0 B10R1.20 BrCC1=C(CBr)C=CC=C1 MC20537 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.20 C#CC1=C(OC)C=CC=C1 CS21618 [0,0,0,0,0,0|0,0,2]=2 2 B10R1.20 CCC1=C(C#N)C=CC=C1 MC40655 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.20 CCC1=C(C#N)C=CN=C1 MC427151 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.20 CCC1=C(C=O)C=CC=C1 MC20141 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.20 CCC1=C(NN)C=CC=C1 CS15134 [0,0,0,0,0,0|3,0,0]=3 6 B10R1.20 CNC1=C(C=O)C=CC=C1 CS17054 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.20 CNC1=NC=CC=C1CO CS10541 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.20 COC1=C(C#N)C=CC=C1 CS19247 [0,0,0,0,0,0|1,0,1]=2 9 B10R1.20 COC1=C(C#N)C=CC=N1 MC425657 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.20 COC1=C(C=O)C=CC=N1 CS20317 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.20 COC1=C(C=O)C=CN=C1 MC442707 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.20 COC1=C(CCl)C=CC=C1 MC20247 [0,0,0,0,0,0|1,0,1]=2 13 B10R1.20 COC1=C(CN)C=CC=C1 CS15681 [0,0,0,0,0,0|1,0,1]=2 14 B10R1.20 COC1=C(NN)C=CC=C1 CS19579 [0,0,0,0,0,0|2,0,0]=2 15 B10R1.20 COC1=C(NN)C=CC=C1 MC433991 [0,0,0,0,0,0|2,0,0]=2 16 B10R1.20 COC1=C(OC)C=CC=C1 CS12067 [0,0,0,0,0,0|1,0,1]=2 17 B10R1.20 COC1=CC=CN=C1C#N MC10410 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.20 COC1=CC=CN=C1CBr CS13321 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.20 COC1=CC=CN=C1CN CS18076 [0,0,0,0,0,0|2,0,1]=3 20 B10R1.20 COC1=CC=CN=C1CN MC431773 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.20 COC1=CC=CN=C1NN MC106439 [0,0,0,0,0,0|3,0,0]=3 22 B10R1.20 COC1=CC=CN=C1OC CS14783 [0,0,0,0,0,0|2,0,1]=3 23 B10R1.20 COC1=CC=NC=C1C=O MC442745 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.20 COC1=CN=CN=C1C#N MC428138 [0,0,0,0,0,0|3,0,1]=4 25 B10R1.20 COC1=NC=CC=C1CCl CS16832 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.20 COC1=NC=CC=C1CN CS14780 [0,0,0,0,0,0|2,0,1]=3 27 B10R1.20 COC1=NC=CC=C1CN CS17327 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.20 COC1=NC=CC=C1CO CS13650 [0,0,0,0,0,0|2,0,1]=3 29 B10R1.20 N#CC1=C(C=O)C=CC=C1 CS15835 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.20 N#CC1=C(C=O)C=NC=C1 MC442579 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.20 N#CC1=C(C=O)N=CC=C1 MC33525 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.20 N#CC1=C(CBr)C=CC=C1 CS18879 [0,0,0,0,0,0|3,0,1]=4 33 B10R1.20 N#CC1=C(CCl)C=CC=C1 CS18396 [0,0,0,0,0,0|3,0,1]=4 34 B10R1.20 N#CC1=C(CN)C=CC=C1 CS15557 [0,0,0,0,0,0|3,0,1]=4 35 B10R1.20 N#CC1=C(CO)C=CC=C1 MC40696 [0,0,0,0,0,0|3,0,1]=4 36 B10R1.20 N#CC1=CC=CC=C1C#N CS11856 [0,0,0,0,0,0|3,0,1]=4 37 B10R1.20 N#CC1=NC=CC=C1C=O MC442793 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.20 NCC1=C(C=O)C=CC=N1 MC33472 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.20 NCC1=C(CO)C=CC=C1 CS13269 [0,0,0,0,0,0|3,0,1]=4 40 B10R1.20 O=CC1=CC=CC=C1C=O MC41138 [0,0,0,0,0,0|3,0,0]=3 41 B10R1.20 OCC1=C(CBr)C=CC=C1 CS17090 [0,0,0,0,0,0|3,0,1]=4 42 B10R1.20 OCC1=CC=CC=C1CO MC433840 [0,0,0,0,0,0|3,0,1]=4 43 B9R1.15 BrCC1=C(Br)C=CC=C1 MC20808 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.15 BrCC1=C(I)C=CC=C1 MC40561 [1,0,0,0,0,0|2,0,1]=4 45 B9R1.15 C#CC1=C(Cl)C=CC=C1 CS20629 [1,0,0,0,0,0|1,0,2]=4 46 B9R1.15 C#CC1=C(N)C=CC=C1 CS21537 [1,0,0,0,0,0|1,0,2]=4 47 B9R1.15 C#CC1=C(O)C=CC=C1 CS21538 [1,0,0,0,0,0|0,0,2]=3 48 B9R1.15 C#CC1=CC=CN=C1O MC102702 [1,0,0,0,0,0|1,0,2]=4 49 B9R1.15 C=CC1=C(Br)C=CC=C1 CS18853 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.15 C=CC1=C(Cl)C=CC=C1 CS19873 [1,0,0,0,0,0|1,0,0]=2 51 B9R1.15 C=CC1=CC=CN=C1N MC103094 [1,0,0,0,0,0|2,0,0]=3 52 B9R1.15 CC1=C(CBr)C=CC=C1 CS14791 [1,0,0,0,0,0|1,0,1]=3 53 B9R1.15 CC1=C(CBr)C=NC=C1 CS17496 [1,0,0,0,0,0|2,0,1]=4 54 B9R1.15 CC1=C(CCl)C=NC=C1 MC104833 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.15 CC1=C(CN)C=CC=C1 MC33216 [1,0,0,0,0,0|1,0,1]=3 56 B9R1.15 CC1=C(CN)C=NC=C1 CS20204 [1,0,0,0,0,0|2,0,1]=4 57 B9R1.15 CC1=C(CO)C=NC=C1 MC443666 [1,0,0,0,0,0|2,0,1]=4 58 B9R1.15 CC1=C(NN)C=CC=C1 CS19575 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.15 CC1=C(NN)C=CC=C1 MC20365 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.15 CC1=CC=CC=C1C=O CS19114 [1,0,0,0,0,0|1,0,0]=2 61 B9R1.15 CC1=CC=CN=C1C#N CS20234 [1,0,0,0,0,0|2,0,1]=4 62 B9R1.15 CC1=CC=CN=C1C=O CS14987 [1,0,0,0,0,0|2,0,0]=3 63 B9R1.15 CC1=CC=CN=C1CCl CS15725 [1,0,0,0,0,0|2,0,1]=4 64 B9R1.15 CC1=CC=CN=C1CO CS19225 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.15 CC1=CC=NC=C1C#N CS22253 [1,0,0,0,0,0|2,0,1]=4 66 B9R1.15 CC1=CC=NC=C1C=O MC442433 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.15 CC1=NC=CC=C1CCl MC104832 [1,0,0,0,0,0|2,0,1]=4 68 B9R1.15 CC1=NC=CC=C1CN MC102930 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.15 CC1=NC=CC=C1CO CS20145 [1,0,0,0,0,0|2,0,1]=4 70 B9R1.15 CCC1=C(Br)C=CC=C1 CS20980 [1,0,0,0,0,0|2,0,0]=3 71 B9R1.15 CCC1=C(Br)C=CN=C1 MC427078 [1,0,0,0,0,0|3,0,0]=4 72 B9R1.15 CCC1=C(C)C=CC=C1 CS21536 [1,0,0,0,0,0|0,0,2]=3 73 B9R1.15 CCC1=C(N)C=CC=C1 MC40911 [1,0,0,0,0,0|2,0,0]=3 74 B9R1.15 CCC1=NC=CC=C1Br MC105746 [1,0,0,0,0,0|3,0,0]=4 75 B9R1.15 CNC1=C(Cl)C=CC=C1 MC40890 [1,0,0,0,0,0|2,0,0]=3 76 B9R1.15 CNC1=C(F)C=CC=C1 CS13895 [1,0,0,0,0,0|2,0,0]=3 77 B9R1.15 CNC1=C(N)C=NC=C1 MC10330 [1,0,0,0,0,0|3,0,0]=4 78 B9R1.15 CNC1=CC=CC=C1N CS22302 [1,0,0,0,0,0|2,0,0]=3 79 B9R1.15 CNC1=NC=CC=C1Br CS17281 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.15 CNC1=NC=CC=C1Cl MC33482 [1,0,0,0,0,0|3,0,0]=4 81 B9R1.15 CNC1=NC=CC=C1N MC427393 [1,0,0,0,0,0|3,0,0]=4 82 B9R1.15 COC1=C(Br)C=CC=C1 CS19150 [1,0,0,0,0,0|1,0,0]=2 83 B9R1.15 COC1=C(Br)C=CN=C1 CS14715 [1,0,0,0,0,0|2,0,0]=3 84 B9R1.15 COC1=C(Br)C=NC=C1 CS18491 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.15 COC1=C(C)C=CN=C1 MC443637 [1,0,0,0,0,0|1,0,1]=3 86 B9R1.15 COC1=C(C)C=NC=C1 MC33476 [1,0,0,0,0,0|1,0,1]=3 87 B9R1.15 COC1=C(Cl)C=CN=C1 MC442708 [1,0,0,0,0,0|2,0,0]=3 88 B9R1.15 COC1=C(F)C=CC=C1 CS19904 [1,0,0,0,0,0|1,0,0]=2 89 B9R1.15 COC1=C(F)C=NC=C1 CS16194 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.15 COC1=C(I)C=CC=C1 MC41341 [1,0,0,0,0,0|1,0,0]=2 91 B9R1.15 COC1=C(I)C=CN=C1 MC106301 [1,0,0,0,0,0|2,0,0]=3 92 B9R1.15 COC1=C(I)C=NC=C1 CS18542 [1,0,0,0,0,0|2,0,0]=3 93 B9R1.15 COC1=C(N)C=CC=C1 CS11812 [1,0,0,0,0,0|1,0,0]=2 94 B9R1.15 COC1=C(N)C=CN=C1 CS22564 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.15 COC1=C(N)C=NC=C1 CS18248 [1,0,0,0,0,0|2,0,0]=3 96 B9R1.15 COC1=C(O)C=CC=C1 MC41202 [1,0,0,0,0,0|1,0,0]=2 97 B9R1.15 COC1=C(O)C=CN=C1 MC443266 [1,0,0,0,0,0|2,0,0]=3 98 B9R1.15 COC1=CC=CN=C1Br CS19255 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.15 COC1=CC=CN=C1Cl CS19305 [1,0,0,0,0,0|2,0,0]=3 100 B9R1.15 COC1=CC=CN=C1F CS13044 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.15 COC1=CC=CN=C1N CS17216 [1,0,0,0,0,0|2,0,0]=3 102 B9R1.15 COC1=CN=CN=C1Br CS17880 [1,0,0,0,0,0|3,0,0]=4 103 B9R1.15 COC1=CN=CN=C1N CS13116 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.15 COC1=CN=CN=C1O MC432213 [1,0,0,0,0,0|3,0,0]=4 105 B9R1.15 COC1=NC=CC=C1Br CS19258 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.15 COC1=NC=CC=C1C MC33438 [1,0,0,0,0,0|1,0,1]=3 107 B9R1.15 COC1=NC=CC=C1Cl CS18705 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.15 COC1=NC=CC=C1F CS19564 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.15 COC1=NC=CC=C1I CS13512 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.15 COC1=NC=CC=C1N CS19526 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.15 COC1=NC=CN=C1Br CS12288 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.15 COC1=NC=CN=C1Cl CS14291 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.15 COC1=NC=CN=C1N MC441119 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.15 CSC1=C(Br)C=CN=C1 MC430535 [1,0,0,0,0,0|2,1,0]=4 115 B9R1.15 CSC1=C(I)C=CC=C1 MC433405 [1,0,0,0,0,0|1,1,0]=3 116 B9R1.15 ClC1=C(CBr)C=CC=C1 CS19190 [1,0,0,0,0,0|2,0,1]=4 117 B9R1.15 ClCC1=C(Cl)C=CC=C1 CS19964 [1,0,0,0,0,0|2,0,1]=4 118 B9R1.15 ClCC1=CC=CC=C1Br MC30029 [1,0,0,0,0,0|2,0,1]=4 119 B9R1.15 FC1=C(CBr)C=CC=C1 CS21562 [1,0,0,0,0,0|2,0,1]=4 120 B9R1.15 FC1=C(CCl)C=CC=C1 MC40597 [1,0,0,0,0,0|2,0,1]=4 121 B9R1.15 N#CC1=C(Br)C=CC=C1 MC20182 [1,0,0,0,0,0|2,0,1]=4 122 B9R1.15 N#CC1=C(F)C=CC=C1 CS18285 [1,0,0,0,0,0|2,0,1]=4 123 B9R1.15 N#CC1=C(I)C=CC=C1 CS21883 [1,0,0,0,0,0|2,0,1]=4 124 B9R1.15 N#CC1=C(N)C=CC=C1 CS13393 [1,0,0,0,0,0|2,0,1]=4 125 B9R1.15 N#CC1=C(O)C=CC=C1 CS19191 [1,0,0,0,0,0|1,0,1]=3 126 B9R1.15 N#CC1=CC=CN=C1O CS13920 [1,0,0,0,0,0|2,0,1]=4 127 B9R1.15 N#CC1=CN=CC=C1O MC106630 [1,0,0,0,0,0|2,0,1]=4 128 B9R1.15 N#CC1=NC=CC=C1O CS21861 [1,0,0,0,0,0|2,0,1]=4 129 B9R1.15 NC1=C(C=O)C=CC=C1 MC20756 [1,0,0,0,0,0|2,0,0]=3 130 B9R1.15 NC1=C(C=O)C=CC=N1 CS19340 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.15 NC1=C(C=O)C=CN=C1 CS14976 [1,0,0,0,0,0|3,0,0]=4 132 B9R1.15 NC1=C(CO)C=CC=C1 CS19122 [1,0,0,0,0,0|2,0,1]=4 133 B9R1.15 NC1=CC=NC=C1C=O CS19349 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.15 NCC1=C(Br)C=CC=C1 CS19534 [1,0,0,0,0,0|2,0,1]=4 135 B9R1.15 NCC1=C(F)C=CC=C1 MC40826 [1,0,0,0,0,0|2,0,1]=4 136 B9R1.15 NCC1=C(N)C=CC=C1 MC40796 [1,0,0,0,0,0|2,0,1]=4 137 B9R1.15 NCC1=C(O)C=CC=C1 CS20889 [1,0,0,0,0,0|1,0,1]=3 138 B9R1.15 NCC1=NC=CC=C1O MC443567 [1,0,0,0,0,0|2,0,1]=4 139 B9R1.15 NNC1=C(Br)C=CC=C1 CS19466 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.15 NNC1=C(Cl)C=CC=C1 CS19478 [1,0,0,0,0,0|3,0,0]=4 141 B9R1.15 NNC1=C(F)C=CC=C1 CS23033 [1,0,0,0,0,0|3,0,0]=4 142 B9R1.15 NNC1=C(F)C=CC=C1 MC33086 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.15 O=CC1=C(Br)C=CC=C1 CS19251 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.15 O=CC1=C(Br)C=NC=C1 CS15669 [1,0,0,0,0,0|3,0,0]=4 145 B9R1.15 O=CC1=C(Br)N=CC=C1 CS17915 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.15 O=CC1=C(Cl)C=CN=C1 MC425655 [1,0,0,0,0,0|3,0,0]=4 147 B9R1.15 O=CC1=C(Cl)C=NC=C1 CS15780 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.15 O=CC1=C(Cl)N=CC=C1 CS14208 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.15 O=CC1=C(F)C=CC=C1 CS21560 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.15 O=CC1=C(F)N=CC=C1 CS18263 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.15 O=CC1=C(I)C=CC=C1 CS20131 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.15 O=CC1=C(O)C=CC=C1 MC41121 [1,0,0,0,0,0|1,0,0]=2 153 B9R1.15 O=CC1=C(O)C=NC=C1 CS13859 [1,0,0,0,0,0|2,0,0]=3 154 B9R1.15 O=CC1=C(O)N=CC=C1 CS19011 [1,0,0,0,0,0|2,0,0]=3 155 B9R1.15 O=CC1=CN=CC=C1Br MC429512 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.15 O=CC1=CN=CC=C1O CS15926 [1,0,0,0,0,0|2,0,0]=3 157 B9R1.15 O=CC1=CNC=CC1=O CS17898 [1,0,0,0,0,0|2,0,1]=4 158 B9R1.15 O=CC1=NC=CC=C1Br MC442737 [1,0,0,0,0,0|3,0,0]=4 159 B9R1.15 O=CC1=NC=CC=C1F CS14128 [1,0,0,0,0,0|3,0,0]=4 160 B9R1.15 O=CC1=NC=CC=C1O MC443215 [1,0,0,0,0,0|2,0,0]=3 161 B9R1.15 OCC1=C(Br)C=CC=C1 CS18828 [1,0,0,0,0,0|2,0,1]=4 162 B9R1.15 OCC1=C(Cl)C=CC=C1 CS21494 [1,0,0,0,0,0|2,0,1]=4 163 B9R1.15 OCC1=C(F)C=CC=C1 MC33139 [1,0,0,0,0,0|2,0,1]=4 164 B9R1.15 OCC1=C(I)C=CC=C1 CS19102 [1,0,0,0,0,0|2,0,1]=4 165 B9R1.15 OCC1=C(O)C=CC=C1 CS16243 [1,0,0,0,0,0|1,0,1]=3 166 B9R1.15 OCC1=NC=CC=C1O MC20200 [1,0,0,0,0,0|2,0,1]=4 167 B11R1.37 C=CC1=C(C=O)C=C(F)C=C1 MC112225 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.37 C=CC1=C(C=O)C=C(O)C=C1 MC112221 [0,1,0,0,0,0|2,0,0]=3 169 B11R1.37 C=CC1=C(C=O)C=CC(C)=C1 MC112222 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.37 CCC1=C(C=O)C=C(Br)C=C1 MC443562 [0,1,0,0,0,0|2,0,0]=3 171 B11R1.37 CCC1=C(C=O)C=CC(O)=C1 MC441221 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.37 CCC1=C(CO)C=C(I)C=C1 MC111700 [0,1,0,0,0,0|2,0,1]=4 173 B11R1.37 COC1=C(C#N)C=C(Br)C=C1 MC30025 [0,1,0,0,0,0|1,0,1]=3 174 B11R1.37 COC1=C(C#N)C=C(Cl)C=C1 CS20726 [0,1,0,0,0,0|1,0,1]=3 175 B11R1.37 COC1=C(C#N)C=C(F)C=C1 MC433778 [0,1,0,0,0,0|1,0,1]=3 176 B11R1.37 COC1=C(C#N)C=C(O)C=C1 MC108583 [0,1,0,0,0,0|1,0,1]=3 177 B11R1.37 COC1=C(C#N)C=CC(Br)=C1 CS18242 [0,1,0,0,0,0|1,0,1]=3 178 B11R1.37 COC1=C(C#N)C=CC(C)=C1 CS21636 [0,1,0,0,0,0|1,0,1]=3 179 B11R1.37 COC1=C(C#N)C=CC(Cl)=N1 MC431143 [0,1,0,0,0,0|2,0,1]=4 180 B11R1.37 COC1=C(C#N)C=CC(F)=C1 MC30021 [0,1,0,0,0,0|1,0,1]=3 181 B11R1.37 COC1=C(C#N)C=CC(N)=C1 CS22550 [0,1,0,0,0,0|1,0,1]=3 182 B11R1.37 COC1=C(C#N)C=CC(O)=C1 MC442317 [0,1,0,0,0,0|1,0,1]=3 183 B11R1.37 COC1=C(C=O)C=C(Br)C=N1 MC431751 [0,1,0,0,0,0|2,0,0]=3 184 B11R1.37 COC1=C(C=O)C=C(Cl)C=C1 CS20830 [0,1,0,0,0,0|1,0,0]=2 185 B11R1.37 COC1=C(C=O)C=C(F)C=C1 CS13891 [0,1,0,0,0,0|1,0,0]=2 186 B11R1.37 COC1=C(C=O)C=C(F)C=N1 MC430389 [0,1,0,0,0,0|2,0,0]=3 187 B11R1.37 COC1=C(C=O)C=CC(Br)=C1 CS22648 [0,1,0,0,0,0|1,0,0]=2 188 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 MC30022 [0,1,0,0,0,0|1,0,0]=2 189 B11R1.37 COC1=C(C=O)C=CC(Cl)=N1 MC432194 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.37 COC1=C(C=O)C=CC(N)=C1 MC431889 [0,1,0,0,0,0|1,0,0]=2 191 B11R1.37 COC1=C(C=O)C=CC(O)=C1 MC442306 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.37 COC1=C(CBr)C=C(F)C=C1 MC30089 [0,1,0,0,0,0|1,0,1]=3 193 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 CS16238 [0,1,0,0,0,0|1,0,1]=3 194 B11R1.37 COC1=C(CN)C=C(N)C=C1 CS10206 [0,1,0,0,0,0|1,0,1]=3 195 B11R1.37 COC1=C(CN)C=CC(Cl)=C1 MC107633 [0,1,0,0,0,0|1,0,1]=3 196 B11R1.37 COC1=C(CN)C=CC(F)=C1 CS12735 [0,1,0,0,0,0|1,0,1]=3 197 B11R1.37 COC1=C(CO)C=C(Br)C=C1 MC40688 [0,1,0,0,0,0|1,0,1]=3 198 B11R1.37 COC1=C(CO)C=C(F)C=C1 MC30023 [0,1,0,0,0,0|1,0,1]=3 199 B11R1.37 COC1=C(CO)C=CC(Br)=C1 MC40687 [0,1,0,0,0,0|1,0,1]=3 200 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 MC443798 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.37 COC1=C(NN)C=CC(Cl)=C1 MC445716 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.37 COC1=C(OC)C=C(Br)C=C1 CS19895 [0,1,0,0,0,0|1,0,1]=3 203 B11R1.37 COC1=C(OC)C=C(C)C=C1 CS21947 [0,1,0,0,0,0|1,0,1]=3 204 B11R1.37 COC1=C(OC)C=C(F)C=C1 CS20493 [0,1,0,0,0,0|1,0,1]=3 205 B11R1.37 COC1=C(OC)C=C(I)C=C1 MC41359 [0,1,0,0,0,0|1,0,1]=3 206 B11R1.37 COC1=C(OC)C=C(N)C=C1 CS15398 [0,1,0,0,0,0|1,0,1]=3 207 B11R1.37 COC1=C(OC)C=C(O)C=C1 MC30097 [0,1,0,0,0,0|1,0,1]=3 208 B11R1.37 COC1=C(OC)C=C(S)C=C1 MC41407 [0,1,0,0,0,0|1,0,1]=3 209 B11R1.37 COC1=C(OC)N=CC(N)=C1 CS15128 [0,1,0,0,0,0|2,0,1]=4 210 B11R1.37 COC1=CC(Br)=CN=C1C=O MC431560 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.37 COC1=CC(Br)=CN=C1CO MC431858 [0,1,0,0,0,0|2,0,1]=4 212 B11R1.37 COC1=CC(Cl)=NC=C1C#N CS15634 [0,1,0,0,0,0|2,0,1]=4 213 B11R1.37 COC1=CC(F)=CC=C1C=O MC30305 [0,1,0,0,0,0|1,0,0]=2 214 B11R1.37 COC1=CC(F)=NC=C1C#N MC432631 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.37 COC1=CC(N)=CN=C1C#N MC111662 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.37 COC1=CC=C(Br)C=C1C=O MC33091 [0,1,0,0,0,0|1,0,0]=2 217 B11R1.37 COC1=CC=C(Br)N=C1C=O CS15316 [0,1,0,0,0,0|2,0,0]=3 218 B11R1.37 COC1=CN=C(Br)C=C1C#N MC108361 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.37 COC1=NC(Br)=CC=C1CN CS17510 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.37 COC1=NC(Br)=CC=C1CO CS17509 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.37 COC1=NC(F)=CC=C1C#N MC429293 [0,1,0,0,0,0|2,0,1]=4 222 B11R1.37 COC1=NC=C(Br)C=C1CN MC103396 [0,1,0,0,0,0|2,0,1]=4 223 B11R1.37 COC1=NC=C(Br)C=C1CO MC443486 [0,1,0,0,0,0|2,0,1]=4 224 B11R1.37 COC1=NC=C(F)C=C1CO MC430391 [0,1,0,0,0,0|2,0,1]=4 225 B11R1.37 N#CC1=C(C=O)C=C(Br)C=C1 CS16727 [0,1,0,0,0,0|3,0,0]=4 226 B11R1.37 N#CC1=C(C=O)C=CC(Br)=C1 CS14723 [0,1,0,0,0,0|3,0,0]=4 227 B11R1.41 CCOC1=C(C#N)C=CC=C1 MC33181 [0,1,0,0,0,0|1,0,1]=3 228 B11R1.41 CCOC1=C(OC)C=CC=C1 MC433385 [0,1,0,0,0,0|0,0,2]=3 229 B11R1.41 CCOC1=CC=NC=C1C=O MC443446 [0,1,0,0,0,0|2,0,0]=3 230 B11R1.41 COC1=C(CCO)C=CC=C1 CS15749 [0,1,0,0,0,0|0,0,2]=3 231 B11R1.41 N#CC1=C(CCO)C=CC=C1 MC100045 [0,1,0,0,0,0|2,0,1]=4 232 B11R1.41 O=CC1=C(CCBr)C=CC=C1 MC106620 [0,1,0,0,0,0|2,0,0]=3 233 B11R1.53 C=CC1=C(C(=O)O)C=CC=C1 CS16516 [0,1,0,0,0,0|2,0,0]=3 234 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 CS21523 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.53 CC(C)C1=C(C=O)C=CC=C1 MC441019 [0,1,0,0,0,0|2,0,0]=3 236 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 MC103557 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.53 CCC1=C(B(O)O)C=CC=C1 CS20466 [0,1,0,0,0,0|3,0,0]=4 238 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 CS15281 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 CS12568 [0,1,0,0,0,0|3,0,0]=4 240 B11R1.53 CCC1=C(C(=O)O)C=CN=C1 CS15310 [0,1,0,0,0,0|3,0,0]=4 241 B11R1.53 COC1=C(B(O)O)C=CC=C1 CS20142 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.53 COC1=C(B(O)O)C=CN=C1 MC430491 [0,1,0,0,0,0|3,0,0]=4 243 B11R1.53 COC1=C(B(O)O)C=CN=C1 MC430492 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.53 COC1=C(B(O)O)C=NC=C1 MC443759 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.53 COC1=C(C(=O)Cl)C=CC=C1 MC40492 [0,1,0,0,0,0|1,0,0]=2 246 B11R1.53 COC1=C(C(=O)O)C=CC=C1 CS15086 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.53 COC1=C(C(=O)O)C=CC=N1 CS20330 [0,1,0,0,0,0|2,0,0]=3 248 B11R1.53 COC1=C(C(=O)O)C=CN=C1 CS10492 [0,1,0,0,0,0|2,0,0]=3 249 B11R1.53 COC1=C(C(C)=O)C=CC=C1 MC41261 [0,1,0,0,0,0|0,0,1]=2 250 B11R1.53 COC1=C(C(C)=O)C=CN=C1 MC105760 [0,1,0,0,0,0|1,0,1]=3 251 B11R1.53 COC1=C(C(C)=O)C=NC=C1 MC102690 [0,1,0,0,0,0|1,0,1]=3 252 B11R1.53 COC1=C(C(C)N)C=CC=C1 CS15754 [0,1,0,0,0,0|0,0,2]=3 253 B11R1.53 COC1=C(S(=O)[O-])C=CC=C1 MC106123 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.53 COC1=C([N+](=O)[O-])C=CC=C1 MC41348 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.53 COC1=C([N+](=O)[O-])C=CN=C1 MC33480 [0,1,0,0,0,0|3,0,0]=4 256 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 CS19392 [0,1,0,0,0,0|3,0,0]=4 257 B11R1.53 COC1=C([N+](=O)[O-])C=NC=C1 MC33493 [0,1,0,0,0,0|3,0,0]=4 258 B11R1.53 COC1=CC=CN=C1C(=O)O CS22335 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.53 COC1=CC=CN=C1C(C)=O CS16598 [0,1,0,0,0,0|1,0,1]=3 260 B11R1.53 COC1=CC=CN=C1[N+](=O)[O-] CS19391 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.53 COC1=CC=NC=C1C(=O)O CS13273 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.53 COC1=NC=CC=C1B(O)O MC20273 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.53 COC1=NC=CC=C1C(C)=O MC102691 [0,1,0,0,0,0|1,0,1]=3 264 B11R1.53 COC1=NC=CC=C1[N+](=O)[O-] CS13911 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.53 COC1=NC=CN=C1C(=O)O CS16473 [0,1,0,0,0,0|3,0,0]=4 266 B11R1.53 N#CC1=C(C(=O)O)C=CC=C1 MC40261 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.53 NC(=O)C1=C(CBr)C=CC=C1 CS16759 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.53 O=CC1=C(B(O)O)C=CC=C1 CS10453 [0,1,0,0,0,0|3,0,0]=4 269 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 CS13542 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.53 O=CC1=C(C(F)F)C=CC=C1 CS15613 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.53 O=CC1=C([N+](=O)[O-])C=CC=C1 MC20421 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.265 CCC1=C(C#N)C(O)=CC=C1 MC442500 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.265 CCC1=C(NN)C(C)=CC=C1 MC430937 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.265 COC1=C(C#N)C(=O)NC=C1 MC20663 [0,1,0,0,0,0|2,0,1]=4 275 B11R1.265 COC1=C(C#N)C(C)=CC=C1 CS14397 [0,1,0,0,0,0|1,0,1]=3 276 B11R1.265 COC1=C(C#N)C=CC=C1Br MC442374 [0,1,0,0,0,0|1,0,1]=3 277 B11R1.265 COC1=C(C#N)C=CC=C1F MC442372 [0,1,0,0,0,0|1,0,1]=3 278 B11R1.265 COC1=C(C#N)C=CC=C1O MC40663 [0,1,0,0,0,0|1,0,1]=3 279 B11R1.265 COC1=C(C=O)C(Br)=CC=N1 MC441121 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.265 COC1=C(C=O)C(C)=CC=C1 CS21645 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.265 COC1=C(C=O)C(I)=CC=N1 CS13769 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.265 COC1=C(C=O)C=CC=C1Br CS22135 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.265 COC1=C(C=O)C=CC=C1C CS15730 [0,1,0,0,0,0|1,0,0]=2 284 B11R1.265 COC1=C(C=O)C=CC=C1Cl CS12248 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.265 COC1=C(C=O)C=CC=C1F MC30252 [0,1,0,0,0,0|1,0,0]=2 286 B11R1.265 COC1=C(C=O)C=CC=C1O MC425754 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.265 COC1=C(CO)C=CC=C1F CS14762 [0,1,0,0,0,0|1,0,1]=3 288 B11R1.265 COC1=CC=CC(Br)=C1C#N CS16021 [0,1,0,0,0,0|1,0,1]=3 289 B11R1.265 COC1=CC=CC(Br)=C1C=O MC427142 [0,1,0,0,0,0|1,0,0]=2 290 B11R1.265 COC1=CC=CC(Br)=C1OC CS14821 [0,1,0,0,0,0|1,0,1]=3 291 B11R1.265 COC1=CC=CC(Cl)=C1C#N CS21481 [0,1,0,0,0,0|1,0,1]=3 292 B11R1.265 COC1=CC=CC(Cl)=C1C=O CS17258 [0,1,0,0,0,0|1,0,0]=2 293 B11R1.265 COC1=CC=CC(Cl)=C1CBr MC107653 [0,1,0,0,0,0|1,0,1]=3 294 B11R1.265 COC1=CC=CC(Cl)=C1CN MC107632 [0,1,0,0,0,0|1,0,1]=3 295 B11R1.265 COC1=CC=CC(F)=C1C#N CS10752 [0,1,0,0,0,0|1,0,1]=3 296 B11R1.265 COC1=CC=CC(F)=C1C=O CS20843 [0,1,0,0,0,0|1,0,0]=2 297 B11R1.265 COC1=CC=CC(F)=C1CN CS20435 [0,1,0,0,0,0|1,0,1]=3 298 B11R1.265 COC1=CC=CC(F)=C1OC MC433523 [0,1,0,0,0,0|1,0,1]=3 299 B11R1.265 COC1=CC=CC(O)=C1C=O MC442703 [0,1,0,0,0,0|1,0,0]=2 300 B11R1.265 COC1=CC=CC(O)=C1OC CS21046 [0,1,0,0,0,0|1,0,1]=3 301 B11R1.265 COC1=CC=NC(Br)=C1C#N MC431570 [0,1,0,0,0,0|2,0,1]=4 302 B11R1.265 COC1=CC=NC(C)=C1C#N MC427559 [0,1,0,0,0,0|2,0,1]=4 303 B11R1.265 COC1=CC=NC(Cl)=C1C#N MC427601 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.265 COC1=CN=CC(Br)=C1C=O MC442313 [0,1,0,0,0,0|2,0,0]=3 305 B11R1.265 CSC1=CC=CC(Cl)=C1C=O MC103295 [0,1,0,0,0,0|1,1,0]=3 306 B11R1.265 N#CC1=C(C=O)C(Cl)=CC=C1 MC21113 [0,1,0,0,0,0|3,0,0]=4 307 B11R1.265 N#CC1=C(C=O)C=CC=C1Cl MC20702 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.265 N#CC1=C(F)C=CC=C1C=O MC429836 [0,1,0,0,0,0|3,0,0]=4 309 B11R2.1 BrC1=COC2=C1C=CC=C2 CS20626 [0,0,0,1,0,0|1,0,1]=3 310 B11R2.1 BrC1=NNC2=CC=CC=C21 MC442207 [0,0,0,1,0,0|3,0,0]=4 311 B11R2.1 CC1=CCC2=CC=CC=C12 MC106180 [0,0,0,1,0,0|1,0,1]=3 312 B11R2.1 CC1=CNC2=C1C=NC=C2 MC443768 [0,0,0,1,0,0|3,0,0]=4 313 B11R2.1 CC1=CNC2=CC=CC=C12 CS11030 [0,0,0,1,0,0|2,0,0]=3 314 B11R2.1 CC1=CNC2=NC=CC=C12 CS22368 [0,0,0,1,0,0|3,0,0]=4 315 B11R2.1 CC1=COC2=C1C=CC=C2 MC30270 [0,0,0,1,0,0|0,0,2]=3 316 B11R2.1 CC1=NNC2=CC=CC=C21 CS17372 [0,0,0,1,0,0|2,0,1]=4 317 B11R2.1 CC1=NOC2=C1C=CC=C2 CS22352 [0,0,0,1,0,0|1,0,1]=3 318 B11R2.1 CN1C=CC2=CC=CC=C21 CS11026 [0,0,0,1,0,0|1,0,0]=2 319 B11R2.1 CN1C=CC2=CC=CN=C21 CS20755 [0,0,0,1,0,0|2,0,0]=3 320 B11R2.1 CN1C=NC2=NC=CC=C21 MC105725 [0,0,0,1,0,0|3,0,0]=4 321 B11R2.1 ClC1=CNC2=CC=CC=C12 MC427199 [0,0,0,1,0,0|2,0,1]=4 322 B11R2.1 ClC1=COC2=C1C=CC=C2 MC114725 [0,0,0,1,0,0|1,0,1]=3 323 B11R2.1 ClC1=NOC2=C1C=CC=C2 CS19970 [0,0,0,1,0,0|2,0,0]=3 324 B11R2.1 IC1=CSC2=C1C=CC=C2 CS22329 [0,0,0,1,0,0|1,1,1]=4 325 B11R2.1 NC1=CSC2=C1C=CC=C2 CS13998 [0,0,0,1,0,0|1,1,1]=4 326 B11R2.1 NC1=NNC2=CC=CC=C21 CS20708 [0,0,0,1,0,0|3,0,0]=4 327 B11R2.1 NC1=NOC2=C1C=CC=C2 CS20240 [0,0,0,1,0,0|2,0,0]=3 328 B11R2.1 NC1=NOC2=CC=CN=C21 CS12630 [0,0,0,1,0,0|3,0,0]=4 329 B11R2.1 NC1=NSC2=C1C=CC=C2 CS13975 [0,0,0,1,0,0|2,1,0]=4 330 B11R2.1 NC1CCC2=CC=CC=C21 CS16005 [0,0,0,1,0,0|2,0,1]=4 331 B11R2.1 NC1CCC2=CC=CC=C21 CS19275 [0,0,0,1,0,0|2,0,1]=4 332 B11R2.1 NC1CCC2=CC=CC=C21 CS19803 [0,0,0,1,0,0|2,0,1]=4 333 B11R2.1 NC1CCC2=CC=CC=C21 CS20307 [0,0,0,1,0,0|2,0,1]=4 334 B11R2.1 NC1CCC2=CC=CC=C21 MC425841 [0,0,0,1,0,0|2,0,1]=4 335 B11R2.1 NC1COC2=NC=CC=C21 MC443539 [0,0,0,1,0,0|2,0,1]=4 336 B11R2.1 NN1C=CC2=CC=CC=C21 CS19942 [0,0,0,1,0,0|2,0,0]=3 337 B11R2.1 O=C1CCC2=CC=CC=C12 CS18668 [0,0,0,1,0,0|2,0,0]=3 338 B11R2.1 O=C1CCC2=CC=CN=C12 CS10816 [0,0,0,1,0,0|3,0,0]=4 339 B11R2.1 O=C1CCC2=NC=CC=C12 CS18212 [0,0,0,1,0,0|3,0,0]=4 340 B11R2.1 O=C1COC2=C1C=CC=C2 CS20787 [0,0,0,1,0,0|1,0,0]=2 341 B11R2.1 O=C1COC2=CC=CN=C12 MC103039 [0,0,0,1,0,0|2,0,0]=3 342 B11R2.1 O=C1COC2=NC=CC=C12 MC441318 [0,0,0,1,0,0|2,0,0]=3 343 B11R2.1 O=C1CSC2=C1C=CC=C2 CS20606 [0,0,0,1,0,0|1,1,0]=3 344 B11R2.1 O=C1NCC2=CC=CC=C12 CS11515 [0,0,0,1,0,0|3,0,0]=4 345 B11R2.1 O=C1NNC2=CC=CC=C12 MC441212 [0,0,0,1,0,0|3,0,0]=4 346 B11R2.1 O=C1NSC2=C1C=CC=C2 CS14057 [0,0,0,1,0,0|2,1,0]=4 347 B11R2.1 O=C1OCC2=CC=CC=C12 CS11853 [0,0,0,1,0,0|3,0,0]=4 348 B11R2.1 O=C1SSC2=C1C=CC=C2 MC428208 [0,0,0,1,0,0|2,1,0]=4 349 B11R2.1 O=S1C=NC2=C1C=CC=C2 MC31232 [0,0,0,1,0,0|2,1,0]=4 350 B11R2.1 OC1=NOC2=C1C=CC=C2 MC442249 [0,0,0,1,0,0|2,0,0]=3 351 B11R2.20 C1=CC2=CC=NC=C2C=N1 MC442537 [0,0,0,1,0,0|3,0,0]=4 352 B11R2.20 C1=CC2=CN=CC=C2C=N1 MC111272 [0,0,0,1,0,0|3,0,0]=4 353 B11R2.20 C1=CC2=CN=CC=C2N=C1 MC442547 [0,0,0,1,0,0|2,0,1]=4 354 B11R2.20 C1=CC=C2C=NC=CC2=C1 CS19770 [0,0,0,1,0,0|2,0,0]=3 355 B11R2.20 C1=CC=C2C=NN=CC2=C1 CS10532 [0,0,0,1,0,0|3,0,0]=4 356 B11R2.20 C1=CC=C2CC=CCC2=C1 CS11050 [0,0,0,1,0,0|1,0,2]=4 357 B11R2.20 C1=CC=C2CNCCC2=C1 CS19412 [0,0,0,1,0,0|2,0,1]=4 358 B11R2.20 C1=CC=C2COCCC2=C1 CS19933 [0,0,0,1,0,0|2,0,1]=4 359 B11R2.20 C1=CC=C2N=CC=CC2=C1 CS11929 [0,0,0,1,0,0|1,0,1]=3 360 B11R2.20 C1=CC=C2N=CC=NC2=C1 CS11932 [0,0,0,1,0,0|2,0,1]=4 361 B11R2.20 C1=CC=C2N=CN=CC2=C1 CS11926 [0,0,0,1,0,0|2,0,1]=4 362 B11R2.20 C1=CC=C2N=NC=CC2=C1 CS11145 [0,0,0,1,0,0|2,0,0]=3 363 B11R2.20 C1=CC=C2NCCNC2=C1 CS19000 [0,0,0,1,0,0|2,0,1]=4 364 B11R2.20 C1=CN=C2C=CC=NC2=C1 CS20548 [0,0,0,1,0,0|2,0,1]=4 365 B9R1.14 COC1=CSC=C1OC CS10119 [0,0,0,0,1,0|2,0,1]=4 366 B8R1.2 C#CC1=CC=CC=C1 CS19127 [2,0,0,0,0,0|0,0,2]=4 367 B8R1.2 CCC1=CC=CC=C1 MC41556 [2,0,0,0,0,0|1,0,0]=3 368 B8R1.2 CCC1=CC=CN=C1 CS22277 [2,0,0,0,0,0|2,0,0]=4 369 B8R1.2 CNC1=CC=CC=C1 CS11792 [2,0,0,0,0,0|1,0,0]=3 370 B8R1.2 CNC1=CC=CN=C1 CS13856 [2,0,0,0,0,0|2,0,0]=4 371 B8R1.2 CNC1=CC=NC=C1 MC41620 [2,0,0,0,0,0|2,0,0]=4 372 B8R1.2 COC1=CC=CC=C1 MC41309 [2,0,0,0,0,0|0,0,0]=2 373 B8R1.2 COC1=CC=CN=C1 CS22348 [2,0,0,0,0,0|1,0,0]=3 374 B8R1.2 COC1=CC=CN=N1 CS22347 [2,0,0,0,0,0|2,0,0]=4 375 B8R1.2 COC1=CC=NC=C1 CS19206 [2,0,0,0,0,0|1,0,0]=3 376 B8R1.2 COC1=CN=CN=C1 MC428182 [2,0,0,0,0,0|2,0,0]=4 377 B8R1.2 COC1=CN=NC=C1 MC427243 [2,0,0,0,0,0|2,0,0]=4 378 B8R1.2 COC1=NC=CC=C1 CS18780 [2,0,0,0,0,0|1,0,0]=3 379 B8R1.2 COC1=NC=CN=C1 CS17887 [2,0,0,0,0,0|2,0,0]=4 380 B8R1.2 CSC1=CC=CC=C1 MC439137 [2,0,0,0,0,0|0,1,0]=3 381 B8R1.2 CSC1=NC=CC=C1 MC41628 [2,0,0,0,0,0|1,1,0]=4 382 B8R1.2 ICC1=CC=CC=C1 CS11000 [2,0,0,0,0,0|1,0,1]=4 383 B8R1.2 I[Zn]c1ccccc1 MC121332 [2,0,0,0,0,0|2,0,0]=4 384 B8R1.2 N#CC1=CC=CC=C1 MC40623 [2,0,0,0,0,0|1,0,1]=4 385 B8R1.2 N#Cc1ccccc1 CS13696 [2,0,0,0,0,0|1,0,1]=4 386 B8R1.2 NCC1=CC=CC=C1 MC40797 [2,0,0,0,0,0|1,0,1]=4 387 B8R1.2 NNC1=CC=CC=C1 CS15210 [2,0,0,0,0,0|2,0,0]=4 388 B8R1.2 NNC1=CC=CC=C1 MC427075 [2,0,0,0,0,0|2,0,0]=4 389 B8R1.2 O=CC1=CN=CC=C1 CS19090 [2,0,0,0,0,0|2,0,0]=4 390 B8R1.2 O=CC1=NC=CC=C1 CS18610 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.2 O=NC1=CC=CC=C1 MC33163 [2,0,0,0,0,0|2,0,0]=4 392 B8R1.2 OCC1=CC=CC=C1 MC40684 [2,0,0,0,0,0|1,0,1]=4 393 B8R1.5 BrC1=C(Br)C=CC=C1 CS19765 [2,0,0,0,0,0|2,0,0]=4 394 B8R1.5 BrC1=C(I)C=CC=C1 CS19157 [2,0,0,0,0,0|2,0,0]=4 395 B8R1.5 CC1=C(Br)C=CC=C1 MC20187 [2,0,0,0,0,0|1,0,0]=3 396 B8R1.5 CC1=C(Br)C=CN=C1 CS13416 [2,0,0,0,0,0|2,0,0]=4 397 B8R1.5 CC1=C(Br)C=NC=C1 CS21916 [2,0,0,0,0,0|2,0,0]=4 398 B8R1.5 CC1=C(Cl)C=CC=C1 CS20009 [2,0,0,0,0,0|1,0,0]=3 399 B8R1.5 CC1=C(Cl)C=CN=C1 CS18038 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.5 CC1=C(Cl)C=NC=C1 CS15751 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.5 CC1=C(F)C=CC=C1 MC41519 [2,0,0,0,0,0|1,0,0]=3 402 B8R1.5 CC1=C(F)C=CN=C1 MC433051 [2,0,0,0,0,0|2,0,0]=4 403 B8R1.5 CC1=C(F)C=NC=C1 CS19332 [2,0,0,0,0,0|2,0,0]=4 404 B8R1.5 CC1=C(I)C=CC=C1 CS19198 [2,0,0,0,0,0|1,0,0]=3 405 B8R1.5 CC1=C(N)C=CN=C1 CS19521 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.5 CC1=C(N)C=NC=C1 CS21907 [2,0,0,0,0,0|2,0,0]=4 407 B8R1.5 CC1=C(O)C=CN=C1 CS13965 [2,0,0,0,0,0|1,0,1]=4 408 B8R1.5 CC1=C(O)C=NC=C1 CS22316 [2,0,0,0,0,0|1,0,1]=4 409 B8R1.5 CC1=CC=CC=C1C MC41549 [2,0,0,0,0,0|0,0,1]=3 410 B8R1.5 CC1=CC=CC=C1N CS20592 [2,0,0,0,0,0|1,0,0]=3 411 B8R1.5 CC1=CC=CC=C1O CS11813 [2,0,0,0,0,0|0,0,1]=3 412 B8R1.5 CC1=CC=CN=C1Br CS23002 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.5 CC1=CC=CN=C1C CS21050 [2,0,0,0,0,0|1,0,1]=4 414 B8R1.5 CC1=CC=CN=C1Cl CS13857 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.5 CC1=CC=CN=C1F CS19328 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.5 CC1=CC=CN=C1N CS13775 [2,0,0,0,0,0|2,0,0]=4 417 B8R1.5 CC1=CC=CN=C1O CS19498 [2,0,0,0,0,0|1,0,1]=4 418 B8R1.5 CC1=NC=CC=C1Br MC20012 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.5 CC1=NC=CC=C1Cl MC425470 [2,0,0,0,0,0|2,0,0]=4 420 B8R1.5 CC1=NC=CC=C1F CS19850 [2,0,0,0,0,0|2,0,0]=4 421 B8R1.5 CC1=NC=CC=C1N CS19518 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.5 CC1=NC=CC=C1O MC20374 [2,0,0,0,0,0|1,0,1]=4 423 B8R1.5 C[N+]1=C(Cl)C=CC=C1 CS19467 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.5 ClC1=C(Br)C=CC=C1 CS21391 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.5 ClC1=C(Cl)C=CC=C1 MC41478 [2,0,0,0,0,0|2,0,0]=4 426 B8R1.5 FC1=C(Br)C=CC=C1 CS19658 [2,0,0,0,0,0|2,0,0]=4 427 B8R1.5 FC1=C(Cl)C=CC=C1 MC429398 [2,0,0,0,0,0|2,0,0]=4 428 B8R1.5 FC1=C(F)C=CC=C1 CS20490 [2,0,0,0,0,0|2,0,0]=4 429 B8R1.5 FC1=C(I)C=CC=C1 MC429560 [2,0,0,0,0,0|2,0,0]=4 430 B8R1.5 FC1=C(S)C=CC=C1 MC429404 [2,0,0,0,0,0|1,1,0]=4 431 B8R1.5 IC1=C(I)C=CC=C1 MC41488 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.5 NC1=C(Br)C=CC=C1 CS19197 [2,0,0,0,0,0|2,0,0]=4 433 B8R1.5 NC1=C(Cl)C=CC=C1 CS19766 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.5 NC1=C(F)C=CC=C1 MC40915 [2,0,0,0,0,0|2,0,0]=4 435 B8R1.5 NC1=C(I)C=CC=C1 CS23020 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.5 NC1=C(O)C=CC=C1 CS21309 [2,0,0,0,0,0|1,0,0]=3 437 B8R1.5 NC1=C(O)C=CN=C1 MC427456 [2,0,0,0,0,0|2,0,0]=4 438 B8R1.5 NC1=C(O)C=NC=C1 CS14741 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.5 NC1=C(S)C=CC=C1 MC41400 [2,0,0,0,0,0|1,1,0]=4 440 B8R1.5 NC1=CC=CC=C1N CS11822 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.5 NC1=NC=CC=C1O CS22765 [2,0,0,0,0,0|2,0,0]=4 442 B8R1.5 O=C1C=COC=C1O CS16007 [2,0,0,0,0,0|2,0,0]=4 443 B8R1.5 O=C1NC=CC=C1O CS22752 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.5 O=C1OC=CC=C1O CS22311 [2,0,0,0,0,0|2,0,0]=4 445 B8R1.5 OC1=C(Br)C=CC=C1 CS19429 [2,0,0,0,0,0|1,0,0]=3 446 B8R1.5 OC1=C(Br)C=CN=C1 CS13781 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.5 OC1=C(Br)C=NC=C1 CS14222 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.5 OC1=C(Cl)C=CC=C1 MC41174 [2,0,0,0,0,0|1,0,0]=3 449 B8R1.5 OC1=C(Cl)C=CN=C1 CS16383 [2,0,0,0,0,0|2,0,0]=4 450 B8R1.5 OC1=C(Cl)C=NC=C1 CS16225 [2,0,0,0,0,0|2,0,0]=4 451 B8R1.5 OC1=C(F)C=CC=C1 MC20096 [2,0,0,0,0,0|1,0,0]=3 452 B8R1.5 OC1=C(F)C=NC=C1 CS22284 [2,0,0,0,0,0|2,0,0]=4 453 B8R1.5 OC1=C(I)C=CC=C1 MC20193 [2,0,0,0,0,0|1,0,0]=3 454 B8R1.5 OC1=C(I)C=CN=C1 CS12130 [2,0,0,0,0,0|2,0,0]=4 455 B8R1.5 OC1=C(I)C=NC=C1 MC425611 [2,0,0,0,0,0|2,0,0]=4 456 B8R1.5 OC1=CC=CC=C1O CS11109 [2,0,0,0,0,0|1,0,0]=3 457 B8R1.5 OC1=CC=CN=C1Br CS17449 [2,0,0,0,0,0|2,0,0]=4 458 B8R1.5 OC1=CC=CN=C1Cl CS17508 [2,0,0,0,0,0|2,0,0]=4 459 B8R1.5 OC1=CC=CN=C1F CS13836 [2,0,0,0,0,0|2,0,0]=4 460 B8R1.5 OC1=CC=CN=C1I CS14294 [2,0,0,0,0,0|2,0,0]=4 461 B8R1.5 OC1=NC=CC=C1Br CS18703 [2,0,0,0,0,0|2,0,0]=4 462 B8R1.5 SC1=C(I)C=CC=C1 MC41410 [2,0,0,0,0,0|1,1,0]=4 463 B8R1.5 [O-][N+]1=C(O)C=CC=C1 CS21603 [2,0,0,0,0,0|2,0,0]=4 464 B10R1.2 C=CC1=C(O)C(=O)C=CO1 MC111677 [1,1,0,0,0,0|1,0,0]=3 465 B10R1.2 CC1=C(Br)C=CN=C1C=O MC442513 [1,1,0,0,0,0|2,0,0]=4 466 B10R1.2 CC1=C(C#N)C=CC=C1Br CS13130 [1,1,0,0,0,0|1,0,1]=4 467 B10R1.2 CC1=C(C#N)C=CC=C1F CS10738 [1,1,0,0,0,0|1,0,1]=4 468 B10R1.2 CC1=C(C=O)C=CC=C1Cl MC433418 [1,1,0,0,0,0|1,0,0]=3 469 B10R1.2 CC1=C(C=O)C=CC=C1F CS10806 [1,1,0,0,0,0|1,0,0]=3 470 B10R1.2 CC1=C(C=O)C=CC=C1O CS15258 [1,1,0,0,0,0|1,0,0]=3 471 B10R1.2 CC1=C(C=O)C=CN=C1Cl MC430495 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.2 CC1=C(CO)C=CC=C1Br MC40689 [1,1,0,0,0,0|1,0,1]=4 473 B10R1.2 CC1=C(Cl)C=CN=C1C=O MC442568 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.2 CC1=C(F)C=CN=C1C=O MC431962 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.2 CC1=C(O)C=CC=C1CO MC425562 [1,1,0,0,0,0|1,0,1]=4 476 B10R1.2 CC1=CC=CC(C#N)=C1C CS11027 [1,1,0,0,0,0|1,0,1]=4 477 B10R1.2 CC1=CC=CC(C=O)=C1C CS10889 [1,1,0,0,0,0|1,0,0]=3 478 B10R1.2 CC1=CC=CC(C=O)=C1Cl MC33173 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.2 CC1=CC=CC(C=O)=C1F MC20031 [1,1,0,0,0,0|2,0,0]=4 480 B10R1.2 CC1=CC=CC(C=O)=C1O CS20930 [1,1,0,0,0,0|1,0,0]=3 481 B10R1.2 CC1=CC=CC(CBr)=C1C CS10894 [1,1,0,0,0,0|1,0,1]=4 482 B10R1.2 CC1=CC=CC(CN)=C1C MC40822 [1,1,0,0,0,0|1,0,1]=4 483 B10R1.2 CC1=CC=CC(CO)=C1C CS20113 [1,1,0,0,0,0|1,0,1]=4 484 B10R1.2 CCC1=C(O)C(F)=CC=C1 MC431776 [1,1,0,0,0,0|0,0,2]=4 485 B10R1.2 CCC1=C(O)C(O)=CC=C1 MC442025 [1,1,0,0,0,0|0,0,2]=4 486 B10R1.2 CCC1=CC=CC(Br)=C1O MC442827 [1,1,0,0,0,0|0,0,2]=4 487 B10R1.2 CCC1=CC=CC(Cl)=C1N MC443589 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.2 CCC1=CC=CC(Cl)=C1O MC441042 [1,1,0,0,0,0|0,0,2]=4 489 B10R1.2 CCC1=CC=CC(O)=C1F MC442498 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.2 COC1=C(Br)C(Cl)=CC=C1 MC41311 [1,1,0,0,0,0|1,0,0]=3 491 B10R1.2 COC1=C(Br)C(Cl)=NC=C1 CS17952 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.2 COC1=C(Br)C(F)=CC=C1 MC429428 [1,1,0,0,0,0|1,0,0]=3 493 B10R1.2 COC1=C(Br)C(I)=CC=C1 MC41319 [1,1,0,0,0,0|1,0,0]=3 494 B10R1.2 COC1=C(C)C(C)=CC=C1 MC20206 [1,1,0,0,0,0|0,0,1]=3 495 B10R1.2 COC1=C(C)C(Cl)=CC=C1 MC20115 [1,1,0,0,0,0|0,0,1]=3 496 B10R1.2 COC1=C(F)C(Br)=CC=C1 MC20208 [1,1,0,0,0,0|1,0,0]=3 497 B10R1.2 COC1=C(F)C(Br)=NC=C1 MC432157 [1,1,0,0,0,0|2,0,0]=4 498 B10R1.2 COC1=C(I)C(F)=CC=C1 MC433387 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.2 COC1=C(I)C(N)=CC=C1 MC433348 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.2 COC1=C(N)C(Br)=NC=C1 CS14869 [1,1,0,0,0,0|2,0,0]=4 501 B10R1.2 COC1=C(N)C(C)=CC=C1 MC427399 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.2 COC1=C(N)C(N)=CC=C1 CS12559 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.2 COC1=CC=CC(Br)=C1C MC442371 [1,1,0,0,0,0|0,0,1]=3 504 B10R1.2 COC1=CC=CC(Br)=C1I CS14393 [1,1,0,0,0,0|1,0,0]=3 505 B10R1.2 COC1=CC=CC(Br)=C1O MC442834 [1,1,0,0,0,0|1,0,0]=3 506 B10R1.2 COC1=CC=CC(Cl)=C1N CS16113 [1,1,0,0,0,0|1,0,0]=3 507 B10R1.2 COC1=CC=CC(Cl)=C1O MC441233 [1,1,0,0,0,0|1,0,0]=3 508 B10R1.2 COC1=CC=CC(F)=C1F CS21031 [1,1,0,0,0,0|1,0,0]=3 509 B10R1.2 COC1=CC=CC(F)=C1N CS21557 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.2 COC1=CC=CC(F)=C1O MC433388 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.2 COC1=CC=CC(I)=C1C MC442370 [1,1,0,0,0,0|0,0,1]=3 512 B10R1.2 COC1=CC=CC(N)=C1Br CS21335 [1,1,0,0,0,0|1,0,0]=3 513 B10R1.2 COC1=CC=CC(N)=C1C CS10556 [1,1,0,0,0,0|0,0,1]=3 514 B10R1.2 COC1=CC=CC(N)=C1Cl CS18618 [1,1,0,0,0,0|1,0,0]=3 515 B10R1.2 COC1=CC=CC(N)=C1Cl MC428124 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.2 COC1=CC=CC(N)=C1F CS12736 [1,1,0,0,0,0|1,0,0]=3 517 B10R1.2 COC1=CC=CC(N)=C1O CS17187 [1,1,0,0,0,0|1,0,0]=3 518 B10R1.2 COC1=CC=CC(N)=C1O MC121305 [1,1,0,0,0,0|1,0,0]=3 519 B10R1.2 COC1=CC=CC(O)=C1Br MC443182 [1,1,0,0,0,0|1,0,0]=3 520 B10R1.2 COC1=CC=CC(O)=C1Cl CS21434 [1,1,0,0,0,0|1,0,0]=3 521 B10R1.2 COC1=CC=CC(O)=C1F MC442393 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.2 COC1=CC=CC(O)=C1I MC111957 [1,1,0,0,0,0|1,0,0]=3 523 B10R1.2 COC1=CC=CC(O)=C1N CS16742 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.2 COC1=CN=CC(Cl)=C1N MC431893 [1,1,0,0,0,0|2,0,0]=4 525 B10R1.2 COC1=CN=CC(F)=C1Br MC429481 [1,1,0,0,0,0|2,0,0]=4 526 B10R1.2 COC1=CN=CC(F)=C1Cl MC429483 [1,1,0,0,0,0|2,0,0]=4 527 B10R1.2 COC1=NC=CC(Br)=C1C MC427103 [1,1,0,0,0,0|1,0,1]=4 528 B10R1.2 COC1=NC=CC(C)=C1Br MC433060 [1,1,0,0,0,0|2,0,0]=4 529 B10R1.2 COC1=NC=CC(C)=C1N MC425798 [1,1,0,0,0,0|2,0,0]=4 530 B10R1.2 COC1=NC=CC(N)=C1N MC427324 [1,1,0,0,0,0|2,0,0]=4 531 B10R1.2 COC1=NC=CC(O)=C1Cl MC432620 [1,1,0,0,0,0|2,0,0]=4 532 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 MC20573 [1,1,0,0,0,0|0,1,1]=4 533 B10R1.2 N#CC1=C(O)C(Br)=CC=C1 MC442373 [1,1,0,0,0,0|1,0,1]=4 534 B10R1.2 N#CC1=C(O)C(Cl)=CC=C1 MC441234 [1,1,0,0,0,0|1,0,1]=4 535 B10R1.2 N#CC1=C(O)C(F)=CC=C1 MC40658 [1,1,0,0,0,0|1,0,1]=4 536 B10R1.2 N#CC1=C(O)C(N)=CC=C1 MC442219 [1,1,0,0,0,0|1,0,1]=4 537 B10R1.2 N#CC1=C(O)C(O)=CC=C1 MC441227 [1,1,0,0,0,0|1,0,1]=4 538 B10R1.2 NC1=C(C=O)C=CC=C1Br CS16139 [1,1,0,0,0,0|2,0,0]=4 539 B10R1.2 NC1=C(C=O)C=CC=C1F CS17444 [1,1,0,0,0,0|2,0,0]=4 540 B10R1.2 O=CC1=C(Br)C(Br)=CC=C1 MC10119 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.2 O=CC1=C(Br)C(Cl)=CC=C1 CS13248 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.2 O=CC1=C(Br)C(F)=CC=C1 CS21338 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.2 O=CC1=C(Br)C(O)=CC=C1 CS13249 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.2 O=CC1=C(Cl)C(Br)=CC=C1 CS17694 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.2 O=CC1=C(Cl)C(Cl)=CC=C1 CS13389 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.2 O=CC1=C(Cl)C(F)=CC=C1 CS10258 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.2 O=CC1=C(F)C(Br)=CC=C1 CS14896 [1,1,0,0,0,0|2,0,0]=4 548 B10R1.2 O=CC1=C(F)C(Cl)=CC=C1 CS10263 [1,1,0,0,0,0|2,0,0]=4 549 B10R1.2 O=CC1=C(F)C(F)=CC=C1 CS10281 [1,1,0,0,0,0|2,0,0]=4 550 B10R1.2 O=CC1=C(F)C(O)=CC=C1 MC441017 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.2 O=CC1=C(I)C(F)=CC=C1 MC21112 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.2 O=CC1=C(O)C(Br)=CC=C1 CS20079 [1,1,0,0,0,0|1,0,0]=3 553 B10R1.2 O=CC1=C(O)C(Cl)=CC=C1 MC20676 [1,1,0,0,0,0|1,0,0]=3 554 B10R1.2 O=CC1=C(O)C(Cl)=NC=C1 MC442720 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.2 O=CC1=C(O)C(F)=CC=C1 CS20128 [1,1,0,0,0,0|1,0,0]=3 556 B10R1.2 O=CC1=C(O)C(I)=CC=C1 MC442738 [1,1,0,0,0,0|1,0,0]=3 557 B10R1.2 O=CC1=C(O)C(O)=CC=C1 CS21044 [1,1,0,0,0,0|1,0,0]=3 558 B10R1.4 CC1=C(CC#N)C=CC=C1 CS11825 [1,1,0,0,0,0|0,0,2]=4 559 B10R1.4 CCOC1=C(Br)C=CC=C1 MC20149 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.4 CCOC1=C(Br)C=NC=C1 MC443330 [1,1,0,0,0,0|2,0,0]=4 561 B10R1.4 CCOC1=C(N)C=CC=C1 CS11823 [1,1,0,0,0,0|1,0,0]=3 562 B10R1.4 CCOC1=C(N)C=CN=C1 MC442472 [1,1,0,0,0,0|2,0,0]=4 563 B10R1.4 CCOC1=C(O)C=CC=C1 MC41194 [1,1,0,0,0,0|1,0,0]=3 564 B10R1.4 CCOC1=CC=CN=C1C MC443397 [1,1,0,0,0,0|1,0,1]=4 565 B10R1.4 CCOC1=CC=CN=C1O MC110935 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.4 CNCC1=C(F)C=CC=C1 MC40828 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.4 COCC1=C(Br)C=CC=C1 MC41399 [1,1,0,0,0,0|1,0,0]=3 568 B10R1.4 NCCC1=C(Br)C=CC=C1 CS15138 [1,1,0,0,0,0|2,0,0]=4 569 B10R1.4 NCCC1=C(F)C=CC=C1 CS14793 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.4 NCCC1=C(N)C=CC=C1 CS15970 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.4 O=CCC1=C(F)C=CC=C1 MC431003 [1,1,0,0,0,0|1,0,1]=4 572 B10R1.4 OC1=C(CCI)C=CC=C1 MC430321 [1,1,0,0,0,0|0,0,2]=4 573 B10R1.4 OCCC1=C(Br)C=CC=C1 CS21407 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.4 OCCC1=C(Cl)C=CC=C1 MC40737 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.4 OCCC1=C(F)C=CC=C1 MC33149 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC106948 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.4 O\N=C\C1=C(F)C=CC=C1 MC433456 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.25 CC1=C(C#N)C=CC(Br)=C1 CS10708 [1,1,0,0,0,0|1,0,1]=4 579 B10R1.25 CC1=C(C#N)C=CC(Cl)=C1 MC433106 [1,1,0,0,0,0|1,0,1]=4 580 B10R1.25 CC1=C(C#N)C=CC(F)=C1 MC20042 [1,1,0,0,0,0|1,0,1]=4 581 B10R1.25 CC1=C(C#N)C=CC(N)=C1 CS16661 [1,1,0,0,0,0|1,0,1]=4 582 B10R1.25 CC1=C(C#N)C=CC(O)=C1 MC442235 [1,1,0,0,0,0|1,0,1]=4 583 B10R1.25 CC1=C(C=O)C=CC(Br)=C1 CS22653 [1,1,0,0,0,0|1,0,0]=3 584 B10R1.25 CC1=C(C=O)C=CC(Br)=N1 MC443390 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.25 CC1=C(C=O)C=CC(Cl)=C1 CS20823 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.25 CC1=C(C=O)C=CC(F)=C1 CS10809 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.25 CC1=C(C=O)C=CC(N)=N1 MC430302 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.25 CC1=C(C=O)C=CC(O)=C1 CS20933 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.25 CC1=C(CCl)C=CC(Br)=C1 MC107510 [1,1,0,0,0,0|1,0,1]=4 590 B10R1.25 CC1=C(CN)C=CC(Br)=C1 MC20891 [1,1,0,0,0,0|1,0,1]=4 591 B10R1.25 CC1=C(CN)C=CC(F)=C1 MC40830 [1,1,0,0,0,0|1,0,1]=4 592 B10R1.25 CC1=C(CN)C=CC(O)=C1 MC442240 [1,1,0,0,0,0|1,0,1]=4 593 B10R1.25 CC1=C(CO)C=CC(Br)=C1 MC433849 [1,1,0,0,0,0|1,0,1]=4 594 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 CS20803 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.25 CC1=CC(Br)=CN=C1C=O MC428377 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.25 CC1=CC(C)=C(C#N)C=C1 MC40652 [1,1,0,0,0,0|1,0,1]=4 597 B10R1.25 CC1=CC(C)=C(C=O)C=C1 CS21114 [1,1,0,0,0,0|1,0,0]=3 598 B10R1.25 CC1=CC(C)=C(CBr)C=C1 CS21116 [1,1,0,0,0,0|1,0,1]=4 599 B10R1.25 CC1=CC(C)=C(CCl)C=C1 MC40593 [1,1,0,0,0,0|1,0,1]=4 600 B10R1.25 CC1=CC(C)=C(NN)C=C1 CS20500 [1,1,0,0,0,0|2,0,0]=4 601 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 CS21448 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.25 CC1=CC(F)=C(C=O)C=C1 MC41116 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.25 CC1=CC(O)=C(C#N)C=C1 CS21585 [1,1,0,0,0,0|1,0,1]=4 604 B10R1.25 CC1=CC(O)=C(C=O)C=C1 MC33188 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.25 CCC1=C(Br)C=C(N)C=C1 MC33284 [1,1,0,0,0,0|2,0,0]=4 606 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 MC442501 [1,1,0,0,0,0|2,0,0]=4 607 B10R1.25 CCC1=C(N)C=C(F)C=C1 MC40914 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.25 CNC1=CC=C(Br)C=C1N MC443280 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 CS20168 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.25 COC1=C(Br)C=C(F)C=C1 MC30075 [1,1,0,0,0,0|1,0,0]=3 611 B10R1.25 COC1=C(Br)C=C(I)C=C1 MC41320 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.25 COC1=C(Br)C=C(N)C=C1 MC20804 [1,1,0,0,0,0|1,0,0]=3 613 B10R1.25 COC1=C(Br)C=C(O)C=C1 CS18795 [1,1,0,0,0,0|1,0,0]=3 614 B10R1.25 COC1=C(Br)C=C(O)C=N1 MC432022 [1,1,0,0,0,0|2,0,0]=4 615 B10R1.25 COC1=C(C)C=C(Br)C=C1 CS22652 [1,1,0,0,0,0|0,0,1]=3 616 B10R1.25 COC1=C(C)C=C(I)C=C1 MC41343 [1,1,0,0,0,0|0,0,1]=3 617 B10R1.25 COC1=C(C)C=C(N)C=C1 CS18714 [1,1,0,0,0,0|0,0,1]=3 618 B10R1.25 COC1=C(C)C=C(N)C=N1 CS15363 [1,1,0,0,0,0|1,0,1]=4 619 B10R1.25 COC1=C(C)C=C(O)C=C1 MC442018 [1,1,0,0,0,0|0,0,1]=3 620 B10R1.25 COC1=C(Cl)C=C(C)C=C1 MC442301 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.25 COC1=C(Cl)C=C(F)C=C1 MC30033 [1,1,0,0,0,0|1,0,0]=3 622 B10R1.25 COC1=C(Cl)C=C(N)C=C1 CS14858 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.25 COC1=C(Cl)C=C(N)C=N1 CS17094 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.25 COC1=C(Cl)C=C(O)C=C1 MC442396 [1,1,0,0,0,0|1,0,0]=3 625 B10R1.25 COC1=C(Cl)N=C(N)C=C1 MC103574 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.25 COC1=C(F)C=C(Br)C=C1 MC30240 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.25 COC1=C(F)C=C(I)C=C1 MC425677 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.25 COC1=C(F)C=C(N)C=C1 CS10515 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.25 COC1=C(F)C=C(N)C=N1 CS15127 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.25 COC1=C(F)C=C(O)C=C1 CS22287 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.25 COC1=C(I)C=C(Br)C=C1 CS17024 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.25 COC1=C(I)C=C(Cl)C=C1 MC41330 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.25 COC1=C(I)C=C(N)C=C1 CS18915 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.25 COC1=C(I)C=C(N)C=C1 CS19301 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.25 COC1=C(N)C=C(Br)C=C1 CS10268 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.25 COC1=C(N)C=C(C)C=C1 CS13548 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.25 COC1=C(N)C=C(F)C=C1 MC30206 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.25 COC1=C(N)C=C(I)C=C1 MC428313 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.25 COC1=C(N)C=C(N)C=C1 CS21066 [1,1,0,0,0,0|1,0,0]=3 640 B10R1.25 COC1=C(O)C=C(C)C=C1 MC442401 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.25 COC1=C(O)C=C(Cl)C=C1 MC442017 [1,1,0,0,0,0|1,0,0]=3 642 B10R1.25 COC1=C(O)C=C(F)C=C1 CS15779 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.25 COC1=CC=C(Br)N=C1F MC425103 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.25 COC1=CN=C(Br)C=C1N MC432419 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.25 COC1=CN=C(C)C=C1Br MC431792 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.25 COC1=CN=C(C)C=C1N MC431793 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.25 COC1=CN=C(Cl)C=C1Br MC431572 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.25 COC1=CN=C(Cl)C=C1I MC431710 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.25 COC1=CN=C(Cl)C=C1N MC103245 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.25 COC1=CN=C(N)C=C1Cl MC103569 [1,1,0,0,0,0|2,0,0]=4 651 B10R1.25 COC1=NC=C(Br)C=C1Br CS18704 [1,1,0,0,0,0|2,0,0]=4 652 B10R1.25 COC1=NC=C(Br)C=C1C CS17558 [1,1,0,0,0,0|1,0,1]=4 653 B10R1.25 COC1=NC=C(Br)C=C1Cl CS19358 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.25 COC1=NC=C(Br)C=C1F CS17560 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.25 COC1=NC=C(Br)C=C1N CS17340 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.25 COC1=NC=C(C)C=C1Br CS12715 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.25 COC1=NC=C(Cl)C=C1Br CS17800 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.25 COC1=NC=C(Cl)C=C1I MC432522 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.25 COC1=NC=C(F)C=C1Br CS19396 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.25 COC1=NC=C(F)C=C1C MC431991 [1,1,0,0,0,0|1,0,1]=4 661 B10R1.25 COC1=NC=C(F)C=C1O MC431711 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.25 COC1=NC=C(N)C=C1Br MC20010 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.25 COC1=[N+]([O-])C=C(F)C=C1 MC110903 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.25 CSC1=C(Br)C=C(Cl)C=C1 MC428294 [1,1,0,0,0,0|1,1,0]=4 665 B10R1.25 CSC1=C(C)C=C(O)C=C1 MC20571 [1,1,0,0,0,0|0,1,1]=4 666 B10R1.25 CSC1=C(F)C=C(F)C=C1 MC430845 [1,1,0,0,0,0|1,1,0]=4 667 B10R1.25 CSC1=C(F)C=C(O)C=C1 MC431554 [1,1,0,0,0,0|1,1,0]=4 668 B10R1.25 N#CC1=C(O)C=C(Br)C=C1 CS22646 [1,1,0,0,0,0|1,0,1]=4 669 B10R1.25 N#CC1=C(O)C=C(Cl)C=C1 CS14584 [1,1,0,0,0,0|1,0,1]=4 670 B10R1.25 N#CC1=C(O)C=C(N)C=C1 MC442238 [1,1,0,0,0,0|1,0,1]=4 671 B10R1.25 N#CC1=C(O)C=C(O)C=C1 MC10369 [1,1,0,0,0,0|1,0,1]=4 672 B10R1.25 NC1=C(C=O)C=CC(Br)=C1 CS21241 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.25 NC1=C(C=O)C=CC(Cl)=C1 CS17491 [1,1,0,0,0,0|2,0,0]=4 674 B10R1.25 NC1=C(C=O)C=CC(F)=C1 MC30207 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.25 O=CC1=C(Br)C=C(Br)C=C1 CS16310 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.25 O=CC1=C(Br)C=C(Cl)C=C1 CS15142 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.25 O=CC1=C(Br)C=C(F)C=C1 CS10226 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.25 O=CC1=C(Br)C=C(I)C=C1 CS19853 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 CS16052 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.25 O=CC1=C(Cl)C=C(Br)C=C1 CS18762 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.25 O=CC1=C(Cl)C=C(Cl)C=C1 MC33212 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.25 O=CC1=C(Cl)C=C(F)C=C1 CS10260 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 CS10340 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.25 O=CC1=C(F)C=C(Br)C=C1 CS10231 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.25 O=CC1=C(F)C=C(Cl)C=C1 MC20030 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.25 O=CC1=C(F)C=C(F)C=C1 CS18760 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.25 O=CC1=C(F)C=C(I)C=C1 CS10293 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.25 O=CC1=C(F)C=C(O)C=C1 CS10365 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.25 O=CC1=C(I)C=C(O)C=C1 CS16844 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.25 O=CC1=C(O)C=C(Br)C=C1 CS20081 [1,1,0,0,0,0|1,0,0]=3 691 B10R1.25 O=CC1=C(O)C=C(Cl)C=C1 CS20105 [1,1,0,0,0,0|1,0,0]=3 692 B10R1.25 O=CC1=C(O)C=C(F)C=C1 CS20130 [1,1,0,0,0,0|1,0,0]=3 693 B10R1.25 O=CC1=C(O)C=C(I)C=C1 MC425567 [1,1,0,0,0,0|1,0,0]=3 694 B10R1.25 O=CC1=C(O)C=C(O)C=C1 CS19428 [1,1,0,0,0,0|1,0,0]=3 695 B10R1.25 OCC1=C(O)C=C(Br)C=C1 CS10248 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.30 C#CC1=C(C)C=CC(N)=C1 MC103342 [1,1,0,0,0,0|0,0,2]=4 697 B10R1.30 CC1=C(C#N)C=C(Br)C=C1 CS10274 [1,1,0,0,0,0|1,0,1]=4 698 B10R1.30 CC1=C(C#N)C=C(Cl)C=C1 MC40633 [1,1,0,0,0,0|1,0,1]=4 699 B10R1.30 CC1=C(C#N)C=C(F)C=C1 MC429400 [1,1,0,0,0,0|1,0,1]=4 700 B10R1.30 CC1=C(C#N)C=C(N)C=C1 CS10209 [1,1,0,0,0,0|1,0,1]=4 701 B10R1.30 CC1=C(C#N)C=C(O)C=C1 MC442397 [1,1,0,0,0,0|1,0,1]=4 702 B10R1.30 CC1=C(C=O)C=C(Br)C=C1 MC20545 [1,1,0,0,0,0|1,0,0]=3 703 B10R1.30 CC1=C(C=O)C=C(Br)C=N1 MC432423 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.30 CC1=C(C=O)C=C(Cl)C=C1 MC41106 [1,1,0,0,0,0|1,0,0]=3 705 B10R1.30 CC1=C(C=O)C=C(F)C=C1 MC20032 [1,1,0,0,0,0|1,0,0]=3 706 B10R1.30 CC1=C(C=O)C=C(I)C=C1 MC425522 [1,1,0,0,0,0|1,0,0]=3 707 B10R1.30 CC1=C(CBr)C=C(F)C=C1 MC40554 [1,1,0,0,0,0|1,0,1]=4 708 B10R1.30 CC1=C(CO)C=C(I)C=C1 MC425423 [1,1,0,0,0,0|1,0,1]=4 709 B10R1.30 CC1=C(NN)C=C(F)C=C1 MC40997 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.30 CC1=CC(C#N)=C(O)C=C1 MC442255 [1,1,0,0,0,0|1,0,1]=4 711 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 CS13222 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.30 CC1=CC(C=O)=C(F)C=C1 CS10804 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.30 CC1=CC(C=O)=C(O)C=C1 MC33170 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.30 CC1=CC(CCl)=C(C)C=C1 MC40594 [1,1,0,0,0,0|1,0,1]=4 715 B10R1.30 CC1=CC(CN)=C(C)C=C1 MC20405 [1,1,0,0,0,0|1,0,1]=4 716 B10R1.30 CC1=CC(CN)=C(O)C=C1 MC431862 [1,1,0,0,0,0|1,0,1]=4 717 B10R1.30 CC1=CC(NN)=C(C)C=C1 CS20501 [1,1,0,0,0,0|2,0,0]=4 718 B10R1.30 CC1=CC=C(F)N=C1C=O MC431964 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.30 CC1=CC=C(O)C(C=O)=N1 MC442566 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.30 CCC1=C(Br)C=CC(I)=C1 MC428380 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.30 CCC1=C(Cl)C=CC(O)=C1 MC20088 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.30 CCC1=C(F)C=CC(Br)=C1 MC41552 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.30 CCC1=C(F)C=CC(O)=C1 MC442497 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.30 CCC1=C(N)C=CC(Br)=C1 MC30325 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.30 CCC1=C(N)C=CC(Br)=C1 MC30326 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.30 CCC1=C(N)C=CC(Cl)=C1 MC30090 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.30 CNC1=C(I)C=CC(F)=C1 MC430179 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.30 CNC1=CC(Br)=CC=C1N CS13254 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.30 COC1=C(Br)C=CC(Br)=C1 CS12737 [1,1,0,0,0,0|1,0,0]=3 730 B10R1.30 COC1=C(Br)C=CC(C)=C1 MC20209 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 CS21371 [1,1,0,0,0,0|1,0,0]=3 732 B10R1.30 COC1=C(Br)C=CC(F)=C1 CS10394 [1,1,0,0,0,0|1,0,0]=3 733 B10R1.30 COC1=C(Br)C=CC(I)=C1 MC33199 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.30 COC1=C(Br)C=CC(N)=C1 CS18102 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.30 COC1=C(Br)C=CC(N)=N1 MC429703 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.30 COC1=C(Br)C=CC(O)=C1 MC443538 [1,1,0,0,0,0|1,0,0]=3 737 B10R1.30 COC1=C(Br)N=CC(N)=C1 CS12409 [1,1,0,0,0,0|2,0,0]=4 738 B10R1.30 COC1=C(C)C=CC(Cl)=C1 MC33132 [1,1,0,0,0,0|0,0,1]=3 739 B10R1.30 COC1=C(C)C=CC(N)=C1 MC40926 [1,1,0,0,0,0|0,0,1]=3 740 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 MC33062 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 MC33073 [1,1,0,0,0,0|1,0,0]=3 742 B10R1.30 COC1=C(Cl)C=CC(F)=C1 MC41328 [1,1,0,0,0,0|1,0,0]=3 743 B10R1.30 COC1=C(Cl)C=CC(I)=C1 MC20290 [1,1,0,0,0,0|1,0,0]=3 744 B10R1.30 COC1=C(Cl)C=CC(N)=C1 CS22759 [1,1,0,0,0,0|1,0,0]=3 745 B10R1.30 COC1=C(Cl)C=CC(O)=C1 MC441231 [1,1,0,0,0,0|1,0,0]=3 746 B10R1.30 COC1=C(Cl)N=CC(O)=C1 MC103609 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.30 COC1=C(F)C=CC(Br)=C1 CS19804 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.30 COC1=C(F)C=CC(F)=C1 MC41336 [1,1,0,0,0,0|1,0,0]=3 749 B10R1.30 COC1=C(F)C=CC(N)=C1 CS10516 [1,1,0,0,0,0|1,0,0]=3 750 B10R1.30 COC1=C(F)C=CC(O)=C1 CS16180 [1,1,0,0,0,0|1,0,0]=3 751 B10R1.30 COC1=C(I)C=CC(Br)=C1 MC41321 [1,1,0,0,0,0|1,0,0]=3 752 B10R1.30 COC1=C(I)C=CC(Cl)=C1 MC20291 [1,1,0,0,0,0|1,0,0]=3 753 B10R1.30 COC1=C(I)C=CC(F)=C1 MC41340 [1,1,0,0,0,0|1,0,0]=3 754 B10R1.30 COC1=C(I)C=CC(I)=C1 MC442228 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.30 COC1=C(N)C=CC(Br)=C1 CS19178 [1,1,0,0,0,0|1,0,0]=3 756 B10R1.30 COC1=C(N)C=CC(Cl)=C1 MC30210 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.30 COC1=C(N)C=CC(F)=C1 CS12096 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.30 COC1=C(N)C=CC(F)=C1 MC40917 [1,1,0,0,0,0|1,0,0]=3 759 B10R1.30 COC1=C(N)C=CC(I)=C1 MC21014 [1,1,0,0,0,0|1,0,0]=3 760 B10R1.30 COC1=C(N)C=CC(N)=C1 CS21132 [1,1,0,0,0,0|1,0,0]=3 761 B10R1.30 COC1=C(O)C=CC(Br)=C1 CS22682 [1,1,0,0,0,0|1,0,0]=3 762 B10R1.30 COC1=C(O)C=CC(C)=C1 CS16322 [1,1,0,0,0,0|1,0,0]=3 763 B10R1.30 COC1=C(O)C=CC(Cl)=C1 MC41171 [1,1,0,0,0,0|1,0,0]=3 764 B10R1.30 COC1=C(O)C=CC(F)=C1 MC41195 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.30 COC1=C(O)C=CC(I)=C1 MC41200 [1,1,0,0,0,0|1,0,0]=3 766 B10R1.30 COC1=C(O)C=CC(N)=C1 MC41143 [1,1,0,0,0,0|1,0,0]=3 767 B10R1.30 COC1=C(O)C=CC(N)=C1 MC442300 [1,1,0,0,0,0|1,0,0]=3 768 B10R1.30 COC1=C(O)C=CC(O)=C1 MC33205 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.30 COC1=C(O)C=NC(Br)=C1 MC429892 [1,1,0,0,0,0|2,0,0]=4 770 B10R1.30 COC1=CC(Br)=CN=C1Cl CS10254 [1,1,0,0,0,0|2,0,0]=4 771 B10R1.30 COC1=CC(Br)=CN=C1F MC429568 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.30 COC1=CC(Br)=CN=C1N CS14023 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.30 COC1=CC(Br)=CNC1=O MC432413 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.30 COC1=CC(Br)=NC=C1Br MC430262 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.30 COC1=CC(Br)=NC=C1Cl MC432372 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.30 COC1=CC(Cl)=NC=C1Br CS14850 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.30 COC1=CC(Cl)=NC=C1Cl CS15874 [1,1,0,0,0,0|2,0,0]=4 778 B10R1.30 COC1=CC(F)=CN=C1Br MC432342 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.30 COC1=CC(F)=CN=C1Cl MC432017 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.30 COC1=CC(F)=NC=C1Br MC432632 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.30 COC1=CC(I)=CN=C1Br MC442221 [1,1,0,0,0,0|2,0,0]=4 782 B10R1.30 COC1=CC(I)=CN=C1I MC442220 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.30 COC1=CC(N)=NC=C1Br MC431984 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.30 COC1=CC(N)=NC=C1F MC431830 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.30 COC1=CC(O)=CN=C1Br MC429848 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.30 COC1=CC(O)=NC=C1Br MC429897 [1,1,0,0,0,0|2,0,0]=4 787 B10R1.30 COC1=NC(Br)=CC=C1F MC432018 [1,1,0,0,0,0|2,0,0]=4 788 B10R1.30 COC1=NC(Br)=CC=C1N CS18540 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.30 COC1=NC(C)=CC=C1Br CS19284 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.30 COC1=NC(C)=CC=C1F MC103284 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.30 COC1=NC(C)=CC=C1N CS13867 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.30 COC1=NC(Cl)=CC=C1Br CS16211 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.30 COC1=NC(Cl)=CC=C1F MC432020 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.30 COC1=NC(Cl)=CC=C1N CS10669 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.30 COC1=NC(F)=CC=C1Br MC429643 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.30 N#CC1=C(O)C=CC(Br)=C1 CS10240 [1,1,0,0,0,0|1,0,1]=4 797 B10R1.30 N#CC1=C(O)C=CC(Cl)=C1 MC30046 [1,1,0,0,0,0|1,0,1]=4 798 B10R1.30 N#CC1=C(O)C=CC(N)=C1 CS10205 [1,1,0,0,0,0|1,0,1]=4 799 B10R1.30 NC1=C(C=O)C=C(Br)C=C1 CS13430 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.30 NC1=C(C=O)C=C(Cl)C=C1 MC20404 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.30 NCC1=C(O)C=CC(Br)=C1 CS18138 [1,1,0,0,0,0|1,0,1]=4 802 B10R1.30 O=CC1=C(Br)C=CC(Br)=C1 CS10002 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.30 O=CC1=C(Br)C=CC(Cl)=C1 CS18798 [1,1,0,0,0,0|2,0,0]=4 804 B10R1.30 O=CC1=C(Br)C=CC(F)=C1 CS10227 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.30 O=CC1=C(Br)C=CC(O)=C1 CS20078 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.30 O=CC1=C(Cl)C=CC(Br)=C1 MC20546 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.30 O=CC1=C(Cl)C=CC(Cl)=C1 CS19231 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.30 O=CC1=C(Cl)C=CC(F)=C1 MC41103 [1,1,0,0,0,0|2,0,0]=4 809 B10R1.30 O=CC1=C(Cl)C=CC(O)=C1 CS15260 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.30 O=CC1=C(F)C=CC(Br)=C1 CS10234 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.30 O=CC1=C(F)C=CC(Cl)=C1 CS10265 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.30 O=CC1=C(F)C=CC(F)=C1 CS20008 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.30 O=CC1=C(F)C=CC(O)=C1 CS13428 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.30 O=CC1=C(I)C=CC(Br)=C1 MC433412 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.30 O=CC1=C(I)C=CC(F)=C1 MC433439 [1,1,0,0,0,0|2,0,0]=4 816 B10R1.30 O=CC1=C(O)C=CC(Cl)=C1 CS20107 [1,1,0,0,0,0|1,0,0]=3 817 B10R1.30 O=CC1=C(O)C=CC(F)=C1 CS10369 [1,1,0,0,0,0|1,0,0]=3 818 B10R1.30 O=CC1=C(O)C=CC(I)=C1 CS20136 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.30 O=CC1=C(O)C=CC(O)=C1 MC20094 [1,1,0,0,0,0|1,0,0]=3 820 B10R1.30 O=CC1=CC(Br)=CC=C1O CS20084 [1,1,0,0,0,0|1,0,0]=3 821 B10R1.30 O=CC1=CC(Cl)=NC=C1O MC441109 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.30 OCC1=CC(Br)=CC=C1O CS20280 [1,1,0,0,0,0|1,0,1]=4 823 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 CS18866 [1,1,0,0,0,0|1,0,1]=4 824 B10R1.61 CC(=O)C1=C(C)C=CC=C1 CS19710 [1,1,0,0,0,0|0,0,1]=3 825 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 MC41234 [1,1,0,0,0,0|1,0,1]=4 826 B10R1.61 CC(=O)C1=C(F)C=CC=C1 CS15490 [1,1,0,0,0,0|1,0,1]=4 827 B10R1.61 CC(=O)C1=C(N)C=CC=C1 CS19948 [1,1,0,0,0,0|1,0,1]=4 828 B10R1.61 CC(=O)C1=C(O)C=CC=C1 CS15026 [1,1,0,0,0,0|0,0,1]=3 829 B10R1.61 CC(=O)C1=C(O)C=NC=C1 MC427306 [1,1,0,0,0,0|1,0,1]=4 830 B10R1.61 CC(=O)C1=CC=CN=C1O MC427454 [1,1,0,0,0,0|1,0,1]=4 831 B10R1.61 CC(=O)C1=NC=CC=C1O CS14450 [1,1,0,0,0,0|1,0,1]=4 832 B10R1.61 CC(C)C1=C(Br)C=CC=C1 CS19988 [1,1,0,0,0,0|2,0,0]=4 833 B10R1.61 CC(N)C1=C(Br)C=CC=C1 CS20301 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.61 CC(N)C1=C(F)C=CC=C1 CS20318 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.61 CC(N)C1=C(F)C=CC=C1 MC429423 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 CS13547 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.61 CC(O)C1=C(F)C=CC=C1 CS15513 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.61 CC(O)C1=C(F)C=CC=C1 MC33138 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.61 CC1=C(B(O)O)C=CC=C1 CS20397 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.61 CC1=C(C(=O)O)C=CC=C1 CS19823 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.61 CC1=C(C(=O)O)C=CC=N1 CS18975 [1,1,0,0,0,0|2,0,0]=4 842 B10R1.61 CC1=C(C(=O)O)C=CN=C1 CS22360 [1,1,0,0,0,0|2,0,0]=4 843 B10R1.61 CC1=C(C(N)=O)C=CC=N1 CS22408 [1,1,0,0,0,0|2,0,0]=4 844 B10R1.61 CC1=C(C(N)=O)C=NC=C1 MC33526 [1,1,0,0,0,0|2,0,0]=4 845 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 MC41522 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.61 CC1=CC=CN=C1C(=O)O CS19680 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.61 CC1=CC=NC=C1C(=O)O CS22976 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.61 CC1=CC=NC=C1C(=O)O CS22977 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.61 CN(C)C1=C(Br)C=CC=C1 MC20183 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 MC20288 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.61 CN(C)C1=C(F)C=CC=C1 MC20285 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.61 CN(C)C1=C(O)C=CC=C1 CS14782 [1,1,0,0,0,0|1,0,1]=4 853 B10R1.61 CN(C)C1=CC=CC=C1N CS14204 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.61 Cc1ccccc1C(C)Br MC106119 [1,1,0,0,0,0|0,0,2]=4 855 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 CS20174 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.61 NC(=O)C1=C(F)C=CC=C1 MC41021 [1,1,0,0,0,0|2,0,0]=4 857 B10R1.61 NC(=O)C1=C(I)C=CC=C1 MC433808 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.61 NC(=O)C1=C(O)C=CC=C1 CS11941 [1,1,0,0,0,0|1,0,0]=3 859 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 MC40438 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 MC40472 [1,1,0,0,0,0|2,0,0]=4 861 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 CS19188 [1,1,0,0,0,0|2,0,0]=4 862 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 CS16216 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.61 O=C(O)C1=C(F)C=CC=C1 CS10366 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.61 O=C(O)C1=C(I)C=CC=C1 CS20137 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.61 O=C(O)C1=C(O)C=CC=C1 MC40289 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.61 O=C(O)C1=C(O)C=NC=C1 CS22995 [1,1,0,0,0,0|2,0,0]=4 867 B10R1.61 O=C(O)C1=C(S)C=CC=C1 MC40297 [1,1,0,0,0,0|1,1,0]=4 868 B10R1.61 O=C(O)C1=CN=CC=C1O CS15271 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.61 O=C(O)C1=NC=CC=C1O CS22996 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 MC40335 [1,1,0,0,0,0|2,0,0]=4 871 B10R1.61 O=C([O-])C1=C(F)C=CC=C1 MC40349 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.61 O=[N+]([O-])C1=C(O)C=CC=C1 CS21724 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.61 OB(O)C1=C(O)C=CC=C1 CS21880 [1,1,0,0,0,0|2,0,0]=4 874 B10R1.245 C=CC1=C(F)C=CC=C1F MC41563 [1,1,0,0,0,0|1,0,0]=3 875 B10R1.245 CC1=CC=CC(Br)=C1C#N CS12993 [1,1,0,0,0,0|1,0,1]=4 876 B10R1.245 CC1=CC=CC(C)=C1C#N CS21705 [1,1,0,0,0,0|1,0,1]=4 877 B10R1.245 CC1=CC=CC(C)=C1C=O CS21067 [1,1,0,0,0,0|1,0,0]=3 878 B10R1.245 CC1=CC=CC(C)=C1CBr MC40551 [1,1,0,0,0,0|1,0,1]=4 879 B10R1.245 CC1=CC=CC(C)=C1CCl MC20793 [1,1,0,0,0,0|1,0,1]=4 880 B10R1.245 CC1=CC=CC(C)=C1CN CS21184 [1,1,0,0,0,0|1,0,1]=4 881 B10R1.245 CC1=CC=CC(C)=C1CO CS10906 [1,1,0,0,0,0|1,0,1]=4 882 B10R1.245 CC1=CC=CC(C)=C1NN CS19886 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.245 CC1=CC=CC(Cl)=C1C#N MC433758 [1,1,0,0,0,0|1,0,1]=4 884 B10R1.245 CC1=CC=CC(F)=C1C#N CS19871 [1,1,0,0,0,0|1,0,1]=4 885 B10R1.245 CC1=CC=CC(F)=C1C=O CS21558 [1,1,0,0,0,0|1,0,0]=3 886 B10R1.245 CC1=CC=CC(O)=C1C#N CS21595 [1,1,0,0,0,0|1,0,1]=4 887 B10R1.245 CC1=CC=CC(O)=C1C=O MC442494 [1,1,0,0,0,0|1,0,0]=3 888 B10R1.245 CC1=CC=NC(Cl)=C1C=O MC443360 [1,1,0,0,0,0|2,0,0]=4 889 B10R1.245 CCC1=C(O)C=CC=C1N MC442227 [1,1,0,0,0,0|0,0,2]=4 890 B10R1.245 CNC1=C(F)C=CC=C1F MC430506 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.245 COC1=C(Br)C=CC=C1Br CS21160 [1,1,0,0,0,0|1,0,0]=3 892 B10R1.245 COC1=C(Br)C=CC=C1Cl MC41312 [1,1,0,0,0,0|1,0,0]=3 893 B10R1.245 COC1=C(Br)C=CC=C1F MC30007 [1,1,0,0,0,0|1,0,0]=3 894 B10R1.245 COC1=C(Br)C=CN=C1Br MC111574 [1,1,0,0,0,0|2,0,0]=4 895 B10R1.245 COC1=C(Cl)C=CC=C1Cl MC41334 [1,1,0,0,0,0|1,0,0]=3 896 B10R1.245 COC1=C(Cl)C=CC=C1F CS12979 [1,1,0,0,0,0|1,0,0]=3 897 B10R1.245 COC1=C(F)C=CC=C1F MC30190 [1,1,0,0,0,0|1,0,0]=3 898 B10R1.245 COC1=C(F)C=CC=C1I MC20137 [1,1,0,0,0,0|1,0,0]=3 899 B10R1.245 COC1=C(F)C=CN=C1Br MC431066 [1,1,0,0,0,0|2,0,0]=4 900 B10R1.245 COC1=C(N)C=CC=C1Cl MC442093 [1,1,0,0,0,0|1,0,0]=3 901 B10R1.245 COC1=C(N)C=CC=C1F MC20133 [1,1,0,0,0,0|1,0,0]=3 902 B10R1.245 COC1=C(N)C=NC=C1F MC432228 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.245 COC1=C(O)C=CC=C1Br MC441228 [1,1,0,0,0,0|1,0,0]=3 904 B10R1.245 COC1=C(O)C=CC=C1Cl MC441015 [1,1,0,0,0,0|1,0,0]=3 905 B10R1.245 COC1=C(O)C=CC=C1F MC442390 [1,1,0,0,0,0|1,0,0]=3 906 B10R1.245 COC1=[N+]([O-])C=CC=C1C MC427230 [1,1,0,0,0,0|1,0,1]=4 907 B10R1.245 CSC1=C(O)C=CC=C1Br MC442206 [1,1,0,0,0,0|1,0,1]=4 908 B10R1.245 N#CC1=C(Cl)C=CC=C1O MC433752 [1,1,0,0,0,0|1,0,1]=4 909 B10R1.245 N#CC1=C(F)C=CC=C1O MC40657 [1,1,0,0,0,0|1,0,1]=4 910 B10R1.245 N#Cc1c(O)cccc1Br MC433746 [1,1,0,0,0,0|1,0,1]=4 911 B10R1.245 O=CC1=C(Br)C=CC=C1Br CS21162 [1,1,0,0,0,0|2,0,0]=4 912 B10R1.245 O=CC1=C(Br)C=CC=C1Cl CS12691 [1,1,0,0,0,0|2,0,0]=4 913 B10R1.245 O=CC1=C(Br)C=CC=C1F CS10228 [1,1,0,0,0,0|2,0,0]=4 914 B10R1.245 O=CC1=C(Br)C=CC=C1O CS21383 [1,1,0,0,0,0|1,0,0]=3 915 B10R1.245 O=CC1=C(Cl)C=CC=C1Cl CS16083 [1,1,0,0,0,0|2,0,0]=4 916 B10R1.245 O=CC1=C(Cl)C=CC=C1F CS10261 [1,1,0,0,0,0|2,0,0]=4 917 B10R1.245 O=CC1=C(Cl)C=CC=C1I MC30043 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.245 O=CC1=C(Cl)C=CC=C1O CS20108 [1,1,0,0,0,0|1,0,0]=3 919 B10R1.245 O=CC1=C(F)C=CC=C1F CS10283 [1,1,0,0,0,0|2,0,0]=4 920 B10R1.245 O=CC1=C(F)C=CC=C1I MC442380 [1,1,0,0,0,0|2,0,0]=4 921 B10R1.245 O=CC1=C(F)C=CC=C1O CS20127 [1,1,0,0,0,0|1,0,0]=3 922 B10R1.39 COC1=CSC=C1C(=O)O CS19448 [0,1,0,0,1,0|2,0,0]=4 923 B12R1.46 CC(C)C1=C(C=O)C=CC(O)=C1 MC441224 [0,2,0,0,0,0|2,0,0]=4 924 B12R1.46 CCC1=C(C(=O)O)C=C(I)C=C1 MC111699 [0,2,0,0,0,0|2,0,0]=4 925 B12R1.46 COC1=C(B(O)O)C=C(Br)C=C1 CS20347 [0,2,0,0,0,0|2,0,0]=4 926 B12R1.46 COC1=C(B(O)O)C=C(C)C=C1 MC442902 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.46 COC1=C(B(O)O)C=C(Cl)C=C1 MC441712 [0,2,0,0,0,0|2,0,0]=4 928 B12R1.46 COC1=C(B(O)O)C=C(F)C=C1 MC41823 [0,2,0,0,0,0|2,0,0]=4 929 B12R1.46 COC1=C(C(=O)Cl)C=C(F)C=C1 MC40478 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=C1 CS14019 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=N1 CS20188 [0,2,0,0,0,0|2,0,0]=4 932 B12R1.46 COC1=C(C(=O)O)C=C(C)C=C1 MC40300 [0,2,0,0,0,0|1,0,0]=3 933 B12R1.46 COC1=C(C(=O)O)C=C(Cl)C=C1 CS20833 [0,2,0,0,0,0|1,0,0]=3 934 B12R1.46 COC1=C(C(=O)O)C=C(F)C=C1 MC10307 [0,2,0,0,0,0|1,0,0]=3 935 B12R1.46 COC1=C(C(=O)O)C=C(F)C=C1 MC30024 [0,2,0,0,0,0|1,0,0]=3 936 B12R1.46 COC1=C(C(C)=O)C=C(Cl)C=C1 MC442666 [0,2,0,0,0,0|0,0,1]=3 937 B12R1.46 COC1=C(C(C)=O)C=C(F)C=C1 MC41253 [0,2,0,0,0,0|0,0,1]=3 938 B12R1.46 COC1=C([N+](=O)[O-])C=C(Br)C=C1 CS10404 [0,2,0,0,0,0|2,0,0]=4 939 B12R1.46 COC1=C([N+](=O)[O-])C=C(C)C=C1 MC41347 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.46 COC1=C([N+](=O)[O-])C=C(Cl)C=C1 MC41333 [0,2,0,0,0,0|2,0,0]=4 941 B12R1.46 COC1=C([N+](=O)[O-])C=C(F)C=C1 MC433071 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.46 COC1=C([N+](=O)[O-])C=C(I)C=C1 MC41345 [0,2,0,0,0,0|2,0,0]=4 943 B12R1.46 COC1=C([N+](=O)[O-])C=C(N)C=C1 CS20387 [0,2,0,0,0,0|2,0,0]=4 944 B12R1.46 COC1=C([N+](=O)[O-])C=C(O)C=C1 MC20905 [0,2,0,0,0,0|2,0,0]=4 945 B12R1.46 COC1=CC=C(C)N=C1C(=O)O MC111035 [0,2,0,0,0,0|2,0,0]=4 946 B12R1.46 COC1=CN=C(Br)C=C1C(=O)O MC432218 [0,2,0,0,0,0|2,0,0]=4 947 B12R1.57 CN(C)C1=C(C=O)C=C(Br)C=C1 CS16269 [0,2,0,0,0,0|2,0,0]=4 948 B12R1.57 COC1=C(B(O)O)C=CC(C)=C1 MC442046 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.57 COC1=C(B(O)O)C=CC(Cl)=C1 MC442036 [0,2,0,0,0,0|2,0,0]=4 950 B12R1.57 COC1=C(B(O)O)C=CC(F)=C1 CS20358 [0,2,0,0,0,0|2,0,0]=4 951 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=C1 CS22649 [0,2,0,0,0,0|1,0,0]=3 952 B12R1.57 COC1=C(C(=O)O)C=CC(Br)=N1 MC431231 [0,2,0,0,0,0|2,0,0]=4 953 B12R1.57 COC1=C(C(=O)O)C=CC(C)=C1 MC40301 [0,2,0,0,0,0|1,0,0]=3 954 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=C1 CS10785 [0,2,0,0,0,0|1,0,0]=3 955 B12R1.57 COC1=C(C(=O)O)C=CC(Cl)=N1 MC441307 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.57 COC1=C(C(=O)O)C=CC(F)=C1 CS14268 [0,2,0,0,0,0|1,0,0]=3 957 B12R1.57 COC1=C(C(=O)O)C=CC(F)=N1 MC441122 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.57 COC1=C(C(=O)O)C=CC(O)=C1 MC442318 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.57 COC1=C(C(C)=O)C=CC(Br)=C1 CS16731 [0,2,0,0,0,0|0,0,1]=3 960 B12R1.57 COC1=C(C(C)=O)C=CC(F)=C1 MC31158 [0,2,0,0,0,0|0,0,1]=3 961 B12R1.57 COC1=C(C(C)=O)C=NC(N)=C1 MC429827 [0,2,0,0,0,0|1,0,1]=4 962 B12R1.57 COC1=C([N+](=O)[O-])C=CC(Br)=C1 MC433364 [0,2,0,0,0,0|2,0,0]=4 963 B12R1.57 COC1=C([N+](=O)[O-])C=CC(C)=C1 MC433396 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.57 COC1=C([N+](=O)[O-])C=CC(Cl)=C1 MC30061 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.57 COC1=C([N+](=O)[O-])C=CC(F)=C1 CS14411 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.57 COC1=C([N+](=O)[O-])C=CC(N)=C1 CS16631 [0,2,0,0,0,0|2,0,0]=4 967 B12R1.57 COC1=C([N+](=O)[O-])C=CC(O)=C1 CS12660 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.57 COC1=CC(Br)=CN=C1C(C)=O CS17619 [0,2,0,0,0,0|1,0,1]=4 969 B12R1.57 COC1=CC(Cl)=NC=C1C(=O)O CS10679 [0,2,0,0,0,0|2,0,0]=4 970 B12R1.78 C#CC1=CC(OC)=C(OC)C=C1 MC106594 [0,2,0,0,0,0|1,0,1]=4 971 B12R1.78 COC1=C(C=O)C=C(C#N)C=C1 MC430926 [0,2,0,0,0,0|1,0,0]=3 972 B12R1.78 COC1=C(C=O)C=CC(C#N)=C1 CS21535 [0,2,0,0,0,0|1,0,0]=3 973 B12R1.78 COC1=C(CBr)C=CC(C#N)=C1 MC33029 [0,2,0,0,0,0|1,0,1]=4 974 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 MC40649 [0,2,0,0,0,0|1,0,1]=4 975 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 MC10449 [0,2,0,0,0,0|1,0,1]=4 976 B12R1.78 COC1=C(OC)C=C(CBr)C=C1 CS21945 [0,2,0,0,0,0|1,0,1]=4 977 B12R1.78 COC1=C(OC)C=C(CCl)C=C1 MC10289 [0,2,0,0,0,0|1,0,1]=4 978 B12R1.78 COC1=C(OC)C=C(CO)C=C1 CS19420 [0,2,0,0,0,0|1,0,1]=4 979 B12R1.78 COC1=C(OC)C=C(NN)C=C1 MC40996 [0,2,0,0,0,0|1,0,1]=4 980 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 MC40648 [0,2,0,0,0,0|1,0,1]=4 981 B12R1.78 COC1=CC(C=O)=C(OC)C=C1 MC20085 [0,2,0,0,0,0|1,0,0]=3 982 B12R1.78 COC1=CC(OC)=C(C#N)C=C1 MC433125 [0,2,0,0,0,0|1,0,1]=4 983 B12R1.78 COC1=CC(OC)=C(C=O)C=C1 CS15286 [0,2,0,0,0,0|1,0,0]=3 984 B12R1.78 COC1=CC(OC)=C(CCl)C=C1 MC10526 [0,2,0,0,0,0|1,0,1]=4 985 B12R1.78 COC1=CC(OC)=C(CN)C=C1 CS15120 [0,2,0,0,0,0|1,0,1]=4 986 B12R1.78 COC1=CC(OC)=C(CO)C=C1 CS21200 [0,2,0,0,0,0|1,0,1]=4 987 B12R1.78 COC1=CC(OC)=C(OC)C=C1 CS18710 [0,2,0,0,0,0|1,0,1]=4 988 B12R1.112 COC1=C(CC#N)C=CC(Br)=C1 MC40760 [0,2,0,0,0,0|0,0,2]=4 989 B12R1.112 COC1=C(CC#N)C=CC(Cl)=C1 MC40766 [0,2,0,0,0,0|0,0,2]=4 990 B12R1.112 COC1=C(CC#N)C=CC(F)=C1 MC40774 [0,2,0,0,0,0|0,0,2]=4 991 B12R1.234 CNC1=C(OC)C=C(Br)C=C1N MC111682 [0,2,0,0,0,0|1,0,1]=4 992 B12R1.234 COC1=C(C#N)C(C)=CC(Br)=C1 MC427541 [0,2,0,0,0,0|1,0,1]=4 993 B12R1.234 COC1=C(C=O)C(C)=CC(Br)=C1 MC427135 [0,2,0,0,0,0|1,0,0]=3 994 B12R1.234 COC1=C(C=O)C=C(Br)C=C1F MC110563 [0,2,0,0,0,0|1,0,0]=3 995 B12R1.234 COC1=C(C=O)C=C(F)C=C1F MC430894 [0,2,0,0,0,0|1,0,0]=3 996 B12R1.234 COC1=C(CBr)C=C(F)C=C1F MC40547 [0,2,0,0,0,0|1,0,1]=4 997 B12R1.234 COC1=C(CO)C=C(Br)C=C1F MC115319 [0,2,0,0,0,0|1,0,1]=4 998 B12R1.234 COC1=C(CO)C=C(F)C=C1F MC430756 [0,2,0,0,0,0|1,0,1]=4 999 B12R1.234 COC1=C(OC)C(F)=CC(I)=C1 MC432233 [0,2,0,0,0,0|1,0,1]=4 1000 B12R1.234 COC1=CC(Br)=CC(F)=C1C=O MC105790 [0,2,0,0,0,0|1,0,0]=3 1001 B12R1.234 COC1=CC(Cl)=CC(F)=C1C=O MC429617 [0,2,0,0,0,0|1,0,0]=3 1002 B12R1.234 COC1=CC(O)=CC(Br)=C1OC MC114799 [0,2,0,0,0,0|1,0,1]=4 1003 B12R1.268 COC1=C(CC#N)C=C(Br)C=C1 CS10269 [0,2,0,0,0,0|0,0,2]=4 1004 B12R1.268 COC1=C(CC#N)C=C(Cl)C=C1 CS20218 [0,2,0,0,0,0|0,0,2]=4 1005 B12R1.448 COC1=C(C#N)C=C(F)C(F)=C1 MC433111 [0,2,0,0,0,0|1,0,1]=4 1006 B12R1.448 COC1=C(C=O)C=C(F)C(F)=C1 MC433432 [0,2,0,0,0,0|1,0,0]=3 1007 B12R1.448 COC1=C(CO)C=C(Br)C(F)=C1 MC115325 [0,2,0,0,0,0|1,0,1]=4 1008 B12R1.448 COC1=C(OC)C=C(Br)C(F)=C1 MC41353 [0,2,0,0,0,0|1,0,1]=4 1009 B12R1.448 COC1=CC(C)=C(N)C=C1OC CS10914 [0,2,0,0,0,0|1,0,1]=4 1010 B12R1.652 COC1=CC=C(Br)C(F)=C1C=O MC433408 [0,2,0,0,0,0|1,0,0]=3 1011 B12R1.652 COC1=CC=C(F)C(F)=C1C#N MC20254 [0,2,0,0,0,0|1,0,1]=4 1012 B12R1.75 COC1=C(CC(=O)O)C=CC=C1 CS16300 [0,2,0,0,0,0|0,0,1]=3 1013 B12R1.75 COC1=C(OC(C)=O)C=CC=C1 MC40006 [0,2,0,0,0,0|0,0,1]=3 1014 B12R1.75 FC(F)OC1=C(CBr)C=CC=C1 MC40548 [0,2,0,0,0,0|1,0,1]=4 1015 B12R1.75 NCC1=C(OC(F)F)C=CC=C1 MC40817 [0,2,0,0,0,0|1,0,1]=4 1016 B12R1.75 O=CC1=C(OC(F)F)C=CC=C1 MC33191 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.75 O=CC1=NC=CC=C1OC(F)F MC429862 [0,2,0,0,0,0|2,0,0]=4 1018 B12R1.75 OCC1=C(OC(F)F)C=CC=C1 MC40702 [0,2,0,0,0,0|1,0,1]=4 1019 B12R1.77 C=CC1=C(C(=O)OC)C=CC=N1 MC429151 [0,2,0,0,0,0|1,0,0]=3 1020 B12R1.77 COC(=O)C1=C(C#N)C=CC=C1 MC40089 [0,2,0,0,0,0|1,0,1]=4 1021 B12R1.77 COC(=O)C1=C(C=O)C=CC=C1 CS21630 [0,2,0,0,0,0|1,0,0]=3 1022 B12R1.77 COC(=O)C1=C(C=O)N=CC=C1 MC431364 [0,2,0,0,0,0|2,0,0]=4 1023 B12R1.77 COC(=O)C1=C(CBr)C=CC=C1 CS18185 [0,2,0,0,0,0|1,0,1]=4 1024 B12R1.77 COC(=O)C1=C(OC)C=NC=C1 MC431681 [0,2,0,0,0,0|1,0,1]=4 1025 B12R1.77 COC(=O)C1=C(OC)N=CC=C1 CS13707 [0,2,0,0,0,0|1,0,1]=4 1026 B12R1.77 COC(=O)C1=CN=CC=C1OC MC425461 [0,2,0,0,0,0|1,0,1]=4 1027 B12R1.77 COC(=O)C1=NC=CC=C1C=O MC102694 [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.77 COC(=O)C1=NC=CC=C1OC CS22344 [0,2,0,0,0,0|1,0,1]=4 1029 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 CS11020 [0,2,0,0,0,0|0,0,1]=3 1030 B12R1.121 COC1=C(OCC=O)C=CC=C1 MC112452 [0,2,0,0,0,0|0,0,1]=3 1031 B12R1.121 COC1=C(OCCN)C=CC=C1 CS21224 [0,2,0,0,0,0|0,0,2]=4 1032 B12R1.121 COC1=C(\C=C\C=O)C=CC=C1 CS15311 [0,2,0,0,0,0|0,0,0]=2 1033 B12R1.169 CCOC1=C(N=C=S)C=CC=C1 MC41070 [0,2,0,0,0,0|1,0,1]=4 1034 B12R1.283 CCOC1=C(C(=O)O)C=CC=C1 CS13616 [0,2,0,0,0,0|1,0,0]=3 1035 B12R1.283 CCOC1=C([N+](=O)[O-])C=CC=C1 MC41361 [0,2,0,0,0,0|2,0,0]=4 1036 B12R1.283 CCOC1=CC=CN=C1C(=O)O MC41614 [0,2,0,0,0,0|2,0,0]=4 1037 B12R1.542 CCOC1=C(C=O)C(I)=CC=N1 MC102789 [0,2,0,0,0,0|2,0,0]=4 1038 B12R1.1112 C=CC1=CC=CC(Br)=C1OCC MC112461 [0,2,0,0,0,0|0,0,0]=2 1039 B12R1.1112 CCOC1=C(C=O)C=CC=C1Br MC103354 [0,2,0,0,0,0|1,0,0]=3 1040 B12R1.1112 COC1=CC=CC(F)=C1CC#N MC40773 [0,2,0,0,0,0|0,0,2]=4 1041 B12R1.76 C=CC1=C(C(F)(F)F)C=CC=C1 MC41564 [0,2,0,0,0,0|2,0,0]=4 1042 B12R1.87 COC1=C(B(O)O)C=CC=C1Br CS16115 [0,2,0,0,0,0|2,0,0]=4 1043 B12R1.87 COC1=C(B(O)O)C=CC=C1C MC442415 [0,2,0,0,0,0|2,0,0]=4 1044 B12R1.87 COC1=C(B(O)O)C=CC=C1F CS11072 [0,2,0,0,0,0|2,0,0]=4 1045 B12R1.87 COC1=C(C(=O)O)C=CC=C1Cl CS22208 [0,2,0,0,0,0|1,0,0]=3 1046 B12R1.87 COC1=C(C(=O)O)C=CC=C1F MC30253 [0,2,0,0,0,0|1,0,0]=3 1047 B12R1.87 COC1=C(C(=O)O)C=CC=C1N MC442094 [0,2,0,0,0,0|1,0,0]=3 1048 B12R1.87 COC1=C(C(C)=O)C=CC=C1Br MC442667 [0,2,0,0,0,0|0,0,1]=3 1049 B12R1.87 COC1=C(C(C)=O)C=CC=C1O MC443238 [0,2,0,0,0,0|0,0,1]=3 1050 B12R1.87 COC1=C(Cl)C=CC=C1[N+](=O)[O-] MC433369 [0,2,0,0,0,0|2,0,0]=4 1051 B12R1.87 COC1=C(F)C=CC=C1[N+](=O)[O-] MC30065 [0,2,0,0,0,0|2,0,0]=4 1052 B12R1.87 COC1=C(F)C=CN=C1C(=O)O MC431069 [0,2,0,0,0,0|2,0,0]=4 1053 B12R1.87 COc1c(Br)cccc1[N+](=O)[O-] MC433363 [0,2,0,0,0,0|2,0,0]=4 1054 B12R1.261 CC(=O)C1=C(C(=O)O)C=CC=C1 MC40221 [0,2,0,0,0,0|2,0,0]=4 1055 B12R1.261 CC(C)C1=C(C(=O)O)C=CC=C1 MC433703 [0,2,0,0,0,0|2,0,0]=4 1056 B12R1.437 COC1=C(C(=O)O)C(=O)NC=C1 MC105963 [0,2,0,0,0,0|2,0,0]=4 1057 B12R1.437 COC1=C(C(=O)O)C(C)=CC=C1 CS21646 [0,2,0,0,0,0|1,0,0]=3 1058 B12R1.437 COC1=C(C(C)=O)C(C)=CC=C1 MC106370 [0,2,0,0,0,0|0,0,1]=3 1059 B12R1.437 COC1=C([N+](=O)[O-])C(Br)=CC=C1 MC41323 [0,2,0,0,0,0|2,0,0]=4 1060 B12R1.437 COC1=C([N+](=O)[O-])C(C)=CC=C1 MC427414 [0,2,0,0,0,0|2,0,0]=4 1061 B12R1.437 COC1=CC=CC(Br)=C1C(=O)O CS21384 [0,2,0,0,0,0|1,0,0]=3 1062 B12R1.437 COC1=CC=CC(Br)=C1C(C)=O CS17977 [0,2,0,0,0,0|0,0,1]=3 1063 B12R1.437 COC1=CC=CC(C)=C1C(N)=O MC433809 [0,2,0,0,0,0|1,0,0]=3 1064 B12R1.437 COC1=CC=CC(Cl)=C1B(O)O MC441471 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.437 COC1=CC=CC(Cl)=C1C(=O)O CS12215 [0,2,0,0,0,0|1,0,0]=3 1066 B12R1.437 COC1=CC=CC(Cl)=C1C(C)=O CS17184 [0,2,0,0,0,0|0,0,1]=3 1067 B12R1.437 COC1=CC=CC(F)=C1B(O)O CS20357 [0,2,0,0,0,0|2,0,0]=4 1068 B12R1.437 COC1=CC=CC(F)=C1C(=O)O CS13643 [0,2,0,0,0,0|1,0,0]=3 1069 B12R1.437 COC1=CC=CC(F)=C1C(C)=O MC430014 [0,2,0,0,0,0|0,0,1]=3 1070 B12R1.437 COC1=CC=CC(F)=C1C(C)O MC430015 [0,2,0,0,0,0|0,0,2]=4 1071 B12R1.437 COC1=CC=CC(F)=C1[N+](=O)[O-] CS12333 [0,2,0,0,0,0|2,0,0]=4 1072 B12R1.437 COC1=CC=CC(N)=C1C(=O)O CS21293 [0,2,0,0,0,0|1,0,0]=3 1073 B12R1.437 COC1=CC=CC(N)=C1[N+](=O)[O-] MC30050 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.437 COC1=CC=NC(Cl)=C1C(=O)Cl MC106016 [0,2,0,0,0,0|2,0,0]=4 1075 B12R1.437 COC1=CC=NC(F)=C1C(=O)O CS16459 [0,2,0,0,0,0|2,0,0]=4 1076 B12R1.437 COC1=CN=CC(O)=C1C(=O)O MC432137 [0,2,0,0,0,0|2,0,0]=4 1077 B12R1.437 COc1cccc(O)c1C(C)=O MC433242 [0,2,0,0,0,0|0,0,1]=3 1078 B12R1.741 COC1=C(CO)C(Cl)=CC=C1Cl MC433858 [0,2,0,0,0,0|1,0,1]=4 1079 B12R1.1879 COC1=CC=CC(C#N)=C1OC MC433772 [0,2,0,0,0,0|1,0,1]=4 1080 B12R1.1879 COC1=CC=CC(C=O)=C1OC CS19374 [0,2,0,0,0,0|1,0,0]=3 1081 B12R1.1879 COC1=CC=CC(OC)=C1C=O MC442704 [0,2,0,0,0,0|1,0,0]=3 1082 B12R1.1879 COC1=CC=CC(OC)=C1OC CS20476 [0,2,0,0,0,0|1,0,1]=4 1083 B12R1.1879 COC1=CN=CC(OC)=C1C=O MC441206 [0,2,0,0,0,0|2,0,0]=4 1084 B10R1.15 C=C(C#N)C1=CC=CC=C1 MC106124 [0,0,1,1,0,0|2,0,0]=4 1085 B10R1.15 C=C(CBr)C1=CC=CC=C1 CS20091 [0,0,1,1,0,0|2,0,0]=4 1086 B10R1.15 COC(=N)C1=NC=CC=C1 MC106728 [0,0,1,1,0,0|2,0,0]=4 1087 B10R1.15 COC(=O)C1=CC=CC=C1 MC40065 [0,0,1,1,0,0|1,0,0]=3 1088 B10R1.15 COC(=O)C1=CC=NC=C1 CS18945 [0,0,1,1,0,0|2,0,0]=4 1089 B10R1.15 COC(=O)C1=CN=CC=C1 CS19425 [0,0,1,1,0,0|2,0,0]=4 1090 B10R1.15 COC(=O)C1=NC=CC=C1 CS19684 [0,0,1,1,0,0|2,0,0]=4 1091 B10R1.172 CCC1=CC=CC(C=O)=C1 CS11688 [0,0,1,1,0,0|2,0,0]=4 1092 B10R1.172 COC1=CC(C=O)=NC=C1 MC425477 [0,0,1,1,0,0|2,0,0]=4 1093 B10R1.172 COC1=CC=CC(C=O)=C1 CS19170 [0,0,1,1,0,0|1,0,0]=3 1094 B10R1.172 COC1=CC=CC(C=O)=N1 CS20321 [0,0,1,1,0,0|2,0,0]=4 1095 B10R1.172 COC1=CC=CC(CCl)=C1 MC10324 [0,0,1,1,0,0|1,0,1]=4 1096 B10R1.172 COC1=CC=CC(CN)=C1 CS19097 [0,0,1,1,0,0|1,0,1]=4 1097 B10R1.172 COC1=CC=CC(CO)=C1 CS19269 [0,0,1,1,0,0|1,0,1]=4 1098 B10R1.172 COC1=CC=CC(NN)=C1 CS19580 [0,0,1,1,0,0|2,0,0]=4 1099 B10R1.172 COC1=CC=CC(OC)=C1 CS19845 [0,0,1,1,0,0|1,0,1]=4 1100 B10R1.172 COC1=CN=CC(C=O)=C1 CS17827 [0,0,1,1,0,0|2,0,0]=4 1101 B10R1.172 COC1=NC=CC(C=O)=C1 CS15775 [0,0,1,1,0,0|2,0,0]=4 1102 B10R1.176 COC1=CC(Br)=C(Br)C=C1 MC433376 [0,0,1,1,0,0|2,0,0]=4 1103 B10R1.176 COC1=CC(Br)=C(Br)C=C1 MC442365 [0,0,1,1,0,0|2,0,0]=4 1104 B10R1.176 COC1=CC(Br)=C(C)C=C1 CS16376 [0,0,1,1,0,0|1,0,1]=4 1105 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 MC433350 [0,0,1,1,0,0|2,0,0]=4 1106 B10R1.176 COC1=CC(Br)=C(F)C=C1 CS15238 [0,0,1,1,0,0|2,0,0]=4 1107 B10R1.176 COC1=CC(Br)=C(N)C=C1 CS21359 [0,0,1,1,0,0|2,0,0]=4 1108 B10R1.176 COC1=CC(Br)=C(O)C=C1 MC30339 [0,0,1,1,0,0|2,0,0]=4 1109 B10R1.176 COC1=CC(Br)=C(O)C=C1 MC41160 [0,0,1,1,0,0|2,0,0]=4 1110 B10R1.176 COC1=CC(C)=C(Br)C=C1 MC33099 [0,0,1,1,0,0|1,0,1]=4 1111 B10R1.176 COC1=CC(C)=C(N)C=C1 CS13421 [0,0,1,1,0,0|1,0,1]=4 1112 B10R1.176 COC1=CC(C)=C(O)C=C1 CS15470 [0,0,1,1,0,0|1,0,1]=4 1113 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 CS14601 [0,0,1,1,0,0|2,0,0]=4 1114 B10R1.176 COC1=CC(Cl)=C(C)C=C1 MC41331 [0,0,1,1,0,0|1,0,1]=4 1115 B10R1.176 COC1=CC(Cl)=C(Cl)C=C1 MC41335 [0,0,1,1,0,0|2,0,0]=4 1116 B10R1.176 COC1=CC(Cl)=C(I)C=C1 MC442237 [0,0,1,1,0,0|2,0,0]=4 1117 B10R1.176 COC1=CC(Cl)=C(N)C=C1 CS14656 [0,0,1,1,0,0|2,0,0]=4 1118 B10R1.176 COC1=CC(Cl)=C(O)C=C1 CS20293 [0,0,1,1,0,0|2,0,0]=4 1119 B10R1.176 COC1=CC(F)=C(Br)C=C1 CS10396 [0,0,1,1,0,0|2,0,0]=4 1120 B10R1.176 COC1=CC(F)=C(C)C=C1 CS10872 [0,0,1,1,0,0|1,0,1]=4 1121 B10R1.176 COC1=CC(F)=C(Cl)C=C1 MC33148 [0,0,1,1,0,0|2,0,0]=4 1122 B10R1.176 COC1=CC(F)=C(N)C=C1 MC40916 [0,0,1,1,0,0|2,0,0]=4 1123 B10R1.176 COC1=CC(F)=C(N)C=C1 MC433345 [0,0,1,1,0,0|2,0,0]=4 1124 B10R1.176 COC1=CC(F)=C(O)C=C1 MC441061 [0,0,1,1,0,0|2,0,0]=4 1125 B10R1.176 COC1=CC(I)=C(Br)C=C1 MC433361 [0,0,1,1,0,0|2,0,0]=4 1126 B10R1.176 COC1=CC(I)=C(N)C=C1 MC20577 [0,0,1,1,0,0|2,0,0]=4 1127 B10R1.176 COC1=CC(N)=C(Br)C=C1 CS18386 [0,0,1,1,0,0|2,0,0]=4 1128 B10R1.176 COC1=CC(N)=C(C)C=C1 CS14868 [0,0,1,1,0,0|1,0,1]=4 1129 B10R1.176 COC1=CC(N)=C(Cl)C=C1 CS13990 [0,0,1,1,0,0|2,0,0]=4 1130 B10R1.176 COC1=CC(N)=C(F)C=C1 CS12726 [0,0,1,1,0,0|2,0,0]=4 1131 B10R1.176 COC1=CC(N)=C(I)C=C1 CS15023 [0,0,1,1,0,0|2,0,0]=4 1132 B10R1.176 COC1=CC(N)=C(I)C=C1 MC30213 [0,0,1,1,0,0|2,0,0]=4 1133 B10R1.176 COC1=CC(N)=C(N)C=C1 MC433373 [0,0,1,1,0,0|2,0,0]=4 1134 B10R1.176 COC1=CC(N)=C(O)C=C1 CS21254 [0,0,1,1,0,0|2,0,0]=4 1135 B10R1.176 COC1=CC(O)=C(Br)C=C1 CS21376 [0,0,1,1,0,0|2,0,0]=4 1136 B10R1.176 COC1=CC(O)=C(Cl)C=C1 MC442395 [0,0,1,1,0,0|2,0,0]=4 1137 B10R1.176 COC1=CC(O)=C(F)C=C1 MC430013 [0,0,1,1,0,0|2,0,0]=4 1138 B10R1.176 COC1=CC(O)=C(N)C=C1 CS21584 [0,0,1,1,0,0|2,0,0]=4 1139 B10R1.176 COC1=CC=C(O)C(O)=C1 MC442392 [0,0,1,1,0,0|2,0,0]=4 1140 B10R2.7 C1=CC2=C(C=C1)CSC2 MC114506 [1,0,0,1,0,0|1,0,1]=4 1141 B10R2.7 C1=CC2=C(C=C1)NC=N2 MC41756 [1,0,0,1,0,0|2,0,0]=4 1142 B10R2.7 C1=CC2=C(C=C1)OC=N2 CS10994 [1,0,0,1,0,0|1,0,0]=3 1143 B10R2.7 C1=CC2=C(C=C1)OCC2 CS20929 [1,0,0,1,0,0|0,0,1]=3 1144 B10R2.7 C1=CC2=C(C=C1)OCO2 CS20505 [1,0,0,1,0,0|1,0,0]=3 1145 B10R2.7 C1=CC2=C(C=C1)SC=C2 CS16362 [1,0,0,1,0,0|0,1,0]=3 1146 B10R2.7 C1=CC2=C(C=C1)SC=N2 CS10992 [1,0,0,1,0,0|1,1,0]=4 1147 B10R2.7 C1=CC2=C(C=CN2)C=N1 CS20237 [1,0,0,1,0,0|2,0,0]=4 1148 B10R2.7 C1=CC2=C(C=CS2)C=N1 MC441330 [1,0,0,1,0,0|1,1,0]=4 1149 B10R2.7 C1=CC2=CC=CN2C=C1 MC441215 [1,0,0,1,0,0|1,0,1]=4 1150 B10R2.7 C1=CC2=CC=NC=C2N1 CS20238 [1,0,0,1,0,0|2,0,0]=4 1151 B10R2.7 C1=CC2=CC=NC=C2O1 MC100123 [1,0,0,1,0,0|1,0,0]=3 1152 B10R2.7 C1=CC2=CC=NC=C2S1 CS13198 [1,0,0,1,0,0|1,1,0]=4 1153 B10R2.7 C1=CC2=CC=NN2C=C1 MC106678 [1,0,0,1,0,0|2,0,0]=4 1154 B10R2.7 C1=CC2=NC=CN2C=C1 CS18927 [1,0,0,1,0,0|2,0,0]=4 1155 B10R2.7 C1=CC=C2CC=CC2=C1 MC20914 [1,0,0,1,0,0|0,0,0]=2 1156 B10R2.7 C1=CC=C2CNCC2=C1 CS11516 [1,0,0,1,0,0|1,0,1]=4 1157 B10R2.7 C1=CC=C2CNCC2=C1 MC442466 [1,0,0,1,0,0|1,0,1]=4 1158 B10R2.7 C1=CC=C2NC=CC2=C1 CS11496 [1,0,0,1,0,0|1,0,0]=3 1159 B10R2.7 C1=CC=C2NCCC2=C1 CS19084 [1,0,0,1,0,0|1,0,1]=4 1160 B10R2.7 C1=CC=C2NN=CC2=C1 CS11488 [1,0,0,1,0,0|2,0,0]=4 1161 B10R2.7 C1=CC=C2OC=CC2=C1 CS11169 [1,0,0,1,0,0|0,0,0]=2 1162 B10R2.7 C1=CN=C2C=CNC2=C1 CS20236 [1,0,0,1,0,0|2,0,0]=4 1163 B10R2.7 C1=CN=C2C=CSC2=C1 CS14375 [1,0,0,1,0,0|1,1,0]=4 1164 B10R2.7 C1=CN=C2NC=CC2=C1 CS10447 [1,0,0,1,0,0|2,0,0]=4 1165 B10R2.7 C1=CN=C2OC=CC2=C1 MC107657 [1,0,0,1,0,0|1,0,0]=3 1166 B10R2.7 C1=CN=C2OCOC2=C1 MC111188 [1,0,0,1,0,0|2,0,0]=4 1167 B10R2.7 C1=CN=C2SC=CC2=C1 CS14590 [1,0,0,1,0,0|1,1,0]=4 1168 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 CS10787 [0,1,0,1,0,0|1,0,1]=4 1169 B12R2.24 BrC1=CC2=C(C=C1)NCCO2 CS15185 [0,1,0,1,0,0|1,0,1]=4 1170 B12R2.24 BrC1=CC2=C(C=C1)OCCN2 CS15468 [0,1,0,1,0,0|1,0,1]=4 1171 B12R2.24 BrC1=CC2=C(C=C1)OCCO2 CS10776 [0,1,0,1,0,0|1,0,1]=4 1172 B12R2.24 BrC1=CC2=CC=CC=C2C=C1 CS19153 [0,1,0,1,0,0|1,0,1]=4 1173 B12R2.24 BrC1=CC2=CC=CC=C2C=N1 CS22177 [0,1,0,1,0,0|2,0,0]=4 1174 B12R2.24 BrC1=CC2=CC=CC=C2N=C1 CS21394 [0,1,0,1,0,0|1,0,1]=4 1175 B12R2.24 BrC1=CC=C2C=CC=NC2=C1 CS19085 [0,1,0,1,0,0|1,0,1]=4 1176 B12R2.24 BrC1=CC=C2C=CN=CC2=C1 CS19165 [0,1,0,1,0,0|2,0,0]=4 1177 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 CS21398 [0,1,0,1,0,0|2,0,0]=4 1178 B12R2.24 BrC1=CC=C2CCCOC2=C1 MC443258 [0,1,0,1,0,0|0,0,2]=4 1179 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 CS10941 [0,1,0,1,0,0|1,0,1]=4 1180 B12R2.24 BrC1=CC=C2N=NC=CC2=C1 CS14598 [0,1,0,1,0,0|2,0,0]=4 1181 B12R2.24 BrC1=CC=C2OCCCC2=C1 CS19916 [0,1,0,1,0,0|0,0,2]=4 1182 B12R2.24 BrC1=NC2=CC=CC=C2C=C1 CS21392 [0,1,0,1,0,0|1,0,1]=4 1183 B12R2.24 CC1=CC2=CC=CC=C2C=N1 CS19703 [0,1,0,1,0,0|2,0,0]=4 1184 B12R2.24 CC1=CC2=CC=CC=C2N=C1 CS11336 [0,1,0,1,0,0|1,0,1]=4 1185 B12R2.24 CC1=CC=C2C=CC=NC2=C1 MC20324 [0,1,0,1,0,0|1,0,1]=4 1186 B12R2.24 CC1=CC=C2C=NC=CC2=C1 CS10742 [0,1,0,1,0,0|2,0,0]=4 1187 B12R2.24 CC1=CC=C2N=CC=CC2=C1 CS10066 [0,1,0,1,0,0|1,0,1]=4 1188 B12R2.24 CC1=NC2=CC=CC=C2C=C1 CS11335 [0,1,0,1,0,0|1,0,0]=3 1189 B12R2.24 CC1=NC2=CN=CC=C2C=C1 MC111420 [0,1,0,1,0,0|2,0,0]=4 1190 B12R2.24 CC1=NC2=NC=CC=C2C=C1 CS18023 [0,1,0,1,0,0|2,0,0]=4 1191 B12R2.24 ClC1=CC2=C(C=C1)NCCO2 MC443200 [0,1,0,1,0,0|1,0,1]=4 1192 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 MC441073 [0,1,0,1,0,0|1,0,1]=4 1193 B12R2.24 ClC1=CC2=CC=CC=C2C=N1 CS22238 [0,1,0,1,0,0|2,0,0]=4 1194 B12R2.24 ClC1=CC2=CC=CC=C2N=C1 CS22245 [0,1,0,1,0,0|1,0,1]=4 1195 B12R2.24 ClC1=CC=C2C=CC=NC2=C1 CS10811 [0,1,0,1,0,0|1,0,1]=4 1196 B12R2.24 ClC1=CC=C2C=NC=CC2=C1 CS11526 [0,1,0,1,0,0|2,0,0]=4 1197 B12R2.24 ClC1=CC=C2N=CC=CC2=C1 CS21425 [0,1,0,1,0,0|1,0,1]=4 1198 B12R2.24 ClC1=NC2=CC=CC=C2C=C1 CS21419 [0,1,0,1,0,0|1,0,1]=4 1199 B12R2.24 FC1=CC2=CC=CC=C2C=N1 MC429919 [0,1,0,1,0,0|2,0,0]=4 1200 B12R2.24 FC1=CC=C2C=NC=CC2=C1 CS14751 [0,1,0,1,0,0|2,0,0]=4 1201 B12R2.24 FC1=CC=C2N=CC=CC2=C1 CS12098 [0,1,0,1,0,0|1,0,1]=4 1202 B12R2.24 IC1=CC=C2N=CC=CC2=C1 MC30340 [0,1,0,1,0,0|1,0,1]=4 1203 B12R2.24 IC1=CC=C2OCCCC2=C1 MC425133 [0,1,0,1,0,0|0,0,2]=4 1204 B12R2.24 NC1=CC2=C(C=C1)NCCO2 MC442710 [0,1,0,1,0,0|1,0,1]=4 1205 B12R2.24 NC1=CC2=CC=CC=C2C=C1 MC41753 [0,1,0,1,0,0|1,0,1]=4 1206 B12R2.24 NC1=CC2=CC=CC=C2C=N1 CS21593 [0,1,0,1,0,0|2,0,0]=4 1207 B12R2.24 NC1=CC2=CC=CC=C2N=C1 CS11010 [0,1,0,1,0,0|1,0,1]=4 1208 B12R2.24 NC1=CC=C2C=CC=NC2=C1 CS12077 [0,1,0,1,0,0|1,0,1]=4 1209 B12R2.24 NC1=CC=C2C=CN=CC2=C1 CS18893 [0,1,0,1,0,0|2,0,0]=4 1210 B12R2.24 NC1=CC=C2C=NC=CC2=C1 CS18181 [0,1,0,1,0,0|2,0,0]=4 1211 B12R2.24 NC1=CC=C2N=CC=CC2=C1 CS11016 [0,1,0,1,0,0|1,0,1]=4 1212 B12R2.24 NC1=NC2=CC=CC=C2C=C1 CS11009 [0,1,0,1,0,0|1,0,1]=4 1213 B12R2.24 O=C1C=C2C=CC=CC2=NN1 CS16596 [0,1,0,1,0,0|2,0,0]=4 1214 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 MC440135 [0,1,0,1,0,0|1,0,1]=4 1215 B12R2.24 O=C1CCC2=CC=CC=C2N1 CS11038 [0,1,0,1,0,0|2,0,0]=4 1216 B12R2.24 O=C1CCc2ccccc2O1 MC41795 [0,1,0,1,0,0|2,0,0]=4 1217 B12R2.24 O=C1COC2=C(C=CC=C2)N1 CS21568 [0,1,0,1,0,0|1,0,0]=3 1218 B12R2.24 O=C1COC2=C(C=CN=C2)N1 MC425525 [0,1,0,1,0,0|2,0,0]=4 1219 B12R2.24 O=C1COC2=C(C=NC=C2)N1 MC425642 [0,1,0,1,0,0|2,0,0]=4 1220 B12R2.24 O=C1CSC2=CC=CC=C2C1 MC107174 [0,1,0,1,0,0|0,1,1]=4 1221 B12R2.24 OC1=CC2=C(C=C1)NCCO2 MC442455 [0,1,0,1,0,0|1,0,1]=4 1222 B12R2.24 OC1=CC2=C(C=C1)OCCO2 MC429083 [0,1,0,1,0,0|1,0,1]=4 1223 B12R2.24 OC1=CC2=CC=CC=C2C=C1 CS21708 [0,1,0,1,0,0|1,0,1]=4 1224 B12R2.24 OC1=CC2=CC=CC=C2N=C1 CS19154 [0,1,0,1,0,0|1,0,1]=4 1225 B12R2.24 OC1=CC=C2C=CC=NC2=C1 CS10982 [0,1,0,1,0,0|1,0,1]=4 1226 B12R2.24 OC1=CC=C2C=CN=CC2=C1 MC441084 [0,1,0,1,0,0|2,0,0]=4 1227 B12R2.24 OC1=CC=C2C=NC=CC2=C1 CS18471 [0,1,0,1,0,0|2,0,0]=4 1228 B12R2.24 [O-][N+]1=CC2=CC=CC=C2C=C1 CS21529 [0,1,0,1,0,0|2,0,0]=4 1229 B12R2.132 CC1=CC2=C(C=C1)N=CN2C CS17127 [0,1,0,1,0,0|2,0,0]=4 1230 B12R2.132 CC1=CC2=C(C=C1)ON=C2N CS16622 [0,1,0,1,0,0|2,0,0]=4 1231 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 MC446759 [0,1,0,1,0,0|2,0,0]=4 1232 B12R2.132 CC1=CNC2=CC=C(O)C=C12 CS14814 [0,1,0,1,0,0|2,0,0]=4 1233 B12R2.132 CC1=COC2=C1C=C(Br)C=C2 MC441297 [0,1,0,1,0,0|0,0,2]=4 1234 B12R2.132 CC1=COC2=C1C=C(F)C=C2 MC427320 [0,1,0,1,0,0|0,0,2]=4 1235 B12R2.132 CC1=CSC2=C1C=C(Br)C=C2 MC100206 [0,1,0,1,0,0|2,0,0]=4 1236 B12R2.132 CC1=CSC2=C1C=C(Cl)C=C2 MC441868 [0,1,0,1,0,0|2,0,0]=4 1237 B12R2.132 CC1=CSC2=C1C=C(F)C=C2 MC441869 [0,1,0,1,0,0|2,0,0]=4 1238 B12R2.132 CC1=NC=C2OCC(=O)C2=C1 MC102724 [0,1,0,1,0,0|2,0,0]=4 1239 B12R2.132 CC1=NOC2=C1C=C(N)C=C2 CS16745 [0,1,0,1,0,0|1,0,1]=4 1240 B12R2.132 CN1C=CC2=CC=C(N)N=C21 MC104469 [0,1,0,1,0,0|2,0,0]=4 1241 B12R2.132 CN1C=CC2=NC=C(Br)C=C21 MC443718 [0,1,0,1,0,0|2,0,0]=4 1242 B12R2.132 CN1N=CC2=CC=C(Br)C=C21 CS12391 [0,1,0,1,0,0|2,0,0]=4 1243 B12R2.132 CN1N=CC2=CC=C(F)C=C21 CS12396 [0,1,0,1,0,0|2,0,0]=4 1244 B12R2.132 CN1N=CC2=CC=C(I)C=C21 MC443447 [0,1,0,1,0,0|2,0,0]=4 1245 B12R2.132 CN1N=CC2=CC=C(N)C=C21 MC444404 [0,1,0,1,0,0|2,0,0]=4 1246 B12R2.132 Cn1ccc2ccc(N)nc21 MC104470 [0,1,0,1,0,0|2,0,0]=4 1247 B12R2.132 FC1=CC2=C(C=C1)ON=C2Cl MC445698 [0,1,0,1,0,0|2,0,0]=4 1248 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 MC446750 [0,1,0,1,0,0|2,0,0]=4 1249 B12R2.132 NC1=NOC2=C1C=C(Br)C=C2 CS18317 [0,1,0,1,0,0|2,0,0]=4 1250 B12R2.132 NC1COC2=C1C=C(F)C=C2 MC431482 [0,1,0,1,0,0|1,0,1]=4 1251 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 CS18733 [0,1,0,1,0,0|2,0,0]=4 1252 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 CS13722 [0,1,0,1,0,0|2,0,0]=4 1253 B12R2.132 O=C1CCC2=CC=C(F)C=C12 MC429567 [0,1,0,1,0,0|2,0,0]=4 1254 B12R2.132 O=C1CCC2=CC=C(I)C=C12 CS19840 [0,1,0,1,0,0|2,0,0]=4 1255 B12R2.132 O=C1CCC2=CC=C(O)C=C12 CS15371 [0,1,0,1,0,0|2,0,0]=4 1256 B12R2.132 O=C1COC2=C1C=C(Br)C=C2 CS18239 [0,1,0,1,0,0|1,0,0]=3 1257 B12R2.132 O=C1COC2=C1C=C(Cl)C=C2 MC428126 [0,1,0,1,0,0|1,0,0]=3 1258 B12R2.132 O=C1COC2=C1C=C(F)C=C2 MC113784 [0,1,0,1,0,0|1,0,0]=3 1259 B12R2.132 O=C1COC2=C1C=C(I)C=C2 MC100482 [0,1,0,1,0,0|1,0,0]=3 1260 B12R2.132 O=C1NOC2=C1C=C(Br)C=C2 CS15251 [0,1,0,1,0,0|2,0,0]=4 1261 B12R2.132 O=C1NOC2=C1C=C(Cl)C=C2 MC427277 [0,1,0,1,0,0|2,0,0]=4 1262 B12R2.132 O=C1NOC2=C1C=C(F)C=C2 CS16834 [0,1,0,1,0,0|2,0,0]=4 1263 B12R2.612 CC1=CC2=C(C=C1)C(=O)NO2 MC115929 [0,1,0,1,0,0|2,0,0]=4 1264 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 MC446693 [0,1,0,1,0,0|2,0,0]=4 1265 B12R2.612 CC1=COC2=C1C=CC(Br)=C2 MC441296 [0,1,0,1,0,0|0,0,2]=4 1266 B12R2.612 CC1=CSC2=C1C=CC(Br)=C2 MC441272 [0,1,0,1,0,0|2,0,0]=4 1267 B12R2.612 CC1=CSC2=C1C=CC(Cl)=C2 MC441867 [0,1,0,1,0,0|2,0,0]=4 1268 B12R2.612 CC1=NOC2=C1C=CC(O)=C2 CS12249 [0,1,0,1,0,0|1,0,1]=4 1269 B12R2.612 CN1C=CC2=CC(Br)=CC=C21 CS10246 [0,1,0,1,0,0|1,0,0]=3 1270 B12R2.612 CN1C=CC2=CC(Br)=CN=C21 MC443223 [0,1,0,1,0,0|2,0,0]=4 1271 B12R2.612 CN1C=CC2=CC(N)=CN=C21 MC113007 [0,1,0,1,0,0|2,0,0]=4 1272 B12R2.612 CN1C=CC2=CC(O)=CC=C21 MC102986 [0,1,0,1,0,0|1,0,0]=3 1273 B12R2.612 CN1C=CC2=CC(O)=CN=C21 MC425497 [0,1,0,1,0,0|2,0,0]=4 1274 B12R2.612 CN1C=NC2=C1C=CC(Br)=C2 MC442223 [0,1,0,1,0,0|2,0,0]=4 1275 B12R2.612 CN1C=NC2=C1C=CC(O)=C2 MC33533 [0,1,0,1,0,0|2,0,0]=4 1276 B12R2.612 CN1N=CC2=CC(Br)=CC=C21 MC41765 [0,1,0,1,0,0|2,0,0]=4 1277 B12R2.612 CN1N=CC2=CC(N)=CC=C21 CS18338 [0,1,0,1,0,0|2,0,0]=4 1278 B12R2.612 CN1N=CC2=CC(O)=CC=C21 CS13076 [0,1,0,1,0,0|2,0,0]=4 1279 B12R2.612 ClC1=CC2=C(C=C1)C(Cl)=NO2 CS15249 [0,1,0,1,0,0|2,0,0]=4 1280 B12R2.612 ClC1=NOC2=C1C=CC(Br)=C2 MC442243 [0,1,0,1,0,0|2,0,0]=4 1281 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NO2 MC115930 [0,1,0,1,0,0|2,0,0]=4 1282 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 MC446737 [0,1,0,1,0,0|2,0,0]=4 1283 B12R2.612 NC1=NOC2=C1C=CC(Br)=C2 CS10654 [0,1,0,1,0,0|2,0,0]=4 1284 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 CS21498 [0,1,0,1,0,0|2,0,0]=4 1285 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 CS22043 [0,1,0,1,0,0|2,0,0]=4 1286 B12R2.612 O=C1CCC2=CC(F)=CC=C12 MC10164 [0,1,0,1,0,0|2,0,0]=4 1287 B12R2.612 O=C1CCC2=CC(O)=CC=C12 CS11017 [0,1,0,1,0,0|2,0,0]=4 1288 B12R2.612 O=C1COC2=C1C=CC(Br)=C2 MC115907 [0,1,0,1,0,0|1,0,0]=3 1289 B12R2.612 O=C1COC2=C1C=CC(Cl)=C2 CS15082 [0,1,0,1,0,0|1,0,0]=3 1290 B12R2.612 O=C1COC2=C1C=CC(O)=C2 CS20793 [0,1,0,1,0,0|1,0,0]=3 1291 B12R2.612 O=C1NOC2=C1C=CC(F)=C2 CS16833 [0,1,0,1,0,0|2,0,0]=4 1292 B12R2.612 OC1=NOC2=C1C=CC(Cl)=C2 MC20600 [0,1,0,1,0,0|2,0,0]=4 1293 B12R2.1 BrCC1=CSC2=C1C=CC=C2 CS17544 [0,1,0,1,0,0|2,0,0]=4 1294 B12R2.1 COC1=NNC2=CC=CC=C21 MC428325 [0,1,0,1,0,0|2,0,0]=4 1295 B12R2.1 NCC1=CNC2=CC=CC=C12 CS20093 [0,1,0,1,0,0|2,0,0]=4 1296 B12R2.1 O=CC1=CNC2=CC=CC=C12 CS21525 [0,1,0,1,0,0|1,0,1]=4 1297 B12R2.1 O=CC1=COC2=NC=CC=C12 MC430546 [0,1,0,1,0,0|1,0,1]=4 1298 B12R2.1 O=CC1=CSC2=C1C=CC=C2 CS21482 [0,1,0,1,0,0|0,1,1]=4 1299 B12R2.1 O=CC1=NNC2=CC=CC=C21 CS20713 [0,1,0,1,0,0|2,0,0]=4 1300 B12R2.1 OCC1=CNC2=C1C=CC=C2 MC20402 [0,1,0,1,0,0|2,0,0]=4 1301 B12R2.1 OCN1C=NC2=C1C=CC=C2 MC33419 [0,1,0,1,0,0|2,0,0]=4 1302 B12R2.18 CC1=C(Br)C2=C(C=CC=C2)S1 CS22136 [0,1,0,1,0,0|1,1,0]=4 1303 B12R2.18 CC1=C(O)C2=NC=CC=C2O1 MC427139 [0,1,0,1,0,0|2,0,0]=4 1304 B12R2.18 CC1=CC2=CC=CC=C2N1C CS10010 [0,1,0,1,0,0|1,0,0]=3 1305 B12R2.18 CC1CC2=CC=CC=C2C1=O MC446688 [0,1,0,1,0,0|2,0,0]=4 1306 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 MC10211 [0,1,0,1,0,0|2,0,0]=4 1307 B12R2.18 CN1C(N)=CC2=CC=CC=C21 MC106654 [0,1,0,1,0,0|1,0,0]=3 1308 B12R2.18 CN1N=C2C=CC=CC2=C1Br MC104938 [0,1,0,1,0,0|2,0,0]=4 1309 B12R2.18 CN1NC2=CC=CC=C2C1=O MC442274 [0,1,0,1,0,0|2,0,0]=4 1310 B12R2.315 BrCC1=CC=CC2=C1OCO2 CS15539 [0,1,0,1,0,0|1,0,1]=4 1311 B12R2.315 BrCC1=CC=CC2=C1SC=C2 CS17546 [0,1,0,1,0,0|2,0,0]=4 1312 B12R2.315 COC1=C2C=CNC2=CC=C1 CS21717 [0,1,0,1,0,0|0,0,0]=2 1313 B12R2.315 COC1=C2C=CNC2=NC=C1 MC10480 [0,1,0,1,0,0|1,0,0]=3 1314 B12R2.315 COC1=C2C=NNC2=CC=C1 MC102407 [0,1,0,1,0,0|1,0,0]=3 1315 B12R2.315 COC1=C2C=NNC2=NC=C1 MC110816 [0,1,0,1,0,0|2,0,0]=4 1316 B12R2.315 COC1=C2CNCC2=CC=C1 CS17395 [0,1,0,1,0,0|0,0,2]=4 1317 B12R2.315 COC1=C2CNCC2=CC=C1 MC107634 [0,1,0,1,0,0|0,0,2]=4 1318 B12R2.315 COC1=C2NC=CC2=CN=C1 MC105233 [0,1,0,1,0,0|1,0,0]=3 1319 B12R2.315 COC1=C2NC=CC2=NC=C1 MC105235 [0,1,0,1,0,0|1,0,0]=3 1320 B12R2.315 COC1=C2OC=CC2=CC=N1 MC104057 [0,1,0,1,0,0|1,0,0]=3 1321 B12R2.315 COC1=CC=CC2=C1OC=C2 CS21625 [0,1,0,1,0,0|0,0,0]=2 1322 B12R2.315 COC1=NC=CC2=C1N=CN2 MC427181 [0,1,0,1,0,0|2,0,0]=4 1323 B12R2.315 COC1=NC=CN2C=CN=C12 CS18501 [0,1,0,1,0,0|2,0,0]=4 1324 B12R2.315 N#CC1=C2NC=CC2=CC=C1 CS16384 [0,1,0,1,0,0|2,0,0]=4 1325 B12R2.315 N#CC1=CC=CC2=C1C=CN2 CS10950 [0,1,0,1,0,0|2,0,0]=4 1326 B12R2.315 N#CC1=CC=CC2=C1OCO2 MC442705 [0,1,0,1,0,0|1,0,1]=4 1327 B12R2.315 O=CC1=C2C=COC2=CC=C1 MC441168 [0,1,0,1,0,0|2,0,0]=4 1328 B12R2.315 O=CC1=C2NC=CC2=CC=C1 CS21528 [0,1,0,1,0,0|2,0,0]=4 1329 B12R2.315 O=CC1=CC=CC2=C1C=CN2 CS10984 [0,1,0,1,0,0|2,0,0]=4 1330 B12R2.315 O=CC1=CC=CC2=C1C=CS2 MC441866 [0,1,0,1,0,0|2,0,0]=4 1331 B12R2.315 O=CC1=CC=CC2=C1OCC2 MC442782 [0,1,0,1,0,0|1,0,0]=3 1332 B12R2.315 O=CC1=CC=CC2=C1SC=C2 MC441865 [0,1,0,1,0,0|2,0,0]=4 1333 B12R2.315 O=CC1=CC=CC2=NON=C12 CS22143 [0,1,0,1,0,0|2,0,0]=4 1334 B12R2.315 OCc1cccc2ccoc12 MC103541 [0,1,0,1,0,0|2,0,0]=4 1335 B12R2.1081 BrC1=C2C=CC=NC2=CC=C1 CS21397 [0,1,0,1,0,0|1,0,1]=4 1336 B12R2.1081 BrC1=C2C=CN=CC2=CC=C1 CS21395 [0,1,0,1,0,0|2,0,0]=4 1337 B12R2.1081 BrC1=C2C=NC=CC2=CC=C1 CS21399 [0,1,0,1,0,0|2,0,0]=4 1338 B12R2.1081 BrC1=C2N=CC=CC2=CC=C1 CS21400 [0,1,0,1,0,0|1,0,1]=4 1339 B12R2.1081 BrC1=CC=CC2=CC=CC=C12 CS19505 [0,1,0,1,0,0|1,0,1]=4 1340 B12R2.1081 BrC1=CC=NC2=CC=CC=C12 CS22702 [0,1,0,1,0,0|1,0,1]=4 1341 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 CS10939 [0,1,0,1,0,0|2,0,0]=4 1342 B12R2.1081 CC1=C2C=CC=NC2=CC=C1 MC33383 [0,1,0,1,0,0|1,0,1]=4 1343 B12R2.1081 CC1=C2N=CC=CC2=CC=C1 CS11338 [0,1,0,1,0,0|1,0,1]=4 1344 B12R2.1081 CC1=CC=NC2=CC=CC=C12 CS11332 [0,1,0,1,0,0|1,0,0]=3 1345 B12R2.1081 CC1=CN=CC2=CC=CC=C12 CS13187 [0,1,0,1,0,0|1,0,0]=3 1346 B12R2.1081 C[N+]1=CC=NC2=CC=CC=C21 MC113795 [0,1,0,1,0,0|1,0,0]=3 1347 B12R2.1081 ClC1=C2C=CC=NC2=CC=C1 CS21421 [0,1,0,1,0,0|1,0,1]=4 1348 B12R2.1081 ClC1=C2C=CN=CC2=CC=C1 CS21420 [0,1,0,1,0,0|2,0,0]=4 1349 B12R2.1081 ClC1=C2C=NC=CC2=CC=C1 CS17692 [0,1,0,1,0,0|2,0,0]=4 1350 B12R2.1081 ClC1=C2N=CC=CC2=CC=C1 CS21426 [0,1,0,1,0,0|1,0,1]=4 1351 B12R2.1081 ClC1=CC=NC2=CC=CC=C12 CS19192 [0,1,0,1,0,0|1,0,1]=4 1352 B12R2.1081 ClC1=CN=CC2=CC=CC=C12 CS12363 [0,1,0,1,0,0|2,0,0]=4 1353 B12R2.1081 ClC1=CN=NC2=CC=CC=C12 MC427406 [0,1,0,1,0,0|2,0,0]=4 1354 B12R2.1081 ClC1=NC=CC2=CC=CC=C21 CS10943 [0,1,0,1,0,0|2,0,0]=4 1355 B12R2.1081 FC1=CC=CC2=C1CC=CO2 MC41786 [0,1,0,1,0,0|0,0,2]=4 1356 B12R2.1081 FC1=CC=CC2=C1NCCO2 MC443372 [0,1,0,1,0,0|1,0,1]=4 1357 B12R2.1081 FC1=CC=CC2=CC=CC=C12 MC20582 [0,1,0,1,0,0|1,0,1]=4 1358 B12R2.1081 IC1=C2C=CN=CC2=CC=C1 MC33302 [0,1,0,1,0,0|2,0,0]=4 1359 B12R2.1081 IC1=CN=CC2=CC=CC=C12 CS12479 [0,1,0,1,0,0|2,0,0]=4 1360 B12R2.1081 Ic1cccc2ccccc12 MC434036 [0,1,0,1,0,0|1,0,1]=4 1361 B12R2.1081 NC1=C2C=CN=CC2=CC=C1 CS11013 [0,1,0,1,0,0|2,0,0]=4 1362 B12R2.1081 NC1=C2C=NC=CC2=CC=C1 CS18182 [0,1,0,1,0,0|2,0,0]=4 1363 B12R2.1081 NC1=C2N=CC=CC2=CC=C1 CS22125 [0,1,0,1,0,0|1,0,1]=4 1364 B12R2.1081 NC1=CC=CC2=C1C=CC=N2 CS11015 [0,1,0,1,0,0|1,0,1]=4 1365 B12R2.1081 NC1=CC=CC2=C1NCCO2 MC111436 [0,1,0,1,0,0|1,0,1]=4 1366 B12R2.1081 NC1=CC=CC2=C1OCCO2 MC430590 [0,1,0,1,0,0|1,0,1]=4 1367 B12R2.1081 NC1=CC=CC2=CC=CC=C12 CS20774 [0,1,0,1,0,0|1,0,1]=4 1368 B12R2.1081 NC1=CC=CC2=CC=CC=C12 MC41752 [0,1,0,1,0,0|1,0,1]=4 1369 B12R2.1081 NC1=CC=NC2=CC=CC=C12 CS18376 [0,1,0,1,0,0|1,0,1]=4 1370 B12R2.1081 NC1=CN=CC2=CC=CC=C12 CS11011 [0,1,0,1,0,0|2,0,0]=4 1371 B12R2.1081 NC1=CN=NC2=CC=CC=C12 MC427405 [0,1,0,1,0,0|2,0,0]=4 1372 B12R2.1081 NC1=NC=CC2=CC=CC=C21 CS21592 [0,1,0,1,0,0|2,0,0]=4 1373 B12R2.1081 NC1CCOC2=CC=CC=C21 CS18355 [0,1,0,1,0,0|0,0,2]=4 1374 B12R2.1081 NC1COCC2=CC=CC=C21 MC100130 [0,1,0,1,0,0|1,0,1]=4 1375 B12R2.1081 N[N+]1=CC=CC2=CC=CC=C21 MC107680 [0,1,0,1,0,0|1,0,1]=4 1376 B12R2.1081 O=C1C=CNC2=CC=CC=C12 CS15452 [0,1,0,1,0,0|1,0,1]=4 1377 B12R2.1081 O=C1C=NNC2=CC=CC=C12 CS20704 [0,1,0,1,0,0|2,0,0]=4 1378 B12R2.1081 O=C1CCCC2=CC=CC=C12 CS14809 [0,1,0,1,0,0|1,0,1]=4 1379 B12R2.1081 O=C1CCNC2=CC=CC=C12 CS15321 [0,1,0,1,0,0|1,0,1]=4 1380 B12R2.1081 O=C1CCNC2=CC=CC=C12 MC441207 [0,1,0,1,0,0|1,0,1]=4 1381 B12R2.1081 O=C1CCOC2=CC=CC=C12 CS22800 [0,1,0,1,0,0|0,0,1]=3 1382 B12R2.1081 O=C1COCC2=C1C=CC=C2 MC41773 [0,1,0,1,0,0|1,0,0]=3 1383 B12R2.1081 O=C1NCCC2=CC=CC=C12 CS17872 [0,1,0,1,0,0|2,0,0]=4 1384 B12R2.1081 O=C1OCCC2=CC=CC=C12 CS12987 [0,1,0,1,0,0|2,0,0]=4 1385 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 MC30343 [0,1,0,1,0,0|1,0,1]=4 1386 B12R2.1081 OC1=CC=CC2=C1C=CC=N2 CS10980 [0,1,0,1,0,0|1,0,1]=4 1387 B12R2.1081 OC1=CC=CC2=C1C=CN=C2 CS10979 [0,1,0,1,0,0|2,0,0]=4 1388 B12R2.1081 OC1=CC=CC2=C1OCCN2 MC441075 [0,1,0,1,0,0|1,0,1]=4 1389 B12R2.1081 OC1=CC=CC2=C1OCCO2 CS12196 [0,1,0,1,0,0|1,0,1]=4 1390 B12R2.1081 OC1=CC=CC2=CC=CC=C12 CS18546 [0,1,0,1,0,0|1,0,1]=4 1391 B12R2.1081 OC1=CC=NC2=CC=CC=C12 CS21522 [0,1,0,1,0,0|1,0,1]=4 1392 B12R2.1081 OC1=CN=NC2=CC=CC=C12 CS22888 [0,1,0,1,0,0|2,0,0]=4 1393 B12R2.1081 OC1=NC=CC2=CC=CC=C21 CS10978 [0,1,0,1,0,0|2,0,0]=4 1394 B12R2.1081 SC1=C2N=CC=CC2=CC=C1 MC427717 [0,1,0,1,0,0|1,0,1]=4 1395 B12R2.1081 [O-]c1cccc2cccnc12 MC440649 [0,1,0,1,0,0|1,0,1]=4 1396 B12R2.2028 CN1C=C(Br)C2=CC=CC=C21 MC441090 [0,1,0,1,0,0|1,0,0]=3 1397 B12R2.2028 CN1C=C(Br)C2=CC=CN=C21 CS13199 [0,1,0,1,0,0|2,0,0]=4 1398 B12R2.2028 O=C1CC(Br)C2=CC=CC=C12 CS22129 [0,1,0,1,0,0|2,0,0]=4 1399 B12R2.196 CC1=C2CCC(=O)C2=CC=C1 CS14012 [0,1,0,1,0,0|2,0,0]=4 1400 B12R2.196 CC1=COC2=C1C=CC=C2Br MC441289 [0,1,0,1,0,0|0,0,2]=4 1401 B12R2.196 CC1=CSC2=C1C=CC=C2Br MC441871 [0,1,0,1,0,0|2,0,0]=4 1402 B12R2.196 CN1C=CC2=C(Cl)C=CN=C21 CS13174 [0,1,0,1,0,0|2,0,0]=4 1403 B12R2.196 CN1C=CC2=C1C=CC=C2O CS13327 [0,1,0,1,0,0|1,0,0]=3 1404 B12R2.196 CN1C=CC2=C1C=CN=C2Cl CS22725 [0,1,0,1,0,0|2,0,0]=4 1405 B12R2.196 CN1C=NC2=C1C=CC=C2Br CS17911 [0,1,0,1,0,0|2,0,0]=4 1406 B12R2.196 CN1C=NC2=C1C=CC=C2N CS22542 [0,1,0,1,0,0|2,0,0]=4 1407 B12R2.196 CN1N=CC2=C(Br)C=CC=C21 MC441372 [0,1,0,1,0,0|2,0,0]=4 1408 B12R2.196 CN1N=CC2=C(I)C=CC=C21 MC444121 [0,1,0,1,0,0|2,0,0]=4 1409 B12R2.196 CN1N=CC2=C(N)C=CC=C21 CS20749 [0,1,0,1,0,0|2,0,0]=4 1410 B12R2.196 CN1N=CC2=C1C=CC=C2O MC441199 [0,1,0,1,0,0|2,0,0]=4 1411 B12R2.196 NC1=C2CCC(=O)C2=CC=C1 MC446724 [0,1,0,1,0,0|2,0,0]=4 1412 B12R2.196 NC1=NOC2=C1C=CC=C2F MC430947 [0,1,0,1,0,0|2,0,0]=4 1413 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 CS10966 [0,1,0,1,0,0|2,0,0]=4 1414 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 CS18751 [0,1,0,1,0,0|2,0,0]=4 1415 B12R2.196 O=C1CCC2=C(F)C=CC=C12 MC442503 [0,1,0,1,0,0|2,0,0]=4 1416 B12R2.196 O=C1CCC2=C(O)C=CC=C12 CS19922 [0,1,0,1,0,0|2,0,0]=4 1417 B12R2.196 O=C1COC2=C1C=CC=C2F MC113785 [0,1,0,1,0,0|1,0,0]=3 1418 B12R2.196 O=C1COC2=C1C=CC=C2I MC114833 [0,1,0,1,0,0|1,0,0]=3 1419 B12R2.196 O=C1CSC2=C1C=CC=C2F MC107892 [0,1,0,1,0,0|1,1,0]=4 1420 B12R2.203 CC1=C2C(=CC=C1)C=NN2C CS17810 [0,1,0,1,0,0|2,0,0]=4 1421 B12R2.203 CC1=CNC2=CC=CC(Br)=C12 CS12569 [0,1,0,1,0,0|2,0,0]=4 1422 B12R2.203 CC1=CSC2=C1C(Br)=CC=C2 MC441278 [0,1,0,1,0,0|2,0,0]=4 1423 B12R2.203 CC1=CSC2=C1C(Cl)=CC=C2 MC441870 [0,1,0,1,0,0|2,0,0]=4 1424 B12R2.203 CN1N=CC2=CC=CC(Br)=C21 CS12330 [0,1,0,1,0,0|2,0,0]=4 1425 B12R2.203 CN1N=CC2=CC=CC(N)=C21 MC444436 [0,1,0,1,0,0|2,0,0]=4 1426 B12R2.203 O=C1CCC2=CC=CC(Br)=C12 MC106557 [0,1,0,1,0,0|2,0,0]=4 1427 B12R2.203 O=C1CCC2=CC=CC(Cl)=C12 MC429388 [0,1,0,1,0,0|2,0,0]=4 1428 B12R2.203 O=C1CCC2=CC=CC(F)=C12 CS15500 [0,1,0,1,0,0|2,0,0]=4 1429 B12R2.203 O=C1CCC2=CC=CC(I)=C12 MC113777 [0,1,0,1,0,0|2,0,0]=4 1430 B12R2.203 O=C1CCC2=CC=CC(O)=C12 CS12591 [0,1,0,1,0,0|2,0,0]=4 1431 B12R2.203 O=C1COC2=C1C(F)=CC=C2 MC113791 [0,1,0,1,0,0|1,0,0]=3