0 B7R1.1 BrCC1=CC=CO1 AC-83854 [0,0,0,0,0,0|1,0,0]=1 1 B7R1.1 BrCC1=CN=CS1 AC-89026 [0,0,0,0,0,0|2,1,0]=3 2 B7R1.1 BrCC1=CN=CS1 AC-94581 [0,0,0,0,0,0|2,1,0]=3 3 B7R1.1 BrCC1=CNC=N1 AC-93969 [0,0,0,0,0,0|3,0,0]=3 4 B7R1.1 BrCC1=COC=C1 AC-76496 [0,0,0,0,0,0|3,0,0]=3 5 B7R1.1 BrCC1=CSC=C1 AC-16184 [0,0,0,0,0,0|3,0,0]=3 6 B7R1.1 BrCC1=NC=CN1 AC-79480 [0,0,0,0,0,0|3,0,0]=3 7 B7R1.1 BrCC1=NC=CN1 AC-91839 [0,0,0,0,0,0|3,0,0]=3 8 B7R1.1 BrCC1=NC=CS1 AC-76091 [0,0,0,0,0,0|2,1,0]=3 9 B7R1.1 BrCC1=NOC=C1 AC-44488 [0,0,0,0,0,0|3,0,0]=3 10 B7R1.1 C#CC1=CC=CS1 AC-85448 [0,0,0,0,0,0|1,1,1]=3 11 B7R1.1 CCC1=NC=CN1 AC-76773 [0,0,0,0,0,0|3,0,0]=3 12 B7R1.1 CCC1=NC=CS1 AC-29297 [0,0,0,0,0,0|2,1,0]=3 13 B7R1.1 CCC1=NN=CO1 AC-86829 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.1 CCN1C=CC=N1 AC-50245 [0,0,0,0,0,0|3,0,0]=3 15 B7R1.1 CCN1C=NC=N1 AC-93286 [0,0,0,0,0,0|4,0,0]=4 16 B7R1.1 CNC1=NC=CS1 AC-80039 [0,0,0,0,0,0|3,1,0]=4 17 B7R1.1 COC1=NC=CS1 AC-13529 [0,0,0,0,0,0|3,1,0]=4 18 B7R1.1 ClCC1=CC=CS1 AC-26301 [0,0,0,0,0,0|1,1,0]=2 19 B7R1.1 ClCC1=CN=CS1 AC-80908 [0,0,0,0,0,0|2,1,0]=3 20 B7R1.1 ClCC1=COC=N1 AC-95204 [0,0,0,0,0,0|3,0,0]=3 21 B7R1.1 ClCC1=CSC=N1 AC-14339 [0,0,0,0,0,0|3,0,0]=3 22 B7R1.1 ClCC1=NC=CN1 AC-80845 [0,0,0,0,0,0|3,0,0]=3 23 B7R1.1 ClCC1=NC=CS1 AC-46118 [0,0,0,0,0,0|2,1,0]=3 24 B7R1.1 ClCC1=NOC=C1 AC-94658 [0,0,0,0,0,0|3,0,0]=3 25 B7R1.1 ClCN1C=CC=N1 AC-75752 [0,0,0,0,0,0|3,0,0]=3 26 B7R1.1 N#CC1=CC=NO1 AC-81006 [0,0,0,0,0,0|2,0,1]=3 27 B7R1.1 N#CC1=CN=CS1 AC-27197 [0,0,0,0,0,0|2,1,1]=4 28 B7R1.1 N#CC1=CNC=C1 AC-37646 [0,0,0,0,0,0|3,0,1]=4 29 B7R1.1 N#CC1=CSC=C1 AC-17501 [0,0,0,0,0,0|3,0,1]=4 30 B7R1.1 N#CC1=CSC=N1 AC-45221 [0,0,0,0,0,0|3,0,1]=4 31 B7R1.1 N#CC1=NC=CN1 AC-70281 [0,0,0,0,0,0|3,0,1]=4 32 B7R1.1 N#CC1=NC=CO1 AC-87260 [0,0,0,0,0,0|2,0,1]=3 33 B7R1.1 N#CC1=NC=CS1 AC-77133 [0,0,0,0,0,0|2,1,1]=4 34 B7R1.1 N#CC1=NNC=C1 AC-27168 [0,0,0,0,0,0|3,0,1]=4 35 B7R1.1 N#CC1=NOC=C1 AC-30087 [0,0,0,0,0,0|3,0,1]=4 36 B7R1.1 NCC1=CC=CN1 AC-94850 [0,0,0,0,0,0|2,0,0]=2 37 B7R1.1 NCC1=CC=CS1 AC-13549 [0,0,0,0,0,0|1,1,0]=2 38 B7R1.1 NCC1=CC=NO1 AC-34902 [0,0,0,0,0,0|2,0,0]=2 39 B7R1.1 NCC1=CC=NO1 AC-82629 [0,0,0,0,0,0|2,0,0]=2 40 B7R1.1 NCC1=CN=CO1 AC-77227 [0,0,0,0,0,0|2,0,0]=2 41 B7R1.1 NCC1=CN=CS1 AC-41503 [0,0,0,0,0,0|2,1,0]=3 42 B7R1.1 NCC1=CN=CS1 AC-50455 [0,0,0,0,0,0|2,1,0]=3 43 B7R1.1 NCC1=CNC=C1 AC-86964 [0,0,0,0,0,0|3,0,0]=3 44 B7R1.1 NCC1=CNC=N1 AC-75396 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.1 NCC1=CNC=N1 AC-81092 [0,0,0,0,0,0|3,0,0]=3 46 B7R1.1 NCC1=CNN=C1 AC-70129 [0,0,0,0,0,0|4,0,0]=4 47 B7R1.1 NCC1=COC=N1 AC-70218 [0,0,0,0,0,0|3,0,0]=3 48 B7R1.1 NCC1=COC=N1 AC-72092 [0,0,0,0,0,0|3,0,0]=3 49 B7R1.1 NCC1=CON=C1 AC-81407 [0,0,0,0,0,0|4,0,0]=4 50 B7R1.1 NCC1=CSC=C1 AC-46249 [0,0,0,0,0,0|3,0,0]=3 51 B7R1.1 NCC1=CSC=N1 AC-44543 [0,0,0,0,0,0|3,0,0]=3 52 B7R1.1 NCC1=NC=CN1 AC-29781 [0,0,0,0,0,0|3,0,0]=3 53 B7R1.1 NCC1=NC=CO1 AC-88063 [0,0,0,0,0,0|2,0,0]=2 54 B7R1.1 NCC1=NC=CS1 AC-32428 [0,0,0,0,0,0|2,1,0]=3 55 B7R1.1 NCC1=NC=CS1 AC-45443 [0,0,0,0,0,0|2,1,0]=3 56 B7R1.1 NCC1=NC=CS1 AC-50453 [0,0,0,0,0,0|2,1,0]=3 57 B7R1.1 NCC1=NN=CO1 AC-88448 [0,0,0,0,0,0|3,0,0]=3 58 B7R1.1 NCC1=NNC=C1 AC-34918 [0,0,0,0,0,0|3,0,0]=3 59 B7R1.1 NCC1=NNC=C1 AC-75399 [0,0,0,0,0,0|3,0,0]=3 60 B7R1.1 NCC1=NOC=C1 AC-87053 [0,0,0,0,0,0|3,0,0]=3 61 B7R1.1 NNC1=NC=CN1 AC-86445 [0,0,0,0,0,0|4,0,0]=4 62 B7R1.1 O=CC1=CC=CS1 AC-61053 [0,0,0,0,0,0|0,2,1]=3 63 B7R1.1 O=CC1=CC=NN1 AC-80397 [0,0,0,0,0,0|2,1,1]=4 64 B7R1.1 O=CC1=CC=NO1 AC-42863 [0,0,0,0,0,0|1,1,1]=3 65 B7R1.1 O=CC1=CN=CS1 AC-21275 [0,0,0,0,0,0|1,2,1]=4 66 B7R1.1 O=CC1=CNC=C1 AC-63694 [0,0,0,0,0,0|2,1,1]=4 67 B7R1.1 O=CC1=COC=C1 AC-61908 [0,0,0,0,0,0|2,1,1]=4 68 B7R1.1 O=CC1=CSC=C1 AC-13155 [0,0,0,0,0,0|2,1,1]=4 69 B7R1.1 O=CC1=CSC=N1 AC-21274 [0,0,0,0,0,0|2,1,1]=4 70 B7R1.1 O=CC1=NC=CN1 AC-20268 [0,0,0,0,0,0|2,1,1]=4 71 B7R1.1 O=CC1=NC=CS1 AC-13531 [0,0,0,0,0,0|1,2,1]=4 72 B7R1.1 O=CC1=NNC=C1 AC-40933 [0,0,0,0,0,0|2,1,1]=4 73 B7R1.1 O=CC1=NNC=C1 AC-94677 [0,0,0,0,0,0|2,1,1]=4 74 B7R1.1 OCC1=CC=CN1 AC-87348 [0,0,0,0,0,0|1,1,0]=2 75 B7R1.1 OCC1=CC=NO1 AC-80699 [0,0,0,0,0,0|1,1,0]=2 76 B7R1.1 OCC1=CN=CO1 AC-45049 [0,0,0,0,0,0|1,1,0]=2 77 B7R1.1 OCC1=CN=CS1 AC-14542 [0,0,0,0,0,0|1,2,0]=3 78 B7R1.1 OCC1=CNN=C1 AC-45239 [0,0,0,0,0,0|3,1,0]=4 79 B7R1.1 OCC1=COC=C1 AC-45361 [0,0,0,0,0,0|2,1,0]=3 80 B7R1.1 OCC1=COC=N1 AC-45032 [0,0,0,0,0,0|2,1,0]=3 81 B7R1.1 OCC1=CSC=C1 AC-62945 [0,0,0,0,0,0|2,1,0]=3 82 B7R1.1 OCC1=CSC=N1 AC-21277 [0,0,0,0,0,0|2,1,0]=3 83 B7R1.1 OCC1=CSN=C1 AC-94856 [0,0,0,0,0,0|3,1,0]=4 84 B7R1.1 OCC1=NC=CO1 AC-90952 [0,0,0,0,0,0|1,1,0]=2 85 B7R1.1 OCC1=NC=CS1 AC-42239 [0,0,0,0,0,0|1,2,0]=3 86 B7R1.1 OCC1=NNC=C1 AC-40869 [0,0,0,0,0,0|2,1,0]=3 87 B7R1.1 OCC1=NNC=C1 AC-45347 [0,0,0,0,0,0|2,1,0]=3 88 B7R1.1 OCN1C=CN=C1 AC-90927 [0,0,0,0,0,0|3,1,0]=4 89 B6R1.2 BrC1=CC=CS1 AC-13542 [1,0,0,0,0,0|1,1,0]=3 90 B6R1.2 BrC1=CC=NN1 AC-77336 [1,0,0,0,0,0|3,0,0]=4 91 B6R1.2 BrC1=COC=C1 AC-76818 [1,0,0,0,0,0|3,0,0]=4 92 B6R1.2 BrC1=CSC=C1 AC-13152 [1,0,0,0,0,0|3,0,0]=4 93 B6R1.2 BrC1=NC=CN1 AC-25036 [1,0,0,0,0,0|3,0,0]=4 94 B6R1.2 BrC1=NC=CS1 AC-14180 [1,0,0,0,0,0|2,1,0]=4 95 B6R1.2 BrC1=NNC=C1 AC-25466 [1,0,0,0,0,0|3,0,0]=4 96 B6R1.2 BrC1=NOC=C1 AC-44673 [1,0,0,0,0,0|3,0,0]=4 97 B6R1.2 BrC1=NSC=C1 AC-33995 [1,0,0,0,0,0|3,0,0]=4 98 B6R1.2 CC1=CC=CN1 AC-76876 [1,0,0,0,0,0|1,0,0]=2 99 B6R1.2 CC1=CC=CS1 AC-13544 [1,0,0,0,0,0|0,1,0]=2 100 B6R1.2 CC1=CC=NO1 AC-61136 [1,0,0,0,0,0|1,0,0]=2 101 B6R1.2 CC1=CN=CS1 AC-61630 [1,0,0,0,0,0|1,1,0]=3 102 B6R1.2 CC1=CNC=C1 AC-31721 [1,0,0,0,0,0|2,0,0]=3 103 B6R1.2 CC1=CNC=N1 AC-74092 [1,0,0,0,0,0|2,0,0]=3 104 B6R1.2 CC1=CNN=C1 AC-40914 [1,0,0,0,0,0|3,0,0]=4 105 B6R1.2 CC1=CNN=N1 AC-81046 [1,0,0,0,0,0|3,0,0]=4 106 B6R1.2 CC1=CSC=C1 AC-13559 [1,0,0,0,0,0|2,0,0]=3 107 B6R1.2 CC1=CSC=N1 AC-70267 [1,0,0,0,0,0|2,0,0]=3 108 B6R1.2 CC1=NC=CO1 AC-79510 [1,0,0,0,0,0|1,0,0]=2 109 B6R1.2 CC1=NC=CS1 AC-13530 [1,0,0,0,0,0|1,1,0]=3 110 B6R1.2 CC1=NCCO1 AC-82993 [1,0,0,0,0,0|1,0,2]=4 111 B6R1.2 CC1=NN=CO1 AC-80084 [1,0,0,0,0,0|2,0,0]=3 112 B6R1.2 CC1=NNC=C1 AC-31436 [1,0,0,0,0,0|2,0,0]=3 113 B6R1.2 CC1=NOC=C1 AC-79826 [1,0,0,0,0,0|2,0,0]=3 114 B6R1.2 CC1=NON=C1 AC-91556 [1,0,0,0,0,0|3,0,0]=4 115 B6R1.2 CN1C=CC=N1 AC-40913 [1,0,0,0,0,0|2,0,0]=3 116 B6R1.2 CN1C=CN=N1 AC-31956 [1,0,0,0,0,0|3,0,0]=4 117 B6R1.2 CN1C=NC=N1 AC-31955 [1,0,0,0,0,0|3,0,0]=4 118 B6R1.2 ClC1=CC=NN1 AC-81136 [1,0,0,0,0,0|3,0,0]=4 119 B6R1.2 ClC1=CNC=N1 AC-25904 [1,0,0,0,0,0|3,0,0]=4 120 B6R1.2 ClC1=CSC=C1 AC-13557 [1,0,0,0,0,0|3,0,0]=4 121 B6R1.2 ClC1=NC=CS1 AC-26932 [1,0,0,0,0,0|2,1,0]=4 122 B6R1.2 FC1=CC=NN1 AC-88376 [1,0,0,0,0,0|3,0,0]=4 123 B6R1.2 FC1=NC=CN1 AC-83757 [1,0,0,0,0,0|3,0,0]=4 124 B6R1.2 FC1=NC=CN1 AC-84741 [1,0,0,0,0,0|3,0,0]=4 125 B6R1.2 IC1=CC=CS1 AC-13543 [1,0,0,0,0,0|1,1,0]=3 126 B6R1.2 IC1=CC=NN1 AC-77422 [1,0,0,0,0,0|3,0,0]=4 127 B6R1.2 IC1=CNC=N1 AC-29921 [1,0,0,0,0,0|3,0,0]=4 128 B6R1.2 IC1=NC=CN1 AC-23771 [1,0,0,0,0,0|3,0,0]=4 129 B6R1.2 NC1=CC=CS1 AC-84538 [1,0,0,0,0,0|1,1,0]=3 130 B6R1.2 NC1=CC=CS1 AC-87247 [1,0,0,0,0,0|1,1,0]=3 131 B6R1.2 NC1=CC=NN1 AC-75921 [1,0,0,0,0,0|3,0,0]=4 132 B6R1.2 NC1=CC=NO1 AC-30090 [1,0,0,0,0,0|2,0,0]=3 133 B6R1.2 NC1=CC=NS1 AC-82048 [1,0,0,0,0,0|2,1,0]=4 134 B6R1.2 NC1=CN=CS1 AC-62963 [1,0,0,0,0,0|2,1,0]=4 135 B6R1.2 NC1=CNC=N1 AC-24564 [1,0,0,0,0,0|3,0,0]=4 136 B6R1.2 NC1=CNC=N1 AC-80611 [1,0,0,0,0,0|3,0,0]=4 137 B6R1.2 NC1=CNC=N1 AC-80945 [1,0,0,0,0,0|3,0,0]=4 138 B6R1.2 NC1=COC=C1 AC-86478 [1,0,0,0,0,0|3,0,0]=4 139 B6R1.2 NC1=COC=N1 AC-86667 [1,0,0,0,0,0|3,0,0]=4 140 B6R1.2 NC1=CSC=C1 AC-46207 [1,0,0,0,0,0|3,0,0]=4 141 B6R1.2 NC1=CSC=C1 AC-81635 [1,0,0,0,0,0|3,0,0]=4 142 B6R1.2 NC1=CSC=N1 AC-92448 [1,0,0,0,0,0|3,0,0]=4 143 B6R1.2 NC1=NC=CN1 AC-93291 [1,0,0,0,0,0|3,0,0]=4 144 B6R1.2 NC1=NC=CO1 AC-40000 [1,0,0,0,0,0|2,0,0]=3 145 B6R1.2 NC1=NNC=C1 AC-12678 [1,0,0,0,0,0|3,0,0]=4 146 B6R1.2 NC1=NOC=C1 AC-15172 [1,0,0,0,0,0|3,0,0]=4 147 B6R1.2 NN1C=CC=C1 AC-32518 [1,0,0,0,0,0|3,0,0]=4 148 B6R1.2 O=C1CC=CC1 AC-37498 [1,0,0,0,0,0|1,1,1]=4 149 B6R1.2 OC1=CSC=C1 AC-80187 [1,0,0,0,0,0|2,1,0]=4 150 B6R1.2 SC1=NC=CN1 AC-75915 [1,0,0,0,0,0|2,0,0]=3 151 B6R1.2 SC1=NNC=N1 AC-14293 [1,0,0,0,0,0|3,0,0]=4 152 B8R1.1 BrCC1=CC=C(Br)O1 AC-82472 [0,1,0,0,0,0|1,0,0]=2 153 B8R1.1 BrCC1=CN=C(Br)S1 AC-93720 [0,1,0,0,0,0|2,1,0]=4 154 B8R1.1 BrCC1=CSC(Br)=N1 AC-86420 [0,1,0,0,0,0|3,0,0]=4 155 B8R1.1 C#CC1=CC=C(Cl)S1 AC-89028 [0,1,0,0,0,0|1,1,1]=4 156 B8R1.1 CC1=CC(CBr)=NO1 AC-76495 [0,1,0,0,0,0|3,0,0]=4 157 B8R1.1 CC1=CC(CCl)=NO1 AC-17450 [0,1,0,0,0,0|3,0,0]=4 158 B8R1.1 CC1=CN=C(CCl)S1 AC-56741 [0,1,0,0,0,0|2,1,0]=4 159 B8R1.1 CC1=CN=C(CO)S1 AC-31859 [0,1,0,0,0,0|1,2,0]=4 160 B8R1.1 CC1=CSC(CO)=C1 AC-42277 [0,1,0,0,0,0|0,2,0]=3 161 B8R1.1 CC1=CSC(CO)=N1 AC-31867 [0,1,0,0,0,0|1,2,0]=4 162 B8R1.1 CC1=NC(CBr)=CO1 AC-94273 [0,1,0,0,0,0|3,0,0]=4 163 B8R1.1 CC1=NC(CBr)=CS1 AC-94936 [0,1,0,0,0,0|3,0,0]=4 164 B8R1.1 CC1=NC(CN)=CO1 AC-82857 [0,1,0,0,0,0|3,0,0]=4 165 B8R1.1 CC1=NC(CN)=CS1 AC-34900 [0,1,0,0,0,0|3,0,0]=4 166 B8R1.1 CC1=NC(CO)=CO1 AC-75448 [0,1,0,0,0,0|2,1,0]=4 167 B8R1.1 CC1=NC(CO)=CS1 AC-46149 [0,1,0,0,0,0|2,1,0]=4 168 B8R1.1 CC1=NC=C(C#N)O1 AC-84775 [0,1,0,0,0,0|2,0,1]=4 169 B8R1.1 CC1=NC=C(CBr)O1 AC-94274 [0,1,0,0,0,0|2,0,0]=3 170 B8R1.1 CC1=NN=C(CCl)O1 AC-44490 [0,1,0,0,0,0|3,0,0]=4 171 B8R1.1 CC1=NN=C(CN)O1 AC-89297 [0,1,0,0,0,0|3,0,0]=4 172 B8R1.1 CC1=NOC(CCl)=N1 AC-45092 [0,1,0,0,0,0|3,0,0]=4 173 B8R1.1 CCC1=CN=C(N)S1 AC-45558 [0,1,0,0,0,0|2,1,0]=4 174 B8R1.1 CCC1=CSC(Cl)=N1 AC-84308 [0,1,0,0,0,0|3,0,0]=4 175 B8R1.1 CCC1=NC=C(Br)S1 AC-82021 [0,1,0,0,0,0|2,1,0]=4 176 B8R1.1 CCC1=NNC(N)=C1 AC-29251 [0,1,0,0,0,0|3,0,0]=4 177 B8R1.1 CCC1=NOC(N)=C1 AC-89811 [0,1,0,0,0,0|3,0,0]=4 178 B8R1.1 CCN1C=C(Br)C=N1 AC-50247 [0,1,0,0,0,0|3,0,0]=4 179 B8R1.1 CCN1C=CC(C)=N1 AC-50257 [0,1,0,0,0,0|3,0,0]=4 180 B8R1.1 CN1C=CC(CCl)=N1 AC-76499 [0,1,0,0,0,0|3,0,0]=4 181 B8R1.1 CN1C=CC(CN)=N1 AC-31609 [0,1,0,0,0,0|3,0,0]=4 182 B8R1.1 CN1C=CC(CN)=N1 AC-89994 [0,1,0,0,0,0|3,0,0]=4 183 B8R1.1 CN1C=CC(CO)=N1 AC-44857 [0,1,0,0,0,0|2,1,0]=4 184 B8R1.1 CN1C=NC(CBr)=C1 AC-90839 [0,1,0,0,0,0|3,0,0]=4 185 B8R1.1 CN1C=NC(CN)=C1 AC-64684 [0,1,0,0,0,0|3,0,0]=4 186 B8R1.1 CN1C=NC(CN)=C1 AC-70280 [0,1,0,0,0,0|3,0,0]=4 187 B8R1.1 CN1C=NC(CO)=C1 AC-42223 [0,1,0,0,0,0|2,1,0]=4 188 B8R1.1 ClCC1=CC(Br)=NO1 AC-39670 [0,1,0,0,0,0|2,0,0]=3 189 B8R1.1 ClCC1=CC=C(Br)O1 AC-76278 [0,1,0,0,0,0|1,0,0]=2 190 B8R1.1 ClCC1=CN=C(Cl)S1 AC-13520 [0,1,0,0,0,0|2,1,0]=4 191 B8R1.1 ClCC1=CSC(Br)=N1 AC-96572 [0,1,0,0,0,0|3,0,0]=4 192 B8R1.1 ClCC1=CSC(Cl)=N1 AC-46113 [0,1,0,0,0,0|3,0,0]=4 193 B8R1.1 ClCC1=NC=C(Br)S1 AC-96314 [0,1,0,0,0,0|2,1,0]=4 194 B8R1.1 N#CC1=CC(Br)=CS1 AC-87289 [0,1,0,0,0,0|1,1,1]=4 195 B8R1.1 N#CC1=CC(N)=CS1 AC-93503 [0,1,0,0,0,0|1,1,1]=4 196 B8R1.1 N#CC1=CC=C(Br)O1 AC-85904 [0,1,0,0,0,0|1,0,1]=3 197 B8R1.1 N#CC1=CC=C(Br)S1 AC-33817 [0,1,0,0,0,0|1,1,1]=4 198 B8R1.1 NC1=CC(CO)=NS1 AC-83230 [0,1,0,0,0,0|2,1,0]=4 199 B8R1.1 NC1=NC(CCl)=CS1 AC-24397 [0,1,0,0,0,0|3,0,0]=4 200 B8R1.1 NC1=NC(CO)=CO1 AC-88337 [0,1,0,0,0,0|2,1,0]=4 201 B8R1.1 NC1=NC(CO)=CS1 AC-24554 [0,1,0,0,0,0|2,1,0]=4 202 B8R1.1 NC1=NN=C(CO)O1 AC-88423 [0,1,0,0,0,0|2,1,0]=4 203 B8R1.1 NCC1=CC(Br)=CS1 AC-25572 [0,1,0,0,0,0|1,1,0]=3 204 B8R1.1 NCC1=CC(Br)=CS1 AC-86958 [0,1,0,0,0,0|1,1,0]=3 205 B8R1.1 NCC1=CC=C(Br)S1 AC-89688 [0,1,0,0,0,0|1,1,0]=3 206 B8R1.1 NCC1=CN=C(Br)S1 AC-75427 [0,1,0,0,0,0|2,1,0]=4 207 B8R1.1 NCC1=CN=C(Cl)S1 AC-43257 [0,1,0,0,0,0|2,1,0]=4 208 B8R1.1 NCC1=CN=C(Cl)S1 AC-43360 [0,1,0,0,0,0|2,1,0]=4 209 B8R1.1 NCC1=CSC(Br)=N1 AC-75426 [0,1,0,0,0,0|3,0,0]=4 210 B8R1.1 NCC1=CSC(Cl)=N1 AC-96678 [0,1,0,0,0,0|3,0,0]=4 211 B8R1.1 NCC1=NC(Br)=CS1 AC-82506 [0,1,0,0,0,0|2,1,0]=4 212 B8R1.1 NCC1=NC(Br)=CS1 AC-91152 [0,1,0,0,0,0|2,1,0]=4 213 B8R1.1 O=C1C=C(CBr)CO1 AC-39233 [0,1,0,0,0,0|3,0,0]=4 214 B8R1.1 O=CC1=CC(Br)=CO1 AC-18437 [0,1,0,0,0,0|0,1,1]=3 215 B8R1.1 O=CC1=CC(Cl)=CS1 AC-46216 [0,1,0,0,0,0|0,2,1]=4 216 B8R1.1 O=CC1=CC(F)=CN1 AC-86957 [0,1,0,0,0,0|1,1,1]=4 217 B8R1.1 O=CC1=CC(F)=CS1 AC-86846 [0,1,0,0,0,0|0,2,1]=4 218 B8R1.1 O=CC1=CC(I)=CN1 AC-81350 [0,1,0,0,0,0|1,1,1]=4 219 B8R1.1 O=CC1=CC=C(Br)N1 AC-80870 [0,1,0,0,0,0|1,1,1]=4 220 B8R1.1 O=CC1=CC=C(Br)S1 AC-25564 [0,1,0,0,0,0|0,2,1]=4 221 B8R1.1 O=CC1=CC=C(Cl)N1 AC-95825 [0,1,0,0,0,0|1,1,1]=4 222 B8R1.1 O=CC1=CC=C(Cl)S1 AC-26948 [0,1,0,0,0,0|0,2,1]=4 223 B8R1.1 O=CC1=CC=C(F)S1 AC-88071 [0,1,0,0,0,0|0,2,1]=4 224 B8R1.1 O=CC1=CC=C(I)O1 AC-10619 [0,1,0,0,0,0|0,1,1]=3 225 B8R1.1 OCC1=CC(Br)=CN1 AC-84383 [0,1,0,0,0,0|1,1,0]=3 226 B8R1.1 OCC1=CC(Br)=CS1 AC-72294 [0,1,0,0,0,0|0,2,0]=3 227 B8R1.1 OCC1=CC(Br)=NO1 AC-39676 [0,1,0,0,0,0|1,1,0]=3 228 B8R1.1 OCC1=CC=C(Br)O1 AC-71056 [0,1,0,0,0,0|0,1,0]=2 229 B8R1.1 OCC1=CC=C(Br)S1 AC-25573 [0,1,0,0,0,0|0,2,0]=3 230 B8R1.1 OCC1=CC=C(Cl)S1 AC-26954 [0,1,0,0,0,0|0,2,0]=3 231 B8R1.1 OCC1=CN=C(Br)S1 AC-21203 [0,1,0,0,0,0|1,2,0]=4 232 B8R1.1 OCC1=CSC(Br)=C1 AC-84572 [0,1,0,0,0,0|2,1,0]=4 233 B8R1.1 OCC1=CSC(Cl)=C1 AC-89471 [0,1,0,0,0,0|2,1,0]=4 234 B8R1.7 CC(=O)C1=NC=CO1 AC-32128 [0,1,0,0,0,0|1,1,1]=4 235 B8R1.7 CC(C)C1=CC=CO1 AC-65204 [0,1,0,0,0,0|1,0,0]=2 236 B8R1.7 CC(C)C1=CN=CS1 AC-92021 [0,1,0,0,0,0|2,1,0]=4 237 B8R1.7 CC(N)C1=CC=CS1 AC-41497 [0,1,0,0,0,0|1,1,0]=3 238 B8R1.7 CC(N)C1=CSC=C1 AC-58087 [0,1,0,0,0,0|3,0,0]=4 239 B8R1.7 CC(N)C1=CSC=N1 AC-86636 [0,1,0,0,0,0|3,0,0]=4 240 B8R1.7 CC(N)C1=NC=CS1 AC-46197 [0,1,0,0,0,0|2,1,0]=4 241 B8R1.7 CC(N)C1=NNC=C1 AC-75613 [0,1,0,0,0,0|3,0,0]=4 242 B8R1.7 CC(O)C1=CC=CS1 AC-42316 [0,1,0,0,0,0|0,2,0]=3 243 B8R1.7 CC(O)C1=CSC=C1 AC-75785 [0,1,0,0,0,0|2,1,0]=4 244 B8R1.7 N=C(N)C1=CC=CO1 AC-53373 [0,1,0,0,0,0|1,0,1]=3 245 B8R1.7 N=C(N)C1=CC=CS1 AC-90731 [0,1,0,0,0,0|1,1,1]=4 246 B8R1.7 N=C(N)C1=CC=CS1 AC-91009 [0,1,0,0,0,0|1,1,1]=4 247 B8R1.7 O=C(O)C1=CC=CN1 AC-24039 [0,1,0,0,0,0|1,1,1]=4 248 B8R1.7 O=C(O)C1=CC=CS1 AC-44639 [0,1,0,0,0,0|0,2,1]=4 249 B8R1.7 O=C(O)C1=CN=CO1 AC-40004 [0,1,0,0,0,0|1,1,1]=4 250 B8R1.7 O=C([O-])C1=NC=CO1 AC-92153 [0,1,0,0,0,0|1,1,1]=4 251 B8R1.7 O=[N+]([O-])C1=CC=CS1 AC-13381 [0,1,0,0,0,0|1,2,0]=4 252 B8R1.7 OB(O)C1=CC=CN1 AC-63669 [0,1,0,0,0,0|2,1,0]=4 253 B8R1.7 OB(O)C1=CC=CS1 AC-11344 [0,1,0,0,0,0|1,2,0]=4 254 B8R1.8 BrCCN1C=CC=N1 AC-42034 [0,1,0,0,0,0|3,0,0]=4 255 B8R1.8 CCCC1=NN=CO1 AC-89526 [0,1,0,0,0,0|3,0,0]=4 256 B8R1.8 CCNC1=CC=CS1 AC-92984 [0,1,0,0,0,0|1,1,0]=3 257 B8R1.8 CCOC1=NC=CS1 AC-13522 [0,1,0,0,0,0|2,1,0]=4 258 B8R1.8 CNCC1=CC=CN1 AC-87560 [0,1,0,0,0,0|2,0,0]=3 259 B8R1.8 CNCC1=CC=CS1 AC-46234 [0,1,0,0,0,0|1,1,0]=3 260 B8R1.8 CNCC1=CC=NO1 AC-86147 [0,1,0,0,0,0|2,0,0]=3 261 B8R1.8 CNCC1=CN=CS1 AC-88139 [0,1,0,0,0,0|2,1,0]=4 262 B8R1.8 CNCC1=NC=CN1 AC-56745 [0,1,0,0,0,0|3,0,0]=4 263 B8R1.8 N#CCC1=CN=CN1 AC-29758 [0,1,0,0,0,0|3,0,0]=4 264 B8R1.8 N#CCC1=NC=CN1 AC-83932 [0,1,0,0,0,0|3,0,0]=4 265 B8R1.8 N#CCC1=NC=CS1 AC-70243 [0,1,0,0,0,0|2,1,0]=4 266 B8R1.8 NCCC1=CC=CO1 AC-44898 [0,1,0,0,0,0|1,0,0]=2 267 B8R1.8 NCCC1=CN=CN1 AC-73903 [0,1,0,0,0,0|3,0,0]=4 268 B8R1.8 NCCC1=CN=CS1 AC-90203 [0,1,0,0,0,0|2,1,0]=4 269 B8R1.8 NCCC1=CSC=C1 AC-32087 [0,1,0,0,0,0|3,0,0]=4 270 B8R1.8 NCCC1=CSC=C1 AC-46248 [0,1,0,0,0,0|3,0,0]=4 271 B8R1.8 NCCN1C=CC=N1 AC-53196 [0,1,0,0,0,0|3,0,0]=4 272 B8R1.8 O=CCC1=CC=CS1 AC-79856 [0,1,0,0,0,0|0,2,0]=3 273 B8R1.8 OCCC1=CC=CS1 AC-13547 [0,1,0,0,0,0|0,2,0]=3 274 B8R1.8 OCCC1=CSC=C1 AC-62922 [0,1,0,0,0,0|2,1,0]=4 275 B8R1.8 O\N=C\C1=CC=CO1 AC-76414 [0,1,0,0,0,0|0,1,1]=3 276 B8R1.11 CC1=C(C#N)NC=C1 AC-82218 [0,1,0,0,0,0|2,0,1]=4 277 B8R1.11 CC1=C(C=O)NC=C1 AC-87539 [0,1,0,0,0,0|1,1,1]=4 278 B8R1.11 CC1=C(C=O)OC=N1 AC-42864 [0,1,0,0,0,0|1,1,1]=4 279 B8R1.11 CC1=C(CCl)N=CS1 AC-82107 [0,1,0,0,0,0|3,0,0]=4 280 B8R1.11 CC1=C(CO)N=CN1 AC-14349 [0,1,0,0,0,0|2,1,0]=4 281 B8R1.11 CC1=C(CO)SC=C1 AC-42283 [0,1,0,0,0,0|0,2,0]=3 282 B8R1.11 CCC1=C(C)N=CS1 AC-27506 [0,1,0,0,0,0|2,1,0]=4 283 B8R1.11 CCN1N=CC=C1N AC-61814 [0,1,0,0,0,0|3,0,0]=4 284 B8R1.11 CN1C=CN=C1CCl AC-73905 [0,1,0,0,0,0|3,0,0]=4 285 B8R1.11 CN1C=NC=C1CBr AC-90840 [0,1,0,0,0,0|3,0,0]=4 286 B8R1.11 CN1C=NC=C1CCl AC-89494 [0,1,0,0,0,0|3,0,0]=4 287 B8R1.11 CN1C=NC=C1CCl AC-92351 [0,1,0,0,0,0|3,0,0]=4 288 B8R1.11 CN1C=NC=C1CN AC-39341 [0,1,0,0,0,0|3,0,0]=4 289 B8R1.11 CN1N=CC=C1CN AC-58056 [0,1,0,0,0,0|3,0,0]=4 290 B8R1.11 CN1N=CC=C1CN AC-71363 [0,1,0,0,0,0|3,0,0]=4 291 B8R1.11 CN1N=CC=C1CO AC-55671 [0,1,0,0,0,0|2,1,0]=4 292 B8R1.11 ClC1=C(CBr)C=CS1 AC-25663 [0,1,0,0,0,0|3,0,0]=4 293 B8R1.11 N#CC1=C(Br)C=CS1 AC-46215 [0,1,0,0,0,0|1,1,1]=4 294 B8R1.11 N#CC1=C(N)C=CS1 AC-76595 [0,1,0,0,0,0|1,1,1]=4 295 B8R1.11 N#CC1=CC=CN1N AC-32352 [0,1,0,0,0,0|2,0,1]=4 296 B8R1.11 N#CC1=CC=CN1N AC-45600 [0,1,0,0,0,0|2,0,1]=4 297 B8R1.11 NC1=C(C=O)SC=C1 AC-80955 [0,1,0,0,0,0|0,2,1]=4 298 B8R1.11 NN1C=CC=C1C=O AC-85985 [0,1,0,0,0,0|1,1,1]=4 299 B8R1.11 O=CC1=C(Br)C=CN1 AC-89160 [0,1,0,0,0,0|1,1,1]=4 300 B8R1.11 O=CC1=C(Br)C=CO1 AC-34260 [0,1,0,0,0,0|0,1,1]=3 301 B8R1.11 O=CC1=C(Br)C=CS1 AC-18532 [0,1,0,0,0,0|0,2,1]=4 302 B8R1.11 O=CC1=C(F)C=CS1 AC-81447 [0,1,0,0,0,0|0,2,1]=4 303 B8R1.11 OCC1=C(Br)SC=C1 AC-33165 [0,1,0,0,0,0|2,1,0]=4 304 B8R1.11 OCC1=C(Br)SC=N1 AC-95459 [0,1,0,0,0,0|2,1,0]=4 305 B8R1.11 OCC1=C(Cl)SC=C1 AC-94092 [0,1,0,0,0,0|2,1,0]=4 306 B8R1.11 OCC1=C(F)C=CS1 AC-87936 [0,1,0,0,0,0|0,2,0]=3 307 B8R1.2 BrCC1=CC=CN=C1 AC-25258 [0,0,0,0,0,1|2,0,0]=3 308 B8R1.2 BrCC1=CC=CN=C1 AC-76498 [0,0,0,0,0,1|2,0,0]=3 309 B8R1.2 BrCC1=CC=NC=N1 AC-81976 [0,0,0,0,0,1|2,0,0]=3 310 B8R1.2 BrCC1=CC=NC=N1 AC-84148 [0,0,0,0,0,1|2,0,0]=3 311 B8R1.2 BrCC1=CN=CN=C1 AC-79845 [0,0,0,0,0,1|3,0,0]=4 312 B8R1.2 BrCC1=CN=CN=C1 AC-80932 [0,0,0,0,0,1|3,0,0]=4 313 B8R1.2 BrCC1=NC=CC=C1 AC-25266 [0,0,0,0,0,1|2,0,0]=3 314 B8R1.2 BrCC1=NC=CN=C1 AC-72395 [0,0,0,0,0,1|2,0,0]=3 315 B8R1.2 C#CC1=CC=NC=C1 AC-23559 [0,0,0,0,0,1|2,0,1]=4 316 B8R1.2 C#CC1=CC=NC=C1 AC-93387 [0,0,0,0,0,1|2,0,1]=4 317 B8R1.2 C#CC1=NC=CC=C1 AC-61740 [0,0,0,0,0,1|2,0,1]=4 318 B8R1.2 C#CC1=NC=CC=N1 AC-77095 [0,0,0,0,0,1|2,0,1]=4 319 B8R1.2 C#CC1=NC=CN=C1 AC-76395 [0,0,0,0,0,1|2,0,1]=4 320 B8R1.2 CCC1=CC=NC=N1 AC-87953 [0,0,0,0,0,1|2,0,0]=3 321 B8R1.2 CCC1=NC=CN=C1 AC-13441 [0,0,0,0,0,1|2,0,0]=3 322 B8R1.2 CNC1=CC=NC=C1 AC-10223 [0,0,0,0,0,1|3,0,0]=4 323 B8R1.2 CNC1=NC=CC=N1 AC-83753 [0,0,0,0,0,1|3,0,0]=4 324 B8R1.2 COC1=CC=CN=C1 AC-61633 [0,0,0,0,0,1|3,0,0]=4 325 B8R1.2 COC1=NC=CC=C1 AC-77035 [0,0,0,0,0,1|3,0,0]=4 326 B8R1.2 CSC1=NC=CC=N1 AC-77102 [0,0,0,0,0,1|3,0,0]=4 327 B8R1.2 CSC1=NC=CN=C1 AC-13449 [0,0,0,0,0,1|3,0,0]=4 328 B8R1.2 ClCC1=CC=CN=C1 AC-11627 [0,0,0,0,0,1|2,0,0]=3 329 B8R1.2 ClCC1=CC=NC=C1 AC-11628 [0,0,0,0,0,1|2,0,0]=3 330 B8R1.2 ClCC1=CC=NC=N1 AC-86216 [0,0,0,0,0,1|2,0,0]=3 331 B8R1.2 ClCC1=CN=CN=C1 AC-26256 [0,0,0,0,0,1|3,0,0]=4 332 B8R1.2 ClCC1=NC=CC=C1 AC-11626 [0,0,0,0,0,1|2,0,0]=3 333 B8R1.2 ClCC1=NC=CC=N1 AC-26262 [0,0,0,0,0,1|2,0,0]=3 334 B8R1.2 ClCC1=NC=CN=C1 AC-26220 [0,0,0,0,0,1|2,0,0]=3 335 B8R1.2 ClCC1=NC=CN=C1 AC-76096 [0,0,0,0,0,1|2,0,0]=3 336 B8R1.2 ClCC1=NN=CC=C1 AC-69285 [0,0,0,0,0,1|2,0,0]=3 337 B8R1.2 ICC1=CC=CC=C1 AC-80028 [0,0,0,0,0,1|2,0,0]=3 338 B8R1.2 N#CC1=CC=CN=C1 AC-27171 [0,0,0,0,0,1|2,0,1]=4 339 B8R1.2 N#CC1=NC=CC=C1 AC-27170 [0,0,0,0,0,1|2,0,1]=4 340 B8R1.2 N#CC1=NC=CC=N1 AC-16724 [0,0,0,0,0,1|2,0,1]=4 341 B8R1.2 N#CC1=NC=CN=C1 AC-14201 [0,0,0,0,0,1|2,0,1]=4 342 B8R1.2 NCC1=CC=CC=C1 AC-22861 [0,0,0,0,0,1|2,0,0]=3 343 B8R1.2 NCC1=CC=CN=C1 AC-13721 [0,0,0,0,0,1|2,0,0]=3 344 B8R1.2 NCC1=CC=CN=C1 AC-16657 [0,0,0,0,0,1|2,0,0]=3 345 B8R1.2 NCC1=CC=NC=C1 AC-22745 [0,0,0,0,0,1|2,0,0]=3 346 B8R1.2 NCC1=CC=NC=C1 AC-75575 [0,0,0,0,0,1|2,0,0]=3 347 B8R1.2 NCC1=CC=NC=N1 AC-22746 [0,0,0,0,0,1|2,0,0]=3 348 B8R1.2 NCC1=CC=NC=N1 AC-68960 [0,0,0,0,0,1|2,0,0]=3 349 B8R1.2 NCC1=CC=NN=C1 AC-69278 [0,0,0,0,0,1|3,0,0]=4 350 B8R1.2 NCC1=CC=NN=C1 AC-81095 [0,0,0,0,0,1|3,0,0]=4 351 B8R1.2 NCC1=CN=CN=C1 AC-88522 [0,0,0,0,0,1|3,0,0]=4 352 B8R1.2 NCC1=NC=CC=C1 AC-22744 [0,0,0,0,0,1|2,0,0]=3 353 B8R1.2 NCC1=NC=CC=N1 AC-24647 [0,0,0,0,0,1|2,0,0]=3 354 B8R1.2 NCC1=NC=CC=N1 AC-34916 [0,0,0,0,0,1|2,0,0]=3 355 B8R1.2 NCC1=NC=CC=N1 AC-95654 [0,0,0,0,0,1|2,0,0]=3 356 B8R1.2 NCC1=NC=CN=C1 AC-24641 [0,0,0,0,0,1|2,0,0]=3 357 B8R1.2 NCC1=NC=CN=C1 AC-40799 [0,0,0,0,0,1|2,0,0]=3 358 B8R1.2 NCC1=NN=CC=C1 AC-69279 [0,0,0,0,0,1|2,0,0]=3 359 B8R1.2 NCC1=NN=CC=C1 AC-69336 [0,0,0,0,0,1|2,0,0]=3 360 B8R1.2 NNC1=CC=NC=C1 AC-34830 [0,0,0,0,0,1|3,0,0]=4 361 B8R1.2 NNC1=CC=NC=C1 AC-56235 [0,0,0,0,0,1|3,0,0]=4 362 B8R1.2 NNC1=NC=CC=C1 AC-44634 [0,0,0,0,0,1|3,0,0]=4 363 B8R1.2 NNC1=NC=CC=C1 AC-77176 [0,0,0,0,0,1|3,0,0]=4 364 B8R1.2 NNC1=NC=CC=C1 AC-77364 [0,0,0,0,0,1|3,0,0]=4 365 B8R1.2 NNC1=NC=CC=N1 AC-43581 [0,0,0,0,0,1|3,0,0]=4 366 B8R1.2 NNC1=NN=CC=C1 AC-76130 [0,0,0,0,0,1|3,0,0]=4 367 B8R1.2 NNC1=NN=CC=C1 AC-93698 [0,0,0,0,0,1|3,0,0]=4 368 B8R1.2 NOC1=CC=CC=C1 AC-83716 [0,0,0,0,0,1|3,0,0]=4 369 B8R1.2 O=CC1=CC=CN=C1 AC-24016 [0,0,0,0,0,1|1,1,1]=4 370 B8R1.2 O=CC1=CC=NC=C1 AC-15288 [0,0,0,0,0,1|1,1,1]=4 371 B8R1.2 O=CC1=NC=CC=C1 AC-24015 [0,0,0,0,0,1|1,1,1]=4 372 B8R1.2 O=CC1=NC=CN=C1 AC-63783 [0,0,0,0,0,1|1,1,1]=4 373 B8R1.2 OCC1=CC=CN=C1 AC-13420 [0,0,0,0,0,1|1,1,0]=3 374 B8R1.2 OCC1=CC=NC=C1 AC-11666 [0,0,0,0,0,1|1,1,0]=3 375 B8R1.2 OCC1=CC=NN=C1 AC-40989 [0,0,0,0,0,1|2,1,0]=4 376 B8R1.2 OCC1=CN=CN=C1 AC-26624 [0,0,0,0,0,1|2,1,0]=4 377 B8R1.2 OCC1=NC=CC=C1 AC-11665 [0,0,0,0,0,1|1,1,0]=3 378 B8R1.2 OCC1=NC=CC=N1 AC-26633 [0,0,0,0,0,1|1,1,0]=3 379 B8R1.2 OCC1=NC=CN=C1 AC-45233 [0,0,0,0,0,1|1,1,0]=3 380 B8R1.2 OCC1=NN=CC=C1 AC-40990 [0,0,0,0,0,1|1,1,0]=3 381 B5R1.1 C1=CNN=C1 AC-14505 [2,0,0,0,0,0|2,0,0]=4 382 B5R1.1 C1=COCC1 AC-74091 [2,0,0,0,0,0|0,0,2]=4 383 B5R1.1 C1=CSC=N1 AC-46193 [2,0,0,0,0,0|1,1,0]=4 384 B5R1.1 C1=C[CH-]C=C1 AC-74053 [2,0,0,0,0,0|1,0,0]=3 385 B7R0.4 CCO\C=C\C(=O)O AC-28683 [0,1,1,0,0,0|2,0,0]=4 386 B7R1.2 BrC1=CC=C(Br)S1 AC-13553 [1,1,0,0,0,0|1,1,0]=4 387 B7R1.2 CC1=CC(=O)CO1 AC-85907 [1,1,0,0,0,0|0,0,1]=3 388 B7R1.2 CC1=CC(=O)NN1 AC-13387 [1,1,0,0,0,0|2,0,0]=4 389 B7R1.2 CC1=CC(Br)=CS1 AC-18798 [1,1,0,0,0,0|0,1,0]=3 390 B7R1.2 CC1=CC(Br)=NO1 AC-33149 [1,1,0,0,0,0|1,0,0]=3 391 B7R1.2 CC1=CC(C)=NO1 AC-13649 [1,1,0,0,0,0|1,0,0]=3 392 B7R1.2 CC1=CC(N)=NN1 AC-44621 [1,1,0,0,0,0|2,0,0]=4 393 B7R1.2 CC1=CC(N)=NO1 AC-32674 [1,1,0,0,0,0|1,0,0]=3 394 B7R1.2 CC1=CC(O)=NO1 AC-58257 [1,1,0,0,0,0|1,0,0]=3 395 B7R1.2 CC1=CC=C(Br)O1 AC-81494 [1,1,0,0,0,0|0,0,0]=2 396 B7R1.2 CC1=CC=C(Br)S1 AC-13561 [1,1,0,0,0,0|0,1,0]=3 397 B7R1.2 CC1=CN(C)N=C1 AC-28546 [1,1,0,0,0,0|2,0,0]=4 398 B7R1.2 CC1=CN=C(Br)S1 AC-25288 [1,1,0,0,0,0|1,1,0]=4 399 B7R1.2 CC1=CN=C(C)S1 AC-13532 [1,1,0,0,0,0|1,1,0]=4 400 B7R1.2 CC1=CN=C(Cl)S1 AC-13521 [1,1,0,0,0,0|1,1,0]=4 401 B7R1.2 CC1=CN=C(N)N1 AC-31000 [1,1,0,0,0,0|2,0,0]=4 402 B7R1.2 CC1=CN=C(N)O1 AC-41470 [1,1,0,0,0,0|1,0,0]=3 403 B7R1.2 CC1=CN=C(N)S1 AC-44619 [1,1,0,0,0,0|1,1,0]=4 404 B7R1.2 CC1=CNC(Br)=N1 AC-76276 [1,1,0,0,0,0|2,0,0]=4 405 B7R1.2 CC1=CNC(C)=C1 AC-13373 [1,1,0,0,0,0|1,0,0]=3 406 B7R1.2 CC1=CNC(I)=N1 AC-29953 [1,1,0,0,0,0|2,0,0]=4 407 B7R1.2 CC1=CSC(=O)N1 AC-93701 [1,1,0,0,0,0|2,0,0]=4 408 B7R1.2 CC1=CSC(Br)=N1 AC-25287 [1,1,0,0,0,0|2,0,0]=4 409 B7R1.2 CC1=CSC(Cl)=N1 AC-42176 [1,1,0,0,0,0|2,0,0]=4 410 B7R1.2 CC1=CSC(I)=C1 AC-82271 [1,1,0,0,0,0|1,1,0]=4 411 B7R1.2 CC1=CSC(I)=N1 AC-87424 [1,1,0,0,0,0|2,0,0]=4 412 B7R1.2 CC1=NC(Br)=CS1 AC-46103 [1,1,0,0,0,0|1,1,0]=4 413 B7R1.2 CC1=NC(I)=CS1 AC-85068 [1,1,0,0,0,0|1,1,0]=4 414 B7R1.2 CC1=NC(N)=CS1 AC-76457 [1,1,0,0,0,0|1,1,0]=4 415 B7R1.2 CC1=NC=C(Br)S1 AC-32947 [1,1,0,0,0,0|1,1,0]=4 416 B7R1.2 CC1=NC=C(N)S1 AC-80974 [1,1,0,0,0,0|1,1,0]=4 417 B7R1.2 CC1=NN(C)C=C1 AC-28547 [1,1,0,0,0,0|2,0,0]=4 418 B7R1.2 CC1=NN=C(C)O1 AC-79358 [1,1,0,0,0,0|2,0,0]=4 419 B7R1.2 CC1=NN=C(N)O1 AC-49677 [1,1,0,0,0,0|2,0,0]=4 420 B7R1.2 CC1=NN=C(O)O1 AC-31284 [1,1,0,0,0,0|2,0,0]=4 421 B7R1.2 CC1=NNC(O)=C1 AC-68450 [1,1,0,0,0,0|2,0,0]=4 422 B7R1.2 CC1=NOC(Br)=C1 AC-33145 [1,1,0,0,0,0|2,0,0]=4 423 B7R1.2 CC1=NSC(N)=C1 AC-21153 [1,1,0,0,0,0|2,0,0]=4 424 B7R1.2 CC1=NSC(N)=C1 AC-87848 [1,1,0,0,0,0|2,0,0]=4 425 B7R1.2 CN1C=C(Br)C=N1 AC-25230 [1,1,0,0,0,0|2,0,0]=4 426 B7R1.2 CN1C=C(Cl)C=N1 AC-26223 [1,1,0,0,0,0|2,0,0]=4 427 B7R1.2 CN1C=C(F)C=N1 AC-92443 [1,1,0,0,0,0|2,0,0]=4 428 B7R1.2 CN1C=C(I)C=N1 AC-43056 [1,1,0,0,0,0|2,0,0]=4 429 B7R1.2 CN1C=C(N)C=N1 AC-40810 [1,1,0,0,0,0|2,0,0]=4 430 B7R1.2 CN1C=C(N)C=N1 AC-42780 [1,1,0,0,0,0|2,0,0]=4 431 B7R1.2 CN1C=CC(=O)N1 AC-82045 [1,1,0,0,0,0|2,0,0]=4 432 B7R1.2 CN1C=CC(Br)=N1 AC-40821 [1,1,0,0,0,0|2,0,0]=4 433 B7R1.2 CN1C=CC(N)=C1 AC-80610 [1,1,0,0,0,0|2,0,0]=4 434 B7R1.2 CN1C=CC(N)=C1 AC-81457 [1,1,0,0,0,0|2,0,0]=4 435 B7R1.2 CN1C=CC(N)=N1 AC-22735 [1,1,0,0,0,0|2,0,0]=4 436 B7R1.2 O=C1C=C(O)CO1 AC-65559 [1,1,0,0,0,0|0,1,1]=4 437 B7R1.2 O=C1C=CC(Br)O1 AC-95636 [1,1,0,0,0,0|0,1,1]=4 438 B7R1.4 BrC1=C(Br)SC=C1 AC-13551 [1,1,0,0,0,0|1,1,0]=4 439 B7R1.4 CC1=C(Br)C=CS1 AC-25294 [1,1,0,0,0,0|0,1,0]=3 440 B7R1.4 CC1=C(Br)C=NN1 AC-77463 [1,1,0,0,0,0|2,0,0]=4 441 B7R1.4 CC1=C(Br)NC=N1 AC-30754 [1,1,0,0,0,0|2,0,0]=4 442 B7R1.4 CC1=C(Br)SC=N1 AC-73657 [1,1,0,0,0,0|2,0,0]=4 443 B7R1.4 CC1=C(C)OC=N1 AC-95517 [1,1,0,0,0,0|1,0,0]=3 444 B7R1.4 CC1=C(Cl)SC=C1 AC-13378 [1,1,0,0,0,0|1,1,0]=4 445 B7R1.4 CC1=C(I)C=NN1 AC-56064 [1,1,0,0,0,0|2,0,0]=4 446 B7R1.4 CC1=C(I)NC=N1 AC-77281 [1,1,0,0,0,0|2,0,0]=4 447 B7R1.4 CC1=C(N)C=NO1 AC-89714 [1,1,0,0,0,0|1,0,0]=3 448 B7R1.4 CC1=C(N)N=CN1 AC-72298 [1,1,0,0,0,0|2,0,0]=4 449 B7R1.4 CC1=C(N)SC=C1 AC-85843 [1,1,0,0,0,0|1,1,0]=4 450 B7R1.4 CC1=C(N)SC=C1 AC-89988 [1,1,0,0,0,0|1,1,0]=4 451 B7R1.4 CC1=CC=NN1C AC-28545 [1,1,0,0,0,0|2,0,0]=4 452 B7R1.4 CC1=NC=CN1C AC-23425 [1,1,0,0,0,0|2,0,0]=4 453 B7R1.4 CC1=NNC=C1Br AC-15612 [1,1,0,0,0,0|2,0,0]=4 454 B7R1.4 CC1=NOC=C1N AC-43260 [1,1,0,0,0,0|2,0,0]=4 455 B7R1.4 CC1=NSC=C1N AC-89628 [1,1,0,0,0,0|2,0,0]=4 456 B7R1.4 CN1C=CN=C1S AC-75220 [1,1,0,0,0,0|2,0,0]=4 457 B7R1.4 CN1N=CC=C1N AC-12728 [1,1,0,0,0,0|2,0,0]=4 458 B7R1.4 CN1N=CC=C1O AC-72736 [1,1,0,0,0,0|2,0,0]=4 459 B7R1.4 CN1N=CC=C1O AC-95910 [1,1,0,0,0,0|2,0,0]=4 460 B7R1.4 O=C1OCC=C1Br AC-89416 [1,1,0,0,0,0|0,1,1]=4 461 B9R1.1 BrCC1=CC=C(Br)C=C1 AC-14326 [0,1,0,0,0,1|2,0,0]=4 462 B9R1.1 BrCC1=CN=C(Br)C=C1 AC-94210 [0,1,0,0,0,1|2,0,0]=4 463 B9R1.1 BrCC1=NC=C(Br)C=N1 AC-85837 [0,1,0,0,0,1|2,0,0]=4 464 B9R1.1 CC1=CC=C(CN)C=C1 AC-79860 [0,1,0,0,0,1|2,0,0]=4 465 B9R1.1 CC1=CC=C(CN)C=N1 AC-44571 [0,1,0,0,0,1|2,0,0]=4 466 B9R1.1 CC1=CC=C(CO)C=C1 AC-76910 [0,1,0,0,0,1|1,1,0]=4 467 B9R1.1 CC1=CC=C(CO)C=N1 AC-31663 [0,1,0,0,0,1|1,1,0]=4 468 B9R1.1 CC1=CN=C(CBr)N=C1 AC-82828 [0,1,0,0,0,1|2,0,0]=4 469 B9R1.1 CC1=CN=C(CCl)C=C1 AC-86976 [0,1,0,0,0,1|2,0,0]=4 470 B9R1.1 CC1=CN=C(CCl)C=C1 AC-91833 [0,1,0,0,0,1|2,0,0]=4 471 B9R1.1 CC1=CN=C(CCl)C=N1 AC-69264 [0,1,0,0,0,1|2,0,0]=4 472 B9R1.1 CC1=CN=C(CCl)C=N1 AC-76094 [0,1,0,0,0,1|2,0,0]=4 473 B9R1.1 CC1=CN=C(CCl)N=C1 AC-69124 [0,1,0,0,0,1|2,0,0]=4 474 B9R1.1 CC1=CN=C(CN)C=C1 AC-41495 [0,1,0,0,0,1|2,0,0]=4 475 B9R1.1 CC1=CN=C(CN)C=C1 AC-77026 [0,1,0,0,0,1|2,0,0]=4 476 B9R1.1 CC1=CN=C(CN)N=C1 AC-34925 [0,1,0,0,0,1|2,0,0]=4 477 B9R1.1 CC1=CN=C(CO)C=N1 AC-31582 [0,1,0,0,0,1|1,1,0]=4 478 B9R1.1 CC1=CN=C(CO)N=C1 AC-42264 [0,1,0,0,0,1|1,1,0]=4 479 B9R1.1 CC1=NC=C(CBr)C=C1 AC-77004 [0,1,0,0,0,1|2,0,0]=4 480 B9R1.1 CC1=NC=C(CCl)C=C1 AC-64799 [0,1,0,0,0,1|2,0,0]=4 481 B9R1.1 CC1=NN=C(CN)C=C1 AC-69287 [0,1,0,0,0,1|2,0,0]=4 482 B9R1.1 CC1=NN=C(CN)C=C1 AC-91270 [0,1,0,0,0,1|2,0,0]=4 483 B9R1.1 CC1=NN=C(CN)C=C1 AC-94257 [0,1,0,0,0,1|2,0,0]=4 484 B9R1.1 CCC1=CC=C(O)C=C1 AC-91678 [0,1,0,0,0,1|2,0,0]=4 485 B9R1.1 CCC1=CN=C(Br)C=C1 AC-79451 [0,1,0,0,0,1|2,0,0]=4 486 B9R1.1 CCC1=CN=C(Cl)C=C1 AC-87826 [0,1,0,0,0,1|2,0,0]=4 487 B9R1.1 CCC1=CN=C(Cl)C=C1 AC-88999 [0,1,0,0,0,1|2,0,0]=4 488 B9R1.1 CCC1=CN=C(N)C=C1 AC-79457 [0,1,0,0,0,1|2,0,0]=4 489 B9R1.1 CCC1=CN=C(N)C=N1 AC-94838 [0,1,0,0,0,1|2,0,0]=4 490 B9R1.1 CCC1=NC=C(Br)C=C1 AC-24896 [0,1,0,0,0,1|2,0,0]=4 491 B9R1.1 CCC1=NC=C(C)N=C1 AC-29167 [0,1,0,0,0,1|2,0,0]=4 492 B9R1.1 ClC1=CC=C(CBr)C=C1 AC-16990 [0,1,0,0,0,1|2,0,0]=4 493 B9R1.1 ClC1=CN=C(CBr)C=C1 AC-81071 [0,1,0,0,0,1|2,0,0]=4 494 B9R1.1 ClC1=NN=C(CBr)C=C1 AC-88820 [0,1,0,0,0,1|2,0,0]=4 495 B9R1.1 ClCC1=CN=C(Cl)C=C1 AC-11668 [0,1,0,0,0,1|2,0,0]=4 496 B9R1.1 ClCC1=NC=C(Cl)C=C1 AC-71228 [0,1,0,0,0,1|2,0,0]=4 497 B9R1.1 FC1=CN=C(CCl)N=C1 AC-84146 [0,1,0,0,0,1|2,0,0]=4 498 B9R1.1 FC1=NC=C(CBr)C=C1 AC-85613 [0,1,0,0,0,1|2,0,0]=4 499 B9R1.1 FC1=NC=C(CCl)C=C1 AC-69785 [0,1,0,0,0,1|2,0,0]=4 500 B9R1.1 N#CC1=COC(=O)C=C1 AC-91226 [0,1,0,0,0,1|1,0,1]=4 501 B9R1.1 NC1=CC=C(CBr)C=C1 AC-89799 [0,1,0,0,0,1|2,0,0]=4 502 B9R1.1 NC1=CC=C(CO)C=C1 AC-14320 [0,1,0,0,0,1|1,1,0]=4 503 B9R1.1 NC1=CC=C(CO)C=C1 AC-82241 [0,1,0,0,0,1|1,1,0]=4 504 B9R1.1 NC1=CN=C(CO)C=C1 AC-71769 [0,1,0,0,0,1|1,1,0]=4 505 B9R1.1 NCC1=CC=C(Br)N=C1 AC-75533 [0,1,0,0,0,1|2,0,0]=4 506 B9R1.1 NCC1=CC=C(Cl)C=C1 AC-13860 [0,1,0,0,0,1|2,0,0]=4 507 B9R1.1 NCC1=CC=C(Cl)N=C1 AC-88277 [0,1,0,0,0,1|2,0,0]=4 508 B9R1.1 NCC1=CC=C(N)C=C1 AC-77237 [0,1,0,0,0,1|2,0,0]=4 509 B9R1.1 NCC1=CC=C(N)C=N1 AC-45018 [0,1,0,0,0,1|2,0,0]=4 510 B9R1.1 NCC1=CC=C(O)C=C1 AC-17830 [0,1,0,0,0,1|2,0,0]=4 511 B9R1.1 NCC1=CC=C(O)C=C1 AC-90539 [0,1,0,0,0,1|2,0,0]=4 512 B9R1.1 NCC1=CN=C(Cl)C=C1 AC-32878 [0,1,0,0,0,1|2,0,0]=4 513 B9R1.1 NCC1=CN=C(N)C=C1 AC-73412 [0,1,0,0,0,1|2,0,0]=4 514 B9R1.1 NCC1=CN=C(N)C=C1 AC-92430 [0,1,0,0,0,1|2,0,0]=4 515 B9R1.1 NCC1=CNC(=O)C=C1 AC-83927 [0,1,0,0,0,1|2,0,0]=4 516 B9R1.1 NCC1=NC=C(Br)C=C1 AC-44721 [0,1,0,0,0,1|2,0,0]=4 517 B9R1.1 NCC1=NC=C(Br)C=C1 AC-69679 [0,1,0,0,0,1|2,0,0]=4 518 B9R1.1 NCC1=NC=C(Br)C=C1 AC-72160 [0,1,0,0,0,1|2,0,0]=4 519 B9R1.1 NCC1=NC=C(Br)C=N1 AC-93187 [0,1,0,0,0,1|2,0,0]=4 520 B9R1.1 NCC1=NC=C(Cl)C=C1 AC-75524 [0,1,0,0,0,1|2,0,0]=4 521 B9R1.1 NCC1=NC=C(Cl)C=C1 AC-75525 [0,1,0,0,0,1|2,0,0]=4 522 B9R1.1 NCC1=NC=C(Cl)C=C1 AC-75526 [0,1,0,0,0,1|2,0,0]=4 523 B9R1.1 NCC1=NC=C(Cl)C=N1 AC-44976 [0,1,0,0,0,1|2,0,0]=4 524 B9R1.1 NCC1=NC=C(F)C=C1 AC-29711 [0,1,0,0,0,1|2,0,0]=4 525 B9R1.1 NCC1=NC=C(N)C=N1 AC-84620 [0,1,0,0,0,1|2,0,0]=4 526 B9R1.1 NCC1=NN=C(Cl)C=C1 AC-75539 [0,1,0,0,0,1|2,0,0]=4 527 B9R1.1 O=C1C=CC(CO)=CO1 AC-85566 [0,1,0,0,0,1|0,1,0]=3 528 B9R1.1 OCC1=CC=C(Br)N=C1 AC-25494 [0,1,0,0,0,1|1,1,0]=4 529 B9R1.1 OCC1=CC=C(O)C=C1 AC-38474 [0,1,0,0,0,1|1,1,0]=4 530 B9R1.1 OCC1=CN=C(F)C=C1 AC-29402 [0,1,0,0,0,1|1,1,0]=4 531 B9R1.1 OCC1=CN=C(O)C=C1 AC-80514 [0,1,0,0,0,1|1,1,0]=4 532 B9R1.1 OCC1=NC=C(Br)C=C1 AC-12892 [0,1,0,0,0,1|1,1,0]=4 533 B9R1.1 OCC1=NC=C(Br)C=N1 AC-89382 [0,1,0,0,0,1|1,1,0]=4 534 B9R1.1 OCC1=NC=C(Cl)C=C1 AC-26820 [0,1,0,0,0,1|1,1,0]=4 535 B9R1.2 BrCC1=CC(Br)=NC=C1 AC-91838 [0,1,0,0,0,1|2,0,0]=4 536 B9R1.2 BrCC1=CC=CC(Br)=C1 AC-15436 [0,1,0,0,0,1|2,0,0]=4 537 B9R1.2 BrCC1=CC=CC(Br)=N1 AC-43779 [0,1,0,0,0,1|2,0,0]=4 538 B9R1.2 BrCC1=CC=CC(Br)=N1 AC-87060 [0,1,0,0,0,1|2,0,0]=4 539 B9R1.2 CC1=CC(CCl)=CC=C1 AC-83195 [0,1,0,0,0,1|2,0,0]=4 540 B9R1.2 CC1=CC(CN)=NC=C1 AC-44569 [0,1,0,0,0,1|2,0,0]=4 541 B9R1.2 CC1=CC(CN)=NC=C1 AC-75499 [0,1,0,0,0,1|2,0,0]=4 542 B9R1.2 CC1=CC(CN)=NC=C1 AC-93088 [0,1,0,0,0,1|2,0,0]=4 543 B9R1.2 CC1=CC(CO)=NC=C1 AC-79536 [0,1,0,0,0,1|1,1,0]=4 544 B9R1.2 CC1=CC=CC(CBr)=N1 AC-88563 [0,1,0,0,0,1|2,0,0]=4 545 B9R1.2 CC1=CC=CC(CCl)=N1 AC-26182 [0,1,0,0,0,1|2,0,0]=4 546 B9R1.2 CC1=CC=CC(CN)=N1 AC-84527 [0,1,0,0,0,1|2,0,0]=4 547 B9R1.2 CC1=CN=CC(CBr)=C1 AC-83859 [0,1,0,0,0,1|2,0,0]=4 548 B9R1.2 CC1=CN=CC(CCl)=C1 AC-26183 [0,1,0,0,0,1|2,0,0]=4 549 B9R1.2 CC1=CN=CC(CCl)=C1 AC-76501 [0,1,0,0,0,1|2,0,0]=4 550 B9R1.2 CC1=CN=CC(CO)=N1 AC-81101 [0,1,0,0,0,1|1,1,0]=4 551 B9R1.2 CC1=NC(CCl)=NC=C1 AC-81323 [0,1,0,0,0,1|2,0,0]=4 552 B9R1.2 CC1=NC(CN)=NC=C1 AC-93001 [0,1,0,0,0,1|2,0,0]=4 553 B9R1.2 CC1=NC=CC(CCl)=N1 AC-89102 [0,1,0,0,0,1|2,0,0]=4 554 B9R1.2 CC1=NC=CC(CN)=C1 AC-41502 [0,1,0,0,0,1|2,0,0]=4 555 B9R1.2 CC1=NC=CC(CN)=C1 AC-44573 [0,1,0,0,0,1|2,0,0]=4 556 B9R1.2 CC1=NC=CC(CO)=C1 AC-41226 [0,1,0,0,0,1|1,1,0]=4 557 B9R1.2 CCC1=CC(Br)=CC=C1 AC-18413 [0,1,0,0,0,1|2,0,0]=4 558 B9R1.2 CCC1=CC(N)=NC=C1 AC-22647 [0,1,0,0,0,1|2,0,0]=4 559 B9R1.2 CCC1=CC=CC(Br)=N1 AC-80192 [0,1,0,0,0,1|2,0,0]=4 560 B9R1.2 CCC1=CC=CC(N)=N1 AC-22648 [0,1,0,0,0,1|2,0,0]=4 561 B9R1.2 CCC1=NC(C)=CN=C1 AC-85539 [0,1,0,0,0,1|2,0,0]=4 562 B9R1.2 CCC1=NC=CC(I)=C1 AC-93531 [0,1,0,0,0,1|2,0,0]=4 563 B9R1.2 CCC1=NC=NC(Cl)=C1 AC-34979 [0,1,0,0,0,1|2,0,0]=4 564 B9R1.2 ClC1=CC(CBr)=CC=C1 AC-19311 [0,1,0,0,0,1|2,0,0]=4 565 B9R1.2 ClC1=CC(CBr)=NC=C1 AC-76090 [0,1,0,0,0,1|2,0,0]=4 566 B9R1.2 ClCC1=CC=CC(Br)=N1 AC-92293 [0,1,0,0,0,1|2,0,0]=4 567 B9R1.2 ClCC1=CC=CC(Cl)=C1 AC-37702 [0,1,0,0,0,1|2,0,0]=4 568 B9R1.2 ClCC1=CC=CC(I)=C1 AC-81895 [0,1,0,0,0,1|2,0,0]=4 569 B9R1.2 ClCC1=CN=CC(Br)=C1 AC-76614 [0,1,0,0,0,1|2,0,0]=4 570 B9R1.2 ClCC1=CN=CC(Cl)=C1 AC-79879 [0,1,0,0,0,1|2,0,0]=4 571 B9R1.2 ClCC1=NC(Cl)=NC=C1 AC-71529 [0,1,0,0,0,1|2,0,0]=4 572 B9R1.2 FC1=CC(CCl)=NC=C1 AC-88555 [0,1,0,0,0,1|2,0,0]=4 573 B9R1.2 FC1=CN=CC(CCl)=C1 AC-79324 [0,1,0,0,0,1|2,0,0]=4 574 B9R1.2 NC1=CC(CO)=CC=C1 AC-22505 [0,1,0,0,0,1|1,1,0]=4 575 B9R1.2 NC1=CC=CC(CO)=N1 AC-68092 [0,1,0,0,0,1|1,1,0]=4 576 B9R1.2 NC1=CN=CC(CO)=C1 AC-79827 [0,1,0,0,0,1|1,1,0]=4 577 B9R1.2 NC1=NC=CC(CCl)=C1 AC-40999 [0,1,0,0,0,1|2,0,0]=4 578 B9R1.2 NC1=NC=CC(CO)=N1 AC-80569 [0,1,0,0,0,1|1,1,0]=4 579 B9R1.2 NCC1=CC(=O)NC=C1 AC-69572 [0,1,0,0,0,1|2,0,0]=4 580 B9R1.2 NCC1=CC(Br)=CN=C1 AC-41067 [0,1,0,0,0,1|2,0,0]=4 581 B9R1.2 NCC1=CC(Br)=CN=C1 AC-92356 [0,1,0,0,0,1|2,0,0]=4 582 B9R1.2 NCC1=CC(Br)=NC=C1 AC-25491 [0,1,0,0,0,1|2,0,0]=4 583 B9R1.2 NCC1=CC(Br)=NC=C1 AC-84441 [0,1,0,0,0,1|2,0,0]=4 584 B9R1.2 NCC1=CC(Cl)=CN=C1 AC-93598 [0,1,0,0,0,1|2,0,0]=4 585 B9R1.2 NCC1=CC(Cl)=NC=C1 AC-43333 [0,1,0,0,0,1|2,0,0]=4 586 B9R1.2 NCC1=CC(Cl)=NC=C1 AC-72790 [0,1,0,0,0,1|2,0,0]=4 587 B9R1.2 NCC1=CC(F)=CN=C1 AC-41008 [0,1,0,0,0,1|2,0,0]=4 588 B9R1.2 NCC1=CC(F)=NC=C1 AC-75434 [0,1,0,0,0,1|2,0,0]=4 589 B9R1.2 NCC1=CC(F)=NC=C1 AC-75435 [0,1,0,0,0,1|2,0,0]=4 590 B9R1.2 NCC1=CC(F)=NC=C1 AC-75436 [0,1,0,0,0,1|2,0,0]=4 591 B9R1.2 NCC1=CC(N)=NC=C1 AC-94500 [0,1,0,0,0,1|2,0,0]=4 592 B9R1.2 NCC1=CC(O)=CC=C1 AC-38059 [0,1,0,0,0,1|2,0,0]=4 593 B9R1.2 NCC1=CC=CC(Br)=C1 AC-18388 [0,1,0,0,0,1|2,0,0]=4 594 B9R1.2 NCC1=CC=CC(Br)=C1 AC-26582 [0,1,0,0,0,1|2,0,0]=4 595 B9R1.2 NCC1=CC=CC(Cl)=C1 AC-16989 [0,1,0,0,0,1|2,0,0]=4 596 B9R1.2 NCC1=CC=CC(N)=N1 AC-85506 [0,1,0,0,0,1|2,0,0]=4 597 B9R1.2 NCC1=CC=C[N+]([O-])=C1 AC-84681 [0,1,0,0,0,1|2,0,0]=4 598 B9R1.2 NCC1=NC(Br)=CC=C1 AC-25492 [0,1,0,0,0,1|2,0,0]=4 599 B9R1.2 NCC1=NC(Br)=CC=C1 AC-25493 [0,1,0,0,0,1|2,0,0]=4 600 B9R1.2 NCC1=NC(Cl)=CN=C1 AC-75538 [0,1,0,0,0,1|2,0,0]=4 601 B9R1.2 NCC1=NC(F)=CC=C1 AC-41007 [0,1,0,0,0,1|2,0,0]=4 602 B9R1.2 NCC1=NC(F)=CC=C1 AC-75540 [0,1,0,0,0,1|2,0,0]=4 603 B9R1.2 NCC1=NC=CC(Br)=C1 AC-68810 [0,1,0,0,0,1|2,0,0]=4 604 B9R1.2 NCC1=NC=CC(Br)=C1 AC-69625 [0,1,0,0,0,1|2,0,0]=4 605 B9R1.2 NCC1=NC=CC(Br)=C1 AC-80473 [0,1,0,0,0,1|2,0,0]=4 606 B9R1.2 NCC1=NC=CC(F)=C1 AC-75492 [0,1,0,0,0,1|2,0,0]=4 607 B9R1.2 NCC1=NC=CC(F)=C1 AC-75493 [0,1,0,0,0,1|2,0,0]=4 608 B9R1.2 O=C1C=CNC(CO)=C1 AC-80244 [0,1,0,0,0,1|1,1,0]=4 609 B9R1.2 OC1=CC(CBr)=NC=N1 AC-89383 [0,1,0,0,0,1|2,0,0]=4 610 B9R1.2 OC1=CC=CC(CBr)=C1 AC-76497 [0,1,0,0,0,1|2,0,0]=4 611 B9R1.2 OCC1=CC(Br)=NC=C1 AC-25495 [0,1,0,0,0,1|1,1,0]=4 612 B9R1.2 OCC1=CC(Cl)=NC=C1 AC-35205 [0,1,0,0,0,1|1,1,0]=4 613 B9R1.2 OCC1=CC(F)=CN=C1 AC-69956 [0,1,0,0,0,1|1,1,0]=4 614 B9R1.2 OCC1=CC(F)=NC=C1 AC-75437 [0,1,0,0,0,1|1,1,0]=4 615 B9R1.2 OCC1=CC=CC(Br)=N1 AC-13942 [0,1,0,0,0,1|1,1,0]=4 616 B9R1.2 OCC1=CC=CC(Cl)=C1 AC-14278 [0,1,0,0,0,1|1,1,0]=4 617 B9R1.2 OCC1=CC=CC(O)=C1 AC-14288 [0,1,0,0,0,1|1,1,0]=4 618 B9R1.2 OCC1=CC=CC(O)=N1 AC-93867 [0,1,0,0,0,1|1,1,0]=4 619 B9R1.2 OCC1=CN=CC(Br)=C1 AC-25010 [0,1,0,0,0,1|1,1,0]=4 620 B9R1.2 OCC1=CN=CC(O)=C1 AC-82683 [0,1,0,0,0,1|1,1,0]=4 621 B9R1.2 OCC1=NC(Br)=CN=C1 AC-86980 [0,1,0,0,0,1|1,1,0]=4 622 B9R1.2 OCC1=NC(Cl)=CC=C1 AC-26797 [0,1,0,0,0,1|1,1,0]=4 623 B9R1.2 OCC1=NC(Cl)=CN=C1 AC-72596 [0,1,0,0,0,1|1,1,0]=4 624 B9R1.2 OCC1=NC=CC(F)=C1 AC-75494 [0,1,0,0,0,1|1,1,0]=4 625 B9R1.2 OCC1=NC=CC(O)=C1 AC-79741 [0,1,0,0,0,1|1,1,0]=4 626 B9R1.2 [O-][N+]1=CC(CCl)=CC=C1 AC-76709 [0,1,0,0,0,1|2,0,0]=4 627 B9R1.6 CC(Br)C1=NC=CN=C1 AC-81558 [0,1,0,0,0,1|2,0,0]=4 628 B9R1.6 CC(N)C1=CC=CC=C1 AC-32241 [0,1,0,0,0,1|2,0,0]=4 629 B9R1.6 CC(O)C1=CC=CN=C1 AC-41175 [0,1,0,0,0,1|1,1,0]=4 630 B9R1.6 CC(O)C1=NC=CC=C1 AC-41174 [0,1,0,0,0,1|1,1,0]=4 631 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AC-13616 [0,1,0,0,0,1|2,0,0]=4 632 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AC-81041 [0,1,0,0,0,1|2,0,0]=4 633 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AC-64050 [0,1,0,0,0,1|1,1,0]=4 634 B9R1.6 C[C@H](N)C1=CC=CC=C1 AC-13614 [0,1,0,0,0,1|2,0,0]=4 635 B9R1.8 BrCCC1=CC=CC=C1 AC-10988 [0,1,0,0,0,1|2,0,0]=4 636 B9R1.8 BrCCC1=NC=CC=C1 AC-24894 [0,1,0,0,0,1|2,0,0]=4 637 B9R1.8 BrCCC1=NC=CC=C1 AC-33015 [0,1,0,0,0,1|2,0,0]=4 638 B9R1.8 CCCC1=CC=NC=C1 AC-12668 [0,1,0,0,0,1|2,0,0]=4 639 B9R1.8 CCNC1=NC=CC=C1 AC-28871 [0,1,0,0,0,1|2,0,0]=4 640 B9R1.8 CCNC1=NC=CN=C1 AC-92793 [0,1,0,0,0,1|2,0,0]=4 641 B9R1.8 CCOC1=NC=CC=C1 AC-11163 [0,1,0,0,0,1|2,0,0]=4 642 B9R1.8 CCOC1=NC=CN=C1 AC-13440 [0,1,0,0,0,1|2,0,0]=4 643 B9R1.8 CCOC1=NN=CC=C1 AC-91823 [0,1,0,0,0,1|2,0,0]=4 644 B9R1.8 CNCC1=CC=CN=C1 AC-31451 [0,1,0,0,0,1|2,0,0]=4 645 B9R1.8 CNCC1=CC=NC=C1 AC-41285 [0,1,0,0,0,1|2,0,0]=4 646 B9R1.8 CNCC1=CC=NC=C1 AC-92743 [0,1,0,0,0,1|2,0,0]=4 647 B9R1.8 CNCC1=NC=CC=C1 AC-41284 [0,1,0,0,0,1|2,0,0]=4 648 B9R1.8 CNCC1=NC=CN=C1 AC-90842 [0,1,0,0,0,1|2,0,0]=4 649 B9R1.8 COCC1=NC=CC=C1 AC-30327 [0,1,0,0,0,1|1,1,0]=4 650 B9R1.8 N#CCC1=CC=CN=C1 AC-24013 [0,1,0,0,0,1|2,0,0]=4 651 B9R1.8 N#CCC1=NC=CC=C1 AC-11591 [0,1,0,0,0,1|2,0,0]=4 652 B9R1.8 NCCC1=CC=CN=C1 AC-10206 [0,1,0,0,0,1|2,0,0]=4 653 B9R1.8 NCCC1=CC=CN=C1 AC-95294 [0,1,0,0,0,1|2,0,0]=4 654 B9R1.8 NCCC1=NC=CC=C1 AC-22649 [0,1,0,0,0,1|2,0,0]=4 655 B9R1.8 NCCC1=NC=CC=N1 AC-94495 [0,1,0,0,0,1|2,0,0]=4 656 B9R1.8 NNCC1=CC=CC=C1 AC-75839 [0,1,0,0,0,1|2,0,0]=4 657 B9R1.8 NNCC1=CC=CN=C1 AC-75992 [0,1,0,0,0,1|2,0,0]=4 658 B9R1.8 NNCC1=CC=NC=C1 AC-69402 [0,1,0,0,0,1|2,0,0]=4 659 B9R1.8 NNCC1=CC=NC=C1 AC-75993 [0,1,0,0,0,1|2,0,0]=4 660 B9R1.8 NNCC1=NC=CC=C1 AC-75991 [0,1,0,0,0,1|2,0,0]=4 661 B9R1.8 NOCC1=CC=CC=C1 AC-13722 [0,1,0,0,0,1|1,1,0]=4 662 B9R1.8 O=CCC1=NC=CC=C1 AC-86545 [0,1,0,0,0,1|1,1,0]=4 663 B9R1.8 OCCC1=CC=CN=C1 AC-17846 [0,1,0,0,0,1|1,1,0]=4 664 B9R1.8 OCCC1=NC=CC=C1 AC-57914 [0,1,0,0,0,1|1,1,0]=4 665 B9R1.8 OCCC1=NC=CC=N1 AC-92422 [0,1,0,0,0,1|1,1,0]=4 666 B9R1.8 ONCC1=CC=CC=C1 AC-45409 [0,1,0,0,0,1|1,1,0]=4 667 B9R1.8 [C-]#[N+]CC1=NC=CC=C1 AC-76114 [0,1,0,0,0,1|2,0,0]=4 668 B9R1.15 BrCC1=CC=CN=C1Br AC-33144 [0,1,0,0,0,1|2,0,0]=4 669 B9R1.15 BrCC1=NC=CC=C1Br AC-92748 [0,1,0,0,0,1|2,0,0]=4 670 B9R1.15 CC1=C(CBr)C=NC=C1 AC-91663 [0,1,0,0,0,1|2,0,0]=4 671 B9R1.15 CC1=C(CN)C=CN=C1 AC-41501 [0,1,0,0,0,1|2,0,0]=4 672 B9R1.15 CC1=C(CO)C=NC=C1 AC-69836 [0,1,0,0,0,1|1,1,0]=4 673 B9R1.15 CC1=CC=CN=C1CBr AC-76086 [0,1,0,0,0,1|2,0,0]=4 674 B9R1.15 CC1=CC=CN=C1CBr AC-92173 [0,1,0,0,0,1|2,0,0]=4 675 B9R1.15 CC1=CC=CN=C1CN AC-41496 [0,1,0,0,0,1|2,0,0]=4 676 B9R1.15 CC1=CC=CN=C1CO AC-42281 [0,1,0,0,0,1|1,1,0]=4 677 B9R1.15 CC1=NC=CC=C1CCl AC-69852 [0,1,0,0,0,1|2,0,0]=4 678 B9R1.15 CC1=NC=CC=C1CN AC-44572 [0,1,0,0,0,1|2,0,0]=4 679 B9R1.15 CC1=NC=CN=C1CN AC-69265 [0,1,0,0,0,1|2,0,0]=4 680 B9R1.15 CCC1=C(Br)C=CN=C1 AC-69694 [0,1,0,0,0,1|2,0,0]=4 681 B9R1.15 CCC1=C(Br)C=NC=C1 AC-24895 [0,1,0,0,0,1|2,0,0]=4 682 B9R1.15 CCC1=C(Br)C=NC=N1 AC-89800 [0,1,0,0,0,1|2,0,0]=4 683 B9R1.15 CCC1=CC=CC=C1Br AC-38136 [0,1,0,0,0,1|2,0,0]=4 684 B9R1.15 CCC1=CC=CC=C1I AC-82889 [0,1,0,0,0,1|2,0,0]=4 685 B9R1.15 CCC1=NC=CN=C1C AC-14206 [0,1,0,0,0,1|2,0,0]=4 686 B9R1.15 ClC1=CC=CC=C1CBr AC-14186 [0,1,0,0,0,1|2,0,0]=4 687 B9R1.15 ClC1=CC=CN=C1CBr AC-76084 [0,1,0,0,0,1|2,0,0]=4 688 B9R1.15 ClC1=CC=CN=C1CBr AC-76085 [0,1,0,0,0,1|2,0,0]=4 689 B9R1.15 ClCC1=CC=CC=C1Cl AC-37585 [0,1,0,0,0,1|2,0,0]=4 690 B9R1.15 ClCC1=CC=CN=C1Br AC-84994 [0,1,0,0,0,1|2,0,0]=4 691 B9R1.15 ClCC1=NC=CC=C1Br AC-84732 [0,1,0,0,0,1|2,0,0]=4 692 B9R1.15 ClCC1=NC=CC=C1Br AC-91275 [0,1,0,0,0,1|2,0,0]=4 693 B9R1.15 ClCC1=NC=CN=C1Cl AC-79800 [0,1,0,0,0,1|2,0,0]=4 694 B9R1.15 FC1=NC=CC=C1CCl AC-91873 [0,1,0,0,0,1|2,0,0]=4 695 B9R1.15 FC1=NC=CC=C1CCl AC-91874 [0,1,0,0,0,1|2,0,0]=4 696 B9R1.15 NC1=C(CBr)C=CN=C1 AC-85642 [0,1,0,0,0,1|2,0,0]=4 697 B9R1.15 NC1=C(CO)C=NC=C1 AC-75489 [0,1,0,0,0,1|1,1,0]=4 698 B9R1.15 NC1=CC=CN=C1CO AC-71775 [0,1,0,0,0,1|1,1,0]=4 699 B9R1.15 NC1=NC=CC=C1CCl AC-93501 [0,1,0,0,0,1|2,0,0]=4 700 B9R1.15 NCC1=C(Br)C=NC=N1 AC-87395 [0,1,0,0,0,1|2,0,0]=4 701 B9R1.15 NCC1=C(Cl)C=NC=C1 AC-75473 [0,1,0,0,0,1|2,0,0]=4 702 B9R1.15 NCC1=C(F)C=NC=C1 AC-75478 [0,1,0,0,0,1|2,0,0]=4 703 B9R1.15 NCC1=C(F)C=NC=C1 AC-75479 [0,1,0,0,0,1|2,0,0]=4 704 B9R1.15 NCC1=C(N)C=NC=C1 AC-90796 [0,1,0,0,0,1|2,0,0]=4 705 B9R1.15 NCC1=CC=CC=C1Br AC-33299 [0,1,0,0,0,1|2,0,0]=4 706 B9R1.15 NCC1=CC=CC=C1O AC-65632 [0,1,0,0,0,1|2,0,0]=4 707 B9R1.15 NCC1=CC=CC=C1O AC-77351 [0,1,0,0,0,1|2,0,0]=4 708 B9R1.15 NCC1=CC=CN=C1Cl AC-26815 [0,1,0,0,0,1|2,0,0]=4 709 B9R1.15 NCC1=CC=CN=C1Cl AC-82682 [0,1,0,0,0,1|2,0,0]=4 710 B9R1.15 NCC1=CC=CN=C1N AC-56452 [0,1,0,0,0,1|2,0,0]=4 711 B9R1.15 NCC1=CC=CN=C1N AC-84723 [0,1,0,0,0,1|2,0,0]=4 712 B9R1.15 NCC1=NC=CC=C1Br AC-85830 [0,1,0,0,0,1|2,0,0]=4 713 B9R1.15 NCC1=NC=CC=C1Br AC-94154 [0,1,0,0,0,1|2,0,0]=4 714 B9R1.15 NCC1=NC=CC=C1Cl AC-68866 [0,1,0,0,0,1|2,0,0]=4 715 B9R1.15 NCC1=NC=CC=C1Cl AC-92190 [0,1,0,0,0,1|2,0,0]=4 716 B9R1.15 NCC1=NC=CC=C1F AC-75477 [0,1,0,0,0,1|2,0,0]=4 717 B9R1.15 NCC1=NC=CC=C1F AC-80937 [0,1,0,0,0,1|2,0,0]=4 718 B9R1.15 NCC1=NC=CN=C1Cl AC-40776 [0,1,0,0,0,1|2,0,0]=4 719 B9R1.15 O=C1C=CNC=C1CO AC-88385 [0,1,0,0,0,1|1,1,0]=4 720 B9R1.15 OCC1=C(Br)C=CN=C1 AC-43110 [0,1,0,0,0,1|1,1,0]=4 721 B9R1.15 OCC1=C(Br)C=NC=C1 AC-43886 [0,1,0,0,0,1|1,1,0]=4 722 B9R1.15 OCC1=C(Cl)C=CN=C1 AC-86577 [0,1,0,0,0,1|1,1,0]=4 723 B9R1.15 OCC1=CC=CC=C1Cl AC-19310 [0,1,0,0,0,1|1,1,0]=4 724 B9R1.15 OCC1=CC=CC=C1I AC-23760 [0,1,0,0,0,1|1,1,0]=4 725 B9R1.15 OCC1=CC=CN=C1F AC-29712 [0,1,0,0,0,1|1,1,0]=4 726 B9R1.15 OCC1=NC=CC=C1Br AC-75471 [0,1,0,0,0,1|1,1,0]=4 727 B9R1.15 OCC1=NC=CC=C1Cl AC-71216 [0,1,0,0,0,1|1,1,0]=4 728 B9R1.15 OCC1=NC=CN=C1Cl AC-42808 [0,1,0,0,0,1|1,1,0]=4 729 B9R1.7 CC1=CC=C(CCN)S1 AC-61042 [0,2,0,0,0,0|1,1,0]=4 730 B9R1.7 CNCC1=CC(C)=NO1 AC-54224 [0,2,0,0,0,0|2,0,0]=4 731 B9R1.21 CCC1=CC=C(C=O)O1 AC-58015 [0,2,0,0,0,0|1,0,0]=3 732 B9R1.21 CCC1=CC=C(CC)N1 AC-95569 [0,2,0,0,0,0|2,0,0]=4 733 B9R1.21 CCC1=CC=C(CC)S1 AC-96382 [0,2,0,0,0,0|1,1,0]=4 734 B9R1.21 ClCC1=CC=C(CCl)S1 AC-79583 [0,2,0,0,0,0|1,1,0]=4 735 B9R1.21 N#CC1=CC=C(CBr)S1 AC-80124 [0,2,0,0,0,0|1,1,0]=4 736 B9R1.21 N#CC1=CC=C(CN)S1 AC-59658 [0,2,0,0,0,0|1,1,0]=4 737 B9R1.21 N#CC1=COC(CN)=C1 AC-32390 [0,2,0,0,0,0|1,0,0]=3 738 B9R1.21 O=CC1=CC=C(C=O)O1 AC-65879 [0,2,0,0,0,0|0,1,1]=4 739 B9R1.21 O=CC1=CC=C(CO)N1 AC-80446 [0,2,0,0,0,0|1,1,0]=4 740 B9R1.21 OCC1=CC=C(CO)O1 AC-61931 [0,2,0,0,0,0|0,1,0]=3 741 B9R1.22 CC1=C(CCl)OC(=O)O1 AC-20243 [0,2,0,0,0,0|2,0,0]=4 742 B9R1.22 CC1=C(CO)OC(=O)O1 AC-41585 [0,2,0,0,0,0|1,1,0]=4 743 B9R1.23 O=CC1=CC(Br)=C(Br)O1 AC-10395 [0,2,0,0,0,0|0,1,1]=4 744 B9R1.35 CC(=O)C1=CC=C(Br)O1 AC-79567 [0,2,0,0,0,0|0,1,1]=4 745 B9R1.35 CC(=O)C1=CC=C(N)O1 AC-94559 [0,2,0,0,0,0|0,1,1]=4 746 B9R1.35 CC(N)C1=CC=C(Cl)S1 AC-46308 [0,2,0,0,0,0|1,1,0]=4 747 B9R1.35 CC1=CC=C(B(O)O)O1 AC-21523 [0,2,0,0,0,0|1,1,0]=4 748 B9R1.35 CC1=CC=C(C(C)C)O1 AC-87634 [0,2,0,0,0,0|1,0,0]=3 749 B9R1.35 O=C(O)C1=CC(Br)=CO1 AC-24987 [0,2,0,0,0,0|0,1,1]=4 750 B9R1.35 O=C(O)C1=CC=C(Br)O1 AC-18438 [0,2,0,0,0,0|0,1,1]=4 751 B9R1.132 BrCC1=C(Br)C(Br)=CS1 AC-92545 [0,2,0,0,0,0|1,1,0]=4 752 B9R1.11 COC(=O)C1=CC=CO1 AC-15203 [0,2,0,0,0,0|0,1,1]=4 753 B9R1.11 NNC(=O)C1=CC=CO1 AC-23737 [0,2,0,0,0,0|0,1,1]=4 754 B9R1.11 O=C(CBr)C1=CC=CS1 AC-34122 [0,2,0,0,0,0|1,1,0]=4 755 B9R1.19 CC(C)(O)C1=CC=CO1 AC-89853 [0,2,0,0,0,0|0,1,0]=3 756 B9R1.19 FC(F)(F)C1=CC=CS1 AC-94947 [0,2,0,0,0,0|1,1,0]=4 757 B9R1.41 CC1=C(C(=O)O)OC=C1 AC-30965 [0,2,0,0,0,0|0,1,1]=4 758 B9R1.12 CCOCC1=CC=CO1 AC-77358 [0,2,0,0,0,0|0,1,0]=3 759 B9R1.13 CN(C)CC1=CC=CN1 AC-53235 [0,2,0,0,0,0|2,0,0]=4 760 B9R1.13 O=C(Cl)CC1=CC=CS1 AC-14244 [0,2,0,0,0,0|0,2,0]=4 761 B9R1.13 O=C(O)CC1=CC=CO1 AC-45115 [0,2,0,0,0,0|0,1,0]=3 762 B9R1.13 O=C(O)CC1=CC=CS1 AC-13546 [0,2,0,0,0,0|0,2,0]=4 763 B9R1.33 CCOC1=C(C)N=CO1 AC-15206 [0,2,0,0,0,0|2,0,0]=4 764 B9R1.33 CNCC1=CC=CN1C AC-56678 [0,2,0,0,0,0|2,0,0]=4 765 B7R1.3 OC1=CC=CN=C1 AC-41183 [0,0,1,1,0,0|1,0,1]=4 766 B7R1.3 OC1=NC=CC=C1 AC-15386 [0,0,1,1,0,0|2,0,0]=4 767 B9R2.3 C1=CC2=CSC=C2S1 AC-90809 [0,1,0,1,0,0|0,1,1]=4