0 B16R2.2256 C1=CC=C(CNCC2=CC=NC=C2)C=C1 71440 [0,0,0,0,0,0|2,0,0]=2 1 B16R2.2256 C1=CC=C(CNCC2=NC=CC=C2)C=C1 71439 [0,0,0,0,0,0|2,0,0]=2 2 B17R2.143 O=C(CC1=CC=CC=C1)NC2=CC=CC=C2 C10418 [0,1,0,0,0,0|2,0,0]=3 3 B17R2.216 FC1=CC=C(CNCC2=CC=CC=C2)C=C1 W18469 [0,1,0,0,0,0|1,0,0]=2 4 B17R2.2342 CC(C=CC1=CC=CC=C1)C2=CC=CC=C2 D93566 [0,1,0,0,0,0|1,0,1]=3 5 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CN=CC=C2 D77312 [0,1,0,0,0,0|1,0,1]=3 6 B17R2.5301 ClC1=NC=NC(COCC2=CC=CC=C2)=C1 78038 [0,1,0,0,0,0|2,0,0]=3 7 B17R3.8 C1=CC=C(C2=CNC3=C2C=CC=C3)C=C1 Y13578 [0,0,0,1,0,0|2,0,1]=4 8 B17R3.8 C1=CC=C(C2=NNC3=C2C=CC=C3)C=C1 C72228 [0,0,0,1,0,0|2,0,1]=4 9 B17R3.8 C1=CC=C(N2C=CC3=C2C=CC=C3)C=C1 35182 [0,0,0,1,0,0|2,0,1]=4 10 B17R3.8 C1=CC=C(N2C=NC3=C2C=CC=C3)C=C1 65288 [0,0,0,1,0,0|3,0,0]=4 11 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 E70421 [0,0,0,0,1,0|1,0,0]=2 12 B15R2.2195 C1=CC=C(COC2=CN=CC=C2)C=C1 W19145 [0,0,0,0,1,0|1,0,0]=2 13 B15R2.2195 C1=CC=C(SSC2=CC=CC=C2)C=C1 D72521 [0,0,0,0,1,0|1,1,0]=3 14 B15R2.2195 C1=CC=C([Te][Te]C2=CC=CC=C2)C=C1 T70770 [0,0,0,0,1,0|1,1,0]=3 15 B15R2.2195 C1=CC=C(\C=C\C2=CC=NC=C2)C=C1 F17039 [0,0,0,0,1,0|1,0,2]=4 16 B15R2.2196 C1=CC=C(CNCC2=CN=CN2)C=C1 W11631 [0,0,0,0,1,0|3,0,0]=4 17 B15R2.2196 C1=CC=C(CNCC2=NNC=C2)C=C1 W11637 [0,0,0,0,1,0|3,0,0]=4 18 B17R2.2382 C1=CC=C(CSSCC2=CC=CC=C2)C=C1 D77707 [0,0,0,0,0,1|0,1,0]=2 19 B16R2.71 ClC1=NC=NC=C1OCC2=CC=CC=C2 C77104 [0,1,0,0,1,0|2,0,0]=4 20 B16R2.71 FC1=C(OCC2=CC=CC=C2)C=CC=C1 C74898 [0,1,0,0,1,0|0,0,0]=2 21 B16R2.71 IC1=C(OCC2=CC=CC=C2)C=CC=C1 C11685 [0,1,0,0,1,0|0,0,0]=2 22 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=CC=C2 C75880 [0,1,0,0,1,0|1,0,0]=3 23 B16R2.88 C[C@H](NC1=CC=CC=C1)C2=CC=CN=C2 F31241 [0,1,0,0,1,0|2,0,0]=4 24 B16R2.88 O=C(CC1=CC=CC=C1)C2=NC=CC=C2 28067 [0,1,0,0,1,0|1,0,1]=4 25 B16R2.88 [O-]\[N+](=C/C1=CC=CC=C1)C2=CC=CC=C2 A11906 [0,1,0,0,1,0|1,0,1]=4 26 B16R2.132 BrC1=CC=C(COC2=NC=CC=C2)C=C1 W18684 [0,1,0,0,1,0|1,0,0]=3 27 B16R2.132 BrC1=CC=C(CSC2=CC=CC=C2)C=C1 A12827 [0,1,0,0,1,0|0,1,0]=3 28 B16R2.132 BrC1=NC=C(OCC2=CC=CC=C2)C=C1 42461 [0,1,0,0,1,0|1,0,0]=3 29 B16R2.132 BrC1=NC=C(OCC2=NC=CC=C2)C=C1 96180 [0,1,0,0,1,0|2,0,0]=4 30 B16R2.132 CC1=NC=C(OCC2=CC=CC=C2)C=C1 AB6298 [0,1,0,0,1,0|1,0,0]=3 31 B16R2.132 ClC1=CC=C(\C=N\C2=CC=CC=C2)C=C1 D79438 [0,1,0,0,1,0|1,0,1]=4 32 B16R2.132 NC1=CC=C(COC2=CC=CC=C2)C=C1 F11770 [0,1,0,0,1,0|0,0,0]=2 33 B16R2.132 NC1=CC=C(OCC2=NC=CC=C2)C=C1 68839 [0,1,0,0,1,0|1,0,0]=3 34 B16R2.132 NC1=CC=C(\C=C\C2=CC=CC=C2)C=C1 D88339 [0,1,0,0,1,0|0,0,2]=4 35 B16R2.132 NC1=NC=C(OCC2=CC=CC=C2)C=C1 26563 [0,1,0,0,1,0|1,0,0]=3 36 B16R2.132 NC1=NC=C(OCC2=CC=CC=C2)C=C1 C77322 [0,1,0,0,1,0|1,0,0]=3 37 B16R2.252 CC1=CC(SCC2=CC=CC=C2)=CN=C1 C13279 [0,1,0,0,1,0|1,1,0]=4 38 B16R2.252 ClC1=NC(OCC2=CC=CC=C2)=CC=N1 C71311 [0,1,0,0,1,0|2,0,0]=4 39 B16R2.252 ClC1=NC(OCC2=CC=NC=C2)=CC=C1 A11931 [0,1,0,0,1,0|2,0,0]=4 40 B16R2.252 ClC1=NC=CC(OCC2=CC=CC=C2)=C1 AB10213 [0,1,0,0,1,0|1,0,0]=3 41 B16R2.252 ClC1=NN=CC(OCC2=CC=CC=C2)=C1 O11295 [0,1,0,0,1,0|2,0,0]=4 42 B16R2.252 FC1=NC=CC(OCC2=CC=CC=C2)=C1 C71999 [0,1,0,0,1,0|1,0,0]=3 43 B16R2.252 IC1=CC(OCC2=CC=CC=C2)=NC=C1 N13119 [0,1,0,0,1,0|1,0,0]=3 44 B16R2.252 NC1=CC(C#CC2=CC=CC=C2)=CC=C1 W18181 [0,1,0,0,1,0|0,0,2]=4 45 B16R2.252 NC1=CC(OCC2=CC=CC=C2)=NC=C1 91730 [0,1,0,0,1,0|1,0,0]=3 46 B16R2.252 O=C1C=C(OCC2=CC=CC=C2)C=NN1 AC2006 [0,1,0,0,1,0|2,0,0]=4 47 B18R2.7189 O[C@@H](CNCC1=CC=CC=C1)C2=CC=CC=C2 FD1196 [0,1,0,0,0,1|1,0,0]=3 48 B18R2.199 O=NN(CC1=CC=CC=C1)CC2=CC=CC=C2 D93482 [0,2,0,0,0,0|1,0,0]=3 49 B18R2.7204 CC(OC1=CC=CC=C1)C(O)C2=CC=CC=C2 C74512 [0,2,0,0,0,0|2,0,0]=4 50 B18R2.32233 C[N+](C)(CC1=CC=CC=C1)CC2=CC=CC=C2 D92817 [0,2,0,0,0,0|1,0,0]=3 51 B18R2.253 CC1=CC=C(C(=O)OCC2=CC=CC=C2)C=C1 A11094 [0,2,0,0,0,0|0,0,1]=3 52 B18R2.253 NC1=CC=C(C(=O)OCC2=CC=CC=C2)C=C1 21144 [0,2,0,0,0,0|0,0,1]=3 53 B18R2.253 O=C(CCC1=CC=CC=C1)C2=CC=C(Cl)C=C2 N10438 [0,2,0,0,0,0|1,0,1]=4 54 B18R2.274 BrC1=CC=C(CNCC2=CC=C(Br)C=C2)C=C1 T70644 [0,2,0,0,0,0|1,0,0]=3 55 B18R2.3634 C[C@H](N[C@@H](C)C1=CC=CC=C1)C2=CC=CC=C2 A12863 [0,2,0,0,0,0|1,0,0]=3 56 B18R2.3634 C[C@H](N[C@@H](C)C1=CC=CC=C1)C2=CC=CC=C2 T70889 [0,2,0,0,0,0|1,0,0]=3 57 B18R2.4001 NC1=C(C(=O)OCC2=CC=CC=C2)C=CC=C1 A12861 [0,2,0,0,0,0|0,0,1]=3 58 B18R2.6463 NC1=CC=CC(C(=O)NCC2=CC=CC=C2)=C1 F20160 [0,2,0,0,0,0|1,0,1]=4 59 B18R2.6463 O=C(OCC1=CC=CC=C1)C2=CC(O)=CC=C2 76477 [0,2,0,0,0,0|0,0,1]=3 60 B18R2.6482 ClC1=CC=CC(CNCC2=CC=CC(Cl)=C2)=C1 T70191 [0,2,0,0,0,0|1,0,0]=3 61 B18R3.2098 C1=CC=C(CC2=NNC3=C2C=CC=C3)C=C1 C75220 [0,0,0,1,0,1|2,0,0]=4 62 B18R3.2098 C1=CC=C(CN2N=NC3=C2C=CC=C3)C=C1 C75250 [0,0,0,1,0,1|2,0,0]=4 63 B18R3.2108 C1=CC=C(C2=NCCC3=C2C=CC=C3)C=C1 F20642 [0,0,0,1,0,1|1,0,1]=4 64 B18R3.182 O=C1NC2=C(C=CC=C2)[C@@H]1C3=CC=CC=C3 Y13508 [0,1,0,1,0,0|2,0,0]=4 65 B18R3.2123 C1=CC=C(N2CCC3=C(C=CC=C3)C2)C=C1 D82937 [0,1,0,1,0,0|2,0,0]=4 66 B14R2.6 C1=CC=C(NC2=CC=CC=C2)C=C1 T70381 [0,0,0,0,2,0|1,0,0]=3 67 B14R2.6 C1=CC=C(NC2=CC=CN=C2)C=C1 A11249 [0,0,0,0,2,0|2,0,0]=4 68 B14R2.6 C1=CC=C(NC2=CC=NC=C2)C=C1 T70602 [0,0,0,0,2,0|2,0,0]=4 69 B14R2.6 C1=CC=C(OC2=CN=CC=C2)C=C1 BL000092 [0,0,0,0,2,0|1,0,0]=3 70 B14R2.6 C1=CC=C(OC2=NC=CC=C2)C=C1 W13856 [0,0,0,0,2,0|1,0,0]=3 71 B14R2.6 C1=CC=C(PC2=CC=CC=C2)C=C1 F14999 [0,0,0,0,2,0|1,0,0]=3 72 B14R2.6 C1=CC=C([I+]C2=CC=CC=C2)C=C1 S11853 [0,0,0,0,2,0|1,0,0]=3 73 B14R2.6 C1=CC=C([SnH4+2]C2=CC=CC=C2)C=C1 T70532 [0,0,0,0,2,0|1,0,0]=3 74 B14R2.6 C1=CN=C(CC2=NC=CC=C2)C=C1 D82134 [0,0,0,0,2,0|2,0,0]=4 75 B14R2.6 C1=CN=CC(CC2=CN=CC=C2)=C1 W13166 [0,0,0,0,2,0|2,0,0]=4 76 B14R2.101 C1=CC=C(CON2C=CN=C2)C=C1 75111 [0,0,0,0,2,0|2,0,0]=4