0 B10R1.17 BrCCCC1=CC=CC=C1 1700-9-Z5 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.17 BrCCOC1=CC=CC=C1 2607-9-X6 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.17 CCNCC1=CC=CC=C1 3731-1-04 [0,0,0,0,0,0|2,0,0]=2 3 B10R1.17 CCNCC1=CC=CC=N1 3H31-1-3M [0,0,0,0,0,0|3,0,0]=3 4 B10R1.17 CNCCC1=CC=CC=N1 3H31-1-Q6 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.17 COCSC1=CC=CC=C1 6666-1-0Q [0,0,0,0,0,0|3,0,0]=3 6 B10R1.17 ClCCSC1=CC=CC=C1 5666-5-04 [0,0,0,0,0,0|2,0,0]=2 7 B10R1.17 N#CCNC1=CC=CC=C1 3637-1-0H [0,0,0,0,0,0|2,0,1]=3 8 B10R1.17 N#CCSC1=CC=CC=C1 7666-1-W9 [0,0,0,0,0,0|2,0,1]=3 9 B10R1.17 NCCCC1=CC=CC=C1 3H30-1-H6 [0,0,0,0,0,0|1,0,0]=1 10 B10R1.17 NCCNC1=CC=CC=N1 3H31-5-17 [0,0,0,0,0,0|3,0,0]=3 11 B10R1.17 NCCNC1=CC=NC=C1 3H31-5-18 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.17 NCCOC1=CC=CC=C1 4656-1-Y0 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.17 O=CC#CC1=CC=CC=C1 2915-1-09 [0,0,0,0,0,0|0,0,4]=4 14 B10R1.17 OCC#CC1=CC=CC=C1 2901-1-02 [0,0,0,0,0,0|0,0,2]=2 15 B10R1.17 OCC#CC1=CC=CC=N1 4H56-1-0G6 [0,0,0,0,0,0|1,0,2]=3 16 B10R1.17 OCC#CC1=CC=CN=C1 4H56-1-0G1 [0,0,0,0,0,0|1,0,2]=3 17 B10R1.17 OCC#CC1=CC=NC=C1 4H01-1-AU [0,0,0,0,0,0|1,0,2]=3 18 B10R1.17 OCCCC1=CC=CC=N1 4H56-1-LM [0,0,0,0,0,0|1,0,0]=1 19 B10R1.17 OCCNC1=CC=CC=N1 4H56-1-FB [0,0,0,0,0,0|2,0,0]=2 20 B10R1.17 OCCNC1=CC=CC=N1 4H56-5-20 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.17 OCCNC1=CC=NC=C1 4H56-1-DX [0,0,0,0,0,0|2,0,0]=2 22 B10R1.17 OCCOC1=CC=CC=C1 2607-1-06 [0,0,0,0,0,0|1,0,0]=1 23 B10R1.17 S=C=NCC1=CC=CC=C1 7768-1-X2 [0,0,0,0,0,0|1,1,1]=3 24 B10R1.17 S=C=NCC1=CC=CN=C1 7H68-9-01 [0,0,0,0,0,0|2,1,1]=4 25 B9R1.8 BrCCC1=CC=CC=C1 1700-9-47 [1,0,0,0,0,0|1,0,0]=2 26 B9R1.8 Br\C=C\C1=CC=CC=C1 1900-9-23 [1,0,0,0,0,0|1,0,2]=4 27 B9R1.8 CCCC1=CC=NC=C1 3H32-1-Z1 [1,0,0,0,0,0|1,0,0]=2 28 B9R1.8 CNCC1=CC=CC=C1 3631-1-X0 [1,0,0,0,0,0|1,0,0]=2 29 B9R1.8 CNCC1=CC=CC=N1 3H31-1-8T [1,0,0,0,0,0|2,0,0]=3 30 B9R1.8 CNCC1=CC=CN=C1 3H31-1-P0 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 CNCC1=CC=NC=C1 3H31-1-U2 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.8 COCC1=CC=CC=N1 4H07-1-Y1 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.8 C\C=C\C1=CC=CC=C1 1900-1-02 [1,0,0,0,0,0|0,0,2]=3 34 B9R1.8 C\C=C\C1=CC=CC=C1 1900-1-04 [1,0,0,0,0,0|0,0,2]=3 35 B9R1.8 ClCCC1=CC=CC=N1 3H32-5-CX [1,0,0,0,0,0|2,0,0]=3 36 B9R1.8 N#CCC1=CC=CC=C1 3737-1-01 [1,0,0,0,0,0|1,0,1]=3 37 B9R1.8 N#CCC1=CC=CC=N1 3H37-1-M2 [1,0,0,0,0,0|2,0,1]=4 38 B9R1.8 N#CCC1=CC=NC=C1 3H37-5-2C [1,0,0,0,0,0|2,0,1]=4 39 B9R1.8 N#CC[N+]1=CC=CC=C1 3H37-5-1K [1,0,0,0,0,0|2,0,1]=4 40 B9R1.8 N#COC1=CC=CC=C1 4637-1-34 [1,0,0,0,0,0|2,0,1]=4 41 B9R1.8 NCCC1=CC=CC=C1 3630-1-17 [1,0,0,0,0,0|1,0,0]=2 42 B9R1.8 NCCC1=CC=CN=C1 3H30-1-QN [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 NCCC1=CC=NC=C1 3H30-1-V2 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.8 NNCC1=CC=NC=C1 3H39-5-X0 [1,0,0,0,0,0|3,0,0]=4 45 B9R1.8 NOCC1=CC=CC=C1 4647-5-01 [1,0,0,0,0,0|2,0,0]=3 46 B9R1.8 O=CNC1=CC=CC=C1 4648-1-2A [1,0,0,0,0,0|1,0,2]=4 47 B9R1.8 OCCC1=CC=CC=C1 2601-1-0U [1,0,0,0,0,0|0,0,0]=1 48 B9R1.8 OCCC1=CC=NC=C1 4H01-1-Z0 [1,0,0,0,0,0|1,0,0]=2 49 B9R1.8 ONCC1=CC=CC=C1 4647-5-23 [1,0,0,0,0,0|1,0,0]=2 50 B9R1.8 O\N=C\C1=CC=CC=C1 4647-1-X3 [1,0,0,0,0,0|1,0,1]=3 51 B9R1.8 O\N=C\C1=NC=CC=C1 G311-A-35 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.8 S=C=NC1=CC=CC=C1 7668-1-X1 [1,0,0,0,0,0|1,1,1]=4 53 B9R1.8 SCCC1=CC=CC=C1 5661-1-05 [1,0,0,0,0,0|0,1,0]=2 54 B11R1.1 BrCC#CC1=CC=C(Br)C=C1 1900-9-0F [0,1,0,0,0,0|1,0,2]=4 55 B11R1.1 C=CCCC1=CC=C(F)C=C1 1900-3-44 [0,1,0,0,0,0|1,0,1]=3 56 B11R1.1 CC1=CC=C(CN=C=S)C=C1 7768-1-24 [0,1,0,0,0,0|1,1,1]=4 57 B11R1.1 CC1=CC=C(OCC#N)C=C1 4737-1-02 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.1 CCCCC1=CC=C(Br)C=C1 1700-9-W8 [0,1,0,0,0,0|1,0,0]=2 59 B11R1.1 FC1=CC=C(CN=C=S)C=C1 7668-3-14 [0,1,0,0,0,0|1,1,1]=4 60 B11R1.1 FC1=CC=C(OCCBr)C=C1 2607-B-X0 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.1 N#CCCC1=CC=C(Br)C=C1 3637-9-X9 [0,1,0,0,0,0|1,0,1]=3 62 B11R1.1 N#CCCC1=CC=C(Cl)C=C1 3737-5-06 [0,1,0,0,0,0|1,0,1]=3 63 B11R1.1 N#CCCC1=CC=C(O)C=C1 4637-1-X2 [0,1,0,0,0,0|1,0,1]=3 64 B11R1.1 N#CCOC1=CC=C(Cl)C=C1 4637-5-X4 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.1 N#CCSC1=CC=C(Cl)C=C1 7666-5-X3 [0,1,0,0,0,0|2,0,1]=4 66 B11R1.1 N#CSCC1=CC=C(Br)C=C1 7668-9-03 [0,1,0,0,0,0|2,0,1]=4 67 B11R1.1 N#CSCC1=CC=C(Cl)C=C1 7768-5-06 [0,1,0,0,0,0|2,0,1]=4 68 B11R1.1 N#CSCC1=CC=C(F)C=C1 7768-3-03 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.1 NCCOC1=CC=C(Cl)C=C1 4630-5-09 [0,1,0,0,0,0|2,0,0]=3 70 B11R1.1 OCC#CC1=CC=C(Br)C=C1 2601-9-0G [0,1,0,0,0,0|0,0,2]=3 71 B11R1.1 OCC#CC1=CC=C(F)C=C1 2901-3-X1 [0,1,0,0,0,0|0,0,2]=3 72 B11R1.1 OCCCC1=CC=C(Br)C=C1 2601-9-11 [0,1,0,0,0,0|0,0,0]=1 73 B11R1.1 OCCCC1=CC=C(Cl)C=C1 2701-5-X5 [0,1,0,0,0,0|0,0,0]=1 74 B11R1.1 OCCSC1=CC=C(Cl)C=C1 6666-5-X4 [0,1,0,0,0,0|1,0,0]=2 75 B11R1.1 S=C=NCC1=CC=C(Cl)C=C1 7768-5-01 [0,1,0,0,0,0|1,1,1]=4 76 B11R1.16 CC(N=C=S)C1=CC=CC=C1 7768-1-26 [0,1,0,0,0,0|1,1,1]=4 77 B11R1.16 CN(CCO)C1=CC=CC=C1 4632-1-0D [0,1,0,0,0,0|1,0,0]=2 78 B11R1.16 CN(CCO)C1=CC=CC=N1 4H32-1-13 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.16 C[C@@H](N=C=S)C1=CC=CC=C1 7768-1-25 [0,1,0,0,0,0|1,1,1]=4 80 B11R1.16 C[C@H](N=C=O)C1=CC=CC=C1 4649-1-05 [0,1,0,0,0,0|1,0,2]=4 81 B11R1.16 C[C@H](N=C=S)C1=CC=CC=C1 7768-1-27 [0,1,0,0,0,0|1,1,1]=4 82 B11R1.16 N#CCC(=O)C1=CC=CC=C1 4637-1-W9 [0,1,0,0,0,0|1,0,2]=4 83 B11R1.16 N#CCC(O)C1=CC=CC=C1 4637-1-X0 [0,1,0,0,0,0|1,0,1]=3 84 B11R1.16 O=C(CCCl)C1=CC=CC=C1 2617-5-X6 [0,1,0,0,0,0|1,0,1]=3 85 B11R1.16 O=C(CCCl)C1=CC=CC=C1 2617-5-Y0 [0,1,0,0,0,0|1,0,1]=3 86 B11R1.16 O=C(OCCl)C1=CC=CC=C1 2623-5-02 [0,1,0,0,0,0|2,0,1]=4 87 B11R1.16 O=C(\C=N\O)C1=CC=CC=C1 4647-1-X5 [0,1,0,0,0,0|1,0,2]=4 88 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 2602-5-04 [0,1,0,0,0,0|1,0,0]=2 89 B11R1.17 BrCC#CC1=C(Br)C=CC=C1 1900-9-0H [0,1,0,0,0,0|1,0,2]=4 90 B11R1.17 C#CCOC1=C(Br)C=CC=C1 2607-9-0W [0,1,0,0,0,0|2,0,1]=4 91 B11R1.17 CC1=CC=CC=C1CN=C=S 7768-1-22 [0,1,0,0,0,0|1,1,1]=4 92 B11R1.17 FC1=C(C#CCBr)C=CC=C1 1900-B-0N [0,1,0,0,0,0|1,0,2]=4 93 B11R1.17 FC1=C(CN=C=S)C=CC=C1 7668-3-X3 [0,1,0,0,0,0|1,1,1]=4 94 B11R1.17 N#CCCC1=CC=CC=C1Cl 3737-5-05 [0,1,0,0,0,0|1,0,1]=3 95 B11R1.17 N#CCOC1=CC=CC=C1Br 4647-9-09 [0,1,0,0,0,0|2,0,1]=4 96 B11R1.17 N#CCOC1=CC=CC=C1Cl 4637-5-Y2 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.17 N#CSCC1=CC=CC=C1Br 7668-9-01 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.17 N#CSCC1=CC=CC=C1Cl 7768-5-04 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.17 N#CSCC1=CC=CC=C1F 7768-3-01 [0,1,0,0,0,0|2,0,1]=4 100 B11R1.17 NCCOC1=CC=CC=C1Cl 2630-5-01 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.17 OCC#CC1=CC=CC=C1Br 2601-9-0F [0,1,0,0,0,0|0,0,2]=3 102 B11R1.17 OCC#CC1=CC=CC=C1F 2601-3-0G [0,1,0,0,0,0|0,0,2]=3 103 B11R1.17 OCCNC1=NC=CN=C1Cl 4H56-5-J0 [0,1,0,0,0,0|3,0,0]=4 104 B11R1.17 S=C=NCC1=CC=CC=C1Cl 7768-5-02 [0,1,0,0,0,0|1,1,1]=4 105 B11R1.24 BrCC#CC1=CC(Br)=CC=C1 1900-9-0G [0,1,0,0,0,0|1,0,2]=4 106 B11R1.24 C#CCOC1=CC=CC(Br)=C1 2607-9-0V [0,1,0,0,0,0|2,0,1]=4 107 B11R1.24 C=CCCC1=CC=CC(Cl)=C1 1900-5-X4 [0,1,0,0,0,0|1,0,1]=3 108 B11R1.24 CC1=CC(OCC#N)=CC=C1 4737-1-0G [0,1,0,0,0,0|2,0,1]=4 109 B11R1.24 CC1=CC=CC(CCCO)=N1 4H56-1-893 [0,1,0,0,0,0|1,0,0]=2 110 B11R1.24 CC1=CC=CC(CN=C=S)=C1 7768-1-23 [0,1,0,0,0,0|1,1,1]=4 111 B11R1.24 CCCNC1=CC=CC(Br)=N1 3H33-D-0A [0,1,0,0,0,0|3,0,0]=4 112 B11R1.24 FC1=CC=CC(C#CCBr)=C1 1900-B-0M [0,1,0,0,0,0|1,0,2]=4 113 B11R1.24 FC1=CC=CC(CN=C=S)=C1 7668-3-13 [0,1,0,0,0,0|1,1,1]=4 114 B11R1.24 N#CCCC1=CC(Br)=CC=C1 3637-9-Y0 [0,1,0,0,0,0|1,0,1]=3 115 B11R1.24 N#CCOC1=CC=CC(Br)=C1 4647-9-08 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.24 N#CCOC1=CC=CC(F)=C1 4637-3-5K [0,1,0,0,0,0|2,0,1]=4 117 B11R1.24 N#CSCC1=CC(Br)=CC=C1 7668-9-02 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.24 N#CSCC1=CC(Cl)=CC=C1 7768-5-05 [0,1,0,0,0,0|2,0,1]=4 119 B11R1.24 N#CSCC1=CC(F)=CC=C1 7768-3-02 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.24 NCCOC1=CC=CC(Cl)=C1 4630-5-X1 [0,1,0,0,0,0|2,0,0]=3 121 B11R1.24 OCC#CC1=CC(Cl)=CC=C1 2901-5-X0 [0,1,0,0,0,0|0,0,2]=3 122 B11R1.24 OCC#CC1=CC=CC(F)=C1 2901-3-X0 [0,1,0,0,0,0|0,0,2]=3 123 B11R1.24 S=C=NCC1=CC(Cl)=CC=C1 7768-5-03 [0,1,0,0,0,0|1,1,1]=4 124 B11R1.28 BrCCCCC1=CC=CC=C1 1700-9-Z4 [0,1,0,0,0,0|1,0,0]=2 125 B11R1.28 C#CCCCC1=CC=CC=C1 1900-1-Y0 [0,1,0,0,0,0|1,0,0]=2 126 B11R1.28 CCCCNC1=CC=CC=C1 3631-1-X4 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.28 ClCCNCC1=CC=CC=C1 3731-5-X5 [0,1,0,0,0,0|1,0,0]=2 128 B11R1.28 NCCOCC1=CC=CC=C1 4756-5-X8 [0,1,0,0,0,0|1,0,0]=2 129 B11R1.28 NCCSSC1=CC=CC=N1 7H66-5-1D [0,1,0,0,0,0|3,0,0]=4 130 B11R1.28 O=C=NCCC1=CC=CC=C1 4649-1-X7 [0,1,0,0,0,0|0,0,2]=3 131 B11R1.28 OCCCCC1=CC=CC=C1 2701-1-00 [0,1,0,0,0,0|0,0,0]=1 132 B11R1.28 OCCNCC1=CC=CC=C1 4656-1-71 [0,1,0,0,0,0|0,0,0]=1 133 B11R1.28 O\N=C\C=C\C1=CC=CC=C1 4947-1-X0 [0,1,0,0,0,0|0,0,3]=4 134 B11R1.28 S=C=NCCC1=CC=CC=C1 7768-1-37 [0,1,0,0,0,0|0,1,1]=3 135 B11R1.40 CC(CN)OC1=CC=CC=C1 4630-5-05 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.40 CNC(=O)CC1=CC=CC=C1 4748-1-18 [0,1,0,0,0,0|2,0,1]=4 137 B11R1.40 N=C(CC1=CC=CC=C1)NO 4647-1-20 [0,1,0,0,0,0|1,0,1]=3 138 B11R1.40 NNC(=O)CC1=CC=CC=C1 4648-1-76 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 4756-1-53 [0,1,0,0,0,0|0,0,0]=1 140 B11R1.40 O=C(CCl)NC1=CC=CC=C1 4648-5-Y6 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.91 CC(=O)COC1=CC=CC=C1 2617-1-0W [0,1,0,0,0,0|1,0,2]=4 142 B11R1.91 CC(N)CCC1=CC=CC=C1 3630-1-X9 [0,1,0,0,0,0|1,0,0]=2 143 B11R1.91 CC(O)CCC1=CC=CC=C1 2602-1-09 [0,1,0,0,0,0|0,0,0]=1 144 B11R1.91 CN(C)CCC1=CC=CC=N1 3H32-1-N6 [0,1,0,0,0,0|3,0,0]=4 145 B11R1.91 FC(F)COC1=CC=CC=C1 2607-3-36 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.91 FC(F)SCC1=CC=CC=C1 5666-3-07 [0,1,0,0,0,0|2,0,0]=3 147 B11R1.91 N=C(N)COC1=CC=CC=C1 4641-5-X3 [0,1,0,0,0,0|2,0,1]=4 148 B11R1.91 N=C(N)CSC1=CC=CC=C1 7666-5-X5 [0,1,0,0,0,0|2,0,1]=4 149 B11R1.91 NC(=O)COC1=CC=CC=C1 4648-1-17 [0,1,0,0,0,0|1,0,2]=4 150 B11R1.91 NC(=O)OCC1=CC=CC=C1 4756-1-47 [0,1,0,0,0,0|1,0,2]=4 151 B11R1.91 NC(=S)NCC1=CC=CC=C1 7767-1-06 [0,1,0,0,0,0|1,1,1]=4 152 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 2616-5-13 [0,1,0,0,0,0|0,0,2]=3 153 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 2716-5-X4 [0,1,0,0,0,0|1,0,2]=4 154 B11R1.91 O=C(O)CCC1=CC=CC=C1 2721-1-01 [0,1,0,0,0,0|0,0,1]=2 155 B11R1.91 O=C(O)CCC1=CC=CN=C1 4H21-1-XY [0,1,0,0,0,0|1,0,1]=3 156 B11R1.91 O=C(O)CCC1=CC=NC=C1 P612-A-35 [0,1,0,0,0,0|1,0,1]=3 157 B11R1.91 O=C(O)COC1=CC=CC=C1 2621-1-02 [0,1,0,0,0,0|1,0,1]=3 158 B11R1.91 O=C(O)CSC1=CC=NC=C1 8H66-1-W7 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.91 OB(O)CCC1=CC=CC=C1 6760-1-W3 [0,1,0,0,0,0|1,0,0]=2 160 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 6960-1-X3 [0,1,0,0,0,0|1,0,2]=4 161 B11R2.1 NC1CCC2=CC=CC=C21 3630-5-X0 [0,0,0,1,0,0|1,0,0]=2 162 B11R2.1 NC1CCC2=CC=CC=C21 3730-1-47 [0,0,0,1,0,0|1,0,0]=2 163 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 3730-5-Z1 [0,0,0,1,0,0|1,0,0]=2 164 B11R2.1 O=C1CCC2=C1C=CC=C2 2717-1-01 [0,0,0,1,0,0|0,0,2]=3 165 B11R2.1 O=C1COC2=CC=CC=C12 2H17-1-X3 [0,0,0,1,0,0|1,0,2]=4 166 B11R2.1 O=C1NCC2=CC=CC=C12 4H48-1-13 [0,0,0,1,0,0|1,0,2]=4 167 B11R2.1 OB1OCC2=CC=CC=C12 6H60-1-V8 [0,0,0,1,0,0|2,0,0]=3 168 B11R2.1 OC1=NNC2=CC=CC=C21 4H56-1-3A [0,0,0,1,0,0|2,0,1]=4 169 B11R2.1 OC1=NOC2=CC=CC=C21 4H01-1-Y0 [0,0,0,1,0,0|2,0,1]=4 170 B11R2.1 OC1CCC2=CC=CC=C21 2701-1-05 [0,0,0,1,0,0|0,0,0]=1 171 B11R2.20 C1=CC2=C(C=C1)NCCN2 G311-A-32 [0,0,0,1,0,0|2,0,0]=3 172 B11R2.20 C1=CC2=C(C=C1)OCCN2 P311-A-27 [0,0,0,1,0,0|1,0,0]=2 173 B11R2.20 C1=CC=C2CNCCC2=C1 3H31-1-X4 [0,0,0,1,0,0|2,0,0]=3 174 B11R2.20 C1=CC=C2COCCC2=C1 2H10-1-X8 [0,0,0,1,0,0|2,0,0]=3 175 B11R2.20 C1=CC=C2NCCCC2=C1 3H31-1-P9 [0,0,0,1,0,0|1,0,0]=2 176 B11R2.20 C1=CC=C2OCCOC2=C1 2H10-1-X0 [0,0,0,1,0,0|1,0,0]=2 177 B11R2.238 C1=CC=C(SC2CC2)C=C1 5666-1-X1 [0,0,0,1,0,0|2,0,0]=3 178 B9R1.12 CCCCC1=CC=CO1 2H10-1-X2 [0,0,0,0,1,0|2,0,0]=3 179 B9R1.12 CCCCN1C=CN=C1 3H32-1-CJ [0,0,0,0,1,0|3,0,0]=4 180 B9R1.12 OCCCN1C=CN=C1 4H01-1-46 [0,0,0,0,1,0|2,0,0]=3 181 B9R1.12 OCCCN1C=NN=C1 4H01-1-U4 [0,0,0,0,1,0|3,0,0]=4 182 B8R1.2 BrCC1=CC=CC=C1 1700-9-29 [2,0,0,0,0,0|1,0,0]=3 183 B8R1.2 BrCC1=CC=CC=N1 3H32-9-5R [2,0,0,0,0,0|2,0,0]=4 184 B8R1.2 BrCC1=CC=CN=C1 3H32-9-3V [2,0,0,0,0,0|2,0,0]=4 185 B8R1.2 C#CC1=CC=CC=C1 1900-1-Y3 [2,0,0,0,0,0|0,0,2]=4 186 B8R1.2 CCC1=CC=CC=C1 1700-1-16 [2,0,0,0,0,0|0,0,0]=2 187 B8R1.2 CNC1=CC=CC=C1 3631-1-0S [2,0,0,0,0,0|1,0,0]=3 188 B8R1.2 COC1=CC=CC=N1 4H07-1-X8 [2,0,0,0,0,0|2,0,0]=4 189 B8R1.2 COC1=CC=CN=C1 4H07-1-Z0 [2,0,0,0,0,0|2,0,0]=4 190 B8R1.2 COC1=CC=NC=C1 4H56-1-K1 [2,0,0,0,0,0|2,0,0]=4 191 B8R1.2 CSC1=CC=CC=C1 5666-1-02 [2,0,0,0,0,0|1,0,0]=3 192 B8R1.2 ClCC1=CC=CC=N1 3H32-5-P8 [2,0,0,0,0,0|2,0,0]=4 193 B8R1.2 ClCC1=CC=CN=C1 3H32-5-P9 [2,0,0,0,0,0|2,0,0]=4 194 B8R1.2 ClCC1=CC=NC=C1 3H32-5-G4 [2,0,0,0,0,0|2,0,0]=4 195 B8R1.2 N#CC1=CC=CC=C1 3637-1-05 [2,0,0,0,0,0|1,0,1]=4 196 B8R1.2 N#CC1=CC=CC=C1 3637-5-08 [2,0,0,0,0,0|1,0,1]=4 197 B8R1.2 NCC1=CC=CC=C1 3630-1-10 [2,0,0,0,0,0|1,0,0]=3 198 B8R1.2 NCC1=CC=CC=N1 3H30-1-T0 [2,0,0,0,0,0|2,0,0]=4 199 B8R1.2 NCC1=CC=NC=C1 3H30-1-P1 [2,0,0,0,0,0|2,0,0]=4 200 B8R1.2 O=NC1=CC=CC=C1 4645-1-01 [2,0,0,0,0,0|1,0,1]=4 201 B8R1.2 OCC1=CC=CC=C1 2601-1-02 [2,0,0,0,0,0|0,0,0]=2 202 B8R1.2 OCC1=CC=CN=C1 4H01-1-Y5 [2,0,0,0,0,0|1,0,0]=3 203 B8R1.2 OCC1=CN=CN=C1 4H01-1-Q7 [2,0,0,0,0,0|2,0,0]=4 204 B8R1.2 OCC1=NC=CC=N1 4H01-1-5H [2,0,0,0,0,0|2,0,0]=4 205 B8R1.2 OCC1=NC=CN=C1 4H01-1-Q6 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.1 CC1=CC=C(CCN)C=C1 3730-1-31 [1,1,0,0,0,0|1,0,0]=3 207 B10R1.1 CCCC1=CC=C(Br)C=C1 1700-9-Z0 [1,1,0,0,0,0|0,0,0]=2 208 B10R1.1 CCCC1=CC=C(Cl)C=C1 1700-5-58 [1,1,0,0,0,0|0,0,0]=2 209 B10R1.1 CCCC1=CN=C(Cl)N=C1 3H32-5-U0 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.1 CCOC1=CC=C(Br)C=N1 4H07-9-X6 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.1 CCOC1=CC=C(Br)N=C1 4H07-9-X7 [1,1,0,0,0,0|2,0,0]=4 212 B10R1.1 CCOC1=CC=C(F)C=C1 2607-3-44 [1,1,0,0,0,0|1,0,0]=3 213 B10R1.1 CCOC1=CC=C(I)C=C1 2607-H-X0 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.1 CCOC1=CC=C(N)C=N1 4H56-1-598 [1,1,0,0,0,0|2,0,0]=4 215 B10R1.1 CCOC1=CC=C(O)C=C1 2607-1-23 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.1 CNCC1=CC=C(C)C=C1 3H31-1-Q7 [1,1,0,0,0,0|1,0,0]=3 217 B10R1.1 CNCC1=CC=C(Cl)C=C1 3731-5-X1 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.1 CNCC1=CC=C(N)C=C1 3731-1-X2 [1,1,0,0,0,0|1,0,0]=3 219 B10R1.1 FC1=CC=C(CCBr)C=C1 1700-B-41 [1,1,0,0,0,0|1,0,0]=3 220 B10R1.1 FC1=CC=C(CCCl)C=C1 1700-7-06 [1,1,0,0,0,0|1,0,0]=3 221 B10R1.1 N#CCC1=CC=C(Br)C=C1 3637-9-Y9 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.1 N#CCC1=CC=C(Cl)C=C1 3637-5-X0 [1,1,0,0,0,0|1,0,1]=4 223 B10R1.1 N#CCC1=CC=C(F)C=C1 3737-3-04 [1,1,0,0,0,0|1,0,1]=4 224 B10R1.1 N#CCC1=CC=C(I)C=C1 3637-H-X0 [1,1,0,0,0,0|1,0,1]=4 225 B10R1.1 N#CCC1=CC=C(N)C=C1 3637-1-Y1 [1,1,0,0,0,0|1,0,1]=4 226 B10R1.1 N#CCC1=CC=C(O)C=C1 4637-1-T9 [1,1,0,0,0,0|1,0,1]=4 227 B10R1.1 NC1=CC=C(CCO)C=C1 4756-1-Y3 [1,1,0,0,0,0|0,0,0]=2 228 B10R1.1 NCCC1=CC=C(Br)C=C1 3730-9-02 [1,1,0,0,0,0|1,0,0]=3 229 B10R1.1 NCCC1=CC=C(Br)C=C1 3730-9-04 [1,1,0,0,0,0|1,0,0]=3 230 B10R1.1 NCCC1=CC=C(F)C=C1 3630-3-X1 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.1 NCCC1=CC=C(N)C=C1 3730-1-15 [1,1,0,0,0,0|1,0,0]=3 232 B10R1.1 NNCC1=CC=C(Br)C=C1 3639-9-01 [1,1,0,0,0,0|2,0,0]=4 233 B10R1.1 NNCC1=CC=C(Br)C=C1 3639-D-00 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.1 NOCC1=CC=C(F)C=C1 4647-7-15 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.1 OC1=CC=C(CCBr)C=C1 2701-9-11 [1,1,0,0,0,0|1,0,0]=3 236 B10R1.1 OCCC1=CC=C(Br)C=C1 2701-9-Y1 [1,1,0,0,0,0|0,0,0]=2 237 B10R1.1 OCCC1=CC=C(Cl)C=C1 2701-5-X6 [1,1,0,0,0,0|0,0,0]=2 238 B10R1.1 OCCC1=CC=C(F)C=C1 2601-3-84 [1,1,0,0,0,0|0,0,0]=2 239 B10R1.1 OCCC1=CC=C(O)C=C1 2704-1-X4 [1,1,0,0,0,0|0,0,0]=2 240 B10R1.1 O\N=C\C1=CC=C(Br)C=C1 4647-9-03 [1,1,0,0,0,0|1,0,1]=4 241 B10R1.1 O\N=C\C1=CC=C(Cl)C=C1 4647-5-X6 [1,1,0,0,0,0|1,0,1]=4 242 B10R1.4 BrCCC1=CC=CC=C1Br 1700-9-57 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.4 CC1=CC=CC=C1CCN 3730-1-29 [1,1,0,0,0,0|1,0,0]=3 244 B10R1.4 CC1=CC=CC=C1CCO 2701-1-0E [1,1,0,0,0,0|0,0,0]=2 245 B10R1.4 CCCC1=NC=NC=C1Br 3H32-9-Z9 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.4 CCNC1=C(F)C=CC=C1 3631-3-X2 [1,1,0,0,0,0|1,0,0]=3 247 B10R1.4 CCOC1=C(F)C=CC=C1 2607-3-42 [1,1,0,0,0,0|1,0,0]=3 248 B10R1.4 CCOC1=CC=CC=C1Br 2607-9-Y1 [1,1,0,0,0,0|1,0,0]=3 249 B10R1.4 CCOC1=CC=CC=C1O 2607-1-1H [1,1,0,0,0,0|1,0,0]=3 250 B10R1.4 CNCC1=C(F)C=CC=C1 3631-3-62 [1,1,0,0,0,0|1,0,0]=3 251 B10R1.4 COCC1=CC=CC=C1Br 2707-9-X3 [1,1,0,0,0,0|1,0,0]=3 252 B10R1.4 N#CCC1=C(F)C=CC=C1 3737-3-02 [1,1,0,0,0,0|1,0,1]=4 253 B10R1.4 N#CCC1=CC=CC=C1Br 3637-9-Z1 [1,1,0,0,0,0|1,0,1]=4 254 B10R1.4 N#CCC1=CC=CC=C1Cl 3637-5-X9 [1,1,0,0,0,0|1,0,1]=4 255 B10R1.4 N#CCC1=CC=CC=C1F 3637-3-28 [1,1,0,0,0,0|1,0,1]=4 256 B10R1.4 NCCC1=CC=CC=C1Cl 3730-5-07 [1,1,0,0,0,0|1,0,0]=3 257 B10R1.4 NCCC1=CC=CC=C1F 3630-3-65 [1,1,0,0,0,0|1,0,0]=3 258 B10R1.4 NNCC1=CC=CC=C1F 3639-7-05 [1,1,0,0,0,0|2,0,0]=4 259 B10R1.4 NNCC1=CC=CC=C1F 3639-7-13 [1,1,0,0,0,0|2,0,0]=4 260 B10R1.4 NNCC1=CC=CC=C1F 3739-3-01 [1,1,0,0,0,0|2,0,0]=4 261 B10R1.4 NOCC1=CC=CC=C1Cl 4747-5-X1 [1,1,0,0,0,0|2,0,0]=4 262 B10R1.4 OCCC1=C(Br)C=CC=C1 2701-9-01 [1,1,0,0,0,0|0,0,0]=2 263 B10R1.4 O\N=C\C1=CC=CC=C1Br 4647-9-01 [1,1,0,0,0,0|1,0,1]=4 264 B10R1.4 O\N=C\C1=CC=CC=C1F 4647-3-24 [1,1,0,0,0,0|1,0,1]=4 265 B10R1.10 C=CCC1=CC(Br)=CC=C1 1900-9-X1 [1,1,0,0,0,0|0,0,2]=4 266 B10R1.10 CC1=CC=CC(CCN)=C1 3730-1-30 [1,1,0,0,0,0|1,0,0]=3 267 B10R1.10 CCOC1=CC(F)=CC=C1 2607-3-32 [1,1,0,0,0,0|1,0,0]=3 268 B10R1.10 CCOC1=CC(F)=NC=C1 4H07-3-0S [1,1,0,0,0,0|2,0,0]=4 269 B10R1.10 CCOC1=CC=CC(Br)=C1 2607-9-30 [1,1,0,0,0,0|1,0,0]=3 270 B10R1.10 CCOC1=CC=CC(Br)=N1 4H07-9-X8 [1,1,0,0,0,0|2,0,0]=4 271 B10R1.10 CCOC1=CN=CC(N)=C1 4H30-1-0B [1,1,0,0,0,0|2,0,0]=4 272 B10R1.10 CNCC1=CC(F)=CC=C1 3631-3-63 [1,1,0,0,0,0|1,0,0]=3 273 B10R1.10 CNCC1=CC=CC(Br)=C1 3731-9-02 [1,1,0,0,0,0|1,0,0]=3 274 B10R1.10 CNCC1=CC=CC(Cl)=C1 3631-5-0D [1,1,0,0,0,0|1,0,0]=3 275 B10R1.10 ClC1=CC(CCBr)=CC=C1 1700-D-0F [1,1,0,0,0,0|1,0,0]=3 276 B10R1.10 FC1=CC=CC(CCBr)=C1 1700-B-31 [1,1,0,0,0,0|1,0,0]=3 277 B10R1.10 N#CCC1=CC(F)=CC=C1 3737-3-03 [1,1,0,0,0,0|1,0,1]=4 278 B10R1.10 N#CCC1=CC(I)=CC=C1 3737-H-04 [1,1,0,0,0,0|1,0,1]=4 279 B10R1.10 NCCC1=CC=CC(Cl)=C1 3730-5-08 [1,1,0,0,0,0|1,0,0]=3 280 B10R1.10 NCCC1=CC=CC(O)=C1 4756-5-12 [1,1,0,0,0,0|1,0,0]=3 281 B10R1.10 NNCC1=CC(F)=CC=C1 3739-7-02 [1,1,0,0,0,0|2,0,0]=4 282 B10R1.10 OCCC1=CC=CC(Br)=C1 2701-9-00 [1,1,0,0,0,0|0,0,0]=2 283 B10R1.10 OCCC1=CC=CC(F)=C1 2601-3-Y1 [1,1,0,0,0,0|0,0,0]=2 284 B10R1.10 OCCC1=CC=CC(O)=C1 2604-1-0D [1,1,0,0,0,0|0,0,0]=2 285 B10R1.15 CC(CN)C1=CC=CC=C1 3730-1-Z4 [1,1,0,0,0,0|1,0,0]=3 286 B10R1.15 COC(=N)C1=CC=CC=C1 4636-5-01 [1,1,0,0,0,0|1,0,1]=4 287 B10R1.15 C[C@H](NO)C1=CC=CC=C1 4647-1-S0 [1,1,0,0,0,0|1,0,0]=3 288 B10R1.15 C\C=C(/F)C1=CC=CC=C1 1900-3-27 [1,1,0,0,0,0|0,0,2]=4 289 B10R1.15 NCC(O)C1=CC=CC=C1 4656-1-T1 [1,1,0,0,0,0|1,0,0]=3 290 B10R1.15 NCC(O)C1=CC=CN=C1 4H56-5-Q3 [1,1,0,0,0,0|2,0,0]=4 291 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 4656-1-R1 [1,1,0,0,0,0|1,0,0]=3 292 B10R1.15 NC[C@H](O)C1=CC=CC=C1 4656-1-S1 [1,1,0,0,0,0|1,0,0]=3 293 B10R1.15 N[C@H](CO)C1=CC=CC=C1 4656-1-S3 [1,1,0,0,0,0|0,0,0]=2 294 B10R1.15 N\C(=N/O)C1=CC=CC=C1 4647-1-X4 [1,1,0,0,0,0|1,0,1]=4 295 B10R1.15 O=C(CBr)C1=CC=CC=C1 2617-9-X7 [1,1,0,0,0,0|1,0,1]=4 296 B10R1.15 O=C(CF)C1=CC=CC=C1 2617-3-31 [1,1,0,0,0,0|1,0,1]=4 297 B10R1.15 O=C(NO)C1=CC=CC=C1 4656-1-9B [1,1,0,0,0,0|1,0,1]=4 298 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 2604-1-S1 [1,1,0,0,0,0|0,0,0]=2 299 B10R1.15 O[C@H](CCl)C1=CC=CC=C1 2602-5-S1 [1,1,0,0,0,0|1,0,0]=3 300 B10R1.15 O\N=C(\Cl)C1=CC=CC=C1 4647-5-24 [1,1,0,0,0,0|1,0,1]=4 301 B10R1.15 [C@H](C)(CN)C1=CC=CC=C1 3730-1-Y2 [1,1,0,0,0,0|1,0,0]=3 302 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 4630-1-V2T [1,1,0,0,0,0|0,0,0]=2 303 B10R1.15 [C@H](N)(CO)C1=CC=CC=C1 4656-1-V2 [1,1,0,0,0,0|0,0,0]=2 304 B10R1.18 CC(=O)CC1=CC=NC=C1 4H17-1-61 [1,1,0,0,0,0|1,0,1]=4 305 B10R1.18 CC(=O)OC1=CC=CC=C1 2623-1-Y3 [1,1,0,0,0,0|1,0,1]=4 306 B10R1.18 CC(C)CC1=CC=CC=C1 1700-1-X0 [1,1,0,0,0,0|0,0,0]=2 307 B10R1.18 CC(C)OC1=CC=CC=C1 2607-1-10 [1,1,0,0,0,0|1,0,0]=3 308 B10R1.18 CC(C)SC1=CC=CC=C1 5666-1-X2 [1,1,0,0,0,0|1,0,0]=3 309 B10R1.18 CN(C)CC1=CC=CC=C1 3632-1-07 [1,1,0,0,0,0|1,0,0]=3 310 B10R1.18 FC(F)OC1=CC=CC=C1 2607-3-25 [1,1,0,0,0,0|2,0,0]=4 311 B10R1.18 NC(=O)CC1=CC=CC=C1 4748-1-X7 [1,1,0,0,0,0|0,0,2]=4 312 B10R1.18 NC(=S)CC1=CC=CC=C1 7667-1-41 [1,1,0,0,0,0|0,1,1]=4 313 B10R1.18 O=C(Cl)CC1=CC=CC=C1 2716-5-04 [1,1,0,0,0,0|0,0,2]=4 314 B10R1.18 O=C(O)CC1=CC=CC=N1 4H58-5-0B [1,1,0,0,0,0|1,0,1]=4 315 B10R1.18 O=C(O)CC1=CC=CN=C1 4H21-1-J9 [1,1,0,0,0,0|1,0,1]=4 316 B10R1.18 O=C(O)CC1=CC=CN=C1 4H21-5-Z8 [1,1,0,0,0,0|1,0,1]=4 317 B10R1.18 O=C(O)CC1=CC=NC=C1 4H58-5-4Y [1,1,0,0,0,0|1,0,1]=4 318 B10R1.18 O=S([O-])CC1=CC=CC=C1 6665-1-00 [1,1,0,0,0,0|1,0,1]=4 319 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 4654-1-9H [1,1,0,0,0,0|1,0,1]=4 320 B12R1.1 BrCCCOC1=CC=C(Br)C=C1 2607-9-25 [0,2,0,0,0,0|1,0,0]=3 321 B12R1.1 CC1=CC=C(CCN=C=S)C=C1 7768-1-31 [0,2,0,0,0,0|0,1,1]=4 322 B12R1.1 CCCCCC1=CC=C(Br)C=C1 1700-9-W7 [0,2,0,0,0,0|1,0,0]=3 323 B12R1.1 CCCCCC1=CC=C(Cl)C=C1 1700-5-57 [0,2,0,0,0,0|1,0,0]=3 324 B12R1.1 CCCCCC1=CC=C(F)C=C1 1700-3-45 [0,2,0,0,0,0|1,0,0]=3 325 B12R1.1 CCCCCC1=CC=C(I)C=C1 1700-H-04 [0,2,0,0,0,0|1,0,0]=3 326 B12R1.1 CCCCOC1=CC=C(N)C=C1 4630-1-08 [0,2,0,0,0,0|1,0,0]=3 327 B12R1.1 COCCOC1=CC=C(O)C=C1 2608-1-0V [0,2,0,0,0,0|1,0,0]=3 328 B12R1.1 N#CCCOC1=CC=C(Br)C=C1 4637-9-Z3 [0,2,0,0,0,0|1,0,1]=4 329 B12R1.1 N#CCCOC1=CC=C(Cl)C=C1 4637-5-Y7 [0,2,0,0,0,0|1,0,1]=4 330 B12R1.1 NCCSCC1=CC=C(F)C=C1 7666-3-02 [0,2,0,0,0,0|1,0,0]=3 331 B12R1.1 NCCSCC1=CC=C(F)C=C1 7666-7-01 [0,2,0,0,0,0|1,0,0]=3 332 B12R1.1 S=C=NCCC1=CC=C(Cl)C=C1 7768-5-12 [0,2,0,0,0,0|0,1,1]=4 333 B12R1.16 CC1=CC=C(C(=O)CCCl)C=C1 2717-5-00 [0,2,0,0,0,0|1,0,1]=4 334 B12R1.16 CCCC(=O)C1=CC=C(F)C=C1 2617-3-44 [0,2,0,0,0,0|1,0,1]=4 335 B12R1.16 CCCC(=O)C1=CC=C(N)C=C1 4656-1-27 [0,2,0,0,0,0|1,0,1]=4 336 B12R1.16 CCCC(=O)C1=CC=C(O)C=C1 2620-1-Y0 [0,2,0,0,0,0|1,0,1]=4 337 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 4656-3-BS [0,2,0,0,0,0|0,0,0]=2 338 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 2617-7-43 [0,2,0,0,0,0|1,0,1]=4 339 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 2620-1-X5 [0,2,0,0,0,0|0,0,2]=4 340 B12R1.21 CC1=CC=C(CCC(=O)O)C=C1 2721-1-42 [0,2,0,0,0,0|0,0,1]=3 341 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 6766-1-X1 [0,2,0,0,0,0|1,0,1]=4 342 B12R1.21 CN(C)CCC1=CC=C(N)C=C1 3632-1-0M [0,2,0,0,0,0|2,0,0]=4 343 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 4757-1-06 [0,2,0,0,0,0|0,0,1]=3 344 B12R1.21 O=C(O)CCC1=CC=C(Br)C=C1 2721-9-07 [0,2,0,0,0,0|0,0,1]=3 345 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 2721-5-06 [0,2,0,0,0,0|0,0,1]=3 346 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 2721-3-14 [0,2,0,0,0,0|0,0,1]=3 347 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 2721-H-X2 [0,2,0,0,0,0|0,0,1]=3 348 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 2729-1-X5 [0,2,0,0,0,0|0,0,1]=3 349 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 2621-5-0B [0,2,0,0,0,0|1,0,1]=4 350 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 2621-3-01 [0,2,0,0,0,0|1,0,1]=4 351 B12R1.49 CC(CBr)OC1=CC=C(F)C=C1 2607-B-3C [0,2,0,0,0,0|2,0,0]=4 352 B12R1.69 OCCOC1=CC=C(Cl)C=C1Cl 2607-5-05 [0,2,0,0,0,0|1,0,0]=3 353 B12R1.71 C#CC1=CC=C(CCCC)C=C1 1900-1-Y6 [0,2,0,0,0,0|1,0,0]=3 354 B12R1.71 CCCCC1=CC=C(C#N)C=C1 3737-1-Z0 [0,2,0,0,0,0|1,0,0]=3 355 B12R1.71 CCCCC1=CC=C(CN)C=C1 3730-1-17 [0,2,0,0,0,0|1,0,0]=3 356 B12R1.71 CCCOC1=CC=C(C#N)C=C1 4637-1-Q1 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.71 COC1=CC=C(CCC#N)C=C1 4737-1-27 [0,2,0,0,0,0|1,0,1]=4 358 B12R1.71 COC1=CC=C(CCCO)C=C1 2607-1-30 [0,2,0,0,0,0|0,0,0]=2 359 B12R1.71 COC1=CC=C(OCCN)C=C1 4656-1-77 [0,2,0,0,0,0|2,0,0]=4 360 B12R1.30 CCCCC(=O)C1=CC=CC=C1 2617-1-15 [0,2,0,0,0,0|1,0,0]=3 361 B12R1.39 O=S(=O)(CCCl)C1=CC=CC=C1 6663-5-Y2 [0,2,0,0,0,0|2,0,0]=4 362 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 2621-1-2X [0,2,0,0,0,0|0,0,1]=3 363 B12R1.107 CN(C)CC(N)C1=CC=CC=C1 3732-1-X7 [0,2,0,0,0,0|2,0,0]=4 364 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 4657-1-29 [0,2,0,0,0,0|0,0,1]=3 365 B12R1.308 O=C(CCCl)C1=C(F)C=CC=C1 2617-7-0B [0,2,0,0,0,0|1,0,1]=4 366 B12R1.121 CCCOC1=CC=CC=C1C#N 4637-1-12 [0,2,0,0,0,0|2,0,0]=4 367 B12R1.121 N#CC1=CC=CC=C1C#CCO 4637-1-N5 [0,2,0,0,0,0|0,0,2]=4 368 B12R1.125 CC1=CC=CC=C1CCC(=O)O 2721-1-41 [0,2,0,0,0,0|0,0,1]=3 369 B12R1.125 FC(F)COC1=C(Br)C=CC=C1 2607-B-01 [0,2,0,0,0,0|2,0,0]=4 370 B12R1.125 NC1=CC=CC=C1OCC(F)F 4656-3-6L [0,2,0,0,0,0|2,0,0]=4 371 B12R1.125 O=C(O)CCC1=CC=CC=C1Br 2721-9-05 [0,2,0,0,0,0|0,0,1]=3 372 B12R1.125 O=C(O)CCC1=CC=CC=C1Cl 2721-5-05 [0,2,0,0,0,0|0,0,1]=3 373 B12R1.125 O=C(O)CCC1=CC=CC=C1F 2721-3-12 [0,2,0,0,0,0|0,0,1]=3 374 B12R1.125 O=C(O)CCC1=CC=CC=C1O 2729-1-16 [0,2,0,0,0,0|0,0,1]=3 375 B12R1.125 O=C(O)COC1=CC=CC=C1Br 2621-9-0G [0,2,0,0,0,0|1,0,1]=4 376 B12R1.267 NCCSCC1=CC=CC=C1Cl 7766-1-X0 [0,2,0,0,0,0|1,0,0]=3 377 B12R1.374 CCCOC1=C(F)C=CC(C)=C1 2707-3-0F [0,2,0,0,0,0|2,0,0]=4 378 B12R1.28 CC1=CC=CC(CSCCN)=C1 7766-5-03 [0,2,0,0,0,0|1,0,0]=3 379 B12R1.28 NCCSCC1=CC=CC(Cl)=C1 7766-5-02 [0,2,0,0,0,0|1,0,0]=3 380 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 2721-1-03 [0,2,0,0,0,0|0,0,1]=3 381 B12R1.226 FC(F)COC1=CC(Br)=CC=C1 2607-B-03 [0,2,0,0,0,0|2,0,0]=4 382 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 4657-1-Z7 [0,2,0,0,0,0|0,0,1]=3 383 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 2721-3-13 [0,2,0,0,0,0|0,0,1]=3 384 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 2721-9-06 [0,2,0,0,0,0|0,0,1]=3 385 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 2721-5-Y0 [0,2,0,0,0,0|0,0,1]=3 386 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 2721-H-05 [0,2,0,0,0,0|0,0,1]=3 387 B12R1.226 O=C(O)CCC1=CC=CC(O)=C1 2729-1-17 [0,2,0,0,0,0|0,0,1]=3 388 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 2621-3-6R [0,2,0,0,0,0|1,0,1]=4 389 B12R1.382 CCCOC1=CC=CC(C=O)=C1 2615-1-0B [0,2,0,0,0,0|2,0,0]=4 390 B12R1.382 COC1=CC=CC(OCCBr)=C1 2608-9-X8 [0,2,0,0,0,0|2,0,0]=4 391 B12R1.8 BrCCCCCC1=CC=CC=C1 1700-9-09 [0,2,0,0,0,0|1,0,0]=3 392 B12R1.8 BrCCCOCC1=CC=CC=C1 2707-9-13 [0,2,0,0,0,0|1,0,0]=3 393 B12R1.8 C=CCCNCC1=CC=CC=C1 3931-1-X1 [0,2,0,0,0,0|1,0,0]=3 394 B12R1.8 CNCCCCC1=CC=CC=C1 3632-5-X2 [0,2,0,0,0,0|1,0,0]=3 395 B12R1.8 N#CCCNCC1=CC=CN=C1 3H37-1-V6 [0,2,0,0,0,0|2,0,0]=4 396 B12R1.8 S=C=NCCCC1=CC=CC=C1 7768-1-41 [0,2,0,0,0,0|0,1,0]=3 397 B12R1.27 CC(CO)NCC1=CC=CC=C1 4656-1-AA [0,2,0,0,0,0|0,0,0]=2 398 B12R1.27 COC(=O)CCC1=CC=CC=C1 2723-1-38 [0,2,0,0,0,0|0,0,1]=3 399 B12R1.27 COC(=O)COC1=CC=CC=C1 2623-1-37 [0,2,0,0,0,0|1,0,1]=4 400 B12R1.27 NCC(=O)OCC1=CC=CC=C1 4657-5-0Q [0,2,0,0,0,0|1,0,1]=4 401 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 4748-5-X3 [0,2,0,0,0,0|1,0,1]=4 402 B12R1.27 O=C(NO)OCC1=CC=CC=C1 4656-1-9J [0,2,0,0,0,0|1,0,1]=4 403 B12R1.32 CCOC(=O)CC1=CC=CC=C1 2723-1-01 [0,2,0,0,0,0|1,0,1]=4 404 B12R1.32 CN(CCN)CC1=CC=CC=C1 3732-1-03 [0,2,0,0,0,0|1,0,0]=3 405 B12R1.252 C[C@H](O)COCC1=CC=CC=C1 2607-1-S4 [0,2,0,0,0,0|0,0,0]=2 406 B12R1.252 NC(=S)NCCC1=CC=CC=C1 7767-1-31 [0,2,0,0,0,0|0,1,1]=4 407 B12R1.252 O=C(O)CCCC1=CC=CC=C1 2621-1-X9 [0,2,0,0,0,0|0,0,0]=2 408 B12R1.252 O=C(O)CCCC1=CC=NC=C1 4H21-5-13 [0,2,0,0,0,0|1,0,0]=3 409 B12R1.252 O=C(O)CCOC1=CC=CC=C1 2621-1-Z8 [0,2,0,0,0,0|0,0,1]=3 410 B12R1.252 O=C(O)COCC1=CC=CC=C1 2721-1-97 [0,2,0,0,0,0|0,0,1]=3 411 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 2621-1-1R [0,2,0,0,0,0|0,0,2]=4 412 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O 2921-1-Y6 [0,2,0,0,0,0|0,0,2]=4 413 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O 4H57-5-S1 [0,2,0,0,0,0|1,0,1]=4 414 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O 4757-1-R0 [0,2,0,0,0,0|0,0,1]=3 415 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O 4H57-1-13 [0,2,0,0,0,0|1,0,1]=4 416 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O 4H57-5-R1 [0,2,0,0,0,0|1,0,1]=4 417 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O 4H57-5-0G [0,2,0,0,0,0|1,0,1]=4 418 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O 4H57-5-0A [0,2,0,0,0,0|1,0,1]=4 419 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O 4H57-1-W7 [0,2,0,0,0,0|1,0,1]=4 420 B12R1.43 [C@H](N)(CC1=CC=NC=C1)C(=O)O 4H57-1-Y6 [0,2,0,0,0,0|1,0,1]=4 421 B12R1.891 FC(F)(F)COC1=CC=CC=C1 2607-3-60 [0,2,0,0,0,0|2,0,0]=4 422 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 8H64-1-24 [0,2,0,0,0,0|2,0,0]=4 423 B10R2.6 [C@H]1(C2=CC=CC=C2)CO1 2609-1-S2 [1,0,0,1,0,0|0,0,0]=2 424 B10R2.7 C1=CC2=C(C=N1)CNC2 3H32-5-1K [1,0,0,1,0,0|2,0,0]=4 425 B10R2.7 C1=CC=C2CNCC2=C1 3H31-5-3D [1,0,0,1,0,0|1,0,0]=3 426 B10R2.7 C1=CC=C2COCC2=C1 2H10-1-13 [1,0,0,1,0,0|1,0,0]=3 427 B10R2.7 C1=CC=C2NCCC2=C1 3H31-1-U9 [1,0,0,1,0,0|1,0,0]=3 428 B10R2.7 C1=CC=C2OC=CC2=C1 2H10-1-Y6 [1,0,0,1,0,0|0,0,2]=4 429 B10R2.7 C1=CC=C2OC=NC2=C1 4H56-1-X6 [1,0,0,1,0,0|1,0,1]=4 430 B10R2.7 C1=CC=C2OCCC2=C1 2H10-1-Y1 [1,0,0,1,0,0|0,0,0]=2 431 B10R2.7 C1=CC=C2OCOC2=C1 2H10-1-X1 [1,0,0,1,0,0|1,0,0]=3 432 B10R2.7 C1=CN=C2NCCC2=C1 3H32-1-B0 [1,0,0,1,0,0|2,0,0]=4 433 B10R2.320 BrC1CC2=CC=CC=C21 1600-9-0A [1,0,0,1,0,0|1,0,0]=3 434 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 3H32-D-34 [0,1,0,1,0,0|2,0,0]=4 435 B12R2.24 BrC1=CC=C2NCCCC2=C1 3H31-9-03 [0,1,0,1,0,0|1,0,0]=3 436 B12R2.24 BrC1=CC=C2OCCCC2=C1 2H10-9-X8 [0,1,0,1,0,0|0,0,0]=2 437 B12R2.24 BrC1=CC=C2OCCNC2=C1 4H56-9-AQ [0,1,0,1,0,0|1,0,0]=3 438 B12R2.24 BrC1=CC=C2OCCOC2=C1 2H10-9-X9 [0,1,0,1,0,0|1,0,0]=3 439 B12R2.24 FC1=CC2=C(C=C1)OCCN2 4H56-3-GX [0,1,0,1,0,0|1,0,0]=3 440 B12R2.24 NC1=CC=C2OCCOC2=C1 4H56-1-3G [0,1,0,1,0,0|1,0,0]=3 441 B12R2.24 O=C1CCC2=C(C=CC=C2)C1 2617-1-2B [0,1,0,1,0,0|0,0,2]=4 442 B12R2.24 O=C1CCC2=CC=CC=C2N1 4H48-1-T2 [0,1,0,1,0,0|0,0,2]=4 443 B12R2.24 OC1CCC2=CC=CC=C2C1 2602-1-08 [0,1,0,1,0,0|0,0,0]=2 444 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 2717-1-Z0 [0,1,0,1,0,0|0,0,2]=4 445 B12R2.132 NC1=CC=C2CCC(=O)C2=C1 4756-1-V2 [0,1,0,1,0,0|0,0,2]=4 446 B12R2.132 NC1=CC=C2COB(O)C2=C1 8H60-5-L5 [0,1,0,1,0,0|2,0,0]=4 447 B12R2.132 NC1CCC2=C1C=C(F)C=C2 3633-7-03 [0,1,0,1,0,0|1,0,0]=3 448 B12R2.132 N[C@H]1CCC2=C1C=C(F)C=C2 3633-7-S3 [0,1,0,1,0,0|1,0,0]=3 449 B12R2.132 O=C1CCC2=CC=C(Br)C=C12 2717-9-06 [0,1,0,1,0,0|0,0,2]=4 450 B12R2.132 O=C1CCC2=CC=C(Cl)C=C12 2617-5-29 [0,1,0,1,0,0|0,0,2]=4 451 B12R2.132 O=C1CCC2=CC=C(F)C=C12 2617-3-X2 [0,1,0,1,0,0|0,0,2]=4 452 B12R2.132 O=C1CCC2=CC=C(O)C=C12 2720-1-18 [0,1,0,1,0,0|0,0,2]=4 453 B12R2.2 C1=CC(C2CCCN2)=CC=N1 3H31-1-XE [0,1,0,1,0,0|2,0,0]=4 454 B12R2.2 C1=CC(N2CCCC2)=CC=N1 3H32-1-U9 [0,1,0,1,0,0|2,0,0]=4 455 B12R2.2 C1=CC=C(C2CCCN2)C=C1 P911-A-43 [0,1,0,1,0,0|1,0,0]=3 456 B12R2.2 C1=CC=C(C2CCCN2)N=C1 3H32-1-Q0 [0,1,0,1,0,0|2,0,0]=4 457 B12R2.2 C1=CC=C(C2NCCS2)C=C1 7H70-1-Y2 [0,1,0,1,0,0|0,1,0]=3 458 B12R2.2 C1=CN=CC(C2CCCN2)=C1 3H31-1-Z4 [0,1,0,1,0,0|2,0,0]=4 459 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 2717-1-Z2 [0,1,0,1,0,0|0,0,2]=4 460 B12R2.1081 BrC1=CC=CC2=C1CCNC2 3H31-9-24 [0,1,0,1,0,0|2,0,0]=4 461 B12R2.1081 CC1=CC=CC2=C1NCCC2 3H31-1-53 [0,1,0,1,0,0|1,0,0]=3 462 B12R2.1081 FC1=CC=CC2=C1OCCO2 2610-3-00 [0,1,0,1,0,0|1,0,0]=3 463 B12R2.1081 NC1=C2OCCOC2=CC=C1 4H30-1-V6 [0,1,0,1,0,0|1,0,0]=3 464 B12R2.1081 NC1CCOC2=CC=CC=C21 4H30-1-9B [0,1,0,1,0,0|0,0,0]=2 465 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 3730-1-S1 [0,1,0,1,0,0|1,0,0]=3 466 B12R2.1081 O=C1CCCC2=C1C=CC=C2 2717-1-03 [0,1,0,1,0,0|0,0,1]=3 467 B12R2.1081 O=C1CCCC2=C1N=CC=C2 4H17-1-15 [0,1,0,1,0,0|1,0,1]=4 468 B12R2.1081 O=C1CCOC2=CC=CC=C12 2H17-1-07 [0,1,0,1,0,0|0,0,1]=3 469 B12R2.1081 O=C1NCCC2=CC=CC=C12 4H48-1-KU [0,1,0,1,0,0|0,0,2]=4 470 B12R2.1081 O=C1OCCC2=CC=CC=C12 2H25-1-2D [0,1,0,1,0,0|0,0,2]=4 471 B12R2.1081 OC1=CC=CC2=C1NCCC2 4H01-1-5E [0,1,0,1,0,0|1,0,0]=3 472 B12R2.1081 OC1CCCC2=C1N=CC=C2 4H01-1-CP [0,1,0,1,0,0|1,0,0]=3 473 B12R2.1081 OC1CCCC2=CC=CC=C21 2702-1-00 [0,1,0,1,0,0|0,0,0]=2 474 B12R2.1081 OC1CCOC2=CC=CC=C21 2H02-1-07 [0,1,0,1,0,0|0,0,0]=2 475 B12R2.32 OCC1=CC2=CC=CC=C2N1 4H56-1-483 [0,1,0,1,0,0|0,0,2]=4 476 B12R2.32 OCC1=CC2=CC=CC=C2S1 6H01-1-X4 [0,1,0,1,0,0|0,0,2]=4 477 B12R2.32 OCC1=NC2=CC=CC=C2N1 4H01-1-02 [0,1,0,1,0,0|1,0,1]=4 478 B12R2.32 OCC1=NC2=CC=CC=C2S1 8H01-1-X4 [0,1,0,1,0,0|1,0,1]=4 479 B12R2.32 OC[C@@H]1CC2=CC=CC=C2N1 4H56-1-SP [0,1,0,1,0,0|0,0,0]=2 480 B12R2.196 O=C1CCC2=C(Br)C=CC=C12 2717-9-02 [0,1,0,1,0,0|0,0,2]=4 481 B12R2.196 O=C1CCC2=C(Cl)C=CC=C12 2217-5-03 [0,1,0,1,0,0|0,0,2]=4 482 B12R2.196 O=C1CCC2=C(O)C=CC=C12 2720-1-X6 [0,1,0,1,0,0|0,0,2]=4 483 B12R2.196 O=C1CCC2=C1C=CC=C2F 2717-3-X1 [0,1,0,1,0,0|0,0,2]=4 484 B12R2.612 NC1=CC2=C(C=C1)C(=O)CC2 4756-1-V1 [0,1,0,1,0,0|0,0,2]=4 485 B12R2.612 O=C1CCC2=CC(Br)=CC=C12 2917-9-X0 [0,1,0,1,0,0|0,0,2]=4 486 B12R2.612 O=C1CCC2=CC(Cl)=CC=C12 2717-5-51 [0,1,0,1,0,0|0,0,2]=4 487 B12R2.612 O=C1CCC2=CC(F)=CC=C12 2717-3-01 [0,1,0,1,0,0|0,0,2]=4 488 B12R2.612 O=C1CCC2=CC(O)=CC=C12 2720-1-X5 [0,1,0,1,0,0|0,0,2]=4 489 B12R2.1 OCC1=NNC2=CC=CC=C21 4H56-1-LR [0,1,0,1,0,0|1,0,1]=4 490 B12R2.1 O\N=C1\CCC2=CC=CC=C21 4747-1-X2 [0,1,0,1,0,0|0,0,1]=3 491 B12R2.2057 C1=CC=C(CNC2CC2)C=C1 3731-1-03 [0,1,0,1,0,0|1,0,0]=3 492 B12R2.2058 C1=CC=C(OC2CNC2)C=C1 4H56-1-MQ [0,1,0,1,0,0|2,0,0]=4 493 B12R2.18 CC1CC2=CC=CC=C2C1=O 2717-1-19 [0,1,0,1,0,0|0,0,2]=4 494 B12R2.18 NC1C2=CC=CC=C2CC1O 4656-1-93 [0,1,0,1,0,0|1,0,0]=3 495 B12R2.18 N[C@H]1C2=CC=CC=C2C[C@@H]1O 4656-1-4B [0,1,0,1,0,0|1,0,0]=3 496 B12R2.18 N[C@H]1C2=CC=CC=C2C[C@H]1O 4756-1-S1 [0,1,0,1,0,0|1,0,0]=3 497 B12R2.18 OC1C2=CC=CC=C2CC1Br 2702-9-X0 [0,1,0,1,0,0|0,0,0]=2 498 B12R2.18 [C@H]1(O)CC2=CC=CC=C2[C@H]1N 4H56-1-3Y [0,1,0,1,0,0|1,0,0]=3 499 B12R2.2403 CC1(C)CNC2=CC=CC=C21 3H31-1-R3 [0,1,0,1,0,0|2,0,0]=4 500 B8R1.8 CNCC1=CC=CO1 4H56-1-395 [1,0,0,0,1,0|2,0,0]=4 501 B8R1.8 CSCC1=CC=CO1 6H66-1-0X [1,0,0,0,1,0|2,0,0]=4 502 B8R1.8 NCCC1=CC=CS1 7H30-1-X0 [1,0,0,0,1,0|2,0,0]=4 503 B8R1.8 NCCC1=CSC=C1 7H30-5-X3 [1,0,0,0,1,0|2,0,0]=4 504 B8R1.8 OCCC1=CC=CS1 6H01-1-01 [1,0,0,0,1,0|1,0,0]=3 505 B8R1.8 OCCC1=CNC=N1 4H56-1-833 [1,0,0,0,1,0|2,0,0]=4 506 B8R1.8 OCCC1=CNN=C1 4H01-1-Y9 [1,0,0,0,1,0|2,0,0]=4 507 B8R1.8 OCCC1=CSC=C1 6H01-1-12 [1,0,0,0,1,0|1,0,0]=3 508 B8R1.8 OCCN1C=CC=C1 4H01-1-66 [1,0,0,0,1,0|1,0,0]=3 509 B8R1.8 OCCN1C=CC=N1 4H01-1-U5 [1,0,0,0,1,0|2,0,0]=4