0 B10R1.3 BrCC1=CC=C(CBr)C=C1 B48752 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.3 C#CC1=CC=C(C#N)C=C1 E36850 [0,0,0,0,0,0|2,0,2]=4 2 B10R1.3 C#CC1=CC=C(C=O)C=C1 E38050 [0,0,0,0,0,0|1,0,3]=4 3 B10R1.3 C#CC1=CC=C(CC)C=C1 E52271 [0,0,0,0,0,0|2,0,1]=3 4 B10R1.3 C#CC1=CC=C(CN)C=C1 E38189 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.3 C#CC1=CC=C(CO)C=C1 E51546 [0,0,0,0,0,0|1,0,1]=2 6 B10R1.3 C#CC1=CC=C(OC)C=C1 E51542 [0,0,0,0,0,0|1,0,1]=2 7 B10R1.3 C#CC1=CN=C(OC)C=C1 E0638 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.3 C=CC1=CC=C(CO)C=C1 V32337 [0,0,0,0,0,0|1,0,1]=2 9 B10R1.3 C=CC1=CC=C(OC)C=C1 M68575 [0,0,0,0,0,0|1,0,1]=2 10 B10R1.3 CCC1=CC=C(NN)C=C1 E49533 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.3 CCC1=CC=C(OC)C=C1 E50270 [0,0,0,0,0,0|1,0,0]=1 12 B10R1.3 CCC1=CN=C(C=O)C=C1 E49257 [0,0,0,0,0,0|2,0,2]=4 13 B10R1.3 CNC1=CC=C(C#N)C=C1 M67463 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.3 CNC1=CN=C(C#N)C=C1 M45724 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.3 CNC1=NC=C(C#N)C=C1 M45725 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.3 COC1=CC=C(C#N)C=C1 M68579 [0,0,0,0,0,0|1,0,1]=2 17 B10R1.3 COC1=CC=C(CN)C=C1 M4627 [0,0,0,0,0,0|1,0,0]=1 18 B10R1.3 COC1=CC=C(CO)C=C1 M68895 [0,0,0,0,0,0|0,0,0]=0 19 B10R1.3 COC1=CC=C(NN)C=C1 M46462 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.3 COC1=CC=C(OC)C=C1 D68896 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.3 COC1=CN=C(C#N)C=C1 M5547 [0,0,0,0,0,0|2,0,1]=3 22 B10R1.3 COC1=CN=C(C#N)N=C1 M12138 [0,0,0,0,0,0|3,0,1]=4 23 B10R1.3 COC1=CN=C(C=O)C=C1 M15225 [0,0,0,0,0,0|1,0,2]=3 24 B10R1.3 COC1=CN=C(C=O)N=C1 M12145 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.3 COC1=CN=C(CCl)C=C1 C15224 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.3 COC1=CN=C(CCl)N=C1 C19967 [0,0,0,0,0,0|3,0,0]=3 27 B10R1.3 COC1=CN=C(CO)C=C1 H15223 [0,0,0,0,0,0|1,0,0]=1 28 B10R1.3 COC1=CN=C(OC)C=C1 D46391 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.3 COC1=NC=C(C#N)C=C1 M9551 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.3 COC1=NC=C(C=O)C=C1 M31008 [0,0,0,0,0,0|1,0,2]=3 31 B10R1.3 COC1=NC=C(C=O)C=N1 M42777 [0,0,0,0,0,0|2,0,2]=4 32 B10R1.3 COC1=NC=C(CBr)C=C1 B37014 [0,0,0,0,0,0|2,0,0]=2 33 B10R1.3 COC1=NC=C(CCl)C=C1 C46199 [0,0,0,0,0,0|2,0,0]=2 34 B10R1.3 COC1=NC=C(CN)C=C1 A10463 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.3 COC1=NC=C(CN)C=C1 M29962 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.3 COC1=NC=C(CN)C=C1 M46593 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.3 COC1=NC=C(CN)C=N1 M26757 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.3 COC1=NC=C(CO)C=C1 M0584 [0,0,0,0,0,0|1,0,0]=1 39 B10R1.3 COC1=NC=C(CO)C=N1 M16831 [0,0,0,0,0,0|2,0,0]=2 40 B10R1.3 COC1=NC=C(CO)N=C1 M61572 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.3 COC1=NC=C(NN)C=C1 H43550 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.3 CSC1=CC=C(C=O)C=C1 M49157 [0,0,0,0,0,0|0,1,2]=3 43 B10R1.3 CSC1=NC=C(CO)C=N1 M36801 [0,0,0,0,0,0|2,1,0]=3 44 B10R1.3 N#CC1=CC=C(C#N)C=C1 B60782 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.3 N#CC1=CC=C(CBr)C=C1 C47942 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.3 N#CC1=CC=C(CCl)C=C1 C47959 [0,0,0,0,0,0|3,0,0]=3 47 B10R1.3 N#CC1=CC=C(CN)C=C1 A37021 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.3 N#CC1=CC=C(CN)C=C1 A49611 [0,0,0,0,0,0|3,0,0]=3 49 B10R1.3 N#CC1=CC=C(CO)C=C1 H48443 [0,0,0,0,0,0|2,0,0]=2 50 B10R1.3 N#CC1=CC=C(NN)C=C1 H46544 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.3 N#CC1=CN=C(CBr)C=C1 B44748 [0,0,0,0,0,0|4,0,0]=4 52 B10R1.3 N#CC1=CN=C(CCl)C=C1 C25620 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.3 N#CC1=CN=C(CO)C=C1 H45222 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.3 N#CC1=NC=C(CBr)C=C1 B44747 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.3 N#CC1=NC=C(CCl)C=C1 C44785 [0,0,0,0,0,0|4,0,0]=4 56 B10R1.3 N#CC1=NC=C(CO)C=C1 H24396 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.3 NCC1=CC=C(CN)C=C1 P46958 [0,0,0,0,0,0|3,0,0]=3 58 B10R1.3 NCC1=CC=C(CO)C=C1 A37992 [0,0,0,0,0,0|2,0,0]=2 59 B10R1.3 O=CC1=CC=C(C=O)C=C1 T69290 [0,0,0,0,0,0|2,0,2]=4 60 B10R1.3 O=CC1=CC=C(CBr)C=C1 B24021 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.3 O=CC1=CC=C(CCl)C=C1 C38746 [0,0,0,0,0,0|3,0,0]=3 62 B10R1.3 O=CC1=CC=C(CO)C=C1 H49069 [0,0,0,0,0,0|2,0,0]=2 63 B10R1.3 OCC1=CC=C(CBr)C=C1 B38754 [0,0,0,0,0,0|2,0,0]=2 64 B10R1.3 OCC1=CC=C(CCl)C=C1 C49451 [0,0,0,0,0,0|2,0,0]=2 65 B10R1.3 OCC1=CC=C(CO)C=C1 B68897 [0,0,0,0,0,0|2,0,0]=2 66 B9R1.1 BrCC1=CC=C(I)C=C1 B45171 [1,0,0,0,0,0|2,0,0]=3 67 B9R1.1 BrCC1=NC=C(Br)C=C1 B42521 [1,0,0,0,0,0|3,0,0]=4 68 B9R1.1 C#CC1=CC=C(Br)C=C1 B47528 [1,0,0,0,0,0|2,0,1]=4 69 B9R1.1 C#CC1=CC=C(C)C=C1 E68609 [1,0,0,0,0,0|1,0,1]=3 70 B9R1.1 C#CC1=CC=C(Cl)C=C1 C4938 [1,0,0,0,0,0|2,0,1]=4 71 B9R1.1 C#CC1=CC=C(F)C=C1 F2891 [1,0,0,0,0,0|2,0,1]=4 72 B9R1.1 C#CC1=CC=C(N)C=C1 E37919 [1,0,0,0,0,0|2,0,1]=4 73 B9R1.1 C=CC1=CC=C(Br)C=C1 B68124 [1,0,0,0,0,0|2,0,1]=4 74 B9R1.1 C=CC1=CC=C(O)C=C1 V67697 [1,0,0,0,0,0|1,0,1]=3 75 B9R1.1 C=CC1=CN=C(C)C=C1 M11564 [1,0,0,0,0,0|2,0,1]=4 76 B9R1.1 CC1=CC=C(C=O)C=C1 M68600 [1,0,0,0,0,0|0,0,2]=3 77 B9R1.1 CC1=CC=C(CN)C=C1 M69544 [1,0,0,0,0,0|1,0,0]=2 78 B9R1.1 CC1=CC=C(CN)N=N1 M0158 [1,0,0,0,0,0|3,0,0]=4 79 B9R1.1 CC1=CC=C(CN)N=N1 M27037 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.1 CC1=CC=C(CO)C=C1 T37852 [1,0,0,0,0,0|0,0,0]=1 81 B9R1.1 CC1=CC=C(NN)C=C1 T68855 [1,0,0,0,0,0|2,0,0]=3 82 B9R1.1 CC1=CN=C(C#N)C=C1 C4792 [1,0,0,0,0,0|2,0,1]=4 83 B9R1.1 CC1=CN=C(C=O)C=C1 M3063 [1,0,0,0,0,0|1,0,2]=4 84 B9R1.1 CC1=CN=C(CCl)C=C1 C46107 [1,0,0,0,0,0|2,0,0]=3 85 B9R1.1 CC1=CN=C(CCl)C=N1 C11548 [1,0,0,0,0,0|3,0,0]=4 86 B9R1.1 CC1=CN=C(CCl)C=N1 C43004 [1,0,0,0,0,0|3,0,0]=4 87 B9R1.1 CC1=CN=C(CCl)N=C1 C14428 [1,0,0,0,0,0|3,0,0]=4 88 B9R1.1 CC1=CN=C(CCl)N=C1 C8015 [1,0,0,0,0,0|3,0,0]=4 89 B9R1.1 CC1=CN=C(CN)C=C1 M43622 [1,0,0,0,0,0|2,0,0]=3 90 B9R1.1 CC1=CN=C(CN)C=C1 M46461 [1,0,0,0,0,0|2,0,0]=3 91 B9R1.1 CC1=CN=C(CN)C=N1 A3139 [1,0,0,0,0,0|3,0,0]=4 92 B9R1.1 CC1=CN=C(CN)N=C1 M11333 [1,0,0,0,0,0|3,0,0]=4 93 B9R1.1 CC1=CN=C(CO)C=N1 M43210 [1,0,0,0,0,0|2,0,0]=3 94 B9R1.1 CC1=CN=C(CO)N=C1 H11473 [1,0,0,0,0,0|2,0,0]=3 95 B9R1.1 CC1=CN=C(NN)C=C1 H63578 [1,0,0,0,0,0|3,0,0]=4 96 B9R1.1 CC1=NC=C(C#N)C=C1 M12704 [1,0,0,0,0,0|2,0,1]=4 97 B9R1.1 CC1=NC=C(C=O)C=C1 M0419 [1,0,0,0,0,0|1,0,2]=4 98 B9R1.1 CC1=NC=C(CBr)C=C1 B46089 [1,0,0,0,0,0|2,0,0]=3 99 B9R1.1 CC1=NC=C(CBr)C=N1 B42978 [1,0,0,0,0,0|3,0,0]=4 100 B9R1.1 CC1=NC=C(CCl)C=C1 C46111 [1,0,0,0,0,0|2,0,0]=3 101 B9R1.1 CC1=NC=C(CCl)C=N1 C19650 [1,0,0,0,0,0|3,0,0]=4 102 B9R1.1 CC1=NC=C(CN)C=C1 M0572 [1,0,0,0,0,0|2,0,0]=3 103 B9R1.1 CC1=NC=C(CN)C=N1 A1723 [1,0,0,0,0,0|3,0,0]=4 104 B9R1.1 CC1=NC=C(CO)C=C1 M15722 [1,0,0,0,0,0|1,0,0]=2 105 B9R1.1 CC1=NC=C(CO)C=N1 H12381 [1,0,0,0,0,0|2,0,0]=3 106 B9R1.1 CC1=NC=C(NN)C=C1 H14024 [1,0,0,0,0,0|3,0,0]=4 107 B9R1.1 CCC1=CC=C(Br)C=C1 B68945 [1,0,0,0,0,0|2,0,0]=3 108 B9R1.1 CCC1=CC=C(Cl)C=C1 C49160 [1,0,0,0,0,0|2,0,0]=3 109 B9R1.1 CCC1=CC=C(I)C=C1 E49167 [1,0,0,0,0,0|2,0,0]=3 110 B9R1.1 CCC1=CC=C([Mg+])C=C1 E31741 [1,0,0,0,0,0|2,0,0]=3 111 B9R1.1 CCC1=CN=C(Cl)C=C1 C26331 [1,0,0,0,0,0|3,0,0]=4 112 B9R1.1 CCC1=CN=C(N)C=C1 E43600 [1,0,0,0,0,0|3,0,0]=4 113 B9R1.1 CCC1=NC=C(Br)C=C1 B1614 [1,0,0,0,0,0|3,0,0]=4 114 B9R1.1 CCC1=NC=C(Cl)C=C1 C46096 [1,0,0,0,0,0|3,0,0]=4 115 B9R1.1 CCC1=NC=C(N)C=C1 E43602 [1,0,0,0,0,0|3,0,0]=4 116 B9R1.1 CNC1=CC=C(Br)C=C1 B61266 [1,0,0,0,0,0|2,0,0]=3 117 B9R1.1 CNC1=CC=C(C)C=C1 D39432 [1,0,0,0,0,0|1,0,0]=2 118 B9R1.1 CNC1=CC=C(I)C=C1 K46120 [1,0,0,0,0,0|2,0,0]=3 119 B9R1.1 CNC1=CC=C(N)C=C1 M69627 [1,0,0,0,0,0|2,0,0]=3 120 B9R1.1 CNC1=CN=C(C)C=C1 D43616 [1,0,0,0,0,0|2,0,0]=3 121 B9R1.1 CNC1=NC=C(Br)C=C1 B42975 [1,0,0,0,0,0|3,0,0]=4 122 B9R1.1 CNC1=NC=C(C)C=C1 D43614 [1,0,0,0,0,0|2,0,0]=3 123 B9R1.1 CNC1=NC=C(F)C=C1 F32100 [1,0,0,0,0,0|3,0,0]=4 124 B9R1.1 CNC1=NC=C(N)C=C1 M43342 [1,0,0,0,0,0|3,0,0]=4 125 B9R1.1 CNC1=NC=C(N)C=C1 M43545 [1,0,0,0,0,0|3,0,0]=4 126 B9R1.1 COC1=CC=C(S)C=C1 M46276 [1,0,0,0,0,0|0,1,0]=2 127 B9R1.1 COC1=CC=C([Mg+])C=C1 M31744 [1,0,0,0,0,0|1,0,0]=2 128 B9R1.1 COC1=CN=C(Br)C=C1 B5045 [1,0,0,0,0,0|2,0,0]=3 129 B9R1.1 COC1=CN=C(Br)C=N1 B14594 [1,0,0,0,0,0|3,0,0]=4 130 B9R1.1 COC1=CN=C(Br)N=C1 B10519 [1,0,0,0,0,0|3,0,0]=4 131 B9R1.1 COC1=CN=C(Cl)C=C1 C19386 [1,0,0,0,0,0|2,0,0]=3 132 B9R1.1 COC1=CN=C(Cl)C=N1 C14595 [1,0,0,0,0,0|3,0,0]=4 133 B9R1.1 COC1=CN=C(Cl)N=C1 C10446 [1,0,0,0,0,0|3,0,0]=4 134 B9R1.1 COC1=CN=C(F)C=C1 F42925 [1,0,0,0,0,0|2,0,0]=3 135 B9R1.1 COC1=CN=C(I)C=C1 I5931 [1,0,0,0,0,0|2,0,0]=3 136 B9R1.1 COC1=CN=C(N)C=C1 A10497 [1,0,0,0,0,0|2,0,0]=3 137 B9R1.1 COC1=CN=C(N)N=C1 A10520 [1,0,0,0,0,0|3,0,0]=4 138 B9R1.1 COC1=NC=C(Br)C=C1 B9550 [1,0,0,0,0,0|2,0,0]=3 139 B9R1.1 COC1=NC=C(Br)C=N1 B2218 [1,0,0,0,0,0|3,0,0]=4 140 B9R1.1 COC1=NC=C(C)C=C1 M67554 [1,0,0,0,0,0|1,0,0]=2 141 B9R1.1 COC1=NC=C(Cl)C=C1 C42903 [1,0,0,0,0,0|2,0,0]=3 142 B9R1.1 COC1=NC=C(Cl)C=N1 C40931 [1,0,0,0,0,0|3,0,0]=4 143 B9R1.1 COC1=NC=C(F)C=C1 F24011 [1,0,0,0,0,0|2,0,0]=3 144 B9R1.1 COC1=NC=C(I)C=C1 K42935 [1,0,0,0,0,0|2,0,0]=3 145 B9R1.1 COC1=NC=C(I)C=N1 K40945 [1,0,0,0,0,0|3,0,0]=4 146 B9R1.1 COC1=NC=C(N)C=C1 A12692 [1,0,0,0,0,0|2,0,0]=3 147 B9R1.1 COC1=NC=C(N)C=N1 M24312 [1,0,0,0,0,0|3,0,0]=4 148 B9R1.1 COC1=NC=C(N)N=C1 M9733 [1,0,0,0,0,0|3,0,0]=4 149 B9R1.1 COC1=NC=C(O)C=C1 H43140 [1,0,0,0,0,0|1,0,0]=2 150 B9R1.1 COC1=NN=C(Br)C=C1 B36769 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.1 COC1=NN=C(C)C=C1 M43203 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.1 COC1=NN=C(Cl)C=C1 C12386 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.1 COC1=NN=C(I)C=C1 K40944 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.1 COC1=NN=C(N)C=C1 A12790 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.1 COC1=NN=C(N)C=C1 M62955 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.1 CSC1=CC=C(I)C=C1 I38579 [1,0,0,0,0,0|1,1,0]=3 157 B9R1.1 CSC1=CC=C(O)C=C1 M67393 [1,0,0,0,0,0|0,1,0]=2 158 B9R1.1 CSC1=CC=C([Mg+])C=C1 M31771 [1,0,0,0,0,0|1,1,0]=3 159 B9R1.1 CSC1=CN=C(N)C=C1 A43262 [1,0,0,0,0,0|2,1,0]=4 160 B9R1.1 CSC1=NC=C(Br)C=C1 B2646 [1,0,0,0,0,0|2,1,0]=4 161 B9R1.1 CSC1=NC=C(O)C=N1 M41048 [1,0,0,0,0,0|2,1,0]=4 162 B9R1.1 ClC1=CC=C(CBr)C=C1 B45158 [1,0,0,0,0,0|2,0,0]=3 163 B9R1.1 ClC1=CN=C(CBr)C=C1 B42537 [1,0,0,0,0,0|3,0,0]=4 164 B9R1.1 ClCC1=CC=C(Br)C=C1 B45160 [1,0,0,0,0,0|2,0,0]=3 165 B9R1.1 ClCC1=CN=C(Br)C=C1 B42528 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.1 ClCC1=CN=C(Br)C=C1 B42539 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.1 ClCC1=NC=C(Br)C=C1 B42540 [1,0,0,0,0,0|3,0,0]=4 168 B9R1.1 ClCC1=NC=C(Br)C=C1 B61533 [1,0,0,0,0,0|3,0,0]=4 169 B9R1.1 ClCC1=NC=C(Cl)C=C1 C14676 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.1 ClCC1=NC=C(Cl)C=C1 C42565 [1,0,0,0,0,0|3,0,0]=4 171 B9R1.1 FC1=CC=C(C[Mg+])C=C1 F6777 [1,0,0,0,0,0|2,0,0]=3 172 B9R1.1 FC1=NC=C(CBr)C=C1 B39061 [1,0,0,0,0,0|3,0,0]=4 173 B9R1.1 FC1=NC=C(CBr)C=C1 B7888 [1,0,0,0,0,0|3,0,0]=4 174 B9R1.1 FC1=NC=C(CCl)C=C1 C7887 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.1 N#CC1=CC=C(Br)C=C1 B67636 [1,0,0,0,0,0|2,0,1]=4 176 B9R1.1 N#CC1=CC=C(Cl)C=C1 C37848 [1,0,0,0,0,0|2,0,1]=4 177 B9R1.1 N#CC1=CC=C(F)C=C1 F64969 [1,0,0,0,0,0|2,0,1]=4 178 B9R1.1 N#CC1=CC=C(I)C=C1 K44443 [1,0,0,0,0,0|2,0,1]=4 179 B9R1.1 N#CC1=CC=C(N)C=C1 A64955 [1,0,0,0,0,0|2,0,1]=4 180 B9R1.1 N#CC1=CC=C(O)C=C1 C64941 [1,0,0,0,0,0|1,0,1]=3 181 B9R1.1 N#CC1=CC=C(S)C=C1 M64870 [1,0,0,0,0,0|1,1,1]=4 182 B9R1.1 N#CC1=CN=C(O)C=C1 H42087 [1,0,0,0,0,0|2,0,1]=4 183 B9R1.1 N#CC1=NC=C(O)C=C1 C7985 [1,0,0,0,0,0|2,0,1]=4 184 B9R1.1 NC1=CC=C(CO)C=C1 A36619 [1,0,0,0,0,0|1,0,0]=2 185 B9R1.1 NC1=NC=C(CO)C=C1 A0345 [1,0,0,0,0,0|2,0,0]=3 186 B9R1.1 NC1=NC=C(CO)C=N1 A11298 [1,0,0,0,0,0|3,0,0]=4 187 B9R1.1 NCC1=CC=C(Br)C=C1 B36612 [1,0,0,0,0,0|2,0,0]=3 188 B9R1.1 NCC1=CC=C(Br)C=C1 B46090 [1,0,0,0,0,0|2,0,0]=3 189 B9R1.1 NCC1=CC=C(Cl)C=C1 C46099 [1,0,0,0,0,0|2,0,0]=3 190 B9R1.1 NCC1=CC=C(I)C=C1 I36689 [1,0,0,0,0,0|2,0,0]=3 191 B9R1.1 NCC1=CC=C(I)C=C1 K46123 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.1 NCC1=CC=C(N)C=C1 A46581 [1,0,0,0,0,0|2,0,0]=3 193 B9R1.1 NCC1=CC=C(O)C=C1 A67587 [1,0,0,0,0,0|1,0,0]=2 194 B9R1.1 NCC1=CN=C(Br)C=C1 B42976 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.1 NCC1=CN=C(Cl)C=C1 A0585 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.1 NCC1=CN=C(F)C=C1 A13990 [1,0,0,0,0,0|3,0,0]=4 197 B9R1.1 NCC1=CNC(=O)C=C1 A1719 [1,0,0,0,0,0|2,0,1]=4 198 B9R1.1 NCC1=NC=C(Br)C=C1 B15775 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.1 NCC1=NC=C(Br)C=C1 B42983 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.1 NCC1=NC=C(Br)C=C1 B7021 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.1 NCC1=NC=C(Cl)C=C1 C43002 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.1 NCC1=NC=C(Cl)C=C1 C43003 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.1 NCC1=NC=C(N)C=C1 A36932 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.1 NNC1=CC=C(Br)C=C1 B42962 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.1 NNC1=CC=C(Br)C=C1 B42980 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.1 NNC1=CC=C(Cl)C=C1 C61981 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.1 NNC1=CC=C(Cl)C=C1 C68982 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.1 NNC1=CC=C(F)C=C1 F25536 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.1 NNC1=CC=C(I)C=C1 K43029 [1,0,0,0,0,0|3,0,0]=4 210 B9R1.1 O=C1C=CC(CO)=CN1 H37111 [1,0,0,0,0,0|1,0,1]=3 211 B9R1.1 O=CC1=CC=C(Br)C=C1 B67400 [1,0,0,0,0,0|1,0,2]=4 212 B9R1.1 O=CC1=CC=C(Cl)C=C1 C37300 [1,0,0,0,0,0|1,0,2]=4 213 B9R1.1 O=CC1=CC=C(F)C=C1 F4631 [1,0,0,0,0,0|1,0,2]=4 214 B9R1.1 O=CC1=CC=C(I)C=C1 K20170 [1,0,0,0,0,0|1,0,2]=4 215 B9R1.1 O=CC1=NC=C(O)C=C1 H36846 [1,0,0,0,0,0|1,0,2]=4 216 B9R1.1 OCC1=CC=C(Br)C=C1 B67585 [1,0,0,0,0,0|1,0,0]=2 217 B9R1.1 OCC1=CC=C(Cl)C=C1 C39406 [1,0,0,0,0,0|1,0,0]=2 218 B9R1.1 OCC1=CC=C(F)C=C1 F39409 [1,0,0,0,0,0|1,0,0]=2 219 B9R1.1 OCC1=CC=C(I)C=C1 I36662 [1,0,0,0,0,0|1,0,0]=2 220 B9R1.1 OCC1=CN=C(Br)C=C1 B12392 [1,0,0,0,0,0|2,0,0]=3 221 B9R1.1 OCC1=CN=C(Cl)C=C1 C9389 [1,0,0,0,0,0|2,0,0]=3 222 B9R1.1 OCC1=CN=C(Cl)C=N1 C1534 [1,0,0,0,0,0|3,0,0]=4 223 B9R1.1 OCC1=CN=C(Cl)N=C1 C1532 [1,0,0,0,0,0|3,0,0]=4 224 B9R1.1 OCC1=CN=C(F)C=C1 F13989 [1,0,0,0,0,0|2,0,0]=3 225 B9R1.1 OCC1=NC=C(Br)C=C1 B3203 [1,0,0,0,0,0|2,0,0]=3 226 B9R1.1 OCC1=NC=C(Br)C=N1 B14040 [1,0,0,0,0,0|3,0,0]=4 227 B9R1.1 OCC1=NC=C(Cl)C=C1 C22297 [1,0,0,0,0,0|2,0,0]=3 228 B9R1.1 OCC1=NC=C(Cl)C=N1 C14437 [1,0,0,0,0,0|3,0,0]=4 229 B9R1.1 OCC1=NC=C(F)C=C1 F0644 [1,0,0,0,0,0|2,0,0]=3 230 B9R1.1 OCC1=NC=C(F)C=N1 F11272 [1,0,0,0,0,0|3,0,0]=4 231 B9R1.1 OCC1=NN=C(Cl)C=C1 C14684 [1,0,0,0,0,0|3,0,0]=4 232 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 E16325 [0,1,0,0,0,0|1,0,2]=4 233 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 E62179 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.3 C#CC1=CC=C(C(C)C)C=C1 E54481 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 D38058 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 V67904 [0,1,0,0,0,0|1,0,2]=4 237 B11R1.3 C=CC1=CC=C([SiH](C)C)C=C1 D53107 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 A51160 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 A51552 [0,1,0,0,0,0|1,0,2]=4 240 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 B36669 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 A52108 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 H49897 [0,1,0,0,0,0|1,0,0]=2 243 B11R1.3 CC(C)C1=CC=C(CN)C=C1 P53115 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.3 CCC1=CC=C(B(O)O)C=C1 E3140 [0,1,0,0,0,0|2,0,0]=3 245 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 E61033 [0,1,0,0,0,0|1,0,1]=3 246 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 E49271 [0,1,0,0,0,0|2,0,1]=4 247 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 D69320 [0,1,0,0,0,0|1,0,2]=4 248 B11R1.3 CN(C)C1=CC=C(CO)C=C1 D61045 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.3 CN(C)C1=CC=C(NN)C=C1 H49675 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 M60981 [0,1,0,0,0,0|1,0,1]=3 251 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 M50024 [0,1,0,0,0,0|1,0,2]=4 252 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 M60707 [0,1,0,0,0,0|2,0,1]=4 253 B11R1.3 COC1=CC=C(C(=N)N)C=C1 M49492 [0,1,0,0,0,0|1,0,1]=3 254 B11R1.3 COC1=CC=C(C(=O)O)C=C1 M64803 [0,1,0,0,0,0|0,0,1]=2 255 B11R1.3 COC1=CC=C(C(N)=O)C=C1 M49268 [0,1,0,0,0,0|0,0,2]=3 256 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 M50287 [0,1,0,0,0,0|0,0,0]=1 257 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M50345 [0,1,0,0,0,0|1,0,0]=2 258 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M63049 [0,1,0,0,0,0|1,0,0]=2 259 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M68132 [0,1,0,0,0,0|1,0,0]=2 260 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M38013 [0,1,0,0,0,0|0,0,0]=1 261 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M50288 [0,1,0,0,0,0|0,0,0]=1 262 B11R1.3 COC1=CN=C(C(=N)N)C=C1 M32423 [0,1,0,0,0,0|2,0,1]=4 263 B11R1.3 COC1=CN=C(C(=O)O)C=C1 M14344 [0,1,0,0,0,0|1,0,1]=3 264 B11R1.3 COC1=CN=C(C(=O)O)C=N1 M23515 [0,1,0,0,0,0|2,0,1]=4 265 B11R1.3 COC1=CN=C(C(C)=O)C=C1 A15229 [0,1,0,0,0,0|1,0,2]=4 266 B11R1.3 COC1=NC=C(B(O)O)C=C1 M4320 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.3 COC1=NC=C(B(O)O)C=N1 M2205 [0,1,0,0,0,0|3,0,0]=4 268 B11R1.3 COC1=NC=C(C(=N)N)C=C1 M46573 [0,1,0,0,0,0|2,0,1]=4 269 B11R1.3 COC1=NC=C(C(=O)O)C=C1 M12739 [0,1,0,0,0,0|1,0,1]=3 270 B11R1.3 COC1=NC=C(C(C)=O)C=C1 A49280 [0,1,0,0,0,0|1,0,2]=4 271 B11R1.3 COC1=NC=C([N+](=O)[O-])C=C1 M42783 [0,1,0,0,0,0|2,0,1]=4 272 B11R1.3 COC1=NN=C(C(=O)O)C=C1 M24293 [0,1,0,0,0,0|2,0,1]=4 273 B11R1.3 CSC1=CC=C(B(O)O)C=C1 M4660 [0,1,0,0,0,0|1,1,0]=3 274 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 M62193 [0,1,0,0,0,0|0,1,1]=3 275 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 M49959 [0,1,0,0,0,0|0,1,2]=4 276 B11R1.3 CSC1=NC=C(B(O)O)C=C1 M2495 [0,1,0,0,0,0|2,1,0]=4 277 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 A52058 [0,1,0,0,0,0|2,0,1]=4 278 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 A64157 [0,1,0,0,0,0|2,0,1]=4 279 B11R1.3 C[C@@H](N)C1=CC=C(CO)C=C1 A64851 [0,1,0,0,0,0|1,0,0]=2 280 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 A52059 [0,1,0,0,0,0|2,0,1]=4 281 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 A64156 [0,1,0,0,0,0|2,0,1]=4 282 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 C2360 [0,1,0,0,0,0|3,0,0]=4 283 B11R1.3 N#CC1=CC=C(C(Cl)Cl)C=C1 D47688 [0,1,0,0,0,0|3,0,0]=4 284 B11R1.3 NCC1=CC=C(B(O)O)C=C1 A1320 [0,1,0,0,0,0|3,0,0]=4 285 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 A37814 [0,1,0,0,0,0|2,0,1]=4 286 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 A49493 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 N46556 [0,1,0,0,0,0|3,0,0]=4 288 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 N69631 [0,1,0,0,0,0|2,0,1]=4 289 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 H49094 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 H32219 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 F3540 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 F69091 [0,1,0,0,0,0|2,0,1]=4 293 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 N68869 [0,1,0,0,0,0|2,0,0]=3 294 B11R1.3 O=[N+]([O-])C1=CN=C(CO)C=C1 N42784 [0,1,0,0,0,0|3,0,0]=4 295 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 B1880 [0,1,0,0,0,0|3,0,0]=4 296 B11R1.3 OCC1=CC=C(B(O)O)C=C1 H3720 [0,1,0,0,0,0|2,0,0]=3 297 B11R1.83 C#CC1=CC=C(CC#N)C=C1 E53504 [0,1,0,0,0,0|2,0,1]=4 298 B11R1.83 C#CC1=CC=C(CCC)C=C1 E54480 [0,1,0,0,0,0|2,0,1]=4 299 B11R1.83 C#CC1=CC=C(OCC)C=C1 E52410 [0,1,0,0,0,0|1,0,1]=3 300 B11R1.83 CCC1=CC=C(CNC)C=C1 E53118 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.83 CCC1=CN=C(CCO)C=C1 E39550 [0,1,0,0,0,0|2,0,0]=3 302 B11R1.83 CCCC1=CC=C(C=O)C=C1 P52777 [0,1,0,0,0,0|1,0,2]=4 303 B11R1.83 CCNC1=CC=C(C#N)C=C1 E49708 [0,1,0,0,0,0|2,0,1]=4 304 B11R1.83 CCOC1=CC=C(CN)C=C1 E50343 [0,1,0,0,0,0|1,0,0]=2 305 B11R1.83 CCOC1=NC=C(C=O)C=C1 E49274 [0,1,0,0,0,0|1,0,2]=4 306 B11R1.83 CNCC1=CC=C(C#N)C=C1 M49716 [0,1,0,0,0,0|2,0,1]=4 307 B11R1.83 CNCC1=CC=C(OC)C=C1 M38582 [0,1,0,0,0,0|1,0,0]=2 308 B11R1.83 CNCC1=CC=C(OC)C=C1 M52172 [0,1,0,0,0,0|1,0,0]=2 309 B11R1.83 COC1=CC=C(C#CI)C=C1 M1885 [0,1,0,0,0,0|1,0,1]=3 310 B11R1.83 COC1=CC=C(CC#N)C=C1 M16235 [0,1,0,0,0,0|1,0,0]=2 311 B11R1.83 COC1=CC=C(CC=O)C=C1 M49894 [0,1,0,0,0,0|0,0,1]=2 312 B11R1.83 COC1=CC=C(CCO)C=C1 M67580 [0,1,0,0,0,0|0,0,0]=1 313 B11R1.83 COC1=CC=C(CC[Mg+])C=C1 M31722 [0,1,0,0,0,0|1,0,0]=2 314 B11R1.83 COC1=CC=C(CNN)C=C1 M0099 [0,1,0,0,0,0|1,0,0]=2 315 B11R1.83 COC1=CC=C(CNN)C=C1 M19471 [0,1,0,0,0,0|1,0,0]=2 316 B11R1.83 COC1=CC=C(CNN)C=C1 M23593 [0,1,0,0,0,0|1,0,0]=2 317 B11R1.83 COC1=CC=C(CON)C=C1 M10064 [0,1,0,0,0,0|0,0,0]=1 318 B11R1.83 COC1=CC=C(CON)C=C1 M38789 [0,1,0,0,0,0|0,0,0]=1 319 B11R1.83 COC1=CN=C(CC#N)C=C1 M48814 [0,1,0,0,0,0|2,0,0]=3 320 B11R1.83 COC1=CN=C(CCN)C=C1 M49539 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.83 N#CC1=CC=C(CCBr)C=C1 B36957 [0,1,0,0,0,0|2,0,1]=4 322 B11R1.83 N#CC1=CC=C(CCO)C=C1 H51763 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.83 N#CCC1=CC=C(C#N)C=C1 C50794 [0,1,0,0,0,0|3,0,0]=4 324 B11R1.279 CCC1=CC(N)=C(OC)C=C1 E50338 [0,1,0,0,0,0|1,0,0]=2 325 B11R1.279 CCC1=NC(N)=C(CO)C=N1 A43752 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.279 CNC1=C(N)C=C(C#N)C=C1 A49204 [0,1,0,0,0,0|2,0,1]=4 327 B11R1.279 COC1=C(Br)C=C(C#N)C=C1 B48070 [0,1,0,0,0,0|1,0,1]=3 328 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 B2967 [0,1,0,0,0,0|0,0,2]=3 329 B11R1.279 COC1=C(Br)C=C(CO)C=C1 B49379 [0,1,0,0,0,0|0,0,0]=1 330 B11R1.279 COC1=C(C)C=C(C#N)C=C1 M63445 [0,1,0,0,0,0|1,0,1]=3 331 B11R1.279 COC1=C(C)C=C(C=O)C=C1 M49891 [0,1,0,0,0,0|0,0,2]=3 332 B11R1.279 COC1=C(Cl)C=C(C#N)C=C1 C48086 [0,1,0,0,0,0|1,0,1]=3 333 B11R1.279 COC1=C(Cl)C=C(C=O)C=C1 C67645 [0,1,0,0,0,0|0,0,2]=3 334 B11R1.279 COC1=C(Cl)C=C(C=O)C=N1 C37108 [0,1,0,0,0,0|1,0,2]=4 335 B11R1.279 COC1=C(Cl)C=C(CBr)C=C1 B49134 [0,1,0,0,0,0|1,0,0]=2 336 B11R1.279 COC1=C(Cl)C=C(CN)C=C1 C46806 [0,1,0,0,0,0|1,0,0]=2 337 B11R1.279 COC1=C(F)C=C(C#N)C=C1 F48101 [0,1,0,0,0,0|1,0,1]=3 338 B11R1.279 COC1=C(F)C=C(C=O)C=C1 F48620 [0,1,0,0,0,0|0,0,2]=3 339 B11R1.279 COC1=C(F)C=C(CBr)C=C1 B2649 [0,1,0,0,0,0|1,0,0]=2 340 B11R1.279 COC1=C(F)C=C(CN)C=C1 F46816 [0,1,0,0,0,0|1,0,0]=2 341 B11R1.279 COC1=C(I)C=C(C=O)C=C1 K48635 [0,1,0,0,0,0|0,0,2]=3 342 B11R1.279 COC1=C(N)C=C(C#N)C=C1 A9445 [0,1,0,0,0,0|1,0,1]=3 343 B11R1.279 COC1=C(N)C=C(C=O)C=C1 A49285 [0,1,0,0,0,0|0,0,2]=3 344 B11R1.279 COC1=C(N)C=C(CO)C=C1 A37036 [0,1,0,0,0,0|0,0,0]=1 345 B11R1.279 COC1=C(O)C=C(C#N)C=C1 H67534 [0,1,0,0,0,0|1,0,1]=3 346 B11R1.279 COC1=C(O)C=C(CO)C=C1 H39431 [0,1,0,0,0,0|0,0,0]=1 347 B11R1.279 COC1=CC(Br)=C(C#N)C=C1 B37120 [0,1,0,0,0,0|1,0,1]=3 348 B11R1.279 COC1=CC(Br)=C(C=O)C=C1 B48573 [0,1,0,0,0,0|0,0,2]=3 349 B11R1.279 COC1=CC(Br)=C(OC)C=C1 B39519 [0,1,0,0,0,0|2,0,0]=3 350 B11R1.279 COC1=CC(C)=C(C#N)C=C1 M51764 [0,1,0,0,0,0|1,0,1]=3 351 B11R1.279 COC1=CC(C)=C(C=O)C=C1 M49888 [0,1,0,0,0,0|0,0,2]=3 352 B11R1.279 COC1=CC(C)=C(C=O)C=N1 M49289 [0,1,0,0,0,0|1,0,2]=4 353 B11R1.279 COC1=CC(C)=C(OC)C=C1 D50280 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.279 COC1=CC(Cl)=C(C#N)C=C1 C48085 [0,1,0,0,0,0|1,0,1]=3 355 B11R1.279 COC1=CC(Cl)=C(C=O)C=C1 C48595 [0,1,0,0,0,0|0,0,2]=3 356 B11R1.279 COC1=CC(F)=C(C#N)C=C1 F68008 [0,1,0,0,0,0|1,0,1]=3 357 B11R1.279 COC1=CC(F)=C(C=O)C=C1 F48617 [0,1,0,0,0,0|0,0,2]=3 358 B11R1.279 COC1=CC(F)=C(NN)C=C1 F46569 [0,1,0,0,0,0|2,0,0]=3 359 B11R1.279 COC1=CC(F)=C(OC)C=C1 F49392 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.279 COC1=CC(N)=C(C#N)C=C1 A36670 [0,1,0,0,0,0|1,0,1]=3 361 B11R1.279 COC1=CC(N)=C(CO)C=C1 A46922 [0,1,0,0,0,0|0,0,0]=1 362 B11R1.279 COC1=CC(N)=C(OC)C=C1 D39435 [0,1,0,0,0,0|2,0,0]=3 363 B11R1.279 COC1=CC(O)=C(C#N)C=C1 H48461 [0,1,0,0,0,0|1,0,1]=3 364 B11R1.279 COC1=CC(O)=C(OC)C=C1 D46841 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.279 COC1=CC(S)=C(OC)C=C1 D46838 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.279 COC1=CC([Mg+])=C(OC)C=C1 D31788 [0,1,0,0,0,0|2,0,0]=3 367 B11R1.279 COC1=CC=C(C=O)C(Br)=N1 B45340 [0,1,0,0,0,0|1,0,2]=4 368 B11R1.279 COC1=CC=C(C=O)C(Cl)=N1 C45361 [0,1,0,0,0,0|1,0,2]=4 369 B11R1.279 COC1=CC=C(CO)C(Cl)=N1 C46142 [0,1,0,0,0,0|1,0,0]=2 370 B11R1.279 COC1=NC=C(C#N)C(C)=C1 M48810 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.279 CSC1=NC(C)=C(CO)C=N1 M43686 [0,1,0,0,0,0|2,1,0]=4 372 B11R1.279 CSC1=NC(N)=C(CO)C=N1 A10636 [0,1,0,0,0,0|2,1,0]=4 373 B11R1.279 CSC1=NC=C(CO)C(Cl)=N1 C13102 [0,1,0,0,0,0|2,1,0]=4 374 B11R1.279 N#CC1=C(F)C=C(CBr)C=C1 B47673 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.279 N#CC1=C(F)C=C(CN)C=C1 A64257 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.279 N#CC1=C(F)C=C(CO)C=C1 F38070 [0,1,0,0,0,0|2,0,0]=3 377 B11R1.279 N#CC1=CC(Br)=C(CBr)C=C1 B38721 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.279 N#CC1=CC(Br)=C(CO)C=C1 B48079 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.279 N#CC1=CC(F)=C(CBr)C=C1 B16321 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.279 N#CC1=CC(F)=C(CO)C=C1 F67413 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.279 O=CC1=C(O)C=C(CO)C=C1 H64562 [0,1,0,0,0,0|2,0,0]=3 382 B11R2.190 C=CC1=CC2=C(C=C1)CC2 V52272 [0,0,0,1,0,0|2,0,1]=4 383 B11R2.190 O=CC1=CC2=C(C=C1)CC2 B51547 [0,0,0,1,0,0|1,0,2]=4 384 B11R2.190 OCC1=CC2=C(C=C1)CC2 B49878 [0,0,0,1,0,0|1,0,0]=2 385 B9R1.21 COC1=CC(CN)=NN1 A7802 [0,0,0,0,1,0|3,0,0]=4 386 B9R1.21 COC1=CC=C(OC)S1 D43309 [0,0,0,0,1,0|3,0,0]=4 387 B9R1.21 O=CC1=CC=C(CO)N1 H43148 [0,0,0,0,1,0|3,0,0]=4 388 B9R1.21 OCC1=CC=C(CO)O1 F69147 [0,0,0,0,1,0|3,0,0]=4 389 B8R0.9 COC(=O)\C=C\C(=O)O M60916 [1,0,1,0,0,0|2,0,0]=4 390 B8R1.2 BrCC1=CC=NC=C1 B36897 [2,0,0,0,0,0|2,0,0]=4 391 B8R1.2 BrCC1=CN=CC=C1 B23879 [2,0,0,0,0,0|2,0,0]=4 392 B8R1.2 BrCC1=NC=CC=C1 B42841 [2,0,0,0,0,0|2,0,0]=4 393 B8R1.2 CNC1=CC=CN=C1 M38086 [2,0,0,0,0,0|2,0,0]=4 394 B8R1.2 CNC1=CC=NC=C1 M68620 [2,0,0,0,0,0|2,0,0]=4 395 B8R1.2 COC1=CC=NC=C1 M9391 [2,0,0,0,0,0|1,0,0]=3 396 B8R1.2 COC1=CN=CC=C1 M67978 [2,0,0,0,0,0|1,0,0]=3 397 B8R1.2 COC1=CN=NC=C1 M41023 [2,0,0,0,0,0|2,0,0]=4 398 B8R1.2 COC1=NC=CC=C1 M39277 [2,0,0,0,0,0|1,0,0]=3 399 B8R1.2 COC1=NC=CN=C1 M2768 [2,0,0,0,0,0|2,0,0]=4 400 B8R1.2 COC1=NN=CC=C1 M41021 [2,0,0,0,0,0|2,0,0]=4 401 B8R1.2 ClCC1=CC=NC=C1 C68845 [2,0,0,0,0,0|2,0,0]=4 402 B8R1.2 ClCC1=NC=CC=C1 C67870 [2,0,0,0,0,0|2,0,0]=4 403 B8R1.2 NCC1=CC=CN=C1 A69257 [2,0,0,0,0,0|2,0,0]=4 404 B8R1.2 NCC1=CC=NC=C1 P67743 [2,0,0,0,0,0|2,0,0]=4 405 B8R1.2 NNC1=CC=CC=C1 P68696 [2,0,0,0,0,0|2,0,0]=4 406 B8R1.2 NOC1=CC=CC=C1 P43533 [2,0,0,0,0,0|1,0,0]=3 407 B8R1.2 OCC1=CC=NC=C1 P43429 [2,0,0,0,0,0|1,0,0]=3 408 B8R1.2 OCC1=CC=NC=C1 P67894 [2,0,0,0,0,0|1,0,0]=3 409 B8R1.2 OCC1=CN=CC=C1 P15946 [2,0,0,0,0,0|1,0,0]=3 410 B8R1.2 OCC1=CN=CN=C1 P0145 [2,0,0,0,0,0|2,0,0]=4 411 B8R1.2 OCC1=NC=CC=C1 P69303 [2,0,0,0,0,0|1,0,0]=3 412 B8R1.2 OCC1=NC=CC=N1 P0151 [2,0,0,0,0,0|2,0,0]=4 413 B8R1.2 OCC1=NC=CN=C1 P0147 [2,0,0,0,0,0|2,0,0]=4 414 B8R1.2 OCC1=NC=NC=C1 P0160 [2,0,0,0,0,0|2,0,0]=4 415 B8R1.2 OCC1=NN=CC=C1 P0155 [2,0,0,0,0,0|2,0,0]=4 416 B8R1.2 ONC1=CC=CC=C1 P67873 [2,0,0,0,0,0|1,0,0]=3 417 B8R1.3 BrC1=CC=C(I)C=C1 B39232 [2,0,0,0,0,0|2,0,0]=4 418 B8R1.3 CC1=CC=C(C)N=N1 D43182 [2,0,0,0,0,0|2,0,0]=4 419 B8R1.3 CC1=CC=C(I)C=C1 K68149 [2,0,0,0,0,0|1,0,0]=3 420 B8R1.3 CC1=CC=C([Mg+])C=C1 M31731 [2,0,0,0,0,0|1,0,0]=3 421 B8R1.3 CC1=CN=C(Br)C=C1 B4672 [2,0,0,0,0,0|2,0,0]=4 422 B8R1.3 CC1=CN=C(Cl)C=C1 C21968 [2,0,0,0,0,0|2,0,0]=4 423 B8R1.3 CC1=CN=C(F)C=C1 F22553 [2,0,0,0,0,0|2,0,0]=4 424 B8R1.3 CC1=CN=C(N)C=C1 M20542 [2,0,0,0,0,0|2,0,0]=4 425 B8R1.3 CC1=CN=C(O)C=C1 M63706 [2,0,0,0,0,0|1,0,0]=3 426 B8R1.3 CC1=CNC(=O)C=C1 M68372 [2,0,0,0,0,0|1,0,1]=4 427 B8R1.3 CC1=NC=C(Br)C=C1 B5402 [2,0,0,0,0,0|2,0,0]=4 428 B8R1.3 CC1=NC=C(Cl)C=C1 C42845 [2,0,0,0,0,0|2,0,0]=4 429 B8R1.3 CC1=NC=C(F)C=C1 F1117 [2,0,0,0,0,0|2,0,0]=4 430 B8R1.3 CC1=NC=C(I)C=C1 I36966 [2,0,0,0,0,0|2,0,0]=4 431 B8R1.3 CC1=NC=C(N)C=C1 A1121 [2,0,0,0,0,0|2,0,0]=4 432 B8R1.3 CC1=NC=C(O)C=C1 H4553 [2,0,0,0,0,0|1,0,0]=3 433 B8R1.3 CC1=NC=C(O)C=N1 M23235 [2,0,0,0,0,0|2,0,0]=4 434 B8R1.3 ClC1=CC=C(I)C=C1 C67848 [2,0,0,0,0,0|2,0,0]=4 435 B8R1.3 FC1=CC=C(Br)C=C1 B39231 [2,0,0,0,0,0|2,0,0]=4 436 B8R1.3 FC1=CC=C(I)C=C1 F39236 [2,0,0,0,0,0|2,0,0]=4 437 B8R1.3 FC1=CC=C(S)C=C1 F42373 [2,0,0,0,0,0|1,1,0]=4 438 B8R1.3 FC1=CC=C([Mg+])C=C1 F31733 [2,0,0,0,0,0|2,0,0]=4 439 B8R1.3 IC1=CC=C(I)C=C1 D39237 [2,0,0,0,0,0|2,0,0]=4 440 B8R1.3 NC1=CC=C(I)C=C1 K68110 [2,0,0,0,0,0|2,0,0]=4 441 B8R1.3 O=C1C=CC(O)=CN1 H67757 [2,0,0,0,0,0|1,0,1]=4 442 B8R1.3 OC1=CC=C(F)C=C1 F68080 [2,0,0,0,0,0|1,0,0]=3 443 B8R1.3 OC1=CN=C(Br)C=C1 B0344 [2,0,0,0,0,0|2,0,0]=4 444 B8R1.3 OC1=CN=C(Cl)C=C1 C4788 [2,0,0,0,0,0|2,0,0]=4 445 B8R1.3 OC1=CN=C(F)C=C1 F5147 [2,0,0,0,0,0|2,0,0]=4 446 B8R1.3 OC1=NC=C(Br)C=C1 B39171 [2,0,0,0,0,0|2,0,0]=4 447 B8R1.3 OC1=NC=C(Br)C=C1 B39172 [2,0,0,0,0,0|2,0,0]=4 448 B8R1.3 OC1=NC=C(F)C=C1 F36674 [2,0,0,0,0,0|2,0,0]=4 449 B8R1.3 OC1=NC=C(I)C=C1 K40858 [2,0,0,0,0,0|2,0,0]=4 450 B8R1.3 SC1=CC=C(Br)C=C1 B60845 [2,0,0,0,0,0|1,1,0]=4 451 B8R1.3 SC1=CC=C(S)C=C1 B63577 [2,0,0,0,0,0|0,2,0]=4 452 B8R1.3 [Mg+]C1=CC=C(Cl)C=C1 C31752 [2,0,0,0,0,0|2,0,0]=4 453 B10R1.1 CC1=CC=C(CC#N)C=C1 M39574 [1,1,0,0,0,0|1,0,0]=3 454 B10R1.1 CC1=CC=C(CCBr)C=C1 B0463 [1,1,0,0,0,0|1,0,0]=3 455 B10R1.1 CC1=CC=C(CCO)C=C1 T50265 [1,1,0,0,0,0|0,0,0]=2 456 B10R1.1 CC1=CC=C(CC[Mg+])C=C1 M31724 [1,1,0,0,0,0|1,0,0]=3 457 B10R1.1 CC1=CC=C(CNN)C=C1 M49662 [1,1,0,0,0,0|1,0,0]=3 458 B10R1.1 CC1=CN=C(CC#N)C=C1 M48792 [1,1,0,0,0,0|2,0,0]=4 459 B10R1.1 CC1=NC=C(CCO)C=C1 M15913 [1,1,0,0,0,0|1,0,0]=3 460 B10R1.1 CCCC1=CC=C(Br)C=C1 B39542 [1,1,0,0,0,0|2,0,0]=4 461 B10R1.1 CCCC1=CC=C(N)C=C1 P68566 [1,1,0,0,0,0|2,0,0]=4 462 B10R1.1 CCCC1=CC=C([Mg+])C=C1 P31760 [1,1,0,0,0,0|2,0,0]=4 463 B10R1.1 CCNC1=CC=C(F)C=C1 E46759 [1,1,0,0,0,0|2,0,0]=4 464 B10R1.1 CCOC1=CC=C(I)C=C1 E49468 [1,1,0,0,0,0|1,0,0]=3 465 B10R1.1 CCOC1=CC=C(O)C=C1 E68898 [1,1,0,0,0,0|0,0,0]=2 466 B10R1.1 CCOC1=CC=C([Mg+])C=C1 E31767 [1,1,0,0,0,0|1,0,0]=3 467 B10R1.1 CCOC1=CN=C(Br)C=C1 B46151 [1,1,0,0,0,0|2,0,0]=4 468 B10R1.1 CCOC1=CN=C(Cl)C=C1 C46184 [1,1,0,0,0,0|2,0,0]=4 469 B10R1.1 CCOC1=CN=C(N)C=C1 E43625 [1,1,0,0,0,0|2,0,0]=4 470 B10R1.1 CCOC1=NC=C(Br)C=C1 B4568 [1,1,0,0,0,0|2,0,0]=4 471 B10R1.1 CCOC1=NC=C(I)C=C1 E46226 [1,1,0,0,0,0|2,0,0]=4 472 B10R1.1 CCSC1=CC=C([Mg+])C=C1 E31791 [1,1,0,0,0,0|1,1,0]=4 473 B10R1.1 CNCC1=CC=C(Br)C=C1 B46738 [1,1,0,0,0,0|2,0,0]=4 474 B10R1.1 CNCC1=CC=C(Br)C=C1 M46740 [1,1,0,0,0,0|2,0,0]=4 475 B10R1.1 CNCC1=CC=C(C)C=C1 M50315 [1,1,0,0,0,0|1,0,0]=3 476 B10R1.1 CNCC1=CC=C(C)C=C1 M52163 [1,1,0,0,0,0|1,0,0]=3 477 B10R1.1 CNCC1=CC=C(Cl)C=C1 C46755 [1,1,0,0,0,0|2,0,0]=4 478 B10R1.1 CNCC1=CC=C(Cl)C=C1 M46757 [1,1,0,0,0,0|2,0,0]=4 479 B10R1.1 COCC1=CC=C(N)C=C1 M46895 [1,1,0,0,0,0|1,0,0]=3 480 B10R1.1 ClC1=CC=C(CCBr)C=C1 B48760 [1,1,0,0,0,0|2,0,0]=4 481 B10R1.1 FC1=CC=C(CCBr)C=C1 B13769 [1,1,0,0,0,0|2,0,0]=4 482 B10R1.1 FC1=CC=C(CC[Mg+])C=C1 F31725 [1,1,0,0,0,0|2,0,0]=4 483 B10R1.1 N#CCC1=CC=C(Cl)C=C1 C69078 [1,1,0,0,0,0|2,0,0]=4 484 B10R1.1 N#CCC1=CC=C(I)C=C1 K47988 [1,1,0,0,0,0|2,0,0]=4 485 B10R1.1 N#CCC1=CC=C(N)C=C1 A67449 [1,1,0,0,0,0|2,0,0]=4 486 B10R1.1 N#CCC1=CC=C(O)C=C1 H68900 [1,1,0,0,0,0|1,0,0]=3 487 B10R1.1 NCCC1=CC=C(Cl)C=C1 C67656 [1,1,0,0,0,0|2,0,0]=4 488 B10R1.1 NCCC1=CC=C(F)C=C1 F69101 [1,1,0,0,0,0|2,0,0]=4 489 B10R1.1 NNCC1=CC=C(Br)C=C1 B0093 [1,1,0,0,0,0|2,0,0]=4 490 B10R1.1 NNCC1=CC=C(Br)C=C1 B12215 [1,1,0,0,0,0|2,0,0]=4 491 B10R1.1 NNCC1=CC=C(Cl)C=C1 C0094 [1,1,0,0,0,0|2,0,0]=4 492 B10R1.1 NNCC1=CC=C(Cl)C=C1 C10206 [1,1,0,0,0,0|2,0,0]=4 493 B10R1.1 NNCC1=CC=C(F)C=C1 F0090 [1,1,0,0,0,0|2,0,0]=4 494 B10R1.1 NOCC1=CC=C(Cl)C=C1 C64524 [1,1,0,0,0,0|1,0,0]=3 495 B10R1.1 NOCC1=CC=C(F)C=C1 F46562 [1,1,0,0,0,0|1,0,0]=3 496 B10R1.1 O=CCC1=CC=C(Br)C=C1 B48709 [1,1,0,0,0,0|1,0,1]=4 497 B10R1.1 O=CCC1=CC=C(Cl)C=C1 C48725 [1,1,0,0,0,0|1,0,1]=4 498 B10R1.1 OC1=CC=C(CCBr)C=C1 B49426 [1,1,0,0,0,0|1,0,0]=3 499 B10R1.1 OCCC1=CC=C(Br)C=C1 B36776 [1,1,0,0,0,0|1,0,0]=3 500 B10R1.1 OCCC1=CC=C(Cl)C=C1 C39522 [1,1,0,0,0,0|1,0,0]=3 501 B10R1.1 OCCC1=CC=C(F)C=C1 F49459 [1,1,0,0,0,0|1,0,0]=3 502 B10R1.1 OCCC1=CC=C(I)C=C1 K49469 [1,1,0,0,0,0|1,0,0]=3 503 B10R1.1 OCCC1=CN=C(Cl)C=C1 C37718 [1,1,0,0,0,0|2,0,0]=4 504 B10R1.1 OCCC1=NC=C(Br)C=C1 B7705 [1,1,0,0,0,0|2,0,0]=4 505 B10R1.1 ON=CC1=CC=C(O)C=C1 H45817 [1,1,0,0,0,0|0,0,1]=3 506 B10R1.1 O\N=C\C1=CC=C(F)C=C1 F64667 [1,1,0,0,0,0|1,0,1]=4 507 B10R1.1 [Mg+]CCC1=CC=C(Cl)C=C1 C31726 [1,1,0,0,0,0|2,0,0]=4 508 B10R1.13 C=C(C)C1=CC=C(F)C=C1 F51670 [1,1,0,0,0,0|2,0,0]=4 509 B10R1.13 C=C(C)C1=CC=C(O)C=C1 P49877 [1,1,0,0,0,0|1,0,0]=3 510 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [1,1,0,0,0,0|1,0,0]=3 511 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C68865 [1,1,0,0,0,0|2,0,0]=4 512 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [1,1,0,0,0,0|2,0,0]=4 513 B10R1.13 CC(=O)C1=CC=C(I)C=C1 K39500 [1,1,0,0,0,0|2,0,0]=4 514 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A68181 [1,1,0,0,0,0|2,0,0]=4 515 B10R1.13 CC(=O)C1=CC=C(O)C=C1 H64899 [1,1,0,0,0,0|1,0,0]=3 516 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [1,1,0,0,0,0|2,0,0]=4 517 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [1,1,0,0,0,0|2,0,0]=4 518 B10R1.13 CC(=O)C1=NC=C(O)C=C1 H45820 [1,1,0,0,0,0|2,0,0]=4 519 B10R1.13 CC(C)C1=CC=C(Br)C=C1 B49963 [1,1,0,0,0,0|2,0,0]=4 520 B10R1.13 CC(C)C1=CC=C(N)C=C1 P69319 [1,1,0,0,0,0|2,0,0]=4 521 B10R1.13 CC(C)C1=CC=C(O)C=C1 P60863 [1,1,0,0,0,0|1,0,0]=3 522 B10R1.13 CC(C)C1=CC=C([Mg+])C=C1 P31759 [1,1,0,0,0,0|2,0,0]=4 523 B10R1.13 CC1=CC=C(B(O)O)C=C1 T5215 [1,1,0,0,0,0|1,0,0]=3 524 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M38078 [1,1,0,0,0,0|1,0,1]=4 525 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [1,1,0,0,0,0|0,0,1]=3 526 B10R1.13 CC1=CC=C(C(C)C)C=C1 D60786 [1,1,0,0,0,0|1,0,0]=3 527 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [1,1,0,0,0,0|0,0,2]=4 528 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T52161 [1,1,0,0,0,0|1,0,0]=3 529 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T60511 [1,1,0,0,0,0|1,0,0]=3 530 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 T50271 [1,1,0,0,0,0|0,0,0]=2 531 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 S38423 [1,1,0,0,0,0|1,0,1]=4 532 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [1,1,0,0,0,0|0,1,0]=3 533 B10R1.13 CC1=CC=C([S@](N)=O)C=C1 M36646 [1,1,0,0,0,0|1,0,1]=4 534 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M23707 [1,1,0,0,0,0|1,0,1]=4 535 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M46550 [1,1,0,0,0,0|1,0,1]=4 536 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 M49667 [1,1,0,0,0,0|2,0,0]=4 537 B10R1.13 CC1=NC=C(B(O)O)C=C1 M24773 [1,1,0,0,0,0|2,0,0]=4 538 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [1,1,0,0,0,0|1,0,1]=4 539 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 H64312 [1,1,0,0,0,0|1,0,0]=3 540 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 C46751 [1,1,0,0,0,0|2,0,0]=4 541 B10R1.13 CN(C)C1=CC=C(I)C=C1 K46770 [1,1,0,0,0,0|2,0,0]=4 542 B10R1.13 CN(C)C1=CC=C([Mg+])C=C1 D31762 [1,1,0,0,0,0|2,0,0]=4 543 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 B38580 [1,1,0,0,0,0|2,0,0]=4 544 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 C64533 [1,1,0,0,0,0|2,0,0]=4 545 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F46766 [1,1,0,0,0,0|2,0,0]=4 546 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F49509 [1,1,0,0,0,0|2,0,0]=4 547 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 B49428 [1,1,0,0,0,0|1,0,0]=3 548 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 C49454 [1,1,0,0,0,0|1,0,0]=3 549 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 F49461 [1,1,0,0,0,0|1,0,0]=3 550 B10R1.13 C[C@H](Br)C1=CC=C(F)C=C1 B36983 [1,1,0,0,0,0|2,0,0]=4 551 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46724 [1,1,0,0,0,0|2,0,0]=4 552 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46735 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B65383 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F36974 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F64415 [1,1,0,0,0,0|2,0,0]=4 556 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46768 [1,1,0,0,0,0|2,0,0]=4 557 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46771 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 A46957 [1,1,0,0,0,0|2,0,0]=4 559 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 B49431 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49442 [1,1,0,0,0,0|1,0,0]=3 561 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49449 [1,1,0,0,0,0|1,0,0]=3 562 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 F49463 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 H46826 [1,1,0,0,0,0|0,0,0]=2 564 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 B63199 [1,1,0,0,0,0|1,1,0]=4 565 B10R1.13 FC(F)C1=CC=C(Cl)C=C1 C44732 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.13 FC(F)C1=CC=C(I)C=C1 D44733 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.13 N=C(N)C1=CC=C(O)C=C1 H46554 [1,1,0,0,0,0|1,0,1]=4 568 B10R1.13 NC(=S)C1=CC=C(O)C=C1 H39401 [1,1,0,0,0,0|0,1,1]=4 569 B10R1.13 NC1=CC=C(B(O)O)C=C1 A1420 [1,1,0,0,0,0|2,0,0]=4 570 B10R1.13 NC1=CC=C(C(F)F)C=C1 D46546 [1,1,0,0,0,0|2,0,0]=4 571 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 C67273 [1,1,0,0,0,0|1,0,1]=4 572 B10R1.13 O=C(O)C1=CC=C(I)C=C1 K39365 [1,1,0,0,0,0|1,0,1]=4 573 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M69070 [1,1,0,0,0,0|0,1,1]=4 574 B10R1.13 O=C(O)C1=NC=C(O)C=C1 H8151 [1,1,0,0,0,0|1,0,1]=4 575 B10R1.13 O=[S@](O)C1=CC=C(Br)C=C1 B42696 [1,1,0,0,0,0|2,0,0]=4 576 B10R1.13 OB(O)C1=CC=C(Br)C=C1 B1940 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 C2280 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.13 OB(O)C1=CC=C(F)C=C1 F3380 [1,1,0,0,0,0|2,0,0]=4 579 B10R1.13 OB(O)C1=CN=C(O)C=C1 H26341 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.13 OC1=CN=C(C(F)F)C=C1 D43514 [1,1,0,0,0,0|2,0,0]=4 581 B10R1.25 BrCC1=C(I)C=C(Br)C=C1 B44700 [1,1,0,0,0,0|2,0,0]=4 582 B10R1.25 CC1=C(C#N)C=CC(O)=C1 H48449 [1,1,0,0,0,0|1,0,1]=4 583 B10R1.25 CC1=C(C=O)C=CC(O)=C1 H49073 [1,1,0,0,0,0|0,0,2]=4 584 B10R1.25 CC1=C(CBr)C=CC(Br)=C1 B48758 [1,1,0,0,0,0|2,0,0]=4 585 B10R1.25 CC1=C(CF)C=CC(Br)=C1 B48770 [1,1,0,0,0,0|2,0,0]=4 586 B10R1.25 CC1=C(CN)C=CC(Br)=C1 B46736 [1,1,0,0,0,0|2,0,0]=4 587 B10R1.25 CC1=C(CN)C=CC(Br)=C1 B46744 [1,1,0,0,0,0|2,0,0]=4 588 B10R1.25 CC1=C(CO)C=CC(Br)=C1 B61046 [1,1,0,0,0,0|1,0,0]=3 589 B10R1.25 CC1=C(CO)C=CC(F)=N1 F46222 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.25 CC1=C(CO)C=CC(N)=C1 A39080 [1,1,0,0,0,0|1,0,0]=3 591 B10R1.25 CC1=CC(Br)=C(C#N)C=C1 B47945 [1,1,0,0,0,0|1,0,1]=4 592 B10R1.25 CC1=CC(Br)=C(C=O)C=C1 B48711 [1,1,0,0,0,0|0,0,2]=4 593 B10R1.25 CC1=CC(C)=C(C=O)C=C1 D49874 [1,1,0,0,0,0|0,0,2]=4 594 B10R1.25 CC1=CC(C)=C(CBr)C=C1 B49966 [1,1,0,0,0,0|1,0,0]=3 595 B10R1.25 CC1=CC(C)=C(CO)C=C1 D50273 [1,1,0,0,0,0|0,0,0]=2 596 B10R1.25 CC1=CC(C)=C(NN)C=C1 D49534 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.25 CC1=CC(Cl)=C(C#N)C=C1 C47960 [1,1,0,0,0,0|1,0,1]=4 598 B10R1.25 CC1=CC(Cl)=C(C=O)C=C1 C48726 [1,1,0,0,0,0|0,0,2]=4 599 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 C46753 [1,1,0,0,0,0|1,0,0]=3 600 B10R1.25 CC1=CC(F)=C(C#N)C=C1 F47972 [1,1,0,0,0,0|1,0,1]=4 601 B10R1.25 CC1=CC(F)=C(C=O)C=C1 F48737 [1,1,0,0,0,0|0,0,2]=4 602 B10R1.25 CC1=CC(N)=C(C#N)C=C1 A48781 [1,1,0,0,0,0|1,0,1]=4 603 B10R1.25 CC1=CC(N)=C(CO)C=C1 A46913 [1,1,0,0,0,0|0,0,0]=2 604 B10R1.25 CC1=CC(N)=C(CO)C=N1 A43644 [1,1,0,0,0,0|1,0,0]=3 605 B10R1.25 CC1=CC(O)=C(C#N)C=C1 H48444 [1,1,0,0,0,0|1,0,1]=4 606 B10R1.25 CC1=CC(O)=C(C=O)C=C1 H38560 [1,1,0,0,0,0|0,0,2]=4 607 B10R1.25 CC1=CC=C(CBr)C(Br)=N1 B45763 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.25 CC1=CN=C(CCl)C(C)=C1 C38639 [1,1,0,0,0,0|2,0,0]=4 609 B10R1.25 CC1=CN=C(CO)C(C)=C1 D46914 [1,1,0,0,0,0|1,0,0]=3 610 B10R1.25 CC1=NC(=O)C(CO)=CN1 H43232 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.25 CC1=NC(C)=C(CO)C=C1 D64003 [1,1,0,0,0,0|1,0,0]=3 612 B10R1.25 CC1=NC(N)=C(CO)C=N1 A67768 [1,1,0,0,0,0|2,0,0]=4 613 B10R1.25 CCC1=C(Cl)C=C(N)C=C1 C46746 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.25 CCC1=C(F)C=C(O)C=C1 E65621 [1,1,0,0,0,0|1,0,0]=3 615 B10R1.25 CCC1=C(N)C=C(Br)C=C1 B46721 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.25 CCC1=C(N)C=C(Cl)C=C1 C46745 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.25 CNC1=C(Br)C=C(C)C=C1 B46730 [1,1,0,0,0,0|1,0,0]=3 618 B10R1.25 CNC1=C(N)C=C(Br)C=C1 B46287 [1,1,0,0,0,0|2,0,0]=4 619 B10R1.25 CNC1=C(N)C=C(Cl)C=C1 C46303 [1,1,0,0,0,0|2,0,0]=4 620 B10R1.25 COC1=C(Br)C=C(Br)C=N1 D42633 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.25 COC1=C(Br)C=C(C)C=N1 B46168 [1,1,0,0,0,0|1,0,0]=3 622 B10R1.25 COC1=C(Br)C=C(Cl)C=C1 B39392 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.25 COC1=C(Br)C=C(Cl)C=N1 B16110 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.25 COC1=C(Br)C=C(Cl)N=C1 B42645 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.25 COC1=C(Br)C=C(F)C=C1 B39393 [1,1,0,0,0,0|1,0,0]=3 626 B10R1.25 COC1=C(Br)C=C(F)C=N1 B42652 [1,1,0,0,0,0|2,0,0]=4 627 B10R1.25 COC1=C(Br)C=C(F)N=C1 B37314 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.25 COC1=C(Br)C=C(I)C=C1 B45584 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.25 COC1=C(Br)C=C(N)C=C1 B46154 [1,1,0,0,0,0|1,0,0]=3 630 B10R1.25 COC1=C(Br)C=C(N)C=N1 B43055 [1,1,0,0,0,0|2,0,0]=4 631 B10R1.25 COC1=C(Br)C=C(O)C=C1 B45899 [1,1,0,0,0,0|0,0,0]=2 632 B10R1.25 COC1=C(Br)C=C(O)C=N1 B42852 [1,1,0,0,0,0|1,0,0]=3 633 B10R1.25 COC1=C(Br)N=C(I)C=C1 B36842 [1,1,0,0,0,0|2,0,0]=4 634 B10R1.25 COC1=C(C)C=C(Br)C=C1 B49440 [1,1,0,0,0,0|1,0,0]=3 635 B10R1.25 COC1=C(C)C=C(C)C=C1 D50266 [1,1,0,0,0,0|0,0,0]=2 636 B10R1.25 COC1=C(C)C=C(F)C=C1 F49467 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.25 COC1=C(C)C=C(I)C=C1 K49474 [1,1,0,0,0,0|1,0,0]=3 638 B10R1.25 COC1=C(C)C=C(N)C=C1 M46909 [1,1,0,0,0,0|1,0,0]=3 639 B10R1.25 COC1=C(C)C=C(O)C=C1 M38275 [1,1,0,0,0,0|0,0,0]=2 640 B10R1.25 COC1=C(C)C=C([Mg+])C=C1 M31769 [1,1,0,0,0,0|1,0,0]=3 641 B10R1.25 COC1=C(C)N=C(Br)C=C1 B46175 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.25 COC1=C(Cl)C=C(Br)C=C1 B45564 [1,1,0,0,0,0|1,0,0]=3 643 B10R1.25 COC1=C(Cl)C=C(C)C=N1 C46202 [1,1,0,0,0,0|1,0,0]=3 644 B10R1.25 COC1=C(Cl)C=C(N)C=N1 C43070 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.25 COC1=C(Cl)C=C(N)N=C1 C10605 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.25 COC1=C(F)C=C(Br)C=C1 B13752 [1,1,0,0,0,0|1,0,0]=3 647 B10R1.25 COC1=C(F)C=C(I)C=C1 F45610 [1,1,0,0,0,0|1,0,0]=3 648 B10R1.25 COC1=C(F)C=C(N)C=C1 F38501 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.25 COC1=C(F)C=C(N)C=N1 A43085 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.25 COC1=C(F)C=C(O)C=C1 F23734 [1,1,0,0,0,0|0,0,0]=2 651 B10R1.25 COC1=C(F)C=C([Mg+])C=C1 F31773 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.25 COC1=C(I)C=C(Br)C=C1 B38589 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.25 COC1=C(I)C=C(Br)C=N1 B42657 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.25 COC1=C(I)C=C(C)C=C1 K62337 [1,1,0,0,0,0|0,0,0]=2 655 B10R1.25 COC1=C(I)C=C(Cl)C=C1 C45602 [1,1,0,0,0,0|1,0,0]=3 656 B10R1.25 COC1=C(I)C=C(N)C=C1 K46229 [1,1,0,0,0,0|1,0,0]=3 657 B10R1.25 COC1=C(I)C=C(N)C=C1 K46231 [1,1,0,0,0,0|1,0,0]=3 658 B10R1.25 COC1=C(N)C=C(Br)C=C1 B46157 [1,1,0,0,0,0|1,0,0]=3 659 B10R1.25 COC1=C(N)C=C(F)C=C1 F46211 [1,1,0,0,0,0|1,0,0]=3 660 B10R1.25 COC1=C(N)C=C(I)C=C1 A46224 [1,1,0,0,0,0|1,0,0]=3 661 B10R1.25 COC1=C(N)N=C(Br)C=C1 B36893 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.25 COC1=C(N)N=C(F)C=C1 F43084 [1,1,0,0,0,0|2,0,0]=4 663 B10R1.25 COC1=C(O)C=C(Br)C=C1 B37821 [1,1,0,0,0,0|1,0,0]=3 664 B10R1.25 COC1=C(O)C=C(F)C=C1 F45919 [1,1,0,0,0,0|1,0,0]=3 665 B10R1.25 COC1=C(O)C=C(N)C=C1 A46397 [1,1,0,0,0,0|1,0,0]=3 666 B10R1.25 COC1=C(O)C=C(O)C=C1 M61053 [1,1,0,0,0,0|0,0,0]=2 667 B10R1.25 COC1=C(O)N=C(O)N=C1 D41043 [1,1,0,0,0,0|2,0,0]=4 668 B10R1.25 COC1=C([Mg+])C=C(C)C=C1 M31765 [1,1,0,0,0,0|0,0,0]=2 669 B10R1.25 COC1=C([Mg+])C=C(Cl)C=C1 C31793 [1,1,0,0,0,0|1,0,0]=3 670 B10R1.25 COC1=C([Mg+])C=C(F)C=C1 F31774 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.25 COC1=CC=C(Br)N=C1Br D42631 [1,1,0,0,0,0|2,0,0]=4 672 B10R1.25 COC1=CC=C(C)N=C1Br B3731 [1,1,0,0,0,0|1,0,0]=3 673 B10R1.25 COC1=CC=C(C)N=C1Cl C46200 [1,1,0,0,0,0|1,0,0]=3 674 B10R1.25 COC1=CC=C(Cl)N=C1Br B42641 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.25 COC1=CC=C(N)N=C1Cl C10744 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.25 COC1=CN=C(Br)C=C1N B62821 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.25 COC1=CN=C(Cl)C=C1N C43069 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.25 COC1=NC=C(Br)C=C1C B46172 [1,1,0,0,0,0|2,0,0]=4 679 B10R1.25 COC1=NC=C(Br)C=C1Cl B42648 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.25 COC1=NC=C(Br)C=C1F B42654 [1,1,0,0,0,0|2,0,0]=4 681 B10R1.25 COC1=NC=C(Br)C=C1N B7645 [1,1,0,0,0,0|2,0,0]=4 682 B10R1.25 COC1=NC=C(Br)C=C1O B10651 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.25 COC1=NC=C(Cl)C=C1F C69055 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.25 COC1=NC=C(F)C=C1C F46221 [1,1,0,0,0,0|2,0,0]=4 685 B10R1.25 COC1=NC=C(F)C=C1N F37439 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.25 COC1=NC=C(N)C=C1C M43642 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.25 ClC1=C(CBr)C=CC(Br)=C1 B44691 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.25 ClC1=CC(Cl)=C(CBr)C=C1 B38059 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.25 FC1=C(CBr)C=CC(Br)=C1 B39350 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.25 FC1=CC(Br)=C(CBr)C=C1 B44692 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.25 FC1=CC(Cl)=C(CBr)C=C1 B44714 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.25 FC1=CC(F)=C(CBr)C=C1 B44724 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.25 N#CC1=C(Cl)C=C(O)C=C1 C38503 [1,1,0,0,0,0|1,0,1]=4 694 B10R1.25 N#CC1=C(F)C=C(O)C=C1 F39332 [1,1,0,0,0,0|1,0,1]=4 695 B10R1.25 N#CC1=C(O)C=C(O)C=C1 D24706 [1,1,0,0,0,0|1,0,1]=4 696 B10R1.25 NC1=C(CO)C=CC(Br)=C1 A46164 [1,1,0,0,0,0|1,0,0]=3 697 B10R1.25 NC1=C(CO)C=CC(Cl)=C1 A46195 [1,1,0,0,0,0|1,0,0]=3 698 B10R1.25 NC1=CC(Br)=CN=C1CO A12038 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.25 NC1=CC(Cl)=CN=C1CO A59939 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.25 NC1=CC(Cl)=NC=C1CO A25618 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.25 NCC1=C(Br)C=C(Cl)C=C1 B45767 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 D45792 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.25 NCC1=C(Cl)C=C(F)C=C1 C68851 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.25 NCC1=C(F)C=C(Br)C=C1 B45781 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.25 NCC1=C(F)C=C(Cl)C=C1 C63109 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.25 NCC1=C(F)C=C(F)C=C1 D38872 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.25 NCC1=C(O)C=C(Br)C=C1 A46159 [1,1,0,0,0,0|2,0,0]=4 708 B10R1.25 O=CC1=C(Br)C=C(O)C=C1 B37795 [1,1,0,0,0,0|0,0,2]=4 709 B10R1.25 O=CC1=C(Cl)C=C(O)C=C1 C45089 [1,1,0,0,0,0|0,0,2]=4 710 B10R1.25 O=CC1=C(F)C=C(O)C=C1 F45098 [1,1,0,0,0,0|0,0,2]=4 711 B10R1.25 O=CC1=C(I)C=C(O)C=C1 H69541 [1,1,0,0,0,0|0,0,2]=4 712 B10R1.25 O=CC1=C(O)C=C(O)C=C1 D67877 [1,1,0,0,0,0|0,0,2]=4 713 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 D45544 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.25 OCC1=C(Br)C=C(Cl)C=N1 B17743 [1,1,0,0,0,0|2,0,0]=4 715 B10R1.25 OCC1=C(Br)C=C(F)C=C1 B45567 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.25 OCC1=C(Br)C=C(O)C=C1 B45904 [1,1,0,0,0,0|0,0,0]=2 717 B10R1.25 OCC1=C(Cl)C=C(Cl)C=C1 D63315 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.25 OCC1=C(Cl)C=C(Cl)C=N1 D6829 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.25 OCC1=C(Cl)C=C(F)C=C1 C45594 [1,1,0,0,0,0|1,0,0]=3 720 B10R1.25 OCC1=C(F)C=C(Br)C=C1 B61349 [1,1,0,0,0,0|1,0,0]=3 721 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 C45596 [1,1,0,0,0,0|1,0,0]=3 722 B10R1.25 OCC1=C(F)C=C(F)C=C1 D45607 [1,1,0,0,0,0|1,0,0]=3 723 B10R1.25 OCC1=C(F)C=C(O)C=C1 F38990 [1,1,0,0,0,0|0,0,0]=2 724 B10R1.25 OCC1=C(O)C=C(Br)C=C1 B38232 [1,1,0,0,0,0|1,0,0]=3 725 B10R1.25 OCC1=CC=C(Br)N=C1Br D42635 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.25 OCC1=CC=C(Cl)N=C1Cl D0718 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.25 OCC1=CN=C(Cl)C=C1Cl D42662 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.25 OCC1=NC=C(Br)C=C1Cl B42651 [1,1,0,0,0,0|2,0,0]=4 729 B10R1.25 OCC1=NC=C(Br)C=C1F B0544 [1,1,0,0,0,0|2,0,0]=4 730 B10R1.25 OCC1=NC=C(Cl)C=C1F C13727 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.176 BrCC1=CC(Br)=C(Br)C=C1 D44703 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.176 CC1=C(Br)C=C(C#N)C=C1 B39465 [1,1,0,0,0,0|1,0,1]=4 733 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 B48714 [1,1,0,0,0,0|0,0,2]=4 734 B10R1.176 CC1=C(Br)C=C(CBr)C=C1 B38347 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.176 CC1=C(Br)C=C(CO)C=C1 B49432 [1,1,0,0,0,0|0,0,0]=2 736 B10R1.176 CC1=C(Br)C=CC(CBr)=C1 B48757 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.176 CC1=C(Br)C=CC(CO)=C1 B49433 [1,1,0,0,0,0|1,0,0]=3 738 B10R1.176 CC1=C(Br)C=NC(CO)=C1 B46178 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.176 CC1=C(C)C=C(C#N)C=C1 D51674 [1,1,0,0,0,0|1,0,1]=4 740 B10R1.176 CC1=C(C)C=C(CCl)C=C1 C49971 [1,1,0,0,0,0|1,0,0]=3 741 B10R1.176 CC1=C(C)C=C(CO)C=C1 D50275 [1,1,0,0,0,0|0,0,0]=2 742 B10R1.176 CC1=C(C)C=C(NN)C=C1 D39524 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.176 CC1=C(Cl)C=C(C#N)C=C1 C47963 [1,1,0,0,0,0|1,0,1]=4 744 B10R1.176 CC1=C(Cl)C=C(C=O)C=C1 C48728 [1,1,0,0,0,0|0,0,2]=4 745 B10R1.176 CC1=C(Cl)C=C(CN)C=C1 C46749 [1,1,0,0,0,0|1,0,0]=3 746 B10R1.176 CC1=C(F)C=C(C#N)C=C1 F47976 [1,1,0,0,0,0|1,0,1]=4 747 B10R1.176 CC1=C(F)C=C(CO)C=N1 F46223 [1,1,0,0,0,0|1,0,0]=3 748 B10R1.176 CC1=C(F)C=C(NN)C=C1 F46563 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.176 CC1=C(F)C=CC(CN)=C1 F46767 [1,1,0,0,0,0|2,0,0]=4 750 B10R1.176 CC1=C(I)C=C(CO)C=C1 K63324 [1,1,0,0,0,0|0,0,0]=2 751 B10R1.176 CC1=C(N)C=C(C#N)C=C1 A38450 [1,1,0,0,0,0|1,0,1]=4 752 B10R1.176 CC1=C(O)C=C(C#N)C=C1 H48447 [1,1,0,0,0,0|1,0,1]=4 753 B10R1.176 CC1=C(O)C=C(C=O)C=C1 H67820 [1,1,0,0,0,0|0,0,2]=4 754 B10R1.176 CC1=C(O)C=CC(C#N)=C1 H48450 [1,1,0,0,0,0|1,0,1]=4 755 B10R1.176 CC1=C(O)C=CC(C=O)=C1 H49074 [1,1,0,0,0,0|0,0,2]=4 756 B10R1.176 CC1=C(O)C=CC(CO)=C1 H46832 [1,1,0,0,0,0|0,0,0]=2 757 B10R1.176 CCC1=CC(Br)=C(O)C=C1 B49424 [1,1,0,0,0,0|1,0,0]=3 758 B10R1.176 CCC1=CC(C)=C(C)C=C1 E53022 [1,1,0,0,0,0|1,0,0]=3 759 B10R1.176 CCC1=CC(C)=C(I)C=C1 E49973 [1,1,0,0,0,0|2,0,0]=4 760 B10R1.176 CCC1=CC(F)=C(N)C=C1 E46758 [1,1,0,0,0,0|2,0,0]=4 761 B10R1.176 CCC1=CC(N)=C(N)C=C1 E49664 [1,1,0,0,0,0|2,0,0]=4 762 B10R1.176 CCC1=CC(O)=C(N)C=C1 A49521 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.176 CN1C=C(CO)C=CC1=O H7538 [1,1,0,0,0,0|1,0,1]=4 764 B10R1.176 CN1C=CC(CN)=CC1=O A10237 [1,1,0,0,0,0|2,0,0]=4 765 B10R1.176 CN1C=CC(CN)=CC1=O A7466 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.176 CN1C=CC(CO)=CC1=O M7545 [1,1,0,0,0,0|1,0,0]=3 767 B10R1.176 CNC1=CC(Cl)=C(Cl)C=C1 D45789 [1,1,0,0,0,0|2,0,0]=4 768 B10R1.176 COC1=CC(Br)=C(Br)C=C1 D45549 [1,1,0,0,0,0|1,0,0]=3 769 B10R1.176 COC1=CC(Br)=C(C)C=C1 B49439 [1,1,0,0,0,0|0,0,0]=2 770 B10R1.176 COC1=CC(Br)=C(C)C=N1 B37321 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.176 COC1=CC(Br)=C(C)N=C1 B13456 [1,1,0,0,0,0|1,0,0]=3 772 B10R1.176 COC1=CC(Br)=C(Cl)C=C1 B45563 [1,1,0,0,0,0|1,0,0]=3 773 B10R1.176 COC1=CC(Br)=C(Cl)C=N1 B42646 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.176 COC1=CC(Br)=C(F)C=C1 B45565 [1,1,0,0,0,0|1,0,0]=3 775 B10R1.176 COC1=CC(Br)=C(F)C=N1 B42653 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.176 COC1=CC(Br)=C(I)C=C1 B45583 [1,1,0,0,0,0|1,0,0]=3 777 B10R1.176 COC1=CC(Br)=C(N)C=C1 B38510 [1,1,0,0,0,0|1,0,0]=3 778 B10R1.176 COC1=CC(Br)=C(O)C=C1 B38008 [1,1,0,0,0,0|0,0,0]=2 779 B10R1.176 COC1=CC(C)=C(Br)C=C1 B49437 [1,1,0,0,0,0|1,0,0]=3 780 B10R1.176 COC1=CC(C)=C(Br)C=N1 B46173 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.176 COC1=CC(C)=C(F)C=C1 F49456 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.176 COC1=CC(C)=C(O)C=C1 H38045 [1,1,0,0,0,0|0,0,0]=2 783 B10R1.176 COC1=CC(C)=C([Mg+])C=C1 M31768 [1,1,0,0,0,0|1,0,0]=3 784 B10R1.176 COC1=CC(Cl)=C(Br)C=C1 B45553 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.176 COC1=CC(Cl)=C(Br)C=N1 B38791 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.176 COC1=CC(Cl)=C(C)C=C1 C49453 [1,1,0,0,0,0|0,0,0]=2 787 B10R1.176 COC1=CC(Cl)=C(Cl)C=C1 D45585 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.176 COC1=CC(Cl)=C(F)C=C1 C45600 [1,1,0,0,0,0|1,0,0]=3 789 B10R1.176 COC1=CC(Cl)=C(I)C=C1 C63668 [1,1,0,0,0,0|1,0,0]=3 790 B10R1.176 COC1=CC(Cl)=C(N)C=C1 C37946 [1,1,0,0,0,0|1,0,0]=3 791 B10R1.176 COC1=CC(Cl)=C(O)C=C1 C45910 [1,1,0,0,0,0|0,0,0]=2 792 B10R1.176 COC1=CC(F)=C(Br)C=C1 B45566 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.176 COC1=CC(F)=C(Br)C=N1 B60043 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.176 COC1=CC(F)=C(C)C=C1 F49466 [1,1,0,0,0,0|0,0,0]=2 795 B10R1.176 COC1=CC(F)=C(Cl)C=C1 C45599 [1,1,0,0,0,0|1,0,0]=3 796 B10R1.176 COC1=CC(F)=C(F)C=C1 D65181 [1,1,0,0,0,0|1,0,0]=3 797 B10R1.176 COC1=CC(F)=C(N)C=C1 F38553 [1,1,0,0,0,0|1,0,0]=3 798 B10R1.176 COC1=CC(F)=C(N)N=C1 F43081 [1,1,0,0,0,0|2,0,0]=4 799 B10R1.176 COC1=CC(I)=C(Br)C=C1 B38541 [1,1,0,0,0,0|1,0,0]=3 800 B10R1.176 COC1=CC(I)=C(Cl)C=C1 C63030 [1,1,0,0,0,0|1,0,0]=3 801 B10R1.176 COC1=CC(I)=C(Cl)C=N1 C61104 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.176 COC1=CC(I)=C(F)C=N1 F62243 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.176 COC1=CC(I)=C(N)C=C1 K46228 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.176 COC1=CC(N)=C(Br)C=C1 B46152 [1,1,0,0,0,0|1,0,0]=3 805 B10R1.176 COC1=CC(N)=C(Br)C=N1 A7726 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.176 COC1=CC(N)=C(C)C=C1 M46901 [1,1,0,0,0,0|0,0,0]=2 807 B10R1.176 COC1=CC(N)=C(Cl)C=C1 C46185 [1,1,0,0,0,0|1,0,0]=3 808 B10R1.176 COC1=CC(N)=C(F)C=C1 F36653 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.176 COC1=CC(N)=C(F)C=N1 F24390 [1,1,0,0,0,0|2,0,0]=4 810 B10R1.176 COC1=CC(N)=C(I)C=C1 I5695 [1,1,0,0,0,0|1,0,0]=3 811 B10R1.176 COC1=CC(N)=C(N)C=C1 M43632 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.176 COC1=CC(N)=C(N)C=C1 M46463 [1,1,0,0,0,0|1,0,0]=3 813 B10R1.176 COC1=CC(N)=C(O)C=C1 A46393 [1,1,0,0,0,0|0,0,0]=2 814 B10R1.176 COC1=CC(O)=C(Br)C=C1 B45898 [1,1,0,0,0,0|1,0,0]=3 815 B10R1.176 COC1=CC(O)=C(C)C=C1 M46827 [1,1,0,0,0,0|0,0,0]=2 816 B10R1.176 COC1=CC(O)=C(I)C=C1 K45922 [1,1,0,0,0,0|1,0,0]=3 817 B10R1.176 COC1=CC(O)=C(N)C=C1 A46394 [1,1,0,0,0,0|1,0,0]=3 818 B10R1.176 COC1=CC(O)=C(N)C=C1 A46576 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.176 COC1=CC=C(Br)C(Br)=N1 D42629 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.176 COC1=CC=C(Cl)C(Cl)=N1 D42661 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.176 COC1=CC=C(N)C(Br)=N1 A43056 [1,1,0,0,0,0|2,0,0]=4 822 B10R1.176 COC1=CC=C(N)C(Cl)=N1 A3832 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.176 COC1=CN=C(Br)C(N)=C1 B43053 [1,1,0,0,0,0|2,0,0]=4 824 B10R1.176 COC1=CN=C(Cl)C(C)=C1 C46201 [1,1,0,0,0,0|2,0,0]=4 825 B10R1.176 COC1=CN=C(Cl)C(N)=C1 C25045 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.176 COC1=NC(C)=C(Br)C=C1 B46158 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.176 COC1=NC(C)=C(F)C=C1 F46212 [1,1,0,0,0,0|2,0,0]=4 828 B10R1.176 COC1=NC(C)=C(N)C=C1 M46590 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.176 COC1=NC(C)=C(N)C=C1 M69566 [1,1,0,0,0,0|2,0,0]=4 830 B10R1.176 COC1=NC(Cl)=C(Br)C=C1 B42643 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.176 COC1=NC(N)=C(Br)C=C1 B38888 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.176 COC1=NC=C(C)C(N)=C1 M43637 [1,1,0,0,0,0|1,0,0]=3 833 B10R1.176 COC1=NC=C(N)C(C)=C1 M43641 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.176 COC1=NC=C(N)C(N)=C1 M43351 [1,1,0,0,0,0|2,0,0]=4 835 B10R1.176 ClC1=C(Cl)C=C(CBr)C=C1 D44705 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.176 FC1=C(Br)C=C(CBr)C=C1 B44699 [1,1,0,0,0,0|2,0,0]=4 837 B10R1.176 FC1=C(Br)C=CC(CBr)=C1 B44697 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.176 FC1=C(Cl)C=C(CBr)C=C1 B44717 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.176 FC1=C(Cl)C=C(CCl)C=C1 C44729 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.176 N#CC1=CC(Br)=C(O)C=C1 B44522 [1,1,0,0,0,0|1,0,1]=4 841 B10R1.176 N#CC1=CC(Cl)=C(O)C=C1 C22522 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.176 N#CC1=CC(F)=C(O)C=C1 F44546 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.176 N#CC1=CC(I)=C(O)C=C1 H44558 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.176 N#CC1=CC(N)=C(O)C=C1 A69485 [1,1,0,0,0,0|1,0,1]=4 845 B10R1.176 N#CC1=CC(O)=C(O)C=C1 P68087 [1,1,0,0,0,0|1,0,1]=4 846 B10R1.176 NC1=C(Br)C=C(CO)C=N1 A43064 [1,1,0,0,0,0|2,0,0]=4 847 B10R1.176 NC1=C(Br)C=CC(CO)=C1 A63987 [1,1,0,0,0,0|1,0,0]=3 848 B10R1.176 NC1=C(Br)C=NC(CO)=C1 A13425 [1,1,0,0,0,0|2,0,0]=4 849 B10R1.176 NC1=C(F)C=CC(CO)=C1 A46218 [1,1,0,0,0,0|1,0,0]=3 850 B10R1.176 NC1=C(O)C=CC(CO)=C1 A46403 [1,1,0,0,0,0|0,0,0]=2 851 B10R1.176 NCC1=CC(Cl)=C(Br)C=C1 B45768 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.176 NCC1=CC(Cl)=C(Cl)C=C1 D45785 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.176 NCC1=CC(Cl)=C(F)C=C1 C45798 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.176 NCC1=CC(F)=C(Br)C=C1 B37399 [1,1,0,0,0,0|2,0,0]=4 855 B10R1.176 NCC1=CC(F)=C(Cl)C=C1 C45803 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.176 O=CC1=CC(Br)=C(O)C=C1 B45084 [1,1,0,0,0,0|0,0,2]=4 857 B10R1.176 O=CC1=CC(Cl)=C(O)C=C1 C45092 [1,1,0,0,0,0|0,0,2]=4 858 B10R1.176 O=CC1=CC(F)=C(O)C=C1 F45101 [1,1,0,0,0,0|0,0,2]=4 859 B10R1.176 O=CC1=CC(I)=C(O)C=C1 H69424 [1,1,0,0,0,0|0,0,2]=4 860 B10R1.176 OCC1=CC(Br)=C(Cl)C=C1 B45556 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.176 OCC1=CC(Br)=C(O)C=C1 B45902 [1,1,0,0,0,0|0,0,0]=2 862 B10R1.176 OCC1=CC(Cl)=C(Cl)C=C1 D45586 [1,1,0,0,0,0|1,0,0]=3 863 B10R1.176 OCC1=CC(Cl)=C(F)C=N1 C5396 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.176 OCC1=CC(F)=C(Br)C=C1 B45570 [1,1,0,0,0,0|1,0,0]=3 865 B10R1.176 OCC1=CC(F)=C(Cl)C=C1 C45597 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.176 OCC1=CC(F)=C(F)C=C1 D45608 [1,1,0,0,0,0|1,0,0]=3 867 B10R1.176 OCC1=CC(I)=C(Cl)N=C1 C42675 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.176 OCC1=CC(O)=C(Br)C=C1 B45903 [1,1,0,0,0,0|1,0,0]=3 869 B10R1.176 OCC1=CC(O)=C(F)C=C1 F45920 [1,1,0,0,0,0|1,0,0]=3 870 B10R1.176 OCC1=CC(O)=C(I)C=C1 H45924 [1,1,0,0,0,0|1,0,0]=3 871 B10R1.176 OCC1=CN=C(Cl)C(Cl)=C1 D9504 [1,1,0,0,0,0|2,0,0]=4 872 B12R1.5 C#CC1=CC=C(C(=O)OC)C=C1 M38528 [0,2,0,0,0,0|1,0,1]=4 873 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 M52426 [0,2,0,0,0,0|1,0,1]=4 874 B12R1.5 CCC(=O)C1=CC=C(CC)C=C1 E22775 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 M50044 [0,2,0,0,0,0|0,0,2]=4 876 B12R1.5 COC(=O)C1=CC=C(C#N)C=C1 M51166 [0,2,0,0,0,0|1,0,1]=4 877 B12R1.5 COC(=O)C1=CC=C(C=O)C=C1 M37811 [0,2,0,0,0,0|0,0,2]=4 878 B12R1.5 COC(=O)C1=CC=C(CBr)C=C1 M51885 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.5 COC(=O)C1=CC=C(CCl)C=C1 M39578 [0,2,0,0,0,0|1,0,0]=3 880 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 M52110 [0,2,0,0,0,0|1,0,0]=3 881 B12R1.5 COC(=O)C1=CC=C(CN)C=C1 M64553 [0,2,0,0,0,0|1,0,0]=3 882 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 M68842 [0,2,0,0,0,0|0,0,1]=3 883 B12R1.5 COC(=O)C1=CN=C(CBr)C=C1 M18631 [0,2,0,0,0,0|2,0,0]=4 884 B12R1.5 COC(=O)C1=CN=C(CN)C=C1 M49498 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.5 COC(=O)C1=CN=C(CO)C=C1 M37990 [0,2,0,0,0,0|1,0,0]=3 886 B12R1.5 COC(=O)C1=CN=C(OC)C=C1 M6283 [0,2,0,0,0,0|1,0,1]=4 887 B12R1.5 COC(=O)C1=NC=C(CBr)C=C1 M36849 [0,2,0,0,0,0|2,0,0]=4 888 B12R1.5 COC(=O)C1=NC=C(OC)C=C1 M14343 [0,2,0,0,0,0|1,0,1]=4 889 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 B68678 [0,2,0,0,0,0|1,0,0]=3 890 B12R1.5 COC1=CC=C(C(=O)CCl)C=C1 C68948 [0,2,0,0,0,0|1,0,0]=3 891 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 A50364 [0,2,0,0,0,0|0,0,0]=2 892 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 A52181 [0,2,0,0,0,0|0,0,0]=2 893 B12R1.5 COC1=CC=C([C@@H](N)CO)C=C1 A52182 [0,2,0,0,0,0|0,0,0]=2 894 B12R1.5 COC1=CN=C(C(=N)NO)C=C1 H46346 [0,2,0,0,0,0|1,0,1]=4 895 B12R1.5 COC1=NC=C([C@@H](N)CO)C=C1 A49672 [0,2,0,0,0,0|1,0,0]=3 896 B12R1.6 CC(C)(C)C1=CC=C(CBr)C=C1 B54818 [0,2,0,0,0,0|2,0,0]=4 897 B12R1.6 CC(C)(C)C1=CC=C(CO)C=C1 B54950 [0,2,0,0,0,0|1,0,0]=3 898 B12R1.6 CNC1=CC=C(C(F)(F)F)C=C1 T11155 [0,2,0,0,0,0|2,0,0]=4 899 B12R1.6 COC1=CC=C(C(C)(C)C)C=C1 B54952 [0,2,0,0,0,0|1,0,0]=3 900 B12R1.6 COC1=CC=C(C(F)(F)F)C=C1 M48749 [0,2,0,0,0,0|1,0,0]=3 901 B12R1.6 COC1=CC=C(S(N)(=O)=O)C=C1 M46436 [0,2,0,0,0,0|1,0,1]=4 902 B12R1.6 COC1=NC=C(C(F)(F)F)C=C1 M4517 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.6 CS(=O)(=O)C1=CC=C(CBr)C=C1 B49382 [0,2,0,0,0,0|1,1,0]=4 904 B12R1.6 CS(=O)(=O)C1=CC=C(CN)C=C1 M49531 [0,2,0,0,0,0|1,1,0]=4 905 B12R1.6 CS(=O)(=O)C1=CC=C(CO)C=C1 M46852 [0,2,0,0,0,0|0,1,0]=3 906 B12R1.6 CS(=O)(=O)C1=NC=C(CO)C=C1 M46437 [0,2,0,0,0,0|1,1,0]=4 907 B12R1.6 OCC1=CC=C(C(F)(F)F)C=C1 T60552 [0,2,0,0,0,0|2,0,0]=4 908 B12R1.48 CC1=C(CO)C=CC([N+](=O)[O-])=C1 M49322 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.48 CCC1=C(Br)C=C(C(=O)O)C=C1 B36941 [0,2,0,0,0,0|1,0,1]=4 910 B12R1.48 CCC1=C(N)C=C(C(=O)O)C=C1 A50040 [0,2,0,0,0,0|1,0,1]=4 911 B12R1.48 CNC1=C(N)C=C(C(=O)O)C=C1 A46677 [0,2,0,0,0,0|1,0,1]=4 912 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=C1 B48640 [0,2,0,0,0,0|0,0,1]=3 913 B12R1.48 COC1=C(Br)C=C(C(=O)O)C=N1 B45411 [0,2,0,0,0,0|1,0,1]=4 914 B12R1.48 COC1=C(Br)C=C(C(C)=O)C=C1 B51906 [0,2,0,0,0,0|0,0,2]=4 915 B12R1.48 COC1=C(Br)C=C([N+](=O)[O-])C=C1 B39390 [0,2,0,0,0,0|1,0,1]=4 916 B12R1.48 COC1=C(C)C=C(B(O)O)C=C1 M2759 [0,2,0,0,0,0|1,0,0]=3 917 B12R1.48 COC1=C(C)C=C(C(=O)O)C=C1 M49918 [0,2,0,0,0,0|0,0,1]=3 918 B12R1.48 COC1=C(C)C=C(C(C)=O)C=C1 M52806 [0,2,0,0,0,0|0,0,2]=4 919 B12R1.48 COC1=C(C)C=C([N+](=O)[O-])C=C1 M49329 [0,2,0,0,0,0|1,0,1]=4 920 B12R1.48 COC1=C(Cl)C=C(B(O)O)C=C1 C2212 [0,2,0,0,0,0|1,0,0]=3 921 B12R1.48 COC1=C(Cl)C=C(B(O)O)C=N1 C61782 [0,2,0,0,0,0|2,0,0]=4 922 B12R1.48 COC1=C(Cl)C=C(C(=O)O)C=C1 C36658 [0,2,0,0,0,0|0,0,1]=3 923 B12R1.48 COC1=C(Cl)C=C(C(=O)O)N=C1 C13348 [0,2,0,0,0,0|1,0,1]=4 924 B12R1.48 COC1=C(F)C=C(B(O)O)C=C1 F3260 [0,2,0,0,0,0|1,0,0]=3 925 B12R1.48 COC1=C(F)C=C(B(O)O)C=N1 F43165 [0,2,0,0,0,0|2,0,0]=4 926 B12R1.48 COC1=C(F)C=C(C(=O)O)C=C1 F69026 [0,2,0,0,0,0|0,0,1]=3 927 B12R1.48 COC1=C(F)C=C(C(=O)O)C=N1 F45448 [0,2,0,0,0,0|1,0,1]=4 928 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 F51937 [0,2,0,0,0,0|0,0,2]=4 929 B12R1.48 COC1=C(F)C=C([C@H](C)N)C=C1 F52155 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.48 COC1=C(F)C=C([C@H](C)N)C=C1 F63085 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.48 COC1=C(F)C=C([N+](=O)[O-])C=C1 F45441 [0,2,0,0,0,0|1,0,1]=4 932 B12R1.48 COC1=C(I)C=C([N+](=O)[O-])C=C1 K69650 [0,2,0,0,0,0|1,0,1]=4 933 B12R1.48 COC1=C(N)C=C(C(=O)O)C=C1 A69041 [0,2,0,0,0,0|0,0,1]=3 934 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 M39427 [0,2,0,0,0,0|1,0,1]=4 935 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 M60757 [0,2,0,0,0,0|1,0,1]=4 936 B12R1.48 COC1=C(O)C=C([N+](=O)[O-])C=C1 M39400 [0,2,0,0,0,0|1,0,1]=4 937 B12R1.48 COC1=CC=C(C(=O)O)N=C1Br B45415 [0,2,0,0,0,0|1,0,1]=4 938 B12R1.48 NC1=C(CO)C=CC([N+](=O)[O-])=C1 A46027 [0,2,0,0,0,0|2,0,0]=4 939 B12R1.48 O=[N+]([O-])C1=CC(Cl)=C(CO)C=C1 C45427 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.48 O=[N+]([O-])C1=CC(F)=C(CO)C=C1 F24777 [0,2,0,0,0,0|2,0,0]=4 941 B12R1.48 OCC1=C(F)C=C(B(O)O)C=C1 F46265 [0,2,0,0,0,0|2,0,0]=4 942 B12R1.113 CC#CC1=CC=C(C(=O)O)C=C1 P53794 [0,2,0,0,0,0|1,0,1]=4 943 B12R1.113 CCCC1=CC=C(B(O)O)C=C1 P5058 [0,2,0,0,0,0|2,0,0]=4 944 B12R1.113 CCCC1=CC=C(C(=O)O)C=C1 P39602 [0,2,0,0,0,0|1,0,1]=4 945 B12R1.113 CCOC1=CC=C(B(O)O)C=C1 E3100 [0,2,0,0,0,0|1,0,0]=3 946 B12R1.113 CCOC1=CC=C(C(C)=O)C=C1 E52787 [0,2,0,0,0,0|0,0,2]=4 947 B12R1.113 CCOC1=CN=C(C(=O)O)C=C1 E49300 [0,2,0,0,0,0|1,0,1]=4 948 B12R1.113 CCOC1=NC=C(B(O)O)C=C1 E43705 [0,2,0,0,0,0|2,0,0]=4 949 B12R1.113 CCSC1=CC=C(B(O)O)C=C1 E3166 [0,2,0,0,0,0|1,1,0]=4 950 B12R1.113 CN(C)C1=CC=C(CCO)C=C1 D53144 [0,2,0,0,0,0|1,0,0]=3 951 B12R1.113 O=C(O)C1=CC=C(CCBr)C=C1 B51878 [0,2,0,0,0,0|1,0,1]=4 952 B12R1.113 O=C(O)C1=CC=C(CCO)C=C1 H49916 [0,2,0,0,0,0|1,0,1]=4 953 B12R1.113 O=[N+]([O-])C1=CC=C(CCO)C=C1 N4656 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.113 OCCC1=CC=C(B(O)O)C=C1 H46949 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.256 CC(=O)C1=CC=C(B(O)O)C=C1 A49401 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 A67428 [0,2,0,0,0,0|1,0,1]=4 957 B12R1.256 CC(C)C1=CC=C(B(O)O)C=C1 I3960 [0,2,0,0,0,0|2,0,0]=4 958 B12R1.256 C[C@@H](N)C1=CC=C(C(=O)O)C=C1 A52113 [0,2,0,0,0,0|1,0,1]=4 959 B12R1.256 C[C@@H](O)C1=CC=C([N+](=O)[O-])C=C1 N49316 [0,2,0,0,0,0|2,0,0]=4 960 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 A22822 [0,2,0,0,0,0|1,0,1]=4 961 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 A50063 [0,2,0,0,0,0|1,0,1]=4 962 B12R1.256 C[C@H](N)C1=CC=C(C(=O)O)C=C1 A52114 [0,2,0,0,0,0|1,0,1]=4 963 B12R1.256 C[C@H](O)C1=CC=C(B(O)O)C=C1 H46948 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.256 C[C@H](O)C1=CC=C(C(=O)O)C=C1 H49915 [0,2,0,0,0,0|1,0,1]=4 965 B12R1.256 C[C@H](O)C1=CC=C(C(N)=O)C=C1 H50041 [0,2,0,0,0,0|2,0,0]=4 966 B12R1.256 C[S@](=O)C1=CC=C(B(O)O)C=C1 M4480 [0,2,0,0,0,0|1,1,0]=4 967 B12R1.452 CC1=C([N+](=O)[O-])C=CC(CO)=C1 M49323 [0,2,0,0,0,0|2,0,0]=4 968 B12R1.452 COC1=CC(Br)=C(C(=O)O)C=C1 B38494 [0,2,0,0,0,0|0,0,1]=3 969 B12R1.452 COC1=CC(Br)=C([N+](=O)[O-])C=C1 B45420 [0,2,0,0,0,0|1,0,1]=4 970 B12R1.452 COC1=CC(C)=C(B(O)O)C=C1 M4226 [0,2,0,0,0,0|1,0,0]=3 971 B12R1.452 COC1=CC(C)=C(C(=O)O)C=C1 M49917 [0,2,0,0,0,0|0,0,1]=3 972 B12R1.452 COC1=CC(C)=C([N+](=O)[O-])C=C1 M39518 [0,2,0,0,0,0|1,0,1]=4 973 B12R1.452 COC1=CC(Cl)=C(B(O)O)C=C1 C2208 [0,2,0,0,0,0|1,0,0]=3 974 B12R1.452 COC1=CC(Cl)=C(C(=O)O)C=C1 C68933 [0,2,0,0,0,0|0,0,1]=3 975 B12R1.452 COC1=CC(Cl)=C(C(=O)O)N=C1 C45433 [0,2,0,0,0,0|1,0,1]=4 976 B12R1.452 COC1=CC(Cl)=C(C(C)=O)C=C1 C51927 [0,2,0,0,0,0|0,0,2]=4 977 B12R1.452 COC1=CC(Cl)=C([N+](=O)[O-])C=C1 C45438 [0,2,0,0,0,0|1,0,1]=4 978 B12R1.452 COC1=CC(F)=C(B(O)O)C=C1 F3224 [0,2,0,0,0,0|1,0,0]=3 979 B12R1.452 COC1=CC(F)=C(C(=O)O)C=C1 F67517 [0,2,0,0,0,0|0,0,1]=3 980 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 F15561 [0,2,0,0,0,0|0,0,2]=4 981 B12R1.452 COC1=CC(F)=C(C(C)C)C=C1 F15562 [0,2,0,0,0,0|1,0,0]=3 982 B12R1.452 COC1=CC(F)=C([C@H](C)N)C=C1 F52154 [0,2,0,0,0,0|1,0,0]=3 983 B12R1.452 COC1=CC(F)=C([N+](=O)[O-])C=C1 F38632 [0,2,0,0,0,0|1,0,1]=4 984 B12R1.452 COC1=CC(I)=C(C(=O)O)C=C1 K48689 [0,2,0,0,0,0|0,0,1]=3 985 B12R1.452 COC1=CC(I)=C([N+](=O)[O-])C=C1 K45457 [0,2,0,0,0,0|1,0,1]=4 986 B12R1.452 COC1=CC(N)=C(C(=O)O)C=C1 A10725 [0,2,0,0,0,0|0,0,1]=3 987 B12R1.452 COC1=CC(N)=C(C(=O)O)C=N1 A12851 [0,2,0,0,0,0|1,0,1]=4 988 B12R1.452 COC1=CC(N)=C(C(C)=O)C=C1 A61340 [0,2,0,0,0,0|0,0,2]=4 989 B12R1.452 COC1=CC(N)=C([N+](=O)[O-])C=C1 M46026 [0,2,0,0,0,0|1,0,1]=4 990 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 H49115 [0,2,0,0,0,0|0,0,1]=3 991 B12R1.452 COC1=CC(O)=C(C(=O)[O-])C=C1 P46627 [0,2,0,0,0,0|0,0,2]=4 992 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 H1583 [0,2,0,0,0,0|0,0,2]=4 993 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 M45859 [0,2,0,0,0,0|1,0,1]=4 994 B12R1.452 COC1=CC=C(C(=O)O)C(Cl)=N1 C45432 [0,2,0,0,0,0|1,0,1]=4 995 B12R1.452 COC1=CN=C(C(=O)O)C(N)=C1 A62991 [0,2,0,0,0,0|1,0,1]=4 996 B12R1.452 COC1=NC=C(B(O)O)C(C)=C1 M43706 [0,2,0,0,0,0|2,0,0]=4 997 B12R1.452 NC1=C([N+](=O)[O-])C=CC(CO)=C1 A63290 [0,2,0,0,0,0|2,0,0]=4 998 B12R1.452 O=C(O)C1=C(F)C=C(CO)C=C1 F63304 [0,2,0,0,0,0|2,0,0]=4 999 B12R1.452 O=[N+]([O-])C1=C(F)C=C(CO)C=C1 F61584 [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.452 O=[N+]([O-])C1=C(O)C=C(CO)C=C1 H65292 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.4 C=CC1=CC=C(OC(C)=O)C=C1 A52418 [0,2,0,0,0,0|1,0,1]=4 1002 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 A50169 [0,2,0,0,0,0|2,0,0]=4 1003 B12R1.4 CC(=O)NC1=CC=C(CN)C=C1 A52132 [0,2,0,0,0,0|2,0,0]=4 1004 B12R1.4 CC(=O)OC1=CC=C(CBr)C=C1 B51883 [0,2,0,0,0,0|1,0,0]=3 1005 B12R1.4 CC(C)OC1=CC=C(C#N)C=C1 P63801 [0,2,0,0,0,0|1,0,1]=4 1006 B12R1.4 CC(C)OC1=CC=C(C=O)C=C1 P52789 [0,2,0,0,0,0|0,0,2]=4 1007 B12R1.4 CC(C)OC1=CC=C(NN)C=C1 P52189 [0,2,0,0,0,0|2,0,0]=4 1008 B12R1.4 CN(C)CC1=CC=C(CN)C=C1 A54206 [0,2,0,0,0,0|2,0,0]=4 1009 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 M37629 [0,2,0,0,0,0|0,0,0]=2 1010 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 M39603 [0,2,0,0,0,0|0,0,1]=3 1011 B12R1.4 COC1=CC=C(CC(N)=O)C=C1 M50047 [0,2,0,0,0,0|0,0,1]=3 1012 B12R1.4 COC1=CC=C(OC(=O)Cl)C=C1 M48659 [0,2,0,0,0,0|0,0,2]=4 1013 B12R1.4 CSC1=CC=C(CC(=O)O)C=C1 M49906 [0,2,0,0,0,0|0,1,0]=3 1014 B12R1.4 FC(F)OC1=CC=C(CBr)C=C1 B48723 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.4 FC(F)OC1=NC=C(CCl)C=C1 C45491 [0,2,0,0,0,0|2,0,0]=4 1016 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 C51175 [0,2,0,0,0,0|2,0,0]=4 1017 B12R1.4 N#CC1=CC=C(OC(F)F)C=C1 D47752 [0,2,0,0,0,0|1,0,1]=4 1018 B12R1.4 NCC1=CC=C(CC(=O)O)C=C1 A52120 [0,2,0,0,0,0|2,0,0]=4 1019 B12R1.4 O=C(O)CC1=CC=C(CBr)C=C1 B51900 [0,2,0,0,0,0|2,0,0]=4 1020 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 H49932 [0,2,0,0,0,0|1,0,1]=4 1021 B12R1.4 O=CC1=CC=C(CC(=O)O)C=C1 F51626 [0,2,0,0,0,0|2,0,0]=4 1022 B12R1.4 O=CC1=CC=C(OC(F)F)C=C1 D48189 [0,2,0,0,0,0|0,0,2]=4 1023 B12R1.4 OCC1=CC=C(OC(F)F)C=C1 D49085 [0,2,0,0,0,0|0,0,0]=2 1024 B12R1.71 C#CC1=CC=C(OCCC)C=C1 E54537 [0,2,0,0,0,0|1,0,1]=4 1025 B12R1.71 CCCOC1=CC=C(C=O)C=C1 P2642 [0,2,0,0,0,0|0,0,2]=4 1026 B12R1.71 CCNCC1=CC=C(OC)C=C1 M53139 [0,2,0,0,0,0|1,0,0]=3 1027 B12R1.71 COC1=CC=C(CCCN)C=C1 M53143 [0,2,0,0,0,0|1,0,0]=3 1028 B12R1.71 COC1=CC=C(CN=[N+]=[N-])C=C1 A9117 [0,2,0,0,0,0|1,0,0]=3 1029 B12R1.71 COC1=CC=C(CNC=O)C=C1 M50050 [0,2,0,0,0,0|0,0,1]=3 1030 B12R1.71 COC1=CC=C(OCCN)C=C1 M50362 [0,2,0,0,0,0|1,0,0]=3 1031 B12R1.71 N#CC1=CC=C(CCCO)C=C1 H52548 [0,2,0,0,0,0|2,0,0]=4 1032 B12R1.71 O=CC1=CC=C(OCCBr)C=C1 B51882 [0,2,0,0,0,0|0,0,2]=4 1033 B12R1.71 O=CC1=CC=C(OCCO)C=C1 H49920 [0,2,0,0,0,0|0,0,2]=4 1034 B12R1.114 CCOC1=C(Br)C=C(C=O)C=C1 B51877 [0,2,0,0,0,0|0,0,2]=4 1035 B12R1.114 COC1=CC(C)=C(CC#N)C=C1 M52552 [0,2,0,0,0,0|1,0,0]=3 1036 B12R1.288 COC1=C(Br)C=C(CC#N)C=C1 B62199 [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.288 COC1=C(F)C=C(CC#N)C=C1 F51535 [0,2,0,0,0,0|1,0,0]=3 1038 B12R1.288 COC1=C(F)C=C(CCO)C=C1 F50130 [0,2,0,0,0,0|0,0,0]=2 1039 B12R1.288 COC1=C(O)C=C(CCN)C=C1 A69548 [0,2,0,0,0,0|1,0,0]=3 1040 B12R1.78 C#CC1=C(CO)C=C(OC)C=C1 E38958 [0,2,0,0,0,0|1,0,1]=4 1041 B12R1.78 C=CC1=CC(OC)=C(OC)C=C1 D52795 [0,2,0,0,0,0|1,0,1]=4 1042 B12R1.78 CCC1=CC(OC)=C(OC)C=C1 E53088 [0,2,0,0,0,0|1,0,0]=3 1043 B12R1.78 COC1=C(OC)C=C(C#N)C=C1 D60501 [0,2,0,0,0,0|1,0,1]=4 1044 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 V69274 [0,2,0,0,0,0|0,0,2]=4 1045 B12R1.78 COC1=C(OC)C=C(CBr)C=C1 B38021 [0,2,0,0,0,0|1,0,0]=3 1046 B12R1.78 COC1=C(OC)C=C(NN)C=C1 D67774 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.78 COC1=CC(C#N)=C(C=O)C=C1 C69491 [0,2,0,0,0,0|0,0,2]=4 1048 B12R1.78 COC1=CC(C#N)=C(OC)C=C1 D51773 [0,2,0,0,0,0|2,0,0]=4 1049 B12R1.78 COC1=CC(C=O)=C(OC)C=C1 D39536 [0,2,0,0,0,0|2,0,0]=4 1050 B12R1.78 COC1=CC(OC)=C(CN)C=C1 D37838 [0,2,0,0,0,0|1,0,0]=3 1051 B12R1.78 COC1=CC=C(CN)N=C1OC D29503 [0,2,0,0,0,0|2,0,0]=4 1052 B12R1.301 COC1=C(Br)C=C(C=O)C=C1Br D48120 [0,2,0,0,0,0|0,0,2]=4 1053 B12R1.301 COC1=C(C)C=C(C#N)C=C1C M52550 [0,2,0,0,0,0|1,0,1]=4 1054 B12R1.301 COC1=C(C)C=C(C=O)C=C1C D52808 [0,2,0,0,0,0|0,0,2]=4 1055 B12R1.301 COC1=C(F)C=C(C#N)C=C1F D63907 [0,2,0,0,0,0|1,0,1]=4 1056 B12R1.301 COC1=C(F)C=C(CO)C=C1F D49086 [0,2,0,0,0,0|0,0,0]=2 1057 B12R1.301 COC1=C(I)C=C(C#N)C=C1I D47758 [0,2,0,0,0,0|1,0,1]=4 1058 B12R1.301 COC1=CC(Br)=C(OC)C(N)=C1 B46773 [0,2,0,0,0,0|2,0,0]=4 1059 B12R1.301 COC1=CC(C)=C(C=O)C(C)=C1 M52811 [0,2,0,0,0,0|0,0,2]=4 1060 B12R1.301 COC1=CC(F)=C(C=O)C(F)=C1 D48201 [0,2,0,0,0,0|0,0,2]=4 1061 B12R1.301 N#CC1=CC(F)=C(CO)C(F)=C1 D47755 [0,2,0,0,0,0|2,0,0]=4 1062 B12R1.450 COC1=C(Br)C=C(C=O)C(O)=C1 B48651 [0,2,0,0,0,0|0,0,2]=4 1063 B12R1.450 COC1=C(F)C=C(C#N)C(F)=C1 D47753 [0,2,0,0,0,0|1,0,1]=4 1064 B12R1.450 COC1=C(F)C=C(C=O)C(F)=C1 D48200 [0,2,0,0,0,0|0,0,2]=4 1065 B12R1.450 COC1=CC(Br)=C(C=O)C=C1O B48650 [0,2,0,0,0,0|0,0,2]=4 1066 B12R1.450 COC1=CC(Br)=C(OC)C=C1Br D3514 [0,2,0,0,0,0|2,0,0]=4 1067 B12R1.450 COC1=CC(C)=C(C=O)C=C1C M52810 [0,2,0,0,0,0|0,0,2]=4 1068 B12R1.450 COC1=CC(I)=C(OC)C=C1Br B49083 [0,2,0,0,0,0|2,0,0]=4 1069 B12R1.450 COC1=CC(I)=C(OC)C=C1I D49087 [0,2,0,0,0,0|2,0,0]=4 1070 B12R1.653 COC1=C(C)C(C)=C(C=O)C=C1 M52809 [0,2,0,0,0,0|0,0,2]=4 1071 B12R1.653 COC1=C(C)C(N)=C(C#N)C=C1 A65382 [0,2,0,0,0,0|1,0,1]=4 1072 B12R1.653 COC1=C(O)C(O)=C(C=O)C=C1 D49118 [0,2,0,0,0,0|0,0,2]=4 1073 B12R1.653 COC1=CC=C(C=O)C(Cl)=C1O C48665 [0,2,0,0,0,0|0,0,2]=4 1074 B10R1.2 CC1=CC=CC(CO)=C1C D50272 [0,0,1,1,0,0|1,0,1]=4 1075 B10R1.2 CC1=CC=CC(CO)=C1N A46912 [0,0,1,1,0,0|2,0,0]=4 1076 B10R1.2 CN1C=CC=C(CO)C1=O M0353 [0,0,1,1,0,0|2,0,0]=4 1077 B10R1.2 COC1=C(Br)C(O)=CC=C1 B37391 [0,0,1,1,0,0|1,0,1]=4 1078 B10R1.2 COC1=C(Cl)C(O)=CC=C1 C38626 [0,0,1,1,0,0|1,0,1]=4 1079 B10R1.2 COC1=C(N)C(O)=CC=C1 A46392 [0,0,1,1,0,0|1,0,1]=4 1080 B10R2.31 BrC1=CC2=C(C=C1)CC2 B48297 [1,0,0,1,0,0|2,0,0]=4 1081 B12R2.1384 O=C(O)C1=CC2=C(C=C1)CC2 B51559 [0,1,0,1,0,0|1,0,1]=4 1082 B12R2.1384 OB(O)C1=CC2=C(C=C1)CC2 B61599 [0,1,0,1,0,0|2,0,0]=4 1083 B12R2.44 C#CC1=CC2=C(C=C1)OCO2 E50963 [0,1,0,1,0,0|1,0,1]=4 1084 B12R2.44 COC1=CC2=C(C=C1)C=NN2 M0480 [0,1,0,1,0,0|1,0,1]=4 1085 B12R2.44 COC1=CC2=C(C=C1)CCN2 M52102 [0,1,0,1,0,0|1,0,0]=3 1086 B12R2.44 COC1=CC2=C(C=C1)CNC2 M52106 [0,1,0,1,0,0|1,0,0]=3 1087 B12R2.44 COC1=CC2=C(C=C1)N=CS2 M48553 [0,1,0,1,0,0|0,1,1]=4 1088 B12R2.44 COC1=CC2=C(C=C1)NC=N2 M48805 [0,1,0,1,0,0|1,0,1]=4 1089 B12R2.44 COC1=CC2=C(C=C1)NCC2 M22375 [0,1,0,1,0,0|1,0,0]=3 1090 B12R2.44 COC1=CC2=C(C=C1)NCC2 M52101 [0,1,0,1,0,0|1,0,0]=3 1091 B12R2.44 COC1=CC2=C(C=C1)NN=C2 M7598 [0,1,0,1,0,0|2,0,0]=4 1092 B12R2.44 COC1=CC2=C(C=C1)SC=C2 M51661 [0,1,0,1,0,0|1,0,1]=4 1093 B12R2.44 COC1=CC2=C(C=CC2)C=C1 M52406 [0,1,0,1,0,0|1,0,1]=4 1094 B12R2.44 COC1=CC2=C(C=CN2)C=C1 M2150 [0,1,0,1,0,0|1,0,1]=4 1095 B12R2.44 COC1=CC2=C(C=CO2)C=C1 M51550 [0,1,0,1,0,0|0,0,1]=3 1096 B12R2.44 COC1=CC2=C(C=CS2)C=C1 M26356 [0,1,0,1,0,0|0,1,1]=4 1097 B12R2.44 N#CC1=CC2=C(C=C1)OCO2 M47716 [0,1,0,1,0,0|1,0,1]=4 1098 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 D51558 [0,1,0,1,0,0|0,0,2]=4 1099 B12R2.44 OCC1=CC2=C(C=C1)C=NN2 I9283 [0,1,0,1,0,0|2,0,0]=4 1100 B12R2.44 OCC1=CC2=C(C=C1)CCO2 D37247 [0,1,0,1,0,0|1,0,0]=3 1101 B12R2.44 OCC1=CC2=C(C=C1)NN=C2 H5879 [0,1,0,1,0,0|1,0,1]=4 1102 B12R2.44 OCC1=CC2=C(C=C1)OCC2 D65568 [0,1,0,1,0,0|0,0,0]=2 1103 B12R2.44 OCC1=CC2=C(C=C1)SC=C2 B22245 [0,1,0,1,0,0|0,1,1]=4 1104 B12R2.44 OCC1=CC2=C(C=C1)SC=N2 B48555 [0,1,0,1,0,0|0,1,1]=4 1105 B12R2.44 OCC1=CC2=C(C=CS2)C=C1 B24567 [0,1,0,1,0,0|1,0,1]=4 1106 B12R2.44 OCC1=CC2=C(C=N1)OC=C2 F48462 [0,1,0,1,0,0|1,0,1]=4 1107 B12R2.44 OCC1=CC2=NSN=C2C=C1 B38951 [0,1,0,1,0,0|1,1,0]=4 1108 B8R1.1 CC1=CC=C(CN)O1 M37131 [1,0,0,0,1,0|2,0,0]=4 1109 B8R1.1 CC1=CC=C(CO)O1 M43304 [1,0,0,0,1,0|1,0,0]=3 1110 B8R1.1 CC1=CN=C(CO)S1 M41173 [1,0,0,0,1,0|2,0,0]=4 1111 B8R1.1 CC1=NC=C(CO)O1 M37561 [1,0,0,0,1,0|2,0,0]=4 1112 B8R1.1 CC1=NC=C(CO)S1 M1967 [1,0,0,0,1,0|2,0,0]=4 1113 B8R1.1 CCC1=CC=C(C)S1 E43745 [1,0,0,0,1,0|2,0,0]=4 1114 B8R1.1 CN1C=C(CO)C=N1 M10343 [1,0,0,0,1,0|2,0,0]=4 1115 B8R1.1 CN1C=CC(CO)=N1 M9953 [1,0,0,0,1,0|2,0,0]=4 1116 B8R1.1 CN1C=NC(CO)=C1 M12982 [1,0,0,0,1,0|2,0,0]=4 1117 B8R1.1 OCC1=CC(Br)=CS1 B12759 [1,0,0,0,1,0|2,0,0]=4 1118 B8R1.1 OCC1=CC(Cl)=CS1 C7722 [1,0,0,0,1,0|2,0,0]=4 1119 B8R1.1 OCC1=CC=C(Br)S1 B12756 [1,0,0,0,1,0|2,0,0]=4 1120 B8R1.1 OCC1=CC=C(Br)S1 B41016 [1,0,0,0,1,0|2,0,0]=4 1121 B8R1.1 OCC1=CC=C(Cl)S1 C1567 [1,0,0,0,1,0|2,0,0]=4 1122 B8R1.1 OCC1=CC=C(F)S1 F8123 [1,0,0,0,1,0|2,0,0]=4 1123 B8R1.1 OCC1=CSC(Cl)=C1 C7721 [1,0,0,0,1,0|2,0,0]=4 1124 B10R1.172 C#CC1=CC=CC(OC)=C1 E25312 [0,0,0,0,1,1|1,0,1]=4 1125 B10R1.172 CCC1=CC=CC(CO)=N1 E46907 [0,0,0,0,1,1|2,0,0]=4 1126 B10R1.172 CNC1=NC=CC(CO)=N1 M63073 [0,0,0,0,1,1|2,0,0]=4 1127 B10R1.172 COC1=CC(C#N)=CC=C1 M65442 [0,0,0,0,1,1|1,0,1]=4 1128 B10R1.172 COC1=CC(C#N)=NC=C1 M9468 [0,0,0,0,1,1|1,0,1]=4 1129 B10R1.172 COC1=CC(C=O)=CN=C1 M2961 [0,0,0,0,1,1|0,0,2]=4 1130 B10R1.172 COC1=CC(C=O)=NC=C1 M38180 [0,0,0,0,1,1|0,0,2]=4 1131 B10R1.172 COC1=CC(CCl)=NC=C1 C46205 [0,0,0,0,1,1|1,0,0]=3 1132 B10R1.172 COC1=CC(CN)=CC=C1 M27985 [0,0,0,0,1,1|1,0,0]=3 1133 B10R1.172 COC1=CC(CN)=NC=C1 M36712 [0,0,0,0,1,1|1,0,0]=3 1134 B10R1.172 COC1=CC(CN)=NC=C1 M46591 [0,0,0,0,1,1|1,0,0]=3 1135 B10R1.172 COC1=CC(CO)=CC=C1 M39430 [0,0,0,0,1,1|0,0,0]=2 1136 B10R1.172 COC1=CC(CO)=NC=C1 M38100 [0,0,0,0,1,1|0,0,0]=2 1137 B10R1.172 COC1=CC(NN)=CC=C1 M69005 [0,0,0,0,1,1|2,0,0]=4 1138 B10R1.172 COC1=CC(OC)=NC=C1 D46390 [0,0,0,0,1,1|2,0,0]=4 1139 B10R1.172 COC1=CC=CC(C=O)=C1 M67838 [0,0,0,0,1,1|0,0,2]=4 1140 B10R1.172 COC1=CC=CC(CBr)=N1 B46166 [0,0,0,0,1,1|2,0,0]=4 1141 B10R1.172 COC1=CC=CC(CCl)=C1 C49452 [0,0,0,0,1,1|1,0,0]=3 1142 B10R1.172 COC1=CC=CC(CCl)=N1 C46206 [0,0,0,0,1,1|2,0,0]=4 1143 B10R1.172 COC1=CN=CC(C#N)=C1 M45213 [0,0,0,0,1,1|1,0,1]=4 1144 B10R1.172 COC1=CN=CC(CN)=C1 M11309 [0,0,0,0,1,1|1,0,0]=3 1145 B10R1.172 COC1=CN=CC(CO)=C1 M14136 [0,0,0,0,1,1|0,0,0]=2 1146 B10R1.172 COC1=CN=CC(OC)=C1 D28467 [0,0,0,0,1,1|2,0,0]=4 1147 B10R1.172 COC1=NC(CN)=CC=C1 M46592 [0,0,0,0,1,1|2,0,0]=4 1148 B10R1.172 COC1=NC(CN)=CC=N1 M43577 [0,0,0,0,1,1|2,0,0]=4 1149 B10R1.172 COC1=NC(CN)=NC=C1 M27520 [0,0,0,0,1,1|2,0,0]=4 1150 B10R1.172 COC1=NC(CO)=CC=C1 M46402 [0,0,0,0,1,1|1,0,0]=3 1151 B10R1.172 COC1=NC(CO)=CC=N1 H11374 [0,0,0,0,1,1|1,0,0]=3 1152 B10R1.172 COC1=NC=CC(C#N)=C1 C12714 [0,0,0,0,1,1|1,0,1]=4 1153 B10R1.172 COC1=NC=CC(C=O)=C1 M3688 [0,0,0,0,1,1|0,0,2]=4 1154 B10R1.172 COC1=NC=CC(CN)=C1 M0578 [0,0,0,0,1,1|1,0,0]=3 1155 B10R1.172 COC1=NC=CC(CO)=C1 M0582 [0,0,0,0,1,1|0,0,0]=2 1156 B10R1.172 CSC1=NC(CO)=CC=N1 M32432 [0,0,0,0,1,1|1,1,0]=4 1157 B10R1.172 N#CC1=CC(CO)=CN=C1 H37587 [0,0,0,0,1,1|2,0,0]=4 1158 B10R1.172 N#CC1=CC=CC(CO)=C1 C48440 [0,0,0,0,1,1|2,0,0]=4 1159 B10R1.172 NCC1=CC=CC(CO)=C1 A46908 [0,0,0,0,1,1|2,0,0]=4 1160 B10R1.172 O=CC1=CC(CO)=CC=C1 H36764 [0,0,0,0,1,1|2,0,0]=4 1161 B10R1.172 OCC1=CC=CC(CCl)=C1 C49450 [0,0,0,0,1,1|2,0,0]=4