0 B6R1.2 BrC1=CC=CO1 SBB054415 [0,0,0,0,0,0|1,0,0]=1 1 B6R1.2 BrC1=CC=CS1 SBB003931 [0,0,0,0,0,0|1,1,0]=2 2 B6R1.2 BrC1=CC=NN1 SBB062821 [0,0,0,0,0,0|3,0,0]=3 3 B6R1.2 BrC1=CC=NS1 SBB027176 [0,0,0,0,0,0|2,1,0]=3 4 B6R1.2 BrC1=CN=CS1 SBB054428 [0,0,0,0,0,0|2,1,0]=3 5 B6R1.2 BrC1=CNN=C1 SBB000097 [0,0,0,0,0,0|4,0,0]=4 6 B6R1.2 BrC1=COC=C1 SBB004098 [0,0,0,0,0,0|3,0,0]=3 7 B6R1.2 BrC1=CSC=C1 SBB003930 [0,0,0,0,0,0|3,0,0]=3 8 B6R1.2 BrC1=CSN=C1 SBB013032 [0,0,0,0,0,0|4,0,0]=4 9 B6R1.2 BrC1=NC=CN1 SBB054452 [0,0,0,0,0,0|3,0,0]=3 10 B6R1.2 BrC1=NC=CS1 SBB003918 [0,0,0,0,0,0|2,1,0]=3 11 B6R1.2 BrC1=NC=NN1 SBB050161 [0,0,0,0,0,0|4,0,0]=4 12 B6R1.2 BrC1=NN=CS1 SBB054616 [0,0,0,0,0,0|3,1,0]=4 13 B6R1.2 CC1=CN=CS1 SBB055804 [0,0,0,0,0,0|1,1,0]=2 14 B6R1.2 CC1=CNN=C1 SBB004402 [0,0,0,0,0,0|3,0,0]=3 15 B6R1.2 CC1=CON=C1 SBB025727 [0,0,0,0,0,0|3,0,0]=3 16 B6R1.2 CC1=NC=CN1 SBB040944 [0,0,0,0,0,0|2,0,0]=2 17 B6R1.2 CC1=NCCN1 SBB040067 [0,0,0,0,0,0|2,0,2]=4 18 B6R1.2 CC1=NN=CN1 SBB025943 [0,0,0,0,0,0|3,0,0]=3 19 B6R1.2 CC1=NN=NN1 SBB014296 [0,0,0,0,0,0|4,0,0]=4 20 B6R1.2 CC1=NNC=C1 SBB004404 [0,0,0,0,0,0|2,0,0]=2 21 B6R1.2 CN1C=CC=N1 SBB013729 [0,0,0,0,0,0|2,0,0]=2 22 B6R1.2 CN1C=CN=C1 SBB007574 [0,0,0,0,0,0|3,0,0]=3 23 B6R1.2 CN1C=NN=N1 SBB013782 [0,0,0,0,0,0|4,0,0]=4 24 B6R1.2 CN1N=CN=N1 SBB013781 [0,0,0,0,0,0|4,0,0]=4 25 B6R1.2 ClC1=CNN=C1 SBB000035 [0,0,0,0,0,0|4,0,0]=4 26 B6R1.2 ClC1=NC=CS1 SBB054425 [0,0,0,0,0,0|2,1,0]=3 27 B6R1.2 ClC1=NC=NN1 SBB019448 [0,0,0,0,0,0|4,0,0]=4 28 B6R1.2 FC1=CC=CS1 SBB073288 [0,0,0,0,0,0|1,1,0]=2 29 B6R1.2 IC1=CC=CS1 SBB054409 [0,0,0,0,0,0|1,1,0]=2 30 B6R1.2 IC1=CNC=N1 SBB054451 [0,0,0,0,0,0|3,0,0]=3 31 B6R1.2 IC1=CNN=C1 SBB025965 [0,0,0,0,0,0|4,0,0]=4 32 B6R1.2 IC1=CSN=C1 SBB074233 [0,0,0,0,0,0|4,0,0]=4 33 B6R1.2 IC1=NC=CN1 SBB054450 [0,0,0,0,0,0|3,0,0]=3 34 B6R1.2 IC1=NN=CN1 SBB019405 [0,0,0,0,0,0|4,0,0]=4 35 B6R1.2 N1C=CC(I)=N1 SBB091657 [0,0,0,0,0,0|3,0,0]=3 36 B6R1.2 NC1=CCNN1 SBB023708 [0,0,0,0,0,0|3,0,1]=4 37 B6R1.2 NC1=CN=CN1 SBB017132 [0,0,0,0,0,0|3,0,0]=3 38 B6R1.2 NC1=CN=CS1 SBB069743 [0,0,0,0,0,0|2,1,0]=3 39 B6R1.2 NC1=CNN=C1 SBB018730 [0,0,0,0,0,0|4,0,0]=4 40 B6R1.2 NC1=NC=CN1 SBB001015 [0,0,0,0,0,0|3,0,0]=3 41 B6R1.2 NC1=NC=CN1 SBB051944 [0,0,0,0,0,0|3,0,0]=3 42 B6R1.2 NC1=NC=CN1 SBB051945 [0,0,0,0,0,0|3,0,0]=3 43 B6R1.2 NC1=NC=CO1 SBB019333 [0,0,0,0,0,0|2,0,0]=2 44 B6R1.2 NC1=NC=CS1 SBB000070 [0,0,0,0,0,0|2,1,0]=3 45 B6R1.2 NC1=NC=CS1 SBB028135 [0,0,0,0,0,0|2,1,0]=3 46 B6R1.2 NC1=NC=NS1 SBB014839 [0,0,0,0,0,0|3,1,0]=4 47 B6R1.2 NC1=NN=CS1 SBB010052 [0,0,0,0,0,0|3,1,0]=4 48 B6R1.2 NC1=NNC=C1 SBB004401 [0,0,0,0,0,0|3,0,0]=3 49 B6R1.2 NC1=NNC=N1 SBB004400 [0,0,0,0,0,0|4,0,0]=4 50 B6R1.2 NC1=NOC=C1 SBB051928 [0,0,0,0,0,0|3,0,0]=3 51 B6R1.2 NN1C=CN=N1 SBB000029 [0,0,0,0,0,0|4,0,0]=4 52 B6R1.2 O=C1C=CCO1 SBB040281 [0,0,0,0,0,0|1,0,1]=2 53 B6R1.2 O=C1NC=CN1 SBB071638 [0,0,0,0,0,0|3,0,0]=3 54 B6R1.2 O=C1NC=NN1 SBB116064 [0,0,0,0,0,0|4,0,0]=4 55 B6R1.2 S=C1NC=NN1 SBB016173 [0,0,0,0,0,0|4,0,0]=4 56 B6R1.2 SC1=CC=CS1 SBB059094 [0,0,0,0,0,0|1,1,0]=2 57 B6R1.2 SC1=NC=CN1 SBB004368 [0,0,0,0,0,0|3,0,0]=3 58 B6R1.2 SC1=NC=CS1 SBB066357 [0,0,0,0,0,0|2,1,0]=3 59 B6R1.2 SC1=NN=CS1 SBB041074 [0,0,0,0,0,0|3,1,0]=4 60 B6R1.2 SC1=NNC=N1 SBB004364 [0,0,0,0,0,0|4,0,0]=4 61 B5R1.1 C1=CNC=N1 SBB040815 [1,0,0,0,0,0|2,0,0]=3 62 B5R1.1 C1=CNN=C1 SBB059844 [1,0,0,0,0,0|2,0,0]=3 63 B5R1.1 C1=CNN=N1 SBB058566 [1,0,0,0,0,0|3,0,0]=4 64 B5R1.1 C1=COC=N1 SBB061419 [1,0,0,0,0,0|1,0,0]=2 65 B5R1.1 C1=CSN=C1 SBB012883 [1,0,0,0,0,0|1,1,0]=3 66 B5R1.1 C1=NC=NN1 SBB040922 [1,0,0,0,0,0|3,0,0]=4 67 B7R1.1 BrCC1=CSC=C1 SBB070721 [0,1,0,0,0,0|2,0,0]=3 68 B7R1.1 BrCC1=CSC=N1 SBB054932 [0,1,0,0,0,0|2,0,0]=3 69 B7R1.1 C#CC1=CC=CS1 SBB008821 [0,1,0,0,0,0|0,1,1]=3 70 B7R1.1 C#CC1=CSC=C1 SBB066455 [0,1,0,0,0,0|2,0,1]=4 71 B7R1.1 C(=O)C1=CN=CN1 SBB004381 [0,1,0,0,0,0|2,0,1]=4 72 B7R1.1 C(=O)C1=CN=CN1 SBB004382 [0,1,0,0,0,0|2,0,1]=4 73 B7R1.1 C(=O)C1=CSC=C1 SBB004320 [0,1,0,0,0,0|2,0,1]=4 74 B7R1.1 CCN1C=CC=N1 SBB020346 [0,1,0,0,0,0|2,0,0]=3 75 B7R1.1 CCN1C=CN=C1 SBB045396 [0,1,0,0,0,0|3,0,0]=4 76 B7R1.1 CSC1=CC=CS1 SBB085766 [0,1,0,0,0,0|0,1,0]=2 77 B7R1.1 CSC1=CSC=C1 SBB055747 [0,1,0,0,0,0|2,0,0]=3 78 B7R1.1 CSC1=NN=CN1 SBB059216 [0,1,0,0,0,0|3,0,0]=4 79 B7R1.1 ClCC1=CC=NO1 SBB013787 [0,1,0,0,0,0|1,0,0]=2 80 B7R1.1 ClCC1=CSC=N1 SBB054935 [0,1,0,0,0,0|2,0,0]=3 81 B7R1.1 ClCC1=NOC=C1 SBB013648 [0,1,0,0,0,0|2,0,0]=3 82 B7R1.1 ClCC1=NOC=N1 SBB005592 [0,1,0,0,0,0|3,0,0]=4 83 B7R1.1 N#CC1=CC=CN1 SBB067109 [0,1,0,0,0,0|1,0,1]=3 84 B7R1.1 N#CC1=CC=CO1 SBB055776 [0,1,0,0,0,0|0,0,1]=2 85 B7R1.1 N#CC1=CC=CS1 SBB055745 [0,1,0,0,0,0|0,1,1]=3 86 B7R1.1 N#CC1=CNC=N1 SBB055864 [0,1,0,0,0,0|2,0,1]=4 87 B7R1.1 N#CC1=CSC=C1 SBB047994 [0,1,0,0,0,0|2,0,1]=4 88 B7R1.1 N#CC1=CSC=N1 SBB059707 [0,1,0,0,0,0|2,0,1]=4 89 B7R1.1 N#CC1=NNC=C1 SBB055854 [0,1,0,0,0,0|2,0,1]=4 90 B7R1.1 NCC1=CC=CO1 SBB004376 [0,1,0,0,0,0|0,0,0]=1 91 B7R1.1 NCC1=CC=CS1 SBB004315 [0,1,0,0,0,0|0,1,0]=2 92 B7R1.1 NCC1=CN=CS1 SBB047473 [0,1,0,0,0,0|1,1,0]=3 93 B7R1.1 NCC1=CNN=C1 SBB026489 [0,1,0,0,0,0|3,0,0]=4 94 B7R1.1 NCC1=CSC=C1 SBB079179 [0,1,0,0,0,0|2,0,0]=3 95 B7R1.1 NCC1=CSC=N1 SBB047472 [0,1,0,0,0,0|2,0,0]=3 96 B7R1.1 NCC1=NC=CN1 SBB013485 [0,1,0,0,0,0|2,0,0]=3 97 B7R1.1 NCC1=NC=CN1 SBB052487 [0,1,0,0,0,0|2,0,0]=3 98 B7R1.1 NCC1=NC=CS1 SBB052479 [0,1,0,0,0,0|1,1,0]=3 99 B7R1.1 NCC1=NNC=C1 SBB020888 [0,1,0,0,0,0|2,0,0]=3 100 B7R1.1 NCC1=NOC=N1 SBB052491 [0,1,0,0,0,0|3,0,0]=4 101 B7R1.1 O=CC1=CC=CN1 SBB004389 [0,1,0,0,0,0|1,0,1]=3 102 B7R1.1 O=CC1=CC=CN1 SBB004390 [0,1,0,0,0,0|1,0,1]=3 103 B7R1.1 O=CC1=CC=CO1 SBB004386 [0,1,0,0,0,0|0,0,1]=2 104 B7R1.1 O=CC1=CC=CS1 SBB004321 [0,1,0,0,0,0|0,1,1]=3 105 B7R1.1 O=CC1=CN=CS1 SBB052293 [0,1,0,0,0,0|1,1,1]=4 106 B7R1.1 O=CC1=CNC=C1 SBB052279 [0,1,0,0,0,0|2,0,1]=4 107 B7R1.1 O=CC1=COC=C1 SBB004385 [0,1,0,0,0,0|2,0,1]=4 108 B7R1.1 O=CC1=COC=N1 SBB052299 [0,1,0,0,0,0|2,0,1]=4 109 B7R1.1 O=CC1=CSC=N1 SBB047478 [0,1,0,0,0,0|2,0,1]=4 110 B7R1.1 O=CC1=NC=CN1 SBB004383 [0,1,0,0,0,0|2,0,1]=4 111 B7R1.1 O=CC1=NC=CN1 SBB004384 [0,1,0,0,0,0|2,0,1]=4 112 B7R1.1 O=CC1=NC=CO1 SBB052295 [0,1,0,0,0,0|1,0,1]=3 113 B7R1.1 O=CC1=NC=CS1 SBB052286 [0,1,0,0,0,0|1,1,1]=4 114 B7R1.1 O=CC1=NNC=C1 SBB052310 [0,1,0,0,0,0|2,0,1]=4 115 B7R1.1 OCC1=CC=CO1 SBB004373 [0,1,0,0,0,0|0,0,0]=1 116 B7R1.1 OCC1=CC=CS1 SBB058563 [0,1,0,0,0,0|0,1,0]=2 117 B7R1.1 OCC1=CC=NN1 SBB014141 [0,1,0,0,0,0|2,0,0]=3 118 B7R1.1 OCC1=CN=CS1 SBB066375 [0,1,0,0,0,0|1,1,0]=3 119 B7R1.1 OCC1=CN=NN1 SBB013581 [0,1,0,0,0,0|3,0,0]=4 120 B7R1.1 OCC1=CNC=N1 SBB004207 [0,1,0,0,0,0|2,0,0]=3 121 B7R1.1 OCC1=CNC=N1 SBB054821 [0,1,0,0,0,0|2,0,0]=3 122 B7R1.1 OCC1=CNN=C1 SBB073660 [0,1,0,0,0,0|3,0,0]=4 123 B7R1.1 OCC1=CSC=C1 SBB004309 [0,1,0,0,0,0|2,0,0]=3 124 B7R1.1 OCC1=CSC=N1 SBB066562 [0,1,0,0,0,0|2,0,0]=3 125 B7R1.1 OCC1=NC=CN1 SBB054820 [0,1,0,0,0,0|2,0,0]=3 126 B7R1.1 OCC1=NC=CS1 SBB054805 [0,1,0,0,0,0|1,1,0]=3 127 B7R1.1 SCC1=CC=CO1 SBB004308 [0,1,0,0,0,0|0,0,0]=1 128 B7R1.2 BrC1=CSC(Br)=C1 SBB099511 [0,1,0,0,0,0|1,1,0]=3 129 B7R1.2 BrC1=CSC(Br)=N1 SBB054426 [0,1,0,0,0,0|2,1,0]=4 130 B7R1.2 CC1=CC(=O)NO1 SBB055813 [0,1,0,0,0,0|1,0,0]=2 131 B7R1.2 CC1=CC(C)=NN1 SBB004377 [0,1,0,0,0,0|2,0,0]=3 132 B7R1.2 CC1=CC(C)=NO1 SBB042637 [0,1,0,0,0,0|1,0,0]=2 133 B7R1.2 CC1=CC(N)=NO1 SBB005553 [0,1,0,0,0,0|1,0,0]=2 134 B7R1.2 CC1=CC=C(C)N1 SBB059455 [0,1,0,0,0,0|1,0,0]=2 135 B7R1.2 CC1=CC=C(Cl)S1 SBB054408 [0,1,0,0,0,0|0,1,0]=2 136 B7R1.2 CC1=CN(C)C=N1 SBB073385 [0,1,0,0,0,0|2,0,0]=3 137 B7R1.2 CC1=CN(C)N=C1 SBB073292 [0,1,0,0,0,0|2,0,0]=3 138 B7R1.2 CC1=CN=C(Br)S1 SBB054420 [0,1,0,0,0,0|1,1,0]=3 139 B7R1.2 CC1=CN=C(N)S1 SBB028194 [0,1,0,0,0,0|1,1,0]=3 140 B7R1.2 CC1=CNC(C)=C1 SBB059454 [0,1,0,0,0,0|1,0,0]=2 141 B7R1.2 CC1=COC(N)=N1 SBB051930 [0,1,0,0,0,0|2,0,0]=3 142 B7R1.2 CC1=CSC(Br)=N1 SBB054421 [0,1,0,0,0,0|2,0,0]=3 143 B7R1.2 CC1=CSC(S)=N1 SBB041075 [0,1,0,0,0,0|2,0,0]=3 144 B7R1.2 CC1=NN(C)C=C1 SBB015024 [0,1,0,0,0,0|2,0,0]=3 145 B7R1.2 CC1=NN=C(Br)S1 SBB041010 [0,1,0,0,0,0|2,1,0]=4 146 B7R1.2 CC1=NN=C(Cl)S1 SBB111880 [0,1,0,0,0,0|2,1,0]=4 147 B7R1.2 CC1=NN=C(I)S1 SBB116057 [0,1,0,0,0,0|2,1,0]=4 148 B7R1.2 CC1=NN=C(N)O1 SBB046365 [0,1,0,0,0,0|2,0,0]=3 149 B7R1.2 CC1=NN=C(N)S1 SBB000045 [0,1,0,0,0,0|2,1,0]=4 150 B7R1.2 CC1=NN=C(S)N1 SBB024699 [0,1,0,0,0,0|3,0,0]=4 151 B7R1.2 CC1=NNC(=S)S1 SBB041073 [0,1,0,0,0,0|2,1,0]=4 152 B7R1.2 CC1=NNC(C)=N1 SBB108831 [0,1,0,0,0,0|3,0,0]=4 153 B7R1.2 CC1=NNC(Cl)=N1 SBB019449 [0,1,0,0,0,0|3,0,0]=4 154 B7R1.2 CC1=NNC(N)=C1 SBB004375 [0,1,0,0,0,0|2,0,0]=3 155 B7R1.2 CC1=NNC(N)=N1 SBB013163 [0,1,0,0,0,0|3,0,0]=4 156 B7R1.2 CC1=NOC(N)=C1 SBB006539 [0,1,0,0,0,0|2,0,0]=3 157 B7R1.2 CC1=NSC(N)=C1 SBB004066 [0,1,0,0,0,0|2,0,0]=3 158 B7R1.2 CC1=NSC(N)=N1 SBB005481 [0,1,0,0,0,0|3,0,0]=4 159 B7R1.2 CN1C=C(Br)C=N1 SBB019150 [0,1,0,0,0,0|2,0,0]=3 160 B7R1.2 CN1C=C(Cl)C=N1 SBB047361 [0,1,0,0,0,0|2,0,0]=3 161 B7R1.2 CN1C=C(I)C=N1 SBB027265 [0,1,0,0,0,0|2,0,0]=3 162 B7R1.2 CN1C=C(N)C=N1 SBB009607 [0,1,0,0,0,0|2,0,0]=3 163 B7R1.2 CN1C=CC(Br)=N1 SBB051488 [0,1,0,0,0,0|2,0,0]=3 164 B7R1.2 CN1C=CC(I)=N1 SBB093951 [0,1,0,0,0,0|2,0,0]=3 165 B7R1.2 CN1C=CC(N)=N1 SBB019460 [0,1,0,0,0,0|2,0,0]=3 166 B7R1.2 CN1C=NC(N)=N1 SBB073304 [0,1,0,0,0,0|3,0,0]=4 167 B7R1.2 ClC1=CSC(Cl)=N1 SBB086954 [0,1,0,0,0,0|2,1,0]=4 168 B7R1.2 IC1=CC=C(I)S1 SBB058942 [0,1,0,0,0,0|1,1,0]=3 169 B7R1.2 IC1=CNC(I)=N1 SBB054454 [0,1,0,0,0,0|3,0,0]=4 170 B7R1.2 N1C=C(C)N=C1C SBB004378 [0,1,0,0,0,0|2,0,0]=3 171 B7R1.2 N1C=C(C)N=C1S SBB059569 [0,1,0,0,0,0|2,0,0]=3 172 B7R1.2 N1N=C(C)CC1=O SBB004372 [0,1,0,0,0,0|2,0,1]=4 173 B7R1.2 NC1=CC(=O)NO1 SBB303237 [0,1,0,0,0,0|2,0,0]=3 174 B7R1.2 NC1=CC(N)=NN1 SBB073418 [0,1,0,0,0,0|3,0,0]=4 175 B7R1.2 NC1=CC=C(S)S1 SBB000065 [0,1,0,0,0,0|1,1,0]=3 176 B7R1.2 NC1=NC(C)=CS1 SBB004307 [0,1,0,0,0,0|2,0,0]=3 177 B7R1.2 NC1=NC=C(Br)S1 SBB000204 [0,1,0,0,0,0|2,1,0]=4 178 B7R1.2 NC1=NC=C(Br)S1 SBB051923 [0,1,0,0,0,0|2,1,0]=4 179 B7R1.2 NC1=NC=C(Cl)S1 SBB003849 [0,1,0,0,0,0|2,1,0]=4 180 B7R1.2 NC1=NNC(O)=C1 SBB005531 [0,1,0,0,0,0|3,0,0]=4 181 B7R1.2 O=C1C=C(O)CO1 SBB056227 [0,1,0,0,0,0|1,0,1]=3 182 B7R1.2 O=C1C=CC(=O)O1 SBB060268 [0,1,0,0,0,0|1,0,0]=2 183 B7R1.2 O=C1CCC(=O)O1 SBB040819 [0,1,0,0,0,0|1,0,2]=4 184 B7R1.2 O=C1COC(=O)C1 SBB008561 [0,1,0,0,0,0|1,0,2]=4 185 B7R1.2 SC1=NN=C(C)S1 SBB004217 [0,1,0,0,0,0|2,1,0]=4 186 B7R1.4 BrC1=C(Br)SC=C1 SBB059557 [0,1,0,0,0,0|1,1,0]=3 187 B7R1.4 CC1=C(Br)SC=C1 SBB089226 [0,1,0,0,0,0|1,1,0]=3 188 B7R1.4 CC1=CC=NN1C SBB020344 [0,1,0,0,0,0|2,0,0]=3 189 B7R1.4 CC1=NC=CN1C SBB040829 [0,1,0,0,0,0|2,0,0]=3 190 B7R1.4 CC1=NNC=C1Br SBB003957 [0,1,0,0,0,0|2,0,0]=3 191 B7R1.4 CC1=NNC=C1Cl SBB022182 [0,1,0,0,0,0|2,0,0]=3 192 B7R1.4 CC1=NNC=C1I SBB073954 [0,1,0,0,0,0|2,0,0]=3 193 B7R1.4 CC1=NNC=C1N SBB009508 [0,1,0,0,0,0|2,0,0]=3 194 B7R1.4 CC1=NON=C1N SBB002777 [0,1,0,0,0,0|3,0,0]=4 195 B7R1.4 CN1C=CN=C1Br SBB054456 [0,1,0,0,0,0|3,0,0]=4 196 B7R1.4 CN1C=CN=C1I SBB093949 [0,1,0,0,0,0|3,0,0]=4 197 B7R1.4 CN1C=CN=C1S SBB041060 [0,1,0,0,0,0|3,0,0]=4 198 B7R1.4 CN1C=NC=C1Cl SBB004296 [0,1,0,0,0,0|3,0,0]=4 199 B7R1.4 CN1N=CC=C1Br SBB116410 [0,1,0,0,0,0|2,0,0]=3 200 B7R1.4 CN1N=CC=C1I SBB093950 [0,1,0,0,0,0|2,0,0]=3 201 B7R1.4 CN1N=CC=C1N SBB023971 [0,1,0,0,0,0|2,0,0]=3 202 B7R1.4 ClC1=C(Br)C=CS1 SBB092197 [0,1,0,0,0,0|1,1,0]=3 203 B7R1.4 ClC1=C(Cl)NC=N1 SBB085955 [0,1,0,0,0,0|3,0,0]=4 204 B7R1.4 IC1=C(I)NC=N1 SBB054455 [0,1,0,0,0,0|3,0,0]=4 205 B7R1.4 IC1=C(I)SN=C1 SBB074234 [0,1,0,0,0,0|2,1,0]=4 206 B7R1.4 NC1=C(Br)C=NN1 SBB005499 [0,1,0,0,0,0|3,0,0]=4 207 B7R1.4 NC1=C(N)NN=C1 SBB025371 [0,1,0,0,0,0|3,0,0]=4 208 B5R0.1 CC(C)=CCBr SBB061690 [0,0,1,0,0,0|2,0,1]=4 209 B5R0.1 C\C(Cl)=C\CN SBB301293 [0,0,1,0,0,0|2,0,1]=4 210 B5R0.1 C\C(N)=C\C#N SBB002655 [0,0,1,0,0,0|2,0,1]=4 211 B7R1.3 BrC1=CC=CN=C1 SBB003998 [0,0,0,0,0,1|2,0,0]=3 212 B7R1.3 BrC1=CC=NC=C1 SBB003600 [0,0,0,0,0,1|2,0,0]=3 213 B7R1.3 BrC1=CN=CN=C1 SBB054477 [0,0,0,0,0,1|3,0,0]=4 214 B7R1.3 BrC1=NC=CC=C1 SBB003999 [0,0,0,0,0,1|2,0,0]=3 215 B7R1.3 BrC1=NC=CC=N1 SBB054484 [0,0,0,0,0,1|2,0,0]=3 216 B7R1.3 BrC1=NC=CN=C1 SBB087333 [0,0,0,0,0,1|2,0,0]=3 217 B7R1.3 BrC1=NC=NC=C1 SBB054515 [0,0,0,0,0,1|2,0,0]=3 218 B7R1.3 CC1=CN=CC=N1 SBB060830 [0,0,0,0,0,1|1,0,0]=2 219 B7R1.3 CC1CC=CCC1 SBB060473 [0,0,0,0,0,1|1,0,2]=4 220 B7R1.3 ClC1=CC=CC=C1 SBB040899 [0,0,0,0,0,1|2,0,0]=3 221 B7R1.3 ClC1=CC=CN=N1 SBB054542 [0,0,0,0,0,1|2,0,0]=3 222 B7R1.3 ClC1=NC=CC=C1 SBB079180 [0,0,0,0,0,1|2,0,0]=3 223 B7R1.3 ClC1=NC=CC=N1 SBB054479 [0,0,0,0,0,1|2,0,0]=3 224 B7R1.3 ClC1=NC=NC=C1 SBB054514 [0,0,0,0,0,1|2,0,0]=3 225 B7R1.3 FC1=CC=CN=C1 SBB054315 [0,0,0,0,0,1|2,0,0]=3 226 B7R1.3 FC1=CC=NC=C1 SBB054247 [0,0,0,0,0,1|2,0,0]=3 227 B7R1.3 FC1=NC=CC=C1 SBB062911 [0,0,0,0,0,1|2,0,0]=3 228 B7R1.3 IC1=CC=CN=C1 SBB054246 [0,0,0,0,0,1|2,0,0]=3 229 B7R1.3 IC1=CC=NC=C1 SBB009104 [0,0,0,0,0,1|2,0,0]=3 230 B7R1.3 IC1=NC=CC=C1 SBB054364 [0,0,0,0,0,1|2,0,0]=3 231 B7R1.3 IC1=NC=CN=C1 SBB093563 [0,0,0,0,0,1|2,0,0]=3 232 B7R1.3 NC1=CC=CC=N1 SBB004394 [0,0,0,0,0,1|2,0,0]=3 233 B7R1.3 NC1=CC=CN=N1 SBB051973 [0,0,0,0,0,1|2,0,0]=3 234 B7R1.3 NC1=CC=NC=C1 SBB004393 [0,0,0,0,0,1|2,0,0]=3 235 B7R1.3 NC1=CC=NC=N1 SBB028163 [0,0,0,0,0,1|2,0,0]=3 236 B7R1.3 NC1=CN=CC=C1 SBB004395 [0,0,0,0,0,1|2,0,0]=3 237 B7R1.3 NC1=CN=CC=N1 SBB004388 [0,0,0,0,0,1|2,0,0]=3 238 B7R1.3 NC1=CN=CN=C1 SBB051965 [0,0,0,0,0,1|3,0,0]=4 239 B7R1.3 NC1=NC=CC=N1 SBB004387 [0,0,0,0,0,1|2,0,0]=3 240 B7R1.3 NC1=NC=NC=N1 SBB005530 [0,0,0,0,0,1|3,0,0]=4 241 B7R1.3 NC1=NN=CC=N1 SBB004379 [0,0,0,0,0,1|3,0,0]=4 242 B7R1.3 O=C1C=CC=NN1 SBB005360 [0,0,0,0,0,1|2,0,0]=3 243 B7R1.3 O=C1C=CCCC1 SBB008209 [0,0,0,0,0,1|2,0,1]=4 244 B7R1.3 O=C1C=CNC=C1 SBB005800 [0,0,0,0,0,1|2,0,0]=3 245 B7R1.3 O=C1N=CC=CN1 SBB004216 [0,0,0,0,0,1|2,0,0]=3 246 B7R1.3 OC1=CC=CC=N1 SBB004392 [0,0,0,0,0,1|2,0,0]=3 247 B7R1.3 OC1=CC=NC=C1 SBB000030 [0,0,0,0,0,1|2,0,0]=3 248 B7R1.3 OC1=CN=CC=C1 SBB004391 [0,0,0,0,0,1|2,0,0]=3 249 B7R1.3 OC1=NC=CC=N1 SBB004380 [0,0,0,0,0,1|2,0,0]=3 250 B7R1.3 OC1=NC=NC=C1 SBB055919 [0,0,0,0,0,1|2,0,0]=3 251 B7R1.3 SC1=CC=CC=N1 SBB058593 [0,0,0,0,0,1|2,0,0]=3 252 B7R1.3 SC1=NC=CC=N1 SBB007595 [0,0,0,0,0,1|2,0,0]=3 253 B7R1.3 [NH+]1=CC=C(Cl)C=C1 SBB058933 [0,0,0,0,0,1|2,0,0]=3 254 B4R0.2 C\C=C\CC SBB059879 [1,0,1,0,0,0|0,0,2]=4 255 B6R0.1 C\C=C\C(=O)OC SBB061218 [0,1,1,0,0,0|0,0,2]=4 256 B6R0.2 C=C(C)OC(C)=O SBB056824 [0,1,1,0,0,0|0,0,1]=3 257 B6R0.2 CC(=O)C=C(C)C SBB040870 [0,1,1,0,0,0|0,0,2]=4 258 B6R0.2 CC(=O)\C=C(\C)N SBB007945 [0,1,1,0,0,0|0,0,2]=4 259 B6R0.2 CC(=O)\C=C(\C)[O-] SBB080715 [0,1,1,0,0,0|0,0,2]=4 260 B6R0.2 CC(C)=CC(=O)O SBB065769 [0,1,1,0,0,0|1,0,1]=4 261 B6R0.3 C=CC(=O)N(C)C SBB008330 [0,1,1,0,0,0|2,0,0]=4 262 B6R0.3 C\C=C(\C)C(=O)O SBB071598 [0,1,1,0,0,0|1,0,1]=4 263 B6R0.4 C=CCCC(=O)O SBB061214 [0,1,1,0,0,0|1,0,1]=4 264 B6R0.4 C=CCCC(C)=O SBB009089 [0,1,1,0,0,0|0,0,2]=4 265 B6R0.4 C=COCC(C)C SBB060157 [0,1,1,0,0,0|0,0,2]=4 266 B6R0.4 CC\C=C\C(=O)O SBB061994 [0,1,1,0,0,0|1,0,1]=4 267 B6R0.6 C=CCOCCO SBB060194 [0,1,1,0,0,0|0,0,2]=4 268 B6R0.6 CCC\C=C\C=O SBB067097 [0,1,1,0,0,0|0,0,2]=4 269 B6R0.6 CC\C=C/CCO SBB007739 [0,1,1,0,0,0|0,0,2]=4 270 B6R0.9 C=CC(CCl)OC SBB061093 [0,1,1,0,0,0|0,0,2]=4 271 B8R1.2 BrCC1=CC=NC=C1 SBB054924 [0,1,0,0,0,1|1,0,0]=3 272 B8R1.2 BrCC1=NC=CC=C1 SBB054926 [0,1,0,0,0,1|1,0,0]=3 273 B8R1.2 C#CC1=CC=CC=C1 SBB040919 [0,1,0,0,0,1|1,0,1]=4 274 B8R1.2 C#CC1=CC=CC=N1 SBB006619 [0,1,0,0,0,1|1,0,1]=4 275 B8R1.2 C#CC1=CC=CN=C1 SBB065464 [0,1,0,0,0,1|1,0,1]=4 276 B8R1.2 C#CC1=CC=NC=C1 SBB055516 [0,1,0,0,0,1|1,0,1]=4 277 B8R1.2 C#CC1=CC=NC=C1 SBB065466 [0,1,0,0,0,1|1,0,1]=4 278 B8R1.2 C=CC1=NC=CN=C1 SBB055880 [0,1,0,0,0,1|1,0,1]=4 279 B8R1.2 CCC1=CC=CC=C1 SBB040891 [0,1,0,0,0,1|1,0,0]=3 280 B8R1.2 CCC1=CC=CC=N1 SBB060373 [0,1,0,0,0,1|1,0,0]=3 281 B8R1.2 CCC1=CC=NC=C1 SBB061128 [0,1,0,0,0,1|1,0,0]=3 282 B8R1.2 CCC1=CN=CC=C1 SBB060374 [0,1,0,0,0,1|1,0,0]=3 283 B8R1.2 CNC1=CC=CC=C1 SBB008162 [0,1,0,0,0,1|1,0,0]=3 284 B8R1.2 CNC1=CC=CC=C1 SBB059778 [0,1,0,0,0,1|1,0,0]=3 285 B8R1.2 CNC1=NC=CN=C1 SBB018751 [0,1,0,0,0,1|1,0,0]=3 286 B8R1.2 CSC1=NN=CC=N1 SBB085690 [0,1,0,0,0,1|2,0,0]=4 287 B8R1.2 ClCC1=CC=NC=C1 SBB003917 [0,1,0,0,0,1|1,0,0]=3 288 B8R1.2 ClCC1=NC=CC=C1 SBB054925 [0,1,0,0,0,1|1,0,0]=3 289 B8R1.2 N#CC1=CC=CC=C1 SBB028746 [0,1,0,0,0,1|1,0,1]=4 290 B8R1.2 N#CC1=CC=CN=C1 SBB007554 [0,1,0,0,0,1|1,0,1]=4 291 B8R1.2 N#CC1=CC=NC=C1 SBB008923 [0,1,0,0,0,1|1,0,1]=4 292 B8R1.2 N#CC1=NC=CC=C1 SBB008920 [0,1,0,0,0,1|1,0,1]=4 293 B8R1.2 N#CC1=NC=CC=N1 SBB048115 [0,1,0,0,0,1|1,0,1]=4 294 B8R1.2 N#CC1=NC=CN=C1 SBB055876 [0,1,0,0,0,1|1,0,1]=4 295 B8R1.2 NCC1=CC=CC=C1 SBB040473 [0,1,0,0,0,1|1,0,0]=3 296 B8R1.2 NCC1=CC=CN=C1 SBB004351 [0,1,0,0,0,1|1,0,0]=3 297 B8R1.2 NCC1=CC=NC=C1 SBB004350 [0,1,0,0,0,1|1,0,0]=3 298 B8R1.2 NCC1=NC=CC=C1 SBB004352 [0,1,0,0,0,1|1,0,0]=3 299 B8R1.2 NCC1=NC=CN=C1 SBB014584 [0,1,0,0,0,1|1,0,0]=3 300 B8R1.2 NCC1=NC=NC=C1 SBB086444 [0,1,0,0,0,1|1,0,0]=3 301 B8R1.2 NNC1=CC=CC=C1 SBB040886 [0,1,0,0,0,1|2,0,0]=4 302 B8R1.2 NNC1=CC=CN=N1 SBB055934 [0,1,0,0,0,1|2,0,0]=4 303 B8R1.2 NNC1=CC=NC=C1 SBB018987 [0,1,0,0,0,1|2,0,0]=4 304 B8R1.2 NNC1=NC=CC=N1 SBB047725 [0,1,0,0,0,1|2,0,0]=4 305 B8R1.2 O=CC1=CC=CN=C1 SBB004359 [0,1,0,0,0,1|1,0,1]=4 306 B8R1.2 O=CC1=CC=NC=C1 SBB004357 [0,1,0,0,0,1|1,0,1]=4 307 B8R1.2 O=CC1=NC=CC=C1 SBB004358 [0,1,0,0,0,1|1,0,1]=4 308 B8R1.2 O=CC1=NC=CC=N1 SBB052320 [0,1,0,0,0,1|1,0,1]=4 309 B8R1.2 O=CC1=NC=CN=C1 SBB052318 [0,1,0,0,0,1|1,0,1]=4 310 B8R1.2 OCC1=CC=CC=C1 SBB058558 [0,1,0,0,0,1|1,0,0]=3 311 B8R1.2 OCC1=CC=CN=C1 SBB004344 [0,1,0,0,0,1|1,0,0]=3 312 B8R1.2 OCC1=CC=CN=N1 SBB054829 [0,1,0,0,0,1|1,0,0]=3 313 B8R1.2 OCC1=CC=NC=C1 SBB004347 [0,1,0,0,0,1|1,0,0]=3 314 B8R1.2 OCC1=CN=CN=C1 SBB065691 [0,1,0,0,0,1|2,0,0]=4 315 B8R1.2 OCC1=NC=CC=C1 SBB004348 [0,1,0,0,0,1|1,0,0]=3 316 B8R1.2 OCC1=NC=CN=C1 SBB054824 [0,1,0,0,0,1|1,0,0]=3 317 B8R1.2 OCC1=NC=NC=C1 SBB054828 [0,1,0,0,0,1|1,0,0]=3 318 B8R1.2 ONC1=CC=CC=C1 SBB008413 [0,1,0,0,0,1|2,0,0]=4 319 B8R1.2 [NH+]1=CC=CC(CCl)=C1 SBB061738 [0,1,0,0,0,1|1,0,0]=3 320 B8R1.2 [NH3+]NC1=CC=CC=C1 SBB060000 [0,1,0,0,0,1|2,0,0]=4 321 B8R1.3 BrC1=CC=C(Br)N=N1 SBB054546 [0,1,0,0,0,1|2,0,0]=4 322 B8R1.3 BrC1=CC=C(I)C=N1 SBB013974 [0,1,0,0,0,1|2,0,0]=4 323 B8R1.3 BrC1=CN=C(Br)C=C1 SBB054335 [0,1,0,0,0,1|2,0,0]=4 324 B8R1.3 BrC1=CN=C(Br)C=N1 SBB054474 [0,1,0,0,0,1|2,0,0]=4 325 B8R1.3 BrC1=CN=C(I)C=C1 SBB054355 [0,1,0,0,0,1|2,0,0]=4 326 B8R1.3 BrC1=CN=C(I)C=N1 SBB054462 [0,1,0,0,0,1|2,0,0]=4 327 B8R1.3 BrC1=CN=C(I)N=C1 SBB054488 [0,1,0,0,0,1|2,0,0]=4 328 B8R1.3 CC1=CC=C(Br)C=C1 SBB040884 [0,1,0,0,0,1|1,0,0]=3 329 B8R1.3 CC1=CC=C(Br)C=N1 SBB088566 [0,1,0,0,0,1|1,0,0]=3 330 B8R1.3 CC1=CC=C(C)N=C1 SBB060370 [0,1,0,0,0,1|1,0,0]=3 331 B8R1.3 CC1=CC=C(Cl)C=C1 SBB040887 [0,1,0,0,0,1|1,0,0]=3 332 B8R1.3 CC1=CC=C(N)C=C1 SBB040498 [0,1,0,0,0,1|1,0,0]=3 333 B8R1.3 CC1=CC=C(N)C=C1 SBB073002 [0,1,0,0,0,1|1,0,0]=3 334 B8R1.3 CC1=CC=C(N)C=N1 SBB051894 [0,1,0,0,0,1|1,0,0]=3 335 B8R1.3 CC1=CC=C(N)N=N1 SBB051974 [0,1,0,0,0,1|1,0,0]=3 336 B8R1.3 CC1=CC=C(O)C=C1 SBB040878 [0,1,0,0,0,1|1,0,0]=3 337 B8R1.3 CC1=CC=C(O)N=N1 SBB051111 [0,1,0,0,0,1|1,0,0]=3 338 B8R1.3 CC1=CN=C(Br)C=C1 SBB054301 [0,1,0,0,0,1|1,0,0]=3 339 B8R1.3 CC1=CN=C(Br)C=N1 SBB054471 [0,1,0,0,0,1|1,0,0]=3 340 B8R1.3 CC1=CN=C(C)C=N1 SBB058647 [0,1,0,0,0,1|1,0,0]=3 341 B8R1.3 CC1=CN=C(Cl)C=C1 SBB085698 [0,1,0,0,0,1|1,0,0]=3 342 B8R1.3 CC1=CN=C(N)C=C1 SBB004353 [0,1,0,0,0,1|1,0,0]=3 343 B8R1.3 CC1=CN=C(N)C=N1 SBB069755 [0,1,0,0,0,1|1,0,0]=3 344 B8R1.3 CC1=CN=C(O)C=C1 SBB055600 [0,1,0,0,0,1|1,0,0]=3 345 B8R1.3 CC1=CN=C(O)N=C1 SBB026947 [0,1,0,0,0,1|2,0,0]=4 346 B8R1.3 CC1=CN=C(S)C=C1 SBB068990 [0,1,0,0,0,1|1,0,0]=3 347 B8R1.3 CC1=CN=C(S)N=C1 SBB021424 [0,1,0,0,0,1|2,0,0]=4 348 B8R1.3 CC1=CNC(=O)C=C1 SBB040121 [0,1,0,0,0,1|1,0,0]=3 349 B8R1.3 CC1=NC=C(O)C=C1 SBB004349 [0,1,0,0,0,1|1,0,0]=3 350 B8R1.3 CC1=NN=C(Cl)C=C1 SBB039123 [0,1,0,0,0,1|1,0,0]=3 351 B8R1.3 ClC1=CC=C(Br)C=C1 SBB060209 [0,1,0,0,0,1|2,0,0]=4 352 B8R1.3 ClC1=CC=C(Br)C=N1 SBB013973 [0,1,0,0,0,1|2,0,0]=4 353 B8R1.3 ClC1=CC=C(I)C=N1 SBB013975 [0,1,0,0,0,1|2,0,0]=4 354 B8R1.3 ClC1=CC=C(I)N=N1 SBB054548 [0,1,0,0,0,1|2,0,0]=4 355 B8R1.3 ClC1=CN=C(Br)C=C1 SBB054397 [0,1,0,0,0,1|2,0,0]=4 356 B8R1.3 ClC1=CN=C(Cl)C=C1 SBB054354 [0,1,0,0,0,1|2,0,0]=4 357 B8R1.3 ClC1=CN=C(Cl)N=C1 SBB086615 [0,1,0,0,0,1|2,0,0]=4 358 B8R1.3 ClC1=CN=C(I)C=C1 SBB054334 [0,1,0,0,0,1|2,0,0]=4 359 B8R1.3 ClC1=NC=C(Br)C=N1 SBB048149 [0,1,0,0,0,1|2,0,0]=4 360 B8R1.3 ClC1=NC=C(Br)N=C1 SBB091627 [0,1,0,0,0,1|2,0,0]=4 361 B8R1.3 ClC1=NC=C(I)C=N1 SBB099308 [0,1,0,0,0,1|2,0,0]=4 362 B8R1.3 ClC1=NN=C(Cl)C=C1 SBB058457 [0,1,0,0,0,1|2,0,0]=4 363 B8R1.3 FC1=CC=C(Br)C=C1 SBB088991 [0,1,0,0,0,1|2,0,0]=4 364 B8R1.3 FC1=CC=C(Br)N=C1 SBB089107 [0,1,0,0,0,1|2,0,0]=4 365 B8R1.3 FC1=CC=C(Cl)C=C1 SBB085775 [0,1,0,0,0,1|2,0,0]=4 366 B8R1.3 FC1=CC=C(I)C=C1 SBB096227 [0,1,0,0,0,1|2,0,0]=4 367 B8R1.3 FC1=CC=C(I)C=N1 SBB013899 [0,1,0,0,0,1|2,0,0]=4 368 B8R1.3 FC1=CN=C(Cl)C=C1 SBB085793 [0,1,0,0,0,1|2,0,0]=4 369 B8R1.3 FC1=CN=C(Cl)N=C1 SBB085824 [0,1,0,0,0,1|2,0,0]=4 370 B8R1.3 FC1=NC=C(Br)C=C1 SBB089108 [0,1,0,0,0,1|2,0,0]=4 371 B8R1.3 FC1=NC=C(Br)C=N1 SBB089223 [0,1,0,0,0,1|2,0,0]=4 372 B8R1.3 FC1=NC=C(Cl)C=C1 SBB085795 [0,1,0,0,0,1|2,0,0]=4 373 B8R1.3 IC1=CC=C(I)N=N1 SBB054544 [0,1,0,0,0,1|2,0,0]=4 374 B8R1.3 NC1=CC=C(Br)C=C1 SBB040491 [0,1,0,0,0,1|2,0,0]=4 375 B8R1.3 NC1=CC=C(Br)N=C1 SBB005540 [0,1,0,0,0,1|2,0,0]=4 376 B8R1.3 NC1=CC=C(Cl)C=C1 SBB040490 [0,1,0,0,0,1|2,0,0]=4 377 B8R1.3 NC1=CC=C(Cl)N=C1 SBB004234 [0,1,0,0,0,1|2,0,0]=4 378 B8R1.3 NC1=CC=C(F)C=C1 SBB040453 [0,1,0,0,0,1|2,0,0]=4 379 B8R1.3 NC1=CC=C(F)N=C1 SBB051873 [0,1,0,0,0,1|2,0,0]=4 380 B8R1.3 NC1=CC=C(I)C=N1 SBB028436 [0,1,0,0,0,1|2,0,0]=4 381 B8R1.3 NC1=CC=C(I)N=N1 SBB051975 [0,1,0,0,0,1|2,0,0]=4 382 B8R1.3 NC1=CC=C(O)C=C1 SBB059792 [0,1,0,0,0,1|2,0,0]=4 383 B8R1.3 NC1=CC=C(O)N=C1 SBB028187 [0,1,0,0,0,1|2,0,0]=4 384 B8R1.3 NC1=CC=C(S)C=C1 SBB059850 [0,1,0,0,0,1|2,0,0]=4 385 B8R1.3 NC1=CN=C(Br)C=N1 SBB028377 [0,1,0,0,0,1|2,0,0]=4 386 B8R1.3 NC1=CN=C(Cl)N=C1 SBB051953 [0,1,0,0,0,1|2,0,0]=4 387 B8R1.3 NC1=CN=C(I)C=C1 SBB070540 [0,1,0,0,0,1|2,0,0]=4 388 B8R1.3 NC1=CN=C(N)C=C1 SBB004342 [0,1,0,0,0,1|2,0,0]=4 389 B8R1.3 NC1=NC=C(Br)C=C1 SBB003823 [0,1,0,0,0,1|2,0,0]=4 390 B8R1.3 NC1=NC=C(Br)C=N1 SBB000184 [0,1,0,0,0,1|2,0,0]=4 391 B8R1.3 NC1=NC=C(Cl)C=C1 SBB000059 [0,1,0,0,0,1|2,0,0]=4 392 B8R1.3 NC1=NC=C(Cl)C=N1 SBB005486 [0,1,0,0,0,1|2,0,0]=4 393 B8R1.3 NC1=NC=C(F)C=C1 SBB013948 [0,1,0,0,0,1|2,0,0]=4 394 B8R1.3 NC1=NC=C(I)C=N1 SBB028441 [0,1,0,0,0,1|2,0,0]=4 395 B8R1.3 NC1=NN=C(Cl)C=C1 SBB005487 [0,1,0,0,0,1|2,0,0]=4 396 B8R1.3 O=C1C=CC(=O)C=C1 SBB058657 [0,1,0,0,0,1|2,0,0]=4 397 B8R1.3 O=C1C=CC(Br)=CN1 SBB003806 [0,1,0,0,0,1|2,0,0]=4 398 B8R1.3 O=C1C=CC(Cl)=CN1 SBB004227 [0,1,0,0,0,1|2,0,0]=4 399 B8R1.3 OC1=CC=C(Br)C=C1 SBB040917 [0,1,0,0,0,1|2,0,0]=4 400 B8R1.3 OC1=CC=C(Cl)C=C1 SBB040864 [0,1,0,0,0,1|2,0,0]=4 401 B8R1.3 OC1=CC=C(F)C=C1 SBB040810 [0,1,0,0,0,1|2,0,0]=4 402 B8R1.3 OC1=CC=C(O)C=C1 SBB060421 [0,1,0,0,0,1|2,0,0]=4 403 B8R1.3 OC1=CN=C(Cl)C=C1 SBB054276 [0,1,0,0,0,1|2,0,0]=4 404 B8R1.3 OC1=NC=C(Br)C=C1 SBB054347 [0,1,0,0,0,1|2,0,0]=4 405 B8R1.3 OC1=NC=C(Br)C=N1 SBB059601 [0,1,0,0,0,1|2,0,0]=4 406 B8R1.3 OC1=NC=C(Br)N=C1 SBB062713 [0,1,0,0,0,1|2,0,0]=4 407 B8R1.3 OC1=NC=C(Cl)C=C1 SBB054352 [0,1,0,0,0,1|2,0,0]=4 408 B8R1.3 OC1=NC=C(I)C=C1 SBB054372 [0,1,0,0,0,1|2,0,0]=4 409 B8R1.3 OC1=NN=C(O)C=C1 SBB004322 [0,1,0,0,0,1|2,0,0]=4 410 B8R1.3 SC1=CC=C(Br)C=C1 SBB055148 [0,1,0,0,0,1|2,0,0]=4 411 B8R1.4 BrC1=CC(I)=CC=N1 SBB013971 [0,1,0,0,0,1|2,0,0]=4 412 B8R1.4 BrC1=CC=CC(Br)=N1 SBB059469 [0,1,0,0,0,1|2,0,0]=4 413 B8R1.4 BrC1=CC=NC(Br)=C1 SBB013976 [0,1,0,0,0,1|2,0,0]=4 414 B8R1.4 BrC1=CC=NC(Br)=N1 SBB054494 [0,1,0,0,0,1|2,0,0]=4 415 B8R1.4 BrC1=CN=CC(Br)=C1 SBB003237 [0,1,0,0,0,1|2,0,0]=4 416 B8R1.4 BrC1=CN=CC(Br)=C1 SBB003238 [0,1,0,0,0,1|2,0,0]=4 417 B8R1.4 BrC1=NC(I)=CC=C1 SBB054359 [0,1,0,0,0,1|2,0,0]=4 418 B8R1.4 CC1=CC(=O)CCC1 SBB007736 [0,1,0,0,0,1|1,0,1]=4 419 B8R1.4 CC1=CC(=O)NC=C1 SBB004346 [0,1,0,0,0,1|1,0,0]=3 420 B8R1.4 CC1=CC(=O)NN=C1 SBB055936 [0,1,0,0,0,1|2,0,0]=4 421 B8R1.4 CC1=CC(Br)=NC=C1 SBB054348 [0,1,0,0,0,1|1,0,0]=3 422 B8R1.4 CC1=CC(C)=NC=N1 SBB059547 [0,1,0,0,0,1|1,0,0]=3 423 B8R1.4 CC1=CC(Cl)=NC=C1 SBB054263 [0,1,0,0,0,1|1,0,0]=3 424 B8R1.4 CC1=CC(F)=NC=C1 SBB054405 [0,1,0,0,0,1|1,0,0]=3 425 B8R1.4 CC1=CC(N)=CC=C1 SBB040444 [0,1,0,0,0,1|1,0,0]=3 426 B8R1.4 CC1=CC(N)=NC=C1 SBB004354 [0,1,0,0,0,1|1,0,0]=3 427 B8R1.4 CC1=CC(O)=CC=C1 SBB060101 [0,1,0,0,0,1|1,0,0]=3 428 B8R1.4 CC1=CC(O)=NC=N1 SBB081936 [0,1,0,0,0,1|1,0,0]=3 429 B8R1.4 CC1=CC=CC(=O)N1 SBB004345 [0,1,0,0,0,1|1,0,0]=3 430 B8R1.4 CC1=CC=CC(Br)=C1 SBB060207 [0,1,0,0,0,1|1,0,0]=3 431 B8R1.4 CC1=CC=CC(Br)=N1 SBB054376 [0,1,0,0,0,1|1,0,0]=3 432 B8R1.4 CC1=CC=CC(C)=N1 SBB060371 [0,1,0,0,0,1|1,0,0]=3 433 B8R1.4 CC1=CC=CC(Cl)=N1 SBB048080 [0,1,0,0,0,1|1,0,0]=3 434 B8R1.4 CC1=CC=CC(F)=C1 SBB061650 [0,1,0,0,0,1|1,0,0]=3 435 B8R1.4 CC1=CC=CC(I)=N1 SBB054318 [0,1,0,0,0,1|1,0,0]=3 436 B8R1.4 CC1=CC=CC(N)=N1 SBB004355 [0,1,0,0,0,1|1,0,0]=3 437 B8R1.4 CC1=CC=NC(=O)N1 SBB004102 [0,1,0,0,0,1|1,0,0]=3 438 B8R1.4 CC1=CC=NC(=S)N1 SBB003935 [0,1,0,0,0,1|1,0,0]=3 439 B8R1.4 CC1=CC=NC(C)=C1 SBB060369 [0,1,0,0,0,1|1,0,0]=3 440 B8R1.4 CC1=CC=NC(N)=N1 SBB004343 [0,1,0,0,0,1|1,0,0]=3 441 B8R1.4 CC1=CN=CC(Br)=C1 SBB054290 [0,1,0,0,0,1|1,0,0]=3 442 B8R1.4 CC1=CN=CC(Br)=N1 SBB054472 [0,1,0,0,0,1|1,0,0]=3 443 B8R1.4 CC1=CN=CC(C)=C1 SBB060372 [0,1,0,0,0,1|1,0,0]=3 444 B8R1.4 CC1=CN=CC(Cl)=N1 SBB054461 [0,1,0,0,0,1|1,0,0]=3 445 B8R1.4 CC1=CN=CC(N)=C1 SBB051822 [0,1,0,0,0,1|1,0,0]=3 446 B8R1.4 CC1=CN=CC(N)=N1 SBB051946 [0,1,0,0,0,1|1,0,0]=3 447 B8R1.4 CC1=CN=CC(O)=C1 SBB055598 [0,1,0,0,0,1|1,0,0]=3 448 B8R1.4 CC1=CN=NC(Cl)=C1 SBB054545 [0,1,0,0,0,1|2,0,0]=4 449 B8R1.4 CC1=NC(=S)NC=C1 SBB003934 [0,1,0,0,0,1|1,0,0]=3 450 B8R1.4 CC1=NC(Cl)=NC=C1 SBB054509 [0,1,0,0,0,1|1,0,0]=3 451 B8R1.4 CC1=NC(S)=NC=C1 SBB055918 [0,1,0,0,0,1|1,0,0]=3 452 B8R1.4 CC1=NC=CC(Br)=C1 SBB088565 [0,1,0,0,0,1|1,0,0]=3 453 B8R1.4 CC1=NC=CC(Cl)=N1 SBB085538 [0,1,0,0,0,1|1,0,0]=3 454 B8R1.4 CC1=NC=CC(N)=C1 SBB027134 [0,1,0,0,0,1|1,0,0]=3 455 B8R1.4 CC1=NC=NC(Cl)=C1 SBB039515 [0,1,0,0,0,1|1,0,0]=3 456 B8R1.4 ClC1=CC(Br)=NC=C1 SBB054398 [0,1,0,0,0,1|2,0,0]=4 457 B8R1.4 ClC1=CC(Cl)=NC=N1 SBB054475 [0,1,0,0,0,1|2,0,0]=4 458 B8R1.4 ClC1=CC=CC(Cl)=N1 SBB040849 [0,1,0,0,0,1|2,0,0]=4 459 B8R1.4 ClC1=CC=CC(I)=C1 SBB098968 [0,1,0,0,0,1|2,0,0]=4 460 B8R1.4 ClC1=CC=NC(Cl)=C1 SBB013978 [0,1,0,0,0,1|2,0,0]=4 461 B8R1.4 ClC1=CN=CC(Cl)=N1 SBB054463 [0,1,0,0,0,1|2,0,0]=4 462 B8R1.4 ClC1=NC(Cl)=NC=C1 SBB048117 [0,1,0,0,0,1|2,0,0]=4 463 B8R1.4 ClC1=NC=CC(Br)=C1 SBB054396 [0,1,0,0,0,1|2,0,0]=4 464 B8R1.4 ClC1=NC=CC(I)=C1 SBB054361 [0,1,0,0,0,1|2,0,0]=4 465 B8R1.4 FC1=CC(Br)=CC=C1 SBB088990 [0,1,0,0,0,1|2,0,0]=4 466 B8R1.4 FC1=CC(Br)=CN=C1 SBB054265 [0,1,0,0,0,1|2,0,0]=4 467 B8R1.4 FC1=CC(Br)=NC=C1 SBB089109 [0,1,0,0,0,1|2,0,0]=4 468 B8R1.4 FC1=CC(Cl)=NC=N1 SBB085823 [0,1,0,0,0,1|2,0,0]=4 469 B8R1.4 FC1=CC(I)=CC=C1 SBB096228 [0,1,0,0,0,1|2,0,0]=4 470 B8R1.4 FC1=CC=CC(Br)=N1 SBB089103 [0,1,0,0,0,1|2,0,0]=4 471 B8R1.4 FC1=CC=CC(Cl)=C1 SBB085773 [0,1,0,0,0,1|2,0,0]=4 472 B8R1.4 FC1=CC=NC(Cl)=C1 SBB013977 [0,1,0,0,0,1|2,0,0]=4 473 B8R1.4 FC1=CN=CC(Cl)=C1 SBB085794 [0,1,0,0,0,1|2,0,0]=4 474 B8R1.4 FC1=CN=CC(F)=C1 SBB054377 [0,1,0,0,0,1|2,0,0]=4 475 B8R1.4 FC1=NC=CC(Br)=C1 SBB089106 [0,1,0,0,0,1|2,0,0]=4 476 B8R1.4 FC1=NC=CC(Cl)=C1 SBB054331 [0,1,0,0,0,1|2,0,0]=4 477 B8R1.4 FC1=NC=CC(I)=C1 SBB054283 [0,1,0,0,0,1|2,0,0]=4 478 B8R1.4 NC1=CC(Br)=CC=C1 SBB040484 [0,1,0,0,0,1|2,0,0]=4 479 B8R1.4 NC1=CC(Br)=CN=C1 SBB044004 [0,1,0,0,0,1|2,0,0]=4 480 B8R1.4 NC1=CC(Br)=NC=C1 SBB028374 [0,1,0,0,0,1|2,0,0]=4 481 B8R1.4 NC1=CC(Cl)=CN=C1 SBB069846 [0,1,0,0,0,1|2,0,0]=4 482 B8R1.4 NC1=CC(Cl)=NC=C1 SBB004235 [0,1,0,0,0,1|2,0,0]=4 483 B8R1.4 NC1=CC(Cl)=NC=N1 SBB017910 [0,1,0,0,0,1|2,0,0]=4 484 B8R1.4 NC1=CC(N)=NC=C1 SBB069750 [0,1,0,0,0,1|2,0,0]=4 485 B8R1.4 NC1=CC(N)=NC=N1 SBB004336 [0,1,0,0,0,1|2,0,0]=4 486 B8R1.4 NC1=CC(O)=CC=C1 SBB059791 [0,1,0,0,0,1|2,0,0]=4 487 B8R1.4 NC1=CC=CC(Br)=N1 SBB028373 [0,1,0,0,0,1|2,0,0]=4 488 B8R1.4 NC1=CC=CC(Cl)=C1 SBB040450 [0,1,0,0,0,1|2,0,0]=4 489 B8R1.4 NC1=CC=CC(F)=C1 SBB059856 [0,1,0,0,0,1|2,0,0]=4 490 B8R1.4 NC1=CC=CC(N)=N1 SBB004340 [0,1,0,0,0,1|2,0,0]=4 491 B8R1.4 NC1=NC(=O)NC=C1 SBB071711 [0,1,0,0,0,1|2,0,0]=4 492 B8R1.4 NC1=NC(Cl)=CC=C1 SBB028231 [0,1,0,0,0,1|2,0,0]=4 493 B8R1.4 NC1=NC(Cl)=CC=N1 SBB042043 [0,1,0,0,0,1|2,0,0]=4 494 B8R1.4 NC1=NC(Cl)=CN=C1 SBB005488 [0,1,0,0,0,1|2,0,0]=4 495 B8R1.4 NC1=NC(Cl)=NC=C1 SBB085748 [0,1,0,0,0,1|2,0,0]=4 496 B8R1.4 NC1=NC(F)=CC=C1 SBB069764 [0,1,0,0,0,1|2,0,0]=4 497 B8R1.4 NC1=NC=CC(Br)=C1 SBB016050 [0,1,0,0,0,1|2,0,0]=4 498 B8R1.4 NC1=NC=CC(Br)=N1 SBB088837 [0,1,0,0,0,1|2,0,0]=4 499 B8R1.4 NC1=NC=CC(Cl)=C1 SBB051892 [0,1,0,0,0,1|2,0,0]=4 500 B8R1.4 NC1=NC=CC(F)=C1 SBB051908 [0,1,0,0,0,1|2,0,0]=4 501 B8R1.4 NC1=NC=NC(O)=C1 SBB028189 [0,1,0,0,0,1|2,0,0]=4 502 B8R1.4 O=C1C=C(I)C=CN1 SBB054248 [0,1,0,0,0,1|2,0,0]=4 503 B8R1.4 O=C1C=CC=C(Cl)N1 SBB004228 [0,1,0,0,0,1|2,0,0]=4 504 B8R1.4 O=C1C=CC=C(O)N1 SBB004090 [0,1,0,0,0,1|2,0,0]=4 505 B8R1.4 O=C1C=CNC(=O)N1 SBB058492 [0,1,0,0,0,1|2,0,0]=4 506 B8R1.4 OC1=CC(Cl)=CN=C1 SBB054268 [0,1,0,0,0,1|2,0,0]=4 507 B8R1.4 OC1=CC(O)=NC=N1 SBB080740 [0,1,0,0,0,1|2,0,0]=4 508 B8R1.4 OC1=CC=CC(Cl)=C1 SBB061136 [0,1,0,0,0,1|2,0,0]=4 509 B8R1.4 OC1=CC=CC(O)=C1 SBB040843 [0,1,0,0,0,1|2,0,0]=4 510 B8R1.4 OC1=CC=NC(Cl)=C1 SBB085746 [0,1,0,0,0,1|2,0,0]=4 511 B8R1.4 OC1=CC=NC(O)=C1 SBB004331 [0,1,0,0,0,1|2,0,0]=4 512 B8R1.4 OC1=CN=CC(Br)=C1 SBB081337 [0,1,0,0,0,1|2,0,0]=4 513 B8R1.4 OC1=CN=CC(F)=C1 SBB062707 [0,1,0,0,0,1|2,0,0]=4 514 B8R1.4 OC1=NC(C)=CC=N1 SBB004337 [0,1,0,0,0,1|1,0,0]=3 515 B8R1.4 OC1=NC(S)=NC=C1 SBB007592 [0,1,0,0,0,1|2,0,0]=4 516 B8R1.4 OC1=NC=CC(Br)=C1 SBB054250 [0,1,0,0,0,1|2,0,0]=4 517 B8R1.4 SC1=CC=CC(Br)=C1 SBB066529 [0,1,0,0,0,1|2,0,0]=4 518 B8R1.4 SC1=NC=CC(N)=N1 SBB005532 [0,1,0,0,0,1|2,0,0]=4 519 B8R1.4 [NH3+]C1=CC=CC([NH3+])=C1 SBB061252 [0,1,0,0,0,1|2,0,0]=4 520 B8R1.4 [O-][N+]1=CC=CC(Br)=C1 SBB088833 [0,1,0,0,0,1|2,0,0]=4 521 B8R1.5 BrC1=CC=CN=C1Br SBB003239 [0,1,0,0,0,1|2,0,0]=4 522 B8R1.5 BrC1=CC=CN=C1I SBB054393 [0,1,0,0,0,1|2,0,0]=4 523 B8R1.5 CC1=C(C)C=CC=C1 SBB040816 [0,1,0,0,0,1|1,0,0]=3 524 B8R1.5 CC1=C(C)C=NC=C1 SBB040907 [0,1,0,0,0,1|1,0,0]=3 525 B8R1.5 CC1=C(C)N=CC=C1 SBB060735 [0,1,0,0,0,1|1,0,0]=3 526 B8R1.5 CC1=C(Cl)N=NC=C1 SBB054543 [0,1,0,0,0,1|2,0,0]=4 527 B8R1.5 CC1=C(N)C=CC=C1 SBB028141 [0,1,0,0,0,1|1,0,0]=3 528 B8R1.5 CC1=C(N)C=CN=C1 SBB027197 [0,1,0,0,0,1|1,0,0]=3 529 B8R1.5 CC1=C(N)C=NC=C1 SBB028185 [0,1,0,0,0,1|1,0,0]=3 530 B8R1.5 CC1=CC=CC=C1N SBB058642 [0,1,0,0,0,1|1,0,0]=3 531 B8R1.5 CC1=CC=CC=C1O SBB060100 [0,1,0,0,0,1|1,0,0]=3 532 B8R1.5 CC1=CC=CN=C1Br SBB054403 [0,1,0,0,0,1|1,0,0]=3 533 B8R1.5 CC1=CC=CN=C1I SBB054379 [0,1,0,0,0,1|1,0,0]=3 534 B8R1.5 CC1=CC=CN=C1N SBB004356 [0,1,0,0,0,1|1,0,0]=3 535 B8R1.5 CC1=CC=CNC1=O SBB040120 [0,1,0,0,0,1|1,0,0]=3 536 B8R1.5 CC1=CC=NC=C1Br SBB054294 [0,1,0,0,0,1|1,0,0]=3 537 B8R1.5 CC1=CC=NC=C1O SBB055538 [0,1,0,0,0,1|1,0,0]=3 538 B8R1.5 CC1=NC=CC=C1Br SBB054275 [0,1,0,0,0,1|1,0,0]=3 539 B8R1.5 CC1=NC=CC=C1Cl SBB054401 [0,1,0,0,0,1|1,0,0]=3 540 B8R1.5 CC1=NC=CC=C1N SBB069748 [0,1,0,0,0,1|1,0,0]=3 541 B8R1.5 CN1C=CC=CC1=S SBB085613 [0,1,0,0,0,1|2,0,0]=4 542 B8R1.5 C[N+]1=CC=CC=C1Br SBB088730 [0,1,0,0,0,1|2,0,0]=4 543 B8R1.5 ClC1=C(Cl)N=CC=C1 SBB086564 [0,1,0,0,0,1|2,0,0]=4 544 B8R1.5 ClC1=C(I)C=CC=N1 SBB013979 [0,1,0,0,0,1|2,0,0]=4 545 B8R1.5 ClC1=CC=CC=C1Cl SBB040881 [0,1,0,0,0,1|2,0,0]=4 546 B8R1.5 ClC1=CC=CN=C1Br SBB054378 [0,1,0,0,0,1|2,0,0]=4 547 B8R1.5 ClC1=CC=CN=C1I SBB051904 [0,1,0,0,0,1|2,0,0]=4 548 B8R1.5 ClC1=CC=NC=C1Br SBB054249 [0,1,0,0,0,1|2,0,0]=4 549 B8R1.5 ClC1=CC=NC=C1Cl SBB054368 [0,1,0,0,0,1|2,0,0]=4 550 B8R1.5 ClC1=CN=CC=C1Br SBB054284 [0,1,0,0,0,1|2,0,0]=4 551 B8R1.5 ClC1=CN=CC=C1I SBB054367 [0,1,0,0,0,1|2,0,0]=4 552 B8R1.5 ClC1=NC=CC=C1Br SBB003618 [0,1,0,0,0,1|2,0,0]=4 553 B8R1.5 ClC1=NC=CN=C1Cl SBB080632 [0,1,0,0,0,1|2,0,0]=4 554 B8R1.5 FC1=C(Br)C=CC=C1 SBB088989 [0,1,0,0,0,1|2,0,0]=4 555 B8R1.5 FC1=C(Cl)C=CC=C1 SBB085774 [0,1,0,0,0,1|2,0,0]=4 556 B8R1.5 FC1=C(Cl)C=CN=C1 SBB088125 [0,1,0,0,0,1|2,0,0]=4 557 B8R1.5 FC1=C(I)C=CC=C1 SBB096229 [0,1,0,0,0,1|2,0,0]=4 558 B8R1.5 FC1=C(I)C=CN=C1 SBB096406 [0,1,0,0,0,1|2,0,0]=4 559 B8R1.5 FC1=CC=CN=C1Br SBB089105 [0,1,0,0,0,1|2,0,0]=4 560 B8R1.5 FC1=CC=CN=C1Cl SBB085791 [0,1,0,0,0,1|2,0,0]=4 561 B8R1.5 FC1=CN=CN=C1Cl SBB085825 [0,1,0,0,0,1|2,0,0]=4 562 B8R1.5 FC1=NC=CC=C1Br SBB054288 [0,1,0,0,0,1|2,0,0]=4 563 B8R1.5 FC1=NC=CC=C1Cl SBB085790 [0,1,0,0,0,1|2,0,0]=4 564 B8R1.5 FC1=NC=CC=C1I SBB096409 [0,1,0,0,0,1|2,0,0]=4 565 B8R1.5 NC1=C(Br)C=CC=C1 SBB058717 [0,1,0,0,0,1|2,0,0]=4 566 B8R1.5 NC1=C(Br)C=NC=C1 SBB005537 [0,1,0,0,0,1|2,0,0]=4 567 B8R1.5 NC1=C(Cl)C=CC=N1 SBB015835 [0,1,0,0,0,1|2,0,0]=4 568 B8R1.5 NC1=C(Cl)C=CN=C1 SBB028232 [0,1,0,0,0,1|2,0,0]=4 569 B8R1.5 NC1=C(Cl)N=CC=C1 SBB004233 [0,1,0,0,0,1|2,0,0]=4 570 B8R1.5 NC1=C(F)C=NC=C1 SBB069765 [0,1,0,0,0,1|2,0,0]=4 571 B8R1.5 NC1=C(I)C=CC=N1 SBB028437 [0,1,0,0,0,1|2,0,0]=4 572 B8R1.5 NC1=C(I)C=CN=C1 SBB070538 [0,1,0,0,0,1|2,0,0]=4 573 B8R1.5 NC1=C(N)C=NC=C1 SBB004341 [0,1,0,0,0,1|2,0,0]=4 574 B8R1.5 NC1=C(N)N=CN=C1 SBB004335 [0,1,0,0,0,1|2,0,0]=4 575 B8R1.5 NC1=C(O)C=CC=C1 SBB040832 [0,1,0,0,0,1|2,0,0]=4 576 B8R1.5 NC1=C(O)C=CC=N1 SBB028186 [0,1,0,0,0,1|2,0,0]=4 577 B8R1.5 NC1=C(S)C=CC=C1 SBB009960 [0,1,0,0,0,1|2,0,0]=4 578 B8R1.5 NC1=CC=CC=C1Cl SBB040494 [0,1,0,0,0,1|2,0,0]=4 579 B8R1.5 NC1=CC=CC=C1Cl SBB087744 [0,1,0,0,0,1|2,0,0]=4 580 B8R1.5 NC1=CC=CC=C1F SBB040472 [0,1,0,0,0,1|2,0,0]=4 581 B8R1.5 NC1=CC=CC=C1I SBB016575 [0,1,0,0,0,1|2,0,0]=4 582 B8R1.5 NC1=CC=CC=C1N SBB040801 [0,1,0,0,0,1|2,0,0]=4 583 B8R1.5 NC1=CC=CN=C1Br SBB005539 [0,1,0,0,0,1|2,0,0]=4 584 B8R1.5 NC1=CC=CN=C1N SBB004339 [0,1,0,0,0,1|2,0,0]=4 585 B8R1.5 NC1=CC=CN=C1O SBB051906 [0,1,0,0,0,1|2,0,0]=4 586 B8R1.5 NC1=CC=CNC1=O SBB000038 [0,1,0,0,0,1|2,0,0]=4 587 B8R1.5 NC1=CC=NC=C1Cl SBB051889 [0,1,0,0,0,1|2,0,0]=4 588 B8R1.5 NC1=CC=NC=C1I SBB028438 [0,1,0,0,0,1|2,0,0]=4 589 B8R1.5 NC1=CC=NC=C1O SBB051918 [0,1,0,0,0,1|2,0,0]=4 590 B8R1.5 NC1=CN=CC=C1O SBB051888 [0,1,0,0,0,1|2,0,0]=4 591 B8R1.5 NC1=NC=CC=C1Br SBB005538 [0,1,0,0,0,1|2,0,0]=4 592 B8R1.5 NC1=NC=CC=C1F SBB051797 [0,1,0,0,0,1|2,0,0]=4 593 B8R1.5 NC1=NC=CC=C1S SBB065453 [0,1,0,0,0,1|2,0,0]=4 594 B8R1.5 NC1=NC=CN=C1Cl SBB006510 [0,1,0,0,0,1|2,0,0]=4 595 B8R1.5 NC1=[N+]([O-])C=CC=C1 SBB051816 [0,1,0,0,0,1|2,0,0]=4 596 B8R1.5 O=C1C=CC=CN1O SBB004329 [0,1,0,0,0,1|2,0,0]=4 597 B8R1.5 O=C1NC=CC=C1Br SBB088834 [0,1,0,0,0,1|2,0,0]=4 598 B8R1.5 OC1=C(Br)C=NC=C1 SBB088832 [0,1,0,0,0,1|2,0,0]=4 599 B8R1.5 OC1=C(O)N=CC=C1 SBB004333 [0,1,0,0,0,1|2,0,0]=4 600 B8R1.5 OC1=CC=CC=C1I SBB055205 [0,1,0,0,0,1|2,0,0]=4 601 B8R1.5 OC1=CC=CC=C1O SBB040792 [0,1,0,0,0,1|2,0,0]=4 602 B8R1.5 OC1=CC=CN=C1Br SBB003805 [0,1,0,0,0,1|2,0,0]=4 603 B8R1.5 OC1=CC=CN=C1Cl SBB054358 [0,1,0,0,0,1|2,0,0]=4 604 B8R1.5 OC1=CC=CN=C1I SBB054374 [0,1,0,0,0,1|2,0,0]=4 605 B8R1.5 OC1=NC=CC=C1Cl SBB054336 [0,1,0,0,0,1|2,0,0]=4 606 B8R1.5 SC1=CC=CC=C1Br SBB063171 [0,1,0,0,0,1|2,0,0]=4 607 B8R1.5 [O-][N+]1=C(S)C=CC=C1 SBB065304 [0,1,0,0,0,1|2,0,0]=4 608 B8R1.5 [O-][N+]1=CC=CC=C1Cl SBB085747 [0,1,0,0,0,1|2,0,0]=4 609 B8R1.5 [O-][N+]1=CC=CC=C1O SBB004330 [0,1,0,0,0,1|2,0,0]=4 610 B8R1.1 C#CC1=CN(C)N=C1 SBB074343 [0,2,0,0,0,0|2,0,0]=4 611 B8R1.1 C#CC1=NN(C)C=C1 SBB116170 [0,2,0,0,0,0|2,0,0]=4 612 B8R1.1 C(=O)C1=CC(C)=NO1 SBB073327 [0,2,0,0,0,0|1,0,1]=4 613 B8R1.1 C(=O)C1=CC=C(C)S1 SBB004249 [0,2,0,0,0,0|0,1,0]=3 614 B8R1.1 C(=O)C1=CC=C(Cl)O1 SBB004223 [0,2,0,0,0,0|0,0,1]=3 615 B8R1.1 C(=O)C1=CC=C(Cl)S1 SBB004100 [0,2,0,0,0,0|0,1,1]=4 616 B8R1.1 C(=O)C1=CC=C(F)S1 SBB027017 [0,2,0,0,0,0|0,1,1]=4 617 B8R1.1 C(=O)C1=CN(C)N=C1 SBB000002 [0,2,0,0,0,0|2,0,0]=4 618 B8R1.1 CC1=CC(C=O)=NO1 SBB052294 [0,2,0,0,0,0|1,0,0]=3 619 B8R1.1 CC1=CC(CBr)=NO1 SBB089113 [0,2,0,0,0,0|1,0,0]=3 620 B8R1.1 CC1=CC(CCl)=NO1 SBB026481 [0,2,0,0,0,0|1,0,0]=3 621 B8R1.1 CC1=CC(CN)=NO1 SBB018900 [0,2,0,0,0,0|1,0,0]=3 622 B8R1.1 CC1=CC(CO)=CS1 SBB017457 [0,2,0,0,0,0|0,1,0]=3 623 B8R1.1 CC1=CC(CO)=NO1 SBB025974 [0,2,0,0,0,0|1,0,0]=3 624 B8R1.1 CC1=CC=C(C=O)O1 SBB040222 [0,2,0,0,0,0|0,0,0]=2 625 B8R1.1 CC1=CC=C(CN)O1 SBB047770 [0,2,0,0,0,0|0,0,0]=2 626 B8R1.1 CC1=CN(CCl)N=C1 SBB031559 [0,2,0,0,0,0|2,0,0]=4 627 B8R1.1 CC1=CN(CO)N=C1 SBB023299 [0,2,0,0,0,0|2,0,0]=4 628 B8R1.1 CC1=CN=C(C=O)S1 SBB052287 [0,2,0,0,0,0|1,1,0]=4 629 B8R1.1 CC1=CN=C(CO)S1 SBB054807 [0,2,0,0,0,0|1,1,0]=4 630 B8R1.1 CC1=CSC(CO)=N1 SBB054809 [0,2,0,0,0,0|1,1,0]=4 631 B8R1.1 CC1=NC(C#N)=CS1 SBB085571 [0,2,0,0,0,0|1,1,0]=4 632 B8R1.1 CC1=NC(C=O)=CN1 SBB052314 [0,2,0,0,0,0|2,0,0]=4 633 B8R1.1 CC1=NC(C=O)=CS1 SBB085686 [0,2,0,0,0,0|1,1,0]=4 634 B8R1.1 CC1=NC(CCl)=CS1 SBB005574 [0,2,0,0,0,0|1,1,0]=4 635 B8R1.1 CC1=NC(CCl)=CS1 SBB054934 [0,2,0,0,0,0|1,1,0]=4 636 B8R1.1 CC1=NC(CCl)=NO1 SBB014359 [0,2,0,0,0,0|2,0,0]=4 637 B8R1.1 CC1=NC(CN)=CS1 SBB052476 [0,2,0,0,0,0|1,1,0]=4 638 B8R1.1 CC1=NC(CN)=NO1 SBB018524 [0,2,0,0,0,0|2,0,0]=4 639 B8R1.1 CC1=NC(CO)=NO1 SBB018815 [0,2,0,0,0,0|2,0,0]=4 640 B8R1.1 CC1=NC=C(C=O)S1 SBB018895 [0,2,0,0,0,0|1,1,0]=4 641 B8R1.1 CC1=NN=C(CCl)O1 SBB012831 [0,2,0,0,0,0|2,0,0]=4 642 B8R1.1 CC1=NN=C(CN)O1 SBB018726 [0,2,0,0,0,0|2,0,0]=4 643 B8R1.1 CC1=NNC(C=O)=C1 SBB020823 [0,2,0,0,0,0|2,0,0]=4 644 B8R1.1 CC1=NNC(CN)=C1 SBB027644 [0,2,0,0,0,0|2,0,0]=4 645 B8R1.1 CC1=NNC(CO)=C1 SBB080476 [0,2,0,0,0,0|2,0,0]=4 646 B8R1.1 CC1=NOC(C#N)=C1 SBB073421 [0,2,0,0,0,0|1,0,1]=4 647 B8R1.1 CC1=NOC(CCl)=N1 SBB014390 [0,2,0,0,0,0|2,0,0]=4 648 B8R1.1 CC1=NOC(CN)=C1 SBB026727 [0,2,0,0,0,0|1,0,0]=3 649 B8R1.1 CC1=NOC(CO)=C1 SBB025975 [0,2,0,0,0,0|1,0,0]=3 650 B8R1.1 CCC1=CC(Br)=CS1 SBB073295 [0,2,0,0,0,0|0,1,0]=3 651 B8R1.1 CCC1=NN=C(N)O1 SBB059512 [0,2,0,0,0,0|2,0,0]=4 652 B8R1.1 CCN1C=C(Br)C=N1 SBB046690 [0,2,0,0,0,0|2,0,0]=4 653 B8R1.1 CCN1C=C(Cl)C=N1 SBB046646 [0,2,0,0,0,0|2,0,0]=4 654 B8R1.1 CCN1C=C(I)C=N1 SBB051456 [0,2,0,0,0,0|2,0,0]=4 655 B8R1.1 CCN1C=C(N)C=N1 SBB009610 [0,2,0,0,0,0|2,0,0]=4 656 B8R1.1 CCN1C=C(O)C=N1 SBB032284 [0,2,0,0,0,0|2,0,0]=4 657 B8R1.1 CCN1C=CC(Br)=N1 SBB054434 [0,2,0,0,0,0|2,0,0]=4 658 B8R1.1 CCN1C=CC(C)=N1 SBB020339 [0,2,0,0,0,0|2,0,0]=4 659 B8R1.1 CCN1C=CC(I)=N1 SBB116216 [0,2,0,0,0,0|2,0,0]=4 660 B8R1.1 CCN1C=CC(N)=N1 SBB020916 [0,2,0,0,0,0|2,0,0]=4 661 B8R1.1 CN1C=C(C#N)C=N1 SBB021947 [0,2,0,0,0,0|2,0,0]=4 662 B8R1.1 CN1C=C(CCl)C=N1 SBB026129 [0,2,0,0,0,0|2,0,0]=4 663 B8R1.1 CN1C=C(CN)C=N1 SBB000039 [0,2,0,0,0,0|2,0,0]=4 664 B8R1.1 CN1C=C(CO)C=N1 SBB022156 [0,2,0,0,0,0|2,0,0]=4 665 B8R1.1 CN1C=CC(C#N)=N1 SBB021945 [0,2,0,0,0,0|2,0,0]=4 666 B8R1.1 CN1C=CC(C=O)=N1 SBB020577 [0,2,0,0,0,0|2,0,0]=4 667 B8R1.1 CN1C=CC(CCl)=N1 SBB054941 [0,2,0,0,0,0|2,0,0]=4 668 B8R1.1 CN1C=CC(CN)=N1 SBB020585 [0,2,0,0,0,0|2,0,0]=4 669 B8R1.1 CN1C=CC(CO)=N1 SBB073640 [0,2,0,0,0,0|2,0,0]=4 670 B8R1.1 ClCC1=CC(Br)=NO1 SBB054936 [0,2,0,0,0,0|1,0,0]=3 671 B8R1.1 ClCC1=CN=C(Cl)S1 SBB070711 [0,2,0,0,0,0|1,1,0]=4 672 B8R1.1 ClCN1C=C(Br)C=N1 SBB021115 [0,2,0,0,0,0|2,0,0]=4 673 B8R1.1 ClCN1C=C(Cl)C=N1 SBB022607 [0,2,0,0,0,0|2,0,0]=4 674 B8R1.1 N#CC1=CC(Br)=CS1 SBB018975 [0,2,0,0,0,0|0,1,1]=4 675 B8R1.1 N#CC1=CC=C(Br)O1 SBB000174 [0,2,0,0,0,0|0,0,1]=3 676 B8R1.1 N#CC1=CC=C(F)S1 SBB116496 [0,2,0,0,0,0|0,1,1]=4 677 B8R1.1 N1C=C(C)N=C1CC SBB004334 [0,2,0,0,0,0|2,0,0]=4 678 B8R1.1 NC1=NC(CCl)=CS1 SBB027575 [0,2,0,0,0,0|2,0,0]=4 679 B8R1.1 NC1=NC(CCl)=CS1 SBB090242 [0,2,0,0,0,0|2,0,0]=4 680 B8R1.1 NC1=NC(CO)=CS1 SBB014800 [0,2,0,0,0,0|2,0,0]=4 681 B8R1.1 NC1=NC=C(CO)S1 SBB054810 [0,2,0,0,0,0|1,1,0]=4 682 B8R1.1 NC1=NNC(CO)=C1 SBB073850 [0,2,0,0,0,0|2,0,0]=4 683 B8R1.1 NCC1=CC=C(Br)O1 SBB014655 [0,2,0,0,0,0|0,0,0]=2 684 B8R1.1 O=C1C=C[C@H](CO)O1 SBB006580 [0,2,0,0,0,0|0,0,1]=3 685 B8R1.1 O=CC1=CC(Br)=CO1 SBB069420 [0,2,0,0,0,0|0,0,1]=3 686 B8R1.1 O=CC1=CC(Br)=CS1 SBB000293 [0,2,0,0,0,0|0,1,1]=4 687 B8R1.1 O=CC1=CC=C(Br)O1 SBB047477 [0,2,0,0,0,0|0,0,1]=3 688 B8R1.1 O=CC1=CC=C(Br)S1 SBB000294 [0,2,0,0,0,0|0,1,1]=4 689 B8R1.1 O=CC1=CC=C(I)O1 SBB039297 [0,2,0,0,0,0|0,0,1]=3 690 B8R1.1 OCC1=CC(Br)=CS1 SBB091532 [0,2,0,0,0,0|0,1,0]=3 691 B8R1.1 OCC1=CC=C(Br)S1 SBB068487 [0,2,0,0,0,0|0,1,0]=3 692 B8R1.1 OCC1=CC=C(F)S1 SBB073359 [0,2,0,0,0,0|0,1,0]=3 693 B8R1.1 OCC1=CN=C(Cl)S1 SBB086668 [0,2,0,0,0,0|1,1,0]=4 694 B8R1.1 OCN1C=C(Br)C=N1 SBB024003 [0,2,0,0,0,0|2,0,0]=4 695 B8R1.1 OCN1C=C(Cl)C=N1 SBB022509 [0,2,0,0,0,0|2,0,0]=4 696 B8R1.7 CC(=O)C1=CC=CN1 SBB066752 [0,2,0,0,0,0|1,0,0]=3 697 B8R1.7 CC(=O)C1=CC=CO1 SBB040248 [0,2,0,0,0,0|0,0,0]=2 698 B8R1.7 CC(=O)C1=CC=CS1 SBB038710 [0,2,0,0,0,0|0,1,0]=3 699 B8R1.7 CC(=O)C1=CC=NN1 SBB086523 [0,2,0,0,0,0|2,0,0]=4 700 B8R1.7 CC(=O)C1=CSC=C1 SBB048022 [0,2,0,0,0,0|2,0,0]=4 701 B8R1.7 CC(=O)C1=NC=CS1 SBB085685 [0,2,0,0,0,0|1,1,0]=4 702 B8R1.7 CC(C)C1=NNC=C1 SBB026130 [0,2,0,0,0,0|2,0,0]=4 703 B8R1.7 CC(C)N1C=CC=N1 SBB025134 [0,2,0,0,0,0|2,0,0]=4 704 B8R1.7 CC(N)C1=CC=CO1 SBB017903 [0,2,0,0,0,0|0,0,0]=2 705 B8R1.7 CC(N)C1=CC=CS1 SBB028228 [0,2,0,0,0,0|0,1,0]=3 706 B8R1.7 CN(C)C1=CC=CS1 SBB059107 [0,2,0,0,0,0|0,1,0]=3 707 B8R1.7 FC(F)C1=NNC=C1 SBB027078 [0,2,0,0,0,0|2,0,0]=4 708 B8R1.7 FC(F)N1C=CC=N1 SBB000004 [0,2,0,0,0,0|2,0,0]=4 709 B8R1.7 NC(=O)C1=CC=CO1 SBB028188 [0,2,0,0,0,0|0,0,1]=3 710 B8R1.7 NC(=O)C1=CC=CS1 SBB028227 [0,2,0,0,0,0|0,1,1]=4 711 B8R1.7 NC(=S)C1=CC=CO1 SBB055768 [0,2,0,0,0,0|0,0,1]=3 712 B8R1.7 NC(=S)C1=CC=CS1 SBB016501 [0,2,0,0,0,0|0,1,1]=4 713 B8R1.7 O=C(Cl)C1=CC=CO1 SBB004224 [0,2,0,0,0,0|0,0,1]=3 714 B8R1.7 O=C(Cl)C1=CC=CS1 SBB004099 [0,2,0,0,0,0|0,1,1]=4 715 B8R1.7 O=C(Cl)C1=CC=NO1 SBB005469 [0,2,0,0,0,0|1,0,1]=4 716 B8R1.7 O=C(O)C1=CC=CN1 SBB004332 [0,2,0,0,0,0|1,0,1]=4 717 B8R1.7 O=C(O)C1=CC=CO1 SBB004324 [0,2,0,0,0,0|0,0,1]=3 718 B8R1.7 O=C(O)C1=CC=CS1 SBB004241 [0,2,0,0,0,0|0,1,1]=4 719 B8R1.7 O=C(O)C1=CC=NO1 SBB004319 [0,2,0,0,0,0|1,0,1]=4 720 B8R1.7 O=C(O)C1=CN=CO1 SBB053191 [0,2,0,0,0,0|1,0,1]=4 721 B8R1.7 O=[N+]([O-])C1=CC=CS1 SBB040890 [0,2,0,0,0,0|1,1,0]=4 722 B8R1.7 OB(O)C1=CC=CO1 SBB004326 [0,2,0,0,0,0|1,0,0]=3 723 B8R1.7 OB(O)C1=CC=CS1 SBB004243 [0,2,0,0,0,0|1,1,0]=4 724 B8R1.8 BrCCN1C=CC=N1 SBB051197 [0,2,0,0,0,0|2,0,0]=4 725 B8R1.8 CCCC1=CC=CS1 SBB073407 [0,2,0,0,0,0|0,1,0]=3 726 B8R1.8 CCCC1=NC=CS1 SBB055797 [0,2,0,0,0,0|1,1,0]=4 727 B8R1.8 CCCN1C=CC=N1 SBB024228 [0,2,0,0,0,0|2,0,0]=4 728 B8R1.8 CNCC1=CC=CO1 SBB079004 [0,2,0,0,0,0|0,0,0]=2 729 B8R1.8 CNCC1=CC=NN1 SBB023948 [0,2,0,0,0,0|2,0,0]=4 730 B8R1.8 ClCCN1C=CC=N1 SBB022467 [0,2,0,0,0,0|2,0,0]=4 731 B8R1.8 N#CCC1=CC=CS1 SBB055746 [0,2,0,0,0,0|0,1,0]=3 732 B8R1.8 N#CCC1=CSC=C1 SBB058364 [0,2,0,0,0,0|2,0,0]=4 733 B8R1.8 N#CCN1C=CC=N1 SBB022524 [0,2,0,0,0,0|2,0,0]=4 734 B8R1.8 NCCC1=CC=CO1 SBB013333 [0,2,0,0,0,0|0,0,0]=2 735 B8R1.8 NCCC1=CC=CS1 SBB013250 [0,2,0,0,0,0|0,1,0]=3 736 B8R1.8 NCCC1=CC=CS1 SBB013650 [0,2,0,0,0,0|0,1,0]=3 737 B8R1.8 NCCC1=CNC=N1 SBB003722 [0,2,0,0,0,0|2,0,0]=4 738 B8R1.8 NCCC1=CNC=N1 SBB012708 [0,2,0,0,0,0|2,0,0]=4 739 B8R1.8 NCCC1=CSC=C1 SBB109999 [0,2,0,0,0,0|2,0,0]=4 740 B8R1.8 NCCC1=NC=CS1 SBB046047 [0,2,0,0,0,0|1,1,0]=4 741 B8R1.8 NCCN1C=CC=N1 SBB007087 [0,2,0,0,0,0|2,0,0]=4 742 B8R1.8 O=C=NC1=CC=CS1 SBB054891 [0,2,0,0,0,0|0,1,1]=4 743 B8R1.8 OCCC1=CC=CS1 SBB062831 [0,2,0,0,0,0|0,1,0]=3 744 B8R1.8 OCCN1C=CC=N1 SBB022466 [0,2,0,0,0,0|2,0,0]=4 745 B8R1.11 C#CC1=CC=NN1C SBB116614 [0,2,0,0,0,0|2,0,0]=4 746 B8R1.11 CC1=C(C#N)SC=C1 SBB055764 [0,2,0,0,0,0|0,1,1]=4 747 B8R1.11 CC1=C(C=O)C=CO1 SBB052277 [0,2,0,0,0,0|0,0,0]=2 748 B8R1.11 CC1=C(C=O)C=NN1 SBB024513 [0,2,0,0,0,0|2,0,0]=4 749 B8R1.11 CC1=C(C=O)NC=N1 SBB052313 [0,2,0,0,0,0|2,0,0]=4 750 B8R1.11 CC1=C(C=O)SC=C1 SBB040199 [0,2,0,0,0,0|0,1,1]=4 751 B8R1.11 CC1=C(C=O)SC=N1 SBB052288 [0,2,0,0,0,0|2,0,0]=4 752 B8R1.11 CC1=C(CCl)NC=N1 SBB019096 [0,2,0,0,0,0|2,0,0]=4 753 B8R1.11 CC1=C(CN)SC=C1 SBB028229 [0,2,0,0,0,0|0,1,0]=3 754 B8R1.11 CC1=C(CO)C=CO1 SBB054803 [0,2,0,0,0,0|0,0,0]=2 755 B8R1.11 CC1=NNC=C1C#N SBB013488 [0,2,0,0,0,0|2,0,0]=4 756 B8R1.11 CC1=NNC=C1CN SBB013491 [0,2,0,0,0,0|2,0,0]=4 757 B8R1.11 CCC1=CC=NN1C SBB026460 [0,2,0,0,0,0|2,0,0]=4 758 B8R1.11 CCN1N=CC=C1C SBB020345 [0,2,0,0,0,0|2,0,0]=4 759 B8R1.11 CCN1N=CC=C1F SBB116429 [0,2,0,0,0,0|2,0,0]=4 760 B8R1.11 CCN1N=CC=C1I SBB116428 [0,2,0,0,0,0|2,0,0]=4 761 B8R1.11 CCN1N=CC=C1N SBB005554 [0,2,0,0,0,0|2,0,0]=4 762 B8R1.11 CN1C=CC=C1C=O SBB040239 [0,2,0,0,0,0|1,0,1]=4 763 B8R1.11 CN1C=CN=C1CCl SBB013849 [0,2,0,0,0,0|2,0,0]=4 764 B8R1.11 CN1C=CN=C1CCl SBB088045 [0,2,0,0,0,0|2,0,0]=4 765 B8R1.11 CN1C=CN=C1CN SBB014295 [0,2,0,0,0,0|2,0,0]=4 766 B8R1.11 CN1C=CN=C1CO SBB054819 [0,2,0,0,0,0|2,0,0]=4 767 B8R1.11 CN1N=CC=C1C#N SBB025129 [0,2,0,0,0,0|2,0,0]=4 768 B8R1.11 CN1N=CC=C1C=O SBB017366 [0,2,0,0,0,0|2,0,0]=4 769 B8R1.11 CN1N=CC=C1CCl SBB025039 [0,2,0,0,0,0|2,0,0]=4 770 B8R1.11 CN1N=CC=C1CN SBB021230 [0,2,0,0,0,0|2,0,0]=4 771 B8R1.11 CN1N=CC=C1CO SBB024002 [0,2,0,0,0,0|2,0,0]=4 772 B8R1.11 N#CC1=C(Br)C=CS1 SBB090686 [0,2,0,0,0,0|0,1,1]=4 773 B8R1.11 N#CC1=C(N)ON=C1 SBB002694 [0,2,0,0,0,0|2,0,0]=4 774 B8R1.11 N#CC1=C(N)SC=C1 SBB005484 [0,2,0,0,0,0|1,1,0]=4 775 B8R1.11 NCC1=NNC=C1I SBB073991 [0,2,0,0,0,0|2,0,0]=4 776 B8R1.11 O=CC1=C(Br)C=CO1 SBB067497 [0,2,0,0,0,0|0,0,1]=3 777 B8R1.11 O=CC1=C(Br)C=CS1 SBB052262 [0,2,0,0,0,0|0,1,1]=4 778 B8R1.11 OCC1=C(C)N=CN1 SBB005865 [0,2,0,0,0,0|2,0,0]=4 779 B8R1.11 OCC1=NNC=C1I SBB073992 [0,2,0,0,0,0|2,0,0]=4 780 B8R1.18 CC1=C(Br)SC(N)=N1 SBB070340 [0,2,0,0,0,0|2,0,0]=4 781 B8R1.18 CC1=C(C)NC(=S)N1 SBB014699 [0,2,0,0,0,0|2,0,0]=4 782 B8R1.18 CC1=C(C)OC(=O)O1 SBB017270 [0,2,0,0,0,0|1,0,0]=3 783 B8R1.18 CC1=C(C)SC(Br)=N1 SBB110187 [0,2,0,0,0,0|1,1,0]=4 784 B8R1.18 CC1=C(C)SC(N)=N1 SBB003911 [0,2,0,0,0,0|1,1,0]=4 785 B8R1.18 CC1=C(C)SC(N)=N1 SBB028421 [0,2,0,0,0,0|1,1,0]=4 786 B8R1.18 CC1=C(C)SC(N)=N1 SBB037835 [0,2,0,0,0,0|1,1,0]=4 787 B8R1.18 CC1=C(C)SC(S)=N1 SBB059522 [0,2,0,0,0,0|1,1,0]=4 788 B8R1.18 CC1=CC(=O)C(C)O1 SBB055769 [0,2,0,0,0,0|0,0,1]=3 789 B8R1.18 CC1=CC(Br)=NN1C SBB116193 [0,2,0,0,0,0|2,0,0]=4 790 B8R1.18 CC1=CC(C)=NN1C SBB055828 [0,2,0,0,0,0|2,0,0]=4 791 B8R1.18 CC1=CC(I)=NN1C SBB116210 [0,2,0,0,0,0|2,0,0]=4 792 B8R1.18 CC1=CC(N)=NN1C SBB009548 [0,2,0,0,0,0|2,0,0]=4 793 B8R1.18 CC1=CN(C)N=C1N SBB027022 [0,2,0,0,0,0|2,0,0]=4 794 B8R1.18 CC1=NC(C)=C(Br)S1 SBB054427 [0,2,0,0,0,0|1,1,0]=4 795 B8R1.18 CC1=NN(C)C(Cl)=C1 SBB054432 [0,2,0,0,0,0|2,0,0]=4 796 B8R1.18 CC1=NN(C)C(F)=C1 SBB116432 [0,2,0,0,0,0|2,0,0]=4 797 B8R1.18 CC1=NN(C)C(N)=C1 SBB022916 [0,2,0,0,0,0|2,0,0]=4 798 B8R1.18 CC1=NN(C)C=C1Br SBB005613 [0,2,0,0,0,0|2,0,0]=4 799 B8R1.18 CC1=NN(C)C=C1Cl SBB046655 [0,2,0,0,0,0|2,0,0]=4 800 B8R1.18 CC1=NN(C)C=C1I SBB051457 [0,2,0,0,0,0|2,0,0]=4 801 B8R1.18 CC1=NN(C)C=C1N SBB009353 [0,2,0,0,0,0|2,0,0]=4 802 B8R1.18 CN1C=C(Br)C(N)=N1 SBB028137 [0,2,0,0,0,0|2,0,0]=4 803 B8R1.18 CN1C=C(Cl)C(N)=N1 SBB022306 [0,2,0,0,0,0|2,0,0]=4 804 B8R1.18 CN1C=C(I)C(N)=N1 SBB074169 [0,2,0,0,0,0|2,0,0]=4 805 B8R1.18 ClC1=CC(Br)=C(Cl)S1 SBB097839 [0,2,0,0,0,0|1,1,0]=4 806 B8R1.18 ClC1=CC(Cl)=C(Cl)S1 SBB058331 [0,2,0,0,0,0|1,1,0]=4 807 B8R1.50 CC1=C(Br)C(N)=NO1 SBB005510 [0,2,0,0,0,0|1,0,0]=3 808 B8R1.50 CC1=C(Br)C=NN1C SBB019101 [0,2,0,0,0,0|2,0,0]=4 809 B8R1.50 CC1=C(C)C(=O)NC1 SBB055792 [0,2,0,0,0,0|2,0,0]=4 810 B8R1.50 CC1=C(C)C(N)=NO1 SBB059728 [0,2,0,0,0,0|1,0,0]=3 811 B8R1.50 CC1=C(Cl)C(N)=NN1 SBB020537 [0,2,0,0,0,0|2,0,0]=4 812 B8R1.50 CC1=C(Cl)C=NN1C SBB047362 [0,2,0,0,0,0|2,0,0]=4 813 B8R1.50 CC1=C(I)C=NN1C SBB051458 [0,2,0,0,0,0|2,0,0]=4 814 B8R1.50 CC1=C(N)C=NN1C SBB020193 [0,2,0,0,0,0|2,0,0]=4 815 B8R1.50 CC1=CC=C(C)N1N SBB059489 [0,2,0,0,0,0|1,0,0]=3 816 B8R1.50 CC1=NNC(C)=C1Br SBB000189 [0,2,0,0,0,0|2,0,0]=4 817 B8R1.50 CC1=NNC(C)=C1C SBB047376 [0,2,0,0,0,0|2,0,0]=4 818 B8R1.50 CC1=NNC(C)=C1Cl SBB000063 [0,2,0,0,0,0|2,0,0]=4 819 B8R1.50 CC1=NNC(C)=C1I SBB025983 [0,2,0,0,0,0|2,0,0]=4 820 B8R1.50 CC1=NNC(C)=C1N SBB007105 [0,2,0,0,0,0|2,0,0]=4 821 B8R1.50 CC1=NNC(N)=C1Br SBB017332 [0,2,0,0,0,0|2,0,0]=4 822 B8R1.50 CC1=NNC(N)=C1Br SBB028151 [0,2,0,0,0,0|2,0,0]=4 823 B8R1.50 CC1=NOC(C)=C1Br SBB003784 [0,2,0,0,0,0|1,0,0]=3 824 B8R1.50 CC1=NOC(C)=C1I SBB054430 [0,2,0,0,0,0|1,0,0]=3 825 B8R1.50 CC1=NOC(C)=C1N SBB005896 [0,2,0,0,0,0|1,0,0]=3 826 B8R1.50 CC1=NOC(N)=C1Br SBB074393 [0,2,0,0,0,0|2,0,0]=4 827 B8R1.50 CC1=NOC(N)=C1C SBB028192 [0,2,0,0,0,0|2,0,0]=4 828 B8R1.50 CC1=[N+]([O-])C=CN1O SBB085231 [0,2,0,0,0,0|2,0,0]=4 829 B8R1.50 CN1N=CC(Br)=C1N SBB028379 [0,2,0,0,0,0|2,0,0]=4 830 B8R1.50 N1N=C(N)C(Cl)=C1C SBB059499 [0,2,0,0,0,0|2,0,0]=4 831 B6R1.1 C1=CC=NC=C1 SBB055734 [0,0,1,1,0,0|1,0,1]=4 832 B6R1.1 C1=CN=NC=C1 SBB059541 [0,0,1,1,0,0|2,0,0]=4 833 B6R1.1 C1=COCCC1 SBB060381 [0,0,1,1,0,0|0,0,2]=4 834 B8R1.22 O=C1C=CC=CC=C1 SBB057378 [0,0,0,0,0,2|2,0,0]=4