0 B14R2.6 C1=CC=C(C=C1)CC2=CC=CC=C2 D105755 [0,0,0,0,0,0|1,0,0]=1 1 B14R2.6 C1=CC=C(C=C1)CC2=CC=CC=C2 D105756 [0,0,0,0,0,0|1,0,0]=1 2 B14R2.6 C1=CC=C(C=C1)CC2=CC=CC=N2 B152137 [0,0,0,0,0,0|2,0,0]=2 3 B14R2.6 C1=CC=C(C=C1)CC2=CC=NC=C2 B152132 [0,0,0,0,0,0|2,0,0]=2 4 B14R2.6 C1=CC=C(C=C1)CC2=CN=CC=C2 B152131 [0,0,0,0,0,0|2,0,0]=2 5 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 A304374 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D112594 [0,0,0,0,0,0|1,0,0]=1 7 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D112595 [0,0,0,0,0,0|1,0,0]=1 8 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D113465 [0,0,0,0,0,0|1,0,0]=1 9 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D154703 [0,0,0,0,0,0|1,0,0]=1 10 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D350039 [0,0,0,0,0,0|1,0,0]=1 11 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D424600 [0,0,0,0,0,0|1,0,0]=1 12 B14R2.6 C1=CC=C(C=C1)NC2=CC=CC=C2 D493259 [0,0,0,0,0,0|1,0,0]=1 13 B14R2.6 C1=CC=C(C=C1)NC2=CC=NC=C2 A151570 [0,0,0,0,0,0|2,0,0]=2 14 B14R2.6 C1=CC=C(C=C1)OC2=CC=CC=C2 D110644 [0,0,0,0,0,0|0,0,0]=0 15 B14R2.6 C1=CC=C(C=C1)OC2=CC=CC=C2 D110645 [0,0,0,0,0,0|0,0,0]=0 16 B14R2.6 C1=CC=C(C=C1)OC2=CC=CC=C2 D130016 [0,0,0,0,0,0|0,0,0]=0 17 B14R2.6 C1=CC=C(C=C1)OC2=CC=NC=C2 P135635 [0,0,0,0,0,0|1,0,0]=1 18 B14R2.6 C1=CC=C(C=C1)PC2=CC=CC=C2 D110231 [0,0,0,0,0,0|1,0,0]=1 19 B14R2.6 C1=CC=C(C=C1)PC2=CC=CC=C2 D578979 [0,0,0,0,0,0|1,0,0]=1 20 B14R2.6 C1=CC=C(C=C1)SC2=CC=CC=C2 D107043 [0,0,0,0,0,0|0,1,0]=1 21 B14R2.6 C1=CC=C(C=C1)SC2=CC=CC=C2 D107044 [0,0,0,0,0,0|0,1,0]=1 22 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D113485 [0,0,0,0,0,0|1,0,0]=1 23 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D122465 [0,0,0,0,0,0|1,0,0]=1 24 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D131525 [0,0,0,0,0,0|1,0,0]=1 25 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D132479 [0,0,0,0,0,0|1,0,0]=1 26 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D154817 [0,0,0,0,0,0|1,0,0]=1 27 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D154818 [0,0,0,0,0,0|1,0,0]=1 28 B14R2.6 C1=CC=C(C=C1)[I+]C2=CC=CC=C2 D154819 [0,0,0,0,0,0|1,0,0]=1 29 B14R2.6 C1=CC=C(C=C1)[NH2+]C2=CC=CC=C2 D138340 [0,0,0,0,0,0|1,0,0]=1 30 B14R2.6 C1=CC=C(C=C1)[Se]C2=CC=CC=C2 D282566 [0,0,0,0,0,0|0,1,0]=1 31 B14R2.6 C1=CC=C(C=C1)[Si]C2=CC=CC=C2 D139260 [0,0,0,0,0,0|1,0,0]=1 32 B14R2.6 C1=CC=NC(=C1)NC2=CC=CC=N2 D106373 [0,0,0,0,0,0|3,0,0]=3 33 B14R2.6 C1=CN=CC=C1NC2=CC=NC=C2 D305284 [0,0,0,0,0,0|3,0,0]=3 34 B14R2.6 C1=CN=CC=C1SC2=CC=NC=C2 D155615 [0,0,0,0,0,0|2,1,0]=3 35 B14R2.6 N(c1ccccc1)c2ccccc2 BWY400576 [0,0,0,0,0,0|1,0,0]=1 36 B14R2.6 N(c1ccccc1)c2ccccc2 BWY400578 [0,0,0,0,0,0|1,0,0]=1 37 B14R2.6 N(c1ccccc1)c2ccccc2 D141270 [0,0,0,0,0,0|1,0,0]=1 38 B15R2.29 C1=CC(=CC=C1CC2=CC=NC=C2)Cl C153328 [0,1,0,0,0,0|2,0,0]=3 39 B15R2.29 C1=CC(=CC=C1CC2=CC=NC=C2)N P335183 [0,1,0,0,0,0|2,0,0]=3 40 B15R2.29 C1=CC=C(C=C1)CC2=CC=C(C=C2)Br B478829 [0,1,0,0,0,0|1,0,0]=2 41 B15R2.29 C1=CC=C(C=C1)CC2=CC=C(C=C2)Cl C139306 [0,1,0,0,0,0|1,0,0]=2 42 B15R2.29 C1=CC=C(C=C1)CC2=CC=C(C=C2)F F156672 [0,1,0,0,0,0|1,0,0]=2 43 B15R2.29 C1=CC=C(C=C1)CC2=CC=C(C=C2)N B138044 [0,1,0,0,0,0|1,0,0]=2 44 B15R2.29 C1=CC=C(C=C1)CC2=CC=C(C=C2)N B470150 [0,1,0,0,0,0|1,0,0]=2 45 B15R2.29 C1=CC=C(C=C1)CC2=CC=C(C=C2)O B152810 [0,1,0,0,0,0|1,0,0]=2 46 B15R2.29 C1=CC=C(C=C1)NC2=CC=C(C=C2)Br B102492 [0,1,0,0,0,0|1,0,0]=2 47 B15R2.29 C1=CC=C(C=C1)NC2=CC=C(C=C2)F F156592 [0,1,0,0,0,0|1,0,0]=2 48 B15R2.29 C1=CC=C(C=C1)NC2=CC=C(C=C2)N A104007 [0,1,0,0,0,0|1,0,0]=2 49 B15R2.29 C1=CC=C(C=C1)NC2=CC=C(C=C2)N A151541 [0,1,0,0,0,0|1,0,0]=2 50 B15R2.29 C1=CC=C(C=C1)NC2=CC=C(C=C2)O H157164 [0,1,0,0,0,0|1,0,0]=2 51 B15R2.29 C1=CC=C(C=C1)OC2=CC=C(C=C2)Br B153002 [0,1,0,0,0,0|0,0,0]=1 52 B15R2.29 C1=CC=C(C=C1)OC2=CC=C(C=C2)F F183749 [0,1,0,0,0,0|0,0,0]=1 53 B15R2.29 C1=CC=C(C=C1)OC2=CC=C(C=C2)N P115495 [0,1,0,0,0,0|0,0,0]=1 54 B15R2.29 C1=CC=C(C=C1)OC2=CC=C(C=C2)O P119947 [0,1,0,0,0,0|0,0,0]=1 55 B15R2.29 C1=CC=C(C=C1)OC2=NC=C(C=C2)Br B185470 [0,1,0,0,0,0|1,0,0]=2 56 B15R2.29 C1=CC=NC(=C1)CC2=CC=C(C=C2)Cl C153329 [0,1,0,0,0,0|2,0,0]=3 57 B15R2.29 CC1=CC=C(C=C1)NC2=CC=CC=C2 M102488 [0,1,0,0,0,0|1,0,0]=2 58 B15R2.29 CC1=CC=C(C=C1)OC2=CC=CC=C2 M191483 [0,1,0,0,0,0|0,0,0]=1 59 B15R2.29 CC1=CC=C(C=C1)SC2=CC=CC=C2 P160297 [0,1,0,0,0,0|0,1,0]=2 60 B15R2.31 C1=CC=C(C=C1)OC2=CC(=CC=C2)Br B124376 [0,1,0,0,0,0|0,0,0]=1 61 B15R2.31 C1=CC=C(C=C1)OC2=CC=CC(=C2)N P169883 [0,1,0,0,0,0|0,0,0]=1 62 B15R2.31 CC1=CC(=CC=C1)NC2=CC=CC=C2 M102489 [0,1,0,0,0,0|1,0,0]=2 63 B15R2.31 CC1=CC(=CC=C1)OC2=CC=CC=C2 P160719 [0,1,0,0,0,0|0,0,0]=1 64 B15R2.38 C1=CC=C(C=C1)CC2=CC=CC=C2N B133142 [0,1,0,0,0,0|1,0,0]=2 65 B15R2.38 C1=CC=C(C=C1)CC2=CC=CC=C2O B134913 [0,1,0,0,0,0|1,0,0]=2 66 B15R2.38 C1=CC=C(C=C1)NC2=CC=CC=C2Br B292602 [0,1,0,0,0,0|1,0,0]=2 67 B15R2.38 C1=CC=C(C=C1)NC2=CC=CC=C2N P123018 [0,1,0,0,0,0|1,0,0]=2 68 B15R2.38 C1=CC=C(C=C1)OC2=CC=CC=C2Br B194679 [0,1,0,0,0,0|0,0,0]=1 69 B15R2.38 C1=CC=C(C=C1)OC2=CC=CC=C2I I192903 [0,1,0,0,0,0|0,0,0]=1 70 B15R2.38 C1=CC=C(C=C1)OC2=CC=CC=C2N P113816 [0,1,0,0,0,0|0,0,0]=1 71 B15R2.38 C1=CC=C(C=C1)OC2=CC=CC=C2N P141394 [0,1,0,0,0,0|0,0,0]=1 72 B15R2.38 C1=CC=C(C=C1)OC2=CC=CC=C2O P192246 [0,1,0,0,0,0|0,0,0]=1 73 B15R2.38 C1=CC=C(C=C1)SC2=CC=CC=C2N P101806 [0,1,0,0,0,0|0,1,0]=2 74 B15R2.38 CC1=CC=CC=C1NC2=CC=CC=C2 M190057 [0,1,0,0,0,0|1,0,0]=2 75 B15R2.2226 C1=CC(=CN=C1)C(=O)C2=CN=CC=C2 D169875 [0,1,0,0,0,0|3,0,0]=4 76 B15R2.2226 C1=CC=C(C=C1)C(=N)C2=CC=CC=C2 B121782 [0,1,0,0,0,0|1,0,0]=2 77 B15R2.2226 C1=CC=C(C=C1)C(=N)C2=CC=CC=C2 D193784 [0,1,0,0,0,0|1,0,0]=2 78 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B103860 [0,1,0,0,0,0|1,0,0]=2 79 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B103861 [0,1,0,0,0,0|1,0,0]=2 80 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B103862 [0,1,0,0,0,0|1,0,0]=2 81 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B103863 [0,1,0,0,0,0|1,0,0]=2 82 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B128321 [0,1,0,0,0,0|1,0,0]=2 83 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B420866 [0,1,0,0,0,0|1,0,0]=2 84 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B431545 [0,1,0,0,0,0|1,0,0]=2 85 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 B473910 [0,1,0,0,0,0|1,0,0]=2 86 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CC=CC=N2 B152134 [0,1,0,0,0,0|2,0,0]=3 87 B15R2.2226 C1=CC=C(C=C1)C(=O)C2=CN=CC=C2 B152135 [0,1,0,0,0,0|2,0,0]=3 88 B15R2.2226 C1=CC=C(C=C1)C(C2=CC=CC=C2)Br A134025 [0,1,0,0,0,0|1,0,0]=2 89 B15R2.2226 C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl C103216 [0,1,0,0,0,0|1,0,0]=2 90 B15R2.2226 C1=CC=C(C=C1)C(C2=CC=CC=C2)N B109909 [0,1,0,0,0,0|1,0,0]=2 91 B15R2.2226 C1=CC=C(C=C1)C(C2=CC=CC=C2)N B152289 [0,1,0,0,0,0|1,0,0]=2 92 B15R2.2226 C1=CC=C(C=C1)C(C2=CC=CC=C2)O D106394 [0,1,0,0,0,0|1,0,0]=2 93 B15R2.2226 C1=CC=C(C=C1)C(C2=CC=CC=N2)O P167219 [0,1,0,0,0,0|2,0,0]=3 94 B15R2.2226 C1=CC=C(C=C1)N(C2=CC=CC=C2)N D155065 [0,1,0,0,0,0|1,0,0]=2 95 B15R2.2226 C1=CC=C(C=C1)N(C2=CC=CC=C2)N D155068 [0,1,0,0,0,0|1,0,0]=2 96 B15R2.2226 C1=CC=C(C=C1)P(C2=CC=CC=C2)Cl C109472 [0,1,0,0,0,0|1,0,0]=2 97 B15R2.2226 C1=CC=C(C=C1)S(=O)C2=CC=CC=C2 D109422 [0,1,0,0,0,0|0,1,0]=2 98 B15R2.2226 C1=CC=C(C=C1)[P+](=O)C2=CC=CC=C2 D110251 [0,1,0,0,0,0|1,0,0]=2 99 B15R2.2226 C1=CC=C(C=C1)[Si](C2=CC=CC=C2)Cl C167725 [0,1,0,0,0,0|1,0,0]=2 100 B15R2.2226 C1=CC=NC(=C1)C(=O)C2=CC=CC=N2 D107727 [0,1,0,0,0,0|3,0,0]=4 101 B15R2.2226 C=C(C1=CC=CC=C1)C2=CC=CC=C2 D155632 [0,1,0,0,0,0|1,0,0]=2 102 B15R2.2226 CN(C1=CC=CC=C1)C2=CC=CC=C2 M103618 [0,1,0,0,0,0|1,0,0]=2 103 B15R2.2226 CP(C1=CC=CC=C1)C2=CC=CC=C2 B152148 [0,1,0,0,0,0|1,0,0]=2 104 B15R2.2226 CP(C1=CC=CC=C1)C2=CC=CC=C2 C129171 [0,1,0,0,0,0|1,0,0]=2 105 B15R2.2226 CP(C1=CC=CC=C1)C2=CC=CC=C2 M115367 [0,1,0,0,0,0|1,0,0]=2 106 B15R2.2226 C[S+](C1=CC=CC=C1)C2=CC=CC=C2 D155602 [0,1,0,0,0,0|0,1,0]=2 107 B15R2.2226 C[Si](C1=CC=CC=C1)C2=CC=CC=C2 M158032 [0,1,0,0,0,0|1,0,0]=2 108 B13R1.44 C=CCOC(=O)OC1=CC=CC=C1 A151037 [0,0,1,0,0,0|2,0,1]=4 109 B15R3.3 C1=CC=C2C(=C1)C3=C(N2)C=CC=N3 H156995 [0,0,0,1,0,0|2,0,0]=3 110 B15R3.3 C1=CC=C2C(=C1)C3=C(N2)C=CN=C3 H157003 [0,0,0,1,0,0|2,0,0]=3 111 B15R3.3 C1=CC=C2C(=C1)C3=C(N2)C=NC=C3 N132898 [0,0,0,1,0,0|2,0,0]=3 112 B15R3.3 C1=CC=C2C(=C1)C3=C(N2)N=CC=C3 H157002 [0,0,0,1,0,0|2,0,0]=3 113 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3N2 C104874 [0,0,0,1,0,0|1,0,0]=2 114 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3N2 C104875 [0,0,0,1,0,0|1,0,0]=2 115 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3N2 C104876 [0,0,0,1,0,0|1,0,0]=2 116 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3N2 C119537 [0,0,0,1,0,0|1,0,0]=2 117 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3O2 D100594 [0,0,0,1,0,0|0,0,0]=1 118 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3S2 D106395 [0,0,0,1,0,0|0,1,0]=2 119 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3S2 D106396 [0,0,0,1,0,0|0,1,0]=2 120 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3S2 D106397 [0,0,0,1,0,0|0,1,0]=2 121 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3[I+]2 D113448 [0,0,0,1,0,0|1,0,0]=2 122 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3[I+]2 D424096 [0,0,0,1,0,0|1,0,0]=2 123 B15R3.3 C1=CC=C2C(=C1)C3=CC=CC=C3[N-]2 C153630 [0,0,0,1,0,0|1,0,0]=2 124 B15R3.3 C1C2=CC=CC=C2C3=CC=CC=C31 F105296 [0,0,0,1,0,0|1,0,0]=2 125 B15R3.3 C1C2=CC=CC=C2C3=CC=CC=C31 F105298 [0,0,0,1,0,0|1,0,0]=2 126 B15R3.3 C1C2=CC=CC=C2C3=CC=CC=C31 F105299 [0,0,0,1,0,0|1,0,0]=2 127 B15R3.3 C1C2=CC=CC=C2C3=CC=CC=C31 F105300 [0,0,0,1,0,0|1,0,0]=2 128 B15R3.3 C1C2=CC=CC=C2C3=CC=CC=C31 F128226 [0,0,0,1,0,0|1,0,0]=2 129 B13R2.3 C1=CC(=CN=C1)C2=CN=CC=C2 B152246 [0,0,0,0,1,0|2,0,0]=3 130 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 B110381 [0,0,0,0,1,0|0,0,0]=1 131 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 B110382 [0,0,0,0,1,0|0,0,0]=1 132 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 B110383 [0,0,0,0,1,0|0,0,0]=1 133 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 B110385 [0,0,0,0,1,0|0,0,0]=1 134 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 B119538 [0,0,0,0,1,0|0,0,0]=1 135 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=C2 B474126 [0,0,0,0,1,0|0,0,0]=1 136 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=N2 P107716 [0,0,0,0,1,0|1,0,0]=2 137 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=N2 T123393 [0,0,0,0,1,0|1,0,0]=2 138 B13R2.3 C1=CC=C(C=C1)C2=CC=CC=N2 T124063 [0,0,0,0,1,0|1,0,0]=2 139 B13R2.3 C1=CC=C(C=C1)C2=CC=NC=C2 P117997 [0,0,0,0,1,0|1,0,0]=2 140 B13R2.3 C1=CC=C(C=C1)C2=CN=CC=C2 P111392 [0,0,0,0,1,0|1,0,0]=2 141 B13R2.3 C1=CC=C(C=C1)C2=CN=CN=C2 P192898 [0,0,0,0,1,0|2,0,0]=3 142 B13R2.3 C1=CC=C(C=C1)C2=NC=CC=N2 P160680 [0,0,0,0,1,0|2,0,0]=3 143 B13R2.3 C1=CC=C(C=C1)C2=NC=NC=C2 P339064 [0,0,0,0,1,0|2,0,0]=3 144 B13R2.3 C1=CC=C([C-]=C1)C2=CC=CC=N2 D129167 [0,0,0,0,1,0|1,0,1]=3 145 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 B588259 [0,0,0,0,1,0|2,0,0]=3 146 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 B589601 [0,0,0,0,1,0|2,0,0]=3 147 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 C118516 [0,0,0,0,1,0|2,0,0]=3 148 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 C283075 [0,0,0,0,1,0|2,0,0]=3 149 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 C487395 [0,0,0,0,1,0|2,0,0]=3 150 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 D108977 [0,0,0,0,1,0|2,0,0]=3 151 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T113540 [0,0,0,0,1,0|2,0,0]=3 152 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T161784 [0,0,0,0,1,0|2,0,0]=3 153 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T161786 [0,0,0,0,1,0|2,0,0]=3 154 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T282797 [0,0,0,0,1,0|2,0,0]=3 155 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T299622 [0,0,0,0,1,0|2,0,0]=3 156 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T432774 [0,0,0,0,1,0|2,0,0]=3 157 B13R2.3 C1=CC=NC(=C1)C2=CC=CC=N2 T587395 [0,0,0,0,1,0|2,0,0]=3 158 B13R2.3 C1=CC=NC(=C1)C2=CC=NC=C2 B139033 [0,0,0,0,1,0|2,0,0]=3 159 B13R2.3 C1=CC=NC(=C1)C2=CN=CC=C2 B189163 [0,0,0,0,1,0|2,0,0]=3 160 B13R2.3 C1=CC=[N+](C=C1)C2=CC=NC=C2 P101870 [0,0,0,0,1,0|2,0,0]=3 161 B13R2.3 C1=CN=CC=C1C2=CC=NC=C2 B105217 [0,0,0,0,1,0|2,0,0]=3 162 B13R2.3 C1=CN=CC=C1C2=CC=NC=C2 B105218 [0,0,0,0,1,0|2,0,0]=3 163 B13R2.3 C1=CN=CC=C1C2=CC=NC=C2 B471927 [0,0,0,0,1,0|2,0,0]=3 164 B13R2.3 C1=CN=CC=C1C2=CC=NC=C2 D132219 [0,0,0,0,1,0|2,0,0]=3 165 B13R2.64 C1=CC=C(C=C1)CC2=NC=CN2 B190997 [0,0,0,0,1,0|3,0,0]=4 166 B13R2.64 C1=CC=C(C=C1)CN2C=CC=C2 B132318 [0,0,0,0,1,0|2,0,0]=3 167 B13R2.64 C1=CC=C(C=C1)CN2C=CN=C2 B152366 [0,0,0,0,1,0|3,0,0]=4 168 B13R2.64 C1=CC=C(C=C1)C[N+]2=CSC=C2 B152741 [0,0,0,0,1,0|3,0,0]=4 169 B13R2.64 C1=CN(C=C1)CC2=CN=CC=C2 P160630 [0,0,0,0,1,0|3,0,0]=4 170 B15R2.2195 C1=CC=C(C=C1)C#CC2=CC=CC=C2 D106402 [0,0,0,0,0,1|1,0,0]=2 171 B15R2.2195 C1=CC=C(C=C1)C=CC2=CC=CC=C2 S107167 [0,0,0,0,0,1|1,0,0]=2 172 B15R2.2195 C1=CC=C(C=C1)C=CC2=CC=CC=C2 T161734 [0,0,0,0,0,1|1,0,0]=2 173 B15R2.2195 C1=CC=C(C=C1)C=CC2=CC=NC=C2 S161058 [0,0,0,0,0,1|2,0,0]=3 174 B15R2.2195 C1=CC=C(C=C1)C=NC2=CC=CC=C2 B152653 [0,0,0,0,0,1|1,0,0]=2 175 B15R2.2195 C1=CC=C(C=C1)CCC2=CC=CC=C2 B102513 [0,0,0,0,0,1|1,0,0]=2 176 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=CC=C2 N137951 [0,0,0,0,0,1|1,0,0]=2 177 B15R2.2195 C1=CC=C(C=C1)CNC2=CC=CC=N2 B152133 [0,0,0,0,0,1|2,0,0]=3 178 B15R2.2195 C1=CC=C(C=C1)COC2=CC=CC=C2 B153000 [0,0,0,0,0,1|0,0,0]=1 179 B15R2.2195 C1=CC=C(C=C1)COC2=CC=C[C-]=C2 B466140 [0,0,0,0,0,1|0,0,1]=2 180 B15R2.2195 C1=CC=C(C=C1)COC2=CC=[C-]C=C2 B466132 [0,0,0,0,0,1|0,0,1]=2 181 B15R2.2195 C1=CC=C(C=C1)CSC2=CC=CC=C2 B101826 [0,0,0,0,0,1|0,1,0]=2 182 B15R2.2195 C1=CC=C(C=C1)N=CC2=CC=CC=N2 T354559 [0,0,0,0,0,1|2,0,0]=3 183 B15R2.2195 C1=CC=C(C=C1)N=NC2=CC=CC=C2 A104616 [0,0,0,0,0,1|1,0,0]=2 184 B15R2.2195 C1=CC=C(C=C1)N=NC2=CC=CC=C2 A104617 [0,0,0,0,0,1|1,0,0]=2 185 B15R2.2195 C1=CC=C(C=C1)N=NC2=CC=CC=C2 A294946 [0,0,0,0,0,1|1,0,0]=2 186 B15R2.2195 C1=CC=C(C=C1)NNC2=CC=CC=C2 H431617 [0,0,0,0,0,1|1,0,0]=2 187 B15R2.2195 C1=CC=C(C=C1)SSC2=CC=CC=C2 P101812 [0,0,0,0,0,1|0,1,0]=2 188 B15R2.2195 C1=CC=C(C=C1)[Se][Se]C2=CC=CC=C2 D106407 [0,0,0,0,0,1|0,1,0]=2 189 B15R2.2195 C1=CC=C(C=C1)[Te][Te]C2=CC=CC=C2 D155895 [0,0,0,0,0,1|0,1,0]=2 190 B15R2.2195 C1=CC=NC(=C1)SSC2=CC=CC=N2 D100574 [0,0,0,0,0,1|2,1,0]=4 191 B15R2.2195 C1=CN=CC=C1C=CC2=CC=NC=C2 D106372 [0,0,0,0,0,1|3,0,0]=4 192 B15R2.2195 C1=CN=CC=C1C=CC2=CC=NC=C2 D302230 [0,0,0,0,0,1|3,0,0]=4 193 B15R2.2195 C1=CN=CC=C1CCC2=CC=NC=C2 D154600 [0,0,0,0,0,1|3,0,0]=4 194 B15R2.2195 C1=CN=CC=C1N=NC2=CC=NC=C2 A486959 [0,0,0,0,0,1|3,0,0]=4 195 B15R2.2195 C1=CN=CC=C1N=NC2=CC=NC=C2 B300238 [0,0,0,0,0,1|3,0,0]=4 196 B15R2.2195 C1=CN=CC=C1SSC2=CC=NC=C2 D109419 [0,0,0,0,0,1|2,1,0]=4 197 B14R2.21 C1=CC(=CC(=C1)Br)C2=CC=NC=C2 B152395 [0,1,0,0,1,0|1,0,0]=3 198 B14R2.21 C1=CC(=CC(=C1)Br)C2=CN=CC=C2 B152398 [0,1,0,0,1,0|1,0,0]=3 199 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)Br B115167 [0,1,0,0,1,0|0,0,0]=2 200 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)Cl P115130 [0,1,0,0,1,0|0,0,0]=2 201 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)Cl P115161 [0,1,0,0,1,0|0,0,0]=2 202 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)I I182625 [0,1,0,0,1,0|0,0,0]=2 203 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)N A121454 [0,1,0,0,1,0|0,0,0]=2 204 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)N A141209 [0,1,0,0,1,0|0,0,0]=2 205 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)N A182742 [0,1,0,0,1,0|0,0,0]=2 206 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)O P114098 [0,1,0,0,1,0|0,0,0]=2 207 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)O P120448 [0,1,0,0,1,0|0,0,0]=2 208 B14R2.21 C1=CC=C(C=C1)C2=CC(=CC=C2)O P432980 [0,1,0,0,1,0|0,0,0]=2 209 B14R2.21 C1=CC=C(C=C1)C2=CC(=CN=C2)Br B152401 [0,1,0,0,1,0|1,0,0]=3 210 B14R2.21 C1=CC=C(C=C1)C2=CC(=NC=C2)N P334295 [0,1,0,0,1,0|1,0,0]=3 211 B14R2.21 C1=CC=C(C=C1)C2=CC(=NC=N2)I I287808 [0,1,0,0,1,0|2,0,0]=4 212 B14R2.21 C1=CC=C(C=C1)C2=NC(=CC=C2)Br B152400 [0,1,0,0,1,0|1,0,0]=3 213 B14R2.21 C1=CC=C(C=C1)C2=NC(=NC=C2)N A168818 [0,1,0,0,1,0|2,0,0]=4 214 B14R2.21 C1=CC=NC(=C1)C2=CC(=CC=C2)Br B152399 [0,1,0,0,1,0|1,0,0]=3 215 B14R2.21 C1=CC=NC(=C1)C2=NC(=CC=C2)Br B119929 [0,1,0,0,1,0|2,0,0]=4 216 B14R2.21 C1=CC=NC(=C1)C2=NC(=CC=C2)N A305206 [0,1,0,0,1,0|2,0,0]=4 217 B14R2.21 C1=CC=NC(=C1)C2=NC=CC(=C2)Br B290663 [0,1,0,0,1,0|2,0,0]=4 218 B14R2.21 C1=CC=NC(=C1)C2=NC=CC(=C2)N B401202 [0,1,0,0,1,0|2,0,0]=4 219 B14R2.21 C1=CN=CC=C1C2=CC(=NC=C2)Cl C193790 [0,1,0,0,1,0|2,0,0]=4 220 B14R2.21 CC1=CC(=CC=C1)C2=CC=CC=C2 M136215 [0,1,0,0,1,0|0,0,0]=2 221 B14R2.21 CC1=CC(=NC=C1)C2=CC=CC=C2 M192895 [0,1,0,0,1,0|1,0,0]=3 222 B14R2.21 CC1=NC(=CC=C1)C2=CC=CC=C2 M158571 [0,1,0,0,1,0|1,0,0]=3 223 B14R2.24 C1=CC=C(C(=C1)C2=CC=CC=N2)Br B405205 [0,1,0,0,1,0|1,0,0]=3 224 B14R2.24 C1=CC=C(C(=C1)C2=CC=NC=C2)Br B152388 [0,1,0,0,1,0|1,0,0]=3 225 B14R2.24 C1=CC=C(C(=C1)C2=CN=CC=C2)Br B152402 [0,1,0,0,1,0|1,0,0]=3 226 B14R2.24 C1=CC=C(C=C1)C2=C(C=CC=N2)Br B195778 [0,1,0,0,1,0|1,0,0]=3 227 B14R2.24 C1=CC=C(C=C1)C2=C(C=CC=N2)N A178752 [0,1,0,0,1,0|1,0,0]=3 228 B14R2.24 C1=CC=C(C=C1)C2=C(C=CC=N2)O P192774 [0,1,0,0,1,0|1,0,0]=3 229 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2Br B102815 [0,1,0,0,1,0|0,0,0]=2 230 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2Cl C128140 [0,1,0,0,1,0|0,0,0]=2 231 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2Cl P115129 [0,1,0,0,1,0|0,0,0]=2 232 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2Cl P137740 [0,1,0,0,1,0|0,0,0]=2 233 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2F F103594 [0,1,0,0,1,0|0,0,0]=2 234 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2I I122423 [0,1,0,0,1,0|0,0,0]=2 235 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2N A104706 [0,1,0,0,1,0|0,0,0]=2 236 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2O P107350 [0,1,0,0,1,0|0,0,0]=2 237 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2O P107351 [0,1,0,0,1,0|0,0,0]=2 238 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=C2[O-] S498926 [0,1,0,0,1,0|0,0,0]=2 239 B14R2.24 C1=CC=C(C=C1)C2=CC=CC=[N+]2[O-] P404953 [0,1,0,0,1,0|1,0,0]=3 240 B14R2.24 C1=CC=C(C=C1)C2=NC=CNC2=O P194796 [0,1,0,0,1,0|2,0,0]=4 241 B14R2.24 C1=CC=C([C-]=C1)C2=CC=CC=C2N D139313 [0,1,0,0,1,0|0,0,1]=3 242 B14R2.24 C1=CC=NC(=C1)C2=C(C=CC=N2)N B302139 [0,1,0,0,1,0|2,0,0]=4 243 B14R2.24 C1=CC=NC(=C1)C2=CC=CC=[N+]2[O-] D169653 [0,1,0,0,1,0|2,0,0]=4 244 B14R2.24 CC1=C(N=CC=C1)C2=CC=CC=C2 M137948 [0,1,0,0,1,0|1,0,0]=3 245 B14R2.24 CC1=CC=CC=C1C2=CC=CC=C2 M158409 [0,1,0,0,1,0|0,0,0]=2 246 B14R2.68 C1=CC(=CC=C1C2=CC=NC=C2)Br B152397 [0,1,0,0,1,0|1,0,0]=3 247 B14R2.68 C1=CC(=CC=C1C2=CC=NC=C2)N P302402 [0,1,0,0,1,0|1,0,0]=3 248 B14R2.68 C1=CC(=CN=C1)C2=CC=C(C=C2)Br B152396 [0,1,0,0,1,0|1,0,0]=3 249 B14R2.68 C1=CC(=CN=C1)C2=CN=C(C=C2)N B192704 [0,1,0,0,1,0|2,0,0]=4 250 B14R2.68 C1=CC(=NC=C1C2=CC=NC=C2)Cl C349263 [0,1,0,0,1,0|2,0,0]=4 251 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)Br B110578 [0,1,0,0,1,0|0,0,0]=2 252 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)Br B110579 [0,1,0,0,1,0|0,0,0]=2 253 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)Cl P115131 [0,1,0,0,1,0|0,0,0]=2 254 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)Cl P141424 [0,1,0,0,1,0|0,0,0]=2 255 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)F F121052 [0,1,0,0,1,0|0,0,0]=2 256 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)I I102017 [0,1,0,0,1,0|0,0,0]=2 257 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)N A112677 [0,1,0,0,1,0|0,0,0]=2 258 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)O P100424 [0,1,0,0,1,0|0,0,0]=2 259 B14R2.68 C1=CC=C(C=C1)C2=CC=C(C=C2)O P100425 [0,1,0,0,1,0|0,0,0]=2 260 B14R2.68 C1=CC=C(C=C1)C2=CC=[N+](C=C2)[O-] P160489 [0,1,0,0,1,0|1,0,0]=3 261 B14R2.68 C1=CC=C(C=C1)C2=CN=C(C=C2)N A135460 [0,1,0,0,1,0|1,0,0]=3 262 B14R2.68 C1=CC=C(C=C1)C2=CN=C(C=N2)N A151408 [0,1,0,0,1,0|2,0,0]=4 263 B14R2.68 C1=CC=C(C=C1)C2=NC=C(C=C2)Br B119892 [0,1,0,0,1,0|1,0,0]=3 264 B14R2.68 C1=CC=C(C=C1)C2=NC=C(C=C2)O H185880 [0,1,0,0,1,0|1,0,0]=3 265 B14R2.68 C1=CC=C(C=C1)C2=NC=C(C=N2)Br B184215 [0,1,0,0,1,0|2,0,0]=4 266 B14R2.68 C1=CC=C(C=C1)C2=NN=C(C=C2)Cl C138448 [0,1,0,0,1,0|2,0,0]=4 267 B14R2.68 C1=CC=C(C=C1)C2=NNC(=O)C=C2 P160745 [0,1,0,0,1,0|2,0,0]=4 268 B14R2.68 C1=CC=NC(=C1)C2=CC=C(C=C2)Br B152394 [0,1,0,0,1,0|1,0,0]=3 269 B14R2.68 C1=CC=NC(=C1)C2=CC=C(C=C2)F F404463 [0,1,0,0,1,0|1,0,0]=3 270 B14R2.68 C1=CC=NC(=C1)C2=CC=C(C=C2)O P589311 [0,1,0,0,1,0|1,0,0]=3 271 B14R2.68 C1=CC=NC(=C1)C2=NC=C(C=C2)Br B290599 [0,1,0,0,1,0|2,0,0]=4 272 B14R2.68 C1=CC=NC(=C1)C2=NC=C(C=C2)Cl C191320 [0,1,0,0,1,0|2,0,0]=4 273 B14R2.68 C1=CC=NC(=C1)C2=NC=C(C=C2)N B587484 [0,1,0,0,1,0|2,0,0]=4 274 B14R2.68 C1=CN=C(N=C1)C2=CC=C(C=C2)Br B405355 [0,1,0,0,1,0|2,0,0]=4 275 B14R2.68 CC1=CC=C(C=C1)C2=CC=CC=C2 P115519 [0,1,0,0,1,0|0,0,0]=2 276 B14R2.68 CC1=CC=C(C=C1)C2=CC=CC=N2 P119889 [0,1,0,0,1,0|1,0,0]=3 277 B14R2.68 CC1=CC=C(C=C1)C2=NC=CC=N2 P405589 [0,1,0,0,1,0|2,0,0]=4 278 B14R2.68 CC1=CN=C(C=C1)C2=CC=CC=C2 M292617 [0,1,0,0,1,0|1,0,0]=3 279 B14R2.68 CC1=C[C-]=C(C=C1)C2=CC=CC=N2 T293087 [0,1,0,0,1,0|1,0,1]=4 280 B14R2.68 C[N+]1=CC=C(C=C1)C2=CC=CC=C2 N137206 [0,1,0,0,1,0|1,0,0]=3 281 B14R2.114 C1=CC=C(C=C1)C(=O)C2=CC=CN2 B152701 [0,1,0,0,1,0|2,0,0]=4 282 B14R2.114 C1=CC=C(C=C1)C(=O)C2=CC=CS2 B153041 [0,1,0,0,1,0|2,0,0]=4 283 B14R2.114 C1=CC=C(C=C1)C(=O)C2=CNC=C2 B186188 [0,1,0,0,1,0|2,0,0]=4 284 B16R2.71 C1=CC=C(C=C1)COC2=C(N=CC=C2)N A151569 [0,1,0,0,0,1|1,0,0]=3 285 B16R2.71 C1=CC=C(C=C1)COC2=CC=CC=C2N B132313 [0,1,0,0,0,1|0,0,0]=2 286 B16R2.71 C1=CC=C(C=C1)COC2=CC=CC=C2O B152813 [0,1,0,0,0,1|0,0,0]=2 287 B16R2.71 C1=CC=C(C=C1)N=CC2=CC=CC=C2O N159541 [0,1,0,0,0,1|1,0,0]=3 288 B16R2.71 CC1=CC=CC=C1C=CC2=CC=CC=C2 M158029 [0,1,0,0,0,1|1,0,0]=3 289 B16R2.88 C1=CC=C(C=C1)C(=NC2=CC=CC=C2)N N167493 [0,1,0,0,0,1|1,0,0]=3 290 B16R2.88 C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC=C2 P160618 [0,1,0,0,0,1|2,0,0]=4 291 B16R2.88 C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2 B152328 [0,1,0,0,0,1|1,0,0]=3 292 B16R2.88 C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2 P107013 [0,1,0,0,0,1|0,0,0]=2 293 B16R2.88 C1=CC=C(C=C1)C(=S)NC2=CC=CC=C2 N140452 [0,1,0,0,0,1|1,0,0]=3 294 B16R2.88 C1=CC=C(C=C1)CC(=O)C2=CC=CC=C2 P108570 [0,1,0,0,0,1|1,0,0]=3 295 B16R2.88 C1=CC=C(C=C1)CC(C2=CC=CC=C2)N D154742 [0,1,0,0,0,1|1,0,0]=3 296 B16R2.88 C1=CC=C(C=C1)CN(C2=CC=CC=C2)N B152453 [0,1,0,0,0,1|1,0,0]=3 297 B16R2.88 C1=CC=C(C=C1)N=[N+](C2=CC=CC=C2)[O-] A140451 [0,1,0,0,0,1|1,0,0]=3 298 B16R2.88 C1=CC=C(C=C1)NC(=O)C2=CN=CC=C2 N167942 [0,1,0,0,0,1|2,0,0]=4 299 B16R2.88 C1=CC=C(C=C1)OC(=O)C2=CC=NC=C2 P305008 [0,1,0,0,0,1|1,0,0]=3 300 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=CC=C2 N194202 [0,1,0,0,0,1|1,0,0]=3 301 B16R2.88 CN(CC1=CC=CC=C1)C2=CC=NC=C2 D355485 [0,1,0,0,0,1|2,0,0]=4 302 B16R2.132 C1=CC=C(C=C1)C#CC2=CC=C(C=C2)Br B153025 [0,1,0,0,0,1|1,0,0]=3 303 B16R2.132 C1=CC=C(C=C1)C#CC2=CC=C(C=C2)Cl C472486 [0,1,0,0,0,1|1,0,0]=3 304 B16R2.132 C1=CC=C(C=C1)C#CC2=CC=C(C=C2)N P587812 [0,1,0,0,0,1|1,0,0]=3 305 B16R2.132 C1=CC=C(C=C1)C=CC2=CC=C(C=C2)Br B152902 [0,1,0,0,0,1|1,0,0]=3 306 B16R2.132 C1=CC=C(C=C1)C=CC2=CC=C(C=C2)Br B301954 [0,1,0,0,0,1|1,0,0]=3 307 B16R2.132 C1=CC=C(C=C1)C=CC2=CC=C(C=C2)N A151436 [0,1,0,0,0,1|1,0,0]=3 308 B16R2.132 C1=CC=C(C=C1)C=NC2=CC=C(C=C2)O B152811 [0,1,0,0,0,1|1,0,0]=3 309 B16R2.132 C1=CC=C(C=C1)COC2=CC=C(C=C2)Br B123178 [0,1,0,0,0,1|0,0,0]=2 310 B16R2.132 C1=CC=C(C=C1)COC2=CC=C(C=C2)F B184076 [0,1,0,0,0,1|0,0,0]=2 311 B16R2.132 C1=CC=C(C=C1)COC2=CC=C(C=C2)N B138933 [0,1,0,0,0,1|0,0,0]=2 312 B16R2.132 C1=CC=C(C=C1)COC2=CC=C(C=C2)N B405221 [0,1,0,0,0,1|0,0,0]=2 313 B16R2.132 C1=CC=C(C=C1)COC2=CC=C(C=C2)O B100826 [0,1,0,0,0,1|0,0,0]=2 314 B16R2.132 C1=CC=C(C=C1)COC2=CC=[N+](C=C2)[O-] B124263 [0,1,0,0,0,1|1,0,0]=3 315 B16R2.132 C1=CC=C(C=C1)COC2=NC=C(C=C2)Br B186831 [0,1,0,0,0,1|1,0,0]=3 316 B16R2.132 C1=CC=C(C=C1)COC2=NC=C(C=C2)O B194772 [0,1,0,0,0,1|1,0,0]=3 317 B16R2.132 C1=CC=C(C=C1)COC2=NC=C(C=N2)Br B186361 [0,1,0,0,0,1|2,0,0]=4 318 B16R2.132 C1=CC=C(C=C1)N=CC2=CC=C(C=C2)F N159234 [0,1,0,0,0,1|1,0,0]=3 319 B16R2.132 C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N A104703 [0,1,0,0,0,1|1,0,0]=3 320 B16R2.132 C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N A104704 [0,1,0,0,0,1|1,0,0]=3 321 B16R2.132 C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N A151403 [0,1,0,0,0,1|1,0,0]=3 322 B16R2.132 CC1=CC=C(C=C1)C=CC2=CC=CC=C2 M158031 [0,1,0,0,0,1|1,0,0]=3 323 B16R2.132 OC1=CC=C(OCC2=CC=CC=C2)C=C1 M408651 [0,1,0,0,0,1|0,0,0]=2 324 B16R2.252 C1=CC=C(C=C1)CNC2=CC(=CC=C2)Br N182767 [0,1,0,0,0,1|1,0,0]=3 325 B16R2.252 C1=CC=C(C=C1)COC2=CC(=CC=C2)Br B133897 [0,1,0,0,0,1|0,0,0]=2 326 B16R2.252 C1=CC=C(C=C1)COC2=CC(=CC=C2)I B153013 [0,1,0,0,0,1|0,0,0]=2 327 B16R2.252 C1=CC=C(C=C1)COC2=CC(=CN=C2)Br B153066 [0,1,0,0,0,1|1,0,0]=3 328 B16R2.252 C1=CC=C(C=C1)COC2=CC(=O)NC=C2 B138962 [0,1,0,0,0,1|1,0,0]=3 329 B16R2.252 C1=CC=C(C=C1)COC2=CC=CC(=C2)N P132392 [0,1,0,0,0,1|0,0,0]=2 330 B16R2.252 C1=CC=C(C=C1)COC2=CC=CC(=C2)O B152817 [0,1,0,0,0,1|0,0,0]=2 331 B16R2.252 C1=CC=C(C=C1)COC2=NC(=CC=C2)Br B153072 [0,1,0,0,0,1|1,0,0]=3 332 B16R2.252 C1=CC=C(C=C1)COC2=NC(=NC=C2)Cl B586336 [0,1,0,0,0,1|2,0,0]=4 333 B16R2.252 C1=CC=C(C=C1)COC2=NC=CC(=C2)N B586639 [0,1,0,0,0,1|1,0,0]=3 334 B16R2.252 CC1=NC(=CC=C1)C#CC2=CC=CC=C2 M127959 [0,1,0,0,0,1|2,0,0]=4 335 B16R2.252 CC1=NC(=CC=C1)C#CC2=CC=CC=C2 M287567 [0,1,0,0,0,1|2,0,0]=4 336 B16R2.252 CC1=NC(=CC=C1)C#CC2=CC=CC=C2 M408882 [0,1,0,0,0,1|2,0,0]=4 337 B16R2.252 CC1=NC(=CC=C1)C=CC2=CC=CC=C2 S286680 [0,1,0,0,0,1|2,0,0]=4 338 B16R2.2 C#CC1=CC=C(C=C1)OC2=CC=CC=C2 E170265 [0,2,0,0,0,0|0,0,0]=2 339 B16R2.2 C1=CC=C(C=C1)NC2=CC=C(C=C2)N=O N159284 [0,2,0,0,0,0|1,0,0]=3 340 B16R2.2 C1=CC=C(C=C1)NC2=CC=C(C=C2)[N+]#N D154560 [0,2,0,0,0,0|1,0,0]=3 341 B16R2.2 C1=CC=C(C=C1)OC2=CC=C(C=C2)C#N P160080 [0,2,0,0,0,0|0,0,0]=2 342 B16R2.2 C1=CC=C(C=C1)OC2=CC=C(C=C2)C=O P160746 [0,2,0,0,0,0|0,0,0]=2 343 B16R2.2 C1=CC=C(C=C1)OC2=CC=C(C=C2)CN P189593 [0,2,0,0,0,0|0,0,0]=2 344 B16R2.2 C1=CC=C(C=C1)OC2=NC=C(C=C2)C=O P587656 [0,2,0,0,0,0|1,0,0]=3 345 B16R2.2 COC1=CC=C(C=C1)NC2=CC=CC=C2 M102493 [0,2,0,0,0,0|1,0,0]=3 346 B16R2.33 C1=CC(=CC=C1Br)[I+]C2=CC=C(C=C2)Br B405226 [0,2,0,0,0,0|1,0,0]=3 347 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)Cl)Cl D357064 [0,2,0,0,0,0|1,0,0]=3 348 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)F)F D155059 [0,2,0,0,0,0|1,0,0]=3 349 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)N)N D108778 [0,2,0,0,0,0|1,0,0]=3 350 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)N)N D108779 [0,2,0,0,0,0|1,0,0]=3 351 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)N)N D108780 [0,2,0,0,0,0|1,0,0]=3 352 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)N)N D108781 [0,2,0,0,0,0|1,0,0]=3 353 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)N)N D141212 [0,2,0,0,0,0|1,0,0]=3 354 B16R2.33 C1=CC(=CC=C1CC2=CC=C(C=C2)O)O D135041 [0,2,0,0,0,0|1,0,0]=3 355 B16R2.33 C1=CC(=CC=C1N)NC2=CC=C(C=C2)N D154677 [0,2,0,0,0,0|1,0,0]=3 356 B16R2.33 C1=CC(=CC=C1N)OC2=CC=C(C=C2)Cl A151417 [0,2,0,0,0,0|0,0,0]=2 357 B16R2.33 C1=CC(=CC=C1N)OC2=CC=C(C=C2)N D104463 [0,2,0,0,0,0|0,0,0]=2 358 B16R2.33 C1=CC(=CC=C1N)OC2=CC=C(C=C2)N D104464 [0,2,0,0,0,0|0,0,0]=2 359 B16R2.33 C1=CC(=CC=C1N)SC2=CC=C(C=C2)N D101165 [0,2,0,0,0,0|0,1,0]=3 360 B16R2.33 C1=CC(=CC=C1N)SC2=CC=C(C=C2)N D101166 [0,2,0,0,0,0|0,1,0]=3 361 B16R2.33 C1=CC(=CC=C1NC2=CC=C(C=C2)Br)Br B102486 [0,2,0,0,0,0|1,0,0]=3 362 B16R2.33 C1=CC(=CC=C1NC2=CC=C(C=C2)I)I B121315 [0,2,0,0,0,0|1,0,0]=3 363 B16R2.33 C1=CC(=CC=C1O)OC2=CC=C(C=C2)Br B351130 [0,2,0,0,0,0|0,0,0]=2 364 B16R2.33 C1=CC(=CC=C1O)OC2=CC=C(C=C2)Cl C132722 [0,2,0,0,0,0|0,0,0]=2 365 B16R2.33 C1=CC(=CC=C1O)OC2=CC=C(C=C2)O D119948 [0,2,0,0,0,0|0,0,0]=2 366 B16R2.33 C1=CC(=CC=C1O)SC2=CC=C(C=C2)O T101808 [0,2,0,0,0,0|0,1,0]=3 367 B16R2.33 C1=CC(=CC=C1OC2=CC=C(C=C2)Br)Br B102475 [0,2,0,0,0,0|0,0,0]=2 368 B16R2.33 C1=CC(=CC=C1OC2=NC=C(C=C2)N)Br B301395 [0,2,0,0,0,0|1,0,0]=3 369 B16R2.33 C1=CC(=CC=C1S)SC2=CC=C(C=C2)S T101821 [0,2,0,0,0,0|0,1,0]=3 370 B16R2.33 C1=CC(=CC=C1SC2=CC=C(C=C2)Br)Br B152477 [0,2,0,0,0,0|0,1,0]=3 371 B16R2.33 C1=CC(=CC=C1SC2=CC=C(C=C2)Cl)Cl B404127 [0,2,0,0,0,0|0,1,0]=3 372 B16R2.33 C1=CC(=O)C=CC1=NC2=CC=C(C=C2)O I133727 [0,2,0,0,0,0|1,0,0]=3 373 B16R2.33 CC1=CC=C(C=C1)CC2=CC=C(C=C2)C D155050 [0,2,0,0,0,0|1,0,0]=3 374 B16R2.33 CC1=CC=C(C=C1)NC2=CC=C(C=C2)C D102485 [0,2,0,0,0,0|1,0,0]=3 375 B16R2.33 CC1=CC=C(C=C1)OC2=CC=C(C=C2)C D155750 [0,2,0,0,0,0|0,0,0]=2 376 B16R2.33 CC1=CC=C(C=C1)OC2=CC=C(C=C2)N A151439 [0,2,0,0,0,0|0,0,0]=2 377 B16R2.120 C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Br B139416 [0,2,0,0,0,0|1,0,0]=3 378 B16R2.120 C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl C100737 [0,2,0,0,0,0|1,0,0]=3 379 B16R2.120 C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)F F156636 [0,2,0,0,0,0|1,0,0]=3 380 B16R2.120 C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)N A151497 [0,2,0,0,0,0|1,0,0]=3 381 B16R2.120 C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)O H108575 [0,2,0,0,0,0|1,0,0]=3 382 B16R2.120 C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)N B589459 [0,2,0,0,0,0|1,0,0]=3 383 B16R2.120 C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)O B137164 [0,2,0,0,0,0|1,0,0]=3 384 B16R2.120 C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)Cl C299034 [0,2,0,0,0,0|1,0,0]=3 385 B16R2.120 C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)N C588546 [0,2,0,0,0,0|1,0,0]=3 386 B16R2.120 C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)O C154106 [0,2,0,0,0,0|1,0,0]=3 387 B16R2.120 C1=CC=C(C=C1)C(C2=CC=C(C=C2)F)O F337902 [0,2,0,0,0,0|1,0,0]=3 388 B16R2.120 C1=CC=NC(=C1)C(=O)C2=CC=C(C=C2)Cl C153330 [0,2,0,0,0,0|2,0,0]=4 389 B16R2.120 C1=CC=NC(=C1)C(C2=CC=C(C=C2)Cl)O A151083 [0,2,0,0,0,0|2,0,0]=4 390 B16R2.120 CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2 M101594 [0,2,0,0,0,0|1,0,0]=3 391 B16R2.120 CC1=CC=C(C=C1)C(C2=CC=CC=C2)O M158737 [0,2,0,0,0,0|1,0,0]=3 392 B16R2.124 CC1=C(C=C(C=C1)NC2=CC=CC=C2)C D102487 [0,2,0,0,0,0|1,0,0]=3 393 B16R2.131 C1=CC(=CC(=C1)Cl)OC2=CC=C(C=C2)N C356325 [0,2,0,0,0,0|0,0,0]=2 394 B16R2.131 C1=CC(=CC(=C1)N)CC2=CC=C(C=C2)N D133056 [0,2,0,0,0,0|1,0,0]=3 395 B16R2.131 C1=CC(=CC(=C1)OC2=CC=C(C=C2)N)N O102219 [0,2,0,0,0,0|0,0,0]=2 396 B16R2.131 CC1=CC(=CC=C1)OC2=CC=C(C=C2)F M158585 [0,2,0,0,0,0|0,0,0]=2 397 B16R2.131 CC1=CC(=CC=C1)OC2=CNC(=O)N=C2 T133701 [0,2,0,0,0,0|2,0,0]=4 398 B16R2.131 CC1=CC=C(C=C1)NC2=CC(=CC=C2)O H333195 [0,2,0,0,0,0|1,0,0]=3 399 B16R2.312 C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)N D154777 [0,2,0,0,0,0|1,0,0]=3 400 B16R2.312 C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N A115493 [0,2,0,0,0,0|0,0,0]=2 401 B16R2.312 C1=CC=C(C=C1)OC2=C(C=C(C=C2)N)Cl C589385 [0,2,0,0,0,0|0,0,0]=2 402 B16R2.312 CC1=CC(=C(C=C1)NC2=CC=CC=C2)C D121321 [0,2,0,0,0,0|1,0,0]=3 403 B16R2.1129 C1=CC=C(C(=C1)CC2=CC=C(C=C2)N)N A190082 [0,2,0,0,0,0|1,0,0]=3 404 B16R2.1129 C1=CC=C(C(=C1)CC2=CC=C(C=C2)O)O D155999 [0,2,0,0,0,0|1,0,0]=3 405 B16R2.1129 C1=CC=C(C(=C1)N)NC2=CC=C(C=C2)Br N292561 [0,2,0,0,0,0|1,0,0]=3 406 B16R2.1129 C1=CC=C(C(=C1)N)NC2=CC=C(C=C2)Cl N338537 [0,2,0,0,0,0|1,0,0]=3 407 B16R2.1129 C1=CC=C(C(=C1)N)OC2=CC=C(C=C2)Cl A151364 [0,2,0,0,0,0|0,0,0]=2 408 B16R2.1129 C1=CC=C(C(=C1)OC2=CC=C(C=C2)N)F F588652 [0,2,0,0,0,0|0,0,0]=2 409 B16R2.23 C1=CC=C(C=C1)OC2=CC=CC(=C2)C=O P135124 [0,2,0,0,0,0|0,0,0]=2 410 B16R2.23 C1=CC=C(C=C1)OC2=CC=CC(=C2)CCl P136374 [0,2,0,0,0,0|0,0,0]=2 411 B16R2.23 C1=CC=C(C=C1)OC2=CC=CC(=C2)CN P589302 [0,2,0,0,0,0|0,0,0]=2 412 B16R2.23 C1=CC=C(C=C1)OC2=CC=CC(=C2)CO P111199 [0,2,0,0,0,0|0,0,0]=2 413 B16R2.23 COC1=CC=CC(=C1)NC2=CC=CC=C2 M101876 [0,2,0,0,0,0|1,0,0]=3 414 B16R2.236 C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)Br B165455 [0,2,0,0,0,0|1,0,0]=3 415 B16R2.236 C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)Br B472718 [0,2,0,0,0,0|1,0,0]=3 416 B16R2.236 C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)Cl C153776 [0,2,0,0,0,0|1,0,0]=3 417 B16R2.236 C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)F F578734 [0,2,0,0,0,0|1,0,0]=3 418 B16R2.236 C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)N A151498 [0,2,0,0,0,0|1,0,0]=3 419 B16R2.236 C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)O H156986 [0,2,0,0,0,0|1,0,0]=3 420 B16R2.236 CC1=CC(=CC=C1)C(=O)C2=CC=CC=C2 M158277 [0,2,0,0,0,0|1,0,0]=3 421 B16R2.236 CC1=CC(=CC=C1)C(=O)C2=CC=CC=C2 M474885 [0,2,0,0,0,0|1,0,0]=3 422 B16R2.251 C1=CC(=CC(=C1)N)CC2=CC(=CC=C2)N D132695 [0,2,0,0,0,0|1,0,0]=3 423 B16R2.251 C1=CC(=CC(=C1)OC2=CC=CC(=C2)N)N O404839 [0,2,0,0,0,0|0,0,0]=2 424 B16R2.251 CC1=CC(=CC=C1)NC2=CC=CC(=C2)C D121319 [0,2,0,0,0,0|1,0,0]=3 425 B16R2.317 C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)O B152826 [0,2,0,0,0,0|1,0,0]=3 426 B16R2.2923 CC1=CC(=CC=C1)OC2=CC=CC=C2F M405724 [0,2,0,0,0,0|0,0,0]=2 427 B16R2.172 C1=CC=C(C=C1)OC2=CC=CC=C2C=O P404898 [0,2,0,0,0,0|0,0,0]=2 428 B16R2.172 C1=CC=C(C=C1)OC2=CC=CC=C2CCl P160293 [0,2,0,0,0,0|0,0,0]=2 429 B16R2.3259 C1=CC=C(C=C1)NC2=C(C=CC=C2Cl)Cl D132398 [0,2,0,0,0,0|1,0,0]=3 430 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2Br B152250 [0,2,0,0,0,0|1,0,0]=3 431 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2Cl C101907 [0,2,0,0,0,0|1,0,0]=3 432 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2F F122011 [0,2,0,0,0,0|1,0,0]=3 433 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2I I588415 [0,2,0,0,0,0|1,0,0]=3 434 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2N A107273 [0,2,0,0,0,0|1,0,0]=3 435 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O H156994 [0,2,0,0,0,0|1,0,0]=3 436 B16R2.3896 C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O H474493 [0,2,0,0,0,0|1,0,0]=3 437 B16R2.3896 C1=CC=C(C=C1)C(C2=CC=CC=C2N)O A166953 [0,2,0,0,0,0|1,0,0]=3 438 B16R2.3896 CC1=CC=CC=C1C(=O)C2=CC=CC=C2 M158276 [0,2,0,0,0,0|1,0,0]=3 439 B16R2.3896 CC1=CC=CC=C1C(C2=CC=CC=C2)O M158739 [0,2,0,0,0,0|1,0,0]=3 440 B16R2.4062 C1=CC=C(C(=C1)CC2=CC=CC=C2N)N M304304 [0,2,0,0,0,0|1,0,0]=3 441 B16R2.4062 C1=CC=C(C(=C1)CC2=CC=CC=C2O)O D156001 [0,2,0,0,0,0|1,0,0]=3 442 B16R2.4062 C1=CC=C(C(=C1)N)NC2=CC=CC=C2F N588583 [0,2,0,0,0,0|1,0,0]=3 443 B16R2.4062 C1=CC=C(C(=C1)N)OC2=CC=CC=C2N O138553 [0,2,0,0,0,0|0,0,0]=2 444 B16R2.4062 C1=CC=C(C(=C1)N)SC2=CC=CC=C2N D101807 [0,2,0,0,0,0|0,1,0]=3 445 B16R2.4062 CC1=CC=CC=C1OC2=CC=CC=C2N A115494 [0,2,0,0,0,0|0,0,0]=2 446 B16R2.187 C1=CC=C(C=C1)C(=NN)C2=CC=CC=C2 B110107 [0,2,0,0,0,0|1,0,0]=3 447 B16R2.187 C1=CC=C(C=C1)C(=NO)C2=CC=CC=C2 B304037 [0,2,0,0,0,0|1,0,0]=3 448 B16R2.187 C1=CC=C(C=C1)C(=NO)C2=CC=CC=N2 P160501 [0,2,0,0,0,0|2,0,0]=4 449 B16R2.187 C1=CC=C(C=C1)C(C#N)C2=CC=CC=C2 D107444 [0,2,0,0,0,0|1,0,0]=3 450 B16R2.187 C1=CC=C(C=C1)C(C#N)C2=CC=CC=N2 P136340 [0,2,0,0,0,0|2,0,0]=4 451 B16R2.187 C1=CC=C(C=C1)C(CN)C2=CC=CC=C2 D138788 [0,2,0,0,0,0|1,0,0]=3 452 B16R2.187 C1=CC=C(C=C1)N(C2=CC=CC=C2)N=O N111862 [0,2,0,0,0,0|1,0,0]=3 453 B16R2.187 C1=CC=C(C=C1)N(C2=CC=CC=C2)N=O N111863 [0,2,0,0,0,0|1,0,0]=3 454 B16R2.187 C1=CC=C(C=C1)N(C=O)C2=CC=CC=C2 N159298 [0,2,0,0,0,0|1,0,0]=3 455 B16R2.187 C=CP(C1=CC=CC=C1)C2=CC=CC=C2 D115606 [0,2,0,0,0,0|1,0,0]=3 456 B16R2.187 C=C[S+](C1=CC=CC=C1)C2=CC=CC=C2 E175884 [0,2,0,0,0,0|0,1,0]=3 457 B16R2.187 CCP(C1=CC=CC=C1)C2=CC=CC=C2 E115368 [0,2,0,0,0,0|1,0,0]=3 458 B16R2.187 CNC(C1=CC=CC=C1)C2=CC=CC=C2 I167364 [0,2,0,0,0,0|1,0,0]=3 459 B16R2.187 COP(C1=CC=CC=C1)C2=CC=CC=C2 M158552 [0,2,0,0,0,0|1,0,0]=3 460 B16R2.2945 C1=CC=C(C=C1)C(C2=CC=CC=C2)(Cl)Cl D134352 [0,2,0,0,0,0|1,0,0]=3 461 B16R2.2945 C1=CC=C(C=C1)C(C2=CC=CC=C2)(Cl)Cl D312120 [0,2,0,0,0,0|1,0,0]=3 462 B16R2.2945 C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)Cl D109429 [0,2,0,0,0,0|1,0,0]=3 463 B16R2.2945 C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)N D332002 [0,2,0,0,0,0|1,0,0]=3 464 B16R2.2945 C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)O D110250 [0,2,0,0,0,0|1,0,0]=3 465 B16R2.2945 C1=CC=C(C=C1)P(=S)(C2=CC=CC=C2)S D300168 [0,2,0,0,0,0|1,0,0]=3 466 B16R2.2945 C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2 D109424 [0,2,0,0,0,0|0,1,0]=3 467 B16R2.2945 C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2 D109425 [0,2,0,0,0,0|0,1,0]=3 468 B16R2.2945 C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2 D109426 [0,2,0,0,0,0|0,1,0]=3 469 B16R2.2945 C1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=N2 P183089 [0,2,0,0,0,0|1,1,0]=4 470 B16R2.2945 C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(Cl)Cl D140820 [0,2,0,0,0,0|1,0,0]=3 471 B16R2.2945 C1=CC=C(C=C1)[Si](C2=CC=CC=C2)(O)O D154568 [0,2,0,0,0,0|1,0,0]=3 472 B16R2.2945 C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(Cl)Cl D114143 [0,2,0,0,0,0|1,0,0]=3 473 B16R2.2945 CC(C)(C1=CC=CC=C1)C2=CC=CC=C2 D120343 [0,2,0,0,0,0|1,0,0]=3 474 B16R2.2945 CC(C1=CC=CC=C1)(C2=CC=CC=C2)O D154163 [0,2,0,0,0,0|1,0,0]=3 475 B16R2.2945 CP(=O)(C1=CC=CC=C1)C2=CC=CC=C2 M137520 [0,2,0,0,0,0|1,0,0]=3 476 B16R2.2945 C[P+](C)(C1=CC=CC=C1)C2=CC=CC=C2 D281995 [0,2,0,0,0,0|1,0,0]=3 477 B16R2.2945 C[Si](C)(C1=CC=CC=C1)C2=CC=CC=C2 D155479 [0,2,0,0,0,0|1,0,0]=3 478 B16R2.2945 C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl C472883 [0,2,0,0,0,0|1,0,0]=3 479 B16R2.2945 C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl M132474 [0,2,0,0,0,0|1,0,0]=3 480 B16R2.2945 C[Si](C1=CC=CC=C1)(C2=CC=CC=C2)Cl M591279 [0,2,0,0,0,0|1,0,0]=3 481 B14R2.7150 C=CCC1=CC=CC2=CC=CC=C21 A133081 [0,0,1,1,0,0|1,0,1]=4 482 B14R3.2 C1=CC=C2C(=C1)C3=CC=CC=C23 B169102 [0,0,0,1,1,0|0,0,0]=2 483 B16R3.9 C1=CC=C2C(=C1)C=CC3=C2C=CC=N3 B152686 [0,0,0,1,0,1|2,0,0]=4 484 B16R3.9 C1=CC=C2C(=C1)C=CC3=C2N=CC=C3 B152687 [0,0,0,1,0,1|2,0,0]=4 485 B16R3.9 C1=CC=C2C(=C1)C=CC3=CC=CC=C32 P109245 [0,0,0,1,0,1|1,0,0]=3 486 B16R3.9 C1=CC=C2C(=C1)C=CC3=CC=CC=C32 P109246 [0,0,0,1,0,1|1,0,0]=3 487 B16R3.9 C1=CC=C2C(=C1)C=CC3=CC=CC=C32 P109247 [0,0,0,1,0,1|1,0,0]=3 488 B16R3.9 C1=CC=C2C(=C1)C=CC3=CC=CC=C32 P109249 [0,0,0,1,0,1|1,0,0]=3 489 B16R3.9 C1=CC=C2C(=C1)C=CC3=CC=CC=C32 P109250 [0,0,0,1,0,1|1,0,0]=3 490 B16R3.9 C1=CC=C2C(=C1)C=CC3=CC=CC=C32 P140547 [0,0,0,1,0,1|1,0,0]=3 491 B16R3.9 C1=CC=C2C(=C1)C=NC3=CC=CC=C23 P160094 [0,0,0,1,0,1|1,0,0]=3 492 B16R3.9 C1CC2=CC=CC=C2C3=CC=CC=C31 D120010 [0,0,0,1,0,1|1,0,0]=3 493 B16R3.2583 C1=CC2=C(C3=C(N2)C=CC(=C3)Br)N=C1 B152142 [0,1,0,1,0,0|2,0,0]=4 494 B16R3.2583 C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)Br B118428 [0,1,0,1,0,0|1,0,0]=3 495 B16R3.2583 C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)Br B395761 [0,1,0,1,0,0|1,0,0]=3 496 B16R3.2583 C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)F F156590 [0,1,0,1,0,0|1,0,0]=3 497 B16R3.2583 C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)I I157687 [0,1,0,1,0,0|1,0,0]=3 498 B16R3.2583 C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)O H331392 [0,1,0,1,0,0|1,0,0]=3 499 B16R3.2583 C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)Br B134874 [0,1,0,1,0,0|0,0,0]=2 500 B16R3.2583 C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)Br B398413 [0,1,0,1,0,0|0,0,0]=2 501 B16R3.2583 C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)I I157474 [0,1,0,1,0,0|0,0,0]=2 502 B16R3.2583 C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)N A356417 [0,1,0,1,0,0|0,0,0]=2 503 B16R3.2583 C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)O H398481 [0,1,0,1,0,0|0,0,0]=2 504 B16R3.2583 C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)Br B121514 [0,1,0,1,0,0|0,1,0]=3 505 B16R3.2583 C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)Br B398441 [0,1,0,1,0,0|0,1,0]=3 506 B16R3.2583 C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)I I157491 [0,1,0,1,0,0|0,1,0]=3 507 B16R3.2583 C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)N D404272 [0,1,0,1,0,0|0,1,0]=3 508 B16R3.2583 C1=CC=C2C(=C1)C3=CC(=NC=C3N2)N A151563 [0,1,0,1,0,0|2,0,0]=4 509 B16R3.2583 CC1=CC2=C(C=C1)NC3=CC=CC=C32 M158783 [0,1,0,1,0,0|1,0,0]=3 510 B16R3.2637 C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)Br B152010 [0,1,0,1,0,0|1,0,0]=3 511 B16R3.2637 C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)Cl C153921 [0,1,0,1,0,0|1,0,0]=3 512 B16R3.2637 C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)F F303627 [0,1,0,1,0,0|1,0,0]=3 513 B16R3.2637 C1=CC=C2C(=C1)C3=C(N2)C=C(C=C3)O H359431 [0,1,0,1,0,0|1,0,0]=3 514 B16R3.2637 C1=CC=C2C(=C1)C3=C(N2)N=C(C=C3)N A169118 [0,1,0,1,0,0|2,0,0]=4 515 B16R3.2637 C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)Br B152999 [0,1,0,1,0,0|0,0,0]=2 516 B16R3.2637 C1=CC=C2C(=C1)C3=C(O2)C=C(C=C3)N D184410 [0,1,0,1,0,0|0,0,0]=2 517 B16R3.2637 C1=CC=C2C(=C1)C3=C(S2)C=C(C=C3)Br B405266 [0,1,0,1,0,0|0,1,0]=3 518 B16R3.2637 C1C2=CC=CC=C2C3=C1C=C(C=C3)Br B107656 [0,1,0,1,0,0|1,0,0]=3 519 B16R3.2637 C1C2=CC=CC=C2C3=C1C=C(C=C3)F F156609 [0,1,0,1,0,0|1,0,0]=3 520 B16R3.2637 C1C2=CC=CC=C2C3=C1C=C(C=C3)I I123288 [0,1,0,1,0,0|1,0,0]=3 521 B16R3.2637 C1C2=CC=CC=C2C3=C1C=C(C=C3)I I298606 [0,1,0,1,0,0|1,0,0]=3 522 B16R3.2637 C1C2=CC=CC=C2C3=C1C=C(C=C3)N A103032 [0,1,0,1,0,0|1,0,0]=3 523 B16R3.2637 C1C2=CC=CC=C2C3=C1C=C(C=C3)O H137128 [0,1,0,1,0,0|1,0,0]=3 524 B16R3.27838 C1=CC=C2C(=C1)C3=C(N2)C=CC=C3Br B152017 [0,1,0,1,0,0|1,0,0]=3 525 B16R3.27838 C1=CC=C2C(=C1)C3=C(N2)C=CC=C3O H123286 [0,1,0,1,0,0|1,0,0]=3 526 B16R3.27838 C1=CC=C2C(=C1)C3=C(O2)C=CC=C3Br B405337 [0,1,0,1,0,0|0,0,0]=2 527 B16R3.27838 C1=CC=C2C(=C1)C3=C(O2)C=CC=C3Cl C304762 [0,1,0,1,0,0|0,0,0]=2 528 B16R3.27838 C1=CC=C2C(=C1)C3=C(S2)C=CC=C3Br B405368 [0,1,0,1,0,0|0,1,0]=3 529 B16R3.1720 C1=CC=C2C(=C1)C=C3C=CC=CC3=N2 A106024 [0,1,0,1,0,0|1,0,0]=3 530 B16R3.1720 C1=CC=C2C(=C1)C=C3C=CC=CC3=N2 A109213 [0,1,0,1,0,0|1,0,0]=3 531 B16R3.1720 C1=CC=C2C(=C1)N=C3C=CC=CC3=N2 P104715 [0,1,0,1,0,0|1,0,0]=3 532 B16R3.1720 C1=CC=C2C(=C1)NC3=C(S2)C=CC=N3 H132908 [0,1,0,1,0,0|1,1,0]=4 533 B16R3.1720 C1=CC=C2C(=C1)NC3=CC=CC=C3N2 D589653 [0,1,0,1,0,0|1,0,0]=3 534 B16R3.1720 C1=CC=C2C(=C1)NC3=CC=CC=C3O2 P100418 [0,1,0,1,0,0|0,0,0]=2 535 B16R3.1720 C1=CC=C2C(=C1)NC3=CC=CC=C3S2 P108681 [0,1,0,1,0,0|0,1,0]=3 536 B16R3.1720 C1=CC=C2C(=C1)NC3=CC=CC=C3S2 P108682 [0,1,0,1,0,0|0,1,0]=3 537 B16R3.1720 C1=CC=C2C(=C1)OC3=CC=CC=C3O2 D154544 [0,1,0,1,0,0|0,0,0]=2 538 B16R3.1720 C1=CC=C2C(=C1)OC3=CC=CC=C3S2 P160095 [0,1,0,1,0,0|0,0,0]=2 539 B16R3.1720 C1=CC=C2C(=C1)SC3=CC=CC=C3S2 T101325 [0,1,0,1,0,0|0,1,0]=3 540 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A108699 [0,1,0,1,0,0|1,0,0]=3 541 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A108700 [0,1,0,1,0,0|1,0,0]=3 542 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A108701 [0,1,0,1,0,0|1,0,0]=3 543 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A108702 [0,1,0,1,0,0|1,0,0]=3 544 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A108703 [0,1,0,1,0,0|1,0,0]=3 545 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A119534 [0,1,0,1,0,0|1,0,0]=3 546 B16R3.1720 C1=CC=C2C=C3C=CC=CC3=CC2=C1 A305166 [0,1,0,1,0,0|1,0,0]=3 547 B16R3.1720 C1C2=CC=CC=C2CC3=CC=CC=C31 D155012 [0,1,0,1,0,0|1,0,0]=3 548 B16R3.1720 C1C2=CC=CC=C2NC3=CC=CC=C31 D156017 [0,1,0,1,0,0|1,0,0]=3 549 B16R3.1720 C1C2=CC=CC=C2OC3=CC=CC=C31 X109747 [0,1,0,1,0,0|0,0,0]=2 550 B16R3.1720 c1ccc2cc3ccccc3cc2c1 A140630 [0,1,0,1,0,0|1,0,0]=3 551 B16R3.3329 C1=CC=C2C(=C1)C3=C(N2)C(=CC=C3)Br B152021 [0,1,0,1,0,0|1,0,0]=3 552 B16R3.3329 C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)Br B136935 [0,1,0,1,0,0|0,0,0]=2 553 B16R3.3329 C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)I I157473 [0,1,0,1,0,0|0,0,0]=2 554 B16R3.3329 C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)N D404275 [0,1,0,1,0,0|0,0,0]=2 555 B16R3.3329 C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)Cl C153538 [0,1,0,1,0,0|2,0,0]=4 556 B16R3.3329 C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)Br B152940 [0,1,0,1,0,0|0,1,0]=3 557 B16R3.3329 C1=CC=C2C(=C1)C3=C(S2)C(=CC=C3)I I124311 [0,1,0,1,0,0|0,1,0]=3 558 B16R3.3329 CC1=C2C(=CC=C1)C3=CC=CC=C3N2 M404767 [0,1,0,1,0,0|1,0,0]=3 559 B16R3.3329 CC1=C2C(=CC=C1)C3=CC=CC=C3S2 W136027 [0,1,0,1,0,0|0,1,0]=3 560 B16R3.3329 CC1=NC=CC2=C1NC3=CC=CC=C23 H135153 [0,1,0,1,0,0|2,0,0]=4 561 B16R3.20606 C1=CC=C2C(=C1)C(C3=CC=CC=C32)Br B121493 [0,1,0,1,0,0|1,0,0]=3 562 B16R3.20606 C1=CC=C2C(=C1)C(C3=CC=CC=C32)N H293869 [0,1,0,1,0,0|1,0,0]=3 563 B16R3.20606 C1=CC=C2C(=C1)C(C3=CC=CC=C32)O H101956 [0,1,0,1,0,0|1,0,0]=3 564 B16R3.20606 C1=CC=C2C(=C1)C3=CC=CC=C3C2=O F109047 [0,1,0,1,0,0|1,0,0]=3 565 B16R3.20606 CC1C2=CC=CC=C2C3=CC=CC=C13 M169040 [0,1,0,1,0,0|1,0,0]=3 566 B16R3.20606 CN1C2=CC=CC=C2C3=C1C=NC=C3 M158253 [0,1,0,1,0,0|2,0,0]=4 567 B16R3.20606 CN1C2=CC=CC=C2C3=CC=CC=C31 M158780 [0,1,0,1,0,0|1,0,0]=3 568 B12R2.2 C1=CC(=CN=C1)C2=CC=CS2 T135355 [0,0,0,0,2,0|2,0,0]=4 569 B12R2.2 C1=CC=C(C=C1)C2=CC=CN2 P588646 [0,0,0,0,2,0|1,0,0]=3 570 B12R2.2 C1=CC=C(C=C1)C2=CC=CS2 P123203 [0,0,0,0,2,0|1,0,0]=3 571 B12R2.2 C1=CC=C(C=C1)C2=CC=NN2 P124738 [0,0,0,0,2,0|2,0,0]=4 572 B12R2.2 C1=CC=C(C=C1)C2=CC=NO2 P160176 [0,0,0,0,2,0|2,0,0]=4 573 B12R2.2 C1=CC=C(C=C1)C2=CN=CN2 P135879 [0,0,0,0,2,0|2,0,0]=4 574 B12R2.2 C1=CC=C(C=C1)C2=CSC=C2 P160670 [0,0,0,0,2,0|1,0,0]=3 575 B12R2.2 C1=CC=C(C=C1)C2=NC=CN2 P124054 [0,0,0,0,2,0|2,0,0]=4 576 B12R2.2 C1=CC=C(C=C1)C2=NC=CS2 P305244 [0,0,0,0,2,0|2,0,0]=4 577 B12R2.2 C1=CC=C(C=C1)N2C=CC=C2 P160301 [0,0,0,0,2,0|1,0,0]=3 578 B12R2.2 C1=CC=C(C=C1)N2C=CC=N2 P160449 [0,0,0,0,2,0|2,0,0]=4 579 B12R2.2 C1=CC=C(C=C1)N2C=CN=C2 P160275 [0,0,0,0,2,0|2,0,0]=4 580 B12R2.2 C1=CC=C(C=C1)N2C=CN=C2 P404962 [0,0,0,0,2,0|2,0,0]=4 581 B12R2.2 C1=CC=NC(=C1)C2=CC=CN2 H587650 [0,0,0,0,2,0|2,0,0]=4 582 B12R2.2 C1=CC=NC(=C1)C2=CC=CS2 T133377 [0,0,0,0,2,0|2,0,0]=4 583 B12R2.2 C1=CC=NC(=C1)C2=CSC=C2 T132077 [0,0,0,0,2,0|2,0,0]=4 584 B16R2.2256 C1=CC=C(C=C1)C=NNC2=CC=CC=C2 B152169 [0,0,0,0,0,2|1,0,0]=3 585 B16R2.2256 C1=CC=C(C=C1)CCCC2=CC=CC=C2 D155045 [0,0,0,0,0,2|1,0,0]=3 586 B16R2.2256 C1=CC=C(C=C1)CCCC2=CC=CC=N2 P160498 [0,0,0,0,0,2|2,0,0]=4 587 B16R2.2256 C1=CC=C(C=C1)CCCC2=CC=NC=C2 P160500 [0,0,0,0,0,2|2,0,0]=4 588 B16R2.2256 C1=CC=C(C=C1)CCOC2=CC=CC=C2 P193264 [0,0,0,0,0,2|0,0,0]=2 589 B16R2.2256 C1=CC=C(C=C1)CN=CC2=CC=CC=C2 N343630 [0,0,0,0,0,2|1,0,0]=3 590 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=C2 D108479 [0,0,0,0,0,2|1,0,0]=3 591 B16R2.2256 C1=CC=C(C=C1)CNCC2=CC=CC=C2 D396173 [0,0,0,0,0,2|1,0,0]=3 592 B16R2.2256 C1=CC=C(C=C1)COCC2=CC=CC=C2 D107584 [0,0,0,0,0,2|0,0,0]=2 593 B16R2.2256 C1=CC=C(C=C1)CSCC2=CC=CC=C2 D100593 [0,0,0,0,0,2|0,1,0]=3 594 B16R2.2256 C1=CC=C(C=C1)NC=NC2=CC=CC=C2 N159245 [0,0,0,0,0,2|1,0,0]=3 595 B16R2.2256 C1=CC=C(C=C1)NN=NC2=CC=CC=C2 D330873 [0,0,0,0,0,2|1,0,0]=3 596 B16R2.2256 C1=CC=C(C=C1)OCOC2=CC=CC=C2 D155931 [0,0,0,0,0,2|0,0,0]=2 597 B16R2.2256 C1=CC=C(C=C1)SCSC2=CC=CC=C2 B140293 [0,0,0,0,0,2|0,1,0]=3