0 B8R1.4 BrC1=CC(I)=NC=C1 A10666 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.4 CC1=CC(I)=NC=C1 D87895 [0,0,0,0,0,0|2,0,0]=2 2 B8R1.4 CC1=CC=NC(I)=N1 N13215 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.4 CC1=NC(N)=CN=N1 D86296 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.4 C[C@H]1CC(=O)C=CO1 F50263 [0,0,0,0,0,0|1,0,3]=4 5 B8R1.4 ClC1=CC(I)=NC=N1 A51177 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.4 ClC1=CC=NC(Br)=N1 81850 [0,0,0,0,0,0|4,0,0]=4 7 B8R1.4 FC1=NC=CC(Br)=N1 AT18301 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.4 NC1=CC=CC(=S)N1 C15708 [0,0,0,0,0,0|2,1,0]=3 9 B8R1.4 O=C1C=C(S)NC=N1 FD7370 [0,0,0,0,0,0|3,0,1]=4 10 B8R1.4 O=C1C=CNC(=O)O1 C15625 [0,0,0,0,0,0|3,0,1]=4 11 B8R1.4 OC1=CC(I)=CN=C1 D74429 [0,0,0,0,0,0|2,0,0]=2 12 B8R1.4 SC1=CC(Br)=CN=C1 P12662 [0,0,0,0,0,0|2,1,0]=3 13 B8R1.4 [2H]C1=CC=CC([2H])=C1 D99674 [0,0,0,0,0,0|2,0,0]=2 14 B8R1.4 [2H]C1=CC=CC([2H])=N1 D98925 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.4 [O-][N+]1=CN=CC(O)=C1 F17903 [0,0,0,0,0,0|3,0,0]=3 16 B7R1.3 ClC1=CC=NC=C1 F17303 [1,0,0,0,0,0|2,0,0]=3 17 B7R1.3 ClC1=CN=NC=C1 F19795 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.3 ClC1=NC=CC=N1 F20795 [1,0,0,0,0,0|3,0,0]=4 19 B7R1.3 ClC1=NC=NC=C1 F18311 [1,0,0,0,0,0|3,0,0]=4 20 B7R1.3 FC1=CC=NC=C1 F19691 [1,0,0,0,0,0|2,0,0]=3 21 B7R1.3 FC1=CN=CN=C1 F14737 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [1,0,0,0,0,0|1,0,0]=2 23 B7R1.3 IC1=NC=NC=C1 C15557 [1,0,0,0,0,0|3,0,0]=4 24 B7R1.3 OC1=CN=NC=C1 O12057 [1,0,0,0,0,0|2,0,0]=3 25 B7R1.3 SC1=NN=CC=C1 AT13031 [1,0,0,0,0,0|2,1,0]=4 26 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [1,0,0,0,0,0|1,0,0]=2 27 B7R1.3 [2H]C1=CC=CC=C1 D98570 [1,0,0,0,0,0|1,0,0]=2 28 B7R1.3 [2H]C1=CC=NC=C1 D98795 [1,0,0,0,0,0|2,0,0]=3 29 B7R1.3 [2H]C1=NC=CC=C1 D98277 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.2 C#CC1=CC(C)=CN=C1 AT12963 [0,1,0,0,0,0|2,0,0]=3 31 B9R1.2 C#CC1=CC=CC(N)=N1 C73323 [0,1,0,0,0,0|2,0,1]=4 32 B9R1.2 C#CC1=CN=CC(N)=C1 C76102 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.2 C#CC1=NC(C)=CC=N1 AT18275 [0,1,0,0,0,0|3,0,0]=4 34 B9R1.2 CC1=CC(C=O)=NC=N1 AT18315 [0,1,0,0,0,0|2,0,1]=4 35 B9R1.2 CC1=CC(CBr)=CN=C1 43925 [0,1,0,0,0,0|2,0,0]=3 36 B9R1.2 CC1=CC(CCl)=NC=N1 F52607 [0,1,0,0,0,0|3,0,0]=4 37 B9R1.2 CC1=CC(CN)=NC=N1 AT18324 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.2 CC1=CC=NC(CCl)=N1 P10964 [0,1,0,0,0,0|3,0,0]=4 39 B9R1.2 CC1=CC=NC(CN)=N1 P10960 [0,1,0,0,0,0|3,0,0]=4 40 B9R1.2 CC1=CN=CC(CCl)=N1 O10514 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.2 CC1=CN=CC(CCl)=N1 Y10493 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.2 CC1=CN=CC(CO)=N1 O10143 [0,1,0,0,0,0|2,0,0]=3 43 B9R1.2 CC1=CN=NC(CN)=C1 P13788 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.2 CC1=NC=CC(CCl)=N1 F53395 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.2 CC1=NC=CC(CN)=N1 F14224 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.2 CC1=NC=CC(NN)=C1 F16202 [0,1,0,0,0,0|2,0,0]=3 47 B9R1.2 CCC1=CC(Cl)=NN=C1 S11387 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.2 CCC1=NC=CC(Cl)=N1 W12562 [0,1,0,0,0,0|3,0,0]=4 49 B9R1.2 CNC1=CC(Br)=NC=N1 AT18306 [0,1,0,0,0,0|3,0,0]=4 50 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [0,1,0,0,0,0|2,0,0]=3 51 B9R1.2 COC1=CC(O)=NC=C1 F17762 [0,1,0,0,0,0|1,0,0]=2 52 B9R1.2 COC1=CCC=C(C)C1 AC4015 [0,1,0,0,0,0|0,0,2]=3 53 B9R1.2 COC1=CN=CC(N)=C1 P11509 [0,1,0,0,0,0|2,0,0]=3 54 B9R1.2 CSC1=CC(Cl)=CN=C1 AT19857 [0,1,0,0,0,0|2,0,0]=3 55 B9R1.2 CSC1=CN=CC(Cl)=N1 AT24641 [0,1,0,0,0,0|3,0,0]=4 56 B9R1.2 CSC1=NC(N)=NC=C1 AT18329 [0,1,0,0,0,0|3,0,0]=4 57 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.2 ClC1=NC=CC(CBr)=N1 F12213 [0,1,0,0,0,0|3,0,0]=4 60 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [0,1,0,0,0,0|2,0,0]=3 61 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [0,1,0,0,0,0|2,0,0]=3 62 B9R1.2 FCC1=CC(Cl)=NC=N1 82110 [0,1,0,0,0,0|3,0,0]=4 63 B9R1.2 N#CC1=CC(I)=NC=C1 A11430 [0,1,0,0,0,0|2,0,1]=4 64 B9R1.2 N#CC1=NC=CC(I)=C1 P10625 [0,1,0,0,0,0|2,0,1]=4 65 B9R1.2 NC1=NC=CC(C=O)=C1 O10660 [0,1,0,0,0,0|2,0,1]=4 66 B9R1.2 NCC1=CC(=O)NC=C1 37540 [0,1,0,0,0,0|1,0,1]=3 67 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [0,1,0,0,0,0|2,0,0]=3 68 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [0,1,0,0,0,0|2,0,0]=3 69 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [0,1,0,0,0,0|2,0,0]=3 70 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [0,1,0,0,0,0|2,0,0]=3 71 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [0,1,0,0,0,0|1,0,0]=2 72 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [0,1,0,0,0,0|1,0,0]=2 73 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [0,1,0,0,0,0|2,0,0]=3 74 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [0,1,0,0,0,0|2,0,0]=3 75 B9R1.2 NCC1=NC=CC(N)=C1 77886 [0,1,0,0,0,0|2,0,0]=3 76 B9R1.2 NNC1=CC=NC(O)=N1 S10644 [0,1,0,0,0,0|3,0,0]=4 77 B9R1.2 NNC1=NC(N)=CC=C1 C91519 [0,1,0,0,0,0|3,0,0]=4 78 B9R1.2 O=CC1=CC(I)=CN=C1 H10413 [0,1,0,0,0,0|2,0,1]=4 79 B9R1.2 OCC1=CC(O)=NC=N1 59935 [0,1,0,0,0,0|2,0,0]=3 80 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [0,1,0,0,0,0|1,0,0]=2 81 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 96310 [0,1,0,0,0,0|1,0,1]=3 82 B9R1.3 CC1=C(Br)C(=O)NC=C1 29620 [0,1,0,0,0,0|1,0,1]=3 83 B9R1.3 CC1=C(F)C(=O)NC=N1 54993 [0,1,0,0,0,0|2,0,1]=4 84 B9R1.3 CC1=C(F)C(Br)=NC=N1 54994 [0,1,0,0,0,0|3,0,0]=4 85 B9R1.3 CC1=C(F)C(Cl)=NC=N1 C77032 [0,1,0,0,0,0|3,0,0]=4 86 B9R1.3 CC1=C(F)C=NC=C1O AC4170 [0,1,0,0,0,0|2,0,0]=3 87 B9R1.3 CC1=C(I)C(=O)C=CN1 D84797 [0,1,0,0,0,0|1,0,1]=3 88 B9R1.3 CC1=C(N)C(Cl)=NC=N1 W15310 [0,1,0,0,0,0|3,0,0]=4 89 B9R1.3 CC1=CC=CC(S)=C1C F20973 [0,1,0,0,0,0|0,1,0]=2 90 B9R1.3 CC1=CC=CC(S)=C1N AT19641 [0,1,0,0,0,0|0,1,0]=2 91 B9R1.3 CC1=CC=NC(C)=C1O F17537 [0,1,0,0,0,0|2,0,0]=3 92 B9R1.3 CC1=CC=NC(Cl)=C1I H11415 [0,1,0,0,0,0|2,0,0]=3 93 B9R1.3 CC1=CC=NC(F)=C1I AT21585 [0,1,0,0,0,0|2,0,0]=3 94 B9R1.3 CC1=CC=NC(N)=C1Cl D71951 [0,1,0,0,0,0|2,0,0]=3 95 B9R1.3 CC1=CC=NC(N)=C1I 65853 [0,1,0,0,0,0|2,0,0]=3 96 B9R1.3 CC1=CN=NC(N)=C1Br AT10447 [0,1,0,0,0,0|3,0,0]=4 97 B9R1.3 CC1=NC=CC(Cl)=C1N O11210 [0,1,0,0,0,0|2,0,0]=3 98 B9R1.3 CC1=NC=CC(N)=C1Br D96170 [0,1,0,0,0,0|2,0,0]=3 99 B9R1.3 CC1=NC=C[N+]([O-])=C1Cl F18066 [0,1,0,0,0,0|2,0,1]=4 100 B9R1.3 CC1=NC=NC(C)=C1N AT18386 [0,1,0,0,0,0|3,0,0]=4 101 B9R1.3 CN1C=CN=C(Cl)C1=O AT19208 [0,1,0,0,0,0|3,0,0]=4 102 B9R1.3 CN1C=CN=C(N)C1=O AT13880 [0,1,0,0,0,0|3,0,0]=4 103 B9R1.3 CN1N=CC=C(Cl)C1=O 55553 [0,1,0,0,0,0|3,0,0]=4 104 B9R1.3 ClC1=CC=NC(Br)=C1I C11069 [0,1,0,0,0,0|3,0,0]=4 105 B9R1.3 ClC1=CN=CC(Br)=C1Br O10907 [0,1,0,0,0,0|3,0,0]=4 106 B9R1.3 FC1=CC=CC(Br)=C1S AT20836 [0,1,0,0,0,0|2,0,0]=3 107 B9R1.3 FC1=CC=CC(Cl)=C1S AT20825 [0,1,0,0,0,0|2,0,0]=3 108 B9R1.3 FC1=CN=CC(F)=C1Br 24292 [0,1,0,0,0,0|3,0,0]=4 109 B9R1.3 FC1=CN=CC(F)=C1F C76146 [0,1,0,0,0,0|3,0,0]=4 110 B9R1.3 F[N+]1=C(Cl)C=CC=C1Cl C14552 [0,1,0,0,0,0|3,0,0]=4 111 B9R1.3 NC1=C(F)C(=O)NC=C1 F18691 [0,1,0,0,0,0|2,0,1]=4 112 B9R1.3 NC1=C(S)C=CC=C1F C16304 [0,1,0,0,0,0|1,1,0]=3 113 B9R1.3 NC1=CC=CC(Cl)=C1S AT19651 [0,1,0,0,0,0|2,0,0]=3 114 B9R1.3 NC1=CC=CC(I)=C1Cl D96226 [0,1,0,0,0,0|2,0,0]=3 115 B9R1.3 NC1=CC=CC(N)=C1N C75845 [0,1,0,0,0,0|2,0,0]=3 116 B9R1.3 NC1=CC=CC(N)=C1O O10621 [0,1,0,0,0,0|2,0,0]=3 117 B9R1.3 NC1=CC=CC(O)=C1O 30915 [0,1,0,0,0,0|1,0,0]=2 118 B9R1.3 NC1=NC=CC(N)=C1N 98115 [0,1,0,0,0,0|3,0,0]=4 119 B9R1.3 NC1=NC=CC(N)=C1N CS1386 [0,1,0,0,0,0|3,0,0]=4 120 B9R1.3 O=C1NC=CC(Br)=C1Br 91734 [0,1,0,0,0,0|2,0,1]=4 121 B9R1.3 OC1=CC=CC(I)=C1O D82483 [0,1,0,0,0,0|1,0,0]=2 122 B9R1.3 OC1=CC=NC(F)=C1Cl 91690 [0,1,0,0,0,0|2,0,0]=3 123 B9R1.3 OC1=CN=CC(Br)=C1F N16972 [0,1,0,0,0,0|2,0,0]=3 124 B9R1.3 OC1=NC=NC(O)=C1Cl S10271 [0,1,0,0,0,0|3,0,0]=4 125 B9R1.3 [2H]C1=CC=CC(I)=C1[2H] D97970 [0,1,0,0,0,0|2,0,0]=3 126 B9R1.34 CC1=CC(Cl)=CC(F)=N1 91500 [0,1,0,0,0,0|2,0,0]=3 127 B9R1.34 CC1=CC(F)=CC(F)=N1 C16435 [0,1,0,0,0,0|2,0,0]=3 128 B9R1.34 CC1=CC(F)=NC(N)=N1 92215 [0,1,0,0,0,0|3,0,0]=4 129 B9R1.34 CC1=CC(I)=CC(C)=N1 O11249 [0,1,0,0,0,0|2,0,0]=3 130 B9R1.34 CC1=CC(N)=CC(=O)O1 W11226 [0,1,0,0,0,0|1,0,1]=3 131 B9R1.34 CC1=CC(N)=CC(O)=N1 D80759 [0,1,0,0,0,0|1,0,0]=2 132 B9R1.34 CC1=CC(O)=CC(Cl)=N1 C15794 [0,1,0,0,0,0|1,0,0]=2 133 B9R1.34 ClC1=CC(I)=CC(Br)=N1 AT13204 [0,1,0,0,0,0|3,0,0]=4 134 B9R1.34 NC1=CC(Br)=CC(F)=N1 E71786 [0,1,0,0,0,0|3,0,0]=4 135 B9R1.34 NC1=CC(Br)=CC(O)=C1 53862 [0,1,0,0,0,0|1,0,0]=2 136 B9R1.34 NC1=CC(I)=CC(I)=C1 59844 [0,1,0,0,0,0|2,0,0]=3 137 B9R1.34 NC1=CC(N)=NC(O)=N1 H10201 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.34 NC1=CC(O)=CC(O)=C1 11229 [0,1,0,0,0,0|1,0,0]=2 139 B9R1.34 OC1=CC(O)=NC(O)=N1 S12330 [0,1,0,0,0,0|3,0,0]=4 140 B9R1.34 SC1=CC(Br)=CC(Cl)=C1 AT20882 [0,1,0,0,0,0|1,1,0]=3 141 B9R1.34 SC1=CC(S)=CC(S)=C1 T70854 [0,1,0,0,0,0|1,1,0]=3 142 B9R1.34 [2H]C1=CC([2H])=CC(Cl)=C1 D99131 [0,1,0,0,0,0|2,0,0]=3 143 B9R1.34 [2H]C1=CC([2H])=CC(O)=C1 D99082 [0,1,0,0,0,0|1,0,0]=2 144 B9R1.34 [O-][N+]1=CC(O)=CC(Cl)=C1 AB22391 [0,1,0,0,0,0|2,0,0]=3 145 B9R1.69 BrC1=C(Br)C=C(I)C=C1 T73057 [0,1,0,0,0,0|2,0,0]=3 146 B9R1.69 BrC1=CN=C(I)C(Br)=C1 AT22131 [0,1,0,0,0,0|3,0,0]=4 147 B9R1.69 CC1=C(C)N=C(Br)C=C1 F16237 [0,1,0,0,0,0|2,0,0]=3 148 B9R1.69 CC1=C(C)N=C(O)C=C1 F51184 [0,1,0,0,0,0|1,0,0]=2 149 B9R1.69 CC1=C(C)NC(=O)C=C1 F52969 [0,1,0,0,0,0|1,0,1]=3 150 B9R1.69 CC1=C(Cl)C=C(Cl)C=N1 61810 [0,1,0,0,0,0|3,0,0]=4 151 B9R1.69 CC1=C(F)N=C(Br)C=C1 AT22416 [0,1,0,0,0,0|3,0,0]=4 152 B9R1.69 CC1=C(N)C=CC(S)=C1 AT20958 [0,1,0,0,0,0|0,1,0]=2 153 B9R1.69 CC1=C(O)N=C(Cl)N=C1 AC8001 [0,1,0,0,0,0|3,0,0]=4 154 B9R1.69 CC1=C(S)C=C(Br)C=C1 AT20875 [0,1,0,0,0,0|1,1,0]=3 155 B9R1.69 CC1=C(S)C=C(N)C=C1 AT20843 [0,1,0,0,0,0|1,1,0]=3 156 B9R1.69 CC1=C(S)C=CC(Br)=C1 AT20848 [0,1,0,0,0,0|1,0,0]=2 157 B9R1.69 CC1=CC(Br)=COC1=O E71746 [0,1,0,0,0,0|2,0,0]=3 158 B9R1.69 CC1=CC(Br)=NC=C1O 96317 [0,1,0,0,0,0|2,0,0]=3 159 B9R1.69 CC1=CC(Br)=NN=C1C AT17779 [0,1,0,0,0,0|3,0,0]=4 160 B9R1.69 CC1=CC(C)=C(N)N=N1 A51049 [0,1,0,0,0,0|3,0,0]=4 161 B9R1.69 CC1=CC(Cl)=NN=C1N AT17812 [0,1,0,0,0,0|3,0,0]=4 162 B9R1.69 CC1=CC(I)=C(Br)N=C1 I10150 [0,1,0,0,0,0|2,0,0]=3 163 B9R1.69 CC1=CC(I)=C(Cl)N=C1 I10136 [0,1,0,0,0,0|2,0,0]=3 164 B9R1.69 CC1=CC(I)=C(O)C=N1 96425 [0,1,0,0,0,0|2,0,0]=3 165 B9R1.69 CC1=CC(I)=NC=C1N 80294 [0,1,0,0,0,0|2,0,0]=3 166 B9R1.69 CC1=CC(N)=C(S)C=C1 AT19644 [0,1,0,0,0,0|1,0,0]=2 167 B9R1.69 CC1=CC(S)=C(Cl)C=C1 AT20814 [0,1,0,0,0,0|0,1,0]=2 168 B9R1.69 CC1=CC(S)=C(N)C=C1 AT19639 [0,1,0,0,0,0|0,1,0]=2 169 B9R1.69 CC1=CC(S)=C(N)C=C1 AT19640 [0,1,0,0,0,0|0,1,0]=2 170 B9R1.69 CC1=CC(S)=C(N)N=N1 P10200 [0,1,0,0,0,0|2,1,0]=4 171 B9R1.69 CC1=CC(S)=NN=C1C AT17808 [0,1,0,0,0,0|2,1,0]=4 172 B9R1.69 CC1=CC=C(Cl)N=C1Br O10690 [0,1,0,0,0,0|3,0,0]=4 173 B9R1.69 CC1=CC=C(I)C(=O)N1 93733 [0,1,0,0,0,0|1,0,1]=3 174 B9R1.69 CC1=CC=C(N)C(N)=N1 C16371 [0,1,0,0,0,0|2,0,0]=3 175 B9R1.69 CC1=CC=C(N)C(O)=N1 68793 [0,1,0,0,0,0|1,0,0]=2 176 B9R1.69 CC1=CN=C(Cl)C=C1F F18561 [0,1,0,0,0,0|3,0,0]=4 177 B9R1.69 CC1=CN=C(N)C(N)=C1 27799 [0,1,0,0,0,0|2,0,0]=3 178 B9R1.69 CC1=CN=C(O)C=C1C AT24357 [0,1,0,0,0,0|1,0,0]=2 179 B9R1.69 CC1=NC(=O)C(N)=CN1 O11345 [0,1,0,0,0,0|2,0,1]=4 180 B9R1.69 CC1=NC(Br)=CN=C1Br N13385 [0,1,0,0,0,0|3,0,0]=4 181 B9R1.69 CC1=NC(Cl)=C(I)C=N1 O11217 [0,1,0,0,0,0|3,0,0]=4 182 B9R1.69 CC1=[N+]([O-])C=C(F)C=C1 AC6175 [0,1,0,0,0,0|2,0,1]=4 183 B9R1.69 CC1=[N+]([O-])C=CC(Cl)=C1 AT14034 [0,1,0,0,0,0|2,0,0]=3 184 B9R1.69 CN1C=CC(=O)C=C1Br C73679 [0,1,0,0,0,0|2,0,1]=4 185 B9R1.69 ClC1=C(Br)C=C(Br)C=C1 N12666 [0,1,0,0,0,0|2,0,0]=3 186 B9R1.69 ClC1=C(Cl)N=C(Br)C=C1 N12997 [0,1,0,0,0,0|3,0,0]=4 187 B9R1.69 ClC1=CC=C(Br)N=C1Br C15980 [0,1,0,0,0,0|3,0,0]=4 188 B9R1.69 FC1=C(Br)C=C(S)C=C1 AT20850 [0,1,0,0,0,0|1,1,0]=3 189 B9R1.69 FC1=C(I)C=C(I)C=C1 AT18537 [0,1,0,0,0,0|2,0,0]=3 190 B9R1.69 FC1=C(S)C=C(Br)C=C1 AT20849 [0,1,0,0,0,0|1,1,0]=3 191 B9R1.69 FC1=C(S)C=C(Cl)C=C1 AT20862 [0,1,0,0,0,0|1,1,0]=3 192 B9R1.69 FC1=CC(Br)=C(S)C=C1 AT20837 [0,1,0,0,0,0|2,0,0]=3 193 B9R1.69 FC1=CC(Cl)=C(I)C=N1 O11206 [0,1,0,0,0,0|3,0,0]=4 194 B9R1.69 FC1=CC(I)=C(Br)N=C1 AT19915 [0,1,0,0,0,0|3,0,0]=4 195 B9R1.69 FC1=CC(I)=C(Cl)N=C1 O10733 [0,1,0,0,0,0|3,0,0]=4 196 B9R1.69 FC1=CC(S)=C(Br)C=C1 AT20853 [0,1,0,0,0,0|1,1,0]=3 197 B9R1.69 N=C1NC(O)=NC=C1F H10295 [0,1,0,0,0,0|3,0,0]=4 198 B9R1.69 NC1=C(Cl)C=C(O)C=N1 D87909 [0,1,0,0,0,0|2,0,0]=3 199 B9R1.69 NC1=C(F)C=C(Br)C=C1 36801 [0,1,0,0,0,0|2,0,0]=3 200 B9R1.69 NC1=C(I)C=C(Cl)C=C1 F13699 [0,1,0,0,0,0|2,0,0]=3 201 B9R1.69 NC1=C(I)C=NC(F)=C1 W19621 [0,1,0,0,0,0|3,0,0]=4 202 B9R1.69 NC1=C(O)C=CC(I)=C1 I10250 [0,1,0,0,0,0|2,0,0]=3 203 B9R1.69 NC1=C(S)C=C(Br)C=C1 AT20886 [0,1,0,0,0,0|1,1,0]=3 204 B9R1.69 NC1=C(S)C=CC(F)=C1 C90392 [0,1,0,0,0,0|2,0,0]=3 205 B9R1.69 NC1=CC(Br)=C(S)C=C1 AT20835 [0,1,0,0,0,0|2,0,0]=3 206 B9R1.69 NC1=CC(Cl)=C(S)C=C1 AT20821 [0,1,0,0,0,0|2,0,0]=3 207 B9R1.69 NC1=CC(F)=CN=C1O AT11534 [0,1,0,0,0,0|3,0,0]=4 208 B9R1.69 NC1=CC(F)=CNC1=O AT11533 [0,1,0,0,0,0|3,0,0]=4 209 B9R1.69 NC1=CC(I)=C(F)C=C1 98239 [0,1,0,0,0,0|2,0,0]=3 210 B9R1.69 NC1=CC(O)=C(Br)C=C1 C91066 [0,1,0,0,0,0|1,0,0]=2 211 B9R1.69 NC1=CC(S)=C(Cl)C=C1 AT20816 [0,1,0,0,0,0|1,1,0]=3 212 B9R1.69 NC1=CC=C(Br)C(=O)N1 AT18218 [0,1,0,0,0,0|2,0,1]=4 213 B9R1.69 NC1=CC=C(F)C(Cl)=N1 91518 [0,1,0,0,0,0|3,0,0]=4 214 B9R1.69 NC1=CC=C(F)C(F)=N1 N16971 [0,1,0,0,0,0|3,0,0]=4 215 B9R1.69 NC1=CN=C(Cl)C=C1N SC3001 [0,1,0,0,0,0|3,0,0]=4 216 B9R1.69 NC1=CNC(=O)C=C1Cl 94340 [0,1,0,0,0,0|2,0,1]=4 217 B9R1.69 NC1=NC(N)=C(Cl)C=C1 D87713 [0,1,0,0,0,0|3,0,0]=4 218 B9R1.69 O=C1C=C(Cl)C(Br)=CN1 C90977 [0,1,0,0,0,0|2,0,1]=4 219 B9R1.69 O=C1C=C(O)C(Cl)=CN1 43948 [0,1,0,0,0,0|2,0,0]=3 220 B9R1.69 O=C1OC=C(Br)C=C1Br 51893 [0,1,0,0,0,0|3,0,0]=4 221 B9R1.69 OC1=C(Br)C=NC(F)=C1 F30342 [0,1,0,0,0,0|2,0,0]=3 222 B9R1.69 OC1=C(Cl)N=C(Br)C=C1 F30996 [0,1,0,0,0,0|3,0,0]=4 223 B9R1.69 OC1=C(I)C=C(F)C=N1 D74689 [0,1,0,0,0,0|3,0,0]=4 224 B9R1.69 OC1=C(I)C=C(F)N=C1 AT19114 [0,1,0,0,0,0|3,0,0]=4 225 B9R1.69 OC1=C(I)C=CC(Cl)=N1 N10090 [0,1,0,0,0,0|2,0,0]=3 226 B9R1.69 OC1=C(I)C=NC(F)=C1 E71631 [0,1,0,0,0,0|2,0,0]=3 227 B9R1.69 OC1=CC(Br)=NC=C1Br 94341 [0,1,0,0,0,0|2,0,0]=3 228 B9R1.69 OC1=CC(Cl)=CN=C1Cl 92617 [0,1,0,0,0,0|2,0,0]=3 229 B9R1.69 OC1=CC(Cl)=CN=C1I C92793 [0,1,0,0,0,0|2,0,0]=3 230 B9R1.69 OC1=CC(F)=CN=C1I C91418 [0,1,0,0,0,0|2,0,0]=3 231 B9R1.69 OC1=CC(I)=C(F)C=C1 79298 [0,1,0,0,0,0|1,0,0]=2 232 B9R1.69 OC1=CC(S)=C(O)C=C1 79473 [0,1,0,0,0,0|1,0,0]=2 233 B9R1.69 OC1=NC(Br)=C(I)C=C1 N10163 [0,1,0,0,0,0|2,0,0]=3 234 B9R1.69 OC1=NC(Cl)=C(Br)C=C1 AC3279 [0,1,0,0,0,0|2,0,0]=3 235 B9R1.69 SC1=C(Br)C=CC(Cl)=C1 AT20839 [0,1,0,0,0,0|1,1,0]=3 236 B9R1.69 SC1=C(Cl)C=C(Br)C=C1 AT20954 [0,1,0,0,0,0|2,0,0]=3 237 B9R1.69 SC1=CC(Cl)=C(Br)C=C1 AT20846 [0,1,0,0,0,0|1,1,0]=3 238 B9R1.69 [BH3-]C1=C(F)C=NC(N)=C1 AC8350 [0,1,0,0,0,0|3,0,0]=4 239 B9R1.69 [O-][N+]1=C(Cl)C=C(I)C=C1 W15291 [0,1,0,0,0,0|3,0,0]=4 240 B9R1.69 [O-][N+]1=C(Cl)C=CC(Cl)=C1 32966 [0,1,0,0,0,0|2,0,1]=4 241 B9R1.69 [O-][N+]1=CC(Br)=C(Cl)C=C1 O10961 [0,1,0,0,0,0|2,0,1]=4 242 B7R0.2 C=CC(=O)C=C(C)C F12626 [0,0,1,0,0,0|0,0,2]=3 243 B7R0.2 CC\C(C)=C/C(=O)O 64163 [0,0,1,0,0,0|1,0,2]=4 244 B7R0.4 C=C(C)CC\C=C\C T72820 [0,0,1,0,0,0|1,0,2]=4 245 B7R0.4 CC\C=C/CC(=O)O F18341 [0,0,1,0,0,0|1,0,2]=4 246 B7R0.4 COC\C=C\C(=O)O P17072 [0,0,1,0,0,0|2,0,1]=4 247 B7R1.2 BrC1=CSC(I)=C1 F10349 [0,0,0,0,1,0|3,0,0]=4 248 B7R1.2 CC1=CC(Br)=CO1 I11460 [0,0,0,0,1,0|2,0,0]=3 249 B7R1.2 CC1=CC(N)=CS1 27442 [0,0,0,0,1,0|2,0,0]=3 250 B7R1.2 CC1=CC(N)=NS1 A51223 [0,0,0,0,1,0|3,0,0]=4 251 B7R1.2 CC1=CC=C(S)S1 AT16550 [0,0,0,0,1,0|1,1,0]=3 252 B7R1.2 CC1=CN=C(C)O1 AC5679 [0,0,0,0,1,0|3,0,0]=4 253 B7R1.2 CC1=CN=C(Cl)O1 AT18559 [0,0,0,0,1,0|3,0,0]=4 254 B7R1.2 CC1=CN=C(N)N1 27977 [0,0,0,0,1,0|3,0,0]=4 255 B7R1.2 CC1=COC(Br)=N1 AT18461 [0,0,0,0,1,0|3,0,0]=4 256 B7R1.2 CC1=COC(Cl)=N1 A51023 [0,0,0,0,1,0|3,0,0]=4 257 B7R1.2 CC1=CSC(N)=C1 N12877 [0,0,0,0,1,0|2,0,0]=3 258 B7R1.2 CC1=CSC(N)=C1 S11464 [0,0,0,0,1,0|2,0,0]=3 259 B7R1.2 CC1=CSC(S)=C1 AT16548 [0,0,0,0,1,0|1,1,0]=3 260 B7R1.2 CC1=NC(N)=CS1 AC2762 [0,0,0,0,1,0|3,0,0]=4 261 B7R1.2 CC1=NC=C(Br)O1 AT18670 [0,0,0,0,1,0|3,0,0]=4 262 B7R1.2 CC1=NC=C(Cl)S1 AT15021 [0,0,0,0,1,0|3,0,0]=4 263 B7R1.2 CC1=NC=C(N)S1 D85841 [0,0,0,0,1,0|3,0,0]=4 264 B7R1.2 CC1=NSC(I)=C1 W12926 [0,0,0,0,1,0|3,0,0]=4 265 B7R1.2 CC1=NSC(N)=C1 C77679 [0,0,0,0,1,0|3,0,0]=4 266 B7R1.2 CN1C=C(F)C=N1 D79458 [0,0,0,0,1,0|3,0,0]=4 267 B7R1.2 CN1C=CC(N)=C1 77871 [0,0,0,0,1,0|2,0,0]=3 268 B7R1.2 CN1C=C[N+](C)=C1 91466 [0,0,0,0,1,0|3,0,0]=4 269 B7R1.2 CN1C=NC(N)=C1 F13269 [0,0,0,0,1,0|3,0,0]=4 270 B7R1.2 ClC1=CC=C(I)S1 C74472 [0,0,0,0,1,0|3,0,0]=4 271 B7R1.2 ClC1=CSC(Br)=C1 AT16371 [0,0,0,0,1,0|3,0,0]=4 272 B7R1.2 NC1=CC=C(Cl)S1 D87671 [0,0,0,0,1,0|3,0,0]=4 273 B7R1.2 NC1=CSC(Cl)=C1 38492 [0,0,0,0,1,0|3,0,0]=4 274 B7R1.2 NC1=CSC(Cl)=C1 P13129 [0,0,0,0,1,0|3,0,0]=4 275 B7R1.2 O=C1C=C(O)CN1 F14818 [0,0,0,0,1,0|2,0,1]=4 276 B7R1.2 O=C1C=C[C@@H](O)C1 86326 [0,0,0,0,1,0|1,0,2]=4 277 B7R1.2 O=C1NC(O)=CS1 D73417 [0,0,0,0,1,0|3,0,0]=4 278 B7R1.2 [2H]C1=CC=C([2H])S1 D99575 [0,0,0,0,1,0|3,0,0]=4 279 B7R1.4 BrC1=C(I)C=CS1 AT16380 [0,0,0,0,1,0|3,0,0]=4 280 B7R1.4 CC1=C(Br)C=NN1 O11185 [0,0,0,0,1,0|3,0,0]=4 281 B7R1.4 CC1=C(Br)OC=C1 F53471 [0,0,0,0,1,0|2,0,0]=3 282 B7R1.4 CC1=C(I)NN=C1 72687 [0,0,0,0,1,0|3,0,0]=4 283 B7R1.4 CC1=C(N)C=NO1 AT19805 [0,0,0,0,1,0|3,0,0]=4 284 B7R1.4 CC1=C(N)N=CN1 C15418 [0,0,0,0,1,0|3,0,0]=4 285 B7R1.4 CC1=C(N)NN=C1 P11216 [0,0,0,0,1,0|3,0,0]=4 286 B7R1.4 CC1=C(S)C=CS1 A10974 [0,0,0,0,1,0|1,1,0]=3 287 B7R1.4 CC1=CNN=C1I 72684 [0,0,0,0,1,0|3,0,0]=4 288 B7R1.4 CC1=NNC=C1Cl AT10929 [0,0,0,0,1,0|3,0,0]=4 289 B7R1.4 CC1=NOC=C1N AT19806 [0,0,0,0,1,0|3,0,0]=4 290 B7R1.4 CN1N=CC=C1Cl AT15843 [0,0,0,0,1,0|3,0,0]=4 291 B7R1.4 NC1=C(Br)C=CS1 C16366 [0,0,0,0,1,0|3,0,0]=4 292 B7R1.4 NC1=C(Cl)SC=C1 AT16569 [0,0,0,0,1,0|3,0,0]=4 293 B6R0.2 C\C(I)=C\C(=O)O W11497 [1,0,1,0,0,0|2,0,0]=4 294 B6R0.4 C=C\C=C/C(=O)O C74528 [1,0,1,0,0,0|1,0,0]=3 295 B6R0.4 C=C\C=C\C(=O)O 35918 [1,0,1,0,0,0|1,0,0]=3 296 B6R0.6 O=C\C=C\C=C\[O-] 98104 [1,0,1,0,0,0|1,0,1]=4 297 B8R1.2 BrCC1=CN=CN=C1 F52462 [1,1,0,0,0,0|2,0,0]=4 298 B8R1.2 BrCC1=NC=CC=N1 D79434 [1,1,0,0,0,0|2,0,0]=4 299 B8R1.2 C=CC1=CC=CN=C1 71366 [1,1,0,0,0,0|1,0,1]=4 300 B8R1.2 CNC1=CC=CN=N1 79165 [1,1,0,0,0,0|2,0,0]=4 301 B8R1.2 CSC1=NC=CC=N1 O10841 [1,1,0,0,0,0|2,0,0]=4 302 B8R1.2 ClCC1=NC=NC=C1 A10562 [1,1,0,0,0,0|2,0,0]=4 303 B8R1.2 NCC1=CC=CC=C1 T70846 [1,1,0,0,0,0|0,0,0]=2 304 B8R1.2 SCC1=NC=CN=C1 78318 [1,1,0,0,0,0|2,0,0]=4 305 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [1,1,0,0,0,0|0,0,0]=2 306 B8R1.3 CC1=CN=C(C)N=C1 C15366 [1,1,0,0,0,0|2,0,0]=4 307 B8R1.3 CC1=CN=C(Cl)N=C1 F13414 [1,1,0,0,0,0|2,0,0]=4 308 B8R1.3 CC1=CN=C(I)N=C1 90174 [1,1,0,0,0,0|2,0,0]=4 309 B8R1.3 CC1=CN=C(O)N=C1 W10551 [1,1,0,0,0,0|2,0,0]=4 310 B8R1.3 CC1=NC=C(I)C=N1 82252 [1,1,0,0,0,0|2,0,0]=4 311 B8R1.3 NC1=CN=C(O)C=N1 N13380 [1,1,0,0,0,0|2,0,0]=4 312 B8R1.3 NC1=CN=C(S)C=C1 AT20609 [1,1,0,0,0,0|1,1,0]=4 313 B8R1.3 NC1=NC=C(O)C=N1 D78823 [1,1,0,0,0,0|2,0,0]=4 314 B8R1.3 [2H]C1=CC=C(Cl)C=C1 D98354 [1,1,0,0,0,0|1,0,0]=3 315 B8R1.3 [2H]C1=CC=C([2H])C=C1 D99669 [1,1,0,0,0,0|1,0,0]=3 316 B8R1.5 CC1=CC=NNC1=O 20227 [1,1,0,0,0,0|2,0,0]=4 317 B8R1.5 CC1=CN=CN=C1Cl 72600 [1,1,0,0,0,0|2,0,0]=4 318 B8R1.5 CC1=CN=NC=C1C C15709 [1,1,0,0,0,0|2,0,0]=4 319 B8R1.5 CC1=NC=CN=C1I P10643 [1,1,0,0,0,0|2,0,0]=4 320 B8R1.5 CC1=[N+](C)C=CC=C1 D87448 [1,1,0,0,0,0|1,0,0]=3 321 B8R1.5 C[C@H]1C=NC=CC1=S AT18149 [1,1,0,0,0,0|1,0,1]=4 322 B8R1.5 FC1=C(F)C=NC=C1 O10910 [1,1,0,0,0,0|2,0,0]=4 323 B8R1.5 FC1=CC=CN=C1S AT18759 [1,1,0,0,0,0|1,1,0]=4 324 B8R1.5 NC1=C(S)C=NC=C1 P11896 [1,1,0,0,0,0|1,1,0]=4 325 B8R1.5 OC1=C(Cl)C=NC=N1 25825 [1,1,0,0,0,0|2,0,0]=4 326 B8R1.5 OC1=C(O)C=NN=C1 S10982 [1,1,0,0,0,0|2,0,0]=4 327 B8R1.5 OC1=[13C](O)C=CC=C1 D98565 [1,1,0,0,0,0|0,0,0]=2 328 B8R1.5 S=C1C=CNC=C1Cl AT18152 [1,1,0,0,0,0|1,1,0]=4 329 B8R1.5 [2H]C1=C([2H])C=CC=C1 D97880 [1,1,0,0,0,0|1,0,0]=3 330 B8R1.5 [O-][N+]1=C([S-])C=CC=C1 S12409 [1,1,0,0,0,0|1,0,1]=4 331 B8R1.1 BrCC1=CC=C(Br)O1 55253 [0,1,0,0,1,0|2,0,0]=4 332 B8R1.1 BrCC1=CC=C(Br)S1 AC9027 [0,1,0,0,1,0|2,0,0]=4 333 B8R1.1 BrCC1=CSC(Br)=C1 AT16378 [0,1,0,0,1,0|2,0,0]=4 334 B8R1.1 CC1=CC(CN)=CO1 AT17525 [0,1,0,0,1,0|2,0,0]=4 335 B8R1.1 CC1=CC(CO)=CO1 AT17479 [0,1,0,0,1,0|1,0,0]=3 336 B8R1.1 CC1=CC(CO)=CS1 AT16765 [0,1,0,0,1,0|1,0,0]=3 337 B8R1.1 CC1=CC(CO)=NN1 O10131 [0,1,0,0,1,0|2,0,0]=4 338 B8R1.1 CC1=CC(CO)=NS1 AT21126 [0,1,0,0,1,0|2,0,0]=4 339 B8R1.1 CC1=CN=C(CO)N1 P12877 [0,1,0,0,1,0|2,0,0]=4 340 B8R1.1 CC1=CN=C(CO)O1 AT18512 [0,1,0,0,1,0|2,0,0]=4 341 B8R1.1 CC1=COC(C#N)=C1 AT17407 [0,1,0,0,1,0|2,0,0]=4 342 B8R1.1 CC1=COC(CO)=C1 AT17124 [0,1,0,0,1,0|1,0,0]=3 343 B8R1.1 CC1=NC=C(CO)N1 W10507 [0,1,0,0,1,0|2,0,0]=4 344 B8R1.1 CC1=NC=C(CO)O1 F12980 [0,1,0,0,1,0|2,0,0]=4 345 B8R1.1 CCC1=CC=C(S)S1 AT16555 [0,1,0,0,1,0|1,1,0]=4 346 B8R1.1 CCN1C=CC(O)=N1 AT14005 [0,1,0,0,1,0|2,0,0]=4 347 B8R1.1 CN1C=CC(CN)=C1 AT16243 [0,1,0,0,1,0|2,0,0]=4 348 B8R1.1 COC1=CC=C(Br)S1 N10622 [0,1,0,0,1,0|2,0,0]=4 349 B8R1.1 COC1=CN(C)N=C1 C91427 [0,1,0,0,1,0|2,0,0]=4 350 B8R1.1 COC1=NN(C)C=C1 AT24917 [0,1,0,0,1,0|2,0,0]=4 351 B8R1.1 COC1=NNC(C)=C1 E71889 [0,1,0,0,1,0|2,0,0]=4 352 B8R1.1 ClC1=CC(CBr)=CS1 AT16579 [0,1,0,0,1,0|2,0,0]=4 353 B8R1.1 ClC1=CC=C(CBr)S1 AT16577 [0,1,0,0,1,0|2,0,0]=4 354 B8R1.1 ClCC1=CC(Br)=CS1 F30091 [0,1,0,0,1,0|2,0,0]=4 355 B8R1.1 ClCC1=CC=C(Br)S1 AT16373 [0,1,0,0,1,0|2,0,0]=4 356 B8R1.1 ClCC1=CSC(Br)=C1 AT16374 [0,1,0,0,1,0|2,0,0]=4 357 B8R1.1 NCC1=CC(Br)=CN1 AT16225 [0,1,0,0,1,0|2,0,0]=4 358 B8R1.1 NCC1=CC(Cl)=CO1 50492 [0,1,0,0,1,0|2,0,0]=4 359 B8R1.1 NCC1=CC=C(Br)O1 79914 [0,1,0,0,1,0|2,0,0]=4 360 B8R1.1 NCC1=CC=C(Br)O1 94512 [0,1,0,0,1,0|2,0,0]=4 361 B8R1.1 NCC1=CC=C(Cl)S1 P19111 [0,1,0,0,1,0|2,0,0]=4 362 B8R1.1 NCC1=CSC(Br)=C1 AT16376 [0,1,0,0,1,0|2,0,0]=4 363 B8R1.1 OCC1=CC(Cl)=CS1 37631 [0,1,0,0,1,0|2,0,0]=4 364 B8R1.1 OCC1=CSC(Br)=C1 AT16369 [0,1,0,0,1,0|2,0,0]=4 365 B8R1.1 OCC1=NNC(O)=C1 C90528 [0,1,0,0,1,0|2,0,0]=4 366 B8R1.18 CC1=C(C)SC(Br)=C1 95200 [0,1,0,0,1,0|2,0,0]=4 367 B8R1.18 CC1=CC(C)=C(S)S1 AT16553 [0,1,0,0,1,0|1,1,0]=4 368 B8R1.18 CC1=CC(I)=C(C)S1 CS2241 [0,1,0,0,1,0|2,0,0]=4 369 B8R1.18 CN1C=C(Br)C(O)=N1 AT14036 [0,1,0,0,1,0|2,0,0]=4 370 B8R1.18 CN1C=C(I)C(O)=N1 AT14039 [0,1,0,0,1,0|2,0,0]=4 371 B8R1.50 CC1=C(C)C(O)=NO1 AT21054 [0,1,0,0,1,0|2,0,0]=4 372 B8R1.50 CC1=CC=C(C)N1N AT25958 [0,1,0,0,1,0|2,0,0]=4 373 B8R1.11 BrCC1=CSC=C1Br 88259 [0,1,0,0,1,0|2,0,0]=4 374 B8R1.11 CC1=C(C#N)C=CO1 AT17522 [0,1,0,0,1,0|2,0,0]=4 375 B8R1.11 CC1=C(C=O)C=CS1 AT16762 [0,1,0,0,1,0|1,0,1]=4 376 B8R1.11 CC1=C(CN)C=CO1 AT17524 [0,1,0,0,1,0|2,0,0]=4 377 B8R1.11 CC1=C(CN)C=CO1 AT17541 [0,1,0,0,1,0|2,0,0]=4 378 B8R1.11 CC1=C(CN)C=CS1 AT16801 [0,1,0,0,1,0|2,0,0]=4 379 B8R1.11 CC1=C(CN)OC=C1 AT17196 [0,1,0,0,1,0|2,0,0]=4 380 B8R1.11 CC1=C(CN)SC=C1 71361 [0,1,0,0,1,0|2,0,0]=4 381 B8R1.11 CC1=C(CO)N=CS1 AT21447 [0,1,0,0,1,0|2,0,0]=4 382 B8R1.11 CC1=C(CO)ON=C1 A51017 [0,1,0,0,1,0|2,0,0]=4 383 B8R1.11 CC1=C(CO)SC=N1 74180 [0,1,0,0,1,0|2,0,0]=4 384 B8R1.11 CC1=CNC=C1C#N AT16242 [0,1,0,0,1,0|2,0,0]=4 385 B8R1.11 CC1=CON=C1CO 95084 [0,1,0,0,1,0|2,0,0]=4 386 B8R1.11 CC1=CSC=C1CN AT16790 [0,1,0,0,1,0|2,0,0]=4 387 B8R1.11 CC1=NSC=C1CO AT21132 [0,1,0,0,1,0|2,0,0]=4 388 B8R1.11 CCN1N=CC=C1O AT14056 [0,1,0,0,1,0|2,0,0]=4 389 B8R1.11 COC1=C(Br)C=CS1 AT16340 [0,1,0,0,1,0|2,0,0]=4 390 B8R1.11 COC1=C(C)C=CS1 91670 [0,1,0,0,1,0|1,0,0]=3 391 B8R1.11 C[S@H]1C=CC=C1CN AT17306 [0,1,0,0,1,0|2,0,0]=4 392 B8R1.11 ClCC1=C(Br)C=CS1 AT16718 [0,1,0,0,1,0|2,0,0]=4 393 B8R1.11 ClCC1=C(Cl)C=CS1 AT16716 [0,1,0,0,1,0|2,0,0]=4 394 B8R1.11 ClCC1=C(Cl)SC=C1 AT17068 [0,1,0,0,1,0|2,0,0]=4 395 B8R1.11 NCC1=C(Br)C=CS1 P10346 [0,1,0,0,1,0|2,0,0]=4 396 B8R1.11 NCC1=CSC=C1Br AT16740 [0,1,0,0,1,0|2,0,0]=4 397 B8R1.11 NCC1=CSC=C1Cl AT16880 [0,1,0,0,1,0|2,0,0]=4 398 B8R1.11 OCC1=C(Cl)SC=C1 AT16564 [0,1,0,0,1,0|2,0,0]=4 399 B8R1.11 OCC1=CSC=C1Br 88258 [0,1,0,0,1,0|2,0,0]=4 400 B8R1.11 OCC1=CSC=C1Cl AT16882 [0,1,0,0,1,0|2,0,0]=4 401 B10R1.2 C=CC1=CC=CC(Br)=C1F H11842 [0,2,0,0,0,0|1,0,1]=4 402 B10R1.2 CC1=C(CCl)C=CC=[N+]1[O-] 96309 [0,2,0,0,0,0|1,0,1]=4 403 B10R1.2 CC1=C(F)C=CC=C1CN N12172 [0,2,0,0,0,0|1,0,0]=3 404 B10R1.2 CC1=C(O)C=CC=C1CO 56654 [0,2,0,0,0,0|0,0,0]=2 405 B10R1.2 CC1=CC=CC(C#N)=C1S AT20894 [0,2,0,0,0,0|1,0,0]=3 406 B10R1.2 CC1=CC=CC(CN)=C1O N10504 [0,2,0,0,0,0|1,0,0]=3 407 B10R1.2 CCC1=C(Br)C(C)=CC=C1 D85933 [0,2,0,0,0,0|1,0,0]=3 408 B10R1.2 CCC1=CC=CC(Cl)=C1N W13802 [0,2,0,0,0,0|1,0,0]=3 409 B10R1.2 CCC1=NC=NC(O)=C1Br F13817 [0,2,0,0,0,0|2,0,0]=4 410 B10R1.2 CCN1C=CC=C(N)C1=O AT19274 [0,2,0,0,0,0|2,0,0]=4 411 B10R1.2 CN1C=CC=C(C#N)C1=O O10426 [0,2,0,0,0,0|2,0,0]=4 412 B10R1.2 CN1C=CC=C(C=O)C1=O 55279 [0,2,0,0,0,0|1,0,1]=4 413 B10R1.2 CN1C=CC=C(CN)C1=O P11876 [0,2,0,0,0,0|2,0,0]=4 414 B10R1.2 CNC1=CC=CC(F)=C1N AC7422 [0,2,0,0,0,0|1,0,0]=3 415 B10R1.2 CNC1=CN=CC(Br)=C1C AT12945 [0,2,0,0,0,0|2,0,0]=4 416 B10R1.2 CNC1=NC=CC(Cl)=C1N C92709 [0,2,0,0,0,0|2,0,0]=4 417 B10R1.2 COC1=C(Cl)C(O)=CC=N1 FD10667 [0,2,0,0,0,0|1,0,0]=3 418 B10R1.2 COC1=C(N)C(N)=CC=C1 F52601 [0,2,0,0,0,0|1,0,0]=3 419 B10R1.2 COC1=C(O)C(N)=CC=C1 O10655 [0,2,0,0,0,0|1,0,0]=3 420 B10R1.2 COC1=CC=CC(Cl)=C1N CL9246 [0,2,0,0,0,0|1,0,0]=3 421 B10R1.2 COC1=CC=CC(S)=C1N AT19649 [0,2,0,0,0,0|0,1,0]=3 422 B10R1.2 COC1=CC=C[N+]([O-])=C1Cl F18647 [0,2,0,0,0,0|1,0,1]=4 423 B10R1.2 COC1=CC=NC(F)=C1Cl 91691 [0,2,0,0,0,0|2,0,0]=4 424 B10R1.2 COC1=CC=NC(N)=C1I C16820 [0,2,0,0,0,0|2,0,0]=4 425 B10R1.2 COC1=CN=CC(F)=C1N 93259 [0,2,0,0,0,0|2,0,0]=4 426 B10R1.2 COC1=NC=CC(F)=C1N F53634 [0,2,0,0,0,0|2,0,0]=4 427 B10R1.2 COC1=NC=CC(I)=C1F N11837 [0,2,0,0,0,0|2,0,0]=4 428 B10R1.2 COC1=NC=NC(O)=C1C C14793 [0,2,0,0,0,0|2,0,0]=4 429 B10R1.2 CSC1=C(C)C(N)=CC=C1 AT20858 [0,2,0,0,0,0|1,0,0]=3 430 B10R1.2 CSC1=CC=CC(Br)=C1C AC7030 [0,2,0,0,0,0|1,0,0]=3 431 B10R1.2 N#CC1=CC=CC(N)=C1O AT22558 [0,2,0,0,0,0|1,0,1]=4 432 B10R1.2 N#CC1=CC=CC(O)=C1N C74010 [0,2,0,0,0,0|0,0,1]=3 433 B10R1.2 NCC1=CC=CC(F)=C1O N12979 [0,2,0,0,0,0|1,0,0]=3 434 B10R1.2 NCC1=CC=CC(I)=C1Cl C72087 [0,2,0,0,0,0|1,0,0]=3 435 B10R1.2 NNC1=CC=CC(Br)=C1F 53855 [0,2,0,0,0,0|2,0,0]=4 436 B10R1.2 O=CC1=CC=CC(Cl)=C1I 93250 [0,2,0,0,0,0|1,0,1]=4 437 B10R1.2 OCC1=CC=CC(Cl)=C1F A12360 [0,2,0,0,0,0|1,0,0]=3 438 B10R1.2 OCC1=CN=CC(Br)=C1Cl AT15942 [0,2,0,0,0,0|2,0,0]=4 439 B10R1.8 C=CC1=CC(Br)=CC(F)=C1 W12634 [0,2,0,0,0,0|1,0,1]=4 440 B10R1.8 C=CC1=CC(F)=CC(F)=C1 AC9541 [0,2,0,0,0,0|1,0,1]=4 441 B10R1.8 CC1=CC(CCl)=CC(Cl)=N1 57849 [0,2,0,0,0,0|2,0,0]=4 442 B10R1.8 CC1=CC(CCl)=NC(C)=C1 O10512 [0,2,0,0,0,0|2,0,0]=4 443 B10R1.8 CC1=CC(CN)=CC(Cl)=N1 57851 [0,2,0,0,0,0|2,0,0]=4 444 B10R1.8 CC1=CC(Cl)=CC(C=O)=N1 C77358 [0,2,0,0,0,0|1,0,1]=4 445 B10R1.8 CCC1=CC(C)=CC(Br)=C1 C90915 [0,2,0,0,0,0|1,0,0]=3 446 B10R1.8 CNC1=CC(C)=NC(C)=C1 78071 [0,2,0,0,0,0|2,0,0]=4 447 B10R1.8 CNC1=CC(F)=NC(F)=C1 56960 [0,2,0,0,0,0|2,0,0]=4 448 B10R1.8 CNC1=CC(I)=CC(Br)=C1 F14267 [0,2,0,0,0,0|1,0,0]=3 449 B10R1.8 COC1=CC(Br)=NC(F)=C1 P18763 [0,2,0,0,0,0|2,0,0]=4 450 B10R1.8 COC1=CC(Br)=NC(O)=C1 AT10291 [0,2,0,0,0,0|1,0,0]=3 451 B10R1.8 COC1=CC(I)=CC(Cl)=N1 N10142 [0,2,0,0,0,0|2,0,0]=4 452 B10R1.8 COC1=CC(I)=CC(F)=C1 AT12533 [0,2,0,0,0,0|1,0,0]=3 453 B10R1.8 COC1=C[C@@H](C)C=C(C)C1 AC6323 [0,2,0,0,0,0|0,0,2]=4 454 B10R1.8 COC1=NC(C)=CC(C)=N1 H10099 [0,2,0,0,0,0|2,0,0]=4 455 B10R1.8 COC1=NC(N)=NC(O)=C1 N11825 [0,2,0,0,0,0|2,0,0]=4 456 B10R1.8 COC1=NC(O)=CC(O)=N1 23223 [0,2,0,0,0,0|2,0,0]=4 457 B10R1.8 COC1=NC(O)=NC(C)=C1 C16076 [0,2,0,0,0,0|2,0,0]=4 458 B10R1.8 FCC1=CC(Br)=CC(F)=C1 94378 [0,2,0,0,0,0|1,0,0]=3 459 B10R1.8 FCC1=CC(I)=CC(F)=C1 94383 [0,2,0,0,0,0|1,0,0]=3 460 B10R1.8 NCC1=CC(Cl)=CC(Cl)=N1 C91444 [0,2,0,0,0,0|2,0,0]=4 461 B10R1.8 NCC1=CC(Cl)=CC(Cl)=N1 D81608 [0,2,0,0,0,0|2,0,0]=4 462 B10R1.8 NNC1=CC(Cl)=CC(F)=C1 D88071 [0,2,0,0,0,0|2,0,0]=4 463 B10R1.8 OCC1=CC(I)=CC(F)=C1 94382 [0,2,0,0,0,0|1,0,0]=3 464 B10R1.8 OCC1=CC(S)=CC(S)=C1 F19554 [0,2,0,0,0,0|0,1,0]=3 465 B10R1.8 OCC1=NC(O)=CC(O)=N1 AT21036 [0,2,0,0,0,0|2,0,0]=4 466 B10R1.10 CC#CC1=CC(Br)=NC=C1 93991 [0,2,0,0,0,0|2,0,0]=4 467 B10R1.10 CC#CC1=CC(Cl)=NC=C1 94009 [0,2,0,0,0,0|2,0,0]=4 468 B10R1.10 CC#CC1=CC=CC(Cl)=N1 94007 [0,2,0,0,0,0|2,0,0]=4 469 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [0,2,0,0,0,0|0,0,1]=3 470 B10R1.10 CC1=CC=CC(CCBr)=N1 AC6969 [0,2,0,0,0,0|2,0,0]=4 471 B10R1.10 CC1=CC=CC(CCN)=N1 P19093 [0,2,0,0,0,0|2,0,0]=4 472 B10R1.10 CC1=NC=CC(CNN)=C1 F52070 [0,2,0,0,0,0|2,0,0]=4 473 B10R1.10 CC1=NC=CC(CNN)=C1 F52466 [0,2,0,0,0,0|2,0,0]=4 474 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [0,2,0,0,0,0|1,0,0]=3 475 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [0,2,0,0,0,0|1,0,0]=3 476 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [0,2,0,0,0,0|0,0,0]=2 477 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [0,2,0,0,0,0|0,1,0]=3 478 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [0,2,0,0,0,0|1,0,0]=3 479 B10R1.10 CNCC1=CC(Cl)=NC=C1 AT26616 [0,2,0,0,0,0|2,0,0]=4 480 B10R1.10 CNCC1=NC(C)=CC=C1 D87644 [0,2,0,0,0,0|2,0,0]=4 481 B10R1.10 CNCC1=NC=CC(Cl)=C1 CS1254 [0,2,0,0,0,0|2,0,0]=4 482 B10R1.10 COCC1=CC(N)=CC=C1 30379 [0,2,0,0,0,0|1,0,0]=3 483 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [0,2,0,0,0,0|1,0,0]=3 484 B10R1.10 ClC1=CC=CC(C#CBr)=C1 55375 [0,2,0,0,0,0|1,0,1]=4 485 B10R1.10 N#CCC1=CC(Cl)=CN=C1 93159 [0,2,0,0,0,0|2,0,0]=4 486 B10R1.10 N#CCC1=CC(N)=NC=C1 AT18208 [0,2,0,0,0,0|2,0,0]=4 487 B10R1.10 N#CCC1=CC=CC(Cl)=N1 O10491 [0,2,0,0,0,0|2,0,0]=4 488 B10R1.10 NCCC1=CC=CC(I)=C1 C78608 [0,2,0,0,0,0|1,0,0]=3 489 B10R1.10 NNCC1=CC(Br)=CN=C1 P11105 [0,2,0,0,0,0|2,0,0]=4 490 B10R1.10 NNCC1=CC=CC(Cl)=C1 P15270 [0,2,0,0,0,0|1,0,0]=3 491 B10R1.10 NNCC1=CC=CC(O)=C1 D87672 [0,2,0,0,0,0|0,0,0]=2 492 B10R1.10 N\N=C\C1=CC=CC(O)=C1 F15561 [0,2,0,0,0,0|0,0,1]=3 493 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [0,2,0,0,0,0|1,0,0]=3 494 B10R1.30 BrCC1=C(Br)C=CC(Br)=C1 68639 [0,2,0,0,0,0|1,0,0]=3 495 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 CL9154 [0,2,0,0,0,0|1,0,0]=3 496 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 CL9155 [0,2,0,0,0,0|1,0,0]=3 497 B10R1.30 C#CC1=C(Br)C=CC(Cl)=C1 AT26743 [0,2,0,0,0,0|1,0,1]=4 498 B10R1.30 C#CC1=C(Cl)C=CC(N)=C1 C76584 [0,2,0,0,0,0|1,0,1]=4 499 B10R1.30 C#CC1=C(N)C=CC(F)=C1 AC7120 [0,2,0,0,0,0|1,0,1]=4 500 B10R1.30 C=CC1=C(Cl)C=CC(Cl)=C1 CK2537 [0,2,0,0,0,0|1,0,1]=4 501 B10R1.30 C=CC1=C(F)C=CC(F)=C1 CK2551 [0,2,0,0,0,0|1,0,1]=4 502 B10R1.30 CC1=C(CBr)C=C(Cl)C=C1 73456 [0,2,0,0,0,0|1,0,0]=3 503 B10R1.30 CC1=C(CO)C=C(O)C=C1 AC3540 [0,2,0,0,0,0|0,0,0]=2 504 B10R1.30 CC1=C(CO)N=C(Br)C=C1 AT18411 [0,2,0,0,0,0|2,0,0]=4 505 B10R1.30 CC1=CC(C#N)=C(S)C=C1 AT20893 [0,2,0,0,0,0|1,0,0]=3 506 B10R1.30 CC1=CC(C=O)=C(Br)C=N1 D72245 [0,2,0,0,0,0|1,0,1]=4 507 B10R1.30 CC1=CC(CBr)=C(F)C=C1 98276 [0,2,0,0,0,0|1,0,0]=3 508 B10R1.30 CC1=CC(CO)=C(I)C=C1 H11526 [0,2,0,0,0,0|0,0,0]=2 509 B10R1.30 CC1=CC=C(C)C(C#N)=N1 Y10193 [0,2,0,0,0,0|2,0,0]=4 510 B10R1.30 CC1=CC=C(N)C(C#N)=N1 68796 [0,2,0,0,0,0|2,0,0]=4 511 B10R1.30 CC1=CN=C(Cl)C(C#N)=C1 94431 [0,2,0,0,0,0|2,0,0]=4 512 B10R1.30 CC1=CN=C(Cl)C(CO)=C1 D85930 [0,2,0,0,0,0|1,0,0]=3 513 B10R1.30 CC1=NC(C#N)=C(F)C=C1 C91533 [0,2,0,0,0,0|2,0,0]=4 514 B10R1.30 CC1=NC(C#N)=C(O)C=C1 57115 [0,2,0,0,0,0|2,0,0]=4 515 B10R1.30 CC1=NC(CO)=C(F)C=C1 C91534 [0,2,0,0,0,0|1,0,0]=3 516 B10R1.30 CC1=NC=C(Br)C=C1CCl AC3206 [0,2,0,0,0,0|2,0,0]=4 517 B10R1.30 CCC1=C(Br)C=NC(Cl)=C1 AT13829 [0,2,0,0,0,0|2,0,0]=4 518 B10R1.30 CCC1=C(C)C=CC(C)=C1 T71937 [0,2,0,0,0,0|1,0,0]=3 519 B10R1.30 CCC1=CC(Br)=NC=C1N 51679 [0,2,0,0,0,0|2,0,0]=4 520 B10R1.30 CCN1C=C(N)C=CC1=O AT19278 [0,2,0,0,0,0|2,0,0]=4 521 B10R1.30 CNC1=C(F)C=CC(Br)=C1 AC3023 [0,2,0,0,0,0|1,0,0]=3 522 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C76710 [0,2,0,0,0,0|1,0,0]=3 523 B10R1.30 CNC1=C(O)C=CC(C)=C1 C16345 [0,2,0,0,0,0|1,0,0]=3 524 B10R1.30 CNC1=CC(Cl)=NC=C1F F13412 [0,2,0,0,0,0|2,0,0]=4 525 B10R1.30 CNC1=NC(C)=CC=C1N S10557 [0,2,0,0,0,0|2,0,0]=4 526 B10R1.30 COC1=C(C)C=CC(O)=C1 AT19376 [0,2,0,0,0,0|0,0,0]=2 527 B10R1.30 COC1=C(Cl)C=CC(N)=N1 A12809 [0,2,0,0,0,0|2,0,0]=4 528 B10R1.30 COC1=C(I)C=CC(Cl)=N1 AT11606 [0,2,0,0,0,0|2,0,0]=4 529 B10R1.30 COC1=C(S)C=CC(N)=C1 D87749 [0,2,0,0,0,0|1,0,0]=3 530 B10R1.30 COC1=CC(Br)=CN=C1Br N12851 [0,2,0,0,0,0|2,0,0]=4 531 B10R1.30 COC1=CC(Br)=NC=C1F AT26883 [0,2,0,0,0,0|2,0,0]=4 532 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 C13369 [0,2,0,0,0,0|1,0,0]=3 533 B10R1.30 CSC1=C(N)C=CC(C)=C1 AT20827 [0,2,0,0,0,0|0,1,0]=3 534 B10R1.30 ClC1=NC(CBr)=C(Br)C=C1 52492 [0,2,0,0,0,0|2,0,0]=4 535 B10R1.30 ClCC1=C(Br)C=NC(Cl)=C1 94576 [0,2,0,0,0,0|2,0,0]=4 536 B10R1.30 FC1=NC(CBr)=C(Br)C=C1 85647 [0,2,0,0,0,0|2,0,0]=4 537 B10R1.30 FCC1=C(F)C=CC(Br)=N1 C92966 [0,2,0,0,0,0|2,0,0]=4 538 B10R1.30 N#CC1=C(S)C=CC(Cl)=C1 AT20896 [0,2,0,0,0,0|1,0,1]=4 539 B10R1.30 NC1=C(C=O)C=C(I)C=C1 F15851 [0,2,0,0,0,0|1,0,1]=4 540 B10R1.30 NC1=CN=C(Cl)C(CO)=C1 D88075 [0,2,0,0,0,0|2,0,0]=4 541 B10R1.30 NC1=NC=C(Br)C=C1CO 26758 [0,2,0,0,0,0|2,0,0]=4 542 B10R1.30 NCC1=C(Br)C=CC(F)=C1 AC7757 [0,2,0,0,0,0|1,0,0]=3 543 B10R1.30 NCC1=C(Br)C=CC(O)=C1 D88088 [0,2,0,0,0,0|0,0,0]=2 544 B10R1.30 NCC1=C(F)C=CC(N)=C1 AC9197 [0,2,0,0,0,0|1,0,0]=3 545 B10R1.30 NCC1=C(I)C=CC(Br)=C1 67324 [0,2,0,0,0,0|1,0,0]=3 546 B10R1.30 NCC1=C(N)C=CC(Br)=C1 O10495 [0,2,0,0,0,0|1,0,0]=3 547 B10R1.30 NCC1=C(N)C=CC(F)=C1 CK2412 [0,2,0,0,0,0|1,0,0]=3 548 B10R1.30 NCC1=C(O)C=CC(Br)=C1 76231 [0,2,0,0,0,0|1,0,0]=3 549 B10R1.30 NCC1=CC(Br)=CN=C1F P12283 [0,2,0,0,0,0|2,0,0]=4 550 B10R1.30 NCC1=CC(Br)=CN=C1N AC3840 [0,2,0,0,0,0|2,0,0]=4 551 B10R1.30 NCC1=CC(Cl)=CN=C1O 79398 [0,2,0,0,0,0|2,0,0]=4 552 B10R1.30 NNC1=C(Cl)C=CC(Br)=C1 E72103 [0,2,0,0,0,0|2,0,0]=4 553 B10R1.30 NNC1=C(F)C=CC(Cl)=C1 A51221 [0,2,0,0,0,0|2,0,0]=4 554 B10R1.30 OCC1=C(Br)C=NC(Cl)=C1 F30510 [0,2,0,0,0,0|2,0,0]=4 555 B10R1.30 OCC1=C(F)C=CC(Cl)=N1 A10682 [0,2,0,0,0,0|2,0,0]=4 556 B10R1.30 OCC1=CC(Br)=CN=C1F P11806 [0,2,0,0,0,0|2,0,0]=4 557 B10R1.30 OCC1=CC(F)=CN=C1Cl 85046 [0,2,0,0,0,0|2,0,0]=4 558 B10R1.30 OCC1=CC(F)=CN=C1F AT10048 [0,2,0,0,0,0|2,0,0]=4 559 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [0,2,0,0,0,0|1,0,0]=3 560 B10R1.113 CC(=O)C1=CC(=O)NC=C1 90624 [0,2,0,0,0,0|1,0,1]=4 561 B10R1.113 CC(=O)C1=NC(N)=CC=C1 N14723 [0,2,0,0,0,0|2,0,0]=4 562 B10R1.113 CC(C)C1=CC(Cl)=NC=C1 D71924 [0,2,0,0,0,0|2,0,0]=4 563 B10R1.113 CC1=CC(B(O)O)=NC=C1 83427 [0,2,0,0,0,0|1,0,0]=3 564 B10R1.113 CC1=CC(C(F)F)=NC=C1 C91253 [0,2,0,0,0,0|2,0,0]=4 565 B10R1.113 CC1=CC=CC(B([O-])O)=N1 AT15842 [0,2,0,0,0,0|1,0,0]=3 566 B10R1.113 CC1=CC=CC(C(=N)N)=N1 74734 [0,2,0,0,0,0|2,0,0]=4 567 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [0,2,0,0,0,0|1,0,0]=3 568 B10R1.113 CC1=CC=CC(N(C)C)=N1 N10110 [0,2,0,0,0,0|2,0,0]=4 569 B10R1.113 CC1=CC=CC([C@H](C)N)=N1 N13137 [0,2,0,0,0,0|2,0,0]=4 570 B10R1.113 CC1=NC=CC([C@H](C)O)=C1 F13150 [0,2,0,0,0,0|1,0,0]=3 571 B10R1.113 CN(C)C1=CC(Br)=CN=C1 N10343 [0,2,0,0,0,0|2,0,0]=4 572 B10R1.113 CN(C)C1=CC=CC(F)=N1 AT20362 [0,2,0,0,0,0|2,0,0]=4 573 B10R1.113 CN(C)C1=NC=CC(Cl)=C1 C16301 [0,2,0,0,0,0|2,0,0]=4 574 B10R1.113 CN(C)C1=NC=CC(O)=N1 AT18298 [0,2,0,0,0,0|2,0,0]=4 575 B10R1.113 CN(N)C1=CC=CC(Br)=N1 95484 [0,2,0,0,0,0|2,0,0]=4 576 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [0,2,0,0,0,0|1,0,0]=3 577 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [0,2,0,0,0,0|1,0,0]=3 578 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=N1 55243 [0,2,0,0,0,0|2,0,0]=4 579 B10R1.113 C[C@H](N)C1=CC(Br)=CN=C1 90822 [0,2,0,0,0,0|2,0,0]=4 580 B10R1.113 C[C@H](N)C1=CC(Br)=NC=C1 AC3205 [0,2,0,0,0,0|2,0,0]=4 581 B10R1.113 C[C@H](N)C1=CC(Cl)=CN=C1 90825 [0,2,0,0,0,0|2,0,0]=4 582 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N10537 [0,2,0,0,0,0|2,0,0]=4 583 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 N13087 [0,2,0,0,0,0|2,0,0]=4 584 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90539 [0,2,0,0,0,0|2,0,0]=4 585 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 90540 [0,2,0,0,0,0|2,0,0]=4 586 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [0,2,0,0,0,0|1,0,0]=3 587 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [0,2,0,0,0,0|1,0,0]=3 588 B10R1.113 C[C@H](N)C1=CC=CC(N)=N1 D81409 [0,2,0,0,0,0|2,0,0]=4 589 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [0,2,0,0,0,0|0,0,0]=2 590 B10R1.113 C[C@H](N)C1=NC=CC(Br)=C1 90526 [0,2,0,0,0,0|2,0,0]=4 591 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14934 [0,2,0,0,0,0|2,0,0]=4 592 B10R1.113 C[C@H](N)C1=NC=CC(Cl)=C1 N14935 [0,2,0,0,0,0|2,0,0]=4 593 B10R1.113 C[C@H](O)C1=CC(F)=CN=C1 AT10686 [0,2,0,0,0,0|2,0,0]=4 594 B10R1.113 C[C@H](O)C1=CC(N)=NC=C1 CS1317 [0,2,0,0,0,0|2,0,0]=4 595 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [0,2,0,0,0,0|1,0,0]=3 596 B10R1.113 C[C@H](O)C1=CC=CC(F)=N1 AT10689 [0,2,0,0,0,0|2,0,0]=4 597 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [0,2,0,0,0,0|0,0,0]=2 598 B10R1.113 C[C@H](O)C1=NC=CC(F)=C1 AT10691 [0,2,0,0,0,0|2,0,0]=4 599 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [0,2,0,0,0,0|1,0,0]=3 600 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [0,2,0,0,0,0|1,0,0]=3 601 B10R1.113 FC(F)C1=CC(Cl)=CN=C1 94167 [0,2,0,0,0,0|2,0,0]=4 602 B10R1.113 FC(F)C1=CC=CC(S)=C1 97706 [0,2,0,0,0,0|0,1,0]=3 603 B10R1.113 FC1=NC(C(F)F)=CC=C1 E72212 [0,2,0,0,0,0|2,0,0]=4 604 B10R1.113 NC(=S)C1=CC=CC(I)=C1 A10482 [0,2,0,0,0,0|1,0,1]=4 605 B10R1.113 NC1=CC(B(O)O)=CN=C1 AT14947 [0,2,0,0,0,0|2,0,0]=4 606 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AC3399 [0,2,0,0,0,0|1,0,1]=4 607 B10R1.113 O=C([O-])C1=CC=CC(Cl)=C1 I11436 [0,2,0,0,0,0|1,0,1]=4 608 B10R1.113 O=[N+]([O-])C1=CC=CC(S)=C1 AT20860 [0,2,0,0,0,0|1,0,1]=4 609 B10R1.113 O=[N+]([O-])C1=NC(O)=CC=C1 D83533 [0,2,0,0,0,0|2,0,0]=4 610 B10R1.113 OB(O)C1=CC(O)=CN=C1 AT14949 [0,2,0,0,0,0|2,0,0]=4 611 B10R1.113 OB(O)C1=CC=CC(S)=C1 C10361 [0,2,0,0,0,0|1,0,0]=3 612 B10R1.172 BrCC1=CC=CC(CBr)=N1 AC6696 [0,2,0,0,0,0|2,0,0]=4 613 B10R1.172 BrCC1=CN=CC(CBr)=C1 C11061 [0,2,0,0,0,0|2,0,0]=4 614 B10R1.172 BrCC1=CN=CC(CBr)=C1 F30548 [0,2,0,0,0,0|2,0,0]=4 615 B10R1.172 C=CC1=CC=CC(OC)=N1 52911 [0,2,0,0,0,0|1,0,1]=4 616 B10R1.172 CCC1=CC=CC(C#N)=N1 87882 [0,2,0,0,0,0|2,0,0]=4 617 B10R1.172 CCC1=CC=CC(CO)=C1 D85939 [0,2,0,0,0,0|0,0,0]=2 618 B10R1.172 CCC1=NC=CC(CN)=C1 57083 [0,2,0,0,0,0|2,0,0]=4 619 B10R1.172 CNC1=CC=CC(CO)=C1 AT21037 [0,2,0,0,0,0|0,0,0]=2 620 B10R1.172 CNC1=CC=CC(SC)=C1 AT20859 [0,2,0,0,0,0|0,1,0]=3 621 B10R1.172 CNC1=NC=CC(CO)=C1 AT18191 [0,2,0,0,0,0|1,0,0]=3 622 B10R1.172 CNC1=NC=CC(CO)=N1 D75561 [0,2,0,0,0,0|2,0,0]=4 623 B10R1.172 COC1=CC(CCl)=CN=C1 81942 [0,2,0,0,0,0|1,0,0]=3 624 B10R1.172 COC1=CC(OC)=NN=C1 C73963 [0,2,0,0,0,0|2,0,0]=4 625 B10R1.172 COC1=CC=CC(CCl)=N1 81766 [0,2,0,0,0,0|1,0,0]=3 626 B10R1.172 COC1=CN=NC(CO)=C1 P14137 [0,2,0,0,0,0|2,0,0]=4 627 B10R1.172 COC1=NC(CN)=CC=C1 79028 [0,2,0,0,0,0|1,0,0]=3 628 B10R1.172 COC1=NC(NN)=CC=C1 F16103 [0,2,0,0,0,0|2,0,0]=4 629 B10R1.172 COC1=NC=CC(CCl)=C1 P17364 [0,2,0,0,0,0|1,0,0]=3 630 B10R1.172 COC1=NC=CC(CCl)=N1 F30444 [0,2,0,0,0,0|2,0,0]=4 631 B10R1.172 COC1=NC=CC(SC)=C1 F50801 [0,2,0,0,0,0|1,0,0]=3 632 B10R1.172 COC1=NC=NC(CN)=C1 P12885 [0,2,0,0,0,0|2,0,0]=4 633 B10R1.172 CSC1=CC(CN)=CC=C1 N14326 [0,2,0,0,0,0|0,1,0]=3 634 B10R1.172 CSC1=CN=CC(SC)=C1 H11054 [0,2,0,0,0,0|1,1,0]=4 635 B10R1.172 N#CC1=NC=CC(CCl)=C1 C76293 [0,2,0,0,0,0|2,0,0]=4 636 B10R1.172 NCC1=CC=CC(CO)=C1 C75075 [0,2,0,0,0,0|0,0,0]=2 637 B10R1.172 O=CC1=NC=CC(CO)=C1 60952 [0,2,0,0,0,0|1,0,1]=4 638 B10R1.172 OCC1=CN=CC(CO)=C1 61754 [0,2,0,0,0,0|1,0,0]=3 639 B10R1.176 BrCC1=CC(Br)=C(I)C=C1 AT26690 [0,2,0,0,0,0|1,0,0]=3 640 B10R1.176 BrCC1=CC(I)=C(Br)C=C1 97476 [0,2,0,0,0,0|1,0,0]=3 641 B10R1.176 C#CC1=CC(C)=C(Br)C=C1 C91264 [0,2,0,0,0,0|1,0,0]=3 642 B10R1.176 CC1=C(Br)C=C(CO)N=C1 81452 [0,2,0,0,0,0|2,0,0]=4 643 B10R1.176 CC1=C(Br)C=CC(CCl)=C1 D87322 [0,2,0,0,0,0|1,0,0]=3 644 B10R1.176 CC1=C(Br)C=CC(NN)=N1 80859 [0,2,0,0,0,0|2,0,0]=4 645 B10R1.176 CC1=C(Br)C=NC(CN)=C1 AC7093 [0,2,0,0,0,0|2,0,0]=4 646 B10R1.176 CC1=C(Br)C=NC(CO)=C1 C72572 [0,2,0,0,0,0|1,0,0]=3 647 B10R1.176 CC1=C(C)N=C(C#N)C=C1 Y10192 [0,2,0,0,0,0|2,0,0]=4 648 B10R1.176 CC1=C(F)C=C(CO)C=N1 C77142 [0,2,0,0,0,0|2,0,0]=4 649 B10R1.176 CC1=C(F)C=CC(CO)=N1 O10128 [0,2,0,0,0,0|1,0,0]=3 650 B10R1.176 CC1=C(I)C=C(CO)C=C1 D75885 [0,2,0,0,0,0|1,0,0]=3 651 B10R1.176 CC1=C(N)C=CC(CO)=C1 F15978 [0,2,0,0,0,0|0,0,0]=2 652 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14330 [0,2,0,0,0,0|1,0,0]=3 653 B10R1.176 CC1=CC(CCl)=CN=C1Cl 97209 [0,2,0,0,0,0|2,0,0]=4 654 B10R1.176 CC1=CC(CO)=CN=C1C F53420 [0,2,0,0,0,0|1,0,0]=3 655 B10R1.176 CCC1=CC(N)=C(Br)C=N1 C14681 [0,2,0,0,0,0|2,0,0]=4 656 B10R1.176 CCC1=CC(N)=C(C)C=C1 F21363 [0,2,0,0,0,0|1,0,0]=3 657 B10R1.176 CCC1=CC(O)=C(F)C=C1 F30470 [0,2,0,0,0,0|0,0,0]=2 658 B10R1.176 CCC1=CC(O)=C(O)C=C1 70407 [0,2,0,0,0,0|0,0,0]=2 659 B10R1.176 CCC1=NC(C)=C(O)C=C1 76361 [0,2,0,0,0,0|2,0,0]=4 660 B10R1.176 CN1C=C(C#N)C=CC1=O AT19297 [0,2,0,0,0,0|2,0,0]=4 661 B10R1.176 CN1C=C(CN)C=CC1=O P11875 [0,2,0,0,0,0|2,0,0]=4 662 B10R1.176 CN1C=CC(CCl)=CC1=O AT19302 [0,2,0,0,0,0|1,0,1]=4 663 B10R1.176 CNC1=CC(Cl)=C(Br)C=C1 AC3296 [0,2,0,0,0,0|1,0,0]=3 664 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 C77674 [0,2,0,0,0,0|1,0,0]=3 665 B10R1.176 CNC1=CC(F)=C(Br)C=C1 S10823 [0,2,0,0,0,0|1,0,0]=3 666 B10R1.176 COC1=CC(C)=[N+]([O-])C=C1 F18022 [0,2,0,0,0,0|1,0,0]=3 667 B10R1.176 COC1=CC(I)=C(C)C=N1 AT12881 [0,2,0,0,0,0|2,0,0]=4 668 B10R1.176 COC1=CC(N)=C(I)C=C1 O10806 [0,2,0,0,0,0|1,0,0]=3 669 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19646 [0,2,0,0,0,0|1,0,0]=3 670 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19647 [0,2,0,0,0,0|1,0,0]=3 671 B10R1.176 COC1=CC(S)=C(N)C=C1 C90511 [0,2,0,0,0,0|0,1,0]=3 672 B10R1.176 COC1=NC(Cl)=C(I)C=C1 N10091 [0,2,0,0,0,0|2,0,0]=4 673 B10R1.176 COC1=NN=C(Cl)C(C)=C1 C16632 [0,2,0,0,0,0|2,0,0]=4 674 B10R1.176 CSC1=CC(C)=C(Br)C=C1 AT14181 [0,2,0,0,0,0|0,1,0]=3 675 B10R1.176 CSC1=CC(C)=C(Br)C=N1 AT14153 [0,2,0,0,0,0|1,1,0]=4 676 B10R1.176 CSC1=CC(C)=C(O)C=C1 AT20904 [0,2,0,0,0,0|0,1,0]=3 677 B10R1.176 CSC1=CC(N)=C(C)C=C1 AT20856 [0,2,0,0,0,0|1,0,0]=3 678 B10R1.176 CSC1=NC(C)=C(Br)C=C1 AT14158 [0,2,0,0,0,0|1,1,0]=4 679 B10R1.176 CSC1=NC(O)=C(Cl)C=N1 AC6462 [0,2,0,0,0,0|2,0,0]=4 680 B10R1.176 FC1=C(Br)C=C(CCl)C=C1 W16546 [0,2,0,0,0,0|1,0,0]=3 681 B10R1.176 FC1=C(Br)C=CC(CCl)=C1 96328 [0,2,0,0,0,0|1,0,0]=3 682 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 CK1006 [0,2,0,0,0,0|1,0,0]=3 683 B10R1.176 NC1=C(Cl)C=C(CO)C=N1 AT11640 [0,2,0,0,0,0|2,0,0]=4 684 B10R1.176 NCC1=CC(O)=C(N)C=C1 F13360 [0,2,0,0,0,0|0,0,0]=2 685 B10R1.176 NCC1=CC=C(Cl)C(Cl)=N1 D97054 [0,2,0,0,0,0|2,0,0]=4 686 B10R1.176 NCC1=CN=C(Br)C(Cl)=C1 Y11680 [0,2,0,0,0,0|2,0,0]=4 687 B10R1.176 NNC1=CC(Br)=C(F)C=C1 54717 [0,2,0,0,0,0|2,0,0]=4 688 B10R1.176 O=C1C=C(CO)C=CN1O C92065 [0,2,0,0,0,0|1,0,1]=4 689 B10R1.176 O=CC1=CC(Br)=C(I)C=C1 AT26050 [0,2,0,0,0,0|1,0,1]=4 690 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 AT23715 [0,2,0,0,0,0|1,0,1]=4 691 B10R1.176 OCC1=CC(Br)=C(Cl)N=C1 AC7185 [0,2,0,0,0,0|2,0,0]=4 692 B10R1.176 OCC1=CC(I)=C(Br)C=C1 97475 [0,2,0,0,0,0|1,0,0]=3 693 B10R1.176 OCC1=CC=C(O)C(Br)=N1 F53642 [0,2,0,0,0,0|2,0,0]=4 694 B10R1.176 OCC1=CN=C(Br)C(Cl)=C1 AT10810 [0,2,0,0,0,0|2,0,0]=4 695 B10R1.176 OCC1=CN=C(Cl)C(F)=C1 D88117 [0,2,0,0,0,0|2,0,0]=4 696 B10R1.22 CC1=C(Br)C=C(Cl)C=C1F 98310 [0,2,0,0,0,0|2,0,0]=4 697 B10R1.22 CC1=C(Br)C=C(F)C=C1Cl C90840 [0,2,0,0,0,0|2,0,0]=4 698 B10R1.22 CC1=C(I)C=C(Br)C=C1N F13806 [0,2,0,0,0,0|2,0,0]=4 699 B10R1.22 CC1=C(O)C(I)=CC(I)=N1 FD10658 [0,2,0,0,0,0|2,0,0]=4 700 B10R1.22 CC1=C(O)C=C(O)N=C1Cl C16631 [0,2,0,0,0,0|2,0,0]=4 701 B10R1.22 CC1=CC(=O)N(C)C(N)=C1 AT19286 [0,2,0,0,0,0|1,0,1]=4 702 B10R1.22 CC1=CC(Br)=CC(Br)=C1I AC9862 [0,2,0,0,0,0|1,0,0]=3 703 B10R1.22 CC1=CC(Br)=CC(I)=C1N S10863 [0,2,0,0,0,0|1,0,0]=3 704 B10R1.22 CC1=CC(Br)=CC(N)=C1F 55937 [0,2,0,0,0,0|1,0,0]=3 705 B10R1.22 CC1=CC(Br)=NC(C)=C1Br C75336 [0,2,0,0,0,0|2,0,0]=4 706 B10R1.22 CC1=CC(C)=C(N)C(Br)=N1 C71195 [0,2,0,0,0,0|2,0,0]=4 707 B10R1.22 CC1=CC(C)=NC(C)=C1Br W12678 [0,2,0,0,0,0|2,0,0]=4 708 B10R1.22 CC1=CC(C)=[N+](F)C(C)=C1 C71278 [0,2,0,0,0,0|2,0,0]=4 709 B10R1.22 CC1=CC(Cl)=C(Cl)C(N)=C1 H11579 [0,2,0,0,0,0|1,0,0]=3 710 B10R1.22 CC1=CC(Cl)=CC(F)=C1N 95138 [0,2,0,0,0,0|1,0,0]=3 711 B10R1.22 CC1=CC(Cl)=CC(N)=C1O 78884 [0,2,0,0,0,0|1,0,0]=3 712 B10R1.22 CC1=CC(Cl)=NC(N)=C1N P12074 [0,2,0,0,0,0|2,0,0]=4 713 B10R1.22 CC1=CC(F)=C(F)C(F)=C1 36229 [0,2,0,0,0,0|1,0,0]=3 714 B10R1.22 CC1=CC(F)=C(N)C(F)=C1 36800 [0,2,0,0,0,0|1,0,0]=3 715 B10R1.22 CC1=CC(I)=C(F)C(F)=C1 96950 [0,2,0,0,0,0|1,0,0]=3 716 B10R1.22 CC1=CC(I)=C(N)C(Br)=C1 91883 [0,2,0,0,0,0|1,0,0]=3 717 B10R1.22 CC1=CC(I)=CC(F)=C1Br AT18861 [0,2,0,0,0,0|1,0,0]=3 718 B10R1.22 CC1=CC(N)=CC(=O)N1C AT19299 [0,2,0,0,0,0|1,0,1]=4 719 B10R1.22 CC1=CC(N)=CC(Br)=C1F FD10715 [0,2,0,0,0,0|1,0,0]=3 720 B10R1.22 CC1=CC(N)=CC(C)=C1N 61916 [0,2,0,0,0,0|1,0,0]=3 721 B10R1.22 CC1=CC(N)=CC(Cl)=C1Br FD10718 [0,2,0,0,0,0|1,0,0]=3 722 B10R1.22 CC1=CC(N)=CN(C)C1=O 79438 [0,2,0,0,0,0|2,0,0]=4 723 B10R1.22 CC1=CC(O)=C(N)C(C)=N1 C75076 [0,2,0,0,0,0|1,0,0]=3 724 B10R1.22 CC1=CC(O)=C(O)C(O)=C1 D92404 [0,2,0,0,0,0|0,0,0]=2 725 B10R1.22 CC1=NC(O)=NC(C)=C1Br 71764 [0,2,0,0,0,0|2,0,0]=4 726 B10R1.22 CN1C=C(F)C=C(Br)C1=O AT13035 [0,2,0,0,0,0|2,0,0]=4 727 B10R1.22 CN1C=C(N)C=C(Cl)C1=O 92341 [0,2,0,0,0,0|2,0,0]=4 728 B10R1.22 CN1C=C(N)C=C(F)C1=O 92352 [0,2,0,0,0,0|2,0,0]=4 729 B10R1.22 FC1=C(Br)C=C(Br)C=C1Br AC1265 [0,2,0,0,0,0|2,0,0]=4 730 B10R1.22 FC1=CC(Cl)=CC(Br)=C1F 98257 [0,2,0,0,0,0|2,0,0]=4 731 B10R1.22 FC1=CC(I)=CC(F)=C1Cl C90862 [0,2,0,0,0,0|2,0,0]=4 732 B10R1.22 NC1=C(Cl)C=C(Cl)C=C1S AT19658 [0,2,0,0,0,0|1,1,0]=4 733 B10R1.22 NC1=C(Cl)C=C(I)C=C1Cl AT25401 [0,2,0,0,0,0|2,0,0]=4 734 B10R1.22 NC1=C(F)C=C(Cl)C=C1O E71911 [0,2,0,0,0,0|1,0,0]=3 735 B10R1.22 NC1=C(I)C=C(Br)C=C1F 50421 [0,2,0,0,0,0|2,0,0]=4 736 B10R1.22 NC1=CC(Br)=CC(Cl)=C1F CL9735 [0,2,0,0,0,0|2,0,0]=4 737 B10R1.22 NC1=CC(Br)=CC(F)=C1F C90856 [0,2,0,0,0,0|2,0,0]=4 738 B10R1.22 NC1=CC(Br)=CC(F)=C1I 98240 [0,2,0,0,0,0|2,0,0]=4 739 B10R1.22 NC1=CC(Br)=CC(F)=C1O 34405 [0,2,0,0,0,0|2,0,0]=4 740 B10R1.22 NC1=CC(Br)=CC(I)=C1N C91480 [0,2,0,0,0,0|2,0,0]=4 741 B10R1.22 NC1=CC(Cl)=C(O)C(F)=C1 C13904 [0,2,0,0,0,0|2,0,0]=4 742 B10R1.22 NC1=CC(Cl)=CC(Cl)=C1I E71709 [0,2,0,0,0,0|2,0,0]=4 743 B10R1.22 NC1=CC(Cl)=CC(F)=C1O AT10612 [0,2,0,0,0,0|2,0,0]=4 744 B10R1.22 NC1=CC(F)=CC(F)=C1O 34412 [0,2,0,0,0,0|2,0,0]=4 745 B10R1.22 NC1=CC(F)=CC(N)=C1Br 57863 [0,2,0,0,0,0|2,0,0]=4 746 B10R1.22 OC1=C(Br)C=C(Cl)C=C1Cl C15816 [0,2,0,0,0,0|2,0,0]=4 747 B10R1.22 OC1=C(Cl)C=C(Cl)C=C1F C10592 [0,2,0,0,0,0|2,0,0]=4 748 B10R1.22 OC1=C(I)C=C(Br)C=C1Cl 57667 [0,2,0,0,0,0|2,0,0]=4 749 B10R1.22 OC1=CC(Br)=C(Cl)C(Br)=C1 AC6723 [0,2,0,0,0,0|1,0,0]=3 750 B10R1.22 OC1=CC(Br)=C(F)C(Cl)=C1 95329 [0,2,0,0,0,0|1,0,0]=3 751 B10R1.22 OC1=CC(Br)=C(F)C(F)=C1 D96237 [0,2,0,0,0,0|1,0,0]=3 752 B10R1.22 OC1=CC(Cl)=C(Br)C(Cl)=C1 C91269 [0,2,0,0,0,0|1,0,0]=3 753 B10R1.22 OC1=CC(Cl)=CC(Cl)=C1Br C90857 [0,2,0,0,0,0|1,0,0]=3 754 B10R1.22 OC1=CC(Cl)=CC(Cl)=C1I 53003 [0,2,0,0,0,0|1,0,0]=3 755 B10R1.22 OC1=CC(F)=CC(Cl)=C1Br C90827 [0,2,0,0,0,0|1,0,0]=3 756 B10R1.22 [2H]C1=CC(C)=C(N)C([2H])=C1 D99361 [0,2,0,0,0,0|1,0,0]=3 757 B10R1.22 [2H]C1=CC(Cl)=C(N)C([2H])=C1 D99210 [0,2,0,0,0,0|2,0,0]=4 758 B10R1.22 [2H]C1=CC(Cl)=CC([2H])=C1N D99114 [0,2,0,0,0,0|2,0,0]=4 759 B10R1.22 [2H]C1=CC(Cl)=CC([2H])=C1[2H] D98503 [0,2,0,0,0,0|2,0,0]=4 760 B10R1.22 [2H]C1=CC([2H])=C(Br)C([2H])=C1 D98801 [0,2,0,0,0,0|2,0,0]=4 761 B10R1.22 [2H]C1=CC([2H])=C(O)C([2H])=C1 D99569 [0,2,0,0,0,0|2,0,0]=4 762 B10R1.119 CC1=C(Br)C=CC(N)=C1Cl E72722 [0,2,0,0,0,0|1,0,0]=3 763 B10R1.119 CC1=C(Br)C=NC(N)=C1I 72279 [0,2,0,0,0,0|2,0,0]=4 764 B10R1.119 CC1=C(C)C(Br)=C(N)C=C1 AC4809 [0,2,0,0,0,0|1,0,0]=3 765 B10R1.119 CC1=C(C)C(Cl)=C(Cl)C=C1 AC6597 [0,2,0,0,0,0|1,0,0]=3 766 B10R1.119 CC1=C(C)C(N)=C(N)C=C1 77536 [0,2,0,0,0,0|1,0,0]=3 767 B10R1.119 CC1=C(Cl)C=CC(F)=C1Br 98311 [0,2,0,0,0,0|1,0,0]=3 768 B10R1.119 CC1=C(Cl)C=CC(N)=C1Cl W19151 [0,2,0,0,0,0|1,0,0]=3 769 B10R1.119 CC1=C(Cl)C=NC(N)=C1O F13362 [0,2,0,0,0,0|2,0,0]=4 770 B10R1.119 CC1=C(F)C=CC(F)=C1Br C90884 [0,2,0,0,0,0|1,0,0]=3 771 B10R1.119 CC1=C(F)C=CC(N)=C1Cl 22765 [0,2,0,0,0,0|1,0,0]=3 772 B10R1.119 CC1=C(F)C=CC(O)=C1Cl C90871 [0,2,0,0,0,0|0,0,0]=2 773 B10R1.119 CC1=C(I)C=CC(Br)=C1F AT11321 [0,2,0,0,0,0|1,0,0]=3 774 B10R1.119 CC1=C(I)C=NC(Cl)=C1F 67329 [0,2,0,0,0,0|2,0,0]=4 775 B10R1.119 CC1=C(N)C(=O)N(C)C=C1 AT19273 [0,2,0,0,0,0|1,0,1]=4 776 B10R1.119 CC1=C(N)C=CC(F)=C1Br C90841 [0,2,0,0,0,0|1,0,0]=3 777 B10R1.119 CC1=C(N)C=CC(F)=C1C 34354 [0,2,0,0,0,0|1,0,0]=3 778 B10R1.119 CC1=C(N)C=CC(I)=C1F S11390 [0,2,0,0,0,0|1,0,0]=3 779 B10R1.119 CC1=CC=C(Br)C(=O)N1C 91876 [0,2,0,0,0,0|1,0,1]=4 780 B10R1.119 CC1=CC=C(Br)C(Br)=C1N H11548 [0,2,0,0,0,0|1,0,0]=3 781 B10R1.119 CC1=CC=C(N)C(=O)N1C AT19272 [0,2,0,0,0,0|1,0,1]=4 782 B10R1.119 CC1=CC=C(O)C(C)=C1Br W18028 [0,2,0,0,0,0|1,0,0]=3 783 B10R1.119 CC1=CC=C(O)C(F)=C1F A12364 [0,2,0,0,0,0|1,0,0]=3 784 B10R1.119 CC1=CN=C(Cl)C(N)=C1N O10740 [0,2,0,0,0,0|2,0,0]=4 785 B10R1.119 CN1C(=O)C=CC(Br)=C1Cl AC8970 [0,2,0,0,0,0|2,0,0]=4 786 B10R1.119 NC1=C(Br)C(F)=CC=C1Br S10120 [0,2,0,0,0,0|2,0,0]=4 787 B10R1.119 NC1=C(Cl)C(Cl)=CC=C1F 95645 [0,2,0,0,0,0|2,0,0]=4 788 B10R1.119 NC1=C(Cl)C(F)=CC=C1F D96225 [0,2,0,0,0,0|2,0,0]=4 789 B10R1.119 NC1=C(Cl)C=CC(Br)=C1F D75961 [0,2,0,0,0,0|2,0,0]=4 790 B10R1.119 NC1=C(Cl)C=CC(Cl)=C1F 95650 [0,2,0,0,0,0|2,0,0]=4 791 B10R1.119 NC1=C(Cl)C=CC(Cl)=C1N F20769 [0,2,0,0,0,0|2,0,0]=4 792 B10R1.119 NC1=C(F)C=CC(Br)=C1Cl AT10552 [0,2,0,0,0,0|2,0,0]=4 793 B10R1.119 NC1=CC=C(O)C(F)=C1Cl C16464 [0,2,0,0,0,0|1,0,0]=3 794 B10R1.119 OC1=C(Br)C(F)=CC=C1Cl 96414 [0,2,0,0,0,0|1,0,0]=3 795 B10R1.119 OC1=C(Br)C(F)=CC=C1F 98242 [0,2,0,0,0,0|1,0,0]=3 796 B10R1.119 OC1=C(Cl)C=CC(Br)=C1F H11196 [0,2,0,0,0,0|1,0,0]=3 797 B10R1.119 OC1=C(Cl)C=CC(Cl)=C1O 73815 [0,2,0,0,0,0|1,0,0]=3 798 B10R1.119 OC1=C(F)C(F)=C(Cl)C=C1 N12663 [0,2,0,0,0,0|1,0,0]=3 799 B10R1.119 OC1=C(I)C=CC(I)=C1O C15671 [0,2,0,0,0,0|1,0,0]=3 800 B10R1.119 OC1=CC=C(F)C(Cl)=C1F N12876 [0,2,0,0,0,0|1,0,0]=3 801 B10R1.119 OC1=CC=C(F)C(F)=C1Cl 96418 [0,2,0,0,0,0|1,0,0]=3 802 B10R1.245 CC1=C(C#N)C(S)=NC=C1 51819 [0,2,0,0,0,0|1,1,0]=4 803 B10R1.245 CC1=C(C=O)C(F)=NC=C1 AT13974 [0,2,0,0,0,0|2,0,0]=4 804 B10R1.245 CC1=C(CN)C(=O)NC=C1 F18093 [0,2,0,0,0,0|1,0,1]=4 805 B10R1.245 CC1=CC=CC(Br)=C1CO D96259 [0,2,0,0,0,0|1,0,0]=3 806 B10R1.245 CC1=CC=CC(N)=C1C=O F15844 [0,2,0,0,0,0|1,0,0]=3 807 B10R1.245 CC1=CC=CC(N)=C1CO AC6550 [0,2,0,0,0,0|1,0,0]=3 808 B10R1.245 CC1=CC=C[N+]([O-])=C1C#N D87970 [0,2,0,0,0,0|1,0,1]=4 809 B10R1.245 CC1=CN=CC(Br)=C1C=O 51803 [0,2,0,0,0,0|2,0,0]=4 810 B10R1.245 CC1=CN=CC(C)=C1C=O 51703 [0,2,0,0,0,0|2,0,0]=4 811 B10R1.245 COC1=C(I)C=CC=C1Cl C90767 [0,2,0,0,0,0|2,0,0]=4 812 B10R1.245 COC1=C(O)C=CC=C1N AT15764 [0,2,0,0,0,0|1,0,0]=3 813 B10R1.245 COC1=C(O)C=CN=C1F 91686 [0,2,0,0,0,0|2,0,0]=4 814 B10R1.245 N#CC1=C(Cl)C=CC=C1S AT20865 [0,2,0,0,0,0|1,1,0]=4 815 B10R1.245 OCC1=C(Br)C=CC=C1Cl C91616 [0,2,0,0,0,0|2,0,0]=4 816 B10R1.245 OCC1=C(Br)C=CC=C1O 75753 [0,2,0,0,0,0|1,0,0]=3 817 B10R1.25 BrCC1=C(Br)C=C(Br)C=C1 C90776 [0,2,0,0,0,0|2,0,0]=4 818 B10R1.25 C#CC1=C(C)N=C(F)C=C1 AT20062 [0,2,0,0,0,0|2,0,0]=4 819 B10R1.25 C=CC1=C(F)C=C(Cl)C=C1 AC6667 [0,2,0,0,0,0|2,0,0]=4 820 B10R1.25 CC1=C(C#N)C=CC(S)=C1 AT20986 [0,2,0,0,0,0|0,1,0]=3 821 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [0,2,0,0,0,0|1,0,0]=3 822 B10R1.25 CC1=C(CCl)C=CC(F)=N1 77960 [0,2,0,0,0,0|2,0,0]=4 823 B10R1.25 CC1=C(CO)C=CC(Br)=N1 AT12929 [0,2,0,0,0,0|2,0,0]=4 824 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [0,2,0,0,0,0|1,0,0]=3 825 B10R1.25 CC1=C(CO)C=CC(Cl)=N1 F16741 [0,2,0,0,0,0|2,0,0]=4 826 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [0,2,0,0,0,0|1,0,0]=3 827 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [0,2,0,0,0,0|0,0,0]=2 828 B10R1.25 CC1=CC(Br)=C(C=O)C=N1 C14106 [0,2,0,0,0,0|2,0,0]=4 829 B10R1.25 CC1=CC(Br)=C(C=O)N=C1 53823 [0,2,0,0,0,0|2,0,0]=4 830 B10R1.25 CC1=CC(C)=NC=C1CN W16199 [0,2,0,0,0,0|2,0,0]=4 831 B10R1.25 CC1=CC(Cl)=CN=C1C=O 97693 [0,2,0,0,0,0|2,0,0]=4 832 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [0,2,0,0,0,0|1,0,0]=3 833 B10R1.25 CC1=CC(F)=C(CO)C=C1 98275 [0,2,0,0,0,0|1,0,0]=3 834 B10R1.25 CC1=CC(F)=C(NN)C=C1 A12578 [0,2,0,0,0,0|1,0,0]=3 835 B10R1.25 CC1=CC(F)=CN=C1C#N 55147 [0,2,0,0,0,0|2,0,0]=4 836 B10R1.25 CC1=CC(N)=C(C#N)C=N1 P18774 [0,2,0,0,0,0|2,0,0]=4 837 B10R1.25 CC1=CC(N)=C(C=O)C=C1 F15845 [0,2,0,0,0,0|1,0,0]=3 838 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [0,2,0,0,0,0|1,0,0]=3 839 B10R1.25 CC1=CC(O)=C(CO)C=C1 N12596 [0,2,0,0,0,0|0,0,0]=2 840 B10R1.25 CC1=CC=C(C#N)C(S)=N1 94430 [0,2,0,0,0,0|1,1,0]=4 841 B10R1.25 CC1=CN=C(CBr)C(C)=C1 O10504 [0,2,0,0,0,0|2,0,0]=4 842 B10R1.25 CC1=CN=C(CN)C(C)=C1 D73748 [0,2,0,0,0,0|2,0,0]=4 843 B10R1.25 CC1=C[N+]([O-])=C(C#N)C=C1 87753 [0,2,0,0,0,0|1,0,1]=4 844 B10R1.25 CC1=NC(C)=C(C=O)C=C1 F12423 [0,2,0,0,0,0|2,0,0]=4 845 B10R1.25 CC1=NC(N)=C(C#N)C=C1 P17376 [0,2,0,0,0,0|2,0,0]=4 846 B10R1.25 CC1=NC=C(CO)C(O)=N1 C76221 [0,2,0,0,0,0|2,0,0]=4 847 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [0,2,0,0,0,0|2,0,0]=4 848 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [0,2,0,0,0,0|2,0,0]=4 849 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [0,2,0,0,0,0|2,0,0]=4 850 B10R1.25 CNC1=CN=C(Br)C=C1C 96211 [0,2,0,0,0,0|2,0,0]=4 851 B10R1.25 CNC1=CN=C(Cl)C=C1C 96215 [0,2,0,0,0,0|2,0,0]=4 852 B10R1.25 CNC1=NC=C(C)C=C1N D75084 [0,2,0,0,0,0|2,0,0]=4 853 B10R1.25 COC1=C(Br)C=C(O)C=N1 C72194 [0,2,0,0,0,0|2,0,0]=4 854 B10R1.25 COC1=C(C)N=C(N)C=C1 F53499 [0,2,0,0,0,0|2,0,0]=4 855 B10R1.25 COC1=C(F)C=C(O)C=N1 91782 [0,2,0,0,0,0|2,0,0]=4 856 B10R1.25 COC1=C(I)C=C(C)N=C1 96426 [0,2,0,0,0,0|2,0,0]=4 857 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [0,2,0,0,0,0|2,0,0]=4 858 B10R1.25 COC1=C(O)N=C(C)N=C1 F30536 [0,2,0,0,0,0|2,0,0]=4 859 B10R1.25 COC1=NC=C(C)C=C1N D74381 [0,2,0,0,0,0|2,0,0]=4 860 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [0,2,0,0,0,0|2,0,0]=4 861 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [0,2,0,0,0,0|1,0,0]=3 862 B10R1.25 CSC1=NC=C(Br)C=C1C AT14138 [0,2,0,0,0,0|2,0,0]=4 863 B10R1.25 FC1=CC(F)=C(CS)C=C1 AT13686 [0,2,0,0,0,0|2,0,0]=4 864 B10R1.25 N#CC1=C(Cl)C=C(S)C=C1 AT20867 [0,2,0,0,0,0|1,1,0]=4 865 B10R1.25 N#CC1=C(F)C=C(O)C=N1 D79759 [0,2,0,0,0,0|2,0,0]=4 866 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [0,2,0,0,0,0|2,0,0]=4 867 B10R1.25 NC1=CC(F)=C(CO)C=C1 AT26531 [0,2,0,0,0,0|2,0,0]=4 868 B10R1.25 NC1=CC(O)=C(CO)C=C1 D76340 [0,2,0,0,0,0|1,0,0]=3 869 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11648 [0,2,0,0,0,0|2,0,0]=4 870 B10R1.25 NCC1=C(Cl)C=C(O)C=C1 F52064 [0,2,0,0,0,0|1,0,0]=3 871 B10R1.25 NCC1=C(F)C=C(N)C=C1 C90567 [0,2,0,0,0,0|2,0,0]=4 872 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14307 [0,2,0,0,0,0|1,0,0]=3 873 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [0,2,0,0,0,0|2,0,0]=4 874 B10R1.25 NCC1=C(O)C=C(Br)C=C1 AT19138 [0,2,0,0,0,0|1,0,0]=3 875 B10R1.25 NCC1=C(O)C=C(O)C=C1 I11211 [0,2,0,0,0,0|1,0,0]=3 876 B10R1.25 NNC1=C(Br)C=C(F)C=C1 69916 [0,2,0,0,0,0|2,0,0]=4 877 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 C10398 [0,2,0,0,0,0|2,0,0]=4 878 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 C90858 [0,2,0,0,0,0|2,0,0]=4 879 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 C90809 [0,2,0,0,0,0|2,0,0]=4 880 B10R1.25 OCC1=C(O)C=C(F)C=C1 A51208 [0,2,0,0,0,0|1,0,0]=3 881 B10R1.118 CC1=C(Br)N=C(Br)C(N)=C1 O10625 [0,2,0,0,0,0|2,0,0]=4 882 B10R1.118 CC1=C(Cl)C=C(N)C(F)=C1 F13823 [0,2,0,0,0,0|1,0,0]=3 883 B10R1.118 CC1=C(Cl)C=C(N)C(F)=C1 F13824 [0,2,0,0,0,0|1,0,0]=3 884 B10R1.118 CC1=C(N)N=C(Br)C(F)=C1 F19626 [0,2,0,0,0,0|2,0,0]=4 885 B10R1.118 CC1=CC(Br)=C(Cl)C=C1O AR2867 [0,2,0,0,0,0|1,0,0]=3 886 B10R1.118 CC1=CC(C)=C(N)C=C1N F31159 [0,2,0,0,0,0|1,0,0]=3 887 B10R1.118 CC1=CC(Cl)=C(I)C=C1C O10394 [0,2,0,0,0,0|1,0,0]=3 888 B10R1.118 CC1=CC(Cl)=C(N)C=C1Cl 95140 [0,2,0,0,0,0|1,0,0]=3 889 B10R1.118 CC1=CC(F)=C(Br)C=C1C D87743 [0,2,0,0,0,0|1,0,0]=3 890 B10R1.118 CC1=CC(F)=C(Br)C=C1F CL9322 [0,2,0,0,0,0|1,0,0]=3 891 B10R1.118 CC1=CC(I)=C(C)C=C1N D76806 [0,2,0,0,0,0|1,0,0]=3 892 B10R1.118 CC1=CC(I)=C(Cl)C=C1Br E70017 [0,2,0,0,0,0|1,0,0]=3 893 B10R1.118 CC1=CC(I)=C(I)C=C1C S12295 [0,2,0,0,0,0|1,0,0]=3 894 B10R1.118 CC1=CC(O)=C(C)N=C1Br D80172 [0,2,0,0,0,0|1,0,0]=3 895 B10R1.118 CC1=CC(O)=C(Cl)C=C1F C90829 [0,2,0,0,0,0|0,0,0]=2 896 B10R1.118 CC1=CC(O)=C(I)C=C1Cl 58349 [0,2,0,0,0,0|0,0,0]=2 897 B10R1.118 CC1=CC(S)=C(Cl)C=C1Cl 34560 [0,2,0,0,0,0|0,1,0]=3 898 B10R1.118 CC1=NC(Cl)=C(Br)C=C1N C91671 [0,2,0,0,0,0|2,0,0]=4 899 B10R1.118 CC1=NC(N)=C(I)C=C1Br 82189 [0,2,0,0,0,0|2,0,0]=4 900 B10R1.118 CC1=NC(O)=C(C)N=C1O N13378 [0,2,0,0,0,0|2,0,0]=4 901 B10R1.118 CN1C=C(Br)C(Cl)=CC1=O C90978 [0,2,0,0,0,0|2,0,0]=4 902 B10R1.118 FC1=C(Br)C=C(S)C(Cl)=C1 F21490 [0,2,0,0,0,0|1,1,0]=4 903 B10R1.118 FC1=CC(Br)=C(Br)C=C1Br AC1261 [0,2,0,0,0,0|2,0,0]=4 904 B10R1.118 FC1=CC(Cl)=C(Cl)C=C1Cl AC8775 [0,2,0,0,0,0|2,0,0]=4 905 B10R1.118 FC1=CC(Cl)=C(F)C=C1Cl 34812 [0,2,0,0,0,0|2,0,0]=4 906 B10R1.118 NC1=C(I)C=C(Cl)C(Br)=C1 53897 [0,2,0,0,0,0|2,0,0]=4 907 B10R1.118 NC1=C(I)C=C(F)C(Br)=C1 S10262 [0,2,0,0,0,0|2,0,0]=4 908 B10R1.118 NC1=CC(Br)=C(Br)C=C1O F14372 [0,2,0,0,0,0|1,0,0]=3 909 B10R1.118 NC1=CC(F)=C(Br)C=C1Cl E72116 [0,2,0,0,0,0|2,0,0]=4 910 B10R1.118 NC1=CC(F)=C(O)C=C1F AC9755 [0,2,0,0,0,0|1,0,0]=3 911 B10R1.118 NC1=CC(I)=C(O)C=C1F AC1882 [0,2,0,0,0,0|1,0,0]=3 912 B10R1.118 NC1=CC(N)=C(Cl)C=C1Cl W16789 [0,2,0,0,0,0|2,0,0]=4 913 B10R1.118 NC1=CC(N)=C(N)C=C1N C14431 [0,2,0,0,0,0|2,0,0]=4 914 B10R1.118 NC1=CC(O)=C(Br)C=C1Cl 58355 [0,2,0,0,0,0|1,0,0]=3 915 B10R1.118 OC1=C(Cl)C=C(F)C(F)=C1 96412 [0,2,0,0,0,0|1,0,0]=3 916 B10R1.118 OC1=CC(F)=C(Br)C=C1Br D87887 [0,2,0,0,0,0|1,0,0]=3 917 B10R1.118 OC1=CC(I)=C(F)C=C1F D96234 [0,2,0,0,0,0|1,0,0]=3 918 B10R1.118 [2H]C1=CC([2H])=C([2H])C=C1[2H] D98240 [0,2,0,0,0,0|2,0,0]=4 919 B8R1.7 C=C(C)C1=NC=CS1 T71747 [0,0,1,1,0,0|1,1,0]=4 920 B8R1.7 CC(=O)C1=CN=CO1 F19037 [0,0,1,1,0,0|2,0,0]=4 921 B8R1.7 C[C@H](N)C1=CC=CO1 74860 [0,0,1,1,0,0|1,0,1]=4 922 B8R1.7 C[C@H](N)C1=CC=CO1 F16901 [0,0,1,1,0,0|1,0,1]=4 923 B8R1.7 C[C@H](N)C1=CC=CO1 N12744 [0,0,1,1,0,0|1,0,1]=4 924 B8R1.7 NC(=S)C1=CC=CO1 F11945 [0,0,1,1,0,0|2,0,0]=4 925 B6R1.2 CC1=CN=CO1 C77581 [1,0,0,0,1,0|2,0,0]=4 926 B6R1.2 CC1=NC=CO1 O10838 [1,0,0,0,1,0|2,0,0]=4 927 B6R1.2 CC1=NSC=C1 AC6637 [1,0,0,0,1,0|2,0,0]=4 928 B6R1.2 NC1=CC=CS1 44128 [1,0,0,0,1,0|2,0,0]=4 929 B6R1.2 NC1=CC=CS1 F10359 [1,0,0,0,1,0|2,0,0]=4 930 B6R1.2 OC1=CON=C1 AT21052 [1,0,0,0,1,0|2,0,0]=4 931 B6R1.2 [2H]N1C=CC=C1 D98995 [1,0,0,0,1,0|2,0,0]=4