0 B9R1.1 BrCC1=CC=C(I)C=C1 B45171 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.1 BrCC1=NC=C(Br)C=C1 B42521 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.1 BrCC1=NC=C(Br)C=N1 B37593 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.1 BrCC1=NN=C(Br)C=C1 B36805 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.1 C#CC1=CC=C(C)C=C1 E68609 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.1 C#CC1=CN=C(Cl)C=C1 C38156 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.1 C#CC1=CN=C(F)C=C1 E44436 [0,0,0,0,0,0|2,0,2]=4 7 B9R1.1 C#CC1=CN=C(N)C=C1 E36917 [0,0,0,0,0,0|2,0,2]=4 8 B9R1.1 C#CC1=NC=C(Br)C=C1 B44410 [0,0,0,0,0,0|2,0,2]=4 9 B9R1.1 C#CC1=NC=C(Cl)C=C1 C44424 [0,0,0,0,0,0|2,0,2]=4 10 B9R1.1 C#CC1=NC=C(F)C=C1 E60834 [0,0,0,0,0,0|2,0,2]=4 11 B9R1.1 C#CC1=NC=C(N)C=C1 E45201 [0,0,0,0,0,0|2,0,2]=4 12 B9R1.1 C=CC1=CN=C(C)C=C1 M11564 [0,0,0,0,0,0|1,0,2]=3 13 B9R1.1 C=CC1=CN=C(F)C=C1 E16703 [0,0,0,0,0,0|2,0,2]=4 14 B9R1.1 CC1=CC=C(C=O)C=C1 M68600 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.1 CC1=CC=C(CN)C=C1 M69544 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.1 CC1=CC=C(CN)N=N1 M0158 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.1 CC1=CC=C(CN)N=N1 M27037 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.1 CC1=CC=C(CO)C=C1 T37852 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.1 CC1=CC=C(NN)C=C1 T68855 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.1 CC1=CC=C(NN)N=N1 H23440 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.1 CC1=CN=C(C#N)C=C1 C4792 [0,0,0,0,0,0|2,0,1]=3 22 B9R1.1 CC1=CN=C(C#N)C=N1 M42468 [0,0,0,0,0,0|1,0,1]=2 23 B9R1.1 CC1=CN=C(C#N)N=C1 M11787 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.1 CC1=CN=C(C=O)C=C1 M3063 [0,0,0,0,0,0|2,0,1]=3 25 B9R1.1 CC1=CN=C(C=O)C=N1 M14618 [0,0,0,0,0,0|1,0,1]=2 26 B9R1.1 CC1=CN=C(C=O)N=C1 M11474 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.1 CC1=CN=C(CCl)C=C1 C46107 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.1 CC1=CN=C(CCl)C=N1 C11548 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.1 CC1=CN=C(CCl)C=N1 C43004 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.1 CC1=CN=C(CCl)N=C1 C14428 [0,0,0,0,0,0|3,0,0]=3 31 B9R1.1 CC1=CN=C(CCl)N=C1 C8015 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.1 CC1=CN=C(CN)C=C1 M43622 [0,0,0,0,0,0|2,0,0]=2 33 B9R1.1 CC1=CN=C(CN)C=C1 M46461 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.1 CC1=CN=C(CN)C=N1 A3139 [0,0,0,0,0,0|1,0,0]=1 35 B9R1.1 CC1=CN=C(CN)N=C1 M11333 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.1 CC1=CN=C(CO)C=N1 M43210 [0,0,0,0,0,0|1,0,0]=1 37 B9R1.1 CC1=CN=C(CO)N=C1 H11473 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.1 CC1=CN=C(NN)C=C1 H63578 [0,0,0,0,0,0|3,0,0]=3 39 B9R1.1 CC1=NC=C(C#N)C=C1 M12704 [0,0,0,0,0,0|2,0,1]=3 40 B9R1.1 CC1=NC=C(C#N)C=N1 M12702 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.1 CC1=NC=C(C=O)C=C1 M0419 [0,0,0,0,0,0|2,0,1]=3 42 B9R1.1 CC1=NC=C(C=O)C=N1 M12382 [0,0,0,0,0,0|3,0,1]=4 43 B9R1.1 CC1=NC=C(CBr)C=C1 B46089 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.1 CC1=NC=C(CBr)C=N1 B42978 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.1 CC1=NC=C(CCl)C=C1 C46111 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.1 CC1=NC=C(CCl)C=N1 C19650 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.1 CC1=NC=C(CN)C=C1 M0572 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.1 CC1=NC=C(CN)C=N1 A1723 [0,0,0,0,0,0|3,0,0]=3 49 B9R1.1 CC1=NC=C(CO)C=C1 M15722 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.1 CC1=NC=C(CO)C=N1 H12381 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.1 CC1=NC=C(NN)C=C1 H14024 [0,0,0,0,0,0|3,0,0]=3 52 B9R1.1 CC1=NN=C(C#N)C=C1 M0552 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.1 CCC1=CC=C(Br)C=C1 B68945 [0,0,0,0,0,0|3,0,0]=3 54 B9R1.1 CCC1=CC=C(Cl)C=C1 C49160 [0,0,0,0,0,0|3,0,0]=3 55 B9R1.1 CCC1=CC=C(I)C=C1 E49167 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.1 CCC1=CC=C([Mg+])C=C1 E31741 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.1 CCC1=CN=C(Cl)C=C1 C26331 [0,0,0,0,0,0|2,0,0]=2 58 B9R1.1 CCC1=CN=C(Cl)N=C1 E11897 [0,0,0,0,0,0|3,0,0]=3 59 B9R1.1 CCC1=CN=C(N)C=C1 E43600 [0,0,0,0,0,0|2,0,0]=2 60 B9R1.1 CCC1=CN=C(N)N=C1 E28664 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.1 CCC1=NC=C(Br)C=C1 B1614 [0,0,0,0,0,0|2,0,0]=2 62 B9R1.1 CCC1=NC=C(Br)C=N1 B36933 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.1 CCC1=NC=C(Cl)C=C1 C46096 [0,0,0,0,0,0|2,0,0]=2 64 B9R1.1 CCC1=NC=C(N)C=C1 E43602 [0,0,0,0,0,0|2,0,0]=2 65 B9R1.1 CCC1=NC=C(N)C=N1 A11320 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.1 CNC1=CC=C(Br)C=C1 B61266 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.1 CNC1=CC=C(C)C=C1 D39432 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.1 CNC1=CC=C(I)C=C1 K46120 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.1 CNC1=CC=C(N)C=C1 M69627 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.1 CNC1=CN=C(C)C=C1 D43616 [0,0,0,0,0,0|2,0,0]=2 71 B9R1.1 CNC1=NC=C(Br)C=C1 B42975 [0,0,0,0,0,0|3,0,0]=3 72 B9R1.1 CNC1=NC=C(Br)C=N1 B41067 [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|2,0,0]=2 74 B9R1.1 CNC1=NC=C(F)C=C1 F32100 [0,0,0,0,0,0|3,0,0]=3 75 B9R1.1 CNC1=NC=C(N)C=C1 M43342 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.1 CNC1=NC=C(N)C=C1 M43545 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.1 CNC1=NN=C(Br)C=C1 B41068 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.1 CNC1=NN=C(Cl)C=C1 C41078 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.1 COC1=CC=C(S)C=C1 M46276 [0,0,0,0,0,0|4,0,0]=4 80 B9R1.1 COC1=CC=C([Mg+])C=C1 M31744 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.1 COC1=CN=C(Br)C=C1 B5045 [0,0,0,0,0,0|3,0,0]=3 82 B9R1.1 COC1=CN=C(Br)C=N1 B14594 [0,0,0,0,0,0|2,0,0]=2 83 B9R1.1 COC1=CN=C(Br)N=C1 B10519 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.1 COC1=CN=C(Cl)C=C1 C19386 [0,0,0,0,0,0|3,0,0]=3 85 B9R1.1 COC1=CN=C(Cl)C=N1 C14595 [0,0,0,0,0,0|2,0,0]=2 86 B9R1.1 COC1=CN=C(Cl)N=C1 C10446 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.1 COC1=CN=C(F)C=C1 F42925 [0,0,0,0,0,0|3,0,0]=3 88 B9R1.1 COC1=CN=C(I)C=C1 I5931 [0,0,0,0,0,0|3,0,0]=3 89 B9R1.1 COC1=CN=C(N)C=C1 A10497 [0,0,0,0,0,0|3,0,0]=3 90 B9R1.1 COC1=CN=C(N)N=C1 A10520 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.1 COC1=NC=C(Br)C=C1 B9550 [0,0,0,0,0,0|3,0,0]=3 92 B9R1.1 COC1=NC=C(Br)C=N1 B2218 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.1 COC1=NC=C(C)C=C1 M67554 [0,0,0,0,0,0|2,0,0]=2 94 B9R1.1 COC1=NC=C(Cl)C=C1 C42903 [0,0,0,0,0,0|3,0,0]=3 95 B9R1.1 COC1=NC=C(Cl)C=N1 C40931 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.1 COC1=NC=C(F)C=C1 F24011 [0,0,0,0,0,0|3,0,0]=3 97 B9R1.1 COC1=NC=C(I)C=C1 K42935 [0,0,0,0,0,0|3,0,0]=3 98 B9R1.1 COC1=NC=C(I)C=N1 K40945 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.1 COC1=NC=C(N)C=C1 A12692 [0,0,0,0,0,0|3,0,0]=3 100 B9R1.1 COC1=NC=C(N)C=N1 M24312 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.1 COC1=NC=C(N)N=C1 M9733 [0,0,0,0,0,0|2,0,0]=2 102 B9R1.1 COC1=NC=C(O)C=C1 H43140 [0,0,0,0,0,0|3,0,0]=3 103 B9R1.1 COC1=NN=C(Br)C=C1 B36769 [0,0,0,0,0,0|4,0,0]=4 104 B9R1.1 COC1=NN=C(C)C=C1 M43203 [0,0,0,0,0,0|3,0,0]=3 105 B9R1.1 COC1=NN=C(Cl)C=C1 C12386 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.1 COC1=NN=C(I)C=C1 K40944 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.1 COC1=NN=C(N)C=C1 A12790 [0,0,0,0,0,0|4,0,0]=4 108 B9R1.1 COC1=NN=C(N)C=C1 M62955 [0,0,0,0,0,0|4,0,0]=4 109 B9R1.1 CSC1=CC=C(I)C=C1 I38579 [0,0,0,0,0,0|4,0,0]=4 110 B9R1.1 CSC1=CC=C(O)C=C1 M67393 [0,0,0,0,0,0|4,0,0]=4 111 B9R1.1 CSC1=CC=C([Mg+])C=C1 M31771 [0,0,0,0,0,0|4,0,0]=4 112 B9R1.1 CSC1=CN=C(Br)C=N1 B40873 [0,0,0,0,0,0|2,0,0]=2 113 B9R1.1 CSC1=CN=C(Cl)N=C1 C40880 [0,0,0,0,0,0|4,0,0]=4 114 B9R1.1 CSC1=CN=C(N)C=C1 A43262 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.1 CSC1=NC=C(Br)C=C1 B2646 [0,0,0,0,0,0|3,0,0]=3 116 B9R1.1 CSC1=NC=C(Br)C=N1 B2361 [0,0,0,0,0,0|4,0,0]=4 117 B9R1.1 CSC1=NC=C(Cl)C=N1 C23410 [0,0,0,0,0,0|4,0,0]=4 118 B9R1.1 CSC1=NC=C(O)C=N1 M41048 [0,0,0,0,0,0|4,0,0]=4 119 B9R1.1 ClC1=CC=C(CBr)C=C1 B45158 [0,0,0,0,0,0|4,0,0]=4 120 B9R1.1 ClC1=CN=C(CBr)C=C1 B42537 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.1 ClCC1=CC=C(Br)C=C1 B45160 [0,0,0,0,0,0|4,0,0]=4 122 B9R1.1 ClCC1=CN=C(Br)C=C1 B42528 [0,0,0,0,0,0|3,0,0]=3 123 B9R1.1 ClCC1=CN=C(Br)C=C1 B42539 [0,0,0,0,0,0|3,0,0]=3 124 B9R1.1 ClCC1=CN=C(Cl)C=N1 C40730 [0,0,0,0,0,0|2,0,0]=2 125 B9R1.1 ClCC1=CN=C(Cl)N=C1 C11483 [0,0,0,0,0,0|4,0,0]=4 126 B9R1.1 ClCC1=NC=C(Br)C=C1 B42540 [0,0,0,0,0,0|3,0,0]=3 127 B9R1.1 ClCC1=NC=C(Br)C=C1 B61533 [0,0,0,0,0,0|3,0,0]=3 128 B9R1.1 ClCC1=NC=C(Br)C=N1 B14442 [0,0,0,0,0,0|4,0,0]=4 129 B9R1.1 ClCC1=NC=C(Cl)C=C1 C14676 [0,0,0,0,0,0|3,0,0]=3 130 B9R1.1 ClCC1=NC=C(Cl)C=C1 C42565 [0,0,0,0,0,0|3,0,0]=3 131 B9R1.1 ClCC1=NC=C(Cl)C=N1 C14440 [0,0,0,0,0,0|4,0,0]=4 132 B9R1.1 ClCC1=NN=C(Cl)C=C1 C14685 [0,0,0,0,0,0|4,0,0]=4 133 B9R1.1 ClCC1=NN=C(Cl)C=C1 C40731 [0,0,0,0,0,0|4,0,0]=4 134 B9R1.1 FC1=CC=C(C[Mg+])C=C1 F6777 [0,0,0,0,0,0|4,0,0]=4 135 B9R1.1 FC1=CN=C(CCl)N=C1 C31600 [0,0,0,0,0,0|4,0,0]=4 136 B9R1.1 FC1=NC=C(CBr)C=C1 B39061 [0,0,0,0,0,0|3,0,0]=3 137 B9R1.1 FC1=NC=C(CBr)C=C1 B7888 [0,0,0,0,0,0|3,0,0]=3 138 B9R1.1 FC1=NC=C(CCl)C=C1 C7887 [0,0,0,0,0,0|3,0,0]=3 139 B9R1.1 N#CC1=CN=C(Br)C=C1 B41817 [0,0,0,0,0,0|3,0,1]=4 140 B9R1.1 N#CC1=CN=C(Br)C=N1 B3579 [0,0,0,0,0,0|2,0,1]=3 141 B9R1.1 N#CC1=CN=C(Cl)C=C1 C4495 [0,0,0,0,0,0|3,0,1]=4 142 B9R1.1 N#CC1=CN=C(Cl)C=N1 C4890 [0,0,0,0,0,0|2,0,1]=3 143 B9R1.1 N#CC1=CN=C(F)C=C1 F13172 [0,0,0,0,0,0|3,0,1]=4 144 B9R1.1 N#CC1=CN=C(N)C=C1 A0556 [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|3,0,1]=4 146 B9R1.1 N#CC1=NC=C(Br)C=C1 B4492 [0,0,0,0,0,0|3,0,1]=4 147 B9R1.1 N#CC1=NC=C(Cl)C=C1 C27293 [0,0,0,0,0,0|3,0,1]=4 148 B9R1.1 N#CC1=NC=C(F)C=C1 C38463 [0,0,0,0,0,0|3,0,1]=4 149 B9R1.1 N#CC1=NC=C(I)C=C1 C3011 [0,0,0,0,0,0|3,0,1]=4 150 B9R1.1 N#CC1=NC=C(N)C=C1 A12780 [0,0,0,0,0,0|3,0,1]=4 151 B9R1.1 N#CC1=NC=C(N)N=C1 A3818 [0,0,0,0,0,0|2,0,1]=3 152 B9R1.1 N#CC1=NC=C(O)C=C1 C7985 [0,0,0,0,0,0|3,0,1]=4 153 B9R1.1 NC1=CC=C(CO)C=C1 A36619 [0,0,0,0,0,0|4,0,0]=4 154 B9R1.1 NC1=CN=C(C=O)C=N1 A63812 [0,0,0,0,0,0|2,0,1]=3 155 B9R1.1 NC1=NC=C(C=O)C=C1 A12393 [0,0,0,0,0,0|3,0,1]=4 156 B9R1.1 NC1=NC=C(C=O)C=C1 A43519 [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|3,0,0]=3 158 B9R1.1 NC1=NC=C(CO)C=N1 A11298 [0,0,0,0,0,0|4,0,0]=4 159 B9R1.1 NCC1=CC=C(Br)C=C1 B36612 [0,0,0,0,0,0|4,0,0]=4 160 B9R1.1 NCC1=CC=C(Br)C=C1 B46090 [0,0,0,0,0,0|4,0,0]=4 161 B9R1.1 NCC1=CC=C(Cl)C=C1 C46099 [0,0,0,0,0,0|4,0,0]=4 162 B9R1.1 NCC1=CC=C(I)C=C1 I36689 [0,0,0,0,0,0|4,0,0]=4 163 B9R1.1 NCC1=CC=C(I)C=C1 K46123 [0,0,0,0,0,0|4,0,0]=4 164 B9R1.1 NCC1=CC=C(N)C=C1 A46581 [0,0,0,0,0,0|4,0,0]=4 165 B9R1.1 NCC1=CC=C(O)C=C1 A67587 [0,0,0,0,0,0|4,0,0]=4 166 B9R1.1 NCC1=CN=C(Br)C=C1 B42976 [0,0,0,0,0,0|3,0,0]=3 167 B9R1.1 NCC1=CN=C(Cl)C=C1 A0585 [0,0,0,0,0,0|3,0,0]=3 168 B9R1.1 NCC1=CN=C(Cl)N=C1 C7926 [0,0,0,0,0,0|4,0,0]=4 169 B9R1.1 NCC1=CN=C(F)C=C1 A13990 [0,0,0,0,0,0|3,0,0]=3 170 B9R1.1 NCC1=CNC(=O)C=C1 A1719 [0,0,0,0,0,0|3,0,1]=4 171 B9R1.1 NCC1=NC=C(Br)C=C1 B15775 [0,0,0,0,0,0|3,0,0]=3 172 B9R1.1 NCC1=NC=C(Br)C=C1 B42983 [0,0,0,0,0,0|3,0,0]=3 173 B9R1.1 NCC1=NC=C(Br)C=C1 B7021 [0,0,0,0,0,0|3,0,0]=3 174 B9R1.1 NCC1=NC=C(Br)C=N1 B11273 [0,0,0,0,0,0|4,0,0]=4 175 B9R1.1 NCC1=NC=C(Br)C=N1 B29572 [0,0,0,0,0,0|4,0,0]=4 176 B9R1.1 NCC1=NC=C(Br)C=N1 B41070 [0,0,0,0,0,0|4,0,0]=4 177 B9R1.1 NCC1=NC=C(Cl)C=C1 C43002 [0,0,0,0,0,0|3,0,0]=3 178 B9R1.1 NCC1=NC=C(Cl)C=C1 C43003 [0,0,0,0,0,0|3,0,0]=3 179 B9R1.1 NCC1=NC=C(F)C=N1 F14038 [0,0,0,0,0,0|4,0,0]=4 180 B9R1.1 NCC1=NC=C(F)C=N1 F29609 [0,0,0,0,0,0|4,0,0]=4 181 B9R1.1 NCC1=NC=C(N)C=C1 A36932 [0,0,0,0,0,0|3,0,0]=3 182 B9R1.1 NCC1=NN=C(Cl)C=C1 C36937 [0,0,0,0,0,0|4,0,0]=4 183 B9R1.1 NNC1=CN=C(Cl)C=C1 C41073 [0,0,0,0,0,0|4,0,0]=4 184 B9R1.1 NNC1=CN=C(Cl)C=N1 C14613 [0,0,0,0,0,0|3,0,0]=3 185 B9R1.1 NNC1=NC=C(Br)C=C1 B41060 [0,0,0,0,0,0|4,0,0]=4 186 B9R1.1 NNC1=NC=C(Cl)C=C1 C41075 [0,0,0,0,0,0|4,0,0]=4 187 B9R1.1 NNC1=NC=C(F)C=C1 F41395 [0,0,0,0,0,0|4,0,0]=4 188 B9R1.1 O=C1C=CC(CO)=CN1 H37111 [0,0,0,0,0,0|3,0,1]=4 189 B9R1.1 O=CC1=CN=C(Br)C=C1 B2834 [0,0,0,0,0,0|3,0,1]=4 190 B9R1.1 O=CC1=CN=C(Cl)C=C1 C3215 [0,0,0,0,0,0|3,0,1]=4 191 B9R1.1 O=CC1=CN=C(Cl)C=N1 C12389 [0,0,0,0,0,0|2,0,1]=3 192 B9R1.1 O=CC1=CN=C(F)C=C1 F13991 [0,0,0,0,0,0|3,0,1]=4 193 B9R1.1 O=CC1=NC=C(Br)C=C1 B1678 [0,0,0,0,0,0|3,0,1]=4 194 B9R1.1 O=CC1=NC=C(Cl)C=C1 C5623 [0,0,0,0,0,0|3,0,1]=4 195 B9R1.1 O=CC1=NC=C(O)C=C1 H36846 [0,0,0,0,0,0|3,0,1]=4 196 B9R1.1 OCC1=CC=C(Br)C=C1 B67585 [0,0,0,0,0,0|4,0,0]=4 197 B9R1.1 OCC1=CC=C(Cl)C=C1 C39406 [0,0,0,0,0,0|4,0,0]=4 198 B9R1.1 OCC1=CC=C(F)C=C1 F39409 [0,0,0,0,0,0|4,0,0]=4 199 B9R1.1 OCC1=CC=C(I)C=C1 I36662 [0,0,0,0,0,0|4,0,0]=4 200 B9R1.1 OCC1=CN=C(Br)C=C1 B12392 [0,0,0,0,0,0|3,0,0]=3 201 B9R1.1 OCC1=CN=C(Cl)C=C1 C9389 [0,0,0,0,0,0|3,0,0]=3 202 B9R1.1 OCC1=CN=C(Cl)C=N1 C1534 [0,0,0,0,0,0|2,0,0]=2 203 B9R1.1 OCC1=CN=C(Cl)N=C1 C1532 [0,0,0,0,0,0|4,0,0]=4 204 B9R1.1 OCC1=CN=C(F)C=C1 F13989 [0,0,0,0,0,0|3,0,0]=3 205 B9R1.1 OCC1=NC=C(Br)C=C1 B3203 [0,0,0,0,0,0|3,0,0]=3 206 B9R1.1 OCC1=NC=C(Br)C=N1 B14040 [0,0,0,0,0,0|4,0,0]=4 207 B9R1.1 OCC1=NC=C(Cl)C=C1 C22297 [0,0,0,0,0,0|3,0,0]=3 208 B9R1.1 OCC1=NC=C(Cl)C=N1 C14437 [0,0,0,0,0,0|4,0,0]=4 209 B9R1.1 OCC1=NC=C(F)C=C1 F0644 [0,0,0,0,0,0|3,0,0]=3 210 B9R1.1 OCC1=NC=C(F)C=N1 F11272 [0,0,0,0,0,0|4,0,0]=4 211 B9R1.1 OCC1=NN=C(Cl)C=C1 C14684 [0,0,0,0,0,0|4,0,0]=4 212 B8R1.2 BrCC1=CN=CC=C1 B23879 [1,0,0,0,0,0|2,0,0]=3 213 B8R1.2 BrCC1=CN=CN=C1 B36879 [1,0,0,0,0,0|3,0,0]=4 214 B8R1.2 BrCC1=NC=CC=C1 B42841 [1,0,0,0,0,0|2,0,0]=3 215 B8R1.2 BrCC1=NC=CN=C1 B36766 [1,0,0,0,0,0|1,0,0]=2 216 B8R1.2 BrCC1=NC=NC=C1 B32305 [1,0,0,0,0,0|3,0,0]=4 217 B8R1.2 BrCC1=NN=CC=C1 B36818 [1,0,0,0,0,0|3,0,0]=4 218 B8R1.2 C#CC1=CC=CN=C1 E12479 [1,0,0,0,0,0|1,0,2]=4 219 B8R1.2 C#CC1=NC=CC=C1 E12434 [1,0,0,0,0,0|1,0,2]=4 220 B8R1.2 C#CC1=NC=CN=C1 E14588 [1,0,0,0,0,0|0,0,2]=3 221 B8R1.2 CCC1=NC=CN=C1 E43180 [1,0,0,0,0,0|0,0,0]=1 222 B8R1.2 CNC1=CC=CN=C1 M38086 [1,0,0,0,0,0|2,0,0]=3 223 B8R1.2 CNC1=CN=CN=C1 M29839 [1,0,0,0,0,0|3,0,0]=4 224 B8R1.2 CNC1=CN=NC=C1 M38382 [1,0,0,0,0,0|3,0,0]=4 225 B8R1.2 CNC1=NC=CN=C1 M41140 [1,0,0,0,0,0|1,0,0]=2 226 B8R1.2 COC1=CN=CC=C1 M67978 [1,0,0,0,0,0|2,0,0]=3 227 B8R1.2 COC1=CN=NC=C1 M41023 [1,0,0,0,0,0|3,0,0]=4 228 B8R1.2 COC1=NC=CC=C1 M39277 [1,0,0,0,0,0|2,0,0]=3 229 B8R1.2 COC1=NC=CN=C1 M2768 [1,0,0,0,0,0|1,0,0]=2 230 B8R1.2 COC1=NN=CC=C1 M41021 [1,0,0,0,0,0|3,0,0]=4 231 B8R1.2 CSC1=NC=CC=N1 M2492 [1,0,0,0,0,0|3,0,0]=4 232 B8R1.2 CSC1=NN=CC=N1 M5642 [1,0,0,0,0,0|2,0,0]=3 233 B8R1.2 ClCC1=CN=CN=C1 C10228 [1,0,0,0,0,0|3,0,0]=4 234 B8R1.2 ClCC1=NC=CC=C1 C67870 [1,0,0,0,0,0|2,0,0]=3 235 B8R1.2 ClCC1=NC=CC=N1 C0153 [1,0,0,0,0,0|3,0,0]=4 236 B8R1.2 ClCC1=NC=CC=N1 C40877 [1,0,0,0,0,0|3,0,0]=4 237 B8R1.2 ClCC1=NC=CN=C1 C0149 [1,0,0,0,0,0|1,0,0]=2 238 B8R1.2 ClCC1=NC=NC=C1 C40878 [1,0,0,0,0,0|3,0,0]=4 239 B8R1.2 ClCC1=NN=CC=C1 C0156 [1,0,0,0,0,0|3,0,0]=4 240 B8R1.2 N#CC1=NC=CN=C1 C68117 [1,0,0,0,0,0|1,0,1]=3 241 B8R1.2 NCC1=CC=CN=C1 A69257 [1,0,0,0,0,0|2,0,0]=3 242 B8R1.2 NCC1=CC=CN=N1 A0031 [1,0,0,0,0,0|3,0,0]=4 243 B8R1.2 NCC1=CC=CN=N1 P29569 [1,0,0,0,0,0|3,0,0]=4 244 B8R1.2 NCC1=CN=CN=C1 P0028 [1,0,0,0,0,0|3,0,0]=4 245 B8R1.2 NCC1=CN=CN=C1 P29548 [1,0,0,0,0,0|3,0,0]=4 246 B8R1.2 NCC1=CN=NC=C1 A0027 [1,0,0,0,0,0|3,0,0]=4 247 B8R1.2 NCC1=CN=NC=C1 P41350 [1,0,0,0,0,0|3,0,0]=4 248 B8R1.2 NCC1=NC=CC=N1 A7421 [1,0,0,0,0,0|3,0,0]=4 249 B8R1.2 NCC1=NC=CC=N1 P0030 [1,0,0,0,0,0|3,0,0]=4 250 B8R1.2 NCC1=NC=CN=C1 P0029 [1,0,0,0,0,0|1,0,0]=2 251 B8R1.2 NCC1=NC=CN=C1 P4303 [1,0,0,0,0,0|1,0,0]=2 252 B8R1.2 NCC1=NC=NC=C1 A0032 [1,0,0,0,0,0|3,0,0]=4 253 B8R1.2 NCC1=NC=NC=C1 A10198 [1,0,0,0,0,0|3,0,0]=4 254 B8R1.2 NCC1=NC=NC=C1 P23754 [1,0,0,0,0,0|3,0,0]=4 255 B8R1.2 NNC1=CC=CN=C1 H0043 [1,0,0,0,0,0|3,0,0]=4 256 B8R1.2 NNC1=CC=CN=C1 H41349 [1,0,0,0,0,0|3,0,0]=4 257 B8R1.2 NNC1=NC=CC=C1 H38511 [1,0,0,0,0,0|3,0,0]=4 258 B8R1.2 NNC1=NC=CN=C1 H0220 [1,0,0,0,0,0|2,0,0]=3 259 B8R1.2 O=CC1=CN=CC=C1 P13753 [1,0,0,0,0,0|2,0,1]=4 260 B8R1.2 O=CC1=NC=CC=C1 P67836 [1,0,0,0,0,0|2,0,1]=4 261 B8R1.2 O=CC1=NC=CN=C1 P0148 [1,0,0,0,0,0|1,0,1]=3 262 B8R1.2 OCC1=CN=CC=C1 P15946 [1,0,0,0,0,0|2,0,0]=3 263 B8R1.2 OCC1=CN=CN=C1 P0145 [1,0,0,0,0,0|3,0,0]=4 264 B8R1.2 OCC1=NC=CC=C1 P69303 [1,0,0,0,0,0|2,0,0]=3 265 B8R1.2 OCC1=NC=CC=N1 P0151 [1,0,0,0,0,0|3,0,0]=4 266 B8R1.2 OCC1=NC=CN=C1 P0147 [1,0,0,0,0,0|1,0,0]=2 267 B8R1.2 OCC1=NC=NC=C1 P0160 [1,0,0,0,0,0|3,0,0]=4 268 B8R1.2 OCC1=NN=CC=C1 P0155 [1,0,0,0,0,0|3,0,0]=4 269 B8R1.3 BrC1=CN=C(Br)C=C1 D4497 [1,0,0,0,0,0|3,0,0]=4 270 B8R1.3 BrC1=CN=C(Br)C=N1 D3577 [1,0,0,0,0,0|2,0,0]=3 271 B8R1.3 BrC1=CN=C(I)C=C1 B1586 [1,0,0,0,0,0|3,0,0]=4 272 B8R1.3 BrC1=CN=C(I)C=N1 B3582 [1,0,0,0,0,0|2,0,0]=3 273 B8R1.3 BrC1=NC=C(I)C=C1 B12390 [1,0,0,0,0,0|3,0,0]=4 274 B8R1.3 CC1=CC=C(C)N=N1 D43182 [1,0,0,0,0,0|2,0,0]=3 275 B8R1.3 CC1=CC=C(I)C=C1 K68149 [1,0,0,0,0,0|3,0,0]=4 276 B8R1.3 CC1=CC=C(N)N=N1 A0340 [1,0,0,0,0,0|3,0,0]=4 277 B8R1.3 CC1=CC=C([Mg+])C=C1 M31731 [1,0,0,0,0,0|3,0,0]=4 278 B8R1.3 CC1=CN=C(Br)C=C1 B4672 [1,0,0,0,0,0|2,0,0]=3 279 B8R1.3 CC1=CN=C(Br)C=N1 B14614 [1,0,0,0,0,0|1,0,0]=2 280 B8R1.3 CC1=CN=C(Br)N=C1 B67690 [1,0,0,0,0,0|3,0,0]=4 281 B8R1.3 CC1=CN=C(Cl)C=C1 C21968 [1,0,0,0,0,0|2,0,0]=3 282 B8R1.3 CC1=CN=C(Cl)C=N1 C40876 [1,0,0,0,0,0|1,0,0]=2 283 B8R1.3 CC1=CN=C(Cl)N=C1 C4929 [1,0,0,0,0,0|3,0,0]=4 284 B8R1.3 CC1=CN=C(F)C=C1 F22553 [1,0,0,0,0,0|2,0,0]=3 285 B8R1.3 CC1=CN=C(N)C=C1 M20542 [1,0,0,0,0,0|2,0,0]=3 286 B8R1.3 CC1=CN=C(N)C=N1 M14592 [1,0,0,0,0,0|1,0,0]=2 287 B8R1.3 CC1=CN=C(N)N=C1 A0080 [1,0,0,0,0,0|3,0,0]=4 288 B8R1.3 CC1=CN=C(N)N=C1 M38708 [1,0,0,0,0,0|3,0,0]=4 289 B8R1.3 CC1=CN=C(O)C=C1 M63706 [1,0,0,0,0,0|2,0,0]=3 290 B8R1.3 CC1=CNC(=O)C=C1 M68372 [1,0,0,0,0,0|2,0,1]=4 291 B8R1.3 CC1=CNC(=O)C=N1 M68091 [1,0,0,0,0,0|1,0,1]=3 292 B8R1.3 CC1=NC=C(Br)C=C1 B5402 [1,0,0,0,0,0|2,0,0]=3 293 B8R1.3 CC1=NC=C(Br)C=N1 B0659 [1,0,0,0,0,0|3,0,0]=4 294 B8R1.3 CC1=NC=C(Cl)C=C1 C42845 [1,0,0,0,0,0|2,0,0]=3 295 B8R1.3 CC1=NC=C(Cl)C=N1 C40879 [1,0,0,0,0,0|3,0,0]=4 296 B8R1.3 CC1=NC=C(F)C=C1 F1117 [1,0,0,0,0,0|2,0,0]=3 297 B8R1.3 CC1=NC=C(F)C=N1 F40883 [1,0,0,0,0,0|3,0,0]=4 298 B8R1.3 CC1=NC=C(I)C=C1 I36966 [1,0,0,0,0,0|2,0,0]=3 299 B8R1.3 CC1=NC=C(N)C=C1 A1121 [1,0,0,0,0,0|2,0,0]=3 300 B8R1.3 CC1=NC=C(N)C=N1 A10293 [1,0,0,0,0,0|3,0,0]=4 301 B8R1.3 CC1=NC=C(O)C=C1 H4553 [1,0,0,0,0,0|2,0,0]=3 302 B8R1.3 CC1=NC=C(O)C=N1 M23235 [1,0,0,0,0,0|3,0,0]=4 303 B8R1.3 CC1=NN=C(Br)C=C1 B10633 [1,0,0,0,0,0|3,0,0]=4 304 B8R1.3 CC1=NN=C(Cl)C=C1 C3219 [1,0,0,0,0,0|3,0,0]=4 305 B8R1.3 CC1=NN=C(I)C=C1 I10435 [1,0,0,0,0,0|3,0,0]=4 306 B8R1.3 CC1=NNC(=O)C=C1 M0242 [1,0,0,0,0,0|3,0,0]=4 307 B8R1.3 CC1=NNC(=O)C=C1 M25029 [1,0,0,0,0,0|3,0,0]=4 308 B8R1.3 CC1=NNC(=O)C=C1 M41309 [1,0,0,0,0,0|3,0,0]=4 309 B8R1.3 ClC1=CN=C(Br)C=C1 B4976 [1,0,0,0,0,0|3,0,0]=4 310 B8R1.3 ClC1=CN=C(Br)C=N1 B3581 [1,0,0,0,0,0|2,0,0]=3 311 B8R1.3 ClC1=CN=C(Cl)C=C1 D4510 [1,0,0,0,0,0|3,0,0]=4 312 B8R1.3 ClC1=CN=C(Cl)C=N1 D3587 [1,0,0,0,0,0|2,0,0]=3 313 B8R1.3 ClC1=CN=C(I)C=C1 I4551 [1,0,0,0,0,0|3,0,0]=4 314 B8R1.3 ClC1=CN=C(I)C=N1 C39982 [1,0,0,0,0,0|2,0,0]=3 315 B8R1.3 ClC1=NC=C(Br)C=C1 B3973 [1,0,0,0,0,0|3,0,0]=4 316 B8R1.3 ClC1=NC=C(I)C=C1 C24918 [1,0,0,0,0,0|3,0,0]=4 317 B8R1.3 FC1=CN=C(Br)C=C1 B40635 [1,0,0,0,0,0|3,0,0]=4 318 B8R1.3 FC1=CN=C(Br)C=N1 B39978 [1,0,0,0,0,0|2,0,0]=3 319 B8R1.3 FC1=CN=C(Cl)C=C1 C40641 [1,0,0,0,0,0|3,0,0]=4 320 B8R1.3 FC1=CN=C(F)C=C1 D40649 [1,0,0,0,0,0|3,0,0]=4 321 B8R1.3 FC1=CN=C(I)C=C1 F38230 [1,0,0,0,0,0|3,0,0]=4 322 B8R1.3 FC1=NC=C(Br)C=C1 B4730 [1,0,0,0,0,0|3,0,0]=4 323 B8R1.3 FC1=NC=C(Cl)C=C1 C40644 [1,0,0,0,0,0|3,0,0]=4 324 B8R1.3 FC1=NC=C(I)C=C1 F40650 [1,0,0,0,0,0|3,0,0]=4 325 B8R1.3 NC1=CN=C(Br)C=C1 A4783 [1,0,0,0,0,0|3,0,0]=4 326 B8R1.3 NC1=CN=C(Br)C=N1 A2854 [1,0,0,0,0,0|2,0,0]=3 327 B8R1.3 NC1=CN=C(Cl)C=C1 C39174 [1,0,0,0,0,0|3,0,0]=4 328 B8R1.3 NC1=CN=C(Cl)C=N1 A0684 [1,0,0,0,0,0|2,0,0]=3 329 B8R1.3 NC1=CN=C(F)C=C1 A12653 [1,0,0,0,0,0|3,0,0]=4 330 B8R1.3 NC1=CN=C(I)C=C1 A40889 [1,0,0,0,0,0|3,0,0]=4 331 B8R1.3 NC1=CN=C(I)C=N1 A40087 [1,0,0,0,0,0|2,0,0]=3 332 B8R1.3 NC1=CN=C(N)C=N1 P40199 [1,0,0,0,0,0|2,0,0]=3 333 B8R1.3 NC1=CN=C(N)C=N1 P40324 [1,0,0,0,0,0|2,0,0]=3 334 B8R1.3 NC1=NC=C(Br)C=C1 A5382 [1,0,0,0,0,0|3,0,0]=4 335 B8R1.3 NC1=NC=C(F)C=C1 A3607 [1,0,0,0,0,0|3,0,0]=4 336 B8R1.3 NC1=NC=C(I)C=C1 K4516 [1,0,0,0,0,0|3,0,0]=4 337 B8R1.3 NC1=NN=C(Br)C=N1 A39826 [1,0,0,0,0,0|3,0,0]=4 338 B8R1.3 OC1=CN=C(Br)C=C1 B0344 [1,0,0,0,0,0|3,0,0]=4 339 B8R1.3 OC1=CN=C(Br)C=N1 B14598 [1,0,0,0,0,0|2,0,0]=3 340 B8R1.3 OC1=CN=C(Cl)C=C1 C4788 [1,0,0,0,0,0|3,0,0]=4 341 B8R1.3 OC1=CN=C(Cl)C=N1 C38694 [1,0,0,0,0,0|2,0,0]=3 342 B8R1.3 OC1=CN=C(F)C=C1 F5147 [1,0,0,0,0,0|3,0,0]=4 343 B8R1.3 OC1=NC=C(Br)C=C1 B39171 [1,0,0,0,0,0|3,0,0]=4 344 B8R1.3 OC1=NC=C(Br)C=C1 B39172 [1,0,0,0,0,0|3,0,0]=4 345 B8R1.3 OC1=NC=C(F)C=C1 F36674 [1,0,0,0,0,0|3,0,0]=4 346 B8R1.3 OC1=NC=C(I)C=C1 K40858 [1,0,0,0,0,0|3,0,0]=4 347 B8R1.3 SC1=NC=C(Br)C=C1 B40822 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.1 CC1=CC=C(CC#N)C=C1 M39574 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.1 CC1=CC=C(CCBr)C=C1 B0463 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.1 CC1=CC=C(CCO)C=C1 T50265 [0,1,0,0,0,0|2,0,0]=3 351 B10R1.1 CC1=CC=C(CC[Mg+])C=C1 M31724 [0,1,0,0,0,0|2,0,0]=3 352 B10R1.1 CC1=CC=C(CNN)C=C1 M49662 [0,1,0,0,0,0|3,0,0]=4 353 B10R1.1 CC1=CN=C(CC#N)C=C1 M48792 [0,1,0,0,0,0|1,0,1]=3 354 B10R1.1 CC1=NC=C(CCO)C=C1 M15913 [0,1,0,0,0,0|1,0,0]=2 355 B10R1.1 CCCC1=CC=C(Br)C=C1 B39542 [0,1,0,0,0,0|3,0,0]=4 356 B10R1.1 CCCC1=CC=C(N)C=C1 P68566 [0,1,0,0,0,0|3,0,0]=4 357 B10R1.1 CCCC1=CC=C([Mg+])C=C1 P31760 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.1 CCNC1=CC=C(F)C=C1 E46759 [0,1,0,0,0,0|3,0,0]=4 359 B10R1.1 CCOC1=CC=C(I)C=C1 E49468 [0,1,0,0,0,0|3,0,0]=4 360 B10R1.1 CCOC1=CC=C(O)C=C1 E68898 [0,1,0,0,0,0|3,0,0]=4 361 B10R1.1 CCOC1=CC=C([Mg+])C=C1 E31767 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.1 CCOC1=CN=C(Br)C=C1 B46151 [0,1,0,0,0,0|2,0,0]=3 363 B10R1.1 CCOC1=CN=C(Br)N=C1 B11613 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.1 CCOC1=CN=C(Cl)C=C1 C46184 [0,1,0,0,0,0|2,0,0]=3 365 B10R1.1 CCOC1=CN=C(Cl)N=C1 C1802 [0,1,0,0,0,0|3,0,0]=4 366 B10R1.1 CCOC1=CN=C(N)C=C1 E43625 [0,1,0,0,0,0|2,0,0]=3 367 B10R1.1 CCOC1=CN=C(N)N=C1 E43348 [0,1,0,0,0,0|3,0,0]=4 368 B10R1.1 CCOC1=NC=C(Br)C=C1 B4568 [0,1,0,0,0,0|2,0,0]=3 369 B10R1.1 CCOC1=NC=C(Br)C=N1 B2619 [0,1,0,0,0,0|3,0,0]=4 370 B10R1.1 CCOC1=NC=C(I)C=C1 E46226 [0,1,0,0,0,0|2,0,0]=3 371 B10R1.1 CCOC1=NC=C(N)C=N1 E43346 [0,1,0,0,0,0|3,0,0]=4 372 B10R1.1 CCOC1=NC=C(N)N=C1 E9737 [0,1,0,0,0,0|1,0,0]=2 373 B10R1.1 CCOC1=NN=C(Cl)C=C1 C43068 [0,1,0,0,0,0|3,0,0]=4 374 B10R1.1 CCOC1=NN=C(N)C=C1 E43349 [0,1,0,0,0,0|3,0,0]=4 375 B10R1.1 CCSC1=CC=C([Mg+])C=C1 E31791 [0,1,0,0,0,0|3,0,0]=4 376 B10R1.1 CNCC1=CC=C(Br)C=C1 B46738 [0,1,0,0,0,0|3,0,0]=4 377 B10R1.1 CNCC1=CC=C(Br)C=C1 M46740 [0,1,0,0,0,0|3,0,0]=4 378 B10R1.1 CNCC1=CC=C(C)C=C1 M50315 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.1 CNCC1=CC=C(C)C=C1 M52163 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.1 CNCC1=CC=C(Cl)C=C1 C46755 [0,1,0,0,0,0|3,0,0]=4 381 B10R1.1 CNCC1=CC=C(Cl)C=C1 M46757 [0,1,0,0,0,0|3,0,0]=4 382 B10R1.1 COCC1=CC=C(N)C=C1 M46895 [0,1,0,0,0,0|3,0,0]=4 383 B10R1.1 COCC1=NC=C(Br)C=N1 B20026 [0,1,0,0,0,0|3,0,0]=4 384 B10R1.1 ClC1=CC=C(CCBr)C=C1 B48760 [0,1,0,0,0,0|3,0,0]=4 385 B10R1.1 FC1=CC=C(CCBr)C=C1 B13769 [0,1,0,0,0,0|3,0,0]=4 386 B10R1.1 FC1=CC=C(CC[Mg+])C=C1 F31725 [0,1,0,0,0,0|3,0,0]=4 387 B10R1.1 N#CCC1=CN=C(Cl)C=C1 C44776 [0,1,0,0,0,0|2,0,1]=4 388 B10R1.1 N#CCC1=NC=C(Br)C=C1 B10483 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.1 N#CCC1=NC=C(Cl)C=C1 C44783 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.1 N#CCC1=NC=C(N)C=C1 A61010 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.1 NCCC1=CC=C(Cl)C=C1 C67656 [0,1,0,0,0,0|3,0,0]=4 392 B10R1.1 NCCC1=CC=C(F)C=C1 F69101 [0,1,0,0,0,0|3,0,0]=4 393 B10R1.1 NCCC1=NC=C(Br)C=C1 A1731 [0,1,0,0,0,0|2,0,0]=3 394 B10R1.1 OC1=CC=C(CCBr)C=C1 B49426 [0,1,0,0,0,0|3,0,0]=4 395 B10R1.1 OCCC1=CC=C(Br)C=C1 B36776 [0,1,0,0,0,0|3,0,0]=4 396 B10R1.1 OCCC1=CC=C(Cl)C=C1 C39522 [0,1,0,0,0,0|3,0,0]=4 397 B10R1.1 OCCC1=CC=C(F)C=C1 F49459 [0,1,0,0,0,0|3,0,0]=4 398 B10R1.1 OCCC1=CC=C(I)C=C1 K49469 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.1 OCCC1=CN=C(Cl)C=C1 C37718 [0,1,0,0,0,0|2,0,0]=3 400 B10R1.1 OCCC1=NC=C(Br)C=C1 B7705 [0,1,0,0,0,0|2,0,0]=3 401 B10R1.1 [Mg+]CCC1=CC=C(Cl)C=C1 C31726 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.3 BrCC1=CC=C(CBr)C=C1 B48752 [0,1,0,0,0,0|3,0,0]=4 403 B10R1.3 C#CC1=CC=C(CC)C=C1 E52271 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.3 C#CC1=CN=C(OC)C=C1 E0638 [0,1,0,0,0,0|1,0,2]=4 405 B10R1.3 CCC1=CC=C(NN)C=C1 E49533 [0,1,0,0,0,0|3,0,0]=4 406 B10R1.3 CCC1=CC=C(OC)C=C1 E50270 [0,1,0,0,0,0|2,0,0]=3 407 B10R1.3 CCC1=CN=C(C=O)C=C1 E49257 [0,1,0,0,0,0|1,0,1]=3 408 B10R1.3 CNC1=CN=C(C#N)C=C1 M45724 [0,1,0,0,0,0|2,0,1]=4 409 B10R1.3 CNC1=NC=C(C#N)C=C1 M45725 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.3 COC1=CC=C(CN)C=C1 M4627 [0,1,0,0,0,0|3,0,0]=4 411 B10R1.3 COC1=CC=C(CO)C=C1 M68895 [0,1,0,0,0,0|3,0,0]=4 412 B10R1.3 COC1=CC=C(OC)C=C1 D68896 [0,1,0,0,0,0|3,0,0]=4 413 B10R1.3 COC1=CN=C(C#N)C=C1 M5547 [0,1,0,0,0,0|2,0,1]=4 414 B10R1.3 COC1=CN=C(C=O)C=C1 M15225 [0,1,0,0,0,0|2,0,1]=4 415 B10R1.3 COC1=CN=C(CCl)C=C1 C15224 [0,1,0,0,0,0|2,0,0]=3 416 B10R1.3 COC1=CN=C(CCl)N=C1 C19967 [0,1,0,0,0,0|3,0,0]=4 417 B10R1.3 COC1=CN=C(CO)C=C1 H15223 [0,1,0,0,0,0|2,0,0]=3 418 B10R1.3 COC1=CN=C(OC)C=C1 D46391 [0,1,0,0,0,0|2,0,0]=3 419 B10R1.3 COC1=NC=C(C#N)C=C1 M9551 [0,1,0,0,0,0|2,0,1]=4 420 B10R1.3 COC1=NC=C(C=O)C=C1 M31008 [0,1,0,0,0,0|2,0,1]=4 421 B10R1.3 COC1=NC=C(CBr)C=C1 B37014 [0,1,0,0,0,0|2,0,0]=3 422 B10R1.3 COC1=NC=C(CCl)C=C1 C46199 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.3 COC1=NC=C(CN)C=C1 A10463 [0,1,0,0,0,0|2,0,0]=3 424 B10R1.3 COC1=NC=C(CN)C=C1 M29962 [0,1,0,0,0,0|2,0,0]=3 425 B10R1.3 COC1=NC=C(CN)C=C1 M46593 [0,1,0,0,0,0|2,0,0]=3 426 B10R1.3 COC1=NC=C(CN)C=N1 M26757 [0,1,0,0,0,0|3,0,0]=4 427 B10R1.3 COC1=NC=C(CO)C=C1 M0584 [0,1,0,0,0,0|2,0,0]=3 428 B10R1.3 COC1=NC=C(CO)C=N1 M16831 [0,1,0,0,0,0|3,0,0]=4 429 B10R1.3 COC1=NC=C(CO)N=C1 M61572 [0,1,0,0,0,0|1,0,0]=2 430 B10R1.3 COC1=NC=C(NN)C=C1 H43550 [0,1,0,0,0,0|3,0,0]=4 431 B10R1.3 CSC1=NC=C(CO)C=N1 M36801 [0,1,0,0,0,0|3,0,0]=4 432 B10R1.3 N#CC1=CN=C(CBr)C=C1 B44748 [0,1,0,0,0,0|2,0,1]=4 433 B10R1.3 N#CC1=CN=C(CCl)C=C1 C25620 [0,1,0,0,0,0|2,0,1]=4 434 B10R1.3 N#CC1=CN=C(CO)C=C1 H45222 [0,1,0,0,0,0|2,0,1]=4 435 B10R1.3 N#CC1=NC=C(CBr)C=C1 B44747 [0,1,0,0,0,0|2,0,1]=4 436 B10R1.3 N#CC1=NC=C(CCl)C=C1 C44785 [0,1,0,0,0,0|2,0,1]=4 437 B10R1.3 N#CC1=NC=C(CO)C=C1 H24396 [0,1,0,0,0,0|2,0,1]=4 438 B10R1.3 NCC1=CC=C(CN)C=C1 P46958 [0,1,0,0,0,0|3,0,0]=4 439 B10R1.3 NCC1=CC=C(CO)C=C1 A37992 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.3 OCC1=CC=C(CBr)C=C1 B38754 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.3 OCC1=CC=C(CCl)C=C1 C49451 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.3 OCC1=CC=C(CO)C=C1 B68897 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [0,1,0,0,0,0|2,0,1]=4 444 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B3106 [0,1,0,0,0,0|2,0,1]=4 445 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [0,1,0,0,0,0|1,0,1]=3 446 B10R1.13 CC(=O)C1=CN=C(C)N=C1 M13671 [0,1,0,0,0,0|2,0,1]=4 447 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 A24257 [0,1,0,0,0,0|2,0,1]=4 448 B10R1.13 CC(=O)C1=CN=C(F)C=C1 F45498 [0,1,0,0,0,0|2,0,1]=4 449 B10R1.13 CC(=O)C1=CN=C(N)C=C1 A22139 [0,1,0,0,0,0|2,0,1]=4 450 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 B22347 [0,1,0,0,0,0|2,0,1]=4 451 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [0,1,0,0,0,0|1,0,1]=3 452 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 C26822 [0,1,0,0,0,0|2,0,1]=4 453 B10R1.13 CC(=O)C1=NC=C(O)C=C1 H45820 [0,1,0,0,0,0|2,0,1]=4 454 B10R1.13 CC(=O)C1=NC=C(O)N=C1 H42776 [0,1,0,0,0,0|1,0,1]=3 455 B10R1.13 CC(C)C1=CC=C(Br)C=C1 B49963 [0,1,0,0,0,0|3,0,0]=4 456 B10R1.13 CC(C)C1=CC=C(N)C=C1 P69319 [0,1,0,0,0,0|3,0,0]=4 457 B10R1.13 CC(C)C1=CC=C(O)C=C1 P60863 [0,1,0,0,0,0|3,0,0]=4 458 B10R1.13 CC(C)C1=CC=C([Mg+])C=C1 P31759 [0,1,0,0,0,0|3,0,0]=4 459 B10R1.13 CC(C)C1=CN=C(Br)C=C1 B46728 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.13 CC(C)C1=CN=C(N)C=C1 P24474 [0,1,0,0,0,0|2,0,0]=3 461 B10R1.13 CC(C)C1=NC=C(Br)C=C1 B32058 [0,1,0,0,0,0|2,0,0]=3 462 B10R1.13 CC(C)C1=NC=C(Br)C=N1 B13199 [0,1,0,0,0,0|3,0,0]=4 463 B10R1.13 CC(C)C1=NC=C(N)C=C1 A12160 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.13 CC1=CC=C(C(C)C)C=C1 D60786 [0,1,0,0,0,0|2,0,0]=3 465 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T52161 [0,1,0,0,0,0|2,0,0]=3 466 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T60511 [0,1,0,0,0,0|2,0,0]=3 467 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 T50271 [0,1,0,0,0,0|2,0,0]=3 468 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [0,1,0,0,0,0|3,0,0]=4 469 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M23707 [0,1,0,0,0,0|2,0,1]=4 470 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M46550 [0,1,0,0,0,0|2,0,1]=4 471 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M4677 [0,1,0,0,0,0|1,0,1]=3 472 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 M49667 [0,1,0,0,0,0|1,0,0]=2 473 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 M42775 [0,1,0,0,0,0|3,0,0]=4 474 B10R1.13 CC1=NC=C(B(O)O)C=C1 M24773 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [0,1,0,0,0,0|2,0,1]=4 476 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 H64312 [0,1,0,0,0,0|1,0,0]=2 477 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 M4745 [0,1,0,0,0,0|3,0,0]=4 478 B10R1.13 CN(C)C1=CN=C(Br)C=C1 B46285 [0,1,0,0,0,0|3,0,0]=4 479 B10R1.13 CN(C)C1=CN=C(Br)C=N1 B43265 [0,1,0,0,0,0|2,0,0]=3 480 B10R1.13 CN(C)C1=CN=C(Cl)C=C1 C46302 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.13 CN(C)C1=NC=C(Br)C=C1 B3355 [0,1,0,0,0,0|3,0,0]=4 482 B10R1.13 CN(C)C1=NC=C(I)C=C1 K46311 [0,1,0,0,0,0|3,0,0]=4 483 B10R1.13 CN(C)C1=NC=C(N)C=C1 A12270 [0,1,0,0,0,0|3,0,0]=4 484 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 B38580 [0,1,0,0,0,0|3,0,0]=4 485 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 C64533 [0,1,0,0,0,0|3,0,0]=4 486 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F46766 [0,1,0,0,0,0|3,0,0]=4 487 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F49509 [0,1,0,0,0,0|3,0,0]=4 488 B10R1.13 C[C@@H](N)C1=CN=C(Br)C=C1 B63698 [0,1,0,0,0,0|2,0,0]=3 489 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 F46566 [0,1,0,0,0,0|2,0,0]=3 490 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 B49428 [0,1,0,0,0,0|3,0,0]=4 491 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 C49454 [0,1,0,0,0,0|3,0,0]=4 492 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 F49461 [0,1,0,0,0,0|3,0,0]=4 493 B10R1.13 C[C@H](Br)C1=CC=C(F)C=C1 B36983 [0,1,0,0,0,0|3,0,0]=4 494 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46724 [0,1,0,0,0,0|3,0,0]=4 495 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46735 [0,1,0,0,0,0|3,0,0]=4 496 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B65383 [0,1,0,0,0,0|3,0,0]=4 497 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F36974 [0,1,0,0,0,0|3,0,0]=4 498 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F64415 [0,1,0,0,0,0|3,0,0]=4 499 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46768 [0,1,0,0,0,0|3,0,0]=4 500 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46771 [0,1,0,0,0,0|3,0,0]=4 501 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 A46957 [0,1,0,0,0,0|3,0,0]=4 502 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 B46292 [0,1,0,0,0,0|2,0,0]=3 503 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 B46296 [0,1,0,0,0,0|2,0,0]=3 504 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F0635 [0,1,0,0,0,0|2,0,0]=3 505 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F46612 [0,1,0,0,0,0|2,0,0]=3 506 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 F14039 [0,1,0,0,0,0|3,0,0]=4 507 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 F29648 [0,1,0,0,0,0|3,0,0]=4 508 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 B49431 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49442 [0,1,0,0,0,0|3,0,0]=4 510 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49449 [0,1,0,0,0,0|3,0,0]=4 511 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 F49463 [0,1,0,0,0,0|3,0,0]=4 512 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 H46826 [0,1,0,0,0,0|3,0,0]=4 513 B10R1.13 FC(F)C1=NC=C(Br)C=C1 B28701 [0,1,0,0,0,0|3,0,0]=4 514 B10R1.13 NC(=O)C1=CN=C(Br)C=N1 B40806 [0,1,0,0,0,0|2,0,1]=4 515 B10R1.13 NC(=O)C1=NC=C(N)N=C1 A41099 [0,1,0,0,0,0|2,0,1]=4 516 B10R1.13 NC1=CN=C(C(=O)O)C=N1 A14591 [0,1,0,0,0,0|2,0,1]=4 517 B10R1.13 NC1=CN=C(C(F)F)C=C1 D36896 [0,1,0,0,0,0|3,0,0]=4 518 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 B26010 [0,1,0,0,0,0|2,0,1]=4 519 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 C7535 [0,1,0,0,0,0|2,0,1]=4 520 B10R1.13 O=C(O)C1=NC=C(O)N=C1 H12388 [0,1,0,0,0,0|2,0,1]=4 521 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=N1 B40008 [0,1,0,0,0,0|3,0,0]=4 522 B10R1.13 OC1=CN=C(C(F)F)C=C1 D43514 [0,1,0,0,0,0|3,0,0]=4 523 B10R1.25 C#CC1=NC=C(C)C=C1N E8223 [0,1,0,0,0,0|1,0,2]=4 524 B10R1.25 CC1=C(CO)C=CC(F)=N1 F46222 [0,1,0,0,0,0|3,0,0]=4 525 B10R1.25 CC1=CC(Br)=C(C#N)N=C1 B44752 [0,1,0,0,0,0|2,0,1]=4 526 B10R1.25 CC1=CC(Br)=CN=C1CN B46293 [0,1,0,0,0,0|3,0,0]=4 527 B10R1.25 CC1=CC(C)=C(C=O)C=N1 D49261 [0,1,0,0,0,0|2,0,1]=4 528 B10R1.25 CC1=CC(C)=C(CBr)C=C1 B49966 [0,1,0,0,0,0|3,0,0]=4 529 B10R1.25 CC1=CC(C)=C(CO)C=C1 D50273 [0,1,0,0,0,0|3,0,0]=4 530 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 C46753 [0,1,0,0,0,0|3,0,0]=4 531 B10R1.25 CC1=CC(N)=C(CO)C=C1 A46913 [0,1,0,0,0,0|3,0,0]=4 532 B10R1.25 CC1=CC(N)=C(CO)C=N1 A43644 [0,1,0,0,0,0|2,0,0]=3 533 B10R1.25 CC1=CC=C(C#N)C(Br)=N1 B14778 [0,1,0,0,0,0|2,0,1]=4 534 B10R1.25 CC1=CC=C(C#N)C(Cl)=N1 C12889 [0,1,0,0,0,0|2,0,1]=4 535 B10R1.25 CC1=CC=C(C=O)C(Cl)=N1 C45484 [0,1,0,0,0,0|2,0,1]=4 536 B10R1.25 CC1=CC=C(CBr)C(Br)=N1 B45763 [0,1,0,0,0,0|2,0,0]=3 537 B10R1.25 CC1=CN=C(CCl)C(C)=C1 C38639 [0,1,0,0,0,0|2,0,0]=3 538 B10R1.25 CC1=CN=C(CO)C(C)=C1 D46914 [0,1,0,0,0,0|2,0,0]=3 539 B10R1.25 CC1=NC(=O)C(CO)=CN1 H43232 [0,1,0,0,0,0|3,0,0]=4 540 B10R1.25 CC1=NC(C)=C(CO)C=C1 D64003 [0,1,0,0,0,0|2,0,0]=3 541 B10R1.25 CC1=NC(N)=C(CO)C=N1 A67768 [0,1,0,0,0,0|3,0,0]=4 542 B10R1.25 CC1=NC=C(CN)C(N)=N1 A61754 [0,1,0,0,0,0|3,0,0]=4 543 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 C46746 [0,1,0,0,0,0|3,0,0]=4 544 B10R1.25 CCC1=C(Cl)N=C(Cl)N=C1 D38805 [0,1,0,0,0,0|3,0,0]=4 545 B10R1.25 CCC1=C(F)C=C(O)C=C1 E65621 [0,1,0,0,0,0|3,0,0]=4 546 B10R1.25 CCC1=C(N)C=C(Br)C=C1 B46721 [0,1,0,0,0,0|3,0,0]=4 547 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C46745 [0,1,0,0,0,0|3,0,0]=4 548 B10R1.25 CCC1=NC=C(Br)C=C1N A11260 [0,1,0,0,0,0|2,0,0]=3 549 B10R1.25 CCC1=NC=C(Cl)N=C1Cl D42741 [0,1,0,0,0,0|1,0,0]=2 550 B10R1.25 CNC1=C(Br)C=C(C)C=C1 B46730 [0,1,0,0,0,0|3,0,0]=4 551 B10R1.25 CNC1=NC=C(Br)C=C1N B26263 [0,1,0,0,0,0|3,0,0]=4 552 B10R1.25 COC1=C(Br)C=C(Br)C=N1 D42633 [0,1,0,0,0,0|3,0,0]=4 553 B10R1.25 COC1=C(Br)C=C(C)C=N1 B46168 [0,1,0,0,0,0|2,0,0]=3 554 B10R1.25 COC1=C(Br)C=C(Cl)C=N1 B16110 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 B42645 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.25 COC1=C(Br)C=C(F)C=N1 B42652 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.25 COC1=C(Br)C=C(F)N=C1 B37314 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.25 COC1=C(Br)C=C(N)C=N1 B43055 [0,1,0,0,0,0|3,0,0]=4 559 B10R1.25 COC1=C(Br)C=C(O)C=N1 B42852 [0,1,0,0,0,0|3,0,0]=4 560 B10R1.25 COC1=C(Br)N=C(I)C=C1 B36842 [0,1,0,0,0,0|3,0,0]=4 561 B10R1.25 COC1=C(C)C=C(C)C=C1 D50266 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.25 COC1=C(C)N=C(Br)C=C1 B46175 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C46202 [0,1,0,0,0,0|2,0,0]=3 564 B10R1.25 COC1=C(Cl)C=C(N)C=N1 C43070 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.25 COC1=C(Cl)C=C(N)N=C1 C10605 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.25 COC1=C(F)C=C(N)C=N1 A43085 [0,1,0,0,0,0|3,0,0]=4 567 B10R1.25 COC1=C(I)C=C(Br)C=N1 B42657 [0,1,0,0,0,0|3,0,0]=4 568 B10R1.25 COC1=C(I)C=C(C)C=C1 K62337 [0,1,0,0,0,0|3,0,0]=4 569 B10R1.25 COC1=C(N)N=C(Br)C=C1 B36893 [0,1,0,0,0,0|3,0,0]=4 570 B10R1.25 COC1=C(N)N=C(F)C=C1 F43084 [0,1,0,0,0,0|3,0,0]=4 571 B10R1.25 COC1=C([Mg+])C=C(C)C=C1 M31765 [0,1,0,0,0,0|3,0,0]=4 572 B10R1.25 COC1=CC=C(Br)N=C1Br D42631 [0,1,0,0,0,0|3,0,0]=4 573 B10R1.25 COC1=CC=C(C)N=C1Br B3731 [0,1,0,0,0,0|2,0,0]=3 574 B10R1.25 COC1=CC=C(C)N=C1Cl C46200 [0,1,0,0,0,0|2,0,0]=3 575 B10R1.25 COC1=CC=C(Cl)N=C1Br B42641 [0,1,0,0,0,0|3,0,0]=4 576 B10R1.25 COC1=CC=C(N)N=C1Cl C10744 [0,1,0,0,0,0|3,0,0]=4 577 B10R1.25 COC1=CN=C(Br)C=C1N B62821 [0,1,0,0,0,0|3,0,0]=4 578 B10R1.25 COC1=CN=C(Cl)C=C1N C43069 [0,1,0,0,0,0|3,0,0]=4 579 B10R1.25 COC1=NC=C(Br)C=C1C B46172 [0,1,0,0,0,0|3,0,0]=4 580 B10R1.25 COC1=NC=C(Br)C=C1Cl B42648 [0,1,0,0,0,0|3,0,0]=4 581 B10R1.25 COC1=NC=C(Br)C=C1F B42654 [0,1,0,0,0,0|3,0,0]=4 582 B10R1.25 COC1=NC=C(Br)C=C1N B7645 [0,1,0,0,0,0|3,0,0]=4 583 B10R1.25 COC1=NC=C(Br)C=C1O B10651 [0,1,0,0,0,0|3,0,0]=4 584 B10R1.25 COC1=NC=C(Cl)C=C1F C69055 [0,1,0,0,0,0|3,0,0]=4 585 B10R1.25 COC1=NC=C(F)C=C1C F46221 [0,1,0,0,0,0|3,0,0]=4 586 B10R1.25 COC1=NC=C(F)C=C1N F37439 [0,1,0,0,0,0|3,0,0]=4 587 B10R1.25 COC1=NC=C(N)C=C1C M43642 [0,1,0,0,0,0|3,0,0]=4 588 B10R1.25 CSC1=NC=C(Cl)N=C1Cl D20240 [0,1,0,0,0,0|2,0,0]=3 589 B10R1.25 ClCC1=CN=C(Cl)C=C1Cl D42231 [0,1,0,0,0,0|3,0,0]=4 590 B10R1.25 N#CC1=NC=C(Cl)N=C1Cl D11544 [0,1,0,0,0,0|2,0,1]=4 591 B10R1.25 N#CC1=NC=C(N)N=C1Cl A62103 [0,1,0,0,0,0|2,0,1]=4 592 B10R1.25 NC1=CC(Br)=CN=C1CO A12038 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.25 NC1=CC(Cl)=CN=C1CO A59939 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.25 NC1=CC(Cl)=NC=C1CO A25618 [0,1,0,0,0,0|3,0,0]=4 595 B10R1.25 NCC1=C(F)C=C(F)C=N1 D43571 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.25 NCC1=NC=C(Br)C=C1F A12623 [0,1,0,0,0,0|3,0,0]=4 597 B10R1.25 NCC1=NC=C(Br)C=C1F B27080 [0,1,0,0,0,0|3,0,0]=4 598 B10R1.25 NCC1=NC=C(Cl)N=C1Cl D62358 [0,1,0,0,0,0|2,0,0]=3 599 B10R1.25 OCC1=C(Br)C=C(Cl)C=N1 B17743 [0,1,0,0,0,0|3,0,0]=4 600 B10R1.25 OCC1=C(Cl)C=C(Cl)C=N1 D6829 [0,1,0,0,0,0|3,0,0]=4 601 B10R1.25 OCC1=CC=C(Br)N=C1Br D42635 [0,1,0,0,0,0|3,0,0]=4 602 B10R1.25 OCC1=CC=C(Cl)N=C1Cl D0718 [0,1,0,0,0,0|3,0,0]=4 603 B10R1.25 OCC1=CN=C(Cl)C=C1Cl D42662 [0,1,0,0,0,0|3,0,0]=4 604 B10R1.25 OCC1=NC=C(Br)C=C1Cl B42651 [0,1,0,0,0,0|3,0,0]=4 605 B10R1.25 OCC1=NC=C(Br)C=C1F B0544 [0,1,0,0,0,0|3,0,0]=4 606 B10R1.25 OCC1=NC=C(Cl)C=C1F C13727 [0,1,0,0,0,0|3,0,0]=4 607 B10R1.176 CC1=C(Br)C=C(C#N)N=C1 B44753 [0,1,0,0,0,0|2,0,1]=4 608 B10R1.176 CC1=C(Br)C=C(C=O)N=C1 B45472 [0,1,0,0,0,0|2,0,1]=4 609 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 B38347 [0,1,0,0,0,0|3,0,0]=4 610 B10R1.176 CC1=C(Br)C=C(CO)C=C1 B49432 [0,1,0,0,0,0|3,0,0]=4 611 B10R1.176 CC1=C(Br)C=NC(CO)=C1 B46178 [0,1,0,0,0,0|3,0,0]=4 612 B10R1.176 CC1=C(C)C=C(CCl)C=C1 C49971 [0,1,0,0,0,0|3,0,0]=4 613 B10R1.176 CC1=C(C)C=C(CO)C=C1 D50275 [0,1,0,0,0,0|3,0,0]=4 614 B10R1.176 CC1=C(Cl)C=C(C#N)C=N1 C63869 [0,1,0,0,0,0|2,0,1]=4 615 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 C46749 [0,1,0,0,0,0|3,0,0]=4 616 B10R1.176 CC1=C(F)C=C(CO)C=N1 F46223 [0,1,0,0,0,0|2,0,0]=3 617 B10R1.176 CC1=C(F)C=CC(CCl)=N1 C19366 [0,1,0,0,0,0|3,0,0]=4 618 B10R1.176 CC1=C(I)C=C(CO)C=C1 K63324 [0,1,0,0,0,0|3,0,0]=4 619 B10R1.176 CC1=CC(C#N)=CN=C1C D48779 [0,1,0,0,0,0|2,0,1]=4 620 B10R1.176 CC1=CC=C(C#N)N=C1Br B23729 [0,1,0,0,0,0|2,0,1]=4 621 B10R1.176 CC1=NC=C(C#N)C=C1N A45726 [0,1,0,0,0,0|2,0,1]=4 622 B10R1.176 CCC1=CC(Br)=C(O)C=C1 B49424 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.176 CCC1=CC(C)=C(C)C=C1 E53022 [0,1,0,0,0,0|2,0,0]=3 624 B10R1.176 CCC1=CC(C)=C(I)C=C1 E49973 [0,1,0,0,0,0|3,0,0]=4 625 B10R1.176 CCC1=CC(F)=C(N)C=C1 E46758 [0,1,0,0,0,0|3,0,0]=4 626 B10R1.176 CCC1=CC(N)=C(N)C=C1 E49664 [0,1,0,0,0,0|3,0,0]=4 627 B10R1.176 CCC1=CC(O)=C(N)C=C1 A49521 [0,1,0,0,0,0|3,0,0]=4 628 B10R1.176 CCC1=NC(C)=C(C)N=C1 E46963 [0,1,0,0,0,0|0,0,0]=1 629 B10R1.176 CCC1=NC(Cl)=C(Br)C=C1 B45765 [0,1,0,0,0,0|2,0,0]=3 630 B10R1.176 COC1=CC(Br)=C(C)C=C1 B49439 [0,1,0,0,0,0|3,0,0]=4 631 B10R1.176 COC1=CC(Br)=C(C)C=N1 B37321 [0,1,0,0,0,0|2,0,0]=3 632 B10R1.176 COC1=CC(Br)=C(C)N=C1 B13456 [0,1,0,0,0,0|2,0,0]=3 633 B10R1.176 COC1=CC(Br)=C(Cl)C=N1 B42646 [0,1,0,0,0,0|3,0,0]=4 634 B10R1.176 COC1=CC(Br)=C(F)C=N1 B42653 [0,1,0,0,0,0|3,0,0]=4 635 B10R1.176 COC1=CC(C)=C(Br)C=N1 B46173 [0,1,0,0,0,0|3,0,0]=4 636 B10R1.176 COC1=CC(Cl)=C(Br)C=N1 B38791 [0,1,0,0,0,0|3,0,0]=4 637 B10R1.176 COC1=CC(Cl)=C(C)C=C1 C49453 [0,1,0,0,0,0|3,0,0]=4 638 B10R1.176 COC1=CC(F)=C(Br)C=N1 B60043 [0,1,0,0,0,0|3,0,0]=4 639 B10R1.176 COC1=CC(F)=C(C)C=C1 F49466 [0,1,0,0,0,0|3,0,0]=4 640 B10R1.176 COC1=CC(F)=C(N)N=C1 F43081 [0,1,0,0,0,0|3,0,0]=4 641 B10R1.176 COC1=CC(I)=C(Cl)C=N1 C61104 [0,1,0,0,0,0|3,0,0]=4 642 B10R1.176 COC1=CC(I)=C(F)C=N1 F62243 [0,1,0,0,0,0|3,0,0]=4 643 B10R1.176 COC1=CC(N)=C(Br)C=N1 A7726 [0,1,0,0,0,0|3,0,0]=4 644 B10R1.176 COC1=CC(N)=C(C)C=C1 M46901 [0,1,0,0,0,0|3,0,0]=4 645 B10R1.176 COC1=CC(N)=C(F)C=N1 F24390 [0,1,0,0,0,0|3,0,0]=4 646 B10R1.176 COC1=CC(O)=C(C)C=C1 M46827 [0,1,0,0,0,0|3,0,0]=4 647 B10R1.176 COC1=CC=C(Br)C(Br)=N1 D42629 [0,1,0,0,0,0|3,0,0]=4 648 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 D42661 [0,1,0,0,0,0|3,0,0]=4 649 B10R1.176 COC1=CC=C(N)C(Br)=N1 A43056 [0,1,0,0,0,0|3,0,0]=4 650 B10R1.176 COC1=CC=C(N)C(Cl)=N1 A3832 [0,1,0,0,0,0|3,0,0]=4 651 B10R1.176 COC1=CN=C(Br)C(C)=N1 B43057 [0,1,0,0,0,0|2,0,0]=3 652 B10R1.176 COC1=CN=C(Br)C(N)=C1 B43053 [0,1,0,0,0,0|3,0,0]=4 653 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C46201 [0,1,0,0,0,0|3,0,0]=4 654 B10R1.176 COC1=CN=C(Cl)C(N)=C1 C25045 [0,1,0,0,0,0|3,0,0]=4 655 B10R1.176 COC1=CN=C(Cl)C(N)=N1 C18840 [0,1,0,0,0,0|2,0,0]=3 656 B10R1.176 COC1=NC(C)=C(Br)C=C1 B46158 [0,1,0,0,0,0|3,0,0]=4 657 B10R1.176 COC1=NC(C)=C(F)C=C1 F46212 [0,1,0,0,0,0|3,0,0]=4 658 B10R1.176 COC1=NC(C)=C(N)C=C1 M46590 [0,1,0,0,0,0|3,0,0]=4 659 B10R1.176 COC1=NC(C)=C(N)C=C1 M69566 [0,1,0,0,0,0|3,0,0]=4 660 B10R1.176 COC1=NC(C)=C(N)N=C1 M43352 [0,1,0,0,0,0|2,0,0]=3 661 B10R1.176 COC1=NC(Cl)=C(Br)C=C1 B42643 [0,1,0,0,0,0|3,0,0]=4 662 B10R1.176 COC1=NC(N)=C(Br)C=C1 B38888 [0,1,0,0,0,0|3,0,0]=4 663 B10R1.176 COC1=NC=C(C)C(N)=C1 M43637 [0,1,0,0,0,0|2,0,0]=3 664 B10R1.176 COC1=NC=C(N)C(C)=C1 M43641 [0,1,0,0,0,0|3,0,0]=4 665 B10R1.176 COC1=NC=C(N)C(N)=C1 M43351 [0,1,0,0,0,0|3,0,0]=4 666 B10R1.176 CSC1=CN=C(Cl)C(Cl)=N1 P11188 [0,1,0,0,0,0|2,0,0]=3 667 B10R1.176 CSC1=NC=C(C)C(=O)N1 M43258 [0,1,0,0,0,0|3,0,0]=4 668 B10R1.176 CSC1=NC=C(C)C(Cl)=N1 C43008 [0,1,0,0,0,0|3,0,0]=4 669 B10R1.176 ClC1=C(I)C=C(CBr)C=N1 B42208 [0,1,0,0,0,0|3,0,0]=4 670 B10R1.176 FC1=C(Br)C=C(CCl)C=N1 B42205 [0,1,0,0,0,0|3,0,0]=4 671 B10R1.176 NC1=C(Br)C=C(CO)C=N1 A43064 [0,1,0,0,0,0|3,0,0]=4 672 B10R1.176 NC1=C(Br)C=NC(CO)=C1 A13425 [0,1,0,0,0,0|3,0,0]=4 673 B10R1.176 NCC1=NC(Cl)=C(Br)C=C1 B36820 [0,1,0,0,0,0|3,0,0]=4 674 B10R1.176 OCC1=CC(Cl)=C(F)C=N1 C5396 [0,1,0,0,0,0|3,0,0]=4 675 B10R1.176 OCC1=CC(I)=C(Cl)N=C1 C42675 [0,1,0,0,0,0|3,0,0]=4 676 B10R1.176 OCC1=CN=C(Cl)C(Cl)=C1 D9504 [0,1,0,0,0,0|3,0,0]=4 677 B10R2.31 BrC1=CC2=C(C=C1)CC2 B48297 [0,0,0,1,0,0|3,0,0]=4 678 B8R1.1 C#CC1=NC(C)=CS1 E42681 [0,0,0,0,1,0|1,0,2]=4 679 B8R1.1 CC1=CC(C#N)=NN1 M9814 [0,0,0,0,1,0|2,0,1]=4 680 B8R1.1 CC1=CC(C=O)=CS1 M29797 [0,0,0,0,1,0|2,0,1]=4 681 B8R1.1 CC1=CC(C=O)=NN1 M41030 [0,0,0,0,1,0|2,0,1]=4 682 B8R1.1 CC1=CC(CN)=NO1 M15781 [0,0,0,0,1,0|2,0,0]=3 683 B8R1.1 CC1=CC=C(CN)O1 M37131 [0,0,0,0,1,0|3,0,0]=4 684 B8R1.1 CC1=CC=C(CO)O1 M43304 [0,0,0,0,1,0|3,0,0]=4 685 B8R1.1 CC1=CN=C(C=O)S1 M19270 [0,0,0,0,1,0|2,0,1]=4 686 B8R1.1 CC1=CN=C(CO)S1 M41173 [0,0,0,0,1,0|2,0,0]=3 687 B8R1.1 CC1=CNC(C#N)=N1 M40951 [0,0,0,0,1,0|1,0,2]=4 688 B8R1.1 CC1=COC(C=O)=C1 M13538 [0,0,0,0,1,0|2,0,1]=4 689 B8R1.1 CC1=COC(C=O)=N1 M12937 [0,0,0,0,1,0|2,0,1]=4 690 B8R1.1 CC1=CSC(C#N)=N1 M8139 [0,0,0,0,1,0|2,0,1]=4 691 B8R1.1 CC1=CSC(C=O)=C1 M42959 [0,0,0,0,1,0|2,0,1]=4 692 B8R1.1 CC1=CSC(C=O)=N1 M14992 [0,0,0,0,1,0|2,0,1]=4 693 B8R1.1 CC1=CSC(CN)=N1 M64512 [0,0,0,0,1,0|2,0,0]=3 694 B8R1.1 CC1=NC(C=O)=CO1 M3278 [0,0,0,0,1,0|2,0,1]=4 695 B8R1.1 CC1=NC(C=O)=CS1 F2075 [0,0,0,0,1,0|2,0,1]=4 696 B8R1.1 CC1=NC(C=O)=NO1 M32392 [0,0,0,0,1,0|2,0,1]=4 697 B8R1.1 CC1=NC(CCl)=NO1 C40128 [0,0,0,0,1,0|2,0,0]=3 698 B8R1.1 CC1=NC(CN)=CO1 M41196 [0,0,0,0,1,0|2,0,0]=3 699 B8R1.1 CC1=NC(CN)=CO1 M41310 [0,0,0,0,1,0|2,0,0]=3 700 B8R1.1 CC1=NC=C(C=O)S1 F2897 [0,0,0,0,1,0|2,0,1]=4 701 B8R1.1 CC1=NC=C(CBr)S1 B41111 [0,0,0,0,1,0|2,0,0]=3 702 B8R1.1 CC1=NC=C(CN)O1 M41197 [0,0,0,0,1,0|2,0,0]=3 703 B8R1.1 CC1=NC=C(CO)O1 M37561 [0,0,0,0,1,0|2,0,0]=3 704 B8R1.1 CC1=NC=C(CO)S1 M1967 [0,0,0,0,1,0|2,0,0]=3 705 B8R1.1 CC1=NN=C(CCl)S1 M66901 [0,0,0,0,1,0|3,0,0]=4 706 B8R1.1 CC1=NOC(C=O)=N1 M36862 [0,0,0,0,1,0|2,0,1]=4 707 B8R1.1 CC1=NOC(CN)=C1 M41364 [0,0,0,0,1,0|2,0,0]=3 708 B8R1.1 CCC1=CC(N)=NO1 E41190 [0,0,0,0,1,0|2,0,0]=3 709 B8R1.1 CCC1=CC=C(C)S1 E43745 [0,0,0,0,1,0|2,0,0]=3 710 B8R1.1 CCC1=CN=C(C)N1 E41428 [0,0,0,0,1,0|0,0,1]=2 711 B8R1.1 CCC1=CN=C(N)S1 E41203 [0,0,0,0,1,0|2,0,0]=3 712 B8R1.1 CCC1=CN=C(N)S1 E69753 [0,0,0,0,1,0|2,0,0]=3 713 B8R1.1 CCC1=NC(C)=CS1 E43395 [0,0,0,0,1,0|1,0,0]=2 714 B8R1.1 CCC1=NN=C(N)O1 A12274 [0,0,0,0,1,0|3,0,0]=4 715 B8R1.1 CCC1=NNC(N)=C1 A9777 [0,0,0,0,1,0|2,0,0]=3 716 B8R1.1 CCC1=NOC(N)=C1 E41189 [0,0,0,0,1,0|2,0,0]=3 717 B8R1.1 CCN1C=C(Br)C=N1 B9823 [0,0,0,0,1,0|2,0,0]=3 718 B8R1.1 CCN1C=C(N)C=N1 A12746 [0,0,0,0,1,0|2,0,0]=3 719 B8R1.1 CC[N+]1=CN(C)C=C1 E38121 [0,0,0,0,1,0|3,0,0]=4 720 B8R1.1 CC[N+]1=CN(C)C=C1 E41405 [0,0,0,0,1,0|3,0,0]=4 721 B8R1.1 CC[N+]1=CN(C)C=C1 E43585 [0,0,0,0,1,0|3,0,0]=4 722 B8R1.1 CC[N+]1=CN(C)C=C1 E46615 [0,0,0,0,1,0|3,0,0]=4 723 B8R1.1 CN1C=C(C#N)C=N1 M12749 [0,0,0,0,1,0|2,0,1]=4 724 B8R1.1 CN1C=C(C=O)C=N1 M6127 [0,0,0,0,1,0|2,0,1]=4 725 B8R1.1 CN1C=C(CBr)C=N1 B27149 [0,0,0,0,1,0|2,0,0]=3 726 B8R1.1 CN1C=C(CN)C=N1 M16591 [0,0,0,0,1,0|2,0,0]=3 727 B8R1.1 CN1C=C(CN)C=N1 M17032 [0,0,0,0,1,0|2,0,0]=3 728 B8R1.1 CN1C=C(CN)C=N1 M9443 [0,0,0,0,1,0|2,0,0]=3 729 B8R1.1 CN1C=C(CO)C=N1 M10343 [0,0,0,0,1,0|2,0,0]=3 730 B8R1.1 CN1C=CC(CCl)=N1 C25609 [0,0,0,0,1,0|3,0,0]=4 731 B8R1.1 CN1C=CC(CN)=N1 M9952 [0,0,0,0,1,0|3,0,0]=4 732 B8R1.1 CN1C=CC(CO)=N1 M9953 [0,0,0,0,1,0|3,0,0]=4 733 B8R1.1 CN1C=NC(C#N)=C1 M14079 [0,0,0,0,1,0|2,0,1]=4 734 B8R1.1 CN1C=NC(C=O)=C1 M11287 [0,0,0,0,1,0|2,0,1]=4 735 B8R1.1 CN1C=NC(CCl)=C1 C21803 [0,0,0,0,1,0|2,0,0]=3 736 B8R1.1 CN1C=NC(CCl)=N1 C40197 [0,0,0,0,1,0|2,0,0]=3 737 B8R1.1 CN1C=NC(CN)=C1 A11226 [0,0,0,0,1,0|2,0,0]=3 738 B8R1.1 CN1C=NC(CN)=C1 A11227 [0,0,0,0,1,0|2,0,0]=3 739 B8R1.1 CN1C=NC(CN)=C1 A29740 [0,0,0,0,1,0|2,0,0]=3 740 B8R1.1 CN1C=NC(CN)=N1 A14790 [0,0,0,0,1,0|2,0,0]=3 741 B8R1.1 CN1C=NC(CN)=N1 M29766 [0,0,0,0,1,0|2,0,0]=3 742 B8R1.1 CN1C=NC(CO)=C1 M12982 [0,0,0,0,1,0|2,0,0]=3 743 B8R1.1 CN1C=NC(CO)=N1 M14789 [0,0,0,0,1,0|2,0,0]=3 744 B8R1.1 CNC1=CN(C)N=C1 D41402 [0,0,0,0,1,0|2,0,0]=3 745 B8R1.1 COC1=CC(N)=NN1 M0643 [0,0,0,0,1,0|3,0,0]=4 746 B8R1.1 COC1=CC(N)=NN1 M13731 [0,0,0,0,1,0|3,0,0]=4 747 B8R1.1 COC1=CC(N)=NO1 M40185 [0,0,0,0,1,0|3,0,0]=4 748 B8R1.1 COC1=NC(Br)=CS1 B2259 [0,0,0,0,1,0|3,0,0]=4 749 B8R1.1 COC1=NC=C(Br)S1 B2563 [0,0,0,0,1,0|3,0,0]=4 750 B8R1.1 CSC1=CN=C(N)S1 M40191 [0,0,0,0,1,0|3,0,0]=4 751 B8R1.1 CSC1=NC(Br)=CS1 T2262 [0,0,0,0,1,0|3,0,0]=4 752 B8R1.1 CSC1=NC(N)=NN1 M62161 [0,0,0,0,1,0|3,0,0]=4 753 B8R1.1 ClCC1=CC(Br)=NO1 B2105 [0,0,0,0,1,0|3,0,0]=4 754 B8R1.1 ClCC1=CN=C(Cl)S1 C2059 [0,0,0,0,1,0|3,0,0]=4 755 B8R1.1 ClCC1=CSC(Cl)=N1 C2721 [0,0,0,0,1,0|3,0,0]=4 756 B8R1.1 NC1=NC(CCl)=CS1 A2564 [0,0,0,0,1,0|3,0,0]=4 757 B8R1.1 NC1=NC(CO)=CS1 A40186 [0,0,0,0,1,0|3,0,0]=4 758 B8R1.1 NC1=NC=C(CO)S1 A40187 [0,0,0,0,1,0|3,0,0]=4 759 B8R1.1 NC1=NNC(CO)=C1 A14738 [0,0,0,0,1,0|3,0,0]=4 760 B8R1.1 NCC1=CC(Br)=CS1 B41112 [0,0,0,0,1,0|3,0,0]=4 761 B8R1.1 NCC1=CN=C(Cl)S1 C40120 [0,0,0,0,1,0|3,0,0]=4 762 B8R1.1 NCC1=CSC(Br)=C1 B16484 [0,0,0,0,1,0|3,0,0]=4 763 B8R1.1 NCC1=CSC(Cl)=C1 C7665 [0,0,0,0,1,0|3,0,0]=4 764 B8R1.1 NCC1=NC=C(Br)S1 B10574 [0,0,0,0,1,0|3,0,0]=4 765 B8R1.1 NCC1=NC=C(Br)S1 B13057 [0,0,0,0,1,0|3,0,0]=4 766 B8R1.1 NCC1=NC=C(Cl)S1 C13932 [0,0,0,0,1,0|3,0,0]=4 767 B8R1.1 OCC1=CC(Br)=CS1 B12759 [0,0,0,0,1,0|3,0,0]=4 768 B8R1.1 OCC1=CC(Br)=NO1 B2177 [0,0,0,0,1,0|3,0,0]=4 769 B8R1.1 OCC1=CC(Cl)=CS1 C7722 [0,0,0,0,1,0|3,0,0]=4 770 B8R1.1 OCC1=CN=C(Br)S1 B2127 [0,0,0,0,1,0|3,0,0]=4 771 B8R1.1 OCC1=CN=C(Cl)S1 C2061 [0,0,0,0,1,0|3,0,0]=4 772 B8R1.1 OCC1=COC(Br)=N1 B3572 [0,0,0,0,1,0|3,0,0]=4 773 B8R1.1 OCC1=CSC(Br)=N1 B2126 [0,0,0,0,1,0|3,0,0]=4 774 B8R1.1 OCC1=CSC(Cl)=C1 C7721 [0,0,0,0,1,0|3,0,0]=4 775 B8R1.1 OCC1=CSC(Cl)=N1 C2782 [0,0,0,0,1,0|3,0,0]=4 776 B8R1.1 OCC1=NC(Br)=CN1 B32450 [0,0,0,0,1,0|2,0,1]=4 777 B8R1.1 OCC1=NC(Br)=CS1 B10817 [0,0,0,0,1,0|3,0,0]=4 778 B8R1.1 OCC1=NC=C(Br)S1 B10575 [0,0,0,0,1,0|3,0,0]=4 779 B8R1.1 OCC1=NC=C(Cl)S1 C13054 [0,0,0,0,1,0|3,0,0]=4 780 B7R1.3 BrC1=CN=CC=C1 B2746 [2,0,0,0,0,0|2,0,0]=4 781 B7R1.3 BrC1=NC=CN=C1 B40020 [2,0,0,0,0,0|1,0,0]=3 782 B7R1.3 CC1=CC=CN=N1 M0216 [2,0,0,0,0,0|2,0,0]=4 783 B7R1.3 CC1=CN=CN=C1 M41018 [2,0,0,0,0,0|2,0,0]=4 784 B7R1.3 CC1=CN=NC=C1 M3532 [2,0,0,0,0,0|2,0,0]=4 785 B7R1.3 CC1=NC=CC=N1 M68916 [2,0,0,0,0,0|2,0,0]=4 786 B7R1.3 CC1=NC=CN=C1 M61917 [2,0,0,0,0,0|0,0,0]=2 787 B7R1.3 CC1=NC=CN=N1 M36785 [2,0,0,0,0,0|1,0,0]=3 788 B7R1.3 CC1=NC=NC=C1 M7491 [2,0,0,0,0,0|2,0,0]=4 789 B7R1.3 ClC1=CN=CC=C1 C68367 [2,0,0,0,0,0|2,0,0]=4 790 B7R1.3 ClC1=NC=CN=C1 C5165 [2,0,0,0,0,0|1,0,0]=3 791 B7R1.3 FC1=CN=CC=C1 F1892 [2,0,0,0,0,0|2,0,0]=4 792 B7R1.3 FC1=NC=CC=C1 F4862 [2,0,0,0,0,0|2,0,0]=4 793 B7R1.3 FC1=NC=CN=C1 F40023 [2,0,0,0,0,0|1,0,0]=3 794 B7R1.3 IC1=CN=CC=C1 I16635 [2,0,0,0,0,0|2,0,0]=4 795 B7R1.3 IC1=NC=CC=C1 K67594 [2,0,0,0,0,0|2,0,0]=4 796 B7R1.3 IC1=NC=CN=C1 I2669 [2,0,0,0,0,0|1,0,0]=3 797 B7R1.3 NC1=NC=CC=C1 A23973 [2,0,0,0,0,0|2,0,0]=4 798 B7R1.3 NC1=NC=CN=C1 A15535 [2,0,0,0,0,0|1,0,0]=3 799 B7R1.3 NC1=NC=CN=N1 T67661 [2,0,0,0,0,0|2,0,0]=4 800 B7R1.3 O=C1C=NC=CN1 H68630 [2,0,0,0,0,0|1,0,1]=4 801 B7R1.3 OC1=NC=CC=C1 P61113 [2,0,0,0,0,0|2,0,0]=4 802 B7R1.3 [Mg+]C1=CN=CC=C1 P8350 [2,0,0,0,0,0|2,0,0]=4 803 B7R1.3 [Mg+]C1=NC=CC=C1 P8351 [2,0,0,0,0,0|2,0,0]=4 804 B9R1.2 BrCC1=CC=CC(Br)=N1 B42519 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.2 CC1=CC(CCl)=CN=C1 C46109 [1,1,0,0,0,0|2,0,0]=4 806 B9R1.2 CC1=CC(CCl)=NC=C1 C46106 [1,1,0,0,0,0|2,0,0]=4 807 B9R1.2 CC1=CC(CN)=NC=C1 A62602 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.2 CC1=CC(CN)=NC=C1 M46587 [1,1,0,0,0,0|2,0,0]=4 809 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.2 CC1=CC(CO)=NC=C1 M46387 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.2 CC1=CC=CC(CBr)=N1 B46087 [1,1,0,0,0,0|2,0,0]=4 812 B9R1.2 CC1=CC=CC(CCl)=N1 C46103 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.2 CC1=CC=CC(CN)=N1 M24786 [1,1,0,0,0,0|2,0,0]=4 814 B9R1.2 CC1=CC=CC(CN)=N1 M63579 [1,1,0,0,0,0|2,0,0]=4 815 B9R1.2 CC1=CC=CC(CO)=N1 M46384 [1,1,0,0,0,0|2,0,0]=4 816 B9R1.2 CC1=CN=CC(C#N)=N1 M42469 [1,1,0,0,0,0|1,0,1]=4 817 B9R1.2 CC1=CN=CC(C=O)=N1 M16928 [1,1,0,0,0,0|1,0,1]=4 818 B9R1.2 CC1=CN=CC(CCl)=N1 C43005 [1,1,0,0,0,0|1,0,0]=3 819 B9R1.2 CCC1=CC(=O)NC=N1 E43198 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.2 CCC1=CC(=O)NN=C1 E43197 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.2 CCC1=CC(Br)=CN=C1 B46076 [1,1,0,0,0,0|1,0,0]=3 822 B9R1.2 CCC1=CC(Cl)=NC=N1 C69336 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.2 CCC1=CC=CC(Br)=C1 B49158 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.2 CCC1=CC=CC(Br)=N1 B46074 [1,1,0,0,0,0|1,0,0]=3 825 B9R1.2 CCC1=CC=CC(N)=C1 E68361 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.2 CCC1=CC=CC(N)=N1 E43601 [1,1,0,0,0,0|1,0,0]=3 827 B9R1.2 CCC1=CC=CC([Mg+])=C1 E31740 [1,1,0,0,0,0|2,0,0]=4 828 B9R1.2 CCC1=CN=CC(N)=C1 E37485 [1,1,0,0,0,0|1,0,0]=3 829 B9R1.2 CCC1=NC=CC(Br)=C1 B46078 [1,1,0,0,0,0|1,0,0]=3 830 B9R1.2 CCC1=NC=CC(Cl)=N1 C29661 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.2 CCC1=NC=CC(N)=C1 A15478 [1,1,0,0,0,0|1,0,0]=3 832 B9R1.2 CNC1=CC=CC(Cl)=N1 C43001 [1,1,0,0,0,0|2,0,0]=4 833 B9R1.2 CNC1=NC(C)=CC=C1 D43615 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.2 CNC1=NC=CC(Br)=C1 B23788 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.2 CNC1=NC=CC(N)=C1 M43544 [1,1,0,0,0,0|2,0,0]=4 836 B9R1.2 COC1=CC(Br)=CN=C1 B2876 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.2 COC1=CC=CC(Br)=N1 B2785 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.2 COC1=CC=CC(Cl)=N1 C39269 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.2 COC1=CC=CC(F)=N1 F67375 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.2 COC1=CC=CC(I)=N1 K42932 [1,1,0,0,0,0|2,0,0]=4 841 B9R1.2 COC1=CN=CC(Cl)=N1 C2454 [1,1,0,0,0,0|1,0,0]=3 842 B9R1.2 COC1=CN=CC(I)=N1 I2676 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.2 COC1=CN=CC(N)=C1 A14114 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.2 COC1=CN=CC(N)=C1 A7930 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.2 COC1=CN=CC(O)=C1 M43136 [1,1,0,0,0,0|2,0,0]=4 846 B9R1.2 COC1=NC(C)=CC=C1 M46380 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.2 COC1=NC(N)=CC=C1 A43190 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.2 COC1=NC(N)=CN=C1 A8995 [1,1,0,0,0,0|1,0,0]=3 849 B9R1.2 COC1=NC=CC(Br)=C1 B3113 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.2 COC1=NC=CC(C)=C1 M46379 [1,1,0,0,0,0|2,0,0]=4 851 B9R1.2 COC1=NC=CC(Cl)=C1 C42902 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.2 COC1=NC=CC(F)=C1 F42927 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.2 COC1=NC=CC(I)=C1 K60534 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.2 COC1=NC=CC(N)=C1 M3947 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.2 COC1=NC=CC(O)=C1 M38428 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.2 CSC1=CC=CC(Br)=N1 B2786 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.2 CSC1=NC=CC(Cl)=C1 C42846 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.2 ClCC1=CC(Br)=CN=C1 B15185 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.2 ClCC1=CC(Cl)=CN=C1 C1777 [1,1,0,0,0,0|2,0,0]=4 860 B9R1.2 ClCC1=CC=CC(Br)=N1 B27809 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.2 ClCC1=CC=CC(Cl)=N1 C42562 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.2 ClCC1=NC=CC(Cl)=C1 C32395 [1,1,0,0,0,0|2,0,0]=4 863 B9R1.2 FC1=CC(CBr)=CN=C1 B37165 [1,1,0,0,0,0|2,0,0]=4 864 B9R1.2 FC1=CC(CCl)=CN=C1 C1821 [1,1,0,0,0,0|2,0,0]=4 865 B9R1.2 FC1=CC=CC(CBr)=N1 B42547 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.2 FC1=CC=CC(CCl)=N1 C42570 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.2 N#CC1=CN=CC(Br)=N1 B40486 [1,1,0,0,0,0|1,0,1]=4 868 B9R1.2 N#CC1=CN=CC(Cl)=N1 C4892 [1,1,0,0,0,0|1,0,1]=4 869 B9R1.2 N#CC1=NC(N)=CN=C1 A11545 [1,1,0,0,0,0|1,0,1]=4 870 B9R1.2 NC1=CC(CO)=CN=C1 A43207 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.2 NC1=CC(CO)=NC=C1 A15900 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.2 NC1=CC=CC(CO)=N1 A43208 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.2 NCC1=CC(F)=CN=C1 F5829 [1,1,0,0,0,0|2,0,0]=4 874 B9R1.2 NCC1=CC=CC(Br)=N1 B42981 [1,1,0,0,0,0|2,0,0]=4 875 B9R1.2 NCC1=CC=CC(Cl)=N1 C43006 [1,1,0,0,0,0|2,0,0]=4 876 B9R1.2 NCC1=CN=CC(Cl)=N1 C18971 [1,1,0,0,0,0|1,0,0]=3 877 B9R1.2 NCC1=NC=CC(Br)=C1 A1747 [1,1,0,0,0,0|2,0,0]=4 878 B9R1.2 NCC1=NC=CC(Br)=C1 B42982 [1,1,0,0,0,0|2,0,0]=4 879 B9R1.2 NCC1=NC=CC(Cl)=C1 A14281 [1,1,0,0,0,0|2,0,0]=4 880 B9R1.2 NCC1=NC=CC(F)=C1 F43529 [1,1,0,0,0,0|2,0,0]=4 881 B9R1.2 O=CC1=CN=CC(Cl)=N1 C14597 [1,1,0,0,0,0|1,0,1]=4 882 B9R1.2 OCC1=CC(Br)=CN=C1 B12503 [1,1,0,0,0,0|2,0,0]=4 883 B9R1.2 OCC1=CC(Cl)=CN=C1 C42912 [1,1,0,0,0,0|2,0,0]=4 884 B9R1.2 OCC1=CC(F)=CN=C1 F0704 [1,1,0,0,0,0|2,0,0]=4 885 B9R1.2 OCC1=CC(O)=CN=C1 H39124 [1,1,0,0,0,0|2,0,0]=4 886 B9R1.2 OCC1=CC=CC(Br)=N1 B12271 [1,1,0,0,0,0|2,0,0]=4 887 B9R1.2 OCC1=CC=CC(Cl)=N1 C38619 [1,1,0,0,0,0|2,0,0]=4 888 B9R1.2 OCC1=CC=CC(Cl)=N1 C42916 [1,1,0,0,0,0|2,0,0]=4 889 B9R1.2 OCC1=CC=CC(F)=N1 F67771 [1,1,0,0,0,0|2,0,0]=4 890 B9R1.2 OCC1=CN=CC(Br)=N1 B40916 [1,1,0,0,0,0|1,0,0]=3 891 B9R1.2 OCC1=CN=CC(Cl)=N1 C14609 [1,1,0,0,0,0|1,0,0]=3 892 B9R1.2 OCC1=NC=CC(Br)=C1 B0602 [1,1,0,0,0,0|2,0,0]=4 893 B9R1.2 OCC1=NC=CC(Cl)=C1 C12436 [1,1,0,0,0,0|2,0,0]=4 894 B9R1.2 OCC1=NC=CC(F)=C1 F37340 [1,1,0,0,0,0|2,0,0]=4 895 B9R1.6 CC(=O)C1=NC=CN=C1 A39262 [1,1,0,0,0,0|0,0,1]=3 896 B9R1.6 CC(C)C1=NC=CC=C1 I0627 [1,1,0,0,0,0|1,0,0]=3 897 B9R1.6 C[C@@H](N)C1=CC=CC=C1 P68072 [1,1,0,0,0,0|2,0,0]=4 898 B9R1.6 C[C@@H](N)C1=CC=CN=C1 P43620 [1,1,0,0,0,0|1,0,0]=3 899 B9R1.6 C[C@@H](N)C1=CN=CN=C1 A12922 [1,1,0,0,0,0|2,0,0]=4 900 B9R1.6 C[C@@H](N)C1=CN=CN=C1 P27095 [1,1,0,0,0,0|2,0,0]=4 901 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P43619 [1,1,0,0,0,0|1,0,0]=3 902 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P46583 [1,1,0,0,0,0|1,0,0]=3 903 B9R1.6 C[C@@H](O)C1=CC=CC=C1 P46824 [1,1,0,0,0,0|2,0,0]=4 904 B9R1.6 C[C@@H](O)C1=NC=CC=C1 P46382 [1,1,0,0,0,0|1,0,0]=3 905 B9R1.6 C[C@H](Br)C1=NC=CN=C1 B42963 [1,1,0,0,0,0|0,0,0]=2 906 B9R1.6 C[C@H](N)C1=CC=CC=C1 P68597 [1,1,0,0,0,0|2,0,0]=4 907 B9R1.6 C[C@H](N)C1=CC=CC=C1 P69271 [1,1,0,0,0,0|2,0,0]=4 908 B9R1.6 C[C@H](N)C1=CC=CN=C1 P43604 [1,1,0,0,0,0|1,0,0]=3 909 B9R1.6 C[C@H](N)C1=CC=CN=C1 P46585 [1,1,0,0,0,0|1,0,0]=3 910 B9R1.6 C[C@H](N)C1=CC=CN=C1 P61653 [1,1,0,0,0,0|1,0,0]=3 911 B9R1.6 C[C@H](N)C1=CN=CN=C1 A12921 [1,1,0,0,0,0|2,0,0]=4 912 B9R1.6 C[C@H](N)C1=CN=CN=C1 A7447 [1,1,0,0,0,0|2,0,0]=4 913 B9R1.6 C[C@H](N)C1=CN=NC=C1 P30996 [1,1,0,0,0,0|2,0,0]=4 914 B9R1.6 C[C@H](N)C1=NC=CC=C1 P43621 [1,1,0,0,0,0|1,0,0]=3 915 B9R1.6 C[C@H](N)C1=NC=CC=C1 P66366 [1,1,0,0,0,0|1,0,0]=3 916 B9R1.6 C[C@H](N)C1=NC=CC=N1 P36807 [1,1,0,0,0,0|2,0,0]=4 917 B9R1.6 C[C@H](N)C1=NC=CN=C1 P14583 [1,1,0,0,0,0|0,0,0]=2 918 B9R1.6 C[C@H](N)C1=NC=NC=C1 A12259 [1,1,0,0,0,0|2,0,0]=4 919 B9R1.6 C[C@H](O)C1=CC=CC=C1 P46823 [1,1,0,0,0,0|2,0,0]=4 920 B9R1.6 C[C@H](O)C1=NC=CC=C1 P46375 [1,1,0,0,0,0|1,0,0]=3 921 B9R1.6 C[C@H](O)C1=NC=CN=C1 P43187 [1,1,0,0,0,0|0,0,0]=2 922 B9R1.6 C[S@](=O)C1=NC=CC=C1 M43172 [1,1,0,0,0,0|2,0,0]=4 923 B9R1.6 N=C(N)C1=NC=CN=C1 P60819 [1,1,0,0,0,0|1,0,1]=4 924 B9R1.6 O=C(O)C1=NC=CN=C1 P2716 [1,1,0,0,0,0|1,0,1]=4 925 B9R1.6 OB(O)C1=NC=CN=C1 P36936 [1,1,0,0,0,0|2,0,0]=4 926 B9R1.8 CCCC1=NC=CC=C1 P46859 [1,1,0,0,0,0|1,0,0]=3 927 B9R1.8 CCCC1=NC=CN=C1 P43598 [1,1,0,0,0,0|0,0,0]=2 928 B9R1.8 CCNC1=NC=CN=C1 E43330 [1,1,0,0,0,0|0,0,0]=2 929 B9R1.8 CCOC1=NC=CC=C1 E46369 [1,1,0,0,0,0|1,0,0]=3 930 B9R1.8 CNCC1=CN=CN=C1 N11436 [1,1,0,0,0,0|2,0,0]=4 931 B9R1.8 CNCC1=CN=NC=C1 M12238 [1,1,0,0,0,0|2,0,0]=4 932 B9R1.8 CNCC1=CN=NC=C1 M27035 [1,1,0,0,0,0|2,0,0]=4 933 B9R1.8 CNCC1=NC=CC=N1 M14362 [1,1,0,0,0,0|2,0,0]=4 934 B9R1.8 CNCC1=NC=CC=N1 M31227 [1,1,0,0,0,0|2,0,0]=4 935 B9R1.8 CNCC1=NC=CN=C1 M14584 [1,1,0,0,0,0|0,0,0]=2 936 B9R1.8 COCC1=NC=CC=C1 M46377 [1,1,0,0,0,0|1,0,0]=3 937 B9R1.8 N#CCC1=CN=CC=C1 P38543 [1,1,0,0,0,0|1,0,1]=4 938 B9R1.8 N#CCC1=NC=CC=C1 P45196 [1,1,0,0,0,0|1,0,1]=4 939 B9R1.8 NCCC1=CC=CN=C1 P43605 [1,1,0,0,0,0|1,0,0]=3 940 B9R1.8 NCCC1=NC=CC=C1 P67673 [1,1,0,0,0,0|1,0,0]=3 941 B9R1.8 NCCC1=NC=NC=C1 P14666 [1,1,0,0,0,0|2,0,0]=4 942 B9R1.8 NCCC1=NC=NC=C1 P29961 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.8 NNCC1=CC=CN=C1 H0097 [1,1,0,0,0,0|2,0,0]=4 944 B9R1.8 NNCC1=CC=CN=C1 H36962 [1,1,0,0,0,0|2,0,0]=4 945 B9R1.8 NNCC1=NC=CC=C1 H0098 [1,1,0,0,0,0|2,0,0]=4 946 B9R1.8 NNCC1=NC=CN=C1 H7534 [1,1,0,0,0,0|1,0,0]=3 947 B9R1.8 OCCC1=CN=CC=C1 P46376 [1,1,0,0,0,0|1,0,0]=3 948 B9R1.8 OCCC1=NC=CN=C1 P24824 [1,1,0,0,0,0|0,0,0]=2 949 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [1,1,0,0,0,0|2,0,0]=4 950 B9R1.8 [N-]=[N+]=NC1=NC=CN=C1 A31883 [1,1,0,0,0,0|2,0,0]=4 951 B9R1.15 BrCC1=C(Br)C=CC=N1 B32048 [1,1,0,0,0,0|2,0,0]=4 952 B9R1.15 C#CC1=NC=CN=C1Cl C63547 [1,1,0,0,0,0|0,0,2]=4 953 B9R1.15 CC1=C(CBr)C=CC=N1 B15311 [1,1,0,0,0,0|2,0,0]=4 954 B9R1.15 CC1=C(CBr)C=NC=C1 B37536 [1,1,0,0,0,0|2,0,0]=4 955 B9R1.15 CC1=C(CCl)C=CC=N1 C14756 [1,1,0,0,0,0|2,0,0]=4 956 B9R1.15 CC1=C(CCl)C=NC=C1 C14757 [1,1,0,0,0,0|2,0,0]=4 957 B9R1.15 CC1=C(CCl)C=NC=C1 C46108 [1,1,0,0,0,0|2,0,0]=4 958 B9R1.15 CC1=C(CN)C=NC=C1 A11511 [1,1,0,0,0,0|2,0,0]=4 959 B9R1.15 CC1=C(CO)C=NC=C1 H11512 [1,1,0,0,0,0|2,0,0]=4 960 B9R1.15 CC1=CC=CN=C1CCl C14758 [1,1,0,0,0,0|2,0,0]=4 961 B9R1.15 CC1=CC=CN=C1CCl C46105 [1,1,0,0,0,0|2,0,0]=4 962 B9R1.15 CC1=CC=CN=C1CN M46460 [1,1,0,0,0,0|2,0,0]=4 963 B9R1.15 CC1=CC=CN=C1CO H46388 [1,1,0,0,0,0|2,0,0]=4 964 B9R1.15 CC1=NC=CN=C1C=O M14617 [1,1,0,0,0,0|1,0,1]=4 965 B9R1.15 CC1=NC=CN=C1CCl C14615 [1,1,0,0,0,0|1,0,0]=3 966 B9R1.15 CC1=NC=CN=C1CN A11549 [1,1,0,0,0,0|1,0,0]=3 967 B9R1.15 CC1=NC=CN=C1CO H14616 [1,1,0,0,0,0|1,0,0]=3 968 B9R1.15 CCC1=C(Br)C=CC=C1 B68946 [1,1,0,0,0,0|2,0,0]=4 969 B9R1.15 CCC1=C(Br)C=CC=N1 B23432 [1,1,0,0,0,0|1,0,0]=3 970 B9R1.15 CCC1=C(Br)C=CN=C1 B10961 [1,1,0,0,0,0|1,0,0]=3 971 B9R1.15 CCC1=C(Br)C=CN=C1 B30062 [1,1,0,0,0,0|1,0,0]=3 972 B9R1.15 CCC1=C(Br)C=NC=N1 B42964 [1,1,0,0,0,0|2,0,0]=4 973 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [1,1,0,0,0,0|2,0,0]=4 974 B9R1.15 CCC1=C(F)C=NC=N1 E0673 [1,1,0,0,0,0|2,0,0]=4 975 B9R1.15 CCC1=C([Mg+])C=CC=C1 E31738 [1,1,0,0,0,0|2,0,0]=4 976 B9R1.15 CCC1=CN=CN=C1Cl C42985 [1,1,0,0,0,0|2,0,0]=4 977 B9R1.15 CCC1=NC=CN=C1C E43603 [1,1,0,0,0,0|0,0,0]=2 978 B9R1.15 CCC1=NC=CN=C1Cl C38966 [1,1,0,0,0,0|0,0,0]=2 979 B9R1.15 CCC1=NC=CN=C1N E43328 [1,1,0,0,0,0|0,0,0]=2 980 B9R1.15 CCC1=NC=CNC1=O E43188 [1,1,0,0,0,0|0,0,1]=3 981 B9R1.15 CNC1=C(C)C=CN=C1 D67183 [1,1,0,0,0,0|2,0,0]=4 982 B9R1.15 CNC1=C(Cl)C=CC=N1 C42995 [1,1,0,0,0,0|2,0,0]=4 983 B9R1.15 CNC1=C(N)C=CN=C1 M62812 [1,1,0,0,0,0|2,0,0]=4 984 B9R1.15 CNC1=CC=CN=C1Cl C42994 [1,1,0,0,0,0|2,0,0]=4 985 B9R1.15 CNC1=CC=CN=C1N M62813 [1,1,0,0,0,0|2,0,0]=4 986 B9R1.15 CNC1=NC=CC=C1N M43341 [1,1,0,0,0,0|2,0,0]=4 987 B9R1.15 CNC1=NC=CN=C1N M63361 [1,1,0,0,0,0|1,0,0]=3 988 B9R1.15 COC1=C(Br)C=CC=N1 B12855 [1,1,0,0,0,0|2,0,0]=4 989 B9R1.15 COC1=C(Br)C=CN=C1 B61080 [1,1,0,0,0,0|2,0,0]=4 990 B9R1.15 COC1=C(Cl)C=CC=N1 C42900 [1,1,0,0,0,0|2,0,0]=4 991 B9R1.15 COC1=C(F)C=CC=N1 F42926 [1,1,0,0,0,0|2,0,0]=4 992 B9R1.15 COC1=C(I)C=CC=N1 K42933 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.15 COC1=C(N)N=CC=C1 A69248 [1,1,0,0,0,0|2,0,0]=4 994 B9R1.15 COC1=CC=CN=C1Br B4536 [1,1,0,0,0,0|2,0,0]=4 995 B9R1.15 COC1=CC=CN=C1Cl C24085 [1,1,0,0,0,0|2,0,0]=4 996 B9R1.15 COC1=CC=CN=C1F F42924 [1,1,0,0,0,0|2,0,0]=4 997 B9R1.15 COC1=CC=CN=C1I K62151 [1,1,0,0,0,0|2,0,0]=4 998 B9R1.15 COC1=NC=CC=C1C M46378 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.15 COC1=NC=CC=C1N A12743 [1,1,0,0,0,0|2,0,0]=4 1000 B9R1.15 COC1=NC=CN=C1Br B40912 [1,1,0,0,0,0|1,0,0]=3 1001 B9R1.15 COC1=NC=CN=C1C M39278 [1,1,0,0,0,0|1,0,0]=3 1002 B9R1.15 COC1=NC=CN=C1Cl C1053 [1,1,0,0,0,0|1,0,0]=3 1003 B9R1.15 COC1=NC=CN=C1I I3006 [1,1,0,0,0,0|1,0,0]=3 1004 B9R1.15 COC1=NC=CN=C1N M32096 [1,1,0,0,0,0|1,0,0]=3 1005 B9R1.15 CSC1=C(F)N=CC=C1 F42849 [1,1,0,0,0,0|2,0,0]=4 1006 B9R1.15 CSC1=NC=CN=C1C M43263 [1,1,0,0,0,0|1,0,0]=3 1007 B9R1.15 ClCC1=C(Br)C=CC=N1 B42529 [1,1,0,0,0,0|2,0,0]=4 1008 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42563 [1,1,0,0,0,0|2,0,0]=4 1009 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42564 [1,1,0,0,0,0|2,0,0]=4 1010 B9R1.15 ClCC1=CC=CN=C1Cl C7688 [1,1,0,0,0,0|2,0,0]=4 1011 B9R1.15 ClCC1=NC=CN=C1Cl C12594 [1,1,0,0,0,0|1,0,0]=3 1012 B9R1.15 FC1=CC=CN=C1CBr B19661 [1,1,0,0,0,0|2,0,0]=4 1013 B9R1.15 FC1=CC=CN=C1CBr B7783 [1,1,0,0,0,0|2,0,0]=4 1014 B9R1.15 FC1=CC=CN=C1CCl C13988 [1,1,0,0,0,0|2,0,0]=4 1015 B9R1.15 N#CC1=NC=CN=C1Cl C0571 [1,1,0,0,0,0|1,0,1]=4 1016 B9R1.15 N#CC1=NC=CN=C1N A40815 [1,1,0,0,0,0|1,0,1]=4 1017 B9R1.15 NC1=C(CO)C=CC=N1 A12467 [1,1,0,0,0,0|2,0,0]=4 1018 B9R1.15 NC1=CC=CN=C1CO A24069 [1,1,0,0,0,0|2,0,0]=4 1019 B9R1.15 NC1=NC=CN=C1C=O A0269 [1,1,0,0,0,0|1,0,1]=4 1020 B9R1.15 NCC1=C(Br)C=CN=C1 B63849 [1,1,0,0,0,0|2,0,0]=4 1021 B9R1.15 NCC1=C(Cl)C=CC=N1 A14307 [1,1,0,0,0,0|2,0,0]=4 1022 B9R1.15 NCC1=C(Cl)C=CC=N1 C29809 [1,1,0,0,0,0|2,0,0]=4 1023 B9R1.15 NCC1=C(F)C=CC=N1 A12648 [1,1,0,0,0,0|2,0,0]=4 1024 B9R1.15 NCC1=C(F)C=CC=N1 A1712 [1,1,0,0,0,0|2,0,0]=4 1025 B9R1.15 NCC1=C(F)C=CC=N1 F61824 [1,1,0,0,0,0|2,0,0]=4 1026 B9R1.15 NCC1=C(O)C=CC=N1 A43199 [1,1,0,0,0,0|2,0,0]=4 1027 B9R1.15 NCC1=CC=CN=C1Cl A10464 [1,1,0,0,0,0|2,0,0]=4 1028 B9R1.15 NCC1=CC=CN=C1F F43528 [1,1,0,0,0,0|2,0,0]=4 1029 B9R1.15 NCC1=NC=CN=C1Cl C25893 [1,1,0,0,0,0|1,0,0]=3 1030 B9R1.15 NCC1=NC=CN=C1Cl C26687 [1,1,0,0,0,0|1,0,0]=3 1031 B9R1.15 NNC1=NC=CN=C1Cl C12505 [1,1,0,0,0,0|2,0,0]=4 1032 B9R1.15 O=CC1=NC=CN=C1Cl C12693 [1,1,0,0,0,0|1,0,1]=4 1033 B9R1.15 OCC1=C(Br)C=CC=N1 B42889 [1,1,0,0,0,0|2,0,0]=4 1034 B9R1.15 OCC1=C(Cl)C=CC=N1 C42910 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.15 OCC1=C(Cl)C=CN=C1 C42911 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.15 OCC1=C(Cl)C=CN=C1 C42915 [1,1,0,0,0,0|2,0,0]=4 1037 B9R1.15 OCC1=C(F)C=CC=N1 F1706 [1,1,0,0,0,0|2,0,0]=4 1038 B9R1.15 OCC1=C(F)C=CN=C1 F30083 [1,1,0,0,0,0|2,0,0]=4 1039 B9R1.15 OCC1=C(O)C=CC=N1 H60848 [1,1,0,0,0,0|2,0,0]=4 1040 B9R1.15 OCC1=CC=CN=C1Br B69414 [1,1,0,0,0,0|2,0,0]=4 1041 B9R1.15 OCC1=CC=CN=C1Cl C0580 [1,1,0,0,0,0|2,0,0]=4 1042 B9R1.15 OCC1=CC=CN=C1F F42930 [1,1,0,0,0,0|2,0,0]=4 1043 B9R1.15 OCC1=NC=CN=C1Cl C1612 [1,1,0,0,0,0|1,0,0]=3 1044 B9R1.69 CC1=C(Br)C=C(Br)C=N1 D15335 [1,1,0,0,0,0|2,0,0]=4 1045 B9R1.69 CC1=C(Br)C=C(Cl)N=C1 B9888 [1,1,0,0,0,0|2,0,0]=4 1046 B9R1.69 CC1=C(Br)C=C(N)C=N1 B0530 [1,1,0,0,0,0|2,0,0]=4 1047 B9R1.69 CC1=C(Br)C=C(N)N=C1 B16154 [1,1,0,0,0,0|2,0,0]=4 1048 B9R1.69 CC1=C(Br)C=C(O)C=N1 B22011 [1,1,0,0,0,0|2,0,0]=4 1049 B9R1.69 CC1=C(C)N=C(Br)C=N1 B42969 [1,1,0,0,0,0|1,0,0]=3 1050 B9R1.69 CC1=C(C)N=C(Cl)C=C1 C46102 [1,1,0,0,0,0|2,0,0]=4 1051 B9R1.69 CC1=C(C)N=C(Cl)C=N1 C42990 [1,1,0,0,0,0|1,0,0]=3 1052 B9R1.69 CC1=C(C)N=C(N)C=C1 D24371 [1,1,0,0,0,0|2,0,0]=4 1053 B9R1.69 CC1=C(C)N=C(N)C=N1 D24637 [1,1,0,0,0,0|1,0,0]=3 1054 B9R1.69 CC1=C(C)NC(=O)C=N1 D43209 [1,1,0,0,0,0|1,0,1]=4 1055 B9R1.69 CC1=C(Cl)C=C(N)N=C1 C42997 [1,1,0,0,0,0|2,0,0]=4 1056 B9R1.69 CC1=C(Cl)C=C(O)C=N1 C42908 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.69 CC1=C(Cl)N=CC(Br)=N1 B63362 [1,1,0,0,0,0|2,0,0]=4 1058 B9R1.69 CC1=C(I)C=C(Cl)N=C1 C42582 [1,1,0,0,0,0|2,0,0]=4 1059 B9R1.69 CC1=C(I)C=C(F)N=C1 F1115 [1,1,0,0,0,0|2,0,0]=4 1060 B9R1.69 CC1=C(I)C=C(N)N=C1 I37305 [1,1,0,0,0,0|2,0,0]=4 1061 B9R1.69 CC1=C(N)N=C(Br)C=C1 B26268 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.69 CC1=C(N)N=CC(Br)=N1 A37808 [1,1,0,0,0,0|2,0,0]=4 1063 B9R1.69 CC1=C(O)N=CC(Br)=N1 B37166 [1,1,0,0,0,0|2,0,0]=4 1064 B9R1.69 CC1=CC(Br)=C(C)C=C1 D39511 [1,1,0,0,0,0|2,0,0]=4 1065 B9R1.69 CC1=CC(Br)=C(C)C=N1 B46084 [1,1,0,0,0,0|1,0,0]=3 1066 B9R1.69 CC1=CC(Br)=C(Cl)C=N1 B17532 [1,1,0,0,0,0|2,0,0]=4 1067 B9R1.69 CC1=CC(Br)=C(Cl)N=C1 B42532 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.69 CC1=CC(Br)=C(F)C=N1 B32009 [1,1,0,0,0,0|2,0,0]=4 1069 B9R1.69 CC1=CC(Br)=C(F)N=C1 B2994 [1,1,0,0,0,0|2,0,0]=4 1070 B9R1.69 CC1=CC(Br)=C(N)N=C1 B21800 [1,1,0,0,0,0|2,0,0]=4 1071 B9R1.69 CC1=CC(Br)=C(O)C=N1 B42884 [1,1,0,0,0,0|2,0,0]=4 1072 B9R1.69 CC1=CC(Br)=C(O)N=C1 B21801 [1,1,0,0,0,0|2,0,0]=4 1073 B9R1.69 CC1=CC(Br)=CN=C1C B46085 [1,1,0,0,0,0|2,0,0]=4 1074 B9R1.69 CC1=CC(C)=C(Br)C=N1 B46086 [1,1,0,0,0,0|2,0,0]=4 1075 B9R1.69 CC1=CC(Cl)=C(Br)C=N1 B12057 [1,1,0,0,0,0|2,0,0]=4 1076 B9R1.69 CC1=CC(Cl)=C(N)N=C1 C61779 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.69 CC1=CC(F)=C(C)C=C1 F49165 [1,1,0,0,0,0|2,0,0]=4 1078 B9R1.69 CC1=CC(F)=C(N)N=C1 F43015 [1,1,0,0,0,0|2,0,0]=4 1079 B9R1.69 CC1=CC(I)=C(F)N=C1 F6510 [1,1,0,0,0,0|2,0,0]=4 1080 B9R1.69 CC1=CC(I)=C(N)N=C1 I29765 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.69 CC1=CC(N)=C(Br)C=N1 A1741 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.69 CC1=CC(N)=C(Cl)C=N1 C26973 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.69 CC1=CC(N)=C(I)C=N1 K43023 [1,1,0,0,0,0|2,0,0]=4 1084 B9R1.69 CC1=CC(N)=CN=C1C D43613 [1,1,0,0,0,0|2,0,0]=4 1085 B9R1.69 CC1=CC(O)=C(Br)C=N1 B42886 [1,1,0,0,0,0|2,0,0]=4 1086 B9R1.69 CC1=CC([Mg+])=C(C)C=C1 D31736 [1,1,0,0,0,0|2,0,0]=4 1087 B9R1.69 CC1=CC=C(Br)C(Br)=N1 D42515 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.69 CC1=CC=C(C)C(N)=N1 D43611 [1,1,0,0,0,0|1,0,0]=3 1089 B9R1.69 CC1=CC=C(Cl)C(Cl)=N1 D42559 [1,1,0,0,0,0|2,0,0]=4 1090 B9R1.69 CC1=CC=C(Cl)N=C1Cl D24399 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.69 CC1=CC=C(F)C(Br)=N1 B23352 [1,1,0,0,0,0|2,0,0]=4 1092 B9R1.69 CC1=CC=C(F)C(Cl)=N1 C42573 [1,1,0,0,0,0|2,0,0]=4 1093 B9R1.69 CC1=CC=C(F)N=C1Br B17536 [1,1,0,0,0,0|2,0,0]=4 1094 B9R1.69 CC1=CC=C(N)C(Br)=N1 B37081 [1,1,0,0,0,0|2,0,0]=4 1095 B9R1.69 CC1=CC=C(N)C(C)=N1 D43608 [1,1,0,0,0,0|2,0,0]=4 1096 B9R1.69 CC1=CC=C(N)C(Cl)=N1 A42987 [1,1,0,0,0,0|2,0,0]=4 1097 B9R1.69 CC1=CC=C(N)C(I)=N1 K43022 [1,1,0,0,0,0|2,0,0]=4 1098 B9R1.69 CC1=CC=C(N)N=C1Br B26269 [1,1,0,0,0,0|2,0,0]=4 1099 B9R1.69 CC1=CC=C(N)N=C1Cl C23697 [1,1,0,0,0,0|2,0,0]=4 1100 B9R1.69 CC1=CC=C(N)N=C1N M43333 [1,1,0,0,0,0|2,0,0]=4 1101 B9R1.69 CC1=CC=C(O)C(Br)=N1 B1020 [1,1,0,0,0,0|2,0,0]=4 1102 B9R1.69 CC1=CC=C(O)C(F)=N1 F42928 [1,1,0,0,0,0|2,0,0]=4 1103 B9R1.69 CC1=CC=C(O)C(I)=N1 H37772 [1,1,0,0,0,0|2,0,0]=4 1104 B9R1.69 CC1=CN=C(Br)C(Br)=C1 D42517 [1,1,0,0,0,0|2,0,0]=4 1105 B9R1.69 CC1=CN=C(Br)C(C)=C1 B46080 [1,1,0,0,0,0|2,0,0]=4 1106 B9R1.69 CC1=CN=C(Br)C(Cl)=C1 B42530 [1,1,0,0,0,0|2,0,0]=4 1107 B9R1.69 CC1=CN=C(Br)C(F)=C1 B13540 [1,1,0,0,0,0|2,0,0]=4 1108 B9R1.69 CC1=CN=C(Br)C(N)=C1 A42977 [1,1,0,0,0,0|2,0,0]=4 1109 B9R1.69 CC1=CN=C(Br)C=C1Br D32049 [1,1,0,0,0,0|2,0,0]=4 1110 B9R1.69 CC1=CN=C(Br)C=C1Cl B37311 [1,1,0,0,0,0|2,0,0]=4 1111 B9R1.69 CC1=CN=C(Br)C=C1N B25405 [1,1,0,0,0,0|2,0,0]=4 1112 B9R1.69 CC1=CN=C(C)C(C)=C1 T39433 [1,1,0,0,0,0|1,0,0]=3 1113 B9R1.69 CC1=CN=C(C)C(Cl)=N1 C42989 [1,1,0,0,0,0|0,0,0]=2 1114 B9R1.69 CC1=CN=C(C)C(I)=N1 K43021 [1,1,0,0,0,0|0,0,0]=2 1115 B9R1.69 CC1=CN=C(C)C(N)=N1 D32397 [1,1,0,0,0,0|0,0,0]=2 1116 B9R1.69 CC1=CN=C(C)C=C1N D22447 [1,1,0,0,0,0|1,0,0]=3 1117 B9R1.69 CC1=CN=C(C)N=C1N D43337 [1,1,0,0,0,0|2,0,0]=4 1118 B9R1.69 CC1=CN=C(Cl)C(C)=N1 C42988 [1,1,0,0,0,0|1,0,0]=3 1119 B9R1.69 CC1=CN=C(Cl)C(Cl)=C1 D42558 [1,1,0,0,0,0|2,0,0]=4 1120 B9R1.69 CC1=CN=C(Cl)C(Cl)=N1 D40725 [1,1,0,0,0,0|1,0,0]=3 1121 B9R1.69 CC1=CN=C(Cl)C(F)=C1 C42572 [1,1,0,0,0,0|2,0,0]=4 1122 B9R1.69 CC1=CN=C(Cl)C(N)=C1 C42993 [1,1,0,0,0,0|2,0,0]=4 1123 B9R1.69 CC1=CN=C(Cl)C(N)=N1 C39122 [1,1,0,0,0,0|1,0,0]=3 1124 B9R1.69 CC1=CN=C(Cl)C(O)=C1 C42904 [1,1,0,0,0,0|2,0,0]=4 1125 B9R1.69 CC1=CN=C(Cl)C=C1Cl D38063 [1,1,0,0,0,0|2,0,0]=4 1126 B9R1.69 CC1=CN=C(Cl)C=C1F C37310 [1,1,0,0,0,0|2,0,0]=4 1127 B9R1.69 CC1=CN=C(Cl)C=C1N C25406 [1,1,0,0,0,0|2,0,0]=4 1128 B9R1.69 CC1=CN=C(I)C(C)=N1 K63360 [1,1,0,0,0,0|1,0,0]=3 1129 B9R1.69 CC1=CN=C(N)C(=O)N1 A41143 [1,1,0,0,0,0|1,0,1]=4 1130 B9R1.69 CC1=CN=C(N)C(Br)=N1 B41061 [1,1,0,0,0,0|1,0,0]=3 1131 B9R1.69 CC1=CN=C(N)C(C)=C1 D43610 [1,1,0,0,0,0|2,0,0]=4 1132 B9R1.69 CC1=CN=C(N)C(Cl)=N1 C41076 [1,1,0,0,0,0|1,0,0]=3 1133 B9R1.69 CC1=CN=C(N)C(N)=C1 D43331 [1,1,0,0,0,0|2,0,0]=4 1134 B9R1.69 CC1=CN=C(N)C=C1C D43612 [1,1,0,0,0,0|2,0,0]=4 1135 B9R1.69 CC1=CN=C(O)C=C1N A43204 [1,1,0,0,0,0|2,0,0]=4 1136 B9R1.69 CC1=CNC(=O)C(C)=N1 D69506 [1,1,0,0,0,0|1,0,1]=4 1137 B9R1.69 CC1=CNC(=O)C(Cl)=N1 C40933 [1,1,0,0,0,0|1,0,1]=4 1138 B9R1.69 CC1=NC(C)=C(Br)C=C1 B46082 [1,1,0,0,0,0|2,0,0]=4 1139 B9R1.69 CC1=NC(C)=C(O)C=C1 D67987 [1,1,0,0,0,0|2,0,0]=4 1140 B9R1.69 CC1=NC(Cl)=C(Br)C=C1 B42526 [1,1,0,0,0,0|2,0,0]=4 1141 B9R1.69 CC1=NC(F)=C(Br)C=C1 B42546 [1,1,0,0,0,0|2,0,0]=4 1142 B9R1.69 CC1=NC(F)=C(I)C=C1 F42594 [1,1,0,0,0,0|2,0,0]=4 1143 B9R1.69 CC1=NC(N)=C(Br)C=C1 B18303 [1,1,0,0,0,0|2,0,0]=4 1144 B9R1.69 CC1=NC(N)=C(I)C=C1 K61473 [1,1,0,0,0,0|2,0,0]=4 1145 B9R1.69 CC1=NC(N)=C(O)C=C1 A43201 [1,1,0,0,0,0|2,0,0]=4 1146 B9R1.69 CC1=NC(N)=CN=C1Br B41062 [1,1,0,0,0,0|2,0,0]=4 1147 B9R1.69 CC1=NC(N)=CN=C1Cl C23741 [1,1,0,0,0,0|2,0,0]=4 1148 B9R1.69 CC1=NC(O)=C(Br)C=C1 B42882 [1,1,0,0,0,0|2,0,0]=4 1149 B9R1.69 CC1=NC=C(Br)C=C1Cl B8062 [1,1,0,0,0,0|2,0,0]=4 1150 B9R1.69 CC1=NC=C(Br)C=C1F B16887 [1,1,0,0,0,0|2,0,0]=4 1151 B9R1.69 CC1=NC=C(Br)C=C1N A0082 [1,1,0,0,0,0|2,0,0]=4 1152 B9R1.69 CC1=NC=C(Br)C=C1O B42885 [1,1,0,0,0,0|2,0,0]=4 1153 B9R1.69 CC1=NC=C(Cl)C=C1N A1755 [1,1,0,0,0,0|2,0,0]=4 1154 B9R1.69 CC1=NC=C(N)N=C1Br B41063 [1,1,0,0,0,0|1,0,0]=3 1155 B9R1.69 ClC1=CN=C(Br)C(Cl)=N1 B40275 [1,1,0,0,0,0|2,0,0]=4 1156 B9R1.69 ClC1=CN=C(Cl)C(Cl)=N1 T40281 [1,1,0,0,0,0|2,0,0]=4 1157 B9R1.69 ClC1=CN=C(I)C(Cl)=N1 D32285 [1,1,0,0,0,0|2,0,0]=4 1158 B9R1.69 ClC1=NC(Br)=CN=C1Br D63358 [1,1,0,0,0,0|2,0,0]=4 1159 B9R1.69 ClC1=NC=C(Br)N=C1Br D9770 [1,1,0,0,0,0|2,0,0]=4 1160 B9R1.69 NC1=C(Cl)N=C(Br)C=N1 A0343 [1,1,0,0,0,0|2,0,0]=4 1161 B9R1.69 NC1=C(Cl)N=C(I)C=N1 A11542 [1,1,0,0,0,0|2,0,0]=4 1162 B9R1.69 NC1=C(Cl)N=CC(Br)=N1 B9774 [1,1,0,0,0,0|2,0,0]=4 1163 B9R1.69 NC1=C(N)N=C(Br)C=N1 B9793 [1,1,0,0,0,0|2,0,0]=4 1164 B9R1.69 NC1=C(N)N=C(Cl)C=N1 C40148 [1,1,0,0,0,0|2,0,0]=4 1165 B9R1.69 NC1=CN=C(Br)C(Br)=N1 D40046 [1,1,0,0,0,0|2,0,0]=4 1166 B9R1.69 NC1=CN=C(Br)C(Cl)=N1 A11540 [1,1,0,0,0,0|2,0,0]=4 1167 B9R1.69 NC1=CN=C(Cl)C(Br)=N1 B32312 [1,1,0,0,0,0|2,0,0]=4 1168 B9R1.69 NC1=CN=C(I)C(Cl)=N1 C61833 [1,1,0,0,0,0|2,0,0]=4 1169 B9R1.69 NC1=NC(Br)=CN=C1Br D0685 [1,1,0,0,0,0|2,0,0]=4 1170 B9R1.69 NC1=NC(Cl)=CN=C1Br A11539 [1,1,0,0,0,0|2,0,0]=4 1171 B9R1.69 NC1=NC(Cl)=CN=C1Cl D40048 [1,1,0,0,0,0|2,0,0]=4 1172 B9R1.69 NC1=NC=C(Br)N=C1Br A9691 [1,1,0,0,0,0|2,0,0]=4 1173 B9R1.69 NC1=NC=C(Br)N=C1I B37564 [1,1,0,0,0,0|2,0,0]=4 1174 B9R1.69 NC1=NC=C(Cl)N=C1Br B25290 [1,1,0,0,0,0|2,0,0]=4 1175 B9R1.69 NC1=NC=C(Cl)N=C1Cl A38575 [1,1,0,0,0,0|2,0,0]=4 1176 B9R1.69 OC1=NC=C(Br)N=C1Br D39990 [1,1,0,0,0,0|2,0,0]=4 1177 B9R1.7 CC1=CC=C(CCO)O1 M43716 [0,1,0,0,1,0|2,0,0]=4 1178 B9R1.7 CC1=NNC(CC#N)=N1 M65089 [0,1,0,0,1,0|1,0,1]=4 1179 B9R1.7 CCCC1=CC(N)=NN1 P41489 [0,1,0,0,1,0|2,0,0]=4 1180 B9R1.7 CCCC1=NOC(N)=C1 P41430 [0,1,0,0,1,0|2,0,0]=4 1181 B9R1.7 CCCN1C=C(Br)C=N1 B9822 [0,1,0,0,1,0|2,0,0]=4 1182 B9R1.7 CCOC1=NC(Br)=CS1 B2261 [0,1,0,0,1,0|2,0,0]=4 1183 B9R1.7 CCOC1=NNC(Br)=C1 B15683 [0,1,0,0,1,0|2,0,0]=4 1184 B9R1.7 CN1C=C(CC#N)C=N1 M7746 [0,1,0,0,1,0|1,0,1]=4 1185 B9R1.7 CNCC1=CN(C)C=N1 M16460 [0,1,0,0,1,0|1,0,0]=3 1186 B9R1.7 COCC1=CC(N)=NN1 A11618 [0,1,0,0,1,0|2,0,0]=4 1187 B9R1.7 NC1=CN(CCO)N=C1 A41248 [0,1,0,0,1,0|2,0,0]=4 1188 B9R1.7 NC1=NC=C(CCO)S1 A41202 [0,1,0,0,1,0|2,0,0]=4 1189 B9R1.7 OCCC1=CC(Br)=NO1 B2471 [0,1,0,0,1,0|2,0,0]=4 1190 B9R1.7 OCCN1C=C(Br)C=N1 B9452 [0,1,0,0,1,0|2,0,0]=4 1191 B9R1.7 OCCN1C=C(I)C=N1 K41137 [0,1,0,0,1,0|2,0,0]=4 1192 B9R1.21 CCC1=CSC(C=O)=N1 E43175 [0,1,0,0,1,0|1,0,1]=4 1193 B9R1.21 CCN1C=C(C=O)C=N1 E3269 [0,1,0,0,1,0|1,0,1]=4 1194 B9R1.21 CCN1C=C(CN)C=N1 E41492 [0,1,0,0,1,0|1,0,0]=3 1195 B9R1.21 COC1=CC(CN)=NN1 A7802 [0,1,0,0,1,0|2,0,0]=4 1196 B9R1.22 CC1=NC(Br)=C(CBr)S1 B40988 [0,1,0,0,1,0|2,0,0]=4 1197 B9R1.22 CC1=NC(C)=C(CO)S1 D43393 [0,1,0,0,1,0|2,0,0]=4 1198 B9R1.22 CC1=NN(C)C(CCl)=C1 C1040 [0,1,0,0,1,0|2,0,0]=4 1199 B9R1.22 CC1=NN(C)C(CO)=C1 D3957 [0,1,0,0,1,0|2,0,0]=4 1200 B9R1.22 CC1=NN(C)C=C1CN D23506 [0,1,0,0,1,0|2,0,0]=4 1201 B9R1.23 CC1=CC(CCl)=NN1C C11366 [0,1,0,0,1,0|2,0,0]=4 1202 B9R1.23 CC1=CC(CN)=NN1C A11367 [0,1,0,0,1,0|2,0,0]=4 1203 B9R1.23 CC1=CC(CO)=NN1C H11365 [0,1,0,0,1,0|2,0,0]=4 1204 B9R1.23 CCC1=NC(C)=C(Br)S1 B43293 [0,1,0,0,1,0|1,0,0]=3 1205 B9R1.23 CCN1C=C(N)C(C)=N1 A15545 [0,1,0,0,1,0|2,0,0]=4 1206 B9R1.23 CCN1C=C(N)C(C)=N1 E61343 [0,1,0,0,1,0|2,0,0]=4 1207 B9R1.35 CC(=O)C1=CN(C)N=C1 M3257 [0,1,0,0,1,0|1,0,1]=4 1208 B9R1.35 CC(=O)C1=CNC(C)=C1 M46389 [0,1,0,0,1,0|0,0,2]=4 1209 B9R1.35 CC(=O)C1=NC(C)=CO1 M43141 [0,1,0,0,1,0|1,0,1]=4 1210 B9R1.35 CC(=O)C1=NNC(C)=C1 M62065 [0,1,0,0,1,0|1,0,1]=4 1211 B9R1.35 CC(=O)C1=NOC(C)=C1 M43142 [0,1,0,0,1,0|1,0,1]=4 1212 B9R1.35 CC(C)C1=CN=C(Br)S1 B43292 [0,1,0,0,1,0|2,0,0]=4 1213 B9R1.35 CC(C)C1=CN=C(N)S1 P67827 [0,1,0,0,1,0|2,0,0]=4 1214 B9R1.35 CC(C)C1=CSC(Br)=N1 B43291 [0,1,0,0,1,0|2,0,0]=4 1215 B9R1.35 CC(C)C1=NC(Br)=CS1 B2063 [0,1,0,0,1,0|2,0,0]=4 1216 B9R1.35 CC(C)C1=NC=C(Br)S1 B64788 [0,1,0,0,1,0|2,0,0]=4 1217 B9R1.35 CC(C)C1=NOC(N)=C1 P41431 [0,1,0,0,1,0|2,0,0]=4 1218 B9R1.35 CC(C)N1C=C(Br)C=N1 B43323 [0,1,0,0,1,0|2,0,0]=4 1219 B9R1.35 CC(C)N1C=C(N)C=N1 P41490 [0,1,0,0,1,0|2,0,0]=4 1220 B9R1.35 CC(C)N1C=NC(Br)=C1 B8984 [0,1,0,0,1,0|2,0,0]=4 1221 B9R1.35 CC1=CSC(C(C)C)=N1 P43783 [0,1,0,0,1,0|1,0,0]=3 1222 B9R1.35 C[C@H](N)C1=CN(C)N=C1 M14047 [0,1,0,0,1,0|1,0,0]=3 1223 B9R1.35 C[C@H](O)C1=CN(C)C=N1 M0652 [0,1,0,0,1,0|1,0,0]=3 1224 B9R1.35 C[C@H](O)C1=CSC(Cl)=C1 C7957 [0,1,0,0,1,0|2,0,0]=4 1225 B11R1.1 CCNCC1=CC=C(C)C=C1 M53114 [0,2,0,0,0,0|2,0,0]=4 1226 B11R1.1 CCOCC1=CN=C(Cl)C=C1 C62281 [0,2,0,0,0,0|2,0,0]=4 1227 B11R1.1 COCOC1=CN=C(Cl)C=C1 C46141 [0,2,0,0,0,0|2,0,0]=4 1228 B11R1.1 NCCNC1=NC=C(Br)C=C1 B43690 [0,2,0,0,0,0|2,0,0]=4 1229 B11R1.20 CC(C)OC1=CN=C(Cl)C=C1 C37509 [0,2,0,0,0,0|2,0,0]=4 1230 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 B46786 [0,2,0,0,0,0|2,0,0]=4 1231 B11R1.20 CC(C)OC1=NC=C(N)C=C1 P59792 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.20 CC(C)OC1=NC=C(O)C=C1 P63580 [0,2,0,0,0,0|2,0,0]=4 1233 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 M49647 [0,2,0,0,0,0|1,0,1]=4 1234 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 M61975 [0,2,0,0,0,0|1,0,1]=4 1235 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 A52174 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 T54185 [0,2,0,0,0,0|2,0,0]=4 1237 B11R1.22 COC(=O)C1=CN=C(Br)C=N1 M8884 [0,2,0,0,0,0|1,0,1]=4 1238 B11R1.22 COC(=O)C1=CN=C(C)C=C1 M13760 [0,2,0,0,0,0|1,0,1]=4 1239 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 M1561 [0,2,0,0,0,0|1,0,1]=4 1240 B11R1.22 COC(=O)C1=NC=C(C)C=C1 M22900 [0,2,0,0,0,0|1,0,1]=4 1241 B11R1.22 COC(=O)C1=NC=C(C)N=C1 M46011 [0,2,0,0,0,0|0,0,1]=3 1242 B11R1.22 COC(=O)C1=NC=C(N)N=C1 A0342 [0,2,0,0,0,0|1,0,1]=4 1243 B11R1.22 COC(=O)C1=NC=C(N)N=C1 M19340 [0,2,0,0,0,0|1,0,1]=4 1244 B11R1.22 COC(=O)C1=NC=C(O)N=C1 M12387 [0,2,0,0,0,0|1,0,1]=4 1245 B11R1.22 N[C@@H](CO)C1=CN=C(Cl)C=C1 A46332 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.22 N[C@@H](CO)C1=NC=C(F)C=C1 A37122 [0,2,0,0,0,0|2,0,0]=4 1247 B11R1.81 CCOC1=C(Br)C=C(C)C=N1 B64110 [0,2,0,0,0,0|1,0,0]=3 1248 B11R1.81 CCOC1=C(C)N=C(N)C=C1 E46978 [0,2,0,0,0,0|2,0,0]=4 1249 B11R1.81 CCOC1=C(F)C=C(N)C=N1 E46335 [0,2,0,0,0,0|2,0,0]=4 1250 B11R1.81 CCOC1=C(N)C=C(C)C=C1 E50337 [0,2,0,0,0,0|2,0,0]=4 1251 B11R1.81 CCOC1=NC=C(Br)C=C1N B46321 [0,2,0,0,0,0|2,0,0]=4 1252 B11R1.83 CCC1=CC=C(CNC)C=C1 E53118 [0,2,0,0,0,0|2,0,0]=4 1253 B11R1.83 CCC1=CN=C(CCO)C=C1 E39550 [0,2,0,0,0,0|1,0,0]=3 1254 B11R1.83 CCOC1=CC=C(CN)C=C1 E50343 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.83 CCOC1=NC=C(C=O)C=C1 E49274 [0,2,0,0,0,0|1,0,1]=4 1256 B11R1.83 CNCC1=CC=C(OC)C=C1 M38582 [0,2,0,0,0,0|2,0,0]=4 1257 B11R1.83 CNCC1=CC=C(OC)C=C1 M52172 [0,2,0,0,0,0|2,0,0]=4 1258 B11R1.83 COC1=CC=C(CCO)C=C1 M67580 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.83 COC1=CC=C(CC[Mg+])C=C1 M31722 [0,2,0,0,0,0|2,0,0]=4 1260 B11R1.83 COC1=CN=C(CC#N)C=C1 M48814 [0,2,0,0,0,0|1,0,1]=4 1261 B11R1.83 COC1=CN=C(CCN)C=C1 M49539 [0,2,0,0,0,0|1,0,0]=3 1262 B11R1.192 CNCC1=CC(C)=C(C)C=C1 D53119 [0,2,0,0,0,0|2,0,0]=4 1263 B11R1.3 CC(=O)C1=NC=C(C#N)N=C1 A44868 [0,2,0,0,0,0|0,0,2]=4 1264 B11R1.3 CC(C)C1=CC=C(CN)C=C1 P53115 [0,2,0,0,0,0|2,0,0]=4 1265 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 E49271 [0,2,0,0,0,0|1,0,1]=4 1266 B11R1.3 CCC1=NC=C([N+](=O)[O-])C=C1 E15600 [0,2,0,0,0,0|2,0,0]=4 1267 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 M50287 [0,2,0,0,0,0|2,0,0]=4 1268 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M50345 [0,2,0,0,0,0|2,0,0]=4 1269 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M63049 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M68132 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M38013 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M50288 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.3 COC1=CN=C(C(=O)O)C=N1 M23515 [0,2,0,0,0,0|1,0,1]=4 1274 B11R1.3 COC1=CN=C(C(C)=O)C=C1 A15229 [0,2,0,0,0,0|1,0,1]=4 1275 B11R1.3 COC1=NC=C(C(C)=O)C=C1 A49280 [0,2,0,0,0,0|1,0,1]=4 1276 B11R1.3 C[C@@H](N)C1=CC=C(CO)C=C1 A64851 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.279 CCC1=CC(N)=C(OC)C=C1 E50338 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.279 CCC1=NC(N)=C(CO)C=N1 A43752 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.279 COC1=CC=C(CO)C(Cl)=N1 C46142 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.19 CC1=CN=C(C(F)(F)F)C=C1 M20623 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.19 FC(F)(F)C1=CN=C(Br)C=N1 B40452 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.19 NC1=CN=C(C(F)(F)F)C=N1 T40789 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.21 CC(C)C1=NC(N)=C(Br)C=C1 B59688 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 D46015 [0,2,0,0,0,0|1,0,1]=4 1285 B11R1.21 CC1=C(Cl)C=C([C@@H](C)N)C=C1 C61118 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 C50241 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 C61334 [0,2,0,0,0,0|2,0,0]=4 1288 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 F63759 [0,2,0,0,0,0|2,0,0]=4 1289 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 A52256 [0,2,0,0,0,0|2,0,0]=4 1290 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 D54187 [0,2,0,0,0,0|2,0,0]=4 1291 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 D46013 [0,2,0,0,0,0|1,0,1]=4 1292 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D63331 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.37 CC1=CN=C(C#N)C(C#N)=N1 M44407 [0,2,0,0,0,0|1,0,1]=4 1294 B11R1.37 CCC1=NC=C(C)N=C1CC D50396 [0,2,0,0,0,0|0,0,0]=2 1295 B11R1.37 COC1=C(OC)N=C(Br)C=N1 B43030 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.37 COC1=CC(C)=CN=C1OC D46918 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.277 CC1=NC(C)=C(C)N=C1CO T28640 [0,2,0,0,0,0|1,0,0]=3 1298 B11R1.277 CCC1=NC(C)=C(C)N=C1C E50397 [0,2,0,0,0,0|0,0,0]=2 1299 B11R1.277 COC1=CC(Br)=C(C)N=C1N B46322 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.278 CC1=CN=C(CO)C(C)=C1Cl C46805 [0,2,0,0,0,0|2,0,0]=4 1301 B11R1.278 COC1=NC=C(C)C(Br)=C1C B37690 [0,2,0,0,0,0|2,0,0]=4 1302 B9R1.3 CC1=CC=NC(C)=C1Br B46081 [0,0,1,1,0,0|1,0,1]=4 1303 B9R2.50 C1=CC2=C(C=C1)CC2 B68912 [1,0,0,1,0,0|2,0,0]=4 1304 B11R2.34 BrC1=CN=C(C2CC2)C=C1 B38917 [0,1,0,1,0,0|2,0,0]=4 1305 B11R2.34 BrC1=NC=C(C2CC2)C=C1 B48875 [0,1,0,1,0,0|2,0,0]=4 1306 B11R2.34 BrC1=NC=C(C2CC2)N=C1 B64845 [0,1,0,1,0,0|1,0,0]=3 1307 B11R2.34 FC1=NC=C(C2CC2)C=C1 C48887 [0,1,0,1,0,0|2,0,0]=4 1308 B11R2.34 NC1=CN=C(C2CC2)C=C1 C46642 [0,1,0,1,0,0|2,0,0]=4 1309 B11R2.34 NC1=NC=C(C2CC2)C=C1 C46640 [0,1,0,1,0,0|2,0,0]=4 1310 B11R2.34 OC1=NC=C(C2CC2)C=C1 C37180 [0,1,0,1,0,0|2,0,0]=4 1311 B11R2.36 BrC1=CN=C2CNCC2=C1 B11679 [0,1,0,1,0,0|2,0,0]=4 1312 B11R2.36 BrC1=CN=C2CNCC2=C1 B11680 [0,1,0,1,0,0|2,0,0]=4 1313 B11R2.36 BrC1=CN=C2NCCC2=C1 B12242 [0,1,0,1,0,0|2,0,0]=4 1314 B11R2.36 BrC1=CN=C2NCCC2=C1 B30154 [0,1,0,1,0,0|2,0,0]=4 1315 B11R2.36 BrC1=NC2=C(C=C1)NCC2 B45617 [0,1,0,1,0,0|2,0,0]=4 1316 B11R2.36 CC1=CC2=C(C=C1)NCC2 M49974 [0,1,0,1,0,0|2,0,0]=4 1317 B11R2.36 CC1=NC2=C(C=N1)CSC2 M46059 [0,1,0,1,0,0|2,0,0]=4 1318 B11R2.36 ClC1=CN=C2NCCC2=C1 C45621 [0,1,0,1,0,0|2,0,0]=4 1319 B11R2.36 ClC1=NC2=C(C=C1)CCC2 C48882 [0,1,0,1,0,0|2,0,0]=4 1320 B11R2.36 ClC1=NC2=C(C=C1)CNC2 C25491 [0,1,0,1,0,0|2,0,0]=4 1321 B11R2.36 ClC1=NC=C2CCNC2=C1 C38106 [0,1,0,1,0,0|2,0,0]=4 1322 B11R2.36 FC1=CN=C2CNCC2=C1 F18831 [0,1,0,1,0,0|2,0,0]=4 1323 B11R2.190 OCC1=CC2=C(C=C1)CC2 B49878 [0,1,0,1,0,0|2,0,0]=4 1324 B7R1.1 BrCC1=CSC=C1 B60823 [1,0,0,0,1,0|2,0,0]=4 1325 B7R1.1 BrCC1=NC=CN1 B40117 [1,0,0,0,1,0|1,0,1]=4 1326 B7R1.1 CCC1=NC=CN1 E68629 [1,0,0,0,1,0|0,0,1]=3 1327 B7R1.1 CCC1=NN=CO1 E37555 [1,0,0,0,1,0|2,0,0]=4 1328 B7R1.1 CCN1C=CN=N1 E40219 [1,0,0,0,1,0|2,0,0]=4 1329 B7R1.1 CCN1C=NC=N1 E40218 [1,0,0,0,1,0|1,0,0]=3 1330 B7R1.1 CNC1=NC=CS1 M67793 [1,0,0,0,1,0|2,0,0]=4 1331 B7R1.1 CNC1=NC=NS1 M32356 [1,0,0,0,1,0|2,0,0]=4 1332 B7R1.1 COC1=CC=CS1 M41123 [1,0,0,0,1,0|2,0,0]=4 1333 B7R1.1 COC1=CNN=C1 M20056 [1,0,0,0,1,0|2,0,0]=4 1334 B7R1.1 COC1=CSC=C1 M41124 [1,0,0,0,1,0|2,0,0]=4 1335 B7R1.1 COC1=NC=CS1 M2608 [1,0,0,0,1,0|2,0,0]=4 1336 B7R1.1 CSC1=NC=CO1 M40164 [1,0,0,0,1,0|2,0,0]=4 1337 B7R1.1 ClCC1=CN=CS1 C32421 [1,0,0,0,1,0|2,0,0]=4 1338 B7R1.1 ClCC1=CNC=N1 C2088 [1,0,0,0,1,0|1,0,1]=4 1339 B7R1.1 ClCC1=CSC=N1 C2334 [1,0,0,0,1,0|2,0,0]=4 1340 B7R1.1 ClCC1=NC=CO1 C40107 [1,0,0,0,1,0|2,0,0]=4 1341 B7R1.1 ClCC1=NOC=N1 C24041 [1,0,0,0,1,0|2,0,0]=4 1342 B7R1.1 NCC1=CC=CN1 P41359 [1,0,0,0,1,0|1,0,1]=4 1343 B7R1.1 NCC1=CC=CS1 A12813 [1,0,0,0,1,0|2,0,0]=4 1344 B7R1.1 NCC1=CC=NO1 K40323 [1,0,0,0,1,0|2,0,0]=4 1345 B7R1.1 NCC1=CN=CN1 A69377 [1,0,0,0,1,0|1,0,1]=4 1346 B7R1.1 NCC1=CN=CO1 X11178 [1,0,0,0,1,0|2,0,0]=4 1347 B7R1.1 NCC1=CN=CO1 X17340 [1,0,0,0,1,0|2,0,0]=4 1348 B7R1.1 NCC1=CN=CS1 T11225 [1,0,0,0,1,0|2,0,0]=4 1349 B7R1.1 NCC1=CN=CS1 T37607 [1,0,0,0,1,0|2,0,0]=4 1350 B7R1.1 NCC1=CN=CS1 T40190 [1,0,0,0,1,0|2,0,0]=4 1351 B7R1.1 NCC1=CNC=C1 P26218 [1,0,0,0,1,0|1,0,1]=4 1352 B7R1.1 NCC1=CNC=N1 K40332 [1,0,0,0,1,0|1,0,1]=4 1353 B7R1.1 NCC1=CNN=C1 A10475 [1,0,0,0,1,0|2,0,0]=4 1354 B7R1.1 NCC1=CNN=C1 P17334 [1,0,0,0,1,0|2,0,0]=4 1355 B7R1.1 NCC1=CNN=C1 P20267 [1,0,0,0,1,0|2,0,0]=4 1356 B7R1.1 NCC1=COC=N1 A40322 [1,0,0,0,1,0|2,0,0]=4 1357 B7R1.1 NCC1=COC=N1 O7924 [1,0,0,0,1,0|2,0,0]=4 1358 B7R1.1 NCC1=COC=N1 X11296 [1,0,0,0,1,0|2,0,0]=4 1359 B7R1.1 NCC1=CON=C1 A14706 [1,0,0,0,1,0|2,0,0]=4 1360 B7R1.1 NCC1=CON=C1 I29534 [1,0,0,0,1,0|2,0,0]=4 1361 B7R1.1 NCC1=CSC=C1 T41357 [1,0,0,0,1,0|2,0,0]=4 1362 B7R1.1 NCC1=CSC=N1 T13924 [1,0,0,0,1,0|2,0,0]=4 1363 B7R1.1 NCC1=CSC=N1 T29521 [1,0,0,0,1,0|2,0,0]=4 1364 B7R1.1 NCC1=NC=CN1 A14237 [1,0,0,0,1,0|1,0,1]=4 1365 B7R1.1 NCC1=NC=CN1 K40331 [1,0,0,0,1,0|1,0,1]=4 1366 B7R1.1 NCC1=NC=CS1 A11223 [1,0,0,0,1,0|2,0,0]=4 1367 B7R1.1 NCC1=NC=CS1 T11224 [1,0,0,0,1,0|2,0,0]=4 1368 B7R1.1 NCC1=NC=CS1 T24256 [1,0,0,0,1,0|2,0,0]=4 1369 B7R1.1 NCC1=NNC=C1 P9792 [1,0,0,0,1,0|2,0,0]=4 1370 B7R1.1 NCC1=NOC=C1 I29536 [1,0,0,0,1,0|2,0,0]=4 1371 B7R1.1 NCC1=NOC=C1 I7943 [1,0,0,0,1,0|2,0,0]=4 1372 B7R1.1 NCC1=NSC=C1 I15218 [1,0,0,0,1,0|2,0,0]=4 1373 B7R1.1 OCC1=CC=CS1 T12815 [1,0,0,0,1,0|2,0,0]=4 1374 B7R1.1 OCC1=CC=NO1 K40159 [1,0,0,0,1,0|2,0,0]=4 1375 B7R1.1 OCC1=CN=CN1 I14077 [1,0,0,0,1,0|1,0,1]=4 1376 B7R1.1 OCC1=CN=CO1 X14033 [1,0,0,0,1,0|2,0,0]=4 1377 B7R1.1 OCC1=CN=CS1 T2166 [1,0,0,0,1,0|2,0,0]=4 1378 B7R1.1 OCC1=CNC=N1 H2067 [1,0,0,0,1,0|1,0,1]=4 1379 B7R1.1 OCC1=CNN=C1 H1729 [1,0,0,0,1,0|2,0,0]=4 1380 B7R1.1 OCC1=COC=C1 F41115 [1,0,0,0,1,0|2,0,0]=4 1381 B7R1.1 OCC1=COC=N1 O7923 [1,0,0,0,1,0|2,0,0]=4 1382 B7R1.1 OCC1=CON=C1 H14705 [1,0,0,0,1,0|2,0,0]=4 1383 B7R1.1 OCC1=CSC=C1 T12827 [1,0,0,0,1,0|2,0,0]=4 1384 B7R1.1 OCC1=CSC=N1 T2165 [1,0,0,0,1,0|2,0,0]=4 1385 B7R1.1 OCC1=NC=CN1 I38716 [1,0,0,0,1,0|1,0,1]=4 1386 B7R1.1 OCC1=NC=CO1 X14019 [1,0,0,0,1,0|2,0,0]=4 1387 B7R1.1 OCC1=NC=CS1 H3028 [1,0,0,0,1,0|2,0,0]=4 1388 B7R1.1 OCC1=NC=NN1 T39912 [1,0,0,0,1,0|2,0,0]=4 1389 B7R1.1 OCC1=NNC=C1 H7696 [1,0,0,0,1,0|2,0,0]=4 1390 B7R1.1 OCC1=NOC=C1 I11321 [1,0,0,0,1,0|2,0,0]=4 1391 B7R1.1 OCN1C=CC=N1 P9800 [1,0,0,0,1,0|2,0,0]=4 1392 B7R1.1 OCN1C=NC=N1 T39855 [1,0,0,0,1,0|2,0,0]=4 1393 B7R1.2 CC1=CC(Br)=CS1 B40867 [1,0,0,0,1,0|2,0,0]=4 1394 B7R1.2 CC1=CC(Br)=NN1 B9765 [1,0,0,0,1,0|2,0,0]=4 1395 B7R1.2 CC1=CC(Br)=NO1 B2183 [1,0,0,0,1,0|2,0,0]=4 1396 B7R1.2 CC1=CC(C)=NO1 D39182 [1,0,0,0,1,0|1,0,0]=3 1397 B7R1.2 CC1=CC(Cl)=NN1 C7548 [1,0,0,0,1,0|2,0,0]=4 1398 B7R1.2 CC1=CC(I)=NN1 I26594 [1,0,0,0,1,0|2,0,0]=4 1399 B7R1.2 CC1=CC(N)=NN1 A11614 [1,0,0,0,1,0|2,0,0]=4 1400 B7R1.2 CC1=CC(N)=NO1 A12655 [1,0,0,0,1,0|2,0,0]=4 1401 B7R1.2 CC1=CC=C(C)S1 D43320 [1,0,0,0,1,0|2,0,0]=4 1402 B7R1.2 CC1=CN(C)N=C1 D69464 [1,0,0,0,1,0|1,0,0]=3 1403 B7R1.2 CC1=CN(C)N=N1 D40221 [1,0,0,0,1,0|2,0,0]=4 1404 B7R1.2 CC1=CN=C(Br)S1 B40104 [1,0,0,0,1,0|2,0,0]=4 1405 B7R1.2 CC1=CN=C(C)S1 D38993 [1,0,0,0,1,0|1,0,0]=3 1406 B7R1.2 CC1=CN=C(Cl)S1 C1978 [1,0,0,0,1,0|2,0,0]=4 1407 B7R1.2 CC1=CN=C(N)S1 A69715 [1,0,0,0,1,0|2,0,0]=4 1408 B7R1.2 CC1=CN=C(N)S1 M69725 [1,0,0,0,1,0|2,0,0]=4 1409 B7R1.2 CC1=CNC(Br)=N1 B40115 [1,0,0,0,1,0|1,0,1]=4 1410 B7R1.2 CC1=CNC(C)=N1 D41187 [1,0,0,0,1,0|0,0,1]=3 1411 B7R1.2 CC1=CNC(I)=N1 K40123 [1,0,0,0,1,0|1,0,1]=4 1412 B7R1.2 CC1=COC(N)=N1 A2053 [1,0,0,0,1,0|2,0,0]=4 1413 B7R1.2 CC1=CSC(Br)=N1 B2087 [1,0,0,0,1,0|2,0,0]=4 1414 B7R1.2 CC1=CSC(C)=N1 D41174 [1,0,0,0,1,0|1,0,0]=3 1415 B7R1.2 CC1=CSC(N)=C1 A0597 [1,0,0,0,1,0|2,0,0]=4 1416 B7R1.2 CC1=NC(Br)=CN1 B2121 [1,0,0,0,1,0|1,0,1]=4 1417 B7R1.2 CC1=NC(Br)=CS1 B2069 [1,0,0,0,1,0|2,0,0]=4 1418 B7R1.2 CC1=NC(N)=NO1 M39856 [1,0,0,0,1,0|2,0,0]=4 1419 B7R1.2 CC1=NC=C(Br)S1 B5222 [1,0,0,0,1,0|2,0,0]=4 1420 B7R1.2 CC1=NC=C(I)N1 K40124 [1,0,0,0,1,0|1,0,1]=4 1421 B7R1.2 CC1=NC=C(N)S1 M40189 [1,0,0,0,1,0|2,0,0]=4 1422 B7R1.2 CC1=NN(C)C=C1 D4115 [1,0,0,0,1,0|2,0,0]=4 1423 B7R1.2 CC1=NN=C(C)N1 D0366 [1,0,0,0,1,0|1,0,1]=4 1424 B7R1.2 CC1=NN=C(C)O1 D13454 [1,0,0,0,1,0|2,0,0]=4 1425 B7R1.2 CC1=NNC(Br)=C1 B40114 [1,0,0,0,1,0|2,0,0]=4 1426 B7R1.2 CC1=NNC(I)=C1 K40122 [1,0,0,0,1,0|2,0,0]=4 1427 B7R1.2 CC1=NNC(N)=C1 M40220 [1,0,0,0,1,0|2,0,0]=4 1428 B7R1.2 CC1=NNC(O)=C1 M0907 [1,0,0,0,1,0|2,0,0]=4 1429 B7R1.2 CC1=NOC(N)=C1 A37936 [1,0,0,0,1,0|2,0,0]=4 1430 B7R1.2 CC1=NSC(Br)=N1 B39817 [1,0,0,0,1,0|2,0,0]=4 1431 B7R1.2 CC1=NSC(Cl)=N1 C39820 [1,0,0,0,1,0|2,0,0]=4 1432 B7R1.2 CC1=NSC(I)=C1 I6114 [1,0,0,0,1,0|2,0,0]=4 1433 B7R1.2 CC1=NSC(N)=C1 M65783 [1,0,0,0,1,0|2,0,0]=4 1434 B7R1.2 CC1=NSC(N)=N1 A39858 [1,0,0,0,1,0|2,0,0]=4 1435 B7R1.2 CN1C=C(Br)C=N1 B7572 [1,0,0,0,1,0|2,0,0]=4 1436 B7R1.2 CN1C=C(Cl)C=N1 C40119 [1,0,0,0,1,0|2,0,0]=4 1437 B7R1.2 CN1C=C(I)C=N1 I23483 [1,0,0,0,1,0|2,0,0]=4 1438 B7R1.2 CN1C=C(N)C=N1 A10471 [1,0,0,0,1,0|2,0,0]=4 1439 B7R1.2 CN1C=C(N)C=N1 M24961 [1,0,0,0,1,0|2,0,0]=4 1440 B7R1.2 CN1C=C(N)C=N1 M40360 [1,0,0,0,1,0|2,0,0]=4 1441 B7R1.2 CN1C=C(O)C=N1 M38839 [1,0,0,0,1,0|2,0,0]=4 1442 B7R1.2 CN1C=NC(Br)=C1 B5167 [1,0,0,0,1,0|2,0,0]=4 1443 B7R1.2 CN1C=NC(Br)=N1 B36665 [1,0,0,0,1,0|2,0,0]=4 1444 B7R1.2 CN1C=NC(I)=C1 I2146 [1,0,0,0,1,0|2,0,0]=4 1445 B7R1.2 CN1C=NC(N)=C1 M38763 [1,0,0,0,1,0|2,0,0]=4 1446 B7R1.2 CN1C=NC(N)=N1 M38833 [1,0,0,0,1,0|2,0,0]=4 1447 B7R1.2 CN1N=CC(Br)=N1 B39841 [1,0,0,0,1,0|2,0,0]=4