0 B6R1.2 BrC1=CC=CS1 B7561 [0,0,0,0,0,0|4,0,0]=4 1 B6R1.2 BrC1=CNC=N1 B11785 [0,0,0,0,0,0|3,0,0]=3 2 B6R1.2 BrC1=CNN=C1 B17685 [0,0,0,0,0,0|1,0,0]=1 3 B6R1.2 BrC1=CSC=C1 B7562 [0,0,0,0,0,0|3,0,0]=3 4 B6R1.2 BrC1=CSC=N1 B12641 [0,0,0,0,0,0|4,0,0]=4 5 B6R1.2 BrC1=NSC=C1 B19313 [0,0,0,0,0,0|4,0,0]=4 6 B6R1.2 CC1=CNC=N1 M0110 [0,0,0,0,0,0|2,0,0]=2 7 B6R1.2 CC1=CON=C1 M14375 [0,0,0,0,0,0|1,0,0]=1 8 B6R1.2 CC1=NC=CN1 M18847 [0,0,0,0,0,0|4,0,0]=4 9 B6R1.2 CC1=NC=CS1 M17737 [0,0,0,0,0,0|4,0,0]=4 10 B6R1.2 CC1=NN=NN1 M1394 [0,0,0,0,0,0|2,0,1]=3 11 B6R1.2 CC1=NNC=N1 M07295 [0,0,0,0,0,0|3,0,0]=3 12 B6R1.2 CC1=NNC=N1 M07295 [0,0,0,0,0,0|3,0,0]=3 13 B6R1.2 CC1CCNC1 M17094 [0,0,0,0,0,0|1,0,3]=4 14 B6R1.2 ClC1=CN=NS1 C18993 [0,0,0,0,0,0|2,0,1]=3 15 B6R1.2 IC1=CC=CS1 I3940 [0,0,0,0,0,0|4,0,0]=4 16 B6R1.2 IC1=CNC=N1 I4020 [0,0,0,0,0,0|3,0,0]=3 17 B6R1.2 IC1=CNC=N1 I4020 [0,0,0,0,0,0|3,0,0]=3 18 B6R1.2 IC1=CNN=C1 I8759 [0,0,0,0,0,0|1,0,0]=1 19 B6R1.2 NC1=CN=NS1 A3755 [0,0,0,0,0,0|2,0,1]=3 20 B6R1.2 NC1=CN=NS1 A3755 [0,0,0,0,0,0|2,0,1]=3 21 B6R1.2 NC1=CSC=N1 A19319 [0,0,0,0,0,0|4,0,0]=4 22 B6R1.2 NC1=NN=CS1 T5400 [0,0,0,0,0,0|4,0,0]=4 23 B6R1.2 NC1=NN=CS1 T5400 [0,0,0,0,0,0|4,0,0]=4 24 B6R1.2 NC1=NN=NN1 A13272 [0,0,0,0,0,0|3,0,1]=4 25 B6R1.2 NC1=NNC=N1 A1361 [0,0,0,0,0,0|4,0,0]=4 26 B6R1.2 NN1C=NN=C1 A1051 [0,0,0,0,0,0|2,0,1]=3 27 B6R1.2 O=C1C=CCC1 C18886 [0,0,0,0,0,0|3,0,1]=4 28 B6R1.2 O=C1C=CSN1 S19312 [0,0,0,0,0,0|4,0,0]=4 29 B6R1.2 SC1=NNC=N1 M5422 [0,0,0,0,0,0|4,0,0]=4 30 B6R1.2 [NH3+]C1=CNN=C1 P12536 [0,0,0,0,0,0|1,0,0]=1 31 B5R1.1 C1=CCNC1 P12964 [1,0,0,0,0,0|1,0,1]=3 32 B5R1.1 C1=CNC=N1 I18837 [1,0,0,0,0,0|2,0,0]=3 33 B5R1.1 C1=CNN=N1 T4825 [1,0,0,0,0,0|1,0,0]=2 34 B5R1.1 C1=CNN=N1 T4825 [1,0,0,0,0,0|1,0,0]=2 35 B5R1.1 C1=CON=C1 I12950 [1,0,0,0,0,0|1,0,0]=2 36 B7R1.1 BrCC1=CSC=C1 B8083 [0,1,0,0,0,0|2,0,0]=3 37 B7R1.1 BrCC1=CSC=C1 B8083 [0,1,0,0,0,0|2,0,0]=3 38 B7R1.1 C(=O)C1=CSC=C1 T0722 [0,1,0,0,0,0|2,0,1]=4 39 B7R1.1 C(=O)C1=CSC=C1 T0722 [0,1,0,0,0,0|2,0,1]=4 40 B7R1.1 CSC1=NN=NN1 M4326 [0,1,0,0,0,0|2,0,1]=4 41 B7R1.1 ClCC1=CSC=N1 C14673 [0,1,0,0,0,0|3,0,0]=4 42 B7R1.1 ClCC1=CSC=N1 C14673 [0,1,0,0,0,0|3,0,0]=4 43 B7R1.1 ClCC1=NN=NN1 C4327 [0,1,0,0,0,0|2,0,1]=4 44 B7R1.1 NCC1=CC=CO1 F2158 [0,1,0,0,0,0|3,0,0]=4 45 B7R1.1 NCC1=CC=CS1 T3333 [0,1,0,0,0,0|3,0,0]=4 46 B7R1.1 NCC1=NNC=C1 P17146 [0,1,0,0,0,0|2,0,0]=3 47 B7R1.1 O=CC1=CN=CS1 T17632 [0,1,0,0,0,0|2,0,1]=4 48 B7R1.1 O=CC1=CNC=N1 I2653 [0,1,0,0,0,0|2,0,1]=4 49 B7R1.1 O=CC1=NNC=C1 M3639 [0,1,0,0,0,0|2,0,1]=4 50 B7R1.1 OCC1=CN=CS1 H15363 [0,1,0,0,0,0|2,0,0]=3 51 B7R1.1 OCC1=CNC=N1 H11787 [0,1,0,0,0,0|2,0,0]=3 52 B7R1.1 OCC1=CNC=N1 H4012 [0,1,0,0,0,0|2,0,0]=3 53 B7R1.1 OCC1=NNC=C1 P17144 [0,1,0,0,0,0|2,0,0]=3 54 B7R1.1 OCC1=NNC=C1 P17144 [0,1,0,0,0,0|2,0,0]=3 55 B7R1.2 CC1=CC(=O)NN1 M2903 [0,1,0,0,0,0|2,0,0]=3 56 B7R1.2 CC1=CC(Br)=CS1 B8084 [0,1,0,0,0,0|3,0,0]=4 57 B7R1.2 CC1=CC(N)=NO1 A0141 [0,1,0,0,0,0|2,0,0]=3 58 B7R1.2 CC1=CC=C(Br)S1 B3937 [0,1,0,0,0,0|3,0,0]=4 59 B7R1.2 CC1=CC=C(C)N1 D1487 [0,1,0,0,0,0|3,0,0]=4 60 B7R1.2 CC1=CC=C(C)S1 P14109 [0,1,0,0,0,0|3,0,0]=4 61 B7R1.2 CC1=CN=C(Cl)S1 C3520 [0,1,0,0,0,0|2,0,0]=3 62 B7R1.2 CC1=CN=C(N)S1 A0591 [0,1,0,0,0,0|2,0,0]=3 63 B7R1.2 CC1=CNC(C)=N1 D12856 [0,1,0,0,0,0|2,0,0]=3 64 B7R1.2 CC1=CSC(N)=N1 A5326 [0,1,0,0,0,0|3,0,0]=4 65 B7R1.2 CC1=NC(Br)=CN1 B7504 [0,1,0,0,0,0|3,0,0]=4 66 B7R1.2 CC1=NC(I)=CN1 M4036 [0,1,0,0,0,0|3,0,0]=4 67 B7R1.2 CC1=NN=C(Br)S1 B8152 [0,1,0,0,0,0|3,0,0]=4 68 B7R1.2 CC1=NN=C(S)S1 M2336 [0,1,0,0,0,0|3,0,0]=4 69 B7R1.2 CN1C=C(Br)C=N1 B18453 [0,1,0,0,0,0|1,0,0]=2 70 B7R1.2 CN1N=NC(N)=N1 M0383 [0,1,0,0,0,0|3,0,0]=4 71 B7R1.2 NC1=NC=C(Br)S1 A18626 [0,1,0,0,0,0|3,0,0]=4 72 B7R1.4 BrC1=C(Br)SC=C1 D3934 [0,1,0,0,0,0|3,0,0]=4 73 B7R1.4 BrC1=CSC=C1Br D3935 [0,1,0,0,0,0|3,0,0]=4 74 B7R1.4 CC1=C(Br)SC=C1 B5335 [0,1,0,0,0,0|2,0,0]=3 75 B7R1.4 CC1=C(C)SC=N1 D0729 [0,1,0,0,0,0|2,0,0]=3 76 B7R1.4 CC1=C(Cl)SC=C1 C1192 [0,1,0,0,0,0|2,0,0]=3 77 B7R1.4 CC1=NNC=C1Br B7502 [0,1,0,0,0,0|1,0,0]=2 78 B7R1.4 CN1C=CN=C1Br B7503 [0,1,0,0,0,0|2,0,0]=3 79 B7R1.4 CN1C=CN=C1S T0187 [0,1,0,0,0,0|2,0,0]=3 80 B7R1.4 CN1C=CN=C1S T0187 [0,1,0,0,0,0|2,0,0]=3 81 B7R1.4 CN1C=NC=C1Br B13582 [0,1,0,0,0,0|2,0,0]=3 82 B7R1.4 CN1C=NC=C1Cl C0777 [0,1,0,0,0,0|2,0,0]=3 83 B7R1.4 CN1C=NC=C1Cl M4716 [0,1,0,0,0,0|2,0,0]=3 84 B7R1.4 CN1C=NC=C1I M19391 [0,1,0,0,0,0|2,0,0]=3 85 B7R1.4 CN1CCN=C1S M3268 [0,1,0,0,0,0|2,0,1]=4 86 B7R1.4 CN1N=NN=C1N A0533 [0,1,0,0,0,0|2,0,1]=4 87 B7R1.4 CN1N=NN=C1N A0533 [0,1,0,0,0,0|2,0,1]=4 88 B7R1.4 CN1N=NN=C1S M5001 [0,1,0,0,0,0|2,0,1]=4 89 B7R1.4 ClC1=C(Br)C=CS1 B8915 [0,1,0,0,0,0|3,0,0]=4 90 B5R0.1 C\C(I)=C\CI D16723 [0,0,1,0,0,0|3,0,0]=4 91 B5R1.2 O=C1CCN1 A18280 [0,0,0,0,1,0|2,0,1]=4 92 B7R1.3 BrC1=CC=CN=C1 B11571 [0,0,0,0,0,1|2,0,0]=3 93 B7R1.3 BrC1=CC=NC=C1 B17440 [0,0,0,0,0,1|2,0,0]=3 94 B7R1.3 BrC1=CC=NC=C1 B1969 [0,0,0,0,0,1|2,0,0]=3 95 B7R1.3 BrC1=CC=NC=C1 B1969 [0,0,0,0,0,1|2,0,0]=3 96 B7R1.3 BrC1=CN=CN=C1 B1754 [0,0,0,0,0,1|1,0,1]=3 97 B7R1.3 BrC1=NC=CC=C1 B0120 [0,0,0,0,0,1|3,0,0]=4 98 B7R1.3 CC1=CN=CN=C1 M17713 [0,0,0,0,0,1|0,0,1]=2 99 B7R1.3 C[N+]1=CC=CC=C1 M7975 [0,0,0,0,0,1|3,0,0]=4 100 B7R1.3 ClC1=CC=CN=C1 C3229 [0,0,0,0,0,1|2,0,0]=3 101 B7R1.3 ClC1=CC=NC=C1 C0128 [0,0,0,0,0,1|2,0,0]=3 102 B7R1.3 ClC1=CC=NC=C1 C0128 [0,0,0,0,0,1|2,0,0]=3 103 B7R1.3 ClC1=CN=CN=C1 C4480 [0,0,0,0,0,1|1,0,1]=3 104 B7R1.3 ClC1=NC=CN=C1 C1194 [0,0,0,0,0,1|2,0,0]=3 105 B7R1.3 FC1=CC=CN=C1 F0708 [0,0,0,0,0,1|2,0,0]=3 106 B7R1.3 FC1=CN=CN=C1 F12585 [0,0,0,0,0,1|1,0,1]=3 107 B7R1.3 FC1=NC=CC=C1 F11774 [0,0,0,0,0,1|3,0,0]=4 108 B7R1.3 IC1=CC=CN=C1 I9223 [0,0,0,0,0,1|2,0,0]=3 109 B7R1.3 IC1=CC=NC=C1 I2357 [0,0,0,0,0,1|2,0,0]=3 110 B7R1.3 IC1=NC=CC=C1 I11288 [0,0,0,0,0,1|3,0,0]=4 111 B7R1.3 IC1=NC=CN=C1 I4021 [0,0,0,0,0,1|2,0,0]=3 112 B7R1.3 NC1=CC=CN=C1 A11569 [0,0,0,0,0,1|2,0,0]=3 113 B7R1.3 NC1=CC=NC=C1 A0126 [0,0,0,0,0,1|2,0,0]=3 114 B7R1.3 NC1=CC=NC=C1 A0126 [0,0,0,0,0,1|2,0,0]=3 115 B7R1.3 NC1=NC=CC=C1 A11568 [0,0,0,0,0,1|3,0,0]=4 116 B7R1.3 NC1=NC=CN=C1 A13271 [0,0,0,0,0,1|2,0,0]=3 117 B7R1.3 OC1=CC=NC=C1 H4081 [0,0,0,0,0,1|2,0,0]=3 118 B7R1.3 OC1=NC=CC=C1 H5719 [0,0,0,0,0,1|3,0,0]=4 119 B7R1.3 OC1=NC=NC=C1 U11252 [0,0,0,0,0,1|2,0,0]=3 120 B7R1.3 SC1=NC=CC=C1 P0646 [0,0,0,0,0,1|3,0,0]=4 121 B4R0.1 CC(=O)NO A3293 [1,0,1,0,0,0|2,0,0]=4 122 B4R0.1 CC(N)=NN A13105 [1,0,1,0,0,0|1,0,0]=3 123 B4R0.1 C\C(N)=N\O H13104 [1,0,1,0,0,0|2,0,0]=4 124 B4R0.1 N=C(N)CN A17678 [1,0,1,0,0,0|1,0,1]=4 125 B6R0.2 C\C(N)=C/C(N)=S A18256 [0,1,1,0,0,0|2,0,0]=4 126 B8R1.2 C#CC1=CC=NC=C1 E11459 [0,1,0,0,0,1|1,0,1]=4 127 B8R1.2 C#CC1=CC=NC=C1 E11459 [0,1,0,0,0,1|1,0,1]=4 128 B8R1.2 C#CC1=CN=CC=C1 E11458 [0,1,0,0,0,1|1,0,1]=4 129 B8R1.2 C#CC1=CN=CN=C1 E15176 [0,1,0,0,0,1|0,0,2]=4 130 B8R1.2 C(=O)C1=CC=CN=C1 P11581 [0,1,0,0,0,1|1,0,1]=4 131 B8R1.2 C(=O)C1=CC=NC=C1 P11582 [0,1,0,0,0,1|1,0,1]=4 132 B8R1.2 C=CC1=NC=CN=C1 V13362 [0,1,0,0,0,1|1,0,1]=4 133 B8R1.2 COC1=CC=NC=C1 M3232 [0,1,0,0,0,1|1,0,0]=3 134 B8R1.2 COC1=CC=NC=C1 M3232 [0,1,0,0,0,1|1,0,0]=3 135 B8R1.2 ClCC1=CC=CN=C1 C1770 [0,1,0,0,0,1|1,0,0]=3 136 B8R1.2 ClCC1=CC=NC=C1 C2804 [0,1,0,0,0,1|1,0,0]=3 137 B8R1.2 ClCC1=NC=CC=C1 C5538 [0,1,0,0,0,1|2,0,0]=4 138 B8R1.2 N#CC1=CC=CN=C1 C2747 [0,1,0,0,0,1|1,0,1]=4 139 B8R1.2 NCC1=CC=CN=C1 P2319 [0,1,0,0,0,1|1,0,0]=3 140 B8R1.2 OCC1=CN=CN=C1 P17132 [0,1,0,0,0,1|0,0,1]=3 141 B8R1.2 OCC1=NC=CC=C1 P1495 [0,1,0,0,0,1|2,0,0]=4 142 B8R1.2 OCC1=NC=NC=C1 P14938 [0,1,0,0,0,1|1,0,0]=3 143 B8R1.3 BrC1=CN=C(Br)C=C1 D0300 [0,1,0,0,0,1|2,0,0]=4 144 B8R1.3 BrC1=CN=C(I)C=C1 B2799 [0,1,0,0,0,1|2,0,0]=4 145 B8R1.3 BrC1=CN=C(I)C=N1 I14524 [0,1,0,0,0,1|2,0,0]=4 146 B8R1.3 BrC1=CN=C(I)N=C1 B11051 [0,1,0,0,0,1|1,0,1]=4 147 B8R1.3 BrC1=CN=C(I)N=C1 B11051 [0,1,0,0,0,1|1,0,1]=4 148 B8R1.3 BrC1=NC=C(I)C=C1 B18506 [0,1,0,0,0,1|2,0,0]=4 149 B8R1.3 CC1=CC=C(Br)C=C1 B18871 [0,1,0,0,0,1|2,0,0]=4 150 B8R1.3 CC1=CC=C(Cl)N=N1 C2320 [0,1,0,0,0,1|2,0,0]=4 151 B8R1.3 CC1=CC=C(N)C=C1 T18863 [0,1,0,0,0,1|2,0,0]=4 152 B8R1.3 CC1=CN=C(Br)C=C1 B5054 [0,1,0,0,0,1|1,0,0]=3 153 B8R1.3 CC1=CN=C(F)C=C1 F16734 [0,1,0,0,0,1|1,0,0]=3 154 B8R1.3 CC1=CN=C(N)C=C1 A1408 [0,1,0,0,0,1|1,0,0]=3 155 B8R1.3 CC1=CN=C(N)C=N1 A18243 [0,1,0,0,0,1|1,0,0]=3 156 B8R1.3 CC1=CN=C(O)C=C1 H11434 [0,1,0,0,0,1|1,0,0]=3 157 B8R1.3 CC1=NC=C(Br)C=C1 B0366 [0,1,0,0,0,1|2,0,0]=4 158 B8R1.3 CC1=NC=C(N)C=C1 A1025 [0,1,0,0,0,1|2,0,0]=4 159 B8R1.3 CC1=NC=C(N)C=C1 A1025 [0,1,0,0,0,1|2,0,0]=4 160 B8R1.3 ClC1=CC=C(Br)C=N1 B1034 [0,1,0,0,0,1|2,0,0]=4 161 B8R1.3 ClC1=CN=C(Br)C=C1 B1035 [0,1,0,0,0,1|2,0,0]=4 162 B8R1.3 ClC1=CN=C(Cl)C=C1 D3860 [0,1,0,0,0,1|2,0,0]=4 163 B8R1.3 ClC1=CN=C(I)N=C1 C11052 [0,1,0,0,0,1|1,0,1]=4 164 B8R1.3 ClC1=NC=C(Br)C=N1 B3252 [0,1,0,0,0,1|1,0,1]=4 165 B8R1.3 ClC1=NC=C(I)C=C1 C2827 [0,1,0,0,0,1|2,0,0]=4 166 B8R1.3 ClC1=NC=C(I)C=N1 C17328 [0,1,0,0,0,1|1,0,1]=4 167 B8R1.3 FC1=CC=C(Br)N=C1 B8041 [0,1,0,0,0,1|2,0,0]=4 168 B8R1.3 FC1=CC=C(I)C=N1 F4567 [0,1,0,0,0,1|2,0,0]=4 169 B8R1.3 FC1=CN=C(Cl)N=C1 C11600 [0,1,0,0,0,1|1,0,1]=4 170 B8R1.3 FC1=CN=C(Cl)N=C1 C11600 [0,1,0,0,0,1|1,0,1]=4 171 B8R1.3 FC1=NC=C(Br)C=C1 B4562 [0,1,0,0,0,1|2,0,0]=4 172 B8R1.3 FC1=NC=C(Cl)C=C1 C0694 [0,1,0,0,0,1|2,0,0]=4 173 B8R1.3 NC1=CC=C(O)C=N1 A15404 [0,1,0,0,0,1|2,0,0]=4 174 B8R1.3 NC1=CN=C(Br)C=C1 A5466 [0,1,0,0,0,1|2,0,0]=4 175 B8R1.3 NC1=CN=C(Br)C=N1 A12579 [0,1,0,0,0,1|2,0,0]=4 176 B8R1.3 NC1=CN=C(Cl)C=C1 A1452 [0,1,0,0,0,1|2,0,0]=4 177 B8R1.3 NC1=CN=C(Cl)N=C1 A12632 [0,1,0,0,0,1|1,0,1]=4 178 B8R1.3 NC1=CN=C(F)C=C1 A4561 [0,1,0,0,0,1|2,0,0]=4 179 B8R1.3 NC1=CN=C(N)C=C1 D11589 [0,1,0,0,0,1|2,0,0]=4 180 B8R1.3 NC1=CN=C(N)C=C1 D5349 [0,1,0,0,0,1|2,0,0]=4 181 B8R1.3 NC1=CN=C(O)C=C1 A18681 [0,1,0,0,0,1|2,0,0]=4 182 B8R1.3 NC1=CN=C(O)C=C1 H2035 [0,1,0,0,0,1|2,0,0]=4 183 B8R1.3 NC1=NC=C(Br)C=C1 A5056 [0,1,0,0,0,1|2,0,0]=4 184 B8R1.3 NC1=NC=C(Br)C=N1 A3251 [0,1,0,0,0,1|1,0,1]=4 185 B8R1.3 NC1=NC=C(Cl)C=C1 A0913 [0,1,0,0,0,1|2,0,0]=4 186 B8R1.3 NC1=NC=C(Cl)C=N1 A5036 [0,1,0,0,0,1|1,0,1]=4 187 B8R1.3 NC1=NC=C(F)C=C1 A1918 [0,1,0,0,0,1|2,0,0]=4 188 B8R1.3 NC1=NC=C(I)C=C1 A5502 [0,1,0,0,0,1|2,0,0]=4 189 B8R1.3 NC1=NC=C(I)C=N1 A9928 [0,1,0,0,0,1|1,0,1]=4 190 B8R1.3 OC1=CC=C(Br)C=N1 B7974 [0,1,0,0,0,1|2,0,0]=4 191 B8R1.3 OC1=CN=C(Br)C=C1 B18504 [0,1,0,0,0,1|2,0,0]=4 192 B8R1.3 OC1=CN=C(Cl)C=C1 C11720 [0,1,0,0,0,1|2,0,0]=4 193 B8R1.3 OC1=CN=C(Cl)C=C1 C11720 [0,1,0,0,0,1|2,0,0]=4 194 B8R1.3 OC1=CN=C(F)C=C1 F17081 [0,1,0,0,0,1|2,0,0]=4 195 B8R1.3 OC1=NC=C(Br)C=N1 B3253 [0,1,0,0,0,1|1,0,1]=4 196 B8R1.3 OC1=NC=C(Br)C=N1 B3253 [0,1,0,0,0,1|1,0,1]=4 197 B8R1.4 BrC1=CC(Br)=NC=C1 D1833 [0,1,0,0,0,1|2,0,0]=4 198 B8R1.4 BrC1=CN=CC(Br)=C1 D1834 [0,1,0,0,0,1|2,0,0]=4 199 B8R1.4 BrC1=NC=CC(I)=C1 B1908 [0,1,0,0,0,1|2,0,0]=4 200 B8R1.4 CC1=CC(Br)=CC=N1 B11287 [0,1,0,0,0,1|2,0,0]=4 201 B8R1.4 CC1=CC(Br)=NC=C1 B2654 [0,1,0,0,0,1|1,0,0]=3 202 B8R1.4 CC1=CC(F)=NC=C1 F12483 [0,1,0,0,0,1|1,0,0]=3 203 B8R1.4 CC1=CC(N)=CN=C1 M11544 [0,1,0,0,0,1|1,0,0]=3 204 B8R1.4 CC1=CC(N)=NC=C1 A3549 [0,1,0,0,0,1|1,0,0]=3 205 B8R1.4 CC1=CC(O)=NC=C1 H11433 [0,1,0,0,0,1|1,0,0]=3 206 B8R1.4 CC1=CC=CC(Br)=N1 B7894 [0,1,0,0,0,1|2,0,0]=4 207 B8R1.4 CC1=CC=CC(Cl)=N1 C0781 [0,1,0,0,0,1|2,0,0]=4 208 B8R1.4 CC1=CC=CC(I)=C1 I9818 [0,1,0,0,0,1|2,0,0]=4 209 B8R1.4 CC1=CC=CC(O)=N1 H2705 [0,1,0,0,0,1|2,0,0]=4 210 B8R1.4 CC1=CC=CC(O)=N1 H2705 [0,1,0,0,0,1|2,0,0]=4 211 B8R1.4 CC1=CC=NC(Br)=N1 B7935 [0,1,0,0,0,1|1,0,0]=3 212 B8R1.4 CC1=CN=CC(Br)=C1 B1021 [0,1,0,0,0,1|1,0,0]=3 213 B8R1.4 CC1=CN=CC(Br)=C1 B1021 [0,1,0,0,0,1|1,0,0]=3 214 B8R1.4 CC1=CN=CC(C)=C1 D3192 [0,1,0,0,0,1|1,0,0]=3 215 B8R1.4 CC1=NC(Cl)=NC=C1 C16993 [0,1,0,0,0,1|1,0,0]=3 216 B8R1.4 CC1=NC(N)=CC=C1 A1028 [0,1,0,0,0,1|2,0,0]=4 217 B8R1.4 CC1=NC(O)=NC=C1 H11330 [0,1,0,0,0,1|1,0,0]=3 218 B8R1.4 CC1=NC=CC(N)=C1 A1027 [0,1,0,0,0,1|2,0,0]=4 219 B8R1.4 CC1=NC=NC(Cl)=C1 M4481 [0,1,0,0,0,1|1,0,0]=3 220 B8R1.4 ClC1=CC(Cl)=NC=C1 D1832 [0,1,0,0,0,1|2,0,0]=4 221 B8R1.4 ClC1=CC(Cl)=NC=N1 D1088 [0,1,0,0,0,1|2,0,0]=4 222 B8R1.4 ClC1=CC=NC(Br)=C1 B1838 [0,1,0,0,0,1|2,0,0]=4 223 B8R1.4 ClC1=CC=NC(Cl)=N1 D1230 [0,1,0,0,0,1|2,0,0]=4 224 B8R1.4 ClC1=CC=NC(Cl)=N1 D1230 [0,1,0,0,0,1|2,0,0]=4 225 B8R1.4 ClC1=CN=CC(Br)=C1 B11419 [0,1,0,0,0,1|2,0,0]=4 226 B8R1.4 ClC1=CN=CC(Cl)=C1 D1836 [0,1,0,0,0,1|2,0,0]=4 227 B8R1.4 ClC1=CN=CC(Cl)=N1 D1339 [0,1,0,0,0,1|2,0,0]=4 228 B8R1.4 ClC1=NC=CC(Br)=C1 B1837 [0,1,0,0,0,1|2,0,0]=4 229 B8R1.4 ClC1=NC=CC(I)=C1 C3227 [0,1,0,0,0,1|2,0,0]=4 230 B8R1.4 ClC1=NC=CC(I)=C1 C3227 [0,1,0,0,0,1|2,0,0]=4 231 B8R1.4 FC1=CC(Cl)=NC=C1 C0693 [0,1,0,0,0,1|2,0,0]=4 232 B8R1.4 FC1=CN=CC(Br)=C1 B8042 [0,1,0,0,0,1|2,0,0]=4 233 B8R1.4 FC1=CN=CC(Cl)=C1 C11480 [0,1,0,0,0,1|2,0,0]=4 234 B8R1.4 FC1=CN=CC(F)=C1 D11481 [0,1,0,0,0,1|2,0,0]=4 235 B8R1.4 FC1=NC=CC(I)=C1 F16735 [0,1,0,0,0,1|2,0,0]=4 236 B8R1.4 NC1=CC(Br)=CN=C1 B2718 [0,1,0,0,0,1|2,0,0]=4 237 B8R1.4 NC1=CC(Br)=NC=C1 A2081 [0,1,0,0,0,1|2,0,0]=4 238 B8R1.4 NC1=CC(Cl)=NC=C1 A0127 [0,1,0,0,0,1|2,0,0]=4 239 B8R1.4 NC1=CC(Cl)=NC=C1 A0127 [0,1,0,0,0,1|2,0,0]=4 240 B8R1.4 NC1=CC(Cl)=NC=N1 A11506 [0,1,0,0,0,1|2,0,0]=4 241 B8R1.4 NC1=CC(N)=NC=N1 D4319 [0,1,0,0,0,1|2,0,0]=4 242 B8R1.4 NC1=CC(O)=CC=N1 A14644 [0,1,0,0,0,1|2,0,0]=4 243 B8R1.4 NC1=CC(O)=CC=N1 A14644 [0,1,0,0,0,1|2,0,0]=4 244 B8R1.4 NC1=CC(O)=NC=C1 A14552 [0,1,0,0,0,1|2,0,0]=4 245 B8R1.4 NC1=CN=CC(Cl)=C1 C1840 [0,1,0,0,0,1|2,0,0]=4 246 B8R1.4 NC1=CN=CC(Cl)=N1 A3767 [0,1,0,0,0,1|2,0,0]=4 247 B8R1.4 NC1=NC(=O)NC=C1 C0377 [0,1,0,0,0,1|2,0,0]=4 248 B8R1.4 NC1=NC(Cl)=NC=C1 A1939 [0,1,0,0,0,1|2,0,0]=4 249 B8R1.4 NC1=NC(Cl)=NC=C1 A1939 [0,1,0,0,0,1|2,0,0]=4 250 B8R1.4 NC1=NC=CC(Br)=C1 A11797 [0,1,0,0,0,1|2,0,0]=4 251 B8R1.4 NC1=NC=CC(Cl)=C1 A11778 [0,1,0,0,0,1|2,0,0]=4 252 B8R1.4 NC1=NC=CC(Cl)=N1 A2445 [0,1,0,0,0,1|2,0,0]=4 253 B8R1.4 NC1=NC=CC(Cl)=N1 A2445 [0,1,0,0,0,1|2,0,0]=4 254 B8R1.4 OC1=CC(O)=NC=N1 D1169 [0,1,0,0,0,1|2,0,0]=4 255 B8R1.4 OC1=CC=NC(Cl)=C1 C2931 [0,1,0,0,0,1|2,0,0]=4 256 B8R1.4 OC1=CC=NC(Cl)=C1 C2931 [0,1,0,0,0,1|2,0,0]=4 257 B8R1.4 OC1=CN=CC(Br)=C1 B11445 [0,1,0,0,0,1|2,0,0]=4 258 B8R1.4 OC1=NC(O)=NC=C1 D17728 [0,1,0,0,0,1|2,0,0]=4 259 B8R1.5 BrC1=C(Br)N=CC=C1 D10541 [0,1,0,0,0,1|2,0,0]=4 260 B8R1.5 BrC1=CC=NC=C1Br D1835 [0,1,0,0,0,1|2,0,0]=4 261 B8R1.5 CC1=C(Br)C=CC=N1 B7895 [0,1,0,0,0,1|2,0,0]=4 262 B8R1.5 CC1=C(Br)C=CC=N1 B7895 [0,1,0,0,0,1|2,0,0]=4 263 B8R1.5 CC1=C(Br)C=NC=C1 B5109 [0,1,0,0,0,1|1,0,0]=3 264 B8R1.5 CC1=C(Cl)C=NC=C1 C17294 [0,1,0,0,0,1|1,0,0]=3 265 B8R1.5 CC1=C(F)N=CC=C1 F4563 [0,1,0,0,0,1|1,0,0]=3 266 B8R1.5 CC1=C(N)C=CN=C1 A1026 [0,1,0,0,0,1|1,0,0]=3 267 B8R1.5 CC1=C(N)C=NC=C1 M2783 [0,1,0,0,0,1|1,0,0]=3 268 B8R1.5 CC1=C(N)C=NC=C1 M2783 [0,1,0,0,0,1|1,0,0]=3 269 B8R1.5 CC1=C(S)C=CC=C1 T0861 [0,1,0,0,0,1|2,0,0]=4 270 B8R1.5 CC1=CC=CC=C1I I1272 [0,1,0,0,0,1|2,0,0]=4 271 B8R1.5 CC1=CC=CN=C1Br B1020 [0,1,0,0,0,1|1,0,0]=3 272 B8R1.5 CC1=CC=CN=C1Br B1020 [0,1,0,0,0,1|1,0,0]=3 273 B8R1.5 CC1=CC=CN=C1Cl C1079 [0,1,0,0,0,1|1,0,0]=3 274 B8R1.5 CC1=CC=CN=C1O H11432 [0,1,0,0,0,1|1,0,0]=3 275 B8R1.5 CC1=NC=CC=C1N A5470 [0,1,0,0,0,1|2,0,0]=4 276 B8R1.5 CC1=NC=CC=C1O H6683 [0,1,0,0,0,1|2,0,0]=4 277 B8R1.5 CC1=NC=CN=C1C D0878 [0,1,0,0,0,1|1,0,0]=3 278 B8R1.5 ClC1=C(Br)C=CN=C1 B17251 [0,1,0,0,0,1|2,0,0]=4 279 B8R1.5 ClC1=C(Cl)C=NC=C1 D11763 [0,1,0,0,0,1|2,0,0]=4 280 B8R1.5 ClC1=C(I)C=CN=C1 C17297 [0,1,0,0,0,1|2,0,0]=4 281 B8R1.5 ClC1=C(I)C=NC=N1 C11508 [0,1,0,0,0,1|1,0,1]=4 282 B8R1.5 ClC1=CC=CN=C1Br B17285 [0,1,0,0,0,1|2,0,0]=4 283 B8R1.5 ClC1=CC=CN=C1Cl D3859 [0,1,0,0,0,1|2,0,0]=4 284 B8R1.5 ClC1=CC=CN=C1I C17310 [0,1,0,0,0,1|2,0,0]=4 285 B8R1.5 ClC1=CC=NC=C1Br B8706 [0,1,0,0,0,1|2,0,0]=4 286 B8R1.5 ClC1=NC=CC=C1Br B3796 [0,1,0,0,0,1|2,0,0]=4 287 B8R1.5 ClC1=NC=CC=C1I C2829 [0,1,0,0,0,1|2,0,0]=4 288 B8R1.5 ClC1=NC=CC=C1I C2829 [0,1,0,0,0,1|2,0,0]=4 289 B8R1.5 ClC1=NC=CN=C1Cl D3858 [0,1,0,0,0,1|2,0,0]=4 290 B8R1.5 FC1=C(Br)C=CN=C1 B8043 [0,1,0,0,0,1|2,0,0]=4 291 B8R1.5 FC1=C(Cl)C=CN=C1 C2693 [0,1,0,0,0,1|2,0,0]=4 292 B8R1.5 FC1=C(F)N=CC=C1 D4565 [0,1,0,0,0,1|2,0,0]=4 293 B8R1.5 FC1=C(F)N=CC=C1 D4565 [0,1,0,0,0,1|2,0,0]=4 294 B8R1.5 FC1=CC=CN=C1I F14061 [0,1,0,0,0,1|2,0,0]=4 295 B8R1.5 FC1=NC=CC=C1Cl C4560 [0,1,0,0,0,1|2,0,0]=4 296 B8R1.5 FC1=NC=CC=C1I F10006 [0,1,0,0,0,1|2,0,0]=4 297 B8R1.5 NC1=C(Br)C=CC=N1 A1029 [0,1,0,0,0,1|2,0,0]=4 298 B8R1.5 NC1=C(Cl)C=CN=C1 A5467 [0,1,0,0,0,1|2,0,0]=4 299 B8R1.5 NC1=C(N)C=NC=C1 D5650 [0,1,0,0,0,1|2,0,0]=4 300 B8R1.5 NC1=C(N)N=CC=C1 D5372 [0,1,0,0,0,1|2,0,0]=4 301 B8R1.5 NC1=C(N)N=CC=C1 D5372 [0,1,0,0,0,1|2,0,0]=4 302 B8R1.5 NC1=C(O)C=CN=C1 A5469 [0,1,0,0,0,1|2,0,0]=4 303 B8R1.5 NC1=C(O)C=CN=C1 A5469 [0,1,0,0,0,1|2,0,0]=4 304 B8R1.5 NC1=C(O)C=NC=C1 A14525 [0,1,0,0,0,1|2,0,0]=4 305 B8R1.5 NC1=C(O)C=NC=C1 A14525 [0,1,0,0,0,1|2,0,0]=4 306 B8R1.5 NC1=CC=CN=C1Br A2720 [0,1,0,0,0,1|2,0,0]=4 307 B8R1.5 NC1=CC=CN=C1Cl A0125 [0,1,0,0,0,1|2,0,0]=4 308 B8R1.5 NC1=CC=CN=C1O A3846 [0,1,0,0,0,1|2,0,0]=4 309 B8R1.5 NC1=CC=CNC1=S A15134 [0,1,0,0,0,1|2,0,0]=4 310 B8R1.5 NC1=CC=CNC1=S A15134 [0,1,0,0,0,1|2,0,0]=4 311 B8R1.5 NC1=CC=NC=C1Br A7934 [0,1,0,0,0,1|2,0,0]=4 312 B8R1.5 NC1=CC=NC=C1Cl A12497 [0,1,0,0,0,1|2,0,0]=4 313 B8R1.5 NC1=CC=NC=C1I I13841 [0,1,0,0,0,1|2,0,0]=4 314 B8R1.5 NC1=CN=CN=C1N F12586 [0,1,0,0,0,1|1,0,1]=4 315 B8R1.5 NC1=NC=CC=C1Cl A7281 [0,1,0,0,0,1|2,0,0]=4 316 B8R1.5 NC1=NC=CC=C1O A0268 [0,1,0,0,0,1|2,0,0]=4 317 B8R1.5 NC1=NC=CN=C1Br A19171 [0,1,0,0,0,1|2,0,0]=4 318 B8R1.5 O=C1NC=CC=C1Cl C17306 [0,1,0,0,0,1|2,0,0]=4 319 B8R1.5 OC1=C(F)C=NC=N1 F11602 [0,1,0,0,0,1|1,0,1]=4 320 B8R1.5 OC1=C(O)N=CC=C1 D3231 [0,1,0,0,0,1|2,0,0]=4 321 B8R1.5 OC1=CC=CN=C1Br B2507 [0,1,0,0,0,1|2,0,0]=4 322 B8R1.5 OC1=CC=CN=C1Cl C2506 [0,1,0,0,0,1|2,0,0]=4 323 B8R1.5 OC1=CC=CN=C1Cl C2506 [0,1,0,0,0,1|2,0,0]=4 324 B8R1.5 S=C1NC=CC=C1Cl C17304 [0,1,0,0,0,1|2,0,0]=4 325 B8R1.1 CC1=NC(CO)=CN1 M14970 [0,2,0,0,0,0|2,0,0]=4 326 B8R1.1 CCC1=NC(C)=CN1 E1457 [0,2,0,0,0,0|2,0,0]=4 327 B8R1.1 CCC1=NC(C)=CN1 E1887 [0,2,0,0,0,0|2,0,0]=4 328 B8R1.1 CCC1=NNC(N)=C1 E16726 [0,2,0,0,0,0|2,0,0]=4 329 B8R1.1 CN1C=C(C=O)C=N1 M11562 [0,2,0,0,0,0|0,0,1]=3 330 B8R1.1 ClCC1=CN=C(Cl)S1 C3368 [0,2,0,0,0,0|2,0,0]=4 331 B8R1.1 OCC1=NNC(Cl)=C1 C16998 [0,2,0,0,0,0|2,0,0]=4 332 B8R1.7 CC(=O)C1=CNC=C1 P7297 [0,2,0,0,0,0|1,0,0]=3 333 B8R1.7 CC(=O)C1=CNN=C1 A17999 [0,2,0,0,0,0|0,0,0]=2 334 B8R1.7 O=C(O)C1=CNC=C1 P7298 [0,2,0,0,0,0|1,0,1]=4 335 B8R1.7 O=C(O)C1=CNC=C1 P7298 [0,2,0,0,0,0|1,0,1]=4 336 B8R1.7 O=[N+]([O-])C1=CNN=C1 N12535 [0,2,0,0,0,0|1,0,0]=3 337 B8R1.8 N#CCC1=CSC=C1 T2219 [0,2,0,0,0,0|2,0,0]=4 338 B8R1.8 N#CCC1=NNC=C1 P17143 [0,2,0,0,0,0|2,0,0]=4 339 B8R1.8 NCCC1=CNC=N1 H2293 [0,2,0,0,0,0|2,0,0]=4 340 B8R1.8 NCCC1=CNC=N1 H2389 [0,2,0,0,0,0|2,0,0]=4 341 B8R1.8 NCCC1=CSC=C1 A18159 [0,2,0,0,0,0|2,0,0]=4 342 B8R1.8 NCCN1C=CN=C1 E19344 [0,2,0,0,0,0|2,0,0]=4 343 B8R1.8 NCCN1C=CN=C1 I12545 [0,2,0,0,0,0|2,0,0]=4 344 B8R1.8 OCCC1=CNC=N1 I11788 [0,2,0,0,0,0|2,0,0]=4 345 B8R1.8 OCCC1=CNC=N1 I11788 [0,2,0,0,0,0|2,0,0]=4 346 B8R1.8 OCCN1C=CN=C1 H1461 [0,2,0,0,0,0|2,0,0]=4 347 B8R1.8 OCCN1C=NN=C1 H3524 [0,2,0,0,0,0|1,0,1]=4 348 B8R1.11 BrCC1=C(Br)SC=C1 B18447 [0,2,0,0,0,0|2,0,0]=4 349 B8R1.11 C(=O)C1=C(C)C=CS1 M0714 [0,2,0,0,0,0|2,0,0]=4 350 B8R1.11 CC1=C(C=O)N=CN1 M12761 [0,2,0,0,0,0|2,0,0]=4 351 B8R1.11 CC1=C(CO)N=CN1 M12810 [0,2,0,0,0,0|2,0,0]=4 352 B8R1.11 CC1=C(CO)NC=N1 M5101 [0,2,0,0,0,0|2,0,0]=4 353 B8R1.11 CSC1=C(C)OC=C1 M6703 [0,2,0,0,0,0|2,0,0]=4 354 B8R1.11 ClC1=C(CBr)C=CS1 C11658 [0,2,0,0,0,0|2,0,0]=4 355 B8R1.11 ClCC1=C(Cl)SN=N1 C7790 [0,2,0,0,0,0|2,0,0]=4 356 B8R1.11 N#CC1=C(Br)C=NN1 B7891 [0,2,0,0,0,0|1,0,0]=3 357 B8R1.11 N#CC1=C(N)NN=C1 A3070 [0,2,0,0,0,0|0,0,1]=3 358 B8R1.11 N#CC1=C(N)NN=C1 A3070 [0,2,0,0,0,0|0,0,1]=3 359 B8R1.11 N#CC1=C(N)ON=C1 A15501 [0,2,0,0,0,0|1,0,1]=4 360 B8R1.11 NCC1=C(Br)SC=C1 B8668 [0,2,0,0,0,0|2,0,0]=4 361 B8R1.18 CC1=C(Cl)SC(Cl)=C1 D7736 [0,2,0,0,0,0|2,0,0]=4 362 B8R1.18 CC1=NC(C)=C(C)S1 T11320 [0,2,0,0,0,0|2,0,0]=4 363 B8R1.18 CC1=NN(C)C(N)=C1 A13658 [0,2,0,0,0,0|2,0,0]=4 364 B8R1.50 CC1=C(C)C(N)=NO1 A12569 [0,2,0,0,0,0|1,0,0]=3 365 B8R1.50 CC1=C(Cl)C(N)=NN1 C14729 [0,2,0,0,0,0|1,0,0]=3 366 B8R1.50 CC1=C(O)COC1=O H15815 [0,2,0,0,0,0|2,0,0]=4 367 B8R1.50 CC1=NNC(C)=C1Br B8009 [0,2,0,0,0,0|1,0,0]=3 368 B8R1.50 CC1=NNC(N)=C1Br A3761 [0,2,0,0,0,0|1,0,0]=3 369 B8R1.50 CC1=NOC(C)=C1Br B8044 [0,2,0,0,0,0|2,0,0]=4 370 B8R1.50 CC1=NOC(C)=C1N A18208 [0,2,0,0,0,0|2,0,0]=4 371 B8R1.50 CC1=NOC(N)=C1C A11501 [0,2,0,0,0,0|1,0,0]=3 372 B8R1.50 CN1C=NC(Br)=C1Br D10638 [0,2,0,0,0,0|2,0,0]=4 373 B8R1.50 CN1N=CC(Br)=C1N A8045 [0,2,0,0,0,0|1,0,0]=3