0 B11R1.266 C#CC1=CC(C(=O)O)=CC=C1 047534 [0,0,0,0,0,0|1,0,1]=2 1 B11R1.266 C#CC1=CC=CC([N+](=O)[O-])=C1 046081 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.266 C(=O)C1=CC=CC(B(O)O)=C1 010798 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.266 C=CC1=CC(C(=O)O)=CC=C1 240694 [0,0,0,0,0,0|1,0,1]=2 4 B11R1.266 CC(=O)C1=CC(C=O)=CC=C1 325484 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 001255 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.266 CCC1=CC(B(O)O)=CC=C1 092255 [0,0,0,0,0,0|2,0,1]=3 7 B11R1.266 CCC1=NC=CC(C(N)=S)=C1 023863 [0,0,0,0,0,0|3,1,0]=4 8 B11R1.266 COC1=CC(C(=O)Cl)=CC=C1 018779 [0,0,0,0,0,0|1,0,0]=1 9 B11R1.266 COC1=CC(C(=O)O)=CC=C1 334012 [0,0,0,0,0,0|0,0,0]=0 10 B11R1.266 COC1=CC(C(=O)O)=NC=C1 077250 [0,0,0,0,0,0|1,0,0]=1 11 B11R1.266 COC1=CC(C(C)N)=CC=C1 030159 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.266 COC1=CC=CC(B(O)O)=C1 011002 [0,0,0,0,0,0|1,0,1]=2 13 B11R1.266 COC1=CC=CC(C(C)=O)=C1 021712 [0,0,0,0,0,0|1,0,0]=1 14 B11R1.266 COC1=CC=CC(C(C)C)=C1 099960 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.266 COC1=CC=CC(C(N)=O)=C1 545201 [0,0,0,0,0,0|1,0,0]=1 16 B11R1.266 COC1=CC=CC(C(N)=S)=C1 097875 [0,0,0,0,0,0|1,1,0]=2 17 B11R1.266 COC1=NC=CC(B(O)O)=C1 076729 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.266 CSC1=CC(B(O)O)=CC=C1 016264 [0,0,0,0,0,0|1,1,1]=3 19 B11R1.266 N#CC1=CC(B(O)O)=CC=C1 010787 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 013809 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.266 N#CC1=CC=CC([N+](=O)[O-])=C1 050418 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.266 NC(=O)C1=CC=CC(C=O)=C1 037338 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 221071 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.266 NCC1=CC(B(O)O)=CC=C1 091871 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.266 NCC1=CC=CC([N+](=O)[O-])=C1 237137 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.266 NNC1=CC(C(=O)O)=CC=C1 092194 [0,0,0,0,0,0|2,0,0]=2 27 B11R1.266 O=C(Cl)C1=CC=CC(CCl)=C1 317440 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 043285 [0,0,0,0,0,0|2,0,0]=2 29 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 077878 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 078661 [0,0,0,0,0,0|2,0,0]=2 31 B11R1.266 O=CC1=CC=CC([N+](=O)[O-])=C1 209059 [0,0,0,0,0,0|3,0,1]=4 32 B11R1.266 O=[N+]([O-])C1=CC=CC(CBr)=C1 002721 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.266 O=[N+]([O-])C1=CC=CC(CO)=C1 008826 [0,0,0,0,0,0|3,0,1]=4 34 B11R1.266 OCC1=CC(B(O)O)=CC=C1 016258 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.113 CC(=O)C1=CC(Br)=CC=C1 008816 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.113 CC(=O)C1=CC(C)=CC=C1 349312 [1,0,0,0,0,0|1,0,0]=2 37 B10R1.113 CC(=O)C1=CC(Cl)=CC=C1 024871 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.113 CC(=O)C1=CC(F)=CC=C1 001467 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.113 CC(=O)C1=CC(I)=CC=C1 147400 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.113 CC(=O)C1=CC(N)=CC=C1 001722 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.113 CC(=O)C1=CC=CC(O)=C1 078748 [1,0,0,0,0,0|1,0,0]=2 42 B10R1.113 CC(=O)C1=C[N+]([O-])=CC=C1 300933 [1,0,0,0,0,0|2,0,1]=4 43 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 077437 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.113 CC(=O)C1=NC(C)=CC=C1 215987 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.113 CC(=O)C1=NC=CC(C)=C1 068379 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 047445 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.113 CC(C)C1=CC=CC(O)=C1 099128 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.113 CC(O)C1=CC(Br)=CC=C1 003550 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.113 CC(O)C1=CC(Cl)=CC=C1 353644 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.113 CC(O)C1=CC(F)=CC=C1 006338 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.113 CC1=CC(B(O)O)=CC=C1 010853 [1,0,0,0,0,0|1,0,1]=3 52 B10R1.113 CC1=CC(C(=O)Cl)=CC=C1 095026 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.113 CC1=CC(C(=O)O)=CC=C1 242869 [1,0,0,0,0,0|0,0,0]=1 54 B10R1.113 CC1=CC(C(=O)O)=CC=N1 045782 [1,0,0,0,0,0|1,0,0]=2 55 B10R1.113 CC1=CC(C(N)=O)=CC=C1 324085 [1,0,0,0,0,0|1,0,0]=2 56 B10R1.113 CC1=CC(N(C)C)=CC=C1 242206 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.113 CC1=CC=CC(C(=O)O)=N1 011322 [1,0,0,0,0,0|1,0,0]=2 58 B10R1.113 CC1=CC=CC(C(C)O)=C1 033735 [1,0,0,0,0,0|1,0,1]=3 59 B10R1.113 CC1=CC=CC(C(N)=S)=C1 021340 [1,0,0,0,0,0|1,1,0]=3 60 B10R1.113 CC1=CC=CC(C(N)=S)=C1 097831 [1,0,0,0,0,0|1,1,0]=3 61 B10R1.113 CC1=CC=CC([N+](=O)[O-])=C1 208843 [1,0,0,0,0,0|1,0,1]=3 62 B10R1.113 CC1=CN=CC(B(O)O)=C1 076877 [1,0,0,0,0,0|2,0,1]=4 63 B10R1.113 CC1=CN=CC(C(=O)O)=C1 024697 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.113 CN(C)C1=CC(O)=CC=C1 080296 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 103760 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 181849 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.113 N=C(N)C1=CC(N)=CC=C1 540016 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.113 NC(=O)C1=CC(Br)=CC=C1 036153 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 068498 [1,0,0,0,0,0|3,0,0]=4 70 B10R1.113 NC(=O)C1=CC(F)=CC=C1 006180 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.113 NC(=O)C1=CC(I)=CC=C1 036159 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.113 NC(=O)C1=CC(N)=CC=C1 018167 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 018356 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.113 NC(=O)C1=CC=C[N+]([O-])=C1 024703 [1,0,0,0,0,0|2,0,1]=4 75 B10R1.113 NC(=O)C1=CC=NC(Cl)=C1 017099 [1,0,0,0,0,0|3,0,0]=4 76 B10R1.113 NC(=O)C1=NC(F)=CC=C1 013003 [1,0,0,0,0,0|3,0,0]=4 77 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 068535 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.113 NC(=S)C1=CC(Br)=CC=C1 021312 [1,0,0,0,0,0|2,1,0]=4 79 B10R1.113 NC(=S)C1=CC(Cl)=CC=C1 021322 [1,0,0,0,0,0|2,1,0]=4 80 B10R1.113 NC(=S)C1=CC(F)=CC=C1 021325 [1,0,0,0,0,0|2,1,0]=4 81 B10R1.113 NC(=S)C1=CC(N)=CC=C1 021308 [1,0,0,0,0,0|2,1,0]=4 82 B10R1.113 NC1=CC(C(=O)O)=CC=C1 078487 [1,0,0,0,0,0|1,0,0]=2 83 B10R1.113 NC1=CC(C(=O)O)=CC=N1 045247 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.113 NC1=CC(C(=O)O)=NC=C1 066080 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.113 NC1=CC([N+](=O)[O-])=CC=C1 094473 [1,0,0,0,0,0|2,0,1]=4 86 B10R1.113 NC1=CC=CC(B(O)O)=C1 021277 [1,0,0,0,0,0|2,0,1]=4 87 B10R1.113 NC1=CC=CC(B(O)O)=C1 065558 [1,0,0,0,0,0|2,0,1]=4 88 B10R1.113 NC1=CC=CC(B(O)O)=C1 M02697 [1,0,0,0,0,0|2,0,1]=4 89 B10R1.113 NC1=CN=CC(C(=O)O)=C1 024647 [1,0,0,0,0,0|2,0,0]=3 90 B10R1.113 NC1=NC(C(=O)O)=CC=C1 033257 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.113 O=C(Cl)C1=CC(Br)=CC=C1 024397 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 066675 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 098670 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 001641 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.113 O=C(Cl)C1=CC=CC(I)=C1 014704 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 017100 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.113 O=C(O)C1=CC(Br)=CC=C1 109800 [1,0,0,0,0,0|1,0,0]=2 98 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 009061 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 024767 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 043669 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 010413 [1,0,0,0,0,0|2,0,0]=3 102 B10R1.113 O=C(O)C1=CC(F)=CC=C1 002167 [1,0,0,0,0,0|1,0,0]=2 103 B10R1.113 O=C(O)C1=CC(F)=NC=C1 005468 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.113 O=C(O)C1=CC(I)=CC=C1 147800 [1,0,0,0,0,0|1,0,0]=2 105 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 078545 [1,0,0,0,0,0|1,0,0]=2 106 B10R1.113 O=C(O)C1=CC=CC(F)=N1 005466 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.113 O=C(O)C1=CC=CC(O)=C1 208854 [1,0,0,0,0,0|0,0,0]=1 108 B10R1.113 O=C(O)C1=CC=CC(O)=N1 045246 [1,0,0,0,0,0|1,0,0]=2 109 B10R1.113 O=C(O)C1=CC=NC(O)=C1 043645 [1,0,0,0,0,0|1,0,0]=2 110 B10R1.113 O=C(O)C1=CN=CC(F)=C1 035868 [1,0,0,0,0,0|2,0,0]=3 111 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 021278 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 013139 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.113 O=C(O)C1=NC(Cl)=CN=C1 062993 [1,0,0,0,0,0|3,0,0]=4 114 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 036988 [1,0,0,0,0,0|2,0,0]=3 115 B10R1.113 O=C(O)C1=NC=CC(O)=C1 093182 [1,0,0,0,0,0|1,0,0]=2 116 B10R1.113 O=C(O)C1=NC=NC(Cl)=C1 077265 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.113 O=C(O)C1=NC=NC(O)=C1 076404 [1,0,0,0,0,0|2,0,0]=3 118 B10R1.113 O=S([O-])C1=CC=CC(Cl)=C1 045928 [1,0,0,0,0,0|2,0,1]=4 119 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CC=C1 242821 [1,0,0,0,0,0|2,0,1]=4 120 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 001678 [1,0,0,0,0,0|2,0,1]=4 121 B10R1.113 O=[N+]([O-])C1=CC=CC(I)=C1 002716 [1,0,0,0,0,0|2,0,1]=4 122 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 024562 [1,0,0,0,0,0|1,0,1]=3 123 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 010985 [1,0,0,0,0,0|2,0,1]=4 124 B10R1.113 OB(O)C1=CC(I)=CC=C1 011041 [1,0,0,0,0,0|2,0,1]=4 125 B10R1.113 OB(O)C1=CC(O)=CC=C1 024329 [1,0,0,0,0,0|1,0,1]=3 126 B10R1.113 OB(O)C1=CC=CC(Br)=C1 016107 [1,0,0,0,0,0|2,0,1]=4 127 B10R1.113 OB(O)C1=CC=CC(F)=C1 010996 [1,0,0,0,0,0|2,0,1]=4 128 B10R1.113 OB(O)C1=CC=CC(S)=C1 334272 [1,0,0,0,0,0|1,1,1]=4 129 B10R1.172 C#CC1=CC(OC)=CC=C1 046073 [1,0,0,0,0,0|1,0,1]=3 130 B10R1.172 CCC1=CC(C#N)=CC=C1 208791 [1,0,0,0,0,0|2,0,1]=4 131 B10R1.172 COC1=CC(C=O)=CC=C1 208834 [1,0,0,0,0,0|0,0,0]=1 132 B10R1.172 COC1=CC(CCl)=CC=C1 018781 [1,0,0,0,0,0|1,0,1]=3 133 B10R1.172 COC1=CC(CO)=CC=C1 235697 [1,0,0,0,0,0|0,0,1]=2 134 B10R1.172 COC1=CC=CC(C#N)=C1 035585 [1,0,0,0,0,0|1,0,1]=3 135 B10R1.172 COC1=CC=CC(C=O)=N1 065223 [1,0,0,0,0,0|1,0,0]=2 136 B10R1.172 COC1=CC=CC(CBr)=C1 067808 [1,0,0,0,0,0|1,0,1]=3 137 B10R1.172 COC1=CC=CC(CN)=C1 008880 [1,0,0,0,0,0|1,0,1]=3 138 B10R1.172 COC1=CC=CC(NN)=C1 043642 [1,0,0,0,0,0|2,0,0]=3 139 B10R1.172 COC1=CC=CC(OC)=C1 216356 [1,0,0,0,0,0|2,0,0]=3 140 B10R1.172 COC1=CC=CC(OC)=N1 045228 [1,0,0,0,0,0|3,0,0]=4 141 B10R1.172 COC1=CC=CC(SC)=C1 019335 [1,0,0,0,0,0|2,0,0]=3 142 B10R1.172 COC1=NC=CC(C#N)=C1 068359 [1,0,0,0,0,0|2,0,1]=4 143 B10R1.172 COC1=NC=CC(CN)=C1 065469 [1,0,0,0,0,0|2,0,1]=4 144 B10R1.172 N#CC1=CC(CO)=CC=C1 208807 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.172 N#CC1=CC=CC(C=O)=C1 021882 [1,0,0,0,0,0|2,0,0]=3 146 B10R1.172 O=CC1=CC=CC(C=O)=C1 079861 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.172 O=CC1=CC=CC(C=O)=N1 011851 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.172 OCC1=CC=CC(CO)=C1 463279 [1,0,0,0,0,0|2,0,1]=4 149 B12R1.11 COC1=CC(Br)=CC(C(=O)O)=C1 211454 [0,1,0,0,0,0|0,0,0]=1 150 B12R1.11 COC1=CC(Br)=CC([N+](=O)[O-])=C1 037759 [0,1,0,0,0,0|1,0,1]=3 151 B12R1.11 COC1=CC(Cl)=CC(B(O)O)=C1 219392 [0,1,0,0,0,0|1,0,1]=3 152 B12R1.11 COC1=CC(F)=CC(B(O)O)=C1 016207 [0,1,0,0,0,0|1,0,1]=3 153 B12R1.11 COC1=CC(F)=CC([N+](=O)[O-])=C1 218724 [0,1,0,0,0,0|1,0,1]=3 154 B12R1.11 COC1=CC([N+](=O)[O-])=CC(N)=C1 014176 [0,1,0,0,0,0|1,0,1]=3 155 B12R1.11 COC1=NC(Cl)=CC(C(=O)O)=C1 017198 [0,1,0,0,0,0|1,0,0]=2 156 B12R1.11 N#CC1=CC(F)=CC(C(=O)O)=C1 013901 [0,1,0,0,0,0|2,0,0]=3 157 B12R1.56 CCC1=C(Cl)C=CC(C(=O)O)=C1 069717 [0,1,0,0,0,0|1,0,0]=2 158 B12R1.56 CCC1=CC(C(=O)O)=CC=C1Br 069710 [0,1,0,0,0,0|1,0,0]=2 159 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 048788 [0,1,0,0,0,0|0,0,0]=1 160 B12R1.56 COC1=C(Br)C=CC([N+](=O)[O-])=C1 035097 [0,1,0,0,0,0|1,0,1]=3 161 B12R1.56 COC1=C(Cl)C=CC([N+](=O)[O-])=C1 003636 [0,1,0,0,0,0|1,0,1]=3 162 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 005490 [0,1,0,0,0,0|0,0,0]=1 163 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 013010 [0,1,0,0,0,0|1,0,0]=2 164 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 149002 [0,1,0,0,0,0|1,0,1]=3 165 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 035780 [0,1,0,0,0,0|0,0,0]=1 166 B12R1.56 COC1=C(N)C=CC([N+](=O)[O-])=C1 154100 [0,1,0,0,0,0|1,0,1]=3 167 B12R1.56 COC1=CC(B(O)O)=CC=C1C 219427 [0,1,0,0,0,0|1,0,1]=3 168 B12R1.56 COC1=CC(C(=O)O)=CC=C1C 092939 [0,1,0,0,0,0|0,0,0]=1 169 B12R1.56 COC1=CC(C(=O)O)=CC=C1O 075247 [0,1,0,0,0,0|0,0,0]=1 170 B12R1.56 COC1=CC(C(C)=O)=CC=C1O 227636 [0,1,0,0,0,0|1,0,0]=2 171 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1C 040263 [0,1,0,0,0,0|1,0,1]=3 172 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1F 045066 [0,1,0,0,0,0|1,0,1]=3 173 B12R1.56 COC1=CC([N+](=O)[O-])=CC=C1O 013672 [0,1,0,0,0,0|1,0,1]=3 174 B12R1.56 N#CC1=C(Br)C=CC(C(=O)O)=C1 237738 [0,1,0,0,0,0|2,0,0]=3 175 B12R1.258 C=C(C)C1=CC=CC(C(=C)C)=C1 094819 [0,1,0,0,0,0|3,0,0]=4 176 B12R1.258 CC(=O)C1=CC(C(=O)O)=CC=C1 021668 [0,1,0,0,0,0|1,0,0]=2 177 B12R1.258 CC(=O)C1=CC=CC(B(O)O)=C1 021605 [0,1,0,0,0,0|2,0,1]=4 178 B12R1.258 CC(=O)C1=CC=CC(C(C)=O)=N1 011668 [0,1,0,0,0,0|3,0,0]=4 179 B12R1.258 CC(=O)C1=CC=CC([N+](=O)[O-])=C1 216432 [0,1,0,0,0,0|2,0,1]=4 180 B12R1.258 CC(C)C1=CC(B(O)O)=CC=C1 078647 [0,1,0,0,0,0|2,0,1]=4 181 B12R1.258 CC(C)C1=CC=CC(C(=O)O)=C1 037566 [0,1,0,0,0,0|1,0,0]=2 182 B12R1.258 CN(C)C1=CC([N+](=O)[O-])=CC=C1 317425 [0,1,0,0,0,0|2,0,1]=4 183 B12R1.258 CN(C)C1=CC=CC(C(=O)O)=C1 065807 [0,1,0,0,0,0|1,0,0]=2 184 B12R1.258 NC(=O)C1=CC(B(O)O)=CC=C1 036708 [0,1,0,0,0,0|3,0,0]=4 185 B12R1.258 NC(=O)C1=CC([N+](=O)[O-])=CC=C1 456437 [0,1,0,0,0,0|3,0,0]=4 186 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=C1 053365 [0,1,0,0,0,0|3,0,0]=4 187 B12R1.258 O=C(O)C1=CC(C(=O)O)=NC=C1 209439 [0,1,0,0,0,0|3,0,0]=4 188 B12R1.258 O=C(O)C1=CC=CC(B(O)O)=C1 010785 [0,1,0,0,0,0|2,0,0]=3 189 B12R1.258 O=C(O)C1=CC=CC(C(=O)O)=C1 240952 [0,1,0,0,0,0|2,0,0]=3 190 B12R1.258 O=C(O)C1=CC=CC(C(=O)O)=N1 066072 [0,1,0,0,0,0|3,0,0]=4 191 B12R1.258 O=C(O)C1=CC=CC([N+](=O)[O-])=C1 209438 [0,1,0,0,0,0|2,0,0]=3 192 B12R1.258 O=C(O)C1=CN=CC(C(=O)O)=C1 043366 [0,1,0,0,0,0|3,0,0]=4 193 B12R1.279 CC(=O)C1=CC=CC(N=C=O)=C1 365579 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.279 CC(=O)C1=CC=CC(N=C=S)=C1 018153 [0,1,0,0,0,0|2,0,1]=4 195 B12R1.279 CCOC1=CC(C(N)=S)=CC=C1 346736 [0,1,0,0,0,0|1,1,0]=3 196 B12R1.279 CCOC1=CC=CC(B(O)O)=C1 040251 [0,1,0,0,0,0|1,0,1]=3 197 B12R1.279 CNCC1=CC=CC([N+](=O)[O-])=C1 076659 [0,1,0,0,0,0|2,0,1]=4 198 B12R1.279 NCCC1=CC=CC([N+](=O)[O-])=C1 231246 [0,1,0,0,0,0|2,0,1]=4 199 B12R1.279 O=C(O)C1=CC=CC(N=C=S)=C1 008757 [0,1,0,0,0,0|1,0,1]=3 200 B12R1.279 O=[N+]([O-])C1=CC(CCO)=CC=C1 220568 [0,1,0,0,0,0|2,0,1]=4 201 B12R1.279 OCCC1=CC(B(O)O)=CC=C1 234162 [0,1,0,0,0,0|2,0,1]=4 202 B12R1.435 COC(=O)C1=CC(CBr)=CC=C1 066804 [0,1,0,0,0,0|2,0,0]=3 203 B12R1.435 COC(=O)C1=CC=CC(C#N)=C1 078586 [0,1,0,0,0,0|2,0,0]=3 204 B12R1.435 COC(=O)C1=CC=CC(C=O)=C1 078656 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 023467 [0,1,0,0,0,0|2,0,0]=3 206 B12R1.435 COC(=O)C1=CC=CC(OC)=C1 239390 [0,1,0,0,0,0|0,0,0]=1 207 B12R1.435 COC(=O)C1=CC=C[N+](OC)=C1 181930 [0,1,0,0,0,0|1,0,0]=2 208 B12R1.435 COC(=O)C1=CC=NC(C#N)=C1 077572 [0,1,0,0,0,0|3,0,0]=4 209 B12R1.435 COC(=O)C1=NC(CO)=CC=C1 214916 [0,1,0,0,0,0|3,0,0]=4 210 B12R1.435 COC1=CC(C(=O)NN)=CC=C1 018770 [0,1,0,0,0,0|1,0,0]=2 211 B12R1.435 COC1=CC(\C(N)=N\O)=CC=C1 316435 [0,1,0,0,0,0|1,0,0]=2 212 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 018069 [0,1,0,0,0,0|1,0,0]=2 213 B12R1.435 N#CC1=CC(C(=O)NN)=CC=C1 061268 [0,1,0,0,0,0|3,0,0]=4 214 B12R1.435 N#CC1=CC=CC(C(=O)CBr)=C1 018078 [0,1,0,0,0,0|3,0,0]=4 215 B12R1.436 COC1=CC(C(F)(F)F)=CC=C1 007579 [0,1,0,0,0,0|2,0,1]=4 216 B12R1.436 COC1=CC=CC(S(=O)(=O)Cl)=C1 008892 [0,1,0,0,0,0|1,0,1]=3 217 B12R1.436 COC1=CC=CC(S(N)(=O)=O)=C1 034663 [0,1,0,0,0,0|1,0,1]=3 218 B12R1.436 COC1=CC=CC([B-](F)(F)F)=C1 034896 [0,1,0,0,0,0|3,0,0]=4 219 B12R1.440 COC1=C(N)C(C(=O)O)=CC=C1 065824 [0,1,0,0,0,0|0,0,0]=1 220 B12R1.440 COC1=CC=CC(B(O)O)=C1F 033098 [0,1,0,0,0,0|1,0,1]=3 221 B12R1.440 COC1=CC=CC(C(=O)O)=C1F 035004 [0,1,0,0,0,0|0,0,0]=1 222 B12R1.440 COC1=CC=CC([N+](=O)[O-])=C1C 068330 [0,1,0,0,0,0|1,0,1]=3 223 B12R1.453 CCC1=CC=C(O)C(C(C)=O)=C1 012073 [0,1,0,0,0,0|2,0,0]=3 224 B12R1.453 COC1=CC(B(O)O)=C(F)C=C1 044629 [0,1,0,0,0,0|1,0,1]=3 225 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 033755 [0,1,0,0,0,0|0,0,0]=1 226 B12R1.453 COC1=CC(C(=O)O)=C(N)C=C1 013749 [0,1,0,0,0,0|0,0,0]=1 227 B12R1.453 COC1=CC([N+](=O)[O-])=C(C)C=C1 040266 [0,1,0,0,0,0|1,0,1]=3 228 B12R1.453 COC1=CC([N+](=O)[O-])=C(Cl)C=C1 049179 [0,1,0,0,0,0|1,0,1]=3 229 B12R1.453 COC1=CC([N+](=O)[O-])=C(I)C=C1 237107 [0,1,0,0,0,0|1,0,1]=3 230 B12R1.453 COC1=CC=C(Br)C(C(=O)O)=C1 092320 [0,1,0,0,0,0|0,0,0]=1 231 B12R1.453 COC1=CC=C(Br)C([N+](=O)[O-])=C1 005873 [0,1,0,0,0,0|1,0,1]=3 232 B12R1.453 COC1=CC=C(C)C(C(=O)O)=C1 038681 [0,1,0,0,0,0|0,0,0]=1 233 B12R1.453 COC1=CC=C(Cl)C(B(O)O)=C1 065562 [0,1,0,0,0,0|1,0,1]=3 234 B12R1.453 COC1=CC=C(N)C([N+](=O)[O-])=C1 078105 [0,1,0,0,0,0|1,0,1]=3 235 B12R1.453 COC1=CC=C(O)C(C(=O)O)=C1 218970 [0,1,0,0,0,0|0,0,0]=1 236 B12R1.453 CSC1=NC=C(Br)C(C(=O)O)=N1 049733 [0,1,0,0,0,0|2,1,0]=4 237 B12R1.453 N#CC1=CC(C(=O)O)=C(Br)C=C1 069373 [0,1,0,0,0,0|2,0,0]=3 238 B12R1.453 N#CC1=CC=C(F)C(C(=O)O)=C1 092334 [0,1,0,0,0,0|2,0,0]=3 239 B12R1.453 O=CC1=CC(C(=O)O)=C(O)C=C1 013893 [0,1,0,0,0,0|2,0,0]=3 240 B10R1.31 COC1=NOC(C(=O)O)=C1 219610 [0,0,0,0,1,0|2,0,0]=3 241 B10R1.31 O=C(O)C1=CC=C(CO)O1 029067 [0,0,0,0,1,0|3,0,0]=4 242 B10R1.31 O=CC1=CC=C(C(=O)O)O1 009253 [0,0,0,0,1,0|3,0,0]=4 243 B10R1.31 O=CC1=CC=C(C(=O)O)S1 009254 [0,0,0,0,1,0|3,0,0]=4 244 B10R1.39 CCN1C=CC=C1C(C)=O 002746 [0,0,0,0,1,0|3,0,0]=4 245 B10R1.39 CCN1N=CC=C1C(=O)O 014531 [0,0,0,0,1,0|3,0,0]=4 246 B12R1.438 CC(=O)NC1=CC(CN)=CC=C1 023465 [0,0,0,0,0,1|3,0,0]=4 247 B12R1.438 CC(=O)OC1=CC=CC(C=O)=C1 002484 [0,0,0,0,0,1|3,0,0]=4 248 B12R1.438 COC1=CC(NC(N)=O)=CC=C1 092009 [0,0,0,0,0,1|1,0,0]=2 249 B12R1.438 COC1=CC(NC(N)=S)=CC=C1 018809 [0,0,0,0,0,1|1,1,0]=3 250 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 018795 [0,0,0,0,0,1|0,0,0]=1 251 B12R1.438 CSC1=CC=CC(NC(N)=S)=C1 018880 [0,0,0,0,0,1|1,2,0]=4 252 B12R1.438 CSC1=CC=CC(OC(C)=O)=C1 103242 [0,0,0,0,0,1|1,1,0]=3 253 B9R1.2 C#CC1=CC(C)=CC=C1 040032 [2,0,0,0,0,0|1,0,1]=4 254 B9R1.2 C#CC1=CC=CC(O)=C1 239150 [2,0,0,0,0,0|1,0,1]=4 255 B9R1.2 C(=O)C1=CC(Br)=CC=C1 003060 [2,0,0,0,0,0|1,0,0]=3 256 B9R1.2 C(=O)C1=CC(C)=CC=C1 001390 [2,0,0,0,0,0|0,0,0]=2 257 B9R1.2 C=CC1=CC(Br)=CC=C1 001731 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.2 CC1=CC(C=O)=NC=C1 033041 [2,0,0,0,0,0|1,0,0]=3 259 B9R1.2 CC1=CC(NN)=CC=C1 033721 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.2 CC1=CC=CC(C#N)=C1 035881 [2,0,0,0,0,0|1,0,1]=4 261 B9R1.2 CC1=CC=CC(C=O)=N1 021900 [2,0,0,0,0,0|1,0,0]=3 262 B9R1.2 CC1=CC=CC(CBr)=C1 067812 [2,0,0,0,0,0|1,0,1]=4 263 B9R1.2 CC1=CC=CC(CN)=C1 008878 [2,0,0,0,0,0|1,0,1]=4 264 B9R1.2 CC1=CC=CC(CO)=C1 102453 [2,0,0,0,0,0|0,0,1]=3 265 B9R1.2 CC1=CC=CC(CO)=N1 092614 [2,0,0,0,0,0|1,0,1]=4 266 B9R1.2 CCC1=CC(I)=CC=C1 037712 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.2 CCC1=CC=CC(Br)=C1 024168 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.2 CCC1=CC=CC(N)=C1 043276 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.2 CNC1=CC(Cl)=CC=C1 009649 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.2 CNC1=CC(F)=CC=C1 019287 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.2 CNC1=CC=CC(Br)=C1 045857 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.2 COC1=CC(Br)=CC=C1 003058 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.2 COC1=CC(F)=CC=C1 002695 [2,0,0,0,0,0|1,0,0]=3 274 B9R1.2 COC1=CC(F)=NC=C1 043905 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.2 COC1=CC(I)=CC=C1 001303 [2,0,0,0,0,0|1,0,0]=3 276 B9R1.2 COC1=CC(N)=NC=C1 043010 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.2 COC1=CC(O)=CC=C1 235567 [2,0,0,0,0,0|0,0,0]=2 278 B9R1.2 COC1=CC=CC(C)=C1 342147 [2,0,0,0,0,0|0,0,1]=3 279 B9R1.2 COC1=CC=CC(Cl)=C1 118300 [2,0,0,0,0,0|1,0,0]=3 280 B9R1.2 COC1=CC=CC(N)=C1 043402 [2,0,0,0,0,0|1,0,0]=3 281 B9R1.2 COC1=CC=CC(N)=N1 043829 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.2 COC1=CC=CC(S)=C1 001309 [2,0,0,0,0,0|0,1,0]=3 283 B9R1.2 COC1=CN=CC(I)=C1 038147 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.2 COC1=CN=CC(N)=C1 048102 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.2 COC1=NC(Br)=CC=C1 045063 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.2 COC1=NC(C)=CC=C1 040046 [2,0,0,0,0,0|1,0,1]=4 287 B9R1.2 COC1=NC(Cl)=CC=C1 045005 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.2 COC1=NC=CC(Br)=C1 036245 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.2 COC1=NC=CC(F)=C1 208735 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.2 COC1=NC=CC(N)=C1 036821 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.2 CSC1=CC(Br)=CC=C1 003661 [2,0,0,0,0,0|1,1,0]=4 292 B9R1.2 CSC1=CC(C)=CC=C1 019356 [2,0,0,0,0,0|0,1,1]=4 293 B9R1.2 CSC1=CC(Cl)=CC=C1 003553 [2,0,0,0,0,0|1,1,0]=4 294 B9R1.2 CSC1=CC(F)=CC=C1 019273 [2,0,0,0,0,0|1,1,0]=4 295 B9R1.2 CSC1=CC(I)=CC=C1 094459 [2,0,0,0,0,0|1,1,0]=4 296 B9R1.2 CSC1=CC([Mg+])=CC=C1 397737 [2,0,0,0,0,0|1,1,0]=4 297 B9R1.2 CSC1=CC=CC(N)=C1 018141 [2,0,0,0,0,0|1,1,0]=4 298 B9R1.2 N#CC1=CC(O)=CC=C1 049834 [2,0,0,0,0,0|1,0,1]=4 299 B9R1.2 NC1=CC=CC(CO)=C1 008828 [2,0,0,0,0,0|1,0,1]=4 300 B9R1.2 NCC1=CC=CC(O)=C1 023455 [2,0,0,0,0,0|1,0,1]=4 301 B9R1.2 O=CC1=CC(Br)=CN=C1 037001 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.2 O=CC1=CC(Cl)=CC=C1 032762 [2,0,0,0,0,0|1,0,0]=3 303 B9R1.2 O=CC1=CC(F)=CC=C1 001668 [2,0,0,0,0,0|1,0,0]=3 304 B9R1.2 O=CC1=CC(F)=NC=C1 036282 [2,0,0,0,0,0|2,0,0]=4 305 B9R1.2 O=CC1=CC(O)=CC=C1 044196 [2,0,0,0,0,0|0,0,0]=2 306 B9R1.2 O=CC1=CC=CC(I)=C1 079137 [2,0,0,0,0,0|1,0,0]=3 307 B9R1.2 O=CC1=NC(Br)=CC=C1 011583 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.2 O=CC1=NC=CC(Br)=C1 077333 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.2 OCC1=CC(Br)=CC=C1 001365 [2,0,0,0,0,0|1,0,1]=4 310 B9R1.2 OCC1=CC(Cl)=CC=C1 001376 [2,0,0,0,0,0|1,0,1]=4 311 B9R1.2 OCC1=CC(F)=CC=C1 002170 [2,0,0,0,0,0|1,0,1]=4 312 B9R1.6 C=C(C)C1=CC=CC=C1 245708 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.6 CC(=O)C1=CC=CC=C1 043319 [2,0,0,0,0,0|1,0,0]=3 314 B9R1.6 CC(=O)C1=CC=CN=C1 032763 [2,0,0,0,0,0|2,0,0]=4 315 B9R1.6 CC(=O)C1=CC=NC=C1 033067 [2,0,0,0,0,0|2,0,0]=4 316 B9R1.6 CC(=O)C1=NC=CC=C1 044389 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.6 CC(O)C1=CC=CC=C1 098924 [2,0,0,0,0,0|1,0,1]=4 318 B9R1.6 CS(=O)C1=CC=CC=C1 180124 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.6 C[C@@H](O)C1=CC=CC=C1 222634 [2,0,0,0,0,0|1,0,1]=4 320 B9R1.6 N=C(N)C1=CC=CC=C1 044622 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.6 N=C(N)C1=CC=CC=C1 067951 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.6 N=C(N)C1=CC=CC=C1 099104 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.6 N=C(N)C1=CC=CC=C1 102340 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.6 NC(=O)C1=CC=CC=C1 099462 [2,0,0,0,0,0|1,0,0]=3 325 B9R1.6 NC(=O)C1=CC=NC=C1 079012 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.6 NC(=O)C1=CN=CC=C1 239905 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.6 NC(=O)C1=NC=CC=C1 235663 [2,0,0,0,0,0|2,0,0]=4 328 B9R1.6 NC(=S)C1=CC=CC=C1 067940 [2,0,0,0,0,0|1,1,0]=4 329 B9R1.6 O=C(Cl)C1=CC=CC=C1 097787 [2,0,0,0,0,0|1,0,0]=3 330 B9R1.6 O=C(Cl)C1=CC=CC=C1 102565 [2,0,0,0,0,0|1,0,0]=3 331 B9R1.6 O=C(Cl)C1=CC=CN=C1 053251 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.6 O=C(Cl)C1=CC=NC=C1 066672 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.6 O=C(Cl)C1=NC=CC=C1 166500 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.6 O=C(O)C1=CC=CC=C1 102544 [2,0,0,0,0,0|0,0,0]=2 335 B9R1.6 O=C(O)C1=CC=CC=C1 237766 [2,0,0,0,0,0|0,0,0]=2 336 B9R1.6 O=C(O)C1=CC=CN=C1 106451 [2,0,0,0,0,0|1,0,0]=3 337 B9R1.6 O=C(O)C1=CC=NC=C1 045226 [2,0,0,0,0,0|1,0,0]=3 338 B9R1.6 O=C(O)C1=CC=NN=C1 023601 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.6 O=C(O)C1=CN=CC=C1 214893 [2,0,0,0,0,0|1,0,0]=3 340 B9R1.6 O=C(O)C1=CN=CN=C1 023569 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.6 O=C(O)C1=NC=CC=C1 043385 [2,0,0,0,0,0|1,0,0]=3 342 B9R1.6 O=C(O)C1=NC=CC=N1 043596 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.6 O=C(O)C1=NC=CN=C1 066244 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.6 O=C(O)C1=NC=NC=C1 066253 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.6 O=C(O)C1=NN=CC=C1 047653 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.6 O=C([O-])C1=CC=CC=C1 094455 [2,0,0,0,0,0|0,0,1]=3 347 B9R1.6 O=C([O-])C1=CC=CC=C1 095369 [2,0,0,0,0,0|0,0,1]=3 348 B9R1.6 O=C([O-])C1=CC=CC=C1 099144 [2,0,0,0,0,0|0,0,1]=3 349 B9R1.6 O=C([O-])C1=CC=CC=C1 239403 [2,0,0,0,0,0|0,0,1]=3 350 B9R1.6 O=C([O-])C1=CN=CC=C1 245943 [2,0,0,0,0,0|1,0,1]=4 351 B9R1.6 O=S([O-])C1=CC=CC=C1 003814 [2,0,0,0,0,0|1,0,1]=4 352 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 094600 [2,0,0,0,0,0|1,0,1]=4 353 B9R1.6 O=[PH](O)C1=CC=CC=C1 003643 [2,0,0,0,0,0|1,0,0]=3 354 B9R1.6 O=[Se](O)C1=CC=CC=C1 005551 [2,0,0,0,0,0|1,0,0]=3 355 B9R1.6 OB(O)C1=CC=CC=C1 019491 [2,0,0,0,0,0|1,0,1]=4 356 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 010205 [1,1,0,0,0,0|2,0,0]=4 357 B11R1.21 CC(=O)C1=CC(C)=C(O)C=C1 024848 [1,1,0,0,0,0|1,0,0]=3 358 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 004415 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.21 CC(=O)C1=CC(F)=C(C)C=C1 005782 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 013798 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 002078 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 013006 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 036036 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 002544 [1,1,0,0,0,0|1,0,0]=3 365 B11R1.21 CC1=C(Br)C=C(C(=O)Cl)C=C1 014697 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.21 CC1=C(Br)C=C(C(N)=O)C=C1 094072 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.21 CC1=C(Br)C=CC(C(=O)Cl)=C1 062791 [1,1,0,0,0,0|1,0,0]=3 368 B11R1.21 CC1=C(Br)C=CC([N+](=O)[O-])=C1 001131 [1,1,0,0,0,0|1,0,1]=4 369 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 045282 [1,1,0,0,0,0|1,0,1]=4 370 B11R1.21 CC1=C(C)C=C(C(=O)Cl)C=C1 014686 [1,1,0,0,0,0|1,0,0]=3 371 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 044555 [1,1,0,0,0,0|0,0,0]=2 372 B11R1.21 CC1=C(Cl)C=C(C(=O)Cl)C=C1 062744 [1,1,0,0,0,0|2,0,0]=4 373 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 120215 [1,1,0,0,0,0|1,0,0]=3 374 B11R1.21 CC1=C(F)C=C(C(=O)Cl)C=C1 005791 [1,1,0,0,0,0|2,0,0]=4 375 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 001468 [1,1,0,0,0,0|1,0,0]=3 376 B11R1.21 CC1=C(F)C=C(C(N)=O)C=C1 005786 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 033099 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.21 CC1=C(F)C=CC(C(=O)Cl)=C1 005792 [1,1,0,0,0,0|1,0,0]=3 379 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 005790 [1,1,0,0,0,0|0,0,0]=2 380 B11R1.21 CC1=C(F)C=CC(C(N)=O)=C1 005787 [1,1,0,0,0,0|1,0,0]=3 381 B11R1.21 CC1=C(F)C=CC([N+](=O)[O-])=C1 002351 [1,1,0,0,0,0|1,0,1]=4 382 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 013858 [1,1,0,0,0,0|1,0,0]=3 383 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 018745 [1,1,0,0,0,0|0,0,0]=2 384 B11R1.21 CC1=C(I)C=CC(C(N)=O)=C1 104052 [1,1,0,0,0,0|1,0,0]=3 385 B11R1.21 CC1=C(I)C=CC([N+](=O)[O-])=C1 018748 [1,1,0,0,0,0|1,0,1]=4 386 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 047883 [1,1,0,0,0,0|1,0,0]=3 387 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 019461 [1,1,0,0,0,0|0,0,0]=2 388 B11R1.21 CC1=C(N)C=CC([N+](=O)[O-])=C1 098656 [1,1,0,0,0,0|1,0,1]=4 389 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 018719 [1,1,0,0,0,0|0,0,0]=2 390 B11R1.21 CC1=CC(B(O)O)=CC=C1Cl 093028 [1,1,0,0,0,0|1,0,1]=4 391 B11R1.21 CC1=CC(C(=O)O)=CC=C1Br 018296 [1,1,0,0,0,0|0,0,0]=2 392 B11R1.21 CC1=CC(C(=O)O)=CC=C1Cl 018394 [1,1,0,0,0,0|0,0,0]=2 393 B11R1.21 CC1=CC(C(N)=O)=CC=C1Br 080101 [1,1,0,0,0,0|1,0,0]=3 394 B11R1.21 CC1=CC([N+](=O)[O-])=CC=C1O 209118 [1,1,0,0,0,0|1,0,1]=4 395 B11R1.21 CC1=CC=C(C(=O)O)C=C1Br 075171 [1,1,0,0,0,0|1,0,0]=3 396 B11R1.21 CC1=CC=C(C(N)=O)C=C1C 091232 [1,1,0,0,0,0|1,0,0]=3 397 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1C 227721 [1,1,0,0,0,0|1,0,1]=4 398 B11R1.21 CN1C=CC(C(=O)O)=CC1=O 041839 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.21 NC(=O)C1=CC(Br)=C(F)C=C1 094071 [1,1,0,0,0,0|2,0,0]=4 400 B11R1.21 NC(=O)C1=CC(Cl)=C(Cl)C=C1 068041 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.21 NC(=O)C1=CC(Cl)=C(F)C=C1 004424 [1,1,0,0,0,0|2,0,0]=4 402 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 004778 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.21 NC(=O)C1=CC=C(Br)C(F)=C1 080105 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.21 NC(=O)C1=CC=C(Br)C(I)=C1 050136 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.21 NC(=O)C1=CC=C(Cl)C(Br)=C1 080102 [1,1,0,0,0,0|2,0,0]=4 406 B11R1.21 NC(=O)C1=CC=C(Cl)C(F)=C1 234558 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 065847 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 021888 [1,1,0,0,0,0|1,0,0]=3 409 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 033910 [1,1,0,0,0,0|1,0,0]=3 410 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 013032 [1,1,0,0,0,0|1,0,0]=3 411 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 065683 [1,1,0,0,0,0|0,0,0]=2 412 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 065840 [1,1,0,0,0,0|1,0,0]=3 413 B11R1.21 NC1=CC=C(C(=O)O)C=C1N 003415 [1,1,0,0,0,0|1,0,0]=3 414 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1O 068239 [1,1,0,0,0,0|1,0,1]=4 415 B11R1.21 O=C(Cl)C1=CC(Br)=C(F)C=C1 032957 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 358152 [1,1,0,0,0,0|2,0,0]=4 417 B11R1.21 O=C(Cl)C1=CC(Cl)=C(F)C=C1 007836 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.21 O=C(Cl)C1=CC(F)=C(Cl)C=C1 038158 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 002083 [1,1,0,0,0,0|2,0,0]=4 420 B11R1.21 O=C(Cl)C1=CC=C(Br)C(F)=C1 038142 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 005474 [1,1,0,0,0,0|1,0,0]=3 422 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 038131 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 127105 [1,1,0,0,0,0|1,0,0]=3 424 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 010699 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 002149 [1,1,0,0,0,0|1,0,0]=3 426 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 005476 [1,1,0,0,0,0|1,0,0]=3 427 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 005183 [1,1,0,0,0,0|1,0,0]=3 428 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 002080 [1,1,0,0,0,0|1,0,0]=3 429 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 013030 [1,1,0,0,0,0|1,0,0]=3 430 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 119801 [1,1,0,0,0,0|1,0,0]=3 431 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 048775 [1,1,0,0,0,0|0,0,0]=2 432 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 065618 [1,1,0,0,0,0|0,0,0]=2 433 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 009206 [1,1,0,0,0,0|0,0,0]=2 434 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 043464 [1,1,0,0,0,0|0,0,0]=2 435 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 110500 [1,1,0,0,0,0|1,0,0]=3 436 B11R1.21 O=C(O)C1=CC=C(I)C(F)=C1 078055 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 078581 [1,1,0,0,0,0|0,0,0]=2 438 B11R1.21 O=C(O)C1=CC=C(O)C(Br)=C1 240961 [1,1,0,0,0,0|1,0,0]=3 439 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 018380 [1,1,0,0,0,0|2,0,0]=4 440 B11R1.21 O=[N+]([O-])C1=CC=C(Br)C(O)=C1 218412 [1,1,0,0,0,0|1,0,1]=4 441 B11R1.21 O=[N+]([O-])C1=CC=C(Cl)C(O)=C1 076706 [1,1,0,0,0,0|1,0,1]=4 442 B11R1.21 O=[N+]([O-])C1=CC=C(F)C(O)=C1 092322 [1,1,0,0,0,0|1,0,1]=4 443 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(O)=C1 209169 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.23 CC1=CC(\C(N)=N\O)=CC=C1 017315 [1,1,0,0,0,0|1,0,0]=3 445 B11R1.23 CCC(=O)C1=CC(Cl)=CC=C1 003621 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.23 CCC(=O)C1=CC=CC(Br)=C1 114000 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.23 CCC(=O)C1=CC=CC(C)=C1 240661 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.23 CNC(=O)C1=CC(C)=CC=C1 094995 [1,1,0,0,0,0|1,0,0]=3 449 B11R1.23 CNC(=O)C1=CC(F)=CC=C1 448487 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.23 CNC(=O)C1=CC(I)=CC=C1 104053 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.23 CNC(=O)C1=CC=CC(N)=C1 036759 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 017390 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 236597 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.23 COC(=O)C1=CC(C)=CC=C1 358396 [1,1,0,0,0,0|0,0,0]=2 455 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 013133 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.23 COC(=O)C1=CC(F)=CC=C1 009502 [1,1,0,0,0,0|1,0,0]=3 457 B11R1.23 COC(=O)C1=CC(I)=CC=C1 037328 [1,1,0,0,0,0|1,0,0]=3 458 B11R1.23 COC(=O)C1=CC(O)=CN=C1 009282 [1,1,0,0,0,0|1,0,0]=3 459 B11R1.23 COC(=O)C1=CC=CC(=O)N1 231201 [1,1,0,0,0,0|1,0,1]=4 460 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 155102 [1,1,0,0,0,0|1,0,0]=3 461 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 049693 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 243026 [1,1,0,0,0,0|1,0,0]=3 463 B11R1.23 COC(=O)C1=CC=CC(N)=C1 038247 [1,1,0,0,0,0|1,0,0]=3 464 B11R1.23 COC(=O)C1=CC=CC(O)=C1 078900 [1,1,0,0,0,0|0,0,0]=2 465 B11R1.23 COC(=O)C1=CC=C[N+]([O-])=C1 032582 [1,1,0,0,0,0|1,0,1]=4 466 B11R1.23 COC(=O)C1=CN=CC(C)=C1 078340 [1,1,0,0,0,0|1,0,0]=3 467 B11R1.23 COC(=O)C1=NC(C)=CC=C1 032619 [1,1,0,0,0,0|1,0,0]=3 468 B11R1.23 COC(=O)C1=NC(N)=CC=C1 078136 [1,1,0,0,0,0|2,0,0]=4 469 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 043009 [1,1,0,0,0,0|2,0,0]=4 470 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 066860 [1,1,0,0,0,0|2,0,0]=4 471 B11R1.23 C\C(=N/O)C1=CC(Cl)=CC=C1 075943 [1,1,0,0,0,0|2,0,0]=4 472 B11R1.23 C\C(=N\O)C1=CC=CC(N)=C1 076019 [1,1,0,0,0,0|2,0,0]=4 473 B11R1.23 NC1=CC(\C(N)=N\O)=CC=C1 040163 [1,1,0,0,0,0|2,0,0]=4 474 B11R1.23 NNC(=O)C1=CC(F)=CC=C1 006189 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.23 NNC(=O)C1=CC(I)=CC=C1 018735 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.23 NNC(=O)C1=CC(O)=CC=C1 018714 [1,1,0,0,0,0|1,0,0]=3 477 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 018243 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 018359 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.23 N\C(=N/O)C1=CC(O)=CC=C1 351668 [1,1,0,0,0,0|1,0,0]=3 480 B11R1.23 O=C(CBr)C1=CC(Br)=CC=C1 011106 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 017212 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 006313 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.23 O=C(OO)C1=CC(Cl)=CC=C1 080350 [1,1,0,0,0,0|1,0,0]=3 484 B11R1.23 O=CC(=O)C1=CC=CC(Br)=C1 033145 [1,1,0,0,0,0|1,0,1]=4 485 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 035945 [1,1,0,0,0,0|1,0,1]=4 486 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 037867 [1,1,0,0,0,0|1,0,0]=3 487 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 022391 [1,1,0,0,0,0|2,0,0]=4 488 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 002108 [1,1,0,0,0,0|2,0,0]=4 489 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 021304 [1,1,0,0,0,0|1,0,0]=3 490 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 038171 [1,1,0,0,0,0|0,0,0]=2 491 B11R1.74 CC1=CC(C(=O)Cl)=CC(Cl)=C1 062745 [1,1,0,0,0,0|1,0,0]=3 492 B11R1.74 CC1=CC(C(=O)Cl)=CC(F)=C1 062682 [1,1,0,0,0,0|1,0,0]=3 493 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 225100 [1,1,0,0,0,0|1,0,0]=3 494 B11R1.74 CC1=CC(C(N)=O)=CC(F)=C1 094069 [1,1,0,0,0,0|1,0,0]=3 495 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 010993 [1,1,0,0,0,0|1,0,1]=4 496 B11R1.74 CC1=CC(C)=CC(C(=O)Cl)=C1 014687 [1,1,0,0,0,0|1,0,0]=3 497 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 037423 [1,1,0,0,0,0|0,0,0]=2 498 B11R1.74 CC1=CC(C)=CC(C(N)=O)=C1 091233 [1,1,0,0,0,0|1,0,0]=3 499 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 037650 [1,1,0,0,0,0|0,0,0]=2 500 B11R1.74 CC1=CC(F)=CC(B(O)O)=C1 092397 [1,1,0,0,0,0|1,0,1]=4 501 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 037154 [1,1,0,0,0,0|0,0,0]=2 502 B11R1.74 CC1=CC([N+](=O)[O-])=CC(Br)=C1 037681 [1,1,0,0,0,0|1,0,1]=4 503 B11R1.74 CC1=CC([N+](=O)[O-])=CC(F)=C1 077933 [1,1,0,0,0,0|1,0,1]=4 504 B11R1.74 CC1=NC(Cl)=CC(C(=O)O)=C1 017200 [1,1,0,0,0,0|1,0,0]=3 505 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 436889 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.74 NC(=O)C1=CC(Cl)=CC(Cl)=C1 103463 [1,1,0,0,0,0|2,0,0]=4 507 B11R1.74 NC(=O)C1=CC(F)=CC(Br)=C1 080106 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.74 NC(=O)C1=CC(F)=CC(F)=C1 004779 [1,1,0,0,0,0|2,0,0]=4 509 B11R1.74 O=C(Cl)C1=CC(Br)=CC(F)=C1 038141 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.74 O=C(Cl)C1=CC(Cl)=CC(Cl)=C1 033159 [1,1,0,0,0,0|2,0,0]=4 511 B11R1.74 O=C(Cl)C1=CC(F)=CC(Cl)=C1 038157 [1,1,0,0,0,0|2,0,0]=4 512 B11R1.74 O=C(Cl)C1=CC(F)=CC(F)=C1 002113 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 038167 [1,1,0,0,0,0|1,0,0]=3 514 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 038164 [1,1,0,0,0,0|1,0,0]=3 515 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 005475 [1,1,0,0,0,0|1,0,0]=3 516 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 046182 [1,1,0,0,0,0|2,0,0]=4 517 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 005560 [1,1,0,0,0,0|1,0,0]=3 518 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 005181 [1,1,0,0,0,0|1,0,0]=3 519 B11R1.74 O=C(O)C1=CC(Cl)=CC(I)=C1 033365 [1,1,0,0,0,0|1,0,0]=3 520 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 017205 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 001417 [1,1,0,0,0,0|1,0,0]=3 522 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 112001 [1,1,0,0,0,0|1,0,0]=3 523 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 011691 [1,1,0,0,0,0|1,0,0]=3 524 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 209189 [1,1,0,0,0,0|0,0,0]=2 525 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 235192 [1,1,0,0,0,0|0,0,0]=2 526 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 049501 [1,1,0,0,0,0|2,0,0]=4 527 B11R1.74 O=C1C=C(C(=O)O)C=C(O)N1 056519 [1,1,0,0,0,0|1,0,0]=3 528 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(O)=C1 222565 [1,1,0,0,0,0|1,0,1]=4 529 B11R1.74 OB(O)C1=CC(O)=CC(F)=C1 223502 [1,1,0,0,0,0|1,0,1]=4 530 B11R1.155 CC1=CC=CC(S(=O)(=O)Cl)=C1 003789 [1,1,0,0,0,0|1,0,1]=4 531 B11R1.155 CC1=CC=CC(S(N)(=O)=O)=C1 034667 [1,1,0,0,0,0|1,0,1]=4 532 B11R1.155 NC1=CC(S(=O)(=O)O)=CC=C1 217093 [1,1,0,0,0,0|2,0,0]=4 533 B11R1.159 CC(=O)C1=C(F)C(F)=CC=C1 004775 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.159 CC(=O)C1=CC=CC(N)=C1O 040162 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.159 CC(=O)C1=CC=CC(O)=C1O 093041 [1,1,0,0,0,0|1,0,0]=3 536 B11R1.159 CC1=C(Br)C([N+](=O)[O-])=CC=C1 037690 [1,1,0,0,0,0|1,0,1]=4 537 B11R1.159 CC1=C(Br)C=CC=C1C(=O)Cl 470788 [1,1,0,0,0,0|2,0,0]=4 538 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O 018295 [1,1,0,0,0,0|1,0,0]=3 539 B11R1.159 CC1=C(C(=O)O)C=CC=C1Cl 011627 [1,1,0,0,0,0|1,0,0]=3 540 B11R1.159 CC1=C(C(=O)O)C=CC=C1I 018744 [1,1,0,0,0,0|1,0,0]=3 541 B11R1.159 CC1=C(C(N)=O)C=CC=C1Br 433488 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.159 CC1=C(C)C(C(=O)Cl)=CC=C1 066661 [1,1,0,0,0,0|1,0,0]=3 543 B11R1.159 CC1=C(C)C(C(N)=O)=CC=C1 091231 [1,1,0,0,0,0|1,0,0]=3 544 B11R1.159 CC1=C(Cl)C(C(=O)Cl)=CC=C1 062749 [1,1,0,0,0,0|1,0,0]=3 545 B11R1.159 CC1=C(Cl)C([N+](=O)[O-])=CC=C1 037691 [1,1,0,0,0,0|1,0,1]=4 546 B11R1.159 CC1=C(F)C=CC=C1C(=O)O 037153 [1,1,0,0,0,0|1,0,0]=3 547 B11R1.159 CC1=C(I)C([N+](=O)[O-])=CC=C1 037692 [1,1,0,0,0,0|1,0,1]=4 548 B11R1.159 CC1=C(N)C([N+](=O)[O-])=CC=C1 012746 [1,1,0,0,0,0|1,0,1]=4 549 B11R1.159 CC1=C(N)C=CC=C1C(=O)O 078644 [1,1,0,0,0,0|1,0,0]=3 550 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 079044 [1,1,0,0,0,0|0,0,0]=2 551 B11R1.159 CC1=C(O)C=CC=C1C(=O)O 078643 [1,1,0,0,0,0|0,0,0]=2 552 B11R1.159 CC1=C(O)C=CC=C1[N+](=O)[O-] 044938 [1,1,0,0,0,0|1,0,1]=4 553 B11R1.159 CC1=CC=CC(C(=O)Cl)=C1F 062679 [1,1,0,0,0,0|1,0,0]=3 554 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br 112800 [1,1,0,0,0,0|0,0,0]=2 555 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 001048 [1,1,0,0,0,0|0,0,0]=2 556 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl 120200 [1,1,0,0,0,0|0,0,0]=2 557 B11R1.159 CC1=CC=CC(C(=O)O)=C1F 034859 [1,1,0,0,0,0|0,0,0]=2 558 B11R1.159 CC1=CC=CC(C(=O)O)=C1I 148700 [1,1,0,0,0,0|0,0,0]=2 559 B11R1.159 CC1=CC=CC(C(=O)O)=C1N 023905 [1,1,0,0,0,0|0,0,0]=2 560 B11R1.159 CC1=CC=CC(C(N)=O)=C1Br 403276 [1,1,0,0,0,0|1,0,0]=3 561 B11R1.159 CC1=CC=CC(C(N)=O)=C1Cl 094065 [1,1,0,0,0,0|1,0,0]=3 562 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1F 033668 [1,1,0,0,0,0|1,0,1]=4 563 B11R1.159 NC(=O)C1=C(Cl)C(F)=CC=C1 017140 [1,1,0,0,0,0|2,0,0]=4 564 B11R1.159 NC(=O)C1=C(F)C(Cl)=CC=C1 005615 [1,1,0,0,0,0|2,0,0]=4 565 B11R1.159 NC(=O)C1=C(F)C(F)=CC=C1 004777 [1,1,0,0,0,0|2,0,0]=4 566 B11R1.159 NC(=O)C1=CC=CC(Cl)=C1Br 038277 [1,1,0,0,0,0|2,0,0]=4 567 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O 040654 [1,1,0,0,0,0|1,0,0]=3 568 B11R1.159 NC1=C(C(=O)O)C=CC=C1F 040187 [1,1,0,0,0,0|1,0,0]=3 569 B11R1.159 NC1=C(Cl)C=CC=C1C(=O)O 077502 [1,1,0,0,0,0|1,0,0]=3 570 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 037148 [1,1,0,0,0,0|1,0,0]=3 571 B11R1.159 NC1=C(I)C=CC=C1C(=O)O 091956 [1,1,0,0,0,0|1,0,0]=3 572 B11R1.159 NC1=C(O)C=CC=C1C(=O)O 077960 [1,1,0,0,0,0|0,0,0]=2 573 B11R1.159 NC1=C(O)C=CC=C1C(=O)O 329962 [1,1,0,0,0,0|0,0,0]=2 574 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1O 076703 [1,1,0,0,0,0|1,0,1]=4 575 B11R1.159 O=C(Cl)C1=C(Cl)C(Cl)=CC=C1 387030 [1,1,0,0,0,0|2,0,0]=4 576 B11R1.159 O=C(Cl)C1=C(F)C(Br)=CC=C1 038140 [1,1,0,0,0,0|2,0,0]=4 577 B11R1.159 O=C(Cl)C1=C(F)C(Cl)=CC=C1 005621 [1,1,0,0,0,0|2,0,0]=4 578 B11R1.159 O=C(Cl)C1=C(F)C(F)=CC=C1 004788 [1,1,0,0,0,0|2,0,0]=4 579 B11R1.159 O=C(Cl)C1=CC=CC(Cl)=C1Br 038276 [1,1,0,0,0,0|2,0,0]=4 580 B11R1.159 O=C(O)C1=C(Br)C(F)=CC=C1 005469 [1,1,0,0,0,0|1,0,0]=3 581 B11R1.159 O=C(O)C1=C(Cl)C(Br)=CC=C1 062765 [1,1,0,0,0,0|1,0,0]=3 582 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=C1 001164 [1,1,0,0,0,0|1,0,0]=3 583 B11R1.159 O=C(O)C1=C(Cl)C(F)=CC=C1 005185 [1,1,0,0,0,0|1,0,0]=3 584 B11R1.159 O=C(O)C1=C(F)C(Br)=CC=C1 005473 [1,1,0,0,0,0|1,0,0]=3 585 B11R1.159 O=C(O)C1=C(F)C(Cl)=CC=C1 004429 [1,1,0,0,0,0|1,0,0]=3 586 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 013130 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.159 O=C(O)C1=C(F)C(F)=CC=C1 001858 [1,1,0,0,0,0|1,0,0]=3 588 B11R1.159 O=C(O)C1=C(F)C(I)=CC=C1 038269 [1,1,0,0,0,0|1,0,0]=3 589 B11R1.159 O=C(O)C1=C(O)C(F)=CC=C1 013028 [1,1,0,0,0,0|1,0,0]=3 590 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O 076295 [1,1,0,0,0,0|1,0,0]=3 591 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br 038275 [1,1,0,0,0,0|1,0,0]=3 592 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O 079645 [1,1,0,0,0,0|1,0,0]=3 593 B11R1.159 O=C(O)C1=CC=CC(O)=C1O 092005 [1,1,0,0,0,0|0,0,0]=2 594 B11R1.159 O=C(O)C1=CC=NC(Br)=C1F 323712 [1,1,0,0,0,0|2,0,0]=4 595 B11R1.159 O=[N+]([O-])C1=C(Cl)C(O)=CC=C1 076365 [1,1,0,0,0,0|1,0,1]=4 596 B11R1.167 CC(=O)C1=C(C)C=CC(C)=C1 002546 [1,1,0,0,0,0|1,0,0]=3 597 B11R1.167 CC(=O)C1=C(Cl)C=CC(Cl)=C1 021996 [1,1,0,0,0,0|2,0,0]=4 598 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 006272 [1,1,0,0,0,0|1,0,0]=3 599 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 237985 [1,1,0,0,0,0|2,0,0]=4 600 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 001235 [1,1,0,0,0,0|2,0,0]=4 601 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F 077015 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.167 CC(=O)C1=CC(Br)=CC=C1N 077115 [1,1,0,0,0,0|2,0,0]=4 603 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O 012070 [1,1,0,0,0,0|2,0,0]=4 604 B11R1.167 CC(=O)C1=CC(C)=CC=C1O 227889 [1,1,0,0,0,0|1,0,0]=3 605 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1O 012069 [1,1,0,0,0,0|2,0,0]=4 606 B11R1.167 CC(=O)C1=CC(F)=CC=C1F 001930 [1,1,0,0,0,0|2,0,0]=4 607 B11R1.167 CC(=O)C1=CC(F)=CC=C1I 330127 [1,1,0,0,0,0|2,0,0]=4 608 B11R1.167 CC(=O)C1=CC(N)=CC=C1O 242457 [1,1,0,0,0,0|2,0,0]=4 609 B11R1.167 CC(=O)C1=CC(O)=CC=C1O 079189 [1,1,0,0,0,0|1,0,0]=3 610 B11R1.167 CC1=C(C(=O)Cl)C=C(F)C=C1 006280 [1,1,0,0,0,0|2,0,0]=4 611 B11R1.167 CC1=C(C(=O)Cl)C=C(I)C=C1 101904 [1,1,0,0,0,0|2,0,0]=4 612 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 042885 [1,1,0,0,0,0|1,0,0]=3 613 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 002249 [1,1,0,0,0,0|1,0,0]=3 614 B11R1.167 CC1=C(C(N)=O)C=C(Cl)C=C1 103790 [1,1,0,0,0,0|2,0,0]=4 615 B11R1.167 CC1=C(C(N)=O)C=C(I)C=C1 102074 [1,1,0,0,0,0|2,0,0]=4 616 B11R1.167 CC1=CC(B(O)O)=C(F)C=C1 045817 [1,1,0,0,0,0|1,0,1]=4 617 B11R1.167 CC1=CC(C(=O)Cl)=C(I)C=C1 103362 [1,1,0,0,0,0|1,0,0]=3 618 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 112810 [1,1,0,0,0,0|0,0,0]=2 619 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 044556 [1,1,0,0,0,0|0,0,0]=2 620 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 013846 [1,1,0,0,0,0|0,0,0]=2 621 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 148705 [1,1,0,0,0,0|0,0,0]=2 622 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 011365 [1,1,0,0,0,0|0,0,0]=2 623 B11R1.167 CC1=CC(C(N)=O)=C(Br)C=C1 102884 [1,1,0,0,0,0|1,0,0]=3 624 B11R1.167 CC1=CC(C(N)=O)=C(I)C=C1 103461 [1,1,0,0,0,0|1,0,0]=3 625 B11R1.167 CC1=CC([N+](=O)[O-])=C(Br)C=C1 001728 [1,1,0,0,0,0|1,0,1]=4 626 B11R1.167 CC1=CC([N+](=O)[O-])=C(F)C=C1 003233 [1,1,0,0,0,0|1,0,1]=4 627 B11R1.167 CC1=CC([N+](=O)[O-])=C(I)C=C1 149210 [1,1,0,0,0,0|1,0,1]=4 628 B11R1.167 CC1=CC([N+](=O)[O-])=C(O)C=C1 003619 [1,1,0,0,0,0|1,0,1]=4 629 B11R1.167 CC1=CC=C(Br)C=C1C(=O)Cl 043018 [1,1,0,0,0,0|2,0,0]=4 630 B11R1.167 CC1=CC=C(C)C(B(O)O)=C1 045280 [1,1,0,0,0,0|1,0,1]=4 631 B11R1.167 CC1=CC=C(C)C(C(=O)Cl)=C1 062603 [1,1,0,0,0,0|1,0,0]=3 632 B11R1.167 CC1=CC=C(C)C(C(N)=O)=C1 091229 [1,1,0,0,0,0|1,0,0]=3 633 B11R1.167 CC1=CC=C(C)C([N+](=O)[O-])=C1 078925 [1,1,0,0,0,0|1,0,1]=4 634 B11R1.167 CC1=CC=C(Cl)C([N+](=O)[O-])=C1 222322 [1,1,0,0,0,0|1,0,1]=4 635 B11R1.167 CC1=CC=C(Cl)C=C1C(=O)Cl 062747 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.167 CC1=CC=C(Cl)C=C1C(=O)O 018395 [1,1,0,0,0,0|1,0,0]=3 637 B11R1.167 CC1=CC=C(F)C=C1C(N)=O 008339 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.167 CC1=CC=C(I)C=C1C(=O)O 038168 [1,1,0,0,0,0|1,0,0]=3 639 B11R1.167 CC1=CC=C(N)C(C(N)=O)=C1 092228 [1,1,0,0,0,0|1,0,0]=3 640 B11R1.167 CC1=CC=C(N)C([N+](=O)[O-])=C1 078567 [1,1,0,0,0,0|1,0,1]=4 641 B11R1.167 CC1=CC=C(O)C(C(=O)O)=C1 222122 [1,1,0,0,0,0|0,0,0]=2 642 B11R1.167 CC1=CC=C(O)C=C1[N+](=O)[O-] 043896 [1,1,0,0,0,0|1,0,1]=4 643 B11R1.167 NC(=O)C1=C(Br)C=CC(F)=C1 094254 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.167 NC(=O)C1=C(Br)C=CC(I)=C1 102507 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.167 NC(=O)C1=C(Cl)C=CC(F)=C1 005614 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.167 NC(=O)C1=C(F)C=CC(Br)=C1 013777 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 005617 [1,1,0,0,0,0|2,0,0]=4 648 B11R1.167 NC(=O)C1=C(F)C=CC(F)=C1 001933 [1,1,0,0,0,0|2,0,0]=4 649 B11R1.167 NC(=O)C1=C(F)C=CC(I)=C1 103198 [1,1,0,0,0,0|2,0,0]=4 650 B11R1.167 NC(=O)C1=CC(Br)=CC=C1Cl 080103 [1,1,0,0,0,0|2,0,0]=4 651 B11R1.167 NC(=O)C1=CC(Br)=CC=C1I 229584 [1,1,0,0,0,0|2,0,0]=4 652 B11R1.167 NC(=O)C1=CC(Br)=CC=C1N 061653 [1,1,0,0,0,0|2,0,0]=4 653 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1Cl 210093 [1,1,0,0,0,0|2,0,0]=4 654 B11R1.167 NC(=O)C1=CC(Cl)=CC=C1N 061671 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.167 NC(=O)C1=CC(F)=CC=C1N 061688 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 018242 [1,1,0,0,0,0|1,0,0]=3 657 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 011364 [1,1,0,0,0,0|1,0,0]=3 658 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 003126 [1,1,0,0,0,0|1,0,0]=3 659 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 011772 [1,1,0,0,0,0|0,0,0]=2 660 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 020066 [1,1,0,0,0,0|1,0,0]=3 661 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 005488 [1,1,0,0,0,0|1,0,0]=3 662 B11R1.167 NC1=CC=C(I)C=C1C(=O)O 065839 [1,1,0,0,0,0|1,0,0]=3 663 B11R1.167 NC1=CC=C(O)C(C(=O)O)=C1 065629 [1,1,0,0,0,0|1,0,0]=3 664 B11R1.167 NC1=CC=C(O)C=C1[N+](=O)[O-] 078712 [1,1,0,0,0,0|1,0,1]=4 665 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O 049668 [1,1,0,0,0,0|2,0,0]=4 666 B11R1.167 O=C(Cl)C1=C(Br)C=CC(I)=C1 477326 [1,1,0,0,0,0|2,0,0]=4 667 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(Br)=C1 020644 [1,1,0,0,0,0|2,0,0]=4 668 B11R1.167 O=C(Cl)C1=C(Cl)C=CC(F)=C1 005620 [1,1,0,0,0,0|2,0,0]=4 669 B11R1.167 O=C(Cl)C1=C(F)C=CC(Cl)=C1 005622 [1,1,0,0,0,0|2,0,0]=4 670 B11R1.167 O=C(Cl)C1=C(F)C=CC(F)=C1 001937 [1,1,0,0,0,0|2,0,0]=4 671 B11R1.167 O=C(Cl)C1=C(F)C=CC(I)=C1 013055 [1,1,0,0,0,0|2,0,0]=4 672 B11R1.167 O=C(Cl)C1=CC(Cl)=CC=C1Cl 062678 [1,1,0,0,0,0|2,0,0]=4 673 B11R1.167 O=C(Cl)C1=CC(F)=CC=C1Br 038138 [1,1,0,0,0,0|2,0,0]=4 674 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 005471 [1,1,0,0,0,0|1,0,0]=3 675 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 112000 [1,1,0,0,0,0|1,0,0]=3 676 B11R1.167 O=C(O)C1=C(Br)C=NC(Br)=C1 033263 [1,1,0,0,0,0|2,0,0]=4 677 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 075288 [1,1,0,0,0,0|1,0,0]=3 678 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=N1 045805 [1,1,0,0,0,0|2,0,0]=4 679 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 008647 [1,1,0,0,0,0|1,0,0]=3 680 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 009093 [1,1,0,0,0,0|1,0,0]=3 681 B11R1.167 O=C(O)C1=C(Cl)N=CC(F)=C1 033569 [1,1,0,0,0,0|2,0,0]=4 682 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 005477 [1,1,0,0,0,0|1,0,0]=3 683 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 005182 [1,1,0,0,0,0|1,0,0]=3 684 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 001934 [1,1,0,0,0,0|1,0,0]=3 685 B11R1.167 O=C(O)C1=C(F)C=CC(F)=N1 045836 [1,1,0,0,0,0|2,0,0]=4 686 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 013023 [1,1,0,0,0,0|1,0,0]=3 687 B11R1.167 O=C(O)C1=C(F)C=NC(Br)=C1 219540 [1,1,0,0,0,0|2,0,0]=4 688 B11R1.167 O=C(O)C1=C(F)C=NC(Cl)=C1 092393 [1,1,0,0,0,0|2,0,0]=4 689 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 112100 [1,1,0,0,0,0|1,0,0]=3 690 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 119810 [1,1,0,0,0,0|1,0,0]=3 691 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 001665 [1,1,0,0,0,0|1,0,0]=3 692 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 236790 [1,1,0,0,0,0|0,0,0]=2 693 B11R1.167 O=C(O)C1=CC(Br)=CC=C1O 078566 [1,1,0,0,0,0|1,0,0]=3 694 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl 036867 [1,1,0,0,0,0|2,0,0]=4 695 B11R1.167 O=C(O)C1=CC(Br)=CNC1=O 045185 [1,1,0,0,0,0|2,0,0]=4 696 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1Br 018255 [1,1,0,0,0,0|1,0,0]=3 697 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1Cl 079000 [1,1,0,0,0,0|1,0,0]=3 698 B11R1.167 O=C(O)C1=CC(Cl)=CC=C1O 079860 [1,1,0,0,0,0|1,0,0]=3 699 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F 033572 [1,1,0,0,0,0|2,0,0]=4 700 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1O 017239 [1,1,0,0,0,0|2,0,0]=4 701 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl 045315 [1,1,0,0,0,0|2,0,0]=4 702 B11R1.167 O=C(O)C1=CC(F)=NC=C1F 094469 [1,1,0,0,0,0|2,0,0]=4 703 B11R1.167 O=C(O)C1=CC(I)=CC=C1I 005559 [1,1,0,0,0,0|1,0,0]=3 704 B11R1.167 O=C(O)C1=CC(I)=CC=C1O 216852 [1,1,0,0,0,0|1,0,0]=3 705 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl 065960 [1,1,0,0,0,0|2,0,0]=4 706 B11R1.167 O=C(O)C1=CC(O)=CC=C1I 305547 [1,1,0,0,0,0|0,0,0]=2 707 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Br 078244 [1,1,0,0,0,0|2,0,0]=4 708 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(O)=C1 013480 [1,1,0,0,0,0|1,0,1]=4 709 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(O)=C1 013090 [1,1,0,0,0,0|1,0,1]=4 710 B11R1.9 COC1=CC(Br)=CC(C#N)=C1 078073 [1,1,0,0,0,0|1,0,1]=4 711 B11R1.9 COC1=CC(Br)=CC(OC)=C1 092710 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.9 COC1=CC(C)=CC(C=O)=C1 038673 [1,1,0,0,0,0|0,0,0]=2 713 B11R1.9 COC1=CC(C)=CC(OC)=C1 008958 [1,1,0,0,0,0|2,0,0]=4 714 B11R1.9 COC1=CC(C=O)=CC(Cl)=C1 075242 [1,1,0,0,0,0|0,0,0]=2 715 B11R1.9 COC1=CC(Cl)=CC(OC)=C1 227675 [1,1,0,0,0,0|2,0,0]=4 716 B11R1.9 COC1=CC(F)=CC(OC)=C1 209191 [1,1,0,0,0,0|2,0,0]=4 717 B11R1.9 COC1=CC(I)=CC(OC)=C1 050463 [1,1,0,0,0,0|2,0,0]=4 718 B11R1.9 COC1=CC(N)=CC(OC)=C1 038594 [1,1,0,0,0,0|2,0,0]=4 719 B11R1.9 COC1=CC(O)=CC(OC)=C1 013047 [1,1,0,0,0,0|2,0,0]=4 720 B11R1.189 CCC1=CC=CC(N=C=O)=C1 024283 [1,1,0,0,0,0|1,0,1]=4 721 B11R1.189 CCOC1=CC=CC(C#N)=C1 018662 [1,1,0,0,0,0|1,0,1]=4 722 B11R1.189 COC1=CC(CC#N)=CC=C1 018797 [1,1,0,0,0,0|1,0,1]=4 723 B11R1.189 COC1=CC(CCBr)=CC=C1 485630 [1,1,0,0,0,0|1,0,1]=4 724 B11R1.189 COC1=CC=CC(CCN)=C1 008884 [1,1,0,0,0,0|1,0,1]=4 725 B11R1.189 COC1=CC=CC(N=C=O)=C1 046952 [1,1,0,0,0,0|0,0,1]=3 726 B11R1.189 COC1=CC=CC(N=C=S)=C1 009513 [1,1,0,0,0,0|0,1,1]=4 727 B11R1.189 CSC1=CC=CC(N=C=O)=C1 024309 [1,1,0,0,0,0|0,1,1]=4 728 B11R1.267 COC1=C(O)C(C=O)=CC=C1 078653 [1,1,0,0,0,0|0,0,0]=2 729 B11R1.267 COC1=CC=CC(OC)=C1I 092465 [1,1,0,0,0,0|2,0,0]=4 730 B11R1.267 COC1=CC=CC(OC)=C1N 017336 [1,1,0,0,0,0|2,0,0]=4 731 B11R1.267 COC1=CC=CC(OC)=C1O 008832 [1,1,0,0,0,0|2,0,0]=4 732 B11R1.267 N#CC1=C(Cl)C(C=O)=CC=C1 079729 [1,1,0,0,0,0|2,0,0]=4 733 B11R1.280 C(=O)C1=C(F)C=CC(OC)=C1 006264 [1,1,0,0,0,0|0,0,0]=2 734 B11R1.280 CCC1=C(Cl)C=CC(C=O)=C1 069716 [1,1,0,0,0,0|1,0,0]=3 735 B11R1.280 COC1=C(C)C=CC(C=O)=C1 065168 [1,1,0,0,0,0|0,0,0]=2 736 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 075245 [1,1,0,0,0,0|0,0,0]=2 737 B11R1.280 COC1=C(F)C=CC(C#N)=C1 033768 [1,1,0,0,0,0|1,0,1]=4 738 B11R1.280 COC1=C(F)C=CC(C=O)=C1 013012 [1,1,0,0,0,0|0,0,0]=2 739 B11R1.280 COC1=C(O)C=CC(CN)=C1 049826 [1,1,0,0,0,0|1,0,1]=4 740 B11R1.280 COC1=C(O)C=CC(CO)=C1 358167 [1,1,0,0,0,0|0,0,1]=3 741 B11R1.280 COC1=CC(C#N)=C(F)C=C1 013331 [1,1,0,0,0,0|1,0,1]=4 742 B11R1.280 COC1=CC(C#N)=CC=C1C 221692 [1,1,0,0,0,0|1,0,1]=4 743 B11R1.280 COC1=CC(C#N)=CC=C1N 093506 [1,1,0,0,0,0|1,0,1]=4 744 B11R1.280 COC1=CC(C=O)=C(Cl)C=C1 037537 [1,1,0,0,0,0|0,0,0]=2 745 B11R1.280 COC1=CC(C=O)=CC=C1O 032468 [1,1,0,0,0,0|0,0,0]=2 746 B11R1.280 COC1=CC(CBr)=CC=C1Cl 243252 [1,1,0,0,0,0|1,0,1]=4 747 B11R1.280 COC1=CC(CN)=C(F)C=C1 013340 [1,1,0,0,0,0|1,0,1]=4 748 B11R1.280 COC1=CC(CN)=CC=C1F 013343 [1,1,0,0,0,0|1,0,1]=4 749 B11R1.280 COC1=CC(CO)=C(Br)C=C1 448465 [1,1,0,0,0,0|0,0,1]=3 750 B11R1.280 COC1=CC(OC)=C(F)C=C1 018018 [1,1,0,0,0,0|2,0,0]=4 751 B11R1.280 COC1=CC(OC)=C(I)C=C1 018584 [1,1,0,0,0,0|2,0,0]=4 752 B11R1.280 COC1=CC=C(Br)C(C#N)=C1 233792 [1,1,0,0,0,0|1,0,1]=4 753 B11R1.280 COC1=CC=C(Br)C(C=O)=C1 044450 [1,1,0,0,0,0|0,0,0]=2 754 B11R1.280 COC1=CC=C(Br)C(CBr)=C1 222652 [1,1,0,0,0,0|1,0,1]=4 755 B11R1.280 COC1=CC=C(Br)C(OC)=C1 018268 [1,1,0,0,0,0|2,0,0]=4 756 B11R1.280 COC1=CC=C(N)C(C#N)=C1 093006 [1,1,0,0,0,0|1,0,1]=4 757 B11R1.280 COC1=CC=C(O)C(C=O)=C1 209088 [1,1,0,0,0,0|0,0,0]=2 758 B11R1.280 COC1=CC=C(O)C(OC)=C1 077720 [1,1,0,0,0,0|2,0,0]=4 759 B11R1.280 N#CC1=C(F)C=CC(C=O)=C1 023328 [1,1,0,0,0,0|2,0,0]=4 760 B11R1.280 O=CC1=C(O)C=CC(CCl)=C1 025138 [1,1,0,0,0,0|2,0,0]=4 761 B11R1.175 CC(=O)C1=CC=C(C(=O)O)S1 225758 [0,1,0,0,1,0|2,0,0]=4 762 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 002580 [0,1,0,0,0,1|0,0,0]=2 763 B13R1.587 CC(=O)NC1=CC(C(C)=O)=CC=C1 209741 [0,1,0,0,0,1|2,0,0]=4 764 B13R1.587 O=C(O)CC1=CC=CC([N+](=O)[O-])=C1 078639 [0,1,0,0,0,1|2,0,0]=4 765 B13R1.642 COC1=CC=CC(N(C)C(=S)Cl)=C1 009721 [0,1,0,0,0,1|1,1,0]=4 766 B13R1.126 CC(C)C1=CC(C(=O)O)=CC(Br)=C1 044965 [0,2,0,0,0,0|1,0,0]=3 767 B13R1.126 CC1=CC(C(=O)O)=CC(C(=O)O)=C1 065615 [0,2,0,0,0,0|2,0,0]=4 768 B13R1.126 NC1=CC(C(=O)O)=CC(C(=O)O)=C1 209860 [0,2,0,0,0,0|2,0,0]=4 769 B13R1.126 NC1=CC([N+](=O)[O-])=CC(C(=O)O)=C1 021284 [0,2,0,0,0,0|2,0,0]=4 770 B13R1.126 O=C(O)C1=CC(Br)=CC(C(=O)O)=C1 048783 [0,2,0,0,0,0|2,0,0]=4 771 B13R1.126 O=C(O)C1=CC(F)=CC([N+](=O)[O-])=C1 022027 [0,2,0,0,0,0|2,0,0]=4 772 B13R1.126 O=C(O)C1=CC(O)=CC(C(=O)O)=C1 078877 [0,2,0,0,0,0|2,0,0]=4 773 B13R1.126 O=C(O)C1=CC([N+](=O)[O-])=CC(Br)=C1 047913 [0,2,0,0,0,0|2,0,0]=4 774 B13R1.298 COC1=C(I)C(Br)=CC([N+](=O)[O-])=C1 037761 [0,2,0,0,0,0|1,0,1]=4 775 B13R1.298 COC1=C(N)C(Br)=CC([N+](=O)[O-])=C1 035098 [0,2,0,0,0,0|1,0,1]=4 776 B13R1.313 CCC1=CC(CC)=CC(C(=O)O)=C1 034261 [0,2,0,0,0,0|1,0,0]=3 777 B13R1.313 COC1=CC(OC)=CC(B(O)O)=C1 045265 [0,2,0,0,0,0|1,0,1]=4 778 B13R1.313 COC1=CC(OC)=CC(C(=O)Cl)=C1 013538 [0,2,0,0,0,0|1,0,0]=3 779 B13R1.313 COC1=CC(OC)=CC(C(=O)O)=C1 077697 [0,2,0,0,0,0|0,0,0]=2 780 B13R1.313 COC1=CC(OC)=CC(C(C)=O)=C1 021803 [0,2,0,0,0,0|1,0,0]=3 781 B13R1.313 COC1=CC(OC)=NC(C(=O)O)=N1 016090 [0,2,0,0,0,0|2,0,0]=4 782 B13R1.313 COC1=NC(OC)=NC(C(=O)O)=C1 023772 [0,2,0,0,0,0|2,0,0]=4 783 B13R1.437 COC1=CC(Br)=C(N)C([N+](=O)[O-])=C1 062580 [0,2,0,0,0,0|1,0,1]=4 784 B13R1.13 CC1=CC=C(C(=O)O)C=C1[N+](=O)[O-] 078106 [0,2,0,0,0,0|2,0,0]=4 785 B13R1.13 CC1=CC=C([N+](=O)[O-])C=C1C(=O)O 077830 [0,2,0,0,0,0|2,0,0]=4 786 B13R1.13 NC1=CC=C(C(=O)O)C=C1[N+](=O)[O-] 076517 [0,2,0,0,0,0|2,0,0]=4 787 B13R1.13 NC1=CC=C([N+](=O)[O-])C=C1C(=O)O 018896 [0,2,0,0,0,0|2,0,0]=4 788 B13R1.13 O=C(O)C1=C(F)C=CC(B(O)O)=C1 033089 [0,2,0,0,0,0|2,0,0]=4 789 B13R1.13 O=C(O)C1=C(F)C=CC([N+](=O)[O-])=C1 009222 [0,2,0,0,0,0|2,0,0]=4 790 B13R1.13 O=C(O)C1=CC(C(=O)O)=C(Br)C=C1 001005 [0,2,0,0,0,0|2,0,0]=4 791 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(Br)C=C1 008948 [0,2,0,0,0,0|2,0,0]=4 792 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(F)C=C1 018022 [0,2,0,0,0,0|2,0,0]=4 793 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(I)C=C1 043862 [0,2,0,0,0,0|2,0,0]=4 794 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=CC=C1Br BR1601 [0,2,0,0,0,0|2,0,0]=4 795 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=CC=C1Cl 079108 [0,2,0,0,0,0|2,0,0]=4 796 B13R1.13 O=C(O)C1=CC=C(Cl)C([N+](=O)[O-])=C1 079099 [0,2,0,0,0,0|2,0,0]=4 797 B13R1.13 O=C(O)C1=CC=C(O)C(C(=O)O)=C1 228258 [0,2,0,0,0,0|2,0,0]=4 798 B13R1.13 O=C(O)C1=CC=C(O)C([N+](=O)[O-])=C1 078551 [0,2,0,0,0,0|2,0,0]=4 799 B13R1.49 CCC(O)C1=CC=C(O)C(OC)=C1 375163 [0,2,0,0,0,0|1,0,1]=4 800 B13R1.49 COC(=O)C1=CC=C(Br)C(OC)=C1 092860 [0,2,0,0,0,0|0,0,0]=2 801 B13R1.49 COC(=O)C1=CC=C(F)C(C#N)=C1 076717 [0,2,0,0,0,0|2,0,0]=4 802 B13R1.49 COC(=O)C1=CC=C(N)C(OC)=C1 093685 [0,2,0,0,0,0|0,0,0]=2 803 B13R1.49 COC(=O)C1=CC=C(O)C(OC)=C1 222051 [0,2,0,0,0,0|0,0,0]=2 804 B13R1.49 COC1=C(O)C=CC(\C(N)=N\O)=C1 355922 [0,2,0,0,0,0|1,0,0]=3 805 B13R1.50 COC1=C(Br)C=CC(S(=O)(=O)Cl)=C1 062595 [0,2,0,0,0,0|1,0,1]=4 806 B13R1.50 COC1=C(O)C=CC(S(=O)(=O)[O-])=C1 103296 [0,2,0,0,0,0|1,0,1]=4 807 B13R1.651 COC1=CC([N+](=O)[O-])=C(F)C=C1Cl 010744 [0,2,0,0,0,0|1,0,1]=4 808 B13R1.3091 COC1=C(OC)C=C(C(=O)Cl)C=C1 018572 [0,2,0,0,0,0|1,0,0]=3 809 B13R1.3091 COC1=C(OC)C=C(C(=O)O)C=C1 065744 [0,2,0,0,0,0|0,0,0]=2 810 B13R1.3091 COC1=CC=C(B(O)O)C=C1OC 010992 [0,2,0,0,0,0|1,0,1]=4 811 B13R1.3091 COC1=CC=C(C(C)=O)C=C1OC 236751 [0,2,0,0,0,0|1,0,0]=3 812 B13R1.3091 COC1=CC=C(C(N)=S)C=C1OC 021337 [0,2,0,0,0,0|1,1,0]=4 813 B13R1.3230 COC1=C(F)C(C(=O)O)=CC=C1Cl 343233 [0,2,0,0,0,0|0,0,0]=2 814 B13R1.345 CC(C)(C)C1=CC(C(=O)O)=CC=C1 037544 [0,2,0,0,0,0|1,0,0]=3 815 B13R1.345 CC(C)(C)C1=CC=CC(C(=O)Cl)=C1 062970 [0,2,0,0,0,0|2,0,0]=4 816 B13R1.345 CS(=O)(=O)C1=CC(C(=O)O)=CC=C1 023370 [0,2,0,0,0,0|0,1,0]=3 817 B13R1.345 NS(=O)(=O)C1=CC=CC(C(=O)O)=C1 015592 [0,2,0,0,0,0|1,1,0]=4 818 B13R1.345 O=C(O)C1=CC(C(F)(F)F)=CC=C1 002133 [0,2,0,0,0,0|2,0,0]=4 819 B13R1.345 O=C(O)C1=CC=CC(S(=O)(=O)Cl)=C1 047742 [0,2,0,0,0,0|1,1,0]=4 820 B13R1.543 COC(=O)C1=CC(C(=O)O)=CC=C1 078838 [0,2,0,0,0,0|0,0,0]=2 821 B13R1.543 COC(=O)C1=CC(C(N)=O)=CC=C1 023484 [0,2,0,0,0,0|1,0,0]=3 822 B13R1.543 COC(=O)C1=CC=CC(B(O)O)=C1 010804 [0,2,0,0,0,0|1,0,1]=4 823 B13R1.543 COC(=O)C1=CC=CC(C(C)=O)=C1 075250 [0,2,0,0,0,0|1,0,0]=3 824 B13R1.543 COC(=O)C1=CC=CC([N+](=O)[O-])=C1 091524 [0,2,0,0,0,0|1,0,1]=4 825 B13R1.543 O=C(O)C1=CC=CC(C(=O)CBr)=C1 018115 [0,2,0,0,0,0|1,0,0]=3 826 B13R1.3801 CC1=C(C(=O)O)C=CC=C1[N+](=O)[O-] 065756 [0,2,0,0,0,0|2,0,0]=4 827 B13R1.3801 NC1=C(C(=O)O)C=CC=C1C(=O)O 023431 [0,2,0,0,0,0|2,0,0]=4 828 B13R1.3801 NC1=C([N+](=O)[O-])C=CC=C1C(=O)O 046208 [0,2,0,0,0,0|2,0,0]=4 829 B13R1.3801 O=C(O)C1=C(Br)C([N+](=O)[O-])=CC=C1 065838 [0,2,0,0,0,0|2,0,0]=4 830 B13R1.3801 O=C(O)C1=C(F)C([N+](=O)[O-])=CC=C1 044554 [0,2,0,0,0,0|2,0,0]=4 831 B13R1.3801 O=C(O)C1=CC=CC([N+](=O)[O-])=C1Cl 076580 [0,2,0,0,0,0|2,0,0]=4 832 B13R1.3801 O=C(O)C1=CC=CC([N+](=O)[O-])=C1O 049728 [0,2,0,0,0,0|2,0,0]=4 833 B13R1.374 COC(=O)C1=CC=CC(N=C=S)=C1 009504 [0,2,0,0,0,0|1,0,1]=4 834 B13R1.568 CCCCC1=CC=CC(C(=O)O)=C1 070790 [0,2,0,0,0,0|1,0,0]=3 835 B13R1.568 CCCOC1=CC=CC(B(O)O)=C1 236742 [0,2,0,0,0,0|1,0,1]=4 836 B13R1.82 COC(=O)C1=CC=CC(OC)=C1O 209882 [0,2,0,0,0,0|0,0,0]=2 837 B13R1.460 CCOC(=O)C1=CC=CC(CCl)=C1 242618 [0,2,0,0,0,0|2,0,0]=4 838 B13R1.460 CCOC(=O)C1=CC=CC(NN)=C1 061323 [0,2,0,0,0,0|2,0,0]=4 839 B13R1.2431 COC(=O)C1=C(C)C=CC(OC)=C1 044826 [0,2,0,0,0,0|0,0,0]=2 840 B13R1.2431 COC(=O)C1=CC(OC)=CC=C1Br 211873 [0,2,0,0,0,0|0,0,0]=2 841 B13R1.2431 COC(=O)C1=CC(OC)=CC=C1F 473032 [0,2,0,0,0,0|0,0,0]=2 842 B13R1.2431 COC(=O)C1=CC(OC)=CC=C1O 078761 [0,2,0,0,0,0|0,0,0]=2 843 B13R1.98 COC1=CC=C(Cl)C(S(=O)(=O)Cl)=C1 037970 [0,2,0,0,0,0|1,0,1]=4 844 B13R1.2137 COC1=CC=CC(C(=O)O)=C1OC 021652 [0,2,0,0,0,0|0,0,0]=2 845 B13R1.2137 COC1=CC=CC(C(N)=O)=C1OC 021861 [0,2,0,0,0,0|1,0,0]=3 846 B13R1.2137 COC1=CC=CC(C(N)=S)=C1OC 021334 [0,2,0,0,0,0|1,1,0]=4 847 B13R1.3097 COC1=C(F)C(C(=O)O)=C(F)C=C1 035764 [0,2,0,0,0,0|0,0,0]=2 848 B13R1.3097 COC1=CC=C(F)C(B(O)O)=C1F 033090 [0,2,0,0,0,0|1,0,1]=4 849 B13R1.2430 CCC1=CC(C(C)=O)=C(OC)C=C1 019222 [0,2,0,0,0,0|2,0,0]=4 850 B13R1.2430 COC1=CC(C(C)=O)=C(OC)C=C1 132200 [0,2,0,0,0,0|1,0,0]=3 851 B13R1.2430 COC1=CC(C(N)=S)=C(OC)C=C1 021336 [0,2,0,0,0,0|1,1,0]=4 852 B13R1.2430 COC1=CC=C(C#N)C(C(=O)O)=C1 065860 [0,2,0,0,0,0|0,0,0]=2 853 B13R1.2430 COC1=CC=C(C#N)C([N+](=O)[O-])=C1 092304 [0,2,0,0,0,0|1,0,1]=4 854 B13R1.2430 COC1=CC=C(C=O)C(B(O)O)=C1 011047 [0,2,0,0,0,0|1,0,1]=4 855 B13R1.2430 COC1=CC=C(OC)C(B(O)O)=C1 010990 [0,2,0,0,0,0|1,0,1]=4 856 B13R1.2430 COC1=CC=C(OC)C(C(=O)O)=C1 076548 [0,2,0,0,0,0|0,0,0]=2 857 B13R1.2430 COC1=NN=C(OC)C(C(=O)O)=C1 023600 [0,2,0,0,0,0|2,0,0]=4 858 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 209013 [0,0,1,1,0,0|1,0,1]=4 859 B11R1.91 O=C(O)\C=C\C1=CC=CN=C1 003424 [0,0,1,1,0,0|2,0,0]=4 860 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 009847 [0,0,1,1,0,0|1,0,1]=4 861 B11R1.91 O=C(O)\C=C\c1ccccc1 195963 [0,0,1,1,0,0|1,0,1]=4 862 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 092296 [0,0,1,1,0,0|1,0,1]=4 863 B13R2.581 COC1=C2N=C(N)SC2=CC=C1 040348 [0,0,0,1,0,1|2,0,0]=4 864 B13R2.2121 COC1=CC2=C(C=C1)N=C(N)S2 048096 [0,0,0,1,0,1|2,0,0]=4 865 B13R2.2121 COC1=CC2=C(C=C1)NC(C)=C2 092347 [0,0,0,1,0,1|2,0,0]=4 866 B13R2.2121 COC1=CC=C2N=C(Br)SC2=C1 037004 [0,0,0,1,0,1|2,0,0]=4 867 B13R2.430 CC(=O)C1=CC=C2CCCC2=C1 104311 [0,1,0,1,0,0|2,0,0]=4 868 B13R2.430 CC(=O)C1=CC=C2OCCC2=C1 021797 [0,1,0,1,0,0|2,0,0]=4 869 B13R2.430 NC(=S)C1=CC2=C(C=C1)OCO2 356264 [0,1,0,1,0,0|1,1,0]=4 870 B13R2.430 O=C(Cl)C1=CC2=NON=C2C=C1 005894 [0,1,0,1,0,0|2,0,0]=4 871 B13R2.430 O=C(O)C1=CC2=C(C=C1)N=NN2 058473 [0,1,0,1,0,0|2,0,0]=4 872 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 047688 [0,1,0,1,0,0|1,0,1]=4 873 B13R2.430 O=C(O)C1=CC2=C(C=C1)NN=C2 066535 [0,1,0,1,0,0|2,0,0]=4 874 B13R2.430 O=C(O)C1=CC2=C(C=C1)OCO2 022643 [0,1,0,1,0,0|0,0,0]=2 875 B13R2.430 O=C(O)C1=CC2=NON=C2C=C1 005895 [0,1,0,1,0,0|1,0,0]=3 876 B13R2.430 O=C(O)C1=CC2=NSN=C2C=C1 017046 [0,1,0,1,0,0|1,1,0]=4 877 B13R2.430 O=C(O)C1=CC=C2C=CNC2=C1 023377 [0,1,0,1,0,0|1,0,1]=4 878 B13R2.430 O=C(O)C1=CC=C2N=CSC2=C1 005892 [0,1,0,1,0,0|0,1,1]=4 879 B13R2.430 O=C(O)C1=CC=C2NC=NC2=C1 066310 [0,1,0,1,0,0|1,0,1]=4 880 B13R2.430 O=C(O)C1=CC=C2SC=CC2=C1 325184 [0,1,0,1,0,0|1,0,1]=4 881 B13R2.430 O=C(O)C1=CC=C2SC=NC2=C1 066307 [0,1,0,1,0,0|1,0,1]=4 882 B13R2.430 O=[N+]([O-])C1=CC=C2OCOC2=C1 220387 [0,1,0,1,0,0|1,0,1]=4 883 B13R2.430 OB(O)C1=CC2=C(C=C1)OCO2 011004 [0,1,0,1,0,0|1,0,1]=4 884 B13R2.429 O=C(O)C1=CC=CC(C2CC2)=C1 039874 [0,1,0,1,0,0|1,0,0]=3 885 B13R2.5569 O=C(O)C1=C2N=CNC2=CC=C1 066311 [0,1,0,1,0,0|1,0,1]=4 886 B13R2.5569 O=C(O)C1=C2OCCC2=CC=C1 011337 [0,1,0,1,0,0|1,0,0]=3 887 B13R2.5569 O=C(O)C1=CC=CC2=C1C=CN2 045079 [0,1,0,1,0,0|1,0,1]=4 888 B13R2.5569 O=C(O)C1=CC=CC2=C1NC=C2 035872 [0,1,0,1,0,0|1,0,1]=4 889 B13R2.669 COC1=CC2=C(C=C1)CCC2=O 012751 [0,1,0,1,0,0|1,0,0]=3 890 B13R2.669 COC1=CC=C2CNC(=O)C2=C1 035892 [0,1,0,1,0,0|1,0,0]=3 891 B9R1.35 CC(=O)C1=CC=C(C)S1 001262 [1,0,0,0,1,0|2,0,0]=4 892 B9R1.35 CC(=O)C1=CN(C)C=C1 103065 [1,0,0,0,1,0|2,0,0]=4 893 B9R1.35 CC1=CC(C(=O)O)=NN1 014537 [1,0,0,0,1,0|2,0,0]=4 894 B9R1.35 CC1=CC(C(=O)O)=NO1 017252 [1,0,0,0,1,0|2,0,0]=4 895 B9R1.35 CC1=CC=C(C(=O)O)O1 014513 [1,0,0,0,1,0|1,0,0]=3 896 B9R1.35 CC1=CC=C(C(=O)O)S1 045076 [1,0,0,0,1,0|1,0,0]=3 897 B9R1.35 CC1=CN=C(C(=O)O)S1 044786 [1,0,0,0,1,0|2,0,0]=4 898 B9R1.35 CC1=CSC(C(=O)O)=C1 023894 [1,0,0,0,1,0|1,0,0]=3 899 B9R1.35 CC1=CSC(C(N)=O)=C1 023896 [1,0,0,0,1,0|2,0,0]=4 900 B9R1.35 CC1=NC=C(C(=O)O)O1 227751 [1,0,0,0,1,0|2,0,0]=4 901 B9R1.35 CC1=NC=C(C(=O)O)S1 044774 [1,0,0,0,1,0|2,0,0]=4 902 B9R1.35 CC1=NOC(C(=O)O)=C1 027734 [1,0,0,0,1,0|2,0,0]=4 903 B9R1.35 CN1C=C(C(=O)O)C=N1 028252 [1,0,0,0,1,0|2,0,0]=4 904 B9R1.35 CN1C=CC(C(=O)O)=N1 014532 [1,0,0,0,1,0|2,0,0]=4 905 B9R1.35 CN1C=NC(C(=O)O)=C1 012732 [1,0,0,0,1,0|2,0,0]=4 906 B9R1.35 O=C(O)C1=CC(Br)=CS1 028027 [1,0,0,0,1,0|2,0,0]=4 907 B9R1.35 O=C(O)C1=CC=C(Br)O1 020339 [1,0,0,0,1,0|2,0,0]=4 908 B9R1.35 O=C(O)C1=CC=C(Br)S1 114300 [1,0,0,0,1,0|2,0,0]=4 909 B9R1.35 O=C(O)C1=CC=C(Cl)S1 014515 [1,0,0,0,1,0|2,0,0]=4 910 B9R1.41 CC(=O)C1=CC=CN1C 002488 [1,0,0,0,1,0|2,0,0]=4 911 B9R1.41 CC1=C(C(=O)O)C=CS1 066125 [1,0,0,0,1,0|1,0,0]=3 912 B9R1.41 CC1=C(C(=O)O)C=NO1 066197 [1,0,0,0,1,0|2,0,0]=4 913 B9R1.41 CC1=C(C(=O)O)OC=N1 035897 [1,0,0,0,1,0|2,0,0]=4 914 B9R1.41 CC1=C(C(=O)O)SC=C1 045075 [1,0,0,0,1,0|1,0,0]=3 915 B9R1.41 CC1=CSC=C1C(=O)O 224039 [1,0,0,0,1,0|1,0,0]=3 916 B9R1.41 CN1C=CC=C1C(=O)O 093156 [1,0,0,0,1,0|1,0,0]=3 917 B9R1.41 CN1C=CN=C1C(=O)O 093196 [1,0,0,0,1,0|2,0,0]=4 918 B9R1.41 CN1C=NC=C1C(=O)O 066237 [1,0,0,0,1,0|2,0,0]=4 919 B9R1.41 CN1N=CC=C1C(=O)O 014534 [1,0,0,0,1,0|2,0,0]=4 920 B9R1.41 O=C(O)C1=C(Br)C=CS1 019423 [1,0,0,0,1,0|2,0,0]=4 921 B9R1.41 O=C(O)C1=C(Br)SC=C1 092319 [1,0,0,0,1,0|2,0,0]=4 922 B9R1.41 O=C(O)C1=C(Cl)C=CS1 017407 [1,0,0,0,1,0|2,0,0]=4 923 B9R1.41 O=C(O)C1=C(Cl)SC=C1 077280 [1,0,0,0,1,0|2,0,0]=4 924 B9R1.41 O=C(O)C1=C(I)C=CS1 021666 [1,0,0,0,1,0|2,0,0]=4 925 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 306942 [1,0,0,0,0,1|2,0,0]=4 926 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 037377 [1,0,0,0,0,1|2,0,0]=4 927 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 094704 [1,0,0,0,0,1|1,0,0]=3 928 B11R1.157 CC(=O)NC1=CC(C)=CC=N1 032647 [1,0,0,0,0,1|2,0,0]=4 929 B11R1.157 CC(=O)NC1=CC(F)=CC=C1 006174 [1,0,0,0,0,1|2,0,0]=4 930 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 118101 [1,0,0,0,0,1|2,0,0]=4 931 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 079660 [1,0,0,0,0,1|2,0,0]=4 932 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 003917 [1,0,0,0,0,1|2,0,0]=4 933 B11R1.157 CC(=O)OC1=CC=CC(Br)=C1 224315 [1,0,0,0,0,1|2,0,0]=4 934 B11R1.157 CC1=CC(CC(=O)Cl)=CC=C1 014709 [1,0,0,0,0,1|1,0,0]=3 935 B11R1.157 CC1=CC(NC(N)=O)=CC=C1 018864 [1,0,0,0,0,1|1,0,0]=3 936 B11R1.157 CC1=CC(NC(N)=S)=CC=C1 018862 [1,0,0,0,0,1|1,1,0]=4 937 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 001325 [1,0,0,0,0,1|0,0,0]=2 938 B11R1.157 NC(=O)CC1=CC(Br)=CC=C1 325398 [1,0,0,0,0,1|2,0,0]=4 939 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 047554 [1,0,0,0,0,1|2,0,0]=4 940 B11R1.157 NC(=O)NC1=CC(Br)=CC=C1 068039 [1,0,0,0,0,1|2,0,0]=4 941 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 043387 [1,0,0,0,0,1|1,0,0]=3 942 B11R1.157 O=C(Cl)CC1=CC=CC(Br)=C1 402704 [1,0,0,0,0,1|2,0,0]=4 943 B11R1.157 O=C(Cl)CC1=CC=CC(Cl)=C1 402742 [1,0,0,0,0,1|2,0,0]=4 944 B11R1.157 O=C(Cl)CC1=CC=CC(F)=C1 038272 [1,0,0,0,0,1|2,0,0]=4 945 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 001134 [1,0,0,0,0,1|1,0,0]=3 946 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 046146 [1,0,0,0,0,1|1,0,0]=3 947 B11R1.157 O=C(O)CC1=CC(F)=CC=C1 001293 [1,0,0,0,0,1|1,0,0]=3 948 B11R1.157 O=C(O)CC1=CC=CC(O)=C1 079029 [1,0,0,0,0,1|0,0,0]=2 949 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 047874 [0,0,0,0,1,1|1,0,1]=4 950 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 001222 [0,0,0,0,1,1|1,0,1]=4 951 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 018679 [0,0,0,0,1,1|2,0,0]=4 952 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 065850 [0,0,0,0,1,1|1,0,0]=3 953 B11R1.3 CCC1=CC=C(C(N)=O)C=C1 104617 [0,0,0,0,1,1|2,0,0]=4 954 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 235735 [0,0,0,0,1,1|1,0,0]=3 955 B11R1.3 COC1=CC=C(B(O)O)C=C1 003422 [0,0,0,0,1,1|1,0,1]=4 956 B11R1.3 COC1=CC=C(B(O)O)C=N1 011048 [0,0,0,0,1,1|1,0,1]=4 957 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 098865 [0,0,0,0,1,1|1,0,0]=3 958 B11R1.3 COC1=CC=C(C(=O)O)C=C1 065743 [0,0,0,0,1,1|0,0,0]=2 959 B11R1.3 COC1=CC=C(C(C)=O)C=C1 043293 [0,0,0,0,1,1|1,0,0]=3 960 B11R1.3 COC1=CC=C(C(C)=O)C=N1 046159 [0,0,0,0,1,1|1,0,0]=3 961 B11R1.3 COC1=CC=C(C(C)O)C=C1 002977 [0,0,0,0,1,1|1,0,1]=4 962 B11R1.3 COC1=CC=C(C(N)=O)C=C1 240987 [0,0,0,0,1,1|1,0,0]=3 963 B11R1.3 COC1=CC=C(C(N)=S)C=C1 021331 [0,0,0,0,1,1|1,1,0]=4 964 B11R1.3 COC1=CC=C(C(N)=S)C=C1 097901 [0,0,0,0,1,1|1,1,0]=4 965 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 209126 [0,0,0,0,1,1|1,0,1]=4 966 B11R1.3 COC1=CN=C(C(=O)O)C=N1 076463 [0,0,0,0,1,1|1,0,0]=3 967 B11R1.3 COC1=NC=C(C(=O)O)C=C1 043843 [0,0,0,0,1,1|0,0,0]=2 968 B11R1.3 COC1=NC=C([N+](=O)[O-])C=C1 045078 [0,0,0,0,1,1|1,0,1]=4 969 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 023852 [0,0,0,0,1,1|1,1,0]=4 970 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 076798 [0,0,0,0,1,1|1,1,0]=4 971 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 075232 [0,0,0,0,1,1|2,0,0]=4 972 B11R1.3 N#CC1=CC=C(C(=O)O)C=N1 023686 [0,0,0,0,1,1|2,0,0]=4 973 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 077969 [0,0,0,0,1,1|2,0,0]=4 974 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 103985 [0,0,0,0,1,1|2,0,0]=4 975 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 209100 [0,0,0,0,1,1|2,0,0]=4 976 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 210055 [0,0,0,0,1,1|2,0,0]=4 977 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 019226 [0,0,0,0,1,1|2,0,0]=4 978 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 091971 [0,0,0,0,1,1|2,0,0]=4 979 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 M02899 [0,0,0,0,1,1|2,0,0]=4 980 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 078635 [0,0,0,0,1,1|2,0,0]=4 981 B13R1.643 COC1=CC(CCC(=O)O)=CC=C1 018802 [0,0,0,0,0,2|0,0,0]=2 982 B13R1.643 COC1=CC(\C=C\C(=O)O)=CC=C1 209774 [0,0,0,0,0,2|0,0,0]=2