0 B9R1.1 BrCC1=CC=C(I)C=C1 B45171 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.1 BrCC1=NC=C(Br)C=C1 B42521 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.1 BrCC1=NN=C(Br)C=C1 B36805 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.1 C#CC1=CC=C(Br)C=C1 B47528 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.1 C#CC1=CC=C(C)C=C1 E68609 [0,0,0,0,0,0|1,0,2]=3 5 B9R1.1 C#CC1=CC=C(Cl)C=C1 C4938 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.1 C#CC1=CC=C(F)C=C1 F2891 [0,0,0,0,0,0|2,0,2]=4 7 B9R1.1 C#CC1=CC=C(N)C=C1 E37919 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.1 C#CC1=CN=C(Cl)C=C1 C38156 [0,0,0,0,0,0|1,0,2]=3 9 B9R1.1 C#CC1=CN=C(F)C=C1 E44436 [0,0,0,0,0,0|1,0,2]=3 10 B9R1.1 C#CC1=CN=C(N)C=C1 E36917 [0,0,0,0,0,0|1,0,2]=3 11 B9R1.1 C#CC1=CNC(=O)C=C1 E32387 [0,0,0,0,0,0|1,0,3]=4 12 B9R1.1 C=CC1=CC=C(Br)C=C1 B68124 [0,0,0,0,0,0|2,0,2]=4 13 B9R1.1 C=CC1=CC=C(O)C=C1 V67697 [0,0,0,0,0,0|2,0,2]=4 14 B9R1.1 C=CC1=CN=C(C)C=C1 M11564 [0,0,0,0,0,0|0,0,2]=2 15 B9R1.1 C=CC1=CN=C(Cl)N=C1 C18596 [0,0,0,0,0,0|2,0,2]=4 16 B9R1.1 C=CC1=CN=C(F)C=C1 E16703 [0,0,0,0,0,0|1,0,2]=3 17 B9R1.1 CC1=CC=C(C=O)C=C1 M68600 [0,0,0,0,0,0|2,0,1]=3 18 B9R1.1 CC1=CC=C(CN)C=C1 M69544 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.1 CC1=CC=C(CN)N=N1 M0158 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.1 CC1=CC=C(CN)N=N1 M27037 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.1 CC1=CC=C(CO)C=C1 T37852 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.1 CC1=CC=C(NN)C=C1 T68855 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.1 CC1=CC=C(NN)N=N1 H23440 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.1 CC1=CN=C(C#N)C=C1 C4792 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.1 CC1=CN=C(C#N)C=N1 M42468 [0,0,0,0,0,0|2,0,1]=3 26 B9R1.1 CC1=CN=C(C=O)C=C1 M3063 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.1 CC1=CN=C(C=O)C=N1 M14618 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.1 CC1=CN=C(CCl)C=C1 C46107 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.1 CC1=CN=C(CCl)C=N1 C11548 [0,0,0,0,0,0|2,0,0]=2 30 B9R1.1 CC1=CN=C(CCl)C=N1 C43004 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.1 CC1=CN=C(CCl)N=C1 C14428 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.1 CC1=CN=C(CCl)N=C1 C8015 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.1 CC1=CN=C(CN)C=C1 M43622 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.1 CC1=CN=C(CN)C=C1 M46461 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.1 CC1=CN=C(CN)C=N1 A3139 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.1 CC1=CN=C(CN)N=C1 M11333 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.1 CC1=CN=C(CO)C=N1 M43210 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.1 CC1=CN=C(CO)N=C1 H11473 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.1 CC1=CN=C(NN)C=C1 H63578 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.1 CC1=NC=C(C#N)C=C1 M12704 [0,0,0,0,0,0|1,0,1]=2 41 B9R1.1 CC1=NC=C(C#N)C=N1 M12702 [0,0,0,0,0,0|2,0,1]=3 42 B9R1.1 CC1=NC=C(C=O)C=C1 M0419 [0,0,0,0,0,0|1,0,1]=2 43 B9R1.1 CC1=NC=C(C=O)C=N1 M12382 [0,0,0,0,0,0|2,0,1]=3 44 B9R1.1 CC1=NC=C(CBr)C=C1 B46089 [0,0,0,0,0,0|1,0,0]=1 45 B9R1.1 CC1=NC=C(CBr)C=N1 B42978 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.1 CC1=NC=C(CCl)C=C1 C46111 [0,0,0,0,0,0|1,0,0]=1 47 B9R1.1 CC1=NC=C(CCl)C=N1 C19650 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.1 CC1=NC=C(CN)C=C1 M0572 [0,0,0,0,0,0|1,0,0]=1 49 B9R1.1 CC1=NC=C(CN)C=N1 A1723 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.1 CC1=NC=C(CO)C=C1 M15722 [0,0,0,0,0,0|1,0,0]=1 51 B9R1.1 CC1=NC=C(CO)C=N1 H12381 [0,0,0,0,0,0|2,0,0]=2 52 B9R1.1 CC1=NC=C(NN)C=C1 H14024 [0,0,0,0,0,0|2,0,0]=2 53 B9R1.1 CC1=NN=C(C#N)C=C1 M0552 [0,0,0,0,0,0|2,0,1]=3 54 B9R1.1 CCC1=CC=C(Br)C=C1 B68945 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.1 CCC1=CC=C(Cl)C=C1 C49160 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.1 CCC1=CC=C(I)C=C1 E49167 [0,0,0,0,0,0|2,0,0]=2 57 B9R1.1 CCC1=CC=C([Mg+])C=C1 E31741 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.1 CCC1=CN=C(Cl)C=C1 C26331 [0,0,0,0,0,0|1,0,0]=1 59 B9R1.1 CCC1=CN=C(Cl)N=C1 E11897 [0,0,0,0,0,0|2,0,0]=2 60 B9R1.1 CCC1=CN=C(N)C=C1 E43600 [0,0,0,0,0,0|1,0,0]=1 61 B9R1.1 CCC1=CN=C(N)N=C1 E28664 [0,0,0,0,0,0|2,0,0]=2 62 B9R1.1 CCC1=NC=C(Br)C=C1 B1614 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.1 CCC1=NC=C(Br)C=N1 B36933 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.1 CCC1=NC=C(Cl)C=C1 C46096 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.1 CCC1=NC=C(N)C=C1 E43602 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.1 CCC1=NC=C(N)C=N1 A11320 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.1 CNC1=CC=C(Br)C=C1 B61266 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.1 CNC1=CC=C(C)C=C1 D39432 [0,0,0,0,0,0|2,0,0]=2 69 B9R1.1 CNC1=CC=C(I)C=C1 K46120 [0,0,0,0,0,0|3,0,0]=3 70 B9R1.1 CNC1=CC=C(N)C=C1 M69627 [0,0,0,0,0,0|3,0,0]=3 71 B9R1.1 CNC1=CN=C(C)C=C1 D43616 [0,0,0,0,0,0|1,0,0]=1 72 B9R1.1 CNC1=NC=C(Br)C=C1 B42975 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.1 CNC1=NC=C(C)C=C1 D43614 [0,0,0,0,0,0|3,0,0]=3 74 B9R1.1 CNC1=NC=C(F)C=C1 F32100 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.1 CNC1=NC=C(N)C=C1 M43342 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.1 CNC1=NC=C(N)C=C1 M43545 [0,0,0,0,0,0|4,0,0]=4 77 B9R1.1 CNC1=NN=C(Br)C=C1 B41068 [0,0,0,0,0,0|3,0,0]=3 78 B9R1.1 CNC1=NN=C(Cl)C=C1 C41078 [0,0,0,0,0,0|3,0,0]=3 79 B9R1.1 COC1=CC=C(S)C=C1 M46276 [0,0,0,0,0,0|3,0,0]=3 80 B9R1.1 COC1=CC=C([Mg+])C=C1 M31744 [0,0,0,0,0,0|3,0,0]=3 81 B9R1.1 COC1=CN=C(Br)C=C1 B5045 [0,0,0,0,0,0|2,0,0]=2 82 B9R1.1 COC1=CN=C(Br)C=N1 B14594 [0,0,0,0,0,0|3,0,0]=3 83 B9R1.1 COC1=CN=C(Br)N=C1 B10519 [0,0,0,0,0,0|3,0,0]=3 84 B9R1.1 COC1=CN=C(Cl)C=C1 C19386 [0,0,0,0,0,0|2,0,0]=2 85 B9R1.1 COC1=CN=C(Cl)C=N1 C14595 [0,0,0,0,0,0|3,0,0]=3 86 B9R1.1 COC1=CN=C(Cl)N=C1 C10446 [0,0,0,0,0,0|3,0,0]=3 87 B9R1.1 COC1=CN=C(F)C=C1 F42925 [0,0,0,0,0,0|2,0,0]=2 88 B9R1.1 COC1=CN=C(I)C=C1 I5931 [0,0,0,0,0,0|2,0,0]=2 89 B9R1.1 COC1=CN=C(N)C=C1 A10497 [0,0,0,0,0,0|2,0,0]=2 90 B9R1.1 COC1=CN=C(N)N=C1 A10520 [0,0,0,0,0,0|3,0,0]=3 91 B9R1.1 COC1=NC=C(Br)C=C1 B9550 [0,0,0,0,0,0|4,0,0]=4 92 B9R1.1 COC1=NC=C(C)C=C1 M67554 [0,0,0,0,0,0|3,0,0]=3 93 B9R1.1 COC1=NC=C(Cl)C=C1 C42903 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.1 COC1=NC=C(F)C=C1 F24011 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.1 COC1=NC=C(I)C=C1 K42935 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.1 COC1=NC=C(N)C=C1 A12692 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.1 COC1=NC=C(N)N=C1 M9733 [0,0,0,0,0,0|3,0,0]=3 98 B9R1.1 COC1=NC=C(O)C=C1 H43140 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.1 COC1=NN=C(Br)C=C1 B36769 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.1 COC1=NN=C(C)C=C1 M43203 [0,0,0,0,0,0|2,0,0]=2 101 B9R1.1 COC1=NN=C(Cl)C=C1 C12386 [0,0,0,0,0,0|3,0,0]=3 102 B9R1.1 COC1=NN=C(I)C=C1 K40944 [0,0,0,0,0,0|3,0,0]=3 103 B9R1.1 COC1=NN=C(N)C=C1 A12790 [0,0,0,0,0,0|3,0,0]=3 104 B9R1.1 COC1=NN=C(N)C=C1 M62955 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.1 CSC1=CC=C(I)C=C1 I38579 [0,0,0,0,0,0|3,0,0]=3 106 B9R1.1 CSC1=CC=C(O)C=C1 M67393 [0,0,0,0,0,0|3,0,0]=3 107 B9R1.1 CSC1=CC=C([Mg+])C=C1 M31771 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.1 CSC1=CN=C(Br)C=N1 B40873 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.1 CSC1=CN=C(Cl)N=C1 C40880 [0,0,0,0,0,0|3,0,0]=3 110 B9R1.1 CSC1=CN=C(N)C=C1 A43262 [0,0,0,0,0,0|2,0,0]=2 111 B9R1.1 CSC1=NC=C(Br)C=C1 B2646 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.1 ClC1=CC=C(CBr)C=C1 B45158 [0,0,0,0,0,0|3,0,0]=3 113 B9R1.1 ClC1=CN=C(CBr)C=C1 B42537 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.1 ClCC1=CC=C(Br)C=C1 B45160 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.1 ClCC1=CN=C(Br)C=C1 B42528 [0,0,0,0,0,0|2,0,0]=2 116 B9R1.1 ClCC1=CN=C(Br)C=C1 B42539 [0,0,0,0,0,0|2,0,0]=2 117 B9R1.1 ClCC1=CN=C(Cl)C=N1 C40730 [0,0,0,0,0,0|3,0,0]=3 118 B9R1.1 ClCC1=CN=C(Cl)N=C1 C11483 [0,0,0,0,0,0|3,0,0]=3 119 B9R1.1 ClCC1=NC=C(Br)C=C1 B42540 [0,0,0,0,0,0|4,0,0]=4 120 B9R1.1 ClCC1=NC=C(Br)C=C1 B61533 [0,0,0,0,0,0|4,0,0]=4 121 B9R1.1 ClCC1=NC=C(Cl)C=C1 C14676 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.1 ClCC1=NC=C(Cl)C=C1 C42565 [0,0,0,0,0,0|4,0,0]=4 123 B9R1.1 ClCC1=NN=C(Cl)C=C1 C14685 [0,0,0,0,0,0|3,0,0]=3 124 B9R1.1 ClCC1=NN=C(Cl)C=C1 C40731 [0,0,0,0,0,0|3,0,0]=3 125 B9R1.1 FC1=CC=C(C[Mg+])C=C1 F6777 [0,0,0,0,0,0|3,0,0]=3 126 B9R1.1 FC1=NC=C(CBr)C=C1 B39061 [0,0,0,0,0,0|2,0,0]=2 127 B9R1.1 FC1=NC=C(CBr)C=C1 B7888 [0,0,0,0,0,0|2,0,0]=2 128 B9R1.1 FC1=NC=C(CCl)C=C1 C7887 [0,0,0,0,0,0|2,0,0]=2 129 B9R1.1 N#CC1=CC=C(Br)C=C1 B67636 [0,0,0,0,0,0|3,0,1]=4 130 B9R1.1 N#CC1=CC=C(Cl)C=C1 C37848 [0,0,0,0,0,0|3,0,1]=4 131 B9R1.1 N#CC1=CC=C(F)C=C1 F64969 [0,0,0,0,0,0|3,0,1]=4 132 B9R1.1 N#CC1=CC=C(I)C=C1 K44443 [0,0,0,0,0,0|3,0,1]=4 133 B9R1.1 N#CC1=CC=C(N)C=C1 A64955 [0,0,0,0,0,0|3,0,1]=4 134 B9R1.1 N#CC1=CC=C(O)C=C1 C64941 [0,0,0,0,0,0|3,0,1]=4 135 B9R1.1 N#CC1=CC=C(S)C=C1 M64870 [0,0,0,0,0,0|3,0,1]=4 136 B9R1.1 N#CC1=CN=C(Br)C=C1 B41817 [0,0,0,0,0,0|2,0,1]=3 137 B9R1.1 N#CC1=CN=C(Br)C=N1 B3579 [0,0,0,0,0,0|3,0,1]=4 138 B9R1.1 N#CC1=CN=C(Br)N=C1 B37469 [0,0,0,0,0,0|3,0,1]=4 139 B9R1.1 N#CC1=CN=C(Cl)C=C1 C4495 [0,0,0,0,0,0|2,0,1]=3 140 B9R1.1 N#CC1=CN=C(Cl)C=N1 C4890 [0,0,0,0,0,0|3,0,1]=4 141 B9R1.1 N#CC1=CN=C(Cl)N=C1 C8018 [0,0,0,0,0,0|3,0,1]=4 142 B9R1.1 N#CC1=CN=C(F)C=C1 F13172 [0,0,0,0,0,0|2,0,1]=3 143 B9R1.1 N#CC1=CN=C(N)C=C1 A0556 [0,0,0,0,0,0|2,0,1]=3 144 B9R1.1 N#CC1=CN=C(N)N=C1 A36705 [0,0,0,0,0,0|3,0,1]=4 145 B9R1.1 N#CC1=CN=C(O)C=C1 H42087 [0,0,0,0,0,0|2,0,1]=3 146 B9R1.1 N#CC1=CNC(=O)C=C1 H12267 [0,0,0,0,0,0|2,0,2]=4 147 B9R1.1 N#CC1=NC=C(N)N=C1 A3818 [0,0,0,0,0,0|3,0,1]=4 148 B9R1.1 N#CC1=NN=C(Cl)C=C1 C1750 [0,0,0,0,0,0|3,0,1]=4 149 B9R1.1 N#CC1=NN=C(F)C=C1 F0671 [0,0,0,0,0,0|3,0,1]=4 150 B9R1.1 N#CC1=NN=C(N)C=C1 A1858 [0,0,0,0,0,0|3,0,1]=4 151 B9R1.1 NC1=CC=C(CO)C=C1 A36619 [0,0,0,0,0,0|3,0,0]=3 152 B9R1.1 NC1=CN=C(C=O)C=N1 A63812 [0,0,0,0,0,0|3,0,1]=4 153 B9R1.1 NC1=NC=C(C=O)C=C1 A12393 [0,0,0,0,0,0|2,0,1]=3 154 B9R1.1 NC1=NC=C(C=O)C=C1 A43519 [0,0,0,0,0,0|2,0,1]=3 155 B9R1.1 NC1=NC=C(C=O)C=N1 A3982 [0,0,0,0,0,0|3,0,1]=4 156 B9R1.1 NC1=NC=C(C=O)C=N1 A40961 [0,0,0,0,0,0|3,0,1]=4 157 B9R1.1 NC1=NC=C(CO)C=C1 A0345 [0,0,0,0,0,0|2,0,0]=2 158 B9R1.1 NC1=NC=C(CO)C=N1 A11298 [0,0,0,0,0,0|3,0,0]=3 159 B9R1.1 NCC1=CC=C(Br)C=C1 B36612 [0,0,0,0,0,0|3,0,0]=3 160 B9R1.1 NCC1=CC=C(Br)C=C1 B46090 [0,0,0,0,0,0|3,0,0]=3 161 B9R1.1 NCC1=CC=C(Cl)C=C1 C46099 [0,0,0,0,0,0|3,0,0]=3 162 B9R1.1 NCC1=CC=C(I)C=C1 I36689 [0,0,0,0,0,0|3,0,0]=3 163 B9R1.1 NCC1=CC=C(I)C=C1 K46123 [0,0,0,0,0,0|3,0,0]=3 164 B9R1.1 NCC1=CC=C(N)C=C1 A46581 [0,0,0,0,0,0|3,0,0]=3 165 B9R1.1 NCC1=CC=C(O)C=C1 A67587 [0,0,0,0,0,0|3,0,0]=3 166 B9R1.1 NCC1=CN=C(Br)C=C1 B42976 [0,0,0,0,0,0|2,0,0]=2 167 B9R1.1 NCC1=CN=C(Cl)C=C1 A0585 [0,0,0,0,0,0|2,0,0]=2 168 B9R1.1 NCC1=CN=C(Cl)N=C1 C7926 [0,0,0,0,0,0|3,0,0]=3 169 B9R1.1 NCC1=CN=C(F)C=C1 A13990 [0,0,0,0,0,0|2,0,0]=2 170 B9R1.1 NCC1=CNC(=O)C=C1 A1719 [0,0,0,0,0,0|2,0,1]=3 171 B9R1.1 NCC1=NC=C(Br)C=C1 B15775 [0,0,0,0,0,0|4,0,0]=4 172 B9R1.1 NCC1=NC=C(Br)C=C1 B42983 [0,0,0,0,0,0|4,0,0]=4 173 B9R1.1 NCC1=NC=C(Br)C=C1 B7021 [0,0,0,0,0,0|4,0,0]=4 174 B9R1.1 NCC1=NC=C(Cl)C=C1 C43002 [0,0,0,0,0,0|4,0,0]=4 175 B9R1.1 NCC1=NC=C(Cl)C=C1 C43003 [0,0,0,0,0,0|4,0,0]=4 176 B9R1.1 NCC1=NC=C(N)C=C1 A36932 [0,0,0,0,0,0|4,0,0]=4 177 B9R1.1 NCC1=NN=C(Cl)C=C1 C36937 [0,0,0,0,0,0|3,0,0]=3 178 B9R1.1 NNC1=CC=C(Br)C=C1 B42962 [0,0,0,0,0,0|4,0,0]=4 179 B9R1.1 NNC1=CC=C(Br)C=C1 B42980 [0,0,0,0,0,0|4,0,0]=4 180 B9R1.1 NNC1=CC=C(Cl)C=C1 C61981 [0,0,0,0,0,0|4,0,0]=4 181 B9R1.1 NNC1=CC=C(Cl)C=C1 C68982 [0,0,0,0,0,0|4,0,0]=4 182 B9R1.1 NNC1=CC=C(F)C=C1 F25536 [0,0,0,0,0,0|4,0,0]=4 183 B9R1.1 NNC1=CC=C(I)C=C1 K43029 [0,0,0,0,0,0|4,0,0]=4 184 B9R1.1 NNC1=CN=C(Cl)C=C1 C41073 [0,0,0,0,0,0|3,0,0]=3 185 B9R1.1 NNC1=CN=C(Cl)C=N1 C14613 [0,0,0,0,0,0|4,0,0]=4 186 B9R1.1 NNC1=NN=C(Cl)C=C1 C0265 [0,0,0,0,0,0|4,0,0]=4 187 B9R1.1 O=C1C=CC(CO)=CN1 H37111 [0,0,0,0,0,0|2,0,1]=3 188 B9R1.1 O=CC1=CC=C(Br)C=C1 B67400 [0,0,0,0,0,0|3,0,1]=4 189 B9R1.1 O=CC1=CC=C(Cl)C=C1 C37300 [0,0,0,0,0,0|3,0,1]=4 190 B9R1.1 O=CC1=CC=C(F)C=C1 F4631 [0,0,0,0,0,0|3,0,1]=4 191 B9R1.1 O=CC1=CC=C(I)C=C1 K20170 [0,0,0,0,0,0|3,0,1]=4 192 B9R1.1 O=CC1=CN=C(Br)C=C1 B2834 [0,0,0,0,0,0|2,0,1]=3 193 B9R1.1 O=CC1=CN=C(Cl)C=C1 C3215 [0,0,0,0,0,0|2,0,1]=3 194 B9R1.1 O=CC1=CN=C(Cl)C=N1 C12389 [0,0,0,0,0,0|3,0,1]=4 195 B9R1.1 O=CC1=CN=C(Cl)N=C1 C0338 [0,0,0,0,0,0|3,0,1]=4 196 B9R1.1 O=CC1=CN=C(F)C=C1 F13991 [0,0,0,0,0,0|2,0,1]=3 197 B9R1.1 O=CC1=CNC(=O)C=C1 X42601 [0,0,0,0,0,0|2,0,2]=4 198 B9R1.1 O=CC1=CNC(=O)N=C1 X63767 [0,0,0,0,0,0|3,0,1]=4 199 B9R1.1 O=CC1=NN=C(Cl)C=C1 C9432 [0,0,0,0,0,0|3,0,1]=4 200 B9R1.1 OCC1=CC=C(Br)C=C1 B67585 [0,0,0,0,0,0|3,0,0]=3 201 B9R1.1 OCC1=CC=C(Cl)C=C1 C39406 [0,0,0,0,0,0|3,0,0]=3 202 B9R1.1 OCC1=CC=C(F)C=C1 F39409 [0,0,0,0,0,0|3,0,0]=3 203 B9R1.1 OCC1=CC=C(I)C=C1 I36662 [0,0,0,0,0,0|3,0,0]=3 204 B9R1.1 OCC1=CN=C(Br)C=C1 B12392 [0,0,0,0,0,0|2,0,0]=2 205 B9R1.1 OCC1=CN=C(Cl)C=C1 C9389 [0,0,0,0,0,0|2,0,0]=2 206 B9R1.1 OCC1=CN=C(Cl)C=N1 C1534 [0,0,0,0,0,0|3,0,0]=3 207 B9R1.1 OCC1=CN=C(Cl)N=C1 C1532 [0,0,0,0,0,0|3,0,0]=3 208 B9R1.1 OCC1=CN=C(F)C=C1 F13989 [0,0,0,0,0,0|2,0,0]=2 209 B9R1.1 OCC1=NC=C(Br)C=C1 B3203 [0,0,0,0,0,0|4,0,0]=4 210 B9R1.1 OCC1=NC=C(Cl)C=C1 C22297 [0,0,0,0,0,0|4,0,0]=4 211 B9R1.1 OCC1=NC=C(F)C=C1 F0644 [0,0,0,0,0,0|4,0,0]=4 212 B9R1.1 OCC1=NN=C(Cl)C=C1 C14684 [0,0,0,0,0,0|3,0,0]=3 213 B8R1.2 BrCC1=CC=NC=C1 B36897 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.2 BrCC1=CN=CC=C1 B23879 [1,0,0,0,0,0|1,0,0]=2 215 B8R1.2 BrCC1=CN=CN=C1 B36879 [1,0,0,0,0,0|2,0,0]=3 216 B8R1.2 BrCC1=NC=CC=C1 B42841 [1,0,0,0,0,0|3,0,0]=4 217 B8R1.2 BrCC1=NC=CN=C1 B36766 [1,0,0,0,0,0|2,0,0]=3 218 B8R1.2 BrCC1=NN=CC=C1 B36818 [1,0,0,0,0,0|2,0,0]=3 219 B8R1.2 C#CC1=CC=CN=C1 E12479 [1,0,0,0,0,0|0,0,2]=3 220 B8R1.2 C#CC1=CC=CN=N1 E7489 [1,0,0,0,0,0|1,0,2]=4 221 B8R1.2 C#CC1=CN=CN=C1 E14435 [1,0,0,0,0,0|1,0,2]=4 222 B8R1.2 C#CC1=NC=CN=C1 E14588 [1,0,0,0,0,0|1,0,2]=4 223 B8R1.2 CCC1=NC=CN=C1 E43180 [1,0,0,0,0,0|1,0,0]=2 224 B8R1.2 CNC1=CC=CN=C1 M38086 [1,0,0,0,0,0|1,0,0]=2 225 B8R1.2 CNC1=CC=NC=C1 M68620 [1,0,0,0,0,0|3,0,0]=4 226 B8R1.2 CNC1=CN=CN=C1 M29839 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.2 CNC1=CN=NC=C1 M38382 [1,0,0,0,0,0|2,0,0]=3 228 B8R1.2 CNC1=NC=CN=C1 M41140 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.2 COC1=CC=NC=C1 M9391 [1,0,0,0,0,0|3,0,0]=4 230 B8R1.2 COC1=CN=CC=C1 M67978 [1,0,0,0,0,0|1,0,0]=2 231 B8R1.2 COC1=CN=NC=C1 M41023 [1,0,0,0,0,0|2,0,0]=3 232 B8R1.2 COC1=NC=CC=C1 M39277 [1,0,0,0,0,0|3,0,0]=4 233 B8R1.2 COC1=NC=CN=C1 M2768 [1,0,0,0,0,0|2,0,0]=3 234 B8R1.2 COC1=NN=CC=C1 M41021 [1,0,0,0,0,0|2,0,0]=3 235 B8R1.2 CSC1=NN=CC=N1 M5642 [1,0,0,0,0,0|3,0,0]=4 236 B8R1.2 ClCC1=CC=NC=C1 C68845 [1,0,0,0,0,0|3,0,0]=4 237 B8R1.2 ClCC1=CN=CN=C1 C10228 [1,0,0,0,0,0|2,0,0]=3 238 B8R1.2 ClCC1=NC=CC=C1 C67870 [1,0,0,0,0,0|3,0,0]=4 239 B8R1.2 ClCC1=NC=CN=C1 C0149 [1,0,0,0,0,0|2,0,0]=3 240 B8R1.2 ClCC1=NN=CC=C1 C0156 [1,0,0,0,0,0|2,0,0]=3 241 B8R1.2 N#CC1=CN=CN=C1 P0144 [1,0,0,0,0,0|2,0,1]=4 242 B8R1.2 N#CC1=CN=NC=C1 C10224 [1,0,0,0,0,0|2,0,1]=4 243 B8R1.2 N#CC1=NC=CN=C1 C68117 [1,0,0,0,0,0|2,0,1]=4 244 B8R1.2 N#CC1=NN=CC=C1 C7488 [1,0,0,0,0,0|2,0,1]=4 245 B8R1.2 NCC1=CC=CN=C1 A69257 [1,0,0,0,0,0|1,0,0]=2 246 B8R1.2 NCC1=CC=CN=N1 A0031 [1,0,0,0,0,0|2,0,0]=3 247 B8R1.2 NCC1=CC=CN=N1 P29569 [1,0,0,0,0,0|2,0,0]=3 248 B8R1.2 NCC1=CC=NC=C1 P67743 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.2 NCC1=CN=CN=C1 P0028 [1,0,0,0,0,0|2,0,0]=3 250 B8R1.2 NCC1=CN=CN=C1 P29548 [1,0,0,0,0,0|2,0,0]=3 251 B8R1.2 NCC1=CN=NC=C1 A0027 [1,0,0,0,0,0|2,0,0]=3 252 B8R1.2 NCC1=CN=NC=C1 P41350 [1,0,0,0,0,0|2,0,0]=3 253 B8R1.2 NCC1=NC=CN=C1 P0029 [1,0,0,0,0,0|2,0,0]=3 254 B8R1.2 NCC1=NC=CN=C1 P4303 [1,0,0,0,0,0|2,0,0]=3 255 B8R1.2 NNC1=CC=CC=C1 P68696 [1,0,0,0,0,0|3,0,0]=4 256 B8R1.2 NNC1=CC=CN=C1 H0043 [1,0,0,0,0,0|2,0,0]=3 257 B8R1.2 NNC1=CC=CN=C1 H41349 [1,0,0,0,0,0|2,0,0]=3 258 B8R1.2 NNC1=NC=CN=C1 H0220 [1,0,0,0,0,0|3,0,0]=4 259 B8R1.2 NOC1=CC=CC=C1 P43533 [1,0,0,0,0,0|3,0,0]=4 260 B8R1.2 O=CC1=CN=CC=C1 P13753 [1,0,0,0,0,0|1,0,1]=3 261 B8R1.2 O=CC1=CN=CN=C1 F2817 [1,0,0,0,0,0|2,0,1]=4 262 B8R1.2 O=CC1=CN=NC=C1 P7445 [1,0,0,0,0,0|2,0,1]=4 263 B8R1.2 O=CC1=NC=CN=C1 P0148 [1,0,0,0,0,0|2,0,1]=4 264 B8R1.2 OCC1=CC=NC=C1 P43429 [1,0,0,0,0,0|3,0,0]=4 265 B8R1.2 OCC1=CC=NC=C1 P67894 [1,0,0,0,0,0|3,0,0]=4 266 B8R1.2 OCC1=CN=CC=C1 P15946 [1,0,0,0,0,0|1,0,0]=2 267 B8R1.2 OCC1=CN=CN=C1 P0145 [1,0,0,0,0,0|2,0,0]=3 268 B8R1.2 OCC1=NC=CC=C1 P69303 [1,0,0,0,0,0|3,0,0]=4 269 B8R1.2 OCC1=NC=CN=C1 P0147 [1,0,0,0,0,0|2,0,0]=3 270 B8R1.2 OCC1=NN=CC=C1 P0155 [1,0,0,0,0,0|2,0,0]=3 271 B8R1.2 ONC1=CC=CC=C1 P67873 [1,0,0,0,0,0|3,0,0]=4 272 B8R1.3 BrC1=CC=C(I)C=C1 B39232 [1,0,0,0,0,0|3,0,0]=4 273 B8R1.3 BrC1=CN=C(Br)C=C1 D4497 [1,0,0,0,0,0|2,0,0]=3 274 B8R1.3 BrC1=CN=C(Br)C=N1 D3577 [1,0,0,0,0,0|3,0,0]=4 275 B8R1.3 BrC1=CN=C(Br)N=C1 D9536 [1,0,0,0,0,0|3,0,0]=4 276 B8R1.3 BrC1=CN=C(I)C=C1 B1586 [1,0,0,0,0,0|2,0,0]=3 277 B8R1.3 BrC1=CN=C(I)C=N1 B3582 [1,0,0,0,0,0|3,0,0]=4 278 B8R1.3 BrC1=CN=C(I)N=C1 B3076 [1,0,0,0,0,0|3,0,0]=4 279 B8R1.3 BrC1=NC=C(I)C=C1 B12390 [1,0,0,0,0,0|2,0,0]=3 280 B8R1.3 BrC1=NC=C(I)C=N1 B39107 [1,0,0,0,0,0|3,0,0]=4 281 B8R1.3 BrC1=NN=C(Br)C=C1 D1016 [1,0,0,0,0,0|3,0,0]=4 282 B8R1.3 CC1=CC=C(C)N=N1 D43182 [1,0,0,0,0,0|1,0,0]=2 283 B8R1.3 CC1=CC=C(I)C=C1 K68149 [1,0,0,0,0,0|2,0,0]=3 284 B8R1.3 CC1=CC=C(N)N=N1 A0340 [1,0,0,0,0,0|2,0,0]=3 285 B8R1.3 CC1=CC=C([Mg+])C=C1 M31731 [1,0,0,0,0,0|2,0,0]=3 286 B8R1.3 CC1=CN=C(Br)C=C1 B4672 [1,0,0,0,0,0|1,0,0]=2 287 B8R1.3 CC1=CN=C(Br)C=N1 B14614 [1,0,0,0,0,0|2,0,0]=3 288 B8R1.3 CC1=CN=C(Br)N=C1 B67690 [1,0,0,0,0,0|2,0,0]=3 289 B8R1.3 CC1=CN=C(Cl)C=C1 C21968 [1,0,0,0,0,0|1,0,0]=2 290 B8R1.3 CC1=CN=C(Cl)C=N1 C40876 [1,0,0,0,0,0|2,0,0]=3 291 B8R1.3 CC1=CN=C(Cl)N=C1 C4929 [1,0,0,0,0,0|2,0,0]=3 292 B8R1.3 CC1=CN=C(F)C=C1 F22553 [1,0,0,0,0,0|1,0,0]=2 293 B8R1.3 CC1=CN=C(N)C=C1 M20542 [1,0,0,0,0,0|1,0,0]=2 294 B8R1.3 CC1=CN=C(N)C=N1 M14592 [1,0,0,0,0,0|2,0,0]=3 295 B8R1.3 CC1=CN=C(N)N=C1 A0080 [1,0,0,0,0,0|2,0,0]=3 296 B8R1.3 CC1=CN=C(N)N=C1 M38708 [1,0,0,0,0,0|2,0,0]=3 297 B8R1.3 CC1=CN=C(O)C=C1 M63706 [1,0,0,0,0,0|1,0,0]=2 298 B8R1.3 CC1=CNC(=O)C=C1 M68372 [1,0,0,0,0,0|1,0,1]=3 299 B8R1.3 CC1=CNC(=O)C=N1 M68091 [1,0,0,0,0,0|2,0,0]=3 300 B8R1.3 CC1=NC=C(Br)C=C1 B5402 [1,0,0,0,0,0|1,0,0]=2 301 B8R1.3 CC1=NC=C(Br)C=N1 B0659 [1,0,0,0,0,0|2,0,0]=3 302 B8R1.3 CC1=NC=C(Cl)C=C1 C42845 [1,0,0,0,0,0|1,0,0]=2 303 B8R1.3 CC1=NC=C(Cl)C=N1 C40879 [1,0,0,0,0,0|2,0,0]=3 304 B8R1.3 CC1=NC=C(F)C=C1 F1117 [1,0,0,0,0,0|1,0,0]=2 305 B8R1.3 CC1=NC=C(F)C=N1 F40883 [1,0,0,0,0,0|2,0,0]=3 306 B8R1.3 CC1=NC=C(I)C=C1 I36966 [1,0,0,0,0,0|1,0,0]=2 307 B8R1.3 CC1=NC=C(N)C=C1 A1121 [1,0,0,0,0,0|1,0,0]=2 308 B8R1.3 CC1=NC=C(N)C=N1 A10293 [1,0,0,0,0,0|2,0,0]=3 309 B8R1.3 CC1=NC=C(O)C=C1 H4553 [1,0,0,0,0,0|1,0,0]=2 310 B8R1.3 CC1=NC=C(O)C=N1 M23235 [1,0,0,0,0,0|2,0,0]=3 311 B8R1.3 CC1=NN=C(Br)C=C1 B10633 [1,0,0,0,0,0|2,0,0]=3 312 B8R1.3 CC1=NN=C(Cl)C=C1 C3219 [1,0,0,0,0,0|2,0,0]=3 313 B8R1.3 CC1=NN=C(I)C=C1 I10435 [1,0,0,0,0,0|2,0,0]=3 314 B8R1.3 CC1=NNC(=O)C=C1 M0242 [1,0,0,0,0,0|2,0,0]=3 315 B8R1.3 CC1=NNC(=O)C=C1 M25029 [1,0,0,0,0,0|2,0,0]=3 316 B8R1.3 CC1=NNC(=O)C=C1 M41309 [1,0,0,0,0,0|2,0,0]=3 317 B8R1.3 ClC1=CC=C(I)C=C1 C67848 [1,0,0,0,0,0|3,0,0]=4 318 B8R1.3 ClC1=CN=C(Br)C=C1 B4976 [1,0,0,0,0,0|2,0,0]=3 319 B8R1.3 ClC1=CN=C(Br)C=N1 B3581 [1,0,0,0,0,0|3,0,0]=4 320 B8R1.3 ClC1=CN=C(Br)N=C1 B17946 [1,0,0,0,0,0|3,0,0]=4 321 B8R1.3 ClC1=CN=C(Cl)C=C1 D4510 [1,0,0,0,0,0|2,0,0]=3 322 B8R1.3 ClC1=CN=C(Cl)C=N1 D3587 [1,0,0,0,0,0|3,0,0]=4 323 B8R1.3 ClC1=CN=C(Cl)N=C1 D3914 [1,0,0,0,0,0|3,0,0]=4 324 B8R1.3 ClC1=CN=C(I)C=C1 I4551 [1,0,0,0,0,0|2,0,0]=3 325 B8R1.3 ClC1=CN=C(I)C=N1 C39982 [1,0,0,0,0,0|3,0,0]=4 326 B8R1.3 ClC1=CN=C(I)N=C1 C4724 [1,0,0,0,0,0|3,0,0]=4 327 B8R1.3 ClC1=NC=C(Br)C=C1 B3973 [1,0,0,0,0,0|2,0,0]=3 328 B8R1.3 ClC1=NC=C(Br)C=N1 B2217 [1,0,0,0,0,0|3,0,0]=4 329 B8R1.3 ClC1=NC=C(I)C=C1 C24918 [1,0,0,0,0,0|2,0,0]=3 330 B8R1.3 ClC1=NC=C(I)C=N1 C6980 [1,0,0,0,0,0|3,0,0]=4 331 B8R1.3 ClC1=NN=C(Br)C=C1 B38795 [1,0,0,0,0,0|3,0,0]=4 332 B8R1.3 ClC1=NN=C(I)C=C1 C12055 [1,0,0,0,0,0|3,0,0]=4 333 B8R1.3 FC1=CC=C(Br)C=C1 B39231 [1,0,0,0,0,0|3,0,0]=4 334 B8R1.3 FC1=CC=C(I)C=C1 F39236 [1,0,0,0,0,0|3,0,0]=4 335 B8R1.3 FC1=CC=C(S)C=C1 F42373 [1,0,0,0,0,0|3,0,0]=4 336 B8R1.3 FC1=CC=C([Mg+])C=C1 F31733 [1,0,0,0,0,0|3,0,0]=4 337 B8R1.3 FC1=CN=C(Br)C=C1 B40635 [1,0,0,0,0,0|2,0,0]=3 338 B8R1.3 FC1=CN=C(Br)C=N1 B39978 [1,0,0,0,0,0|3,0,0]=4 339 B8R1.3 FC1=CN=C(Br)N=C1 B4878 [1,0,0,0,0,0|3,0,0]=4 340 B8R1.3 FC1=CN=C(Cl)C=C1 C40641 [1,0,0,0,0,0|2,0,0]=3 341 B8R1.3 FC1=CN=C(Cl)N=C1 C2722 [1,0,0,0,0,0|3,0,0]=4 342 B8R1.3 FC1=CN=C(F)C=C1 D40649 [1,0,0,0,0,0|2,0,0]=3 343 B8R1.3 FC1=CN=C(I)C=C1 F38230 [1,0,0,0,0,0|2,0,0]=3 344 B8R1.3 FC1=NC=C(Br)C=C1 B4730 [1,0,0,0,0,0|2,0,0]=3 345 B8R1.3 FC1=NC=C(Br)C=N1 B2219 [1,0,0,0,0,0|3,0,0]=4 346 B8R1.3 FC1=NC=C(Cl)C=C1 C40644 [1,0,0,0,0,0|2,0,0]=3 347 B8R1.3 FC1=NC=C(I)C=C1 F40650 [1,0,0,0,0,0|2,0,0]=3 348 B8R1.3 FC1=NC=C(I)C=N1 F39986 [1,0,0,0,0,0|3,0,0]=4 349 B8R1.3 FC1=NN=C(Br)C=C1 B37510 [1,0,0,0,0,0|3,0,0]=4 350 B8R1.3 FC1=NN=C(F)C=C1 D3618 [1,0,0,0,0,0|3,0,0]=4 351 B8R1.3 IC1=CC=C(I)C=C1 D39237 [1,0,0,0,0,0|3,0,0]=4 352 B8R1.3 IC1=NN=C(I)C=C1 D39988 [1,0,0,0,0,0|3,0,0]=4 353 B8R1.3 NC1=CC=C(I)C=C1 K68110 [1,0,0,0,0,0|3,0,0]=4 354 B8R1.3 NC1=CC=C(N)N=N1 P3643 [1,0,0,0,0,0|3,0,0]=4 355 B8R1.3 NC1=CN=C(Br)C=C1 A4783 [1,0,0,0,0,0|2,0,0]=3 356 B8R1.3 NC1=CN=C(Br)C=N1 A2854 [1,0,0,0,0,0|3,0,0]=4 357 B8R1.3 NC1=CN=C(Br)N=C1 A12920 [1,0,0,0,0,0|3,0,0]=4 358 B8R1.3 NC1=CN=C(Cl)C=C1 C39174 [1,0,0,0,0,0|2,0,0]=3 359 B8R1.3 NC1=CN=C(Cl)C=N1 A0684 [1,0,0,0,0,0|3,0,0]=4 360 B8R1.3 NC1=CN=C(Cl)N=C1 A3768 [1,0,0,0,0,0|3,0,0]=4 361 B8R1.3 NC1=CN=C(F)C=C1 A12653 [1,0,0,0,0,0|2,0,0]=3 362 B8R1.3 NC1=CN=C(I)C=C1 A40889 [1,0,0,0,0,0|2,0,0]=3 363 B8R1.3 NC1=CN=C(I)C=N1 A40087 [1,0,0,0,0,0|3,0,0]=4 364 B8R1.3 NC1=CN=C(N)C=N1 P40199 [1,0,0,0,0,0|3,0,0]=4 365 B8R1.3 NC1=CN=C(N)C=N1 P40324 [1,0,0,0,0,0|3,0,0]=4 366 B8R1.3 NC1=NC=C(Br)C=C1 A5382 [1,0,0,0,0,0|2,0,0]=3 367 B8R1.3 NC1=NC=C(Br)C=N1 A0339 [1,0,0,0,0,0|3,0,0]=4 368 B8R1.3 NC1=NC=C(Cl)C=N1 A9537 [1,0,0,0,0,0|3,0,0]=4 369 B8R1.3 NC1=NC=C(F)C=C1 A3607 [1,0,0,0,0,0|2,0,0]=3 370 B8R1.3 NC1=NC=C(F)C=N1 F40086 [1,0,0,0,0,0|3,0,0]=4 371 B8R1.3 NC1=NC=C(I)C=C1 K4516 [1,0,0,0,0,0|2,0,0]=3 372 B8R1.3 NC1=NC=C(I)C=N1 A40089 [1,0,0,0,0,0|3,0,0]=4 373 B8R1.3 NC1=NC=C(O)C=N1 A4017 [1,0,0,0,0,0|3,0,0]=4 374 B8R1.3 NC1=NN=C(Br)C=C1 A0262 [1,0,0,0,0,0|3,0,0]=4 375 B8R1.3 NC1=NN=C(Cl)C=C1 A2844 [1,0,0,0,0,0|3,0,0]=4 376 B8R1.3 NC1=NN=C(F)C=C1 F3619 [1,0,0,0,0,0|3,0,0]=4 377 B8R1.3 NC1=NN=C(I)C=C1 A0591 [1,0,0,0,0,0|3,0,0]=4 378 B8R1.3 NC1=NNC(=O)C=C1 A40132 [1,0,0,0,0,0|3,0,0]=4 379 B8R1.3 O=C1C=CC(Br)=NN1 B38928 [1,0,0,0,0,0|3,0,0]=4 380 B8R1.3 O=C1C=CC(Cl)=CN1 C68182 [1,0,0,0,0,0|2,0,1]=4 381 B8R1.3 O=C1C=CC(I)=CN1 K40860 [1,0,0,0,0,0|2,0,1]=4 382 B8R1.3 O=C1C=CC(O)=CN1 H67757 [1,0,0,0,0,0|2,0,1]=4 383 B8R1.3 O=C1N=CC(Cl)=CN1 C69555 [1,0,0,0,0,0|3,0,0]=4 384 B8R1.3 O=C1N=CC(F)=CN1 F68054 [1,0,0,0,0,0|3,0,0]=4 385 B8R1.3 O=C1N=CC(I)=CN1 K40045 [1,0,0,0,0,0|3,0,0]=4 386 B8R1.3 OC1=CC=C(F)C=C1 F68080 [1,0,0,0,0,0|3,0,0]=4 387 B8R1.3 OC1=CN=C(Br)C=C1 B0344 [1,0,0,0,0,0|2,0,0]=3 388 B8R1.3 OC1=CN=C(Br)C=N1 B14598 [1,0,0,0,0,0|3,0,0]=4 389 B8R1.3 OC1=CN=C(Br)N=C1 B7907 [1,0,0,0,0,0|3,0,0]=4 390 B8R1.3 OC1=CN=C(Cl)C=C1 C4788 [1,0,0,0,0,0|2,0,0]=3 391 B8R1.3 OC1=CN=C(Cl)C=N1 C38694 [1,0,0,0,0,0|3,0,0]=4 392 B8R1.3 OC1=CN=C(Cl)N=C1 C0498 [1,0,0,0,0,0|3,0,0]=4 393 B8R1.3 OC1=CN=C(F)C=C1 F5147 [1,0,0,0,0,0|2,0,0]=3 394 B8R1.3 OC1=NC=C(Br)C=C1 B39171 [1,0,0,0,0,0|2,0,0]=3 395 B8R1.3 OC1=NC=C(Br)C=C1 B39172 [1,0,0,0,0,0|2,0,0]=3 396 B8R1.3 OC1=NC=C(Br)C=N1 B2618 [1,0,0,0,0,0|3,0,0]=4 397 B8R1.3 OC1=NC=C(F)C=C1 F36674 [1,0,0,0,0,0|2,0,0]=3 398 B8R1.3 OC1=NC=C(I)C=C1 K40858 [1,0,0,0,0,0|2,0,0]=3 399 B8R1.3 OC1=NN=C(Cl)C=C1 C3188 [1,0,0,0,0,0|3,0,0]=4 400 B8R1.3 SC1=CC=C(Br)C=C1 B60845 [1,0,0,0,0,0|3,0,0]=4 401 B8R1.3 SC1=CC=C(S)C=C1 B63577 [1,0,0,0,0,0|3,0,0]=4 402 B8R1.3 SC1=NC=C(Br)C=C1 B40822 [1,0,0,0,0,0|2,0,0]=3 403 B8R1.3 [Mg+]C1=CC=C(Cl)C=C1 C31752 [1,0,0,0,0,0|3,0,0]=4 404 B10R1.1 CC1=CC=C(CC#N)C=C1 M39574 [0,1,0,0,0,0|1,0,1]=3 405 B10R1.1 CC1=CC=C(CCBr)C=C1 B0463 [0,1,0,0,0,0|1,0,0]=2 406 B10R1.1 CC1=CC=C(CCO)C=C1 T50265 [0,1,0,0,0,0|1,0,0]=2 407 B10R1.1 CC1=CC=C(CC[Mg+])C=C1 M31724 [0,1,0,0,0,0|1,0,0]=2 408 B10R1.1 CC1=CC=C(CNN)C=C1 M49662 [0,1,0,0,0,0|2,0,0]=3 409 B10R1.1 CC1=CN=C(CC#N)C=C1 M48792 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.1 CC1=NC=C(CCO)C=C1 M15913 [0,1,0,0,0,0|0,0,0]=1 411 B10R1.1 CCCC1=CC=C(Br)C=C1 B39542 [0,1,0,0,0,0|2,0,0]=3 412 B10R1.1 CCCC1=CC=C(N)C=C1 P68566 [0,1,0,0,0,0|2,0,0]=3 413 B10R1.1 CCCC1=CC=C([Mg+])C=C1 P31760 [0,1,0,0,0,0|2,0,0]=3 414 B10R1.1 CCNC1=CC=C(F)C=C1 E46759 [0,1,0,0,0,0|2,0,0]=3 415 B10R1.1 CCOC1=CC=C(I)C=C1 E49468 [0,1,0,0,0,0|2,0,0]=3 416 B10R1.1 CCOC1=CC=C(O)C=C1 E68898 [0,1,0,0,0,0|2,0,0]=3 417 B10R1.1 CCOC1=CC=C([Mg+])C=C1 E31767 [0,1,0,0,0,0|2,0,0]=3 418 B10R1.1 CCOC1=CN=C(Br)C=C1 B46151 [0,1,0,0,0,0|1,0,0]=2 419 B10R1.1 CCOC1=CN=C(Br)N=C1 B11613 [0,1,0,0,0,0|2,0,0]=3 420 B10R1.1 CCOC1=CN=C(Cl)C=C1 C46184 [0,1,0,0,0,0|1,0,0]=2 421 B10R1.1 CCOC1=CN=C(Cl)N=C1 C1802 [0,1,0,0,0,0|2,0,0]=3 422 B10R1.1 CCOC1=CN=C(N)C=C1 E43625 [0,1,0,0,0,0|1,0,0]=2 423 B10R1.1 CCOC1=CN=C(N)N=C1 E43348 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.1 CCOC1=NC=C(Br)C=C1 B4568 [0,1,0,0,0,0|3,0,0]=4 425 B10R1.1 CCOC1=NC=C(I)C=C1 E46226 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.1 CCOC1=NC=C(N)N=C1 E9737 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.1 CCOC1=NN=C(Cl)C=C1 C43068 [0,1,0,0,0,0|2,0,0]=3 428 B10R1.1 CCOC1=NN=C(N)C=C1 E43349 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.1 CCSC1=CC=C([Mg+])C=C1 E31791 [0,1,0,0,0,0|2,0,0]=3 430 B10R1.1 CNCC1=CC=C(Br)C=C1 B46738 [0,1,0,0,0,0|2,0,0]=3 431 B10R1.1 CNCC1=CC=C(Br)C=C1 M46740 [0,1,0,0,0,0|2,0,0]=3 432 B10R1.1 CNCC1=CC=C(C)C=C1 M50315 [0,1,0,0,0,0|1,0,0]=2 433 B10R1.1 CNCC1=CC=C(C)C=C1 M52163 [0,1,0,0,0,0|1,0,0]=2 434 B10R1.1 CNCC1=CC=C(Cl)C=C1 C46755 [0,1,0,0,0,0|2,0,0]=3 435 B10R1.1 CNCC1=CC=C(Cl)C=C1 M46757 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.1 COCC1=CC=C(N)C=C1 M46895 [0,1,0,0,0,0|2,0,0]=3 437 B10R1.1 ClC1=CC=C(CCBr)C=C1 B48760 [0,1,0,0,0,0|2,0,0]=3 438 B10R1.1 FC1=CC=C(CCBr)C=C1 B13769 [0,1,0,0,0,0|2,0,0]=3 439 B10R1.1 FC1=CC=C(CC[Mg+])C=C1 F31725 [0,1,0,0,0,0|2,0,0]=3 440 B10R1.1 N#CCC1=CC=C(Cl)C=C1 C69078 [0,1,0,0,0,0|2,0,1]=4 441 B10R1.1 N#CCC1=CC=C(I)C=C1 K47988 [0,1,0,0,0,0|2,0,1]=4 442 B10R1.1 N#CCC1=CC=C(N)C=C1 A67449 [0,1,0,0,0,0|2,0,1]=4 443 B10R1.1 N#CCC1=CC=C(O)C=C1 H68900 [0,1,0,0,0,0|2,0,1]=4 444 B10R1.1 N#CCC1=CN=C(Cl)C=C1 C44776 [0,1,0,0,0,0|1,0,1]=3 445 B10R1.1 NCCC1=CC=C(Cl)C=C1 C67656 [0,1,0,0,0,0|2,0,0]=3 446 B10R1.1 NCCC1=CC=C(F)C=C1 F69101 [0,1,0,0,0,0|2,0,0]=3 447 B10R1.1 NCCC1=NC=C(Br)C=C1 A1731 [0,1,0,0,0,0|3,0,0]=4 448 B10R1.1 NNCC1=CC=C(Br)C=C1 B0093 [0,1,0,0,0,0|3,0,0]=4 449 B10R1.1 NNCC1=CC=C(Br)C=C1 B12215 [0,1,0,0,0,0|3,0,0]=4 450 B10R1.1 NNCC1=CC=C(Cl)C=C1 C0094 [0,1,0,0,0,0|3,0,0]=4 451 B10R1.1 NNCC1=CC=C(Cl)C=C1 C10206 [0,1,0,0,0,0|3,0,0]=4 452 B10R1.1 NNCC1=CC=C(F)C=C1 F0090 [0,1,0,0,0,0|3,0,0]=4 453 B10R1.1 NOCC1=CC=C(Cl)C=C1 C64524 [0,1,0,0,0,0|3,0,0]=4 454 B10R1.1 NOCC1=CC=C(F)C=C1 F46562 [0,1,0,0,0,0|3,0,0]=4 455 B10R1.1 O=CCC1=CC=C(Br)C=C1 B48709 [0,1,0,0,0,0|2,0,1]=4 456 B10R1.1 O=CCC1=CC=C(Cl)C=C1 C48725 [0,1,0,0,0,0|2,0,1]=4 457 B10R1.1 OC1=CC=C(CCBr)C=C1 B49426 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.1 OCCC1=CC=C(Br)C=C1 B36776 [0,1,0,0,0,0|2,0,0]=3 459 B10R1.1 OCCC1=CC=C(Cl)C=C1 C39522 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.1 OCCC1=CC=C(F)C=C1 F49459 [0,1,0,0,0,0|2,0,0]=3 461 B10R1.1 OCCC1=CC=C(I)C=C1 K49469 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.1 OCCC1=CN=C(Cl)C=C1 C37718 [0,1,0,0,0,0|1,0,0]=2 463 B10R1.1 OCCC1=NC=C(Br)C=C1 B7705 [0,1,0,0,0,0|3,0,0]=4 464 B10R1.1 [Mg+]CCC1=CC=C(Cl)C=C1 C31726 [0,1,0,0,0,0|2,0,0]=3 465 B10R1.3 BrCC1=CC=C(CBr)C=C1 B48752 [0,1,0,0,0,0|2,0,0]=3 466 B10R1.3 C#CC1=CC=C(CC)C=C1 E52271 [0,1,0,0,0,0|1,0,1]=3 467 B10R1.3 C#CC1=CC=C(CN)C=C1 E38189 [0,1,0,0,0,0|1,0,2]=4 468 B10R1.3 C#CC1=CC=C(CO)C=C1 E51546 [0,1,0,0,0,0|1,0,2]=4 469 B10R1.3 C#CC1=CC=C(OC)C=C1 E51542 [0,1,0,0,0,0|1,0,2]=4 470 B10R1.3 C#CC1=CN=C(OC)C=C1 E0638 [0,1,0,0,0,0|0,0,2]=3 471 B10R1.3 C=CC1=CC=C(CO)C=C1 V32337 [0,1,0,0,0,0|1,0,2]=4 472 B10R1.3 C=CC1=CC=C(OC)C=C1 M68575 [0,1,0,0,0,0|1,0,2]=4 473 B10R1.3 CCC1=CC=C(NN)C=C1 E49533 [0,1,0,0,0,0|2,0,0]=3 474 B10R1.3 CCC1=CC=C(OC)C=C1 E50270 [0,1,0,0,0,0|1,0,0]=2 475 B10R1.3 CCC1=CN=C(C=O)C=C1 E49257 [0,1,0,0,0,0|0,0,1]=2 476 B10R1.3 CNC1=CC=C(C#N)C=C1 M67463 [0,1,0,0,0,0|2,0,1]=4 477 B10R1.3 CNC1=CN=C(C#N)C=C1 M45724 [0,1,0,0,0,0|1,0,1]=3 478 B10R1.3 CNC1=NC=C(C#N)C=C1 M45725 [0,1,0,0,0,0|1,0,1]=3 479 B10R1.3 COC1=CC=C(C#N)C=C1 M68579 [0,1,0,0,0,0|2,0,1]=4 480 B10R1.3 COC1=CC=C(CN)C=C1 M4627 [0,1,0,0,0,0|2,0,0]=3 481 B10R1.3 COC1=CC=C(CO)C=C1 M68895 [0,1,0,0,0,0|2,0,0]=3 482 B10R1.3 COC1=CC=C(NN)C=C1 M46462 [0,1,0,0,0,0|3,0,0]=4 483 B10R1.3 COC1=CC=C(OC)C=C1 D68896 [0,1,0,0,0,0|2,0,0]=3 484 B10R1.3 COC1=CN=C(C#N)C=C1 M5547 [0,1,0,0,0,0|1,0,1]=3 485 B10R1.3 COC1=CN=C(C#N)N=C1 M12138 [0,1,0,0,0,0|2,0,1]=4 486 B10R1.3 COC1=CN=C(C=O)C=C1 M15225 [0,1,0,0,0,0|1,0,1]=3 487 B10R1.3 COC1=CN=C(C=O)N=C1 M12145 [0,1,0,0,0,0|2,0,1]=4 488 B10R1.3 COC1=CN=C(CCl)C=C1 C15224 [0,1,0,0,0,0|1,0,0]=2 489 B10R1.3 COC1=CN=C(CCl)N=C1 C19967 [0,1,0,0,0,0|2,0,0]=3 490 B10R1.3 COC1=CN=C(CO)C=C1 H15223 [0,1,0,0,0,0|1,0,0]=2 491 B10R1.3 COC1=CN=C(OC)C=C1 D46391 [0,1,0,0,0,0|1,0,0]=2 492 B10R1.3 COC1=NC=C(C#N)C=C1 M9551 [0,1,0,0,0,0|1,0,1]=3 493 B10R1.3 COC1=NC=C(C=O)C=C1 M31008 [0,1,0,0,0,0|1,0,1]=3 494 B10R1.3 COC1=NC=C(C=O)C=N1 M42777 [0,1,0,0,0,0|2,0,1]=4 495 B10R1.3 COC1=NC=C(CBr)C=C1 B37014 [0,1,0,0,0,0|1,0,0]=2 496 B10R1.3 COC1=NC=C(CCl)C=C1 C46199 [0,1,0,0,0,0|1,0,0]=2 497 B10R1.3 COC1=NC=C(CN)C=C1 A10463 [0,1,0,0,0,0|1,0,0]=2 498 B10R1.3 COC1=NC=C(CN)C=C1 M29962 [0,1,0,0,0,0|1,0,0]=2 499 B10R1.3 COC1=NC=C(CN)C=C1 M46593 [0,1,0,0,0,0|1,0,0]=2 500 B10R1.3 COC1=NC=C(CN)C=N1 M26757 [0,1,0,0,0,0|2,0,0]=3 501 B10R1.3 COC1=NC=C(CO)C=C1 M0584 [0,1,0,0,0,0|1,0,0]=2 502 B10R1.3 COC1=NC=C(CO)C=N1 M16831 [0,1,0,0,0,0|2,0,0]=3 503 B10R1.3 COC1=NC=C(CO)N=C1 M61572 [0,1,0,0,0,0|2,0,0]=3 504 B10R1.3 COC1=NC=C(NN)C=C1 H43550 [0,1,0,0,0,0|2,0,0]=3 505 B10R1.3 CSC1=CC=C(C=O)C=C1 M49157 [0,1,0,0,0,0|2,0,1]=4 506 B10R1.3 CSC1=NC=C(C#N)C=N1 M42495 [0,1,0,0,0,0|2,0,1]=4 507 B10R1.3 CSC1=NC=C(C=O)C=N1 M14446 [0,1,0,0,0,0|2,0,1]=4 508 B10R1.3 CSC1=NC=C(CO)C=N1 M36801 [0,1,0,0,0,0|2,0,0]=3 509 B10R1.3 N#CC1=CC=C(CBr)C=C1 C47942 [0,1,0,0,0,0|2,0,1]=4 510 B10R1.3 N#CC1=CC=C(CCl)C=C1 C47959 [0,1,0,0,0,0|2,0,1]=4 511 B10R1.3 N#CC1=CC=C(CN)C=C1 A37021 [0,1,0,0,0,0|2,0,1]=4 512 B10R1.3 N#CC1=CC=C(CN)C=C1 A49611 [0,1,0,0,0,0|2,0,1]=4 513 B10R1.3 N#CC1=CC=C(CO)C=C1 H48443 [0,1,0,0,0,0|2,0,1]=4 514 B10R1.3 N#CC1=CN=C(C#N)C=C1 P44082 [0,1,0,0,0,0|1,0,2]=4 515 B10R1.3 N#CC1=CN=C(C=O)C=C1 F22261 [0,1,0,0,0,0|1,0,2]=4 516 B10R1.3 N#CC1=CN=C(CBr)C=C1 B44748 [0,1,0,0,0,0|1,0,1]=3 517 B10R1.3 N#CC1=CN=C(CCl)C=C1 C25620 [0,1,0,0,0,0|1,0,1]=3 518 B10R1.3 N#CC1=CN=C(CO)C=C1 H45222 [0,1,0,0,0,0|1,0,1]=3 519 B10R1.3 N#CC1=CN=C(NN)C=C1 H63587 [0,1,0,0,0,0|2,0,1]=4 520 B10R1.3 N#CC1=NC=C(C=O)C=C1 F18629 [0,1,0,0,0,0|1,0,2]=4 521 B10R1.3 N#CC1=NC=C(CBr)C=C1 B44747 [0,1,0,0,0,0|1,0,1]=3 522 B10R1.3 N#CC1=NC=C(CCl)C=C1 C44785 [0,1,0,0,0,0|1,0,1]=3 523 B10R1.3 N#CC1=NC=C(CO)C=C1 H24396 [0,1,0,0,0,0|1,0,1]=3 524 B10R1.3 NCC1=CC=C(CN)C=C1 P46958 [0,1,0,0,0,0|2,0,0]=3 525 B10R1.3 NCC1=CC=C(CO)C=C1 A37992 [0,1,0,0,0,0|2,0,0]=3 526 B10R1.3 O=CC1=CC=C(CBr)C=C1 B24021 [0,1,0,0,0,0|2,0,1]=4 527 B10R1.3 O=CC1=CC=C(CCl)C=C1 C38746 [0,1,0,0,0,0|2,0,1]=4 528 B10R1.3 O=CC1=CC=C(CO)C=C1 H49069 [0,1,0,0,0,0|2,0,1]=4 529 B10R1.3 OCC1=CC=C(CBr)C=C1 B38754 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.3 OCC1=CC=C(CCl)C=C1 C49451 [0,1,0,0,0,0|2,0,0]=3 531 B10R1.3 OCC1=CC=C(CO)C=C1 B68897 [0,1,0,0,0,0|2,0,0]=3 532 B10R1.13 C=C(C)C1=CC=C(F)C=C1 F51670 [0,1,0,0,0,0|2,0,1]=4 533 B10R1.13 C=C(C)C1=CC=C(O)C=C1 P49877 [0,1,0,0,0,0|2,0,1]=4 534 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [0,1,0,0,0,0|1,0,1]=3 535 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C68865 [0,1,0,0,0,0|2,0,1]=4 536 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.13 CC(=O)C1=CC=C(I)C=C1 K39500 [0,1,0,0,0,0|2,0,1]=4 538 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A68181 [0,1,0,0,0,0|2,0,1]=4 539 B10R1.13 CC(=O)C1=CC=C(O)C=C1 H64899 [0,1,0,0,0,0|2,0,1]=4 540 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B3106 [0,1,0,0,0,0|1,0,1]=3 541 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [0,1,0,0,0,0|0,0,1]=2 542 B10R1.13 CC(=O)C1=CN=C(C)N=C1 M13671 [0,1,0,0,0,0|1,0,1]=3 543 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 A24257 [0,1,0,0,0,0|1,0,1]=3 544 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 C16565 [0,1,0,0,0,0|2,0,1]=4 545 B10R1.13 CC(=O)C1=CN=C(F)C=C1 F45498 [0,1,0,0,0,0|1,0,1]=3 546 B10R1.13 CC(=O)C1=CN=C(N)C=C1 A22139 [0,1,0,0,0,0|1,0,1]=3 547 B10R1.13 CC(=O)C1=CN=C(N)N=C1 A43099 [0,1,0,0,0,0|2,0,1]=4 548 B10R1.13 CC(=O)C1=CNC(=O)C=C1 A67563 [0,1,0,0,0,0|1,0,2]=4 549 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [0,1,0,0,0,0|2,0,1]=4 550 B10R1.13 CC(=O)C1=NC=C(O)N=C1 H42776 [0,1,0,0,0,0|2,0,1]=4 551 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 A15077 [0,1,0,0,0,0|2,0,1]=4 552 B10R1.13 CC(C)C1=CC=C(Br)C=C1 B49963 [0,1,0,0,0,0|2,0,0]=3 553 B10R1.13 CC(C)C1=CC=C(N)C=C1 P69319 [0,1,0,0,0,0|2,0,0]=3 554 B10R1.13 CC(C)C1=CC=C(O)C=C1 P60863 [0,1,0,0,0,0|2,0,0]=3 555 B10R1.13 CC(C)C1=CC=C([Mg+])C=C1 P31759 [0,1,0,0,0,0|2,0,0]=3 556 B10R1.13 CC(C)C1=CN=C(Br)C=C1 B46728 [0,1,0,0,0,0|1,0,0]=2 557 B10R1.13 CC(C)C1=CN=C(N)C=C1 P24474 [0,1,0,0,0,0|1,0,0]=2 558 B10R1.13 CC(C)C1=NC=C(Br)C=C1 B32058 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.13 CC(C)C1=NC=C(N)C=C1 A12160 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.13 CC1=CC=C(B(O)O)C=C1 T5215 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M38078 [0,1,0,0,0,0|2,0,1]=4 562 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [0,1,0,0,0,0|2,0,1]=4 563 B10R1.13 CC1=CC=C(C(C)C)C=C1 D60786 [0,1,0,0,0,0|1,0,0]=2 564 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [0,1,0,0,0,0|2,0,1]=4 565 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T52161 [0,1,0,0,0,0|1,0,0]=2 566 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T60511 [0,1,0,0,0,0|1,0,0]=2 567 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 T50271 [0,1,0,0,0,0|1,0,0]=2 568 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 S38423 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [0,1,0,0,0,0|2,0,0]=3 570 B10R1.13 CC1=CC=C([S@](N)=O)C=C1 M36646 [0,1,0,0,0,0|3,0,0]=4 571 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M4677 [0,1,0,0,0,0|2,0,1]=4 572 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 M49667 [0,1,0,0,0,0|2,0,0]=3 573 B10R1.13 CC1=NC=C(B(O)O)C=C1 M24773 [0,1,0,0,0,0|2,0,0]=3 574 B10R1.13 CC1=NC=C(B(O)O)C=N1 M14450 [0,1,0,0,0,0|3,0,0]=4 575 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [0,1,0,0,0,0|1,0,1]=3 576 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 H64312 [0,1,0,0,0,0|0,0,0]=1 577 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 M4745 [0,1,0,0,0,0|2,0,0]=3 578 B10R1.13 CC1=NC=C([N+](=O)[O-])C=N1 M13140 [0,1,0,0,0,0|3,0,0]=4 579 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 C46751 [0,1,0,0,0,0|3,0,0]=4 580 B10R1.13 CN(C)C1=CC=C(I)C=C1 K46770 [0,1,0,0,0,0|3,0,0]=4 581 B10R1.13 CN(C)C1=CC=C([Mg+])C=C1 D31762 [0,1,0,0,0,0|3,0,0]=4 582 B10R1.13 CN(C)C1=CN=C(Br)C=C1 B46285 [0,1,0,0,0,0|2,0,0]=3 583 B10R1.13 CN(C)C1=CN=C(Br)C=N1 B43265 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.13 CN(C)C1=CN=C(Cl)C=C1 C46302 [0,1,0,0,0,0|2,0,0]=3 585 B10R1.13 CN(C)C1=NN=C(Cl)C=C1 C43282 [0,1,0,0,0,0|3,0,0]=4 586 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 B38580 [0,1,0,0,0,0|2,0,0]=3 587 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 C64533 [0,1,0,0,0,0|2,0,0]=3 588 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F46766 [0,1,0,0,0,0|2,0,0]=3 589 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F49509 [0,1,0,0,0,0|2,0,0]=3 590 B10R1.13 C[C@@H](N)C1=CN=C(Br)C=C1 B63698 [0,1,0,0,0,0|1,0,0]=2 591 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 F46566 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 B49428 [0,1,0,0,0,0|2,0,0]=3 593 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 C49454 [0,1,0,0,0,0|2,0,0]=3 594 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 F49461 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.13 C[C@H](Br)C1=CC=C(F)C=C1 B36983 [0,1,0,0,0,0|2,0,0]=3 596 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46724 [0,1,0,0,0,0|2,0,0]=3 597 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46735 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B65383 [0,1,0,0,0,0|2,0,0]=3 599 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F36974 [0,1,0,0,0,0|2,0,0]=3 600 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F64415 [0,1,0,0,0,0|2,0,0]=3 601 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46768 [0,1,0,0,0,0|2,0,0]=3 602 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46771 [0,1,0,0,0,0|2,0,0]=3 603 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 A46957 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 B46292 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 B46296 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F0635 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F46612 [0,1,0,0,0,0|3,0,0]=4 608 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 B49431 [0,1,0,0,0,0|2,0,0]=3 609 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49442 [0,1,0,0,0,0|2,0,0]=3 610 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49449 [0,1,0,0,0,0|2,0,0]=3 611 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 F49463 [0,1,0,0,0,0|2,0,0]=3 612 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 H46826 [0,1,0,0,0,0|2,0,0]=3 613 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 B63199 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.13 FC(F)C1=CC=C(Cl)C=C1 C44732 [0,1,0,0,0,0|3,0,0]=4 615 B10R1.13 FC(F)C1=CC=C(I)C=C1 D44733 [0,1,0,0,0,0|3,0,0]=4 616 B10R1.13 FC(F)C1=NN=C(Cl)C=C1 C32186 [0,1,0,0,0,0|3,0,0]=4 617 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 C42810 [0,1,0,0,0,0|2,0,1]=4 618 B10R1.13 N=C(N)C1=CN=C(F)C=C1 F10578 [0,1,0,0,0,0|2,0,1]=4 619 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 B9626 [0,1,0,0,0,0|2,0,1]=4 620 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 C42457 [0,1,0,0,0,0|2,0,1]=4 621 B10R1.13 NC1=CC=C(C(F)F)C=C1 D46546 [0,1,0,0,0,0|3,0,0]=4 622 B10R1.13 NC1=NC=C(B(O)O)C=C1 A63168 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.13 NC1=NC=C(B(O)O)C=C1 A7476 [0,1,0,0,0,0|3,0,0]=4 624 B10R1.13 NC1=NC=C(C(=O)O)C=C1 A4758 [0,1,0,0,0,0|2,0,1]=4 625 B10R1.13 NC1=NC=C([N+](=O)[O-])C=C1 N68892 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 C42006 [0,1,0,0,0,0|2,0,1]=4 627 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 B4499 [0,1,0,0,0,0|2,0,1]=4 628 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 C24114 [0,1,0,0,0,0|2,0,1]=4 629 B10R1.13 O=C(O)C1=CN=C(F)C=C1 F2849 [0,1,0,0,0,0|2,0,1]=4 630 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 B7412 [0,1,0,0,0,0|3,0,0]=4 631 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 C1099 [0,1,0,0,0,0|3,0,0]=4 632 B10R1.13 O=[N+]([O-])C1=CN=C(F)C=C1 F40584 [0,1,0,0,0,0|3,0,0]=4 633 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 H68889 [0,1,0,0,0,0|3,0,0]=4 634 B10R1.13 OB(O)C1=CN=C(Br)C=C1 B1950 [0,1,0,0,0,0|3,0,0]=4 635 B10R1.13 OB(O)C1=CN=C(Cl)C=C1 C2288 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.13 OB(O)C1=CN=C(F)C=C1 F3388 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.13 OB(O)C1=CN=C(O)C=C1 H26341 [0,1,0,0,0,0|3,0,0]=4 638 B10R1.25 BrCC1=C(I)C=C(Br)C=C1 B44700 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.25 CC1=C(C#N)C=CC(Br)=N1 B44757 [0,1,0,0,0,0|2,0,1]=4 640 B10R1.25 CC1=C(C#N)C=CC(Cl)=N1 C69365 [0,1,0,0,0,0|2,0,1]=4 641 B10R1.25 CC1=C(C=O)C=CC(Cl)=N1 C45486 [0,1,0,0,0,0|2,0,1]=4 642 B10R1.25 CC1=C(C=O)C=CC(F)=N1 F45499 [0,1,0,0,0,0|2,0,1]=4 643 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 B48758 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.25 CC1=C(CF)C=CC(Br)=C1 B48770 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.25 CC1=C(CN)C=CC(Br)=C1 B46736 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.25 CC1=C(CN)C=CC(Br)=C1 B46744 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.25 CC1=C(CO)C=CC(Br)=C1 B61046 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.25 CC1=C(CO)C=CC(F)=N1 F46222 [0,1,0,0,0,0|2,0,0]=3 649 B10R1.25 CC1=C(CO)C=CC(N)=C1 A39080 [0,1,0,0,0,0|3,0,0]=4 650 B10R1.25 CC1=CC(Br)=C(C#N)C=C1 B47945 [0,1,0,0,0,0|2,0,1]=4 651 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 B48711 [0,1,0,0,0,0|2,0,1]=4 652 B10R1.25 CC1=CC(Br)=NC=C1C#N B44736 [0,1,0,0,0,0|2,0,1]=4 653 B10R1.25 CC1=CC(Br)=NC=C1C=O B45475 [0,1,0,0,0,0|2,0,1]=4 654 B10R1.25 CC1=CC(C)=C(C=O)C=C1 D49874 [0,1,0,0,0,0|2,0,1]=4 655 B10R1.25 CC1=CC(C)=C(C=O)C=N1 D49261 [0,1,0,0,0,0|1,0,1]=3 656 B10R1.25 CC1=CC(C)=C(CBr)C=C1 B49966 [0,1,0,0,0,0|2,0,0]=3 657 B10R1.25 CC1=CC(C)=C(CO)C=C1 D50273 [0,1,0,0,0,0|2,0,0]=3 658 B10R1.25 CC1=CC(C)=C(NN)C=C1 D49534 [0,1,0,0,0,0|3,0,0]=4 659 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 C47960 [0,1,0,0,0,0|2,0,1]=4 660 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 C48726 [0,1,0,0,0,0|2,0,1]=4 661 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 C46753 [0,1,0,0,0,0|2,0,0]=3 662 B10R1.25 CC1=CC(Cl)=NC=C1C#N C13568 [0,1,0,0,0,0|2,0,1]=4 663 B10R1.25 CC1=CC(Cl)=NC=C1C=O C45487 [0,1,0,0,0,0|2,0,1]=4 664 B10R1.25 CC1=CC(F)=C(C#N)C=C1 F47972 [0,1,0,0,0,0|2,0,1]=4 665 B10R1.25 CC1=CC(F)=C(C=O)C=C1 F48737 [0,1,0,0,0,0|2,0,1]=4 666 B10R1.25 CC1=CC(N)=C(C#N)C=C1 A48781 [0,1,0,0,0,0|2,0,1]=4 667 B10R1.25 CC1=CC(N)=C(CO)C=C1 A46913 [0,1,0,0,0,0|2,0,0]=3 668 B10R1.25 CC1=CC(N)=C(CO)C=N1 A43644 [0,1,0,0,0,0|1,0,0]=2 669 B10R1.25 CC1=CC(O)=C(C#N)C=C1 H48444 [0,1,0,0,0,0|2,0,1]=4 670 B10R1.25 CC1=CC(O)=C(C=O)C=C1 H38560 [0,1,0,0,0,0|2,0,1]=4 671 B10R1.25 CC1=CC(O)=NC=C1C#N H45225 [0,1,0,0,0,0|2,0,1]=4 672 B10R1.25 CC1=CC=C(C#N)C(=O)N1 H14779 [0,1,0,0,0,0|1,0,2]=4 673 B10R1.25 CC1=CC=C(C#N)C(Br)=N1 B14778 [0,1,0,0,0,0|1,0,1]=3 674 B10R1.25 CC1=CC=C(C#N)C(Cl)=N1 C12889 [0,1,0,0,0,0|1,0,1]=3 675 B10R1.25 CC1=CC=C(C=O)C(Cl)=N1 C45484 [0,1,0,0,0,0|1,0,1]=3 676 B10R1.25 CC1=CC=C(CBr)C(Br)=N1 B45763 [0,1,0,0,0,0|1,0,0]=2 677 B10R1.25 CC1=CN=C(CCl)C(C)=C1 C38639 [0,1,0,0,0,0|3,0,0]=4 678 B10R1.25 CC1=CN=C(CO)C(C)=C1 D46914 [0,1,0,0,0,0|3,0,0]=4 679 B10R1.25 CC1=NC(=O)C(CO)=CN1 H43232 [0,1,0,0,0,0|2,0,0]=3 680 B10R1.25 CC1=NC(C)=C(CO)C=C1 D64003 [0,1,0,0,0,0|1,0,0]=2 681 B10R1.25 CC1=NC(N)=C(C#N)C=N1 A42834 [0,1,0,0,0,0|2,0,1]=4 682 B10R1.25 CC1=NC(N)=C(CO)C=N1 A67768 [0,1,0,0,0,0|2,0,0]=3 683 B10R1.25 CC1=NC=C(C#N)C(Cl)=N1 C42162 [0,1,0,0,0,0|2,0,1]=4 684 B10R1.25 CC1=NC=C(C#N)C(O)=N1 H42481 [0,1,0,0,0,0|2,0,1]=4 685 B10R1.25 CC1=NC=C(CN)C(N)=N1 A61754 [0,1,0,0,0,0|2,0,0]=3 686 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 C46746 [0,1,0,0,0,0|2,0,0]=3 687 B10R1.25 CCC1=C(Cl)N=C(Cl)N=C1 D38805 [0,1,0,0,0,0|2,0,0]=3 688 B10R1.25 CCC1=C(F)C=C(O)C=C1 E65621 [0,1,0,0,0,0|2,0,0]=3 689 B10R1.25 CCC1=C(N)C=C(Br)C=C1 B46721 [0,1,0,0,0,0|2,0,0]=3 690 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C46745 [0,1,0,0,0,0|2,0,0]=3 691 B10R1.25 CCC1=CNC(=O)NC1=O E38526 [0,1,0,0,0,0|2,0,1]=4 692 B10R1.25 CCC1=NC=C(Br)C=C1N A11260 [0,1,0,0,0,0|3,0,0]=4 693 B10R1.25 CCC1=NC=C(Cl)N=C1Cl D42741 [0,1,0,0,0,0|2,0,0]=3 694 B10R1.25 CCN1C=CC(Br)=CC1=O B15236 [0,1,0,0,0,0|3,0,0]=4 695 B10R1.25 CCN1C=CC(N)=CC1=O A27174 [0,1,0,0,0,0|3,0,0]=4 696 B10R1.25 CCN1C=CC(N)=CC1=O A7787 [0,1,0,0,0,0|3,0,0]=4 697 B10R1.25 CNC1=C(Br)C=C(C)C=C1 B46730 [0,1,0,0,0,0|2,0,0]=3 698 B10R1.25 CNC1=C(N)C=C(Br)C=C1 B46287 [0,1,0,0,0,0|3,0,0]=4 699 B10R1.25 CNC1=C(N)C=C(Cl)C=C1 C46303 [0,1,0,0,0,0|3,0,0]=4 700 B10R1.25 CNC1=NN=C(Cl)C=C1N C41161 [0,1,0,0,0,0|3,0,0]=4 701 B10R1.25 COC1=C(Br)C=C(C)C=N1 B46168 [0,1,0,0,0,0|3,0,0]=4 702 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 B39392 [0,1,0,0,0,0|3,0,0]=4 703 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 B42645 [0,1,0,0,0,0|2,0,0]=3 704 B10R1.25 COC1=C(Br)C=C(F)C=C1 B39393 [0,1,0,0,0,0|3,0,0]=4 705 B10R1.25 COC1=C(Br)C=C(F)N=C1 B37314 [0,1,0,0,0,0|2,0,0]=3 706 B10R1.25 COC1=C(Br)C=C(I)C=C1 B45584 [0,1,0,0,0,0|3,0,0]=4 707 B10R1.25 COC1=C(Br)C=C(N)C=C1 B46154 [0,1,0,0,0,0|3,0,0]=4 708 B10R1.25 COC1=C(Br)C=C(O)C=C1 B45899 [0,1,0,0,0,0|3,0,0]=4 709 B10R1.25 COC1=C(Br)N=C(I)C=C1 B36842 [0,1,0,0,0,0|2,0,0]=3 710 B10R1.25 COC1=C(C)C=C(Br)C=C1 B49440 [0,1,0,0,0,0|3,0,0]=4 711 B10R1.25 COC1=C(C)C=C(C)C=C1 D50266 [0,1,0,0,0,0|2,0,0]=3 712 B10R1.25 COC1=C(C)C=C(F)C=C1 F49467 [0,1,0,0,0,0|3,0,0]=4 713 B10R1.25 COC1=C(C)C=C(I)C=C1 K49474 [0,1,0,0,0,0|3,0,0]=4 714 B10R1.25 COC1=C(C)C=C(N)C=C1 M46909 [0,1,0,0,0,0|3,0,0]=4 715 B10R1.25 COC1=C(C)C=C(O)C=C1 M38275 [0,1,0,0,0,0|3,0,0]=4 716 B10R1.25 COC1=C(C)C=C([Mg+])C=C1 M31769 [0,1,0,0,0,0|3,0,0]=4 717 B10R1.25 COC1=C(C)N=C(Br)C=C1 B46175 [0,1,0,0,0,0|2,0,0]=3 718 B10R1.25 COC1=C(C)N=C(Cl)N=C1 C43074 [0,1,0,0,0,0|3,0,0]=4 719 B10R1.25 COC1=C(Cl)C=C(Br)C=C1 B45564 [0,1,0,0,0,0|3,0,0]=4 720 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C46202 [0,1,0,0,0,0|3,0,0]=4 721 B10R1.25 COC1=C(Cl)C=C(N)N=C1 C10605 [0,1,0,0,0,0|2,0,0]=3 722 B10R1.25 COC1=C(Cl)N=C(Cl)N=C1 D40771 [0,1,0,0,0,0|3,0,0]=4 723 B10R1.25 COC1=C(F)C=C(Br)C=C1 B13752 [0,1,0,0,0,0|3,0,0]=4 724 B10R1.25 COC1=C(F)C=C(I)C=C1 F45610 [0,1,0,0,0,0|3,0,0]=4 725 B10R1.25 COC1=C(F)C=C(N)C=C1 F38501 [0,1,0,0,0,0|3,0,0]=4 726 B10R1.25 COC1=C(F)C=C(O)C=C1 F23734 [0,1,0,0,0,0|3,0,0]=4 727 B10R1.25 COC1=C(F)C=C([Mg+])C=C1 F31773 [0,1,0,0,0,0|3,0,0]=4 728 B10R1.25 COC1=C(I)C=C(Br)C=C1 B38589 [0,1,0,0,0,0|3,0,0]=4 729 B10R1.25 COC1=C(I)C=C(C)C=C1 K62337 [0,1,0,0,0,0|2,0,0]=3 730 B10R1.25 COC1=C(I)C=C(Cl)C=C1 C45602 [0,1,0,0,0,0|3,0,0]=4 731 B10R1.25 COC1=C(I)C=C(Cl)N=N1 C40778 [0,1,0,0,0,0|3,0,0]=4 732 B10R1.25 COC1=C(I)C=C(N)C=C1 K46229 [0,1,0,0,0,0|3,0,0]=4 733 B10R1.25 COC1=C(I)C=C(N)C=C1 K46231 [0,1,0,0,0,0|3,0,0]=4 734 B10R1.25 COC1=C(N)C=C(Br)C=C1 B46157 [0,1,0,0,0,0|3,0,0]=4 735 B10R1.25 COC1=C(N)C=C(F)C=C1 F46211 [0,1,0,0,0,0|3,0,0]=4 736 B10R1.25 COC1=C(N)C=C(I)C=C1 A46224 [0,1,0,0,0,0|3,0,0]=4 737 B10R1.25 COC1=C(N)N=C(Br)C=C1 B36893 [0,1,0,0,0,0|2,0,0]=3 738 B10R1.25 COC1=C(N)N=C(Cl)N=C1 C27017 [0,1,0,0,0,0|3,0,0]=4 739 B10R1.25 COC1=C(N)N=C(F)C=C1 F43084 [0,1,0,0,0,0|2,0,0]=3 740 B10R1.25 COC1=C(O)C=C(Br)C=C1 B37821 [0,1,0,0,0,0|3,0,0]=4 741 B10R1.25 COC1=C(O)C=C(F)C=C1 F45919 [0,1,0,0,0,0|3,0,0]=4 742 B10R1.25 COC1=C(O)C=C(N)C=C1 A46397 [0,1,0,0,0,0|3,0,0]=4 743 B10R1.25 COC1=C(O)C=C(O)C=C1 M61053 [0,1,0,0,0,0|3,0,0]=4 744 B10R1.25 COC1=C(O)N=C(O)N=C1 D41043 [0,1,0,0,0,0|3,0,0]=4 745 B10R1.25 COC1=C([Mg+])C=C(C)C=C1 M31765 [0,1,0,0,0,0|2,0,0]=3 746 B10R1.25 COC1=C([Mg+])C=C(Cl)C=C1 C31793 [0,1,0,0,0,0|3,0,0]=4 747 B10R1.25 COC1=C([Mg+])C=C(F)C=C1 F31774 [0,1,0,0,0,0|3,0,0]=4 748 B10R1.25 COC1=CC=C(Br)N=C1Br D42631 [0,1,0,0,0,0|2,0,0]=3 749 B10R1.25 COC1=CC=C(C)N=C1Br B3731 [0,1,0,0,0,0|1,0,0]=2 750 B10R1.25 COC1=CC=C(C)N=C1Cl C46200 [0,1,0,0,0,0|1,0,0]=2 751 B10R1.25 COC1=CC=C(Cl)N=C1Br B42641 [0,1,0,0,0,0|2,0,0]=3 752 B10R1.25 COC1=CC=C(N)N=C1Cl C10744 [0,1,0,0,0,0|2,0,0]=3 753 B10R1.25 COC1=CN=C(Br)C=C1N B62821 [0,1,0,0,0,0|2,0,0]=3 754 B10R1.25 COC1=CN=C(Cl)C=C1N C43069 [0,1,0,0,0,0|2,0,0]=3 755 B10R1.25 COC1=CNC(N)=NC1=O A41147 [0,1,0,0,0,0|3,0,0]=4 756 B10R1.25 COC1=NN=C(Cl)C=C1C C43076 [0,1,0,0,0,0|3,0,0]=4 757 B10R1.25 CSC1=C(Cl)N=C(Cl)N=C1 D15617 [0,1,0,0,0,0|3,0,0]=4 758 B10R1.25 CSC1=NC=C(Cl)N=C1Cl D20240 [0,1,0,0,0,0|3,0,0]=4 759 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 B44691 [0,1,0,0,0,0|3,0,0]=4 760 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 B38059 [0,1,0,0,0,0|3,0,0]=4 761 B10R1.25 ClC1=NC(Cl)=C(CI)C=N1 D63457 [0,1,0,0,0,0|3,0,0]=4 762 B10R1.25 ClCC1=CN=C(Cl)C=C1Cl D42231 [0,1,0,0,0,0|2,0,0]=3 763 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 B39350 [0,1,0,0,0,0|3,0,0]=4 764 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 B44692 [0,1,0,0,0,0|3,0,0]=4 765 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 B44714 [0,1,0,0,0,0|3,0,0]=4 766 B10R1.25 FC1=CC(F)=C(CBr)C=C1 B44724 [0,1,0,0,0,0|3,0,0]=4 767 B10R1.25 N#CC1=C(I)C=C(Br)N=C1 B41675 [0,1,0,0,0,0|2,0,1]=4 768 B10R1.25 N#CC1=C(I)C=C(Cl)N=C1 C14512 [0,1,0,0,0,0|2,0,1]=4 769 B10R1.25 N#CC1=C(N)N=C(Cl)C=C1 A42155 [0,1,0,0,0,0|2,0,1]=4 770 B10R1.25 N#CC1=CC=C(Cl)N=C1Br B41669 [0,1,0,0,0,0|2,0,1]=4 771 B10R1.25 N#CC1=CC=C(Cl)N=C1Cl D23534 [0,1,0,0,0,0|2,0,1]=4 772 B10R1.25 N#CC1=CC=C(N)N=C1Cl A38309 [0,1,0,0,0,0|2,0,1]=4 773 B10R1.25 N#CC1=CN=C(Cl)C=C1Cl D21697 [0,1,0,0,0,0|2,0,1]=4 774 B10R1.25 N#CC1=CN=C(F)C=C1F D41687 [0,1,0,0,0,0|2,0,1]=4 775 B10R1.25 NC1=C(CO)C=CC(Br)=C1 A46164 [0,1,0,0,0,0|3,0,0]=4 776 B10R1.25 NC1=C(CO)C=CC(Cl)=C1 A46195 [0,1,0,0,0,0|3,0,0]=4 777 B10R1.25 NC1=C(CO)C=NC(Cl)=N1 A41093 [0,1,0,0,0,0|3,0,0]=4 778 B10R1.25 NC1=CC(Cl)=NC=C1C=O A15911 [0,1,0,0,0,0|2,0,1]=4 779 B10R1.25 NC1=CC(Cl)=NC=C1CO A25618 [0,1,0,0,0,0|2,0,0]=3 780 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 B45767 [0,1,0,0,0,0|3,0,0]=4 781 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 D45792 [0,1,0,0,0,0|3,0,0]=4 782 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 C68851 [0,1,0,0,0,0|3,0,0]=4 783 B10R1.25 NCC1=C(F)C=C(Br)C=C1 B45781 [0,1,0,0,0,0|3,0,0]=4 784 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 C63109 [0,1,0,0,0,0|3,0,0]=4 785 B10R1.25 NCC1=C(F)C=C(F)C=C1 D38872 [0,1,0,0,0,0|3,0,0]=4 786 B10R1.25 NCC1=C(O)C=C(Br)C=C1 A46159 [0,1,0,0,0,0|3,0,0]=4 787 B10R1.25 NCC1=NC=C(Cl)N=C1Cl D62358 [0,1,0,0,0,0|3,0,0]=4 788 B10R1.25 O=CC1=C(Br)C=C(Cl)N=C1 B41994 [0,1,0,0,0,0|2,0,1]=4 789 B10R1.25 O=CC1=C(Cl)C=C(F)N=C1 C42014 [0,1,0,0,0,0|2,0,1]=4 790 B10R1.25 O=CC1=CC=C(Br)N=C1Br D7611 [0,1,0,0,0,0|2,0,1]=4 791 B10R1.25 O=CC1=CC=C(Cl)N=C1Br B36994 [0,1,0,0,0,0|2,0,1]=4 792 B10R1.25 O=CC1=CC=C(Cl)N=C1Cl D4988 [0,1,0,0,0,0|2,0,1]=4 793 B10R1.25 O=CC1=CN=C(Br)C=C1Br D37426 [0,1,0,0,0,0|2,0,1]=4 794 B10R1.25 O=CC1=CN=C(Br)C=C1Cl B41995 [0,1,0,0,0,0|2,0,1]=4 795 B10R1.25 O=CC1=CN=C(Cl)C=C1Cl D12930 [0,1,0,0,0,0|2,0,1]=4 796 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 D45544 [0,1,0,0,0,0|3,0,0]=4 797 B10R1.25 OCC1=C(Br)C=C(F)C=C1 B45567 [0,1,0,0,0,0|3,0,0]=4 798 B10R1.25 OCC1=C(Br)C=C(O)C=C1 B45904 [0,1,0,0,0,0|3,0,0]=4 799 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 D63315 [0,1,0,0,0,0|3,0,0]=4 800 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 C45594 [0,1,0,0,0,0|3,0,0]=4 801 B10R1.25 OCC1=C(F)C=C(Br)C=C1 B61349 [0,1,0,0,0,0|3,0,0]=4 802 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 C45596 [0,1,0,0,0,0|3,0,0]=4 803 B10R1.25 OCC1=C(F)C=C(F)C=C1 D45607 [0,1,0,0,0,0|3,0,0]=4 804 B10R1.25 OCC1=C(F)C=C(O)C=C1 F38990 [0,1,0,0,0,0|3,0,0]=4 805 B10R1.25 OCC1=C(O)C=C(Br)C=C1 B38232 [0,1,0,0,0,0|3,0,0]=4 806 B10R1.25 OCC1=CC=C(Br)N=C1Br D42635 [0,1,0,0,0,0|2,0,0]=3 807 B10R1.25 OCC1=CC=C(Cl)N=C1Cl D0718 [0,1,0,0,0,0|2,0,0]=3 808 B10R1.25 OCC1=CN=C(Cl)C=C1Cl D42662 [0,1,0,0,0,0|2,0,0]=3 809 B10R1.176 BrCC1=CC(Br)=C(Br)C=C1 D44703 [0,1,0,0,0,0|3,0,0]=4 810 B10R1.176 CC1=C(Br)C=C(C#N)C=C1 B39465 [0,1,0,0,0,0|2,0,1]=4 811 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 B48714 [0,1,0,0,0,0|2,0,1]=4 812 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 B38347 [0,1,0,0,0,0|2,0,0]=3 813 B10R1.176 CC1=C(Br)C=C(CO)C=C1 B49432 [0,1,0,0,0,0|2,0,0]=3 814 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 B48757 [0,1,0,0,0,0|3,0,0]=4 815 B10R1.176 CC1=C(Br)C=CC(CO)=C1 B49433 [0,1,0,0,0,0|3,0,0]=4 816 B10R1.176 CC1=C(C)C=C(C#N)C=C1 D51674 [0,1,0,0,0,0|2,0,1]=4 817 B10R1.176 CC1=C(C)C=C(CCl)C=C1 C49971 [0,1,0,0,0,0|2,0,0]=3 818 B10R1.176 CC1=C(C)C=C(CO)C=C1 D50275 [0,1,0,0,0,0|2,0,0]=3 819 B10R1.176 CC1=C(C)C=C(NN)C=C1 D39524 [0,1,0,0,0,0|3,0,0]=4 820 B10R1.176 CC1=C(Cl)C=C(C#N)C=C1 C47963 [0,1,0,0,0,0|2,0,1]=4 821 B10R1.176 CC1=C(Cl)C=C(C#N)C=N1 C63869 [0,1,0,0,0,0|1,0,1]=3 822 B10R1.176 CC1=C(Cl)C=C(C=O)C=C1 C48728 [0,1,0,0,0,0|2,0,1]=4 823 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 C46749 [0,1,0,0,0,0|2,0,0]=3 824 B10R1.176 CC1=C(F)C=C(C#N)C=C1 F47976 [0,1,0,0,0,0|2,0,1]=4 825 B10R1.176 CC1=C(F)C=C(CO)C=N1 F46223 [0,1,0,0,0,0|1,0,0]=2 826 B10R1.176 CC1=C(F)C=C(NN)C=C1 F46563 [0,1,0,0,0,0|3,0,0]=4 827 B10R1.176 CC1=C(F)C=CC(CN)=C1 F46767 [0,1,0,0,0,0|3,0,0]=4 828 B10R1.176 CC1=C(I)C=C(CO)C=C1 K63324 [0,1,0,0,0,0|2,0,0]=3 829 B10R1.176 CC1=C(N)C=C(C#N)C=C1 A38450 [0,1,0,0,0,0|2,0,1]=4 830 B10R1.176 CC1=C(O)C=C(C#N)C=C1 H48447 [0,1,0,0,0,0|2,0,1]=4 831 B10R1.176 CC1=C(O)C=C(C=O)C=C1 H67820 [0,1,0,0,0,0|2,0,1]=4 832 B10R1.176 CC1=C(O)C=CC(CO)=C1 H46832 [0,1,0,0,0,0|3,0,0]=4 833 B10R1.176 CC1=CC(C#N)=CN=C1Br B44735 [0,1,0,0,0,0|2,0,1]=4 834 B10R1.176 CC1=CC(C#N)=CN=C1C D48779 [0,1,0,0,0,0|1,0,1]=3 835 B10R1.176 CC1=CC(C#N)=CN=C1Cl C44768 [0,1,0,0,0,0|2,0,1]=4 836 B10R1.176 CC1=CC(C#N)=CN=C1F C4733 [0,1,0,0,0,0|2,0,1]=4 837 B10R1.176 CC1=CC(C#N)=CN=C1N A3637 [0,1,0,0,0,0|2,0,1]=4 838 B10R1.176 CC1=CC(C=O)=CN=C1Br B45476 [0,1,0,0,0,0|2,0,1]=4 839 B10R1.176 CC1=NC=C(C#N)C=C1N A45726 [0,1,0,0,0,0|1,0,1]=3 840 B10R1.176 CCC1=CC(Br)=C(O)C=C1 B49424 [0,1,0,0,0,0|2,0,0]=3 841 B10R1.176 CCC1=CC(C)=C(C)C=C1 E53022 [0,1,0,0,0,0|1,0,0]=2 842 B10R1.176 CCC1=CC(C)=C(I)C=C1 E49973 [0,1,0,0,0,0|2,0,0]=3 843 B10R1.176 CCC1=CC(F)=C(N)C=C1 E46758 [0,1,0,0,0,0|2,0,0]=3 844 B10R1.176 CCC1=CC(N)=C(N)C=C1 E49664 [0,1,0,0,0,0|2,0,0]=3 845 B10R1.176 CCC1=CC(O)=C(N)C=C1 A49521 [0,1,0,0,0,0|2,0,0]=3 846 B10R1.176 CCC1=NC(C)=C(C)N=C1 E46963 [0,1,0,0,0,0|1,0,0]=2 847 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 B45765 [0,1,0,0,0,0|3,0,0]=4 848 B10R1.176 CN1C=C(CN)C=CC1=O A12261 [0,1,0,0,0,0|2,0,1]=4 849 B10R1.176 CN1C=C(CN)C=CC1=O A31857 [0,1,0,0,0,0|2,0,1]=4 850 B10R1.176 CN1C=C(CO)C=CC1=O H7538 [0,1,0,0,0,0|2,0,1]=4 851 B10R1.176 CN1C=CC(CN)=CC1=O A10237 [0,1,0,0,0,0|3,0,0]=4 852 B10R1.176 CN1C=CC(CN)=CC1=O A7466 [0,1,0,0,0,0|3,0,0]=4 853 B10R1.176 CN1C=CC(CO)=CC1=O M7545 [0,1,0,0,0,0|3,0,0]=4 854 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 D45789 [0,1,0,0,0,0|3,0,0]=4 855 B10R1.176 COC1=CC(Br)=C(Br)C=C1 D45549 [0,1,0,0,0,0|3,0,0]=4 856 B10R1.176 COC1=CC(Br)=C(C)C=C1 B49439 [0,1,0,0,0,0|2,0,0]=3 857 B10R1.176 COC1=CC(Br)=C(C)C=N1 B37321 [0,1,0,0,0,0|3,0,0]=4 858 B10R1.176 COC1=CC(Br)=C(C)N=C1 B13456 [0,1,0,0,0,0|1,0,0]=2 859 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 B45563 [0,1,0,0,0,0|3,0,0]=4 860 B10R1.176 COC1=CC(Br)=C(F)C=C1 B45565 [0,1,0,0,0,0|3,0,0]=4 861 B10R1.176 COC1=CC(Br)=C(I)C=C1 B45583 [0,1,0,0,0,0|3,0,0]=4 862 B10R1.176 COC1=CC(Br)=C(N)C=C1 B38510 [0,1,0,0,0,0|3,0,0]=4 863 B10R1.176 COC1=CC(Br)=C(O)C=C1 B38008 [0,1,0,0,0,0|3,0,0]=4 864 B10R1.176 COC1=CC(C)=C(Br)C=C1 B49437 [0,1,0,0,0,0|3,0,0]=4 865 B10R1.176 COC1=CC(C)=C(F)C=C1 F49456 [0,1,0,0,0,0|3,0,0]=4 866 B10R1.176 COC1=CC(C)=C(O)C=C1 H38045 [0,1,0,0,0,0|3,0,0]=4 867 B10R1.176 COC1=CC(C)=C([Mg+])C=C1 M31768 [0,1,0,0,0,0|3,0,0]=4 868 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 B45553 [0,1,0,0,0,0|3,0,0]=4 869 B10R1.176 COC1=CC(Cl)=C(C)C=C1 C49453 [0,1,0,0,0,0|2,0,0]=3 870 B10R1.176 COC1=CC(Cl)=C(Cl)C=C1 D45585 [0,1,0,0,0,0|3,0,0]=4 871 B10R1.176 COC1=CC(Cl)=C(F)C=C1 C45600 [0,1,0,0,0,0|3,0,0]=4 872 B10R1.176 COC1=CC(Cl)=C(I)C=C1 C63668 [0,1,0,0,0,0|3,0,0]=4 873 B10R1.176 COC1=CC(Cl)=C(N)C=C1 C37946 [0,1,0,0,0,0|3,0,0]=4 874 B10R1.176 COC1=CC(Cl)=C(O)C=C1 C45910 [0,1,0,0,0,0|3,0,0]=4 875 B10R1.176 COC1=CC(F)=C(Br)C=C1 B45566 [0,1,0,0,0,0|3,0,0]=4 876 B10R1.176 COC1=CC(F)=C(C)C=C1 F49466 [0,1,0,0,0,0|2,0,0]=3 877 B10R1.176 COC1=CC(F)=C(Cl)C=C1 C45599 [0,1,0,0,0,0|3,0,0]=4 878 B10R1.176 COC1=CC(F)=C(F)C=C1 D65181 [0,1,0,0,0,0|3,0,0]=4 879 B10R1.176 COC1=CC(F)=C(N)C=C1 F38553 [0,1,0,0,0,0|3,0,0]=4 880 B10R1.176 COC1=CC(F)=C(N)N=C1 F43081 [0,1,0,0,0,0|2,0,0]=3 881 B10R1.176 COC1=CC(I)=C(Br)C=C1 B38541 [0,1,0,0,0,0|3,0,0]=4 882 B10R1.176 COC1=CC(I)=C(Cl)C=C1 C63030 [0,1,0,0,0,0|3,0,0]=4 883 B10R1.176 COC1=CC(I)=C(N)C=C1 K46228 [0,1,0,0,0,0|3,0,0]=4 884 B10R1.176 COC1=CC(N)=C(Br)C=C1 B46152 [0,1,0,0,0,0|3,0,0]=4 885 B10R1.176 COC1=CC(N)=C(C)C=C1 M46901 [0,1,0,0,0,0|2,0,0]=3 886 B10R1.176 COC1=CC(N)=C(Cl)C=C1 C46185 [0,1,0,0,0,0|3,0,0]=4 887 B10R1.176 COC1=CC(N)=C(F)C=C1 F36653 [0,1,0,0,0,0|3,0,0]=4 888 B10R1.176 COC1=CC(N)=C(I)C=C1 I5695 [0,1,0,0,0,0|3,0,0]=4 889 B10R1.176 COC1=CC(N)=C(N)C=C1 M43632 [0,1,0,0,0,0|3,0,0]=4 890 B10R1.176 COC1=CC(N)=C(N)C=C1 M46463 [0,1,0,0,0,0|3,0,0]=4 891 B10R1.176 COC1=CC(N)=C(O)C=C1 A46393 [0,1,0,0,0,0|3,0,0]=4 892 B10R1.176 COC1=CC(O)=C(Br)C=C1 B45898 [0,1,0,0,0,0|3,0,0]=4 893 B10R1.176 COC1=CC(O)=C(C)C=C1 M46827 [0,1,0,0,0,0|2,0,0]=3 894 B10R1.176 COC1=CC(O)=C(I)C=C1 K45922 [0,1,0,0,0,0|3,0,0]=4 895 B10R1.176 COC1=CC(O)=C(N)C=C1 A46394 [0,1,0,0,0,0|3,0,0]=4 896 B10R1.176 COC1=CC(O)=C(N)C=C1 A46576 [0,1,0,0,0,0|3,0,0]=4 897 B10R1.176 COC1=CN=C(Br)C(C)=N1 B43057 [0,1,0,0,0,0|3,0,0]=4 898 B10R1.176 COC1=CN=C(Br)C(N)=C1 B43053 [0,1,0,0,0,0|2,0,0]=3 899 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C46201 [0,1,0,0,0,0|2,0,0]=3 900 B10R1.176 COC1=CN=C(Cl)C(N)=C1 C25045 [0,1,0,0,0,0|2,0,0]=3 901 B10R1.176 COC1=CN=C(Cl)C(N)=N1 C18840 [0,1,0,0,0,0|3,0,0]=4 902 B10R1.176 COC1=NC(C)=C(N)N=C1 M43352 [0,1,0,0,0,0|3,0,0]=4 903 B10R1.176 COC1=NC=C(C)C(N)=C1 M43637 [0,1,0,0,0,0|3,0,0]=4 904 B10R1.176 CSC1=CN=C(Cl)C(Cl)=N1 P11188 [0,1,0,0,0,0|3,0,0]=4 905 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 D44705 [0,1,0,0,0,0|3,0,0]=4 906 B10R1.176 ClC1=C(I)C=C(CBr)C=N1 B42208 [0,1,0,0,0,0|2,0,0]=3 907 B10R1.176 FC1=C(Br)C=C(CBr)C=C1 B44699 [0,1,0,0,0,0|3,0,0]=4 908 B10R1.176 FC1=C(Br)C=C(CCl)C=N1 B42205 [0,1,0,0,0,0|2,0,0]=3 909 B10R1.176 FC1=C(Br)C=CC(CBr)=C1 B44697 [0,1,0,0,0,0|3,0,0]=4 910 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 B44717 [0,1,0,0,0,0|3,0,0]=4 911 B10R1.176 FC1=C(Cl)C=C(CCl)C=C1 C44729 [0,1,0,0,0,0|3,0,0]=4 912 B10R1.176 N#CC1=CC(Br)=C(Cl)N=C1 B25036 [0,1,0,0,0,0|2,0,1]=4 913 B10R1.176 N#CC1=CC(Br)=C(N)N=C1 A42145 [0,1,0,0,0,0|2,0,1]=4 914 B10R1.176 N#CC1=CC(Cl)=C(N)N=C1 A37760 [0,1,0,0,0,0|2,0,1]=4 915 B10R1.176 N#CC1=CC(Cl)=C(O)N=C1 C41856 [0,1,0,0,0,0|2,0,1]=4 916 B10R1.176 N#CC1=CC(I)=C(N)N=C1 A42167 [0,1,0,0,0,0|2,0,1]=4 917 B10R1.176 N#CC1=CN=C(Cl)C(Cl)=C1 D41679 [0,1,0,0,0,0|2,0,1]=4 918 B10R1.176 N#CC1=CN=C(Cl)C(F)=C1 C41684 [0,1,0,0,0,0|2,0,1]=4 919 B10R1.176 NC1=C(Br)C=C(CO)C=N1 A43064 [0,1,0,0,0,0|2,0,0]=3 920 B10R1.176 NC1=C(Br)C=CC(CO)=C1 A63987 [0,1,0,0,0,0|3,0,0]=4 921 B10R1.176 NC1=C(F)C=CC(CO)=C1 A46218 [0,1,0,0,0,0|3,0,0]=4 922 B10R1.176 NC1=C(O)C=CC(CO)=C1 A46403 [0,1,0,0,0,0|3,0,0]=4 923 B10R1.176 NCC1=CC(Cl)=C(Br)C=C1 B45768 [0,1,0,0,0,0|3,0,0]=4 924 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 D45785 [0,1,0,0,0,0|3,0,0]=4 925 B10R1.176 NCC1=CC(Cl)=C(F)C=C1 C45798 [0,1,0,0,0,0|3,0,0]=4 926 B10R1.176 NCC1=CC(F)=C(Br)C=C1 B37399 [0,1,0,0,0,0|3,0,0]=4 927 B10R1.176 NCC1=CC(F)=C(Cl)C=C1 C45803 [0,1,0,0,0,0|3,0,0]=4 928 B10R1.176 O=CC1=CC(Cl)=C(O)N=C1 C42251 [0,1,0,0,0,0|2,0,1]=4 929 B10R1.176 O=CC1=CN=C(Br)C(F)=C1 B41998 [0,1,0,0,0,0|2,0,1]=4 930 B10R1.176 O=CC1=CN=C(Cl)C(Cl)=C1 D42008 [0,1,0,0,0,0|2,0,1]=4 931 B10R1.176 OCC1=CC(Br)=C(Cl)C=C1 B45556 [0,1,0,0,0,0|3,0,0]=4 932 B10R1.176 OCC1=CC(Br)=C(O)C=C1 B45902 [0,1,0,0,0,0|3,0,0]=4 933 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 D45586 [0,1,0,0,0,0|3,0,0]=4 934 B10R1.176 OCC1=CC(F)=C(Br)C=C1 B45570 [0,1,0,0,0,0|3,0,0]=4 935 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 C45597 [0,1,0,0,0,0|3,0,0]=4 936 B10R1.176 OCC1=CC(F)=C(F)C=C1 D45608 [0,1,0,0,0,0|3,0,0]=4 937 B10R1.176 OCC1=CC(I)=C(Cl)N=C1 C42675 [0,1,0,0,0,0|2,0,0]=3 938 B10R1.176 OCC1=CC(O)=C(Br)C=C1 B45903 [0,1,0,0,0,0|3,0,0]=4 939 B10R1.176 OCC1=CC(O)=C(F)C=C1 F45920 [0,1,0,0,0,0|3,0,0]=4 940 B10R1.176 OCC1=CC(O)=C(I)C=C1 H45924 [0,1,0,0,0,0|3,0,0]=4 941 B10R1.176 OCC1=CN=C(Cl)C(Cl)=C1 D9504 [0,1,0,0,0,0|2,0,0]=3 942 B10R2.31 BrC1=CC2=C(C=C1)CC2 B48297 [0,0,0,1,0,0|2,0,0]=3 943 B8R1.1 C#CC1=NC(C)=CS1 E42681 [0,0,0,0,1,0|1,0,2]=4 944 B8R1.1 CC1=CC(C=O)=CS1 M29797 [0,0,0,0,1,0|2,0,1]=4 945 B8R1.1 CC1=CC(CN)=NO1 M15781 [0,0,0,0,1,0|3,0,0]=4 946 B8R1.1 CC1=CC=C(C#N)N1 M32172 [0,0,0,0,1,0|1,0,2]=4 947 B8R1.1 CC1=CC=C(C#N)S1 M12843 [0,0,0,0,1,0|2,0,1]=4 948 B8R1.1 CC1=CC=C(C=O)N1 M43134 [0,0,0,0,1,0|1,0,2]=4 949 B8R1.1 CC1=CC=C(C=O)S1 M39272 [0,0,0,0,1,0|2,0,1]=4 950 B8R1.1 CC1=CC=C(CN)O1 M37131 [0,0,0,0,1,0|2,0,0]=3 951 B8R1.1 CC1=CC=C(CO)O1 M43304 [0,0,0,0,1,0|2,0,0]=3 952 B8R1.1 CC1=CN=C(CO)S1 M41173 [0,0,0,0,1,0|3,0,0]=4 953 B8R1.1 CC1=CNC(C#N)=N1 M40951 [0,0,0,0,1,0|2,0,1]=4 954 B8R1.1 CC1=COC(C=O)=C1 M13538 [0,0,0,0,1,0|2,0,1]=4 955 B8R1.1 CC1=COC(C=O)=N1 M12937 [0,0,0,0,1,0|2,0,1]=4 956 B8R1.1 CC1=CSC(C#N)=N1 M8139 [0,0,0,0,1,0|2,0,1]=4 957 B8R1.1 CC1=CSC(C=O)=C1 M42959 [0,0,0,0,1,0|2,0,1]=4 958 B8R1.1 CC1=CSC(C=O)=N1 M14992 [0,0,0,0,1,0|2,0,1]=4 959 B8R1.1 CC1=CSC(CN)=N1 M64512 [0,0,0,0,1,0|2,0,0]=3 960 B8R1.1 CC1=NC(C=O)=CO1 M3278 [0,0,0,0,1,0|2,0,1]=4 961 B8R1.1 CC1=NC(C=O)=CS1 F2075 [0,0,0,0,1,0|2,0,1]=4 962 B8R1.1 CC1=NC(CCl)=NO1 C40128 [0,0,0,0,1,0|3,0,0]=4 963 B8R1.1 CC1=NC(CN)=CO1 M41196 [0,0,0,0,1,0|2,0,0]=3 964 B8R1.1 CC1=NC(CN)=CO1 M41310 [0,0,0,0,1,0|2,0,0]=3 965 B8R1.1 CC1=NC=C(C=O)S1 F2897 [0,0,0,0,1,0|2,0,1]=4 966 B8R1.1 CC1=NC=C(CBr)S1 B41111 [0,0,0,0,1,0|2,0,0]=3 967 B8R1.1 CC1=NC=C(CN)O1 M41197 [0,0,0,0,1,0|2,0,0]=3 968 B8R1.1 CC1=NC=C(CO)O1 M37561 [0,0,0,0,1,0|2,0,0]=3 969 B8R1.1 CC1=NC=C(CO)S1 M1967 [0,0,0,0,1,0|2,0,0]=3 970 B8R1.1 CC1=NN=C(CCl)S1 M66901 [0,0,0,0,1,0|3,0,0]=4 971 B8R1.1 CC1=NOC(CN)=C1 M41364 [0,0,0,0,1,0|2,0,0]=3 972 B8R1.1 CCC1=CC(N)=NO1 E41190 [0,0,0,0,1,0|2,0,0]=3 973 B8R1.1 CCC1=CC=C(C)S1 E43745 [0,0,0,0,1,0|1,0,0]=2 974 B8R1.1 CCC1=CN=C(C)N1 E41428 [0,0,0,0,1,0|1,0,0]=2 975 B8R1.1 CCC1=CN=C(N)S1 E41203 [0,0,0,0,1,0|2,0,0]=3 976 B8R1.1 CCC1=CN=C(N)S1 E69753 [0,0,0,0,1,0|2,0,0]=3 977 B8R1.1 CCC1=NC(C)=CS1 E43395 [0,0,0,0,1,0|1,0,0]=2 978 B8R1.1 CCC1=NN=C(N)O1 A12274 [0,0,0,0,1,0|3,0,0]=4 979 B8R1.1 CCC1=NNC(N)=C1 A9777 [0,0,0,0,1,0|2,0,1]=4 980 B8R1.1 CCC1=NOC(N)=C1 E41189 [0,0,0,0,1,0|3,0,0]=4 981 B8R1.1 CCN1C=C(Br)C=N1 B9823 [0,0,0,0,1,0|3,0,0]=4 982 B8R1.1 CCN1C=C(N)C=N1 A12746 [0,0,0,0,1,0|3,0,0]=4 983 B8R1.1 CC[N+]1=CN(C)C=C1 E38121 [0,0,0,0,1,0|2,0,0]=3 984 B8R1.1 CC[N+]1=CN(C)C=C1 E41405 [0,0,0,0,1,0|2,0,0]=3 985 B8R1.1 CC[N+]1=CN(C)C=C1 E43585 [0,0,0,0,1,0|2,0,0]=3 986 B8R1.1 CC[N+]1=CN(C)C=C1 E46615 [0,0,0,0,1,0|2,0,0]=3 987 B8R1.1 CN1C=C(C#N)C=N1 M12749 [0,0,0,0,1,0|2,0,1]=4 988 B8R1.1 CN1C=C(C=O)C=N1 M6127 [0,0,0,0,1,0|2,0,1]=4 989 B8R1.1 CN1C=C(CBr)C=N1 B27149 [0,0,0,0,1,0|2,0,0]=3 990 B8R1.1 CN1C=C(CN)C=N1 M16591 [0,0,0,0,1,0|2,0,0]=3 991 B8R1.1 CN1C=C(CN)C=N1 M17032 [0,0,0,0,1,0|2,0,0]=3 992 B8R1.1 CN1C=C(CN)C=N1 M9443 [0,0,0,0,1,0|2,0,0]=3 993 B8R1.1 CN1C=C(CO)C=N1 M10343 [0,0,0,0,1,0|2,0,0]=3 994 B8R1.1 CN1C=CC(C#N)=N1 M12751 [0,0,0,0,1,0|2,0,1]=4 995 B8R1.1 CN1C=CC(C=O)=N1 M22764 [0,0,0,0,1,0|2,0,1]=4 996 B8R1.1 CN1C=CC(CCl)=N1 C25609 [0,0,0,0,1,0|2,0,0]=3 997 B8R1.1 CN1C=CC(CN)=N1 M9952 [0,0,0,0,1,0|2,0,0]=3 998 B8R1.1 CN1C=CC(CO)=N1 M9953 [0,0,0,0,1,0|2,0,0]=3 999 B8R1.1 CN1C=NC(CCl)=C1 C21803 [0,0,0,0,1,0|3,0,0]=4 1000 B8R1.1 CN1C=NC(CCl)=N1 C40197 [0,0,0,0,1,0|3,0,0]=4 1001 B8R1.1 CN1C=NC(CN)=C1 A11226 [0,0,0,0,1,0|3,0,0]=4 1002 B8R1.1 CN1C=NC(CN)=C1 A11227 [0,0,0,0,1,0|3,0,0]=4 1003 B8R1.1 CN1C=NC(CN)=C1 A29740 [0,0,0,0,1,0|3,0,0]=4 1004 B8R1.1 CN1C=NC(CN)=N1 A14790 [0,0,0,0,1,0|3,0,0]=4 1005 B8R1.1 CN1C=NC(CN)=N1 M29766 [0,0,0,0,1,0|3,0,0]=4 1006 B8R1.1 CN1C=NC(CO)=C1 M12982 [0,0,0,0,1,0|3,0,0]=4 1007 B8R1.1 CN1C=NC(CO)=N1 M14789 [0,0,0,0,1,0|3,0,0]=4 1008 B8R1.1 CNC1=CN(C)N=C1 D41402 [0,0,0,0,1,0|2,0,0]=3 1009 B8R1.1 COC1=CC(N)=NN1 M0643 [0,0,0,0,1,0|3,0,0]=4 1010 B8R1.1 COC1=CC(N)=NN1 M13731 [0,0,0,0,1,0|3,0,0]=4 1011 B8R1.1 COC1=CC(N)=NO1 M40185 [0,0,0,0,1,0|3,0,0]=4 1012 B8R1.1 COC1=NC(Br)=CS1 B2259 [0,0,0,0,1,0|3,0,0]=4 1013 B8R1.1 CSC1=CN=C(N)S1 M40191 [0,0,0,0,1,0|3,0,0]=4 1014 B8R1.1 CSC1=NC(Br)=CS1 T2262 [0,0,0,0,1,0|3,0,0]=4 1015 B8R1.1 ClCC1=CC(Br)=NO1 B2105 [0,0,0,0,1,0|3,0,0]=4 1016 B8R1.1 ClCC1=CC=C(Cl)S1 C40699 [0,0,0,0,1,0|3,0,0]=4 1017 B8R1.1 ClCC1=CN=C(Cl)S1 C2059 [0,0,0,0,1,0|3,0,0]=4 1018 B8R1.1 ClCC1=CSC(Cl)=N1 C2721 [0,0,0,0,1,0|3,0,0]=4 1019 B8R1.1 NC1=NC(CCl)=CS1 A2564 [0,0,0,0,1,0|3,0,0]=4 1020 B8R1.1 NC1=NC(CO)=CS1 A40186 [0,0,0,0,1,0|3,0,0]=4 1021 B8R1.1 NC1=NC=C(CO)S1 A40187 [0,0,0,0,1,0|3,0,0]=4 1022 B8R1.1 NC1=NNC(CO)=C1 A14738 [0,0,0,0,1,0|3,0,0]=4 1023 B8R1.1 NCC1=CC(Br)=CS1 B41112 [0,0,0,0,1,0|3,0,0]=4 1024 B8R1.1 NCC1=CC=C(Br)S1 A12757 [0,0,0,0,1,0|3,0,0]=4 1025 B8R1.1 NCC1=CC=C(Cl)S1 A12836 [0,0,0,0,1,0|3,0,0]=4 1026 B8R1.1 NCC1=CC=C(Cl)S1 C27089 [0,0,0,0,1,0|3,0,0]=4 1027 B8R1.1 NCC1=CC=C(F)S1 F8124 [0,0,0,0,1,0|3,0,0]=4 1028 B8R1.1 NCC1=CN=C(Cl)S1 C40120 [0,0,0,0,1,0|3,0,0]=4 1029 B8R1.1 NCC1=CSC(Br)=C1 B16484 [0,0,0,0,1,0|3,0,0]=4 1030 B8R1.1 NCC1=CSC(Cl)=C1 C7665 [0,0,0,0,1,0|3,0,0]=4 1031 B8R1.1 OCC1=CC(Br)=CS1 B12759 [0,0,0,0,1,0|3,0,0]=4 1032 B8R1.1 OCC1=CC(Br)=NO1 B2177 [0,0,0,0,1,0|3,0,0]=4 1033 B8R1.1 OCC1=CC(Cl)=CS1 C7722 [0,0,0,0,1,0|3,0,0]=4 1034 B8R1.1 OCC1=CC=C(Br)S1 B12756 [0,0,0,0,1,0|3,0,0]=4 1035 B8R1.1 OCC1=CC=C(Br)S1 B41016 [0,0,0,0,1,0|3,0,0]=4 1036 B8R1.1 OCC1=CC=C(Cl)S1 C1567 [0,0,0,0,1,0|3,0,0]=4 1037 B8R1.1 OCC1=CC=C(F)S1 F8123 [0,0,0,0,1,0|3,0,0]=4 1038 B8R1.1 OCC1=CN=C(Br)S1 B2127 [0,0,0,0,1,0|3,0,0]=4 1039 B8R1.1 OCC1=CN=C(Cl)S1 C2061 [0,0,0,0,1,0|3,0,0]=4 1040 B8R1.1 OCC1=COC(Br)=N1 B3572 [0,0,0,0,1,0|3,0,0]=4 1041 B8R1.1 OCC1=CSC(Br)=N1 B2126 [0,0,0,0,1,0|3,0,0]=4 1042 B8R1.1 OCC1=CSC(Cl)=C1 C7721 [0,0,0,0,1,0|3,0,0]=4 1043 B8R1.1 OCC1=CSC(Cl)=N1 C2782 [0,0,0,0,1,0|3,0,0]=4 1044 B8R1.1 OCC1=NC(Br)=CN1 B32450 [0,0,0,0,1,0|3,0,0]=4 1045 B8R1.1 OCC1=NC(Br)=CS1 B10817 [0,0,0,0,1,0|3,0,0]=4 1046 B7R1.3 BrC1=CN=CC=C1 B2746 [2,0,0,0,0,0|1,0,0]=3 1047 B7R1.3 BrC1=CN=CN=C1 B2363 [2,0,0,0,0,0|2,0,0]=4 1048 B7R1.3 BrC1=NC=CC=N1 B2474 [2,0,0,0,0,0|2,0,0]=4 1049 B7R1.3 BrC1=NC=CN=C1 B40020 [2,0,0,0,0,0|2,0,0]=4 1050 B7R1.3 BrC1=NC=NC=C1 B62457 [2,0,0,0,0,0|2,0,0]=4 1051 B7R1.3 BrC1=NN=CC=C1 B26087 [2,0,0,0,0,0|2,0,0]=4 1052 B7R1.3 CC1=CC=CN=N1 M0216 [2,0,0,0,0,0|1,0,0]=3 1053 B7R1.3 CC1=CN=CN=C1 M41018 [2,0,0,0,0,0|1,0,0]=3 1054 B7R1.3 CC1=CN=NC=C1 M3532 [2,0,0,0,0,0|1,0,0]=3 1055 B7R1.3 CC1=NC=CC=N1 M68916 [2,0,0,0,0,0|1,0,0]=3 1056 B7R1.3 CC1=NC=CN=C1 M61917 [2,0,0,0,0,0|1,0,0]=3 1057 B7R1.3 CC1=NC=CN=N1 M36785 [2,0,0,0,0,0|2,0,0]=4 1058 B7R1.3 CC1=NC=NC=C1 M7491 [2,0,0,0,0,0|1,0,0]=3 1059 B7R1.3 C[N+]1=CC=CC=C1 M38728 [2,0,0,0,0,0|2,0,0]=4 1060 B7R1.3 ClC1=CN=CC=C1 C68367 [2,0,0,0,0,0|1,0,0]=3 1061 B7R1.3 ClC1=CN=CN=C1 C40022 [2,0,0,0,0,0|2,0,0]=4 1062 B7R1.3 ClC1=CN=NC=C1 C37590 [2,0,0,0,0,0|2,0,0]=4 1063 B7R1.3 ClC1=NC=CN=C1 C5165 [2,0,0,0,0,0|2,0,0]=4 1064 B7R1.3 ClC1=NC=NC=C1 C0425 [2,0,0,0,0,0|2,0,0]=4 1065 B7R1.3 ClC1=NN=CC=C1 C7487 [2,0,0,0,0,0|2,0,0]=4 1066 B7R1.3 FC1=CN=CC=C1 F1892 [2,0,0,0,0,0|1,0,0]=3 1067 B7R1.3 FC1=NC=CC=C1 F4862 [2,0,0,0,0,0|1,0,0]=3 1068 B7R1.3 FC1=NC=CC=N1 F69151 [2,0,0,0,0,0|2,0,0]=4 1069 B7R1.3 FC1=NC=CN=C1 F40023 [2,0,0,0,0,0|2,0,0]=4 1070 B7R1.3 IC1=CC=CC=C1 I38419 [2,0,0,0,0,0|2,0,0]=4 1071 B7R1.3 IC1=CN=CC=C1 I16635 [2,0,0,0,0,0|1,0,0]=3 1072 B7R1.3 IC1=CN=CN=C1 K22993 [2,0,0,0,0,0|2,0,0]=4 1073 B7R1.3 IC1=NC=CC=C1 K67594 [2,0,0,0,0,0|1,0,0]=3 1074 B7R1.3 IC1=NC=CC=N1 K40026 [2,0,0,0,0,0|2,0,0]=4 1075 B7R1.3 IC1=NC=CN=C1 I2669 [2,0,0,0,0,0|2,0,0]=4 1076 B7R1.3 NC1=CC=CN=N1 A6039 [2,0,0,0,0,0|2,0,0]=4 1077 B7R1.3 NC1=CN=CN=C1 A5265 [2,0,0,0,0,0|2,0,0]=4 1078 B7R1.3 NC1=CN=NC=C1 A3533 [2,0,0,0,0,0|2,0,0]=4 1079 B7R1.3 NC1=CN=NC=C1 A7237 [2,0,0,0,0,0|2,0,0]=4 1080 B7R1.3 NC1=NC=CC=C1 A23973 [2,0,0,0,0,0|1,0,0]=3 1081 B7R1.3 NC1=NC=CN=C1 A15535 [2,0,0,0,0,0|2,0,0]=4 1082 B7R1.3 NC1=NC=NC=C1 A12258 [2,0,0,0,0,0|2,0,0]=4 1083 B7R1.3 O=C1C=CC=NN1 P5932 [2,0,0,0,0,0|2,0,0]=4 1084 B7R1.3 O=C1C=NC=CN1 H68630 [2,0,0,0,0,0|2,0,0]=4 1085 B7R1.3 O=C1N=CC=CN1 P67458 [2,0,0,0,0,0|2,0,0]=4 1086 B7R1.3 OC1=CN=CN=C1 H14432 [2,0,0,0,0,0|2,0,0]=4 1087 B7R1.3 OC1=CN=NC=C1 H22270 [2,0,0,0,0,0|2,0,0]=4 1088 B7R1.3 OC1=CN=NC=C1 P40299 [2,0,0,0,0,0|2,0,0]=4 1089 B7R1.3 OC1=NC=CC=C1 P61113 [2,0,0,0,0,0|1,0,0]=3 1090 B7R1.3 OC1=NC=NC=C1 P32223 [2,0,0,0,0,0|2,0,0]=4 1091 B7R1.3 S=C1N=CC=CN1 P61565 [2,0,0,0,0,0|2,0,0]=4 1092 B7R1.3 [Mg+]C1=CC=CC=C1 P31728 [2,0,0,0,0,0|2,0,0]=4 1093 B7R1.3 [Mg+]C1=CN=CC=C1 P8350 [2,0,0,0,0,0|1,0,0]=3 1094 B7R1.3 [Mg+]C1=NC=CC=C1 P8351 [2,0,0,0,0,0|1,0,0]=3 1095 B9R1.2 BrCC1=CC=CC(Br)=C1 B39369 [1,1,0,0,0,0|2,0,0]=4 1096 B9R1.2 BrCC1=CC=CC(I)=C1 B45170 [1,1,0,0,0,0|2,0,0]=4 1097 B9R1.2 C#CC1=CC(Cl)=CN=C1 C44423 [1,1,0,0,0,0|0,0,2]=4 1098 B9R1.2 C#CC1=CN=CC(N)=C1 E45200 [1,1,0,0,0,0|0,0,2]=4 1099 B9R1.2 C=CC1=CC(Br)=CN=C1 B38372 [1,1,0,0,0,0|0,0,2]=4 1100 B9R1.2 C=CC1=CC(F)=CN=C1 E16704 [1,1,0,0,0,0|0,0,2]=4 1101 B9R1.2 CC1=CC(C#N)=CN=C1 M45202 [1,1,0,0,0,0|1,0,1]=4 1102 B9R1.2 CC1=CC(C=O)=CN=C1 M12908 [1,1,0,0,0,0|1,0,1]=4 1103 B9R1.2 CC1=CC(CCl)=CN=C1 C46109 [1,1,0,0,0,0|1,0,0]=3 1104 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [1,1,0,0,0,0|1,0,0]=3 1105 B9R1.2 CC1=CC(CO)=NN=C1 M27710 [1,1,0,0,0,0|2,0,0]=4 1106 B9R1.2 CC1=CC=CC(CN)=C1 M37355 [1,1,0,0,0,0|2,0,0]=4 1107 B9R1.2 CC1=CN=CC(CCl)=N1 C43005 [1,1,0,0,0,0|2,0,0]=4 1108 B9R1.2 CC1=CN=NC(CN)=C1 A13026 [1,1,0,0,0,0|2,0,0]=4 1109 B9R1.2 CC1=CN=NC(CN)=C1 M27097 [1,1,0,0,0,0|2,0,0]=4 1110 B9R1.2 CCC1=CC(=O)NN=C1 E43197 [1,1,0,0,0,0|1,0,0]=3 1111 B9R1.2 CCC1=CC(Br)=CN=C1 B46076 [1,1,0,0,0,0|0,0,0]=2 1112 B9R1.2 CCC1=CC(N)=NC=C1 E4696 [1,1,0,0,0,0|2,0,0]=4 1113 B9R1.2 CCC1=CC=CC(Br)=C1 B49158 [1,1,0,0,0,0|1,0,0]=3 1114 B9R1.2 CCC1=CC=CC(Br)=N1 B46074 [1,1,0,0,0,0|2,0,0]=4 1115 B9R1.2 CCC1=CC=CC(N)=C1 E68361 [1,1,0,0,0,0|1,0,0]=3 1116 B9R1.2 CCC1=CC=CC(N)=N1 E43601 [1,1,0,0,0,0|2,0,0]=4 1117 B9R1.2 CCC1=CC=CC([Mg+])=C1 E31740 [1,1,0,0,0,0|1,0,0]=3 1118 B9R1.2 CCC1=CN=CC(N)=C1 E37485 [1,1,0,0,0,0|0,0,0]=2 1119 B9R1.2 CCC1=NC=CC(Br)=C1 B46078 [1,1,0,0,0,0|2,0,0]=4 1120 B9R1.2 CCC1=NC=CC(N)=C1 A15478 [1,1,0,0,0,0|2,0,0]=4 1121 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [1,1,0,0,0,0|2,0,0]=4 1122 B9R1.2 CNC1=CC=CC(Br)=C1 B46077 [1,1,0,0,0,0|2,0,0]=4 1123 B9R1.2 CNC1=CC=CC(Br)=C1 B66504 [1,1,0,0,0,0|2,0,0]=4 1124 B9R1.2 COC1=CC(=O)NN=C1 M17895 [1,1,0,0,0,0|2,0,0]=4 1125 B9R1.2 COC1=CC(Br)=CN=C1 B2876 [1,1,0,0,0,0|1,0,0]=3 1126 B9R1.2 COC1=CC(Cl)=NN=C1 C11516 [1,1,0,0,0,0|2,0,0]=4 1127 B9R1.2 COC1=CC(O)=CC=C1 M27960 [1,1,0,0,0,0|2,0,0]=4 1128 B9R1.2 COC1=CC=CC(F)=C1 F45965 [1,1,0,0,0,0|2,0,0]=4 1129 B9R1.2 COC1=CC=CC(I)=C1 K45966 [1,1,0,0,0,0|2,0,0]=4 1130 B9R1.2 COC1=CC=CC([Mg+])=C1 M31743 [1,1,0,0,0,0|2,0,0]=4 1131 B9R1.2 COC1=CN=CC(Cl)=N1 C2454 [1,1,0,0,0,0|2,0,0]=4 1132 B9R1.2 COC1=CN=CC(I)=N1 I2676 [1,1,0,0,0,0|2,0,0]=4 1133 B9R1.2 COC1=CN=CC(N)=C1 A14114 [1,1,0,0,0,0|1,0,0]=3 1134 B9R1.2 COC1=CN=CC(N)=C1 A7930 [1,1,0,0,0,0|1,0,0]=3 1135 B9R1.2 COC1=CN=CC(O)=C1 M43136 [1,1,0,0,0,0|1,0,0]=3 1136 B9R1.2 COC1=NC(N)=CN=C1 A8995 [1,1,0,0,0,0|2,0,0]=4 1137 B9R1.2 CSC1=CC(N)=CC=C1 M46442 [1,1,0,0,0,0|2,0,0]=4 1138 B9R1.2 CSC1=CC=CC(Br)=C1 B45613 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.2 ClC1=CC=CC(CBr)=C1 B39371 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.2 ClCC1=CC(Br)=CN=C1 B15185 [1,1,0,0,0,0|1,0,0]=3 1141 B9R1.2 ClCC1=CC(Cl)=CN=C1 C1777 [1,1,0,0,0,0|1,0,0]=3 1142 B9R1.2 ClCC1=CC=CC(Br)=C1 B45159 [1,1,0,0,0,0|2,0,0]=4 1143 B9R1.2 ClCC1=CC=CC(I)=C1 C45183 [1,1,0,0,0,0|2,0,0]=4 1144 B9R1.2 FC1=CC(CBr)=CN=C1 B37165 [1,1,0,0,0,0|1,0,0]=3 1145 B9R1.2 FC1=CC(CCl)=CN=C1 C1821 [1,1,0,0,0,0|1,0,0]=3 1146 B9R1.2 FC1=CC=CC(CBr)=C1 B45165 [1,1,0,0,0,0|2,0,0]=4 1147 B9R1.2 N#CC1=CC(Br)=CN=C1 B12737 [1,1,0,0,0,0|1,0,1]=4 1148 B9R1.2 N#CC1=CC(Cl)=CN=C1 C41827 [1,1,0,0,0,0|1,0,1]=4 1149 B9R1.2 N#CC1=CC(F)=CN=C1 F41835 [1,1,0,0,0,0|1,0,1]=4 1150 B9R1.2 N#CC1=CC(O)=CN=C1 H36685 [1,1,0,0,0,0|1,0,1]=4 1151 B9R1.2 N#CC1=CN=CC(N)=C1 A37387 [1,1,0,0,0,0|1,0,1]=4 1152 B9R1.2 NC1=CC(CO)=CN=C1 A43207 [1,1,0,0,0,0|1,0,0]=3 1153 B9R1.2 NC1=CC=CC(CO)=C1 A37868 [1,1,0,0,0,0|2,0,0]=4 1154 B9R1.2 NCC1=CC(F)=CN=C1 F5829 [1,1,0,0,0,0|1,0,0]=3 1155 B9R1.2 NCC1=CC=CC(Br)=C1 B46079 [1,1,0,0,0,0|2,0,0]=4 1156 B9R1.2 NCC1=CC=CC(Cl)=C1 C46098 [1,1,0,0,0,0|2,0,0]=4 1157 B9R1.2 NCC1=CC=CC(F)=C1 F15968 [1,1,0,0,0,0|2,0,0]=4 1158 B9R1.2 NCC1=CC=CC(I)=C1 K46122 [1,1,0,0,0,0|2,0,0]=4 1159 B9R1.2 NCC1=CC=CC(N)=C1 A43599 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.2 NCC1=CN=CC(Cl)=N1 C18971 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.2 O=CC1=CC(Br)=CN=C1 B3012 [1,1,0,0,0,0|1,0,1]=4 1162 B9R1.2 O=CC1=CC(Cl)=CN=C1 C15036 [1,1,0,0,0,0|1,0,1]=4 1163 B9R1.2 O=CC1=CC(F)=CN=C1 F15543 [1,1,0,0,0,0|1,0,1]=4 1164 B9R1.2 O=CC1=CN=CC(O)=C1 H37579 [1,1,0,0,0,0|1,0,1]=4 1165 B9R1.2 OC1=CC=CC(CBr)=C1 B38962 [1,1,0,0,0,0|2,0,0]=4 1166 B9R1.2 OCC1=CC(Br)=CN=C1 B12503 [1,1,0,0,0,0|1,0,0]=3 1167 B9R1.2 OCC1=CC(Cl)=CN=C1 C42912 [1,1,0,0,0,0|1,0,0]=3 1168 B9R1.2 OCC1=CC(F)=CN=C1 F0704 [1,1,0,0,0,0|1,0,0]=3 1169 B9R1.2 OCC1=CC(O)=CN=C1 H39124 [1,1,0,0,0,0|1,0,0]=3 1170 B9R1.2 OCC1=CC=CC(Cl)=C1 C39405 [1,1,0,0,0,0|2,0,0]=4 1171 B9R1.2 OCC1=CC=CC(F)=C1 F39408 [1,1,0,0,0,0|2,0,0]=4 1172 B9R1.2 OCC1=CC=CC(I)=C1 H61971 [1,1,0,0,0,0|2,0,0]=4 1173 B9R1.2 OCC1=CN=CC(Br)=N1 B40916 [1,1,0,0,0,0|2,0,0]=4 1174 B9R1.2 OCC1=CN=CC(Cl)=N1 C14609 [1,1,0,0,0,0|2,0,0]=4 1175 B9R1.6 CC(=O)C1=CN=CN=C1 A7446 [1,1,0,0,0,0|1,0,1]=4 1176 B9R1.6 CC(=O)C1=CN=NC=C1 A10222 [1,1,0,0,0,0|1,0,1]=4 1177 B9R1.6 CC(=O)C1=NC=CN=C1 A39262 [1,1,0,0,0,0|1,0,1]=4 1178 B9R1.6 CC(=O)C1=NN=CC=C1 P0157 [1,1,0,0,0,0|1,0,1]=4 1179 B9R1.6 CC(C)C1=NC=CC=C1 I0627 [1,1,0,0,0,0|2,0,0]=4 1180 B9R1.6 C[C@@H](N)C1=CC=CC=C1 P68072 [1,1,0,0,0,0|1,0,0]=3 1181 B9R1.6 C[C@@H](N)C1=CC=CN=C1 P43620 [1,1,0,0,0,0|0,0,0]=2 1182 B9R1.6 C[C@@H](N)C1=CC=NC=C1 P43606 [1,1,0,0,0,0|2,0,0]=4 1183 B9R1.6 C[C@@H](N)C1=CC=NC=C1 P46584 [1,1,0,0,0,0|2,0,0]=4 1184 B9R1.6 C[C@@H](N)C1=CN=CN=C1 A12922 [1,1,0,0,0,0|1,0,0]=3 1185 B9R1.6 C[C@@H](N)C1=CN=CN=C1 P27095 [1,1,0,0,0,0|1,0,0]=3 1186 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P43619 [1,1,0,0,0,0|2,0,0]=4 1187 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P46583 [1,1,0,0,0,0|2,0,0]=4 1188 B9R1.6 C[C@@H](O)C1=CC=CC=C1 P46824 [1,1,0,0,0,0|1,0,0]=3 1189 B9R1.6 C[C@@H](O)C1=CC=NC=C1 P46383 [1,1,0,0,0,0|2,0,0]=4 1190 B9R1.6 C[C@@H](O)C1=NC=CC=C1 P46382 [1,1,0,0,0,0|2,0,0]=4 1191 B9R1.6 C[C@H](Br)C1=NC=CN=C1 B42963 [1,1,0,0,0,0|1,0,0]=3 1192 B9R1.6 C[C@H](N)C1=CC=CC=C1 P68597 [1,1,0,0,0,0|1,0,0]=3 1193 B9R1.6 C[C@H](N)C1=CC=CC=C1 P69271 [1,1,0,0,0,0|1,0,0]=3 1194 B9R1.6 C[C@H](N)C1=CC=CN=C1 P43604 [1,1,0,0,0,0|0,0,0]=2 1195 B9R1.6 C[C@H](N)C1=CC=CN=C1 P46585 [1,1,0,0,0,0|0,0,0]=2 1196 B9R1.6 C[C@H](N)C1=CC=CN=C1 P61653 [1,1,0,0,0,0|0,0,0]=2 1197 B9R1.6 C[C@H](N)C1=CC=NC=C1 P43607 [1,1,0,0,0,0|2,0,0]=4 1198 B9R1.6 C[C@H](N)C1=CC=NC=C1 P46582 [1,1,0,0,0,0|2,0,0]=4 1199 B9R1.6 C[C@H](N)C1=CN=CN=C1 A12921 [1,1,0,0,0,0|1,0,0]=3 1200 B9R1.6 C[C@H](N)C1=CN=CN=C1 A7447 [1,1,0,0,0,0|1,0,0]=3 1201 B9R1.6 C[C@H](N)C1=CN=NC=C1 P30996 [1,1,0,0,0,0|1,0,0]=3 1202 B9R1.6 C[C@H](N)C1=NC=CC=C1 P43621 [1,1,0,0,0,0|2,0,0]=4 1203 B9R1.6 C[C@H](N)C1=NC=CC=C1 P66366 [1,1,0,0,0,0|2,0,0]=4 1204 B9R1.6 C[C@H](N)C1=NC=CN=C1 P14583 [1,1,0,0,0,0|1,0,0]=3 1205 B9R1.6 C[C@H](O)C1=CC=CC=C1 P46823 [1,1,0,0,0,0|1,0,0]=3 1206 B9R1.6 C[C@H](O)C1=CC=NC=C1 P38118 [1,1,0,0,0,0|2,0,0]=4 1207 B9R1.6 C[C@H](O)C1=NC=CC=C1 P46375 [1,1,0,0,0,0|2,0,0]=4 1208 B9R1.6 C[C@H](O)C1=NC=CN=C1 P43187 [1,1,0,0,0,0|1,0,0]=3 1209 B9R1.6 C[S@](=O)C1=CC=CC=C1 M61814 [1,1,0,0,0,0|2,0,0]=4 1210 B9R1.6 N=C(N)C1=CC=CN=C1 N43530 [1,1,0,0,0,0|1,0,1]=4 1211 B9R1.6 OB(O)C1=CN=CC=C1 P5080 [1,1,0,0,0,0|2,0,0]=4 1212 B9R1.8 BrCCC1=CC=NC=C1 B46088 [1,1,0,0,0,0|2,0,0]=4 1213 B9R1.8 CC#CC1=CC=CC=C1 P68608 [1,1,0,0,0,0|1,0,1]=4 1214 B9R1.8 CCCC1=NC=CC=C1 P46859 [1,1,0,0,0,0|2,0,0]=4 1215 B9R1.8 CCCC1=NC=CN=C1 P43598 [1,1,0,0,0,0|1,0,0]=3 1216 B9R1.8 CCNC1=NC=CN=C1 E43330 [1,1,0,0,0,0|1,0,0]=3 1217 B9R1.8 CCOC1=NC=CC=C1 E46369 [1,1,0,0,0,0|2,0,0]=4 1218 B9R1.8 CNCC1=CC=NC=C1 M43623 [1,1,0,0,0,0|2,0,0]=4 1219 B9R1.8 CNCC1=CN=CN=C1 N11436 [1,1,0,0,0,0|1,0,0]=3 1220 B9R1.8 CNCC1=CN=NC=C1 M12238 [1,1,0,0,0,0|1,0,0]=3 1221 B9R1.8 CNCC1=CN=NC=C1 M27035 [1,1,0,0,0,0|1,0,0]=3 1222 B9R1.8 CNCC1=NC=CN=C1 M14584 [1,1,0,0,0,0|1,0,0]=3 1223 B9R1.8 CNNC1=CC=CC=C1 M46459 [1,1,0,0,0,0|2,0,0]=4 1224 B9R1.8 COCC1=NC=CC=C1 M46377 [1,1,0,0,0,0|2,0,0]=4 1225 B9R1.8 C\C=C\C1=CC=CC=C1 P62367 [1,1,0,0,0,0|1,0,1]=4 1226 B9R1.8 N#CCC1=CN=CC=C1 P38543 [1,1,0,0,0,0|0,0,1]=3 1227 B9R1.8 N#CCC1=CN=CN=C1 P1642 [1,1,0,0,0,0|1,0,1]=4 1228 B9R1.8 N#CCC1=CN=NC=C1 P0143 [1,1,0,0,0,0|1,0,1]=4 1229 B9R1.8 N#CCC1=NN=CC=C1 P7452 [1,1,0,0,0,0|1,0,1]=4 1230 B9R1.8 NCCC1=CC=CN=C1 P43605 [1,1,0,0,0,0|0,0,0]=2 1231 B9R1.8 NCCC1=NC=CC=C1 P67673 [1,1,0,0,0,0|2,0,0]=4 1232 B9R1.8 NNCC1=CC=CC=C1 B6123 [1,1,0,0,0,0|2,0,0]=4 1233 B9R1.8 NNCC1=CC=CC=C1 B68081 [1,1,0,0,0,0|2,0,0]=4 1234 B9R1.8 NNCC1=CC=CN=C1 H0097 [1,1,0,0,0,0|1,0,0]=3 1235 B9R1.8 NNCC1=CC=CN=C1 H36962 [1,1,0,0,0,0|1,0,0]=3 1236 B9R1.8 NNCC1=CC=CN=N1 H13970 [1,1,0,0,0,0|2,0,0]=4 1237 B9R1.8 NNCC1=CN=CN=C1 H0219 [1,1,0,0,0,0|2,0,0]=4 1238 B9R1.8 NNCC1=CN=NC=C1 H12257 [1,1,0,0,0,0|2,0,0]=4 1239 B9R1.8 NNCC1=NC=CN=C1 H7534 [1,1,0,0,0,0|2,0,0]=4 1240 B9R1.8 NOCC1=CC=CC=C1 B68114 [1,1,0,0,0,0|2,0,0]=4 1241 B9R1.8 OCCC1=CC=NC=C1 H46381 [1,1,0,0,0,0|2,0,0]=4 1242 B9R1.8 OCCC1=CN=CC=C1 P46376 [1,1,0,0,0,0|0,0,0]=2 1243 B9R1.8 OCCC1=NC=CN=C1 P24824 [1,1,0,0,0,0|1,0,0]=3 1244 B9R1.8 ONCC1=CC=CC=C1 B36744 [1,1,0,0,0,0|2,0,0]=4 1245 B9R1.8 ONCC1=CC=CC=C1 B46575 [1,1,0,0,0,0|2,0,0]=4 1246 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B66761 [1,1,0,0,0,0|1,0,1]=4 1247 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [1,1,0,0,0,0|1,0,0]=3 1248 B9R1.8 [N-]=[N+]=NC1=CN=CC=C1 A2019 [1,1,0,0,0,0|2,0,0]=4 1249 B9R1.15 BrCC1=C(I)C=CC=C1 B37896 [1,1,0,0,0,0|2,0,0]=4 1250 B9R1.15 C#CC1=C(N)C=CN=C1 E37259 [1,1,0,0,0,0|0,0,2]=4 1251 B9R1.15 C#CC1=CC=CN=C1F E44435 [1,1,0,0,0,0|0,0,2]=4 1252 B9R1.15 C#CC1=CC=CN=C1N E45198 [1,1,0,0,0,0|0,0,2]=4 1253 B9R1.15 CC1=C(C#N)C=CC=N1 C10623 [1,1,0,0,0,0|1,0,1]=4 1254 B9R1.15 CC1=C(C#N)C=NC=C1 M14105 [1,1,0,0,0,0|1,0,1]=4 1255 B9R1.15 CC1=C(C=O)C=CC=N1 M1759 [1,1,0,0,0,0|1,0,1]=4 1256 B9R1.15 CC1=C(C=O)C=NC=C1 M1852 [1,1,0,0,0,0|1,0,1]=4 1257 B9R1.15 CC1=C(CBr)C=CC=N1 B15311 [1,1,0,0,0,0|1,0,0]=3 1258 B9R1.15 CC1=C(CBr)C=NC=C1 B37536 [1,1,0,0,0,0|1,0,0]=3 1259 B9R1.15 CC1=C(CCl)C=CC=N1 C14756 [1,1,0,0,0,0|1,0,0]=3 1260 B9R1.15 CC1=C(CCl)C=NC=C1 C14757 [1,1,0,0,0,0|1,0,0]=3 1261 B9R1.15 CC1=C(CCl)C=NC=C1 C46108 [1,1,0,0,0,0|1,0,0]=3 1262 B9R1.15 CC1=C(CN)C=CC=C1 M65907 [1,1,0,0,0,0|2,0,0]=4 1263 B9R1.15 CC1=C(CN)C=NC=C1 A11511 [1,1,0,0,0,0|1,0,0]=3 1264 B9R1.15 CC1=C(CN)N=NC=C1 M60279 [1,1,0,0,0,0|2,0,0]=4 1265 B9R1.15 CC1=C(CO)C=CN=N1 M63840 [1,1,0,0,0,0|2,0,0]=4 1266 B9R1.15 CC1=C(CO)C=NC=C1 H11512 [1,1,0,0,0,0|1,0,0]=3 1267 B9R1.15 CC1=CN=NC=C1CN A14785 [1,1,0,0,0,0|2,0,0]=4 1268 B9R1.15 CC1=NC=CN=C1CCl C14615 [1,1,0,0,0,0|2,0,0]=4 1269 B9R1.15 CC1=NC=CN=C1CN A11549 [1,1,0,0,0,0|2,0,0]=4 1270 B9R1.15 CC1=NC=CN=C1CO H14616 [1,1,0,0,0,0|2,0,0]=4 1271 B9R1.15 CCC1=C(Br)C=CC=C1 B68946 [1,1,0,0,0,0|1,0,0]=3 1272 B9R1.15 CCC1=C(Br)C=CC=N1 B23432 [1,1,0,0,0,0|2,0,0]=4 1273 B9R1.15 CCC1=C(Br)C=CN=C1 B10961 [1,1,0,0,0,0|0,0,0]=2 1274 B9R1.15 CCC1=C(Br)C=CN=C1 B30062 [1,1,0,0,0,0|0,0,0]=2 1275 B9R1.15 CCC1=C(Br)C=NC=C1 B23431 [1,1,0,0,0,0|2,0,0]=4 1276 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [1,1,0,0,0,0|1,0,0]=3 1277 B9R1.15 CCC1=C([Mg+])C=CC=C1 E31738 [1,1,0,0,0,0|1,0,0]=3 1278 B9R1.15 CCC1=CC=NNC1=O E43195 [1,1,0,0,0,0|1,0,1]=4 1279 B9R1.15 CCC1=CN=CN=C1Cl C42985 [1,1,0,0,0,0|1,0,0]=3 1280 B9R1.15 CCC1=NC=CN=C1C E43603 [1,1,0,0,0,0|1,0,0]=3 1281 B9R1.15 CCC1=NC=CN=C1Cl C38966 [1,1,0,0,0,0|1,0,0]=3 1282 B9R1.15 CCC1=NC=CN=C1N E43328 [1,1,0,0,0,0|1,0,0]=3 1283 B9R1.15 CCC1=NC=CNC1=O E43188 [1,1,0,0,0,0|1,0,1]=4 1284 B9R1.15 CC[N+]1=C(Br)C=CC=C1 B46367 [1,1,0,0,0,0|2,0,0]=4 1285 B9R1.15 CNC1=C(Br)C=CC=C1 B46075 [1,1,0,0,0,0|2,0,0]=4 1286 B9R1.15 CNC1=C(C)C=CC=C1 D46860 [1,1,0,0,0,0|2,0,0]=4 1287 B9R1.15 CNC1=C(C)C=CN=C1 D67183 [1,1,0,0,0,0|1,0,0]=3 1288 B9R1.15 CNC1=C(Cl)C=CC=C1 C46094 [1,1,0,0,0,0|2,0,0]=4 1289 B9R1.15 CNC1=C(F)C=CC=C1 M39414 [1,1,0,0,0,0|2,0,0]=4 1290 B9R1.15 CNC1=C(N)C=CC=C1 M43618 [1,1,0,0,0,0|2,0,0]=4 1291 B9R1.15 CNC1=C(N)C=CC=C1 M68814 [1,1,0,0,0,0|2,0,0]=4 1292 B9R1.15 CNC1=C(N)C=CN=C1 M62812 [1,1,0,0,0,0|1,0,0]=3 1293 B9R1.15 CNC1=C(O)C=CC=C1 M64657 [1,1,0,0,0,0|2,0,0]=4 1294 B9R1.15 CNC1=CC=CN=C1Cl C42994 [1,1,0,0,0,0|1,0,0]=3 1295 B9R1.15 CNC1=CC=CN=C1N M62813 [1,1,0,0,0,0|1,0,0]=3 1296 B9R1.15 CNC1=NC=CN=C1N M63361 [1,1,0,0,0,0|2,0,0]=4 1297 B9R1.15 COC1=C(Br)C=CC=C1 B67901 [1,1,0,0,0,0|2,0,0]=4 1298 B9R1.15 COC1=C(Br)C=CN=C1 B61080 [1,1,0,0,0,0|1,0,0]=3 1299 B9R1.15 COC1=C(I)C=CC=C1 K68160 [1,1,0,0,0,0|2,0,0]=4 1300 B9R1.15 COC1=C(N)N=CC=C1 A69248 [1,1,0,0,0,0|1,0,0]=3 1301 B9R1.15 COC1=C(N)N=CN=C1 M24946 [1,1,0,0,0,0|2,0,0]=4 1302 B9R1.15 COC1=C([Mg+])C=CC=C1 M31742 [1,1,0,0,0,0|2,0,0]=4 1303 B9R1.15 COC1=CC=CN=C1Br B4536 [1,1,0,0,0,0|1,0,0]=3 1304 B9R1.15 COC1=CC=CN=C1Cl C24085 [1,1,0,0,0,0|1,0,0]=3 1305 B9R1.15 COC1=CC=CN=C1F F42924 [1,1,0,0,0,0|1,0,0]=3 1306 B9R1.15 COC1=CC=CN=C1I K62151 [1,1,0,0,0,0|1,0,0]=3 1307 B9R1.15 COC1=CN=CN=C1Cl C24945 [1,1,0,0,0,0|2,0,0]=4 1308 B9R1.15 COC1=CNC=NC1=O M41033 [1,1,0,0,0,0|2,0,0]=4 1309 B9R1.15 COC1=NC=CN=C1Br B40912 [1,1,0,0,0,0|2,0,0]=4 1310 B9R1.15 COC1=NC=CN=C1C M39278 [1,1,0,0,0,0|2,0,0]=4 1311 B9R1.15 COC1=NC=CN=C1Cl C1053 [1,1,0,0,0,0|2,0,0]=4 1312 B9R1.15 COC1=NC=CN=C1I I3006 [1,1,0,0,0,0|2,0,0]=4 1313 B9R1.15 COC1=NC=CN=C1N M32096 [1,1,0,0,0,0|2,0,0]=4 1314 B9R1.15 CSC1=C(F)N=CC=C1 F42849 [1,1,0,0,0,0|1,0,0]=3 1315 B9R1.15 CSC1=C([Mg+])C=CC=C1 M31770 [1,1,0,0,0,0|2,0,0]=4 1316 B9R1.15 CSC1=NC=CN=C1C M43263 [1,1,0,0,0,0|2,0,0]=4 1317 B9R1.15 ClCC1=CC=CN=C1Cl C7688 [1,1,0,0,0,0|1,0,0]=3 1318 B9R1.15 ClCC1=NC=CN=C1Cl C12594 [1,1,0,0,0,0|2,0,0]=4 1319 B9R1.15 FC1=C(C[Mg+])C=CC=C1 F6778 [1,1,0,0,0,0|2,0,0]=4 1320 B9R1.15 N#CC1=C(Cl)C=CN=C1 C41826 [1,1,0,0,0,0|1,0,1]=4 1321 B9R1.15 N#CC1=C(N)N=CC=C1 A67490 [1,1,0,0,0,0|1,0,1]=4 1322 B9R1.15 N#CC1=CC=CN=C1Br B37950 [1,1,0,0,0,0|1,0,1]=4 1323 B9R1.15 N#CC1=CC=CN=C1Cl C1772 [1,1,0,0,0,0|1,0,1]=4 1324 B9R1.15 N#CC1=CC=CN=C1F F41834 [1,1,0,0,0,0|1,0,1]=4 1325 B9R1.15 NC1=C(C=O)C=CC=N1 A25218 [1,1,0,0,0,0|1,0,1]=4 1326 B9R1.15 NC1=C(C=O)C=NC=C1 A9624 [1,1,0,0,0,0|1,0,1]=4 1327 B9R1.15 NC1=C(CO)C=CC=C1 A7795 [1,1,0,0,0,0|2,0,0]=4 1328 B9R1.15 NC1=C(CO)C=CC=N1 A12467 [1,1,0,0,0,0|1,0,0]=3 1329 B9R1.15 NCC1=C(Br)C=CC=C1 B36643 [1,1,0,0,0,0|2,0,0]=4 1330 B9R1.15 NCC1=C(Br)C=CN=C1 B63849 [1,1,0,0,0,0|1,0,0]=3 1331 B9R1.15 NCC1=C(Cl)C=CC=C1 C46097 [1,1,0,0,0,0|2,0,0]=4 1332 B9R1.15 NCC1=C(Cl)C=CC=C1 C46104 [1,1,0,0,0,0|2,0,0]=4 1333 B9R1.15 NCC1=C(F)C=CC=C1 F26320 [1,1,0,0,0,0|2,0,0]=4 1334 B9R1.15 NCC1=C(I)C=CC=C1 I36799 [1,1,0,0,0,0|2,0,0]=4 1335 B9R1.15 NCC1=C(O)C=CC=C1 A38718 [1,1,0,0,0,0|2,0,0]=4 1336 B9R1.15 NCC1=C(O)C=CC=C1 A46574 [1,1,0,0,0,0|2,0,0]=4 1337 B9R1.15 NCC1=CC=CN=C1Cl A10464 [1,1,0,0,0,0|1,0,0]=3 1338 B9R1.15 NCC1=CC=CN=C1F F43528 [1,1,0,0,0,0|1,0,0]=3 1339 B9R1.15 NCC1=NC=CN=C1Cl C25893 [1,1,0,0,0,0|2,0,0]=4 1340 B9R1.15 NCC1=NC=CN=C1Cl C26687 [1,1,0,0,0,0|2,0,0]=4 1341 B9R1.15 O=CC1=C(Cl)C=CN=C1 C4985 [1,1,0,0,0,0|1,0,1]=4 1342 B9R1.15 O=CC1=CC=CN=C1Br B67403 [1,1,0,0,0,0|1,0,1]=4 1343 B9R1.15 O=CC1=CC=CN=C1Cl C3459 [1,1,0,0,0,0|1,0,1]=4 1344 B9R1.15 O=CC1=CC=CN=C1F F2386 [1,1,0,0,0,0|1,0,1]=4 1345 B9R1.15 OCC1=C(Br)C=CC=C1 B39402 [1,1,0,0,0,0|2,0,0]=4 1346 B9R1.15 OCC1=C(Cl)C=CC=C1 C68885 [1,1,0,0,0,0|2,0,0]=4 1347 B9R1.15 OCC1=C(Cl)C=CN=C1 C42911 [1,1,0,0,0,0|1,0,0]=3 1348 B9R1.15 OCC1=C(Cl)C=CN=C1 C42915 [1,1,0,0,0,0|1,0,0]=3 1349 B9R1.15 OCC1=C(F)C=CC=C1 F39407 [1,1,0,0,0,0|2,0,0]=4 1350 B9R1.15 OCC1=C(F)C=CN=C1 F30083 [1,1,0,0,0,0|1,0,0]=3 1351 B9R1.15 OCC1=C(I)C=CC=C1 K45967 [1,1,0,0,0,0|2,0,0]=4 1352 B9R1.15 OCC1=CC=CN=C1Br B69414 [1,1,0,0,0,0|1,0,0]=3 1353 B9R1.15 OCC1=CC=CN=C1Cl C0580 [1,1,0,0,0,0|1,0,0]=3 1354 B9R1.15 OCC1=CC=CN=C1F F42930 [1,1,0,0,0,0|1,0,0]=3 1355 B9R1.15 OCC1=NC=CN=C1Cl C1612 [1,1,0,0,0,0|2,0,0]=4 1356 B9R1.69 BrC1=CC(I)=C(Br)C=N1 D61974 [1,1,0,0,0,0|2,0,0]=4 1357 B9R1.69 CC1=C(Br)C=C(Br)C=C1 D45155 [1,1,0,0,0,0|2,0,0]=4 1358 B9R1.69 CC1=C(Br)C=C(Br)C=N1 D15335 [1,1,0,0,0,0|1,0,0]=3 1359 B9R1.69 CC1=C(Br)C=C(Cl)N=C1 B9888 [1,1,0,0,0,0|1,0,0]=3 1360 B9R1.69 CC1=C(Br)C=C(F)C=C1 B68836 [1,1,0,0,0,0|2,0,0]=4 1361 B9R1.69 CC1=C(Br)C=C(I)C=C1 B45176 [1,1,0,0,0,0|2,0,0]=4 1362 B9R1.69 CC1=C(Br)C=C(N)C=C1 B39411 [1,1,0,0,0,0|2,0,0]=4 1363 B9R1.69 CC1=C(Br)C=C(N)C=N1 B0530 [1,1,0,0,0,0|1,0,0]=3 1364 B9R1.69 CC1=C(Br)C=C(N)N=C1 B16154 [1,1,0,0,0,0|1,0,0]=3 1365 B9R1.69 CC1=C(Br)C=C(O)C=C1 B45948 [1,1,0,0,0,0|2,0,0]=4 1366 B9R1.69 CC1=C(Br)C=C(O)C=N1 B22011 [1,1,0,0,0,0|1,0,0]=3 1367 B9R1.69 CC1=C(Br)C=CC(Br)=N1 D23496 [1,1,0,0,0,0|2,0,0]=4 1368 B9R1.69 CC1=C(Br)C=CC(Cl)=N1 B18652 [1,1,0,0,0,0|2,0,0]=4 1369 B9R1.69 CC1=C(Br)C=CC(F)=N1 B42551 [1,1,0,0,0,0|2,0,0]=4 1370 B9R1.69 CC1=C(Br)C=CC(N)=N1 B5097 [1,1,0,0,0,0|2,0,0]=4 1371 B9R1.69 CC1=C(Br)C=CC(O)=N1 B42887 [1,1,0,0,0,0|2,0,0]=4 1372 B9R1.69 CC1=C(Br)C=NC(Cl)=C1 B25363 [1,1,0,0,0,0|2,0,0]=4 1373 B9R1.69 CC1=C(Br)C=NC(F)=C1 B5184 [1,1,0,0,0,0|2,0,0]=4 1374 B9R1.69 CC1=C(Br)C=NC(N)=C1 A5096 [1,1,0,0,0,0|2,0,0]=4 1375 B9R1.69 CC1=C(Br)C=NC(O)=C1 B21661 [1,1,0,0,0,0|2,0,0]=4 1376 B9R1.69 CC1=C(Br)N=C(Br)N=C1 D40704 [1,1,0,0,0,0|2,0,0]=4 1377 B9R1.69 CC1=C(C)C=C(F)C=C1 F49166 [1,1,0,0,0,0|2,0,0]=4 1378 B9R1.69 CC1=C(C)C=C(I)C=C1 K49170 [1,1,0,0,0,0|2,0,0]=4 1379 B9R1.69 CC1=C(C)C=C([Mg+])C=C1 D31727 [1,1,0,0,0,0|2,0,0]=4 1380 B9R1.69 CC1=C(C)N=C(Br)C=N1 B42969 [1,1,0,0,0,0|2,0,0]=4 1381 B9R1.69 CC1=C(C)N=C(Cl)C=C1 C46102 [1,1,0,0,0,0|1,0,0]=3 1382 B9R1.69 CC1=C(C)N=C(Cl)C=N1 C42990 [1,1,0,0,0,0|2,0,0]=4 1383 B9R1.69 CC1=C(C)N=C(N)C=C1 D24371 [1,1,0,0,0,0|1,0,0]=3 1384 B9R1.69 CC1=C(C)N=C(N)C=N1 D24637 [1,1,0,0,0,0|2,0,0]=4 1385 B9R1.69 CC1=C(C)N=C(N)N=C1 D43338 [1,1,0,0,0,0|2,0,0]=4 1386 B9R1.69 CC1=C(C)NC(=O)C=N1 D43209 [1,1,0,0,0,0|2,0,0]=4 1387 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 B39370 [1,1,0,0,0,0|2,0,0]=4 1388 B9R1.69 CC1=C(Cl)C=C(F)C=C1 C60661 [1,1,0,0,0,0|2,0,0]=4 1389 B9R1.69 CC1=C(Cl)C=C(N)C=C1 C65827 [1,1,0,0,0,0|2,0,0]=4 1390 B9R1.69 CC1=C(Cl)C=C(N)N=C1 C42997 [1,1,0,0,0,0|1,0,0]=3 1391 B9R1.69 CC1=C(Cl)C=C(O)C=C1 C45955 [1,1,0,0,0,0|2,0,0]=4 1392 B9R1.69 CC1=C(Cl)C=C(O)C=N1 C42908 [1,1,0,0,0,0|1,0,0]=3 1393 B9R1.69 CC1=C(Cl)C=C([Mg+])C=C1 C31809 [1,1,0,0,0,0|2,0,0]=4 1394 B9R1.69 CC1=C(Cl)C=CC(Br)=N1 B42536 [1,1,0,0,0,0|2,0,0]=4 1395 B9R1.69 CC1=C(Cl)C=CC(Cl)=N1 D42561 [1,1,0,0,0,0|2,0,0]=4 1396 B9R1.69 CC1=C(Cl)C=CC(N)=N1 C42999 [1,1,0,0,0,0|2,0,0]=4 1397 B9R1.69 CC1=C(Cl)C=CC(O)=N1 C42907 [1,1,0,0,0,0|2,0,0]=4 1398 B9R1.69 CC1=C(Cl)C=NC(N)=C1 A4752 [1,1,0,0,0,0|2,0,0]=4 1399 B9R1.69 CC1=C(Cl)C=NC(O)=C1 C42906 [1,1,0,0,0,0|2,0,0]=4 1400 B9R1.69 CC1=C(Cl)N=C(Cl)N=C1 D4933 [1,1,0,0,0,0|2,0,0]=4 1401 B9R1.69 CC1=C(F)C=C(Br)C=C1 B68837 [1,1,0,0,0,0|2,0,0]=4 1402 B9R1.69 CC1=C(F)C=C(Cl)C=C1 C68878 [1,1,0,0,0,0|2,0,0]=4 1403 B9R1.69 CC1=C(F)C=C(I)C=C1 F45194 [1,1,0,0,0,0|2,0,0]=4 1404 B9R1.69 CC1=C(F)C=C(N)C=C1 F46113 [1,1,0,0,0,0|2,0,0]=4 1405 B9R1.69 CC1=C(F)C=C(O)C=C1 F45960 [1,1,0,0,0,0|2,0,0]=4 1406 B9R1.69 CC1=C(F)C=C([Mg+])C=C1 F31745 [1,1,0,0,0,0|2,0,0]=4 1407 B9R1.69 CC1=C(F)C=CC(Br)=N1 B4782 [1,1,0,0,0,0|2,0,0]=4 1408 B9R1.69 CC1=C(F)C=CC(Cl)=N1 C26077 [1,1,0,0,0,0|2,0,0]=4 1409 B9R1.69 CC1=C(F)C=CC(N)=N1 A16597 [1,1,0,0,0,0|2,0,0]=4 1410 B9R1.69 CC1=C(F)C=NC(N)=C1 A43009 [1,1,0,0,0,0|2,0,0]=4 1411 B9R1.69 CC1=C(I)C=C(Br)C=C1 B37920 [1,1,0,0,0,0|2,0,0]=4 1412 B9R1.69 CC1=C(I)C=C(Cl)C=C1 C38509 [1,1,0,0,0,0|2,0,0]=4 1413 B9R1.69 CC1=C(I)C=C(Cl)N=C1 C42582 [1,1,0,0,0,0|1,0,0]=3 1414 B9R1.69 CC1=C(I)C=C(F)C=C1 F45195 [1,1,0,0,0,0|2,0,0]=4 1415 B9R1.69 CC1=C(I)C=C(F)N=C1 F1115 [1,1,0,0,0,0|1,0,0]=3 1416 B9R1.69 CC1=C(I)C=C(N)C=C1 K46118 [1,1,0,0,0,0|2,0,0]=4 1417 B9R1.69 CC1=C(I)C=C(N)N=C1 I37305 [1,1,0,0,0,0|1,0,0]=3 1418 B9R1.69 CC1=C(I)C=CC(F)=N1 F42596 [1,1,0,0,0,0|2,0,0]=4 1419 B9R1.69 CC1=C(I)C=CC(N)=N1 K43025 [1,1,0,0,0,0|2,0,0]=4 1420 B9R1.69 CC1=C(I)C=NC(Cl)=C1 C42585 [1,1,0,0,0,0|2,0,0]=4 1421 B9R1.69 CC1=C(I)C=NC(F)=C1 F42595 [1,1,0,0,0,0|2,0,0]=4 1422 B9R1.69 CC1=C(I)C=NC(N)=C1 K43026 [1,1,0,0,0,0|2,0,0]=4 1423 B9R1.69 CC1=C(N)C=C(Br)C=C1 B39412 [1,1,0,0,0,0|2,0,0]=4 1424 B9R1.69 CC1=C(N)C=C(I)C=C1 K46121 [1,1,0,0,0,0|2,0,0]=4 1425 B9R1.69 CC1=C(N)C=C(O)C=C1 A38014 [1,1,0,0,0,0|2,0,0]=4 1426 B9R1.69 CC1=C(N)C=CC(Br)=N1 A15124 [1,1,0,0,0,0|2,0,0]=4 1427 B9R1.69 CC1=C(N)C=CC(Cl)=N1 A15123 [1,1,0,0,0,0|2,0,0]=4 1428 B9R1.69 CC1=C(N)N=C(Br)C=C1 B26268 [1,1,0,0,0,0|1,0,0]=3 1429 B9R1.69 CC1=C(N)N=C(Cl)N=C1 A3364 [1,1,0,0,0,0|2,0,0]=4 1430 B9R1.69 CC1=C(O)C=C(Br)C=C1 B45951 [1,1,0,0,0,0|2,0,0]=4 1431 B9R1.69 CC1=C(O)C=C(F)C=C1 F45964 [1,1,0,0,0,0|2,0,0]=4 1432 B9R1.69 CC1=C(O)C=C(O)C=C1 M28674 [1,1,0,0,0,0|2,0,0]=4 1433 B9R1.69 CC1=C(O)C=CC(Br)=N1 B42888 [1,1,0,0,0,0|2,0,0]=4 1434 B9R1.69 CC1=C(O)C=CC(Cl)=N1 C42909 [1,1,0,0,0,0|2,0,0]=4 1435 B9R1.69 CC1=C([Mg+])C=C(F)C=C1 F31748 [1,1,0,0,0,0|2,0,0]=4 1436 B9R1.69 CC1=CC(=O)NN=C1C D15899 [1,1,0,0,0,0|2,0,0]=4 1437 B9R1.69 CC1=CC(Br)=C(Br)C=C1 D45154 [1,1,0,0,0,0|2,0,0]=4 1438 B9R1.69 CC1=CC(Br)=C(C)C=C1 D39511 [1,1,0,0,0,0|1,0,0]=3 1439 B9R1.69 CC1=CC(Br)=C(C)C=N1 B46084 [1,1,0,0,0,0|0,0,0]=2 1440 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 B45156 [1,1,0,0,0,0|2,0,0]=4 1441 B9R1.69 CC1=CC(Br)=C(Cl)C=N1 B17532 [1,1,0,0,0,0|1,0,0]=3 1442 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 B42532 [1,1,0,0,0,0|1,0,0]=3 1443 B9R1.69 CC1=CC(Br)=C(F)C=N1 B32009 [1,1,0,0,0,0|1,0,0]=3 1444 B9R1.69 CC1=CC(Br)=C(F)N=C1 B2994 [1,1,0,0,0,0|1,0,0]=3 1445 B9R1.69 CC1=CC(Br)=C(I)C=C1 B45175 [1,1,0,0,0,0|2,0,0]=4 1446 B9R1.69 CC1=CC(Br)=C(N)N=C1 B21800 [1,1,0,0,0,0|1,0,0]=3 1447 B9R1.69 CC1=CC(Br)=C(O)C=C1 B39403 [1,1,0,0,0,0|2,0,0]=4 1448 B9R1.69 CC1=CC(Br)=C(O)C=N1 B42884 [1,1,0,0,0,0|1,0,0]=3 1449 B9R1.69 CC1=CC(Br)=C(O)N=C1 B21801 [1,1,0,0,0,0|1,0,0]=3 1450 B9R1.69 CC1=CC(Br)=CN=C1Br D1477 [1,1,0,0,0,0|2,0,0]=4 1451 B9R1.69 CC1=CC(Br)=CN=C1C B46085 [1,1,0,0,0,0|1,0,0]=3 1452 B9R1.69 CC1=CC(Br)=CN=C1Cl B22875 [1,1,0,0,0,0|2,0,0]=4 1453 B9R1.69 CC1=CC(Br)=CN=C1F B2992 [1,1,0,0,0,0|2,0,0]=4 1454 B9R1.69 CC1=CC(Br)=CN=C1N B42973 [1,1,0,0,0,0|2,0,0]=4 1455 B9R1.69 CC1=CC(Br)=NC=C1Br D3209 [1,1,0,0,0,0|2,0,0]=4 1456 B9R1.69 CC1=CC(Br)=NC=C1F B42548 [1,1,0,0,0,0|2,0,0]=4 1457 B9R1.69 CC1=CC(Br)=NC=C1N B7909 [1,1,0,0,0,0|2,0,0]=4 1458 B9R1.69 CC1=CC(C)=C(Br)C=C1 D39510 [1,1,0,0,0,0|2,0,0]=4 1459 B9R1.69 CC1=CC(C)=C(Br)C=N1 B46086 [1,1,0,0,0,0|1,0,0]=3 1460 B9R1.69 CC1=CC(C)=C([Mg+])C=C1 D31735 [1,1,0,0,0,0|2,0,0]=4 1461 B9R1.69 CC1=CC(C)=NN=C1Cl C1716 [1,1,0,0,0,0|2,0,0]=4 1462 B9R1.69 CC1=CC(C)=NNC1=O D15210 [1,1,0,0,0,0|2,0,0]=4 1463 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 B67676 [1,1,0,0,0,0|2,0,0]=4 1464 B9R1.69 CC1=CC(Cl)=C(Br)C=N1 B12057 [1,1,0,0,0,0|1,0,0]=3 1465 B9R1.69 CC1=CC(Cl)=C(I)C=C1 C62467 [1,1,0,0,0,0|2,0,0]=4 1466 B9R1.69 CC1=CC(Cl)=C(N)C=C1 C69100 [1,1,0,0,0,0|2,0,0]=4 1467 B9R1.69 CC1=CC(Cl)=C(N)N=C1 C61779 [1,1,0,0,0,0|1,0,0]=3 1468 B9R1.69 CC1=CC(Cl)=C(O)C=C1 C38476 [1,1,0,0,0,0|2,0,0]=4 1469 B9R1.69 CC1=CC(Cl)=CN=C1Br B8272 [1,1,0,0,0,0|2,0,0]=4 1470 B9R1.69 CC1=CC(Cl)=CN=C1Cl D42560 [1,1,0,0,0,0|2,0,0]=4 1471 B9R1.69 CC1=CC(Cl)=CN=C1N C42998 [1,1,0,0,0,0|2,0,0]=4 1472 B9R1.69 CC1=CC(Cl)=CN=C1O C42905 [1,1,0,0,0,0|2,0,0]=4 1473 B9R1.69 CC1=CC(Cl)=NC=C1F C42574 [1,1,0,0,0,0|2,0,0]=4 1474 B9R1.69 CC1=CC(Cl)=NC=C1N C24814 [1,1,0,0,0,0|2,0,0]=4 1475 B9R1.69 CC1=CC(F)=C(Br)C=C1 B39373 [1,1,0,0,0,0|2,0,0]=4 1476 B9R1.69 CC1=CC(F)=C(C)C=C1 F49165 [1,1,0,0,0,0|1,0,0]=3 1477 B9R1.69 CC1=CC(F)=C(Cl)C=C1 C45177 [1,1,0,0,0,0|2,0,0]=4 1478 B9R1.69 CC1=CC(F)=C(F)C=C1 D45188 [1,1,0,0,0,0|2,0,0]=4 1479 B9R1.69 CC1=CC(F)=C(I)C=C1 F45193 [1,1,0,0,0,0|2,0,0]=4 1480 B9R1.69 CC1=CC(F)=C(N)N=C1 F43015 [1,1,0,0,0,0|1,0,0]=3 1481 B9R1.69 CC1=CC(F)=C(O)C=C1 F45958 [1,1,0,0,0,0|2,0,0]=4 1482 B9R1.69 CC1=CC(F)=CN=C1Br B23405 [1,1,0,0,0,0|2,0,0]=4 1483 B9R1.69 CC1=CC(F)=CN=C1Cl C42569 [1,1,0,0,0,0|2,0,0]=4 1484 B9R1.69 CC1=CC(F)=CN=C1N F43018 [1,1,0,0,0,0|2,0,0]=4 1485 B9R1.69 CC1=CC(F)=NC=C1O F42929 [1,1,0,0,0,0|2,0,0]=4 1486 B9R1.69 CC1=CC(I)=C(Br)C=C1 B38445 [1,1,0,0,0,0|2,0,0]=4 1487 B9R1.69 CC1=CC(I)=C(F)C=C1 F45191 [1,1,0,0,0,0|2,0,0]=4 1488 B9R1.69 CC1=CC(I)=C(F)N=C1 F6510 [1,1,0,0,0,0|1,0,0]=3 1489 B9R1.69 CC1=CC(I)=C(N)C=C1 K46116 [1,1,0,0,0,0|2,0,0]=4 1490 B9R1.69 CC1=CC(I)=C(N)N=C1 I29765 [1,1,0,0,0,0|1,0,0]=3 1491 B9R1.69 CC1=CC(I)=C(O)C=C1 K60967 [1,1,0,0,0,0|2,0,0]=4 1492 B9R1.69 CC1=CC(I)=CN=C1Br B42556 [1,1,0,0,0,0|2,0,0]=4 1493 B9R1.69 CC1=CC(I)=CN=C1Cl C42584 [1,1,0,0,0,0|2,0,0]=4 1494 B9R1.69 CC1=CC(I)=CN=C1N K43024 [1,1,0,0,0,0|2,0,0]=4 1495 B9R1.69 CC1=CC(I)=CN=C1O K42936 [1,1,0,0,0,0|2,0,0]=4 1496 B9R1.69 CC1=CC(N)=C(Br)C=C1 B39410 [1,1,0,0,0,0|2,0,0]=4 1497 B9R1.69 CC1=CC(N)=C(Br)C=N1 A1741 [1,1,0,0,0,0|1,0,0]=3 1498 B9R1.69 CC1=CC(N)=C(Cl)C=C1 C46092 [1,1,0,0,0,0|2,0,0]=4 1499 B9R1.69 CC1=CC(N)=C(Cl)C=N1 C26973 [1,1,0,0,0,0|1,0,0]=3 1500 B9R1.69 CC1=CC(N)=C(F)C=C1 A23738 [1,1,0,0,0,0|2,0,0]=4 1501 B9R1.69 CC1=CC(N)=C(I)C=C1 K46117 [1,1,0,0,0,0|2,0,0]=4 1502 B9R1.69 CC1=CC(N)=C(I)C=N1 K43023 [1,1,0,0,0,0|1,0,0]=3 1503 B9R1.69 CC1=CC(N)=C(N)C=C1 D68596 [1,1,0,0,0,0|2,0,0]=4 1504 B9R1.69 CC1=CC(N)=CN=C1Br A42967 [1,1,0,0,0,0|2,0,0]=4 1505 B9R1.69 CC1=CC(N)=CN=C1C D43613 [1,1,0,0,0,0|1,0,0]=3 1506 B9R1.69 CC1=CC(N)=CN=C1Cl C23404 [1,1,0,0,0,0|2,0,0]=4 1507 B9R1.69 CC1=CC(N)=CN=C1F F43017 [1,1,0,0,0,0|2,0,0]=4 1508 B9R1.69 CC1=CC(O)=C(Br)C=C1 B36626 [1,1,0,0,0,0|2,0,0]=4 1509 B9R1.69 CC1=CC(O)=C(Br)C=N1 B42886 [1,1,0,0,0,0|1,0,0]=3 1510 B9R1.69 CC1=CC(O)=C(F)C=C1 F45959 [1,1,0,0,0,0|2,0,0]=4 1511 B9R1.69 CC1=CC(O)=C(N)C=C1 A68595 [1,1,0,0,0,0|2,0,0]=4 1512 B9R1.69 CC1=CC(O)=CN=C1Br B42893 [1,1,0,0,0,0|2,0,0]=4 1513 B9R1.69 CC1=CC(O)=CN=C1Cl C15197 [1,1,0,0,0,0|2,0,0]=4 1514 B9R1.69 CC1=CC(O)=CN=C1F F62152 [1,1,0,0,0,0|2,0,0]=4 1515 B9R1.69 CC1=CC([Mg+])=C(C)C=C1 D31736 [1,1,0,0,0,0|1,0,0]=3 1516 B9R1.69 CC1=CC=C(Br)C(Br)=N1 D42515 [1,1,0,0,0,0|1,0,0]=3 1517 B9R1.69 CC1=CC=C(C)C(N)=N1 D43611 [1,1,0,0,0,0|0,0,0]=2 1518 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 D42559 [1,1,0,0,0,0|1,0,0]=3 1519 B9R1.69 CC1=CC=C(Cl)N=C1Cl D24399 [1,1,0,0,0,0|1,0,0]=3 1520 B9R1.69 CC1=CC=C(F)C(Br)=N1 B23352 [1,1,0,0,0,0|1,0,0]=3 1521 B9R1.69 CC1=CC=C(F)C(Cl)=N1 C42573 [1,1,0,0,0,0|1,0,0]=3 1522 B9R1.69 CC1=CC=C(F)N=C1Br B17536 [1,1,0,0,0,0|1,0,0]=3 1523 B9R1.69 CC1=CC=C(N)C(Br)=N1 B37081 [1,1,0,0,0,0|1,0,0]=3 1524 B9R1.69 CC1=CC=C(N)C(C)=N1 D43608 [1,1,0,0,0,0|1,0,0]=3 1525 B9R1.69 CC1=CC=C(N)C(Cl)=N1 A42987 [1,1,0,0,0,0|1,0,0]=3 1526 B9R1.69 CC1=CC=C(N)C(I)=N1 K43022 [1,1,0,0,0,0|1,0,0]=3 1527 B9R1.69 CC1=CC=C(N)N=C1Br B26269 [1,1,0,0,0,0|1,0,0]=3 1528 B9R1.69 CC1=CC=C(N)N=C1Cl C23697 [1,1,0,0,0,0|1,0,0]=3 1529 B9R1.69 CC1=CC=C(N)N=C1N M43333 [1,1,0,0,0,0|1,0,0]=3 1530 B9R1.69 CC1=CC=C(O)C(Br)=N1 B1020 [1,1,0,0,0,0|1,0,0]=3 1531 B9R1.69 CC1=CC=C(O)C(F)=N1 F42928 [1,1,0,0,0,0|1,0,0]=3 1532 B9R1.69 CC1=CC=C(O)C(I)=N1 H37772 [1,1,0,0,0,0|1,0,0]=3 1533 B9R1.69 CC1=CN=C(Br)C(Br)=C1 D42517 [1,1,0,0,0,0|1,0,0]=3 1534 B9R1.69 CC1=CN=C(Br)C(C)=C1 B46080 [1,1,0,0,0,0|1,0,0]=3 1535 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 B42530 [1,1,0,0,0,0|1,0,0]=3 1536 B9R1.69 CC1=CN=C(Br)C(F)=C1 B13540 [1,1,0,0,0,0|1,0,0]=3 1537 B9R1.69 CC1=CN=C(Br)C(N)=C1 A42977 [1,1,0,0,0,0|1,0,0]=3 1538 B9R1.69 CC1=CN=C(Br)C=C1Br D32049 [1,1,0,0,0,0|1,0,0]=3 1539 B9R1.69 CC1=CN=C(Br)C=C1Cl B37311 [1,1,0,0,0,0|1,0,0]=3 1540 B9R1.69 CC1=CN=C(Br)C=C1N B25405 [1,1,0,0,0,0|1,0,0]=3 1541 B9R1.69 CC1=CN=C(C)C(C)=C1 T39433 [1,1,0,0,0,0|0,0,0]=2 1542 B9R1.69 CC1=CN=C(C)C(Cl)=N1 C42989 [1,1,0,0,0,0|1,0,0]=3 1543 B9R1.69 CC1=CN=C(C)C(I)=N1 K43021 [1,1,0,0,0,0|1,0,0]=3 1544 B9R1.69 CC1=CN=C(C)C(N)=N1 D32397 [1,1,0,0,0,0|1,0,0]=3 1545 B9R1.69 CC1=CN=C(C)C=C1N D22447 [1,1,0,0,0,0|0,0,0]=2 1546 B9R1.69 CC1=CN=C(C)N=C1N D43337 [1,1,0,0,0,0|1,0,0]=3 1547 B9R1.69 CC1=CN=C(Cl)C(C)=N1 C42988 [1,1,0,0,0,0|2,0,0]=4 1548 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 D42558 [1,1,0,0,0,0|1,0,0]=3 1549 B9R1.69 CC1=CN=C(Cl)C(Cl)=N1 D40725 [1,1,0,0,0,0|2,0,0]=4 1550 B9R1.69 CC1=CN=C(Cl)C(F)=C1 C42572 [1,1,0,0,0,0|1,0,0]=3 1551 B9R1.69 CC1=CN=C(Cl)C(N)=C1 C42993 [1,1,0,0,0,0|1,0,0]=3 1552 B9R1.69 CC1=CN=C(Cl)C(N)=N1 C39122 [1,1,0,0,0,0|2,0,0]=4 1553 B9R1.69 CC1=CN=C(Cl)C(O)=C1 C42904 [1,1,0,0,0,0|1,0,0]=3 1554 B9R1.69 CC1=CN=C(Cl)C=C1Cl D38063 [1,1,0,0,0,0|1,0,0]=3 1555 B9R1.69 CC1=CN=C(Cl)C=C1F C37310 [1,1,0,0,0,0|1,0,0]=3 1556 B9R1.69 CC1=CN=C(Cl)C=C1N C25406 [1,1,0,0,0,0|1,0,0]=3 1557 B9R1.69 CC1=CN=C(I)C(C)=N1 K63360 [1,1,0,0,0,0|2,0,0]=4 1558 B9R1.69 CC1=CN=C(N)C(=O)N1 A41143 [1,1,0,0,0,0|2,0,0]=4 1559 B9R1.69 CC1=CN=C(N)C(Br)=N1 B41061 [1,1,0,0,0,0|2,0,0]=4 1560 B9R1.69 CC1=CN=C(N)C(C)=C1 D43610 [1,1,0,0,0,0|1,0,0]=3 1561 B9R1.69 CC1=CN=C(N)C(Cl)=N1 C41076 [1,1,0,0,0,0|2,0,0]=4 1562 B9R1.69 CC1=CN=C(N)C(N)=C1 D43331 [1,1,0,0,0,0|1,0,0]=3 1563 B9R1.69 CC1=CN=C(N)C=C1C D43612 [1,1,0,0,0,0|1,0,0]=3 1564 B9R1.69 CC1=CN=C(N)N=C1Cl C10001 [1,1,0,0,0,0|2,0,0]=4 1565 B9R1.69 CC1=CN=C(N)NC1=O A63134 [1,1,0,0,0,0|2,0,0]=4 1566 B9R1.69 CC1=CN=C(O)C=C1N A43204 [1,1,0,0,0,0|1,0,0]=3 1567 B9R1.69 CC1=CNC(=O)C(C)=N1 D69506 [1,1,0,0,0,0|2,0,0]=4 1568 B9R1.69 CC1=CNC(=O)C(Cl)=N1 C40933 [1,1,0,0,0,0|2,0,0]=4 1569 B9R1.69 CC1=CNC(=O)C(N)=C1 A43211 [1,1,0,0,0,0|1,0,1]=4 1570 B9R1.69 CC1=NC(C)=C(Br)C=C1 B46082 [1,1,0,0,0,0|1,0,0]=3 1571 B9R1.69 CC1=NC(C)=C(Br)C=N1 B42971 [1,1,0,0,0,0|2,0,0]=4 1572 B9R1.69 CC1=NC(C)=C(N)C=N1 D43336 [1,1,0,0,0,0|2,0,0]=4 1573 B9R1.69 CC1=NC(C)=C(O)C=C1 D67987 [1,1,0,0,0,0|1,0,0]=3 1574 B9R1.69 CC1=NC(C)=C(O)C=N1 D43192 [1,1,0,0,0,0|2,0,0]=4 1575 B9R1.69 CC1=NC(Cl)=C(Br)C=C1 B42526 [1,1,0,0,0,0|1,0,0]=3 1576 B9R1.69 CC1=NC(Cl)=C(Br)C=N1 B25786 [1,1,0,0,0,0|2,0,0]=4 1577 B9R1.69 CC1=NC(F)=C(Br)C=C1 B42546 [1,1,0,0,0,0|1,0,0]=3 1578 B9R1.69 CC1=NC(F)=C(I)C=C1 F42594 [1,1,0,0,0,0|1,0,0]=3 1579 B9R1.69 CC1=NC(N)=C(Br)C=C1 B18303 [1,1,0,0,0,0|1,0,0]=3 1580 B9R1.69 CC1=NC(N)=C(Br)C=N1 B41065 [1,1,0,0,0,0|2,0,0]=4 1581 B9R1.69 CC1=NC(N)=C(Cl)C=N1 C41080 [1,1,0,0,0,0|2,0,0]=4 1582 B9R1.69 CC1=NC(N)=C(F)C=N1 F41083 [1,1,0,0,0,0|2,0,0]=4 1583 B9R1.69 CC1=NC(N)=C(I)C=C1 K61473 [1,1,0,0,0,0|1,0,0]=3 1584 B9R1.69 CC1=NC(N)=C(O)C=C1 A43201 [1,1,0,0,0,0|1,0,0]=3 1585 B9R1.69 CC1=NC(O)=C(Br)C=C1 B42882 [1,1,0,0,0,0|1,0,0]=3 1586 B9R1.69 CC1=NC(O)=C(Br)C=N1 B40917 [1,1,0,0,0,0|2,0,0]=4 1587 B9R1.69 CC1=NC(O)=C(F)C=N1 F40940 [1,1,0,0,0,0|2,0,0]=4 1588 B9R1.69 CC1=NC=C(Br)C=C1Cl B8062 [1,1,0,0,0,0|1,0,0]=3 1589 B9R1.69 CC1=NC=C(Br)C=C1F B16887 [1,1,0,0,0,0|1,0,0]=3 1590 B9R1.69 CC1=NC=C(Br)C=C1N A0082 [1,1,0,0,0,0|1,0,0]=3 1591 B9R1.69 CC1=NC=C(Br)C=C1O B42885 [1,1,0,0,0,0|1,0,0]=3 1592 B9R1.69 CC1=NC=C(Cl)C(=O)N1 C40935 [1,1,0,0,0,0|2,0,0]=4 1593 B9R1.69 CC1=NC=C(Cl)C(Cl)=N1 D40727 [1,1,0,0,0,0|2,0,0]=4 1594 B9R1.69 CC1=NC=C(Cl)C=C1N A1755 [1,1,0,0,0,0|1,0,0]=3 1595 B9R1.69 CC1=NC=C(F)C(Cl)=N1 C36910 [1,1,0,0,0,0|2,0,0]=4 1596 B9R1.69 CC1=NC=C(N)C(Cl)=N1 C41079 [1,1,0,0,0,0|2,0,0]=4 1597 B9R1.69 CC1=NC=C(N)N=C1Br B41063 [1,1,0,0,0,0|2,0,0]=4 1598 B9R1.69 CC1=NN=C(Cl)C=C1Cl D32267 [1,1,0,0,0,0|2,0,0]=4 1599 B9R1.69 CC1=NNC(=O)C(Br)=C1 B38674 [1,1,0,0,0,0|2,0,0]=4 1600 B9R1.69 CC1=NNC(=O)C(N)=C1 A19341 [1,1,0,0,0,0|2,0,0]=4 1601 B9R1.69 CN1C=NC(Cl)=CC1=O C40937 [1,1,0,0,0,0|2,0,0]=4 1602 B9R1.69 CN1N=CC(I)=CC1=O I12967 [1,1,0,0,0,0|2,0,0]=4 1603 B9R1.69 CN1N=CC(N)=CC1=O A12961 [1,1,0,0,0,0|2,0,0]=4 1604 B9R1.69 ClC1=C(Br)C=C(Br)C=N1 D4524 [1,1,0,0,0,0|2,0,0]=4 1605 B9R1.69 ClC1=C(I)C=C(Br)C=N1 B40517 [1,1,0,0,0,0|2,0,0]=4 1606 B9R1.69 ClC1=C(I)C=C(I)C=N1 C40534 [1,1,0,0,0,0|2,0,0]=4 1607 B9R1.69 ClC1=C(I)C=CC(Br)=N1 B67565 [1,1,0,0,0,0|2,0,0]=4 1608 B9R1.69 ClC1=C(I)C=NC(Br)=C1 B61440 [1,1,0,0,0,0|2,0,0]=4 1609 B9R1.69 ClC1=CC(Br)=C(Br)C=N1 D62935 [1,1,0,0,0,0|2,0,0]=4 1610 B9R1.69 ClC1=CC(Br)=C(Cl)C=N1 B37675 [1,1,0,0,0,0|2,0,0]=4 1611 B9R1.69 ClC1=CC(Br)=C(Cl)N=C1 B40505 [1,1,0,0,0,0|2,0,0]=4 1612 B9R1.69 ClC1=CC(Br)=CN=C1Br D3046 [1,1,0,0,0,0|2,0,0]=4 1613 B9R1.69 ClC1=CC(Br)=CN=C1Cl B4728 [1,1,0,0,0,0|2,0,0]=4 1614 B9R1.69 ClC1=CC(Br)=NC=C1Br D40498 [1,1,0,0,0,0|2,0,0]=4 1615 B9R1.69 ClC1=CC(Cl)=C(Br)C=N1 B40506 [1,1,0,0,0,0|2,0,0]=4 1616 B9R1.69 ClC1=CC(Cl)=C(I)C=N1 D32226 [1,1,0,0,0,0|2,0,0]=4 1617 B9R1.69 ClC1=CC(I)=C(Cl)C=N1 D40528 [1,1,0,0,0,0|2,0,0]=4 1618 B9R1.69 ClC1=CC(I)=C(Cl)N=C1 D40527 [1,1,0,0,0,0|2,0,0]=4 1619 B9R1.69 ClC1=CC(I)=CN=C1Cl D15369 [1,1,0,0,0,0|2,0,0]=4 1620 B9R1.69 ClC1=CC=C(Br)C(Br)=N1 D40497 [1,1,0,0,0,0|2,0,0]=4 1621 B9R1.69 ClC1=CC=C(Cl)C(Cl)=N1 T40529 [1,1,0,0,0,0|2,0,0]=4 1622 B9R1.69 ClC1=CN=C(Br)C(Br)=C1 D5204 [1,1,0,0,0,0|2,0,0]=4 1623 B9R1.69 ClC1=CN=C(Br)C(Cl)=C1 B4706 [1,1,0,0,0,0|2,0,0]=4 1624 B9R1.69 ClC1=CN=C(Br)C=C1Cl B40503 [1,1,0,0,0,0|2,0,0]=4 1625 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 T67406 [1,1,0,0,0,0|2,0,0]=4 1626 B9R1.69 ClC1=CN=C(Cl)C=C1Cl T24276 [1,1,0,0,0,0|2,0,0]=4 1627 B9R1.69 ClC1=CN=C(I)C(Br)=C1 B40516 [1,1,0,0,0,0|2,0,0]=4 1628 B9R1.69 ClC1=NC(Cl)=C(Br)C=C1 D38502 [1,1,0,0,0,0|2,0,0]=4 1629 B9R1.69 ClC1=NC(Cl)=C(I)C=C1 D4526 [1,1,0,0,0,0|2,0,0]=4 1630 B9R1.69 ClC1=NC=C(I)C=C1Br B40515 [1,1,0,0,0,0|2,0,0]=4 1631 B9R1.69 FC1=C(Br)C=C(Br)C=N1 D38481 [1,1,0,0,0,0|2,0,0]=4 1632 B9R1.69 FC1=C(Br)C=C(Cl)C=N1 B40511 [1,1,0,0,0,0|2,0,0]=4 1633 B9R1.69 FC1=C(Br)C=C(Cl)N=C1 P26079 [1,1,0,0,0,0|2,0,0]=4 1634 B9R1.69 FC1=C(Br)C=CC(Cl)=N1 B40512 [1,1,0,0,0,0|2,0,0]=4 1635 B9R1.69 FC1=C(Br)C=NC(Cl)=C1 B40514 [1,1,0,0,0,0|2,0,0]=4 1636 B9R1.69 FC1=C(Cl)C=C(Cl)C=N1 F40524 [1,1,0,0,0,0|2,0,0]=4 1637 B9R1.69 FC1=C(F)N=C(Br)C=C1 B18110 [1,1,0,0,0,0|2,0,0]=4 1638 B9R1.69 FC1=C(I)C=C(Br)N=C1 B13657 [1,1,0,0,0,0|2,0,0]=4 1639 B9R1.69 FC1=C(I)C=C(Cl)C=N1 C40533 [1,1,0,0,0,0|2,0,0]=4 1640 B9R1.69 FC1=C(I)C=C(Cl)N=C1 C26072 [1,1,0,0,0,0|2,0,0]=4 1641 B9R1.69 FC1=C(I)C=CC(Cl)=N1 C61937 [1,1,0,0,0,0|2,0,0]=4 1642 B9R1.69 FC1=CC(Br)=C(Cl)C=N1 B32075 [1,1,0,0,0,0|2,0,0]=4 1643 B9R1.69 FC1=CC(Br)=C(Cl)N=C1 B40509 [1,1,0,0,0,0|2,0,0]=4 1644 B9R1.69 FC1=CC(Br)=C(F)N=C1 B17516 [1,1,0,0,0,0|2,0,0]=4 1645 B9R1.69 FC1=CC(Br)=CN=C1Br D5207 [1,1,0,0,0,0|2,0,0]=4 1646 B9R1.69 FC1=CC(Br)=CN=C1Cl B2299 [1,1,0,0,0,0|2,0,0]=4 1647 B9R1.69 FC1=CC(Br)=CN=C1F B5203 [1,1,0,0,0,0|2,0,0]=4 1648 B9R1.69 FC1=CC(Cl)=C(F)C=N1 C40532 [1,1,0,0,0,0|2,0,0]=4 1649 B9R1.69 FC1=CC(Cl)=C(F)N=C1 C32247 [1,1,0,0,0,0|2,0,0]=4 1650 B9R1.69 FC1=CC(Cl)=CN=C1Br B5202 [1,1,0,0,0,0|2,0,0]=4 1651 B9R1.69 FC1=CC(Cl)=CN=C1Cl D5206 [1,1,0,0,0,0|2,0,0]=4 1652 B9R1.69 FC1=CC(Cl)=CN=C1F C4649 [1,1,0,0,0,0|2,0,0]=4 1653 B9R1.69 FC1=CC(I)=C(Cl)C=N1 C24772 [1,1,0,0,0,0|2,0,0]=4 1654 B9R1.69 FC1=CC(I)=C(F)C=N1 D40537 [1,1,0,0,0,0|2,0,0]=4 1655 B9R1.69 FC1=CC(I)=CN=C1F D40535 [1,1,0,0,0,0|2,0,0]=4 1656 B9R1.69 FC1=CC=C(Br)N=C1Br D40500 [1,1,0,0,0,0|2,0,0]=4 1657 B9R1.69 FC1=CC=C(Cl)N=C1Cl D40523 [1,1,0,0,0,0|2,0,0]=4 1658 B9R1.69 FC1=CN=C(Br)C(Br)=C1 D40499 [1,1,0,0,0,0|2,0,0]=4 1659 B9R1.69 FC1=CN=C(Br)C(Cl)=C1 B40507 [1,1,0,0,0,0|2,0,0]=4 1660 B9R1.69 FC1=CN=C(Br)C(F)=C1 B3435 [1,1,0,0,0,0|2,0,0]=4 1661 B9R1.69 FC1=CN=C(Cl)C(Cl)=C1 D32190 [1,1,0,0,0,0|2,0,0]=4 1662 B9R1.69 FC1=CN=C(Cl)C=C1Cl D40522 [1,1,0,0,0,0|2,0,0]=4 1663 B9R1.69 FC1=CN=C(F)C(F)=C1 T40539 [1,1,0,0,0,0|2,0,0]=4 1664 B9R1.69 FC1=NC(F)=C(Br)C=C1 B5205 [1,1,0,0,0,0|2,0,0]=4 1665 B9R1.69 FC1=NC(F)=C(I)C=C1 D24901 [1,1,0,0,0,0|2,0,0]=4 1666 B9R1.69 FC1=NC=C(Br)C=C1Cl B27815 [1,1,0,0,0,0|2,0,0]=4 1667 B9R1.69 NC1=C(Br)C=C(Br)C=N1 A67470 [1,1,0,0,0,0|2,0,0]=4 1668 B9R1.69 NC1=C(Br)C=C(Cl)C=N1 B39169 [1,1,0,0,0,0|2,0,0]=4 1669 B9R1.69 NC1=C(Br)C=C(F)C=N1 A40715 [1,1,0,0,0,0|2,0,0]=4 1670 B9R1.69 NC1=C(Br)C=CC(Cl)=N1 B62185 [1,1,0,0,0,0|2,0,0]=4 1671 B9R1.69 NC1=C(Br)C=CC(F)=N1 B40713 [1,1,0,0,0,0|2,0,0]=4 1672 B9R1.69 NC1=C(Br)C=NC(Cl)=C1 A12849 [1,1,0,0,0,0|2,0,0]=4 1673 B9R1.69 NC1=C(Br)C=NC(F)=C1 A10498 [1,1,0,0,0,0|2,0,0]=4 1674 B9R1.69 NC1=C(Cl)C=C(Cl)C=N1 D40722 [1,1,0,0,0,0|2,0,0]=4 1675 B9R1.69 NC1=C(Cl)C=C(F)C=N1 C40733 [1,1,0,0,0,0|2,0,0]=4 1676 B9R1.69 NC1=C(Cl)C=CC(Cl)=N1 A22985 [1,1,0,0,0,0|2,0,0]=4 1677 B9R1.69 NC1=C(Cl)N=C(Br)C=C1 B40710 [1,1,0,0,0,0|2,0,0]=4 1678 B9R1.69 NC1=C(F)C=C(F)C=N1 A9006 [1,1,0,0,0,0|2,0,0]=4 1679 B9R1.69 NC1=C(F)C=CC(Br)=N1 B19236 [1,1,0,0,0,0|2,0,0]=4 1680 B9R1.69 NC1=C(F)C=CC(Cl)=N1 C37118 [1,1,0,0,0,0|2,0,0]=4 1681 B9R1.69 NC1=C(F)C=CC(F)=N1 D40748 [1,1,0,0,0,0|2,0,0]=4 1682 B9R1.69 NC1=C(F)N=C(Br)C=C1 B61668 [1,1,0,0,0,0|2,0,0]=4 1683 B9R1.69 NC1=C(I)C=C(Br)C=N1 B28657 [1,1,0,0,0,0|2,0,0]=4 1684 B9R1.69 NC1=C(I)C=C(Cl)C=N1 A37985 [1,1,0,0,0,0|2,0,0]=4 1685 B9R1.69 NC1=C(I)C=C(F)C=N1 A40753 [1,1,0,0,0,0|2,0,0]=4 1686 B9R1.69 NC1=C(I)C=C(I)C=N1 D38304 [1,1,0,0,0,0|2,0,0]=4 1687 B9R1.69 NC1=C(I)C=CC(Cl)=N1 C40742 [1,1,0,0,0,0|2,0,0]=4 1688 B9R1.69 NC1=C(I)C=NC(Cl)=C1 A6266 [1,1,0,0,0,0|2,0,0]=4 1689 B9R1.69 NC1=C(N)N=C(Br)C=C1 B9494 [1,1,0,0,0,0|2,0,0]=4 1690 B9R1.69 NC1=C(N)N=C(Cl)C=C1 C10347 [1,1,0,0,0,0|2,0,0]=4 1691 B9R1.69 NC1=C(O)C=CC(Br)=N1 A32027 [1,1,0,0,0,0|2,0,0]=4 1692 B9R1.69 NC1=CC(Br)=C(Br)C=N1 D40702 [1,1,0,0,0,0|2,0,0]=4 1693 B9R1.69 NC1=CC(Br)=C(Cl)C=N1 B17074 [1,1,0,0,0,0|2,0,0]=4 1694 B9R1.69 NC1=CC(Br)=C(Cl)N=C1 C13528 [1,1,0,0,0,0|2,0,0]=4 1695 B9R1.69 NC1=CC(Br)=C(F)N=C1 B40714 [1,1,0,0,0,0|2,0,0]=4 1696 B9R1.69 NC1=CC(Br)=C(I)C=N1 B40718 [1,1,0,0,0,0|2,0,0]=4 1697 B9R1.69 NC1=CC(Br)=C(N)N=C1 B41055 [1,1,0,0,0,0|2,0,0]=4 1698 B9R1.69 NC1=CC(Br)=CN=C1Br A0402 [1,1,0,0,0,0|2,0,0]=4 1699 B9R1.69 NC1=CC(Br)=CN=C1Cl A7566 [1,1,0,0,0,0|2,0,0]=4 1700 B9R1.69 NC1=CC(Br)=CN=C1I B37691 [1,1,0,0,0,0|2,0,0]=4 1701 B9R1.69 NC1=CC(Br)=CN=C1N B10892 [1,1,0,0,0,0|2,0,0]=4 1702 B9R1.69 NC1=CC(Br)=NC=C1Br D40701 [1,1,0,0,0,0|2,0,0]=4 1703 B9R1.69 NC1=CC(Cl)=C(Br)C=N1 B0633 [1,1,0,0,0,0|2,0,0]=4 1704 B9R1.69 NC1=CC(Cl)=C(Cl)C=N1 D12103 [1,1,0,0,0,0|2,0,0]=4 1705 B9R1.69 NC1=CC(Cl)=C(I)C=N1 C40740 [1,1,0,0,0,0|2,0,0]=4 1706 B9R1.69 NC1=CC(Cl)=CN=C1Br A4558 [1,1,0,0,0,0|2,0,0]=4 1707 B9R1.69 NC1=CC(Cl)=CN=C1Cl A40724 [1,1,0,0,0,0|2,0,0]=4 1708 B9R1.69 NC1=CC(Cl)=CN=C1O A40932 [1,1,0,0,0,0|2,0,0]=4 1709 B9R1.69 NC1=CC(Cl)=NC=C1Cl D23549 [1,1,0,0,0,0|2,0,0]=4 1710 B9R1.69 NC1=CC(Cl)=NC=C1F C9054 [1,1,0,0,0,0|2,0,0]=4 1711 B9R1.69 NC1=CC(Cl)=NC=C1O A37620 [1,1,0,0,0,0|2,0,0]=4 1712 B9R1.69 NC1=CC(F)=C(Br)C=N1 B26749 [1,1,0,0,0,0|2,0,0]=4 1713 B9R1.69 NC1=CC(F)=C(Cl)C=N1 C40735 [1,1,0,0,0,0|2,0,0]=4 1714 B9R1.69 NC1=CC(F)=C(F)C=N1 D40749 [1,1,0,0,0,0|2,0,0]=4 1715 B9R1.69 NC1=CC(F)=C(I)C=N1 F40752 [1,1,0,0,0,0|2,0,0]=4 1716 B9R1.69 NC1=CC(F)=CN=C1Br A40716 [1,1,0,0,0,0|2,0,0]=4 1717 B9R1.69 NC1=CC(F)=CN=C1Cl C40732 [1,1,0,0,0,0|2,0,0]=4 1718 B9R1.69 NC1=CC(F)=CN=C1N F38160 [1,1,0,0,0,0|2,0,0]=4 1719 B9R1.69 NC1=CC(I)=C(Br)N=C1 B40721 [1,1,0,0,0,0|2,0,0]=4 1720 B9R1.69 NC1=CC(I)=C(F)C=N1 F29709 [1,1,0,0,0,0|2,0,0]=4 1721 B9R1.69 NC1=CC(I)=CN=C1Cl C40738 [1,1,0,0,0,0|2,0,0]=4 1722 B9R1.69 NC1=CC(N)=C(Br)C=N1 B41057 [1,1,0,0,0,0|2,0,0]=4 1723 B9R1.69 NC1=CC=C(Br)C(Br)=N1 D26249 [1,1,0,0,0,0|2,0,0]=4 1724 B9R1.69 NC1=CC=C(Br)C(I)=N1 B40719 [1,1,0,0,0,0|2,0,0]=4 1725 B9R1.69 NC1=CC=C(Br)N=C1Br A12896 [1,1,0,0,0,0|2,0,0]=4 1726 B9R1.69 NC1=CC=C(Br)N=C1I B40720 [1,1,0,0,0,0|2,0,0]=4 1727 B9R1.69 NC1=CC=C(Cl)C(Br)=N1 B29470 [1,1,0,0,0,0|2,0,0]=4 1728 B9R1.69 NC1=CC=C(Cl)N=C1Br A15005 [1,1,0,0,0,0|2,0,0]=4 1729 B9R1.69 NC1=CC=C(Cl)N=C1Cl A4557 [1,1,0,0,0,0|2,0,0]=4 1730 B9R1.69 NC1=CC=C(Cl)N=C1I C40741 [1,1,0,0,0,0|2,0,0]=4 1731 B9R1.69 NC1=CC=C(F)N=C1Br B40712 [1,1,0,0,0,0|2,0,0]=4 1732 B9R1.69 NC1=CC=C(F)N=C1F D40745 [1,1,0,0,0,0|2,0,0]=4 1733 B9R1.69 NC1=CC=C(N)C(Br)=N1 B41058 [1,1,0,0,0,0|2,0,0]=4 1734 B9R1.69 NC1=CN=C(Br)C(Br)=C1 D40703 [1,1,0,0,0,0|2,0,0]=4 1735 B9R1.69 NC1=CN=C(Br)C(Cl)=C1 B37743 [1,1,0,0,0,0|2,0,0]=4 1736 B9R1.69 NC1=CN=C(Br)C=C1Br D23993 [1,1,0,0,0,0|2,0,0]=4 1737 B9R1.69 NC1=CN=C(Br)C=C1N B9140 [1,1,0,0,0,0|2,0,0]=4 1738 B9R1.69 NC1=CN=C(Cl)C(Cl)=C1 A38934 [1,1,0,0,0,0|2,0,0]=4 1739 B9R1.69 NC1=CN=C(Cl)C(F)=C1 C40736 [1,1,0,0,0,0|2,0,0]=4 1740 B9R1.69 NC1=CN=C(Cl)C(N)=C1 C41071 [1,1,0,0,0,0|2,0,0]=4 1741 B9R1.69 NC1=CN=C(Cl)C=C1Cl D25105 [1,1,0,0,0,0|2,0,0]=4 1742 B9R1.69 NC1=CN=C(Cl)C=C1N C3941 [1,1,0,0,0,0|2,0,0]=4 1743 B9R1.69 NC1=CN=C(N)C=C1N P41207 [1,1,0,0,0,0|2,0,0]=4 1744 B9R1.69 NC1=NC(Cl)=C(Br)C=C1 B23269 [1,1,0,0,0,0|2,0,0]=4 1745 B9R1.69 NC1=NC(Cl)=C(I)C=C1 C40743 [1,1,0,0,0,0|2,0,0]=4 1746 B9R1.69 NC1=NC(F)=C(I)C=C1 F62026 [1,1,0,0,0,0|2,0,0]=4 1747 B9R1.69 NC1=NC(N)=C(Br)C=C1 B3719 [1,1,0,0,0,0|2,0,0]=4 1748 B9R1.69 NC1=NC=C(Br)C=C1Cl B23403 [1,1,0,0,0,0|2,0,0]=4 1749 B9R1.69 NC1=NC=C(Br)C=C1F B25193 [1,1,0,0,0,0|2,0,0]=4 1750 B9R1.69 NC1=NC=C(Br)C=C1O A28669 [1,1,0,0,0,0|2,0,0]=4 1751 B9R1.69 NC1=NC=C(Cl)C=C1F C40734 [1,1,0,0,0,0|2,0,0]=4 1752 B9R1.69 NC1=NC=C(Cl)C=C1O A40927 [1,1,0,0,0,0|2,0,0]=4 1753 B9R1.69 NC1=NC=C(I)C=C1Br B29918 [1,1,0,0,0,0|2,0,0]=4 1754 B9R1.69 NC1=NC=C(I)C=C1F F40751 [1,1,0,0,0,0|2,0,0]=4 1755 B9R1.69 OC1=C(Br)C=C(Br)C=N1 D40657 [1,1,0,0,0,0|2,0,0]=4 1756 B9R1.69 OC1=C(Br)C=C(Cl)C=N1 B37047 [1,1,0,0,0,0|2,0,0]=4 1757 B9R1.69 OC1=C(Br)C=NC(Cl)=C1 B40661 [1,1,0,0,0,0|2,0,0]=4 1758 B9R1.69 OC1=C(Br)N=C(I)C=C1 B63091 [1,1,0,0,0,0|2,0,0]=4 1759 B9R1.69 OC1=C(Cl)N=C(I)C=C1 C21995 [1,1,0,0,0,0|2,0,0]=4 1760 B9R1.69 OC1=C(F)N=C(Br)C=C1 B40664 [1,1,0,0,0,0|2,0,0]=4 1761 B9R1.69 OC1=C(F)N=C(Cl)C=C1 C40679 [1,1,0,0,0,0|2,0,0]=4 1762 B9R1.69 OC1=C(I)C=C(I)C=N1 D40684 [1,1,0,0,0,0|2,0,0]=4 1763 B9R1.69 OC1=C(I)C=NC(Cl)=C1 C10773 [1,1,0,0,0,0|2,0,0]=4 1764 B9R1.69 OC1=CC(Br)=C(Cl)N=C1 B18505 [1,1,0,0,0,0|2,0,0]=4 1765 B9R1.69 OC1=CC(Br)=C(F)C=N1 B26078 [1,1,0,0,0,0|2,0,0]=4 1766 B9R1.69 OC1=CC(Br)=C(F)N=C1 B40663 [1,1,0,0,0,0|2,0,0]=4 1767 B9R1.69 OC1=CC(Br)=CN=C1Br D40655 [1,1,0,0,0,0|2,0,0]=4 1768 B9R1.69 OC1=CC(Br)=CN=C1Cl B9981 [1,1,0,0,0,0|2,0,0]=4 1769 B9R1.69 OC1=CC(Br)=CN=C1O B36779 [1,1,0,0,0,0|2,0,0]=4 1770 B9R1.69 OC1=CC(Br)=NC=C1F B40662 [1,1,0,0,0,0|2,0,0]=4 1771 B9R1.69 OC1=CC(Cl)=C(F)N=C1 C40678 [1,1,0,0,0,0|2,0,0]=4 1772 B9R1.69 OC1=CC(Cl)=CN=C1Br B37041 [1,1,0,0,0,0|2,0,0]=4 1773 B9R1.69 OC1=CC(Cl)=CN=C1O C40837 [1,1,0,0,0,0|2,0,0]=4 1774 B9R1.69 OC1=CC(F)=CN=C1Cl C40676 [1,1,0,0,0,0|2,0,0]=4 1775 B9R1.69 OC1=CC=C(Br)N=C1Br D39120 [1,1,0,0,0,0|2,0,0]=4 1776 B9R1.69 OC1=CC=C(Br)N=C1I B40667 [1,1,0,0,0,0|2,0,0]=4 1777 B9R1.69 OC1=CC=C(Cl)C(Cl)=N1 D40675 [1,1,0,0,0,0|2,0,0]=4 1778 B9R1.69 OC1=CC=C(Cl)N=C1Cl D40669 [1,1,0,0,0,0|2,0,0]=4 1779 B9R1.69 OC1=CC=C(Cl)N=C1I C40681 [1,1,0,0,0,0|2,0,0]=4 1780 B9R1.69 OC1=CC=C(F)N=C1F D40683 [1,1,0,0,0,0|2,0,0]=4 1781 B9R1.69 OC1=CC=C(F)N=C1I F22349 [1,1,0,0,0,0|2,0,0]=4 1782 B9R1.69 OC1=CN=C(Br)C(Cl)=C1 B40660 [1,1,0,0,0,0|2,0,0]=4 1783 B9R1.69 OC1=CN=C(Cl)C(Cl)=C1 D40671 [1,1,0,0,0,0|2,0,0]=4 1784 B9R1.69 OC1=CN=C(Cl)C(F)=C1 C25929 [1,1,0,0,0,0|2,0,0]=4 1785 B9R1.69 OC1=CN=C(F)C=C1F D67338 [1,1,0,0,0,0|2,0,0]=4 1786 B9R1.69 OC1=NC=C(Cl)C=C1F C40677 [1,1,0,0,0,0|2,0,0]=4 1787 B9R1.69 OC1=NC=C(I)C=C1Br B40666 [1,1,0,0,0,0|2,0,0]=4 1788 B9R1.7 CC1=CC=C(CCO)O1 M43716 [0,1,0,0,1,0|1,0,0]=3 1789 B9R1.7 CCCC1=CC(N)=NN1 P41489 [0,1,0,0,1,0|2,0,0]=4 1790 B9R1.7 CCCC1=CC=C(Br)S1 B38199 [0,1,0,0,1,0|2,0,0]=4 1791 B9R1.7 CCOC1=NC(Br)=CS1 B2261 [0,1,0,0,1,0|2,0,0]=4 1792 B9R1.7 CN1C=C(CC#N)C=N1 M7746 [0,1,0,0,1,0|1,0,1]=4 1793 B9R1.7 CNCC1=CN(C)C=N1 M16460 [0,1,0,0,1,0|2,0,0]=4 1794 B9R1.7 COCC1=CC(N)=NN1 A11618 [0,1,0,0,1,0|2,0,0]=4 1795 B9R1.7 NC1=NC=C(CCO)S1 A41202 [0,1,0,0,1,0|2,0,0]=4 1796 B9R1.7 NC1=NN(CCO)C=C1 A41247 [0,1,0,0,1,0|2,0,0]=4 1797 B9R1.7 OCCC1=CC(Br)=NO1 B2471 [0,1,0,0,1,0|2,0,0]=4 1798 B9R1.21 CCC1=CSC(C=O)=N1 E43175 [0,1,0,0,1,0|1,0,1]=4 1799 B9R1.21 CCN1C=C(CN)C=N1 E41492 [0,1,0,0,1,0|2,0,0]=4 1800 B9R1.21 COC1=CC(CN)=NN1 A7802 [0,1,0,0,1,0|2,0,0]=4 1801 B9R1.21 COC1=CC=C(OC)S1 D43309 [0,1,0,0,1,0|2,0,0]=4 1802 B9R1.21 OCC1=CC=C(CO)O1 F69147 [0,1,0,0,1,0|2,0,0]=4 1803 B9R1.22 CC1=NC(Br)=C(CBr)S1 B40988 [0,1,0,0,1,0|2,0,0]=4 1804 B9R1.22 CC1=NC(C)=C(CO)S1 D43393 [0,1,0,0,1,0|2,0,0]=4 1805 B9R1.22 CC1=NN(C)C(CCl)=C1 C1040 [0,1,0,0,1,0|2,0,0]=4 1806 B9R1.22 CC1=NN(C)C(CO)=C1 D3957 [0,1,0,0,1,0|2,0,0]=4 1807 B9R1.22 CC1=NN(C)C=C1CN D23506 [0,1,0,0,1,0|2,0,0]=4 1808 B9R1.23 CC1=CC(CCl)=NN1C C11366 [0,1,0,0,1,0|2,0,0]=4 1809 B9R1.23 CC1=CC(CN)=NN1C A11367 [0,1,0,0,1,0|2,0,0]=4 1810 B9R1.23 CC1=CC(CO)=NN1C H11365 [0,1,0,0,1,0|2,0,0]=4 1811 B9R1.23 CCC1=NC(C)=C(Br)S1 B43293 [0,1,0,0,1,0|1,0,0]=3 1812 B9R1.23 CCN1C=C(N)C(C)=N1 A15545 [0,1,0,0,1,0|1,0,0]=3 1813 B9R1.23 CCN1C=C(N)C(C)=N1 E61343 [0,1,0,0,1,0|1,0,0]=3 1814 B9R1.35 CC(=O)C1=CC=C(C)S1 A46277 [0,1,0,0,1,0|1,0,1]=4 1815 B9R1.35 CC(=O)C1=CN(C)N=C1 M3257 [0,1,0,0,1,0|1,0,1]=4 1816 B9R1.35 CC(=O)C1=CNC(C)=C1 M46389 [0,1,0,0,1,0|0,0,2]=4 1817 B9R1.35 CC(=O)C1=NC(C)=CO1 M43141 [0,1,0,0,1,0|1,0,1]=4 1818 B9R1.35 CC(=O)C1=NN(C)C=C1 A13629 [0,1,0,0,1,0|1,0,1]=4 1819 B9R1.35 CC(C)C1=CN=C(Br)S1 B43292 [0,1,0,0,1,0|2,0,0]=4 1820 B9R1.35 CC(C)C1=CN=C(N)S1 P67827 [0,1,0,0,1,0|2,0,0]=4 1821 B9R1.35 CC(C)C1=CSC(Br)=N1 B43291 [0,1,0,0,1,0|2,0,0]=4 1822 B9R1.35 CC(C)C1=NC(Br)=CS1 B2063 [0,1,0,0,1,0|2,0,0]=4 1823 B9R1.35 CC(C)N1C=NC(Br)=C1 B8984 [0,1,0,0,1,0|2,0,0]=4 1824 B9R1.35 CC1=CSC(C(C)C)=N1 P43783 [0,1,0,0,1,0|1,0,0]=3 1825 B9R1.35 C[C@H](N)C1=CN(C)N=C1 M14047 [0,1,0,0,1,0|1,0,0]=3 1826 B9R1.35 C[C@H](O)C1=CN(C)C=N1 M0652 [0,1,0,0,1,0|2,0,0]=4 1827 B9R1.35 C[C@H](O)C1=CSC(Cl)=C1 C7957 [0,1,0,0,1,0|2,0,0]=4 1828 B9R1.132 CC1=CC=C(CN)N1C A13529 [0,1,0,0,1,0|1,0,1]=4 1829 B9R1.132 CC[N+]1=C(C)N(C)C=C1 E46613 [0,1,0,0,1,0|2,0,0]=4 1830 B9R1.132 CC[N+]1=C(C)N(C)C=C1 E46616 [0,1,0,0,1,0|2,0,0]=4 1831 B9R1.132 CC[N+]1=C(C)N(C)C=C1 E46619 [0,1,0,0,1,0|2,0,0]=4 1832 B11R1.1 BrCCCC1=CC=C(Br)C=C1 B49699 [0,2,0,0,0,0|2,0,0]=4 1833 B11R1.1 CC1=CC=C(CN=[N+]=[N-])C=C1 A9118 [0,2,0,0,0,0|2,0,0]=4 1834 B11R1.1 CCCCC1=CC=C(Br)C=C1 B68752 [0,2,0,0,0,0|2,0,0]=4 1835 B11R1.1 CCCCC1=CC=C(N)C=C1 B39618 [0,2,0,0,0,0|2,0,0]=4 1836 B11R1.1 CCCCC1=CC=C([Mg+])C=C1 B31783 [0,2,0,0,0,0|2,0,0]=4 1837 B11R1.1 CCCC[N+]1=CC=C(C)C=C1 B54075 [0,2,0,0,0,0|2,0,0]=4 1838 B11R1.1 CCCC[N+]1=CC=C(C)C=C1 B54252 [0,2,0,0,0,0|2,0,0]=4 1839 B11R1.1 CCCOC1=NN=C(Cl)C=C1 C46327 [0,2,0,0,0,0|2,0,0]=4 1840 B11R1.1 CCNCC1=CC=C(Br)C=C1 E50225 [0,2,0,0,0,0|2,0,0]=4 1841 B11R1.1 CCNCC1=CC=C(C)C=C1 M53114 [0,2,0,0,0,0|1,0,0]=3 1842 B11R1.1 CCNCC1=CC=C(Cl)C=C1 E50238 [0,2,0,0,0,0|2,0,0]=4 1843 B11R1.1 CCOCC1=CN=C(Cl)C=C1 C62281 [0,2,0,0,0,0|1,0,0]=3 1844 B11R1.1 COCCC1=CC=C(O)C=C1 H67272 [0,2,0,0,0,0|2,0,0]=4 1845 B11R1.1 COCOC1=CN=C(Cl)C=C1 C46141 [0,2,0,0,0,0|1,0,0]=3 1846 B11R1.1 ClC1=CC=C(CCCBr)C=C1 B49700 [0,2,0,0,0,0|2,0,0]=4 1847 B11R1.1 ClCCOC1=CC=C(Cl)C=C1 C49149 [0,2,0,0,0,0|2,0,0]=4 1848 B11R1.1 FC1=CC=C(CCCI)C=C1 F49704 [0,2,0,0,0,0|2,0,0]=4 1849 B11R1.1 FC1=CC=C(OCCBr)C=C1 B49139 [0,2,0,0,0,0|2,0,0]=4 1850 B11R1.1 N#CCCC1=CC=C(Br)C=C1 B51452 [0,2,0,0,0,0|2,0,0]=4 1851 B11R1.1 NCCCC1=CC=C(Cl)C=C1 C50240 [0,2,0,0,0,0|2,0,0]=4 1852 B11R1.1 NCCCC1=CC=C(F)C=C1 F52144 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.1 NCCOC1=CC=C(F)C=C1 F46812 [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.1 NCCOC1=CC=C(F)C=C1 F49512 [0,2,0,0,0,0|2,0,0]=4 1855 B11R1.1 O=CCCC1=CC=C(Br)C=C1 B52022 [0,2,0,0,0,0|2,0,0]=4 1856 B11R1.1 O=CCCC1=CC=C(O)C=C1 H60513 [0,2,0,0,0,0|2,0,0]=4 1857 B11R1.1 OCCCC1=CC=C(Br)C=C1 B37932 [0,2,0,0,0,0|2,0,0]=4 1858 B11R1.1 OCCCC1=CC=C(Cl)C=C1 C50159 [0,2,0,0,0,0|2,0,0]=4 1859 B11R1.1 OCCCC1=CC=C(O)C=C1 H37679 [0,2,0,0,0,0|2,0,0]=4 1860 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 B52021 [0,2,0,0,0,0|2,0,0]=4 1861 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 C52036 [0,2,0,0,0,0|2,0,0]=4 1862 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 F52043 [0,2,0,0,0,0|2,0,0]=4 1863 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 H46009 [0,2,0,0,0,0|1,0,1]=4 1864 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 B52869 [0,2,0,0,0,0|2,0,0]=4 1865 B11R1.20 CC(C)NC1=CC=C(F)C=C1 F50250 [0,2,0,0,0,0|2,0,0]=4 1866 B11R1.20 CC(C)OC1=CC=C(N)C=C1 P50334 [0,2,0,0,0,0|2,0,0]=4 1867 B11R1.20 CC(C)OC1=CC=C(O)C=C1 P60509 [0,2,0,0,0,0|2,0,0]=4 1868 B11R1.20 CC(C)OC1=CN=C(Cl)C=C1 C37509 [0,2,0,0,0,0|1,0,0]=3 1869 B11R1.20 CC(C)OC1=NN=C(I)C=C1 K46336 [0,2,0,0,0,0|2,0,0]=4 1870 B11R1.20 CC(C)SC1=CC=C(Br)C=C1 B49968 [0,2,0,0,0,0|2,0,0]=4 1871 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T37815 [0,2,0,0,0,0|1,0,1]=4 1872 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 M61975 [0,2,0,0,0,0|0,0,1]=3 1873 B11R1.20 CN(C)CC1=CC=C(N)C=C1 D24687 [0,2,0,0,0,0|2,0,0]=4 1874 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 F36778 [0,2,0,0,0,0|2,0,0]=4 1875 B11R1.20 FC(F)OC1=CN=C(Br)C=C1 B42292 [0,2,0,0,0,0|2,0,0]=4 1876 B11R1.20 FC(F)OC1=CN=C(Cl)C=C1 C42301 [0,2,0,0,0,0|2,0,0]=4 1877 B11R1.20 NC(=O)CC1=CN=C(Cl)C=C1 C45699 [0,2,0,0,0,0|1,0,1]=4 1878 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 C28734 [0,2,0,0,0,0|1,0,1]=4 1879 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 B52024 [0,2,0,0,0,0|1,0,1]=4 1880 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 A52107 [0,2,0,0,0,0|1,0,1]=4 1881 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 A52174 [0,2,0,0,0,0|1,0,0]=3 1882 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 B16168 [0,2,0,0,0,0|2,0,0]=4 1883 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 F39582 [0,2,0,0,0,0|2,0,0]=4 1884 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 K52052 [0,2,0,0,0,0|2,0,0]=4 1885 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 T54185 [0,2,0,0,0,0|1,0,0]=3 1886 B11R1.22 CC[C@@H](N)C1=CC=C(Cl)C=C1 C50244 [0,2,0,0,0,0|2,0,0]=4 1887 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 F52146 [0,2,0,0,0,0|2,0,0]=4 1888 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 B39008 [0,2,0,0,0,0|2,0,0]=4 1889 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 B50231 [0,2,0,0,0,0|2,0,0]=4 1890 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 B50235 [0,2,0,0,0,0|2,0,0]=4 1891 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 C37034 [0,2,0,0,0,0|2,0,0]=4 1892 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 F52142 [0,2,0,0,0,0|2,0,0]=4 1893 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 F52149 [0,2,0,0,0,0|2,0,0]=4 1894 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 C45698 [0,2,0,0,0,0|1,0,1]=4 1895 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 B50237 [0,2,0,0,0,0|2,0,0]=4 1896 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 C50248 [0,2,0,0,0,0|2,0,0]=4 1897 B11R1.22 CN[C@H](C)C1=CC=C(Cl)C=C1 C50247 [0,2,0,0,0,0|2,0,0]=4 1898 B11R1.22 COC(=O)C1=CC=C(C)C=C1 M60598 [0,2,0,0,0,0|1,0,1]=4 1899 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 M0015 [0,2,0,0,0,0|1,0,1]=4 1900 B11R1.22 COC(=O)C1=CN=C(C)C=C1 M13760 [0,2,0,0,0,0|0,0,1]=3 1901 B11R1.22 COC(=O)C1=CN=C(C)N=C1 M12380 [0,2,0,0,0,0|1,0,1]=4 1902 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 M39382 [0,2,0,0,0,0|1,0,1]=4 1903 B11R1.22 COC(=O)C1=CN=C(F)C=C1 M4740 [0,2,0,0,0,0|1,0,1]=4 1904 B11R1.22 COC(=O)C1=NC=C(C)N=C1 M46011 [0,2,0,0,0,0|1,0,1]=4 1905 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 A28643 [0,2,0,0,0,0|2,0,0]=4 1906 B11R1.22 C[C@H](C#N)C1=CC=C(Br)C=C1 B51451 [0,2,0,0,0,0|2,0,0]=4 1907 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A38341 [0,2,0,0,0,0|2,0,0]=4 1908 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A46796 [0,2,0,0,0,0|2,0,0]=4 1909 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A46798 [0,2,0,0,0,0|2,0,0]=4 1910 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 A46808 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 A46813 [0,2,0,0,0,0|2,0,0]=4 1912 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 A46818 [0,2,0,0,0,0|2,0,0]=4 1913 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 A49527 [0,2,0,0,0,0|2,0,0]=4 1914 B11R1.22 N[C@@H](CO)C1=CN=C(Cl)C=C1 A46332 [0,2,0,0,0,0|1,0,0]=3 1915 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 A46797 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 A46811 [0,2,0,0,0,0|2,0,0]=4 1917 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 A46821 [0,2,0,0,0,0|2,0,0]=4 1918 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 A49517 [0,2,0,0,0,0|2,0,0]=4 1919 B11R1.22 N[C@H](CO)C1=CC=C(O)C=C1 A49528 [0,2,0,0,0,0|2,0,0]=4 1920 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 C45047 [0,2,0,0,0,0|1,0,1]=4 1921 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 B49377 [0,2,0,0,0,0|2,0,0]=4 1922 B11R1.81 CC1=CC(F)=C(CC#N)C=C1 F51461 [0,2,0,0,0,0|1,0,1]=4 1923 B11R1.81 CCCC1=C(O)C=C(O)C=C1 P50281 [0,2,0,0,0,0|2,0,0]=4 1924 B11R1.81 CCOC1=C(Br)C=C(C)C=N1 B64110 [0,2,0,0,0,0|2,0,0]=4 1925 B11R1.81 CCOC1=C(C)N=C(N)C=C1 E46978 [0,2,0,0,0,0|1,0,0]=3 1926 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 C38144 [0,2,0,0,0,0|2,0,0]=4 1927 B11R1.81 CCOC1=C(Cl)N=C(Cl)N=C1 D38241 [0,2,0,0,0,0|2,0,0]=4 1928 B11R1.81 CCOC1=C(N)C=C(C)C=C1 E50337 [0,2,0,0,0,0|1,0,0]=3 1929 B11R1.81 CCOC1=C(N)C=C(N)C=C1 E46634 [0,2,0,0,0,0|2,0,0]=4 1930 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 D1582 [0,2,0,0,0,0|2,0,0]=4 1931 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 D29989 [0,2,0,0,0,0|2,0,0]=4 1932 B11R1.81 CNCC1=C(F)C=C(F)C=C1 D49253 [0,2,0,0,0,0|2,0,0]=4 1933 B11R1.81 COCC1=C(F)C=C(N)C=C1 F46814 [0,2,0,0,0,0|2,0,0]=4 1934 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 B48298 [0,2,0,0,0,0|2,0,0]=4 1935 B11R1.81 N#CCC1=CN=C(Cl)C=C1Cl D44323 [0,2,0,0,0,0|1,0,1]=4 1936 B11R1.81 NCCC1=C(F)C=C(F)C=C1 D69468 [0,2,0,0,0,0|2,0,0]=4 1937 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 D49147 [0,2,0,0,0,0|2,0,0]=4 1938 B11R1.83 C#CC1=CC=C(CCC)C=C1 E54480 [0,2,0,0,0,0|1,0,1]=4 1939 B11R1.83 C#CC1=CC=C(OCC)C=C1 E52410 [0,2,0,0,0,0|1,0,1]=4 1940 B11R1.83 CCC1=CC=C(CNC)C=C1 E53118 [0,2,0,0,0,0|1,0,0]=3 1941 B11R1.83 CCC1=CN=C(CCO)C=C1 E39550 [0,2,0,0,0,0|0,0,0]=2 1942 B11R1.83 CCCC1=CC=C(C=O)C=C1 P52777 [0,2,0,0,0,0|1,0,1]=4 1943 B11R1.83 CCNC1=CC=C(C#N)C=C1 E49708 [0,2,0,0,0,0|1,0,1]=4 1944 B11R1.83 CCOC1=CC=C(CN)C=C1 E50343 [0,2,0,0,0,0|1,0,0]=3 1945 B11R1.83 CCOC1=NC=C(C=O)C=C1 E49274 [0,2,0,0,0,0|1,0,1]=4 1946 B11R1.83 CNCC1=CC=C(C#N)C=C1 M49716 [0,2,0,0,0,0|1,0,1]=4 1947 B11R1.83 CNCC1=CC=C(OC)C=C1 M38582 [0,2,0,0,0,0|1,0,0]=3 1948 B11R1.83 CNCC1=CC=C(OC)C=C1 M52172 [0,2,0,0,0,0|1,0,0]=3 1949 B11R1.83 COC1=CC=C(CC#N)C=C1 M16235 [0,2,0,0,0,0|1,0,1]=4 1950 B11R1.83 COC1=CC=C(CC=O)C=C1 M49894 [0,2,0,0,0,0|1,0,1]=4 1951 B11R1.83 COC1=CC=C(CCO)C=C1 M67580 [0,2,0,0,0,0|1,0,0]=3 1952 B11R1.83 COC1=CC=C(CC[Mg+])C=C1 M31722 [0,2,0,0,0,0|1,0,0]=3 1953 B11R1.83 COC1=CC=C(CNN)C=C1 M0099 [0,2,0,0,0,0|2,0,0]=4 1954 B11R1.83 COC1=CC=C(CNN)C=C1 M19471 [0,2,0,0,0,0|2,0,0]=4 1955 B11R1.83 COC1=CC=C(CNN)C=C1 M23593 [0,2,0,0,0,0|2,0,0]=4 1956 B11R1.83 COC1=CC=C(CON)C=C1 M10064 [0,2,0,0,0,0|2,0,0]=4 1957 B11R1.83 COC1=CC=C(CON)C=C1 M38789 [0,2,0,0,0,0|2,0,0]=4 1958 B11R1.83 COC1=CN=C(CC#N)C=C1 M48814 [0,2,0,0,0,0|1,0,0]=3 1959 B11R1.83 COC1=CN=C(CCN)C=C1 M49539 [0,2,0,0,0,0|1,0,0]=3 1960 B11R1.83 N#CC1=CC=C(CCBr)C=C1 B36957 [0,2,0,0,0,0|1,0,1]=4 1961 B11R1.83 N#CC1=CC=C(CCO)C=C1 H51763 [0,2,0,0,0,0|1,0,1]=4 1962 B11R1.192 CCCC1=CC(F)=C(Br)C=C1 B49701 [0,2,0,0,0,0|2,0,0]=4 1963 B11R1.192 CCOC1=CC(C)=C(Br)C=C1 B50152 [0,2,0,0,0,0|2,0,0]=4 1964 B11R1.192 CCOC1=CC(F)=C(Br)C=C1 B49136 [0,2,0,0,0,0|2,0,0]=4 1965 B11R1.192 CNCC1=CC(C)=C(C)C=C1 D53119 [0,2,0,0,0,0|1,0,0]=3 1966 B11R1.192 CNCC1=CC(Cl)=C(Cl)C=C1 D67460 [0,2,0,0,0,0|2,0,0]=4 1967 B11R1.192 CNCC1=CC(O)=C(O)C=C1 M49486 [0,2,0,0,0,0|2,0,0]=4 1968 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 B48302 [0,2,0,0,0,0|2,0,0]=4 1969 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 D49146 [0,2,0,0,0,0|2,0,0]=4 1970 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 C49151 [0,2,0,0,0,0|2,0,0]=4 1971 B11R1.3 C#CC1=CC=C(C(C)C)C=C1 E54481 [0,2,0,0,0,0|1,0,1]=4 1972 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 B36669 [0,2,0,0,0,0|1,0,1]=4 1973 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 A52108 [0,2,0,0,0,0|1,0,1]=4 1974 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 H49897 [0,2,0,0,0,0|1,0,1]=4 1975 B11R1.3 CC(C)C1=CC=C(CN)C=C1 P53115 [0,2,0,0,0,0|1,0,0]=3 1976 B11R1.3 CCC1=CC=C(B(O)O)C=C1 E3140 [0,2,0,0,0,0|2,0,0]=4 1977 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 E61033 [0,2,0,0,0,0|1,0,1]=4 1978 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 E49271 [0,2,0,0,0,0|0,0,1]=3 1979 B11R1.3 CCC1=NC=C([N+](=O)[O-])C=C1 E15600 [0,2,0,0,0,0|2,0,0]=4 1980 B11R1.3 CN(C)C1=CC=C(CO)C=C1 D61045 [0,2,0,0,0,0|2,0,0]=4 1981 B11R1.3 CN(C)C1=CN=C(CN)N=C1 A14743 [0,2,0,0,0,0|2,0,0]=4 1982 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 M50024 [0,2,0,0,0,0|1,0,1]=4 1983 B11R1.3 CNC1=NC=C([N+](=O)[O-])C=C1 M43105 [0,2,0,0,0,0|2,0,0]=4 1984 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 M50287 [0,2,0,0,0,0|1,0,0]=3 1985 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M50345 [0,2,0,0,0,0|1,0,0]=3 1986 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M63049 [0,2,0,0,0,0|1,0,0]=3 1987 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M68132 [0,2,0,0,0,0|1,0,0]=3 1988 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M38013 [0,2,0,0,0,0|1,0,0]=3 1989 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M50288 [0,2,0,0,0,0|1,0,0]=3 1990 B11R1.3 COC1=CN=C(C(=N)N)C=C1 M32423 [0,2,0,0,0,0|1,0,1]=4 1991 B11R1.3 COC1=CN=C(C(=O)O)C=C1 M14344 [0,2,0,0,0,0|1,0,1]=4 1992 B11R1.3 COC1=CN=C(C(C)=O)C=C1 A15229 [0,2,0,0,0,0|1,0,0]=3 1993 B11R1.3 COC1=NC=C(B(O)O)C=C1 M4320 [0,2,0,0,0,0|2,0,0]=4 1994 B11R1.3 COC1=NC=C(C(=N)N)C=C1 M46573 [0,2,0,0,0,0|1,0,1]=4 1995 B11R1.3 COC1=NC=C(C(=O)O)C=C1 M12739 [0,2,0,0,0,0|1,0,1]=4 1996 B11R1.3 COC1=NC=C(C(C)=O)C=C1 A49280 [0,2,0,0,0,0|0,0,1]=3 1997 B11R1.3 COC1=NC=C(C(C)=O)C=N1 M46010 [0,2,0,0,0,0|1,0,1]=4 1998 B11R1.3 COC1=NC=C([N+](=O)[O-])C=C1 M42783 [0,2,0,0,0,0|2,0,0]=4 1999 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 M49959 [0,2,0,0,0,0|1,0,1]=4 2000 B11R1.3 CSC1=NC=C(B(O)O)C=C1 M2495 [0,2,0,0,0,0|2,0,0]=4 2001 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 A52058 [0,2,0,0,0,0|1,0,1]=4 2002 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 A64157 [0,2,0,0,0,0|1,0,1]=4 2003 B11R1.3 C[C@@H](N)C1=CC=C(CO)C=C1 A64851 [0,2,0,0,0,0|1,0,0]=3 2004 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 A52059 [0,2,0,0,0,0|1,0,1]=4 2005 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 A64156 [0,2,0,0,0,0|1,0,1]=4 2006 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 H32219 [0,2,0,0,0,0|1,0,1]=4 2007 B11R1.3 O=[N+]([O-])C1=CN=C(CBr)C=C1 B62306 [0,2,0,0,0,0|2,0,0]=4 2008 B11R1.3 O=[N+]([O-])C1=CN=C(CO)C=C1 N42784 [0,2,0,0,0,0|2,0,0]=4 2009 B11R1.279 CCC1=CC(N)=C(OC)C=C1 E50338 [0,2,0,0,0,0|1,0,0]=3 2010 B11R1.279 CCC1=NC(N)=C(CO)C=N1 A43752 [0,2,0,0,0,0|2,0,0]=4 2011 B11R1.279 COC1=C(Br)C=C(CO)C=C1 B49379 [0,2,0,0,0,0|2,0,0]=4 2012 B11R1.279 COC1=C(Cl)C=C(C=O)C=N1 C37108 [0,2,0,0,0,0|1,0,1]=4 2013 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 B49134 [0,2,0,0,0,0|2,0,0]=4 2014 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 C46806 [0,2,0,0,0,0|2,0,0]=4 2015 B11R1.279 COC1=C(F)C=C(CBr)C=C1 B2649 [0,2,0,0,0,0|2,0,0]=4 2016 B11R1.279 COC1=C(F)C=C(CN)C=C1 F46816 [0,2,0,0,0,0|2,0,0]=4 2017 B11R1.279 COC1=C(N)C=C(CO)C=C1 A37036 [0,2,0,0,0,0|2,0,0]=4 2018 B11R1.279 COC1=C(O)C=C(CO)C=C1 H39431 [0,2,0,0,0,0|2,0,0]=4 2019 B11R1.279 COC1=C(O)N=C(SC)N=C1 M43239 [0,2,0,0,0,0|2,0,0]=4 2020 B11R1.279 COC1=CC(Br)=C(OC)C=C1 B39519 [0,2,0,0,0,0|2,0,0]=4 2021 B11R1.279 COC1=CC(C)=C(C=O)C=N1 M49289 [0,2,0,0,0,0|1,0,1]=4 2022 B11R1.279 COC1=CC(C)=C(OC)C=C1 D50280 [0,2,0,0,0,0|2,0,0]=4 2023 B11R1.279 COC1=CC(F)=C(OC)C=C1 F49392 [0,2,0,0,0,0|2,0,0]=4 2024 B11R1.279 COC1=CC(N)=C(CO)C=C1 A46922 [0,2,0,0,0,0|2,0,0]=4 2025 B11R1.279 COC1=CC(N)=C(OC)C=C1 D39435 [0,2,0,0,0,0|2,0,0]=4 2026 B11R1.279 COC1=CC(O)=C(OC)C=C1 D46841 [0,2,0,0,0,0|2,0,0]=4 2027 B11R1.279 COC1=CC(S)=C(OC)C=C1 D46838 [0,2,0,0,0,0|2,0,0]=4 2028 B11R1.279 COC1=CC([Mg+])=C(OC)C=C1 D31788 [0,2,0,0,0,0|2,0,0]=4 2029 B11R1.279 COC1=CC=C(C=O)C(Br)=N1 B45340 [0,2,0,0,0,0|1,0,1]=4 2030 B11R1.279 COC1=CC=C(C=O)C(Cl)=N1 C45361 [0,2,0,0,0,0|1,0,1]=4 2031 B11R1.279 COC1=CC=C(CO)C(Cl)=N1 C46142 [0,2,0,0,0,0|1,0,0]=3 2032 B11R1.279 COC1=CN=C(OC)N=C1Cl C43039 [0,2,0,0,0,0|2,0,0]=4 2033 B11R1.279 COC1=CN=C(SC)N=C1Cl C43079 [0,2,0,0,0,0|2,0,0]=4 2034 B11R1.279 COC1=NC(N)=C(OC)C=N1 D43359 [0,2,0,0,0,0|2,0,0]=4 2035 B11R1.279 COC1=NC=C(C#N)C(C)=C1 M48810 [0,2,0,0,0,0|1,0,1]=4 2036 B11R1.279 CSC1=NC(C)=C(CO)C=N1 M43686 [0,2,0,0,0,0|2,0,0]=4 2037 B11R1.279 CSC1=NC(N)=C(CO)C=N1 A10636 [0,2,0,0,0,0|2,0,0]=4 2038 B11R1.279 CSC1=NC=C(CO)C(Cl)=N1 C13102 [0,2,0,0,0,0|2,0,0]=4 2039 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 B68078 [0,2,0,0,0,0|2,0,0]=4 2040 B11R1.19 CC(C)(C)C1=CC=C(Cl)C=C1 B52874 [0,2,0,0,0,0|2,0,0]=4 2041 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 B52875 [0,2,0,0,0,0|2,0,0]=4 2042 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 B53106 [0,2,0,0,0,0|2,0,0]=4 2043 B11R1.19 CC(C)(C)C1=CC=C([Mg+])C=C1 B31784 [0,2,0,0,0,0|2,0,0]=4 2044 B11R1.19 CC(C)(C)C1=CN=C(N)N=C1 D67350 [0,2,0,0,0,0|2,0,0]=4 2045 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 B50148 [0,2,0,0,0,0|2,0,0]=4 2046 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 B48301 [0,2,0,0,0,0|2,0,0]=4 2047 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 M48306 [0,2,0,0,0,0|2,0,0]=4 2048 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 M43169 [0,2,0,0,0,0|2,0,0]=4 2049 B11R1.19 ClC1=NC=C(C(Cl)(Cl)Cl)C=C1 C4741 [0,2,0,0,0,0|2,0,0]=4 2050 B11R1.19 FC(F)(F)C1=CN=C(Br)C=C1 B41886 [0,2,0,0,0,0|2,0,0]=4 2051 B11R1.19 FC(F)(F)C1=CN=C(Cl)C=C1 C31193 [0,2,0,0,0,0|2,0,0]=4 2052 B11R1.19 FC(F)(F)C1=CN=C(I)C=C1 I5797 [0,2,0,0,0,0|2,0,0]=4 2053 B11R1.19 FC1=NC=C(C(F)(F)F)C=C1 F41894 [0,2,0,0,0,0|2,0,0]=4 2054 B11R1.19 NC1=NC=C(C(F)(F)F)C=C1 A0555 [0,2,0,0,0,0|2,0,0]=4 2055 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 B52032 [0,2,0,0,0,0|1,0,1]=4 2056 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 C61119 [0,2,0,0,0,0|1,0,1]=4 2057 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 A50026 [0,2,0,0,0,0|1,0,1]=4 2058 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C49042 [0,2,0,0,0,0|1,0,1]=4 2059 B11R1.21 CC(=O)C1=CN=C(Cl)C(Cl)=C1 D37474 [0,2,0,0,0,0|1,0,1]=4 2060 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=N1 B64856 [0,2,0,0,0,0|1,0,1]=4 2061 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=N1 B0529 [0,2,0,0,0,0|2,0,0]=4 2062 B11R1.21 CC1=C(Cl)C=C([C@@H](C)N)C=C1 C61118 [0,2,0,0,0,0|1,0,0]=3 2063 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 C50241 [0,2,0,0,0,0|1,0,0]=3 2064 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 C61334 [0,2,0,0,0,0|1,0,0]=3 2065 B11R1.21 CC1=C(Cl)C=C([N+](=O)[O-])C=N1 C42406 [0,2,0,0,0,0|2,0,0]=4 2066 B11R1.21 CC1=C(Cl)C=CC([C@@H](C)N)=C1 C50246 [0,2,0,0,0,0|2,0,0]=4 2067 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 F61560 [0,2,0,0,0,0|1,0,1]=4 2068 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 F63759 [0,2,0,0,0,0|1,0,0]=3 2069 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 F52150 [0,2,0,0,0,0|2,0,0]=4 2070 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 A52256 [0,2,0,0,0,0|1,0,0]=3 2071 B11R1.21 CC1=NC=C(C(=O)O)C=C1N A8134 [0,2,0,0,0,0|1,0,1]=4 2072 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1N A11812 [0,2,0,0,0,0|2,0,0]=4 2073 B11R1.21 CC1=NC=C([N+](=O)[O-])C=C1O H15193 [0,2,0,0,0,0|2,0,0]=4 2074 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(Cl)C=C1 D49232 [0,2,0,0,0,0|2,0,0]=4 2075 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 C49241 [0,2,0,0,0,0|2,0,0]=4 2076 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 C49243 [0,2,0,0,0,0|2,0,0]=4 2077 B11R1.21 C[C@@H](N)C1=CC(F)=C(F)C=C1 D49250 [0,2,0,0,0,0|2,0,0]=4 2078 B11R1.21 C[C@@H](N)C1=CC(F)=C(F)C=C1 D49637 [0,2,0,0,0,0|2,0,0]=4 2079 B11R1.21 C[C@H](N)C1=CC(Br)=C(F)C=C1 B49225 [0,2,0,0,0,0|2,0,0]=4 2080 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Br)C=C1 B49221 [0,2,0,0,0,0|2,0,0]=4 2081 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 B49227 [0,2,0,0,0,0|2,0,0]=4 2082 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 C49246 [0,2,0,0,0,0|2,0,0]=4 2083 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 D49642 [0,2,0,0,0,0|2,0,0]=4 2084 B11R1.21 C[C@H](O)C1=CC(Cl)=C(Cl)C=C1 D49144 [0,2,0,0,0,0|2,0,0]=4 2085 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 D49155 [0,2,0,0,0,0|2,0,0]=4 2086 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 D68875 [0,2,0,0,0,0|1,0,1]=4 2087 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 A50025 [0,2,0,0,0,0|1,0,1]=4 2088 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl A9870 [0,2,0,0,0,0|1,0,1]=4 2089 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl D63902 [0,2,0,0,0,0|1,0,1]=4 2090 B11R1.166 CC(C)C1=C(N)N=C(Cl)N=C1 C37537 [0,2,0,0,0,0|2,0,0]=4 2091 B11R1.166 CC(C)C1=C(O)C=C(N)C=C1 A67349 [0,2,0,0,0,0|2,0,0]=4 2092 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 I38010 [0,2,0,0,0,0|2,0,0]=4 2093 B11R1.166 CC1=CC(Br)=C(N(C)C)C=C1 B50229 [0,2,0,0,0,0|2,0,0]=4 2094 B11R1.166 CC1=CC(Br)=NC=C1C(F)F B45318 [0,2,0,0,0,0|2,0,0]=4 2095 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 D49278 [0,2,0,0,0,0|1,0,1]=4 2096 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 D54187 [0,2,0,0,0,0|1,0,0]=3 2097 B11R1.166 CC1=CC(C)=C([N+](=O)[O-])C=N1 D62064 [0,2,0,0,0,0|2,0,0]=4 2098 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=N1 C12703 [0,2,0,0,0,0|1,0,1]=4 2099 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=N1 C13525 [0,2,0,0,0,0|2,0,0]=4 2100 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 A12850 [0,2,0,0,0,0|1,0,1]=4 2101 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 H39399 [0,2,0,0,0,0|1,0,1]=4 2102 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 C10451 [0,2,0,0,0,0|1,0,1]=4 2103 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Br)=N1 B60575 [0,2,0,0,0,0|2,0,0]=4 2104 B11R1.166 CC1=CC=C([N+](=O)[O-])C(Cl)=N1 C4544 [0,2,0,0,0,0|2,0,0]=4 2105 B11R1.166 CC1=CC=C([N+](=O)[O-])C(F)=N1 F38026 [0,2,0,0,0,0|2,0,0]=4 2106 B11R1.166 CC1=NC(C)=C(B(O)O)C=C1 D43702 [0,2,0,0,0,0|2,0,0]=4 2107 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 D61273 [0,2,0,0,0,0|1,0,1]=4 2108 B11R1.166 CC1=NC(C)=C([N+](=O)[O-])C=C1 D45999 [0,2,0,0,0,0|2,0,0]=4 2109 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 A10622 [0,2,0,0,0,0|1,0,1]=4 2110 B11R1.166 CC1=NC(N)=C([N+](=O)[O-])C=C1 A43101 [0,2,0,0,0,0|2,0,0]=4 2111 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 H45847 [0,2,0,0,0,0|1,0,1]=4 2112 B11R1.166 CC1=NC(O)=C([N+](=O)[O-])C=C1 M4747 [0,2,0,0,0,0|2,0,0]=4 2113 B11R1.166 C[C@@H](N)C1=C(Br)C=C(F)C=C1 B49222 [0,2,0,0,0,0|2,0,0]=4 2114 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 D49229 [0,2,0,0,0,0|2,0,0]=4 2115 B11R1.166 C[C@@H](N)C1=C(F)C=C(Br)C=C1 B49223 [0,2,0,0,0,0|2,0,0]=4 2116 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 D49249 [0,2,0,0,0,0|2,0,0]=4 2117 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 D49634 [0,2,0,0,0,0|2,0,0]=4 2118 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 B49224 [0,2,0,0,0,0|2,0,0]=4 2119 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 B49226 [0,2,0,0,0,0|2,0,0]=4 2120 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 B63723 [0,2,0,0,0,0|2,0,0]=4 2121 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 D49252 [0,2,0,0,0,0|2,0,0]=4 2122 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 D49640 [0,2,0,0,0,0|2,0,0]=4 2123 B11R1.166 C[C@H](O)C1=C(Cl)C=C(Cl)C=C1 D49143 [0,2,0,0,0,0|2,0,0]=4 2124 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D63331 [0,2,0,0,0,0|1,0,0]=3 2125 B11R1.37 CCC1=NC=C(C)N=C1CC D50396 [0,2,0,0,0,0|1,0,0]=3 2126 B11R1.37 COC1=C(C#N)C=C(C)C=C1 M24107 [0,2,0,0,0,0|2,0,0]=4 2127 B11R1.37 COC1=C(C=O)C=C(C)C=C1 M65814 [0,2,0,0,0,0|2,0,0]=4 2128 B11R1.37 COC1=C(C=O)N=C(Br)C=C1 B45343 [0,2,0,0,0,0|2,0,0]=4 2129 B11R1.37 COC1=C(CBr)C=CC(Br)=N1 B45872 [0,2,0,0,0,0|2,0,0]=4 2130 B11R1.37 COC1=C(CN)C=CC(Br)=N1 B46323 [0,2,0,0,0,0|2,0,0]=4 2131 B11R1.37 COC1=C(CN)C=CC(Br)=N1 B46325 [0,2,0,0,0,0|2,0,0]=4 2132 B11R1.37 COC1=C(CO)C=CC(Br)=N1 B46129 [0,2,0,0,0,0|2,0,0]=4 2133 B11R1.37 COC1=C(OC)N=C(I)C=C1 K62513 [0,2,0,0,0,0|2,0,0]=4 2134 B11R1.37 COC1=CC(Cl)=NC=C1CO C63126 [0,2,0,0,0,0|2,0,0]=4 2135 B11R1.37 COC1=CC=C(N)N=C1OC D43649 [0,2,0,0,0,0|2,0,0]=4 2136 B11R1.277 CC1=C(C)N=C(Br)C(C#N)=C1 B48312 [0,2,0,0,0,0|1,0,1]=4 2137 B11R1.277 CC1=NC(C)=C(C)N=C1CO T28640 [0,2,0,0,0,0|2,0,0]=4 2138 B11R1.277 CCC1=CC(F)=C(F)C=C1N E49247 [0,2,0,0,0,0|2,0,0]=4 2139 B11R1.277 CCC1=NC(C)=C(C)N=C1C E50397 [0,2,0,0,0,0|1,0,0]=3 2140 B11R1.277 COC1=C(Br)C=C(C)C(N)=C1 B46790 [0,2,0,0,0,0|2,0,0]=4 2141 B11R1.277 COC1=CC(Br)=C(C)N=C1N B46322 [0,2,0,0,0,0|1,0,0]=3 2142 B11R1.278 CC1=NC=C(C#N)C(Cl)=C1I C13233 [0,2,0,0,0,0|1,0,1]=4 2143 B11R1.464 CC1=CC(C)=C(C#N)C(Cl)=N1 C48335 [0,2,0,0,0,0|1,0,1]=4 2144 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 B32045 [0,2,0,0,0,0|2,0,0]=4 2145 B11R1.464 CC1=CC(C)=C(CN)C(=O)N1 A10621 [0,2,0,0,0,0|1,0,1]=4 2146 B11R1.464 CC1=CC(C)=C(CN)C(=O)N1 A13177 [0,2,0,0,0,0|1,0,1]=4 2147 B11R1.464 CC1=CC(C)=C(CN)C(=O)N1 A30095 [0,2,0,0,0,0|1,0,1]=4 2148 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 M53111 [0,2,0,0,0,0|2,0,0]=4 2149 B11R1.464 CC1=CC(C)=C(CO)C(C)=C1 M53082 [0,2,0,0,0,0|2,0,0]=4 2150 B11R1.464 CC1=CC(Cl)=C(C#N)C(Cl)=N1 D23416 [0,2,0,0,0,0|1,0,1]=4 2151 B11R1.464 CCC1=C(Cl)N=C(Cl)N=C1Cl T42375 [0,2,0,0,0,0|2,0,0]=4 2152 B11R1.464 CCC1=C(Cl)N=C(N)N=C1Cl D43089 [0,2,0,0,0,0|2,0,0]=4 2153 B11R1.464 CCC1=C(O)N=C(N)NC1=O A43364 [0,2,0,0,0,0|2,0,0]=4 2154 B11R1.464 COC1=C(C)N=C(Cl)C=C1Cl D15350 [0,2,0,0,0,0|2,0,0]=4 2155 B11R1.464 COC1=C(Cl)N=C(Br)C=C1C B45876 [0,2,0,0,0,0|2,0,0]=4 2156 B11R1.14 COC1=CC(Br)=C(C)C(Br)=C1 D49129 [0,2,0,0,0,0|2,0,0]=4 2157 B11R1.280 COC1=CC(C=O)=C(C)C=C1 M49892 [0,2,0,0,0,0|2,0,0]=4 2158 B11R1.280 COC1=CC(CO)=C(C)C=C1 M50289 [0,2,0,0,0,0|2,0,0]=4 2159 B11R1.280 COC1=CN=C(Cl)C(C#N)=C1 C11819 [0,2,0,0,0,0|2,0,0]=4 2160 B9R1.3 CC1=CC=NC(C)=C1Br B46081 [0,0,1,1,0,0|1,0,1]=4 2161 B9R2.50 C1=CC2=C(C=C1)CC2 B68912 [1,0,0,1,0,0|1,0,0]=3 2162 B11R2.34 BrC1=CC=C(C2CC2)C=C1 B32033 [0,1,0,1,0,0|2,0,0]=4 2163 B11R2.34 BrC1=NC=C(C2CC2)C=C1 B48875 [0,1,0,1,0,0|1,0,0]=3 2164 B11R2.34 BrC1=NC=C(C2CC2)N=C1 B64845 [0,1,0,1,0,0|2,0,0]=4 2165 B11R2.34 ClC1=NN=C(C2CC2)C=C1 C45620 [0,1,0,1,0,0|2,0,0]=4 2166 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 F62188 [0,1,0,1,0,0|2,0,0]=4 2167 B11R2.34 FC1=NC=C(C2CC2)C=C1 C48887 [0,1,0,1,0,0|1,0,0]=3 2168 B11R2.34 NC1=CC=C(C2CC2)C=C1 C52090 [0,1,0,1,0,0|2,0,0]=4 2169 B11R2.34 NC1=NC=C(C2CC2)C=C1 C46640 [0,1,0,1,0,0|1,0,0]=3 2170 B11R2.34 OC1=CC=C(C2CC2)C=C1 C49871 [0,1,0,1,0,0|2,0,0]=4 2171 B11R2.34 OC1=NC=C(C2CC2)C=C1 C37180 [0,1,0,1,0,0|1,0,0]=3 2172 B11R2.36 BrC1=CC2=C(C=C1)CCN2 B48873 [0,1,0,1,0,0|2,0,0]=4 2173 B11R2.36 BrC1=CC2=C(C=C1)CCN2 B48878 [0,1,0,1,0,0|2,0,0]=4 2174 B11R2.36 BrC1=CC2=C(C=C1)CCO2 B48719 [0,1,0,1,0,0|2,0,0]=4 2175 B11R2.36 BrC1=CC2=C(C=C1)CNC2 B0713 [0,1,0,1,0,0|2,0,0]=4 2176 B11R2.36 BrC1=CC2=C(C=C1)NCC2 B22435 [0,1,0,1,0,0|2,0,0]=4 2177 B11R2.36 BrC1=CC2=C(C=C1)OCC2 B24807 [0,1,0,1,0,0|2,0,0]=4 2178 B11R2.36 BrC1=NC2=C(C=C1)NCC2 B45617 [0,1,0,1,0,0|1,0,0]=3 2179 B11R2.36 CC1=CC2=C(C=C1)NCC2 M49974 [0,1,0,1,0,0|1,0,0]=3 2180 B11R2.36 CC1=CC2=C(C=C1)OCO2 M65617 [0,1,0,1,0,0|2,0,0]=4 2181 B11R2.36 CC1=NC2=C(C=C1)C=NN2 M9878 [0,1,0,1,0,0|1,0,1]=4 2182 B11R2.36 CC1=NC2=C(C=C1)NC=C2 M48791 [0,1,0,1,0,0|0,0,2]=4 2183 B11R2.36 CC1=NC2=C(C=C1)NC=N2 M45729 [0,1,0,1,0,0|1,0,1]=4 2184 B11R2.36 CC1=NC2=C(C=C1)NN=C2 M9872 [0,1,0,1,0,0|1,0,1]=4 2185 B11R2.36 CC1=NC2=C(C=N1)CSC2 M46059 [0,1,0,1,0,0|1,0,0]=3 2186 B11R2.36 CC1=NC=C2C=CNC2=C1 M15102 [0,1,0,1,0,0|0,0,2]=4 2187 B11R2.36 ClC1=CC2=C(C=C1)CCN2 C48881 [0,1,0,1,0,0|2,0,0]=4 2188 B11R2.36 ClC1=CC2=C(C=C1)CNC2 C48884 [0,1,0,1,0,0|2,0,0]=4 2189 B11R2.36 ClC1=CC2=C(C=C1)OCC2 C48731 [0,1,0,1,0,0|2,0,0]=4 2190 B11R2.36 ClC1=NC2=C(C=C1)CCC2 C48882 [0,1,0,1,0,0|1,0,0]=3 2191 B11R2.36 ClC1=NC2=C(C=C1)CNC2 C25491 [0,1,0,1,0,0|1,0,0]=3 2192 B11R2.36 ClC1=NC2=C(C=N1)CCC2 C37147 [0,1,0,1,0,0|2,0,0]=4 2193 B11R2.36 ClC1=NC2=C(C=N1)CCN2 C37242 [0,1,0,1,0,0|2,0,0]=4 2194 B11R2.36 ClC1=NC=C2CCNC2=C1 C38106 [0,1,0,1,0,0|1,0,0]=3 2195 B11R2.36 FC1=CC2=C(C=C1)CCC2 F51669 [0,1,0,1,0,0|2,0,0]=4 2196 B11R2.36 FC1=CC2=C(C=C1)CNC2 F24902 [0,1,0,1,0,0|2,0,0]=4 2197 B11R2.36 FC1=CC2=C(C=C1)OCC2 F62598 [0,1,0,1,0,0|2,0,0]=4 2198 B11R2.36 IC1=CC2=C(C=C1)CCC2 K64448 [0,1,0,1,0,0|2,0,0]=4 2199 B11R2.36 IC1=CC2=C(C=C1)OCC2 I2714 [0,1,0,1,0,0|2,0,0]=4 2200 B11R2.36 NC1=CC2=C(C=C1)COC2 D49267 [0,1,0,1,0,0|2,0,0]=4 2201 B11R2.36 NC1=CC2=C(C=C1)OCC2 D49263 [0,1,0,1,0,0|2,0,0]=4 2202 B11R2.36 NC1=CC=C2OCOC2=N1 D60200 [0,1,0,1,0,0|2,0,0]=4 2203 B11R2.36 OC1=CC2=C(C=C1)CCN2 K49255 [0,1,0,1,0,0|2,0,0]=4 2204 B11R2.36 OC1=CC2=C(C=C1)CCO2 D49068 [0,1,0,1,0,0|2,0,0]=4 2205 B11R2.36 OC1=CC2=C(C=C1)CNC2 D29486 [0,1,0,1,0,0|2,0,0]=4 2206 B11R2.36 OC1=CC2=C(C=C1)NCC2 K49254 [0,1,0,1,0,0|2,0,0]=4 2207 B11R2.36 OC1=CC2=C(C=C1)OCC2 D49067 [0,1,0,1,0,0|2,0,0]=4 2208 B11R2.190 C=CC1=CC2=C(C=C1)CC2 V52272 [0,1,0,1,0,0|1,0,1]=4 2209 B11R2.190 O=CC1=CC2=C(C=C1)CC2 B51547 [0,1,0,1,0,0|1,0,1]=4 2210 B11R2.190 OCC1=CC2=C(C=C1)CC2 B49878 [0,1,0,1,0,0|1,0,0]=3 2211 B7R1.1 BrCC1=CSC=C1 B60823 [1,0,0,0,1,0|2,0,0]=4 2212 B7R1.1 BrCC1=NC=CN1 B40117 [1,0,0,0,1,0|2,0,0]=4 2213 B7R1.1 CCC1=NC=CN1 E68629 [1,0,0,0,1,0|1,0,0]=3 2214 B7R1.1 CCC1=NN=CO1 E37555 [1,0,0,0,1,0|2,0,0]=4 2215 B7R1.1 CCN1C=CN=N1 E40219 [1,0,0,0,1,0|2,0,0]=4 2216 B7R1.1 CCN1C=NC=N1 E40218 [1,0,0,0,1,0|2,0,0]=4 2217 B7R1.1 CNC1=NC=CS1 M67793 [1,0,0,0,1,0|2,0,0]=4 2218 B7R1.1 COC1=CC=CS1 M41123 [1,0,0,0,1,0|2,0,0]=4 2219 B7R1.1 COC1=CNN=C1 M20056 [1,0,0,0,1,0|2,0,0]=4 2220 B7R1.1 COC1=CSC=C1 M41124 [1,0,0,0,1,0|2,0,0]=4 2221 B7R1.1 COC1=NC=CS1 M2608 [1,0,0,0,1,0|2,0,0]=4 2222 B7R1.1 CSC1=NC=CO1 M40164 [1,0,0,0,1,0|2,0,0]=4 2223 B7R1.1 ClCC1=CN=CS1 C32421 [1,0,0,0,1,0|2,0,0]=4 2224 B7R1.1 ClCC1=CNC=N1 C2088 [1,0,0,0,1,0|2,0,0]=4 2225 B7R1.1 ClCC1=CSC=N1 C2334 [1,0,0,0,1,0|2,0,0]=4 2226 B7R1.1 ClCC1=NC=CO1 C40107 [1,0,0,0,1,0|2,0,0]=4 2227 B7R1.1 NCC1=CC=CN1 P41359 [1,0,0,0,1,0|1,0,1]=4 2228 B7R1.1 NCC1=CC=CS1 A12813 [1,0,0,0,1,0|2,0,0]=4 2229 B7R1.1 NCC1=CC=NO1 K40323 [1,0,0,0,1,0|2,0,0]=4 2230 B7R1.1 NCC1=CN=CN1 A69377 [1,0,0,0,1,0|2,0,0]=4 2231 B7R1.1 NCC1=CN=CO1 X11178 [1,0,0,0,1,0|2,0,0]=4 2232 B7R1.1 NCC1=CN=CO1 X17340 [1,0,0,0,1,0|2,0,0]=4 2233 B7R1.1 NCC1=CN=CS1 T11225 [1,0,0,0,1,0|2,0,0]=4 2234 B7R1.1 NCC1=CN=CS1 T37607 [1,0,0,0,1,0|2,0,0]=4 2235 B7R1.1 NCC1=CN=CS1 T40190 [1,0,0,0,1,0|2,0,0]=4 2236 B7R1.1 NCC1=CNC=C1 P26218 [1,0,0,0,1,0|1,0,1]=4 2237 B7R1.1 NCC1=CNC=N1 K40332 [1,0,0,0,1,0|2,0,0]=4 2238 B7R1.1 NCC1=CNN=C1 A10475 [1,0,0,0,1,0|2,0,0]=4 2239 B7R1.1 NCC1=CNN=C1 P17334 [1,0,0,0,1,0|2,0,0]=4 2240 B7R1.1 NCC1=CNN=C1 P20267 [1,0,0,0,1,0|2,0,0]=4 2241 B7R1.1 NCC1=COC=N1 A40322 [1,0,0,0,1,0|2,0,0]=4 2242 B7R1.1 NCC1=COC=N1 O7924 [1,0,0,0,1,0|2,0,0]=4 2243 B7R1.1 NCC1=COC=N1 X11296 [1,0,0,0,1,0|2,0,0]=4 2244 B7R1.1 NCC1=CON=C1 A14706 [1,0,0,0,1,0|2,0,0]=4 2245 B7R1.1 NCC1=CON=C1 I29534 [1,0,0,0,1,0|2,0,0]=4 2246 B7R1.1 NCC1=CSC=C1 T41357 [1,0,0,0,1,0|2,0,0]=4 2247 B7R1.1 NCC1=CSC=N1 T13924 [1,0,0,0,1,0|2,0,0]=4 2248 B7R1.1 NCC1=CSC=N1 T29521 [1,0,0,0,1,0|2,0,0]=4 2249 B7R1.1 NCC1=NC=CN1 A14237 [1,0,0,0,1,0|2,0,0]=4 2250 B7R1.1 NCC1=NC=CN1 K40331 [1,0,0,0,1,0|2,0,0]=4 2251 B7R1.1 NCC1=NC=CS1 A11223 [1,0,0,0,1,0|2,0,0]=4 2252 B7R1.1 NCC1=NC=CS1 T11224 [1,0,0,0,1,0|2,0,0]=4 2253 B7R1.1 NCC1=NC=CS1 T24256 [1,0,0,0,1,0|2,0,0]=4 2254 B7R1.1 NCC1=NNC=C1 P9792 [1,0,0,0,1,0|2,0,0]=4 2255 B7R1.1 NCC1=NOC=C1 I29536 [1,0,0,0,1,0|2,0,0]=4 2256 B7R1.1 NCC1=NOC=C1 I7943 [1,0,0,0,1,0|2,0,0]=4 2257 B7R1.1 NCC1=NSC=C1 I15218 [1,0,0,0,1,0|2,0,0]=4 2258 B7R1.1 OCC1=CC=CS1 T12815 [1,0,0,0,1,0|2,0,0]=4 2259 B7R1.1 OCC1=CC=NO1 K40159 [1,0,0,0,1,0|2,0,0]=4 2260 B7R1.1 OCC1=CN=CN1 I14077 [1,0,0,0,1,0|2,0,0]=4 2261 B7R1.1 OCC1=CN=CO1 X14033 [1,0,0,0,1,0|2,0,0]=4 2262 B7R1.1 OCC1=CN=CS1 T2166 [1,0,0,0,1,0|2,0,0]=4 2263 B7R1.1 OCC1=CNC=N1 H2067 [1,0,0,0,1,0|2,0,0]=4 2264 B7R1.1 OCC1=CNN=C1 H1729 [1,0,0,0,1,0|2,0,0]=4 2265 B7R1.1 OCC1=COC=C1 F41115 [1,0,0,0,1,0|2,0,0]=4 2266 B7R1.1 OCC1=COC=N1 O7923 [1,0,0,0,1,0|2,0,0]=4 2267 B7R1.1 OCC1=CON=C1 H14705 [1,0,0,0,1,0|2,0,0]=4 2268 B7R1.1 OCC1=CSC=C1 T12827 [1,0,0,0,1,0|2,0,0]=4 2269 B7R1.1 OCC1=CSC=N1 T2165 [1,0,0,0,1,0|2,0,0]=4 2270 B7R1.1 OCC1=NC=CN1 I38716 [1,0,0,0,1,0|2,0,0]=4 2271 B7R1.1 OCC1=NC=CO1 X14019 [1,0,0,0,1,0|2,0,0]=4 2272 B7R1.1 OCC1=NC=CS1 H3028 [1,0,0,0,1,0|2,0,0]=4 2273 B7R1.1 OCC1=NNC=C1 H7696 [1,0,0,0,1,0|2,0,0]=4 2274 B7R1.1 OCC1=NOC=C1 I11321 [1,0,0,0,1,0|2,0,0]=4 2275 B7R1.1 OCN1C=CC=N1 P9800 [1,0,0,0,1,0|2,0,0]=4 2276 B7R1.2 CC1=CC(Br)=CS1 B40867 [1,0,0,0,1,0|2,0,0]=4 2277 B7R1.2 CC1=CC(Br)=NN1 B9765 [1,0,0,0,1,0|2,0,0]=4 2278 B7R1.2 CC1=CC(Br)=NO1 B2183 [1,0,0,0,1,0|2,0,0]=4 2279 B7R1.2 CC1=CC(C)=NO1 D39182 [1,0,0,0,1,0|1,0,0]=3 2280 B7R1.2 CC1=CC(Cl)=NN1 C7548 [1,0,0,0,1,0|2,0,0]=4 2281 B7R1.2 CC1=CC(I)=NN1 I26594 [1,0,0,0,1,0|2,0,0]=4 2282 B7R1.2 CC1=CC(N)=NN1 A11614 [1,0,0,0,1,0|2,0,0]=4 2283 B7R1.2 CC1=CC(N)=NO1 A12655 [1,0,0,0,1,0|2,0,0]=4 2284 B7R1.2 CC1=CC=C(Br)O1 B41015 [1,0,0,0,1,0|2,0,0]=4 2285 B7R1.2 CC1=CC=C(Br)S1 B40865 [1,0,0,0,1,0|2,0,0]=4 2286 B7R1.2 CC1=CC=C(C)S1 D43320 [1,0,0,0,1,0|1,0,0]=3 2287 B7R1.2 CC1=CC=C(I)S1 K40868 [1,0,0,0,1,0|2,0,0]=4 2288 B7R1.2 CC1=CN(C)N=C1 D69464 [1,0,0,0,1,0|1,0,0]=3 2289 B7R1.2 CC1=CN(C)N=N1 D40221 [1,0,0,0,1,0|2,0,0]=4 2290 B7R1.2 CC1=CN=C(Br)S1 B40104 [1,0,0,0,1,0|2,0,0]=4 2291 B7R1.2 CC1=CN=C(C)S1 D38993 [1,0,0,0,1,0|1,0,0]=3 2292 B7R1.2 CC1=CN=C(Cl)S1 C1978 [1,0,0,0,1,0|2,0,0]=4 2293 B7R1.2 CC1=CN=C(N)S1 A69715 [1,0,0,0,1,0|2,0,0]=4 2294 B7R1.2 CC1=CN=C(N)S1 M69725 [1,0,0,0,1,0|2,0,0]=4 2295 B7R1.2 CC1=CNC(Br)=N1 B40115 [1,0,0,0,1,0|2,0,0]=4 2296 B7R1.2 CC1=CNC(C)=N1 D41187 [1,0,0,0,1,0|1,0,0]=3 2297 B7R1.2 CC1=CNC(I)=N1 K40123 [1,0,0,0,1,0|2,0,0]=4 2298 B7R1.2 CC1=COC(N)=N1 A2053 [1,0,0,0,1,0|2,0,0]=4 2299 B7R1.2 CC1=CSC(Br)=N1 B2087 [1,0,0,0,1,0|2,0,0]=4 2300 B7R1.2 CC1=CSC(C)=N1 D41174 [1,0,0,0,1,0|1,0,0]=3 2301 B7R1.2 CC1=CSC(N)=C1 A0597 [1,0,0,0,1,0|2,0,0]=4 2302 B7R1.2 CC1=NC(Br)=CN1 B2121 [1,0,0,0,1,0|2,0,0]=4 2303 B7R1.2 CC1=NC(Br)=CS1 B2069 [1,0,0,0,1,0|2,0,0]=4 2304 B7R1.2 CC1=NC=C(Br)S1 B5222 [1,0,0,0,1,0|2,0,0]=4 2305 B7R1.2 CC1=NC=C(I)N1 K40124 [1,0,0,0,1,0|2,0,0]=4 2306 B7R1.2 CC1=NC=C(N)S1 M40189 [1,0,0,0,1,0|2,0,0]=4 2307 B7R1.2 CC1=NN(C)C=C1 D4115 [1,0,0,0,1,0|1,0,0]=3 2308 B7R1.2 CC1=NN=C(C)N1 D0366 [1,0,0,0,1,0|2,0,0]=4 2309 B7R1.2 CC1=NN=C(C)O1 D13454 [1,0,0,0,1,0|2,0,0]=4 2310 B7R1.2 CC1=NNC(Br)=C1 B40114 [1,0,0,0,1,0|2,0,0]=4 2311 B7R1.2 CC1=NNC(I)=C1 K40122 [1,0,0,0,1,0|2,0,0]=4 2312 B7R1.2 CC1=NNC(N)=C1 M40220 [1,0,0,0,1,0|2,0,0]=4 2313 B7R1.2 CC1=NNC(O)=C1 M0907 [1,0,0,0,1,0|2,0,0]=4 2314 B7R1.2 CC1=NOC(N)=C1 A37936 [1,0,0,0,1,0|2,0,0]=4 2315 B7R1.2 CC1=NSC(I)=C1 I6114 [1,0,0,0,1,0|2,0,0]=4 2316 B7R1.2 CC1=NSC(N)=C1 M65783 [1,0,0,0,1,0|2,0,0]=4 2317 B7R1.2 CN1C=C(Br)C=N1 B7572 [1,0,0,0,1,0|2,0,0]=4 2318 B7R1.2 CN1C=C(Cl)C=N1 C40119 [1,0,0,0,1,0|2,0,0]=4 2319 B7R1.2 CN1C=C(I)C=N1 I23483 [1,0,0,0,1,0|2,0,0]=4 2320 B7R1.2 CN1C=C(N)C=N1 A10471 [1,0,0,0,1,0|2,0,0]=4 2321 B7R1.2 CN1C=C(N)C=N1 M24961 [1,0,0,0,1,0|2,0,0]=4 2322 B7R1.2 CN1C=C(N)C=N1 M40360 [1,0,0,0,1,0|2,0,0]=4 2323 B7R1.2 CN1C=C(O)C=N1 M38839 [1,0,0,0,1,0|2,0,0]=4 2324 B7R1.2 CN1C=CC(Br)=N1 B5930 [1,0,0,0,1,0|2,0,0]=4 2325 B7R1.2 CN1C=CC(Cl)=N1 C64917 [1,0,0,0,1,0|2,0,0]=4 2326 B7R1.2 CN1C=CC(I)=N1 M13226 [1,0,0,0,1,0|2,0,0]=4 2327 B7R1.2 CN1C=CC(N)=N1 A3263 [1,0,0,0,1,0|2,0,0]=4 2328 B7R1.2 CN1C=C[N+](C)=C1 D23670 [1,0,0,0,1,0|2,0,0]=4 2329 B7R1.2 CN1C=NC(Br)=C1 B5167 [1,0,0,0,1,0|2,0,0]=4 2330 B7R1.2 CN1C=NC(I)=C1 I2146 [1,0,0,0,1,0|2,0,0]=4 2331 B7R1.2 CN1C=NC(N)=C1 M38763 [1,0,0,0,1,0|2,0,0]=4