0 B15R2.2226 BrC(C1=CC=CC=C1)C2=CC=CC=C2 075976 [0,0,0,0,0,0|1,0,1]=2 1 B15R2.2226 C=C(C1=CC=CC=C1)C2=CC=CC=C2 461612 [0,0,0,0,0,0|1,0,0]=1 2 B15R2.2226 ClC(C1=CC=CC=C1)C2=CC=CC=C2 075977 [0,0,0,0,0,0|1,0,1]=2 3 B15R2.2226 ClP(C1=CC=CC=C1)C2=CC=CC=C2 050109 [0,0,0,0,0,0|2,0,0]=2 4 B15R2.2226 Cl[SiH](C1=CC=CC=C1)C2=CC=CC=C2 S07725 [0,0,0,0,0,0|1,1,0]=2 5 B15R2.2226 N=C(C1=CC=CC=C1)C2=CC=CC=C2 092251 [0,0,0,0,0,0|1,0,0]=1 6 B15R2.2226 NC(C1=CC=CC=C1)C2=CC=CC=C2 021524 [0,0,0,0,0,0|1,0,1]=2 7 B15R2.2226 NN(C1=CC=CC=C1)C2=CC=CC=C2 241835 [0,0,0,0,0,0|2,0,0]=2 8 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=CC=C2 097621 [0,0,0,0,0,0|0,0,0]=0 9 B15R2.2226 O=C(C1=CC=CC=C1)C2=CC=NC=C2 237782 [0,0,0,0,0,0|1,0,0]=1 10 B15R2.2226 O=C(C1=CC=CC=C1)C2=NC=CC=C2 202520 [0,0,0,0,0,0|1,0,0]=1 11 B15R2.2226 O=C(C1=NC=CC=C1)C2=NC=CC=C2 070063 [0,0,0,0,0,0|2,0,0]=2 12 B15R2.2226 O=S(C1=CC=CC=C1)C2=CC=CC=C2 078965 [0,0,0,0,0,0|1,0,0]=1 13 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=CC=C2 227720 [0,0,0,0,0,0|0,0,2]=2 14 B15R2.2226 OC(C1=CC=CC=C1)C2=CC=NC=C2 325091 [0,0,0,0,0,0|1,0,2]=3 15 B14R2.6 C1=CC=C(CC2=CC=CC=C2)C=C1 235562 [1,0,0,0,0,0|0,0,1]=2 16 B14R2.6 C1=CC=C(CC2=CC=NC=C2)C=C1 336040 [1,0,0,0,0,0|1,0,1]=3 17 B14R2.6 C1=CC=C(CC2=NC=CC=C2)C=C1 095088 [1,0,0,0,0,0|1,0,1]=3 18 B14R2.6 C1=CC=C(NC2=CC=CC=C2)C=C1 099691 [1,0,0,0,0,0|1,0,0]=2 19 B14R2.6 C1=CC=C(NC2=CC=CC=C2)C=C1 136000 [1,0,0,0,0,0|1,0,0]=2 20 B14R2.6 C1=CC=C(NC2=NC=CC=C2)C=C1 322026 [1,0,0,0,0,0|2,0,0]=3 21 B14R2.6 C1=CC=C(OC2=CC=CC=C2)C=C1 099314 [1,0,0,0,0,0|1,0,0]=2 22 B14R2.6 C1=CC=C(OC2=CC=CC=C2)C=C1 099338 [1,0,0,0,0,0|1,0,0]=2 23 B14R2.6 C1=CC=C(PC2=CC=CC=C2)C=C1 050092 [1,0,0,0,0,0|1,0,0]=2 24 B14R2.6 C1=CC=C(PC2=CC=CC=C2)C=C1 107014 [1,0,0,0,0,0|1,0,0]=2 25 B14R2.6 C1=CC=C(SC2=CC=CC=C2)C=C1 098931 [1,0,0,0,0,0|1,0,0]=2 26 B14R2.6 C1=CC=C(SC2=CC=CC=C2)C=C1 104588 [1,0,0,0,0,0|1,0,0]=2 27 B14R2.6 C1=CC=C([SiH2]C2=CC=CC=C2)C=C1 005285 [1,0,0,0,0,0|0,1,0]=2 28 B14R2.6 C1=CN=C(NC2=NC=CC=C2)C=C1 329505 [1,0,0,0,0,0|3,0,0]=4 29 B16R2.120 CC1=CC=C(C(=O)C2=CC=CC=C2)C=C1 079256 [0,1,0,0,0,0|0,0,0]=1 30 B16R2.120 CC1=CC=C(C(O)C2=CC=CC=C2)C=C1 240968 [0,1,0,0,0,0|0,0,2]=3 31 B16R2.120 ClC1=CC=C(C(Cl)C2=CC=CC=C2)C=C1 222381 [0,1,0,0,0,0|1,0,1]=3 32 B16R2.120 NC(C1=CC=CC=C1)C2=CC=C(Cl)C=C2 319913 [0,1,0,0,0,0|1,0,1]=3 33 B16R2.120 NC1=CC=C(C(=O)C2=CC=CC=C2)C=C1 092544 [0,1,0,0,0,0|0,0,0]=1 34 B16R2.120 O=C(C1=CC=C(Cl)C=C1)C2=NC=CC=C2 202535 [0,1,0,0,0,0|1,0,0]=2 35 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(Br)C=C2 201611 [0,1,0,0,0,0|0,0,0]=1 36 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(Cl)C=C2 217127 [0,1,0,0,0,0|0,0,0]=1 37 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(F)C=C2 003845 [0,1,0,0,0,0|0,0,0]=1 38 B16R2.120 O=C(C1=CC=CC=C1)C2=CC=C(O)C=C2 046143 [0,1,0,0,0,0|0,0,0]=1 39 B16R2.120 OC(C1=CC=CC=C1)C2=CC=C(Br)C=C2 018245 [0,1,0,0,0,0|0,0,2]=3 40 B16R2.120 OC(C1=CC=CC=C1)C2=CC=C(Cl)C=C2 242819 [0,1,0,0,0,0|0,0,2]=3 41 B16R2.120 OC(C1=CC=CC=C1)C2=CC=C(F)C=C2 024615 [0,1,0,0,0,0|0,0,2]=3 42 B16R2.187 CN=C(C1=CC=CC=C1)C2=CC=CC=C2 011430 [0,1,0,0,0,0|1,0,0]=2 43 B16R2.187 N#CC(C1=CC=CC=C1)C2=CC=CC=C2 135980 [0,1,0,0,0,0|1,0,1]=3 44 B16R2.187 N#CC(C1=CC=CC=C1)C2=NC=CC=C2 239296 [0,1,0,0,0,0|2,0,1]=4 45 B16R2.187 NCC(C1=CC=CC=C1)C2=CC=CC=C2 075955 [0,1,0,0,0,0|1,0,1]=3 46 B16R2.187 NN=C(C1=CC=CC=C1)C2=CC=CC=C2 001100 [0,1,0,0,0,0|1,0,0]=2 47 B16R2.187 O=CN(C1=CC=CC=C1)C2=CC=CC=C2 099049 [0,1,0,0,0,0|1,0,0]=2 48 B16R2.187 O=NN(C1=CC=CC=C1)C2=CC=CC=C2 102855 [0,1,0,0,0,0|1,0,0]=2 49 B16R2.187 O\N=C(/C1=CC=CC=N1)C2=NC=CC=C2 097982 [0,1,0,0,0,0|2,0,1]=4 50 B16R2.236 O=C(C1=CC=CC=C1)C2=CC=CC(Br)=C2 022813 [0,1,0,0,0,0|0,0,0]=1 51 B16R2.236 O=C(C1=CC=CC=C1)C2=CC=CC(F)=C2 024623 [0,1,0,0,0,0|0,0,0]=1 52 B16R2.236 OC(C1=CC=CC=C1)C2=CC(Cl)=CC=C2 022419 [0,1,0,0,0,0|0,0,2]=3 53 B16R2.236 OC(C1=CC=CC=C1)C2=CC(F)=CC=C2 022429 [0,1,0,0,0,0|0,0,2]=3 54 B16R2.2945 CC(O)(C1=CC=CC=C1)C2=NC=CC=C2 223180 [0,1,0,0,0,0|1,0,2]=4 55 B16R2.2945 C[Si](C)(C1=CC=CC=C1)C2=CC=CC=C2 005284 [0,1,0,0,0,0|1,1,0]=3 56 B16R2.2945 C[Si](Cl)(C1=CC=CC=C1)C2=CC=CC=C2 S07950 [0,1,0,0,0,0|1,1,0]=3 57 B16R2.2945 ClC(Cl)(C1=CC=CC=C1)C2=CC=CC=C2 235569 [0,1,0,0,0,0|1,0,1]=3 58 B16R2.2945 Cl[Si](Cl)(C1=CC=CC=C1)C2=CC=CC=C2 005932 [0,1,0,0,0,0|1,1,0]=3 59 B16R2.2945 F[Si](F)(C1=CC=CC=C1)C2=CC=CC=C2 S07850 [0,1,0,0,0,0|1,1,0]=3 60 B16R2.2945 O=P(Cl)(C1=CC=CC=C1)C2=CC=CC=C2 033690 [0,1,0,0,0,0|1,0,0]=2 61 B16R2.2945 O=P(O)(C1=CC=CC=C1)C2=CC=CC=C2 386701 [0,1,0,0,0,0|1,0,0]=2 62 B16R2.2945 O=S(=O)(C1=CC=CC=C1)C2=CC=CC=C2 241365 [0,1,0,0,0,0|1,0,0]=2 63 B16R2.2945 O[Si](O)(C1=CC=CC=C1)C2=CC=CC=C2 S08075 [0,1,0,0,0,0|0,1,1]=3 64 B16R2.3896 NC1=C(C(=O)C2=CC=CC=C2)C=CC=C1 044667 [0,1,0,0,0,0|0,0,0]=1 65 B16R2.3896 NC1=CC=CC=C1C(=O)C2=CC=CC=N2 011081 [0,1,0,0,0,0|1,0,0]=2 66 B16R2.3896 NC1=CC=CC=C1C(O)C2=CC=CC=C2 018171 [0,1,0,0,0,0|0,0,2]=3 67 B16R2.3896 O=C(C1=CC=CC=C1)C2=CC=CC=C2Br 018246 [0,1,0,0,0,0|0,0,0]=1 68 B16R2.3896 O=C(C1=CC=CC=C1)C2=CC=CC=C2F 003865 [0,1,0,0,0,0|0,0,0]=1 69 B16R2.3896 O=C(C1=CC=CC=C1)C2=CC=CC=C2I 018737 [0,1,0,0,0,0|0,0,0]=1 70 B16R2.3896 O=C(C1=CC=CC=C1)C2=CC=CC=C2O 324908 [0,1,0,0,0,0|0,0,0]=1 71 B16R3.20606 BrC1C2=CC=CC=C2C3=C1C=CC=C3 BR1273 [0,0,0,1,0,0|1,0,1]=3 72 B16R3.20606 CN1C2=C(C=CC=C2)C3=C1C=CC=C3 471870 [0,0,0,1,0,0|2,0,0]=3 73 B16R3.20606 NC1C2=C(C=CC=C2)C3=C1C=CC=C3 065053 [0,0,0,1,0,0|1,0,1]=3 74 B16R3.20606 NN1C2=C(C=CC=C2)C3=C1C=CC=C3 243766 [0,0,0,1,0,0|2,0,0]=3 75 B16R3.20606 O=C1C2=C(C=CC=C2)C3=C1C=CC=C3 095005 [0,0,0,1,0,0|0,0,0]=1 76 B16R3.20606 OC1C2=CC=CC=C2C3=C1C=CC=C3 008846 [0,0,0,1,0,0|0,0,2]=3 77 B14R2.114 O=C(C1=CC=CC=C1)C2=CC=CN2 185371 [0,0,0,0,1,0|1,0,0]=2 78 B14R2.114 O=C(C1=CC=CC=C1)N2C=CN=C2 003799 [0,0,0,0,1,0|2,0,0]=3 79 B16R2.88 NC(CC1=CC=CC=C1)C2=CC=CC=C2 358146 [0,0,0,0,0,1|1,0,1]=3 80 B16R2.88 O=C(CC1=CC=CC=C1)C2=CC=CC=C2 022896 [0,0,0,0,0,1|0,0,0]=1 81 B16R2.88 O=C(CC1=CC=NC=N1)C2=CC=CC=C2 023538 [0,0,0,0,0,1|2,0,0]=3 82 B16R2.88 O=C(C[N+]1=CC=CC=C1)C2=CC=CC=C2 182115 [0,0,0,0,0,1|1,0,0]=2 83 B16R2.88 O=C(NC1=CC=CC=C1)C2=CC=CC=C2 242653 [0,0,0,0,0,1|0,0,0]=1 84 B16R2.88 O=C(OC1=CC=CC=C1)C2=CC=CC=C2 239029 [0,0,0,0,0,1|0,0,0]=1 85 B16R2.88 OC(CC1=CC=CC=C1)C2=CC=CC=C2 104279 [0,0,0,0,0,1|0,0,2]=3 86 B15R2.29 BrC1=CC=C(CC2=CC=CC=C2)C=C1 018275 [1,1,0,0,0,0|0,0,1]=3 87 B15R2.29 BrC1=CC=C(OC2=CC=CC=C2)C=C1 048752 [1,1,0,0,0,0|1,0,0]=3 88 B15R2.29 CC1=CC=C(CC2=CC=CC=C2)C=C1 018834 [1,1,0,0,0,0|0,0,1]=3 89 B15R2.29 ClC1=CC=C(OC2=CC=CC=C2)C=C1 002531 [1,1,0,0,0,0|1,0,0]=3 90 B15R2.29 FC1=CC=C(CC2=CC=CC=C2)C=C1 009194 [1,1,0,0,0,0|0,0,1]=3 91 B15R2.29 FC1=CC=C(OC2=CC=CC=C2)C=C1 006228 [1,1,0,0,0,0|1,0,0]=3 92 B15R2.29 IC1=CC=C(CC2=CC=CC=C2)C=C1 018742 [1,1,0,0,0,0|0,0,1]=3 93 B15R2.29 IC1=CC=C(OC2=CC=CC=C2)C=C1 148100 [1,1,0,0,0,0|1,0,0]=3 94 B15R2.29 NC1=CC=C(CC2=CC=CC=C2)C=C1 018207 [1,1,0,0,0,0|0,0,1]=3 95 B15R2.29 NC1=CC=C(NC2=CC=CC=C2)C=C1 216681 [1,1,0,0,0,0|1,0,0]=3 96 B15R2.29 NC1=CC=C(OC2=CC=CC=C2)C=C1 306905 [1,1,0,0,0,0|1,0,0]=3 97 B15R2.29 OC1=CC=C(CC2=CC=CC=C2)C=C1 012743 [1,1,0,0,0,0|0,0,1]=3 98 B15R2.29 OC1=CC=C(OC2=CC=CC=C2)C=C1 241010 [1,1,0,0,0,0|1,0,0]=3 99 B15R2.29 SC1=CC=C(OC2=CC=CC=C2)C=C1 023076 [1,1,0,0,0,0|1,0,0]=3 100 B15R2.31 CC1=CC=CC(OC2=CC=CC=C2)=C1 223084 [1,1,0,0,0,0|1,0,0]=3 101 B15R2.31 CC1=NC=CC(CC2=CC=CC=C2)=C1 180495 [1,1,0,0,0,0|1,0,1]=4 102 B15R2.31 ClC1=CC(NC2=CC=CC=C2)=CC=C1 234016 [1,1,0,0,0,0|1,0,0]=3 103 B15R2.31 NC1=CC=CC(CC2=CC=CC=C2)=C1 018206 [1,1,0,0,0,0|0,0,1]=3 104 B15R2.31 OC1=CC=CC(OC2=CC=CC=C2)=C1 050962 [1,1,0,0,0,0|1,0,0]=3 105 B15R2.38 BrC1=CC=CC=C1CC2=CC=CC=C2 018274 [1,1,0,0,0,0|0,0,1]=3 106 B15R2.38 CC1=CC=CC=C1CC2=CC=CC=C2 018833 [1,1,0,0,0,0|0,0,1]=3 107 B15R2.38 CC1=CC=CN=C1NC2=CC=CC=C2 180502 [1,1,0,0,0,0|2,0,0]=4 108 B15R2.38 FC1=C(CC2=CC=CC=C2)C=CC=C1 006229 [1,1,0,0,0,0|0,0,1]=3 109 B15R2.38 FC1=CC=CC=C1OC2=CC=CC=C2 001609 [1,1,0,0,0,0|1,0,0]=3 110 B15R2.38 NC1=C(CC2=CC=CC=C2)C=CC=C1 024215 [1,1,0,0,0,0|0,0,1]=3 111 B15R2.38 NC1=C(SC2=CC=CC=C2)C=CC=C1 459647 [1,1,0,0,0,0|1,0,0]=3 112 B15R2.38 NC1=CC=CC=C1NC2=CC=CC=C2 050460 [1,1,0,0,0,0|1,0,0]=3 113 B15R2.38 NC1=CC=CC=C1OC2=CC=CC=C2 080294 [1,1,0,0,0,0|1,0,0]=3 114 B15R2.38 NC1=[N+](CC2=CC=CC=C2)C=CC=C1 181034 [1,1,0,0,0,0|1,0,1]=4 115 B15R2.38 OC1=CC=CC=C1CC2=CC=CC=C2 219277 [1,1,0,0,0,0|0,0,1]=3 116 B15R2.131 O\N=C(/C1=CC=CC=C1)C2=CC=CN2 099673 [0,1,0,0,1,0|1,0,1]=4 117 B15R2.353 O=S(=O)(C1=CC=CC=C1)N2C=CC=C2 013695 [0,1,0,0,1,0|2,0,0]=4 118 B17R2.192 CC1=CC=C(C(=O)NC2=CC=CC=C2)C=C1 180872 [0,1,0,0,0,1|0,0,0]=2 119 B17R2.192 O=C(CC1=CC=CC=C1)C2=CC=C(Cl)C=C2 022848 [0,1,0,0,0,1|0,0,0]=2 120 B17R2.192 O=C(CC1=CC=CC=C1)C2=CC=C(O)C=C2 103212 [0,1,0,0,0,1|0,0,0]=2 121 B17R2.192 O=C(OC1=CC=CC=C1)C2=CC=C(O)C=C2 018964 [0,1,0,0,0,1|0,0,0]=2 122 B17R2.209 CC1=CC=C(NC(=O)C2=CC=CC=C2)C=C1 060782 [0,1,0,0,0,1|0,0,0]=2 123 B17R2.209 O=C(NC1=CC=C(Br)C=C1)C2=CC=CC=C2 060781 [0,1,0,0,0,1|0,0,0]=2 124 B17R2.209 O=C(NC1=CC=C(Cl)C=C1)C2=CC=CC=C2 181245 [0,1,0,0,0,1|0,0,0]=2 125 B17R2.3417 CC1=C(C(=O)NC2=CC=CC=C2)C=CC=C1 180875 [0,1,0,0,0,1|0,0,0]=2 126 B17R2.3426 O=C(CN1C=CC=CC1=O)C2=CC=CC=C2 180910 [0,1,0,0,0,1|1,0,0]=3 127 B17R2.5293 CC1=CC(NC(=O)C2=CC=NC=C2)=NC=C1 024715 [0,1,0,0,0,1|2,0,0]=4 128 B17R2.5293 O=C1N=C(NC(=O)C2=CC=CC=C2)C=CN1 210922 [0,1,0,0,0,1|2,0,0]=4 129 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@@H](N)C2=CC=CC=C2 011709 [0,1,0,0,0,1|1,0,1]=4 130 B17R2.10205 N[C@@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 036819 [0,1,0,0,0,1|0,0,2]=4 131 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 048051 [0,1,0,0,0,1|0,0,2]=4 132 B17R2.10205 N[C@H](C1=CC=CC=C1)[C@H](N)C2=CC=CC=C2 011708 [0,1,0,0,0,1|1,0,1]=4 133 B17R2.10205 O=C(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 098812 [0,1,0,0,0,1|0,0,0]=2 134 B17R2.10205 O=C(C(=O)C1=NC=CC=C1)C2=NC=CC=C2 099273 [0,1,0,0,0,1|2,0,0]=4 135 B17R2.10205 O=C(C1=CC=CC=C1)C(Br)C2=CC=CC=C2 212634 [0,1,0,0,0,1|0,0,0]=2 136 B17R2.10205 O=C(C1=CC=CC=C1)C(Cl)C2=CC=CC=C2 358265 [0,1,0,0,0,1|0,0,0]=2 137 B17R2.10205 O=C(C1=CC=CC=C1)C(O)C2=CC=CC=C2 235660 [0,1,0,0,0,1|0,0,0]=2 138 B17R2.10205 O[C@@H](C1=CC=CC=C1)[C@@H](O)C2=CC=CC=C2 454959 [0,1,0,0,0,1|0,0,2]=4 139 B17R2.10205 O[C@H](C1=CC=CC=C1)[C@H](O)C2=CC=CC=C2 078920 [0,1,0,0,0,1|0,0,2]=4 140 B17R2.20249 O=S(=O)(CC1=CC=CC=C1)C2=CC=CC=C2 003667 [0,1,0,0,0,1|1,0,0]=3 141 B17R2.68 COC1=CC=C(C(=O)C2=CC=CC=C2)C=C1 201573 [0,2,0,0,0,0|0,0,0]=2 142 B17R2.68 O=C(C1=CC=CC=C1)C2=CC=C(CBr)C=C2 212635 [0,2,0,0,0,0|0,0,0]=2 143 B17R2.191 OC(C1=CC=C(Cl)C=C1)C2=CC(F)=CC=C2 022465 [0,2,0,0,0,0|0,0,2]=4 144 B17R2.203 CC(C)(C1=CC=CC=C1)C2=CC=C(O)C=C2 094614 [0,2,0,0,0,0|1,0,1]=4 145 B17R2.203 NC1=CC=C(S(=O)(=O)C2=CC=CC=C2)C=C1 019288 [0,2,0,0,0,0|1,0,0]=3 146 B17R2.203 O=S(=O)(C1=CC=CC=C1)C2=CC=C(Br)C=C2 222956 [0,2,0,0,0,0|1,0,0]=3 147 B17R2.203 O=S(=O)(C1=CC=CC=C1)C2=CC=C(Cl)C=C2 008030 [0,2,0,0,0,0|1,0,0]=3 148 B17R2.217 C(O)(C1=CC=C(F)C=C1)C2=CC=C(F)C=C2 002691 [0,2,0,0,0,0|0,0,2]=4 149 B17R2.217 CC1=CC=C(C(O)C2=CC=C(C)C=C2)C=C1 018608 [0,2,0,0,0,0|0,0,2]=4 150 B17R2.217 O=C(C1=CC=C(Br)C=C1)C2=CC=C(Br)C=C2 201469 [0,2,0,0,0,0|0,0,0]=2 151 B17R2.217 O=C(C1=CC=C(Cl)C=C1)C2=CC=C(Br)C=C2 022809 [0,2,0,0,0,0|0,0,0]=2 152 B17R2.217 O=C(C1=CC=C(Cl)C=C1)C2=CC=C(Cl)C=C2 201607 [0,2,0,0,0,0|0,0,0]=2 153 B17R2.217 O=C(C1=CC=C(F)C=C1)C2=CC=C(Br)C=C2 022818 [0,2,0,0,0,0|0,0,0]=2 154 B17R2.217 O=C(C1=CC=C(F)C=C1)C2=CC=C(F)C=C2 002692 [0,2,0,0,0,0|0,0,0]=2 155 B17R2.217 OC(C1=CC=C(Cl)C=C1)C2=CC=C(Cl)C=C2 241677 [0,2,0,0,0,0|0,0,2]=4 156 B17R2.219 NC1=CC=C(C(=O)C2=CC=CC=C2)C=C1N 242214 [0,2,0,0,0,0|0,0,0]=2 157 B17R2.219 OC(C1=CC=CC=C1)C2=CC(Cl)=C(F)C=C2 022416 [0,2,0,0,0,0|0,0,2]=4 158 B17R2.381 NC1=CC=CC=C1C(=O)C2=CC=C(Cl)C=C2 222487 [0,2,0,0,0,0|0,0,0]=2 159 B17R2.381 O=C(C1=CC=C(F)C=C1)C2=C(Cl)C=CC=C2 004435 [0,2,0,0,0,0|0,0,0]=2 160 B17R2.381 O=C(C1=CC=C(F)C=C1)C2=CC=CC=C2F 004784 [0,2,0,0,0,0|0,0,0]=2 161 B17R2.5362 CC1=CC(C)=C(C(=O)C2=CC=CC=C2)C=C1 358199 [0,2,0,0,0,0|0,0,0]=2 162 B17R2.5362 CC1=CC(N)=C(C(=O)C2=CC=CC=C2)C=C1 104308 [0,2,0,0,0,0|0,0,0]=2 163 B17R2.5362 O=C(C1=CC=CC=C1)C2=CC=C(F)C=C2F 001919 [0,2,0,0,0,0|0,0,0]=2 164 B17R2.159 BrCCC(C1=CC=CC=C1)C2=CC=CC=C2 041087 [0,2,0,0,0,0|1,0,1]=4 165 B17R2.159 CCOP(C1=CC=CC=C1)C2=CC=CC=C2 214896 [0,2,0,0,0,0|1,0,1]=4 166 B17R2.159 NCCC(C1=CC=CC=C1)C2=CC=CC=C2 243015 [0,2,0,0,0,0|1,0,1]=4 167 B17R2.159 O=C=NC(C1=CC=CC=C1)C2=CC=CC=C2 103874 [0,2,0,0,0,0|0,0,1]=3 168 B17R2.159 OCCC(C1=CC=CC=C1)C2=CC=CC=C2 049907 [0,2,0,0,0,0|0,0,2]=4 169 B17R2.159 S=C=NC(C1=CC=CC=C1)C2=CC=CC=C2 018194 [0,2,0,0,0,0|0,1,1]=4 170 B17R2.159 [NH3+]CCP(C1=CC=CC=C1)C2=CC=CC=C2 215595 [0,2,0,0,0,0|2,0,0]=4 171 B17R2.2712 C#CC(O)(C1=CC=CC=C1)C2=CC=CC=C2 136700 [0,2,0,0,0,0|0,0,2]=4 172 B17R2.2712 CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2 001097 [0,2,0,0,0,0|1,0,1]=4 173 B17R2.2712 CC(CN)(C1=CC=CC=C1)C2=CC=CC=C2 075301 [0,2,0,0,0,0|1,0,1]=4 174 B17R2.5711 CC(=O)N(C1=CC=CC=C1)C2=CC=CC=C2 099672 [0,2,0,0,0,0|1,0,0]=3 175 B17R2.5711 CN(C)C(C1=CC=CC=C1)C2=CC=CC=C2 180880 [0,2,0,0,0,0|1,0,1]=4 176 B17R2.5711 NC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2 103975 [0,2,0,0,0,0|0,0,1]=3 177 B17R2.5711 NC(=S)C(C1=CC=CC=C1)C2=CC=CC=C2 021351 [0,2,0,0,0,0|0,1,1]=4 178 B17R2.5711 NC(=S)N(C1=CC=CC=C1)C2=CC=CC=C2 099195 [0,2,0,0,0,0|1,1,0]=4 179 B17R2.5711 O=C(Cl)C(C1=CC=CC=C1)C2=CC=CC=C2 402734 [0,2,0,0,0,0|0,0,1]=3 180 B17R2.5711 O=C(O)C(C1=CC=CC=C1)C2=CC=CC=C2 242817 [0,2,0,0,0,0|0,0,1]=3 181 B17R2.1797 COC1=CC=CC(C(N)C2=CC=CC=C2)=C1 103355 [0,2,0,0,0,0|1,0,1]=4 182 B17R2.1797 COC1=CC=CC(C(O)C2=CC=CC=C2)=C1 022430 [0,2,0,0,0,0|0,0,2]=4 183 B17R2.3218 O=C(C1=CC=CC=C1)C2=CC(F)=CC(F)=C2 004787 [0,2,0,0,0,0|0,0,0]=2 184 B17R2.3218 OC(C1=CC=CC=C1)C2=CC(Cl)=CC(Cl)=C2 022421 [0,2,0,0,0,0|0,0,2]=4 185 B17R2.5272 CC1=CC=CC(C(O)C2=CC=CC(C)=C2)=C1 022432 [0,2,0,0,0,0|0,0,2]=4 186 B17R2.5272 O=C(C1=CC=CC(Cl)=C1)C2=CC(Cl)=CC=C2 022824 [0,2,0,0,0,0|0,0,0]=2 187 B17R2.5272 O=C(C1=CC=CC(F)=C1)C2=CC=CC(F)=C2 009139 [0,2,0,0,0,0|0,0,0]=2 188 B17R2.5272 OC(C1=CC=CC(Cl)=C1)C2=CC(Cl)=CC=C2 022474 [0,2,0,0,0,0|0,0,2]=4 189 B17R2.5272 OC(C1=CC=CC(F)=C1)C2=CC(F)=CC=C2 022501 [0,2,0,0,0,0|0,0,2]=4 190 B17R2.5305 O=C(C1=CC=CC=C1)C2=CC=CC(F)=C2F 004783 [0,2,0,0,0,0|0,0,0]=2 191 B17R2.5356 NC1=C(C(=O)C2=CC=CC=C2)C=C(Br)C=C1 041091 [0,2,0,0,0,0|0,0,0]=2 192 B17R2.5356 NC1=C(C(=O)C2=CC=CC=C2)C=C(Cl)C=C1 043861 [0,2,0,0,0,0|0,0,0]=2 193 B17R2.5356 O=C(C1=CC=CC=C1)C2=CC(Cl)=CC=C2Cl 018517 [0,2,0,0,0,0|0,0,0]=2 194 B17R2.5356 O=C(C1=CC=CC=C1)C2=CC(F)=CC=C2F 001936 [0,2,0,0,0,0|0,0,0]=2 195 B17R2.3434 NC1=C(S(=O)(=O)C2=CC=CC=C2)C=CC=C1 238750 [0,2,0,0,0,0|1,0,0]=3 196 B17R2.5268 O=C(C1=CC=CC=C1)C2=C(F)C=CC=C2F 001959 [0,2,0,0,0,0|0,0,0]=2 197 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)N2 091686 [1,0,0,1,0,0|1,0,0]=3 198 B15R3.3 C1=CC=C2C(=C1)CC3=C2C=CC=C3 094650 [1,0,0,1,0,0|0,0,1]=3 199 B15R3.3 C1=CC=C2C(=C1)OC3=C2C=CC=C3 044557 [1,0,0,1,0,0|1,0,0]=3 200 B15R3.3 C1=CC=C2C(=C1)SC3=C2C=CC=C3 005547 [1,0,0,1,0,0|1,0,0]=3 201 B17R3.1927 C1=CC=C([C@H]2O[C@@H]2C3=CC=CC=C3)C=C1 103270 [0,0,0,1,0,1|0,0,2]=4 202 B17R3.8708 C1=CC=C(C2=CC3=C(C=CC=C3)N2)C=C1 221612 [0,0,0,1,0,1|1,0,0]=3 203 B17R3.8708 C1=CC=C(C2=CN3C=CC=CC3=N2)C=C1 303541 [0,0,0,1,0,1|2,0,0]=4 204 B17R3.8708 C1=CC=C(C2=NC3=CC=CC=C3N2)C=C1 216917 [0,0,0,1,0,1|1,0,0]=3 205 B17R3.8708 C1=CC=C(C2=NC3=CC=CC=C3O2)C=C1 210267 [0,0,0,1,0,1|0,0,1]=3 206 B17R3.8708 C1=CN=CC(C2=NC3=C(C=CC=C3)N2)=C1 238900 [0,0,0,1,0,1|2,0,0]=4 207 B17R3.54615 BrC1=CC2=CC=CC=C2C3=C1C=CC=C3 237121 [0,0,0,1,0,1|1,0,0]=3 208 B17R3.54615 O=C1NC2=CC=CC=C2C3=C1C=CC=C3 077618 [0,0,0,1,0,1|0,0,0]=2 209 B17R3.54615 O=C1OC2=C(C=CC=C2)C3=C1C=CC=C3 180669 [0,0,0,1,0,1|0,0,0]=2 210 B17R3.182920 CCN1C2=C(C=CC=C2)C3=C1C=CC=C3 223213 [0,1,0,1,0,0|2,0,0]=4 211 B17R3.182920 OCC1C2=CC=CC=C2C3=C1C=CC=C3 011726 [0,1,0,1,0,0|0,0,2]=4 212 B17R3.182920 OCN1C2=C(C=CC=C2)C3=C1C=CC=C3 013467 [0,1,0,1,0,0|1,0,1]=4 213 B17R3.31819 O=C1C2=CC(Br)=CC=C2C3=C1C=CC=C3 048755 [0,1,0,1,0,0|0,0,0]=2 214 B17R3.35227 BrC1=C2C=CC=CC2=CC3=CC=CC=C31 223693 [0,1,0,1,0,0|1,0,0]=3 215 B17R3.35227 NC1=C2C=CC=CC2=NC3=CC=CC=C31 102700 [0,1,0,1,0,0|1,0,0]=3 216 B17R3.35227 NC1=C2C=CC=CC2=[NH+]C3=C1C=CC=C3 186212 [0,1,0,1,0,0|1,0,0]=3 217 B17R3.35227 O=C1C2=C(C=CC=C2)OC3=C1C=CC=C3 358255 [0,1,0,1,0,0|0,0,0]=2 218 B17R3.35227 O=C1C2=C(C=CC=C2)SC3=C1C=CC=C3 243049 [0,1,0,1,0,0|0,0,0]=2 219 B17R3.35227 O=C1C2=CC=CC=C2CC3=C1C=CC=C3 102034 [0,1,0,1,0,0|0,0,0]=2 220 B17R3.35227 O=C1C2=CC=CC=C2CC3=C1C=CC=C3 180640 [0,1,0,1,0,0|0,0,0]=2 221 B17R3.35227 O=C1C2=CC=CC=C2NC3=C1C=CC=C3 078876 [0,1,0,1,0,0|0,0,0]=2 222 B17R3.35227 O=C1C2=CC=CC=C2NC3=CC=CC=C13 013393 [0,1,0,1,0,0|0,0,0]=2 223 B17R3.35227 OC1C2=C(C=CC=C2)OC3=C1C=CC=C3 468359 [0,1,0,1,0,0|0,0,2]=4 224 B13R2.3 C1=CC(C2=CC=NC=C2)=CC=N1 068344 [1,0,0,0,1,0|2,0,0]=4 225 B13R2.3 C1=CC=C(C2=CC=CC=C2)C=C1 098382 [1,0,0,0,1,0|0,0,0]=2 226 B13R2.3 C1=CC=C(C2=CC=CN=C2)C=C1 047010 [1,0,0,0,1,0|1,0,0]=3 227 B13R2.3 C1=CC=C(C2=CC=NC=C2)C=C1 047011 [1,0,0,0,1,0|1,0,0]=3 228 B13R2.3 C1=CC=C(C2=NC=CC=C2)C=C1 047027 [1,0,0,0,1,0|1,0,0]=3 229 B13R2.3 C1=CN=C(C2=NC=CC=C2)C=C1 003434 [1,0,0,0,1,0|2,0,0]=4 230 B13R2.3 C1=CN=C(C2=NC=CC=C2)C=C1 104450 [1,0,0,0,1,0|2,0,0]=4 231 B13R2.64 C1=CC=C(CN2C=CC=C2)C=C1 209220 [1,0,0,0,1,0|1,0,1]=4 232 B15R2.2195 C(#CC1=CC=CC=C1)C2=CC=CC=C2 098872 [1,0,0,0,0,1|0,0,1]=3 233 B15R2.2195 C1=CC(\C=C\C2=CC=NC=C2)=CC=N1 209893 [1,0,0,0,0,1|2,0,0]=4 234 B15R2.2195 C1=CC=C(CCC2=CC=CC=C2)C=C1 226679 [1,0,0,0,0,1|0,0,1]=3 235 B15R2.2195 C1=CC=C(CNC2=CC=CC=C2)C=C1 358220 [1,0,0,0,0,1|0,0,1]=3 236 B15R2.2195 C1=CC=C(CNC2=CC=NC=C2)C=C1 032589 [1,0,0,0,0,1|1,0,1]=4 237 B15R2.2195 C1=CC=C(CNC2=NC=CC=C2)C=C1 226573 [1,0,0,0,0,1|1,0,1]=4 238 B15R2.2195 C1=CC=C(COC2=CC=CC=C2)C=C1 023290 [1,0,0,0,0,1|0,0,1]=3 239 B15R2.2195 C1=CC=C(CSC2=CC=CC=C2)C=C1 003349 [1,0,0,0,0,1|0,0,1]=3 240 B15R2.2195 C1=CC=C(SSC2=CC=CC=C2)C=C1 002923 [1,0,0,0,0,1|1,0,0]=3 241 B15R2.2195 C1=CC=C([Se][Se]C2=CC=CC=C2)C=C1 235853 [1,0,0,0,0,1|1,0,0]=3 242 B15R2.2195 C1=CC=C(\C=C\C2=CC=CC=C2)C=C1 358024 [1,0,0,0,0,1|0,0,0]=2 243 B15R2.2195 C1=CC=C(\C=C\C2=CC=NC=C2)C=C1 241695 [1,0,0,0,0,1|1,0,0]=3 244 B15R2.2195 C1=CC=C(\C=C\C2=NC=CC=C2)C=C1 186283 [1,0,0,0,0,1|1,0,0]=3 245 B15R2.2195 C1=CC=C(\C=N\C2=CC=CC=C2)C=C1 339976 [1,0,0,0,0,1|0,0,0]=2 246 B15R2.2195 C1=CC=C(\N=N\C2=CC=CC=C2)C=C1 358435 [1,0,0,0,0,1|1,0,0]=3 247 B15R2.64 O=C(NC1=CC=CC=C1)C2=CC=NN2 187238 [0,0,0,0,1,1|2,0,0]=4 248 B17R2.143 N=C(NC1=CC=CC=C1)NC2=CC=CC=C2 098827 [0,0,0,0,0,2|1,0,0]=3 249 B17R2.143 NN(CC1=CC=CC=C1)CC2=CC=CC=C2 125300 [0,0,0,0,0,2|2,0,0]=4 250 B17R2.143 O=C(CC1=CC=CC=C1)CC2=CC=CC=C2 461066 [0,0,0,0,0,2|0,0,0]=2 251 B17R2.143 O=C(CC1=CC=CC=C1)NC2=CC=CC=C2 336639 [0,0,0,0,0,2|0,0,0]=2 252 B17R2.143 O=C(NC1=CC=CC=C1)NC2=CC=CC=C2 235655 [0,0,0,0,0,2|0,0,0]=2 253 B17R2.143 O=C(NC1=CC=CC=C1)OC2=CC=CC=C2 104149 [0,0,0,0,0,2|0,0,0]=2 254 B17R2.143 O=C(OC1=CC=CC=C1)OC2=CC=CC=C2 214624 [0,0,0,0,0,2|0,0,0]=2 255 B17R2.143 O=C(OC1=NC=CC=C1)OC2=NC=CC=C2 011331 [0,0,0,0,0,2|2,0,0]=4 256 B17R2.143 O=[PH](OC1=CC=CC=C1)OC2=CC=CC=C2 242834 [0,0,0,0,0,2|1,0,0]=3 257 B17R2.143 OC(CC1=CC=CC=C1)CC2=CC=CC=C2 103117 [0,0,0,0,0,2|0,0,2]=4 258 B17R2.143 S=C(NC1=CC=CC=C1)NC2=CC=CC=C2 018646 [0,0,0,0,0,2|0,1,0]=3 259 B17R2.143 S=C(NC1=CC=CC=C1)NC2=NC=CC=C2 018970 [0,0,0,0,0,2|1,1,0]=4 260 B17R2.2342 C[C@@H](NCC1=CC=CC=C1)C2=CC=CC=C2 012696 [0,0,0,0,0,2|1,0,1]=4 261 B17R2.2342 C[C@H](NCC1=CC=CC=C1)C2=CC=CC=C2 012697 [0,0,0,0,0,2|1,0,1]=4 262 B17R2.2342 O=C(CCC1=CC=CC=C1)C2=CC=CC=C2 205565 [0,0,0,0,0,2|0,0,0]=2 263 B17R2.2342 O=C(NCC1=CC=CC=C1)C2=CC=CC=C2 011095 [0,0,0,0,0,2|0,0,0]=2 264 B17R2.2342 O=C(NNC1=CC=CC=C1)C2=CC=CC=C2 067935 [0,0,0,0,0,2|0,0,0]=2 265 B17R2.2342 O=C(OCC1=CC=CC=C1)C2=CC=CC=C2 818701 [0,0,0,0,0,2|0,0,0]=2 266 B17R2.2342 O=C(\C=C\C1=CC=CC=C1)C2=CC=CC=C2 210679 [0,0,0,0,0,2|0,0,0]=2