0 B7R1.3 BrC1=CC=CN=C1 HR2571 [0,0,0,0,0,0|2,0,0]=2 1 B7R1.3 BrC1=CC=CN=N1 HR117966 [0,0,0,0,0,0|3,0,0]=3 2 B7R1.3 BrC1=CC=NC=C1 HR118403 [0,0,0,0,0,0|2,0,0]=2 3 B7R1.3 BrC1=CC=NC=C1 HR2589 [0,0,0,0,0,0|2,0,0]=2 4 B7R1.3 BrC1=CN=CN=C1 HR30060 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.3 BrC1=CN=NC=C1 HR129632 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.3 BrC1=NC=CC=C1 RESA03406 [0,0,0,0,0,0|2,0,0]=2 7 B7R1.3 BrC1=NC=CC=N1 HR30059 [0,0,0,0,0,0|3,0,0]=3 8 B7R1.3 BrC1=NC=CN=C1 HR132508 [0,0,0,0,0,0|3,0,0]=3 9 B7R1.3 BrC1=NC=NC=C1 HR103345 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.3 CC1=CC=CC=C1 HR141847 [0,0,0,0,0,0|1,0,0]=1 11 B7R1.3 CC1=CC=CN=N1 HR118859 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.3 CC1=CC=NC=C1 ABXF00108 [0,0,0,0,0,0|2,0,0]=2 13 B7R1.3 CC1=CCC=CC1 HR142661 [0,0,0,0,0,0|1,0,2]=3 14 B7R1.3 CC1=CN=CN=C1 HR7207 [0,0,0,0,0,0|3,0,0]=3 15 B7R1.3 CC1=CN=NC=C1 HR131519 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.3 CC1=NC=CC=C1 HR147066 [0,0,0,0,0,0|2,0,0]=2 17 B7R1.3 CC1=NC=CC=N1 HR127988 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 CC1=NC=CN=C1 HR129440 [0,0,0,0,0,0|3,0,0]=3 19 B7R1.3 CC1=NC=NC=C1 HR134623 [0,0,0,0,0,0|3,0,0]=3 20 B7R1.3 C[N+]1=CC=CC=C1 HR122704 [0,0,0,0,0,0|2,0,0]=2 21 B7R1.3 Cc1ccccn1 HR136839 [0,0,0,0,0,0|2,0,0]=2 22 B7R1.3 ClC1=CC=CN=C1 HR124464 [0,0,0,0,0,0|2,0,0]=2 23 B7R1.3 ClC1=CC=CN=N1 HR133355 [0,0,0,0,0,0|3,0,0]=3 24 B7R1.3 ClC1=CC=NC=C1 HR128632 [0,0,0,0,0,0|2,0,0]=2 25 B7R1.3 ClC1=CC=NC=C1 HR129409 [0,0,0,0,0,0|2,0,0]=2 26 B7R1.3 ClC1=CN=CN=C1 HR7041 [0,0,0,0,0,0|3,0,0]=3 27 B7R1.3 ClC1=CN=NC=C1 HR120044 [0,0,0,0,0,0|3,0,0]=3 28 B7R1.3 ClC1=NC=CC=C1 HR13200 [0,0,0,0,0,0|2,0,0]=2 29 B7R1.3 ClC1=NC=CC=N1 HR30058 [0,0,0,0,0,0|3,0,0]=3 30 B7R1.3 ClC1=NC=CN=C1 HR128895 [0,0,0,0,0,0|3,0,0]=3 31 B7R1.3 ClC1=NC=NC=C1 HR133073 [0,0,0,0,0,0|3,0,0]=3 32 B7R1.3 Clc1ccncn1 HR109086 [0,0,0,0,0,0|3,0,0]=3 33 B7R1.3 FC1=CC=CC=C1 HR147055 [0,0,0,0,0,0|1,0,0]=1 34 B7R1.3 FC1=CC=CN=C1 HR1095 [0,0,0,0,0,0|2,0,0]=2 35 B7R1.3 FC1=CC=NC=C1 HR125607 [0,0,0,0,0,0|2,0,0]=2 36 B7R1.3 FC1=CC=NC=C1 HR138558 [0,0,0,0,0,0|2,0,0]=2 37 B7R1.3 FC1=CN=CN=C1 HR129037 [0,0,0,0,0,0|3,0,0]=3 38 B7R1.3 FC1=NC=CC=C1 HR1094 [0,0,0,0,0,0|2,0,0]=2 39 B7R1.3 FC1=NC=CN=C1 HR117339 [0,0,0,0,0,0|3,0,0]=3 40 B7R1.3 FC1=NC=NC=C1 HR112589 [0,0,0,0,0,0|3,0,0]=3 41 B7R1.3 F[N+]1=CC=CC=C1 HR105617 [0,0,0,0,0,0|2,0,0]=2 42 B7R1.3 IC1=CC=CC=C1 HR127846 [0,0,0,0,0,0|1,0,0]=1 43 B7R1.3 IC1=CC=CN=C1 HR131442 [0,0,0,0,0,0|2,0,0]=2 44 B7R1.3 IC1=CC=NC=C1 HR131041 [0,0,0,0,0,0|2,0,0]=2 45 B7R1.3 IC1=CN=CN=C1 HR103029 [0,0,0,0,0,0|3,0,0]=3 46 B7R1.3 IC1=NC=CC=C1 HR126390 [0,0,0,0,0,0|2,0,0]=2 47 B7R1.3 IC1=NC=CC=N1 HR110089 [0,0,0,0,0,0|3,0,0]=3 48 B7R1.3 IC1=NC=CN=C1 HR119189 [0,0,0,0,0,0|3,0,0]=3 49 B7R1.3 IC1=NC=NC=C1 HR32418 [0,0,0,0,0,0|3,0,0]=3 50 B7R1.3 NC1=CC=CC=C1 HR145297 [0,0,0,0,0,0|1,0,0]=1 51 B7R1.3 NC1=CC=CC=C1 SESA05504 [0,0,0,0,0,0|1,0,0]=1 52 B7R1.3 NC1=CC=CN=C1 HR146968 [0,0,0,0,0,0|2,0,0]=2 53 B7R1.3 NC1=CC=CN=N1 HR113456 [0,0,0,0,0,0|3,0,0]=3 54 B7R1.3 NC1=CC=NC=C1 HR1281 [0,0,0,0,0,0|2,0,0]=2 55 B7R1.3 NC1=CN=CN=C1 HR107204 [0,0,0,0,0,0|3,0,0]=3 56 B7R1.3 NC1=CN=NC=C1 HR129398 [0,0,0,0,0,0|3,0,0]=3 57 B7R1.3 NC1=NC=CC=C1 HR146971 [0,0,0,0,0,0|2,0,0]=2 58 B7R1.3 NC1=NC=CC=N1 HR129899 [0,0,0,0,0,0|3,0,0]=3 59 B7R1.3 NC1=NC=CN=C1 HR124249 [0,0,0,0,0,0|3,0,0]=3 60 B7R1.3 NC1=NC=NC=C1 HR30433 [0,0,0,0,0,0|3,0,0]=3 61 B7R1.3 NN1C=CN=CC1 HR116274 [0,0,0,0,0,0|3,0,1]=4 62 B7R1.3 N[N+]1=CC=CC=C1 HR116598 [0,0,0,0,0,0|2,0,0]=2 63 B7R1.3 Nc1cccnn1 HR130751 [0,0,0,0,0,0|3,0,0]=3 64 B7R1.3 O=C1C=CC=NN1 HR137023 [0,0,0,0,0,0|2,1,0]=3 65 B7R1.3 O=C1C=CCCC1 HR146309 [0,0,0,0,0,0|0,1,3]=4 66 B7R1.3 OC1=CC=CN=C1 HR133674 [0,0,0,0,0,0|1,1,0]=2 67 B7R1.3 OC1=CC=NC=C1 HR133943 [0,0,0,0,0,0|1,1,0]=2 68 B7R1.3 OC1=CN=CN=C1 HR133884 [0,0,0,0,0,0|2,1,0]=3 69 B7R1.3 OC1=CN=CN=C1 HR156138 [0,0,0,0,0,0|2,1,0]=3 70 B7R1.3 OC1=CN=NC=C1 HR105542 [0,0,0,0,0,0|2,1,0]=3 71 B7R1.3 OC1=NC=CC=C1 HR104705 [0,0,0,0,0,0|1,1,0]=2 72 B7R1.3 OC1=NC=CC=C1 HR133405 [0,0,0,0,0,0|1,1,0]=2 73 B7R1.3 OC1=NC=CC=N1 HR127441 [0,0,0,0,0,0|2,1,0]=3 74 B7R1.3 OC1=NC=CN=C1 HR119328 [0,0,0,0,0,0|2,1,0]=3 75 B7R1.3 OC1=NC=NC=C1 HR102860 [0,0,0,0,0,0|2,1,0]=3 76 B7R1.3 OC1=NC=NC=C1 HR130946 [0,0,0,0,0,0|2,1,0]=3 77 B7R1.3 OC1=NC=NC=C1 HR146538 [0,0,0,0,0,0|2,1,0]=3 78 B7R1.3 Oc1ccccc1 HR122962 [0,0,0,0,0,0|0,1,0]=1 79 B7R1.3 PC1=CC=CC=C1 HR104634 [0,0,0,0,0,0|1,0,0]=1 80 B7R1.3 SC1=CC=NC=C1 HR124309 [0,0,0,0,0,0|1,0,0]=1 81 B7R1.3 SC1=NC=CC=C1 HR115477 [0,0,0,0,0,0|1,0,0]=1 82 B7R1.3 SC1=NC=CC=C1 HR136528 [0,0,0,0,0,0|1,0,0]=1 83 B7R1.3 SC1=NC=CC=N1 HR127715 [0,0,0,0,0,0|2,0,0]=2 84 B7R1.3 [Li]C1=CC=CC=C1 INSA03510 [0,0,0,0,0,0|1,0,0]=1 85 B7R1.3 [O-][N+]1=CC=CC=C1 HR130224 [0,0,0,0,0,0|1,1,0]=2 86 B7R1.3 [O-][N+]1=CC=NC=C1 HR109210 [0,0,0,0,0,0|2,1,0]=3 87 B7R1.3 [S-]C1=CC=CC=C1 HR111290 [0,0,0,0,0,0|0,0,1]=1 88 B7R1.3 [Si]C1=CC=CC=C1 HR144112 [0,0,0,0,0,0|1,0,0]=1 89 B6R1.1 C1=CC=NC=C1 HR107448 [1,0,0,0,0,0|1,0,0]=2 90 B6R1.1 C1=CC=NC=C1 HR119168 [1,0,0,0,0,0|1,0,0]=2 91 B6R1.1 C1=CC=NC=C1 HR132217 [1,0,0,0,0,0|1,0,0]=2 92 B6R1.1 C1=CC=NC=C1 HR136497 [1,0,0,0,0,0|1,0,0]=2 93 B6R1.1 C1=CC=NC=C1 HR147704 [1,0,0,0,0,0|1,0,0]=2 94 B6R1.1 C1=CC=[NH+]C=C1 HR136866 [1,0,0,0,0,0|1,0,0]=2 95 B6R1.1 C1=CC=[NH+]C=C1 HR15908 [1,0,0,0,0,0|1,0,0]=2 96 B6R1.1 C1=CCCC=C1 HR147137 [1,0,0,0,0,0|0,0,2]=3 97 B6R1.1 C1=CN=CC=N1 HR16607 [1,0,0,0,0,0|2,0,0]=3 98 B6R1.1 C1=CN=CN=C1 HR132250 [1,0,0,0,0,0|2,0,0]=3 99 B6R1.1 C1=CN=NC=C1 HR105144 [1,0,0,0,0,0|2,0,0]=3 100 B6R1.1 C1=NC=NC=N1 HR129307 [1,0,0,0,0,0|3,0,0]=4 101 B6R1.1 c1ccccc1 HR143507 [1,0,0,0,0,0|0,0,0]=1 102 B6R1.1 c1ccncc1 HR140272 [1,0,0,0,0,0|1,0,0]=2 103 B8R1.2 BrCC1=CC=CN=C1 HR108717 [0,1,0,0,0,0|2,0,0]=3 104 B8R1.2 BrCC1=CC=CN=C1 HR121556 [0,1,0,0,0,0|2,0,0]=3 105 B8R1.2 BrCC1=CC=CN=N1 HR104831 [0,1,0,0,0,0|3,0,0]=4 106 B8R1.2 BrCC1=CC=NC=C1 HR112538 [0,1,0,0,0,0|2,0,0]=3 107 B8R1.2 BrCC1=CC=NC=C1 HR120923 [0,1,0,0,0,0|2,0,0]=3 108 B8R1.2 BrCC1=CN=CN=C1 HR120917 [0,1,0,0,0,0|3,0,0]=4 109 B8R1.2 BrCC1=NC=CC=C1 HR121865 [0,1,0,0,0,0|2,0,0]=3 110 B8R1.2 BrCC1=NC=CN=C1 HR116592 [0,1,0,0,0,0|3,0,0]=4 111 B8R1.2 BrCc1ccccn1 HR121394 [0,1,0,0,0,0|2,0,0]=3 112 B8R1.2 Br[Mg]C1=NC=CC=C1 OLSA05204 [0,1,0,0,0,0|2,0,0]=3 113 B8R1.2 C#CC1=CC=CC=C1 HR146973 [0,1,0,0,0,0|1,0,0]=2 114 B8R1.2 C#CC1=CC=CN=C1 HR109693 [0,1,0,0,0,0|2,0,0]=3 115 B8R1.2 C#CC1=CC=NC=C1 HR110607 [0,1,0,0,0,0|2,0,0]=3 116 B8R1.2 C#CC1=CN=CN=C1 HR148160 [0,1,0,0,0,0|3,0,0]=4 117 B8R1.2 C#CC1=NC=CC=C1 HR119587 [0,1,0,0,0,0|2,0,0]=3 118 B8R1.2 C#CC1=NC=CC=N1 HR148148 [0,1,0,0,0,0|3,0,0]=4 119 B8R1.2 C#Cc1ccncc1 HR134925 [0,1,0,0,0,0|2,0,0]=3 120 B8R1.2 C=CC1=CC=CN=C1 HR114859 [0,1,0,0,0,0|2,0,0]=3 121 B8R1.2 C=CC1=NC=CN=C1 HR138193 [0,1,0,0,0,0|3,0,0]=4 122 B8R1.2 C=NC1=CC=CC=C1 HR101539 [0,1,0,0,0,0|1,0,0]=2 123 B8R1.2 CCC1=CC=CN=N1 HR120566 [0,1,0,0,0,0|3,0,0]=4 124 B8R1.2 CCC1=CN=NC=C1 HR112995 [0,1,0,0,0,0|3,0,0]=4 125 B8R1.2 CCC1=NC=CN=C1 HR127547 [0,1,0,0,0,0|3,0,0]=4 126 B8R1.2 CC[N+]1=CC=CC=C1 HR122454 [0,1,0,0,0,0|2,0,0]=3 127 B8R1.2 CC[n+]1ccccc1 HR122718 [0,1,0,0,0,0|2,0,0]=3 128 B8R1.2 CNC1=CC=CN=C1 HR129985 [0,1,0,0,0,0|2,0,0]=3 129 B8R1.2 CNC1=CC=NC=C1 HR110286 [0,1,0,0,0,0|2,0,0]=3 130 B8R1.2 CNC1=NC=CC=N1 HR114686 [0,1,0,0,0,0|3,0,0]=4 131 B8R1.2 CNc1ccccc1 HR100457 [0,1,0,0,0,0|1,0,0]=2 132 B8R1.2 COC1=CC=CCC1 HR140042 [0,1,0,0,0,0|0,1,2]=4 133 B8R1.2 COC1=CC=CN=C1 HR32267 [0,1,0,0,0,0|1,1,0]=3 134 B8R1.2 COC1=CC=CN=N1 HR105981 [0,1,0,0,0,0|2,1,0]=4 135 B8R1.2 COC1=CC=NC=C1 HR125268 [0,1,0,0,0,0|1,1,0]=3 136 B8R1.2 COC1=CN=CN=C1 HR117403 [0,1,0,0,0,0|2,1,0]=4 137 B8R1.2 COC1=CN=NC=C1 HR120245 [0,1,0,0,0,0|2,1,0]=4 138 B8R1.2 COC1=NC=CC=C1 HR126716 [0,1,0,0,0,0|1,1,0]=3 139 B8R1.2 COC1=NC=CN=C1 HR126989 [0,1,0,0,0,0|2,1,0]=4 140 B8R1.2 CSC1=CC=CC=C1 HR122762 [0,1,0,0,0,0|0,0,0]=1 141 B8R1.2 CSC1=NC=CC=C1 HR131827 [0,1,0,0,0,0|1,0,0]=2 142 B8R1.2 CSC1=NC=CN=C1 HR124880 [0,1,0,0,0,0|2,0,0]=3 143 B8R1.2 CSC1=NC=CN=N1 HR115056 [0,1,0,0,0,0|3,0,0]=4 144 B8R1.2 C[Si]C1=CC=CC=C1 HR105191 [0,1,0,0,0,0|1,0,0]=2 145 B8R1.2 ClCC1=CC=CN=C1 HR119663 [0,1,0,0,0,0|2,0,0]=3 146 B8R1.2 ClCC1=CC=CN=C1 HR130796 [0,1,0,0,0,0|2,0,0]=3 147 B8R1.2 ClCC1=CN=CN=C1 HR112145 [0,1,0,0,0,0|3,0,0]=4 148 B8R1.2 ClCC1=NC=CC=C1 HR129737 [0,1,0,0,0,0|2,0,0]=3 149 B8R1.2 ClCC1=NC=CC=C1 HR135031 [0,1,0,0,0,0|2,0,0]=3 150 B8R1.2 ClCC1=NC=CC=N1 ELXM02404 [0,1,0,0,0,0|3,0,0]=4 151 B8R1.2 ClCC1=NC=CC=N1 HR133860 [0,1,0,0,0,0|3,0,0]=4 152 B8R1.2 ClCC1=NC=CN=C1 HR116912 [0,1,0,0,0,0|3,0,0]=4 153 B8R1.2 ClCC1=NC=NC=C1 HR108647 [0,1,0,0,0,0|3,0,0]=4 154 B8R1.2 ClCc1ccncc1 HR131056 [0,1,0,0,0,0|2,0,0]=3 155 B8R1.2 Cl[Mg]C1=CC=CC=C1 HR115046 [0,1,0,0,0,0|1,0,0]=2 156 B8R1.2 ICC1=CC=CN=C1 HR112683 [0,1,0,0,0,0|2,0,0]=3 157 B8R1.2 I[Mg]c1ccccc1 HR107979 [0,1,0,0,0,0|1,0,0]=2 158 B8R1.2 N#CC1=CC=NC=C1 CLXM00501 [0,1,0,0,0,0|2,0,0]=3 159 B8R1.2 N#CC1=CN=CN=C1 HR102719 [0,1,0,0,0,0|3,0,0]=4 160 B8R1.2 N#CC1=NC=CC=C1 HR122345 [0,1,0,0,0,0|2,0,0]=3 161 B8R1.2 N#CC1=NC=CC=N1 HR126257 [0,1,0,0,0,0|3,0,0]=4 162 B8R1.2 N#CC1=NC=CN=C1 HR132037 [0,1,0,0,0,0|3,0,0]=4 163 B8R1.2 N#CC1=NC=NC=C1 HR113299 [0,1,0,0,0,0|3,0,0]=4 164 B8R1.2 N#Cc1ccccc1 HR128200 [0,1,0,0,0,0|1,0,0]=2 165 B8R1.2 N#Cc1ccccc1 HR128467 [0,1,0,0,0,0|1,0,0]=2 166 B8R1.2 NCC1=CC=CN=C1 HR131367 [0,1,0,0,0,0|2,0,0]=3 167 B8R1.2 NCC1=CC=NC=C1 HR119360 [0,1,0,0,0,0|2,0,0]=3 168 B8R1.2 NCC1=CC=NC=C1 HR146144 [0,1,0,0,0,0|2,0,0]=3 169 B8R1.2 NCC1=CN=CN=C1 HR120018 [0,1,0,0,0,0|3,0,0]=4 170 B8R1.2 NCC1=CN=NC=C1 HR111479 [0,1,0,0,0,0|3,0,0]=4 171 B8R1.2 NCC1=CN=NC=C1 HR148716 [0,1,0,0,0,0|3,0,0]=4 172 B8R1.2 NCC1=NC=CC=C1 HR136467 [0,1,0,0,0,0|2,0,0]=3 173 B8R1.2 NCC1=NC=CC=N1 HR102349 [0,1,0,0,0,0|3,0,0]=4 174 B8R1.2 NCC1=NC=CC=N1 HR115583 [0,1,0,0,0,0|3,0,0]=4 175 B8R1.2 NCC1=NC=CN=C1 HR105402 [0,1,0,0,0,0|3,0,0]=4 176 B8R1.2 NCC1=NC=CN=C1 HR119571 [0,1,0,0,0,0|3,0,0]=4 177 B8R1.2 NCC1=NC=NC=C1 HR109749 [0,1,0,0,0,0|3,0,0]=4 178 B8R1.2 NCc1ccccc1 HR129185 [0,1,0,0,0,0|1,0,0]=2 179 B8R1.2 NNC1=CC=CC=C1 HR126212 [0,1,0,0,0,0|1,0,0]=2 180 B8R1.2 NNC1=CC=CN=C1 HR117538 [0,1,0,0,0,0|2,0,0]=3 181 B8R1.2 NNC1=CC=CN=C1 HR147357 [0,1,0,0,0,0|2,0,0]=3 182 B8R1.2 NNC1=CC=CN=N1 HR102254 [0,1,0,0,0,0|3,0,0]=4 183 B8R1.2 NNC1=CC=NC=C1 HR103990 [0,1,0,0,0,0|2,0,0]=3 184 B8R1.2 NNC1=CC=NC=C1 HR16313 [0,1,0,0,0,0|2,0,0]=3 185 B8R1.2 NNC1=NC=CC=C1 HR111958 [0,1,0,0,0,0|2,0,0]=3 186 B8R1.2 NNC1=NC=CC=N1 HR104709 [0,1,0,0,0,0|3,0,0]=4 187 B8R1.2 NNC1=NC=CN=C1 SESA05107 [0,1,0,0,0,0|3,0,0]=4 188 B8R1.2 NNc1ccccc1 HR146770 [0,1,0,0,0,0|1,0,0]=2 189 B8R1.2 NOC1=CC=CC=C1 HR113378 [0,1,0,0,0,0|0,1,0]=2 190 B8R1.2 O=CC1=CC=CC=C1 PLSA00402 [0,1,0,0,0,0|0,1,0]=2 191 B8R1.2 O=CC1=CC=CN=C1 HR123179 [0,1,0,0,0,0|1,1,0]=3 192 B8R1.2 O=CC1=CC=NC=C1 HR123122 [0,1,0,0,0,0|1,1,0]=3 193 B8R1.2 O=CC1=CN=CN=C1 HR135692 [0,1,0,0,0,0|2,1,0]=4 194 B8R1.2 O=CC1=CN=NC=C1 HR119931 [0,1,0,0,0,0|2,1,0]=4 195 B8R1.2 O=CC1=NC=CC=C1 HR135399 [0,1,0,0,0,0|1,1,0]=3 196 B8R1.2 O=CC1=NC=CC=N1 HR129551 [0,1,0,0,0,0|2,1,0]=4 197 B8R1.2 O=CC1=NC=CN=C1 HR110626 [0,1,0,0,0,0|2,1,0]=4 198 B8R1.2 O=CC1=NC=NC=C1 HR115485 [0,1,0,0,0,0|2,1,0]=4 199 B8R1.2 OCC1=CC=CC=C1 HR129716 [0,1,0,0,0,0|0,1,0]=2 200 B8R1.2 OCC1=CC=CN=C1 ENJL01103 [0,1,0,0,0,0|1,1,0]=3 201 B8R1.2 OCC1=CC=CN=N1 HR116608 [0,1,0,0,0,0|2,1,0]=4 202 B8R1.2 OCC1=CC=NC=C1 HR122855 [0,1,0,0,0,0|1,1,0]=3 203 B8R1.2 OCC1=CC=NC=C1 HR142772 [0,1,0,0,0,0|1,1,0]=3 204 B8R1.2 OCC1=CN=CN=C1 HR131395 [0,1,0,0,0,0|2,1,0]=4 205 B8R1.2 OCC1=NC=CC=C1 HR136134 [0,1,0,0,0,0|1,1,0]=3 206 B8R1.2 OCC1=NC=CC=N1 HR128826 [0,1,0,0,0,0|2,1,0]=4 207 B8R1.2 OCC1=NC=CN=C1 HR132253 [0,1,0,0,0,0|2,1,0]=4 208 B8R1.2 OCC1=NC=NC=C1 HR110347 [0,1,0,0,0,0|2,1,0]=4 209 B8R1.2 SCC1=NC=CC=C1 HR129844 [0,1,0,0,0,0|1,0,0]=2 210 B8R1.2 SCC1=NC=CN=C1 HR122647 [0,1,0,0,0,0|2,0,0]=3 211 B8R1.2 [Na]Cc1ccccc1 HR100698 [0,1,0,0,0,0|1,0,0]=2 212 B8R1.3 BrC1=CC=C(Br)C=C1 HR135257 [0,1,0,0,0,0|1,0,0]=2 213 B8R1.3 BrC1=CC=C(Br)N=N1 HR112679 [0,1,0,0,0,0|3,0,0]=4 214 B8R1.3 BrC1=CC=C(I)C=C1 HR136103 [0,1,0,0,0,0|1,0,0]=2 215 B8R1.3 BrC1=CN=C(Br)C=C1 HR30124 [0,1,0,0,0,0|2,0,0]=3 216 B8R1.3 BrC1=CN=C(Br)C=N1 HR103494 [0,1,0,0,0,0|3,0,0]=4 217 B8R1.3 BrC1=CN=C(Br)N=C1 HR135537 [0,1,0,0,0,0|3,0,0]=4 218 B8R1.3 BrC1=CN=C(I)C=C1 HR126028 [0,1,0,0,0,0|2,0,0]=3 219 B8R1.3 BrC1=CN=C(I)N=C1 HR125836 [0,1,0,0,0,0|3,0,0]=4 220 B8R1.3 BrC1=NC=C(I)C=C1 HR125389 [0,1,0,0,0,0|2,0,0]=3 221 B8R1.3 BrC1=NC=C(I)C=N1 HR33969 [0,1,0,0,0,0|3,0,0]=4 222 B8R1.3 BrC1=NC=C(I)N=C1 HR120354 [0,1,0,0,0,0|3,0,0]=4 223 B8R1.3 CC1=CC=C(Br)C=C1 HR21011 [0,1,0,0,0,0|1,0,0]=2 224 B8R1.3 CC1=CC=C(Br)N=N1 HR148281 [0,1,0,0,0,0|3,0,0]=4 225 B8R1.3 CC1=CC=C(C)N=N1 HR112680 [0,1,0,0,0,0|3,0,0]=4 226 B8R1.3 CC1=CC=C(Cl)N=N1 HR137497 [0,1,0,0,0,0|3,0,0]=4 227 B8R1.3 CC1=CC=C(I)C=C1 HR131008 [0,1,0,0,0,0|1,0,0]=2 228 B8R1.3 CC1=CC=C(N)C=C1 HR147703 [0,1,0,0,0,0|1,0,0]=2 229 B8R1.3 CC1=CC=C(N)C=N1 HR131136 [0,1,0,0,0,0|2,0,0]=3 230 B8R1.3 CC1=CC=C(N)N=N1 HR103580 [0,1,0,0,0,0|3,0,0]=4 231 B8R1.3 CC1=CC=C(O)C=N1 HR123018 [0,1,0,0,0,0|1,1,0]=3 232 B8R1.3 CC1=CC=[N+]([O-])C=C1 HR132370 [0,1,0,0,0,0|1,1,0]=3 233 B8R1.3 CC1=CN=C(Br)C=C1 HR1185 [0,1,0,0,0,0|2,0,0]=3 234 B8R1.3 CC1=CN=C(Br)C=N1 HR114177 [0,1,0,0,0,0|3,0,0]=4 235 B8R1.3 CC1=CN=C(Br)N=C1 HR33492 [0,1,0,0,0,0|3,0,0]=4 236 B8R1.3 CC1=CN=C(C)C=N1 HR133127 [0,1,0,0,0,0|3,0,0]=4 237 B8R1.3 CC1=CN=C(Cl)C=C1 HR1193 [0,1,0,0,0,0|2,0,0]=3 238 B8R1.3 CC1=CN=C(Cl)C=N1 HR147274 [0,1,0,0,0,0|3,0,0]=4 239 B8R1.3 CC1=CN=C(Cl)N=C1 HR33491 [0,1,0,0,0,0|3,0,0]=4 240 B8R1.3 CC1=CN=C(F)C=C1 HR136733 [0,1,0,0,0,0|2,0,0]=3 241 B8R1.3 CC1=CN=C(I)N=C1 HR34068 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.3 CC1=CN=C(N)C=C1 ABXF00101 [0,1,0,0,0,0|2,0,0]=3 243 B8R1.3 CC1=CN=C(N)C=N1 HR104011 [0,1,0,0,0,0|3,0,0]=4 244 B8R1.3 CC1=CN=C(N)N=C1 HR111581 [0,1,0,0,0,0|3,0,0]=4 245 B8R1.3 CC1=CN=C(O)C=C1 HR127832 [0,1,0,0,0,0|1,1,0]=3 246 B8R1.3 CC1=CN=C(O)C=C1 HR14321 [0,1,0,0,0,0|1,1,0]=3 247 B8R1.3 CC1=CN=C(O)C=N1 HR147862 [0,1,0,0,0,0|2,1,0]=4 248 B8R1.3 CC1=NC=C(Br)C=C1 HR4058 [0,1,0,0,0,0|2,0,0]=3 249 B8R1.3 CC1=NC=C(Br)C=N1 HR30429 [0,1,0,0,0,0|3,0,0]=4 250 B8R1.3 CC1=NC=C(Cl)C=C1 HR120085 [0,1,0,0,0,0|2,0,0]=3 251 B8R1.3 CC1=NC=C(Cl)C=N1 HR147489 [0,1,0,0,0,0|3,0,0]=4 252 B8R1.3 CC1=NC=C(F)C=C1 HR129366 [0,1,0,0,0,0|2,0,0]=3 253 B8R1.3 CC1=NC=C(I)C=C1 HR6698 [0,1,0,0,0,0|2,0,0]=3 254 B8R1.3 CC1=NC=C(N)C=N1 HR130339 [0,1,0,0,0,0|3,0,0]=4 255 B8R1.3 CC1=NC=C(O)C=N1 HR110662 [0,1,0,0,0,0|2,1,0]=4 256 B8R1.3 CC1=NNC(=O)C=C1 HR125138 [0,1,0,0,0,0|2,1,0]=4 257 B8R1.3 CC1=NNC(=S)C=C1 HR113051 [0,1,0,0,0,0|2,0,1]=4 258 B8R1.3 Cc1ccc(O)cc1 HR128349 [0,1,0,0,0,0|0,1,0]=2 259 B8R1.3 Cc1ccc([SiH3])cc1 HR143570 [0,1,0,0,0,0|1,0,0]=2 260 B8R1.3 ClC1=CC=C(Br)C=C1 HR132877 [0,1,0,0,0,0|1,0,0]=2 261 B8R1.3 ClC1=CC=C(Br)N=N1 HR105360 [0,1,0,0,0,0|3,0,0]=4 262 B8R1.3 ClC1=CC=C(Cl)C=C1 HR100038 [0,1,0,0,0,0|1,0,0]=2 263 B8R1.3 ClC1=CC=C(Cl)N=N1 ENCQ01503 [0,1,0,0,0,0|3,0,0]=4 264 B8R1.3 ClC1=CC=C(I)C=C1 HR134051 [0,1,0,0,0,0|1,0,0]=2 265 B8R1.3 ClC1=CC=C(I)N=N1 HR105826 [0,1,0,0,0,0|3,0,0]=4 266 B8R1.3 ClC1=CN=C(Br)C=C1 HR1169 [0,1,0,0,0,0|2,0,0]=3 267 B8R1.3 ClC1=CN=C(Br)N=C1 HR32420 [0,1,0,0,0,0|3,0,0]=4 268 B8R1.3 ClC1=CN=C(Cl)C=C1 HR1199 [0,1,0,0,0,0|2,0,0]=3 269 B8R1.3 ClC1=CN=C(Cl)C=N1 HR30232 [0,1,0,0,0,0|3,0,0]=4 270 B8R1.3 ClC1=CN=C(Cl)N=C1 HR137018 [0,1,0,0,0,0|3,0,0]=4 271 B8R1.3 ClC1=CN=C(I)C=C1 HR125891 [0,1,0,0,0,0|2,0,0]=3 272 B8R1.3 ClC1=CN=C(I)N=C1 HR101809 [0,1,0,0,0,0|3,0,0]=4 273 B8R1.3 ClC1=NC=C(Br)C=C1 HR1168 [0,1,0,0,0,0|2,0,0]=3 274 B8R1.3 ClC1=NC=C(Br)C=N1 HR138230 [0,1,0,0,0,0|3,0,0]=4 275 B8R1.3 ClC1=NC=C(Br)N=C1 HR119964 [0,1,0,0,0,0|3,0,0]=4 276 B8R1.3 ClC1=NC=C(I)C=C1 HR2078 [0,1,0,0,0,0|2,0,0]=3 277 B8R1.3 ClC1=NC=C(I)C=N1 HR115523 [0,1,0,0,0,0|3,0,0]=4 278 B8R1.3 ClC1=NC=C(I)N=C1 HR147826 [0,1,0,0,0,0|3,0,0]=4 279 B8R1.3 FC1=CC=C(Br)C=C1 HR129390 [0,1,0,0,0,0|1,0,0]=2 280 B8R1.3 FC1=CC=C(Cl)C=C1 HR147155 [0,1,0,0,0,0|1,0,0]=2 281 B8R1.3 FC1=CC=C(F)C=C1 HR146974 [0,1,0,0,0,0|1,0,0]=2 282 B8R1.3 FC1=CC=C(F)N=N1 HR103994 [0,1,0,0,0,0|3,0,0]=4 283 B8R1.3 FC1=CC=C(I)C=C1 HR129530 [0,1,0,0,0,0|1,0,0]=2 284 B8R1.3 FC1=CC=C(S)C=C1 HR125198 [0,1,0,0,0,0|0,0,0]=1 285 B8R1.3 FC1=CN=C(Br)C=C1 HR1099 [0,1,0,0,0,0|2,0,0]=3 286 B8R1.3 FC1=CN=C(Br)C=N1 HR32785 [0,1,0,0,0,0|3,0,0]=4 287 B8R1.3 FC1=CN=C(Br)N=C1 HR120673 [0,1,0,0,0,0|3,0,0]=4 288 B8R1.3 FC1=CN=C(Cl)C=C1 HR1097 [0,1,0,0,0,0|2,0,0]=3 289 B8R1.3 FC1=CN=C(Cl)N=C1 HR133795 [0,1,0,0,0,0|3,0,0]=4 290 B8R1.3 FC1=CN=C(F)C=C1 HR133853 [0,1,0,0,0,0|2,0,0]=3 291 B8R1.3 FC1=CN=C(I)C=C1 HR116954 [0,1,0,0,0,0|2,0,0]=3 292 B8R1.3 FC1=NC=C(Br)C=C1 HR3550 [0,1,0,0,0,0|2,0,0]=3 293 B8R1.3 FC1=NC=C(Br)C=N1 HR123044 [0,1,0,0,0,0|3,0,0]=4 294 B8R1.3 FC1=NC=C(Cl)C=C1 HR1186 [0,1,0,0,0,0|2,0,0]=3 295 B8R1.3 FC1=NC=C(I)C=C1 HR6324 [0,1,0,0,0,0|2,0,0]=3 296 B8R1.3 IC1=CC=C(I)C=C1 HR135375 [0,1,0,0,0,0|1,0,0]=2 297 B8R1.3 IC1=CC=C(I)N=N1 HR131182 [0,1,0,0,0,0|3,0,0]=4 298 B8R1.3 IC1=CN=C(I)C=C1 HR125647 [0,1,0,0,0,0|2,0,0]=3 299 B8R1.3 NC1=CC=C(Br)C=C1 GASA04301 [0,1,0,0,0,0|1,0,0]=2 300 B8R1.3 NC1=CC=C(Br)N=C1 HR132418 [0,1,0,0,0,0|2,0,0]=3 301 B8R1.3 NC1=CC=C(Br)N=N1 HR117077 [0,1,0,0,0,0|3,0,0]=4 302 B8R1.3 NC1=CC=C(Cl)C=C1 HR146918 [0,1,0,0,0,0|1,0,0]=2 303 B8R1.3 NC1=CC=C(Cl)N=N1 HR9496 [0,1,0,0,0,0|3,0,0]=4 304 B8R1.3 NC1=CC=C(F)C=C1 HR147053 [0,1,0,0,0,0|1,0,0]=2 305 B8R1.3 NC1=CC=C(I)C=C1 HR127574 [0,1,0,0,0,0|1,0,0]=2 306 B8R1.3 NC1=CC=C(N)N=N1 HR104564 [0,1,0,0,0,0|3,0,0]=4 307 B8R1.3 NC1=CC=C(O)C=C1 DOXF02203 [0,1,0,0,0,0|0,1,0]=2 308 B8R1.3 NC1=CC=C(O)C=N1 HR104751 [0,1,0,0,0,0|1,1,0]=3 309 B8R1.3 NC1=CC=C(O)C=N1 HR136765 [0,1,0,0,0,0|1,1,0]=3 310 B8R1.3 NC1=CC=C(S)C=C1 HR2471 [0,1,0,0,0,0|0,0,0]=1 311 B8R1.3 NC1=CN=C(Br)N=C1 HR33631 [0,1,0,0,0,0|3,0,0]=4 312 B8R1.3 NC1=CN=C(Cl)C=C1 HR2406 [0,1,0,0,0,0|2,0,0]=3 313 B8R1.3 NC1=CN=C(Cl)N=C1 HR133345 [0,1,0,0,0,0|3,0,0]=4 314 B8R1.3 NC1=CN=C(F)C=C1 HR1155 [0,1,0,0,0,0|2,0,0]=3 315 B8R1.3 NC1=CN=C(N)C=C1 HR130782 [0,1,0,0,0,0|2,0,0]=3 316 B8R1.3 NC1=CN=C(N)C=N1 HR148345 [0,1,0,0,0,0|3,0,0]=4 317 B8R1.3 NC1=CN=C(N)N=C1 HR122008 [0,1,0,0,0,0|3,0,0]=4 318 B8R1.3 NC1=CN=C(O)C=C1 HR104123 [0,1,0,0,0,0|1,1,0]=3 319 B8R1.3 NC1=CN=C(O)C=C1 HR6563 [0,1,0,0,0,0|1,1,0]=3 320 B8R1.3 NC1=NC=C(Br)C=C1 HR1107 [0,1,0,0,0,0|2,0,0]=3 321 B8R1.3 NC1=NC=C(Br)C=N1 HR30063 [0,1,0,0,0,0|3,0,0]=4 322 B8R1.3 NC1=NC=C(Br)N=C1 HR8867 [0,1,0,0,0,0|3,0,0]=4 323 B8R1.3 NC1=NC=C(Cl)C=C1 HR126672 [0,1,0,0,0,0|2,0,0]=3 324 B8R1.3 NC1=NC=C(Cl)C=N1 HR134102 [0,1,0,0,0,0|3,0,0]=4 325 B8R1.3 NC1=NC=C(Cl)N=C1 HR121823 [0,1,0,0,0,0|3,0,0]=4 326 B8R1.3 NC1=NC=C(F)C=C1 HR1109 [0,1,0,0,0,0|2,0,0]=3 327 B8R1.3 NC1=NC=C(F)C=N1 HR102597 [0,1,0,0,0,0|3,0,0]=4 328 B8R1.3 NC1=NC=C(I)C=C1 HR2407 [0,1,0,0,0,0|2,0,0]=3 329 B8R1.3 NC1=NC=C(I)C=N1 HR104487 [0,1,0,0,0,0|3,0,0]=4 330 B8R1.3 NC1=NC=C(I)N=C1 HR147813 [0,1,0,0,0,0|3,0,0]=4 331 B8R1.3 NC1=NC=C(O)C=N1 HR131743 [0,1,0,0,0,0|2,1,0]=4 332 B8R1.3 Nc1ccc(Cl)cc1 HR123459 [0,1,0,0,0,0|1,0,0]=2 333 B8R1.3 Nc1ccc(N)cc1 HR142575 [0,1,0,0,0,0|1,0,0]=2 334 B8R1.3 Nc1ccc(N)nc1 HR144712 [0,1,0,0,0,0|2,0,0]=3 335 B8R1.3 O=C1C=CC(=O)C=C1 HR129503 [0,1,0,0,0,0|0,1,0]=2 336 B8R1.3 O=C1C=CC(=O)C=C1 HR14592 [0,1,0,0,0,0|0,1,0]=2 337 B8R1.3 O=C1C=NC(Br)=CN1 HR30621 [0,1,0,0,0,0|2,1,0]=4 338 B8R1.3 O=C1C=NC(Cl)=CN1 HR30622 [0,1,0,0,0,0|2,1,0]=4 339 B8R1.3 OC1=CC=C(Br)C=C1 HR146620 [0,1,0,0,0,0|0,1,0]=2 340 B8R1.3 OC1=CC=C(Cl)C=C1 HR147432 [0,1,0,0,0,0|0,1,0]=2 341 B8R1.3 OC1=CC=C(Cl)N=N1 HR117029 [0,1,0,0,0,0|2,1,0]=4 342 B8R1.3 OC1=CC=C(F)C=C1 HR138117 [0,1,0,0,0,0|0,1,0]=2 343 B8R1.3 OC1=CC=C(I)C=C1 HR3199 [0,1,0,0,0,0|0,1,0]=2 344 B8R1.3 OC1=CC=C(S)C=C1 HR135276 [0,1,0,0,0,0|0,0,0]=1 345 B8R1.3 OC1=CN=C(Br)C=C1 HR125117 [0,1,0,0,0,0|1,1,0]=3 346 B8R1.3 OC1=CN=C(Cl)C=C1 HR130615 [0,1,0,0,0,0|1,1,0]=3 347 B8R1.3 OC1=CN=C(Cl)N=C1 HR31764 [0,1,0,0,0,0|2,1,0]=4 348 B8R1.3 OC1=CN=C(F)C=C1 HR6321 [0,1,0,0,0,0|1,1,0]=3 349 B8R1.3 OC1=CN=C(I)C=C1 HR115833 [0,1,0,0,0,0|1,1,0]=3 350 B8R1.3 OC1=NC=C(Br)C=C1 HR126401 [0,1,0,0,0,0|1,1,0]=3 351 B8R1.3 OC1=NC=C(Br)C=N1 HR138205 [0,1,0,0,0,0|2,1,0]=4 352 B8R1.3 OC1=NC=C(Br)C=N1 HR146537 [0,1,0,0,0,0|2,1,0]=4 353 B8R1.3 OC1=NC=C(Cl)C=C1 HR135593 [0,1,0,0,0,0|1,1,0]=3 354 B8R1.3 OC1=NC=C(Cl)C=N1 HR122378 [0,1,0,0,0,0|2,1,0]=4 355 B8R1.3 OC1=NC=C(F)C=C1 HR137792 [0,1,0,0,0,0|1,1,0]=3 356 B8R1.3 OC1=NC=C(I)C=C1 HR137857 [0,1,0,0,0,0|1,1,0]=3 357 B8R1.3 OC1=NC=C(I)C=N1 HR147494 [0,1,0,0,0,0|2,1,0]=4 358 B8R1.3 S=C1C=CC(Cl)=CN1 HR107424 [0,1,0,0,0,0|1,0,1]=3 359 B8R1.3 SC1=CC=C(Br)C=C1 HR4043 [0,1,0,0,0,0|0,0,0]=1 360 B8R1.3 SC1=CC=C(Br)C=N1 HR148263 [0,1,0,0,0,0|1,0,0]=2 361 B8R1.3 SC1=CC=C(S)C=C1 HR141245 [0,1,0,0,0,0|0,0,0]=1 362 B8R1.3 [O-][N+]1=CC=C(Br)C=C1 HR105098 [0,1,0,0,0,0|1,1,0]=3 363 B8R1.3 [O-][N+]1=CC=C(Cl)C=C1 HR106976 [0,1,0,0,0,0|1,1,0]=3 364 B8R1.3 [O-][N+]1=CC=[N+]([O-])C=C1 HR100345 [0,1,0,0,0,0|2,1,0]=4 365 B8R1.3 [SiH3]C1=CC=C(Cl)C=C1 HR101057 [0,1,0,0,0,0|1,0,0]=2 366 B8R1.4 BrC1=CC(Br)=NC=C1 HR5452 [0,1,0,0,0,0|2,0,0]=3 367 B8R1.4 BrC1=CC(Br)=NC=N1 HR32778 [0,1,0,0,0,0|3,0,0]=4 368 B8R1.4 BrC1=CC(I)=CC=C1 HR135115 [0,1,0,0,0,0|1,0,0]=2 369 B8R1.4 BrC1=CC(I)=CN=C1 HR117916 [0,1,0,0,0,0|2,0,0]=3 370 B8R1.4 BrC1=CC(I)=NC=C1 HR118999 [0,1,0,0,0,0|2,0,0]=3 371 B8R1.4 BrC1=CC=CC(Br)=C1 HR134993 [0,1,0,0,0,0|1,0,0]=2 372 B8R1.4 BrC1=CC=CC(Br)=N1 LAXF01505 [0,1,0,0,0,0|2,0,0]=3 373 B8R1.4 BrC1=CN=CC(Br)=C1 HR136404 [0,1,0,0,0,0|2,0,0]=3 374 B8R1.4 BrC1=CN=CC(Br)=N1 HR104446 [0,1,0,0,0,0|3,0,0]=4 375 B8R1.4 BrC1=NC(Br)=NC=C1 HR30223 [0,1,0,0,0,0|3,0,0]=4 376 B8R1.4 BrC1=NC(I)=CC=C1 HR113549 [0,1,0,0,0,0|2,0,0]=3 377 B8R1.4 BrC1=NC=CC(I)=C1 HR134074 [0,1,0,0,0,0|2,0,0]=3 378 B8R1.4 CC1=CC(=O)NN=C1 HR11016 [0,1,0,0,0,0|2,1,0]=4 379 B8R1.4 CC1=CC(Br)=CC=C1 HR147078 [0,1,0,0,0,0|1,0,0]=2 380 B8R1.4 CC1=CC(Br)=NC=C1 HR1184 [0,1,0,0,0,0|2,0,0]=3 381 B8R1.4 CC1=CC(Br)=NC=N1 HR148333 [0,1,0,0,0,0|3,0,0]=4 382 B8R1.4 CC1=CC(C)=NC=N1 HR132989 [0,1,0,0,0,0|3,0,0]=4 383 B8R1.4 CC1=CC(Cl)=NC=C1 HR1192 [0,1,0,0,0,0|2,0,0]=3 384 B8R1.4 CC1=CC(Cl)=NC=N1 HR13240 [0,1,0,0,0,0|3,0,0]=4 385 B8R1.4 CC1=CC(F)=NC=C1 HR1203 [0,1,0,0,0,0|2,0,0]=3 386 B8R1.4 CC1=CC(I)=NC=C1 HR110692 [0,1,0,0,0,0|2,0,0]=3 387 B8R1.4 CC1=CC(N)=NC=C1 HR146783 [0,1,0,0,0,0|2,0,0]=3 388 B8R1.4 CC1=CC(N)=NC=N1 HR102836 [0,1,0,0,0,0|3,0,0]=4 389 B8R1.4 CC1=CC(O)=CC=C1 IDSA06810 [0,1,0,0,0,0|0,1,0]=2 390 B8R1.4 CC1=CC(O)=NC=C1 HR127276 [0,1,0,0,0,0|1,1,0]=3 391 B8R1.4 CC1=CC(O)=NC=N1 HR105356 [0,1,0,0,0,0|2,1,0]=4 392 B8R1.4 CC1=CC(O)=NC=N1 HR116470 [0,1,0,0,0,0|2,1,0]=4 393 B8R1.4 CC1=CC=CC(=S)N1 HR116107 [0,1,0,0,0,0|1,0,1]=3 394 B8R1.4 CC1=CC=CC(Br)=N1 HR1139 [0,1,0,0,0,0|2,0,0]=3 395 B8R1.4 CC1=CC=CC(C)=N1 HR146920 [0,1,0,0,0,0|2,0,0]=3 396 B8R1.4 CC1=CC=CC(Cl)=N1 HR1194 [0,1,0,0,0,0|2,0,0]=3 397 B8R1.4 CC1=CC=CC(F)=C1 HR147075 [0,1,0,0,0,0|1,0,0]=2 398 B8R1.4 CC1=CC=CC(F)=N1 HR138536 [0,1,0,0,0,0|2,0,0]=3 399 B8R1.4 CC1=CC=CC(I)=C1 HR130747 [0,1,0,0,0,0|1,0,0]=2 400 B8R1.4 CC1=CC=CC(I)=N1 HR33220 [0,1,0,0,0,0|2,0,0]=3 401 B8R1.4 CC1=CC=CC(N)=N1 HR126189 [0,1,0,0,0,0|2,0,0]=3 402 B8R1.4 CC1=CC=CC(O)=N1 HR102304 [0,1,0,0,0,0|1,1,0]=3 403 B8R1.4 CC1=CC=CC(O)=N1 HR123689 [0,1,0,0,0,0|1,1,0]=3 404 B8R1.4 CC1=CC=C[N+]([O-])=C1 HR131855 [0,1,0,0,0,0|1,1,0]=3 405 B8R1.4 CC1=CC=NC(=S)N1 HR134884 [0,1,0,0,0,0|2,0,1]=4 406 B8R1.4 CC1=CN=CC(=O)N1 HR110908 [0,1,0,0,0,0|2,1,0]=4 407 B8R1.4 CC1=CN=CC(Br)=C1 HR4036 [0,1,0,0,0,0|2,0,0]=3 408 B8R1.4 CC1=CN=CC(C)=N1 HR129129 [0,1,0,0,0,0|3,0,0]=4 409 B8R1.4 CC1=CN=CC(Cl)=C1 HR109685 [0,1,0,0,0,0|2,0,0]=3 410 B8R1.4 CC1=CN=CC(Cl)=N1 HR107821 [0,1,0,0,0,0|3,0,0]=4 411 B8R1.4 CC1=CN=CC(F)=C1 HR137759 [0,1,0,0,0,0|2,0,0]=3 412 B8R1.4 CC1=CN=CC(N)=C1 HR122715 [0,1,0,0,0,0|2,0,0]=3 413 B8R1.4 CC1=CN=CC(N)=N1 HR106865 [0,1,0,0,0,0|3,0,0]=4 414 B8R1.4 CC1=CN=CC(O)=C1 HR107413 [0,1,0,0,0,0|1,1,0]=3 415 B8R1.4 CC1=CN=NC(Cl)=C1 HR106299 [0,1,0,0,0,0|3,0,0]=4 416 B8R1.4 CC1=NC(Br)=NC=C1 HR107042 [0,1,0,0,0,0|3,0,0]=4 417 B8R1.4 CC1=NC(Cl)=NC=C1 HR6906 [0,1,0,0,0,0|3,0,0]=4 418 B8R1.4 CC1=NC(N)=NC=C1 HR108556 [0,1,0,0,0,0|3,0,0]=4 419 B8R1.4 CC1=NC(O)=NC=C1 HR130877 [0,1,0,0,0,0|2,1,0]=4 420 B8R1.4 CC1=NC(O)=NC=C1 HR144704 [0,1,0,0,0,0|2,1,0]=4 421 B8R1.4 CC1=NC(S)=NC=C1 HR143163 [0,1,0,0,0,0|2,0,0]=3 422 B8R1.4 CC1=NC=CC(Br)=C1 HR4035 [0,1,0,0,0,0|2,0,0]=3 423 B8R1.4 CC1=NC=CC(Cl)=C1 HR138568 [0,1,0,0,0,0|2,0,0]=3 424 B8R1.4 CC1=NC=CC(Cl)=N1 HR16387 [0,1,0,0,0,0|3,0,0]=4 425 B8R1.4 CC1=NC=CC(F)=C1 HR112228 [0,1,0,0,0,0|2,0,0]=3 426 B8R1.4 CC1=NC=CC(I)=C1 HR120740 [0,1,0,0,0,0|2,0,0]=3 427 B8R1.4 CC1=NC=CC(N)=C1 HR123486 [0,1,0,0,0,0|2,0,0]=3 428 B8R1.4 CC1=NC=CC(N)=N1 HR107859 [0,1,0,0,0,0|3,0,0]=4 429 B8R1.4 CC1=NC=CC(O)=C1 HR136769 [0,1,0,0,0,0|1,1,0]=3 430 B8R1.4 CC1=NC=CC(O)=N1 HR112244 [0,1,0,0,0,0|2,1,0]=4 431 B8R1.4 CC1=NC=CC(O)=N1 HR113416 [0,1,0,0,0,0|2,1,0]=4 432 B8R1.4 C[N+]1=CC(Br)=CC=C1 HR150972 [0,1,0,0,0,0|2,0,0]=3 433 B8R1.4 ClC1=CC(Br)=NC=C1 HR134871 [0,1,0,0,0,0|2,0,0]=3 434 B8R1.4 ClC1=CC(Br)=NC=N1 HR31662 [0,1,0,0,0,0|3,0,0]=4 435 B8R1.4 ClC1=CC(Cl)=NC=C1 HR30047 [0,1,0,0,0,0|2,0,0]=3 436 B8R1.4 ClC1=CC(Cl)=NC=N1 HR6913 [0,1,0,0,0,0|3,0,0]=4 437 B8R1.4 ClC1=CC(I)=CC=C1 HR125340 [0,1,0,0,0,0|1,0,0]=2 438 B8R1.4 ClC1=CC(I)=NC=C1 HR32394 [0,1,0,0,0,0|2,0,0]=3 439 B8R1.4 ClC1=CC=CC(Br)=C1 HR125599 [0,1,0,0,0,0|1,0,0]=2 440 B8R1.4 ClC1=CC=CC(Br)=N1 HR9626 [0,1,0,0,0,0|2,0,0]=3 441 B8R1.4 ClC1=CC=CC(Cl)=N1 HR125187 [0,1,0,0,0,0|2,0,0]=3 442 B8R1.4 ClC1=CN=CC(Br)=C1 HR7700 [0,1,0,0,0,0|2,0,0]=3 443 B8R1.4 ClC1=CN=CC(Cl)=C1 HR13506 [0,1,0,0,0,0|2,0,0]=3 444 B8R1.4 ClC1=CN=CC(Cl)=N1 HR132811 [0,1,0,0,0,0|3,0,0]=4 445 B8R1.4 ClC1=CN=NC(Cl)=C1 HR113621 [0,1,0,0,0,0|3,0,0]=4 446 B8R1.4 ClC1=NC(Cl)=NC=C1 DAJL00406 [0,1,0,0,0,0|3,0,0]=4 447 B8R1.4 ClC1=NC(I)=CC=C1 HR152471 [0,1,0,0,0,0|2,0,0]=3 448 B8R1.4 ClC1=NC=CC(Br)=C1 HR1171 [0,1,0,0,0,0|2,0,0]=3 449 B8R1.4 ClC1=NC=CC(I)=C1 HR2579 [0,1,0,0,0,0|2,0,0]=3 450 B8R1.4 ClC1=NC=NC(I)=C1 HR31663 [0,1,0,0,0,0|3,0,0]=4 451 B8R1.4 FC1=CC(Br)=NC=C1 HR115495 [0,1,0,0,0,0|2,0,0]=3 452 B8R1.4 FC1=CC(Cl)=NC=C1 HR6180 [0,1,0,0,0,0|2,0,0]=3 453 B8R1.4 FC1=CC(Cl)=NC=N1 HR120886 [0,1,0,0,0,0|3,0,0]=4 454 B8R1.4 FC1=CC(F)=NC=C1 HR122747 [0,1,0,0,0,0|2,0,0]=3 455 B8R1.4 FC1=CC(I)=CC=C1 HR136349 [0,1,0,0,0,0|1,0,0]=2 456 B8R1.4 FC1=CC(I)=CN=C1 HR104502 [0,1,0,0,0,0|2,0,0]=3 457 B8R1.4 FC1=CC=CC(Br)=C1 HR129141 [0,1,0,0,0,0|1,0,0]=2 458 B8R1.4 FC1=CC=CC(Cl)=N1 HR116646 [0,1,0,0,0,0|2,0,0]=3 459 B8R1.4 FC1=CC=CC(F)=C1 HR2308 [0,1,0,0,0,0|1,0,0]=2 460 B8R1.4 FC1=CC=CC(F)=N1 HR9241 [0,1,0,0,0,0|2,0,0]=3 461 B8R1.4 FC1=CC=CC(S)=C1 HR5429 [0,1,0,0,0,0|0,0,0]=1 462 B8R1.4 FC1=CN=CC(Br)=C1 HR132209 [0,1,0,0,0,0|2,0,0]=3 463 B8R1.4 FC1=CN=CC(Cl)=C1 HR126150 [0,1,0,0,0,0|2,0,0]=3 464 B8R1.4 FC1=CN=CC(F)=C1 HR125349 [0,1,0,0,0,0|2,0,0]=3 465 B8R1.4 FC1=CN=CC(F)=C1 HR150327 [0,1,0,0,0,0|2,0,0]=3 466 B8R1.4 FC1=NC(Br)=CC=C1 HR139991 [0,1,0,0,0,0|2,0,0]=3 467 B8R1.4 FC1=NC(Br)=CC=C1 HR14324 [0,1,0,0,0,0|2,0,0]=3 468 B8R1.4 FC1=NC=CC(Br)=C1 HR1228 [0,1,0,0,0,0|2,0,0]=3 469 B8R1.4 FC1=NC=CC(Cl)=C1 HR111330 [0,1,0,0,0,0|2,0,0]=3 470 B8R1.4 FC1=NC=CC(I)=C1 HR3510 [0,1,0,0,0,0|2,0,0]=3 471 B8R1.4 IC1=CC(I)=NC=C1 HR102917 [0,1,0,0,0,0|2,0,0]=3 472 B8R1.4 IC1=CC=CC(I)=C1 HR136610 [0,1,0,0,0,0|1,0,0]=2 473 B8R1.4 IC1=CC=CC(I)=N1 HR146887 [0,1,0,0,0,0|2,0,0]=3 474 B8R1.4 IC1=CN=CC(I)=N1 HR134722 [0,1,0,0,0,0|3,0,0]=4 475 B8R1.4 IC1=NC(I)=NC=C1 HR148047 [0,1,0,0,0,0|3,0,0]=4 476 B8R1.4 NC1=CC(Br)=CC=C1 HR146977 [0,1,0,0,0,0|1,0,0]=2 477 B8R1.4 NC1=CC(Br)=CN=C1 HR122679 [0,1,0,0,0,0|2,0,0]=3 478 B8R1.4 NC1=CC(Br)=NC=C1 HR1222 [0,1,0,0,0,0|2,0,0]=3 479 B8R1.4 NC1=CC(Cl)=CC=C1 HR20239 [0,1,0,0,0,0|1,0,0]=2 480 B8R1.4 NC1=CC(Cl)=CN=C1 HR105279 [0,1,0,0,0,0|2,0,0]=3 481 B8R1.4 NC1=CC(Cl)=CN=C1 HR32545 [0,1,0,0,0,0|2,0,0]=3 482 B8R1.4 NC1=CC(Cl)=NC=C1 HR1248 [0,1,0,0,0,0|2,0,0]=3 483 B8R1.4 NC1=CC(F)=CC=C1 HR150410 [0,1,0,0,0,0|1,0,0]=2 484 B8R1.4 NC1=CC(F)=CN=C1 HR1260 [0,1,0,0,0,0|2,0,0]=3 485 B8R1.4 NC1=CC(F)=NC=C1 HR116597 [0,1,0,0,0,0|2,0,0]=3 486 B8R1.4 NC1=CC(I)=CC=C1 HR132893 [0,1,0,0,0,0|1,0,0]=2 487 B8R1.4 NC1=CC(N)=NC=C1 HR5418 [0,1,0,0,0,0|2,0,0]=3 488 B8R1.4 NC1=CC(N)=NC=N1 HR130458 [0,1,0,0,0,0|3,0,0]=4 489 B8R1.4 NC1=CC(O)=NC=C1 HR120752 [0,1,0,0,0,0|1,1,0]=3 490 B8R1.4 NC1=CC(O)=NC=C1 HR146873 [0,1,0,0,0,0|1,1,0]=3 491 B8R1.4 NC1=CC=CC(=S)N1 HR112349 [0,1,0,0,0,0|1,0,1]=3 492 B8R1.4 NC1=CC=CC(N)=N1 HR114400 [0,1,0,0,0,0|2,0,0]=3 493 B8R1.4 NC1=CC=CC(N)=N1 HR130188 [0,1,0,0,0,0|2,0,0]=3 494 B8R1.4 NC1=CC=CC(O)=C1 HR150861 [0,1,0,0,0,0|0,1,0]=2 495 B8R1.4 NC1=CC=CC(S)=C1 HR125939 [0,1,0,0,0,0|0,0,0]=1 496 B8R1.4 NC1=CN=CC(F)=C1 HR105761 [0,1,0,0,0,0|2,0,0]=3 497 B8R1.4 NC1=CN=CC(N)=C1 HR106990 [0,1,0,0,0,0|2,0,0]=3 498 B8R1.4 NC1=CN=CC(N)=N1 HR148747 [0,1,0,0,0,0|3,0,0]=4 499 B8R1.4 NC1=CN=CC(O)=C1 HR147901 [0,1,0,0,0,0|1,1,0]=3 500 B8R1.4 NC1=CN=CC(O)=C1 HR6627 [0,1,0,0,0,0|1,1,0]=3 501 B8R1.4 NC1=CN=NC(Cl)=C1 HR148310 [0,1,0,0,0,0|3,0,0]=4 502 B8R1.4 NC1=NC(=O)NC=C1 HR137595 [0,1,0,0,0,0|2,1,0]=4 503 B8R1.4 NC1=NC(Br)=CC=C1 HR7663 [0,1,0,0,0,0|2,0,0]=3 504 B8R1.4 NC1=NC(Br)=CN=C1 HR147814 [0,1,0,0,0,0|3,0,0]=4 505 B8R1.4 NC1=NC(Br)=NC=C1 HR32787 [0,1,0,0,0,0|3,0,0]=4 506 B8R1.4 NC1=NC(Cl)=CC=C1 HR9117 [0,1,0,0,0,0|2,0,0]=3 507 B8R1.4 NC1=NC(Cl)=CN=C1 HR8543 [0,1,0,0,0,0|3,0,0]=4 508 B8R1.4 NC1=NC(Cl)=NC=C1 HR125610 [0,1,0,0,0,0|3,0,0]=4 509 B8R1.4 NC1=NC(F)=CC=C1 HR137984 [0,1,0,0,0,0|2,0,0]=3 510 B8R1.4 NC1=NC(N)=NC=C1 HR138039 [0,1,0,0,0,0|3,0,0]=4 511 B8R1.4 NC1=NC(O)=CC=C1 HR106840 [0,1,0,0,0,0|1,1,0]=3 512 B8R1.4 NC1=NC(S)=NC=C1 HR100407 [0,1,0,0,0,0|2,0,0]=3 513 B8R1.4 NC1=NC=CC(Br)=C1 HR4039 [0,1,0,0,0,0|2,0,0]=3 514 B8R1.4 NC1=NC=CC(Br)=N1 HR32786 [0,1,0,0,0,0|3,0,0]=4 515 B8R1.4 NC1=NC=CC(Cl)=C1 HR5695 [0,1,0,0,0,0|2,0,0]=3 516 B8R1.4 NC1=NC=CC(Cl)=N1 HR122973 [0,1,0,0,0,0|3,0,0]=4 517 B8R1.4 NC1=NC=CC(F)=C1 HR107651 [0,1,0,0,0,0|2,0,0]=3 518 B8R1.4 NC1=NC=CC(I)=C1 HR103230 [0,1,0,0,0,0|2,0,0]=3 519 B8R1.4 NC1=NC=CC(I)=N1 HR147758 [0,1,0,0,0,0|3,0,0]=4 520 B8R1.4 NC1=NC=CC(O)=C1 HR105068 [0,1,0,0,0,0|1,1,0]=3 521 B8R1.4 NC1=NC=CC(O)=C1 HR6677 [0,1,0,0,0,0|1,1,0]=3 522 B8R1.4 NC1=NC=CC(O)=N1 HR130931 [0,1,0,0,0,0|2,1,0]=4 523 B8R1.4 NC1=NC=NC(Br)=C1 HR147893 [0,1,0,0,0,0|3,0,0]=4 524 B8R1.4 NC1=NC=NC(Cl)=C1 HR30636 [0,1,0,0,0,0|3,0,0]=4 525 B8R1.4 NC1=NC=NC(I)=C1 HR148082 [0,1,0,0,0,0|3,0,0]=4 526 B8R1.4 NC1=NC=NC(O)=C1 HR128595 [0,1,0,0,0,0|2,1,0]=4 527 B8R1.4 O=C1C=C(Cl)C=NN1 HR113302 [0,1,0,0,0,0|2,1,0]=4 528 B8R1.4 O=C1C=C(Cl)NC=N1 HR123013 [0,1,0,0,0,0|2,1,0]=4 529 B8R1.4 O=C1C=C(F)C=CN1 HR116146 [0,1,0,0,0,0|1,1,0]=3 530 B8R1.4 O=C1C=C(F)NC=N1 HR113935 [0,1,0,0,0,0|2,1,0]=4 531 B8R1.4 O=C1C=C(I)C=NN1 HR121165 [0,1,0,0,0,0|2,1,0]=4 532 B8R1.4 O=C1C=C(S)N=CN1 HR113633 [0,1,0,0,0,0|2,0,0]=3 533 B8R1.4 O=C1C=CC=C(Br)N1 HR32191 [0,1,0,0,0,0|1,1,0]=3 534 B8R1.4 O=C1C=CNC(=O)N1 HR131339 [0,1,0,0,0,0|2,1,0]=4 535 B8R1.4 O=C1C=CNC(=S)N1 HR128324 [0,1,0,0,0,0|2,0,1]=4 536 B8R1.4 O=C1C=CNC(F)=C1 HR118051 [0,1,0,0,0,0|1,1,0]=3 537 B8R1.4 OC1=CC(Br)=CC=C1 HR146769 [0,1,0,0,0,0|0,1,0]=2 538 B8R1.4 OC1=CC(Br)=NC=C1 HR30422 [0,1,0,0,0,0|1,1,0]=3 539 B8R1.4 OC1=CC(Br)=NC=N1 HR148537 [0,1,0,0,0,0|2,1,0]=4 540 B8R1.4 OC1=CC(Cl)=CC=C1 HR147057 [0,1,0,0,0,0|0,1,0]=2 541 B8R1.4 OC1=CC(Cl)=CN=C1 HR30408 [0,1,0,0,0,0|1,1,0]=3 542 B8R1.4 OC1=CC(Cl)=NC=C1 HR2578 [0,1,0,0,0,0|1,1,0]=3 543 B8R1.4 OC1=CC(F)=CC=C1 HR137861 [0,1,0,0,0,0|0,1,0]=2 544 B8R1.4 OC1=CC(I)=CC=C1 HR135819 [0,1,0,0,0,0|0,1,0]=2 545 B8R1.4 OC1=CC(O)=NC=C1 HR108969 [0,1,0,0,0,0|1,1,0]=3 546 B8R1.4 OC1=CC(O)=NC=C1 HR132953 [0,1,0,0,0,0|1,1,0]=3 547 B8R1.4 OC1=CC(O)=NC=N1 HR123343 [0,1,0,0,0,0|2,1,0]=4 548 B8R1.4 OC1=CC=CC(Cl)=N1 HR12988 [0,1,0,0,0,0|1,1,0]=3 549 B8R1.4 OC1=CC=CC(F)=N1 HR117733 [0,1,0,0,0,0|1,1,0]=3 550 B8R1.4 OC1=CC=CC(O)=C1 HR147710 [0,1,0,0,0,0|0,1,0]=2 551 B8R1.4 OC1=CC=CC(O)=N1 HR118512 [0,1,0,0,0,0|1,1,0]=3 552 B8R1.4 OC1=CC=CC(S)=C1 HR131802 [0,1,0,0,0,0|0,0,0]=1 553 B8R1.4 OC1=CN=CC(Br)=C1 HR131420 [0,1,0,0,0,0|1,1,0]=3 554 B8R1.4 OC1=CN=CC(F)=C1 HR6625 [0,1,0,0,0,0|1,1,0]=3 555 B8R1.4 OC1=CN=CC(O)=C1 HR30319 [0,1,0,0,0,0|1,1,0]=3 556 B8R1.4 OC1=NC(Cl)=CN=C1 HR148279 [0,1,0,0,0,0|2,1,0]=4 557 B8R1.4 OC1=NC(Cl)=NC=C1 HR32643 [0,1,0,0,0,0|2,1,0]=4 558 B8R1.4 OC1=NC=CC(Br)=C1 HR118544 [0,1,0,0,0,0|1,1,0]=3 559 B8R1.4 OC1=NC=CC(Cl)=C1 HR112849 [0,1,0,0,0,0|1,1,0]=3 560 B8R1.4 OC1=NC=CC(I)=C1 HR31945 [0,1,0,0,0,0|1,1,0]=3 561 B8R1.4 SC1=CC(Br)=CC=C1 HR127811 [0,1,0,0,0,0|0,0,0]=1 562 B8R1.4 SC1=CC(Cl)=CC=C1 HR133383 [0,1,0,0,0,0|0,0,0]=1 563 B8R1.4 Sc1cccc(S)n1 HR102605 [0,1,0,0,0,0|1,0,0]=2 564 B8R1.4 [O-][N+]1=CC(Br)=CC=C1 HR155356 [0,1,0,0,0,0|1,1,0]=3 565 B8R1.4 [O-][N+]1=CC(Cl)=CC=C1 HR32236 [0,1,0,0,0,0|1,1,0]=3 566 B8R1.4 [O-][N+]1=CC(F)=CC=C1 HR143483 [0,1,0,0,0,0|1,1,0]=3 567 B8R1.4 [O-][N+]1=CC(O)=CC=C1 HR141596 [0,1,0,0,0,0|1,1,0]=3 568 B8R1.5 BrC1=C(Br)C=CC=C1 HR147058 [0,1,0,0,0,0|1,0,0]=2 569 B8R1.5 BrC1=C(Br)C=NC=C1 HR114426 [0,1,0,0,0,0|2,0,0]=3 570 B8R1.5 BrC1=C(I)C=CC=C1 HR139833 [0,1,0,0,0,0|1,0,0]=2 571 B8R1.5 BrC1=C(I)C=CC=C1 HR2278 [0,1,0,0,0,0|1,0,0]=2 572 B8R1.5 BrC1=C(I)C=CN=C1 HR121175 [0,1,0,0,0,0|2,0,0]=3 573 B8R1.5 BrC1=C(I)C=NC=C1 HR107930 [0,1,0,0,0,0|2,0,0]=3 574 B8R1.5 BrC1=CC=CN=C1Br HR5402 [0,1,0,0,0,0|2,0,0]=3 575 B8R1.5 BrC1=CC=CN=C1I HR111152 [0,1,0,0,0,0|2,0,0]=3 576 B8R1.5 BrC1=NC=CC=C1I HR111010 [0,1,0,0,0,0|2,0,0]=3 577 B8R1.5 BrC1=NC=CN=C1Br HR148131 [0,1,0,0,0,0|3,0,0]=4 578 B8R1.5 CC1=C(Br)C=CC=C1 HR3834 [0,1,0,0,0,0|1,0,0]=2 579 B8R1.5 CC1=C(Br)C=CN=C1 HR136743 [0,1,0,0,0,0|2,0,0]=3 580 B8R1.5 CC1=C(Br)C=NC=C1 HR3994 [0,1,0,0,0,0|2,0,0]=3 581 B8R1.5 CC1=C(Cl)C=CN=C1 HR123542 [0,1,0,0,0,0|2,0,0]=3 582 B8R1.5 CC1=C(Cl)C=CN=C1 HR9218 [0,1,0,0,0,0|2,0,0]=3 583 B8R1.5 CC1=C(Cl)C=NC=C1 HR110950 [0,1,0,0,0,0|2,0,0]=3 584 B8R1.5 CC1=C(Cl)N=NC=C1 HR105674 [0,1,0,0,0,0|3,0,0]=4 585 B8R1.5 CC1=C(F)C=CN=C1 HR110786 [0,1,0,0,0,0|2,0,0]=3 586 B8R1.5 CC1=C(F)C=NC=C1 HR9251 [0,1,0,0,0,0|2,0,0]=3 587 B8R1.5 CC1=C(I)C=CC=C1 HR130478 [0,1,0,0,0,0|1,0,0]=2 588 B8R1.5 CC1=C(N)C=CN=C1 HR1119 [0,1,0,0,0,0|2,0,0]=3 589 B8R1.5 CC1=C(N)C=NC=C1 HR1278 [0,1,0,0,0,0|2,0,0]=3 590 B8R1.5 CC1=C(O)C=NC=C1 HR115514 [0,1,0,0,0,0|1,1,0]=3 591 B8R1.5 CC1=CC=CC=[N+]1[O-] HR122610 [0,1,0,0,0,0|1,1,0]=3 592 B8R1.5 CC1=CC=CN=C1Br HR9208 [0,1,0,0,0,0|2,0,0]=3 593 B8R1.5 CC1=CC=CN=C1C HR133818 [0,1,0,0,0,0|2,0,0]=3 594 B8R1.5 CC1=CC=CN=C1Cl HR123809 [0,1,0,0,0,0|2,0,0]=3 595 B8R1.5 CC1=CC=CN=C1F HR3992 [0,1,0,0,0,0|2,0,0]=3 596 B8R1.5 CC1=CC=CN=C1I HR138350 [0,1,0,0,0,0|2,0,0]=3 597 B8R1.5 CC1=CC=CN=C1N HR131109 [0,1,0,0,0,0|2,0,0]=3 598 B8R1.5 CC1=CC=CN=C1O HR8871 [0,1,0,0,0,0|1,1,0]=3 599 B8R1.5 CC1=CC=CNC1=O HR101557 [0,1,0,0,0,0|1,1,0]=3 600 B8R1.5 CC1=CC=NNC1=O HR110974 [0,1,0,0,0,0|2,1,0]=4 601 B8R1.5 CC1=CN=CN=C1Br HR148130 [0,1,0,0,0,0|3,0,0]=4 602 B8R1.5 CC1=CN=CN=C1Cl HR116131 [0,1,0,0,0,0|3,0,0]=4 603 B8R1.5 CC1=CN=CN=C1N HR107095 [0,1,0,0,0,0|3,0,0]=4 604 B8R1.5 CC1=CN=CNC1=O HR109493 [0,1,0,0,0,0|2,1,0]=4 605 B8R1.5 CC1=NC=CC=C1Br HR1220 [0,1,0,0,0,0|2,0,0]=3 606 B8R1.5 CC1=NC=CC=C1Cl HR115515 [0,1,0,0,0,0|2,0,0]=3 607 B8R1.5 CC1=NC=CC=C1F HR105446 [0,1,0,0,0,0|2,0,0]=3 608 B8R1.5 CC1=NC=CC=C1I HR112363 [0,1,0,0,0,0|2,0,0]=3 609 B8R1.5 CC1=NC=CC=C1N HR135664 [0,1,0,0,0,0|2,0,0]=3 610 B8R1.5 CC1=NC=CC=C1O HR6626 [0,1,0,0,0,0|1,1,0]=3 611 B8R1.5 CC1=NC=CN=C1Br HR116581 [0,1,0,0,0,0|3,0,0]=4 612 B8R1.5 CC1=NC=CN=C1C HR136586 [0,1,0,0,0,0|3,0,0]=4 613 B8R1.5 CC1=NC=CN=C1Cl HR2149 [0,1,0,0,0,0|3,0,0]=4 614 B8R1.5 CC1=NC=CN=C1N HR33319 [0,1,0,0,0,0|3,0,0]=4 615 B8R1.5 CC1=NC=CN=C1O HR33318 [0,1,0,0,0,0|2,1,0]=4 616 B8R1.5 CC1=NC=NC=C1Br HR17240 [0,1,0,0,0,0|3,0,0]=4 617 B8R1.5 CC1=NC=NC=C1Cl HR147077 [0,1,0,0,0,0|3,0,0]=4 618 B8R1.5 CC1=NC=NC=C1I HR148219 [0,1,0,0,0,0|3,0,0]=4 619 B8R1.5 CC1=NC=NC=C1N HR33990 [0,1,0,0,0,0|3,0,0]=4 620 B8R1.5 C[N+]1=C(Cl)C=CC=C1 HR122254 [0,1,0,0,0,0|2,0,0]=3 621 B8R1.5 Cc1cccc[n+]1N HR140760 [0,1,0,0,0,0|2,0,0]=3 622 B8R1.5 Cc1cccnc1N HR111705 [0,1,0,0,0,0|2,0,0]=3 623 B8R1.5 Cc1cnccc1Br HR6889 [0,1,0,0,0,0|2,0,0]=3 624 B8R1.5 Cc1cnccc1O HR110964 [0,1,0,0,0,0|1,1,0]=3 625 B8R1.5 ClC1=C(Br)C=CC=C1 HR122937 [0,1,0,0,0,0|1,0,0]=2 626 B8R1.5 ClC1=C(Br)C=CN=C1 HR1288 [0,1,0,0,0,0|2,0,0]=3 627 B8R1.5 ClC1=C(Br)C=NC=C1 HR110876 [0,1,0,0,0,0|2,0,0]=3 628 B8R1.5 ClC1=C(Br)C=NC=C1 HR136506 [0,1,0,0,0,0|2,0,0]=3 629 B8R1.5 ClC1=C(Cl)C=CC=C1 HR147133 [0,1,0,0,0,0|1,0,0]=2 630 B8R1.5 ClC1=C(Cl)C=NC=C1 HR6613 [0,1,0,0,0,0|2,0,0]=3 631 B8R1.5 ClC1=C(I)C=CC=C1 HR134316 [0,1,0,0,0,0|1,0,0]=2 632 B8R1.5 ClC1=C(I)C=CN=C1 HR115934 [0,1,0,0,0,0|2,0,0]=3 633 B8R1.5 ClC1=C(I)C=NC=C1 HR114568 [0,1,0,0,0,0|2,0,0]=3 634 B8R1.5 ClC1=CC=CN=C1Br HR135714 [0,1,0,0,0,0|2,0,0]=3 635 B8R1.5 ClC1=CC=CN=C1Cl HR1198 [0,1,0,0,0,0|2,0,0]=3 636 B8R1.5 ClC1=CC=CN=C1I HR114262 [0,1,0,0,0,0|2,0,0]=3 637 B8R1.5 ClC1=CN=CN=C1Cl HR112037 [0,1,0,0,0,0|3,0,0]=4 638 B8R1.5 ClC1=NC=CC=C1Br HR1098 [0,1,0,0,0,0|2,0,0]=3 639 B8R1.5 ClC1=NC=CC=C1I HR1188 [0,1,0,0,0,0|2,0,0]=3 640 B8R1.5 ClC1=NC=CN=C1Cl HR130498 [0,1,0,0,0,0|3,0,0]=4 641 B8R1.5 ClC1=NC=NC=C1Br HR110452 [0,1,0,0,0,0|3,0,0]=4 642 B8R1.5 ClC1=NC=NC=C1I HR7344 [0,1,0,0,0,0|3,0,0]=4 643 B8R1.5 FC1=C(Br)C=CC=C1 HR128872 [0,1,0,0,0,0|1,0,0]=2 644 B8R1.5 FC1=C(Br)C=CN=C1 HR118861 [0,1,0,0,0,0|2,0,0]=3 645 B8R1.5 FC1=C(Br)C=CN=C1 HR146607 [0,1,0,0,0,0|2,0,0]=3 646 B8R1.5 FC1=C(Br)C=NC=C1 HR105209 [0,1,0,0,0,0|2,0,0]=3 647 B8R1.5 FC1=C(Cl)C=CC=C1 HR147074 [0,1,0,0,0,0|1,0,0]=2 648 B8R1.5 FC1=C(Cl)C=CN=C1 HR116813 [0,1,0,0,0,0|2,0,0]=3 649 B8R1.5 FC1=C(Cl)C=CN=C1 HR151181 [0,1,0,0,0,0|2,0,0]=3 650 B8R1.5 FC1=C(Cl)C=NC=C1 HR113476 [0,1,0,0,0,0|2,0,0]=3 651 B8R1.5 FC1=C(F)C=CC=C1 HR147134 [0,1,0,0,0,0|1,0,0]=2 652 B8R1.5 FC1=C(F)C=NC=C1 HR104480 [0,1,0,0,0,0|2,0,0]=3 653 B8R1.5 FC1=C(I)C=CC=C1 HR137773 [0,1,0,0,0,0|1,0,0]=2 654 B8R1.5 FC1=C(I)C=CN=C1 HR32035 [0,1,0,0,0,0|2,0,0]=3 655 B8R1.5 FC1=C(S)C=CC=C1 HR141832 [0,1,0,0,0,0|0,0,0]=1 656 B8R1.5 FC1=CC=CN=C1Br HR107454 [0,1,0,0,0,0|2,0,0]=3 657 B8R1.5 FC1=CC=CN=C1Cl HR2532 [0,1,0,0,0,0|2,0,0]=3 658 B8R1.5 FC1=CC=CN=C1F HR136989 [0,1,0,0,0,0|2,0,0]=3 659 B8R1.5 FC1=CC=CN=C1I HR118160 [0,1,0,0,0,0|2,0,0]=3 660 B8R1.5 FC1=CN=CN=C1Br HR115178 [0,1,0,0,0,0|3,0,0]=4 661 B8R1.5 FC1=CN=CN=C1Cl HR147706 [0,1,0,0,0,0|3,0,0]=4 662 B8R1.5 FC1=NC=CC=C1Br HR3008 [0,1,0,0,0,0|2,0,0]=3 663 B8R1.5 FC1=NC=CC=C1Cl HR129122 [0,1,0,0,0,0|2,0,0]=3 664 B8R1.5 FC1=NC=CC=C1I HR122170 [0,1,0,0,0,0|2,0,0]=3 665 B8R1.5 IC1=C(I)C=CC=C1 HR125859 [0,1,0,0,0,0|1,0,0]=2 666 B8R1.5 IC1=CC=CN=C1I HR153025 [0,1,0,0,0,0|2,0,0]=3 667 B8R1.5 NC1=C(Br)C=CC=C1 HR146980 [0,1,0,0,0,0|1,0,0]=2 668 B8R1.5 NC1=C(Br)C=CN=C1 HR131448 [0,1,0,0,0,0|2,0,0]=3 669 B8R1.5 NC1=C(Br)C=NC=C1 HR135412 [0,1,0,0,0,0|2,0,0]=3 670 B8R1.5 NC1=C(Cl)C=CC=C1 HR106496 [0,1,0,0,0,0|1,0,0]=2 671 B8R1.5 NC1=C(Cl)C=CC=C1 HR147059 [0,1,0,0,0,0|1,0,0]=2 672 B8R1.5 NC1=C(Cl)C=CN=C1 HR132779 [0,1,0,0,0,0|2,0,0]=3 673 B8R1.5 NC1=C(Cl)C=NC=C1 HR122419 [0,1,0,0,0,0|2,0,0]=3 674 B8R1.5 NC1=C(F)C=CC=C1 LECQ00905 [0,1,0,0,0,0|1,0,0]=2 675 B8R1.5 NC1=C(F)C=NC=C1 HR1261 [0,1,0,0,0,0|2,0,0]=3 676 B8R1.5 NC1=C(I)C=CC=C1 HR132618 [0,1,0,0,0,0|1,0,0]=2 677 B8R1.5 NC1=C(I)C=CN=C1 HR6681 [0,1,0,0,0,0|2,0,0]=3 678 B8R1.5 NC1=C(I)C=NC=C1 HR131803 [0,1,0,0,0,0|2,0,0]=3 679 B8R1.5 NC1=C(N)C=NC=C1 HR1295 [0,1,0,0,0,0|2,0,0]=3 680 B8R1.5 NC1=C(O)C=CC=C1 HR147260 [0,1,0,0,0,0|0,1,0]=2 681 B8R1.5 NC1=C(O)C=CN=C1 HR135148 [0,1,0,0,0,0|1,1,0]=3 682 B8R1.5 NC1=C(O)C=NC=C1 HR137347 [0,1,0,0,0,0|1,1,0]=3 683 B8R1.5 NC1=CC=CN=C1Br HR136257 [0,1,0,0,0,0|2,0,0]=3 684 B8R1.5 NC1=CC=CN=C1Cl HR137306 [0,1,0,0,0,0|2,0,0]=3 685 B8R1.5 NC1=CC=CN=C1F HR137001 [0,1,0,0,0,0|2,0,0]=3 686 B8R1.5 NC1=CC=CN=C1I HR111116 [0,1,0,0,0,0|2,0,0]=3 687 B8R1.5 NC1=CC=CN=C1N HR1296 [0,1,0,0,0,0|2,0,0]=3 688 B8R1.5 NC1=CC=CN=C1O HR136029 [0,1,0,0,0,0|1,1,0]=3 689 B8R1.5 NC1=CC=CN=C1O HR146499 [0,1,0,0,0,0|1,1,0]=3 690 B8R1.5 NC1=CC=CNC1=S HR115011 [0,1,0,0,0,0|1,0,1]=3 691 B8R1.5 NC1=CC=NNC1=O HR108870 [0,1,0,0,0,0|2,1,0]=4 692 B8R1.5 NC1=CN=CN=C1Br HR33328 [0,1,0,0,0,0|3,0,0]=4 693 B8R1.5 NC1=CN=CN=C1Cl HR132327 [0,1,0,0,0,0|3,0,0]=4 694 B8R1.5 NC1=CN=CN=C1N HR30073 [0,1,0,0,0,0|3,0,0]=4 695 B8R1.5 NC1=CN=CNC1=O HR110134 [0,1,0,0,0,0|2,1,0]=4 696 B8R1.5 NC1=NC=CC=C1Br HR133830 [0,1,0,0,0,0|2,0,0]=3 697 B8R1.5 NC1=NC=CC=C1Cl HR136804 [0,1,0,0,0,0|2,0,0]=3 698 B8R1.5 NC1=NC=CC=C1F HR2976 [0,1,0,0,0,0|2,0,0]=3 699 B8R1.5 NC1=NC=CC=C1I HR123494 [0,1,0,0,0,0|2,0,0]=3 700 B8R1.5 NC1=NC=CC=C1O LOXF02404 [0,1,0,0,0,0|1,1,0]=3 701 B8R1.5 NC1=NC=CC=C1S HR106679 [0,1,0,0,0,0|1,0,0]=2 702 B8R1.5 NC1=NC=CN=C1Br HR30398 [0,1,0,0,0,0|3,0,0]=4 703 B8R1.5 NC1=NC=CN=C1Cl HR103655 [0,1,0,0,0,0|3,0,0]=4 704 B8R1.5 NC1=NC=CN=C1Cl HR138562 [0,1,0,0,0,0|3,0,0]=4 705 B8R1.5 NC1=NC=CN=C1I HR148056 [0,1,0,0,0,0|3,0,0]=4 706 B8R1.5 NC1=NC=CN=C1N HR111087 [0,1,0,0,0,0|3,0,0]=4 707 B8R1.5 NC1=NC=CN=C1O HR30400 [0,1,0,0,0,0|2,1,0]=4 708 B8R1.5 NC1=NC=NC=C1Br HR30222 [0,1,0,0,0,0|3,0,0]=4 709 B8R1.5 NC1=NC=NC=C1Cl HR105221 [0,1,0,0,0,0|3,0,0]=4 710 B8R1.5 NC1=NC=NC=C1F HR112776 [0,1,0,0,0,0|3,0,0]=4 711 B8R1.5 NC1=NC=NC=C1I HR147522 [0,1,0,0,0,0|3,0,0]=4 712 B8R1.5 Nc1ccccc1O HR125449 [0,1,0,0,0,0|0,1,0]=2 713 B8R1.5 O=C1C=CNC=C1Cl HR120402 [0,1,0,0,0,0|1,1,0]=3 714 B8R1.5 O=C1C=CNC=C1F HR117421 [0,1,0,0,0,0|1,1,0]=3 715 B8R1.5 O=C1NC=CC=C1I HR34029 [0,1,0,0,0,0|1,1,0]=3 716 B8R1.5 O=C1NC=NC=C1O HR112688 [0,1,0,0,0,0|2,1,0]=4 717 B8R1.5 OC1=C(Br)C=CC=C1 HR3841 [0,1,0,0,0,0|0,1,0]=2 718 B8R1.5 OC1=C(Br)C=CN=C1 HR156106 [0,1,0,0,0,0|1,1,0]=3 719 B8R1.5 OC1=C(Br)C=CN=C1 HR33276 [0,1,0,0,0,0|1,1,0]=3 720 B8R1.5 OC1=C(Br)C=NC=C1 HR33455 [0,1,0,0,0,0|1,1,0]=3 721 B8R1.5 OC1=C(Cl)C=CN=C1 HR114294 [0,1,0,0,0,0|1,1,0]=3 722 B8R1.5 OC1=C(F)C=CC=C1 HR2313 [0,1,0,0,0,0|0,1,0]=2 723 B8R1.5 OC1=C(I)C=CC=C1 HR3963 [0,1,0,0,0,0|0,1,0]=2 724 B8R1.5 OC1=C(I)C=CN=C1 HR118943 [0,1,0,0,0,0|1,1,0]=3 725 B8R1.5 OC1=C(I)C=CN=C1 HR155923 [0,1,0,0,0,0|1,1,0]=3 726 B8R1.5 OC1=C(I)C=NC=C1 HR116257 [0,1,0,0,0,0|1,1,0]=3 727 B8R1.5 OC1=C(O)C=NC=C1 HR113174 [0,1,0,0,0,0|1,1,0]=3 728 B8R1.5 OC1=C(S)C=CC=C1 HR132747 [0,1,0,0,0,0|0,0,0]=1 729 B8R1.5 OC1=CC=CN=C1Br HR134806 [0,1,0,0,0,0|1,1,0]=3 730 B8R1.5 OC1=CC=CN=C1Cl HR134272 [0,1,0,0,0,0|1,1,0]=3 731 B8R1.5 OC1=CC=CN=C1F HR124057 [0,1,0,0,0,0|1,1,0]=3 732 B8R1.5 OC1=CC=CN=C1I HR140442 [0,1,0,0,0,0|1,1,0]=3 733 B8R1.5 OC1=CC=CN=C1O HR125001 [0,1,0,0,0,0|1,1,0]=3 734 B8R1.5 OC1=NC=CC=C1Br HR30714 [0,1,0,0,0,0|1,1,0]=3 735 B8R1.5 OC1=NC=CC=C1Cl HR123544 [0,1,0,0,0,0|1,1,0]=3 736 B8R1.5 OC1=NC=CC=C1F HR138044 [0,1,0,0,0,0|1,1,0]=3 737 B8R1.5 OC1=NC=NC=C1Br HR115482 [0,1,0,0,0,0|2,1,0]=4 738 B8R1.5 OC1=NC=NC=C1F HR132806 [0,1,0,0,0,0|2,1,0]=4 739 B8R1.5 OC1=NC=NC=C1I HR120654 [0,1,0,0,0,0|2,1,0]=4 740 B8R1.5 On1ccccc1=S HR138699 [0,1,0,0,0,0|1,0,1]=3 741 B8R1.5 SC1=C(Br)C=CC=C1 HR127539 [0,1,0,0,0,0|0,0,0]=1 742 B8R1.5 SC1=C(Cl)C=CC=C1 HR133114 [0,1,0,0,0,0|0,0,0]=1 743 B8R1.5 SC1=CC=CC=C1S HR141898 [0,1,0,0,0,0|0,0,0]=1 744 B8R1.5 [O-][N+]1=C(Br)C=CC=C1 HR131892 [0,1,0,0,0,0|1,1,0]=3 745 B8R1.5 [O-][N+]1=C(Br)C=CC=C1 HR144356 [0,1,0,0,0,0|1,1,0]=3 746 B8R1.5 [O-][N+]1=C(Cl)C=CC=C1 HR105386 [0,1,0,0,0,0|1,1,0]=3 747 B8R1.5 [O-][N+]1=C(Cl)C=CC=C1 HR125974 [0,1,0,0,0,0|1,1,0]=3 748 B8R1.5 [O-][N+]1=CC=CC=C1O HR137775 [0,1,0,0,0,0|1,1,0]=3 749 B8R1.5 [O-][N+]1=CC=CC=C1S HR138434 [0,1,0,0,0,0|1,0,0]=2 750 B8R1.5 [O-][n+]1ccccc1Br HR142800 [0,1,0,0,0,0|1,1,0]=3 751 B8R1.5 [O-][n+]1ccccc1[S-] HR128926 [0,1,0,0,0,0|1,0,1]=3 752 B6R0.6 C\C=C\C=C\C=O HR122495 [0,0,1,0,0,0|0,1,1]=3 753 B6R0.6 C\C=C\C=C\CO HR126927 [0,0,1,0,0,0|0,1,2]=4 754 B6R1.2 BrC1=CC=CO1 HR132225 [0,0,0,0,1,0|2,0,0]=3 755 B6R1.2 BrC1=CC=CS1 HR34180 [0,0,0,0,1,0|2,0,0]=3 756 B6R1.2 BrC1=CN=CO1 HR146519 [0,0,0,0,1,0|3,0,0]=4 757 B6R1.2 BrC1=CN=CS1 HR33453 [0,0,0,0,1,0|3,0,0]=4 758 B6R1.2 BrC1=CNC=C1 HR106799 [0,0,0,0,1,0|2,0,0]=3 759 B6R1.2 BrC1=CNC=N1 HR9443 [0,0,0,0,1,0|3,0,0]=4 760 B6R1.2 BrC1=CNN=C1 HR138778 [0,0,0,0,1,0|3,0,0]=4 761 B6R1.2 BrC1=COC=C1 HR8830 [0,0,0,0,1,0|2,0,0]=3 762 B6R1.2 BrC1=CON=C1 HR103203 [0,0,0,0,1,0|3,0,0]=4 763 B6R1.2 BrC1=CSC=C1 HR126013 [0,0,0,0,1,0|2,0,0]=3 764 B6R1.2 BrC1=CSC=N1 HR4040 [0,0,0,0,1,0|3,0,0]=4 765 B6R1.2 BrC1=CSN=C1 HR113269 [0,0,0,0,1,0|3,0,0]=4 766 B6R1.2 BrC1=NC=CN1 HR126116 [0,0,0,0,1,0|3,0,0]=4 767 B6R1.2 BrC1=NC=CO1 HR107371 [0,0,0,0,1,0|3,0,0]=4 768 B6R1.2 BrC1=NC=CS1 HR125698 [0,0,0,0,1,0|3,0,0]=4 769 B6R1.2 BrC1=NNC=C1 HR117565 [0,0,0,0,1,0|3,0,0]=4 770 B6R1.2 BrC1=NSC=C1 HR109115 [0,0,0,0,1,0|3,0,0]=4 771 B6R1.2 CC1=CC=CN1 HR147294 [0,0,0,0,1,0|2,0,0]=3 772 B6R1.2 CC1=CC=CS1 HR131866 [0,0,0,0,1,0|2,0,0]=3 773 B6R1.2 CC1=CC=NN1 HR10442 [0,0,0,0,1,0|3,0,0]=4 774 B6R1.2 CC1=CC=NO1 HR131159 [0,0,0,0,1,0|3,0,0]=4 775 B6R1.2 CC1=CN=CS1 HR128769 [0,0,0,0,1,0|3,0,0]=4 776 B6R1.2 CC1=CNC=C1 HR13921 [0,0,0,0,1,0|2,0,0]=3 777 B6R1.2 CC1=CNC=N1 HR7153 [0,0,0,0,1,0|3,0,0]=4 778 B6R1.2 CC1=CNN=C1 HR13055 [0,0,0,0,1,0|3,0,0]=4 779 B6R1.2 CC1=COC=C1 HR125178 [0,0,0,0,1,0|2,0,0]=3 780 B6R1.2 CC1=COC=N1 HR121299 [0,0,0,0,1,0|3,0,0]=4 781 B6R1.2 CC1=CSC=N1 HR132874 [0,0,0,0,1,0|3,0,0]=4 782 B6R1.2 CC1=NC=CN1 HR135019 [0,0,0,0,1,0|3,0,0]=4 783 B6R1.2 CC1=NC=CS1 HR128073 [0,0,0,0,1,0|3,0,0]=4 784 B6R1.2 CC1=NNC=C1 HR13253 [0,0,0,0,1,0|3,0,0]=4 785 B6R1.2 CC1=NOC=C1 HR104498 [0,0,0,0,1,0|3,0,0]=4 786 B6R1.2 CC1=NSC=C1 HR105128 [0,0,0,0,1,0|3,0,0]=4 787 B6R1.2 CN1C=CC=C1 HR131584 [0,0,0,0,1,0|2,0,0]=3 788 B6R1.2 CN1C=CC=N1 HR128244 [0,0,0,0,1,0|3,0,0]=4 789 B6R1.2 CN1C=CN=C1 HR134754 [0,0,0,0,1,0|3,0,0]=4 790 B6R1.2 ClC1=CC=CS1 HR130520 [0,0,0,0,1,0|2,0,0]=3 791 B6R1.2 ClC1=CNC=N1 HR122069 [0,0,0,0,1,0|3,0,0]=4 792 B6R1.2 ClC1=CNN=C1 HR130917 [0,0,0,0,1,0|3,0,0]=4 793 B6R1.2 ClC1=CSC=C1 HR130789 [0,0,0,0,1,0|2,0,0]=3 794 B6R1.2 ClC1=CSC=N1 HR119807 [0,0,0,0,1,0|3,0,0]=4 795 B6R1.2 ClC1=NC=CN1 HR120395 [0,0,0,0,1,0|3,0,0]=4 796 B6R1.2 ClC1=NC=CO1 HR102063 [0,0,0,0,1,0|3,0,0]=4 797 B6R1.2 ClC1=NC=CS1 HR135175 [0,0,0,0,1,0|3,0,0]=4 798 B6R1.2 FC1=CC=CS1 HR116433 [0,0,0,0,1,0|2,0,0]=3 799 B6R1.2 FC1=CNC=N1 HR112272 [0,0,0,0,1,0|3,0,0]=4 800 B6R1.2 FC1=CNN=C1 HR146959 [0,0,0,0,1,0|3,0,0]=4 801 B6R1.2 FC1=NC=CN1 HR111959 [0,0,0,0,1,0|3,0,0]=4 802 B6R1.2 IC1=CC=CS1 HR133352 [0,0,0,0,1,0|2,0,0]=3 803 B6R1.2 IC1=CN=CS1 HR30442 [0,0,0,0,1,0|3,0,0]=4 804 B6R1.2 IC1=CNC=N1 HR34118 [0,0,0,0,1,0|3,0,0]=4 805 B6R1.2 IC1=CNN=C1 HR129803 [0,0,0,0,1,0|3,0,0]=4 806 B6R1.2 IC1=CON=C1 HR119946 [0,0,0,0,1,0|3,0,0]=4 807 B6R1.2 IC1=CSC=C1 HR131727 [0,0,0,0,1,0|2,0,0]=3 808 B6R1.2 IC1=NC=CN1 HR127196 [0,0,0,0,1,0|3,0,0]=4 809 B6R1.2 IC1=NNC=C1 HR148460 [0,0,0,0,1,0|3,0,0]=4 810 B6R1.2 NC1=CC=CN1 HR107433 [0,0,0,0,1,0|2,0,0]=3 811 B6R1.2 NC1=CC=CS1 HR102647 [0,0,0,0,1,0|2,0,0]=3 812 B6R1.2 NC1=CC=NN1 HR147285 [0,0,0,0,1,0|3,0,0]=4 813 B6R1.2 NC1=CC=NO1 HR120254 [0,0,0,0,1,0|3,0,0]=4 814 B6R1.2 NC1=CN=CS1 HR127505 [0,0,0,0,1,0|3,0,0]=4 815 B6R1.2 NC1=CN=CS1 HR147472 [0,0,0,0,1,0|3,0,0]=4 816 B6R1.2 NC1=CNC=N1 HR129839 [0,0,0,0,1,0|3,0,0]=4 817 B6R1.2 NC1=CNN=C1 HR102513 [0,0,0,0,1,0|3,0,0]=4 818 B6R1.2 NC1=CNN=C1 HR146877 [0,0,0,0,1,0|3,0,0]=4 819 B6R1.2 NC1=CON=C1 HR102737 [0,0,0,0,1,0|3,0,0]=4 820 B6R1.2 NC1=CSC=C1 HR102995 [0,0,0,0,1,0|2,0,0]=3 821 B6R1.2 NC1=CSC=N1 HR111500 [0,0,0,0,1,0|3,0,0]=4 822 B6R1.2 NC1=NC=CN1 HR125916 [0,0,0,0,1,0|3,0,0]=4 823 B6R1.2 NC1=NC=CN1 HR146724 [0,0,0,0,1,0|3,0,0]=4 824 B6R1.2 NC1=NC=CN1 HR8378 [0,0,0,0,1,0|3,0,0]=4 825 B6R1.2 NC1=NC=CO1 HR133033 [0,0,0,0,1,0|3,0,0]=4 826 B6R1.2 NC1=NC=CS1 HR124885 [0,0,0,0,1,0|3,0,0]=4 827 B6R1.2 NC1=NNC=C1 HR11252 [0,0,0,0,1,0|3,0,0]=4 828 B6R1.2 NC1=NOC=C1 HR8627 [0,0,0,0,1,0|3,0,0]=4 829 B6R1.2 NN1C=CC=C1 HR12475 [0,0,0,0,1,0|2,0,0]=3 830 B6R1.2 Nc1ccsc1 HR114587 [0,0,0,0,1,0|2,0,0]=3 831 B6R1.2 Nc1cnoc1 HR108880 [0,0,0,0,1,0|3,0,0]=4 832 B6R1.2 O=C1C=CCC1 HR136753 [0,0,0,0,1,0|0,1,2]=4 833 B6R1.2 O=C1C=CCO1 HR119486 [0,0,0,0,1,0|1,1,1]=4 834 B6R1.2 O=C1C=CON1 HR31911 [0,0,0,0,1,0|2,1,0]=4 835 B6R1.2 O=C1C=CSN1 HR146483 [0,0,0,0,1,0|2,1,0]=4 836 B6R1.2 O=C1CC=CC1 HR111189 [0,0,0,0,1,0|0,1,2]=4 837 B6R1.2 O=C1OC=CO1 HR128933 [0,0,0,0,1,0|2,1,0]=4 838 B6R1.2 OC1=CNC=C1 HR106486 [0,0,0,0,1,0|1,1,0]=3 839 B6R1.2 OC1=NC=CS1 HR147755 [0,0,0,0,1,0|2,1,0]=4 840 B6R1.2 SC1=CC=CS1 HR128217 [0,0,0,0,1,0|1,0,0]=2 841 B6R1.2 SC1=CSC=C1 HR103982 [0,0,0,0,1,0|1,0,0]=2 842 B6R1.2 SC1=NC=CS1 HR127107 [0,0,0,0,1,0|2,0,0]=3 843 B6R1.2 SC1=NNC=N1 HR135806 [0,0,0,0,1,0|3,0,0]=4 844 B6R1.2 Sc1nncs1 HR10119 [0,0,0,0,1,0|3,0,0]=4 845 B6R1.2 [TlH2]C1C=CC=C1 HR101871 [0,0,0,0,1,0|1,0,1]=3 846 B6R1.2 [Zr+3]C1C=CC=C1 HR100500 [0,0,0,0,1,0|1,0,1]=3 847 B5R0.1 C=C(C)\C=C\[AlH3] HR142674 [1,0,1,0,0,0|2,0,0]=4 848 B5R0.2 C=CCCC=C HR145060 [1,0,1,0,0,0|0,0,2]=4 849 B5R0.3 C=CC(O)C=C HR133002 [1,0,1,0,0,0|0,1,1]=4 850 B7R0.3 C=CCOC(=O)C=C HR107303 [0,1,1,0,0,0|0,1,1]=4 851 B7R0.7 C=COC(=O)\C=C\C HR129020 [0,1,1,0,0,0|0,1,1]=4 852 B7R0.4 C=C\C=C\OC(C)=O HR141489 [0,1,1,0,0,0|0,1,1]=4 853 B7R0.4 C\C=C\C=C\C(=O)O HR125524 [0,1,1,0,0,0|1,1,0]=4 854 B7R0.4 C\C=C\C=C\C(=O)[O-] HR124997 [0,1,1,0,0,0|1,1,0]=4 855 B7R0.4 C\C=C\C=C\C(=O)[O-] HR125264 [0,1,1,0,0,0|1,1,0]=4 856 B7R0.1 CC\C=C\C=C\C=O HR130022 [0,1,1,0,0,0|0,1,1]=4 857 B7R1.1 BrCC1=CC=CS1 HR107794 [0,1,0,0,1,0|2,0,0]=4 858 B7R1.1 BrCC1=COC=C1 HR105237 [0,1,0,0,1,0|2,0,0]=4 859 B7R1.1 BrCC1=CSC=C1 HR126049 [0,1,0,0,1,0|2,0,0]=4 860 B7R1.1 Br[Mg]c1cccs1 HR115567 [0,1,0,0,1,0|2,0,0]=4 861 B7R1.1 C#CC1=CC=CS1 HR115815 [0,1,0,0,1,0|2,0,0]=4 862 B7R1.1 C#CC1=CSC=C1 HR137538 [0,1,0,0,1,0|2,0,0]=4 863 B7R1.1 C=CC1=CC=CS1 HR127371 [0,1,0,0,1,0|2,0,0]=4 864 B7R1.1 CCC1=CC=CO1 HR125873 [0,1,0,0,1,0|2,0,0]=4 865 B7R1.1 CCC1=CC=CS1 HR111385 [0,1,0,0,1,0|2,0,0]=4 866 B7R1.1 CCC1=CSC=C1 HR124094 [0,1,0,0,1,0|2,0,0]=4 867 B7R1.1 CCN1C=CC=C1 HR125020 [0,1,0,0,1,0|2,0,0]=4 868 B7R1.1 COC1=CC=CS1 HR128854 [0,1,0,0,1,0|1,1,0]=4 869 B7R1.1 COC1=CSC=C1 HR138278 [0,1,0,0,1,0|1,1,0]=4 870 B7R1.1 CSC1=CC=CS1 HR119424 [0,1,0,0,1,0|1,0,0]=3 871 B7R1.1 CSC1=CSC=C1 HR153189 [0,1,0,0,1,0|1,0,0]=3 872 B7R1.1 ClCC1=CC=CS1 HR130983 [0,1,0,0,1,0|2,0,0]=4 873 B7R1.1 ClCC1=COC=C1 HR104894 [0,1,0,0,1,0|2,0,0]=4 874 B7R1.1 N#CC1=CC=CN1 HR131195 [0,1,0,0,1,0|2,0,0]=4 875 B7R1.1 N#CC1=CC=CO1 HR105593 [0,1,0,0,1,0|2,0,0]=4 876 B7R1.1 N#CC1=CC=CS1 HR127173 [0,1,0,0,1,0|2,0,0]=4 877 B7R1.1 N#CC1=CSC=C1 HR134610 [0,1,0,0,1,0|2,0,0]=4 878 B7R1.1 NCC1=CC=CN1 HR148675 [0,1,0,0,1,0|2,0,0]=4 879 B7R1.1 NCC1=CC=CS1 HR128270 [0,1,0,0,1,0|2,0,0]=4 880 B7R1.1 NCC1=CSC=C1 HR134337 [0,1,0,0,1,0|2,0,0]=4 881 B7R1.1 O=CC1=CC=CN1 HR133248 [0,1,0,0,1,0|1,1,0]=4 882 B7R1.1 O=CC1=CC=CO1 HR147284 [0,1,0,0,1,0|1,1,0]=4 883 B7R1.1 O=CC1=CNC=C1 HR129921 [0,1,0,0,1,0|1,1,0]=4 884 B7R1.1 O=CC1=COC=C1 HR125211 [0,1,0,0,1,0|1,1,0]=4 885 B7R1.1 O=CC1=CSC=C1 HR126177 [0,1,0,0,1,0|1,1,0]=4 886 B7R1.1 O=C[C-]1C=CC=C1 HR128771 [0,1,0,0,1,0|0,1,1]=4 887 B7R1.1 O=Cc1cccs1 HR125923 [0,1,0,0,1,0|1,1,0]=4 888 B7R1.1 OCC1=CC=CO1 HR147620 [0,1,0,0,1,0|1,1,0]=4 889 B7R1.1 OCC1=CC=CS1 HR136423 [0,1,0,0,1,0|1,1,0]=4 890 B7R1.1 OCC1=COC=C1 HR124594 [0,1,0,0,1,0|1,1,0]=4 891 B7R1.1 OCC1=CSC=C1 HR123712 [0,1,0,0,1,0|1,1,0]=4 892 B7R1.1 SCC1=CC=CS1 HR139099 [0,1,0,0,1,0|1,0,0]=3 893 B7R1.2 BrC1=CC=C(Br)S1 HR130516 [0,1,0,0,1,0|2,0,0]=4 894 B7R1.2 BrC1=CC=C(I)S1 HR117988 [0,1,0,0,1,0|2,0,0]=4 895 B7R1.2 BrC1=COC(Br)=C1 HR146341 [0,1,0,0,1,0|2,0,0]=4 896 B7R1.2 BrC1=CSC(Br)=C1 HR124329 [0,1,0,0,1,0|2,0,0]=4 897 B7R1.2 CC1=CC(Br)=CS1 HR129329 [0,1,0,0,1,0|2,0,0]=4 898 B7R1.2 CC1=CC(N)=CS1 HR107971 [0,1,0,0,1,0|2,0,0]=4 899 B7R1.2 CC1=CC=C(Br)O1 HR117458 [0,1,0,0,1,0|2,0,0]=4 900 B7R1.2 CC1=CC=C(Br)S1 HR138580 [0,1,0,0,1,0|2,0,0]=4 901 B7R1.2 CC1=CC=C(C)N1 HR127998 [0,1,0,0,1,0|2,0,0]=4 902 B7R1.2 CC1=CC=C(C)S1 HR126900 [0,1,0,0,1,0|2,0,0]=4 903 B7R1.2 CC1=CC=C(Cl)S1 HR122756 [0,1,0,0,1,0|2,0,0]=4 904 B7R1.2 CC1=CC=C(I)S1 HR103673 [0,1,0,0,1,0|2,0,0]=4 905 B7R1.2 CC1=CNC(C)=C1 HR129042 [0,1,0,0,1,0|2,0,0]=4 906 B7R1.2 CC1=CSC(C)=C1 HR101719 [0,1,0,0,1,0|2,0,0]=4 907 B7R1.2 CC1=CSC(N)=C1 HR103206 [0,1,0,0,1,0|2,0,0]=4 908 B7R1.2 ClC1=CC(Br)=CS1 HR103371 [0,1,0,0,1,0|2,0,0]=4 909 B7R1.2 ClC1=CC=C(Br)S1 HR116295 [0,1,0,0,1,0|2,0,0]=4 910 B7R1.2 ClC1=CC=C(Cl)S1 HR124877 [0,1,0,0,1,0|2,0,0]=4 911 B7R1.2 ClC1=CC=C(I)S1 HR33555 [0,1,0,0,1,0|2,0,0]=4 912 B7R1.2 IC1=CC=C(I)S1 HR119952 [0,1,0,0,1,0|2,0,0]=4 913 B7R1.2 NC1=CSC(Cl)=C1 HR109607 [0,1,0,0,1,0|2,0,0]=4 914 B7R1.2 O=C1C=CC(=O)N1 HR130748 [0,1,0,0,1,0|1,1,0]=4 915 B7R1.2 O=C1C=CC(=O)O1 HR146919 [0,1,0,0,1,0|1,1,0]=4 916 B7R1.4 BrC1=C(Br)SC=C1 HR129845 [0,1,0,0,1,0|2,0,0]=4 917 B7R1.4 BrC1=CSC=C1Br HR5510 [0,1,0,0,1,0|2,0,0]=4 918 B7R1.4 BrC1=CSC=C1I HR34025 [0,1,0,0,1,0|2,0,0]=4 919 B7R1.4 CC1=C(Br)C=CS1 HR128369 [0,1,0,0,1,0|2,0,0]=4 920 B7R1.4 CC1=C(Br)SC=C1 HR5191 [0,1,0,0,1,0|2,0,0]=4 921 B7R1.4 CC1=C(Cl)SC=C1 HR130722 [0,1,0,0,1,0|2,0,0]=4 922 B7R1.4 CC1=C(S)C=CO1 HR127105 [0,1,0,0,1,0|1,0,0]=3 923 B7R1.4 CC1=C(S)C=CO1 HR138863 [0,1,0,0,1,0|1,0,0]=3 924 B7R1.4 CC1=C(S)C=CS1 HR109926 [0,1,0,0,1,0|1,0,0]=3 925 B7R1.4 CC1=CSC=C1Br HR30444 [0,1,0,0,1,0|2,0,0]=4 926 B7R1.4 CC1=CSC=C1C HR112647 [0,1,0,0,1,0|2,0,0]=4 927 B7R1.4 CC1=CSC=C1N HR106606 [0,1,0,0,1,0|2,0,0]=4 928 B7R1.4 ClC1=C(Br)C=CS1 HR31859 [0,1,0,0,1,0|2,0,0]=4 929 B7R1.4 ClC1=C(Br)SC=C1 HR32396 [0,1,0,0,1,0|2,0,0]=4 930 B7R1.4 ClC1=C(Cl)SC=C1 HR133504 [0,1,0,0,1,0|2,0,0]=4 931 B7R1.4 FC1=CNC=C1F HR109768 [0,1,0,0,1,0|2,0,0]=4 932 B7R1.4 NC1=CSC=C1N HR102649 [0,1,0,0,1,0|2,0,0]=4 933 B7R1.4 OC1=CSC=C1O HR121295 [0,1,0,0,1,0|1,1,0]=4 934 B9R1.5 O=c1cccccc1O HR122352 [0,1,0,0,0,1|0,1,0]=3 935 B9R1.89 N#CC1C=CC=CC=C1 HR128619 [0,1,0,0,0,1|1,0,1]=4 936 B9R1.1 BrCC1=CC=C(Br)C=C1 HR7460 [0,2,0,0,0,0|1,0,0]=3 937 B9R1.1 BrCC1=CC=C(I)C=C1 HR135650 [0,2,0,0,0,0|1,0,0]=3 938 B9R1.1 BrCC1=CN=C(Br)C=C1 HR120556 [0,2,0,0,0,0|2,0,0]=4 939 B9R1.1 C#CC1=CC=C(Br)C=C1 HR114189 [0,2,0,0,0,0|1,0,0]=3 940 B9R1.1 C#CC1=CC=C(C)C=C1 HR136983 [0,2,0,0,0,0|1,0,0]=3 941 B9R1.1 C#CC1=CC=C(Cl)C=C1 HR121219 [0,2,0,0,0,0|1,0,0]=3 942 B9R1.1 C#CC1=CC=C(F)C=C1 HR115655 [0,2,0,0,0,0|1,0,0]=3 943 B9R1.1 C#CC1=CC=C(I)C=C1 HR33310 [0,2,0,0,0,0|1,0,0]=3 944 B9R1.1 C#CC1=CC=C(N)C=C1 HR107190 [0,2,0,0,0,0|1,0,0]=3 945 B9R1.1 C#CC1=NC=C(Br)C=C1 HR112143 [0,2,0,0,0,0|2,0,0]=4 946 B9R1.1 C=CC1=CC=C(Br)C=C1 HR138506 [0,2,0,0,0,0|1,0,0]=3 947 B9R1.1 C=CC1=CC=C(Cl)C=C1 HR135914 [0,2,0,0,0,0|1,0,0]=3 948 B9R1.1 C=CC1=CC=C(F)C=C1 HR138766 [0,2,0,0,0,0|1,0,0]=3 949 B9R1.1 C=CC1=CC=C(N)C=C1 HR137482 [0,2,0,0,0,0|1,0,0]=3 950 B9R1.1 C=CC1=CC=C(O)C=C1 HR132206 [0,2,0,0,0,0|0,1,0]=3 951 B9R1.1 C=CC1=CN=C(Br)C=C1 HR31899 [0,2,0,0,0,0|2,0,0]=4 952 B9R1.1 C=CC1=CN=C(C)C=C1 HR130292 [0,2,0,0,0,0|2,0,0]=4 953 B9R1.1 CC1=CC=C(C#N)C=C1 HR8168 [0,2,0,0,0,0|1,0,0]=3 954 B9R1.1 CC1=CC=C(C#N)C=N1 HR103696 [0,2,0,0,0,0|2,0,0]=4 955 B9R1.1 CC1=CC=C(C=O)C=C1 HR131206 [0,2,0,0,0,0|0,1,0]=3 956 B9R1.1 CC1=CC=C(CBr)C=C1 HR123604 [0,2,0,0,0,0|1,0,0]=3 957 B9R1.1 CC1=CC=C(CCl)C=C1 HR128366 [0,2,0,0,0,0|1,0,0]=3 958 B9R1.1 CC1=CC=C(CN)C=C1 HR124253 [0,2,0,0,0,0|1,0,0]=3 959 B9R1.1 CC1=CC=C(CO)C=C1 HR127584 [0,2,0,0,0,0|0,1,0]=3 960 B9R1.1 CC1=CC=C(CO)C=N1 HR104447 [0,2,0,0,0,0|1,1,0]=4 961 B9R1.1 CC1=CC=C(NN)C=C1 HR102423 [0,2,0,0,0,0|1,0,0]=3 962 B9R1.1 CC1=CC=C(NN)C=C1 HR127308 [0,2,0,0,0,0|1,0,0]=3 963 B9R1.1 CC1=CC=C(NN)C=N1 HR114703 [0,2,0,0,0,0|2,0,0]=4 964 B9R1.1 CC1=CC=C([Mg]Br)C=C1 HR110524 [0,2,0,0,0,0|1,0,0]=3 965 B9R1.1 CC1=CC=C([Mg]Cl)C=C1 HR116520 [0,2,0,0,0,0|1,0,0]=3 966 B9R1.1 CC1=CN=C(C#N)C=C1 HR12978 [0,2,0,0,0,0|2,0,0]=4 967 B9R1.1 CC1=CN=C(C=O)C=C1 HR133859 [0,2,0,0,0,0|1,1,0]=4 968 B9R1.1 CC1=CN=C(CN)C=C1 HR146882 [0,2,0,0,0,0|2,0,0]=4 969 B9R1.1 CC1=CN=C(CO)C=C1 HR152994 [0,2,0,0,0,0|1,1,0]=4 970 B9R1.1 CC1=NC=C(C=O)C=C1 HR120114 [0,2,0,0,0,0|1,1,0]=4 971 B9R1.1 CC1=NC=C(C=S)C=C1 HR152666 [0,2,0,0,0,0|1,0,1]=4 972 B9R1.1 CC1=NC=C(CCl)C=C1 HR102069 [0,2,0,0,0,0|2,0,0]=4 973 B9R1.1 CC1=NC=C(CCl)C=C1 HR119770 [0,2,0,0,0,0|2,0,0]=4 974 B9R1.1 CCC1=CC=C(Br)C=C1 HR3772 [0,2,0,0,0,0|1,0,0]=3 975 B9R1.1 CCC1=CC=C(C)C=C1 HR139087 [0,2,0,0,0,0|1,0,0]=3 976 B9R1.1 CCC1=CC=C(F)C=C1 HR116057 [0,2,0,0,0,0|1,0,0]=3 977 B9R1.1 CCC1=CC=C(I)C=C1 HR134481 [0,2,0,0,0,0|1,0,0]=3 978 B9R1.1 CCC1=CC=C(N)C=C1 HR135678 [0,2,0,0,0,0|1,0,0]=3 979 B9R1.1 CCC1=CC=C(O)C=C1 HR3874 [0,2,0,0,0,0|0,1,0]=3 980 B9R1.1 CCC1=CC=C(S)C=C1 HR132680 [0,2,0,0,0,0|0,0,0]=2 981 B9R1.1 CCC1=CN=C(C)C=C1 HR10482 [0,2,0,0,0,0|2,0,0]=4 982 B9R1.1 CCC1=CN=C(O)C=C1 HR110137 [0,2,0,0,0,0|1,1,0]=4 983 B9R1.1 CCC1=NC=C(Br)C=C1 HR32793 [0,2,0,0,0,0|2,0,0]=4 984 B9R1.1 CNC1=CC=C(C)C=C1 HR128207 [0,2,0,0,0,0|1,0,0]=3 985 B9R1.1 CNC1=CC=C(Cl)C=C1 HR139089 [0,2,0,0,0,0|1,0,0]=3 986 B9R1.1 CNC1=CC=C(F)C=C1 HR143239 [0,2,0,0,0,0|1,0,0]=3 987 B9R1.1 CNC1=CC=C(I)C=C1 HR147442 [0,2,0,0,0,0|1,0,0]=3 988 B9R1.1 CNC1=CC=C(N)C=C1 HR124809 [0,2,0,0,0,0|1,0,0]=3 989 B9R1.1 CNC1=CC=C(N)C=C1 HR127936 [0,2,0,0,0,0|1,0,0]=3 990 B9R1.1 CNC1=CC=C(O)C=C1 HR142548 [0,2,0,0,0,0|0,1,0]=3 991 B9R1.1 CNC1=NC=C(Br)C=C1 HR147486 [0,2,0,0,0,0|2,0,0]=4 992 B9R1.1 COC1=CC=C(Br)C=C1 HR146915 [0,2,0,0,0,0|0,1,0]=3 993 B9R1.1 COC1=CC=C(C)C=C1 HR132594 [0,2,0,0,0,0|0,1,0]=3 994 B9R1.1 COC1=CC=C(Cl)C=C1 HR124117 [0,2,0,0,0,0|0,1,0]=3 995 B9R1.1 COC1=CC=C(F)C=C1 HR129685 [0,2,0,0,0,0|0,1,0]=3 996 B9R1.1 COC1=CC=C(I)C=C1 HOJB00105 [0,2,0,0,0,0|0,1,0]=3 997 B9R1.1 COC1=CC=C(N)C=C1 HR146916 [0,2,0,0,0,0|0,1,0]=3 998 B9R1.1 COC1=CC=C(O)C=C1 HR2276 [0,2,0,0,0,0|0,1,0]=3 999 B9R1.1 COC1=CC=C(O)C=N1 HR32560 [0,2,0,0,0,0|1,1,0]=4 1000 B9R1.1 COC1=CC=C(S)C=C1 HR122828 [0,2,0,0,0,0|0,0,0]=2 1001 B9R1.1 COC1=CC=[N+]([O-])C=C1 HR125695 [0,2,0,0,0,0|1,1,0]=4 1002 B9R1.1 COC1=CN=C(Br)C=C1 HR32803 [0,2,0,0,0,0|1,1,0]=4 1003 B9R1.1 COC1=CN=C(Cl)C=C1 HR103038 [0,2,0,0,0,0|1,1,0]=4 1004 B9R1.1 COC1=CN=C(F)C=C1 HR32552 [0,2,0,0,0,0|1,1,0]=4 1005 B9R1.1 COC1=CN=C(N)C=C1 HR32397 [0,2,0,0,0,0|1,1,0]=4 1006 B9R1.1 COC1=NC=C(Br)C=C1 HR137211 [0,2,0,0,0,0|1,1,0]=4 1007 B9R1.1 COC1=NC=C(C)C=C1 HR6609 [0,2,0,0,0,0|1,1,0]=4 1008 B9R1.1 COC1=NC=C(Cl)C=C1 HR114485 [0,2,0,0,0,0|1,1,0]=4 1009 B9R1.1 COC1=NC=C(F)C=C1 HR11248 [0,2,0,0,0,0|1,1,0]=4 1010 B9R1.1 COC1=NC=C(I)C=C1 HR156588 [0,2,0,0,0,0|1,1,0]=4 1011 B9R1.1 COC1=NC=C(N)C=C1 HR132091 [0,2,0,0,0,0|1,1,0]=4 1012 B9R1.1 COc1ccc(N)cc1 HR145121 [0,2,0,0,0,0|0,1,0]=3 1013 B9R1.1 CSC1=CC=C(Br)C=C1 HR136118 [0,2,0,0,0,0|0,0,0]=2 1014 B9R1.1 CSC1=CC=C(C)C=C1 HR101328 [0,2,0,0,0,0|0,0,0]=2 1015 B9R1.1 CSC1=CC=C(Cl)C=C1 HR125986 [0,2,0,0,0,0|0,0,0]=2 1016 B9R1.1 CSC1=CC=C(F)C=C1 HR102835 [0,2,0,0,0,0|0,0,0]=2 1017 B9R1.1 CSC1=CC=C(I)C=C1 HR145122 [0,2,0,0,0,0|0,0,0]=2 1018 B9R1.1 CSC1=CC=C(N)C=C1 HR138130 [0,2,0,0,0,0|0,0,0]=2 1019 B9R1.1 CSC1=CC=C(O)C=C1 FEJL01902 [0,2,0,0,0,0|0,0,0]=2 1020 B9R1.1 CSC1=CC=C(S)C=C1 HR136561 [0,2,0,0,0,0|0,0,0]=2 1021 B9R1.1 CSC1=CN=C(Br)C=C1 HR152521 [0,2,0,0,0,0|1,0,0]=3 1022 B9R1.1 CSC1=CN=C(Br)C=N1 HR107298 [0,2,0,0,0,0|2,0,0]=4 1023 B9R1.1 CSC1=CN=C(C)C=N1 HR124466 [0,2,0,0,0,0|2,0,0]=4 1024 B9R1.1 CSC1=CN=C(F)C=C1 HR152811 [0,2,0,0,0,0|1,0,0]=3 1025 B9R1.1 CSC1=CN=C(N)C=C1 HR142025 [0,2,0,0,0,0|1,0,0]=3 1026 B9R1.1 CSC1=CN=C(N)C=N1 HR109495 [0,2,0,0,0,0|2,0,0]=4 1027 B9R1.1 CSC1=NC=C(Br)C=C1 HR104024 [0,2,0,0,0,0|1,0,0]=3 1028 B9R1.1 CSC1=NC=C(Br)C=N1 HR33571 [0,2,0,0,0,0|2,0,0]=4 1029 B9R1.1 CSC1=NC=C(C)C=C1 HR152871 [0,2,0,0,0,0|1,0,0]=3 1030 B9R1.1 CSC1=NC=C(C)C=N1 HR114762 [0,2,0,0,0,0|2,0,0]=4 1031 B9R1.1 CSC1=NC=C(Cl)C=C1 HR152433 [0,2,0,0,0,0|1,0,0]=3 1032 B9R1.1 Cc1ccc(NN)cc1 HR102634 [0,2,0,0,0,0|1,0,0]=3 1033 B9R1.1 Cc1ccc(NN)cn1 HR142604 [0,2,0,0,0,0|2,0,0]=4 1034 B9R1.1 ClC1=CC=C(CBr)C=C1 HR124533 [0,2,0,0,0,0|1,0,0]=3 1035 B9R1.1 ClC1=CC=C([Mg]Br)C=C1 HR144019 [0,2,0,0,0,0|1,0,0]=3 1036 B9R1.1 ClC1=NC=C(CBr)C=C1 HR140274 [0,2,0,0,0,0|2,0,0]=4 1037 B9R1.1 ClCC1=CC=C(Br)C=C1 HR2478 [0,2,0,0,0,0|1,0,0]=3 1038 B9R1.1 ClCC1=CN=C(Cl)C=C1 HR130451 [0,2,0,0,0,0|2,0,0]=4 1039 B9R1.1 ClCC1=NC=C(Cl)C=C1 HR111339 [0,2,0,0,0,0|2,0,0]=4 1040 B9R1.1 FC1=CC=C(CBr)C=C1 HR7354 [0,2,0,0,0,0|1,0,0]=3 1041 B9R1.1 FC1=CC=C(CCl)C=C1 HR134207 [0,2,0,0,0,0|1,0,0]=3 1042 B9R1.1 FC1=CC=C(CS)C=C1 HR143933 [0,2,0,0,0,0|0,0,0]=2 1043 B9R1.1 Fc1ccc([Mg]Br)cc1 HR144642 [0,2,0,0,0,0|1,0,0]=3 1044 B9R1.1 N#CC1=CC=C(Br)C=C1 HR138339 [0,2,0,0,0,0|1,0,0]=3 1045 B9R1.1 N#CC1=CC=C(Cl)C=C1 HR126473 [0,2,0,0,0,0|1,0,0]=3 1046 B9R1.1 N#CC1=CC=C(F)C=C1 HR1585 [0,2,0,0,0,0|1,0,0]=3 1047 B9R1.1 N#CC1=CC=C(I)C=C1 HR133800 [0,2,0,0,0,0|1,0,0]=3 1048 B9R1.1 N#CC1=CC=C(N)C=C1 HR15683 [0,2,0,0,0,0|1,0,0]=3 1049 B9R1.1 N#CC1=CC=C(N)C=N1 HR124043 [0,2,0,0,0,0|2,0,0]=4 1050 B9R1.1 N#CC1=CC=C(O)C=C1 HR128634 [0,2,0,0,0,0|0,1,0]=3 1051 B9R1.1 N#CC1=CC=C(O)N=C1 HR141632 [0,2,0,0,0,0|1,1,0]=4 1052 B9R1.1 N#CC1=CC=[N+]([O-])C=C1 HR135674 [0,2,0,0,0,0|1,1,0]=4 1053 B9R1.1 N#CC1=CN=C(Br)C=C1 HR126119 [0,2,0,0,0,0|2,0,0]=4 1054 B9R1.1 N#CC1=CN=C(Cl)C=C1 HR1224 [0,2,0,0,0,0|2,0,0]=4 1055 B9R1.1 N#CC1=CN=C(F)C=C1 HR109348 [0,2,0,0,0,0|2,0,0]=4 1056 B9R1.1 N#CC1=CN=C(N)C=C1 HR125345 [0,2,0,0,0,0|2,0,0]=4 1057 B9R1.1 N#CC1=CN=C(O)C=C1 HR141731 [0,2,0,0,0,0|1,1,0]=4 1058 B9R1.1 N#CC1=NC=C(Br)C=C1 HR2108 [0,2,0,0,0,0|2,0,0]=4 1059 B9R1.1 N#CC1=NC=C(Cl)C=C1 HR138026 [0,2,0,0,0,0|2,0,0]=4 1060 B9R1.1 N#CC1=NC=C(F)C=C1 HR16479 [0,2,0,0,0,0|2,0,0]=4 1061 B9R1.1 N#CC1=NC=C(O)C=C1 HR124320 [0,2,0,0,0,0|1,1,0]=4 1062 B9R1.1 NC1=CC=C(C=O)C=C1 HR7795 [0,2,0,0,0,0|0,1,0]=3 1063 B9R1.1 NC1=CC=C(CO)C=C1 HR129902 [0,2,0,0,0,0|0,1,0]=3 1064 B9R1.1 NC1=NC=C(C=O)C=C1 ABSA04915 [0,2,0,0,0,0|1,1,0]=4 1065 B9R1.1 NC1=NC=C(CO)C=C1 HR106659 [0,2,0,0,0,0|1,1,0]=4 1066 B9R1.1 NCC1=CC=C(Br)C=C1 HR100856 [0,2,0,0,0,0|1,0,0]=3 1067 B9R1.1 NCC1=CC=C(Br)N=C1 HR147588 [0,2,0,0,0,0|2,0,0]=4 1068 B9R1.1 NCC1=CC=C(Cl)C=C1 HR130978 [0,2,0,0,0,0|1,0,0]=3 1069 B9R1.1 NCC1=CC=C(F)C=C1 HR133400 [0,2,0,0,0,0|1,0,0]=3 1070 B9R1.1 NCC1=CC=C(I)C=C1 HR141334 [0,2,0,0,0,0|1,0,0]=3 1071 B9R1.1 NCC1=CC=C(N)C=C1 HR117693 [0,2,0,0,0,0|1,0,0]=3 1072 B9R1.1 NCC1=CC=C(N)C=C1 HR132876 [0,2,0,0,0,0|1,0,0]=3 1073 B9R1.1 NCC1=CC=C(O)C=C1 HR113823 [0,2,0,0,0,0|0,1,0]=3 1074 B9R1.1 NCC1=CN=C(Cl)C=C1 HR144934 [0,2,0,0,0,0|2,0,0]=4 1075 B9R1.1 NCC1=NC=C(Br)C=C1 HR139695 [0,2,0,0,0,0|2,0,0]=4 1076 B9R1.1 NCc1ccc(Br)cc1 HR116743 [0,2,0,0,0,0|1,0,0]=3 1077 B9R1.1 NNC1=CC=C(Br)C=C1 HR146775 [0,2,0,0,0,0|1,0,0]=3 1078 B9R1.1 NNC1=CC=C(Cl)C=C1 HR118022 [0,2,0,0,0,0|1,0,0]=3 1079 B9R1.1 NNC1=CC=C(Cl)C=C1 HR124374 [0,2,0,0,0,0|1,0,0]=3 1080 B9R1.1 NNC1=CC=C(F)C=C1 HR140905 [0,2,0,0,0,0|1,0,0]=3 1081 B9R1.1 NNC1=CC=C(F)C=C1 HR3330 [0,2,0,0,0,0|1,0,0]=3 1082 B9R1.1 NNC1=CC=C(F)N=C1 HR117260 [0,2,0,0,0,0|2,0,0]=4 1083 B9R1.1 NNC1=CN=C(Cl)C=C1 HR145908 [0,2,0,0,0,0|2,0,0]=4 1084 B9R1.1 NNC1=NC=C(Br)C=C1 HR18793 [0,2,0,0,0,0|2,0,0]=4 1085 B9R1.1 NNC1=NC=C(Cl)C=C1 HR152946 [0,2,0,0,0,0|2,0,0]=4 1086 B9R1.1 NNC1=NC=C(F)C=C1 HR141735 [0,2,0,0,0,0|2,0,0]=4 1087 B9R1.1 NNc1ccc(Br)cc1 HR128157 [0,2,0,0,0,0|1,0,0]=3 1088 B9R1.1 O=C1C=CC(CO)=CN1 HR117167 [0,2,0,0,0,0|1,1,0]=4 1089 B9R1.1 O=CC1=CC=C(Br)C=C1 HR8053 [0,2,0,0,0,0|0,1,0]=3 1090 B9R1.1 O=CC1=CC=C(Cl)C=C1 HR8078 [0,2,0,0,0,0|0,1,0]=3 1091 B9R1.1 O=CC1=CC=C(F)C=C1 HR130471 [0,2,0,0,0,0|0,1,0]=3 1092 B9R1.1 O=CC1=CC=C(I)C=C1 HR5349 [0,2,0,0,0,0|0,1,0]=3 1093 B9R1.1 O=CC1=CC=C(O)C=C1 RAXM01505 [0,2,0,0,0,0|0,1,0]=3 1094 B9R1.1 O=CC1=CC=C(S)C=C1 HR107830 [0,2,0,0,0,0|0,0,0]=2 1095 B9R1.1 O=CC1=CN=C(Br)C=C1 HR1181 [0,2,0,0,0,0|1,1,0]=4 1096 B9R1.1 O=CC1=CN=C(Cl)C=C1 HR9221 [0,2,0,0,0,0|1,1,0]=4 1097 B9R1.1 O=CC1=CN=C(F)C=C1 HR138831 [0,2,0,0,0,0|1,1,0]=4 1098 B9R1.1 O=CC1=CN=C(O)C=C1 HR135720 [0,2,0,0,0,0|1,1,0]=4 1099 B9R1.1 O=CC1=NC=C(Br)C=C1 HR123942 [0,2,0,0,0,0|1,1,0]=4 1100 B9R1.1 O=CC1=NC=C(Cl)C=C1 HR103976 [0,2,0,0,0,0|1,1,0]=4 1101 B9R1.1 O=CC1=NC=C(F)C=C1 HR106479 [0,2,0,0,0,0|1,1,0]=4 1102 B9R1.1 O=CC1=NC=C(O)C=C1 HR32603 [0,2,0,0,0,0|1,1,0]=4 1103 B9R1.1 OCC1=CC=C(Br)C=C1 HR130106 [0,2,0,0,0,0|0,1,0]=3 1104 B9R1.1 OCC1=CC=C(Br)N=C1 HR107324 [0,2,0,0,0,0|1,1,0]=4 1105 B9R1.1 OCC1=CC=C(Cl)C=C1 HR130446 [0,2,0,0,0,0|0,1,0]=3 1106 B9R1.1 OCC1=CC=C(F)C=C1 HR131236 [0,2,0,0,0,0|0,1,0]=3 1107 B9R1.1 OCC1=CC=C(F)N=C1 HR138573 [0,2,0,0,0,0|1,1,0]=4 1108 B9R1.1 OCC1=CC=C(I)C=C1 HR136446 [0,2,0,0,0,0|0,1,0]=3 1109 B9R1.1 OCC1=CC=C(O)C=C1 HR134210 [0,2,0,0,0,0|0,1,0]=3 1110 B9R1.1 OCC1=CC=C(S)C=C1 HR103947 [0,2,0,0,0,0|0,0,0]=2 1111 B9R1.1 OCC1=CN=C(Cl)C=C1 HR12920 [0,2,0,0,0,0|1,1,0]=4 1112 B9R1.1 OCC1=NC=C(Br)C=C1 HR125589 [0,2,0,0,0,0|1,1,0]=4 1113 B9R1.1 OCC1=NC=C(Cl)C=C1 HR112429 [0,2,0,0,0,0|1,1,0]=4 1114 B9R1.1 ONC1=CC=C(Cl)C=C1 HR119792 [0,2,0,0,0,0|0,1,0]=3 1115 B9R1.1 SCC1=CC=C(Br)C=C1 HR114279 [0,2,0,0,0,0|0,0,0]=2 1116 B9R1.1 SCC1=CC=C(Cl)C=C1 HR128891 [0,2,0,0,0,0|0,0,0]=2 1117 B9R1.1 [1*]SC1=CC=C([2*])C=C1 HR100365 [0,2,0,0,0,0|0,0,0]=2 1118 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 HR119978 [0,2,0,0,0,0|1,0,0]=3 1119 B9R1.1 [Zn+]CC1=CC=C(Br)C=C1 HR109497 [0,2,0,0,0,0|1,0,0]=3 1120 B9R1.2 BrCC1=CC(Br)=CC=C1 HR122516 [0,2,0,0,0,0|1,0,0]=3 1121 B9R1.2 BrCC1=CC(I)=CC=C1 HR112540 [0,2,0,0,0,0|1,0,0]=3 1122 B9R1.2 BrCC1=CC=CC(Br)=N1 HR102510 [0,2,0,0,0,0|2,0,0]=4 1123 B9R1.2 C#CC1=CC(Br)=CC=C1 HR119495 [0,2,0,0,0,0|1,0,0]=3 1124 B9R1.2 C#CC1=CC(Cl)=CC=C1 HR122207 [0,2,0,0,0,0|1,0,0]=3 1125 B9R1.2 C#CC1=CC(Cl)=NC=C1 HR148420 [0,2,0,0,0,0|2,0,0]=4 1126 B9R1.2 C#CC1=CC(F)=CC=C1 HR135455 [0,2,0,0,0,0|1,0,0]=3 1127 B9R1.2 C#CC1=CC(N)=CC=C1 HR4052 [0,2,0,0,0,0|1,0,0]=3 1128 B9R1.2 C#CC1=CC(O)=CC=C1 HR118790 [0,2,0,0,0,0|0,1,0]=3 1129 B9R1.2 C#CC1=CC=CC(C)=C1 HR139871 [0,2,0,0,0,0|1,0,0]=3 1130 B9R1.2 C#Cc1cccc(N)c1 HR112144 [0,2,0,0,0,0|1,0,0]=3 1131 B9R1.2 C=CC1=CC(F)=CC=C1 HR113846 [0,2,0,0,0,0|1,0,0]=3 1132 B9R1.2 C=CC1=CC=CC(Br)=C1 HR102214 [0,2,0,0,0,0|1,0,0]=3 1133 B9R1.2 C=CC1=CC=CC(Cl)=C1 HR122076 [0,2,0,0,0,0|1,0,0]=3 1134 B9R1.2 C=CC1=CC=CC(N)=C1 HR105735 [0,2,0,0,0,0|1,0,0]=3 1135 B9R1.2 C=CC1=CN=CC(Br)=C1 HR121497 [0,2,0,0,0,0|2,0,0]=4 1136 B9R1.2 CC1=CC(C#N)=NC=C1 HR21387 [0,2,0,0,0,0|2,0,0]=4 1137 B9R1.2 CC1=CC(C=O)=CC=C1 HR128890 [0,2,0,0,0,0|0,1,0]=3 1138 B9R1.2 CC1=CC(C=O)=CN=C1 HR121509 [0,2,0,0,0,0|1,1,0]=4 1139 B9R1.2 CC1=CC(C=O)=NC=C1 HR130135 [0,2,0,0,0,0|1,1,0]=4 1140 B9R1.2 CC1=CC(NN)=CC=C1 HR118305 [0,2,0,0,0,0|1,0,0]=3 1141 B9R1.2 CC1=CC(NN)=NC=C1 HR148427 [0,2,0,0,0,0|2,0,0]=4 1142 B9R1.2 CC1=CC([Mg]Br)=CC=C1 HR121856 [0,2,0,0,0,0|1,0,0]=3 1143 B9R1.2 CC1=CC=CC(C#N)=C1 HR147064 [0,2,0,0,0,0|1,0,0]=3 1144 B9R1.2 CC1=CC=CC(C#N)=N1 HR125912 [0,2,0,0,0,0|2,0,0]=4 1145 B9R1.2 CC1=CC=CC(C=O)=N1 HR135669 [0,2,0,0,0,0|1,1,0]=4 1146 B9R1.2 CC1=CC=CC(CBr)=C1 HR132756 [0,2,0,0,0,0|1,0,0]=3 1147 B9R1.2 CC1=CC=CC(CBr)=N1 HR138125 [0,2,0,0,0,0|2,0,0]=4 1148 B9R1.2 CC1=CC=CC(CCl)=C1 HR132041 [0,2,0,0,0,0|1,0,0]=3 1149 B9R1.2 CC1=CC=CC(CCl)=N1 HR117937 [0,2,0,0,0,0|2,0,0]=4 1150 B9R1.2 CC1=CC=CC(CN)=C1 HR134990 [0,2,0,0,0,0|1,0,0]=3 1151 B9R1.2 CC1=CC=CC(CN)=N1 HR105915 [0,2,0,0,0,0|2,0,0]=4 1152 B9R1.2 CC1=CC=CC(CO)=C1 HR138128 [0,2,0,0,0,0|0,1,0]=3 1153 B9R1.2 CC1=CC=CC(CO)=N1 HR20959 [0,2,0,0,0,0|1,1,0]=4 1154 B9R1.2 CC1=CC=CC(CS)=C1 HR119173 [0,2,0,0,0,0|0,0,0]=2 1155 B9R1.2 CC1=CC=CC(NN)=C1 HR128310 [0,2,0,0,0,0|1,0,0]=3 1156 B9R1.2 CC1=CC=CC(NN)=N1 HR145919 [0,2,0,0,0,0|2,0,0]=4 1157 B9R1.2 CC1=CN=CC(C#N)=C1 HR131719 [0,2,0,0,0,0|2,0,0]=4 1158 B9R1.2 CC1=CN=CC(CCl)=C1 HR107932 [0,2,0,0,0,0|2,0,0]=4 1159 B9R1.2 CC1=CN=CC(CO)=C1 HR103480 [0,2,0,0,0,0|1,1,0]=4 1160 B9R1.2 CC1=NC=CC(C#N)=C1 HR30164 [0,2,0,0,0,0|2,0,0]=4 1161 B9R1.2 CC1=NC=CC(C=O)=C1 HR136587 [0,2,0,0,0,0|1,1,0]=4 1162 B9R1.2 CC1=NC=CC(CN)=C1 HR33910 [0,2,0,0,0,0|2,0,0]=4 1163 B9R1.2 CC1=NC=CC(CO)=C1 HR120041 [0,2,0,0,0,0|1,1,0]=4 1164 B9R1.2 CCC1=CC(Br)=NC=C1 HR121490 [0,2,0,0,0,0|2,0,0]=4 1165 B9R1.2 CCC1=CC(N)=NC=C1 HR112213 [0,2,0,0,0,0|2,0,0]=4 1166 B9R1.2 CCC1=CC=CC(Br)=C1 HR140648 [0,2,0,0,0,0|1,0,0]=3 1167 B9R1.2 CCC1=CC=CC(Cl)=C1 HR105116 [0,2,0,0,0,0|1,0,0]=3 1168 B9R1.2 CCC1=CC=CC(N)=C1 HR117646 [0,2,0,0,0,0|1,0,0]=3 1169 B9R1.2 CCC1=CC=CC(N)=N1 HR111426 [0,2,0,0,0,0|2,0,0]=4 1170 B9R1.2 CCC1=CC=CC(O)=C1 HR132582 [0,2,0,0,0,0|0,1,0]=3 1171 B9R1.2 CCC1=CN=CC(Br)=C1 HR147705 [0,2,0,0,0,0|2,0,0]=4 1172 B9R1.2 CNC1=CC(Br)=CC=C1 HR109153 [0,2,0,0,0,0|1,0,0]=3 1173 B9R1.2 CNC1=CC(Br)=CN=C1 HR33743 [0,2,0,0,0,0|2,0,0]=4 1174 B9R1.2 CNC1=CC(Br)=NC=C1 HR32609 [0,2,0,0,0,0|2,0,0]=4 1175 B9R1.2 CNC1=CC(Cl)=CC=C1 HR9202 [0,2,0,0,0,0|1,0,0]=3 1176 B9R1.2 CNC1=CC(F)=CC=C1 HR102295 [0,2,0,0,0,0|1,0,0]=3 1177 B9R1.2 CNC1=CC=CC(C)=C1 HR128472 [0,2,0,0,0,0|1,0,0]=3 1178 B9R1.2 CNC1=CC=CC(N)=C1 HR113475 [0,2,0,0,0,0|1,0,0]=3 1179 B9R1.2 CNC1=CC=CC(O)=C1 HR31869 [0,2,0,0,0,0|0,1,0]=3 1180 B9R1.2 CNC1=NC(Cl)=CC=C1 HR139033 [0,2,0,0,0,0|2,0,0]=4 1181 B9R1.2 CNC1=NC=CC(Br)=C1 HR30707 [0,2,0,0,0,0|2,0,0]=4 1182 B9R1.2 CNC1=NC=CC(I)=C1 HR152755 [0,2,0,0,0,0|2,0,0]=4 1183 B9R1.2 COC1=CC(Br)=NC=C1 HR30626 [0,2,0,0,0,0|1,1,0]=4 1184 B9R1.2 COC1=CC(C)=CC=C1 HR135808 [0,2,0,0,0,0|0,1,0]=3 1185 B9R1.2 COC1=CC(C)=CN=C1 HR104484 [0,2,0,0,0,0|1,1,0]=4 1186 B9R1.2 COC1=CC(Cl)=NC=C1 HR30624 [0,2,0,0,0,0|1,1,0]=4 1187 B9R1.2 COC1=CC(F)=CC=C1 HR129426 [0,2,0,0,0,0|0,1,0]=3 1188 B9R1.2 COC1=CC(F)=NC=C1 HR34007 [0,2,0,0,0,0|1,1,0]=4 1189 B9R1.2 COC1=CC(N)=NC=C1 HR130386 [0,2,0,0,0,0|1,1,0]=4 1190 B9R1.2 COC1=CC(O)=NC=C1 HR117471 [0,2,0,0,0,0|1,1,0]=4 1191 B9R1.2 COC1=CC=CC(Br)=C1 HR136293 [0,2,0,0,0,0|0,1,0]=3 1192 B9R1.2 COC1=CC=CC(Br)=N1 HR136250 [0,2,0,0,0,0|1,1,0]=4 1193 B9R1.2 COC1=CC=CC(Cl)=C1 HR123852 [0,2,0,0,0,0|0,1,0]=3 1194 B9R1.2 COC1=CC=CC(Cl)=N1 HR136204 [0,2,0,0,0,0|1,1,0]=4 1195 B9R1.2 COC1=CC=CC(I)=C1 HR139943 [0,2,0,0,0,0|0,1,0]=3 1196 B9R1.2 COC1=CC=CC(I)=N1 HR32677 [0,2,0,0,0,0|1,1,0]=4 1197 B9R1.2 COC1=CC=CC(N)=N1 HR12919 [0,2,0,0,0,0|1,1,0]=4 1198 B9R1.2 COC1=CC=CC(O)=C1 HR134507 [0,2,0,0,0,0|0,1,0]=3 1199 B9R1.2 COC1=CC=CC(S)=C1 HR122562 [0,2,0,0,0,0|0,0,0]=2 1200 B9R1.2 COC1=CC=C[N+]([O-])=C1 HR118167 [0,2,0,0,0,0|1,1,0]=4 1201 B9R1.2 COC1=CN=CC(Br)=C1 HR133604 [0,2,0,0,0,0|1,1,0]=4 1202 B9R1.2 COC1=CN=CC(Cl)=C1 HR136337 [0,2,0,0,0,0|1,1,0]=4 1203 B9R1.2 COC1=CN=CC(F)=C1 HR152698 [0,2,0,0,0,0|1,1,0]=4 1204 B9R1.2 COC1=CN=CC(N)=C1 HR33750 [0,2,0,0,0,0|1,1,0]=4 1205 B9R1.2 COC1=CN=CC(O)=C1 HR106001 [0,2,0,0,0,0|1,1,0]=4 1206 B9R1.2 COC1=NC(C)=CC=C1 HR130037 [0,2,0,0,0,0|1,1,0]=4 1207 B9R1.2 COC1=NC=CC(Br)=C1 HR30416 [0,2,0,0,0,0|1,1,0]=4 1208 B9R1.2 COC1=NC=CC(C)=C1 HR138011 [0,2,0,0,0,0|1,1,0]=4 1209 B9R1.2 COC1=NC=CC(Cl)=C1 HR6663 [0,2,0,0,0,0|1,1,0]=4 1210 B9R1.2 COC1=NC=CC(F)=C1 HR109376 [0,2,0,0,0,0|1,1,0]=4 1211 B9R1.2 COC1=NC=CC(I)=C1 HR108979 [0,2,0,0,0,0|1,1,0]=4 1212 B9R1.2 COC1=NC=CC(N)=C1 HR117526 [0,2,0,0,0,0|1,1,0]=4 1213 B9R1.2 COC1=NC=CC(N)=C1 HR6595 [0,2,0,0,0,0|1,1,0]=4 1214 B9R1.2 COC1=NC=CC(O)=C1 HR143478 [0,2,0,0,0,0|1,1,0]=4 1215 B9R1.2 CSC1=CC(Br)=CC=C1 PRXM00601 [0,2,0,0,0,0|0,0,0]=2 1216 B9R1.2 CSC1=CC(Cl)=CC=C1 HR154063 [0,2,0,0,0,0|0,0,0]=2 1217 B9R1.2 CSC1=CC(Cl)=NC=C1 HR113628 [0,2,0,0,0,0|1,0,0]=3 1218 B9R1.2 CSC1=CC(Cl)=NC=N1 HR120682 [0,2,0,0,0,0|2,0,0]=4 1219 B9R1.2 CSC1=CC(F)=CC=C1 HR139303 [0,2,0,0,0,0|0,0,0]=2 1220 B9R1.2 CSC1=CC(F)=NC=C1 HR152916 [0,2,0,0,0,0|1,0,0]=3 1221 B9R1.2 CSC1=CC(N)=CC=C1 HR10635 [0,2,0,0,0,0|0,0,0]=2 1222 B9R1.2 CSC1=CC=CC(Br)=N1 HR31868 [0,2,0,0,0,0|1,0,0]=3 1223 B9R1.2 CSC1=CC=CC(C)=C1 HR140264 [0,2,0,0,0,0|0,0,0]=2 1224 B9R1.2 CSC1=CC=CC(I)=C1 HR139126 [0,2,0,0,0,0|0,0,0]=2 1225 B9R1.2 CSC1=CN=CC(Br)=C1 HR152656 [0,2,0,0,0,0|1,0,0]=3 1226 B9R1.2 CSC1=CN=CC(C)=N1 HR124732 [0,2,0,0,0,0|2,0,0]=4 1227 B9R1.2 CSC1=CN=CC(Cl)=C1 HR153113 [0,2,0,0,0,0|1,0,0]=3 1228 B9R1.2 CSC1=CN=CC(O)=C1 HR152980 [0,2,0,0,0,0|1,0,0]=3 1229 B9R1.2 CSC1=NC(Cl)=NC=C1 HR109499 [0,2,0,0,0,0|2,0,0]=4 1230 B9R1.2 CSC1=NC=CC(=O)N1 HR138000 [0,2,0,0,0,0|2,0,0]=4 1231 B9R1.2 CSC1=NC=CC(Br)=N1 HR113104 [0,2,0,0,0,0|2,0,0]=4 1232 B9R1.2 CSC1=NC=CC(C)=N1 HR102479 [0,2,0,0,0,0|2,0,0]=4 1233 B9R1.2 CSC1=NC=CC(Cl)=C1 HR148091 [0,2,0,0,0,0|1,0,0]=3 1234 B9R1.2 CSC1=NC=CC(Cl)=N1 HR138302 [0,2,0,0,0,0|2,0,0]=4 1235 B9R1.2 CSC1=NC=CC(N)=N1 HR118029 [0,2,0,0,0,0|2,0,0]=4 1236 B9R1.2 Cc1cccc([Mg]Cl)c1 HR108627 [0,2,0,0,0,0|1,0,0]=3 1237 B9R1.2 ClC1=CC=CC(CBr)=C1 HR132227 [0,2,0,0,0,0|1,0,0]=3 1238 B9R1.2 ClC1=CC=CC(CBr)=N1 HR153010 [0,2,0,0,0,0|2,0,0]=4 1239 B9R1.2 ClC1=NC=CC(CBr)=C1 HR121367 [0,2,0,0,0,0|2,0,0]=4 1240 B9R1.2 ClCC1=CC(Br)=CC=C1 HR141825 [0,2,0,0,0,0|1,0,0]=3 1241 B9R1.2 ClCC1=CC(Cl)=CC=C1 HR131510 [0,2,0,0,0,0|1,0,0]=3 1242 B9R1.2 ClCC1=CC(Cl)=NC=C1 HR112398 [0,2,0,0,0,0|2,0,0]=4 1243 B9R1.2 ClCC1=CC=CC(Cl)=N1 HR103245 [0,2,0,0,0,0|2,0,0]=4 1244 B9R1.2 Clc1cccc([Mg]Br)c1 HR108311 [0,2,0,0,0,0|1,0,0]=3 1245 B9R1.2 FC1=CC=CC(CBr)=C1 HR122719 [0,2,0,0,0,0|1,0,0]=3 1246 B9R1.2 FC1=CC=CC(CCl)=C1 HR133938 [0,2,0,0,0,0|1,0,0]=3 1247 B9R1.2 FC1=CC=CC([Mg]Br)=C1 HR110842 [0,2,0,0,0,0|1,0,0]=3 1248 B9R1.2 N#CC1=CC(Br)=CC=C1 HR137380 [0,2,0,0,0,0|1,0,0]=3 1249 B9R1.2 N#CC1=CC(Br)=CN=C1 HR129104 [0,2,0,0,0,0|2,0,0]=4 1250 B9R1.2 N#CC1=CC(Br)=NC=C1 HR123028 [0,2,0,0,0,0|2,0,0]=4 1251 B9R1.2 N#CC1=CC(Cl)=CC=C1 HR131840 [0,2,0,0,0,0|1,0,0]=3 1252 B9R1.2 N#CC1=CC(Cl)=CN=C1 HR121499 [0,2,0,0,0,0|2,0,0]=4 1253 B9R1.2 N#CC1=CC(Cl)=NC=C1 HR129930 [0,2,0,0,0,0|2,0,0]=4 1254 B9R1.2 N#CC1=CC(F)=CC=C1 HR122191 [0,2,0,0,0,0|1,0,0]=3 1255 B9R1.2 N#CC1=CC(F)=NC=C1 HR106071 [0,2,0,0,0,0|2,0,0]=4 1256 B9R1.2 N#CC1=CC(I)=CC=C1 HR134874 [0,2,0,0,0,0|1,0,0]=3 1257 B9R1.2 N#CC1=CC(N)=CC=C1 HR146708 [0,2,0,0,0,0|1,0,0]=3 1258 B9R1.2 N#CC1=CC(N)=CN=C1 HR103509 [0,2,0,0,0,0|2,0,0]=4 1259 B9R1.2 N#CC1=CC(N)=NC=C1 HR137951 [0,2,0,0,0,0|2,0,0]=4 1260 B9R1.2 N#CC1=CC(O)=CC=C1 HR105267 [0,2,0,0,0,0|0,1,0]=3 1261 B9R1.2 N#CC1=CC(O)=CN=C1 HR120561 [0,2,0,0,0,0|1,1,0]=4 1262 B9R1.2 N#CC1=CC=CC(Cl)=N1 HR2163 [0,2,0,0,0,0|2,0,0]=4 1263 B9R1.2 N#CC1=CC=CC(N)=N1 HR113864 [0,2,0,0,0,0|2,0,0]=4 1264 B9R1.2 N#CC1=CC=C[N+]([O-])=C1 HR108677 [0,2,0,0,0,0|1,1,0]=4 1265 B9R1.2 N#CC1=CN=CC(F)=C1 HR30713 [0,2,0,0,0,0|2,0,0]=4 1266 B9R1.2 N#CC1=C[N+]([O-])=CC=C1 ARJL02202 [0,2,0,0,0,0|1,1,0]=4 1267 B9R1.2 N#CC1=NC(Br)=CC=C1 HR102056 [0,2,0,0,0,0|2,0,0]=4 1268 B9R1.2 N#CC1=NC(F)=CC=C1 HR118632 [0,2,0,0,0,0|2,0,0]=4 1269 B9R1.2 N#CC1=NC=CC(Br)=C1 HR102788 [0,2,0,0,0,0|2,0,0]=4 1270 B9R1.2 N#CC1=NC=CC(Cl)=C1 HR132841 [0,2,0,0,0,0|2,0,0]=4 1271 B9R1.2 N#CC1=NC=CC(F)=C1 HR107627 [0,2,0,0,0,0|2,0,0]=4 1272 B9R1.2 N#CC1=NC=CC(N)=C1 HR111824 [0,2,0,0,0,0|2,0,0]=4 1273 B9R1.2 N#CC1=NC=CC(O)=C1 HR33479 [0,2,0,0,0,0|1,1,0]=4 1274 B9R1.2 NC1=CC=CC(CO)=C1 HR135100 [0,2,0,0,0,0|0,1,0]=3 1275 B9R1.2 NC1=CC=CC(CO)=N1 HR108688 [0,2,0,0,0,0|1,1,0]=4 1276 B9R1.2 NC1=CN=CC(CO)=C1 HR142599 [0,2,0,0,0,0|1,1,0]=4 1277 B9R1.2 NC1=NC=CC(CO)=C1 HR30048 [0,2,0,0,0,0|1,1,0]=4 1278 B9R1.2 NCC1=CC(Br)=CC=C1 HR122489 [0,2,0,0,0,0|1,0,0]=3 1279 B9R1.2 NCC1=CC(Br)=CC=C1 HR123871 [0,2,0,0,0,0|1,0,0]=3 1280 B9R1.2 NCC1=CC(Br)=CN=C1 HR102985 [0,2,0,0,0,0|2,0,0]=4 1281 B9R1.2 NCC1=CC(Cl)=CC=C1 HR135363 [0,2,0,0,0,0|1,0,0]=3 1282 B9R1.2 NCC1=CC(F)=CC=C1 HR138534 [0,2,0,0,0,0|1,0,0]=3 1283 B9R1.2 NCC1=CC(F)=NC=C1 HR34018 [0,2,0,0,0,0|2,0,0]=4 1284 B9R1.2 NCC1=CC(I)=CC=C1 HR106172 [0,2,0,0,0,0|1,0,0]=3 1285 B9R1.2 NCC1=CC(I)=CC=C1 HR124334 [0,2,0,0,0,0|1,0,0]=3 1286 B9R1.2 NCC1=CC(N)=CC=C1 HR125229 [0,2,0,0,0,0|1,0,0]=3 1287 B9R1.2 NCC1=CC(N)=NC=C1 HR107899 [0,2,0,0,0,0|2,0,0]=4 1288 B9R1.2 NCC1=CC=CC(O)=C1 HR116688 [0,2,0,0,0,0|0,1,0]=3 1289 B9R1.2 NCC1=NC(Br)=CC=C1 HR120166 [0,2,0,0,0,0|2,0,0]=4 1290 B9R1.2 NCC1=NC=CC(Br)=C1 HR117574 [0,2,0,0,0,0|2,0,0]=4 1291 B9R1.2 NCC1=NC=CC(Cl)=C1 HR146853 [0,2,0,0,0,0|2,0,0]=4 1292 B9R1.2 NCC1=NC=CC(F)=C1 HR117840 [0,2,0,0,0,0|2,0,0]=4 1293 B9R1.2 NNC1=CC(Cl)=NC=C1 HR120493 [0,2,0,0,0,0|2,0,0]=4 1294 B9R1.2 NNC1=CC(F)=CC=C1 HR123010 [0,2,0,0,0,0|1,0,0]=3 1295 B9R1.2 NNC1=CC(F)=NC=C1 HR112055 [0,2,0,0,0,0|2,0,0]=4 1296 B9R1.2 NNC1=CC=CC(Cl)=N1 HR106228 [0,2,0,0,0,0|2,0,0]=4 1297 B9R1.2 NNC1=NC(Br)=CC=C1 HR141932 [0,2,0,0,0,0|2,0,0]=4 1298 B9R1.2 NNC1=NC=CC(F)=C1 HR111740 [0,2,0,0,0,0|2,0,0]=4 1299 B9R1.2 NNC1=NC=CC(I)=C1 HR152947 [0,2,0,0,0,0|2,0,0]=4 1300 B9R1.2 NNc1cccc(Br)c1 HR139376 [0,2,0,0,0,0|1,0,0]=3 1301 B9R1.2 NNc1cccc(Cl)c1 HR132514 [0,2,0,0,0,0|1,0,0]=3 1302 B9R1.2 Nc1cccc(C=O)c1 HR113736 [0,2,0,0,0,0|0,1,0]=3 1303 B9R1.2 Nc1cccc(C=O)c1 HR134302 [0,2,0,0,0,0|0,1,0]=3 1304 B9R1.2 O=CC1=CC(=O)NC=C1 HR128615 [0,2,0,0,0,0|1,1,0]=4 1305 B9R1.2 O=CC1=CC(Br)=CC=C1 HR3728 [0,2,0,0,0,0|0,1,0]=3 1306 B9R1.2 O=CC1=CC(Br)=NC=C1 HR135125 [0,2,0,0,0,0|1,1,0]=4 1307 B9R1.2 O=CC1=CC(Cl)=CC=C1 HR10800 [0,2,0,0,0,0|0,1,0]=3 1308 B9R1.2 O=CC1=CC(Cl)=NC=C1 HR136457 [0,2,0,0,0,0|1,1,0]=4 1309 B9R1.2 O=CC1=CC(F)=CC=C1 HR130202 [0,2,0,0,0,0|0,1,0]=3 1310 B9R1.2 O=CC1=CC(F)=NC=C1 HR124583 [0,2,0,0,0,0|1,1,0]=4 1311 B9R1.2 O=CC1=CC(I)=CC=C1 HR3917 [0,2,0,0,0,0|0,1,0]=3 1312 B9R1.2 O=CC1=CC(O)=CC=C1 EMSA06901 [0,2,0,0,0,0|0,1,0]=3 1313 B9R1.2 O=CC1=CN=CC(Br)=C1 HR16604 [0,2,0,0,0,0|1,1,0]=4 1314 B9R1.2 O=CC1=CN=CC(F)=C1 HR116785 [0,2,0,0,0,0|1,1,0]=4 1315 B9R1.2 O=CC1=NC(Br)=CC=C1 HR127431 [0,2,0,0,0,0|1,1,0]=4 1316 B9R1.2 O=CC1=NC(Cl)=CC=C1 HR13323 [0,2,0,0,0,0|1,1,0]=4 1317 B9R1.2 O=CC1=NC(F)=CC=C1 HR127979 [0,2,0,0,0,0|1,1,0]=4 1318 B9R1.2 O=CC1=NC=CC(Br)=C1 HR105348 [0,2,0,0,0,0|1,1,0]=4 1319 B9R1.2 O=CC1=NC=CC(Cl)=C1 HR109123 [0,2,0,0,0,0|1,1,0]=4 1320 B9R1.2 OCC1=CC(Br)=CC=C1 HR135241 [0,2,0,0,0,0|0,1,0]=3 1321 B9R1.2 OCC1=CC(Br)=CN=C1 HR114325 [0,2,0,0,0,0|1,1,0]=4 1322 B9R1.2 OCC1=CC(Br)=NC=C1 HR127451 [0,2,0,0,0,0|1,1,0]=4 1323 B9R1.2 OCC1=CC(Cl)=CC=C1 HR130178 [0,2,0,0,0,0|0,1,0]=3 1324 B9R1.2 OCC1=CC(Cl)=CN=C1 HR131696 [0,2,0,0,0,0|1,1,0]=4 1325 B9R1.2 OCC1=CC(Cl)=NC=C1 HR116926 [0,2,0,0,0,0|1,1,0]=4 1326 B9R1.2 OCC1=CC(F)=CC=C1 HR132286 [0,2,0,0,0,0|0,1,0]=3 1327 B9R1.2 OCC1=CC(F)=CN=C1 HR152444 [0,2,0,0,0,0|1,1,0]=4 1328 B9R1.2 OCC1=CC(F)=NC=C1 HR147281 [0,2,0,0,0,0|1,1,0]=4 1329 B9R1.2 OCC1=CC(I)=CC=C1 HR143741 [0,2,0,0,0,0|0,1,0]=3 1330 B9R1.2 OCC1=CC(O)=CC=C1 HR133941 [0,2,0,0,0,0|0,1,0]=3 1331 B9R1.2 OCC1=NC(Br)=CC=C1 HR127705 [0,2,0,0,0,0|1,1,0]=4 1332 B9R1.2 OCC1=NC(Cl)=CC=C1 HR101923 [0,2,0,0,0,0|1,1,0]=4 1333 B9R1.2 OCC1=NC=CC(Br)=C1 HR113342 [0,2,0,0,0,0|1,1,0]=4 1334 B9R1.2 OCC1=NC=CC(Cl)=C1 HR9828 [0,2,0,0,0,0|1,1,0]=4 1335 B9R1.2 OCc1cccc(Cl)n1 HR110468 [0,2,0,0,0,0|1,1,0]=4 1336 B9R1.2 ONC1=CC(Cl)=CC=C1 HR119158 [0,2,0,0,0,0|0,1,0]=3 1337 B9R1.6 BrC(Br)C1=CC=CC=C1 HR115920 [0,2,0,0,0,0|1,0,0]=3 1338 B9R1.6 CC(=O)C1=CC=CC=C1 HR133334 [0,2,0,0,0,0|0,1,0]=3 1339 B9R1.6 CC(=O)C1=CC=CN=C1 HR124857 [0,2,0,0,0,0|1,1,0]=4 1340 B9R1.6 CC(=O)C1=CC=NC=C1 HR122177 [0,2,0,0,0,0|1,1,0]=4 1341 B9R1.6 CC(=O)C1=NC=CC=C1 HR124589 [0,2,0,0,0,0|1,1,0]=4 1342 B9R1.6 CC(Br)C1=CC=CC=C1 HR128809 [0,2,0,0,0,0|1,0,0]=3 1343 B9R1.6 CC(Br)C1=CC=CC=C1 HR144035 [0,2,0,0,0,0|1,0,0]=3 1344 B9R1.6 CC(C)C1=CC=NC=C1 HR123293 [0,2,0,0,0,0|2,0,0]=4 1345 B9R1.6 CC(C)C1=NC=CC=C1 HR121179 [0,2,0,0,0,0|2,0,0]=4 1346 B9R1.6 CC(Cl)C1=CC=CC=C1 HR143243 [0,2,0,0,0,0|1,0,0]=3 1347 B9R1.6 CC(N)C1=CC=CC=C1 HR138387 [0,2,0,0,0,0|1,0,0]=3 1348 B9R1.6 CC(N)C1=CC=NC=C1 HR114337 [0,2,0,0,0,0|2,0,0]=4 1349 B9R1.6 CC(N)C1=CC=NC=C1 HR118448 [0,2,0,0,0,0|2,0,0]=4 1350 B9R1.6 CC(N)C1=NC=CC=C1 HR118573 [0,2,0,0,0,0|2,0,0]=4 1351 B9R1.6 CC(N)C1=NC=CC=C1 HR139032 [0,2,0,0,0,0|2,0,0]=4 1352 B9R1.6 CC(N)C1=NC=CC=C1 HR146145 [0,2,0,0,0,0|2,0,0]=4 1353 B9R1.6 CC(N)c1ccccc1 HR113196 [0,2,0,0,0,0|1,0,0]=3 1354 B9R1.6 CC(N)c1ccccc1 HR131269 [0,2,0,0,0,0|1,0,0]=3 1355 B9R1.6 CC(N)c1ccccc1 HR6060 [0,2,0,0,0,0|1,0,0]=3 1356 B9R1.6 CC(N)c1ccccc1 HR6061 [0,2,0,0,0,0|1,0,0]=3 1357 B9R1.6 CC(O)C1=CC=CC=C1 HR121274 [0,2,0,0,0,0|0,1,0]=3 1358 B9R1.6 CC(O)C1=CC=CC=C1 HR140945 [0,2,0,0,0,0|0,1,0]=3 1359 B9R1.6 CC(O)C1=CC=CC=C1 HR145171 [0,2,0,0,0,0|0,1,0]=3 1360 B9R1.6 CC(O)C1=CC=NC=C1 HR108902 [0,2,0,0,0,0|1,1,0]=4 1361 B9R1.6 CC(O)C1=CC=NC=C1 HR118138 [0,2,0,0,0,0|1,1,0]=4 1362 B9R1.6 CC(O)C1=CC=NC=C1 HR119453 [0,2,0,0,0,0|1,1,0]=4 1363 B9R1.6 CC(O)C1=CC=NC=C1 HR120966 [0,2,0,0,0,0|1,1,0]=4 1364 B9R1.6 CC(O)C1=NC=CC=C1 HR139212 [0,2,0,0,0,0|1,1,0]=4 1365 B9R1.6 CC(O)c1ccccn1 HR139125 [0,2,0,0,0,0|1,1,0]=4 1366 B9R1.6 CC(S)C1=CC=CC=C1 HR132212 [0,2,0,0,0,0|0,0,0]=2 1367 B9R1.6 CN(C)C1=CC=NC=C1 HR137344 [0,2,0,0,0,0|2,0,0]=4 1368 B9R1.6 CN(C)C1=NC=CC=C1 HR100852 [0,2,0,0,0,0|2,0,0]=4 1369 B9R1.6 CN(C)c1ccccc1 HR111456 [0,2,0,0,0,0|1,0,0]=3 1370 B9R1.6 C[SiH](C)C1=CC=CC=C1 HR120016 [0,2,0,0,0,0|1,0,0]=3 1371 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 HR139034 [0,2,0,0,0,0|1,0,0]=3 1372 B9R1.6 N=C(N)C1=CC=CC=C1 HR137220 [0,2,0,0,0,0|1,0,0]=3 1373 B9R1.6 N=C(N)C1=CC=CN=C1 HR109611 [0,2,0,0,0,0|2,0,0]=4 1374 B9R1.6 N=C(N)C1=CC=CN=C1 HR110152 [0,2,0,0,0,0|2,0,0]=4 1375 B9R1.6 N=C(N)C1=CC=NC=C1 CLXM00502 [0,2,0,0,0,0|2,0,0]=4 1376 B9R1.6 N=C(N)C1=CC=NC=C1 HR106649 [0,2,0,0,0,0|2,0,0]=4 1377 B9R1.6 N=C(N)C1=CC=NC=C1 HR109288 [0,2,0,0,0,0|2,0,0]=4 1378 B9R1.6 N=C(N)C1=NC=CC=C1 HR110150 [0,2,0,0,0,0|2,0,0]=4 1379 B9R1.6 NC(=O)C1=CC=CC=C1 HR127325 [0,2,0,0,0,0|0,1,0]=3 1380 B9R1.6 NC(=O)C1=CC=CN=C1 HR135206 [0,2,0,0,0,0|1,1,0]=4 1381 B9R1.6 NC(=O)C1=CC=NC=C1 HR133425 [0,2,0,0,0,0|1,1,0]=4 1382 B9R1.6 NC(=O)C1=NC=CC=C1 HR138372 [0,2,0,0,0,0|1,1,0]=4 1383 B9R1.6 NC(=S)C1=CC=CC=C1 HR122245 [0,2,0,0,0,0|0,0,1]=3 1384 B9R1.6 NC(=S)C1=CC=NC=C1 HR114925 [0,2,0,0,0,0|1,0,1]=4 1385 B9R1.6 NC(=S)C1=CN=CC=C1 HR122514 [0,2,0,0,0,0|1,0,1]=4 1386 B9R1.6 NC(=S)C1=NC=CC=C1 HR108668 [0,2,0,0,0,0|1,0,1]=4 1387 B9R1.6 O=C(Br)C1=CC=CC=C1 HR144111 [0,2,0,0,0,0|0,1,0]=3 1388 B9R1.6 O=C(Cl)C1=CC=CN=C1 HR140923 [0,2,0,0,0,0|1,1,0]=4 1389 B9R1.6 O=C(Cl)C1=CC=NC=C1 HR122948 [0,2,0,0,0,0|1,1,0]=4 1390 B9R1.6 O=C(Cl)C1=CN=CC=C1 HR130926 [0,2,0,0,0,0|1,1,0]=4 1391 B9R1.6 O=C(Cl)C1=NC=CC=C1 HR125180 [0,2,0,0,0,0|1,1,0]=4 1392 B9R1.6 O=C(O)C1=CC=CC=C1 HR137266 [0,2,0,0,0,0|0,1,0]=3 1393 B9R1.6 O=C(O)C1=CC=NC=C1 HR135466 [0,2,0,0,0,0|1,1,0]=4 1394 B9R1.6 O=C(O)C1=CN=CC=C1 HR124368 [0,2,0,0,0,0|1,1,0]=4 1395 B9R1.6 O=C(O)C1=NC=CC=C1 DOXF02207 [0,2,0,0,0,0|1,1,0]=4 1396 B9R1.6 O=C(O)c1ccccc1 HR133705 [0,2,0,0,0,0|0,1,0]=3 1397 B9R1.6 O=C([O-])C1=CC=CC=C1 HR105037 [0,2,0,0,0,0|0,1,0]=3 1398 B9R1.6 O=C([O-])C1=CC=CC=C1 HR110458 [0,2,0,0,0,0|0,1,0]=3 1399 B9R1.6 O=C([O-])C1=CC=CC=C1 HR135303 [0,2,0,0,0,0|0,1,0]=3 1400 B9R1.6 O=C([O-])C1=CC=CC=C1 HR135516 [0,2,0,0,0,0|0,1,0]=3 1401 B9R1.6 O=S(O)C1=CC=CC=C1 HR117415 [0,2,0,0,0,0|0,0,1]=3 1402 B9R1.6 O=S([O-])C1=CC=CC=C1 INSA03503 [0,2,0,0,0,0|0,0,1]=3 1403 B9R1.6 O=S([O-])c1ccccc1 HR100713 [0,2,0,0,0,0|0,0,1]=3 1404 B9R1.6 O=S([O-])c1ccccc1 HR132384 [0,2,0,0,0,0|0,0,1]=3 1405 B9R1.6 O=[N+]([O-])C1=CC=NC=C1 HR125450 [0,2,0,0,0,0|1,1,0]=4 1406 B9R1.6 O=[PH](O)C1=CC=CC=C1 HR124788 [0,2,0,0,0,0|0,1,0]=3 1407 B9R1.6 O=[PH]([O-])C1=CC=CC=C1 HR125346 [0,2,0,0,0,0|0,1,0]=3 1408 B9R1.6 O=[Se](O)C1=CC=CC=C1 HR127583 [0,2,0,0,0,0|0,1,0]=3 1409 B9R1.6 OB(O)C1=CC=CC=C1 HR1753 [0,2,0,0,0,0|0,1,0]=3 1410 B9R1.6 OB(O)C1=CC=CN=C1 SEXF01402 [0,2,0,0,0,0|1,1,0]=4 1411 B9R1.6 OB(O)C1=CC=NC=C1 HR149080 [0,2,0,0,0,0|1,1,0]=4 1412 B9R1.6 OB(O)C1=CC=NC=C1 HR5145 [0,2,0,0,0,0|1,1,0]=4 1413 B9R1.6 OB(O)C1=NC=CC=C1 HR134839 [0,2,0,0,0,0|1,1,0]=4 1414 B9R1.6 OC(=S)C1=CC=CC=C1 HR123025 [0,2,0,0,0,0|0,0,1]=3 1415 B9R1.8 BrCCC1=CC=CC=C1 HR137400 [0,2,0,0,0,0|1,0,0]=3 1416 B9R1.8 BrCCC1=CC=CN=C1 HR145991 [0,2,0,0,0,0|2,0,0]=4 1417 B9R1.8 BrCCC1=NC=CC=C1 HR108401 [0,2,0,0,0,0|2,0,0]=4 1418 B9R1.8 BrCCC1=NC=CC=C1 HR140265 [0,2,0,0,0,0|2,0,0]=4 1419 B9R1.8 Br[Mg]CC1=CC=CC=C1 HR107023 [0,2,0,0,0,0|1,0,0]=3 1420 B9R1.8 Br\C=C\C1=CC=CC=C1 HR125278 [0,2,0,0,0,0|1,0,0]=3 1421 B9R1.8 C#CSC1=CC=CC=C1 HR119776 [0,2,0,0,0,0|0,0,0]=2 1422 B9R1.8 C=CCC1=CC=CC=C1 HR125190 [0,2,0,0,0,0|1,0,0]=3 1423 B9R1.8 C=CSC1=CC=CC=C1 HR114439 [0,2,0,0,0,0|0,0,0]=2 1424 B9R1.8 CC#CC1=CC=CC=C1 HR143340 [0,2,0,0,0,0|1,0,0]=3 1425 B9R1.8 CCCC1=CC=NC=C1 HR126194 [0,2,0,0,0,0|2,0,0]=4 1426 B9R1.8 CCCC1=NC=CC=C1 HR129514 [0,2,0,0,0,0|2,0,0]=4 1427 B9R1.8 CCC[n+]1ccccc1 HR103120 [0,2,0,0,0,0|2,0,0]=4 1428 B9R1.8 CCC[n+]1ccccc1 HR122183 [0,2,0,0,0,0|2,0,0]=4 1429 B9R1.8 CCOC1=CC=CC=C1 SOSA06013 [0,2,0,0,0,0|0,1,0]=3 1430 B9R1.8 CCOC1=NC=CC=C1 HR1126 [0,2,0,0,0,0|1,1,0]=4 1431 B9R1.8 CNCC1=CC=CC=C1 HR122296 [0,2,0,0,0,0|1,0,0]=3 1432 B9R1.8 CNCC1=CC=CN=C1 HR115545 [0,2,0,0,0,0|2,0,0]=4 1433 B9R1.8 COCC1=CC=CC=C1 HR110737 [0,2,0,0,0,0|0,1,0]=3 1434 B9R1.8 COCC1=NC=CC=C1 HR139025 [0,2,0,0,0,0|1,1,0]=4 1435 B9R1.8 CSCC1=CC=CC=C1 HR135285 [0,2,0,0,0,0|0,0,0]=2 1436 B9R1.8 CSSC1=CC=CC=C1 HR128216 [0,2,0,0,0,0|0,0,0]=2 1437 B9R1.8 ClCCC1=CC=CC=C1 HR133891 [0,2,0,0,0,0|1,0,0]=3 1438 B9R1.8 ClCCC1=NC=CC=C1 HR142690 [0,2,0,0,0,0|2,0,0]=4 1439 B9R1.8 ClCSC1=CC=CC=C1 HR129663 [0,2,0,0,0,0|0,0,0]=2 1440 B9R1.8 Cl[Mg]CC1=CC=CC=C1 HR114099 [0,2,0,0,0,0|1,0,0]=3 1441 B9R1.8 N#CCC1=CC=CC=C1 HR20468 [0,2,0,0,0,0|1,0,0]=3 1442 B9R1.8 N#CCC1=CC=CN=C1 HR123244 [0,2,0,0,0,0|2,0,0]=4 1443 B9R1.8 N#CCC1=CC=NC=C1 HR129755 [0,2,0,0,0,0|2,0,0]=4 1444 B9R1.8 N#CCC1=CC=NC=C1 HR143282 [0,2,0,0,0,0|2,0,0]=4 1445 B9R1.8 N#CCC1=NC=CC=C1 HR128977 [0,2,0,0,0,0|2,0,0]=4 1446 B9R1.8 NCCC1=CC=CC=C1 HR124878 [0,2,0,0,0,0|1,0,0]=3 1447 B9R1.8 NCCC1=CC=CC=C1 HR126697 [0,2,0,0,0,0|1,0,0]=3 1448 B9R1.8 NCCC1=CC=CN=C1 HR134041 [0,2,0,0,0,0|2,0,0]=4 1449 B9R1.8 NCCC1=CC=NC=C1 HR116357 [0,2,0,0,0,0|2,0,0]=4 1450 B9R1.8 NCCC1=CC=NC=C1 HR119181 [0,2,0,0,0,0|2,0,0]=4 1451 B9R1.8 NCCC1=NC=CC=C1 HR141302 [0,2,0,0,0,0|2,0,0]=4 1452 B9R1.8 NNCC1=CC=CC=C1 HR134091 [0,2,0,0,0,0|1,0,0]=3 1453 B9R1.8 NNCC1=CC=CC=C1 HR30015 [0,2,0,0,0,0|1,0,0]=3 1454 B9R1.8 NNCC1=CC=CN=C1 HR105274 [0,2,0,0,0,0|2,0,0]=4 1455 B9R1.8 NOCC1=CC=CC=C1 HR139396 [0,2,0,0,0,0|0,1,0]=3 1456 B9R1.8 NOCC1=CC=CC=C1 HR7095 [0,2,0,0,0,0|0,1,0]=3 1457 B9R1.8 N\C=C\C1=CC=CC=C1 HR145262 [0,2,0,0,0,0|1,0,0]=3 1458 B9R1.8 O=C=NC1=CC=CN=C1 HR114840 [0,2,0,0,0,0|1,1,0]=4 1459 B9R1.8 O=CCC1=CC=CC=C1 HR138581 [0,2,0,0,0,0|0,1,0]=3 1460 B9R1.8 O=CNC1=CC=CC=C1 HR101147 [0,2,0,0,0,0|0,1,0]=3 1461 B9R1.8 O=S=NC1=CC=CC=C1 HR140039 [0,2,0,0,0,0|0,0,1]=3 1462 B9R1.8 OCCC1=CC=CC=C1 HR126434 [0,2,0,0,0,0|0,1,0]=3 1463 B9R1.8 OCCC1=CC=CN=C1 HR117461 [0,2,0,0,0,0|1,1,0]=4 1464 B9R1.8 OCCC1=CC=NC=C1 HR134681 [0,2,0,0,0,0|1,1,0]=4 1465 B9R1.8 OCCC1=NC=CC=C1 HR132012 [0,2,0,0,0,0|1,1,0]=4 1466 B9R1.8 ONCC1=CC=CC=C1 HR30114 [0,2,0,0,0,0|0,1,0]=3 1467 B9R1.8 O\N=C\C1=CC=CN=C1 HR142277 [0,2,0,0,0,0|1,1,0]=4 1468 B9R1.8 O\N=C\C1=CC=NC=C1 HR136002 [0,2,0,0,0,0|1,1,0]=4 1469 B9R1.8 O\N=C\c1ccccc1 HR135559 [0,2,0,0,0,0|0,1,0]=3 1470 B9R1.8 O\N=C\c1ccccn1 HR110053 [0,2,0,0,0,0|1,1,0]=4 1471 B9R1.8 SCCC1=CC=CC=C1 HR137189 [0,2,0,0,0,0|0,0,0]=2 1472 B9R1.8 SCCC1=NC=CN=C1 HR126064 [0,2,0,0,0,0|2,0,0]=4 1473 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 HR100465 [0,2,0,0,0,0|1,0,0]=3 1474 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 HR104840 [0,2,0,0,0,0|2,0,0]=4 1475 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 HR116542 [0,2,0,0,0,0|2,0,0]=4 1476 B9R1.15 BrCC1=C(Br)C=CC=C1 HR16915 [0,2,0,0,0,0|1,0,0]=3 1477 B9R1.15 BrCC1=C(I)C=CC=C1 HR128775 [0,2,0,0,0,0|1,0,0]=3 1478 B9R1.15 BrCC1=CC=CN=C1Br HR109478 [0,2,0,0,0,0|2,0,0]=4 1479 B9R1.15 C#CC1=C(Br)C=CC=C1 HR120120 [0,2,0,0,0,0|1,0,0]=3 1480 B9R1.15 C#CC1=C(C)C=CC=C1 HR139967 [0,2,0,0,0,0|1,0,0]=3 1481 B9R1.15 C#CC1=C(Cl)C=CC=C1 HR142112 [0,2,0,0,0,0|1,0,0]=3 1482 B9R1.15 C#CC1=C(F)C=CC=C1 HR119279 [0,2,0,0,0,0|1,0,0]=3 1483 B9R1.15 C#CC1=C(O)C=CC=C1 HR113605 [0,2,0,0,0,0|0,1,0]=3 1484 B9R1.15 C#CC1=CC=CN=C1N HR33481 [0,2,0,0,0,0|2,0,0]=4 1485 B9R1.15 C=CC1=C(Br)C=CC=C1 HR102534 [0,2,0,0,0,0|1,0,0]=3 1486 B9R1.15 C=CC1=C(Cl)C=CC=C1 HR133556 [0,2,0,0,0,0|1,0,0]=3 1487 B9R1.15 C=CC1=C(F)C=CC=C1 HR129562 [0,2,0,0,0,0|1,0,0]=3 1488 B9R1.15 C=CC1=C(N)C=CC=C1 HR135916 [0,2,0,0,0,0|1,0,0]=3 1489 B9R1.15 CC1=C(C#N)C=CN=C1 HR102692 [0,2,0,0,0,0|2,0,0]=4 1490 B9R1.15 CC1=C(C#N)C=NC=C1 HR6623 [0,2,0,0,0,0|2,0,0]=4 1491 B9R1.15 CC1=C(C=O)C=CC=N1 HR120880 [0,2,0,0,0,0|1,1,0]=4 1492 B9R1.15 CC1=C(C=O)C=CN=C1 HR131229 [0,2,0,0,0,0|1,1,0]=4 1493 B9R1.15 CC1=C(CBr)C=CC=C1 HR148643 [0,2,0,0,0,0|1,0,0]=3 1494 B9R1.15 CC1=C(CCl)C=CC=C1 HR138358 [0,2,0,0,0,0|1,0,0]=3 1495 B9R1.15 CC1=C(CN)C=CC=C1 HR135254 [0,2,0,0,0,0|1,0,0]=3 1496 B9R1.15 CC1=C(CO)C=CC=C1 HR137871 [0,2,0,0,0,0|0,1,0]=3 1497 B9R1.15 CC1=C(CO)C=NC=C1 HR33879 [0,2,0,0,0,0|1,1,0]=4 1498 B9R1.15 CC1=C(NN)C=CC=C1 HR6396 [0,2,0,0,0,0|1,0,0]=3 1499 B9R1.15 CC1=CC=CC=C1C=O HR128627 [0,2,0,0,0,0|0,1,0]=3 1500 B9R1.15 CC1=CC=CN=C1C#N HR128098 [0,2,0,0,0,0|2,0,0]=4 1501 B9R1.15 CC1=CC=CN=C1C=O HR134669 [0,2,0,0,0,0|1,1,0]=4 1502 B9R1.15 CC1=CC=CN=C1CN HR101019 [0,2,0,0,0,0|2,0,0]=4 1503 B9R1.15 CC1=CC=NC=C1C=O HR32184 [0,2,0,0,0,0|1,1,0]=4 1504 B9R1.15 CC1=NC=CC=C1C#N HR117061 [0,2,0,0,0,0|2,0,0]=4 1505 B9R1.15 CC1=NC=CC=C1CO HR106318 [0,2,0,0,0,0|1,1,0]=4 1506 B9R1.15 CCC1=C(Br)C=CC=C1 HR3770 [0,2,0,0,0,0|1,0,0]=3 1507 B9R1.15 CCC1=C(C)C=CC=C1 HR141099 [0,2,0,0,0,0|1,0,0]=3 1508 B9R1.15 CCC1=C(O)C=CC=C1 HR137341 [0,2,0,0,0,0|0,1,0]=3 1509 B9R1.15 CCC1=C(S)C=CC=C1 HR125552 [0,2,0,0,0,0|0,0,0]=2 1510 B9R1.15 CCC1=CC=CN=C1N HR112369 [0,2,0,0,0,0|2,0,0]=4 1511 B9R1.15 CCC1=NC=CC=C1Br HR30415 [0,2,0,0,0,0|2,0,0]=4 1512 B9R1.15 CC[N+]1=C(Br)C=CC=C1 HR138344 [0,2,0,0,0,0|2,0,0]=4 1513 B9R1.15 CNC1=C(Br)C=CC=C1 HR114695 [0,2,0,0,0,0|1,0,0]=3 1514 B9R1.15 CNC1=C(C)C=CN=C1 HR110155 [0,2,0,0,0,0|2,0,0]=4 1515 B9R1.15 CNC1=C(Cl)C=CC=C1 HR144009 [0,2,0,0,0,0|1,0,0]=3 1516 B9R1.15 CNC1=C(F)C=CC=C1 HR136160 [0,2,0,0,0,0|1,0,0]=3 1517 B9R1.15 CNC1=C(N)C=CC=C1 HR133206 [0,2,0,0,0,0|1,0,0]=3 1518 B9R1.15 CNC1=C(N)C=NC=C1 HR30038 [0,2,0,0,0,0|2,0,0]=4 1519 B9R1.15 CNC1=C(O)C=CC=C1 HR141198 [0,2,0,0,0,0|0,1,0]=3 1520 B9R1.15 CNC1=CC=CC=C1N HR133477 [0,2,0,0,0,0|1,0,0]=3 1521 B9R1.15 CNC1=CC=CN=C1Cl HR131302 [0,2,0,0,0,0|2,0,0]=4 1522 B9R1.15 CNC1=NC=CC=C1I HR152872 [0,2,0,0,0,0|2,0,0]=4 1523 B9R1.15 CNc1ccccc1C HR130258 [0,2,0,0,0,0|1,0,0]=3 1524 B9R1.15 COC1=C(Br)C=CC=C1 HR3725 [0,2,0,0,0,0|0,1,0]=3 1525 B9R1.15 COC1=C(Br)C=CN=C1 HR104864 [0,2,0,0,0,0|1,1,0]=4 1526 B9R1.15 COC1=C(Br)C=CN=C1 HR33882 [0,2,0,0,0,0|1,1,0]=4 1527 B9R1.15 COC1=C(Br)C=NC=C1 HR33454 [0,2,0,0,0,0|1,1,0]=4 1528 B9R1.15 COC1=C(C)C=CC=C1 HR137455 [0,2,0,0,0,0|0,1,0]=3 1529 B9R1.15 COC1=C(C)C=CN=C1 HR33839 [0,2,0,0,0,0|1,1,0]=4 1530 B9R1.15 COC1=C(Cl)C=CC=C1 HR123590 [0,2,0,0,0,0|0,1,0]=3 1531 B9R1.15 COC1=C(Cl)C=CN=C1 HR32566 [0,2,0,0,0,0|1,1,0]=4 1532 B9R1.15 COC1=C(F)C=CC=C1 ELXM01906 [0,2,0,0,0,0|0,1,0]=3 1533 B9R1.15 COC1=C(I)C=CC=C1 HR136181 [0,2,0,0,0,0|0,1,0]=3 1534 B9R1.15 COC1=C(I)C=NC=C1 HR33703 [0,2,0,0,0,0|1,1,0]=4 1535 B9R1.15 COC1=C(N)C=CN=C1 HR32243 [0,2,0,0,0,0|1,1,0]=4 1536 B9R1.15 COC1=C(N)C=NC=C1 HR146867 [0,2,0,0,0,0|1,1,0]=4 1537 B9R1.15 COC1=C(O)C=CN=C1 HR33371 [0,2,0,0,0,0|1,1,0]=4 1538 B9R1.15 COC1=C(O)C=NC=C1 HR110862 [0,2,0,0,0,0|1,1,0]=4 1539 B9R1.15 COC1=C(S)C=CC=C1 HR122294 [0,2,0,0,0,0|0,0,0]=2 1540 B9R1.15 COC1=CC=CC=C1O HR128921 [0,2,0,0,0,0|0,1,0]=3 1541 B9R1.15 COC1=CC=CN=C1Br HR30133 [0,2,0,0,0,0|1,1,0]=4 1542 B9R1.15 COC1=CC=CN=C1Cl HR138618 [0,2,0,0,0,0|1,1,0]=4 1543 B9R1.15 COC1=CC=CN=C1F HR152621 [0,2,0,0,0,0|1,1,0]=4 1544 B9R1.15 COC1=CC=CN=C1N HR31846 [0,2,0,0,0,0|1,1,0]=4 1545 B9R1.15 COC1=CC=CNC1=O HR106554 [0,2,0,0,0,0|1,1,0]=4 1546 B9R1.15 COC1=NC=CC=C1Br HR129848 [0,2,0,0,0,0|1,1,0]=4 1547 B9R1.15 COC1=NC=CC=C1Cl HR109358 [0,2,0,0,0,0|1,1,0]=4 1548 B9R1.15 COC1=NC=CC=C1I HR6586 [0,2,0,0,0,0|1,1,0]=4 1549 B9R1.15 COC1=NC=CC=C1N HR136977 [0,2,0,0,0,0|1,1,0]=4 1550 B9R1.15 COC1=NC=CC=C1O HR152722 [0,2,0,0,0,0|1,1,0]=4 1551 B9R1.15 COc1ccccc1N HR147690 [0,2,0,0,0,0|0,1,0]=3 1552 B9R1.15 CSC1=C(Br)C=CC=C1 HR139567 [0,2,0,0,0,0|0,0,0]=2 1553 B9R1.15 CSC1=C(Br)C=CN=C1 HR152821 [0,2,0,0,0,0|1,0,0]=3 1554 B9R1.15 CSC1=C(Cl)C=CC=C1 HR140054 [0,2,0,0,0,0|0,0,0]=2 1555 B9R1.15 CSC1=C(F)C=CC=C1 HR139213 [0,2,0,0,0,0|0,0,0]=2 1556 B9R1.15 CSC1=C(F)C=NC=C1 HR153036 [0,2,0,0,0,0|1,0,0]=3 1557 B9R1.15 CSC1=C(I)C=CC=C1 HR139026 [0,2,0,0,0,0|0,0,0]=2 1558 B9R1.15 CSC1=C(N)C=CC=C1 HR137618 [0,2,0,0,0,0|0,0,0]=2 1559 B9R1.15 CSC1=C(O)C=CC=C1 HR143629 [0,2,0,0,0,0|0,0,0]=2 1560 B9R1.15 CSC1=CC=CN=C1Cl HR152807 [0,2,0,0,0,0|1,0,0]=3 1561 B9R1.15 CSC1=CC=CN=C1F HR152808 [0,2,0,0,0,0|1,0,0]=3 1562 B9R1.15 CSC1=NC=CC=C1Br HR117530 [0,2,0,0,0,0|1,0,0]=3 1563 B9R1.15 CSC1=NC=CC=C1Cl HR152636 [0,2,0,0,0,0|1,0,0]=3 1564 B9R1.15 CSC1=NC=CN=C1C HR123098 [0,2,0,0,0,0|2,0,0]=4 1565 B9R1.15 Cc1ccccc1NN HR135194 [0,2,0,0,0,0|1,0,0]=3 1566 B9R1.15 Cc1ccccc1[Mg]Br HR119359 [0,2,0,0,0,0|1,0,0]=3 1567 B9R1.15 ClC1=C(CBr)C=CC=C1 HR132482 [0,2,0,0,0,0|1,0,0]=3 1568 B9R1.15 ClCC1=C(Cl)C=CC=C1 HR131237 [0,2,0,0,0,0|1,0,0]=3 1569 B9R1.15 ClCC1=C(Cl)N=CC=C1 HR127532 [0,2,0,0,0,0|2,0,0]=4 1570 B9R1.15 ClCC1=C(I)C=CC=C1 HR118598 [0,2,0,0,0,0|1,0,0]=3 1571 B9R1.15 FC1=C(CBr)C=CC=C1 VEXM01107 [0,2,0,0,0,0|1,0,0]=3 1572 B9R1.15 FC1=C(CCl)C=CC=C1 RAXM01504 [0,2,0,0,0,0|1,0,0]=3 1573 B9R1.15 N#CC1=C(Br)C=CC=C1 HR3744 [0,2,0,0,0,0|1,0,0]=3 1574 B9R1.15 N#CC1=C(Br)C=CN=C1 HR122466 [0,2,0,0,0,0|2,0,0]=4 1575 B9R1.15 N#CC1=C(Br)C=NC=C1 HR31992 [0,2,0,0,0,0|2,0,0]=4 1576 B9R1.15 N#CC1=C(Cl)C=CC=C1 HR126210 [0,2,0,0,0,0|1,0,0]=3 1577 B9R1.15 N#CC1=C(Cl)C=NC=C1 HR127240 [0,2,0,0,0,0|2,0,0]=4 1578 B9R1.15 N#CC1=C(F)C=CC=C1 HR132061 [0,2,0,0,0,0|1,0,0]=3 1579 B9R1.15 N#CC1=C(F)C=NC=C1 HR108087 [0,2,0,0,0,0|2,0,0]=4 1580 B9R1.15 N#CC1=C(I)C=CC=C1 HR134075 [0,2,0,0,0,0|1,0,0]=3 1581 B9R1.15 N#CC1=C(I)C=CN=C1 HR106363 [0,2,0,0,0,0|2,0,0]=4 1582 B9R1.15 N#CC1=C(I)C=NC=C1 HR106676 [0,2,0,0,0,0|2,0,0]=4 1583 B9R1.15 N#CC1=C(I)N=CC=C1 HR33324 [0,2,0,0,0,0|2,0,0]=4 1584 B9R1.15 N#CC1=C(N)C=CC=C1 HR127798 [0,2,0,0,0,0|1,0,0]=3 1585 B9R1.15 N#CC1=C(N)C=NC=C1 HR143479 [0,2,0,0,0,0|2,0,0]=4 1586 B9R1.15 N#CC1=C(O)C=CC=C1 HR4803 [0,2,0,0,0,0|0,1,0]=3 1587 B9R1.15 N#CC1=C(O)N=CC=C1 HR109178 [0,2,0,0,0,0|1,1,0]=4 1588 B9R1.15 N#CC1=CC=CN=C1Br HR113734 [0,2,0,0,0,0|2,0,0]=4 1589 B9R1.15 N#CC1=CC=CN=C1Cl HR129665 [0,2,0,0,0,0|2,0,0]=4 1590 B9R1.15 N#CC1=CC=CN=C1F HR122498 [0,2,0,0,0,0|2,0,0]=4 1591 B9R1.15 N#CC1=CC=CN=C1N HR5584 [0,2,0,0,0,0|2,0,0]=4 1592 B9R1.15 N#CC1=CC=CN=C1O HR6539 [0,2,0,0,0,0|1,1,0]=4 1593 B9R1.15 N#CC1=CN=CC=C1Cl HR123278 [0,2,0,0,0,0|2,0,0]=4 1594 B9R1.15 N#CC1=CN=CC=C1O HR141533 [0,2,0,0,0,0|1,1,0]=4 1595 B9R1.15 N#CC1=CNC=CC1=O HR116659 [0,2,0,0,0,0|1,1,0]=4 1596 B9R1.15 N#CC1=NC=CC=C1Br HR2263 [0,2,0,0,0,0|2,0,0]=4 1597 B9R1.15 N#CC1=NC=CC=C1Cl HR138272 [0,2,0,0,0,0|2,0,0]=4 1598 B9R1.15 N#CC1=NC=CC=C1F HR107772 [0,2,0,0,0,0|2,0,0]=4 1599 B9R1.15 N#CC1=NC=CC=C1I HR15743 [0,2,0,0,0,0|2,0,0]=4 1600 B9R1.15 N#CC1=NC=CC=C1N HR117626 [0,2,0,0,0,0|2,0,0]=4 1601 B9R1.15 N#CC1=NC=CC=C1O HR124041 [0,2,0,0,0,0|1,1,0]=4 1602 B9R1.15 NC1=C(C=O)C=CC=C1 HR15692 [0,2,0,0,0,0|0,1,0]=3 1603 B9R1.15 NC1=C(C=O)C=CN=C1 HR130656 [0,2,0,0,0,0|1,1,0]=4 1604 B9R1.15 NC1=C(C=O)C=NC=C1 HR127808 [0,2,0,0,0,0|1,1,0]=4 1605 B9R1.15 NC1=C(CO)C=CC=C1 HR129640 [0,2,0,0,0,0|0,1,0]=3 1606 B9R1.15 NC1=C(CO)C=CN=C1 HR117281 [0,2,0,0,0,0|1,1,0]=4 1607 B9R1.15 NC1=C(CO)C=NC=C1 HR113015 [0,2,0,0,0,0|1,1,0]=4 1608 B9R1.15 NC1=NC=CC=C1C=O HR126656 [0,2,0,0,0,0|1,1,0]=4 1609 B9R1.15 NC1=NC=CC=C1CO HR122953 [0,2,0,0,0,0|1,1,0]=4 1610 B9R1.15 NCC1=C(Br)C=CC=C1 HR107271 [0,2,0,0,0,0|1,0,0]=3 1611 B9R1.15 NCC1=C(Cl)C=CC=C1 HR130715 [0,2,0,0,0,0|1,0,0]=3 1612 B9R1.15 NCC1=C(F)C=CC=C1 HR136479 [0,2,0,0,0,0|1,0,0]=3 1613 B9R1.15 NCC1=C(F)C=NC=C1 HR121891 [0,2,0,0,0,0|2,0,0]=4 1614 B9R1.15 NCC1=C(N)C=CC=C1 HR139219 [0,2,0,0,0,0|1,0,0]=3 1615 B9R1.15 NCC1=C(O)C=CC=C1 HR114145 [0,2,0,0,0,0|0,1,0]=3 1616 B9R1.15 NCC1=CC=CN=C1Cl HR120674 [0,2,0,0,0,0|2,0,0]=4 1617 B9R1.15 NCC1=CC=CN=C1F HR114175 [0,2,0,0,0,0|2,0,0]=4 1618 B9R1.15 NCC1=CC=CN=C1F HR146812 [0,2,0,0,0,0|2,0,0]=4 1619 B9R1.15 NCC1=NC=CC=C1O HR33759 [0,2,0,0,0,0|1,1,0]=4 1620 B9R1.15 NCc1ccccc1Cl HR114059 [0,2,0,0,0,0|1,0,0]=3 1621 B9R1.15 NCc1ccccc1N CESA03017 [0,2,0,0,0,0|1,0,0]=3 1622 B9R1.15 NCc1cccnc1O HR113504 [0,2,0,0,0,0|1,1,0]=4 1623 B9R1.15 NNC1=C(Br)C=CC=C1 HR104654 [0,2,0,0,0,0|1,0,0]=3 1624 B9R1.15 NNC1=C(Br)C=CC=C1 HR123322 [0,2,0,0,0,0|1,0,0]=3 1625 B9R1.15 NNC1=C(Cl)C=CC=C1 HR126949 [0,2,0,0,0,0|1,0,0]=3 1626 B9R1.15 NNC1=C(F)C=CC=C1 HR122819 [0,2,0,0,0,0|1,0,0]=3 1627 B9R1.15 NNC1=C(F)C=CC=C1 HR127495 [0,2,0,0,0,0|1,0,0]=3 1628 B9R1.15 NNC1=NC=CC=C1Cl HR134367 [0,2,0,0,0,0|2,0,0]=4 1629 B9R1.15 NNC1=NC=CC=C1F HR145905 [0,2,0,0,0,0|2,0,0]=4 1630 B9R1.15 NNC1=NC=CC=C1I HR152948 [0,2,0,0,0,0|2,0,0]=4 1631 B9R1.15 O=CC1=C(Br)C=CC=C1 HR3727 [0,2,0,0,0,0|0,1,0]=3 1632 B9R1.15 O=CC1=C(Br)C=CN=C1 HR152991 [0,2,0,0,0,0|1,1,0]=4 1633 B9R1.15 O=CC1=C(Br)C=CN=C1 HR156453 [0,2,0,0,0,0|1,1,0]=4 1634 B9R1.15 O=CC1=C(Br)C=NC=C1 HR122757 [0,2,0,0,0,0|1,1,0]=4 1635 B9R1.15 O=CC1=C(Cl)C=CC=C1 HR124630 [0,2,0,0,0,0|0,1,0]=3 1636 B9R1.15 O=CC1=C(Cl)C=CN=C1 HR136076 [0,2,0,0,0,0|1,1,0]=4 1637 B9R1.15 O=CC1=C(Cl)C=NC=C1 HR129650 [0,2,0,0,0,0|1,1,0]=4 1638 B9R1.15 O=CC1=C(Cl)C=NC=C1 HR156293 [0,2,0,0,0,0|1,1,0]=4 1639 B9R1.15 O=CC1=C(F)C=CC=C1 HR3476 [0,2,0,0,0,0|0,1,0]=3 1640 B9R1.15 O=CC1=C(F)C=NC=C1 HR111597 [0,2,0,0,0,0|1,1,0]=4 1641 B9R1.15 O=CC1=C(I)C=CC=C1 HR111252 [0,2,0,0,0,0|0,1,0]=3 1642 B9R1.15 O=CC1=C(O)C=NC=C1 HR32036 [0,2,0,0,0,0|1,1,0]=4 1643 B9R1.15 O=CC1=C(O)N=CC=C1 HR111401 [0,2,0,0,0,0|1,1,0]=4 1644 B9R1.15 O=CC1=CC=CC=C1O HR147512 [0,2,0,0,0,0|0,1,0]=3 1645 B9R1.15 O=CC1=CC=CN=C1Br HR123822 [0,2,0,0,0,0|1,1,0]=4 1646 B9R1.15 O=CC1=CC=CN=C1Cl HR5097 [0,2,0,0,0,0|1,1,0]=4 1647 B9R1.15 O=CC1=CC=CN=C1F HR110374 [0,2,0,0,0,0|1,1,0]=4 1648 B9R1.15 O=CC1=CN=CC=C1Br HR108036 [0,2,0,0,0,0|1,1,0]=4 1649 B9R1.15 O=CC1=CN=CC=C1Cl HR154428 [0,2,0,0,0,0|1,1,0]=4 1650 B9R1.15 O=CC1=NC=CC=C1Br HR32612 [0,2,0,0,0,0|1,1,0]=4 1651 B9R1.15 O=CC1=NC=CC=C1Cl HR115301 [0,2,0,0,0,0|1,1,0]=4 1652 B9R1.15 O=CC1=NC=CC=C1F HR32037 [0,2,0,0,0,0|1,1,0]=4 1653 B9R1.15 O=CC1=NC=CC=C1O HR33297 [0,2,0,0,0,0|1,1,0]=4 1654 B9R1.15 OC1=C([Hg]Cl)C=CC=C1 HR141603 [0,2,0,0,0,0|0,1,0]=3 1655 B9R1.15 OCC1=C(Br)C=CC=C1 HR124688 [0,2,0,0,0,0|0,1,0]=3 1656 B9R1.15 OCC1=C(Br)C=CN=C1 HR117819 [0,2,0,0,0,0|1,1,0]=4 1657 B9R1.15 OCC1=C(Br)C=CN=C1 HR154450 [0,2,0,0,0,0|1,1,0]=4 1658 B9R1.15 OCC1=C(Br)C=CN=C1 HR156452 [0,2,0,0,0,0|1,1,0]=4 1659 B9R1.15 OCC1=C(Br)C=NC=C1 HR101946 [0,2,0,0,0,0|1,1,0]=4 1660 B9R1.15 OCC1=C(Cl)C=CC=C1 HR129922 [0,2,0,0,0,0|0,1,0]=3 1661 B9R1.15 OCC1=C(Cl)C=CN=C1 HR131428 [0,2,0,0,0,0|1,1,0]=4 1662 B9R1.15 OCC1=C(Cl)C=NC=C1 HR110284 [0,2,0,0,0,0|1,1,0]=4 1663 B9R1.15 OCC1=C(F)C=CC=C1 HR133869 [0,2,0,0,0,0|0,1,0]=3 1664 B9R1.15 OCC1=C(F)C=NC=C1 HR109962 [0,2,0,0,0,0|1,1,0]=4 1665 B9R1.15 OCC1=C(I)C=CC=C1 HR134417 [0,2,0,0,0,0|0,1,0]=3 1666 B9R1.15 OCC1=C(S)C=CC=C1 HR108380 [0,2,0,0,0,0|0,0,0]=2 1667 B9R1.15 OCC1=CC=CC=C1O HR133672 [0,2,0,0,0,0|0,1,0]=3 1668 B9R1.15 OCC1=CC=CN=C1Cl HR12984 [0,2,0,0,0,0|1,1,0]=4 1669 B9R1.15 OCC1=CC=CN=C1F HR105854 [0,2,0,0,0,0|1,1,0]=4 1670 B9R1.15 OCC1=NC=CC=C1Cl HR117957 [0,2,0,0,0,0|1,1,0]=4 1671 B9R1.15 OCC1=NC=CC=C1F HR108056 [0,2,0,0,0,0|1,1,0]=4 1672 B9R1.15 OCC1=NC=CC=C1O HR4075 [0,2,0,0,0,0|1,1,0]=4 1673 B9R1.15 ONC1=C(Cl)C=CC=C1 HR119473 [0,2,0,0,0,0|0,1,0]=3 1674 B9R1.15 SCC1=C(Br)C=CC=C1 HR141525 [0,2,0,0,0,0|0,0,0]=2 1675 B9R1.118 CC1(CS)C=CC=CC1 HR132463 [0,2,0,0,0,0|0,0,2]=4 1676 B9R1.69 BrC1=CC(Br)=C(Br)C=C1 HR143437 [0,2,0,0,0,0|1,0,0]=3 1677 B9R1.69 BrC1=CC(I)=C(Br)C=C1 HR153626 [0,2,0,0,0,0|1,0,0]=3 1678 B9R1.69 BrC1=CN=C(Br)C(Br)=C1 HR10382 [0,2,0,0,0,0|2,0,0]=4 1679 B9R1.69 BrC1=CN=C(Br)C(I)=C1 HR152747 [0,2,0,0,0,0|2,0,0]=4 1680 B9R1.69 BrC1=CN=C(Br)C=C1I HR33618 [0,2,0,0,0,0|2,0,0]=4 1681 B9R1.69 BrC1=CN=C(I)C(Br)=C1 HR152473 [0,2,0,0,0,0|2,0,0]=4 1682 B9R1.69 CC1=C(Br)C=C(Br)C=C1 HR3915 [0,2,0,0,0,0|1,0,0]=3 1683 B9R1.69 CC1=C(Br)C=C(Cl)C=C1 HR128545 [0,2,0,0,0,0|1,0,0]=3 1684 B9R1.69 CC1=C(Br)C=C(F)C=C1 HR1602 [0,2,0,0,0,0|1,0,0]=3 1685 B9R1.69 CC1=C(Br)C=C(I)C=C1 HR120831 [0,2,0,0,0,0|1,0,0]=3 1686 B9R1.69 CC1=C(Br)C=C(N)C=C1 HR135955 [0,2,0,0,0,0|1,0,0]=3 1687 B9R1.69 CC1=C(Br)C=C(N)C=N1 HR102696 [0,2,0,0,0,0|2,0,0]=4 1688 B9R1.69 CC1=C(Br)C=C(O)C=C1 HR31942 [0,2,0,0,0,0|0,1,0]=3 1689 B9R1.69 CC1=C(Br)C=CC(Br)=C1 HR137401 [0,2,0,0,0,0|1,0,0]=3 1690 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 HR131858 [0,2,0,0,0,0|1,0,0]=3 1691 B9R1.69 CC1=C(Br)C=CC(F)=C1 HR122797 [0,2,0,0,0,0|1,0,0]=3 1692 B9R1.69 CC1=C(Br)C=CC(I)=C1 HR107543 [0,2,0,0,0,0|1,0,0]=3 1693 B9R1.69 CC1=C(Br)C=CC(N)=C1 HR125379 [0,2,0,0,0,0|1,0,0]=3 1694 B9R1.69 CC1=C(Br)C=CC(N)=N1 HR129359 [0,2,0,0,0,0|2,0,0]=4 1695 B9R1.69 CC1=C(Br)C=CC(O)=C1 HR32031 [0,2,0,0,0,0|0,1,0]=3 1696 B9R1.69 CC1=C(Br)N=CC(O)=C1 HR34016 [0,2,0,0,0,0|1,1,0]=4 1697 B9R1.69 CC1=C(C)C=C(Br)C=C1 HR146976 [0,2,0,0,0,0|1,0,0]=3 1698 B9R1.69 CC1=C(C)C=C(Cl)C=C1 HR143529 [0,2,0,0,0,0|1,0,0]=3 1699 B9R1.69 CC1=C(C)C=C(F)C=C1 HR129824 [0,2,0,0,0,0|1,0,0]=3 1700 B9R1.69 CC1=C(C)C=C(I)C=C1 HR126918 [0,2,0,0,0,0|1,0,0]=3 1701 B9R1.69 CC1=C(C)C=C(O)C=C1 HR154713 [0,2,0,0,0,0|0,1,0]=3 1702 B9R1.69 CC1=C(C)C=C(S)C=C1 HR144805 [0,2,0,0,0,0|0,0,0]=2 1703 B9R1.69 CC1=C(C)N=C(N)C=C1 HR139308 [0,2,0,0,0,0|2,0,0]=4 1704 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 HR128281 [0,2,0,0,0,0|1,0,0]=3 1705 B9R1.69 CC1=C(Cl)C=C(F)C=C1 HR1605 [0,2,0,0,0,0|1,0,0]=3 1706 B9R1.69 CC1=C(Cl)C=C(I)C=C1 HR132507 [0,2,0,0,0,0|1,0,0]=3 1707 B9R1.69 CC1=C(Cl)C=C(N)C=C1 HR133155 [0,2,0,0,0,0|1,0,0]=3 1708 B9R1.69 CC1=C(Cl)C=C(O)C=C1 HR107695 [0,2,0,0,0,0|0,1,0]=3 1709 B9R1.69 CC1=C(Cl)C=C(O)C=N1 HR33361 [0,2,0,0,0,0|1,1,0]=4 1710 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 HR135484 [0,2,0,0,0,0|1,0,0]=3 1711 B9R1.69 CC1=C(Cl)C=CC(F)=C1 HR133427 [0,2,0,0,0,0|1,0,0]=3 1712 B9R1.69 CC1=C(Cl)C=CC(I)=C1 HR3653 [0,2,0,0,0,0|1,0,0]=3 1713 B9R1.69 CC1=C(Cl)C=CC(N)=C1 HR130079 [0,2,0,0,0,0|1,0,0]=3 1714 B9R1.69 CC1=C(Cl)C=CC(N)=N1 HR100468 [0,2,0,0,0,0|2,0,0]=4 1715 B9R1.69 CC1=C(Cl)C=C[N+]([O-])=C1 HR116334 [0,2,0,0,0,0|1,1,0]=4 1716 B9R1.69 CC1=C(Cl)N=C(N)C=C1 HR145128 [0,2,0,0,0,0|2,0,0]=4 1717 B9R1.69 CC1=C(Cl)N=CC(N)=C1 HR146752 [0,2,0,0,0,0|2,0,0]=4 1718 B9R1.69 CC1=C(Cl)N=CC(O)=C1 HR118788 [0,2,0,0,0,0|1,1,0]=4 1719 B9R1.69 CC1=C(F)C=C(Br)C=C1 HR130704 [0,2,0,0,0,0|1,0,0]=3 1720 B9R1.69 CC1=C(F)C=C(Cl)C=C1 HR123332 [0,2,0,0,0,0|1,0,0]=3 1721 B9R1.69 CC1=C(F)C=C(F)C=C1 HR129054 [0,2,0,0,0,0|1,0,0]=3 1722 B9R1.69 CC1=C(F)C=C(I)C=C1 HR133593 [0,2,0,0,0,0|1,0,0]=3 1723 B9R1.69 CC1=C(F)C=C(N)C=C1 HR1509 [0,2,0,0,0,0|1,0,0]=3 1724 B9R1.69 CC1=C(F)C=C(O)C=C1 HR123808 [0,2,0,0,0,0|0,1,0]=3 1725 B9R1.69 CC1=C(F)C=C(S)C=C1 HR139397 [0,2,0,0,0,0|0,0,0]=2 1726 B9R1.69 CC1=C(F)C=CC(Br)=C1 HR126063 [0,2,0,0,0,0|1,0,0]=3 1727 B9R1.69 CC1=C(F)C=CC(Br)=N1 HR1135 [0,2,0,0,0,0|2,0,0]=4 1728 B9R1.69 CC1=C(F)C=CC(Cl)=C1 HR125548 [0,2,0,0,0,0|1,0,0]=3 1729 B9R1.69 CC1=C(F)C=CC(Cl)=N1 HR6219 [0,2,0,0,0,0|2,0,0]=4 1730 B9R1.69 CC1=C(F)C=CC(F)=C1 HR129314 [0,2,0,0,0,0|1,0,0]=3 1731 B9R1.69 CC1=C(F)C=CC(I)=C1 HR135435 [0,2,0,0,0,0|1,0,0]=3 1732 B9R1.69 CC1=C(F)C=CC(N)=C1 HR1513 [0,2,0,0,0,0|1,0,0]=3 1733 B9R1.69 CC1=C(F)C=CC(N)=N1 HR144158 [0,2,0,0,0,0|2,0,0]=4 1734 B9R1.69 CC1=C(F)C=CC(O)=C1 HR123540 [0,2,0,0,0,0|0,1,0]=3 1735 B9R1.69 CC1=C(F)N=CC(N)=C1 HR130139 [0,2,0,0,0,0|2,0,0]=4 1736 B9R1.69 CC1=C(I)C=C(Br)C=C1 HR153734 [0,2,0,0,0,0|1,0,0]=3 1737 B9R1.69 CC1=C(I)C=C(Cl)C=C1 HR120686 [0,2,0,0,0,0|1,0,0]=3 1738 B9R1.69 CC1=C(I)C=C(F)C=C1 HR125570 [0,2,0,0,0,0|1,0,0]=3 1739 B9R1.69 CC1=C(I)C=C(N)C=C1 HR114542 [0,2,0,0,0,0|1,0,0]=3 1740 B9R1.69 CC1=C(I)C=C(O)C=C1 HR153876 [0,2,0,0,0,0|0,1,0]=3 1741 B9R1.69 CC1=C(I)C=CC(Br)=C1 HR141239 [0,2,0,0,0,0|1,0,0]=3 1742 B9R1.69 CC1=C(I)C=CC(Cl)=C1 HR139304 [0,2,0,0,0,0|1,0,0]=3 1743 B9R1.69 CC1=C(I)C=CC(F)=C1 HR102145 [0,2,0,0,0,0|1,0,0]=3 1744 B9R1.69 CC1=C(I)C=CC(F)=C1 HR114752 [0,2,0,0,0,0|1,0,0]=3 1745 B9R1.69 CC1=C(I)C=CC(O)=C1 HR147441 [0,2,0,0,0,0|0,1,0]=3 1746 B9R1.69 CC1=C(N)C=C(Br)C=C1 HR138432 [0,2,0,0,0,0|1,0,0]=3 1747 B9R1.69 CC1=C(N)C=C(F)C=C1 HR130357 [0,2,0,0,0,0|1,0,0]=3 1748 B9R1.69 CC1=C(N)C=C(I)C=C1 HR134930 [0,2,0,0,0,0|1,0,0]=3 1749 B9R1.69 CC1=C(N)C=C(O)C=C1 HR139454 [0,2,0,0,0,0|0,1,0]=3 1750 B9R1.69 CC1=C(N)C=CC(Br)=C1 HR122139 [0,2,0,0,0,0|1,0,0]=3 1751 B9R1.69 CC1=C(N)C=CC(Br)=N1 HR137508 [0,2,0,0,0,0|2,0,0]=4 1752 B9R1.69 CC1=C(N)C=CC(Cl)=C1 HR132644 [0,2,0,0,0,0|1,0,0]=3 1753 B9R1.69 CC1=C(N)C=CC(F)=C1 HR131690 [0,2,0,0,0,0|1,0,0]=3 1754 B9R1.69 CC1=C(N)C=CC(F)=N1 HR132770 [0,2,0,0,0,0|2,0,0]=4 1755 B9R1.69 CC1=C(N)C=CC(I)=C1 HR105853 [0,2,0,0,0,0|1,0,0]=3 1756 B9R1.69 CC1=C(N)C=NC(Cl)=C1 HR133110 [0,2,0,0,0,0|2,0,0]=4 1757 B9R1.69 CC1=C(N)C=NC(F)=C1 HR17516 [0,2,0,0,0,0|2,0,0]=4 1758 B9R1.69 CC1=C(O)C=C(Br)C=C1 HR4132 [0,2,0,0,0,0|0,1,0]=3 1759 B9R1.69 CC1=C(O)C=C(Cl)C=C1 HR143829 [0,2,0,0,0,0|0,1,0]=3 1760 B9R1.69 CC1=C(O)C=C(F)C=C1 HR30155 [0,2,0,0,0,0|0,1,0]=3 1761 B9R1.69 CC1=C(O)C=C(I)C=C1 HR154066 [0,2,0,0,0,0|0,1,0]=3 1762 B9R1.69 CC1=C(O)C=C(O)C=C1 HR31937 [0,2,0,0,0,0|0,1,0]=3 1763 B9R1.69 CC1=C(O)C=CC(Br)=C1 HR7106 [0,2,0,0,0,0|0,1,0]=3 1764 B9R1.69 CC1=C(O)C=CC(Cl)=C1 HR137146 [0,2,0,0,0,0|0,1,0]=3 1765 B9R1.69 CC1=C(O)C=CC(F)=C1 HR123040 [0,2,0,0,0,0|0,1,0]=3 1766 B9R1.69 CC1=C(O)C=CC(N)=C1 HR133687 [0,2,0,0,0,0|0,1,0]=3 1767 B9R1.69 CC1=C(O)C=CC(O)=C1 HR100450 [0,2,0,0,0,0|0,1,0]=3 1768 B9R1.69 CC1=C(O)C=NC(Br)=C1 HR153143 [0,2,0,0,0,0|1,1,0]=4 1769 B9R1.69 CC1=C(S)C=C(Cl)C=C1 HR140266 [0,2,0,0,0,0|0,0,0]=2 1770 B9R1.69 CC1=C(S)C=CC(F)=C1 HR141571 [0,2,0,0,0,0|0,0,0]=2 1771 B9R1.69 CC1=CC(=O)C=CC1=O HR138433 [0,2,0,0,0,0|0,1,0]=3 1772 B9R1.69 CC1=CC(=O)NC=C1Br HR122796 [0,2,0,0,0,0|1,1,0]=4 1773 B9R1.69 CC1=CC(Br)=C(Br)C=C1 HR114393 [0,2,0,0,0,0|1,0,0]=3 1774 B9R1.69 CC1=CC(Br)=C(C)C=C1 HR108754 [0,2,0,0,0,0|1,0,0]=3 1775 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 HR123229 [0,2,0,0,0,0|1,0,0]=3 1776 B9R1.69 CC1=CC(Br)=C(F)C=C1 HR1600 [0,2,0,0,0,0|1,0,0]=3 1777 B9R1.69 CC1=CC(Br)=C(I)C=C1 HR154163 [0,2,0,0,0,0|1,0,0]=3 1778 B9R1.69 CC1=CC(Br)=C(N)C=C1 HR124218 [0,2,0,0,0,0|1,0,0]=3 1779 B9R1.69 CC1=CC(Br)=C(N)C=N1 HR115425 [0,2,0,0,0,0|2,0,0]=4 1780 B9R1.69 CC1=CC(Br)=C(O)C=C1 HR136243 [0,2,0,0,0,0|0,1,0]=3 1781 B9R1.69 CC1=CC(Br)=CN=C1Br HR1138 [0,2,0,0,0,0|2,0,0]=4 1782 B9R1.69 CC1=CC(Br)=CN=C1C HR112373 [0,2,0,0,0,0|2,0,0]=4 1783 B9R1.69 CC1=CC(Br)=CN=C1Cl HR128272 [0,2,0,0,0,0|2,0,0]=4 1784 B9R1.69 CC1=CC(Br)=CN=C1F HR1136 [0,2,0,0,0,0|2,0,0]=4 1785 B9R1.69 CC1=CC(Br)=CN=C1I HR104088 [0,2,0,0,0,0|2,0,0]=4 1786 B9R1.69 CC1=CC(Br)=CN=C1N HR1236 [0,2,0,0,0,0|2,0,0]=4 1787 B9R1.69 CC1=CC(Br)=CN=C1N HR156700 [0,2,0,0,0,0|2,0,0]=4 1788 B9R1.69 CC1=CC(Br)=CN=C1O HR6562 [0,2,0,0,0,0|1,1,0]=4 1789 B9R1.69 CC1=CC(Br)=NC=C1Br HR127999 [0,2,0,0,0,0|2,0,0]=4 1790 B9R1.69 CC1=CC(Br)=NC=C1Cl HR152545 [0,2,0,0,0,0|2,0,0]=4 1791 B9R1.69 CC1=CC(Br)=NC=C1I HR153016 [0,2,0,0,0,0|2,0,0]=4 1792 B9R1.69 CC1=CC(Br)=NC=C1N HR5960 [0,2,0,0,0,0|2,0,0]=4 1793 B9R1.69 CC1=CC(C)=C(Br)C=C1 SPXF01306 [0,2,0,0,0,0|1,0,0]=3 1794 B9R1.69 CC1=CC(C)=C(I)C=C1 HR109163 [0,2,0,0,0,0|1,0,0]=3 1795 B9R1.69 CC1=CC(C)=C(N)C=C1 HR147082 [0,2,0,0,0,0|1,0,0]=3 1796 B9R1.69 CC1=CC(C)=C(S)C=C1 HR34171 [0,2,0,0,0,0|0,0,0]=2 1797 B9R1.69 CC1=CC(C)=NC=C1N HR113965 [0,2,0,0,0,0|2,0,0]=4 1798 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 HR122455 [0,2,0,0,0,0|1,0,0]=3 1799 B9R1.69 CC1=CC(Cl)=C(C)C=C1 HR100328 [0,2,0,0,0,0|1,0,0]=3 1800 B9R1.69 CC1=CC(Cl)=C(Cl)C=C1 HR147323 [0,2,0,0,0,0|1,0,0]=3 1801 B9R1.69 CC1=CC(Cl)=C(F)C=C1 HR131984 [0,2,0,0,0,0|1,0,0]=3 1802 B9R1.69 CC1=CC(Cl)=C(I)C=C1 HR139398 [0,2,0,0,0,0|1,0,0]=3 1803 B9R1.69 CC1=CC(Cl)=C(N)C=C1 HR2472 [0,2,0,0,0,0|1,0,0]=3 1804 B9R1.69 CC1=CC(Cl)=C(O)C=C1 HR31963 [0,2,0,0,0,0|0,1,0]=3 1805 B9R1.69 CC1=CC(Cl)=CN=C1Br HR128837 [0,2,0,0,0,0|2,0,0]=4 1806 B9R1.69 CC1=CC(Cl)=CN=C1Cl HR15129 [0,2,0,0,0,0|2,0,0]=4 1807 B9R1.69 CC1=CC(Cl)=CN=C1F HR123011 [0,2,0,0,0,0|2,0,0]=4 1808 B9R1.69 CC1=CC(Cl)=CN=C1N HR111151 [0,2,0,0,0,0|2,0,0]=4 1809 B9R1.69 CC1=CC(Cl)=CN=C1O HR9824 [0,2,0,0,0,0|1,1,0]=4 1810 B9R1.69 CC1=CC(Cl)=NC=C1Br HR107535 [0,2,0,0,0,0|2,0,0]=4 1811 B9R1.69 CC1=CC(Cl)=NC=C1Cl HR15130 [0,2,0,0,0,0|2,0,0]=4 1812 B9R1.69 CC1=CC(Cl)=NC=C1F HR10460 [0,2,0,0,0,0|2,0,0]=4 1813 B9R1.69 CC1=CC(Cl)=NC=C1I HR107214 [0,2,0,0,0,0|2,0,0]=4 1814 B9R1.69 CC1=CC(Cl)=NC=C1O HR152637 [0,2,0,0,0,0|1,1,0]=4 1815 B9R1.69 CC1=CC(F)=C(Br)C=C1 HR1604 [0,2,0,0,0,0|1,0,0]=3 1816 B9R1.69 CC1=CC(F)=C(Cl)C=C1 HR131457 [0,2,0,0,0,0|1,0,0]=3 1817 B9R1.69 CC1=CC(F)=C(F)C=C1 HR1615 [0,2,0,0,0,0|1,0,0]=3 1818 B9R1.69 CC1=CC(F)=C(I)C=C1 HR113664 [0,2,0,0,0,0|1,0,0]=3 1819 B9R1.69 CC1=CC(F)=C(N)C=C1 HR127329 [0,2,0,0,0,0|1,0,0]=3 1820 B9R1.69 CC1=CC(F)=C(O)C=C1 HR153448 [0,2,0,0,0,0|0,1,0]=3 1821 B9R1.69 CC1=CC(F)=CN=C1Br HR5965 [0,2,0,0,0,0|2,0,0]=4 1822 B9R1.69 CC1=CC(F)=CN=C1Cl HR6220 [0,2,0,0,0,0|2,0,0]=4 1823 B9R1.69 CC1=CC(F)=CN=C1N HR144256 [0,2,0,0,0,0|2,0,0]=4 1824 B9R1.69 CC1=CC(F)=NC=C1Br HR3547 [0,2,0,0,0,0|2,0,0]=4 1825 B9R1.69 CC1=CC(F)=NC=C1Cl HR110294 [0,2,0,0,0,0|2,0,0]=4 1826 B9R1.69 CC1=CC(F)=NC=C1I HR152603 [0,2,0,0,0,0|2,0,0]=4 1827 B9R1.69 CC1=CC(F)=NC=C1O HR152604 [0,2,0,0,0,0|1,1,0]=4 1828 B9R1.69 CC1=CC(I)=C(Br)C=C1 HR153893 [0,2,0,0,0,0|1,0,0]=3 1829 B9R1.69 CC1=CC(I)=C(Cl)C=C1 HR154049 [0,2,0,0,0,0|1,0,0]=3 1830 B9R1.69 CC1=CC(I)=C(F)C=C1 HR113344 [0,2,0,0,0,0|1,0,0]=3 1831 B9R1.69 CC1=CC(I)=C(N)C=C1 HR5353 [0,2,0,0,0,0|1,0,0]=3 1832 B9R1.69 CC1=CC(I)=CN=C1Br HR109835 [0,2,0,0,0,0|2,0,0]=4 1833 B9R1.69 CC1=CC(I)=CN=C1Cl HR108889 [0,2,0,0,0,0|2,0,0]=4 1834 B9R1.69 CC1=CC(I)=CN=C1F HR152539 [0,2,0,0,0,0|2,0,0]=4 1835 B9R1.69 CC1=CC(I)=CN=C1N HR130662 [0,2,0,0,0,0|2,0,0]=4 1836 B9R1.69 CC1=CC(I)=NC=C1Br HR152930 [0,2,0,0,0,0|2,0,0]=4 1837 B9R1.69 CC1=CC(N)=C(Br)C=C1 HR4337 [0,2,0,0,0,0|1,0,0]=3 1838 B9R1.69 CC1=CC(N)=C(Cl)C=C1 HR134667 [0,2,0,0,0,0|1,0,0]=3 1839 B9R1.69 CC1=CC(N)=C(F)C=C1 HR123516 [0,2,0,0,0,0|1,0,0]=3 1840 B9R1.69 CC1=CC(N)=C(I)C=C1 HR20232 [0,2,0,0,0,0|1,0,0]=3 1841 B9R1.69 CC1=CC(N)=C(N)C=C1 HR131785 [0,2,0,0,0,0|1,0,0]=3 1842 B9R1.69 CC1=CC(N)=C(N)C=N1 HR110161 [0,2,0,0,0,0|2,0,0]=4 1843 B9R1.69 CC1=CC(N)=C(O)C=C1 HR135753 [0,2,0,0,0,0|0,1,0]=3 1844 B9R1.69 CC1=CC(N)=CN=C1Br HR137503 [0,2,0,0,0,0|2,0,0]=4 1845 B9R1.69 CC1=CC(N)=NC=C1Br HR2241 [0,2,0,0,0,0|2,0,0]=4 1846 B9R1.69 CC1=CC(N)=NC=C1Cl HR5717 [0,2,0,0,0,0|2,0,0]=4 1847 B9R1.69 CC1=CC(N)=NC=C1F HR131192 [0,2,0,0,0,0|2,0,0]=4 1848 B9R1.69 CC1=CC(N)=NC=C1I HR112051 [0,2,0,0,0,0|2,0,0]=4 1849 B9R1.69 CC1=CC(O)=C(Br)C=C1 HR153447 [0,2,0,0,0,0|0,1,0]=3 1850 B9R1.69 CC1=CC(O)=C(C)C=C1 HR147008 [0,2,0,0,0,0|0,1,0]=3 1851 B9R1.69 CC1=CC(O)=C(F)C=C1 HR31579 [0,2,0,0,0,0|0,1,0]=3 1852 B9R1.69 CC1=CC(O)=C(N)C=C1 HR127266 [0,2,0,0,0,0|0,1,0]=3 1853 B9R1.69 CC1=CC(O)=CC=C1N HR130163 [0,2,0,0,0,0|0,1,0]=3 1854 B9R1.69 CC1=CC(O)=CN=C1F HR6320 [0,2,0,0,0,0|1,1,0]=4 1855 B9R1.69 CC1=CC(S)=C(C)C=C1 HR136062 [0,2,0,0,0,0|0,0,0]=2 1856 B9R1.69 CC1=CC(S)=C(N)C=C1 HR111845 [0,2,0,0,0,0|0,0,0]=2 1857 B9R1.69 CC1=CC=C(Br)C(C)=N1 HR129847 [0,2,0,0,0,0|2,0,0]=4 1858 B9R1.69 CC1=CC=C(Br)C(Cl)=N1 HR1286 [0,2,0,0,0,0|2,0,0]=4 1859 B9R1.69 CC1=CC=C(Br)C(F)=N1 HR6256 [0,2,0,0,0,0|2,0,0]=4 1860 B9R1.69 CC1=CC=C(Br)C(N)=N1 HR132509 [0,2,0,0,0,0|2,0,0]=4 1861 B9R1.69 CC1=CC=C(Br)C(O)=N1 HR33570 [0,2,0,0,0,0|1,1,0]=4 1862 B9R1.69 CC1=CC=C(Br)N=C1N HR33718 [0,2,0,0,0,0|2,0,0]=4 1863 B9R1.69 CC1=CC=C(C)C(N)=N1 HR111739 [0,2,0,0,0,0|2,0,0]=4 1864 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 HR118142 [0,2,0,0,0,0|2,0,0]=4 1865 B9R1.69 CC1=CC=C(Cl)N=C1Cl HR105715 [0,2,0,0,0,0|2,0,0]=4 1866 B9R1.69 CC1=CC=C(F)C(Br)=N1 HR123856 [0,2,0,0,0,0|2,0,0]=4 1867 B9R1.69 CC1=CC=C(F)C(Cl)=N1 HR131463 [0,2,0,0,0,0|2,0,0]=4 1868 B9R1.69 CC1=CC=C(F)N=C1C HR152686 [0,2,0,0,0,0|2,0,0]=4 1869 B9R1.69 CC1=CC=C(I)C(N)=N1 HR143963 [0,2,0,0,0,0|2,0,0]=4 1870 B9R1.69 CC1=CC=C(N)C(Br)=N1 HR138047 [0,2,0,0,0,0|2,0,0]=4 1871 B9R1.69 CC1=CC=C(N)C(C)=N1 HR142085 [0,2,0,0,0,0|2,0,0]=4 1872 B9R1.69 CC1=CC=C(N)C(Cl)=N1 HR1245 [0,2,0,0,0,0|2,0,0]=4 1873 B9R1.69 CC1=CC=C(N)C(F)=N1 HR123255 [0,2,0,0,0,0|2,0,0]=4 1874 B9R1.69 CC1=CC=C(N)C(N)=N1 HR102375 [0,2,0,0,0,0|2,0,0]=4 1875 B9R1.69 CC1=CC=C(N)C=C1O HR123833 [0,2,0,0,0,0|0,1,0]=3 1876 B9R1.69 CC1=CC=C(O)C(Br)=N1 HR109939 [0,2,0,0,0,0|1,1,0]=4 1877 B9R1.69 CC1=CC=C(O)C(C)=N1 HR129321 [0,2,0,0,0,0|1,1,0]=4 1878 B9R1.69 CC1=CC=C(O)C(F)=N1 HR105544 [0,2,0,0,0,0|1,1,0]=4 1879 B9R1.69 CC1=CC=C(O)C(I)=N1 HR145101 [0,2,0,0,0,0|1,1,0]=4 1880 B9R1.69 CC1=CC=C(O)C(N)=N1 HR33373 [0,2,0,0,0,0|1,1,0]=4 1881 B9R1.69 CC1=CC=C(O)C(O)=C1 HR127858 [0,2,0,0,0,0|0,1,0]=3 1882 B9R1.69 CC1=CN=C(Br)C(Br)=C1 HR5399 [0,2,0,0,0,0|2,0,0]=4 1883 B9R1.69 CC1=CN=C(Br)C(C)=C1 HR16831 [0,2,0,0,0,0|2,0,0]=4 1884 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 HR113215 [0,2,0,0,0,0|2,0,0]=4 1885 B9R1.69 CC1=CN=C(Br)C(F)=C1 HR21377 [0,2,0,0,0,0|2,0,0]=4 1886 B9R1.69 CC1=CN=C(Br)C(I)=C1 HR110472 [0,2,0,0,0,0|2,0,0]=4 1887 B9R1.69 CC1=CN=C(Br)C(N)=C1 HR110273 [0,2,0,0,0,0|2,0,0]=4 1888 B9R1.69 CC1=CN=C(Br)C(O)=C1 HR146453 [0,2,0,0,0,0|1,1,0]=4 1889 B9R1.69 CC1=CN=C(C)C(Br)=C1 HR119302 [0,2,0,0,0,0|2,0,0]=4 1890 B9R1.69 CC1=CN=C(C)C(C)=C1 HR15901 [0,2,0,0,0,0|2,0,0]=4 1891 B9R1.69 CC1=CN=C(Cl)C(Br)=C1 HR129874 [0,2,0,0,0,0|2,0,0]=4 1892 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 HR135166 [0,2,0,0,0,0|2,0,0]=4 1893 B9R1.69 CC1=CN=C(Cl)C(F)=C1 HR14231 [0,2,0,0,0,0|2,0,0]=4 1894 B9R1.69 CC1=CN=C(Cl)C(N)=C1 HR1152 [0,2,0,0,0,0|2,0,0]=4 1895 B9R1.69 CC1=CN=C(Cl)C(O)=C1 HR6141 [0,2,0,0,0,0|1,1,0]=4 1896 B9R1.69 CC1=CN=C(Cl)C=C1Br HR148462 [0,2,0,0,0,0|2,0,0]=4 1897 B9R1.69 CC1=CN=C(Cl)C=C1Cl HR145032 [0,2,0,0,0,0|2,0,0]=4 1898 B9R1.69 CC1=CN=C(Cl)C=C1N HR110179 [0,2,0,0,0,0|2,0,0]=4 1899 B9R1.69 CC1=CN=C(F)C(Br)=C1 HR127769 [0,2,0,0,0,0|2,0,0]=4 1900 B9R1.69 CC1=CN=C(F)C(C)=C1 HR152586 [0,2,0,0,0,0|2,0,0]=4 1901 B9R1.69 CC1=CN=C(F)C(I)=C1 HR1304 [0,2,0,0,0,0|2,0,0]=4 1902 B9R1.69 CC1=CN=C(F)C(N)=C1 HR103840 [0,2,0,0,0,0|2,0,0]=4 1903 B9R1.69 CC1=CN=C(F)C(O)=C1 HR152598 [0,2,0,0,0,0|1,1,0]=4 1904 B9R1.69 CC1=CN=C(F)C=C1Br HR152648 [0,2,0,0,0,0|2,0,0]=4 1905 B9R1.69 CC1=CN=C(F)C=C1C HR152649 [0,2,0,0,0,0|2,0,0]=4 1906 B9R1.69 CC1=CN=C(F)C=C1I HR1305 [0,2,0,0,0,0|2,0,0]=4 1907 B9R1.69 CC1=CN=C(N)C(Br)=C1 HR2240 [0,2,0,0,0,0|2,0,0]=4 1908 B9R1.69 CC1=CN=C(N)C(Cl)=C1 HR109635 [0,2,0,0,0,0|2,0,0]=4 1909 B9R1.69 CC1=CN=C(N)C(N)=C1 HR120555 [0,2,0,0,0,0|2,0,0]=4 1910 B9R1.69 CC1=CN=C(O)C(Br)=C1 HR142600 [0,2,0,0,0,0|1,1,0]=4 1911 B9R1.69 CC1=CN=C(O)C(N)=C1 HR6518 [0,2,0,0,0,0|1,1,0]=4 1912 B9R1.69 CC1=CN=C(O)C=C1N FIJL00504 [0,2,0,0,0,0|1,1,0]=4 1913 B9R1.69 CC1=CNC(=O)C=C1I HR155271 [0,2,0,0,0,0|1,1,0]=4 1914 B9R1.69 CC1=NC(Br)=CC=C1Br HR3580 [0,2,0,0,0,0|2,0,0]=4 1915 B9R1.69 CC1=NC(Cl)=CC=C1Br HR114169 [0,2,0,0,0,0|2,0,0]=4 1916 B9R1.69 CC1=NC(Cl)=CC=C1I HR108573 [0,2,0,0,0,0|2,0,0]=4 1917 B9R1.69 CC1=NC(Cl)=CC=C1N HR1246 [0,2,0,0,0,0|2,0,0]=4 1918 B9R1.69 CC1=NC(Cl)=CC=C1O HR152955 [0,2,0,0,0,0|1,1,0]=4 1919 B9R1.69 CC1=NC(F)=CC=C1Br HR127494 [0,2,0,0,0,0|2,0,0]=4 1920 B9R1.69 CC1=NC(F)=CC=C1I HR105022 [0,2,0,0,0,0|2,0,0]=4 1921 B9R1.69 CC1=NC(F)=CC=C1O HR152684 [0,2,0,0,0,0|1,1,0]=4 1922 B9R1.69 CC1=NC(I)=CC=C1Br HR153026 [0,2,0,0,0,0|2,0,0]=4 1923 B9R1.69 CC1=NC(N)=CC=C1I HR103716 [0,2,0,0,0,0|2,0,0]=4 1924 B9R1.69 CC1=NC(O)=CC=C1Br HR142500 [0,2,0,0,0,0|1,1,0]=4 1925 B9R1.69 CC1=NC=C(Br)C(Cl)=C1 HR146454 [0,2,0,0,0,0|2,0,0]=4 1926 B9R1.69 CC1=NC=C(Br)C=C1Br HR16457 [0,2,0,0,0,0|2,0,0]=4 1927 B9R1.69 CC1=NC=C(Br)C=C1Cl HR30322 [0,2,0,0,0,0|2,0,0]=4 1928 B9R1.69 CC1=NC=C(Br)C=C1N HR17523 [0,2,0,0,0,0|2,0,0]=4 1929 B9R1.69 CC1=NC=C(Br)C=C1O HR148745 [0,2,0,0,0,0|1,1,0]=4 1930 B9R1.69 CC1=NC=C(Cl)C(Cl)=C1 HR108892 [0,2,0,0,0,0|2,0,0]=4 1931 B9R1.69 CC1=NC=C(F)C(Cl)=C1 HR107312 [0,2,0,0,0,0|2,0,0]=4 1932 B9R1.69 CC1=NC=C(O)C=C1Br HR6702 [0,2,0,0,0,0|1,1,0]=4 1933 B9R1.69 CC1=[N+]([O-])C=C(Br)C=C1 HR142412 [0,2,0,0,0,0|1,1,0]=4 1934 B9R1.69 CN1C=C(Br)C=CC1=O HR32382 [0,2,0,0,0,0|1,1,0]=4 1935 B9R1.69 CN1C=C(F)C=CC1=O HR104598 [0,2,0,0,0,0|1,1,0]=4 1936 B9R1.69 CN1C=C(N)C=CC1=O HR31910 [0,2,0,0,0,0|1,1,0]=4 1937 B9R1.69 CN1C=CC(Br)=CC1=O HR32270 [0,2,0,0,0,0|1,1,0]=4 1938 B9R1.69 CN1C=CC(I)=CC1=O HR31946 [0,2,0,0,0,0|1,1,0]=4 1939 B9R1.69 CN1C=CC(N)=CC1=O HR111197 [0,2,0,0,0,0|1,1,0]=4 1940 B9R1.69 Cc1cc(S)ccc1O HR129040 [0,2,0,0,0,0|0,0,0]=2 1941 B9R1.69 Cc1ccc(N)c(C)c1 HR101309 [0,2,0,0,0,0|1,0,0]=3 1942 B9R1.69 Cc1ccc(N)c(N)c1 HR142499 [0,2,0,0,0,0|1,0,0]=3 1943 B9R1.69 Cc1nc(Br)ccc1O HR152628 [0,2,0,0,0,0|1,1,0]=4 1944 B9R1.69 ClC1=C(Br)C=C(I)C=C1 HR154176 [0,2,0,0,0,0|1,0,0]=3 1945 B9R1.69 ClC1=C(Br)C=CC(Br)=C1 HR143768 [0,2,0,0,0,0|1,0,0]=3 1946 B9R1.69 ClC1=C(Br)C=CC(I)=C1 HR16805 [0,2,0,0,0,0|1,0,0]=3 1947 B9R1.69 ClC1=C(Cl)C=C(Br)C=C1 HR130882 [0,2,0,0,0,0|1,0,0]=3 1948 B9R1.69 ClC1=C(Cl)C=C(I)C=C1 HR120535 [0,2,0,0,0,0|1,0,0]=3 1949 B9R1.69 ClC1=C(I)C=CC(Br)=C1 HR142797 [0,2,0,0,0,0|1,0,0]=3 1950 B9R1.69 ClC1=CC(Br)=C(Cl)C=C1 HR126908 [0,2,0,0,0,0|1,0,0]=3 1951 B9R1.69 ClC1=CC(Br)=C(I)C=C1 HR147265 [0,2,0,0,0,0|1,0,0]=3 1952 B9R1.69 ClC1=CC(Br)=CN=C1Br HR17521 [0,2,0,0,0,0|2,0,0]=4 1953 B9R1.69 ClC1=CC(Br)=CN=C1Cl HR1174 [0,2,0,0,0,0|2,0,0]=4 1954 B9R1.69 ClC1=CC(Cl)=C(Br)C=C1 HR129308 [0,2,0,0,0,0|1,0,0]=3 1955 B9R1.69 ClC1=CC(Cl)=C(I)C=C1 HR142290 [0,2,0,0,0,0|1,0,0]=3 1956 B9R1.69 ClC1=CC(Cl)=NC=C1Br HR109106 [0,2,0,0,0,0|2,0,0]=4 1957 B9R1.69 ClC1=CC(Cl)=NC=C1I HR108798 [0,2,0,0,0,0|2,0,0]=4 1958 B9R1.69 ClC1=CC(I)=C(Br)C=C1 HR153732 [0,2,0,0,0,0|1,0,0]=3 1959 B9R1.69 ClC1=CC(I)=C(Cl)C=C1 HR141999 [0,2,0,0,0,0|1,0,0]=3 1960 B9R1.69 ClC1=CC(I)=CN=C1Cl HR31853 [0,2,0,0,0,0|2,0,0]=4 1961 B9R1.69 ClC1=CC=C(Br)C(Br)=N1 HR33835 [0,2,0,0,0,0|2,0,0]=4 1962 B9R1.69 ClC1=CC=C(Br)C(Cl)=N1 HR15140 [0,2,0,0,0,0|2,0,0]=4 1963 B9R1.69 ClC1=CC=C(Br)N=C1Cl HR153033 [0,2,0,0,0,0|2,0,0]=4 1964 B9R1.69 ClC1=CC=C(Cl)C(Cl)=N1 HR124627 [0,2,0,0,0,0|2,0,0]=4 1965 B9R1.69 ClC1=CC=C(Cl)C(Cl)=N1 HR9782 [0,2,0,0,0,0|2,0,0]=4 1966 B9R1.69 ClC1=CC=C(I)C(Cl)=N1 HR133025 [0,2,0,0,0,0|2,0,0]=4 1967 B9R1.69 ClC1=CN=C(Br)C(Br)=C1 HR109742 [0,2,0,0,0,0|2,0,0]=4 1968 B9R1.69 ClC1=CN=C(Br)C(Cl)=C1 HR10223 [0,2,0,0,0,0|2,0,0]=4 1969 B9R1.69 ClC1=CN=C(Br)C(I)=C1 HR153103 [0,2,0,0,0,0|2,0,0]=4 1970 B9R1.69 ClC1=CN=C(Br)C=C1I HR152534 [0,2,0,0,0,0|2,0,0]=4 1971 B9R1.69 ClC1=CN=C(Cl)C(Br)=C1 HR30053 [0,2,0,0,0,0|2,0,0]=4 1972 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 HR123303 [0,2,0,0,0,0|2,0,0]=4 1973 B9R1.69 ClC1=CN=C(Cl)C=C1Br HR113850 [0,2,0,0,0,0|2,0,0]=4 1974 B9R1.69 ClC1=CN=C(Cl)C=C1I HR108480 [0,2,0,0,0,0|2,0,0]=4 1975 B9R1.69 ClC1=NC(Br)=CC=C1Br HR153032 [0,2,0,0,0,0|2,0,0]=4 1976 B9R1.69 ClC1=NC(Br)=CC=C1I HR148474 [0,2,0,0,0,0|2,0,0]=4 1977 B9R1.69 ClC1=NC=C(Br)C(I)=C1 HR117741 [0,2,0,0,0,0|2,0,0]=4 1978 B9R1.69 ClC1=NC=C(Br)C=C1Br HR6101 [0,2,0,0,0,0|2,0,0]=4 1979 B9R1.69 ClC1=NC=C(Br)C=C1I HR152533 [0,2,0,0,0,0|2,0,0]=4 1980 B9R1.69 ClC1=NC=C(I)C=C1I HR109516 [0,2,0,0,0,0|2,0,0]=4 1981 B9R1.69 Clc1ccc(Br)c(Br)c1 HR154832 [0,2,0,0,0,0|1,0,0]=3 1982 B9R1.69 FC1=C(Br)C=C(Br)C=C1 HR3446 [0,2,0,0,0,0|1,0,0]=3 1983 B9R1.69 FC1=C(Br)C=C(Cl)C=C1 HR3210 [0,2,0,0,0,0|1,0,0]=3 1984 B9R1.69 FC1=C(Br)C=C(I)C=C1 HR103459 [0,2,0,0,0,0|1,0,0]=3 1985 B9R1.69 FC1=C(Br)C=CC(Br)=C1 HR143574 [0,2,0,0,0,0|1,0,0]=3 1986 B9R1.69 FC1=C(Br)C=CC(Cl)=C1 HR132783 [0,2,0,0,0,0|1,0,0]=3 1987 B9R1.69 FC1=C(Br)C=CC(I)=C1 HR103664 [0,2,0,0,0,0|1,0,0]=3 1988 B9R1.69 FC1=C(Cl)C=C(Br)C=C1 HR146979 [0,2,0,0,0,0|1,0,0]=3 1989 B9R1.69 FC1=C(Cl)C=C(Cl)C=C1 HR134995 [0,2,0,0,0,0|1,0,0]=3 1990 B9R1.69 FC1=C(Cl)C=C(S)C=C1 HR2857 [0,2,0,0,0,0|0,0,0]=2 1991 B9R1.69 FC1=C(Cl)C=CC(Br)=C1 HR146978 [0,2,0,0,0,0|1,0,0]=3 1992 B9R1.69 FC1=C(Cl)C=CC(Cl)=C1 HR116638 [0,2,0,0,0,0|1,0,0]=3 1993 B9R1.69 FC1=C(Cl)C=CC(I)=C1 HR110844 [0,2,0,0,0,0|1,0,0]=3 1994 B9R1.69 FC1=C(F)C=C(Br)C=C1 HR128375 [0,2,0,0,0,0|1,0,0]=3 1995 B9R1.69 FC1=C(F)C=C(Cl)C=C1 HR137159 [0,2,0,0,0,0|1,0,0]=3 1996 B9R1.69 FC1=C(F)C=C(I)C=C1 HR123282 [0,2,0,0,0,0|1,0,0]=3 1997 B9R1.69 FC1=C(F)C=C(S)C=C1 HR130462 [0,2,0,0,0,0|0,0,0]=2 1998 B9R1.69 FC1=C(I)C=C(Br)C=C1 HR154069 [0,2,0,0,0,0|1,0,0]=3 1999 B9R1.69 FC1=C(I)C=CC(Br)=C1 HR133320 [0,2,0,0,0,0|1,0,0]=3 2000 B9R1.69 FC1=C(I)C=CC(Cl)=C1 HR140762 [0,2,0,0,0,0|1,0,0]=3 2001 B9R1.69 FC1=C(I)C=CC(I)=C1 HR139505 [0,2,0,0,0,0|1,0,0]=3 2002 B9R1.69 FC1=CC(Br)=C(Br)C=C1 HR142560 [0,2,0,0,0,0|1,0,0]=3 2003 B9R1.69 FC1=CC(Br)=C(Cl)C=C1 HR132255 [0,2,0,0,0,0|1,0,0]=3 2004 B9R1.69 FC1=CC(Br)=C(F)C=C1 HR124300 [0,2,0,0,0,0|1,0,0]=3 2005 B9R1.69 FC1=CC(Br)=C(I)C=C1 HR103352 [0,2,0,0,0,0|1,0,0]=3 2006 B9R1.69 FC1=CC(Br)=CN=C1Br HR17547 [0,2,0,0,0,0|2,0,0]=4 2007 B9R1.69 FC1=CC(Br)=CN=C1Cl HR1163 [0,2,0,0,0,0|2,0,0]=4 2008 B9R1.69 FC1=CC(Br)=CN=C1F HR104820 [0,2,0,0,0,0|2,0,0]=4 2009 B9R1.69 FC1=CC(Cl)=C(Br)C=C1 HR129348 [0,2,0,0,0,0|1,0,0]=3 2010 B9R1.69 FC1=CC(Cl)=C(Cl)C=C1 HR128343 [0,2,0,0,0,0|1,0,0]=3 2011 B9R1.69 FC1=CC(Cl)=C(F)C=C1 HR133494 [0,2,0,0,0,0|1,0,0]=3 2012 B9R1.69 FC1=CC(Cl)=C(I)C=C1 HR117703 [0,2,0,0,0,0|1,0,0]=3 2013 B9R1.69 FC1=CC(Cl)=C(S)C=C1 HR2850 [0,2,0,0,0,0|0,0,0]=2 2014 B9R1.69 FC1=CC(Cl)=CN=C1Br HR115322 [0,2,0,0,0,0|2,0,0]=4 2015 B9R1.69 FC1=CC(Cl)=CN=C1Cl HR104586 [0,2,0,0,0,0|2,0,0]=4 2016 B9R1.69 FC1=CC(Cl)=CN=C1F HR122923 [0,2,0,0,0,0|2,0,0]=4 2017 B9R1.69 FC1=CC(F)=C(Br)C=C1 ANSA06433 [0,2,0,0,0,0|1,0,0]=3 2018 B9R1.69 FC1=CC(F)=C(Cl)C=C1 HR141146 [0,2,0,0,0,0|1,0,0]=3 2019 B9R1.69 FC1=CC(F)=C(F)C=C1 HR126978 [0,2,0,0,0,0|1,0,0]=3 2020 B9R1.69 FC1=CC(F)=C(I)C=C1 HR124209 [0,2,0,0,0,0|1,0,0]=3 2021 B9R1.69 FC1=CC(F)=C(S)C=C1 HR102164 [0,2,0,0,0,0|0,0,0]=2 2022 B9R1.69 FC1=CC(F)=NC=C1I HR111111 [0,2,0,0,0,0|2,0,0]=4 2023 B9R1.69 FC1=CC(I)=C(Br)C=C1 HR124328 [0,2,0,0,0,0|1,0,0]=3 2024 B9R1.69 FC1=CC(I)=C(Cl)C=C1 HR154523 [0,2,0,0,0,0|1,0,0]=3 2025 B9R1.69 FC1=CC(I)=CN=C1Cl HR152464 [0,2,0,0,0,0|2,0,0]=4 2026 B9R1.69 FC1=CC(S)=C(F)C=C1 HR142221 [0,2,0,0,0,0|0,0,0]=2 2027 B9R1.69 FC1=CC=C(Br)C(F)=N1 HR106763 [0,2,0,0,0,0|2,0,0]=4 2028 B9R1.69 FC1=CC=C(Br)C=C1F HR153944 [0,2,0,0,0,0|1,0,0]=3 2029 B9R1.69 FC1=CC=C(Br)N=C1Br HR152448 [0,2,0,0,0,0|2,0,0]=4 2030 B9R1.69 FC1=CC=C(Cl)C(F)=N1 HR119577 [0,2,0,0,0,0|2,0,0]=4 2031 B9R1.69 FC1=CC=C(Cl)N=C1Cl HR121218 [0,2,0,0,0,0|2,0,0]=4 2032 B9R1.69 FC1=CC=C(F)C(F)=N1 HR140571 [0,2,0,0,0,0|2,0,0]=4 2033 B9R1.69 FC1=CC=C(I)C(F)=N1 HR152509 [0,2,0,0,0,0|2,0,0]=4 2034 B9R1.69 FC1=CN=C(Br)C(Br)=C1 HR21379 [0,2,0,0,0,0|2,0,0]=4 2035 B9R1.69 FC1=CN=C(Br)C(F)=C1 HR4046 [0,2,0,0,0,0|2,0,0]=4 2036 B9R1.69 FC1=CN=C(Br)C=C1I HR150623 [0,2,0,0,0,0|2,0,0]=4 2037 B9R1.69 FC1=CN=C(Cl)C(Br)=C1 HR1102 [0,2,0,0,0,0|2,0,0]=4 2038 B9R1.69 FC1=CN=C(Cl)C(Cl)=C1 HR106384 [0,2,0,0,0,0|2,0,0]=4 2039 B9R1.69 FC1=CN=C(Cl)C(I)=C1 HR125128 [0,2,0,0,0,0|2,0,0]=4 2040 B9R1.69 FC1=CN=C(Cl)C=C1Br HR108376 [0,2,0,0,0,0|2,0,0]=4 2041 B9R1.69 FC1=CN=C(Cl)C=C1I HR6183 [0,2,0,0,0,0|2,0,0]=4 2042 B9R1.69 FC1=CN=C(F)C(Cl)=C1 HR107969 [0,2,0,0,0,0|2,0,0]=4 2043 B9R1.69 FC1=CN=C(F)C(F)=C1 HR123008 [0,2,0,0,0,0|2,0,0]=4 2044 B9R1.69 FC1=NC=C(Br)C=C1Br HR13502 [0,2,0,0,0,0|2,0,0]=4 2045 B9R1.69 FC1=NC=C(Br)C=C1Cl HR140957 [0,2,0,0,0,0|2,0,0]=4 2046 B9R1.69 FC1=NC=C(Br)C=C1I HR152853 [0,2,0,0,0,0|2,0,0]=4 2047 B9R1.69 FC1=NC=C(Cl)C(I)=C1 HR131186 [0,2,0,0,0,0|2,0,0]=4 2048 B9R1.69 FC1=NC=C(Cl)C=C1Br HR112219 [0,2,0,0,0,0|2,0,0]=4 2049 B9R1.69 FC1=NC=C(Cl)C=C1Cl HR141223 [0,2,0,0,0,0|2,0,0]=4 2050 B9R1.69 FC1=NC=C(Cl)C=C1I HR152620 [0,2,0,0,0,0|2,0,0]=4 2051 B9R1.69 Fc1cc(Cl)ccc1I HR120055 [0,2,0,0,0,0|1,0,0]=3 2052 B9R1.69 Fc1ccc(I)cc1Cl HR140858 [0,2,0,0,0,0|1,0,0]=3 2053 B9R1.69 NC1=C(Br)C=C(Cl)C=C1 HR137587 [0,2,0,0,0,0|1,0,0]=3 2054 B9R1.69 NC1=C(Br)C=C(F)C=C1 HR127610 [0,2,0,0,0,0|1,0,0]=3 2055 B9R1.69 NC1=C(Br)C=C(I)C=C1 HR117852 [0,2,0,0,0,0|1,0,0]=3 2056 B9R1.69 NC1=C(Br)C=C(O)C=C1 HR140801 [0,2,0,0,0,0|0,1,0]=3 2057 B9R1.69 NC1=C(Br)C=C(O)C=N1 HR100554 [0,2,0,0,0,0|1,1,0]=4 2058 B9R1.69 NC1=C(Br)C=CC(Br)=C1 HR146555 [0,2,0,0,0,0|1,0,0]=3 2059 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 HR3577 [0,2,0,0,0,0|1,0,0]=3 2060 B9R1.69 NC1=C(Br)C=CC(F)=C1 HR1524 [0,2,0,0,0,0|1,0,0]=3 2061 B9R1.69 NC1=C(Br)C=CC(O)=C1 HR114550 [0,2,0,0,0,0|0,1,0]=3 2062 B9R1.69 NC1=C(Cl)C=C(Br)C=C1 HR136241 [0,2,0,0,0,0|1,0,0]=3 2063 B9R1.69 NC1=C(Cl)C=C(F)C=C1 HR123248 [0,2,0,0,0,0|1,0,0]=3 2064 B9R1.69 NC1=C(Cl)C=C(I)C=C1 HR125107 [0,2,0,0,0,0|1,0,0]=3 2065 B9R1.69 NC1=C(Cl)C=C(O)C=C1 HR102053 [0,2,0,0,0,0|0,1,0]=3 2066 B9R1.69 NC1=C(Cl)C=C(O)C=C1 HR136287 [0,2,0,0,0,0|0,1,0]=3 2067 B9R1.69 NC1=C(Cl)C=CC(Cl)=C1 HR10755 [0,2,0,0,0,0|1,0,0]=3 2068 B9R1.69 NC1=C(Cl)C=CC(F)=C1 HR136255 [0,2,0,0,0,0|1,0,0]=3 2069 B9R1.69 NC1=C(Cl)C=CC(O)=C1 HR114982 [0,2,0,0,0,0|0,1,0]=3 2070 B9R1.69 NC1=C(F)C=C(Br)C=C1 HR128346 [0,2,0,0,0,0|1,0,0]=3 2071 B9R1.69 NC1=C(F)C=C(Cl)C=C1 HR1514 [0,2,0,0,0,0|1,0,0]=3 2072 B9R1.69 NC1=C(F)C=C(F)C=C1 HR123607 [0,2,0,0,0,0|1,0,0]=3 2073 B9R1.69 NC1=C(F)C=C(I)C=C1 HR1532 [0,2,0,0,0,0|1,0,0]=3 2074 B9R1.69 NC1=C(F)C=C(O)C=C1 HR124483 [0,2,0,0,0,0|0,1,0]=3 2075 B9R1.69 NC1=C(F)C=C(S)C=C1 HR141049 [0,2,0,0,0,0|0,0,0]=2 2076 B9R1.69 NC1=C(F)C=CC(Br)=C1 HR127528 [0,2,0,0,0,0|1,0,0]=3 2077 B9R1.69 NC1=C(F)C=CC(Cl)=C1 HR134917 [0,2,0,0,0,0|1,0,0]=3 2078 B9R1.69 NC1=C(F)C=CC(F)=C1 HR123867 [0,2,0,0,0,0|1,0,0]=3 2079 B9R1.69 NC1=C(F)C=CC(I)=C1 HR112553 [0,2,0,0,0,0|1,0,0]=3 2080 B9R1.69 NC1=C(F)C=CC(O)=C1 HR4776 [0,2,0,0,0,0|0,1,0]=3 2081 B9R1.69 NC1=C(I)C=C(Br)C=C1 HR3784 [0,2,0,0,0,0|1,0,0]=3 2082 B9R1.69 NC1=C(I)C=C(Cl)C=C1 HR3645 [0,2,0,0,0,0|1,0,0]=3 2083 B9R1.69 NC1=C(I)C=C(Cl)N=C1 HR102264 [0,2,0,0,0,0|2,0,0]=4 2084 B9R1.69 NC1=C(I)C=C(F)C=C1 HR134944 [0,2,0,0,0,0|1,0,0]=3 2085 B9R1.69 NC1=C(I)C=CC(Br)=C1 HR102610 [0,2,0,0,0,0|1,0,0]=3 2086 B9R1.69 NC1=C(I)C=CC(Cl)=C1 HR102976 [0,2,0,0,0,0|1,0,0]=3 2087 B9R1.69 NC1=C(I)C=CC(F)=C1 HR114499 [0,2,0,0,0,0|1,0,0]=3 2088 B9R1.69 NC1=C(N)C=C(Br)C=C1 HR4315 [0,2,0,0,0,0|1,0,0]=3 2089 B9R1.69 NC1=C(N)C=C(Cl)C=C1 HR134653 [0,2,0,0,0,0|1,0,0]=3 2090 B9R1.69 NC1=C(N)C=C(Cl)N=C1 HR112531 [0,2,0,0,0,0|2,0,0]=4 2091 B9R1.69 NC1=C(N)C=C(Cl)N=C1 HR114242 [0,2,0,0,0,0|2,0,0]=4 2092 B9R1.69 NC1=C(O)C=C(Br)C=C1 HR32069 [0,2,0,0,0,0|0,1,0]=3 2093 B9R1.69 NC1=C(O)C=C(Cl)C=C1 HR123831 [0,2,0,0,0,0|0,1,0]=3 2094 B9R1.69 NC1=C(O)C=C(F)C=C1 HR124119 [0,2,0,0,0,0|0,1,0]=3 2095 B9R1.69 NC1=C(O)C=C(O)C=C1 HR32213 [0,2,0,0,0,0|0,1,0]=3 2096 B9R1.69 NC1=C(O)C=CC(Br)=C1 HR135153 [0,2,0,0,0,0|0,1,0]=3 2097 B9R1.69 NC1=C(O)C=CC(F)=C1 HR2825 [0,2,0,0,0,0|0,1,0]=3 2098 B9R1.69 NC1=C(O)C=NC(Cl)=C1 HR120603 [0,2,0,0,0,0|1,1,0]=4 2099 B9R1.69 NC1=C(S)C=C(Br)C=C1 HR115257 [0,2,0,0,0,0|0,0,0]=2 2100 B9R1.69 NC1=C(S)C=C(Cl)C=C1 HR115570 [0,2,0,0,0,0|0,0,0]=2 2101 B9R1.69 NC1=C(S)C=C(F)C=C1 HR112162 [0,2,0,0,0,0|0,0,0]=2 2102 B9R1.69 NC1=C(S)C=CC(Cl)=C1 HR123060 [0,2,0,0,0,0|0,0,0]=2 2103 B9R1.69 NC1=C(S)C=CC(Cl)=C1 HR137571 [0,2,0,0,0,0|0,0,0]=2 2104 B9R1.69 NC1=CC(Br)=C(Br)C=C1 HR154622 [0,2,0,0,0,0|1,0,0]=3 2105 B9R1.69 NC1=CC(Br)=C(Br)N=C1 HR147085 [0,2,0,0,0,0|2,0,0]=4 2106 B9R1.69 NC1=CC(Br)=C(Cl)C=C1 HR5307 [0,2,0,0,0,0|1,0,0]=3 2107 B9R1.69 NC1=CC(Br)=C(F)C=C1 HR2924 [0,2,0,0,0,0|1,0,0]=3 2108 B9R1.69 NC1=CC(Br)=C(O)C=C1 HR113601 [0,2,0,0,0,0|0,1,0]=3 2109 B9R1.69 NC1=CC(Br)=CC=C1Cl HR3132 [0,2,0,0,0,0|1,0,0]=3 2110 B9R1.69 NC1=CC(Br)=CN=C1Br HR119395 [0,2,0,0,0,0|2,0,0]=4 2111 B9R1.69 NC1=CC(Br)=CN=C1Cl HR1142 [0,2,0,0,0,0|2,0,0]=4 2112 B9R1.69 NC1=CC(Br)=CN=C1F HR1146 [0,2,0,0,0,0|2,0,0]=4 2113 B9R1.69 NC1=CC(Br)=CN=C1N HR5383 [0,2,0,0,0,0|2,0,0]=4 2114 B9R1.69 NC1=CC(Br)=CN=C1O HR134186 [0,2,0,0,0,0|1,1,0]=4 2115 B9R1.69 NC1=CC(Br)=CN=C1O HR6513 [0,2,0,0,0,0|1,1,0]=4 2116 B9R1.69 NC1=CC(Cl)=C(Br)C=C1 HR141997 [0,2,0,0,0,0|1,0,0]=3 2117 B9R1.69 NC1=CC(Cl)=C(Br)N=C1 HR31856 [0,2,0,0,0,0|2,0,0]=4 2118 B9R1.69 NC1=CC(Cl)=C(Cl)C=C1 HR147322 [0,2,0,0,0,0|1,0,0]=3 2119 B9R1.69 NC1=CC(Cl)=C(Cl)N=C1 HR1253 [0,2,0,0,0,0|2,0,0]=4 2120 B9R1.69 NC1=CC(Cl)=C(F)C=C1 HR133380 [0,2,0,0,0,0|1,0,0]=3 2121 B9R1.69 NC1=CC(Cl)=C(I)C=C1 HR144738 [0,2,0,0,0,0|1,0,0]=3 2122 B9R1.69 NC1=CC(Cl)=C(N)C=C1 HR122582 [0,2,0,0,0,0|1,0,0]=3 2123 B9R1.69 NC1=CC(Cl)=C(N)C=C1 HR122850 [0,2,0,0,0,0|1,0,0]=3 2124 B9R1.69 NC1=CC(Cl)=C(O)C=C1 HR136020 [0,2,0,0,0,0|0,1,0]=3 2125 B9R1.69 NC1=CC(Cl)=CN=C1Br HR123594 [0,2,0,0,0,0|2,0,0]=4 2126 B9R1.69 NC1=CC(Cl)=CN=C1Cl HR5507 [0,2,0,0,0,0|2,0,0]=4 2127 B9R1.69 NC1=CC(Cl)=CN=C1N HR131462 [0,2,0,0,0,0|2,0,0]=4 2128 B9R1.69 NC1=CC(Cl)=NC=C1Br HR104719 [0,2,0,0,0,0|2,0,0]=4 2129 B9R1.69 NC1=CC(Cl)=NC=C1Cl HR102875 [0,2,0,0,0,0|2,0,0]=4 2130 B9R1.69 NC1=CC(Cl)=NC=C1I HR109578 [0,2,0,0,0,0|2,0,0]=4 2131 B9R1.69 NC1=CC(F)=C(Br)C=C1 HR137232 [0,2,0,0,0,0|1,0,0]=3 2132 B9R1.69 NC1=CC(F)=C(Cl)C=C1 HR126462 [0,2,0,0,0,0|1,0,0]=3 2133 B9R1.69 NC1=CC(F)=C(F)C=C1 HR124381 [0,2,0,0,0,0|1,0,0]=3 2134 B9R1.69 NC1=CC(F)=C(I)C=C1 HR1534 [0,2,0,0,0,0|1,0,0]=3 2135 B9R1.69 NC1=CC(F)=C(O)C=C1 HR129109 [0,2,0,0,0,0|0,1,0]=3 2136 B9R1.69 NC1=CC(F)=CN=C1Br HR1145 [0,2,0,0,0,0|2,0,0]=4 2137 B9R1.69 NC1=CC(F)=CN=C1Cl HR33423 [0,2,0,0,0,0|2,0,0]=4 2138 B9R1.69 NC1=CC(F)=CN=C1N HR115985 [0,2,0,0,0,0|2,0,0]=4 2139 B9R1.69 NC1=CC(I)=C(Br)N=C1 HR103560 [0,2,0,0,0,0|2,0,0]=4 2140 B9R1.69 NC1=CC(I)=C(Cl)C=C1 HR101927 [0,2,0,0,0,0|1,0,0]=3 2141 B9R1.69 NC1=CC(I)=C(N)C=C1 HR132754 [0,2,0,0,0,0|1,0,0]=3 2142 B9R1.69 NC1=CC(N)=C(Cl)C=C1 HR131780 [0,2,0,0,0,0|1,0,0]=3 2143 B9R1.69 NC1=CC(N)=C(O)C=C1 HR100646 [0,2,0,0,0,0|0,1,0]=3 2144 B9R1.69 NC1=CC(N)=C(O)C=C1 HR134768 [0,2,0,0,0,0|0,1,0]=3 2145 B9R1.69 NC1=CC(O)=C(Cl)C=C1 HR129565 [0,2,0,0,0,0|0,1,0]=3 2146 B9R1.69 NC1=CC=C(Br)C(N)=N1 HR117450 [0,2,0,0,0,0|2,0,0]=4 2147 B9R1.69 NC1=CC=C(Br)N=C1Br HR9809 [0,2,0,0,0,0|2,0,0]=4 2148 B9R1.69 NC1=CC=C(Br)N=C1Cl HR148297 [0,2,0,0,0,0|2,0,0]=4 2149 B9R1.69 NC1=CC=C(Br)N=C1N HR121475 [0,2,0,0,0,0|2,0,0]=4 2150 B9R1.69 NC1=CC=C(Cl)N=C1Br HR33471 [0,2,0,0,0,0|2,0,0]=4 2151 B9R1.69 NC1=CC=C(Cl)N=C1Cl HR10384 [0,2,0,0,0,0|2,0,0]=4 2152 B9R1.69 NC1=CC=C(Cl)N=C1I HR143771 [0,2,0,0,0,0|2,0,0]=4 2153 B9R1.69 NC1=CC=C(Cl)N=C1N HR19958 [0,2,0,0,0,0|2,0,0]=4 2154 B9R1.69 NC1=CC=C(F)C(N)=N1 HR106882 [0,2,0,0,0,0|2,0,0]=4 2155 B9R1.69 NC1=CC=C(F)C=C1N HR110076 [0,2,0,0,0,0|1,0,0]=3 2156 B9R1.69 NC1=CC=C(F)N=C1F HR32038 [0,2,0,0,0,0|2,0,0]=4 2157 B9R1.69 NC1=CC=C(I)C=C1N HR144060 [0,2,0,0,0,0|1,0,0]=3 2158 B9R1.69 NC1=CC=C(N)C(N)=C1 HR136234 [0,2,0,0,0,0|1,0,0]=3 2159 B9R1.69 NC1=CN=C(Cl)C(Br)=C1 HR1143 [0,2,0,0,0,0|2,0,0]=4 2160 B9R1.69 NC1=CN=C(Cl)C=C1Cl HR121148 [0,2,0,0,0,0|2,0,0]=4 2161 B9R1.69 NC1=CN=C(F)C(Br)=C1 HR6245 [0,2,0,0,0,0|2,0,0]=4 2162 B9R1.69 NC1=CN=C(N)C=C1N HR119534 [0,2,0,0,0,0|2,0,0]=4 2163 B9R1.69 NC1=CN=C(S)N=C1N HR109871 [0,2,0,0,0,0|2,0,0]=4 2164 B9R1.69 NC1=NC(Br)=CC=C1O HR104267 [0,2,0,0,0,0|1,1,0]=4 2165 B9R1.69 NC1=NC(Cl)=C(Cl)C=C1 HR107000 [0,2,0,0,0,0|2,0,0]=4 2166 B9R1.69 NC1=NC(Cl)=CC=C1Cl HR32521 [0,2,0,0,0,0|2,0,0]=4 2167 B9R1.69 NC1=NC(Cl)=CC=C1I HR108653 [0,2,0,0,0,0|2,0,0]=4 2168 B9R1.69 NC1=NC=C(Br)C(Cl)=C1 HR106897 [0,2,0,0,0,0|2,0,0]=4 2169 B9R1.69 NC1=NC=C(Br)C=C1Br HR129991 [0,2,0,0,0,0|2,0,0]=4 2170 B9R1.69 NC1=NC=C(Br)C=C1Cl HR106641 [0,2,0,0,0,0|2,0,0]=4 2171 B9R1.69 NC1=NC=C(Br)C=C1F HR148157 [0,2,0,0,0,0|2,0,0]=4 2172 B9R1.69 NC1=NC=C(Cl)C(Br)=C1 HR33905 [0,2,0,0,0,0|2,0,0]=4 2173 B9R1.69 NC1=NC=C(Cl)C(Cl)=C1 HR136851 [0,2,0,0,0,0|2,0,0]=4 2174 B9R1.69 NC1=NC=C(Cl)C=C1Br HR126123 [0,2,0,0,0,0|2,0,0]=4 2175 B9R1.69 NC1=NC=C(Cl)C=C1Cl HR124718 [0,2,0,0,0,0|2,0,0]=4 2176 B9R1.69 NC1=NC=C(Cl)C=C1F HR108584 [0,2,0,0,0,0|2,0,0]=4 2177 B9R1.69 NC1=NC=C(Cl)C=C1I HR105863 [0,2,0,0,0,0|2,0,0]=4 2178 B9R1.69 NC1=NC=C(Cl)C=C1O HR148198 [0,2,0,0,0,0|1,1,0]=4 2179 B9R1.69 NC1=NC=C(F)C=C1Br HR129105 [0,2,0,0,0,0|2,0,0]=4 2180 B9R1.69 NC1=NC=C(F)C=C1F HR134125 [0,2,0,0,0,0|2,0,0]=4 2181 B9R1.69 NC1=NC=C(F)C=C1I HR146906 [0,2,0,0,0,0|2,0,0]=4 2182 B9R1.69 NC1=NC=C(I)C(Cl)=C1 HR15065 [0,2,0,0,0,0|2,0,0]=4 2183 B9R1.69 NC1=NC=C(I)C=C1Br HR117430 [0,2,0,0,0,0|2,0,0]=4 2184 B9R1.69 NC1=NC=C(I)C=C1I HR143294 [0,2,0,0,0,0|2,0,0]=4 2185 B9R1.69 Nc1ccc(F)c(N)c1 HR124076 [0,2,0,0,0,0|1,0,0]=3 2186 B9R1.69 Nc1ccc(N)c(Cl)c1 HR128899 [0,2,0,0,0,0|1,0,0]=3 2187 B9R1.69 Nc1ncc(Br)cc1I HR8081 [0,2,0,0,0,0|2,0,0]=4 2188 B9R1.69 O=C1C=C(O)C(Cl)=CN1 HR117746 [0,2,0,0,0,0|1,1,0]=4 2189 B9R1.69 O=C1C=CC(=O)C(Br)=C1 HR104214 [0,2,0,0,0,0|0,1,0]=3 2190 B9R1.69 O=C1C=CC(=O)C(Cl)=C1 HR140079 [0,2,0,0,0,0|0,1,0]=3 2191 B9R1.69 O=C1NC(Cl)=CC=C1Br HR33389 [0,2,0,0,0,0|1,1,0]=4 2192 B9R1.69 O=C1NC=C(Br)C=C1F HR9960 [0,2,0,0,0,0|1,1,0]=4 2193 B9R1.69 O=C1NC=C(Br)C=C1I HR105718 [0,2,0,0,0,0|1,1,0]=4 2194 B9R1.69 O=C1NC=C(Br)C=C1O HR107910 [0,2,0,0,0,0|1,1,0]=4 2195 B9R1.69 OC1=C(Br)C=C(Br)C=C1 HR130855 [0,2,0,0,0,0|0,1,0]=3 2196 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 HR134986 [0,2,0,0,0,0|0,1,0]=3 2197 B9R1.69 OC1=C(Br)C=C(F)C=C1 HR1485 [0,2,0,0,0,0|0,1,0]=3 2198 B9R1.69 OC1=C(Br)C=C(I)C=C1 HR30393 [0,2,0,0,0,0|0,1,0]=3 2199 B9R1.69 OC1=C(Br)C=CC(Br)=C1 HR108927 [0,2,0,0,0,0|0,1,0]=3 2200 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 HR109259 [0,2,0,0,0,0|0,1,0]=3 2201 B9R1.69 OC1=C(Br)C=CC(F)=C1 HR1964 [0,2,0,0,0,0|0,1,0]=3 2202 B9R1.69 OC1=C(Br)C=CC(I)=C1 HR112265 [0,2,0,0,0,0|0,1,0]=3 2203 B9R1.69 OC1=C(Cl)C=C(Br)C=C1 HR131571 [0,2,0,0,0,0|0,1,0]=3 2204 B9R1.69 OC1=C(Cl)C=C(F)C=C1 HR128863 [0,2,0,0,0,0|0,1,0]=3 2205 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 HR1476 [0,2,0,0,0,0|0,1,0]=3 2206 B9R1.69 OC1=C(Cl)C=CC(F)=C1 HR2146 [0,2,0,0,0,0|0,1,0]=3 2207 B9R1.69 OC1=C(Cl)C=CC(I)=C1 HR3651 [0,2,0,0,0,0|0,1,0]=3 2208 B9R1.69 OC1=C(F)C=C(Br)C=C1 RPJL02408 [0,2,0,0,0,0|0,1,0]=3 2209 B9R1.69 OC1=C(F)C=C(Cl)C=C1 HR123782 [0,2,0,0,0,0|0,1,0]=3 2210 B9R1.69 OC1=C(F)C=C(F)C=C1 HR129416 [0,2,0,0,0,0|0,1,0]=3 2211 B9R1.69 OC1=C(F)C=C(I)C=C1 HR106165 [0,2,0,0,0,0|0,1,0]=3 2212 B9R1.69 OC1=C(F)C=CC(Br)=C1 HR1490 [0,2,0,0,0,0|0,1,0]=3 2213 B9R1.69 OC1=C(F)C=CC(Cl)=C1 HR32141 [0,2,0,0,0,0|0,1,0]=3 2214 B9R1.69 OC1=C(F)C=CC(F)=C1 HR123777 [0,2,0,0,0,0|0,1,0]=3 2215 B9R1.69 OC1=C(F)C=CC(I)=C1 HR115137 [0,2,0,0,0,0|0,1,0]=3 2216 B9R1.69 OC1=C(I)C=C(Cl)C=C1 HR117275 [0,2,0,0,0,0|0,1,0]=3 2217 B9R1.69 OC1=C(I)C=C(F)C=C1 HR30565 [0,2,0,0,0,0|0,1,0]=3 2218 B9R1.69 OC1=C(I)C=C(F)N=C1 HR156505 [0,2,0,0,0,0|1,1,0]=4 2219 B9R1.69 OC1=C(I)C=CC(Br)=C1 HR32754 [0,2,0,0,0,0|0,1,0]=3 2220 B9R1.69 OC1=C(I)C=CC(Cl)=C1 HR9582 [0,2,0,0,0,0|0,1,0]=3 2221 B9R1.69 OC1=C(I)C=CC(F)=C1 HR30564 [0,2,0,0,0,0|0,1,0]=3 2222 B9R1.69 OC1=C(I)C=CC(I)=C1 HR31858 [0,2,0,0,0,0|0,1,0]=3 2223 B9R1.69 OC1=CC(Br)=C(Br)C=C1 HR31670 [0,2,0,0,0,0|0,1,0]=3 2224 B9R1.69 OC1=CC(Br)=C(Cl)C=C1 HR3595 [0,2,0,0,0,0|0,1,0]=3 2225 B9R1.69 OC1=CC(Br)=C(Cl)N=C1 HR116243 [0,2,0,0,0,0|1,1,0]=4 2226 B9R1.69 OC1=CC(Br)=C(F)C=C1 HR1486 [0,2,0,0,0,0|0,1,0]=3 2227 B9R1.69 OC1=CC(Br)=C(O)C=C1 HR121957 [0,2,0,0,0,0|0,1,0]=3 2228 B9R1.69 OC1=CC(Br)=CN=C1Br HR153069 [0,2,0,0,0,0|1,1,0]=4 2229 B9R1.69 OC1=CC(Br)=CN=C1Cl HR104437 [0,2,0,0,0,0|1,1,0]=4 2230 B9R1.69 OC1=CC(Br)=CN=C1F HR152595 [0,2,0,0,0,0|1,1,0]=4 2231 B9R1.69 OC1=CC(Br)=NC=C1Br HR152801 [0,2,0,0,0,0|1,1,0]=4 2232 B9R1.69 OC1=CC(Cl)=C(Br)C=C1 HR3597 [0,2,0,0,0,0|0,1,0]=3 2233 B9R1.69 OC1=CC(Cl)=C(Br)N=C1 HR31857 [0,2,0,0,0,0|1,1,0]=4 2234 B9R1.69 OC1=CC(Cl)=C(Cl)N=C1 HR107292 [0,2,0,0,0,0|1,1,0]=4 2235 B9R1.69 OC1=CC(Cl)=C(F)C=C1 HR124622 [0,2,0,0,0,0|0,1,0]=3 2236 B9R1.69 OC1=CC(Cl)=C(F)N=C1 HR139410 [0,2,0,0,0,0|1,1,0]=4 2237 B9R1.69 OC1=CC(Cl)=C(I)C=C1 HR31866 [0,2,0,0,0,0|0,1,0]=3 2238 B9R1.69 OC1=CC(Cl)=C(O)C=C1 HR132139 [0,2,0,0,0,0|0,1,0]=3 2239 B9R1.69 OC1=CC(Cl)=CN=C1Cl HR121839 [0,2,0,0,0,0|1,1,0]=4 2240 B9R1.69 OC1=CC(Cl)=CN=C1F HR152646 [0,2,0,0,0,0|1,1,0]=4 2241 B9R1.69 OC1=CC(Cl)=NC=C1Br HR153085 [0,2,0,0,0,0|1,1,0]=4 2242 B9R1.69 OC1=CC(Cl)=NC=C1Cl HR152432 [0,2,0,0,0,0|1,1,0]=4 2243 B9R1.69 OC1=CC(Cl)=NC=C1F HR153122 [0,2,0,0,0,0|1,1,0]=4 2244 B9R1.69 OC1=CC(F)=C(Br)C=C1 HR146618 [0,2,0,0,0,0|0,1,0]=3 2245 B9R1.69 OC1=CC(F)=C(Cl)C=C1 HR30588 [0,2,0,0,0,0|0,1,0]=3 2246 B9R1.69 OC1=CC(F)=C(Cl)N=C1 HR33370 [0,2,0,0,0,0|1,1,0]=4 2247 B9R1.69 OC1=CC(F)=C(F)C=C1 HR129675 [0,2,0,0,0,0|0,1,0]=3 2248 B9R1.69 OC1=CC(F)=C(I)C=C1 HR30394 [0,2,0,0,0,0|0,1,0]=3 2249 B9R1.69 OC1=CC(F)=C(O)C=C1 HR16452 [0,2,0,0,0,0|0,1,0]=3 2250 B9R1.69 OC1=CC(F)=CN=C1Cl HR105546 [0,2,0,0,0,0|1,1,0]=4 2251 B9R1.69 OC1=CC(I)=C(F)C=C1 HR32114 [0,2,0,0,0,0|0,1,0]=3 2252 B9R1.69 OC1=CC(O)=C(Br)C=C1 HR123804 [0,2,0,0,0,0|0,1,0]=3 2253 B9R1.69 OC1=CC(O)=C(Cl)C=C1 HR136882 [0,2,0,0,0,0|0,1,0]=3 2254 B9R1.69 OC1=CC(O)=C(F)C=C1 HR32121 [0,2,0,0,0,0|0,1,0]=3 2255 B9R1.69 OC1=CC(S)=C(O)C=C1 HR123609 [0,2,0,0,0,0|0,0,0]=2 2256 B9R1.69 OC1=CC=C(Br)C=C1O HR147420 [0,2,0,0,0,0|0,1,0]=3 2257 B9R1.69 OC1=CC=C(Br)N=C1Br HR120918 [0,2,0,0,0,0|1,1,0]=4 2258 B9R1.69 OC1=CC=C(Br)N=C1F HR104250 [0,2,0,0,0,0|1,1,0]=4 2259 B9R1.69 OC1=CC=C(Cl)N=C1Br HR152992 [0,2,0,0,0,0|1,1,0]=4 2260 B9R1.69 OC1=CC=C(Cl)N=C1Cl HR152435 [0,2,0,0,0,0|1,1,0]=4 2261 B9R1.69 OC1=CC=C(Cl)N=C1I HR114893 [0,2,0,0,0,0|1,1,0]=4 2262 B9R1.69 OC1=CC=C(F)C=C1O HR136472 [0,2,0,0,0,0|0,1,0]=3 2263 B9R1.69 OC1=CC=C(F)N=C1Br HR153073 [0,2,0,0,0,0|1,1,0]=4 2264 B9R1.69 OC1=CC=C(F)N=C1F HR152584 [0,2,0,0,0,0|1,1,0]=4 2265 B9R1.69 OC1=CC=C(I)N=C1Br HR152549 [0,2,0,0,0,0|1,1,0]=4 2266 B9R1.69 OC1=CC=C(I)N=C1Cl HR153066 [0,2,0,0,0,0|1,1,0]=4 2267 B9R1.69 OC1=CC=C(O)C(O)=C1 HR131310 [0,2,0,0,0,0|0,1,0]=3 2268 B9R1.69 OC1=CN=C(F)C=C1Br HR152633 [0,2,0,0,0,0|1,1,0]=4 2269 B9R1.69 OC1=NC=C(Br)C=C1Br HR121694 [0,2,0,0,0,0|1,1,0]=4 2270 B9R1.69 OC1=NC=C(Br)C=C1Cl HR130399 [0,2,0,0,0,0|1,1,0]=4 2271 B9R1.69 OC1=NC=C(Cl)C=C1Br HR100938 [0,2,0,0,0,0|1,1,0]=4 2272 B9R1.69 OC1=NC=C(Cl)C=C1Cl HR115797 [0,2,0,0,0,0|1,1,0]=4 2273 B9R1.69 OC1=NC=C(F)C(Br)=C1 HR139894 [0,2,0,0,0,0|1,1,0]=4 2274 B9R1.69 OC1=NC=C(F)C=C1Br HR14287 [0,2,0,0,0,0|1,1,0]=4 2275 B9R1.69 OC1=NC=C(I)C=C1Br HR117113 [0,2,0,0,0,0|1,1,0]=4 2276 B9R1.69 Oc1cc(Cl)cnc1O HR101105 [0,2,0,0,0,0|1,1,0]=4 2277 B9R1.69 SC1=C(Cl)C=C(Cl)C=C1 HR127282 [0,2,0,0,0,0|0,0,0]=2 2278 B9R1.69 SC1=C(Cl)C=CC(Cl)=C1 HR127557 [0,2,0,0,0,0|0,0,0]=2 2279 B9R1.69 SC1=CC(Cl)=C(Cl)C=C1 HR128540 [0,2,0,0,0,0|0,0,0]=2 2280 B9R1.69 [O-][N+]1=C(Br)C=C(Br)C=C1 HR106033 [0,2,0,0,0,0|1,1,0]=4 2281 B9R1.69 [O-][N+]1=C(Cl)C=CC(Br)=C1 HR114390 [0,2,0,0,0,0|1,1,0]=4 2282 B9R1.3 BrC1=CC=CC(Br)=C1Br HR156672 [0,2,0,0,0,0|1,0,0]=3 2283 B9R1.3 BrC1=CN=CC(Br)=C1Br HR111638 [0,2,0,0,0,0|2,0,0]=4 2284 B9R1.3 BrC1=CN=CC(Br)=C1I HR152607 [0,2,0,0,0,0|2,0,0]=4 2285 B9R1.3 CC1=C(Br)C(=O)NC=C1 HR118768 [0,2,0,0,0,0|1,1,0]=4 2286 B9R1.3 CC1=C(Br)C(Br)=NC=C1 HR32744 [0,2,0,0,0,0|2,0,0]=4 2287 B9R1.3 CC1=C(Br)C(Cl)=NC=C1 HR1290 [0,2,0,0,0,0|2,0,0]=4 2288 B9R1.3 CC1=C(Br)C(F)=CC=C1 HR127981 [0,2,0,0,0,0|1,0,0]=3 2289 B9R1.3 CC1=C(Br)C(F)=NC=C1 HR107748 [0,2,0,0,0,0|2,0,0]=4 2290 B9R1.3 CC1=C(Br)C(N)=NC=C1 HR102628 [0,2,0,0,0,0|2,0,0]=4 2291 B9R1.3 CC1=C(Br)C=CC=C1Br HR133263 [0,2,0,0,0,0|1,0,0]=3 2292 B9R1.3 CC1=C(Br)C=CC=C1Cl HR122007 [0,2,0,0,0,0|1,0,0]=3 2293 B9R1.3 CC1=C(Br)C=CC=C1F HR136746 [0,2,0,0,0,0|1,0,0]=3 2294 B9R1.3 CC1=C(Br)C=CN=C1F HR152447 [0,2,0,0,0,0|2,0,0]=4 2295 B9R1.3 CC1=C(Br)C=NC=C1Br HR17566 [0,2,0,0,0,0|2,0,0]=4 2296 B9R1.3 CC1=C(Br)C=NC=C1Cl HR156538 [0,2,0,0,0,0|2,0,0]=4 2297 B9R1.3 CC1=C(Br)C=NC=C1F HR152592 [0,2,0,0,0,0|2,0,0]=4 2298 B9R1.3 CC1=C(Br)C=NC=C1I HR152825 [0,2,0,0,0,0|2,0,0]=4 2299 B9R1.3 CC1=C(C)C(Cl)=NC=C1 HR144296 [0,2,0,0,0,0|2,0,0]=4 2300 B9R1.3 CC1=C(C)C(N)=NC=C1 HR139131 [0,2,0,0,0,0|2,0,0]=4 2301 B9R1.3 CC1=C(Cl)C(Br)=NC=C1 HR108061 [0,2,0,0,0,0|2,0,0]=4 2302 B9R1.3 CC1=C(Cl)C(Cl)=NC=C1 HR104062 [0,2,0,0,0,0|2,0,0]=4 2303 B9R1.3 CC1=C(Cl)C(F)=CC=C1 HR109538 [0,2,0,0,0,0|1,0,0]=3 2304 B9R1.3 CC1=C(Cl)C(F)=NC=C1 HR155462 [0,2,0,0,0,0|2,0,0]=4 2305 B9R1.3 CC1=C(Cl)C=CC=C1Cl HR147228 [0,2,0,0,0,0|1,0,0]=3 2306 B9R1.3 CC1=C(Cl)C=CC=C1F HR123066 [0,2,0,0,0,0|1,0,0]=3 2307 B9R1.3 CC1=C(Cl)C=CC=C1I HR114387 [0,2,0,0,0,0|1,0,0]=3 2308 B9R1.3 CC1=C(Cl)C=CN=C1Cl HR105522 [0,2,0,0,0,0|2,0,0]=4 2309 B9R1.3 CC1=C(Cl)C=NC=C1Cl HR6617 [0,2,0,0,0,0|2,0,0]=4 2310 B9R1.3 CC1=C(F)C(Br)=CC=C1 HR136489 [0,2,0,0,0,0|1,0,0]=3 2311 B9R1.3 CC1=C(F)C(Br)=NC=C1 HR147000 [0,2,0,0,0,0|2,0,0]=4 2312 B9R1.3 CC1=C(F)C(Cl)=CC=C1 HR30030 [0,2,0,0,0,0|1,0,0]=3 2313 B9R1.3 CC1=C(F)C(Cl)=NC=C1 HR131411 [0,2,0,0,0,0|2,0,0]=4 2314 B9R1.3 CC1=C(F)C(F)=CC=C1 HR130913 [0,2,0,0,0,0|1,0,0]=3 2315 B9R1.3 CC1=C(F)C=CC=C1F HR128793 [0,2,0,0,0,0|1,0,0]=3 2316 B9R1.3 CC1=C(F)C=CC=C1I HR133048 [0,2,0,0,0,0|1,0,0]=3 2317 B9R1.3 CC1=C(F)C=CN=C1Cl HR153042 [0,2,0,0,0,0|2,0,0]=4 2318 B9R1.3 CC1=C(I)C(Br)=NC=C1 HR139696 [0,2,0,0,0,0|2,0,0]=4 2319 B9R1.3 CC1=C(I)C(Cl)=CC=C1 HR146563 [0,2,0,0,0,0|1,0,0]=3 2320 B9R1.3 CC1=C(I)C(F)=CC=C1 HR4552 [0,2,0,0,0,0|1,0,0]=3 2321 B9R1.3 CC1=C(I)C(F)=NC=C1 HR156545 [0,2,0,0,0,0|2,0,0]=4 2322 B9R1.3 CC1=C(I)C=CN=C1Cl HR31818 [0,2,0,0,0,0|2,0,0]=4 2323 B9R1.3 CC1=C(I)C=CN=C1F HR6315 [0,2,0,0,0,0|2,0,0]=4 2324 B9R1.3 CC1=C(I)C=CNC1=O HR153308 [0,2,0,0,0,0|1,1,0]=4 2325 B9R1.3 CC1=C(I)C=NC=C1I HR155192 [0,2,0,0,0,0|2,0,0]=4 2326 B9R1.3 CC1=C(N)C(Br)=NC=C1 HR136999 [0,2,0,0,0,0|2,0,0]=4 2327 B9R1.3 CC1=C(N)C(Cl)=NC=C1 HR134268 [0,2,0,0,0,0|2,0,0]=4 2328 B9R1.3 CC1=C(N)C(F)=NC=C1 HR106526 [0,2,0,0,0,0|2,0,0]=4 2329 B9R1.3 CC1=C(N)C(N)=CC=C1 HR130988 [0,2,0,0,0,0|1,0,0]=3 2330 B9R1.3 CC1=C(N)C(N)=NC=C1 HR106366 [0,2,0,0,0,0|2,0,0]=4 2331 B9R1.3 CC1=C(N)C=CC=C1Br HR3529 [0,2,0,0,0,0|1,0,0]=3 2332 B9R1.3 CC1=C(N)C=CC=C1Cl HR126742 [0,2,0,0,0,0|1,0,0]=3 2333 B9R1.3 CC1=C(N)C=CC=C1F HR1510 [0,2,0,0,0,0|1,0,0]=3 2334 B9R1.3 CC1=C(N)C=CC=C1I HR147256 [0,2,0,0,0,0|1,0,0]=3 2335 B9R1.3 CC1=C(O)C(=O)C=CO1 CAJB01101 [0,2,0,0,0,0|1,1,0]=4 2336 B9R1.3 CC1=C(O)C(F)=NC=C1 HR155748 [0,2,0,0,0,0|1,1,0]=4 2337 B9R1.3 CC1=C(O)C(O)=CC=C1 HR124937 [0,2,0,0,0,0|0,1,0]=3 2338 B9R1.3 CC1=C(O)C=CC=C1Br HR148540 [0,2,0,0,0,0|0,1,0]=3 2339 B9R1.3 CC1=C(O)C=CC=C1Cl HR102436 [0,2,0,0,0,0|0,1,0]=3 2340 B9R1.3 CC1=C(O)C=CC=C1F HR131115 [0,2,0,0,0,0|0,1,0]=3 2341 B9R1.3 CC1=C(O)C=CC=C1N HR108690 [0,2,0,0,0,0|0,1,0]=3 2342 B9R1.3 CC1=C(O)C=CC=C1O HR15385 [0,2,0,0,0,0|0,1,0]=3 2343 B9R1.3 CC1=C(O)C=NC=C1Br HR155333 [0,2,0,0,0,0|1,1,0]=4 2344 B9R1.3 CC1=CC=CC(Br)=C1Cl HR34024 [0,2,0,0,0,0|1,0,0]=3 2345 B9R1.3 CC1=CC=CC(Br)=C1N HR117711 [0,2,0,0,0,0|1,0,0]=3 2346 B9R1.3 CC1=CC=CC(Br)=C1O HR102690 [0,2,0,0,0,0|0,1,0]=3 2347 B9R1.3 CC1=CC=CC(C)=C1Br HR101199 [0,2,0,0,0,0|1,0,0]=3 2348 B9R1.3 CC1=CC=CC(C)=C1Cl HR142380 [0,2,0,0,0,0|1,0,0]=3 2349 B9R1.3 CC1=CC=CC(C)=C1I HR108685 [0,2,0,0,0,0|1,0,0]=3 2350 B9R1.3 CC1=CC=CC(C)=C1N AMJB00602 [0,2,0,0,0,0|1,0,0]=3 2351 B9R1.3 CC1=CC=CC(C)=C1O HR147229 [0,2,0,0,0,0|0,1,0]=3 2352 B9R1.3 CC1=CC=CC(C)=C1S HR129260 [0,2,0,0,0,0|0,0,0]=2 2353 B9R1.3 CC1=CC=CC(C)=[N+]1[O-] HR136794 [0,2,0,0,0,0|1,1,0]=4 2354 B9R1.3 CC1=CC=CC(Cl)=C1Br HR32249 [0,2,0,0,0,0|1,0,0]=3 2355 B9R1.3 CC1=CC=CC(Cl)=C1Cl HR127284 [0,2,0,0,0,0|1,0,0]=3 2356 B9R1.3 CC1=CC=CC(Cl)=C1N HR130694 [0,2,0,0,0,0|1,0,0]=3 2357 B9R1.3 CC1=CC=CC(F)=C1C HR107039 [0,2,0,0,0,0|1,0,0]=3 2358 B9R1.3 CC1=CC=CC(F)=C1N HR4470 [0,2,0,0,0,0|1,0,0]=3 2359 B9R1.3 CC1=CC=CC(I)=C1C HR112829 [0,2,0,0,0,0|1,0,0]=3 2360 B9R1.3 CC1=CC=CC(I)=C1F HR113977 [0,2,0,0,0,0|1,0,0]=3 2361 B9R1.3 CC1=CC=CC(N)=C1Br HR115554 [0,2,0,0,0,0|1,0,0]=3 2362 B9R1.3 CC1=CC=CC(N)=C1F HR130894 [0,2,0,0,0,0|1,0,0]=3 2363 B9R1.3 CC1=CC=CC(N)=C1O HR131375 [0,2,0,0,0,0|0,1,0]=3 2364 B9R1.3 CC1=CC=CC(O)=C1Cl HR34010 [0,2,0,0,0,0|0,1,0]=3 2365 B9R1.3 CC1=CC=CC(O)=C1F HR4120 [0,2,0,0,0,0|0,1,0]=3 2366 B9R1.3 CC1=CC=CC(O)=C1I HR31960 [0,2,0,0,0,0|0,1,0]=3 2367 B9R1.3 CC1=CC=CC(O)=C1N HR139748 [0,2,0,0,0,0|0,1,0]=3 2368 B9R1.3 CC1=CC=CC(S)=C1C HR6883 [0,2,0,0,0,0|0,0,0]=2 2369 B9R1.3 CC1=CC=C[N+]([O-])=C1C HR139302 [0,2,0,0,0,0|1,1,0]=4 2370 B9R1.3 CC1=CN=CC(Br)=C1C HR152569 [0,2,0,0,0,0|2,0,0]=4 2371 B9R1.3 CC1=CN=CC(Br)=C1N HR105739 [0,2,0,0,0,0|2,0,0]=4 2372 B9R1.3 CC1=CN=CC(C)=C1N HR109200 [0,2,0,0,0,0|2,0,0]=4 2373 B9R1.3 CC1=CN=CC(Cl)=C1N HR148533 [0,2,0,0,0,0|2,0,0]=4 2374 B9R1.3 CC1=CN=CC(F)=C1N HR115609 [0,2,0,0,0,0|2,0,0]=4 2375 B9R1.3 CC1=NC=CC(Br)=C1N HR137248 [0,2,0,0,0,0|2,0,0]=4 2376 B9R1.3 CC1=NC=CC(C)=C1Br HR30407 [0,2,0,0,0,0|2,0,0]=4 2377 B9R1.3 CC1=NC=CC(C)=C1N HR114285 [0,2,0,0,0,0|2,0,0]=4 2378 B9R1.3 CC1=NC=CC(Cl)=C1C HR32522 [0,2,0,0,0,0|2,0,0]=4 2379 B9R1.3 CC1=NC=CC(N)=C1C HR104547 [0,2,0,0,0,0|2,0,0]=4 2380 B9R1.3 CC1=NC=CC(N)=C1Cl HR104798 [0,2,0,0,0,0|2,0,0]=4 2381 B9R1.3 CC1=NC=CC(N)=C1N HR110376 [0,2,0,0,0,0|2,0,0]=4 2382 B9R1.3 CC1=[C]C=CC(Cl)=C1F HR155480 [0,2,0,0,0,0|1,0,1]=4 2383 B9R1.3 CN1C(=O)C=CC=C1Br HR32269 [0,2,0,0,0,0|1,1,0]=4 2384 B9R1.3 CN1C=CC=C(Br)C1=O HR32186 [0,2,0,0,0,0|1,1,0]=4 2385 B9R1.3 CN1C=CC=C(N)C1=O HR111508 [0,2,0,0,0,0|1,1,0]=4 2386 B9R1.3 Cc1c(N)cccc1Cl HR126998 [0,2,0,0,0,0|1,0,0]=3 2387 B9R1.3 Cc1c(N)cncc1Br HR152567 [0,2,0,0,0,0|2,0,0]=4 2388 B9R1.3 Cc1cccc(C)c1F HR135719 [0,2,0,0,0,0|1,0,0]=3 2389 B9R1.3 Cc1cccc(Cl)c1C HR112477 [0,2,0,0,0,0|1,0,0]=3 2390 B9R1.3 ClC1=C(Br)C=CC=C1Br HR148719 [0,2,0,0,0,0|1,0,0]=3 2391 B9R1.3 ClC1=C(Br)C=NC=C1Br HR33457 [0,2,0,0,0,0|2,0,0]=4 2392 B9R1.3 ClC1=C(Cl)C(I)=CC=C1 HR125669 [0,2,0,0,0,0|1,0,0]=3 2393 B9R1.3 ClC1=CC=CC(Br)=C1Br HR156673 [0,2,0,0,0,0|1,0,0]=3 2394 B9R1.3 ClC1=CC=CC(Br)=C1Cl HR143073 [0,2,0,0,0,0|1,0,0]=3 2395 B9R1.3 ClC1=CC=CC(Br)=C1I HR118529 [0,2,0,0,0,0|1,0,0]=3 2396 B9R1.3 ClC1=CC=CC(Cl)=C1Br HR139284 [0,2,0,0,0,0|1,0,0]=3 2397 B9R1.3 ClC1=CC=CC(Cl)=C1I HR141732 [0,2,0,0,0,0|1,0,0]=3 2398 B9R1.3 ClC1=CN=CC(Br)=C1Cl HR33439 [0,2,0,0,0,0|2,0,0]=4 2399 B9R1.3 ClC1=CN=CC(Cl)=C1Br HR21381 [0,2,0,0,0,0|2,0,0]=4 2400 B9R1.3 ClC1=CN=CC(Cl)=C1Cl HR11021 [0,2,0,0,0,0|2,0,0]=4 2401 B9R1.3 ClC1=CN=CC(Cl)=C1I HR32578 [0,2,0,0,0,0|2,0,0]=4 2402 B9R1.3 ClC1=NC=CC(Br)=C1I HR152451 [0,2,0,0,0,0|2,0,0]=4 2403 B9R1.3 ClC1=NC=CC(Cl)=C1Br HR141150 [0,2,0,0,0,0|2,0,0]=4 2404 B9R1.3 ClC1=NC=CC(Cl)=C1Cl HR153141 [0,2,0,0,0,0|2,0,0]=4 2405 B9R1.3 ClC1=NC=CC(Cl)=C1I HR113733 [0,2,0,0,0,0|2,0,0]=4 2406 B9R1.3 ClC1=NC=CC(I)=C1Br HR152512 [0,2,0,0,0,0|2,0,0]=4 2407 B9R1.3 ClC1=NC=CC(I)=C1Cl HR30412 [0,2,0,0,0,0|2,0,0]=4 2408 B9R1.3 FC1=C(Br)C(I)=CC=C1 HR32185 [0,2,0,0,0,0|1,0,0]=3 2409 B9R1.3 FC1=C(Br)C=CC=C1Cl HR143195 [0,2,0,0,0,0|1,0,0]=3 2410 B9R1.3 FC1=C(Br)C=CC=C1I HR32113 [0,2,0,0,0,0|1,0,0]=3 2411 B9R1.3 FC1=C(Br)C=CN=C1Cl HR153139 [0,2,0,0,0,0|2,0,0]=4 2412 B9R1.3 FC1=C(Cl)C=CC=C1Cl HR134729 [0,2,0,0,0,0|1,0,0]=3 2413 B9R1.3 FC1=C(Cl)C=CN=C1Cl HR153138 [0,2,0,0,0,0|2,0,0]=4 2414 B9R1.3 FC1=C(F)C(I)=CC=C1 HR32108 [0,2,0,0,0,0|1,0,0]=3 2415 B9R1.3 FC1=C(I)C(Cl)=NC=C1 HR152934 [0,2,0,0,0,0|2,0,0]=4 2416 B9R1.3 FC1=C(I)C=CN=C1Cl HR30700 [0,2,0,0,0,0|2,0,0]=4 2417 B9R1.3 FC1=CC=CC(Br)=C1Br HR153475 [0,2,0,0,0,0|1,0,0]=3 2418 B9R1.3 FC1=CC=CC(Br)=C1Cl HR110967 [0,2,0,0,0,0|1,0,0]=3 2419 B9R1.3 FC1=CC=CC(Br)=C1F HR126329 [0,2,0,0,0,0|1,0,0]=3 2420 B9R1.3 FC1=CC=CC(Br)=C1I HR115721 [0,2,0,0,0,0|1,0,0]=3 2421 B9R1.3 FC1=CC=CC(Cl)=C1Cl HR142123 [0,2,0,0,0,0|1,0,0]=3 2422 B9R1.3 FC1=CC=CC(Cl)=C1I HR153888 [0,2,0,0,0,0|1,0,0]=3 2423 B9R1.3 FC1=CC=CC(F)=C1Br HR124551 [0,2,0,0,0,0|1,0,0]=3 2424 B9R1.3 FC1=CC=CC(F)=C1Cl HR123204 [0,2,0,0,0,0|1,0,0]=3 2425 B9R1.3 FC1=CC=CC(F)=C1F HR126706 [0,2,0,0,0,0|1,0,0]=3 2426 B9R1.3 FC1=CC=CC(F)=C1I HR101261 [0,2,0,0,0,0|1,0,0]=3 2427 B9R1.3 FC1=CN=CC(Br)=C1Br HR148564 [0,2,0,0,0,0|2,0,0]=4 2428 B9R1.3 FC1=CN=CC(Br)=C1Cl HR154377 [0,2,0,0,0,0|2,0,0]=4 2429 B9R1.3 FC1=CN=CC(F)=C1Br HR106453 [0,2,0,0,0,0|2,0,0]=4 2430 B9R1.3 FC1=CN=CC(F)=C1I HR30258 [0,2,0,0,0,0|2,0,0]=4 2431 B9R1.3 FC1=NC=CC(F)=C1I HR111427 [0,2,0,0,0,0|2,0,0]=4 2432 B9R1.3 FC1=NC=CC(I)=C1Cl HR156634 [0,2,0,0,0,0|2,0,0]=4 2433 B9R1.3 FC1=NC=CC(I)=C1F HR30411 [0,2,0,0,0,0|2,0,0]=4 2434 B9R1.3 F[N+]1=C(Cl)C=CC=C1Cl HR104992 [0,2,0,0,0,0|2,0,0]=4 2435 B9R1.3 F[N+]1=C(Cl)C=CC=C1Cl HR105926 [0,2,0,0,0,0|2,0,0]=4 2436 B9R1.3 Fc1cccc(Cl)c1Br HR147802 [0,2,0,0,0,0|1,0,0]=3 2437 B9R1.3 Fc1cccc(Cl)c1F HR4396 [0,2,0,0,0,0|1,0,0]=3 2438 B9R1.3 NC1=C(Br)C(=O)NC=C1 HR106049 [0,2,0,0,0,0|1,1,0]=4 2439 B9R1.3 NC1=C(Br)C(Cl)=CC=C1 HR31995 [0,2,0,0,0,0|1,0,0]=3 2440 B9R1.3 NC1=C(Br)C(Cl)=NC=C1 HR146432 [0,2,0,0,0,0|2,0,0]=4 2441 B9R1.3 NC1=C(Br)C(F)=CC=C1 HR1523 [0,2,0,0,0,0|1,0,0]=3 2442 B9R1.3 NC1=C(Br)C=CC=C1Br HR136645 [0,2,0,0,0,0|1,0,0]=3 2443 B9R1.3 NC1=C(Br)C=CC=C1F LECQ00901 [0,2,0,0,0,0|1,0,0]=3 2444 B9R1.3 NC1=C(Br)C=NC=C1Br HR144743 [0,2,0,0,0,0|2,0,0]=4 2445 B9R1.3 NC1=C(Br)C=NC=C1F HR148362 [0,2,0,0,0,0|2,0,0]=4 2446 B9R1.3 NC1=C(Br)C=NC=C1I HR144458 [0,2,0,0,0,0|2,0,0]=4 2447 B9R1.3 NC1=C(Cl)C(=O)NC=C1 HR105114 [0,2,0,0,0,0|1,1,0]=4 2448 B9R1.3 NC1=C(Cl)C(F)=CC=C1 HR122390 [0,2,0,0,0,0|1,0,0]=3 2449 B9R1.3 NC1=C(Cl)C=CC=C1Cl HR146557 [0,2,0,0,0,0|1,0,0]=3 2450 B9R1.3 NC1=C(Cl)C=CC=C1F HR31674 [0,2,0,0,0,0|1,0,0]=3 2451 B9R1.3 NC1=C(Cl)C=CC=C1I HR10508 [0,2,0,0,0,0|1,0,0]=3 2452 B9R1.3 NC1=C(Cl)C=CN=C1Cl HR5456 [0,2,0,0,0,0|2,0,0]=4 2453 B9R1.3 NC1=C(Cl)C=NC=C1Cl HR1254 [0,2,0,0,0,0|2,0,0]=4 2454 B9R1.3 NC1=C(Cl)C=NC=C1Cl HR127531 [0,2,0,0,0,0|2,0,0]=4 2455 B9R1.3 NC1=C(F)C(Br)=CC=C1 HR31671 [0,2,0,0,0,0|1,0,0]=3 2456 B9R1.3 NC1=C(F)C(Cl)=CC=C1 HR1529 [0,2,0,0,0,0|1,0,0]=3 2457 B9R1.3 NC1=C(F)C(F)=CC=C1 HR135368 [0,2,0,0,0,0|1,0,0]=3 2458 B9R1.3 NC1=C(F)C=CC=C1F PAJB01001 [0,2,0,0,0,0|1,0,0]=3 2459 B9R1.3 NC1=C(F)C=CC=C1I HR104275 [0,2,0,0,0,0|1,0,0]=3 2460 B9R1.3 NC1=C(F)C=NC=C1F HR148458 [0,2,0,0,0,0|2,0,0]=4 2461 B9R1.3 NC1=C(I)C(Cl)=CC=C1 HR10506 [0,2,0,0,0,0|1,0,0]=3 2462 B9R1.3 NC1=C(I)C(Cl)=NC=C1 HR114808 [0,2,0,0,0,0|2,0,0]=4 2463 B9R1.3 NC1=C(I)C(F)=CC=C1 HR115699 [0,2,0,0,0,0|1,0,0]=3 2464 B9R1.3 NC1=C(I)C(F)=CC=C1 HR148814 [0,2,0,0,0,0|1,0,0]=3 2465 B9R1.3 NC1=C(I)C=NC=C1I HR143389 [0,2,0,0,0,0|2,0,0]=4 2466 B9R1.3 NC1=C(N)C(Br)=CN=C1 HR148135 [0,2,0,0,0,0|2,0,0]=4 2467 B9R1.3 NC1=C(N)C(Cl)=CC=C1 HR148524 [0,2,0,0,0,0|1,0,0]=3 2468 B9R1.3 NC1=C(N)C(Cl)=CN=C1 HR114479 [0,2,0,0,0,0|2,0,0]=4 2469 B9R1.3 NC1=C(N)C(Cl)=NC=C1 HR113921 [0,2,0,0,0,0|2,0,0]=4 2470 B9R1.3 NC1=C(N)C(O)=NC=C1 HR127243 [0,2,0,0,0,0|1,1,0]=4 2471 B9R1.3 NC1=C(O)C(Br)=CC=C1 HR132257 [0,2,0,0,0,0|0,1,0]=3 2472 B9R1.3 NC1=C(O)C(Br)=CN=C1 HR142605 [0,2,0,0,0,0|1,1,0]=4 2473 B9R1.3 NC1=C(O)C(Cl)=CC=C1 HR109818 [0,2,0,0,0,0|0,1,0]=3 2474 B9R1.3 NC1=C(O)C(F)=CC=C1 HR106790 [0,2,0,0,0,0|0,1,0]=3 2475 B9R1.3 NC1=C(O)C=CC=C1Br HR32071 [0,2,0,0,0,0|0,1,0]=3 2476 B9R1.3 NC1=C(O)C=CC=C1Cl HR31673 [0,2,0,0,0,0|0,1,0]=3 2477 B9R1.3 NC1=C(O)C=CC=C1F HR32066 [0,2,0,0,0,0|0,1,0]=3 2478 B9R1.3 NC1=C(O)C=CC=C1O HR107621 [0,2,0,0,0,0|0,1,0]=3 2479 B9R1.3 NC1=C(O)C=CC=C1O HR134655 [0,2,0,0,0,0|0,1,0]=3 2480 B9R1.3 NC1=C(S)C=CC=C1Cl HR115889 [0,2,0,0,0,0|0,0,0]=2 2481 B9R1.3 NC1=CC=CC(Br)=C1N HR148365 [0,2,0,0,0,0|1,0,0]=3 2482 B9R1.3 NC1=CC=CC(F)=C1N HR110793 [0,2,0,0,0,0|1,0,0]=3 2483 B9R1.3 NC1=CC=CC(O)=C1N HR130050 [0,2,0,0,0,0|0,1,0]=3 2484 B9R1.3 NC1=CN=CC(N)=C1N HR109192 [0,2,0,0,0,0|2,0,0]=4 2485 B9R1.3 NC1=NC=CC(Cl)=C1Cl HR104168 [0,2,0,0,0,0|2,0,0]=4 2486 B9R1.3 NC1=NC=CC(Cl)=C1I HR14998 [0,2,0,0,0,0|2,0,0]=4 2487 B9R1.3 O=C1C(Br)=CNC=C1Br HR111237 [0,2,0,0,0,0|1,1,0]=4 2488 B9R1.3 O=C1NC=CC(O)=C1Cl HR147850 [0,2,0,0,0,0|1,1,0]=4 2489 B9R1.3 OC1=C(Br)C(Cl)=NC=C1 HR152708 [0,2,0,0,0,0|1,1,0]=4 2490 B9R1.3 OC1=C(Br)C(F)=CC=C1 HR128037 [0,2,0,0,0,0|0,1,0]=3 2491 B9R1.3 OC1=C(Br)C=CC=C1Br HR136831 [0,2,0,0,0,0|0,1,0]=3 2492 B9R1.3 OC1=C(Br)C=CC=C1Cl HR30599 [0,2,0,0,0,0|0,1,0]=3 2493 B9R1.3 OC1=C(Br)C=CC=C1F HR1487 [0,2,0,0,0,0|0,1,0]=3 2494 B9R1.3 OC1=C(Br)C=CC=C1I HR30316 [0,2,0,0,0,0|0,1,0]=3 2495 B9R1.3 OC1=C(Br)C=CN=C1Cl HR152983 [0,2,0,0,0,0|1,1,0]=4 2496 B9R1.3 OC1=C(Br)C=NC=C1Br HR103944 [0,2,0,0,0,0|1,1,0]=4 2497 B9R1.3 OC1=C(Br)C=NC=C1Br HR105723 [0,2,0,0,0,0|1,1,0]=4 2498 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 HR101591 [0,2,0,0,0,0|0,1,0]=3 2499 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 HR16946 [0,2,0,0,0,0|0,1,0]=3 2500 B9R1.3 OC1=C(Cl)C(Cl)=NC=C1 HR152716 [0,2,0,0,0,0|1,1,0]=4 2501 B9R1.3 OC1=C(Cl)C(F)=CC=C1 HR9615 [0,2,0,0,0,0|0,1,0]=3 2502 B9R1.3 OC1=C(Cl)C(F)=NC=C1 HR155463 [0,2,0,0,0,0|1,1,0]=4 2503 B9R1.3 OC1=C(Cl)C=CC=C1F HR2853 [0,2,0,0,0,0|0,1,0]=3 2504 B9R1.3 OC1=C(Cl)C=CC=C1I HR30252 [0,2,0,0,0,0|0,1,0]=3 2505 B9R1.3 OC1=C(Cl)C=CN=C1Cl HR31744 [0,2,0,0,0,0|1,1,0]=4 2506 B9R1.3 OC1=C(Cl)C=NC=C1Cl HR131594 [0,2,0,0,0,0|1,1,0]=4 2507 B9R1.3 OC1=C(Cl)C=NC=C1Cl HR146616 [0,2,0,0,0,0|1,1,0]=4 2508 B9R1.3 OC1=C(F)C(Br)=CC=C1 HR110378 [0,2,0,0,0,0|0,1,0]=3 2509 B9R1.3 OC1=C(F)C(Cl)=CC=C1 HR2855 [0,2,0,0,0,0|0,1,0]=3 2510 B9R1.3 OC1=C(F)C(Cl)=NC=C1 HR152605 [0,2,0,0,0,0|1,1,0]=4 2511 B9R1.3 OC1=C(F)C(F)=CC=C1 HR129170 [0,2,0,0,0,0|0,1,0]=3 2512 B9R1.3 OC1=C(F)C(I)=CC=C1 HR31693 [0,2,0,0,0,0|0,1,0]=3 2513 B9R1.3 OC1=C(F)C=CC=C1F HR128598 [0,2,0,0,0,0|0,1,0]=3 2514 B9R1.3 OC1=C(F)C=CC=C1I HR104284 [0,2,0,0,0,0|0,1,0]=3 2515 B9R1.3 OC1=C(I)C(Br)=CC=C1 HR33537 [0,2,0,0,0,0|0,1,0]=3 2516 B9R1.3 OC1=C(I)C(Cl)=CC=C1 HR32112 [0,2,0,0,0,0|0,1,0]=3 2517 B9R1.3 OC1=C(I)C(F)=CC=C1 HR32107 [0,2,0,0,0,0|0,1,0]=3 2518 B9R1.3 OC1=CC=CC(Br)=C1O HR32763 [0,2,0,0,0,0|0,1,0]=3 2519 B9R1.3 OC1=CC=CC(Cl)=C1O HR30584 [0,2,0,0,0,0|0,1,0]=3 2520 B9R1.3 OC1=CC=CC(F)=C1O HR4142 [0,2,0,0,0,0|0,1,0]=3 2521 B9R1.3 OC1=CC=CC(O)=C1Br HR33240 [0,2,0,0,0,0|0,1,0]=3 2522 B9R1.3 OC1=CC=CC(O)=C1Cl HR30583 [0,2,0,0,0,0|0,1,0]=3 2523 B9R1.3 OC1=CC=CC(O)=C1F HR4141 [0,2,0,0,0,0|0,1,0]=3 2524 B9R1.3 OC1=CC=CC(O)=C1I HR33587 [0,2,0,0,0,0|0,1,0]=3 2525 B9R1.3 OC1=CC=CC(O)=C1O HR133068 [0,2,0,0,0,0|0,1,0]=3 2526 B9R1.3 SC1=C(Cl)C(Cl)=CC=C1 HR141343 [0,2,0,0,0,0|0,0,0]=2 2527 B9R1.3 SC1=C(Cl)C=CC=C1Cl HR127827 [0,2,0,0,0,0|0,0,0]=2 2528 B9R1.3 [O-][N+]1=C(Br)C(O)=CC=C1 HR146491 [0,2,0,0,0,0|1,1,0]=4 2529 B9R1.3 [O-][N+]1=C(Cl)C=CC=C1Cl HR143967 [0,2,0,0,0,0|1,1,0]=4 2530 B9R1.34 BrC1=CC(Br)=CC(Br)=C1 HR134946 [0,2,0,0,0,0|1,0,0]=3 2531 B9R1.34 BrC1=CC(Br)=CC(I)=C1 HR118030 [0,2,0,0,0,0|1,0,0]=3 2532 B9R1.34 BrC1=CC(Br)=NC(Br)=C1 HR147211 [0,2,0,0,0,0|2,0,0]=4 2533 B9R1.34 CC1=CC(=O)C=C(C)O1 HR130901 [0,2,0,0,0,0|1,1,0]=4 2534 B9R1.34 CC1=CC(=O)NC(C)=C1 HR31747 [0,2,0,0,0,0|1,1,0]=4 2535 B9R1.34 CC1=CC(=O)NC(O)=C1 HR107482 [0,2,0,0,0,0|1,1,0]=4 2536 B9R1.34 CC1=CC(Br)=CC(Br)=C1 HR136144 [0,2,0,0,0,0|1,0,0]=3 2537 B9R1.34 CC1=CC(Br)=CC(Br)=N1 HR30715 [0,2,0,0,0,0|2,0,0]=4 2538 B9R1.34 CC1=CC(Br)=CC(C)=N1 HR115742 [0,2,0,0,0,0|2,0,0]=4 2539 B9R1.34 CC1=CC(Br)=CC(Cl)=C1 HR32696 [0,2,0,0,0,0|1,0,0]=3 2540 B9R1.34 CC1=CC(Br)=CC(F)=C1 HR128264 [0,2,0,0,0,0|1,0,0]=3 2541 B9R1.34 CC1=CC(Br)=CC(N)=N1 HR118060 [0,2,0,0,0,0|2,0,0]=4 2542 B9R1.34 CC1=CC(Br)=NC(Br)=C1 HR147927 [0,2,0,0,0,0|2,0,0]=4 2543 B9R1.34 CC1=CC(Br)=NC(C)=C1 HR128572 [0,2,0,0,0,0|2,0,0]=4 2544 B9R1.34 CC1=CC(Br)=NC(Cl)=C1 HR104265 [0,2,0,0,0,0|2,0,0]=4 2545 B9R1.34 CC1=CC(Br)=NC(F)=C1 HR117325 [0,2,0,0,0,0|2,0,0]=4 2546 B9R1.34 CC1=CC(C)=CC(Br)=C1 HR136698 [0,2,0,0,0,0|1,0,0]=3 2547 B9R1.34 CC1=CC(C)=CC(Cl)=C1 HR110356 [0,2,0,0,0,0|1,0,0]=3 2548 B9R1.34 CC1=CC(C)=CC(I)=C1 HR116946 [0,2,0,0,0,0|1,0,0]=3 2549 B9R1.34 CC1=CC(C)=CC(S)=C1 HR144518 [0,2,0,0,0,0|0,0,0]=2 2550 B9R1.34 CC1=CC(C)=NC(C)=C1 HR124242 [0,2,0,0,0,0|2,0,0]=4 2551 B9R1.34 CC1=CC(C)=NC(S)=N1 HR136163 [0,2,0,0,0,0|2,0,0]=4 2552 B9R1.34 CC1=CC(Cl)=CC(C)=N1 HR112668 [0,2,0,0,0,0|2,0,0]=4 2553 B9R1.34 CC1=CC(Cl)=CC(Cl)=C1 HR31998 [0,2,0,0,0,0|1,0,0]=3 2554 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 HR136833 [0,2,0,0,0,0|2,0,0]=4 2555 B9R1.34 CC1=CC(Cl)=CC(N)=N1 HR116155 [0,2,0,0,0,0|2,0,0]=4 2556 B9R1.34 CC1=CC(Cl)=NC(C)=C1 HR3919 [0,2,0,0,0,0|2,0,0]=4 2557 B9R1.34 CC1=CC(Cl)=NC(Cl)=C1 HR5534 [0,2,0,0,0,0|2,0,0]=4 2558 B9R1.34 CC1=CC(F)=CC(F)=C1 HR132252 [0,2,0,0,0,0|1,0,0]=3 2559 B9R1.34 CC1=CC(I)=CC(F)=C1 HR114076 [0,2,0,0,0,0|1,0,0]=3 2560 B9R1.34 CC1=CC(I)=CC(F)=N1 HR148317 [0,2,0,0,0,0|2,0,0]=4 2561 B9R1.34 CC1=CC(N)=CC(Br)=C1 HR115603 [0,2,0,0,0,0|1,0,0]=3 2562 B9R1.34 CC1=CC(N)=CC(Br)=N1 HR30716 [0,2,0,0,0,0|2,0,0]=4 2563 B9R1.34 CC1=CC(N)=CC(C)=N1 HR117343 [0,2,0,0,0,0|2,0,0]=4 2564 B9R1.34 CC1=CC(N)=CC(Cl)=C1 HR142592 [0,2,0,0,0,0|1,0,0]=3 2565 B9R1.34 CC1=CC(N)=CC(Cl)=N1 HR30321 [0,2,0,0,0,0|2,0,0]=4 2566 B9R1.34 CC1=CC(N)=CC(F)=C1 HR1537 [0,2,0,0,0,0|1,0,0]=3 2567 B9R1.34 CC1=CC(N)=NC(C)=C1 HR135129 [0,2,0,0,0,0|2,0,0]=4 2568 B9R1.34 CC1=CC(N)=NC(Cl)=C1 HR147254 [0,2,0,0,0,0|2,0,0]=4 2569 B9R1.34 CC1=CC(N)=NC(N)=C1 HR105399 [0,2,0,0,0,0|2,0,0]=4 2570 B9R1.34 CC1=CC(O)=CC(Br)=C1 HR4137 [0,2,0,0,0,0|0,1,0]=3 2571 B9R1.34 CC1=CC(O)=CC(C)=N1 HR127510 [0,2,0,0,0,0|1,1,0]=4 2572 B9R1.34 CC1=CC(O)=CC(Cl)=C1 HR32695 [0,2,0,0,0,0|0,1,0]=3 2573 B9R1.34 CC1=CC(O)=CC(Cl)=N1 HR30623 [0,2,0,0,0,0|1,1,0]=4 2574 B9R1.34 CC1=CC(O)=CC(F)=C1 HR139881 [0,2,0,0,0,0|0,1,0]=3 2575 B9R1.34 CC1=CC(O)=CC(N)=C1 HR109574 [0,2,0,0,0,0|0,1,0]=3 2576 B9R1.34 CC1=CC(O)=CC(O)=C1 HR129647 [0,2,0,0,0,0|0,1,0]=3 2577 B9R1.34 CC1=CC(O)=CC(O)=N1 HR147218 [0,2,0,0,0,0|1,1,0]=4 2578 B9R1.34 CC1=CC(O)=CC(O)=N1 HR22295 [0,2,0,0,0,0|1,1,0]=4 2579 B9R1.34 Cc1cc(C)cc(F)c1 HR135765 [0,2,0,0,0,0|1,0,0]=3 2580 B9R1.34 Cc1cc(N)cc(Br)c1 HR117875 [0,2,0,0,0,0|1,0,0]=3 2581 B9R1.34 Cc1cc(O)cc(=O)o1 HR125347 [0,2,0,0,0,0|1,1,0]=4 2582 B9R1.34 ClC1=CC(Br)=CC(Br)=C1 HR123751 [0,2,0,0,0,0|1,0,0]=3 2583 B9R1.34 ClC1=CC(Cl)=CC(Br)=C1 HR3612 [0,2,0,0,0,0|1,0,0]=3 2584 B9R1.34 ClC1=CC(Cl)=CC(I)=C1 HR113976 [0,2,0,0,0,0|1,0,0]=3 2585 B9R1.34 ClC1=CC(Cl)=NC(Cl)=C1 HR11020 [0,2,0,0,0,0|2,0,0]=4 2586 B9R1.34 ClC1=CC(I)=CC(Br)=C1 HR115424 [0,2,0,0,0,0|1,0,0]=3 2587 B9R1.34 ClC1=CC(I)=CC(Cl)=N1 HR137530 [0,2,0,0,0,0|2,0,0]=4 2588 B9R1.34 FC1=CC(Br)=CC(Br)=C1 HR125350 [0,2,0,0,0,0|1,0,0]=3 2589 B9R1.34 FC1=CC(Br)=CC(Cl)=C1 HR131324 [0,2,0,0,0,0|1,0,0]=3 2590 B9R1.34 FC1=CC(Br)=CC(F)=N1 HR118370 [0,2,0,0,0,0|2,0,0]=4 2591 B9R1.34 FC1=CC(Br)=NC(F)=C1 HR118685 [0,2,0,0,0,0|2,0,0]=4 2592 B9R1.34 FC1=CC(Cl)=CC(Cl)=C1 HR130918 [0,2,0,0,0,0|1,0,0]=3 2593 B9R1.34 FC1=CC(F)=CC(Br)=C1 HR126461 [0,2,0,0,0,0|1,0,0]=3 2594 B9R1.34 FC1=CC(F)=CC(Cl)=C1 HR138001 [0,2,0,0,0,0|1,0,0]=3 2595 B9R1.34 FC1=CC(F)=CC(F)=C1 HR1069 [0,2,0,0,0,0|1,0,0]=3 2596 B9R1.34 FC1=CC(F)=CC(F)=C1 HR150409 [0,2,0,0,0,0|1,0,0]=3 2597 B9R1.34 FC1=CC(F)=CC(I)=C1 HR134485 [0,2,0,0,0,0|1,0,0]=3 2598 B9R1.34 FC1=CC(F)=CC(S)=C1 HR142316 [0,2,0,0,0,0|0,0,0]=2 2599 B9R1.34 FC1=CC(F)=NC(F)=C1 HR140474 [0,2,0,0,0,0|2,0,0]=4 2600 B9R1.34 FC1=CC(I)=CC(Br)=C1 HR110335 [0,2,0,0,0,0|1,0,0]=3 2601 B9R1.34 FC1=CC(I)=CC(F)=N1 HR156647 [0,2,0,0,0,0|2,0,0]=4 2602 B9R1.34 NC1=CC(Br)=CC(Br)=C1 HR140371 [0,2,0,0,0,0|1,0,0]=3 2603 B9R1.34 NC1=CC(Br)=CC(Cl)=C1 HR106663 [0,2,0,0,0,0|1,0,0]=3 2604 B9R1.34 NC1=CC(Br)=CC(N)=N1 HR112982 [0,2,0,0,0,0|2,0,0]=4 2605 B9R1.34 NC1=CC(Br)=CC(O)=C1 HR32073 [0,2,0,0,0,0|0,1,0]=3 2606 B9R1.34 NC1=CC(Br)=NC(Br)=C1 HR114576 [0,2,0,0,0,0|2,0,0]=4 2607 B9R1.34 NC1=CC(Cl)=CC(Cl)=C1 HR147330 [0,2,0,0,0,0|1,0,0]=3 2608 B9R1.34 NC1=CC(Cl)=CC(F)=C1 HR2953 [0,2,0,0,0,0|1,0,0]=3 2609 B9R1.34 NC1=CC(Cl)=CC(N)=N1 HR103428 [0,2,0,0,0,0|2,0,0]=4 2610 B9R1.34 NC1=CC(Cl)=NC(Cl)=C1 HR131992 [0,2,0,0,0,0|2,0,0]=4 2611 B9R1.34 NC1=CC(F)=CC(Br)=C1 HR139986 [0,2,0,0,0,0|1,0,0]=3 2612 B9R1.34 NC1=CC(F)=CC(F)=C1 HR124646 [0,2,0,0,0,0|1,0,0]=3 2613 B9R1.34 NC1=CC(F)=CC(I)=C1 HR143864 [0,2,0,0,0,0|1,0,0]=3 2614 B9R1.34 NC1=CC(F)=NC(F)=C1 HR32430 [0,2,0,0,0,0|2,0,0]=4 2615 B9R1.34 NC1=CC(N)=CC(N)=C1 HR142941 [0,2,0,0,0,0|1,0,0]=3 2616 B9R1.34 NC1=CC(N)=CC(N)=C1 HR30165 [0,2,0,0,0,0|1,0,0]=3 2617 B9R1.34 NC1=CC(N)=NC(S)=N1 HR132562 [0,2,0,0,0,0|2,0,0]=4 2618 B9R1.34 NC1=CC(O)=CC(O)=C1 HR147471 [0,2,0,0,0,0|0,1,0]=3 2619 B9R1.34 NC1=NC(Cl)=CC(Cl)=C1 HR105525 [0,2,0,0,0,0|2,0,0]=4 2620 B9R1.34 NC1=NC(N)=NC(S)=C1 HR114875 [0,2,0,0,0,0|2,0,0]=4 2621 B9R1.34 NC1=NC(S)=CC(=O)N1 HR103777 [0,2,0,0,0,0|2,0,0]=4 2622 B9R1.34 NC1=NC(S)=NC(O)=C1 HR132840 [0,2,0,0,0,0|2,0,0]=4 2623 B9R1.34 OC1=CC(Br)=CC(Br)=C1 HR117124 [0,2,0,0,0,0|0,1,0]=3 2624 B9R1.34 OC1=CC(Br)=CC(Cl)=C1 HR116841 [0,2,0,0,0,0|0,1,0]=3 2625 B9R1.34 OC1=CC(Br)=CC(F)=C1 HR131189 [0,2,0,0,0,0|0,1,0]=3 2626 B9R1.34 OC1=CC(Br)=CC(I)=C1 HR113511 [0,2,0,0,0,0|0,1,0]=3 2627 B9R1.34 OC1=CC(Cl)=CC(Cl)=C1 HR3699 [0,2,0,0,0,0|0,1,0]=3 2628 B9R1.34 OC1=CC(Cl)=CC(F)=C1 HR31588 [0,2,0,0,0,0|0,1,0]=3 2629 B9R1.34 OC1=CC(Cl)=CC(I)=C1 HR142997 [0,2,0,0,0,0|0,1,0]=3 2630 B9R1.34 OC1=CC(Cl)=NC(Cl)=C1 HR108541 [0,2,0,0,0,0|1,1,0]=4 2631 B9R1.34 OC1=CC(F)=CC(F)=C1 HR1496 [0,2,0,0,0,0|0,1,0]=3 2632 B9R1.34 OC1=CC(O)=CC(Br)=C1 HR105089 [0,2,0,0,0,0|0,1,0]=3 2633 B9R1.34 OC1=CC(O)=CC(F)=C1 HR154591 [0,2,0,0,0,0|0,1,0]=3 2634 B9R1.34 OC1=CC(O)=CC(O)=C1 HR103820 [0,2,0,0,0,0|0,1,0]=3 2635 B9R1.34 OC1=CC(O)=NC(S)=N1 HR146759 [0,2,0,0,0,0|2,0,0]=4 2636 B9R1.34 SC1=CC(Cl)=CC(Cl)=C1 HR143865 [0,2,0,0,0,0|0,0,0]=2 2637 B9R1.34 [O-][N+]1=CC(Br)=CC(Br)=C1 HR140178 [0,2,0,0,0,0|1,1,0]=4 2638 B9R2.50 C1=CC=C2CCC2=C1 HR131102 [0,1,0,1,0,0|1,0,0]=3 2639 B5R1.1 C1=CNC=C1 HR147707 [1,0,0,0,1,0|1,0,0]=3 2640 B5R1.1 C1=CNC=N1 HR131665 [1,0,0,0,1,0|2,0,0]=4 2641 B5R1.1 C1=CNC=N1 PRCQ00204 [1,0,0,0,1,0|2,0,0]=4 2642 B5R1.1 C1=CNN=C1 HR127099 [1,0,0,0,1,0|2,0,0]=4 2643 B5R1.1 C1=COC=N1 HR135535 [1,0,0,0,1,0|2,0,0]=4 2644 B5R1.1 C1=CON=C1 HR8623 [1,0,0,0,1,0|2,0,0]=4 2645 B5R1.1 C1=CSC=C1 HR147733 [1,0,0,0,1,0|1,0,0]=3 2646 B5R1.1 C1=CSC=N1 HR127648 [1,0,0,0,1,0|2,0,0]=4 2647 B5R1.1 C1=CSN=C1 HR114528 [1,0,0,0,1,0|2,0,0]=4 2648 B5R1.1 C1=C[CH-]C=C1 HR101505 [1,0,0,0,1,0|0,0,1]=3 2649 B5R1.1 C1=C[CH-]C=C1 HR138115 [1,0,0,0,1,0|0,0,1]=3 2650 B5R1.1 C1=C[CH-]C=C1 HR141305 [1,0,0,0,1,0|0,0,1]=3 2651 B5R1.1 C1=C[CH-]C=C1 HR144503 [1,0,0,0,1,0|0,0,1]=3