0 B10R1.172 BrCC1=CC=CC(CBr)=C1 7491 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.172 CCC1=CC=CC(C#N)=C1 5432 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.172 CCC1=CC=CC(C=O)=C1 3073 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.172 CNC1=CC=CC(NC)=C1 21395 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.172 CNC1=CC=CC(OC)=N1 15374 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.172 COC1=CC(C#N)=CN=C1 16544 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.172 COC1=CC(C=O)=NC=C1 27798 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.172 COC1=CC(CN)=NC=C1 27624 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.172 COC1=CC(CN)=NC=C1 34573 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.172 COC1=CC(CO)=NC=C1 9295 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.172 COC1=CC(OC)=NC=N1 7178 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.172 COC1=CC=CC(C#N)=C1 4813 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.172 COC1=CC=CC(C=O)=C1 13614 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.172 COC1=CC=CC(C=O)=N1 15345 [0,0,0,0,0,0|3,0,0]=3 14 B10R1.172 COC1=CC=CC(CBr)=C1 13585 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.172 COC1=CC=CC(CCl)=C1 4653 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.172 COC1=CC=CC(CN)=C1 7401 [0,0,0,0,0,0|2,0,0]=2 17 B10R1.172 COC1=CC=CC(CO)=C1 3095 [0,0,0,0,0,0|2,0,0]=2 18 B10R1.172 COC1=CC=CC(CO)=N1 16585 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.172 COC1=CC=CC(OC)=N1 29237 [0,0,0,0,0,0|1,0,0]=1 20 B10R1.172 COC1=CC=CC(SC)=C1 10653 [0,0,0,0,0,0|0,1,0]=1 21 B10R1.172 COC1=CN=CC(C#N)=N1 34212 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.172 COC1=CN=CC(C=O)=C1 27156 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.172 COC1=CN=CC(OC)=C1 18112 [0,0,0,0,0,0|1,0,0]=1 24 B10R1.172 COC1=CN=CC(OC)=N1 8614 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.172 COC1=NC(OC)=NC=C1 7104 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.172 COC1=NC=CC(C=O)=C1 17088 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.172 COC1=NC=CC(CCl)=C1 24332 [0,0,0,0,0,0|3,0,0]=3 28 B10R1.172 CSC1=CC=CC(CCl)=C1 32305 [0,0,0,0,0,0|2,1,0]=3 29 B10R1.172 ClCC1=CC=CC(CCl)=C1 7521 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.172 N#CC1=CC(CN)=CC=C1 18585 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.172 N#CC1=CC=CC(C=O)=C1 7766 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.172 N#CC1=CC=CC(CBr)=C1 15686 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.172 N#CC1=CC=CC(CCl)=C1 10207 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.172 N#CC1=CC=CC(NN)=C1 7560 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.172 N#Cc1cccc(CO)c1 30787 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.172 NCC1=CC=CC(CN)=C1 17202 [0,0,0,0,0,0|4,0,0]=4 37 B10R1.172 O=CC1=CC(CBr)=CC=C1 17017 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.172 O=CC1=CC=CC(C=O)=C1 17622 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.172 SCC1=CC=CC(CS)=C1 6869 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.2 BrCC1=CC(Br)=CC=C1 3029 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.2 BrCC1=CC(I)=CC=C1 28805 [1,0,0,0,0,0|3,0,0]=4 42 B9R1.2 C#CC1=CC(F)=CC=C1 12891 [1,0,0,0,0,0|2,0,1]=4 43 B9R1.2 C#CC1=CC(N)=CC=C1 30297 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.2 C#CC1=CC(N)=CC=C1 4052 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.2 C#CC1=CC=CC(Br)=C1 19784 [1,0,0,0,0,0|2,0,1]=4 46 B9R1.2 C#CC1=CC=CC(Cl)=C1 14083 [1,0,0,0,0,0|2,0,1]=4 47 B9R1.2 C=CC1=CC(Br)=CC=C1 23859 [1,0,0,0,0,0|2,0,1]=4 48 B9R1.2 C=CC1=CC=CC(C)=N1 25969 [1,0,0,0,0,0|2,0,1]=4 49 B9R1.2 CC1=CC(C#N)=NC=C1 21387 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.2 CC1=CC(C=O)=CC=C1 15513 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.2 CC1=CC(C=O)=NC=C1 17166 [1,0,0,0,0,0|3,0,0]=4 52 B9R1.2 CC1=CC=CC(C#N)=N1 16781 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.2 CC1=CC=CC(C=O)=N1 15904 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.2 CC1=CC=CC(CBr)=N1 22577 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.2 CC1=CC=CC(CCl)=N1 22531 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.2 CC1=CC=CC(CCl)=N1 22536 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.2 CC1=CC=CC(CF)=C1 28809 [1,0,0,0,0,0|2,0,0]=3 58 B9R1.2 CC1=CC=CC(CN)=C1 10198 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.2 CC1=CC=CC(CN)=N1 19465 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.2 CC1=CC=CC(CO)=N1 20959 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.2 CC1=CC=CC(NN)=C1 6397 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.2 CC1=CN=CC(CO)=C1 22640 [1,0,0,0,0,0|3,0,0]=4 63 B9R1.2 CC1=NC=CC(C#N)=C1 26215 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.2 CC1=NC=CC(CN)=C1 34737 [1,0,0,0,0,0|3,0,0]=4 65 B9R1.2 CCC1=CC(N)=NC=C1 7108 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.2 CCC1=CC(O)=NC=N1 23619 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.2 CCC1=CC=CC(Br)=C1 3771 [1,0,0,0,0,0|2,0,0]=3 68 B9R1.2 CCC1=CC=CC(N)=C1 13534 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.2 CCC1=CC=CC(O)=C1 10772 [1,0,0,0,0,0|1,0,0]=2 70 B9R1.2 CCC1=NC=CC(Br)=C1 22128 [1,0,0,0,0,0|3,0,0]=4 71 B9R1.2 CNC1=CC(Br)=CN=C1 34590 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.2 CNC1=CC(Br)=NC=C1 33713 [1,0,0,0,0,0|3,0,0]=4 73 B9R1.2 CNC1=CC(Cl)=CC=C1 9202 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.2 CNC1=CC(F)=CC=C1 24835 [1,0,0,0,0,0|2,0,0]=3 75 B9R1.2 CNC1=CC=CC(O)=C1 27611 [1,0,0,0,0,0|1,0,0]=2 76 B9R1.2 CNC1=NC=CC(Br)=C1 32483 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.2 COC1=CC(Br)=CC=C1 13575 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.2 COC1=CC(Br)=NC=C1 5957 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.2 COC1=CC(Br)=NC=N1 28084 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.2 COC1=CC(Cl)=CC=C1 3615 [1,0,0,0,0,0|1,0,0]=2 81 B9R1.2 COC1=CC(Cl)=NC=C1 6204 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.2 COC1=CC(Cl)=NC=N1 7038 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.2 COC1=CC(F)=CC=C1 3474 [1,0,0,0,0,0|1,0,0]=2 84 B9R1.2 COC1=CC(F)=NC=C1 34821 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.2 COC1=CC(I)=CC=C1 3904 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.2 COC1=CC(I)=NC=N1 28085 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.2 COC1=CC(N)=NC=C1 16566 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.2 COC1=CC(N)=NC=C1 5700 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.2 COC1=CC(N)=NC=N1 2605 [1,0,0,0,0,0|3,0,0]=4 90 B9R1.2 COC1=CC(O)=CC=C1 13577 [1,0,0,0,0,0|0,0,0]=1 91 B9R1.2 COC1=CC=CC(Br)=N1 9206 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.2 COC1=CC=CC(Cl)=N1 13194 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.2 COC1=CC=CC(I)=N1 9288 [1,0,0,0,0,0|2,0,0]=3 94 B9R1.2 COC1=CC=CC(N)=C1 8374 [1,0,0,0,0,0|1,0,0]=2 95 B9R1.2 COC1=CC=CC(N)=N1 12919 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.2 COC1=CC=CC(S)=C1 6817 [1,0,0,0,0,0|0,1,0]=2 97 B9R1.2 COC1=CN=CC(Br)=C1 5085 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.2 COC1=CN=CC(Cl)=N1 32164 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.2 COC1=CN=CC(I)=C1 16704 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.2 COC1=CN=CC(N)=C1 22353 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.2 COC1=CN=CC(N)=N1 17504 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.2 COC1=CN=CC(O)=C1 27157 [1,0,0,0,0,0|1,0,0]=2 103 B9R1.2 COC1=CN=NC(O)=C1 28201 [1,0,0,0,0,0|2,0,0]=3 104 B9R1.2 COC1=NC(Br)=NC=C1 28086 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.2 COC1=NC(C)=NC=C1 19887 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.2 COC1=NC(N)=NC=C1 21995 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.2 COC1=NC=CC(Br)=C1 6657 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.2 COC1=NC=CC(Br)=N1 33686 [1,0,0,0,0,0|3,0,0]=4 109 B9R1.2 COC1=NC=CC(C)=C1 6598 [1,0,0,0,0,0|1,0,0]=2 110 B9R1.2 COC1=NC=CC(Cl)=C1 15650 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.2 COC1=NC=CC(Cl)=C1 6663 [1,0,0,0,0,0|2,0,0]=3 112 B9R1.2 COC1=NC=CC(Cl)=N1 23206 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.2 COC1=NC=CC(F)=C1 6596 [1,0,0,0,0,0|2,0,0]=3 114 B9R1.2 COC1=NC=CC(I)=C1 17128 [1,0,0,0,0,0|2,0,0]=3 115 B9R1.2 COC1=NC=CC(N)=C1 32235 [1,0,0,0,0,0|2,0,0]=3 116 B9R1.2 COC1=NC=CC(N)=C1 6595 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.2 COC1=NC=CC(N)=N1 28087 [1,0,0,0,0,0|3,0,0]=4 118 B9R1.2 COC1=NC=CC(O)=C1 35149 [1,0,0,0,0,0|1,0,0]=2 119 B9R1.2 CSC1=CC(Br)=CC=C1 10649 [1,0,0,0,0,0|1,1,0]=3 120 B9R1.2 CSC1=CC(C)=CC=C1 10793 [1,0,0,0,0,0|0,1,0]=2 121 B9R1.2 CSC1=CC(Cl)=CC=C1 10644 [1,0,0,0,0,0|1,1,0]=3 122 B9R1.2 CSC1=CC(F)=CC=C1 10640 [1,0,0,0,0,0|1,1,0]=3 123 B9R1.2 CSC1=CC(I)=CC=C1 10669 [1,0,0,0,0,0|1,1,0]=3 124 B9R1.2 CSC1=CC(N)=CC=C1 10635 [1,0,0,0,0,0|1,1,0]=3 125 B9R1.2 CSC1=CC=CC(Br)=N1 27610 [1,0,0,0,0,0|2,1,0]=4 126 B9R1.2 CSC1=NC=CC(C)=N1 35732 [1,0,0,0,0,0|2,1,0]=4 127 B9R1.2 CSC1=NC=CC(O)=N1 21487 [1,0,0,0,0,0|2,1,0]=4 128 B9R1.2 ClC1=CC=CC(CBr)=C1 10765 [1,0,0,0,0,0|3,0,0]=4 129 B9R1.2 ClCC1=CC(Br)=CC=C1 23319 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.2 ClCC1=CC(Cl)=CC=C1 7520 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.2 ClCC1=CC(I)=CC=C1 31286 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.2 FC1=CC=CC(CBr)=C1 10214 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.2 FC1=CC=CC(CCl)=C1 7516 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.2 N#CC1=CC(Br)=CC=C1 1584 [1,0,0,0,0,0|3,0,0]=4 135 B9R1.2 N#CC1=CC(Cl)=CC=C1 3624 [1,0,0,0,0,0|3,0,0]=4 136 B9R1.2 N#CC1=CC(F)=CC=C1 1579 [1,0,0,0,0,0|3,0,0]=4 137 B9R1.2 N#CC1=CC(I)=CC=C1 3935 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.2 N#CC1=CC(O)=CC=C1 13113 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.2 N#CC1=CC(O)=CN=C1 17727 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.2 N#CC1=CC(O)=CN=C1 18350 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.2 N#CC1=CC=CC(S)=C1 26190 [1,0,0,0,0,0|2,1,0]=4 142 B9R1.2 N#CC1=NC=CC(O)=C1 34371 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.2 NC1=CC=CC(CO)=C1 13383 [1,0,0,0,0,0|3,0,0]=4 144 B9R1.2 NCC1=CC(Br)=CC=C1 21109 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.2 NCC1=CC(Br)=CC=C1 3750 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.2 NCC1=CC(F)=CC=C1 4417 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.2 NCC1=CC(I)=CC=C1 3302 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.2 NCC1=CC(N)=CC=C1 5802 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.2 NNC1=CC(Br)=CC=C1 23212 [1,0,0,0,0,0|3,0,0]=4 150 B9R1.2 NNC1=CC(Cl)=CC=C1 7529 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.2 NNC1=CC(F)=CC=C1 3341 [1,0,0,0,0,0|3,0,0]=4 152 B9R1.2 O=CC1=CC(Br)=CC=C1 3728 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.2 O=CC1=CC(Cl)=CC=C1 10800 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.2 O=CC1=CC(F)=CC=C1 3477 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.2 O=CC1=CC(I)=CC=C1 3917 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.2 O=CC1=CC(O)=CC=C1 7767 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.2 O=CC1=CC(O)=CN=C1 23673 [1,0,0,0,0,0|3,0,0]=4 158 B9R1.2 O=CC1=CC(O)=NC=C1 9345 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.2 OCC1=CC(Br)=CC=C1 3747 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.2 OCC1=CC(Cl)=CC=C1 3626 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.2 OCC1=CC(F)=CC=C1 3486 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.2 OCC1=CC(I)=CC=C1 24776 [1,0,0,0,0,0|3,0,0]=4 163 B11R1.9 CCC1=CC(Br)=CC(CC)=C1 16099 [0,1,0,0,0,0|2,0,0]=3 164 B11R1.9 CCC1=CC(OC)=CC(=O)O1 23480 [0,1,0,0,0,0|2,0,0]=3 165 B11R1.9 COC1=CC(Br)=CC(OC)=C1 25408 [0,1,0,0,0,0|0,0,0]=1 166 B11R1.9 COC1=CC(Br)=NC(OC)=N1 21470 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.9 COC1=CC(C#N)=CC(Br)=C1 4720 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.9 COC1=CC(C#N)=CC(Cl)=C1 30802 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.9 COC1=CC(C#N)=CC(F)=C1 4785 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.9 COC1=CC(C)=CC(C#N)=C1 25377 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.9 COC1=CC(C)=CC(C=O)=C1 28420 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.9 COC1=CC(C)=CC(OC)=C1 17775 [0,1,0,0,0,0|0,0,0]=1 173 B11R1.9 COC1=CC(C=O)=CC(Br)=C1 30933 [0,1,0,0,0,0|2,0,0]=3 174 B11R1.9 COC1=CC(C=O)=CC(Cl)=C1 30902 [0,1,0,0,0,0|2,0,0]=3 175 B11R1.9 COC1=CC(C=O)=CC(F)=C1 25242 [0,1,0,0,0,0|2,0,0]=3 176 B11R1.9 COC1=CC(CBr)=CC(F)=C1 31283 [0,1,0,0,0,0|2,0,0]=3 177 B11R1.9 COC1=CC(Cl)=CC(OC)=C1 3042 [0,1,0,0,0,0|0,0,0]=1 178 B11R1.9 COC1=CC(Cl)=NC(OC)=C1 25791 [0,1,0,0,0,0|1,0,0]=2 179 B11R1.9 COC1=CC(Cl)=NC(OC)=N1 16350 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.9 COC1=CC(F)=CC(OC)=C1 3049 [0,1,0,0,0,0|0,0,0]=1 181 B11R1.9 COC1=CC(I)=CC(OC)=C1 4400 [0,1,0,0,0,0|0,0,0]=1 182 B11R1.9 COC1=CC(N)=CC(OC)=C1 4423 [0,1,0,0,0,0|0,0,0]=1 183 B11R1.9 COC1=CC(N)=NC(OC)=N1 6926 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.9 COC1=CC(O)=CC(OC)=C1 16421 [0,1,0,0,0,0|0,0,0]=1 185 B11R1.9 COC1=CC(OC)=NC(C)=N1 7103 [0,1,0,0,0,0|2,0,0]=3 186 B11R1.9 COC1=CC(OC)=NC(Cl)=N1 7010 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.9 COC1=CC(OC)=NC(N)=N1 6972 [0,1,0,0,0,0|2,0,0]=3 188 B11R1.9 COC1=CC(OC)=NC(S)=N1 21467 [0,1,0,0,0,0|2,0,0]=3 189 B11R1.9 COC1=NC(Cl)=NC(OC)=N1 20734 [0,1,0,0,0,0|3,0,0]=4 190 B11R1.189 CCOC1=CC=CC(C=O)=C1 13132 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.189 CCOC1=CC=CC(NN)=C1 16014 [0,1,0,0,0,0|2,0,0]=3 192 B11R1.189 CNCC1=CC(OC)=CC=C1 31256 [0,1,0,0,0,0|1,0,0]=2 193 B11R1.189 COC1=CC=CC(CC#N)=C1 18497 [0,1,0,0,0,0|1,0,1]=3 194 B11R1.189 COC1=CC=CC(CCN)=C1 12794 [0,1,0,0,0,0|1,0,0]=2 195 B11R1.189 CSC1=CC=CC(N=C=O)=C1 14329 [0,1,0,0,0,0|1,1,1]=4 196 B11R1.266 CC(=O)C1=CC(C=O)=CC=C1 31237 [0,1,0,0,0,0|3,0,0]=4 197 B11R1.266 CC(=O)C1=CC(CCl)=CC=C1 23456 [0,1,0,0,0,0|3,0,0]=4 198 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 12649 [0,1,0,0,0,0|3,0,0]=4 199 B11R1.266 CC(C)C1=CC=CC(C=O)=C1 19606 [0,1,0,0,0,0|3,0,0]=4 200 B11R1.266 CCC1=CC=CC(B(O)O)=C1 28829 [0,1,0,0,0,0|3,0,0]=4 201 B11R1.266 CCC1=CC=CC(C(C)=O)=C1 3092 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.266 CN(C)C1=CC=CC(C=O)=C1 15110 [0,1,0,0,0,0|3,0,0]=4 203 B11R1.266 COC1=CC(C(=O)O)=CN=C1 27158 [0,1,0,0,0,0|3,0,0]=4 204 B11R1.266 COC1=CC(C(=O)O)=NC=C1 16686 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.266 COC1=CC(C(C)=O)=NC=C1 33636 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.266 COC1=CC(C(N)=O)=NC=C1 9294 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.266 COC1=CC=CC(B(O)O)=C1 1866 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.266 COC1=CC=CC(C(=O)Cl)=C1 35489 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.266 COC1=CC=CC(C(=O)O)=C1 9012 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.266 COC1=CC=CC(C(=O)O)=N1 15165 [0,1,0,0,0,0|3,0,0]=4 211 B11R1.266 COC1=CC=CC(C(=O)O)=N1 17144 [0,1,0,0,0,0|3,0,0]=4 212 B11R1.266 COC1=CC=CC(C(C)=O)=C1 9201 [0,1,0,0,0,0|1,0,0]=2 213 B11R1.266 COC1=CC=CC(C(C)C)=N1 12411 [0,1,0,0,0,0|2,0,0]=3 214 B11R1.266 COC1=CC=CC(C(N)=O)=N1 16543 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.266 COC1=CC=CC([C@@H](C)O)=C1 15587 [0,1,0,0,0,0|1,0,0]=2 216 B11R1.266 COC1=CC=CC([C@H](C)N)=C1 24749 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.266 COC1=CN=CC(B(O)O)=C1 29500 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.266 COC1=NC=CC(B(O)O)=C1 17079 [0,1,0,0,0,0|3,0,0]=4 219 B11R1.266 COC1=NC=CC(C(=O)O)=C1 9293 [0,1,0,0,0,0|3,0,0]=4 220 B11R1.266 CSC1=CC([N+](=O)[O-])=CC=C1 8316 [0,1,0,0,0,0|2,1,0]=4 221 B11R1.266 CSC1=CC=CC(B(O)O)=C1 1789 [0,1,0,0,0,0|2,1,0]=4 222 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 10679 [0,1,0,0,0,0|2,1,0]=4 223 B11R1.266 CSC1=CC=CC(C(=O)O)=C1 20970 [0,1,0,0,0,0|2,1,0]=4 224 B11R1.266 CSc1cccc(B(O)O)c1 7887 [0,1,0,0,0,0|2,1,0]=4 225 B11R1.266 C[C@H](N)C1=CC=CC(C#N)=C1 23001 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.267 CCC1=CC=CC(CC)=C1Br 33409 [0,1,0,0,0,0|2,0,0]=3 227 B11R1.267 COC1=C(C)C(CCl)=NC=C1 22658 [0,1,0,0,0,0|3,0,0]=4 228 B11R1.267 COC1=CC=CC(C#N)=C1F 4782 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.267 COC1=CC=CC(C#N)=C1I 33270 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.267 COC1=CC=CC(C#N)=C1N 19797 [0,1,0,0,0,0|2,0,0]=3 231 B11R1.267 COC1=CC=CC(C#N)=C1O 19922 [0,1,0,0,0,0|2,0,0]=3 232 B11R1.267 COC1=CC=CC(C=O)=C1F 4224 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.267 COC1=CC=CC(CO)=C1F 16855 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.267 COC1=CC=CC(CO)=C1O 10255 [0,1,0,0,0,0|2,0,0]=3 235 B11R1.267 COC1=CC=CC(OC)=C1Br 25397 [0,1,0,0,0,0|0,0,0]=1 236 B11R1.267 COC1=CC=CC(OC)=C1C 4545 [0,1,0,0,0,0|0,0,0]=1 237 B11R1.267 COC1=CC=CC(OC)=C1Cl 4405 [0,1,0,0,0,0|0,0,0]=1 238 B11R1.267 COC1=CC=CC(OC)=C1N 4419 [0,1,0,0,0,0|0,0,0]=1 239 B11R1.267 COC1=CC=CC(OC)=C1O 10985 [0,1,0,0,0,0|0,0,0]=1 240 B11R1.267 COC1=CN=CC(OC)=C1N 34187 [0,1,0,0,0,0|1,0,0]=2 241 B11R1.267 COC1=NC=CC(C#N)=C1F 34654 [0,1,0,0,0,0|3,0,0]=4 242 B11R1.267 COC1=NC=CC(C=O)=C1Cl 17167 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.267 COc1cccc(C=O)c1C 30950 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.267 COc1ccnc(CO)c1C 21118 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.280 CCC1=C(Cl)C=CC(OC)=C1 5282 [0,1,0,0,0,0|1,0,0]=2 246 B11R1.280 CCC1=C(F)C=CC(C#N)=C1 28744 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 16098 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 21039 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.280 CCC1=C(O)C=CC(C=O)=C1 28101 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.280 CCC1=CC(OC)=C(Cl)C=C1 5280 [0,1,0,0,0,0|1,0,0]=2 251 B11R1.280 CNC1=NC(OC)=CC=C1N 15372 [0,1,0,0,0,0|2,0,0]=3 252 B11R1.280 CNC1=NC(OC)=CC=C1N 9606 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.280 COC1=C(Br)C=CC(C#N)=C1 28722 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.280 COC1=C(Br)C=CC(C=O)=C1 30968 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.280 COC1=C(Br)C=CC(CO)=C1 31324 [0,1,0,0,0,0|2,0,0]=3 256 B11R1.280 COC1=C(C)C=CC(C#N)=C1 28758 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.280 COC1=C(C)C=CC(C=O)=C1 2646 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 18681 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 30916 [0,1,0,0,0,0|2,0,0]=3 260 B11R1.280 COC1=C(F)C=CC(C#N)=C1 3501 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.280 COC1=C(F)C=CC(C=O)=C1 1449 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.280 COC1=C(F)C=CC(CBr)=C1 27471 [0,1,0,0,0,0|2,0,0]=3 263 B11R1.280 COC1=C(F)C=CC(CN)=C1 27537 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.280 COC1=C(F)C=CC(CO)=C1 7734 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.280 COC1=C(O)C=CC(C#N)=C1 13112 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.280 COC1=C(O)C=CC(C=O)=C1 25440 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.280 COC1=C(O)C=CC(CN)=C1 7385 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.280 COC1=CC(C#N)=C(Br)C=C1 26687 [0,1,0,0,0,0|2,0,0]=3 269 B11R1.280 COC1=CC(C#N)=C(Cl)C=C1 28121 [0,1,0,0,0,0|2,0,0]=3 270 B11R1.280 COC1=CC(C#N)=C(F)C=C1 3500 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.280 COC1=CC(C#N)=C(N)C=C1 25963 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.280 COC1=CC(C#N)=C(O)C=C1 30775 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.280 COC1=CC(C=O)=C(Br)C=C1 2642 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.280 COC1=CC(C=O)=C(C)C=C1 28421 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.280 COC1=CC(C=O)=C(Cl)C=C1 27588 [0,1,0,0,0,0|2,0,0]=3 276 B11R1.280 COC1=CC(C=O)=C(F)C=C1 2634 [0,1,0,0,0,0|2,0,0]=3 277 B11R1.280 COC1=CC(C=O)=C(O)C=C1 2649 [0,1,0,0,0,0|2,0,0]=3 278 B11R1.280 COC1=CC(CBr)=C(Br)C=C1 18176 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.280 COC1=CC(CBr)=C(F)C=C1 31343 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.280 COC1=CC(CO)=C(F)C=C1 3503 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.280 COC1=CC(NN)=C(F)C=C1 1086 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.280 COC1=CC(OC)=C(Br)C=C1 3036 [0,1,0,0,0,0|0,0,0]=1 283 B11R1.280 COC1=CC(OC)=C(Cl)C=C1 3041 [0,1,0,0,0,0|0,0,0]=1 284 B11R1.280 COC1=CC(OC)=C(F)C=C1 28466 [0,1,0,0,0,0|0,0,0]=1 285 B11R1.280 COC1=CC(OC)=C(I)C=C1 3053 [0,1,0,0,0,0|0,0,0]=1 286 B11R1.280 COC1=CC(OC)=C(N)C=C1 16639 [0,1,0,0,0,0|0,0,0]=1 287 B11R1.280 COC1=CC(OC)=C(S)C=C1 6882 [0,1,0,0,0,0|0,0,0]=1 288 B11R1.280 COC1=NC=C(Br)C(OC)=N1 5281 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.280 COC1=NC=C(F)C(C=O)=C1 15265 [0,1,0,0,0,0|3,0,0]=4 290 B11R1.280 COC1=NC=C(F)C(C=O)=C1 17143 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.280 COC1=NC=C(I)C(OC)=N1 6914 [0,1,0,0,0,0|2,0,0]=3 292 B11R2.190 C=CC1=CC=C2CCC2=C1 35204 [0,0,0,1,0,0|2,0,1]=4 293 B9R1.14 COC1=C(C=O)OC=C1 31930 [0,0,0,0,1,0|3,0,0]=4 294 B9R1.14 COC1=C(C=O)SC=C1 35392 [0,0,0,0,1,0|3,0,0]=4 295 B9R1.14 COC1=CSC=C1OC 15752 [0,0,0,0,1,0|1,0,0]=2 296 B9R1.21 COC1C=CC(OC)O1 6933 [0,0,0,0,1,0|1,0,2]=4 297 B8R1.2 BrCC1=CC=CC=C1 13143 [2,0,0,0,0,0|2,0,0]=4 298 B8R1.2 C#CC1=CC=CC=C1 15340 [2,0,0,0,0,0|1,0,1]=4 299 B8R1.2 CNC1=CC=CN=C1 14983 [2,0,0,0,0,0|2,0,0]=4 300 B8R1.2 CNC1=CC=NC=C1 12915 [2,0,0,0,0,0|2,0,0]=4 301 B8R1.2 COC1=CC=CC=C1 12830 [2,0,0,0,0,0|0,0,0]=2 302 B8R1.2 COC1=CC=CC=C1 17272 [2,0,0,0,0,0|0,0,0]=2 303 B8R1.2 COC1=CC=CN=C1 15370 [2,0,0,0,0,0|1,0,0]=3 304 B8R1.2 COC1=CC=NC=C1 2585 [2,0,0,0,0,0|1,0,0]=3 305 B8R1.2 COC1=CN=CN=C1 25073 [2,0,0,0,0,0|2,0,0]=4 306 B8R1.2 COC1=NC=CC=C1 13201 [2,0,0,0,0,0|1,0,0]=3 307 B8R1.2 COC1=NC=CN=C1 8605 [2,0,0,0,0,0|2,0,0]=4 308 B8R1.2 COC1=NC=NC=C1 21029 [2,0,0,0,0,0|2,0,0]=4 309 B8R1.2 CSC1=CC=CC=C1 10578 [2,0,0,0,0,0|0,1,0]=3 310 B8R1.2 CSC1=NC=CC=C1 35938 [2,0,0,0,0,0|1,1,0]=4 311 B8R1.2 N#Cc1ccccc1 25507 [2,0,0,0,0,0|2,0,0]=4 312 B8R1.2 NCC1=CC=CC=C1 25530 [2,0,0,0,0,0|2,0,0]=4 313 B8R1.2 NNC1=CC=CC=C1 22925 [2,0,0,0,0,0|2,0,0]=4 314 B8R1.2 SCC1=CC=CC=C1 6835 [2,0,0,0,0,0|2,0,0]=4 315 B8R1.4 BrC1=CC(I)=CC=C1 3785 [2,0,0,0,0,0|2,0,0]=4 316 B8R1.4 BrC1=CC=CC(Br)=C1 3855 [2,0,0,0,0,0|2,0,0]=4 317 B8R1.4 CC1=CC(Br)=CC=C1 3836 [2,0,0,0,0,0|1,0,0]=3 318 B8R1.4 CC1=CC(Br)=NC=C1 1184 [2,0,0,0,0,0|2,0,0]=4 319 B8R1.4 CC1=CC(C)=NC=C1 20508 [2,0,0,0,0,0|1,0,0]=3 320 B8R1.4 CC1=CC(C)=NC=N1 21498 [2,0,0,0,0,0|2,0,0]=4 321 B8R1.4 CC1=CC(Cl)=CC=C1 3678 [2,0,0,0,0,0|1,0,0]=3 322 B8R1.4 CC1=CC(Cl)=NC=C1 1192 [2,0,0,0,0,0|2,0,0]=4 323 B8R1.4 CC1=CC(F)=NC=C1 1203 [2,0,0,0,0,0|2,0,0]=4 324 B8R1.4 CC1=CC(I)=CC=C1 12585 [2,0,0,0,0,0|1,0,0]=3 325 B8R1.4 CC1=CC(I)=NC=C1 13513 [2,0,0,0,0,0|2,0,0]=4 326 B8R1.4 CC1=CC(N)=NC=C1 2238 [2,0,0,0,0,0|2,0,0]=4 327 B8R1.4 CC1=CC(O)=NC=C1 1206 [2,0,0,0,0,0|1,0,0]=3 328 B8R1.4 CC1=CC(O)=NC=N1 11013 [2,0,0,0,0,0|2,0,0]=4 329 B8R1.4 CC1=CC=CC(Br)=N1 1139 [2,0,0,0,0,0|2,0,0]=4 330 B8R1.4 CC1=CC=CC(C)=N1 14295 [2,0,0,0,0,0|1,0,0]=3 331 B8R1.4 CC1=CC=CC(C)=N1 15897 [2,0,0,0,0,0|1,0,0]=3 332 B8R1.4 CC1=CC=CC(Cl)=N1 1194 [2,0,0,0,0,0|2,0,0]=4 333 B8R1.4 CC1=CC=CC(F)=C1 24460 [2,0,0,0,0,0|1,0,0]=3 334 B8R1.4 CC1=CC=CC(F)=N1 6443 [2,0,0,0,0,0|2,0,0]=4 335 B8R1.4 CC1=CC=CC(I)=N1 34165 [2,0,0,0,0,0|2,0,0]=4 336 B8R1.4 CC1=CC=CC(N)=N1 5922 [2,0,0,0,0,0|2,0,0]=4 337 B8R1.4 CC1=CC=CC(O)=N1 1114 [2,0,0,0,0,0|1,0,0]=3 338 B8R1.4 CC1=CC=CC(S)=C1 6808 [2,0,0,0,0,0|0,1,0]=3 339 B8R1.4 CC1=CC=C[N+]([O-])=C1 25351 [2,0,0,0,0,0|1,0,1]=4 340 B8R1.4 CC1=CN=CC(Br)=C1 4036 [2,0,0,0,0,0|2,0,0]=4 341 B8R1.4 CC1=CN=CC(C)=N1 8609 [2,0,0,0,0,0|2,0,0]=4 342 B8R1.4 CC1=CN=CC(F)=C1 10630 [2,0,0,0,0,0|2,0,0]=4 343 B8R1.4 CC1=CN=CC(N)=C1 1279 [2,0,0,0,0,0|2,0,0]=4 344 B8R1.4 CC1=CN=CC(N)=C1 9634 [2,0,0,0,0,0|2,0,0]=4 345 B8R1.4 CC1=CN=CC(O)=C1 6629 [2,0,0,0,0,0|1,0,0]=3 346 B8R1.4 CC1=NC(O)=NC=C1 22005 [2,0,0,0,0,0|2,0,0]=4 347 B8R1.4 CC1=NC=CC(Br)=C1 4035 [2,0,0,0,0,0|2,0,0]=4 348 B8R1.4 CC1=NC=CC(Cl)=C1 2071 [2,0,0,0,0,0|2,0,0]=4 349 B8R1.4 CC1=NC=CC(F)=C1 21038 [2,0,0,0,0,0|2,0,0]=4 350 B8R1.4 CC1=NC=CC(N)=C1 1118 [2,0,0,0,0,0|2,0,0]=4 351 B8R1.4 CC1=NC=CC(O)=C1 17657 [2,0,0,0,0,0|1,0,0]=3 352 B8R1.4 ClC1=CC(I)=CC=C1 3647 [2,0,0,0,0,0|2,0,0]=4 353 B8R1.4 ClC1=CC=CC(Br)=C1 3583 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.4 ClC1=CC=CC(Cl)=C1 13088 [2,0,0,0,0,0|2,0,0]=4 355 B8R1.4 FC1=CC(I)=CC=C1 3497 [2,0,0,0,0,0|2,0,0]=4 356 B8R1.4 FC1=CC=CC(Br)=C1 2300 [2,0,0,0,0,0|2,0,0]=4 357 B8R1.4 FC1=CC=CC(Cl)=C1 3419 [2,0,0,0,0,0|2,0,0]=4 358 B8R1.4 FC1=CC=CC(F)=C1 2308 [2,0,0,0,0,0|2,0,0]=4 359 B8R1.4 FC1=CC=CC(S)=C1 5429 [2,0,0,0,0,0|1,1,0]=4 360 B8R1.4 IC1=CC=CC(I)=C1 3833 [2,0,0,0,0,0|2,0,0]=4 361 B8R1.4 NC1=CC(Br)=CC=C1 3723 [2,0,0,0,0,0|2,0,0]=4 362 B8R1.4 NC1=CC(Cl)=CC=C1 20239 [2,0,0,0,0,0|2,0,0]=4 363 B8R1.4 NC1=CC(F)=CC=C1 10751 [2,0,0,0,0,0|2,0,0]=4 364 B8R1.4 NC1=CC(F)=CC=C1 13943 [2,0,0,0,0,0|2,0,0]=4 365 B8R1.4 NC1=CC(I)=CC=C1 10577 [2,0,0,0,0,0|2,0,0]=4 366 B8R1.4 NC1=CC(O)=NC=C1 6648 [2,0,0,0,0,0|2,0,0]=4 367 B8R1.4 NC1=CC=CC(O)=C1 18119 [2,0,0,0,0,0|1,0,0]=3 368 B8R1.4 NC1=CC=CC(O)=N1 25861 [2,0,0,0,0,0|2,0,0]=4 369 B8R1.4 NC1=CC=CC(S)=C1 2470 [2,0,0,0,0,0|1,1,0]=4 370 B8R1.4 NC1=CN=CC(O)=C1 6627 [2,0,0,0,0,0|2,0,0]=4 371 B8R1.4 NC1=NC=CC(O)=C1 6677 [2,0,0,0,0,0|2,0,0]=4 372 B8R1.4 OC1=CC(Br)=CC=C1 3824 [2,0,0,0,0,0|1,0,0]=3 373 B8R1.4 OC1=CC(Br)=CN=C1 9214 [2,0,0,0,0,0|2,0,0]=4 374 B8R1.4 OC1=CC(Br)=NC=C1 23393 [2,0,0,0,0,0|2,0,0]=4 375 B8R1.4 OC1=CC(Cl)=CC=C1 3677 [2,0,0,0,0,0|1,0,0]=3 376 B8R1.4 OC1=CC(Cl)=CN=C1 6628 [2,0,0,0,0,0|2,0,0]=4 377 B8R1.4 OC1=CC(Cl)=NC=C1 2578 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.4 OC1=CC(F)=CC=C1 3884 [2,0,0,0,0,0|1,0,0]=3 379 B8R1.4 OC1=CC(I)=CC=C1 3968 [2,0,0,0,0,0|1,0,0]=3 380 B8R1.4 OC1=CC(I)=CN=C1 27396 [2,0,0,0,0,0|2,0,0]=4 381 B8R1.4 OC1=CC(O)=NC=C1 5487 [2,0,0,0,0,0|1,0,0]=3 382 B8R1.4 OC1=CC(O)=NC=N1 7102 [2,0,0,0,0,0|2,0,0]=4 383 B8R1.4 OC1=CC=CC(Br)=N1 15211 [2,0,0,0,0,0|2,0,0]=4 384 B8R1.4 OC1=CC=CC(Cl)=N1 12988 [2,0,0,0,0,0|2,0,0]=4 385 B8R1.4 OC1=CC=CC(O)=C1 22214 [2,0,0,0,0,0|0,0,0]=2 386 B8R1.4 OC1=CC=CC(O)=N1 17666 [2,0,0,0,0,0|1,0,0]=3 387 B8R1.4 OC1=CC=CC(S)=C1 6829 [2,0,0,0,0,0|0,1,0]=3 388 B8R1.4 OC1=CN=CC(F)=C1 6625 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.4 OC1=CN=CC(O)=C1 27828 [2,0,0,0,0,0|1,0,0]=3 390 B8R1.4 OC1=NC=CC(Br)=C1 6560 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.4 OC1=NC=CC(Cl)=C1 9621 [2,0,0,0,0,0|2,0,0]=4 392 B8R1.4 OC1=NC=CC(I)=C1 27672 [2,0,0,0,0,0|2,0,0]=4 393 B8R1.4 SC1=CC(Br)=CC=C1 6805 [2,0,0,0,0,0|1,1,0]=4 394 B8R1.4 SC1=CC(Cl)=CC=C1 6785 [2,0,0,0,0,0|1,1,0]=4 395 B10R1.2 CC1=C(C=O)C=CC=C1O 30949 [1,1,0,0,0,0|2,0,0]=4 396 B10R1.2 CC1=CC=CC(C#N)=C1Br 26070 [1,1,0,0,0,0|2,0,0]=4 397 B10R1.2 CC1=CC=CC(C#N)=C1C 8125 [1,1,0,0,0,0|2,0,0]=4 398 B10R1.2 CC1=CC=CC(C#N)=C1Cl 4731 [1,1,0,0,0,0|2,0,0]=4 399 B10R1.2 CC1=CC=CC(C#N)=C1F 4788 [1,1,0,0,0,0|2,0,0]=4 400 B10R1.2 CC1=CC=CC(C#N)=C1N 27566 [1,1,0,0,0,0|2,0,0]=4 401 B10R1.2 CC1=CC=CC(C=O)=C1Br 30978 [1,1,0,0,0,0|2,0,0]=4 402 B10R1.2 CC1=CC=CC(C=O)=C1C 3080 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.2 CC1=CC=CC(C=O)=C1Cl 28398 [1,1,0,0,0,0|2,0,0]=4 404 B10R1.2 CC1=CC=CC(C=O)=C1F 1450 [1,1,0,0,0,0|2,0,0]=4 405 B10R1.2 CC1=CC=CC(C=O)=C1O 14264 [1,1,0,0,0,0|2,0,0]=4 406 B10R1.2 CC1=CC=CC(CBr)=C1Br 31378 [1,1,0,0,0,0|2,0,0]=4 407 B10R1.2 CC1=CC=CC(CBr)=C1C 27463 [1,1,0,0,0,0|2,0,0]=4 408 B10R1.2 CC1=CC=CC(CN)=C1Cl 31260 [1,1,0,0,0,0|2,0,0]=4 409 B10R1.2 CC1=CC=CC(CN)=C1F 31262 [1,1,0,0,0,0|2,0,0]=4 410 B10R1.2 CC1=CC=CC(CO)=C1Br 31377 [1,1,0,0,0,0|2,0,0]=4 411 B10R1.2 CC1=CC=CC(NN)=C1C 6398 [1,1,0,0,0,0|2,0,0]=4 412 B10R1.2 CCC1=C(O)C(O)=CC=C1 33193 [1,1,0,0,0,0|1,0,0]=3 413 B10R1.2 CCC1=CC=CC(Br)=C1O 33831 [1,1,0,0,0,0|2,0,0]=4 414 B10R1.2 CCC1=CC=CC(Cl)=C1N 34625 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.2 CCC1=CC=CC(Cl)=C1O 27841 [1,1,0,0,0,0|2,0,0]=4 416 B10R1.2 CCC1=CC=CC(O)=C1F 27791 [1,1,0,0,0,0|1,0,0]=3 417 B10R1.2 COC1=C(Br)C(Br)=CC=C1 31145 [1,1,0,0,0,0|1,0,0]=3 418 B10R1.2 COC1=C(Br)C(C)=CC=C1 31146 [1,1,0,0,0,0|0,0,0]=2 419 B10R1.2 COC1=C(Br)C(F)=CC=C1 4125 [1,1,0,0,0,0|1,0,0]=3 420 B10R1.2 COC1=C(C)C(Br)=CC=C1 31165 [1,1,0,0,0,0|1,0,0]=3 421 B10R1.2 COC1=C(C)C(C)=CC=C1 4114 [1,1,0,0,0,0|0,0,0]=2 422 B10R1.2 COC1=C(C)C(Cl)=CC=C1 2664 [1,1,0,0,0,0|1,0,0]=3 423 B10R1.2 COC1=C(Cl)C(Br)=CC=C1 31152 [1,1,0,0,0,0|1,0,0]=3 424 B10R1.2 COC1=C(Cl)C(Cl)=CC=C1 3680 [1,1,0,0,0,0|1,0,0]=3 425 B10R1.2 COC1=C(Cl)C(F)=CC=C1 31158 [1,1,0,0,0,0|1,0,0]=3 426 B10R1.2 COC1=C(F)C(Br)=CC=C1 4127 [1,1,0,0,0,0|1,0,0]=3 427 B10R1.2 COC1=C(F)C(Cl)=CC=C1 31153 [1,1,0,0,0,0|1,0,0]=3 428 B10R1.2 COC1=C(F)C(Cl)=CC=C1 8445 [1,1,0,0,0,0|1,0,0]=3 429 B10R1.2 COC1=C(I)C(F)=CC=C1 4119 [1,1,0,0,0,0|1,0,0]=3 430 B10R1.2 COC1=C(I)C(N)=CC=C1 28346 [1,1,0,0,0,0|1,0,0]=3 431 B10R1.2 COC1=C(I)C(N)=NC=C1 26695 [1,1,0,0,0,0|2,0,0]=4 432 B10R1.2 COC1=CC=CC(Br)=C1N 31031 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.2 COC1=CC=CC(Br)=C1O 33838 [1,1,0,0,0,0|1,0,0]=3 434 B10R1.2 COC1=CC=CC(Cl)=C1N 31032 [1,1,0,0,0,0|1,0,0]=3 435 B10R1.2 COC1=CC=CC(Cl)=C1O 28111 [1,1,0,0,0,0|1,0,0]=3 436 B10R1.2 COC1=CC=CC(F)=C1F 1969 [1,1,0,0,0,0|1,0,0]=3 437 B10R1.2 COC1=CC=CC(F)=C1N 8485 [1,1,0,0,0,0|1,0,0]=3 438 B10R1.2 COC1=CC=CC(F)=C1O 3878 [1,1,0,0,0,0|1,0,0]=3 439 B10R1.2 COC1=CC=CC(I)=C1Br 27634 [1,1,0,0,0,0|1,0,0]=3 440 B10R1.2 COC1=CC=CC(I)=C1C 33420 [1,1,0,0,0,0|1,0,0]=3 441 B10R1.2 COC1=CC=CC(N)=C1Br 15644 [1,1,0,0,0,0|1,0,0]=3 442 B10R1.2 COC1=CC=CC(N)=C1C 15040 [1,1,0,0,0,0|1,0,0]=3 443 B10R1.2 COC1=CC=CC(N)=C1C 19248 [1,1,0,0,0,0|1,0,0]=3 444 B10R1.2 COC1=CC=CC(N)=C1Cl 19249 [1,1,0,0,0,0|1,0,0]=3 445 B10R1.2 COC1=CC=CC(N)=C1Cl 19250 [1,1,0,0,0,0|1,0,0]=3 446 B10R1.2 COC1=CC=CC(N)=C1F 15807 [1,1,0,0,0,0|1,0,0]=3 447 B10R1.2 COC1=CC=CC(N)=C1O 33268 [1,1,0,0,0,0|1,0,0]=3 448 B10R1.2 COC1=CC=CC(O)=C1Br 34186 [1,1,0,0,0,0|0,0,0]=2 449 B10R1.2 COC1=CC=CC(O)=C1Cl 33442 [1,1,0,0,0,0|0,0,0]=2 450 B10R1.2 COC1=CC=CC(O)=C1F 27943 [1,1,0,0,0,0|0,0,0]=2 451 B10R1.2 COC1=NC=CC(C)=C1Br 6583 [1,1,0,0,0,0|1,0,0]=3 452 B10R1.2 COC1=NC=CC(C)=C1N 6582 [1,1,0,0,0,0|1,0,0]=3 453 B10R1.2 COc1ccc[n+]([O-])c1Br 5949 [1,1,0,0,0,0|1,0,1]=4 454 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 10673 [1,1,0,0,0,0|1,1,0]=4 455 B10R1.2 N#CC1=C(Br)C(O)=CC=C1 23204 [1,1,0,0,0,0|2,0,0]=4 456 B10R1.2 N#CC1=C(F)C(O)=CC=C1 4775 [1,1,0,0,0,0|2,0,0]=4 457 B10R1.2 N#CC1=C(O)C(O)=CC=C1 28105 [1,1,0,0,0,0|2,0,0]=4 458 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 20855 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.2 O=CC1=C(F)C(O)=CC=C1 27364 [1,1,0,0,0,0|2,0,0]=4 460 B10R1.2 O=CC1=C(O)C(O)=CC=C1 6561 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.8 CC1=CC(C#N)=CC(Br)=C1 28723 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.8 CC1=CC(C#N)=CC(Cl)=C1 30784 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.8 CC1=CC(C#N)=CC(F)=C1 8336 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.8 CC1=CC(C#N)=CC(I)=C1 28754 [1,1,0,0,0,0|2,0,0]=4 465 B10R1.8 CC1=CC(C#N)=CC(O)=C1 27390 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.8 CC1=CC(C)=CC(C#N)=C1 12528 [1,1,0,0,0,0|2,0,0]=4 467 B10R1.8 CC1=CC(C)=CC(C=O)=C1 15515 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.8 CC1=CC(C)=CC(CBr)=C1 9979 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.8 CC1=CC(C)=CC(NN)=C1 6407 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.8 CC1=CC(C=O)=CC(Br)=C1 16400 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.8 CC1=CC(C=O)=CC(Cl)=C1 17203 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.8 CC1=CC(C=O)=CC(F)=C1 1455 [1,1,0,0,0,0|2,0,0]=4 473 B10R1.8 CC1=CC(C=O)=CC(O)=C1 28118 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.8 CC1=CC(CBr)=CC(Br)=C1 31367 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.8 CC1=CC(CO)=CC(N)=C1 28795 [1,1,0,0,0,0|2,0,0]=4 476 B10R1.8 CCC1=CC(F)=CC(F)=C1 26498 [1,1,0,0,0,0|2,0,0]=4 477 B10R1.8 CNC1=CC(C)=NC(C)=C1 26354 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.8 COC1=CC(Br)=CC(Br)=C1 2009 [1,1,0,0,0,0|1,0,0]=3 479 B10R1.8 COC1=CC(Br)=CC(Cl)=C1 22130 [1,1,0,0,0,0|1,0,0]=3 480 B10R1.8 COC1=CC(Br)=CC(F)=C1 31138 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.8 COC1=CC(Br)=CC(F)=C1 4128 [1,1,0,0,0,0|1,0,0]=3 482 B10R1.8 COC1=CC(C)=CC(Br)=C1 16436 [1,1,0,0,0,0|0,0,0]=2 483 B10R1.8 COC1=CC(C)=CC(C)=C1 28380 [1,1,0,0,0,0|0,0,0]=2 484 B10R1.8 COC1=CC(C)=CC(Cl)=C1 34222 [1,1,0,0,0,0|0,0,0]=2 485 B10R1.8 COC1=CC(C)=CC(N)=C1 31028 [1,1,0,0,0,0|0,0,0]=2 486 B10R1.8 COC1=CC(C)=NC(N)=N1 21464 [1,1,0,0,0,0|2,0,0]=4 487 B10R1.8 COC1=CC(Cl)=CC(Cl)=C1 3684 [1,1,0,0,0,0|1,0,0]=3 488 B10R1.8 COC1=CC(Cl)=CC(Cl)=N1 32328 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.8 COC1=CC(Cl)=CC(F)=C1 2661 [1,1,0,0,0,0|1,0,0]=3 490 B10R1.8 COC1=CC(Cl)=NC(C)=N1 29065 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.8 COC1=CC(F)=CC(F)=C1 1967 [1,1,0,0,0,0|1,0,0]=3 492 B10R1.8 COC1=CC(F)=NC(F)=C1 29420 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.8 COC1=CC(I)=CC(F)=N1 32977 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.8 COC1=CC(N)=CC(Br)=C1 31040 [1,1,0,0,0,0|1,0,0]=3 495 B10R1.8 COC1=CC(N)=CC(Cl)=C1 31015 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.8 COC1=CC(N)=CC(F)=C1 31082 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.8 COC1=CC(O)=CC(Br)=C1 23048 [1,1,0,0,0,0|0,0,0]=2 498 B10R1.8 COC1=CC(O)=CC(Cl)=C1 16948 [1,1,0,0,0,0|0,0,0]=2 499 B10R1.8 COC1=CC(O)=CC(F)=C1 31095 [1,1,0,0,0,0|0,0,0]=2 500 B10R1.8 COC1=CC(O)=NC(O)=N1 30328 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.8 COC1=NC(C)=CC(C)=N1 21469 [1,1,0,0,0,0|2,0,0]=4 502 B10R1.8 COC1=NC(Cl)=NC(C)=C1 33773 [1,1,0,0,0,0|2,0,0]=4 503 B10R1.8 COC1=NC(O)=CC(O)=N1 30330 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.8 CSC1=CC(Br)=CC(F)=C1 27650 [1,1,0,0,0,0|1,1,0]=4 505 B10R1.8 CSC1=CC(Cl)=CC(Cl)=C1 10647 [1,1,0,0,0,0|1,1,0]=4 506 B10R1.8 CSC1=CC(O)=CC(Br)=C1 28076 [1,1,0,0,0,0|0,1,0]=3 507 B10R1.8 Cc1cc(Br)cc(CO)c1 31366 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.8 Cc1cc(C)cc(CN)c1 7407 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.8 N#CC1=CC(Br)=CC(O)=C1 33702 [1,1,0,0,0,0|2,0,0]=4 510 B10R1.8 N#CC1=CC(Cl)=CC(O)=C1 18502 [1,1,0,0,0,0|2,0,0]=4 511 B10R1.8 N#CC1=CC(F)=CC(O)=C1 30786 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.8 N#CC1=CC(O)=CC(O)=C1 13116 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.8 O=CC1=CC(Br)=CC(O)=C1 30932 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.8 O=CC1=CC(Cl)=CC(O)=C1 30901 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.8 O=CC1=CC(F)=CC(O)=C1 28128 [1,1,0,0,0,0|2,0,0]=4 516 B10R1.8 O=CC1=CC(O)=CC(O)=C1 8249 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.8 OCC1=CC(O)=CC(O)=C1 7418 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.10 CC1=CC=CC(CCO)=N1 25853 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.10 CCOC1=CC(Br)=CC=C1 3137 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.10 CCOC1=CC(Br)=CN=C1 14409 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.10 CCOC1=CC(C)=CC=C1 3180 [1,1,0,0,0,0|0,0,0]=2 522 B10R1.10 CCOC1=CC(Cl)=CC=C1 3162 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.10 CCOC1=CC(F)=CC=C1 3174 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.10 CCOC1=CC(F)=NC=C1 6672 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.10 CCOC1=CC(I)=CC=C1 3241 [1,1,0,0,0,0|1,0,0]=3 526 B10R1.10 CCOC1=CC(N)=CC=C1 9507 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.10 CCOC1=CC(N)=NC=C1 5698 [1,1,0,0,0,0|2,0,0]=4 528 B10R1.10 CCOC1=CC=CC(Br)=N1 5971 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.10 CCOC1=CC=CC(O)=C1 9510 [1,1,0,0,0,0|0,0,0]=2 530 B10R1.10 CCOC1=CC=CC(S)=C1 6826 [1,1,0,0,0,0|0,1,0]=3 531 B10R1.10 CCOC1=CN=CC(Cl)=C1 6619 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.10 CCOC1=NC=CC(Br)=C1 22048 [1,1,0,0,0,0|2,0,0]=4 533 B10R1.10 CCOC1=NC=CC(Cl)=C1 22039 [1,1,0,0,0,0|2,0,0]=4 534 B10R1.10 CCOC1=NC=CC(N)=C1 6647 [1,1,0,0,0,0|2,0,0]=4 535 B10R1.10 CCOC1=NC=NC(C)=C1 21485 [1,1,0,0,0,0|2,0,0]=4 536 B10R1.10 CNCC1=CC(Br)=CC=C1 23425 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.10 COCC1=CC=CC(F)=C1 24279 [1,1,0,0,0,0|1,0,0]=3 538 B10R1.10 COCC1=CN=CC(Br)=C1 22088 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.10 FC1=CC=CC(CCBr)=C1 4671 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.10 NC1=CC=CC(CCO)=C1 27351 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.10 NCCC1=CC(Br)=CC=C1 17194 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.10 NCCC1=CC(Br)=CC=C1 23432 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.10 NCCC1=CC(F)=CC=C1 13958 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.10 NCCC1=CC(N)=CC=C1 5799 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.10 NCCC1=CC(O)=CC=C1 21937 [1,1,0,0,0,0|1,0,0]=3 546 B10R1.10 NCCC1=CC=CC(N)=C1 11375 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.10 NNCC1=CC(O)=CC=C1 14770 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.10 OC1=CC(\C=C\Br)=CC=C1 31891 [1,1,0,0,0,0|1,0,1]=4 549 B10R1.10 OCCC1=CC(Br)=CC=C1 14821 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.10 OCCC1=CC(F)=CC=C1 28824 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.30 CC1=C(C#N)C=C(O)C=C1 33444 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.30 CC1=C(C=O)C=C(O)C=C1 30957 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.30 CC1=CC(C#N)=C(Br)C=C1 14563 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.30 CC1=CC(C#N)=C(Cl)C=C1 14562 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.30 CC1=CC(C#N)=C(F)C=C1 1552 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.30 CC1=CC(C#N)=C(N)C=C1 17447 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.30 CC1=CC(C#N)=C(O)C=C1 27632 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 16748 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.30 CC1=CC(C=O)=C(F)C=C1 1452 [1,1,0,0,0,0|2,0,0]=4 560 B10R1.30 CC1=CC(CBr)=C(C)C=C1 31376 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.30 CC1=CC(CN)=C(C)C=C1 7405 [1,1,0,0,0,0|2,0,0]=4 562 B10R1.30 CC1=CC(NN)=C(C)C=C1 6400 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.30 CC1=CC=C(O)C(C=O)=C1 15680 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 2213 [1,1,0,0,0,0|1,0,0]=3 565 B10R1.30 CCC1=C(F)C=CC(O)=C1 27790 [1,1,0,0,0,0|1,0,0]=3 566 B10R1.30 CCC1=C(I)C=CC(Br)=C1 3773 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.30 CCC1=C(N)C=CC(Br)=C1 23174 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.30 CCC1=C(N)C=CC(Br)=C1 3769 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.30 CCC1=NC(C)=CC=C1O 35102 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.30 CNC1=C(O)C=CC(N)=C1 20872 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.30 CNC1=CC(Br)=CC=C1N 18337 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.30 COC1=C(Br)C=CC(Br)=C1 5357 [1,1,0,0,0,0|1,0,0]=3 573 B10R1.30 COC1=C(Br)C=CC(C)=C1 4136 [1,1,0,0,0,0|0,0,0]=2 574 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 5265 [1,1,0,0,0,0|1,0,0]=3 575 B10R1.30 COC1=C(Br)C=CC(F)=C1 4091 [1,1,0,0,0,0|1,0,0]=3 576 B10R1.30 COC1=C(Br)C=CC(I)=C1 5333 [1,1,0,0,0,0|1,0,0]=3 577 B10R1.30 COC1=C(Br)C=CC(N)=C1 3794 [1,1,0,0,0,0|1,0,0]=3 578 B10R1.30 COC1=C(Br)C=CC(O)=C1 13260 [1,1,0,0,0,0|0,0,0]=2 579 B10R1.30 COC1=C(C)C=CC(Br)=C1 25292 [1,1,0,0,0,0|1,0,0]=3 580 B10R1.30 COC1=C(C)C=CC(C)=C1 5360 [1,1,0,0,0,0|0,0,0]=2 581 B10R1.30 COC1=C(C)C=CC(Cl)=C1 2667 [1,1,0,0,0,0|1,0,0]=3 582 B10R1.30 COC1=C(C)C=CC(F)=C1 2624 [1,1,0,0,0,0|1,0,0]=3 583 B10R1.30 COC1=C(C)C=CC(N)=C1 3329 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 2632 [1,1,0,0,0,0|1,0,0]=3 585 B10R1.30 COC1=C(Cl)C=CC(C)=C1 5299 [1,1,0,0,0,0|0,0,0]=2 586 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 3681 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.30 COC1=C(Cl)C=CC(F)=C1 2659 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.30 COC1=C(Cl)C=CC(I)=C1 5289 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.30 COC1=C(Cl)C=CC(N)=C1 3659 [1,1,0,0,0,0|1,0,0]=3 590 B10R1.30 COC1=C(Cl)C=CC(O)=C1 28110 [1,1,0,0,0,0|0,0,0]=2 591 B10R1.30 COC1=C(Cl)N=CC(N)=C1 22114 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.30 COC1=C(F)C=CC(Br)=C1 18513 [1,1,0,0,0,0|1,0,0]=3 593 B10R1.30 COC1=C(F)C=CC(C)=C1 8487 [1,1,0,0,0,0|0,0,0]=2 594 B10R1.30 COC1=C(F)C=CC(F)=C1 3456 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.30 COC1=C(F)C=CC(N)=C1 14566 [1,1,0,0,0,0|1,0,0]=3 596 B10R1.30 COC1=C(F)C=CC(N)=C1 3022 [1,1,0,0,0,0|1,0,0]=3 597 B10R1.30 COC1=C(F)C=CC(O)=C1 14358 [1,1,0,0,0,0|0,0,0]=2 598 B10R1.30 COC1=C(I)C=CC(Br)=C1 28357 [1,1,0,0,0,0|1,0,0]=3 599 B10R1.30 COC1=C(I)C=CC(Cl)=C1 5293 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.30 COC1=C(I)C=CC(I)=C1 28130 [1,1,0,0,0,0|1,0,0]=3 601 B10R1.30 COC1=C(I)C=CC(N)=C1 5352 [1,1,0,0,0,0|1,0,0]=3 602 B10R1.30 COC1=C(N)C=CC(Br)=C1 2258 [1,1,0,0,0,0|1,0,0]=3 603 B10R1.30 COC1=C(N)C=CC(F)=C1 28343 [1,1,0,0,0,0|1,0,0]=3 604 B10R1.30 COC1=C(N)C=CC(I)=C1 25591 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.30 COC1=C(N)C=CC(O)=C1 18733 [1,1,0,0,0,0|0,0,0]=2 606 B10R1.30 COC1=C(N)C=CC(O)=C1 26950 [1,1,0,0,0,0|0,0,0]=2 607 B10R1.30 COC1=C(O)C=CC(Br)=C1 17271 [1,1,0,0,0,0|1,0,0]=3 608 B10R1.30 COC1=C(O)C=CC(Cl)=C1 3665 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.30 COC1=C(O)C=CC(F)=C1 3880 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.30 COC1=C(O)C=CC(I)=C1 17587 [1,1,0,0,0,0|1,0,0]=3 611 B10R1.30 COC1=C(O)C=CC(N)=C1 14144 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.30 COC1=C(O)C=CC(N)=C1 33372 [1,1,0,0,0,0|1,0,0]=3 613 B10R1.30 COC1=CC(Br)=CN=C1Cl 35568 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.30 COC1=CC(Br)=CN=C1I 26836 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.30 COC1=CC(Cl)=CN=C1Br 5915 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.30 COC1=CC(I)=CN=C1Br 28124 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.30 COC1=CC(I)=CN=C1I 28122 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.30 COC1=NC(Br)=CC=C1N 21956 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.30 COC1=NC(C)=CC=C1Br 8122 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.30 COC1=NC(C)=CC=C1F 6585 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.30 COC1=NC(C)=CC=C1N 1266 [1,1,0,0,0,0|1,0,0]=3 622 B10R1.30 COC1=NC(C)=NC=C1N 22765 [1,1,0,0,0,0|2,0,0]=4 623 B10R1.30 N#CC1=C(Br)C=CC(O)=C1 9770 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.30 N#CC1=C(Cl)C=CC(O)=C1 28120 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.30 N#CC1=C(F)C=CC(O)=C1 28108 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.30 O=CC1=C(Br)C=CC(O)=C1 14430 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.30 O=CC1=C(Cl)C=CC(O)=C1 30918 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.30 O=CC1=C(F)C=CC(O)=C1 16486 [1,1,0,0,0,0|2,0,0]=4 629 B10R1.30 O=CC1=C(O)C=CC(O)=C1 2285 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 3087 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.113 CC(=O)C1=CC(C)=CC=C1 4279 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.113 CC(=O)C1=CC(C)=CN=C1 26484 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 27309 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 3085 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.113 CC(=O)C1=CC(F)=CC=C1 4232 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.113 CC(=O)C1=CC(I)=CC=C1 3895 [1,1,0,0,0,0|2,0,0]=4 637 B10R1.113 CC(=O)C1=CC(N)=CC=C1 6391 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.113 CC(=O)C1=CC(O)=CC=C1 3284 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.113 CC(=O)C1=NC(C)=CC=C1 9826 [1,1,0,0,0,0|2,0,0]=4 640 B10R1.113 CC(=O)C1=NC=CC(C)=C1 4045 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.113 CC(C)c1cccc(Br)c1 27489 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.113 CC(N)C1=CC(F)=CC=C1 24339 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.113 CC(O)C1=CC(F)=CC=C1 28823 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.113 CC1=CC(B(O)O)=CC=C1 1872 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.113 CC1=CC(C(=O)O)=CC=C1 15435 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 15456 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.113 CC1=CC=CC(C(O)=S)=C1 28685 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.113 CN(C)C1=CC(Br)=CC=C1 3760 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.113 CN(C)C1=CC(Cl)=CC=C1 3637 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.113 CN(C)C1=CC(F)=CC=C1 5244 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.113 CN(C)C1=CC(N)=CC=C1 14991 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.113 CN(C)C1=CC=CC(O)=C1 11072 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.113 C[C@@H](N)C1=CC(Cl)=CC=C1 24741 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.113 C[C@@H](N)C1=CC(F)=CC=C1 24730 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.113 C[C@@H](O)C1=CC(Br)=CC=C1 15565 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 15577 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.113 C[C@@H](O)C1=CC(F)=CC=C1 24771 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 14235 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.113 C[C@H](N)C1=CC(Br)=CC=C1 24746 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.113 C[C@H](N)C1=CC(Cl)=CC=C1 24735 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.113 C[C@H](N)C1=CC(F)=CC=C1 25216 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.113 C[C@H](O)C1=CC(Br)=CC=C1 24772 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.113 C[C@H](O)C1=CC(Cl)=CC=C1 15576 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 24770 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.113 O=C(O)C1=CC(O)=CC=C1 9161 [1,1,0,0,0,0|2,0,0]=4 666 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 17999 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.113 OB(O)C1=CC(O)=CC=C1 1728 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.176 C=CC1=CC(O)=C(O)C=C1 35519 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.176 CC1=C(Br)C=CC(C#N)=C1 3808 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 30935 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 24290 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.176 CC1=C(C)C=C(C#N)C=C1 14892 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.176 CC1=C(C)C=C(C=O)C=C1 2535 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.176 CC1=C(C)C=C(CCl)C=C1 14890 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.176 CC1=C(C)C=C(CN)C=C1 4412 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.176 CC1=C(C)C=C(CO)C=C1 2161 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.176 CC1=C(C)C=C(NN)C=C1 19865 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.176 CC1=C(C)C=C(NN)C=C1 21448 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.176 CC1=C(C)C=C(NN)C=C1 7555 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.176 CC1=C(Cl)C=CC(C#N)=C1 8005 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 28400 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.176 CC1=C(F)C=CC(C#N)=C1 1553 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.176 CC1=C(F)C=CC(C=O)=C1 1457 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.176 CC1=C(F)C=CC(CN)=C1 4495 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.176 CC1=C(N)C=CC(C#N)=C1 4667 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.176 CC1=C(O)C=C(C#N)C=C1 19802 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.176 CC1=C(O)C=CC(C=O)=C1 8134 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.176 CCC1=CC(Br)=C(N)C=C1 5314 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.176 CCC1=CC(N)=C(O)C=C1 27789 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 3644 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.176 CCC1=CC=C(N)C(N)=C1 31890 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.176 CCC1=CC=C(O)C(O)=C1 28104 [1,1,0,0,0,0|1,0,0]=3 693 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 28299 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.176 COC1=CC(Br)=C(Br)C=C1 4110 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.176 COC1=CC(Br)=C(C)C=C1 24319 [1,1,0,0,0,0|1,0,0]=3 696 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 4555 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.176 COC1=CC(Br)=C(F)C=C1 28354 [1,1,0,0,0,0|1,0,0]=3 698 B10R1.176 COC1=CC(Br)=C(N)C=C1 31003 [1,1,0,0,0,0|1,0,0]=3 699 B10R1.176 COC1=CC(Br)=C(N)C=C1 4332 [1,1,0,0,0,0|1,0,0]=3 700 B10R1.176 COC1=CC(Br)=C(O)C=C1 4135 [1,1,0,0,0,0|1,0,0]=3 701 B10R1.176 COC1=CC(C)=C(Br)C=C1 3796 [1,1,0,0,0,0|0,0,0]=2 702 B10R1.176 COC1=CC(C)=C(C)C=C1 5361 [1,1,0,0,0,0|0,0,0]=2 703 B10R1.176 COC1=CC(C)=C(Cl)C=C1 2666 [1,1,0,0,0,0|0,0,0]=2 704 B10R1.176 COC1=CC(C)=C(F)C=C1 2623 [1,1,0,0,0,0|0,0,0]=2 705 B10R1.176 COC1=CC(C)=C(N)C=C1 28347 [1,1,0,0,0,0|0,0,0]=2 706 B10R1.176 COC1=CC(C)=C(O)C=C1 31104 [1,1,0,0,0,0|0,0,0]=2 707 B10R1.176 COC1=CC(C)=C(S)C=C1 6886 [1,1,0,0,0,0|0,0,0]=2 708 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 2631 [1,1,0,0,0,0|1,0,0]=3 709 B10R1.176 COC1=CC(Cl)=C(C)C=C1 4101 [1,1,0,0,0,0|1,0,0]=3 710 B10R1.176 COC1=CC(Cl)=C(Cl)C=C1 3683 [1,1,0,0,0,0|1,0,0]=3 711 B10R1.176 COC1=CC(Cl)=C(F)C=C1 2660 [1,1,0,0,0,0|1,0,0]=3 712 B10R1.176 COC1=CC(Cl)=C(I)C=C1 27614 [1,1,0,0,0,0|1,0,0]=3 713 B10R1.176 COC1=CC(Cl)=C(N)C=C1 27577 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.176 COC1=CC(Cl)=C(O)C=C1 3663 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.176 COC1=CC(F)=C(Br)C=C1 1970 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.176 COC1=CC(F)=C(Br)C=C1 20025 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.176 COC1=CC(F)=C(C)C=C1 2621 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.176 COC1=CC(F)=C(Cl)C=C1 2663 [1,1,0,0,0,0|1,0,0]=3 719 B10R1.176 COC1=CC(F)=C(F)C=C1 3457 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.176 COC1=CC(F)=C(N)C=C1 15755 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.176 COC1=CC(F)=C(O)C=C1 15011 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.176 COC1=CC(I)=C(Br)C=C1 5347 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.176 COC1=CC(I)=C(Cl)C=C1 5291 [1,1,0,0,0,0|1,0,0]=3 724 B10R1.176 COC1=CC(I)=C(N)C=C1 10738 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.176 COC1=CC(N)=C(Br)C=C1 5335 [1,1,0,0,0,0|1,0,0]=3 726 B10R1.176 COC1=CC(N)=C(Br)C=C1 5367 [1,1,0,0,0,0|1,0,0]=3 727 B10R1.176 COC1=CC(N)=C(C)C=C1 19827 [1,1,0,0,0,0|1,0,0]=3 728 B10R1.176 COC1=CC(N)=C(Cl)C=C1 3658 [1,1,0,0,0,0|1,0,0]=3 729 B10R1.176 COC1=CC(N)=C(Cl)C=C1 3660 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.176 COC1=CC(N)=C(F)C=C1 15806 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.176 COC1=CC(N)=C(I)C=C1 31005 [1,1,0,0,0,0|1,0,0]=3 732 B10R1.176 COC1=CC(N)=C(N)C=C1 28370 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.176 COC1=CC(N)=C(N)C=C1 28371 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.176 COC1=CC(O)=C(Br)C=C1 13262 [1,1,0,0,0,0|0,0,0]=2 735 B10R1.176 COC1=CC(O)=C(C)C=C1 31114 [1,1,0,0,0,0|0,0,0]=2 736 B10R1.176 COC1=CC(O)=C(Cl)C=C1 10217 [1,1,0,0,0,0|0,0,0]=2 737 B10R1.176 COC1=CC(O)=C(F)C=C1 33440 [1,1,0,0,0,0|0,0,0]=2 738 B10R1.176 COC1=CC(S)=C(N)C=C1 21901 [1,1,0,0,0,0|0,1,0]=3 739 B10R1.176 COC1=CC=C(Cl)C(Br)=N1 34861 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 27271 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.176 COC1=CC=C(Cl)C(N)=N1 34185 [1,1,0,0,0,0|2,0,0]=4 742 B10R1.176 COC1=CC=C(N)C(Br)=N1 1233 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.176 COC1=CC=C(N)C(C)=N1 1267 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.176 COC1=CC=C(N)C(C)=N1 16794 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.176 COC1=CC=C(N)C(N)=N1 20870 [1,1,0,0,0,0|2,0,0]=4 746 B10R1.176 COC1=CC=C(N)C(N)=N1 5392 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.176 COC1=CC=C(O)C(O)=C1 33439 [1,1,0,0,0,0|0,0,0]=2 748 B10R1.176 COC1=CN=C(Cl)C(N)=C1 26205 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.176 COC1=NC(C)=C(Br)C=C1 29228 [1,1,0,0,0,0|1,0,0]=3 750 B10R1.176 COC1=NC(C)=C(Br)C=C1 6601 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.176 COC1=NC(C)=C(F)C=C1 6605 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.176 COC1=NC(C)=C(N)C=C1 1133 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.176 COC1=NC=C(Br)C(C)=C1 6600 [1,1,0,0,0,0|1,0,0]=3 754 B10R1.176 COC1=NC=C(Br)C(C)=N1 27835 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.176 COC1=NC=C(Cl)C(Br)=C1 34352 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.176 COC1=NC=C(F)C(Br)=C1 17047 [1,1,0,0,0,0|2,0,0]=4 757 B10R1.176 COC1=NC=C(F)C(C)=C1 6604 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.176 COC1=NC=C(F)C(I)=C1 15251 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.176 COC1=NC=C(F)C(N)=C1 34238 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.176 COC1=NC=C(N)C(C)=C1 6599 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.176 COc1ccc(Br)c(N)c1 26521 [1,1,0,0,0,0|1,0,0]=3 762 B10R1.176 N#CC1=CC(O)=C(Br)C=C1 33768 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.176 N#CC1=CC(O)=C(Cl)C=C1 27837 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.176 N#CC1=CC(O)=C(F)C=C1 28107 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.176 N#CC1=CC(O)=C(I)C=C1 28752 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.176 N#CC1=CC(O)=C(O)C=C1 3120 [1,1,0,0,0,0|2,0,0]=4 767 B10R1.176 NCC1=CC(O)=C(O)C=C1 21986 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 16848 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 30917 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.176 O=CC1=CC(O)=C(I)C=C1 8597 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.176 O=CC1=CC(O)=C(O)C=C1 8231 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.176 OCC1=CC(O)=C(F)C=C1 35161 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.176 OCC1=CC(O)=C(I)C=C1 28804 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.176 OCC1=CC(O)=C(O)C=C1 3025 [1,1,0,0,0,0|2,0,0]=4 775 B12R1.11 COC1=CC(B(O)O)=CC(Br)=C1 29588 [0,2,0,0,0,0|2,0,0]=4 776 B12R1.11 COC1=CC(B(O)O)=CC(Cl)=C1 1777 [0,2,0,0,0,0|2,0,0]=4 777 B12R1.11 COC1=CC(B(O)O)=CC(F)=C1 29601 [0,2,0,0,0,0|2,0,0]=4 778 B12R1.11 COC1=CC(B(O)O)=CC(O)=C1 33201 [0,2,0,0,0,0|2,0,0]=4 779 B12R1.11 COC1=CC(C(=O)O)=CC(Br)=C1 16435 [0,2,0,0,0,0|2,0,0]=4 780 B12R1.11 COC1=CC(C(=O)O)=CC(Cl)=C1 14017 [0,2,0,0,0,0|2,0,0]=4 781 B12R1.11 COC1=CC(C(=O)O)=CC(F)=C1 45057 [0,2,0,0,0,0|2,0,0]=4 782 B12R1.11 COC1=CC(C(=O)O)=CC(F)=C1 45057 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.11 COC1=CC(C(=O)O)=CC(I)=C1 27807 [0,2,0,0,0,0|2,0,0]=4 784 B12R1.11 COC1=CC(C(=O)O)=CC(N)=C1 27806 [0,2,0,0,0,0|2,0,0]=4 785 B12R1.11 COC1=CC(C)=CC(B(O)O)=C1 34406 [0,2,0,0,0,0|2,0,0]=4 786 B12R1.11 COC1=CC(C)=CC(C(=O)O)=C1 25660 [0,2,0,0,0,0|2,0,0]=4 787 B12R1.11 COC1=CC(Cl)=CC([N+](=O)[O-])=C1 31166 [0,2,0,0,0,0|2,0,0]=4 788 B12R1.11 COC1=CC([N+](=O)[O-])=CC(Br)=C1 21624 [0,2,0,0,0,0|2,0,0]=4 789 B12R1.11 COC1=CC([N+](=O)[O-])=CC(F)=C1 33262 [0,2,0,0,0,0|2,0,0]=4 790 B12R1.11 COC1=CC([N+](=O)[O-])=CC(O)=C1 35140 [0,2,0,0,0,0|2,0,0]=4 791 B12R1.41 COC1=CC(CC#N)=CC(F)=C1 25413 [0,2,0,0,0,0|1,0,1]=4 792 B12R1.58 C#CC1=CC(OC)=CC(OC)=C1 29058 [0,2,0,0,0,0|0,0,0]=2 793 B12R1.58 CCC1=CC(CC)=CC(CC)=C1 19794 [0,2,0,0,0,0|2,0,0]=4 794 B12R1.58 COC1=CC(C#N)=CC(OC)=C1 3122 [0,2,0,0,0,0|0,0,0]=2 795 B12R1.58 COC1=CC(C=O)=CC(C=O)=C1 20489 [0,2,0,0,0,0|2,0,0]=4 796 B12R1.58 COC1=CC(C=O)=CC(OC)=C1 2645 [0,2,0,0,0,0|0,0,0]=2 797 B12R1.58 COC1=CC(CBr)=CC(OC)=C1 13588 [0,2,0,0,0,0|0,0,0]=2 798 B12R1.58 COC1=CC(CN)=CC(OC)=C1 7393 [0,2,0,0,0,0|0,0,0]=2 799 B12R1.58 COC1=CC(CO)=CC(OC)=C1 7732 [0,2,0,0,0,0|0,0,0]=2 800 B12R1.58 COC1=CC(OC)=CC(OC)=C1 16522 [0,2,0,0,0,0|0,0,0]=2 801 B12R1.58 COC1=CC(OC)=NC(CCl)=N1 7039 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.58 COC1=CC(OC)=NC(SC)=N1 16779 [0,2,0,0,0,0|2,0,0]=4 803 B12R1.235 CCC1=CC(Br)=CC(CC)=C1N 12488 [0,2,0,0,0,0|2,0,0]=4 804 B12R1.235 COC1=CC(=O)C=C(OC)C1=O 35780 [0,2,0,0,0,0|0,0,0]=2 805 B12R1.235 COC1=CC(O)=CC(OC)=C1O 3024 [0,2,0,0,0,0|0,0,0]=2 806 B12R1.235 COC1=NC(C)=NC(OC)=C1Br 31711 [0,2,0,0,0,0|2,0,0]=4 807 B12R1.235 COC1=NC(N)=NC(OC)=C1N 7050 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.300 COC1=C(O)C(Br)=CC(C=O)=C1 8197 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.300 COC1=CC(C=O)=CC(F)=C1F 30893 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.300 COC1=CC(C=O)=CC(F)=C1O 10464 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.300 COC1=CC(C=O)=CC(O)=C1O 8233 [0,2,0,0,0,0|2,0,0]=4 812 B12R1.300 COC1=CC(F)=C(Br)C(OC)=C1 3038 [0,2,0,0,0,0|0,0,0]=2 813 B12R1.300 COC1=CC(N)=C(F)C(OC)=C1 28318 [0,2,0,0,0,0|0,0,0]=2 814 B12R1.270 CCOC1=C(Br)C=CC(C#N)=C1 7753 [0,2,0,0,0,0|2,0,0]=4 815 B12R1.270 CCOC1=C(Cl)C=CC(C#N)=C1 8001 [0,2,0,0,0,0|2,0,0]=4 816 B12R1.270 COC1=CC(CC#N)=C(F)C=C1 24725 [0,2,0,0,0,0|1,0,1]=4 817 B12R1.278 CCNC1=CC=CC(NCC)=C1 21411 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.279 CCOC1=CC([N+](=O)[O-])=CC=C1 3189 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.279 CCOC1=CC=CC(B(O)O)=C1 1835 [0,2,0,0,0,0|2,0,0]=4 820 B12R1.279 CCOC1=CC=CC(C(=O)O)=C1 34280 [0,2,0,0,0,0|2,0,0]=4 821 B12R1.279 COCC1=CC=CC(B(O)O)=C1 33893 [0,2,0,0,0,0|2,0,0]=4 822 B12R1.280 CCOC1=CC=CC(C=O)=C1O 3123 [0,2,0,0,0,0|2,0,0]=4 823 B12R1.280 COC1=CC=CC(CC#N)=C1O 12596 [0,2,0,0,0,0|1,0,1]=4 824 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 12778 [0,2,0,0,0,0|1,0,1]=4 825 B12R1.286 COC1=C(O)C=CC(CC#N)=C1 14775 [0,2,0,0,0,0|1,0,1]=4 826 B12R1.286 COC1=C(O)C=CC(CCN)=C1 34925 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.382 COC1=CN=CC(C#CCO)=C1 26990 [0,2,0,0,0,0|2,0,0]=4 828 B12R1.435 C#CC1=CC=CC(C(=O)OC)=C1 44763 [0,2,0,0,0,0|1,0,1]=4 829 B12R1.435 COC(=O)C1=CC(C#N)=CC=C1 21088 [0,2,0,0,0,0|2,0,0]=4 830 B12R1.435 COC(=O)C1=CC(C=O)=CC=C1 12631 [0,2,0,0,0,0|2,0,0]=4 831 B12R1.435 COC(=O)C1=CC(CBr)=CC=C1 17417 [0,2,0,0,0,0|2,0,0]=4 832 B12R1.435 COC(=O)C1=CC(CBr)=CC=C1 30509 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.435 COC(=O)C1=CC(CCl)=CC=C1 19902 [0,2,0,0,0,0|2,0,0]=4 834 B12R1.435 COC(=O)C1=CC(CN)=CC=C1 11178 [0,2,0,0,0,0|2,0,0]=4 835 B12R1.435 COC(=O)C1=NC(OC)=CC=C1 16541 [0,2,0,0,0,0|1,0,0]=3 836 B12R1.435 COC(=O)C1=NC(OC)=CN=C1 32123 [0,2,0,0,0,0|2,0,0]=4 837 B12R1.435 COC(=O)c1cc(OC)ccn1 11083 [0,2,0,0,0,0|1,0,0]=3 838 B12R1.435 COC(=O)c1cccc(SCl)c1 28889 [0,2,0,0,0,0|1,1,0]=4 839 B12R1.435 COC1=CC=CC(C(=O)C=O)=C1 12325 [0,2,0,0,0,0|1,0,1]=4 840 B12R1.435 COc1cccc(C(=O)CN)c1 20065 [0,2,0,0,0,0|1,0,0]=3 841 B12R1.438 CC(=O)OC1=CC=CC(C=O)=C1 13227 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 19669 [0,2,0,0,0,0|1,0,1]=4 843 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 28267 [0,2,0,0,0,0|1,0,0]=3 844 B12R1.438 COC1=CC=CC(CC(O)=S)=C1 21122 [0,2,0,0,0,0|1,0,1]=4 845 B12R1.438 COC1=CC=CC(NC(=N)N)=C1 22163 [0,2,0,0,0,0|1,0,1]=4 846 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 3321 [0,2,0,0,0,0|1,0,0]=3 847 B12R1.438 COC1=CC=CC(OC(C)=O)=C1 3063 [0,2,0,0,0,0|0,0,0]=2 848 B12R1.438 CSC1=CC(NC(C)=O)=CC=C1 10658 [0,2,0,0,0,0|1,1,0]=4 849 B12R1.438 FC(F)Oc1cccc(CBr)c1 31281 [0,2,0,0,0,0|2,0,0]=4 850 B12R1.438 NCC1=CC(OC(F)F)=CC=C1 31253 [0,2,0,0,0,0|2,0,0]=4 851 B12R1.438 O=CC1=CC(OC(F)F)=CC=C1 2907 [0,2,0,0,0,0|2,0,0]=4 852 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 24786 [0,2,0,0,0,0|2,0,0]=4 853 B12R1.56 COC1=C(Br)C=CC([N+](=O)[O-])=C1 2536 [0,2,0,0,0,0|2,0,0]=4 854 B12R1.56 COC1=C(C)C=CC(B(O)O)=C1 5130 [0,2,0,0,0,0|2,0,0]=4 855 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 2672 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.56 COC1=C(C)C=CC(C(C)=O)=C1 31231 [0,2,0,0,0,0|1,0,0]=3 857 B12R1.56 COC1=C(C)C=CC([N+](=O)[O-])=C1 2628 [0,2,0,0,0,0|2,0,0]=4 858 B12R1.56 COC1=C(Cl)C=CC(B(O)O)=C1 17400 [0,2,0,0,0,0|2,0,0]=4 859 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 4565 [0,2,0,0,0,0|2,0,0]=4 860 B12R1.56 COC1=C(Cl)C=CC([N+](=O)[O-])=C1 2625 [0,2,0,0,0,0|2,0,0]=4 861 B12R1.56 COC1=C(F)C=CC(B(O)O)=C1 29618 [0,2,0,0,0,0|2,0,0]=4 862 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 1394 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 4234 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 2668 [0,2,0,0,0,0|2,0,0]=4 865 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 3131 [0,2,0,0,0,0|2,0,0]=4 866 B12R1.56 COC1=C(N)C=CC([N+](=O)[O-])=C1 3332 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 33662 [0,2,0,0,0,0|2,0,0]=4 868 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 19485 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 3315 [0,2,0,0,0,0|1,0,0]=3 870 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 16519 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.56 COc1cc([N+](=O)[O-])ccc1F 1055 [0,2,0,0,0,0|2,0,0]=4 872 B12R1.258 CC(=O)C1=CC(C(C)C)=CC=C1 34513 [0,2,0,0,0,0|2,0,0]=4 873 B12R1.258 CN(C)C1=CC=CC(N(C)C)=C1 24780 [0,2,0,0,0,0|2,0,0]=4 874 B12R1.436 COC1=CC=CC(C(F)(F)F)=C1 2712 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.436 COC1=CC=CC(S(=O)(=O)Cl)=C1 5169 [0,2,0,0,0,0|1,1,0]=4 876 B12R1.436 COC1=CC=CC([B-](F)(F)F)=C1 11520 [0,2,0,0,0,0|2,0,0]=4 877 B12R1.440 COC1=C(Br)C([N+](=O)[O-])=CC=C1 3140 [0,2,0,0,0,0|2,0,0]=4 878 B12R1.440 COC1=C(C)C([N+](=O)[O-])=CC=C1 4148 [0,2,0,0,0,0|2,0,0]=4 879 B12R1.440 COC1=C(Cl)C([N+](=O)[O-])=CC=C1 19263 [0,2,0,0,0,0|2,0,0]=4 880 B12R1.440 COC1=C(Cl)C([N+](=O)[O-])=CC=C1 31136 [0,2,0,0,0,0|2,0,0]=4 881 B12R1.440 COC1=C(N)C([N+](=O)[O-])=CC=C1 19661 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.440 COC1=C(O)C([N+](=O)[O-])=CC=C1 33267 [0,2,0,0,0,0|2,0,0]=4 883 B12R1.440 COC1=CC=CC(B(O)O)=C1Cl 32861 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.440 COC1=CC=CC(B(O)O)=C1F 1848 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.440 COC1=CC=CC(B(O)O)=C1O 33844 [0,2,0,0,0,0|2,0,0]=4 886 B12R1.440 COC1=CC=CC(C(=O)O)=C1Br 30461 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.440 COC1=CC=CC(C(=O)O)=C1C 4976 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.440 COC1=CC=CC(C(=O)O)=C1Cl 28592 [0,2,0,0,0,0|2,0,0]=4 889 B12R1.440 COC1=CC=CC(C(=O)O)=C1F 4964 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.440 COC1=CC=CC(C(=O)O)=C1N 4701 [0,2,0,0,0,0|2,0,0]=4 891 B12R1.440 COC1=CC=CC(C(C)=O)=C1N 29251 [0,2,0,0,0,0|1,0,0]=3 892 B12R1.453 COC1=CC(B(O)O)=C(C)C=C1 26663 [0,2,0,0,0,0|2,0,0]=4 893 B12R1.453 COC1=CC(B(O)O)=C(Cl)C=C1 6932 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.453 COC1=CC(B(O)O)=C(F)C=C1 4080 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.453 COC1=CC(B(O)O)=C(O)C=C1 32860 [0,2,0,0,0,0|2,0,0]=4 896 B12R1.453 COC1=CC(C(=O)O)=C(Br)C=C1 2674 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.453 COC1=CC(C(=O)O)=C(C)C=C1 28681 [0,2,0,0,0,0|2,0,0]=4 898 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 4563 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.453 COC1=CC(C(=O)O)=C(F)C=C1 4966 [0,2,0,0,0,0|2,0,0]=4 900 B12R1.453 COC1=CC(C(=O)O)=C(N)C=C1 2544 [0,2,0,0,0,0|2,0,0]=4 901 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 13248 [0,2,0,0,0,0|1,0,0]=3 902 B12R1.453 COC1=CC(C(C)C)=C(O)C=C1 26583 [0,2,0,0,0,0|1,0,0]=3 903 B12R1.453 COC1=CC(C(F)F)=C(Br)C=C1 31142 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.453 COC1=CC([N+](=O)[O-])=C(Br)C=C1 2655 [0,2,0,0,0,0|2,0,0]=4 905 B12R1.453 COC1=CC([N+](=O)[O-])=C(C)C=C1 3127 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.453 COC1=CC([N+](=O)[O-])=C(Cl)C=C1 2627 [0,2,0,0,0,0|2,0,0]=4 907 B12R1.453 COC1=CC([N+](=O)[O-])=C(F)C=C1 31156 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.453 COC1=CC([N+](=O)[O-])=C(I)C=C1 35587 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.453 COC1=CC([N+](=O)[O-])=C(N)C=C1 28349 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.453 COC1=CC([N+](=O)[O-])=C(O)C=C1 16829 [0,2,0,0,0,0|2,0,0]=4 911 B12R1.654 CCC1=CC=C(Cl)C(CC)=C1N 3201 [0,2,0,0,0,0|2,0,0]=4 912 B12R1.654 COC1=C(Br)C=CC(C#N)=C1F 30824 [0,2,0,0,0,0|2,0,0]=4 913 B12R1.654 COC1=C(F)C(OC)=C(N)C=C1 10109 [0,2,0,0,0,0|0,0,0]=2 914 B12R1.654 COC1=C(F)C=CC(C#N)=C1F 4765 [0,2,0,0,0,0|2,0,0]=4 915 B12R1.654 COC1=C(F)C=CC(C=O)=C1F 25895 [0,2,0,0,0,0|2,0,0]=4 916 B12R1.654 COC1=CC=C(F)C(C=O)=C1F 16517 [0,2,0,0,0,0|2,0,0]=4 917 B12R1.1879 COC1=CC=CC(C#N)=C1OC 13104 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.1879 COC1=CC=CC(C=O)=C1OC 8216 [0,2,0,0,0,0|2,0,0]=4 919 B12R1.1879 COC1=CC=CC(CN)=C1OC 7399 [0,2,0,0,0,0|2,0,0]=4 920 B12R1.1879 COC1=CC=CC(CO)=C1OC 44703 [0,2,0,0,0,0|2,0,0]=4 921 B12R1.1879 COC1=CC=CC(OC)=C1C#N 4772 [0,2,0,0,0,0|0,0,0]=2 922 B12R1.1879 COC1=CC=CC(OC)=C1C=O 8226 [0,2,0,0,0,0|0,0,0]=2 923 B12R1.1879 COC1=CC=CC(OC)=C1CN 7395 [0,2,0,0,0,0|0,0,0]=2 924 B12R1.1879 COC1=CC=CC(OC)=C1OC 14319 [0,2,0,0,0,0|0,0,0]=2 925 B12R1.1879 COC1=CN=CC(OC)=C1C=O 28077 [0,2,0,0,0,0|1,0,0]=3 926 B12R1.1879 COC1=NC=NC(OC)=C1C=O 27980 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.78 C#CC1=CC(OC)=C(OC)C=C1 19824 [0,2,0,0,0,0|1,0,1]=4 928 B12R1.78 CCC1=C(OC)C=CC(OC)=C1 3047 [0,2,0,0,0,0|1,0,0]=3 929 B12R1.78 CCC1=CC(OC)=C(OC)C=C1 3046 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.78 COC1=C(C=O)C=CC(C#N)=C1 17019 [0,2,0,0,0,0|2,0,0]=4 931 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 8124 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 8238 [0,2,0,0,0,0|2,0,0]=4 933 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 13181 [0,2,0,0,0,0|2,0,0]=4 934 B12R1.78 COC1=C(OC)C=C(CN)C=C1 7394 [0,2,0,0,0,0|2,0,0]=4 935 B12R1.78 COC1=C(OC)C=C(CO)C=C1 7452 [0,2,0,0,0,0|2,0,0]=4 936 B12R1.78 COC1=CC(C#N)=C(C=O)C=C1 17011 [0,2,0,0,0,0|2,0,0]=4 937 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 13109 [0,2,0,0,0,0|2,0,0]=4 938 B12R1.78 COC1=CC(C=O)=C(OC)C=C1 2176 [0,2,0,0,0,0|2,0,0]=4 939 B12R1.78 COC1=CC(CN)=C(OC)C=C1 7396 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.78 COC1=CC(OC)=C(C#N)C=C1 13105 [0,2,0,0,0,0|0,0,0]=2 941 B12R1.78 COC1=CC(OC)=C(C=O)C=C1 8220 [0,2,0,0,0,0|0,0,0]=2 942 B12R1.78 COC1=CC(OC)=C(CCl)C=C1 27178 [0,2,0,0,0,0|0,0,0]=2 943 B12R1.78 COC1=CC(OC)=C(CN)C=C1 7397 [0,2,0,0,0,0|0,0,0]=2 944 B12R1.78 COC1=CC(OC)=C(CN)C=C1 7398 [0,2,0,0,0,0|0,0,0]=2 945 B12R1.78 COC1=CC(OC)=C(CO)C=C1 7454 [0,2,0,0,0,0|0,0,0]=2 946 B12R1.78 COC1=CC=C(C=O)C(OC)=N1 5105 [0,2,0,0,0,0|1,0,0]=3 947 B12R1.78 COC1=NC=C(C=O)C(OC)=N1 5292 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.449 CCC1=CC(OC)=C(O)C=C1F 26368 [0,2,0,0,0,0|1,0,0]=3 949 B12R1.449 COC1=NC(OC)=C(N)C=C1N 20874 [0,2,0,0,0,0|1,0,0]=3 950 B10R1.149 COC(=O)C1=CC=CN1C 12438 [0,0,1,1,0,0|2,0,0]=4 951 B10R2.7 C1=C2OCCOC2=CS1 12563 [0,0,0,1,1,0|1,0,0]=3 952 B12R2.44 COC1=CC2=C(C=C1)N=CN2 7662 [0,1,0,1,0,0|1,0,1]=4 953 B12R2.44 COC1=CC2=C(C=CO2)C=C1 33547 [0,1,0,1,0,0|0,0,1]=3 954 B12R2.44 COC1=CC2=C(C=CS2)C=C1 27294 [0,1,0,1,0,0|0,1,1]=4 955 B12R2.44 COC1=CC=C2C=CNC2=C1 1701 [0,1,0,1,0,0|1,0,1]=4 956 B12R2.44 COC1=CC=C2CCNC2=C1 20088 [0,1,0,1,0,0|1,0,0]=3 957 B12R2.44 COC1=CC=C2CCNC2=C1 8317 [0,1,0,1,0,0|1,0,0]=3 958 B12R2.44 COC1=CC=C2CNCC2=C1 17685 [0,1,0,1,0,0|1,0,0]=3 959 B12R2.44 COC1=CC=C2CNCC2=N1 23499 [0,1,0,1,0,0|2,0,0]=4 960 B12R2.44 COC1=CC=C2NC=CC2=C1 7432 [0,1,0,1,0,0|1,0,1]=4 961 B12R2.44 COC1=CC=C2NCCC2=C1 8318 [0,1,0,1,0,0|1,0,0]=3 962 B12R2.44 COC1=CC=C2NN=CC2=C1 11084 [0,1,0,1,0,0|2,0,0]=4 963 B12R2.44 ClCC1=CC2=C(C=C1)OCO2 35833 [0,1,0,1,0,0|2,0,0]=4 964 B12R2.44 N#CC1=CC2=C(C=C1)OCO2 15358 [0,1,0,1,0,0|2,0,0]=4 965 B12R2.44 NCC1=CC2=C(C=C1)OCO2 7387 [0,1,0,1,0,0|2,0,0]=4 966 B12R2.44 OCC1=CC2=C(C=C1)CCO2 33826 [0,1,0,1,0,0|2,0,0]=4 967 B12R2.44 OCC1=CC2=C(C=C1)OCO2 13179 [0,1,0,1,0,0|2,0,0]=4 968 B12R2.315 COC1=C2C=CNC2=CC=C1 7433 [0,1,0,1,0,0|1,0,1]=4 969 B12R2.315 COC1=C2CNCC2=CC=C1 17686 [0,1,0,1,0,0|1,0,0]=3 970 B12R2.315 COC1=C2NC=CC2=CC=C1 7434 [0,1,0,1,0,0|1,0,1]=4 971 B12R2.315 N#CC1=CC=CC2=C1OCO2 33672 [0,1,0,1,0,0|2,0,0]=4 972 B8R1.1 COC1=CC=C(O)O1 22256 [1,0,0,0,1,0|1,0,0]=3 973 B10R1.3 CCC1=CC=C(OC)C=C1 25322 [0,0,0,0,1,1|1,0,0]=3 974 B10R1.3 CNC1=CC=C(OC)C=C1 25931 [0,0,0,0,1,1|1,0,0]=3 975 B10R1.3 COC1=CC=C(C#N)C=C1 8162 [0,0,0,0,1,1|2,0,0]=4 976 B10R1.3 COC1=CC=C(C=O)C=C1 22535 [0,0,0,0,1,1|2,0,0]=4 977 B10R1.3 COC1=CC=C(C=O)C=N1 5152 [0,0,0,0,1,1|2,0,0]=4 978 B10R1.3 COC1=CC=C(CBr)C=C1 15882 [0,0,0,0,1,1|2,0,0]=4 979 B10R1.3 COC1=CC=C(CCl)C=C1 18654 [0,0,0,0,1,1|2,0,0]=4 980 B10R1.3 COC1=CC=C(CN)C=C1 4428 [0,0,0,0,1,1|2,0,0]=4 981 B10R1.3 COC1=CC=C(CN)C=N1 33703 [0,0,0,0,1,1|2,0,0]=4 982 B10R1.3 COC1=CC=C(CO)C=C1 19100 [0,0,0,0,1,1|2,0,0]=4 983 B10R1.3 COC1=CC=C(CS)C=C1 6839 [0,0,0,0,1,1|2,0,0]=4 984 B10R1.3 COC1=CC=C(NN)C=C1 4498 [0,0,0,0,1,1|2,0,0]=4 985 B10R1.3 COC1=CC=C(SC)C=C1 10655 [0,0,0,0,1,1|0,1,0]=3 986 B10R1.3 COC1=CN=C(C=O)C=C1 24092 [0,0,0,0,1,1|2,0,0]=4 987 B10R1.3 COC1=CN=C(CO)C=C1 34570 [0,0,0,0,1,1|2,0,0]=4 988 B10R1.3 COC1=NC=C(C#N)C=C1 15154 [0,0,0,0,1,1|2,0,0]=4