0 B11R1.280 C#CC1=CC(C=O)=C(O)C=C1 MC428150 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 CS21640 [0,0,0,0,0,0|1,0,0]=1 2 B11R1.280 CC1=C(C#N)C=C(C=O)C=C1 MC41111 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.280 CCC1=C(F)C=CC(C#N)=C1 MC40656 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.280 CCC1=C(F)C=CC(CN)=C1 MC111150 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 MC433729 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.280 CCC1=C(O)C=CC(C=O)=C1 MC441223 [0,0,0,0,0,0|1,0,0]=1 7 B11R1.280 COC1=C(Br)C=CC(C#N)=C1 MC30328 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.280 COC1=C(Br)C=CC(CO)=C1 CS21375 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.280 COC1=C(C)C=CC(C#N)=C1 CS22338 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.280 COC1=C(C)C=CC(C=O)=C1 CS21938 [0,0,0,0,0,0|1,0,0]=1 11 B11R1.280 COC1=C(C)C=CC(CN)=C1 MC111182 [0,0,0,0,0,0|2,0,1]=3 12 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 CS15135 [0,0,0,0,0,0|1,0,0]=1 13 B11R1.280 COC1=C(Cl)C=CC(CBr)=C1 MC40533 [0,0,0,0,0,0|2,0,1]=3 14 B11R1.280 COC1=C(Cl)C=CC(CN)=C1 MC40809 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 CS17422 [0,0,0,0,0,0|1,0,2]=3 16 B11R1.280 COC1=C(F)C=CC(C#N)=C1 MC30271 [0,0,0,0,0,0|2,0,1]=3 17 B11R1.280 COC1=C(F)C=CC(C=O)=C1 MC429581 [0,0,0,0,0,0|1,0,0]=1 18 B11R1.280 COC1=C(F)C=CC(CBr)=C1 MC429580 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.280 COC1=C(F)C=CC(CN)=C1 MC433899 [0,0,0,0,0,0|2,0,1]=3 20 B11R1.280 COC1=C(F)C=CC(CO)=C1 MC40713 [0,0,0,0,0,0|1,0,2]=3 21 B11R1.280 COC1=C(N)C=CC(C#N)=C1 CS14461 [0,0,0,0,0,0|2,0,1]=3 22 B11R1.280 COC1=C(O)C=CC(C#N)=C1 MC40664 [0,0,0,0,0,0|1,0,1]=2 23 B11R1.280 COC1=C(O)C=CC(C=O)=C1 CS13553 [0,0,0,0,0,0|0,0,0]=0 24 B11R1.280 COC1=C(O)C=CC(CN)=C1 CS22873 [0,0,0,0,0,0|1,0,1]=2 25 B11R1.280 COC1=C(O)C=CC(CO)=C1 MC40721 [0,0,0,0,0,0|0,0,2]=2 26 B11R1.280 COC1=CC(C#N)=CN=C1Br MC108362 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.280 COC1=CC(C=O)=C(O)C=C1 CS20949 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.280 COC1=CC(CBr)=NC=C1F MC431887 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.280 COC1=CC(OC)=C(Br)C=C1 MC433149 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.280 COC1=CC(OC)=C(O)C=C1 CS21112 [0,0,0,0,0,0|2,0,0]=2 31 B11R1.280 COC1=CC=C(N)C(OC)=N1 CS13926 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.280 COc1ccc(F)c(OC)c1 MC433522 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.280 N#CC1=C(Br)C=CC(C=O)=C1 CS14722 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.280 N#CC1=C(Cl)C=CC(C=O)=C1 CS17615 [0,0,0,0,0,0|3,0,0]=3 35 B11R1.280 N#CC1=C(F)C=CC(C=O)=C1 CS20608 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.280 N#CC1=C(I)C=CC(C=O)=C1 MC431062 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.280 N#CC1=CC(C#N)=C(O)C=C1 MC442316 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.280 N#CC1=CC(C=O)=C(O)C=C1 MC20826 [0,0,0,0,0,0|3,0,1]=4 39 B10R1.30 CC1=CC(C#N)=C(O)C=C1 MC442255 [1,0,0,0,0,0|2,0,1]=4 40 B10R1.30 CC1=CC(C=O)=C(O)C=C1 MC33170 [1,0,0,0,0,0|2,0,1]=4 41 B10R1.30 CC1=CC(CN)=C(O)C=C1 MC431862 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.30 CCC1=C(Br)C=CC(I)=C1 MC428380 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 MC20088 [1,0,0,0,0,0|2,0,1]=4 44 B10R1.30 CCC1=C(F)C=CC(Br)=C1 MC41552 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.30 CCC1=C(F)C=CC(O)=C1 MC442497 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.30 CCC1=C(N)C=CC(Br)=C1 MC30325 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.30 CCC1=C(N)C=CC(Br)=C1 MC30326 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.30 CCC1=C(N)C=CC(Cl)=C1 MC30090 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.30 CCC1=NC(C)=CC=C1O CS13984 [1,0,0,0,0,0|2,0,1]=4 50 B10R1.30 CCC1=NC(C)=CC=C1O MC41617 [1,0,0,0,0,0|2,0,1]=4 51 B10R1.30 CNC1=C(I)C=CC(F)=C1 MC430179 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.30 CNC1=CC(Br)=CC=C1N CS13254 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.30 COC1=C(Br)C=CC(Br)=C1 CS12737 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.30 COC1=C(Br)C=CC(C)=C1 MC20209 [1,0,0,0,0,0|1,0,1]=3 55 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 CS21371 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.30 COC1=C(Br)C=CC(F)=C1 CS10394 [1,0,0,0,0,0|2,0,0]=3 57 B10R1.30 COC1=C(Br)C=CC(I)=C1 MC33199 [1,0,0,0,0,0|2,0,0]=3 58 B10R1.30 COC1=C(Br)C=CC(N)=C1 CS18102 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.30 COC1=C(Br)C=CC(N)=N1 MC429703 [1,0,0,0,0,0|3,0,0]=4 60 B10R1.30 COC1=C(Br)C=CC(O)=C1 MC443538 [1,0,0,0,0,0|1,0,1]=3 61 B10R1.30 COC1=C(Br)N=CC(N)=C1 CS12409 [1,0,0,0,0,0|3,0,0]=4 62 B10R1.30 COC1=C(C)C=CC(Cl)=C1 MC33132 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.30 COC1=C(C)C=CC(N)=C1 MC40926 [1,0,0,0,0,0|2,0,0]=3 64 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 MC33062 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 MC33073 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.30 COC1=C(Cl)C=CC(F)=C1 MC41328 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.30 COC1=C(Cl)C=CC(I)=C1 MC20290 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS22759 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.30 COC1=C(Cl)C=CC(O)=C1 MC441231 [1,0,0,0,0,0|1,0,1]=3 70 B10R1.30 COC1=C(Cl)N=CC(O)=C1 MC103609 [1,0,0,0,0,0|2,0,1]=4 71 B10R1.30 COC1=C(F)C=CC(Br)=C1 CS19804 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.30 COC1=C(F)C=CC(F)=C1 MC41336 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.30 COC1=C(F)C=CC(N)=C1 CS10516 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.30 COC1=C(F)C=CC(O)=C1 CS16180 [1,0,0,0,0,0|1,0,1]=3 75 B10R1.30 COC1=C(I)C=CC(Br)=C1 MC41321 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.30 COC1=C(I)C=CC(Cl)=C1 MC20291 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.30 COC1=C(I)C=CC(F)=C1 MC41340 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.30 COC1=C(I)C=CC(I)=C1 MC442228 [1,0,0,0,0,0|2,0,0]=3 79 B10R1.30 COC1=C(N)C=CC(Br)=C1 CS19178 [1,0,0,0,0,0|2,0,0]=3 80 B10R1.30 COC1=C(N)C=CC(Cl)=C1 MC30210 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.30 COC1=C(N)C=CC(F)=C1 CS12096 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.30 COC1=C(N)C=CC(F)=C1 MC40917 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.30 COC1=C(N)C=CC(I)=C1 MC21014 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.30 COC1=C(N)C=CC(N)=C1 CS21132 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.30 COC1=C(O)C=CC(Br)=C1 CS22682 [1,0,0,0,0,0|1,0,0]=2 86 B10R1.30 COC1=C(O)C=CC(C)=C1 CS16322 [1,0,0,0,0,0|0,0,1]=2 87 B10R1.30 COC1=C(O)C=CC(Cl)=C1 MC41171 [1,0,0,0,0,0|1,0,0]=2 88 B10R1.30 COC1=C(O)C=CC(F)=C1 MC41195 [1,0,0,0,0,0|1,0,0]=2 89 B10R1.30 COC1=C(O)C=CC(I)=C1 MC41200 [1,0,0,0,0,0|1,0,0]=2 90 B10R1.30 COC1=C(O)C=CC(N)=C1 MC41143 [1,0,0,0,0,0|1,0,0]=2 91 B10R1.30 COC1=C(O)C=CC(N)=C1 MC442300 [1,0,0,0,0,0|1,0,0]=2 92 B10R1.30 COC1=C(O)C=CC(O)=C1 MC33205 [1,0,0,0,0,0|0,0,1]=2 93 B10R1.30 COC1=C(O)C=NC(Br)=C1 MC429892 [1,0,0,0,0,0|2,0,0]=3 94 B10R1.30 COC1=CC(Br)=CN=C1Cl CS10254 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.30 COC1=CC(Br)=CN=C1F MC429568 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.30 COC1=CC(Br)=CN=C1N CS14023 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.30 COC1=CC(Br)=CNC1=O MC432413 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.30 COC1=CC(Br)=NC=C1Br MC430262 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.30 COC1=CC(Br)=NC=C1Cl MC432372 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.30 COC1=CC(Cl)=NC=C1Br CS14850 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.30 COC1=CC(Cl)=NC=C1Cl CS15874 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.30 COC1=CC(F)=CN=C1Br MC432342 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.30 COC1=CC(F)=CN=C1Cl MC432017 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.30 COC1=CC(F)=NC=C1Br MC432632 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.30 COC1=CC(I)=CN=C1Br MC442221 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.30 COC1=CC(I)=CN=C1I MC442220 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.30 COC1=CC(N)=NC=C1Br MC431984 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.30 COC1=CC(N)=NC=C1F MC431830 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.30 COC1=CC(O)=CN=C1Br MC429848 [1,0,0,0,0,0|2,0,1]=4 110 B10R1.30 COC1=CC(O)=NC=C1Br MC429897 [1,0,0,0,0,0|2,0,1]=4 111 B10R1.30 COC1=NC(Br)=CC=C1F MC432018 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.30 COC1=NC(Br)=CC=C1N CS18540 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.30 COC1=NC(C)=CC=C1Br CS19284 [1,0,0,0,0,0|2,0,1]=4 114 B10R1.30 COC1=NC(C)=CC=C1F MC103284 [1,0,0,0,0,0|2,0,1]=4 115 B10R1.30 COC1=NC(C)=CC=C1N CS13867 [1,0,0,0,0,0|2,0,1]=4 116 B10R1.30 COC1=NC(Cl)=CC=C1Br CS16211 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.30 COC1=NC(Cl)=CC=C1F MC432020 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.30 COC1=NC(Cl)=CC=C1N CS10669 [1,0,0,0,0,0|3,0,0]=4 119 B10R1.30 COC1=NC(F)=CC=C1Br MC429643 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 CS10240 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.30 N#CC1=C(O)C=CC(Cl)=C1 MC30046 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.30 N#CC1=C(O)C=CC(N)=C1 CS10205 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.30 NCC1=C(O)C=CC(Br)=C1 CS18138 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 CS20107 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.30 O=CC1=C(O)C=CC(F)=C1 CS10369 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.30 O=CC1=C(O)C=CC(I)=C1 CS20136 [1,0,0,0,0,0|3,0,0]=4 127 B10R1.30 O=CC1=C(O)C=CC(O)=C1 MC20094 [1,0,0,0,0,0|2,0,1]=4 128 B10R1.30 O=CC1=CC(Br)=CC=C1O CS20084 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.30 OCC1=CC(Br)=CC=C1O CS20280 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.172 CCC1=CC=CC(C#N)=C1 MC433775 [1,0,0,0,0,0|2,0,1]=4 131 B10R1.172 CCC1=CC=CC(C=O)=C1 CS11688 [1,0,0,0,0,0|1,0,0]=2 132 B10R1.172 CNC1=CC=CC(CO)=C1 MC115827 [1,0,0,0,0,0|1,0,2]=4 133 B10R1.172 CNC1=CC=CC(NC)=C1 MC40949 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.172 COC1=CC(C#N)=NC=C1 MC425709 [1,0,0,0,0,0|2,0,1]=4 135 B10R1.172 COC1=CC(C=O)=NC=C1 MC425477 [1,0,0,0,0,0|1,0,0]=2 136 B10R1.172 COC1=CC(CN)=NC=C1 CS12102 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.172 COC1=CC(CN)=NC=C1 MC443540 [1,0,0,0,0,0|2,0,1]=4 138 B10R1.172 COC1=CC(CO)=NC=C1 MC31070 [1,0,0,0,0,0|1,0,2]=4 139 B10R1.172 COC1=CC(OC)=NC=C1 CS18092 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.172 COC1=CC=CC(C#N)=N1 MC425417 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.172 COC1=CC=CC(C=O)=C1 CS19170 [1,0,0,0,0,0|0,0,0]=1 142 B10R1.172 COC1=CC=CC(C=O)=N1 CS20321 [1,0,0,0,0,0|1,0,0]=2 143 B10R1.172 COC1=CC=CC(CCl)=C1 MC10324 [1,0,0,0,0,0|1,0,1]=3 144 B10R1.172 COC1=CC=CC(CCl)=N1 CS16831 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.172 COC1=CC=CC(CN)=C1 CS19097 [1,0,0,0,0,0|1,0,1]=3 146 B10R1.172 COC1=CC=CC(CO)=C1 CS19269 [1,0,0,0,0,0|0,0,2]=3 147 B10R1.172 COC1=CC=CC(NN)=C1 CS19580 [1,0,0,0,0,0|2,0,0]=3 148 B10R1.172 COC1=CC=CC(OC)=C1 CS19845 [1,0,0,0,0,0|2,0,0]=3 149 B10R1.172 COC1=CC=CC(OC)=N1 MC433065 [1,0,0,0,0,0|3,0,0]=4 150 B10R1.172 COC1=CN=CC(C#N)=C1 MC425494 [1,0,0,0,0,0|2,0,1]=4 151 B10R1.172 COC1=CN=CC(C=O)=C1 CS17827 [1,0,0,0,0,0|1,0,0]=2 152 B10R1.172 COC1=CN=CC(OC)=C1 CS17332 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.172 COC1=NC=CC(C#N)=C1 CS22801 [1,0,0,0,0,0|2,0,1]=4 154 B10R1.172 COC1=NC=CC(C=O)=C1 CS15775 [1,0,0,0,0,0|1,0,0]=2 155 B10R1.172 COC1=NC=CC(C=O)=N1 CS12643 [1,0,0,0,0,0|2,0,0]=3 156 B10R1.172 COC1=NC=CC(CN)=C1 CS16830 [1,0,0,0,0,0|2,0,1]=4 157 B10R1.172 COC1=NC=CC(CO)=C1 CS12823 [1,0,0,0,0,0|1,0,2]=4 158 B10R1.172 CSC1=NC=CC(C=O)=N1 CS19811 [1,0,0,0,0,0|2,1,0]=4 159 B10R1.172 N#CC1=CC(C=O)=CC=C1 CS14027 [1,0,0,0,0,0|2,0,0]=3 160 B10R1.172 N#CC1=NC(C=O)=CC=C1 CS16109 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.172 NCC1=CC(C=O)=CN=C1 MC33471 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.172 NCC1=NC=CC(C=O)=C1 MC33470 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.172 O=CC1=CC(CBr)=CC=C1 MC430420 [1,0,0,0,0,0|2,0,0]=3 164 B10R1.172 O=CC1=CC=CC(C=O)=C1 CS20788 [1,0,0,0,0,0|2,0,0]=3 165 B10R1.172 O=CC1=CC=CC(C=O)=N1 MC10353 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.172 O=CC1=NC=CC(CO)=C1 MC102699 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.176 C=CC1=CC(F)=C(F)C=C1 CS19052 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 MC41096 [1,0,0,0,0,0|2,0,0]=3 169 B10R1.176 CC1=C(Br)C=C(C=O)C=N1 MC431775 [1,0,0,0,0,0|3,0,0]=4 170 B10R1.176 CC1=C(Br)C=CC(C#N)=C1 CS20685 [1,0,0,0,0,0|2,0,1]=4 171 B10R1.176 CC1=C(Br)C=CC(C=O)=C1 CS22664 [1,0,0,0,0,0|1,0,0]=2 172 B10R1.176 CC1=C(Br)C=CC(CO)=C1 MC111151 [1,0,0,0,0,0|1,0,2]=4 173 B10R1.176 CC1=C(C)C=C(C#N)C=C1 MC40653 [1,0,0,0,0,0|2,0,1]=4 174 B10R1.176 CC1=C(C)C=C(C=O)C=C1 MC33166 [1,0,0,0,0,0|1,0,0]=2 175 B10R1.176 CC1=C(C)C=C(CBr)C=C1 CS14390 [1,0,0,0,0,0|2,0,1]=4 176 B10R1.176 CC1=C(C)C=C(CN)C=C1 MC40823 [1,0,0,0,0,0|2,0,1]=4 177 B10R1.176 CC1=C(C)C=C(CO)C=C1 MC40706 [1,0,0,0,0,0|1,0,2]=4 178 B10R1.176 CC1=C(C)C=C(NN)C=C1 CS20502 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.176 CC1=C(Cl)C=C(C=O)C=C1 MC433130 [1,0,0,0,0,0|2,0,0]=3 180 B10R1.176 CC1=C(Cl)C=CC(C#N)=C1 CS22761 [1,0,0,0,0,0|2,0,1]=4 181 B10R1.176 CC1=C(Cl)C=CC(C=O)=C1 MC433419 [1,0,0,0,0,0|1,0,0]=2 182 B10R1.176 CC1=C(F)C=C(C=O)C=C1 MC33065 [1,0,0,0,0,0|2,0,0]=3 183 B10R1.176 CC1=C(F)C=CC(C#N)=C1 CS10743 [1,0,0,0,0,0|2,0,1]=4 184 B10R1.176 CC1=C(F)C=CC(C=O)=C1 MC41117 [1,0,0,0,0,0|1,0,0]=2 185 B10R1.176 CC1=C(F)C=CC(C=O)=N1 CS12797 [1,0,0,0,0,0|2,0,0]=3 186 B10R1.176 CC1=C(F)C=CC(CN)=C1 MC40831 [1,0,0,0,0,0|2,0,1]=4 187 B10R1.176 CC1=C(N)C=CC(C#N)=C1 CS20915 [1,0,0,0,0,0|2,0,1]=4 188 B10R1.176 CC1=C(O)C=C(C#N)C=C1 CS10986 [1,0,0,0,0,0|2,0,1]=4 189 B10R1.176 CC1=C(O)C=C(C=O)C=C1 MC41122 [1,0,0,0,0,0|1,0,0]=2 190 B10R1.176 CC1=C(O)C=CC(C#N)=C1 CS17416 [1,0,0,0,0,0|1,0,1]=3 191 B10R1.176 CC1=C(O)C=CC(C=O)=C1 CS20934 [1,0,0,0,0,0|0,0,0]=1 192 B10R1.176 CC1=C(O)C=CC(CN)=C1 MC445599 [1,0,0,0,0,0|1,0,1]=3 193 B10R1.176 CC1=CC(C=O)=CN=C1O MC442266 [1,0,0,0,0,0|1,0,0]=2 194 B10R1.176 CC1=CN=C(C=O)C=C1Br MC102712 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.176 CC1=NC=C(C=O)C=C1F MC431247 [1,0,0,0,0,0|3,0,0]=4 196 B10R1.176 CC1=NC=C(C=O)C=C1O MC430648 [1,0,0,0,0,0|2,0,0]=3 197 B10R1.176 CCC1=CC(N)=C(O)C=C1 MC442496 [1,0,0,0,0,0|2,0,1]=4 198 B10R1.176 CCC1=CC(O)=C(Cl)C=C1 MC432619 [1,0,0,0,0,0|2,0,1]=4 199 B10R1.176 CCC1=CC(O)=C(N)C=C1 CS16266 [1,0,0,0,0,0|2,0,1]=4 200 B10R1.176 CCC1=CC=C(O)C(O)=C1 MC441226 [1,0,0,0,0,0|1,0,1]=3 201 B10R1.176 COC1=CC(Br)=C(O)C=C1 MC30339 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.176 COC1=CC(Br)=C(O)C=C1 MC41160 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.176 COC1=CC(C)=C(Br)C=C1 MC33099 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.176 COC1=CC(C)=C(N)C=C1 CS13421 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.176 COC1=CC(C)=C(O)C=C1 CS15470 [1,0,0,0,0,0|2,0,0]=3 206 B10R1.176 COC1=CC(Cl)=C(O)C=C1 CS20293 [1,0,0,0,0,0|3,0,0]=4 207 B10R1.176 COC1=CC(F)=C(O)C=C1 MC441061 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.176 COC1=CC(N)=C(O)C=C1 CS21254 [1,0,0,0,0,0|3,0,0]=4 209 B10R1.176 COC1=CC(O)=C(Br)C=C1 CS21376 [1,0,0,0,0,0|3,0,0]=4 210 B10R1.176 COC1=CC(O)=C(Cl)C=C1 MC442395 [1,0,0,0,0,0|3,0,0]=4 211 B10R1.176 COC1=CC(O)=C(F)C=C1 MC430013 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.176 COC1=CC(O)=C(N)C=C1 CS21584 [1,0,0,0,0,0|3,0,0]=4 213 B10R1.176 COC1=CC=C(O)C(O)=C1 MC442392 [1,0,0,0,0,0|2,0,0]=3 214 B10R1.176 Cn1ccc(C=O)cc1=O MC103763 [1,0,0,0,0,0|2,0,1]=4 215 B10R1.176 N#CC1=CC(Br)=C(O)C=C1 CS10311 [1,0,0,0,0,0|2,0,1]=4 216 B10R1.176 N#CC1=CC(Cl)=C(O)C=C1 CS18887 [1,0,0,0,0,0|2,0,1]=4 217 B10R1.176 N#CC1=CC(F)=C(O)C=C1 CS14303 [1,0,0,0,0,0|2,0,1]=4 218 B10R1.176 N#CC1=CC(N)=C(O)C=C1 CS21247 [1,0,0,0,0,0|2,0,1]=4 219 B10R1.176 N#CC1=CC(O)=C(Br)C=C1 MC442777 [1,0,0,0,0,0|2,0,1]=4 220 B10R1.176 N#CC1=CC(O)=C(Cl)C=C1 MC441026 [1,0,0,0,0,0|2,0,1]=4 221 B10R1.176 N#CC1=CC(O)=C(F)C=C1 CS20043 [1,0,0,0,0,0|2,0,1]=4 222 B10R1.176 N#CC1=CC(O)=C(I)C=C1 MC433781 [1,0,0,0,0,0|2,0,1]=4 223 B10R1.176 N#CC1=CC(O)=C(N)C=C1 CS22562 [1,0,0,0,0,0|2,0,1]=4 224 B10R1.176 N#CC1=CC(O)=C(O)C=C1 MC20147 [1,0,0,0,0,0|1,0,1]=3 225 B10R1.176 NC1=NC=C(C=O)C=C1Br MC432272 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.176 NCC1=CC(O)=C(O)C=C1 MC425646 [1,0,0,0,0,0|1,0,1]=3 227 B10R1.176 O=CC1=CC(Br)=C(Br)C=C1 MC430425 [1,0,0,0,0,0|2,0,0]=3 228 B10R1.176 O=CC1=CC(Br)=C(Cl)C=C1 CS12700 [1,0,0,0,0,0|2,0,0]=3 229 B10R1.176 O=CC1=CC(Br)=C(F)C=C1 CS10229 [1,0,0,0,0,0|2,0,0]=3 230 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 MC20184 [1,0,0,0,0,0|1,0,0]=2 231 B10R1.176 O=CC1=CC(Cl)=C(Br)C=C1 CS12259 [1,0,0,0,0,0|2,0,0]=3 232 B10R1.176 O=CC1=CC(Cl)=C(Cl)C=C1 CS19889 [1,0,0,0,0,0|2,0,0]=3 233 B10R1.176 O=CC1=CC(Cl)=C(F)C=C1 MC20026 [1,0,0,0,0,0|2,0,0]=3 234 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 CS10232 [1,0,0,0,0,0|2,0,0]=3 235 B10R1.176 O=CC1=CC(F)=C(Cl)C=C1 CS10264 [1,0,0,0,0,0|2,0,0]=3 236 B10R1.176 O=CC1=CC(F)=C(F)C=C1 CS14168 [1,0,0,0,0,0|2,0,0]=3 237 B10R1.176 O=CC1=CC(F)=C(I)C=C1 CS10296 [1,0,0,0,0,0|2,0,0]=3 238 B10R1.176 O=CC1=CC(F)=C(O)C=C1 CS10367 [1,0,0,0,0,0|1,0,0]=2 239 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 MC431061 [1,0,0,0,0,0|2,0,0]=3 240 B10R1.176 O=CC1=CC(I)=C(Cl)C=C1 MC441220 [1,0,0,0,0,0|2,0,0]=3 241 B10R1.176 O=CC1=CC(I)=C(F)C=C1 MC20286 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.176 O=CC1=CC(I)=C(I)C=C1 MC431060 [1,0,0,0,0,0|2,0,0]=3 243 B10R1.176 O=CC1=CC(I)=C(O)C=C1 MC429971 [1,0,0,0,0,0|1,0,0]=2 244 B10R1.176 O=CC1=CC(O)=C(Br)C=C1 MC41092 [1,0,0,0,0,0|1,0,0]=2 245 B10R1.176 O=CC1=CC(O)=C(Cl)C=C1 CS15259 [1,0,0,0,0,0|1,0,0]=2 246 B10R1.176 O=CC1=CC(O)=C(F)C=C1 MC41115 [1,0,0,0,0,0|1,0,0]=2 247 B10R1.176 O=CC1=CC(O)=C(O)C=C1 CS18720 [1,0,0,0,0,0|0,0,0]=1 248 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 CS18127 [1,0,0,0,0,0|3,0,0]=4 249 B10R1.176 O=CC1=CN=C(Cl)C(Cl)=C1 MC33386 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.176 O=CC1=CNC(=O)C(Br)=C1 MC430621 [1,0,0,0,0,0|2,0,1]=4 251 B10R1.176 O=CC1=CNC(=O)C(Cl)=C1 MC430658 [1,0,0,0,0,0|2,0,1]=4 252 B10R1.176 OCC1=CC(Br)=C(O)C=C1 CS21356 [1,0,0,0,0,0|1,0,2]=4 253 B10R1.176 OCC1=CC(O)=C(Br)C=C1 CS16027 [1,0,0,0,0,0|1,0,2]=4 254 B10R1.176 OCC1=CC(O)=C(I)C=C1 MC33283 [1,0,0,0,0,0|1,0,2]=4 255 B12R1.56 C#CC1=C(C)C=CC(C(=O)O)=C1 MC442815 [0,1,0,0,0,0|2,0,1]=4 256 B12R1.56 CC(=O)C1=CC(C#N)=C(N)C=C1 MC433721 [0,1,0,0,0,0|3,0,0]=4 257 B12R1.56 CCC1=C(Br)C=CC(C(=O)O)=C1 MC428381 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.56 CCC1=C(N)C=CC(C(=O)O)=C1 MC30294 [0,1,0,0,0,0|2,0,0]=3 259 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=C1 CS22663 [0,1,0,0,0,0|1,0,0]=2 260 B12R1.56 COC1=C(Br)C=CC(C(=O)O)=N1 CS16863 [0,1,0,0,0,0|2,0,0]=3 261 B12R1.56 COC1=C(Br)C=CC([N+](=O)[O-])=C1 MC30087 [0,1,0,0,0,0|2,0,0]=3 262 B12R1.56 COC1=C(C)C=CC(B(O)O)=C1 MC21120 [0,1,0,0,0,0|2,0,1]=4 263 B12R1.56 COC1=C(C)C=CC(C(=O)O)=C1 CS21939 [0,1,0,0,0,0|1,0,0]=2 264 B12R1.56 COC1=C(C)C=CC([N+](=O)[O-])=C1 CS10878 [0,1,0,0,0,0|2,0,0]=3 265 B12R1.56 COC1=C(Cl)C=CC(B(O)O)=C1 CS12284 [0,1,0,0,0,0|2,0,1]=4 266 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=C1 CS20832 [0,1,0,0,0,0|1,0,0]=2 267 B12R1.56 COC1=C(Cl)C=CC(C(=O)O)=N1 CS13301 [0,1,0,0,0,0|2,0,0]=3 268 B12R1.56 COC1=C(Cl)C=CC([N+](=O)[O-])=C1 CS20212 [0,1,0,0,0,0|2,0,0]=3 269 B12R1.56 COC1=C(F)C=CC(B(O)O)=C1 CS12285 [0,1,0,0,0,0|2,0,1]=4 270 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 CS16067 [0,1,0,0,0,0|1,0,0]=2 271 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 MC30272 [0,1,0,0,0,0|1,0,0]=2 272 B12R1.56 COC1=C(F)C=CC([N+](=O)[O-])=C1 CS21550 [0,1,0,0,0,0|2,0,0]=3 273 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 MC20116 [0,1,0,0,0,0|2,0,0]=3 274 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 CS21016 [0,1,0,0,0,0|1,0,0]=2 275 B12R1.56 COC1=C(N)C=CC(C(=O)O)=N1 MC432347 [0,1,0,0,0,0|2,0,0]=3 276 B12R1.56 COC1=C(N)C=CC([N+](=O)[O-])=C1 CS16396 [0,1,0,0,0,0|2,0,0]=3 277 B12R1.56 COC1=C(O)C=CC(B(O)O)=C1 MC442694 [0,1,0,0,0,0|1,0,1]=3 278 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 CS20951 [0,1,0,0,0,0|0,0,0]=1 279 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 CS14549 [0,1,0,0,0,0|0,0,0]=1 280 B12R1.56 COC1=C(O)C=CC([N+](=O)[O-])=C1 CS20340 [0,1,0,0,0,0|1,0,0]=2 281 B12R1.56 COC1=CC([N+](=O)[O-])=CN=C1Cl MC20983 [0,1,0,0,0,0|3,0,0]=4 282 B12R1.56 COC1=CC([N+](=O)[O-])=CN=C1O MC431861 [0,1,0,0,0,0|2,0,0]=3 283 B12R1.56 N#CC1=C(Br)C=CC(C(=O)O)=C1 CS16346 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.56 N#CC1=C(Cl)C=CC(C(=O)O)=C1 MC31025 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.56 N#CC1=C(O)C=CC(C(=O)O)=C1 MC441018 [0,1,0,0,0,0|2,0,0]=3 286 B12R1.56 N#CC1=C(O)C=CC([N+](=O)[O-])=C1 MC442231 [0,1,0,0,0,0|3,0,0]=4 287 B12R1.56 O=CC1=C(F)C=CC(C(=O)O)=C1 CS22830 [0,1,0,0,0,0|3,0,0]=4 288 B12R1.78 C#CC1=CC(OC)=C(OC)C=C1 MC106594 [0,1,0,0,0,0|1,0,1]=3 289 B12R1.78 COC1=C(C=O)C=CC(C#N)=C1 CS21535 [0,1,0,0,0,0|1,0,2]=4 290 B12R1.78 COC1=C(CBr)C=CC(C#N)=C1 MC33029 [0,1,0,0,0,0|2,0,1]=4 291 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 MC40649 [0,1,0,0,0,0|1,0,1]=3 292 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 MC10449 [0,1,0,0,0,0|0,0,0]=1 293 B12R1.78 COC1=C(OC)C=C(CBr)C=C1 CS21945 [0,1,0,0,0,0|1,0,1]=3 294 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 MC10289 [0,1,0,0,0,0|1,0,1]=3 295 B12R1.78 COC1=C(OC)C=C(CO)C=C1 CS19420 [0,1,0,0,0,0|0,0,2]=3 296 B12R1.78 COC1=C(OC)C=C(NN)C=C1 MC40996 [0,1,0,0,0,0|2,0,0]=3 297 B12R1.78 COC1=C(OC)N=C(C=O)C=C1 MC431779 [0,1,0,0,0,0|1,0,0]=2 298 B12R1.78 COC1=C(OC)N=C(CN)C=C1 MC33279 [0,1,0,0,0,0|2,0,1]=4 299 B12R1.78 COC1=CC(OC)=C(C#N)C=C1 MC433125 [0,1,0,0,0,0|3,0,0]=4 300 B12R1.78 COC1=CC(OC)=C(C=O)C=C1 CS15286 [0,1,0,0,0,0|2,0,1]=4 301 B12R1.78 COC1=CC(OC)=C(CCl)C=C1 MC10526 [0,1,0,0,0,0|3,0,0]=4 302 B12R1.78 COC1=CC(OC)=C(CN)C=C1 CS15120 [0,1,0,0,0,0|3,0,0]=4 303 B12R1.78 COC1=CC(OC)=C(CO)C=C1 CS21200 [0,1,0,0,0,0|2,0,0]=3 304 B12R1.78 COC1=CC(OC)=C(OC)C=C1 CS18710 [0,1,0,0,0,0|2,0,0]=3 305 B12R1.270 C=CC1=CC(OCC)=C(Cl)C=C1 MC112465 [0,1,0,0,0,0|2,0,0]=3 306 B12R1.270 CCOC1=C(C)C=CC(C=O)=N1 MC430647 [0,1,0,0,0,0|2,0,0]=3 307 B12R1.270 CCOC1=C(Cl)C=CC(C=O)=C1 MC112464 [0,1,0,0,0,0|1,0,0]=2 308 B12R1.270 CCOC1=C(O)C=CC(C=O)=C1 MC41114 [0,1,0,0,0,0|0,0,0]=1 309 B12R1.286 COC1=C(C)C=CC(CC#N)=C1 CS22339 [0,1,0,0,0,0|2,0,1]=4 310 B12R1.286 COC1=C(F)C=CC(CC#N)=C1 MC40775 [0,1,0,0,0,0|2,0,1]=4 311 B12R1.286 COC1=C(O)C=CC(CCN)=C1 MC437967 [0,1,0,0,0,0|1,0,1]=3 312 B12R1.286 COC1=C(O)C=CC(CCN)=C1 MC443853 [0,1,0,0,0,0|1,0,1]=3 313 B12R1.300 COC1=C(O)C(C)=CC(C#N)=C1 MC105253 [0,1,0,0,0,0|1,0,1]=3 314 B12R1.300 COC1=CC(C=O)=CC(F)=C1O CS20848 [0,1,0,0,0,0|0,0,0]=1 315 B12R1.300 COC1=CC(F)=C(Br)C(OC)=C1 MC20136 [0,1,0,0,0,0|3,0,0]=4 316 B12R1.300 COC1=CC(F)=C(F)C(OC)=C1 MC110052 [0,1,0,0,0,0|3,0,0]=4 317 B12R1.300 COC1=CC(N)=C(F)C(OC)=C1 MC433318 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.449 COC1=CC(C=O)=C(F)C=C1Cl MC106574 [0,1,0,0,0,0|1,0,0]=2 319 B12R1.449 COC1=CC(OC)=C(Br)C=C1Br MC33090 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.449 N#CC1=C(F)C=C(F)C(C=O)=C1 CS18068 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.453 CC(=O)C1=C(O)C=CC(C#N)=C1 CS21208 [0,1,0,0,0,0|2,0,1]=4 322 B12R1.453 COC1=CC(C(C)=O)=C(O)C=C1 MC446638 [0,1,0,0,0,0|3,0,0]=4 323 B12R1.453 O=CC1=CC(B(O)O)=C(Cl)C=C1 MC441513 [0,1,0,0,0,0|3,0,0]=4 324 B12R1.453 O=CC1=CC(C(=O)O)=C(F)C=C1 MC40281 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.453 O=CC1=CC([N+](=O)[O-])=C(Br)C=C1 CS19872 [0,1,0,0,0,0|3,0,0]=4 326 B12R1.453 O=CC1=CC([N+](=O)[O-])=C(Cl)C=C1 MC41107 [0,1,0,0,0,0|3,0,0]=4 327 B12R1.453 O=CC1=CC([N+](=O)[O-])=C(F)C=C1 CS14331 [0,1,0,0,0,0|3,0,0]=4 328 B12R1.453 O=CC1=CC([N+](=O)[O-])=C(O)C=C1 CS20152 [0,1,0,0,0,0|2,0,0]=3 329 B12R1.654 COC1=C(F)C=CC(C#N)=C1F MC433769 [0,1,0,0,0,0|2,0,1]=4 330 B12R2.44 O=CC1=CC2=C(C=C1)N=CO2 CS15841 [0,0,0,1,0,0|1,0,1]=3 331 B12R2.44 O=CC1=CC2=C(C=C1)N=CS2 MC427239 [0,0,0,1,0,0|1,1,1]=4 332 B12R2.44 O=CC1=CC2=C(C=C1)OC=C2 CS21474 [0,0,0,1,0,0|1,0,1]=3 333 B12R2.44 O=CC1=CC2=C(C=C1)OC=N2 CS16843 [0,0,0,1,0,0|1,0,1]=3 334 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 CS21622 [0,0,0,1,0,0|1,0,0]=2 335 B12R2.44 O=CC1=CC2=C(C=C1)SC=N2 MC115936 [0,0,0,1,0,0|1,1,1]=4 336 B12R2.44 O=CC1=CC2=C(C=C1)SN=C2 MC105912 [0,0,0,1,0,0|2,1,0]=4 337 B12R2.44 O=CC1=CC2=C(C=CO2)C=C1 MC441152 [0,0,0,1,0,0|1,0,1]=3 338 B12R2.44 O=CC1=CC2=C(C=CS2)C=C1 MC441269 [0,0,0,1,0,0|1,1,1]=4 339 B12R2.44 O=CC1=CC=C2C=CNC2=C1 CS21527 [0,0,0,1,0,0|2,0,1]=4 340 B12R2.44 O=CC1=CC=C2C=NNC2=C1 MC444140 [0,0,0,1,0,0|3,0,0]=4 341 B12R2.44 O=CC1=CC=C2NC=CC2=C1 CS21526 [0,0,0,1,0,0|2,0,1]=4 342 B12R2.44 O=CC1=CC=C2NN=CC2=C1 MC444139 [0,0,0,1,0,0|3,0,0]=4 343 B12R2.44 O=CC1=NC=C2OC=CC2=C1 CS14660 [0,0,0,1,0,0|2,0,1]=4 344 B12R2.44 OCC1=CC2=C(C=C1)CCO2 MC442824 [0,0,0,1,0,0|1,0,2]=4 345 B12R2.44 OCC1=CC2=C(C=C1)OCO2 MC40722 [0,0,0,1,0,0|0,0,2]=3 346 B9R1.2 C#CC1=CC=CC(O)=C1 CS22325 [2,0,0,0,0,0|1,0,1]=4 347 B9R1.2 C=NC1=CC(C)=CC=C1 MC111025 [2,0,0,0,0,0|2,0,0]=4 348 B9R1.2 CC1=CC(C=O)=CN=C1 MC425681 [2,0,0,0,0,0|1,0,0]=3 349 B9R1.2 CC1=CC(C=O)=NC=C1 CS19123 [2,0,0,0,0,0|1,0,0]=3 350 B9R1.2 CC1=CC(CN)=CC=C1 CS19644 [2,0,0,0,0,0|1,0,1]=4 351 B9R1.2 CC1=CC(NN)=CC=C1 CS19574 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.2 CC1=CC=CC(C#N)=C1 CS19778 [2,0,0,0,0,0|1,0,1]=4 353 B9R1.2 CC1=CC=CC(C=O)=C1 MC41127 [2,0,0,0,0,0|0,0,0]=2 354 B9R1.2 CC1=CC=CC(C=O)=N1 MC41626 [2,0,0,0,0,0|1,0,0]=3 355 B9R1.2 CC1=CC=CC(CCl)=C1 MC40602 [2,0,0,0,0,0|1,0,1]=4 356 B9R1.2 CC1=CC=CC(CF)=C1 MC433869 [2,0,0,0,0,0|1,0,1]=4 357 B9R1.2 CC1=NC(C=O)=NC=C1 MC104692 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.2 CC1=NC=CC(C=O)=C1 CS15441 [2,0,0,0,0,0|1,0,0]=3 359 B9R1.2 CC1=NC=CC(C=O)=N1 CS19715 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.2 CCC1=CC=CC(Br)=C1 MC30292 [2,0,0,0,0,0|2,0,0]=4 361 B9R1.2 CCC1=CC=CC(C)=C1 MC425590 [2,0,0,0,0,0|1,0,1]=4 362 B9R1.2 CCC1=CC=CC(N)=C1 MC433319 [2,0,0,0,0,0|2,0,0]=4 363 B9R1.2 CNC1=CC(Br)=CC=C1 CS22185 [2,0,0,0,0,0|2,0,0]=4 364 B9R1.2 CNC1=CC(Br)=CC=C1 MC40876 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.2 CNC1=CC(Cl)=CC=C1 MC20486 [2,0,0,0,0,0|2,0,0]=4 366 B9R1.2 CNC1=CC(N)=CC=C1 CS16640 [2,0,0,0,0,0|2,0,0]=4 367 B9R1.2 CNC1=CC=CC(O)=C1 MC442233 [2,0,0,0,0,0|1,0,1]=4 368 B9R1.2 COC1=CC(=O)NC=C1 CS12334 [2,0,0,0,0,0|1,0,0]=3 369 B9R1.2 COC1=CC(Br)=NC=C1 CS16230 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.2 COC1=CC(Cl)=NC=C1 CS19311 [2,0,0,0,0,0|2,0,0]=4 371 B9R1.2 COC1=CC(F)=NC=C1 CS14826 [2,0,0,0,0,0|2,0,0]=4 372 B9R1.2 COC1=CC(N)=NC=C1 CS19522 [2,0,0,0,0,0|2,0,0]=4 373 B9R1.2 COC1=CC=CC(Br)=N1 CS14301 [2,0,0,0,0,0|2,0,0]=4 374 B9R1.2 COC1=CC=CC(Cl)=C1 CS19894 [2,0,0,0,0,0|1,0,0]=3 375 B9R1.2 COC1=CC=CC(Cl)=N1 CS13826 [2,0,0,0,0,0|2,0,0]=4 376 B9R1.2 COC1=CC=CC(F)=C1 CS19929 [2,0,0,0,0,0|1,0,0]=3 377 B9R1.2 COC1=CC=CC(F)=N1 CS13652 [2,0,0,0,0,0|2,0,0]=4 378 B9R1.2 COC1=CC=CC(I)=N1 CS18075 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.2 COC1=CC=CC(N)=C1 CS19943 [2,0,0,0,0,0|1,0,0]=3 380 B9R1.2 COC1=CC=CC(N)=N1 CS13845 [2,0,0,0,0,0|2,0,0]=4 381 B9R1.2 COC1=CC=CC(O)=C1 CS18747 [2,0,0,0,0,0|0,0,1]=3 382 B9R1.2 COC1=CC=CC(O)=N1 MC428307 [2,0,0,0,0,0|1,0,1]=4 383 B9R1.2 COC1=CC=C[N+]([O-])=C1 CS22349 [2,0,0,0,0,0|1,0,1]=4 384 B9R1.2 COC1=CN=CC(Br)=C1 MC427397 [2,0,0,0,0,0|2,0,0]=4 385 B9R1.2 COC1=CN=CC(N)=C1 CS19973 [2,0,0,0,0,0|2,0,0]=4 386 B9R1.2 COC1=CN=CC(O)=C1 CS17819 [2,0,0,0,0,0|1,0,1]=4 387 B9R1.2 COC1=NC(C)=CC=C1 CS15396 [2,0,0,0,0,0|1,0,1]=4 388 B9R1.2 COC1=NC=CC(Br)=C1 CS22650 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.2 COC1=NC=CC(C)=C1 CS21637 [2,0,0,0,0,0|1,0,1]=4 390 B9R1.2 COC1=NC=CC(Cl)=C1 CS19313 [2,0,0,0,0,0|2,0,0]=4 391 B9R1.2 COC1=NC=CC(F)=C1 CS11908 [2,0,0,0,0,0|2,0,0]=4 392 B9R1.2 COC1=NC=CC(I)=C1 CS19594 [2,0,0,0,0,0|2,0,0]=4 393 B9R1.2 COC1=NC=CC(N)=C1 CS19525 [2,0,0,0,0,0|2,0,0]=4 394 B9R1.2 COC1=NC=CC(O)=C1 MC115931 [2,0,0,0,0,0|1,0,1]=4 395 B9R1.2 CSC1=CC(N)=CC=C1 MC20570 [2,0,0,0,0,0|1,1,0]=4 396 B9R1.2 N#CC1=CC(O)=CC=C1 CS19377 [2,0,0,0,0,0|1,0,1]=4 397 B9R1.2 NC1=CC=CC(C=O)=N1 MC110929 [2,0,0,0,0,0|2,0,0]=4 398 B9R1.2 NC1=NC=CC(C=O)=C1 CS18505 [2,0,0,0,0,0|2,0,0]=4 399 B9R1.2 NC1=NC=CC(C=O)=C1 MC103369 [2,0,0,0,0,0|2,0,0]=4 400 B9R1.2 O=CC1=CC(Br)=CC=C1 CS18958 [2,0,0,0,0,0|1,0,0]=3 401 B9R1.2 O=CC1=CC(Br)=NC=C1 CS18783 [2,0,0,0,0,0|2,0,0]=4 402 B9R1.2 O=CC1=CC(Cl)=CC=C1 MC20579 [2,0,0,0,0,0|1,0,0]=3 403 B9R1.2 O=CC1=CC(F)=CC=C1 CS22298 [2,0,0,0,0,0|1,0,0]=3 404 B9R1.2 O=CC1=CC(F)=NC=C1 MC431324 [2,0,0,0,0,0|2,0,0]=4 405 B9R1.2 O=CC1=CC(I)=CC=C1 CS20132 [2,0,0,0,0,0|1,0,0]=3 406 B9R1.2 O=CC1=CC(O)=CC=C1 MC20422 [2,0,0,0,0,0|0,0,0]=2 407 B9R1.2 O=CC1=CC=C[N+]([O-])=C1 CS17137 [2,0,0,0,0,0|1,0,1]=4 408 B9R1.2 O=CC1=CN=CC(Br)=C1 MC20791 [2,0,0,0,0,0|2,0,0]=4 409 B9R1.2 O=CC1=CN=CC(F)=C1 CS19040 [2,0,0,0,0,0|2,0,0]=4 410 B9R1.2 O=CC1=CN=CC(O)=C1 CS15599 [2,0,0,0,0,0|1,0,0]=3 411 B9R1.2 O=CC1=NC(Br)=CC=C1 CS22094 [2,0,0,0,0,0|2,0,0]=4 412 B9R1.2 O=CC1=NC(Cl)=CC=C1 CS19944 [2,0,0,0,0,0|2,0,0]=4 413 B9R1.2 O=CC1=NC(F)=CC=C1 CS13928 [2,0,0,0,0,0|2,0,0]=4 414 B9R1.2 O=CC1=NC=CC(Br)=C1 CS12092 [2,0,0,0,0,0|2,0,0]=4 415 B9R1.2 O=CC1=NC=CC(Cl)=C1 CS22794 [2,0,0,0,0,0|2,0,0]=4 416 B9R1.2 OC1=CC(CBr)=CC=C1 MC425573 [2,0,0,0,0,0|1,0,1]=4 417 B9R1.2 OCC1=CC(O)=CC=C1 MC40720 [2,0,0,0,0,0|0,0,2]=4 418 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [2,0,0,0,0,0|1,0,1]=4 419 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [2,0,0,0,0,0|2,0,0]=4 420 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [2,0,0,0,0,0|2,0,0]=4 421 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [2,0,0,0,0,0|2,0,0]=4 422 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [2,0,0,0,0,0|2,0,0]=4 423 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [2,0,0,0,0,0|2,0,0]=4 424 B9R1.15 CNC1=CC=CC=C1N CS22302 [2,0,0,0,0,0|2,0,0]=4 425 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [2,0,0,0,0,0|1,0,0]=3 426 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [2,0,0,0,0,0|2,0,0]=4 427 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [2,0,0,0,0,0|2,0,0]=4 428 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [2,0,0,0,0,0|2,0,0]=4 429 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [2,0,0,0,0,0|2,0,0]=4 430 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [2,0,0,0,0,0|2,0,0]=4 431 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [2,0,0,0,0,0|1,0,0]=3 432 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [2,0,0,0,0,0|2,0,0]=4 433 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [2,0,0,0,0,0|1,0,0]=3 434 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [2,0,0,0,0,0|2,0,0]=4 435 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [2,0,0,0,0,0|2,0,0]=4 436 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [2,0,0,0,0,0|1,0,0]=3 437 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [2,0,0,0,0,0|2,0,0]=4 438 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [2,0,0,0,0,0|2,0,0]=4 439 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [2,0,0,0,0,0|0,0,0]=2 440 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [2,0,0,0,0,0|1,0,0]=3 441 B9R1.15 COC1=CC=CN=C1Br CS19255 [2,0,0,0,0,0|2,0,0]=4 442 B9R1.15 COC1=CC=CN=C1Cl CS19305 [2,0,0,0,0,0|2,0,0]=4 443 B9R1.15 COC1=CC=CN=C1F CS13044 [2,0,0,0,0,0|2,0,0]=4 444 B9R1.15 COC1=CC=CN=C1N CS17216 [2,0,0,0,0,0|2,0,0]=4 445 B9R1.15 COC1=CN=CN=C1O MC432213 [2,0,0,0,0,0|2,0,0]=4 446 B9R1.15 COC1=NC=CC=C1Br CS19258 [2,0,0,0,0,0|2,0,0]=4 447 B9R1.15 COC1=NC=CC=C1C MC33438 [2,0,0,0,0,0|2,0,0]=4 448 B9R1.15 COC1=NC=CC=C1Cl CS18705 [2,0,0,0,0,0|2,0,0]=4 449 B9R1.15 COC1=NC=CC=C1F CS19564 [2,0,0,0,0,0|2,0,0]=4 450 B9R1.15 COC1=NC=CC=C1I CS13512 [2,0,0,0,0,0|2,0,0]=4 451 B9R1.15 COC1=NC=CC=C1N CS19526 [2,0,0,0,0,0|2,0,0]=4 452 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [2,0,0,0,0,0|1,1,0]=4 453 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [2,0,0,0,0,0|2,0,0]=4 454 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [2,0,0,0,0,0|2,0,0]=4 455 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [2,0,0,0,0,0|2,0,0]=4 456 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [2,0,0,0,0,0|2,0,0]=4 457 B9R1.69 CC1=C(Br)C=CC(Br)=C1 CS21137 [2,0,0,0,0,0|2,0,0]=4 458 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 CS20166 [2,0,0,0,0,0|2,0,0]=4 459 B9R1.69 CC1=C(Br)C=CC(F)=C1 CS10390 [2,0,0,0,0,0|2,0,0]=4 460 B9R1.69 CC1=C(Br)C=CC(I)=C1 MC33074 [2,0,0,0,0,0|2,0,0]=4 461 B9R1.69 CC1=C(Br)C=CC(N)=C1 CS15448 [2,0,0,0,0,0|2,0,0]=4 462 B9R1.69 CC1=C(Br)C=CC(O)=C1 CS20279 [2,0,0,0,0,0|1,0,1]=4 463 B9R1.69 CC1=C(C)C=C(Cl)C=C1 MC433525 [2,0,0,0,0,0|2,0,0]=4 464 B9R1.69 CC1=C(C)C=C(N)C=C1 CS20010 [2,0,0,0,0,0|2,0,0]=4 465 B9R1.69 CC1=C(C)C=C(O)C=C1 MC41191 [2,0,0,0,0,0|1,0,1]=4 466 B9R1.69 CC1=C(C)NC(=O)C=C1 MC111283 [2,0,0,0,0,0|2,0,0]=4 467 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 CS19135 [2,0,0,0,0,0|2,0,0]=4 468 B9R1.69 CC1=C(Cl)C=CC(Cl)=C1 MC41516 [2,0,0,0,0,0|2,0,0]=4 469 B9R1.69 CC1=C(Cl)C=CC(I)=C1 CS20194 [2,0,0,0,0,0|2,0,0]=4 470 B9R1.69 CC1=C(Cl)C=CC(N)=C1 MC40892 [2,0,0,0,0,0|2,0,0]=4 471 B9R1.69 CC1=C(Cl)C=CC(O)=C1 MC41173 [2,0,0,0,0,0|1,0,1]=4 472 B9R1.69 CC1=C(F)C=CC(Br)=C1 MC33150 [2,0,0,0,0,0|2,0,0]=4 473 B9R1.69 CC1=C(F)C=CC(Cl)=C1 CS14434 [2,0,0,0,0,0|2,0,0]=4 474 B9R1.69 CC1=C(F)C=CC(F)=C1 CS19928 [2,0,0,0,0,0|2,0,0]=4 475 B9R1.69 CC1=C(F)C=CC(I)=C1 CS10424 [2,0,0,0,0,0|2,0,0]=4 476 B9R1.69 CC1=C(F)C=CC(N)=C1 CS10514 [2,0,0,0,0,0|2,0,0]=4 477 B9R1.69 CC1=C(F)C=CC(O)=C1 CS10483 [2,0,0,0,0,0|1,0,1]=4 478 B9R1.69 CC1=C(F)C=CC(S)=C1 MC41409 [2,0,0,0,0,0|1,1,0]=4 479 B9R1.69 CC1=C(I)C=CC(=O)N1 CS15056 [2,0,0,0,0,0|2,0,0]=4 480 B9R1.69 CC1=C(I)C=CC(Br)=C1 CS10398 [2,0,0,0,0,0|2,0,0]=4 481 B9R1.69 CC1=C(I)C=CC(F)=C1 MC433024 [2,0,0,0,0,0|2,0,0]=4 482 B9R1.69 CC1=C(I)C=CC(O)=C1 CS22901 [2,0,0,0,0,0|1,0,1]=4 483 B9R1.69 CC1=C(N)C=CC(=O)N1 MC425072 [2,0,0,0,0,0|2,0,0]=4 484 B9R1.69 CC1=C(N)C=CC(Br)=C1 CS15106 [2,0,0,0,0,0|2,0,0]=4 485 B9R1.69 CC1=C(N)C=CC(Cl)=C1 CS16371 [2,0,0,0,0,0|2,0,0]=4 486 B9R1.69 CC1=C(N)C=CC(F)=C1 CS10513 [2,0,0,0,0,0|2,0,0]=4 487 B9R1.69 CC1=C(N)C=CC(I)=C1 CS20371 [2,0,0,0,0,0|2,0,0]=4 488 B9R1.69 CC1=C(N)C=CC(N)=C1 CS18566 [2,0,0,0,0,0|2,0,0]=4 489 B9R1.69 CC1=C(N)C=CC(O)=C1 CS14087 [2,0,0,0,0,0|1,0,1]=4 490 B9R1.69 CC1=C(O)C=C(Br)C=C1 CS10275 [2,0,0,0,0,0|2,0,0]=4 491 B9R1.69 CC1=C(O)C=C(F)C=C1 CS10484 [2,0,0,0,0,0|2,0,0]=4 492 B9R1.69 CC1=C(O)C=C(N)C=C1 CS10536 [2,0,0,0,0,0|2,0,0]=4 493 B9R1.69 CC1=C(O)C=C(O)C=C1 CS20391 [2,0,0,0,0,0|1,0,1]=4 494 B9R1.69 CC1=C(O)C=CC(Br)=C1 MC20395 [2,0,0,0,0,0|1,0,0]=3 495 B9R1.69 CC1=C(O)C=CC(Cl)=C1 CS20290 [2,0,0,0,0,0|1,0,0]=3 496 B9R1.69 CC1=C(O)C=CC(F)=C1 CS10482 [2,0,0,0,0,0|1,0,0]=3 497 B9R1.69 CC1=C(O)C=CC(I)=C1 MC30013 [2,0,0,0,0,0|1,0,0]=3 498 B9R1.69 CC1=C(O)C=CC(N)=C1 MC30012 [2,0,0,0,0,0|1,0,0]=3 499 B9R1.69 CC1=CC(=O)C=CC1=O MC41219 [2,0,0,0,0,0|0,0,1]=3 500 B9R1.69 CC1=CC(Br)=CN=C1O CS18541 [2,0,0,0,0,0|2,0,0]=4 501 B9R1.69 CC1=CC(C)=C(Br)C=C1 MC41530 [2,0,0,0,0,0|1,0,1]=4 502 B9R1.69 CC1=CC(C)=C(C)C=C1 MC41547 [2,0,0,0,0,0|1,0,1]=4 503 B9R1.69 CC1=CC(C)=C(F)C=C1 MC33141 [2,0,0,0,0,0|1,0,1]=4 504 B9R1.69 CC1=CC(C)=C(N)C=C1 CS20011 [2,0,0,0,0,0|1,0,1]=4 505 B9R1.69 CC1=CC(C)=C(O)C=C1 MC30165 [2,0,0,0,0,0|0,0,1]=3 506 B9R1.69 CC1=CC(C)=C(S)C=C1 MC443880 [2,0,0,0,0,0|0,1,1]=4 507 B9R1.69 CC1=CC(Cl)=C(O)C=C1 CS20292 [2,0,0,0,0,0|1,0,1]=4 508 B9R1.69 CC1=CC(Cl)=CN=C1O MC20516 [2,0,0,0,0,0|2,0,0]=4 509 B9R1.69 CC1=CC(I)=C(O)C=C1 MC41201 [2,0,0,0,0,0|1,0,1]=4 510 B9R1.69 CC1=CC(O)=C(Br)C=C1 CS16357 [2,0,0,0,0,0|1,0,1]=4 511 B9R1.69 CC1=CC(O)=C(C)C=C1 CS19431 [2,0,0,0,0,0|1,0,1]=4 512 B9R1.69 CC1=CC(O)=C(F)C=C1 MC41196 [2,0,0,0,0,0|1,0,1]=4 513 B9R1.69 CC1=CC(O)=C(N)C=C1 CS14086 [2,0,0,0,0,0|1,0,1]=4 514 B9R1.69 CC1=CC=C(Br)C=C1C MC41529 [2,0,0,0,0,0|2,0,0]=4 515 B9R1.69 CC1=CC=C(F)C=C1C MC41541 [2,0,0,0,0,0|2,0,0]=4 516 B9R1.69 CC1=CC=C(O)C(C)=N1 MC41612 [2,0,0,0,0,0|1,0,1]=4 517 B9R1.69 CC1=CC=C(O)C(O)=C1 CS14435 [2,0,0,0,0,0|0,0,1]=3 518 B9R1.69 CC1=NC(Br)=CC=C1O CS15297 [2,0,0,0,0,0|2,0,0]=4 519 B9R1.69 CC1=NC(I)=CC=C1O MC431760 [2,0,0,0,0,0|2,0,0]=4 520 B9R1.69 Cc1ccc(Cl)c(C)c1 MC433524 [2,0,0,0,0,0|1,0,1]=4 521 B9R1.69 NC1=C(O)C=C(Br)C=C1 CS21272 [2,0,0,0,0,0|2,0,0]=4 522 B9R1.69 NC1=C(O)C=C(Cl)C=C1 CS19300 [2,0,0,0,0,0|2,0,0]=4 523 B9R1.69 NC1=C(O)C=C(F)C=C1 CS23016 [2,0,0,0,0,0|2,0,0]=4 524 B9R1.69 NC1=C(O)C=C(O)C=C1 CS22592 [2,0,0,0,0,0|1,0,1]=4 525 B9R1.69 NC1=C(O)C=CC(Br)=C1 CS14311 [2,0,0,0,0,0|2,0,0]=4 526 B9R1.69 NC1=C(O)C=CC(Cl)=C1 CS16374 [2,0,0,0,0,0|2,0,0]=4 527 B9R1.69 NC1=C(O)C=CC(F)=C1 MC20123 [2,0,0,0,0,0|2,0,0]=4 528 B9R1.69 NC1=CC(Br)=C(O)C=C1 MC30074 [2,0,0,0,0,0|2,0,0]=4 529 B9R1.69 NC1=CC(Cl)=C(O)C=C1 CS19309 [2,0,0,0,0,0|2,0,0]=4 530 B9R1.69 NC1=CC(F)=C(O)C=C1 MC30224 [2,0,0,0,0,0|2,0,0]=4 531 B9R1.69 NC1=CC(N)=C(O)C=C1 CS16325 [2,0,0,0,0,0|2,0,0]=4 532 B9R1.69 NC1=CC(O)=C(Cl)C=C1 MC433340 [2,0,0,0,0,0|2,0,0]=4 533 B9R1.69 NC1=CC(O)=C(F)C=C1 CS13999 [2,0,0,0,0,0|2,0,0]=4 534 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 CS15632 [2,0,0,0,0,0|2,0,0]=4 535 B9R1.69 OC1=C(Br)C=C(F)C=C1 MC10138 [2,0,0,0,0,0|2,0,0]=4 536 B9R1.69 OC1=C(Br)C=C(I)C=C1 MC441118 [2,0,0,0,0,0|2,0,0]=4 537 B9R1.69 OC1=C(Br)C=CC(Br)=C1 MC30180 [2,0,0,0,0,0|2,0,0]=4 538 B9R1.69 OC1=C(Br)C=CC(Cl)=C1 CS21372 [2,0,0,0,0,0|2,0,0]=4 539 B9R1.69 OC1=C(Br)C=CC(F)=C1 MC20075 [2,0,0,0,0,0|2,0,0]=4 540 B9R1.69 OC1=C(Br)C=CC(I)=C1 CS13046 [2,0,0,0,0,0|2,0,0]=4 541 B9R1.69 OC1=C(Cl)C=C(Cl)C=C1 MC41180 [2,0,0,0,0,0|2,0,0]=4 542 B9R1.69 OC1=C(Cl)C=C(F)C=C1 CS13904 [2,0,0,0,0,0|2,0,0]=4 543 B9R1.69 OC1=C(Cl)C=CC(Br)=C1 MC20037 [2,0,0,0,0,0|2,0,0]=4 544 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 CS21143 [2,0,0,0,0,0|2,0,0]=4 545 B9R1.69 OC1=C(Cl)C=CC(F)=C1 CS22918 [2,0,0,0,0,0|2,0,0]=4 546 B9R1.69 OC1=C(F)C=C(Br)C=C1 CS22908 [2,0,0,0,0,0|2,0,0]=4 547 B9R1.69 OC1=C(F)C=C(Cl)C=C1 MC41170 [2,0,0,0,0,0|2,0,0]=4 548 B9R1.69 OC1=C(F)C=C(F)C=C1 CS19015 [2,0,0,0,0,0|2,0,0]=4 549 B9R1.69 OC1=C(F)C=C(I)C=C1 MC433386 [2,0,0,0,0,0|2,0,0]=4 550 B9R1.69 OC1=C(F)C=CC(Br)=C1 CS22910 [2,0,0,0,0,0|2,0,0]=4 551 B9R1.69 OC1=C(F)C=CC(Cl)=C1 CS22920 [2,0,0,0,0,0|2,0,0]=4 552 B9R1.69 OC1=C(F)C=CC(F)=C1 MC41184 [2,0,0,0,0,0|2,0,0]=4 553 B9R1.69 OC1=C(F)C=CC(I)=C1 CS12536 [2,0,0,0,0,0|2,0,0]=4 554 B9R1.69 OC1=C(I)C=C(Br)C=C1 MC433360 [2,0,0,0,0,0|2,0,0]=4 555 B9R1.69 OC1=C(I)C=C(Cl)C=C1 CS22744 [2,0,0,0,0,0|2,0,0]=4 556 B9R1.69 OC1=C(I)C=C(F)C=C1 CS13176 [2,0,0,0,0,0|2,0,0]=4 557 B9R1.69 OC1=C(I)C=CC(Br)=C1 MC442822 [2,0,0,0,0,0|2,0,0]=4 558 B9R1.69 OC1=C(I)C=CC(Cl)=C1 CS10328 [2,0,0,0,0,0|2,0,0]=4 559 B9R1.69 OC1=C(I)C=CC(F)=C1 MC441216 [2,0,0,0,0,0|2,0,0]=4 560 B9R1.69 OC1=C(I)C=CC(I)=C1 MC442225 [2,0,0,0,0,0|2,0,0]=4 561 B9R1.69 OC1=CC(F)=C(O)C=C1 MC20784 [2,0,0,0,0,0|1,0,1]=4 562 B9R1.69 OC1=CC(O)=C(Br)C=C1 CS22703 [2,0,0,0,0,0|1,0,1]=4 563 B9R1.69 OC1=CC(O)=C(F)C=C1 CS22989 [2,0,0,0,0,0|1,0,1]=4 564 B9R1.69 OC1=CC=C(Br)C=C1O CS22676 [2,0,0,0,0,0|1,0,0]=3 565 B9R1.1 C=CC1=CC=C(Br)C=C1 MC41562 [2,0,0,0,0,0|2,0,0]=4 566 B9R1.1 C=CC1=CC=C(F)C=C1 MC33131 [2,0,0,0,0,0|2,0,0]=4 567 B9R1.1 CC1=CC=C(C=O)C=C1 MC41128 [2,0,0,0,0,0|1,0,0]=3 568 B9R1.1 CC1=CN=C(C=O)C=C1 CS19088 [2,0,0,0,0,0|2,0,0]=4 569 B9R1.1 CC1=NC=C(C=O)C=C1 CS19116 [2,0,0,0,0,0|2,0,0]=4 570 B9R1.1 CCC1=CC=C(O)C=C1 MC20188 [2,0,0,0,0,0|1,0,1]=4 571 B9R1.1 COC1=CC=C(O)C=C1 CS22939 [2,0,0,0,0,0|2,0,0]=4 572 B9R1.1 CSC1=CC=C(O)C=C1 MC20743 [2,0,0,0,0,0|2,0,0]=4 573 B9R1.1 N#CC1=CC=C(O)C=C1 CS15887 [2,0,0,0,0,0|1,0,1]=4 574 B9R1.1 NC1=CC=C(C=O)C=C1 MC20423 [2,0,0,0,0,0|1,0,0]=3 575 B9R1.1 NCC1=CC=C(O)C=C1 CS22886 [2,0,0,0,0,0|1,0,1]=4 576 B9R1.1 O=CC1=CC=C(Br)C=C1 CS18612 [2,0,0,0,0,0|1,0,0]=3 577 B9R1.1 O=CC1=CC=C(Cl)C=C1 CS14843 [2,0,0,0,0,0|1,0,0]=3 578 B9R1.1 O=CC1=CC=C(F)C=C1 CS19072 [2,0,0,0,0,0|1,0,0]=3 579 B9R1.1 O=CC1=CC=C(I)C=C1 CS20133 [2,0,0,0,0,0|1,0,0]=3 580 B9R1.1 O=CC1=CC=C(O)C=C1 CS18686 [2,0,0,0,0,0|0,0,0]=2 581 B9R1.1 O=CC1=CN=C(Br)C=C1 CS13736 [2,0,0,0,0,0|2,0,0]=4 582 B9R1.1 O=CC1=CN=C(Cl)C=C1 CS13978 [2,0,0,0,0,0|2,0,0]=4 583 B9R1.1 O=CC1=CN=C(F)C=C1 CS19261 [2,0,0,0,0,0|2,0,0]=4 584 B9R1.1 O=CC1=CN=C(O)C=C1 CS13494 [2,0,0,0,0,0|1,0,0]=3 585 B9R1.1 O=CC1=NC=C(Br)C=C1 CS14127 [2,0,0,0,0,0|2,0,0]=4 586 B9R1.1 O=CC1=NC=C(Cl)C=C1 CS18956 [2,0,0,0,0,0|2,0,0]=4 587 B9R1.1 O=CC1=NC=C(F)C=C1 CS20057 [2,0,0,0,0,0|2,0,0]=4 588 B9R1.1 O=CC1=NC=C(O)C=C1 CS12167 [2,0,0,0,0,0|1,0,0]=3 589 B9R1.1 OCC1=CC=C(O)C=C1 CS19212 [2,0,0,0,0,0|0,0,2]=4 590 B11R1.8 COC1=C(Br)C(Br)=CC(F)=C1 MC108803 [1,1,0,0,0,0|2,0,0]=4 591 B11R1.8 COC1=C(C)C(F)=CC(F)=C1 MC110200 [1,1,0,0,0,0|2,0,0]=4 592 B11R1.8 COC1=C(Cl)C(Cl)=CC(C)=C1 MC109834 [1,1,0,0,0,0|1,0,1]=4 593 B11R1.8 COC1=C(Cl)C(Cl)=CC(F)=C1 MC109586 [1,1,0,0,0,0|2,0,0]=4 594 B11R1.8 COC1=C(Cl)C(F)=CC(Cl)=C1 MC109589 [1,1,0,0,0,0|2,0,0]=4 595 B11R1.8 COC1=C(F)C(Br)=CC(Br)=C1 MC108806 [1,1,0,0,0,0|2,0,0]=4 596 B11R1.8 COC1=C(F)C(C)=CC(F)=C1 MC110198 [1,1,0,0,0,0|2,0,0]=4 597 B11R1.8 COC1=C(F)C(Cl)=CC(Cl)=C1 MC109594 [1,1,0,0,0,0|2,0,0]=4 598 B11R1.8 COC1=C(F)C(F)=CC(C)=C1 MC110195 [1,1,0,0,0,0|1,0,1]=4 599 B11R1.8 COC1=C(N)C(C)=CC(Br)=C1 MC427328 [1,1,0,0,0,0|2,0,0]=4 600 B11R1.8 COC1=CC(Br)=CC(F)=C1Cl MC106980 [1,1,0,0,0,0|2,0,0]=4 601 B11R1.8 COC1=CC(Br)=CC(F)=C1F CS10250 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.8 COC1=CC(Br)=CC(F)=C1N MC106979 [1,1,0,0,0,0|2,0,0]=4 603 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 CS18242 [1,1,0,0,0,0|2,0,0]=4 604 B11R1.37 COC1=C(C#N)C=CC(C)=C1 CS21636 [1,1,0,0,0,0|1,0,1]=4 605 B11R1.37 COC1=C(C#N)C=CC(F)=C1 MC30021 [1,1,0,0,0,0|2,0,0]=4 606 B11R1.37 COC1=C(C#N)C=CC(N)=C1 CS22550 [1,1,0,0,0,0|2,0,0]=4 607 B11R1.37 COC1=C(C#N)C=CC(O)=C1 MC442317 [1,1,0,0,0,0|1,0,1]=4 608 B11R1.37 COC1=C(C=O)C=CC(Br)=C1 CS22648 [1,1,0,0,0,0|1,0,1]=4 609 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 MC30022 [1,1,0,0,0,0|1,0,1]=4 610 B11R1.37 COC1=C(C=O)C=CC(N)=C1 MC431889 [1,1,0,0,0,0|1,0,1]=4 611 B11R1.37 COC1=C(C=O)C=CC(O)=C1 MC442306 [1,1,0,0,0,0|0,0,2]=4 612 B11R1.37 COC1=C(CN)C=CC(Cl)=C1 MC107633 [1,1,0,0,0,0|2,0,0]=4 613 B11R1.37 COC1=C(CN)C=CC(F)=C1 CS12735 [1,1,0,0,0,0|2,0,0]=4 614 B11R1.37 COC1=C(CO)C=CC(Br)=C1 MC40687 [1,1,0,0,0,0|1,0,0]=3 615 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 MC443798 [1,1,0,0,0,0|2,0,0]=4 616 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 MC445716 [1,1,0,0,0,0|2,0,0]=4 617 B11R1.37 COC1=C(OC)C=C(Br)C=C1 CS19895 [1,1,0,0,0,0|1,0,0]=3 618 B11R1.37 COC1=C(OC)C=C(C)C=C1 CS21947 [1,1,0,0,0,0|0,0,1]=3 619 B11R1.37 COC1=C(OC)C=C(F)C=C1 CS20493 [1,1,0,0,0,0|1,0,0]=3 620 B11R1.37 COC1=C(OC)C=C(I)C=C1 MC41359 [1,1,0,0,0,0|1,0,0]=3 621 B11R1.37 COC1=C(OC)C=C(N)C=C1 CS15398 [1,1,0,0,0,0|1,0,0]=3 622 B11R1.37 COC1=C(OC)C=C(O)C=C1 MC30097 [1,1,0,0,0,0|0,0,1]=3 623 B11R1.37 COC1=C(OC)C=C(S)C=C1 MC41407 [1,1,0,0,0,0|0,1,0]=3 624 B11R1.37 COC1=C(OC)N=CC(N)=C1 CS15128 [1,1,0,0,0,0|2,0,0]=4 625 B11R1.37 COC1=CC(Br)=CN=C1CO MC431858 [1,1,0,0,0,0|2,0,0]=4 626 B11R1.37 COC1=CC(F)=CC=C1C=O MC30305 [1,1,0,0,0,0|1,0,1]=4 627 B11R1.37 COC1=NC(Br)=CC=C1CO CS17509 [1,1,0,0,0,0|2,0,0]=4 628 B11R1.72 COC1=C(Br)C(Br)=CC=C1F MC108804 [1,1,0,0,0,0|2,0,0]=4 629 B11R1.72 COC1=C(Br)C(F)=CC=C1Br MC108805 [1,1,0,0,0,0|2,0,0]=4 630 B11R1.72 COC1=C(Br)C=CC(F)=C1C MC430319 [1,1,0,0,0,0|2,0,0]=4 631 B11R1.72 COC1=C(Br)C=CC(F)=C1F MC443197 [1,1,0,0,0,0|2,0,0]=4 632 B11R1.72 COC1=C(Cl)C(F)=CC=C1Cl MC109591 [1,1,0,0,0,0|2,0,0]=4 633 B11R1.72 COC1=C(F)C(Br)=CC=C1F MC30186 [1,1,0,0,0,0|2,0,0]=4 634 B11R1.72 COC1=C(F)C(Cl)=CC=C1Cl MC109596 [1,1,0,0,0,0|2,0,0]=4 635 B11R1.72 COC1=C(F)C(F)=CC=C1C MC110196 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.72 COC1=C(F)C(F)=CC=C1N MC433343 [1,1,0,0,0,0|2,0,0]=4 637 B11R1.72 COC1=C(O)C(F)=CC=C1Br MC442753 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 MC10135 [1,1,0,0,0,0|2,0,0]=4 639 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 CS13715 [1,1,0,0,0,0|2,0,0]=4 640 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 CS20840 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 MC33295 [1,1,0,0,0,0|2,0,0]=4 642 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 CS19932 [1,1,0,0,0,0|1,0,1]=4 643 B11R1.167 CC(C)C1=C(O)C=CC(Br)=C1 MC443460 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.167 CC(C)C1=C(O)C=CC(Cl)=C1 MC442236 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.167 CC(O)C1=C(O)C=CC(Br)=C1 MC107819 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.182 CCOC1=C(Br)C=CC(N)=C1 CS20424 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.182 CCOC1=C(C)C=CC(N)=C1 MC111938 [1,1,0,0,0,0|2,0,0]=4 648 B11R1.182 CCOC1=C(Cl)C=CC(Br)=C1 MC41352 [1,1,0,0,0,0|2,0,0]=4 649 B11R1.182 CCOC1=C(F)C=CC(Cl)=C1 MC41354 [1,1,0,0,0,0|2,0,0]=4 650 B11R1.277 COC1=C(Cl)C=C(Br)C(C)=C1 MC30038 [1,1,0,0,0,0|1,0,1]=4 651 B11R1.277 COC1=C(Cl)C=C(Cl)C(F)=C1 MC109588 [1,1,0,0,0,0|2,0,0]=4 652 B11R1.277 COC1=C(Cl)C=C(F)C(Br)=C1 MC41314 [1,1,0,0,0,0|2,0,0]=4 653 B11R1.277 COC1=C(Cl)C=C(F)C(Cl)=C1 MC109590 [1,1,0,0,0,0|2,0,0]=4 654 B11R1.277 COC1=C(F)C=C(Br)C(F)=C1 MC433355 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.277 COC1=C(F)C=C(Cl)C(Cl)=C1 MC109597 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.277 COC1=C(F)C=C(F)C(O)=C1 MC110063 [1,1,0,0,0,0|1,0,1]=4 657 B11R1.277 COC1=C(N)C=C(Cl)C(Cl)=C1 MC430424 [1,1,0,0,0,0|2,0,0]=4 658 B11R1.277 COC1=C(N)C=C(Cl)C(F)=C1 MC30020 [1,1,0,0,0,0|2,0,0]=4 659 B11R1.277 COC1=C(N)C=C(F)C(Br)=C1 MC30204 [1,1,0,0,0,0|2,0,0]=4 660 B11R1.277 COC1=C(N)C=C(I)C(Cl)=C1 MC103145 [1,1,0,0,0,0|2,0,0]=4 661 B11R1.277 COC1=C(O)C=C(Br)C(Cl)=C1 MC443543 [1,1,0,0,0,0|1,0,0]=3 662 B11R1.277 COC1=C(O)C=C(F)C(Br)=C1 MC433357 [1,1,0,0,0,0|1,0,0]=3 663 B11R1.277 COC1=CC(C)=C(N)C=C1Br CS16621 [1,1,0,0,0,0|1,0,1]=4 664 B11R1.277 COC1=CC(F)=C(Br)C=C1Br MC113702 [1,1,0,0,0,0|2,0,0]=4 665 B11R1.277 COC1=CC(N)=C(C)C=C1Br MC107170 [1,1,0,0,0,0|2,0,0]=4 666 B11R1.277 COC1=CC(N)=C(Cl)C=C1Br MC30039 [1,1,0,0,0,0|2,0,0]=4 667 B11R1.277 COC1=CC(N)=C(Cl)C=C1Cl MC20225 [1,1,0,0,0,0|2,0,0]=4 668 B11R1.9 COC1=CC(Br)=CC(OC)=C1 CS19874 [1,1,0,0,0,0|2,0,0]=4 669 B11R1.9 COC1=CC(C#N)=CC(Br)=C1 CS22161 [1,1,0,0,0,0|1,0,1]=4 670 B11R1.9 COC1=CC(C#N)=CC(F)=C1 MC30261 [1,1,0,0,0,0|1,0,1]=4 671 B11R1.9 COC1=CC(C#N)=CC(N)=C1 CS16517 [1,1,0,0,0,0|1,0,1]=4 672 B11R1.9 COC1=CC(C)=CC(C#N)=C1 CS13219 [1,1,0,0,0,0|1,0,1]=4 673 B11R1.9 COC1=CC(C)=CC(C=O)=C1 MC433444 [1,1,0,0,0,0|0,0,0]=2 674 B11R1.9 COC1=CC(C)=CC(CO)=C1 CS17199 [1,1,0,0,0,0|0,0,2]=4 675 B11R1.9 COC1=CC(C)=CC(OC)=C1 MC20844 [1,1,0,0,0,0|2,0,0]=4 676 B11R1.9 COC1=CC(C=O)=CC(Cl)=C1 CS22225 [1,1,0,0,0,0|0,0,0]=2 677 B11R1.9 COC1=CC(C=O)=CC(F)=C1 CS10960 [1,1,0,0,0,0|0,0,0]=2 678 B11R1.9 COC1=CC(CBr)=CC(Cl)=C1 MC33329 [1,1,0,0,0,0|1,0,1]=4 679 B11R1.9 COC1=CC(CBr)=CC(F)=C1 CS19414 [1,1,0,0,0,0|1,0,1]=4 680 B11R1.9 COC1=CC(CO)=CC(F)=C1 MC40712 [1,1,0,0,0,0|0,0,2]=4 681 B11R1.9 COC1=CC(Cl)=CC(OC)=C1 CS20662 [1,1,0,0,0,0|2,0,0]=4 682 B11R1.9 COC1=CC(F)=CC(OC)=C1 MC30108 [1,1,0,0,0,0|2,0,0]=4 683 B11R1.9 COC1=CC(I)=CC(OC)=C1 CS15978 [1,1,0,0,0,0|2,0,0]=4 684 B11R1.9 COC1=CC(N)=CC(OC)=C1 CS20489 [1,1,0,0,0,0|2,0,0]=4 685 B11R1.9 COC1=CC(O)=CC(OC)=C1 MC442394 [1,1,0,0,0,0|2,0,0]=4 686 B11R1.9 N#CC1=CC(F)=CC(C=O)=C1 CS12677 [1,1,0,0,0,0|2,0,0]=4 687 B11R1.9 O=CC1=CC(Cl)=CC(C=O)=C1 MC113787 [1,1,0,0,0,0|2,0,0]=4 688 B11R1.189 C=CCC1=CC=CC(OC)=C1 MC425775 [1,1,0,0,0,0|1,0,0]=3 689 B11R1.189 CCOC1=CC=CC(C=O)=C1 MC433437 [1,1,0,0,0,0|0,0,0]=2 690 B11R1.189 COC1=CC=CC(CC#N)=C1 CS11040 [1,1,0,0,0,0|1,0,1]=4 691 B11R1.189 COC1=CC=CC(CCN)=C1 CS13916 [1,1,0,0,0,0|1,0,1]=4 692 B11R1.189 COC1=CC=CC(CCO)=C1 CS22342 [1,1,0,0,0,0|0,0,2]=4 693 B11R1.189 COCC1=CC=CC(C#N)=C1 CS18233 [1,1,0,0,0,0|1,0,1]=4 694 B11R1.189 COCC1=CC=CC(CN)=C1 CS15687 [1,1,0,0,0,0|1,0,1]=4 695 B11R1.266 CC(=O)C1=CC=CC(C#N)=C1 MC33169 [1,1,0,0,0,0|2,0,0]=4 696 B11R1.266 CC(=O)c1cccc(CCl)c1 MC30280 [1,1,0,0,0,0|2,0,0]=4 697 B11R1.266 CCC1=CC=CC(C(=O)O)=N1 CS21756 [1,1,0,0,0,0|2,0,0]=4 698 B11R1.266 CNC1=CC(C(=O)O)=CN=C1 MC33524 [1,1,0,0,0,0|2,0,0]=4 699 B11R1.266 CNC1=CC=CC(C(=O)O)=N1 CS18139 [1,1,0,0,0,0|2,0,0]=4 700 B11R1.266 COC1=CC(C(=O)O)=CN=C1 CS20059 [1,1,0,0,0,0|1,0,0]=3 701 B11R1.266 COC1=CC(C(=O)O)=CN=N1 CS17802 [1,1,0,0,0,0|2,0,0]=4 702 B11R1.266 COC1=CC(C(=O)O)=NC=C1 CS20334 [1,1,0,0,0,0|1,0,0]=3 703 B11R1.266 COC1=CC(C(=O)O)=NC=N1 MC441129 [1,1,0,0,0,0|2,0,0]=4 704 B11R1.266 COC1=CC(C(C)=O)=NC=C1 MC442668 [1,1,0,0,0,0|1,0,0]=3 705 B11R1.266 COC1=CC(N(C)C)=CC=C1 MC445041 [1,1,0,0,0,0|2,0,0]=4 706 B11R1.266 COC1=CC=CC(B(O)O)=C1 CS20399 [1,1,0,0,0,0|1,0,1]=4 707 B11R1.266 COC1=CC=CC(C(=N)N)=C1 CS18198 [1,1,0,0,0,0|1,0,0]=3 708 B11R1.266 COC1=CC=CC(C(=O)Cl)=C1 MC40493 [1,1,0,0,0,0|0,0,0]=2 709 B11R1.266 COC1=CC=CC(C(=O)O)=C1 MC40298 [1,1,0,0,0,0|0,0,0]=2 710 B11R1.266 COC1=CC=CC(C(=O)O)=N1 CS18200 [1,1,0,0,0,0|1,0,0]=3 711 B11R1.266 COC1=CN=CC(C(=O)O)=N1 CS14316 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.266 COC1=CN=NC(C(=O)O)=C1 MC116095 [1,1,0,0,0,0|2,0,0]=4 713 B11R1.266 COC1=NC=CC(C(=O)O)=C1 CS10487 [1,1,0,0,0,0|1,0,0]=3 714 B11R1.266 COC1=NC=CC(C(=O)O)=N1 MC441255 [1,1,0,0,0,0|2,0,0]=4 715 B11R1.266 N#CC1=CC=CC(C(=O)Cl)=C1 MC20560 [1,1,0,0,0,0|2,0,0]=4 716 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 MC433634 [1,1,0,0,0,0|2,0,0]=4 717 B11R1.266 NC(=O)C1=CC(CBr)=CC=C1 CS16760 [1,1,0,0,0,0|2,0,0]=4 718 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 CS21006 [1,1,0,0,0,0|2,0,0]=4 719 B11R1.266 O=C(Cl)C1=CC(CCl)=CC=C1 MC40457 [1,1,0,0,0,0|2,0,0]=4 720 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 MC30291 [1,1,0,0,0,0|2,0,0]=4 721 B11R1.266 O=C(O)C1=CC(CCl)=CC=C1 CS18966 [1,1,0,0,0,0|2,0,0]=4 722 B11R1.266 O=CC1=CC(C(=O)O)=CC=C1 CS21920 [1,1,0,0,0,0|2,0,0]=4 723 B11R1.266 O=CC1=CC([N+](=O)[O-])=CC=C1 MC41131 [1,1,0,0,0,0|2,0,0]=4 724 B11R1.266 O=CC1=CC=CC(B(O)O)=C1 CS20263 [1,1,0,0,0,0|2,0,0]=4 725 B11R1.266 O=Cc1cccc(C(F)F)c1 MC432454 [1,1,0,0,0,0|2,0,0]=4 726 B11R1.267 C#CC1=C(F)C(OC)=CC=C1 MC111983 [1,1,0,0,0,0|1,0,1]=4 727 B11R1.267 COC1=CC=CC(C#N)=C1C MC30009 [1,1,0,0,0,0|1,0,1]=4 728 B11R1.267 COC1=CC=CC(C#N)=C1F MC20257 [1,1,0,0,0,0|1,0,1]=4 729 B11R1.267 COC1=CC=CC(C#N)=C1I MC442095 [1,1,0,0,0,0|1,0,1]=4 730 B11R1.267 COC1=CC=CC(C#N)=C1N MC433732 [1,1,0,0,0,0|1,0,1]=4 731 B11R1.267 COC1=CC=CC(C#N)=C1O MC441232 [1,1,0,0,0,0|1,0,1]=4 732 B11R1.267 COC1=CC=CC(C=O)=C1F MC30215 [1,1,0,0,0,0|0,0,0]=2 733 B11R1.267 COC1=CC=CC(C=O)=C1O CS21576 [1,1,0,0,0,0|0,0,0]=2 734 B11R1.267 COC1=CC=CC(CN)=C1Cl MC111175 [1,1,0,0,0,0|1,0,1]=4 735 B11R1.267 COC1=CC=CC(CO)=C1I MC111288 [1,1,0,0,0,0|0,0,2]=4 736 B11R1.267 COC1=CC=CC(OC)=C1Br CS20645 [1,1,0,0,0,0|2,0,0]=4 737 B11R1.267 COC1=CC=CC(OC)=C1Cl MC30044 [1,1,0,0,0,0|2,0,0]=4 738 B11R1.267 COC1=CC=CC(OC)=C1I CS14848 [1,1,0,0,0,0|2,0,0]=4 739 B11R1.267 COC1=CC=CC(OC)=C1N CS18207 [1,1,0,0,0,0|2,0,0]=4 740 B11R1.267 COC1=NC=CC(C=O)=C1Cl MC430248 [1,1,0,0,0,0|1,0,0]=3 741 B11R1.267 N#CC1=C(Cl)C(C=O)=CC=C1 CS13796 [1,1,0,0,0,0|2,0,0]=4 742 B11R1.267 N#CC1=C(F)C(C=O)=CC=C1 MC430728 [1,1,0,0,0,0|2,0,0]=4 743 B11R1.267 O=CC1=CC=CC(C=O)=C1Br MC33204 [1,1,0,0,0,0|2,0,0]=4 744 B11R1.14 CC1=C(F)C=C(C=O)C=C1Br CS14266 [1,1,0,0,0,0|2,0,0]=4 745 B11R1.14 CC1=CC(C#N)=CC(C)=C1O CS21714 [1,1,0,0,0,0|1,0,1]=4 746 B11R1.14 CC1=CC(C=O)=CC(C)=C1Br CS21651 [1,1,0,0,0,0|1,0,0]=3 747 B11R1.14 CC1=CC(C=O)=CC(C)=C1O CS21079 [1,1,0,0,0,0|0,0,0]=2 748 B11R1.14 O=CC1=CC(Br)=C(Br)C(F)=C1 MC108815 [1,1,0,0,0,0|2,0,0]=4 749 B11R1.14 O=CC1=CC(Br)=C(F)C(Cl)=C1 MC107931 [1,1,0,0,0,0|2,0,0]=4 750 B11R1.14 O=CC1=CC(Br)=C(O)C(F)=C1 CS16316 [1,1,0,0,0,0|1,0,0]=3 751 B11R1.14 O=CC1=CC(Br)=C(O)C(O)=C1 MC442474 [1,1,0,0,0,0|0,0,0]=2 752 B11R1.14 O=CC1=CC(Cl)=C(Cl)C(F)=C1 MC433427 [1,1,0,0,0,0|2,0,0]=4 753 B11R1.14 O=CC1=CC(Cl)=C(F)C(Cl)=C1 MC433428 [1,1,0,0,0,0|2,0,0]=4 754 B11R1.14 O=CC1=CC(Cl)=C(O)C(Cl)=C1 CS19903 [1,1,0,0,0,0|1,0,0]=3 755 B11R1.14 O=CC1=CC(F)=C(Br)C(F)=C1 MC41089 [1,1,0,0,0,0|2,0,0]=4 756 B11R1.14 O=CC1=CC(F)=C(Cl)C(F)=C1 MC430963 [1,1,0,0,0,0|2,0,0]=4 757 B11R1.14 O=CC1=CC(F)=C(F)C(F)=C1 MC20027 [1,1,0,0,0,0|2,0,0]=4 758 B11R1.14 O=CC1=CC(F)=C(O)C(F)=C1 CS20018 [1,1,0,0,0,0|1,0,0]=3 759 B11R1.14 O=CC1=CC(I)=C(O)C(I)=C1 MC433433 [1,1,0,0,0,0|1,0,0]=3 760 B11R1.14 O=CC1=CC(O)=C(O)C(O)=C1 CS21918 [1,1,0,0,0,0|0,0,0]=2 761 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 MC41231 [1,1,0,0,0,0|2,0,0]=4 762 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 MC41229 [1,1,0,0,0,0|2,0,0]=4 763 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 CS20410 [1,1,0,0,0,0|2,0,0]=4 764 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 MC41240 [1,1,0,0,0,0|1,0,0]=3 765 B11R1.21 CC(=O)C1=CC(C)=C(Cl)N=C1 MC115594 [1,1,0,0,0,0|2,0,0]=4 766 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 CS21693 [1,1,0,0,0,0|1,0,0]=3 767 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 CS15561 [1,1,0,0,0,0|2,0,0]=4 768 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 CS10715 [1,1,0,0,0,0|2,0,0]=4 769 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 CS18939 [1,1,0,0,0,0|2,0,0]=4 770 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 CS22282 [1,1,0,0,0,0|2,0,0]=4 771 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 CS16308 [1,1,0,0,0,0|2,0,0]=4 772 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 CS10813 [1,1,0,0,0,0|1,0,0]=3 773 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 CS10863 [1,1,0,0,0,0|0,0,0]=2 774 B11R1.21 CC(=O)c1ccc(Br)c(Br)c1 MC433228 [1,1,0,0,0,0|2,0,0]=4 775 B11R1.21 CC(=O)c1ccc(Cl)c(F)c1 MC433221 [1,1,0,0,0,0|2,0,0]=4 776 B11R1.21 CC(=O)c1ccc(Cl)c(N)c1 MC433203 [1,1,0,0,0,0|2,0,0]=4 777 B11R1.21 CC(=O)c1ccc(F)c(F)c1 CS19019 [1,1,0,0,0,0|2,0,0]=4 778 B11R1.21 CC(=O)c1ccc(F)c(N)c1 MC433205 [1,1,0,0,0,0|2,0,0]=4 779 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 CS20811 [1,1,0,0,0,0|2,0,0]=4 780 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 MC433136 [1,1,0,0,0,0|1,0,0]=3 781 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=N1 MC431672 [1,1,0,0,0,0|2,0,0]=4 782 B11R1.21 CC1=C(Br)C=CC(C(N)=O)=C1 MC41013 [1,1,0,0,0,0|1,0,0]=3 783 B11R1.21 CC1=C(Br)C=CC([N+](=O)[O-])=C1 MC41503 [1,1,0,0,0,0|2,0,0]=4 784 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 CS21076 [1,1,0,0,0,0|1,0,0]=3 785 B11R1.21 CC1=C(C)C=C([N+](=O)[O-])C=C1 CS19756 [1,1,0,0,0,0|2,0,0]=4 786 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 MC111082 [1,1,0,0,0,0|2,0,0]=4 787 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 CS20828 [1,1,0,0,0,0|2,0,0]=4 788 B11R1.21 CC1=C(Cl)C=C(C(=O)[O-])C=C1 MC40343 [1,1,0,0,0,0|2,0,0]=4 789 B11R1.21 CC1=C(Cl)C=CC(C(=O)Cl)=C1 MC433626 [1,1,0,0,0,0|1,0,0]=3 790 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 CS19324 [1,1,0,0,0,0|1,0,0]=3 791 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 CS13608 [1,1,0,0,0,0|2,0,0]=4 792 B11R1.21 CC1=C(Cl)N=CC(C(=O)O)=C1 MC429982 [1,1,0,0,0,0|2,0,0]=4 793 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 CS21927 [1,1,0,0,0,0|2,0,0]=4 794 B11R1.21 CC1=C(F)C=CC(C(=O)Cl)=C1 MC40481 [1,1,0,0,0,0|1,0,0]=3 795 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 CS14298 [1,1,0,0,0,0|1,0,0]=3 796 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 CS12903 [1,1,0,0,0,0|2,0,0]=4 797 B11R1.21 CC1=C(F)C=CC([N+](=O)[O-])=C1 CS10433 [1,1,0,0,0,0|2,0,0]=4 798 B11R1.21 CC1=C(I)C=C(C(=O)Cl)C=C1 MC433702 [1,1,0,0,0,0|2,0,0]=4 799 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 CS21937 [1,1,0,0,0,0|2,0,0]=4 800 B11R1.21 CC1=C(I)C=CC([N+](=O)[O-])=C1 MC442250 [1,1,0,0,0,0|2,0,0]=4 801 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 CS21906 [1,1,0,0,0,0|2,0,0]=4 802 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 CS21001 [1,1,0,0,0,0|1,0,0]=3 803 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 CS20943 [1,1,0,0,0,0|1,0,0]=3 804 B11R1.21 CC1=C(O)C=C([N+](=O)[O-])C=C1 CS10489 [1,1,0,0,0,0|2,0,0]=4 805 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 MC441420 [1,1,0,0,0,0|1,0,1]=4 806 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 CS20947 [1,1,0,0,0,0|0,0,0]=2 807 B11R1.21 CC1=C(O)C=CC([N+](=O)[O-])=C1 MC433397 [1,1,0,0,0,0|1,0,0]=3 808 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br CS17571 [1,1,0,0,0,0|2,0,0]=4 809 B11R1.21 CC1=CC([N+](=O)[O-])=CN=C1O CS19382 [1,1,0,0,0,0|2,0,0]=4 810 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 MC40225 [1,1,0,0,0,0|2,0,0]=4 811 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 MC33100 [1,1,0,0,0,0|2,0,0]=4 812 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 CS20206 [1,1,0,0,0,0|2,0,0]=4 813 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 CS20228 [1,1,0,0,0,0|2,0,0]=4 814 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 CS10439 [1,1,0,0,0,0|2,0,0]=4 815 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 MC10142 [1,1,0,0,0,0|2,0,0]=4 816 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 MC31156 [1,1,0,0,0,0|2,0,0]=4 817 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 CS20381 [1,1,0,0,0,0|2,0,0]=4 818 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 CS20332 [1,1,0,0,0,0|1,0,0]=3 819 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 CS10491 [1,1,0,0,0,0|1,0,0]=3 820 B11R1.21 NC1=C(O)C=CC([N+](=O)[O-])=C1 MC41144 [1,1,0,0,0,0|2,0,0]=4 821 B11R1.21 NC1=CC=C(C(=O)O)C=C1Cl MC20248 [1,1,0,0,0,0|2,0,0]=4 822 B11R1.21 O=C(Cl)C1=CC(Cl)=C(Cl)C=C1 MC21024 [1,1,0,0,0,0|2,0,0]=4 823 B11R1.21 O=C(Cl)C1=CC(Cl)=C(F)C=C1 MC30275 [1,1,0,0,0,0|2,0,0]=4 824 B11R1.21 O=C(Cl)C1=CC(F)=C(Br)C=C1 MC40445 [1,1,0,0,0,0|2,0,0]=4 825 B11R1.21 O=C(Cl)C1=CC(F)=C(Cl)C=C1 MC40454 [1,1,0,0,0,0|2,0,0]=4 826 B11R1.21 O=C(Cl)C1=CC(F)=C(F)C=C1 MC30095 [1,1,0,0,0,0|2,0,0]=4 827 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 CS13169 [1,1,0,0,0,0|1,0,1]=4 828 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 MC433643 [1,1,0,0,0,0|2,0,0]=4 829 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 CS19835 [1,1,0,0,0,0|2,0,0]=4 830 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 CS21914 [1,1,0,0,0,0|2,0,0]=4 831 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 CS16354 [1,1,0,0,0,0|2,0,0]=4 832 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 MC40236 [1,1,0,0,0,0|2,0,0]=4 833 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 CS14672 [1,1,0,0,0,0|2,0,0]=4 834 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 CS19962 [1,1,0,0,0,0|2,0,0]=4 835 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 CS20110 [1,1,0,0,0,0|1,0,0]=3 836 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 CS21990 [1,1,0,0,0,0|2,0,0]=4 837 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 CS19967 [1,1,0,0,0,0|2,0,0]=4 838 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 CS20015 [1,1,0,0,0,0|2,0,0]=4 839 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 CS22285 [1,1,0,0,0,0|2,0,0]=4 840 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 MC40282 [1,1,0,0,0,0|1,0,0]=3 841 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 MC441218 [1,1,0,0,0,0|2,0,0]=4 842 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 MC434062 [1,1,0,0,0,0|2,0,0]=4 843 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 CS12746 [1,1,0,0,0,0|2,0,0]=4 844 B11R1.21 O=C(O)C1=CC(I)=C(I)C=C1 MC441219 [1,1,0,0,0,0|2,0,0]=4 845 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 CS22662 [1,1,0,0,0,0|1,0,0]=3 846 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CS20111 [1,1,0,0,0,0|1,0,0]=3 847 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 MC40283 [1,1,0,0,0,0|1,0,0]=3 848 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 CS18380 [1,1,0,0,0,0|1,0,0]=3 849 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 CS20259 [1,1,0,0,0,0|0,0,0]=2 850 B11R1.21 O=C(O)C1=CC=C(O)C(=O)N1 CS17670 [1,1,0,0,0,0|1,0,1]=4 851 B11R1.21 O=C(O)C1=NC(Cl)=C(O)C=C1 MC432469 [1,1,0,0,0,0|2,0,0]=4 852 B11R1.21 O=C(O)C1=NC(O)=C(F)C=C1 CS17967 [1,1,0,0,0,0|2,0,0]=4 853 B11R1.21 O=C(O)C1=NC(O)=C(O)N=C1 CS17143 [1,1,0,0,0,0|2,0,0]=4 854 B11R1.21 O=C(O)C1=NC=C(O)C(Cl)=C1 MC432602 [1,1,0,0,0,0|2,0,0]=4 855 B11R1.21 O=C([O-])C1=CC(Cl)=C(F)C=C1 MC40342 [1,1,0,0,0,0|2,0,0]=4 856 B11R1.21 O=C([O-])C1=CC(F)=C(F)C=C1 MC40348 [1,1,0,0,0,0|2,0,0]=4 857 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(O)C=C1 CS18789 [1,1,0,0,0,0|2,0,0]=4 858 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(O)C=C1 CS18855 [1,1,0,0,0,0|2,0,0]=4 859 B11R1.21 O=[N+]([O-])C1=CC(F)=C(O)C=C1 MC30320 [1,1,0,0,0,0|2,0,0]=4 860 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Br)C=C1 MC33152 [1,1,0,0,0,0|2,0,0]=4 861 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1 CS22922 [1,1,0,0,0,0|2,0,0]=4 862 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 CS21551 [1,1,0,0,0,0|2,0,0]=4 863 B11R1.192 CC1=C(Cl)C=CC(N=C=O)=C1 MC41037 [1,1,0,0,0,0|1,0,1]=4 864 B11R1.192 NCCC1=CC=C(O)C(O)=C1 CS15345 [1,1,0,0,0,0|1,0,1]=4 865 B11R1.192 O=CCC1=CC(Br)=C(F)C=C1 MC430543 [1,1,0,0,0,0|2,0,0]=4 866 B11R1.192 O=CCC1=CC(F)=C(Br)C=C1 MC430272 [1,1,0,0,0,0|2,0,0]=4 867 B11R1.278 CC1=C(Br)C(F)=C(C=O)C=C1 MC443356 [1,1,0,0,0,0|2,0,0]=4 868 B11R1.278 CC1=C(C=O)C=CC(F)=C1F CS17527 [1,1,0,0,0,0|2,0,0]=4 869 B11R1.278 CC1=C(F)C(F)=C(C=O)C=C1 MC430055 [1,1,0,0,0,0|2,0,0]=4 870 B11R1.278 CC1=C(F)C=CC(C=O)=C1Cl CS16312 [1,1,0,0,0,0|1,0,0]=3 871 B11R1.278 CC1=C(F)C=CC(C=O)=C1F CS21103 [1,1,0,0,0,0|1,0,0]=3 872 B11R1.278 CC1=C(O)C=CC(C=O)=C1O CS15354 [1,1,0,0,0,0|0,0,0]=2 873 B11R1.278 O=CC1=C(Br)C(Br)=C(F)C=C1 MC108808 [1,1,0,0,0,0|2,0,0]=4 874 B11R1.278 O=CC1=C(Br)C(F)=C(Br)C=C1 MC108810 [1,1,0,0,0,0|2,0,0]=4 875 B11R1.278 O=CC1=C(Cl)C(O)=C(Cl)C=C1 CS15848 [1,1,0,0,0,0|1,0,0]=3 876 B11R1.278 O=CC1=C(F)C(Br)=C(Br)C=C1 MC108814 [1,1,0,0,0,0|2,0,0]=4 877 B11R1.278 O=CC1=C(F)C(Cl)=C(F)C=C1 MC41101 [1,1,0,0,0,0|2,0,0]=4 878 B11R1.278 O=CC1=C(F)C(F)=C(Br)C=C1 CS14416 [1,1,0,0,0,0|2,0,0]=4 879 B11R1.278 O=CC1=C(F)C(F)=C(Br)C=C1 MC433076 [1,1,0,0,0,0|2,0,0]=4 880 B11R1.278 O=CC1=C(F)C(F)=C(F)C=C1 MC30123 [1,1,0,0,0,0|2,0,0]=4 881 B11R1.278 O=CC1=C(F)C(F)=C(I)C=C1 CS15042 [1,1,0,0,0,0|2,0,0]=4 882 B11R1.278 O=CC1=C(F)C(F)=C(O)C=C1 CS21025 [1,1,0,0,0,0|1,0,0]=3 883 B11R1.278 O=CC1=C(F)C(O)=C(F)C=C1 CS15755 [1,1,0,0,0,0|1,0,0]=3 884 B11R1.278 O=CC1=C(O)C(O)=C(O)C=C1 CS20987 [1,1,0,0,0,0|0,0,0]=2 885 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 MC30287 [1,1,0,0,0,0|1,0,0]=3 886 B11R1.279 COC1=C(C)C=C(C#N)C=C1 MC30267 [1,1,0,0,0,0|1,0,1]=4 887 B11R1.279 COC1=C(C)C=C(C=O)C=C1 CS10892 [1,1,0,0,0,0|0,0,0]=2 888 B11R1.279 COC1=C(Cl)C=C(C=O)C=C1 MC41105 [1,1,0,0,0,0|1,0,0]=3 889 B11R1.279 COC1=C(F)C=C(C=O)C=C1 MC30257 [1,1,0,0,0,0|1,0,0]=3 890 B11R1.279 COC1=C(N)C=C(C=O)C=C1 CS22069 [1,1,0,0,0,0|1,0,0]=3 891 B11R1.279 COC1=C(O)C=C(C#N)C=C1 CS14799 [1,1,0,0,0,0|1,0,1]=4 892 B11R1.279 COC1=C(O)C=C(C=O)C=C1 CS15324 [1,1,0,0,0,0|0,0,0]=2 893 B11R1.279 COC1=C(O)C=C(CO)C=C1 CS22314 [1,1,0,0,0,0|0,0,2]=4 894 B11R1.279 COC1=CC(O)=C(OC)C=C1 CS21149 [1,1,0,0,0,0|2,0,0]=4 895 B11R1.279 COC1=NC=C(C=O)C=C1Br MC430406 [1,1,0,0,0,0|2,0,0]=4 896 B11R1.279 COC1=NC=C(C=O)C=C1F MC115933 [1,1,0,0,0,0|2,0,0]=4 897 B13R1.13 CC(=O)C1=CC([N+](=O)[O-])=C(O)C=C1 CS15399 [0,2,0,0,0,0|2,0,0]=4 898 B13R1.13 CC(=O)c1cc([N+](=O)[O-])ccc1O CS20867 [0,2,0,0,0,0|2,0,0]=4 899 B13R1.13 O=C(O)C1=CC([N+](=O)[O-])=C(O)C=C1 CS15294 [0,2,0,0,0,0|2,0,0]=4 900 B13R1.49 CCC(=O)C1=CC(OC)=C(O)C=C1 CS22875 [0,2,0,0,0,0|0,0,0]=2 901 B13R1.49 CNC1=C(N)C=CC(C(=O)OC)=C1 CS16777 [0,2,0,0,0,0|2,0,0]=4 902 B13R1.49 COC(=O)C1=CC(OC)=C(Br)C=C1 CS11640 [0,2,0,0,0,0|1,0,0]=3 903 B13R1.49 COC(=O)C1=CC(OC)=C(C)C=C1 CS11629 [0,2,0,0,0,0|1,0,0]=3 904 B13R1.49 COC(=O)C1=CC(OC)=C(Cl)C=C1 MC40084 [0,2,0,0,0,0|1,0,0]=3 905 B13R1.49 COC(=O)C1=CC(OC)=C(I)C=C1 MC40108 [0,2,0,0,0,0|1,0,0]=3 906 B13R1.49 COC(=O)C1=CC(OC)=C(N)C=C1 CS10901 [0,2,0,0,0,0|1,0,0]=3 907 B13R1.49 COC(=O)C1=CC(OC)=C(O)C=C1 CS21130 [0,2,0,0,0,0|0,0,0]=2 908 B13R1.49 COC(=O)C1=NC(OC)=C(Br)C=C1 MC432584 [0,2,0,0,0,0|2,0,0]=4 909 B13R1.49 COC(=O)C1=NC(OC)=C(C)C=C1 MC428184 [0,2,0,0,0,0|2,0,0]=4 910 B13R1.49 COC(=O)C1=NC=C(Br)C(OC)=C1 MC431901 [0,2,0,0,0,0|2,0,0]=4 911 B13R1.49 O=C(CBr)C1=CC(CO)=C(O)C=C1 MC425697 [0,2,0,0,0,0|2,0,0]=4 912 B13R1.49 O=CC1=C(O)C=CC(C(=O)CBr)=C1 MC427112 [0,2,0,0,0,0|2,0,0]=4 913 B13R1.50 COC1=C(F)C=CC(S(=O)(=O)Cl)=C1 MC445190 [0,2,0,0,0,0|2,0,0]=4 914 B13R1.50 COC1=C(N)C=CC(S(C)(=O)=O)=C1 CS15738 [0,2,0,0,0,0|2,0,0]=4 915 B13R1.298 COC1=CC(B(O)O)=CC(Cl)=C1O MC113640 [0,2,0,0,0,0|1,0,1]=4 916 B13R1.298 COC1=CC(C(=O)O)=CC(Cl)=C1O MC40256 [0,2,0,0,0,0|0,0,0]=2 917 B13R1.298 N#CC1=CC(C(=O)O)=CC(Br)=C1O MC108263 [0,2,0,0,0,0|2,0,0]=4 918 B13R1.354 CCCC1=C(F)C=CC(C(=O)O)=C1 CS16016 [0,2,0,0,0,0|2,0,0]=4 919 B13R1.354 CCOC1=C(Br)C=CC([N+](=O)[O-])=C1 CS21379 [0,2,0,0,0,0|2,0,0]=4 920 B13R1.354 CCOC1=C(N)C=CC([N+](=O)[O-])=C1 MC20294 [0,2,0,0,0,0|2,0,0]=4 921 B13R1.651 CC1=CC(O)=C(C(C)C)C=C1N=O CS11146 [0,2,0,0,0,0|2,0,0]=4 922 B13R1.651 COC1=C(Cl)C=C(C)C([N+](=O)[O-])=C1 CS16931 [0,2,0,0,0,0|2,0,0]=4 923 B13R1.651 COC1=C(Cl)C=C(Cl)C([N+](=O)[O-])=C1 MC433379 [0,2,0,0,0,0|2,0,0]=4 924 B13R1.651 COC1=C(Cl)C=C(F)C([N+](=O)[O-])=C1 MC31201 [0,2,0,0,0,0|2,0,0]=4 925 B13R1.651 COC1=C(F)C=C(Br)C([N+](=O)[O-])=C1 MC41318 [0,2,0,0,0,0|2,0,0]=4 926 B13R1.651 COC1=C(F)C=C(F)C([N+](=O)[O-])=C1 MC433384 [0,2,0,0,0,0|2,0,0]=4 927 B13R1.651 COC1=C(F)C=C(N)C([N+](=O)[O-])=C1 MC433347 [0,2,0,0,0,0|2,0,0]=4 928 B13R1.651 COC1=CC(C(=O)O)=C(Br)C=C1F MC30076 [0,2,0,0,0,0|1,0,0]=3 929 B13R1.651 COC1=CC(C(=O)O)=C(F)C=C1C MC433685 [0,2,0,0,0,0|1,0,0]=3 930 B13R1.651 COC1=CC(C(=O)O)=C(F)C=C1N CS12719 [0,2,0,0,0,0|1,0,0]=3 931 B13R1.651 COC1=CC(C(C)=O)=C(C)C=C1O MC429367 [0,2,0,0,0,0|0,0,0]=2 932 B13R1.651 COC1=CC(C(C)=O)=C(F)C=C1O MC41252 [0,2,0,0,0,0|0,0,0]=2 933 B13R1.651 COc1cc(C(C)=O)c(N)cc1F MC433206 [0,2,0,0,0,0|1,0,0]=3 934 B13R1.651 N#CC1=CC(C(=O)O)=C(Br)C=C1O MC108258 [0,2,0,0,0,0|2,0,0]=4 935 B13R1.3091 COC1=C(CCl)C=C(C(C)=O)C=C1 MC41241 [0,2,0,0,0,0|2,0,0]=4 936 B13R1.3091 COC1=C(OC)C=C(B(O)O)C=C1 MC445050 [0,2,0,0,0,0|1,0,1]=4 937 B13R1.3091 COC1=C(OC)C=C(C(=O)Cl)C=C1 MC40469 [0,2,0,0,0,0|0,0,0]=2 938 B13R1.3091 COC1=C(OC)C=C(C(=O)O)C=C1 MC40279 [0,2,0,0,0,0|0,0,0]=2 939 B13R1.3230 COC1=C(Br)C=CC(C(=O)O)=C1C MC102544 [0,2,0,0,0,0|1,0,0]=3 940 B13R1.3230 COC1=C(Br)C=CC(C(=O)O)=C1F MC443146 [0,2,0,0,0,0|1,0,0]=3 941 B13R1.3230 COC1=C(Cl)C=CC(C(=O)O)=C1Cl MC433652 [0,2,0,0,0,0|1,0,0]=3 942 B13R1.3230 COC1=C(F)C=CC(C(=O)O)=C1F MC30157 [0,2,0,0,0,0|1,0,0]=3 943 B13R1.3230 COC1=C(F)C=CC(C(=O)O)=C1N CS14710 [0,2,0,0,0,0|1,0,0]=3 944 B13R1.3230 COC1=C(O)C=CC(C(=O)O)=C1N MC442451 [0,2,0,0,0,0|0,0,0]=2 945 B13R1.99 COC1=C(B(O)O)C=CC(C#N)=C1 CS16543 [0,2,0,0,0,0|1,0,1]=4 946 B13R1.99 COC1=C(C(=O)O)C=CC(C#N)=C1 CS16589 [0,2,0,0,0,0|1,0,1]=4 947 B13R1.99 COC1=C(C(F)F)C=CC(C=O)=C1 MC432547 [0,2,0,0,0,0|1,0,0]=3 948 B13R1.99 COC1=CC(OC)=C(B(O)O)C=C1 MC442590 [0,2,0,0,0,0|2,0,0]=4 949 B13R1.99 COC1=CC(OC)=C(C(=O)O)C=C1 CS21119 [0,2,0,0,0,0|2,0,0]=4 950 B13R1.355 CCOC1=C(OC)C=CC(C#N)=C1 MC425852 [0,2,0,0,0,0|1,0,1]=4 951 B13R1.355 CCOC1=C(OC)C=CC(C=O)=C1 MC20668 [0,2,0,0,0,0|0,0,0]=2 952 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 CS16297 [0,2,0,0,0,0|1,0,1]=4 953 B13R1.386 COC1=C(OC)C=C(CC=O)C=C1 CS20165 [0,2,0,0,0,0|0,0,0]=2 954 B13R1.386 COC1=C(OC)C=C(CCO)C=C1 MC10303 [0,2,0,0,0,0|0,0,2]=4 955 B13R1.1249 CCOC1=C(OC)C=C(CO)C=C1 MC40710 [0,2,0,0,0,0|0,0,2]=4 956 B13R1.2200 COC1=C(OC)C=C(C=O)C(Br)=C1 CS10496 [0,2,0,0,0,0|0,0,0]=2 957 B13R1.2200 COC1=CC(Br)=C(CBr)C=C1OC CS21348 [0,2,0,0,0,0|1,0,1]=4 958 B13R1.2200 COC1=CC(F)=C(C#N)C=C1OC MC40650 [0,2,0,0,0,0|1,0,1]=4 959 B13R1.2200 COC1=CC(N)=C(C#N)C=C1OC MC433728 [0,2,0,0,0,0|1,0,1]=4 960 B13R1.2422 COC1=C(OC)C(Cl)=C(C=O)C=C1 MC10308 [0,2,0,0,0,0|0,0,0]=2 961 B13R1.2430 COC1=C([N+](=O)[O-])C=C(C=O)C=C1 CS20860 [0,2,0,0,0,0|2,0,0]=4 962 B13R1.97 CC(=O)NC1=C(C)C=CC(C=O)=C1 MC102228 [0,2,0,0,0,0|2,0,0]=4 963 B13R1.97 O=CC1=CN=C(F)C(OC(F)F)=C1 MC110075 [0,2,0,0,0,0|2,0,0]=4 964 B13R1.97 O=CC1=NC=C(F)C(OC(F)F)=C1 MC110085 [0,2,0,0,0,0|2,0,0]=4 965 B13R1.2431 COC(=O)C1=C(F)C=CC(C=O)=C1 MC431865 [0,2,0,0,0,0|1,0,0]=3 966 B13R1.2431 COC(=O)C1=C(O)C=CC(OC)=C1 CS11659 [0,2,0,0,0,0|2,0,0]=4 967 B13R1.3981 CCOC1=CC(C=O)=CC(Br)=C1O MC41091 [0,2,0,0,0,0|0,0,0]=2 968 B13R1.52 COC1=C(F)C=CC(CC(=O)O)=C1 CS19593 [0,2,0,0,0,0|1,0,0]=3 969 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 MC433954 [0,2,0,0,0,0|0,0,0]=2 970 B13R1.425 COC1=CC(C=O)=C(F)C(F)=C1C MC102560 [0,2,0,0,0,0|1,0,0]=3 971 B13R1.433 COC1=CC(C=O)=CC(OC)=C1Br CS21665 [0,2,0,0,0,0|1,0,0]=3 972 B13R1.433 COC1=CC(C=O)=CC(OC)=C1O CS21131 [0,2,0,0,0,0|0,0,0]=2 973 B13R1.98 CC(C)(C)C1=C(O)C=CC(C=O)=C1 MC441222 [0,2,0,0,0,0|1,0,0]=3 974 B13R1.98 O=CC1=CC(C(F)(F)F)=C(O)C=C1 MC41124 [0,2,0,0,0,0|2,0,0]=4 975 B13R1.2277 COC1=C(Br)C=CC(C=O)=C1OC MC443154 [0,2,0,0,0,0|1,0,0]=3 976 B11R1.23 COC(=O)C1=CC=CC(=O)N1 CS15010 [0,0,1,1,0,0|2,0,0]=4 977 B11R2.36 BrC1=CC2=C(C=C1)CCO2 MC441170 [1,0,0,1,0,0|2,0,0]=4 978 B11R2.36 BrC1=CC2=C(C=C1)OCC2 MC20389 [1,0,0,1,0,0|2,0,0]=4 979 B11R2.36 Brc1ccc2c(c1)OCO2 CS19789 [1,0,0,1,0,0|1,0,0]=3 980 B11R2.36 FC1=CC2=C(C=C1)CCO2 MC432264 [1,0,0,1,0,0|2,0,0]=4 981 B11R2.36 IC1=CC2=C(C=C1)OCC2 MC442476 [1,0,0,1,0,0|2,0,0]=4 982 B11R2.36 IC1=CC2=C(C=C1)OCO2 MC442800 [1,0,0,1,0,0|1,0,0]=3 983 B11R2.36 NC1=CC2=C(C=C1)OCC2 MC442475 [1,0,0,1,0,0|2,0,0]=4 984 B11R2.36 NC1=CC2=C(C=C1)OCO2 CS20315 [1,0,0,1,0,0|1,0,0]=3 985 B11R2.36 OC1=CC2=C(C=C1)CCO2 CS16031 [1,0,0,1,0,0|1,0,1]=4 986 B13R2.430 CC(=O)C1=CC2=C(C=C1)CCO2 MC442785 [0,1,0,1,0,0|1,0,0]=3 987 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCO2 CS11018 [0,1,0,1,0,0|0,0,0]=2 988 B13R2.430 CC(N)C1=CC2=C(C=C1)OCO2 MC106693 [0,1,0,1,0,0|1,0,1]=4 989 B13R2.430 CC(N)C1=CC2=C(C=C1)OCO2 MC106694 [0,1,0,1,0,0|1,0,1]=4 990 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCO2 CS21041 [0,1,0,1,0,0|1,0,0]=3 991 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=C2 CS21477 [0,1,0,1,0,0|1,0,1]=4 992 B13R2.430 O=C(O)C1=CC2=C(C=CO2)C=C1 MC441167 [0,1,0,1,0,0|1,0,1]=4 993 B13R2.430 OB(O)C1=CC2=C(C=C1)OCO2 CS18560 [0,1,0,1,0,0|1,0,1]=4 994 B13R2.57 NCC1=CC2=C(C=C1)OCCO2 MC429944 [0,1,0,1,0,0|1,0,1]=4 995 B13R2.57 O=CC1=CC2=C(C=C1)OCCO2 CS21629 [0,1,0,1,0,0|0,0,0]=2 996 B13R2.57 O=CC1=CC2=C(C=N1)OCCO2 MC115814 [0,1,0,1,0,0|1,0,0]=3 997 B13R2.57 OCC1=CC2=C(C=C1)OCCO2 CS21036 [0,1,0,1,0,0|0,0,2]=4 998 B13R2.669 CC1=NNC2=CC=C(C=O)C=C21 MC441353 [0,1,0,1,0,0|2,0,0]=4 999 B13R2.669 CN1C=CC2=CC=C(C=O)C=C21 CS13366 [0,1,0,1,0,0|2,0,0]=4 1000 B13R2.669 CN1C=NC2=C1C=C(C=O)C=C2 MC113243 [0,1,0,1,0,0|2,0,0]=4 1001 B13R2.2121 CC1=NC2=C(C=CC(C=O)=C2)S1 MC107171 [0,1,0,1,0,0|1,1,0]=4 1002 B13R2.2121 CN1C=C2C=CC(C=O)=CC2=N1 MC104564 [0,1,0,1,0,0|2,0,0]=4 1003 B13R2.449 N#CCC1=CC2=C(C=C1)OCO2 MC40784 [0,1,0,1,0,0|1,0,1]=4 1004 B13R2.449 O=C=Nc1ccc2c(c1)OCO2 MC41048 [0,1,0,1,0,0|0,0,1]=3 1005 B13R2.599 COC1=C(Br)C=C2NC=CC2=C1 CS15247 [0,1,0,1,0,0|2,0,0]=4 1006 B13R2.599 COC1=C(Br)C=C2NN=CC2=C1 MC444417 [0,1,0,1,0,0|2,0,0]=4 1007 B13R2.599 COC1=C(F)C=C2NC=CC2=C1 MC115997 [0,1,0,1,0,0|2,0,0]=4 1008 B13R2.599 COC1=CC2=C(C=C1Br)N=CN2 CS16251 [0,1,0,1,0,0|2,0,0]=4 1009 B9R1.21 COC1=NC=C(C=O)S1 MC443812 [1,0,0,0,1,0|2,0,0]=4 1010 B11R1.265 COC1=C(C#N)C=CC=C1O MC40663 [0,0,0,0,1,1|1,0,1]=4 1011 B11R1.265 COC1=C(C=O)C=CC=C1Br CS22135 [0,0,0,0,1,1|1,0,0]=3 1012 B11R1.265 COC1=C(C=O)C=CC=C1C CS15730 [0,0,0,0,1,1|1,0,0]=3 1013 B11R1.265 COC1=C(C=O)C=CC=C1Cl CS12248 [0,0,0,0,1,1|1,0,0]=3 1014 B11R1.265 COC1=C(C=O)C=CC=C1F MC30252 [0,0,0,0,1,1|1,0,0]=3 1015 B11R1.265 COC1=C(C=O)C=CC=C1O MC425754 [0,0,0,0,1,1|0,0,0]=2 1016 B11R1.265 COC1=CC=CC(O)=C1OC CS21046 [0,0,0,0,1,1|2,0,0]=4