0 B11R1.267 C#CC1=C(F)C(OC)=CC=C1 MC111983 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.267 CCC1=CC=CC(CC)=C1Br MC442359 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.267 CCC1=CC=CC(CC)=C1N CS21174 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.267 CCC1=CC=CC(CC)=C1O CS21175 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.267 COC1=C(C)C(C#N)=CN=C1 MC102709 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.267 COC1=C(F)C(C#N)=NC=C1 MC431736 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.267 COC1=CC=CC(C#N)=C1C MC30009 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.267 COC1=CC=CC(C#N)=C1F MC20257 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.267 COC1=CC=CC(C#N)=C1I MC442095 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.267 COC1=CC=CC(C#N)=C1N MC433732 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.267 COC1=CC=CC(C#N)=C1O MC441232 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.267 COC1=CC=CC(C=O)=C1F MC30215 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.267 COC1=CC=CC(C=O)=C1O CS21576 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.267 COC1=CC=CC(CN)=C1Cl MC111175 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.267 COC1=CC=CC(CO)=C1I MC111288 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.267 COC1=CC=CC(OC)=C1Br CS20645 [0,0,0,0,0,0|1,0,0]=1 16 B11R1.267 COC1=CC=CC(OC)=C1Cl MC30044 [0,0,0,0,0,0|1,0,0]=1 17 B11R1.267 COC1=CC=CC(OC)=C1I CS14848 [0,0,0,0,0,0|1,0,0]=1 18 B11R1.267 COC1=CC=CC(OC)=C1N CS18207 [0,0,0,0,0,0|1,0,0]=1 19 B11R1.267 COC1=CN=CC(OC)=C1Br MC427086 [0,0,0,0,0,0|2,0,0]=2 20 B11R1.267 COC1=CN=CC(OC)=C1N MC443184 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.267 COC1=NC=CC(C#N)=C1Br MC108363 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.267 COC1=NC=CC(C#N)=C1F MC443619 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.267 COC1=NC=CC(C=O)=C1Cl MC430248 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.267 COC1=NC=CC(OC)=C1Br MC427595 [0,0,0,0,0,0|2,0,0]=2 25 B11R1.267 COC1=NC=NC(OC)=C1N CS12113 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.267 N#CC1=CC=CC(C#N)=C1O MC443708 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.2 CC1=C(C=O)C=CC=C1O CS15258 [1,0,0,0,0,0|3,0,0]=4 28 B10R1.2 CC1=C(O)C=CC=C1CO MC425562 [1,0,0,0,0,0|3,0,0]=4 29 B10R1.2 CC1=CC=CC(C#N)=C1C CS11027 [1,0,0,0,0,0|3,0,0]=4 30 B10R1.2 CC1=CC=CC(C#N)=C1Cl MC20252 [1,0,0,0,0,0|3,0,0]=4 31 B10R1.2 CC1=CC=CC(C#N)=C1F CS10735 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.2 CC1=CC=CC(C#N)=C1N CS15405 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.2 CC1=CC=CC(C=O)=C1C CS10889 [1,0,0,0,0,0|3,0,0]=4 34 B10R1.2 CC1=CC=CC(C=O)=C1Cl MC33173 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.2 CC1=CC=CC(C=O)=C1F MC20031 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.2 CC1=CC=CC(C=O)=C1O CS20930 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.2 CC1=CC=CC(CBr)=C1C CS10894 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.2 CC1=CC=CC(CN)=C1C MC40822 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.2 CC1=CC=CC(CO)=C1C CS20113 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.2 CCC1=C(O)C(F)=CC=C1 MC431776 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.2 CCC1=C(O)C(O)=CC=C1 MC442025 [1,0,0,0,0,0|1,0,0]=2 42 B10R1.2 CCC1=CC=CC(Br)=C1O MC442827 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.2 CCC1=CC=CC(Cl)=C1N MC443589 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.2 CCC1=CC=CC(Cl)=C1O MC441042 [1,0,0,0,0,0|2,0,0]=3 45 B10R1.2 CCC1=CC=CC(O)=C1F MC442498 [1,0,0,0,0,0|2,0,0]=3 46 B10R1.2 COC1=C(Br)C(Cl)=CC=C1 MC41311 [1,0,0,0,0,0|2,0,0]=3 47 B10R1.2 COC1=C(Br)C(Cl)=NC=C1 CS17952 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.2 COC1=C(Br)C(F)=CC=C1 MC429428 [1,0,0,0,0,0|2,0,0]=3 49 B10R1.2 COC1=C(Br)C(I)=CC=C1 MC41319 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.2 COC1=C(C)C(C)=CC=C1 MC20206 [1,0,0,0,0,0|1,0,0]=2 51 B10R1.2 COC1=C(C)C(Cl)=CC=C1 MC20115 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.2 COC1=C(F)C(Br)=CC=C1 MC20208 [1,0,0,0,0,0|2,0,0]=3 53 B10R1.2 COC1=C(F)C(Br)=NC=C1 MC432157 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.2 COC1=C(I)C(F)=CC=C1 MC433387 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.2 COC1=C(I)C(N)=CC=C1 MC433348 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.2 COC1=C(N)C(Br)=NC=C1 CS14869 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.2 COC1=C(N)C(C)=CC=C1 MC427399 [1,0,0,0,0,0|1,0,0]=2 58 B10R1.2 COC1=C(N)C(N)=CC=C1 CS12559 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.2 COC1=CC=CC(Br)=C1C MC442371 [1,0,0,0,0,0|2,0,0]=3 60 B10R1.2 COC1=CC=CC(Br)=C1I CS14393 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.2 COC1=CC=CC(Br)=C1O MC442834 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.2 COC1=CC=CC(Cl)=C1N CS16113 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.2 COC1=CC=CC(Cl)=C1O MC441233 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.2 COC1=CC=CC(F)=C1F CS21031 [1,0,0,0,0,0|2,0,0]=3 65 B10R1.2 COC1=CC=CC(F)=C1N CS21557 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.2 COC1=CC=CC(F)=C1O MC433388 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.2 COC1=CC=CC(I)=C1C MC442370 [1,0,0,0,0,0|2,0,0]=3 68 B10R1.2 COC1=CC=CC(N)=C1Br CS21335 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.2 COC1=CC=CC(N)=C1C CS10556 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.2 COC1=CC=CC(N)=C1Cl CS18618 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.2 COC1=CC=CC(N)=C1Cl MC428124 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.2 COC1=CC=CC(N)=C1F CS12736 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.2 COC1=CC=CC(N)=C1O CS17187 [1,0,0,0,0,0|1,0,0]=2 74 B10R1.2 COC1=CC=CC(N)=C1O MC121305 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.2 COC1=CC=CC(O)=C1Br MC443182 [1,0,0,0,0,0|1,0,0]=2 76 B10R1.2 COC1=CC=CC(O)=C1Cl CS21434 [1,0,0,0,0,0|1,0,0]=2 77 B10R1.2 COC1=CC=CC(O)=C1F MC442393 [1,0,0,0,0,0|1,0,0]=2 78 B10R1.2 COC1=CC=CC(O)=C1I MC111957 [1,0,0,0,0,0|1,0,0]=2 79 B10R1.2 COC1=CC=CC(O)=C1N CS16742 [1,0,0,0,0,0|1,0,0]=2 80 B10R1.2 COC1=CN=CC(Cl)=C1N MC431893 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.2 COC1=CN=CC(F)=C1Br MC429481 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.2 COC1=CN=CC(F)=C1Cl MC429483 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.2 COC1=NC=CC(Br)=C1C MC427103 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.2 COC1=NC=CC(C)=C1Br MC433060 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.2 COC1=NC=CC(C)=C1N MC425798 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.2 COC1=NC=CC(N)=C1N MC427324 [1,0,0,0,0,0|3,0,0]=4 87 B10R1.2 COC1=NC=CC(O)=C1Cl MC432620 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.2 COC1=NC=NC(C)=C1Br MC425701 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 MC20573 [1,0,0,0,0,0|2,1,0]=4 90 B10R1.2 N#CC1=C(F)C(O)=CC=C1 MC441230 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.2 N#CC1=C(O)C(Br)=CC=C1 MC442373 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.2 N#CC1=C(O)C(Cl)=CC=C1 MC441234 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.2 N#CC1=C(O)C(F)=CC=C1 MC40658 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.2 N#CC1=C(O)C(N)=CC=C1 MC442219 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.2 N#CC1=C(O)C(O)=CC=C1 MC441227 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.2 N#Cc1cccc(O)c1Br MC433745 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 CS13249 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.2 O=CC1=C(F)C(O)=CC=C1 MC441017 [1,0,0,0,0,0|3,0,0]=4 99 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 CS20079 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 MC20676 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.2 O=CC1=C(O)C(F)=CC=C1 CS20128 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.2 O=CC1=C(O)C(I)=CC=C1 MC442738 [1,0,0,0,0,0|3,0,0]=4 103 B10R1.2 O=CC1=C(O)C(O)=CC=C1 CS21044 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.172 CCC1=CC=CC(C#N)=C1 MC433775 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.172 CCC1=CC=CC(C=O)=C1 CS11688 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.172 CNC1=CC=CC(CO)=C1 MC115827 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.172 CNC1=CC=CC(NC)=C1 MC40949 [1,0,0,0,0,0|2,0,0]=3 108 B10R1.172 COC1=CC(C#N)=NC=C1 MC425709 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.172 COC1=CC(C=O)=NC=C1 MC425477 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.172 COC1=CC(CN)=NC=C1 CS12102 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.172 COC1=CC(CN)=NC=C1 MC443540 [1,0,0,0,0,0|3,0,0]=4 112 B10R1.172 COC1=CC(CO)=NC=C1 MC31070 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.172 COC1=CC(OC)=NC=C1 CS18092 [1,0,0,0,0,0|1,0,0]=2 114 B10R1.172 COC1=CC=CC(C#N)=N1 MC425417 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.172 COC1=CC=CC(C=O)=C1 CS19170 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.172 COC1=CC=CC(C=O)=N1 CS20321 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.172 COC1=CC=CC(CCl)=C1 MC10324 [1,0,0,0,0,0|2,0,0]=3 118 B10R1.172 COC1=CC=CC(CCl)=N1 CS16831 [1,0,0,0,0,0|3,0,0]=4 119 B10R1.172 COC1=CC=CC(CN)=C1 CS19097 [1,0,0,0,0,0|2,0,0]=3 120 B10R1.172 COC1=CC=CC(CO)=C1 CS19269 [1,0,0,0,0,0|2,0,0]=3 121 B10R1.172 COC1=CC=CC(NN)=C1 CS19580 [1,0,0,0,0,0|2,0,0]=3 122 B10R1.172 COC1=CC=CC(OC)=C1 CS19845 [1,0,0,0,0,0|0,0,0]=1 123 B10R1.172 COC1=CC=CC(OC)=N1 MC433065 [1,0,0,0,0,0|1,0,0]=2 124 B10R1.172 COC1=CN=CC(C#N)=C1 MC425494 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.172 COC1=CN=CC(C=O)=C1 CS17827 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.172 COC1=CN=CC(OC)=C1 CS17332 [1,0,0,0,0,0|1,0,0]=2 127 B10R1.172 COC1=CN=CC(OC)=N1 MC425619 [1,0,0,0,0,0|2,0,0]=3 128 B10R1.172 COC1=NC(OC)=NC=C1 CS19530 [1,0,0,0,0,0|2,0,0]=3 129 B10R1.172 COC1=NC=CC(C#N)=C1 CS22801 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.172 COC1=NC=CC(C=O)=C1 CS15775 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.172 COC1=NC=CC(CN)=C1 CS16830 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.172 COC1=NC=CC(CO)=C1 CS12823 [1,0,0,0,0,0|3,0,0]=4 133 B12R1.235 CCC1=CC(Br)=CC(CC)=C1I MC41553 [0,1,0,0,0,0|3,0,0]=4 134 B12R1.235 CCC1=CC(C)=CC(CC)=C1Br CS16480 [0,1,0,0,0,0|3,0,0]=4 135 B12R1.235 COC1=CC(Br)=CC(C#N)=C1O MC106989 [0,1,0,0,0,0|2,0,0]=3 136 B12R1.235 COC1=CC(Br)=CC(C=O)=C1O MC41093 [0,1,0,0,0,0|2,0,0]=3 137 B12R1.235 COC1=CC(C)=CC(OC)=C1O MC41185 [0,1,0,0,0,0|0,0,0]=1 138 B12R1.235 COC1=CC(F)=CC(OC)=C1F MC110053 [0,1,0,0,0,0|1,0,0]=2 139 B12R1.280 C=CCC1=C(O)C(OC)=CC=C1 MC112509 [0,1,0,0,0,0|1,0,1]=3 140 B12R1.440 CC(=O)C1=CC=CC(C#N)=C1O MC442490 [0,1,0,0,0,0|3,0,0]=4 141 B12R1.440 CC(C)C1=CC=CC(C=O)=C1O MC442347 [0,1,0,0,0,0|3,0,0]=4 142 B12R1.440 CCC1=CC=CC(B(O)O)=C1O MC442029 [0,1,0,0,0,0|3,0,0]=4 143 B12R1.440 COC1=C(Br)C([N+](=O)[O-])=CC=C1 CS20185 [0,1,0,0,0,0|3,0,0]=4 144 B12R1.440 COC1=C(C)C([N+](=O)[O-])=CC=C1 CS21011 [0,1,0,0,0,0|3,0,0]=4 145 B12R1.440 COC1=C(Cl)C([N+](=O)[O-])=CC=C1 CS10965 [0,1,0,0,0,0|3,0,0]=4 146 B12R1.440 COC1=C(N)C([N+](=O)[O-])=CC=C1 CS21647 [0,1,0,0,0,0|3,0,0]=4 147 B12R1.440 COC1=C(O)C([N+](=O)[O-])=CC=C1 CS17036 [0,1,0,0,0,0|2,0,0]=3 148 B12R1.440 COC1=CC=CC(B(O)O)=C1Cl CS17540 [0,1,0,0,0,0|3,0,0]=4 149 B12R1.440 COC1=CC=CC(B(O)O)=C1F MC31127 [0,1,0,0,0,0|3,0,0]=4 150 B12R1.440 COC1=CC=CC(B(O)O)=C1O MC442853 [0,1,0,0,0,0|2,0,0]=3 151 B12R1.440 COC1=CC=CC(C(=O)O)=C1C CS21110 [0,1,0,0,0,0|3,0,0]=4 152 B12R1.440 COC1=CC=CC(C(=O)O)=C1Cl CS21433 [0,1,0,0,0,0|3,0,0]=4 153 B12R1.440 COC1=CC=CC(C(=O)O)=C1F CS13642 [0,1,0,0,0,0|3,0,0]=4 154 B12R1.440 COC1=CC=CC(C(=O)O)=C1N CS21008 [0,1,0,0,0,0|3,0,0]=4 155 B12R1.440 COC1=CC=CC(C(=O)O)=C1O CS20952 [0,1,0,0,0,0|2,0,0]=3 156 B12R1.440 COC1=CC=CC(C(C)=O)=C1O MC103731 [0,1,0,0,0,0|1,0,0]=2 157 B12R1.654 COC1=C(F)C=CC(C#N)=C1F MC433769 [0,1,0,0,0,0|3,0,0]=4 158 B12R1.654 COC1=CC=C(Br)C(C=O)=C1O MC41094 [0,1,0,0,0,0|2,0,0]=3 159 B12R1.654 COC1=CC=C(F)C(C#N)=C1Cl MC432348 [0,1,0,0,0,0|3,0,0]=4 160 B12R1.1879 COC1=CC=CC(C#N)=C1OC MC433772 [0,1,0,0,0,0|2,0,0]=3 161 B12R1.1879 COC1=CC=CC(C=O)=C1OC CS19374 [0,1,0,0,0,0|2,0,0]=3 162 B12R1.1879 COC1=CC=CC(OC)=C1C=O MC442704 [0,1,0,0,0,0|0,0,1]=2 163 B12R1.1879 COC1=CC=CC(OC)=C1OC CS20476 [0,1,0,0,0,0|0,0,0]=1 164 B12R1.1879 COC1=CN=CC(OC)=C1C=O MC441206 [0,1,0,0,0,0|1,0,1]=3 165 B12R1.1879 COC1=NC=NC(OC)=C1C=O MC441131 [0,1,0,0,0,0|2,0,1]=4 166 B12R1.1879 COC1=NC=NC(OC)=C1CN CS13231 [0,1,0,0,0,0|3,0,0]=4 167 B12R2.315 BrCC1=CC=CC2=C1OCO2 CS15539 [0,0,0,1,0,0|2,0,0]=3 168 B12R2.315 COC1=C2C=CNC2=CC=C1 CS21717 [0,0,0,1,0,0|2,0,1]=4 169 B12R2.315 COC1=C2C=NNC2=CC=C1 MC102407 [0,0,0,1,0,0|3,0,0]=4 170 B12R2.315 COC1=C2CNCC2=CC=C1 CS17395 [0,0,0,1,0,0|3,0,0]=4 171 B12R2.315 COC1=C2CNCC2=CC=C1 MC107634 [0,0,0,1,0,0|3,0,0]=4 172 B12R2.315 COC1=C2OC=CC2=CC=N1 MC104057 [0,0,0,1,0,0|2,0,1]=4 173 B12R2.315 COC1=CC=CC2=C1OC=C2 CS21625 [0,0,0,1,0,0|1,0,1]=3 174 B12R2.315 N#CC1=CC=CC2=C1OCO2 MC442705 [0,0,0,1,0,0|2,0,0]=3 175 B12R2.315 O=CC1=CC=CC2=C1OCC2 MC442782 [0,0,0,1,0,0|3,0,0]=4 176 B9R1.2 C#CC1=CC=CC(O)=C1 CS22325 [2,0,0,0,0,0|1,0,1]=4 177 B9R1.2 C=NC1=CC(C)=CC=C1 MC111025 [2,0,0,0,0,0|1,0,1]=4 178 B9R1.2 CC1=CC(CN)=CC=C1 CS19644 [2,0,0,0,0,0|2,0,0]=4 179 B9R1.2 CC1=CC(NN)=CC=C1 CS19574 [2,0,0,0,0,0|2,0,0]=4 180 B9R1.2 CC1=CC=CC(C#N)=C1 CS19778 [2,0,0,0,0,0|2,0,0]=4 181 B9R1.2 CC1=CC=CC(C=O)=C1 MC41127 [2,0,0,0,0,0|2,0,0]=4 182 B9R1.2 CC1=CC=CC(CCl)=C1 MC40602 [2,0,0,0,0,0|2,0,0]=4 183 B9R1.2 CC1=CC=CC(CF)=C1 MC433869 [2,0,0,0,0,0|2,0,0]=4 184 B9R1.2 CCC1=CC=CC(Br)=C1 MC30292 [2,0,0,0,0,0|2,0,0]=4 185 B9R1.2 CCC1=CC=CC(C)=C1 MC425590 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.2 CCC1=CC=CC(N)=C1 MC433319 [2,0,0,0,0,0|2,0,0]=4 187 B9R1.2 CNC1=CC(Br)=CC=C1 CS22185 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.2 CNC1=CC(Br)=CC=C1 MC40876 [2,0,0,0,0,0|2,0,0]=4 189 B9R1.2 CNC1=CC(Cl)=CC=C1 MC20486 [2,0,0,0,0,0|2,0,0]=4 190 B9R1.2 CNC1=CC(N)=CC=C1 CS16640 [2,0,0,0,0,0|2,0,0]=4 191 B9R1.2 CNC1=CC=CC(O)=C1 MC442233 [2,0,0,0,0,0|1,0,0]=3 192 B9R1.2 COC1=CC(=O)NC=C1 CS12334 [2,0,0,0,0,0|1,0,1]=4 193 B9R1.2 COC1=CC(Br)=NC=C1 CS16230 [2,0,0,0,0,0|2,0,0]=4 194 B9R1.2 COC1=CC(Cl)=NC=C1 CS19311 [2,0,0,0,0,0|2,0,0]=4 195 B9R1.2 COC1=CC(F)=NC=C1 CS14826 [2,0,0,0,0,0|2,0,0]=4 196 B9R1.2 COC1=CC(N)=NC=C1 CS19522 [2,0,0,0,0,0|2,0,0]=4 197 B9R1.2 COC1=CC=CC(Br)=N1 CS14301 [2,0,0,0,0,0|2,0,0]=4 198 B9R1.2 COC1=CC=CC(Cl)=C1 CS19894 [2,0,0,0,0,0|1,0,0]=3 199 B9R1.2 COC1=CC=CC(Cl)=N1 CS13826 [2,0,0,0,0,0|2,0,0]=4 200 B9R1.2 COC1=CC=CC(F)=C1 CS19929 [2,0,0,0,0,0|1,0,0]=3 201 B9R1.2 COC1=CC=CC(F)=N1 CS13652 [2,0,0,0,0,0|2,0,0]=4 202 B9R1.2 COC1=CC=CC(I)=N1 CS18075 [2,0,0,0,0,0|2,0,0]=4 203 B9R1.2 COC1=CC=CC(N)=C1 CS19943 [2,0,0,0,0,0|1,0,0]=3 204 B9R1.2 COC1=CC=CC(N)=N1 CS13845 [2,0,0,0,0,0|2,0,0]=4 205 B9R1.2 COC1=CC=CC(O)=C1 CS18747 [2,0,0,0,0,0|0,0,0]=2 206 B9R1.2 COC1=CC=CC(O)=N1 MC428307 [2,0,0,0,0,0|1,0,0]=3 207 B9R1.2 COC1=CC=C[N+]([O-])=C1 CS22349 [2,0,0,0,0,0|1,0,1]=4 208 B9R1.2 COC1=CN=CC(Br)=C1 MC427397 [2,0,0,0,0,0|2,0,0]=4 209 B9R1.2 COC1=CN=CC(N)=C1 CS19973 [2,0,0,0,0,0|2,0,0]=4 210 B9R1.2 COC1=CN=CC(O)=C1 CS17819 [2,0,0,0,0,0|1,0,0]=3 211 B9R1.2 COC1=NC(C)=CC=C1 CS15396 [2,0,0,0,0,0|1,0,0]=3 212 B9R1.2 COC1=NC(C)=NC=C1 CS11919 [2,0,0,0,0,0|2,0,0]=4 213 B9R1.2 COC1=NC=CC(Br)=C1 CS22650 [2,0,0,0,0,0|2,0,0]=4 214 B9R1.2 COC1=NC=CC(C)=C1 CS21637 [2,0,0,0,0,0|1,0,0]=3 215 B9R1.2 COC1=NC=CC(Cl)=C1 CS19313 [2,0,0,0,0,0|2,0,0]=4 216 B9R1.2 COC1=NC=CC(F)=C1 CS11908 [2,0,0,0,0,0|2,0,0]=4 217 B9R1.2 COC1=NC=CC(I)=C1 CS19594 [2,0,0,0,0,0|2,0,0]=4 218 B9R1.2 COC1=NC=CC(N)=C1 CS19525 [2,0,0,0,0,0|2,0,0]=4 219 B9R1.2 COC1=NC=CC(O)=C1 MC115931 [2,0,0,0,0,0|1,0,0]=3 220 B9R1.2 CSC1=CC(N)=CC=C1 MC20570 [2,0,0,0,0,0|1,1,0]=4 221 B9R1.2 N#CC1=CC(O)=CC=C1 CS19377 [2,0,0,0,0,0|2,0,0]=4 222 B9R1.2 O=CC1=CC(O)=CC=C1 MC20422 [2,0,0,0,0,0|2,0,0]=4 223 B9R1.2 OC1=CC(CBr)=CC=C1 MC425573 [2,0,0,0,0,0|2,0,0]=4 224 B9R1.2 OCC1=CC(O)=CC=C1 MC40720 [2,0,0,0,0,0|2,0,0]=4 225 B9R1.3 CC1=C(Br)C(Cl)=CC=C1 MC41498 [2,0,0,0,0,0|2,0,0]=4 226 B9R1.3 CC1=C(Br)C(F)=CC=C1 MC30071 [2,0,0,0,0,0|2,0,0]=4 227 B9R1.3 CC1=C(Br)C(O)=NC=C1 CS21575 [2,0,0,0,0,0|2,0,0]=4 228 B9R1.3 CC1=C(C)C(Br)=CC=C1 CS19738 [2,0,0,0,0,0|2,0,0]=4 229 B9R1.3 CC1=C(C)C(O)=NC=C1 MC431552 [2,0,0,0,0,0|2,0,0]=4 230 B9R1.3 CC1=C(F)C(Br)=CC=C1 MC30221 [2,0,0,0,0,0|2,0,0]=4 231 B9R1.3 CC1=C(I)C(Cl)=CC=C1 CS20195 [2,0,0,0,0,0|2,0,0]=4 232 B9R1.3 CC1=C(I)C(F)=CC=C1 CS20026 [2,0,0,0,0,0|2,0,0]=4 233 B9R1.3 CC1=C(N)C(N)=CC=C1 MC33098 [2,0,0,0,0,0|2,0,0]=4 234 B9R1.3 CC1=C(O)C(=O)C=CO1 MC21095 [2,0,0,0,0,0|1,0,1]=4 235 B9R1.3 CC1=C(O)C(Cl)=NC=C1 CS16152 [2,0,0,0,0,0|2,0,0]=4 236 B9R1.3 CC1=C(O)C(O)=CC=C1 MC30145 [2,0,0,0,0,0|0,0,0]=2 237 B9R1.3 CC1=C(O)C=CC=C1Br CS14415 [2,0,0,0,0,0|2,0,0]=4 238 B9R1.3 CC1=C(O)C=CC=C1Cl CS22210 [2,0,0,0,0,0|2,0,0]=4 239 B9R1.3 CC1=C(O)C=CC=C1F MC433104 [2,0,0,0,0,0|2,0,0]=4 240 B9R1.3 CC1=C(O)C=CC=C1O MC20744 [2,0,0,0,0,0|1,0,0]=3 241 B9R1.3 CC1=CC=CC(Br)=C1N CS10505 [2,0,0,0,0,0|2,0,0]=4 242 B9R1.3 CC1=CC=CC(Br)=C1O MC41161 [2,0,0,0,0,0|1,0,0]=3 243 B9R1.3 CC1=CC=CC(Br)=C1S MC111932 [2,0,0,0,0,0|1,1,0]=4 244 B9R1.3 CC1=CC=CC(C)=C1Br CS19952 [2,0,0,0,0,0|1,0,0]=3 245 B9R1.3 CC1=CC=CC(C)=C1Cl MC41533 [2,0,0,0,0,0|1,0,0]=3 246 B9R1.3 CC1=CC=CC(C)=C1I MC41542 [2,0,0,0,0,0|1,0,0]=3 247 B9R1.3 CC1=CC=CC(C)=C1N CS19754 [2,0,0,0,0,0|1,0,0]=3 248 B9R1.3 CC1=CC=CC(C)=C1O CS21185 [2,0,0,0,0,0|0,0,0]=2 249 B9R1.3 CC1=CC=CC(C)=[N+]1[O-] MC41613 [2,0,0,0,0,0|1,0,1]=4 250 B9R1.3 CC1=CC=CC(Cl)=C1C MC41535 [2,0,0,0,0,0|2,0,0]=4 251 B9R1.3 CC1=CC=CC(Cl)=C1F CS22205 [2,0,0,0,0,0|2,0,0]=4 252 B9R1.3 CC1=CC=CC(Cl)=C1N CS13397 [2,0,0,0,0,0|2,0,0]=4 253 B9R1.3 CC1=CC=CC(F)=C1C MC30143 [2,0,0,0,0,0|2,0,0]=4 254 B9R1.3 CC1=CC=CC(F)=C1F CS19914 [2,0,0,0,0,0|2,0,0]=4 255 B9R1.3 CC1=CC=CC(F)=C1N CS10511 [2,0,0,0,0,0|2,0,0]=4 256 B9R1.3 CC1=CC=CC(F)=C1O MC433389 [2,0,0,0,0,0|1,0,0]=3 257 B9R1.3 CC1=CC=CC(N)=C1Br CS12669 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.3 CC1=CC=CC(N)=C1C MC40904 [2,0,0,0,0,0|2,0,0]=4 259 B9R1.3 CC1=CC=CC(N)=C1F MC433020 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.3 CC1=CC=CC(N)=C1O CS13842 [2,0,0,0,0,0|1,0,0]=3 261 B9R1.3 CC1=CC=CC(O)=C1C MC41190 [2,0,0,0,0,0|1,0,0]=3 262 B9R1.3 CC1=CC=CC(O)=C1Cl MC443764 [2,0,0,0,0,0|1,0,0]=3 263 B9R1.3 CC1=CC=CC(O)=C1F MC20207 [2,0,0,0,0,0|1,0,0]=3 264 B9R1.3 CC1=CC=CC(O)=C1I MC442299 [2,0,0,0,0,0|1,0,0]=3 265 B9R1.3 CC1=CC=CC(O)=C1N CS14085 [2,0,0,0,0,0|1,0,0]=3 266 B9R1.3 CC1=CC=CC(S)=C1C MC20384 [2,0,0,0,0,0|1,1,0]=4 267 B9R1.3 CC1=NC=CC(C)=C1O MC430625 [2,0,0,0,0,0|1,0,0]=3 268 B9R1.3 NC1=C(O)C(Br)=CC=C1 CS14079 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.3 NC1=C(O)C(Cl)=CC=C1 CS13388 [2,0,0,0,0,0|2,0,0]=4 270 B9R1.3 NC1=C(O)C(F)=CC=C1 CS10703 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.3 NC1=C(O)C=CC=C1Br CS12191 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.3 NC1=C(O)C=CC=C1Cl MC442092 [2,0,0,0,0,0|2,0,0]=4 273 B9R1.3 NC1=C(O)C=CC=C1F CS13672 [2,0,0,0,0,0|2,0,0]=4 274 B9R1.3 NC1=C(O)C=CC=C1O CS21312 [2,0,0,0,0,0|1,0,0]=3 275 B9R1.3 NC1=CC=CC(O)=C1Br CS15538 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.3 OC1=C(Br)C(Br)=CC=C1 MC433375 [2,0,0,0,0,0|2,0,0]=4 277 B9R1.3 OC1=C(Br)C(Cl)=CC=C1 CS21337 [2,0,0,0,0,0|2,0,0]=4 278 B9R1.3 OC1=C(Br)C(F)=CC=C1 MC433102 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.3 OC1=C(Br)C(I)=CC=C1 MC115196 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.3 OC1=C(Br)C=CC=C1Br CS15261 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.3 OC1=C(Br)C=CC=C1Cl CS15849 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.3 OC1=C(Br)C=CC=C1F CS22904 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.3 OC1=C(Br)C=CC=C1I MC441065 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.3 OC1=C(Cl)C(Br)=CC=C1 CS19373 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 CS21020 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.3 OC1=C(Cl)C(F)=CC=C1 CS21431 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.3 OC1=C(Cl)C=CC=C1Cl CS21171 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.3 OC1=C(Cl)C=CC=C1F CS18835 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.3 OC1=C(Cl)C=CC=C1I MC441025 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.3 OC1=C(F)C(Br)=CC=C1 MC433356 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.3 OC1=C(F)C(Cl)=CC=C1 CS22204 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.3 OC1=C(F)C(F)=CC=C1 CS18870 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.3 OC1=C(F)C(I)=CC=C1 MC442102 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.3 OC1=C(F)C=CC=C1F CS18872 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.3 OC1=C(I)C(Br)=CC=C1 MC433359 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.3 OC1=C(I)C(Cl)=CC=C1 MC433367 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.3 OC1=C(I)C(F)=CC=C1 MC442381 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.3 OC1=CC=CC(Br)=C1O MC442826 [2,0,0,0,0,0|1,0,0]=3 299 B9R1.3 OC1=CC=CC(Cl)=C1O MC441225 [2,0,0,0,0,0|1,0,0]=3 300 B9R1.3 OC1=CC=CC(F)=C1O MC20210 [2,0,0,0,0,0|1,0,0]=3 301 B9R1.3 OC1=CC=CC(I)=C1O MC114532 [2,0,0,0,0,0|1,0,0]=3 302 B9R1.3 OC1=CC=CC(O)=C1Br MC443180 [2,0,0,0,0,0|1,0,0]=3 303 B9R1.3 OC1=CC=CC(O)=C1Cl CS19075 [2,0,0,0,0,0|1,0,0]=3 304 B9R1.3 OC1=CC=CC(O)=C1F MC433390 [2,0,0,0,0,0|1,0,0]=3 305 B9R1.3 OC1=CC=CC(O)=C1I MC443433 [2,0,0,0,0,0|1,0,0]=3 306 B9R1.3 OC1=CC=CC(O)=C1O MC427034 [2,0,0,0,0,0|0,0,0]=2 307 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [2,0,0,0,0,0|1,0,1]=4 308 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.15 CNC1=CC=CC=C1N CS22302 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [2,0,0,0,0,0|1,0,0]=3 315 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [2,0,0,0,0,0|2,0,0]=4 316 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [2,0,0,0,0,0|1,0,0]=3 321 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [2,0,0,0,0,0|1,0,0]=3 323 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [2,0,0,0,0,0|1,0,0]=3 326 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [2,0,0,0,0,0|2,0,0]=4 328 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [2,0,0,0,0,0|0,0,0]=2 329 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [2,0,0,0,0,0|1,0,0]=3 330 B9R1.15 COC1=CC=CN=C1Br CS19255 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.15 COC1=CC=CN=C1Cl CS19305 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.15 COC1=CC=CN=C1F CS13044 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.15 COC1=CC=CN=C1N CS17216 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.15 COC1=CN=CN=C1O MC432213 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.15 COC1=NC=CC=C1Br CS19258 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.15 COC1=NC=CC=C1C MC33438 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.15 COC1=NC=CC=C1Cl CS18705 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.15 COC1=NC=CC=C1F CS19564 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.15 COC1=NC=CC=C1I CS13512 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.15 COC1=NC=CC=C1N CS19526 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [2,0,0,0,0,0|1,1,0]=4 342 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.8 CC1=CC(Br)=CC(C#N)=C1O CS17330 [1,1,0,0,0,0|2,0,0]=4 347 B11R1.8 COC1=C(Br)C(Br)=CC(F)=C1 MC108803 [1,1,0,0,0,0|2,0,0]=4 348 B11R1.8 COC1=C(C)C(F)=CC(F)=C1 MC110200 [1,1,0,0,0,0|2,0,0]=4 349 B11R1.8 COC1=C(Cl)C(Cl)=CC(C)=C1 MC109834 [1,1,0,0,0,0|2,0,0]=4 350 B11R1.8 COC1=C(Cl)C(Cl)=CC(F)=C1 MC109586 [1,1,0,0,0,0|2,0,0]=4 351 B11R1.8 COC1=C(Cl)C(F)=CC(Cl)=C1 MC109589 [1,1,0,0,0,0|2,0,0]=4 352 B11R1.8 COC1=C(F)C(Br)=CC(Br)=C1 MC108806 [1,1,0,0,0,0|2,0,0]=4 353 B11R1.8 COC1=C(F)C(C)=CC(F)=C1 MC110198 [1,1,0,0,0,0|1,0,0]=3 354 B11R1.8 COC1=C(F)C(Cl)=CC(Cl)=C1 MC109594 [1,1,0,0,0,0|2,0,0]=4 355 B11R1.8 COC1=C(F)C(F)=CC(C)=C1 MC110195 [1,1,0,0,0,0|2,0,0]=4 356 B11R1.8 COC1=C(N)C(C)=CC(Br)=C1 MC427328 [1,1,0,0,0,0|1,0,0]=3 357 B11R1.8 COC1=CC(Br)=CC(F)=C1Cl MC106980 [1,1,0,0,0,0|2,0,0]=4 358 B11R1.8 COC1=CC(Br)=CC(F)=C1F CS10250 [1,1,0,0,0,0|2,0,0]=4 359 B11R1.8 COC1=CC(Br)=CC(F)=C1N MC106979 [1,1,0,0,0,0|2,0,0]=4 360 B11R1.8 CSC1=C(Cl)C(C)=CC(Cl)=C1 MC109979 [1,1,0,0,0,0|1,1,0]=4 361 B11R1.13 CCOc1cccc(F)c1F MC433141 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.72 CC1=CC=C(C)C(C=O)=C1O CS12222 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.72 COC1=C(Br)C(Br)=CC=C1F MC108804 [1,1,0,0,0,0|2,0,0]=4 364 B11R1.72 COC1=C(Br)C(F)=CC=C1Br MC108805 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.72 COC1=C(Br)C=CC(F)=C1C MC430319 [1,1,0,0,0,0|2,0,0]=4 366 B11R1.72 COC1=C(Br)C=CC(F)=C1F MC443197 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.72 COC1=C(Cl)C(F)=CC=C1Cl MC109591 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.72 COC1=C(F)C(Br)=CC=C1F MC30186 [1,1,0,0,0,0|2,0,0]=4 369 B11R1.72 COC1=C(F)C(Cl)=CC=C1Cl MC109596 [1,1,0,0,0,0|2,0,0]=4 370 B11R1.72 COC1=C(F)C(F)=CC=C1C MC110196 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.72 COC1=C(F)C(F)=CC=C1N MC433343 [1,1,0,0,0,0|2,0,0]=4 372 B11R1.72 COC1=C(O)C(F)=CC=C1Br MC442753 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 MC33077 [1,1,0,0,0,0|2,0,0]=4 374 B11R1.159 CC(=O)C1=C(F)C(O)=CC=C1 MC442382 [1,1,0,0,0,0|2,0,0]=4 375 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 CS20991 [1,1,0,0,0,0|2,0,0]=4 376 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 CS20407 [1,1,0,0,0,0|2,0,0]=4 377 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 CS13325 [1,1,0,0,0,0|1,0,0]=3 378 B11R1.159 CC(=O)C1=C(O)C(Cl)=CC=C1 CS10781 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 CS15701 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 CS20939 [1,1,0,0,0,0|1,0,0]=3 381 B11R1.159 CC(C)C1=C(O)C(O)=CC=C1 MC443613 [1,1,0,0,0,0|1,0,0]=3 382 B11R1.159 CC(C)C1=CC=CC(Br)=C1O MC442830 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.159 CC(C)C1=CC=CC(Cl)=C1O MC441235 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.159 CC(C)C1=CC=CC(O)=C1F MC442499 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.159 CC1=CC=CC(B(O)O)=C1O MC442851 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.159 CC1=CC=CC(C(=O)O)=C1O CS16085 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.159 CC1=CC=CC(C(C)C)=C1N MC428273 [1,1,0,0,0,0|2,0,0]=4 388 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1O CS10495 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 MC20146 [1,1,0,0,0,0|2,0,0]=4 390 B11R1.265 CCC1=C(C#N)C(O)=CC=C1 MC442500 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.265 CCC1=C(NN)C(C)=CC=C1 MC430937 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.265 COC1=C(C#N)C(C)=CC=C1 CS14397 [1,1,0,0,0,0|1,0,0]=3 393 B11R1.265 COC1=C(C#N)C=CC=C1O MC40663 [1,1,0,0,0,0|2,0,0]=4 394 B11R1.265 COC1=C(C=O)C(C)=CC=C1 CS21645 [1,1,0,0,0,0|0,0,1]=3 395 B11R1.265 COC1=C(C=O)C=CC=C1C CS15730 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.265 COC1=C(C=O)C=CC=C1O MC425754 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.265 COC1=CC=CC(Br)=C1C#N CS16021 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.265 COC1=CC=CC(Br)=C1C=O MC427142 [1,1,0,0,0,0|1,0,1]=4 399 B11R1.265 COC1=CC=CC(Br)=C1OC CS14821 [1,1,0,0,0,0|1,0,0]=3 400 B11R1.265 COC1=CC=CC(Cl)=C1C#N CS21481 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.265 COC1=CC=CC(Cl)=C1C=O CS17258 [1,1,0,0,0,0|1,0,1]=4 402 B11R1.265 COC1=CC=CC(Cl)=C1CBr MC107653 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.265 COC1=CC=CC(Cl)=C1CN MC107632 [1,1,0,0,0,0|2,0,0]=4 404 B11R1.265 COC1=CC=CC(F)=C1C#N CS10752 [1,1,0,0,0,0|2,0,0]=4 405 B11R1.265 COC1=CC=CC(F)=C1C=O CS20843 [1,1,0,0,0,0|1,0,1]=4 406 B11R1.265 COC1=CC=CC(F)=C1CN CS20435 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.265 COC1=CC=CC(F)=C1OC MC433523 [1,1,0,0,0,0|1,0,0]=3 408 B11R1.265 COC1=CC=CC(O)=C1C=O MC442703 [1,1,0,0,0,0|0,0,1]=3 409 B11R1.265 COC1=CC=CC(O)=C1OC CS21046 [1,1,0,0,0,0|0,0,0]=2 410 B11R1.265 COC1=CC=NC(C)=C1C#N MC427559 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.278 CC1=C(O)C=CC(C=O)=C1O CS15354 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.278 CNC1=CC=C(Br)C(C)=C1N MC111686 [1,1,0,0,0,0|2,0,0]=4 413 B11R1.278 COC1=C(Br)C(F)=C(F)C=C1 MC433353 [1,1,0,0,0,0|2,0,0]=4 414 B11R1.278 COC1=C(C)C(C)=C(Br)C=C1 MC41316 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.278 COC1=C(C)C(C)=C(I)C=C1 CS20738 [1,1,0,0,0,0|1,0,0]=3 416 B11R1.278 COC1=C(Cl)C(C)=C(F)C=C1 MC432566 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.278 COC1=C(Cl)C(F)=C(Cl)C=C1 MC109587 [1,1,0,0,0,0|2,0,0]=4 418 B11R1.278 COC1=C(F)C(C)=C(F)C=C1 MC110197 [1,1,0,0,0,0|1,0,0]=3 419 B11R1.278 COC1=C(F)C(Cl)=C(Cl)C=C1 MC109592 [1,1,0,0,0,0|2,0,0]=4 420 B11R1.278 COC1=C(F)C(F)=C(Br)C=C1 MC433354 [1,1,0,0,0,0|2,0,0]=4 421 B11R1.278 COC1=C(F)C(F)=C(F)C=C1 MC433400 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.278 COC1=CC=C(Cl)C(N)=C1Br MC30088 [1,1,0,0,0,0|2,0,0]=4 423 B11R1.278 O=CC1=C(O)C(O)=C(O)C=C1 CS20987 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.9 CCC1=CC(Br)=CC(CC)=C1 MC30248 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.9 CCC1=CC(OC)=CC(=O)O1 MC106605 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.9 COC1=CC(Br)=CC(OC)=C1 CS19874 [1,1,0,0,0,0|0,0,0]=2 427 B11R1.9 COC1=CC(C#N)=CC(Br)=C1 CS22161 [1,1,0,0,0,0|2,0,0]=4 428 B11R1.9 COC1=CC(C#N)=CC(F)=C1 MC30261 [1,1,0,0,0,0|2,0,0]=4 429 B11R1.9 COC1=CC(C#N)=CC(N)=C1 CS16517 [1,1,0,0,0,0|2,0,0]=4 430 B11R1.9 COC1=CC(C)=CC(C#N)=C1 CS13219 [1,1,0,0,0,0|2,0,0]=4 431 B11R1.9 COC1=CC(C)=CC(C=O)=C1 MC433444 [1,1,0,0,0,0|2,0,0]=4 432 B11R1.9 COC1=CC(C)=CC(CO)=C1 CS17199 [1,1,0,0,0,0|2,0,0]=4 433 B11R1.9 COC1=CC(C)=CC(OC)=C1 MC20844 [1,1,0,0,0,0|0,0,0]=2 434 B11R1.9 COC1=CC(C=O)=CC(Cl)=C1 CS22225 [1,1,0,0,0,0|2,0,0]=4 435 B11R1.9 COC1=CC(C=O)=CC(F)=C1 CS10960 [1,1,0,0,0,0|2,0,0]=4 436 B11R1.9 COC1=CC(CBr)=CC(Cl)=C1 MC33329 [1,1,0,0,0,0|2,0,0]=4 437 B11R1.9 COC1=CC(CBr)=CC(F)=C1 CS19414 [1,1,0,0,0,0|2,0,0]=4 438 B11R1.9 COC1=CC(CO)=CC(F)=C1 MC40712 [1,1,0,0,0,0|2,0,0]=4 439 B11R1.9 COC1=CC(Cl)=CC(OC)=C1 CS20662 [1,1,0,0,0,0|0,0,0]=2 440 B11R1.9 COC1=CC(F)=CC(OC)=C1 MC30108 [1,1,0,0,0,0|0,0,0]=2 441 B11R1.9 COC1=CC(I)=CC(OC)=C1 CS15978 [1,1,0,0,0,0|0,0,0]=2 442 B11R1.9 COC1=CC(N)=CC(OC)=C1 CS20489 [1,1,0,0,0,0|0,0,0]=2 443 B11R1.9 COC1=CC(N)=NC(OC)=N1 CS19557 [1,1,0,0,0,0|2,0,0]=4 444 B11R1.9 COC1=CC(O)=CC(OC)=C1 MC442394 [1,1,0,0,0,0|0,0,0]=2 445 B11R1.9 COC1=CC(OC)=NC(Cl)=N1 CS19480 [1,1,0,0,0,0|2,0,0]=4 446 B11R1.9 COC1=CC(OC)=NC(N)=N1 CS21806 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.9 COC1=NC(OC)=NC(Cl)=C1 MC425724 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.189 C=CCC1=CC=CC(OC)=C1 MC425775 [1,1,0,0,0,0|1,0,1]=4 449 B11R1.189 CCOC1=CC=CC(C=O)=C1 MC433437 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.189 COC1=CC=CC(CC#N)=C1 CS11040 [1,1,0,0,0,0|1,0,1]=4 451 B11R1.189 COC1=CC=CC(CCN)=C1 CS13916 [1,1,0,0,0,0|1,0,0]=3 452 B11R1.189 COC1=CC=CC(CCO)=C1 CS22342 [1,1,0,0,0,0|1,0,0]=3 453 B11R1.189 COCC1=CC=CC(C#N)=C1 CS18233 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.189 COCC1=CC=CC(CN)=C1 CS15687 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.266 COC1=CC(C(C)=O)=NC=C1 MC442668 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.266 COC1=CC(C(C)N)=NC=C1 MC112203 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.266 COC1=CC(N(C)C)=CC=C1 MC445041 [1,1,0,0,0,0|1,0,0]=3 458 B11R1.266 COC1=CC=CC(B(O)O)=C1 CS20399 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.266 COC1=CC=CC(C(=N)N)=C1 CS18198 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.266 COC1=CC=CC(C(=O)Cl)=C1 MC40493 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.266 COC1=CC=CC(C(=O)O)=C1 MC40298 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.280 C=CC1=CC(OC)=C(O)C=C1 CS21640 [1,1,0,0,0,0|1,0,1]=4 463 B11R1.280 COC1=C(Br)C=CC(C#N)=C1 MC30328 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.280 COC1=C(Br)C=CC(CO)=C1 CS21375 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.280 COC1=C(C)C=CC(C#N)=C1 CS22338 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.280 COC1=C(C)C=CC(C=O)=C1 CS21938 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.280 COC1=C(C)C=CC(CN)=C1 MC111182 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 CS15135 [1,1,0,0,0,0|2,0,0]=4 469 B11R1.280 COC1=C(Cl)C=CC(CBr)=C1 MC40533 [1,1,0,0,0,0|2,0,0]=4 470 B11R1.280 COC1=C(Cl)C=CC(CN)=C1 MC40809 [1,1,0,0,0,0|2,0,0]=4 471 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 CS17422 [1,1,0,0,0,0|2,0,0]=4 472 B11R1.280 COC1=C(F)C=CC(C#N)=C1 MC30271 [1,1,0,0,0,0|2,0,0]=4 473 B11R1.280 COC1=C(F)C=CC(C=O)=C1 MC429581 [1,1,0,0,0,0|2,0,0]=4 474 B11R1.280 COC1=C(F)C=CC(CBr)=C1 MC429580 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.280 COC1=C(F)C=CC(CN)=C1 MC433899 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.280 COC1=C(F)C=CC(CO)=C1 MC40713 [1,1,0,0,0,0|2,0,0]=4 477 B11R1.280 COC1=C(N)C=CC(C#N)=C1 CS14461 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.280 COC1=C(O)C=CC(C#N)=C1 MC40664 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.280 COC1=C(O)C=CC(C=O)=C1 CS13553 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.280 COC1=C(O)C=CC(CN)=C1 CS22873 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.280 COC1=C(O)C=CC(CO)=C1 MC40721 [1,1,0,0,0,0|2,0,0]=4 482 B11R1.280 COC1=CC(C#N)=C(Br)C=C1 MC33046 [1,1,0,0,0,0|2,0,0]=4 483 B11R1.280 COC1=CC(C#N)=C(Cl)C=C1 MC433756 [1,1,0,0,0,0|2,0,0]=4 484 B11R1.280 COC1=CC(C#N)=C(F)C=C1 MC20170 [1,1,0,0,0,0|2,0,0]=4 485 B11R1.280 COC1=CC(C=O)=C(Br)C=C1 CS20806 [1,1,0,0,0,0|2,0,0]=4 486 B11R1.280 COC1=CC(C=O)=C(C)C=C1 MC433445 [1,1,0,0,0,0|2,0,0]=4 487 B11R1.280 COC1=CC(C=O)=C(Cl)C=C1 MC433417 [1,1,0,0,0,0|2,0,0]=4 488 B11R1.280 COC1=CC(C=O)=C(F)C=C1 MC30243 [1,1,0,0,0,0|2,0,0]=4 489 B11R1.280 COC1=CC(C=O)=C(O)C=C1 CS20949 [1,1,0,0,0,0|2,0,0]=4 490 B11R1.280 COC1=CC(CBr)=C(Br)C=C1 MC40524 [1,1,0,0,0,0|2,0,0]=4 491 B11R1.280 COC1=CC(NN)=C(F)C=C1 MC20004 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.280 COC1=CC(OC)=C(Br)C=C1 MC433149 [1,1,0,0,0,0|0,0,0]=2 493 B11R1.280 COC1=CC(OC)=C(O)C=C1 CS21112 [1,1,0,0,0,0|0,0,0]=2 494 B11R1.280 COC1=CC=C(N)C(OC)=N1 CS13926 [1,1,0,0,0,0|1,0,0]=3 495 B11R1.280 COC1=NC=C(Br)C(OC)=N1 CS15025 [1,1,0,0,0,0|2,0,0]=4 496 B11R1.280 COC1=NC=C(I)C(OC)=N1 CS19939 [1,1,0,0,0,0|2,0,0]=4 497 B11R1.280 COc1ccc(F)c(OC)c1 MC433522 [1,1,0,0,0,0|0,0,0]=2 498 B11R1.280 COc1ccc(N)c(C#N)c1 MC30209 [1,1,0,0,0,0|2,0,0]=4 499 B13R1.302 COC1=CC(Br)=CC(OC)=C1C=O MC31048 [0,2,0,0,0,0|0,0,1]=3 500 B13R1.302 COC1=CC(Br)=CC(OC)=C1OC CS19891 [0,2,0,0,0,0|0,0,0]=2 501 B13R1.302 COC1=CC(F)=CC(CO)=C1OC MC100419 [0,2,0,0,0,0|2,0,0]=4 502 B13R1.302 COC1=CC(N)=CC(OC)=C1OC CS21919 [0,2,0,0,0,0|0,0,0]=2 503 B13R1.302 COC1=CC(O)=CC(OC)=C1C=O CS21121 [0,2,0,0,0,0|0,0,1]=3 504 B13R1.433 COC1=CC(C=O)=CC(OC)=C1Br CS21665 [0,2,0,0,0,0|1,0,0]=3 505 B13R1.433 COC1=CC(C=O)=CC(OC)=C1O CS21131 [0,2,0,0,0,0|0,0,0]=2 506 B13R1.82 COC(=O)C1=C(O)C(OC)=CC=C1 CS21122 [0,2,0,0,0,0|0,0,0]=2 507 B13R1.569 COCOC1=CC=CC(OC)=C1I MC111958 [0,2,0,0,0,0|1,0,0]=3 508 B13R1.641 CSC1=C(Br)C(OC(F)F)=CC=C1 MC108555 [0,2,0,0,0,0|1,1,0]=4 509 B13R1.3911 CNCC1=C(OC)C(OC)=CC=C1 CS17118 [0,2,0,0,0,0|1,0,0]=3 510 B13R1.645 COC1=CC=CC(S(=O)(=O)Cl)=C1O MC111622 [0,2,0,0,0,0|1,1,0]=4 511 B13R1.2137 COC1=CC=CC(C(=O)O)=C1OC CS21118 [0,2,0,0,0,0|2,0,0]=4 512 B13R1.2137 COc1cccc(C(C)=O)c1OC MC433237 [0,2,0,0,0,0|1,0,0]=3 513 B13R1.2277 COC1=C(Br)C=CC(C=O)=C1OC MC443154 [0,2,0,0,0,0|2,0,0]=4 514 B13R1.2422 COC1=C(Cl)C(OC)=C(C=O)C=C1 MC443204 [0,2,0,0,0,0|1,0,0]=3 515 B13R1.2356 COC1=CC=CC(C#N)=C1B(O)O MC441430 [0,2,0,0,0,0|2,0,0]=4 516 B13R1.2356 COC1=CC=CC(OC)=C1B(O)O CS20473 [0,2,0,0,0,0|0,0,0]=2 517 B13R1.2356 COC1=CC=CC(OC)=C1C(=O)Cl MC433666 [0,2,0,0,0,0|0,0,1]=3 518 B13R1.2356 COC1=CC=CC(OC)=C1C(=O)O MC433665 [0,2,0,0,0,0|0,0,0]=2 519 B13R1.2356 COC1=CC=CC(OC)=C1C(C)=O MC443224 [0,2,0,0,0,0|0,0,1]=3 520 B13R1.2356 COC1=CN=CC(OC)=C1C(=O)O MC442079 [0,2,0,0,0,0|1,0,0]=3 521 B13R1.2356 COC1=NC=NC(OC)=C1B(O)O MC441955 [0,2,0,0,0,0|2,0,0]=4 522 B13R1.2356 COC1=NC=NC(OC)=C1C(=O)O MC442166 [0,2,0,0,0,0|2,0,0]=4 523 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS10928 [0,0,1,1,0,0|2,0,0]=4 524 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 CS10929 [0,0,1,1,0,0|2,0,0]=4 525 B11R2.106 BrC1=CC=CC2=C1OCC2 CS12983 [1,0,0,1,0,0|2,0,0]=4 526 B11R2.106 BrC1=CC=CC2=C1OCO2 CS22623 [1,0,0,1,0,0|1,0,0]=3 527 B11R2.106 CC1=C2CCNC2=CC=C1 MC425439 [1,0,0,1,0,0|2,0,0]=4 528 B11R2.106 CC1=C2NCCC2=CC=C1 CS18412 [1,0,0,1,0,0|2,0,0]=4 529 B11R2.106 CC1=CC=CC2=C1OC=C2 MC441162 [1,0,0,1,0,0|1,0,1]=4 530 B11R2.106 IC1=CC=CC2=C1OCO2 CS12923 [1,0,0,1,0,0|1,0,0]=3 531 B11R2.106 NC1=C2CCOC2=CC=C1 CS21040 [1,0,0,1,0,0|2,0,0]=4 532 B11R2.106 OC1=C2C=COC2=CC=C1 MC441157 [1,0,0,1,0,0|1,0,1]=4 533 B11R2.106 OC1=C2N=COC2=CC=C1 MC443775 [1,0,0,1,0,0|1,0,1]=4 534 B11R2.106 OC1=CC=CC2=C1CCC2 CS22898 [1,0,0,1,0,0|2,0,0]=4 535 B11R2.106 OC1=CC=CC2=C1OC=C2 MC441279 [1,0,0,1,0,0|1,0,1]=4 536 B13R2.623 COC1=CC(Br)=CC2=C1OC=C2 MC441286 [0,1,0,1,0,0|1,0,1]=4 537 B13R2.1613 BrCC1=CC=CC2=C1OCCO2 MC121295 [0,1,0,1,0,0|2,0,0]=4 538 B13R2.1613 COC1=C2CCCNC2=CC=C1 CS18951 [0,1,0,1,0,0|2,0,0]=4 539 B13R2.1613 COC1=C2CNCCC2=CC=C1 MC111163 [0,1,0,1,0,0|2,0,0]=4 540 B13R2.1613 COC1=C2NCCCC2=CC=C1 MC111965 [0,1,0,1,0,0|2,0,0]=4 541 B13R2.1613 NCC1=CC=CC2=C1OCCO2 CS21034 [0,1,0,1,0,0|2,0,0]=4 542 B13R2.1613 OCC1=CC=CC2=C1OCCO2 CS21033 [0,1,0,1,0,0|2,0,0]=4 543 B13R2.573 COC1=C2C=NN(C)C2=CC=C1 MC441198 [0,1,0,1,0,0|2,0,0]=4 544 B13R2.573 COC1=C2CCC(=O)C2=CC=C1 MC446697 [0,1,0,1,0,0|2,0,0]=4 545 B13R2.5569 O=C(Cl)C1=CC=CC2=C1OCO2 CS12132 [0,1,0,1,0,0|2,0,0]=4 546 B13R2.5569 OB(O)C1=CC=CC2=C1OCO2 MC442910 [0,1,0,1,0,0|2,0,0]=4 547 B13R2.121 O=CC1=C(Br)C=CC2=C1OCO2 MC431996 [0,1,0,1,0,0|2,0,0]=4 548 B13R2.611 COC1=CC=C(Br)C2=C1OC=C2 MC441287 [0,1,0,1,0,0|1,0,1]=4 549 B13R2.582 COC1=C2C(=O)CCC2=CC=C1 CS15531 [0,1,0,1,0,0|1,0,1]=4 550 B9R1.14 COC1=CSC=C1OC CS10119 [1,0,0,0,1,0|1,0,0]=3 551 B11R1.279 CNC1=CC=C(OC)C=C1N MC107631 [0,0,0,0,1,1|2,0,0]=4 552 B11R1.279 COC1=C(O)C=C(C#N)C=C1 CS14799 [0,0,0,0,1,1|2,0,0]=4 553 B11R1.279 COC1=C(O)C=C(C=O)C=C1 CS15324 [0,0,0,0,1,1|2,0,0]=4 554 B11R1.279 COC1=C(O)C=C(CO)C=C1 CS22314 [0,0,0,0,1,1|2,0,0]=4 555 B11R1.279 COC1=CC(F)=C(OC)C=C1 CS20541 [0,0,0,0,1,1|1,0,0]=3 556 B11R1.279 COC1=CC(N)=C(OC)C=C1 CS21148 [0,0,0,0,1,1|1,0,0]=3 557 B11R1.279 COC1=CC(O)=C(C#N)C=C1 CS14796 [0,0,0,0,1,1|2,0,0]=4 558 B11R1.279 COC1=CC(O)=C(C=O)C=C1 CS20937 [0,0,0,0,1,1|2,0,0]=4 559 B11R1.279 COC1=CC(O)=C(OC)C=C1 CS21149 [0,0,0,0,1,1|0,0,0]=2