0 B9R1.8 BrCCC1=CC=CC=C1 1700-9-47 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.8 CCCC1=CC=NC=C1 3H32-1-Z1 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.8 CNCC1=CC=CC=C1 3631-1-X0 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.8 CNCC1=CC=CC=N1 3H31-1-8T [0,0,0,0,0,0|3,0,0]=3 4 B9R1.8 CNCC1=CC=CN=C1 3H31-1-P0 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.8 COCC1=CC=CC=N1 4H07-1-Y1 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.8 ClCCC1=CC=CC=N1 3H32-5-CX [0,0,0,0,0,0|2,0,0]=2 7 B9R1.8 N#CCC1=CC=CC=C1 3737-1-01 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.8 N#CCC1=CC=CC=N1 3H37-1-M2 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.8 NCCC1=CC=CC=C1 3630-1-17 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.8 NCCC1=CC=CN=C1 3H30-1-QN [0,0,0,0,0,0|2,0,0]=2 11 B9R1.8 NCCC1=CC=NC=C1 3H30-1-V2 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.8 NOCC1=CC=CC=C1 4647-5-01 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.8 OCCC1=CC=CC=C1 2601-1-0U [0,0,0,0,0,0|2,1,0]=3 14 B9R1.8 OCCC1=CC=NC=C1 4H01-1-Z0 [0,0,0,0,0,0|3,1,0]=4 15 B9R1.8 ONCC1=CC=CC=C1 4647-5-23 [0,0,0,0,0,0|3,1,0]=4 16 B9R1.8 O\N=C\C1=NC=CC=C1 G311-A-35 [0,0,0,0,0,0|2,1,1]=4 17 B9R1.8 S=C=NC1=CC=CN=C1 7H68-1-X0 [0,0,0,0,0,0|2,0,2]=4 18 B9R1.8 SCCC1=CC=CC=C1 5661-1-05 [0,0,0,0,0,0|2,0,0]=2 19 B8R1.2 BrCC1=CC=CC=C1 1700-9-29 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.2 BrCC1=CC=CC=N1 3H32-9-5R [1,0,0,0,0,0|2,0,0]=3 21 B8R1.2 BrCC1=CC=CN=C1 3H32-9-3V [1,0,0,0,0,0|2,0,0]=3 22 B8R1.2 C#CC1=CN=CC=N1 3H32-1-Y3 [1,0,0,0,0,0|0,0,2]=3 23 B8R1.2 C#CC1=NC=CC=C1 G311-A-34 [1,0,0,0,0,0|1,0,2]=4 24 B8R1.2 CCC1=CC=CC=C1 1700-1-16 [1,0,0,0,0,0|2,0,0]=3 25 B8R1.2 CNC1=CC=CC=C1 3631-1-0S [1,0,0,0,0,0|3,0,0]=4 26 B8R1.2 COC1=CC=CC=N1 4H07-1-X8 [1,0,0,0,0,0|2,0,0]=3 27 B8R1.2 COC1=CC=CN=C1 4H07-1-Z0 [1,0,0,0,0,0|2,0,0]=3 28 B8R1.2 COC1=CC=CN=N1 4H07-1-7B [1,0,0,0,0,0|3,0,0]=4 29 B8R1.2 COC1=CCC=CC1 2407-1-01 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.2 CSC1=CC=CC=C1 5666-1-02 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.2 CSC1=NC=CC=N1 7H66-1-X8 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 ClCC1=CC=CC=N1 3H32-5-P8 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.2 ClCC1=CC=CN=C1 3H32-5-P9 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.2 ClCC1=CN=CN=C1 3H32-5-1V [1,0,0,0,0,0|3,0,0]=4 35 B8R1.2 ClCC1=NC=CC=N1 3H32-5-2G [1,0,0,0,0,0|3,0,0]=4 36 B8R1.2 N#CC1=CN=CC=N1 3H37-1-M3 [1,0,0,0,0,0|1,0,1]=3 37 B8R1.2 NCC1=CC=CC=C1 3630-1-10 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.2 NCC1=CC=CC=N1 3H30-1-T0 [1,0,0,0,0,0|2,0,0]=3 39 B8R1.2 NCC1=CN=CC=N1 3H30-1-X2 [1,0,0,0,0,0|1,0,0]=2 40 B8R1.2 NCC1=NC=CC=N1 3H30-5-X5 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.2 NCC1=NC=CC=N1 3H32-1-B9 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.2 NCC1=NC=CC=N1 4H56-1-L6 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.2 NNC1=CC=CC=N1 3H39-1-04 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.2 NNC1=CC=CN=C1 3H39-5-05 [1,0,0,0,0,0|3,0,0]=4 45 B8R1.2 NNC1=CN=CC=N1 3H39-1-Y1 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.2 O=CC1=CC=CC=N1 4H15-1-X7 [1,0,0,0,0,0|1,1,1]=4 47 B8R1.2 O=CC1=CN=CC=N1 P612-A-87 [1,0,0,0,0,0|0,1,1]=3 48 B8R1.2 OCC1=CC=CC=C1 2601-1-02 [1,0,0,0,0,0|2,1,0]=4 49 B8R1.2 OCC1=CC=CN=C1 4H01-1-Y5 [1,0,0,0,0,0|1,1,0]=3 50 B8R1.2 OCC1=CN=CN=C1 4H01-1-Q7 [1,0,0,0,0,0|2,1,0]=4 51 B8R1.2 OCC1=NC=CC=N1 4H01-1-5H [1,0,0,0,0,0|2,1,0]=4 52 B8R1.2 OCC1=NC=CN=C1 4H01-1-Q6 [1,0,0,0,0,0|0,1,0]=2 53 B10R1.1 CC1=CC=C(CCN)C=C1 3730-1-31 [0,1,0,0,0,0|3,0,0]=4 54 B10R1.1 CCCC1=CC=C(Br)C=C1 1700-9-Z0 [0,1,0,0,0,0|3,0,0]=4 55 B10R1.1 CCCC1=CC=C(Cl)C=C1 1700-5-58 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.1 CCCC1=CN=C(Cl)N=C1 3H32-5-U0 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.1 CCOC1=CC=C(Br)C=N1 4H07-9-X6 [0,1,0,0,0,0|3,0,0]=4 58 B10R1.1 CCOC1=CC=C(Br)N=C1 4H07-9-X7 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.1 CCOC1=CC=C(N)C=N1 4H56-1-598 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.1 FC1=CC=C(CCBr)C=C1 1700-B-41 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.1 FC1=CC=C(CCCl)C=C1 1700-7-06 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.1 NC1=CC=C(CCO)C=C1 4756-1-Y3 [0,1,0,0,0,0|2,1,0]=4 63 B10R1.1 NCCC1=CC=C(Br)C=C1 3730-9-02 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.1 NCCC1=CC=C(Br)C=C1 3730-9-04 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.1 NCCC1=CC=C(F)C=C1 3630-3-X1 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.1 NCCC1=CC=C(N)C=C1 3730-1-15 [0,1,0,0,0,0|3,0,0]=4 67 B10R1.1 OC1=CC=C(CCBr)C=C1 2701-9-11 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.1 OCCC1=CC=C(Br)C=C1 2701-9-Y1 [0,1,0,0,0,0|2,1,0]=4 69 B10R1.1 OCCC1=CC=C(Cl)C=C1 2701-5-X6 [0,1,0,0,0,0|2,1,0]=4 70 B10R1.1 OCCC1=CC=C(F)C=C1 2601-3-84 [0,1,0,0,0,0|2,1,0]=4 71 B10R1.1 OCCC1=CC=C(O)C=C1 2704-1-X4 [0,1,0,0,0,0|2,1,0]=4 72 B10R1.4 BrCCC1=CC=CC=C1Br 1700-9-57 [0,1,0,0,0,0|3,0,0]=4 73 B10R1.4 CC1=CC=CC=C1CCN 3730-1-29 [0,1,0,0,0,0|3,0,0]=4 74 B10R1.4 CC1=CC=CC=C1CCO 2701-1-0E [0,1,0,0,0,0|2,1,0]=4 75 B10R1.4 CCCC1=NC=NC=C1Br 3H32-9-Z9 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.4 NCCC1=CC=CC=C1Cl 3730-5-07 [0,1,0,0,0,0|3,0,0]=4 77 B10R1.4 NCCC1=CC=CC=C1F 3630-3-65 [0,1,0,0,0,0|3,0,0]=4 78 B10R1.4 OCCC1=C(Br)C=CC=C1 2701-9-01 [0,1,0,0,0,0|2,1,0]=4 79 B10R1.10 CC1=CC=CC(CCN)=C1 3730-1-30 [0,1,0,0,0,0|3,0,0]=4 80 B10R1.10 CCOC1=CC=CC(Br)=N1 4H07-9-X8 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.10 CCOC1=CN=CC(N)=C1 4H30-1-0B [0,1,0,0,0,0|3,0,0]=4 82 B10R1.10 ClC1=CC(CCBr)=CC=C1 1700-D-0F [0,1,0,0,0,0|3,0,0]=4 83 B10R1.10 FC1=CC=CC(CCBr)=C1 1700-B-31 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.10 NCCC1=CC=CC(Cl)=C1 3730-5-08 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.10 NCCC1=CC=CC(O)=C1 4756-5-12 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.10 OCCC1=CC=CC(Br)=C1 2701-9-00 [0,1,0,0,0,0|2,1,0]=4 87 B10R1.10 OCCC1=CC=CC(F)=C1 2601-3-Y1 [0,1,0,0,0,0|2,1,0]=4 88 B10R1.10 OCCC1=CC=CC(O)=C1 2604-1-0D [0,1,0,0,0,0|2,1,0]=4 89 B10R1.15 CC(CN)C1=CC=CC=C1 3730-1-Z4 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.15 NCC(O)C1=CC=CC=C1 4656-1-T1 [0,1,0,0,0,0|3,0,0]=4 91 B10R1.15 NCC(O)C1=CC=CN=C1 4H56-5-Q3 [0,1,0,0,0,0|2,0,0]=3 92 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 4656-1-R1 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.15 NC[C@H](O)C1=CC=CC=C1 4656-1-S1 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.15 N[C@H](CO)C1=CC=CC=C1 4656-1-S3 [0,1,0,0,0,0|2,1,0]=4 95 B10R1.15 N\C(=N/O)C1=NC=CN=C1 4H47-1-X8 [0,1,0,0,0,0|1,1,1]=4 96 B10R1.15 O=C(CBr)C1=CC=CC=N1 4H56-9-W5 [0,1,0,0,0,0|2,0,1]=4 97 B10R1.15 O=C(CBr)C1=CC=CN=C1 4H17-9-X0 [0,1,0,0,0,0|2,0,1]=4 98 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 2604-1-S1 [0,1,0,0,0,0|2,1,0]=4 99 B10R1.15 O[C@H](CCl)C1=CC=CC=C1 2602-5-S1 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.15 [C@H](C)(CN)C1=CC=CC=C1 3730-1-Y2 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 4630-1-V2T [0,1,0,0,0,0|2,1,0]=4 102 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 4656-1-V2 [0,1,0,0,0,0|2,1,0]=4 103 B10R1.17 BrCCCC1=CC=CC=C1 1700-9-Z5 [0,1,0,0,0,0|3,0,0]=4 104 B10R1.17 BrCCOC1=CC=CC=C1 2607-9-X6 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.17 CCNCC1=CC=CC=C1 3731-1-04 [0,1,0,0,0,0|3,0,0]=4 106 B10R1.17 CCNCC1=CC=CC=N1 3H31-1-3M [0,1,0,0,0,0|2,0,0]=3 107 B10R1.17 CNCCC1=CC=CC=N1 3H31-1-Q6 [0,1,0,0,0,0|2,0,0]=3 108 B10R1.17 ClCCSC1=CC=CC=C1 5666-5-04 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.17 NCCCC1=CC=CC=C1 3H30-1-H6 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.17 NCCNC1=CC=CC=N1 3H31-5-17 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.17 NCCOC1=CC=CC=C1 4656-1-Y0 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.17 OCC#CC1=CC=CC=N1 4H56-1-0G6 [0,1,0,0,0,0|1,1,1]=4 113 B10R1.17 OCC#CC1=CC=CN=C1 4H56-1-0G1 [0,1,0,0,0,0|1,1,1]=4 114 B10R1.17 OCCCC1=CC=CC=N1 4H56-1-LM [0,1,0,0,0,0|1,1,0]=3 115 B10R1.17 OCCNC1=CC=CC=N1 4H56-1-FB [0,1,0,0,0,0|1,1,0]=3 116 B10R1.17 OCCNC1=CC=CC=N1 4H56-5-20 [0,1,0,0,0,0|1,1,0]=3 117 B10R1.17 OCCOC1=CC=CC=C1 2607-1-06 [0,1,0,0,0,0|2,1,0]=4 118 B10R1.17 S=C=NCC1=CC=CN=C1 7H68-9-01 [0,1,0,0,0,0|1,0,2]=4 119 B10R1.18 CC(C)CC1=CC=CC=C1 1700-1-X0 [0,1,0,0,0,0|3,0,0]=4 120 B10R1.18 O=C(O)CC1=CC=CC=N1 4H58-5-0B [0,1,0,0,0,0|1,1,1]=4 121 B10R1.18 O=C(O)CC1=CC=CN=C1 4H21-1-J9 [0,1,0,0,0,0|1,1,1]=4 122 B10R1.18 O=C(O)CC1=CC=CN=C1 4H21-5-Z8 [0,1,0,0,0,0|1,1,1]=4 123 B10R2.6 [C@H]1(C2=CC=CC=C2)CO1 2609-1-S2 [0,0,0,1,0,0|2,1,0]=4 124 B10R2.7 C1=CC2=C(C=N1)CNC2 3H32-5-1K [0,0,0,1,0,0|3,0,0]=4 125 B10R2.7 C1=CC2=CN=CC=C2S1 7H70-1-V1 [0,0,0,1,0,0|1,0,2]=4 126 B10R2.7 C1=CC=C2NCCC2=C1 3H31-1-U9 [0,0,0,1,0,0|3,0,0]=4 127 B10R2.7 C1=CC=C2OCCC2=C1 2H10-1-Y1 [0,0,0,1,0,0|2,1,0]=4 128 B10R2.7 C1=CN=C2NCCC2=C1 3H32-1-B0 [0,0,0,1,0,0|2,0,0]=3 129 B10R2.7 C1=CN=C2SC=CC2=C1 7H70-1-77 [0,0,0,1,0,0|1,0,2]=4 130 B10R2.320 BrC1CC2=CC=CC=C21 1600-9-0A [0,0,0,1,0,0|3,0,0]=4 131 B8R1.8 CNCC1=CC=CO1 4H56-1-395 [0,0,0,0,1,0|3,0,0]=4 132 B8R1.8 CNCC1=CN=CS1 7H33-5-0A [0,0,0,0,1,0|3,0,0]=4 133 B8R1.8 CSCC1=CC=CO1 6H66-1-0X [0,0,0,0,1,0|3,0,0]=4 134 B8R1.8 FCCN1C=CC=N1 3H32-3-CG [0,0,0,0,1,0|2,0,0]=3 135 B8R1.8 N#CCC1=CC=CS1 7H37-1-N5 [0,0,0,0,1,0|2,0,1]=4 136 B8R1.8 N#CCC1=CNC=N1 3H37-1-1C [0,0,0,0,1,0|1,0,2]=4 137 B8R1.8 NCCC1=CC=CS1 7H30-1-X0 [0,0,0,0,1,0|2,0,0]=3 138 B8R1.8 NCCC1=CNC=N1 3H30-5-V3 [0,0,0,0,1,0|1,0,1]=3 139 B8R1.8 NCCC1=CSC=C1 7H30-5-X3 [0,0,0,0,1,0|2,0,0]=3 140 B8R1.8 NCCN1C=CN=C1 3H30-9-Y4 [0,0,0,0,1,0|2,0,0]=3 141 B8R1.8 NCCN1C=NC=N1 3H30-5-X9 [0,0,0,0,1,0|2,0,0]=3 142 B8R1.8 OCCC1=CC=CS1 6H01-1-01 [0,0,0,0,1,0|1,1,0]=3 143 B8R1.8 OCCC1=CNC=N1 4H56-1-833 [0,0,0,0,1,0|0,1,1]=3 144 B8R1.8 OCCC1=CNN=C1 4H01-1-Y9 [0,0,0,0,1,0|1,1,0]=3 145 B8R1.8 OCCC1=CSC=C1 6H01-1-12 [0,0,0,0,1,0|1,1,0]=3 146 B8R1.8 OCCN1C=CC=C1 4H01-1-66 [0,0,0,0,1,0|2,1,0]=4 147 B8R1.8 OCCN1C=CC=N1 4H01-1-U5 [0,0,0,0,1,0|1,1,0]=3 148 B7R1.3 BrC1=CC=CN=C1 3H32-9-N6 [2,0,0,0,0,0|2,0,0]=4 149 B7R1.3 BrC1=CN=CC=N1 P612-A-24 [2,0,0,0,0,0|1,0,0]=3 150 B7R1.3 BrC1=NC=CC=C1 3H32-9-02 [2,0,0,0,0,0|2,0,0]=4 151 B7R1.3 CC1=CC=CN=N1 3H32-1-A9 [2,0,0,0,0,0|2,0,0]=4 152 B7R1.3 CC1=CC=NC=N1 3H32-1-9Z [2,0,0,0,0,0|2,0,0]=4 153 B7R1.3 CC1=CC=NN=C1 3H32-1-G7 [2,0,0,0,0,0|2,0,0]=4 154 B7R1.3 CC1=CCC=CC1 1200-1-0A [2,0,0,0,0,0|2,0,0]=4 155 B7R1.3 CC1=CN=CC=N1 3H32-1-1R [2,0,0,0,0,0|0,0,0]=2 156 B7R1.3 CC1=CN=CN=C1 3H32-1-J3 [2,0,0,0,0,0|2,0,0]=4 157 B7R1.3 ClC1=CC=CN=C1 3H32-5-X8 [2,0,0,0,0,0|2,0,0]=4 158 B7R1.3 ClC1=CN=CC=N1 3H32-5-J3 [2,0,0,0,0,0|1,0,0]=3 159 B7R1.3 ClC1=NC=CC=C1 3H32-5-K6 [2,0,0,0,0,0|2,0,0]=4 160 B7R1.3 FC1=CC=CN=C1 3H32-3-03 [2,0,0,0,0,0|2,0,0]=4 161 B7R1.3 FC1=NC=CC=C1 3H32-3-34 [2,0,0,0,0,0|2,0,0]=4 162 B7R1.3 FC1=NC=CN=C1 3H31-3-X0 [2,0,0,0,0,0|1,0,0]=3 163 B7R1.3 IC1=CC=CN=C1 3H32-H-X0 [2,0,0,0,0,0|2,0,0]=4 164 B7R1.3 IC1=CN=CC=N1 3H32-H-X2 [2,0,0,0,0,0|1,0,0]=3 165 B7R1.3 NC1=CC=CC=N1 3H30-1-02 [2,0,0,0,0,0|2,0,0]=4 166 B7R1.3 NC1=CC=CN=C1 3H30-1-XB [2,0,0,0,0,0|2,0,0]=4 167 B7R1.3 NC1=CN=CC=N1 3H30-1-T9 [2,0,0,0,0,0|1,0,0]=3 168 B7R1.3 NC1=NC=CN=N1 3H30-1-6N [2,0,0,0,0,0|2,0,0]=4 169 B7R1.3 OC1=CC=CC=N1 4H01-1-1U [2,0,0,0,0,0|1,1,0]=4 170 B7R1.3 OC1=CN=CC=N1 4H01-1-5M [2,0,0,0,0,0|0,1,0]=3 171 B7R1.3 SC1=CC=CC=N1 7H61-1-X1 [2,0,0,0,0,0|1,0,0]=3 172 B7R1.3 SC1=NC=CC=N1 7H61-1-Y0 [2,0,0,0,0,0|2,0,0]=4 173 B9R1.1 C#CC1=NC=C(C)N=C1 3H32-1-Y7 [1,1,0,0,0,0|0,0,2]=4 174 B9R1.1 CC1=CC=C(CN)N=C1 3H30-1-BP [1,1,0,0,0,0|2,0,0]=4 175 B9R1.1 CC1=CC=C(CO)C=N1 3H01-1-X2 [1,1,0,0,0,0|1,1,0]=4 176 B9R1.1 CC1=CN=C(C=O)C=N1 4H15-1-G7 [1,1,0,0,0,0|0,1,1]=4 177 B9R1.1 CCC1=CC=C(Br)C=C1 1700-9-Y6 [1,1,0,0,0,0|2,0,0]=4 178 B9R1.1 CCC1=CC=C(Br)C=N1 3H32-9-8N [1,1,0,0,0,0|1,0,0]=3 179 B9R1.1 CCC1=CC=C(C)N=C1 3H32-1-2W [1,1,0,0,0,0|1,0,0]=3 180 B9R1.1 CCC1=CC=C(Cl)C=C1 1700-5-53 [1,1,0,0,0,0|2,0,0]=4 181 B9R1.1 CCC1=CC=C(F)C=C1 1700-3-50 [1,1,0,0,0,0|2,0,0]=4 182 B9R1.1 CCC1=CC=C(I)C=C1 1700-H-01 [1,1,0,0,0,0|2,0,0]=4 183 B9R1.1 CCC1=CN=C(Cl)N=C1 3H32-5-V5 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.1 COC1=CC=C(Cl)C=N1 4H07-5-24 [1,1,0,0,0,0|2,0,0]=4 185 B9R1.1 COC1=CC=C(Cl)N=C1 4H56-5-9D [1,1,0,0,0,0|2,0,0]=4 186 B9R1.1 COC1=CC=C(N)C=N1 4H56-1-YW [1,1,0,0,0,0|2,0,0]=4 187 B9R1.1 COC1=CC=C(N)N=C1 4H56-1-YX [1,1,0,0,0,0|2,0,0]=4 188 B9R1.1 COC1=CC=C(O)C=N1 6660-1-U6 [1,1,0,0,0,0|2,0,0]=4 189 B9R1.1 COC1=CN=C(Br)C=C1 P311-A-53 [1,1,0,0,0,0|2,0,0]=4 190 B9R1.1 COC1=CN=C(Br)C=N1 4H07-9-Y4 [1,1,0,0,0,0|1,0,0]=3 191 B9R1.1 COC1=CN=C(N)C=N1 4H30-1-6B [1,1,0,0,0,0|1,0,0]=3 192 B9R1.1 COC1=NC=C(F)C=C1 4H07-3-X0 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.1 CSC1=CC=C(Br)C=N1 7H66-9-X1 [1,1,0,0,0,0|2,0,0]=4 194 B9R1.1 ClCC1=CC=C(Cl)C=N1 3H32-5-GS [1,1,0,0,0,0|2,0,0]=4 195 B9R1.1 ClCC1=CC=C(Cl)N=C1 3H32-5-W0 [1,1,0,0,0,0|2,0,0]=4 196 B9R1.1 FC1=CC=C(CS)C=C1 5661-3-14 [1,1,0,0,0,0|2,0,0]=4 197 B9R1.1 N#CC1=NC=C(Br)N=C1 3H37-9-Y9 [1,1,0,0,0,0|1,0,1]=4 198 B9R1.1 N#CC1=NC=C(Cl)N=C1 3H37-5-X7 [1,1,0,0,0,0|1,0,1]=4 199 B9R1.1 N#CC1=NC=C(N)N=C1 3H37-1-U4 [1,1,0,0,0,0|1,0,1]=4 200 B9R1.1 NC1=CC=C(CO)C=N1 4H56-1-VG [1,1,0,0,0,0|1,1,0]=4 201 B9R1.1 NCC1=CC=C(Br)N=C1 3H30-9-0A [1,1,0,0,0,0|2,0,0]=4 202 B9R1.1 NCC1=CC=C(Cl)C=N1 3H30-5-V5 [1,1,0,0,0,0|2,0,0]=4 203 B9R1.1 NNC1=NC=C(Cl)N=C1 3H39-5-0A [1,1,0,0,0,0|2,0,0]=4 204 B9R1.1 OCC1=CC=C(Cl)C=N1 4H01-5-X2 [1,1,0,0,0,0|1,1,0]=4 205 B9R1.1 OCC1=CC=C(F)N=C1 4H01-3-0P [1,1,0,0,0,0|1,1,0]=4 206 B9R1.1 OCC1=CN=C(Cl)C=C1 4H01-5-Y0 [1,1,0,0,0,0|1,1,0]=4 207 B9R1.1 OCC1=NC=C(Br)C=C1 P311-A-19 [1,1,0,0,0,0|1,1,0]=4 208 B9R1.1 SCC1=CC=C(Br)C=C1 5661-9-02 [1,1,0,0,0,0|2,0,0]=4 209 B9R1.2 CC1=CC=CC(CCl)=N1 3H32-5-FW [1,1,0,0,0,0|2,0,0]=4 210 B9R1.2 CC1=CC=CC(CN)=N1 3H33-5-35 [1,1,0,0,0,0|2,0,0]=4 211 B9R1.2 CC1=CC=CC(CO)=N1 4H01-1-77 [1,1,0,0,0,0|1,1,0]=4 212 B9R1.2 CC1=CC=CC(CS)=C1 5761-1-X7 [1,1,0,0,0,0|2,0,0]=4 213 B9R1.2 CCC1=CC=CC(N)=C1 3730-1-0E [1,1,0,0,0,0|2,0,0]=4 214 B9R1.2 CCC1=CC=CC(N)=N1 3H30-1-Y0 [1,1,0,0,0,0|1,0,0]=3 215 B9R1.2 CCC1=CN=CC(Br)=C1 4H56-9-M2 [1,1,0,0,0,0|1,0,0]=3 216 B9R1.2 CNC1=CN=CC(Cl)=N1 3H31-5-Z8 [1,1,0,0,0,0|1,0,0]=3 217 B9R1.2 COC1=CC(Br)=CC=N1 4H07-9-Y0 [1,1,0,0,0,0|2,0,0]=4 218 B9R1.2 COC1=CC(Cl)=CC=N1 4H56-5-9A [1,1,0,0,0,0|2,0,0]=4 219 B9R1.2 COC1=CC(I)=CC=N1 4H56-H-31 [1,1,0,0,0,0|2,0,0]=4 220 B9R1.2 COC1=CC(N)=CN=C1 4H56-1-9H [1,1,0,0,0,0|2,0,0]=4 221 B9R1.2 COC1=CC=CC(Br)=N1 4H07-9-Y3 [1,1,0,0,0,0|2,0,0]=4 222 B9R1.2 COC1=CC=CC(C)=N1 4H07-1-Y9 [1,1,0,0,0,0|2,0,0]=4 223 B9R1.2 COC1=CC=CC(F)=N1 4H07-3-09 [1,1,0,0,0,0|2,0,0]=4 224 B9R1.2 COC1=CC=CC(N)=N1 P911-A-26 [1,1,0,0,0,0|2,0,0]=4 225 B9R1.2 COC1=CN=CC(Br)=C1 4H07-9-Y5 [1,1,0,0,0,0|2,0,0]=4 226 B9R1.2 COC1=CN=CC(Br)=N1 4H07-9-Y6 [1,1,0,0,0,0|1,0,0]=3 227 B9R1.2 COC1=CN=CC(Cl)=N1 4H07-5-1M [1,1,0,0,0,0|1,0,0]=3 228 B9R1.2 CSC1=CN=CC(Br)=C1 7H66-9-X2 [1,1,0,0,0,0|2,0,0]=4 229 B9R1.2 FC1=CN=CC(CCl)=C1 3H32-7-W7 [1,1,0,0,0,0|2,0,0]=4 230 B9R1.2 NCC1=CC=CC(F)=N1 3H30-7-13 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.2 OCC1=CC(Cl)=CN=C1 4H01-5-0M [1,1,0,0,0,0|1,1,0]=4 232 B9R1.2 OCC1=CC=CC(Cl)=N1 4H56-5-H4 [1,1,0,0,0,0|1,1,0]=4 233 B9R1.2 OCC1=CN=CC(Br)=C1 4H56-9-W0 [1,1,0,0,0,0|1,1,0]=4 234 B9R1.2 OCC1=NC=CC(Cl)=C1 4H01-5-X9 [1,1,0,0,0,0|1,1,0]=4 235 B9R1.2 SCC1=CC=CC(Br)=C1 5661-9-00 [1,1,0,0,0,0|2,0,0]=4 236 B9R1.6 CC(=O)C1=CN=CC=N1 4H56-1-K0 [1,1,0,0,0,0|0,0,1]=3 237 B9R1.6 CC(Br)C1=CC=CC=C1 1700-9-01 [1,1,0,0,0,0|2,0,0]=4 238 B9R1.6 CC(C)C1=CC=CC=N1 3H32-1-C8 [1,1,0,0,0,0|1,0,0]=3 239 B9R1.6 CC(N)C1=CC=CC=N1 3H30-1-P4 [1,1,0,0,0,0|1,0,0]=3 240 B9R1.6 CC(N)C1=CC=CN=C1 3H30-1-P5 [1,1,0,0,0,0|1,0,0]=3 241 B9R1.6 CC(O)C1=CC=CC=N1 4H02-1-X1 [1,1,0,0,0,0|1,0,0]=3 242 B9R1.6 CC(S)C1=CC=CC=C1 5661-1-06 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.6 CN(C)C1=CC=CN=C1 3H32-1-73 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.6 C[C@@H](N)C1=CC=CC=C1 3630-1-R4 [1,1,0,0,0,0|2,0,0]=4 245 B9R1.6 C[C@@H](O)C1=CC=CC=C1 2602-1-R0 [1,1,0,0,0,0|2,0,0]=4 246 B9R1.6 C[C@H](N)C1=CC=CC=C1 3630-1-S2 [1,1,0,0,0,0|2,0,0]=4 247 B9R1.6 C[C@H](O)C1=CC=CC=C1 2602-1-S0 [1,1,0,0,0,0|2,0,0]=4 248 B9R1.6 FC(F)C1=CC=CC=N1 3H32-3-Q5 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.6 N=C(N)C1=CN=CC=N1 3H41-5-X4 [1,1,0,0,0,0|1,0,1]=4 250 B9R1.6 NC(=S)C1=CN=CC=N1 7H67-1-50 [1,1,0,0,0,0|0,0,2]=4 251 B9R1.6 O=C(O)C1=CN=CC=N1 4H21-1-02 [1,1,0,0,0,0|0,1,1]=4 252 B9R1.15 C#CC1=NC=CN=C1C 3H32-1-Y5 [1,1,0,0,0,0|0,0,2]=4 253 B9R1.15 C#CC1=NC=CN=C1Cl 3H32-5-Y6 [1,1,0,0,0,0|0,0,2]=4 254 B9R1.15 CC1=NC=CN=C1NN 3H39-1-X1 [1,1,0,0,0,0|2,0,0]=4 255 B9R1.15 CCC1=CC=CC=C1Br 1700-9-Y8 [1,1,0,0,0,0|2,0,0]=4 256 B9R1.15 CCC1=CC=CC=C1Cl 1700-5-52 [1,1,0,0,0,0|2,0,0]=4 257 B9R1.15 CCC1=CC=CC=C1I 2700-H-X1 [1,1,0,0,0,0|2,0,0]=4 258 B9R1.15 CCC1=NC=NC=C1Br 3732-9-X0 [1,1,0,0,0,0|2,0,0]=4 259 B9R1.15 COC1=CC=CN=C1Br 4H07-9-X4 [1,1,0,0,0,0|2,0,0]=4 260 B9R1.15 COC1=CC=CN=C1Cl 4H07-5-22 [1,1,0,0,0,0|2,0,0]=4 261 B9R1.15 COC1=CC=CN=C1N 4H30-1-01 [1,1,0,0,0,0|2,0,0]=4 262 B9R1.15 COC1=NC=CC=C1Br 4H07-9-37 [1,1,0,0,0,0|2,0,0]=4 263 B9R1.15 COC1=NC=CC=C1Cl 4H07-5-Z0 [1,1,0,0,0,0|2,0,0]=4 264 B9R1.15 COC1=NC=CC=C1F 4H07-3-X6 [1,1,0,0,0,0|2,0,0]=4 265 B9R1.15 COC1=NC=CC=C1I 4H56-H-38 [1,1,0,0,0,0|2,0,0]=4 266 B9R1.15 COC1=NC=CC=C1N 4H56-1-WC [1,1,0,0,0,0|2,0,0]=4 267 B9R1.15 COC1=NC=CN=C1Cl 4H07-5-Z1 [1,1,0,0,0,0|1,0,0]=3 268 B9R1.15 CSC1=CC=CN=C1F 7H66-3-0F [1,1,0,0,0,0|2,0,0]=4 269 B9R1.15 ClCC1=CC=CN=C1Cl 3H32-5-2C [1,1,0,0,0,0|2,0,0]=4 270 B9R1.15 N#CC1=NC=CN=C1Cl 3H37-5-01 [1,1,0,0,0,0|1,0,1]=4 271 B9R1.15 NC1=NC=CC=C1CO 4H56-1-VW [1,1,0,0,0,0|1,1,0]=4 272 B9R1.15 NCC1=CC=CN=C1Cl 3H30-5-48 [1,1,0,0,0,0|2,0,0]=4 273 B9R1.15 NCC1=NC=CN=C1Cl 3H30-7-Y2 [1,1,0,0,0,0|1,0,0]=3 274 B9R1.15 NNC1=NC=CN=C1Cl 3H39-5-X1 [1,1,0,0,0,0|2,0,0]=4 275 B9R1.15 OCC1=C(F)N=CC=C1 4H01-3-19 [1,1,0,0,0,0|1,1,0]=4 276 B9R1.15 OCC1=CC=CN=C1Cl 4H56-5-Y2 [1,1,0,0,0,0|1,1,0]=4 277 B9R1.15 OCC1=NC=CC=C1Br 4H01-9-X2 [1,1,0,0,0,0|1,1,0]=4 278 B9R1.15 OCC1=NC=CC=C1F 4H01-3-17 [1,1,0,0,0,0|1,1,0]=4 279 B9R1.15 OCC1=NC=CC=C1O 4H56-5-Z3 [1,1,0,0,0,0|1,1,0]=4 280 B9R1.7 CC1=NC(CCO)=CS1 8H01-1-X0 [0,1,0,0,1,0|1,1,0]=4 281 B9R1.7 NCCC1=NNC(N)=N1 3H30-5-Z5 [0,1,0,0,1,0|2,0,0]=4 282 B9R1.12 CCCCC1=CC=CO1 2H10-1-X2 [0,1,0,0,1,0|2,0,0]=4 283 B9R1.12 CCCCN1C=CN=C1 3H32-1-CJ [0,1,0,0,1,0|2,0,0]=4 284 B9R1.12 NCCCN1C=NC=N1 3H30-5-Z0 [0,1,0,0,1,0|2,0,0]=4 285 B9R1.12 OCCCN1C=CN=C1 4H01-1-46 [0,1,0,0,1,0|1,1,0]=4 286 B9R1.13 CC(C)CC1=NC=CS1 7H70-1-28 [0,1,0,0,1,0|2,0,0]=4 287 B9R1.33 CC1=C(CCO)SC=N1 8H01-1-X2 [0,1,0,0,1,0|1,1,0]=4 288 B11R1.17 OCCNC1=NC=CN=C1Cl 4H56-5-J0 [0,2,0,0,0,0|0,1,0]=3 289 B11R1.24 CC1=CC=CC(CCCO)=N1 4H56-1-893 [0,2,0,0,0,0|1,1,0]=4 290 B11R1.24 CCCNC1=CC=CC(Br)=N1 3H33-D-0A [0,2,0,0,0,0|2,0,0]=4 291 B11R1.24 CCCOC1=CN=CC(C)=N1 4H56-1-413 [0,2,0,0,0,0|1,0,0]=3 292 B11R1.16 CCOC(=O)C1=NC=CN=C1 4H23-1-3E [0,2,0,0,0,0|1,0,1]=4 293 B11R1.16 CN(CCO)C1=CC=CC=N1 4H32-1-13 [0,2,0,0,0,0|1,1,0]=4 294 B11R1.28 NCCSSC1=CC=CC=N1 7H66-5-1D [0,2,0,0,0,0|2,0,0]=4 295 B11R1.91 CN(C)CCC1=CC=CC=N1 3H32-1-N6 [0,2,0,0,0,0|2,0,0]=4 296 B11R1.91 O=C(O)CCC1=CC=CN=C1 4H21-1-XY [0,2,0,0,0,0|1,1,0]=4 297 B9R2.2 C1=CC(C2CC2)=NN1 3H32-1-0G [0,0,0,1,1,0|2,0,0]=4 298 B11R2.34 NC1=CC=C(C2CC2)N=C1 3H30-1-BF [0,1,0,1,0,0|2,0,0]=4 299 B11R2.36 BrC1=CN=C2NCCC2=C1 3H31-9-60 [0,1,0,1,0,0|2,0,0]=4 300 B11R2.55 NC1=C(C2CC2)C=CC=N1 3H30-1-UQ [0,1,0,1,0,0|2,0,0]=4 301 B11R2.106 ClC1=CC=NC2=C1CCC2 3H32-5-BT [0,1,0,1,0,0|2,0,0]=4 302 B7R1.1 BrCC1=CSC=C1 5H66-9-21 [1,0,0,0,1,0|2,0,0]=4 303 B7R1.1 CCC1=CC=CN1 3H32-1-48 [1,0,0,0,1,0|0,0,1]=3 304 B7R1.1 CCC1=CC=CO1 2H10-1-17 [1,0,0,0,1,0|1,0,0]=3 305 B7R1.1 CCN1C=CC=C1 3H32-1-47 [1,0,0,0,1,0|2,0,0]=4 306 B7R1.1 CCN1C=CN=C1 3H32-1-W0 [1,0,0,0,1,0|1,0,0]=3 307 B7R1.1 COC1=CSC=C1 6H07-1-01 [1,0,0,0,1,0|2,0,0]=4 308 B7R1.1 COC1=NC=CS1 8H70-1-81 [1,0,0,0,1,0|2,0,0]=4 309 B7R1.1 CSC1=CC=CS1 5H66-1-X2 [1,0,0,0,1,0|2,0,0]=4 310 B7R1.1 CSC1=CSC=C1 5H55-1-X0 [1,0,0,0,1,0|2,0,0]=4 311 B7R1.1 CSC1=NC=CS1 7H66-1-0U [1,0,0,0,1,0|2,0,0]=4 312 B7R1.1 ClCC1=CNC=N1 3H31-5-Z5 [1,0,0,0,1,0|1,0,1]=4 313 B7R1.1 ClCC1=CSC=N1 7H70-5-Z9 [1,0,0,0,1,0|2,0,0]=4 314 B7R1.1 NCC1=CC=CO1 4H56-1-1H [1,0,0,0,1,0|2,0,0]=4 315 B7R1.1 NCC1=CC=CS1 7H30-1-X3 [1,0,0,0,1,0|2,0,0]=4 316 B7R1.1 NCC1=CN=CO1 4H30-5-X0 [1,0,0,0,1,0|2,0,0]=4 317 B7R1.1 NCC1=COC=C1 4H30-5-X1 [1,0,0,0,1,0|2,0,0]=4 318 B7R1.1 NCC1=CSC=C1 7H30-1-Y4 [1,0,0,0,1,0|2,0,0]=4 319 B7R1.1 NCC1=NC=CN1 3H30-1-55 [1,0,0,0,1,0|1,0,1]=4 320 B7R1.1 NCC1=NC=CN1 3H30-5-16 [1,0,0,0,1,0|1,0,1]=4 321 B7R1.1 NCC1=NC=CS1 7H30-1-Y5 [1,0,0,0,1,0|2,0,0]=4 322 B7R1.1 NCC1=NC=CS1 7H30-7-X0 [1,0,0,0,1,0|2,0,0]=4 323 B7R1.1 OCC1=CC=CO1 2H01-1-16 [1,0,0,0,1,0|1,1,0]=4 324 B7R1.1 OCC1=CC=CS1 6H01-1-X6 [1,0,0,0,1,0|1,1,0]=4 325 B7R1.1 OCC1=CN=CS1 P311-A-67 [1,0,0,0,1,0|1,1,0]=4 326 B7R1.1 OCC1=CNC=N1 G311-A-53 [1,0,0,0,1,0|0,1,1]=4 327 B7R1.1 OCC1=COC=N1 4H01-1-Q8 [1,0,0,0,1,0|1,1,0]=4 328 B7R1.1 OCC1=CSC=C1 6H01-1-X0 [1,0,0,0,1,0|1,1,0]=4 329 B7R1.1 OCC1=NC=CS1 8H01-1-X5 [1,0,0,0,1,0|1,1,0]=4