0 B10R1.59 CC(=O)C1=C(C)C=C(C)O1 D46833 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.59 CC(=O)C1=C(C)N=C(Br)S1 B62817 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.59 CC(=O)C1=C(C)N=C(C)S1 D46440 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.59 CC(=O)C1=C(C)OC(C)=N1 D46406 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.59 CC(=O)C1=C(C)SC(N)=N1 A43257 [0,0,0,0,0,0|2,1,0]=3 5 B10R1.59 CC(=O)C1=C(Cl)SC(Cl)=C1 A13751 [0,0,0,0,0,0|2,1,0]=3 6 B10R1.59 CC(=O)C1=CC(C)=NN1C D1042 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.59 CC1=C(C(=O)O)N=C(Br)S1 B40835 [0,0,0,0,0,0|3,1,0]=4 8 B10R1.59 CC1=C(C(=O)O)N=C(N)S1 A69488 [0,0,0,0,0,0|3,1,0]=4 9 B10R1.59 CC1=C(C(=O)O)SC(Br)=N1 B40834 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 A41039 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.59 CC1=CC(C(=O)O)=C(C)N1 D62561 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 P64574 [0,0,0,0,0,0|1,0,0]=1 13 B10R1.59 CC1=CC(C(N)=O)=C(N)S1 A43256 [0,0,0,0,0,0|2,1,0]=3 14 B10R1.59 CC1=CN(C)N=C1C(=O)O D43227 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.59 CC1=NC(C(=O)O)=C(Br)O1 B9781 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.59 CC1=NC(C(=O)O)=C(N)S1 A41040 [0,0,0,0,0,0|3,1,0]=4 17 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 D43161 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 D43157 [0,0,0,0,0,0|3,0,0]=3 19 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 D3961 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.59 CC1=NN(C)C(C(N)=O)=C1 D43358 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.59 CC1=NN(C)C=C1C(=O)O D12015 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.59 CC1=NN(C)C=C1[N+](=O)[O-] D23453 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.59 CN1C=C(Br)C=C1C(=O)O B42854 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.59 CN1C=C(C(=O)O)C(I)=N1 K63323 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.59 CN1C=C(C(N)=O)C(N)=N1 A39069 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.59 CN1N=C(Cl)C=C1C(=O)O C10638 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.59 CN1NC(=O)C=C1C(=O)O M63710 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.59 O=C(O)C1=C(Br)SC(Br)=C1 D38606 [0,0,0,0,0,0|3,1,0]=4 29 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=C1 D15392 [0,0,0,0,0,0|3,1,0]=4 30 B9R1.22 CC1=C(C=O)N=C(N)S1 A41053 [1,0,0,0,0,0|2,1,0]=4 31 B9R1.22 CC1=C(C=O)SC(Br)=N1 B40845 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.22 CC1=CC(C)=C(C=O)N1 D37937 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.22 CC1=NC(C)=C(C=O)N1 D39065 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.22 CC1=NN(C)C(C=O)=C1 D3606 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.22 CC1=NN(C)C=C1C=O D9711 [1,0,0,0,0,0|2,0,0]=3 36 B9R1.22 O=CC1=C(Cl)SC(Cl)=C1 D40556 [1,0,0,0,0,0|2,1,0]=4 37 B9R1.35 CC(=O)C1=CC(Br)=CS1 B13699 [1,0,0,0,0,0|3,0,0]=4 38 B9R1.35 CC(=O)C1=CC(Cl)=CS1 A12844 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.35 CC(=O)C1=CC(N)=NN1 A11043 [1,0,0,0,0,0|3,0,0]=4 40 B9R1.35 CC(=O)C1=CC=C(Br)S1 A12839 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.35 CC(=O)C1=CC=C(C)S1 A46277 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.35 CC(=O)C1=CN(C)N=C1 M3257 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.35 CC(=O)C1=CN=C(Br)S1 B32437 [1,0,0,0,0,0|3,0,0]=4 44 B9R1.35 CC(=O)C1=CN=C(N)S1 A41052 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.35 CC(=O)C1=CNC(C)=C1 M46389 [1,0,0,0,0,0|1,0,0]=2 46 B9R1.35 CC(=O)C1=CSC(Cl)=C1 A1568 [1,0,0,0,0,0|1,1,0]=3 47 B9R1.35 CC(=O)C1=CSC(N)=N1 A41051 [1,0,0,0,0,0|2,1,0]=4 48 B9R1.35 CC(=O)C1=NC(C)=CO1 M43141 [1,0,0,0,0,0|3,0,0]=4 49 B9R1.35 CC(=O)C1=NN(C)C=C1 A13629 [1,0,0,0,0,0|3,0,0]=4 50 B9R1.35 CC(=O)C1=NNC(C)=C1 M62065 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.35 CC(=O)C1=NOC(C)=C1 M43142 [1,0,0,0,0,0|1,0,0]=2 52 B9R1.35 CC1=CC(C(=O)O)=CN1 M43147 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.35 CC1=CC(C(=O)O)=CS1 M5852 [1,0,0,0,0,0|1,1,0]=3 54 B9R1.35 CC1=CC(C(=O)O)=NN1 M7890 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.35 CC1=CC(C(=O)O)=NO1 M27266 [1,0,0,0,0,0|2,0,0]=3 56 B9R1.35 CC1=CC(C(N)=O)=NO1 M67790 [1,0,0,0,0,0|2,0,0]=3 57 B9R1.35 CC1=CC=C(C(=O)O)N1 M36732 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.35 CC1=CC=C(C(=O)O)O1 M38051 [1,0,0,0,0,0|3,0,0]=4 59 B9R1.35 CC1=CC=C(C(=O)O)S1 M42943 [1,0,0,0,0,0|3,0,0]=4 60 B9R1.35 CC1=NC(C(=O)O)=CN1 M19958 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.35 CC1=NC(C(=O)O)=CO1 M62066 [1,0,0,0,0,0|2,0,0]=3 62 B9R1.35 CC1=NC(C(=O)O)=CO1 M7132 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.35 CC1=NC(C(=O)O)=CS1 M3047 [1,0,0,0,0,0|2,1,0]=4 64 B9R1.35 CC1=NC(C(N)=O)=CS1 M41050 [1,0,0,0,0,0|2,1,0]=4 65 B9R1.35 CC1=NC=C(C(=O)O)O1 M9856 [1,0,0,0,0,0|3,0,0]=4 66 B9R1.35 CC1=NC=C(C(=O)O)S1 M5426 [1,0,0,0,0,0|3,0,0]=4 67 B9R1.35 CC1=NOC(C(=O)O)=C1 M38698 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.35 CN1C=C(C(=O)O)C=N1 M7676 [1,0,0,0,0,0|3,0,0]=4 69 B9R1.35 CN1C=CC(C(=O)O)=C1 M43143 [1,0,0,0,0,0|3,0,0]=4 70 B9R1.35 NC(=O)C1=CSC(Br)=C1 B40843 [1,0,0,0,0,0|2,1,0]=4 71 B9R1.35 NC1=NC(C(=O)O)=CO1 A11266 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.35 O=C(O)C1=COC(Br)=C1 B69658 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.35 O=C(O)C1=COC(Br)=N1 B15227 [1,0,0,0,0,0|3,0,0]=4 74 B9R1.35 O=C(O)C1=COC(Cl)=N1 C15228 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.35 O=C(O)C1=CSC(Br)=C1 B12752 [1,0,0,0,0,0|2,1,0]=4 76 B9R1.35 O=C(O)C1=CSC(Cl)=C1 C7720 [1,0,0,0,0,0|2,1,0]=4 77 B9R1.35 O=C(O)C1=CSC(F)=C1 F15451 [1,0,0,0,0,0|2,1,0]=4 78 B9R1.41 CC(=O)C1=C(C)N=CS1 M63978 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.41 CC(=O)C1=C(C)SC=N1 M43176 [1,0,0,0,0,0|1,1,0]=3 80 B9R1.41 CC(=O)C1=CN=CN1C M43213 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.41 CC(=O)C1=CNC=C1C M67633 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.41 CC(=O)C1=NC=CN1C A1591 [1,0,0,0,0,0|3,0,0]=4 83 B9R1.41 CC1=C(C(=O)Cl)C=NO1 M2623 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.41 CC1=C(C(=O)O)C=CN1 M39104 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.41 CC1=C(C(=O)O)C=CO1 M63194 [1,0,0,0,0,0|1,0,0]=2 86 B9R1.41 CC1=C(C(=O)O)C=CS1 M36640 [1,0,0,0,0,0|1,1,0]=3 87 B9R1.41 CC1=C(C(=O)O)C=NO1 M2622 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.41 CC1=C(C(=O)O)N=CO1 M3158 [1,0,0,0,0,0|2,0,0]=3 89 B9R1.41 CC1=C(C(=O)O)N=CS1 M3491 [1,0,0,0,0,0|2,1,0]=4 90 B9R1.41 CC1=C(C(=O)O)NC=C1 M43146 [1,0,0,0,0,0|3,0,0]=4 91 B9R1.41 CC1=C(C(=O)O)OC=C1 M42945 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.41 CC1=C(C(=O)O)OC=N1 M38000 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.41 CC1=C(C(=O)O)SC=C1 M42942 [1,0,0,0,0,0|3,0,0]=4 94 B9R1.41 CC1=C(C(=O)O)SC=N1 M67956 [1,0,0,0,0,0|3,0,0]=4 95 B9R1.41 CC1=C([N+](=O)[O-])C=NO1 M37214 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.41 CC1=CSC=C1C(=O)O M25374 [1,0,0,0,0,0|3,0,0]=4 97 B9R1.41 CC1=NNC=C1C(=O)O M9647 [1,0,0,0,0,0|3,0,0]=4 98 B9R1.41 CC1=NOC=C1C(=O)O M21771 [1,0,0,0,0,0|3,0,0]=4 99 B9R1.41 CN1C=CC=C1C(=O)O M68591 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.41 CN1N=CC=C1C(=O)O M3734 [1,0,0,0,0,0|3,0,0]=4 101 B9R1.41 NC(=O)C1=C(N)SC=C1 A41049 [1,0,0,0,0,0|2,1,0]=4 102 B9R1.41 O=C(O)C1=C(Br)OC=N1 B37246 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.41 O=C(O)C1=C(Br)SC=C1 B37969 [1,0,0,0,0,0|2,1,0]=4 104 B9R1.41 O=C(O)C1=C(Cl)SC=C1 C40686 [1,0,0,0,0,0|2,1,0]=4 105 B11R1.49 CCC1=C(C(=O)O)SC(C)=N1 E46419 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.49 CCN1N=C(C)C=C1C(=O)O E29866 [0,1,0,0,0,0|3,0,0]=4 107 B11R1.50 CCC1=NN(C)C(C(=O)O)=C1 E43666 [0,1,0,0,0,0|3,0,0]=4 108 B11R1.50 CNC1=NC(C)=C(C(C)=O)S1 M43687 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.225 CC1=CN(C)N=C1C(=O)CBr B46324 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.225 COC(=O)C1=C(C)C=C(C)N1 M63511 [0,1,0,0,0,0|2,0,0]=3 111 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 M43241 [0,1,0,0,0,0|3,0,0]=4 112 B11R1.225 COC(=O)C1=C(C)SC(Br)=C1 M45909 [0,1,0,0,0,0|1,1,0]=3 113 B11R1.225 COC(=O)C1=C(C)SC(Br)=N1 M3489 [0,1,0,0,0,0|2,1,0]=4 114 B11R1.225 COC(=O)C1=C(C)SC(N)=N1 M3486 [0,1,0,0,0,0|2,1,0]=4 115 B11R1.225 COC(=O)C1=C(Cl)SC(Br)=C1 M42316 [0,1,0,0,0,0|2,1,0]=4 116 B11R1.225 COC(=O)C1=C(N)C=C(C)S1 M12253 [0,1,0,0,0,0|3,0,0]=4 117 B11R1.225 COC(=O)C1=C(N)SC(Cl)=C1 M42863 [0,1,0,0,0,0|2,1,0]=4 118 B11R1.225 COC(=O)C1=C(O)C=C(C)S1 M46270 [0,1,0,0,0,0|3,0,0]=4 119 B11R1.225 COC(=O)C1=CC(=O)NN1C M43251 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.225 COC(=O)C1=CC(Br)=CN1C M46130 [0,1,0,0,0,0|3,0,0]=4 121 B11R1.225 COC(=O)C1=CC(C)=NN1C M43664 [0,1,0,0,0,0|2,0,0]=3 122 B11R1.225 COC(=O)C1=CC(Cl)=NN1C M10639 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.225 COC(=O)C1=CC(N)=CN1C M63534 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.673 CC1=NN(C)C(C)=C1C(=O)O T43663 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 D38007 [0,0,0,0,0,1|3,0,0]=4 126 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 B20352 [0,0,0,0,0,1|3,0,0]=4 127 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 B48253 [0,0,0,0,0,1|3,0,0]=4 128 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 B52033 [0,0,0,0,0,1|2,0,0]=3 129 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 D52785 [0,0,0,0,0,1|1,0,0]=2 130 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 D48272 [0,0,0,0,0,1|3,0,0]=4 131 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 D48284 [0,0,0,0,0,1|3,0,0]=4 132 B11R1.74 CC(=O)C1=CC(O)=CC(C)=C1 H49902 [0,0,0,0,0,1|2,0,0]=3 133 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 D49099 [0,0,0,0,0,1|3,0,0]=4 134 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 B48571 [0,0,0,0,0,1|3,0,0]=4 135 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=N1 B63466 [0,0,0,0,0,1|3,0,0]=4 136 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 D24167 [0,0,0,0,0,1|2,0,0]=3 137 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 C14183 [0,0,0,0,0,1|3,0,0]=4 138 B11R1.74 CC1=CC(C(=O)O)=CC(N)=C1 A49283 [0,0,0,0,0,1|3,0,0]=4 139 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 A12069 [0,0,0,0,0,1|3,0,0]=4 140 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 H49096 [0,0,0,0,0,1|3,0,0]=4 141 B11R1.74 CC1=CC(C(=O)O)=CC(O)=N1 H45844 [0,0,0,0,0,1|3,0,0]=4 142 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 C48594 [0,0,0,0,0,1|3,0,0]=4 143 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 C45370 [0,0,0,0,0,1|3,0,0]=4 144 B11R1.74 CC1=CC(Cl)=NC(C(=O)O)=C1 C45368 [0,0,0,0,0,1|3,0,0]=4 145 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 F48614 [0,0,0,0,0,1|3,0,0]=4 146 B11R1.74 CC1=CC(I)=CC(C(=O)O)=C1 K48633 [0,0,0,0,0,1|3,0,0]=4 147 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 M61613 [0,0,0,0,0,1|3,0,0]=4 148 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 B48242 [0,0,0,0,0,1|3,0,0]=4 149 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 B48579 [0,0,0,0,0,1|3,0,0]=4 150 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 D68875 [0,0,0,0,0,1|1,0,0]=2 151 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 H49903 [0,0,0,0,0,1|2,0,0]=3 152 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 B48244 [0,0,0,0,0,1|3,0,0]=4 153 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 C48277 [0,0,0,0,0,1|3,0,0]=4 154 B11R1.166 CC(=O)C1=C(Cl)N=C(Cl)N=C1 D11958 [0,0,0,0,0,1|3,0,0]=4 155 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 B8298 [0,0,0,0,0,1|3,0,0]=4 156 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 C48275 [0,0,0,0,0,1|3,0,0]=4 157 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 D69359 [0,0,0,0,0,1|3,0,0]=4 158 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 D67335 [0,0,0,0,0,1|3,0,0]=4 159 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 F48622 [0,0,0,0,0,1|3,0,0]=4 160 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 A49024 [0,0,0,0,0,1|3,0,0]=4 161 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 A50025 [0,0,0,0,0,1|2,0,0]=3 162 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 A49037 [0,0,0,0,0,1|3,0,0]=4 163 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 B9402 [0,0,0,0,0,1|3,0,0]=4 164 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 C61332 [0,0,0,0,0,1|3,0,0]=4 165 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 F69072 [0,0,0,0,0,1|3,0,0]=4 166 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 A49290 [0,0,0,0,0,1|3,0,0]=4 167 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl A9870 [0,0,0,0,0,1|3,0,0]=4 168 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl D63902 [0,0,0,0,0,1|3,0,0]=4 169 B11R1.166 CC(=O)C1=CNC(=O)NC1=O A69360 [0,0,0,0,0,1|3,0,0]=4 170 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C B37444 [0,0,0,0,0,1|2,0,0]=3 171 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 B24914 [0,0,0,0,0,1|3,0,0]=4 172 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=N1 B45337 [0,0,0,0,0,1|3,0,0]=4 173 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 C38469 [0,0,0,0,0,1|3,0,0]=4 174 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 C19139 [0,0,0,0,0,1|3,0,0]=4 175 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 F48615 [0,0,0,0,0,1|3,0,0]=4 176 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 F45382 [0,0,0,0,0,1|3,0,0]=4 177 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 A49284 [0,0,0,0,0,1|3,0,0]=4 178 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 H68873 [0,0,0,0,0,1|3,0,0]=4 179 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=N1 C8877 [0,0,0,0,0,1|3,0,0]=4 180 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 A60535 [0,0,0,0,0,1|3,0,0]=4 181 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 B25317 [0,0,0,0,0,1|3,0,0]=4 182 B11R1.166 CC1=CC(Br)=C(C(=O)O)N=C1 B45334 [0,0,0,0,0,1|3,0,0]=4 183 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O B38539 [0,0,0,0,0,1|3,0,0]=4 184 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 D49278 [0,0,0,0,0,1|2,0,0]=3 185 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 D54187 [0,0,0,0,0,1|2,0,1]=4 186 B11R1.166 CC1=CC(C)=C([N+](=O)[O-])C=N1 D62064 [0,0,0,0,0,1|3,0,0]=4 187 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 C38447 [0,0,0,0,0,1|3,0,0]=4 188 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=N1 C12703 [0,0,0,0,0,1|3,0,0]=4 189 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O C45367 [0,0,0,0,0,1|3,0,0]=4 190 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O C23967 [0,0,0,0,0,1|3,0,0]=4 191 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 F48610 [0,0,0,0,0,1|3,0,0]=4 192 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 F11219 [0,0,0,0,0,1|3,0,0]=4 193 B11R1.166 CC1=CC(F)=NC=C1C(=O)O F45383 [0,0,0,0,0,1|3,0,0]=4 194 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 K61454 [0,0,0,0,0,1|3,0,0]=4 195 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 A49282 [0,0,0,0,0,1|3,0,0]=4 196 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 A12850 [0,0,0,0,0,1|3,0,0]=4 197 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 A46651 [0,0,0,0,0,1|3,0,0]=4 198 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 M68144 [0,0,0,0,0,1|3,0,0]=4 199 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 H39399 [0,0,0,0,0,1|3,0,0]=4 200 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 C10451 [0,0,0,0,0,1|3,0,0]=4 201 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 D46013 [0,0,0,0,0,1|2,0,0]=3 202 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 D61273 [0,0,0,0,0,1|2,0,0]=3 203 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 D46016 [0,0,0,0,0,1|2,0,0]=3 204 B11R1.166 CC1=NC(C)=C([N+](=O)[O-])C=C1 D45999 [0,0,0,0,0,1|3,0,0]=4 205 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 A10622 [0,0,0,0,0,1|3,0,0]=4 206 B11R1.166 CC1=NC(N)=C(C(=O)O)C=N1 A62547 [0,0,0,0,0,1|3,0,0]=4 207 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 H45847 [0,0,0,0,0,1|3,0,0]=4 208 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 B48243 [0,0,0,0,0,1|3,0,0]=4 209 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 B48249 [0,0,0,0,0,1|3,0,0]=4 210 B11R1.167 CC(=O)C1=C(C)C=CC(Br)=C1 B61483 [0,0,0,0,0,1|2,0,0]=3 211 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 F62666 [0,0,0,0,0,1|2,0,0]=3 212 B11R1.167 CC(=O)C1=C(C)C=NC(Cl)=N1 C45701 [0,0,0,0,0,1|3,0,0]=4 213 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 B48247 [0,0,0,0,0,1|3,0,0]=4 214 B11R1.167 CC(=O)C1=C(F)C=CC(Cl)=C1 C48279 [0,0,0,0,0,1|3,0,0]=4 215 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 D48287 [0,0,0,0,0,1|3,0,0]=4 216 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 A49053 [0,0,0,0,0,1|3,0,0]=4 217 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 F48623 [0,0,0,0,0,1|3,0,0]=4 218 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 F48292 [0,0,0,0,0,1|3,0,0]=4 219 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 A49025 [0,0,0,0,0,1|3,0,0]=4 220 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 A49038 [0,0,0,0,0,1|3,0,0]=4 221 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 A49049 [0,0,0,0,0,1|3,0,0]=4 222 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 B3183 [0,0,0,0,0,1|3,0,0]=4 223 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 H49899 [0,0,0,0,0,1|2,0,0]=3 224 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 C48603 [0,0,0,0,0,1|3,0,0]=4 225 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 F39496 [0,0,0,0,0,1|3,0,0]=4 226 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 A49291 [0,0,0,0,0,1|3,0,0]=4 227 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 D39506 [0,0,0,0,0,1|3,0,0]=4 228 B11R1.167 CC(=O)C1=CC(Br)=CN=C1C B49027 [0,0,0,0,0,1|2,0,0]=3 229 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl B12729 [0,0,0,0,0,1|3,0,0]=4 230 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F B10880 [0,0,0,0,0,1|3,0,0]=4 231 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 B25445 [0,0,0,0,0,1|3,0,0]=4 232 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 C39492 [0,0,0,0,0,1|3,0,0]=4 233 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 F48616 [0,0,0,0,0,1|3,0,0]=4 234 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 K48634 [0,0,0,0,0,1|3,0,0]=4 235 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 A38108 [0,0,0,0,0,1|3,0,0]=4 236 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 H49098 [0,0,0,0,0,1|3,0,0]=4 237 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 B48567 [0,0,0,0,0,1|3,0,0]=4 238 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 D39532 [0,0,0,0,0,1|2,0,0]=3 239 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 C48592 [0,0,0,0,0,1|3,0,0]=4 240 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 C45365 [0,0,0,0,0,1|3,0,0]=4 241 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 F48611 [0,0,0,0,0,1|3,0,0]=4 242 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 F45384 [0,0,0,0,0,1|3,0,0]=4 243 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 I24082 [0,0,0,0,0,1|3,0,0]=4 244 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 A67448 [0,0,0,0,0,1|3,0,0]=4 245 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 A1742 [0,0,0,0,0,1|3,0,0]=4 246 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 A31834 [0,0,0,0,0,1|3,0,0]=4 247 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 A46002 [0,0,0,0,0,1|3,0,0]=4 248 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 H60608 [0,0,0,0,0,1|3,0,0]=4 249 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 A46652 [0,0,0,0,0,1|3,0,0]=4 250 B11R1.167 CC1=CC([N+](=O)[O-])=C(C)C=C1 D39515 [0,0,0,0,0,1|3,0,0]=4 251 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 D46014 [0,0,0,0,0,1|3,0,0]=4 252 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 C45357 [0,0,0,0,0,1|3,0,0]=4 253 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 F45381 [0,0,0,0,0,1|3,0,0]=4 254 B11R1.167 CC1=NC=C(Br)C=C1C(=O)O B45336 [0,0,0,0,0,1|3,0,0]=4 255 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O C9688 [0,0,0,0,0,1|3,0,0]=4 256 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 C2950 [0,0,0,0,0,1|3,0,0]=4 257 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 M2951 [0,0,0,0,0,1|3,0,0]=4 258 B11R1.645 CC1=NC(C)=C(CC(=O)O)S1 D29808 [0,0,0,0,0,1|3,0,0]=4 259 B11R1.645 CC1=NC(CC(=O)O)=C(C)S1 D62061 [0,0,0,0,0,1|2,1,0]=4 260 B8R0.1 CCOC(=O)\C=C\C=O E69342 [1,0,1,0,0,0|1,0,1]=4 261 B8R0.9 COC(=O)\C=C\C(=O)O M60916 [1,0,1,0,0,0|2,0,0]=4 262 B8R1.1 CC1=CC(C=O)=CS1 M29797 [2,0,0,0,0,0|0,1,0]=3 263 B8R1.1 CC1=CC(C=O)=NN1 M41030 [2,0,0,0,0,0|2,0,0]=4 264 B8R1.1 CC1=CC=C(C=O)N1 M43134 [2,0,0,0,0,0|2,0,0]=4 265 B8R1.1 CC1=CC=C(C=O)S1 M39272 [2,0,0,0,0,0|2,0,0]=4 266 B8R1.1 CC1=COC(C=O)=C1 M13538 [2,0,0,0,0,0|2,0,0]=4 267 B8R1.1 CC1=CSC(C=O)=C1 M42959 [2,0,0,0,0,0|2,0,0]=4 268 B8R1.1 CC1=NC(C=O)=CO1 M3278 [2,0,0,0,0,0|1,0,0]=3 269 B8R1.1 CC1=NC(C=O)=CS1 F2075 [2,0,0,0,0,0|1,1,0]=4 270 B8R1.1 CC1=NC(C=O)=NO1 M32392 [2,0,0,0,0,0|2,0,0]=4 271 B8R1.1 CC1=NC=C(C=O)S1 F2897 [2,0,0,0,0,0|2,0,0]=4 272 B8R1.1 CN1C=C(C=O)C=N1 M6127 [2,0,0,0,0,0|2,0,0]=4 273 B8R1.1 O=CC1=CSC(Br)=C1 B12754 [2,0,0,0,0,0|1,1,0]=4 274 B8R1.1 O=CC1=CSC(Cl)=C1 C1739 [2,0,0,0,0,0|1,1,0]=4 275 B8R1.11 CC1=C(C=O)N=CN1 M41031 [2,0,0,0,0,0|2,0,0]=4 276 B8R1.11 CC1=C(C=O)N=CS1 M41008 [2,0,0,0,0,0|1,1,0]=4 277 B8R1.11 CC1=C(C=O)NC=C1 M63105 [2,0,0,0,0,0|2,0,0]=4 278 B8R1.11 CC1=C(C=O)SC=C1 M39271 [2,0,0,0,0,0|2,0,0]=4 279 B8R1.11 CC1=C(C=O)SC=N1 M41007 [2,0,0,0,0,0|2,0,0]=4 280 B8R1.11 CC1=CSC=C1C=O M29934 [2,0,0,0,0,0|2,0,0]=4 281 B8R1.11 CC1=NNC=C1C=O M5838 [2,0,0,0,0,0|2,0,0]=4 282 B8R1.11 CN1C=CC=C1C=O M17296 [2,0,0,0,0,0|2,0,0]=4 283 B8R1.11 CN1N=CC=C1C=O M12515 [2,0,0,0,0,0|2,0,0]=4 284 B8R1.11 CSC1=C(C)OC=C1 M43319 [2,0,0,0,0,0|1,0,0]=3 285 B8R1.11 O=CC1=C(Br)SC=C1 B38048 [2,0,0,0,0,0|1,1,0]=4 286 B8R1.11 O=CC1=C(Cl)SC=C1 C40693 [2,0,0,0,0,0|1,1,0]=4 287 B8R1.11 O=CC1=C(I)SC=C1 K40695 [2,0,0,0,0,0|1,1,0]=4 288 B8R1.18 CC1=C(C)OC(=O)O1 D39178 [2,0,0,0,0,0|2,0,0]=4 289 B8R1.18 CC1=CC(=O)OC1=O C60582 [2,0,0,0,0,0|2,0,0]=4 290 B8R1.18 CC1=CC(=O)[C@H](C)O1 D43303 [2,0,0,0,0,0|0,0,1]=3 291 B8R1.18 CC1=CC(C)=NN1C T41425 [2,0,0,0,0,0|2,0,0]=4 292 B8R1.18 CC1=NC(C)=C(C)O1 T43377 [2,0,0,0,0,0|1,0,0]=3 293 B8R1.7 CC(=O)C1=CC=CN1 P68619 [2,0,0,0,0,0|2,0,0]=4 294 B8R1.7 CC(=O)C1=CC=CS1 A69304 [2,0,0,0,0,0|2,0,0]=4 295 B8R1.7 CC(=O)C1=CC=NN1 P61226 [2,0,0,0,0,0|2,0,0]=4 296 B8R1.7 CC(=O)C1=CC=NO1 K40990 [2,0,0,0,0,0|2,0,0]=4 297 B8R1.7 CC(=O)C1=CNC=C1 A37548 [2,0,0,0,0,0|1,0,0]=3 298 B8R1.7 CC(=O)C1=CNC=N1 A41019 [2,0,0,0,0,0|2,0,0]=4 299 B8R1.7 CC(=O)C1=CNN=C1 P22638 [2,0,0,0,0,0|2,0,0]=4 300 B8R1.7 CC(=O)C1=CSC=C1 A12828 [2,0,0,0,0,0|0,1,0]=3 301 B8R1.7 CC(=O)C1=CSC=N1 T41006 [2,0,0,0,0,0|1,1,0]=4 302 B8R1.7 CC(=O)C1=NOC=C1 K40989 [2,0,0,0,0,0|1,0,0]=3 303 B8R1.7 CC(=O)N1C=CN=C1 I37940 [2,0,0,0,0,0|2,0,0]=4 304 B8R1.7 NC(=O)C1=COC=N1 X40074 [2,0,0,0,0,0|2,0,0]=4 305 B8R1.7 O=C(O)C1=COC=C1 F14351 [2,0,0,0,0,0|1,0,0]=3 306 B8R1.7 O=C(O)C1=COC=N1 X9342 [2,0,0,0,0,0|2,0,0]=4 307 B8R1.7 O=C(O)C1=CON=C1 X24704 [2,0,0,0,0,0|2,0,0]=4 308 B8R1.7 O=C(O)C1=CSC=C1 T12825 [2,0,0,0,0,0|1,1,0]=4 309 B8R1.7 O=C(O)C1=NOC=C1 I12360 [2,0,0,0,0,0|2,0,0]=4 310 B10R1.34 CC1=C(Br)C(C)=C(C=O)N1 B46180 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.256 CC1=NN(C)C(C)=C1C=O T43648 [1,1,0,0,0,0|2,0,0]=4 312 B10R1.256 CC1=NN(C)C(Cl)=C1C=O C43078 [1,1,0,0,0,0|2,0,0]=4 313 B10R1.14 CNC(=O)C1=NOC(C)=C1 D43221 [1,1,0,0,0,0|1,0,0]=3 314 B10R1.14 COC(=O)C1=CC(C)=NO1 M43162 [1,1,0,0,0,0|2,0,0]=4 315 B10R1.14 COC(=O)C1=CC=C(C)N1 M46412 [1,1,0,0,0,0|2,0,0]=4 316 B10R1.14 COC(=O)C1=CC=C(C)O1 M46254 [1,1,0,0,0,0|2,0,0]=4 317 B10R1.14 COC(=O)C1=CN=C(C)N1 M43230 [1,1,0,0,0,0|2,0,0]=4 318 B10R1.14 COC(=O)C1=CN=C(C)O1 M3277 [1,1,0,0,0,0|2,0,0]=4 319 B10R1.14 COC(=O)C1=CNC(Br)=C1 M42853 [1,1,0,0,0,0|2,0,0]=4 320 B10R1.14 COC(=O)C1=COC(Br)=N1 M3573 [1,1,0,0,0,0|2,0,0]=4 321 B10R1.14 COC(=O)C1=COC(C)=C1 M46255 [1,1,0,0,0,0|0,0,0]=2 322 B10R1.14 COC(=O)C1=COC(C)=N1 M7131 [1,1,0,0,0,0|1,0,0]=3 323 B10R1.14 COC(=O)C1=COC(Cl)=N1 M2706 [1,1,0,0,0,0|2,0,0]=4 324 B10R1.14 COC(=O)C1=COC(N)=N1 M2978 [1,1,0,0,0,0|2,0,0]=4 325 B10R1.14 COC(=O)C1=CSC(Br)=C1 M12753 [1,1,0,0,0,0|1,1,0]=4 326 B10R1.14 COC(=O)C1=CSC(C)=N1 M2884 [1,1,0,0,0,0|1,1,0]=4 327 B10R1.14 COC(=O)C1=CSC(Cl)=C1 M1606 [1,1,0,0,0,0|1,1,0]=4 328 B10R1.14 COC(=O)C1=NNC(C)=C1 M9723 [1,1,0,0,0,0|2,0,0]=4 329 B10R1.14 COC(=O)C1=NOC(N)=C1 M61911 [1,1,0,0,0,0|2,0,0]=4 330 B10R1.31 CC(=O)C1=CNC(C=O)=C1 A63189 [1,1,0,0,0,0|1,0,1]=4 331 B10R1.58 CC(=O)C1=CC(C)=C(Br)S1 B45953 [1,1,0,0,0,0|2,0,0]=4 332 B10R1.194 CC(=O)C1=CNC(Br)=C1C B46179 [1,1,0,0,0,0|2,0,0]=4 333 B10R1.194 CC1=C(N)C(C(=O)O)=CS1 A43159 [1,1,0,0,0,0|1,1,0]=4 334 B10R1.39 CCN1C=CC=C1C(C)=O E46916 [1,1,0,0,0,0|2,0,0]=4 335 B10R1.149 COC(=O)C1=C(Br)SC=C1 M42697 [1,1,0,0,0,0|1,1,0]=4 336 B10R1.149 COC(=O)C1=C(C)C=CN1 M11830 [1,1,0,0,0,0|2,0,0]=4 337 B10R1.149 COC(=O)C1=C(C)C=CO1 M46253 [1,1,0,0,0,0|2,0,0]=4 338 B10R1.149 COC(=O)C1=C(C)C=CS1 M46249 [1,1,0,0,0,0|2,0,0]=4 339 B10R1.149 COC(=O)C1=C(C)N=CS1 M67491 [1,1,0,0,0,0|2,0,0]=4 340 B10R1.149 COC(=O)C1=C(C)OC=C1 M63405 [1,1,0,0,0,0|0,0,0]=2 341 B10R1.149 COC(=O)C1=C(C)SC=C1 M46248 [1,1,0,0,0,0|0,1,0]=3 342 B10R1.149 COC(=O)C1=C(C)SC=N1 M3490 [1,1,0,0,0,0|1,1,0]=4 343 B10R1.149 COC(=O)C1=C(Cl)SC=C1 M42700 [1,1,0,0,0,0|1,1,0]=4 344 B10R1.149 COC(=O)C1=C(N)SC=C1 M12698 [1,1,0,0,0,0|1,1,0]=4 345 B10R1.149 COC(=O)C1=CC=NN1C M21904 [1,1,0,0,0,0|2,0,0]=4 346 B10R1.149 COC(=O)C1=CNC=C1C M23532 [1,1,0,0,0,0|2,0,0]=4 347 B10R1.149 COC(=O)C1=CNN=C1C M43226 [1,1,0,0,0,0|2,0,0]=4 348 B10R1.192 CC1=CNC(C)=C1C(=O)O D67822 [1,1,0,0,0,0|2,0,0]=4 349 B10R1.192 CC1=NOC(C)=C1C(=O)O D67476 [1,1,0,0,0,0|2,0,0]=4 350 B12R1.11 COC1=CC(C)=CC(C(=O)O)=C1 M49914 [0,1,0,0,0,1|2,0,0]=4 351 B12R1.11 COC1=CC(C)=CC(C(C)=O)=C1 M52814 [0,1,0,0,0,1|1,0,0]=3 352 B12R1.358 COC(=O)C1=CC(Br)=NC(C)=C1 M26075 [0,1,0,0,0,1|2,0,0]=4 353 B12R1.358 COC(=O)C1=CC(C)=CC(Br)=C1 M51897 [0,1,0,0,0,1|2,0,0]=4 354 B12R1.358 COC(=O)C1=CC(C)=CC(C)=C1 M52794 [0,1,0,0,0,1|1,0,0]=3 355 B12R1.358 COC(=O)C1=CC(C)=CC(Cl)=N1 M48948 [0,1,0,0,0,1|2,0,0]=4 356 B12R1.358 COC(=O)C1=CC(C)=NC(C)=C1 M50068 [0,1,0,0,0,1|1,0,0]=3 357 B12R1.358 COC(=O)C1=CC(Cl)=NC(C)=C1 C10736 [0,1,0,0,0,1|2,0,0]=4 358 B12R1.358 COC(=O)C1=CC(N)=CC(C)=C1 M50060 [0,1,0,0,0,1|2,0,0]=4 359 B12R1.358 COC(=O)C1=NC(C)=CC(C)=N1 M46686 [0,1,0,0,0,1|2,0,0]=4 360 B12R1.511 CC1=CC(C(=O)O)=C(N)C(C)=C1 A19865 [0,1,0,0,0,1|2,0,0]=4 361 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1Br B63456 [0,1,0,0,0,1|2,0,0]=4 362 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1N A69197 [0,1,0,0,0,1|2,0,0]=4 363 B12R1.1005 CC1=CC(C(=O)O)=CC(C)=C1O H49927 [0,1,0,0,0,1|2,0,0]=4 364 B12R1.1005 CC1=CC(C(N)=O)=CC(C)=C1I K66951 [0,1,0,0,0,1|2,0,0]=4 365 B12R1.57 COC1=C(C(=O)O)C=CC(C)=C1 M49919 [0,1,0,0,0,1|2,0,0]=4 366 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=C1 B38809 [0,1,0,0,0,1|2,0,0]=4 367 B12R1.57 COC1=C(C(C)=O)C=CC(F)=C1 F51948 [0,1,0,0,0,1|2,0,0]=4 368 B12R1.57 COC1=C(C(C)=O)C=CC(N)=C1 A50071 [0,1,0,0,0,1|2,0,0]=4 369 B12R1.232 CC1=CC(C)=C(Br)C=C1C(=O)O B67324 [0,1,0,0,0,1|2,0,0]=4 370 B12R1.232 CC1=NC(C)=C(C(N)=O)N=C1Cl C66400 [0,1,0,0,0,1|2,0,0]=4 371 B12R1.452 COC1=CC(C)=C(C(=O)O)C=C1 M49917 [0,1,0,0,0,1|2,0,0]=4 372 B12R1.452 COC1=CC(Cl)=C(C(C)=O)C=C1 C51927 [0,1,0,0,0,1|2,0,0]=4 373 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 F15561 [0,1,0,0,0,1|2,0,0]=4 374 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 A61340 [0,1,0,0,0,1|2,0,0]=4 375 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 H1583 [0,1,0,0,0,1|2,0,0]=4 376 B12R1.452 CSC1=NC(N)=C(C(C)=O)C=N1 A12134 [0,1,0,0,0,1|2,0,0]=4 377 B12R1.452 CSC1=NC=C(C(C)=O)C(Cl)=N1 C45703 [0,1,0,0,0,1|2,0,0]=4 378 B12R1.1000 CC(=O)C1=C(C)C=C(C)C=C1C T62393 [0,1,0,0,0,1|1,0,0]=3 379 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(Cl)=N1 C48951 [0,1,0,0,0,1|2,0,0]=4 380 B12R1.1000 CC1=CC(C)=C(C(N)=O)C(Cl)=N1 C31111 [0,1,0,0,0,1|2,0,0]=4 381 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=C1 H63791 [0,1,0,0,0,1|2,0,0]=4 382 B12R1.1000 CC1=CC(O)=C(C(=O)O)C(C)=N1 H49336 [0,1,0,0,0,1|2,0,0]=4 383 B12R1.1703 COC(=O)C1=C(Br)C=C(C)C=C1 M51893 [0,1,0,0,0,1|2,0,0]=4 384 B12R1.1703 COC(=O)C1=C(C)C=C(Br)C=C1 M51898 [0,1,0,0,0,1|2,0,0]=4 385 B12R1.1703 COC(=O)C1=C(C)C=C(C)C=C1 M52792 [0,1,0,0,0,1|1,0,0]=3 386 B12R1.1703 COC(=O)C1=C(C)C=C(F)C=C1 M37927 [0,1,0,0,0,1|2,0,0]=4 387 B12R1.1703 COC(=O)C1=C(C)C=C(I)C=C1 M51962 [0,1,0,0,0,1|2,0,0]=4 388 B12R1.1703 COC(=O)C1=C(C)C=C(N)C=C1 M50061 [0,1,0,0,0,1|2,0,0]=4 389 B12R1.1703 COC(=O)C1=C(C)C=C(O)C=C1 M49924 [0,1,0,0,0,1|2,0,0]=4 390 B12R1.1703 COC(=O)C1=C(C)N=C(Cl)C=C1 M48947 [0,1,0,0,0,1|2,0,0]=4 391 B12R1.1703 COC(=O)C1=C(C)N=C(F)C=C1 M48974 [0,1,0,0,0,1|2,0,0]=4 392 B12R1.1703 COC(=O)C1=C(C)N=C(N)C=C1 M62058 [0,1,0,0,0,1|2,0,0]=4 393 B12R1.1703 COC(=O)C1=C(N)C=C(C)C=C1 M60968 [0,1,0,0,0,1|2,0,0]=4 394 B12R1.1703 COC(=O)C1=C(N)C=C(C)N=C1 M39076 [0,1,0,0,0,1|2,0,0]=4 395 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 M69045 [0,1,0,0,0,1|2,0,0]=4 396 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Br M48919 [0,1,0,0,0,1|2,0,0]=4 397 B12R1.1703 COC(=O)C1=CC=C(C)N=C1Cl M24115 [0,1,0,0,0,1|2,0,0]=4 398 B12R1.1703 COC(=O)C1=CN=C(Cl)C=C1C M37333 [0,1,0,0,0,1|2,0,0]=4 399 B12R1.1703 COC(=O)C1=NC=C(Br)C=C1C M22333 [0,1,0,0,0,1|2,0,0]=4 400 B12R1.1703 COC(=O)C1=NC=C(C)N=C1Cl M39043 [0,1,0,0,0,1|2,0,0]=4 401 B12R1.1703 COC(=O)C1=NC=C(F)C=C1C M18811 [0,1,0,0,0,1|2,0,0]=4 402 B12R1.46 COC1=C(C(=O)O)C=C(C)C=C1 M49911 [0,1,0,0,0,1|2,0,0]=4 403 B12R1.46 COC1=C(C(=O)O)C=C(C)C=N1 M62514 [0,1,0,0,0,1|2,0,0]=4 404 B12R1.46 COC1=C(C(C)=O)C=C(C)C=C1 M52812 [0,1,0,0,0,1|1,0,0]=3 405 B12R1.46 COC1=C(C(C)=O)C=C(F)C=C1 F51949 [0,1,0,0,0,1|2,0,0]=4 406 B12R1.354 COC(=O)C1=C(Br)C=CC(C)=C1 M51894 [0,1,0,0,0,1|2,0,0]=4 407 B12R1.354 COC(=O)C1=C(C)C=CC(Br)=C1 M51902 [0,1,0,0,0,1|2,0,0]=4 408 B12R1.354 COC(=O)C1=C(C)C=CC(Cl)=C1 M51926 [0,1,0,0,0,1|2,0,0]=4 409 B12R1.354 COC(=O)C1=C(C)C=CC(F)=C1 M51944 [0,1,0,0,0,1|2,0,0]=4 410 B12R1.354 COC(=O)C1=C(C)C=CC(I)=C1 M51964 [0,1,0,0,0,1|2,0,0]=4 411 B12R1.354 COC(=O)C1=C(C)C=CC(N)=C1 M50062 [0,1,0,0,0,1|2,0,0]=4 412 B12R1.354 COC(=O)C1=C(C)C=CC(O)=C1 M25125 [0,1,0,0,0,1|2,0,0]=4 413 B12R1.354 COC(=O)C1=C(F)C=CC(C)=C1 M51941 [0,1,0,0,0,1|2,0,0]=4 414 B12R1.354 COC(=O)C1=C(I)C=CC(C)=C1 M51959 [0,1,0,0,0,1|2,0,0]=4 415 B12R1.354 COC(=O)C1=C(N)C=CC(C)=C1 M50059 [0,1,0,0,0,1|2,0,0]=4 416 B12R1.354 COC(=O)C1=CC(Br)=CN=C1C M62490 [0,1,0,0,0,1|2,0,0]=4 417 B12R1.354 COC(=O)C1=CC(C)=CN=C1Br M48918 [0,1,0,0,0,1|2,0,0]=4 418 B12R1.354 COC(=O)C1=CC(C)=CN=C1Cl M48944 [0,1,0,0,0,1|2,0,0]=4 419 B12R1.354 COC(=O)C1=CC(Cl)=CN=C1C M48946 [0,1,0,0,0,1|2,0,0]=4 420 B12R1.453 COC1=CC(C(=O)O)=C(C)C=C1 M37945 [0,1,0,0,0,1|2,0,0]=4 421 B12R1.453 COC1=CC(C(C)=O)=C(Br)C=C1 B51903 [0,1,0,0,0,1|2,0,0]=4 422 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 H49921 [0,1,0,0,0,1|2,0,0]=4 423 B12R1.532 COC(=O)CC1=C(C)SC(C)=N1 M46934 [0,1,0,0,0,1|1,1,0]=4 424 B12R1.854 CC(=O)OC1=C(C)O[C@@H](C)C1=O D46857 [0,1,0,0,0,1|0,0,1]=3 425 B12R1.608 COC(=O)C1=CC(OC)=NN1C M43679 [0,2,0,0,0,0|2,0,0]=4 426 B12R1.313 CCOC(=O)C1=C(C)N=C(C)S1 E46933 [0,2,0,0,0,0|2,0,0]=4 427 B12R1.313 CCOC(=O)C1=C(N)NC(C)=C1 E1827 [0,2,0,0,0,0|2,0,0]=4 428 B12R1.313 CCOC(=O)C1=CC(C)=NN1C E3956 [0,2,0,0,0,0|2,0,0]=4 429 B12R1.3443 COC(=O)C1=C(C)C(C)=NN1C M46992 [0,2,0,0,0,0|2,0,0]=4 430 B12R1.3443 COC(=O)C1=C(C)NC(C)=C1Br M46777 [0,2,0,0,0,0|1,0,0]=3 431 B12R1.3443 COC(=O)C1=C(N)SC(C)=C1C M46935 [0,2,0,0,0,0|1,1,0]=4 432 B10R1.61 CC(=O)C1=C(C)C=CC=C1 T39529 [0,0,1,1,0,0|1,0,1]=4 433 B10R1.61 CC(=O)C1=C(C)N=CC=C1 M21788 [0,0,1,1,0,0|1,0,1]=4 434 B10R1.61 CC(=O)C1=C(C)N=CN=C1 M45983 [0,0,1,1,0,0|2,0,0]=4 435 B10R1.113 CC(=O)C1=CC(C)=CC=C1 T39528 [0,0,1,1,0,0|1,0,1]=4 436 B10R1.113 CC(=O)C1=CC(C)=NC=C1 M49265 [0,0,1,1,0,0|1,0,1]=4 437 B10R1.113 CC(=O)C1=CC(O)=CC=C1 H60763 [0,0,1,1,0,0|0,0,2]=4 438 B10R1.113 CC(=O)C1=CN=CC(C)=C1 M63719 [0,0,1,1,0,0|2,0,0]=4 439 B10R2.32 O=C1CCC2=C1C=CS2 D45612 [1,0,0,1,0,0|0,1,0]=3 440 B10R2.32 O=C1CCC2=C1SC=C2 C67539 [1,0,0,1,0,0|2,0,0]=4 441 B12R2.612 CC1=CC2=C(C=C1)C(=O)CC2 M52405 [0,0,0,1,0,1|1,0,0]=3 442 B12R2.612 CC1=CC2=C(C=C1)C(=O)OC2 M51553 [0,0,0,1,0,1|2,0,0]=4 443 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 A3834 [0,0,0,1,0,1|2,0,0]=4 444 B12R2.612 O=C1C=CC2=C(CCC2=O)N1 D63506 [0,0,0,1,0,1|2,0,0]=4 445 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 B23186 [0,0,0,1,0,1|2,0,0]=4 446 B12R2.612 O=C1CCC2=C1C=CC(Br)=N2 B61632 [0,0,0,1,0,1|2,0,0]=4 447 B12R2.612 O=C1CCC2=C1C=CC(Cl)=C2 C39570 [0,0,0,1,0,1|2,0,0]=4 448 B12R2.612 O=C1CCC2=C1C=CC(F)=C2 F51326 [0,0,0,1,0,1|2,0,0]=4 449 B12R2.612 O=C1CCC2=C1C=CC(I)=C2 D9498 [0,0,0,1,0,1|2,0,0]=4 450 B12R2.612 O=C1CCC2=C1C=CC(O)=C2 H38546 [0,0,0,1,0,1|2,0,0]=4 451 B12R2.132 CC1=CC2=C(C=C1)COC2=O M51554 [0,0,0,1,0,1|2,0,0]=4 452 B12R2.132 NC1=CC2=C(C=C1)CCC2=O A4485 [0,0,0,1,0,1|2,0,0]=4 453 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 B13141 [0,0,0,1,0,1|2,0,0]=4 454 B12R2.132 O=C1CCC2=C1C=C(Cl)C=C2 C13148 [0,0,0,1,0,1|2,0,0]=4 455 B12R2.132 O=C1CCC2=C1C=C(F)C=C2 F51322 [0,0,0,1,0,1|2,0,0]=4 456 B12R2.132 O=C1CCC2=C1C=C(I)C=C2 D9500 [0,0,0,1,0,1|2,0,0]=4 457 B12R2.132 O=C1CCC2=C1C=C(O)C=C2 H51556 [0,0,0,1,0,1|2,0,0]=4 458 B12R2.202 O=C1NCCC2=C1C=C(Br)S2 B11991 [0,1,0,1,0,0|1,1,0]=4 459 B10R1.8 CC1=CC(Br)=CC(C=O)=C1 B48715 [1,0,0,0,0,1|2,0,0]=4 460 B10R1.8 CC1=CC(C)=CC(C=O)=C1 D49876 [1,0,0,0,0,1|1,0,0]=3 461 B10R1.8 CC1=CC(C=O)=CC(C)=N1 D38336 [1,0,0,0,0,1|1,0,0]=3 462 B10R1.8 CC1=CC(C=O)=CC(O)=C1 H49072 [1,0,0,0,0,1|2,0,0]=4 463 B10R1.8 CC1=CC(Cl)=CC(C=O)=C1 C48729 [1,0,0,0,0,1|2,0,0]=4 464 B10R1.8 CC1=CC(Cl)=CC(C=O)=N1 C45485 [1,0,0,0,0,1|2,0,0]=4 465 B10R1.8 CC1=CC(F)=CC(C=O)=C1 F38057 [1,0,0,0,0,1|2,0,0]=4 466 B10R1.8 COC1=CC(C)=CC(C)=C1 M50277 [1,0,0,0,0,1|2,0,0]=4 467 B10R1.8 COC1=NC(C)=NC(C)=C1 M43636 [1,0,0,0,0,1|2,0,0]=4 468 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 B48716 [1,0,0,0,0,1|2,0,0]=4 469 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 C23512 [1,0,0,0,0,1|2,0,0]=4 470 B10R1.25 CC1=C(C=O)C=CC(Cl)=N1 C45486 [1,0,0,0,0,1|2,0,0]=4 471 B10R1.25 CC1=C(C=O)C=CC(F)=C1 F48741 [1,0,0,0,0,1|2,0,0]=4 472 B10R1.25 CC1=C(C=O)C=CC(F)=N1 F45499 [1,0,0,0,0,1|2,0,0]=4 473 B10R1.25 CC1=C(C=O)C=CC(O)=C1 H49073 [1,0,0,0,0,1|2,0,0]=4 474 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 B48711 [1,0,0,0,0,1|2,0,0]=4 475 B10R1.25 CC1=CC(Br)=CN=C1C=O B61323 [1,0,0,0,0,1|2,0,0]=4 476 B10R1.25 CC1=CC(Br)=NC=C1C=O B45475 [1,0,0,0,0,1|2,0,0]=4 477 B10R1.25 CC1=CC(C)=C(C=O)C=C1 D49874 [1,0,0,0,0,1|1,0,0]=3 478 B10R1.25 CC1=CC(C)=C(C=O)C=N1 D49261 [1,0,0,0,0,1|1,0,0]=3 479 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 C48726 [1,0,0,0,0,1|2,0,0]=4 480 B10R1.25 CC1=CC(Cl)=NC=C1C=O C45487 [1,0,0,0,0,1|2,0,0]=4 481 B10R1.25 CC1=CC(F)=C(C=O)C=C1 F48737 [1,0,0,0,0,1|2,0,0]=4 482 B10R1.25 CC1=CC(O)=C(C=O)C=C1 H38560 [1,0,0,0,0,1|2,0,0]=4 483 B10R1.25 CC1=CC=C(C=O)C(Cl)=N1 C45484 [1,0,0,0,0,1|2,0,0]=4 484 B10R1.25 COC1=C(C)C=C(C)C=C1 D50266 [1,0,0,0,0,1|2,0,0]=4 485 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [1,0,0,0,0,1|1,0,0]=3 486 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C68865 [1,0,0,0,0,1|2,0,0]=4 487 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [1,0,0,0,0,1|2,0,0]=4 488 B10R1.13 CC(=O)C1=CC=C(I)C=C1 K39500 [1,0,0,0,0,1|2,0,0]=4 489 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A68181 [1,0,0,0,0,1|2,0,0]=4 490 B10R1.13 CC(=O)C1=CC=C(O)C=C1 H64899 [1,0,0,0,0,1|2,0,0]=4 491 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B3106 [1,0,0,0,0,1|2,0,0]=4 492 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [1,0,0,0,0,1|1,0,0]=3 493 B10R1.13 CC(=O)C1=CN=C(C)N=C1 M13671 [1,0,0,0,0,1|1,0,0]=3 494 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 A24257 [1,0,0,0,0,1|2,0,0]=4 495 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 C16565 [1,0,0,0,0,1|2,0,0]=4 496 B10R1.13 CC(=O)C1=CN=C(F)C=C1 F45498 [1,0,0,0,0,1|2,0,0]=4 497 B10R1.13 CC(=O)C1=CN=C(N)C=C1 A22139 [1,0,0,0,0,1|2,0,0]=4 498 B10R1.13 CC(=O)C1=CN=C(N)N=C1 A43099 [1,0,0,0,0,1|2,0,0]=4 499 B10R1.13 CC(=O)C1=CNC(=O)C=C1 A67563 [1,0,0,0,0,1|2,0,0]=4 500 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 B22347 [1,0,0,0,0,1|2,0,0]=4 501 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [1,0,0,0,0,1|1,0,0]=3 502 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 C26822 [1,0,0,0,0,1|2,0,0]=4 503 B10R1.13 CC(=O)C1=NC=C(O)C=C1 H45820 [1,0,0,0,0,1|2,0,0]=4 504 B10R1.13 CC(=O)C1=NC=C(O)N=C1 H42776 [1,0,0,0,0,1|2,0,0]=4 505 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [1,0,0,0,0,1|2,0,0]=4 506 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [1,0,0,0,0,1|2,0,0]=4 507 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [1,0,0,0,0,1|2,0,0]=4 508 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M23707 [1,0,0,0,0,1|2,0,0]=4 509 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M46550 [1,0,0,0,0,1|2,0,0]=4 510 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M4677 [1,0,0,0,0,1|2,0,0]=4 511 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [1,0,0,0,0,1|2,0,0]=4 512 B10R1.13 O=C1C=CC(C(=O)O)=CO1 C7780 [1,0,0,0,0,1|2,0,0]=4 513 B12R1.101 CC1=CC(C)=CC(CC(=O)O)=C1 D68844 [0,0,0,0,0,2|2,0,0]=4 514 B12R1.233 CC(=O)NC1=C(F)C=C(C)C=C1 F49864 [0,0,0,0,0,2|2,0,0]=4 515 B12R1.233 CC1=CC(C)=C(CC(=O)O)C=C1 D52798 [0,0,0,0,0,2|2,0,0]=4 516 B12R1.127 CC(=O)NC1=C(C)C=CC(F)=C1 A49862 [0,0,0,0,0,2|2,0,0]=4 517 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 D39606 [0,0,0,0,0,2|2,0,0]=4