0 B8R1.2 BrCC1=CN=CN=C1 F52462 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.2 BrCC1=NC=CC=N1 D79434 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.2 C=CC1=CC=CN=C1 71366 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.2 C=CC1=NC=CN=C1 T72447 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.2 CNC1=CC=CN=N1 79165 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.2 CSC1=NC=CC=N1 O10841 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.2 ClCC1=NC=NC=C1 A10562 [0,0,0,0,0,0|3,0,1]=4 7 B8R1.2 NCC1=CC=CC=C1 T70846 [0,0,0,0,0,0|1,0,1]=2 8 B8R1.2 NNC1=CC=CN=N1 C15759 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.2 NNC1=NC=NC=C1 57488 [0,0,0,0,0,0|4,0,0]=4 10 B8R1.2 SCC1=NC=CN=C1 78318 [0,0,0,0,0,0|2,1,1]=4 11 B8R1.2 [2H]OC1=CC=CC=C1 D99313 [0,0,0,0,0,0|2,0,0]=2 12 B7R1.3 ClC1=CC=NC=C1 F17303 [1,0,0,0,0,0|2,0,0]=3 13 B7R1.3 ClC1=CN=NC=C1 F19795 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.3 ClC1=NC=CC=N1 F20795 [1,0,0,0,0,0|3,0,0]=4 15 B7R1.3 ClC1=NC=NC=C1 F18311 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.3 FC1=CC=NC=C1 F19691 [1,0,0,0,0,0|2,0,0]=3 17 B7R1.3 FC1=CN=CN=C1 F14737 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.3 F[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 40525 [1,0,0,0,0,0|1,0,0]=2 19 B7R1.3 IC1=NC=NC=C1 C15557 [1,0,0,0,0,0|3,0,0]=4 20 B7R1.3 O=C1C=NCN=C1 36727 [1,0,0,0,0,0|2,0,1]=4 21 B7R1.3 O=C1C=NN=CN1 F30273 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.3 OC1=CN=NC=C1 O12057 [1,0,0,0,0,0|2,0,1]=4 23 B7R1.3 SC1=NN=CC=C1 AT13031 [1,0,0,0,0,0|2,1,0]=4 24 B7R1.3 [15NH2]C1=CC=CC=C1 41405 [1,0,0,0,0,0|1,0,0]=2 25 B7R1.3 [2H]C1=CC=CC=C1 D98570 [1,0,0,0,0,0|1,0,0]=2 26 B7R1.3 [2H]C1=CC=NC=C1 D98795 [1,0,0,0,0,0|2,0,0]=3 27 B7R1.3 [2H]C1=NC=CC=C1 D98277 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.1 C=CC1=CN=C(C)N=C1 P14948 [0,1,0,0,0,0|3,0,0]=4 29 B9R1.1 C=CC1=CN=C(F)C=C1 79557 [0,1,0,0,0,0|2,0,0]=3 30 B9R1.1 CC1=NC=C(CBr)C=C1 F52459 [0,1,0,0,0,0|2,0,1]=4 31 B9R1.1 CC1=NC=C(CCl)C=C1 D87733 [0,1,0,0,0,0|2,0,1]=4 32 B9R1.1 CC1=NC=C(NN)C=C1 P10368 [0,1,0,0,0,0|3,0,0]=4 33 B9R1.1 CCN1C=CC(=S)C=C1 W16146 [0,1,0,0,0,0|2,0,1]=4 34 B9R1.1 CNC1=CC=C(N)C=C1 C78356 [0,1,0,0,0,0|2,0,0]=3 35 B9R1.1 CNC1=NC=C(N)C=C1 Y13586 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.1 COC1=CN=C(I)C=C1 F17075 [0,1,0,0,0,0|3,0,0]=4 37 B9R1.1 CSC1=NC=C(N)C=C1 D73901 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.1 C[Se]C1=CC=C(Br)C=C1 97865 [0,1,0,0,0,0|2,0,0]=3 39 B9R1.1 ClC1=CN=C(CBr)C=C1 S12201 [0,1,0,0,0,0|2,0,1]=4 40 B9R1.1 ClCC1=CN=C(Cl)C=C1 W18630 [0,1,0,0,0,0|2,0,1]=4 41 B9R1.1 FC1=CN=C(CCl)C=C1 P19178 [0,1,0,0,0,0|2,0,1]=4 42 B9R1.1 NC1=NC=C(CCl)C=C1 AT22351 [0,1,0,0,0,0|2,0,1]=4 43 B9R1.1 NCC1=CC=C(F)C=C1 N12249 [0,1,0,0,0,0|1,0,1]=3 44 B9R1.1 NCC1=CC=C(S)C=C1 AT20992 [0,1,0,0,0,0|1,0,1]=3 45 B9R1.1 NCC1=NC=C(F)C=C1 83593 [0,1,0,0,0,0|2,0,1]=4 46 B9R1.1 NCC1=NC=C(I)C=C1 C91084 [0,1,0,0,0,0|2,0,1]=4 47 B9R1.1 NNC1=CN=C(Br)C=C1 68947 [0,1,0,0,0,0|3,0,0]=4 48 B9R1.1 NNC1=CN=C(Br)C=C1 W15223 [0,1,0,0,0,0|3,0,0]=4 49 B9R1.1 NNC1=NC=C(I)C=C1 C91520 [0,1,0,0,0,0|3,0,0]=4 50 B9R1.1 O=C1C=CC(=NCl)C=C1 T72753 [0,1,0,0,0,0|2,0,0]=3 51 B9R1.1 O=CC1=CN=C(Br)N=C1 55465 [0,1,0,0,0,0|2,0,0]=3 52 B9R1.1 O=CC1=CN=C(F)C=N1 P15039 [0,1,0,0,0,0|2,0,0]=3 53 B9R1.1 O=CC1=NC=C(Br)C=N1 38375 [0,1,0,0,0,0|2,0,0]=3 54 B9R1.1 [2H]CC1=CC=C(F)C=C1 D98910 [0,1,0,0,0,0|1,0,1]=3 55 B9R1.2 C#CC1=CC(C)=CN=C1 AT12963 [0,1,0,0,0,0|2,0,1]=4 56 B9R1.2 C#CC1=CC=CC(N)=N1 C73323 [0,1,0,0,0,0|2,0,1]=4 57 B9R1.2 C#CC1=CN=CC(N)=C1 C76102 [0,1,0,0,0,0|2,0,1]=4 58 B9R1.2 C=CC1=CC=NC(N)=N1 AT12778 [0,1,0,0,0,0|3,0,0]=4 59 B9R1.2 CC1=CC(C=O)=NC=N1 AT18315 [0,1,0,0,0,0|2,0,0]=3 60 B9R1.2 CC1=CC(CBr)=CN=C1 43925 [0,1,0,0,0,0|2,0,1]=4 61 B9R1.2 CC1=NC=CC(NN)=C1 F16202 [0,1,0,0,0,0|3,0,0]=4 62 B9R1.2 CNC1=NC=CC(N)=C1 F12690 [0,1,0,0,0,0|3,0,0]=4 63 B9R1.2 COC1=CC(O)=NC=C1 F17762 [0,1,0,0,0,0|3,0,0]=4 64 B9R1.2 COC1=CN=CC(N)=C1 P11509 [0,1,0,0,0,0|3,0,0]=4 65 B9R1.2 CSC1=CC(Cl)=CN=C1 AT19857 [0,1,0,0,0,0|3,0,0]=4 66 B9R1.2 C\N=C1\C=C(C)C=CN1 W18359 [0,1,0,0,0,0|3,0,0]=4 67 B9R1.2 ClC1=NC=CC(CBr)=C1 C16429 [0,1,0,0,0,0|2,0,1]=4 68 B9R1.2 ClCC1=NC=CC(Cl)=C1 C13998 [0,1,0,0,0,0|2,0,1]=4 69 B9R1.2 FC1=CC(CCl)=CN=C1 O10881 [0,1,0,0,0,0|2,0,1]=4 70 B9R1.2 N#CC1=CC(I)=NC=C1 A11430 [0,1,0,0,0,0|2,0,1]=4 71 B9R1.2 N#CC1=NC=CC(I)=C1 P10625 [0,1,0,0,0,0|2,0,1]=4 72 B9R1.2 NC1=NC=CC(C=O)=C1 O10660 [0,1,0,0,0,0|1,0,0]=2 73 B9R1.2 NCC1=CC(=O)NC=C1 37540 [0,1,0,0,0,0|2,0,1]=4 74 B9R1.2 NCC1=CC(Br)=CN=C1 F19818 [0,1,0,0,0,0|2,0,1]=4 75 B9R1.2 NCC1=CC(F)=NC=C1 W18404 [0,1,0,0,0,0|2,0,1]=4 76 B9R1.2 NCC1=CC(N)=NC=C1 AC6477 [0,1,0,0,0,0|2,0,1]=4 77 B9R1.2 NCC1=CC=CC(Cl)=N1 C72946 [0,1,0,0,0,0|2,0,1]=4 78 B9R1.2 NCC1=CC=CC(I)=C1 CK2420 [0,1,0,0,0,0|1,0,1]=3 79 B9R1.2 NCC1=CC=CC(O)=N1 F10425 [0,1,0,0,0,0|2,0,1]=4 80 B9R1.2 NCC1=NC=CC(Br)=C1 26892 [0,1,0,0,0,0|2,0,1]=4 81 B9R1.2 NCC1=NC=CC(F)=C1 C71953 [0,1,0,0,0,0|2,0,1]=4 82 B9R1.2 NCC1=NC=CC(N)=C1 77886 [0,1,0,0,0,0|2,0,1]=4 83 B9R1.2 NNC1=NC(N)=CC=C1 C91519 [0,1,0,0,0,0|3,0,0]=4 84 B9R1.2 O=CC1=CC(I)=CN=C1 H10413 [0,1,0,0,0,0|1,0,0]=2 85 B9R1.2 [2H]CC1=CC=CC(F)=C1 D99661 [0,1,0,0,0,0|1,0,1]=3 86 B9R1.2 [O-][N+]1=CC=CC(CCl)=C1 96310 [0,1,0,0,0,0|2,0,1]=4 87 B9R1.6 C[C@H](Cl)C1=NC=CC=C1 F13293 [0,1,0,0,0,0|2,0,1]=4 88 B9R1.6 C[C@H](N)C1=CC=CN=C1 S11132 [0,1,0,0,0,0|2,0,1]=4 89 B9R1.6 C[C@H](N)C1=CC=NC=C1 F31048 [0,1,0,0,0,0|2,0,1]=4 90 B9R1.6 C[C@H](N)C1=NC=CC=C1 90514 [0,1,0,0,0,0|2,0,1]=4 91 B9R1.6 N=C(N)C1=CC=CN=N1 F30256 [0,1,0,0,0,0|3,0,0]=4 92 B9R1.6 N=C(N)C1=CC=NC=C1 71449 [0,1,0,0,0,0|2,0,0]=3 93 B9R1.6 N=C(N)C1=NC=NC=C1 F30402 [0,1,0,0,0,0|3,0,0]=4 94 B9R1.6 NC(=O)C1=NC=CC=N1 C11052 [0,1,0,0,0,0|2,0,0]=3 95 B9R1.6 O=C(Cl)C1=CC=NC=C1 D78267 [0,1,0,0,0,0|1,0,0]=2 96 B9R1.6 O=C([O-])C1=NC=CC=C1 T71798 [0,1,0,0,0,0|1,0,0]=2 97 B9R1.6 O=C([O-])C1=NN=CC=N1 D72030 [0,1,0,0,0,0|3,0,0]=4 98 B9R1.6 O=[13C](O)C1=CC=CC=C1 F13987 [0,1,0,0,0,0|0,0,0]=1 99 B9R1.6 O=[N+]([O-])C1=CN=CN=C1 C14718 [0,1,0,0,0,0|3,0,0]=4 100 B9R1.6 [2H]C(=C)C1=CC=CC=C1 D97969 [0,1,0,0,0,0|1,0,0]=2 101 B9R1.6 [2H]N([2H])C1=CC=CC=C1 D98688 [0,1,0,0,0,0|2,0,0]=3 102 B9R1.8 BrC#CC1=CN=CC=C1 50128 [0,1,0,0,0,0|2,0,1]=4 103 B9R1.8 BrC#CC1=NC=CC=C1 94426 [0,1,0,0,0,0|2,0,1]=4 104 B9R1.8 BrCCC1=CN=CC=C1 C77647 [0,1,0,0,0,0|2,0,1]=4 105 B9R1.8 C#C[I+]C1=CC=CC=C1 T71678 [0,1,0,0,0,0|1,0,1]=3 106 B9R1.8 CCCC1=CC=CN=C1 O11051 [0,1,0,0,0,0|2,0,1]=4 107 B9R1.8 CCC[N+]1=CC=CC=C1 T72121 [0,1,0,0,0,0|2,0,1]=4 108 B9R1.8 CNNC1=CC=CC=C1 C77159 [0,1,0,0,0,0|2,0,0]=3 109 B9R1.8 FCCC1=CC=CC=C1 75534 [0,1,0,0,0,0|1,0,1]=3 110 B9R1.8 IC#CC1=CC=CC=C1 N11813 [0,1,0,0,0,0|1,0,1]=3 111 B9R1.8 NCCC1=CC=CC=C1 T71816 [0,1,0,0,0,0|1,0,1]=3 112 B9R1.8 NCCC1=CC=CC=C1 T72591 [0,1,0,0,0,0|1,0,1]=3 113 B9R1.8 NNCC1=NC=CC=C1 P10521 [0,1,0,0,0,0|2,0,1]=4 114 B9R1.8 OCCC1=CC=NC=C1 T72404 [0,1,0,0,0,0|1,0,2]=4 115 B9R1.8 S=C=NC1=NC=CC=C1 C11368 [0,1,0,0,0,0|1,1,1]=4 116 B9R1.8 SCCC1=NC=CC=C1 F18309 [0,1,0,0,0,0|1,1,1]=4 117 B9R1.8 [C-]#[N+]CC1=CC=NC=C1 AC8779 [0,1,0,0,0,0|2,0,1]=4 118 B9R1.8 [C-]#[N+]CC1=CN=CC=C1 F16136 [0,1,0,0,0,0|2,0,1]=4 119 B9R1.15 C#CC1=C(C)C=CN=C1 AT12962 [0,1,0,0,0,0|2,0,1]=4 120 B9R1.15 C#CC1=C(N)C=NC=C1 D83940 [0,1,0,0,0,0|2,0,1]=4 121 B9R1.15 C#CC1=CC=CN=C1C AT12964 [0,1,0,0,0,0|2,0,1]=4 122 B9R1.15 C#CC1=CC=CN=C1Cl AT12435 [0,1,0,0,0,0|2,0,1]=4 123 B9R1.15 C#CC1=CC=CN=C1N 72370 [0,1,0,0,0,0|2,0,1]=4 124 B9R1.15 C#CC1=NC=CC=C1C 79080 [0,1,0,0,0,0|2,0,1]=4 125 B9R1.15 C=CC1=C(C)C=CC=C1 T72704 [0,1,0,0,0,0|1,0,0]=2 126 B9R1.15 C=CC1=C(C)C=CN=C1 P11580 [0,1,0,0,0,0|2,0,0]=3 127 B9R1.15 C=CC1=CC=CN=C1F P13082 [0,1,0,0,0,0|2,0,0]=3 128 B9R1.15 CC1=C(C=O)C=NC=N1 O11269 [0,1,0,0,0,0|2,0,0]=3 129 B9R1.15 CC1=C(CBr)C=CC=N1 FD9046 [0,1,0,0,0,0|2,0,1]=4 130 B9R1.15 CC1=C(CBr)C=CC=N1 P11218 [0,1,0,0,0,0|2,0,1]=4 131 B9R1.15 CC1=C(CCl)C=CC=N1 P10970 [0,1,0,0,0,0|2,0,1]=4 132 B9R1.15 CC1=C(CCl)C=NC=C1 P10971 [0,1,0,0,0,0|2,0,1]=4 133 B9R1.15 CC1=CC=CN=C1CBr D97530 [0,1,0,0,0,0|2,0,1]=4 134 B9R1.15 CCC1=C(Br)C=CN=C1 H11182 [0,1,0,0,0,0|2,0,1]=4 135 B9R1.15 CCC1=CC=CN=C1C 75814 [0,1,0,0,0,0|2,0,1]=4 136 B9R1.15 COC1=C(Br)C=CN=C1 F10479 [0,1,0,0,0,0|3,0,0]=4 137 B9R1.15 COC1=C(C)C=NC=C1 D74380 [0,1,0,0,0,0|3,0,0]=4 138 B9R1.15 ClC1=CC=CN=C1CBr 79180 [0,1,0,0,0,0|2,0,1]=4 139 B9R1.15 ClC1=CC=CN=C1CBr 86640 [0,1,0,0,0,0|2,0,1]=4 140 B9R1.15 ClCC1=CC=CN=C1Br 55187 [0,1,0,0,0,0|2,0,1]=4 141 B9R1.15 FC1=C(CBr)C=CC=N1 AT20654 [0,1,0,0,0,0|2,0,1]=4 142 B9R1.15 N#CC1=C(O)C=NC=C1 AT12828 [0,1,0,0,0,0|2,0,1]=4 143 B9R1.15 N#CC1=C(S)C=CC=C1 AT20892 [0,1,0,0,0,0|1,0,1]=3 144 B9R1.15 N#CC1=C(S)C=CN=C1 C77520 [0,1,0,0,0,0|2,0,1]=4 145 B9R1.15 NC1=C(C=O)C=NC=C1 W12249 [0,1,0,0,0,0|1,0,0]=2 146 B9R1.15 NC1=C(CCl)C=CC=N1 89794 [0,1,0,0,0,0|2,0,1]=4 147 B9R1.15 NCC1=C(Br)C=NC=C1 98160 [0,1,0,0,0,0|2,0,1]=4 148 B9R1.15 NCC1=C(Cl)C=CN=C1 C11073 [0,1,0,0,0,0|2,0,1]=4 149 B9R1.15 NCC1=C(F)C=CN=C1 C90218 [0,1,0,0,0,0|2,0,1]=4 150 B9R1.15 NCC1=C(I)C=CC=C1 AT26620 [0,1,0,0,0,0|1,0,1]=3 151 B9R1.15 NCC1=C(O)C=CC=N1 C73700 [0,1,0,0,0,0|2,0,1]=4 152 B9R1.15 NCC1=C(O)C=CN=C1 AT18117 [0,1,0,0,0,0|2,0,1]=4 153 B9R1.15 NCC1=CC=CN=C1Cl 37571 [0,1,0,0,0,0|2,0,1]=4 154 B9R1.15 NCC1=CC=CN=C1N CL0345 [0,1,0,0,0,0|2,0,1]=4 155 B9R1.15 NCC1=[N+]([O-])C=CC=C1 D86206 [0,1,0,0,0,0|2,0,1]=4 156 B9R1.15 NNC1=C(Br)C=CC=N1 F30216 [0,1,0,0,0,0|3,0,0]=4 157 B9R1.15 NNC1=CC=CN=C1Cl D76828 [0,1,0,0,0,0|3,0,0]=4 158 B9R1.15 O=CC1=CNC=CC1=O O11278 [0,1,0,0,0,0|1,0,0]=2 159 B9R1.15 OCC1=C(F)C=CN=C1 P11878 [0,1,0,0,0,0|1,0,2]=4 160 B9R1.15 [2H]CC1=C(F)C=CC=C1 D99779 [0,1,0,0,0,0|1,0,1]=3 161 B9R1.15 [C-]#[N+]C1=C(Cl)C=CC=C1 AC9402 [0,1,0,0,0,0|2,0,0]=3 162 B7R1.1 C=CC1=NC=CS1 C72532 [0,0,0,0,1,0|3,0,0]=4 163 B7R1.1 ClCC1=CSC=C1 AT17055 [0,0,0,0,1,0|2,0,1]=4 164 B7R1.1 NCC1=COC=C1 61502 [0,0,0,0,1,0|2,0,1]=4 165 B7R1.1 NNC1=CC=CS1 W17128 [0,0,0,0,1,0|3,0,0]=4 166 B7R1.1 O=CC1=CSN=C1 83208 [0,0,0,0,1,0|2,0,0]=3 167 B7R1.1 O=CC1=CSN=N1 A51062 [0,0,0,0,1,0|3,0,0]=4 168 B7R1.1 OCC1=CC=CN1 AT16114 [0,0,0,0,1,0|1,0,2]=4 169 B7R1.1 SCC1=CC=CS1 T72725 [0,0,0,0,1,0|1,1,1]=4 170 B6R0.6 O=C\C=C\C=C\[O-] 98104 [1,0,1,0,0,0|1,0,0]=3 171 B6R0.4 C=C\C=C/C(=O)O C74528 [1,0,1,0,0,0|1,0,0]=3 172 B6R0.4 C=C\C=C\C(=O)O 35918 [1,0,1,0,0,0|1,0,0]=3 173 B8R1.3 NC1=CN=C(S)C=C1 AT20609 [1,1,0,0,0,0|1,1,0]=4 174 B8R1.3 NC1=NNC(=O)C=C1 AT17777 [1,1,0,0,0,0|2,0,0]=4 175 B8R1.3 O=C1C=CC(=O)N=N1 83325 [1,1,0,0,0,0|2,0,0]=4 176 B8R1.3 O=C1C=CC(F)=NN1 AT24740 [1,1,0,0,0,0|2,0,0]=4 177 B8R1.3 [2H]C1=CC=C(Cl)C=C1 D98354 [1,1,0,0,0,0|1,0,0]=3 178 B8R1.3 [2H]C1=CC=C([2H])C=C1 D99669 [1,1,0,0,0,0|1,0,0]=3 179 B8R1.4 BrC1=CC(I)=NC=C1 A10666 [1,1,0,0,0,0|2,0,0]=4 180 B8R1.4 CC1=CC(I)=NC=C1 D87895 [1,1,0,0,0,0|1,0,1]=4 181 B8R1.4 NC1=CC=CC(=S)N1 C15708 [1,1,0,0,0,0|1,1,0]=4 182 B8R1.4 O=C1C=C(S)NC=N1 FD7370 [1,1,0,0,0,0|2,0,0]=4 183 B8R1.4 O=C1C=CNC(=O)O1 C15625 [1,1,0,0,0,0|2,0,0]=4 184 B8R1.4 OC1=CC(I)=CN=C1 D74429 [1,1,0,0,0,0|1,0,1]=4 185 B8R1.4 SC1=CC(Br)=CN=C1 P12662 [1,1,0,0,0,0|1,1,0]=4 186 B8R1.4 [2H]C1=CC=CC([2H])=C1 D99674 [1,1,0,0,0,0|1,0,0]=3 187 B8R1.4 [2H]C1=CC=CC([2H])=N1 D98925 [1,1,0,0,0,0|2,0,0]=4 188 B8R1.5 CC1=CC=NNC1=O 20227 [1,1,0,0,0,0|2,0,0]=4 189 B8R1.5 CC1=[N+](C)C=CC=C1 D87448 [1,1,0,0,0,0|1,0,1]=4 190 B8R1.5 FC1=C(F)C=NC=C1 O10910 [1,1,0,0,0,0|2,0,0]=4 191 B8R1.5 FC1=CC=CN=C1S AT18759 [1,1,0,0,0,0|1,1,0]=4 192 B8R1.5 NC1=C(S)C=NC=C1 P11896 [1,1,0,0,0,0|1,1,0]=4 193 B8R1.5 O=C1NC=NC=C1Cl P12334 [1,1,0,0,0,0|2,0,0]=4 194 B8R1.5 O=C1NC=NC=C1I P13009 [1,1,0,0,0,0|2,0,0]=4 195 B8R1.5 OC1=[13C](O)C=CC=C1 D98565 [1,1,0,0,0,0|0,0,1]=3 196 B8R1.5 S=C1C=CNC=C1Cl AT18152 [1,1,0,0,0,0|1,1,0]=4 197 B8R1.5 [2H]C1=C([2H])C=CC=C1 D97880 [1,1,0,0,0,0|1,0,0]=3 198 B8R1.5 [O-][N+]1=C([S-])C=CC=C1 S12409 [1,1,0,0,0,0|1,0,1]=4 199 B8R1.1 CC1=CN=C(C=O)O1 AT17128 [0,1,0,0,1,0|2,0,0]=4 200 B8R1.1 CC1=NNC(C=O)=C1 79805 [0,1,0,0,1,0|2,0,0]=4 201 B8R1.1 CC1=NSC(C=O)=C1 C16590 [0,1,0,0,1,0|2,0,0]=4 202 B8R1.1 O=CC1=CC(Cl)=CO1 50491 [0,1,0,0,1,0|1,0,0]=3 203 B8R1.1 O=CC1=CC(Cl)=CS1 P11080 [0,1,0,0,1,0|1,0,0]=3 204 B8R1.1 O=CC1=CN=C(O)S1 AT14773 [0,1,0,0,1,0|2,0,0]=4 205 B8R1.1 O=CC1=COC(Br)=C1 AT17110 [0,1,0,0,1,0|1,0,0]=3 206 B8R1.1 O=CC1=NC(Cl)=CS1 P12467 [0,1,0,0,1,0|2,0,0]=4 207 B8R1.1 O=CC1=NC=C(I)S1 S10281 [0,1,0,0,1,0|2,0,0]=4 208 B8R1.1 O=CC1=NNC(Br)=C1 F13791 [0,1,0,0,1,0|2,0,0]=4 209 B8R1.7 CC(=O)C1=CN=CO1 F19037 [0,1,0,0,1,0|2,0,0]=4 210 B8R1.7 CC(=O)C1=COC=N1 AT18593 [0,1,0,0,1,0|2,0,0]=4 211 B8R1.7 CC(=O)C1=CSN=C1 AT21129 [0,1,0,0,1,0|2,0,0]=4 212 B8R1.7 N=C(N)C1=CC=CN1 F18689 [0,1,0,0,1,0|2,0,0]=4 213 B8R1.7 NC(=O)C1=NOC=C1 AT19826 [0,1,0,0,1,0|2,0,0]=4 214 B8R1.7 NC(=S)C1=CC=CO1 F11945 [0,1,0,0,1,0|1,1,0]=4 215 B8R1.7 NC(=S)C1=COC=C1 AT17536 [0,1,0,0,1,0|1,1,0]=4 216 B8R1.7 O=C(Cl)C1=COC=N1 D78648 [0,1,0,0,1,0|2,0,0]=4 217 B8R1.7 O=C([O-])C1=NC=CO1 AT18513 [0,1,0,0,1,0|2,0,0]=4 218 B8R1.7 O=[S@](O)C1=CC=CS1 AT16558 [0,1,0,0,1,0|2,0,0]=4 219 B8R1.8 O=CCC1=CC=CS1 O10539 [0,1,0,0,1,0|1,0,0]=3 220 B8R1.8 O=CCC1=NC=CS1 D88143 [0,1,0,0,1,0|2,0,0]=4 221 B8R1.11 CC1=C(C=O)C=CS1 AT16762 [0,1,0,0,1,0|1,0,0]=3 222 B8R1.11 CC1=C(C=O)N=CO1 AT18594 [0,1,0,0,1,0|2,0,0]=4 223 B8R1.11 NC1=C(C=O)SC=C1 O10948 [0,1,0,0,1,0|1,0,0]=3 224 B8R1.11 O=CC1=C(Br)SC=N1 AT14701 [0,1,0,0,1,0|2,0,0]=4 225 B8R1.11 O=CC1=C(I)C=CS1 AT16727 [0,1,0,0,1,0|1,0,0]=3 226 B8R1.11 O=CC1=C(I)C=NN1 S11458 [0,1,0,0,1,0|2,0,0]=4 227 B8R1.11 O=CC1=CNC=C1Br AT16220 [0,1,0,0,1,0|1,0,0]=3 228 B8R1.11 O=CC1=CSC=C1Cl AT16877 [0,1,0,0,1,0|1,0,0]=3 229 B10R1.1 BrC#CC1=CC=C(Br)C=C1 94425 [0,2,0,0,0,0|1,0,1]=4 230 B10R1.1 CC1=CC=C(C#CBr)C=C1 94424 [0,2,0,0,0,0|1,0,1]=4 231 B10R1.1 CC1=CC=C(CNN)C=C1 O10110 [0,2,0,0,0,0|1,0,1]=4 232 B10R1.1 CC1=CC=C(\C=N\O)C=C1 AC8737 [0,2,0,0,0,0|0,0,1]=3 233 B10R1.1 CC1=NC=C(\C=C\Br)C=C1 F50214 [0,2,0,0,0,0|2,0,0]=4 234 B10R1.1 COCC1=CC=C(S)C=C1 AT20980 [0,2,0,0,0,0|0,0,2]=4 235 B10R1.1 CSCC1=CC=C(Cl)C=C1 W18700 [0,2,0,0,0,0|0,1,1]=4 236 B10R1.1 ClC1=CC=C(C#CBr)C=C1 94423 [0,2,0,0,0,0|1,0,1]=4 237 B10R1.1 NC1=CC=C(OCF)C=C1 68782 [0,2,0,0,0,0|1,0,1]=4 238 B10R1.1 NCCC1=CC=C(I)C=C1 C78427 [0,2,0,0,0,0|1,0,1]=4 239 B10R1.1 NNCC1=CC=C(Br)C=C1 AC3503 [0,2,0,0,0,0|1,0,1]=4 240 B10R1.1 NNCC1=CC=C(Cl)C=C1 37006 [0,2,0,0,0,0|1,0,1]=4 241 B10R1.1 N\N=C\C1=CC=C(O)C=C1 F15571 [0,2,0,0,0,0|1,0,0]=3 242 B10R1.1 O=CNC1=CC=C(F)C=C1 F21300 [0,2,0,0,0,0|0,0,0]=2 243 B10R1.1 [N-]=[N+]=NC1=CC=C(I)C=C1 AC6317 [0,2,0,0,0,0|2,0,0]=4 244 B10R1.3 C#CC1=CC=C(CN)C=C1 A50671 [0,2,0,0,0,0|1,0,1]=4 245 B10R1.3 C=CC1=CC=C(C#N)C=C1 D76989 [0,2,0,0,0,0|1,0,0]=3 246 B10R1.3 C=CC1=CN=C(OC)C=C1 P11583 [0,2,0,0,0,0|2,0,0]=4 247 B10R1.3 CCC1=CN=C(C=O)C=C1 C74094 [0,2,0,0,0,0|1,0,0]=3 248 B10R1.3 CNC1=CC=C(CN)C=C1 A10200 [0,2,0,0,0,0|1,0,1]=4 249 B10R1.3 CNC1=CC=C(SC)C=C1 AT20959 [0,2,0,0,0,0|2,0,0]=4 250 B10R1.3 CNC1=NC=C(C=O)C=N1 I11675 [0,2,0,0,0,0|2,0,0]=4 251 B10R1.3 CSC1=NC=C(C=O)C=C1 54709 [0,2,0,0,0,0|1,0,0]=3 252 B10R1.3 NCC1=CC=C(C=O)C=C1 N13169 [0,2,0,0,0,0|0,0,0]=2 253 B10R1.3 [C-]#[N+]C1=CC=C(OC)C=C1 AT23890 [0,2,0,0,0,0|2,0,0]=4 254 B10R1.13 CC(=O)C1=CN=C(C)N=C1 32219 [0,2,0,0,0,0|2,0,0]=4 255 B10R1.13 CC(=O)C1=NN=C(C)C=C1 P12332 [0,2,0,0,0,0|2,0,0]=4 256 B10R1.13 CC1=CC=C([S@@](=O)Cl)C=C1 C14066 [0,2,0,0,0,0|1,0,0]=3 257 B10R1.13 CC1=CN=C(C(=N)N)C=C1 W19131 [0,2,0,0,0,0|2,0,0]=4 258 B10R1.13 CC1=NC=C(C(=O)Cl)C=C1 C90488 [0,2,0,0,0,0|1,0,0]=3 259 B10R1.13 CC1=NC=C(C(N)=O)C=N1 81927 [0,2,0,0,0,0|2,0,0]=4 260 B10R1.13 CN(C)C1=CC=C(S)C=C1 T70960 [0,2,0,0,0,0|2,0,0]=4 261 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 F16941 [0,2,0,0,0,0|1,0,1]=4 262 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 N12656 [0,2,0,0,0,0|1,0,1]=4 263 B10R1.13 N=C(N)C1=NC=C(Br)C=C1 56664 [0,2,0,0,0,0|2,0,0]=4 264 B10R1.13 N=C(N)C1=NC=C(Cl)C=C1 AC8768 [0,2,0,0,0,0|2,0,0]=4 265 B10R1.13 NC(=O)C1=CN=C(Br)C=N1 N13142 [0,2,0,0,0,0|2,0,0]=4 266 B10R1.13 NC(=O)C1=CN=C(N)N=C1 81842 [0,2,0,0,0,0|2,0,0]=4 267 B10R1.13 NC(=O)C1=NN=C(Br)C=C1 D76262 [0,2,0,0,0,0|2,0,0]=4 268 B10R1.13 NC(=O)C1=NNC(=O)C=C1 AC6451 [0,2,0,0,0,0|2,0,0]=4 269 B10R1.13 NC1=CC=C(C(F)F)C=C1 84195 [0,2,0,0,0,0|1,0,1]=4 270 B10R1.13 O=C(Cl)C1=CN=C(Cl)N=C1 C14171 [0,2,0,0,0,0|2,0,0]=4 271 B10R1.13 O=C(O)C1=CN=C(S)N=C1 AT18396 [0,2,0,0,0,0|2,0,0]=4 272 B10R1.25 BrCC1=C(Br)C=C(Br)C=C1 C90776 [0,2,0,0,0,0|1,0,1]=4 273 B10R1.25 C=CC1=C(Br)C=C(Cl)C=N1 BL010236 [0,2,0,0,0,0|2,0,0]=4 274 B10R1.25 C=CC1=C(Cl)C=C(F)C=N1 BL010212 [0,2,0,0,0,0|2,0,0]=4 275 B10R1.25 C=CC1=C(F)C=C(Cl)C=C1 AC6667 [0,2,0,0,0,0|1,0,0]=3 276 B10R1.25 C=CC1=NC=C(Cl)C=C1F BL010235 [0,2,0,0,0,0|2,0,0]=4 277 B10R1.25 CC1=C(C#N)C=CC(S)=C1 AT20986 [0,2,0,0,0,0|1,0,1]=4 278 B10R1.25 CC1=C(CBr)C=CC(N)=C1 98280 [0,2,0,0,0,0|1,0,1]=4 279 B10R1.25 CC1=C(CO)C=CC(Cl)=C1 T70197 [0,2,0,0,0,0|0,0,2]=4 280 B10R1.25 CC1=C(CO)C=CC(F)=C1 CK2474 [0,2,0,0,0,0|0,0,2]=4 281 B10R1.25 CC1=C(CO)C=CC(O)=C1 N13176 [0,2,0,0,0,0|0,0,2]=4 282 B10R1.25 CC1=CC(Br)=C(C=O)C=N1 C14106 [0,2,0,0,0,0|1,0,0]=3 283 B10R1.25 CC1=CC(Br)=C(C=O)N=C1 53823 [0,2,0,0,0,0|1,0,0]=3 284 B10R1.25 CC1=CC(Cl)=CN=C1C=O 97693 [0,2,0,0,0,0|1,0,0]=3 285 B10R1.25 CC1=CC(F)=C(CN)C=C1 A12837 [0,2,0,0,0,0|1,0,1]=4 286 B10R1.25 CC1=CC(F)=C(CO)C=C1 98275 [0,2,0,0,0,0|0,0,2]=4 287 B10R1.25 CC1=CC(F)=C(NN)C=C1 A12578 [0,2,0,0,0,0|2,0,0]=4 288 B10R1.25 CC1=CC(N)=C(C=O)C=C1 F15845 [0,2,0,0,0,0|0,0,0]=2 289 B10R1.25 CC1=CC(N)=C(CO)C=C1 O10038 [0,2,0,0,0,0|0,0,2]=4 290 B10R1.25 CC1=CC(O)=C(CO)C=C1 N12596 [0,2,0,0,0,0|0,0,2]=4 291 B10R1.25 CC1=NC(C)=C(C=O)C=C1 F12423 [0,2,0,0,0,0|1,0,0]=3 292 B10R1.25 CC1=NC(C)=C(C=O)C=N1 D97637 [0,2,0,0,0,0|2,0,0]=4 293 B10R1.25 CCC1=C(N)C=C(F)C=C1 F20990 [0,2,0,0,0,0|1,0,1]=4 294 B10R1.25 CNC1=C(F)C=C(Br)C=C1 AT23114 [0,2,0,0,0,0|2,0,0]=4 295 B10R1.25 CNC1=C(F)C=C(Cl)C=C1 C11094 [0,2,0,0,0,0|2,0,0]=4 296 B10R1.25 COC1=C(I)C=C(I)C=C1 AT18541 [0,2,0,0,0,0|2,0,0]=4 297 B10R1.25 CSC1=C(Br)C=C(Br)C=C1 C13885 [0,2,0,0,0,0|2,0,0]=4 298 B10R1.25 CSC1=C(F)C=C(O)C=C1 94985 [0,2,0,0,0,0|2,0,0]=4 299 B10R1.25 FC1=CC(F)=C(CS)C=C1 AT13686 [0,2,0,0,0,0|0,1,1]=4 300 B10R1.25 N#CC1=C(Cl)C=C(S)C=C1 AT20867 [0,2,0,0,0,0|1,0,1]=4 301 B10R1.25 NC1=C(C=O)C=CC(Br)=N1 97231 [0,2,0,0,0,0|1,0,0]=3 302 B10R1.25 NC1=C(C=O)C=CC(Cl)=N1 66186 [0,2,0,0,0,0|1,0,0]=3 303 B10R1.25 NC1=C(CO)C=CC(F)=C1 AC5155 [0,2,0,0,0,0|0,0,2]=4 304 B10R1.25 NC1=CC(F)=C(CO)C=C1 AT26531 [0,2,0,0,0,0|0,0,2]=4 305 B10R1.25 NC1=CC(O)=C(CO)C=C1 D76340 [0,2,0,0,0,0|0,0,2]=4 306 B10R1.25 NC1=NC=C(C=O)C(=O)N1 D75895 [0,2,0,0,0,0|2,0,0]=4 307 B10R1.25 NCC1=C(Br)C=C(F)C=C1 Y11648 [0,2,0,0,0,0|1,0,1]=4 308 B10R1.25 NCC1=C(Cl)C=C(O)C=C1 F52064 [0,2,0,0,0,0|1,0,1]=4 309 B10R1.25 NCC1=C(F)C=C(N)C=C1 C90567 [0,2,0,0,0,0|1,0,1]=4 310 B10R1.25 NCC1=C(F)C=C(O)C=C1 N14307 [0,2,0,0,0,0|1,0,1]=4 311 B10R1.25 NCC1=C(N)C=C(Cl)C=C1 AC6575 [0,2,0,0,0,0|1,0,1]=4 312 B10R1.25 NCC1=C(O)C=C(Br)C=C1 AT19138 [0,2,0,0,0,0|1,0,1]=4 313 B10R1.25 NCC1=C(O)C=C(O)C=C1 I11211 [0,2,0,0,0,0|1,0,1]=4 314 B10R1.25 NNC1=C(Br)C=C(F)C=C1 69916 [0,2,0,0,0,0|2,0,0]=4 315 B10R1.25 NNC1=C(Cl)C=C(F)C=C1 C10398 [0,2,0,0,0,0|2,0,0]=4 316 B10R1.25 O=CC1=C(Cl)C=C(F)C=N1 BL010213 [0,2,0,0,0,0|1,0,0]=3 317 B10R1.25 O=CC1=C(I)C=C(Cl)C=C1 C90858 [0,2,0,0,0,0|0,0,0]=2 318 B10R1.25 O=CC1=CC=C(F)N=C1Br AT22753 [0,2,0,0,0,0|1,0,0]=3 319 B10R1.25 OCC1=C(I)C=C(Cl)C=C1 C90809 [0,2,0,0,0,0|0,0,2]=4 320 B10R1.25 OCC1=C(O)C=C(F)C=C1 A51208 [0,2,0,0,0,0|0,0,2]=4 321 B10R1.176 BrCC1=CC(Br)=C(I)C=C1 AT26690 [0,2,0,0,0,0|1,0,1]=4 322 B10R1.176 BrCC1=CC(I)=C(Br)C=C1 97476 [0,2,0,0,0,0|1,0,1]=4 323 B10R1.176 C#CC1=CC(C)=C(Br)C=C1 C91264 [0,2,0,0,0,0|1,0,1]=4 324 B10R1.176 CC1=C(Br)C=C(C=O)C=N1 C14264 [0,2,0,0,0,0|1,0,0]=3 325 B10R1.176 CC1=C(Br)C=CC(CCl)=C1 D87322 [0,2,0,0,0,0|1,0,1]=4 326 B10R1.176 CC1=C(I)C=C(CO)C=C1 D75885 [0,2,0,0,0,0|0,0,2]=4 327 B10R1.176 CC1=C(N)C=CC(CO)=C1 F15978 [0,2,0,0,0,0|0,0,2]=4 328 B10R1.176 CC1=C(O)C=CC(CN)=C1 N14330 [0,2,0,0,0,0|1,0,1]=4 329 B10R1.176 CCC1=CC(N)=C(C)C=C1 F21363 [0,2,0,0,0,0|1,0,1]=4 330 B10R1.176 CCC1=CC(O)=C(F)C=C1 F30470 [0,2,0,0,0,0|1,0,1]=4 331 B10R1.176 CCC1=CC(O)=C(O)C=C1 70407 [0,2,0,0,0,0|1,0,1]=4 332 B10R1.176 CNC1=CC(Cl)=C(Br)C=C1 AC3296 [0,2,0,0,0,0|2,0,0]=4 333 B10R1.176 CNC1=CC(Cl)=C(C)C=C1 C77674 [0,2,0,0,0,0|2,0,0]=4 334 B10R1.176 CNC1=CC(F)=C(Br)C=C1 S10823 [0,2,0,0,0,0|2,0,0]=4 335 B10R1.176 COC1=CC(N)=C(I)C=C1 O10806 [0,2,0,0,0,0|2,0,0]=4 336 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19646 [0,2,0,0,0,0|2,0,0]=4 337 B10R1.176 COC1=CC(N)=C(S)C=C1 AT19647 [0,2,0,0,0,0|2,0,0]=4 338 B10R1.176 COC1=CC(S)=C(N)C=C1 C90511 [0,2,0,0,0,0|2,0,0]=4 339 B10R1.176 CSC1=CC(C)=C(Br)C=C1 AT14181 [0,2,0,0,0,0|2,0,0]=4 340 B10R1.176 CSC1=CC(C)=C(O)C=C1 AT20904 [0,2,0,0,0,0|2,0,0]=4 341 B10R1.176 CSC1=CC(N)=C(C)C=C1 AT20856 [0,2,0,0,0,0|2,0,0]=4 342 B10R1.176 FC1=C(Br)C=C(CCl)C=C1 W16546 [0,2,0,0,0,0|1,0,1]=4 343 B10R1.176 FC1=C(Br)C=CC(CCl)=C1 96328 [0,2,0,0,0,0|1,0,1]=4 344 B10R1.176 FC1=C(Cl)C=CC(CCl)=C1 CK1006 [0,2,0,0,0,0|1,0,1]=4 345 B10R1.176 NCC1=CC(O)=C(N)C=C1 F13360 [0,2,0,0,0,0|1,0,1]=4 346 B10R1.176 NNC1=CC(Br)=C(F)C=C1 54717 [0,2,0,0,0,0|2,0,0]=4 347 B10R1.176 O=CC1=CC(Br)=C(I)C=C1 AT26050 [0,2,0,0,0,0|0,0,0]=2 348 B10R1.176 O=CC1=CC(I)=C(Br)C=C1 AT23715 [0,2,0,0,0,0|0,0,0]=2 349 B10R1.176 OCC1=CC(I)=C(Br)C=C1 97475 [0,2,0,0,0,0|0,0,2]=4 350 B10R1.2 C=CC1=CC=CC(Br)=C1F H11842 [0,2,0,0,0,0|1,0,0]=3 351 B10R1.2 CC1=C(F)C=CC=C1CN N12172 [0,2,0,0,0,0|1,0,1]=4 352 B10R1.2 CC1=C(O)C=CC=C1CO 56654 [0,2,0,0,0,0|0,0,2]=4 353 B10R1.2 CC1=CC=CC(C#N)=C1S AT20894 [0,2,0,0,0,0|1,0,1]=4 354 B10R1.2 CC1=CC=CC(CN)=C1O N10504 [0,2,0,0,0,0|1,0,1]=4 355 B10R1.2 CCC1=C(Br)C(C)=CC=C1 D85933 [0,2,0,0,0,0|1,0,1]=4 356 B10R1.2 CCC1=CC=CC(Cl)=C1N W13802 [0,2,0,0,0,0|1,0,1]=4 357 B10R1.2 CN1C=CC=C(C=O)C1=O 55279 [0,2,0,0,0,0|1,0,0]=3 358 B10R1.2 CNC1=CC=CC(F)=C1N AC7422 [0,2,0,0,0,0|2,0,0]=4 359 B10R1.2 COC1=C(N)C(N)=CC=C1 F52601 [0,2,0,0,0,0|2,0,0]=4 360 B10R1.2 COC1=C(O)C(N)=CC=C1 O10655 [0,2,0,0,0,0|2,0,0]=4 361 B10R1.2 COC1=CC=CC(Cl)=C1N CL9246 [0,2,0,0,0,0|2,0,0]=4 362 B10R1.2 COC1=CC=CC(S)=C1N AT19649 [0,2,0,0,0,0|2,0,0]=4 363 B10R1.2 CSC1=C(C)C(N)=CC=C1 AT20858 [0,2,0,0,0,0|2,0,0]=4 364 B10R1.2 CSC1=CC=CC(Br)=C1C AC7030 [0,2,0,0,0,0|2,0,0]=4 365 B10R1.2 N#CC1=CC=CC(N)=C1O AT22558 [0,2,0,0,0,0|1,0,1]=4 366 B10R1.2 N#CC1=CC=CC(O)=C1N C74010 [0,2,0,0,0,0|1,0,1]=4 367 B10R1.2 NC1=C(C=O)C=CN=C1Cl AT14240 [0,2,0,0,0,0|1,0,0]=3 368 B10R1.2 NCC1=CC=CC(F)=C1O N12979 [0,2,0,0,0,0|1,0,1]=4 369 B10R1.2 NCC1=CC=CC(I)=C1Cl C72087 [0,2,0,0,0,0|1,0,1]=4 370 B10R1.2 NNC1=CC=CC(Br)=C1F 53855 [0,2,0,0,0,0|2,0,0]=4 371 B10R1.2 O=CC1=CC=CC(Cl)=C1I 93250 [0,2,0,0,0,0|0,0,0]=2 372 B10R1.2 O=CC1=CN=CC(F)=C1Cl 66141 [0,2,0,0,0,0|1,0,0]=3 373 B10R1.2 O=CC1=NC=CC(Br)=C1Cl F53264 [0,2,0,0,0,0|1,0,0]=3 374 B10R1.2 O=CC1=NC=CC(Cl)=C1F C14479 [0,2,0,0,0,0|1,0,0]=3 375 B10R1.2 OCC1=CC=CC(Cl)=C1F A12360 [0,2,0,0,0,0|0,0,2]=4 376 B10R1.8 C=CC1=CC(Br)=CC(F)=C1 W12634 [0,2,0,0,0,0|1,0,0]=3 377 B10R1.8 C=CC1=CC(F)=CC(F)=C1 AC9541 [0,2,0,0,0,0|1,0,0]=3 378 B10R1.8 CC1=CC(C)=NC(C=O)=N1 P20555 [0,2,0,0,0,0|2,0,0]=4 379 B10R1.8 CC1=CC(Cl)=CC(C=O)=N1 C77358 [0,2,0,0,0,0|1,0,0]=3 380 B10R1.8 CCC1=CC(C)=CC(Br)=C1 C90915 [0,2,0,0,0,0|1,0,1]=4 381 B10R1.8 CNC1=CC(I)=CC(Br)=C1 F14267 [0,2,0,0,0,0|2,0,0]=4 382 B10R1.8 COC1=CC(I)=CC(F)=C1 AT12533 [0,2,0,0,0,0|2,0,0]=4 383 B10R1.8 FCC1=CC(Br)=CC(F)=C1 94378 [0,2,0,0,0,0|1,0,1]=4 384 B10R1.8 FCC1=CC(I)=CC(F)=C1 94383 [0,2,0,0,0,0|1,0,1]=4 385 B10R1.8 NNC1=CC(Cl)=CC(F)=C1 D88071 [0,2,0,0,0,0|2,0,0]=4 386 B10R1.8 O=CC1=CC(F)=CC(Br)=N1 N10043 [0,2,0,0,0,0|1,0,0]=3 387 B10R1.8 OCC1=CC(I)=CC(F)=C1 94382 [0,2,0,0,0,0|0,0,2]=4 388 B10R1.8 OCC1=CC(S)=CC(S)=C1 F19554 [0,2,0,0,0,0|0,0,2]=4 389 B10R1.10 CC1=CC=CC(CC=O)=C1 74805 [0,2,0,0,0,0|0,0,0]=2 390 B10R1.10 CCCC1=CC=CC(F)=C1 36946 [0,2,0,0,0,0|1,0,1]=4 391 B10R1.10 CCNC1=CC=CC(Cl)=C1 L10102 [0,2,0,0,0,0|1,0,1]=4 392 B10R1.10 CCNC1=CC=CC(O)=C1 F16135 [0,2,0,0,0,0|1,0,1]=4 393 B10R1.10 CCOC1=CC=CC(S)=C1 T73015 [0,2,0,0,0,0|1,0,1]=4 394 B10R1.10 CCSC1=CC(N)=CC=C1 AT20857 [0,2,0,0,0,0|1,0,1]=4 395 B10R1.10 COCC1=CC(N)=CC=C1 30379 [0,2,0,0,0,0|0,0,2]=4 396 B10R1.10 CSCC1=CC(N)=CC=C1 AT15211 [0,2,0,0,0,0|0,1,1]=4 397 B10R1.10 ClC1=CC=CC(C#CBr)=C1 55375 [0,2,0,0,0,0|1,0,1]=4 398 B10R1.10 NCCC1=CC=CC(I)=C1 C78608 [0,2,0,0,0,0|1,0,1]=4 399 B10R1.10 NNCC1=CC=CC(Cl)=C1 P15270 [0,2,0,0,0,0|1,0,1]=4 400 B10R1.10 NNCC1=CC=CC(O)=C1 D87672 [0,2,0,0,0,0|1,0,1]=4 401 B10R1.10 N\N=C\C1=CC=CC(O)=C1 F15561 [0,2,0,0,0,0|1,0,0]=3 402 B10R1.10 O=CCC1=CC=CC(Cl)=C1 W16823 [0,2,0,0,0,0|0,0,0]=2 403 B10R1.30 BrCC1=C(Br)C=CC(Br)=C1 68639 [0,2,0,0,0,0|1,0,1]=4 404 B10R1.30 BrCC1=C(Br)C=CC(I)=C1 CL9154 [0,2,0,0,0,0|1,0,1]=4 405 B10R1.30 BrCC1=C(I)C=CC(Br)=C1 CL9155 [0,2,0,0,0,0|1,0,1]=4 406 B10R1.30 C#CC1=C(Br)C=CC(Cl)=C1 AT26743 [0,2,0,0,0,0|1,0,1]=4 407 B10R1.30 C#CC1=C(Cl)C=CC(N)=C1 C76584 [0,2,0,0,0,0|1,0,1]=4 408 B10R1.30 C#CC1=C(N)C=CC(F)=C1 AC7120 [0,2,0,0,0,0|1,0,1]=4 409 B10R1.30 C=CC1=C(Cl)C=CC(Cl)=C1 CK2537 [0,2,0,0,0,0|1,0,0]=3 410 B10R1.30 C=CC1=C(F)C=CC(F)=C1 CK2551 [0,2,0,0,0,0|1,0,0]=3 411 B10R1.30 CC1=C(CBr)C=C(Cl)C=C1 73456 [0,2,0,0,0,0|1,0,1]=4 412 B10R1.30 CC1=C(CO)C=C(O)C=C1 AC3540 [0,2,0,0,0,0|0,0,2]=4 413 B10R1.30 CC1=CC(C#N)=C(S)C=C1 AT20893 [0,2,0,0,0,0|1,0,1]=4 414 B10R1.30 CC1=CC(C=O)=C(Br)C=N1 D72245 [0,2,0,0,0,0|1,0,0]=3 415 B10R1.30 CC1=CC(C=O)=C(C)N=N1 AT17926 [0,2,0,0,0,0|2,0,0]=4 416 B10R1.30 CC1=CC(CBr)=C(F)C=C1 98276 [0,2,0,0,0,0|1,0,1]=4 417 B10R1.30 CC1=CC(CO)=C(I)C=C1 H11526 [0,2,0,0,0,0|0,0,2]=4 418 B10R1.30 CC1=CN=C(F)C=C1C=O AT26672 [0,2,0,0,0,0|1,0,0]=3 419 B10R1.30 CC1=NC=C(F)C=C1C=O C16838 [0,2,0,0,0,0|1,0,0]=3 420 B10R1.30 CCC1=C(C)C=CC(C)=C1 T71937 [0,2,0,0,0,0|1,0,1]=4 421 B10R1.30 CNC1=C(F)C=CC(Br)=C1 AC3023 [0,2,0,0,0,0|2,0,0]=4 422 B10R1.30 CNC1=C(N)C=CC(Cl)=C1 C76710 [0,2,0,0,0,0|2,0,0]=4 423 B10R1.30 CNC1=C(O)C=CC(C)=C1 C16345 [0,2,0,0,0,0|2,0,0]=4 424 B10R1.30 COC1=C(C)C=CC(O)=C1 AT19376 [0,2,0,0,0,0|2,0,0]=4 425 B10R1.30 COC1=C(S)C=CC(N)=C1 D87749 [0,2,0,0,0,0|2,0,0]=4 426 B10R1.30 CSC1=C(Br)C=CC(Br)=C1 C13369 [0,2,0,0,0,0|2,0,0]=4 427 B10R1.30 CSC1=C(N)C=CC(C)=C1 AT20827 [0,2,0,0,0,0|2,0,0]=4 428 B10R1.30 N#CC1=C(S)C=CC(Cl)=C1 AT20896 [0,2,0,0,0,0|1,0,1]=4 429 B10R1.30 NC1=C(C=O)C=C(I)C=C1 F15851 [0,2,0,0,0,0|0,0,0]=2 430 B10R1.30 NC1=C(C=O)N=C(Cl)C=C1 O10939 [0,2,0,0,0,0|1,0,0]=3 431 B10R1.30 NC1=NC=C(Br)C=C1C=O N10755 [0,2,0,0,0,0|1,0,0]=3 432 B10R1.30 NCC1=C(Br)C=CC(F)=C1 AC7757 [0,2,0,0,0,0|1,0,1]=4 433 B10R1.30 NCC1=C(Br)C=CC(O)=C1 D88088 [0,2,0,0,0,0|1,0,1]=4 434 B10R1.30 NCC1=C(F)C=CC(N)=C1 AC9197 [0,2,0,0,0,0|1,0,1]=4 435 B10R1.30 NCC1=C(I)C=CC(Br)=C1 67324 [0,2,0,0,0,0|1,0,1]=4 436 B10R1.30 NCC1=C(N)C=CC(Br)=C1 O10495 [0,2,0,0,0,0|1,0,1]=4 437 B10R1.30 NCC1=C(N)C=CC(F)=C1 CK2412 [0,2,0,0,0,0|1,0,1]=4 438 B10R1.30 NCC1=C(O)C=CC(Br)=C1 76231 [0,2,0,0,0,0|1,0,1]=4 439 B10R1.30 NNC1=C(Cl)C=CC(Br)=C1 E72103 [0,2,0,0,0,0|2,0,0]=4 440 B10R1.30 NNC1=C(F)C=CC(Cl)=C1 A51221 [0,2,0,0,0,0|2,0,0]=4 441 B10R1.30 O=CC1=CC(Br)=CN=C1Br FD10640 [0,2,0,0,0,0|1,0,0]=3 442 B10R1.30 O=CC1=CC(Br)=NC=C1Br 80248 [0,2,0,0,0,0|1,0,0]=3 443 B10R1.30 O=CC1=CC(Br)=NC=C1Cl 88069 [0,2,0,0,0,0|1,0,0]=3 444 B10R1.30 O=CC1=CC(Br)=NC=C1O D70761 [0,2,0,0,0,0|1,0,0]=3 445 B10R1.30 O=CC1=CC(Cl)=CNC1=O AT24459 [0,2,0,0,0,0|1,0,0]=3 446 B10R1.30 O=CC1=CC(F)=CN=C1F AT10064 [0,2,0,0,0,0|1,0,0]=3 447 B10R1.113 C=C(C)C1=CC=CC(Br)=C1 AC1303 [0,2,0,0,0,0|1,0,0]=3 448 B10R1.113 CC(=O)C1=CC(=O)NC=C1 90624 [0,2,0,0,0,0|1,0,0]=3 449 B10R1.113 CC(=O)C1=CC(Cl)=NC=N1 91059 [0,2,0,0,0,0|2,0,0]=4 450 B10R1.113 CC(=O)C1=CN=NC(C)=C1 E71800 [0,2,0,0,0,0|2,0,0]=4 451 B10R1.113 CC(=O)C1=NC(N)=CC=C1 N14723 [0,2,0,0,0,0|1,0,0]=3 452 B10R1.113 CC1=CC=CC(C(=N)N)=N1 74734 [0,2,0,0,0,0|2,0,0]=4 453 B10R1.113 CC1=CC=CC(C(C)C)=C1 T71023 [0,2,0,0,0,0|1,0,1]=4 454 B10R1.113 C[C@H](Br)C1=CC(Cl)=CC=C1 55213 [0,2,0,0,0,0|1,0,1]=4 455 B10R1.113 C[C@H](Br)C1=CC=CC(Br)=C1 55217 [0,2,0,0,0,0|1,0,1]=4 456 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 70883 [0,2,0,0,0,0|1,0,1]=4 457 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 Y11581 [0,2,0,0,0,0|1,0,1]=4 458 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 F16880 [0,2,0,0,0,0|1,0,1]=4 459 B10R1.113 C[C@H](O)C1=CC=CC(F)=C1 SC1245 [0,2,0,0,0,0|0,0,2]=4 460 B10R1.113 C[C@H](O)C1=CC=CC(O)=C1 59959 [0,2,0,0,0,0|0,0,2]=4 461 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50248 [0,2,0,0,0,0|1,0,0]=3 462 B10R1.113 C[S@](=O)C1=CC=CC(Br)=C1 F50315 [0,2,0,0,0,0|1,0,0]=3 463 B10R1.113 FC(F)C1=CC=CC(S)=C1 97706 [0,2,0,0,0,0|1,0,1]=4 464 B10R1.113 N=C(N)C1=CC(Cl)=NC=C1 87823 [0,2,0,0,0,0|2,0,0]=4 465 B10R1.113 N=C(N)C1=CC=CC(Br)=N1 O11565 [0,2,0,0,0,0|2,0,0]=4 466 B10R1.113 N=C(N)C1=NC=CC(Cl)=C1 67989 [0,2,0,0,0,0|2,0,0]=4 467 B10R1.113 NC(=O)C1=CN=CC(Br)=N1 W17936 [0,2,0,0,0,0|2,0,0]=4 468 B10R1.113 NC(=S)C1=CC=CC(I)=C1 A10482 [0,2,0,0,0,0|0,1,0]=3 469 B10R1.113 NC1=CC=NC(C(=O)O)=N1 AT18255 [0,2,0,0,0,0|2,0,0]=4 470 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=N1 C14874 [0,2,0,0,0,0|2,0,0]=4 471 B10R1.113 O=C(Cl)C1=NC=CC(Cl)=C1 D84548 [0,2,0,0,0,0|1,0,0]=3 472 B10R1.113 O=C(O)C1=NC=CC(O)=C1 AC3399 [0,2,0,0,0,0|1,0,0]=3 473 B10R1.113 O=C([O-])C1=CC=CC(Cl)=C1 I11436 [0,2,0,0,0,0|0,0,0]=2 474 B10R1.113 O=[N+]([O-])C1=CC=CC(S)=C1 AT20860 [0,2,0,0,0,0|1,0,0]=3 475 B10R1.113 O=[N+]([O-])C1=NC(O)=CC=C1 D83533 [0,2,0,0,0,0|2,0,0]=4 476 B10R1.113 OB(O)C1=CC=CC(S)=C1 C10361 [0,2,0,0,0,0|1,0,1]=4 477 B10R1.172 C=CC1=CC=CC(C#N)=N1 87879 [0,2,0,0,0,0|2,0,0]=4 478 B10R1.172 C=CC1=CC=CC(OC)=N1 52911 [0,2,0,0,0,0|2,0,0]=4 479 B10R1.172 C=CC1=NC=CC(C#N)=C1 52909 [0,2,0,0,0,0|2,0,0]=4 480 B10R1.172 CCC1=CC=CC(CO)=C1 D85939 [0,2,0,0,0,0|0,0,2]=4 481 B10R1.172 CNC1=CC=CC(CO)=C1 AT21037 [0,2,0,0,0,0|0,0,2]=4 482 B10R1.172 CNC1=CC=CC(SC)=C1 AT20859 [0,2,0,0,0,0|2,0,0]=4 483 B10R1.172 COC1=CC=NC(C=O)=N1 AT18294 [0,2,0,0,0,0|2,0,0]=4 484 B10R1.172 CSC1=CC(CN)=CC=C1 N14326 [0,2,0,0,0,0|1,0,1]=4 485 B10R1.172 NCC1=CC=CC(CO)=C1 C75075 [0,2,0,0,0,0|0,0,2]=4 486 B10R1.172 O=CC1=CC(C=O)=NC=C1 CS1671 [0,2,0,0,0,0|1,0,0]=3 487 B10R1.172 O=CC1=NC=CC(CO)=C1 60952 [0,2,0,0,0,0|1,0,0]=3 488 B10R1.15 C=C(CO)C1=CC=CC=C1 A11577 [0,2,0,0,0,0|0,0,1]=3 489 B10R1.15 CCC(=O)C1=CC=NC=C1 N12310 [0,2,0,0,0,0|1,0,0]=3 490 B10R1.15 CCC(=O)C1=NC=CC=N1 D72036 [0,2,0,0,0,0|2,0,0]=4 491 B10R1.15 CC[C@H](N)C1=CC=CC=C1 N12648 [0,2,0,0,0,0|1,0,1]=4 492 B10R1.15 CN[C@@H](C)C1=CC=CC=C1 L10186 [0,2,0,0,0,0|1,0,1]=4 493 B10R1.15 COC(=N)C1=CC=CC=C1 W12775 [0,2,0,0,0,0|0,0,1]=3 494 B10R1.15 COC(=N)C1=CC=NC=C1 D87808 [0,2,0,0,0,0|1,0,1]=4 495 B10R1.15 COC(=O)N1C=CC=CC1 F21432 [0,2,0,0,0,0|1,0,1]=4 496 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1146 [0,2,0,0,0,0|0,0,0]=2 497 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 AC1167 [0,2,0,0,0,0|0,0,0]=2 498 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10550 [0,2,0,0,0,0|0,0,2]=4 499 B10R1.15 C[C@H](NO)C1=CC=CC=C1 P10551 [0,2,0,0,0,0|0,0,2]=4 500 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14528 [0,2,0,0,0,0|0,0,2]=4 501 B10R1.15 C[C@H](ON)C1=CC=CC=C1 AT14530 [0,2,0,0,0,0|0,0,2]=4 502 B10R1.15 NCC(=O)C1=CN=CC=C1 D87739 [0,2,0,0,0,0|1,0,0]=3 503 B10R1.15 NCC(=O)C1=CN=CC=C1 F13353 [0,2,0,0,0,0|1,0,0]=3 504 B10R1.15 N\C(=N/O)C1=CC=CC=C1 L10027 [0,2,0,0,0,0|0,0,1]=3 505 B10R1.15 O=C(CBr)C1=NC=CC=N1 F19759 [0,2,0,0,0,0|2,0,0]=4 506 B10R1.15 O=C(CBr)C1=NC=NC=C1 FD10496 [0,2,0,0,0,0|2,0,0]=4 507 B10R1.15 O=C(CO)C1=CC=NC=C1 AC5781 [0,2,0,0,0,0|1,0,0]=3 508 B10R1.15 O=C(CO)C1=CN=CC=C1 AC2803 [0,2,0,0,0,0|1,0,0]=3 509 B10R1.28 FC(F)(Cl)C1=CC=CC=C1 36909 [0,2,0,0,0,0|1,0,1]=4 510 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 I11569 [0,2,0,0,0,0|1,0,0]=3 511 B10R1.28 [2H]C(C)(C)C1=CC=CC=C1 D98007 [0,2,0,0,0,0|1,0,1]=4 512 B10R1.28 [2H]C([2H])(Br)C1=CC=CC=C1 D99472 [0,2,0,0,0,0|1,0,1]=4 513 B10R1.28 [2H]C([2H])(C)C1=CC=CC=C1 D99069 [0,2,0,0,0,0|1,0,1]=4 514 B10R1.28 [2H]C([2H])(O)C1=CC=CC=C1 AT24168 [0,2,0,0,0,0|0,0,2]=4 515 B10R1.28 [2H][C@@](C)(O)C1=CC=CC=C1 D98825 [0,2,0,0,0,0|0,0,2]=4 516 B10R1.61 C=C(C)C1=C(I)C=CC=C1 E72643 [0,2,0,0,0,0|1,0,0]=3 517 B10R1.61 CC(=O)C1=C(C)C=CN=C1 69949 [0,2,0,0,0,0|1,0,0]=3 518 B10R1.61 CC(=O)C1=C(C)C=NC=C1 28203 [0,2,0,0,0,0|1,0,0]=3 519 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 86430 [0,2,0,0,0,0|1,0,0]=3 520 B10R1.61 CC(=O)C1=C(N)C=NC=C1 W18377 [0,2,0,0,0,0|1,0,0]=3 521 B10R1.61 CC(=O)C1=C(S)C=CC=C1 93483 [0,2,0,0,0,0|0,0,0]=2 522 B10R1.61 CC(=O)C1=CC=CNC1=O C10188 [0,2,0,0,0,0|1,0,0]=3 523 B10R1.61 CC(=O)C1=NC=CN=C1N P10974 [0,2,0,0,0,0|2,0,0]=4 524 B10R1.61 CC(=O)C1=NC=NC=C1C O10307 [0,2,0,0,0,0|2,0,0]=4 525 B10R1.61 CC1=C(C(C)C)C=CC=C1 T71005 [0,2,0,0,0,0|1,0,1]=4 526 B10R1.61 CC1=C(P(Cl)Cl)C=CC=C1 AC9855 [0,2,0,0,0,0|2,0,0]=4 527 B10R1.61 CC1=[13C](C(=O)O)C=CC=C1 D98685 [0,2,0,0,0,0|0,0,0]=2 528 B10R1.61 C[C@H](Br)C1=C(Cl)C=CC=C1 C77623 [0,2,0,0,0,0|1,0,1]=4 529 B10R1.61 C[C@H](Cl)C1=C(Cl)C=CC=C1 A11172 [0,2,0,0,0,0|1,0,1]=4 530 B10R1.61 N=C(N)C1=C(Br)C=CC=N1 W18185 [0,2,0,0,0,0|2,0,0]=4 531 B10R1.61 N=C(N)C1=C(F)C=CC=C1 W10322 [0,2,0,0,0,0|1,0,0]=3 532 B10R1.61 N=C(N)C1=C(F)C=CC=N1 F51910 [0,2,0,0,0,0|2,0,0]=4 533 B10R1.61 N=C(N)C1=[N+]([O-])C=CC=C1 O10709 [0,2,0,0,0,0|2,0,0]=4 534 B10R1.61 NC(=O)C1=C(F)C=NC=C1 55531 [0,2,0,0,0,0|1,0,0]=3 535 B10R1.61 NC(=O)C1=C(O)N=CC=C1 D74336 [0,2,0,0,0,0|1,0,0]=3 536 B10R1.61 NC(=S)C1=CC=CN=C1Cl 31340 [0,2,0,0,0,0|1,1,0]=4 537 B10R1.61 NC(=S)C1=NC=CC=C1N F13535 [0,2,0,0,0,0|1,1,0]=4 538 B10R1.61 O=C(O)C1=C(Br)C=CN=C1 78917 [0,2,0,0,0,0|1,0,0]=3 539 B10R1.61 O=C(O)C1=CN=CN=C1Cl F10440 [0,2,0,0,0,0|2,0,0]=4 540 B10R1.61 O=C([O-])C1=C(Cl)C=CC=C1 I11424 [0,2,0,0,0,0|0,0,0]=2 541 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 FD10574 [0,2,0,0,0,0|0,0,0]=2 542 B10R1.61 O=[N+]([O-])C1=CC=CN=C1I AB10380 [0,2,0,0,0,0|2,0,0]=4 543 B10R1.61 O=[N+]([O-])C1=CC=CN=C1S T72399 [0,2,0,0,0,0|2,0,0]=4 544 B10R1.4 CC1=C(CC=O)C=CC=C1 W16821 [0,2,0,0,0,0|0,0,0]=2 545 B10R1.4 CC1=C(CON)C=CC=C1 D77271 [0,2,0,0,0,0|0,0,2]=4 546 B10R1.4 CCCC1=C(C)C=CC=C1 T71577 [0,2,0,0,0,0|1,0,1]=4 547 B10R1.4 CCNC1=C(F)C=CC=C1 D87863 [0,2,0,0,0,0|1,0,1]=4 548 B10R1.4 CCSC1=C(Br)C=CC=C1 AT20838 [0,2,0,0,0,0|1,0,1]=4 549 B10R1.4 CCSC1=C(O)C=CC=C1 AT20889 [0,2,0,0,0,0|1,0,1]=4 550 B10R1.4 CNCC1=C(N)C=CC=C1 F13330 [0,2,0,0,0,0|1,0,1]=4 551 B10R1.4 NNCC1=C(Cl)C=CC=C1 W12211 [0,2,0,0,0,0|1,0,1]=4 552 B10R1.4 O=CCC1=C(Cl)C=CC=C1 W16822 [0,2,0,0,0,0|0,0,0]=2 553 B10R1.4 O=CCN1N=CC=CC1=O 57075 [0,2,0,0,0,0|2,0,0]=4 554 B10R1.17 FCCNC1=CC=CC=C1 D77931 [0,2,0,0,0,0|1,0,1]=4 555 B10R1.17 NC\C=C\C1=CC=CC=C1 A12523 [0,2,0,0,0,0|1,0,0]=3 556 B10R1.17 NNCCC1=CC=CC=C1 AC4670 [0,2,0,0,0,0|1,0,1]=4 557 B10R1.17 NOCCC1=CC=CC=C1 C10179 [0,2,0,0,0,0|0,0,2]=4 558 B10R1.17 O=CCCC1=NC=CC=C1 P20552 [0,2,0,0,0,0|1,0,0]=3 559 B10R1.17 O=CCOC1=CC=CC=C1 C15303 [0,2,0,0,0,0|0,0,0]=2 560 B10R1.17 O=CNCC1=NC=CC=C1 AC6369 [0,2,0,0,0,0|1,0,0]=3 561 B10R1.17 O=C\C=C\C1=CC=NC=C1 T72403 [0,2,0,0,0,0|1,0,0]=3 562 B10R1.17 OC\C=C\C1=CC=NC=C1 AC1120 [0,2,0,0,0,0|1,0,1]=4 563 B10R1.18 CC(=O)NC1=CN=CN=C1 F18145 [0,2,0,0,0,0|2,0,0]=4 564 B10R1.18 CC(=O)[15NH]C1=CC=CC=C1 F21470 [0,2,0,0,0,0|0,0,0]=2 565 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71821 [0,2,0,0,0,0|0,0,2]=4 566 B10R1.18 C[C@H](O)CC1=CC=CC=C1 T71861 [0,2,0,0,0,0|0,0,2]=4 567 B10R1.18 C[S@](=O)CC1=CN=CC=C1 E72354 [0,2,0,0,0,0|1,0,1]=4 568 B10R1.18 N=C(N)CC1=CC=CC=C1 C15976 [0,2,0,0,0,0|1,0,0]=3 569 B10R1.18 NC(=O)CC1=CN=CN=C1 FD7229 [0,2,0,0,0,0|2,0,0]=4 570 B10R1.18 OB(O)CC1=CC=CC=C1 32975 [0,2,0,0,0,0|0,0,2]=4 571 B10R1.18 [2H]C([2H])=CC1=CC=CC=C1 D99670 [0,2,0,0,0,0|1,0,0]=3 572 B10R1.20 C#CC1=C(C#N)C=CC=C1 F21305 [0,2,0,0,0,0|1,0,1]=4 573 B10R1.20 CNC1=C(CO)C=CC=C1 C74490 [0,2,0,0,0,0|0,0,2]=4 574 B10R1.20 CNC1=C(SC)C=CC=C1 AT20832 [0,2,0,0,0,0|2,0,0]=4 575 B10R1.20 COC1=C(NN)C=CC=C1 71208 [0,2,0,0,0,0|2,0,0]=4 576 B10R1.20 COC1=NC=CN=C1C=O P10873 [0,2,0,0,0,0|2,0,0]=4 577 B10R1.20 N#CC1=C(C=O)C=CC=N1 P10442 [0,2,0,0,0,0|1,0,0]=3 578 B10R1.20 N#CC1=C(C=O)C=NC=C1 P12254 [0,2,0,0,0,0|1,0,0]=3 579 B10R1.20 N#CC1=CC=CN=C1C=O P10836 [0,2,0,0,0,0|1,0,0]=3 580 B10R1.245 CC1=C(C=O)C(F)=NC=C1 AT13974 [0,2,0,0,0,0|1,0,0]=3 581 B10R1.245 CC1=CC=CC(Br)=C1CO D96259 [0,2,0,0,0,0|0,0,2]=4 582 B10R1.245 CC1=CC=CC(N)=C1C=O F15844 [0,2,0,0,0,0|0,0,0]=2 583 B10R1.245 CC1=CC=CC(N)=C1CO AC6550 [0,2,0,0,0,0|0,0,2]=4 584 B10R1.245 CC1=CN=CC(Br)=C1C=O 51803 [0,2,0,0,0,0|1,0,0]=3 585 B10R1.245 CC1=CN=CC(C)=C1C=O 51703 [0,2,0,0,0,0|1,0,0]=3 586 B10R1.245 COC1=C(I)C=CC=C1Cl C90767 [0,2,0,0,0,0|2,0,0]=4 587 B10R1.245 COC1=C(O)C=CC=C1N AT15764 [0,2,0,0,0,0|2,0,0]=4 588 B10R1.245 N#CC1=C(Cl)C=CC=C1S AT20865 [0,2,0,0,0,0|1,0,1]=4 589 B10R1.245 NC1=C(C=O)C(F)=NC=C1 O11152 [0,2,0,0,0,0|1,0,0]=3 590 B10R1.245 O=CC1=C(Cl)C=NC=C1F 90327 [0,2,0,0,0,0|1,0,0]=3 591 B10R1.245 O=CC1=C(F)C=CN=C1F 74527 [0,2,0,0,0,0|1,0,0]=3 592 B10R1.245 OCC1=C(Br)C=CC=C1Cl C91616 [0,2,0,0,0,0|0,0,2]=4 593 B10R1.245 OCC1=C(Br)C=CC=C1O 75753 [0,2,0,0,0,0|0,0,2]=4 594 B10R2.320 N[C@H]1CC2=C1C=CC=C2 AT20398 [0,1,0,1,0,0|1,0,1]=4 595 B10R2.7 C1=CC2=C(C=C1)SCO2 76474 [0,1,0,1,0,0|0,0,2]=4 596 B10R2.7 C1=CC2=C(C=C1)SCS2 D71935 [0,1,0,1,0,0|0,1,1]=4 597 B10R2.7 C1=CC2=C(C=CO2)C=N1 D74565 [0,1,0,1,0,0|1,0,1]=4 598 B10R2.7 C1=CC2=C(C=N1)NN=C2 W10136 [0,1,0,1,0,0|2,0,0]=4 599 B10R2.7 C1=CC2=CN=NN2C=C1 31900 [0,1,0,1,0,0|2,0,0]=4 600 B10R2.7 C1=CC2=NNC=C2N=C1 F18246 [0,1,0,1,0,0|2,0,0]=4 601 B6R1.2 NC1=CC=CS1 44128 [1,0,0,0,1,0|2,0,0]=4 602 B6R1.2 NC1=CC=CS1 F10359 [1,0,0,0,1,0|2,0,0]=4 603 B6R1.2 [2H]N1C=CC=C1 D98995 [1,0,0,0,1,0|2,0,0]=4