0 B16R2.2256 C1=CC=C(C=C1)/C=C/SC2=CC=CC=C2 S807001 [0,0,0,0,0,0|2,0,1]=3 1 B16R2.2256 C1=CC=C(C=C1)/C=N/NC2=CC=CC=C2 S825883 [0,0,0,0,0,0|2,0,1]=3 2 B16R2.2256 C1=CC=C(C=C1)/N=P/NC2=CC=CC=C2 PH007102 [0,0,0,0,0,0|3,0,0]=3 3 B16R2.2256 C1=CC=C(C=C1)CCSC2=CC=CC=C2 S354627 [0,0,0,0,0,0|2,0,0]=2 4 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=C2 S561967 [0,0,0,0,0,0|1,0,0]=1 5 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=C2 S698458 [0,0,0,0,0,0|1,0,0]=1 6 B16R2.2256 C1=CC=C(C=C1)C[Se]CC2=CC=CC=C2 S906972 [0,0,0,0,0,0|0,1,0]=1 7 B16R2.2256 C1=CC=C(C=C1)NN=CC2=CC=CC=N2 S377562 [0,0,0,0,0,0|3,0,1]=4 8 B16R2.2256 C1=CC=[N+](C=C1)CCC[N+]2=CC=CC=C2 S11488 [0,0,0,0,0,0|3,0,0]=3 9 B16R2.2256 C1=CC=[N+](C=C1)CCC[N+]2=CC=CC=C2 S274089 [0,0,0,0,0,0|3,0,0]=3 10 B16R2.2256 C1=CN=CC(=C1)CNCC2=CC=NC=C2 CDS011510 [0,0,0,0,0,0|3,0,0]=3 11 B16R2.2256 [SiH2](CC1=CC=CC=C1)CC2=CC=CC=C2 S833614 [0,0,0,0,0,0|1,0,0]=1 12 B17R2.143 C/C(=N\C1=CC=CC=C1)/NC2=CC=CC=C2 PH011688 [0,1,0,0,0,0|3,0,0]=4 13 B17R2.143 CN(CC1=CC=CC=C1)CC2=CC=CC=C2 S360147 [0,1,0,0,0,0|1,0,0]=2 14 B17R2.143 C[S+](CC1=CC=CC=C1)CC2=CC=CC=C2 S294179 [0,1,0,0,0,0|0,1,0]=2 15 B17R2.143 C[S+](CC1=CC=CC=C1)CC2=CC=CC=C2 S300276 [0,1,0,0,0,0|0,1,0]=2 16 B17R2.143 ClC(C[N+]1=CC=CC=C1)C[N+]2=CC=CC=C2 S65030 [0,1,0,0,0,0|3,0,0]=4 17 B17R2.143 O=C(CC1=CC=CC=C1)NC2=CC=CC=C2 S521612 [0,1,0,0,0,0|2,0,0]=3 18 B17R2.143 O=C(C[N+]1=CC=CC=C1)NC2=CC=CC=C2 S243019 [0,1,0,0,0,0|3,0,0]=4 19 B17R2.143 O=C(SC1=CC=CC=C1)SC2=CC=CC=C2 T291544 [0,1,0,0,0,0|3,0,0]=4 20 B17R2.143 O=N(=C/C1=CC=CC=C1)\CC2=CC=CC=C2 T272264 [0,1,0,0,0,0|1,0,1]=3 21 B17R2.143 OC(CC1=CC=CC=C1)CC2=CC=CC=C2 S454850 [0,1,0,0,0,0|1,0,0]=2 22 B17R2.143 OC(C[N+]1=CC=CC=C1)C[N+]2=CC=CC=C2 S251747 [0,1,0,0,0,0|3,0,0]=4 23 B17R2.143 OC(C[N+]1=CC=CC=C1)C[N+]2=CC=CC=C2 S65049 [0,1,0,0,0,0|3,0,0]=4 24 B17R2.143 ON(CC1=CC=CC=C1)CC2=CC=CC=C2 T290416 [0,1,0,0,0,0|1,0,0]=2 25 B17R2.143 [O-]/C(=N\C1=CC=CC=C1)/NC2=CC=CC=C2 R466433 [0,1,0,0,0,0|3,0,0]=4 26 B17R2.143 [Se]=C(NC1=CC=CC=C1)NC2=CC=CC=C2 R580856 [0,1,0,0,0,0|3,0,0]=4 27 B17R2.216 BrC1=CC=C(C=C1)/C=N/NC2=CC=CC=C2 S848948 [0,1,0,0,0,0|2,0,1]=4 28 B17R2.216 CC1=CC=C(C=C1)/C=N/NC2=CC=CC=C2 R533807 [0,1,0,0,0,0|2,0,1]=4 29 B17R2.216 CC1=CC=C(C=C1)CNCC2=CC=CC=N2 CDS010792 [0,1,0,0,0,0|2,0,0]=3 30 B17R2.216 CC1=CC=C(C=C1)COCC2=CC=CC=C2 S571423 [0,1,0,0,0,0|0,0,0]=1 31 B17R2.216 CC1=CC=C(C=C1)N/N=C/C2=CC=CC=C2 L127353 [0,1,0,0,0,0|2,0,1]=4 32 B17R2.216 CC1=CC=C(C=C1)NCCC2=CC=CC=N2 S651311 [0,1,0,0,0,0|3,0,0]=4 33 B17R2.216 ClC1=CC=C(C=C1)/C=N/NC2=CC=CC=C2 S554715 [0,1,0,0,0,0|2,0,1]=4 34 B17R2.216 ClC1=CC=C(C=C1)CCCC2=CC=NC=C2 PH007894 [0,1,0,0,0,0|2,0,0]=3 35 B17R2.216 ClC1=CC=C(C=C1)N/N=C/C2=CC=CC=C2 L127434 [0,1,0,0,0,0|2,0,1]=4 36 B17R2.216 ClC1=CC=C(C=C1)NCCC2=CC=CC=N2 S650846 [0,1,0,0,0,0|3,0,0]=4 37 B17R2.2342 BrC(CCC1=CC=CC=C1)C2=CC=CC=C2 S12395 [0,1,0,0,0,0|1,0,0]=2 38 B17R2.2342 C/C(=C/CC1=CC=CC=C1)/C2=CC=CC=C2 R156663 [0,1,0,0,0,0|1,0,1]=3 39 B17R2.2342 C/C(=N\NC1=CC=CC=C1)/C2=CC=CC=C2 R761109 [0,1,0,0,0,0|2,0,1]=4 40 B17R2.2342 CN(/N=C/C1=CC=CC=C1)C2=CC=CC=C2 S837849 [0,1,0,0,0,0|2,0,1]=4 41 B17R2.2342 CN(CCC1=CC=CC=C1)C2=CC=CC=C2 T332089 [0,1,0,0,0,0|2,0,0]=3 42 B17R2.2342 Cl/C(=N\NC1=CC=CC=C1)/C2=CC=CC=C2 PH004274 [0,1,0,0,0,0|2,0,1]=4 43 B17R2.2342 ClC(CCC1=CC=CC=C1)C2=CC=CC=C2 S333786 [0,1,0,0,0,0|1,0,0]=2 44 B17R2.2342 O=C(COC1=CC=CC=C1)C2=CC=CC=C2 S929867 [0,1,0,0,0,0|2,0,1]=4 45 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CN=CC=C2 S406708 [0,1,0,0,0,0|2,0,1]=4 46 B17R2.2342 O=C(NC[N+]1=CC=CC=C1)C2=CC=CC=C2 R642916 [0,1,0,0,0,0|2,0,1]=4 47 B17R2.2342 O=C(NNC1=CC=CC=C1)C2=CC=CC=C2 S682276 [0,1,0,0,0,0|2,0,1]=4 48 B17R2.2342 O=C(SCC1=CC=CC=C1)C2=CN=CC=C2 S876321 [0,1,0,0,0,0|1,1,1]=4 49 B17R2.2342 OC(CCC1=CC=CC=C1)C2=CC=CC=C2 S330159 [0,1,0,0,0,0|1,0,0]=2 50 B17R2.2342 OC(CNC1=CC=CC=C1)C2=CC=CC=C2 PH011910 [0,1,0,0,0,0|2,0,0]=3 51 B17R2.2342 OC(COC1=CC=CN=C1)C2=CC=CC=C2 PH013577 [0,1,0,0,0,0|3,0,0]=4 52 B17R2.2342 [SiH](C)(CCC1=CC=CC=C1)C2=CC=CC=C2 S826731 [0,1,0,0,0,0|1,1,0]=3 53 B17R2.3956 CC1=CC=CC=C1/C=N/NC2=CC=CC=C2 S886203 [0,1,0,0,0,0|2,0,1]=4 54 B17R2.3956 CC1=CC=CC=C1S/C=C\C2=CC=CC=C2 S805890 [0,1,0,0,0,0|2,0,1]=4 55 B17R2.3956 ClC1=CC=CC=C1/C=N/NC2=CC=CC=C2 S886157 [0,1,0,0,0,0|2,0,1]=4 56 B17R2.3956 NC1=CC=CC=C1C=NNC2=CC=CC=C2 S413143 [0,1,0,0,0,0|2,0,1]=4 57 B17R2.3956 NC1=CC=CC=C1CNCC2=CC=CC=C2 PH010345 [0,1,0,0,0,0|1,0,0]=2 58 B17R2.3956 O=C1C=CC=CN1OCCC2=CC=CC=C2 T163112 [0,1,0,0,0,0|3,0,0]=4 59 B17R2.3956 OC1=CC=CC=C1/C=N/CC2=CC=CC=C2 S645923 [0,1,0,0,0,0|1,0,1]=3 60 B17R2.3956 OC1=CC=CC=C1/C=N/NC2=CC=CC=C2 S510157 [0,1,0,0,0,0|2,0,1]=4 61 B17R2.3956 OC1=CC=CC=C1/C=N\CC2=CC=CN=C2 S764159 [0,1,0,0,0,0|2,0,1]=4 62 B17R2.5301 CC1=CC(=CC=C1)S/C=C\C2=CC=CC=C2 S805904 [0,1,0,0,0,0|2,0,1]=4 63 B17R2.5301 CC1=CC=CC(=C1)NCCC2=CC=CC=N2 S650919 [0,1,0,0,0,0|3,0,0]=4 64 B17R2.5301 ClC1=CC=CC(=C1)NCCC2=CC=CC=N2 S650838 [0,1,0,0,0,0|3,0,0]=4 65 B17R3.8 C1=CC=C(C=C1)C2=C3C=CC=CC3=NO2 S657301 [0,0,0,1,0,0|1,0,1]=3 66 B17R3.8 C1=CC=C(C=C1)N2C=NC3=CC=CC=C23 PH003116 [0,0,0,1,0,0|3,0,0]=4 67 B17R3.8 C1=CC=C(C=C1)N2N=CC3=C2C=CC=C3 S941093 [0,0,0,1,0,0|2,0,1]=4 68 B17R3.1963 C1=CC=C2C(=C1)CSCC3=CC=CC=C23 R163694 [0,0,0,1,0,0|0,1,0]=2 69 B15R2.2195 C1=CC=C(C=C1)/C=C/C2=CC=CC=N2 S439843 [0,0,0,0,1,0|1,0,2]=4 70 B15R2.2195 C1=CC=C(C=C1)/C=C/C2=CC=NC=C2 S881546 [0,0,0,0,1,0|1,0,2]=4 71 B15R2.2195 C1=CC=C(C=C1)/N=C/C2=NC=CC=C2 S887641 [0,0,0,0,1,0|2,0,1]=4 72 B15R2.2195 C1=CC=C(C=C1)C=NC2=CC=CC=N2 S23540 [0,0,0,0,1,0|2,0,1]=4 73 B15R2.2195 C1=CC=C(C=C1)CCC2=CC=CC=N2 PH003284 [0,0,0,0,1,0|1,0,0]=2 74 B15R2.2195 C1=CC=C(C=C1)CCC2=CC=NC=C2 PH011912 [0,0,0,0,1,0|1,0,0]=2 75 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=CC=C2 S836575 [0,0,0,0,1,0|1,0,0]=2 76 B15R2.2195 C1=CC=C(C=C1)CNC2=CN=CN=C2 CDS020904 [0,0,0,0,1,0|3,0,0]=4 77 B15R2.2195 C1=CC=C(C=C1)COC2=CC=CN=C2 PH013570 [0,0,0,0,1,0|1,0,0]=2 78 B15R2.2195 C1=CC=C(C=C1)COC2=CC=CN=C2 SYX00412 [0,0,0,0,1,0|1,0,0]=2 79 B15R2.2195 C1=CC=C(C=C1)COC2C=CC=CO2 S517828 [0,0,0,0,1,0|1,0,1]=3 80 B15R2.2195 C1=CC=C(C=C1)CSC2=NC=CC=N2 T316571 [0,0,0,0,1,0|2,1,0]=4 81 B15R2.2195 C1=CC=C(C=C1)OCC2=CC=CN=C2 PH007385 [0,0,0,0,1,0|1,0,0]=2 82 B15R2.2195 C1=CC=C(N=C1)CCC2=CN=CC=C2 PH008220 [0,0,0,0,1,0|2,0,0]=3 83 B15R2.2195 C1=CC=C(N=C1)NCC2=CC=NC=C2 PH010660 [0,0,0,0,1,0|3,0,0]=4 84 B15R2.2195 C1=CC=[N+](C=C1)CC[N+]2=CC=CC=C2 S587702 [0,0,0,0,1,0|2,0,0]=3 85 B15R2.2195 C1=CC=[N+](C=C1)CC[N+]2=CC=CC=C2 TMT00429 [0,0,0,0,1,0|2,0,0]=3 86 B15R2.2195 [SiH2](CC1=CC=CC=C1)C2=CC=CC=C2 S833606 [0,0,0,0,1,0|0,1,0]=2 87 B15R2.2196 C1=CC=C(C=C1)CSCC2=CC=CS2 PH008663 [0,0,0,0,1,0|1,1,0]=3 88 B17R2.2382 C(#CSC1=CC=CC=C1)SC2=CC=CC=C2 S807486 [0,0,0,0,0,1|2,0,1]=4 89 B17R2.2382 C(=N/N=C/C1=CC=CC=C1)\C2=CC=CC=C2 S244201 [0,0,0,0,0,1|1,0,2]=4 90 B17R2.2382 C1=CC(=CC=N1)CSSCC2=CC=NC=C2 PH009829 [0,0,0,0,0,1|2,1,0]=4 91 B17R2.2382 C1=CC=C(C=C1)/C=C/CCC2=CC=NC=C2 PH012841 [0,0,0,0,0,1|2,0,1]=4 92 B17R2.2382 C1=CC=C(C=C1)/C=C/CSC2=NC=CC=C2 R538078 [0,0,0,0,0,1|2,0,1]=4 93 B17R2.2382 C1=CC=C(C=C1)CCCCC2=CC=CC=C2 S823201 [0,0,0,0,0,1|1,0,0]=2 94 B17R2.2382 C1=CC=C(C=C1)CCCCC2=CC=CN=C2 PH012781 [0,0,0,0,0,1|2,0,0]=3 95 B17R2.2382 C1=CC=C(C=C1)CCCCC2=CC=NC=C2 PH011989 [0,0,0,0,0,1|2,0,0]=3 96 B17R2.2382 C1=CC=C(C=C1)CCCOC2=CC=CN=C2 PH013576 [0,0,0,0,0,1|2,0,0]=3 97 B17R2.2382 C1=CC=C(C=C1)CCCSC2=CC=CC=C2 S354635 [0,0,0,0,0,1|1,0,0]=2 98 B17R2.2382 C1=CC=C(C=C1)CNCCC2=NC=CC=C2 PH016686 [0,0,0,0,0,1|2,0,0]=3 99 B17R2.2382 C1=CC=C(C=C1)CON=CC2=CC=CC=N2 S355062 [0,0,0,0,0,1|1,0,1]=3 100 B17R2.2382 C1=CC=C(C=C1)CON=CC2=CC=NC=C2 S355089 [0,0,0,0,0,1|1,0,1]=3 101 B17R2.2382 C1=CC=C(C=C1)CSCCC2=NC=CC=C2 PH007045 [0,0,0,0,0,1|1,1,0]=3 102 B17R2.2382 C1=CC=C(C=C1)NCCOC2=CC=CC=C2 PH010015 [0,0,0,0,0,1|2,0,0]=3 103 B17R2.2382 C1=CC=C(C=C1)SCCSC2=CC=CC=C2 S39781 [0,0,0,0,0,1|2,0,0]=3 104 B17R2.2382 C1=CC=C(C=C1)SCCSC2=CC=CC=C2 S577073 [0,0,0,0,0,1|2,0,0]=3 105 B17R2.2382 C1=CC=[N+](C=C1)CCCC[N+]2=CC=CC=C2 S435627 [0,0,0,0,0,1|3,0,0]=4 106 B16R2.71 BrC1=CC=CC=C1/N=C/C2=CC=CC=C2 R946486 [0,1,0,0,1,0|1,0,1]=4 107 B16R2.71 CC1=C(C=CC=C1)/N=C/C2=CC=CC=C2 S609293 [0,1,0,0,1,0|1,0,1]=4 108 B16R2.71 FC1=CC=CC=C1COC2=CC=CC=N2 T314404 [0,1,0,0,1,0|1,0,0]=3 109 B16R2.71 IC1=C(C=CN=C1)OCC2=CC=CC=C2 ADE000747 [0,1,0,0,1,0|1,0,0]=3 110 B16R2.71 NC1=C(C=CC=C1)SCC2=CC=CC=C2 S704121 [0,1,0,0,1,0|0,1,0]=3 111 B16R2.71 NC1=CC=CC=C1CCC2=CC=CC=N2 CDS005747 [0,1,0,0,1,0|1,0,0]=3 112 B16R2.71 O=C1C=CC=CN1OCC2=CC=CC=C2 T163120 [0,1,0,0,1,0|1,0,0]=3 113 B16R2.71 OC1=C(C=CC=C1)CCC2=CC=CC=C2 PH015899 [0,1,0,0,1,0|0,0,0]=2 114 B16R2.71 OC1=CC=CC=C1CNC2=CC=CC=C2 S859613 [0,1,0,0,1,0|1,0,0]=3 115 B16R2.71 OC1=CC=CC=C1CNC2=CC=CN=C2 S564796 [0,1,0,0,1,0|2,0,0]=4 116 B16R2.71 [SiH2](CC1=CC=CC=C1Cl)C2=CC=CC=C2 S830267 [0,1,0,0,1,0|0,1,0]=3 117 B16R2.88 CC(NC1=CC=CC=C1)C2=CC=CC=C2 S109762 [0,1,0,0,1,0|1,0,0]=3 118 B16R2.88 CC(NC1=CC=CC=C1)C2=CC=CC=C2 S54918 [0,1,0,0,1,0|1,0,0]=3 119 B16R2.88 CC(NC1=CC=CC=C1)C2=CC=CC=N2 PH010681 [0,1,0,0,1,0|2,0,0]=4 120 B16R2.88 N/C(=N\C1=CC=CC=C1)/C2=CC=CC=C2 R635456 [0,1,0,0,1,0|1,0,1]=4 121 B16R2.88 N=C(NC1=CC=CC=C1)C2=CC=CC=C2 S565814 [0,1,0,0,1,0|1,0,1]=4 122 B16R2.88 NC(CC1=CC=CC=C1)C2=CC=CN=C2 PH018513 [0,1,0,0,1,0|1,0,0]=3 123 B16R2.88 NC(CC1=CC=CC=C1)C2=CC=NC=C2 PH018514 [0,1,0,0,1,0|1,0,0]=3 124 B16R2.88 NC(CC1=CC=NC=C1)C2=CC=CC=N2 PH014621 [0,1,0,0,1,0|2,0,0]=4 125 B16R2.88 NC(CC1=CC=NC=C1)C2=CC=NC=C2 PH014846 [0,1,0,0,1,0|2,0,0]=4 126 B16R2.88 NC(CC1=CC=NC=C1)C2=CN=CC=C2 PH014845 [0,1,0,0,1,0|2,0,0]=4 127 B16R2.88 NN(CC1=CC=CC=C1)C2=CC=CC=C2 CDS000470 [0,1,0,0,1,0|1,0,0]=3 128 B16R2.88 O=C(CC1=CC=NC=C1)C2=CC=CC=C2 T313602 [0,1,0,0,1,0|1,0,1]=4 129 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 R610550 [0,1,0,0,1,0|1,0,1]=4 130 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 S189375 [0,1,0,0,1,0|1,0,1]=4 131 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 S224413 [0,1,0,0,1,0|1,0,1]=4 132 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 S248185 [0,1,0,0,1,0|1,0,1]=4 133 B16R2.88 O=C(OC1=CC=CC=C1)C2=CN=CC=C2 S370355 [0,1,0,0,1,0|1,0,1]=4 134 B16R2.88 O=S(CC1=CC=CC=C1)C2=CC=CC=C2 S620033 [0,1,0,0,1,0|0,1,0]=3 135 B16R2.88 OC(CC1=CC=CC=C1)C2=CC=CC=C2 S385581 [0,1,0,0,1,0|0,0,0]=2 136 B16R2.88 S=C(NC1=CC=CC=C1)C2=CC=CC=C2 S502073 [0,1,0,0,1,0|1,0,1]=4 137 B16R2.88 [NH3+]C(CC1=CC=CC=C1)C2=CC=CC=C2 S422517 [0,1,0,0,1,0|0,0,0]=2 138 B16R2.88 [O-]/[N+](=C/C1=CC=CC=C1)/C2=CC=CC=C2 S861243 [0,1,0,0,1,0|1,0,1]=4 139 B16R2.88 [O-]/[N+](=N\C1=CC=CC=C1)/C2=CC=CC=C2 S452289 [0,1,0,0,1,0|2,0,0]=4 140 B16R2.88 [O-][S+](NC1=CC=CC=C1)C2=CC=CC=C2 T174823 [0,1,0,0,1,0|1,1,0]=4 141 B16R2.88 [SiH](C)(CC1=CC=CC=C1)C2=CC=CC=C2 S826685 [0,1,0,0,1,0|0,1,0]=3 142 B16R2.132 BrC1=CC=C(C=C1)/C=N/C2=CC=CC=C2 S834882 [0,1,0,0,1,0|1,0,1]=4 143 B16R2.132 BrC1=CC=C(C=C1)/N=C/C2=CC=CC=C2 S592102 [0,1,0,0,1,0|1,0,1]=4 144 B16R2.132 BrC1=CC=C(C=C1)SCC2=CC=CC=C2 S681318 [0,1,0,0,1,0|0,1,0]=3 145 B16R2.132 CC1=CC=C(C=C1)/C=N/C2=CC=CC=C2 S594431 [0,1,0,0,1,0|1,0,1]=4 146 B16R2.132 CC1=CC=C(C=C1)/N=C/C2=CC=CC=C2 PH000203 [0,1,0,0,1,0|1,0,1]=4 147 B16R2.132 CC1=CC=C(C=C1)/N=N/C2=CC=CC=C2 S921076 [0,1,0,0,1,0|2,0,0]=4 148 B16R2.132 CC1=CC=C(C=C1)/N=N\C2=CC=CC=C2 R322199 [0,1,0,0,1,0|2,0,0]=4 149 B16R2.132 CC1=CC=C(C=C1)CNC2=CN=CC=C2 S548561 [0,1,0,0,1,0|2,0,0]=4 150 B16R2.132 CC1=CC=C(C=C1)CSC2=CC=CC=C2 S748099 [0,1,0,0,1,0|0,1,0]=3 151 B16R2.132 CC1=CC=C(C=C1)NCC2=CC=CN=C2 T321966 [0,1,0,0,1,0|2,0,0]=4 152 B16R2.132 ClC1=CC=C(C=C1)/C=N/C2=CC=CC=C2 S615803 [0,1,0,0,1,0|1,0,1]=4 153 B16R2.132 ClC1=CC=C(C=C1)CSC2=CC=CC=C2 S722030 [0,1,0,0,1,0|0,1,0]=3 154 B16R2.132 ClC1=CC=C(C=C1)N=CC2=CC=CC=C2 S365548 [0,1,0,0,1,0|1,0,1]=4 155 B16R2.132 ClC1=CC=C(C=C1)SCC2=CC=CC=C2 S721948 [0,1,0,0,1,0|0,1,0]=3 156 B16R2.132 FC1=CC=C(C=C1)C=NC2=CC=CC=C2 S523992 [0,1,0,0,1,0|1,0,1]=4 157 B16R2.132 FC1=CC=C(C=C1)CNC2=CC=CC=N2 T312444 [0,1,0,0,1,0|2,0,0]=4 158 B16R2.132 IC1=CC=C(C=C1)/N=C/C2=CC=CC=C2 S818402 [0,1,0,0,1,0|1,0,1]=4 159 B16R2.132 NC1=CC=C(C=C1)/C=C/C2=CC=CC=C2 CDS000140 [0,1,0,0,1,0|0,0,2]=4 160 B16R2.132 NC1=CC=C(C=C1)CCC2=CC=NC=C2 TMT00306 [0,1,0,0,1,0|1,0,0]=3 161 B16R2.132 NC1=CC=C(C=C1)CSC2=CC=CC=C2 KOB0081 [0,1,0,0,1,0|0,1,0]=3 162 B16R2.132 NC1=CC=C(C=C1)NCC2=CC=CC=C2 S935719 [0,1,0,0,1,0|1,0,0]=3 163 B16R2.132 NC1=CC=C(C=C1)OCC2=CC=CC=N2 CDS006513 [0,1,0,0,1,0|1,0,0]=3 164 B16R2.132 OC1=CC=C(C=C1)/C=N/C2=CC=CC=C2 S684589 [0,1,0,0,1,0|1,0,1]=4 165 B16R2.132 OC1=CC=C(C=C1)/N=C/C2=CC=CC=C2 S590649 [0,1,0,0,1,0|1,0,1]=4 166 B16R2.132 OC1=CC=C(N=C1)OCC2=CC=CC=C2 CDS005481 [0,1,0,0,1,0|1,0,0]=3 167 B16R2.252 BrC1=CC(=CC=C1)/N=C/C2=CC=CC=C2 S896314 [0,1,0,0,1,0|1,0,1]=4 168 B16R2.252 BrC1=CC=CC(=C1)CSC2=CC=CC=C2 CDS024287 [0,1,0,0,1,0|0,1,0]=3 169 B16R2.252 CC1=CC=CC(=N1)NCC2=CC=CC=C2 PH017012 [0,1,0,0,1,0|2,0,0]=4 170 B16R2.252 ClC1=CC=CC(=C1)/N=C/C2=CC=CC=C2 S632333 [0,1,0,0,1,0|1,0,1]=4 171 B16R2.252 ClC1=CN=CC(=N1)OCC2=CC=CC=C2 T327336 [0,1,0,0,1,0|2,0,0]=4 172 B16R2.252 NC1=CC=CC(=C1)CCC2=CC=NC=C2 T323934 [0,1,0,0,1,0|1,0,0]=3 173 B18R2.270 CC1=CC=C(C=C1)CCCCC2=CC=CC=C2 S498548 [0,1,0,0,0,1|1,0,0]=3 174 B18R2.270 ClC1=CC=C(C=C1)CCCCC2=CC=NC=C2 PH012856 [0,1,0,0,0,1|2,0,0]=4 175 B18R2.270 ClC1=CC=C(C=C1)CO/N=C/C2=CC=NC=C2 S511323 [0,1,0,0,0,1|1,0,1]=4 176 B18R2.270 ClC1=CC=C(C=C1)SC/C=C/C2=CC=CC=C2 R538418 [0,1,0,0,0,1|1,0,1]=4 177 B18R2.270 NC1=CC=C(C=C1)OCCCC2=CC=CC=C2 PH014050 [0,1,0,0,0,1|1,0,0]=3 178 B18R2.270 NC1=CC=C(C=C1)OCCOC2=CC=CC=C2 S618039 [0,1,0,0,0,1|2,0,0]=4 179 B18R2.2429 CC(CC1=CC=CC=C1)/N=C/C2=CC=CC=C2 PH001544 [0,1,0,0,0,1|1,0,1]=4 180 B18R2.2429 O=C(/C=C/C1=CC=CC=C1)CC2=CC=CC=C2 S141003 [0,1,0,0,0,1|1,0,1]=4 181 B18R2.2429 O=C(CC1=CC=CC=C1)NCC2=CC=CC=C2 R131687 [0,1,0,0,0,1|1,0,0]=3 182 B18R2.2429 O=C(COC1=CC=CC=C1)NC2=CC=CC=C2 R813958 [0,1,0,0,0,1|2,0,0]=4 183 B18R2.2429 O=C(NC1=CC=CC=C1)OCC2=NC=CC=C2 R915254 [0,1,0,0,0,1|1,0,1]=4 184 B18R2.2429 O=C(NCC1=CC=CC=C1)NC2=CC=CC=C2 S517771 [0,1,0,0,0,1|1,0,1]=4 185 B18R2.2429 O=C(OCC1=CC=CC=C1)SC2=CC=CC=C2 S771171 [0,1,0,0,0,1|0,0,1]=3 186 B18R2.2429 S=C(NCC1=CC=CC=C1)NC2=CC=CC=C2 S716774 [0,1,0,0,0,1|1,0,1]=4 187 B18R2.3984 CC1=CN=CC=C1CCCCC2=CC=CC=C2 PH012809 [0,1,0,0,0,1|2,0,0]=4 188 B18R2.3984 OC1=CC=CC=C1/C=N/CCC2=CC=CC=C2 S717398 [0,1,0,0,0,1|1,0,1]=4 189 B18R2.6483 CC1=NC(=CC=C1)/C=N/OCC2=CC=CC=C2 S353477 [0,1,0,0,0,1|1,0,1]=4 190 B18R2.6483 NC1=CC=CC(=C1)OCCOC2=CC=CC=C2 S591955 [0,1,0,0,0,1|2,0,0]=4 191 B18R2.7189 O=C(CCCC1=CC=CC=C1)C2=CC=CC=C2 S561444 [0,1,0,0,0,1|1,0,0]=3 192 B18R2.7189 O=C(CSCC1=CC=CC=C1)C2=CC=CC=C2 S633704 [0,1,0,0,0,1|0,1,0]=3 193 B18R2.128576 O=C(OCC1=CC=CC=C1)N2C=CC=CC=C2 T281905 [0,1,0,0,0,1|1,0,1]=4 194 B18R2.199 N#CN(CC1=CC=CC=C1)CC2=CC=CC=C2 S835927 [0,2,0,0,0,0|1,0,0]=3 195 B18R2.199 O=CN(CC1=CC=CC=C1)CC2=CC=CC=C2 PHB00110 [0,2,0,0,0,0|1,0,0]=3 196 B18R2.199 ON=C(CC1=CC=CC=C1)CC2=CC=CC=C2 S798770 [0,2,0,0,0,0|1,0,0]=3 197 B18R2.266 CC1=CC=C(C=C1)NC(=O)CC2=CC=CC=C2 R371629 [0,2,0,0,0,0|2,0,0]=4 198 B18R2.266 O=C(CC1=CC=CC=C1)NC2=CC=C(C=C2)Br S519464 [0,2,0,0,0,0|2,0,0]=4 199 B18R2.266 O=C(CC1=CC=CC=C1)NC2=CC=C(C=C2)Cl R131660 [0,2,0,0,0,0|2,0,0]=4 200 B18R2.3983 O=C(CC1=C(C=CC=C1)Br)NC2=CC=CC=C2 R437190 [0,2,0,0,0,0|2,0,0]=4 201 B18R2.3983 O=C(CC1=CC=CC=C1)NC2=C(C=CC=C2)Cl S80757 [0,2,0,0,0,0|2,0,0]=4 202 B18R2.3983 O=C(CC1=CC=CC=C1)NC2=CC=CC=C2I R536822 [0,2,0,0,0,0|2,0,0]=4 203 B18R2.3983 O=C(CC1=CC=CC=C1Cl)NC2=CC=CC=C2 PH008567 [0,2,0,0,0,0|2,0,0]=4 204 B18R2.6478 O=C(CC1=CC=CC=C1)NC2=CC(=CC=C2)Br R536768 [0,2,0,0,0,0|2,0,0]=4 205 B18R2.6478 O=C(CC1=CC=CC=C1)NC2=CC(=CC=C2)Cl S900427 [0,2,0,0,0,0|2,0,0]=4 206 B18R2.7204 CC(OC1=CC=CC=C1)C(C)C2=CC=CC=C2 S101265 [0,2,0,0,0,0|2,0,0]=4 207 B18R2.7204 O=C(NC1=CC=CC=C1)C(O)C2=CC=CC=C2 S710172 [0,2,0,0,0,0|2,0,0]=4 208 B18R2.32233 C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2 S442429 [0,2,0,0,0,0|1,0,0]=3 209 B18R2.32233 C[Si](C)(CC1=CC=CC=C1)CC2=CC=CC=C2 S831034 [0,2,0,0,0,0|1,0,0]=3 210 B18R2.61 O=CC1=CC=C(C=C1)OCCC2=CC=CC=C2 CDS003699 [0,2,0,0,0,0|2,0,0]=4 211 B18R2.61 O=CC1=CC=C(C=C1)SCCC2=CC=CC=C2 PH000713 [0,2,0,0,0,0|2,0,0]=4 212 B18R2.253 CC1=CC=C(C=C1)C(=O)NCC2=CC=CC=C2 S598941 [0,2,0,0,0,0|1,0,1]=4 213 B18R2.253 O=C(CCC1=CC=CC=C1)C2=CC=C(C=C2)O PH007956 [0,2,0,0,0,0|1,0,1]=4 214 B18R2.253 O=C(NCC1=CC=CC=C1)C2=CC=C(C=C2)Cl S555053 [0,2,0,0,0,0|1,0,1]=4 215 B18R2.253 O=C(NCC1=CC=CC=C1)C2=CC=C(C=C2)O OTV000003 [0,2,0,0,0,0|1,0,1]=4 216 B18R2.253 O=C(OCC1=CC=CC=C1)C2=CC=C(N=C2)O PH019596 [0,2,0,0,0,0|1,0,1]=4 217 B18R2.257 CC1=CC=C(C=C1)COC(=O)C2=CN=CC=C2 S398365 [0,2,0,0,0,0|1,0,1]=4 218 B18R2.257 O=C(CCC1=CC=C(C=C1)Cl)C2=CC=CC=C2 PH009951 [0,2,0,0,0,0|1,0,1]=4 219 B18R2.257 O=C(CCC1=CC=C(C=C1)O)C2=CC=CC=C2 PH007972 [0,2,0,0,0,0|1,0,1]=4 220 B18R2.274 CC1=CC=C(C=C1)COCC2=CC=C(C=C2)C T331023 [0,2,0,0,0,0|0,0,0]=2 221 B18R2.3606 O=CC(CCC1=CC=CC=C1)C2=CC=CC=C2 PH001365 [0,2,0,0,0,0|1,0,0]=3 222 B18R2.3634 C/C(=C/C(C)C1=CC=CC=C1)/C2=CC=CC=C2 R156655 [0,2,0,0,0,0|1,0,1]=4 223 B18R2.3634 C/C(=N\[C@H](C)C1=CC=CC=C1)/C2=CC=CC=C2 T297968 [0,2,0,0,0,0|1,0,1]=4 224 B18R2.3634 CC(CC(=O)C1=CC=CC=C1)C2=CC=CC=C2 S433489 [0,2,0,0,0,0|1,0,1]=4 225 B18R2.3634 CC(NC(C)C1=CC=CC=C1)C2=CC=CC=C2 S346837 [0,2,0,0,0,0|1,0,0]=3 226 B18R2.3634 CC(OC(=O)C1=CC=CC=C1)C2=CC=CC=C2 S403342 [0,2,0,0,0,0|0,0,1]=3 227 B18R2.3634 CC(SC(C)C1=CC=CC=C1)C2=CC=CC=C2 S354554 [0,2,0,0,0,0|0,1,0]=3 228 B18R2.3634 CN(CC(O)C1=CC=CC=C1)C2=CC=CC=C2 S793949 [0,2,0,0,0,0|2,0,0]=4 229 B18R2.3634 C[C@@H](NC(=O)C1=CC=CC=C1)C2=CC=CC=C2 R425230 [0,2,0,0,0,0|1,0,1]=4 230 B18R2.3990 O=S(CCC1=C(C=CC=C1)Br)C2=CC=CC=C2 T292087 [0,2,0,0,0,0|2,0,0]=4 231 B18R2.4001 C/C(=N\CC1=CC=CC=C1)/C2=CC=CC=C2O S646024 [0,2,0,0,0,0|1,0,1]=4 232 B18R2.4001 CC1=C(C=CC=C1)C(=O)NCC2=CC=CC=C2 R437387 [0,2,0,0,0,0|1,0,1]=4 233 B18R2.4001 NC1=CC=CC=C1C(=O)NCC2=CC=CC=C2 PH003104 [0,2,0,0,0,0|1,0,1]=4 234 B18R2.4001 O=C(NCC1=CC=CC=C1)C2=C(C=CC=C2)Cl S172219 [0,2,0,0,0,0|1,0,1]=4 235 B18R2.4001 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2O EME00258 [0,2,0,0,0,0|1,0,1]=4 236 B18R2.4001 O=C(O[Hg]C1=CC=CC=C1)C2=CC=CC=C2O S617423 [0,2,0,0,0,0|1,0,1]=4 237 B18R2.6463 O=C(NCC1=CC=CC=C1)C2=CC=CC(=C2)F R130818 [0,2,0,0,0,0|1,0,1]=4 238 B18R2.6467 OC(CNC1=CC=CC(=C1)Cl)C2=CC=CC=C2 PH011909 [0,2,0,0,0,0|2,0,0]=4 239 B18R2.32237 CC(O)(C#CC1=CC=CC=C1)C2=CC=CC=C2 S241229 [0,2,0,0,0,0|1,0,1]=4 240 B18R2.32674 [SiH2](CC1=CC=CC=C1Cl)CC2=C(C=CC=C2)Cl S830283 [0,2,0,0,0,0|1,0,0]=3 241 B18R2.6482 ClC1=CC(=CC=C1)CNCC2=CC=CC(=C2)Cl PH011468 [0,2,0,0,0,0|1,0,0]=3 242 B16R3.9 C1=CC2=C(C=C1)C3=C(C=NC=N3)CC2 S761079 [0,0,0,1,1,0|2,0,0]=4 243 B18R3.2098 C1=CC=C(C=C1)/C=C/2\CCC3=C2C=CC=C3 S906506 [0,0,0,1,0,1|1,0,1]=4 244 B18R3.2098 C1=CC=C(C=C1)CC2=CNC3=C2C=CC=C3 PH011550 [0,0,0,1,0,1|1,0,1]=4 245 B18R3.2098 C1=CC=C(C=C1)CC2C=CC3=C2C=CC=C3 S768022 [0,0,0,1,0,1|1,0,1]=4 246 B18R3.2098 C1=CC=C(C=C1)CN2C=CC3=C2C=CC=C3 PH010768 [0,0,0,1,0,1|1,0,1]=4 247 B18R3.2098 C1=CC=C(C=C1)CN2CSC3=C2C=CC=C3 R366951 [0,0,0,1,0,1|1,0,0]=3 248 B18R3.2098 C1=CC=C(C=C1)CN2N=NC3=C2C=CC=C3 S266671 [0,0,0,1,0,1|2,0,0]=4 249 B18R3.2098 C1=CC=C(C=C1)C[N+]2=CSC3=C2C=CC=C3 R242624 [0,0,0,1,0,1|1,0,1]=4 250 B18R3.2098 C1=CC=C(C=C1)C[N+]2=CSC3=C2C=CC=C3 R307912 [0,0,0,1,0,1|1,0,1]=4 251 B18R3.2098 C1=CC=C(C=C1)C[N+]2=CSC3=C2C=CC=C3 R550191 [0,0,0,1,0,1|1,0,1]=4 252 B18R3.2098 C1=CC=C(C=C1)C[N+]2=CSC3=C2C=CC=C3 R587648 [0,0,0,1,0,1|1,0,1]=4 253 B18R3.2108 C1=CC=C(C=C1)C2=CCCC3=C2C=CC=C3 PH000036 [0,0,0,1,0,1|1,0,1]=4 254 B18R3.2108 C1=CC=C(C=C1)C2=CCCC3=C2C=CC=C3 T332550 [0,0,0,1,0,1|1,0,1]=4 255 B18R3.2108 C1=CC=C(C=C1)C2=NCCC3=C2C=CC=C3 PH013726 [0,0,0,1,0,1|1,0,1]=4 256 B18R3.2108 C1=CC=C(C=C1)C2NCCC3=CC=CC=C23 CDS018587 [0,0,0,1,0,1|1,0,0]=3 257 B18R3.2108 C1=CC=C2C(=C1)CCNC2C3=CC=CN=C3 PH018211 [0,0,0,1,0,1|2,0,0]=4 258 B18R3.2173 C1=CC=C2C(=C1)CC=CCC3=C2C=CC=C3 T197254 [0,0,0,1,0,1|1,0,0]=3 259 B18R3.2173 C1=CC=C2C(=C1)CCCCC3=C2C=CC=C3 T197238 [0,0,0,1,0,1|1,0,0]=3 260 B18R3.176 O=C1CC2=C(C=CC=C2)C3=CC=CC=C3N1 PH010252 [0,1,0,1,0,0|2,0,0]=4 261 B18R3.182 BrC1CC2=C(C1[N+]3=CC=CC=C3)C=CC=C2 L498017 [0,1,0,1,0,0|2,0,0]=4 262 B18R3.182 O=C1CC2=C(N1C3=CC=CC=C3)C=CC=C2 PH005146 [0,1,0,1,0,0|2,0,0]=4 263 B18R3.182 O=C1NC2=C(C1C3=CC=CC=C3)C=CC=C2 PH000161 [0,1,0,1,0,0|2,0,0]=4 264 B18R3.182 O=C1OC2=CC=CC=C2C1C3=CC=CC=C3 PH009448 [0,1,0,1,0,0|2,0,0]=4 265 B18R3.2007 NN1C(C1C2=CC=CC=C2)C3=CC=CC=C3 S339938 [0,1,0,1,0,0|1,0,0]=3 266 B18R3.12875 C1=CC=C(C=C1)CC2=NC3=C(N2)C=CC=C3 R464457 [0,1,0,1,0,0|2,0,0]=4 267 B18R3.12875 N1C(=NC2=C1C=CC=C2)CC3=CC=CC=C3 S358258 [0,1,0,1,0,0|2,0,0]=4 268 B18R3.48 ClC1=CC=C(C=C1)C2=CCC3=C2C=CC=C3 PH008501 [0,1,0,1,0,0|1,0,1]=4 269 B18R3.48 OC1=CC=C(C=C1)C2CCC3=C2C=CC=C3 S351377 [0,1,0,1,0,0|1,0,0]=3 270 B18R3.2953 ClC1=CC=C(C=C1)[C@@H]2OC2C3=CC=CC=C3 R751162 [0,1,0,1,0,0|0,0,0]=2 271 B18R3.4253 ClC1=CC2=C(ON=C2C=C1)C3=CC=CC=C3 S359629 [0,1,0,1,0,0|1,0,1]=4 272 B18R3.11551 CC1CC(C2=C1C=CC=C2)C3=CC=CC=C3 T330132 [0,1,0,1,0,0|1,0,0]=3 273 B18R3.11551 O=C1OC(C2=C1C=CC=C2)C3=CC=CC=C3 S292230 [0,1,0,1,0,0|0,0,1]=3 274 B18R3.11551 O=C1OC(C2=C1C=CC=C2)C3=CC=CC=C3 S541486 [0,1,0,1,0,0|0,0,1]=3 275 B18R3.11551 OC1OC(C2=C1C=CC=C2)C3=CC=CC=C3 PH008371 [0,1,0,1,0,0|0,0,0]=2 276 B18R3.112707 O=C1OCC2=CC=CC=C2C3=CC=CC=C13 S882720 [0,1,0,1,0,0|0,0,1]=3 277 B18R4.11 C1=CC2=C(C=C1)C3CC2C4=C3C=CC=C4 T206741 [0,0,0,2,0,0|1,0,0]=3 278 B14R2.6 C1=CC=C(C=C1)NC2=CC=NC=C2 PH011175 [0,0,0,0,2,0|2,0,0]=4 279 B14R2.6 C1=CC=C(C=C1)NC2=NC=CC=C2 PH006857 [0,0,0,0,2,0|2,0,0]=4 280 B14R2.6 C1=CC=C(C=C1)OC2=CC=NC=C2 CDS000196 [0,0,0,0,2,0|1,0,0]=3 281 B14R2.6 C1=CC=C(C=C1)OC2=CN=CC=C2 CDS020813 [0,0,0,0,2,0|1,0,0]=3 282 B14R2.6 C1=CC=C(C=C1)SC2=CC=NC=C2 PH000187 [0,0,0,0,2,0|1,1,0]=4 283 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 R751766 [0,0,0,0,2,0|1,0,0]=3 284 B14R2.6 C1=CC=[N+](C=C1)CC2=NC=CC=C2 S869686 [0,0,0,0,2,0|2,0,0]=4 285 B14R2.6 C1=CC=[N+](C=C1)C[N+]2=CC=CC=C2 S196355 [0,0,0,0,2,0|2,0,0]=4 286 B14R2.6 C1=CC=[N+](C=C1)C[N+]2=CC=CC=C2 S24296 [0,0,0,0,2,0|2,0,0]=4 287 B14R2.6 [NH+]1=CC=C(C=C1)CC2=CC=CC=C2 R945021 [0,0,0,0,2,0|1,0,0]=3 288 B14R2.6 [SnH2](C1=CC=CC=C1)C2=CC=CC=C2 S825905 [0,0,0,0,2,0|1,0,0]=3 289 B14R2.101 C1=CC=C(C=C1)OCC2=COC=C2 T208663 [0,0,0,0,2,0|1,0,0]=3 290 B18R2.2525 C1=CC=C(C=C1)C/N=C/NCC2=CC=CC=C2 PH007266 [0,0,0,0,0,2|1,0,0]=3 291 B18R2.2525 C1=CC=C(C=C1)CCNCCC2=CC=CC=C2 PH003668 [0,0,0,0,0,2|1,0,0]=3 292 B18R2.2525 C1=CC=C(C=C1)CCON=CC2=CC=NC=C2 S355151 [0,0,0,0,0,2|1,0,1]=4 293 B18R2.2525 C1=CC=C(C=C1)CCON=CC2=CN=CC=C2 S355143 [0,0,0,0,0,2|1,0,1]=4 294 B18R2.2525 C1=CC=C(C=C1)CNCNCC2=CC=CC=C2 R465402 [0,0,0,0,0,2|1,0,0]=3 295 B18R2.2525 C1=CC=C(C=C1)COCOCC2=CC=CC=C2 PH007300 [0,0,0,0,0,2|0,0,0]=2 296 B18R2.2525 C1=CC=C(C=C1)OCCCOC2=CC=CN=C2 PH013568 [0,0,0,0,0,2|2,0,0]=4 297 B18R2.2525 C1=CC=C(C=C1)OCOCOC2=CC=CC=C2 S809853 [0,0,0,0,0,2|0,0,0]=2 298 B18R2.2525 [SiH2](CCCC1=CC=CC=C1)CC2=CC=CC=C2 S833630 [0,0,0,0,0,2|1,0,0]=3