0 B9R1.69 CC1=C(Br)C=C(Br)C=C1 D45155 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.69 CC1=C(Br)C=C(Br)C=N1 D15335 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.69 CC1=C(Br)C=C(F)C=C1 B68836 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.69 CC1=C(Br)C=C(I)C=C1 B45176 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.69 CC1=C(Br)C=C(N)C=C1 B39411 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.69 CC1=C(Br)C=C(N)C=N1 B0530 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.69 CC1=C(Br)C=C(O)C=C1 B45948 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 CC1=C(Br)C=C(O)C=N1 B22011 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.69 CC1=C(Br)C=CC(Br)=C1 D39368 [0,0,0,0,0,0|4,0,0]=4 9 B9R1.69 CC1=C(Br)C=CC(Br)=N1 D23496 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 B9485 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.69 CC1=C(Br)C=CC(Cl)=N1 B18652 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.69 CC1=C(Br)C=CC(F)=C1 B45168 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.69 CC1=C(Br)C=CC(F)=N1 B42551 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.69 CC1=C(Br)C=CC(I)=C1 B45173 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.69 CC1=C(Br)C=CC(N)=C1 B61976 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.69 CC1=C(Br)C=CC(N)=C1 B67860 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.69 CC1=C(Br)C=CC(N)=N1 B5097 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.69 CC1=C(Br)C=CC(O)=C1 B39404 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.69 CC1=C(Br)C=CC(O)=N1 B42887 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.69 CC1=C(Br)C=NC(Br)=N1 D69478 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.69 CC1=C(Br)C=NC(Cl)=N1 B38659 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.69 CC1=C(Br)C=NC(N)=N1 A21812 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.69 CC1=C(Br)N=C(Br)N=C1 D40704 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.69 CC1=C(C)C=C(F)C=C1 F49166 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.69 CC1=C(C)C=C(I)C=C1 K49170 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.69 CC1=C(C)C=C([Mg+])C=C1 D31727 [0,0,0,0,0,0|3,0,0]=3 27 B9R1.69 CC1=C(C)N=C(Br)C=N1 B42969 [0,0,0,0,0,0|1,0,0]=1 28 B9R1.69 CC1=C(C)N=C(Cl)C=C1 C46102 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.69 CC1=C(C)N=C(Cl)C=N1 C42990 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.69 CC1=C(C)N=C(N)C=C1 D24371 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.69 CC1=C(C)N=C(N)C=N1 D24637 [0,0,0,0,0,0|1,0,0]=1 32 B9R1.69 CC1=C(C)N=C(N)N=C1 D43338 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.69 CC1=C(C)NC(=O)C=N1 D43209 [0,0,0,0,0,0|1,0,1]=2 34 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 B39370 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.69 CC1=C(Cl)C=C(F)C=C1 C60661 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.69 CC1=C(Cl)C=C(N)C=C1 C65827 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.69 CC1=C(Cl)C=C(O)C=C1 C45955 [0,0,0,0,0,0|4,0,0]=4 38 B9R1.69 CC1=C(Cl)C=C(O)C=N1 C42908 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.69 CC1=C(Cl)C=C([Mg+])C=C1 C31809 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 B45163 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.69 CC1=C(Cl)C=CC(Br)=N1 B42536 [0,0,0,0,0,0|3,0,0]=3 42 B9R1.69 CC1=C(Cl)C=CC(Cl)=N1 D42561 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.69 CC1=C(Cl)C=CC(I)=C1 C45179 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.69 CC1=C(Cl)C=CC(N)=C1 C25031 [0,0,0,0,0,0|4,0,0]=4 45 B9R1.69 CC1=C(Cl)C=CC(N)=N1 C42999 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.69 CC1=C(Cl)C=CC(O)=N1 C42907 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.69 CC1=C(Cl)C=CC([Mg+])=C1 C31776 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.69 CC1=C(Cl)C=NC(Cl)=N1 D40726 [0,0,0,0,0,0|4,0,0]=4 49 B9R1.69 CC1=C(Cl)C=NC(N)=N1 C23537 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.69 CC1=C(Cl)N=C(Cl)N=C1 D4933 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.69 CC1=C(Cl)N=CC(Br)=N1 B63362 [0,0,0,0,0,0|2,0,0]=2 52 B9R1.69 CC1=C(F)C=C(Br)C=C1 B68837 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.69 CC1=C(F)C=C(Cl)C=C1 C68878 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.69 CC1=C(F)C=C(I)C=C1 F45194 [0,0,0,0,0,0|4,0,0]=4 55 B9R1.69 CC1=C(F)C=C(N)C=C1 F46113 [0,0,0,0,0,0|4,0,0]=4 56 B9R1.69 CC1=C(F)C=C(O)C=C1 F45960 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.69 CC1=C(F)C=C([Mg+])C=C1 F31745 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.69 CC1=C(F)C=CC(Br)=N1 B4782 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.69 CC1=C(F)C=CC(Cl)=C1 C45178 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.69 CC1=C(F)C=CC(Cl)=N1 C26077 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.69 CC1=C(F)C=CC(F)=C1 D45185 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.69 CC1=C(F)C=CC(I)=C1 F39375 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.69 CC1=C(F)C=CC(N)=C1 F39413 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.69 CC1=C(F)C=CC(N)=N1 A16597 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.69 CC1=C(F)C=CC(O)=C1 F45963 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.69 CC1=C(F)C=CC([Mg+])=C1 F31747 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.69 CC1=C(F)C=NC(Cl)=N1 C37414 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.69 CC1=C(I)C=C(Br)C=C1 B37920 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.69 CC1=C(I)C=C(Cl)C=C1 C38509 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.69 CC1=C(I)C=C(F)C=C1 F45195 [0,0,0,0,0,0|4,0,0]=4 71 B9R1.69 CC1=C(I)C=C(N)C=C1 K46118 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.69 CC1=C(I)C=CC(=O)N1 K42938 [0,0,0,0,0,0|3,0,1]=4 73 B9R1.69 CC1=C(I)C=CC(Br)=C1 B39374 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.69 CC1=C(I)C=CC(Cl)=C1 C45182 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.69 CC1=C(I)C=CC(F)=C1 F39376 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.69 CC1=C(I)C=CC(F)=N1 F42596 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.69 CC1=C(I)C=CC(N)=N1 K43025 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.69 CC1=C(I)C=CC(O)=C1 K45969 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.69 CC1=C(N)C=C(Br)C=C1 B39412 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.69 CC1=C(N)C=C(I)C=C1 K46121 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.69 CC1=C(N)C=C(O)C=C1 A38014 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.69 CC1=C(N)C=CC(Br)=N1 A15124 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.69 CC1=C(N)C=CC(Cl)=N1 A15123 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.69 CC1=C(N)C=CC(F)=C1 F68357 [0,0,0,0,0,0|4,0,0]=4 85 B9R1.69 CC1=C(N)C=CC(I)=C1 K46119 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.69 CC1=C(N)C=CC(O)=C1 A39417 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.69 CC1=C(N)C=NC(Cl)=N1 C22182 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.69 CC1=C(N)N=C(Br)C=C1 B26268 [0,0,0,0,0,0|3,0,0]=3 89 B9R1.69 CC1=C(N)N=C(Cl)N=C1 A3364 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.69 CC1=C(N)N=CC(Br)=N1 A37808 [0,0,0,0,0,0|2,0,0]=2 91 B9R1.69 CC1=C(O)C=C(Br)C=C1 B45951 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.69 CC1=C(O)C=C(F)C=C1 F45964 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.69 CC1=C(O)C=C(O)C=C1 M28674 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.69 CC1=C(O)C=CC(Br)=C1 B45950 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.69 CC1=C(O)C=CC(Br)=N1 B42888 [0,0,0,0,0,0|3,0,0]=3 96 B9R1.69 CC1=C(O)C=CC(Cl)=N1 C42909 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.69 CC1=C(O)C=CC(F)=C1 F45962 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.69 CC1=C(O)C=CC(I)=C1 K45968 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.69 CC1=C(O)C=CC(N)=C1 A46374 [0,0,0,0,0,0|4,0,0]=4 100 B9R1.69 CC1=C(O)C=NC(Cl)=N1 C17952 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.69 CC1=C(O)N=CC(Br)=N1 B37166 [0,0,0,0,0,0|2,0,0]=2 102 B9R1.69 CC1=C([Mg+])C=C(F)C=C1 F31748 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.69 CC1=C([Mg+])C=CC(Cl)=C1 C31775 [0,0,0,0,0,0|4,0,0]=4 104 B9R1.69 CC1=C([Mg+])C=CC(F)=C1 F31746 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.69 CC1=CC(=O)NN=C1C D15899 [0,0,0,0,0,0|3,0,0]=3 106 B9R1.69 CC1=CC(=O)NN=C1Cl C40939 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.69 CC1=CC(Br)=C(Br)C=C1 D45154 [0,0,0,0,0,0|4,0,0]=4 108 B9R1.69 CC1=CC(Br)=C(C)C=C1 D39511 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.69 CC1=CC(Br)=C(C)C=N1 B46084 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 B45156 [0,0,0,0,0,0|4,0,0]=4 111 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 B42532 [0,0,0,0,0,0|3,0,0]=3 112 B9R1.69 CC1=CC(Br)=C(F)N=C1 B2994 [0,0,0,0,0,0|3,0,0]=3 113 B9R1.69 CC1=CC(Br)=C(I)C=C1 B45175 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.69 CC1=CC(Br)=C(N)N=C1 B21800 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.69 CC1=CC(Br)=C(O)C=C1 B39403 [0,0,0,0,0,0|4,0,0]=4 116 B9R1.69 CC1=CC(Br)=C(O)N=C1 B21801 [0,0,0,0,0,0|3,0,0]=3 117 B9R1.69 CC1=CC(Br)=CN=C1Br D1477 [0,0,0,0,0,0|3,0,0]=3 118 B9R1.69 CC1=CC(Br)=CN=C1C B46085 [0,0,0,0,0,0|2,0,0]=2 119 B9R1.69 CC1=CC(Br)=CN=C1Cl B22875 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.69 CC1=CC(Br)=CN=C1F B2992 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.69 CC1=CC(Br)=CN=C1N B42973 [0,0,0,0,0,0|3,0,0]=3 122 B9R1.69 CC1=CC(Br)=CNC1=O B42891 [0,0,0,0,0,0|3,0,1]=4 123 B9R1.69 CC1=CC(Br)=NN=C1Br D40705 [0,0,0,0,0,0|4,0,0]=4 124 B9R1.69 CC1=CC(C)=C(Br)C=C1 D39510 [0,0,0,0,0,0|3,0,0]=3 125 B9R1.69 CC1=CC(C)=C(Br)C=N1 B46086 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.69 CC1=CC(C)=C([Mg+])C=C1 D31735 [0,0,0,0,0,0|3,0,0]=3 127 B9R1.69 CC1=CC(C)=NN=C1Cl C1716 [0,0,0,0,0,0|3,0,0]=3 128 B9R1.69 CC1=CC(C)=NNC1=O D15210 [0,0,0,0,0,0|3,0,1]=4 129 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 B67676 [0,0,0,0,0,0|4,0,0]=4 130 B9R1.69 CC1=CC(Cl)=C(I)C=C1 C62467 [0,0,0,0,0,0|4,0,0]=4 131 B9R1.69 CC1=CC(Cl)=C(N)C=C1 C69100 [0,0,0,0,0,0|4,0,0]=4 132 B9R1.69 CC1=CC(Cl)=C(N)N=C1 C61779 [0,0,0,0,0,0|3,0,0]=3 133 B9R1.69 CC1=CC(Cl)=C(O)C=C1 C38476 [0,0,0,0,0,0|4,0,0]=4 134 B9R1.69 CC1=CC(Cl)=CN=C1Br B8272 [0,0,0,0,0,0|3,0,0]=3 135 B9R1.69 CC1=CC(Cl)=CN=C1Cl D42560 [0,0,0,0,0,0|3,0,0]=3 136 B9R1.69 CC1=CC(Cl)=CN=C1N C42998 [0,0,0,0,0,0|3,0,0]=3 137 B9R1.69 CC1=CC(Cl)=CN=C1O C42905 [0,0,0,0,0,0|3,0,0]=3 138 B9R1.69 CC1=CC(Cl)=NN=C1Cl D1866 [0,0,0,0,0,0|4,0,0]=4 139 B9R1.69 CC1=CC(Cl)=NN=C1N C24688 [0,0,0,0,0,0|4,0,0]=4 140 B9R1.69 CC1=CC(F)=C(Br)C=C1 B39373 [0,0,0,0,0,0|4,0,0]=4 141 B9R1.69 CC1=CC(F)=C(C)C=C1 F49165 [0,0,0,0,0,0|3,0,0]=3 142 B9R1.69 CC1=CC(F)=C(Cl)C=C1 C45177 [0,0,0,0,0,0|4,0,0]=4 143 B9R1.69 CC1=CC(F)=C(F)C=C1 D45188 [0,0,0,0,0,0|4,0,0]=4 144 B9R1.69 CC1=CC(F)=C(I)C=C1 F45193 [0,0,0,0,0,0|4,0,0]=4 145 B9R1.69 CC1=CC(F)=C(N)N=C1 F43015 [0,0,0,0,0,0|3,0,0]=3 146 B9R1.69 CC1=CC(F)=C(O)C=C1 F45958 [0,0,0,0,0,0|4,0,0]=4 147 B9R1.69 CC1=CC(F)=CN=C1Br B23405 [0,0,0,0,0,0|3,0,0]=3 148 B9R1.69 CC1=CC(F)=CN=C1Cl C42569 [0,0,0,0,0,0|3,0,0]=3 149 B9R1.69 CC1=CC(F)=CN=C1N F43018 [0,0,0,0,0,0|3,0,0]=3 150 B9R1.69 CC1=CC(I)=C(Br)C=C1 B38445 [0,0,0,0,0,0|4,0,0]=4 151 B9R1.69 CC1=CC(I)=C(F)C=C1 F45191 [0,0,0,0,0,0|4,0,0]=4 152 B9R1.69 CC1=CC(I)=C(F)N=C1 F6510 [0,0,0,0,0,0|3,0,0]=3 153 B9R1.69 CC1=CC(I)=C(N)C=C1 K46116 [0,0,0,0,0,0|4,0,0]=4 154 B9R1.69 CC1=CC(I)=C(N)N=C1 I29765 [0,0,0,0,0,0|3,0,0]=3 155 B9R1.69 CC1=CC(I)=C(O)C=C1 K60967 [0,0,0,0,0,0|4,0,0]=4 156 B9R1.69 CC1=CC(I)=CN=C1Br B42556 [0,0,0,0,0,0|3,0,0]=3 157 B9R1.69 CC1=CC(I)=CN=C1Cl C42584 [0,0,0,0,0,0|3,0,0]=3 158 B9R1.69 CC1=CC(I)=CN=C1N K43024 [0,0,0,0,0,0|3,0,0]=3 159 B9R1.69 CC1=CC(I)=CN=C1O K42936 [0,0,0,0,0,0|3,0,0]=3 160 B9R1.69 CC1=CC(N)=C(Br)C=C1 B39410 [0,0,0,0,0,0|4,0,0]=4 161 B9R1.69 CC1=CC(N)=C(Cl)C=C1 C46092 [0,0,0,0,0,0|4,0,0]=4 162 B9R1.69 CC1=CC(N)=C(F)C=C1 A23738 [0,0,0,0,0,0|4,0,0]=4 163 B9R1.69 CC1=CC(N)=C(I)C=C1 K46117 [0,0,0,0,0,0|4,0,0]=4 164 B9R1.69 CC1=CC(N)=C(N)C=C1 D68596 [0,0,0,0,0,0|4,0,0]=4 165 B9R1.69 CC1=CC(N)=CN=C1Br A42967 [0,0,0,0,0,0|3,0,0]=3 166 B9R1.69 CC1=CC(N)=CN=C1C D43613 [0,0,0,0,0,0|2,0,0]=2 167 B9R1.69 CC1=CC(N)=CN=C1Cl C23404 [0,0,0,0,0,0|3,0,0]=3 168 B9R1.69 CC1=CC(N)=CN=C1F F43017 [0,0,0,0,0,0|3,0,0]=3 169 B9R1.69 CC1=CC(N)=NN=C1Cl C24788 [0,0,0,0,0,0|4,0,0]=4 170 B9R1.69 CC1=CC(O)=C(Br)C=C1 B36626 [0,0,0,0,0,0|4,0,0]=4 171 B9R1.69 CC1=CC(O)=C(F)C=C1 F45959 [0,0,0,0,0,0|4,0,0]=4 172 B9R1.69 CC1=CC(O)=C(N)C=C1 A68595 [0,0,0,0,0,0|4,0,0]=4 173 B9R1.69 CC1=CC(O)=CN=C1Br B42893 [0,0,0,0,0,0|3,0,0]=3 174 B9R1.69 CC1=CC(O)=CN=C1Cl C15197 [0,0,0,0,0,0|3,0,0]=3 175 B9R1.69 CC1=CC(O)=CN=C1F F62152 [0,0,0,0,0,0|3,0,0]=3 176 B9R1.69 CC1=CC([Mg+])=C(C)C=C1 D31736 [0,0,0,0,0,0|3,0,0]=3 177 B9R1.69 CC1=CC=C(Br)C(Br)=N1 D42515 [0,0,0,0,0,0|3,0,0]=3 178 B9R1.69 CC1=CC=C(C)C(N)=N1 D43611 [0,0,0,0,0,0|2,0,0]=2 179 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 D42559 [0,0,0,0,0,0|3,0,0]=3 180 B9R1.69 CC1=CC=C(Cl)N=C1Cl D24399 [0,0,0,0,0,0|3,0,0]=3 181 B9R1.69 CC1=CC=C(F)C(Br)=N1 B23352 [0,0,0,0,0,0|3,0,0]=3 182 B9R1.69 CC1=CC=C(F)C(Cl)=N1 C42573 [0,0,0,0,0,0|3,0,0]=3 183 B9R1.69 CC1=CC=C(F)N=C1Br B17536 [0,0,0,0,0,0|3,0,0]=3 184 B9R1.69 CC1=CC=C(N)C(Br)=N1 B37081 [0,0,0,0,0,0|3,0,0]=3 185 B9R1.69 CC1=CC=C(N)C(C)=N1 D43608 [0,0,0,0,0,0|2,0,0]=2 186 B9R1.69 CC1=CC=C(N)C(Cl)=N1 A42987 [0,0,0,0,0,0|3,0,0]=3 187 B9R1.69 CC1=CC=C(N)C(I)=N1 K43022 [0,0,0,0,0,0|3,0,0]=3 188 B9R1.69 CC1=CC=C(N)N=C1Br B26269 [0,0,0,0,0,0|3,0,0]=3 189 B9R1.69 CC1=CC=C(N)N=C1Cl C23697 [0,0,0,0,0,0|3,0,0]=3 190 B9R1.69 CC1=CC=C(N)N=C1N M43333 [0,0,0,0,0,0|3,0,0]=3 191 B9R1.69 CC1=CC=C(O)C(Br)=N1 B1020 [0,0,0,0,0,0|3,0,0]=3 192 B9R1.69 CC1=CC=C(O)C(F)=N1 F42928 [0,0,0,0,0,0|3,0,0]=3 193 B9R1.69 CC1=CC=C(O)C(I)=N1 H37772 [0,0,0,0,0,0|3,0,0]=3 194 B9R1.69 CC1=CN=C(Br)C(Br)=C1 D42517 [0,0,0,0,0,0|3,0,0]=3 195 B9R1.69 CC1=CN=C(Br)C(C)=C1 B46080 [0,0,0,0,0,0|2,0,0]=2 196 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 B42530 [0,0,0,0,0,0|3,0,0]=3 197 B9R1.69 CC1=CN=C(Br)C(F)=C1 B13540 [0,0,0,0,0,0|3,0,0]=3 198 B9R1.69 CC1=CN=C(Br)C(N)=C1 A42977 [0,0,0,0,0,0|3,0,0]=3 199 B9R1.69 CC1=CN=C(C)C(C)=C1 T39433 [0,0,0,0,0,0|1,0,0]=1 200 B9R1.69 CC1=CN=C(C)C(Cl)=N1 C42989 [0,0,0,0,0,0|1,0,0]=1 201 B9R1.69 CC1=CN=C(C)C(I)=N1 K43021 [0,0,0,0,0,0|1,0,0]=1 202 B9R1.69 CC1=CN=C(C)C(N)=N1 D32397 [0,0,0,0,0,0|1,0,0]=1 203 B9R1.69 CC1=CN=C(C)C=C1N D22447 [0,0,0,0,0,0|4,0,0]=4 204 B9R1.69 CC1=CN=C(C)N=C1N D43337 [0,0,0,0,0,0|3,0,0]=3 205 B9R1.69 CC1=CN=C(Cl)C(C)=N1 C42988 [0,0,0,0,0,0|1,0,0]=1 206 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 D42558 [0,0,0,0,0,0|3,0,0]=3 207 B9R1.69 CC1=CN=C(Cl)C(Cl)=N1 D40725 [0,0,0,0,0,0|2,0,0]=2 208 B9R1.69 CC1=CN=C(Cl)C(F)=C1 C42572 [0,0,0,0,0,0|3,0,0]=3 209 B9R1.69 CC1=CN=C(Cl)C(N)=C1 C42993 [0,0,0,0,0,0|3,0,0]=3 210 B9R1.69 CC1=CN=C(Cl)C(N)=N1 C39122 [0,0,0,0,0,0|2,0,0]=2 211 B9R1.69 CC1=CN=C(Cl)C(O)=C1 C42904 [0,0,0,0,0,0|3,0,0]=3 212 B9R1.69 CC1=CN=C(I)C(C)=N1 K63360 [0,0,0,0,0,0|1,0,0]=1 213 B9R1.69 CC1=CN=C(N)C(=O)N1 A41143 [0,0,0,0,0,0|2,0,1]=3 214 B9R1.69 CC1=CN=C(N)C(Br)=N1 B41061 [0,0,0,0,0,0|2,0,0]=2 215 B9R1.69 CC1=CN=C(N)C(C)=C1 D43610 [0,0,0,0,0,0|2,0,0]=2 216 B9R1.69 CC1=CN=C(N)C(Cl)=N1 C41076 [0,0,0,0,0,0|2,0,0]=2 217 B9R1.69 CC1=CN=C(N)C(N)=C1 D43331 [0,0,0,0,0,0|3,0,0]=3 218 B9R1.69 CC1=CN=C(N)C=C1C D43612 [0,0,0,0,0,0|4,0,0]=4 219 B9R1.69 CC1=CN=C(N)N=C1Cl C10001 [0,0,0,0,0,0|4,0,0]=4 220 B9R1.69 CC1=CNC(=O)C(C)=N1 D69506 [0,0,0,0,0,0|1,0,1]=2 221 B9R1.69 CC1=CNC(=O)C(Cl)=N1 C40933 [0,0,0,0,0,0|2,0,1]=3 222 B9R1.69 CC1=CNC(=O)C(N)=C1 A43211 [0,0,0,0,0,0|3,0,1]=4 223 B9R1.69 CC1=NC(C)=C(Br)C=C1 B46082 [0,0,0,0,0,0|2,0,0]=2 224 B9R1.69 CC1=NC(C)=C(Br)C=N1 B42971 [0,0,0,0,0,0|3,0,0]=3 225 B9R1.69 CC1=NC(C)=C(N)C=N1 D43336 [0,0,0,0,0,0|3,0,0]=3 226 B9R1.69 CC1=NC(C)=C(O)C=C1 D67987 [0,0,0,0,0,0|2,0,0]=2 227 B9R1.69 CC1=NC(C)=C(O)C=N1 D43192 [0,0,0,0,0,0|3,0,0]=3 228 B9R1.69 CC1=NC(Cl)=C(Br)C=C1 B42526 [0,0,0,0,0,0|3,0,0]=3 229 B9R1.69 CC1=NC(Cl)=C(Br)C=N1 B25786 [0,0,0,0,0,0|4,0,0]=4 230 B9R1.69 CC1=NC(F)=C(Br)C=C1 B42546 [0,0,0,0,0,0|3,0,0]=3 231 B9R1.69 CC1=NC(F)=C(I)C=C1 F42594 [0,0,0,0,0,0|3,0,0]=3 232 B9R1.69 CC1=NC(N)=C(Br)C=C1 B18303 [0,0,0,0,0,0|3,0,0]=3 233 B9R1.69 CC1=NC(N)=C(Br)C=N1 B41065 [0,0,0,0,0,0|4,0,0]=4 234 B9R1.69 CC1=NC(N)=C(Cl)C=N1 C41080 [0,0,0,0,0,0|4,0,0]=4 235 B9R1.69 CC1=NC(N)=C(F)C=N1 F41083 [0,0,0,0,0,0|4,0,0]=4 236 B9R1.69 CC1=NC(N)=C(I)C=C1 K61473 [0,0,0,0,0,0|3,0,0]=3 237 B9R1.69 CC1=NC(N)=C(O)C=C1 A43201 [0,0,0,0,0,0|3,0,0]=3 238 B9R1.69 CC1=NC(N)=CN=C1Br B41062 [0,0,0,0,0,0|2,0,0]=2 239 B9R1.69 CC1=NC(N)=CN=C1Cl C23741 [0,0,0,0,0,0|2,0,0]=2 240 B9R1.69 CC1=NC(O)=C(Br)C=C1 B42882 [0,0,0,0,0,0|3,0,0]=3 241 B9R1.69 CC1=NC(O)=C(Br)C=N1 B40917 [0,0,0,0,0,0|4,0,0]=4 242 B9R1.69 CC1=NC(O)=C(F)C=N1 F40940 [0,0,0,0,0,0|4,0,0]=4 243 B9R1.69 CC1=NC=C(Br)C=C1Cl B8062 [0,0,0,0,0,0|3,0,0]=3 244 B9R1.69 CC1=NC=C(Br)C=C1F B16887 [0,0,0,0,0,0|3,0,0]=3 245 B9R1.69 CC1=NC=C(Br)C=C1N A0082 [0,0,0,0,0,0|3,0,0]=3 246 B9R1.69 CC1=NC=C(Br)C=C1O B42885 [0,0,0,0,0,0|3,0,0]=3 247 B9R1.69 CC1=NC=C(Cl)C(Cl)=N1 D40727 [0,0,0,0,0,0|4,0,0]=4 248 B9R1.69 CC1=NC=C(Cl)C=C1N A1755 [0,0,0,0,0,0|3,0,0]=3 249 B9R1.69 CC1=NC=C(F)C(Cl)=N1 C36910 [0,0,0,0,0,0|4,0,0]=4 250 B9R1.69 CC1=NC=C(N)C(Cl)=N1 C41079 [0,0,0,0,0,0|4,0,0]=4 251 B9R1.69 CC1=NC=C(N)N=C1Br B41063 [0,0,0,0,0,0|2,0,0]=2 252 B9R1.69 CC1=NN=C(Cl)C=C1Cl D32267 [0,0,0,0,0,0|4,0,0]=4 253 B9R1.69 CN1C=C(Br)C=NC1=O B40922 [0,0,0,0,0,0|4,0,0]=4 254 B9R1.69 CN1N=C(Br)C=CC1=O B40924 [0,0,0,0,0,0|4,0,0]=4 255 B9R1.69 CN1N=CC(I)=CC1=O I12967 [0,0,0,0,0,0|4,0,0]=4 256 B9R1.69 CN1N=CC(N)=CC1=O A12961 [0,0,0,0,0,0|4,0,0]=4 257 B9R1.69 ClC1=C(Br)C=C(Br)C=N1 D4524 [0,0,0,0,0,0|4,0,0]=4 258 B9R1.69 ClC1=C(I)C=C(Br)C=N1 B40517 [0,0,0,0,0,0|4,0,0]=4 259 B9R1.69 ClC1=C(I)C=C(I)C=N1 C40534 [0,0,0,0,0,0|4,0,0]=4 260 B9R1.69 ClC1=C(I)C=CC(Br)=N1 B67565 [0,0,0,0,0,0|4,0,0]=4 261 B9R1.69 ClC1=CC(Br)=C(Cl)N=C1 B40505 [0,0,0,0,0,0|4,0,0]=4 262 B9R1.69 ClC1=CC(Br)=CN=C1Br D3046 [0,0,0,0,0,0|4,0,0]=4 263 B9R1.69 ClC1=CC(Br)=CN=C1Cl B4728 [0,0,0,0,0,0|4,0,0]=4 264 B9R1.69 ClC1=CC(I)=C(Cl)N=C1 D40527 [0,0,0,0,0,0|4,0,0]=4 265 B9R1.69 ClC1=CC(I)=CN=C1Cl D15369 [0,0,0,0,0,0|4,0,0]=4 266 B9R1.69 ClC1=CC=C(Br)C(Br)=N1 D40497 [0,0,0,0,0,0|4,0,0]=4 267 B9R1.69 ClC1=CC=C(Cl)C(Cl)=N1 T40529 [0,0,0,0,0,0|4,0,0]=4 268 B9R1.69 ClC1=CN=C(Br)C(Br)=C1 D5204 [0,0,0,0,0,0|4,0,0]=4 269 B9R1.69 ClC1=CN=C(Br)C(Cl)=C1 B4706 [0,0,0,0,0,0|4,0,0]=4 270 B9R1.69 ClC1=CN=C(Br)C(Cl)=N1 B40275 [0,0,0,0,0,0|3,0,0]=3 271 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 T67406 [0,0,0,0,0,0|4,0,0]=4 272 B9R1.69 ClC1=CN=C(Cl)C(Cl)=N1 T40281 [0,0,0,0,0,0|3,0,0]=3 273 B9R1.69 ClC1=CN=C(I)C(Br)=C1 B40516 [0,0,0,0,0,0|4,0,0]=4 274 B9R1.69 ClC1=CN=C(I)C(Cl)=N1 D32285 [0,0,0,0,0,0|3,0,0]=3 275 B9R1.69 ClC1=NC(Br)=CN=C1Br D63358 [0,0,0,0,0,0|3,0,0]=3 276 B9R1.69 ClC1=NC(Cl)=C(Br)C=C1 D38502 [0,0,0,0,0,0|4,0,0]=4 277 B9R1.69 ClC1=NC(Cl)=C(I)C=C1 D4526 [0,0,0,0,0,0|4,0,0]=4 278 B9R1.69 ClC1=NC=C(Br)N=C1Br D9770 [0,0,0,0,0,0|3,0,0]=3 279 B9R1.69 ClC1=NC=C(I)C=C1Br B40515 [0,0,0,0,0,0|4,0,0]=4 280 B9R1.69 FC1=C(Br)C=C(Br)C=N1 D38481 [0,0,0,0,0,0|4,0,0]=4 281 B9R1.69 FC1=C(Br)C=C(Cl)C=N1 B40511 [0,0,0,0,0,0|4,0,0]=4 282 B9R1.69 FC1=C(Br)C=CC(Cl)=N1 B40512 [0,0,0,0,0,0|4,0,0]=4 283 B9R1.69 FC1=C(Cl)C=C(Cl)C=N1 F40524 [0,0,0,0,0,0|4,0,0]=4 284 B9R1.69 FC1=C(F)N=C(Br)C=C1 B18110 [0,0,0,0,0,0|4,0,0]=4 285 B9R1.69 FC1=C(I)C=C(Cl)C=N1 C40533 [0,0,0,0,0,0|4,0,0]=4 286 B9R1.69 FC1=C(I)C=CC(Cl)=N1 C61937 [0,0,0,0,0,0|4,0,0]=4 287 B9R1.69 FC1=CC(Br)=C(Cl)N=C1 B40509 [0,0,0,0,0,0|4,0,0]=4 288 B9R1.69 FC1=CC(Br)=C(F)N=C1 B17516 [0,0,0,0,0,0|4,0,0]=4 289 B9R1.69 FC1=CC(Br)=CN=C1Br D5207 [0,0,0,0,0,0|4,0,0]=4 290 B9R1.69 FC1=CC(Br)=CN=C1Cl B2299 [0,0,0,0,0,0|4,0,0]=4 291 B9R1.69 FC1=CC(Br)=CN=C1F B5203 [0,0,0,0,0,0|4,0,0]=4 292 B9R1.69 FC1=CC(Cl)=C(F)N=C1 C32247 [0,0,0,0,0,0|4,0,0]=4 293 B9R1.69 FC1=CC(Cl)=CN=C1Br B5202 [0,0,0,0,0,0|4,0,0]=4 294 B9R1.69 FC1=CC(Cl)=CN=C1Cl D5206 [0,0,0,0,0,0|4,0,0]=4 295 B9R1.69 FC1=CC(Cl)=CN=C1F C4649 [0,0,0,0,0,0|4,0,0]=4 296 B9R1.69 FC1=CC(I)=CN=C1F D40535 [0,0,0,0,0,0|4,0,0]=4 297 B9R1.69 FC1=CC=C(Br)N=C1Br D40500 [0,0,0,0,0,0|4,0,0]=4 298 B9R1.69 FC1=CC=C(Cl)N=C1Cl D40523 [0,0,0,0,0,0|4,0,0]=4 299 B9R1.69 FC1=CN=C(Br)C(Br)=C1 D40499 [0,0,0,0,0,0|4,0,0]=4 300 B9R1.69 FC1=CN=C(Br)C(Cl)=C1 B40507 [0,0,0,0,0,0|4,0,0]=4 301 B9R1.69 FC1=CN=C(Br)C(F)=C1 B3435 [0,0,0,0,0,0|4,0,0]=4 302 B9R1.69 FC1=CN=C(Cl)C(Cl)=C1 D32190 [0,0,0,0,0,0|4,0,0]=4 303 B9R1.69 FC1=CN=C(F)C(F)=C1 T40539 [0,0,0,0,0,0|4,0,0]=4 304 B9R1.69 FC1=NC(F)=C(Br)C=C1 B5205 [0,0,0,0,0,0|4,0,0]=4 305 B9R1.69 FC1=NC(F)=C(I)C=C1 D24901 [0,0,0,0,0,0|4,0,0]=4 306 B9R1.69 FC1=NC=C(Br)C=C1Cl B27815 [0,0,0,0,0,0|4,0,0]=4 307 B9R1.69 NC1=C(Br)C=C(Br)C=N1 A67470 [0,0,0,0,0,0|4,0,0]=4 308 B9R1.69 NC1=C(Br)C=C(Cl)C=N1 B39169 [0,0,0,0,0,0|4,0,0]=4 309 B9R1.69 NC1=C(Br)C=C(F)C=N1 A40715 [0,0,0,0,0,0|4,0,0]=4 310 B9R1.69 NC1=C(Br)C=CC(Cl)=N1 B62185 [0,0,0,0,0,0|4,0,0]=4 311 B9R1.69 NC1=C(Br)C=CC(F)=N1 B40713 [0,0,0,0,0,0|4,0,0]=4 312 B9R1.69 NC1=C(Cl)C=C(Cl)C=N1 D40722 [0,0,0,0,0,0|4,0,0]=4 313 B9R1.69 NC1=C(Cl)C=C(F)C=N1 C40733 [0,0,0,0,0,0|4,0,0]=4 314 B9R1.69 NC1=C(Cl)C=CC(Cl)=N1 A22985 [0,0,0,0,0,0|4,0,0]=4 315 B9R1.69 NC1=C(Cl)N=C(Br)C=C1 B40710 [0,0,0,0,0,0|4,0,0]=4 316 B9R1.69 NC1=C(Cl)N=C(Br)C=N1 A0343 [0,0,0,0,0,0|3,0,0]=3 317 B9R1.69 NC1=C(Cl)N=C(I)C=N1 A11542 [0,0,0,0,0,0|3,0,0]=3 318 B9R1.69 NC1=C(Cl)N=CC(Br)=N1 B9774 [0,0,0,0,0,0|3,0,0]=3 319 B9R1.69 NC1=C(F)C=C(F)C=N1 A9006 [0,0,0,0,0,0|4,0,0]=4 320 B9R1.69 NC1=C(F)C=CC(Br)=N1 B19236 [0,0,0,0,0,0|4,0,0]=4 321 B9R1.69 NC1=C(F)C=CC(Cl)=N1 C37118 [0,0,0,0,0,0|4,0,0]=4 322 B9R1.69 NC1=C(F)C=CC(F)=N1 D40748 [0,0,0,0,0,0|4,0,0]=4 323 B9R1.69 NC1=C(F)N=C(Br)C=C1 B61668 [0,0,0,0,0,0|4,0,0]=4 324 B9R1.69 NC1=C(I)C=C(Br)C=N1 B28657 [0,0,0,0,0,0|4,0,0]=4 325 B9R1.69 NC1=C(I)C=C(Cl)C=N1 A37985 [0,0,0,0,0,0|4,0,0]=4 326 B9R1.69 NC1=C(I)C=C(F)C=N1 A40753 [0,0,0,0,0,0|4,0,0]=4 327 B9R1.69 NC1=C(I)C=C(I)C=N1 D38304 [0,0,0,0,0,0|4,0,0]=4 328 B9R1.69 NC1=C(I)C=CC(Cl)=N1 C40742 [0,0,0,0,0,0|4,0,0]=4 329 B9R1.69 NC1=C(N)N=C(Br)C=C1 B9494 [0,0,0,0,0,0|4,0,0]=4 330 B9R1.69 NC1=C(N)N=C(Br)C=N1 B9793 [0,0,0,0,0,0|3,0,0]=3 331 B9R1.69 NC1=C(N)N=C(Cl)C=C1 C10347 [0,0,0,0,0,0|4,0,0]=4 332 B9R1.69 NC1=C(N)N=C(Cl)C=N1 C40148 [0,0,0,0,0,0|3,0,0]=3 333 B9R1.69 NC1=C(O)C=CC(Br)=N1 A32027 [0,0,0,0,0,0|4,0,0]=4 334 B9R1.69 NC1=CC(Br)=C(Cl)N=C1 C13528 [0,0,0,0,0,0|4,0,0]=4 335 B9R1.69 NC1=CC(Br)=C(F)N=C1 B40714 [0,0,0,0,0,0|4,0,0]=4 336 B9R1.69 NC1=CC(Br)=C(N)N=C1 B41055 [0,0,0,0,0,0|4,0,0]=4 337 B9R1.69 NC1=CC(Br)=CN=C1Br A0402 [0,0,0,0,0,0|4,0,0]=4 338 B9R1.69 NC1=CC(Br)=CN=C1Cl A7566 [0,0,0,0,0,0|4,0,0]=4 339 B9R1.69 NC1=CC(Br)=CN=C1I B37691 [0,0,0,0,0,0|4,0,0]=4 340 B9R1.69 NC1=CC(Br)=CN=C1N B10892 [0,0,0,0,0,0|4,0,0]=4 341 B9R1.69 NC1=CC(Cl)=CN=C1Br A4558 [0,0,0,0,0,0|4,0,0]=4 342 B9R1.69 NC1=CC(Cl)=CN=C1Cl A40724 [0,0,0,0,0,0|4,0,0]=4 343 B9R1.69 NC1=CC(Cl)=CN=C1O A40932 [0,0,0,0,0,0|4,0,0]=4 344 B9R1.69 NC1=CC(F)=CN=C1Br A40716 [0,0,0,0,0,0|4,0,0]=4 345 B9R1.69 NC1=CC(F)=CN=C1Cl C40732 [0,0,0,0,0,0|4,0,0]=4 346 B9R1.69 NC1=CC(F)=CN=C1N F38160 [0,0,0,0,0,0|4,0,0]=4 347 B9R1.69 NC1=CC(I)=C(Br)N=C1 B40721 [0,0,0,0,0,0|4,0,0]=4 348 B9R1.69 NC1=CC(I)=CN=C1Cl C40738 [0,0,0,0,0,0|4,0,0]=4 349 B9R1.69 NC1=CC=C(Br)C(Br)=N1 D26249 [0,0,0,0,0,0|4,0,0]=4 350 B9R1.69 NC1=CC=C(Br)C(I)=N1 B40719 [0,0,0,0,0,0|4,0,0]=4 351 B9R1.69 NC1=CC=C(Br)N=C1Br A12896 [0,0,0,0,0,0|4,0,0]=4 352 B9R1.69 NC1=CC=C(Br)N=C1I B40720 [0,0,0,0,0,0|4,0,0]=4 353 B9R1.69 NC1=CC=C(Cl)C(Br)=N1 B29470 [0,0,0,0,0,0|4,0,0]=4 354 B9R1.69 NC1=CC=C(Cl)N=C1Br A15005 [0,0,0,0,0,0|4,0,0]=4 355 B9R1.69 NC1=CC=C(Cl)N=C1Cl A4557 [0,0,0,0,0,0|4,0,0]=4 356 B9R1.69 NC1=CC=C(Cl)N=C1I C40741 [0,0,0,0,0,0|4,0,0]=4 357 B9R1.69 NC1=CC=C(F)N=C1Br B40712 [0,0,0,0,0,0|4,0,0]=4 358 B9R1.69 NC1=CC=C(F)N=C1F D40745 [0,0,0,0,0,0|4,0,0]=4 359 B9R1.69 NC1=CC=C(N)C(Br)=N1 B41058 [0,0,0,0,0,0|4,0,0]=4 360 B9R1.69 NC1=CN=C(Br)C(Br)=C1 D40703 [0,0,0,0,0,0|4,0,0]=4 361 B9R1.69 NC1=CN=C(Br)C(Br)=N1 D40046 [0,0,0,0,0,0|3,0,0]=3 362 B9R1.69 NC1=CN=C(Br)C(Cl)=C1 B37743 [0,0,0,0,0,0|4,0,0]=4 363 B9R1.69 NC1=CN=C(Br)C(Cl)=N1 A11540 [0,0,0,0,0,0|3,0,0]=3 364 B9R1.69 NC1=CN=C(Cl)C(Br)=N1 B32312 [0,0,0,0,0,0|3,0,0]=3 365 B9R1.69 NC1=CN=C(Cl)C(Cl)=C1 A38934 [0,0,0,0,0,0|4,0,0]=4 366 B9R1.69 NC1=CN=C(Cl)C(F)=C1 C40736 [0,0,0,0,0,0|4,0,0]=4 367 B9R1.69 NC1=CN=C(Cl)C(N)=C1 C41071 [0,0,0,0,0,0|4,0,0]=4 368 B9R1.69 NC1=CN=C(I)C(Cl)=N1 C61833 [0,0,0,0,0,0|3,0,0]=3 369 B9R1.69 NC1=NC(Br)=CN=C1Br D0685 [0,0,0,0,0,0|3,0,0]=3 370 B9R1.69 NC1=NC(Cl)=C(Br)C=C1 B23269 [0,0,0,0,0,0|4,0,0]=4 371 B9R1.69 NC1=NC(Cl)=C(I)C=C1 C40743 [0,0,0,0,0,0|4,0,0]=4 372 B9R1.69 NC1=NC(Cl)=CN=C1Br A11539 [0,0,0,0,0,0|3,0,0]=3 373 B9R1.69 NC1=NC(Cl)=CN=C1Cl D40048 [0,0,0,0,0,0|3,0,0]=3 374 B9R1.69 NC1=NC(F)=C(I)C=C1 F62026 [0,0,0,0,0,0|4,0,0]=4 375 B9R1.69 NC1=NC(N)=C(Br)C=C1 B3719 [0,0,0,0,0,0|4,0,0]=4 376 B9R1.69 NC1=NC=C(Br)C=C1Cl B23403 [0,0,0,0,0,0|4,0,0]=4 377 B9R1.69 NC1=NC=C(Br)C=C1F B25193 [0,0,0,0,0,0|4,0,0]=4 378 B9R1.69 NC1=NC=C(Br)C=C1O A28669 [0,0,0,0,0,0|4,0,0]=4 379 B9R1.69 NC1=NC=C(Br)N=C1Br A9691 [0,0,0,0,0,0|3,0,0]=3 380 B9R1.69 NC1=NC=C(Br)N=C1I B37564 [0,0,0,0,0,0|3,0,0]=3 381 B9R1.69 NC1=NC=C(Br)NC1=O A40093 [0,0,0,0,0,0|3,0,1]=4 382 B9R1.69 NC1=NC=C(Cl)C=C1F C40734 [0,0,0,0,0,0|4,0,0]=4 383 B9R1.69 NC1=NC=C(Cl)C=C1O A40927 [0,0,0,0,0,0|4,0,0]=4 384 B9R1.69 NC1=NC=C(Cl)N=C1Br B25290 [0,0,0,0,0,0|3,0,0]=3 385 B9R1.69 NC1=NC=C(Cl)N=C1Cl A38575 [0,0,0,0,0,0|3,0,0]=3 386 B9R1.69 NC1=NC=C(I)C=C1Br B29918 [0,0,0,0,0,0|4,0,0]=4 387 B9R1.69 NC1=NC=C(I)C=C1F F40751 [0,0,0,0,0,0|4,0,0]=4 388 B9R1.69 O=C1NC=C(Br)N=C1Cl B39992 [0,0,0,0,0,0|3,0,1]=4 389 B9R1.69 O=C1NC=C(Cl)N=C1Cl D39996 [0,0,0,0,0,0|3,0,1]=4 390 B9R1.69 OC1=C(Br)C=C(Br)C=N1 D40657 [0,0,0,0,0,0|4,0,0]=4 391 B9R1.69 OC1=C(Br)C=C(Cl)C=N1 B37047 [0,0,0,0,0,0|4,0,0]=4 392 B9R1.69 OC1=C(Br)N=C(I)C=C1 B63091 [0,0,0,0,0,0|4,0,0]=4 393 B9R1.69 OC1=C(Cl)N=C(I)C=C1 C21995 [0,0,0,0,0,0|4,0,0]=4 394 B9R1.69 OC1=C(F)N=C(Br)C=C1 B40664 [0,0,0,0,0,0|4,0,0]=4 395 B9R1.69 OC1=C(F)N=C(Cl)C=C1 C40679 [0,0,0,0,0,0|4,0,0]=4 396 B9R1.69 OC1=C(I)C=C(I)C=N1 D40684 [0,0,0,0,0,0|4,0,0]=4 397 B9R1.69 OC1=CC(Br)=C(Cl)N=C1 B18505 [0,0,0,0,0,0|4,0,0]=4 398 B9R1.69 OC1=CC(Br)=C(F)N=C1 B40663 [0,0,0,0,0,0|4,0,0]=4 399 B9R1.69 OC1=CC(Br)=CN=C1Br D40655 [0,0,0,0,0,0|4,0,0]=4 400 B9R1.69 OC1=CC(Br)=CN=C1Cl B9981 [0,0,0,0,0,0|4,0,0]=4 401 B9R1.69 OC1=CC(Br)=CN=C1O B36779 [0,0,0,0,0,0|4,0,0]=4 402 B9R1.69 OC1=CC(Cl)=C(F)N=C1 C40678 [0,0,0,0,0,0|4,0,0]=4 403 B9R1.69 OC1=CC(Cl)=CN=C1Br B37041 [0,0,0,0,0,0|4,0,0]=4 404 B9R1.69 OC1=CC(Cl)=CN=C1O C40837 [0,0,0,0,0,0|4,0,0]=4 405 B9R1.69 OC1=CC(F)=CN=C1Cl C40676 [0,0,0,0,0,0|4,0,0]=4 406 B9R1.69 OC1=CC=C(Br)N=C1Br D39120 [0,0,0,0,0,0|4,0,0]=4 407 B9R1.69 OC1=CC=C(Br)N=C1I B40667 [0,0,0,0,0,0|4,0,0]=4 408 B9R1.69 OC1=CC=C(Cl)C(Cl)=N1 D40675 [0,0,0,0,0,0|4,0,0]=4 409 B9R1.69 OC1=CC=C(Cl)N=C1Cl D40669 [0,0,0,0,0,0|4,0,0]=4 410 B9R1.69 OC1=CC=C(Cl)N=C1I C40681 [0,0,0,0,0,0|4,0,0]=4 411 B9R1.69 OC1=CC=C(F)N=C1F D40683 [0,0,0,0,0,0|4,0,0]=4 412 B9R1.69 OC1=CC=C(F)N=C1I F22349 [0,0,0,0,0,0|4,0,0]=4 413 B9R1.69 OC1=CN=C(Br)C(Cl)=C1 B40660 [0,0,0,0,0,0|4,0,0]=4 414 B9R1.69 OC1=CN=C(Cl)C(Cl)=C1 D40671 [0,0,0,0,0,0|4,0,0]=4 415 B9R1.69 OC1=CN=C(Cl)C(F)=C1 C25929 [0,0,0,0,0,0|4,0,0]=4 416 B9R1.69 OC1=NC=C(Br)N=C1Br D39990 [0,0,0,0,0,0|3,0,0]=3 417 B9R1.69 OC1=NC=C(Cl)C=C1F C40677 [0,0,0,0,0,0|4,0,0]=4 418 B9R1.69 OC1=NC=C(I)C=C1Br B40666 [0,0,0,0,0,0|4,0,0]=4 419 B8R1.3 BrC1=CN=C(Br)C=C1 D4497 [1,0,0,0,0,0|3,0,0]=4 420 B8R1.3 BrC1=CN=C(Br)C=N1 D3577 [1,0,0,0,0,0|2,0,0]=3 421 B8R1.3 BrC1=CN=C(I)C=C1 B1586 [1,0,0,0,0,0|3,0,0]=4 422 B8R1.3 BrC1=CN=C(I)C=N1 B3582 [1,0,0,0,0,0|2,0,0]=3 423 B8R1.3 BrC1=NC=C(I)C=C1 B12390 [1,0,0,0,0,0|3,0,0]=4 424 B8R1.3 CC1=CC=C(C)N=N1 D43182 [1,0,0,0,0,0|2,0,0]=3 425 B8R1.3 CC1=CC=C(I)C=C1 K68149 [1,0,0,0,0,0|3,0,0]=4 426 B8R1.3 CC1=CC=C(N)N=N1 A0340 [1,0,0,0,0,0|3,0,0]=4 427 B8R1.3 CC1=CC=C([Mg+])C=C1 M31731 [1,0,0,0,0,0|3,0,0]=4 428 B8R1.3 CC1=CN=C(Br)C=C1 B4672 [1,0,0,0,0,0|2,0,0]=3 429 B8R1.3 CC1=CN=C(Br)C=N1 B14614 [1,0,0,0,0,0|1,0,0]=2 430 B8R1.3 CC1=CN=C(Br)N=C1 B67690 [1,0,0,0,0,0|3,0,0]=4 431 B8R1.3 CC1=CN=C(Cl)C=C1 C21968 [1,0,0,0,0,0|2,0,0]=3 432 B8R1.3 CC1=CN=C(Cl)C=N1 C40876 [1,0,0,0,0,0|1,0,0]=2 433 B8R1.3 CC1=CN=C(Cl)N=C1 C4929 [1,0,0,0,0,0|3,0,0]=4 434 B8R1.3 CC1=CN=C(F)C=C1 F22553 [1,0,0,0,0,0|2,0,0]=3 435 B8R1.3 CC1=CN=C(N)C=C1 M20542 [1,0,0,0,0,0|2,0,0]=3 436 B8R1.3 CC1=CN=C(N)C=N1 M14592 [1,0,0,0,0,0|1,0,0]=2 437 B8R1.3 CC1=CN=C(N)N=C1 A0080 [1,0,0,0,0,0|3,0,0]=4 438 B8R1.3 CC1=CN=C(N)N=C1 M38708 [1,0,0,0,0,0|3,0,0]=4 439 B8R1.3 CC1=CN=C(O)C=C1 M63706 [1,0,0,0,0,0|2,0,0]=3 440 B8R1.3 CC1=CNC(=O)C=C1 M68372 [1,0,0,0,0,0|2,0,1]=4 441 B8R1.3 CC1=CNC(=O)C=N1 M68091 [1,0,0,0,0,0|1,0,1]=3 442 B8R1.3 CC1=NC=C(Br)C=C1 B5402 [1,0,0,0,0,0|2,0,0]=3 443 B8R1.3 CC1=NC=C(Br)C=N1 B0659 [1,0,0,0,0,0|3,0,0]=4 444 B8R1.3 CC1=NC=C(Cl)C=C1 C42845 [1,0,0,0,0,0|2,0,0]=3 445 B8R1.3 CC1=NC=C(Cl)C=N1 C40879 [1,0,0,0,0,0|3,0,0]=4 446 B8R1.3 CC1=NC=C(F)C=C1 F1117 [1,0,0,0,0,0|2,0,0]=3 447 B8R1.3 CC1=NC=C(F)C=N1 F40883 [1,0,0,0,0,0|3,0,0]=4 448 B8R1.3 CC1=NC=C(I)C=C1 I36966 [1,0,0,0,0,0|2,0,0]=3 449 B8R1.3 CC1=NC=C(N)C=C1 A1121 [1,0,0,0,0,0|2,0,0]=3 450 B8R1.3 CC1=NC=C(N)C=N1 A10293 [1,0,0,0,0,0|3,0,0]=4 451 B8R1.3 CC1=NC=C(O)C=C1 H4553 [1,0,0,0,0,0|2,0,0]=3 452 B8R1.3 CC1=NC=C(O)C=N1 M23235 [1,0,0,0,0,0|3,0,0]=4 453 B8R1.3 CC1=NN=C(Br)C=C1 B10633 [1,0,0,0,0,0|3,0,0]=4 454 B8R1.3 CC1=NN=C(Cl)C=C1 C3219 [1,0,0,0,0,0|3,0,0]=4 455 B8R1.3 CC1=NN=C(I)C=C1 I10435 [1,0,0,0,0,0|3,0,0]=4 456 B8R1.3 CC1=NNC(=O)C=C1 M0242 [1,0,0,0,0,0|3,0,0]=4 457 B8R1.3 CC1=NNC(=O)C=C1 M25029 [1,0,0,0,0,0|3,0,0]=4 458 B8R1.3 CC1=NNC(=O)C=C1 M41309 [1,0,0,0,0,0|3,0,0]=4 459 B8R1.3 ClC1=CN=C(Br)C=C1 B4976 [1,0,0,0,0,0|3,0,0]=4 460 B8R1.3 ClC1=CN=C(Br)C=N1 B3581 [1,0,0,0,0,0|2,0,0]=3 461 B8R1.3 ClC1=CN=C(Cl)C=C1 D4510 [1,0,0,0,0,0|3,0,0]=4 462 B8R1.3 ClC1=CN=C(Cl)C=N1 D3587 [1,0,0,0,0,0|2,0,0]=3 463 B8R1.3 ClC1=CN=C(I)C=C1 I4551 [1,0,0,0,0,0|3,0,0]=4 464 B8R1.3 ClC1=CN=C(I)C=N1 C39982 [1,0,0,0,0,0|2,0,0]=3 465 B8R1.3 ClC1=NC=C(Br)C=C1 B3973 [1,0,0,0,0,0|3,0,0]=4 466 B8R1.3 ClC1=NC=C(I)C=C1 C24918 [1,0,0,0,0,0|3,0,0]=4 467 B8R1.3 FC1=CN=C(Br)C=C1 B40635 [1,0,0,0,0,0|3,0,0]=4 468 B8R1.3 FC1=CN=C(Br)C=N1 B39978 [1,0,0,0,0,0|2,0,0]=3 469 B8R1.3 FC1=CN=C(Cl)C=C1 C40641 [1,0,0,0,0,0|3,0,0]=4 470 B8R1.3 FC1=CN=C(F)C=C1 D40649 [1,0,0,0,0,0|3,0,0]=4 471 B8R1.3 FC1=CN=C(I)C=C1 F38230 [1,0,0,0,0,0|3,0,0]=4 472 B8R1.3 FC1=NC=C(Br)C=C1 B4730 [1,0,0,0,0,0|3,0,0]=4 473 B8R1.3 FC1=NC=C(Cl)C=C1 C40644 [1,0,0,0,0,0|3,0,0]=4 474 B8R1.3 FC1=NC=C(I)C=C1 F40650 [1,0,0,0,0,0|3,0,0]=4 475 B8R1.3 NC1=CN=C(Br)C=C1 A4783 [1,0,0,0,0,0|3,0,0]=4 476 B8R1.3 NC1=CN=C(Br)C=N1 A2854 [1,0,0,0,0,0|2,0,0]=3 477 B8R1.3 NC1=CN=C(Cl)C=C1 C39174 [1,0,0,0,0,0|3,0,0]=4 478 B8R1.3 NC1=CN=C(Cl)C=N1 A0684 [1,0,0,0,0,0|2,0,0]=3 479 B8R1.3 NC1=CN=C(F)C=C1 A12653 [1,0,0,0,0,0|3,0,0]=4 480 B8R1.3 NC1=CN=C(I)C=C1 A40889 [1,0,0,0,0,0|3,0,0]=4 481 B8R1.3 NC1=CN=C(I)C=N1 A40087 [1,0,0,0,0,0|2,0,0]=3 482 B8R1.3 NC1=CN=C(N)C=N1 P40199 [1,0,0,0,0,0|2,0,0]=3 483 B8R1.3 NC1=CN=C(N)C=N1 P40324 [1,0,0,0,0,0|2,0,0]=3 484 B8R1.3 NC1=NC=C(Br)C=C1 A5382 [1,0,0,0,0,0|3,0,0]=4 485 B8R1.3 NC1=NC=C(F)C=C1 A3607 [1,0,0,0,0,0|3,0,0]=4 486 B8R1.3 NC1=NC=C(I)C=C1 K4516 [1,0,0,0,0,0|3,0,0]=4 487 B8R1.3 NC1=NN=C(Br)C=N1 A39826 [1,0,0,0,0,0|3,0,0]=4 488 B8R1.3 OC1=CN=C(Br)C=C1 B0344 [1,0,0,0,0,0|3,0,0]=4 489 B8R1.3 OC1=CN=C(Br)C=N1 B14598 [1,0,0,0,0,0|2,0,0]=3 490 B8R1.3 OC1=CN=C(Cl)C=C1 C4788 [1,0,0,0,0,0|3,0,0]=4 491 B8R1.3 OC1=CN=C(Cl)C=N1 C38694 [1,0,0,0,0,0|2,0,0]=3 492 B8R1.3 OC1=CN=C(F)C=C1 F5147 [1,0,0,0,0,0|3,0,0]=4 493 B8R1.3 OC1=NC=C(Br)C=C1 B39171 [1,0,0,0,0,0|3,0,0]=4 494 B8R1.3 OC1=NC=C(Br)C=C1 B39172 [1,0,0,0,0,0|3,0,0]=4 495 B8R1.3 OC1=NC=C(F)C=C1 F36674 [1,0,0,0,0,0|3,0,0]=4 496 B8R1.3 OC1=NC=C(I)C=C1 K40858 [1,0,0,0,0,0|3,0,0]=4 497 B8R1.3 SC1=NC=C(Br)C=C1 B40822 [1,0,0,0,0,0|3,0,0]=4 498 B8R1.4 BrC1=CC(I)=CN=C1 B22533 [1,0,0,0,0,0|3,0,0]=4 499 B8R1.4 BrC1=CC=CC(Br)=N1 D24616 [1,0,0,0,0,0|3,0,0]=4 500 B8R1.4 BrC1=CC=CC(I)=N1 B40637 [1,0,0,0,0,0|3,0,0]=4 501 B8R1.4 BrC1=CN=CC(Br)=C1 D2466 [1,0,0,0,0,0|3,0,0]=4 502 B8R1.4 BrC1=CN=CC(Br)=N1 D39976 [1,0,0,0,0,0|2,0,0]=3 503 B8R1.4 CC1=CC(=O)NN=C1 M5789 [1,0,0,0,0,0|3,0,0]=4 504 B8R1.4 CC1=CC(Br)=CN=C1 B10806 [1,0,0,0,0,0|2,0,0]=3 505 B8R1.4 CC1=CC(Cl)=CN=C1 C22076 [1,0,0,0,0,0|2,0,0]=3 506 B8R1.4 CC1=CC(Cl)=NN=C1 C2948 [1,0,0,0,0,0|3,0,0]=4 507 B8R1.4 CC1=CC(F)=CN=C1 F42848 [1,0,0,0,0,0|2,0,0]=3 508 B8R1.4 CC1=CC(O)=CN=C1 H23648 [1,0,0,0,0,0|2,0,0]=3 509 B8R1.4 CC1=CC=CC(=O)N1 M23064 [1,0,0,0,0,0|2,0,1]=4 510 B8R1.4 CC1=CC=CC(Br)=N1 B39267 [1,0,0,0,0,0|2,0,0]=3 511 B8R1.4 CC1=CC=CC(Cl)=N1 C4547 [1,0,0,0,0,0|2,0,0]=3 512 B8R1.4 CC1=CC=CC(F)=N1 F39268 [1,0,0,0,0,0|2,0,0]=3 513 B8R1.4 CC1=CC=CC(I)=C1 K68735 [1,0,0,0,0,0|3,0,0]=4 514 B8R1.4 CC1=CC=CC(I)=N1 K42850 [1,0,0,0,0,0|2,0,0]=3 515 B8R1.4 CC1=CC=CC(N)=N1 A13755 [1,0,0,0,0,0|2,0,0]=3 516 B8R1.4 CC1=CC=CC(S)=N1 M38177 [1,0,0,0,0,0|2,0,0]=3 517 B8R1.4 CC1=CC=CC([Mg+])=C1 M31730 [1,0,0,0,0,0|3,0,0]=4 518 B8R1.4 CC1=CC=NC(Br)=N1 B40870 [1,0,0,0,0,0|3,0,0]=4 519 B8R1.4 CC1=CC=NC(C)=N1 D43181 [1,0,0,0,0,0|2,0,0]=3 520 B8R1.4 CC1=CC=NC(Cl)=N1 C3497 [1,0,0,0,0,0|3,0,0]=4 521 B8R1.4 CC1=CC=NC(I)=N1 I37139 [1,0,0,0,0,0|3,0,0]=4 522 B8R1.4 CC1=CC=NC(N)=N1 M41141 [1,0,0,0,0,0|3,0,0]=4 523 B8R1.4 CC1=CC=NC(O)=N1 M68180 [1,0,0,0,0,0|3,0,0]=4 524 B8R1.4 CC1=CN=CC(Br)=N1 B38752 [1,0,0,0,0,0|1,0,0]=2 525 B8R1.4 CC1=CN=CC(C)=N1 D69480 [1,0,0,0,0,0|0,0,0]=1 526 B8R1.4 CC1=CN=CC(Cl)=N1 C37906 [1,0,0,0,0,0|1,0,0]=2 527 B8R1.4 CC1=CN=CC(N)=C1 A4718 [1,0,0,0,0,0|2,0,0]=3 528 B8R1.4 CC1=CN=CC(N)=N1 M41139 [1,0,0,0,0,0|1,0,0]=2 529 B8R1.4 CC1=CN=CC(O)=N1 M67557 [1,0,0,0,0,0|1,0,0]=2 530 B8R1.4 CC1=NC=CC(Br)=N1 B32286 [1,0,0,0,0,0|3,0,0]=4 531 B8R1.4 CC1=NC=CC(Cl)=N1 C11598 [1,0,0,0,0,0|3,0,0]=4 532 B8R1.4 CC1=NC=CC(N)=N1 M9010 [1,0,0,0,0,0|3,0,0]=4 533 B8R1.4 CC1=NC=CC(O)=N1 M69189 [1,0,0,0,0,0|3,0,0]=4 534 B8R1.4 ClC1=CC(Br)=CN=C1 B5214 [1,0,0,0,0,0|3,0,0]=4 535 B8R1.4 ClC1=CC(I)=CN=C1 C40646 [1,0,0,0,0,0|3,0,0]=4 536 B8R1.4 ClC1=CC=CC(Br)=N1 B4770 [1,0,0,0,0,0|3,0,0]=4 537 B8R1.4 ClC1=CC=CC(Cl)=N1 D69309 [1,0,0,0,0,0|3,0,0]=4 538 B8R1.4 ClC1=CC=CC(I)=N1 C36686 [1,0,0,0,0,0|3,0,0]=4 539 B8R1.4 ClC1=CN=CC(Cl)=C1 D22607 [1,0,0,0,0,0|3,0,0]=4 540 B8R1.4 ClC1=CN=CC(Cl)=N1 D2303 [1,0,0,0,0,0|2,0,0]=3 541 B8R1.4 FC1=CC(Br)=CN=C1 B4562 [1,0,0,0,0,0|3,0,0]=4 542 B8R1.4 FC1=CC(Cl)=CN=C1 C40642 [1,0,0,0,0,0|3,0,0]=4 543 B8R1.4 FC1=CC(I)=CN=C1 F40651 [1,0,0,0,0,0|3,0,0]=4 544 B8R1.4 FC1=CC=CC(Br)=N1 B2593 [1,0,0,0,0,0|3,0,0]=4 545 B8R1.4 FC1=CC=CC(Cl)=N1 C39168 [1,0,0,0,0,0|3,0,0]=4 546 B8R1.4 FC1=CC=CC(F)=N1 D5153 [1,0,0,0,0,0|3,0,0]=4 547 B8R1.4 FC1=CN=CC(F)=C1 D2972 [1,0,0,0,0,0|3,0,0]=4 548 B8R1.4 IC1=CN=CC(I)=C1 D7814 [1,0,0,0,0,0|3,0,0]=4 549 B8R1.4 IC1=CN=CC(I)=N1 D2671 [1,0,0,0,0,0|2,0,0]=3 550 B8R1.4 NC1=CC(Br)=CN=C1 A4523 [1,0,0,0,0,0|3,0,0]=4 551 B8R1.4 NC1=CC(Cl)=CN=C1 C22457 [1,0,0,0,0,0|3,0,0]=4 552 B8R1.4 NC1=CC(F)=CN=C1 F40881 [1,0,0,0,0,0|3,0,0]=4 553 B8R1.4 NC1=CC(O)=CN=C1 A41024 [1,0,0,0,0,0|3,0,0]=4 554 B8R1.4 NC1=CC(O)=CN=C1 A41394 [1,0,0,0,0,0|3,0,0]=4 555 B8R1.4 NC1=CC=CC(Br)=N1 A1106 [1,0,0,0,0,0|3,0,0]=4 556 B8R1.4 NC1=CC=CC(Cl)=N1 A1775 [1,0,0,0,0,0|3,0,0]=4 557 B8R1.4 NC1=CC=CC(F)=N1 A40882 [1,0,0,0,0,0|3,0,0]=4 558 B8R1.4 NC1=CC=CC(I)=N1 K40888 [1,0,0,0,0,0|3,0,0]=4 559 B8R1.4 NC1=CC=CC(N)=N1 P69294 [1,0,0,0,0,0|3,0,0]=4 560 B8R1.4 NC1=CC=CC(O)=N1 A3198 [1,0,0,0,0,0|3,0,0]=4 561 B8R1.4 NC1=CN=CC(Br)=N1 B24169 [1,0,0,0,0,0|2,0,0]=3 562 B8R1.4 NC1=CN=CC(Cl)=N1 A2337 [1,0,0,0,0,0|2,0,0]=3 563 B8R1.4 NC1=CN=CC(N)=C1 P41138 [1,0,0,0,0,0|3,0,0]=4 564 B8R1.4 NC1=CN=CC(N)=N1 P40325 [1,0,0,0,0,0|2,0,0]=3 565 B8R1.4 OC1=CC(Br)=CN=C1 B13207 [1,0,0,0,0,0|3,0,0]=4 566 B8R1.4 OC1=CC(Cl)=CN=C1 C40849 [1,0,0,0,0,0|3,0,0]=4 567 B8R1.4 OC1=CC(F)=CN=C1 F40851 [1,0,0,0,0,0|3,0,0]=4 568 B8R1.4 OC1=CC=CC(F)=N1 F40852 [1,0,0,0,0,0|3,0,0]=4 569 B8R1.4 OC1=CN=CC(Cl)=N1 C40042 [1,0,0,0,0,0|2,0,0]=3 570 B8R1.4 OC1=CN=CC(O)=C1 P28714 [1,0,0,0,0,0|3,0,0]=4 571 B8R1.5 BrC1=C(I)C=CC=N1 B40636 [1,0,0,0,0,0|3,0,0]=4 572 B8R1.5 BrC1=NC=CN=C1Br D39975 [1,0,0,0,0,0|2,0,0]=3 573 B8R1.5 CC1=C(Br)C=CC=N1 B10407 [1,0,0,0,0,0|2,0,0]=3 574 B8R1.5 CC1=C(Br)C=NC=N1 B14434 [1,0,0,0,0,0|3,0,0]=4 575 B8R1.5 CC1=C(Cl)C=CC=N1 C42843 [1,0,0,0,0,0|2,0,0]=3 576 B8R1.5 CC1=C(F)C=CC=N1 F69193 [1,0,0,0,0,0|2,0,0]=3 577 B8R1.5 CC1=C(I)C=CC=C1 K67847 [1,0,0,0,0,0|3,0,0]=4 578 B8R1.5 CC1=C(I)C=NC=N1 K40890 [1,0,0,0,0,0|3,0,0]=4 579 B8R1.5 CC1=C(O)C=CC=N1 H10468 [1,0,0,0,0,0|2,0,0]=3 580 B8R1.5 CC1=C([Mg+])C=CC=C1 M31729 [1,0,0,0,0,0|3,0,0]=4 581 B8R1.5 CC1=CC=CN=C1Br B13771 [1,0,0,0,0,0|2,0,0]=3 582 B8R1.5 CC1=CC=CN=C1C L68373 [1,0,0,0,0,0|1,0,0]=2 583 B8R1.5 CC1=CC=CN=C1Cl C21969 [1,0,0,0,0,0|2,0,0]=3 584 B8R1.5 CC1=CC=CN=C1F F42847 [1,0,0,0,0,0|2,0,0]=3 585 B8R1.5 CC1=CC=CN=C1N M20541 [1,0,0,0,0,0|2,0,0]=3 586 B8R1.5 CC1=CC=CNC1=O M68618 [1,0,0,0,0,0|2,0,1]=4 587 B8R1.5 CC1=CC=NN=C1Cl C20457 [1,0,0,0,0,0|3,0,0]=4 588 B8R1.5 CC1=CC=NN=C1Cl C2949 [1,0,0,0,0,0|3,0,0]=4 589 B8R1.5 CC1=CN=CN=C1Cl C24055 [1,0,0,0,0,0|3,0,0]=4 590 B8R1.5 CC1=CN=CN=C1N A38299 [1,0,0,0,0,0|3,0,0]=4 591 B8R1.5 CC1=CN=CN=C1O H41028 [1,0,0,0,0,0|3,0,0]=4 592 B8R1.5 CC1=NC=CN=C1Br B14599 [1,0,0,0,0,0|1,0,0]=2 593 B8R1.5 CC1=NC=CN=C1Cl C14608 [1,0,0,0,0,0|1,0,0]=2 594 B8R1.5 CC1=NC=CN=C1I I14601 [1,0,0,0,0,0|1,0,0]=2 595 B8R1.5 CC1=NC=CN=C1N A14593 [1,0,0,0,0,0|1,0,0]=2 596 B8R1.5 CC1=NC=CN=C1O H14600 [1,0,0,0,0,0|1,0,0]=2 597 B8R1.5 CC1=NC=NC=C1N A14334 [1,0,0,0,0,0|3,0,0]=4 598 B8R1.5 ClC1=C(Br)C=CC=N1 B9483 [1,0,0,0,0,0|3,0,0]=4 599 B8R1.5 ClC1=C(I)C=CC=N1 C3030 [1,0,0,0,0,0|3,0,0]=4 600 B8R1.5 ClC1=CC=CN=C1Br B40634 [1,0,0,0,0,0|3,0,0]=4 601 B8R1.5 ClC1=CC=CN=C1Cl D5123 [1,0,0,0,0,0|3,0,0]=4 602 B8R1.5 ClC1=CC=CN=C1I C25332 [1,0,0,0,0,0|3,0,0]=4 603 B8R1.5 ClC1=NC=CN=C1Br B37498 [1,0,0,0,0,0|2,0,0]=3 604 B8R1.5 ClC1=NC=CN=C1Cl D7674 [1,0,0,0,0,0|2,0,0]=3 605 B8R1.5 ClC1=NC=CN=C1I C39981 [1,0,0,0,0,0|2,0,0]=3 606 B8R1.5 FC1=C(Br)C=CC=N1 B2291 [1,0,0,0,0,0|3,0,0]=4 607 B8R1.5 FC1=C(Cl)C=CC=N1 C3434 [1,0,0,0,0,0|3,0,0]=4 608 B8R1.5 FC1=C(I)C=CC=N1 F2381 [1,0,0,0,0,0|3,0,0]=4 609 B8R1.5 FC1=CC=CN=C1Br B3502 [1,0,0,0,0,0|3,0,0]=4 610 B8R1.5 FC1=CC=CN=C1Cl C3353 [1,0,0,0,0,0|3,0,0]=4 611 B8R1.5 FC1=CC=CN=C1F D40648 [1,0,0,0,0,0|3,0,0]=4 612 B8R1.5 FC1=CC=CN=C1I F10819 [1,0,0,0,0,0|3,0,0]=4 613 B8R1.5 FC1=NC=CN=C1I F6274 [1,0,0,0,0,0|2,0,0]=3 614 B8R1.5 NC1=C(Br)C=CC=N1 A12591 [1,0,0,0,0,0|3,0,0]=4 615 B8R1.5 NC1=C(Cl)C=CC=N1 A3433 [1,0,0,0,0,0|3,0,0]=4 616 B8R1.5 NC1=C(F)C=CC=N1 A37908 [1,0,0,0,0,0|3,0,0]=4 617 B8R1.5 NC1=C(I)C=CC=N1 I0599 [1,0,0,0,0,0|3,0,0]=4 618 B8R1.5 NC1=C(O)C=CC=N1 A31053 [1,0,0,0,0,0|3,0,0]=4 619 B8R1.5 NC1=CC=CN=C1Br A4535 [1,0,0,0,0,0|3,0,0]=4 620 B8R1.5 NC1=CC=CN=C1Cl C0716 [1,0,0,0,0,0|3,0,0]=4 621 B8R1.5 NC1=CC=CN=C1F F9484 [1,0,0,0,0,0|3,0,0]=4 622 B8R1.5 NC1=CC=CN=C1I K40887 [1,0,0,0,0,0|3,0,0]=4 623 B8R1.5 NC1=CC=CN=C1O A0666 [1,0,0,0,0,0|3,0,0]=4 624 B8R1.5 NC1=NC=CN=C1Br A38037 [1,0,0,0,0,0|2,0,0]=3 625 B8R1.5 NC1=NC=CN=C1Cl A5117 [1,0,0,0,0,0|2,0,0]=3 626 B8R1.5 NC1=NC=CN=C1N D14607 [1,0,0,0,0,0|2,0,0]=3 627 B8R1.5 NC1=NC=CNC1=O A40130 [1,0,0,0,0,0|2,0,1]=4 628 B8R1.5 O=C1NC=CN=C1Cl C40043 [1,0,0,0,0,0|2,0,1]=4 629 B8R1.5 OC1=C(Cl)C=CC=N1 C40847 [1,0,0,0,0,0|3,0,0]=4 630 B8R1.5 OC1=C(F)C=CC=N1 F40853 [1,0,0,0,0,0|3,0,0]=4 631 B8R1.5 OC1=C(I)C=CC=N1 K40856 [1,0,0,0,0,0|3,0,0]=4 632 B8R1.5 OC1=CC=CN=C1Br B12744 [1,0,0,0,0,0|3,0,0]=4 633 B8R1.5 OC1=CC=CN=C1Cl C10469 [1,0,0,0,0,0|3,0,0]=4 634 B8R1.5 OC1=CC=CN=C1F F40850 [1,0,0,0,0,0|3,0,0]=4 635 B8R1.5 OC1=CC=CN=C1I H23528 [1,0,0,0,0,0|3,0,0]=4 636 B8R1.5 OC1=NC=CN=C1Br B40038 [1,0,0,0,0,0|2,0,0]=3 637 B8R1.5 OC1=NC=CN=C1O P40073 [1,0,0,0,0,0|2,0,0]=3 638 B10R1.22 CC1=C(C)C(Cl)=CC(Cl)=N1 D45797 [0,1,0,0,0,0|2,0,0]=3 639 B10R1.22 CC1=C(C)C(O)=CC(=O)N1 H46410 [0,1,0,0,0,0|2,0,1]=4 640 B10R1.22 CC1=C(C)C(O)=CC(=O)O1 H46256 [0,1,0,0,0,0|3,0,0]=4 641 B10R1.22 CC1=CC(Br)=C(Cl)C(C)=C1 B48761 [0,1,0,0,0,0|3,0,0]=4 642 B10R1.22 CC1=CC(Br)=C(N)C(C)=C1 B46726 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.22 CC1=CC(Br)=NC(C)=C1Br D45762 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.22 CC1=CC(C)=C(Br)C(C)=C1 T39543 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.22 CC1=CC(C)=C(I)C(C)=C1 T67936 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.22 CC1=CC(C)=C(N)C(Br)=N1 B46279 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.22 CC1=CC(C)=C([Mg+])C(C)=C1 T31756 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.22 CC1=CC(Cl)=C(C)C(Cl)=N1 D45795 [0,1,0,0,0,0|2,0,0]=3 649 B10R1.22 CC1=CC(Cl)=C(F)C(C)=N1 C36765 [0,1,0,0,0,0|2,0,0]=3 650 B10R1.22 CC1=CC(Cl)=NC(C)=C1Cl D45796 [0,1,0,0,0,0|3,0,0]=4 651 B10R1.22 CC1=CC(I)=CC(C)=C1C I39117 [0,1,0,0,0,0|3,0,0]=4 652 B10R1.22 CC1=CC(N)=C(Br)C(C)=N1 B46280 [0,1,0,0,0,0|2,0,0]=3 653 B10R1.22 CC1=CC(N)=C(N)C(C)=C1 D46968 [0,1,0,0,0,0|3,0,0]=4 654 B10R1.22 CC1=CC(N)=CC(C)=C1C T50310 [0,1,0,0,0,0|3,0,0]=4 655 B10R1.22 CC1=CC(N)=NC(C)=C1Br B68803 [0,1,0,0,0,0|3,0,0]=4 656 B10R1.22 CC1=CC(O)=C(Br)C(C)=C1 B62062 [0,1,0,0,0,0|3,0,0]=4 657 B10R1.22 CC1=CC(O)=C(C)C(=O)N1 H46409 [0,1,0,0,0,0|2,0,1]=4 658 B10R1.22 CC1=CC(O)=C(C)C(C)=C1 T68899 [0,1,0,0,0,0|2,0,0]=3 659 B10R1.22 CC1=CC(O)=C(N)C(C)=N1 A43635 [0,1,0,0,0,0|2,0,0]=3 660 B10R1.22 CC1=CC(O)=CC(Br)=C1C B38894 [0,1,0,0,0,0|3,0,0]=4 661 B10R1.22 CC1=NC(C)=C(Cl)C(Cl)=N1 D42748 [0,1,0,0,0,0|3,0,0]=4 662 B10R1.22 CC1=NC(Cl)=C(Br)C(C)=N1 B42731 [0,1,0,0,0,0|3,0,0]=4 663 B10R1.22 CC1=NC(Cl)=C(C)C(Cl)=N1 D38384 [0,1,0,0,0,0|3,0,0]=4 664 B10R1.22 CC1=NC(Cl)=NC(Cl)=C1C D42746 [0,1,0,0,0,0|3,0,0]=4 665 B10R1.22 CC1=NC(N)=C(C)C(Cl)=N1 C43279 [0,1,0,0,0,0|3,0,0]=4 666 B10R1.22 CC1=NC(N)=C(F)C(C)=N1 F43284 [0,1,0,0,0,0|3,0,0]=4 667 B10R1.22 CC1=NC(O)=NC(O)=C1C D38138 [0,1,0,0,0,0|3,0,0]=4 668 B10R1.25 C#CC1=NC=C(C)C=C1N E8223 [0,1,0,0,0,0|2,0,1]=4 669 B10R1.25 CC1=C(C#N)C=CC(Br)=N1 B44757 [0,1,0,0,0,0|2,0,1]=4 670 B10R1.25 CC1=C(C#N)C=CC(Cl)=N1 C69365 [0,1,0,0,0,0|2,0,1]=4 671 B10R1.25 CC1=C(C=O)C=CC(Cl)=N1 C45486 [0,1,0,0,0,0|2,0,1]=4 672 B10R1.25 CC1=C(C=O)C=CC(F)=N1 F45499 [0,1,0,0,0,0|2,0,1]=4 673 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 B48758 [0,1,0,0,0,0|3,0,0]=4 674 B10R1.25 CC1=C(CF)C=CC(Br)=C1 B48770 [0,1,0,0,0,0|3,0,0]=4 675 B10R1.25 CC1=C(CN)C=CC(Br)=C1 B46736 [0,1,0,0,0,0|3,0,0]=4 676 B10R1.25 CC1=C(CN)C=CC(Br)=C1 B46744 [0,1,0,0,0,0|3,0,0]=4 677 B10R1.25 CC1=C(CO)C=CC(Br)=C1 B61046 [0,1,0,0,0,0|3,0,0]=4 678 B10R1.25 CC1=C(CO)C=CC(F)=N1 F46222 [0,1,0,0,0,0|2,0,0]=3 679 B10R1.25 CC1=C(CO)C=CC(N)=C1 A39080 [0,1,0,0,0,0|3,0,0]=4 680 B10R1.25 CC1=CC(Br)=C(C#N)N=C1 B44752 [0,1,0,0,0,0|2,0,1]=4 681 B10R1.25 CC1=CC(Br)=CN=C1C#N B20439 [0,1,0,0,0,0|2,0,1]=4 682 B10R1.25 CC1=CC(Br)=CN=C1C=O B61323 [0,1,0,0,0,0|2,0,1]=4 683 B10R1.25 CC1=CC(Br)=CN=C1CN B46293 [0,1,0,0,0,0|2,0,0]=3 684 B10R1.25 CC1=CC(C)=C(C=O)C=C1 D49874 [0,1,0,0,0,0|2,0,1]=4 685 B10R1.25 CC1=CC(C)=C(CBr)C=C1 B49966 [0,1,0,0,0,0|2,0,0]=3 686 B10R1.25 CC1=CC(C)=C(CO)C=C1 D50273 [0,1,0,0,0,0|2,0,0]=3 687 B10R1.25 CC1=CC(C)=C(NN)C=C1 D49534 [0,1,0,0,0,0|3,0,0]=4 688 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 C46753 [0,1,0,0,0,0|3,0,0]=4 689 B10R1.25 CC1=CC(Cl)=CN=C1C#N C44782 [0,1,0,0,0,0|2,0,1]=4 690 B10R1.25 CC1=CC(N)=C(CO)C=C1 A46913 [0,1,0,0,0,0|3,0,0]=4 691 B10R1.25 CC1=CC(O)=CN=C1C#N H45224 [0,1,0,0,0,0|2,0,1]=4 692 B10R1.25 CC1=CC=C(C#N)C(Br)=N1 B14778 [0,1,0,0,0,0|2,0,1]=4 693 B10R1.25 CC1=CC=C(C#N)C(Cl)=N1 C12889 [0,1,0,0,0,0|2,0,1]=4 694 B10R1.25 CC1=CC=C(C=O)C(Cl)=N1 C45484 [0,1,0,0,0,0|2,0,1]=4 695 B10R1.25 CC1=CC=C(CBr)C(Br)=N1 B45763 [0,1,0,0,0,0|2,0,0]=3 696 B10R1.25 CC1=CN=C(CCl)C(C)=C1 C38639 [0,1,0,0,0,0|1,0,0]=2 697 B10R1.25 CC1=CN=C(CO)C(C)=C1 D46914 [0,1,0,0,0,0|1,0,0]=2 698 B10R1.25 CC1=NC(=O)C(CO)=CN1 H43232 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.25 CC1=NC(C)=C(CO)C=C1 D64003 [0,1,0,0,0,0|1,0,0]=2 700 B10R1.25 CC1=NC(N)=C(CO)C=N1 A67768 [0,1,0,0,0,0|3,0,0]=4 701 B10R1.25 CC1=NC=C(CN)C(N)=N1 A61754 [0,1,0,0,0,0|3,0,0]=4 702 B10R1.25 CCC1=NC=C(Br)C=C1N A11260 [0,1,0,0,0,0|3,0,0]=4 703 B10R1.25 CCC1=NC=C(Cl)N=C1Cl D42741 [0,1,0,0,0,0|2,0,0]=3 704 B10R1.25 CNC1=C(Br)C=C(C)C=C1 B46730 [0,1,0,0,0,0|3,0,0]=4 705 B10R1.25 CNC1=NC=C(Br)C=C1N B26263 [0,1,0,0,0,0|3,0,0]=4 706 B10R1.25 COC1=C(Br)C=C(Br)C=N1 D42633 [0,1,0,0,0,0|3,0,0]=4 707 B10R1.25 COC1=C(Br)C=C(C)C=N1 B46168 [0,1,0,0,0,0|2,0,0]=3 708 B10R1.25 COC1=C(Br)C=C(Cl)C=N1 B16110 [0,1,0,0,0,0|3,0,0]=4 709 B10R1.25 COC1=C(Br)C=C(F)C=N1 B42652 [0,1,0,0,0,0|3,0,0]=4 710 B10R1.25 COC1=C(Br)C=C(N)C=N1 B43055 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.25 COC1=C(Br)C=C(O)C=N1 B42852 [0,1,0,0,0,0|3,0,0]=4 712 B10R1.25 COC1=C(Br)N=C(I)C=C1 B36842 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.25 COC1=C(C)C=C(Br)C=C1 B49440 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.25 COC1=C(C)C=C(C)C=C1 D50266 [0,1,0,0,0,0|2,0,0]=3 715 B10R1.25 COC1=C(C)C=C(F)C=C1 F49467 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.25 COC1=C(C)C=C(I)C=C1 K49474 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.25 COC1=C(C)C=C(N)C=C1 M46909 [0,1,0,0,0,0|3,0,0]=4 718 B10R1.25 COC1=C(C)C=C(O)C=C1 M38275 [0,1,0,0,0,0|3,0,0]=4 719 B10R1.25 COC1=C(C)C=C([Mg+])C=C1 M31769 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.25 COC1=C(C)N=C(Br)C=C1 B46175 [0,1,0,0,0,0|2,0,0]=3 721 B10R1.25 COC1=C(C)N=C(Cl)N=C1 C43074 [0,1,0,0,0,0|3,0,0]=4 722 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C46202 [0,1,0,0,0,0|2,0,0]=3 723 B10R1.25 COC1=C(Cl)C=C(N)C=N1 C43070 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.25 COC1=C(F)C=C(N)C=N1 A43085 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.25 COC1=C(I)C=C(Br)C=N1 B42657 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.25 COC1=C(I)C=C(C)C=C1 K62337 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.25 COC1=C(N)N=C(Br)C=C1 B36893 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.25 COC1=C(N)N=C(F)C=C1 F43084 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.25 COC1=C([Mg+])C=C(C)C=C1 M31765 [0,1,0,0,0,0|3,0,0]=4 730 B10R1.25 COC1=CC=C(Br)N=C1Br D42631 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.25 COC1=CC=C(C)N=C1Br B3731 [0,1,0,0,0,0|2,0,0]=3 732 B10R1.25 COC1=CC=C(C)N=C1Cl C46200 [0,1,0,0,0,0|2,0,0]=3 733 B10R1.25 COC1=CC=C(Cl)N=C1Br B42641 [0,1,0,0,0,0|3,0,0]=4 734 B10R1.25 COC1=CC=C(N)N=C1Cl C10744 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.25 COC1=NC=C(Br)C=C1C B46172 [0,1,0,0,0,0|2,0,0]=3 736 B10R1.25 COC1=NC=C(Br)C=C1Cl B42648 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.25 COC1=NC=C(Br)C=C1F B42654 [0,1,0,0,0,0|3,0,0]=4 738 B10R1.25 COC1=NC=C(Br)C=C1N B7645 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.25 COC1=NC=C(Br)C=C1O B10651 [0,1,0,0,0,0|3,0,0]=4 740 B10R1.25 COC1=NC=C(Cl)C=C1F C69055 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.25 COC1=NC=C(F)C=C1C F46221 [0,1,0,0,0,0|2,0,0]=3 742 B10R1.25 COC1=NC=C(F)C=C1N F37439 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.25 COC1=NC=C(N)C=C1C M43642 [0,1,0,0,0,0|2,0,0]=3 744 B10R1.25 COC1=NN=C(Cl)C=C1C C43076 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.25 CSC1=NC=C(Cl)N=C1Cl D20240 [0,1,0,0,0,0|2,0,0]=3 746 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl D11544 [0,1,0,0,0,0|2,0,1]=4 747 B10R1.25 N#CC1=NC=C(N)N=C1Cl A62103 [0,1,0,0,0,0|2,0,1]=4 748 B10R1.25 NC1=CC(Br)=CN=C1CO A12038 [0,1,0,0,0,0|3,0,0]=4 749 B10R1.25 NC1=CC(Cl)=CN=C1CO A59939 [0,1,0,0,0,0|3,0,0]=4 750 B10R1.25 NCC1=C(F)C=C(F)C=N1 D43571 [0,1,0,0,0,0|3,0,0]=4 751 B10R1.25 NCC1=NC=C(Br)C=C1F A12623 [0,1,0,0,0,0|3,0,0]=4 752 B10R1.25 NCC1=NC=C(Br)C=C1F B27080 [0,1,0,0,0,0|3,0,0]=4 753 B10R1.25 NCC1=NC=C(Cl)N=C1Cl D62358 [0,1,0,0,0,0|2,0,0]=3 754 B10R1.25 OCC1=C(Br)C=C(Cl)C=N1 B17743 [0,1,0,0,0,0|3,0,0]=4 755 B10R1.25 OCC1=C(Cl)C=C(Cl)C=N1 D6829 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.25 OCC1=CC=C(Br)N=C1Br D42635 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.25 OCC1=CC=C(Cl)N=C1Cl D0718 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.25 OCC1=NC=C(Br)C=C1Cl B42651 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.25 OCC1=NC=C(Br)C=C1F B0544 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.25 OCC1=NC=C(Cl)C=C1F C13727 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.30 C#CC1=C(N)N=CC(Br)=N1 A42148 [0,1,0,0,0,0|2,0,1]=4 762 B10R1.30 CC1=C(C#N)N=C(Cl)C=C1 C37533 [0,1,0,0,0,0|2,0,1]=4 763 B10R1.30 CC1=C(CBr)C=C(F)C=C1 B48769 [0,1,0,0,0,0|3,0,0]=4 764 B10R1.30 CC1=C(CO)C=C(Br)C=C1 B67343 [0,1,0,0,0,0|3,0,0]=4 765 B10R1.30 CC1=C(CO)C=C(I)C=C1 K49473 [0,1,0,0,0,0|3,0,0]=4 766 B10R1.30 CC1=CC(C#N)=C(N)N=C1 A38354 [0,1,0,0,0,0|2,0,1]=4 767 B10R1.30 CC1=CC(C=O)=C(C)C=C1 D38715 [0,1,0,0,0,0|2,0,1]=4 768 B10R1.30 CC1=CC(CO)=C(Br)C=C1 B63209 [0,1,0,0,0,0|3,0,0]=4 769 B10R1.30 CC1=CC(NN)=C(C)C=C1 D49535 [0,1,0,0,0,0|3,0,0]=4 770 B10R1.30 CC1=CC=C(N)C(CO)=N1 A13503 [0,1,0,0,0,0|2,0,0]=3 771 B10R1.30 CC1=CC=C(O)C(CCl)=N1 C65989 [0,1,0,0,0,0|2,0,0]=3 772 B10R1.30 CC1=CN=C(Br)C(C#N)=C1 B44751 [0,1,0,0,0,0|2,0,1]=4 773 B10R1.30 CC1=CN=C(C)C(C#N)=N1 D45730 [0,1,0,0,0,0|0,0,1]=2 774 B10R1.30 CC1=CN=C(F)C(C#N)=C1 F44798 [0,1,0,0,0,0|2,0,1]=4 775 B10R1.30 CC1=NC(C#N)=C(Br)C=C1 B0632 [0,1,0,0,0,0|2,0,1]=4 776 B10R1.30 CC1=NC(C#N)=C(Cl)C=C1 C44779 [0,1,0,0,0,0|2,0,1]=4 777 B10R1.30 CC1=NC(C=O)=C(Br)C=C1 B63911 [0,1,0,0,0,0|2,0,1]=4 778 B10R1.30 CC1=NC(CO)=C(Br)C=C1 B63914 [0,1,0,0,0,0|2,0,0]=3 779 B10R1.30 CC1=NC(CO)=C(O)C=C1 H46408 [0,1,0,0,0,0|2,0,0]=3 780 B10R1.30 CC1=NC=C(Cl)C=C1C#N C44780 [0,1,0,0,0,0|2,0,1]=4 781 B10R1.30 CNC1=C(C)C=CC(O)=C1 M46910 [0,1,0,0,0,0|3,0,0]=4 782 B10R1.30 CNC1=C(N)C=CC(C)=C1 D46972 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.30 COC1=C(Br)C=CC(C)=C1 B49434 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.30 COC1=C(Br)C=CC(C)=N1 B46169 [0,1,0,0,0,0|2,0,0]=3 785 B10R1.30 COC1=C(Br)C=CC(Cl)=N1 B42644 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.30 COC1=C(Br)C=CC(N)=N1 B17534 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.30 COC1=C(C)C=CC(Br)=C1 B49441 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.30 COC1=C(C)C=CC(C)=C1 M50278 [0,1,0,0,0,0|2,0,0]=3 789 B10R1.30 COC1=C(C)C=CC(N)=C1 M46899 [0,1,0,0,0,0|3,0,0]=4 790 B10R1.30 COC1=C(Cl)N=CC(Br)=N1 B9928 [0,1,0,0,0,0|2,0,0]=3 791 B10R1.30 COC1=C(F)C=CC(C)=N1 F46220 [0,1,0,0,0,0|2,0,0]=3 792 B10R1.30 COC1=C(F)C=CC(Cl)=N1 C32280 [0,1,0,0,0,0|3,0,0]=4 793 B10R1.30 COC1=C(N)C=CC(Br)=N1 B3763 [0,1,0,0,0,0|3,0,0]=4 794 B10R1.30 COC1=C(N)C=CC(C)=C1 M69494 [0,1,0,0,0,0|3,0,0]=4 795 B10R1.30 COC1=C(N)N=CC(Br)=N1 B9924 [0,1,0,0,0,0|2,0,0]=3 796 B10R1.30 COC1=C(N)N=CC(Cl)=N1 C63041 [0,1,0,0,0,0|2,0,0]=3 797 B10R1.30 COC1=C(O)C=CC(Br)=N1 B61798 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.30 COC1=C(O)C=CC(C)=C1 M69495 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.30 COC1=CC(Br)=CN=C1C B16799 [0,1,0,0,0,0|2,0,0]=3 800 B10R1.30 COC1=CC(Br)=CN=C1Cl B9982 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.30 COC1=CC(Br)=CN=C1N B23636 [0,1,0,0,0,0|3,0,0]=4 802 B10R1.30 COC1=CC(F)=CN=C1N F43083 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.30 COC1=CC(N)=CN=C1Br B37681 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.30 COC1=CC(N)=CN=C1Cl C25246 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.30 COC1=CC(O)=CN=C1Cl C12083 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.30 COC1=NC(Br)=CN=C1Br D9925 [0,1,0,0,0,0|2,0,0]=3 807 B10R1.30 COC1=NC(Br)=CN=C1I B9892 [0,1,0,0,0,0|2,0,0]=3 808 B10R1.30 COC1=NC(Br)=CNC1=O B9927 [0,1,0,0,0,0|2,0,1]=4 809 B10R1.30 COC1=NC(C)=CC=C1N A67537 [0,1,0,0,0,0|2,0,0]=3 810 B10R1.30 COC1=NC(C)=CN=C1N M26266 [0,1,0,0,0,0|1,0,0]=2 811 B10R1.30 COC1=NC(C)=NC=C1N M43356 [0,1,0,0,0,0|3,0,0]=4 812 B10R1.30 COC1=NC(N)=CN=C1Br B41091 [0,1,0,0,0,0|2,0,0]=3 813 B10R1.30 ClCC1=CC(Cl)=CN=C1Br B42200 [0,1,0,0,0,0|3,0,0]=4 814 B10R1.30 N#CC1=C(N)N=CC(Br)=N1 A40618 [0,1,0,0,0,0|2,0,1]=4 815 B10R1.30 N#CC1=C(N)N=CC(Cl)=N1 A40625 [0,1,0,0,0,0|2,0,1]=4 816 B10R1.30 N#CC1=NC(Br)=CN=C1Br D14606 [0,1,0,0,0,0|2,0,1]=4 817 B10R1.30 N#CC1=NC(Cl)=CN=C1Cl D41288 [0,1,0,0,0,0|2,0,1]=4 818 B10R1.30 N#CC1=NC(F)=CN=C1F D60504 [0,1,0,0,0,0|2,0,1]=4 819 B10R1.30 NC1=C(C=O)N=C(Br)C=N1 A40807 [0,1,0,0,0,0|2,0,1]=4 820 B10R1.30 NC1=C(C=O)N=C(Cl)C=N1 A40810 [0,1,0,0,0,0|2,0,1]=4 821 B10R1.30 NC1=C(CO)N=C(Br)C=N1 A37107 [0,1,0,0,0,0|2,0,0]=3 822 B10R1.30 NC1=NC=C(Br)C=C1CO A43065 [0,1,0,0,0,0|3,0,0]=4 823 B10R1.30 NC1=NC=C(I)C=C1CO A68723 [0,1,0,0,0,0|3,0,0]=4 824 B10R1.30 NCC1=C(Br)C=CC(Cl)=N1 B42733 [0,1,0,0,0,0|3,0,0]=4 825 B10R1.30 NCC1=CC(Br)=CN=C1F A12901 [0,1,0,0,0,0|3,0,0]=4 826 B10R1.30 O=CC1=NC(Cl)=CN=C1Cl D13384 [0,1,0,0,0,0|2,0,1]=4 827 B10R1.30 OCC1=C(F)C=CC(Cl)=N1 C42671 [0,1,0,0,0,0|3,0,0]=4 828 B10R1.30 OCC1=CC(Br)=CN=C1Cl B12727 [0,1,0,0,0,0|3,0,0]=4 829 B10R1.30 OCC1=CC(Br)=CN=C1F B12899 [0,1,0,0,0,0|3,0,0]=4 830 B10R1.30 OCC1=CC(Cl)=CN=C1Br B42649 [0,1,0,0,0,0|3,0,0]=4 831 B10R1.118 CC1=C(Br)C=C(Br)C(Br)=N1 T42193 [0,1,0,0,0,0|3,0,0]=4 832 B10R1.118 CC1=C(Br)C=C(N)C(Cl)=N1 B42732 [0,1,0,0,0,0|3,0,0]=4 833 B10R1.118 CC1=C(Br)C=C(N)C(N)=N1 B43266 [0,1,0,0,0,0|3,0,0]=4 834 B10R1.118 CC1=C(Br)C=C(N)C(O)=N1 A43060 [0,1,0,0,0,0|3,0,0]=4 835 B10R1.118 CC1=C(Br)N=C(Br)C(N)=N1 D32051 [0,1,0,0,0,0|2,0,0]=3 836 B10R1.118 CC1=C(C)N=C(Cl)C(Cl)=N1 D42744 [0,1,0,0,0,0|1,0,0]=2 837 B10R1.118 CC1=C(C)N=C(Cl)C(N)=N1 C43271 [0,1,0,0,0,0|1,0,0]=2 838 B10R1.118 CC1=C(C)NC(=O)C(Cl)=N1 C43077 [0,1,0,0,0,0|1,0,1]=3 839 B10R1.118 CC1=CC(=O)N(C)N=C1Cl C16622 [0,1,0,0,0,0|3,0,0]=4 840 B10R1.118 CC1=CC(Br)=C(Br)C=C1C D48753 [0,1,0,0,0,0|3,0,0]=4 841 B10R1.118 CC1=CC(Br)=C(C)C=C1Br D39501 [0,1,0,0,0,0|3,0,0]=4 842 B10R1.118 CC1=CC(Br)=C(C)C=C1O B49427 [0,1,0,0,0,0|3,0,0]=4 843 B10R1.118 CC1=CC(Br)=C(C)N=C1N B46283 [0,1,0,0,0,0|2,0,0]=3 844 B10R1.118 CC1=CC(C)=C(Br)C=C1Br D48755 [0,1,0,0,0,0|3,0,0]=4 845 B10R1.118 CC1=CC(C)=C(Br)C=C1C B49964 [0,1,0,0,0,0|2,0,0]=3 846 B10R1.118 CC1=CC(C)=C(Br)N=C1Br D45760 [0,1,0,0,0,0|2,0,0]=3 847 B10R1.118 CC1=CC(C)=C([Mg+])C=C1C T31755 [0,1,0,0,0,0|2,0,0]=3 848 B10R1.118 CC1=CC(Cl)=C(C)C=C1Cl D48772 [0,1,0,0,0,0|3,0,0]=4 849 B10R1.118 CC1=CC(Cl)=C(C)C=C1N C46750 [0,1,0,0,0,0|3,0,0]=4 850 B10R1.118 CC1=CC(N)=C(Br)C=C1C B46725 [0,1,0,0,0,0|3,0,0]=4 851 B10R1.118 CC1=CC(O)=C(C)C=C1N A46902 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.118 CC1=NC(C)=C(Br)C=C1Br D67801 [0,1,0,0,0,0|2,0,0]=3 853 B10R1.118 CC1=NC(Cl)=C(Br)C=C1Br D42188 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.118 CC1=NC(F)=C(Br)C=C1Br D62164 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.118 CC1=NC(N)=C(Br)C=C1Br D42727 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.118 CC1=NC(N)=C(Br)C=C1Cl B62524 [0,1,0,0,0,0|3,0,0]=4 857 B10R1.118 NC1=C(Br)N=C(Br)C(Br)=N1 T40002 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.118 NC1=C(Br)N=C(Br)C(Cl)=N1 A40001 [0,1,0,0,0,0|3,0,0]=4 859 B10R1.118 NC1=C(Br)N=C(I)C(Cl)=N1 B37187 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.118 NC1=C(Cl)N=C(Br)C(Cl)=N1 B40003 [0,1,0,0,0,0|3,0,0]=4 861 B10R1.118 NC1=NC(Cl)=C(Cl)N=C1I D40004 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.119 CC1=C(Br)C(C)=C(Br)C=N1 D45761 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.119 CC1=C(Br)C(C)=C(N)C=N1 B62373 [0,1,0,0,0,0|3,0,0]=4 864 B10R1.119 CC1=C(Br)C=NC(N)=C1C A46286 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.119 CC1=C(C)C(F)=C(I)C=C1 D48774 [0,1,0,0,0,0|3,0,0]=4 866 B10R1.119 CC1=C(N)C(C)=C(Br)C=C1 B46732 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.119 CC1=CC=C(C)C(C)=C1C T67775 [0,1,0,0,0,0|2,0,0]=3 868 B10R1.119 CC1=CN=C(Cl)C(N)=C1N C43274 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.119 CC1=CN=C(N)C(C)=C1C T46967 [0,1,0,0,0,0|2,0,0]=3 870 B10R1.119 CC1=NC=C(Cl)C(N)=C1Cl D42749 [0,1,0,0,0,0|3,0,0]=4 871 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 B38347 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.176 CC1=C(Br)C=C(CO)C=C1 B49432 [0,1,0,0,0,0|3,0,0]=4 873 B10R1.176 CC1=C(Br)C=CC(C#N)=N1 B44756 [0,1,0,0,0,0|2,0,1]=4 874 B10R1.176 CC1=C(Br)C=CC(C=O)=N1 B19216 [0,1,0,0,0,0|2,0,1]=4 875 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 B48757 [0,1,0,0,0,0|3,0,0]=4 876 B10R1.176 CC1=C(Br)C=CC(CO)=C1 B49433 [0,1,0,0,0,0|3,0,0]=4 877 B10R1.176 CC1=C(C)C=C(C#N)C=C1 D51674 [0,1,0,0,0,0|2,0,1]=4 878 B10R1.176 CC1=C(C)C=C(CCl)C=C1 C49971 [0,1,0,0,0,0|2,0,0]=3 879 B10R1.176 CC1=C(C)C=C(CO)C=C1 D50275 [0,1,0,0,0,0|2,0,0]=3 880 B10R1.176 CC1=C(C)C=C(NN)C=C1 D39524 [0,1,0,0,0,0|3,0,0]=4 881 B10R1.176 CC1=C(Cl)C=C(C#N)C=N1 C63869 [0,1,0,0,0,0|2,0,1]=4 882 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 C46749 [0,1,0,0,0,0|3,0,0]=4 883 B10R1.176 CC1=C(F)C=C(CO)C=N1 F46223 [0,1,0,0,0,0|2,0,0]=3 884 B10R1.176 CC1=C(F)C=CC(C=O)=N1 F26082 [0,1,0,0,0,0|2,0,1]=4 885 B10R1.176 CC1=C(F)C=CC(CCl)=N1 C19366 [0,1,0,0,0,0|2,0,0]=3 886 B10R1.176 CC1=C(F)C=CC(CN)=C1 F46767 [0,1,0,0,0,0|3,0,0]=4 887 B10R1.176 CC1=C(I)C=C(CO)C=C1 K63324 [0,1,0,0,0,0|3,0,0]=4 888 B10R1.176 CC1=C(N)C=CC(C#N)=N1 A16433 [0,1,0,0,0,0|2,0,1]=4 889 B10R1.176 CC1=C(O)C=CC(CO)=C1 H46832 [0,1,0,0,0,0|3,0,0]=4 890 B10R1.176 CC1=CC(C#N)=CN=C1Br B44735 [0,1,0,0,0,0|2,0,1]=4 891 B10R1.176 CC1=CC(C#N)=CN=C1C D48779 [0,1,0,0,0,0|1,0,1]=3 892 B10R1.176 CC1=CC(C#N)=CN=C1Cl C44768 [0,1,0,0,0,0|2,0,1]=4 893 B10R1.176 CC1=CC(C#N)=CN=C1F C4733 [0,1,0,0,0,0|2,0,1]=4 894 B10R1.176 CC1=CC(C#N)=CN=C1N A3637 [0,1,0,0,0,0|2,0,1]=4 895 B10R1.176 CC1=CC(C=O)=CN=C1Br B45476 [0,1,0,0,0,0|2,0,1]=4 896 B10R1.176 CC1=CC=C(C#N)N=C1Br B23729 [0,1,0,0,0,0|2,0,1]=4 897 B10R1.176 CC1=NC=C(C#N)C=C1N A45726 [0,1,0,0,0,0|2,0,1]=4 898 B10R1.176 CCC1=CC(C)=C(C)C=C1 E53022 [0,1,0,0,0,0|2,0,0]=3 899 B10R1.176 CCC1=CC(C)=C(I)C=C1 E49973 [0,1,0,0,0,0|3,0,0]=4 900 B10R1.176 CCC1=NC(C)=C(C)N=C1 E46963 [0,1,0,0,0,0|0,0,0]=1 901 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 B45765 [0,1,0,0,0,0|3,0,0]=4 902 B10R1.176 COC1=CC(Br)=C(C)C=C1 B49439 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.176 COC1=CC(Br)=C(C)N=C1 B13456 [0,1,0,0,0,0|2,0,0]=3 904 B10R1.176 COC1=CC(C)=C(Br)C=C1 B49437 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.176 COC1=CC(C)=C(F)C=C1 F49456 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.176 COC1=CC(C)=C(O)C=C1 H38045 [0,1,0,0,0,0|3,0,0]=4 907 B10R1.176 COC1=CC(C)=C([Mg+])C=C1 M31768 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.176 COC1=CC(Cl)=C(C)C=C1 C49453 [0,1,0,0,0,0|3,0,0]=4 909 B10R1.176 COC1=CC(F)=C(C)C=C1 F49466 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.176 COC1=CC(F)=C(N)N=C1 F43081 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.176 COC1=CC(N)=C(C)C=C1 M46901 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.176 COC1=CC(O)=C(C)C=C1 M46827 [0,1,0,0,0,0|3,0,0]=4 913 B10R1.176 COC1=CC=C(Br)C(Br)=N1 D42629 [0,1,0,0,0,0|3,0,0]=4 914 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 D42661 [0,1,0,0,0,0|3,0,0]=4 915 B10R1.176 COC1=CC=C(N)C(Br)=N1 A43056 [0,1,0,0,0,0|3,0,0]=4 916 B10R1.176 COC1=CC=C(N)C(Cl)=N1 A3832 [0,1,0,0,0,0|3,0,0]=4 917 B10R1.176 COC1=CN=C(Br)C(C)=N1 B43057 [0,1,0,0,0,0|1,0,0]=2 918 B10R1.176 COC1=CN=C(Br)C(N)=C1 B43053 [0,1,0,0,0,0|3,0,0]=4 919 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C46201 [0,1,0,0,0,0|2,0,0]=3 920 B10R1.176 COC1=CN=C(Cl)C(N)=C1 C25045 [0,1,0,0,0,0|3,0,0]=4 921 B10R1.176 COC1=CN=C(Cl)C(N)=N1 C18840 [0,1,0,0,0,0|2,0,0]=3 922 B10R1.176 COC1=NC(C)=C(Br)C=C1 B46158 [0,1,0,0,0,0|2,0,0]=3 923 B10R1.176 COC1=NC(C)=C(Br)C=N1 B43061 [0,1,0,0,0,0|3,0,0]=4 924 B10R1.176 COC1=NC(C)=C(F)C=C1 F46212 [0,1,0,0,0,0|2,0,0]=3 925 B10R1.176 COC1=NC(C)=C(N)C=C1 M46590 [0,1,0,0,0,0|2,0,0]=3 926 B10R1.176 COC1=NC(C)=C(N)C=C1 M69566 [0,1,0,0,0,0|2,0,0]=3 927 B10R1.176 COC1=NC(C)=C(N)C=N1 M39115 [0,1,0,0,0,0|3,0,0]=4 928 B10R1.176 COC1=NC(C)=C(N)N=C1 M43352 [0,1,0,0,0,0|1,0,0]=2 929 B10R1.176 COC1=NC(Cl)=C(Br)C=C1 B42643 [0,1,0,0,0,0|3,0,0]=4 930 B10R1.176 COC1=NC(N)=C(Br)C=C1 B38888 [0,1,0,0,0,0|3,0,0]=4 931 B10R1.176 CSC1=CN=C(Cl)C(Cl)=N1 P11188 [0,1,0,0,0,0|2,0,0]=3 932 B10R1.176 CSC1=NC(C)=C(Br)C=N1 B42984 [0,1,0,0,0,0|3,0,0]=4 933 B10R1.176 CSC1=NC=C(C)C(Cl)=N1 C43008 [0,1,0,0,0,0|3,0,0]=4 934 B10R1.176 ClC1=C(I)C=C(CBr)C=N1 B42208 [0,1,0,0,0,0|3,0,0]=4 935 B10R1.176 FC1=C(Br)C=C(CCl)C=N1 B42205 [0,1,0,0,0,0|3,0,0]=4 936 B10R1.176 NC1=C(Br)C=C(CO)C=N1 A43064 [0,1,0,0,0,0|3,0,0]=4 937 B10R1.176 NCC1=NC(Cl)=C(Br)C=C1 B36820 [0,1,0,0,0,0|3,0,0]=4 938 B10R1.176 OCC1=CC(I)=C(Cl)N=C1 C42675 [0,1,0,0,0,0|3,0,0]=4 939 B10R1.176 OCC1=CN=C(Cl)C(Cl)=C1 D9504 [0,1,0,0,0,0|3,0,0]=4 940 B10R2.31 BrC1=CC2=C(C=C1)CC2 B48297 [0,0,0,1,0,0|3,0,0]=4 941 B8R1.18 CC1=C(Br)N=C(Br)S1 D37493 [0,0,0,0,1,0|3,0,0]=4 942 B8R1.18 CC1=C(Br)N=C(N)S1 B67359 [0,0,0,0,1,0|3,0,0]=4 943 B8R1.18 CC1=C(Br)NC(Br)=N1 D40071 [0,0,0,0,1,0|2,0,1]=4 944 B8R1.18 CC1=C(Br)SC(Br)=C1 D40697 [0,0,0,0,1,0|3,0,0]=4 945 B8R1.18 CC1=C(Br)SC(Br)=N1 D3449 [0,0,0,0,1,0|3,0,0]=4 946 B8R1.18 CC1=C(Br)SC(N)=N1 A2767 [0,0,0,0,1,0|3,0,0]=4 947 B8R1.18 CC1=C(Br)SC(N)=N1 A3604 [0,0,0,0,1,0|3,0,0]=4 948 B8R1.18 CC1=C(C)NC(N)=N1 D41246 [0,0,0,0,1,0|1,0,1]=3 949 B8R1.18 CC1=C(C)OC(=O)O1 D39178 [0,0,0,0,1,0|3,0,0]=4 950 B8R1.18 CC1=C(C)SC(Br)=N1 B37797 [0,0,0,0,1,0|2,0,0]=3 951 B8R1.18 CC1=C(C)SC(N)=N1 D41205 [0,0,0,0,1,0|2,0,0]=3 952 B8R1.18 CC1=C(C)SC(N)=N1 D41367 [0,0,0,0,1,0|2,0,0]=3 953 B8R1.18 CC1=C(Cl)SC(Cl)=C1 D40698 [0,0,0,0,1,0|3,0,0]=4 954 B8R1.18 CC1=C(Cl)SC(N)=N1 A2766 [0,0,0,0,1,0|3,0,0]=4 955 B8R1.18 CC1=CC(=O)C[C@@H]1C D43712 [0,0,0,0,1,0|2,0,1]=4 956 B8R1.18 CC1=CC(=O)OC1=O C60582 [0,0,0,0,1,0|3,0,0]=4 957 B8R1.18 CC1=CC(=O)[C@H](C)O1 D43303 [0,0,0,0,1,0|2,0,1]=4 958 B8R1.18 CC1=CC(Br)=NN1C B41126 [0,0,0,0,1,0|2,0,0]=3 959 B8R1.18 CC1=CC(C)=NN1C T41425 [0,0,0,0,1,0|1,0,0]=2 960 B8R1.18 CC1=CC(Cl)=NN1C C41128 [0,0,0,0,1,0|2,0,0]=3 961 B8R1.18 CC1=CC(N)=NN1C D41245 [0,0,0,0,1,0|2,0,0]=3 962 B8R1.18 CC1=CN(C)N=C1I K41134 [0,0,0,0,1,0|2,0,0]=3 963 B8R1.18 CC1=NC(Br)=C(C)S1 B41110 [0,0,0,0,1,0|2,0,0]=3 964 B8R1.18 CC1=NC(C)=C(C)O1 T43377 [0,0,0,0,1,0|1,0,0]=2 965 B8R1.18 CC1=NN(C)C(=O)C1 D39183 [0,0,0,0,1,0|2,0,1]=4 966 B8R1.18 CC1=NN(C)C(Br)=C1 B27171 [0,0,0,0,1,0|2,0,0]=3 967 B8R1.18 CC1=NN(C)C(Br)=C1 B2989 [0,0,0,0,1,0|2,0,0]=3 968 B8R1.18 CC1=NN(C)C(N)=C1 D1041 [0,0,0,0,1,0|2,0,0]=3 969 B8R1.18 CC1=NN(C)C(O)=C1 D9461 [0,0,0,0,1,0|2,0,0]=3 970 B8R1.18 CC1=NN(C)C=C1Br B12747 [0,0,0,0,1,0|2,0,0]=3 971 B8R1.18 CC1=NN(C)C=C1I K41135 [0,0,0,0,1,0|2,0,0]=3 972 B8R1.18 CC1=NN(C)C=C1N A10473 [0,0,0,0,1,0|2,0,0]=3 973 B8R1.18 CC1=NN(C)C=C1N D41244 [0,0,0,0,1,0|2,0,0]=3 974 B8R1.18 CC1=NN(C)N=C1Br B39014 [0,0,0,0,1,0|2,0,0]=3 975 B8R1.18 CN1C=C(Br)C(F)=N1 B59911 [0,0,0,0,1,0|3,0,0]=4 976 B8R1.18 CN1C=C(Br)C(N)=N1 B40192 [0,0,0,0,1,0|3,0,0]=4 977 B8R1.18 CN1C=C(N)C(Cl)=N1 C64471 [0,0,0,0,1,0|3,0,0]=4 978 B8R1.18 CN1N=C(Br)C=C1Br D63345 [0,0,0,0,1,0|3,0,0]=4 979 B8R1.18 CN1N=C(Br)N=C1Br D22545 [0,0,0,0,1,0|3,0,0]=4 980 B8R1.18 CN1N=C(Cl)C=C1N C15698 [0,0,0,0,1,0|3,0,0]=4 981 B8R1.18 CN1N=C(Cl)C=C1N C21712 [0,0,0,0,1,0|3,0,0]=4 982 B8R1.18 CN1N=C(N)C=C1Br B40193 [0,0,0,0,1,0|3,0,0]=4 983 B8R1.18 CN1N=C(N)C=C1Cl C40196 [0,0,0,0,1,0|3,0,0]=4 984 B8R1.50 CC1=C(Br)C=NN1C B41125 [0,0,0,0,1,0|2,0,0]=3 985 B8R1.50 CC1=C(Br)N(C)N=C1 B19368 [0,0,0,0,1,0|2,0,0]=3 986 B8R1.50 CC1=C(Br)N(C)N=N1 B37625 [0,0,0,0,1,0|3,0,0]=4 987 B8R1.50 CC1=C(Br)N=NN1C B40194 [0,0,0,0,1,0|3,0,0]=4 988 B8R1.50 CC1=C(C)C(N)=NN1 D26412 [0,0,0,0,1,0|2,0,0]=3 989 B8R1.50 CC1=C(C)C(N)=NO1 D1375 [0,0,0,0,1,0|2,0,0]=3 990 B8R1.50 CC1=C(I)C(I)=NN1 D40072 [0,0,0,0,1,0|3,0,0]=4 991 B8R1.50 CC1=C(I)N(C)N=N1 K40198 [0,0,0,0,1,0|3,0,0]=4 992 B8R1.50 CC1=C(N)C=NN1C D41401 [0,0,0,0,1,0|2,0,0]=3 993 B8R1.50 CC1=NC=C(Br)N1C B41127 [0,0,0,0,1,0|2,0,0]=3 994 B8R1.50 CC1=NNC(=S)N1C D40225 [0,0,0,0,1,0|3,0,0]=4 995 B8R1.50 CC1=NNC(C)=C1Br B39180 [0,0,0,0,1,0|2,0,0]=3 996 B8R1.50 CC1=NNC(C)=C1I D41133 [0,0,0,0,1,0|2,0,0]=3 997 B8R1.50 CC1=NNC(Cl)=C1N C12419 [0,0,0,0,1,0|3,0,0]=4 998 B8R1.50 CC1=NOC(C)=C1Br B7571 [0,0,0,0,1,0|2,0,0]=3 999 B8R1.50 CC1=NOC(C)=C1I D39177 [0,0,0,0,1,0|2,0,0]=3 1000 B8R1.50 CC1=NOC(N)=C1Br B67364 [0,0,0,0,1,0|3,0,0]=4 1001 B8R1.50 CC1=NOC(N)=C1Cl C64997 [0,0,0,0,1,0|3,0,0]=4 1002 B8R1.50 CN1C(I)=CN=C1I D2352 [0,0,0,0,1,0|3,0,0]=4 1003 B8R1.50 CN1N=CC(Cl)=C1N C40195 [0,0,0,0,1,0|3,0,0]=4 1004 B8R1.50 CN1N=CC(N)=C1N M39945 [0,0,0,0,1,0|3,0,0]=4 1005 B7R0.10 CC(=N/O)\C(C)=N\O B68610 [1,0,1,0,0,0|2,0,0]=4 1006 B7R0.6 CC(=O)NN=C(C)C A66607 [1,0,1,0,0,0|2,0,0]=4 1007 B7R1.3 BrC1=CN=CC=C1 B2746 [2,0,0,0,0,0|2,0,0]=4 1008 B7R1.3 BrC1=NC=CN=C1 B40020 [2,0,0,0,0,0|1,0,0]=3 1009 B7R1.3 CC1=CC=CN=N1 M0216 [2,0,0,0,0,0|2,0,0]=4 1010 B7R1.3 CC1=CN=CN=C1 M41018 [2,0,0,0,0,0|2,0,0]=4 1011 B7R1.3 CC1=CN=NC=C1 M3532 [2,0,0,0,0,0|2,0,0]=4 1012 B7R1.3 CC1=NC=CC=N1 M68916 [2,0,0,0,0,0|2,0,0]=4 1013 B7R1.3 CC1=NC=CN=C1 M61917 [2,0,0,0,0,0|0,0,0]=2 1014 B7R1.3 CC1=NC=CN=N1 M36785 [2,0,0,0,0,0|1,0,0]=3 1015 B7R1.3 CC1=NC=NC=C1 M7491 [2,0,0,0,0,0|2,0,0]=4 1016 B7R1.3 ClC1=CN=CC=C1 C68367 [2,0,0,0,0,0|2,0,0]=4 1017 B7R1.3 ClC1=NC=CN=C1 C5165 [2,0,0,0,0,0|1,0,0]=3 1018 B7R1.3 FC1=CN=CC=C1 F1892 [2,0,0,0,0,0|2,0,0]=4 1019 B7R1.3 FC1=NC=CC=C1 F4862 [2,0,0,0,0,0|2,0,0]=4 1020 B7R1.3 FC1=NC=CN=C1 F40023 [2,0,0,0,0,0|1,0,0]=3 1021 B7R1.3 IC1=CN=CC=C1 I16635 [2,0,0,0,0,0|2,0,0]=4 1022 B7R1.3 IC1=NC=CC=C1 K67594 [2,0,0,0,0,0|2,0,0]=4 1023 B7R1.3 IC1=NC=CN=C1 I2669 [2,0,0,0,0,0|1,0,0]=3 1024 B7R1.3 NC1=NC=CC=C1 A23973 [2,0,0,0,0,0|2,0,0]=4 1025 B7R1.3 NC1=NC=CN=C1 A15535 [2,0,0,0,0,0|1,0,0]=3 1026 B7R1.3 NC1=NC=CN=N1 T67661 [2,0,0,0,0,0|2,0,0]=4 1027 B7R1.3 O=C1C=NC=CN1 H68630 [2,0,0,0,0,0|1,0,1]=4 1028 B7R1.3 OC1=NC=CC=C1 P61113 [2,0,0,0,0,0|2,0,0]=4 1029 B7R1.3 [Mg+]C1=CN=CC=C1 P8350 [2,0,0,0,0,0|2,0,0]=4 1030 B7R1.3 [Mg+]C1=NC=CC=C1 P8351 [2,0,0,0,0,0|2,0,0]=4 1031 B9R1.1 BrCC1=NC=C(Br)C=C1 B42521 [1,1,0,0,0,0|2,0,0]=4 1032 B9R1.1 C=CC1=CN=C(C)C=C1 M11564 [1,1,0,0,0,0|1,0,1]=4 1033 B9R1.1 CC1=CC=C(CN)C=C1 M69544 [1,1,0,0,0,0|2,0,0]=4 1034 B9R1.1 CC1=CC=C(CN)N=N1 M0158 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.1 CC1=CC=C(CN)N=N1 M27037 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.1 CC1=CC=C(CO)C=C1 T37852 [1,1,0,0,0,0|2,0,0]=4 1037 B9R1.1 CC1=CN=C(C#N)C=C1 C4792 [1,1,0,0,0,0|1,0,1]=4 1038 B9R1.1 CC1=CN=C(C#N)C=N1 M42468 [1,1,0,0,0,0|0,0,1]=3 1039 B9R1.1 CC1=CN=C(C=O)C=C1 M3063 [1,1,0,0,0,0|1,0,1]=4 1040 B9R1.1 CC1=CN=C(C=O)C=N1 M14618 [1,1,0,0,0,0|0,0,1]=3 1041 B9R1.1 CC1=CN=C(CCl)C=C1 C46107 [1,1,0,0,0,0|1,0,0]=3 1042 B9R1.1 CC1=CN=C(CCl)C=N1 C11548 [1,1,0,0,0,0|0,0,0]=2 1043 B9R1.1 CC1=CN=C(CCl)C=N1 C43004 [1,1,0,0,0,0|0,0,0]=2 1044 B9R1.1 CC1=CN=C(CCl)N=C1 C14428 [1,1,0,0,0,0|2,0,0]=4 1045 B9R1.1 CC1=CN=C(CCl)N=C1 C8015 [1,1,0,0,0,0|2,0,0]=4 1046 B9R1.1 CC1=CN=C(CN)C=C1 M43622 [1,1,0,0,0,0|1,0,0]=3 1047 B9R1.1 CC1=CN=C(CN)C=C1 M46461 [1,1,0,0,0,0|1,0,0]=3 1048 B9R1.1 CC1=CN=C(CN)C=N1 A3139 [1,1,0,0,0,0|0,0,0]=2 1049 B9R1.1 CC1=CN=C(CN)N=C1 M11333 [1,1,0,0,0,0|2,0,0]=4 1050 B9R1.1 CC1=CN=C(CO)C=N1 M43210 [1,1,0,0,0,0|0,0,0]=2 1051 B9R1.1 CC1=CN=C(CO)N=C1 H11473 [1,1,0,0,0,0|2,0,0]=4 1052 B9R1.1 CC1=CN=C(NN)C=C1 H63578 [1,1,0,0,0,0|2,0,0]=4 1053 B9R1.1 CC1=NC=C(C#N)C=C1 M12704 [1,1,0,0,0,0|1,0,1]=4 1054 B9R1.1 CC1=NC=C(C=O)C=C1 M0419 [1,1,0,0,0,0|1,0,1]=4 1055 B9R1.1 CC1=NC=C(CBr)C=C1 B46089 [1,1,0,0,0,0|1,0,0]=3 1056 B9R1.1 CC1=NC=C(CBr)C=N1 B42978 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.1 CC1=NC=C(CCl)C=C1 C46111 [1,1,0,0,0,0|1,0,0]=3 1058 B9R1.1 CC1=NC=C(CCl)C=N1 C19650 [1,1,0,0,0,0|2,0,0]=4 1059 B9R1.1 CC1=NC=C(CN)C=C1 M0572 [1,1,0,0,0,0|1,0,0]=3 1060 B9R1.1 CC1=NC=C(CN)C=N1 A1723 [1,1,0,0,0,0|2,0,0]=4 1061 B9R1.1 CC1=NC=C(CO)C=C1 M15722 [1,1,0,0,0,0|1,0,0]=3 1062 B9R1.1 CC1=NC=C(CO)C=N1 H12381 [1,1,0,0,0,0|2,0,0]=4 1063 B9R1.1 CC1=NC=C(NN)C=C1 H14024 [1,1,0,0,0,0|2,0,0]=4 1064 B9R1.1 CCC1=CN=C(Cl)C=C1 C26331 [1,1,0,0,0,0|2,0,0]=4 1065 B9R1.1 CCC1=CN=C(N)C=C1 E43600 [1,1,0,0,0,0|2,0,0]=4 1066 B9R1.1 CCC1=NC=C(Br)C=C1 B1614 [1,1,0,0,0,0|2,0,0]=4 1067 B9R1.1 CCC1=NC=C(Cl)C=C1 C46096 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.1 CCC1=NC=C(N)C=C1 E43602 [1,1,0,0,0,0|2,0,0]=4 1069 B9R1.1 CNC1=CC=C(C)C=C1 D39432 [1,1,0,0,0,0|2,0,0]=4 1070 B9R1.1 CNC1=CN=C(C)C=C1 D43616 [1,1,0,0,0,0|1,0,0]=3 1071 B9R1.1 CNC1=NC=C(Br)C=C1 B42975 [1,1,0,0,0,0|2,0,0]=4 1072 B9R1.1 CNC1=NC=C(C)C=C1 D43614 [1,1,0,0,0,0|1,0,0]=3 1073 B9R1.1 CNC1=NC=C(F)C=C1 F32100 [1,1,0,0,0,0|2,0,0]=4 1074 B9R1.1 CNC1=NC=C(N)C=C1 M43342 [1,1,0,0,0,0|2,0,0]=4 1075 B9R1.1 CNC1=NC=C(N)C=C1 M43545 [1,1,0,0,0,0|2,0,0]=4 1076 B9R1.1 COC1=CN=C(Br)C=C1 B5045 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.1 COC1=CN=C(Br)C=N1 B14594 [1,1,0,0,0,0|1,0,0]=3 1078 B9R1.1 COC1=CN=C(Cl)C=C1 C19386 [1,1,0,0,0,0|2,0,0]=4 1079 B9R1.1 COC1=CN=C(Cl)C=N1 C14595 [1,1,0,0,0,0|1,0,0]=3 1080 B9R1.1 COC1=CN=C(F)C=C1 F42925 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.1 COC1=CN=C(I)C=C1 I5931 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.1 COC1=CN=C(N)C=C1 A10497 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.1 COC1=NC=C(Br)C=C1 B9550 [1,1,0,0,0,0|2,0,0]=4 1084 B9R1.1 COC1=NC=C(C)C=C1 M67554 [1,1,0,0,0,0|1,0,0]=3 1085 B9R1.1 COC1=NC=C(Cl)C=C1 C42903 [1,1,0,0,0,0|2,0,0]=4 1086 B9R1.1 COC1=NC=C(F)C=C1 F24011 [1,1,0,0,0,0|2,0,0]=4 1087 B9R1.1 COC1=NC=C(I)C=C1 K42935 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.1 COC1=NC=C(N)C=C1 A12692 [1,1,0,0,0,0|2,0,0]=4 1089 B9R1.1 COC1=NC=C(N)N=C1 M9733 [1,1,0,0,0,0|1,0,0]=3 1090 B9R1.1 COC1=NC=C(O)C=C1 H43140 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.1 COC1=NN=C(C)C=C1 M43203 [1,1,0,0,0,0|2,0,0]=4 1092 B9R1.1 CSC1=CN=C(Br)C=N1 B40873 [1,1,0,0,0,0|1,0,0]=3 1093 B9R1.1 CSC1=CN=C(N)C=C1 A43262 [1,1,0,0,0,0|2,0,0]=4 1094 B9R1.1 CSC1=NC=C(Br)C=C1 B2646 [1,1,0,0,0,0|2,0,0]=4 1095 B9R1.1 ClC1=CN=C(CBr)C=C1 B42537 [1,1,0,0,0,0|2,0,0]=4 1096 B9R1.1 ClCC1=CN=C(Br)C=C1 B42528 [1,1,0,0,0,0|2,0,0]=4 1097 B9R1.1 ClCC1=CN=C(Br)C=C1 B42539 [1,1,0,0,0,0|2,0,0]=4 1098 B9R1.1 ClCC1=CN=C(Cl)C=N1 C40730 [1,1,0,0,0,0|1,0,0]=3 1099 B9R1.1 ClCC1=NC=C(Br)C=C1 B42540 [1,1,0,0,0,0|2,0,0]=4 1100 B9R1.1 ClCC1=NC=C(Br)C=C1 B61533 [1,1,0,0,0,0|2,0,0]=4 1101 B9R1.1 ClCC1=NC=C(Cl)C=C1 C14676 [1,1,0,0,0,0|2,0,0]=4 1102 B9R1.1 ClCC1=NC=C(Cl)C=C1 C42565 [1,1,0,0,0,0|2,0,0]=4 1103 B9R1.1 FC1=NC=C(CBr)C=C1 B39061 [1,1,0,0,0,0|2,0,0]=4 1104 B9R1.1 FC1=NC=C(CBr)C=C1 B7888 [1,1,0,0,0,0|2,0,0]=4 1105 B9R1.1 FC1=NC=C(CCl)C=C1 C7887 [1,1,0,0,0,0|2,0,0]=4 1106 B9R1.1 N#CC1=CN=C(Br)C=N1 B3579 [1,1,0,0,0,0|1,0,1]=4 1107 B9R1.1 N#CC1=CN=C(Cl)C=N1 C4890 [1,1,0,0,0,0|1,0,1]=4 1108 B9R1.1 N#CC1=NC=C(N)N=C1 A3818 [1,1,0,0,0,0|1,0,1]=4 1109 B9R1.1 NC1=CN=C(C=O)C=N1 A63812 [1,1,0,0,0,0|1,0,1]=4 1110 B9R1.1 NC1=NC=C(CO)C=C1 A0345 [1,1,0,0,0,0|2,0,0]=4 1111 B9R1.1 NCC1=CN=C(Br)C=C1 B42976 [1,1,0,0,0,0|2,0,0]=4 1112 B9R1.1 NCC1=CN=C(Cl)C=C1 A0585 [1,1,0,0,0,0|2,0,0]=4 1113 B9R1.1 NCC1=CN=C(F)C=C1 A13990 [1,1,0,0,0,0|2,0,0]=4 1114 B9R1.1 NCC1=NC=C(Br)C=C1 B15775 [1,1,0,0,0,0|2,0,0]=4 1115 B9R1.1 NCC1=NC=C(Br)C=C1 B42983 [1,1,0,0,0,0|2,0,0]=4 1116 B9R1.1 NCC1=NC=C(Br)C=C1 B7021 [1,1,0,0,0,0|2,0,0]=4 1117 B9R1.1 NCC1=NC=C(Cl)C=C1 C43002 [1,1,0,0,0,0|2,0,0]=4 1118 B9R1.1 NCC1=NC=C(Cl)C=C1 C43003 [1,1,0,0,0,0|2,0,0]=4 1119 B9R1.1 NCC1=NC=C(N)C=C1 A36932 [1,1,0,0,0,0|2,0,0]=4 1120 B9R1.1 NNC1=CN=C(Cl)C=N1 C14613 [1,1,0,0,0,0|2,0,0]=4 1121 B9R1.1 O=CC1=CN=C(Cl)C=N1 C12389 [1,1,0,0,0,0|1,0,1]=4 1122 B9R1.1 OCC1=CN=C(Br)C=C1 B12392 [1,1,0,0,0,0|2,0,0]=4 1123 B9R1.1 OCC1=CN=C(Cl)C=C1 C9389 [1,1,0,0,0,0|2,0,0]=4 1124 B9R1.1 OCC1=CN=C(Cl)C=N1 C1534 [1,1,0,0,0,0|1,0,0]=3 1125 B9R1.1 OCC1=CN=C(F)C=C1 F13989 [1,1,0,0,0,0|2,0,0]=4 1126 B9R1.1 OCC1=NC=C(Br)C=C1 B3203 [1,1,0,0,0,0|2,0,0]=4 1127 B9R1.1 OCC1=NC=C(Cl)C=C1 C22297 [1,1,0,0,0,0|2,0,0]=4 1128 B9R1.1 OCC1=NC=C(F)C=C1 F0644 [1,1,0,0,0,0|2,0,0]=4 1129 B9R1.2 BrCC1=CC=CC(Br)=N1 B42519 [1,1,0,0,0,0|2,0,0]=4 1130 B9R1.2 C#CC1=NC(C)=CC=C1 E13754 [1,1,0,0,0,0|1,0,1]=4 1131 B9R1.2 C=CC1=NC(C)=CC=C1 M16640 [1,1,0,0,0,0|1,0,1]=4 1132 B9R1.2 CC1=CC(C#N)=CN=C1 M45202 [1,1,0,0,0,0|1,0,1]=4 1133 B9R1.2 CC1=CC(C=O)=CN=C1 M12908 [1,1,0,0,0,0|1,0,1]=4 1134 B9R1.2 CC1=CC(CCl)=CN=C1 C46109 [1,1,0,0,0,0|1,0,0]=3 1135 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [1,1,0,0,0,0|1,0,0]=3 1136 B9R1.2 CC1=CC(CO)=NN=C1 M27710 [1,1,0,0,0,0|2,0,0]=4 1137 B9R1.2 CC1=CC=CC(C#N)=N1 C7796 [1,1,0,0,0,0|1,0,1]=4 1138 B9R1.2 CC1=CC=CC(C=O)=N1 M67935 [1,1,0,0,0,0|1,0,1]=4 1139 B9R1.2 CC1=CC=CC(CBr)=N1 B46087 [1,1,0,0,0,0|1,0,0]=3 1140 B9R1.2 CC1=CC=CC(CCl)=N1 C46103 [1,1,0,0,0,0|1,0,0]=3 1141 B9R1.2 CC1=CC=CC(CN)=C1 M37355 [1,1,0,0,0,0|2,0,0]=4 1142 B9R1.2 CC1=CC=CC(CN)=N1 M24786 [1,1,0,0,0,0|1,0,0]=3 1143 B9R1.2 CC1=CC=CC(CN)=N1 M63579 [1,1,0,0,0,0|1,0,0]=3 1144 B9R1.2 CC1=CC=CC(CO)=N1 M46384 [1,1,0,0,0,0|1,0,0]=3 1145 B9R1.2 CC1=CC=CC(NN)=N1 H69493 [1,1,0,0,0,0|2,0,0]=4 1146 B9R1.2 CC1=CC=NC(CCl)=N1 C11471 [1,1,0,0,0,0|2,0,0]=4 1147 B9R1.2 CC1=CC=NC(CN)=N1 A14426 [1,1,0,0,0,0|2,0,0]=4 1148 B9R1.2 CC1=CC=NC(CN)=N1 M29730 [1,1,0,0,0,0|2,0,0]=4 1149 B9R1.2 CC1=CC=NC(CO)=N1 H11472 [1,1,0,0,0,0|2,0,0]=4 1150 B9R1.2 CC1=CN=CC(C#N)=N1 M42469 [1,1,0,0,0,0|0,0,1]=3 1151 B9R1.2 CC1=CN=CC(C=O)=N1 M16928 [1,1,0,0,0,0|0,0,1]=3 1152 B9R1.2 CC1=CN=CC(CCl)=N1 C43005 [1,1,0,0,0,0|0,0,0]=2 1153 B9R1.2 CC1=CN=NC(CN)=C1 A13026 [1,1,0,0,0,0|2,0,0]=4 1154 B9R1.2 CC1=CN=NC(CN)=C1 M27097 [1,1,0,0,0,0|2,0,0]=4 1155 B9R1.2 CCC1=CC(Br)=CN=C1 B46076 [1,1,0,0,0,0|2,0,0]=4 1156 B9R1.2 CCC1=CC=CC(Br)=N1 B46074 [1,1,0,0,0,0|2,0,0]=4 1157 B9R1.2 CCC1=CC=CC(N)=N1 E43601 [1,1,0,0,0,0|2,0,0]=4 1158 B9R1.2 CCC1=CN=CC(N)=C1 E37485 [1,1,0,0,0,0|2,0,0]=4 1159 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.2 CNC1=CC=CC(Cl)=N1 C43001 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.2 CNC1=NC(C)=CC=C1 D43615 [1,1,0,0,0,0|1,0,0]=3 1162 B9R1.2 COC1=CC(Br)=CN=C1 B2876 [1,1,0,0,0,0|2,0,0]=4 1163 B9R1.2 COC1=CC=CC(Br)=N1 B2785 [1,1,0,0,0,0|2,0,0]=4 1164 B9R1.2 COC1=CC=CC(Cl)=N1 C39269 [1,1,0,0,0,0|2,0,0]=4 1165 B9R1.2 COC1=CC=CC(F)=N1 F67375 [1,1,0,0,0,0|2,0,0]=4 1166 B9R1.2 COC1=CC=CC(I)=N1 K42932 [1,1,0,0,0,0|2,0,0]=4 1167 B9R1.2 COC1=CN=CC(Cl)=N1 C2454 [1,1,0,0,0,0|1,0,0]=3 1168 B9R1.2 COC1=CN=CC(I)=N1 I2676 [1,1,0,0,0,0|1,0,0]=3 1169 B9R1.2 COC1=CN=CC(N)=C1 A14114 [1,1,0,0,0,0|2,0,0]=4 1170 B9R1.2 COC1=CN=CC(N)=C1 A7930 [1,1,0,0,0,0|2,0,0]=4 1171 B9R1.2 COC1=CN=CC(O)=C1 M43136 [1,1,0,0,0,0|2,0,0]=4 1172 B9R1.2 COC1=NC(C)=CC=C1 M46380 [1,1,0,0,0,0|1,0,0]=3 1173 B9R1.2 COC1=NC(C)=CC=N1 M43202 [1,1,0,0,0,0|2,0,0]=4 1174 B9R1.2 COC1=NC(C)=NC=C1 M43205 [1,1,0,0,0,0|2,0,0]=4 1175 B9R1.2 COC1=NC(N)=CC=C1 A43190 [1,1,0,0,0,0|2,0,0]=4 1176 B9R1.2 COC1=NC(N)=CN=C1 A8995 [1,1,0,0,0,0|1,0,0]=3 1177 B9R1.2 CSC1=CC=CC(Br)=N1 B2786 [1,1,0,0,0,0|2,0,0]=4 1178 B9R1.2 ClCC1=CC(Br)=CN=C1 B15185 [1,1,0,0,0,0|2,0,0]=4 1179 B9R1.2 ClCC1=CC(Cl)=CN=C1 C1777 [1,1,0,0,0,0|2,0,0]=4 1180 B9R1.2 ClCC1=CC=CC(Br)=N1 B27809 [1,1,0,0,0,0|2,0,0]=4 1181 B9R1.2 ClCC1=CC=CC(Cl)=N1 C42562 [1,1,0,0,0,0|2,0,0]=4 1182 B9R1.2 FC1=CC(CBr)=CN=C1 B37165 [1,1,0,0,0,0|2,0,0]=4 1183 B9R1.2 FC1=CC(CCl)=CN=C1 C1821 [1,1,0,0,0,0|2,0,0]=4 1184 B9R1.2 FC1=CC=CC(CBr)=N1 B42547 [1,1,0,0,0,0|2,0,0]=4 1185 B9R1.2 FC1=CC=CC(CCl)=N1 C42570 [1,1,0,0,0,0|2,0,0]=4 1186 B9R1.2 N#CC1=CN=CC(Br)=N1 B40486 [1,1,0,0,0,0|1,0,1]=4 1187 B9R1.2 N#CC1=CN=CC(Cl)=N1 C4892 [1,1,0,0,0,0|1,0,1]=4 1188 B9R1.2 N#CC1=NC(N)=CN=C1 A11545 [1,1,0,0,0,0|1,0,1]=4 1189 B9R1.2 NC1=CC(CO)=CN=C1 A43207 [1,1,0,0,0,0|2,0,0]=4 1190 B9R1.2 NC1=CC=CC(CO)=N1 A43208 [1,1,0,0,0,0|2,0,0]=4 1191 B9R1.2 NCC1=CC(F)=CN=C1 F5829 [1,1,0,0,0,0|2,0,0]=4 1192 B9R1.2 NCC1=CC=CC(Br)=N1 B42981 [1,1,0,0,0,0|2,0,0]=4 1193 B9R1.2 NCC1=CC=CC(Cl)=N1 C43006 [1,1,0,0,0,0|2,0,0]=4 1194 B9R1.2 NCC1=CN=CC(Cl)=N1 C18971 [1,1,0,0,0,0|1,0,0]=3 1195 B9R1.2 O=CC1=CN=CC(Cl)=N1 C14597 [1,1,0,0,0,0|1,0,1]=4 1196 B9R1.2 OCC1=CC(Br)=CN=C1 B12503 [1,1,0,0,0,0|2,0,0]=4 1197 B9R1.2 OCC1=CC(Cl)=CN=C1 C42912 [1,1,0,0,0,0|2,0,0]=4 1198 B9R1.2 OCC1=CC(F)=CN=C1 F0704 [1,1,0,0,0,0|2,0,0]=4 1199 B9R1.2 OCC1=CC(O)=CN=C1 H39124 [1,1,0,0,0,0|2,0,0]=4 1200 B9R1.2 OCC1=CC=CC(Br)=N1 B12271 [1,1,0,0,0,0|2,0,0]=4 1201 B9R1.2 OCC1=CC=CC(Cl)=N1 C38619 [1,1,0,0,0,0|2,0,0]=4 1202 B9R1.2 OCC1=CC=CC(Cl)=N1 C42916 [1,1,0,0,0,0|2,0,0]=4 1203 B9R1.2 OCC1=CC=CC(F)=N1 F67771 [1,1,0,0,0,0|2,0,0]=4 1204 B9R1.2 OCC1=CN=CC(Br)=N1 B40916 [1,1,0,0,0,0|1,0,0]=3 1205 B9R1.2 OCC1=CN=CC(Cl)=N1 C14609 [1,1,0,0,0,0|1,0,0]=3 1206 B9R1.3 CC1=CC=CC(C)=C1Br D49159 [1,1,0,0,0,0|2,0,0]=4 1207 B9R1.3 CC1=CC=CC(C)=C1Cl C68697 [1,1,0,0,0,0|2,0,0]=4 1208 B9R1.3 CC1=CC=CC(C)=C1F F49164 [1,1,0,0,0,0|2,0,0]=4 1209 B9R1.3 CC1=CC=CC(C)=C1I K49169 [1,1,0,0,0,0|2,0,0]=4 1210 B9R1.3 CC1=CC=CC(C)=C1[Mg+] D31737 [1,1,0,0,0,0|2,0,0]=4 1211 B9R1.3 CC1=CN=CC(Br)=C1C B67733 [1,1,0,0,0,0|2,0,0]=4 1212 B9R1.3 CC1=CN=CC(Br)=C1Cl B42533 [1,1,0,0,0,0|2,0,0]=4 1213 B9R1.3 CC1=CN=CC(Br)=C1N B36942 [1,1,0,0,0,0|2,0,0]=4 1214 B9R1.3 CC1=CN=CC(C)=C1N D1039 [1,1,0,0,0,0|1,0,0]=3 1215 B9R1.3 CC1=CN=CC(Cl)=C1N C32268 [1,1,0,0,0,0|2,0,0]=4 1216 B9R1.3 CC1=CN=CC(F)=C1N F43016 [1,1,0,0,0,0|2,0,0]=4 1217 B9R1.3 CC1=CN=CC(N)=C1N M43335 [1,1,0,0,0,0|2,0,0]=4 1218 B9R1.34 CC1=CC(=O)C=C(C)N1 D4504 [1,1,0,0,0,0|1,0,1]=4 1219 B9R1.34 CC1=CC(Br)=CC(Br)=N1 D25404 [1,1,0,0,0,0|2,0,0]=4 1220 B9R1.34 CC1=CC(Br)=CC(C)=N1 B32225 [1,1,0,0,0,0|1,0,0]=3 1221 B9R1.34 CC1=CC(Br)=CC(Cl)=N1 B42535 [1,1,0,0,0,0|2,0,0]=4 1222 B9R1.34 CC1=CC(Br)=CC(F)=N1 B42552 [1,1,0,0,0,0|2,0,0]=4 1223 B9R1.34 CC1=CC(Br)=CC(N)=N1 B32094 [1,1,0,0,0,0|2,0,0]=4 1224 B9R1.34 CC1=CC(Br)=CC(O)=N1 B25850 [1,1,0,0,0,0|2,0,0]=4 1225 B9R1.34 CC1=CC(Br)=NC(C)=C1 B23884 [1,1,0,0,0,0|2,0,0]=4 1226 B9R1.34 CC1=CC(Br)=NC(C)=N1 B42970 [1,1,0,0,0,0|2,0,0]=4 1227 B9R1.34 CC1=CC(C)=CC(Br)=C1 B39512 [1,1,0,0,0,0|2,0,0]=4 1228 B9R1.34 CC1=CC(C)=CC(F)=C1 D49162 [1,1,0,0,0,0|2,0,0]=4 1229 B9R1.34 CC1=CC(C)=CC([Mg+])=C1 D31739 [1,1,0,0,0,0|2,0,0]=4 1230 B9R1.34 CC1=CC(C)=NC(C)=C1 T69125 [1,1,0,0,0,0|1,0,0]=3 1231 B9R1.34 CC1=CC(Cl)=CC(C)=N1 C36740 [1,1,0,0,0,0|1,0,0]=3 1232 B9R1.34 CC1=CC(Cl)=CC(Cl)=N1 D5517 [1,1,0,0,0,0|2,0,0]=4 1233 B9R1.34 CC1=CC(Cl)=CC(N)=N1 A69246 [1,1,0,0,0,0|2,0,0]=4 1234 B9R1.34 CC1=CC(Cl)=NC(C)=C1 C46101 [1,1,0,0,0,0|2,0,0]=4 1235 B9R1.34 CC1=CC(Cl)=NC(C)=N1 C23724 [1,1,0,0,0,0|2,0,0]=4 1236 B9R1.34 CC1=CC(F)=CC(F)=N1 D36881 [1,1,0,0,0,0|2,0,0]=4 1237 B9R1.34 CC1=CC(I)=CC(Cl)=N1 C42583 [1,1,0,0,0,0|2,0,0]=4 1238 B9R1.34 CC1=CC(I)=CC(F)=N1 F39127 [1,1,0,0,0,0|2,0,0]=4 1239 B9R1.34 CC1=CC(N)=CC(Br)=N1 B9374 [1,1,0,0,0,0|2,0,0]=4 1240 B9R1.34 CC1=CC(N)=CC(C)=N1 D3945 [1,1,0,0,0,0|1,0,0]=3 1241 B9R1.34 CC1=CC(N)=CC(Cl)=N1 C25407 [1,1,0,0,0,0|2,0,0]=4 1242 B9R1.34 CC1=CC(N)=NC(C)=C1 A43617 [1,1,0,0,0,0|2,0,0]=4 1243 B9R1.34 CC1=CC(O)=CC(O)=N1 M43137 [1,1,0,0,0,0|2,0,0]=4 1244 B9R1.34 CC1=CC(O)=CC(O)=N1 M43138 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.34 CC1=CC(O)=NC(C)=C1 D69531 [1,1,0,0,0,0|2,0,0]=4 1246 B9R1.34 CC1=CC(O)=NC(C)=N1 D43193 [1,1,0,0,0,0|2,0,0]=4 1247 B9R1.15 BrCC1=C(Br)C=CC=N1 B32048 [1,1,0,0,0,0|2,0,0]=4 1248 B9R1.15 C#CC1=NC=CN=C1Cl C63547 [1,1,0,0,0,0|1,0,1]=4 1249 B9R1.15 CC1=C(C#N)C=CC=N1 C10623 [1,1,0,0,0,0|1,0,1]=4 1250 B9R1.15 CC1=C(C=O)C=CC=N1 M1759 [1,1,0,0,0,0|1,0,1]=4 1251 B9R1.15 CC1=C(CBr)C=CC=N1 B15311 [1,1,0,0,0,0|1,0,0]=3 1252 B9R1.15 CC1=C(CCl)C=CC=N1 C14756 [1,1,0,0,0,0|1,0,0]=3 1253 B9R1.15 CC1=C(CN)C=CC=C1 M65907 [1,1,0,0,0,0|2,0,0]=4 1254 B9R1.15 CC1=C(CN)N=NC=C1 M60279 [1,1,0,0,0,0|2,0,0]=4 1255 B9R1.15 CC1=C(CO)C=CN=N1 M63840 [1,1,0,0,0,0|2,0,0]=4 1256 B9R1.15 CC1=CC=CN=C1C#N M29764 [1,1,0,0,0,0|1,0,1]=4 1257 B9R1.15 CC1=CC=CN=C1C=O M1872 [1,1,0,0,0,0|1,0,1]=4 1258 B9R1.15 CC1=CC=CN=C1CCl C14758 [1,1,0,0,0,0|1,0,0]=3 1259 B9R1.15 CC1=CC=CN=C1CCl C46105 [1,1,0,0,0,0|1,0,0]=3 1260 B9R1.15 CC1=CC=CN=C1CN M46460 [1,1,0,0,0,0|1,0,0]=3 1261 B9R1.15 CC1=CC=CN=C1CO H46388 [1,1,0,0,0,0|1,0,0]=3 1262 B9R1.15 CC1=NC=CN=C1C=O M14617 [1,1,0,0,0,0|0,0,1]=3 1263 B9R1.15 CC1=NC=CN=C1CCl C14615 [1,1,0,0,0,0|0,0,0]=2 1264 B9R1.15 CC1=NC=CN=C1CN A11549 [1,1,0,0,0,0|0,0,0]=2 1265 B9R1.15 CC1=NC=CN=C1CO H14616 [1,1,0,0,0,0|0,0,0]=2 1266 B9R1.15 CCC1=C(Br)C=CC=N1 B23432 [1,1,0,0,0,0|2,0,0]=4 1267 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.15 CCC1=NC=CN=C1C E43603 [1,1,0,0,0,0|0,0,0]=2 1269 B9R1.15 CCC1=NC=CN=C1Cl C38966 [1,1,0,0,0,0|1,0,0]=3 1270 B9R1.15 CCC1=NC=CN=C1N E43328 [1,1,0,0,0,0|1,0,0]=3 1271 B9R1.15 CCC1=NC=CNC1=O E43188 [1,1,0,0,0,0|1,0,1]=4 1272 B9R1.15 CNC1=C(C)C=CC=C1 D46860 [1,1,0,0,0,0|2,0,0]=4 1273 B9R1.15 CNC1=C(Cl)C=CC=N1 C42995 [1,1,0,0,0,0|2,0,0]=4 1274 B9R1.15 CNC1=CC=CN=C1Cl C42994 [1,1,0,0,0,0|2,0,0]=4 1275 B9R1.15 CNC1=CC=CN=C1N M62813 [1,1,0,0,0,0|2,0,0]=4 1276 B9R1.15 CNC1=NC=CC=C1N M43341 [1,1,0,0,0,0|2,0,0]=4 1277 B9R1.15 CNC1=NC=CN=C1N M63361 [1,1,0,0,0,0|1,0,0]=3 1278 B9R1.15 COC1=C(Br)C=CC=N1 B12855 [1,1,0,0,0,0|2,0,0]=4 1279 B9R1.15 COC1=C(Cl)C=CC=N1 C42900 [1,1,0,0,0,0|2,0,0]=4 1280 B9R1.15 COC1=C(F)C=CC=N1 F42926 [1,1,0,0,0,0|2,0,0]=4 1281 B9R1.15 COC1=C(I)C=CC=N1 K42933 [1,1,0,0,0,0|2,0,0]=4 1282 B9R1.15 COC1=C(N)N=CC=C1 A69248 [1,1,0,0,0,0|2,0,0]=4 1283 B9R1.15 COC1=CC=CN=C1Br B4536 [1,1,0,0,0,0|2,0,0]=4 1284 B9R1.15 COC1=CC=CN=C1Cl C24085 [1,1,0,0,0,0|2,0,0]=4 1285 B9R1.15 COC1=CC=CN=C1F F42924 [1,1,0,0,0,0|2,0,0]=4 1286 B9R1.15 COC1=CC=CN=C1I K62151 [1,1,0,0,0,0|2,0,0]=4 1287 B9R1.15 COC1=NC=CC=C1C M46378 [1,1,0,0,0,0|1,0,0]=3 1288 B9R1.15 COC1=NC=CC=C1N A12743 [1,1,0,0,0,0|2,0,0]=4 1289 B9R1.15 COC1=NC=CN=C1Br B40912 [1,1,0,0,0,0|1,0,0]=3 1290 B9R1.15 COC1=NC=CN=C1C M39278 [1,1,0,0,0,0|0,0,0]=2 1291 B9R1.15 COC1=NC=CN=C1Cl C1053 [1,1,0,0,0,0|1,0,0]=3 1292 B9R1.15 COC1=NC=CN=C1I I3006 [1,1,0,0,0,0|1,0,0]=3 1293 B9R1.15 COC1=NC=CN=C1N M32096 [1,1,0,0,0,0|1,0,0]=3 1294 B9R1.15 CSC1=C(F)N=CC=C1 F42849 [1,1,0,0,0,0|2,0,0]=4 1295 B9R1.15 CSC1=NC=CN=C1C M43263 [1,1,0,0,0,0|0,0,0]=2 1296 B9R1.15 ClCC1=C(Br)C=CC=N1 B42529 [1,1,0,0,0,0|2,0,0]=4 1297 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42563 [1,1,0,0,0,0|2,0,0]=4 1298 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42564 [1,1,0,0,0,0|2,0,0]=4 1299 B9R1.15 ClCC1=CC=CN=C1Cl C7688 [1,1,0,0,0,0|2,0,0]=4 1300 B9R1.15 ClCC1=NC=CN=C1Cl C12594 [1,1,0,0,0,0|1,0,0]=3 1301 B9R1.15 FC1=CC=CN=C1CBr B19661 [1,1,0,0,0,0|2,0,0]=4 1302 B9R1.15 FC1=CC=CN=C1CBr B7783 [1,1,0,0,0,0|2,0,0]=4 1303 B9R1.15 FC1=CC=CN=C1CCl C13988 [1,1,0,0,0,0|2,0,0]=4 1304 B9R1.15 N#CC1=NC=CN=C1Cl C0571 [1,1,0,0,0,0|1,0,1]=4 1305 B9R1.15 N#CC1=NC=CN=C1N A40815 [1,1,0,0,0,0|1,0,1]=4 1306 B9R1.15 NC1=C(CO)C=CC=N1 A12467 [1,1,0,0,0,0|2,0,0]=4 1307 B9R1.15 NC1=CC=CN=C1CO A24069 [1,1,0,0,0,0|2,0,0]=4 1308 B9R1.15 NC1=NC=CN=C1C=O A0269 [1,1,0,0,0,0|1,0,1]=4 1309 B9R1.15 NCC1=C(Cl)C=CC=N1 A14307 [1,1,0,0,0,0|2,0,0]=4 1310 B9R1.15 NCC1=C(Cl)C=CC=N1 C29809 [1,1,0,0,0,0|2,0,0]=4 1311 B9R1.15 NCC1=C(F)C=CC=N1 A12648 [1,1,0,0,0,0|2,0,0]=4 1312 B9R1.15 NCC1=C(F)C=CC=N1 A1712 [1,1,0,0,0,0|2,0,0]=4 1313 B9R1.15 NCC1=C(F)C=CC=N1 F61824 [1,1,0,0,0,0|2,0,0]=4 1314 B9R1.15 NCC1=C(O)C=CC=N1 A43199 [1,1,0,0,0,0|2,0,0]=4 1315 B9R1.15 NCC1=CC=CN=C1Cl A10464 [1,1,0,0,0,0|2,0,0]=4 1316 B9R1.15 NCC1=CC=CN=C1F F43528 [1,1,0,0,0,0|2,0,0]=4 1317 B9R1.15 NCC1=NC=CN=C1Cl C25893 [1,1,0,0,0,0|1,0,0]=3 1318 B9R1.15 NCC1=NC=CN=C1Cl C26687 [1,1,0,0,0,0|1,0,0]=3 1319 B9R1.15 NNC1=NC=CN=C1Cl C12505 [1,1,0,0,0,0|2,0,0]=4 1320 B9R1.15 O=CC1=NC=CN=C1Cl C12693 [1,1,0,0,0,0|1,0,1]=4 1321 B9R1.15 OCC1=C(Br)C=CC=N1 B42889 [1,1,0,0,0,0|2,0,0]=4 1322 B9R1.15 OCC1=C(Cl)C=CC=N1 C42910 [1,1,0,0,0,0|2,0,0]=4 1323 B9R1.15 OCC1=C(F)C=CC=N1 F1706 [1,1,0,0,0,0|2,0,0]=4 1324 B9R1.15 OCC1=C(O)C=CC=N1 H60848 [1,1,0,0,0,0|2,0,0]=4 1325 B9R1.15 OCC1=CC=CN=C1Br B69414 [1,1,0,0,0,0|2,0,0]=4 1326 B9R1.15 OCC1=CC=CN=C1Cl C0580 [1,1,0,0,0,0|2,0,0]=4 1327 B9R1.15 OCC1=CC=CN=C1F F42930 [1,1,0,0,0,0|2,0,0]=4 1328 B9R1.15 OCC1=NC=CN=C1Cl C1612 [1,1,0,0,0,0|1,0,0]=3 1329 B9R1.22 CC1=CC(C)=C(C=O)N1 D37937 [0,1,0,0,1,0|0,0,2]=4 1330 B9R1.22 CC1=NC(Br)=C(CBr)S1 B40988 [0,1,0,0,1,0|2,0,0]=4 1331 B9R1.22 CC1=NC(C)=C(C=O)N1 D39065 [0,1,0,0,1,0|0,0,2]=4 1332 B9R1.22 CC1=NC(C)=C(CO)S1 D43393 [0,1,0,0,1,0|1,0,0]=3 1333 B9R1.22 CC1=NN(C)C(C=O)=C1 D3606 [0,1,0,0,1,0|1,0,1]=4 1334 B9R1.22 CC1=NN(C)C(CCl)=C1 C1040 [0,1,0,0,1,0|1,0,0]=3 1335 B9R1.22 CC1=NN(C)C(CO)=C1 D3957 [0,1,0,0,1,0|1,0,0]=3 1336 B9R1.22 CC1=NN(C)C=C1C=O D9711 [0,1,0,0,1,0|1,0,1]=4 1337 B9R1.22 CC1=NN(C)C=C1CN D23506 [0,1,0,0,1,0|1,0,0]=3 1338 B9R1.23 CC1=C(C)SC(C#N)=N1 C7813 [0,1,0,0,1,0|1,0,1]=4 1339 B9R1.23 CC1=C(C)SC(C=O)=N1 D25172 [0,1,0,0,1,0|1,0,1]=4 1340 B9R1.23 CC1=CC(CCl)=NN1C C11366 [0,1,0,0,1,0|1,0,0]=3 1341 B9R1.23 CC1=CC(CN)=NN1C A11367 [0,1,0,0,1,0|1,0,0]=3 1342 B9R1.23 CC1=CC(CO)=NN1C H11365 [0,1,0,0,1,0|1,0,0]=3 1343 B9R1.23 CCC1=NC(C)=C(Br)S1 B43293 [0,1,0,0,1,0|2,0,0]=4 1344 B9R1.23 CCN1C=C(N)C(C)=N1 A15545 [0,1,0,0,1,0|2,0,0]=4 1345 B9R1.23 CCN1C=C(N)C(C)=N1 E61343 [0,1,0,0,1,0|2,0,0]=4 1346 B9R1.37 CC1=NN(C)C(C)=C1Br B39280 [0,1,0,0,1,0|1,0,0]=3 1347 B9R1.37 CC1=NN(C)C(C)=C1N A43436 [0,1,0,0,1,0|1,0,0]=3 1348 B9R1.37 CC1=NN(C)C(C)=C1N T41491 [0,1,0,0,1,0|1,0,0]=3 1349 B9R1.37 CC1=NN(C)C(N)=C1Br B22143 [0,1,0,0,1,0|2,0,0]=4 1350 B9R1.27 CC1=C(C=O)N(C)C=N1 D36814 [0,1,0,0,1,0|1,0,1]=4 1351 B9R1.27 CC1=NOC(C)=C1C=O D24190 [0,1,0,0,1,0|1,0,1]=4 1352 B9R1.27 CC1=NOC(C)=C1CCl C43298 [0,1,0,0,1,0|1,0,0]=3 1353 B9R1.27 CC1=NOC(C)=C1CN D41432 [0,1,0,0,1,0|1,0,0]=3 1354 B9R1.132 CC1=CC=C(CN)N1C A13529 [0,1,0,0,1,0|2,0,0]=4 1355 B9R1.132 CC1=CNC(C#N)=C1C D15553 [0,1,0,0,1,0|0,0,2]=4 1356 B9R1.132 CC1=CNC(C=O)=C1C D12049 [0,1,0,0,1,0|0,0,2]=4 1357 B9R1.132 CC1=NC=C(C=O)N1C D61627 [0,1,0,0,1,0|1,0,1]=4 1358 B9R1.132 CN1C(Cl)=CN=C1CO C41136 [0,1,0,0,1,0|2,0,0]=4 1359 B11R1.8 COC1=C(C)C(C)=CC(C)=C1 M53084 [0,2,0,0,0,0|2,0,0]=4 1360 B11R1.14 COC1=NC(C)=C(Br)C(C)=C1 B28642 [0,2,0,0,0,0|2,0,0]=4 1361 B11R1.32 CC1=C(C)C(Br)=C(C)C(N)=C1 B63638 [0,2,0,0,0,0|2,0,0]=4 1362 B11R1.32 CC1=CC(=O)C(C)=C(C)C1=O T49904 [0,2,0,0,0,0|2,0,0]=4 1363 B11R1.32 CC1=CC(C)=C(C)C(C)=C1C P68338 [0,2,0,0,0,0|2,0,0]=4 1364 B11R1.32 CC1=CC(C)=C(C)C([Mg+])=C1C T31781 [0,2,0,0,0,0|2,0,0]=4 1365 B11R1.32 CC1=NC(C)=C(Cl)C(Cl)=C1Cl T45321 [0,2,0,0,0,0|2,0,0]=4 1366 B11R1.32 CC1=NC(C)=C(Cl)C(N)=C1Cl D64412 [0,2,0,0,0,0|2,0,0]=4 1367 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 B32045 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 M53111 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.464 CC1=CC(C)=C(CO)C(C)=C1 M53082 [0,2,0,0,0,0|2,0,0]=4 1370 B11R1.464 COC1=C(C)N=C(Cl)C=C1Cl D15350 [0,2,0,0,0,0|2,0,0]=4 1371 B11R1.37 CC1=CN=C(C#N)C(C#N)=N1 M44407 [0,2,0,0,0,0|0,0,2]=4 1372 B11R1.37 CCC1=NC=C(C)N=C1CC D50396 [0,2,0,0,0,0|0,0,0]=2 1373 B11R1.37 COC1=C(CBr)C=CC(Br)=N1 B45872 [0,2,0,0,0,0|2,0,0]=4 1374 B11R1.37 COC1=C(CN)C=CC(Br)=N1 B46323 [0,2,0,0,0,0|2,0,0]=4 1375 B11R1.37 COC1=C(CN)C=CC(Br)=N1 B46325 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.37 COC1=C(CO)C=CC(Br)=N1 B46129 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.37 COC1=C(OC)N=C(Br)C=N1 B43030 [0,2,0,0,0,0|1,0,0]=3 1378 B11R1.37 COC1=C(OC)N=C(I)C=C1 K62513 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.37 COC1=CC(Br)=CN=C1OC B46127 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.37 COC1=CC(C)=CN=C1OC D46918 [0,2,0,0,0,0|1,0,0]=3 1381 B11R1.37 COC1=CC=C(N)N=C1OC D43649 [0,2,0,0,0,0|2,0,0]=4 1382 B11R1.37 COC1=NC(N)=CN=C1C#N A63896 [0,2,0,0,0,0|1,0,1]=4 1383 B11R1.37 COC1=NC=C(Br)C=C1CN A10481 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.37 COC1=NC=C(Br)C=C1CO B12770 [0,2,0,0,0,0|2,0,0]=4 1385 B11R1.37 COC1=NC=C(F)C=C1CO F32261 [0,2,0,0,0,0|2,0,0]=4 1386 B11R1.81 CCOC1=C(Br)C=C(C)C=N1 B64110 [0,2,0,0,0,0|2,0,0]=4 1387 B11R1.81 CCOC1=C(C)N=C(N)C=C1 E46978 [0,2,0,0,0,0|2,0,0]=4 1388 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 D68875 [0,2,0,0,0,0|2,0,0]=4 1389 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C B37444 [0,2,0,0,0,0|2,0,0]=4 1390 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 D54187 [0,2,0,0,0,0|2,0,0]=4 1391 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 D46013 [0,2,0,0,0,0|0,0,1]=3 1392 B11R1.166 CC1=NC(C)=C(B(O)O)C=C1 D43702 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 D61273 [0,2,0,0,0,0|1,0,1]=4 1394 B11R1.166 CC1=NC(C)=C([N+](=O)[O-])C=C1 D45999 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.277 CC1=C(C)N=C(Br)C(C#N)=C1 B48312 [0,2,0,0,0,0|1,0,1]=4 1396 B11R1.277 CC1=NC(C)=C(C)N=C1CO T28640 [0,2,0,0,0,0|0,0,0]=2 1397 B11R1.277 CCC1=NC(C)=C(C)N=C1C E50397 [0,2,0,0,0,0|0,0,0]=2 1398 B11R1.277 COC1=CC(Br)=C(C)N=C1N B46322 [0,2,0,0,0,0|2,0,0]=4 1399 B11R1.278 CC1=CN=C(CO)C(C)=C1Cl C46805 [0,2,0,0,0,0|1,0,0]=3 1400 B11R1.278 COC1=NC=C(C)C(Br)=C1C B37690 [0,2,0,0,0,0|1,0,0]=3 1401 B11R1.279 COC1=CC(C)=C(OC)C=C1 D50280 [0,2,0,0,0,0|2,0,0]=4 1402 B11R1.279 COC1=CC=C(CO)C(Cl)=N1 C46142 [0,2,0,0,0,0|2,0,0]=4 1403 B11R1.279 CSC1=NC(C)=C(CO)C=N1 M43686 [0,2,0,0,0,0|2,0,0]=4 1404 B11R1.167 CC(=O)C1=CC(Br)=CN=C1C B49027 [0,2,0,0,0,0|2,0,0]=4 1405 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 D46014 [0,2,0,0,0,0|0,0,1]=3 1406 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=N1 C42409 [0,2,0,0,0,0|1,0,1]=4 1407 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 D52506 [0,2,0,0,0,0|2,0,0]=4 1408 B11R1.182 CCOC1=C(N)N=CC(Br)=N1 A69486 [0,2,0,0,0,0|2,0,0]=4 1409 B11R1.280 COC1=CC(CO)=C(C)C=C1 M50289 [0,2,0,0,0,0|2,0,0]=4 1410 B11R1.280 COC1=CC=C(N)C(OC)=N1 A22799 [0,2,0,0,0,0|2,0,0]=4 1411 B11R1.280 COC1=NC(CO)=C(Br)C=C1 B46128 [0,2,0,0,0,0|2,0,0]=4 1412 B11R1.280 COC1=NC(OC)=C(Br)C=C1 B46125 [0,2,0,0,0,0|2,0,0]=4 1413 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C49042 [0,2,0,0,0,0|2,0,0]=4 1414 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 D49279 [0,2,0,0,0,0|1,0,1]=4 1415 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 D46015 [0,2,0,0,0,0|0,0,1]=3 1416 B11R1.21 CC1=NC(C(=O)O)=CN=C1Cl C42410 [0,2,0,0,0,0|1,0,1]=4 1417 B11R1.192 CNCC1=CC(C)=C(C)C=C1 D53119 [0,2,0,0,0,0|2,0,0]=4 1418 B9R2.50 C1=CC2=C(C=C1)CC2 B68912 [1,0,0,1,0,0|2,0,0]=4 1419 B11R2.36 BrC1=CN=C2CNCC2=C1 B11679 [0,1,0,1,0,0|2,0,0]=4 1420 B11R2.36 BrC1=CN=C2CNCC2=C1 B11680 [0,1,0,1,0,0|2,0,0]=4 1421 B11R2.36 BrC1=CN=C2NCCC2=C1 B12242 [0,1,0,1,0,0|2,0,0]=4 1422 B11R2.36 BrC1=CN=C2NCCC2=C1 B30154 [0,1,0,1,0,0|2,0,0]=4 1423 B11R2.36 BrC1=NC2=C(C=C1)NCC2 B45617 [0,1,0,1,0,0|2,0,0]=4 1424 B11R2.36 CC1=CC2=C(C=C1)NCC2 M49974 [0,1,0,1,0,0|2,0,0]=4 1425 B11R2.36 CC1=NC2=C(C=N1)CSC2 M46059 [0,1,0,1,0,0|2,0,0]=4 1426 B11R2.36 ClC1=CN=C2NCCC2=C1 C45621 [0,1,0,1,0,0|2,0,0]=4 1427 B11R2.36 ClC1=NC2=C(C=C1)CCC2 C48882 [0,1,0,1,0,0|2,0,0]=4 1428 B11R2.36 ClC1=NC2=C(C=C1)CNC2 C25491 [0,1,0,1,0,0|2,0,0]=4 1429 B11R2.36 FC1=CN=C2CNCC2=C1 F18831 [0,1,0,1,0,0|2,0,0]=4 1430 B11R2.190 OCC1=CC2=C(C=C1)CC2 B49878 [0,1,0,1,0,0|2,0,0]=4 1431 B7R1.2 CC1=CC(Br)=CS1 B40867 [1,0,0,0,1,0|2,0,0]=4 1432 B7R1.2 CC1=CC(Br)=NN1 B9765 [1,0,0,0,1,0|2,0,0]=4 1433 B7R1.2 CC1=CC(Br)=NO1 B2183 [1,0,0,0,1,0|2,0,0]=4 1434 B7R1.2 CC1=CC(C)=NO1 D39182 [1,0,0,0,1,0|1,0,0]=3 1435 B7R1.2 CC1=CC(Cl)=NN1 C7548 [1,0,0,0,1,0|2,0,0]=4 1436 B7R1.2 CC1=CC(I)=NN1 I26594 [1,0,0,0,1,0|2,0,0]=4 1437 B7R1.2 CC1=CC(N)=NN1 A11614 [1,0,0,0,1,0|2,0,0]=4 1438 B7R1.2 CC1=CC(N)=NO1 A12655 [1,0,0,0,1,0|2,0,0]=4 1439 B7R1.2 CC1=CC=C(C)S1 D43320 [1,0,0,0,1,0|2,0,0]=4 1440 B7R1.2 CC1=CN(C)N=C1 D69464 [1,0,0,0,1,0|1,0,0]=3 1441 B7R1.2 CC1=CN(C)N=N1 D40221 [1,0,0,0,1,0|2,0,0]=4 1442 B7R1.2 CC1=CN=C(Br)S1 B40104 [1,0,0,0,1,0|2,0,0]=4 1443 B7R1.2 CC1=CN=C(C)S1 D38993 [1,0,0,0,1,0|1,0,0]=3 1444 B7R1.2 CC1=CN=C(Cl)S1 C1978 [1,0,0,0,1,0|2,0,0]=4 1445 B7R1.2 CC1=CN=C(N)S1 A69715 [1,0,0,0,1,0|2,0,0]=4 1446 B7R1.2 CC1=CN=C(N)S1 M69725 [1,0,0,0,1,0|2,0,0]=4 1447 B7R1.2 CC1=CNC(Br)=N1 B40115 [1,0,0,0,1,0|1,0,1]=4 1448 B7R1.2 CC1=CNC(C)=N1 D41187 [1,0,0,0,1,0|0,0,1]=3 1449 B7R1.2 CC1=CNC(I)=N1 K40123 [1,0,0,0,1,0|1,0,1]=4 1450 B7R1.2 CC1=COC(N)=N1 A2053 [1,0,0,0,1,0|2,0,0]=4 1451 B7R1.2 CC1=CSC(Br)=N1 B2087 [1,0,0,0,1,0|2,0,0]=4 1452 B7R1.2 CC1=CSC(C)=N1 D41174 [1,0,0,0,1,0|1,0,0]=3 1453 B7R1.2 CC1=CSC(N)=C1 A0597 [1,0,0,0,1,0|2,0,0]=4 1454 B7R1.2 CC1=NC(Br)=CN1 B2121 [1,0,0,0,1,0|1,0,1]=4 1455 B7R1.2 CC1=NC(Br)=CS1 B2069 [1,0,0,0,1,0|2,0,0]=4 1456 B7R1.2 CC1=NC(N)=NO1 M39856 [1,0,0,0,1,0|2,0,0]=4 1457 B7R1.2 CC1=NC=C(Br)S1 B5222 [1,0,0,0,1,0|2,0,0]=4 1458 B7R1.2 CC1=NC=C(I)N1 K40124 [1,0,0,0,1,0|1,0,1]=4 1459 B7R1.2 CC1=NC=C(N)S1 M40189 [1,0,0,0,1,0|2,0,0]=4 1460 B7R1.2 CC1=NN(C)C=C1 D4115 [1,0,0,0,1,0|2,0,0]=4 1461 B7R1.2 CC1=NN=C(C)N1 D0366 [1,0,0,0,1,0|1,0,1]=4 1462 B7R1.2 CC1=NN=C(C)O1 D13454 [1,0,0,0,1,0|2,0,0]=4 1463 B7R1.2 CC1=NNC(Br)=C1 B40114 [1,0,0,0,1,0|2,0,0]=4 1464 B7R1.2 CC1=NNC(I)=C1 K40122 [1,0,0,0,1,0|2,0,0]=4 1465 B7R1.2 CC1=NNC(N)=C1 M40220 [1,0,0,0,1,0|2,0,0]=4 1466 B7R1.2 CC1=NNC(O)=C1 M0907 [1,0,0,0,1,0|2,0,0]=4 1467 B7R1.2 CC1=NOC(N)=C1 A37936 [1,0,0,0,1,0|2,0,0]=4 1468 B7R1.2 CC1=NSC(Br)=N1 B39817 [1,0,0,0,1,0|2,0,0]=4 1469 B7R1.2 CC1=NSC(Cl)=N1 C39820 [1,0,0,0,1,0|2,0,0]=4 1470 B7R1.2 CC1=NSC(I)=C1 I6114 [1,0,0,0,1,0|2,0,0]=4 1471 B7R1.2 CC1=NSC(N)=C1 M65783 [1,0,0,0,1,0|2,0,0]=4 1472 B7R1.2 CC1=NSC(N)=N1 A39858 [1,0,0,0,1,0|2,0,0]=4 1473 B7R1.2 CN1C=C(Br)C=N1 B7572 [1,0,0,0,1,0|2,0,0]=4 1474 B7R1.2 CN1C=C(Cl)C=N1 C40119 [1,0,0,0,1,0|2,0,0]=4 1475 B7R1.2 CN1C=C(I)C=N1 I23483 [1,0,0,0,1,0|2,0,0]=4 1476 B7R1.2 CN1C=C(N)C=N1 A10471 [1,0,0,0,1,0|2,0,0]=4 1477 B7R1.2 CN1C=C(N)C=N1 M24961 [1,0,0,0,1,0|2,0,0]=4 1478 B7R1.2 CN1C=C(N)C=N1 M40360 [1,0,0,0,1,0|2,0,0]=4 1479 B7R1.2 CN1C=C(O)C=N1 M38839 [1,0,0,0,1,0|2,0,0]=4 1480 B7R1.2 CN1C=NC(Br)=C1 B5167 [1,0,0,0,1,0|2,0,0]=4 1481 B7R1.2 CN1C=NC(Br)=N1 B36665 [1,0,0,0,1,0|2,0,0]=4 1482 B7R1.2 CN1C=NC(I)=C1 I2146 [1,0,0,0,1,0|2,0,0]=4 1483 B7R1.2 CN1C=NC(N)=C1 M38763 [1,0,0,0,1,0|2,0,0]=4 1484 B7R1.2 CN1C=NC(N)=N1 M38833 [1,0,0,0,1,0|2,0,0]=4 1485 B7R1.2 CN1N=CC(Br)=N1 B39841 [1,0,0,0,1,0|2,0,0]=4 1486 B7R1.4 CC1=C(Br)C=NN1 B12011 [1,0,0,0,1,0|2,0,0]=4 1487 B7R1.4 CC1=C(Br)C=NO1 B40106 [1,0,0,0,1,0|2,0,0]=4 1488 B7R1.4 CC1=C(N)NN=C1 M13606 [1,0,0,0,1,0|2,0,0]=4 1489 B7R1.4 CC1=C(N)ON=C1 M40180 [1,0,0,0,1,0|2,0,0]=4 1490 B7R1.4 CC1=CNC=C1C D12050 [1,0,0,0,1,0|0,0,1]=3 1491 B7R1.4 CC1=CNN=C1C D22811 [1,0,0,0,1,0|1,0,1]=4 1492 B7R1.4 CC1=CNN=C1C D60965 [1,0,0,0,1,0|1,0,1]=4 1493 B7R1.4 CC1=CSC=C1Br B40866 [1,0,0,0,1,0|2,0,0]=4 1494 B7R1.4 CN1C=NC=C1Br B2463 [1,0,0,0,1,0|2,0,0]=4 1495 B7R1.4 CN1C=NC=C1Cl C40118 [1,0,0,0,1,0|2,0,0]=4 1496 B7R1.4 CN1C=NC=C1I K2147 [1,0,0,0,1,0|2,0,0]=4 1497 B7R1.4 CN1C=NC=C1N M38381 [1,0,0,0,1,0|2,0,0]=4