.4 NC1=CC(Br)=NC=C1 CS21962 [0,1,0,0,0,0|0,0,0]=1 354 B8R1.4 NC1=CC(Br)=NC=C1 MC425916 [0,1,0,0,0,0|0,0,0]=1 355 B8R1.4 NC1=CC(Cl)=CC=C1 CS22234 [0,1,0,0,0,0|1,0,0]=2 356 B8R1.4 NC1=CC(Cl)=CN=C1 MC31090 [0,1,0,0,0,0|2,0,0]=3 357 B8R1.4 NC1=CC(Cl)=CN=C1 MC442692 [0,1,0,0,0,0|2,0,0]=3 358 B8R1.4 NC1=CC(Cl)=CN=N1 MC103570 [0,1,0,0,0,0|2,0,0]=3 359 B8R1.4 NC1=CC(Cl)=NC=C1 CS21964 [0,1,0,0,0,0|0,0,0]=1 360 B8R1.4 NC1=CC(F)=CC=C1 CS19913 [0,1,0,0,0,0|1,0,0]=2 361 B8R1.4 NC1=CC(F)=CN=C1 CS13934 [0,1,0,0,0,0|2,0,0]=3 362 B8R1.4 NC1=CC(F)=NC=C1 CS13865 [0,1,0,0,0,0|0,0,0]=1 363 B8R1.4 NC1=CC(I)=CC=C1 CS19215 [0,1,0,0,0,0|1,0,0]=2 364 B8R1.4 NC1=CC(I)=CN=C1 MC431279 [0,1,0,0,0,0|2,0,0]=3 365 B8R1.4 NC1=CC(N)=NC=C1 CS11909 [0,1,0,0,0,0|0,0,0]=1 366 B8R1.4 NC1=CC(N)=NC=N1 MC425881 [0,1,0,0,0,0|1,0,0]=2 367 B8R1.4 NC1=CC(O)=NC=C1 CS18280 [0,1,0,0,0,0|0,0,0]=1 368 B8R1.4 NC1=CC(O)=NC=C1 MC41598 [0,1,0,0,0,0|0,0,0]=1 369 B8R1.4 NC1=CC=CC(=O)N1 CS22760 [0,1,0,0,0,0|2,0,0]=3 370 B8R1.4 NC1=CC=CC(N)=C1 MC40944 [0,1,0,0,0,0|1,0,0]=2 371 B8R1.4 NC1=CC=CC(N)=N1 CS13686 [0,1,0,0,0,0|2,0,0]=3 372 B8R1.4 NC1=CC=CC(O)=C1 MC41145 [0,1,0,0,0,0|1,0,0]=2 373 B8R1.4 NC1=CC=NC(=O)N1 MC114510 [0,1,0,0,0,0|1,0,0]=2 374 B8R1.4 NC1=CN=CC(F)=C1 MC430057 [0,1,0,0,0,0|2,0,0]=3 375 B8R1.4 NC1=CN=CC(N)=C1 CS21958 [0,1,0,0,0,0|2,0,0]=3 376 B8R1.4 NC1=CN=CC(N)=N1 CS15121 [0,1,0,0,0,0|3,0,0]=4 377 B8R1.4 NC1=CN=CC(N)=N1 MC100335 [0,1,0,0,0,0|3,0,0]=4 378 B8R1.4 NC1=CN=CC(O)=C1 CS12372 [0,1,0,0,0,0|2,0,0]=3 379 B8R1.4 NC1=CN=CC(O)=C1 CS22080 [0,1,0,0,0,0|2,0,0]=3 380 B8R1.4 NC1=CN=NC(Br)=C1 MC116221 [0,1,0,0,0,0|1,0,0]=2 381 B8R1.4 NC1=CN=NC(Cl)=C1 CS13017 [0,1,0,0,0,0|1,0,0]=2 382 B8R1.4 NC1=NC(=O)NC=C1 CS22211 [0,1,0,0,0,0|1,0,1]=3 383 B8R1.4 NC1=NC(=O)NC=N1 CS22023 [0,1,0,0,0,0|2,0,1]=4 384 B8R1.4 NC1=NC(Br)=CC=C1 CS17641 [0,1,0,0,0,0|2,0,0]=3 385 B8R1.4 NC1=NC(Br)=NC=C1 MC442843 [0,1,0,0,0,0|1,0,0]=2 386 B8R1.4 NC1=NC(Cl)=CC=C1 CS17675 [0,1,0,0,0,0|2,0,0]=3 387 B8R1.4 NC1=NC(Cl)=CN=C1 MC20457 [0,1,0,0,0,0|3,0,0]=4 388 B8R1.4 NC1=NC(Cl)=NC=C1 CS22581 [0,1,0,0,0,0|1,0,0]=2 389 B8R1.4 NC1=NC(F)=CC=C1 CS17727 [0,1,0,0,0,0|2,0,0]=3 390 B8R1.4 NC1=NC(N)=NC=C1 CS22603 [0,1,0,0,0,0|1,0,0]=2 391 B8R1.4 NC1=NC=CC(=O)N1 MC426017 [0,1,0,0,0,0|2,0,0]=3 392 B8R1.4 NC1=NC=CC(Br)=C1 CS16114 [0,1,0,0,0,0|1,0,0]=2 393 B8R1.4 NC1=NC=CC(Br)=N1 MC442842 [0,1,0,0,0,0|2,0,0]=3 394 B8R1.4 NC1=NC=CC(Cl)=C1 CS17669 [0,1,0,0,0,0|1,0,0]=2 395 B8R1.4 NC1=NC=CC(Cl)=N1 CS15619 [0,1,0,0,0,0|2,0,0]=3 396 B8R1.4 NC1=NC=CC(F)=C1 CS21251 [0,1,0,0,0,0|1,0,0]=2 397 B8R1.4 NC1=NC=CC(F)=N1 MC104377 [0,1,0,0,0,0|2,0,0]=3 398 B8R1.4 NC1=NC=CC(I)=C1 MC425094 [0,1,0,0,0,0|1,0,0]=2 399 B8R1.4 NC1=NC=CC(I)=N1 CS12109 [0,1,0,0,0,0|2,0,0]=3 400 B8R1.4 NC1=NC=CC(O)=C1 CS14161 [0,1,0,0,0,0|1,0,0]=2 401 B8R1.4 NC1=NC=NC(Br)=C1 CS12354 [0,1,0,0,0,0|1,0,0]=2 402 B8R1.4 NC1=NC=NC(Cl)=C1 CS15652 [0,1,0,0,0,0|1,0,0]=2 403 B8R1.4 NC1=NC=NC(I)=C1 CS12484 [0,1,0,0,0,0|1,0,0]=2 404 B8R1.4 NC1=NC=NC(O)=C1 CS22588 [0,1,0,0,0,0|1,0,0]=2 405 B8R1.4 O=C1C=C(Cl)C=NN1 CS12688 [0,1,0,0,0,0|2,0,1]=4 406 B8R1.4 O=C1C=C(I)C=CN1 CS22900 [0,1,0,0,0,0|1,0,1]=3 407 B8R1.4 O=C1C=C(I)C=NN1 CS12955 [0,1,0,0,0,0|2,0,1]=4 408 B8R1.4 O=C1C=C(O)C=CN1 CS19356 [0,1,0,0,0,0|1,0,1]=3 409 B8R1.4 O=C1C=CC=C(Cl)N1 CS10672 [0,1,0,0,0,0|3,0,0]=4 410 B8R1.4 O=C1C=CNC(=O)N1 CS19249 [0,1,0,0,0,0|2,0,1]=4 411 B8R1.4 O=C1N=CNC(=O)N1 MC111110 [0,1,0,0,0,0|3,0,0]=4 412 B8R1.4 OC1=CC(Br)=CC=C1 CS15169 [0,1,0,0,0,0|2,0,0]=3 413 B8R1.4 OC1=CC(Br)=CN=C1 CS17456 [0,1,0,0,0,0|3,0,0]=4 414 B8R1.4 OC1=CC(Br)=NC=C1 CS14221 [0,1,0,0,0,0|1,0,0]=2 415 B8R1.4 OC1=CC(Cl)=CC=C1 CS19764 [0,1,0,0,0,0|2,0,0]=3 416 B8R1.4 OC1=CC(Cl)=NC=C1 CS22712 [0,1,0,0,0,0|1,0,0]=2 417 B8R1.4 OC1=CC(F)=CC=C1 CS19021 [0,1,0,0,0,0|2,0,0]=3 418 B8R1.4 OC1=CC(F)=CN=C1 CS13932 [0,1,0,0,0,0|3,0,0]=4 419 B8R1.4 OC1=CC(I)=CC=C1 CS19969 [0,1,0,0,0,0|2,0,0]=3 420 B8R1.4 OC1=CC(O)=NC=N1 CS15744 [0,1,0,0,0,0|2,0,0]=3 421 B8R1.4 OC1=CC=CC(S)=C1 MC20381 [0,1,0,0,0,0|2,0,0]=3 422 B8R1.4 OC1=CN=CC(Cl)=C1 MC41606 [0,1,0,0,0,0|3,0,0]=4 423 B8R1.4 OC1=CN=CC(O)=C1 CS21992 [0,1,0,0,0,0|3,0,0]=4 424 B8R1.4 OC1=CN=NC(Cl)=C1 MC107685 [0,1,0,0,0,0|2,0,0]=3 425 B8R1.4 OC1=NC(Br)=CC=C1 CS14076 [0,1,0,0,0,0|3,0,0]=4 426 B8R1.4 OC1=NC(Cl)=NC=C1 MC442755 [0,1,0,0,0,0|2,0,0]=3 427 B8R1.4 OC1=NC=CC(Br)=C1 CS14220 [0,1,0,0,0,0|1,0,0]=2 428 B8R1.4 OC1=NC=CC(Cl)=C1 CS18294 [0,1,0,0,0,0|1,0,0]=2 429 B8R1.4 OC1=NC=CC(F)=C1 CS21583 [0,1,0,0,0,0|1,0,0]=2 430 B8R1.4 OC1=NC=NC(Br)=C1 CS14406 [0,1,0,0,0,0|2,0,0]=3 431 B8R1.4 OC1=NC=NC(Cl)=C1 CS22568 [0,1,0,0,0,0|2,0,0]=3 432 B8R1.4 [O-][N+]1=CC(Cl)=CC=C1 MC442468 [0,1,0,0,0,0|3,0,0]=4 433 B8R1.4 [O-][N+]1=CC(F)=CC=C1 MC433049 [0,1,0,0,0,0|3,0,0]=4 434 B8R1.5 BrC1=C(Br)C=CC=C1 CS19765 [0,1,0,0,0,0|2,0,0]=3 435 B8R1.5 BrC1=C(Br)C=NC=C1 CS13628 [0,1,0,0,0,0|1,0,0]=2 436 B8R1.5 BrC1=C(I)C=CC=C1 CS19157 [0,1,0,0,0,0|2,0,0]=3 437 B8R1.5 BrC1=CC=CN=C1Br CS22670 [0,1,0,0,0,0|3,0,0]=4 438 B8R1.5 BrC1=NC=CC=C1I MC110926 [0,1,0,0,0,0|3,0,0]=4 439 B8R1.5 CC1=C(Br)C=CC=C1 MC20187 [0,1,0,0,0,0|2,0,0]=3 440 B8R1.5 CC1=C(Br)C=CN=C1 CS13416 [0,1,0,0,0,0|1,0,0]=2 441 B8R1.5 CC1=C(Br)C=NC=C1 CS21916 [0,1,0,0,0,0|1,0,0]=2 442 B8R1.5 CC1=C(Cl)C=CC=C1 CS20009 [0,1,0,0,0,0|2,0,0]=3 443 B8R1.5 CC1=C(Cl)C=CN=C1 CS18038 [0,1,0,0,0,0|1,0,0]=2 444 B8R1.5 CC1=C(Cl)C=NC=C1 CS15751 [0,1,0,0,0,0|1,0,0]=2 445 B8R1.5 CC1=C(Cl)N=NC=C1 MC444260 [0,1,0,0,0,0|2,0,0]=3 446 B8R1.5 CC1=C(F)C=CC=C1 MC41519 [0,1,0,0,0,0|2,0,0]=3 447 B8R1.5 CC1=C(F)C=CN=C1 MC433051 [0,1,0,0,0,0|1,0,0]=2 448 B8R1.5 CC1=C(F)C=NC=C1 CS19332 [0,1,0,0,0,0|1,0,0]=2 449 B8R1.5 CC1=C(I)C=CC=C1 CS19198 [0,1,0,0,0,0|2,0,0]=3 450 B8R1.5 CC1=C(N)C=CN=C1 CS19521 [0,1,0,0,0,0|0,0,0]=1 451 B8R1.5 CC1=C(N)C=NC=C1 CS21907 [0,1,0,0,0,0|1,0,0]=2 452 B8R1.5 CC1=C(O)C=CN=C1 CS13965 [0,1,0,0,0,0|1,0,0]=2 453 B8R1.5 CC1=C(O)C=NC=C1 CS22316 [0,1,0,0,0,0|1,0,0]=2 454 B8R1.5 CC1=CC=CC=C1C MC41549 [0,1,0,0,0,0|2,0,0]=3 455 B8R1.5 CC1=CC=CC=C1N CS20592 [0,1,0,0,0,0|1,0,0]=2 456 B8R1.5 CC1=CC=CC=C1O CS11813 [0,1,0,0,0,0|2,0,0]=3 457 B8R1.5 CC1=CC=CN=C1Br CS23002 [0,1,0,0,0,0|3,0,0]=4 458 B8R1.5 CC1=CC=CN=C1C CS21050 [0,1,0,0,0,0|3,0,0]=4 459 B8R1.5 CC1=CC=CN=C1Cl CS13857 [0,1,0,0,0,0|3,0,0]=4 460 B8R1.5 CC1=CC=CN=C1F CS19328 [0,1,0,0,0,0|3,0,0]=4 461 B8R1.5 CC1=CC=CN=C1N CS13775 [0,1,0,0,0,0|2,0,0]=3 462 B8R1.5 CC1=CC=CN=C1O CS19498 [0,1,0,0,0,0|3,0,0]=4 463 B8R1.5 CC1=CN=CN=C1Br CS12572 [0,1,0,0,0,0|2,0,0]=3 464 B8R1.5 CC1=CN=CN=C1Cl CS19938 [0,1,0,0,0,0|2,0,0]=3 465 B8R1.5 CC1=CN=CN=C1N CS12501 [0,1,0,0,0,0|1,0,0]=2 466 B8R1.5 CC1=CN=CN=C1O CS10459 [0,1,0,0,0,0|2,0,0]=3 467 B8R1.5 CC1=NC=CC=C1Br MC20012 [0,1,0,0,0,0|3,0,0]=4 468 B8R1.5 CC1=NC=CC=C1Cl MC425470 [0,1,0,0,0,0|3,0,0]=4 469 B8R1.5 CC1=NC=CC=C1F CS19850 [0,1,0,0,0,0|3,0,0]=4 470 B8R1.5 CC1=NC=CC=C1N CS19518 [0,1,0,0,0,0|2,0,0]=3 471 B8R1.5 CC1=NC=CC=C1O MC20374 [0,1,0,0,0,0|3,0,0]=4 472 B8R1.5 CC1=NC=CN=C1N CS21232 [0,1,0,0,0,0|3,0,0]=4 473 B8R1.5 CC1=NC=NC=C1Br CS11920 [0,1,0,0,0,0|2,0,0]=3 474 B8R1.5 CC1=NC=NC=C1I CS12766 [0,1,0,0,0,0|2,0,0]=3 475 B8R1.5 CC1=NC=NC=C1N CS19908 [0,1,0,0,0,0|2,0,0]=3 476 B8R1.5 C[N+]1=C(Cl)C=CC=C1 CS19467 [0,1,0,0,0,0|3,0,0]=4 477 B8R1.5 ClC1=C(Br)C=CC=C1 CS21391 [0,1,0,0,0,0|2,0,0]=3 478 B8R1.5 ClC1=C(Br)C=CN=C1 CS15809 [0,1,0,0,0,0|1,0,0]=2 479 B8R1.5 ClC1=C(Cl)C=CC=C1 MC41478 [0,1,0,0,0,0|2,0,0]=3 480 B8R1.5 ClC1=C(Cl)C=NC=C1 CS14992 [0,1,0,0,0,0|1,0,0]=2 481 B8R1.5 ClC1=C(Cl)N=NC=C1 MC102217 [0,1,0,0,0,0|2,0,0]=3 482 B8R1.5 ClC1=C(I)C=CN=C1 CS17639 [0,1,0,0,0,0|1,0,0]=2 483 B8R1.5 ClC1=C(I)C=CN=C1 CS19993 [0,1,0,0,0,0|1,0,0]=2 484 B8R1.5 ClC1=C(I)C=NC=C1 CS17640 [0,1,0,0,0,0|1,0,0]=2 485 B8R1.5 ClC1=CC=CN=C1Br CS17272 [0,1,0,0,0,0|3,0,0]=4 486 B8R1.5 ClC1=CC=CN=C1Cl CS13373 [0,1,0,0,0,0|3,0,0]=4 487 B8R1.5 ClC1=NC=CC=C1Br CS22671 [0,1,0,0,0,0|3,0,0]=4 488 B8R1.5 ClC1=NC=CC=C1I CS22694 [0,1,0,0,0,0|3,0,0]=4 489 B8R1.5 ClC1=NC=NC=C1Br CS22769 [0,1,0,0,0,0|2,0,0]=3 490 B8R1.5 ClC1=NC=NC=C1I CS19722 [0,1,0,0,0,0|2,0,0]=3 491 B8R1.5 FC1=C(Br)C=CC=C1 CS19658 [0,1,0,0,0,0|2,0,0]=3 492 B8R1.5 FC1=C(Br)C=CN=C1 MC429590 [0,1,0,0,0,0|1,0,0]=2 493 B8R1.5 FC1=C(Br)C=NC=C1 CS13534 [0,1,0,0,0,0|1,0,0]=2 494 B8R1.5 FC1=C(Cl)C=CC=C1 MC429398 [0,1,0,0,0,0|2,0,0]=3 495 B8R1.5 FC1=C(Cl)C=CN=C1 MC429592 [0,1,0,0,0,0|1,0,0]=2 496 B8R1.5 FC1=C(F)C=CC=C1 CS20490 [0,1,0,0,0,0|2,0,0]=3 497 B8R1.5 FC1=C(F)C=NC=C1 MC431362 [0,1,0,0,0,0|1,0,0]=2 498 B8R1.5 FC1=C(I)C=CC=C1 MC429560 [0,1,0,0,0,0|2,0,0]=3 499 B8R1.5 FC1=C(I)C=CN=C1 CS18172 [0,1,0,0,0,0|1,0,0]=2 500 B8R1.5 FC1=C(S)C=CC=C1 MC429404 [0,1,0,0,0,0|2,0,0]=3 501 B8R1.5 FC1=CC=CN=C1Br CS14296 [0,1,0,0,0,0|3,0,0]=4 502 B8R1.5 FC1=CC=CN=C1Cl CS17308 [0,1,0,0,0,0|3,0,0]=4 503 B8R1.5 FC1=CC=CN=C1F CS18753 [0,1,0,0,0,0|3,0,0]=4 504 B8R1.5 FC1=CN=CN=C1Cl CS11918 [0,1,0,0,0,0|2,0,0]=3 505 B8R1.5 FC1=NC=CC=C1Br CS14198 [0,1,0,0,0,0|3,0,0]=4 506 B8R1.5 FC1=NC=CC=C1Cl CS18743 [0,1,0,0,0,0|3,0,0]=4 507 B8R1.5 FC1=NC=CC=C1I CS21866 [0,1,0,0,0,0|3,0,0]=4 508 B8R1.5 IC1=C(I)C=CC=C1 MC41488 [0,1,0,0,0,0|2,0,0]=3 509 B8R1.5 NC1=C(Br)C=CC=C1 CS19197 [0,1,0,0,0,0|1,0,0]=2 510 B8R1.5 NC1=C(Br)C=CN=C1 CS13987 [0,1,0,0,0,0|1,0,0]=2 511 B8R1.5 NC1=C(Br)C=NC=C1 CS21968 [0,1,0,0,0,0|0,0,0]=1 512 B8R1.5 NC1=C(Cl)C=CC=C1 CS19766 [0,1,0,0,0,0|1,0,0]=2 513 B8R1.5 NC1=C(Cl)C=CN=C1 CS22737 [0,1,0,0,0,0|1,0,0]=2 514 B8R1.5 NC1=C(Cl)C=NC=C1 CS13897 [0,1,0,0,0,0|0,0,0]=1 515 B8R1.5 NC1=C(F)C=CC=C1 MC40915 [0,1,0,0,0,0|1,0,0]=2 516 B8R1.5 NC1=C(F)C=CN=C1 MC106328 [0,1,0,0,0,0|1,0,0]=2 517 B8R1.5 NC1=C(F)C=NC=C1 CS13971 [0,1,0,0,0,0|0,0,0]=1 518 B8R1.5 NC1=C(I)C=CC=C1 CS23020 [0,1,0,0,0,0|1,0,0]=2 519 B8R1.5 NC1=C(I)C=CN=C1 CS17808 [0,1,0,0,0,0|1,0,0]=2 520 B8R1.5 NC1=C(I)C=NC=C1 CS18532 [0,1,0,0,0,0|0,0,0]=1 521 B8R1.5 NC1=C(N)C=NC=C1 CS22778 [0,1,0,0,0,0|0,0,0]=1 522 B8R1.5 NC1=C(O)C=CC=C1 CS21309 [0,1,0,0,0,0|1,0,0]=2 523 B8R1.5 NC1=C(O)C=CN=C1 MC427456 [0,1,0,0,0,0|1,0,0]=2 524 B8R1.5 NC1=C(O)C=NC=C1 CS14741 [0,1,0,0,0,0|0,0,0]=1 525 B8R1.5 NC1=C(S)C=CC=C1 MC41400 [0,1,0,0,0,0|1,0,0]=2 526 B8R1.5 NC1=C(S)C=CN=C1 MC427552 [0,1,0,0,0,0|1,0,0]=2 527 B8R1.5 NC1=C(S)C=NC=C1 MC427410 [0,1,0,0,0,0|0,0,0]=1 528 B8R1.5 NC1=CC=CC=C1N CS11822 [0,1,0,0,0,0|1,0,0]=2 529 B8R1.5 NC1=CC=CN=C1Br CS22729 [0,1,0,0,0,0|2,0,0]=3 530 B8R1.5 NC1=CC=CN=C1Cl CS17686 [0,1,0,0,0,0|2,0,0]=3 531 B8R1.5 NC1=CC=CN=C1F CS22742 [0,1,0,0,0,0|2,0,0]=3 532 B8R1.5 NC1=CC=CN=C1I CS18159 [0,1,0,0,0,0|2,0,0]=3 533 B8R1.5 NC1=CC=CN=C1N CS21785 [0,1,0,0,0,0|2,0,0]=3 534 B8R1.5 NC1=CC=CNC1=O CS15503 [0,1,0,0,0,0|2,0,0]=3 535 B8R1.5 NC1=CC=CNC1=S CS20821 [0,1,0,0,0,0|2,0,0]=3 536 B8R1.5 NC1=CC=NNC1=O CS15772 [0,1,0,0,0,0|1,0,0]=2 537 B8R1.5 NC1=CN=CN=C1Br CS12371 [0,1,0,0,0,0|2,0,0]=3 538 B8R1.5 NC1=CN=CN=C1Cl CS10217 [0,1,0,0,0,0|2,0,0]=3 539 B8R1.5 NC1=CN=CN=C1N MC10418 [0,1,0,0,0,0|1,0,0]=2 540 B8R1.5 NC1=CN=NC=C1Br MC116352 [0,1,0,0,0,0|1,0,0]=2 541 B8R1.5 NC1=NC=CC=C1Br CS17634 [0,1,0,0,0,0|2,0,0]=3 542 B8R1.5 NC1=NC=CC=C1Cl CS17664 [0,1,0,0,0,0|2,0,0]=3 543 B8R1.5 NC1=NC=CC=C1F CS13951 [0,1,0,0,0,0|2,0,0]=3 544 B8R1.5 NC1=NC=CC=C1I CS13464 [0,1,0,0,0,0|2,0,0]=3 545 B8R1.5 NC1=NC=CC=C1O CS22765 [0,1,0,0,0,0|2,0,0]=3 546 B8R1.5 NC1=NC=CC=C1S MC110834 [0,1,0,0,0,0|2,0,0]=3 547 B8R1.5 NC1=NC=CN=C1Br CS21229 [0,1,0,0,0,0|3,0,0]=4 548 B8R1.5 NC1=NC=CN=C1Cl CS18423 [0,1,0,0,0,0|3,0,0]=4 549 B8R1.5 NC1=NC=CN=C1I CS12456 [0,1,0,0,0,0|3,0,0]=4 550 B8R1.5 NC1=NC=CN=C1O CS21231 [0,1,0,0,0,0|3,0,0]=4 551 B8R1.5 NC1=NC=NC=C1Br CS18005 [0,1,0,0,0,0|1,0,0]=2 552 B8R1.5 NC1=NC=NC=C1Cl CS12255 [0,1,0,0,0,0|1,0,0]=2 553 B8R1.5 NC1=NC=NC=C1F CS12828 [0,1,0,0,0,0|1,0,0]=2 554 B8R1.5 NC1=NC=NC=C1O CS16658 [0,1,0,0,0,0|1,0,0]=2 555 B8R1.5 O=C1C=COC=C1O CS16007 [0,1,0,0,0,0|2,0,0]=3 556 B8R1.5 O=C1N=CNC=C1Br CS10567 [0,1,0,0,0,0|2,0,1]=4 557 B8R1.5 O=C1N=CNC=C1Br CS12515 [0,1,0,0,0,0|2,0,1]=4 558 B8R1.5 O=C1NC=CC=C1Cl CS13621 [0,1,0,0,0,0|3,0,0]=4 559 B8R1.5 O=C1NC=CC=C1F CS13754 [0,1,0,0,0,0|3,0,0]=4 560 B8R1.5 O=C1NC=CC=C1I CS16075 [0,1,0,0,0,0|3,0,0]=4 561 B8R1.5 O=C1NC=CC=C1O CS22752 [0,1,0,0,0,0|3,0,0]=4 562 B8R1.5 O=C1NC=NC=C1O CS15721 [0,1,0,0,0,0|2,0,0]=3 563 B8R1.5 O=C1NN=CC=C1Cl CS15942 [0,1,0,0,0,0|2,0,0]=3 564 B8R1.5 O=C1OC=CC=C1O CS22311 [0,1,0,0,0,0|3,0,0]=4 565 B8R1.5 OC1=C(Br)C=CC=C1 CS19429 [0,1,0,0,0,0|2,0,0]=3 566 B8R1.5 OC1=C(Br)C=CN=C1 CS13781 [0,1,0,0,0,0|1,0,0]=2 567 B8R1.5 OC1=C(Br)C=NC=C1 CS14222 [0,1,0,0,0,0|1,0,0]=2 568 B8R1.5 OC1=C(Cl)C=CC=C1 MC41174 [0,1,0,0,0,0|2,0,0]=3 569 B8R1.5 OC1=C(Cl)C=CN=C1 CS16383 [0,1,0,0,0,0|1,0,0]=2 570 B8R1.5 OC1=C(Cl)C=NC=C1 CS16225 [0,1,0,0,0,0|1,0,0]=2 571 B8R1.5 OC1=C(F)C=CC=C1 MC20096 [0,1,0,0,0,0|2,0,0]=3 572 B8R1.5 OC1=C(F)C=NC=C1 CS22284 [0,1,0,0,0,0|1,0,0]=2 573 B8R1.5 OC1=C(I)C=CC=C1 MC20193 [0,1,0,0,0,0|2,0,0]=3 574 B8R1.5 OC1=C(I)C=CN=C1 CS12130 [0,1,0,0,0,0|1,0,0]=2 575 B8R1.5 OC1=C(I)C=NC=C1 MC425611 [0,1,0,0,0,0|1,0,0]=2 576 B8R1.5 OC1=CC=CC=C1O CS11109 [0,1,0,0,0,0|2,0,0]=3 577 B8R1.5 OC1=CC=CN=C1Br CS17449 [0,1,0,0,0,0|3,0,0]=4 578 B8R1.5 OC1=CC=CN=C1Cl CS17508 [0,1,0,0,0,0|3,0,0]=4 579 B8R1.5 OC1=CC=CN=C1F CS13836 [0,1,0,0,0,0|3,0,0]=4 580 B8R1.5 OC1=CC=CN=C1I CS14294 [0,1,0,0,0,0|3,0,0]=4 581 B8R1.5 OC1=NC=CC=C1Br CS18703 [0,1,0,0,0,0|3,0,0]=4 582 B8R1.5 OC1=NC=NC=C1F CS22574 [0,1,0,0,0,0|2,0,0]=3 583 B8R1.5 OC1=NC=NC=C1I CS12263 [0,1,0,0,0,0|2,0,0]=3 584 B8R1.5 SC1=C(I)C=CC=C1 MC41410 [0,1,0,0,0,0|2,0,0]=3 585 B8R1.5 [O-][N+]1=C(Cl)C=CC=C1 MC427271 [0,1,0,0,0,0|3,0,0]=4 586 B8R1.5 [O-][N+]1=C(O)C=CC=C1 CS21603 [0,1,0,0,0,0|3,0,0]=4 587 B6R0.4 C=C\C=C\C(=O)O CS12033 [0,0,1,0,0,0|3,0,0]=4 588 B8R2.34 C1=CC2C=CC1C2 MC445000 [0,0,0,1,0,0|2,0,1]=4 589 B6R1.2 BrC1=CC=CS1 CS21414 [0,0,0,0,1,0|2,0,0]=3 590 B6R1.2 BrC1=CC=C[Se]1 MC114898 [0,0,0,0,1,0|2,0,0]=3 591 B6R1.2 BrC1=CC=NN1 CS17757 [0,0,0,0,1,0|2,0,0]=3 592 B6R1.2 BrC1=CN=CO1 MC105695 [0,0,0,0,1,0|2,0,0]=3 593 B6R1.2 BrC1=CN=CS1 CS14114 [0,0,0,0,1,0|2,0,0]=3 594 B6R1.2 BrC1=CNC=N1 CS14270 [0,0,0,0,1,0|2,0,1]=4 595 B6R1.2 BrC1=CNN=C1 CS13922 [0,0,0,0,1,0|2,0,0]=3 596 B6R1.2 BrC1=COC=C1 CS19877 [0,0,0,0,1,0|2,0,0]=3 597 B6R1.2 BrC1=CSC=C1 CS21415 [0,0,0,0,1,0|2,0,0]=3 598 B6R1.2 BrC1=CSC=N1 MC20197 [0,0,0,0,1,0|3,0,0]=4 599 B6R1.2 BrC1=NC=CN1 CS19858 [0,0,0,0,1,0|3,0,0]=4 600 B6R1.2 BrC1=NC=CO1 MC104314 [0,0,0,0,1,0|3,0,0]=4 601 B6R1.2 BrC1=NC=CS1 CS14242 [0,0,0,0,1,0|3,0,0]=4 602 B6R1.2 BrC1=NC=NS1 CS14599 [0,0,0,0,1,0|3,0,0]=4 603 B6R1.2 BrC1=NN=CN1 CS18124 [0,0,0,0,1,0|3,0,0]=4 604 B6R1.2 BrC1=NN=CS1 CS21329 [0,0,0,0,1,0|3,0,0]=4 605 B6R1.2 BrC1=NNC=C1 CS19717 [0,0,0,0,1,0|2,0,1]=4 606 B6R1.2 BrC1=NOC=C1 MC113742 [0,0,0,0,1,0|3,0,0]=4 607 B6R1.2 BrC1=NSC=C1 CS11529 [0,0,0,0,1,0|3,0,0]=4 608 B6R1.2 CC1=CC=CN1 CS21660 [0,0,0,0,1,0|2,0,0]=3 609 B6R1.2 CC1=CC=CO1 MC41695 [0,0,0,0,1,0|2,0,0]=3 610 B6R1.2 CC1=CC=CS1 CS21701 [0,0,0,0,1,0|2,0,0]=3 611 B6R1.2 CC1=CC=NN1 MC21108 [0,0,0,0,1,0|2,0,0]=3 612 B6R1.2 CC1=CN=CS1 CS10460 [0,0,0,0,1,0|2,0,0]=3 613 B6R1.2 CC1=CNC=C1 MC20689 [0,0,0,0,1,0|1,0,1]=3 614 B6R1.2 CC1=CNC=N1 MC20397 [0,0,0,0,1,0|2,0,1]=4 615 B6R1.2 CC1=CNN=C1 CS22982 [0,0,0,0,1,0|2,0,0]=3 616 B6R1.2 CC1=CNN=N1 CS12910 [0,0,0,0,1,0|3,0,0]=4 617 B6R1.2 CC1=COC=N1 MC427478 [0,0,0,0,1,0|3,0,0]=4 618 B6R1.2 CC1=CSC=N1 CS15621 [0,0,0,0,1,0|3,0,0]=4 619 B6R1.2 CC1=NC=CO1 CS11827 [0,0,0,0,1,0|3,0,0]=4 620 B6R1.2 CC1=NC=CS1 CS22598 [0,0,0,0,1,0|3,0,0]=4 621 B6R1.2 CC1=NN=CO1 CS12863 [0,0,0,0,1,0|3,0,0]=4 622 B6R1.2 CC1=NNC=C1 CS13720 [0,0,0,0,1,0|2,0,1]=4 623 B6R1.2 CC1=NOC=C1 CS11533 [0,0,0,0,1,0|3,0,0]=4 624 B6R1.2 CN1C=CC=C1 CS20770 [0,0,0,0,1,0|2,0,0]=3 625 B6R1.2 CN1C=CC=N1 CS19419 [0,0,0,0,1,0|3,0,0]=4 626 B6R1.2 CN1C=CN=C1 CS19753 [0,0,0,0,1,0|2,0,0]=3 627 B6R1.2 CN1C=CN=N1 CS20743 [0,0,0,0,1,0|3,0,0]=4 628 B6R1.2 CN1C=NC=N1 CS20744 [0,0,0,0,1,0|3,0,0]=4 629 B6R1.2 CN1C=NN=C1 MC20987 [0,0,0,0,1,0|3,0,0]=4 630 B6R1.2 ClC1=CC=NN1 CS16937 [0,0,0,0,1,0|2,0,0]=3 631 B6R1.2 ClC1=CN=CN1 CS10347 [0,0,0,0,1,0|2,0,0]=3 632 B6R1.2 ClC1=CNN=C1 CS18764 [0,0,0,0,1,0|2,0,0]=3 633 B6R1.2 ClC1=CSC=N1 CS14317 [0,0,0,0,1,0|3,0,0]=4 634 B6R1.2 ClC1=NC=CO1 MC106420 [0,0,0,0,1,0|3,0,0]=4 635 B6R1.2 ClC1=NC=NS1 CS13994 [0,0,0,0,1,0|3,0,0]=4 636 B6R1.2 ClC1=NN=CN1 CS18465 [0,0,0,0,1,0|3,0,0]=4 637 B6R1.2 ClC1=NNC=C1 MC103128 [0,0,0,0,1,0|2,0,1]=4 638 B6R1.2 FC1=CC=NN1 MC104307 [0,0,0,0,1,0|2,0,0]=3 639 B6R1.2 FC1=CN=CN1 MC429981 [0,0,0,0,1,0|2,0,0]=3 640 B6R1.2 FC1=NC=CN1 MC430938 [0,0,0,0,1,0|3,0,0]=4 641 B6R1.2 FC1=NC=CN1 MC431135 [0,0,0,0,1,0|3,0,0]=4 642 B6R1.2 IC1=CC=CS1 CS21616 [0,0,0,0,1,0|2,0,0]=3 643 B6R1.2 IC1=CN=CS1 MC441132 [0,0,0,0,1,0|2,0,0]=3 644 B6R1.2 IC1=CNC=N1 CS14306 [0,0,0,0,1,0|2,0,1]=4 645 B6R1.2 IC1=CNN=C1 CS14308 [0,0,0,0,1,0|2,0,0]=3 646 B6R1.2 IC1=CSC=C1 CS22332 [0,0,0,0,1,0|2,0,0]=3 647 B6R1.2 IC1=NC=CN1 CS21881 [0,0,0,0,1,0|3,0,0]=4 648 B6R1.2 IC1=NC=CO1 MC103755 [0,0,0,0,1,0|3,0,0]=4 649 B6R1.2 IC1=NNC=C1 CS13669 [0,0,0,0,1,0|2,0,1]=4 650 B6R1.2 NC1=CC=NS1 MC20989 [0,0,0,0,1,0|1,0,0]=2 651 B6R1.2 NC1=CN=NS1 CS13955 [0,0,0,0,1,0|2,0,0]=3 652 B6R1.2 NC1=CNC=N1 CS16117 [0,0,0,0,1,0|1,0,1]=3 653 B6R1.2 NC1=CNN=C1 CS18307 [0,0,0,0,1,0|1,0,0]=2 654 B6R1.2 NC1=CNN=N1 MC116513 [0,0,0,0,1,0|2,0,0]=3 655 B6R1.2 NC1=COC=N1 MC121309 [0,0,0,0,1,0|2,0,0]=3 656 B6R1.2 NC1=CON=C1 CS15739 [0,0,0,0,1,0|1,0,0]=2 657 B6R1.2 NC1=CSC=C1 CS12280 [0,0,0,0,1,0|1,0,0]=2 658 B6R1.2 NC1=CSC=N1 MC106910 [0,0,0,0,1,0|2,0,0]=3 659 B6R1.2 NC1=CSC=N1 MC121317 [0,0,0,0,1,0|2,0,0]=3 660 B6R1.2 NC1=NC=CN1 CS13716 [0,0,0,0,1,0|2,0,0]=3 661 B6R1.2 NC1=NC=CN1 CS16946 [0,0,0,0,1,0|2,0,0]=3 662 B6R1.2 NC1=NC=CO1 CS19070 [0,0,0,0,1,0|2,0,0]=3 663 B6R1.2 NC1=NC=CS1 CS16381 [0,0,0,0,1,0|2,0,0]=3 664 B6R1.2 NC1=NC=NN1 CS15608 [0,0,0,0,1,0|2,0,0]=3 665 B6R1.2 NC1=NC=NS1 CS13953 [0,0,0,0,1,0|2,0,0]=3 666 B6R1.2 NC1=NC=NS1 CS15183 [0,0,0,0,1,0|2,0,0]=3 667 B6R1.2 NC1=NN=CS1 CS22505 [0,0,0,0,1,0|2,0,0]=3 668 B6R1.2 NC1=NNC=C1 CS22527 [0,0,0,0,1,0|1,0,1]=3 669 B6R1.2 NC1=NNC=N1 CS22032 [0,0,0,0,1,0|2,0,1]=4 670 B6R1.2 NC1=NOC=C1 CS14368 [0,0,0,0,1,0|2,0,0]=3 671 B6R1.2 NC1CC=CC1 CS19415 [0,0,0,0,1,0|0,0,3]=4 672 B6R1.2 NN1C=CC=C1 MC10332 [0,0,0,0,1,0|1,0,0]=2 673 B6R1.2 NN1C=CC=N1 MC105737 [0,0,0,0,1,0|2,0,0]=3 674 B6R1.2 NN1C=NN=C1 CS22509 [0,0,0,0,1,0|2,0,0]=3 675 B6R1.2 O=C1C=CNN1 MC106502 [0,0,0,0,1,0|2,0,1]=4 676 B6R1.2 O=C1C=CON1 MC442265 [0,0,0,0,1,0|3,0,0]=4 677 B6R1.2 O=C1C=CSN1 MC427073 [0,0,0,0,1,0|3,0,0]=4 678 B6R1.2 O=C1CC=NN1 CS20496 [0,0,0,0,1,0|2,0,1]=4 679 B6R1.2 O=C1NC=CN1 MC20853 [0,0,0,0,1,0|3,0,0]=4 680 B6R1.2 OC1=CNN=C1 MC41691 [0,0,0,0,1,0|2,0,0]=3 681 B6R1.2 OC1=NC=CS1 CS12100 [0,0,0,0,1,0|3,0,0]=4 682 B6R1.2 ON1C=CC=N1 CS12818 [0,0,0,0,1,0|3,0,0]=4 683 B6R1.2 SC1=NN=CS1 MC20533 [0,0,0,0,1,0|3,0,0]=4 684 B7R1.1 BrCC1=CC=CS1 MC111260 [0,1,0,0,1,0|2,0,0]=4 685 B7R1.1 BrCC1=CC=NO1 MC114075 [0,1,0,0,1,0|2,0,0]=4 686 B7R1.1 BrCC1=COC=C1 MC111404 [0,1,0,0,1,0|2,0,0]=4 687 B7R1.1 Br[Zn]c1cccs1 MC121347 [0,1,0,0,1,0|2,0,0]=4 688 B7R1.1 C=CN1C=CN=C1 MC20497 [0,1,0,0,1,0|2,0,0]=4 689 B7R1.1 CNC1=NC=CS1 CS12598 [0,1,0,0,1,0|2,0,0]=4 690 B7R1.1 COC1=CSC=C1 CS22351 [0,1,0,0,1,0|2,0,0]=4 691 B7R1.1 CSC1=CNN=C1 MC445675 [0,1,0,0,1,0|2,0,0]=4 692 B7R1.1 ClCC1=CC=CO1 CS13429 [0,1,0,0,1,0|2,0,0]=4 693 B7R1.1 ClCC1=CN=CO1 MC105780 [0,1,0,0,1,0|2,0,0]=4 694 B7R1.1 ClCC1=CN=CO1 MC114644 [0,1,0,0,1,0|2,0,0]=4 695 B7R1.1 ClCC1=CN=CS1 CS16156 [0,1,0,0,1,0|2,0,0]=4 696 B7R1.1 I[Zn]c1ccsc1 MC116065 [0,1,0,0,1,0|2,0,0]=4 697 B7R1.1 N#CC1=CC=CS1 CS22701 [0,1,0,0,1,0|1,0,1]=4 698 B7R1.1 N#CC1=CC=NO1 CS17495 [0,1,0,0,1,0|1,0,1]=4 699 B7R1.1 N#CC1=CN=CS1 CS12489 [0,1,0,0,1,0|1,0,1]=4 700 B7R1.1 N#CC1=CNN=C1 CS17637 [0,1,0,0,1,0|1,0,1]=4 701 B7R1.1 N#CC1=CNN=C1 CS22809 [0,1,0,0,1,0|1,0,1]=4 702 B7R1.1 N#CC1=CSC=C1 CS17418 [0,1,0,0,1,0|1,0,1]=4 703 B7R1.1 NCC1=CC=CN1 CS14874 [0,1,0,0,1,0|1,0,0]=3 704 B7R1.1 NCC1=CC=CO1 MC41689 [0,1,0,0,1,0|1,0,0]=3 705 B7R1.1 NCC1=CC=CS1 CS22783 [0,1,0,0,1,0|1,0,0]=3 706 B7R1.1 NCC1=CN=CO1 CS17502 [0,1,0,0,1,0|1,0,0]=3 707 B7R1.1 NCC1=CN=CO1 CS18508 [0,1,0,0,1,0|1,0,0]=3 708 B7R1.1 NCC1=CN=CO1 MC104477 [0,1,0,0,1,0|1,0,0]=3 709 B7R1.1 NCC1=CNC=N1 CS15263 [0,1,0,0,1,0|1,0,1]=4 710 B7R1.1 NCC1=CNC=N1 CS16828 [0,1,0,0,1,0|1,0,1]=4 711 B7R1.1 NCC1=CON=C1 MC104809 [0,1,0,0,1,0|1,0,0]=3 712 B7R1.1 NCC1=CON=C1 MC114871 [0,1,0,0,1,0|1,0,0]=3 713 B7R1.1 NCC1=CSC=C1 CS22417 [0,1,0,0,1,0|1,0,0]=3 714 B7R1.1 NCC1=CSC=N1 MC116268 [0,1,0,0,1,0|2,0,0]=4 715 B7R1.1 NCC1=NC=CS1 MC444202 [0,1,0,0,1,0|2,0,0]=4 716 B7R1.1 NCC1=NN=CO1 MC103312 [0,1,0,0,1,0|2,0,0]=4 717 B7R1.1 NCC1=NNC=C1 CS15493 [0,1,0,0,1,0|1,0,1]=4 718 B7R1.1 NCC1=NSC=C1 MC105065 [0,1,0,0,1,0|2,0,0]=4 719 B7R1.1 NCc1cocn1 MC102412 [0,1,0,0,1,0|2,0,0]=4 720 B7R1.1 O=CC1=CC=CN1 CS17764 [0,1,0,0,1,0|2,0,0]=4 721 B7R1.1 O=CC1=CC=CN1 MC434011 [0,1,0,0,1,0|2,0,0]=4 722 B7R1.1 O=CC1=CC=CO1 MC41686 [0,1,0,0,1,0|2,0,0]=4 723 B7R1.1 O=CC1=CC=CS1 CS16400 [0,1,0,0,1,0|2,0,0]=4 724 B7R1.1 O=CC1=CN=CO1 MC100355 [0,1,0,0,1,0|2,0,0]=4 725 B7R1.1 O=CC1=CN=CS1 CS15582 [0,1,0,0,1,0|2,0,0]=4 726 B7R1.1 O=CC1=CNC=C1 CS20728 [0,1,0,0,1,0|1,0,1]=4 727 B7R1.1 O=CC1=CNN=C1 CS17644 [0,1,0,0,1,0|2,0,0]=4 728 B7R1.1 O=CC1=CNN=C1 CS18258 [0,1,0,0,1,0|2,0,0]=4 729 B7R1.1 O=CC1=CSC=C1 CS14553 [0,1,0,0,1,0|2,0,0]=4 730 B7R1.1 OCC1=CC=CO1 MC41687 [0,1,0,0,1,0|2,0,0]=4 731 B7R1.1 OCC1=CC=NO1 CS15343 [0,1,0,0,1,0|2,0,0]=4 732 B7R1.1 OCC1=CN=CS1 CS16191 [0,1,0,0,1,0|2,0,0]=4 733 B7R1.1 OCC1=CNN=C1 CS20094 [0,1,0,0,1,0|2,0,0]=4 734 B7R1.1 OCC1=COC=C1 CS22303 [0,1,0,0,1,0|2,0,0]=4 735 B7R1.1 OCC1=CON=C1 MC104808 [0,1,0,0,1,0|2,0,0]=4 736 B7R1.1 OCC1=CSC=C1 CS18039 [0,1,0,0,1,0|2,0,0]=4 737 B7R1.2 BrC1=CC=C(Br)S1 CS22553 [0,1,0,0,1,0|2,0,0]=4 738 B7R1.2 BrC1=CN=C(Br)S1 CS19923 [0,1,0,0,1,0|2,0,0]=4 739 B7R1.2 BrC1=CSC(Br)=C1 MC41669 [0,1,0,0,1,0|2,0,0]=4 740 B7R1.2 CC1=CC(Br)=CS1 CS22736 [0,1,0,0,1,0|2,0,0]=4 741 B7R1.2 CC1=CC(Br)=NN1 CS12832 [0,1,0,0,1,0|2,0,0]=4 742 B7R1.2 CC1=CC(Br)=NO1 MC113406 [0,1,0,0,1,0|2,0,0]=4 743 B7R1.2 CC1=CC(C)=NN1 CS19982 [0,1,0,0,1,0|2,0,0]=4 744 B7R1.2 CC1=CC(C)=NO1 CS14107 [0,1,0,0,1,0|2,0,0]=4 745 B7R1.2 CC1=CC(I)=NN1 CS16887 [0,1,0,0,1,0|2,0,0]=4 746 B7R1.2 CC1=CC=C(Br)S1 CS22735 [0,1,0,0,1,0|2,0,0]=4 747 B7R1.2 CC1=CC=C(C)N1 CS21153 [0,1,0,0,1,0|2,0,0]=4 748 B7R1.2 CC1=CN(C)C=N1 MC111221 [0,1,0,0,1,0|2,0,0]=4 749 B7R1.2 CC1=CN(C)N=C1 CS20542 [0,1,0,0,1,0|2,0,0]=4 750 B7R1.2 CC1=CN=C(Br)S1 CS12301 [0,1,0,0,1,0|2,0,0]=4 751 B7R1.2 CC1=CN=C(C)S1 CS22782 [0,1,0,0,1,0|2,0,0]=4 752 B7R1.2 CC1=CN=C(N)S1 CS21821 [0,1,0,0,1,0|2,0,0]=4 753 B7R1.2 CC1=CSC(N)=C1 MC113026 [0,1,0,0,1,0|1,0,0]=3 754 B7R1.2 CC1=CSC(N)=C1 MC121228 [0,1,0,0,1,0|1,0,0]=3 755 B7R1.2 CC1=NC=C(I)N1 CS19295 [0,1,0,0,1,0|2,0,0]=4 756 B7R1.2 CC1=NC=C(I)S1 MC441133 [0,1,0,0,1,0|2,0,0]=4 757 B7R1.2 CC1=NC=C(N)N1 MC445566 [0,1,0,0,1,0|1,0,0]=3 758 B7R1.2 CC1=NC=C(N)S1 CS15937 [0,1,0,0,1,0|1,0,0]=3 759 B7R1.2 CC1=NN=C(N)N1 CS22083 [0,1,0,0,1,0|2,0,0]=4 760 B7R1.2 CC1=NOC(N)=C1 CS16239 [0,1,0,0,1,0|1,0,0]=3 761 B7R1.2 CC1=NSC(Br)=C1 CS10288 [0,1,0,0,1,0|2,0,0]=4 762 B7R1.2 CC1=NSC(I)=C1 MC100265 [0,1,0,0,1,0|2,0,0]=4 763 B7R1.2 CC1=NSC(N)=C1 CS16387 [0,1,0,0,1,0|1,0,0]=3 764 B7R1.2 CN1C=C(Br)C=N1 CS19794 [0,1,0,0,1,0|2,0,0]=4 765 B7R1.2 CN1C=C(Cl)C=N1 CS12276 [0,1,0,0,1,0|2,0,0]=4 766 B7R1.2 CN1C=C(I)C=N1 CS20765 [0,1,0,0,1,0|2,0,0]=4 767 B7R1.2 CN1C=C(N)C=N1 CS12134 [0,1,0,0,1,0|1,0,0]=3 768 B7R1.2 CN1C=C(N)C=N1 CS15973 [0,1,0,0,1,0|1,0,0]=3 769 B7R1.2 CN1C=C(N)C=N1 MC41661 [0,1,0,0,1,0|1,0,0]=3 770 B7R1.2 CN1C=C(N)N=N1 MC110917 [0,1,0,0,1,0|2,0,0]=4 771 B7R1.2 CN1C=CC(N)=C1 CS17699 [0,1,0,0,1,0|0,0,1]=3 772 B7R1.2 CN1C=CC(N)=N1 CS13878 [0,1,0,0,1,0|1,0,1]=4 773 B7R1.2 CN1C=NC(I)=C1 CS16068 [0,1,0,0,1,0|2,0,0]=4 774 B7R1.2 CN1C=NC(N)=C1 CS15605 [0,1,0,0,1,0|1,0,1]=4 775 B7R1.2 CN1C=NC(N)=C1 MC102995 [0,1,0,0,1,0|1,0,1]=4 776 B7R1.2 ClC1=CC=C(I)S1 MC114731 [0,1,0,0,1,0|2,0,0]=4 777 B7R1.2 ClC1=CN=C(Br)S1 MC441007 [0,1,0,0,1,0|2,0,0]=4 778 B7R1.2 ClC1=NC=C(Br)S1 MC441006 [0,1,0,0,1,0|2,0,0]=4 779 B7R1.2 FC1=CN=C(Br)S1 MC105255 [0,1,0,0,1,0|2,0,0]=4 780 B7R1.2 FC1=CSC(Br)=C1 MC430931 [0,1,0,0,1,0|2,0,0]=4 781 B7R1.2 NC1=CC(=O)NN1 CS13152 [0,1,0,0,1,0|1,0,1]=4 782 B7R1.2 NC1=CC(Cl)=CS1 MC104036 [0,1,0,0,1,0|1,0,0]=3 783 B7R1.2 NC1=CC(Cl)=NN1 MC103573 [0,1,0,0,1,0|1,0,0]=3 784 B7R1.2 NC1=CC(N)=NN1 MC106500 [0,1,0,0,1,0|1,0,0]=3 785 B7R1.2 NC1=CSC(Br)=N1 MC110924 [0,1,0,0,1,0|2,0,0]=4 786 B7R1.2 NC1=CSC(Cl)=C1 MC102443 [0,1,0,0,1,0|1,0,0]=3 787 B7R1.2 NC1=CSC(Cl)=C1 MC104600 [0,1,0,0,1,0|1,0,0]=3 788 B7R1.2 NC1=CSC(N)=N1 CS14359 [0,1,0,0,1,0|2,0,0]=4 789 B7R1.2 NC1=NC(Br)=CS1 CS18333 [0,1,0,0,1,0|2,0,0]=4 790 B7R1.2 NC1=NC(O)=CS1 MC111277 [0,1,0,0,1,0|2,0,0]=4 791 B7R1.2 NC1=NC=C(Cl)S1 CS21276 [0,1,0,0,1,0|2,0,0]=4 792 B7R1.2 NC1=NC=C(Cl)S1 MC442845 [0,1,0,0,1,0|2,0,0]=4 793 B7R1.2 NC1=NC=C(F)S1 CS10393 [0,1,0,0,1,0|2,0,0]=4 794 B7R1.2 NC1=NN=C(Br)S1 CS13944 [0,1,0,0,1,0|2,0,0]=4 795 B7R1.2 NC1=NN=C(Cl)S1 CS12574 [0,1,0,0,1,0|2,0,0]=4 796 B7R1.2 NC1=NN=C(S)S1 MC20709 [0,1,0,0,1,0|2,0,0]=4 797 B7R1.2 NC1=NNC(Br)=C1 CS15854 [0,1,0,0,1,0|1,0,1]=4 798 B7R1.2 NC1=NNC(F)=C1 MC103696 [0,1,0,0,1,0|1,0,1]=4 799 B7R1.2 OC1=NSC(Cl)=C1 MC31103 [0,1,0,0,1,0|2,0,0]=4 800 B7R1.4 BrC1=C(Br)SC=C1 CS22551 [0,1,0,0,1,0|2,0,0]=4 801 B7R1.4 BrC1=C(Br)SC=N1 MC442188 [0,1,0,0,1,0|2,0,0]=4 802 B7R1.4 BrC1=C(I)C=CS1 MC113889 [0,1,0,0,1,0|2,0,0]=4 803 B7R1.4 BrC1=C(I)SC=C1 MC431562 [0,1,0,0,1,0|2,0,0]=4 804 B7R1.4 BrC1=CSC=C1Br CS22554 [0,1,0,0,1,0|2,0,0]=4 805 B7R1.4 BrC1=CSC=C1I MC443772 [0,1,0,0,1,0|2,0,0]=4 806 B7R1.4 CC1=C(Br)C=NN1 CS16927 [0,1,0,0,1,0|2,0,0]=4 807 B7R1.4 CC1=C(Br)SC=C1 CS13700 [0,1,0,0,1,0|2,0,0]=4 808 B7R1.4 CC1=C(C)NC=N1 MC20435 [0,1,0,0,1,0|2,0,0]=4 809 B7R1.4 CC1=C(C)SC=N1 CS22784 [0,1,0,0,1,0|2,0,0]=4 810 B7R1.4 CC1=CC=NN1C CS19266 [0,1,0,0,1,0|2,0,0]=4 811 B7R1.4 CC1=CNN=C1C CS13346 [0,1,0,0,1,0|2,0,0]=4 812 B7R1.4 CC1=CSC=C1Br MC441134 [0,1,0,0,1,0|2,0,0]=4 813 B7R1.4 CC1=CSC=C1N MC427269 [0,1,0,0,1,0|1,0,0]=3 814 B7R1.4 CC1=NNC=C1Br CS15947 [0,1,0,0,1,0|2,0,0]=4 815 B7R1.4 CC1=NNC=C1I CS22358 [0,1,0,0,1,0|2,0,0]=4 816 B7R1.4 CC1=NOC=C1N CS17073 [0,1,0,0,1,0|1,0,0]=3 817 B7R1.4 CC1=NSC=C1Br MC100263 [0,1,0,0,1,0|2,0,0]=4 818 B7R1.4 CN1C=CN=C1Br MC428146 [0,1,0,0,1,0|2,0,0]=4 819 B7R1.4 CN1C=CN=C1I CS21609 [0,1,0,0,1,0|2,0,0]=4 820 B7R1.4 CN1C=NC=C1Br CS17783 [0,1,0,0,1,0|2,0,0]=4 821 B7R1.4 CN1C=NC=C1F MC429980 [0,1,0,0,1,0|2,0,0]=4 822 B7R1.4 CN1C=NC=C1I CS16077 [0,1,0,0,1,0|2,0,0]=4 823 B7R1.4 CN1C=NC=C1N CS17122 [0,1,0,0,1,0|1,0,0]=3 824 B7R1.4 CN1C=NC=C1N MC106511 [0,1,0,0,1,0|1,0,0]=3 825 B7R1.4 CN1C=NN=C1N CS16957 [0,1,0,0,1,0|2,0,0]=4 826 B7R1.4 CN1N=CC=C1Br CS12124 [0,1,0,0,1,0|2,0,0]=4 827 B7R1.4 CN1N=CC=C1N CS22609 [0,1,0,0,1,0|1,0,0]=3 828 B7R1.4 CN1N=CC=C1O CS10399 [0,1,0,0,1,0|2,0,0]=4 829 B7R1.4 CN1N=CN=C1N MC443221 [0,1,0,0,1,0|2,0,0]=4 830 B7R1.4 ClC1=C(Br)C=CS1 CS22555 [0,1,0,0,1,0|2,0,0]=4 831 B7R1.4 ClC1=C(Br)SC=C1 MC442573 [0,1,0,0,1,0|2,0,0]=4 832 B7R1.4 IC1=C(I)NC=N1 MC443844 [0,1,0,0,1,0|2,0,0]=4 833 B7R1.4 NC1=C(Br)C=NN1 CS14320 [0,1,0,0,1,0|1,0,0]=3 834 B7R1.4 NC1=CNN=C1Cl MC33007 [0,1,0,0,1,0|1,0,0]=3 835 B7R1.4 NC1=CNN=C1Cl MC41659 [0,1,0,0,1,0|1,0,0]=3 836 B7R1.4 NC1=NOC=C1Br CS17964 [0,1,0,0,1,0|2,0,0]=4 837 B7R1.4 NC1=NON=C1N CS21924 [0,1,0,0,1,0|2,0,0]=4 838 B9R1.5 O=C1C=CC=CC=C1O MC20359 [0,1,0,0,0,1|2,0,0]=4 839 B9R1.1 BrCC1=CC=C(Br)C=C1 CS19166 [0,2,0,0,0,0|2,0,0]=4 840 B9R1.1 BrCC1=CC=C(I)C=C1 CS20172 [0,2,0,0,0,0|2,0,0]=4 841 B9R1.1 Br[Mg]c1ccc(Br)cc1 MC116037 [0,2,0,0,0,0|2,0,0]=4 842 B9R1.1 C#CC1=CC=C(Br)C=C1 MC440298 [0,2,0,0,0,0|2,0,0]=4 843 B9R1.1 C#CC1=CC=C(C)C=C1 CS21552 [0,2,0,0,0,0|2,0,0]=4 844 B9R1.1 C#CC1=CC=C(Cl)C=C1 MC440300 [0,2,0,0,0,0|2,0,0]=4 845 B9R1.1 C#CC1=CC=C(F)C=C1 MC429574 [0,2,0,0,0,0|2,0,0]=4 846 B9R1.1 C#CC1=CC=C(I)C=C1 MC443225 [0,2,0,0,0,0|2,0,0]=4 847 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [0,2,0,0,0,0|2,0,0]=4 848 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [0,2,0,0,0,0|2,0,0]=4 849 B9R1.1 CC1=CC=C(C#N)C=C1 CS19807 [0,2,0,0,0,0|1,0,1]=4 850 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [0,2,0,0,0,0|2,0,0]=4 851 B9R1.1 CC1=CC=C(CBr)C=C1 CS22969 [0,2,0,0,0,0|2,0,0]=4 852 B9R1.1 CC1=CC=C(CCl)C=C1 MC40603 [0,2,0,0,0,0|2,0,0]=4 853 B9R1.1 CC1=CC=C(CN)C=C1 CS22970 [0,2,0,0,0,0|1,0,0]=3 854 B9R1.1 CC1=CC=C(CO)C=C1 CS19704 [0,2,0,0,0,0|2,0,0]=4 855 B9R1.1 CC1=CC=C(NN)C=C1 CS19576 [0,2,0,0,0,0|1,0,0]=3 856 B9R1.1 CC1=CN=C(CN)C=C1 CS18319 [0,2,0,0,0,0|2,0,0]=4 857 B9R1.1 CCC1=CC=C(Br)C=C1 CS10865 [0,2,0,0,0,0|2,0,0]=4 858 B9R1.1 CCC1=CC=C(F)C=C1 MC20965 [0,2,0,0,0,0|2,0,0]=4 859 B9R1.1 CCC1=CC=C(I)C=C1 MC20189 [0,2,0,0,0,0|2,0,0]=4 860 B9R1.1 CCC1=CC=C(N)C=C1 MC40912 [0,2,0,0,0,0|1,0,0]=3 861 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [0,2,0,0,0,0|2,0,0]=4 862 B9R1.1 CN1C=CC(CN)=CN1 MC105291 [0,2,0,0,0,0|1,0,1]=4 863 B9R1.1 CNC1=CC=C(Cl)C=C1 MC40891 [0,2,0,0,0,0|1,0,0]=3 864 B9R1.1 CNC1=CC=C(F)C=C1 MC40919 [0,2,0,0,0,0|1,0,0]=3 865 B9R1.1 CNC1=CC=C(I)C=C1 CS22906 [0,2,0,0,0,0|1,0,0]=3 866 B9R1.1 CNC1=NC=C(Br)C=C1 CS10304 [0,2,0,0,0,0|2,0,0]=4 867 B9R1.1 CNC1=NC=C(N)C=C1 MC33484 [0,2,0,0,0,0|2,0,0]=4 868 B9R1.1 COC1=CC=C(Br)C=C1 MC41310 [0,2,0,0,0,0|2,0,0]=4 869 B9R1.1 COC1=CC=C(Cl)C=C1 MC41327 [0,2,0,0,0,0|2,0,0]=4 870 B9R1.1 COC1=CC=C(F)C=C1 MC30345 [0,2,0,0,0,0|2,0,0]=4 871 B9R1.1 COC1=CC=C(I)C=C1 MC41342 [0,2,0,0,0,0|2,0,0]=4 872 B9R1.1 COC1=CC=C(N)C=C1 CS18580 [0,2,0,0,0,0|1,0,0]=3 873 B9R1.1 COC1=CC=C(N)C=N1 CS19527 [0,2,0,0,0,0|2,0,0]=4 874 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [0,2,0,0,0,0|2,0,0]=4 875 B9R1.1 COC1=CC=C(S)C=C1 MC20380 [0,2,0,0,0,0|2,0,0]=4 876 B9R1.1 COC1=CC=[N+]([O-])C=C1 CS18613 [0,2,0,0,0,0|1,0,1]=4 877 B9R1.1 COC1=CN=C(N)C=C1 CS17791 [0,2,0,0,0,0|2,0,0]=4 878 B9R1.1 COC1=NC=C(N)C=C1 MC33494 [0,2,0,0,0,0|2,0,0]=4 879 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [0,2,0,0,0,0|2,0,0]=4 880 B9R1.1 ClC1=CC=C(CBr)C=C1 MC40527 [0,2,0,0,0,0|2,0,0]=4 881 B9R1.1 ClCC1=CC=C(Br)C=C1 CS19167 [0,2,0,0,0,0|2,0,0]=4 882 B9R1.1 ClCC1=CC=C(Cl)C=C1 CS19806 [0,2,0,0,0,0|2,0,0]=4 883 B9R1.1 FC1=CC=C(CBr)C=C1 CS19071 [0,2,0,0,0,0|2,0,0]=4 884 B9R1.1 FC1=CC=C(CCl)C=C1 MC429572 [0,2,0,0,0,0|2,0,0]=4 885 B9R1.1 N#CC1=CC=C(Br)C=C1 CS19210 [0,2,0,0,0,0|1,0,1]=4 886 B9R1.1 N#CC1=CC=C(Cl)C=C1 CS19211 [0,2,0,0,0,0|1,0,1]=4 887 B9R1.1 N#CC1=CC=C(F)C=C1 CS18637 [0,2,0,0,0,0|1,0,1]=4 888 B9R1.1 N#CC1=CC=C(I)C=C1 CS22010 [0,2,0,0,0,0|1,0,1]=4 889 B9R1.1 N#CC1=CC=C(N)C=C1 CS13395 [0,2,0,0,0,0|1,0,0]=3 890 B9R1.1 N#CC1=CC=C(N)C=N1 CS19137 [0,2,0,0,0,0|2,0,0]=4 891 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [0,2,0,0,0,0|1,0,1]=4 892 B9R1.1 N#CC1=CC=[N+]([O-])C=C1 MC427173 [0,2,0,0,0,0|0,0,2]=4 893 B9R1.1 N#CC1=CN=C(N)C=C1 CS22991 [0,2,0,0,0,0|2,0,0]=4 894 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [0,2,0,0,0,0|1,0,0]=3 895 B9R1.1 NC1=CC=C(CO)C=C1 MC33175 [0,2,0,0,0,0|1,0,0]=3 896 B9R1.1 NC1=CC=C(CO)C=N1 MC425278 [0,2,0,0,0,0|2,0,0]=4 897 B9R1.1 NC1=CN=C(CO)C=C1 MC33467 [0,2,0,0,0,0|2,0,0]=4 898 B9R1.1 NCC1=CC=C(Br)C=C1 CS19587 [0,2,0,0,0,0|1,0,0]=3 899 B9R1.1 NCC1=CC=C(Br)N=C1 CS11090 [0,2,0,0,0,0|2,0,0]=4 900 B9R1.1 NCC1=CC=C(Cl)C=C1 MC33031 [0,2,0,0,0,0|1,0,0]=3 901 B9R1.1 NCC1=CC=C(Cl)N=C1 CS16390 [0,2,0,0,0,0|2,0,0]=4 902 B9R1.1 NCC1=CC=C(F)C=C1 CS18721 [0,2,0,0,0,0|1,0,0]=3 903 B9R1.1 NCC1=CC=C(I)C=C1 MC40836 [0,2,0,0,0,0|1,0,0]=3 904 B9R1.1 NCC1=CC=C(I)C=C1 MC40837 [0,2,0,0,0,0|1,0,0]=3 905 B9R1.1 NCC1=CC=C(N)C=N1 CS10590 [0,2,0,0,0,0|2,0,0]=4 906 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [0,2,0,0,0,0|1,0,0]=3 907 B9R1.1 NCC1=CN=C(F)C=C1 MC104517 [0,2,0,0,0,0|2,0,0]=4 908 B9R1.1 NCC1=NC=C(F)C=C1 CS16554 [0,2,0,0,0,0|2,0,0]=4 909 B9R1.1 NCC1=NC=C(F)C=C1 MC430168 [0,2,0,0,0,0|2,0,0]=4 910 B9R1.1 NCC1=NC=C(F)C=C1 MC430169 [0,2,0,0,0,0|2,0,0]=4 911 B9R1.1 NNC1=CC=C(Br)C=C1 CS15342 [0,2,0,0,0,0|1,0,0]=3 912 B9R1.1 NNC1=CC=C(Cl)C=C1 CS13495 [0,2,0,0,0,0|1,0,0]=3 913 B9R1.1 NNC1=CC=C(Cl)C=C1 CS17312 [0,2,0,0,0,0|1,0,0]=3 914 B9R1.1 NNC1=CC=C(F)C=C1 CS22006 [0,2,0,0,0,0|1,0,0]=3 915 B9R1.1 NNC1=CC=C(F)N=C1 MC102980 [0,2,0,0,0,0|2,0,0]=4 916 B9R1.1 NNC1=CC=C(N)C=C1 MC430700 [0,2,0,0,0,0|1,0,0]=3 917 B9R1.1 NNC1=NC=C(Br)C=C1 CS19995 [0,2,0,0,0,0|2,0,0]=4 918 B9R1.1 NNC1=NC=C(Cl)C=C1 CS20219 [0,2,0,0,0,0|2,0,0]=4 919 B9R1.1 NNC1=NC=C(F)C=C1 CS17301 [0,2,0,0,0,0|2,0,0]=4 920 B9R1.1 NNC1=NC=C(I)C=C1 MC432010 [0,2,0,0,0,0|2,0,0]=4 921 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [0,2,0,0,0,0|2,0,0]=4 922 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [0,2,0,0,0,0|2,0,0]=4 923 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [0,2,0,0,0,0|2,0,0]=4 924 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [0,2,0,0,0,0|2,0,0]=4 925 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [0,2,0,0,0,0|2,0,0]=4 926 B9R1.1 OCC1=CC=C(Br)C=C1 CS19378 [0,2,0,0,0,0|2,0,0]=4 927 B9R1.1 OCC1=CC=C(Cl)C=C1 CS19353 [0,2,0,0,0,0|2,0,0]=4 928 B9R1.1 OCC1=CC=C(F)C=C1 MC40711 [0,2,0,0,0,0|2,0,0]=4 929 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [0,2,0,0,0,0|2,0,0]=4 930 B9R1.2 BrCC1=CC(I)=CC=C1 MC40562 [0,2,0,0,0,0|2,0,0]=4 931 B9R1.2 BrCC1=CC=CC(Br)=C1 CS19344 [0,2,0,0,0,0|2,0,0]=4 932 B9R1.2 Br[Mg]c1cccc(Br)c1 MC116039 [0,2,0,0,0,0|2,0,0]=4 933 B9R1.2 C#CC1=CC(C)=NC=C1 MC103098 [0,2,0,0,0,0|1,0,0]=3 934 B9R1.2 C#CC1=CC(F)=CC=C1 CS20642 [0,2,0,0,0,0|2,0,0]=4 935 B9R1.2 C#CC1=CC=CC(Br)=C1 MC440366 [0,2,0,0,0,0|2,0,0]=4 936 B9R1.2 C#CC1=CC=CC(N)=C1 CS10819 [0,2,0,0,0,0|1,0,0]=3 937 B9R1.2 C#CC1=CC=CC(O)=C1 CS22325 [0,2,0,0,0,0|2,0,0]=4 938 B9R1.2 C#CC1=NC(Cl)=NC=C1 MC103297 [0,2,0,0,0,0|2,0,0]=4 939 B9R1.2 C#CC1=NC(N)=NC=C1 MC102188 [0,2,0,0,0,0|2,0,0]=4 940 B9R1.2 C=NC1=CC(C)=CC=C1 MC111025 [0,2,0,0,0,0|1,0,1]=4 941 B9R1.2 CC1=CC(C#N)=NC=C1 CS20235 [0,2,0,0,0,0|1,0,0]=3 942 B9R1.2 CC1=CC(C=O)=NC=C1 CS19123 [0,2,0,0,0,0|1,0,0]=3 943 B9R1.2 CC1=CC(CCl)=NC=C1 CS15442 [0,2,0,0,0,0|1,0,0]=3 944 B9R1.2 CC1=CC(CN)=CC=C1 CS19644 [0,2,0,0,0,0|1,0,0]=3 945 B9R1.2 CC1=CC(CO)=NC=C1 CS11126 [0,2,0,0,0,0|1,0,0]=3 946 B9R1.2 CC1=CC(CO)=NC=N1 MC103804 [0,2,0,0,0,0|2,0,0]=4 947 B9R1.2 CC1=CC(NN)=CC=C1 CS19574 [0,2,0,0,0,0|1,0,0]=3 948 B9R1.2 CC1=CC(NN)=NC=C1 CS13399 [0,2,0,0,0,0|1,0,0]=3 949 B9R1.2 CC1=CC=CC(C#N)=C1 CS19778 [0,2,0,0,0,0|1,0,1]=4 950 B9R1.2 CC1=CC=CC(C=O)=C1 MC41127 [0,2,0,0,0,0|2,0,0]=4 951 B9R1.2 CC1=CC=CC(CCl)=C1 MC40602 [0,2,0,0,0,0|2,0,0]=4 952 B9R1.2 CC1=CC=CC(CF)=C1 MC433869 [0,2,0,0,0,0|2,0,0]=4 953 B9R1.2 CC1=CC=CC(CN)=N1 CS18414 [0,2,0,0,0,0|2,0,0]=4 954 B9R1.2 CC1=CC=CC(NN)=N1 MC429683 [0,2,0,0,0,0|2,0,0]=4 955 B9R1.2 CC1=CN=NC(C#N)=C1 MC105173 [0,2,0,0,0,0|2,0,0]=4 956 B9R1.2 CC1=CN=NC(CN)=C1 MC104119 [0,2,0,0,0,0|2,0,0]=4 957 B9R1.2 CC1=NC(C#N)=NC=C1 MC425508 [0,2,0,0,0,0|2,0,0]=4 958 B9R1.2 CC1=NC(C=O)=NC=C1 MC104692 [0,2,0,0,0,0|2,0,0]=4 959 B9R1.2 CC1=NC(CCl)=NC=C1 MC113392 [0,2,0,0,0,0|2,0,0]=4 960 B9R1.2 CC1=NC(CN)=NC=C1 MC431122 [0,2,0,0,0,0|2,0,0]=4 961 B9R1.2 CC1=NC(CO)=NC=C1 MC444189 [0,2,0,0,0,0|2,0,0]=4 962 B9R1.2 CC1=NC=CC(C#N)=C1 MC21144 [0,2,0,0,0,0|0,0,1]=3 963 B9R1.2 CC1=NC=CC(C=O)=C1 CS15441 [0,2,0,0,0,0|1,0,0]=3 964 B9R1.2 CC1=NC=CC(C=O)=N1 CS19715 [0,2,0,0,0,0|2,0,0]=4 965 B9R1.2 CC1=NC=CC(CN)=C1 MC443686 [0,2,0,0,0,0|0,0,0]=2 966 B9R1.2 CCC1=CC(=O)N=CN1 MC106508 [0,2,0,0,0,0|2,0,0]=4 967 B9R1.2 CCC1=CC(Cl)=NC=N1 MC106509 [0,2,0,0,0,0|2,0,0]=4 968 B9R1.2 CCC1=CC=CC(Br)=C1 MC30292 [0,2,0,0,0,0|2,0,0]=4 969 B9R1.2 CCC1=CC=CC(C)=C1 MC425590 [0,2,0,0,0,0|2,0,0]=4 970 B9R1.2 CCC1=CC=CC(N)=C1 MC433319 [0,2,0,0,0,0|1,0,0]=3 971 B9R1.2 CCC1=NC=CC(N)=C1 MC105214 [0,2,0,0,0,0|0,0,0]=2 972 B9R1.2 CNC1=CC(Br)=CC=C1 CS22185 [0,2,0,0,0,0|1,0,0]=3 973 B9R1.2 CNC1=CC(Br)=CC=C1 MC40876 [0,2,0,0,0,0|1,0,0]=3 974 B9R1.2 CNC1=CC(Br)=CN=C1 MC443556 [0,2,0,0,0,0|2,0,0]=4 975 B9R1.2 CNC1=CC(Br)=NC=C1 MC442736 [0,2,0,0,0,0|0,0,0]=2 976 B9R1.2 CNC1=CC(Cl)=CC=C1 MC20486 [0,2,0,0,0,0|1,0,0]=3 977 B9R1.2 CNC1=CC(N)=CC=C1 CS16640 [0,2,0,0,0,0|1,0,0]=3 978 B9R1.2 CNC1=CC=CC(O)=C1 MC442233 [0,2,0,0,0,0|1,0,0]=3 979 B9R1.2 CNC1=NC=CC(Br)=C1 MC33481 [0,2,0,0,0,0|1,0,0]=3 980 B9R1.2 CNC1=NC=CC(Br)=N1 CS14470 [0,2,0,0,0,0|2,0,0]=4 981 B9R1.2 CNC1=NC=CC(Cl)=C1 MC430266 [0,2,0,0,0,0|1,0,0]=3 982 B9R1.2 CNC1=NC=CC(N)=C1 CS16967 [0,2,0,0,0,0|0,0,0]=2 983 B9R1.2 CNC1=NC=NC(Cl)=C1 CS19244 [0,2,0,0,0,0|1,0,0]=3 984 B9R1.2 COC1=CC(=O)NC=C1 CS12334 [0,2,0,0,0,0|1,0,1]=4 985 B9R1.2 COC1=CC(Br)=NC=C1 CS16230 [0,2,0,0,0,0|1,0,0]=3 986 B9R1.2 COC1=CC(Br)=NC=N1 MC441213 [0,2,0,0,0,0|2,0,0]=4 987 B9R1.2 COC1=CC(Cl)=NC=C1 CS19311 [0,2,0,0,0,0|1,0,0]=3 988 B9R1.2 COC1=CC(Cl)=NC=N1 CS17690 [0,2,0,0,0,0|2,0,0]=4 989 B9R1.2 COC1=CC(F)=NC=C1 CS14826 [0,2,0,0,0,0|1,0,0]=3 990 B9R1.2 COC1=CC(I)=NC=N1 CS17505 [0,2,0,0,0,0|2,0,0]=4 991 B9R1.2 COC1=CC(N)=NC=C1 CS19522 [0,2,0,0,0,0|1,0,0]=3 992 B9R1.2 COC1=CC(N)=NC=N1 CS18114 [0,2,0,0,0,0|1,0,0]=3 993 B9R1.2 COC1=CC=CC(Cl)=C1 CS19894 [0,2,0,0,0,0|2,0,0]=4 994 B9R1.2 COC1=CC=CC(F)=C1 CS19929 [0,2,0,0,0,0|2,0,0]=4 995 B9R1.2 COC1=CC=CC(N)=C1 CS19943 [0,2,0,0,0,0|1,0,0]=3 996 B9R1.2 COC1=CC=CC(N)=N1 CS13845 [0,2,0,0,0,0|2,0,0]=4 997 B9R1.2 COC1=CC=CC(O)=C1 CS18747 [0,2,0,0,0,0|2,0,0]=4 998 B9R1.2 COC1=CN=CC(N)=C1 CS19973 [0,2,0,0,0,0|2,0,0]=4 999 B9R1.2 COC1=CN=NC(Cl)=C1 CS22227 [0,2,0,0,0,0|2,0,0]=4 1000 B9R1.2 COC1=NC(Br)=NC=C1 CS12506 [0,2,0,0,0,0|2,0,0]=4 1001 B9R1.2 COC1=NC(C)=NC=C1 CS11919 [0,2,0,0,0,0|2,0,0]=4 1002 B9R1.2 COC1=NC(Cl)=NC=C1 CS21447 [0,2,0,0,0,0|2,0,0]=4 1003 B9R1.2 COC1=NC(I)=NC=C1 CS11917 [0,2,0,0,0,0|2,0,0]=4 1004 B9R1.2 COC1=NC(N)=NC=C1 MC441214 [0,2,0,0,0,0|2,0,0]=4 1005 B9R1.2 COC1=NC=CC(Br)=C1 CS22650 [0,2,0,0,0,0|1,0,0]=3 1006 B9R1.2 COC1=NC=CC(Br)=N1 MC442715 [0,2,0,0,0,0|2,0,0]=4 1007 B9R1.2 COC1=NC=CC(C)=C1 CS21637 [0,2,0,0,0,0|1,0,0]=3 1008 B9R1.2 COC1=NC=CC(Cl)=C1 CS19313 [0,2,0,0,0,0|1,0,0]=3 1009 B9R1.2 COC1=NC=CC(F)=C1 CS11908 [0,2,0,0,0,0|1,0,0]=3 1010 B9R1.2 COC1=NC=CC(I)=C1 CS19594 [0,2,0,0,0,0|1,0,0]=3 1011 B9R1.2 COC1=NC=CC(N)=C1 CS19525 [0,2,0,0,0,0|0,0,0]=2 1012 B9R1.2 COC1=NC=CC(N)=N1 CS10114 [0,2,0,0,0,0|1,0,0]=3 1013 B9R1.2 COC1=NC=CC(O)=C1 MC115931 [0,2,0,0,0,0|1,0,0]=3 1014 B9R1.2 CSC1=CC(Cl)=NC=N1 CS12488 [0,2,0,0,0,0|2,0,0]=4 1015 B9R1.2 CSC1=CC(N)=CC=C1 MC20570 [0,2,0,0,0,0|1,0,0]=3 1016 B9R1.2 CSC1=NC(Cl)=NC=C1 CS19934 [0,2,0,0,0,0|2,0,0]=4 1017 B9R1.2 CSC1=NC=CC(=O)N1 CS22771 [0,2,0,0,0,0|2,0,0]=4 1018 B9R1.2 CSC1=NC=CC(Br)=N1 MC425588 [0,2,0,0,0,0|2,0,0]=4 1019 B9R1.2 CSC1=NC=CC(Cl)=C1 CS12493 [0,2,0,0,0,0|1,0,0]=3 1020 B9R1.2 CSC1=NC=CC(Cl)=N1 CS18332 [0,2,0,0,0,0|2,0,0]=4 1021 B9R1.2 CSC1=NC=CC(N)=N1 CS20913 [0,2,0,0,0,0|1,0,0]=3 1022 B9R1.2 CSC1=NC=CC(O)=N1 CS12612 [0,2,0,0,0,0|2,0,0]=4 1023 B9R1.2 Cc1cc(C#N)ccn1 MC115556 [0,2,0,0,0,0|0,0,1]=3 1024 B9R1.2 ClC1=CC(CBr)=NC=C1 MC111259 [0,2,0,0,0,0|1,0,0]=3 1025 B9R1.2 ClC1=CC=CC(CBr)=C1 CS22235 [0,2,0,0,0,0|2,0,0]=4 1026 B9R1.2 ClCC1=CC(Br)=CC=C1 MC40579 [0,2,0,0,0,0|2,0,0]=4 1027 B9R1.2 ClCC1=CC(Cl)=CC=C1 MC40582 [0,2,0,0,0,0|2,0,0]=4 1028 B9R1.2 FC1=CC=CC(CBr)=C1 MC40552 [0,2,0,0,0,0|2,0,0]=4 1029 B9R1.2 FC1=CC=CC(CCl)=C1 CS19068 [0,2,0,0,0,0|2,0,0]=4 1030 B9R1.2 FCC1=CC=CC(F)=C1 MC433530 [0,2,0,0,0,0|2,0,0]=4 1031 B9R1.2 N#CC1=CC(Br)=CC=C1 CS19865 [0,2,0,0,0,0|1,0,1]=4 1032 B9R1.2 N#CC1=CC(Br)=NC=C1 MC433058 [0,2,0,0,0,0|0,0,1]=3 1033 B9R1.2 N#CC1=CC(Cl)=CC=C1 CS19319 [0,2,0,0,0,0|1,0,1]=4 1034 B9R1.2 N#CC1=CC(Cl)=NC=C1 CS18691 [0,2,0,0,0,0|0,0,1]=3 1035 B9R1.2 N#CC1=CC(F)=CC=C1 MC20044 [0,2,0,0,0,0|1,0,1]=4 1036 B9R1.2 N#CC1=CC(F)=NC=C1 CS21565 [0,2,0,0,0,0|0,0,1]=3 1037 B9R1.2 N#CC1=CC(I)=CC=C1 MC33186 [0,2,0,0,0,0|1,0,1]=4 1038 B9R1.2 N#CC1=CC(N)=CC=C1 CS13394 [0,2,0,0,0,0|1,0,0]=3 1039 B9R1.2 N#CC1=CC(N)=NC=C1 CS21808 [0,2,0,0,0,0|0,0,1]=3 1040 B9R1.2 N#CC1=CC(O)=CC=C1 CS19377 [0,2,0,0,0,0|1,0,1]=4 1041 B9R1.2 N#CC1=NC(Br)=NC=C1 MC442230 [0,2,0,0,0,0|1,0,1]=4 1042 B9R1.2 N#CC1=NC(Cl)=NC=C1 CS10116 [0,2,0,0,0,0|1,0,1]=4 1043 B9R1.2 N#CC1=NC(N)=CC=C1 MC425282 [0,2,0,0,0,0|2,0,0]=4 1044 B9R1.2 N#CC1=NC=CC(Br)=C1 CS18399 [0,2,0,0,0,0|1,0,0]=3 1045 B9R1.2 N#CC1=NC=CC(Cl)=C1 CS18109 [0,2,0,0,0,0|1,0,0]=3 1046 B9R1.2 N#CC1=NC=CC(N)=N1 MC121176 [0,2,0,0,0,0|1,0,0]=3 1047 B9R1.2 N#CC1=NC=CC(O)=C1 MC443349 [0,2,0,0,0,0|1,0,0]=3 1048 B9R1.2 NC1=CC(CO)=NC=C1 MC33483 [0,2,0,0,0,0|0,0,0]=2 1049 B9R1.2 NC1=CC(CO)=NC=N1 MC121194 [0,2,0,0,0,0|1,0,0]=3 1050 B9R1.2 NC1=CC(CO)=NC=N1 MC425257 [0,2,0,0,0,0|1,0,0]=3 1051 B9R1.2 NC1=CC=CC(C=O)=N1 MC110929 [0,2,0,0,0,0|2,0,0]=4 1052 B9R1.2 NC1=CC=CC(CO)=C1 CS18821 [0,2,0,0,0,0|1,0,0]=3 1053 B9R1.2 NC1=CC=CC(CO)=N1 CS16612 [0,2,0,0,0,0|2,0,0]=4 1054 B9R1.2 NC1=CN=CC(CO)=C1 CS22079 [0,2,0,0,0,0|2,0,0]=4 1055 B9R1.2 NC1=NC=CC(C=O)=C1 CS18505 [0,2,0,0,0,0|1,0,0]=3 1056 B9R1.2 NC1=NC=CC(C=O)=C1 MC103369 [0,2,0,0,0,0|1,0,0]=3 1057 B9R1.2 NC1=NC=CC(CCl)=C1 MC431205 [0,2,0,0,0,0|1,0,0]=3 1058 B9R1.2 NC1=NC=CC(CF)=N1 MC430731 [0,2,0,0,0,0|2,0,0]=4 1059 B9R1.2 NC1=NC=CC(CO)=C1 CS17807 [0,2,0,0,0,0|1,0,0]=3 1060 B9R1.2 NC1=NC=CC(CO)=N1 CS21291 [0,2,0,0,0,0|2,0,0]=4 1061 B9R1.2 NCC1=CC(=O)N=CN1 MC112983 [0,2,0,0,0,0|1,0,0]=3 1062 B9R1.2 NCC1=CC(Br)=CC=C1 CS19652 [0,2,0,0,0,0|1,0,0]=3 1063 B9R1.2 NCC1=CC(Br)=CC=C1 MC40798 [0,2,0,0,0,0|1,0,0]=3 1064 B9R1.2 NCC1=CC(Br)=CN=C1 MC106753 [0,2,0,0,0,0|2,0,0]=4 1065 B9R1.2 NCC1=CC(Br)=NC=C1 CS17247 [0,2,0,0,0,0|0,0,0]=2 1066 B9R1.2 NCC1=CC(Cl)=CC=C1 MC33134 [0,2,0,0,0,0|1,0,0]=3 1067 B9R1.2 NCC1=CC(Cl)=NC=C1 CS16037 [0,2,0,0,0,0|0,0,0]=2 1068 B9R1.2 NCC1=CC(F)=CC=C1 MC33025 [0,2,0,0,0,0|1,0,0]=3 1069 B9R1.2 NCC1=CC(F)=CN=C1 MC431591 [0,2,0,0,0,0|2,0,0]=4 1070 B9R1.2 NCC1=CC(F)=NC=C1 MC116260 [0,2,0,0,0,0|0,0,0]=2 1071 B9R1.2 NCC1=CC(I)=CC=C1 CS22330 [0,2,0,0,0,0|1,0,0]=3 1072 B9R1.2 NCC1=CC(N)=NC=C1 CS17453 [0,2,0,0,0,0|0,0,0]=2 1073 B9R1.2 NCC1=CC(N)=NC=N1 MC113023 [0,2,0,0,0,0|1,0,0]=3 1074 B9R1.2 NCC1=CC(N)=NC=N1 MC115658 [0,2,0,0,0,0|1,0,0]=3 1075 B9R1.2 NCC1=CN=CC(N)=C1 MC33458 [0,2,0,0,0,0|2,0,0]=4 1076 B9R1.2 NCC1=NC(Br)=CC=C1 CS10635 [0,2,0,0,0,0|2,0,0]=4 1077 B9R1.2 NCC1=NC(Br)=CC=C1 MC425058 [0,2,0,0,0,0|2,0,0]=4 1078 B9R1.2 NCC1=NC(F)=CC=C1 CS13193 [0,2,0,0,0,0|2,0,0]=4 1079 B9R1.2 NCC1=NC(O)=NC=C1 MC104065 [0,2,0,0,0,0|1,0,0]=3 1080 B9R1.2 NCC1=NC=CC(Br)=C1 CS12824 [0,2,0,0,0,0|1,0,0]=3 1081 B9R1.2 NCC1=NC=CC(Br)=C1 CS15559 [0,2,0,0,0,0|1,0,0]=3 1082 B9R1.2 NCC1=NC=CC(Cl)=C1 MC113773 [0,2,0,0,0,0|1,0,0]=3 1083 B9R1.2 NCC1=NC=NC(Cl)=C1 MC113046 [0,2,0,0,0,0|1,0,0]=3 1084 B9R1.2 NNC1=CC(Br)=CC=C1 CS19465 [0,2,0,0,0,0|1,0,0]=3 1085 B9R1.2 NNC1=CC(Cl)=CC=C1 CS19479 [0,2,0,0,0,0|1,0,0]=3 1086 B9R1.2 NNC1=CC(Cl)=NC=C1 CS15665 [0,2,0,0,0,0|0,0,0]=2 1087 B9R1.2 NNC1=CC(Cl)=NC=N1 CS17425 [0,2,0,0,0,0|1,0,0]=3 1088 B9R1.2 NNC1=CC(F)=CC=C1 CS19485 [0,2,0,0,0,0|1,0,0]=3 1089 B9R1.2 NNC1=CC(O)=NC=N1 CS12366 [0,2,0,0,0,0|1,0,0]=3 1090 B9R1.2 NNC1=CC=CC(Cl)=N1 CS21479 [0,2,0,0,0,0|2,0,0]=4 1091 B9R1.2 NNC1=NC(Cl)=NC=C1 CS16010 [0,2,0,0,0,0|1,0,0]=3 1092 B9R1.2 NNC1=NC=CC(F)=C1 MC115508 [0,2,0,0,0,0|1,0,0]=3 1093 B9R1.2 O=CC1=CC(Br)=CC=C1 CS18958 [0,2,0,0,0,0|2,0,0]=4 1094 B9R1.2 O=CC1=CC(Br)=NC=C1 CS18783 [0,2,0,0,0,0|1,0,0]=3 1095 B9R1.2 O=CC1=CC(Cl)=CC=C1 MC20579 [0,2,0,0,0,0|2,0,0]=4 1096 B9R1.2 O=CC1=CC(F)=CC=C1 CS22298 [0,2,0,0,0,0|2,0,0]=4 1097 B9R1.2 O=CC1=CC(F)=NC=C1 MC431324 [0,2,0,0,0,0|1,0,0]=3 1098 B9R1.2 O=CC1=CC(I)=CC=C1 CS20132 [0,2,0,0,0,0|2,0,0]=4 1099 B9R1.2 O=CC1=CC(O)=CC=C1 MC20422 [0,2,0,0,0,0|2,0,0]=4 1100 B9R1.2 O=CC1=NC(Cl)=NC=C1 MC104746 [0,2,0,0,0,0|2,0,0]=4 1101 B9R1.2 O=CC1=NC=CC(Br)=C1 CS12092 [0,2,0,0,0,0|1,0,0]=3 1102 B9R1.2 O=CC1=NC=CC(Cl)=C1 CS22794 [0,2,0,0,0,0|1,0,0]=3 1103 B9R1.2 O=CC1=NC=NC(Cl)=C1 MC430292 [0,2,0,0,0,0|2,0,0]=4 1104 B9R1.2 OC1=CC(CBr)=CC=C1 MC425573 [0,2,0,0,0,0|2,0,0]=4 1105 B9R1.2 OCC1=CC(Br)=NC=C1 CS19256 [0,2,0,0,0,0|1,0,0]=3 1106 B9R1.2 OCC1=CC(F)=CC=C1 CS19069 [0,2,0,0,0,0|2,0,0]=4 1107 B9R1.2 OCC1=CC(F)=NC=C1 CS21547 [0,2,0,0,0,0|1,0,0]=3 1108 B9R1.2 OCC1=CC(O)=CC=C1 MC40720 [0,2,0,0,0,0|2,0,0]=4 1109 B9R1.2 OCC1=NC=CC(Br)=C1 CS18696 [0,2,0,0,0,0|1,0,0]=3 1110 B9R1.2 OCC1=NC=CC(Cl)=C1 MC20517 [0,2,0,0,0,0|1,0,0]=3 1111 B9R1.2 OCC1=NC=CC(O)=C1 CS17612 [0,2,0,0,0,0|1,0,0]=3 1112 B9R1.2 OCC1=NC=NC(Cl)=C1 MC444425 [0,2,0,0,0,0|2,0,0]=4 1113 B9R1.6 C=C(C)C1=CC=NC=C1 MC111872 [0,2,0,0,0,0|1,0,0]=3 1114 B9R1.6 C=C(F)C1=CC=CC=C1 MC102770 [0,2,0,0,0,0|2,0,0]=4 1115 B9R1.6 CC(=O)C1=CC=CC=C1 MC41221 [0,2,0,0,0,0|2,0,0]=4 1116 B9R1.6 CC(=O)C1=CC=NC=C1 CS22535 [0,2,0,0,0,0|1,0,0]=3 1117 B9R1.6 CC(=O)C1=CN=NC=C1 MC444309 [0,2,0,0,0,0|2,0,0]=4 1118 B9R1.6 CC(=O)C1=NC=NC=C1 MC442362 [0,2,0,0,0,0|2,0,0]=4 1119 B9R1.6 CC(Br)C1=CC=CC=C1 MC40570 [0,2,0,0,0,0|2,0,0]=4 1120 B9R1.6 CC(N)C1=CC=CC=C1 CS10551 [0,2,0,0,0,0|1,0,0]=3 1121 B9R1.6 CC(N)C1=CC=CC=C1 MC20344 [0,2,0,0,0,0|1,0,0]=3 1122 B9R1.6 CC(N)C1=CN=NC=C1 MC103837 [0,2,0,0,0,0|1,0,0]=3 1123 B9R1.6 CC(N)C1=NC=CC=C1 CS15370 [0,2,0,0,0,0|2,0,0]=4 1124 B9R1.6 CC(N)C1=NC=CC=C1 CS20271 [0,2,0,0,0,0|2,0,0]=4 1125 B9R1.6 CC(N)C1=NC=NC=C1 MC103926 [0,2,0,0,0,0|1,0,0]=3 1126 B9R1.6 CC(O)C1=CC=CC=C1 MC20383 [0,2,0,0,0,0|2,0,0]=4 1127 B9R1.6 CN(C)C1=CC=CC=C1 MC40906 [0,2,0,0,0,0|1,0,0]=3 1128 B9R1.6 CN(C)C1=CC=NC=C1 CS13386 [0,2,0,0,0,0|0,0,0]=2 1129 B9R1.6 C[PH](=O)C1=CC=CC=C1 CS16386 [0,2,0,0,0,0|1,1,0]=4 1130 B9R1.6 ClC(Cl)C1=CC=CC=C1 MC40608 [0,2,0,0,0,0|2,0,0]=4 1131 B9R1.6 FC(F)C1=CC=CC=C1 MC41442 [0,2,0,0,0,0|2,0,0]=4 1132 B9R1.6 FC(F)C1=CC=NC=C1 MC429159 [0,2,0,0,0,0|1,0,0]=3 1133 B9R1.6 N=C(N)C1=CC=CC=C1 CS14830 [0,2,0,0,0,0|1,0,0]=3 1134 B9R1.6 N=C(N)C1=CN=CC=C1 CS19487 [0,2,0,0,0,0|2,0,0]=4 1135 B9R1.6 N=C(N)C1=NC=CC=C1 CS19100 [0,2,0,0,0,0|2,0,0]=4 1136 B9R1.6 NC(=O)C1=CC=CC=C1 CS10962 [0,2,0,0,0,0|1,0,0]=3 1137 B9R1.6 NC(=O)C1=CC=NC=C1 CS13721 [0,2,0,0,0,0|0,0,0]=2 1138 B9R1.6 NC(=O)C1=NC=CC=C1 CS11910 [0,2,0,0,0,0|2,0,0]=4 1139 B9R1.6 NC(=S)C1=CC=CC=C1 MC20863 [0,2,0,0,0,0|1,0,0]=3 1140 B9R1.6 O=C(Cl)C1=CC=CC=C1 MC40435 [0,2,0,0,0,0|2,0,0]=4 1141 B9R1.6 O=C(O)C1=CC=CC=C1 MC40233 [0,2,0,0,0,0|2,0,0]=4 1142 B9R1.6 O=C(O)C1=CN=NC=C1 MC41706 [0,2,0,0,0,0|2,0,0]=4 1143 B9R1.6 O=C(O)C1=NC=NC=C1 CS14129 [0,2,0,0,0,0|2,0,0]=4 1144 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 MC41586 [0,2,0,0,0,0|1,0,1]=4 1145 B9R1.6 OB(O)C1=CC=CC=C1 CS19450 [0,2,0,0,0,0|2,0,0]=4 1146 B9R1.6 OB(O)C1=CC=NC=C1 CS22018 [0,2,0,0,0,0|1,0,0]=3 1147 B9R1.6 OB(O)C1=NC=NC=C1 MC20899 [0,2,0,0,0,0|2,0,0]=4 1148 B9R1.8 BrCCC1=CC=CC=C1 MC40571 [0,2,0,0,0,0|2,0,0]=4 1149 B9R1.8 Br[Zn]Cc1ccccc1 MC121333 [0,2,0,0,0,0|2,0,0]=4 1150 B9R1.8 CCNC1=CC=CC=C1 MC40913 [0,2,0,0,0,0|1,0,0]=3 1151 B9R1.8 CNCC1=CC=CC=C1 MC10559 [0,2,0,0,0,0|1,0,0]=3 1152 B9R1.8 CNCC1=CC=CC=C1 MC20323 [0,2,0,0,0,0|1,0,0]=3 1153 B9R1.8 CNCC1=CC=CC=C1 MC21006 [0,2,0,0,0,0|1,0,0]=3 1154 B9R1.8 CNCC1=CC=CN=C1 CS18846 [0,2,0,0,0,0|2,0,0]=4 1155 B9R1.8 ClCCC1=CC=CC=C1 MC40609 [0,2,0,0,0,0|2,0,0]=4 1156 B9R1.8 ClCCC1=CC=NC=C1 CS17913 [0,2,0,0,0,0|1,0,0]=3 1157 B9R1.8 FCCC1=CC=CC=C1 MC41557 [0,2,0,0,0,0|2,0,0]=4 1158 B9R1.8 N#CCC1=CC=NC=C1 CS20239 [0,2,0,0,0,0|0,0,1]=3 1159 B9R1.8 N#CCC1=CN=NC=C1 MC121078 [0,2,0,0,0,0|1,0,1]=4 1160 B9R1.8 N#CCC1=NC=NC=C1 MC101900 [0,2,0,0,0,0|1,0,1]=4 1161 B9R1.8 NCCC1=CC=CC=C1 MC40983 [0,2,0,0,0,0|1,0,0]=3 1162 B9R1.8 NCCC1=CC=CN=C1 CS21892 [0,2,0,0,0,0|2,0,0]=4 1163 B9R1.8 NCCC1=NC=CC=C1 CS14064 [0,2,0,0,0,0|2,0,0]=4 1164 B9R1.8 NCCC1=NC=NC=C1 MC104796 [0,2,0,0,0,0|1,0,0]=3 1165 B9R1.8 NNCC1=CC=CC=C1 CS11006 [0,2,0,0,0,0|1,0,0]=3 1166 B9R1.8 NNCC1=CC=CC=C1 CS12127 [0,2,0,0,0,0|1,0,0]=3 1167 B9R1.8 NNCC1=CC=CN=C1 MC111189 [0,2,0,0,0,0|2,0,0]=4 1168 B9R1.8 NNCC1=CC=CN=C1 MC111240 [0,2,0,0,0,0|2,0,0]=4 1169 B9R1.8 NNCC1=CC=NC=C1 MC111241 [0,2,0,0,0,0|0,0,0]=2 1170 B9R1.8 NNCC1=CN=NC=C1 MC103925 [0,2,0,0,0,0|1,0,0]=3 1171 B9R1.8 NNCC1=NC=CC=C1 MC111239 [0,2,0,0,0,0|2,0,0]=4 1172 B9R1.8 NOCC1=CC=CC=C1 CS14063 [0,2,0,0,0,0|1,0,0]=3 1173 B9R1.8 O=C=NC1=CC=CC=C1 MC41051 [0,2,0,0,0,0|1,0,1]=4 1174 B9R1.8 O=CCC1=CC=NC=C1 MC106357 [0,2,0,0,0,0|1,0,0]=3 1175 B9R1.8 O=CNC1=CC=CC=C1 MC40924 [0,2,0,0,0,0|1,0,0]=3 1176 B9R1.8 O=COC1=CC=CC=C1 MC40136 [0,2,0,0,0,0|2,0,0]=4 1177 B9R1.8 OCCC1=CC=CC=C1 MC40745 [0,2,0,0,0,0|2,0,0]=4 1178 B9R1.8 ONCC1=CC=CC=C1 CS11753 [0,2,0,0,0,0|1,0,0]=3 1179 B9R1.15 BrCC1=C(Br)C=CC=C1 MC20808 [0,2,0,0,0,0|2,0,0]=4 1180 B9R1.15 BrCC1=C(I)C=CC=C1 MC40561 [0,2,0,0,0,0|2,0,0]=4 1181 B9R1.15 C#CC1=C(Cl)C=CC=C1 CS20629 [0,2,0,0,0,0|2,0,0]=4 1182 B9R1.15 C#CC1=C(N)C=CC=C1 CS21537 [0,2,0,0,0,0|1,0,0]=3 1183 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [0,2,0,0,0,0|2,0,0]=4 1184 B9R1.15 C#CC1=CC=CN=C1N MC103217 [0,2,0,0,0,0|2,0,0]=4 1185 B9R1.15 C=CC1=C(Br)C=CC=C1 CS18853 [0,2,0,0,0,0|2,0,0]=4 1186 B9R1.15 C=CC1=C(Cl)C=CC=C1 CS19873 [0,2,0,0,0,0|2,0,0]=4 1187 B9R1.15 C=CC1=CC=CN=C1N MC103094 [0,2,0,0,0,0|2,0,0]=4 1188 B9R1.15 CC1=C(C#N)N=NC=C1 MC105174 [0,2,0,0,0,0|2,0,0]=4 1189 B9R1.15 CC1=C(CBr)C=CC=C1 CS14791 [0,2,0,0,0,0|2,0,0]=4 1190 B9R1.15 CC1=C(CBr)C=NC=C1 CS17496 [0,2,0,0,0,0|1,0,0]=3 1191 B9R1.15 CC1=C(CCl)C=NC=C1 MC104833 [0,2,0,0,0,0|1,0,0]=3 1192 B9R1.15 CC1=C(CN)C=CC=C1 MC33216 [0,2,0,0,0,0|1,0,0]=3 1193 B9R1.15 CC1=C(CN)C=NC=C1 CS20204 [0,2,0,0,0,0|1,0,0]=3 1194 B9R1.15 CC1=C(CO)C=NC=C1 MC443666 [0,2,0,0,0,0|1,0,0]=3 1195 B9R1.15 CC1=C(NN)C=CC=C1 CS19575 [0,2,0,0,0,0|1,0,0]=3 1196 B9R1.15 CC1=C(NN)C=CC=C1 MC20365 [0,2,0,0,0,0|1,0,0]=3 1197 B9R1.15 CC1=CC=CC=C1C=O CS19114 [0,2,0,0,0,0|2,0,0]=4 1198 B9R1.15 CC1=CC=NC=C1C#N CS22253 [0,2,0,0,0,0|1,0,0]=3 1199 B9R1.15 CC1=CC=NC=C1C=O MC442433 [0,2,0,0,0,0|1,0,0]=3 1200 B9R1.15 CC1=CN=NC=C1CN MC104847 [0,2,0,0,0,0|1,0,0]=3 1201 B9R1.15 CC1=NC=CC=C1CN MC102930 [0,2,0,0,0,0|2,0,0]=4 1202 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [0,2,0,0,0,0|2,0,0]=4 1203 B9R1.15 CCC1=C(Br)C=CN=C1 MC427078 [0,2,0,0,0,0|1,0,0]=3 1204 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [0,2,0,0,0,0|2,0,0]=4 1205 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [0,2,0,0,0,0|1,0,0]=3 1206 B9R1.15 CCC1=NC=NC=C1F CS19573 [0,2,0,0,0,0|2,0,0]=4 1207 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [0,2,0,0,0,0|1,0,0]=3 1208 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [0,2,0,0,0,0|1,0,0]=3 1209 B9R1.15 CNC1=C(N)C=NC=C1 MC10330 [0,2,0,0,0,0|0,0,0]=2 1210 B9R1.15 CNC1=CC=CC=C1N CS22302 [0,2,0,0,0,0|1,0,0]=3 1211 B9R1.15 CNC1=NC=CC=C1Br CS17281 [0,2,0,0,0,0|2,0,0]=4 1212 B9R1.15 CNC1=NC=CC=C1Cl MC33482 [0,2,0,0,0,0|2,0,0]=4 1213 B9R1.15 CNC1=NC=CC=C1N MC427393 [0,2,0,0,0,0|2,0,0]=4 1214 B9R1.15 CNC1=NC=NC=C1Br MC425769 [0,2,0,0,0,0|1,0,0]=3 1215 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [0,2,0,0,0,0|2,0,0]=4 1216 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [0,2,0,0,0,0|1,0,0]=3 1217 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [0,2,0,0,0,0|1,0,0]=3 1218 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [0,2,0,0,0,0|1,0,0]=3 1219 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [0,2,0,0,0,0|1,0,0]=3 1220 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [0,2,0,0,0,0|1,0,0]=3 1221 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [0,2,0,0,0,0|2,0,0]=4 1222 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [0,2,0,0,0,0|1,0,0]=3 1223 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [0,2,0,0,0,0|2,0,0]=4 1224 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [0,2,0,0,0,0|1,0,0]=3 1225 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [0,2,0,0,0,0|1,0,0]=3 1226 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [0,2,0,0,0,0|1,0,0]=3 1227 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [0,2,0,0,0,0|0,0,0]=2 1228 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [0,2,0,0,0,0|1,0,0]=3 1229 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [0,2,0,0,0,0|2,0,0]=4 1230 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [0,2,0,0,0,0|1,0,0]=3 1231 B9R1.15 COC1=CC=CN=C1N CS17216 [0,2,0,0,0,0|2,0,0]=4 1232 B9R1.15 COC1=CN=CN=C1Br CS17880 [0,2,0,0,0,0|2,0,0]=4 1233 B9R1.15 COC1=CN=CN=C1N CS13116 [0,2,0,0,0,0|1,0,0]=3 1234 B9R1.15 COC1=CN=CN=C1O MC432213 [0,2,0,0,0,0|2,0,0]=4 1235 B9R1.15 COC1=NC=CC=C1N CS19526 [0,2,0,0,0,0|2,0,0]=4 1236 B9R1.15 CSC1=C(Br)C=CN=C1 MC430535 [0,2,0,0,0,0|1,0,0]=3 1237 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [0,2,0,0,0,0|2,0,0]=4 1238 B9R1.15 ClC1=C(CBr)C=CC=C1 CS19190 [0,2,0,0,0,0|2,0,0]=4 1239 B9R1.15 ClCC1=C(Cl)C=CC=C1 CS19964 [0,2,0,0,0,0|2,0,0]=4 1240 B9R1.15 ClCC1=CC=CC=C1Br MC30029 [0,2,0,0,0,0|2,0,0]=4 1241 B9R1.15 FC1=C(CBr)C=CC=C1 CS21562 [0,2,0,0,0,0|2,0,0]=4 1242 B9R1.15 FC1=C(CCl)C=CC=C1 MC40597 [0,2,0,0,0,0|2,0,0]=4 1243 B9R1.15 N#CC1=C(Br)C=CC=C1 MC20182 [0,2,0,0,0,0|1,0,1]=4 1244 B9R1.15 N#CC1=C(Br)C=NC=C1 CS13671 [0,2,0,0,0,0|0,0,1]=3 1245 B9R1.15 N#CC1=C(Cl)C=NC=C1 CS15593 [0,2,0,0,0,0|0,0,1]=3 1246 B9R1.15 N#CC1=C(Cl)N=NC=C1 MC113294 [0,2,0,0,0,0|1,0,1]=4 1247 B9R1.15 N#CC1=C(F)C=CC=C1 CS18285 [0,2,0,0,0,0|1,0,1]=4 1248 B9R1.15 N#CC1=C(F)C=NC=C1 MC429591 [0,2,0,0,0,0|0,0,1]=3 1249 B9R1.15 N#CC1=C(I)C=CC=C1 CS21883 [0,2,0,0,0,0|1,0,1]=4 1250 B9R1.15 N#CC1=C(I)C=CN=C1 MC113305 [0,2,0,0,0,0|1,0,0]=3 1251 B9R1.15 N#CC1=C(N)C=CC=C1 CS13393 [0,2,0,0,0,0|1,0,0]=3 1252 B9R1.15 N#CC1=C(N)C=NC=C1 CS15948 [0,2,0,0,0,0|0,0,1]=3 1253 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [0,2,0,0,0,0|1,0,1]=4 1254 B9R1.15 N#CC1=CC=CN=C1N CS22990 [0,2,0,0,0,0|2,0,0]=4 1255 B9R1.15 N#CC1=CN=CC=C1Br CS13752 [0,2,0,0,0,0|1,0,0]=3 1256 B9R1.15 N#CC1=CN=CC=C1Cl CS16226 [0,2,0,0,0,0|1,0,0]=3 1257 B9R1.15 N#CC1=CN=CC=C1O MC106630 [0,2,0,0,0,0|1,0,0]=3 1258 B9R1.15 N#CC1=CN=CN=C1Cl CS14002 [0,2,0,0,0,0|2,0,0]=4 1259 B9R1.15 N#CC1=CN=CN=C1O CS17392 [0,2,0,0,0,0|2,0,0]=4 1260 B9R1.15 N#CC1=CNC=CC1=O MC429689 [0,2,0,0,0,0|1,0,1]=4 1261 B9R1.15 N#CC1=NC=NC=C1Br MC431295 [0,2,0,0,0,0|1,0,1]=4 1262 B9R1.15 NC1=C(C=O)C=CC=C1 MC20756 [0,2,0,0,0,0|1,0,0]=3 1263 B9R1.15 NC1=C(C=O)C=CC=N1 CS19340 [0,2,0,0,0,0|2,0,0]=4 1264 B9R1.15 NC1=C(C=O)C=CN=C1 CS14976 [0,2,0,0,0,0|1,0,0]=3 1265 B9R1.15 NC1=C(CO)C=CC=C1 CS19122 [0,2,0,0,0,0|1,0,0]=3 1266 B9R1.15 NC1=CC=NC=C1C=O CS19349 [0,2,0,0,0,0|0,0,0]=2 1267 B9R1.15 NC1=NC=CC=C1CO CS13983 [0,2,0,0,0,0|2,0,0]=4 1268 B9R1.15 NCC1=C(Br)C=CC=C1 CS19534 [0,2,0,0,0,0|1,0,0]=3 1269 B9R1.15 NCC1=C(Br)C=NC=C1 CS17629 [0,2,0,0,0,0|0,0,0]=2 1270 B9R1.15 NCC1=C(F)C=CC=C1 MC40826 [0,2,0,0,0,0|1,0,0]=3 1271 B9R1.15 NCC1=C(F)C=NC=C1 MC116263 [0,2,0,0,0,0|0,0,0]=2 1272 B9R1.15 NCC1=C(F)C=NC=C1 MC431082 [0,2,0,0,0,0|0,0,0]=2 1273 B9R1.15 NCC1=C(N)C=CC=C1 MC40796 [0,2,0,0,0,0|1,0,0]=3 1274 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [0,2,0,0,0,0|1,0,0]=3 1275 B9R1.15 NCC1=CC=NNC1=O MC104734 [0,2,0,0,0,0|1,0,0]=3 1276 B9R1.15 NCC1=NC=CC=C1Cl MC114379 [0,2,0,0,0,0|2,0,0]=4 1277 B9R1.15 NCC1=NC=CC=C1F MC104008 [0,2,0,0,0,0|2,0,0]=4 1278 B9R1.15 NCC1=NC=CC=C1O MC443567 [0,2,0,0,0,0|2,0,0]=4 1279 B9R1.15 NNC1=C(Br)C=CC=C1 CS19466 [0,2,0,0,0,0|1,0,0]=3 1280 B9R1.15 NNC1=C(Cl)C=CC=C1 CS19478 [0,2,0,0,0,0|1,0,0]=3 1281 B9R1.15 NNC1=C(F)C=CC=C1 CS23033 [0,2,0,0,0,0|1,0,0]=3 1282 B9R1.15 NNC1=C(F)C=CC=C1 MC33086 [0,2,0,0,0,0|1,0,0]=3 1283 B9R1.15 NNC1=NC=CC=C1Cl CS20171 [0,2,0,0,0,0|2,0,0]=4 1284 B9R1.15 O=CC1=C(Br)C=CC=C1 CS19251 [0,2,0,0,0,0|2,0,0]=4 1285 B9R1.15 O=CC1=C(Br)C=NC=C1 CS15669 [0,2,0,0,0,0|1,0,0]=3 1286 B9R1.15 O=CC1=C(Cl)C=CN=C1 MC425655 [0,2,0,0,0,0|1,0,0]=3 1287 B9R1.15 O=CC1=C(Cl)C=NC=C1 CS15780 [0,2,0,0,0,0|1,0,0]=3 1288 B9R1.15 O=CC1=C(F)C=CC=C1 CS21560 [0,2,0,0,0,0|2,0,0]=4 1289 B9R1.15 O=CC1=C(I)C=CC=C1 CS20131 [0,2,0,0,0,0|2,0,0]=4 1290 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [0,2,0,0,0,0|2,0,0]=4 1291 B9R1.15 O=CC1=C(O)C=NC=C1 CS13859 [0,2,0,0,0,0|1,0,0]=3 1292 B9R1.15 O=CC1=CN=CC=C1Br MC429512 [0,2,0,0,0,0|1,0,0]=3 1293 B9R1.15 O=CC1=CN=CC=C1O CS15926 [0,2,0,0,0,0|1,0,0]=3 1294 B9R1.15 O=CC1=CNC=CC1=O CS17898 [0,2,0,0,0,0|1,0,1]=4 1295 B9R1.15 OCC1=C(Br)C=CC=C1 CS18828 [0,2,0,0,0,0|2,0,0]=4 1296 B9R1.15 OCC1=C(Br)C=NC=C1 CS12881 [0,2,0,0,0,0|1,0,0]=3 1297 B9R1.15 OCC1=C(Cl)C=CC=C1 CS21494 [0,2,0,0,0,0|2,0,0]=4 1298 B9R1.15 OCC1=C(Cl)C=CN=C1 CS17105 [0,2,0,0,0,0|1,0,0]=3 1299 B9R1.15 OCC1=C(F)C=CC=C1 MC33139 [0,2,0,0,0,0|2,0,0]=4 1300 B9R1.15 OCC1=C(I)C=CC=C1 CS19102 [0,2,0,0,0,0|2,0,0]=4 1301 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [0,2,0,0,0,0|2,0,0]=4 1302 B9R1.15 OCC1=CN=CN=C1Cl MC444026 [0,2,0,0,0,0|2,0,0]=4 1303 B9R1.69 BrC1=CC(Br)=C(Br)C=C1 MC433546 [0,2,0,0,0,0|2,0,0]=4 1304 B9R1.69 BrC1=CC(Br)=C(Br)N=N1 CS15864 [0,2,0,0,0,0|2,0,0]=4 1305 B9R1.69 BrC1=CC(I)=C(Br)C=C1 MC30182 [0,2,0,0,0,0|2,0,0]=4 1306 B9R1.69 BrC1=CN=C(Br)C=C1I MC443457 [0,2,0,0,0,0|1,0,0]=3 1307 B9R1.69 CC1=C(Br)C=C(Br)C=C1 MC33103 [0,2,0,0,0,0|2,0,0]=4 1308 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 MC41499 [0,2,0,0,0,0|2,0,0]=4 1309 B9R1.69 CC1=C(Br)C=C(F)C=C1 MC20047 [0,2,0,0,0,0|2,0,0]=4 1310 B9R1.69 CC1=C(Br)C=C(I)C=C1 CS21358 [0,2,0,0,0,0|2,0,0]=4 1311 B9R1.69 CC1=C(Br)C=C(N)C=C1 CS10506 [0,2,0,0,0,0|1,0,0]=3 1312 B9R1.69 CC1=C(Br)C=C(N)C=N1 CS18819 [0,2,0,0,0,0|2,0,0]=4 1313 B9R1.69 CC1=C(Br)C=C(O)C=C1 CS12184 [0,2,0,0,0,0|2,0,0]=4 1314 B9R1.69 CC1=C(Br)C=CC(Br)=C1 CS21137 [0,2,0,0,0,0|2,0,0]=4 1315 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 CS20166 [0,2,0,0,0,0|2,0,0]=4 1316 B9R1.69 CC1=C(Br)C=CC(F)=C1 CS10390 [0,2,0,0,0,0|2,0,0]=4 1317 B9R1.69 CC1=C(Br)C=CC(I)=C1 MC33074 [0,2,0,0,0,0|2,0,0]=4 1318 B9R1.69 CC1=C(Br)C=CC(N)=C1 CS15448 [0,2,0,0,0,0|1,0,0]=3 1319 B9R1.69 CC1=C(Br)C=CC(N)=N1 CS23028 [0,2,0,0,0,0|2,0,0]=4 1320 B9R1.69 CC1=C(Br)C=CC(O)=C1 CS20279 [0,2,0,0,0,0|2,0,0]=4 1321 B9R1.69 CC1=C(Br)C=NC(=O)N1 CS15560 [0,2,0,0,0,0|2,0,0]=4 1322 B9R1.69 CC1=C(Br)N=C(N)C=C1 MC428235 [0,2,0,0,0,0|2,0,0]=4 1323 B9R1.69 CC1=C(Br)N=CC(N)=C1 CS19464 [0,2,0,0,0,0|2,0,0]=4 1324 B9R1.69 CC1=C(C)C=C(Cl)C=C1 MC433525 [0,2,0,0,0,0|2,0,0]=4 1325 B9R1.69 CC1=C(C)C=C(N)C=C1 CS20010 [0,2,0,0,0,0|1,0,0]=3 1326 B9R1.69 CC1=C(C)C=C(O)C=C1 MC41191 [0,2,0,0,0,0|2,0,0]=4 1327 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 CS22639 [0,2,0,0,0,0|2,0,0]=4 1328 B9R1.69 CC1=C(Cl)C=C(Cl)C=C1 CS21102 [0,2,0,0,0,0|2,0,0]=4 1329 B9R1.69 CC1=C(Cl)C=C(F)C=C1 CS10409 [0,2,0,0,0,0|2,0,0]=4 1330 B9R1.69 CC1=C(Cl)C=C(N)C=C1 MC40889 [0,2,0,0,0,0|1,0,0]=3 1331 B9R1.69 CC1=C(Cl)C=C(O)C=C1 MC33172 [0,2,0,0,0,0|2,0,0]=4 1332 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 CS19135 [0,2,0,0,0,0|2,0,0]=4 1333 B9R1.69 CC1=C(Cl)C=CC(Cl)=C1 MC41516 [0,2,0,0,0,0|2,0,0]=4 1334 B9R1.69 CC1=C(Cl)C=CC(I)=C1 CS20194 [0,2,0,0,0,0|2,0,0]=4 1335 B9R1.69 CC1=C(Cl)C=CC(N)=C1 MC40892 [0,2,0,0,0,0|1,0,0]=3 1336 B9R1.69 CC1=C(Cl)C=CC(O)=C1 MC41173 [0,2,0,0,0,0|2,0,0]=4 1337 B9R1.69 CC1=C(Cl)N=C(N)C=C1 CS21753 [0,2,0,0,0,0|2,0,0]=4 1338 B9R1.69 CC1=C(Cl)N=CC(N)=C1 CS14239 [0,2,0,0,0,0|2,0,0]=4 1339 B9R1.69 CC1=C(Cl)N=NC(Cl)=C1 CS18830 [0,2,0,0,0,0|2,0,0]=4 1340 B9R1.69 CC1=C(F)C=C(Br)C=C1 CS14669 [0,2,0,0,0,0|2,0,0]=4 1341 B9R1.69 CC1=C(F)C=C(Cl)C=C1 MC41507 [0,2,0,0,0,0|2,0,0]=4 1342 B9R1.69 CC1=C(F)C=C(F)C=C1 CS19066 [0,2,0,0,0,0|2,0,0]=4 1343 B9R1.69 CC1=C(F)C=C(I)C=C1 MC30225 [0,2,0,0,0,0|2,0,0]=4 1344 B9R1.69 CC1=C(F)C=C(N)C=C1 MC20039 [0,2,0,0,0,0|1,0,0]=3 1345 B9R1.69 CC1=C(F)C=C(N)C=N1 MC432276 [0,2,0,0,0,0|2,0,0]=4 1346 B9R1.69 CC1=C(F)C=C(O)C=C1 CS10481 [0,2,0,0,0,0|2,0,0]=4 1347 B9R1.69 CC1=C(F)C=CC(Br)=C1 MC33150 [0,2,0,0,0,0|2,0,0]=4 1348 B9R1.69 CC1=C(F)C=CC(Cl)=C1 CS14434 [0,2,0,0,0,0|2,0,0]=4 1349 B9R1.69 CC1=C(F)C=CC(F)=C1 CS19928 [0,2,0,0,0,0|2,0,0]=4 1350 B9R1.69 CC1=C(F)C=CC(I)=C1 CS10424 [0,2,0,0,0,0|2,0,0]=4 1351 B9R1.69 CC1=C(F)C=CC(N)=C1 CS10514 [0,2,0,0,0,0|1,0,0]=3 1352 B9R1.69 CC1=C(F)C=CC(N)=N1 MC433033 [0,2,0,0,0,0|2,0,0]=4 1353 B9R1.69 CC1=C(F)C=CC(O)=C1 CS10483 [0,2,0,0,0,0|2,0,0]=4 1354 B9R1.69 CC1=C(F)C=CC(S)=C1 MC41409 [0,2,0,0,0,0|2,0,0]=4 1355 B9R1.69 CC1=C(F)N=CC(N)=C1 CS13868 [0,2,0,0,0,0|2,0,0]=4 1356 B9R1.69 CC1=C(I)C=C(Br)C=C1 MC41501 [0,2,0,0,0,0|2,0,0]=4 1357 B9R1.69 CC1=C(I)C=CC(Br)=C1 CS10398 [0,2,0,0,0,0|2,0,0]=4 1358 B9R1.69 CC1=C(I)C=CC(F)=C1 MC433024 [0,2,0,0,0,0|2,0,0]=4 1359 B9R1.69 CC1=C(I)C=CC(N)=N1 MC33318 [0,2,0,0,0,0|2,0,0]=4 1360 B9R1.69 CC1=C(I)C=CC(O)=C1 CS22901 [0,2,0,0,0,0|2,0,0]=4 1361 B9R1.69 CC1=C(N)C=C(Br)C=C1 CS14257 [0,2,0,0,0,0|1,0,0]=3 1362 B9R1.69 CC1=C(N)C=C(Cl)C=C1 MC40893 [0,2,0,0,0,0|1,0,0]=3 1363 B9R1.69 CC1=C(N)C=C(I)C=C1 CS20374 [0,2,0,0,0,0|1,0,0]=3 1364 B9R1.69 CC1=C(N)C=C(O)C=C1 MC30249 [0,2,0,0,0,0|1,0,0]=3 1365 B9R1.69 CC1=C(N)C=CC(=O)N1 MC425072 [0,2,0,0,0,0|2,0,0]=4 1366 B9R1.69 CC1=C(N)C=CC(Br)=C1 CS15106 [0,2,0,0,0,0|1,0,0]=3 1367 B9R1.69 CC1=C(N)C=CC(Cl)=C1 CS16371 [0,2,0,0,0,0|1,0,0]=3 1368 B9R1.69 CC1=C(N)C=CC(F)=C1 CS10513 [0,2,0,0,0,0|1,0,0]=3 1369 B9R1.69 CC1=C(N)C=CC(I)=C1 CS20371 [0,2,0,0,0,0|1,0,0]=3 1370 B9R1.69 CC1=C(N)C=CC(N)=C1 CS18566 [0,2,0,0,0,0|1,0,0]=3 1371 B9R1.69 CC1=C(N)C=CC(O)=C1 CS14087 [0,2,0,0,0,0|1,0,0]=3 1372 B9R1.69 CC1=C(N)C=NC(Br)=C1 CS19458 [0,2,0,0,0,0|1,0,0]=3 1373 B9R1.69 CC1=C(N)C=NC(Cl)=C1 CS19473 [0,2,0,0,0,0|1,0,0]=3 1374 B9R1.69 CC1=C(N)C=NC(F)=C1 MC20830 [0,2,0,0,0,0|1,0,0]=3 1375 B9R1.69 CC1=C(N)N=C(O)N=N1 MC116093 [0,2,0,0,0,0|2,0,0]=4 1376 B9R1.69 CC1=C(N)N=NC(Cl)=C1 CS17524 [0,2,0,0,0,0|2,0,0]=4 1377 B9R1.69 CC1=C(O)C=C(Br)C=C1 CS10275 [0,2,0,0,0,0|2,0,0]=4 1378 B9R1.69 CC1=C(O)C=C(F)C=C1 CS10484 [0,2,0,0,0,0|2,0,0]=4 1379 B9R1.69 CC1=C(O)C=C(N)C=C1 CS10536 [0,2,0,0,0,0|1,0,0]=3 1380 B9R1.69 CC1=C(O)C=C(O)C=C1 CS20391 [0,2,0,0,0,0|2,0,0]=4 1381 B9R1.69 CC1=C(O)C=CC(Br)=C1 MC20395 [0,2,0,0,0,0|2,0,0]=4 1382 B9R1.69 CC1=C(O)C=CC(Cl)=C1 CS20290 [0,2,0,0,0,0|2,0,0]=4 1383 B9R1.69 CC1=C(O)C=CC(F)=C1 CS10482 [0,2,0,0,0,0|2,0,0]=4 1384 B9R1.69 CC1=C(O)C=CC(I)=C1 MC30013 [0,2,0,0,0,0|2,0,0]=4 1385 B9R1.69 CC1=C(O)C=CC(N)=C1 MC30012 [0,2,0,0,0,0|1,0,0]=3 1386 B9R1.69 CC1=C(O)N=NC(O)=C1 MC427429 [0,2,0,0,0,0|2,0,0]=4 1387 B9R1.69 CC1=CC(=O)C=CC1=O MC41219 [0,2,0,0,0,0|2,0,0]=4 1388 B9R1.69 CC1=CC(=O)N=NC1=O MC427493 [0,2,0,0,0,0|2,0,0]=4 1389 B9R1.69 CC1=CC(Br)=C(Br)C=C1 MC41513 [0,2,0,0,0,0|2,0,0]=4 1390 B9R1.69 CC1=CC(Br)=C(C)C=C1 CS21410 [0,2,0,0,0,0|2,0,0]=4 1391 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 CS20167 [0,2,0,0,0,0|2,0,0]=4 1392 B9R1.69 CC1=CC(Br)=C(F)C=C1 MC20046 [0,2,0,0,0,0|2,0,0]=4 1393 B9R1.69 CC1=CC(Br)=C(N)C=C1 CS19777 [0,2,0,0,0,0|1,0,0]=3 1394 B9R1.69 CC1=CC(Br)=C(N)N=N1 MC432046 [0,2,0,0,0,0|2,0,0]=4 1395 B9R1.69 CC1=CC(Br)=C(O)C=N1 MC432165 [0,2,0,0,0,0|1,0,0]=3 1396 B9R1.69 CC1=CC(Br)=CN=C1N MC20013 [0,2,0,0,0,0|2,0,0]=4 1397 B9R1.69 CC1=CC(Br)=NC=C1Br CS14171 [0,2,0,0,0,0|1,0,0]=3 1398 B9R1.69 CC1=CC(Br)=NC=C1Cl MC427549 [0,2,0,0,0,0|1,0,0]=3 1399 B9R1.69 CC1=CC(Br)=NC=C1F MC430954 [0,2,0,0,0,0|1,0,0]=3 1400 B9R1.69 CC1=CC(C)=C(Br)C=C1 MC41530 [0,2,0,0,0,0|2,0,0]=4 1401 B9R1.69 CC1=CC(C)=C(C)C=C1 MC41547 [0,2,0,0,0,0|2,0,0]=4 1402 B9R1.69 CC1=CC(C)=C(Cl)N=N1 MC444259 [0,2,0,0,0,0|2,0,0]=4 1403 B9R1.69 CC1=CC(C)=C(F)C=C1 MC33141 [0,2,0,0,0,0|2,0,0]=4 1404 B9R1.69 CC1=CC(C)=C(N)C=C1 CS20011 [0,2,0,0,0,0|1,0,0]=3 1405 B9R1.69 CC1=CC(C)=C(O)C=C1 MC30165 [0,2,0,0,0,0|2,0,0]=4 1406 B9R1.69 CC1=CC(C)=C(S)C=C1 MC443880 [0,2,0,0,0,0|2,0,0]=4 1407 B9R1.69 CC1=CC(C)=NC=C1Br MC427292 [0,2,0,0,0,0|1,0,0]=3 1408 B9R1.69 CC1=CC(C)=NNC1=O MC105060 [0,2,0,0,0,0|2,0,0]=4 1409 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 CS19979 [0,2,0,0,0,0|2,0,0]=4 1410 B9R1.69 CC1=CC(Cl)=C(C)C=C1 MC41534 [0,2,0,0,0,0|2,0,0]=4 1411 B9R1.69 CC1=CC(Cl)=C(Cl)C=C1 CS21935 [0,2,0,0,0,0|2,0,0]=4 1412 B9R1.69 CC1=CC(Cl)=C(F)C=C1 MC433023 [0,2,0,0,0,0|2,0,0]=4 1413 B9R1.69 CC1=CC(Cl)=C(I)C=C1 MC41508 [0,2,0,0,0,0|2,0,0]=4 1414 B9R1.69 CC1=CC(Cl)=C(N)C=C1 MC20110 [0,2,0,0,0,0|1,0,0]=3 1415 B9R1.69 CC1=CC(Cl)=C(O)C=C1 CS20292 [0,2,0,0,0,0|2,0,0]=4 1416 B9R1.69 CC1=CC(Cl)=CN=C1N CS13921 [0,2,0,0,0,0|2,0,0]=4 1417 B9R1.69 CC1=CC(Cl)=NC=C1Br CS18475 [0,2,0,0,0,0|1,0,0]=3 1418 B9R1.69 CC1=CC(Cl)=NC=C1Cl MC20731 [0,2,0,0,0,0|1,0,0]=3 1419 B9R1.69 CC1=CC(Cl)=NC=C1F CS19390 [0,2,0,0,0,0|1,0,0]=3 1420 B9R1.69 CC1=CC(F)=C(Br)C=C1 CS10392 [0,2,0,0,0,0|2,0,0]=4 1421 B9R1.69 CC1=CC(F)=C(C)C=C1 CS13237 [0,2,0,0,0,0|2,0,0]=4 1422 B9R1.69 CC1=CC(F)=C(C)C=C1 MC433527 [0,2,0,0,0,0|2,0,0]=4 1423 B9R1.69 CC1=CC(F)=C(Cl)C=C1 CS22757 [0,2,0,0,0,0|2,0,0]=4 1424 B9R1.69 CC1=CC(F)=C(F)C=C1 CS19897 [0,2,0,0,0,0|2,0,0]=4 1425 B9R1.69 CC1=CC(F)=C(N)C=C1 MC40918 [0,2,0,0,0,0|1,0,0]=3 1426 B9R1.69 CC1=CC(F)=CN=C1N CS17590 [0,2,0,0,0,0|2,0,0]=4 1427 B9R1.69 CC1=CC(F)=NC=C1Br CS10262 [0,2,0,0,0,0|1,0,0]=3 1428 B9R1.69 CC1=CC(F)=NC=C1Cl MC433043 [0,2,0,0,0,0|1,0,0]=3 1429 B9R1.69 CC1=CC(F)=NC=C1I MC433046 [0,2,0,0,0,0|1,0,0]=3 1430 B9R1.69 CC1=CC(I)=C(N)C=C1 CS10517 [0,2,0,0,0,0|1,0,0]=3 1431 B9R1.69 CC1=CC(I)=C(O)C=C1 MC41201 [0,2,0,0,0,0|2,0,0]=4 1432 B9R1.69 CC1=CC(I)=CN=C1N CS13801 [0,2,0,0,0,0|2,0,0]=4 1433 B9R1.69 CC1=CC(N)=C(Br)C=C1 CS18349 [0,2,0,0,0,0|1,0,0]=3 1434 B9R1.69 CC1=CC(N)=C(C)C=C1 MC40905 [0,2,0,0,0,0|1,0,0]=3 1435 B9R1.69 CC1=CC(N)=C(Cl)C=C1 CS20365 [0,2,0,0,0,0|1,0,0]=3 1436 B9R1.69 CC1=CC(N)=C(F)C=C1 CS10510 [0,2,0,0,0,0|1,0,0]=3 1437 B9R1.69 CC1=CC(N)=C(I)C=C1 CS20372 [0,2,0,0,0,0|1,0,0]=3 1438 B9R1.69 CC1=CC(N)=NC=C1Br CS19457 [0,2,0,0,0,0|1,0,0]=3 1439 B9R1.69 CC1=CC(N)=NC=C1Cl CS19468 [0,2,0,0,0,0|1,0,0]=3 1440 B9R1.69 CC1=CC(N)=NC=C1F MC10782 [0,2,0,0,0,0|1,0,0]=3 1441 B9R1.69 CC1=CC(O)=C(Br)C=C1 CS16357 [0,2,0,0,0,0|2,0,0]=4 1442 B9R1.69 CC1=CC(O)=C(C)C=C1 CS19431 [0,2,0,0,0,0|2,0,0]=4 1443 B9R1.69 CC1=CC(O)=C(F)C=C1 MC41196 [0,2,0,0,0,0|2,0,0]=4 1444 B9R1.69 CC1=CC(O)=C(N)C=C1 CS14086 [0,2,0,0,0,0|1,0,0]=3 1445 B9R1.69 CC1=CC(O)=NC=C1Br CS13793 [0,2,0,0,0,0|1,0,0]=3 1446 B9R1.69 CC1=CC=C(Br)C(N)=N1 CS19460 [0,2,0,0,0,0|2,0,0]=4 1447 B9R1.69 CC1=CC=C(Br)C=C1C MC41529 [0,2,0,0,0,0|2,0,0]=4 1448 B9R1.69 CC1=CC=C(Br)N=C1N MC443537 [0,2,0,0,0,0|2,0,0]=4 1449 B9R1.69 CC1=CC=C(C)C(N)=N1 CS16045 [0,2,0,0,0,0|2,0,0]=4 1450 B9R1.69 CC1=CC=C(F)C(N)=N1 MC432249 [0,2,0,0,0,0|2,0,0]=4 1451 B9R1.69 CC1=CC=C(F)C=C1C MC41541 [0,2,0,0,0,0|2,0,0]=4 1452 B9R1.69 CC1=CC=C(F)C=C1N CS20370 [0,2,0,0,0,0|1,0,0]=3 1453 B9R1.69 CC1=CC=C(I)C(N)=N1 CS13037 [0,2,0,0,0,0|2,0,0]=4 1454 B9R1.69 CC1=CC=C(N)C(Br)=N1 CS19459 [0,2,0,0,0,0|2,0,0]=4 1455 B9R1.69 CC1=CC=C(N)C(C)=N1 CS19572 [0,2,0,0,0,0|2,0,0]=4 1456 B9R1.69 CC1=CC=C(N)C(Cl)=N1 CS19471 [0,2,0,0,0,0|2,0,0]=4 1457 B9R1.69 CC1=CC=C(N)C(N)=C1 CS21925 [0,2,0,0,0,0|1,0,0]=3 1458 B9R1.69 CC1=CC=C(N)C(N)=N1 MC427322 [0,2,0,0,0,0|2,0,0]=4 1459 B9R1.69 CC1=CC=C(N)C(N)=N1 MC427509 [0,2,0,0,0,0|2,0,0]=4 1460 B9R1.69 CC1=CC=C(N)C(O)=N1 MC33453 [0,2,0,0,0,0|2,0,0]=4 1461 B9R1.69 CC1=CC=C(O)C(N)=N1 MC431086 [0,2,0,0,0,0|2,0,0]=4 1462 B9R1.69 CC1=CC=C(O)C(O)=C1 CS14435 [0,2,0,0,0,0|2,0,0]=4 1463 B9R1.69 CC1=CN=C(Br)C(N)=C1 MC20317 [0,2,0,0,0,0|2,0,0]=4 1464 B9R1.69 CC1=CN=C(Br)C=C1N CS16645 [0,2,0,0,0,0|0,0,0]=2 1465 B9R1.69 CC1=CN=C(C)C=C1Br MC107156 [0,2,0,0,0,0|1,0,0]=3 1466 B9R1.69 CC1=CN=C(C)C=C1Cl CS15163 [0,2,0,0,0,0|1,0,0]=3 1467 B9R1.69 CC1=CN=C(C)C=C1N MC111434 [0,2,0,0,0,0|0,0,0]=2 1468 B9R1.69 CC1=CN=C(C)N=C1N CS17171 [0,2,0,0,0,0|1,0,0]=3 1469 B9R1.69 CC1=CN=C(Cl)C(N)=C1 CS19472 [0,2,0,0,0,0|2,0,0]=4 1470 B9R1.69 CC1=CN=C(Cl)C=C1Br MC115935 [0,2,0,0,0,0|1,0,0]=3 1471 B9R1.69 CC1=CN=C(Cl)C=C1Cl MC20301 [0,2,0,0,0,0|1,0,0]=3 1472 B9R1.69 CC1=CN=C(Cl)C=C1F MC431381 [0,2,0,0,0,0|1,0,0]=3 1473 B9R1.69 CC1=CN=C(Cl)C=C1N CS14350 [0,2,0,0,0,0|0,0,0]=2 1474 B9R1.69 CC1=CN=C(Cl)N=C1Cl CS17479 [0,2,0,0,0,0|2,0,0]=4 1475 B9R1.69 CC1=CN=C(Cl)N=C1N CS22545 [0,2,0,0,0,0|1,0,0]=3 1476 B9R1.69 CC1=CN=C(F)C(N)=C1 MC430819 [0,2,0,0,0,0|2,0,0]=4 1477 B9R1.69 CC1=CN=C(F)C=C1Br MC430278 [0,2,0,0,0,0|1,0,0]=3 1478 B9R1.69 CC1=CN=C(F)C=C1I CS18758 [0,2,0,0,0,0|1,0,0]=3 1479 B9R1.69 CC1=CN=C(N)C(Br)=C1 CS19456 [0,2,0,0,0,0|2,0,0]=4 1480 B9R1.69 CC1=CN=C(N)C(C)=C1 MC427372 [0,2,0,0,0,0|2,0,0]=4 1481 B9R1.69 CC1=CN=C(N)C(Cl)=C1 MC103285 [0,2,0,0,0,0|2,0,0]=4 1482 B9R1.69 CC1=CN=C(N)C(F)=C1 MC433035 [0,2,0,0,0,0|2,0,0]=4 1483 B9R1.69 CC1=CN=C(N)C(I)=C1 MC425469 [0,2,0,0,0,0|2,0,0]=4 1484 B9R1.69 CC1=CN=C(N)C(N)=C1 CS12089 [0,2,0,0,0,0|2,0,0]=4 1485 B9R1.69 CC1=CN=C(N)C=C1C MC110553 [0,2,0,0,0,0|1,0,0]=3 1486 B9R1.69 CC1=CN=C(N)N=C1Cl CS13071 [0,2,0,0,0,0|2,0,0]=4 1487 B9R1.69 CC1=CN=C(N)NC1=O MC443213 [0,2,0,0,0,0|2,0,0]=4 1488 B9R1.69 CC1=CNC(=O)C(N)=C1 CS21574 [0,2,0,0,0,0|2,0,0]=4 1489 B9R1.69 CC1=CNC(=O)N=C1N CS18115 [0,2,0,0,0,0|1,0,1]=4 1490 B9R1.69 CC1=NC(Br)=CC=C1N CS13574 [0,2,0,0,0,0|2,0,0]=4 1491 B9R1.69 CC1=NC(Br)=NC=C1Br MC441030 [0,2,0,0,0,0|2,0,0]=4 1492 B9R1.69 CC1=NC(Br)=NC=C1N MC443750 [0,2,0,0,0,0|2,0,0]=4 1493 B9R1.69 CC1=NC(Cl)=CC=C1N CS13794 [0,2,0,0,0,0|2,0,0]=4 1494 B9R1.69 CC1=NC(Cl)=NC=C1Br CS12644 [0,2,0,0,0,0|2,0,0]=4 1495 B9R1.69 CC1=NC(Cl)=NC=C1F CS14202 [0,2,0,0,0,0|2,0,0]=4 1496 B9R1.69 CC1=NC(N)=CC=C1N MC427482 [0,2,0,0,0,0|2,0,0]=4 1497 B9R1.69 CC1=NC(N)=NC=C1Br CS19861 [0,2,0,0,0,0|2,0,0]=4 1498 B9R1.69 CC1=NC=C(Br)C(=O)N1 CS17891 [0,2,0,0,0,0|2,0,0]=4 1499 B9R1.69 CC1=NC=C(Br)C(Cl)=N1 CS14459 [0,2,0,0,0,0|2,0,0]=4 1500 B9R1.69 CC1=NC=C(Br)C(O)=N1 CS10273 [0,2,0,0,0,0|2,0,0]=4 1501 B9R1.69 CC1=NC=C(Br)C=C1N CS10276 [0,2,0,0,0,0|2,0,0]=4 1502 B9R1.69 CC1=NC=C(Cl)C(N)=C1 MC105902 [0,2,0,0,0,0|0,0,0]=2 1503 B9R1.69 CC1=NC=C(F)C(=O)N1 CS14592 [0,2,0,0,0,0|2,0,0]=4 1504 B9R1.69 CC1=NC=C(F)C(Br)=C1 CS16271 [0,2,0,0,0,0|1,0,0]=3 1505 B9R1.69 CC1=NC=C(F)C(Cl)=C1 MC431999 [0,2,0,0,0,0|1,0,0]=3 1506 B9R1.69 CC1=NC=C(F)C(Cl)=N1 CS12957 [0,2,0,0,0,0|2,0,0]=4 1507 B9R1.69 CC1=NC=C(N)C(=O)N1 CS14824 [0,2,0,0,0,0|2,0,0]=4 1508 B9R1.69 CC1=NC=C(N)C(C)=N1 CS14188 [0,2,0,0,0,0|2,0,0]=4 1509 B9R1.69 CC1=NC=C(N)C(Cl)=N1 CS13251 [0,2,0,0,0,0|2,0,0]=4 1510 B9R1.69 CC1=NC=C(O)C(C)=N1 CS16008 [0,2,0,0,0,0|2,0,0]=4 1511 B9R1.69 CC1=[N+]([O-])C=CC(Br)=C1 MC106090 [0,2,0,0,0,0|1,0,1]=4 1512 B9R1.69 CC1=[N+]([O-])C=CC(Cl)=C1 MC106091 [0,2,0,0,0,0|1,0,1]=4 1513 B9R1.69 CN1C=C(Br)N=CC1=O CS12933 [0,2,0,0,0,0|2,0,0]=4 1514 B9R1.69 CN1C=C(N)C=CC1=O MC442264 [0,2,0,0,0,0|2,0,0]=4 1515 B9R1.69 CN1C=CC(=O)C(O)=C1 CS17435 [0,2,0,0,0,0|1,0,1]=4 1516 B9R1.69 CN1C=CC(Br)=CC1=O CS12571 [0,2,0,0,0,0|1,0,1]=4 1517 B9R1.69 CN1C=CC(I)=CC1=O MC442287 [0,2,0,0,0,0|1,0,1]=4 1518 B9R1.69 CN1C=CC(N)=CC1=O MC425211 [0,2,0,0,0,0|0,0,1]=3 1519 B9R1.69 CN1C=CC(N)=CC1=O MC444312 [0,2,0,0,0,0|0,0,1]=3 1520 B9R1.69 CN1C=CC(N)=NC1=O MC425150 [0,2,0,0,0,0|1,0,1]=4 1521 B9R1.69 CN1C=NC(Cl)=CC1=O CS14349 [0,2,0,0,0,0|2,0,0]=4 1522 B9R1.69 CN1C=NC(N)=CC1=O MC102813 [0,2,0,0,0,0|1,0,1]=4 1523 B9R1.69 CN1N=CC(N)=CC1=O MC104084 [0,2,0,0,0,0|1,0,1]=4 1524 B9R1.69 Cc1ccc(Cl)c(C)c1 MC433524 [0,2,0,0,0,0|2,0,0]=4 1525 B9R1.69 ClC1=C(Br)C=C(I)C=C1 MC41462 [0,2,0,0,0,0|2,0,0]=4 1526 B9R1.69 ClC1=C(Br)C=CC(I)=C1 CS12748 [0,2,0,0,0,0|2,0,0]=4 1527 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 CS18812 [0,2,0,0,0,0|2,0,0]=4 1528 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 MC30098 [0,2,0,0,0,0|2,0,0]=4 1529 B9R1.69 ClC1=C(I)C=C(Br)C=C1 MC41463 [0,2,0,0,0,0|2,0,0]=4 1530 B9R1.69 ClC1=C(I)C=CC(Br)=C1 MC33105 [0,2,0,0,0,0|2,0,0]=4 1531 B9R1.69 ClC1=CC(Br)=C(Br)C=C1 MC41470 [0,2,0,0,0,0|2,0,0]=4 1532 B9R1.69 ClC1=CC(Br)=C(Cl)C=C1 MC30177 [0,2,0,0,0,0|2,0,0]=4 1533 B9R1.69 ClC1=CC(Br)=C(Cl)N=N1 CS15693 [0,2,0,0,0,0|2,0,0]=4 1534 B9R1.69 ClC1=CC(Br)=C(I)C=C1 CS21351 [0,2,0,0,0,0|2,0,0]=4 1535 B9R1.69 ClC1=CC(Br)=NC=C1Br MC432382 [0,2,0,0,0,0|1,0,0]=3 1536 B9R1.69 ClC1=CC(Br)=NC=C1I MC100278 [0,2,0,0,0,0|1,0,0]=3 1537 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 CS18636 [0,2,0,0,0,0|2,0,0]=4 1538 B9R1.69 ClC1=CC(Cl)=C(Cl)N=N1 CS21922 [0,2,0,0,0,0|2,0,0]=4 1539 B9R1.69 ClC1=CC(Cl)=NC=C1Br CS10253 [0,2,0,0,0,0|1,0,0]=3 1540 B9R1.69 ClC1=CC(I)=C(Br)C=C1 CS20652 [0,2,0,0,0,0|2,0,0]=4 1541 B9R1.69 ClC1=CN=C(Cl)C=C1Br CS12673 [0,2,0,0,0,0|1,0,0]=3 1542 B9R1.69 ClC1=CN=C(Cl)C=C1I MC432198 [0,2,0,0,0,0|1,0,0]=3 1543 B9R1.69 ClC1=CN=C(Cl)N=C1Cl CS16824 [0,2,0,0,0,0|2,0,0]=4 1544 B9R1.69 ClC1=NC=C(Br)C(Cl)=N1 CS16790 [0,2,0,0,0,0|2,0,0]=4 1545 B9R1.69 ClC1=NC=C(I)C(Cl)=N1 CS16795 [0,2,0,0,0,0|2,0,0]=4 1546 B9R1.69 FC1=C(Br)C=C(Br)C=C1 MC20168 [0,2,0,0,0,0|2,0,0]=4 1547 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 CS18841 [0,2,0,0,0,0|2,0,0]=4 1548 B9R1.69 FC1=C(Br)C=C(I)C=C1 CS12590 [0,2,0,0,0,0|2,0,0]=4 1549 B9R1.69 FC1=C(Br)C=CC(Br)=C1 CS18653 [0,2,0,0,0,0|2,0,0]=4 1550 B9R1.69 FC1=C(Br)C=CC(Cl)=C1 MC30231 [0,2,0,0,0,0|2,0,0]=4 1551 B9R1.69 FC1=C(Br)C=CC(I)=C1 CS18663 [0,2,0,0,0,0|2,0,0]=4 1552 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 CS19184 [0,2,0,0,0,0|2,0,0]=4 1553 B9R1.69 FC1=C(Cl)C=C(Cl)C=C1 MC41482 [0,2,0,0,0,0|2,0,0]=4 1554 B9R1.69 FC1=C(Cl)C=C(I)C=C1 MC41474 [0,2,0,0,0,0|2,0,0]=4 1555 B9R1.69 FC1=C(Cl)C=C(S)C=C1 MC20125 [0,2,0,0,0,0|2,0,0]=4 1556 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 CS19182 [0,2,0,0,0,0|2,0,0]=4 1557 B9R1.69 FC1=C(Cl)C=CC(Cl)=C1 MC41483 [0,2,0,0,0,0|2,0,0]=4 1558 B9R1.69 FC1=C(Cl)C=CC(I)=C1 CS18849 [0,2,0,0,0,0|2,0,0]=4 1559 B9R1.69 FC1=C(F)C=C(Br)C=C1 MC41466 [0,2,0,0,0,0|2,0,0]=4 1560 B9R1.69 FC1=C(F)C=C(Cl)C=C1 MC41472 [0,2,0,0,0,0|2,0,0]=4 1561 B9R1.69 FC1=C(F)C=C(I)C=C1 MC41486 [0,2,0,0,0,0|2,0,0]=4 1562 B9R1.69 FC1=C(F)C=C(S)C=C1 MC41406 [0,2,0,0,0,0|2,0,0]=4 1563 B9R1.69 FC1=C(I)C=C(Br)C=C1 CS22852 [0,2,0,0,0,0|2,0,0]=4 1564 B9R1.69 FC1=C(I)C=CC(Br)=C1 CS22850 [0,2,0,0,0,0|2,0,0]=4 1565 B9R1.69 FC1=C(I)C=CC(Cl)=C1 MC41476 [0,2,0,0,0,0|2,0,0]=4 1566 B9R1.69 FC1=C(S)C=CC(Br)=C1 MC41402 [0,2,0,0,0,0|2,0,0]=4 1567 B9R1.69 FC1=CC(Br)=C(Br)C=C1 MC433507 [0,2,0,0,0,0|2,0,0]=4 1568 B9R1.69 FC1=CC(Br)=C(Cl)C=C1 CS18847 [0,2,0,0,0,0|2,0,0]=4 1569 B9R1.69 FC1=CC(Br)=C(F)C=C1 CS19044 [0,2,0,0,0,0|2,0,0]=4 1570 B9R1.69 FC1=CC(Br)=C(I)C=C1 CS18665 [0,2,0,0,0,0|2,0,0]=4 1571 B9R1.69 FC1=CC(Br)=NC=C1Br MC432162 [0,2,0,0,0,0|1,0,0]=3 1572 B9R1.69 FC1=CC(Br)=NC=C1Cl MC432161 [0,2,0,0,0,0|1,0,0]=3 1573 B9R1.69 FC1=CC(Cl)=C(Br)C=C1 MC41460 [0,2,0,0,0,0|2,0,0]=4 1574 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 MC33048 [0,2,0,0,0,0|2,0,0]=4 1575 B9R1.69 FC1=CC(Cl)=C(F)C=C1 MC41471 [0,2,0,0,0,0|2,0,0]=4 1576 B9R1.69 FC1=CC(Cl)=C(S)C=C1 MC20124 [0,2,0,0,0,0|2,0,0]=4 1577 B9R1.69 FC1=CC(Cl)=NC=C1Br MC429362 [0,2,0,0,0,0|1,0,0]=3 1578 B9R1.69 FC1=CC(F)=C(Br)C=C1 MC30162 [0,2,0,0,0,0|2,0,0]=4 1579 B9R1.69 FC1=CC(F)=C(Cl)C=C1 MC33047 [0,2,0,0,0,0|2,0,0]=4 1580 B9R1.69 FC1=CC(F)=C(F)C=C1 MC41495 [0,2,0,0,0,0|2,0,0]=4 1581 B9R1.69 FC1=CC(F)=C(I)C=C1 MC33081 [0,2,0,0,0,0|2,0,0]=4 1582 B9R1.69 FC1=CC(F)=C(S)C=C1 MC41404 [0,2,0,0,0,0|2,0,0]=4 1583 B9R1.69 FC1=CC(F)=NC=C1Br MC431863 [0,2,0,0,0,0|1,0,0]=3 1584 B9R1.69 FC1=CC(F)=NC=C1I MC427520 [0,2,0,0,0,0|1,0,0]=3 1585 B9R1.69 FC1=CC(I)=C(Br)C=C1 MC429394 [0,2,0,0,0,0|2,0,0]=4 1586 B9R1.69 FC1=CC(I)=C(Cl)C=C1 MC433497 [0,2,0,0,0,0|2,0,0]=4 1587 B9R1.69 FC1=CC(I)=C(F)C=C1 MC41487 [0,2,0,0,0,0|2,0,0]=4 1588 B9R1.69 FC1=CN=C(Br)C=C1Br MC431065 [0,2,0,0,0,0|1,0,0]=3 1589 B9R1.69 FC1=CN=C(Br)C=C1Cl CS15366 [0,2,0,0,0,0|1,0,0]=3 1590 B9R1.69 FC1=CN=C(Cl)C=C1Br CS19582 [0,2,0,0,0,0|1,0,0]=3 1591 B9R1.69 FC1=CN=C(Cl)C=C1Cl MC427226 [0,2,0,0,0,0|1,0,0]=3 1592 B9R1.69 FC1=CN=C(Cl)C=C1I CS21461 [0,2,0,0,0,0|1,0,0]=3 1593 B9R1.69 FC1=CN=C(Cl)N=C1Cl CS14094 [0,2,0,0,0,0|2,0,0]=4 1594 B9R1.69 FC1=CN=C(F)C=C1Cl MC33496 [0,2,0,0,0,0|1,0,0]=3 1595 B9R1.69 FC1=CN=C(F)C=C1F MC430890 [0,2,0,0,0,0|1,0,0]=3 1596 B9R1.69 FC1=CN=C(F)N=C1F MC41656 [0,2,0,0,0,0|2,0,0]=4 1597 B9R1.69 FC1=NC=C(Br)C(Cl)=C1 MC431791 [0,2,0,0,0,0|1,0,0]=3 1598 B9R1.69 FC1=NC=C(Br)C(F)=N1 CS14029 [0,2,0,0,0,0|2,0,0]=4 1599 B9R1.69 FC1=NC=C(Cl)C(I)=C1 MC20356 [0,2,0,0,0,0|1,0,0]=3 1600 B9R1.69 Fc1ccc(I)c(Cl)c1 CS19647 [0,2,0,0,0,0|2,0,0]=4 1601 B9R1.69 NC1=C(Br)C=C(Br)C=C1 MC33171 [0,2,0,0,0,0|1,0,0]=3 1602 B9R1.69 NC1=C(Br)C=C(Cl)C=C1 CS18991 [0,2,0,0,0,0|1,0,0]=3 1603 B9R1.69 NC1=C(Br)C=C(Cl)N=N1 CS12417 [0,2,0,0,0,0|2,0,0]=4 1604 B9R1.69 NC1=C(Br)C=C(F)C=C1 MC40868 [0,2,0,0,0,0|1,0,0]=3 1605 B9R1.69 NC1=C(Br)C=C(I)C=C1 CS21357 [0,2,0,0,0,0|1,0,0]=3 1606 B9R1.69 NC1=C(Br)C=C(O)C=C1 MC41139 [0,2,0,0,0,0|1,0,0]=3 1607 B9R1.69 NC1=C(Br)C=CC(Br)=C1 CS18980 [0,2,0,0,0,0|1,0,0]=3 1608 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 CS18496 [0,2,0,0,0,0|1,0,0]=3 1609 B9R1.69 NC1=C(Br)C=CC(F)=C1 CS22951 [0,2,0,0,0,0|1,0,0]=3 1610 B9R1.69 NC1=C(Br)C=CC(O)=C1 CS14504 [0,2,0,0,0,0|1,0,0]=3 1611 B9R1.69 NC1=C(Cl)C=C(Br)C=C1 CS18989 [0,2,0,0,0,0|1,0,0]=3 1612 B9R1.69 NC1=C(Cl)C=C(Cl)C=C1 CS21094 [0,2,0,0,0,0|1,0,0]=3 1613 B9R1.69 NC1=C(Cl)C=C(Cl)N=C1 CS18446 [0,2,0,0,0,0|1,0,0]=3 1614 B9R1.69 NC1=C(Cl)C=C(F)C=C1 MC30032 [0,2,0,0,0,0|1,0,0]=3 1615 B9R1.69 NC1=C(Cl)C=C(O)C=C1 CS18805 [0,2,0,0,0,0|1,0,0]=3 1616 B9R1.69 NC1=C(Cl)C=C(O)C=C1 MC10180 [0,2,0,0,0,0|1,0,0]=3 1617 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 CS15250 [0,2,0,0,0,0|1,0,0]=3 1618 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 CS21140 [0,2,0,0,0,0|1,0,0]=3 1619 B9R1.69 NC1=C(Cl)C=CC(F)=C1 CS22962 [0,2,0,0,0,0|1,0,0]=3 1620 B9R1.69 NC1=C(Cl)N=NC(Cl)=C1 CS15012 [0,2,0,0,0,0|1,0,0]=3 1621 B9R1.69 NC1=C(F)C=C(Br)C=C1 CS22953 [0,2,0,0,0,0|1,0,0]=3 1622 B9R1.69 NC1=C(F)C=C(Cl)C=C1 CS22965 [0,2,0,0,0,0|1,0,0]=3 1623 B9R1.69 NC1=C(F)C=C(F)C=C1 CS19091 [0,2,0,0,0,0|1,0,0]=3 1624 B9R1.69 NC1=C(F)C=C(I)C=C1 CS19120 [0,2,0,0,0,0|1,0,0]=3 1625 B9R1.69 NC1=C(F)C=C(O)C=C1 CS23017 [0,2,0,0,0,0|1,0,0]=3 1626 B9R1.69 NC1=C(F)C=CC(Br)=C1 CS22955 [0,2,0,0,0,0|1,0,0]=3 1627 B9R1.69 NC1=C(F)C=CC(Cl)=C1 MC30003 [0,2,0,0,0,0|1,0,0]=3 1628 B9R1.69 NC1=C(F)C=CC(F)=C1 CS22979 [0,2,0,0,0,0|1,0,0]=3 1629 B9R1.69 NC1=C(F)C=CC(I)=C1 CS19543 [0,2,0,0,0,0|1,0,0]=3 1630 B9R1.69 NC1=C(F)C=CC(O)=C1 CS19712 [0,2,0,0,0,0|1,0,0]=3 1631 B9R1.69 NC1=C(F)C=CC(O)=C1 MC433346 [0,2,0,0,0,0|1,0,0]=3 1632 B9R1.69 NC1=C(F)N=NC(F)=C1 MC432130 [0,2,0,0,0,0|1,0,0]=3 1633 B9R1.69 NC1=C(I)C=C(Br)C=C1 CS22647 [0,2,0,0,0,0|1,0,0]=3 1634 B9R1.69 NC1=C(I)C=C(Cl)C=C1 CS15394 [0,2,0,0,0,0|1,0,0]=3 1635 B9R1.69 NC1=C(I)C=C(F)C=C1 CS19121 [0,2,0,0,0,0|1,0,0]=3 1636 B9R1.69 NC1=C(I)C=CC(Br)=C1 MC30214 [0,2,0,0,0,0|1,0,0]=3 1637 B9R1.69 NC1=C(I)C=CC(Cl)=C1 CS18421 [0,2,0,0,0,0|1,0,0]=3 1638 B9R1.69 NC1=C(I)C=CC(F)=C1 CS22986 [0,2,0,0,0,0|1,0,0]=3 1639 B9R1.69 NC1=C(I)N=C(Br)C=C1 MC427564 [0,2,0,0,0,0|2,0,0]=4 1640 B9R1.69 NC1=C(N)C=C(Br)N=C1 MC425209 [0,2,0,0,0,0|0,0,0]=2 1641 B9R1.69 NC1=C(N)C=C(Cl)N=C1 MC33385 [0,2,0,0,0,0|0,0,0]=2 1642 B9R1.69 NC1=C(N)C=C(F)N=C1 MC425193 [0,2,0,0,0,0|0,0,0]=2 1643 B9R1.69 NC1=C(N)C=C(I)C=C1 MC30303 [0,2,0,0,0,0|1,0,0]=3 1644 B9R1.69 NC1=C(O)C=C(Br)C=C1 CS21272 [0,2,0,0,0,0|1,0,0]=3 1645 B9R1.69 NC1=C(O)C=C(Cl)C=C1 CS19300 [0,2,0,0,0,0|1,0,0]=3 1646 B9R1.69 NC1=C(O)C=C(F)C=C1 CS23016 [0,2,0,0,0,0|1,0,0]=3 1647 B9R1.69 NC1=C(O)C=C(O)C=C1 CS22592 [0,2,0,0,0,0|1,0,0]=3 1648 B9R1.69 NC1=C(O)C=CC(Br)=C1 CS14311 [0,2,0,0,0,0|1,0,0]=3 1649 B9R1.69 NC1=C(O)C=CC(Cl)=C1 CS16374 [0,2,0,0,0,0|1,0,0]=3 1650 B9R1.69 NC1=C(O)C=CC(F)=C1 MC20123 [0,2,0,0,0,0|1,0,0]=3 1651 B9R1.69 NC1=C(O)C=NC(Cl)=C1 MC432273 [0,2,0,0,0,0|0,0,0]=2 1652 B9R1.69 NC1=CC(Br)=C(Br)N=C1 CS20036 [0,2,0,0,0,0|2,0,0]=4 1653 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 CS22147 [0,2,0,0,0,0|1,0,0]=3 1654 B9R1.69 NC1=CC(Br)=C(Cl)N=C1 CS13590 [0,2,0,0,0,0|2,0,0]=4 1655 B9R1.69 NC1=CC(Br)=C(F)C=C1 CS15522 [0,2,0,0,0,0|1,0,0]=3 1656 B9R1.69 NC1=CC(Br)=C(F)N=C1 CS21541 [0,2,0,0,0,0|2,0,0]=4 1657 B9R1.69 NC1=CC(Br)=C(N)C=C1 MC433501 [0,2,0,0,0,0|1,0,0]=3 1658 B9R1.69 NC1=CC(Br)=C(O)C=C1 MC30074 [0,2,0,0,0,0|1,0,0]=3 1659 B9R1.69 NC1=CC(Br)=CN=C1Br MC425626 [0,2,0,0,0,0|2,0,0]=4 1660 B9R1.69 NC1=CC(Br)=CN=C1Cl CS15152 [0,2,0,0,0,0|2,0,0]=4 1661 B9R1.69 NC1=CC(Br)=CN=C1F CS17338 [0,2,0,0,0,0|2,0,0]=4 1662 B9R1.69 NC1=CC(Br)=CN=C1N CS14253 [0,2,0,0,0,0|2,0,0]=4 1663 B9R1.69 NC1=CC(Br)=CN=C1O CS14285 [0,2,0,0,0,0|2,0,0]=4 1664 B9R1.69 NC1=CC(Br)=NC=C1Cl MC431883 [0,2,0,0,0,0|0,0,0]=2 1665 B9R1.69 NC1=CC(Br)=NC=C1F MC431759 [0,2,0,0,0,0|0,0,0]=2 1666 B9R1.69 NC1=CC(Br)=NC=C1I MC431173 [0,2,0,0,0,0|0,0,0]=2 1667 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 CS18864 [0,2,0,0,0,0|1,0,0]=3 1668 B9R1.69 NC1=CC(Cl)=C(Br)N=C1 MC442224 [0,2,0,0,0,0|2,0,0]=4 1669 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 CS21929 [0,2,0,0,0,0|1,0,0]=3 1670 B9R1.69 NC1=CC(Cl)=C(Cl)N=C1 CS19436 [0,2,0,0,0,0|2,0,0]=4 1671 B9R1.69 NC1=CC(Cl)=C(F)C=C1 CS19039 [0,2,0,0,0,0|1,0,0]=3 1672 B9R1.69 NC1=CC(Cl)=C(O)C=C1 CS19309 [0,2,0,0,0,0|1,0,0]=3 1673 B9R1.69 NC1=CC(Cl)=CN=C1Br CS16256 [0,2,0,0,0,0|2,0,0]=4 1674 B9R1.69 NC1=CC(Cl)=CN=C1Cl CS18479 [0,2,0,0,0,0|2,0,0]=4 1675 B9R1.69 NC1=CC(Cl)=CN=C1O MC110840 [0,2,0,0,0,0|2,0,0]=4 1676 B9R1.69 NC1=CC(Cl)=CN=C1O MC427141 [0,2,0,0,0,0|2,0,0]=4 1677 B9R1.69 NC1=CC(Cl)=NC=C1Cl MC102711 [0,2,0,0,0,0|0,0,0]=2 1678 B9R1.69 NC1=CC(Cl)=NC=C1F MC33244 [0,2,0,0,0,0|0,0,0]=2 1679 B9R1.69 NC1=CC(F)=C(Br)C=C1 CS22954 [0,2,0,0,0,0|1,0,0]=3 1680 B9R1.69 NC1=CC(F)=C(Cl)C=C1 CS22968 [0,2,0,0,0,0|1,0,0]=3 1681 B9R1.69 NC1=CC(F)=C(F)C=C1 MC40901 [0,2,0,0,0,0|1,0,0]=3 1682 B9R1.69 NC1=CC(F)=C(F)N=C1 MC432274 [0,2,0,0,0,0|2,0,0]=4 1683 B9R1.69 NC1=CC(F)=C(I)C=C1 CS22985 [0,2,0,0,0,0|1,0,0]=3 1684 B9R1.69 NC1=CC(F)=C(O)C=C1 MC30224 [0,2,0,0,0,0|1,0,0]=3 1685 B9R1.69 NC1=CC(F)=CN=C1Br MC20009 [0,2,0,0,0,0|2,0,0]=4 1686 B9R1.69 NC1=CC(F)=CN=C1Cl MC427548 [0,2,0,0,0,0|2,0,0]=4 1687 B9R1.69 NC1=CC(F)=NC=C1Br MC103398 [0,2,0,0,0,0|0,0,0]=2 1688 B9R1.69 NC1=CC(I)=C(N)C=C1 CS15658 [0,2,0,0,0,0|1,0,0]=3 1689 B9R1.69 NC1=CC(N)=C(Br)C=C1 MC433500 [0,2,0,0,0,0|1,0,0]=3 1690 B9R1.69 NC1=CC(N)=C(Cl)C=C1 CS14655 [0,2,0,0,0,0|1,0,0]=3 1691 B9R1.69 NC1=CC(N)=C(F)C=C1 CS23032 [0,2,0,0,0,0|1,0,0]=3 1692 B9R1.69 NC1=CC(N)=C(O)C=C1 CS16325 [0,2,0,0,0,0|1,0,0]=3 1693 B9R1.69 NC1=CC(O)=C(Cl)C=C1 MC433340 [0,2,0,0,0,0|1,0,0]=3 1694 B9R1.69 NC1=CC(O)=C(F)C=C1 CS13999 [0,2,0,0,0,0|1,0,0]=3 1695 B9R1.69 NC1=CC=C(Br)C(Br)=N1 MC20982 [0,2,0,0,0,0|2,0,0]=4 1696 B9R1.69 NC1=CC=C(Br)C=C1N CS19462 [0,2,0,0,0,0|1,0,0]=3 1697 B9R1.69 NC1=CC=C(Br)N=C1Br CS22704 [0,2,0,0,0,0|2,0,0]=4 1698 B9R1.69 NC1=CC=C(Br)N=C1Cl CS12982 [0,2,0,0,0,0|2,0,0]=4 1699 B9R1.69 NC1=CC=C(Br)N=C1N CS13154 [0,2,0,0,0,0|2,0,0]=4 1700 B9R1.69 NC1=CC=C(Br)NC1=O MC425557 [0,2,0,0,0,0|2,0,0]=4 1701 B9R1.69 NC1=CC=C(Cl)C=C1N CS23029 [0,2,0,0,0,0|1,0,0]=3 1702 B9R1.69 NC1=CC=C(Cl)N=C1Br MC443343 [0,2,0,0,0,0|2,0,0]=4 1703 B9R1.69 NC1=CC=C(Cl)N=C1Cl CS17483 [0,2,0,0,0,0|2,0,0]=4 1704 B9R1.69 NC1=CC=C(Cl)N=C1I MC41596 [0,2,0,0,0,0|2,0,0]=4 1705 B9R1.69 NC1=CC=C(Cl)N=C1N CS21009 [0,2,0,0,0,0|2,0,0]=4 1706 B9R1.69 NC1=CC=C(F)C(N)=N1 MC114913 [0,2,0,0,0,0|2,0,0]=4 1707 B9R1.69 NC1=CC=C(F)C=C1N CS19484 [0,2,0,0,0,0|1,0,0]=3 1708 B9R1.69 NC1=CC=C(F)N=C1Br CS15317 [0,2,0,0,0,0|2,0,0]=4 1709 B9R1.69 NC1=CC=C(F)N=C1Cl MC107913 [0,2,0,0,0,0|2,0,0]=4 1710 B9R1.69 NC1=CC=C(F)N=C1F MC442350 [0,2,0,0,0,0|2,0,0]=4 1711 B9R1.69 NC1=CC=C(I)C(N)=N1 MC33465 [0,2,0,0,0,0|2,0,0]=4 1712 B9R1.69 NC1=CN=C(Cl)N=C1Cl CS18066 [0,2,0,0,0,0|2,0,0]=4 1713 B9R1.69 NC1=CN=C(Cl)N=C1Cl CS18344 [0,2,0,0,0,0|2,0,0]=4 1714 B9R1.69 NC1=CN=C(Cl)N=C1N CS18008 [0,2,0,0,0,0|1,0,0]=3 1715 B9R1.69 NC1=CN=C(N)C=C1N MC105740 [0,2,0,0,0,0|0,0,0]=2 1716 B9R1.69 NC1=CN=C(N)N=C1N MC427333 [0,2,0,0,0,0|1,0,0]=3 1717 B9R1.69 NC1=NC(=O)NC=C1F CS22057 [0,2,0,0,0,0|1,0,1]=4 1718 B9R1.69 NC1=NC(Br)=C(Cl)C=C1 MC110828 [0,2,0,0,0,0|2,0,0]=4 1719 B9R1.69 NC1=NC(Br)=C(F)C=C1 MC431837 [0,2,0,0,0,0|2,0,0]=4 1720 B9R1.69 NC1=NC(Br)=CC=C1F MC431746 [0,2,0,0,0,0|2,0,0]=4 1721 B9R1.69 NC1=NC(Br)=CC=C1O CS15126 [0,2,0,0,0,0|2,0,0]=4 1722 B9R1.69 NC1=NC(Cl)=C(Cl)C=C1 MC431917 [0,2,0,0,0,0|2,0,0]=4 1723 B9R1.69 NC1=NC(Cl)=C(I)C=C1 MC425693 [0,2,0,0,0,0|2,0,0]=4 1724 B9R1.69 NC1=NC(Cl)=CC=C1Cl MC442670 [0,2,0,0,0,0|2,0,0]=4 1725 B9R1.69 NC1=NC(Cl)=CC=C1I CS13134 [0,2,0,0,0,0|2,0,0]=4 1726 B9R1.69 NC1=NC(Cl)=NC=C1Br CS18145 [0,2,0,0,0,0|1,0,0]=3 1727 B9R1.69 NC1=NC(Cl)=NC=C1Cl CS13487 [0,2,0,0,0,0|1,0,0]=3 1728 B9R1.69 NC1=NC(Cl)=NC=C1F CS22567 [0,2,0,0,0,0|1,0,0]=3 1729 B9R1.69 NC1=NC(Cl)=NC=C1I CS14422 [0,2,0,0,0,0|1,0,0]=3 1730 B9R1.69 NC1=NC(F)=C(Br)C=C1 MC432411 [0,2,0,0,0,0|2,0,0]=4 1731 B9R1.69 NC1=NC(F)=C(I)C=C1 CS15172 [0,2,0,0,0,0|2,0,0]=4 1732 B9R1.69 NC1=NC=C(Br)C(Br)=C1 CS16866 [0,2,0,0,0,0|1,0,0]=3 1733 B9R1.69 NC1=NC=C(Br)C(Cl)=C1 CS12672 [0,2,0,0,0,0|1,0,0]=3 1734 B9R1.69 NC1=NC=C(Br)C(F)=C1 CS16865 [0,2,0,0,0,0|1,0,0]=3 1735 B9R1.69 NC1=NC=C(Br)C(O)=N1 CS12513 [0,2,0,0,0,0|2,0,0]=4 1736 B9R1.69 NC1=NC=C(Br)C(O)=N1 CS21270 [0,2,0,0,0,0|2,0,0]=4 1737 B9R1.69 NC1=NC=C(Br)C=C1Br CS17443 [0,2,0,0,0,0|2,0,0]=4 1738 B9R1.69 NC1=NC=C(Br)C=C1Cl MC445144 [0,2,0,0,0,0|2,0,0]=4 1739 B9R1.69 NC1=NC=C(Br)C=C1F CS12629 [0,2,0,0,0,0|2,0,0]=4 1740 B9R1.69 NC1=NC=C(Br)C=C1I CS14238 [0,2,0,0,0,0|2,0,0]=4 1741 B9R1.69 NC1=NC=C(Br)C=C1O CS12337 [0,2,0,0,0,0|2,0,0]=4 1742 B9R1.69 NC1=NC=C(Cl)C(Br)=C1 MC443681 [0,2,0,0,0,0|1,0,0]=3 1743 B9R1.69 NC1=NC=C(Cl)C(Cl)=C1 MC33321 [0,2,0,0,0,0|1,0,0]=3 1744 B9R1.69 NC1=NC=C(Cl)C(Cl)=N1 CS12575 [0,2,0,0,0,0|2,0,0]=4 1745 B9R1.69 NC1=NC=C(Cl)C=C1Br CS14049 [0,2,0,0,0,0|2,0,0]=4 1746 B9R1.69 NC1=NC=C(Cl)C=C1Cl MC41597 [0,2,0,0,0,0|2,0,0]=4 1747 B9R1.69 NC1=NC=C(Cl)C=C1F CS18904 [0,2,0,0,0,0|2,0,0]=4 1748 B9R1.69 NC1=NC=C(Cl)C=C1I CS18161 [0,2,0,0,0,0|2,0,0]=4 1749 B9R1.69 NC1=NC=C(F)C(Cl)=N1 CS11916 [0,2,0,0,0,0|2,0,0]=4 1750 B9R1.69 NC1=NC=C(F)C(O)=C1 MC431832 [0,2,0,0,0,0|1,0,0]=3 1751 B9R1.69 NC1=NC=C(F)C=C1Br CS16185 [0,2,0,0,0,0|2,0,0]=4 1752 B9R1.69 NC1=NC=C(F)C=C1Cl CS17132 [0,2,0,0,0,0|2,0,0]=4 1753 B9R1.69 NC1=NC=C(F)C=C1F MC425905 [0,2,0,0,0,0|2,0,0]=4 1754 B9R1.69 NC1=NC=C(F)C=C1I MC430960 [0,2,0,0,0,0|2,0,0]=4 1755 B9R1.69 NC1=NC=C(F)C=C1O CS14876 [0,2,0,0,0,0|2,0,0]=4 1756 B9R1.69 NC1=NC=C(I)C(Br)=C1 CS16717 [0,2,0,0,0,0|1,0,0]=3 1757 B9R1.69 NC1=NC=C(I)C(Cl)=C1 MC20729 [0,2,0,0,0,0|1,0,0]=3 1758 B9R1.69 NC1=NC=C(I)C=C1Br CS22160 [0,2,0,0,0,0|2,0,0]=4 1759 B9R1.69 NC1=NC=C(I)C=C1F MC430182 [0,2,0,0,0,0|2,0,0]=4 1760 B9R1.69 O=C1C=C(Cl)C(Cl)=CN1 MC33345 [0,2,0,0,0,0|1,0,1]=4 1761 B9R1.69 O=C1NC(Cl)=NC=C1Br MC443818 [0,2,0,0,0,0|2,0,0]=4 1762 B9R1.69 O=C1NC(Cl)=NC=C1F CS19848 [0,2,0,0,0,0|2,0,0]=4 1763 B9R1.69 O=C1NN=C(Cl)C=C1Br CS15689 [0,2,0,0,0,0|2,0,0]=4 1764 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 CS15632 [0,2,0,0,0,0|2,0,0]=4 1765 B9R1.69 OC1=C(Br)C=C(Cl)N=C1 MC107085 [0,2,0,0,0,0|1,0,0]=3 1766 B9R1.69 OC1=C(Br)C=C(F)C=C1 MC10138 [0,2,0,0,0,0|2,0,0]=4 1767 B9R1.69 OC1=C(Br)C=C(I)C=C1 MC441118 [0,2,0,0,0,0|2,0,0]=4 1768 B9R1.69 OC1=C(Br)C=CC(Br)=C1 MC30180 [0,2,0,0,0,0|2,0,0]=4 1769 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 CS21372 [0,2,0,0,0,0|2,0,0]=4 1770 B9R1.69 OC1=C(Br)C=CC(F)=C1 MC20075 [0,2,0,0,0,0|2,0,0]=4 1771 B9R1.69 OC1=C(Br)C=CC(I)=C1 CS13046 [0,2,0,0,0,0|2,0,0]=4 1772 B9R1.69 OC1=C(Cl)C=C(Cl)C=C1 MC41180 [0,2,0,0,0,0|2,0,0]=4 1773 B9R1.69 OC1=C(Cl)C=C(F)C=C1 CS13904 [0,2,0,0,0,0|2,0,0]=4 1774 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 MC20037 [0,2,0,0,0,0|2,0,0]=4 1775 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 CS21143 [0,2,0,0,0,0|2,0,0]=4 1776 B9R1.69 OC1=C(Cl)C=CC(F)=C1 CS22918 [0,2,0,0,0,0|2,0,0]=4 1777 B9R1.69 OC1=C(Cl)N=NC(Cl)=C1 CS17048 [0,2,0,0,0,0|2,0,0]=4 1778 B9R1.69 OC1=C(F)C=C(Br)C=C1 CS22908 [0,2,0,0,0,0|2,0,0]=4 1779 B9R1.69 OC1=C(F)C=C(Cl)C=C1 MC41170 [0,2,0,0,0,0|2,0,0]=4 1780 B9R1.69 OC1=C(F)C=C(F)C=C1 CS19015 [0,2,0,0,0,0|2,0,0]=4 1781 B9R1.69 OC1=C(F)C=C(I)C=C1 MC433386 [0,2,0,0,0,0|2,0,0]=4 1782 B9R1.69 OC1=C(F)C=CC(Br)=C1 CS22910 [0,2,0,0,0,0|2,0,0]=4 1783 B9R1.69 OC1=C(F)C=CC(Cl)=C1 CS22920 [0,2,0,0,0,0|2,0,0]=4 1784 B9R1.69 OC1=C(F)C=CC(F)=C1 MC41184 [0,2,0,0,0,0|2,0,0]=4 1785 B9R1.69 OC1=C(F)C=CC(I)=C1 CS12536 [0,2,0,0,0,0|2,0,0]=4 1786 B9R1.69 OC1=C(I)C=C(Br)C=C1 MC433360 [0,2,0,0,0,0|2,0,0]=4 1787 B9R1.69 OC1=C(I)C=C(Cl)C=C1 CS22744 [0,2,0,0,0,0|2,0,0]=4 1788 B9R1.69 OC1=C(I)C=C(Cl)N=C1 MC432206 [0,2,0,0,0,0|1,0,0]=3 1789 B9R1.69 OC1=C(I)C=C(F)C=C1 CS13176 [0,2,0,0,0,0|2,0,0]=4 1790 B9R1.69 OC1=C(I)C=CC(Br)=C1 MC442822 [0,2,0,0,0,0|2,0,0]=4 1791 B9R1.69 OC1=C(I)C=CC(Cl)=C1 CS10328 [0,2,0,0,0,0|2,0,0]=4 1792 B9R1.69 OC1=C(I)C=CC(F)=C1 MC441216 [0,2,0,0,0,0|2,0,0]=4 1793 B9R1.69 OC1=C(I)C=CC(I)=C1 MC442225 [0,2,0,0,0,0|2,0,0]=4 1794 B9R1.69 OC1=CC(Br)=C(Br)C=C1 MC442091 [0,2,0,0,0,0|2,0,0]=4 1795 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 CS22149 [0,2,0,0,0,0|2,0,0]=4 1796 B9R1.69 OC1=CC(Br)=C(F)C=C1 CS22905 [0,2,0,0,0,0|2,0,0]=4 1797 B9R1.69 OC1=CC(Br)=NC=C1Br MC430329 [0,2,0,0,0,0|1,0,0]=3 1798 B9R1.69 OC1=CC(Br)=NC=C1Br MC430330 [0,2,0,0,0,0|1,0,0]=3 1799 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 MC20176 [0,2,0,0,0,0|2,0,0]=4 1800 B9R1.69 OC1=CC(Cl)=C(Cl)C=C1 MC41181 [0,2,0,0,0,0|2,0,0]=4 1801 B9R1.69 OC1=CC(Cl)=C(F)C=C1 MC33094 [0,2,0,0,0,0|2,0,0]=4 1802 B9R1.69 OC1=CC(Cl)=C(I)C=C1 MC30273 [0,2,0,0,0,0|2,0,0]=4 1803 B9R1.69 OC1=CC(Cl)=NC=C1I MC101996 [0,2,0,0,0,0|1,0,0]=3 1804 B9R1.69 OC1=CC(F)=C(Br)C=C1 CS22909 [0,2,0,0,0,0|2,0,0]=4 1805 B9R1.69 OC1=CC(F)=C(Cl)C=C1 CS22919 [0,2,0,0,0,0|2,0,0]=4 1806 B9R1.69 OC1=CC(F)=C(F)C=C1 CS22926 [0,2,0,0,0,0|2,0,0]=4 1807 B9R1.69 OC1=CC(F)=C(I)C=C1 CS15852 [0,2,0,0,0,0|2,0,0]=4 1808 B9R1.69 OC1=CC(F)=C(O)C=C1 MC20784 [0,2,0,0,0,0|2,0,0]=4 1809 B9R1.69 OC1=CC(I)=C(Cl)C=C1 MC433368 [0,2,0,0,0,0|2,0,0]=4 1810 B9R1.69 OC1=CC(I)=C(F)C=C1 MC442383 [0,2,0,0,0,0|2,0,0]=4 1811 B9R1.69 OC1=CC(O)=C(Br)C=C1 CS22703 [0,2,0,0,0,0|2,0,0]=4 1812 B9R1.69 OC1=CC(O)=C(F)C=C1 CS22989 [0,2,0,0,0,0|2,0,0]=4 1813 B9R1.69 OC1=CC=C(Br)C=C1O CS22676 [0,2,0,0,0,0|2,0,0]=4 1814 B9R1.69 OC1=NC=C(Cl)C(I)=C1 MC21156 [0,2,0,0,0,0|1,0,0]=3 1815 B9R1.69 OC1=NC=C(F)C(Br)=C1 MC114633 [0,2,0,0,0,0|1,0,0]=3 1816 B9R1.69 OC1=NC=C(F)C(I)=C1 MC432590 [0,2,0,0,0,0|1,0,0]=3 1817 B9R1.69 [O-]C1=C(F)C=C(Br)C=C1 MC113953 [0,2,0,0,0,0|2,0,0]=4 1818 B9R1.3 BrC1=NC=CC(Br)=C1Br MC427270 [0,2,0,0,0,0|1,0,0]=3 1819 B9R1.3 BrC1=NC=CC(Br)=C1I MC431175 [0,2,0,0,0,0|1,0,0]=3 1820 B9R1.3 Brc1cccc(Br)c1I MC433509 [0,2,0,0,0,0|2,0,0]=4 1821 B9R1.3 CC1=C(Br)C(Br)=NC=C1 CS20021 [0,2,0,0,0,0|1,0,0]=3 1822 B9R1.3 CC1=C(Br)C(Cl)=CC=C1 MC41498 [0,2,0,0,0,0|2,0,0]=4 1823 B9R1.3 CC1=C(Br)C(Cl)=NC=C1 CS14983 [0,2,0,0,0,0|1,0,0]=3 1824 B9R1.3 CC1=C(Br)C(Cl)=NC=N1 CS12379 [0,2,0,0,0,0|2,0,0]=4 1825 B9R1.3 CC1=C(Br)C(F)=CC=C1 MC30071 [0,2,0,0,0,0|2,0,0]=4 1826 B9R1.3 CC1=C(Br)C(F)=NC=C1 CS20037 [0,2,0,0,0,0|1,0,0]=3 1827 B9R1.3 CC1=C(Br)C(N)=NC=N1 CS12474 [0,2,0,0,0,0|1,0,0]=3 1828 B9R1.3 CC1=C(Br)C(O)=NC=C1 CS21575 [0,2,0,0,0,0|1,0,0]=3 1829 B9R1.3 CC1=C(Br)C(O)=NC=N1 MC106954 [0,2,0,0,0,0|2,0,0]=4 1830 B9R1.3 CC1=C(Br)C=CC=C1Br CS20164 [0,2,0,0,0,0|2,0,0]=4 1831 B9R1.3 CC1=C(Br)C=CC=C1F CS19838 [0,2,0,0,0,0|2,0,0]=4 1832 B9R1.3 CC1=C(Br)C=CC=C1I CS16145 [0,2,0,0,0,0|2,0,0]=4 1833 B9R1.3 CC1=C(Br)C=CN=C1Br MC111268 [0,2,0,0,0,0|1,0,0]=3 1834 B9R1.3 CC1=C(Br)C=CN=C1Cl CS21442 [0,2,0,0,0,0|1,0,0]=3 1835 B9R1.3 CC1=C(Br)C=CN=C1F CS21545 [0,2,0,0,0,0|1,0,0]=3 1836 B9R1.3 CC1=C(Br)C=NC=C1Br CS18996 [0,2,0,0,0,0|1,0,0]=3 1837 B9R1.3 CC1=C(Br)C=NC=C1F MC425678 [0,2,0,0,0,0|1,0,0]=3 1838 B9R1.3 CC1=C(C)C(=O)NC=C1 MC431551 [0,2,0,0,0,0|1,0,1]=4 1839 B9R1.3 CC1=C(C)C(Br)=CC=C1 CS19738 [0,2,0,0,0,0|2,0,0]=4 1840 B9R1.3 CC1=C(C)C(Cl)=NC=C1 MC445292 [0,2,0,0,0,0|1,0,0]=3 1841 B9R1.3 CC1=C(C)C(N)=NC=C1 CS14451 [0,2,0,0,0,0|1,0,0]=3 1842 B9R1.3 CC1=C(C)C(O)=NC=C1 MC431552 [0,2,0,0,0,0|1,0,0]=3 1843 B9R1.3 CC1=C(Cl)C=CC=C1Cl CS21173 [0,2,0,0,0,0|2,0,0]=4 1844 B9R1.3 CC1=C(Cl)C=CC=C1F MC41506 [0,2,0,0,0,0|2,0,0]=4 1845 B9R1.3 CC1=C(Cl)C=CC=C1I MC33135 [0,2,0,0,0,0|2,0,0]=4 1846 B9R1.3 CC1=C(Cl)C=NC=C1Cl MC20373 [0,2,0,0,0,0|1,0,0]=3 1847 B9R1.3 CC1=C(Cl)N=CN=C1Cl CS22507 [0,2,0,0,0,0|2,0,0]=4 1848 B9R1.3 CC1=C(Cl)N=CN=C1N CS10115 [0,2,0,0,0,0|1,0,0]=3 1849 B9R1.3 CC1=C(F)C(Br)=CC=C1 MC30221 [0,2,0,0,0,0|2,0,0]=4 1850 B9R1.3 CC1=C(F)C(Br)=NC=C1 CS19394 [0,2,0,0,0,0|1,0,0]=3 1851 B9R1.3 CC1=C(F)C(Cl)=NC=C1 CS19389 [0,2,0,0,0,0|1,0,0]=3 1852 B9R1.3 CC1=C(F)C(N)=NC=C1 MC433034 [0,2,0,0,0,0|1,0,0]=3 1853 B9R1.3 CC1=C(F)C(O)=NC=N1 MC113803 [0,2,0,0,0,0|2,0,0]=4 1854 B9R1.3 CC1=C(F)C=CC=C1F CS19669 [0,2,0,0,0,0|2,0,0]=4 1855 B9R1.3 CC1=C(F)N=CN=C1N MC100615 [0,2,0,0,0,0|1,0,0]=3 1856 B9R1.3 CC1=C(I)C(Cl)=CC=C1 CS20195 [0,2,0,0,0,0|2,0,0]=4 1857 B9R1.3 CC1=C(I)C(Cl)=NC=N1 CS22770 [0,2,0,0,0,0|2,0,0]=4 1858 B9R1.3 CC1=C(I)C(F)=CC=C1 CS20026 [0,2,0,0,0,0|2,0,0]=4 1859 B9R1.3 CC1=C(I)C(N)=NC=N1 CS10411 [0,2,0,0,0,0|1,0,0]=3 1860 B9R1.3 CC1=C(I)C=CN=C1Cl MC425783 [0,2,0,0,0,0|1,0,0]=3 1861 B9R1.3 CC1=C(I)C=CN=C1F CS18757 [0,2,0,0,0,0|1,0,0]=3 1862 B9R1.3 CC1=C(N)C(Br)=NC=C1 CS13575 [0,2,0,0,0,0|1,0,0]=3 1863 B9R1.3 CC1=C(N)C(Cl)=NC=C1 CS19470 [0,2,0,0,0,0|1,0,0]=3 1864 B9R1.3 CC1=C(N)C(N)=CC=C1 MC33098 [0,2,0,0,0,0|1,0,0]=3 1865 B9R1.3 CC1=C(N)C=CC=C1Br MC20171 [0,2,0,0,0,0|1,0,0]=3 1866 B9R1.3 CC1=C(N)C=CC=C1Cl CS16197 [0,2,0,0,0,0|1,0,0]=3 1867 B9R1.3 CC1=C(N)C=CC=C1F CS10512 [0,2,0,0,0,0|1,0,0]=3 1868 B9R1.3 CC1=C(N)C=CC=C1I CS21292 [0,2,0,0,0,0|1,0,0]=3 1869 B9R1.3 CC1=C(N)C=CN=C1Br MC111388 [0,2,0,0,0,0|0,0,0]=2 1870 B9R1.3 CC1=C(N)C=CN=C1Cl CS15414 [0,2,0,0,0,0|0,0,0]=2 1871 B9R1.3 CC1=C(N)C=CN=C1F MC432318 [0,2,0,0,0,0|0,0,0]=2 1872 B9R1.3 CC1=C(N)C=NC=C1Br CS14627 [0,2,0,0,0,0|1,0,0]=3 1873 B9R1.3 CC1=C(N)C=NC=C1F MC432128 [0,2,0,0,0,0|1,0,0]=3 1874 B9R1.3 CC1=C(O)C(=O)C=CO1 MC21095 [0,2,0,0,0,0|2,0,0]=4 1875 B9R1.3 CC1=C(O)C(Cl)=NC=C1 CS16152 [0,2,0,0,0,0|1,0,0]=3 1876 B9R1.3 CC1=C(O)C(O)=CC=C1 MC30145 [0,2,0,0,0,0|2,0,0]=4 1877 B9R1.3 CC1=C(O)C=CC=C1Br CS14415 [0,2,0,0,0,0|2,0,0]=4 1878 B9R1.3 CC1=C(O)C=CC=C1Cl CS22210 [0,2,0,0,0,0|2,0,0]=4 1879 B9R1.3 CC1=C(O)C=CC=C1F MC433104 [0,2,0,0,0,0|2,0,0]=4 1880 B9R1.3 CC1=C(O)C=CC=C1O MC20744 [0,2,0,0,0,0|2,0,0]=4 1881 B9R1.3 CC1=CC=CC(Br)=C1N CS10505 [0,2,0,0,0,0|1,0,0]=3 1882 B9R1.3 CC1=CC=CC(Br)=C1O MC41161 [0,2,0,0,0,0|2,0,0]=4 1883 B9R1.3 CC1=CC=CC(Br)=C1S MC111932 [0,2,0,0,0,0|2,0,0]=4 1884 B9R1.3 CC1=CC=CC(C)=C1Br CS19952 [0,2,0,0,0,0|2,0,0]=4 1885 B9R1.3 CC1=CC=CC(C)=C1Cl MC41533 [0,2,0,0,0,0|2,0,0]=4 1886 B9R1.3 CC1=CC=CC(C)=C1I MC41542 [0,2,0,0,0,0|2,0,0]=4 1887 B9R1.3 CC1=CC=CC(C)=C1N CS19754 [0,2,0,0,0,0|1,0,0]=3 1888 B9R1.3 CC1=CC=CC(C)=C1O CS21185 [0,2,0,0,0,0|2,0,0]=4 1889 B9R1.3 CC1=CC=CC(Cl)=C1C MC41535 [0,2,0,0,0,0|2,0,0]=4 1890 B9R1.3 CC1=CC=CC(Cl)=C1F CS22205 [0,2,0,0,0,0|2,0,0]=4 1891 B9R1.3 CC1=CC=CC(Cl)=C1N CS13397 [0,2,0,0,0,0|1,0,0]=3 1892 B9R1.3 CC1=CC=CC(F)=C1C MC30143 [0,2,0,0,0,0|2,0,0]=4 1893 B9R1.3 CC1=CC=CC(F)=C1F CS19914 [0,2,0,0,0,0|2,0,0]=4 1894 B9R1.3 CC1=CC=CC(F)=C1N CS10511 [0,2,0,0,0,0|1,0,0]=3 1895 B9R1.3 CC1=CC=CC(F)=C1O MC433389 [0,2,0,0,0,0|2,0,0]=4 1896 B9R1.3 CC1=CC=CC(N)=C1Br CS12669 [0,2,0,0,0,0|1,0,0]=3 1897 B9R1.3 CC1=CC=CC(N)=C1C MC40904 [0,2,0,0,0,0|1,0,0]=3 1898 B9R1.3 CC1=CC=CC(N)=C1F MC433020 [0,2,0,0,0,0|1,0,0]=3 1899 B9R1.3 CC1=CC=CC(N)=C1O CS13842 [0,2,0,0,0,0|1,0,0]=3 1900 B9R1.3 CC1=CC=CC(O)=C1C MC41190 [0,2,0,0,0,0|2,0,0]=4 1901 B9R1.3 CC1=CC=CC(O)=C1Cl MC443764 [0,2,0,0,0,0|2,0,0]=4 1902 B9R1.3 CC1=CC=CC(O)=C1F MC20207 [0,2,0,0,0,0|2,0,0]=4 1903 B9R1.3 CC1=CC=CC(O)=C1I MC442299 [0,2,0,0,0,0|2,0,0]=4 1904 B9R1.3 CC1=CC=CC(O)=C1N CS14085 [0,2,0,0,0,0|1,0,0]=3 1905 B9R1.3 CC1=CC=CC(S)=C1C MC20384 [0,2,0,0,0,0|2,0,0]=4 1906 B9R1.3 CC1=CN=CC(Br)=C1N CS19435 [0,2,0,0,0,0|0,0,0]=2 1907 B9R1.3 CC1=CN=CC(F)=C1N MC432259 [0,2,0,0,0,0|0,0,0]=2 1908 B9R1.3 CC1=CN=CC(I)=C1N MC430398 [0,2,0,0,0,0|0,0,0]=2 1909 B9R1.3 CC1=CN=CC(N)=C1N CS12081 [0,2,0,0,0,0|0,0,0]=2 1910 B9R1.3 CC1=NC=CC(Br)=C1C CS15313 [0,2,0,0,0,0|1,0,0]=3 1911 B9R1.3 CC1=NC=CC(Br)=C1F CS17321 [0,2,0,0,0,0|1,0,0]=3 1912 B9R1.3 CC1=NC=CC(C)=C1O MC430625 [0,2,0,0,0,0|1,0,0]=3 1913 B9R1.3 CC1=NC=CC(Cl)=C1C MC442671 [0,2,0,0,0,0|1,0,0]=3 1914 B9R1.3 CC1=NC=CC(Cl)=C1N CS15139 [0,2,0,0,0,0|1,0,0]=3 1915 B9R1.3 CC1=NC=CC(N)=C1Br MC432357 [0,2,0,0,0,0|0,0,0]=2 1916 B9R1.3 CC1=NC=CC(N)=C1C CS14420 [0,2,0,0,0,0|0,0,0]=2 1917 B9R1.3 CC1=NC=CC(N)=C1N CS21697 [0,2,0,0,0,0|0,0,0]=2 1918 B9R1.3 CC1=NC=NC(C)=C1Br MC425280 [0,2,0,0,0,0|2,0,0]=4 1919 B9R1.3 CN1C=CC=C(N)C1=O MC425210 [0,2,0,0,0,0|2,0,0]=4 1920 B9R1.3 ClC1=C(Br)C=CC=C1Br CS15022 [0,2,0,0,0,0|2,0,0]=4 1921 B9R1.3 ClC1=C(Br)C=CN=C1Br MC427531 [0,2,0,0,0,0|1,0,0]=3 1922 B9R1.3 ClC1=C(Br)C=NC=C1Br MC443331 [0,2,0,0,0,0|1,0,0]=3 1923 B9R1.3 ClC1=C(Cl)C(I)=CC=C1 MC41484 [0,2,0,0,0,0|2,0,0]=4 1924 B9R1.3 ClC1=CC=CC(Cl)=C1Br CS13889 [0,2,0,0,0,0|2,0,0]=4 1925 B9R1.3 ClC1=CC=CC(Cl)=C1Cl MC41493 [0,2,0,0,0,0|2,0,0]=4 1926 B9R1.3 ClC1=CC=CC(Cl)=C1I MC33070 [0,2,0,0,0,0|2,0,0]=4 1927 B9R1.3 ClC1=CN=CC(Br)=C1Br CS17477 [0,2,0,0,0,0|1,0,0]=3 1928 B9R1.3 ClC1=CN=CC(Br)=C1Cl CS14690 [0,2,0,0,0,0|1,0,0]=3 1929 B9R1.3 ClC1=CN=CC(Cl)=C1Br MC20934 [0,2,0,0,0,0|1,0,0]=3 1930 B9R1.3 ClC1=CN=CC(Cl)=C1Cl CS18988 [0,2,0,0,0,0|1,0,0]=3 1931 B9R1.3 ClC1=CN=CC(Cl)=C1I MC442716 [0,2,0,0,0,0|1,0,0]=3 1932 B9R1.3 ClC1=CN=NC(Cl)=C1Cl CS21915 [0,2,0,0,0,0|2,0,0]=4 1933 B9R1.3 ClC1=NC=CC(Cl)=C1Cl CS17151 [0,2,0,0,0,0|1,0,0]=3 1934 B9R1.3 ClC1=NC=CC(I)=C1Br MC432135 [0,2,0,0,0,0|1,0,0]=3 1935 B9R1.3 ClC1=NC=CC(I)=C1Cl CS14028 [0,2,0,0,0,0|1,0,0]=3 1936 B9R1.3 ClC1=NC=NC(Cl)=C1Cl CS13844 [0,2,0,0,0,0|2,0,0]=4 1937 B9R1.3 ClC1=NC=NC(Cl)=C1I CS12896 [0,2,0,0,0,0|2,0,0]=4 1938 B9R1.3 FC1=C(Br)C(I)=CC=C1 MC442434 [0,2,0,0,0,0|2,0,0]=4 1939 B9R1.3 FC1=C(Br)C=CC=C1Br CS16311 [0,2,0,0,0,0|2,0,0]=4 1940 B9R1.3 FC1=C(Br)C=CC=C1Cl MC31054 [0,2,0,0,0,0|2,0,0]=4 1941 B9R1.3 FC1=C(Br)C=CC=C1I MC432408 [0,2,0,0,0,0|2,0,0]=4 1942 B9R1.3 FC1=C(Cl)C(Cl)=NC=C1 MC431926 [0,2,0,0,0,0|1,0,0]=3 1943 B9R1.3 FC1=C(Cl)C=CC=C1Cl CS21170 [0,2,0,0,0,0|2,0,0]=4 1944 B9R1.3 FC1=C(Cl)C=CN=C1Br MC431056 [0,2,0,0,0,0|1,0,0]=3 1945 B9R1.3 FC1=C(Cl)N=CN=C1Cl CS18862 [0,2,0,0,0,0|2,0,0]=4 1946 B9R1.3 FC1=C(I)C=CN=C1Cl CS13734 [0,2,0,0,0,0|1,0,0]=3 1947 B9R1.3 FC1=CC=CC(Br)=C1Cl MC41459 [0,2,0,0,0,0|2,0,0]=4 1948 B9R1.3 FC1=CC=CC(Cl)=C1Br CS12182 [0,2,0,0,0,0|2,0,0]=4 1949 B9R1.3 FC1=CC=CC(Cl)=C1F CS21032 [0,2,0,0,0,0|2,0,0]=4 1950 B9R1.3 FC1=CC=CC(Cl)=C1I MC41475 [0,2,0,0,0,0|2,0,0]=4 1951 B9R1.3 FC1=CC=CC(F)=C1Br MC429411 [0,2,0,0,0,0|2,0,0]=4 1952 B9R1.3 FC1=CC=CC(F)=C1Cl MC30191 [0,2,0,0,0,0|2,0,0]=4 1953 B9R1.3 FC1=CC=CC(F)=C1F MC433153 [0,2,0,0,0,0|2,0,0]=4 1954 B9R1.3 FC1=CC=CC(F)=C1I MC429412 [0,2,0,0,0,0|2,0,0]=4 1955 B9R1.3 FC1=CC=CC(F)=C1S MC41405 [0,2,0,0,0,0|2,0,0]=4 1956 B9R1.3 FC1=CN=CC(Br)=C1Br CS14477 [0,2,0,0,0,0|1,0,0]=3 1957 B9R1.3 FC1=CN=CC(Br)=C1Cl MC116132 [0,2,0,0,0,0|1,0,0]=3 1958 B9R1.3 FC1=CN=CC(Cl)=C1Br CS17228 [0,2,0,0,0,0|1,0,0]=3 1959 B9R1.3 FC1=CN=CC(F)=C1Br MC429482 [0,2,0,0,0,0|1,0,0]=3 1960 B9R1.3 FC1=CN=CC(F)=C1Cl MC429484 [0,2,0,0,0,0|1,0,0]=3 1961 B9R1.3 FC1=CN=CC(F)=C1F MC21137 [0,2,0,0,0,0|1,0,0]=3 1962 B9R1.3 FC1=CN=CC(F)=C1I MC441029 [0,2,0,0,0,0|1,0,0]=3 1963 B9R1.3 FC1=NC=CC(F)=C1Cl MC432267 [0,2,0,0,0,0|1,0,0]=3 1964 B9R1.3 FC1=NC=CC(F)=C1I CS13086 [0,2,0,0,0,0|1,0,0]=3 1965 B9R1.3 FC1=NC=CC(I)=C1Br MC433042 [0,2,0,0,0,0|1,0,0]=3 1966 B9R1.3 FC1=NC=CC(I)=C1F CS21026 [0,2,0,0,0,0|1,0,0]=3 1967 B9R1.3 Fc1cccc(Br)c1Br MC433506 [0,2,0,0,0,0|2,0,0]=4 1968 B9R1.3 Fc1cccc(Br)c1F MC30137 [0,2,0,0,0,0|2,0,0]=4 1969 B9R1.3 Fc1cccc(Cl)c1Cl MC433514 [0,2,0,0,0,0|2,0,0]=4 1970 B9R1.3 Fc1cccc(I)c1F MC433517 [0,2,0,0,0,0|2,0,0]=4 1971 B9R1.3 NC1=C(Br)C(Br)=NC=C1 MC431555 [0,2,0,0,0,0|0,0,0]=2 1972 B9R1.3 NC1=C(Br)C(Cl)=CC=C1 CS12729 [0,2,0,0,0,0|1,0,0]=3 1973 B9R1.3 NC1=C(Br)C(Cl)=NC=C1 MC433057 [0,2,0,0,0,0|0,0,0]=2 1974 B9R1.3 NC1=C(Br)C(F)=CC=C1 CS22950 [0,2,0,0,0,0|1,0,0]=3 1975 B9R1.3 NC1=C(Br)C=CC=C1Br CS19185 [0,2,0,0,0,0|1,0,0]=3 1976 B9R1.3 NC1=C(Br)C=CC=C1Cl CS17061 [0,2,0,0,0,0|1,0,0]=3 1977 B9R1.3 NC1=C(Br)C=CC=C1F MC30006 [0,2,0,0,0,0|1,0,0]=3 1978 B9R1.3 NC1=C(Br)C=NC=C1Cl CS15062 [0,2,0,0,0,0|0,0,0]=2 1979 B9R1.3 NC1=C(Br)C=NC=C1F CS13180 [0,2,0,0,0,0|0,0,0]=2 1980 B9R1.3 NC1=C(Cl)C(=O)NN=C1 CS22571 [0,2,0,0,0,0|1,0,1]=4 1981 B9R1.3 NC1=C(Cl)C(Br)=CN=C1 CS16352 [0,2,0,0,0,0|1,0,0]=3 1982 B9R1.3 NC1=C(Cl)C(Cl)=CC=C1 CS15257 [0,2,0,0,0,0|1,0,0]=3 1983 B9R1.3 NC1=C(Cl)C(Cl)=CN=C1 CS22062 [0,2,0,0,0,0|1,0,0]=3 1984 B9R1.3 NC1=C(Cl)C(F)=CC=C1 CS22961 [0,2,0,0,0,0|1,0,0]=3 1985 B9R1.3 NC1=C(Cl)C=CC=C1Cl CS19030 [0,2,0,0,0,0|1,0,0]=3 1986 B9R1.3 NC1=C(Cl)C=CC=C1F CS14207 [0,2,0,0,0,0|1,0,0]=3 1987 B9R1.3 NC1=C(Cl)C=CC=C1I CS21480 [0,2,0,0,0,0|1,0,0]=3 1988 B9R1.3 NC1=C(Cl)C=CN=C1Cl CS21077 [0,2,0,0,0,0|1,0,0]=3 1989 B9R1.3 NC1=C(Cl)C=NC=C1Cl CS17493 [0,2,0,0,0,0|0,0,0]=2 1990 B9R1.3 NC1=C(Cl)N=CN=C1Cl CS22565 [0,2,0,0,0,0|2,0,0]=4 1991 B9R1.3 NC1=C(F)C(Br)=CC=C1 CS12594 [0,2,0,0,0,0|1,0,0]=3 1992 B9R1.3 NC1=C(F)C(Cl)=CC=C1 CS22203 [0,2,0,0,0,0|1,0,0]=3 1993 B9R1.3 NC1=C(F)C(Cl)=NC=C1 MC425249 [0,2,0,0,0,0|0,0,0]=2 1994 B9R1.3 NC1=C(F)C(F)=CC=C1 MC30135 [0,2,0,0,0,0|1,0,0]=3 1995 B9R1.3 NC1=C(F)C=CC=C1F CS22980 [0,2,0,0,0,0|1,0,0]=3 1996 B9R1.3 NC1=C(F)C=NC=C1F CS13656 [0,2,0,0,0,0|0,0,0]=2 1997 B9R1.3 NC1=C(F)C=NC=C1I MC432540 [0,2,0,0,0,0|0,0,0]=2 1998 B9R1.3 NC1=C(I)C(Cl)=CC=C1 CS17354 [0,2,0,0,0,0|1,0,0]=3 1999 B9R1.3 NC1=C(I)C(Cl)=NC=C1 MC20957 [0,2,0,0,0,0|0,0,0]=2 2000 B9R1.3 NC1=C(I)C(F)=CC=C1 MC20040 [0,2,0,0,0,0|1,0,0]=3 2001 B9R1.3 NC1=C(I)C(F)=CC=C1 MC433320 [0,2,0,0,0,0|1,0,0]=3 2002 B9R1.3 NC1=C(N)C(=O)NC=N1 CS19859 [0,2,0,0,0,0|1,0,1]=4 2003 B9R1.3 NC1=C(N)C(=O)NN=C1 MC427301 [0,2,0,0,0,0|1,0,0]=3 2004 B9R1.3 NC1=C(N)C(Br)=CN=C1 CS12576 [0,2,0,0,0,0|0,0,0]=2 2005 B9R1.3 NC1=C(N)C(Br)=NC=C1 MC33444 [0,2,0,0,0,0|0,0,0]=2 2006 B9R1.3 NC1=C(N)C(Cl)=CN=C1 CS12293 [0,2,0,0,0,0|0,0,0]=2 2007 B9R1.3 NC1=C(N)C(Cl)=NC=C1 CS14254 [0,2,0,0,0,0|0,0,0]=2 2008 B9R1.3 NC1=C(O)C(Br)=CC=C1 CS14079 [0,2,0,0,0,0|1,0,0]=3 2009 B9R1.3 NC1=C(O)C(Br)=CN=C1 CS14319 [0,2,0,0,0,0|1,0,0]=3 2010 B9R1.3 NC1=C(O)C(Br)=CN=C1 MC113808 [0,2,0,0,0,0|1,0,0]=3 2011 B9R1.3 NC1=C(O)C(Cl)=CC=C1 CS13388 [0,2,0,0,0,0|1,0,0]=3 2012 B9R1.3 NC1=C(O)C(F)=CC=C1 CS10703 [0,2,0,0,0,0|1,0,0]=3 2013 B9R1.3 NC1=C(O)C=CC=C1Br CS12191 [0,2,0,0,0,0|1,0,0]=3 2014 B9R1.3 NC1=C(O)C=CC=C1Cl MC442092 [0,2,0,0,0,0|1,0,0]=3 2015 B9R1.3 NC1=C(O)C=CC=C1F CS13672 [0,2,0,0,0,0|1,0,0]=3 2016 B9R1.3 NC1=C(O)C=CC=C1O CS21312 [0,2,0,0,0,0|1,0,0]=3 2017 B9R1.3 NC1=CC=CC(Br)=C1N CS13189 [0,2,0,0,0,0|1,0,0]=3 2018 B9R1.3 NC1=CC=CC(Cl)=C1N CS14386 [0,2,0,0,0,0|1,0,0]=3 2019 B9R1.3 NC1=CC=CC(F)=C1N CS21010 [0,2,0,0,0,0|1,0,0]=3 2020 B9R1.3 NC1=CC=CC(N)=C1N MC427444 [0,2,0,0,0,0|1,0,0]=3 2021 B9R1.3 NC1=CC=CC(O)=C1Br CS15538 [0,2,0,0,0,0|1,0,0]=3 2022 B9R1.3 NC1=CN=NC(Cl)=C1Cl MC116185 [0,2,0,0,0,0|1,0,0]=3 2023 B9R1.3 NC1=CNC=C(Br)C1=O CS17302 [0,2,0,0,0,0|1,0,1]=4 2024 B9R1.3 NC1=NC=CC(Br)=C1Cl MC427530 [0,2,0,0,0,0|1,0,0]=3 2025 B9R1.3 NC1=NC=CC(Br)=C1N MC431804 [0,2,0,0,0,0|1,0,0]=3 2026 B9R1.3 NC1=NC=CC(Cl)=C1Br CS15162 [0,2,0,0,0,0|1,0,0]=3 2027 B9R1.3 NC1=NC=CC(Cl)=C1Cl MC103510 [0,2,0,0,0,0|1,0,0]=3 2028 B9R1.3 NC1=NC=CC(Cl)=C1I CS17492 [0,2,0,0,0,0|1,0,0]=3 2029 B9R1.3 NC1=NC=CC(F)=C1Br CS17383 [0,2,0,0,0,0|1,0,0]=3 2030 B9R1.3 NC1=NC=CC(N)=C1N MC425893 [0,2,0,0,0,0|0,0,0]=2 2031 B9R1.3 NC1=NC=NC(Cl)=C1Br CS12254 [0,2,0,0,0,0|1,0,0]=3 2032 B9R1.3 NC1=NC=NC(Cl)=C1Cl CS10170 [0,2,0,0,0,0|1,0,0]=3 2033 B9R1.3 NC1=NC=NC(Cl)=C1F CS14511 [0,2,0,0,0,0|1,0,0]=3 2034 B9R1.3 NC1=NC=NC(Cl)=C1N CS19732 [0,2,0,0,0,0|1,0,0]=3 2035 B9R1.3 NC1=NC=NC(Cl)=C1O CS13114 [0,2,0,0,0,0|1,0,0]=3 2036 B9R1.3 O=C1C(Cl)=CNC=C1Cl CS21979 [0,2,0,0,0,0|1,0,1]=4 2037 B9R1.3 O=C1NC=CC(O)=C1Br MC427594 [0,2,0,0,0,0|1,0,1]=4 2038 B9R1.3 O=C1NC=NC(Cl)=C1Br CS12757 [0,2,0,0,0,0|2,0,0]=4 2039 B9R1.3 O=C1NC=NC(O)=C1I CS16916 [0,2,0,0,0,0|2,0,0]=4 2040 B9R1.3 O=C1NN=CC(Br)=C1Br CS19953 [0,2,0,0,0,0|2,0,0]=4 2041 B9R1.3 O=C1NN=CC(Cl)=C1Cl CS22494 [0,2,0,0,0,0|2,0,0]=4 2042 B9R1.3 OC1=C(Br)C(Br)=CC=C1 MC433375 [0,2,0,0,0,0|2,0,0]=4 2043 B9R1.3 OC1=C(Br)C(Cl)=CC=C1 CS21337 [0,2,0,0,0,0|2,0,0]=4 2044 B9R1.3 OC1=C(Br)C(F)=CC=C1 MC433102 [0,2,0,0,0,0|2,0,0]=4 2045 B9R1.3 OC1=C(Br)C(I)=CC=C1 MC115196 [0,2,0,0,0,0|2,0,0]=4 2046 B9R1.3 OC1=C(Br)C=CC=C1Br CS15261 [0,2,0,0,0,0|2,0,0]=4 2047 B9R1.3 OC1=C(Br)C=CC=C1Cl CS15849 [0,2,0,0,0,0|2,0,0]=4 2048 B9R1.3 OC1=C(Br)C=CC=C1F CS22904 [0,2,0,0,0,0|2,0,0]=4 2049 B9R1.3 OC1=C(Br)C=CC=C1I MC441065 [0,2,0,0,0,0|2,0,0]=4 2050 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 CS19373 [0,2,0,0,0,0|2,0,0]=4 2051 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 CS21020 [0,2,0,0,0,0|2,0,0]=4 2052 B9R1.3 OC1=C(Cl)C(F)=CC=C1 CS21431 [0,2,0,0,0,0|2,0,0]=4 2053 B9R1.3 OC1=C(Cl)C=CC=C1Cl CS21171 [0,2,0,0,0,0|2,0,0]=4 2054 B9R1.3 OC1=C(Cl)C=CC=C1F CS18835 [0,2,0,0,0,0|2,0,0]=4 2055 B9R1.3 OC1=C(Cl)C=CC=C1I MC441025 [0,2,0,0,0,0|2,0,0]=4 2056 B9R1.3 OC1=C(Cl)C=CN=C1Cl MC442148 [0,2,0,0,0,0|1,0,0]=3 2057 B9R1.3 OC1=C(Cl)C=CN=C1I MC432316 [0,2,0,0,0,0|1,0,0]=3 2058 B9R1.3 OC1=C(Cl)C=NC=C1Cl CS22692 [0,2,0,0,0,0|1,0,0]=3 2059 B9R1.3 OC1=C(Cl)N=CN=C1Cl CS17140 [0,2,0,0,0,0|2,0,0]=4 2060 B9R1.3 OC1=C(F)C(Br)=CC=C1 MC433356 [0,2,0,0,0,0|2,0,0]=4 2061 B9R1.3 OC1=C(F)C(Br)=NC=C1 MC430149 [0,2,0,0,0,0|1,0,0]=3 2062 B9R1.3 OC1=C(F)C(Cl)=CC=C1 CS22204 [0,2,0,0,0,0|2,0,0]=4 2063 B9R1.3 OC1=C(F)C(F)=CC=C1 CS18870 [0,2,0,0,0,0|2,0,0]=4 2064 B9R1.3 OC1=C(F)C(F)=NC=C1 MC430914 [0,2,0,0,0,0|1,0,0]=3 2065 B9R1.3 OC1=C(F)C(I)=CC=C1 MC442102 [0,2,0,0,0,0|2,0,0]=4 2066 B9R1.3 OC1=C(F)C=CC=C1F CS18872 [0,2,0,0,0,0|2,0,0]=4 2067 B9R1.3 OC1=C(F)C=CN=C1Br MC431067 [0,2,0,0,0,0|1,0,0]=3 2068 B9R1.3 OC1=C(F)C=CN=C1Cl MC431720 [0,2,0,0,0,0|1,0,0]=3 2069 B9R1.3 OC1=C(I)C(Br)=CC=C1 MC433359 [0,2,0,0,0,0|2,0,0]=4 2070 B9R1.3 OC1=C(I)C(Cl)=CC=C1 MC433367 [0,2,0,0,0,0|2,0,0]=4 2071 B9R1.3 OC1=C(I)C(F)=CC=C1 MC442381 [0,2,0,0,0,0|2,0,0]=4 2072 B9R1.3 OC1=C(I)C=CN=C1I MC103624 [0,2,0,0,0,0|1,0,0]=3 2073 B9R1.3 OC1=CC=CC(Br)=C1O MC442826 [0,2,0,0,0,0|2,0,0]=4 2074 B9R1.3 OC1=CC=CC(Cl)=C1O MC441225 [0,2,0,0,0,0|2,0,0]=4 2075 B9R1.3 OC1=CC=CC(F)=C1O MC20210 [0,2,0,0,0,0|2,0,0]=4 2076 B9R1.3 OC1=CC=CC(I)=C1O MC114532 [0,2,0,0,0,0|2,0,0]=4 2077 B9R1.3 OC1=CC=CC(O)=C1Br MC443180 [0,2,0,0,0,0|2,0,0]=4 2078 B9R1.3 OC1=CC=CC(O)=C1Cl CS19075 [0,2,0,0,0,0|2,0,0]=4 2079 B9R1.3 OC1=CC=CC(O)=C1F MC433390 [0,2,0,0,0,0|2,0,0]=4 2080 B9R1.3 OC1=CC=CC(O)=C1I MC443433 [0,2,0,0,0,0|2,0,0]=4 2081 B9R1.3 OC1=CC=CC(O)=C1O MC427034 [0,2,0,0,0,0|2,0,0]=4 2082 B9R1.3 OC1=NC=NC(Cl)=C1Cl MC425644 [0,2,0,0,0,0|2,0,0]=4 2083 B9R1.3 SC1=C(Cl)C(Cl)=CC=C1 MC41403 [0,2,0,0,0,0|2,0,0]=4 2084 B9R1.34 BrC1=CC(Br)=CC(Br)=C1 CS19217 [0,2,0,0,0,0|2,0,0]=4 2085 B9R1.34 BrC1=CC(Br)=NC(Br)=C1 CS21057 [0,2,0,0,0,0|1,0,0]=3 2086 B9R1.34 BrC1=CC(Br)=NC(Br)=N1 MC41654 [0,2,0,0,0,0|2,0,0]=4 2087 B9R1.34 BrC1=CC(I)=CC(Br)=N1 MC432097 [0,2,0,0,0,0|1,0,0]=3 2088 B9R1.34 CC1=CC(=O)C=C(O)O1 CS16601 [0,2,0,0,0,0|2,0,0]=4 2089 B9R1.34 CC1=CC(=O)NC(N)=N1 CS14276 [0,2,0,0,0,0|2,0,0]=4 2090 B9R1.34 CC1=CC(Br)=CC(Br)=C1 MC41514 [0,2,0,0,0,0|2,0,0]=4 2091 B9R1.34 CC1=CC(Br)=CC(Br)=N1 MC441309 [0,2,0,0,0,0|1,0,0]=3 2092 B9R1.34 CC1=CC(Br)=CC(C)=N1 CS17464 [0,2,0,0,0,0|1,0,0]=3 2093 B9R1.34 CC1=CC(Br)=CC(Cl)=C1 CS15189 [0,2,0,0,0,0|2,0,0]=4 2094 B9R1.34 CC1=CC(Br)=CC(F)=C1 CS10391 [0,2,0,0,0,0|2,0,0]=4 2095 B9R1.34 CC1=CC(Br)=CC(F)=N1 MC431200 [0,2,0,0,0,0|1,0,0]=3 2096 B9R1.34 CC1=CC(Br)=CC(O)=N1 CS15180 [0,2,0,0,0,0|1,0,0]=3 2097 B9R1.34 CC1=CC(Br)=NC(Br)=C1 CS12414 [0,2,0,0,0,0|1,0,0]=3 2098 B9R1.34 CC1=CC(Br)=NC(C)=C1 CS14545 [0,2,0,0,0,0|1,0,0]=3 2099 B9R1.34 CC1=CC(Br)=NC(Cl)=C1 MC433059 [0,2,0,0,0,0|1,0,0]=3 2100 B9R1.34 CC1=CC(Br)=NC(F)=C1 MC433041 [0,2,0,0,0,0|1,0,0]=3 2101 B9R1.34 CC1=CC(Br)=NC(N)=N1 CS12756 [0,2,0,0,0,0|2,0,0]=4 2102 B9R1.34 CC1=CC(C)=CC(Br)=C1 CS19140 [0,2,0,0,0,0|2,0,0]=4 2103 B9R1.34 CC1=CC(C)=CC(C)=C1 MC41548 [0,2,0,0,0,0|2,0,0]=4 2104 B9R1.34 CC1=CC(C)=CC(I)=C1 CS19879 [0,2,0,0,0,0|2,0,0]=4 2105 B9R1.34 CC1=CC(C)=CC(N)=C1 CS19815 [0,2,0,0,0,0|1,0,0]=3 2106 B9R1.34 CC1=CC(C)=CC(O)=C1 MC41192 [0,2,0,0,0,0|2,0,0]=4 2107 B9R1.34 CC1=CC(C)=CC(S)=C1 MC41408 [0,2,0,0,0,0|2,0,0]=4 2108 B9R1.34 CC1=CC(C)=NC(C)=C1 MC41641 [0,2,0,0,0,0|1,0,0]=3 2109 B9R1.34 CC1=CC(C)=NC(Cl)=N1 CS19469 [0,2,0,0,0,0|2,0,0]=4 2110 B9R1.34 CC1=CC(C)=NC(N)=N1 CS19549 [0,2,0,0,0,0|2,0,0]=4 2111 B9R1.34 CC1=CC(C)=NC(O)=N1 CS19523 [0,2,0,0,0,0|2,0,0]=4 2112 B9R1.34 CC1=CC(C)=NC(S)=N1 CS19545 [0,2,0,0,0,0|2,0,0]=4 2113 B9R1.34 CC1=CC(C)=NC(S)=N1 MC41647 [0,2,0,0,0,0|2,0,0]=4 2114 B9R1.34 CC1=CC(Cl)=CC(C)=N1 CS17490 [0,2,0,0,0,0|1,0,0]=3 2115 B9R1.34 CC1=CC(Cl)=CC(Cl)=C1 CS21779 [0,2,0,0,0,0|2,0,0]=4 2116 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 CS21090 [0,2,0,0,0,0|1,0,0]=3 2117 B9R1.34 CC1=CC(Cl)=CC(F)=N1 MC429626 [0,2,0,0,0,0|1,0,0]=3 2118 B9R1.34 CC1=CC(Cl)=CC(N)=N1 CS21244 [0,2,0,0,0,0|1,0,0]=3 2119 B9R1.34 CC1=CC(Cl)=NC(C)=C1 CS18953 [0,2,0,0,0,0|1,0,0]=3 2120 B9R1.34 CC1=CC(Cl)=NC(C)=N1 CS19474 [0,2,0,0,0,0|2,0,0]=4 2121 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 CS21169 [0,2,0,0,0,0|1,0,0]=3 2122 B9R1.34 CC1=CC(Cl)=NC(Cl)=N1 CS21790 [0,2,0,0,0,0|2,0,0]=4 2123 B9R1.34 CC1=CC(Cl)=NC(N)=N1 CS14995 [0,2,0,0,0,0|2,0,0]=4 2124 B9R1.34 CC1=CC(F)=CC(F)=C1 MC433025 [0,2,0,0,0,0|2,0,0]=4 2125 B9R1.34 CC1=CC(F)=CC(F)=N1 MC432636 [0,2,0,0,0,0|1,0,0]=3 2126 B9R1.34 CC1=CC(F)=CC(O)=N1 MC431644 [0,2,0,0,0,0|1,0,0]=3 2127 B9R1.34 CC1=CC(I)=CC(C)=N1 CS15577 [0,2,0,0,0,0|1,0,0]=3 2128 B9R1.34 CC1=CC(I)=CC(N)=N1 MC430536 [0,2,0,0,0,0|1,0,0]=3 2129 B9R1.34 CC1=CC(N)=CC(Br)=C1 CS12564 [0,2,0,0,0,0|1,0,0]=3 2130 B9R1.34 CC1=CC(N)=CC(Br)=N1 MC441310 [0,2,0,0,0,0|0,0,0]=2 2131 B9R1.34 CC1=CC(N)=CC(C)=N1 CS17195 [0,2,0,0,0,0|0,0,0]=2 2132 B9R1.34 CC1=CC(N)=CC(Cl)=N1 MC427512 [0,2,0,0,0,0|0,0,0]=2 2133 B9R1.34 CC1=CC(N)=CC(F)=C1 CS20369 [0,2,0,0,0,0|1,0,0]=3 2134 B9R1.34 CC1=CC(N)=NC(Br)=C1 CS12540 [0,2,0,0,0,0|1,0,0]=3 2135 B9R1.34 CC1=CC(N)=NC(C)=C1 CS19570 [0,2,0,0,0,0|1,0,0]=3 2136 B9R1.34 CC1=CC(N)=NC(C)=N1 CS14489 [0,2,0,0,0,0|1,0,0]=3 2137 B9R1.34 CC1=CC(N)=NC(Cl)=C1 CS21290 [0,2,0,0,0,0|1,0,0]=3 2138 B9R1.34 CC1=CC(N)=NC(Cl)=N1 MC444182 [0,2,0,0,0,0|1,0,0]=3 2139 B9R1.34 CC1=CC(N)=NC(N)=C1 MC427350 [0,2,0,0,0,0|1,0,0]=3 2140 B9R1.34 CC1=CC(N)=NC(N)=N1 CS13657 [0,2,0,0,0,0|1,0,0]=3 2141 B9R1.34 CC1=CC(O)=CC(=O)N1 CS15737 [0,2,0,0,0,0|1,0,1]=4 2142 B9R1.34 CC1=CC(O)=CC(=O)O1 CS15586 [0,2,0,0,0,0|2,0,0]=4 2143 B9R1.34 CC1=CC(O)=CC(Br)=C1 CS17351 [0,2,0,0,0,0|2,0,0]=4 2144 B9R1.34 CC1=CC(O)=CC(C)=N1 CS21802 [0,2,0,0,0,0|1,0,0]=3 2145 B9R1.34 CC1=CC(O)=CC(Cl)=C1 CS22228 [0,2,0,0,0,0|2,0,0]=4 2146 B9R1.34 CC1=CC(O)=CC(Cl)=N1 MC441247 [0,2,0,0,0,0|1,0,0]=3 2147 B9R1.34 CC1=CC(O)=CC(F)=C1 MC41197 [0,2,0,0,0,0|2,0,0]=4 2148 B9R1.34 CC1=CC(O)=CC(N)=C1 CS22082 [0,2,0,0,0,0|1,0,0]=3 2149 B9R1.34 CC1=CC(O)=CC(O)=C1 CS19696 [0,2,0,0,0,0|2,0,0]=4 2150 B9R1.34 CC1=CC(O)=CC(O)=N1 CS21109 [0,2,0,0,0,0|1,0,0]=3 2151 B9R1.34 CC1=CC(O)=NC(C)=C1 CS18772 [0,2,0,0,0,0|1,0,0]=3 2152 B9R1.34 CC1=NC(C)=NC(O)=C1 MC428287 [0,2,0,0,0,0|2,0,0]=4 2153 B9R1.34 CC1=NC(Cl)=CC(Cl)=N1 MC10399 [0,2,0,0,0,0|2,0,0]=4 2154 B9R1.34 CC1=NC(Cl)=CC(N)=N1 CS17451 [0,2,0,0,0,0|1,0,0]=3 2155 B9R1.34 CC1=NC(Cl)=CC(O)=N1 MC431944 [0,2,0,0,0,0|2,0,0]=4 2156 B9R1.34 CC1=NC(I)=CC(I)=N1 CS19730 [0,2,0,0,0,0|2,0,0]=4 2157 B9R1.34 CC1=NC(I)=CC(N)=N1 CS15438 [0,2,0,0,0,0|1,0,0]=3 2158 B9R1.34 CC1=NC(N)=CC(N)=N1 MC102817 [0,2,0,0,0,0|1,0,0]=3 2159 B9R1.34 CC1=NC(N)=NC(O)=N1 CS16289 [0,2,0,0,0,0|2,0,0]=4 2160 B9R1.34 CC1=NC(O)=CC(O)=N1 CS17927 [0,2,0,0,0,0|2,0,0]=4 2161 B9R1.34 Cc1cc(C)cc(C)c1 MC444978 [0,2,0,0,0,0|2,0,0]=4 2162 B9R1.34 Cc1cc(C)cc(F)c1 CS10870 [0,2,0,0,0,0|2,0,0]=4 2163 B9R1.34 ClC1=CC(Br)=CC(Br)=C1 CS18744 [0,2,0,0,0,0|2,0,0]=4 2164 B9R1.34 ClC1=CC(Br)=CC(Cl)=N1 MC425649 [0,2,0,0,0,0|1,0,0]=3 2165 B9R1.34 ClC1=CC(Br)=NC(Br)=C1 CS16235 [0,2,0,0,0,0|1,0,0]=3 2166 B9R1.34 ClC1=CC(Cl)=CC(Br)=C1 MC20178 [0,2,0,0,0,0|2,0,0]=4 2167 B9R1.34 ClC1=CC(Cl)=CC(Cl)=C1 MC41494 [0,2,0,0,0,0|2,0,0]=4 2168 B9R1.34 ClC1=CC(Cl)=NC(Cl)=C1 CS20815 [0,2,0,0,0,0|1,0,0]=3 2169 B9R1.34 ClC1=CC(Cl)=NC(Cl)=N1 MC41655 [0,2,0,0,0,0|2,0,0]=4 2170 B9R1.34 ClC1=CC(I)=CC(Br)=C1 CS20648 [0,2,0,0,0,0|2,0,0]=4 2171 B9R1.34 ClC1=CC(I)=CC(Cl)=N1 CS20816 [0,2,0,0,0,0|1,0,0]=3 2172 B9R1.34 FC1=CC(Br)=CC(Br)=C1 MC30246 [0,2,0,0,0,0|2,0,0]=4 2173 B9R1.34 FC1=CC(Br)=CC(Cl)=C1 MC33015 [0,2,0,0,0,0|2,0,0]=4 2174 B9R1.34 FC1=CC(Br)=CC(F)=N1 MC115924 [0,2,0,0,0,0|1,0,0]=3 2175 B9R1.34 FC1=CC(Br)=NC(Br)=C1 CS17986 [0,2,0,0,0,0|1,0,0]=3 2176 B9R1.34 FC1=CC(Br)=NC(Cl)=C1 MC430177 [0,2,0,0,0,0|1,0,0]=3 2177 B9R1.34 FC1=CC(Br)=NC(F)=C1 MC430275 [0,2,0,0,0,0|1,0,0]=3 2178 B9R1.34 FC1=CC(Cl)=CC(F)=N1 MC429629 [0,2,0,0,0,0|1,0,0]=3 2179 B9R1.34 FC1=CC(Cl)=NC(Cl)=C1 MC429969 [0,2,0,0,0,0|1,0,0]=3 2180 B9R1.34 FC1=CC(F)=CC(Cl)=C1 CS18729 [0,2,0,0,0,0|2,0,0]=4 2181 B9R1.34 FC1=CC(F)=CC(F)=C1 MC20002 [0,2,0,0,0,0|2,0,0]=4 2182 B9R1.34 FC1=CC(F)=CC(S)=C1 MC33225 [0,2,0,0,0,0|2,0,0]=4 2183 B9R1.34 FC1=CC(F)=NC(F)=C1 MC429929 [0,2,0,0,0,0|1,0,0]=3 2184 B9R1.34 FC1=CC(F)=NC(F)=N1 CS19268 [0,2,0,0,0,0|2,0,0]=4 2185 B9R1.34 FC1=CC(I)=CC(Br)=C1 CS22851 [0,2,0,0,0,0|2,0,0]=4 2186 B9R1.34 FC1=CC(I)=CC(F)=N1 MC429628 [0,2,0,0,0,0|1,0,0]=3 2187 B9R1.34 FC1=CC(S)=CC(Br)=C1 MC106279 [0,2,0,0,0,0|2,0,0]=4 2188 B9R1.34 FC1=NC(Cl)=CC(Cl)=N1 CS17865 [0,2,0,0,0,0|2,0,0]=4 2189 B9R1.34 Fc1cc(Cl)cc(Cl)c1 MC433072 [0,2,0,0,0,0|2,0,0]=4 2190 B9R1.34 Fc1cc(F)cc(Br)c1 MC30107 [0,2,0,0,0,0|2,0,0]=4 2191 B9R1.34 Fc1cc(F)cc(I)c1 MC433151 [0,2,0,0,0,0|2,0,0]=4 2192 B9R1.34 NC1=CC(=O)N=C(N)N1 CS16285 [0,2,0,0,0,0|1,0,0]=3 2193 B9R1.34 NC1=CC(=O)NC(=O)N1 CS22590 [0,2,0,0,0,0|1,0,1]=4 2194 B9R1.34 NC1=CC(=O)NC(=S)N1 CS15528 [0,2,0,0,0,0|1,0,1]=4 2195 B9R1.34 NC1=CC(=O)NC(F)=C1 MC430867 [0,2,0,0,0,0|0,0,1]=3 2196 B9R1.34 NC1=CC(Br)=CC(Br)=C1 CS12085 [0,2,0,0,0,0|1,0,0]=3 2197 B9R1.34 NC1=CC(Br)=CC(Cl)=C1 CS22156 [0,2,0,0,0,0|1,0,0]=3 2198 B9R1.34 NC1=CC(Br)=CC(F)=C1 CS10197 [0,2,0,0,0,0|1,0,0]=3 2199 B9R1.34 NC1=CC(Br)=CC(I)=C1 MC40873 [0,2,0,0,0,0|1,0,0]=3 2200 B9R1.34 NC1=CC(Br)=CC(O)=C1 MC442367 [0,2,0,0,0,0|1,0,0]=3 2201 B9R1.34 NC1=CC(Br)=NC(Br)=C1 CS12790 [0,2,0,0,0,0|0,0,0]=2 2202 B9R1.34 NC1=CC(Cl)=CC(Cl)=C1 CS21981 [0,2,0,0,0,0|1,0,0]=3 2203 B9R1.34 NC1=CC(Cl)=CC(F)=C1 CS22964 [0,2,0,0,0,0|1,0,0]=3 2204 B9R1.34 NC1=CC(Cl)=CC(N)=N1 MC430623 [0,2,0,0,0,0|1,0,0]=3 2205 B9R1.34 NC1=CC(Cl)=NC(Cl)=C1 CS17484 [0,2,0,0,0,0|0,0,0]=2 2206 B9R1.34 NC1=CC(F)=CC(F)=C1 CS22981 [0,2,0,0,0,0|1,0,0]=3 2207 B9R1.34 NC1=CC(F)=CC(I)=C1 CS22290 [0,2,0,0,0,0|1,0,0]=3 2208 B9R1.34 NC1=CC(F)=NC(F)=C1 MC429973 [0,2,0,0,0,0|0,0,0]=2 2209 B9R1.34 NC1=CC(N)=CC(N)=C1 MC433335 [0,2,0,0,0,0|1,0,0]=3 2210 B9R1.34 NC1=CC(N)=NC(N)=N1 CS22611 [0,2,0,0,0,0|1,0,0]=3 2211 B9R1.34 NC1=CC(N)=NC(S)=N1 MC20388 [0,2,0,0,0,0|1,0,0]=3 2212 B9R1.34 NC1=CC(O)=NC(S)=N1 CS16153 [0,2,0,0,0,0|1,0,0]=3 2213 B9R1.34 NC1=NC(Br)=CC(Br)=N1 CS21236 [0,2,0,0,0,0|2,0,0]=4 2214 B9R1.34 NC1=NC(Cl)=CC(=O)N1 CS12189 [0,2,0,0,0,0|2,0,0]=4 2215 B9R1.34 NC1=NC(Cl)=CC(Br)=C1 MC431876 [0,2,0,0,0,0|1,0,0]=3 2216 B9R1.34 NC1=NC(Cl)=CC(Cl)=C1 CS17487 [0,2,0,0,0,0|1,0,0]=3 2217 B9R1.34 NC1=NC(Cl)=CC(Cl)=N1 CS21805 [0,2,0,0,0,0|2,0,0]=4 2218 B9R1.34 NC1=NC(Cl)=NC(Cl)=C1 CS15446 [0,2,0,0,0,0|1,0,0]=3 2219 B9R1.34 NC1=NC(F)=CC(Cl)=C1 MC430540 [0,2,0,0,0,0|1,0,0]=3 2220 B9R1.34 NC1=NC(F)=CC(F)=N1 CS22572 [0,2,0,0,0,0|2,0,0]=4 2221 B9R1.34 NC1=NC(N)=NC(Cl)=C1 CS21994 [0,2,0,0,0,0|1,0,0]=3 2222 B9R1.34 NC1=NC(O)=CC(O)=N1 CS22589 [0,2,0,0,0,0|2,0,0]=4 2223 B9R1.34 O=C1C=C(Cl)C=C(Cl)N1 MC107469 [0,2,0,0,0,0|1,0,1]=4 2224 B9R1.34 O=C1N=C(Cl)C=C(Cl)N1 MC102932 [0,2,0,0,0,0|2,0,0]=4 2225 B9R1.34 OC1=CC(Br)=CC(Br)=C1 CS15360 [0,2,0,0,0,0|2,0,0]=4 2226 B9R1.34 OC1=CC(Br)=CC(Cl)=C1 CS22155 [0,2,0,0,0,0|2,0,0]=4 2227 B9R1.34 OC1=CC(Br)=CC(Cl)=N1 MC430348 [0,2,0,0,0,0|1,0,0]=3 2228 B9R1.34 OC1=CC(Br)=CC(F)=C1 CS19926 [0,2,0,0,0,0|2,0,0]=4 2229 B9R1.34 OC1=CC(Br)=CC(I)=C1 MC41159 [0,2,0,0,0,0|2,0,0]=4 2230 B9R1.34 OC1=CC(Cl)=CC(Cl)=C1 CS19171 [0,2,0,0,0,0|2,0,0]=4 2231 B9R1.34 OC1=CC(Cl)=CC(F)=C1 MC41169 [0,2,0,0,0,0|2,0,0]=4 2232 B9R1.34 OC1=CC(F)=CC(F)=C1 CS22928 [0,2,0,0,0,0|2,0,0]=4 2233 B9R1.34 OC1=CC(O)=CC(Br)=C1 MC425796 [0,2,0,0,0,0|2,0,0]=4 2234 B9R1.34 OC1=CC(O)=CC(O)=C1 CS19697 [0,2,0,0,0,0|2,0,0]=4 2235 B9R1.34 OC1=CC(O)=CC(O)=C1 MC34268 [0,2,0,0,0,0|2,0,0]=4 2236 B9R1.34 OC1=CC(O)=NC(O)=N1 CS16734 [0,2,0,0,0,0|2,0,0]=4 2237 B9R1.34 OC1=CC(O)=NC(S)=N1 CS14575 [0,2,0,0,0,0|2,0,0]=4 2238 B9R2.50 C1=CC=C2CCC2=C1 CS19267 [0,1,0,1,0,0|2,0,0]=4 2239 B5R1.1 C1=CNC=C1 MC20798 [1,0,0,0,1,0|0,0,1]=3 2240 B5R1.1 C1=CNC=N1 CS19767 [1,0,0,0,1,0|1,0,0]=3 2241 B5R1.1 C1=CNN=C1 CS18933 [1,0,0,0,1,0|1,0,0]=3 2242 B5R1.1 C1=CNN=N1 CS18218 [1,0,0,0,1,0|2,0,0]=4 2243 B5R1.1 C1=CON=C1 MC20462 [1,0,0,0,1,0|1,0,0]=3 2244 B5R1.1 C1=CSC=C1 MC41709 [1,0,0,0,1,0|1,0,0]=3 2245 B5R1.1 C1=CSC=N1 MC425154 [1,0,0,0,1,0|1,0,0]=3 2246 B5R1.1 C1=CSN=C1 MC20995 [1,0,0,0,1,0|1,0,0]=3 2247 B5R1.1 C1=C[CH-]C=C1 MC21078 [1,0,0,0,1,0|0,0,1]=3 2248 B5R1.1 C1=NC=NN1 CS19896 [1,0,0,0,1,0|2,0,0]=4