0 B11R1.182 CC1=C(CC#N)C=C(F)C=C1 F51464 [0,0,0,0,0,0|1,0,2]=3 1 B11R1.182 CC1=CC(CC#N)=C(C)C=C1 D52506 [0,0,0,0,0,0|0,0,2]=2 2 B11R1.182 CCOC1=C(C)C=CC(Br)=C1 B50153 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.182 COCC1=C(F)C=CC(Br)=C1 B39083 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.182 N#CCC1=C(Br)C=CC(F)=C1 B47684 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.182 N#CCC1=C(Cl)C=CC(Cl)=C1 D47687 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.182 N#CCC1=C(Cl)C=CC(F)=C1 C47691 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.182 N#CCC1=C(F)C=CC(Br)=C1 B38134 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.182 NC1=CC(CCO)=C(N)C=C1 D47001 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.182 NCCC1=C(Cl)C=CC(Cl)=C1 D49228 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.182 OCCC1=C(Cl)C=CC(Cl)=C1 D49148 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.182 OCCC1=C(F)C=CC(F)=C1 D49156 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.4 CC1=C(CC#N)C=CC=C1 T69238 [1,0,0,0,0,0|0,0,2]=3 13 B10R1.4 CC1=C(CCO)C=CC=C1 T50264 [1,0,0,0,0,0|1,0,0]=2 14 B10R1.4 CC1=C(N=C=S)C=CC=C1 M60893 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.4 CCOC1=C([Mg+])C=CC=C1 E31764 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.4 CCSC1=C(N)C=CC=C1 E46939 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.4 CNCC1=C(Br)C=CC=C1 B46737 [1,0,0,0,0,0|3,0,0]=4 18 B10R1.4 CNCC1=C(C)C=CC=C1 M50314 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.4 CNCC1=C(Cl)C=CC=C1 C46748 [1,0,0,0,0,0|3,0,0]=4 20 B10R1.4 CNCC1=C(F)C=CC=C1 F67727 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.4 COCC1=C(O)C=CC=C1 M69473 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.4 N#CCC1=C(Br)C=CC=C1 B69236 [1,0,0,0,0,0|1,0,2]=4 23 B10R1.4 N#CCC1=C(Cl)C=CC=C1 C39466 [1,0,0,0,0,0|1,0,2]=4 24 B10R1.4 N#CCC1=C(F)C=CC=C1 F68569 [1,0,0,0,0,0|1,0,2]=4 25 B10R1.4 N#CCC1=C(I)C=CC=C1 K47987 [1,0,0,0,0,0|1,0,2]=4 26 B10R1.4 N#CCC1=C(N)C=CC=C1 A48786 [1,0,0,0,0,0|1,0,2]=4 27 B10R1.4 NC1=C(CCO)C=CC=C1 A46894 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.4 NCCC1=C(Br)C=CC=C1 B68553 [1,0,0,0,0,0|1,0,0]=2 29 B10R1.4 NCCC1=C(Br)C=CC=N1 B14102 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.4 NCCC1=C(Cl)C=CC=C1 C69206 [1,0,0,0,0,0|1,0,0]=2 31 B10R1.4 NCCC1=C(O)C=CC=C1 A46892 [1,0,0,0,0,0|1,0,0]=2 32 B10R1.4 NNCC1=C(Br)C=CC=C1 B10205 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.4 NNCC1=C(Br)C=CC=C1 B7428 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.4 NNCC1=C(Cl)C=CC=C1 C10207 [1,0,0,0,0,0|2,0,0]=3 35 B10R1.4 NNCC1=C(F)C=CC=C1 F0092 [1,0,0,0,0,0|2,0,0]=3 36 B10R1.4 NNCC1=C(F)C=CC=C1 F7427 [1,0,0,0,0,0|2,0,0]=3 37 B10R1.4 NOCC1=C(F)C=CC=C1 F63413 [1,0,0,0,0,0|2,0,0]=3 38 B10R1.4 OCCC1=C(Br)C=CC=C1 B16411 [1,0,0,0,0,0|2,0,0]=3 39 B10R1.4 OCCC1=C(Cl)C=CC=C1 C49443 [1,0,0,0,0,0|2,0,0]=3 40 B10R1.4 OCCC1=C(F)C=CC=C1 F49457 [1,0,0,0,0,0|2,0,0]=3 41 B10R1.4 OCCC1=C(I)C=CC=C1 K49472 [1,0,0,0,0,0|2,0,0]=3 42 B10R1.10 BrCCC1=CC=CC(Br)=C1 B23535 [1,0,0,0,0,0|2,0,0]=3 43 B10R1.10 CC1=CC=CC(CC#N)=C1 M67706 [1,0,0,0,0,0|0,0,2]=3 44 B10R1.10 CC1=CC=CC(CCCl)=C1 C49969 [1,0,0,0,0,0|1,0,0]=2 45 B10R1.10 CC1=NC=CC(CC#N)=C1 M29959 [1,0,0,0,0,0|1,0,2]=4 46 B10R1.10 CCOC1=CC(N)=CC=C1 E64076 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.10 CCOC1=CC=CC(Br)=C1 B49423 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.10 CCOC1=CC=CC(F)=C1 E49455 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.10 CCOC1=CC=CC([Mg+])=C1 E31766 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.10 CCSC1=CC=CC(Br)=C1 B3190 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.10 CNCC1=CC(C)=CC=C1 M50313 [1,0,0,0,0,0|2,0,0]=3 52 B10R1.10 CNCC1=CC(N)=CC=C1 M46965 [1,0,0,0,0,0|3,0,0]=4 53 B10R1.10 CNCC1=CC=CC(Cl)=C1 C46754 [1,0,0,0,0,0|3,0,0]=4 54 B10R1.10 ClC1=CC=CC(CCBr)=C1 C48759 [1,0,0,0,0,0|2,0,0]=3 55 B10R1.10 N#CCC1=CC(N)=CC=C1 A48787 [1,0,0,0,0,0|1,0,2]=4 56 B10R1.10 N#CCC1=CC=CC(Br)=C1 B23025 [1,0,0,0,0,0|1,0,2]=4 57 B10R1.10 N#CCC1=CC=CC(Cl)=C1 C69079 [1,0,0,0,0,0|1,0,2]=4 58 B10R1.10 N#CCC1=CC=CC(F)=C1 F39467 [1,0,0,0,0,0|1,0,2]=4 59 B10R1.10 N#CCC1=CC=CC(O)=C1 H48451 [1,0,0,0,0,0|1,0,2]=4 60 B10R1.10 NCCC1=CC(=O)NC=C1 A46457 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.10 NCCC1=CC=CC(Br)=C1 B46722 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.10 NCCC1=CC=CC(Br)=C1 B68552 [1,0,0,0,0,0|1,0,0]=2 63 B10R1.10 NCCC1=CC=CC(Cl)=C1 C10742 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.10 NCCC1=CC=CC(F)=C1 F38570 [1,0,0,0,0,0|1,0,0]=2 65 B10R1.10 NCCC1=CC=CC(F)=C1 F46762 [1,0,0,0,0,0|1,0,0]=2 66 B10R1.10 NCCC1=CC=CC(O)=C1 A49522 [1,0,0,0,0,0|1,0,0]=2 67 B10R1.10 NNCC1=CC(Br)=CN=C1 B12725 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.10 NNCC1=CC=CC(Br)=C1 B12216 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.10 NNCC1=CC=CC(Cl)=C1 C12217 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.10 NNCC1=CC=CC(Cl)=C1 C46306 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.10 NNCC1=CC=CC(F)=C1 F0091 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.10 NNCC1=CC=CC(F)=C1 F10204 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.10 OCCC1=CC=CC(Br)=C1 B22812 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.10 OCCC1=CC=CC(Br)=N1 B46160 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.10 OCCC1=CC=CC(Cl)=C1 C49444 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.10 OCCC1=CC=CC(F)=C1 F49458 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.30 C#CC1=C(N)C=CC(C)=C1 E51676 [1,0,0,0,0,0|1,0,2]=4 78 B10R1.30 CC1=C(C#N)C=C(Br)C=C1 B47952 [1,0,0,0,0,0|1,0,2]=4 79 B10R1.30 CC1=C(C#N)C=C(F)C=C1 F47980 [1,0,0,0,0,0|1,0,2]=4 80 B10R1.30 CC1=C(C#N)C=C(I)C=C1 K47986 [1,0,0,0,0,0|1,0,2]=4 81 B10R1.30 CC1=C(C#N)C=C(N)C=C1 A48785 [1,0,0,0,0,0|1,0,2]=4 82 B10R1.30 CC1=C(C=O)C=C(Br)C=C1 B48718 [1,0,0,0,0,0|2,0,1]=4 83 B10R1.30 CC1=C(C=O)C=C(F)C=C1 F48743 [1,0,0,0,0,0|2,0,1]=4 84 B10R1.30 CC1=C(CBr)C=C(F)C=C1 B48769 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.30 CC1=C(CO)C=C(Br)C=C1 B67343 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.30 CC1=C(CO)C=C(I)C=C1 K49473 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.30 CC1=C(NN)C=C(Br)C=C1 B62458 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.30 CC1=C(NN)C=C(Cl)C=C1 C46308 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.30 CC1=CC(C#N)=C(Br)C=C1 B47946 [1,0,0,0,0,0|1,0,2]=4 90 B10R1.30 CC1=CC(C#N)=C(Cl)C=C1 C47961 [1,0,0,0,0,0|1,0,2]=4 91 B10R1.30 CC1=CC(C#N)=C(F)C=C1 F47973 [1,0,0,0,0,0|1,0,2]=4 92 B10R1.30 CC1=CC(C#N)=C(N)C=C1 A48782 [1,0,0,0,0,0|1,0,2]=4 93 B10R1.30 CC1=CC(C#N)=C(O)C=C1 H63627 [1,0,0,0,0,0|1,0,2]=4 94 B10R1.30 CC1=CC(C=O)=C(Br)C=C1 B48712 [1,0,0,0,0,0|2,0,1]=4 95 B10R1.30 CC1=CC(C=O)=C(C)C=C1 D38715 [1,0,0,0,0,0|1,0,1]=3 96 B10R1.30 CC1=CC(C=O)=C(Cl)C=C1 C48727 [1,0,0,0,0,0|2,0,1]=4 97 B10R1.30 CC1=CC(C=O)=C(F)C=C1 F48738 [1,0,0,0,0,0|2,0,1]=4 98 B10R1.30 CC1=CC(C=O)=C(O)C=C1 H49070 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.30 CC1=CC(CO)=C(Br)C=C1 B63209 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.30 CC1=CC(CO)=C(Br)C=N1 B46177 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.30 CC1=CC(NN)=C(C)C=C1 D49535 [1,0,0,0,0,0|1,0,0]=2 102 B10R1.30 CC1=CC(NN)=C(Cl)C=C1 C46307 [1,0,0,0,0,0|2,0,0]=3 103 B10R1.30 CC1=CC=C(N)C(CO)=N1 A13503 [1,0,0,0,0,0|3,0,0]=4 104 B10R1.30 CC1=CC=C(O)C(CCl)=N1 C65989 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.30 CC1=NC(CO)=C(Br)C=C1 B63914 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.30 CC1=NC(CO)=C(O)C=C1 H46408 [1,0,0,0,0,0|3,0,0]=4 107 B10R1.30 CC1=NNC(=O)C(CN)=C1 A14521 [1,0,0,0,0,0|3,0,0]=4 108 B10R1.30 CCC1=C(Br)C=CC(O)=C1 B49425 [1,0,0,0,0,0|2,0,0]=3 109 B10R1.30 CCC1=C(F)C=CC(Br)=C1 B48764 [1,0,0,0,0,0|2,0,0]=3 110 B10R1.30 CCC1=C(N)C=CC(Br)=C1 B66403 [1,0,0,0,0,0|2,0,0]=3 111 B10R1.30 CCC1=C(N)C=CC(Cl)=C1 C46752 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.30 CCN1C=C(Br)C=CC1=O B46165 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.30 CNC1=C(C)C=CC(O)=C1 M46910 [1,0,0,0,0,0|2,0,0]=3 114 B10R1.30 CNC1=C(N)C=CC(Br)=C1 B46288 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.30 CNC1=C(N)C=CC(C)=C1 D46972 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C46304 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.30 COC1=C(Br)C=CC(Br)=C1 D45542 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.30 COC1=C(Br)C=CC(C)=C1 B49434 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.30 COC1=C(Br)C=CC(C)=N1 B46169 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.30 COC1=C(Br)C=CC(Cl)=C1 B45562 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.30 COC1=C(Br)C=CC(F)=C1 B45575 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.30 COC1=C(Br)C=CC(I)=C1 B45582 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.30 COC1=C(Br)C=CC(N)=C1 B46156 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.30 COC1=C(Br)C=CC(O)=C1 B45901 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.30 COC1=C(Br)C=NC(C)=C1 B46174 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.30 COC1=C(C)C=CC(Br)=C1 B49441 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.30 COC1=C(C)C=CC(C)=C1 M50278 [1,0,0,0,0,0|1,0,0]=2 128 B10R1.30 COC1=C(C)C=CC(N)=C1 M46899 [1,0,0,0,0,0|2,0,0]=3 129 B10R1.30 COC1=C(Cl)C=CC(Br)=C1 B45554 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.30 COC1=C(Cl)C=CC(Cl)=C1 D45591 [1,0,0,0,0,0|3,0,0]=4 131 B10R1.30 COC1=C(Cl)C=CC(F)=C1 C45592 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.30 COC1=C(Cl)C=CC(I)=C1 C45601 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.30 COC1=C(Cl)C=CC(N)=C1 C46190 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.30 COC1=C(Cl)C=CC(O)=C1 C45912 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.30 COC1=C(F)C=CC(Br)=C1 B45577 [1,0,0,0,0,0|3,0,0]=4 136 B10R1.30 COC1=C(F)C=CC(C)=N1 F46220 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.30 COC1=C(F)C=CC(I)=C1 F63969 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.30 COC1=C(F)C=CC(N)=C1 F46210 [1,0,0,0,0,0|3,0,0]=4 139 B10R1.30 COC1=C(F)C=CC(O)=C1 F45918 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.30 COC1=C(I)C=CC(Br)=C1 B38625 [1,0,0,0,0,0|3,0,0]=4 141 B10R1.30 COC1=C(I)C=CC(Cl)=C1 C45603 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.30 COC1=C(I)C=CC(N)=C1 K46230 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.30 COC1=C(N)C=CC(Br)=C1 B37849 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.30 COC1=C(N)C=CC(C)=C1 M69494 [1,0,0,0,0,0|2,0,0]=3 145 B10R1.30 COC1=C(N)C=CC(Cl)=C1 C46189 [1,0,0,0,0,0|3,0,0]=4 146 B10R1.30 COC1=C(N)C=CC(Cl)=C1 C46203 [1,0,0,0,0,0|3,0,0]=4 147 B10R1.30 COC1=C(N)C=CC(F)=C1 F46209 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.30 COC1=C(N)C=CC(N)=C1 M43596 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.30 COC1=C(O)C=CC(Br)=C1 B1785 [1,0,0,0,0,0|3,0,0]=4 150 B10R1.30 COC1=C(O)C=CC(C)=C1 M69495 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.30 COC1=C(O)C=CC(Cl)=C1 C63275 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.30 COC1=C(O)C=CC(F)=C1 F23730 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.30 COC1=C(O)C=CC(N)=C1 A46396 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.30 COC1=C([Mg+])C=CC(Cl)=C1 C31792 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.30 COC1=CC(Br)=CN=C1C B16799 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.30 COC1=CC(Br)=NC=C1C B46167 [1,0,0,0,0,0|3,0,0]=4 157 B10R1.30 COC1=NC(C)=CC=C1N A67537 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.30 CSC1=C(N)C=CC(Br)=C1 B69348 [1,0,0,0,0,0|3,0,0]=4 159 B10R1.30 ClC1=CC(CBr)=C(Br)C=C1 B44690 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.30 ClC1=CC(CBr)=C(Cl)C=C1 B44708 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.30 ClCC1=C(Cl)C=CC(Br)=C1 B44711 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.30 FC1=C(CBr)C=C(Br)C=C1 B44693 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.30 NC1=C(CO)C=C(Br)C=C1 A10854 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.30 NC1=C(CO)C=C(Cl)C=C1 A46196 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.30 NC1=C(CO)C=C(F)C=C1 A46215 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.30 NC1=CC(CO)=C(F)C=C1 A46219 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.30 NCC1=C(Br)C=CC(Cl)=N1 B42733 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.30 NCC1=C(Cl)C=CC(Cl)=C1 D45793 [1,0,0,0,0,0|2,0,0]=3 169 B10R1.30 NCC1=C(F)C=CC(Br)=C1 B61206 [1,0,0,0,0,0|2,0,0]=3 170 B10R1.30 NCC1=C(F)C=CC(Cl)=C1 C38176 [1,0,0,0,0,0|2,0,0]=3 171 B10R1.30 NCC1=C(F)C=CC(F)=C1 D45811 [1,0,0,0,0,0|2,0,0]=3 172 B10R1.30 NCC1=C(N)C=CC(Br)=C1 A46294 [1,0,0,0,0,0|2,0,0]=3 173 B10R1.30 NCC1=C(N)C=CC(Cl)=C1 A46298 [1,0,0,0,0,0|2,0,0]=3 174 B10R1.30 NCC1=C(O)C=CC(Br)=C1 A46182 [1,0,0,0,0,0|2,0,0]=3 175 B10R1.30 NCC1=CC(Br)=CN=C1F A12901 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.30 NNC1=C(Br)C=CC(Br)=C1 D42724 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.30 NNC1=C(Br)C=CC(F)=C1 B42737 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.30 NNC1=C(Cl)C=CC(Cl)=C1 D42757 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.30 NNC1=C(Cl)C=CC(F)=C1 C42761 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.30 NNC1=C(F)C=CC(Br)=C1 B42740 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.30 NNC1=C(F)C=CC(F)=C1 D43515 [1,0,0,0,0,0|3,0,0]=4 182 B10R1.30 OCC1=C(Br)C=CC(Br)=C1 D45545 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.30 OCC1=C(Br)C=CC(Cl)=C1 B45558 [1,0,0,0,0,0|3,0,0]=4 184 B10R1.30 OCC1=C(Br)C=CC(F)=C1 B45568 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.30 OCC1=C(Br)C=CC(I)=C1 B45579 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.30 OCC1=C(Cl)C=CC(Br)=C1 B45559 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.30 OCC1=C(Cl)C=CC(Cl)=C1 D45589 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.30 OCC1=C(Cl)C=CC(F)=C1 C45595 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.30 OCC1=C(Cl)C=CC(O)=C1 C45913 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.30 OCC1=C(F)C=CC(Br)=C1 B45571 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.30 OCC1=C(I)C=CC(Br)=C1 B45580 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.30 OCC1=C(O)C=CC(Br)=C1 B68796 [1,0,0,0,0,0|3,0,0]=4 193 B12R1.127 CC1=C(CC(=O)O)C=C(Br)C=C1 B51909 [0,1,0,0,0,0|2,0,1]=4 194 B12R1.127 CC1=C(OC(C)C)C=C(N)C=C1 P54195 [0,1,0,0,0,0|3,0,0]=4 195 B12R1.127 CC1=C(OC(F)F)C=C(N)C=C1 D49372 [0,1,0,0,0,0|3,0,0]=4 196 B12R1.127 CC1=CC(CC(=O)O)=C(C)C=C1 D39606 [0,1,0,0,0,0|1,0,1]=3 197 B12R1.268 COC1=C(CC#N)C=C(Br)C=C1 B51518 [0,1,0,0,0,0|1,0,2]=4 198 B12R1.268 COC1=C(CC#N)C=C(Cl)C=C1 C51524 [0,1,0,0,0,0|1,0,2]=4 199 B12R1.270 COC1=CC(CC#N)=C(Br)C=C1 B51517 [0,1,0,0,0,0|1,0,2]=4 200 B12R1.270 COC1=CC(CCO)=C(Br)C=C1 B50123 [0,1,0,0,0,0|2,0,0]=3 201 B12R1.354 CC[C@H](N)C1=C(F)C=CC(F)=C1 D52098 [0,1,0,0,0,0|3,0,0]=4 202 B12R1.354 CC[C@H](O)C1=C(C)C=CC(Cl)=C1 C37554 [0,1,0,0,0,0|2,0,0]=3 203 B12R1.354 N[C@H](CO)C1=C(F)C=CC(F)=C1 A49652 [0,1,0,0,0,0|3,0,0]=4 204 B12R1.374 CCNCC1=C(O)C=CC(Br)=C1 B50254 [0,1,0,0,0,0|3,0,0]=4 205 B12R1.374 CCNCC1=C(O)C=CC(Cl)=C1 C50261 [0,1,0,0,0,0|3,0,0]=4 206 B12R1.1123 FC1=CC(F)=C(CCBr)C=C1F B18244 [0,1,0,0,0,0|3,0,0]=4 207 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 B52500 [0,0,0,1,0,0|2,0,0]=3 208 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 B61360 [0,0,0,1,0,0|3,0,0]=4 209 B12R2.24 BrC1=CC2=C(C=C1)CCCN2 B8109 [0,0,0,1,0,0|3,0,0]=4 210 B12R2.24 BrC1=CC2=C(C=C1)CCCO2 B52017 [0,0,0,1,0,0|3,0,0]=4 211 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 B11621 [0,0,0,1,0,0|3,0,0]=4 212 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 B5487 [0,0,0,1,0,0|3,0,0]=4 213 B12R2.24 BrC1=CC2=C(C=C1)CCOC2 B52019 [0,0,0,1,0,0|3,0,0]=4 214 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 B14752 [0,0,0,1,0,0|1,0,0]=2 215 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 B15726 [0,0,0,1,0,0|1,0,0]=2 216 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 B14749 [0,0,0,1,0,0|3,0,0]=4 217 B12R2.24 BrC1=CC2=C(C=C1)OCCC2 B52016 [0,0,0,1,0,0|3,0,0]=4 218 B12R2.24 BrC1=CN=C2CCCCC2=C1 B63820 [0,0,0,1,0,0|3,0,0]=4 219 B12R2.24 BrC1=CN=C2CNCCC2=C1 B14777 [0,0,0,1,0,0|2,0,0]=3 220 B12R2.24 BrC1=CN=C2CNCCC2=C1 B31695 [0,0,0,1,0,0|2,0,0]=3 221 B12R2.24 CC1=CC2=C(C=C1)CCCC2 M54692 [0,0,0,1,0,0|1,0,0]=2 222 B12R2.24 CC1=CC2=C(C=C1)CCNC2 M52881 [0,0,0,1,0,0|2,0,0]=3 223 B12R2.24 CC1=CC2=C(C=C1)CCNC2 M61207 [0,0,0,1,0,0|2,0,0]=3 224 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C32116 [0,0,0,1,0,0|3,0,0]=4 225 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 C49776 [0,0,0,1,0,0|3,0,0]=4 226 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 C49772 [0,0,0,1,0,0|3,0,0]=4 227 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 C49779 [0,0,0,1,0,0|3,0,0]=4 228 B12R2.24 ClC1=CC2=C(C=C1)CNCC2 C67678 [0,0,0,1,0,0|1,0,0]=2 229 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 C23914 [0,0,0,1,0,0|3,0,0]=4 230 B12R2.24 ClC1=NC2=C(C=C1)CCCC2 C36781 [0,0,0,1,0,0|3,0,0]=4 231 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 C4158 [0,0,0,1,0,0|2,0,0]=3 232 B12R2.24 ClC1=NC2=C(C=C1)CNCC2 C49172 [0,0,0,1,0,0|2,0,0]=3 233 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 C18597 [0,0,0,1,0,0|3,0,0]=4 234 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 C5775 [0,0,0,1,0,0|3,0,0]=4 235 B12R2.24 FC1=CC2=C(C=C1)CNCC2 F60960 [0,0,0,1,0,0|1,0,0]=2 236 B12R2.24 FC1=CC2=C(C=C1)NCCC2 F38792 [0,0,0,1,0,0|3,0,0]=4 237 B12R2.24 NC1=CC2=C(C=C1)CCCN2 T63563 [0,0,0,1,0,0|3,0,0]=4 238 B12R2.24 NC1=CC2=C(C=C1)CCCN2 T67419 [0,0,0,1,0,0|3,0,0]=4 239 B12R2.24 NC1=CC2=C(C=C1)CCNC2 T52130 [0,0,0,1,0,0|3,0,0]=4 240 B12R2.24 NC1=NC2=C(C=N1)CNCC2 T46596 [0,0,0,1,0,0|3,0,0]=4 241 B12R2.24 O=C1C=CC2=C(CCNC2)N1 T39057 [0,0,0,1,0,0|2,0,0]=3 242 B12R2.24 OC1=CC2=C(C=C1)CCCC2 T37096 [0,0,0,1,0,0|2,0,0]=3 243 B12R2.24 OC1=CC2=C(C=C1)CCCN2 H50029 [0,0,0,1,0,0|3,0,0]=4 244 B12R2.24 OC1=CC2=C(C=C1)CNCC2 T38163 [0,0,0,1,0,0|1,0,0]=2 245 B12R2.24 OC1=CC2=C(C=C1)CNCC2 T67068 [0,0,0,1,0,0|1,0,0]=2 246 B12R2.24 OC1=CC2=C(C=C1)NCCC2 H50028 [0,0,0,1,0,0|3,0,0]=4 247 B12R2.24 OC1=CN=C2CCCCC2=C1 T38906 [0,0,0,1,0,0|3,0,0]=4 248 B12R2.24 OC1=NC2=C(C=N1)CNCC2 T38314 [0,0,0,1,0,0|3,0,0]=4 249 B12R2.221 CC1=C2C=CCC2=C(C)C=C1 D54479 [0,0,0,1,0,0|1,0,1]=3 250 B12R2.221 CC1=C2C=CNC2=C(Br)C=C1 B21686 [0,0,0,1,0,0|1,0,2]=4 251 B12R2.221 CC1=C2NC=CC2=C(Br)C=C1 B51446 [0,0,0,1,0,0|1,0,2]=4 252 B12R2.221 CC1=C2NC=CC2=C(Cl)C=C1 C51455 [0,0,0,1,0,0|1,0,2]=4 253 B12R2.221 CC1=C2NN=CC2=C(Cl)C=C1 C48333 [0,0,0,1,0,0|2,0,1]=4 254 B12R2.221 CC1=CC=C(N)C2=C1C=NN2 M49199 [0,0,0,1,0,0|2,0,1]=4 255 B12R2.606 CC1=CC2=C(C=C1)CC(=O)N2 M24288 [0,0,0,1,0,0|2,0,1]=4 256 B12R2.606 CC1=CC2=C(C=C1)N=C(N)S2 A48849 [0,0,0,1,0,0|2,0,1]=4 257 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 M51752 [0,0,0,1,0,0|2,0,1]=4 258 B12R2.606 CC1=CC2=C(C=C1)OC(N)=N2 M48797 [0,0,0,1,0,0|2,0,1]=4 259 B12R2.606 CC1=CC2=C(C=C1)SC(N)=N2 A48848 [0,0,0,1,0,0|2,0,1]=4 260 B12R2.606 CN1CC2=C(C=C(N)C=C2)C1 M52247 [0,0,0,1,0,0|3,0,0]=4 261 B12R2.606 C[C@H]1CC2=C(C=CC(F)=C2)N1 F38745 [0,0,0,1,0,0|3,0,0]=4 262 B12R2.606 N[C@H]1CC2=C(C=C(Br)C=C2)C1 B67543 [0,0,0,1,0,0|1,0,0]=2 263 B12R2.606 N[C@H]1CC2=CC(Br)=CN=C2C1 B62941 [0,0,0,1,0,0|2,0,0]=3 264 B12R2.606 O=C1CC2=C(C=C(Br)C=C2)C1 B51311 [0,0,0,1,0,0|2,0,1]=4 265 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 C51319 [0,0,0,1,0,0|2,0,1]=4 266 B12R2.606 O[C@H]1CC2=C(C=C(Br)C=C2)C1 B52018 [0,0,0,1,0,0|2,0,0]=3 267 B10R1.130 CC1=CC(C)=NN1CCO D63007 [0,0,0,0,1,0|3,0,0]=4 268 B10R1.187 CC1=C(CCN)C(=O)NN1 A41493 [0,0,0,0,1,0|3,0,0]=4 269 B10R1.187 NCCN1C(=O)C=CC1=O A46630 [0,0,0,0,1,0|3,0,0]=4 270 B9R1.8 BrCCC1=CC=NC=C1 B46088 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.8 CCCC1=NC=CC=C1 P46859 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.8 NCCC1=CC=CN=C1 P43605 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.8 NCCC1=NC=CC=C1 P67673 [2,0,0,0,0,0|1,0,0]=3 274 B9R1.8 NCCC1=NC=NC=C1 P14666 [2,0,0,0,0,0|2,0,0]=4 275 B9R1.8 NCCC1=NC=NC=C1 P29961 [2,0,0,0,0,0|2,0,0]=4 276 B9R1.8 NNCC1=CC=CC=C1 B6123 [2,0,0,0,0,0|1,0,0]=3 277 B9R1.8 NNCC1=CC=CC=C1 B68081 [2,0,0,0,0,0|1,0,0]=3 278 B9R1.8 NNCC1=CC=CN=C1 H0097 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.8 NNCC1=CC=CN=C1 H36962 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.8 NNCC1=CC=NC=C1 H0096 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.8 NNCC1=CC=NC=C1 H26285 [2,0,0,0,0,0|2,0,0]=4 282 B9R1.8 NNCC1=NC=CC=C1 H0098 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.8 NOCC1=CC=CC=C1 B68114 [2,0,0,0,0,0|1,0,0]=3 284 B9R1.8 OCCC1=CC=NC=C1 H46381 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.8 OCCC1=CN=CC=C1 P46376 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.8 ONCC1=CC=CC=C1 B36744 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.8 ONCC1=CC=CC=C1 B46575 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B66761 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [2,0,0,0,0,0|1,0,0]=3 290 B9R1.15 BrCC1=C(I)C=CC=C1 B37896 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.15 CC1=C(CBr)C=CC=N1 B15311 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.15 CC1=C(CBr)C=NC=C1 B37536 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.15 CC1=C(CCl)C=CC=N1 C14756 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.15 CC1=C(CCl)C=CN=C1 C13917 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.15 CC1=C(CCl)C=CN=C1 C46110 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.15 CC1=C(CCl)C=NC=C1 C14757 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.15 CC1=C(CCl)C=NC=C1 C46108 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.15 CC1=C(CN)C=CC=C1 M65907 [2,0,0,0,0,0|0,0,0]=2 299 B9R1.15 CC1=C(CN)C=NC=C1 A11511 [2,0,0,0,0,0|1,0,0]=3 300 B9R1.15 CC1=C(CN)N=NC=C1 M60279 [2,0,0,0,0,0|2,0,0]=4 301 B9R1.15 CC1=C(CO)C=CN=C1 H1761 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.15 CC1=C(CO)C=NC=C1 H11512 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.15 CC1=C(NN)C=CC=C1 T39424 [2,0,0,0,0,0|1,0,0]=3 304 B9R1.15 CC1=CC=CN=C1CCl C14758 [2,0,0,0,0,0|2,0,0]=4 305 B9R1.15 CC1=CC=CN=C1CCl C46105 [2,0,0,0,0,0|2,0,0]=4 306 B9R1.15 CC1=CC=CN=C1CN M46460 [2,0,0,0,0,0|1,0,0]=3 307 B9R1.15 CC1=CC=CN=C1CO H46388 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.15 CC1=CN=NC=C1CN A14785 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.15 CC1=NC=CN=C1CN A11549 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.15 CCC1=C(Br)C=CC=C1 B68946 [2,0,0,0,0,0|1,0,0]=3 311 B9R1.15 CCC1=C(Br)C=CC=N1 B23432 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.15 CCC1=C(Br)C=CN=C1 B10961 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.15 CCC1=C(Br)C=CN=C1 B30062 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.15 CCC1=C(Br)C=NC=C1 B23431 [2,0,0,0,0,0|2,0,0]=4 315 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [2,0,0,0,0,0|0,0,0]=2 316 B9R1.15 CCC1=C([Mg+])C=CC=C1 E31738 [2,0,0,0,0,0|1,0,0]=3 317 B9R1.15 CCC1=NC=CN=C1C E43603 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.15 CC[N+]1=C(Br)C=CC=C1 B46367 [2,0,0,0,0,0|2,0,0]=4 319 B9R1.15 CNC1=C(Br)C=CC=C1 B46075 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.15 CNC1=C(C)C=CC=C1 D46860 [2,0,0,0,0,0|1,0,0]=3 321 B9R1.15 CNC1=C(C)C=CN=C1 D67183 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.15 CNC1=C(Cl)C=CC=C1 C46094 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.15 CNC1=C(F)C=CC=C1 M39414 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.15 CNC1=C(N)C=CC=C1 M43618 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.15 CNC1=C(N)C=CC=C1 M68814 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.15 CNC1=C(O)C=CC=C1 M64657 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.15 COC1=C(Br)C=CC=C1 B67901 [2,0,0,0,0,0|2,0,0]=4 328 B9R1.15 COC1=C(I)C=CC=C1 K68160 [2,0,0,0,0,0|2,0,0]=4 329 B9R1.15 COC1=C([Mg+])C=CC=C1 M31742 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.15 COC1=NC=CC=C1C M46378 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.15 CSC1=C([Mg+])C=CC=C1 M31770 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.15 FC1=C(C[Mg+])C=CC=C1 F6778 [2,0,0,0,0,0|2,0,0]=4 333 B9R1.15 NC1=C(CO)C=CC=C1 A7795 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.15 NCC1=C(Br)C=CC=C1 B36643 [2,0,0,0,0,0|1,0,0]=3 335 B9R1.15 NCC1=C(Br)C=CN=C1 B63849 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.15 NCC1=C(Br)C=NC=C1 B36920 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.15 NCC1=C(Cl)C=CC=C1 C46097 [2,0,0,0,0,0|1,0,0]=3 338 B9R1.15 NCC1=C(Cl)C=CC=C1 C46104 [2,0,0,0,0,0|1,0,0]=3 339 B9R1.15 NCC1=C(Cl)C=CC=N1 A14307 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.15 NCC1=C(Cl)C=CC=N1 C29809 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.15 NCC1=C(F)C=CC=C1 F26320 [2,0,0,0,0,0|1,0,0]=3 342 B9R1.15 NCC1=C(F)C=CC=N1 A12648 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.15 NCC1=C(F)C=CC=N1 A1712 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.15 NCC1=C(F)C=CC=N1 F61824 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.15 NCC1=C(F)C=NC=C1 F9408 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.15 NCC1=C(I)C=CC=C1 I36799 [2,0,0,0,0,0|1,0,0]=3 347 B9R1.15 NCC1=C(O)C=CC=C1 A38718 [2,0,0,0,0,0|1,0,0]=3 348 B9R1.15 NCC1=C(O)C=CC=C1 A46574 [2,0,0,0,0,0|1,0,0]=3 349 B9R1.15 NCC1=C(O)C=CC=N1 A43199 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.15 NCC1=C(O)C=NC=C1 A43200 [2,0,0,0,0,0|2,0,0]=4 351 B9R1.15 NCC1=CC=CN=C1Cl A10464 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.15 NCC1=CC=CN=C1F F43528 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.15 NNC1=C(Br)C=CC=C1 B39273 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.15 NNC1=C(Cl)C=CC=C1 C39274 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.15 NNC1=C(F)C=CC=C1 F39286 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.15 NNC1=C(I)C=CC=C1 K43028 [2,0,0,0,0,0|2,0,0]=4 357 B9R1.15 OCC1=C(Br)C=CC=C1 B39402 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.15 OCC1=C(Cl)C=CC=C1 C68885 [2,0,0,0,0,0|2,0,0]=4 359 B9R1.15 OCC1=C(F)C=CC=C1 F39407 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.15 OCC1=C(I)C=CC=C1 K45967 [2,0,0,0,0,0|2,0,0]=4 361 B9R1.2 BrCC1=CC=CC(Br)=C1 B39369 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.2 BrCC1=CC=CC(I)=C1 B45170 [2,0,0,0,0,0|2,0,0]=4 363 B9R1.2 C#CC1=CC(C)=CC=C1 E51331 [2,0,0,0,0,0|0,0,2]=4 364 B9R1.2 CC1=CC(CCl)=CN=C1 C46109 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.2 CC1=CC(CCl)=NC=C1 C46106 [2,0,0,0,0,0|2,0,0]=4 366 B9R1.2 CC1=CC(CN)=NC=C1 A62602 [2,0,0,0,0,0|1,0,0]=3 367 B9R1.2 CC1=CC(CN)=NC=C1 M46587 [2,0,0,0,0,0|1,0,0]=3 368 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [2,0,0,0,0,0|2,0,0]=4 369 B9R1.2 CC1=CC(CO)=NC=C1 M46387 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.2 CC1=CC=CC(CBr)=N1 B46087 [2,0,0,0,0,0|2,0,0]=4 371 B9R1.2 CC1=CC=CC(CCl)=N1 C46103 [2,0,0,0,0,0|2,0,0]=4 372 B9R1.2 CC1=CC=CC(CN)=C1 M37355 [2,0,0,0,0,0|0,0,0]=2 373 B9R1.2 CC1=CC=CC(CN)=N1 M24786 [2,0,0,0,0,0|1,0,0]=3 374 B9R1.2 CC1=CC=CC(CN)=N1 M63579 [2,0,0,0,0,0|1,0,0]=3 375 B9R1.2 CC1=CC=CC(CO)=N1 M46384 [2,0,0,0,0,0|2,0,0]=4 376 B9R1.2 CC1=CC=CC(NN)=C1 M46458 [2,0,0,0,0,0|1,0,0]=3 377 B9R1.2 CC1=CC=CC(NN)=N1 H69493 [2,0,0,0,0,0|2,0,0]=4 378 B9R1.2 CC1=CC=NC(CN)=N1 A14426 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.2 CC1=CC=NC(CN)=N1 M29730 [2,0,0,0,0,0|2,0,0]=4 380 B9R1.2 CC1=CN=NC(CN)=C1 A13026 [2,0,0,0,0,0|2,0,0]=4 381 B9R1.2 CC1=CN=NC(CN)=C1 M27097 [2,0,0,0,0,0|2,0,0]=4 382 B9R1.2 CC1=NC=CC(CBr)=C1 B37231 [2,0,0,0,0,0|2,0,0]=4 383 B9R1.2 CC1=NC=CC(CN)=C1 M46586 [2,0,0,0,0,0|1,0,0]=3 384 B9R1.2 CC1=NC=CC(CO)=C1 M4019 [2,0,0,0,0,0|2,0,0]=4 385 B9R1.2 CCC1=CC(Br)=CN=C1 B46076 [2,0,0,0,0,0|2,0,0]=4 386 B9R1.2 CCC1=CC(N)=NC=C1 E4696 [2,0,0,0,0,0|2,0,0]=4 387 B9R1.2 CCC1=CC=CC(Br)=C1 B49158 [2,0,0,0,0,0|1,0,0]=3 388 B9R1.2 CCC1=CC=CC(Br)=N1 B46074 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.2 CCC1=CC=CC(N)=C1 E68361 [2,0,0,0,0,0|1,0,0]=3 390 B9R1.2 CCC1=CC=CC(N)=N1 E43601 [2,0,0,0,0,0|2,0,0]=4 391 B9R1.2 CCC1=CC=CC([Mg+])=C1 E31740 [2,0,0,0,0,0|1,0,0]=3 392 B9R1.2 CCC1=CN=CC(N)=C1 E37485 [2,0,0,0,0,0|2,0,0]=4 393 B9R1.2 CCC1=NC=CC(Br)=C1 B46078 [2,0,0,0,0,0|2,0,0]=4 394 B9R1.2 CCC1=NC=CC(N)=C1 A15478 [2,0,0,0,0,0|2,0,0]=4 395 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [2,0,0,0,0,0|1,0,0]=3 396 B9R1.2 CNC1=CC=CC(Br)=C1 B46077 [2,0,0,0,0,0|2,0,0]=4 397 B9R1.2 CNC1=CC=CC(Br)=C1 B66504 [2,0,0,0,0,0|2,0,0]=4 398 B9R1.2 CNC1=NC(C)=CC=C1 D43615 [2,0,0,0,0,0|2,0,0]=4 399 B9R1.2 COC1=CC(C)=NC=C1 M22575 [2,0,0,0,0,0|2,0,0]=4 400 B9R1.2 COC1=CC(O)=CC=C1 M27960 [2,0,0,0,0,0|2,0,0]=4 401 B9R1.2 COC1=CC=CC(F)=C1 F45965 [2,0,0,0,0,0|2,0,0]=4 402 B9R1.2 COC1=CC=CC(I)=C1 K45966 [2,0,0,0,0,0|2,0,0]=4 403 B9R1.2 COC1=CC=CC([Mg+])=C1 M31743 [2,0,0,0,0,0|2,0,0]=4 404 B9R1.2 COC1=NC(C)=CC=C1 M46380 [2,0,0,0,0,0|2,0,0]=4 405 B9R1.2 COC1=NC=CC(C)=C1 M46379 [2,0,0,0,0,0|2,0,0]=4 406 B9R1.2 CSC1=CC(N)=CC=C1 M46442 [2,0,0,0,0,0|2,0,0]=4 407 B9R1.2 CSC1=CC=CC(Br)=C1 B45613 [2,0,0,0,0,0|2,0,0]=4 408 B9R1.2 ClC1=CC=CC(CBr)=C1 B39371 [2,0,0,0,0,0|2,0,0]=4 409 B9R1.2 ClCC1=CC=CC(Br)=C1 B45159 [2,0,0,0,0,0|2,0,0]=4 410 B9R1.2 ClCC1=CC=CC(I)=C1 C45183 [2,0,0,0,0,0|2,0,0]=4 411 B9R1.2 FC1=CC=CC(CBr)=C1 B45165 [2,0,0,0,0,0|2,0,0]=4 412 B9R1.2 NC1=CC=CC(CO)=C1 A37868 [2,0,0,0,0,0|2,0,0]=4 413 B9R1.2 NCC1=CC(=O)NC=C1 A1717 [2,0,0,0,0,0|2,0,0]=4 414 B9R1.2 NCC1=CC(Br)=NC=C1 B25759 [2,0,0,0,0,0|2,0,0]=4 415 B9R1.2 NCC1=CC(Cl)=NC=C1 A10467 [2,0,0,0,0,0|2,0,0]=4 416 B9R1.2 NCC1=CC(Cl)=NC=C1 C30000 [2,0,0,0,0,0|2,0,0]=4 417 B9R1.2 NCC1=CC(F)=CN=C1 F5829 [2,0,0,0,0,0|2,0,0]=4 418 B9R1.2 NCC1=CC(F)=NC=C1 F43572 [2,0,0,0,0,0|2,0,0]=4 419 B9R1.2 NCC1=CC(F)=NC=C1 F61414 [2,0,0,0,0,0|2,0,0]=4 420 B9R1.2 NCC1=CC(N)=NC=C1 A43343 [2,0,0,0,0,0|2,0,0]=4 421 B9R1.2 NCC1=CC=CC(Br)=C1 B46079 [2,0,0,0,0,0|1,0,0]=3 422 B9R1.2 NCC1=CC=CC(Br)=N1 B42981 [2,0,0,0,0,0|2,0,0]=4 423 B9R1.2 NCC1=CC=CC(Cl)=C1 C46098 [2,0,0,0,0,0|1,0,0]=3 424 B9R1.2 NCC1=CC=CC(Cl)=N1 C43006 [2,0,0,0,0,0|2,0,0]=4 425 B9R1.2 NCC1=CC=CC(F)=C1 F15968 [2,0,0,0,0,0|1,0,0]=3 426 B9R1.2 NCC1=CC=CC(I)=C1 K46122 [2,0,0,0,0,0|1,0,0]=3 427 B9R1.2 NCC1=CC=CC(N)=C1 A43599 [2,0,0,0,0,0|1,0,0]=3 428 B9R1.2 NCC1=NC=CC(Br)=C1 A1747 [2,0,0,0,0,0|2,0,0]=4 429 B9R1.2 NCC1=NC=CC(Br)=C1 B42982 [2,0,0,0,0,0|2,0,0]=4 430 B9R1.2 NCC1=NC=CC(Cl)=C1 A14281 [2,0,0,0,0,0|2,0,0]=4 431 B9R1.2 NCC1=NC=CC(F)=C1 F43529 [2,0,0,0,0,0|2,0,0]=4 432 B9R1.2 NNC1=CC=CC(Br)=C1 B42979 [2,0,0,0,0,0|2,0,0]=4 433 B9R1.2 NNC1=CC=CC(F)=C1 F43527 [2,0,0,0,0,0|2,0,0]=4 434 B9R1.2 OC1=CC=CC(CBr)=C1 B38962 [2,0,0,0,0,0|2,0,0]=4 435 B9R1.2 OCC1=CC=CC(Cl)=C1 C39405 [2,0,0,0,0,0|2,0,0]=4 436 B9R1.2 OCC1=CC=CC(F)=C1 F39408 [2,0,0,0,0,0|2,0,0]=4 437 B9R1.2 OCC1=CC=CC(I)=C1 H61971 [2,0,0,0,0,0|2,0,0]=4 438 B9R1.69 CC1=C(Br)C=C(Br)C=C1 D45155 [2,0,0,0,0,0|2,0,0]=4 439 B9R1.69 CC1=C(Br)C=C(F)C=C1 B68836 [2,0,0,0,0,0|2,0,0]=4 440 B9R1.69 CC1=C(Br)C=C(I)C=C1 B45176 [2,0,0,0,0,0|2,0,0]=4 441 B9R1.69 CC1=C(Br)C=C(N)C=C1 B39411 [2,0,0,0,0,0|2,0,0]=4 442 B9R1.69 CC1=C(Br)C=C(O)C=C1 B45948 [2,0,0,0,0,0|2,0,0]=4 443 B9R1.69 CC1=C(Br)C=CC(Br)=C1 D39368 [2,0,0,0,0,0|2,0,0]=4 444 B9R1.69 CC1=C(Br)C=CC(Cl)=C1 B9485 [2,0,0,0,0,0|2,0,0]=4 445 B9R1.69 CC1=C(Br)C=CC(F)=C1 B45168 [2,0,0,0,0,0|2,0,0]=4 446 B9R1.69 CC1=C(Br)C=CC(I)=C1 B45173 [2,0,0,0,0,0|2,0,0]=4 447 B9R1.69 CC1=C(Br)C=CC(N)=C1 B61976 [2,0,0,0,0,0|2,0,0]=4 448 B9R1.69 CC1=C(Br)C=CC(N)=C1 B67860 [2,0,0,0,0,0|2,0,0]=4 449 B9R1.69 CC1=C(Br)C=CC(O)=C1 B39404 [2,0,0,0,0,0|2,0,0]=4 450 B9R1.69 CC1=C(C)C=C(F)C=C1 F49166 [2,0,0,0,0,0|1,0,0]=3 451 B9R1.69 CC1=C(C)C=C(I)C=C1 K49170 [2,0,0,0,0,0|1,0,0]=3 452 B9R1.69 CC1=C(C)C=C([Mg+])C=C1 D31727 [2,0,0,0,0,0|1,0,0]=3 453 B9R1.69 CC1=C(C)N=C(Cl)C=C1 C46102 [2,0,0,0,0,0|2,0,0]=4 454 B9R1.69 CC1=C(C)N=C(N)C=C1 D24371 [2,0,0,0,0,0|2,0,0]=4 455 B9R1.69 CC1=C(Cl)C=C(Br)C=C1 B39370 [2,0,0,0,0,0|2,0,0]=4 456 B9R1.69 CC1=C(Cl)C=C(F)C=C1 C60661 [2,0,0,0,0,0|2,0,0]=4 457 B9R1.69 CC1=C(Cl)C=C(N)C=C1 C65827 [2,0,0,0,0,0|2,0,0]=4 458 B9R1.69 CC1=C(Cl)C=C(O)C=C1 C45955 [2,0,0,0,0,0|2,0,0]=4 459 B9R1.69 CC1=C(Cl)C=C([Mg+])C=C1 C31809 [2,0,0,0,0,0|2,0,0]=4 460 B9R1.69 CC1=C(Cl)C=CC(Br)=C1 B45163 [2,0,0,0,0,0|2,0,0]=4 461 B9R1.69 CC1=C(Cl)C=CC(I)=C1 C45179 [2,0,0,0,0,0|2,0,0]=4 462 B9R1.69 CC1=C(Cl)C=CC(N)=C1 C25031 [2,0,0,0,0,0|2,0,0]=4 463 B9R1.69 CC1=C(Cl)C=CC([Mg+])=C1 C31776 [2,0,0,0,0,0|2,0,0]=4 464 B9R1.69 CC1=C(F)C=C(Br)C=C1 B68837 [2,0,0,0,0,0|2,0,0]=4 465 B9R1.69 CC1=C(F)C=C(Cl)C=C1 C68878 [2,0,0,0,0,0|2,0,0]=4 466 B9R1.69 CC1=C(F)C=C(I)C=C1 F45194 [2,0,0,0,0,0|2,0,0]=4 467 B9R1.69 CC1=C(F)C=C(N)C=C1 F46113 [2,0,0,0,0,0|2,0,0]=4 468 B9R1.69 CC1=C(F)C=C(O)C=C1 F45960 [2,0,0,0,0,0|2,0,0]=4 469 B9R1.69 CC1=C(F)C=C([Mg+])C=C1 F31745 [2,0,0,0,0,0|2,0,0]=4 470 B9R1.69 CC1=C(F)C=CC(Cl)=C1 C45178 [2,0,0,0,0,0|2,0,0]=4 471 B9R1.69 CC1=C(F)C=CC(F)=C1 D45185 [2,0,0,0,0,0|2,0,0]=4 472 B9R1.69 CC1=C(F)C=CC(I)=C1 F39375 [2,0,0,0,0,0|2,0,0]=4 473 B9R1.69 CC1=C(F)C=CC(N)=C1 F39413 [2,0,0,0,0,0|2,0,0]=4 474 B9R1.69 CC1=C(F)C=CC(O)=C1 F45963 [2,0,0,0,0,0|2,0,0]=4 475 B9R1.69 CC1=C(F)C=CC([Mg+])=C1 F31747 [2,0,0,0,0,0|2,0,0]=4 476 B9R1.69 CC1=C(I)C=C(Br)C=C1 B37920 [2,0,0,0,0,0|2,0,0]=4 477 B9R1.69 CC1=C(I)C=C(Cl)C=C1 C38509 [2,0,0,0,0,0|2,0,0]=4 478 B9R1.69 CC1=C(I)C=C(F)C=C1 F45195 [2,0,0,0,0,0|2,0,0]=4 479 B9R1.69 CC1=C(I)C=C(N)C=C1 K46118 [2,0,0,0,0,0|2,0,0]=4 480 B9R1.69 CC1=C(I)C=CC(Br)=C1 B39374 [2,0,0,0,0,0|2,0,0]=4 481 B9R1.69 CC1=C(I)C=CC(Cl)=C1 C45182 [2,0,0,0,0,0|2,0,0]=4 482 B9R1.69 CC1=C(I)C=CC(F)=C1 F39376 [2,0,0,0,0,0|2,0,0]=4 483 B9R1.69 CC1=C(I)C=CC(O)=C1 K45969 [2,0,0,0,0,0|2,0,0]=4 484 B9R1.69 CC1=C(N)C=C(Br)C=C1 B39412 [2,0,0,0,0,0|1,0,0]=3 485 B9R1.69 CC1=C(N)C=C(I)C=C1 K46121 [2,0,0,0,0,0|1,0,0]=3 486 B9R1.69 CC1=C(N)C=C(O)C=C1 A38014 [2,0,0,0,0,0|1,0,0]=3 487 B9R1.69 CC1=C(N)C=CC(F)=C1 F68357 [2,0,0,0,0,0|2,0,0]=4 488 B9R1.69 CC1=C(N)C=CC(I)=C1 K46119 [2,0,0,0,0,0|2,0,0]=4 489 B9R1.69 CC1=C(N)C=CC(O)=C1 A39417 [2,0,0,0,0,0|2,0,0]=4 490 B9R1.69 CC1=C(N)N=C(Br)C=C1 B26268 [2,0,0,0,0,0|2,0,0]=4 491 B9R1.69 CC1=C(O)C=C(Br)C=C1 B45951 [2,0,0,0,0,0|2,0,0]=4 492 B9R1.69 CC1=C(O)C=C(F)C=C1 F45964 [2,0,0,0,0,0|2,0,0]=4 493 B9R1.69 CC1=C(O)C=C(O)C=C1 M28674 [2,0,0,0,0,0|2,0,0]=4 494 B9R1.69 CC1=C(O)C=CC(Br)=C1 B45950 [2,0,0,0,0,0|2,0,0]=4 495 B9R1.69 CC1=C(O)C=CC(F)=C1 F45962 [2,0,0,0,0,0|2,0,0]=4 496 B9R1.69 CC1=C(O)C=CC(I)=C1 K45968 [2,0,0,0,0,0|2,0,0]=4 497 B9R1.69 CC1=C(O)C=CC(N)=C1 A46374 [2,0,0,0,0,0|2,0,0]=4 498 B9R1.69 CC1=C([Mg+])C=C(F)C=C1 F31748 [2,0,0,0,0,0|2,0,0]=4 499 B9R1.69 CC1=C([Mg+])C=CC(Cl)=C1 C31775 [2,0,0,0,0,0|2,0,0]=4 500 B9R1.69 CC1=C([Mg+])C=CC(F)=C1 F31746 [2,0,0,0,0,0|2,0,0]=4 501 B9R1.69 CC1=CC(Br)=C(Br)C=C1 D45154 [2,0,0,0,0,0|2,0,0]=4 502 B9R1.69 CC1=CC(Br)=C(C)C=C1 D39511 [2,0,0,0,0,0|1,0,0]=3 503 B9R1.69 CC1=CC(Br)=C(C)C=N1 B46084 [2,0,0,0,0,0|2,0,0]=4 504 B9R1.69 CC1=CC(Br)=C(Cl)C=C1 B45156 [2,0,0,0,0,0|2,0,0]=4 505 B9R1.69 CC1=CC(Br)=C(I)C=C1 B45175 [2,0,0,0,0,0|2,0,0]=4 506 B9R1.69 CC1=CC(Br)=C(O)C=C1 B39403 [2,0,0,0,0,0|2,0,0]=4 507 B9R1.69 CC1=CC(Br)=CN=C1C B46085 [2,0,0,0,0,0|2,0,0]=4 508 B9R1.69 CC1=CC(C)=C(Br)C=C1 D39510 [2,0,0,0,0,0|1,0,0]=3 509 B9R1.69 CC1=CC(C)=C(Br)C=N1 B46086 [2,0,0,0,0,0|2,0,0]=4 510 B9R1.69 CC1=CC(C)=C([Mg+])C=C1 D31735 [2,0,0,0,0,0|1,0,0]=3 511 B9R1.69 CC1=CC(Cl)=C(Br)C=C1 B67676 [2,0,0,0,0,0|2,0,0]=4 512 B9R1.69 CC1=CC(Cl)=C(I)C=C1 C62467 [2,0,0,0,0,0|2,0,0]=4 513 B9R1.69 CC1=CC(Cl)=C(N)C=C1 C69100 [2,0,0,0,0,0|2,0,0]=4 514 B9R1.69 CC1=CC(Cl)=C(O)C=C1 C38476 [2,0,0,0,0,0|2,0,0]=4 515 B9R1.69 CC1=CC(F)=C(Br)C=C1 B39373 [2,0,0,0,0,0|2,0,0]=4 516 B9R1.69 CC1=CC(F)=C(C)C=C1 F49165 [2,0,0,0,0,0|1,0,0]=3 517 B9R1.69 CC1=CC(F)=C(Cl)C=C1 C45177 [2,0,0,0,0,0|2,0,0]=4 518 B9R1.69 CC1=CC(F)=C(F)C=C1 D45188 [2,0,0,0,0,0|2,0,0]=4 519 B9R1.69 CC1=CC(F)=C(I)C=C1 F45193 [2,0,0,0,0,0|2,0,0]=4 520 B9R1.69 CC1=CC(F)=C(O)C=C1 F45958 [2,0,0,0,0,0|2,0,0]=4 521 B9R1.69 CC1=CC(I)=C(Br)C=C1 B38445 [2,0,0,0,0,0|2,0,0]=4 522 B9R1.69 CC1=CC(I)=C(F)C=C1 F45191 [2,0,0,0,0,0|2,0,0]=4 523 B9R1.69 CC1=CC(I)=C(N)C=C1 K46116 [2,0,0,0,0,0|2,0,0]=4 524 B9R1.69 CC1=CC(I)=C(O)C=C1 K60967 [2,0,0,0,0,0|2,0,0]=4 525 B9R1.69 CC1=CC(N)=C(Br)C=C1 B39410 [2,0,0,0,0,0|1,0,0]=3 526 B9R1.69 CC1=CC(N)=C(Br)C=N1 A1741 [2,0,0,0,0,0|2,0,0]=4 527 B9R1.69 CC1=CC(N)=C(Cl)C=C1 C46092 [2,0,0,0,0,0|1,0,0]=3 528 B9R1.69 CC1=CC(N)=C(Cl)C=N1 C26973 [2,0,0,0,0,0|2,0,0]=4 529 B9R1.69 CC1=CC(N)=C(F)C=C1 A23738 [2,0,0,0,0,0|1,0,0]=3 530 B9R1.69 CC1=CC(N)=C(I)C=C1 K46117 [2,0,0,0,0,0|1,0,0]=3 531 B9R1.69 CC1=CC(N)=C(I)C=N1 K43023 [2,0,0,0,0,0|2,0,0]=4 532 B9R1.69 CC1=CC(N)=C(N)C=C1 D68596 [2,0,0,0,0,0|1,0,0]=3 533 B9R1.69 CC1=CC(N)=CN=C1C D43613 [2,0,0,0,0,0|2,0,0]=4 534 B9R1.69 CC1=CC(O)=C(Br)C=C1 B36626 [2,0,0,0,0,0|2,0,0]=4 535 B9R1.69 CC1=CC(O)=C(F)C=C1 F45959 [2,0,0,0,0,0|2,0,0]=4 536 B9R1.69 CC1=CC(O)=C(N)C=C1 A68595 [2,0,0,0,0,0|2,0,0]=4 537 B9R1.69 CC1=CC([Mg+])=C(C)C=C1 D31736 [2,0,0,0,0,0|1,0,0]=3 538 B9R1.69 CC1=CC=C(C)C(N)=N1 D43611 [2,0,0,0,0,0|1,0,0]=3 539 B9R1.69 CC1=CC=C(N)C(C)=N1 D43608 [2,0,0,0,0,0|2,0,0]=4 540 B9R1.69 CC1=CC=C(N)N=C1N M43333 [2,0,0,0,0,0|2,0,0]=4 541 B9R1.69 CC1=CN=C(Br)C(C)=C1 B46080 [2,0,0,0,0,0|2,0,0]=4 542 B9R1.69 CC1=CN=C(Br)C(N)=C1 A42977 [2,0,0,0,0,0|2,0,0]=4 543 B9R1.69 CC1=CN=C(Br)C=C1N B25405 [2,0,0,0,0,0|2,0,0]=4 544 B9R1.69 CC1=CN=C(C)C(C)=C1 T39433 [2,0,0,0,0,0|1,0,0]=3 545 B9R1.69 CC1=CN=C(C)C(N)=N1 D32397 [2,0,0,0,0,0|2,0,0]=4 546 B9R1.69 CC1=CN=C(C)C=C1N D22447 [2,0,0,0,0,0|1,0,0]=3 547 B9R1.69 CC1=CN=C(C)N=C1N D43337 [2,0,0,0,0,0|2,0,0]=4 548 B9R1.69 CC1=CN=C(Cl)C(N)=C1 C42993 [2,0,0,0,0,0|2,0,0]=4 549 B9R1.69 CC1=CN=C(Cl)C=C1N C25406 [2,0,0,0,0,0|2,0,0]=4 550 B9R1.69 CC1=CN=C(N)C(C)=C1 D43610 [2,0,0,0,0,0|2,0,0]=4 551 B9R1.69 CC1=CN=C(N)C(N)=C1 D43331 [2,0,0,0,0,0|2,0,0]=4 552 B9R1.69 CC1=CN=C(N)C=C1C D43612 [2,0,0,0,0,0|2,0,0]=4 553 B9R1.69 CC1=CN=C(O)C=C1N A43204 [2,0,0,0,0,0|2,0,0]=4 554 B9R1.69 CC1=CNC(=O)C(N)=C1 A43211 [2,0,0,0,0,0|2,0,0]=4 555 B9R1.69 CC1=NC(C)=C(Br)C=C1 B46082 [2,0,0,0,0,0|2,0,0]=4 556 B9R1.69 CC1=NC(C)=C(O)C=C1 D67987 [2,0,0,0,0,0|2,0,0]=4 557 B9R1.69 CC1=NC(N)=C(Br)C=C1 B18303 [2,0,0,0,0,0|2,0,0]=4 558 B9R1.69 CC1=NC(N)=C(I)C=C1 K61473 [2,0,0,0,0,0|2,0,0]=4 559 B9R1.69 CC1=NC(N)=C(O)C=C1 A43201 [2,0,0,0,0,0|2,0,0]=4 560 B9R1.69 CC1=NC=C(Br)C=C1N A0082 [2,0,0,0,0,0|2,0,0]=4 561 B9R1.69 CC1=NC=C(Cl)C=C1N A1755 [2,0,0,0,0,0|2,0,0]=4 562 B9R1.69 NC1=C(Br)C=CC(Cl)=C1 B42522 [2,0,0,0,0,0|2,0,0]=4 563 B9R1.69 NC1=C(Br)C=CC(F)=C1 B37345 [2,0,0,0,0,0|2,0,0]=4 564 B9R1.69 NC1=C(Br)C=CC(O)=C1 A42877 [2,0,0,0,0,0|2,0,0]=4 565 B9R1.69 NC1=C(Cl)C=CC(Br)=C1 B24501 [2,0,0,0,0,0|2,0,0]=4 566 B9R1.69 NC1=C(Cl)C=CC(F)=C1 C39258 [2,0,0,0,0,0|2,0,0]=4 567 B9R1.69 NC1=C(Cl)C=CC(O)=C1 A42898 [2,0,0,0,0,0|2,0,0]=4 568 B9R1.69 NC1=C(F)C=CC(Br)=C1 B39257 [2,0,0,0,0,0|2,0,0]=4 569 B9R1.69 NC1=C(F)C=CC(Cl)=C1 C39259 [2,0,0,0,0,0|2,0,0]=4 570 B9R1.69 NC1=C(F)C=CC(O)=C1 A42920 [2,0,0,0,0,0|2,0,0]=4 571 B9R1.69 NC1=C(I)C=CC(Br)=C1 B42555 [2,0,0,0,0,0|2,0,0]=4 572 B9R1.69 NC1=C(I)C=CC(Cl)=C1 C42581 [2,0,0,0,0,0|2,0,0]=4 573 B9R1.69 NC1=C(I)C=CC(F)=C1 F37769 [2,0,0,0,0,0|2,0,0]=4 574 B9R1.69 NC1=C(N)C=C(Br)C=C1 B42966 [2,0,0,0,0,0|2,0,0]=4 575 B9R1.69 NC1=C(N)C=C(Cl)C=C1 C67846 [2,0,0,0,0,0|2,0,0]=4 576 B9R1.69 NC1=C(N)C=C(F)C=C1 F43011 [2,0,0,0,0,0|2,0,0]=4 577 B9R1.69 NC1=C(N)C=C(I)C=C1 K43020 [2,0,0,0,0,0|2,0,0]=4 578 B9R1.69 NC1=C(O)C=CC(Br)=C1 A42876 [2,0,0,0,0,0|2,0,0]=4 579 B9R1.69 NC1=C(O)C=CC(F)=C1 A42918 [2,0,0,0,0,0|2,0,0]=4 580 B9R1.69 NC1=C(O)C=CC(O)=C1 A36668 [2,0,0,0,0,0|2,0,0]=4 581 B9R1.69 NC1=C(O)C=CC(O)=C1 A43535 [2,0,0,0,0,0|2,0,0]=4 582 B9R1.69 NC1=CC(N)=C(F)C=C1 F43012 [2,0,0,0,0,0|2,0,0]=4 583 B11R1.13 CC1=C(F)C=CC=C1CC#N F51462 [1,1,0,0,0,0|0,0,2]=4 584 B11R1.13 OCCC1=CC=CC(Cl)=C1Cl D49145 [1,1,0,0,0,0|2,0,0]=4 585 B11R1.17 CC1=C(CN=[N+]=[N-])C=CC=C1 M9125 [1,1,0,0,0,0|1,0,1]=4 586 B11R1.17 CC1=C(NCCO)C=CC=C1 H50355 [1,1,0,0,0,0|1,0,0]=3 587 B11R1.17 CC1=C(OCC#N)C=CC=C1 T51755 [1,1,0,0,0,0|0,0,2]=4 588 B11R1.17 CC1=C(OCCN)C=CC=C1 M50346 [1,1,0,0,0,0|0,0,0]=2 589 B11R1.17 CCCOC1=C(O)C=CC=C1 P50279 [1,1,0,0,0,0|2,0,0]=4 590 B11R1.17 OCCCC1=C(Br)C=CC=C1 B50150 [1,1,0,0,0,0|2,0,0]=4 591 B11R1.41 CNCC1=C(OC)C=CC=C1 M50356 [1,1,0,0,0,0|2,0,0]=4 592 B11R1.41 COC1=C(CC#N)C=CC=C1 M62292 [1,1,0,0,0,0|0,0,2]=4 593 B11R1.41 COC1=C(CCBr)C=CC=C1 B50155 [1,1,0,0,0,0|1,0,0]=3 594 B11R1.41 COC1=C(CCN)C=CC=C1 M66296 [1,1,0,0,0,0|0,0,0]=2 595 B11R1.41 COC1=C(CCO)C=CC=C1 M50284 [1,1,0,0,0,0|1,0,0]=3 596 B11R1.41 COC1=C(CNN)C=CC=C1 M12218 [1,1,0,0,0,0|1,0,0]=3 597 B11R1.41 N#CC1=C(CCBr)C=CC=C1 B51450 [1,1,0,0,0,0|1,0,1]=4 598 B11R1.41 N#CCC1=C(CBr)C=CC=C1 B51453 [1,1,0,0,0,0|0,0,2]=4 599 B11R1.41 O=CC1=C(CCBr)C=CC=C1 B52025 [1,1,0,0,0,0|1,0,1]=4 600 B11R1.81 CCCC1=C(O)C=C(O)C=C1 P50281 [1,1,0,0,0,0|2,0,0]=4 601 B11R1.81 ClC1=CC(Br)=C(CCBr)C=C1 B48298 [1,1,0,0,0,0|2,0,0]=4 602 B11R1.81 NCCC1=C(F)C=C(F)C=C1 D69468 [1,1,0,0,0,0|1,0,0]=3 603 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 D12478 [1,1,0,0,0,0|2,0,0]=4 604 B11R1.81 NNCC1=C(Cl)C=C(Cl)C=C1 D26039 [1,1,0,0,0,0|2,0,0]=4 605 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 C12475 [1,1,0,0,0,0|2,0,0]=4 606 B11R1.81 NNCC1=C(Cl)C=C(F)C=C1 C31594 [1,1,0,0,0,0|2,0,0]=4 607 B11R1.81 NOCC1=C(Cl)C=C(Cl)C=C1 D45883 [1,1,0,0,0,0|2,0,0]=4 608 B11R1.81 OCCC1=C(Cl)C=C(Cl)C=C1 D49147 [1,1,0,0,0,0|2,0,0]=4 609 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 T69090 [1,1,0,0,0,0|1,0,1]=4 610 B11R1.86 NC(=O)CC1=C(Cl)C=CC=C1 C49033 [1,1,0,0,0,0|1,0,1]=4 611 B11R1.222 CC1=C([C@H](C)C#N)C=CC=C1 T52504 [1,1,0,0,0,0|0,0,2]=4 612 B11R1.222 CCC(=O)C1=C(C)C=CC=C1 M52778 [1,1,0,0,0,0|1,0,1]=4 613 B11R1.222 CC[C@@H](N)C1=C(C)C=CC=C1 T54184 [1,1,0,0,0,0|1,0,0]=3 614 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 B53112 [1,1,0,0,0,0|2,0,0]=4 615 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 C50243 [1,1,0,0,0,0|2,0,0]=4 616 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 F52141 [1,1,0,0,0,0|2,0,0]=4 617 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 F52147 [1,1,0,0,0,0|2,0,0]=4 618 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 A52170 [1,1,0,0,0,0|2,0,0]=4 619 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 A69482 [1,1,0,0,0,0|1,0,1]=4 620 B11R1.222 N[C@H](CO)C1=C(Cl)C=CC=C1 A46809 [1,1,0,0,0,0|2,0,0]=4 621 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A46819 [1,1,0,0,0,0|2,0,0]=4 622 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A49515 [1,1,0,0,0,0|2,0,0]=4 623 B11R1.605 NCCC1=C(Cl)C=CC=C1Cl D64783 [1,1,0,0,0,0|1,0,0]=3 624 B11R1.605 OCCC1=C(Cl)C=CC=C1Cl D38686 [1,1,0,0,0,0|2,0,0]=4 625 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 B52023 [1,1,0,0,0,0|1,0,1]=4 626 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 M46653 [1,1,0,0,0,0|1,0,1]=4 627 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 A50349 [1,1,0,0,0,0|1,0,0]=3 628 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A50350 [1,1,0,0,0,0|1,0,0]=3 629 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A52173 [1,1,0,0,0,0|1,0,0]=3 630 B11R1.23 CC[C@@H](N)C1=CC(C)=CC=C1 T54183 [1,1,0,0,0,0|1,0,0]=3 631 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 F52145 [1,1,0,0,0,0|2,0,0]=4 632 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 B50234 [1,1,0,0,0,0|2,0,0]=4 633 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 F52148 [1,1,0,0,0,0|2,0,0]=4 634 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 A46787 [1,1,0,0,0,0|2,0,0]=4 635 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46801 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46803 [1,1,0,0,0,0|2,0,0]=4 637 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A64410 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A66336 [1,1,0,0,0,0|2,0,0]=4 639 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 A49514 [1,1,0,0,0,0|2,0,0]=4 640 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 A49526 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 A46799 [1,1,0,0,0,0|2,0,0]=4 642 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46804 [1,1,0,0,0,0|2,0,0]=4 643 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46810 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A46820 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A49516 [1,1,0,0,0,0|2,0,0]=4 646 B11R1.23 N[C@H](CO)C1=CC=CC(I)=C1 A11985 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 C49388 [1,1,0,0,0,0|2,0,0]=4 648 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C36827 [1,1,0,0,0,0|2,0,0]=4 649 B11R1.24 CC1=CC=CC(CCCO)=C1 M66328 [1,1,0,0,0,0|1,0,0]=3 650 B11R1.24 CC1=CC=CC(CN=[N+]=[N-])=C1 M9126 [1,1,0,0,0,0|1,0,1]=4 651 B11R1.24 CCCC[N+]1=CC(C)=CC=C1 B54248 [1,1,0,0,0,0|2,0,0]=4 652 B11R1.24 CCNCC1=CC=CC(Br)=C1 E50224 [1,1,0,0,0,0|2,0,0]=4 653 B11R1.24 CCNCC1=CC=CC(Cl)=C1 C50239 [1,1,0,0,0,0|2,0,0]=4 654 B11R1.24 CCNCC1=CC=CC(Cl)=C1 C50242 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.24 CCNCC1=CC=CC(F)=C1 F50251 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.24 FCCOC1=CC=CC(F)=C1 D49152 [1,1,0,0,0,0|2,0,0]=4 657 B11R1.24 O=CCCC1=CC=CC(Br)=C1 B64250 [1,1,0,0,0,0|2,0,0]=4 658 B11R1.24 OCCCC1=CC=CC(Br)=C1 B50149 [1,1,0,0,0,0|2,0,0]=4 659 B11R1.34 CC1=CC(F)=CC(CC#N)=C1 F51463 [1,1,0,0,0,0|0,0,2]=4 660 B11R1.34 FC1=CC(F)=CC(CCBr)=C1 B63546 [1,1,0,0,0,0|2,0,0]=4 661 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 B52868 [1,1,0,0,0,0|2,0,0]=4 662 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 T49882 [1,1,0,0,0,0|1,0,1]=4 663 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 A46654 [1,1,0,0,0,0|1,0,1]=4 664 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 C49034 [1,1,0,0,0,0|1,0,1]=4 665 B11R1.189 C=CCC1=CC=CC(OC)=C1 M52782 [1,1,0,0,0,0|1,0,1]=4 666 B11R1.189 CNCC1=CC=CC(OC)=C1 M50357 [1,1,0,0,0,0|2,0,0]=4 667 B11R1.189 COC1=CC(CC#N)=CC=C1 M22153 [1,1,0,0,0,0|0,0,2]=4 668 B11R1.189 COC1=CC(CCN)=CC=C1 M52171 [1,1,0,0,0,0|0,0,0]=2 669 B11R1.189 COC1=CC(CCN)=CC=C1 M67069 [1,1,0,0,0,0|0,0,0]=2 670 B11R1.189 COC1=CC(CCO)=CC=C1 M50285 [1,1,0,0,0,0|1,0,0]=3 671 B11R1.189 COC1=CC(CNN)=CC=C1 M0100 [1,1,0,0,0,0|1,0,0]=3 672 B11R1.189 N#CC1=CC=CC(CCO)=C1 H38259 [1,1,0,0,0,0|1,0,1]=4 673 B11R1.189 NCC1=CC=CC(CCO)=C1 A32377 [1,1,0,0,0,0|1,0,0]=3 674 B11R1.192 CCCC1=CC(F)=C(Br)C=C1 B49701 [1,1,0,0,0,0|2,0,0]=4 675 B11R1.192 CCOC1=CC(C)=C(Br)C=C1 B50152 [1,1,0,0,0,0|2,0,0]=4 676 B11R1.192 CNCC1=CC(C)=C(C)C=C1 D53119 [1,1,0,0,0,0|2,0,0]=4 677 B11R1.192 FC1=C(F)C=C(CCBr)C=C1 B48302 [1,1,0,0,0,0|2,0,0]=4 678 B11R1.192 OCCC1=CC(Cl)=C(Cl)C=C1 D49146 [1,1,0,0,0,0|2,0,0]=4 679 B11R1.192 OCCC1=CC(F)=C(Cl)C=C1 C49151 [1,1,0,0,0,0|2,0,0]=4 680 B11R1.8 CC1=CC(C#N)=C(C)C(N)=C1 A49713 [1,1,0,0,0,0|0,0,2]=4 681 B11R1.8 COC1=C(C)C(C)=CC(C)=C1 M53084 [1,1,0,0,0,0|1,0,0]=3 682 B11R1.8 COC1=CC(C)=CC(F)=C1O F49394 [1,1,0,0,0,0|2,0,0]=4 683 B11R1.8 NCC1=CC(F)=CC(F)=C1F T38161 [1,1,0,0,0,0|2,0,0]=4 684 B11R1.37 BrCC1=C(CBr)C=C(Br)C=C1 B48300 [1,1,0,0,0,0|2,0,0]=4 685 B11R1.37 CCC1=C(C=O)C=CC(Br)=C1 B37466 [1,1,0,0,0,0|1,0,1]=4 686 B11R1.37 CCC1=C(OC)C=CC(Br)=C1 B50154 [1,1,0,0,0,0|1,0,0]=3 687 B11R1.37 CCC1=NC=C(C)N=C1CC D50396 [1,1,0,0,0,0|2,0,0]=4 688 B11R1.37 COC1=C(C#N)C=C(C)C=C1 M24107 [1,1,0,0,0,0|0,0,2]=4 689 B11R1.37 COC1=C(C#N)C=CC(C)=C1 M51760 [1,1,0,0,0,0|1,0,1]=4 690 B11R1.37 COC1=C(C=O)C=C(C)C=C1 M65814 [1,1,0,0,0,0|1,0,1]=4 691 B11R1.37 COC1=C(C=O)C=CC(C)=C1 M49887 [1,1,0,0,0,0|1,0,1]=4 692 B11R1.37 COC1=C(CBr)C=C(Br)C=C1 B49131 [1,1,0,0,0,0|2,0,0]=4 693 B11R1.37 COC1=C(CBr)C=C(F)C=C1 B49141 [1,1,0,0,0,0|2,0,0]=4 694 B11R1.37 COC1=C(CBr)C=CC(Br)=C1 B38655 [1,1,0,0,0,0|2,0,0]=4 695 B11R1.37 COC1=C(CN)C=C(Br)C=C1 B38149 [1,1,0,0,0,0|1,0,0]=3 696 B11R1.37 COC1=C(CN)C=C(Cl)C=C1 C46807 [1,1,0,0,0,0|1,0,0]=3 697 B11R1.37 COC1=C(CN)C=C(N)C=C1 A49668 [1,1,0,0,0,0|1,0,0]=3 698 B11R1.37 COC1=C(CN)C=CC(F)=C1 F46817 [1,1,0,0,0,0|2,0,0]=4 699 B11R1.37 COC1=C(CO)C=C(Br)C=C1 B65332 [1,1,0,0,0,0|2,0,0]=4 700 B11R1.37 COC1=C(CO)C=C(F)C=C1 F49396 [1,1,0,0,0,0|2,0,0]=4 701 B11R1.37 COC1=C(CO)C=CC(Br)=C1 B49376 [1,1,0,0,0,0|2,0,0]=4 702 B11R1.37 COC1=C(CO)C=CC(O)=C1 H4698 [1,1,0,0,0,0|2,0,0]=4 703 B11R1.37 COC1=C(OC)C=C(Br)C=C1 B39520 [1,1,0,0,0,0|2,0,0]=4 704 B11R1.37 COC1=C(OC)C=C(F)C=C1 F49393 [1,1,0,0,0,0|2,0,0]=4 705 B11R1.37 COC1=C(OC)C=C(I)C=C1 K49399 [1,1,0,0,0,0|2,0,0]=4 706 B11R1.37 COC1=C(OC)C=C(N)C=C1 D39436 [1,1,0,0,0,0|2,0,0]=4 707 B11R1.37 COC1=C(OC)C=C([Mg+])C=C1 D31789 [1,1,0,0,0,0|2,0,0]=4 708 B11R1.37 COC1=CC(C)=CN=C1OC D46918 [1,1,0,0,0,0|2,0,0]=4 709 B11R1.37 COC1=NC=C(Br)C=C1CN A10481 [1,1,0,0,0,0|2,0,0]=4 710 B11R1.72 CC1=CC=C(Cl)C(CCl)=C1Cl D32379 [1,1,0,0,0,0|2,0,0]=4 711 B11R1.72 CC1=CC=C(Cl)C(CO)=C1Cl D49150 [1,1,0,0,0,0|2,0,0]=4 712 B11R1.72 NCC1=C(F)C=CC(Cl)=C1F C32160 [1,1,0,0,0,0|2,0,0]=4 713 B11R1.167 CC(=O)C1=C(C)C=CC(Br)=C1 B61483 [1,1,0,0,0,0|1,0,1]=4 714 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 F62666 [1,1,0,0,0,0|1,0,1]=4 715 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 H49899 [1,1,0,0,0,0|1,0,1]=4 716 B11R1.167 CC(C)C1=C(F)C=CC(I)=C1 F49705 [1,1,0,0,0,0|2,0,0]=4 717 B11R1.167 CC(C)C1=C(I)C=CC(Br)=C1 B49703 [1,1,0,0,0,0|2,0,0]=4 718 B11R1.167 CC1=C([C@H](C)O)C=C(Cl)C=C1 C50163 [1,1,0,0,0,0|1,0,0]=3 719 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 D2940 [1,1,0,0,0,0|2,0,0]=4 720 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 D39532 [1,1,0,0,0,0|1,0,1]=4 721 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 A46652 [1,1,0,0,0,0|1,0,1]=4 722 B11R1.167 CC1=CC([N+](=O)[O-])=C(C)C=C1 D39515 [1,1,0,0,0,0|2,0,0]=4 723 B11R1.167 C[C@@H](N)C1=C(F)C=CC(F)=C1 D49635 [1,1,0,0,0,0|2,0,0]=4 724 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 C49238 [1,1,0,0,0,0|2,0,0]=4 725 B11R1.167 C[C@H](O)C1=C(Cl)C=CC(Cl)=C1 D68314 [1,1,0,0,0,0|2,0,0]=4 726 B11R1.167 C[C@H](O)C1=C(F)C=CC(Br)=C1 B49140 [1,1,0,0,0,0|2,0,0]=4 727 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 F62425 [1,1,0,0,0,0|2,0,0]=4 728 B11R1.277 CC1=CC(C=O)=C(C)C=C1O H49895 [1,1,0,0,0,0|1,0,1]=4 729 B11R1.277 CCC1=CC(F)=C(F)C=C1N E49247 [1,1,0,0,0,0|2,0,0]=4 730 B11R1.277 CCC1=NC(C)=C(C)N=C1C E50397 [1,1,0,0,0,0|2,0,0]=4 731 B11R1.277 COC1=C(Br)C=C(N)C(C)=C1 B46791 [1,1,0,0,0,0|2,0,0]=4 732 B11R1.277 COC1=CC(Br)=C(N)C=C1C B46788 [1,1,0,0,0,0|2,0,0]=4 733 B11R1.277 COC1=CC(N)=C(Br)C=C1C B46789 [1,1,0,0,0,0|2,0,0]=4 734 B11R1.277 NCC1=CC(Cl)=C(F)C=C1F C45322 [1,1,0,0,0,0|2,0,0]=4 735 B11R1.280 CCC1=C(Br)C=CC(C#N)=C1 B51449 [1,1,0,0,0,0|1,0,1]=4 736 B11R1.280 CCC1=C(F)C=CC(C#N)=C1 E51459 [1,1,0,0,0,0|1,0,1]=4 737 B11R1.280 CCC1=C(N)C=CC(C#N)=C1 A49710 [1,1,0,0,0,0|1,0,1]=4 738 B11R1.280 COC1=C(Br)C=CC(CO)=C1 B49380 [1,1,0,0,0,0|2,0,0]=4 739 B11R1.280 COC1=C(C)C=CC(C#N)=C1 M51762 [1,1,0,0,0,0|1,0,1]=4 740 B11R1.280 COC1=C(C)C=CC(C=O)=C1 M49889 [1,1,0,0,0,0|1,0,1]=4 741 B11R1.280 COC1=C(Cl)C=CC(CBr)=C1 B49133 [1,1,0,0,0,0|2,0,0]=4 742 B11R1.280 COC1=C(Cl)C=CC(CO)=C1 C49387 [1,1,0,0,0,0|2,0,0]=4 743 B11R1.280 COC1=C(F)C=CC(CBr)=C1 B49142 [1,1,0,0,0,0|2,0,0]=4 744 B11R1.280 COC1=C(N)C=CC(CO)=C1 A46925 [1,1,0,0,0,0|2,0,0]=4 745 B11R1.280 COC1=C(O)C=CC(CN)=C1 A68828 [1,1,0,0,0,0|2,0,0]=4 746 B11R1.280 COC1=CC(C=O)=C(C)C=C1 M49892 [1,1,0,0,0,0|1,0,1]=4 747 B11R1.280 COC1=CC(CBr)=C(Br)C=C1 B49130 [1,1,0,0,0,0|2,0,0]=4 748 B11R1.280 COC1=CC(CN)=C(Br)C=C1 B46795 [1,1,0,0,0,0|1,0,0]=3 749 B11R1.280 COC1=CC(CO)=C(Br)C=C1 B49378 [1,1,0,0,0,0|2,0,0]=4 750 B11R1.280 COC1=CC(CO)=C(C)C=C1 M50289 [1,1,0,0,0,0|1,0,0]=3 751 B11R1.280 COC1=CC(CO)=C(N)C=C1 A46923 [1,1,0,0,0,0|2,0,0]=4 752 B11R1.280 COC1=CC(OC)=C(Br)C=C1 D3157 [1,1,0,0,0,0|2,0,0]=4 753 B11R1.280 COC1=CC(OC)=C(O)C=C1 D46840 [1,1,0,0,0,0|2,0,0]=4 754 B11R1.280 COC1=CC(OC)=C([Mg+])C=C1 D31787 [1,1,0,0,0,0|2,0,0]=4 755 B11R1.465 CC1=NOC(C)=C1CCCN D62557 [0,1,0,0,1,0|2,0,0]=4 756 B13R1.3980 CCCC1=C(CN)C(=O)NC(C)=C1 A53184 [0,2,0,0,0,0|2,0,0]=4 757 B13R1.656 COCCOC1=C(C)C=CC(N)=C1 M53150 [0,2,0,0,0,0|2,0,0]=4 758 B11R2.10 BrC1CC2=C(C=CC=C2)C1 B51667 [1,0,0,1,0,0|1,0,0]=3 759 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 M13896 [1,0,0,1,0,0|2,0,0]=4 760 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 M15830 [1,0,0,1,0,0|2,0,0]=4 761 B11R2.10 O=C1CC2=C(C=CC=C2)C1 K24552 [1,0,0,1,0,0|1,0,1]=4 762 B11R2.10 OC1CC2=C(C=CC=C2)C1 D67665 [1,0,0,1,0,0|1,0,0]=3 763 B11R2.20 C1=CC2=C(C=C1)COCC2 C39527 [1,0,0,1,0,0|1,0,0]=3 764 B11R2.20 C1=CC2=C(C=C1)NCCC2 T37825 [1,0,0,1,0,0|2,0,0]=4 765 B11R2.20 C1=CC2=C(C=C1)OCCC2 D66932 [1,0,0,1,0,0|2,0,0]=4 766 B11R2.20 C1=CC2=C(C=N1)CCCC2 T49977 [1,0,0,1,0,0|2,0,0]=4 767 B11R2.20 C1=CC2=C(C=N1)CCNC2 T49657 [1,0,0,1,0,0|1,0,0]=3 768 B11R2.20 C1=CC2=C(C=N1)CCNC2 T69820 [1,0,0,1,0,0|1,0,0]=3 769 B11R2.20 C1=CC2=C(C=N1)CNCC2 N14836 [1,0,0,1,0,0|1,0,0]=3 770 B11R2.20 C1=CC2=C(C=N1)CNCC2 T49489 [1,0,0,1,0,0|1,0,0]=3 771 B11R2.20 C1=CN=C2CCCCC2=C1 T64966 [1,0,0,1,0,0|2,0,0]=4 772 B11R2.20 C1=CN=C2CCNCC2=C1 T23208 [1,0,0,1,0,0|1,0,0]=3 773 B11R2.20 C1=CN=C2CCNCC2=C1 T4076 [1,0,0,1,0,0|1,0,0]=3 774 B11R2.20 C1=CN=C2CCNCC2=C1 T5331 [1,0,0,1,0,0|1,0,0]=3 775 B11R2.20 C1=CN=C2CNCCC2=C1 T13476 [1,0,0,1,0,0|1,0,0]=3 776 B11R2.20 C1=CN=C2CNCCC2=C1 T18760 [1,0,0,1,0,0|1,0,0]=3 777 B11R2.20 C1=CN=C2CNCCC2=C1 T23221 [1,0,0,1,0,0|1,0,0]=3 778 B11R2.20 C1=NC=C2CCNCC2=N1 T11295 [1,0,0,1,0,0|2,0,0]=4 779 B11R2.20 C1=NC=C2CNCCC2=N1 T11293 [1,0,0,1,0,0|2,0,0]=4 780 B11R2.20 C1=NC=C2CNCCC2=N1 T1801 [1,0,0,1,0,0|2,0,0]=4 781 B11R2.20 C1=NC=C2CNCCC2=N1 T5337 [1,0,0,1,0,0|2,0,0]=4 782 B11R2.55 NC1=C(C2CC2)C=CC=C1 C37591 [1,0,0,1,0,0|2,0,0]=4 783 B11R2.106 BrC1=C2CCCC2=CC=C1 B10979 [1,0,0,1,0,0|2,0,0]=4 784 B11R2.106 BrC1=C2CCNC2=CC=C1 B48872 [1,0,0,1,0,0|1,0,0]=3 785 B11R2.106 BrC1=C2CCNC2=CN=C1 B60365 [1,0,0,1,0,0|2,0,0]=4 786 B11R2.106 BrC1=C2CCNC2=NC=C1 B19352 [1,0,0,1,0,0|2,0,0]=4 787 B11R2.106 CC1=C2CCCC2=CC=C1 M52674 [1,0,0,1,0,0|1,0,0]=3 788 B11R2.106 CC1=CC=CC2=C1C=CN2 M2328 [1,0,0,1,0,0|0,0,2]=4 789 B11R2.106 CC1=CC=CC2=C1C=NN2 M9759 [1,0,0,1,0,0|1,0,1]=4 790 B11R2.106 ClC1=C2CCNC2=CC=C1 C48879 [1,0,0,1,0,0|1,0,0]=3 791 B11R2.106 ClC1=C2CCNC2=NC=C1 C30162 [1,0,0,1,0,0|2,0,0]=4 792 B11R2.106 ClC1=NC=CC2=C1CCN2 C14624 [1,0,0,1,0,0|2,0,0]=4 793 B11R2.106 ClC1=NC=CC2=C1CCN2 C5708 [1,0,0,1,0,0|2,0,0]=4 794 B11R2.106 IC1=C2CCCC2=CC=C1 K51671 [1,0,0,1,0,0|2,0,0]=4 795 B11R2.106 NC1=CC=CC2=C1CCN2 K46638 [1,0,0,1,0,0|1,0,0]=3 796 B11R2.106 NC1=CC=CC2=C1CCO2 A12891 [1,0,0,1,0,0|2,0,0]=4 797 B11R2.106 O=C1C=CC=C2NCCN12 D45988 [1,0,0,1,0,0|2,0,0]=4 798 B11R2.106 OC1=C2CCCC2=CC=C1 K49868 [1,0,0,1,0,0|2,0,0]=4 799 B11R2.106 OC1=C2CCNC2=NC=C1 D62930 [1,0,0,1,0,0|2,0,0]=4 800 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 B49879 [1,0,0,1,0,0|1,0,0]=3 801 B11R2.35 BrC1=CC(C2CC2)=CC=C1 B67707 [1,0,0,1,0,0|2,0,0]=4 802 B11R2.35 NC1=CC(C2CC2)=CC=C1 C49975 [1,0,0,1,0,0|2,0,0]=4 803 B11R2.36 BrC1=CC2=C(C=C1)NCC2 B22435 [1,0,0,1,0,0|1,0,0]=3 804 B11R2.36 BrC1=CC2=C(C=C1)OCC2 B24807 [1,0,0,1,0,0|2,0,0]=4 805 B11R2.36 BrC1=CN=C2NCCC2=C1 B12242 [1,0,0,1,0,0|2,0,0]=4 806 B11R2.36 BrC1=CN=C2NCCC2=C1 B30154 [1,0,0,1,0,0|2,0,0]=4 807 B11R2.36 BrC1=NC2=C(C=C1)NCC2 B45617 [1,0,0,1,0,0|2,0,0]=4 808 B11R2.36 CC1=CC2=C(C=C1)NC=C2 M2329 [1,0,0,1,0,0|0,0,2]=4 809 B11R2.36 CC1=CC2=C(C=C1)NCC2 M49974 [1,0,0,1,0,0|0,0,0]=2 810 B11R2.36 CC1=CC2=C(C=C1)NN=C2 M9605 [1,0,0,1,0,0|1,0,1]=4 811 B11R2.36 CC1=CC2=C(C=C1)OCO2 M65617 [1,0,0,1,0,0|2,0,0]=4 812 B11R2.36 ClC1=CC2=C(C=C1)OCC2 C48731 [1,0,0,1,0,0|2,0,0]=4 813 B11R2.36 ClC1=CN=C2NCCC2=C1 C45621 [1,0,0,1,0,0|2,0,0]=4 814 B11R2.36 FC1=CC2=C(C=C1)CCC2 F51669 [1,0,0,1,0,0|2,0,0]=4 815 B11R2.36 FC1=CC2=C(C=C1)OCC2 F62598 [1,0,0,1,0,0|2,0,0]=4 816 B11R2.36 IC1=CC2=C(C=C1)CCC2 K64448 [1,0,0,1,0,0|2,0,0]=4 817 B11R2.36 IC1=CC2=C(C=C1)OCC2 I2714 [1,0,0,1,0,0|2,0,0]=4 818 B11R2.36 NC1=CC2=C(C=C1)OCC2 D49263 [1,0,0,1,0,0|2,0,0]=4 819 B11R2.36 OC1=CC2=C(C=C1)NCC2 K49254 [1,0,0,1,0,0|1,0,0]=3 820 B11R2.36 OC1=CC2=C(C=C1)OCC2 D49067 [1,0,0,1,0,0|2,0,0]=4 821 B11R2.1 CC1=NC=C2CNCCN21 M61329 [0,0,0,1,1,0|2,0,0]=4 822 B11R2.1 CC1=NC=C2CNCCN21 T14385 [0,0,0,1,1,0|2,0,0]=4 823 B11R2.1 CN1C=NC2=C1CCNC2 M62081 [0,0,0,1,1,0|2,0,0]=4 824 B13R2.155 N[C@H]1CCC2=C(C=C(Br)C=C2)C1 B52728 [0,1,0,1,0,0|1,0,0]=3 825 B13R2.155 N[C@H]1CCC2=C(C=C(Br)C=C2)C1 B52740 [0,1,0,1,0,0|1,0,0]=3 826 B13R2.155 N[C@H]1CCC2=C(C=C(F)C=C2)C1 F52752 [0,1,0,1,0,0|1,0,0]=3 827 B13R2.2136 NC[C@H]1CCC2=C1C=C(Cl)C=C2 C37645 [0,1,0,1,0,0|1,0,0]=3 828 B13R2.3729 BrC1=CC2=C(C=C1)CCCCN2 B52729 [0,1,0,1,0,0|2,0,0]=4 829 B13R2.3729 BrC1=CC2=C(C=C1)CCCNC2 B52730 [0,1,0,1,0,0|2,0,0]=4 830 B13R2.3729 BrC1=CC2=C(C=C1)CNCCO2 B37374 [0,1,0,1,0,0|1,0,0]=3 831 B13R2.3729 FC1=CC2=C(C=C1)CNCCC2 F54128 [0,1,0,1,0,0|1,0,0]=3 832 B13R2.5179 CC1=CC2=C(C=C1)C(=O)CCC2 M54549 [0,1,0,1,0,0|1,0,1]=4 833 B13R2.5179 CC1=CC2=C(C=C1)C(=O)NCC2 M37521 [0,1,0,1,0,0|0,0,1]=3 834 B13R2.5179 CC1=CC2=C(C=C1)[C@@H](N)CCC2 M55487 [0,1,0,1,0,0|1,0,0]=3 835 B13R2.5179 N[C@H]1CCCC2=C1C=CC(Br)=C2 B32355 [0,1,0,1,0,0|2,0,0]=4 836 B13R2.5179 N[C@H]1CCCC2=C1C=CC(Br)=C2 B52738 [0,1,0,1,0,0|2,0,0]=4 837 B13R2.5179 N[C@H]1CCCC2=C1C=CC(Cl)=C2 C52743 [0,1,0,1,0,0|2,0,0]=4 838 B13R2.5179 N[C@H]1CCCC2=C1C=CC(F)=C2 F54129 [0,1,0,1,0,0|2,0,0]=4 839 B13R2.5179 O=C1NCCC2=C1C=CC(Br)=C2 I13836 [0,1,0,1,0,0|1,0,1]=4 840 B13R2.5179 O=C1NCCC2=C1C=CC(Cl)=C2 C11175 [0,1,0,1,0,0|1,0,1]=4 841 B13R2.5179 O=C1NCCC2=C1C=CC(F)=C2 F51539 [0,1,0,1,0,0|1,0,1]=4 842 B13R2.5179 O[C@H]1CCCC2=C1C=CC(F)=C2 F63760 [0,1,0,1,0,0|2,0,0]=4 843 B13R2.5190 CC1=CC2=C(C=C1)N(C)C(N)=N2 D49998 [0,1,0,1,0,0|1,0,1]=4 844 B13R2.57 C#CC1=CC2=C(C=C1)CCCC2 E64380 [0,1,0,1,0,0|1,0,1]=4 845 B13R2.57 COC1=CC2=C(C=C1)CCCN2 M38175 [0,1,0,1,0,0|2,0,0]=4 846 B13R2.57 COC1=CC2=C(C=C1)CCCN2 M52926 [0,1,0,1,0,0|2,0,0]=4 847 B13R2.57 COC1=CC2=C(C=C1)CCNC2 T1075 [0,1,0,1,0,0|2,0,0]=4 848 B13R2.57 COC1=CC2=C(C=C1)CNCC2 M52929 [0,1,0,1,0,0|0,0,0]=2 849 B13R2.57 COC1=CC2=C(C=C1)CNCC2 M54154 [0,1,0,1,0,0|0,0,0]=2 850 B13R2.57 COC1=CC2=C(C=C1)NCCC2 M52925 [0,1,0,1,0,0|2,0,0]=4 851 B13R2.57 N#CC1=CC2=C(C=C1)CNCC2 T54086 [0,1,0,1,0,0|0,0,1]=3 852 B13R2.162 CC1=CC2=C(C=C1)CCCC2=O M54550 [0,1,0,1,0,0|1,0,1]=4 853 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N M55488 [0,1,0,1,0,0|1,0,0]=3 854 B13R2.162 CC1=CC2=C(C=C1)OCC[C@@H]2N M54149 [0,1,0,1,0,0|2,0,0]=4 855 B13R2.162 C[C@H]1CNCC2=C1C=C(Br)C=C2 B60390 [0,1,0,1,0,0|1,0,0]=3 856 B13R2.162 NC1=CC2=C(C=C1)CCC[C@@H]2O A52930 [0,1,0,1,0,0|2,0,0]=4 857 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 B36947 [0,1,0,1,0,0|2,0,0]=4 858 B13R2.162 N[C@H]1CCCC2=C1C=C(Br)C=C2 B52739 [0,1,0,1,0,0|2,0,0]=4 859 B13R2.5151 CC1=C2C(=O)CCC2=C(Br)C=C1 B54049 [0,1,0,1,0,0|2,0,0]=4 860 B13R2.5151 CC1=C2CCC(=O)C2=C(F)C=C1 F54061 [0,1,0,1,0,0|2,0,0]=4 861 B13R2.5151 CC1=C2CCC(=O)C2=C(O)C=C1 H52442 [0,1,0,1,0,0|2,0,0]=4 862 B13R2.5151 N[C@H]1CCC2=C(F)C=CC(F)=C21 D52229 [0,1,0,1,0,0|2,0,0]=4 863 B13R2.5151 N[C@H]1CCC2=C(F)C=CC(F)=C21 D52231 [0,1,0,1,0,0|2,0,0]=4 864 B13R2.371 NC1=C2CNCCC2=C(Br)C=C1 B49980 [0,1,0,1,0,0|2,0,0]=4 865 B13R2.3683 CN1CCC2=C(C=CC(N)=C2)C1 M54237 [0,1,0,1,0,0|1,0,0]=3 866 B13R2.3683 CN1CCC2=C(C=CC(O)=C2)C1 M52933 [0,1,0,1,0,0|1,0,0]=3 867 B13R2.3683 C[C@H]1CC2=C(C=C(Br)C=C2)CN1 B52741 [0,1,0,1,0,0|2,0,0]=4 868 B13R2.3683 N[C@H]1CCC2=C(C=CC(Br)=C2)C1 B52726 [0,1,0,1,0,0|1,0,0]=3 869 B13R2.3683 O=C1CCC2=C(C=CC(Br)=C2)C1 B64120 [0,1,0,1,0,0|2,0,0]=4 870 B13R2.3683 O=C1CCC2=C(C=CC(Cl)=C2)C1 C64119 [0,1,0,1,0,0|2,0,0]=4 871 B13R2.3683 O=C1CCC2=C(C=CC(F)=C2)C1 F54058 [0,1,0,1,0,0|2,0,0]=4 872 B13R2.3683 O=C1CCC2=C(C=CC(O)=C2)C1 H52422 [0,1,0,1,0,0|2,0,0]=4 873 B13R2.3683 O[C@H]1CCC2=C(C=CC(Br)=C2)C1 B37785 [0,1,0,1,0,0|2,0,0]=4 874 B13R2.32 CC1=CC=C2CCCNC2=C1N M53030 [0,1,0,1,0,0|2,0,0]=4 875 B13R2.369 CC1=C(Br)C=C2CNCCC2=C1 B60076 [0,1,0,1,0,0|0,0,0]=2 876 B13R2.369 ClC1=C(Cl)C=C2CNCCC2=C1 D51746 [0,1,0,1,0,0|1,0,0]=3 877 B9R1.33 CC1=C(CCN)SC=N1 M3229 [1,0,0,0,1,0|2,0,0]=4 878 B9R1.33 CC1=NC=CN1CCN M43556 [1,0,0,0,1,0|2,0,0]=4 879 B9R1.7 CC1=CC=C(CCO)O1 M43716 [1,0,0,0,1,0|2,0,0]=4 880 B9R1.22 CC1=NN(C)C=C1CN D23506 [1,0,0,0,1,0|2,0,0]=4 881 B9R1.27 CC1=NOC(C)=C1CN D41432 [1,0,0,0,1,0|2,0,0]=4