0 B9R1.6 CC(=O)C1=CN=CN=C1 A7446 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.6 CC(=O)C1=CN=NC=C1 A10222 [0,0,0,0,0,0|2,0,2]=4 2 B9R1.6 CC(=O)C1=NC=CC=N1 A8017 [0,0,0,0,0,0|2,0,2]=4 3 B9R1.6 CC(=O)C1=NC=CN=C1 A39262 [0,0,0,0,0,0|2,0,2]=4 4 B9R1.6 CC(=O)C1=NC=NC=C1 A12246 [0,0,0,0,0,0|2,0,2]=4 5 B9R1.6 CC(=O)C1=NN=CC=C1 P0157 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.6 CC(C)C1=NC=CC=C1 I0627 [0,0,0,0,0,0|2,0,0]=2 7 B9R1.6 CN(C)C1=CC=NC=C1 P68104 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.6 C[C@@H](N)C1=CC=CC=C1 P68072 [0,0,0,0,0,0|1,0,0]=1 9 B9R1.6 C[C@@H](N)C1=CC=CN=C1 P43620 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.6 C[C@@H](N)C1=CC=NC=C1 P43606 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 C[C@@H](N)C1=CC=NC=C1 P46584 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 C[C@@H](N)C1=CN=CN=C1 A12922 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.6 C[C@@H](N)C1=CN=CN=C1 P27095 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P43619 [0,0,0,0,0,0|2,0,0]=2 15 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P46583 [0,0,0,0,0,0|2,0,0]=2 16 B9R1.6 C[C@@H](O)C1=CC=CC=C1 P46824 [0,0,0,0,0,0|0,0,0]=0 17 B9R1.6 C[C@@H](O)C1=CC=NC=C1 P46383 [0,0,0,0,0,0|1,0,0]=1 18 B9R1.6 C[C@@H](O)C1=NC=CC=C1 P46382 [0,0,0,0,0,0|1,0,0]=1 19 B9R1.6 C[C@H](Br)C1=NC=CN=C1 B42963 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.6 C[C@H](N)C1=CC=CC=C1 P68597 [0,0,0,0,0,0|1,0,0]=1 21 B9R1.6 C[C@H](N)C1=CC=CC=C1 P69271 [0,0,0,0,0,0|1,0,0]=1 22 B9R1.6 C[C@H](N)C1=CC=CN=C1 P43604 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.6 C[C@H](N)C1=CC=CN=C1 P46585 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.6 C[C@H](N)C1=CC=CN=C1 P61653 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.6 C[C@H](N)C1=CC=NC=C1 P43607 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.6 C[C@H](N)C1=CC=NC=C1 P46582 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.6 C[C@H](N)C1=CN=CN=C1 A12921 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.6 C[C@H](N)C1=CN=CN=C1 A7447 [0,0,0,0,0,0|3,0,0]=3 29 B9R1.6 C[C@H](N)C1=CN=NC=C1 P30996 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.6 C[C@H](N)C1=NC=CC=C1 P43621 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.6 C[C@H](N)C1=NC=CC=C1 P66366 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.6 C[C@H](N)C1=NC=CC=N1 P36807 [0,0,0,0,0,0|3,0,0]=3 33 B9R1.6 C[C@H](N)C1=NC=CN=C1 P14583 [0,0,0,0,0,0|3,0,0]=3 34 B9R1.6 C[C@H](N)C1=NC=NC=C1 A12259 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 C[C@H](O)C1=CC=CC=C1 P46823 [0,0,0,0,0,0|0,0,0]=0 36 B9R1.6 C[C@H](O)C1=CC=NC=C1 P38118 [0,0,0,0,0,0|1,0,0]=1 37 B9R1.6 C[C@H](O)C1=NC=CC=C1 P46375 [0,0,0,0,0,0|1,0,0]=1 38 B9R1.6 C[C@H](O)C1=NC=CN=C1 P43187 [0,0,0,0,0,0|2,0,0]=2 39 B9R1.6 C[S@](=O)C1=CC=CC=C1 M61814 [0,0,0,0,0,0|1,0,1]=2 40 B9R1.6 C[S@](=O)C1=NC=CC=C1 M43172 [0,0,0,0,0,0|2,0,1]=3 41 B9R1.6 C[S@](=O)C1=NC=CC=N1 M41047 [0,0,0,0,0,0|3,0,1]=4 42 B9R1.6 N=C(N)C1=CC=CC=C1 B39428 [0,0,0,0,0,0|2,0,1]=3 43 B9R1.6 N=C(N)C1=CC=CN=C1 N43530 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.6 N=C(N)C1=CC=NC=C1 N43531 [0,0,0,0,0,0|3,0,1]=4 45 B9R1.6 N=C(N)C1=NC=CC=C1 A3829 [0,0,0,0,0,0|3,0,1]=4 46 B9R1.6 N=C(N)C1=NC=CC=C1 P43087 [0,0,0,0,0,0|3,0,1]=4 47 B9R1.6 NC(=O)C1=CC=CC=C1 B69845 [0,0,0,0,0,0|1,0,2]=3 48 B9R1.6 NC(=O)C1=NC=CC=C1 P60877 [0,0,0,0,0,0|2,0,2]=4 49 B9R1.6 O=C(Cl)C1=CC=NC=C1 N39246 [0,0,0,0,0,0|2,0,2]=4 50 B9R1.6 O=C(Cl)C1=NC=CC=C1 P42299 [0,0,0,0,0,0|2,0,2]=4 51 B9R1.6 O=C(O)C1=CN=CN=C1 P2410 [0,0,0,0,0,0|3,0,1]=4 52 B9R1.6 O=C(O)C1=CN=NC=C1 P3453 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.6 O=C(O)C1=NC=CC=C1 P62145 [0,0,0,0,0,0|2,0,1]=3 54 B9R1.6 O=C(O)C1=NC=CC=N1 P5589 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.6 O=C(O)C1=NC=CN=C1 P2716 [0,0,0,0,0,0|3,0,1]=4 56 B9R1.6 O=C(O)C1=NC=NC=C1 P4579 [0,0,0,0,0,0|3,0,1]=4 57 B9R1.6 O=C(O)C1=NN=CC=C1 P3149 [0,0,0,0,0,0|3,0,1]=4 58 B9R1.6 O=[S@]([O-])C1=CC=CC=C1 S68689 [0,0,0,0,0,0|2,0,1]=3 59 B9R1.6 OB(O)C1=CC=NC=C1 P5100 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.6 OB(O)C1=CN=CC=C1 P5080 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.6 OB(O)C1=CN=CN=C1 P5106 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.6 OB(O)C1=NC=CC=C1 P36680 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.6 OB(O)C1=NC=CN=C1 P36936 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.6 OB(O)C1=NC=NC=C1 P32118 [0,0,0,0,0,0|4,0,0]=4 65 B8R1.2 BrCC1=CC=NC=C1 B36897 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.2 BrCC1=CN=CC=C1 B23879 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.2 BrCC1=CN=CN=C1 B36879 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.2 BrCC1=NC=CC=C1 B42841 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.2 BrCC1=NC=CN=C1 B36766 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.2 BrCC1=NC=NC=C1 B32305 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.2 BrCC1=NN=CC=C1 B36818 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.2 C#CC1=CC=CN=C1 E12479 [1,0,0,0,0,0|1,0,2]=4 73 B8R1.2 C#CC1=CC=NC=C1 E10312 [1,0,0,0,0,0|1,0,2]=4 74 B8R1.2 C#CC1=CC=NC=C1 E23238 [1,0,0,0,0,0|1,0,2]=4 75 B8R1.2 C#CC1=NC=CC=C1 E12434 [1,0,0,0,0,0|1,0,2]=4 76 B8R1.2 CCC1=NC=CN=C1 E43180 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.2 CNC1=CC=CN=C1 M38086 [1,0,0,0,0,0|2,0,0]=3 78 B8R1.2 CNC1=CC=NC=C1 M68620 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.2 CNC1=CN=CN=C1 M29839 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.2 CNC1=CN=NC=C1 M38382 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.2 CNC1=NC=CN=C1 M41140 [1,0,0,0,0,0|3,0,0]=4 82 B8R1.2 COC1=CC=NC=C1 M9391 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.2 COC1=CN=CC=C1 M67978 [1,0,0,0,0,0|2,0,0]=3 84 B8R1.2 COC1=CN=NC=C1 M41023 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.2 COC1=NC=CC=C1 M39277 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.2 COC1=NC=CN=C1 M2768 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 COC1=NN=CC=C1 M41021 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.2 CSC1=NC=CC=N1 M2492 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.2 ClCC1=CC=NC=C1 C68845 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.2 ClCC1=CN=CN=C1 C10228 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.2 ClCC1=NC=CC=C1 C67870 [1,0,0,0,0,0|2,0,0]=3 92 B8R1.2 ClCC1=NC=CC=N1 C0153 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.2 ClCC1=NC=CC=N1 C40877 [1,0,0,0,0,0|3,0,0]=4 94 B8R1.2 ClCC1=NC=CN=C1 C0149 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.2 ClCC1=NC=NC=C1 C40878 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.2 ClCC1=NN=CC=C1 C0156 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.2 NCC1=CC=CN=C1 A69257 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.2 NCC1=CC=CN=N1 A0031 [1,0,0,0,0,0|3,0,0]=4 99 B8R1.2 NCC1=CC=CN=N1 P29569 [1,0,0,0,0,0|3,0,0]=4 100 B8R1.2 NCC1=CC=NC=C1 P67743 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.2 NCC1=CN=CN=C1 P0028 [1,0,0,0,0,0|3,0,0]=4 102 B8R1.2 NCC1=CN=CN=C1 P29548 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.2 NCC1=CN=NC=C1 A0027 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.2 NCC1=CN=NC=C1 P41350 [1,0,0,0,0,0|3,0,0]=4 105 B8R1.2 NCC1=NC=CC=N1 A7421 [1,0,0,0,0,0|3,0,0]=4 106 B8R1.2 NCC1=NC=CC=N1 P0030 [1,0,0,0,0,0|3,0,0]=4 107 B8R1.2 NCC1=NC=CN=C1 P0029 [1,0,0,0,0,0|3,0,0]=4 108 B8R1.2 NCC1=NC=CN=C1 P4303 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.2 NCC1=NC=NC=C1 A0032 [1,0,0,0,0,0|3,0,0]=4 110 B8R1.2 NCC1=NC=NC=C1 A10198 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.2 NCC1=NC=NC=C1 P23754 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.2 NNC1=CC=CC=C1 P68696 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.2 NNC1=CC=CN=C1 H0043 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.2 NNC1=CC=CN=C1 H41349 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.2 NNC1=CC=NC=C1 H0042 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.2 NNC1=NC=CC=C1 H38511 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.2 NOC1=CC=CC=C1 P43533 [1,0,0,0,0,0|2,0,0]=3 118 B8R1.2 O=CC1=CC=NC=C1 P42598 [1,0,0,0,0,0|1,0,2]=4 119 B8R1.2 O=CC1=CN=CC=C1 P13753 [1,0,0,0,0,0|1,0,2]=4 120 B8R1.2 O=CC1=NC=CC=C1 P67836 [1,0,0,0,0,0|1,0,2]=4 121 B8R1.2 OCC1=CC=NC=C1 P43429 [1,0,0,0,0,0|1,0,0]=2 122 B8R1.2 OCC1=CC=NC=C1 P67894 [1,0,0,0,0,0|1,0,0]=2 123 B8R1.2 OCC1=CN=CC=C1 P15946 [1,0,0,0,0,0|1,0,0]=2 124 B8R1.2 OCC1=CN=CN=C1 P0145 [1,0,0,0,0,0|2,0,0]=3 125 B8R1.2 OCC1=NC=CC=C1 P69303 [1,0,0,0,0,0|1,0,0]=2 126 B8R1.2 OCC1=NC=CC=N1 P0151 [1,0,0,0,0,0|2,0,0]=3 127 B8R1.2 OCC1=NC=CN=C1 P0147 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.2 OCC1=NC=NC=C1 P0160 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.2 OCC1=NN=CC=C1 P0155 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.2 ONC1=CC=CC=C1 P67873 [1,0,0,0,0,0|1,0,0]=2 131 B10R1.13 C=C(C)C1=CC=C(F)C=C1 F51670 [0,1,0,0,0,0|1,0,1]=3 132 B10R1.13 C=C(C)C1=CC=C(O)C=C1 P49877 [0,1,0,0,0,0|1,0,1]=3 133 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [0,1,0,0,0,0|0,0,2]=3 134 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C68865 [0,1,0,0,0,0|0,0,2]=3 135 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [0,1,0,0,0,0|0,0,2]=3 136 B10R1.13 CC(=O)C1=CC=C(I)C=C1 K39500 [0,1,0,0,0,0|0,0,2]=3 137 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A68181 [0,1,0,0,0,0|0,0,2]=3 138 B10R1.13 CC(=O)C1=CC=C(O)C=C1 H64899 [0,1,0,0,0,0|0,0,2]=3 139 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B3106 [0,1,0,0,0,0|1,0,2]=4 140 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [0,1,0,0,0,0|1,0,2]=4 141 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 A24257 [0,1,0,0,0,0|1,0,2]=4 142 B10R1.13 CC(=O)C1=CN=C(F)C=C1 F45498 [0,1,0,0,0,0|1,0,2]=4 143 B10R1.13 CC(=O)C1=CN=C(N)C=C1 A22139 [0,1,0,0,0,0|1,0,2]=4 144 B10R1.13 CC(=O)C1=CNC(=O)C=C1 A67563 [0,1,0,0,0,0|1,0,2]=4 145 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 B22347 [0,1,0,0,0,0|1,0,2]=4 146 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [0,1,0,0,0,0|1,0,2]=4 147 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 C26822 [0,1,0,0,0,0|1,0,2]=4 148 B10R1.13 CC(=O)C1=NC=C(O)C=C1 H45820 [0,1,0,0,0,0|1,0,2]=4 149 B10R1.13 CC(C)C1=CC=C(Br)C=C1 B49963 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.13 CC(C)C1=CC=C(N)C=C1 P69319 [0,1,0,0,0,0|1,0,0]=2 151 B10R1.13 CC(C)C1=CC=C(O)C=C1 P60863 [0,1,0,0,0,0|1,0,0]=2 152 B10R1.13 CC(C)C1=CC=C([Mg+])C=C1 P31759 [0,1,0,0,0,0|1,0,0]=2 153 B10R1.13 CC(C)C1=CN=C(Br)C=C1 B46728 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.13 CC(C)C1=CN=C(N)C=C1 P24474 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.13 CC(C)C1=NC=C(Br)C=C1 B32058 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.13 CC(C)C1=NC=C(Br)C=N1 B13199 [0,1,0,0,0,0|3,0,0]=4 157 B10R1.13 CC(C)C1=NC=C(N)C=C1 A12160 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.13 CC1=CC=C(B(O)O)C=C1 T5215 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M38078 [0,1,0,0,0,0|2,0,1]=4 160 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [0,1,0,0,0,0|1,0,1]=3 161 B10R1.13 CC1=CC=C(C(C)C)C=C1 D60786 [0,1,0,0,0,0|1,0,0]=2 162 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [0,1,0,0,0,0|1,0,2]=4 163 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T52161 [0,1,0,0,0,0|1,0,0]=2 164 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T60511 [0,1,0,0,0,0|1,0,0]=2 165 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 T50271 [0,1,0,0,0,0|0,0,0]=1 166 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 S38423 [0,1,0,0,0,0|2,0,1]=4 167 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [0,1,0,0,0,0|1,0,1]=3 168 B10R1.13 CC1=CC=C([S@](N)=O)C=C1 M36646 [0,1,0,0,0,0|2,0,1]=4 169 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M23707 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M46550 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.13 CC1=CN=C([C@H](C)N)C=C1 M49667 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.13 CC1=NC=C(B(O)O)C=C1 M24773 [0,1,0,0,0,0|3,0,0]=4 173 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 H64312 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 C46751 [0,1,0,0,0,0|2,0,0]=3 176 B10R1.13 CN(C)C1=CC=C(I)C=C1 K46770 [0,1,0,0,0,0|2,0,0]=3 177 B10R1.13 CN(C)C1=CC=C([Mg+])C=C1 D31762 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.13 CN(C)C1=CN=C(Br)C=C1 B46285 [0,1,0,0,0,0|3,0,0]=4 179 B10R1.13 CN(C)C1=CN=C(Cl)C=C1 C46302 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.13 CN(C)C1=NC=C(Br)C=C1 B3355 [0,1,0,0,0,0|3,0,0]=4 181 B10R1.13 CN(C)C1=NC=C(I)C=C1 K46311 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.13 CN(C)C1=NC=C(N)C=C1 A12270 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 B38580 [0,1,0,0,0,0|1,0,0]=2 184 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 C64533 [0,1,0,0,0,0|1,0,0]=2 185 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F46766 [0,1,0,0,0,0|1,0,0]=2 186 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F49509 [0,1,0,0,0,0|1,0,0]=2 187 B10R1.13 C[C@@H](N)C1=CN=C(Br)C=C1 B63698 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 F46566 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 B49428 [0,1,0,0,0,0|0,0,0]=1 190 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 C49454 [0,1,0,0,0,0|0,0,0]=1 191 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 F49461 [0,1,0,0,0,0|0,0,0]=1 192 B10R1.13 C[C@H](Br)C1=CC=C(F)C=C1 B36983 [0,1,0,0,0,0|1,0,0]=2 193 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46724 [0,1,0,0,0,0|1,0,0]=2 194 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46735 [0,1,0,0,0,0|1,0,0]=2 195 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B65383 [0,1,0,0,0,0|1,0,0]=2 196 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F36974 [0,1,0,0,0,0|1,0,0]=2 197 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F64415 [0,1,0,0,0,0|1,0,0]=2 198 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46768 [0,1,0,0,0,0|1,0,0]=2 199 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46771 [0,1,0,0,0,0|1,0,0]=2 200 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 A46957 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 B46292 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 B46296 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F0635 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 F46612 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 F14039 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.13 C[C@H](N)C1=NC=C(F)C=N1 F29648 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 B49431 [0,1,0,0,0,0|0,0,0]=1 208 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49442 [0,1,0,0,0,0|0,0,0]=1 209 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49449 [0,1,0,0,0,0|0,0,0]=1 210 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 F49463 [0,1,0,0,0,0|0,0,0]=1 211 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 H46826 [0,1,0,0,0,0|0,0,0]=1 212 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 B63199 [0,1,0,0,0,0|1,0,1]=3 213 B10R1.13 FC(F)C1=CC=C(Cl)C=C1 C44732 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.13 FC(F)C1=CC=C(I)C=C1 D44733 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.13 FC(F)C1=NC=C(Br)C=C1 B28701 [0,1,0,0,0,0|3,0,0]=4 216 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B45615 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B45619 [0,1,0,0,0,0|2,0,1]=4 218 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C45622 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F46534 [0,1,0,0,0,0|2,0,1]=4 220 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F9396 [0,1,0,0,0,0|2,0,1]=4 221 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A4675 [0,1,0,0,0,0|2,0,1]=4 222 B10R1.13 N=C(N)C1=CC=C(O)C=C1 H46554 [0,1,0,0,0,0|2,0,1]=4 223 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 B45467 [0,1,0,0,0,0|1,0,2]=4 224 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 C45478 [0,1,0,0,0,0|1,0,2]=4 225 B10R1.13 NC(=O)C1=CC=C(N)C=C1 A37818 [0,1,0,0,0,0|1,0,2]=4 226 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 C64929 [0,1,0,0,0,0|1,1,1]=4 227 B10R1.13 NC(=S)C1=CC=C(O)C=C1 H39401 [0,1,0,0,0,0|1,1,1]=4 228 B10R1.13 NC1=CC=C(B(O)O)C=C1 A1420 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.13 NC1=CC=C(C(F)F)C=C1 D46546 [0,1,0,0,0,0|2,0,0]=3 230 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A1119 [0,1,0,0,0,0|2,0,1]=4 231 B10R1.13 NC1=CN=C(C(F)F)C=C1 D36896 [0,1,0,0,0,0|3,0,0]=4 232 B10R1.13 NC1=NC=C(B(O)O)C=C1 A63168 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.13 NC1=NC=C(B(O)O)C=C1 A7476 [0,1,0,0,0,0|3,0,0]=4 234 B10R1.13 NC1=NC=C(C(=O)O)C=C1 A4758 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 C67273 [0,1,0,0,0,0|1,0,1]=3 236 B10R1.13 O=C(O)C1=CC=C(I)C=C1 K39365 [0,1,0,0,0,0|1,0,1]=3 237 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M69070 [0,1,0,0,0,0|1,0,1]=3 238 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 B4499 [0,1,0,0,0,0|2,0,1]=4 239 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 C24114 [0,1,0,0,0,0|2,0,1]=4 240 B10R1.13 O=C(O)C1=CN=C(F)C=C1 F2849 [0,1,0,0,0,0|2,0,1]=4 241 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 B4511 [0,1,0,0,0,0|2,0,1]=4 242 B10R1.13 O=C(O)C1=NC=C(F)C=C1 F13767 [0,1,0,0,0,0|2,0,1]=4 243 B10R1.13 O=C(O)C1=NC=C(I)C=C1 I38885 [0,1,0,0,0,0|2,0,1]=4 244 B10R1.13 O=C(O)C1=NC=C(O)C=C1 H8151 [0,1,0,0,0,0|2,0,1]=4 245 B10R1.13 O=C1C=CC(C(=O)O)=CN1 H12738 [0,1,0,0,0,0|2,0,1]=4 246 B10R1.13 O=C1C=CC(C(=O)O)=CO1 C7780 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 F68090 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.13 O=[S@](O)C1=CC=C(Br)C=C1 B42696 [0,1,0,0,0,0|2,0,0]=3 249 B10R1.13 O=[S@]([O-])C1=CC=C(F)C=C1 S42324 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.13 OB(O)C1=CC=C(Br)C=C1 B1940 [0,1,0,0,0,0|2,0,0]=3 251 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 C2280 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.13 OB(O)C1=CC=C(F)C=C1 F3380 [0,1,0,0,0,0|2,0,0]=3 253 B10R1.13 OB(O)C1=CN=C(Br)C=C1 B1950 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.13 OB(O)C1=CN=C(Cl)C=C1 C2288 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.13 OB(O)C1=CN=C(F)C=C1 F3388 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.13 OB(O)C1=CN=C(O)C=C1 H26341 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.13 OB(O)C1=NC=C(Cl)C=C1 C40992 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.13 OB(O)C1=NC=C(F)C=C1 F61886 [0,1,0,0,0,0|3,0,0]=4 259 B10R1.13 OC1=CN=C(C(F)F)C=C1 D43514 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.15 C#C[C@@H](C)C1=CC=CC=C1 B64382 [0,1,0,0,0,0|1,0,0]=2 261 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 P68581 [0,1,0,0,0,0|0,0,1]=2 262 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [0,1,0,0,0,0|1,0,1]=3 263 B10R1.15 C=C[S@](=O)C1=CC=CC=C1 V62500 [0,1,0,0,0,0|1,0,2]=4 264 B10R1.15 CCC(=O)C1=CN=CC=C1 P49262 [0,1,0,0,0,0|1,0,2]=4 265 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 P39004 [0,1,0,0,0,0|1,0,0]=2 266 B10R1.15 CC[C@@H](N)C1=NC=CC=C1 P49666 [0,1,0,0,0,0|2,0,0]=3 267 B10R1.15 CC[C@H](N)C1=CC=CN=C1 P46964 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.15 CC[C@H](N)C1=NC=CN=C1 P14590 [0,1,0,0,0,0|3,0,0]=4 269 B10R1.15 CC[C@H](N)C1=NC=CN=C1 P27649 [0,1,0,0,0,0|3,0,0]=4 270 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M50312 [0,1,0,0,0,0|1,0,0]=2 271 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M52164 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.15 COC(=O)C1=CC=NC=C1 M64933 [0,1,0,0,0,0|1,0,2]=4 273 B10R1.15 COC(=O)C1=NC=CC=C1 M28469 [0,1,0,0,0,0|1,0,2]=4 274 B10R1.15 CO[S@@](=O)C1=CC=CC=C1 M46243 [0,1,0,0,0,0|1,0,1]=3 275 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P37912 [0,1,0,0,0,0|1,0,0]=2 276 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P39584 [0,1,0,0,0,0|1,0,0]=2 277 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P60945 [0,1,0,0,0,0|1,0,0]=2 278 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 P10845 [0,1,0,0,0,0|0,0,0]=1 279 B10R1.15 C\C(=N\O)C1=NC=CC=C1 M66365 [0,1,0,0,0,0|1,0,1]=3 280 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 B48763 [0,1,0,0,0,0|1,0,0]=2 281 B10R1.15 N=C(NO)C1=CC=NC=C1 H43094 [0,1,0,0,0,0|2,0,1]=4 282 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 A67914 [0,1,0,0,0,0|0,0,0]=1 283 B10R1.15 NC[C@@H](O)C1=CN=CC=C1 A46466 [0,1,0,0,0,0|1,0,0]=2 284 B10R1.15 NC[C@H](N)C1=CC=CC=C1 P49663 [0,1,0,0,0,0|1,0,0]=2 285 B10R1.15 NC[C@H](O)C1=NC=CC=C1 A46589 [0,1,0,0,0,0|1,0,0]=2 286 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [0,1,0,0,0,0|1,0,2]=4 287 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 A67686 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 P39434 [0,1,0,0,0,0|1,0,0]=2 289 B10R1.15 N[C@H](CO)C1=CC=CC=C1 A37812 [0,1,0,0,0,0|1,0,0]=2 290 B10R1.15 O=C(CBr)C1=CN=CC=C1 B68250 [0,1,0,0,0,0|1,0,2]=4 291 B10R1.15 O=C(CBr)C1=NC=CC=C1 B45477 [0,1,0,0,0,0|1,0,2]=4 292 B10R1.15 O=C(CCl)C1=CN=CC=C1 C45489 [0,1,0,0,0,0|1,0,2]=4 293 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [0,1,0,0,0,0|0,0,2]=3 294 B10R1.15 O=CC(=O)C1=CC=CC=C1 P48113 [0,1,0,0,0,0|0,0,3]=4 295 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 P46829 [0,1,0,0,0,0|0,0,0]=1 296 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P46828 [0,1,0,0,0,0|0,0,0]=1 297 B10R1.15 ON=C(Cl)C1=NC=CC=C1 H42458 [0,1,0,0,0,0|2,0,1]=4 298 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 C49445 [0,1,0,0,0,0|0,0,0]=1 299 B10R1.28 CC(C)(N)C1=CC=CC=C1 P32201 [0,1,0,0,0,0|1,0,0]=2 300 B10R1.28 CC(C)(N)C1=NC=CC=C1 P32222 [0,1,0,0,0,0|2,0,0]=3 301 B10R1.28 CC(C)(O)C1=CC=CC=C1 P24569 [0,1,0,0,0,0|0,0,0]=1 302 B10R1.28 CC(C)(O)C1=CN=CC=C1 P46904 [0,1,0,0,0,0|1,0,0]=2 303 B10R1.28 CC(C)(O)C1=NC=CC=C1 P38223 [0,1,0,0,0,0|1,0,0]=2 304 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 M39415 [0,1,0,0,0,0|1,0,1]=3 305 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 T68550 [0,1,0,0,0,0|2,0,0]=3 306 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 T69020 [0,1,0,0,0,0|2,0,0]=3 307 B10R1.28 C[Si](C)(C)C1=NC=CC=C1 T2828 [0,1,0,0,0,0|2,1,0]=4 308 B10R1.28 FC(F)(F)C1=CN=CC=C1 T28463 [0,1,0,0,0,0|3,0,0]=4 309 B10R1.28 F[B-](F)(F)C1=CC=CC=C1 P67648 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 B69318 [0,1,0,0,0,0|2,0,1]=4 311 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 P41001 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.28 O=S(=O)(O)C1=NC=CC=C1 P41000 [0,1,0,0,0,0|3,0,0]=4 313 B10R1.61 C=C(C)C1=C(N)C=CC=C1 P49976 [0,1,0,0,0,0|1,0,1]=3 314 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 B48708 [0,1,0,0,0,0|0,0,2]=3 315 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 B45470 [0,1,0,0,0,0|1,0,2]=4 316 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 A10416 [0,1,0,0,0,0|1,0,2]=4 317 B10R1.61 CC(=O)C1=C(C)C=CC=C1 T39529 [0,1,0,0,0,0|0,0,2]=3 318 B10R1.61 CC(=O)C1=C(C)N=CC=C1 M21788 [0,1,0,0,0,0|1,0,2]=4 319 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 C68333 [0,1,0,0,0,0|0,0,2]=3 320 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 A11386 [0,1,0,0,0,0|1,0,2]=4 321 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 C16933 [0,1,0,0,0,0|1,0,2]=4 322 B10R1.61 CC(=O)C1=C(F)C=CC=C1 F69325 [0,1,0,0,0,0|0,0,2]=3 323 B10R1.61 CC(=O)C1=C(F)C=CC=N1 A12617 [0,1,0,0,0,0|1,0,2]=4 324 B10R1.61 CC(=O)C1=C(F)C=NC=C1 A12618 [0,1,0,0,0,0|1,0,2]=4 325 B10R1.61 CC(=O)C1=C(I)C=CC=C1 K48750 [0,1,0,0,0,0|0,0,2]=3 326 B10R1.61 CC(=O)C1=C(N)C=CC=C1 A49645 [0,1,0,0,0,0|0,0,2]=3 327 B10R1.61 CC(=O)C1=C(N)C=NC=C1 A45980 [0,1,0,0,0,0|1,0,2]=4 328 B10R1.61 CC(=O)C1=C(N)N=CC=C1 A45979 [0,1,0,0,0,0|1,0,2]=4 329 B10R1.61 CC(=O)C1=C(O)C=NC=C1 H45819 [0,1,0,0,0,0|1,0,2]=4 330 B10R1.61 CC(=O)C1=CC=CN=C1Br A13535 [0,1,0,0,0,0|1,0,2]=4 331 B10R1.61 CC(=O)C1=CC=CN=C1Cl A12691 [0,1,0,0,0,0|1,0,2]=4 332 B10R1.61 CC(=O)C1=CC=CN=C1F A45493 [0,1,0,0,0,0|1,0,2]=4 333 B10R1.61 CC(=O)C1=CC=CNC1=O A45815 [0,1,0,0,0,0|1,0,2]=4 334 B10R1.61 CC(=O)C1=CNC=CC1=O A45816 [0,1,0,0,0,0|1,0,2]=4 335 B10R1.61 CC(=O)C1=NC=CC=C1O H37046 [0,1,0,0,0,0|1,0,2]=4 336 B10R1.61 CC(C)C1=C(Br)C=CC=C1 B49961 [0,1,0,0,0,0|1,0,0]=2 337 B10R1.61 CC(C)C1=C(I)C=CC=C1 K49972 [0,1,0,0,0,0|1,0,0]=2 338 B10R1.61 CC(C)C1=C(N)C=CN=C1 P46960 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.61 CC(C)C1=C([Mg+])C=CC=C1 P31757 [0,1,0,0,0,0|1,0,0]=2 340 B10R1.61 CC(C)C1=CC=CN=C1Br B32081 [0,1,0,0,0,0|2,0,0]=3 341 B10R1.61 CC(C)C1=CC=CN=C1Cl C36678 [0,1,0,0,0,0|2,0,0]=3 342 B10R1.61 CC(C)C1=CN=CN=C1Cl C37692 [0,1,0,0,0,0|3,0,0]=4 343 B10R1.61 CC(C)C1=NC=CC=C1N P46959 [0,1,0,0,0,0|2,0,0]=3 344 B10R1.61 CC1=C(B(O)O)C=CC=C1 T5230 [0,1,0,0,0,0|2,0,0]=3 345 B10R1.61 CC1=C(B(O)O)C=CC=N1 M43542 [0,1,0,0,0,0|3,0,0]=4 346 B10R1.61 CC1=C(B(O)O)C=CN=C1 M12606 [0,1,0,0,0,0|3,0,0]=4 347 B10R1.61 CC1=C(B(O)O)C=NC=C1 M3516 [0,1,0,0,0,0|3,0,0]=4 348 B10R1.61 CC1=C(C(=N)N)C=CC=C1 M49487 [0,1,0,0,0,0|2,0,1]=4 349 B10R1.61 CC1=C(C(=O)O)C=CC=C1 T69330 [0,1,0,0,0,0|1,0,1]=3 350 B10R1.61 CC1=C(C(=O)O)C=CC=N1 M14576 [0,1,0,0,0,0|2,0,1]=4 351 B10R1.61 CC1=C(C(=O)O)C=CC=N1 M45814 [0,1,0,0,0,0|2,0,1]=4 352 B10R1.61 CC1=C(C(=O)O)C=CN=C1 M14013 [0,1,0,0,0,0|2,0,1]=4 353 B10R1.61 CC1=C(C(=O)O)C=NC=C1 M4658 [0,1,0,0,0,0|2,0,1]=4 354 B10R1.61 CC1=C(C(N)=S)C=CC=C1 M69080 [0,1,0,0,0,0|1,1,1]=4 355 B10R1.61 CC1=C([C@@H](C)N)C=CC=C1 T52160 [0,1,0,0,0,0|1,0,0]=2 356 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 T52162 [0,1,0,0,0,0|1,0,0]=2 357 B10R1.61 CC1=CC=CN=C1B(O)O M43294 [0,1,0,0,0,0|3,0,0]=4 358 B10R1.61 CC1=CC=CN=C1C(=O)O M14577 [0,1,0,0,0,0|2,0,1]=4 359 B10R1.61 CC1=CC=CN=C1C(=O)O M62138 [0,1,0,0,0,0|2,0,1]=4 360 B10R1.61 CN(C)C1=C(Br)C=CC=C1 B46731 [0,1,0,0,0,0|2,0,0]=3 361 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 C46747 [0,1,0,0,0,0|2,0,0]=3 362 B10R1.61 CN(C)C1=C(N)C=CC=C1 D68123 [0,1,0,0,0,0|2,0,0]=3 363 B10R1.61 CN(C)C1=C(O)C=CC=C1 D23348 [0,1,0,0,0,0|2,0,0]=3 364 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 B37416 [0,1,0,0,0,0|1,0,0]=2 365 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 B46741 [0,1,0,0,0,0|1,0,0]=2 366 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 F46764 [0,1,0,0,0,0|1,0,0]=2 367 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 F49507 [0,1,0,0,0,0|1,0,0]=2 368 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 B25268 [0,1,0,0,0,0|0,0,0]=1 369 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 C49446 [0,1,0,0,0,0|0,0,0]=1 370 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 F49460 [0,1,0,0,0,0|0,0,0]=1 371 B10R1.61 C[C@H](Br)C1=C(F)C=CC=C1 B48765 [0,1,0,0,0,0|1,0,0]=2 372 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 B19470 [0,1,0,0,0,0|1,0,0]=2 373 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 B46723 [0,1,0,0,0,0|1,0,0]=2 374 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 B46742 [0,1,0,0,0,0|1,0,0]=2 375 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 C46756 [0,1,0,0,0,0|1,0,0]=2 376 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 F46760 [0,1,0,0,0,0|1,0,0]=2 377 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 F49510 [0,1,0,0,0,0|1,0,0]=2 378 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 F64880 [0,1,0,0,0,0|1,0,0]=2 379 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 B49429 [0,1,0,0,0,0|0,0,0]=1 380 B10R1.61 C[C@H](O)C1=C(Br)C=CC=N1 B37274 [0,1,0,0,0,0|1,0,0]=2 381 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 C49448 [0,1,0,0,0,0|0,0,0]=1 382 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 C66089 [0,1,0,0,0,0|0,0,0]=1 383 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 F49462 [0,1,0,0,0,0|0,0,0]=1 384 B10R1.61 C[C@H](O)C1=C(F)C=NC=C1 F46213 [0,1,0,0,0,0|1,0,0]=2 385 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 A65242 [0,1,0,0,0,0|1,0,0]=2 386 B10R1.61 C[C@H](O)C1=CC=CN=C1Cl C46191 [0,1,0,0,0,0|1,0,0]=2 387 B10R1.61 FC(F)C1=C(Br)C=CC=C1 B67317 [0,1,0,0,0,0|2,0,0]=3 388 B10R1.61 FC(F)C1=C(Br)C=CC=N1 B42218 [0,1,0,0,0,0|3,0,0]=4 389 B10R1.61 FC(F)C1=CC=CN=C1Br B42217 [0,1,0,0,0,0|3,0,0]=4 390 B10R1.61 N=C(N)C1=C(F)C=CC=C1 F46532 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 B61279 [0,1,0,0,0,0|1,0,2]=4 392 B10R1.61 NC(=O)C1=C(I)C=CC=C1 K45507 [0,1,0,0,0,0|1,0,2]=4 393 B10R1.61 NC(=O)C1=C(N)C=CC=C1 A64967 [0,1,0,0,0,0|1,0,2]=4 394 B10R1.61 NC1=C(B(O)O)C=CC=C1 A1340 [0,1,0,0,0,0|2,0,0]=3 395 B10R1.61 NC1=C(C(=O)O)C=CC=N1 A12487 [0,1,0,0,0,0|2,0,1]=4 396 B10R1.61 NC1=C(C(=O)O)C=CN=C1 A1102 [0,1,0,0,0,0|2,0,1]=4 397 B10R1.61 NC1=C(C(=O)O)C=NC=C1 A4739 [0,1,0,0,0,0|2,0,1]=4 398 B10R1.61 NC1=C(C(F)F)C=CC=N1 D42768 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.61 NC1=CC=CN=C1C(=O)O A0472 [0,1,0,0,0,0|2,0,1]=4 400 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 K44672 [0,1,0,0,0,0|1,0,2]=4 401 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 B31223 [0,1,0,0,0,0|2,0,1]=4 402 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 B1556 [0,1,0,0,0,0|2,0,1]=4 403 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 C14305 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 C16032 [0,1,0,0,0,0|2,0,1]=4 405 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 C42250 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.61 O=C(O)C1=C(F)C=CC=N1 F10405 [0,1,0,0,0,0|2,0,1]=4 407 B10R1.61 O=C(O)C1=C(F)C=CN=C1 F61354 [0,1,0,0,0,0|2,0,1]=4 408 B10R1.61 O=C(O)C1=C(F)C=NC=C1 F1912 [0,1,0,0,0,0|2,0,1]=4 409 B10R1.61 O=C(O)C1=C(I)C=CC=N1 K42258 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.61 O=C(O)C1=C(O)C=NC=C1 H12635 [0,1,0,0,0,0|2,0,1]=4 411 B10R1.61 O=C(O)C1=CC=CN=C1Br B23274 [0,1,0,0,0,0|2,0,1]=4 412 B10R1.61 O=C(O)C1=CC=CN=C1Cl C22883 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.61 O=C(O)C1=CC=CN=C1F F38458 [0,1,0,0,0,0|2,0,1]=4 414 B10R1.61 O=C(O)C1=CC=CNC1=S T69299 [0,1,0,0,0,0|2,0,1]=4 415 B10R1.61 O=C(O)C1=CNC=CC1=O H67947 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.61 O=C(O)C1=NC=CC=C1O H25980 [0,1,0,0,0,0|2,0,1]=4 417 B10R1.61 O=C1NC=CC=C1B(O)O X11948 [0,1,0,0,0,0|3,0,0]=4 418 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 F68062 [0,1,0,0,0,0|2,0,1]=4 419 B10R1.61 OB(O)C1=C(Br)C=CC=C1 B42940 [0,1,0,0,0,0|2,0,0]=3 420 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 C2240 [0,1,0,0,0,0|2,0,0]=3 421 B10R1.61 OB(O)C1=C(Cl)C=NC=C1 C2292 [0,1,0,0,0,0|3,0,0]=4 422 B10R1.61 OB(O)C1=C(F)C=CC=C1 F3340 [0,1,0,0,0,0|2,0,0]=3 423 B10R1.61 OB(O)C1=C(F)C=NC=C1 F2378 [0,1,0,0,0,0|3,0,0]=4 424 B10R1.61 OB(O)C1=C(O)C=CC=C1 H3736 [0,1,0,0,0,0|2,0,0]=3 425 B10R1.61 OB(O)C1=CC=CN=C1Br B68801 [0,1,0,0,0,0|3,0,0]=4 426 B10R1.61 OB(O)C1=CC=CN=C1Cl C3538 [0,1,0,0,0,0|3,0,0]=4 427 B10R1.61 OB(O)C1=CC=CN=C1F F2425 [0,1,0,0,0,0|3,0,0]=4 428 B10R1.61 OC1=C(C(F)F)C=CC=C1 D37751 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.113 C=C(C)C1=CC(Br)=CN=C1 B48877 [0,1,0,0,0,0|2,0,1]=4 430 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 A12880 [0,1,0,0,0,0|1,0,2]=4 431 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 B39012 [0,1,0,0,0,0|1,0,2]=4 432 B10R1.113 CC(=O)C1=CC(C)=CC=C1 T39528 [0,1,0,0,0,0|0,0,2]=3 433 B10R1.113 CC(=O)C1=CC(C)=NC=C1 M49265 [0,1,0,0,0,0|1,0,2]=4 434 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C0410 [0,1,0,0,0,0|1,0,2]=4 435 B10R1.113 CC(=O)C1=CC(F)=CN=C1 F45496 [0,1,0,0,0,0|1,0,2]=4 436 B10R1.113 CC(=O)C1=CC(N)=CC=C1 A68568 [0,1,0,0,0,0|0,0,2]=3 437 B10R1.113 CC(=O)C1=CC(O)=CC=C1 H60763 [0,1,0,0,0,0|0,0,2]=3 438 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 A45468 [0,1,0,0,0,0|1,0,2]=4 439 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 C69069 [0,1,0,0,0,0|0,0,2]=3 440 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 C45483 [0,1,0,0,0,0|1,0,2]=4 441 B10R1.113 CC(=O)C1=CC=CC(F)=C1 F48736 [0,1,0,0,0,0|0,0,2]=3 442 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F45497 [0,1,0,0,0,0|1,0,2]=4 443 B10R1.113 CC(=O)C1=CC=CC(I)=C1 I37889 [0,1,0,0,0,0|0,0,2]=3 444 B10R1.113 CC(=O)C1=CN=CC(C)=C1 M63719 [0,1,0,0,0,0|1,0,2]=4 445 B10R1.113 CC(=O)C1=NC(C)=CC=C1 A49259 [0,1,0,0,0,0|1,0,2]=4 446 B10R1.113 CC(=O)C1=NC(N)=CC=C1 A37132 [0,1,0,0,0,0|1,0,2]=4 447 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 B45471 [0,1,0,0,0,0|1,0,2]=4 448 B10R1.113 CC(=O)C1=NC=CC(C)=C1 M4575 [0,1,0,0,0,0|1,0,2]=4 449 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 C61244 [0,1,0,0,0,0|1,0,2]=4 450 B10R1.113 CC(C)C1=CC(Br)=CN=C1 B32128 [0,1,0,0,0,0|2,0,0]=3 451 B10R1.113 CC(C)C1=CC(Br)=NC=C1 B46727 [0,1,0,0,0,0|2,0,0]=3 452 B10R1.113 CC(C)C1=CC=CC(Br)=C1 B49962 [0,1,0,0,0,0|1,0,0]=2 453 B10R1.113 CC(C)C1=CC=CC(Br)=N1 B46729 [0,1,0,0,0,0|2,0,0]=3 454 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 C37539 [0,1,0,0,0,0|2,0,0]=3 455 B10R1.113 CC(C)C1=CC=CC(N)=C1 P50307 [0,1,0,0,0,0|1,0,0]=2 456 B10R1.113 CC(C)C1=CC=CC([Mg+])=C1 P31758 [0,1,0,0,0,0|1,0,0]=2 457 B10R1.113 CC(C)C1=CN=CC(N)=C1 I32297 [0,1,0,0,0,0|2,0,0]=3 458 B10R1.113 CC(C)C1=NC=CC(Br)=C1 B63808 [0,1,0,0,0,0|2,0,0]=3 459 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 C39059 [0,1,0,0,0,0|2,0,0]=3 460 B10R1.113 CC1=CC(B(O)O)=CN=C1 M5113 [0,1,0,0,0,0|3,0,0]=4 461 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M10515 [0,1,0,0,0,0|2,0,1]=4 462 B10R1.113 CC1=CC(C(=O)O)=NC=C1 M38719 [0,1,0,0,0,0|2,0,1]=4 463 B10R1.113 CC1=CC=CC(B(O)O)=C1 T5210 [0,1,0,0,0,0|2,0,0]=3 464 B10R1.113 CC1=CC=CC(C(=N)N)=C1 M49488 [0,1,0,0,0,0|2,0,1]=4 465 B10R1.113 CC1=CC=CC(C(=O)O)=N1 M45823 [0,1,0,0,0,0|2,0,1]=4 466 B10R1.113 CC1=CC=CC(N(C)C)=C1 T39548 [0,1,0,0,0,0|2,0,0]=3 467 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T50311 [0,1,0,0,0,0|1,0,0]=2 468 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T52159 [0,1,0,0,0,0|1,0,0]=2 469 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 T50309 [0,1,0,0,0,0|1,0,0]=2 470 B10R1.113 CC1=NC=CC(B(O)O)=C1 M24370 [0,1,0,0,0,0|3,0,0]=4 471 B10R1.113 CC1=NC=CC(B(O)O)=C1 M43543 [0,1,0,0,0,0|3,0,0]=4 472 B10R1.113 CC1=NC=CC(C(=O)O)=C1 M15805 [0,1,0,0,0,0|2,0,1]=4 473 B10R1.113 CN(C)C1=CC(Br)=NC=C1 B37923 [0,1,0,0,0,0|3,0,0]=4 474 B10R1.113 CN(C)C1=CC(F)=NC=C1 F46309 [0,1,0,0,0,0|3,0,0]=4 475 B10R1.113 CN(C)C1=CC(N)=CC=C1 D49538 [0,1,0,0,0,0|2,0,0]=3 476 B10R1.113 CN(C)C1=CC(N)=CC=C1 D49665 [0,1,0,0,0,0|2,0,0]=3 477 B10R1.113 CN(C)C1=CC=CC(Br)=C1 B68052 [0,1,0,0,0,0|2,0,0]=3 478 B10R1.113 CN(C)C1=CC=CC(F)=C1 F46763 [0,1,0,0,0,0|2,0,0]=3 479 B10R1.113 CN(C)C1=CC=CC([Mg+])=C1 D31761 [0,1,0,0,0,0|2,0,0]=3 480 B10R1.113 CN(C)C1=NC=CC(Br)=C1 B46282 [0,1,0,0,0,0|3,0,0]=4 481 B10R1.113 C[C@@H](N)C1=CC(Br)=NC=C1 B46295 [0,1,0,0,0,0|2,0,0]=3 482 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 B46734 [0,1,0,0,0,0|1,0,0]=2 483 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=N1 B46291 [0,1,0,0,0,0|2,0,0]=3 484 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 F46765 [0,1,0,0,0,0|1,0,0]=2 485 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 F49508 [0,1,0,0,0,0|1,0,0]=2 486 B10R1.113 C[C@@H](N)C1=CC=CC(F)=N1 F46611 [0,1,0,0,0,0|2,0,0]=3 487 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 A49524 [0,1,0,0,0,0|1,0,0]=2 488 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 C49447 [0,1,0,0,0,0|0,0,0]=1 489 B10R1.113 C[C@H](N)C1=CC(Cl)=NC=C1 C13483 [0,1,0,0,0,0|2,0,0]=3 490 B10R1.113 C[C@H](N)C1=CC(F)=CN=C1 F46567 [0,1,0,0,0,0|2,0,0]=3 491 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B46739 [0,1,0,0,0,0|1,0,0]=2 492 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B46743 [0,1,0,0,0,0|1,0,0]=2 493 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B64158 [0,1,0,0,0,0|1,0,0]=2 494 B10R1.113 C[C@H](N)C1=CC=CC(Cl)=N1 C46299 [0,1,0,0,0,0|2,0,0]=3 495 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 F46761 [0,1,0,0,0,0|1,0,0]=2 496 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 F49511 [0,1,0,0,0,0|1,0,0]=2 497 B10R1.113 C[C@H](N)C1=CC=CC(F)=N1 F46568 [0,1,0,0,0,0|2,0,0]=3 498 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 A46961 [0,1,0,0,0,0|1,0,0]=2 499 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 A64155 [0,1,0,0,0,0|1,0,0]=2 500 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 A64991 [0,1,0,0,0,0|1,0,0]=2 501 B10R1.113 C[C@H](O)C1=CC(N)=CC=C1 A46893 [0,1,0,0,0,0|0,0,0]=1 502 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 B49430 [0,1,0,0,0,0|0,0,0]=1 503 B10R1.113 C[C@H](O)C1=CC=CC(Br)=N1 B37443 [0,1,0,0,0,0|1,0,0]=2 504 B10R1.113 C[C@H](O)C1=NC=CC(Cl)=C1 C46192 [0,1,0,0,0,0|1,0,0]=2 505 B10R1.113 FC(F)C1=CC(Cl)=NC=C1 C42238 [0,1,0,0,0,0|3,0,0]=4 506 B10R1.113 FC(F)C1=CC=CC(Br)=C1 B44723 [0,1,0,0,0,0|2,0,0]=3 507 B10R1.113 FC(F)C1=CC=CC(Br)=N1 B38710 [0,1,0,0,0,0|3,0,0]=4 508 B10R1.113 FC(F)C1=NC=CC(Br)=C1 B42219 [0,1,0,0,0,0|3,0,0]=4 509 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 B45618 [0,1,0,0,0,0|2,0,1]=4 510 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 C69433 [0,1,0,0,0,0|2,0,1]=4 511 B10R1.113 N=C(N)C1=CC=CC(F)=C1 F46533 [0,1,0,0,0,0|2,0,1]=4 512 B10R1.113 NC(=O)C1=CC(O)=CC=C1 H45813 [0,1,0,0,0,0|1,0,2]=4 513 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 B45466 [0,1,0,0,0,0|1,0,2]=4 514 B10R1.113 NC(=O)C1=CC=CC(F)=C1 F45492 [0,1,0,0,0,0|1,0,2]=4 515 B10R1.113 NC1=CC(B(O)O)=CN=C1 A62316 [0,1,0,0,0,0|3,0,0]=4 516 B10R1.113 NC1=CC(C(=O)O)=CN=C1 A4566 [0,1,0,0,0,0|2,0,1]=4 517 B10R1.113 NC1=CC(C(=O)O)=NC=C1 A10317 [0,1,0,0,0,0|2,0,1]=4 518 B10R1.113 NC1=CC(C(F)F)=NC=C1 D43518 [0,1,0,0,0,0|3,0,0]=4 519 B10R1.113 NC1=CC(C(F)F)=NC=C1 D63827 [0,1,0,0,0,0|3,0,0]=4 520 B10R1.113 NC1=CC=CC(B(O)O)=C1 A1370 [0,1,0,0,0,0|2,0,0]=3 521 B10R1.113 NC1=CC=CC(B(O)O)=C1 A2231 [0,1,0,0,0,0|2,0,0]=3 522 B10R1.113 NC1=CC=CC(B(O)O)=C1 A31607 [0,1,0,0,0,0|2,0,0]=3 523 B10R1.113 NC1=CC=CC(B(O)O)=C1 A56559 [0,1,0,0,0,0|2,0,0]=3 524 B10R1.113 NC1=CC=CC(C(=O)O)=C1 A69286 [0,1,0,0,0,0|1,0,1]=3 525 B10R1.113 NC1=CC=CC(C(=O)O)=N1 A4798 [0,1,0,0,0,0|2,0,1]=4 526 B10R1.113 NC1=CC=CC(C(F)F)=N1 D42769 [0,1,0,0,0,0|3,0,0]=4 527 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 N43520 [0,1,0,0,0,0|2,0,1]=4 528 B10R1.113 NC1=NC=CC(B(O)O)=C1 A38700 [0,1,0,0,0,0|3,0,0]=4 529 B10R1.113 NC1=NC=CC(C(=O)O)=C1 A3938 [0,1,0,0,0,0|2,0,1]=4 530 B10R1.113 NC1=NC=CC(C(F)F)=C1 D18818 [0,1,0,0,0,0|3,0,0]=4 531 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 C64820 [0,1,0,0,0,0|1,0,2]=4 532 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 B69308 [0,1,0,0,0,0|2,0,1]=4 533 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 B2422 [0,1,0,0,0,0|2,0,1]=4 534 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 C10556 [0,1,0,0,0,0|2,0,1]=4 535 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 C12400 [0,1,0,0,0,0|2,0,1]=4 536 B10R1.113 O=C(O)C1=CC(F)=CN=C1 F12047 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.113 O=C(O)C1=CC(F)=NC=C1 F42254 [0,1,0,0,0,0|2,0,1]=4 538 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H3170 [0,1,0,0,0,0|2,0,1]=4 539 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H38104 [0,1,0,0,0,0|2,0,1]=4 540 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 B39364 [0,1,0,0,0,0|1,0,1]=3 541 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 B4508 [0,1,0,0,0,0|2,0,1]=4 542 B10R1.113 O=C(O)C1=CC=CC(F)=C1 F68888 [0,1,0,0,0,0|1,0,1]=3 543 B10R1.113 O=C(O)C1=CC=CC(F)=N1 F3784 [0,1,0,0,0,0|2,0,1]=4 544 B10R1.113 O=C(O)C1=CC=CC(I)=C1 K68155 [0,1,0,0,0,0|1,0,1]=3 545 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H4735 [0,1,0,0,0,0|2,0,1]=4 546 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B7920 [0,1,0,0,0,0|2,0,1]=4 547 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C24201 [0,1,0,0,0,0|2,0,1]=4 548 B10R1.113 O=C(O)C1=NC=CC(F)=C1 F42252 [0,1,0,0,0,0|2,0,1]=4 549 B10R1.113 O=C(O)C1=NC=CC(I)=C1 I3949 [0,1,0,0,0,0|2,0,1]=4 550 B10R1.113 O=C(O)C1=NC=CC(O)=C1 H9415 [0,1,0,0,0,0|2,0,1]=4 551 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 F42253 [0,1,0,0,0,0|2,0,1]=4 552 B10R1.113 OB(O)C1=CC(Br)=CN=C1 B1954 [0,1,0,0,0,0|3,0,0]=4 553 B10R1.113 OB(O)C1=CC(Br)=NC=C1 B40991 [0,1,0,0,0,0|3,0,0]=4 554 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 C3534 [0,1,0,0,0,0|3,0,0]=4 555 B10R1.113 OB(O)C1=CC(Cl)=NC=C1 C2286 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.113 OB(O)C1=CC(F)=CN=C1 F25954 [0,1,0,0,0,0|3,0,0]=4 557 B10R1.113 OB(O)C1=CC(F)=NC=C1 F2370 [0,1,0,0,0,0|3,0,0]=4 558 B10R1.113 OB(O)C1=CC=CC(Br)=C1 B1920 [0,1,0,0,0,0|2,0,0]=3 559 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 C2260 [0,1,0,0,0,0|2,0,0]=3 560 B10R1.113 OB(O)C1=CC=CC(F)=C1 F3360 [0,1,0,0,0,0|2,0,0]=3 561 B10R1.113 OB(O)C1=CC=CC(F)=N1 F40993 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.113 OB(O)C1=CC=CC(I)=C1 K3840 [0,1,0,0,0,0|2,0,0]=3 563 B10R1.113 OB(O)C1=CC=CC(O)=C1 H3740 [0,1,0,0,0,0|2,0,0]=3 564 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 P68601 [0,0,0,1,0,0|0,0,0]=1 565 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P68362 [0,0,0,1,0,0|0,0,0]=1 566 B10R2.6 C1=CN=C(C2CC2)N=C1 C14647 [0,0,0,1,0,0|3,0,0]=4 567 B10R2.320 Br[C@H]1CC2=C1C=CC=C2 B68954 [0,0,0,1,0,0|1,0,0]=2 568 B10R2.320 O=C1CC2=C1C=CC=C2 B36727 [0,0,0,1,0,0|0,0,2]=3 569 B8R1.7 CC(=O)C1=CC=CN1 P68619 [0,0,0,0,1,0|1,0,2]=4 570 B8R1.7 CC(=O)C1=CC=CS1 A69304 [0,0,0,0,1,0|1,0,2]=4 571 B8R1.7 CC(=O)C1=CNC=C1 A37548 [0,0,0,0,1,0|1,0,2]=4 572 B8R1.7 CC(=O)C1=CSC=C1 A12828 [0,0,0,0,1,0|1,0,2]=4 573 B8R1.7 CC(C)C1=CC=CO1 P43710 [0,0,0,0,1,0|2,0,0]=3 574 B8R1.7 CC(C)C1=NC=CN1 P67407 [0,0,0,0,1,0|3,0,0]=4 575 B8R1.7 CC(C)C1=NNC=C1 P9834 [0,0,0,0,1,0|3,0,0]=4 576 B8R1.7 CC(C)N1C=CC=N1 P41426 [0,0,0,0,1,0|3,0,0]=4 577 B8R1.7 C[C@@H](N)C1=CC=CS1 T43397 [0,0,0,0,1,0|2,0,0]=3 578 B8R1.7 C[C@@H](O)C1=CC=CO1 F43302 [0,0,0,0,1,0|1,0,0]=2 579 B8R1.7 C[C@H](N)C1=CC=CS1 T43555 [0,0,0,0,1,0|2,0,0]=3 580 B8R1.7 C[C@H](N)C1=CN=CN1 K62106 [0,0,0,0,1,0|3,0,0]=4 581 B8R1.7 C[C@H](N)C1=CNC=N1 K41398 [0,0,0,0,1,0|3,0,0]=4 582 B8R1.7 C[C@H](N)C1=NC=CS1 T41204 [0,0,0,0,1,0|3,0,0]=4 583 B8R1.7 C[C@H](N)C1=NC=CS1 T5352 [0,0,0,0,1,0|3,0,0]=4 584 B8R1.7 O=C(O)C1=CC=CN1 P24658 [0,0,0,0,1,0|2,0,1]=4 585 B8R1.7 O=C(O)C1=CC=CO1 F38499 [0,0,0,0,1,0|2,0,1]=4 586 B8R1.7 O=C(O)C1=CC=CS1 T69312 [0,0,0,0,1,0|2,0,1]=4 587 B8R1.7 O=C(O)C1=COC=C1 F14351 [0,0,0,0,1,0|2,0,1]=4 588 B8R1.7 O=C(O)C1=CSC=C1 T12825 [0,0,0,0,1,0|2,0,1]=4 589 B8R1.7 OB(O)C1=CC=CO1 F3580 [0,0,0,0,1,0|3,0,0]=4 590 B8R1.7 OB(O)C1=COC=C1 F3600 [0,0,0,0,1,0|3,0,0]=4 591 B8R1.7 OB(O)C1=CSC=C1 T5200 [0,0,0,0,1,0|3,0,0]=4 592 B10R1.18 CC(=O)CC1=CC=NC=C1 P49256 [0,0,0,0,0,1|1,0,2]=4 593 B10R1.18 CC(=O)CC1=NC=CC=C1 P15826 [0,0,0,0,0,1|1,0,2]=4 594 B10R1.18 CC(=O)NC1=CC=CC=C1 A60649 [0,0,0,0,0,1|0,0,2]=3 595 B10R1.18 CC(=O)NC1=CN=CC=C1 P63567 [0,0,0,0,0,1|1,0,2]=4 596 B10R1.18 CC(C)=CC1=CC=CC=C1 M52675 [0,0,0,0,0,1|1,0,1]=3 597 B10R1.18 CC(C)NC1=CC=CC=C1 P69278 [0,0,0,0,0,1|1,0,0]=2 598 B10R1.18 CC(C)NC1=NC=CC=N1 I39098 [0,0,0,0,0,1|3,0,0]=4 599 B10R1.18 CC(C)OC1=CN=CC=C1 P46891 [0,0,0,0,0,1|2,0,0]=3 600 B10R1.18 CC(C)OC1=NC=CC=C1 P46890 [0,0,0,0,0,1|2,0,0]=3 601 B10R1.18 FC(F)OC1=CC=CC=C1 D45605 [0,0,0,0,0,1|2,0,0]=3 602 B10R1.18 N=C(N)CC1=CC=CC=C1 P22633 [0,0,0,0,0,1|2,0,1]=4 603 B10R1.18 N=C(N)NC1=CC=CC=C1 P49691 [0,0,0,0,0,1|2,0,1]=4 604 B10R1.18 NC(=O)CC1=CC=CC=C1 P69172 [0,0,0,0,0,1|1,0,2]=4 605 B10R1.18 NC(=O)OC1=CC=CC=C1 P45812 [0,0,0,0,0,1|1,0,2]=4 606 B10R1.18 O=C(O)CC1=CC=NC=C1 P46551 [0,0,0,0,0,1|2,0,1]=4 607 B10R1.18 O=C(O)CC1=CN=CC=C1 P39426 [0,0,0,0,0,1|2,0,1]=4 608 B10R1.18 O=C(O)CC1=NC=CC=C1 P18563 [0,0,0,0,0,1|2,0,1]=4 609 B10R1.18 O=C(O)CC1=NC=CC=C1 P38331 [0,0,0,0,0,1|2,0,1]=4 610 B10R1.18 S=C(Cl)OC1=CC=CC=C1 P37341 [0,0,0,0,0,1|1,1,1]=4 611 B7R1.3 BrC1=CC=NC=C1 B2747 [2,0,0,0,0,0|2,0,0]=4 612 B7R1.3 BrC1=CC=NC=C1 B65041 [2,0,0,0,0,0|2,0,0]=4 613 B7R1.3 BrC1=CN=CC=C1 B2746 [2,0,0,0,0,0|2,0,0]=4 614 B7R1.3 CC1=CC=CN=N1 M0216 [2,0,0,0,0,0|2,0,0]=4 615 B7R1.3 CC1=CN=CN=C1 M41018 [2,0,0,0,0,0|2,0,0]=4 616 B7R1.3 CC1=CN=NC=C1 M3532 [2,0,0,0,0,0|2,0,0]=4 617 B7R1.3 CC1=NC=CC=N1 M68916 [2,0,0,0,0,0|2,0,0]=4 618 B7R1.3 CC1=NC=CN=C1 M61917 [2,0,0,0,0,0|2,0,0]=4 619 B7R1.3 CC1=NC=NC=C1 M7491 [2,0,0,0,0,0|2,0,0]=4 620 B7R1.3 C[N+]1=CC=CC=C1 M38728 [2,0,0,0,0,0|1,0,0]=3 621 B7R1.3 ClC1=CC=NC=C1 C39170 [2,0,0,0,0,0|2,0,0]=4 622 B7R1.3 ClC1=CN=CC=C1 C68367 [2,0,0,0,0,0|2,0,0]=4 623 B7R1.3 FC1=CC=NC=C1 F2970 [2,0,0,0,0,0|2,0,0]=4 624 B7R1.3 FC1=CN=CC=C1 F1892 [2,0,0,0,0,0|2,0,0]=4 625 B7R1.3 FC1=NC=CC=C1 F4862 [2,0,0,0,0,0|2,0,0]=4 626 B7R1.3 IC1=CC=CC=C1 I38419 [2,0,0,0,0,0|1,0,0]=3 627 B7R1.3 IC1=CC=NC=C1 I3870 [2,0,0,0,0,0|2,0,0]=4 628 B7R1.3 IC1=CN=CC=C1 I16635 [2,0,0,0,0,0|2,0,0]=4 629 B7R1.3 IC1=NC=CC=C1 K67594 [2,0,0,0,0,0|2,0,0]=4 630 B7R1.3 NC1=NC=CC=C1 A23973 [2,0,0,0,0,0|2,0,0]=4 631 B7R1.3 O=C1C=COC=C1 P40862 [2,0,0,0,0,0|1,0,1]=4 632 B7R1.3 OC1=CC=NC=C1 H10331 [2,0,0,0,0,0|1,0,0]=3 633 B7R1.3 OC1=CN=CN=C1 H14432 [2,0,0,0,0,0|2,0,0]=4 634 B7R1.3 OC1=CN=NC=C1 H22270 [2,0,0,0,0,0|2,0,0]=4 635 B7R1.3 OC1=CN=NC=C1 P40299 [2,0,0,0,0,0|2,0,0]=4 636 B7R1.3 OC1=NC=CC=C1 P61113 [2,0,0,0,0,0|1,0,0]=3 637 B7R1.3 OC1=NC=NC=C1 P32223 [2,0,0,0,0,0|2,0,0]=4 638 B7R1.3 [Mg+]C1=CC=CC=C1 P31728 [2,0,0,0,0,0|1,0,0]=3 639 B7R1.3 [Mg+]C1=CN=CC=C1 P8350 [2,0,0,0,0,0|2,0,0]=4 640 B7R1.3 [Mg+]C1=NC=CC=C1 P8351 [2,0,0,0,0,0|2,0,0]=4 641 B9R1.1 BrCC1=CC=C(I)C=C1 B45171 [1,1,0,0,0,0|1,0,0]=3 642 B9R1.1 BrCC1=NC=C(Br)C=C1 B42521 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.1 C#CC1=CC=C(Br)C=C1 B47528 [1,1,0,0,0,0|0,0,2]=4 644 B9R1.1 C#CC1=CC=C(C)C=C1 E68609 [1,1,0,0,0,0|0,0,2]=4 645 B9R1.1 C#CC1=CC=C(Cl)C=C1 C4938 [1,1,0,0,0,0|0,0,2]=4 646 B9R1.1 C#CC1=CC=C(F)C=C1 F2891 [1,1,0,0,0,0|0,0,2]=4 647 B9R1.1 C#CC1=CC=C(N)C=C1 E37919 [1,1,0,0,0,0|0,0,2]=4 648 B9R1.1 C=CC1=CC=C(Br)C=C1 B68124 [1,1,0,0,0,0|0,0,2]=4 649 B9R1.1 C=CC1=CC=C(O)C=C1 V67697 [1,1,0,0,0,0|0,0,2]=4 650 B9R1.1 CC1=CC=C(C=O)C=C1 M68600 [1,1,0,0,0,0|0,0,2]=4 651 B9R1.1 CC1=CC=C(CN)C=C1 M69544 [1,1,0,0,0,0|1,0,0]=3 652 B9R1.1 CC1=CC=C(CO)C=C1 T37852 [1,1,0,0,0,0|0,0,0]=2 653 B9R1.1 CC1=CC=C(NN)C=C1 T68855 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.1 CC1=CN=C(CCl)C=C1 C46107 [1,1,0,0,0,0|2,0,0]=4 655 B9R1.1 CC1=CN=C(CN)C=C1 M43622 [1,1,0,0,0,0|2,0,0]=4 656 B9R1.1 CC1=CN=C(CN)C=C1 M46461 [1,1,0,0,0,0|2,0,0]=4 657 B9R1.1 CC1=CN=C(CO)C=N1 M43210 [1,1,0,0,0,0|2,0,0]=4 658 B9R1.1 CC1=CN=C(CO)N=C1 H11473 [1,1,0,0,0,0|2,0,0]=4 659 B9R1.1 CC1=NC=C(CBr)C=C1 B46089 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.1 CC1=NC=C(CCl)C=C1 C46111 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.1 CC1=NC=C(CN)C=C1 M0572 [1,1,0,0,0,0|2,0,0]=4 662 B9R1.1 CC1=NC=C(CO)C=C1 M15722 [1,1,0,0,0,0|1,0,0]=3 663 B9R1.1 CC1=NC=C(CO)C=N1 H12381 [1,1,0,0,0,0|2,0,0]=4 664 B9R1.1 CCC1=CC=C(Br)C=C1 B68945 [1,1,0,0,0,0|0,0,0]=2 665 B9R1.1 CCC1=CC=C(Cl)C=C1 C49160 [1,1,0,0,0,0|0,0,0]=2 666 B9R1.1 CCC1=CC=C(I)C=C1 E49167 [1,1,0,0,0,0|0,0,0]=2 667 B9R1.1 CCC1=CC=C([Mg+])C=C1 E31741 [1,1,0,0,0,0|0,0,0]=2 668 B9R1.1 CCC1=CN=C(Cl)C=C1 C26331 [1,1,0,0,0,0|1,0,0]=3 669 B9R1.1 CCC1=CN=C(Cl)N=C1 E11897 [1,1,0,0,0,0|2,0,0]=4 670 B9R1.1 CCC1=CN=C(N)C=C1 E43600 [1,1,0,0,0,0|1,0,0]=3 671 B9R1.1 CCC1=CN=C(N)N=C1 E28664 [1,1,0,0,0,0|2,0,0]=4 672 B9R1.1 CCC1=NC=C(Br)C=C1 B1614 [1,1,0,0,0,0|1,0,0]=3 673 B9R1.1 CCC1=NC=C(Br)C=N1 B36933 [1,1,0,0,0,0|2,0,0]=4 674 B9R1.1 CCC1=NC=C(Cl)C=C1 C46096 [1,1,0,0,0,0|1,0,0]=3 675 B9R1.1 CCC1=NC=C(N)C=C1 E43602 [1,1,0,0,0,0|1,0,0]=3 676 B9R1.1 CCC1=NC=C(N)C=N1 A11320 [1,1,0,0,0,0|2,0,0]=4 677 B9R1.1 CNC1=CC=C(Br)C=C1 B61266 [1,1,0,0,0,0|1,0,0]=3 678 B9R1.1 CNC1=CC=C(C)C=C1 D39432 [1,1,0,0,0,0|1,0,0]=3 679 B9R1.1 CNC1=CC=C(I)C=C1 K46120 [1,1,0,0,0,0|1,0,0]=3 680 B9R1.1 CNC1=CC=C(N)C=C1 M69627 [1,1,0,0,0,0|1,0,0]=3 681 B9R1.1 CNC1=CN=C(C)C=C1 D43616 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.1 CNC1=NC=C(Br)C=C1 B42975 [1,1,0,0,0,0|2,0,0]=4 683 B9R1.1 CNC1=NC=C(C)C=C1 D43614 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.1 CNC1=NC=C(F)C=C1 F32100 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.1 CNC1=NC=C(N)C=C1 M43342 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.1 CNC1=NC=C(N)C=C1 M43545 [1,1,0,0,0,0|2,0,0]=4 687 B9R1.1 COC1=CC=C(S)C=C1 M46276 [1,1,0,0,0,0|1,0,0]=3 688 B9R1.1 COC1=CC=C([Mg+])C=C1 M31744 [1,1,0,0,0,0|1,0,0]=3 689 B9R1.1 COC1=CN=C(Br)C=C1 B5045 [1,1,0,0,0,0|2,0,0]=4 690 B9R1.1 COC1=CN=C(Cl)C=C1 C19386 [1,1,0,0,0,0|2,0,0]=4 691 B9R1.1 COC1=CN=C(F)C=C1 F42925 [1,1,0,0,0,0|2,0,0]=4 692 B9R1.1 COC1=CN=C(I)C=C1 I5931 [1,1,0,0,0,0|2,0,0]=4 693 B9R1.1 COC1=CN=C(N)C=C1 A10497 [1,1,0,0,0,0|2,0,0]=4 694 B9R1.1 COC1=NC=C(Br)C=C1 B9550 [1,1,0,0,0,0|2,0,0]=4 695 B9R1.1 COC1=NC=C(C)C=C1 M67554 [1,1,0,0,0,0|2,0,0]=4 696 B9R1.1 COC1=NC=C(Cl)C=C1 C42903 [1,1,0,0,0,0|2,0,0]=4 697 B9R1.1 COC1=NC=C(F)C=C1 F24011 [1,1,0,0,0,0|2,0,0]=4 698 B9R1.1 COC1=NC=C(I)C=C1 K42935 [1,1,0,0,0,0|2,0,0]=4 699 B9R1.1 COC1=NC=C(N)C=C1 A12692 [1,1,0,0,0,0|2,0,0]=4 700 B9R1.1 COC1=NC=C(O)C=C1 H43140 [1,1,0,0,0,0|2,0,0]=4 701 B9R1.1 CSC1=CC=C(I)C=C1 I38579 [1,1,0,0,0,0|1,0,0]=3 702 B9R1.1 CSC1=CC=C(O)C=C1 M67393 [1,1,0,0,0,0|1,0,0]=3 703 B9R1.1 CSC1=CC=C([Mg+])C=C1 M31771 [1,1,0,0,0,0|1,0,0]=3 704 B9R1.1 CSC1=CN=C(N)C=C1 A43262 [1,1,0,0,0,0|2,0,0]=4 705 B9R1.1 CSC1=NC=C(Br)C=C1 B2646 [1,1,0,0,0,0|2,0,0]=4 706 B9R1.1 ClC1=CC=C(CBr)C=C1 B45158 [1,1,0,0,0,0|1,0,0]=3 707 B9R1.1 ClC1=CN=C(CBr)C=C1 B42537 [1,1,0,0,0,0|2,0,0]=4 708 B9R1.1 ClCC1=CC=C(Br)C=C1 B45160 [1,1,0,0,0,0|1,0,0]=3 709 B9R1.1 ClCC1=CN=C(Br)C=C1 B42528 [1,1,0,0,0,0|2,0,0]=4 710 B9R1.1 ClCC1=CN=C(Br)C=C1 B42539 [1,1,0,0,0,0|2,0,0]=4 711 B9R1.1 ClCC1=NC=C(Br)C=C1 B42540 [1,1,0,0,0,0|2,0,0]=4 712 B9R1.1 ClCC1=NC=C(Br)C=C1 B61533 [1,1,0,0,0,0|2,0,0]=4 713 B9R1.1 ClCC1=NC=C(Cl)C=C1 C14676 [1,1,0,0,0,0|2,0,0]=4 714 B9R1.1 ClCC1=NC=C(Cl)C=C1 C42565 [1,1,0,0,0,0|2,0,0]=4 715 B9R1.1 FC1=CC=C(C[Mg+])C=C1 F6777 [1,1,0,0,0,0|1,0,0]=3 716 B9R1.1 FC1=NC=C(CBr)C=C1 B39061 [1,1,0,0,0,0|2,0,0]=4 717 B9R1.1 FC1=NC=C(CBr)C=C1 B7888 [1,1,0,0,0,0|2,0,0]=4 718 B9R1.1 FC1=NC=C(CCl)C=C1 C7887 [1,1,0,0,0,0|2,0,0]=4 719 B9R1.1 N#CC1=CC=C(Br)C=C1 B67636 [1,1,0,0,0,0|1,0,1]=4 720 B9R1.1 N#CC1=CC=C(Cl)C=C1 C37848 [1,1,0,0,0,0|1,0,1]=4 721 B9R1.1 N#CC1=CC=C(F)C=C1 F64969 [1,1,0,0,0,0|1,0,1]=4 722 B9R1.1 N#CC1=CC=C(I)C=C1 K44443 [1,1,0,0,0,0|1,0,1]=4 723 B9R1.1 N#CC1=CC=C(N)C=C1 A64955 [1,1,0,0,0,0|1,0,1]=4 724 B9R1.1 N#CC1=CC=C(O)C=C1 C64941 [1,1,0,0,0,0|1,0,1]=4 725 B9R1.1 N#CC1=CC=C(S)C=C1 M64870 [1,1,0,0,0,0|1,0,1]=4 726 B9R1.1 NC1=CC=C(CO)C=C1 A36619 [1,1,0,0,0,0|0,0,0]=2 727 B9R1.1 NC1=NC=C(CO)C=C1 A0345 [1,1,0,0,0,0|1,0,0]=3 728 B9R1.1 NC1=NC=C(CO)C=N1 A11298 [1,1,0,0,0,0|2,0,0]=4 729 B9R1.1 NCC1=CC=C(Br)C=C1 B36612 [1,1,0,0,0,0|1,0,0]=3 730 B9R1.1 NCC1=CC=C(Br)C=C1 B46090 [1,1,0,0,0,0|1,0,0]=3 731 B9R1.1 NCC1=CC=C(Cl)C=C1 C46099 [1,1,0,0,0,0|1,0,0]=3 732 B9R1.1 NCC1=CC=C(I)C=C1 I36689 [1,1,0,0,0,0|1,0,0]=3 733 B9R1.1 NCC1=CC=C(I)C=C1 K46123 [1,1,0,0,0,0|1,0,0]=3 734 B9R1.1 NCC1=CC=C(N)C=C1 A46581 [1,1,0,0,0,0|1,0,0]=3 735 B9R1.1 NCC1=CC=C(O)C=C1 A67587 [1,1,0,0,0,0|1,0,0]=3 736 B9R1.1 NCC1=CN=C(Br)C=C1 B42976 [1,1,0,0,0,0|2,0,0]=4 737 B9R1.1 NCC1=CN=C(Cl)C=C1 A0585 [1,1,0,0,0,0|2,0,0]=4 738 B9R1.1 NCC1=CN=C(F)C=C1 A13990 [1,1,0,0,0,0|2,0,0]=4 739 B9R1.1 NCC1=CNC(=O)C=C1 A1719 [1,1,0,0,0,0|2,0,0]=4 740 B9R1.1 NCC1=NC=C(Br)C=C1 B15775 [1,1,0,0,0,0|2,0,0]=4 741 B9R1.1 NCC1=NC=C(Br)C=C1 B42983 [1,1,0,0,0,0|2,0,0]=4 742 B9R1.1 NCC1=NC=C(Br)C=C1 B7021 [1,1,0,0,0,0|2,0,0]=4 743 B9R1.1 NCC1=NC=C(Cl)C=C1 C43002 [1,1,0,0,0,0|2,0,0]=4 744 B9R1.1 NCC1=NC=C(Cl)C=C1 C43003 [1,1,0,0,0,0|2,0,0]=4 745 B9R1.1 NCC1=NC=C(N)C=C1 A36932 [1,1,0,0,0,0|2,0,0]=4 746 B9R1.1 NNC1=CC=C(Br)C=C1 B42962 [1,1,0,0,0,0|2,0,0]=4 747 B9R1.1 NNC1=CC=C(Br)C=C1 B42980 [1,1,0,0,0,0|2,0,0]=4 748 B9R1.1 NNC1=CC=C(Cl)C=C1 C61981 [1,1,0,0,0,0|2,0,0]=4 749 B9R1.1 NNC1=CC=C(Cl)C=C1 C68982 [1,1,0,0,0,0|2,0,0]=4 750 B9R1.1 NNC1=CC=C(F)C=C1 F25536 [1,1,0,0,0,0|2,0,0]=4 751 B9R1.1 NNC1=CC=C(I)C=C1 K43029 [1,1,0,0,0,0|2,0,0]=4 752 B9R1.1 O=C1C=CC(CO)=CN1 H37111 [1,1,0,0,0,0|1,0,0]=3 753 B9R1.1 O=CC1=CC=C(Br)C=C1 B67400 [1,1,0,0,0,0|0,0,2]=4 754 B9R1.1 O=CC1=CC=C(Cl)C=C1 C37300 [1,1,0,0,0,0|0,0,2]=4 755 B9R1.1 O=CC1=CC=C(F)C=C1 F4631 [1,1,0,0,0,0|0,0,2]=4 756 B9R1.1 O=CC1=CC=C(I)C=C1 K20170 [1,1,0,0,0,0|0,0,2]=4 757 B9R1.1 OCC1=CC=C(Br)C=C1 B67585 [1,1,0,0,0,0|0,0,0]=2 758 B9R1.1 OCC1=CC=C(Cl)C=C1 C39406 [1,1,0,0,0,0|0,0,0]=2 759 B9R1.1 OCC1=CC=C(F)C=C1 F39409 [1,1,0,0,0,0|0,0,0]=2 760 B9R1.1 OCC1=CC=C(I)C=C1 I36662 [1,1,0,0,0,0|0,0,0]=2 761 B9R1.1 OCC1=CN=C(Br)C=C1 B12392 [1,1,0,0,0,0|1,0,0]=3 762 B9R1.1 OCC1=CN=C(Cl)C=C1 C9389 [1,1,0,0,0,0|1,0,0]=3 763 B9R1.1 OCC1=CN=C(Cl)C=N1 C1534 [1,1,0,0,0,0|2,0,0]=4 764 B9R1.1 OCC1=CN=C(Cl)N=C1 C1532 [1,1,0,0,0,0|2,0,0]=4 765 B9R1.1 OCC1=CN=C(F)C=C1 F13989 [1,1,0,0,0,0|1,0,0]=3 766 B9R1.1 OCC1=NC=C(Br)C=C1 B3203 [1,1,0,0,0,0|1,0,0]=3 767 B9R1.1 OCC1=NC=C(Br)C=N1 B14040 [1,1,0,0,0,0|2,0,0]=4 768 B9R1.1 OCC1=NC=C(Cl)C=C1 C22297 [1,1,0,0,0,0|1,0,0]=3 769 B9R1.1 OCC1=NC=C(Cl)C=N1 C14437 [1,1,0,0,0,0|2,0,0]=4 770 B9R1.1 OCC1=NC=C(F)C=C1 F0644 [1,1,0,0,0,0|1,0,0]=3 771 B9R1.1 OCC1=NC=C(F)C=N1 F11272 [1,1,0,0,0,0|2,0,0]=4 772 B9R1.1 OCC1=NN=C(Cl)C=C1 C14684 [1,1,0,0,0,0|2,0,0]=4 773 B9R1.2 BrCC1=CC(Br)=NC=C1 B36914 [1,1,0,0,0,0|2,0,0]=4 774 B9R1.2 BrCC1=CC(Br)=NC=C1 B42520 [1,1,0,0,0,0|2,0,0]=4 775 B9R1.2 BrCC1=CC=CC(Br)=C1 B39369 [1,1,0,0,0,0|1,0,0]=3 776 B9R1.2 BrCC1=CC=CC(Br)=N1 B42519 [1,1,0,0,0,0|2,0,0]=4 777 B9R1.2 BrCC1=CC=CC(I)=C1 B45170 [1,1,0,0,0,0|1,0,0]=3 778 B9R1.2 C#CC1=CC(C)=CC=C1 E51331 [1,1,0,0,0,0|0,0,2]=4 779 B9R1.2 C#CC1=CC=CC(Br)=C1 B47527 [1,1,0,0,0,0|0,0,2]=4 780 B9R1.2 C#CC1=CC=CC(Cl)=C1 C25303 [1,1,0,0,0,0|0,0,2]=4 781 B9R1.2 C#CC1=CC=CC(F)=C1 F47538 [1,1,0,0,0,0|0,0,2]=4 782 B9R1.2 C#CC1=CC=CC(N)=C1 E48307 [1,1,0,0,0,0|0,0,2]=4 783 B9R1.2 C#CC1=CC=CC(N)=C1 E49598 [1,1,0,0,0,0|0,0,2]=4 784 B9R1.2 C#CC1=CC=CC(O)=C1 E37627 [1,1,0,0,0,0|0,0,2]=4 785 B9R1.2 C=CC1=CC=CC(Br)=C1 B36635 [1,1,0,0,0,0|0,0,2]=4 786 B9R1.2 C=CC1=CC=CC(N)=C1 V49171 [1,1,0,0,0,0|0,0,2]=4 787 B9R1.2 CC1=CC(CCl)=CN=C1 C46109 [1,1,0,0,0,0|2,0,0]=4 788 B9R1.2 CC1=CC(CCl)=NC=C1 C46106 [1,1,0,0,0,0|2,0,0]=4 789 B9R1.2 CC1=CC(CN)=NC=C1 A62602 [1,1,0,0,0,0|2,0,0]=4 790 B9R1.2 CC1=CC(CN)=NC=C1 M46587 [1,1,0,0,0,0|2,0,0]=4 791 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [1,1,0,0,0,0|1,0,0]=3 792 B9R1.2 CC1=CC(CO)=NC=C1 M46387 [1,1,0,0,0,0|1,0,0]=3 793 B9R1.2 CC1=CC(CO)=NC=N1 M11486 [1,1,0,0,0,0|2,0,0]=4 794 B9R1.2 CC1=CC(CO)=NN=C1 M27710 [1,1,0,0,0,0|2,0,0]=4 795 B9R1.2 CC1=CC=CC(CBr)=N1 B46087 [1,1,0,0,0,0|2,0,0]=4 796 B9R1.2 CC1=CC=CC(CCl)=N1 C46103 [1,1,0,0,0,0|2,0,0]=4 797 B9R1.2 CC1=CC=CC(CN)=C1 M37355 [1,1,0,0,0,0|1,0,0]=3 798 B9R1.2 CC1=CC=CC(CN)=N1 M24786 [1,1,0,0,0,0|2,0,0]=4 799 B9R1.2 CC1=CC=CC(CN)=N1 M63579 [1,1,0,0,0,0|2,0,0]=4 800 B9R1.2 CC1=CC=CC(CO)=N1 M46384 [1,1,0,0,0,0|1,0,0]=3 801 B9R1.2 CC1=CC=CC(NN)=C1 M46458 [1,1,0,0,0,0|2,0,0]=4 802 B9R1.2 CC1=CC=NC(CO)=N1 H11472 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.2 CC1=NC=CC(CBr)=C1 B37231 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.2 CC1=NC=CC(CN)=C1 M46586 [1,1,0,0,0,0|2,0,0]=4 805 B9R1.2 CC1=NC=CC(CO)=C1 M4019 [1,1,0,0,0,0|1,0,0]=3 806 B9R1.2 CCC1=CC(=O)NC=N1 E43198 [1,1,0,0,0,0|2,0,0]=4 807 B9R1.2 CCC1=CC(=O)NN=C1 E43197 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.2 CCC1=CC(Br)=CN=C1 B46076 [1,1,0,0,0,0|1,0,0]=3 809 B9R1.2 CCC1=CC(Cl)=NC=N1 C69336 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.2 CCC1=CC(N)=NC=C1 E4696 [1,1,0,0,0,0|1,0,0]=3 811 B9R1.2 CCC1=CC=CC(Br)=C1 B49158 [1,1,0,0,0,0|0,0,0]=2 812 B9R1.2 CCC1=CC=CC(Br)=N1 B46074 [1,1,0,0,0,0|1,0,0]=3 813 B9R1.2 CCC1=CC=CC(N)=C1 E68361 [1,1,0,0,0,0|0,0,0]=2 814 B9R1.2 CCC1=CC=CC(N)=N1 E43601 [1,1,0,0,0,0|1,0,0]=3 815 B9R1.2 CCC1=CC=CC([Mg+])=C1 E31740 [1,1,0,0,0,0|0,0,0]=2 816 B9R1.2 CCC1=CN=CC(N)=C1 E37485 [1,1,0,0,0,0|1,0,0]=3 817 B9R1.2 CCC1=NC=CC(Br)=C1 B46078 [1,1,0,0,0,0|1,0,0]=3 818 B9R1.2 CCC1=NC=CC(Cl)=N1 C29661 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.2 CCC1=NC=CC(N)=C1 A15478 [1,1,0,0,0,0|1,0,0]=3 820 B9R1.2 CNC1=CC(Br)=NC=C1 B25633 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [1,1,0,0,0,0|1,0,0]=3 822 B9R1.2 CNC1=CC=CC(Br)=C1 B46077 [1,1,0,0,0,0|1,0,0]=3 823 B9R1.2 CNC1=CC=CC(Br)=C1 B66504 [1,1,0,0,0,0|1,0,0]=3 824 B9R1.2 CNC1=CC=CC(Cl)=N1 C43001 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.2 CNC1=NC(C)=CC=C1 D43615 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.2 CNC1=NC=CC(Br)=C1 B23788 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.2 CNC1=NC=CC(N)=C1 M43544 [1,1,0,0,0,0|2,0,0]=4 828 B9R1.2 COC1=CC(=O)NC=C1 M43139 [1,1,0,0,0,0|2,0,0]=4 829 B9R1.2 COC1=CC(Br)=CN=C1 B2876 [1,1,0,0,0,0|2,0,0]=4 830 B9R1.2 COC1=CC(Br)=NC=C1 B9053 [1,1,0,0,0,0|2,0,0]=4 831 B9R1.2 COC1=CC(C)=NC=C1 M22575 [1,1,0,0,0,0|2,0,0]=4 832 B9R1.2 COC1=CC(Cl)=NC=C1 C5269 [1,1,0,0,0,0|2,0,0]=4 833 B9R1.2 COC1=CC(F)=NC=C1 F21874 [1,1,0,0,0,0|2,0,0]=4 834 B9R1.2 COC1=CC(N)=NC=C1 A43189 [1,1,0,0,0,0|2,0,0]=4 835 B9R1.2 COC1=CC(O)=CC=C1 M27960 [1,1,0,0,0,0|1,0,0]=3 836 B9R1.2 COC1=CC=CC(Br)=N1 B2785 [1,1,0,0,0,0|2,0,0]=4 837 B9R1.2 COC1=CC=CC(Cl)=N1 C39269 [1,1,0,0,0,0|2,0,0]=4 838 B9R1.2 COC1=CC=CC(F)=C1 F45965 [1,1,0,0,0,0|1,0,0]=3 839 B9R1.2 COC1=CC=CC(F)=N1 F67375 [1,1,0,0,0,0|2,0,0]=4 840 B9R1.2 COC1=CC=CC(I)=C1 K45966 [1,1,0,0,0,0|1,0,0]=3 841 B9R1.2 COC1=CC=CC(I)=N1 K42932 [1,1,0,0,0,0|2,0,0]=4 842 B9R1.2 COC1=CC=CC([Mg+])=C1 M31743 [1,1,0,0,0,0|1,0,0]=3 843 B9R1.2 COC1=CN=CC(N)=C1 A14114 [1,1,0,0,0,0|2,0,0]=4 844 B9R1.2 COC1=CN=CC(N)=C1 A7930 [1,1,0,0,0,0|2,0,0]=4 845 B9R1.2 COC1=CN=CC(O)=C1 M43136 [1,1,0,0,0,0|2,0,0]=4 846 B9R1.2 COC1=NC(C)=CC=C1 M46380 [1,1,0,0,0,0|2,0,0]=4 847 B9R1.2 COC1=NC(N)=CC=C1 A43190 [1,1,0,0,0,0|2,0,0]=4 848 B9R1.2 COC1=NC=CC(Br)=C1 B3113 [1,1,0,0,0,0|2,0,0]=4 849 B9R1.2 COC1=NC=CC(C)=C1 M46379 [1,1,0,0,0,0|2,0,0]=4 850 B9R1.2 COC1=NC=CC(Cl)=C1 C42902 [1,1,0,0,0,0|2,0,0]=4 851 B9R1.2 COC1=NC=CC(F)=C1 F42927 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.2 COC1=NC=CC(I)=C1 K60534 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.2 COC1=NC=CC(N)=C1 M3947 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.2 COC1=NC=CC(O)=C1 M38428 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.2 CSC1=CC(N)=CC=C1 M46442 [1,1,0,0,0,0|1,0,0]=3 856 B9R1.2 CSC1=CC=CC(Br)=C1 B45613 [1,1,0,0,0,0|1,0,0]=3 857 B9R1.2 CSC1=CC=CC(Br)=N1 B2786 [1,1,0,0,0,0|2,0,0]=4 858 B9R1.2 CSC1=NC=CC(Cl)=C1 C42846 [1,1,0,0,0,0|2,0,0]=4 859 B9R1.2 ClC1=CC=CC(CBr)=C1 B39371 [1,1,0,0,0,0|1,0,0]=3 860 B9R1.2 ClC1=NC=CC(CBr)=C1 B42538 [1,1,0,0,0,0|2,0,0]=4 861 B9R1.2 ClCC1=CC(Br)=CN=C1 B15185 [1,1,0,0,0,0|2,0,0]=4 862 B9R1.2 ClCC1=CC(Cl)=CN=C1 C1777 [1,1,0,0,0,0|2,0,0]=4 863 B9R1.2 ClCC1=CC(Cl)=NC=C1 C12077 [1,1,0,0,0,0|2,0,0]=4 864 B9R1.2 ClCC1=CC=CC(Br)=C1 B45159 [1,1,0,0,0,0|1,0,0]=3 865 B9R1.2 ClCC1=CC=CC(Br)=N1 B27809 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.2 ClCC1=CC=CC(Cl)=N1 C42562 [1,1,0,0,0,0|2,0,0]=4 867 B9R1.2 ClCC1=CC=CC(I)=C1 C45183 [1,1,0,0,0,0|1,0,0]=3 868 B9R1.2 ClCC1=NC=CC(Cl)=C1 C32395 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.2 FC1=CC(CBr)=CN=C1 B37165 [1,1,0,0,0,0|2,0,0]=4 870 B9R1.2 FC1=CC(CCl)=CN=C1 C1821 [1,1,0,0,0,0|2,0,0]=4 871 B9R1.2 FC1=CC=CC(CBr)=C1 B45165 [1,1,0,0,0,0|1,0,0]=3 872 B9R1.2 FC1=CC=CC(CBr)=N1 B42547 [1,1,0,0,0,0|2,0,0]=4 873 B9R1.2 FC1=CC=CC(CCl)=N1 C42570 [1,1,0,0,0,0|2,0,0]=4 874 B9R1.2 N#CC1=CC=CC(Br)=C1 B67572 [1,1,0,0,0,0|1,0,1]=4 875 B9R1.2 N#CC1=CC=CC(Cl)=C1 C39326 [1,1,0,0,0,0|1,0,1]=4 876 B9R1.2 N#CC1=CC=CC(F)=C1 F39329 [1,1,0,0,0,0|1,0,1]=4 877 B9R1.2 N#CC1=CC=CC(I)=C1 K44442 [1,1,0,0,0,0|1,0,1]=4 878 B9R1.2 N#CC1=CC=CC(O)=C1 H64947 [1,1,0,0,0,0|1,0,1]=4 879 B9R1.2 NC1=CC(CO)=CN=C1 A43207 [1,1,0,0,0,0|1,0,0]=3 880 B9R1.2 NC1=CC(CO)=NC=C1 A15900 [1,1,0,0,0,0|1,0,0]=3 881 B9R1.2 NC1=CC=CC(C=O)=C1 A46548 [1,1,0,0,0,0|0,0,2]=4 882 B9R1.2 NC1=CC=CC(CO)=C1 A37868 [1,1,0,0,0,0|0,0,0]=2 883 B9R1.2 NC1=CC=CC(CO)=N1 A43208 [1,1,0,0,0,0|1,0,0]=3 884 B9R1.2 NC1=NC=CC(CO)=C1 A10460 [1,1,0,0,0,0|1,0,0]=3 885 B9R1.2 NC1=NC=CC(CO)=N1 A38214 [1,1,0,0,0,0|2,0,0]=4 886 B9R1.2 NCC1=CC(=O)NC=C1 A1717 [1,1,0,0,0,0|2,0,0]=4 887 B9R1.2 NCC1=CC(Br)=NC=C1 B25759 [1,1,0,0,0,0|2,0,0]=4 888 B9R1.2 NCC1=CC(Cl)=NC=C1 A10467 [1,1,0,0,0,0|2,0,0]=4 889 B9R1.2 NCC1=CC(Cl)=NC=C1 C30000 [1,1,0,0,0,0|2,0,0]=4 890 B9R1.2 NCC1=CC(F)=CN=C1 F5829 [1,1,0,0,0,0|2,0,0]=4 891 B9R1.2 NCC1=CC(F)=NC=C1 F43572 [1,1,0,0,0,0|2,0,0]=4 892 B9R1.2 NCC1=CC(F)=NC=C1 F61414 [1,1,0,0,0,0|2,0,0]=4 893 B9R1.2 NCC1=CC(N)=NC=C1 A43343 [1,1,0,0,0,0|2,0,0]=4 894 B9R1.2 NCC1=CC=CC(Br)=C1 B46079 [1,1,0,0,0,0|1,0,0]=3 895 B9R1.2 NCC1=CC=CC(Br)=N1 B42981 [1,1,0,0,0,0|2,0,0]=4 896 B9R1.2 NCC1=CC=CC(Cl)=C1 C46098 [1,1,0,0,0,0|1,0,0]=3 897 B9R1.2 NCC1=CC=CC(Cl)=N1 C43006 [1,1,0,0,0,0|2,0,0]=4 898 B9R1.2 NCC1=CC=CC(F)=C1 F15968 [1,1,0,0,0,0|1,0,0]=3 899 B9R1.2 NCC1=CC=CC(I)=C1 K46122 [1,1,0,0,0,0|1,0,0]=3 900 B9R1.2 NCC1=CC=CC(N)=C1 A43599 [1,1,0,0,0,0|1,0,0]=3 901 B9R1.2 NCC1=NC=CC(Br)=C1 A1747 [1,1,0,0,0,0|2,0,0]=4 902 B9R1.2 NCC1=NC=CC(Br)=C1 B42982 [1,1,0,0,0,0|2,0,0]=4 903 B9R1.2 NCC1=NC=CC(Cl)=C1 A14281 [1,1,0,0,0,0|2,0,0]=4 904 B9R1.2 NCC1=NC=CC(F)=C1 F43529 [1,1,0,0,0,0|2,0,0]=4 905 B9R1.2 NNC1=CC=CC(Br)=C1 B42979 [1,1,0,0,0,0|2,0,0]=4 906 B9R1.2 NNC1=CC=CC(F)=C1 F43527 [1,1,0,0,0,0|2,0,0]=4 907 B9R1.2 O=C1C=C(CO)C=CN1 H0460 [1,1,0,0,0,0|1,0,0]=3 908 B9R1.2 O=C1C=CC=C(CO)N1 H23237 [1,1,0,0,0,0|1,0,0]=3 909 B9R1.2 O=CC1=CC(O)=CC=C1 H15969 [1,1,0,0,0,0|0,0,2]=4 910 B9R1.2 O=CC1=CC=CC(Br)=C1 B68146 [1,1,0,0,0,0|0,0,2]=4 911 B9R1.2 O=CC1=CC=CC(Cl)=C1 C69283 [1,1,0,0,0,0|0,0,2]=4 912 B9R1.2 O=CC1=CC=CC(F)=C1 F45149 [1,1,0,0,0,0|0,0,2]=4 913 B9R1.2 O=CC1=CC=CC(I)=C1 K45152 [1,1,0,0,0,0|0,0,2]=4 914 B9R1.2 OC1=CC=CC(CBr)=C1 B38962 [1,1,0,0,0,0|1,0,0]=3 915 B9R1.2 OCC1=CC(Br)=CN=C1 B12503 [1,1,0,0,0,0|1,0,0]=3 916 B9R1.2 OCC1=CC(Br)=NC=C1 B42880 [1,1,0,0,0,0|1,0,0]=3 917 B9R1.2 OCC1=CC(Cl)=CN=C1 C42912 [1,1,0,0,0,0|1,0,0]=3 918 B9R1.2 OCC1=CC(Cl)=NC=C1 C12733 [1,1,0,0,0,0|1,0,0]=3 919 B9R1.2 OCC1=CC(Cl)=NC=N1 C11372 [1,1,0,0,0,0|2,0,0]=4 920 B9R1.2 OCC1=CC(F)=CN=C1 F0704 [1,1,0,0,0,0|1,0,0]=3 921 B9R1.2 OCC1=CC(O)=CN=C1 H39124 [1,1,0,0,0,0|1,0,0]=3 922 B9R1.2 OCC1=CC=CC(Br)=N1 B12271 [1,1,0,0,0,0|1,0,0]=3 923 B9R1.2 OCC1=CC=CC(Cl)=C1 C39405 [1,1,0,0,0,0|0,0,0]=2 924 B9R1.2 OCC1=CC=CC(Cl)=N1 C38619 [1,1,0,0,0,0|1,0,0]=3 925 B9R1.2 OCC1=CC=CC(Cl)=N1 C42916 [1,1,0,0,0,0|1,0,0]=3 926 B9R1.2 OCC1=CC=CC(F)=C1 F39408 [1,1,0,0,0,0|0,0,0]=2 927 B9R1.2 OCC1=CC=CC(F)=N1 F67771 [1,1,0,0,0,0|1,0,0]=3 928 B9R1.2 OCC1=CC=CC(I)=C1 H61971 [1,1,0,0,0,0|0,0,0]=2 929 B9R1.2 OCC1=CN=CC(Br)=N1 B40916 [1,1,0,0,0,0|2,0,0]=4 930 B9R1.2 OCC1=CN=CC(Cl)=N1 C14609 [1,1,0,0,0,0|2,0,0]=4 931 B9R1.2 OCC1=NC=CC(Br)=C1 B0602 [1,1,0,0,0,0|1,0,0]=3 932 B9R1.2 OCC1=NC=CC(Cl)=C1 C12436 [1,1,0,0,0,0|1,0,0]=3 933 B9R1.2 OCC1=NC=CC(F)=C1 F37340 [1,1,0,0,0,0|1,0,0]=3 934 B9R1.8 BrCCC1=CC=NC=C1 B46088 [1,1,0,0,0,0|1,0,0]=3 935 B9R1.8 CC#CC1=CC=CC=C1 P68608 [1,1,0,0,0,0|0,0,1]=3 936 B9R1.8 CCCC1=NC=CC=C1 P46859 [1,1,0,0,0,0|1,0,0]=3 937 B9R1.8 CCCC1=NC=CN=C1 P43598 [1,1,0,0,0,0|2,0,0]=4 938 B9R1.8 CCNC1=NC=CN=C1 E43330 [1,1,0,0,0,0|2,0,0]=4 939 B9R1.8 CCOC1=NC=CC=C1 E46369 [1,1,0,0,0,0|1,0,0]=3 940 B9R1.8 CNCC1=CC=NC=C1 M43623 [1,1,0,0,0,0|1,0,0]=3 941 B9R1.8 CNCC1=CN=CN=C1 N11436 [1,1,0,0,0,0|2,0,0]=4 942 B9R1.8 CNCC1=CN=NC=C1 M12238 [1,1,0,0,0,0|2,0,0]=4 943 B9R1.8 CNCC1=CN=NC=C1 M27035 [1,1,0,0,0,0|2,0,0]=4 944 B9R1.8 CNCC1=NC=CC=N1 M14362 [1,1,0,0,0,0|2,0,0]=4 945 B9R1.8 CNCC1=NC=CC=N1 M31227 [1,1,0,0,0,0|2,0,0]=4 946 B9R1.8 CNCC1=NC=CN=C1 M14584 [1,1,0,0,0,0|2,0,0]=4 947 B9R1.8 CNNC1=CC=CC=C1 M46459 [1,1,0,0,0,0|1,0,0]=3 948 B9R1.8 COCC1=NC=CC=C1 M46377 [1,1,0,0,0,0|1,0,0]=3 949 B9R1.8 C\C=C\C1=CC=CC=C1 P62367 [1,1,0,0,0,0|0,0,1]=3 950 B9R1.8 IC#CC1=CC=CC=C1 I1886 [1,1,0,0,0,0|0,0,2]=4 951 B9R1.8 N#CCC1=CN=CC=C1 P38543 [1,1,0,0,0,0|1,0,1]=4 952 B9R1.8 N#CCC1=NC=CC=C1 P45196 [1,1,0,0,0,0|1,0,1]=4 953 B9R1.8 N#COC1=CC=CC=C1 P44923 [1,1,0,0,0,0|1,0,1]=4 954 B9R1.8 NCCC1=CC=CN=C1 P43605 [1,1,0,0,0,0|1,0,0]=3 955 B9R1.8 NCCC1=NC=CC=C1 P67673 [1,1,0,0,0,0|1,0,0]=3 956 B9R1.8 NCCC1=NC=NC=C1 P14666 [1,1,0,0,0,0|2,0,0]=4 957 B9R1.8 NCCC1=NC=NC=C1 P29961 [1,1,0,0,0,0|2,0,0]=4 958 B9R1.8 NNCC1=CC=CC=C1 B6123 [1,1,0,0,0,0|1,0,0]=3 959 B9R1.8 NNCC1=CC=CC=C1 B68081 [1,1,0,0,0,0|1,0,0]=3 960 B9R1.8 NNCC1=CC=CN=C1 H0097 [1,1,0,0,0,0|2,0,0]=4 961 B9R1.8 NNCC1=CC=CN=C1 H36962 [1,1,0,0,0,0|2,0,0]=4 962 B9R1.8 NNCC1=CC=NC=C1 H0096 [1,1,0,0,0,0|2,0,0]=4 963 B9R1.8 NNCC1=CC=NC=C1 H26285 [1,1,0,0,0,0|2,0,0]=4 964 B9R1.8 NNCC1=NC=CC=C1 H0098 [1,1,0,0,0,0|2,0,0]=4 965 B9R1.8 NOCC1=CC=CC=C1 B68114 [1,1,0,0,0,0|0,0,0]=2 966 B9R1.8 O=COC1=CC=CC=C1 P45508 [1,1,0,0,0,0|0,0,2]=4 967 B9R1.8 OCCC1=CC=NC=C1 H46381 [1,1,0,0,0,0|1,0,0]=3 968 B9R1.8 OCCC1=CN=CC=C1 P46376 [1,1,0,0,0,0|1,0,0]=3 969 B9R1.8 OCCC1=NC=CN=C1 P24824 [1,1,0,0,0,0|2,0,0]=4 970 B9R1.8 ONCC1=CC=CC=C1 B36744 [1,1,0,0,0,0|0,0,0]=2 971 B9R1.8 ONCC1=CC=CC=C1 B46575 [1,1,0,0,0,0|0,0,0]=2 972 B9R1.8 O\N=C\C1=CC=CC=C1 B61148 [1,1,0,0,0,0|0,0,1]=3 973 B9R1.8 S=C=NC1=CC=CC=C1 T64712 [1,1,0,0,0,0|0,1,1]=4 974 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B66761 [1,1,0,0,0,0|0,0,1]=3 975 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [1,1,0,0,0,0|0,0,0]=2 976 B9R1.15 BrCC1=C(Br)C=CC=N1 B32048 [1,1,0,0,0,0|2,0,0]=4 977 B9R1.15 BrCC1=C(I)C=CC=C1 B37896 [1,1,0,0,0,0|1,0,0]=3 978 B9R1.15 C#CC1=C(Br)C=CC=C1 B38613 [1,1,0,0,0,0|0,0,2]=4 979 B9R1.15 C#CC1=C(Cl)C=CC=C1 C38576 [1,1,0,0,0,0|0,0,2]=4 980 B9R1.15 C#CC1=C(F)C=CC=C1 E47539 [1,1,0,0,0,0|0,0,2]=4 981 B9R1.15 C#CC1=C(N)C=CC=C1 E24087 [1,1,0,0,0,0|0,0,2]=4 982 B9R1.15 C#CC1=C(O)C=CC=C1 E48112 [1,1,0,0,0,0|0,0,2]=4 983 B9R1.15 C=CC1=C(Br)C=CC=C1 B48296 [1,1,0,0,0,0|0,0,2]=4 984 B9R1.15 C=CC1=C(Cl)C=CC=C1 C48303 [1,1,0,0,0,0|0,0,2]=4 985 B9R1.15 C=CC1=C(N)C=CC=C1 V36733 [1,1,0,0,0,0|0,0,2]=4 986 B9R1.15 CC1=C(CBr)C=CC=N1 B15311 [1,1,0,0,0,0|2,0,0]=4 987 B9R1.15 CC1=C(CBr)C=NC=C1 B37536 [1,1,0,0,0,0|2,0,0]=4 988 B9R1.15 CC1=C(CCl)C=CC=N1 C14756 [1,1,0,0,0,0|2,0,0]=4 989 B9R1.15 CC1=C(CCl)C=CN=C1 C13917 [1,1,0,0,0,0|2,0,0]=4 990 B9R1.15 CC1=C(CCl)C=CN=C1 C46110 [1,1,0,0,0,0|2,0,0]=4 991 B9R1.15 CC1=C(CCl)C=NC=C1 C14757 [1,1,0,0,0,0|2,0,0]=4 992 B9R1.15 CC1=C(CCl)C=NC=C1 C46108 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.15 CC1=C(CN)C=CC=C1 M65907 [1,1,0,0,0,0|1,0,0]=3 994 B9R1.15 CC1=C(CN)C=NC=C1 A11511 [1,1,0,0,0,0|2,0,0]=4 995 B9R1.15 CC1=C(CO)C=CN=C1 H1761 [1,1,0,0,0,0|1,0,0]=3 996 B9R1.15 CC1=C(CO)C=CN=N1 M63840 [1,1,0,0,0,0|2,0,0]=4 997 B9R1.15 CC1=C(CO)C=NC=C1 H11512 [1,1,0,0,0,0|1,0,0]=3 998 B9R1.15 CC1=C(NN)C=CC=C1 T39424 [1,1,0,0,0,0|2,0,0]=4 999 B9R1.15 CC1=CC=CN=C1CCl C14758 [1,1,0,0,0,0|2,0,0]=4 1000 B9R1.15 CC1=CC=CN=C1CCl C46105 [1,1,0,0,0,0|2,0,0]=4 1001 B9R1.15 CC1=CC=CN=C1CN M46460 [1,1,0,0,0,0|2,0,0]=4 1002 B9R1.15 CC1=CC=CN=C1CO H46388 [1,1,0,0,0,0|1,0,0]=3 1003 B9R1.15 CC1=NC=CN=C1CO H14616 [1,1,0,0,0,0|2,0,0]=4 1004 B9R1.15 CCC1=C(Br)C=CC=C1 B68946 [1,1,0,0,0,0|0,0,0]=2 1005 B9R1.15 CCC1=C(Br)C=CC=N1 B23432 [1,1,0,0,0,0|1,0,0]=3 1006 B9R1.15 CCC1=C(Br)C=CN=C1 B10961 [1,1,0,0,0,0|1,0,0]=3 1007 B9R1.15 CCC1=C(Br)C=CN=C1 B30062 [1,1,0,0,0,0|1,0,0]=3 1008 B9R1.15 CCC1=C(Br)C=NC=C1 B23431 [1,1,0,0,0,0|1,0,0]=3 1009 B9R1.15 CCC1=C(Br)C=NC=N1 B42964 [1,1,0,0,0,0|2,0,0]=4 1010 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [1,1,0,0,0,0|0,0,0]=2 1011 B9R1.15 CCC1=C(F)C=NC=N1 E0673 [1,1,0,0,0,0|2,0,0]=4 1012 B9R1.15 CCC1=C([Mg+])C=CC=C1 E31738 [1,1,0,0,0,0|0,0,0]=2 1013 B9R1.15 CCC1=CC=NNC1=O E43195 [1,1,0,0,0,0|2,0,0]=4 1014 B9R1.15 CCC1=CN=CN=C1Cl C42985 [1,1,0,0,0,0|2,0,0]=4 1015 B9R1.15 CCC1=NC=CN=C1C E43603 [1,1,0,0,0,0|2,0,0]=4 1016 B9R1.15 CCC1=NC=CN=C1Cl C38966 [1,1,0,0,0,0|2,0,0]=4 1017 B9R1.15 CCC1=NC=CN=C1N E43328 [1,1,0,0,0,0|2,0,0]=4 1018 B9R1.15 CCC1=NC=CNC1=O E43188 [1,1,0,0,0,0|2,0,0]=4 1019 B9R1.15 CC[N+]1=C(Br)C=CC=C1 B46367 [1,1,0,0,0,0|1,0,0]=3 1020 B9R1.15 CNC1=C(Br)C=CC=C1 B46075 [1,1,0,0,0,0|1,0,0]=3 1021 B9R1.15 CNC1=C(C)C=CC=C1 D46860 [1,1,0,0,0,0|1,0,0]=3 1022 B9R1.15 CNC1=C(C)C=CN=C1 D67183 [1,1,0,0,0,0|2,0,0]=4 1023 B9R1.15 CNC1=C(Cl)C=CC=C1 C46094 [1,1,0,0,0,0|1,0,0]=3 1024 B9R1.15 CNC1=C(Cl)C=CC=N1 C42995 [1,1,0,0,0,0|2,0,0]=4 1025 B9R1.15 CNC1=C(F)C=CC=C1 M39414 [1,1,0,0,0,0|1,0,0]=3 1026 B9R1.15 CNC1=C(N)C=CC=C1 M43618 [1,1,0,0,0,0|1,0,0]=3 1027 B9R1.15 CNC1=C(N)C=CC=C1 M68814 [1,1,0,0,0,0|1,0,0]=3 1028 B9R1.15 CNC1=C(N)C=CN=C1 M62812 [1,1,0,0,0,0|2,0,0]=4 1029 B9R1.15 CNC1=C(O)C=CC=C1 M64657 [1,1,0,0,0,0|1,0,0]=3 1030 B9R1.15 CNC1=CC=CN=C1Cl C42994 [1,1,0,0,0,0|2,0,0]=4 1031 B9R1.15 CNC1=CC=CN=C1N M62813 [1,1,0,0,0,0|2,0,0]=4 1032 B9R1.15 CNC1=NC=CC=C1N M43341 [1,1,0,0,0,0|2,0,0]=4 1033 B9R1.15 COC1=C(Br)C=CC=C1 B67901 [1,1,0,0,0,0|1,0,0]=3 1034 B9R1.15 COC1=C(Br)C=CC=N1 B12855 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.15 COC1=C(Br)C=CN=C1 B61080 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.15 COC1=C(Br)C=NC=C1 B9421 [1,1,0,0,0,0|2,0,0]=4 1037 B9R1.15 COC1=C(Cl)C=CC=N1 C42900 [1,1,0,0,0,0|2,0,0]=4 1038 B9R1.15 COC1=C(Cl)C=NC=C1 C42901 [1,1,0,0,0,0|2,0,0]=4 1039 B9R1.15 COC1=C(F)C=CC=N1 F42926 [1,1,0,0,0,0|2,0,0]=4 1040 B9R1.15 COC1=C(I)C=CC=C1 K68160 [1,1,0,0,0,0|1,0,0]=3 1041 B9R1.15 COC1=C(I)C=CC=N1 K42933 [1,1,0,0,0,0|2,0,0]=4 1042 B9R1.15 COC1=C(I)C=NC=C1 K42934 [1,1,0,0,0,0|2,0,0]=4 1043 B9R1.15 COC1=C(N)C=NC=C1 A43191 [1,1,0,0,0,0|2,0,0]=4 1044 B9R1.15 COC1=C(N)N=CC=C1 A69248 [1,1,0,0,0,0|2,0,0]=4 1045 B9R1.15 COC1=C([Mg+])C=CC=C1 M31742 [1,1,0,0,0,0|1,0,0]=3 1046 B9R1.15 COC1=CC=CN=C1Br B4536 [1,1,0,0,0,0|2,0,0]=4 1047 B9R1.15 COC1=CC=CN=C1Cl C24085 [1,1,0,0,0,0|2,0,0]=4 1048 B9R1.15 COC1=CC=CN=C1F F42924 [1,1,0,0,0,0|2,0,0]=4 1049 B9R1.15 COC1=CC=CN=C1I K62151 [1,1,0,0,0,0|2,0,0]=4 1050 B9R1.15 COC1=NC=CC=C1C M46378 [1,1,0,0,0,0|2,0,0]=4 1051 B9R1.15 COC1=NC=CC=C1N A12743 [1,1,0,0,0,0|2,0,0]=4 1052 B9R1.15 CSC1=C(F)N=CC=C1 F42849 [1,1,0,0,0,0|2,0,0]=4 1053 B9R1.15 CSC1=C([Mg+])C=CC=C1 M31770 [1,1,0,0,0,0|1,0,0]=3 1054 B9R1.15 ClCC1=C(Br)C=CC=N1 B42529 [1,1,0,0,0,0|2,0,0]=4 1055 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42563 [1,1,0,0,0,0|2,0,0]=4 1056 B9R1.15 ClCC1=C(Cl)C=CC=N1 C42564 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.15 ClCC1=CC=CN=C1Cl C7688 [1,1,0,0,0,0|2,0,0]=4 1058 B9R1.15 FC1=C(C[Mg+])C=CC=C1 F6778 [1,1,0,0,0,0|1,0,0]=3 1059 B9R1.15 FC1=CC=CN=C1CBr B19661 [1,1,0,0,0,0|2,0,0]=4 1060 B9R1.15 FC1=CC=CN=C1CBr B7783 [1,1,0,0,0,0|2,0,0]=4 1061 B9R1.15 FC1=CC=CN=C1CCl C13988 [1,1,0,0,0,0|2,0,0]=4 1062 B9R1.15 N#CC1=C(Br)C=CC=C1 B67862 [1,1,0,0,0,0|1,0,1]=4 1063 B9R1.15 N#CC1=C(F)C=CC=C1 F68598 [1,1,0,0,0,0|1,0,1]=4 1064 B9R1.15 N#CC1=C(I)C=CC=C1 K44441 [1,1,0,0,0,0|1,0,1]=4 1065 B9R1.15 N#CC1=C(N)C=CC=C1 A68606 [1,1,0,0,0,0|1,0,1]=4 1066 B9R1.15 N#CC1=C(O)C=CC=C1 H68602 [1,1,0,0,0,0|1,0,1]=4 1067 B9R1.15 NC1=C(C=O)C=CC=C1 A32220 [1,1,0,0,0,0|0,0,2]=4 1068 B9R1.15 NC1=C(CO)C=CC=C1 A7795 [1,1,0,0,0,0|0,0,0]=2 1069 B9R1.15 NC1=C(CO)C=CC=N1 A12467 [1,1,0,0,0,0|1,0,0]=3 1070 B9R1.15 NC1=CC=CN=C1CO A24069 [1,1,0,0,0,0|1,0,0]=3 1071 B9R1.15 NCC1=C(Br)C=CC=C1 B36643 [1,1,0,0,0,0|1,0,0]=3 1072 B9R1.15 NCC1=C(Br)C=CN=C1 B63849 [1,1,0,0,0,0|2,0,0]=4 1073 B9R1.15 NCC1=C(Br)C=NC=C1 B36920 [1,1,0,0,0,0|2,0,0]=4 1074 B9R1.15 NCC1=C(Cl)C=CC=C1 C46097 [1,1,0,0,0,0|1,0,0]=3 1075 B9R1.15 NCC1=C(Cl)C=CC=C1 C46104 [1,1,0,0,0,0|1,0,0]=3 1076 B9R1.15 NCC1=C(Cl)C=CC=N1 A14307 [1,1,0,0,0,0|2,0,0]=4 1077 B9R1.15 NCC1=C(Cl)C=CC=N1 C29809 [1,1,0,0,0,0|2,0,0]=4 1078 B9R1.15 NCC1=C(F)C=CC=C1 F26320 [1,1,0,0,0,0|1,0,0]=3 1079 B9R1.15 NCC1=C(F)C=CC=N1 A12648 [1,1,0,0,0,0|2,0,0]=4 1080 B9R1.15 NCC1=C(F)C=CC=N1 A1712 [1,1,0,0,0,0|2,0,0]=4 1081 B9R1.15 NCC1=C(F)C=CC=N1 F61824 [1,1,0,0,0,0|2,0,0]=4 1082 B9R1.15 NCC1=C(F)C=NC=C1 F9408 [1,1,0,0,0,0|2,0,0]=4 1083 B9R1.15 NCC1=C(I)C=CC=C1 I36799 [1,1,0,0,0,0|1,0,0]=3 1084 B9R1.15 NCC1=C(O)C=CC=C1 A38718 [1,1,0,0,0,0|1,0,0]=3 1085 B9R1.15 NCC1=C(O)C=CC=C1 A46574 [1,1,0,0,0,0|1,0,0]=3 1086 B9R1.15 NCC1=C(O)C=CC=N1 A43199 [1,1,0,0,0,0|2,0,0]=4 1087 B9R1.15 NCC1=C(O)C=NC=C1 A43200 [1,1,0,0,0,0|2,0,0]=4 1088 B9R1.15 NCC1=CC=CN=C1Cl A10464 [1,1,0,0,0,0|2,0,0]=4 1089 B9R1.15 NCC1=CC=CN=C1F F43528 [1,1,0,0,0,0|2,0,0]=4 1090 B9R1.15 NNC1=C(Br)C=CC=C1 B39273 [1,1,0,0,0,0|2,0,0]=4 1091 B9R1.15 NNC1=C(Cl)C=CC=C1 C39274 [1,1,0,0,0,0|2,0,0]=4 1092 B9R1.15 NNC1=C(F)C=CC=C1 F39286 [1,1,0,0,0,0|2,0,0]=4 1093 B9R1.15 NNC1=C(I)C=CC=C1 K43028 [1,1,0,0,0,0|2,0,0]=4 1094 B9R1.15 O=CC1=C(Br)C=CC=C1 B38420 [1,1,0,0,0,0|0,0,2]=4 1095 B9R1.15 O=CC1=C(Cl)C=CC=C1 C67575 [1,1,0,0,0,0|0,0,2]=4 1096 B9R1.15 O=CC1=C(F)C=CC=C1 F68099 [1,1,0,0,0,0|0,0,2]=4 1097 B9R1.15 O=CC1=C(I)C=CC=C1 I0665 [1,1,0,0,0,0|0,0,2]=4 1098 B9R1.15 OCC1=C(Br)C=CC=C1 B39402 [1,1,0,0,0,0|0,0,0]=2 1099 B9R1.15 OCC1=C(Br)C=CC=N1 B42889 [1,1,0,0,0,0|1,0,0]=3 1100 B9R1.15 OCC1=C(Br)C=NC=C1 B9966 [1,1,0,0,0,0|1,0,0]=3 1101 B9R1.15 OCC1=C(Cl)C=CC=C1 C68885 [1,1,0,0,0,0|0,0,0]=2 1102 B9R1.15 OCC1=C(Cl)C=CC=N1 C42910 [1,1,0,0,0,0|1,0,0]=3 1103 B9R1.15 OCC1=C(Cl)C=CN=C1 C42911 [1,1,0,0,0,0|1,0,0]=3 1104 B9R1.15 OCC1=C(Cl)C=CN=C1 C42915 [1,1,0,0,0,0|1,0,0]=3 1105 B9R1.15 OCC1=C(F)C=CC=C1 F39407 [1,1,0,0,0,0|0,0,0]=2 1106 B9R1.15 OCC1=C(F)C=CC=N1 F1706 [1,1,0,0,0,0|1,0,0]=3 1107 B9R1.15 OCC1=C(F)C=CN=C1 F30083 [1,1,0,0,0,0|1,0,0]=3 1108 B9R1.15 OCC1=C(F)C=NC=C1 F10404 [1,1,0,0,0,0|1,0,0]=3 1109 B9R1.15 OCC1=C(I)C=CC=C1 K45967 [1,1,0,0,0,0|0,0,0]=2 1110 B9R1.15 OCC1=C(O)C=CC=N1 H60848 [1,1,0,0,0,0|1,0,0]=3 1111 B9R1.15 OCC1=CC=CN=C1Br B69414 [1,1,0,0,0,0|1,0,0]=3 1112 B9R1.15 OCC1=CC=CN=C1Cl C0580 [1,1,0,0,0,0|1,0,0]=3 1113 B9R1.15 OCC1=CC=CN=C1F F42930 [1,1,0,0,0,0|1,0,0]=3 1114 B9R1.15 OCC1=NC=CN=C1Cl C1612 [1,1,0,0,0,0|2,0,0]=4 1115 B9R1.11 N[C@@H](CO)C1=CC=CS1 A43554 [0,1,0,0,1,0|2,0,0]=4 1116 B9R1.19 CC(C)(O)C1=NC=CS1 D5833 [0,1,0,0,1,0|2,0,0]=4 1117 B9R1.35 C[C@H](O)C1=CN(C)C=N1 M0652 [0,1,0,0,1,0|2,0,0]=4 1118 B9R1.35 C[C@H](O)C1=CSC(Cl)=C1 C7957 [0,1,0,0,1,0|1,0,0]=3 1119 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 B52021 [0,1,0,0,0,1|0,0,2]=4 1120 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 C52036 [0,1,0,0,0,1|0,0,2]=4 1121 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 F52043 [0,1,0,0,0,1|0,0,2]=4 1122 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 A66708 [0,1,0,0,0,1|0,0,2]=4 1123 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 A64153 [0,1,0,0,0,1|0,0,2]=4 1124 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 B52869 [0,1,0,0,0,1|1,0,0]=3 1125 B11R1.20 CC(C)NC1=CC=C(F)C=C1 F50250 [0,1,0,0,0,1|1,0,0]=3 1126 B11R1.20 CC(C)OC1=CC=C(N)C=C1 P50334 [0,1,0,0,0,1|1,0,0]=3 1127 B11R1.20 CC(C)OC1=CC=C(O)C=C1 P60509 [0,1,0,0,0,1|1,0,0]=3 1128 B11R1.20 CC(C)OC1=CN=C(Cl)C=C1 C37509 [0,1,0,0,0,1|2,0,0]=4 1129 B11R1.20 CC(C)OC1=NC=C(Br)C=C1 B46786 [0,1,0,0,0,1|2,0,0]=4 1130 B11R1.20 CC(C)OC1=NC=C(N)C=C1 P59792 [0,1,0,0,0,1|2,0,0]=4 1131 B11R1.20 CC(C)OC1=NC=C(O)C=C1 P63580 [0,1,0,0,0,1|2,0,0]=4 1132 B11R1.20 CC(C)SC1=CC=C(Br)C=C1 B49968 [0,1,0,0,0,1|1,0,0]=3 1133 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T37815 [0,1,0,0,0,1|1,0,1]=4 1134 B11R1.20 CN(C)CC1=CC=C(N)C=C1 D24687 [0,1,0,0,0,1|2,0,0]=4 1135 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 F36778 [0,1,0,0,0,1|0,0,0]=2 1136 B11R1.20 FC(F)OC1=CC=C(Br)C=C1 B45142 [0,1,0,0,0,1|2,0,0]=4 1137 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 A69139 [0,1,0,0,0,1|1,0,1]=4 1138 B11R1.20 NC1=CC=C(OC(F)F)C=C1 D45886 [0,1,0,0,0,1|2,0,0]=4 1139 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B7856 [0,1,0,0,0,1|1,0,1]=4 1140 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 C68318 [0,1,0,0,0,1|1,0,1]=4 1141 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 F67433 [0,1,0,0,0,1|1,0,1]=4 1142 B11R1.20 OC1=CC=C(OC(F)F)C=C1 D38768 [0,1,0,0,0,1|2,0,0]=4 1143 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 A51548 [0,1,0,0,0,1|1,0,1]=4 1144 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 P69231 [0,1,0,0,0,1|0,0,2]=4 1145 B11R1.36 CC(C)C(=O)C1=CC=CC=C1 B39601 [0,1,0,0,0,1|1,0,0]=3 1146 B11R1.36 CC(C)[C@@H](N)C1=CC=CC=C1 M39089 [0,1,0,0,0,1|1,0,0]=3 1147 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 M36968 [0,1,0,0,0,1|1,0,0]=3 1148 B11R1.36 CC(C)[C@H](N)C1=CC=CC=C1 M53117 [0,1,0,0,0,1|1,0,0]=3 1149 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 P49885 [0,1,0,0,0,1|1,0,1]=4 1150 B11R1.36 C[C@@H](O)[C@@H](N)C1=CC=CC=C1 A52178 [0,1,0,0,0,1|0,0,0]=2 1151 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 A52176 [0,1,0,0,0,1|0,0,0]=2 1152 B11R1.36 C[C@H](Br)C(=O)C1=CC=CC=C1 B52026 [0,1,0,0,0,1|1,0,0]=3 1153 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 P36930 [0,1,0,0,0,1|1,0,1]=4 1154 B11R1.36 C[C@H](O)[C@@H](N)C1=CC=CC=C1 A52179 [0,1,0,0,0,1|0,0,0]=2 1155 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 A52177 [0,1,0,0,0,1|0,0,0]=2 1156 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 A68336 [0,1,0,0,0,1|1,0,1]=4 1157 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 A69083 [0,1,0,0,0,1|1,0,1]=4 1158 B11R1.36 O=C(C1=CC=CC=C1)C(F)F D63183 [0,1,0,0,0,1|2,0,0]=4 1159 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M64934 [0,1,0,0,0,1|1,0,1]=4 1160 B11R1.36 O=C(O)[C@H](Cl)C1=CC=CC=C1 C48589 [0,1,0,0,0,1|1,0,1]=4 1161 B11R1.40 C#C[C@@H](O)CC1=CC=CC=C1 P52407 [0,1,0,0,0,1|0,0,1]=3 1162 B11R1.40 COC(=O)OC1=CC=CC=C1 M37596 [0,1,0,0,0,1|0,0,2]=4 1163 B11R1.40 C[C@@H](C#N)NC1=CC=CC=C1 P38171 [0,1,0,0,0,1|1,0,0]=3 1164 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 P69082 [0,1,0,0,0,1|1,0,0]=3 1165 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 A38136 [0,1,0,0,0,1|1,0,0]=3 1166 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P64903 [0,1,0,0,0,1|1,0,0]=3 1167 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B49021 [0,1,0,0,0,1|0,0,2]=4 1168 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B64861 [0,1,0,0,0,1|0,0,2]=4 1169 B11R1.40 O=C(CBr)OC1=CC=CC=C1 P48564 [0,1,0,0,0,1|0,0,2]=4 1170 B11R1.40 O=C(CCl)NC1=CC=CC=C1 C38641 [0,1,0,0,0,1|0,0,2]=4 1171 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 B50151 [0,1,0,0,0,1|1,0,0]=3 1172 B11R1.40 OC[C@@H](Cl)CC1=CC=CC=C1 C50161 [0,1,0,0,0,1|1,0,0]=3 1173 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 B52020 [0,1,0,0,0,1|0,0,2]=4 1174 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 C52039 [0,1,0,0,0,1|0,0,2]=4 1175 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 F52044 [0,1,0,0,0,1|0,0,2]=4 1176 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 A46655 [0,1,0,0,0,1|0,0,2]=4 1177 B11R1.86 CC(C)NC1=NC=CC=C1N P47054 [0,1,0,0,0,1|2,0,0]=4 1178 B11R1.86 CC(C)OC1=C(Br)C=CC=C1 B50144 [0,1,0,0,0,1|1,0,0]=3 1179 B11R1.86 CC(C)OC1=C(Br)C=CC=N1 B46784 [0,1,0,0,0,1|2,0,0]=4 1180 B11R1.86 CC(C)OC1=C(N)C=CC=C1 P67507 [0,1,0,0,0,1|1,0,0]=3 1181 B11R1.86 CC(C)SC1=C(N)C=CC=C1 P50385 [0,1,0,0,0,1|1,0,0]=3 1182 B11R1.86 CC(C)SC1=C(N)C=CC=C1 P60671 [0,1,0,0,0,1|1,0,0]=3 1183 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 T69090 [0,1,0,0,0,1|1,0,1]=4 1184 B11R1.86 FC(F)OC1=C(Br)C=CC=C1 B45140 [0,1,0,0,0,1|2,0,0]=4 1185 B11R1.86 FC(F)OC1=C(I)C=CC=C1 D38936 [0,1,0,0,0,1|2,0,0]=4 1186 B11R1.86 NC1=C(OC(F)F)C=CC=C1 D67331 [0,1,0,0,0,1|2,0,0]=4 1187 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 B39490 [0,1,0,0,0,1|1,0,1]=4 1188 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 F39494 [0,1,0,0,0,1|1,0,1]=4 1189 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 K48630 [0,1,0,0,0,1|1,0,1]=4 1190 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 B64129 [0,1,0,0,0,1|0,0,2]=4 1191 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 C52040 [0,1,0,0,0,1|0,0,2]=4 1192 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F52045 [0,1,0,0,0,1|0,0,2]=4 1193 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 F2848 [0,1,0,0,0,1|0,0,2]=4 1194 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 F48608 [0,1,0,0,0,1|0,0,2]=4 1195 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 K48628 [0,1,0,0,0,1|0,0,2]=4 1196 B11R1.157 CC(C)CC1=CC=CC(Br)=C1 B52868 [0,1,0,0,0,1|1,0,0]=3 1197 B11R1.157 CC(C)OC1=CC(O)=CC=C1 M61115 [0,1,0,0,0,1|1,0,0]=3 1198 B11R1.157 CC(C)OC1=CC=CC(Br)=C1 B66115 [0,1,0,0,0,1|1,0,0]=3 1199 B11R1.157 CC(C)OC1=NC=CC(Br)=C1 B46785 [0,1,0,0,0,1|2,0,0]=4 1200 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 T49882 [0,1,0,0,0,1|1,0,1]=4 1201 B11R1.157 CN(C)CC1=CC=CC(Br)=C1 B50233 [0,1,0,0,0,1|2,0,0]=4 1202 B11R1.157 CN(C)CC1=CC=CC(O)=C1 D50353 [0,1,0,0,0,1|2,0,0]=4 1203 B11R1.157 FC(F)OC1=CC=CC(Br)=C1 B45141 [0,1,0,0,0,1|2,0,0]=4 1204 B11R1.157 NC1=CC=CC(OC(F)F)=C1 D45885 [0,1,0,0,0,1|2,0,0]=4 1205 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 B67653 [0,1,0,0,0,1|1,0,1]=4 1206 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 C68317 [0,1,0,0,0,1|1,0,1]=4 1207 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F23088 [0,1,0,0,0,1|1,0,1]=4 1208 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 K48631 [0,1,0,0,0,1|1,0,1]=4 1209 B11R1.157 OC1=CC=CC(OC(F)F)=C1 D45518 [0,1,0,0,0,1|2,0,0]=4 1210 B11R1.509 CC(C)(C)OC1=CN=CC=C1 B50336 [0,1,0,0,0,1|2,0,0]=4 1211 B11R1.509 CC(C)(C)OC1=NC=CC=C1 B50335 [0,1,0,0,0,1|2,0,0]=4 1212 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 P46415 [0,1,0,0,0,1|1,0,1]=4 1213 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 B37400 [0,1,0,0,0,1|2,0,0]=4 1214 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 M37460 [0,1,0,0,0,1|2,0,0]=4 1215 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 T60768 [0,1,0,0,0,1|2,0,0]=4 1216 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 T60838 [0,1,0,0,0,1|2,0,0]=4 1217 B11R1.509 FC(F)(F)OC1=CC=CC=C1 T39366 [0,1,0,0,0,1|2,0,0]=4 1218 B11R1.497 CC(C)C1=CC(=O)C=CC=C1 P61146 [0,1,0,0,0,1|1,0,0]=3 1219 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 E16325 [0,2,0,0,0,0|1,0,1]=4 1220 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 E62179 [0,2,0,0,0,0|0,0,2]=4 1221 B11R1.3 C#CC1=CC=C(C(C)C)C=C1 E54481 [0,2,0,0,0,0|1,0,0]=3 1222 B11R1.3 C#CC1=CC=C(N(C)C)C=C1 D38058 [0,2,0,0,0,0|2,0,0]=4 1223 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 V67904 [0,2,0,0,0,0|1,0,1]=4 1224 B11R1.3 C=CC1=CC=C([SiH](C)C)C=C1 D53107 [0,2,0,0,0,0|1,1,0]=4 1225 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 A51160 [0,2,0,0,0,0|0,0,2]=4 1226 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 A51552 [0,2,0,0,0,0|0,0,2]=4 1227 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 B36669 [0,2,0,0,0,0|0,0,2]=4 1228 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 A52108 [0,2,0,0,0,0|0,0,2]=4 1229 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 H49897 [0,2,0,0,0,0|0,0,2]=4 1230 B11R1.3 CC(C)C1=CC=C(CN)C=C1 P53115 [0,2,0,0,0,0|1,0,0]=3 1231 B11R1.3 CCC1=CC=C(B(O)O)C=C1 E3140 [0,2,0,0,0,0|2,0,0]=4 1232 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 E61033 [0,2,0,0,0,0|1,0,1]=4 1233 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 D69320 [0,2,0,0,0,0|2,0,0]=4 1234 B11R1.3 CN(C)C1=CC=C(CO)C=C1 D61045 [0,2,0,0,0,0|2,0,0]=4 1235 B11R1.3 CN(C)C1=CC=C(NN)C=C1 H49675 [0,2,0,0,0,0|2,0,0]=4 1236 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 M60981 [0,2,0,0,0,0|1,0,1]=4 1237 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 M50024 [0,2,0,0,0,0|0,0,2]=4 1238 B11R1.3 COC1=CC=C(C(=O)O)C=C1 M64803 [0,2,0,0,0,0|1,0,1]=4 1239 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 M50287 [0,2,0,0,0,0|0,0,0]=2 1240 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M50345 [0,2,0,0,0,0|1,0,0]=3 1241 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M63049 [0,2,0,0,0,0|1,0,0]=3 1242 B11R1.3 COC1=CC=C([C@H](C)N)C=C1 M68132 [0,2,0,0,0,0|1,0,0]=3 1243 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M38013 [0,2,0,0,0,0|0,0,0]=2 1244 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M50288 [0,2,0,0,0,0|0,0,0]=2 1245 B11R1.3 CSC1=CC=C(B(O)O)C=C1 M4660 [0,2,0,0,0,0|2,0,0]=4 1246 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 M62193 [0,2,0,0,0,0|1,0,1]=4 1247 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 M49959 [0,2,0,0,0,0|0,0,2]=4 1248 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 A52058 [0,2,0,0,0,0|1,0,0]=3 1249 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 A64157 [0,2,0,0,0,0|1,0,0]=3 1250 B11R1.3 C[C@@H](N)C1=CC=C(CO)C=C1 A64851 [0,2,0,0,0,0|1,0,0]=3 1251 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 A52059 [0,2,0,0,0,0|1,0,0]=3 1252 B11R1.3 C[C@H](N)C1=CC=C(C#N)C=C1 A64156 [0,2,0,0,0,0|1,0,0]=3 1253 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 C2360 [0,2,0,0,0,0|2,0,0]=4 1254 B11R1.3 N#CC1=CC=C(C(Cl)Cl)C=C1 D47688 [0,2,0,0,0,0|2,0,0]=4 1255 B11R1.3 NCC1=CC=C(B(O)O)C=C1 A1320 [0,2,0,0,0,0|2,0,0]=4 1256 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 A37814 [0,2,0,0,0,0|1,0,1]=4 1257 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 H49094 [0,2,0,0,0,0|1,0,1]=4 1258 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 F3540 [0,2,0,0,0,0|2,0,0]=4 1259 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 F69091 [0,2,0,0,0,0|1,0,1]=4 1260 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 B1880 [0,2,0,0,0,0|2,0,0]=4 1261 B11R1.3 OCC1=CC=C(B(O)O)C=C1 H3720 [0,2,0,0,0,0|2,0,0]=4 1262 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 B68078 [0,2,0,0,0,0|1,0,0]=3 1263 B11R1.19 CC(C)(C)C1=CC=C(Cl)C=C1 B52874 [0,2,0,0,0,0|1,0,0]=3 1264 B11R1.19 CC(C)(C)C1=CC=C(I)C=C1 B52875 [0,2,0,0,0,0|1,0,0]=3 1265 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 B53106 [0,2,0,0,0,0|1,0,0]=3 1266 B11R1.19 CC(C)(C)C1=CC=C([Mg+])C=C1 B31784 [0,2,0,0,0,0|1,0,0]=3 1267 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 B50148 [0,2,0,0,0,0|0,0,0]=2 1268 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 B48301 [0,2,0,0,0,0|1,0,0]=3 1269 B11R1.19 CC1=CC=C(C(F)(F)F)C=C1 M48306 [0,2,0,0,0,0|2,0,0]=4 1270 B11R1.19 CC1=CC=C(P(=O)(O)O)C=C1 T46447 [0,2,0,0,0,0|2,0,0]=4 1271 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 A38483 [0,2,0,0,0,0|2,0,0]=4 1272 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 A57393 [0,2,0,0,0,0|2,0,0]=4 1273 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 D58072 [0,2,0,0,0,0|2,0,0]=4 1274 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 E56561 [0,2,0,0,0,0|2,0,0]=4 1275 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 E62577 [0,2,0,0,0,0|2,0,0]=4 1276 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 F29658 [0,2,0,0,0,0|2,0,0]=4 1277 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H7302 [0,2,0,0,0,0|2,0,0]=4 1278 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M22571 [0,2,0,0,0,0|2,0,0]=4 1279 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M23344 [0,2,0,0,0,0|2,0,0]=4 1280 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M58073 [0,2,0,0,0,0|2,0,0]=4 1281 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M65363 [0,2,0,0,0,0|2,0,0]=4 1282 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M68821 [0,2,0,0,0,0|2,0,0]=4 1283 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O8459 [0,2,0,0,0,0|2,0,0]=4 1284 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P56560 [0,2,0,0,0,0|2,0,0]=4 1285 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 T55432 [0,2,0,0,0,0|2,0,0]=4 1286 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 T58548 [0,2,0,0,0,0|2,0,0]=4 1287 B11R1.19 CP(C)(=O)C1=CC=C(Br)C=C1 B62353 [0,2,0,0,0,0|1,0,1]=4 1288 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 A49544 [0,2,0,0,0,0|1,0,1]=4 1289 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 B38495 [0,2,0,0,0,0|1,0,1]=4 1290 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 M46269 [0,2,0,0,0,0|1,0,1]=4 1291 B11R1.19 C[Si](C)(C)C1=CC=C(Br)C=C1 B50305 [0,2,0,0,0,0|1,1,0]=4 1292 B11R1.19 FC(F)(F)C1=CC=C(Br)C=C1 B39322 [0,2,0,0,0,0|2,0,0]=4 1293 B11R1.19 FC(F)(F)C1=CC=C(I)C=C1 K39323 [0,2,0,0,0,0|2,0,0]=4 1294 B11R1.19 FC(F)(F)C1=CC=C([Mg+])C=C1 T7139 [0,2,0,0,0,0|2,0,0]=4 1295 B11R1.19 FC1=CC=C(C(F)(F)F)C=C1 F44284 [0,2,0,0,0,0|2,0,0]=4 1296 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 T60587 [0,2,0,0,0,0|2,0,0]=4 1297 B11R1.19 NC1=CC=C(C(F)(F)F)C=C1 T69247 [0,2,0,0,0,0|2,0,0]=4 1298 B11R1.19 O=S(=O)(O)C1=CC=C(I)C=C1 I37070 [0,2,0,0,0,0|2,0,0]=4 1299 B11R1.19 OC1=CC=C(C(F)(F)F)C=C1 T67426 [0,2,0,0,0,0|2,0,0]=4 1300 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 B52032 [0,2,0,0,0,0|0,0,2]=4 1301 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 B39475 [0,2,0,0,0,0|0,0,2]=4 1302 B11R1.21 CC(=O)C1=CC(Br)=C(I)C=C1 B48269 [0,2,0,0,0,0|0,0,2]=4 1303 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 A49026 [0,2,0,0,0,0|0,0,2]=4 1304 B11R1.21 CC(=O)C1=CC(Br)=C(O)C=C1 B48581 [0,2,0,0,0,0|0,0,2]=4 1305 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=C1 B52034 [0,2,0,0,0,0|0,0,2]=4 1306 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 C52042 [0,2,0,0,0,0|0,0,2]=4 1307 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 F28728 [0,2,0,0,0,0|0,0,2]=4 1308 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 B48245 [0,2,0,0,0,0|0,0,2]=4 1309 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 C61119 [0,2,0,0,0,0|0,0,2]=4 1310 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 D39476 [0,2,0,0,0,0|0,0,2]=4 1311 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 C48274 [0,2,0,0,0,0|0,0,2]=4 1312 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 B48250 [0,2,0,0,0,0|0,0,2]=4 1313 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 C69014 [0,2,0,0,0,0|0,0,2]=4 1314 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 D39477 [0,2,0,0,0,0|0,0,2]=4 1315 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 A49052 [0,2,0,0,0,0|0,0,2]=4 1316 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 F48621 [0,2,0,0,0,0|0,0,2]=4 1317 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 A50026 [0,2,0,0,0,0|0,0,2]=4 1318 B11R1.21 CC(=O)C1=CC(N)=C(Cl)C=C1 A49040 [0,2,0,0,0,0|0,0,2]=4 1319 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 D68113 [0,2,0,0,0,0|0,0,2]=4 1320 B11R1.21 CC(C)C1=NC(N)=C(Br)C=C1 B59688 [0,2,0,0,0,0|2,0,0]=4 1321 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 B48570 [0,2,0,0,0,0|1,0,1]=4 1322 B11R1.21 CC1=C(Br)C=CC(B(O)O)=C1 B46237 [0,2,0,0,0,0|2,0,0]=4 1323 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 B38437 [0,2,0,0,0,0|1,0,1]=4 1324 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 D2960 [0,2,0,0,0,0|2,0,0]=4 1325 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 D69089 [0,2,0,0,0,0|1,0,1]=4 1326 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 C2226 [0,2,0,0,0,0|2,0,0]=4 1327 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 C48593 [0,2,0,0,0,0|1,0,1]=4 1328 B11R1.21 CC1=C(Cl)C=C([C@@H](C)N)C=C1 C61118 [0,2,0,0,0,0|1,0,0]=3 1329 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 C50241 [0,2,0,0,0,0|1,0,0]=3 1330 B11R1.21 CC1=C(Cl)C=C([C@H](C)N)C=C1 C61334 [0,2,0,0,0,0|1,0,0]=3 1331 B11R1.21 CC1=C(Cl)C=CC(B(O)O)=C1 C2229 [0,2,0,0,0,0|2,0,0]=4 1332 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 C39491 [0,2,0,0,0,0|1,0,1]=4 1333 B11R1.21 CC1=C(Cl)C=CC([C@@H](C)N)=C1 C50246 [0,2,0,0,0,0|1,0,0]=3 1334 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 F3286 [0,2,0,0,0,0|2,0,0]=4 1335 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 F48613 [0,2,0,0,0,0|1,0,1]=4 1336 B11R1.21 CC1=C(F)C=C([C@H](C)N)C=C1 F63759 [0,2,0,0,0,0|1,0,0]=3 1337 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 F3320 [0,2,0,0,0,0|2,0,0]=4 1338 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 F39495 [0,2,0,0,0,0|1,0,1]=4 1339 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 F52150 [0,2,0,0,0,0|1,0,0]=3 1340 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 K25553 [0,2,0,0,0,0|1,0,1]=4 1341 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 K63515 [0,2,0,0,0,0|1,0,1]=4 1342 B11R1.21 CC1=C(N)C=C(B(O)O)C=C1 A43701 [0,2,0,0,0,0|2,0,0]=4 1343 B11R1.21 CC1=C(N)C=C([C@H](C)N)C=C1 A52256 [0,2,0,0,0,0|1,0,0]=3 1344 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 A39517 [0,2,0,0,0,0|1,0,1]=4 1345 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 H62526 [0,2,0,0,0,0|2,0,0]=4 1346 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 H49095 [0,2,0,0,0,0|1,0,1]=4 1347 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 H46446 [0,2,0,0,0,0|2,0,0]=4 1348 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 H49097 [0,2,0,0,0,0|1,0,1]=4 1349 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(Cl)C=C1 D49232 [0,2,0,0,0,0|1,0,0]=3 1350 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 C49241 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 C49243 [0,2,0,0,0,0|1,0,0]=3 1352 B11R1.21 C[C@@H](N)C1=CC(F)=C(F)C=C1 D49250 [0,2,0,0,0,0|1,0,0]=3 1353 B11R1.21 C[C@@H](N)C1=CC(F)=C(F)C=C1 D49637 [0,2,0,0,0,0|1,0,0]=3 1354 B11R1.21 C[C@H](N)C1=CC(Br)=C(F)C=C1 B49225 [0,2,0,0,0,0|1,0,0]=3 1355 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Br)C=C1 B49221 [0,2,0,0,0,0|1,0,0]=3 1356 B11R1.21 C[C@H](N)C1=CC(F)=C(Br)C=C1 B49227 [0,2,0,0,0,0|1,0,0]=3 1357 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 C49246 [0,2,0,0,0,0|1,0,0]=3 1358 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 D49642 [0,2,0,0,0,0|1,0,0]=3 1359 B11R1.21 C[C@H](O)C1=CC(Cl)=C(Cl)C=C1 D49144 [0,2,0,0,0,0|0,0,0]=2 1360 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 D49155 [0,2,0,0,0,0|0,0,0]=2 1361 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 A45330 [0,2,0,0,0,0|1,0,1]=4 1362 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 A45328 [0,2,0,0,0,0|1,0,1]=4 1363 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 A69418 [0,2,0,0,0,0|1,0,1]=4 1364 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 A69510 [0,2,0,0,0,0|1,0,1]=4 1365 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 A45379 [0,2,0,0,0,0|1,0,1]=4 1366 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 A45377 [0,2,0,0,0,0|1,0,1]=4 1367 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 A45396 [0,2,0,0,0,0|1,0,1]=4 1368 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 A45395 [0,2,0,0,0,0|1,0,1]=4 1369 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 A67467 [0,2,0,0,0,0|1,0,1]=4 1370 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 D36700 [0,2,0,0,0,0|1,0,1]=4 1371 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 B44568 [0,2,0,0,0,0|1,0,1]=4 1372 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 B39336 [0,2,0,0,0,0|1,0,1]=4 1373 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 B44584 [0,2,0,0,0,0|1,0,1]=4 1374 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 B44571 [0,2,0,0,0,0|1,0,1]=4 1375 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 C44591 [0,2,0,0,0,0|1,0,1]=4 1376 B11R1.21 O=C(O)C1=CC(Cl)=C(I)C=C1 C38946 [0,2,0,0,0,0|1,0,1]=4 1377 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 C62141 [0,2,0,0,0,0|1,0,1]=4 1378 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 B44576 [0,2,0,0,0,0|1,0,1]=4 1379 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 C37845 [0,2,0,0,0,0|1,0,1]=4 1380 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 D68133 [0,2,0,0,0,0|1,0,1]=4 1381 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 F36867 [0,2,0,0,0,0|1,0,1]=4 1382 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 F68105 [0,2,0,0,0,0|1,0,1]=4 1383 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 B67829 [0,2,0,0,0,0|1,0,1]=4 1384 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 C44602 [0,2,0,0,0,0|1,0,1]=4 1385 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 F44617 [0,2,0,0,0,0|1,0,1]=4 1386 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 B45113 [0,2,0,0,0,0|1,0,1]=4 1387 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 C38513 [0,2,0,0,0,0|1,0,1]=4 1388 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 F24023 [0,2,0,0,0,0|1,0,1]=4 1389 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 H45126 [0,2,0,0,0,0|1,0,1]=4 1390 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 D2560 [0,2,0,0,0,0|2,0,0]=4 1391 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 C2200 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 C42947 [0,2,0,0,0,0|2,0,0]=4 1393 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 B1817 [0,2,0,0,0,0|2,0,0]=4 1394 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 C2276 [0,2,0,0,0,0|2,0,0]=4 1395 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 D2680 [0,2,0,0,0,0|2,0,0]=4 1396 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 F42953 [0,2,0,0,0,0|2,0,0]=4 1397 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 C42949 [0,2,0,0,0,0|2,0,0]=4 1398 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 F42955 [0,2,0,0,0,0|2,0,0]=4 1399 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 B52024 [0,2,0,0,0,0|0,0,2]=4 1400 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 A52107 [0,2,0,0,0,0|0,0,2]=4 1401 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 A52174 [0,2,0,0,0,0|1,0,0]=3 1402 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 B16168 [0,2,0,0,0,0|0,0,2]=4 1403 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 F39582 [0,2,0,0,0,0|0,0,2]=4 1404 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 K52052 [0,2,0,0,0,0|0,0,2]=4 1405 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 T54185 [0,2,0,0,0,0|1,0,0]=3 1406 B11R1.22 CC[C@@H](N)C1=CC=C(Cl)C=C1 C50244 [0,2,0,0,0,0|1,0,0]=3 1407 B11R1.22 CC[C@@H](N)C1=CC=C(F)C=C1 F52146 [0,2,0,0,0,0|1,0,0]=3 1408 B11R1.22 CC[C@H](C)C1=CC=C(Br)C=C1 B39008 [0,2,0,0,0,0|1,0,0]=3 1409 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 B50231 [0,2,0,0,0,0|1,0,0]=3 1410 B11R1.22 CC[C@H](N)C1=CC=C(Br)C=C1 B50235 [0,2,0,0,0,0|1,0,0]=3 1411 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 C37034 [0,2,0,0,0,0|1,0,0]=3 1412 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 F52142 [0,2,0,0,0,0|1,0,0]=3 1413 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 F52149 [0,2,0,0,0,0|1,0,0]=3 1414 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 B49023 [0,2,0,0,0,0|0,0,2]=4 1415 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 K63815 [0,2,0,0,0,0|0,0,2]=4 1416 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 A69158 [0,2,0,0,0,0|0,0,2]=4 1417 B11R1.22 CN[C@@H](C)C1=CC=C(Br)C=C1 B50237 [0,2,0,0,0,0|1,0,0]=3 1418 B11R1.22 CN[C@@H](C)C1=CC=C(Cl)C=C1 C50248 [0,2,0,0,0,0|1,0,0]=3 1419 B11R1.22 CN[C@H](C)C1=CC=C(Cl)C=C1 C50247 [0,2,0,0,0,0|1,0,0]=3 1420 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 M39489 [0,2,0,0,0,0|0,0,2]=4 1421 B11R1.22 COC(=O)C1=CC=C(C)C=C1 M60598 [0,2,0,0,0,0|0,0,2]=4 1422 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 M64818 [0,2,0,0,0,0|0,0,2]=4 1423 B11R1.22 COC(=O)C1=CC=C(F)C=C1 M67923 [0,2,0,0,0,0|0,0,2]=4 1424 B11R1.22 C[C@@H](CN)C1=CC=C(O)C=C1 A28643 [0,2,0,0,0,0|1,0,0]=3 1425 B11R1.22 C[C@H](C#N)C1=CC=C(Br)C=C1 B51451 [0,2,0,0,0,0|1,0,0]=3 1426 B11R1.22 C\C(=N\O)C1=CC=C(Cl)C=C1 C67180 [0,2,0,0,0,0|0,0,1]=3 1427 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 B49032 [0,2,0,0,0,0|0,0,2]=4 1428 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 A49045 [0,2,0,0,0,0|0,0,2]=4 1429 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 A49617 [0,2,0,0,0,0|0,0,2]=4 1430 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A38341 [0,2,0,0,0,0|1,0,0]=3 1431 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A46796 [0,2,0,0,0,0|1,0,0]=3 1432 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A46798 [0,2,0,0,0,0|1,0,0]=3 1433 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 A46808 [0,2,0,0,0,0|1,0,0]=3 1434 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 A46813 [0,2,0,0,0,0|1,0,0]=3 1435 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 A46818 [0,2,0,0,0,0|1,0,0]=3 1436 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 A49527 [0,2,0,0,0,0|1,0,0]=3 1437 B11R1.22 N[C@@H](CO)C1=CN=C(Cl)C=C1 A46332 [0,2,0,0,0,0|2,0,0]=4 1438 B11R1.22 N[C@@H](CO)C1=NC=C(F)C=C1 A37122 [0,2,0,0,0,0|2,0,0]=4 1439 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 A46797 [0,2,0,0,0,0|1,0,0]=3 1440 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 A46811 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 A46821 [0,2,0,0,0,0|1,0,0]=3 1442 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 A49517 [0,2,0,0,0,0|1,0,0]=3 1443 B11R1.22 N[C@H](CO)C1=CC=C(O)C=C1 A49528 [0,2,0,0,0,0|1,0,0]=3 1444 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 B48246 [0,2,0,0,0,0|0,0,2]=4 1445 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 C69024 [0,2,0,0,0,0|0,0,2]=4 1446 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 B49377 [0,2,0,0,0,0|0,0,0]=2 1447 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 B48242 [0,2,0,0,0,0|0,0,2]=4 1448 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 B48579 [0,2,0,0,0,0|0,0,2]=4 1449 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 D68875 [0,2,0,0,0,0|0,0,2]=4 1450 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 H49903 [0,2,0,0,0,0|0,0,2]=4 1451 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 B48244 [0,2,0,0,0,0|0,0,2]=4 1452 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 C48277 [0,2,0,0,0,0|0,0,2]=4 1453 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 B8298 [0,2,0,0,0,0|0,0,2]=4 1454 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 C48275 [0,2,0,0,0,0|0,0,2]=4 1455 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 D69359 [0,2,0,0,0,0|0,0,2]=4 1456 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 F48622 [0,2,0,0,0,0|0,0,2]=4 1457 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 A49024 [0,2,0,0,0,0|0,0,2]=4 1458 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 A50025 [0,2,0,0,0,0|0,0,2]=4 1459 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 A49037 [0,2,0,0,0,0|0,0,2]=4 1460 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 B9402 [0,2,0,0,0,0|0,0,2]=4 1461 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 C61332 [0,2,0,0,0,0|0,0,2]=4 1462 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 F69072 [0,2,0,0,0,0|0,0,2]=4 1463 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 A49290 [0,2,0,0,0,0|0,0,2]=4 1464 B11R1.166 CC(C)C1=C(O)C=C(N)C=C1 A67349 [0,2,0,0,0,0|1,0,0]=3 1465 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 I38010 [0,2,0,0,0,0|1,0,0]=3 1466 B11R1.166 CC1=C(B(O)O)C=CC(Br)=C1 B46236 [0,2,0,0,0,0|2,0,0]=4 1467 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 C2228 [0,2,0,0,0,0|2,0,0]=4 1468 B11R1.166 CC1=C(B(O)O)C=CC(F)=C1 F3300 [0,2,0,0,0,0|2,0,0]=4 1469 B11R1.166 CC1=C(B(O)O)C=CC(O)=C1 H3726 [0,2,0,0,0,0|2,0,0]=4 1470 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 B24914 [0,2,0,0,0,0|1,0,1]=4 1471 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 C38469 [0,2,0,0,0,0|1,0,1]=4 1472 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 F48615 [0,2,0,0,0,0|1,0,1]=4 1473 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 A49284 [0,2,0,0,0,0|1,0,1]=4 1474 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 H68873 [0,2,0,0,0,0|1,0,1]=4 1475 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 B25317 [0,2,0,0,0,0|1,0,1]=4 1476 B11R1.166 CC1=CC(Br)=C(N(C)C)C=C1 B50229 [0,2,0,0,0,0|2,0,0]=4 1477 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 D46940 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.166 CC1=CC(C)=C([C@H](C)N)C=C1 D54187 [0,2,0,0,0,0|1,0,0]=3 1479 B11R1.166 CC1=CC(Cl)=C(B(O)O)C=C1 C2224 [0,2,0,0,0,0|2,0,0]=4 1480 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 C38447 [0,2,0,0,0,0|1,0,1]=4 1481 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 F7417 [0,2,0,0,0,0|2,0,0]=4 1482 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 F48610 [0,2,0,0,0,0|1,0,1]=4 1483 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 K61454 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 A49282 [0,2,0,0,0,0|1,0,1]=4 1485 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 H7838 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 M68144 [0,2,0,0,0,0|1,0,1]=4 1487 B11R1.166 C[C@@H](N)C1=C(Br)C=C(F)C=C1 B49222 [0,2,0,0,0,0|1,0,0]=3 1488 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 D49229 [0,2,0,0,0,0|1,0,0]=3 1489 B11R1.166 C[C@@H](N)C1=C(F)C=C(Br)C=C1 B49223 [0,2,0,0,0,0|1,0,0]=3 1490 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 D49249 [0,2,0,0,0,0|1,0,0]=3 1491 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 D49634 [0,2,0,0,0,0|1,0,0]=3 1492 B11R1.166 C[C@H](N)C1=C(Br)C=C(F)C=C1 B49224 [0,2,0,0,0,0|1,0,0]=3 1493 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 B49226 [0,2,0,0,0,0|1,0,0]=3 1494 B11R1.166 C[C@H](N)C1=C(F)C=C(Br)C=C1 B63723 [0,2,0,0,0,0|1,0,0]=3 1495 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 D49252 [0,2,0,0,0,0|1,0,0]=3 1496 B11R1.166 C[C@H](N)C1=C(F)C=C(F)C=C1 D49640 [0,2,0,0,0,0|1,0,0]=3 1497 B11R1.166 C[C@H](O)C1=C(Cl)C=C(Cl)C=C1 D49143 [0,2,0,0,0,0|0,0,0]=2 1498 B11R1.166 C[C@H](O)C1=CC=C(Cl)N=C1Cl D63331 [0,2,0,0,0,0|1,0,0]=3 1499 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 A22277 [0,2,0,0,0,0|1,0,1]=4 1500 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 A64964 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 A39388 [0,2,0,0,0,0|1,0,1]=4 1502 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 A45394 [0,2,0,0,0,0|1,0,1]=4 1503 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 A45838 [0,2,0,0,0,0|1,0,1]=4 1504 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 A69021 [0,2,0,0,0,0|1,0,1]=4 1505 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 A45378 [0,2,0,0,0,0|1,0,1]=4 1506 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 A69652 [0,2,0,0,0,0|1,0,1]=4 1507 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 D44562 [0,2,0,0,0,0|1,0,1]=4 1508 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 B26650 [0,2,0,0,0,0|1,0,1]=4 1509 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 B27964 [0,2,0,0,0,0|1,0,1]=4 1510 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 B44582 [0,2,0,0,0,0|1,0,1]=4 1511 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 B45109 [0,2,0,0,0,0|1,0,1]=4 1512 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 B44570 [0,2,0,0,0,0|1,0,1]=4 1513 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 D68555 [0,2,0,0,0,0|1,0,1]=4 1514 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 C45116 [0,2,0,0,0,0|1,0,1]=4 1515 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 C45121 [0,2,0,0,0,0|1,0,1]=4 1516 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 B36989 [0,2,0,0,0,0|1,0,1]=4 1517 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 C23721 [0,2,0,0,0,0|1,0,1]=4 1518 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 D39341 [0,2,0,0,0,0|1,0,1]=4 1519 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 F44613 [0,2,0,0,0,0|1,0,1]=4 1520 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 F38868 [0,2,0,0,0,0|1,0,1]=4 1521 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 B37202 [0,2,0,0,0,0|1,0,1]=4 1522 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 C44601 [0,2,0,0,0,0|1,0,1]=4 1523 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 F44616 [0,2,0,0,0,0|1,0,1]=4 1524 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 B45112 [0,2,0,0,0,0|1,0,1]=4 1525 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 F45124 [0,2,0,0,0,0|1,0,1]=4 1526 B11R1.166 OB(O)C1=C(Cl)C=C(Br)C=C1 B42684 [0,2,0,0,0,0|2,0,0]=4 1527 B11R1.166 OB(O)C1=C(Cl)C=C(Cl)C=C1 D2500 [0,2,0,0,0,0|2,0,0]=4 1528 B11R1.166 OB(O)C1=C(Cl)C=C(F)C=C1 C42688 [0,2,0,0,0,0|2,0,0]=4 1529 B11R1.166 OB(O)C1=C(Cl)C=C(O)C=C1 C42946 [0,2,0,0,0,0|2,0,0]=4 1530 B11R1.166 OB(O)C1=C(F)C=C(Br)C=C1 B1815 [0,2,0,0,0,0|2,0,0]=4 1531 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 C20549 [0,2,0,0,0,0|2,0,0]=4 1532 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 D2620 [0,2,0,0,0,0|2,0,0]=4 1533 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 F3214 [0,2,0,0,0,0|2,0,0]=4 1534 B11R1.7 C#CC(C)(C)C1=CC=CC=C1 M64383 [0,2,0,0,0,0|1,0,0]=3 1535 B11R1.7 C#C[C@@](C)(O)C1=CC=CC=C1 P52408 [0,2,0,0,0,0|0,0,0]=2 1536 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 M62343 [0,2,0,0,0,0|1,0,0]=3 1537 B11R1.7 CC(C)(CN)C1=CC=CC=C1 M53116 [0,2,0,0,0,0|1,0,0]=3 1538 B11R1.7 COS(=O)(=O)C1=CC=CC=C1 M46268 [0,2,0,0,0,0|1,0,1]=4 1539 B11R1.7 NCC(F)(F)C1=NC=CC=C1 D64291 [0,2,0,0,0,0|2,0,0]=4 1540 B11R1.7 NCC(F)(F)C1=NC=CC=C1 P12649 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.7 O=S(=O)(CCl)C1=CC=CC=C1 C45914 [0,2,0,0,0,0|1,0,1]=4 1542 B11R1.7 OCC(F)(F)C1=NC=CC=C1 D1557 [0,2,0,0,0,0|2,0,0]=4 1543 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 M52180 [0,2,0,0,0,0|0,0,0]=2 1544 B11R1.12 COB(OC)C1=NC=CC=C1 P5060 [0,2,0,0,0,0|2,0,0]=4 1545 B11R1.12 COC(OC)C1=CC=CC=C1 B69843 [0,2,0,0,0,0|0,0,0]=2 1546 B11R1.12 COC(OC)C1=NC=NC=C1 D14447 [0,2,0,0,0,0|2,0,0]=4 1547 B11R1.12 CO[C@@H](CO)C1=CC=CC=C1 M50282 [0,2,0,0,0,0|0,0,0]=2 1548 B11R1.12 OCC(CO)C1=CC=CC=C1 P67660 [0,2,0,0,0,0|0,0,0]=2 1549 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 P54139 [0,2,0,0,0,0|1,0,0]=3 1550 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P68339 [0,2,0,0,0,0|0,0,2]=4 1551 B11R1.16 CCC[C@@H](N)C1=CC=CC=C1 P54182 [0,2,0,0,0,0|1,0,0]=3 1552 B11R1.16 CCC[C@H](N)C1=CC=NC=C1 P37698 [0,2,0,0,0,0|2,0,0]=4 1553 B11R1.16 CCC[C@H](N)C1=CC=NC=C1 P52255 [0,2,0,0,0,0|2,0,0]=4 1554 B11R1.16 CCO[P@@H](=O)C1=CC=CC=C1 E46942 [0,2,0,0,0,0|1,0,1]=4 1555 B11R1.16 CN(CCN)C1=CC=CC=C1 M52257 [0,2,0,0,0,0|2,0,0]=4 1556 B11R1.16 CN(CCO)C1=CC=CC=C1 M50351 [0,2,0,0,0,0|1,0,0]=3 1557 B11R1.16 N#CCC(=O)C1=CC=CC=C1 X67635 [0,2,0,0,0,0|0,0,2]=4 1558 B11R1.16 N#CC[C@H](O)C1=CC=CC=C1 H51766 [0,2,0,0,0,0|0,0,0]=2 1559 B11R1.16 NCC[C@H](O)C1=CC=CC=C1 A55426 [0,2,0,0,0,0|0,0,0]=2 1560 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 A37972 [0,2,0,0,0,0|1,0,0]=3 1561 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 A50352 [0,2,0,0,0,0|1,0,0]=3 1562 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 H69256 [0,2,0,0,0,0|1,0,0]=3 1563 B11R1.16 O=C(OCCl)C1=CC=CC=C1 C48587 [0,2,0,0,0,0|0,0,2]=4 1564 B11R1.16 OCC[C@H](O)C1=NC=CC=C1 P46920 [0,2,0,0,0,0|1,0,0]=3 1565 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 C50162 [0,2,0,0,0,0|0,0,0]=2 1566 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 C69270 [0,2,0,0,0,0|0,0,0]=2 1567 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 C50160 [0,2,0,0,0,0|0,0,0]=2 1568 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 B52023 [0,2,0,0,0,0|0,0,2]=4 1569 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 A50349 [0,2,0,0,0,0|1,0,0]=3 1570 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A50350 [0,2,0,0,0,0|1,0,0]=3 1571 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A52173 [0,2,0,0,0,0|1,0,0]=3 1572 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 H49893 [0,2,0,0,0,0|0,0,2]=4 1573 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 F38669 [0,2,0,0,0,0|0,0,2]=4 1574 B11R1.23 CC[C@@H](N)C1=CC(C)=CC=C1 T54183 [0,2,0,0,0,0|1,0,0]=3 1575 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 F52145 [0,2,0,0,0,0|1,0,0]=3 1576 B11R1.23 CC[C@H](N)C1=CC=CC(Br)=C1 B50234 [0,2,0,0,0,0|1,0,0]=3 1577 B11R1.23 CC[C@H](N)C1=CC=CC(F)=C1 F52148 [0,2,0,0,0,0|1,0,0]=3 1578 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 B69408 [0,2,0,0,0,0|0,0,2]=4 1579 B11R1.23 CN[C@@H](C)C1=CC=CC(Br)=C1 B50236 [0,2,0,0,0,0|1,0,0]=3 1580 B11R1.23 COC(=O)C1=CC(N)=CC=C1 M69084 [0,2,0,0,0,0|0,0,2]=4 1581 B11R1.23 COC(=O)C1=CC(O)=CC=C1 M37841 [0,2,0,0,0,0|0,0,2]=4 1582 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 M48565 [0,2,0,0,0,0|0,0,2]=4 1583 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 M22864 [0,2,0,0,0,0|0,0,2]=4 1584 B11R1.23 COC(=O)C1=CC=CC(F)=C1 M39493 [0,2,0,0,0,0|0,0,2]=4 1585 B11R1.23 COC(=O)C1=CC=CC(I)=C1 M48629 [0,2,0,0,0,0|0,0,2]=4 1586 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 A46787 [0,2,0,0,0,0|1,0,0]=3 1587 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46801 [0,2,0,0,0,0|1,0,0]=3 1588 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46803 [0,2,0,0,0,0|1,0,0]=3 1589 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A64410 [0,2,0,0,0,0|1,0,0]=3 1590 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A66336 [0,2,0,0,0,0|1,0,0]=3 1591 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 A49514 [0,2,0,0,0,0|1,0,0]=3 1592 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=N1 A46570 [0,2,0,0,0,0|2,0,0]=4 1593 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 A49526 [0,2,0,0,0,0|1,0,0]=3 1594 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 A46799 [0,2,0,0,0,0|1,0,0]=3 1595 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46804 [0,2,0,0,0,0|1,0,0]=3 1596 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46810 [0,2,0,0,0,0|1,0,0]=3 1597 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A46820 [0,2,0,0,0,0|1,0,0]=3 1598 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A49516 [0,2,0,0,0,0|1,0,0]=3 1599 B11R1.23 N[C@H](CO)C1=CC=CC(I)=C1 A11985 [0,2,0,0,0,0|1,0,0]=3 1600 B11R1.23 N\C(=N/O)C1=CC=CC(Br)=C1 B64571 [0,2,0,0,0,0|1,0,1]=4 1601 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 B48248 [0,2,0,0,0,0|0,0,2]=4 1602 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 B48255 [0,2,0,0,0,0|0,0,2]=4 1603 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 B68743 [0,2,0,0,0,0|0,0,2]=4 1604 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 B68490 [0,2,0,0,0,0|0,0,2]=4 1605 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 C49388 [0,2,0,0,0,0|0,0,0]=2 1606 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C36827 [0,2,0,0,0,0|0,0,0]=2 1607 B11R1.222 CC1=C([C@H](C)C#N)C=CC=C1 T52504 [0,2,0,0,0,0|1,0,0]=3 1608 B11R1.222 CCC(=O)C1=C(C)C=CC=C1 M52778 [0,2,0,0,0,0|0,0,2]=4 1609 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 C52038 [0,2,0,0,0,0|0,0,2]=4 1610 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 H39530 [0,2,0,0,0,0|0,0,2]=4 1611 B11R1.222 CC[C@@H](N)C1=C(C)C=CC=C1 T54184 [0,2,0,0,0,0|1,0,0]=3 1612 B11R1.222 CC[C@H](C)C1=C(N)C=CC=C1 B53112 [0,2,0,0,0,0|1,0,0]=3 1613 B11R1.222 CC[C@H](N)C1=C(Cl)C=CC=C1 C50243 [0,2,0,0,0,0|1,0,0]=3 1614 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 F52141 [0,2,0,0,0,0|1,0,0]=3 1615 B11R1.222 CC[C@H](N)C1=C(F)C=CC=C1 F52147 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.222 CC[C@H](N)C1=C(O)C=CC=C1 A52170 [0,2,0,0,0,0|1,0,0]=3 1617 B11R1.222 CNC(=O)C1=C(Br)C=CC=C1 B49022 [0,2,0,0,0,0|0,0,2]=4 1618 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 A67666 [0,2,0,0,0,0|0,0,2]=4 1619 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 M64518 [0,2,0,0,0,0|0,0,2]=4 1620 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 M39488 [0,2,0,0,0,0|0,0,2]=4 1621 B11R1.222 COC(=O)C1=C(C)C=CC=C1 M39531 [0,2,0,0,0,0|0,0,2]=4 1622 B11R1.222 COC(=O)C1=C(F)C=CC=C1 M69073 [0,2,0,0,0,0|0,0,2]=4 1623 B11R1.222 COC(=O)C1=C(I)C=CC=C1 M67835 [0,2,0,0,0,0|0,0,2]=4 1624 B11R1.222 COC(=O)C1=C(S)C=CC=C1 M69035 [0,2,0,0,0,0|0,0,2]=4 1625 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 A69482 [0,2,0,0,0,0|0,0,2]=4 1626 B11R1.222 N[C@@H](CO)C1=C(Cl)C=NC=C1 A46331 [0,2,0,0,0,0|2,0,0]=4 1627 B11R1.222 N[C@H](CO)C1=C(Cl)C=CC=C1 A46809 [0,2,0,0,0,0|1,0,0]=3 1628 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A46819 [0,2,0,0,0,0|1,0,0]=3 1629 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A49515 [0,2,0,0,0,0|1,0,0]=3 1630 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 B60597 [0,2,0,0,0,0|0,0,2]=4 1631 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 B48254 [0,2,0,0,0,0|0,0,2]=4 1632 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 B48582 [0,2,0,0,0,0|0,0,2]=4 1633 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 F48290 [0,2,0,0,0,0|0,0,2]=4 1634 B11R1.87 CC(C)(C)C1=C(Br)C=CC=C1 B52871 [0,2,0,0,0,0|1,0,0]=3 1635 B11R1.87 CC(C)(C)C1=C(N)C=CC=C1 A38434 [0,2,0,0,0,0|1,0,0]=3 1636 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 B50232 [0,2,0,0,0,0|1,0,0]=3 1637 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 B50146 [0,2,0,0,0,0|0,0,0]=2 1638 B11R1.87 CC(C)(O)C1=C(Br)C=CC=N1 B37253 [0,2,0,0,0,0|1,0,0]=3 1639 B11R1.87 CC(C)(O)C1=C(N)C=CC=C1 A36729 [0,2,0,0,0,0|0,0,0]=2 1640 B11R1.87 CC1=C(C(F)(F)F)C=CC=C1 M48304 [0,2,0,0,0,0|2,0,0]=4 1641 B11R1.87 CC1=C(S(=O)(=O)O)C=CC=C1 M46272 [0,2,0,0,0,0|2,0,0]=4 1642 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 A47013 [0,2,0,0,0,0|1,0,1]=4 1643 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=C1 M61771 [0,2,0,0,0,0|1,0,1]=4 1644 B11R1.87 FC(F)(F)C1=C(I)C=CC=C1 K44282 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.87 FC1=C(C(F)(F)F)C=CC=C1 F44283 [0,2,0,0,0,0|2,0,0]=4 1646 B11R1.87 O=S(=O)(O)C1=C(I)C=CC=C1 K42719 [0,2,0,0,0,0|2,0,0]=4 1647 B11R1.87 OC1=C(C(F)(F)F)C=CC=C1 T68847 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.155 CC(C)(C)C1=CC(Br)=NC=C1 B50228 [0,2,0,0,0,0|2,0,0]=4 1649 B11R1.155 CC(C)(C)C1=CC(Cl)=NC=C1 B69526 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 B52872 [0,2,0,0,0,0|1,0,0]=3 1651 B11R1.155 CC(C)(C)C1=CC=CC(Br)=N1 B50227 [0,2,0,0,0,0|2,0,0]=4 1652 B11R1.155 CC(C)(C)C1=CC=CC(N)=C1 B53113 [0,2,0,0,0,0|1,0,0]=3 1653 B11R1.155 CC(C)(C)C1=CC=CC(O)=C1 B39615 [0,2,0,0,0,0|1,0,0]=3 1654 B11R1.155 CC(C)(C)C1=CC=CC([Mg+])=C1 B31782 [0,2,0,0,0,0|1,0,0]=3 1655 B11R1.155 CC(C)(N)C1=CC(Br)=CN=C1 B15440 [0,2,0,0,0,0|2,0,0]=4 1656 B11R1.155 CC(C)(N)C1=CC=CC(F)=C1 F52143 [0,2,0,0,0,0|1,0,0]=3 1657 B11R1.155 CC(C)(O)C1=CC(Br)=NC=C1 B46792 [0,2,0,0,0,0|1,0,0]=3 1658 B11R1.155 CC(C)(O)C1=CC=CC(Br)=C1 B50147 [0,2,0,0,0,0|0,0,0]=2 1659 B11R1.155 CC(C)(O)C1=CC=CC(Br)=N1 B46794 [0,2,0,0,0,0|1,0,0]=3 1660 B11R1.155 CC(C)(O)C1=CC=CC(Cl)=N1 C46802 [0,2,0,0,0,0|1,0,0]=3 1661 B11R1.155 CC(C)(O)C1=NC=CC(Br)=C1 B46793 [0,2,0,0,0,0|1,0,0]=3 1662 B11R1.155 CC(F)(F)C1=CC(Br)=CN=C1 B45317 [0,2,0,0,0,0|2,0,0]=4 1663 B11R1.155 CC1=CC=CC(C(F)(F)F)=C1 M48305 [0,2,0,0,0,0|2,0,0]=4 1664 B11R1.155 CS(=O)(=O)C1=CC(F)=CC=C1 F45921 [0,2,0,0,0,0|1,0,1]=4 1665 B11R1.155 CS(=O)(=O)C1=CC(N)=CC=C1 M46414 [0,2,0,0,0,0|1,0,1]=4 1666 B11R1.155 CS(=O)(=O)C1=CC=CC(Br)=C1 B61603 [0,2,0,0,0,0|1,0,1]=4 1667 B11R1.155 FC(F)(F)C1=CC=CC(Br)=C1 B44278 [0,2,0,0,0,0|2,0,0]=4 1668 B11R1.155 FC(F)(F)C1=CC=CC(I)=C1 K39324 [0,2,0,0,0,0|2,0,0]=4 1669 B11R1.155 FC1=CC(C(F)(F)F)=CC=C1 F39325 [0,2,0,0,0,0|2,0,0]=4 1670 B11R1.155 OC1=CC=CC(C(F)(F)F)=C1 T68328 [0,2,0,0,0,0|2,0,0]=4 1671 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 E36717 [0,2,0,0,0,0|1,0,1]=4 1672 B11R1.53 C=CC1=C(B(O)O)C=CC=C1 V5638 [0,2,0,0,0,0|2,0,0]=4 1673 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 A26401 [0,2,0,0,0,0|0,0,2]=4 1674 B11R1.53 CC(C)C1=C(CBr)C=CC=C1 B11974 [0,2,0,0,0,0|1,0,0]=3 1675 B11R1.53 CCC1=C(B(O)O)C=CC=C1 E3120 [0,2,0,0,0,0|2,0,0]=4 1676 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 E49881 [0,2,0,0,0,0|1,0,1]=4 1677 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 M38276 [0,2,0,0,0,0|0,0,2]=4 1678 B11R1.53 COC1=C(B(O)O)C=CC=C1 M4260 [0,2,0,0,0,0|2,0,0]=4 1679 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 M50344 [0,2,0,0,0,0|1,0,0]=3 1680 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 M60510 [0,2,0,0,0,0|1,0,0]=3 1681 B11R1.53 CSC1=C(B(O)O)C=CC=C1 M4620 [0,2,0,0,0,0|2,0,0]=4 1682 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 M69034 [0,2,0,0,0,0|1,0,1]=4 1683 B11R1.53 C[C@H](O)C1=C(C#N)C=CC=C1 H51759 [0,2,0,0,0,0|0,0,0]=2 1684 B11R1.53 N#CC1=C(B(O)O)C=CC=C1 C2320 [0,2,0,0,0,0|2,0,0]=4 1685 B11R1.53 NCC1=C(B(O)O)C=CC=C1 A46469 [0,2,0,0,0,0|2,0,0]=4 1686 B11R1.53 NCC1=C(B(O)O)C=CC=C1 A69207 [0,2,0,0,0,0|2,0,0]=4 1687 B11R1.53 NNC1=C(C(=O)O)C=CC=C1 H46555 [0,2,0,0,0,0|1,0,1]=4 1688 B11R1.53 O=C(O)C1=C(CCl)C=CC=C1 C48588 [0,2,0,0,0,0|1,0,1]=4 1689 B11R1.53 O=C(O)C1=C(CO)C=CC=C1 H49093 [0,2,0,0,0,0|1,0,1]=4 1690 B11R1.53 OB(O)C1=C(CBr)C=CC=C1 B46233 [0,2,0,0,0,0|2,0,0]=4 1691 B11R1.53 OCC1=C(B(O)O)C=CC=C1 H46444 [0,2,0,0,0,0|2,0,0]=4 1692 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F B48252 [0,2,0,0,0,0|0,0,2]=4 1693 B11R1.156 CC(=O)C1=C(Br)C=CC=C1N A38400 [0,2,0,0,0,0|0,0,2]=4 1694 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O B24263 [0,2,0,0,0,0|0,0,2]=4 1695 B11R1.156 CC(=O)C1=C(C)C=CC=C1C D52784 [0,2,0,0,0,0|0,0,2]=4 1696 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl D48271 [0,2,0,0,0,0|0,0,2]=4 1697 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F C48278 [0,2,0,0,0,0|0,0,2]=4 1698 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O C48601 [0,2,0,0,0,0|0,0,2]=4 1699 B11R1.156 CC(=O)C1=C(F)C=CC=C1F D19087 [0,2,0,0,0,0|0,0,2]=4 1700 B11R1.156 CC(=O)C1=C(F)C=CC=C1N A49050 [0,2,0,0,0,0|0,0,2]=4 1701 B11R1.156 CC(=O)C1=C(F)C=CC=C1O F48624 [0,2,0,0,0,0|0,0,2]=4 1702 B11R1.156 CC(=O)C1=C(O)C=CC=C1C H49900 [0,2,0,0,0,0|0,0,2]=4 1703 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O B48568 [0,2,0,0,0,0|1,0,1]=4 1704 B11R1.156 CC1=CC=CC(C)=C1B(O)O D37725 [0,2,0,0,0,0|2,0,0]=4 1705 B11R1.156 CC1=CC=CC(C)=C1C(=O)O D49883 [0,2,0,0,0,0|1,0,1]=4 1706 B11R1.156 CC1=CC=CC(C)=C1[C@@H](C)N D54186 [0,2,0,0,0,0|1,0,0]=3 1707 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N D54188 [0,2,0,0,0,0|1,0,0]=3 1708 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O C13764 [0,2,0,0,0,0|1,0,1]=4 1709 B11R1.156 CC1=CC=CC(F)=C1C(=O)O F48612 [0,2,0,0,0,0|1,0,1]=4 1710 B11R1.156 CC1=CC=CC(O)=C1C(=O)O H67526 [0,2,0,0,0,0|1,0,1]=4 1711 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1Cl D49231 [0,2,0,0,0,0|1,0,0]=3 1712 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1F C49234 [0,2,0,0,0,0|1,0,0]=3 1713 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1F C49239 [0,2,0,0,0,0|1,0,0]=3 1714 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1F D49636 [0,2,0,0,0,0|1,0,0]=3 1715 B11R1.156 C[C@@H](O)C1=C(Cl)C=NC=C1Cl D64394 [0,2,0,0,0,0|1,0,0]=3 1716 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl D49230 [0,2,0,0,0,0|1,0,0]=3 1717 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl D49233 [0,2,0,0,0,0|1,0,0]=3 1718 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F C49236 [0,2,0,0,0,0|1,0,0]=3 1719 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F C49244 [0,2,0,0,0,0|1,0,0]=3 1720 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F D49632 [0,2,0,0,0,0|1,0,0]=3 1721 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F D49641 [0,2,0,0,0,0|1,0,0]=3 1722 B11R1.156 C[C@H](O)C1=C(Br)C=CC=C1F B49138 [0,2,0,0,0,0|0,0,0]=2 1723 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl D45881 [0,2,0,0,0,0|1,0,0]=3 1724 B11R1.156 C[C@H](O)C1=C(Cl)C=NC=C1Cl D45882 [0,2,0,0,0,0|1,0,0]=3 1725 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F D49154 [0,2,0,0,0,0|0,0,0]=2 1726 B11R1.156 NC1=CC=CC(Br)=C1C(=O)O A37876 [0,2,0,0,0,0|1,0,1]=4 1727 B11R1.156 NC1=CC=CC(Cl)=C1C(=O)O C64945 [0,2,0,0,0,0|1,0,1]=4 1728 B11R1.156 NC1=CC=CC(F)=C1C(=O)O A67399 [0,2,0,0,0,0|1,0,1]=4 1729 B11R1.156 NC1=CC=CC(I)=C1C(=O)O A61453 [0,2,0,0,0,0|1,0,1]=4 1730 B11R1.156 NC1=CC=CC(O)=C1C(=O)O A45839 [0,2,0,0,0,0|1,0,1]=4 1731 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br D38594 [0,2,0,0,0,0|1,0,1]=4 1732 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Cl B44566 [0,2,0,0,0,0|1,0,1]=4 1733 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F B8160 [0,2,0,0,0,0|1,0,1]=4 1734 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl D39338 [0,2,0,0,0,0|1,0,1]=4 1735 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F C69007 [0,2,0,0,0,0|1,0,1]=4 1736 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O C45117 [0,2,0,0,0,0|1,0,1]=4 1737 B11R1.156 O=C(O)C1=C(F)C=CC=C1O F45122 [0,2,0,0,0,0|1,0,1]=4 1738 B11R1.156 O=C(O)C1=C(I)C=CC=C1Br B61212 [0,2,0,0,0,0|1,0,1]=4 1739 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl C37397 [0,2,0,0,0,0|1,0,1]=4 1740 B11R1.156 O=C(O)C1=C(I)C=CC=C1F F44614 [0,2,0,0,0,0|1,0,1]=4 1741 B11R1.156 OB(O)C1=C(Br)C=CC=C1F B42686 [0,2,0,0,0,0|2,0,0]=4 1742 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl D2540 [0,2,0,0,0,0|2,0,0]=4 1743 B11R1.156 OB(O)C1=C(Cl)C=CC=C1F C42692 [0,2,0,0,0,0|2,0,0]=4 1744 B11R1.156 OB(O)C1=C(F)C=CC=C1F D2660 [0,2,0,0,0,0|2,0,0]=4 1745 B11R1.156 OB(O)C1=C(F)C=CC=C1O F42952 [0,2,0,0,0,0|2,0,0]=4 1746 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 D52783 [0,2,0,0,0,0|0,0,2]=4 1747 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 H49901 [0,2,0,0,0,0|0,0,2]=4 1748 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 F52047 [0,2,0,0,0,0|0,0,2]=4 1749 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 A61143 [0,2,0,0,0,0|0,0,2]=4 1750 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 H27971 [0,2,0,0,0,0|0,0,2]=4 1751 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 A69212 [0,2,0,0,0,0|0,0,2]=4 1752 B11R1.159 CC(=O)C1=CC=CC(Br)=C1F B14139 [0,2,0,0,0,0|0,0,2]=4 1753 B11R1.159 CC(=O)C1=CC=CC(Br)=C1O B48580 [0,2,0,0,0,0|0,0,2]=4 1754 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl D48270 [0,2,0,0,0,0|0,0,2]=4 1755 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F C69015 [0,2,0,0,0,0|0,0,2]=4 1756 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N A49036 [0,2,0,0,0,0|0,0,2]=4 1757 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O C48602 [0,2,0,0,0,0|0,0,2]=4 1758 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br B48251 [0,2,0,0,0,0|0,0,2]=4 1759 B11R1.159 CC(=O)C1=CC=CC(F)=C1Cl C48276 [0,2,0,0,0,0|0,0,2]=4 1760 B11R1.159 CC(=O)C1=CC=CC(F)=C1F D48286 [0,2,0,0,0,0|0,0,2]=4 1761 B11R1.159 CC(=O)C1=CC=CC(F)=C1O F61654 [0,2,0,0,0,0|0,0,2]=4 1762 B11R1.159 CC(=O)C1=CC=CC(N)=C1F A49051 [0,2,0,0,0,0|0,0,2]=4 1763 B11R1.159 CC(C)C1=CC=CC(N)=C1F F50249 [0,2,0,0,0,0|1,0,0]=3 1764 B11R1.159 CC1=C(B(O)O)C=CC=C1N A46470 [0,2,0,0,0,0|2,0,0]=4 1765 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O B48569 [0,2,0,0,0,0|1,0,1]=4 1766 B11R1.159 CC1=C(C(=O)O)C=CC=C1N A39516 [0,2,0,0,0,0|1,0,1]=4 1767 B11R1.159 CC1=C(C(=O)O)C=CC=C1O H69264 [0,2,0,0,0,0|1,0,1]=4 1768 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O C46238 [0,2,0,0,0,0|2,0,0]=4 1769 B11R1.159 CC1=C(Cl)C=CC=C1C(=O)O C67478 [0,2,0,0,0,0|1,0,1]=4 1770 B11R1.159 CC1=C(F)C(B(O)O)=CC=C1 F46240 [0,2,0,0,0,0|2,0,0]=4 1771 B11R1.159 CC1=C(F)C=CC=C1B(O)O F46241 [0,2,0,0,0,0|2,0,0]=4 1772 B11R1.159 CC1=C(F)C=CC=C1C(=O)O F38507 [0,2,0,0,0,0|1,0,1]=4 1773 B11R1.159 CC1=C(N)C(C(C)C)=NC=C1 P69106 [0,2,0,0,0,0|2,0,0]=4 1774 B11R1.159 CC1=CC=CC(B(O)O)=C1C D2920 [0,2,0,0,0,0|2,0,0]=4 1775 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br B48566 [0,2,0,0,0,0|1,0,1]=4 1776 B11R1.159 CC1=CC=CC(C(=O)O)=C1C D65554 [0,2,0,0,0,0|1,0,1]=4 1777 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl C48591 [0,2,0,0,0,0|1,0,1]=4 1778 B11R1.159 CC1=CC=CC(C(=O)O)=C1F F48609 [0,2,0,0,0,0|1,0,1]=4 1779 B11R1.159 CC1=CC=CC(C(=O)O)=C1I K48632 [0,2,0,0,0,0|1,0,1]=4 1780 B11R1.159 C[C@@H](N)C1=CC=CC(Cl)=C1F C49240 [0,2,0,0,0,0|1,0,0]=3 1781 B11R1.159 C[C@@H](N)C1=CC=CC(F)=C1F D49248 [0,2,0,0,0,0|1,0,0]=3 1782 B11R1.159 C[C@@H](N)C1=CC=CC(F)=C1F D49633 [0,2,0,0,0,0|1,0,0]=3 1783 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1Cl D60956 [0,2,0,0,0,0|1,0,0]=3 1784 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F C49237 [0,2,0,0,0,0|1,0,0]=3 1785 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1Cl C49235 [0,2,0,0,0,0|1,0,0]=3 1786 B11R1.159 C[C@H](N)C1=CC=CC(F)=C1F D49639 [0,2,0,0,0,0|1,0,0]=3 1787 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O A45327 [0,2,0,0,0,0|1,0,1]=4 1788 B11R1.159 NC1=C(C(=O)O)C=CC=C1O A38066 [0,2,0,0,0,0|1,0,1]=4 1789 B11R1.159 NC1=C(Cl)C(C(=O)O)=CC=C1 A45353 [0,2,0,0,0,0|1,0,1]=4 1790 B11R1.159 NC1=C(Cl)C=CC=C1C(=O)O A39383 [0,2,0,0,0,0|1,0,1]=4 1791 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 A45376 [0,2,0,0,0,0|1,0,1]=4 1792 B11R1.159 NC1=C(F)C(C(F)F)=CC=C1 D45325 [0,2,0,0,0,0|2,0,0]=4 1793 B11R1.159 NC1=C(F)C=CC=C1C(=O)O A45375 [0,2,0,0,0,0|1,0,1]=4 1794 B11R1.159 NC1=C(I)C=CC=C1C(=O)O A45393 [0,2,0,0,0,0|1,0,1]=4 1795 B11R1.159 NC1=CC=CC(C(=O)O)=C1N D45990 [0,2,0,0,0,0|1,0,1]=4 1796 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Br D44561 [0,2,0,0,0,0|1,0,1]=4 1797 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl B44567 [0,2,0,0,0,0|1,0,1]=4 1798 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F B14138 [0,2,0,0,0,0|1,0,1]=4 1799 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I B38866 [0,2,0,0,0,0|1,0,1]=4 1800 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O B45111 [0,2,0,0,0,0|1,0,1]=4 1801 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br B36699 [0,2,0,0,0,0|1,0,1]=4 1802 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl D39337 [0,2,0,0,0,0|1,0,1]=4 1803 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F C44590 [0,2,0,0,0,0|1,0,1]=4 1804 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I C44599 [0,2,0,0,0,0|1,0,1]=4 1805 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O C45118 [0,2,0,0,0,0|1,0,1]=4 1806 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br B37233 [0,2,0,0,0,0|1,0,1]=4 1807 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl C44588 [0,2,0,0,0,0|1,0,1]=4 1808 B11R1.159 O=C(O)C1=CC=CC(F)=C1F D44604 [0,2,0,0,0,0|1,0,1]=4 1809 B11R1.159 O=C(O)C1=CC=CC(F)=C1I F44615 [0,2,0,0,0,0|1,0,1]=4 1810 B11R1.159 O=C(O)C1=CC=CC(F)=C1O F68862 [0,2,0,0,0,0|1,0,1]=4 1811 B11R1.159 O=C(O)C1=CC=CC(I)=C1Br B44581 [0,2,0,0,0,0|1,0,1]=4 1812 B11R1.159 O=C(O)C1=CC=CC(I)=C1F F44612 [0,2,0,0,0,0|1,0,1]=4 1813 B11R1.159 OB(O)C1=CC=CC(Br)=C1F B42687 [0,2,0,0,0,0|2,0,0]=4 1814 B11R1.159 OB(O)C1=CC=CC(Cl)=C1Cl D2480 [0,2,0,0,0,0|2,0,0]=4 1815 B11R1.159 OB(O)C1=CC=CC(Cl)=C1F C42689 [0,2,0,0,0,0|2,0,0]=4 1816 B11R1.159 OB(O)C1=CC=CC(F)=C1Br B61357 [0,2,0,0,0,0|2,0,0]=4 1817 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl C11182 [0,2,0,0,0,0|2,0,0]=4 1818 B11R1.159 OB(O)C1=CC=CC(I)=C1F F42693 [0,2,0,0,0,0|2,0,0]=4 1819 B11R1.159 OB(O)C1=CC=CC(O)=C1F F42950 [0,2,0,0,0,0|2,0,0]=4 1820 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 B48243 [0,2,0,0,0,0|0,0,2]=4 1821 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 B48249 [0,2,0,0,0,0|0,0,2]=4 1822 B11R1.167 CC(=O)C1=C(C)C=CC(Br)=C1 B61483 [0,2,0,0,0,0|0,0,2]=4 1823 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 F62666 [0,2,0,0,0,0|0,0,2]=4 1824 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 B48247 [0,2,0,0,0,0|0,0,2]=4 1825 B11R1.167 CC(=O)C1=C(F)C=CC(Cl)=C1 C48279 [0,2,0,0,0,0|0,0,2]=4 1826 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 D48287 [0,2,0,0,0,0|0,0,2]=4 1827 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 A49053 [0,2,0,0,0,0|0,0,2]=4 1828 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 F48623 [0,2,0,0,0,0|0,0,2]=4 1829 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 F48292 [0,2,0,0,0,0|0,0,2]=4 1830 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 A49025 [0,2,0,0,0,0|0,0,2]=4 1831 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 A49038 [0,2,0,0,0,0|0,0,2]=4 1832 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 A49049 [0,2,0,0,0,0|0,0,2]=4 1833 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 B3183 [0,2,0,0,0,0|0,0,2]=4 1834 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 H49899 [0,2,0,0,0,0|0,0,2]=4 1835 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 C48603 [0,2,0,0,0,0|0,0,2]=4 1836 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 F39496 [0,2,0,0,0,0|0,0,2]=4 1837 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 A49291 [0,2,0,0,0,0|0,0,2]=4 1838 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 D39506 [0,2,0,0,0,0|0,0,2]=4 1839 B11R1.167 CC(C)C1=C(F)C=CC(I)=C1 F49705 [0,2,0,0,0,0|1,0,0]=3 1840 B11R1.167 CC(C)C1=C(I)C=CC(Br)=C1 B49703 [0,2,0,0,0,0|1,0,0]=3 1841 B11R1.167 CC1=C(B(O)O)C=C(Cl)C=C1 C2230 [0,2,0,0,0,0|2,0,0]=4 1842 B11R1.167 CC1=C(B(O)O)C=C(F)C=C1 F3332 [0,2,0,0,0,0|2,0,0]=4 1843 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 B25445 [0,2,0,0,0,0|1,0,1]=4 1844 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 C39492 [0,2,0,0,0,0|1,0,1]=4 1845 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 F48616 [0,2,0,0,0,0|1,0,1]=4 1846 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 K48634 [0,2,0,0,0,0|1,0,1]=4 1847 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 A38108 [0,2,0,0,0,0|1,0,1]=4 1848 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 H49098 [0,2,0,0,0,0|1,0,1]=4 1849 B11R1.167 CC1=C([C@H](C)O)C=C(Cl)C=C1 C50163 [0,2,0,0,0,0|0,0,0]=2 1850 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 D2940 [0,2,0,0,0,0|2,0,0]=4 1851 B11R1.167 CC1=CC(B(O)O)=C(Cl)C=C1 C69025 [0,2,0,0,0,0|2,0,0]=4 1852 B11R1.167 CC1=CC(B(O)O)=C(F)C=C1 F3284 [0,2,0,0,0,0|2,0,0]=4 1853 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 H46445 [0,2,0,0,0,0|2,0,0]=4 1854 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 B48567 [0,2,0,0,0,0|1,0,1]=4 1855 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 D39532 [0,2,0,0,0,0|1,0,1]=4 1856 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 C48592 [0,2,0,0,0,0|1,0,1]=4 1857 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 F48611 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 I24082 [0,2,0,0,0,0|1,0,1]=4 1859 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 A67448 [0,2,0,0,0,0|1,0,1]=4 1860 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 H60608 [0,2,0,0,0,0|1,0,1]=4 1861 B11R1.167 CN(C)C1=C(I)C=CC(O)=C1 D46822 [0,2,0,0,0,0|2,0,0]=4 1862 B11R1.167 C[C@@H](N)C1=C(F)C=CC(F)=C1 D49635 [0,2,0,0,0,0|1,0,0]=3 1863 B11R1.167 C[C@H](N)C1=C(F)C=CC(Cl)=C1 C49238 [0,2,0,0,0,0|1,0,0]=3 1864 B11R1.167 C[C@H](O)C1=C(Cl)C=CC(Cl)=C1 D68314 [0,2,0,0,0,0|0,0,0]=2 1865 B11R1.167 C[C@H](O)C1=C(F)C=CC(Br)=C1 B49140 [0,2,0,0,0,0|0,0,0]=2 1866 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 F62425 [0,2,0,0,0,0|0,0,0]=2 1867 B11R1.167 NC1=C(B(O)O)C=C(F)C=C1 A62205 [0,2,0,0,0,0|2,0,0]=4 1868 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 B68128 [0,2,0,0,0,0|1,0,1]=4 1869 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 A69316 [0,2,0,0,0,0|1,0,1]=4 1870 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 A69260 [0,2,0,0,0,0|1,0,1]=4 1871 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 A39389 [0,2,0,0,0,0|1,0,1]=4 1872 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 A67447 [0,2,0,0,0,0|1,0,1]=4 1873 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 A45331 [0,2,0,0,0,0|1,0,1]=4 1874 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 A45355 [0,2,0,0,0,0|1,0,1]=4 1875 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 A45380 [0,2,0,0,0,0|1,0,1]=4 1876 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 D44563 [0,2,0,0,0,0|1,0,1]=4 1877 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 B44565 [0,2,0,0,0,0|1,0,1]=4 1878 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 B39335 [0,2,0,0,0,0|1,0,1]=4 1879 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 B44583 [0,2,0,0,0,0|1,0,1]=4 1880 B11R1.167 O=C(O)C1=C(Br)C=CC(O)=C1 B45110 [0,2,0,0,0,0|1,0,1]=4 1881 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 B39334 [0,2,0,0,0,0|1,0,1]=4 1882 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 D68554 [0,2,0,0,0,0|1,0,1]=4 1883 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 C44589 [0,2,0,0,0,0|1,0,1]=4 1884 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 C44598 [0,2,0,0,0,0|1,0,1]=4 1885 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 C37903 [0,2,0,0,0,0|1,0,1]=4 1886 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 B44577 [0,2,0,0,0,0|1,0,1]=4 1887 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 C37880 [0,2,0,0,0,0|1,0,1]=4 1888 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 F17987 [0,2,0,0,0,0|1,0,1]=4 1889 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 B13763 [0,2,0,0,0,0|1,0,1]=4 1890 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 C44603 [0,2,0,0,0,0|1,0,1]=4 1891 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 F28645 [0,2,0,0,0,0|1,0,1]=4 1892 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 D68213 [0,2,0,0,0,0|1,0,1]=4 1893 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 H45127 [0,2,0,0,0,0|1,0,1]=4 1894 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 B67995 [0,2,0,0,0,0|1,0,1]=4 1895 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 F68863 [0,2,0,0,0,0|1,0,1]=4 1896 B11R1.167 O=C(O)C1=C(O)C=CC(I)=C1 H62399 [0,2,0,0,0,0|1,0,1]=4 1897 B11R1.167 O=C(O)C1=C(S)C=CC(Br)=C1 B45087 [0,2,0,0,0,0|1,0,1]=4 1898 B11R1.167 OB(O)C1=C(Br)C=CC(Br)=C1 D42682 [0,2,0,0,0,0|2,0,0]=4 1899 B11R1.167 OB(O)C1=C(Br)C=CC(F)=C1 B42685 [0,2,0,0,0,0|2,0,0]=4 1900 B11R1.167 OB(O)C1=C(Cl)C=CC(Cl)=C1 D2520 [0,2,0,0,0,0|2,0,0]=4 1901 B11R1.167 OB(O)C1=C(Cl)C=CC(F)=C1 C42691 [0,2,0,0,0,0|2,0,0]=4 1902 B11R1.167 OB(O)C1=C(Cl)C=CC(O)=C1 C63873 [0,2,0,0,0,0|2,0,0]=4 1903 B11R1.167 OB(O)C1=C(F)C=CC(Br)=C1 B68733 [0,2,0,0,0,0|2,0,0]=4 1904 B11R1.167 OB(O)C1=C(F)C=CC(Cl)=C1 C2202 [0,2,0,0,0,0|2,0,0]=4 1905 B11R1.167 OB(O)C1=C(F)C=CC(F)=C1 D2640 [0,2,0,0,0,0|2,0,0]=4 1906 B11R1.167 OB(O)C1=C(F)C=CC(O)=C1 F42951 [0,2,0,0,0,0|2,0,0]=4 1907 B11R1.167 OB(O)C1=C(O)C=CC(F)=C1 F3216 [0,2,0,0,0,0|2,0,0]=4 1908 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 D38007 [0,2,0,0,0,0|0,0,2]=4 1909 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 B20352 [0,2,0,0,0,0|0,0,2]=4 1910 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 B48253 [0,2,0,0,0,0|0,0,2]=4 1911 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 B52033 [0,2,0,0,0,0|0,0,2]=4 1912 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 D52785 [0,2,0,0,0,0|0,0,2]=4 1913 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 D48272 [0,2,0,0,0,0|0,0,2]=4 1914 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 D48284 [0,2,0,0,0,0|0,0,2]=4 1915 B11R1.74 CC(=O)C1=CC(O)=CC(C)=C1 H49902 [0,2,0,0,0,0|0,0,2]=4 1916 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 D49099 [0,2,0,0,0,0|0,0,2]=4 1917 B11R1.74 CC1=CC(B(O)O)=CC(Br)=C1 B46235 [0,2,0,0,0,0|2,0,0]=4 1918 B11R1.74 CC1=CC(B(O)O)=CC(Cl)=C1 C46239 [0,2,0,0,0,0|2,0,0]=4 1919 B11R1.74 CC1=CC(B(O)O)=CC(F)=C1 F46242 [0,2,0,0,0,0|2,0,0]=4 1920 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 B48571 [0,2,0,0,0,0|1,0,1]=4 1921 B11R1.74 CC1=CC(C(=O)O)=CC(N)=C1 A49283 [0,2,0,0,0,0|1,0,1]=4 1922 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 H49096 [0,2,0,0,0,0|1,0,1]=4 1923 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 D2980 [0,2,0,0,0,0|2,0,0]=4 1924 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 C48594 [0,2,0,0,0,0|1,0,1]=4 1925 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 F48614 [0,2,0,0,0,0|1,0,1]=4 1926 B11R1.74 CC1=CC(I)=CC(C(=O)O)=C1 K48633 [0,2,0,0,0,0|1,0,1]=4 1927 B11R1.74 C[C@@H](N)C1=CC(Cl)=CC(F)=C1 C49242 [0,2,0,0,0,0|1,0,0]=3 1928 B11R1.74 C[C@@H](N)C1=CC(F)=CC(F)=C1 D49251 [0,2,0,0,0,0|1,0,0]=3 1929 B11R1.74 C[C@@H](N)C1=CC(F)=CC(F)=C1 D49638 [0,2,0,0,0,0|1,0,0]=3 1930 B11R1.74 C[C@H](N)C1=CC(Cl)=CC(F)=C1 C49245 [0,2,0,0,0,0|1,0,0]=3 1931 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 D49643 [0,2,0,0,0,0|1,0,0]=3 1932 B11R1.74 NC1=CC(C(=O)O)=CC(Br)=C1 A45329 [0,2,0,0,0,0|1,0,1]=4 1933 B11R1.74 NC1=CC(C(=O)O)=CC(Cl)=C1 A45354 [0,2,0,0,0,0|1,0,1]=4 1934 B11R1.74 NC1=CC(C(=O)O)=CC(F)=C1 A38712 [0,2,0,0,0,0|1,0,1]=4 1935 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 A46552 [0,2,0,0,0,0|1,0,1]=4 1936 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 D39333 [0,2,0,0,0,0|1,0,1]=4 1937 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 B44569 [0,2,0,0,0,0|1,0,1]=4 1938 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 B44575 [0,2,0,0,0,0|1,0,1]=4 1939 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 B68739 [0,2,0,0,0,0|1,0,1]=4 1940 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 D64931 [0,2,0,0,0,0|1,0,1]=4 1941 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 C44592 [0,2,0,0,0,0|1,0,1]=4 1942 B11R1.74 O=C(O)C1=CC(Cl)=CC(O)=C1 C45119 [0,2,0,0,0,0|1,0,1]=4 1943 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 D68859 [0,2,0,0,0,0|1,0,1]=4 1944 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 F45123 [0,2,0,0,0,0|1,0,1]=4 1945 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 B44585 [0,2,0,0,0,0|1,0,1]=4 1946 B11R1.74 O=C(O)C1=CC(I)=CC(Cl)=C1 C44600 [0,2,0,0,0,0|1,0,1]=4 1947 B11R1.74 O=C(O)C1=CC(I)=CC(F)=C1 F36855 [0,2,0,0,0,0|1,0,1]=4 1948 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 D44618 [0,2,0,0,0,0|1,0,1]=4 1949 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 D2460 [0,2,0,0,0,0|2,0,0]=4 1950 B11R1.74 OB(O)C1=CC(Br)=CC(Cl)=C1 B42683 [0,2,0,0,0,0|2,0,0]=4 1951 B11R1.74 OB(O)C1=CC(Cl)=CC(Cl)=C1 D2580 [0,2,0,0,0,0|2,0,0]=4 1952 B11R1.74 OB(O)C1=CC(Cl)=CC(F)=C1 C42690 [0,2,0,0,0,0|2,0,0]=4 1953 B11R1.74 OB(O)C1=CC(Cl)=CC(O)=C1 C42948 [0,2,0,0,0,0|2,0,0]=4 1954 B11R1.74 OB(O)C1=CC(F)=CC(F)=C1 D2700 [0,2,0,0,0,0|2,0,0]=4 1955 B11R1.74 OB(O)C1=CC(F)=CC(O)=C1 F42954 [0,2,0,0,0,0|2,0,0]=4 1956 B11R1.266 C#CC1=CC=CC(B(O)O)=C1 E7799 [0,2,0,0,0,0|2,0,0]=4 1957 B11R1.266 C#CC1=CC=CC(C(=O)O)=C1 E50962 [0,2,0,0,0,0|1,0,1]=4 1958 B11R1.266 C=CC1=CC=CC(B(O)O)=C1 V5639 [0,2,0,0,0,0|2,0,0]=4 1959 B11R1.266 CC(=O)C1=CC(C#N)=CC=C1 A51159 [0,2,0,0,0,0|0,0,2]=4 1960 B11R1.266 CC(C)C1=CC=CC(C#N)=N1 C12032 [0,2,0,0,0,0|2,0,0]=4 1961 B11R1.266 CC(C)C1=CC=CC(C=O)=C1 P52779 [0,2,0,0,0,0|1,0,0]=3 1962 B11R1.266 CC(C)C1=CC=CC(CBr)=C1 B11975 [0,2,0,0,0,0|1,0,0]=3 1963 B11R1.266 CC(C)C1=NC=CC(C#N)=C1 P63847 [0,2,0,0,0,0|2,0,0]=4 1964 B11R1.266 CCC1=CC=CC(B(O)O)=C1 E2596 [0,2,0,0,0,0|2,0,0]=4 1965 B11R1.266 CN(C)C1=CC=CC(C#N)=C1 D49711 [0,2,0,0,0,0|2,0,0]=4 1966 B11R1.266 CN(C)C1=CC=CC(C=O)=C1 D50021 [0,2,0,0,0,0|2,0,0]=4 1967 B11R1.266 COC1=CC(B(O)O)=CC=C1 M4280 [0,2,0,0,0,0|2,0,0]=4 1968 B11R1.266 COC1=CC(N(C)C)=CC=C1 M50347 [0,2,0,0,0,0|2,0,0]=4 1969 B11R1.266 COC1=CC([C@@H](C)N)=CC=C1 M50354 [0,2,0,0,0,0|1,0,0]=3 1970 B11R1.266 COC1=CC([C@H](C)N)=CC=C1 M52175 [0,2,0,0,0,0|1,0,0]=3 1971 B11R1.266 COC1=CC([C@H](C)N)=CC=C1 M64083 [0,2,0,0,0,0|1,0,0]=3 1972 B11R1.266 COC1=CC([C@H](C)N)=CC=C1 M64469 [0,2,0,0,0,0|1,0,0]=3 1973 B11R1.266 COC1=CC([C@H](C)O)=CC=C1 M50283 [0,2,0,0,0,0|0,0,0]=2 1974 B11R1.266 COC1=CC=CC(C(C)=O)=C1 M27970 [0,2,0,0,0,0|0,0,2]=4 1975 B11R1.266 COC1=NC=CC([C@@H](C)N)=C1 M49669 [0,2,0,0,0,0|2,0,0]=4 1976 B11R1.266 COC1=NC=CC([C@H](C)N)=C1 M49540 [0,2,0,0,0,0|2,0,0]=4 1977 B11R1.266 CSC1=CC(B(O)O)=CC=C1 M4640 [0,2,0,0,0,0|2,0,0]=4 1978 B11R1.266 CSC1=CC(C(=O)O)=CC=C1 M49088 [0,2,0,0,0,0|1,0,1]=4 1979 B11R1.266 C[C@@H](N)C1=CC=CC(C#N)=C1 A52057 [0,2,0,0,0,0|1,0,0]=3 1980 B11R1.266 N#CC1=CC=CC(B(O)O)=C1 C2340 [0,2,0,0,0,0|2,0,0]=4 1981 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 C39460 [0,2,0,0,0,0|1,0,1]=4 1982 B11R1.266 NCC1=CC=CC(B(O)O)=C1 A1260 [0,2,0,0,0,0|2,0,0]=4 1983 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 A49646 [0,2,0,0,0,0|1,0,1]=4 1984 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 H62311 [0,2,0,0,0,0|1,0,1]=4 1985 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 B38629 [0,2,0,0,0,0|1,0,1]=4 1986 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 C48590 [0,2,0,0,0,0|1,0,1]=4 1987 B11R1.266 O=CC1=CC(B(O)O)=CC=C1 F3520 [0,2,0,0,0,0|2,0,0]=4 1988 B11R1.266 O=CC1=CC=CC(C(=O)O)=C1 F27989 [0,2,0,0,0,0|1,0,1]=4 1989 B11R1.266 OB(O)C1=CC=CC(CBr)=C1 B46234 [0,2,0,0,0,0|2,0,0]=4 1990 B11R1.266 OCC1=CC(B(O)O)=CC=C1 H3700 [0,2,0,0,0,0|2,0,0]=4 1991 B9R2.50 C1=CC2=C(C=C1)CC2 B68912 [1,0,0,1,0,0|0,0,0]=2 1992 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 P22144 [0,0,0,1,0,1|1,0,0]=3 1993 B11R2.4 N[C@H]1C[C@H]1C2=CC=CC=C2 P24205 [0,0,0,1,0,1|1,0,0]=3 1994 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 B51041 [0,0,0,1,0,1|1,0,1]=4 1995 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 B47828 [0,0,0,1,0,1|1,0,1]=4 1996 B11R2.10 BrC1CC2=C(C=CC=C2)C1 B51667 [0,0,0,1,0,1|1,0,0]=3 1997 B11R2.10 CC1=CC2=C(C=CC=C2)C1 M38071 [0,0,0,1,0,1|1,0,1]=4 1998 B11R2.10 CC1=CC2=C(C=CC=C2)N1 M13893 [0,0,0,1,0,1|1,0,1]=4 1999 B11R2.10 CC1=CC2=C(C=CC=C2)S1 M51663 [0,0,0,1,0,1|0,1,1]=4 2000 B11R2.10 CC1=NC2=C(C=CC=C2)O1 M63131 [0,0,0,1,0,1|0,0,1]=3 2001 B11R2.10 CC1=NC2=C(C=CC=C2)S1 M39486 [0,0,0,1,0,1|0,1,1]=4 2002 B11R2.10 CC1=NC2=C(C=CC=N2)O1 M38652 [0,0,0,1,0,1|1,0,1]=4 2003 B11R2.10 CN1C=C2C=CC=CC2=N1 M14460 [0,0,0,1,0,1|2,0,0]=4 2004 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 M13896 [0,0,0,1,0,1|1,0,0]=3 2005 B11R2.10 C[C@H]1CC2=C(C=CC=C2)N1 M15830 [0,0,0,1,0,1|1,0,0]=3 2006 B11R2.10 C[C@H]1CC2=CC=CN=C2N1 D64809 [0,0,0,1,0,1|2,0,0]=4 2007 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 C44527 [0,0,0,1,0,1|1,0,1]=4 2008 B11R2.10 NC1=NC2=C(C=CC=C2)O1 B45208 [0,0,0,1,0,1|1,0,1]=4 2009 B11R2.10 O=C1CC2=C(C=CC=C2)C1 K24552 [0,0,0,1,0,1|0,0,2]=4 2010 B11R2.10 O=C1OC2=C(C=CC=C2)O1 B44621 [0,0,0,1,0,1|1,0,1]=4 2011 B11R2.10 OC1CC2=C(C=CC=C2)C1 D67665 [0,0,0,1,0,1|0,0,0]=2 2012 B11R2.34 BrC1=CC=C(C2CC2)C=C1 B32033 [0,1,0,1,0,0|1,0,0]=3 2013 B11R2.34 BrC1=CN=C(C2CC2)C=C1 B38917 [0,1,0,1,0,0|2,0,0]=4 2014 B11R2.34 BrC1=NC=C(C2CC2)C=C1 B48875 [0,1,0,1,0,0|2,0,0]=4 2015 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 F62188 [0,1,0,1,0,0|0,0,0]=2 2016 B11R2.34 FC1=NC=C(C2CC2)C=C1 C48887 [0,1,0,1,0,0|2,0,0]=4 2017 B11R2.34 NC1=CC=C(C2CC2)C=C1 C52090 [0,1,0,1,0,0|1,0,0]=3 2018 B11R2.34 NC1=CN=C(C2CC2)C=C1 C46642 [0,1,0,1,0,0|2,0,0]=4 2019 B11R2.34 NC1=NC=C(C2CC2)C=C1 C46640 [0,1,0,1,0,0|2,0,0]=4 2020 B11R2.34 OC1=CC=C(C2CC2)C=C1 C49871 [0,1,0,1,0,0|1,0,0]=3 2021 B11R2.34 OC1=NC=C(C2CC2)C=C1 C37180 [0,1,0,1,0,0|2,0,0]=4 2022 B11R2.1 BrC1=COC2=C1C=CC=C2 B47829 [0,1,0,1,0,0|1,0,1]=4 2023 B11R2.1 CC1=CCC2=C1C=CC=C2 M52270 [0,1,0,1,0,0|1,0,1]=4 2024 B11R2.1 CC1=CNC2=C1C=CC=C2 M13894 [0,1,0,1,0,0|1,0,1]=4 2025 B11R2.1 CC1=NNC2=C1C=CC=C2 M1829 [0,1,0,1,0,0|1,0,1]=4 2026 B11R2.1 CC1=NOC2=C1C=CC=C2 M68053 [0,1,0,1,0,0|0,0,1]=3 2027 B11R2.1 CN1C=CC2=C1C=CC=C2 M68120 [0,1,0,1,0,0|2,0,0]=4 2028 B11R2.1 CN1C=NC2=C1C=CC=C2 M48776 [0,1,0,1,0,0|2,0,0]=4 2029 B11R2.1 CN1N=CC2=C1C=CC=C2 M14463 [0,1,0,1,0,0|2,0,0]=4 2030 B11R2.1 ClC1=NOC2=C1C=CC=C2 C44531 [0,1,0,1,0,0|1,0,1]=4 2031 B11R2.1 NC1=NCC2=C1C=CC=C2 K49609 [0,1,0,1,0,0|1,0,1]=4 2032 B11R2.1 NC1=NCC2=C1C=CC=C2 K64548 [0,1,0,1,0,0|1,0,1]=4 2033 B11R2.1 NC1=NOC2=C1C=CC=C2 B45214 [0,1,0,1,0,0|1,0,1]=4 2034 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 D37063 [0,1,0,1,0,0|1,0,0]=3 2035 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 D52091 [0,1,0,1,0,0|1,0,0]=3 2036 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 D52092 [0,1,0,1,0,0|1,0,0]=3 2037 B11R2.1 N[C@H]1CCC2=CC=CN=C21 D49490 [0,1,0,1,0,0|2,0,0]=4 2038 B11R2.1 N[C@H]1COC2=NC=CC=C21 D64566 [0,1,0,1,0,0|2,0,0]=4 2039 B11R2.1 O=C1NCC2=C1C=CC=C2 I12007 [0,1,0,1,0,0|0,0,2]=4 2040 B11R2.1 OB1OCC2=C1C=CC=C2 H3680 [0,1,0,1,0,0|1,0,0]=3 2041 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 D68576 [0,1,0,1,0,0|0,0,0]=2 2042 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D60804 [0,1,0,1,0,0|0,0,0]=2 2043 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D68574 [0,1,0,1,0,0|0,0,0]=2 2044 B11R2.1 O[C@H]1CCC2=CC=CN=C21 D67550 [0,1,0,1,0,0|1,0,0]=3 2045 B11R2.40 NC1(C2=CC=CC=C2)CC1 P64329 [0,1,0,1,0,0|1,0,0]=3 2046 B11R2.40 NC1(C2=CC=CN=C2)CC1 P49656 [0,1,0,1,0,0|2,0,0]=4 2047 B11R2.40 NC1(C2=CC=NC=C2)CC1 P8762 [0,1,0,1,0,0|2,0,0]=4 2048 B11R2.40 NC1(C2=NC=CC=C2)CC1 P61647 [0,1,0,1,0,0|2,0,0]=4 2049 B11R2.239 C1=CN=CC(C2CNC2)=C1 A49655 [0,1,0,1,0,0|2,0,0]=4 2050 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 B49879 [0,1,0,1,0,0|0,0,0]=2 2051 B11R2.55 BrC1=C(C2CC2)N=CC=C1 B48876 [0,1,0,1,0,0|2,0,0]=4 2052 B11R2.55 BrC1=NC=CC=C1C2CC2 B48874 [0,1,0,1,0,0|2,0,0]=4 2053 B11R2.55 ClC1=C(C2CC2)C=NC=C1 C48885 [0,1,0,1,0,0|2,0,0]=4 2054 B11R2.55 ClC1=NC=CC=C1C2CC2 C48880 [0,1,0,1,0,0|2,0,0]=4 2055 B11R2.55 FC1=NC=CC=C1C2CC2 C48886 [0,1,0,1,0,0|2,0,0]=4 2056 B11R2.55 NC1=C(C2CC2)C=CC=C1 C37591 [0,1,0,1,0,0|1,0,0]=3 2057 B11R2.55 NC1=NC=CC=C1C2CC2 C46639 [0,1,0,1,0,0|2,0,0]=4 2058 B11R2.55 O=C1NC=CC=C1C2CC2 C49264 [0,1,0,1,0,0|2,0,0]=4 2059 B11R2.35 BrC1=CC(C2CC2)=CC=C1 B67707 [0,1,0,1,0,0|1,0,0]=3 2060 B11R2.35 BrC1=CC(C2CC2)=NC=C1 B37241 [0,1,0,1,0,0|2,0,0]=4 2061 B11R2.35 BrC1=CN=CC(C2CC2)=C1 B37616 [0,1,0,1,0,0|2,0,0]=4 2062 B11R2.35 ClC1=NC=CC(C2CC2)=C1 C21734 [0,1,0,1,0,0|2,0,0]=4 2063 B11R2.35 NC1=CC(C2CC2)=CC=C1 C49975 [0,1,0,1,0,0|1,0,0]=3 2064 B11R2.35 NC1=CC(C2CC2)=CN=C1 C46641 [0,1,0,1,0,0|2,0,0]=4 2065 B7R1.1 BrCC1=CSC=C1 B60823 [1,0,0,0,1,0|2,0,0]=4 2066 B7R1.1 CCC1=NC=CN1 E68629 [1,0,0,0,1,0|2,0,0]=4 2067 B7R1.1 COC1=CC=CS1 M41123 [1,0,0,0,1,0|2,0,0]=4 2068 B7R1.1 COC1=CSC=C1 M41124 [1,0,0,0,1,0|2,0,0]=4 2069 B7R1.1 NCC1=CC=CN1 P41359 [1,0,0,0,1,0|2,0,0]=4 2070 B7R1.1 NCC1=CC=CS1 A12813 [1,0,0,0,1,0|2,0,0]=4 2071 B7R1.1 NCC1=CNC=C1 P26218 [1,0,0,0,1,0|2,0,0]=4 2072 B7R1.1 NCC1=CSC=C1 T41357 [1,0,0,0,1,0|2,0,0]=4 2073 B7R1.1 OCC1=CC=CS1 T12815 [1,0,0,0,1,0|1,0,0]=3 2074 B7R1.1 OCC1=CC=NO1 K40159 [1,0,0,0,1,0|2,0,0]=4 2075 B7R1.1 OCC1=CN=CN1 I14077 [1,0,0,0,1,0|2,0,0]=4 2076 B7R1.1 OCC1=CN=CO1 X14033 [1,0,0,0,1,0|2,0,0]=4 2077 B7R1.1 OCC1=CN=CS1 T2166 [1,0,0,0,1,0|2,0,0]=4 2078 B7R1.1 OCC1=CNC=N1 H2067 [1,0,0,0,1,0|2,0,0]=4 2079 B7R1.1 OCC1=CNN=C1 H1729 [1,0,0,0,1,0|2,0,0]=4 2080 B7R1.1 OCC1=COC=C1 F41115 [1,0,0,0,1,0|1,0,0]=3 2081 B7R1.1 OCC1=COC=N1 O7923 [1,0,0,0,1,0|2,0,0]=4 2082 B7R1.1 OCC1=CON=C1 H14705 [1,0,0,0,1,0|2,0,0]=4 2083 B7R1.1 OCC1=CSC=C1 T12827 [1,0,0,0,1,0|1,0,0]=3 2084 B7R1.1 OCC1=CSC=N1 T2165 [1,0,0,0,1,0|2,0,0]=4 2085 B7R1.1 OCC1=NC=CN1 I38716 [1,0,0,0,1,0|2,0,0]=4 2086 B7R1.1 OCC1=NC=CO1 X14019 [1,0,0,0,1,0|2,0,0]=4 2087 B7R1.1 OCC1=NC=CS1 H3028 [1,0,0,0,1,0|2,0,0]=4 2088 B7R1.1 OCC1=NNC=C1 H7696 [1,0,0,0,1,0|2,0,0]=4 2089 B7R1.1 OCC1=NOC=C1 I11321 [1,0,0,0,1,0|2,0,0]=4 2090 B7R1.1 OCN1C=CC=N1 P9800 [1,0,0,0,1,0|2,0,0]=4 2091 B11R1.91 CC(=O)NNC1=CC=CC=C1 P69088 [0,0,0,0,0,2|0,0,2]=4 2092 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 P68564 [0,0,0,0,0,2|0,0,2]=4 2093 B11R1.91 O=C(O)C#CC1=CC=CC=C1 P67832 [0,0,0,0,0,2|1,0,1]=4 2094 B11R1.91 O=C(O)CNC1=CC=CC=C1 P68874 [0,0,0,0,0,2|1,0,1]=4 2095 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 C37831 [0,0,0,0,0,2|1,0,1]=4 2096 B11R1.91 OB(O)CCC1=CC=CC=C1 P4926 [0,0,0,0,0,2|2,0,0]=4 2097 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 P4986 [0,0,0,0,0,2|2,0,0]=4