0 B9R1.6 CC(=O)C1=CN=CN=C1 A7446 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.6 CC(=O)C1=CN=NC=C1 A10222 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.6 CC(=O)C1=NC=CC=N1 A8017 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.6 CC(=O)C1=NC=CN=C1 A39262 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.6 CC(=O)C1=NC=NC=C1 A12246 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 CC(=O)C1=NN=CC=C1 P0157 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 CC(C)C1=NC=CC=C1 I0627 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.6 CN(C)C1=CC=NC=C1 P68104 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.6 C[C@@H](N)C1=CC=CC=C1 P68072 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.6 C[C@@H](N)C1=CC=CN=C1 P43620 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.6 C[C@@H](N)C1=CC=NC=C1 P43606 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.6 C[C@@H](N)C1=CC=NC=C1 P46584 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P43619 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.6 C[C@@H](N)C1=NC=CC=C1 P46583 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.6 C[C@@H](O)C1=CC=CC=C1 P46824 [0,0,0,0,0,0|1,0,1]=2 15 B9R1.6 C[C@@H](O)C1=CC=NC=C1 P46383 [0,0,0,0,0,0|2,0,1]=3 16 B9R1.6 C[C@@H](O)C1=NC=CC=C1 P46382 [0,0,0,0,0,0|2,0,1]=3 17 B9R1.6 C[C@H](N)C1=CC=CC=C1 P68597 [0,0,0,0,0,0|2,0,1]=3 18 B9R1.6 C[C@H](N)C1=CC=CC=C1 P69271 [0,0,0,0,0,0|2,0,1]=3 19 B9R1.6 C[C@H](N)C1=CC=CN=C1 P43604 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.6 C[C@H](N)C1=CC=CN=C1 P46585 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.6 C[C@H](N)C1=CC=CN=C1 P61653 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.6 C[C@H](N)C1=CC=NC=C1 P43607 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.6 C[C@H](N)C1=CC=NC=C1 P46582 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.6 C[C@H](N)C1=NC=CC=C1 P43621 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.6 C[C@H](N)C1=NC=CC=C1 P66366 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.6 C[C@H](O)C1=CC=CC=C1 P46823 [0,0,0,0,0,0|1,0,1]=2 27 B9R1.6 C[C@H](O)C1=CC=NC=C1 P38118 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.6 C[C@H](O)C1=NC=CC=C1 P46375 [0,0,0,0,0,0|2,0,1]=3 29 B9R1.6 C[C@H](O)C1=NC=CN=C1 P43187 [0,0,0,0,0,0|3,0,1]=4 30 B9R1.6 C[S@](=O)C1=CC=CC=C1 M61814 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.6 C[S@](=O)C1=NC=CC=C1 M43172 [0,0,0,0,0,0|3,0,0]=3 32 B9R1.6 C[S@](=O)C1=NC=CC=N1 M41047 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.6 N=C(N)C1=CC=CC=C1 B39428 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.6 N=C(N)C1=CC=CN=C1 N43530 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.6 N=C(N)C1=CC=NC=C1 N43531 [0,0,0,0,0,0|3,0,0]=3 36 B9R1.6 N=C(N)C1=NC=CC=C1 A3829 [0,0,0,0,0,0|3,0,0]=3 37 B9R1.6 N=C(N)C1=NC=CC=C1 P43087 [0,0,0,0,0,0|3,0,0]=3 38 B9R1.6 N=C(N)C1=NC=CC=N1 A32287 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.6 N=C(N)C1=NC=CC=N1 P41095 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.6 N=C(N)C1=NC=CC=N1 P43594 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.6 N=C(N)C1=NC=CN=C1 P60819 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.6 NC(=O)C1=CC=CC=C1 B69845 [0,0,0,0,0,0|1,0,0]=1 43 B9R1.6 NC(=O)C1=NC=CC=C1 P60877 [0,0,0,0,0,0|2,0,0]=2 44 B9R1.6 NC(=O)C1=NC=NC=C1 P40959 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.6 O=C(Cl)C1=CC=NC=C1 N39246 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.6 O=C(Cl)C1=CN=CN=C1 P0798 [0,0,0,0,0,0|3,0,0]=3 47 B9R1.6 O=C(Cl)C1=NC=CC=C1 P42299 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.6 O=C(O)C1=CCCCO1 D43311 [0,0,0,0,0,0|1,0,3]=4 49 B9R1.6 O=C(O)C1=CN=CN=C1 P2410 [0,0,0,0,0,0|2,0,0]=2 50 B9R1.6 O=C(O)C1=CN=NC=C1 P3453 [0,0,0,0,0,0|2,0,0]=2 51 B9R1.6 O=C(O)C1=COCCC1 D23573 [0,0,0,0,0,0|1,0,3]=4 52 B9R1.6 O=C(O)C1=NC=CC=C1 P62145 [0,0,0,0,0,0|1,0,0]=1 53 B9R1.6 O=C(O)C1=NC=CC=N1 P5589 [0,0,0,0,0,0|2,0,0]=2 54 B9R1.6 O=C(O)C1=NC=CN=C1 P2716 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.6 O=C(O)C1=NC=NC=C1 P4579 [0,0,0,0,0,0|2,0,0]=2 56 B9R1.6 O=C(O)C1=NN=CC=C1 P3149 [0,0,0,0,0,0|2,0,0]=2 57 B9R1.6 O=C(O)[C@@H]1CC=CCC1 C11079 [0,0,0,0,0,0|0,0,4]=4 58 B9R1.6 O=C(O)[C@@H]1CC=CCC1 C68354 [0,0,0,0,0,0|0,0,4]=4 59 B9R1.6 O=C(O)[C@H]1CC=CCC1 C11080 [0,0,0,0,0,0|0,0,4]=4 60 B9R1.6 O=C([O-])C1=NN=CC=N1 T61631 [0,0,0,0,0,0|3,0,1]=4 61 B9R1.6 O=[S@]([O-])C1=CC=CC=C1 S68689 [0,0,0,0,0,0|1,0,1]=2 62 B9R1.6 OB(O)C1=CC=NC=C1 P5100 [0,0,0,0,0,0|2,0,1]=3 63 B9R1.6 OB(O)C1=CN=CC=C1 P5080 [0,0,0,0,0,0|2,0,1]=3 64 B9R1.6 OB(O)C1=CN=CN=C1 P5106 [0,0,0,0,0,0|3,0,1]=4 65 B9R1.6 OB(O)C1=NC=CC=C1 P36680 [0,0,0,0,0,0|2,0,1]=3 66 B9R1.6 OB(O)C1=NC=CN=C1 P36936 [0,0,0,0,0,0|3,0,1]=4 67 B9R1.6 OB(O)C1=NC=NC=C1 P32118 [0,0,0,0,0,0|3,0,1]=4 68 B8R1.2 BrCC1=CC=NC=C1 B36897 [1,0,0,0,0,0|2,0,1]=4 69 B8R1.2 BrCC1=CN=CC=C1 B23879 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.2 BrCC1=NC=CC=C1 B42841 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.2 C#CC1=CC=CN=C1 E12479 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.2 C#CC1=CC=NC=C1 E10312 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.2 C#CC1=CC=NC=C1 E23238 [1,0,0,0,0,0|2,0,1]=4 74 B8R1.2 C#CC1=NC=CC=C1 E12434 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.2 CNC1=CC=CN=C1 M38086 [1,0,0,0,0,0|3,0,0]=4 76 B8R1.2 CNC1=CC=NC=C1 M68620 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.2 COC1=CC=NC=C1 M9391 [1,0,0,0,0,0|3,0,0]=4 78 B8R1.2 COC1=CN=CC=C1 M67978 [1,0,0,0,0,0|3,0,0]=4 79 B8R1.2 COC1=NC=CC=C1 M39277 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.2 ClCC1=CC=NC=C1 C68845 [1,0,0,0,0,0|2,0,1]=4 81 B8R1.2 ClCC1=NC=CC=C1 C67870 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.2 NCC1=CC=CN=C1 A69257 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.2 NCC1=CC=NC=C1 P67743 [1,0,0,0,0,0|2,0,1]=4 84 B8R1.2 NNC1=CC=CC=C1 P68696 [1,0,0,0,0,0|2,0,0]=3 85 B8R1.2 NNC1=CC=CN=C1 H0043 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.2 NNC1=CC=CN=C1 H41349 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.2 NNC1=CC=NC=C1 H0042 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.2 NNC1=NC=CC=C1 H38511 [1,0,0,0,0,0|3,0,0]=4 89 B8R1.2 NOC1=CC=CC=C1 P43533 [1,0,0,0,0,0|2,0,0]=3 90 B8R1.2 O=CC1=CC=NC=C1 P42598 [1,0,0,0,0,0|1,0,0]=2 91 B8R1.2 O=CC1=CN=CC=C1 P13753 [1,0,0,0,0,0|1,0,0]=2 92 B8R1.2 O=CC1=CN=CN=C1 F2817 [1,0,0,0,0,0|2,0,0]=3 93 B8R1.2 O=CC1=CN=NC=C1 P7445 [1,0,0,0,0,0|2,0,0]=3 94 B8R1.2 O=CC1=NC=CC=C1 P67836 [1,0,0,0,0,0|1,0,0]=2 95 B8R1.2 O=CC1=NC=CC=N1 P0152 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.2 O=CC1=NC=CN=C1 P0148 [1,0,0,0,0,0|2,0,0]=3 97 B8R1.2 O=CC1=NC=NC=C1 P40755 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.2 OCC1=CC=NC=C1 P43429 [1,0,0,0,0,0|1,0,1]=3 99 B8R1.2 OCC1=CC=NC=C1 P67894 [1,0,0,0,0,0|1,0,1]=3 100 B8R1.2 OCC1=CN=CC=C1 P15946 [1,0,0,0,0,0|1,0,1]=3 101 B8R1.2 OCC1=CN=CN=C1 P0145 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.2 OCC1=NC=CC=C1 P69303 [1,0,0,0,0,0|1,0,1]=3 103 B8R1.2 OCC1=NC=CC=N1 P0151 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.2 OCC1=NC=CN=C1 P0147 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.2 OCC1=NC=NC=C1 P0160 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.2 OCC1=NN=CC=C1 P0155 [1,0,0,0,0,0|2,0,1]=4 107 B8R1.2 ONC1=CC=CC=C1 P67873 [1,0,0,0,0,0|1,0,0]=2 108 B10R1.13 C=C(C)C1=CC=C(F)C=C1 F51670 [0,1,0,0,0,0|2,0,0]=3 109 B10R1.13 C=C(C)C1=CC=C(O)C=C1 P49877 [0,1,0,0,0,0|2,0,0]=3 110 B10R1.13 CC(=O)C1=CC=C(C)C=C1 M68572 [0,1,0,0,0,0|1,0,0]=2 111 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C68865 [0,1,0,0,0,0|1,0,0]=2 112 B10R1.13 CC(=O)C1=CC=C(F)C=C1 F38426 [0,1,0,0,0,0|1,0,0]=2 113 B10R1.13 CC(=O)C1=CC=C(I)C=C1 K39500 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.13 CC(=O)C1=CC=C(N)C=C1 A68181 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.13 CC(=O)C1=CC=C(O)C=C1 H64899 [0,1,0,0,0,0|1,0,0]=2 116 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 B3106 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.13 CC(=O)C1=CN=C(C)C=C1 A23296 [0,1,0,0,0,0|2,0,0]=3 118 B10R1.13 CC(=O)C1=CN=C(C)N=C1 M13671 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 A24257 [0,1,0,0,0,0|2,0,0]=3 120 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 C16565 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.13 CC(=O)C1=CN=C(F)C=C1 F45498 [0,1,0,0,0,0|2,0,0]=3 122 B10R1.13 CC(=O)C1=CN=C(N)C=C1 A22139 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.13 CC(=O)C1=CN=C(N)N=C1 A43099 [0,1,0,0,0,0|3,0,0]=4 124 B10R1.13 CC(=O)C1=CNC(=O)C=C1 A67563 [0,1,0,0,0,0|2,0,0]=3 125 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 B22347 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.13 CC(=O)C1=NC=C(Br)C=N1 B11274 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.13 CC(=O)C1=NC=C(C)C=C1 M49266 [0,1,0,0,0,0|2,0,0]=3 128 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 C26822 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.13 CC(=O)C1=NC=C(F)C=N1 F9990 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.13 CC(=O)C1=NC=C(O)C=C1 H45820 [0,1,0,0,0,0|2,0,0]=3 131 B10R1.13 CC(=O)C1=NC=C(O)N=C1 H42776 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 A15077 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.13 CC(C)C1=CC=C(Br)C=C1 B49963 [0,1,0,0,0,0|2,0,1]=4 134 B10R1.13 CC(C)C1=CC=C(N)C=C1 P69319 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.13 CC(C)C1=CC=C(O)C=C1 P60863 [0,1,0,0,0,0|2,0,1]=4 136 B10R1.13 CC(C)C1=CC=C([Mg+])C=C1 P31759 [0,1,0,0,0,0|2,0,1]=4 137 B10R1.13 CC1=CC=C(B(O)O)C=C1 T5215 [0,1,0,0,0,0|1,0,1]=3 138 B10R1.13 CC1=CC=C(C(=N)N)C=C1 M38078 [0,1,0,0,0,0|2,0,0]=3 139 B10R1.13 CC1=CC=C(C(=O)O)C=C1 M64877 [0,1,0,0,0,0|0,0,0]=1 140 B10R1.13 CC1=CC=C(C(C)C)C=C1 D60786 [0,1,0,0,0,0|2,0,1]=4 141 B10R1.13 CC1=CC=C(C(N)=O)C=C1 M39514 [0,1,0,0,0,0|1,0,0]=2 142 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T52161 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 T60511 [0,1,0,0,0,0|2,0,1]=4 144 B10R1.13 CC1=CC=C([C@@H](C)O)C=C1 T50271 [0,1,0,0,0,0|1,0,1]=3 145 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 S38423 [0,1,0,0,0,0|1,0,1]=3 146 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 M65785 [0,1,0,0,0,0|2,0,0]=3 147 B10R1.13 CC1=CC=C([S@](N)=O)C=C1 M36646 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M23707 [0,1,0,0,0,0|1,0,0]=2 149 B10R1.13 CC1=CN=C(C(=O)O)C=C1 M46550 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.13 CC1=CN=C(C(=O)O)C=N1 M4677 [0,1,0,0,0,0|2,0,0]=3 151 B10R1.13 CC1=CN=C(C(=O)O)N=C1 M11475 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 M42775 [0,1,0,0,0,0|2,0,1]=4 153 B10R1.13 CC1=NC=C(B(O)O)C=C1 M24773 [0,1,0,0,0,0|2,0,1]=4 154 B10R1.13 CC1=NC=C(C(=O)O)C=C1 M10933 [0,1,0,0,0,0|1,0,0]=2 155 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 H64312 [0,1,0,0,0,0|2,0,1]=4 156 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 M4745 [0,1,0,0,0,0|2,0,1]=4 157 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 C46751 [0,1,0,0,0,0|3,0,0]=4 158 B10R1.13 CN(C)C1=CC=C(I)C=C1 K46770 [0,1,0,0,0,0|3,0,0]=4 159 B10R1.13 CN(C)C1=CC=C([Mg+])C=C1 D31762 [0,1,0,0,0,0|3,0,0]=4 160 B10R1.13 C[C@@H](N)C1=CC=C(Br)C=C1 B38580 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.13 C[C@@H](N)C1=CC=C(Cl)C=C1 C64533 [0,1,0,0,0,0|2,0,1]=4 162 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F46766 [0,1,0,0,0,0|2,0,1]=4 163 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 F49509 [0,1,0,0,0,0|2,0,1]=4 164 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 B49428 [0,1,0,0,0,0|1,0,1]=3 165 B10R1.13 C[C@@H](O)C1=CC=C(Cl)C=C1 C49454 [0,1,0,0,0,0|1,0,1]=3 166 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 F49461 [0,1,0,0,0,0|1,0,1]=3 167 B10R1.13 C[C@H](Br)C1=CC=C(F)C=C1 B36983 [0,1,0,0,0,0|2,0,1]=4 168 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46724 [0,1,0,0,0,0|2,0,1]=4 169 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B46735 [0,1,0,0,0,0|2,0,1]=4 170 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 B65383 [0,1,0,0,0,0|2,0,1]=4 171 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F36974 [0,1,0,0,0,0|2,0,1]=4 172 B10R1.13 C[C@H](N)C1=CC=C(F)C=C1 F64415 [0,1,0,0,0,0|2,0,1]=4 173 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46768 [0,1,0,0,0,0|2,0,1]=4 174 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 K46771 [0,1,0,0,0,0|2,0,1]=4 175 B10R1.13 C[C@H](N)C1=CC=C(N)C=C1 A46957 [0,1,0,0,0,0|2,0,1]=4 176 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 B49431 [0,1,0,0,0,0|1,0,1]=3 177 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49442 [0,1,0,0,0,0|1,0,1]=3 178 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 C49449 [0,1,0,0,0,0|1,0,1]=3 179 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 F49463 [0,1,0,0,0,0|1,0,1]=3 180 B10R1.13 C[C@H](O)C1=CC=C(O)C=C1 H46826 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.13 C[S@](=O)C1=CC=C(Br)C=C1 B63199 [0,1,0,0,0,0|2,0,0]=3 182 B10R1.13 FC(F)C1=CC=C(Cl)C=C1 C44732 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.13 FC(F)C1=CC=C(I)C=C1 D44733 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B45615 [0,1,0,0,0,0|2,0,0]=3 185 B10R1.13 N=C(N)C1=CC=C(Br)C=C1 B45619 [0,1,0,0,0,0|2,0,0]=3 186 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 C45622 [0,1,0,0,0,0|2,0,0]=3 187 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F46534 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.13 N=C(N)C1=CC=C(F)C=C1 F9396 [0,1,0,0,0,0|2,0,0]=3 189 B10R1.13 N=C(N)C1=CC=C(N)C=C1 A4675 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.13 N=C(N)C1=CC=C(O)C=C1 H46554 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.13 N=C(N)C1=CN=C(Cl)C=C1 C42810 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.13 N=C(N)C1=CN=C(F)C=C1 F10578 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.13 N=C(N)C1=NC=C(Cl)C=C1 C10577 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.13 N=C(N)C1=NC=C(F)C=C1 F1754 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 B45467 [0,1,0,0,0,0|1,0,0]=2 196 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 C45478 [0,1,0,0,0,0|1,0,0]=2 197 B10R1.13 NC(=O)C1=CC=C(N)C=C1 A37818 [0,1,0,0,0,0|1,0,0]=2 198 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 B9626 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.13 NC(=O)C1=CN=C(Br)C=N1 B40806 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 C42457 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 B26330 [0,1,0,0,0,0|2,0,0]=3 202 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 C42456 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.13 NC(=O)C1=NC=C(F)C=C1 F42460 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.13 NC(=O)C1=NC=C(N)C=C1 A43096 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.13 NC(=O)C1=NC=C(N)C=N1 A41101 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.13 NC(=O)C1=NC=C(N)N=C1 A41099 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.13 NC(=O)C1=NN=C(Cl)C=C1 C9732 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.13 NC(=O)C1=NN=C(N)C=C1 A10801 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 C64929 [0,1,0,0,0,0|1,1,0]=3 210 B10R1.13 NC(=S)C1=CC=C(O)C=C1 H39401 [0,1,0,0,0,0|1,1,0]=3 211 B10R1.13 NC1=CC=C(B(O)O)C=C1 A1420 [0,1,0,0,0,0|1,0,1]=3 212 B10R1.13 NC1=CC=C(C(F)F)C=C1 D46546 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.13 NC1=CN=C(C(=O)O)C=C1 A1119 [0,1,0,0,0,0|1,0,0]=2 214 B10R1.13 NC1=CN=C(C(=O)O)C=N1 A14591 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.13 NC1=CN=C(C(=O)O)N=C1 A12385 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.13 NC1=CN=C([N+](=O)[O-])C=C1 N40964 [0,1,0,0,0,0|2,0,1]=4 217 B10R1.13 NC1=NC=C(B(O)O)C=C1 A63168 [0,1,0,0,0,0|2,0,1]=4 218 B10R1.13 NC1=NC=C(B(O)O)C=C1 A7476 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.13 NC1=NC=C(C(=O)O)C=C1 A4758 [0,1,0,0,0,0|1,0,0]=2 220 B10R1.13 NC1=NC=C(C(=O)O)C=N1 A23009 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.13 NC1=NC=C([N+](=O)[O-])C=C1 N68892 [0,1,0,0,0,0|2,0,1]=4 222 B10R1.13 NC1=NN=C(C(=O)O)C=C1 A7484 [0,1,0,0,0,0|2,0,0]=3 223 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 C42006 [0,1,0,0,0,0|2,0,0]=3 224 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 C67273 [0,1,0,0,0,0|0,0,0]=1 225 B10R1.13 O=C(O)C1=CC=C(I)C=C1 K39365 [0,1,0,0,0,0|0,0,0]=1 226 B10R1.13 O=C(O)C1=CC=C(S)C=C1 M69070 [0,1,0,0,0,0|0,0,0]=1 227 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 B4499 [0,1,0,0,0,0|1,0,0]=2 228 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 B26010 [0,1,0,0,0,0|2,0,0]=3 229 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 C24114 [0,1,0,0,0,0|1,0,0]=2 230 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 C7535 [0,1,0,0,0,0|2,0,0]=3 231 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 C4912 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.13 O=C(O)C1=CN=C(F)C=C1 F2849 [0,1,0,0,0,0|1,0,0]=2 233 B10R1.13 O=C(O)C1=CN=C(O)N=C1 H4911 [0,1,0,0,0,0|2,0,0]=3 234 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 B4511 [0,1,0,0,0,0|1,0,0]=2 235 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 B14043 [0,1,0,0,0,0|2,0,0]=3 236 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 C11476 [0,1,0,0,0,0|2,0,0]=3 237 B10R1.13 O=C(O)C1=NC=C(F)C=C1 F13767 [0,1,0,0,0,0|1,0,0]=2 238 B10R1.13 O=C(O)C1=NC=C(F)C=N1 F11482 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.13 O=C(O)C1=NC=C(I)C=C1 I38885 [0,1,0,0,0,0|1,0,0]=2 240 B10R1.13 O=C(O)C1=NC=C(O)C=C1 H8151 [0,1,0,0,0,0|1,0,0]=2 241 B10R1.13 O=C(O)C1=NC=C(O)N=C1 H12388 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.13 O=C(O)C1=NN=C(Br)C=C1 B13479 [0,1,0,0,0,0|2,0,0]=3 243 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 C0263 [0,1,0,0,0,0|2,0,0]=3 244 B10R1.13 O=C(O)C1=NN=C(O)C=C1 H0266 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.13 O=C(O)C1=NN=C(O)C=C1 H41345 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.13 O=C1C=CC(C(=O)O)=CN1 H12738 [0,1,0,0,0,0|1,0,0]=2 247 B10R1.13 O=C1C=CC(C(=O)O)=CO1 C7780 [0,1,0,0,0,0|1,0,0]=2 248 B10R1.13 O=C1C=C[C@@H](C(=O)O)N=N1 X40762 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 F68090 [0,1,0,0,0,0|1,0,1]=3 250 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 B7412 [0,1,0,0,0,0|2,0,1]=4 251 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 C1099 [0,1,0,0,0,0|2,0,1]=4 252 B10R1.13 O=[N+]([O-])C1=CN=C(F)C=C1 F40584 [0,1,0,0,0,0|2,0,1]=4 253 B10R1.13 O=[N+]([O-])C1=CN=C(O)C=C1 H68889 [0,1,0,0,0,0|2,0,1]=4 254 B10R1.13 O=[N+]([O-])C1=NC=C(Br)C=C1 B13756 [0,1,0,0,0,0|2,0,1]=4 255 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)C=C1 C40580 [0,1,0,0,0,0|2,0,1]=4 256 B10R1.13 O=[N+]([O-])C1=NC=C(F)C=C1 F40588 [0,1,0,0,0,0|2,0,1]=4 257 B10R1.13 O=[N+]([O-])C1=NC=C(O)C=C1 H40759 [0,1,0,0,0,0|2,0,1]=4 258 B10R1.13 O=[S@](O)C1=CC=C(Br)C=C1 B42696 [0,1,0,0,0,0|1,0,0]=2 259 B10R1.13 O=[S@]([O-])C1=CC=C(F)C=C1 S42324 [0,1,0,0,0,0|1,0,1]=3 260 B10R1.13 OB(O)C1=CC=C(Br)C=C1 B1940 [0,1,0,0,0,0|1,0,1]=3 261 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 C2280 [0,1,0,0,0,0|1,0,1]=3 262 B10R1.13 OB(O)C1=CC=C(F)C=C1 F3380 [0,1,0,0,0,0|1,0,1]=3 263 B10R1.13 OB(O)C1=CN=C(Br)C=C1 B1950 [0,1,0,0,0,0|2,0,1]=4 264 B10R1.13 OB(O)C1=CN=C(Cl)C=C1 C2288 [0,1,0,0,0,0|2,0,1]=4 265 B10R1.13 OB(O)C1=CN=C(F)C=C1 F3388 [0,1,0,0,0,0|2,0,1]=4 266 B10R1.13 OB(O)C1=CN=C(O)C=C1 H26341 [0,1,0,0,0,0|2,0,1]=4 267 B10R1.13 OB(O)C1=NC=C(Cl)C=C1 C40992 [0,1,0,0,0,0|2,0,1]=4 268 B10R1.13 OB(O)C1=NC=C(F)C=C1 F61886 [0,1,0,0,0,0|2,0,1]=4 269 B10R1.15 C#C[C@@H](C)C1=CC=CC=C1 B64382 [0,1,0,0,0,0|2,0,1]=4 270 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 P68581 [0,1,0,0,0,0|1,0,1]=3 271 B10R1.15 C=C(CC)C1=CC=CC=C1 B52673 [0,1,0,0,0,0|2,0,0]=3 272 B10R1.15 C=C[S@](=O)C1=CC=CC=C1 V62500 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.15 CCC(=O)C1=CN=CC=C1 P49262 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.15 CCC(=O)C1=NC=CC=N1 P61892 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.15 CCC(=O)C1=NC=CN=C1 P14589 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.15 CC[C@@H](N)C1=CC=CC=C1 P39004 [0,1,0,0,0,0|2,0,1]=4 277 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M50312 [0,1,0,0,0,0|2,0,1]=4 278 B10R1.15 CN[C@H](C)C1=CC=CC=C1 M52164 [0,1,0,0,0,0|2,0,1]=4 279 B10R1.15 COC(=O)C1=CC=NC=C1 M64933 [0,1,0,0,0,0|1,0,0]=2 280 B10R1.15 COC(=O)C1=CN=CN=C1 M10227 [0,1,0,0,0,0|2,0,0]=3 281 B10R1.15 COC(=O)C1=CN=NC=C1 M12256 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.15 COC(=O)C1=NC=CC=C1 M28469 [0,1,0,0,0,0|1,0,0]=2 283 B10R1.15 COC(=O)C1=NC=CC=N1 M3445 [0,1,0,0,0,0|2,0,0]=3 284 B10R1.15 COC(=O)C1=NC=CN=C1 M2717 [0,1,0,0,0,0|2,0,0]=3 285 B10R1.15 COC(=O)C1=NC=NC=C1 P0159 [0,1,0,0,0,0|2,0,0]=3 286 B10R1.15 COC(=O)C1=NN=CC=C1 M0217 [0,1,0,0,0,0|2,0,0]=3 287 B10R1.15 CO[S@@](=O)C1=CC=CC=C1 M46243 [0,1,0,0,0,0|1,0,0]=2 288 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P37912 [0,1,0,0,0,0|2,0,1]=4 289 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P39584 [0,1,0,0,0,0|2,0,1]=4 290 B10R1.15 C[C@@H](CN)C1=CC=CC=C1 P60945 [0,1,0,0,0,0|2,0,1]=4 291 B10R1.15 C[C@@H](NO)C1=CC=CC=C1 P10845 [0,1,0,0,0,0|1,0,1]=3 292 B10R1.15 C\C(=N\O)C1=NC=CC=C1 M66365 [0,1,0,0,0,0|2,0,0]=3 293 B10R1.15 F[C@@H](CBr)C1=CC=CC=C1 B48763 [0,1,0,0,0,0|2,0,1]=4 294 B10R1.15 N=C(NO)C1=CC=NC=C1 H43094 [0,1,0,0,0,0|2,0,0]=3 295 B10R1.15 NC[C@@H](O)C1=CC=CC=C1 A67914 [0,1,0,0,0,0|1,0,1]=3 296 B10R1.15 NC[C@@H](O)C1=CN=CC=C1 A46466 [0,1,0,0,0,0|2,0,1]=4 297 B10R1.15 NC[C@H](N)C1=CC=CC=C1 P49663 [0,1,0,0,0,0|2,0,1]=4 298 B10R1.15 NC[C@H](O)C1=NC=CC=C1 A46589 [0,1,0,0,0,0|2,0,1]=4 299 B10R1.15 NN=C(N)C1=NC=CC=C1 P37720 [0,1,0,0,0,0|3,0,0]=4 300 B10R1.15 NNC(=O)C1=CC=CC=C1 B69029 [0,1,0,0,0,0|1,0,0]=2 301 B10R1.15 NNC(=O)C1=NC=CC=C1 P43090 [0,1,0,0,0,0|2,0,0]=3 302 B10R1.15 NNC(=O)C1=NC=CN=C1 P67570 [0,1,0,0,0,0|3,0,0]=4 303 B10R1.15 NNC(=O)C1=NC=NC=C1 P9375 [0,1,0,0,0,0|3,0,0]=4 304 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 A67686 [0,1,0,0,0,0|1,0,1]=3 305 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 P39434 [0,1,0,0,0,0|1,0,1]=3 306 B10R1.15 N[C@H](CO)C1=CC=CC=C1 A37812 [0,1,0,0,0,0|1,0,1]=3 307 B10R1.15 O=C(CBr)C1=CN=CC=C1 B68250 [0,1,0,0,0,0|2,0,0]=3 308 B10R1.15 O=C(CBr)C1=NC=CC=C1 B45477 [0,1,0,0,0,0|2,0,0]=3 309 B10R1.15 O=C(CBr)C1=NC=CC=N1 B20416 [0,1,0,0,0,0|3,0,0]=4 310 B10R1.15 O=C(CBr)C1=NC=CC=N1 B69489 [0,1,0,0,0,0|3,0,0]=4 311 B10R1.15 O=C(CBr)C1=NC=CN=C1 B42452 [0,1,0,0,0,0|3,0,0]=4 312 B10R1.15 O=C(CCl)C1=CN=CC=C1 C45489 [0,1,0,0,0,0|2,0,0]=3 313 B10R1.15 O=C(CO)C1=CC=CC=C1 H67472 [0,1,0,0,0,0|0,0,0]=1 314 B10R1.15 O=CC(=O)C1=CC=CC=C1 P48113 [0,1,0,0,0,0|0,0,1]=2 315 B10R1.15 OC[C@@H](O)C1=CC=CC=C1 P46829 [0,1,0,0,0,0|0,0,2]=3 316 B10R1.15 OC[C@H](O)C1=CC=CC=C1 P46828 [0,1,0,0,0,0|0,0,2]=3 317 B10R1.15 ON=C(Cl)C1=NC=CC=C1 H42458 [0,1,0,0,0,0|2,0,0]=3 318 B10R1.15 O[C@@H](CCl)C1=CC=CC=C1 C49445 [0,1,0,0,0,0|1,0,1]=3 319 B10R1.28 CC(C)(N)C1=CC=CC=C1 P32201 [0,1,0,0,0,0|2,0,1]=4 320 B10R1.28 CC(C)(O)C1=CC=CC=C1 P24569 [0,1,0,0,0,0|1,0,1]=3 321 B10R1.28 CC(C)(O)C1=CN=CC=C1 P46904 [0,1,0,0,0,0|2,0,1]=4 322 B10R1.28 CC(C)(O)C1=NC=CC=C1 P38223 [0,1,0,0,0,0|2,0,1]=4 323 B10R1.28 CS(=O)(=O)C1=CC=CC=C1 M39415 [0,1,0,0,0,0|1,0,1]=3 324 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 T68550 [0,1,0,0,0,0|3,0,0]=4 325 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 T69020 [0,1,0,0,0,0|3,0,0]=4 326 B10R1.28 F[B-](F)(F)C1=CC=CC=C1 P67648 [0,1,0,0,0,0|3,0,0]=4 327 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 B69318 [0,1,0,0,0,0|1,0,1]=3 328 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 P0086 [0,1,0,0,0,0|2,0,1]=4 329 B10R1.28 NS(=O)(=O)C1=CN=CC=C1 P22874 [0,1,0,0,0,0|2,0,1]=4 330 B10R1.28 NS(=O)(=O)C1=NC=CC=C1 P0087 [0,1,0,0,0,0|2,0,1]=4 331 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 P0085 [0,1,0,0,0,0|2,0,1]=4 332 B10R1.28 O=S(=O)(Cl)C1=CN=CC=C1 P20595 [0,1,0,0,0,0|2,0,1]=4 333 B10R1.28 O=S(=O)(F)C1=NC=CC=C1 P2730 [0,1,0,0,0,0|2,0,1]=4 334 B10R1.28 O=S(=O)(O)C1=CN=CC=C1 P41001 [0,1,0,0,0,0|2,0,0]=3 335 B10R1.28 O=S(=O)(O)C1=NC=CC=C1 P41000 [0,1,0,0,0,0|2,0,0]=3 336 B10R1.61 C=C(C)C1=C(N)C=CC=C1 P49976 [0,1,0,0,0,0|2,0,0]=3 337 B10R1.61 CC(=O)C1=C(Br)C=CC=C1 B48708 [0,1,0,0,0,0|1,0,0]=2 338 B10R1.61 CC(=O)C1=C(Br)C=CC=N1 B45470 [0,1,0,0,0,0|2,0,0]=3 339 B10R1.61 CC(=O)C1=C(Br)C=NC=C1 A10416 [0,1,0,0,0,0|2,0,0]=3 340 B10R1.61 CC(=O)C1=C(Br)C=NC=N1 B37228 [0,1,0,0,0,0|3,0,0]=4 341 B10R1.61 CC(=O)C1=C(C)C=CC=C1 T39529 [0,1,0,0,0,0|1,0,0]=2 342 B10R1.61 CC(=O)C1=C(C)N=CC=C1 M21788 [0,1,0,0,0,0|2,0,0]=3 343 B10R1.61 CC(=O)C1=C(C)N=CN=C1 M45983 [0,1,0,0,0,0|3,0,0]=4 344 B10R1.61 CC(=O)C1=C(Cl)C=CC=C1 C68333 [0,1,0,0,0,0|1,0,0]=2 345 B10R1.61 CC(=O)C1=C(Cl)C=CC=N1 A11386 [0,1,0,0,0,0|2,0,0]=3 346 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 C16933 [0,1,0,0,0,0|2,0,0]=3 347 B10R1.61 CC(=O)C1=C(F)C=CC=C1 F69325 [0,1,0,0,0,0|1,0,0]=2 348 B10R1.61 CC(=O)C1=C(F)C=CC=N1 A12617 [0,1,0,0,0,0|2,0,0]=3 349 B10R1.61 CC(=O)C1=C(F)C=NC=C1 A12618 [0,1,0,0,0,0|2,0,0]=3 350 B10R1.61 CC(=O)C1=C(I)C=CC=C1 K48750 [0,1,0,0,0,0|1,0,0]=2 351 B10R1.61 CC(=O)C1=C(N)C=CC=C1 A49645 [0,1,0,0,0,0|1,0,0]=2 352 B10R1.61 CC(=O)C1=C(N)C=NC=C1 A45980 [0,1,0,0,0,0|2,0,0]=3 353 B10R1.61 CC(=O)C1=C(N)N=CC=C1 A45979 [0,1,0,0,0,0|2,0,0]=3 354 B10R1.61 CC(=O)C1=C(O)C=NC=C1 H45819 [0,1,0,0,0,0|2,0,0]=3 355 B10R1.61 CC(=O)C1=CC=CN=C1Br A13535 [0,1,0,0,0,0|2,0,0]=3 356 B10R1.61 CC(=O)C1=CC=CN=C1Cl A12691 [0,1,0,0,0,0|2,0,0]=3 357 B10R1.61 CC(=O)C1=CC=CN=C1F A45493 [0,1,0,0,0,0|2,0,0]=3 358 B10R1.61 CC(=O)C1=CC=CNC1=O A45815 [0,1,0,0,0,0|2,0,0]=3 359 B10R1.61 CC(=O)C1=CNC=CC1=O A45816 [0,1,0,0,0,0|2,0,0]=3 360 B10R1.61 CC(=O)C1=NC=CC=C1O H37046 [0,1,0,0,0,0|2,0,0]=3 361 B10R1.61 CC(=O)C1=NC=CN=C1C M45981 [0,1,0,0,0,0|3,0,0]=4 362 B10R1.61 CC(=O)C1=NC=CN=C1Cl A11547 [0,1,0,0,0,0|3,0,0]=4 363 B10R1.61 CC(=O)C1=NC=CN=C1N A14612 [0,1,0,0,0,0|3,0,0]=4 364 B10R1.61 CC(C)C1=C(Br)C=CC=C1 B49961 [0,1,0,0,0,0|2,0,1]=4 365 B10R1.61 CC(C)C1=C(I)C=CC=C1 K49972 [0,1,0,0,0,0|2,0,1]=4 366 B10R1.61 CC(C)C1=C([Mg+])C=CC=C1 P31757 [0,1,0,0,0,0|2,0,1]=4 367 B10R1.61 CC1=C(B(O)O)C=CC=C1 T5230 [0,1,0,0,0,0|1,0,1]=3 368 B10R1.61 CC1=C(B(O)O)C=CC=N1 M43542 [0,1,0,0,0,0|2,0,1]=4 369 B10R1.61 CC1=C(B(O)O)C=CN=C1 M12606 [0,1,0,0,0,0|2,0,1]=4 370 B10R1.61 CC1=C(B(O)O)C=NC=C1 M3516 [0,1,0,0,0,0|2,0,1]=4 371 B10R1.61 CC1=C(C(=N)N)C=CC=C1 M49487 [0,1,0,0,0,0|2,0,0]=3 372 B10R1.61 CC1=C(C(=O)O)C=CC=C1 T69330 [0,1,0,0,0,0|0,0,0]=1 373 B10R1.61 CC1=C(C(=O)O)C=CC=N1 M14576 [0,1,0,0,0,0|1,0,0]=2 374 B10R1.61 CC1=C(C(=O)O)C=CC=N1 M45814 [0,1,0,0,0,0|1,0,0]=2 375 B10R1.61 CC1=C(C(=O)O)C=CN=C1 M14013 [0,1,0,0,0,0|1,0,0]=2 376 B10R1.61 CC1=C(C(=O)O)C=CN=N1 M14644 [0,1,0,0,0,0|2,0,0]=3 377 B10R1.61 CC1=C(C(=O)O)C=NC=C1 M4658 [0,1,0,0,0,0|1,0,0]=2 378 B10R1.61 CC1=C(C(=O)O)C=NC=N1 M42779 [0,1,0,0,0,0|2,0,0]=3 379 B10R1.61 CC1=C(C(=O)O)C=NN=C1 M7666 [0,1,0,0,0,0|2,0,0]=3 380 B10R1.61 CC1=C(C(N)=O)C=CC=N1 M45974 [0,1,0,0,0,0|2,0,0]=3 381 B10R1.61 CC1=C(C(N)=O)C=CN=C1 M45976 [0,1,0,0,0,0|2,0,0]=3 382 B10R1.61 CC1=C(C(N)=S)C=CC=C1 M69080 [0,1,0,0,0,0|1,1,0]=3 383 B10R1.61 CC1=C([C@@H](C)N)C=CC=C1 T52160 [0,1,0,0,0,0|2,0,1]=4 384 B10R1.61 CC1=C([C@H](C)N)C=CC=C1 T52162 [0,1,0,0,0,0|2,0,1]=4 385 B10R1.61 CC1=C([N+](=O)[O-])C=CC=N1 M0519 [0,1,0,0,0,0|2,0,1]=4 386 B10R1.61 CC1=C([N+](=O)[O-])C=CC=N1 M43521 [0,1,0,0,0,0|2,0,1]=4 387 B10R1.61 CC1=C([N+](=O)[O-])C=CN=C1 M12598 [0,1,0,0,0,0|2,0,1]=4 388 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 M1856 [0,1,0,0,0,0|2,0,1]=4 389 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 M43522 [0,1,0,0,0,0|2,0,1]=4 390 B10R1.61 CC1=CC=CN=C1B(O)O M43294 [0,1,0,0,0,0|2,0,1]=4 391 B10R1.61 CC1=CC=CN=C1C(=N)N M46571 [0,1,0,0,0,0|3,0,0]=4 392 B10R1.61 CC1=CC=CN=C1C(=O)O M14577 [0,1,0,0,0,0|1,0,0]=2 393 B10R1.61 CC1=CC=CN=C1C(=O)O M62138 [0,1,0,0,0,0|1,0,0]=2 394 B10R1.61 CC1=CC=CN=C1[N+](=O)[O-] M3727 [0,1,0,0,0,0|2,0,1]=4 395 B10R1.61 CC1=CC=NN=C1C(=O)O M14534 [0,1,0,0,0,0|2,0,0]=3 396 B10R1.61 CC1=CN=CN=C1C(=O)O M42780 [0,1,0,0,0,0|2,0,0]=3 397 B10R1.61 CC1=NC=CN=C1C(=O)O M7738 [0,1,0,0,0,0|2,0,0]=3 398 B10R1.61 CN(C)C1=C(Br)C=CC=C1 B46731 [0,1,0,0,0,0|3,0,0]=4 399 B10R1.61 CN(C)C1=C(Cl)C=CC=C1 C46747 [0,1,0,0,0,0|3,0,0]=4 400 B10R1.61 CN(C)C1=C(N)C=CC=C1 D68123 [0,1,0,0,0,0|3,0,0]=4 401 B10R1.61 CN(C)C1=C(O)C=CC=C1 D23348 [0,1,0,0,0,0|3,0,0]=4 402 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 B37416 [0,1,0,0,0,0|2,0,1]=4 403 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 B46741 [0,1,0,0,0,0|2,0,1]=4 404 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 F46764 [0,1,0,0,0,0|2,0,1]=4 405 B10R1.61 C[C@@H](N)C1=C(F)C=CC=C1 F49507 [0,1,0,0,0,0|2,0,1]=4 406 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 B25268 [0,1,0,0,0,0|1,0,1]=3 407 B10R1.61 C[C@@H](O)C1=C(Cl)C=CC=C1 C49446 [0,1,0,0,0,0|1,0,1]=3 408 B10R1.61 C[C@@H](O)C1=C(F)C=CC=C1 F49460 [0,1,0,0,0,0|1,0,1]=3 409 B10R1.61 C[C@H](Br)C1=C(F)C=CC=C1 B48765 [0,1,0,0,0,0|2,0,1]=4 410 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 B19470 [0,1,0,0,0,0|2,0,1]=4 411 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 B46723 [0,1,0,0,0,0|2,0,1]=4 412 B10R1.61 C[C@H](N)C1=C(Br)C=CC=C1 B46742 [0,1,0,0,0,0|2,0,1]=4 413 B10R1.61 C[C@H](N)C1=C(Cl)C=CC=C1 C46756 [0,1,0,0,0,0|2,0,1]=4 414 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 F46760 [0,1,0,0,0,0|2,0,1]=4 415 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 F49510 [0,1,0,0,0,0|2,0,1]=4 416 B10R1.61 C[C@H](N)C1=C(F)C=CC=C1 F64880 [0,1,0,0,0,0|2,0,1]=4 417 B10R1.61 C[C@H](O)C1=C(Br)C=CC=C1 B49429 [0,1,0,0,0,0|1,0,1]=3 418 B10R1.61 C[C@H](O)C1=C(Br)C=CC=N1 B37274 [0,1,0,0,0,0|2,0,1]=4 419 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 C49448 [0,1,0,0,0,0|1,0,1]=3 420 B10R1.61 C[C@H](O)C1=C(Cl)C=CC=C1 C66089 [0,1,0,0,0,0|1,0,1]=3 421 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 F49462 [0,1,0,0,0,0|1,0,1]=3 422 B10R1.61 C[C@H](O)C1=C(F)C=NC=C1 F46213 [0,1,0,0,0,0|2,0,1]=4 423 B10R1.61 C[C@H](O)C1=C(N)N=CC=C1 A65242 [0,1,0,0,0,0|2,0,1]=4 424 B10R1.61 C[C@H](O)C1=CC=CN=C1Cl C46191 [0,1,0,0,0,0|2,0,1]=4 425 B10R1.61 FC(F)C1=C(Br)C=CC=C1 B67317 [0,1,0,0,0,0|2,0,1]=4 426 B10R1.61 N=C(N)C1=C(F)C=CC=C1 F46532 [0,1,0,0,0,0|2,0,0]=3 427 B10R1.61 NC(=O)C1=C(Br)C=CC=C1 B61279 [0,1,0,0,0,0|1,0,0]=2 428 B10R1.61 NC(=O)C1=C(Br)C=NC=C1 B42449 [0,1,0,0,0,0|2,0,0]=3 429 B10R1.61 NC(=O)C1=C(Cl)C=CC=N1 C42454 [0,1,0,0,0,0|2,0,0]=3 430 B10R1.61 NC(=O)C1=C(Cl)C=CN=C1 C42455 [0,1,0,0,0,0|2,0,0]=3 431 B10R1.61 NC(=O)C1=C(I)C=CC=C1 K45507 [0,1,0,0,0,0|1,0,0]=2 432 B10R1.61 NC(=O)C1=C(N)C=CC=C1 A64967 [0,1,0,0,0,0|1,0,0]=2 433 B10R1.61 NC(=O)C1=C(N)C=CN=C1 A3037 [0,1,0,0,0,0|2,0,0]=3 434 B10R1.61 NC(=O)C1=C(N)C=NC=C1 A3921 [0,1,0,0,0,0|2,0,0]=3 435 B10R1.61 NC(=O)C1=C(N)N=CC=C1 A65610 [0,1,0,0,0,0|2,0,0]=3 436 B10R1.61 NC(=O)C1=C(O)C=NC=C1 H63051 [0,1,0,0,0,0|2,0,0]=3 437 B10R1.61 NC(=O)C1=C(O)N=CN=C1 H40966 [0,1,0,0,0,0|3,0,0]=4 438 B10R1.61 NC(=O)C1=NC=CC=C1N A15555 [0,1,0,0,0,0|2,0,0]=3 439 B10R1.61 NC(=O)C1=NC=CN=C1Br B61986 [0,1,0,0,0,0|3,0,0]=4 440 B10R1.61 NC(=O)C1=NC=CN=C1Cl C40808 [0,1,0,0,0,0|3,0,0]=4 441 B10R1.61 NC(=O)C1=NC=CN=C1N A41098 [0,1,0,0,0,0|3,0,0]=4 442 B10R1.61 NC(=O)C1=NC=CN=C1O H37958 [0,1,0,0,0,0|3,0,0]=4 443 B10R1.61 NC(=O)C1=NC=CN=C1[O-] S65958 [0,1,0,0,0,0|3,0,0]=4 444 B10R1.61 NC1=C(B(O)O)C=CC=C1 A1340 [0,1,0,0,0,0|1,0,1]=3 445 B10R1.61 NC1=C(C(=O)O)C=CC=N1 A12487 [0,1,0,0,0,0|1,0,0]=2 446 B10R1.61 NC1=C(C(=O)O)C=CN=C1 A1102 [0,1,0,0,0,0|1,0,0]=2 447 B10R1.61 NC1=C(C(=O)O)C=CN=N1 A40968 [0,1,0,0,0,0|2,0,0]=3 448 B10R1.61 NC1=C(C(=O)O)C=NC=C1 A4739 [0,1,0,0,0,0|1,0,0]=2 449 B10R1.61 NC1=C(C(=O)O)C=NC=N1 A40969 [0,1,0,0,0,0|2,0,0]=3 450 B10R1.61 NC1=C([N+](=O)[O-])C=CC=N1 A8165 [0,1,0,0,0,0|2,0,1]=4 451 B10R1.61 NC1=C([N+](=O)[O-])C=CN=C1 N8815 [0,1,0,0,0,0|2,0,1]=4 452 B10R1.61 NC1=C([N+](=O)[O-])C=NC=C1 A0428 [0,1,0,0,0,0|2,0,1]=4 453 B10R1.61 NC1=CC=CN=C1C(=O)O A0472 [0,1,0,0,0,0|1,0,0]=2 454 B10R1.61 NC1=CC=CN=C1[N+](=O)[O-] N40962 [0,1,0,0,0,0|2,0,1]=4 455 B10R1.61 NC1=CN=CN=C1C(=O)O A40970 [0,1,0,0,0,0|2,0,0]=3 456 B10R1.61 NC1=NC=CN=C1C(=O)O A69313 [0,1,0,0,0,0|2,0,0]=3 457 B10R1.61 O=C(Cl)C1=C(I)C=CC=C1 K44672 [0,1,0,0,0,0|1,0,0]=2 458 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 B31223 [0,1,0,0,0,0|1,0,0]=2 459 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 B1556 [0,1,0,0,0,0|1,0,0]=2 460 B10R1.61 O=C(O)C1=C(Br)C=NC=N1 B13992 [0,1,0,0,0,0|2,0,0]=3 461 B10R1.61 O=C(O)C1=C(Cl)C=CC=N1 C14305 [0,1,0,0,0,0|1,0,0]=2 462 B10R1.61 O=C(O)C1=C(Cl)C=CN=C1 C16032 [0,1,0,0,0,0|1,0,0]=2 463 B10R1.61 O=C(O)C1=C(Cl)C=NC=C1 C42250 [0,1,0,0,0,0|1,0,0]=2 464 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 C24697 [0,1,0,0,0,0|2,0,0]=3 465 B10R1.61 O=C(O)C1=C(F)C=CC=N1 F10405 [0,1,0,0,0,0|1,0,0]=2 466 B10R1.61 O=C(O)C1=C(F)C=CN=C1 F61354 [0,1,0,0,0,0|1,0,0]=2 467 B10R1.61 O=C(O)C1=C(F)C=NC=C1 F1912 [0,1,0,0,0,0|1,0,0]=2 468 B10R1.61 O=C(O)C1=C(F)C=NC=N1 F17530 [0,1,0,0,0,0|2,0,0]=3 469 B10R1.61 O=C(O)C1=C(I)C=CC=N1 K42258 [0,1,0,0,0,0|1,0,0]=2 470 B10R1.61 O=C(O)C1=C(O)C=NC=C1 H12635 [0,1,0,0,0,0|1,0,0]=2 471 B10R1.61 O=C(O)C1=CC=CN=C1Br B23274 [0,1,0,0,0,0|1,0,0]=2 472 B10R1.61 O=C(O)C1=CC=CN=C1Cl C22883 [0,1,0,0,0,0|1,0,0]=2 473 B10R1.61 O=C(O)C1=CC=CN=C1F F38458 [0,1,0,0,0,0|1,0,0]=2 474 B10R1.61 O=C(O)C1=CC=CNC1=S T69299 [0,1,0,0,0,0|1,0,0]=2 475 B10R1.61 O=C(O)C1=CC=NN=C1Cl C16077 [0,1,0,0,0,0|2,0,0]=3 476 B10R1.61 O=C(O)C1=CC=NNC1=O X40761 [0,1,0,0,0,0|2,0,0]=3 477 B10R1.61 O=C(O)C1=CN=CNC1=O X36907 [0,1,0,0,0,0|2,0,0]=3 478 B10R1.61 O=C(O)C1=CNC=CC1=O H67947 [0,1,0,0,0,0|1,0,0]=2 479 B10R1.61 O=C(O)C1=NC=CC=C1O H25980 [0,1,0,0,0,0|1,0,0]=2 480 B10R1.61 O=C(O)C1=NC=CN=C1Br B40577 [0,1,0,0,0,0|2,0,0]=3 481 B10R1.61 O=C(O)C1=NC=CN=C1Cl C10353 [0,1,0,0,0,0|2,0,0]=3 482 B10R1.61 O=C(O)C1=NC=CN=C1I K40592 [0,1,0,0,0,0|2,0,0]=3 483 B10R1.61 O=C(O)C1=NC=CNC1=O H1611 [0,1,0,0,0,0|2,0,0]=3 484 B10R1.61 O=C1NC=CC=C1B(O)O X11948 [0,1,0,0,0,0|2,0,1]=4 485 B10R1.61 O=[N+]([O-])C1=C(Br)C=CC=N1 B40574 [0,1,0,0,0,0|2,0,1]=4 486 B10R1.61 O=[N+]([O-])C1=C(Br)C=NC=C1 B40575 [0,1,0,0,0,0|2,0,1]=4 487 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=N1 C67993 [0,1,0,0,0,0|2,0,1]=4 488 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CN=C1 C10332 [0,1,0,0,0,0|2,0,1]=4 489 B10R1.61 O=[N+]([O-])C1=C(Cl)C=NC=C1 C37519 [0,1,0,0,0,0|2,0,1]=4 490 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=C1 F68062 [0,1,0,0,0,0|1,0,1]=3 491 B10R1.61 O=[N+]([O-])C1=C(F)C=CC=N1 F40585 [0,1,0,0,0,0|2,0,1]=4 492 B10R1.61 O=[N+]([O-])C1=C(I)C=CC=N1 I38319 [0,1,0,0,0,0|2,0,1]=4 493 B10R1.61 O=[N+]([O-])C1=C(I)C=NC=C1 K40591 [0,1,0,0,0,0|2,0,1]=4 494 B10R1.61 O=[N+]([O-])C1=C(O)C=CN=C1 H0427 [0,1,0,0,0,0|2,0,1]=4 495 B10R1.61 O=[N+]([O-])C1=C(O)N=CC=C1 H0350 [0,1,0,0,0,0|2,0,1]=4 496 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Br B3777 [0,1,0,0,0,0|2,0,1]=4 497 B10R1.61 O=[N+]([O-])C1=CC=CN=C1Cl C15538 [0,1,0,0,0,0|2,0,1]=4 498 B10R1.61 O=[N+]([O-])C1=CC=CN=C1F F40583 [0,1,0,0,0,0|2,0,1]=4 499 B10R1.61 OB(O)C1=C(Br)C=CC=C1 B42940 [0,1,0,0,0,0|1,0,1]=3 500 B10R1.61 OB(O)C1=C(Cl)C=CC=C1 C2240 [0,1,0,0,0,0|1,0,1]=3 501 B10R1.61 OB(O)C1=C(Cl)C=NC=C1 C2292 [0,1,0,0,0,0|2,0,1]=4 502 B10R1.61 OB(O)C1=C(F)C=CC=C1 F3340 [0,1,0,0,0,0|1,0,1]=3 503 B10R1.61 OB(O)C1=C(F)C=NC=C1 F2378 [0,1,0,0,0,0|2,0,1]=4 504 B10R1.61 OB(O)C1=C(O)C=CC=C1 H3736 [0,1,0,0,0,0|1,0,1]=3 505 B10R1.61 OB(O)C1=CC=CN=C1Br B68801 [0,1,0,0,0,0|2,0,1]=4 506 B10R1.61 OB(O)C1=CC=CN=C1Cl C3538 [0,1,0,0,0,0|2,0,1]=4 507 B10R1.61 OB(O)C1=CC=CN=C1F F2425 [0,1,0,0,0,0|2,0,1]=4 508 B10R1.61 OC1=C(C(F)F)C=CC=C1 D37751 [0,1,0,0,0,0|2,0,1]=4 509 B10R1.113 C=C(C)C1=CC(Br)=CN=C1 B48877 [0,1,0,0,0,0|3,0,0]=4 510 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 A12880 [0,1,0,0,0,0|2,0,0]=3 511 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 B39012 [0,1,0,0,0,0|2,0,0]=3 512 B10R1.113 CC(=O)C1=CC(C)=CC=C1 T39528 [0,1,0,0,0,0|1,0,0]=2 513 B10R1.113 CC(=O)C1=CC(C)=NC=C1 M49265 [0,1,0,0,0,0|2,0,0]=3 514 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 C0410 [0,1,0,0,0,0|2,0,0]=3 515 B10R1.113 CC(=O)C1=CC(F)=CN=C1 F45496 [0,1,0,0,0,0|2,0,0]=3 516 B10R1.113 CC(=O)C1=CC(N)=CC=C1 A68568 [0,1,0,0,0,0|1,0,0]=2 517 B10R1.113 CC(=O)C1=CC(O)=CC=C1 H60763 [0,1,0,0,0,0|1,0,0]=2 518 B10R1.113 CC(=O)C1=CC=CC(Br)=N1 A45468 [0,1,0,0,0,0|2,0,0]=3 519 B10R1.113 CC(=O)C1=CC=CC(Cl)=C1 C69069 [0,1,0,0,0,0|1,0,0]=2 520 B10R1.113 CC(=O)C1=CC=CC(Cl)=N1 C45483 [0,1,0,0,0,0|2,0,0]=3 521 B10R1.113 CC(=O)C1=CC=CC(F)=C1 F48736 [0,1,0,0,0,0|1,0,0]=2 522 B10R1.113 CC(=O)C1=CC=CC(F)=N1 F45497 [0,1,0,0,0,0|2,0,0]=3 523 B10R1.113 CC(=O)C1=CC=CC(I)=C1 I37889 [0,1,0,0,0,0|1,0,0]=2 524 B10R1.113 CC(=O)C1=CC=NC(Cl)=N1 C32407 [0,1,0,0,0,0|3,0,0]=4 525 B10R1.113 CC(=O)C1=CN=CC(C)=C1 M63719 [0,1,0,0,0,0|2,0,0]=3 526 B10R1.113 CC(=O)C1=NC(C)=CC=C1 A49259 [0,1,0,0,0,0|2,0,0]=3 527 B10R1.113 CC(=O)C1=NC(N)=CC=C1 A37132 [0,1,0,0,0,0|2,0,0]=3 528 B10R1.113 CC(=O)C1=NC(N)=NC=C1 A14288 [0,1,0,0,0,0|3,0,0]=4 529 B10R1.113 CC(=O)C1=NC=CC(Br)=C1 B45471 [0,1,0,0,0,0|2,0,0]=3 530 B10R1.113 CC(=O)C1=NC=CC(C)=C1 M4575 [0,1,0,0,0,0|2,0,0]=3 531 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 C61244 [0,1,0,0,0,0|2,0,0]=3 532 B10R1.113 CC(=O)C1=NC=NC(C)=C1 M45984 [0,1,0,0,0,0|3,0,0]=4 533 B10R1.113 CC(C)C1=CC=CC(Br)=C1 B49962 [0,1,0,0,0,0|2,0,1]=4 534 B10R1.113 CC(C)C1=CC=CC(N)=C1 P50307 [0,1,0,0,0,0|2,0,1]=4 535 B10R1.113 CC(C)C1=CC=CC([Mg+])=C1 P31758 [0,1,0,0,0,0|2,0,1]=4 536 B10R1.113 CC1=CC(B(O)O)=CN=C1 M5113 [0,1,0,0,0,0|2,0,1]=4 537 B10R1.113 CC1=CC(C(=N)N)=NC=C1 M46572 [0,1,0,0,0,0|3,0,0]=4 538 B10R1.113 CC1=CC(C(=O)O)=CN=C1 M10515 [0,1,0,0,0,0|1,0,0]=2 539 B10R1.113 CC1=CC(C(=O)O)=CN=N1 M16625 [0,1,0,0,0,0|2,0,0]=3 540 B10R1.113 CC1=CC(C(=O)O)=NC=C1 M38719 [0,1,0,0,0,0|1,0,0]=2 541 B10R1.113 CC1=CC(C(=O)O)=NC=N1 M14544 [0,1,0,0,0,0|2,0,0]=3 542 B10R1.113 CC1=CC(C(=O)O)=NN=C1 M17544 [0,1,0,0,0,0|2,0,0]=3 543 B10R1.113 CC1=CC([N+](=O)[O-])=NC=C1 M42774 [0,1,0,0,0,0|2,0,1]=4 544 B10R1.113 CC1=CC=CC(B(O)O)=C1 T5210 [0,1,0,0,0,0|1,0,1]=3 545 B10R1.113 CC1=CC=CC(C(=N)N)=C1 M49488 [0,1,0,0,0,0|2,0,0]=3 546 B10R1.113 CC1=CC=CC(C(=O)O)=N1 M45823 [0,1,0,0,0,0|1,0,0]=2 547 B10R1.113 CC1=CC=CC(N(C)C)=C1 T39548 [0,1,0,0,0,0|3,0,0]=4 548 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T50311 [0,1,0,0,0,0|2,0,1]=4 549 B10R1.113 CC1=CC=CC([C@@H](C)N)=C1 T52159 [0,1,0,0,0,0|2,0,1]=4 550 B10R1.113 CC1=CC=CC([C@H](C)N)=C1 T50309 [0,1,0,0,0,0|2,0,1]=4 551 B10R1.113 CC1=CC=CC([N+](=O)[O-])=N1 M42773 [0,1,0,0,0,0|2,0,1]=4 552 B10R1.113 CC1=CC=NC(C(=O)O)=N1 M14425 [0,1,0,0,0,0|2,0,0]=3 553 B10R1.113 CC1=CC=NC(C(N)=O)=N1 M43098 [0,1,0,0,0,0|3,0,0]=4 554 B10R1.113 CC1=CN=CC(C(=O)O)=N1 M10680 [0,1,0,0,0,0|2,0,0]=3 555 B10R1.113 CC1=CN=CC(C(N)=O)=N1 M43097 [0,1,0,0,0,0|3,0,0]=4 556 B10R1.113 CC1=NC=CC(B(O)O)=C1 M24370 [0,1,0,0,0,0|2,0,1]=4 557 B10R1.113 CC1=NC=CC(B(O)O)=C1 M43543 [0,1,0,0,0,0|2,0,1]=4 558 B10R1.113 CC1=NC=CC(C(=O)O)=C1 M15805 [0,1,0,0,0,0|1,0,0]=2 559 B10R1.113 CC1=NC=CC(C(=O)O)=N1 M42778 [0,1,0,0,0,0|2,0,0]=3 560 B10R1.113 CC1=NC=CC([N+](=O)[O-])=C1 M12848 [0,1,0,0,0,0|2,0,1]=4 561 B10R1.113 CN(C)C1=CC(N)=CC=C1 D49538 [0,1,0,0,0,0|3,0,0]=4 562 B10R1.113 CN(C)C1=CC(N)=CC=C1 D49665 [0,1,0,0,0,0|3,0,0]=4 563 B10R1.113 CN(C)C1=CC=CC(Br)=C1 B68052 [0,1,0,0,0,0|3,0,0]=4 564 B10R1.113 CN(C)C1=CC=CC(F)=C1 F46763 [0,1,0,0,0,0|3,0,0]=4 565 B10R1.113 CN(C)C1=CC=CC([Mg+])=C1 D31761 [0,1,0,0,0,0|3,0,0]=4 566 B10R1.113 C[C@@H](N)C1=CC=CC(Br)=C1 B46734 [0,1,0,0,0,0|2,0,1]=4 567 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 F46765 [0,1,0,0,0,0|2,0,1]=4 568 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 F49508 [0,1,0,0,0,0|2,0,1]=4 569 B10R1.113 C[C@@H](N)C1=CC=CC(O)=C1 A49524 [0,1,0,0,0,0|2,0,1]=4 570 B10R1.113 C[C@@H](O)C1=CC=CC(Cl)=C1 C49447 [0,1,0,0,0,0|1,0,1]=3 571 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B46739 [0,1,0,0,0,0|2,0,1]=4 572 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B46743 [0,1,0,0,0,0|2,0,1]=4 573 B10R1.113 C[C@H](N)C1=CC=CC(Br)=C1 B64158 [0,1,0,0,0,0|2,0,1]=4 574 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 F46761 [0,1,0,0,0,0|2,0,1]=4 575 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 F49511 [0,1,0,0,0,0|2,0,1]=4 576 B10R1.113 C[C@H](N)C1=CC=CC(N)=C1 A46961 [0,1,0,0,0,0|2,0,1]=4 577 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 A64155 [0,1,0,0,0,0|2,0,1]=4 578 B10R1.113 C[C@H](N)C1=CC=CC(O)=C1 A64991 [0,1,0,0,0,0|2,0,1]=4 579 B10R1.113 C[C@H](O)C1=CC(N)=CC=C1 A46893 [0,1,0,0,0,0|1,0,1]=3 580 B10R1.113 C[C@H](O)C1=CC=CC(Br)=C1 B49430 [0,1,0,0,0,0|1,0,1]=3 581 B10R1.113 C[C@H](O)C1=CC=CC(Br)=N1 B37443 [0,1,0,0,0,0|2,0,1]=4 582 B10R1.113 C[C@H](O)C1=NC=CC(Cl)=C1 C46192 [0,1,0,0,0,0|2,0,1]=4 583 B10R1.113 FC(F)C1=CC=CC(Br)=C1 B44723 [0,1,0,0,0,0|2,0,1]=4 584 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 B45618 [0,1,0,0,0,0|2,0,0]=3 585 B10R1.113 N=C(N)C1=CC=CC(Cl)=C1 C69433 [0,1,0,0,0,0|2,0,0]=3 586 B10R1.113 N=C(N)C1=CC=CC(F)=C1 F46533 [0,1,0,0,0,0|2,0,0]=3 587 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 B42448 [0,1,0,0,0,0|2,0,0]=3 588 B10R1.113 NC(=O)C1=CC(O)=CC=C1 H45813 [0,1,0,0,0,0|1,0,0]=2 589 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 B45466 [0,1,0,0,0,0|1,0,0]=2 590 B10R1.113 NC(=O)C1=CC=CC(F)=C1 F45492 [0,1,0,0,0,0|1,0,0]=2 591 B10R1.113 NC(=O)C1=CC=NC(Br)=N1 B37467 [0,1,0,0,0,0|3,0,0]=4 592 B10R1.113 NC(=O)C1=CC=NC(Cl)=N1 C4894 [0,1,0,0,0,0|3,0,0]=4 593 B10R1.113 NC(=O)C1=CN=CC(Cl)=N1 C40809 [0,1,0,0,0,0|3,0,0]=4 594 B10R1.113 NC(=O)C1=CN=CC(N)=C1 A43095 [0,1,0,0,0,0|2,0,0]=3 595 B10R1.113 NC(=O)C1=NC(N)=NC=C1 A41100 [0,1,0,0,0,0|3,0,0]=4 596 B10R1.113 NC(=O)C1=NC(O)=CC=C1 H42772 [0,1,0,0,0,0|2,0,0]=3 597 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 B12089 [0,1,0,0,0,0|2,0,0]=3 598 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 H15729 [0,1,0,0,0,0|2,0,0]=3 599 B10R1.113 NC(=O)C1=NC=CC(N)=C1 A43091 [0,1,0,0,0,0|2,0,0]=3 600 B10R1.113 NC1=CC(B(O)O)=CN=C1 A62316 [0,1,0,0,0,0|2,0,1]=4 601 B10R1.113 NC1=CC(C(=O)O)=CN=C1 A4566 [0,1,0,0,0,0|1,0,0]=2 602 B10R1.113 NC1=CC(C(=O)O)=NC=C1 A10317 [0,1,0,0,0,0|1,0,0]=2 603 B10R1.113 NC1=CC(C(=O)O)=NC=N1 A54071 [0,1,0,0,0,0|2,0,0]=3 604 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 N40963 [0,1,0,0,0,0|2,0,1]=4 605 B10R1.113 NC1=CC([N+](=O)[O-])=CN=C1 N63419 [0,1,0,0,0,0|2,0,1]=4 606 B10R1.113 NC1=CC([N+](=O)[O-])=NC=C1 A40965 [0,1,0,0,0,0|2,0,1]=4 607 B10R1.113 NC1=CC=CC(B(O)O)=C1 A1370 [0,1,0,0,0,0|1,0,1]=3 608 B10R1.113 NC1=CC=CC(B(O)O)=C1 A2231 [0,1,0,0,0,0|1,0,1]=3 609 B10R1.113 NC1=CC=CC(B(O)O)=C1 A31607 [0,1,0,0,0,0|1,0,1]=3 610 B10R1.113 NC1=CC=CC(B(O)O)=C1 A56559 [0,1,0,0,0,0|1,0,1]=3 611 B10R1.113 NC1=CC=CC(C(=O)O)=C1 A69286 [0,1,0,0,0,0|0,0,0]=1 612 B10R1.113 NC1=CC=CC(C(=O)O)=N1 A4798 [0,1,0,0,0,0|1,0,0]=2 613 B10R1.113 NC1=CC=CC([N+](=O)[O-])=C1 N43520 [0,1,0,0,0,0|1,0,1]=3 614 B10R1.113 NC1=CC=CC([N+](=O)[O-])=N1 N36745 [0,1,0,0,0,0|2,0,1]=4 615 B10R1.113 NC1=CN=CC(C(=O)O)=N1 A40967 [0,1,0,0,0,0|2,0,0]=3 616 B10R1.113 NC1=NC=CC(B(O)O)=C1 A38700 [0,1,0,0,0,0|2,0,1]=4 617 B10R1.113 NC1=NC=CC(C(=O)O)=C1 A3938 [0,1,0,0,0,0|1,0,0]=2 618 B10R1.113 NC1=NC=CC(C(=O)O)=N1 A3707 [0,1,0,0,0,0|2,0,0]=3 619 B10R1.113 NC1=NC=CC([N+](=O)[O-])=C1 N8944 [0,1,0,0,0,0|2,0,1]=4 620 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 C64820 [0,1,0,0,0,0|1,0,0]=2 621 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=N1 C42007 [0,1,0,0,0,0|2,0,0]=3 622 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=N1 C40485 [0,1,0,0,0,0|3,0,0]=4 623 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 B69308 [0,1,0,0,0,0|1,0,0]=2 624 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 B2422 [0,1,0,0,0,0|1,0,0]=2 625 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 C10556 [0,1,0,0,0,0|1,0,0]=2 626 B10R1.113 O=C(O)C1=CC(Cl)=CN=N1 C40581 [0,1,0,0,0,0|2,0,0]=3 627 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 C12400 [0,1,0,0,0,0|1,0,0]=2 628 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 C10743 [0,1,0,0,0,0|2,0,0]=3 629 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 C11605 [0,1,0,0,0,0|2,0,0]=3 630 B10R1.113 O=C(O)C1=CC(F)=CN=C1 F12047 [0,1,0,0,0,0|1,0,0]=2 631 B10R1.113 O=C(O)C1=CC(F)=NC=C1 F42254 [0,1,0,0,0,0|1,0,0]=2 632 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H3170 [0,1,0,0,0,0|1,0,0]=2 633 B10R1.113 O=C(O)C1=CC(O)=NC=C1 H38104 [0,1,0,0,0,0|1,0,0]=2 634 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 B39364 [0,1,0,0,0,0|0,0,0]=1 635 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 B4508 [0,1,0,0,0,0|1,0,0]=2 636 B10R1.113 O=C(O)C1=CC=CC(F)=C1 F68888 [0,1,0,0,0,0|0,0,0]=1 637 B10R1.113 O=C(O)C1=CC=CC(F)=N1 F3784 [0,1,0,0,0,0|1,0,0]=2 638 B10R1.113 O=C(O)C1=CC=CC(I)=C1 K68155 [0,1,0,0,0,0|0,0,0]=1 639 B10R1.113 O=C(O)C1=CC=NC(Br)=N1 B32155 [0,1,0,0,0,0|2,0,0]=3 640 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 C5854 [0,1,0,0,0,0|2,0,0]=3 641 B10R1.113 O=C(O)C1=CN=CC(Br)=N1 B32134 [0,1,0,0,0,0|2,0,0]=3 642 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 C0341 [0,1,0,0,0,0|2,0,0]=3 643 B10R1.113 O=C(O)C1=CN=CC(O)=C1 H4735 [0,1,0,0,0,0|1,0,0]=2 644 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 B7920 [0,1,0,0,0,0|1,0,0]=2 645 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 C24201 [0,1,0,0,0,0|1,0,0]=2 646 B10R1.113 O=C(O)C1=NC=CC(F)=C1 F42252 [0,1,0,0,0,0|1,0,0]=2 647 B10R1.113 O=C(O)C1=NC=CC(I)=C1 I3949 [0,1,0,0,0,0|1,0,0]=2 648 B10R1.113 O=C(O)C1=NC=CC(O)=C1 H9415 [0,1,0,0,0,0|1,0,0]=2 649 B10R1.113 O=C(O)C1=NC=NC(O)=C1 H3196 [0,1,0,0,0,0|2,0,0]=3 650 B10R1.113 O=C1C=C(C(=O)O)C=NN1 X69567 [0,1,0,0,0,0|2,0,0]=3 651 B10R1.113 O=C1C=NC=C(C(=O)O)N1 X40760 [0,1,0,0,0,0|2,0,0]=3 652 B10R1.113 O=C1C=NC=C(C(=O)[O-])N1 S65540 [0,1,0,0,0,0|2,0,1]=4 653 B10R1.113 O=C1N=CC=C(C(=O)O)N1 X60835 [0,1,0,0,0,0|2,0,0]=3 654 B10R1.113 O=[N+]([O-])C1=CC(Br)=CN=C1 B40576 [0,1,0,0,0,0|2,0,1]=4 655 B10R1.113 O=[N+]([O-])C1=CC(Br)=NC=C1 B8996 [0,1,0,0,0,0|2,0,1]=4 656 B10R1.113 O=[N+]([O-])C1=CC(Cl)=CN=C1 C40578 [0,1,0,0,0,0|2,0,1]=4 657 B10R1.113 O=[N+]([O-])C1=CC(Cl)=NC=C1 C0227 [0,1,0,0,0,0|2,0,1]=4 658 B10R1.113 O=[N+]([O-])C1=CC(F)=CN=C1 F40586 [0,1,0,0,0,0|2,0,1]=4 659 B10R1.113 O=[N+]([O-])C1=CC=CC(Br)=N1 B38246 [0,1,0,0,0,0|2,0,1]=4 660 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=N1 C9434 [0,1,0,0,0,0|2,0,1]=4 661 B10R1.113 O=[N+]([O-])C1=CC=CC(F)=C1 F42253 [0,1,0,0,0,0|1,0,1]=3 662 B10R1.113 O=[N+]([O-])C1=NC=CC(Br)=C1 B32113 [0,1,0,0,0,0|2,0,1]=4 663 B10R1.113 O=[N+]([O-])C1=NC=CC(Cl)=C1 C40579 [0,1,0,0,0,0|2,0,1]=4 664 B10R1.113 O=[N+]([O-])C1=NC=CC(F)=C1 F40587 [0,1,0,0,0,0|2,0,1]=4 665 B10R1.113 OB(O)C1=CC(Br)=CN=C1 B1954 [0,1,0,0,0,0|2,0,1]=4 666 B10R1.113 OB(O)C1=CC(Br)=NC=C1 B40991 [0,1,0,0,0,0|2,0,1]=4 667 B10R1.113 OB(O)C1=CC(Cl)=CN=C1 C3534 [0,1,0,0,0,0|2,0,1]=4 668 B10R1.113 OB(O)C1=CC(Cl)=NC=C1 C2286 [0,1,0,0,0,0|2,0,1]=4 669 B10R1.113 OB(O)C1=CC(F)=CN=C1 F25954 [0,1,0,0,0,0|2,0,1]=4 670 B10R1.113 OB(O)C1=CC(F)=NC=C1 F2370 [0,1,0,0,0,0|2,0,1]=4 671 B10R1.113 OB(O)C1=CC=CC(Br)=C1 B1920 [0,1,0,0,0,0|1,0,1]=3 672 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 C2260 [0,1,0,0,0,0|1,0,1]=3 673 B10R1.113 OB(O)C1=CC=CC(F)=C1 F3360 [0,1,0,0,0,0|1,0,1]=3 674 B10R1.113 OB(O)C1=CC=CC(F)=N1 F40993 [0,1,0,0,0,0|2,0,1]=4 675 B10R1.113 OB(O)C1=CC=CC(I)=C1 K3840 [0,1,0,0,0,0|1,0,1]=3 676 B10R1.113 OB(O)C1=CC=CC(O)=C1 H3740 [0,1,0,0,0,0|1,0,1]=3 677 B10R2.6 C1=CC=C([C@@H]2CO2)C=C1 P68601 [0,0,0,1,0,0|1,0,1]=3 678 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 P68362 [0,0,0,1,0,0|1,0,1]=3 679 B10R2.320 Br[C@H]1CC2=C1C=CC=C2 B68954 [0,0,0,1,0,0|2,0,1]=4 680 B10R2.320 O=C1CC2=C1C=CC=C2 B36727 [0,0,0,1,0,0|1,0,0]=2 681 B8R1.7 CC(=O)C1=CC=CN1 P68619 [0,0,0,0,1,0|2,0,0]=3 682 B8R1.7 CC(=O)C1=CC=CS1 A69304 [0,0,0,0,1,0|2,0,0]=3 683 B8R1.7 CC(=O)C1=CC=NN1 P61226 [0,0,0,0,1,0|3,0,0]=4 684 B8R1.7 CC(=O)C1=CC=NO1 K40990 [0,0,0,0,1,0|3,0,0]=4 685 B8R1.7 CC(=O)C1=CNC=C1 A37548 [0,0,0,0,1,0|2,0,0]=3 686 B8R1.7 CC(=O)C1=CNC=N1 A41019 [0,0,0,0,1,0|3,0,0]=4 687 B8R1.7 CC(=O)C1=CNN=C1 P22638 [0,0,0,0,1,0|3,0,0]=4 688 B8R1.7 CC(=O)C1=CSC=C1 A12828 [0,0,0,0,1,0|2,0,0]=3 689 B8R1.7 CC(=O)C1=CSC=N1 T41006 [0,0,0,0,1,0|3,0,0]=4 690 B8R1.7 CC(=O)C1=NC=CN1 K67604 [0,0,0,0,1,0|3,0,0]=4 691 B8R1.7 CC(=O)C1=NC=CS1 A22587 [0,0,0,0,1,0|3,0,0]=4 692 B8R1.7 CC(=O)C1=NOC=C1 K40989 [0,0,0,0,1,0|3,0,0]=4 693 B8R1.7 CC(=O)N1C=CN=C1 I37940 [0,0,0,0,1,0|3,0,0]=4 694 B8R1.7 C[C@@H](O)C1=CC=CO1 F43302 [0,0,0,0,1,0|2,0,1]=4 695 B8R1.7 NC(=O)C1=COC=N1 X40074 [0,0,0,0,1,0|3,0,0]=4 696 B8R1.7 NC(=O)C1=NC=CO1 X26086 [0,0,0,0,1,0|3,0,0]=4 697 B8R1.7 NC(=O)C1=NC=CS1 T61005 [0,0,0,0,1,0|3,0,0]=4 698 B8R1.7 NC(=O)C1=NNC=C1 P67746 [0,0,0,0,1,0|3,0,0]=4 699 B8R1.7 NC(=S)C1=CC=CS1 T41010 [0,0,0,0,1,0|2,1,0]=4 700 B8R1.7 O=C(Cl)C1=CC=CS1 T10056 [0,0,0,0,1,0|2,0,0]=3 701 B8R1.7 O=C(O)C1=CC=CN1 P24658 [0,0,0,0,1,0|1,0,0]=2 702 B8R1.7 O=C(O)C1=CC=CO1 F38499 [0,0,0,0,1,0|1,0,0]=2 703 B8R1.7 O=C(O)C1=CC=CS1 T69312 [0,0,0,0,1,0|1,0,0]=2 704 B8R1.7 O=C(O)C1=CC=NO1 K40064 [0,0,0,0,1,0|2,0,0]=3 705 B8R1.7 O=C(O)C1=CC=NS1 T40063 [0,0,0,0,1,0|2,0,0]=3 706 B8R1.7 O=C(O)C1=CCCC1 C43305 [0,0,0,0,1,0|0,0,3]=4 707 B8R1.7 O=C(O)C1=CN=CO1 O9363 [0,0,0,0,1,0|2,0,0]=3 708 B8R1.7 O=C(O)C1=CN=CS1 T2164 [0,0,0,0,1,0|2,0,0]=3 709 B8R1.7 O=C(O)C1=CNN=C1 P10474 [0,0,0,0,1,0|2,0,0]=3 710 B8R1.7 O=C(O)C1=CNN=N1 T38190 [0,0,0,0,1,0|3,0,0]=4 711 B8R1.7 O=C(O)C1=COC=C1 F14351 [0,0,0,0,1,0|1,0,0]=2 712 B8R1.7 O=C(O)C1=COC=N1 X9342 [0,0,0,0,1,0|2,0,0]=3 713 B8R1.7 O=C(O)C1=COCC1 D8190 [0,0,0,0,1,0|1,0,2]=4 714 B8R1.7 O=C(O)C1=CON=C1 X24704 [0,0,0,0,1,0|2,0,0]=3 715 B8R1.7 O=C(O)C1=CSC=C1 T12825 [0,0,0,0,1,0|1,0,0]=2 716 B8R1.7 O=C(O)C1=CSC=N1 T2163 [0,0,0,0,1,0|2,0,0]=3 717 B8R1.7 O=C(O)C1=CSN=C1 T40062 [0,0,0,0,1,0|2,0,0]=3 718 B8R1.7 O=C(O)C1=CSN=N1 T61264 [0,0,0,0,1,0|3,0,0]=4 719 B8R1.7 O=C(O)C1=NC=CN1 I37951 [0,0,0,0,1,0|2,0,0]=3 720 B8R1.7 O=C(O)C1=NC=CS1 T9224 [0,0,0,0,1,0|2,0,0]=3 721 B8R1.7 O=C(O)C1=NNC=C1 P9459 [0,0,0,0,1,0|2,0,0]=3 722 B8R1.7 O=C(O)C1=NOC=C1 I12360 [0,0,0,0,1,0|2,0,0]=3 723 B8R1.7 O=C(O)C1=NON=C1 X39804 [0,0,0,0,1,0|3,0,0]=4 724 B8R1.7 O=C(O)C1=NSC=C1 I6110 [0,0,0,0,1,0|2,0,0]=3 725 B8R1.7 O=C(O)C1CC=CC1 C11537 [0,0,0,0,1,0|0,0,3]=4 726 B8R1.7 O=C(O)[C@@H]1C=CCN1 D41170 [0,0,0,0,1,0|1,0,2]=4 727 B8R1.7 O=C(O)[C@@H]1C=CCN1 D41356 [0,0,0,0,1,0|1,0,2]=4 728 B8R1.7 O=C([O-])C1=CC=CS1 C2751 [0,0,0,0,1,0|1,0,1]=3 729 B8R1.7 O=C([O-])C1=CC=CS1 C41403 [0,0,0,0,1,0|1,0,1]=3 730 B8R1.7 O=C([O-])C1=NC=CO1 S40296 [0,0,0,0,1,0|2,0,1]=4 731 B8R1.7 O=[N+]([O-])C1=CNC=C1 N38853 [0,0,0,0,1,0|2,0,1]=4 732 B8R1.7 OB(O)C1=CC=CO1 F3580 [0,0,0,0,1,0|2,0,1]=4 733 B8R1.7 OB(O)C1=COC=C1 F3600 [0,0,0,0,1,0|2,0,1]=4 734 B8R1.7 OB(O)C1=CSC=C1 T5200 [0,0,0,0,1,0|2,0,1]=4 735 B10R1.18 CC(=O)CC1=CC=NC=C1 P49256 [0,0,0,0,0,1|2,0,0]=3 736 B10R1.18 CC(=O)CC1=NC=CC=C1 P15826 [0,0,0,0,0,1|2,0,0]=3 737 B10R1.18 CC(=O)NC1=CC=CC=C1 A60649 [0,0,0,0,0,1|1,0,0]=2 738 B10R1.18 CC(=O)NC1=CN=CC=C1 P63567 [0,0,0,0,0,1|2,0,0]=3 739 B10R1.18 CC(=O)NC1=NC=CC=N1 P43093 [0,0,0,0,0,1|3,0,0]=4 740 B10R1.18 CC(C)=CC1=CC=CC=C1 M52675 [0,0,0,0,0,1|2,0,0]=3 741 B10R1.18 CC(C)NC1=CC=CC=C1 P69278 [0,0,0,0,0,1|2,0,1]=4 742 B10R1.18 FC(F)OC1=CC=CC=C1 D45605 [0,0,0,0,0,1|2,0,1]=4 743 B10R1.18 N=C(N)CC1=CC=CC=C1 P22633 [0,0,0,0,0,1|2,0,0]=3 744 B10R1.18 N=C(N)NC1=CC=CC=C1 P49691 [0,0,0,0,0,1|2,0,0]=3 745 B10R1.18 NC(=O)CC1=CC=CC=C1 P69172 [0,0,0,0,0,1|1,0,0]=2 746 B10R1.18 NC(=O)CC1=CN=CC=C1 P45977 [0,0,0,0,0,1|2,0,0]=3 747 B10R1.18 NC(=O)CC1=NC=CC=N1 P43092 [0,0,0,0,0,1|3,0,0]=4 748 B10R1.18 NC(=O)NC1=NC=CN=C1 P41097 [0,0,0,0,0,1|3,0,0]=4 749 B10R1.18 NC(=O)OC1=CC=CC=C1 P45812 [0,0,0,0,0,1|1,0,0]=2 750 B10R1.18 NC(=S)NC1=NC=CC=C1 P43125 [0,0,0,0,0,1|2,1,0]=4 751 B10R1.18 O=C(O)CC1=CC=NC=C1 P46551 [0,0,0,0,0,1|1,0,0]=2 752 B10R1.18 O=C(O)CC1=CN=CC=C1 P39426 [0,0,0,0,0,1|1,0,0]=2 753 B10R1.18 O=C(O)CC1=CN=CN=C1 P12239 [0,0,0,0,0,1|2,0,0]=3 754 B10R1.18 O=C(O)CC1=CN=NC=C1 P10225 [0,0,0,0,0,1|2,0,0]=3 755 B10R1.18 O=C(O)CC1=NC=CC=C1 P18563 [0,0,0,0,0,1|1,0,0]=2 756 B10R1.18 O=C(O)CC1=NC=CC=C1 P38331 [0,0,0,0,0,1|1,0,0]=2 757 B10R1.18 O=C(O)CC1=NC=CC=N1 P0756 [0,0,0,0,0,1|2,0,0]=3 758 B10R1.18 O=C(O)CC1=NC=CN=C1 P12241 [0,0,0,0,0,1|2,0,0]=3 759 B10R1.18 O=C(O)CC1=NC=NC=C1 P12245 [0,0,0,0,0,1|2,0,0]=3 760 B10R1.18 O=C(O)CC1=NN=CC=C1 P12243 [0,0,0,0,0,1|2,0,0]=3 761 B10R1.18 O=C([O-])CC1=CN=NC=C1 P10226 [0,0,0,0,0,1|2,0,1]=4 762 B10R1.18 O=C([O-])CC1=NC=CC=N1 P7450 [0,0,0,0,0,1|2,0,1]=4 763 B10R1.18 O=C([O-])CC1=NN=CC=C1 P27036 [0,0,0,0,0,1|2,0,1]=4 764 B10R1.18 S=C(Cl)OC1=CC=CC=C1 P37341 [0,0,0,0,0,1|1,1,0]=3 765 B7R1.3 BrC1=CC=NC=C1 B2747 [2,0,0,0,0,0|2,0,0]=4 766 B7R1.3 BrC1=CC=NC=C1 B65041 [2,0,0,0,0,0|2,0,0]=4 767 B7R1.3 BrC1=CN=CC=C1 B2746 [2,0,0,0,0,0|2,0,0]=4 768 B7R1.3 C[N+]1=CC=CC=C1 M38728 [2,0,0,0,0,0|1,0,1]=4 769 B7R1.3 ClC1=CC=NC=C1 C39170 [2,0,0,0,0,0|2,0,0]=4 770 B7R1.3 ClC1=CN=CC=C1 C68367 [2,0,0,0,0,0|2,0,0]=4 771 B7R1.3 FC1=CC=NC=C1 F2970 [2,0,0,0,0,0|2,0,0]=4 772 B7R1.3 FC1=CN=CC=C1 F1892 [2,0,0,0,0,0|2,0,0]=4 773 B7R1.3 FC1=NC=CC=C1 F4862 [2,0,0,0,0,0|2,0,0]=4 774 B7R1.3 IC1=CC=CC=C1 I38419 [2,0,0,0,0,0|1,0,0]=3 775 B7R1.3 IC1=CC=NC=C1 I3870 [2,0,0,0,0,0|2,0,0]=4 776 B7R1.3 IC1=CN=CC=C1 I16635 [2,0,0,0,0,0|2,0,0]=4 777 B7R1.3 IC1=NC=CC=C1 K67594 [2,0,0,0,0,0|2,0,0]=4 778 B7R1.3 NC1=NC=CC=C1 A23973 [2,0,0,0,0,0|2,0,0]=4 779 B7R1.3 O=C1C=CC=NN1 P5932 [2,0,0,0,0,0|2,0,0]=4 780 B7R1.3 O=C1C=CN=CN1 P0246 [2,0,0,0,0,0|2,0,0]=4 781 B7R1.3 O=C1C=COC=C1 P40862 [2,0,0,0,0,0|1,0,0]=3 782 B7R1.3 O=C1C=NC=CN1 H68630 [2,0,0,0,0,0|2,0,0]=4 783 B7R1.3 O=C1N=CC=CN1 P67458 [2,0,0,0,0,0|2,0,0]=4 784 B7R1.3 OC1=CC=NC=C1 H10331 [2,0,0,0,0,0|1,0,0]=3 785 B7R1.3 OC1=CN=CN=C1 H14432 [2,0,0,0,0,0|2,0,0]=4 786 B7R1.3 OC1=CN=NC=C1 H22270 [2,0,0,0,0,0|2,0,0]=4 787 B7R1.3 OC1=CN=NC=C1 P40299 [2,0,0,0,0,0|2,0,0]=4 788 B7R1.3 OC1=NC=CC=C1 P61113 [2,0,0,0,0,0|1,0,0]=3 789 B7R1.3 OC1=NC=NC=C1 P32223 [2,0,0,0,0,0|2,0,0]=4 790 B7R1.3 [Mg+]C1=CC=CC=C1 P31728 [2,0,0,0,0,0|1,0,0]=3 791 B7R1.3 [Mg+]C1=CN=CC=C1 P8350 [2,0,0,0,0,0|2,0,0]=4 792 B7R1.3 [Mg+]C1=NC=CC=C1 P8351 [2,0,0,0,0,0|2,0,0]=4 793 B9R0.15 C=CCC(CC=C)C(=O)O A47015 [0,1,1,0,0,0|0,0,2]=4 794 B9R1.1 BrCC1=CC=C(I)C=C1 B45171 [1,1,0,0,0,0|1,0,1]=4 795 B9R1.1 C#CC1=CC=C(Br)C=C1 B47528 [1,1,0,0,0,0|1,0,1]=4 796 B9R1.1 C#CC1=CC=C(C)C=C1 E68609 [1,1,0,0,0,0|1,0,1]=4 797 B9R1.1 C#CC1=CC=C(Cl)C=C1 C4938 [1,1,0,0,0,0|1,0,1]=4 798 B9R1.1 C#CC1=CC=C(F)C=C1 F2891 [1,1,0,0,0,0|1,0,1]=4 799 B9R1.1 C#CC1=CC=C(N)C=C1 E37919 [1,1,0,0,0,0|1,0,1]=4 800 B9R1.1 C=CC1=CC=C(Br)C=C1 B68124 [1,1,0,0,0,0|1,0,0]=3 801 B9R1.1 C=CC1=CC=C(O)C=C1 V67697 [1,1,0,0,0,0|1,0,0]=3 802 B9R1.1 C=CC1=CN=C(C)C=C1 M11564 [1,1,0,0,0,0|2,0,0]=4 803 B9R1.1 C=CC1=CN=C(F)C=C1 E16703 [1,1,0,0,0,0|2,0,0]=4 804 B9R1.1 CC1=CC=C(C=O)C=C1 M68600 [1,1,0,0,0,0|0,0,0]=2 805 B9R1.1 CC1=CC=C(CN)C=C1 M69544 [1,1,0,0,0,0|1,0,1]=4 806 B9R1.1 CC1=CC=C(CO)C=C1 T37852 [1,1,0,0,0,0|0,0,1]=3 807 B9R1.1 CC1=CC=C(NN)C=C1 T68855 [1,1,0,0,0,0|2,0,0]=4 808 B9R1.1 CC1=CN=C(C=O)C=C1 M3063 [1,1,0,0,0,0|1,0,0]=3 809 B9R1.1 CC1=CN=C(C=O)C=N1 M14618 [1,1,0,0,0,0|2,0,0]=4 810 B9R1.1 CC1=CN=C(C=O)N=C1 M11474 [1,1,0,0,0,0|2,0,0]=4 811 B9R1.1 CC1=NC=C(C=O)C=C1 M0419 [1,1,0,0,0,0|1,0,0]=3 812 B9R1.1 CC1=NC=C(C=O)C=N1 M12382 [1,1,0,0,0,0|2,0,0]=4 813 B9R1.1 CC1=NC=C(CO)C=C1 M15722 [1,1,0,0,0,0|1,0,1]=4 814 B9R1.1 CCC1=CC=C(Br)C=C1 B68945 [1,1,0,0,0,0|1,0,1]=4 815 B9R1.1 CCC1=CC=C(Cl)C=C1 C49160 [1,1,0,0,0,0|1,0,1]=4 816 B9R1.1 CCC1=CC=C(I)C=C1 E49167 [1,1,0,0,0,0|1,0,1]=4 817 B9R1.1 CCC1=CC=C([Mg+])C=C1 E31741 [1,1,0,0,0,0|1,0,1]=4 818 B9R1.1 CNC1=CC=C(Br)C=C1 B61266 [1,1,0,0,0,0|2,0,0]=4 819 B9R1.1 CNC1=CC=C(C)C=C1 D39432 [1,1,0,0,0,0|2,0,0]=4 820 B9R1.1 CNC1=CC=C(I)C=C1 K46120 [1,1,0,0,0,0|2,0,0]=4 821 B9R1.1 CNC1=CC=C(N)C=C1 M69627 [1,1,0,0,0,0|2,0,0]=4 822 B9R1.1 COC1=CC=C(S)C=C1 M46276 [1,1,0,0,0,0|2,0,0]=4 823 B9R1.1 COC1=CC=C([Mg+])C=C1 M31744 [1,1,0,0,0,0|2,0,0]=4 824 B9R1.1 CSC1=CC=C(I)C=C1 I38579 [1,1,0,0,0,0|2,0,0]=4 825 B9R1.1 CSC1=CC=C(O)C=C1 M67393 [1,1,0,0,0,0|2,0,0]=4 826 B9R1.1 CSC1=CC=C([Mg+])C=C1 M31771 [1,1,0,0,0,0|2,0,0]=4 827 B9R1.1 ClC1=CC=C(CBr)C=C1 B45158 [1,1,0,0,0,0|1,0,1]=4 828 B9R1.1 ClCC1=CC=C(Br)C=C1 B45160 [1,1,0,0,0,0|1,0,1]=4 829 B9R1.1 FC1=CC=C(C[Mg+])C=C1 F6777 [1,1,0,0,0,0|1,0,1]=4 830 B9R1.1 N#CC1=CC=C(Br)C=C1 B67636 [1,1,0,0,0,0|1,0,1]=4 831 B9R1.1 N#CC1=CC=C(Cl)C=C1 C37848 [1,1,0,0,0,0|1,0,1]=4 832 B9R1.1 N#CC1=CC=C(F)C=C1 F64969 [1,1,0,0,0,0|1,0,1]=4 833 B9R1.1 N#CC1=CC=C(I)C=C1 K44443 [1,1,0,0,0,0|1,0,1]=4 834 B9R1.1 N#CC1=CC=C(N)C=C1 A64955 [1,1,0,0,0,0|1,0,1]=4 835 B9R1.1 N#CC1=CC=C(O)C=C1 C64941 [1,1,0,0,0,0|1,0,1]=4 836 B9R1.1 N#CC1=CC=C(S)C=C1 M64870 [1,1,0,0,0,0|1,0,1]=4 837 B9R1.1 NC1=CC=C(CO)C=C1 A36619 [1,1,0,0,0,0|0,0,1]=3 838 B9R1.1 NC1=CN=C(C=O)C=N1 A63812 [1,1,0,0,0,0|2,0,0]=4 839 B9R1.1 NC1=NC=C(C=O)C=C1 A12393 [1,1,0,0,0,0|1,0,0]=3 840 B9R1.1 NC1=NC=C(C=O)C=C1 A43519 [1,1,0,0,0,0|1,0,0]=3 841 B9R1.1 NC1=NC=C(C=O)C=N1 A3982 [1,1,0,0,0,0|2,0,0]=4 842 B9R1.1 NC1=NC=C(C=O)C=N1 A40961 [1,1,0,0,0,0|2,0,0]=4 843 B9R1.1 NC1=NC=C(CO)C=C1 A0345 [1,1,0,0,0,0|1,0,1]=4 844 B9R1.1 NCC1=CC=C(Br)C=C1 B36612 [1,1,0,0,0,0|1,0,1]=4 845 B9R1.1 NCC1=CC=C(Br)C=C1 B46090 [1,1,0,0,0,0|1,0,1]=4 846 B9R1.1 NCC1=CC=C(Cl)C=C1 C46099 [1,1,0,0,0,0|1,0,1]=4 847 B9R1.1 NCC1=CC=C(I)C=C1 I36689 [1,1,0,0,0,0|1,0,1]=4 848 B9R1.1 NCC1=CC=C(I)C=C1 K46123 [1,1,0,0,0,0|1,0,1]=4 849 B9R1.1 NCC1=CC=C(N)C=C1 A46581 [1,1,0,0,0,0|1,0,1]=4 850 B9R1.1 NCC1=CC=C(O)C=C1 A67587 [1,1,0,0,0,0|1,0,1]=4 851 B9R1.1 NNC1=CC=C(Br)C=C1 B42962 [1,1,0,0,0,0|2,0,0]=4 852 B9R1.1 NNC1=CC=C(Br)C=C1 B42980 [1,1,0,0,0,0|2,0,0]=4 853 B9R1.1 NNC1=CC=C(Cl)C=C1 C61981 [1,1,0,0,0,0|2,0,0]=4 854 B9R1.1 NNC1=CC=C(Cl)C=C1 C68982 [1,1,0,0,0,0|2,0,0]=4 855 B9R1.1 NNC1=CC=C(F)C=C1 F25536 [1,1,0,0,0,0|2,0,0]=4 856 B9R1.1 NNC1=CC=C(I)C=C1 K43029 [1,1,0,0,0,0|2,0,0]=4 857 B9R1.1 O=C1C=CC(CO)=CN1 H37111 [1,1,0,0,0,0|1,0,1]=4 858 B9R1.1 O=CC1=CC=C(Br)C=C1 B67400 [1,1,0,0,0,0|0,0,0]=2 859 B9R1.1 O=CC1=CC=C(Cl)C=C1 C37300 [1,1,0,0,0,0|0,0,0]=2 860 B9R1.1 O=CC1=CC=C(F)C=C1 F4631 [1,1,0,0,0,0|0,0,0]=2 861 B9R1.1 O=CC1=CC=C(I)C=C1 K20170 [1,1,0,0,0,0|0,0,0]=2 862 B9R1.1 O=CC1=CN=C(Br)C=C1 B2834 [1,1,0,0,0,0|1,0,0]=3 863 B9R1.1 O=CC1=CN=C(Cl)C=C1 C3215 [1,1,0,0,0,0|1,0,0]=3 864 B9R1.1 O=CC1=CN=C(Cl)C=N1 C12389 [1,1,0,0,0,0|2,0,0]=4 865 B9R1.1 O=CC1=CN=C(Cl)N=C1 C0338 [1,1,0,0,0,0|2,0,0]=4 866 B9R1.1 O=CC1=CN=C(F)C=C1 F13991 [1,1,0,0,0,0|1,0,0]=3 867 B9R1.1 O=CC1=CNC(=O)C=C1 X42601 [1,1,0,0,0,0|1,0,0]=3 868 B9R1.1 O=CC1=CNC(=O)N=C1 X63767 [1,1,0,0,0,0|2,0,0]=4 869 B9R1.1 O=CC1=NC=C(Br)C=C1 B1678 [1,1,0,0,0,0|1,0,0]=3 870 B9R1.1 O=CC1=NC=C(Cl)C=C1 C5623 [1,1,0,0,0,0|1,0,0]=3 871 B9R1.1 O=CC1=NC=C(F)C=N1 F11271 [1,1,0,0,0,0|2,0,0]=4 872 B9R1.1 O=CC1=NC=C(O)C=C1 H36846 [1,1,0,0,0,0|1,0,0]=3 873 B9R1.1 O=CC1=NN=C(Cl)C=C1 C9432 [1,1,0,0,0,0|2,0,0]=4 874 B9R1.1 O=CC1=NNC(=O)C=C1 X3635 [1,1,0,0,0,0|2,0,0]=4 875 B9R1.1 OCC1=CC=C(Br)C=C1 B67585 [1,1,0,0,0,0|0,0,1]=3 876 B9R1.1 OCC1=CC=C(Cl)C=C1 C39406 [1,1,0,0,0,0|0,0,1]=3 877 B9R1.1 OCC1=CC=C(F)C=C1 F39409 [1,1,0,0,0,0|0,0,1]=3 878 B9R1.1 OCC1=CC=C(I)C=C1 I36662 [1,1,0,0,0,0|0,0,1]=3 879 B9R1.1 OCC1=CN=C(Br)C=C1 B12392 [1,1,0,0,0,0|1,0,1]=4 880 B9R1.1 OCC1=CN=C(Cl)C=C1 C9389 [1,1,0,0,0,0|1,0,1]=4 881 B9R1.1 OCC1=CN=C(F)C=C1 F13989 [1,1,0,0,0,0|1,0,1]=4 882 B9R1.1 OCC1=NC=C(Br)C=C1 B3203 [1,1,0,0,0,0|1,0,1]=4 883 B9R1.1 OCC1=NC=C(Cl)C=C1 C22297 [1,1,0,0,0,0|1,0,1]=4 884 B9R1.1 OCC1=NC=C(F)C=C1 F0644 [1,1,0,0,0,0|1,0,1]=4 885 B9R1.2 BrCC1=CC=CC(Br)=C1 B39369 [1,1,0,0,0,0|1,0,1]=4 886 B9R1.2 BrCC1=CC=CC(I)=C1 B45170 [1,1,0,0,0,0|1,0,1]=4 887 B9R1.2 C#CC1=CC(C)=CC=C1 E51331 [1,1,0,0,0,0|1,0,1]=4 888 B9R1.2 C#CC1=CC=CC(Br)=C1 B47527 [1,1,0,0,0,0|1,0,1]=4 889 B9R1.2 C#CC1=CC=CC(Cl)=C1 C25303 [1,1,0,0,0,0|1,0,1]=4 890 B9R1.2 C#CC1=CC=CC(F)=C1 F47538 [1,1,0,0,0,0|1,0,1]=4 891 B9R1.2 C#CC1=CC=CC(N)=C1 E48307 [1,1,0,0,0,0|1,0,1]=4 892 B9R1.2 C#CC1=CC=CC(N)=C1 E49598 [1,1,0,0,0,0|1,0,1]=4 893 B9R1.2 C#CC1=CC=CC(O)=C1 E37627 [1,1,0,0,0,0|1,0,1]=4 894 B9R1.2 C=CC1=CC(Br)=CN=C1 B38372 [1,1,0,0,0,0|2,0,0]=4 895 B9R1.2 C=CC1=CC(F)=CN=C1 E16704 [1,1,0,0,0,0|2,0,0]=4 896 B9R1.2 C=CC1=CC=CC(Br)=C1 B36635 [1,1,0,0,0,0|1,0,0]=3 897 B9R1.2 C=CC1=CC=CC(N)=C1 V49171 [1,1,0,0,0,0|1,0,0]=3 898 B9R1.2 C=CC1=NC(C)=CC=C1 M16640 [1,1,0,0,0,0|2,0,0]=4 899 B9R1.2 C=CC1=NC=CC(Br)=C1 B36792 [1,1,0,0,0,0|2,0,0]=4 900 B9R1.2 C=CC1=NC=CC(Cl)=C1 C45320 [1,1,0,0,0,0|2,0,0]=4 901 B9R1.2 C=CC1=NC=CC(N)=C1 V45970 [1,1,0,0,0,0|2,0,0]=4 902 B9R1.2 CC1=CC(C=O)=CN=C1 M12908 [1,1,0,0,0,0|1,0,0]=3 903 B9R1.2 CC1=CC(C=O)=NC=C1 M3027 [1,1,0,0,0,0|1,0,0]=3 904 B9R1.2 CC1=CC(CO)=CN=C1 H10516 [1,1,0,0,0,0|1,0,1]=4 905 B9R1.2 CC1=CC(CO)=NC=C1 M46387 [1,1,0,0,0,0|1,0,1]=4 906 B9R1.2 CC1=CC=CC(C=O)=N1 M67935 [1,1,0,0,0,0|1,0,0]=3 907 B9R1.2 CC1=CC=CC(CN)=C1 M37355 [1,1,0,0,0,0|1,0,1]=4 908 B9R1.2 CC1=CC=CC(CO)=N1 M46384 [1,1,0,0,0,0|1,0,1]=4 909 B9R1.2 CC1=CC=CC(NN)=C1 M46458 [1,1,0,0,0,0|2,0,0]=4 910 B9R1.2 CC1=CC=NC(C=O)=N1 M14427 [1,1,0,0,0,0|2,0,0]=4 911 B9R1.2 CC1=CN=CC(C=O)=N1 M16928 [1,1,0,0,0,0|2,0,0]=4 912 B9R1.2 CC1=NC=CC(C=O)=C1 M36797 [1,1,0,0,0,0|1,0,0]=3 913 B9R1.2 CC1=NC=CC(C=O)=N1 M42771 [1,1,0,0,0,0|2,0,0]=4 914 B9R1.2 CC1=NC=CC(CO)=C1 M4019 [1,1,0,0,0,0|1,0,1]=4 915 B9R1.2 CCC1=CC=CC(Br)=C1 B49158 [1,1,0,0,0,0|1,0,1]=4 916 B9R1.2 CCC1=CC=CC(N)=C1 E68361 [1,1,0,0,0,0|1,0,1]=4 917 B9R1.2 CCC1=CC=CC([Mg+])=C1 E31740 [1,1,0,0,0,0|1,0,1]=4 918 B9R1.2 CNC1=CC(C)=CC=C1 D46861 [1,1,0,0,0,0|2,0,0]=4 919 B9R1.2 CNC1=CC=CC(Br)=C1 B46077 [1,1,0,0,0,0|2,0,0]=4 920 B9R1.2 CNC1=CC=CC(Br)=C1 B66504 [1,1,0,0,0,0|2,0,0]=4 921 B9R1.2 COC1=CC(O)=CC=C1 M27960 [1,1,0,0,0,0|2,0,0]=4 922 B9R1.2 COC1=CC=CC(F)=C1 F45965 [1,1,0,0,0,0|2,0,0]=4 923 B9R1.2 COC1=CC=CC(I)=C1 K45966 [1,1,0,0,0,0|2,0,0]=4 924 B9R1.2 COC1=CC=CC([Mg+])=C1 M31743 [1,1,0,0,0,0|2,0,0]=4 925 B9R1.2 CSC1=CC(N)=CC=C1 M46442 [1,1,0,0,0,0|2,0,0]=4 926 B9R1.2 CSC1=CC=CC(Br)=C1 B45613 [1,1,0,0,0,0|2,0,0]=4 927 B9R1.2 ClC1=CC=CC(CBr)=C1 B39371 [1,1,0,0,0,0|1,0,1]=4 928 B9R1.2 ClCC1=CC=CC(Br)=C1 B45159 [1,1,0,0,0,0|1,0,1]=4 929 B9R1.2 ClCC1=CC=CC(I)=C1 C45183 [1,1,0,0,0,0|1,0,1]=4 930 B9R1.2 FC1=CC=CC(CBr)=C1 B45165 [1,1,0,0,0,0|1,0,1]=4 931 B9R1.2 N#CC1=CC=CC(Br)=C1 B67572 [1,1,0,0,0,0|1,0,1]=4 932 B9R1.2 N#CC1=CC=CC(Cl)=C1 C39326 [1,1,0,0,0,0|1,0,1]=4 933 B9R1.2 N#CC1=CC=CC(F)=C1 F39329 [1,1,0,0,0,0|1,0,1]=4 934 B9R1.2 N#CC1=CC=CC(I)=C1 K44442 [1,1,0,0,0,0|1,0,1]=4 935 B9R1.2 N#CC1=CC=CC(O)=C1 H64947 [1,1,0,0,0,0|1,0,1]=4 936 B9R1.2 NC1=CC(C=O)=NC=C1 A37575 [1,1,0,0,0,0|1,0,0]=3 937 B9R1.2 NC1=CC(CO)=CN=C1 A43207 [1,1,0,0,0,0|1,0,1]=4 938 B9R1.2 NC1=CC(CO)=NC=C1 A15900 [1,1,0,0,0,0|1,0,1]=4 939 B9R1.2 NC1=CC=CC(C=O)=C1 A46548 [1,1,0,0,0,0|0,0,0]=2 940 B9R1.2 NC1=CC=CC(CO)=C1 A37868 [1,1,0,0,0,0|0,0,1]=3 941 B9R1.2 NC1=CC=CC(CO)=N1 A43208 [1,1,0,0,0,0|1,0,1]=4 942 B9R1.2 NC1=NC=CC(CO)=C1 A10460 [1,1,0,0,0,0|1,0,1]=4 943 B9R1.2 NCC1=CC=CC(Br)=C1 B46079 [1,1,0,0,0,0|1,0,1]=4 944 B9R1.2 NCC1=CC=CC(Cl)=C1 C46098 [1,1,0,0,0,0|1,0,1]=4 945 B9R1.2 NCC1=CC=CC(F)=C1 F15968 [1,1,0,0,0,0|1,0,1]=4 946 B9R1.2 NCC1=CC=CC(I)=C1 K46122 [1,1,0,0,0,0|1,0,1]=4 947 B9R1.2 NCC1=CC=CC(N)=C1 A43599 [1,1,0,0,0,0|1,0,1]=4 948 B9R1.2 NNC1=CC=CC(Br)=C1 B42979 [1,1,0,0,0,0|2,0,0]=4 949 B9R1.2 NNC1=CC=CC(F)=C1 F43527 [1,1,0,0,0,0|2,0,0]=4 950 B9R1.2 O=C1C=C(CO)C=CN1 H0460 [1,1,0,0,0,0|1,0,1]=4 951 B9R1.2 O=C1C=CC=C(CO)N1 H23237 [1,1,0,0,0,0|1,0,1]=4 952 B9R1.2 O=CC1=CC(Br)=CN=C1 B3012 [1,1,0,0,0,0|1,0,0]=3 953 B9R1.2 O=CC1=CC(Br)=NC=C1 B2598 [1,1,0,0,0,0|1,0,0]=3 954 B9R1.2 O=CC1=CC(Br)=NC=N1 B40605 [1,1,0,0,0,0|2,0,0]=4 955 B9R1.2 O=CC1=CC(Cl)=CN=C1 C15036 [1,1,0,0,0,0|1,0,0]=3 956 B9R1.2 O=CC1=CC(Cl)=NC=C1 C0408 [1,1,0,0,0,0|1,0,0]=3 957 B9R1.2 O=CC1=CC(F)=CN=C1 F15543 [1,1,0,0,0,0|1,0,0]=3 958 B9R1.2 O=CC1=CC(F)=NC=C1 F2753 [1,1,0,0,0,0|1,0,0]=3 959 B9R1.2 O=CC1=CC(O)=CC=C1 H15969 [1,1,0,0,0,0|0,0,0]=2 960 B9R1.2 O=CC1=CC(O)=NC=C1 H42599 [1,1,0,0,0,0|1,0,0]=3 961 B9R1.2 O=CC1=CC=CC(Br)=C1 B68146 [1,1,0,0,0,0|0,0,0]=2 962 B9R1.2 O=CC1=CC=CC(Br)=N1 B0253 [1,1,0,0,0,0|1,0,0]=3 963 B9R1.2 O=CC1=CC=CC(Cl)=C1 C69283 [1,1,0,0,0,0|0,0,0]=2 964 B9R1.2 O=CC1=CC=CC(Cl)=N1 C42296 [1,1,0,0,0,0|1,0,0]=3 965 B9R1.2 O=CC1=CC=CC(F)=C1 F45149 [1,1,0,0,0,0|0,0,0]=2 966 B9R1.2 O=CC1=CC=CC(F)=N1 F42303 [1,1,0,0,0,0|1,0,0]=3 967 B9R1.2 O=CC1=CC=CC(I)=C1 K45152 [1,1,0,0,0,0|0,0,0]=2 968 B9R1.2 O=CC1=CC=NC(Cl)=N1 C14545 [1,1,0,0,0,0|2,0,0]=4 969 B9R1.2 O=CC1=CN=CC(Cl)=N1 C14597 [1,1,0,0,0,0|2,0,0]=4 970 B9R1.2 O=CC1=CN=CC(O)=C1 H37579 [1,1,0,0,0,0|1,0,0]=3 971 B9R1.2 O=CC1=NC=CC(Br)=C1 B15000 [1,1,0,0,0,0|1,0,0]=3 972 B9R1.2 O=CC1=NC=CC(Cl)=C1 C10313 [1,1,0,0,0,0|1,0,0]=3 973 B9R1.2 O=CC1=NC=CC(F)=C1 F16335 [1,1,0,0,0,0|1,0,0]=3 974 B9R1.2 OC1=CC=CC(CBr)=C1 B38962 [1,1,0,0,0,0|1,0,1]=4 975 B9R1.2 OCC1=CC(Br)=CN=C1 B12503 [1,1,0,0,0,0|1,0,1]=4 976 B9R1.2 OCC1=CC(Br)=NC=C1 B42880 [1,1,0,0,0,0|1,0,1]=4 977 B9R1.2 OCC1=CC(Cl)=CN=C1 C42912 [1,1,0,0,0,0|1,0,1]=4 978 B9R1.2 OCC1=CC(Cl)=NC=C1 C12733 [1,1,0,0,0,0|1,0,1]=4 979 B9R1.2 OCC1=CC(F)=CN=C1 F0704 [1,1,0,0,0,0|1,0,1]=4 980 B9R1.2 OCC1=CC(O)=CN=C1 H39124 [1,1,0,0,0,0|1,0,1]=4 981 B9R1.2 OCC1=CC=CC(Br)=N1 B12271 [1,1,0,0,0,0|1,0,1]=4 982 B9R1.2 OCC1=CC=CC(Cl)=C1 C39405 [1,1,0,0,0,0|0,0,1]=3 983 B9R1.2 OCC1=CC=CC(Cl)=N1 C38619 [1,1,0,0,0,0|1,0,1]=4 984 B9R1.2 OCC1=CC=CC(Cl)=N1 C42916 [1,1,0,0,0,0|1,0,1]=4 985 B9R1.2 OCC1=CC=CC(F)=C1 F39408 [1,1,0,0,0,0|0,0,1]=3 986 B9R1.2 OCC1=CC=CC(F)=N1 F67771 [1,1,0,0,0,0|1,0,1]=4 987 B9R1.2 OCC1=CC=CC(I)=C1 H61971 [1,1,0,0,0,0|0,0,1]=3 988 B9R1.2 OCC1=NC=CC(Br)=C1 B0602 [1,1,0,0,0,0|1,0,1]=4 989 B9R1.2 OCC1=NC=CC(Cl)=C1 C12436 [1,1,0,0,0,0|1,0,1]=4 990 B9R1.2 OCC1=NC=CC(F)=C1 F37340 [1,1,0,0,0,0|1,0,1]=4 991 B9R1.8 CC#CC1=CC=CC=C1 P68608 [1,1,0,0,0,0|1,0,1]=4 992 B9R1.8 CNNC1=CC=CC=C1 M46459 [1,1,0,0,0,0|2,0,0]=4 993 B9R1.8 COCC1=NC=CC=C1 M46377 [1,1,0,0,0,0|1,0,1]=4 994 B9R1.8 C\C=C\C1=CC=CC=C1 P62367 [1,1,0,0,0,0|1,0,0]=3 995 B9R1.8 IC#CC1=CC=CC=C1 I1886 [1,1,0,0,0,0|1,0,1]=4 996 B9R1.8 N#COC1=CC=CC=C1 P44923 [1,1,0,0,0,0|1,0,1]=4 997 B9R1.8 NNCC1=CC=CC=C1 B6123 [1,1,0,0,0,0|1,0,1]=4 998 B9R1.8 NNCC1=CC=CC=C1 B68081 [1,1,0,0,0,0|1,0,1]=4 999 B9R1.8 NOCC1=CC=CC=C1 B68114 [1,1,0,0,0,0|0,0,1]=3 1000 B9R1.8 O=C=NC1=NC=CC=C1 C64750 [1,1,0,0,0,0|1,0,1]=4 1001 B9R1.8 O=COC1=CC=CC=C1 P45508 [1,1,0,0,0,0|0,0,0]=2 1002 B9R1.8 OCCC1=CC=NC=C1 H46381 [1,1,0,0,0,0|1,0,1]=4 1003 B9R1.8 OCCC1=CN=CC=C1 P46376 [1,1,0,0,0,0|1,0,1]=4 1004 B9R1.8 ON=CC1=NC=NC=C1 P40960 [1,1,0,0,0,0|2,0,0]=4 1005 B9R1.8 ONCC1=CC=CC=C1 B36744 [1,1,0,0,0,0|0,0,1]=3 1006 B9R1.8 ONCC1=CC=CC=C1 B46575 [1,1,0,0,0,0|0,0,1]=3 1007 B9R1.8 O\N=C\C1=CC=CC=C1 B61148 [1,1,0,0,0,0|0,0,0]=2 1008 B9R1.8 S=C=NC1=CC=CC=C1 T64712 [1,1,0,0,0,0|0,1,1]=4 1009 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 B66761 [1,1,0,0,0,0|1,0,1]=4 1010 B9R1.8 [Mg+]CCC1=CC=CC=C1 P31723 [1,1,0,0,0,0|1,0,1]=4 1011 B9R1.15 BrCC1=C(I)C=CC=C1 B37896 [1,1,0,0,0,0|1,0,1]=4 1012 B9R1.15 C#CC1=C(Br)C=CC=C1 B38613 [1,1,0,0,0,0|1,0,1]=4 1013 B9R1.15 C#CC1=C(Cl)C=CC=C1 C38576 [1,1,0,0,0,0|1,0,1]=4 1014 B9R1.15 C#CC1=C(F)C=CC=C1 E47539 [1,1,0,0,0,0|1,0,1]=4 1015 B9R1.15 C#CC1=C(N)C=CC=C1 E24087 [1,1,0,0,0,0|1,0,1]=4 1016 B9R1.15 C#CC1=C(O)C=CC=C1 E48112 [1,1,0,0,0,0|1,0,1]=4 1017 B9R1.15 C=CC1=C(Br)C=CC=C1 B48296 [1,1,0,0,0,0|1,0,0]=3 1018 B9R1.15 C=CC1=C(Cl)C=CC=C1 C48303 [1,1,0,0,0,0|1,0,0]=3 1019 B9R1.15 C=CC1=C(N)C=CC=C1 V36733 [1,1,0,0,0,0|1,0,0]=3 1020 B9R1.15 CC1=C(C=O)C=CC=N1 M1759 [1,1,0,0,0,0|1,0,0]=3 1021 B9R1.15 CC1=C(C=O)C=NC=C1 M1852 [1,1,0,0,0,0|1,0,0]=3 1022 B9R1.15 CC1=C(CN)C=CC=C1 M65907 [1,1,0,0,0,0|1,0,1]=4 1023 B9R1.15 CC1=C(CO)C=CN=C1 H1761 [1,1,0,0,0,0|1,0,1]=4 1024 B9R1.15 CC1=C(CO)C=NC=C1 H11512 [1,1,0,0,0,0|1,0,1]=4 1025 B9R1.15 CC1=C(NN)C=CC=C1 T39424 [1,1,0,0,0,0|2,0,0]=4 1026 B9R1.15 CC1=CC=CN=C1C=O M1872 [1,1,0,0,0,0|1,0,0]=3 1027 B9R1.15 CC1=CC=CN=C1CO H46388 [1,1,0,0,0,0|1,0,1]=4 1028 B9R1.15 CC1=NC=CN=C1C=O M14617 [1,1,0,0,0,0|2,0,0]=4 1029 B9R1.15 CCC1=C(Br)C=CC=C1 B68946 [1,1,0,0,0,0|1,0,1]=4 1030 B9R1.15 CCC1=C(C)C=CC=C1 E50165 [1,1,0,0,0,0|1,0,1]=4 1031 B9R1.15 CCC1=C([Mg+])C=CC=C1 E31738 [1,1,0,0,0,0|1,0,1]=4 1032 B9R1.15 CNC1=C(Br)C=CC=C1 B46075 [1,1,0,0,0,0|2,0,0]=4 1033 B9R1.15 CNC1=C(C)C=CC=C1 D46860 [1,1,0,0,0,0|2,0,0]=4 1034 B9R1.15 CNC1=C(Cl)C=CC=C1 C46094 [1,1,0,0,0,0|2,0,0]=4 1035 B9R1.15 CNC1=C(F)C=CC=C1 M39414 [1,1,0,0,0,0|2,0,0]=4 1036 B9R1.15 CNC1=C(N)C=CC=C1 M43618 [1,1,0,0,0,0|2,0,0]=4 1037 B9R1.15 CNC1=C(N)C=CC=C1 M68814 [1,1,0,0,0,0|2,0,0]=4 1038 B9R1.15 CNC1=C(O)C=CC=C1 M64657 [1,1,0,0,0,0|2,0,0]=4 1039 B9R1.15 COC1=C(Br)C=CC=C1 B67901 [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|2,0,0]=4 1041 B9R1.15 COC1=C([Mg+])C=CC=C1 M31742 [1,1,0,0,0,0|2,0,0]=4 1042 B9R1.15 CSC1=C([Mg+])C=CC=C1 M31770 [1,1,0,0,0,0|2,0,0]=4 1043 B9R1.15 FC1=C(C[Mg+])C=CC=C1 F6778 [1,1,0,0,0,0|1,0,1]=4 1044 B9R1.15 N#CC1=C(Br)C=CC=C1 B67862 [1,1,0,0,0,0|1,0,1]=4 1045 B9R1.15 N#CC1=C(F)C=CC=C1 F68598 [1,1,0,0,0,0|1,0,1]=4 1046 B9R1.15 N#CC1=C(I)C=CC=C1 K44441 [1,1,0,0,0,0|1,0,1]=4 1047 B9R1.15 N#CC1=C(N)C=CC=C1 A68606 [1,1,0,0,0,0|1,0,1]=4 1048 B9R1.15 N#CC1=C(O)C=CC=C1 H68602 [1,1,0,0,0,0|1,0,1]=4 1049 B9R1.15 NC1=C(C=O)C=CC=C1 A32220 [1,1,0,0,0,0|0,0,0]=2 1050 B9R1.15 NC1=C(C=O)C=CC=N1 A25218 [1,1,0,0,0,0|1,0,0]=3 1051 B9R1.15 NC1=C(C=O)C=CN=C1 A12878 [1,1,0,0,0,0|1,0,0]=3 1052 B9R1.15 NC1=C(C=O)C=NC=C1 A9624 [1,1,0,0,0,0|1,0,0]=3 1053 B9R1.15 NC1=C(CO)C=CC=C1 A7795 [1,1,0,0,0,0|0,0,1]=3 1054 B9R1.15 NC1=C(CO)C=CC=N1 A12467 [1,1,0,0,0,0|1,0,1]=4 1055 B9R1.15 NC1=CC=CN=C1CO A24069 [1,1,0,0,0,0|1,0,1]=4 1056 B9R1.15 NC1=NC=CN=C1C=O A0269 [1,1,0,0,0,0|2,0,0]=4 1057 B9R1.15 NCC1=C(Br)C=CC=C1 B36643 [1,1,0,0,0,0|1,0,1]=4 1058 B9R1.15 NCC1=C(Cl)C=CC=C1 C46097 [1,1,0,0,0,0|1,0,1]=4 1059 B9R1.15 NCC1=C(Cl)C=CC=C1 C46104 [1,1,0,0,0,0|1,0,1]=4 1060 B9R1.15 NCC1=C(F)C=CC=C1 F26320 [1,1,0,0,0,0|1,0,1]=4 1061 B9R1.15 NCC1=C(I)C=CC=C1 I36799 [1,1,0,0,0,0|1,0,1]=4 1062 B9R1.15 NCC1=C(O)C=CC=C1 A38718 [1,1,0,0,0,0|1,0,1]=4 1063 B9R1.15 NCC1=C(O)C=CC=C1 A46574 [1,1,0,0,0,0|1,0,1]=4 1064 B9R1.15 NNC1=C(Br)C=CC=C1 B39273 [1,1,0,0,0,0|2,0,0]=4 1065 B9R1.15 NNC1=C(Cl)C=CC=C1 C39274 [1,1,0,0,0,0|2,0,0]=4 1066 B9R1.15 NNC1=C(F)C=CC=C1 F39286 [1,1,0,0,0,0|2,0,0]=4 1067 B9R1.15 NNC1=C(I)C=CC=C1 K43028 [1,1,0,0,0,0|2,0,0]=4 1068 B9R1.15 O=CC1=C(Br)C=CC=C1 B38420 [1,1,0,0,0,0|0,0,0]=2 1069 B9R1.15 O=CC1=C(Br)C=CC=N1 B23547 [1,1,0,0,0,0|1,0,0]=3 1070 B9R1.15 O=CC1=C(Br)C=NC=C1 B5403 [1,1,0,0,0,0|1,0,0]=3 1071 B9R1.15 O=CC1=C(Cl)C=CC=C1 C67575 [1,1,0,0,0,0|0,0,0]=2 1072 B9R1.15 O=CC1=C(Cl)C=CC=N1 C42298 [1,1,0,0,0,0|1,0,0]=3 1073 B9R1.15 O=CC1=C(Cl)C=CN=C1 C4985 [1,1,0,0,0,0|1,0,0]=3 1074 B9R1.15 O=CC1=C(Cl)C=NC=C1 C42297 [1,1,0,0,0,0|1,0,0]=3 1075 B9R1.15 O=CC1=C(F)C=CC=C1 F68099 [1,1,0,0,0,0|0,0,0]=2 1076 B9R1.15 O=CC1=C(F)C=CC=N1 F12613 [1,1,0,0,0,0|1,0,0]=3 1077 B9R1.15 O=CC1=C(F)C=NC=C1 F12612 [1,1,0,0,0,0|1,0,0]=3 1078 B9R1.15 O=CC1=C(I)C=CC=C1 I0665 [1,1,0,0,0,0|0,0,0]=2 1079 B9R1.15 O=CC1=C(O)C=NC=C1 H67691 [1,1,0,0,0,0|1,0,0]=3 1080 B9R1.15 O=CC1=CC=CN=C1Br B67403 [1,1,0,0,0,0|1,0,0]=3 1081 B9R1.15 O=CC1=CC=CN=C1Cl C3459 [1,1,0,0,0,0|1,0,0]=3 1082 B9R1.15 O=CC1=CC=CN=C1F F2386 [1,1,0,0,0,0|1,0,0]=3 1083 B9R1.15 O=CC1=CC=CNC1=O X42600 [1,1,0,0,0,0|1,0,0]=3 1084 B9R1.15 O=CC1=NC=CC=C1O H14795 [1,1,0,0,0,0|1,0,0]=3 1085 B9R1.15 O=CC1=NC=CN=C1Cl C12693 [1,1,0,0,0,0|2,0,0]=4 1086 B9R1.15 OCC1=C(Br)C=CC=C1 B39402 [1,1,0,0,0,0|0,0,1]=3 1087 B9R1.15 OCC1=C(Br)C=CC=N1 B42889 [1,1,0,0,0,0|1,0,1]=4 1088 B9R1.15 OCC1=C(Br)C=NC=C1 B9966 [1,1,0,0,0,0|1,0,1]=4 1089 B9R1.15 OCC1=C(Cl)C=CC=C1 C68885 [1,1,0,0,0,0|0,0,1]=3 1090 B9R1.15 OCC1=C(Cl)C=CC=N1 C42910 [1,1,0,0,0,0|1,0,1]=4 1091 B9R1.15 OCC1=C(Cl)C=CN=C1 C42911 [1,1,0,0,0,0|1,0,1]=4 1092 B9R1.15 OCC1=C(Cl)C=CN=C1 C42915 [1,1,0,0,0,0|1,0,1]=4 1093 B9R1.15 OCC1=C(F)C=CC=C1 F39407 [1,1,0,0,0,0|0,0,1]=3 1094 B9R1.15 OCC1=C(F)C=CC=N1 F1706 [1,1,0,0,0,0|1,0,1]=4 1095 B9R1.15 OCC1=C(F)C=CN=C1 F30083 [1,1,0,0,0,0|1,0,1]=4 1096 B9R1.15 OCC1=C(F)C=NC=C1 F10404 [1,1,0,0,0,0|1,0,1]=4 1097 B9R1.15 OCC1=C(I)C=CC=C1 K45967 [1,1,0,0,0,0|0,0,1]=3 1098 B9R1.15 OCC1=C(O)C=CC=N1 H60848 [1,1,0,0,0,0|1,0,1]=4 1099 B9R1.15 OCC1=CC=CN=C1Br B69414 [1,1,0,0,0,0|1,0,1]=4 1100 B9R1.15 OCC1=CC=CN=C1Cl C0580 [1,1,0,0,0,0|1,0,1]=4 1101 B9R1.15 OCC1=CC=CN=C1F F42930 [1,1,0,0,0,0|1,0,1]=4 1102 B9R1.11 COC(=O)C1=CC=CN1 M11015 [0,1,0,0,1,0|1,0,0]=3 1103 B9R1.11 COC(=O)C1=CC=CO1 M39270 [0,1,0,0,1,0|1,0,0]=3 1104 B9R1.11 COC(=O)C1=CC=CS1 M42941 [0,1,0,0,1,0|1,0,0]=3 1105 B9R1.11 COC(=O)C1=CC=NN1 M12748 [0,1,0,0,1,0|2,0,0]=4 1106 B9R1.11 COC(=O)C1=CN=CN1 M14078 [0,1,0,0,1,0|2,0,0]=4 1107 B9R1.11 COC(=O)C1=CN=CN1 M41348 [0,1,0,0,1,0|2,0,0]=4 1108 B9R1.11 COC(=O)C1=CN=CO1 M40997 [0,1,0,0,1,0|2,0,0]=4 1109 B9R1.11 COC(=O)C1=CN=CS1 M2158 [0,1,0,0,1,0|2,0,0]=4 1110 B9R1.11 COC(=O)C1=CNC=C1 M37783 [0,1,0,0,1,0|1,0,0]=3 1111 B9R1.11 COC(=O)C1=CNN=C1 P8955 [0,1,0,0,1,0|2,0,0]=4 1112 B9R1.11 COC(=O)C1=CSC=C1 M12826 [0,1,0,0,1,0|1,0,0]=3 1113 B9R1.11 COC(=O)C1=CSC=N1 M2932 [0,1,0,0,1,0|2,0,0]=4 1114 B9R1.11 COC(=O)C1=NC=CN1 M11275 [0,1,0,0,1,0|2,0,0]=4 1115 B9R1.11 COC(=O)C1=NC=CO1 M40998 [0,1,0,0,1,0|2,0,0]=4 1116 B9R1.11 COC(=O)C1=NC=CS1 M40994 [0,1,0,0,1,0|2,0,0]=4 1117 B9R1.11 NNC(=O)C1=CC=CO1 F66138 [0,1,0,0,1,0|2,0,0]=4 1118 B9R1.11 O=C(CBr)C1=CC=CS1 B42721 [0,1,0,0,1,0|2,0,0]=4 1119 B9R1.19 O=S(=O)(O)C1=CC=CS1 T40111 [0,1,0,0,1,0|2,0,0]=4 1120 B9R1.35 CC(=O)C1=CC(Br)=CS1 B13699 [0,1,0,0,1,0|2,0,0]=4 1121 B9R1.35 CC(=O)C1=CC(Cl)=CS1 A12844 [0,1,0,0,1,0|2,0,0]=4 1122 B9R1.35 CC(=O)C1=CC=C(Br)S1 A12839 [0,1,0,0,1,0|2,0,0]=4 1123 B9R1.35 CC(=O)C1=CC=C(C)S1 A46277 [0,1,0,0,1,0|2,0,0]=4 1124 B9R1.35 CC(=O)C1=CNC(C)=C1 M46389 [0,1,0,0,1,0|2,0,0]=4 1125 B9R1.35 CC(=O)C1=CSC(Cl)=C1 A1568 [0,1,0,0,1,0|2,0,0]=4 1126 B9R1.35 CC1=CC(C(=O)O)=CN1 M43147 [0,1,0,0,1,0|1,0,0]=3 1127 B9R1.35 CC1=CC(C(=O)O)=CS1 M5852 [0,1,0,0,1,0|1,0,0]=3 1128 B9R1.35 CC1=CC(C(=O)O)=NN1 M7890 [0,1,0,0,1,0|2,0,0]=4 1129 B9R1.35 CC1=CC(C(=O)O)=NO1 M27266 [0,1,0,0,1,0|2,0,0]=4 1130 B9R1.35 CC1=CC=C(C(=O)O)N1 M36732 [0,1,0,0,1,0|1,0,0]=3 1131 B9R1.35 CC1=CC=C(C(=O)O)O1 M38051 [0,1,0,0,1,0|1,0,0]=3 1132 B9R1.35 CC1=CC=C(C(=O)O)S1 M42943 [0,1,0,0,1,0|1,0,0]=3 1133 B9R1.35 CC1=CN=C(C(=O)O)S1 M40996 [0,1,0,0,1,0|2,0,0]=4 1134 B9R1.35 CC1=CSC(C(=O)O)=N1 M14993 [0,1,0,0,1,0|2,0,0]=4 1135 B9R1.35 CC1=NC(C(=O)O)=CN1 M19958 [0,1,0,0,1,0|2,0,0]=4 1136 B9R1.35 CC1=NC(C(=O)O)=CO1 M62066 [0,1,0,0,1,0|2,0,0]=4 1137 B9R1.35 CC1=NC(C(=O)O)=CO1 M7132 [0,1,0,0,1,0|2,0,0]=4 1138 B9R1.35 CC1=NC(C(=O)O)=CS1 M3047 [0,1,0,0,1,0|2,0,0]=4 1139 B9R1.35 CC1=NC=C(C(=O)O)O1 M9856 [0,1,0,0,1,0|2,0,0]=4 1140 B9R1.35 CC1=NC=C(C(=O)O)S1 M5426 [0,1,0,0,1,0|2,0,0]=4 1141 B9R1.35 CC1=NOC(C(=O)O)=C1 M38698 [0,1,0,0,1,0|2,0,0]=4 1142 B9R1.35 CN1C=C(C(=O)O)C=N1 M7676 [0,1,0,0,1,0|2,0,0]=4 1143 B9R1.35 CN1C=CC(C(=O)O)=C1 M43143 [0,1,0,0,1,0|1,0,0]=3 1144 B9R1.35 CN1C=CC(C(=O)O)=N1 M9460 [0,1,0,0,1,0|2,0,0]=4 1145 B9R1.35 CN1C=NC(C(=O)O)=C1 M10536 [0,1,0,0,1,0|2,0,0]=4 1146 B9R1.35 NC(=O)C1=CC(Br)=CN1 B40920 [0,1,0,0,1,0|2,0,0]=4 1147 B9R1.35 NC(=O)C1=CC(Br)=CO1 B40829 [0,1,0,0,1,0|2,0,0]=4 1148 B9R1.35 NC(=O)C1=CC(Br)=CS1 B40841 [0,1,0,0,1,0|2,0,0]=4 1149 B9R1.35 NC(=O)C1=CC=C(Br)N1 B8083 [0,1,0,0,1,0|2,0,0]=4 1150 B9R1.35 NC(=O)C1=CC=C(Br)S1 B68782 [0,1,0,0,1,0|2,0,0]=4 1151 B9R1.35 NC(=O)C1=CSC(Br)=C1 B40843 [0,1,0,0,1,0|2,0,0]=4 1152 B9R1.35 NC1=CC(C(=O)O)=NN1 A13351 [0,1,0,0,1,0|2,0,0]=4 1153 B9R1.35 NC1=CN=C(C(=O)O)S1 A14284 [0,1,0,0,1,0|2,0,0]=4 1154 B9R1.35 NC1=CN=C(C(=O)O)S1 A7363 [0,1,0,0,1,0|2,0,0]=4 1155 B9R1.35 NC1=CNC(C(=O)O)=N1 A20425 [0,1,0,0,1,0|2,0,0]=4 1156 B9R1.35 NC1=NC(C(=O)O)=CO1 A11266 [0,1,0,0,1,0|2,0,0]=4 1157 B9R1.35 NC1=NC(C(=O)O)=CS1 A2115 [0,1,0,0,1,0|2,0,0]=4 1158 B9R1.35 NC1=NC(C(=O)O)=CS1 A4882 [0,1,0,0,1,0|2,0,0]=4 1159 B9R1.35 NC1=NC=C(C(=O)O)S1 A3492 [0,1,0,0,1,0|2,0,0]=4 1160 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 C40558 [0,1,0,0,1,0|2,0,0]=4 1161 B9R1.35 O=C(O)C1=CC(Br)=CN1 B40831 [0,1,0,0,1,0|1,0,0]=3 1162 B9R1.35 O=C(O)C1=CC(Br)=CO1 B13536 [0,1,0,0,1,0|1,0,0]=3 1163 B9R1.35 O=C(O)C1=CC(Br)=CS1 B3026 [0,1,0,0,1,0|1,0,0]=3 1164 B9R1.35 O=C(O)C1=CC(Br)=NO1 I24762 [0,1,0,0,1,0|2,0,0]=4 1165 B9R1.35 O=C(O)C1=CC(Cl)=CS1 C12488 [0,1,0,0,1,0|1,0,0]=3 1166 B9R1.35 O=C(O)C1=CC(O)=NO1 H37322 [0,1,0,0,1,0|2,0,0]=4 1167 B9R1.35 O=C(O)C1=CC=C(Br)O1 B4712 [0,1,0,0,1,0|1,0,0]=3 1168 B9R1.35 O=C(O)C1=CC=C(Br)S1 B12755 [0,1,0,0,1,0|1,0,0]=3 1169 B9R1.35 O=C(O)C1=CC=C(Cl)O1 C40690 [0,1,0,0,1,0|1,0,0]=3 1170 B9R1.35 O=C(O)C1=CC=C(Cl)S1 C10492 [0,1,0,0,1,0|1,0,0]=3 1171 B9R1.35 O=C(O)C1=CC=C(F)S1 F7718 [0,1,0,0,1,0|1,0,0]=3 1172 B9R1.35 O=C(O)C1=CC=C(I)S1 K40688 [0,1,0,0,1,0|1,0,0]=3 1173 B9R1.35 O=C(O)C1=CN=C(Br)O1 B32073 [0,1,0,0,1,0|2,0,0]=4 1174 B9R1.35 O=C(O)C1=CN=C(Br)S1 B2125 [0,1,0,0,1,0|2,0,0]=4 1175 B9R1.35 O=C(O)C1=CN=C(Cl)S1 C2765 [0,1,0,0,1,0|2,0,0]=4 1176 B9R1.35 O=C(O)C1=COC(Br)=C1 B69658 [0,1,0,0,1,0|1,0,0]=3 1177 B9R1.35 O=C(O)C1=COC(Br)=N1 B15227 [0,1,0,0,1,0|2,0,0]=4 1178 B9R1.35 O=C(O)C1=COC(Cl)=N1 C15228 [0,1,0,0,1,0|2,0,0]=4 1179 B9R1.35 O=C(O)C1=CSC(Br)=C1 B12752 [0,1,0,0,1,0|1,0,0]=3 1180 B9R1.35 O=C(O)C1=CSC(Br)=N1 B2124 [0,1,0,0,1,0|2,0,0]=4 1181 B9R1.35 O=C(O)C1=CSC(Cl)=C1 C7720 [0,1,0,0,1,0|1,0,0]=3 1182 B9R1.35 O=C(O)C1=CSC(Cl)=N1 C2862 [0,1,0,0,1,0|2,0,0]=4 1183 B9R1.35 O=C(O)C1=CSC(F)=C1 F15451 [0,1,0,0,1,0|1,0,0]=3 1184 B9R1.35 O=C(O)C1=NC(Br)=CS1 B7895 [0,1,0,0,1,0|2,0,0]=4 1185 B9R1.35 O=C(O)C1=NC=C(Br)S1 B10955 [0,1,0,0,1,0|2,0,0]=4 1186 B9R1.35 O=C(O)C1=NC=C(Cl)S1 C13056 [0,1,0,0,1,0|2,0,0]=4 1187 B9R1.35 O=C(O)C1=NNC(Br)=C1 B18673 [0,1,0,0,1,0|2,0,0]=4 1188 B9R1.35 O=C(O)C1=NNC(Cl)=C1 C26046 [0,1,0,0,1,0|2,0,0]=4 1189 B9R1.35 O=C(O)C1=NNC(O)=C1 H40078 [0,1,0,0,1,0|2,0,0]=4 1190 B9R1.35 O=C1NC=C(C(=O)O)N1 X40079 [0,1,0,0,1,0|2,0,0]=4 1191 B9R1.41 CC(=O)C1=CNC=C1C M67633 [0,1,0,0,1,0|2,0,0]=4 1192 B9R1.41 CC1=C(C(=O)O)C=CN1 M39104 [0,1,0,0,1,0|1,0,0]=3 1193 B9R1.41 CC1=C(C(=O)O)C=CO1 M63194 [0,1,0,0,1,0|1,0,0]=3 1194 B9R1.41 CC1=C(C(=O)O)C=CS1 M36640 [0,1,0,0,1,0|1,0,0]=3 1195 B9R1.41 CC1=C(C(=O)O)C=NO1 M2622 [0,1,0,0,1,0|2,0,0]=4 1196 B9R1.41 CC1=C(C(=O)O)N=CO1 M3158 [0,1,0,0,1,0|2,0,0]=4 1197 B9R1.41 CC1=C(C(=O)O)N=CS1 M3491 [0,1,0,0,1,0|2,0,0]=4 1198 B9R1.41 CC1=C(C(=O)O)NC=C1 M43146 [0,1,0,0,1,0|1,0,0]=3 1199 B9R1.41 CC1=C(C(=O)O)OC=C1 M42945 [0,1,0,0,1,0|1,0,0]=3 1200 B9R1.41 CC1=C(C(=O)O)OC=N1 M38000 [0,1,0,0,1,0|2,0,0]=4 1201 B9R1.41 CC1=C(C(=O)O)ON=C1 M40999 [0,1,0,0,1,0|2,0,0]=4 1202 B9R1.41 CC1=C(C(=O)O)SC=C1 M42942 [0,1,0,0,1,0|1,0,0]=3 1203 B9R1.41 CC1=C(C(=O)O)SC=N1 M67956 [0,1,0,0,1,0|2,0,0]=4 1204 B9R1.41 CC1=CNN=C1C(=O)O M41036 [0,1,0,0,1,0|2,0,0]=4 1205 B9R1.41 CC1=CSC=C1C(=O)O M25374 [0,1,0,0,1,0|1,0,0]=3 1206 B9R1.41 CC1=NNC=C1C(=O)O M9647 [0,1,0,0,1,0|2,0,0]=4 1207 B9R1.41 CC1=NOC=C1C(=O)O M21771 [0,1,0,0,1,0|2,0,0]=4 1208 B9R1.41 CN1C=CC=C1C(=O)O M68591 [0,1,0,0,1,0|1,0,0]=3 1209 B9R1.41 CN1C=CN=C1C(=O)O M12222 [0,1,0,0,1,0|2,0,0]=4 1210 B9R1.41 CN1C=NC=C1C(=O)O M2857 [0,1,0,0,1,0|2,0,0]=4 1211 B9R1.41 CN1N=CC=C1C(=O)O M3734 [0,1,0,0,1,0|2,0,0]=4 1212 B9R1.41 NC(=O)C1=C(N)SC=C1 A41049 [0,1,0,0,1,0|2,0,0]=4 1213 B9R1.41 NC(=O)C1=CC=CN1N A5122 [0,1,0,0,1,0|2,0,0]=4 1214 B9R1.41 NC(=O)C1=CSC=C1Br B40842 [0,1,0,0,1,0|2,0,0]=4 1215 B9R1.41 NC1=CNN=C1C(=O)O A40139 [0,1,0,0,1,0|2,0,0]=4 1216 B9R1.41 O=C(O)C1=C(Br)C=CO1 B40689 [0,1,0,0,1,0|1,0,0]=3 1217 B9R1.41 O=C(O)C1=C(Br)C=CS1 B10327 [0,1,0,0,1,0|1,0,0]=3 1218 B9R1.41 O=C(O)C1=C(Br)C=NN1 B40030 [0,1,0,0,1,0|2,0,0]=4 1219 B9R1.41 O=C(O)C1=C(Br)OC=N1 B37246 [0,1,0,0,1,0|2,0,0]=4 1220 B9R1.41 O=C(O)C1=C(Br)SC=C1 B37969 [0,1,0,0,1,0|1,0,0]=3 1221 B9R1.41 O=C(O)C1=C(Br)SC=N1 B3211 [0,1,0,0,1,0|2,0,0]=4 1222 B9R1.41 O=C(O)C1=C(Cl)C=CS1 C12482 [0,1,0,0,1,0|1,0,0]=3 1223 B9R1.41 O=C(O)C1=C(Cl)C=NN1 C38651 [0,1,0,0,1,0|2,0,0]=4 1224 B9R1.41 O=C(O)C1=C(Cl)C=NS1 C40015 [0,1,0,0,1,0|2,0,0]=4 1225 B9R1.41 O=C(O)C1=C(Cl)NN=C1 C40033 [0,1,0,0,1,0|2,0,0]=4 1226 B9R1.41 O=C(O)C1=C(Cl)SC=C1 C40686 [0,1,0,0,1,0|1,0,0]=3 1227 B9R1.41 O=C(O)C1=C(F)C=CS1 F40687 [0,1,0,0,1,0|1,0,0]=3 1228 B9R1.41 O=C(O)C1=C(I)C=NN1 K40036 [0,1,0,0,1,0|2,0,0]=4 1229 B9R1.41 O=C(O)C1=C(O)C=CS1 H40863 [0,1,0,0,1,0|1,0,0]=3 1230 B9R1.41 O=C(O)C1=CSC=C1Br B11526 [0,1,0,0,1,0|1,0,0]=3 1231 B9R1.41 O=C(O)C1=NNC=C1Br B3819 [0,1,0,0,1,0|2,0,0]=4 1232 B11R1.20 CC(=O)CC1=CC=C(Br)C=C1 B52021 [0,1,0,0,0,1|1,0,0]=3 1233 B11R1.20 CC(=O)CC1=CC=C(Cl)C=C1 C52036 [0,1,0,0,0,1|1,0,0]=3 1234 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 F52043 [0,1,0,0,0,1|1,0,0]=3 1235 B11R1.20 CC(=O)NC1=CN=C(O)C=C1 H46009 [0,1,0,0,0,1|2,0,0]=4 1236 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 B45690 [0,1,0,0,0,1|2,0,0]=4 1237 B11R1.20 CC(=O)NC1=NC=C(O)C=C1 H46008 [0,1,0,0,0,1|2,0,0]=4 1238 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 A66708 [0,1,0,0,0,1|1,0,0]=3 1239 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 A64153 [0,1,0,0,0,1|1,0,0]=3 1240 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T37815 [0,1,0,0,0,1|0,0,0]=2 1241 B11R1.20 CC1=CC=C(NC(N)=S)C=C1 T46710 [0,1,0,0,0,1|1,1,0]=4 1242 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 M49647 [0,1,0,0,0,1|1,0,0]=3 1243 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 M61975 [0,1,0,0,0,1|1,0,0]=3 1244 B11R1.20 C[C@H](O)CC1=CC=C(F)C=C1 F36778 [0,1,0,0,0,1|1,0,1]=4 1245 B11R1.20 NC(=O)CC1=CC=C(Cl)C=C1 C49035 [0,1,0,0,0,1|1,0,0]=3 1246 B11R1.20 NC(=O)CC1=CN=C(Cl)C=C1 C45699 [0,1,0,0,0,1|2,0,0]=4 1247 B11R1.20 NC(=O)CC1=NC=C(Br)C=C1 B45688 [0,1,0,0,0,1|2,0,0]=4 1248 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 C37226 [0,1,0,0,0,1|1,0,0]=3 1249 B11R1.20 NC(=S)NC1=CC=C(F)C=C1 F1233 [0,1,0,0,0,1|1,1,0]=4 1250 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 A69139 [0,1,0,0,0,1|0,0,0]=2 1251 B11R1.20 O=C(Cl)OC1=CC=C(F)C=C1 F44593 [0,1,0,0,0,1|1,0,0]=3 1252 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B7856 [0,1,0,0,0,1|0,0,0]=2 1253 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 C68318 [0,1,0,0,0,1|0,0,0]=2 1254 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 F67433 [0,1,0,0,0,1|0,0,0]=2 1255 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 C28734 [0,1,0,0,0,1|1,0,0]=3 1256 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 B12779 [0,1,0,0,0,1|1,0,0]=3 1257 B11R1.20 O=C(O)CC1=NC=C(Br)C=N1 B8150 [0,1,0,0,0,1|2,0,0]=4 1258 B11R1.20 O=C(O)CC1=NC=C(Cl)C=C1 C15880 [0,1,0,0,0,1|1,0,0]=3 1259 B11R1.20 O=C(O)CC1=NC=C(Cl)C=N1 C26767 [0,1,0,0,0,1|2,0,0]=4 1260 B11R1.20 O=C(O)CC1=NC=C(F)C=C1 F15876 [0,1,0,0,0,1|1,0,0]=3 1261 B11R1.20 O=C(O)CC1=NC=C(I)C=C1 I27088 [0,1,0,0,0,1|1,0,0]=3 1262 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 A51548 [0,1,0,0,0,1|0,0,0]=2 1263 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 P69231 [0,1,0,0,0,1|1,0,0]=3 1264 B11R1.36 C[C@@H](C(=O)O)C1=CC=CC=C1 P49885 [0,1,0,0,0,1|0,0,0]=2 1265 B11R1.36 C[C@@H](O)[C@@H](N)C1=CC=CC=C1 A52178 [0,1,0,0,0,1|1,0,1]=4 1266 B11R1.36 C[C@@H](O)[C@H](N)C1=CC=CC=C1 A52176 [0,1,0,0,0,1|1,0,1]=4 1267 B11R1.36 C[C@H](C(=O)O)C1=CC=CC=C1 P36930 [0,1,0,0,0,1|0,0,0]=2 1268 B11R1.36 C[C@H](O)[C@@H](N)C1=CC=CC=C1 A52179 [0,1,0,0,0,1|1,0,1]=4 1269 B11R1.36 C[C@H](O)[C@H](N)C1=CC=CC=C1 A52177 [0,1,0,0,0,1|1,0,1]=4 1270 B11R1.36 NC(=O)[C@@H](N)C1=CC=CC=C1 A69457 [0,1,0,0,0,1|1,0,0]=3 1271 B11R1.36 NC(=O)[C@H](N)C1=CC=CC=C1 A69199 [0,1,0,0,0,1|1,0,0]=3 1272 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 A68336 [0,1,0,0,0,1|0,0,0]=2 1273 B11R1.36 N[C@@H](C(=O)O)C1=CCC=CC1 A46932 [0,1,0,0,0,1|0,0,2]=4 1274 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 A69083 [0,1,0,0,0,1|0,0,0]=2 1275 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M64934 [0,1,0,0,0,1|0,0,0]=2 1276 B11R1.36 O=C(O)[C@H](Cl)C1=CC=CC=C1 C48589 [0,1,0,0,0,1|0,0,0]=2 1277 B11R1.40 C#C[C@@H](O)CC1=CC=CC=C1 P52407 [0,1,0,0,0,1|1,0,1]=4 1278 B11R1.40 C=CC(=O)NC1=CC=CC=C1 P38034 [0,1,0,0,0,1|1,0,0]=3 1279 B11R1.40 C=CC(=O)OC1=CC=CC=C1 P32241 [0,1,0,0,0,1|1,0,0]=3 1280 B11R1.40 CNC(=O)CC1=CN=CC=C1 M46657 [0,1,0,0,0,1|2,0,0]=4 1281 B11R1.40 COC(=O)CC1=CC=NC=C1 M22906 [0,1,0,0,0,1|1,0,0]=3 1282 B11R1.40 COC(=O)CC1=CN=CC=C1 M12485 [0,1,0,0,0,1|1,0,0]=3 1283 B11R1.40 COC(=O)CC1=CN=NC=C1 M10235 [0,1,0,0,0,1|2,0,0]=4 1284 B11R1.40 COC(=O)CC1=NC=CC=C1 M12486 [0,1,0,0,0,1|1,0,0]=3 1285 B11R1.40 COC(=O)CC1=NC=CC=N1 M46001 [0,1,0,0,0,1|2,0,0]=4 1286 B11R1.40 COC(=O)CC1=NC=CN=C1 M12293 [0,1,0,0,0,1|2,0,0]=4 1287 B11R1.40 COC(=O)CC1=NC=NC=C1 M12914 [0,1,0,0,0,1|2,0,0]=4 1288 B11R1.40 COC(=O)CC1=NN=CC=C1 M10253 [0,1,0,0,0,1|2,0,0]=4 1289 B11R1.40 COC(=O)OC1=CC=CC=C1 M37596 [0,1,0,0,0,1|0,0,0]=2 1290 B11R1.40 NNC(=O)CC1=CC=NC=C1 P9939 [0,1,0,0,0,1|2,0,0]=4 1291 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 P69082 [0,1,0,0,0,1|1,0,1]=4 1292 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 A38136 [0,1,0,0,0,1|1,0,1]=4 1293 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P64903 [0,1,0,0,0,1|1,0,1]=4 1294 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B49021 [0,1,0,0,0,1|1,0,0]=3 1295 B11R1.40 O=C(CBr)NC1=CC=CC=C1 B64861 [0,1,0,0,0,1|1,0,0]=3 1296 B11R1.40 O=C(CBr)OC1=CC=CC=C1 P48564 [0,1,0,0,0,1|1,0,0]=3 1297 B11R1.40 O=C(CCl)NC1=CC=CC=C1 C38641 [0,1,0,0,0,1|1,0,0]=3 1298 B11R1.40 OC[C@@H](Br)CC1=CC=CC=C1 B50151 [0,1,0,0,0,1|1,0,1]=4 1299 B11R1.40 OC[C@@H](Cl)CC1=CC=CC=C1 C50161 [0,1,0,0,0,1|1,0,1]=4 1300 B11R1.86 CC(=O)CC1=C(Br)C=CC=C1 B52020 [0,1,0,0,0,1|1,0,0]=3 1301 B11R1.86 CC(=O)CC1=C(Cl)C=CC=C1 C52039 [0,1,0,0,0,1|1,0,0]=3 1302 B11R1.86 CC(=O)CC1=C(F)C=CC=C1 F52044 [0,1,0,0,0,1|1,0,0]=3 1303 B11R1.86 CC(=O)NC1=C(I)C=NC=C1 K63586 [0,1,0,0,0,1|2,0,0]=4 1304 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 A46655 [0,1,0,0,0,1|1,0,0]=3 1305 B11R1.86 CC(=O)NC1=NC=CC=C1O H46007 [0,1,0,0,0,1|2,0,0]=4 1306 B11R1.86 CC1=C(CC(=O)O)C=CC=C1 T69090 [0,1,0,0,0,1|0,0,0]=2 1307 B11R1.86 NC(=O)CC1=C(Cl)C=CC=C1 C49033 [0,1,0,0,0,1|1,0,0]=3 1308 B11R1.86 NC(=S)NC1=C(Br)C=CC=C1 B62940 [0,1,0,0,0,1|1,1,0]=4 1309 B11R1.86 NC(=S)NC1=C(Cl)C=CC=C1 C39396 [0,1,0,0,0,1|1,1,0]=4 1310 B11R1.86 NC1=C(CC(=O)O)C=CC=N1 A46006 [0,1,0,0,0,1|1,0,0]=3 1311 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 B39490 [0,1,0,0,0,1|0,0,0]=2 1312 B11R1.86 O=C(O)CC1=C(Br)C=CC=N1 B11292 [0,1,0,0,0,1|1,0,0]=3 1313 B11R1.86 O=C(O)CC1=C(F)C=CC=C1 F39494 [0,1,0,0,0,1|0,0,0]=2 1314 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 K48630 [0,1,0,0,0,1|0,0,0]=2 1315 B11R1.86 O=C(O)CC1=CC=CN=C1Cl C10465 [0,1,0,0,0,1|1,0,0]=3 1316 B11R1.86 O=C(O)CC1=NC=CC=C1O H10790 [0,1,0,0,0,1|1,0,0]=3 1317 B11R1.86 O=C(O)CC1=NC=CN=C1Cl C14611 [0,1,0,0,0,1|2,0,0]=4 1318 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 B64129 [0,1,0,0,0,1|1,0,0]=3 1319 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 C52040 [0,1,0,0,0,1|1,0,0]=3 1320 B11R1.157 CC(=O)CC1=CC=CC(F)=C1 F52045 [0,1,0,0,0,1|1,0,0]=3 1321 B11R1.157 CC(=O)NC1=CC(Cl)=NC=C1 C3776 [0,1,0,0,0,1|2,0,0]=4 1322 B11R1.157 CC(=O)NC1=CC=CC(Br)=N1 B45691 [0,1,0,0,0,1|2,0,0]=4 1323 B11R1.157 CC(=O)NC1=CC=CC(F)=C1 F2848 [0,1,0,0,0,1|1,0,0]=3 1324 B11R1.157 CC(=O)NC1=NC(N)=CC=C1 A46342 [0,1,0,0,0,1|2,0,0]=4 1325 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 B45689 [0,1,0,0,0,1|2,0,0]=4 1326 B11R1.157 CC(=O)NC1=NC=CC(Cl)=C1 C45700 [0,1,0,0,0,1|2,0,0]=4 1327 B11R1.157 CC(=O)OC1=CC=CC(F)=C1 F48608 [0,1,0,0,0,1|1,0,0]=3 1328 B11R1.157 CC(=O)OC1=CC=CC(I)=C1 K48628 [0,1,0,0,0,1|1,0,0]=3 1329 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 T49882 [0,1,0,0,0,1|0,0,0]=2 1330 B11R1.157 CC1=CC=CC(CC(=O)[O-])=N1 S49484 [0,1,0,0,0,1|1,0,1]=4 1331 B11R1.157 N=C(N)NC1=CC=CC(Cl)=C1 C65282 [0,1,0,0,0,1|2,0,0]=4 1332 B11R1.157 NC(=O)CC1=CC(N)=CC=C1 A46654 [0,1,0,0,0,1|1,0,0]=3 1333 B11R1.157 NC(=O)CC1=CC=CC(Cl)=C1 C49034 [0,1,0,0,0,1|1,0,0]=3 1334 B11R1.157 O=C(O)CC1=CC(Br)=NC=C1 B38302 [0,1,0,0,0,1|1,0,0]=3 1335 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 C62039 [0,1,0,0,0,1|1,0,0]=3 1336 B11R1.157 O=C(O)CC1=CC(F)=CN=C1 F8162 [0,1,0,0,0,1|1,0,0]=3 1337 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 B67653 [0,1,0,0,0,1|0,0,0]=2 1338 B11R1.157 O=C(O)CC1=CC=CC(Br)=N1 B45345 [0,1,0,0,0,1|1,0,0]=3 1339 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 C68317 [0,1,0,0,0,1|0,0,0]=2 1340 B11R1.157 O=C(O)CC1=CC=CC(Cl)=N1 C38947 [0,1,0,0,0,1|1,0,0]=3 1341 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F23088 [0,1,0,0,0,1|0,0,0]=2 1342 B11R1.157 O=C(O)CC1=CC=CC(F)=N1 F15877 [0,1,0,0,0,1|1,0,0]=3 1343 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 K48631 [0,1,0,0,0,1|0,0,0]=2 1344 B11R1.157 O=C(O)CC1=NC=CC(Br)=C1 B45344 [0,1,0,0,0,1|1,0,0]=3 1345 B11R1.157 O=C(O)CC1=NC=CC(Cl)=C1 C45371 [0,1,0,0,0,1|1,0,0]=3 1346 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 P46415 [0,1,0,0,0,1|1,0,1]=4 1347 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 P38803 [0,1,0,0,0,1|1,0,1]=4 1348 B11R1.509 O=P(Cl)(Cl)OC1=CC=CC=C1 P60785 [0,1,0,0,0,1|2,0,0]=4 1349 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 E16325 [0,2,0,0,0,0|0,0,0]=2 1350 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 E62179 [0,2,0,0,0,0|1,0,0]=3 1351 B11R1.3 C#CC1=CC=C([N+](=O)[O-])C=C1 E38621 [0,2,0,0,0,0|1,0,1]=4 1352 B11R1.3 C#CC1=CN=C(C(=O)O)C=C1 E47712 [0,2,0,0,0,0|1,0,0]=3 1353 B11R1.3 C#CC1=NC=C(C(=O)O)C=C1 E60471 [0,2,0,0,0,0|1,0,0]=3 1354 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 V67904 [0,2,0,0,0,0|0,0,0]=2 1355 B11R1.3 C=CC1=CC=C([N+](=O)[O-])C=C1 N37028 [0,2,0,0,0,0|1,0,1]=4 1356 B11R1.3 CC(=O)C1=CC=C(C#N)C=C1 A51160 [0,2,0,0,0,0|1,0,0]=3 1357 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 A51552 [0,2,0,0,0,0|1,0,0]=3 1358 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 B36669 [0,2,0,0,0,0|1,0,0]=3 1359 B11R1.3 CC(=O)C1=CC=C(CN)C=C1 A52108 [0,2,0,0,0,0|1,0,0]=3 1360 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 H49897 [0,2,0,0,0,0|1,0,0]=3 1361 B11R1.3 CCC1=CC=C(B(O)O)C=C1 E3140 [0,2,0,0,0,0|1,0,1]=4 1362 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 E61033 [0,2,0,0,0,0|0,0,0]=2 1363 B11R1.3 CCC1=CN=C(C(=O)O)C=C1 E49271 [0,2,0,0,0,0|1,0,0]=3 1364 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 M60981 [0,2,0,0,0,0|0,0,0]=2 1365 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 M50024 [0,2,0,0,0,0|1,0,0]=3 1366 B11R1.3 CNC1=CC=C([N+](=O)[O-])C=C1 M60707 [0,2,0,0,0,0|1,0,1]=4 1367 B11R1.3 CNC1=NC=C(C(=O)O)C=N1 M43111 [0,2,0,0,0,0|2,0,0]=4 1368 B11R1.3 COC1=CC=C(C(=N)N)C=C1 M49492 [0,2,0,0,0,0|2,0,0]=4 1369 B11R1.3 COC1=CC=C(C(=O)O)C=C1 M64803 [0,2,0,0,0,0|0,0,0]=2 1370 B11R1.3 COC1=CC=C(C(N)=O)C=C1 M49268 [0,2,0,0,0,0|1,0,0]=3 1371 B11R1.3 COC1=CC=C([C@@H](C)O)C=C1 M50287 [0,2,0,0,0,0|1,0,1]=4 1372 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M38013 [0,2,0,0,0,0|1,0,1]=4 1373 B11R1.3 COC1=CC=C([C@H](C)O)C=C1 M50288 [0,2,0,0,0,0|1,0,1]=4 1374 B11R1.3 COC1=CN=C(C(=O)O)C=C1 M14344 [0,2,0,0,0,0|1,0,0]=3 1375 B11R1.3 COC1=CN=C(C(=O)O)C=N1 M23515 [0,2,0,0,0,0|2,0,0]=4 1376 B11R1.3 COC1=CN=C(C(C)=O)C=C1 A15229 [0,2,0,0,0,0|2,0,0]=4 1377 B11R1.3 COC1=NC=C(C(=O)O)C=C1 M12739 [0,2,0,0,0,0|1,0,0]=3 1378 B11R1.3 COC1=NC=C(C(C)=O)C=C1 A49280 [0,2,0,0,0,0|2,0,0]=4 1379 B11R1.3 COC1=NN=C(C(=O)O)C=C1 M24293 [0,2,0,0,0,0|2,0,0]=4 1380 B11R1.3 CSC1=CC=C(B(O)O)C=C1 M4660 [0,2,0,0,0,0|1,0,1]=4 1381 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 M62193 [0,2,0,0,0,0|0,0,0]=2 1382 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 M49959 [0,2,0,0,0,0|1,0,0]=3 1383 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 M12383 [0,2,0,0,0,0|2,0,0]=4 1384 B11R1.3 N#CC1=CC=C(B(O)O)C=C1 C2360 [0,2,0,0,0,0|1,0,1]=4 1385 B11R1.3 N#CC1=CC=C(C(=N)N)C=C1 C49602 [0,2,0,0,0,0|2,0,0]=4 1386 B11R1.3 N#CC1=CC=C(C(=O)Cl)C=C1 C47438 [0,2,0,0,0,0|1,0,0]=3 1387 B11R1.3 N#CC1=CC=C([N+](=O)[O-])C=C1 N69095 [0,2,0,0,0,0|1,0,1]=4 1388 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 C44349 [0,2,0,0,0,0|1,0,0]=3 1389 B11R1.3 N#CC1=CN=C(C(=O)O)C=N1 C37446 [0,2,0,0,0,0|2,0,0]=4 1390 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 C24975 [0,2,0,0,0,0|1,0,0]=3 1391 B11R1.3 N#CC1=NC=C(C(=O)O)C=N1 C11341 [0,2,0,0,0,0|2,0,0]=4 1392 B11R1.3 NCC1=CC=C(B(O)O)C=C1 A1320 [0,2,0,0,0,0|1,0,1]=4 1393 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 A37814 [0,2,0,0,0,0|0,0,0]=2 1394 B11R1.3 NCC1=CC=C(C(N)=O)C=C1 A49493 [0,2,0,0,0,0|1,0,0]=3 1395 B11R1.3 NCC1=CC=C([N+](=O)[O-])C=C1 N46556 [0,2,0,0,0,0|1,0,1]=4 1396 B11R1.3 NNC1=CC=C([N+](=O)[O-])C=C1 N68829 [0,2,0,0,0,0|1,0,1]=4 1397 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 H7591 [0,2,0,0,0,0|1,0,0]=3 1398 B11R1.3 NOC1=CC=C([N+](=O)[O-])C=C1 N69631 [0,2,0,0,0,0|1,0,1]=4 1399 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 H49094 [0,2,0,0,0,0|0,0,0]=2 1400 B11R1.3 O=C(O)C1=NC=C(CO)C=C1 H32219 [0,2,0,0,0,0|1,0,0]=3 1401 B11R1.3 O=CC1=CC=C(B(O)O)C=C1 F3540 [0,2,0,0,0,0|1,0,1]=4 1402 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 F69091 [0,2,0,0,0,0|0,0,0]=2 1403 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=C1 N67887 [0,2,0,0,0,0|1,0,1]=4 1404 B11R1.3 O=[N+]([O-])C1=CC=C(CO)C=C1 N68869 [0,2,0,0,0,0|1,0,1]=4 1405 B11R1.3 OB(O)C1=CC=C(CBr)C=C1 B1880 [0,2,0,0,0,0|1,0,1]=4 1406 B11R1.3 OCC1=CC=C(B(O)O)C=C1 H3720 [0,2,0,0,0,0|1,0,1]=4 1407 B11R1.19 CC(C)(O)C1=CC=C(Br)C=C1 B50148 [0,2,0,0,0,0|1,0,1]=4 1408 B11R1.19 CC1=CC=C(P(=O)(O)O)C=C1 T46447 [0,2,0,0,0,0|1,0,0]=3 1409 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 A38483 [0,2,0,0,0,0|1,0,0]=3 1410 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 A57393 [0,2,0,0,0,0|1,0,0]=3 1411 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 D58072 [0,2,0,0,0,0|1,0,0]=3 1412 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 E56561 [0,2,0,0,0,0|1,0,0]=3 1413 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 E62577 [0,2,0,0,0,0|1,0,0]=3 1414 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 F29658 [0,2,0,0,0,0|1,0,0]=3 1415 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 H7302 [0,2,0,0,0,0|1,0,0]=3 1416 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M22571 [0,2,0,0,0,0|1,0,0]=3 1417 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M23344 [0,2,0,0,0,0|1,0,0]=3 1418 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M58073 [0,2,0,0,0,0|1,0,0]=3 1419 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M65363 [0,2,0,0,0,0|1,0,0]=3 1420 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 M68821 [0,2,0,0,0,0|1,0,0]=3 1421 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 O8459 [0,2,0,0,0,0|1,0,0]=3 1422 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 P56560 [0,2,0,0,0,0|1,0,0]=3 1423 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 T55432 [0,2,0,0,0,0|1,0,0]=3 1424 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 T58548 [0,2,0,0,0,0|1,0,0]=3 1425 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 B58549 [0,2,0,0,0,0|1,0,1]=4 1426 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 E57398 [0,2,0,0,0,0|1,0,1]=4 1427 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 S45942 [0,2,0,0,0,0|1,0,1]=4 1428 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 T68240 [0,2,0,0,0,0|1,0,1]=4 1429 B11R1.19 CC1=CC=C(S(N)(=O)=O)C=C1 T60719 [0,2,0,0,0,0|1,0,1]=4 1430 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 M43169 [0,2,0,0,0,0|2,0,0]=4 1431 B11R1.19 CP(C)(=O)C1=CC=C(Br)C=C1 B62353 [0,2,0,0,0,0|2,0,0]=4 1432 B11R1.19 CP(C)(=O)C1=CC=C(N)C=C1 A49544 [0,2,0,0,0,0|2,0,0]=4 1433 B11R1.19 CS(=O)(=O)C1=CC=C(Br)C=C1 B38495 [0,2,0,0,0,0|1,0,1]=4 1434 B11R1.19 CS(=O)(=O)C1=CC=C(O)C=C1 M46269 [0,2,0,0,0,0|1,0,1]=4 1435 B11R1.19 NC1=CC=C(S(=O)(=O)F)C=C1 A62220 [0,2,0,0,0,0|1,0,1]=4 1436 B11R1.19 NC1=CC=C(S(=O)(=O)[O-])C=C1 S69634 [0,2,0,0,0,0|1,0,1]=4 1437 B11R1.19 NC1=NC=C(S(=O)(=O)O)C=C1 A41046 [0,2,0,0,0,0|2,0,0]=4 1438 B11R1.19 NS(=O)(=O)C1=CC=C(O)C=C1 H43166 [0,2,0,0,0,0|1,0,1]=4 1439 B11R1.19 O=S(=O)(Cl)C1=CC=C(O)C=C1 H62772 [0,2,0,0,0,0|1,0,1]=4 1440 B11R1.19 O=S(=O)(O)C1=CC=C(I)C=C1 I37070 [0,2,0,0,0,0|1,0,0]=3 1441 B11R1.19 O=S(=O)([O-])C1=CC=C(I)C=C1 P42332 [0,2,0,0,0,0|1,0,1]=4 1442 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 B52032 [0,2,0,0,0,0|1,0,0]=3 1443 B11R1.21 CC(=O)C1=CC(Br)=C(F)C=C1 B39475 [0,2,0,0,0,0|1,0,0]=3 1444 B11R1.21 CC(=O)C1=CC(Br)=C(I)C=C1 B48269 [0,2,0,0,0,0|1,0,0]=3 1445 B11R1.21 CC(=O)C1=CC(Br)=C(N)C=C1 A49026 [0,2,0,0,0,0|1,0,0]=3 1446 B11R1.21 CC(=O)C1=CC(Br)=C(O)C=C1 B48581 [0,2,0,0,0,0|1,0,0]=3 1447 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=C1 B52034 [0,2,0,0,0,0|1,0,0]=3 1448 B11R1.21 CC(=O)C1=CC(C)=C(Br)C=N1 B63831 [0,2,0,0,0,0|2,0,0]=4 1449 B11R1.21 CC(=O)C1=CC(C)=C(Cl)C=C1 C52042 [0,2,0,0,0,0|1,0,0]=3 1450 B11R1.21 CC(=O)C1=CC(C)=C(F)C=C1 F28728 [0,2,0,0,0,0|1,0,0]=3 1451 B11R1.21 CC(=O)C1=CC(Cl)=C(Br)C=C1 B48245 [0,2,0,0,0,0|1,0,0]=3 1452 B11R1.21 CC(=O)C1=CC(Cl)=C(C)C=C1 C61119 [0,2,0,0,0,0|1,0,0]=3 1453 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)C=C1 D39476 [0,2,0,0,0,0|1,0,0]=3 1454 B11R1.21 CC(=O)C1=CC(Cl)=C(F)C=C1 C48274 [0,2,0,0,0,0|1,0,0]=3 1455 B11R1.21 CC(=O)C1=CC(F)=C(Br)C=C1 B48250 [0,2,0,0,0,0|1,0,0]=3 1456 B11R1.21 CC(=O)C1=CC(F)=C(Cl)C=C1 C69014 [0,2,0,0,0,0|1,0,0]=3 1457 B11R1.21 CC(=O)C1=CC(F)=C(F)C=C1 D39477 [0,2,0,0,0,0|1,0,0]=3 1458 B11R1.21 CC(=O)C1=CC(F)=C(N)C=C1 A49052 [0,2,0,0,0,0|1,0,0]=3 1459 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 F48621 [0,2,0,0,0,0|1,0,0]=3 1460 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 A50026 [0,2,0,0,0,0|1,0,0]=3 1461 B11R1.21 CC(=O)C1=CC(N)=C(Cl)C=C1 A49040 [0,2,0,0,0,0|1,0,0]=3 1462 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 D68113 [0,2,0,0,0,0|1,0,0]=3 1463 B11R1.21 CC(=O)C1=CN=C(Cl)C(C)=C1 C49042 [0,2,0,0,0,0|2,0,0]=4 1464 B11R1.21 CC(=O)C1=CN=C(Cl)C(Cl)=C1 D37474 [0,2,0,0,0,0|2,0,0]=4 1465 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 B48570 [0,2,0,0,0,0|0,0,0]=2 1466 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=N1 B64856 [0,2,0,0,0,0|1,0,0]=3 1467 B11R1.21 CC1=C(Br)C=C(C(=O)O)N=C1 B32388 [0,2,0,0,0,0|1,0,0]=3 1468 B11R1.21 CC1=C(Br)C=C([N+](=O)[O-])C=C1 B68178 [0,2,0,0,0,0|1,0,1]=4 1469 B11R1.21 CC1=C(Br)C=CC(B(O)O)=C1 B46237 [0,2,0,0,0,0|1,0,1]=4 1470 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 B38437 [0,2,0,0,0,0|0,0,0]=2 1471 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=N1 B37042 [0,2,0,0,0,0|1,0,0]=3 1472 B11R1.21 CC1=C(Br)C=CC([N+](=O)[O-])=C1 B39379 [0,2,0,0,0,0|1,0,1]=4 1473 B11R1.21 CC1=C(Br)C=NC(C(=O)O)=C1 B45347 [0,2,0,0,0,0|1,0,0]=3 1474 B11R1.21 CC1=C(C)C=C(B(O)O)C=C1 D2960 [0,2,0,0,0,0|1,0,1]=4 1475 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 D69089 [0,2,0,0,0,0|0,0,0]=2 1476 B11R1.21 CC1=C(C)N=C(C(=O)O)C=C1 D49279 [0,2,0,0,0,0|1,0,0]=3 1477 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 D46015 [0,2,0,0,0,0|2,0,0]=4 1478 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 C2226 [0,2,0,0,0,0|1,0,1]=4 1479 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 C48593 [0,2,0,0,0,0|0,0,0]=2 1480 B11R1.21 CC1=C(Cl)C=C(C(=O)O)N=C1 C26055 [0,2,0,0,0,0|1,0,0]=3 1481 B11R1.21 CC1=C(Cl)C=CC(B(O)O)=C1 C2229 [0,2,0,0,0,0|1,0,1]=4 1482 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 C39491 [0,2,0,0,0,0|0,0,0]=2 1483 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 C18675 [0,2,0,0,0,0|1,0,1]=4 1484 B11R1.21 CC1=C(F)C=C(B(O)O)C=C1 F3286 [0,2,0,0,0,0|1,0,1]=4 1485 B11R1.21 CC1=C(F)C=C(C(=N)N)C=C1 F49622 [0,2,0,0,0,0|2,0,0]=4 1486 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 F48613 [0,2,0,0,0,0|0,0,0]=2 1487 B11R1.21 CC1=C(F)C=C(C(=O)O)C=N1 F61560 [0,2,0,0,0,0|1,0,0]=3 1488 B11R1.21 CC1=C(F)C=C(C(=O)O)N=C1 F62992 [0,2,0,0,0,0|1,0,0]=3 1489 B11R1.21 CC1=C(F)C=C([N+](=O)[O-])C=C1 F45372 [0,2,0,0,0,0|1,0,1]=4 1490 B11R1.21 CC1=C(F)C=CC(B(O)O)=C1 F3320 [0,2,0,0,0,0|1,0,1]=4 1491 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 F39495 [0,2,0,0,0,0|0,0,0]=2 1492 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 F37719 [0,2,0,0,0,0|1,0,0]=3 1493 B11R1.21 CC1=C(F)C=CC([N+](=O)[O-])=C1 N69301 [0,2,0,0,0,0|1,0,1]=4 1494 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 K25553 [0,2,0,0,0,0|0,0,0]=2 1495 B11R1.21 CC1=C(I)C=C([N+](=O)[O-])C=C1 K45401 [0,2,0,0,0,0|1,0,1]=4 1496 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 K63515 [0,2,0,0,0,0|0,0,0]=2 1497 B11R1.21 CC1=C(I)C=CC([N+](=O)[O-])=C1 K45398 [0,2,0,0,0,0|1,0,1]=4 1498 B11R1.21 CC1=C(N)C=C(B(O)O)C=C1 A43701 [0,2,0,0,0,0|1,0,1]=4 1499 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 A39517 [0,2,0,0,0,0|0,0,0]=2 1500 B11R1.21 CC1=C(O)C=C(B(O)O)C=C1 H62526 [0,2,0,0,0,0|1,0,1]=4 1501 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 H49095 [0,2,0,0,0,0|0,0,0]=2 1502 B11R1.21 CC1=C(O)C=C([N+](=O)[O-])C=C1 M39397 [0,2,0,0,0,0|1,0,1]=4 1503 B11R1.21 CC1=C(O)C=CC(B(O)O)=C1 H46446 [0,2,0,0,0,0|1,0,1]=4 1504 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 H49097 [0,2,0,0,0,0|0,0,0]=2 1505 B11R1.21 CC1=C(O)C=CC([N+](=O)[O-])=C1 M45830 [0,2,0,0,0,0|1,0,1]=4 1506 B11R1.21 CC1=CC(C(=O)O)=CN=C1Cl C45358 [0,2,0,0,0,0|1,0,0]=3 1507 B11R1.21 CC1=CC(C(=O)O)=CNC1=O M45851 [0,2,0,0,0,0|1,0,0]=3 1508 B11R1.21 CC1=CC=C(C(=O)O)N=C1Br B37453 [0,2,0,0,0,0|1,0,0]=3 1509 B11R1.21 CC1=CC=C(C(=O)O)N=C1Cl C32429 [0,2,0,0,0,0|1,0,0]=3 1510 B11R1.21 CC1=NC(C(=O)O)=CN=C1Cl C42410 [0,2,0,0,0,0|2,0,0]=4 1511 B11R1.21 CC1=NC=C(C(=O)O)C=C1N A8134 [0,2,0,0,0,0|1,0,0]=3 1512 B11R1.21 CN1C=C(C(=O)O)C=CC1=O D7475 [0,2,0,0,0,0|1,0,0]=3 1513 B11R1.21 CN1C=CC(C(=O)O)=CC1=O M0305 [0,2,0,0,0,0|1,0,0]=3 1514 B11R1.21 CN1C=CC(C(N)=O)=CC1=O M24703 [0,2,0,0,0,0|2,0,0]=4 1515 B11R1.21 CN1N=C(C(=O)O)C=CC1=O M12596 [0,2,0,0,0,0|2,0,0]=4 1516 B11R1.21 C[C@H](O)C1=CC(Cl)=C(Cl)C=C1 D49144 [0,2,0,0,0,0|1,0,1]=4 1517 B11R1.21 C[C@H](O)C1=CC(F)=C(F)C=C1 D49155 [0,2,0,0,0,0|1,0,1]=4 1518 B11R1.21 N=C(N)C1=CC(N)=C(N)C=C1 D43696 [0,2,0,0,0,0|2,0,0]=4 1519 B11R1.21 NC(=O)C1=CC(Br)=C(F)C=C1 B45032 [0,2,0,0,0,0|1,0,0]=3 1520 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 D62335 [0,2,0,0,0,0|1,0,0]=3 1521 B11R1.21 NC(=O)C1=CC(O)=C(N)C=C1 A45997 [0,2,0,0,0,0|1,0,0]=3 1522 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 A45330 [0,2,0,0,0,0|0,0,0]=2 1523 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=N1 A21931 [0,2,0,0,0,0|1,0,0]=3 1524 B11R1.21 NC1=C(Br)C=C([N+](=O)[O-])C=C1 B42381 [0,2,0,0,0,0|1,0,1]=4 1525 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 A45328 [0,2,0,0,0,0|0,0,0]=2 1526 B11R1.21 NC1=C(Br)C=CC([N+](=O)[O-])=C1 B42382 [0,2,0,0,0,0|1,0,1]=4 1527 B11R1.21 NC1=C(Br)C=NC(C(=O)O)=C1 A12918 [0,2,0,0,0,0|1,0,0]=3 1528 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 A69418 [0,2,0,0,0,0|0,0,0]=2 1529 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 A69510 [0,2,0,0,0,0|0,0,0]=2 1530 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=N1 A42403 [0,2,0,0,0,0|1,0,0]=3 1531 B11R1.21 NC1=C(Cl)C=CC([N+](=O)[O-])=C1 C69315 [0,2,0,0,0,0|1,0,1]=4 1532 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 A45379 [0,2,0,0,0,0|0,0,0]=2 1533 B11R1.21 NC1=C(F)C=C([N+](=O)[O-])C=C1 F42414 [0,2,0,0,0,0|1,0,1]=4 1534 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 A45377 [0,2,0,0,0,0|0,0,0]=2 1535 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 A45396 [0,2,0,0,0,0|0,0,0]=2 1536 B11R1.21 NC1=C(I)C=C([N+](=O)[O-])C=C1 K67952 [0,2,0,0,0,0|1,0,1]=4 1537 B11R1.21 NC1=C(I)C=CC(C(=O)O)=C1 A45395 [0,2,0,0,0,0|0,0,0]=2 1538 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 A67467 [0,2,0,0,0,0|0,0,0]=2 1539 B11R1.21 NC1=CC(C(=O)O)=CN=C1N D43100 [0,2,0,0,0,0|1,0,0]=3 1540 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br A1664 [0,2,0,0,0,0|2,0,0]=4 1541 B11R1.21 NC1=NC=C(C(=O)O)N=C1I A14604 [0,2,0,0,0,0|2,0,0]=4 1542 B11R1.21 O=C(O)C1=CC(=O)C(O)=CN1 H38960 [0,2,0,0,0,0|1,0,0]=3 1543 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 D36700 [0,2,0,0,0,0|0,0,0]=2 1544 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 B44568 [0,2,0,0,0,0|0,0,0]=2 1545 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 B3744 [0,2,0,0,0,0|1,0,0]=3 1546 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 B39336 [0,2,0,0,0,0|0,0,0]=2 1547 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 B44584 [0,2,0,0,0,0|0,0,0]=2 1548 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 B3783 [0,2,0,0,0,0|1,0,0]=3 1549 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 B44571 [0,2,0,0,0,0|0,0,0]=2 1550 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=N1 B32007 [0,2,0,0,0,0|1,0,0]=3 1551 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 D41928 [0,2,0,0,0,0|1,0,0]=3 1552 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 C44591 [0,2,0,0,0,0|0,0,0]=2 1553 B11R1.21 O=C(O)C1=CC(Cl)=C(I)C=C1 C38946 [0,2,0,0,0,0|0,0,0]=2 1554 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 C62141 [0,2,0,0,0,0|0,0,0]=2 1555 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 B44576 [0,2,0,0,0,0|0,0,0]=2 1556 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 C37845 [0,2,0,0,0,0|0,0,0]=2 1557 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 D68133 [0,2,0,0,0,0|0,0,0]=2 1558 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 F36867 [0,2,0,0,0,0|0,0,0]=2 1559 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 F68105 [0,2,0,0,0,0|0,0,0]=2 1560 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 B67829 [0,2,0,0,0,0|0,0,0]=2 1561 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 C44602 [0,2,0,0,0,0|0,0,0]=2 1562 B11R1.21 O=C(O)C1=CC(I)=C(Cl)N=C1 C41944 [0,2,0,0,0,0|1,0,0]=3 1563 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 F44617 [0,2,0,0,0,0|0,0,0]=2 1564 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 B45113 [0,2,0,0,0,0|0,0,0]=2 1565 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 C38513 [0,2,0,0,0,0|0,0,0]=2 1566 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 F24023 [0,2,0,0,0,0|0,0,0]=2 1567 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 H45126 [0,2,0,0,0,0|0,0,0]=2 1568 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=N1 D41898 [0,2,0,0,0,0|1,0,0]=3 1569 B11R1.21 O=C(O)C1=CC=C(Cl)C(=O)N1 C42277 [0,2,0,0,0,0|1,0,0]=3 1570 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 B41907 [0,2,0,0,0,0|1,0,0]=3 1571 B11R1.21 O=C(O)C1=CC=C(Cl)C(Cl)=N1 D32272 [0,2,0,0,0,0|1,0,0]=3 1572 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 B16286 [0,2,0,0,0,0|1,0,0]=3 1573 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=N1 C36953 [0,2,0,0,0,0|1,0,0]=3 1574 B11R1.21 O=C(O)C1=CN=C(Br)C(Br)=C1 D41897 [0,2,0,0,0,0|1,0,0]=3 1575 B11R1.21 O=C(O)C1=CN=C(Br)C(F)=C1 B15602 [0,2,0,0,0,0|1,0,0]=3 1576 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 D15565 [0,2,0,0,0,0|1,0,0]=3 1577 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=N1 D40472 [0,2,0,0,0,0|2,0,0]=4 1578 B11R1.21 O=C(O)C1=CN=C(F)C(F)=C1 D11881 [0,2,0,0,0,0|1,0,0]=3 1579 B11R1.21 O=C(O)C1=NC(O)=C(Br)C=C1 B37386 [0,2,0,0,0,0|1,0,0]=3 1580 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(Br)C=C1 D41899 [0,2,0,0,0,0|1,0,1]=4 1581 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(Cl)C=C1 B39229 [0,2,0,0,0,0|1,0,1]=4 1582 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(F)C=C1 B2866 [0,2,0,0,0,0|1,0,1]=4 1583 B11R1.21 O=[N+]([O-])C1=CC(Br)=C(O)C=C1 B42260 [0,2,0,0,0,0|1,0,1]=4 1584 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(Br)C=C1 B41909 [0,2,0,0,0,0|1,0,1]=4 1585 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(F)C=C1 C68082 [0,2,0,0,0,0|1,0,1]=4 1586 B11R1.21 O=[N+]([O-])C1=CC(F)=C(Br)C=C1 B41917 [0,2,0,0,0,0|1,0,1]=4 1587 B11R1.21 O=[N+]([O-])C1=CC(F)=C(Cl)C=C1 C41935 [0,2,0,0,0,0|1,0,1]=4 1588 B11R1.21 O=[N+]([O-])C1=CC(F)=C(I)C=C1 F41951 [0,2,0,0,0,0|1,0,1]=4 1589 B11R1.21 O=[N+]([O-])C1=CC(F)=C(O)C=C1 F67644 [0,2,0,0,0,0|1,0,1]=4 1590 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Br)C=C1 B41923 [0,2,0,0,0,0|1,0,1]=4 1591 B11R1.21 O=[N+]([O-])C1=CC(I)=C(Cl)C=C1 C28731 [0,2,0,0,0,0|1,0,1]=4 1592 B11R1.21 O=[N+]([O-])C1=CC(I)=C(F)C=C1 F41953 [0,2,0,0,0,0|1,0,1]=4 1593 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Br)C=C1 B5176 [0,2,0,0,0,0|1,0,1]=4 1594 B11R1.21 O=[N+]([O-])C1=CC(O)=C(Cl)C=C1 C42266 [0,2,0,0,0,0|1,0,1]=4 1595 B11R1.21 O=[N+]([O-])C1=CC(O)=C(F)C=C1 F42279 [0,2,0,0,0,0|1,0,1]=4 1596 B11R1.21 O=[N+]([O-])C1=CC(O)=C(I)C=C1 K62017 [0,2,0,0,0,0|1,0,1]=4 1597 B11R1.21 O=[N+]([O-])C1=CC(O)=C(O)C=C1 N61905 [0,2,0,0,0,0|1,0,1]=4 1598 B11R1.21 OB(O)C1=CC(Cl)=C(Cl)C=C1 D2560 [0,2,0,0,0,0|1,0,1]=4 1599 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 C2200 [0,2,0,0,0,0|1,0,1]=4 1600 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 C42947 [0,2,0,0,0,0|1,0,1]=4 1601 B11R1.21 OB(O)C1=CC(F)=C(Br)C=C1 B1817 [0,2,0,0,0,0|1,0,1]=4 1602 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 C2276 [0,2,0,0,0,0|1,0,1]=4 1603 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 D2680 [0,2,0,0,0,0|1,0,1]=4 1604 B11R1.21 OB(O)C1=CC(F)=C(O)C=C1 F42953 [0,2,0,0,0,0|1,0,1]=4 1605 B11R1.21 OB(O)C1=CC(O)=C(Cl)C=C1 C42949 [0,2,0,0,0,0|1,0,1]=4 1606 B11R1.21 OB(O)C1=CC(O)=C(F)C=C1 F42955 [0,2,0,0,0,0|1,0,1]=4 1607 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 X51560 [0,2,0,0,0,0|0,0,1]=3 1608 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 B52024 [0,2,0,0,0,0|1,0,0]=3 1609 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 A52107 [0,2,0,0,0,0|1,0,0]=3 1610 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 T46647 [0,2,0,0,0,0|1,0,0]=3 1611 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 A52174 [0,2,0,0,0,0|1,0,1]=4 1612 B11R1.22 CCC(=O)C1=CC=C(Br)C=C1 B16168 [0,2,0,0,0,0|1,0,0]=3 1613 B11R1.22 CCC(=O)C1=CC=C(F)C=C1 F39582 [0,2,0,0,0,0|1,0,0]=3 1614 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 K52052 [0,2,0,0,0,0|1,0,0]=3 1615 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 B49023 [0,2,0,0,0,0|1,0,0]=3 1616 B11R1.22 CNC(=O)C1=CC=C(I)C=C1 K63815 [0,2,0,0,0,0|1,0,0]=3 1617 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 A69158 [0,2,0,0,0,0|1,0,0]=3 1618 B11R1.22 CNC(=O)C1=CN=C(Cl)C=C1 C45698 [0,2,0,0,0,0|2,0,0]=4 1619 B11R1.22 CNC(=O)C1=NC=C(Br)C=C1 B60995 [0,2,0,0,0,0|2,0,0]=4 1620 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 M39489 [0,2,0,0,0,0|0,0,0]=2 1621 B11R1.22 COC(=O)C1=CC=C(C)C=C1 M60598 [0,2,0,0,0,0|0,0,0]=2 1622 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 M64818 [0,2,0,0,0,0|0,0,0]=2 1623 B11R1.22 COC(=O)C1=CC=C(F)C=C1 M67923 [0,2,0,0,0,0|0,0,0]=2 1624 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 M0015 [0,2,0,0,0,0|1,0,0]=3 1625 B11R1.22 COC(=O)C1=CN=C(Br)C=N1 M8884 [0,2,0,0,0,0|2,0,0]=4 1626 B11R1.22 COC(=O)C1=CN=C(C)C=C1 M13760 [0,2,0,0,0,0|1,0,0]=3 1627 B11R1.22 COC(=O)C1=CN=C(C)N=C1 M12380 [0,2,0,0,0,0|2,0,0]=4 1628 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 M39382 [0,2,0,0,0,0|1,0,0]=3 1629 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 M1561 [0,2,0,0,0,0|2,0,0]=4 1630 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 M1662 [0,2,0,0,0,0|2,0,0]=4 1631 B11R1.22 COC(=O)C1=CN=C(F)C=C1 M4740 [0,2,0,0,0,0|1,0,0]=3 1632 B11R1.22 COC(=O)C1=CN=C(N)N=C1 M14282 [0,2,0,0,0,0|2,0,0]=4 1633 B11R1.22 COC(=O)C1=CNC(=O)C=C1 M7692 [0,2,0,0,0,0|1,0,0]=3 1634 B11R1.22 COC(=O)C1=CNC(=O)N=C1 M43427 [0,2,0,0,0,0|2,0,0]=4 1635 B11R1.22 COC(=O)C1=COC(=O)C=C1 M38530 [0,2,0,0,0,0|1,0,0]=3 1636 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 M10296 [0,2,0,0,0,0|1,0,0]=3 1637 B11R1.22 COC(=O)C1=NC=C(Br)C=N1 M14042 [0,2,0,0,0,0|2,0,0]=4 1638 B11R1.22 COC(=O)C1=NC=C(C)C=C1 M22900 [0,2,0,0,0,0|1,0,0]=3 1639 B11R1.22 COC(=O)C1=NC=C(C)C=N1 M10612 [0,2,0,0,0,0|2,0,0]=4 1640 B11R1.22 COC(=O)C1=NC=C(C)N=C1 M46011 [0,2,0,0,0,0|2,0,0]=4 1641 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 M45366 [0,2,0,0,0,0|1,0,0]=3 1642 B11R1.22 COC(=O)C1=NC=C(Cl)C=N1 M13251 [0,2,0,0,0,0|2,0,0]=4 1643 B11R1.22 COC(=O)C1=NC=C(F)C=C1 M16415 [0,2,0,0,0,0|1,0,0]=3 1644 B11R1.22 COC(=O)C1=NC=C(F)C=N1 M17741 [0,2,0,0,0,0|2,0,0]=4 1645 B11R1.22 COC(=O)C1=NC=C(I)C=C1 M45392 [0,2,0,0,0,0|1,0,0]=3 1646 B11R1.22 COC(=O)C1=NC=C(N)C=C1 M0251 [0,2,0,0,0,0|1,0,0]=3 1647 B11R1.22 COC(=O)C1=NC=C(N)C=N1 M10294 [0,2,0,0,0,0|2,0,0]=4 1648 B11R1.22 COC(=O)C1=NC=C(N)C=N1 M1663 [0,2,0,0,0,0|2,0,0]=4 1649 B11R1.22 COC(=O)C1=NC=C(N)N=C1 A0342 [0,2,0,0,0,0|2,0,0]=4 1650 B11R1.22 COC(=O)C1=NC=C(N)N=C1 M19340 [0,2,0,0,0,0|2,0,0]=4 1651 B11R1.22 COC(=O)C1=NC=C(O)C=C1 M7706 [0,2,0,0,0,0|1,0,0]=3 1652 B11R1.22 COC(=O)C1=NC=C(O)C=N1 M19514 [0,2,0,0,0,0|2,0,0]=4 1653 B11R1.22 COC(=O)C1=NC=C(O)N=C1 M12387 [0,2,0,0,0,0|2,0,0]=4 1654 B11R1.22 COC(=O)C1=NN=C(Br)C=C1 M32242 [0,2,0,0,0,0|2,0,0]=4 1655 B11R1.22 COC(=O)C1=NN=C(Cl)C=C1 C3617 [0,2,0,0,0,0|2,0,0]=4 1656 B11R1.22 COC(=O)C1=NN=C(N)C=C1 M7641 [0,2,0,0,0,0|2,0,0]=4 1657 B11R1.22 COC(=O)C1=NN=C(O)C=C1 M0452 [0,2,0,0,0,0|2,0,0]=4 1658 B11R1.22 C\C(=N\O)C1=CC=C(Cl)C=C1 C67180 [0,2,0,0,0,0|1,0,0]=3 1659 B11R1.22 NCC(=O)C1=CC=C(Br)C=C1 B49032 [0,2,0,0,0,0|1,0,0]=3 1660 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 A49045 [0,2,0,0,0,0|1,0,0]=3 1661 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 A49617 [0,2,0,0,0,0|1,0,0]=3 1662 B11R1.22 NNC(=O)C1=CC=C(Cl)C=C1 C45695 [0,2,0,0,0,0|1,0,0]=3 1663 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 F45705 [0,2,0,0,0,0|1,0,0]=3 1664 B11R1.22 NNC(=O)C1=CNC(=O)C=C1 X43112 [0,2,0,0,0,0|2,0,0]=4 1665 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 F42828 [0,2,0,0,0,0|2,0,0]=4 1666 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A38341 [0,2,0,0,0,0|1,0,1]=4 1667 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A46796 [0,2,0,0,0,0|1,0,1]=4 1668 B11R1.22 N[C@@H](CO)C1=CC=C(Br)C=C1 A46798 [0,2,0,0,0,0|1,0,1]=4 1669 B11R1.22 N[C@@H](CO)C1=CC=C(Cl)C=C1 A46808 [0,2,0,0,0,0|1,0,1]=4 1670 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 A46813 [0,2,0,0,0,0|1,0,1]=4 1671 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 A46818 [0,2,0,0,0,0|1,0,1]=4 1672 B11R1.22 N[C@@H](CO)C1=CC=C(O)C=C1 A49527 [0,2,0,0,0,0|1,0,1]=4 1673 B11R1.22 N[C@H](CO)C1=CC=C(Br)C=C1 A46797 [0,2,0,0,0,0|1,0,1]=4 1674 B11R1.22 N[C@H](CO)C1=CC=C(Cl)C=C1 A46811 [0,2,0,0,0,0|1,0,1]=4 1675 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 A46821 [0,2,0,0,0,0|1,0,1]=4 1676 B11R1.22 N[C@H](CO)C1=CC=C(F)C=C1 A49517 [0,2,0,0,0,0|1,0,1]=4 1677 B11R1.22 N[C@H](CO)C1=CC=C(O)C=C1 A49528 [0,2,0,0,0,0|1,0,1]=4 1678 B11R1.22 O=C(CCl)C1=CC=C(Br)C=C1 B48246 [0,2,0,0,0,0|1,0,0]=3 1679 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 C69024 [0,2,0,0,0,0|1,0,0]=3 1680 B11R1.22 O=C(CCl)C1=CN=C(Cl)C=C1 C45047 [0,2,0,0,0,0|2,0,0]=4 1681 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 B47769 [0,2,0,0,0,0|0,0,1]=3 1682 B11R1.22 O=CC(=O)C1=CC=C(Cl)C=C1 C47781 [0,2,0,0,0,0|0,0,1]=3 1683 B11R1.22 OC[C@H](O)C1=CC=C(Br)C=C1 B49377 [0,2,0,0,0,0|0,0,2]=4 1684 B11R1.166 CC(=O)C1=C(Br)C=C(Cl)C=C1 B48242 [0,2,0,0,0,0|1,0,0]=3 1685 B11R1.166 CC(=O)C1=C(Br)C=C(O)C=C1 B48579 [0,2,0,0,0,0|1,0,0]=3 1686 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 D68875 [0,2,0,0,0,0|1,0,0]=3 1687 B11R1.166 CC(=O)C1=C(C)C=C(O)C=C1 H49903 [0,2,0,0,0,0|1,0,0]=3 1688 B11R1.166 CC(=O)C1=C(Cl)C=C(Br)C=C1 B48244 [0,2,0,0,0,0|1,0,0]=3 1689 B11R1.166 CC(=O)C1=C(Cl)C=C(F)C=C1 C48277 [0,2,0,0,0,0|1,0,0]=3 1690 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 B8298 [0,2,0,0,0,0|1,0,0]=3 1691 B11R1.166 CC(=O)C1=C(F)C=C(Cl)C=C1 C48275 [0,2,0,0,0,0|1,0,0]=3 1692 B11R1.166 CC(=O)C1=C(F)C=C(F)C=C1 D69359 [0,2,0,0,0,0|1,0,0]=3 1693 B11R1.166 CC(=O)C1=C(F)C=C(F)C=N1 D67335 [0,2,0,0,0,0|2,0,0]=4 1694 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 F48622 [0,2,0,0,0,0|1,0,0]=3 1695 B11R1.166 CC(=O)C1=C(N)C=C(Br)C=C1 A49024 [0,2,0,0,0,0|1,0,0]=3 1696 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 A50025 [0,2,0,0,0,0|1,0,0]=3 1697 B11R1.166 CC(=O)C1=C(N)C=C(Cl)C=C1 A49037 [0,2,0,0,0,0|1,0,0]=3 1698 B11R1.166 CC(=O)C1=C(O)C=C(Br)C=C1 B9402 [0,2,0,0,0,0|1,0,0]=3 1699 B11R1.166 CC(=O)C1=C(O)C=C(Cl)C=C1 C61332 [0,2,0,0,0,0|1,0,0]=3 1700 B11R1.166 CC(=O)C1=C(O)C=C(F)C=C1 F69072 [0,2,0,0,0,0|1,0,0]=3 1701 B11R1.166 CC(=O)C1=C(O)C=C(N)C=C1 A49290 [0,2,0,0,0,0|1,0,0]=3 1702 B11R1.166 CC(=O)C1=CC=C(Cl)N=C1Cl A9870 [0,2,0,0,0,0|2,0,0]=4 1703 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl D63902 [0,2,0,0,0,0|2,0,0]=4 1704 B11R1.166 CC(=O)C1=NC=C(Br)C=C1C B37444 [0,2,0,0,0,0|2,0,0]=4 1705 B11R1.166 CC1=C(B(O)O)C=CC(Br)=C1 B46236 [0,2,0,0,0,0|1,0,1]=4 1706 B11R1.166 CC1=C(B(O)O)C=CC(Cl)=C1 C2228 [0,2,0,0,0,0|1,0,1]=4 1707 B11R1.166 CC1=C(B(O)O)C=CC(F)=C1 F3300 [0,2,0,0,0,0|1,0,1]=4 1708 B11R1.166 CC1=C(B(O)O)C=CC(O)=C1 H3726 [0,2,0,0,0,0|1,0,1]=4 1709 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 B24914 [0,2,0,0,0,0|0,0,0]=2 1710 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=N1 B45337 [0,2,0,0,0,0|1,0,0]=3 1711 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 C38469 [0,2,0,0,0,0|0,0,0]=2 1712 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 C19139 [0,2,0,0,0,0|1,0,0]=3 1713 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 F48615 [0,2,0,0,0,0|0,0,0]=2 1714 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 F45382 [0,2,0,0,0,0|1,0,0]=3 1715 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 A49284 [0,2,0,0,0,0|0,0,0]=2 1716 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 H68873 [0,2,0,0,0,0|0,0,0]=2 1717 B11R1.166 CC1=C(C(=O)O)C=NC(Cl)=N1 C8877 [0,2,0,0,0,0|2,0,0]=4 1718 B11R1.166 CC1=C(C(=O)O)C=NC(N)=C1 A60535 [0,2,0,0,0,0|1,0,0]=3 1719 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Br)=C1 B45339 [0,2,0,0,0,0|1,0,1]=4 1720 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=C1 C39381 [0,2,0,0,0,0|1,0,1]=4 1721 B11R1.166 CC1=C([N+](=O)[O-])C=CC(F)=C1 F39387 [0,2,0,0,0,0|1,0,1]=4 1722 B11R1.166 CC1=C([N+](=O)[O-])C=CC(I)=C1 K63434 [0,2,0,0,0,0|1,0,1]=4 1723 B11R1.166 CC1=C([N+](=O)[O-])C=CC(N)=C1 M45993 [0,2,0,0,0,0|1,0,1]=4 1724 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 B25317 [0,2,0,0,0,0|0,0,0]=2 1725 B11R1.166 CC1=CC(Br)=C(C(=O)O)N=C1 B45334 [0,2,0,0,0,0|1,0,0]=3 1726 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O B38539 [0,2,0,0,0,0|1,0,0]=3 1727 B11R1.166 CC1=CC(C)=C(B(O)O)C=C1 D46940 [0,2,0,0,0,0|1,0,1]=4 1728 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 D49278 [0,2,0,0,0,0|1,0,0]=3 1729 B11R1.166 CC1=CC(Cl)=C(B(O)O)C=C1 C2224 [0,2,0,0,0,0|1,0,1]=4 1730 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 C38447 [0,2,0,0,0,0|0,0,0]=2 1731 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=N1 C12703 [0,2,0,0,0,0|1,0,0]=3 1732 B11R1.166 CC1=CC(Cl)=C([N+](=O)[O-])C=C1 C45360 [0,2,0,0,0,0|1,0,1]=4 1733 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O C45367 [0,2,0,0,0,0|1,0,0]=3 1734 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O C23967 [0,2,0,0,0,0|1,0,0]=3 1735 B11R1.166 CC1=CC(F)=C(B(O)O)C=C1 F7417 [0,2,0,0,0,0|1,0,1]=4 1736 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 F48610 [0,2,0,0,0,0|0,0,0]=2 1737 B11R1.166 CC1=CC(F)=C(C(=O)O)N=C1 F11219 [0,2,0,0,0,0|1,0,0]=3 1738 B11R1.166 CC1=CC(F)=C([N+](=O)[O-])C=C1 M64928 [0,2,0,0,0,0|1,0,1]=4 1739 B11R1.166 CC1=CC(F)=NC=C1C(=O)O F45383 [0,2,0,0,0,0|1,0,0]=3 1740 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 K61454 [0,2,0,0,0,0|0,0,0]=2 1741 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 A49282 [0,2,0,0,0,0|0,0,0]=2 1742 B11R1.166 CC1=CC(N)=C(C(=O)O)C=N1 A12850 [0,2,0,0,0,0|1,0,0]=3 1743 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 A46651 [0,2,0,0,0,0|1,0,0]=3 1744 B11R1.166 CC1=CC(N)=C([N+](=O)[O-])C=C1 M36624 [0,2,0,0,0,0|1,0,1]=4 1745 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 H7838 [0,2,0,0,0,0|1,0,1]=4 1746 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 M68144 [0,2,0,0,0,0|0,0,0]=2 1747 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 H39399 [0,2,0,0,0,0|1,0,0]=3 1748 B11R1.166 CC1=CC(O)=C([N+](=O)[O-])C=C1 M39398 [0,2,0,0,0,0|1,0,1]=4 1749 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 C10451 [0,2,0,0,0,0|1,0,0]=3 1750 B11R1.166 CC1=CN=C(C(=O)O)C(C)=N1 D46013 [0,2,0,0,0,0|2,0,0]=4 1751 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 D61273 [0,2,0,0,0,0|1,0,0]=3 1752 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 D46016 [0,2,0,0,0,0|2,0,0]=4 1753 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 A10622 [0,2,0,0,0,0|1,0,0]=3 1754 B11R1.166 CC1=NC(N)=C(C(=O)O)C=N1 A62547 [0,2,0,0,0,0|2,0,0]=4 1755 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 H45847 [0,2,0,0,0,0|1,0,0]=3 1756 B11R1.166 C[C@H](O)C1=C(Cl)C=C(Cl)C=C1 D49143 [0,2,0,0,0,0|1,0,1]=4 1757 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 B66610 [0,2,0,0,0,0|2,0,0]=4 1758 B11R1.166 NC(=O)C1=C(Br)C=C(I)C=C1 B45043 [0,2,0,0,0,0|1,0,0]=3 1759 B11R1.166 NC(=O)C1=C(Cl)C=C(O)C=C1 C45352 [0,2,0,0,0,0|1,0,0]=3 1760 B11R1.166 NC(=O)C1=C(F)C=C(F)C=C1 D45062 [0,2,0,0,0,0|1,0,0]=3 1761 B11R1.166 NC(=O)C1=C(N)C=C(Br)C=C1 A45686 [0,2,0,0,0,0|1,0,0]=3 1762 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 A67559 [0,2,0,0,0,0|1,0,0]=3 1763 B11R1.166 NC(=O)C1=C(N)C=C(F)C=C1 A45706 [0,2,0,0,0,0|1,0,0]=3 1764 B11R1.166 NC(=O)C1=C(N)C=C(O)C=C1 A45995 [0,2,0,0,0,0|1,0,0]=3 1765 B11R1.166 NC(=O)C1=C(N)N=C(Cl)C=C1 A42825 [0,2,0,0,0,0|2,0,0]=4 1766 B11R1.166 NC(=O)C1=C(O)C=C(N)C=C1 A45996 [0,2,0,0,0,0|1,0,0]=3 1767 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1Cl D42132 [0,2,0,0,0,0|2,0,0]=4 1768 B11R1.166 NC(=O)C1=CN=C(Cl)C=C1Cl D42133 [0,2,0,0,0,0|2,0,0]=4 1769 B11R1.166 NC(=O)C1=NC=C(Br)C=C1N A12888 [0,2,0,0,0,0|2,0,0]=4 1770 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 A22277 [0,2,0,0,0,0|0,0,0]=2 1771 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 A42389 [0,2,0,0,0,0|1,0,0]=3 1772 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 A64964 [0,2,0,0,0,0|0,0,0]=2 1773 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 A0415 [0,2,0,0,0,0|1,0,0]=3 1774 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 A39388 [0,2,0,0,0,0|0,0,0]=2 1775 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 A45394 [0,2,0,0,0,0|0,0,0]=2 1776 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 A45838 [0,2,0,0,0,0|0,0,0]=2 1777 B11R1.166 NC1=C([N+](=O)[O-])C=CC(Br)=C1 B42388 [0,2,0,0,0,0|1,0,1]=4 1778 B11R1.166 NC1=C([N+](=O)[O-])C=CC(Cl)=C1 C42401 [0,2,0,0,0,0|1,0,1]=4 1779 B11R1.166 NC1=C([N+](=O)[O-])C=CC(F)=C1 F42418 [0,2,0,0,0,0|1,0,1]=4 1780 B11R1.166 NC1=C([N+](=O)[O-])C=CC(O)=C1 A60820 [0,2,0,0,0,0|1,0,1]=4 1781 B11R1.166 NC1=CC(Br)=C([N+](=O)[O-])C=C1 B42385 [0,2,0,0,0,0|1,0,1]=4 1782 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O A0231 [0,2,0,0,0,0|1,0,0]=3 1783 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O A20229 [0,2,0,0,0,0|1,0,0]=3 1784 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 A69021 [0,2,0,0,0,0|0,0,0]=2 1785 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=N1 A42402 [0,2,0,0,0,0|1,0,0]=3 1786 B11R1.166 NC1=CC(Cl)=C([N+](=O)[O-])C=C1 C42400 [0,2,0,0,0,0|1,0,1]=4 1787 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O A7927 [0,2,0,0,0,0|1,0,0]=3 1788 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O A8132 [0,2,0,0,0,0|1,0,0]=3 1789 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O A10470 [0,2,0,0,0,0|1,0,0]=3 1790 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 A45378 [0,2,0,0,0,0|0,0,0]=2 1791 B11R1.166 NC1=CC(F)=C([N+](=O)[O-])C=C1 F13749 [0,2,0,0,0,0|1,0,1]=4 1792 B11R1.166 NC1=CC(F)=NC=C1C(=O)O A10496 [0,2,0,0,0,0|1,0,0]=3 1793 B11R1.166 NC1=CC(N)=C([N+](=O)[O-])C=C1 N41420 [0,2,0,0,0,0|1,0,1]=4 1794 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 A69652 [0,2,0,0,0,0|0,0,0]=2 1795 B11R1.166 O=C(Cl)C1=C(F)C=C(F)C=C1 D44260 [0,2,0,0,0,0|1,0,0]=3 1796 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 D44562 [0,2,0,0,0,0|0,0,0]=2 1797 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=N1 D61446 [0,2,0,0,0,0|1,0,0]=3 1798 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 B26650 [0,2,0,0,0,0|0,0,0]=2 1799 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=N1 B5201 [0,2,0,0,0,0|1,0,0]=3 1800 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)N=C1 B41904 [0,2,0,0,0,0|1,0,0]=3 1801 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 B27964 [0,2,0,0,0,0|0,0,0]=2 1802 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=N1 B41919 [0,2,0,0,0,0|1,0,0]=3 1803 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 B44582 [0,2,0,0,0,0|0,0,0]=2 1804 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 B45109 [0,2,0,0,0,0|0,0,0]=2 1805 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 B44570 [0,2,0,0,0,0|0,0,0]=2 1806 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 D68555 [0,2,0,0,0,0|0,0,0]=2 1807 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=N1 D4555 [0,2,0,0,0,0|1,0,0]=3 1808 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=N1 C41937 [0,2,0,0,0,0|1,0,0]=3 1809 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 C45116 [0,2,0,0,0,0|0,0,0]=2 1810 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 C45121 [0,2,0,0,0,0|0,0,0]=2 1811 B11R1.166 O=C(O)C1=C(Cl)C=C(O)N=C1 C42274 [0,2,0,0,0,0|1,0,0]=3 1812 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 B36989 [0,2,0,0,0,0|0,0,0]=2 1813 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 C23721 [0,2,0,0,0,0|0,0,0]=2 1814 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 D39341 [0,2,0,0,0,0|0,0,0]=2 1815 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 D25175 [0,2,0,0,0,0|1,0,0]=3 1816 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 F44613 [0,2,0,0,0,0|0,0,0]=2 1817 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 F38868 [0,2,0,0,0,0|0,0,0]=2 1818 B11R1.166 O=C(O)C1=C(F)N=C(Br)C=C1 B67337 [0,2,0,0,0,0|1,0,0]=3 1819 B11R1.166 O=C(O)C1=C(F)N=C(Cl)C=C1 C41938 [0,2,0,0,0,0|1,0,0]=3 1820 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 B37202 [0,2,0,0,0,0|0,0,0]=2 1821 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 C44601 [0,2,0,0,0,0|0,0,0]=2 1822 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 F44616 [0,2,0,0,0,0|0,0,0]=2 1823 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 B45112 [0,2,0,0,0,0|0,0,0]=2 1824 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 F45124 [0,2,0,0,0,0|0,0,0]=2 1825 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 C42275 [0,2,0,0,0,0|1,0,0]=3 1826 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br D12540 [0,2,0,0,0,0|1,0,0]=3 1827 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl D41927 [0,2,0,0,0,0|1,0,0]=3 1828 B11R1.166 O=C(O)C1=CC=C(F)N=C1Cl C41936 [0,2,0,0,0,0|1,0,0]=3 1829 B11R1.166 O=C(O)C1=CC=C(F)N=C1F D41950 [0,2,0,0,0,0|1,0,0]=3 1830 B11R1.166 O=C(O)C1=CC=C(O)N=C1Cl C23393 [0,2,0,0,0,0|1,0,0]=3 1831 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Br D41896 [0,2,0,0,0,0|1,0,0]=3 1832 B11R1.166 O=C(O)C1=CN=C(Br)C=C1Cl B41906 [0,2,0,0,0,0|1,0,0]=3 1833 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl D25092 [0,2,0,0,0,0|1,0,0]=3 1834 B11R1.166 O=C(O)C1=CNC(=S)NC1=O X40764 [0,2,0,0,0,0|2,0,0]=4 1835 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl B5199 [0,2,0,0,0,0|1,0,0]=3 1836 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F B5198 [0,2,0,0,0,0|1,0,0]=3 1837 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F C5197 [0,2,0,0,0,0|1,0,0]=3 1838 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl D11543 [0,2,0,0,0,0|2,0,0]=4 1839 B11R1.166 O=C1C=C(O)C(C(=O)O)=CN1 H42617 [0,2,0,0,0,0|1,0,0]=3 1840 B11R1.166 O=C1C=C(O)C(C(=O)O)=NN1 H40766 [0,2,0,0,0,0|2,0,0]=4 1841 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 D10886 [0,2,0,0,0,0|2,0,0]=4 1842 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(Br)C=C1 D24039 [0,2,0,0,0,0|1,0,1]=4 1843 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(Cl)C=C1 B41913 [0,2,0,0,0,0|1,0,1]=4 1844 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(F)C=C1 B41922 [0,2,0,0,0,0|1,0,1]=4 1845 B11R1.166 O=[N+]([O-])C1=C(Br)C=C(O)C=C1 B42262 [0,2,0,0,0,0|1,0,1]=4 1846 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(Br)C=C1 B26267 [0,2,0,0,0,0|1,0,1]=4 1847 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(F)C=C1 C37922 [0,2,0,0,0,0|1,0,1]=4 1848 B11R1.166 O=[N+]([O-])C1=C(Cl)C=C(O)C=C1 C42269 [0,2,0,0,0,0|1,0,1]=4 1849 B11R1.166 O=[N+]([O-])C1=C(F)C=C(Br)C=C1 B41916 [0,2,0,0,0,0|1,0,1]=4 1850 B11R1.166 O=[N+]([O-])C1=C(F)C=C(Cl)C=C1 C41940 [0,2,0,0,0,0|1,0,1]=4 1851 B11R1.166 O=[N+]([O-])C1=C(F)C=C(F)C=C1 D69300 [0,2,0,0,0,0|1,0,1]=4 1852 B11R1.166 O=[N+]([O-])C1=C(F)C=C(I)C=C1 F37793 [0,2,0,0,0,0|1,0,1]=4 1853 B11R1.166 O=[N+]([O-])C1=C(F)C=C(O)C=C1 F67845 [0,2,0,0,0,0|1,0,1]=4 1854 B11R1.166 O=[N+]([O-])C1=C(I)C=C(Cl)C=C1 C37881 [0,2,0,0,0,0|1,0,1]=4 1855 B11R1.166 O=[N+]([O-])C1=C(I)C=C(F)C=C1 F41957 [0,2,0,0,0,0|1,0,1]=4 1856 B11R1.166 O=[N+]([O-])C1=C(I)C=C(O)C=C1 K42284 [0,2,0,0,0,0|1,0,1]=4 1857 B11R1.166 O=[N+]([O-])C1=C(O)C=C(Br)C=C1 B42264 [0,2,0,0,0,0|1,0,1]=4 1858 B11R1.166 O=[N+]([O-])C1=C(O)C=C(Cl)C=C1 C42271 [0,2,0,0,0,0|1,0,1]=4 1859 B11R1.166 O=[N+]([O-])C1=C(O)C=C(F)C=C1 F68100 [0,2,0,0,0,0|1,0,1]=4 1860 B11R1.166 O=[N+]([O-])C1=C(O)C=C(I)C=C1 K42285 [0,2,0,0,0,0|1,0,1]=4 1861 B11R1.166 O=[N+]([O-])C1=C(O)C=C(O)C=C1 N42613 [0,2,0,0,0,0|1,0,1]=4 1862 B11R1.166 OB(O)C1=C(Cl)C=C(Br)C=C1 B42684 [0,2,0,0,0,0|1,0,1]=4 1863 B11R1.166 OB(O)C1=C(Cl)C=C(Cl)C=C1 D2500 [0,2,0,0,0,0|1,0,1]=4 1864 B11R1.166 OB(O)C1=C(Cl)C=C(F)C=C1 C42688 [0,2,0,0,0,0|1,0,1]=4 1865 B11R1.166 OB(O)C1=C(Cl)C=C(O)C=C1 C42946 [0,2,0,0,0,0|1,0,1]=4 1866 B11R1.166 OB(O)C1=C(F)C=C(Br)C=C1 B1815 [0,2,0,0,0,0|1,0,1]=4 1867 B11R1.166 OB(O)C1=C(F)C=C(Cl)C=C1 C20549 [0,2,0,0,0,0|1,0,1]=4 1868 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 D2620 [0,2,0,0,0,0|1,0,1]=4 1869 B11R1.166 OB(O)C1=C(O)C=C(F)C=C1 F3214 [0,2,0,0,0,0|1,0,1]=4 1870 B11R1.7 C#C[C@@](C)(O)C1=CC=CC=C1 P52408 [0,2,0,0,0,0|1,0,1]=4 1871 B11R1.7 C=CS(=O)(=O)C1=CC=CC=C1 V37846 [0,2,0,0,0,0|1,0,1]=4 1872 B11R1.7 COS(=O)(=O)C1=CC=CC=C1 M46268 [0,2,0,0,0,0|1,0,0]=3 1873 B11R1.7 O=S(=O)(CCl)C1=CC=CC=C1 C45914 [0,2,0,0,0,0|1,0,1]=4 1874 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 M52180 [0,2,0,0,0,0|1,0,1]=4 1875 B11R1.12 COC(OC)C1=CC=CC=C1 B69843 [0,2,0,0,0,0|0,0,2]=4 1876 B11R1.12 CO[C@@H](CO)C1=CC=CC=C1 M50282 [0,2,0,0,0,0|0,0,2]=4 1877 B11R1.12 OCC(CO)C1=CC=CC=C1 P67660 [0,2,0,0,0,0|0,0,2]=4 1878 B11R1.16 CC=CC(=O)C1=CC=CC=C1 P68339 [0,2,0,0,0,0|1,0,0]=3 1879 B11R1.16 CCCC(=O)C1=CN=CC=C1 P50020 [0,2,0,0,0,0|2,0,0]=4 1880 B11R1.16 CCCC(=O)C1=NC=CC=C1 B50017 [0,2,0,0,0,0|2,0,0]=4 1881 B11R1.16 CCOC(=N)C1=CC=NC=C1 E46648 [0,2,0,0,0,0|2,0,0]=4 1882 B11R1.16 CCOC(=O)C1=CC=NC=C1 E69401 [0,2,0,0,0,0|1,0,0]=3 1883 B11R1.16 CCOC(=O)C1=CN=CC=C1 E68695 [0,2,0,0,0,0|1,0,0]=3 1884 B11R1.16 CCOC(=O)C1=CN=NC=C1 E23449 [0,2,0,0,0,0|2,0,0]=4 1885 B11R1.16 CCOC(=O)C1=NC=CC=C1 E67964 [0,2,0,0,0,0|1,0,0]=3 1886 B11R1.16 CCOC(=O)C1=NC=CC=N1 E46004 [0,2,0,0,0,0|2,0,0]=4 1887 B11R1.16 CCOC(=O)C1=NC=CN=C1 E24926 [0,2,0,0,0,0|2,0,0]=4 1888 B11R1.16 CCOC(=O)C1=NC=NC=C1 E46000 [0,2,0,0,0,0|2,0,0]=4 1889 B11R1.16 CCO[P@@H](=O)C1=CC=CC=C1 E46942 [0,2,0,0,0,0|1,0,0]=3 1890 B11R1.16 CN(CCO)C1=CC=CC=C1 M50351 [0,2,0,0,0,0|2,0,0]=4 1891 B11R1.16 N#CCC(=O)C1=CC=CC=C1 X67635 [0,2,0,0,0,0|1,0,0]=3 1892 B11R1.16 N#CCC(=O)C1=CC=NC=C1 X47870 [0,2,0,0,0,0|2,0,0]=4 1893 B11R1.16 N#CCC(=O)C1=CN=CC=C1 X67552 [0,2,0,0,0,0|2,0,0]=4 1894 B11R1.16 N#CCC(=O)C1=NC=CC=C1 X0968 [0,2,0,0,0,0|2,0,0]=4 1895 B11R1.16 N#CC[C@H](O)C1=CC=CC=C1 H51766 [0,2,0,0,0,0|1,0,1]=4 1896 B11R1.16 NCC[C@H](O)C1=CC=CC=C1 A55426 [0,2,0,0,0,0|1,0,1]=4 1897 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 A37972 [0,2,0,0,0,0|1,0,1]=4 1898 B11R1.16 N[C@@H](CCO)C1=CC=CC=C1 A50352 [0,2,0,0,0,0|1,0,1]=4 1899 B11R1.16 N[C@H](CCO)C1=CC=CC=C1 H69256 [0,2,0,0,0,0|1,0,1]=4 1900 B11R1.16 O=C(OCCl)C1=CC=CC=C1 C48587 [0,2,0,0,0,0|0,0,0]=2 1901 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 C50162 [0,2,0,0,0,0|1,0,1]=4 1902 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 C69270 [0,2,0,0,0,0|1,0,1]=4 1903 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 C50160 [0,2,0,0,0,0|1,0,1]=4 1904 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 B52023 [0,2,0,0,0,0|1,0,0]=3 1905 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 M46653 [0,2,0,0,0,0|1,0,0]=3 1906 B11R1.23 CC1=CC=CC([C@@H](N)CO)=C1 A50349 [0,2,0,0,0,0|1,0,1]=4 1907 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A50350 [0,2,0,0,0,0|1,0,1]=4 1908 B11R1.23 CC1=CC=CC([C@H](N)CO)=C1 A52173 [0,2,0,0,0,0|1,0,1]=4 1909 B11R1.23 CCC(=O)C1=CC(O)=CC=C1 H49893 [0,2,0,0,0,0|1,0,0]=3 1910 B11R1.23 CCC(=O)C1=CC=CC(Br)=N1 B61988 [0,2,0,0,0,0|2,0,0]=4 1911 B11R1.23 CCC(=O)C1=CC=CC(F)=C1 F38669 [0,2,0,0,0,0|1,0,0]=3 1912 B11R1.23 CCC(=O)C1=NC=CC(Cl)=C1 C49039 [0,2,0,0,0,0|2,0,0]=4 1913 B11R1.23 CNC(=O)C1=CC=CC(Br)=C1 B69408 [0,2,0,0,0,0|1,0,0]=3 1914 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 C45697 [0,2,0,0,0,0|2,0,0]=4 1915 B11R1.23 CNC(=O)C1=NC=CC(Cl)=C1 C45702 [0,2,0,0,0,0|2,0,0]=4 1916 B11R1.23 COC(=O)C1=CC(=O)C=CN1 M45849 [0,2,0,0,0,0|1,0,0]=3 1917 B11R1.23 COC(=O)C1=CC(=O)N=CN1 M42791 [0,2,0,0,0,0|2,0,0]=4 1918 B11R1.23 COC(=O)C1=CC(=O)NC=C1 M1682 [0,2,0,0,0,0|1,0,0]=3 1919 B11R1.23 COC(=O)C1=CC(=O)NN=C1 M42790 [0,2,0,0,0,0|2,0,0]=4 1920 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 M12724 [0,2,0,0,0,0|1,0,0]=3 1921 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 M22704 [0,2,0,0,0,0|1,0,0]=3 1922 B11R1.23 COC(=O)C1=CC(C)=NC=C1 M67329 [0,2,0,0,0,0|1,0,0]=3 1923 B11R1.23 COC(=O)C1=CC(Cl)=CN=C1 M60826 [0,2,0,0,0,0|1,0,0]=3 1924 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 M0407 [0,2,0,0,0,0|1,0,0]=3 1925 B11R1.23 COC(=O)C1=CC(Cl)=NC=N1 M24785 [0,2,0,0,0,0|2,0,0]=4 1926 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 M11604 [0,2,0,0,0,0|2,0,0]=4 1927 B11R1.23 COC(=O)C1=CC(F)=CN=C1 M0721 [0,2,0,0,0,0|1,0,0]=3 1928 B11R1.23 COC(=O)C1=CC(F)=NC=C1 M23752 [0,2,0,0,0,0|1,0,0]=3 1929 B11R1.23 COC(=O)C1=CC(N)=CC=C1 M69084 [0,2,0,0,0,0|0,0,0]=2 1930 B11R1.23 COC(=O)C1=CC(N)=NC=C1 M4534 [0,2,0,0,0,0|1,0,0]=3 1931 B11R1.23 COC(=O)C1=CC(O)=CC=C1 M37841 [0,2,0,0,0,0|0,0,0]=2 1932 B11R1.23 COC(=O)C1=CC=CC(=O)N1 M38198 [0,2,0,0,0,0|1,0,0]=3 1933 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 M48565 [0,2,0,0,0,0|0,0,0]=2 1934 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 M22709 [0,2,0,0,0,0|1,0,0]=3 1935 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 M22864 [0,2,0,0,0,0|0,0,0]=2 1936 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 M24789 [0,2,0,0,0,0|1,0,0]=3 1937 B11R1.23 COC(=O)C1=CC=CC(F)=C1 M39493 [0,2,0,0,0,0|0,0,0]=2 1938 B11R1.23 COC(=O)C1=CC=CC(F)=N1 M23753 [0,2,0,0,0,0|1,0,0]=3 1939 B11R1.23 COC(=O)C1=CC=CC(I)=C1 M48629 [0,2,0,0,0,0|0,0,0]=2 1940 B11R1.23 COC(=O)C1=CC=NC(Br)=N1 M32126 [0,2,0,0,0,0|2,0,0]=4 1941 B11R1.23 COC(=O)C1=CC=NC(Cl)=N1 C7815 [0,2,0,0,0,0|2,0,0]=4 1942 B11R1.23 COC(=O)C1=CN=CC(Br)=N1 M38724 [0,2,0,0,0,0|2,0,0]=4 1943 B11R1.23 COC(=O)C1=CN=CC(C)=C1 M12907 [0,2,0,0,0,0|1,0,0]=3 1944 B11R1.23 COC(=O)C1=CN=CC(Cl)=N1 M0687 [0,2,0,0,0,0|2,0,0]=4 1945 B11R1.23 COC(=O)C1=CN=CC(I)=N1 M63354 [0,2,0,0,0,0|2,0,0]=4 1946 B11R1.23 COC(=O)C1=CN=CC(N)=C1 M14137 [0,2,0,0,0,0|1,0,0]=3 1947 B11R1.23 COC(=O)C1=CN=CC(O)=C1 M61635 [0,2,0,0,0,0|1,0,0]=3 1948 B11R1.23 COC(=O)C1=CN=CC(O)=C1 M9186 [0,2,0,0,0,0|1,0,0]=3 1949 B11R1.23 COC(=O)C1=NC(=O)NC=C1 M36852 [0,2,0,0,0,0|2,0,0]=4 1950 B11R1.23 COC(=O)C1=NC(C)=CC=C1 M49292 [0,2,0,0,0,0|1,0,0]=3 1951 B11R1.23 COC(=O)C1=NC(C)=CC=N1 M23011 [0,2,0,0,0,0|2,0,0]=4 1952 B11R1.23 COC(=O)C1=NC(C)=CN=C1 M46012 [0,2,0,0,0,0|2,0,0]=4 1953 B11R1.23 COC(=O)C1=NC(N)=CC=C1 M8927 [0,2,0,0,0,0|1,0,0]=3 1954 B11R1.23 COC(=O)C1=NC(N)=CN=C1 M8739 [0,2,0,0,0,0|2,0,0]=4 1955 B11R1.23 COC(=O)C1=NC(N)=NC=C1 M43110 [0,2,0,0,0,0|2,0,0]=4 1956 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 M1665 [0,2,0,0,0,0|1,0,0]=3 1957 B11R1.23 COC(=O)C1=NC=CC(C)=C1 M49276 [0,2,0,0,0,0|1,0,0]=3 1958 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 M0974 [0,2,0,0,0,0|1,0,0]=3 1959 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 M7541 [0,2,0,0,0,0|1,0,0]=3 1960 B11R1.23 COC(=O)C1=NC=CC(I)=C1 M1513 [0,2,0,0,0,0|1,0,0]=3 1961 B11R1.23 COC(=O)C1=NC=CC(N)=C1 M0975 [0,2,0,0,0,0|1,0,0]=3 1962 B11R1.23 COC(=O)C1=NC=NC(C)=C1 M14453 [0,2,0,0,0,0|2,0,0]=4 1963 B11R1.23 COC(=O)C1=NC=NC(N)=C1 M12144 [0,2,0,0,0,0|2,0,0]=4 1964 B11R1.23 COC(=O)C1=NN=CC(C)=C1 M27709 [0,2,0,0,0,0|2,0,0]=4 1965 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 C0409 [0,2,0,0,0,0|2,0,0]=4 1966 B11R1.23 NNC(=O)C1=CC=CC(Br)=C1 B45685 [0,2,0,0,0,0|1,0,0]=3 1967 B11R1.23 NNC(=O)C1=CC=CC(Cl)=C1 C45694 [0,2,0,0,0,0|1,0,0]=3 1968 B11R1.23 NNC(=O)C1=NC(O)=CC=C1 H43104 [0,2,0,0,0,0|2,0,0]=4 1969 B11R1.23 N[C@@H](CO)C1=CC=CC(Br)=C1 A46787 [0,2,0,0,0,0|1,0,1]=4 1970 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46801 [0,2,0,0,0,0|1,0,1]=4 1971 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A46803 [0,2,0,0,0,0|1,0,1]=4 1972 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A64410 [0,2,0,0,0,0|1,0,1]=4 1973 B11R1.23 N[C@@H](CO)C1=CC=CC(Cl)=C1 A66336 [0,2,0,0,0,0|1,0,1]=4 1974 B11R1.23 N[C@@H](CO)C1=CC=CC(F)=C1 A49514 [0,2,0,0,0,0|1,0,1]=4 1975 B11R1.23 N[C@@H](CO)C1=CC=CC(O)=C1 A49526 [0,2,0,0,0,0|1,0,1]=4 1976 B11R1.23 N[C@H](CO)C1=CC=CC(Br)=C1 A46799 [0,2,0,0,0,0|1,0,1]=4 1977 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46804 [0,2,0,0,0,0|1,0,1]=4 1978 B11R1.23 N[C@H](CO)C1=CC=CC(Cl)=C1 A46810 [0,2,0,0,0,0|1,0,1]=4 1979 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A46820 [0,2,0,0,0,0|1,0,1]=4 1980 B11R1.23 N[C@H](CO)C1=CC=CC(F)=C1 A49516 [0,2,0,0,0,0|1,0,1]=4 1981 B11R1.23 N[C@H](CO)C1=CC=CC(I)=C1 A11985 [0,2,0,0,0,0|1,0,1]=4 1982 B11R1.23 N\C(=N/O)C1=CC=CC(Br)=C1 B64571 [0,2,0,0,0,0|1,0,0]=3 1983 B11R1.23 O=C(CBr)C1=CC(Cl)=CC=C1 B48248 [0,2,0,0,0,0|1,0,0]=3 1984 B11R1.23 O=C(CBr)C1=CC(F)=CC=C1 B48255 [0,2,0,0,0,0|1,0,0]=3 1985 B11R1.23 O=C(CBr)C1=CC(O)=CC=C1 B68743 [0,2,0,0,0,0|1,0,0]=3 1986 B11R1.23 O=C(CBr)C1=CC=CC(Br)=C1 B68490 [0,2,0,0,0,0|1,0,0]=3 1987 B11R1.23 O=CC(=O)C1=CC=CC(F)=C1 F63112 [0,2,0,0,0,0|0,0,1]=3 1988 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 C49388 [0,2,0,0,0,0|0,0,2]=4 1989 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 C36827 [0,2,0,0,0,0|1,0,1]=4 1990 B11R1.222 CCC(=O)C1=C(C)C=CC=C1 M52778 [0,2,0,0,0,0|1,0,0]=3 1991 B11R1.222 CCC(=O)C1=C(Cl)C=CC=C1 C52038 [0,2,0,0,0,0|1,0,0]=3 1992 B11R1.222 CCC(=O)C1=C(O)C=CC=C1 H39530 [0,2,0,0,0,0|1,0,0]=3 1993 B11R1.222 CNC(=O)C1=C(Br)C=CC=C1 B49022 [0,2,0,0,0,0|1,0,0]=3 1994 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 A67666 [0,2,0,0,0,0|1,0,0]=3 1995 B11R1.222 CNC(=O)C1=C(N)C=CN=C1 A46341 [0,2,0,0,0,0|2,0,0]=4 1996 B11R1.222 CNC(=O)C1=C(N)N=CC=C1 A46340 [0,2,0,0,0,0|2,0,0]=4 1997 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 M64518 [0,2,0,0,0,0|1,0,0]=3 1998 B11R1.222 CNC(=O)C1=NC=CC=C1O H46003 [0,2,0,0,0,0|2,0,0]=4 1999 B11R1.222 COC(=O)C1=C(Br)C=CC=C1 M39488 [0,2,0,0,0,0|0,0,0]=2 2000 B11R1.222 COC(=O)C1=C(Br)C=CC=N1 M14100 [0,2,0,0,0,0|1,0,0]=3 2001 B11R1.222 COC(=O)C1=C(Br)C=NC=C1 M12636 [0,2,0,0,0,0|1,0,0]=3 2002 B11R1.222 COC(=O)C1=C(Br)C=NC=N1 M37068 [0,2,0,0,0,0|2,0,0]=4 2003 B11R1.222 COC(=O)C1=C(C)C=CC=C1 M39531 [0,2,0,0,0,0|0,0,0]=2 2004 B11R1.222 COC(=O)C1=C(C)C=CN=C1 M38020 [0,2,0,0,0,0|1,0,0]=3 2005 B11R1.222 COC(=O)C1=C(C)C=NC=C1 M11262 [0,2,0,0,0,0|1,0,0]=3 2006 B11R1.222 COC(=O)C1=C(C)C=NN=C1 M11606 [0,2,0,0,0,0|2,0,0]=4 2007 B11R1.222 COC(=O)C1=C(C)N=CC=C1 M11023 [0,2,0,0,0,0|1,0,0]=3 2008 B11R1.222 COC(=O)C1=C(Cl)C=CC=N1 M45351 [0,2,0,0,0,0|1,0,0]=3 2009 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 M45369 [0,2,0,0,0,0|1,0,0]=3 2010 B11R1.222 COC(=O)C1=C(Cl)C=NC=C1 M45356 [0,2,0,0,0,0|1,0,0]=3 2011 B11R1.222 COC(=O)C1=C(F)C=CC=C1 M69073 [0,2,0,0,0,0|0,0,0]=2 2012 B11R1.222 COC(=O)C1=C(F)C=CC=N1 M25907 [0,2,0,0,0,0|1,0,0]=3 2013 B11R1.222 COC(=O)C1=C(F)C=NC=C1 M1911 [0,2,0,0,0,0|1,0,0]=3 2014 B11R1.222 COC(=O)C1=C(I)C=CC=C1 M67835 [0,2,0,0,0,0|0,0,0]=2 2015 B11R1.222 COC(=O)C1=C(I)C=CC=N1 M45391 [0,2,0,0,0,0|1,0,0]=3 2016 B11R1.222 COC(=O)C1=C(I)C=NC=C1 M10415 [0,2,0,0,0,0|1,0,0]=3 2017 B11R1.222 COC(=O)C1=C(N)C=CN=C1 A1097 [0,2,0,0,0,0|1,0,0]=3 2018 B11R1.222 COC(=O)C1=C(N)C=NC=C1 M0549 [0,2,0,0,0,0|1,0,0]=3 2019 B11R1.222 COC(=O)C1=C(N)N=CC=C1 M27310 [0,2,0,0,0,0|1,0,0]=3 2020 B11R1.222 COC(=O)C1=C(O)C=NC=C1 M15996 [0,2,0,0,0,0|1,0,0]=3 2021 B11R1.222 COC(=O)C1=C(O)N=CC=C1 M38592 [0,2,0,0,0,0|1,0,0]=3 2022 B11R1.222 COC(=O)C1=C(O)N=CN=C1 M38540 [0,2,0,0,0,0|2,0,0]=4 2023 B11R1.222 COC(=O)C1=C(S)C=CC=C1 M69035 [0,2,0,0,0,0|0,0,0]=2 2024 B11R1.222 COC(=O)C1=CC=CN=C1Br M24089 [0,2,0,0,0,0|1,0,0]=3 2025 B11R1.222 COC(=O)C1=CC=CN=C1Cl M0433 [0,2,0,0,0,0|1,0,0]=3 2026 B11R1.222 COC(=O)C1=CC=CN=C1F M45374 [0,2,0,0,0,0|1,0,0]=3 2027 B11R1.222 COC(=O)C1=CC=CNC1=O M45848 [0,2,0,0,0,0|1,0,0]=3 2028 B11R1.222 COC(=O)C1=CC=NNC1=O X14720 [0,2,0,0,0,0|2,0,0]=4 2029 B11R1.222 COC(=O)C1=CNC=CC1=O M36878 [0,2,0,0,0,0|1,0,0]=3 2030 B11R1.222 COC(=O)C1=NC=CC=C1C M24449 [0,2,0,0,0,0|1,0,0]=3 2031 B11R1.222 COC(=O)C1=NC=CC=C1N M23281 [0,2,0,0,0,0|1,0,0]=3 2032 B11R1.222 COC(=O)C1=NC=CN=C1Br B12295 [0,2,0,0,0,0|2,0,0]=4 2033 B11R1.222 COC(=O)C1=NC=CN=C1C M23587 [0,2,0,0,0,0|2,0,0]=4 2034 B11R1.222 COC(=O)C1=NC=CN=C1Cl C0683 [0,2,0,0,0,0|2,0,0]=4 2035 B11R1.222 COC(=O)C1=NC=CN=C1I M37787 [0,2,0,0,0,0|2,0,0]=4 2036 B11R1.222 COC(=O)C1=NC=CN=C1N M20687 [0,2,0,0,0,0|2,0,0]=4 2037 B11R1.222 COC(=O)C1=NC=CN=C1O M42789 [0,2,0,0,0,0|2,0,0]=4 2038 B11R1.222 N#CC(=O)C1=C(F)C=CC=C1 F47445 [0,2,0,0,0,0|1,0,0]=3 2039 B11R1.222 NCC(=O)C1=C(F)C=CC=C1 A69482 [0,2,0,0,0,0|1,0,0]=3 2040 B11R1.222 NNC(=O)C1=C(Cl)C=CC=C1 C45693 [0,2,0,0,0,0|1,0,0]=3 2041 B11R1.222 NNC(=O)C1=C(F)C=CC=C1 F45704 [0,2,0,0,0,0|1,0,0]=3 2042 B11R1.222 N[C@H](CO)C1=C(Cl)C=CC=C1 A46809 [0,2,0,0,0,0|1,0,1]=4 2043 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A46819 [0,2,0,0,0,0|1,0,1]=4 2044 B11R1.222 N[C@H](CO)C1=C(F)C=CC=C1 A49515 [0,2,0,0,0,0|1,0,1]=4 2045 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 B60597 [0,2,0,0,0,0|1,0,0]=3 2046 B11R1.222 O=C(CBr)C1=C(F)C=CC=C1 B48254 [0,2,0,0,0,0|1,0,0]=3 2047 B11R1.222 O=C(CBr)C1=C(O)C=CC=C1 B48582 [0,2,0,0,0,0|1,0,0]=3 2048 B11R1.222 O=C(CF)C1=C(F)C=CC=C1 F48290 [0,2,0,0,0,0|1,0,0]=3 2049 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 B50146 [0,2,0,0,0,0|1,0,1]=4 2050 B11R1.87 CC(C)(O)C1=C(N)C=CC=C1 A36729 [0,2,0,0,0,0|1,0,1]=4 2051 B11R1.87 CC1=C(S(=O)(=O)O)C=CC=C1 M46272 [0,2,0,0,0,0|1,0,0]=3 2052 B11R1.87 CC1=C(S(=O)(=O)O)C=NC=C1 M43167 [0,2,0,0,0,0|2,0,0]=4 2053 B11R1.87 CC1=CC=CN=C1S(=O)(=O)O M43170 [0,2,0,0,0,0|2,0,0]=4 2054 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 A47013 [0,2,0,0,0,0|2,0,0]=4 2055 B11R1.87 CS(=O)(=O)C1=C(N)C=CC=C1 M61771 [0,2,0,0,0,0|1,0,1]=4 2056 B11R1.87 NC1=C(S(=O)(=O)Cl)C=CC=C1 A42864 [0,2,0,0,0,0|1,0,1]=4 2057 B11R1.87 NS(=O)(=O)C1=C(Br)C=CC=C1 B42856 [0,2,0,0,0,0|1,0,1]=4 2058 B11R1.87 NS(=O)(=O)C1=C(F)C=CC=C1 F67903 [0,2,0,0,0,0|1,0,1]=4 2059 B11R1.87 O=S(=O)(Cl)C1=C(F)C=CC=C1 F39248 [0,2,0,0,0,0|1,0,1]=4 2060 B11R1.87 O=S(=O)(F)C1=C(F)C=CC=C1 F42323 [0,2,0,0,0,0|1,0,1]=4 2061 B11R1.87 O=S(=O)(O)C1=C(I)C=CC=C1 K42719 [0,2,0,0,0,0|1,0,0]=3 2062 B11R1.87 O=S(=O)(O)C1=C(O)C=CN=C1 H41004 [0,2,0,0,0,0|2,0,0]=4 2063 B11R1.87 O=S(=O)([O-])C1=C(I)C=CC=C1 S62810 [0,2,0,0,0,0|1,0,1]=4 2064 B11R1.155 CC(C)(O)C1=CC=CC(Br)=C1 B50147 [0,2,0,0,0,0|1,0,1]=4 2065 B11R1.155 CC1=CC(S(=O)(=O)O)=CN=C1 M43168 [0,2,0,0,0,0|2,0,0]=4 2066 B11R1.155 CS(=O)(=O)C1=CC(F)=CC=C1 F45921 [0,2,0,0,0,0|1,0,1]=4 2067 B11R1.155 CS(=O)(=O)C1=CC(N)=CC=C1 M46414 [0,2,0,0,0,0|1,0,1]=4 2068 B11R1.155 CS(=O)(=O)C1=CC=CC(Br)=C1 B61603 [0,2,0,0,0,0|1,0,1]=4 2069 B11R1.155 NC1=CC=CC(S(N)(=O)=O)=C1 A7019 [0,2,0,0,0,0|1,0,1]=4 2070 B11R1.155 NS(=O)(=O)C1=CC=CC(Br)=C1 B42857 [0,2,0,0,0,0|1,0,1]=4 2071 B11R1.155 O=S(=O)(Cl)C1=CC(Cl)=CC=C1 C42319 [0,2,0,0,0,0|1,0,1]=4 2072 B11R1.155 O=S(=O)(Cl)C1=CC(F)=CC=C1 F42321 [0,2,0,0,0,0|1,0,1]=4 2073 B11R1.155 O=S(=O)(Cl)C1=CC=CC(Br)=C1 B42315 [0,2,0,0,0,0|1,0,1]=4 2074 B11R1.53 C#CC1=C(C(=O)O)C=CC=C1 E36717 [0,2,0,0,0,0|0,0,0]=2 2075 B11R1.53 C#CC1=C([N+](=O)[O-])C=CC=C1 E38250 [0,2,0,0,0,0|1,0,1]=4 2076 B11R1.53 C=CC1=C(B(O)O)C=CC=C1 V5638 [0,2,0,0,0,0|1,0,1]=4 2077 B11R1.53 CC(=O)C1=C(C#N)C=CC=C1 A26401 [0,2,0,0,0,0|1,0,0]=3 2078 B11R1.53 CCC1=C(B(O)O)C=CC=C1 E3120 [0,2,0,0,0,0|1,0,1]=4 2079 B11R1.53 CCC1=C(C(=O)O)C=CC=C1 E49881 [0,2,0,0,0,0|0,0,0]=2 2080 B11R1.53 CCC1=C(C(=O)O)C=CC=N1 E49269 [0,2,0,0,0,0|1,0,0]=3 2081 B11R1.53 CCC1=C(C(=O)O)C=CN=C1 E49275 [0,2,0,0,0,0|1,0,0]=3 2082 B11R1.53 CCC1=C(C(=O)O)C=NC=C1 E49270 [0,2,0,0,0,0|1,0,0]=3 2083 B11R1.53 CNC1=C(C(C)=O)C=CC=C1 M38276 [0,2,0,0,0,0|1,0,0]=3 2084 B11R1.53 CNC1=C([N+](=O)[O-])C=CC=C1 M60711 [0,2,0,0,0,0|1,0,1]=4 2085 B11R1.53 COC1=C(B(O)O)C=CC=C1 M4260 [0,2,0,0,0,0|1,0,1]=4 2086 B11R1.53 COC1=C(C(=O)O)C=CC=N1 M12720 [0,2,0,0,0,0|1,0,0]=3 2087 B11R1.53 COC1=C(C(=O)O)C=NC=C1 M45835 [0,2,0,0,0,0|1,0,0]=3 2088 B11R1.53 COC1=C(C(=O)O)C=NC=N1 M25068 [0,2,0,0,0,0|2,0,0]=4 2089 B11R1.53 COC1=C(C(C)=O)C=CC=N1 M49287 [0,2,0,0,0,0|2,0,0]=4 2090 B11R1.53 COC1=C(C(C)=O)C=CN=C1 M49288 [0,2,0,0,0,0|2,0,0]=4 2091 B11R1.53 COC1=C(C(C)=O)C=NC=C1 M29754 [0,2,0,0,0,0|2,0,0]=4 2092 B11R1.53 COC1=C(C(N)=O)C=CC=C1 M60565 [0,2,0,0,0,0|1,0,0]=3 2093 B11R1.53 COC1=CC=CN=C1C(=O)O M45833 [0,2,0,0,0,0|1,0,0]=3 2094 B11R1.53 COC1=CC=CN=C1C(C)=O M27805 [0,2,0,0,0,0|2,0,0]=4 2095 B11R1.53 COC1=NC=CN=C1C(=O)O M42787 [0,2,0,0,0,0|2,0,0]=4 2096 B11R1.53 CSC1=C(B(O)O)C=CC=C1 M4620 [0,2,0,0,0,0|1,0,1]=4 2097 B11R1.53 CSC1=C(C(=O)O)C=CC=C1 M69034 [0,2,0,0,0,0|0,0,0]=2 2098 B11R1.53 CSC1=C([N+](=O)[O-])C=CC=C1 M45826 [0,2,0,0,0,0|1,0,1]=4 2099 B11R1.53 CSC1=NC=CC=C1C(=O)O M62219 [0,2,0,0,0,0|1,0,0]=3 2100 B11R1.53 C[C@H](O)C1=C(C#N)C=CC=C1 H51759 [0,2,0,0,0,0|1,0,1]=4 2101 B11R1.53 N#CC1=C(B(O)O)C=CC=C1 C2320 [0,2,0,0,0,0|1,0,1]=4 2102 B11R1.53 N#CC1=C(C(=O)O)C=NC=C1 C11202 [0,2,0,0,0,0|1,0,0]=3 2103 B11R1.53 N#CC1=C([N+](=O)[O-])C=CC=C1 N44348 [0,2,0,0,0,0|1,0,1]=4 2104 B11R1.53 N#CC1=CC=CN=C1C(=O)O C11201 [0,2,0,0,0,0|1,0,0]=3 2105 B11R1.53 NCC1=C(B(O)O)C=CC=C1 A46469 [0,2,0,0,0,0|1,0,1]=4 2106 B11R1.53 NCC1=C(B(O)O)C=CC=C1 A69207 [0,2,0,0,0,0|1,0,1]=4 2107 B11R1.53 NNC1=C(C(=O)O)C=CC=C1 H46555 [0,2,0,0,0,0|0,0,0]=2 2108 B11R1.53 O=C(O)C1=C(CCl)C=CC=C1 C48588 [0,2,0,0,0,0|0,0,0]=2 2109 B11R1.53 O=C(O)C1=C(CO)C=CC=C1 H49093 [0,2,0,0,0,0|0,0,0]=2 2110 B11R1.53 O=CC1=C(C(=O)O)C=NC=C1 F59858 [0,2,0,0,0,0|1,0,0]=3 2111 B11R1.53 O=[N+]([O-])C1=C(CBr)C=CC=C1 B45332 [0,2,0,0,0,0|1,0,1]=4 2112 B11R1.53 O=[N+]([O-])C1=C(CO)C=CC=C1 N68868 [0,2,0,0,0,0|1,0,1]=4 2113 B11R1.53 OB(O)C1=C(CBr)C=CC=C1 B46233 [0,2,0,0,0,0|1,0,1]=4 2114 B11R1.53 OCC1=C(B(O)O)C=CC=C1 H46444 [0,2,0,0,0,0|1,0,1]=4 2115 B11R1.156 CC(=O)C1=C(Br)C=CC=C1F B48252 [0,2,0,0,0,0|1,0,0]=3 2116 B11R1.156 CC(=O)C1=C(Br)C=CC=C1N A38400 [0,2,0,0,0,0|1,0,0]=3 2117 B11R1.156 CC(=O)C1=C(Br)C=CC=C1O B24263 [0,2,0,0,0,0|1,0,0]=3 2118 B11R1.156 CC(=O)C1=C(Br)C=NC=C1F B37065 [0,2,0,0,0,0|2,0,0]=4 2119 B11R1.156 CC(=O)C1=C(C)C=CC=C1C D52784 [0,2,0,0,0,0|1,0,0]=3 2120 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1Cl D48271 [0,2,0,0,0,0|1,0,0]=3 2121 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1F C48278 [0,2,0,0,0,0|1,0,0]=3 2122 B11R1.156 CC(=O)C1=C(Cl)C=CC=C1O C48601 [0,2,0,0,0,0|1,0,0]=3 2123 B11R1.156 CC(=O)C1=C(F)C=CC=C1F D19087 [0,2,0,0,0,0|1,0,0]=3 2124 B11R1.156 CC(=O)C1=C(F)C=CC=C1N A49050 [0,2,0,0,0,0|1,0,0]=3 2125 B11R1.156 CC(=O)C1=C(F)C=CC=C1O F48624 [0,2,0,0,0,0|1,0,0]=3 2126 B11R1.156 CC(=O)C1=C(O)C=CC=C1C H49900 [0,2,0,0,0,0|1,0,0]=3 2127 B11R1.156 CC1=CC=CC(Br)=C1C(=O)O B48568 [0,2,0,0,0,0|0,0,0]=2 2128 B11R1.156 CC1=CC=CC(Br)=C1[N+](=O)[O-] B12690 [0,2,0,0,0,0|1,0,1]=4 2129 B11R1.156 CC1=CC=CC(C)=C1B(O)O D37725 [0,2,0,0,0,0|1,0,1]=4 2130 B11R1.156 CC1=CC=CC(C)=C1C(=O)O D49883 [0,2,0,0,0,0|0,0,0]=2 2131 B11R1.156 CC1=CC=CC(Cl)=C1C(=O)O C13764 [0,2,0,0,0,0|0,0,0]=2 2132 B11R1.156 CC1=CC=CC(Cl)=C1[N+](=O)[O-] C45350 [0,2,0,0,0,0|1,0,1]=4 2133 B11R1.156 CC1=CC=CC(F)=C1C(=O)O F48612 [0,2,0,0,0,0|0,0,0]=2 2134 B11R1.156 CC1=CC=CC(F)=C1C(N)=O F49048 [0,2,0,0,0,0|1,0,0]=3 2135 B11R1.156 CC1=CC=CC(F)=C1[N+](=O)[O-] F15723 [0,2,0,0,0,0|1,0,1]=4 2136 B11R1.156 CC1=CC=CC(N)=C1[N+](=O)[O-] M45992 [0,2,0,0,0,0|1,0,1]=4 2137 B11R1.156 CC1=CC=CC(O)=C1C(=O)O H67526 [0,2,0,0,0,0|0,0,0]=2 2138 B11R1.156 CC1=CC=CC(O)=C1[N+](=O)[O-] N67754 [0,2,0,0,0,0|1,0,1]=4 2139 B11R1.156 CC1=CN=CC(F)=C1C(=O)O F37437 [0,2,0,0,0,0|1,0,0]=3 2140 B11R1.156 C[C@H](O)C1=C(Br)C=CC=C1F B49138 [0,2,0,0,0,0|1,0,1]=4 2141 B11R1.156 C[C@H](O)C1=C(F)C=CC=C1F D49154 [0,2,0,0,0,0|1,0,1]=4 2142 B11R1.156 NC(=O)C1=C(Br)C=CC=C1F B45031 [0,2,0,0,0,0|1,0,0]=3 2143 B11R1.156 NC(=O)C1=C(Br)C=NC=C1F B42130 [0,2,0,0,0,0|2,0,0]=4 2144 B11R1.156 NC(=O)C1=C(F)C=CC=C1F D60799 [0,2,0,0,0,0|1,0,0]=3 2145 B11R1.156 NC1=C(C(=O)O)C(Br)=NC=C1 A32410 [0,2,0,0,0,0|1,0,0]=3 2146 B11R1.156 NC1=C(C(=O)O)C(Cl)=NC=C1 A14052 [0,2,0,0,0,0|1,0,0]=3 2147 B11R1.156 NC1=CC=CC(Br)=C1C(=O)O A37876 [0,2,0,0,0,0|0,0,0]=2 2148 B11R1.156 NC1=CC=CC(Br)=C1[N+](=O)[O-] B42384 [0,2,0,0,0,0|1,0,1]=4 2149 B11R1.156 NC1=CC=CC(Cl)=C1C(=O)O C64945 [0,2,0,0,0,0|0,0,0]=2 2150 B11R1.156 NC1=CC=CC(Cl)=C1[N+](=O)[O-] C42399 [0,2,0,0,0,0|1,0,1]=4 2151 B11R1.156 NC1=CC=CC(F)=C1C(=O)O A67399 [0,2,0,0,0,0|0,0,0]=2 2152 B11R1.156 NC1=CC=CC(F)=C1[N+](=O)[O-] F42416 [0,2,0,0,0,0|1,0,1]=4 2153 B11R1.156 NC1=CC=CC(I)=C1C(=O)O A61453 [0,2,0,0,0,0|0,0,0]=2 2154 B11R1.156 NC1=CC=CC(O)=C1C(=O)O A45839 [0,2,0,0,0,0|0,0,0]=2 2155 B11R1.156 NC1=NC=CC(Cl)=C1C(=O)O A36737 [0,2,0,0,0,0|1,0,0]=3 2156 B11R1.156 O=C(Cl)C1=C(Br)C=CC=C1F B44230 [0,2,0,0,0,0|1,0,0]=3 2157 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Br D38594 [0,2,0,0,0,0|0,0,0]=2 2158 B11R1.156 O=C(O)C1=C(Br)C=CC=C1Cl B44566 [0,2,0,0,0,0|0,0,0]=2 2159 B11R1.156 O=C(O)C1=C(Br)C=CC=C1F B8160 [0,2,0,0,0,0|0,0,0]=2 2160 B11R1.156 O=C(O)C1=C(Br)C=CN=C1Cl B62153 [0,2,0,0,0,0|1,0,0]=3 2161 B11R1.156 O=C(O)C1=C(Br)C=NC=C1Br D41903 [0,2,0,0,0,0|1,0,0]=3 2162 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F B26886 [0,2,0,0,0,0|1,0,0]=3 2163 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Cl D39338 [0,2,0,0,0,0|0,0,0]=2 2164 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1F C69007 [0,2,0,0,0,0|0,0,0]=2 2165 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1O C45117 [0,2,0,0,0,0|0,0,0]=2 2166 B11R1.156 O=C(O)C1=C(Cl)C=CN=C1Cl D5171 [0,2,0,0,0,0|1,0,0]=3 2167 B11R1.156 O=C(O)C1=C(Cl)C=NC=C1Cl D41931 [0,2,0,0,0,0|1,0,0]=3 2168 B11R1.156 O=C(O)C1=C(Cl)N=CN=C1Cl D40473 [0,2,0,0,0,0|2,0,0]=4 2169 B11R1.156 O=C(O)C1=C(F)C=CC=C1O F45122 [0,2,0,0,0,0|0,0,0]=2 2170 B11R1.156 O=C(O)C1=C(F)C=CN=C1Cl C38693 [0,2,0,0,0,0|1,0,0]=3 2171 B11R1.156 O=C(O)C1=C(F)C=CN=C1O F42282 [0,2,0,0,0,0|1,0,0]=3 2172 B11R1.156 O=C(O)C1=C(F)C=NC=C1F D9064 [0,2,0,0,0,0|1,0,0]=3 2173 B11R1.156 O=C(O)C1=C(I)C=CC=C1Br B61212 [0,2,0,0,0,0|0,0,0]=2 2174 B11R1.156 O=C(O)C1=C(I)C=CC=C1Cl C37397 [0,2,0,0,0,0|0,0,0]=2 2175 B11R1.156 O=C(O)C1=C(I)C=CC=C1F F44614 [0,2,0,0,0,0|0,0,0]=2 2176 B11R1.156 O=C(O)C1=C(I)C=CN=C1F F41952 [0,2,0,0,0,0|1,0,0]=3 2177 B11R1.156 O=C([O-])C1=C(Cl)C=CC=C1Cl S44203 [0,2,0,0,0,0|0,0,1]=3 2178 B11R1.156 O=C([O-])C1=C(F)C=CC=C1F S39423 [0,2,0,0,0,0|0,0,1]=3 2179 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Br D41900 [0,2,0,0,0,0|1,0,1]=4 2180 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1Cl B41910 [0,2,0,0,0,0|1,0,1]=4 2181 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1F B41920 [0,2,0,0,0,0|1,0,1]=4 2182 B11R1.156 O=[N+]([O-])C1=C(Br)C=CC=C1O B38832 [0,2,0,0,0,0|1,0,1]=4 2183 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1Cl D41929 [0,2,0,0,0,0|1,0,1]=4 2184 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1F C41934 [0,2,0,0,0,0|1,0,1]=4 2185 B11R1.156 O=[N+]([O-])C1=C(Cl)C=CC=C1O C42268 [0,2,0,0,0,0|1,0,1]=4 2186 B11R1.156 O=[N+]([O-])C1=C(F)C=CC=C1F D37853 [0,2,0,0,0,0|1,0,1]=4 2187 B11R1.156 O=[N+]([O-])C1=C(F)C=CC=C1O F42280 [0,2,0,0,0,0|1,0,1]=4 2188 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1Cl C61776 [0,2,0,0,0,0|1,0,1]=4 2189 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1F F41954 [0,2,0,0,0,0|1,0,1]=4 2190 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1O K63779 [0,2,0,0,0,0|1,0,1]=4 2191 B11R1.156 O=[N+]([O-])C1=C(O)C=CC=C1O N42612 [0,2,0,0,0,0|1,0,1]=4 2192 B11R1.156 OB(O)C1=C(Br)C=CC=C1F B42686 [0,2,0,0,0,0|1,0,1]=4 2193 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl D2540 [0,2,0,0,0,0|1,0,1]=4 2194 B11R1.156 OB(O)C1=C(Cl)C=CC=C1F C42692 [0,2,0,0,0,0|1,0,1]=4 2195 B11R1.156 OB(O)C1=C(F)C=CC=C1F D2660 [0,2,0,0,0,0|1,0,1]=4 2196 B11R1.156 OB(O)C1=C(F)C=CC=C1O F42952 [0,2,0,0,0,0|1,0,1]=4 2197 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 D52783 [0,2,0,0,0,0|1,0,0]=3 2198 B11R1.159 CC(=O)C1=C(C)C(O)=CC=C1 H49901 [0,2,0,0,0,0|1,0,0]=3 2199 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 F52047 [0,2,0,0,0,0|1,0,0]=3 2200 B11R1.159 CC(=O)C1=C(N)C(O)=CC=C1 A61143 [0,2,0,0,0,0|1,0,0]=3 2201 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 H27971 [0,2,0,0,0,0|1,0,0]=3 2202 B11R1.159 CC(=O)C1=C(O)C(N)=CC=C1 A69212 [0,2,0,0,0,0|1,0,0]=3 2203 B11R1.159 CC(=O)C1=CC=CC(Br)=C1F B14139 [0,2,0,0,0,0|1,0,0]=3 2204 B11R1.159 CC(=O)C1=CC=CC(Br)=C1O B48580 [0,2,0,0,0,0|1,0,0]=3 2205 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1Cl D48270 [0,2,0,0,0,0|1,0,0]=3 2206 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1F C69015 [0,2,0,0,0,0|1,0,0]=3 2207 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1N A49036 [0,2,0,0,0,0|1,0,0]=3 2208 B11R1.159 CC(=O)C1=CC=CC(Cl)=C1O C48602 [0,2,0,0,0,0|1,0,0]=3 2209 B11R1.159 CC(=O)C1=CC=CC(F)=C1Br B48251 [0,2,0,0,0,0|1,0,0]=3 2210 B11R1.159 CC(=O)C1=CC=CC(F)=C1Cl C48276 [0,2,0,0,0,0|1,0,0]=3 2211 B11R1.159 CC(=O)C1=CC=CC(F)=C1F D48286 [0,2,0,0,0,0|1,0,0]=3 2212 B11R1.159 CC(=O)C1=CC=CC(F)=C1O F61654 [0,2,0,0,0,0|1,0,0]=3 2213 B11R1.159 CC(=O)C1=CC=CC(N)=C1F A49051 [0,2,0,0,0,0|1,0,0]=3 2214 B11R1.159 CC1=C(B(O)O)C=CC=C1N A46470 [0,2,0,0,0,0|1,0,1]=4 2215 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O B48569 [0,2,0,0,0,0|0,0,0]=2 2216 B11R1.159 CC1=C(Br)C=CC=C1[N+](=O)[O-] B24235 [0,2,0,0,0,0|1,0,1]=4 2217 B11R1.159 CC1=C(Br)C=CN=C1C(=O)O B45335 [0,2,0,0,0,0|1,0,0]=3 2218 B11R1.159 CC1=C(C(=O)O)C=CC=C1N A39516 [0,2,0,0,0,0|0,0,0]=2 2219 B11R1.159 CC1=C(C(=O)O)C=CC=C1O H69264 [0,2,0,0,0,0|0,0,0]=2 2220 B11R1.159 CC1=C(C(=O)O)C=CN=C1Br B63227 [0,2,0,0,0,0|1,0,0]=3 2221 B11R1.159 CC1=C(C(=O)O)C=CN=C1Cl C61352 [0,2,0,0,0,0|1,0,0]=3 2222 B11R1.159 CC1=C(Cl)C=CC=C1B(O)O C46238 [0,2,0,0,0,0|1,0,1]=4 2223 B11R1.159 CC1=C(Cl)C=CC=C1C(=O)O C67478 [0,2,0,0,0,0|0,0,0]=2 2224 B11R1.159 CC1=C(F)C(B(O)O)=CC=C1 F46240 [0,2,0,0,0,0|1,0,1]=4 2225 B11R1.159 CC1=C(F)C=CC=C1B(O)O F46241 [0,2,0,0,0,0|1,0,1]=4 2226 B11R1.159 CC1=C(F)C=CC=C1C(=O)O F38507 [0,2,0,0,0,0|0,0,0]=2 2227 B11R1.159 CC1=C(F)C=CC=C1[N+](=O)[O-] F39385 [0,2,0,0,0,0|1,0,1]=4 2228 B11R1.159 CC1=C(I)C=CC=C1[N+](=O)[O-] K45397 [0,2,0,0,0,0|1,0,1]=4 2229 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1N M65006 [0,2,0,0,0,0|1,0,1]=4 2230 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1O M45829 [0,2,0,0,0,0|1,0,1]=4 2231 B11R1.159 CC1=CC=CC(B(O)O)=C1C D2920 [0,2,0,0,0,0|1,0,1]=4 2232 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br B48566 [0,2,0,0,0,0|0,0,0]=2 2233 B11R1.159 CC1=CC=CC(C(=O)O)=C1C D65554 [0,2,0,0,0,0|0,0,0]=2 2234 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl C48591 [0,2,0,0,0,0|0,0,0]=2 2235 B11R1.159 CC1=CC=CC(C(=O)O)=C1F F48609 [0,2,0,0,0,0|0,0,0]=2 2236 B11R1.159 CC1=CC=CC(C(=O)O)=C1I K48632 [0,2,0,0,0,0|0,0,0]=2 2237 B11R1.159 CC1=CC=CC(C(=O)[O-])=C1O C3234 [0,2,0,0,0,0|0,0,1]=3 2238 B11R1.159 CC1=CC=CC(C(N)=O)=C1N A46650 [0,2,0,0,0,0|1,0,0]=3 2239 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1Br B37898 [0,2,0,0,0,0|1,0,1]=4 2240 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1Cl C45349 [0,2,0,0,0,0|1,0,1]=4 2241 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1F F38457 [0,2,0,0,0,0|1,0,1]=4 2242 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1I K45400 [0,2,0,0,0,0|1,0,1]=4 2243 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1N M45991 [0,2,0,0,0,0|1,0,1]=4 2244 B11R1.159 CC1=CC=CC([N+](=O)[O-])=C1O M67469 [0,2,0,0,0,0|1,0,1]=4 2245 B11R1.159 CN1C(=O)C=CC=C1C(=O)O M45850 [0,2,0,0,0,0|1,0,0]=3 2246 B11R1.159 CN1C=CC=C(C(=O)O)C1=O M10301 [0,2,0,0,0,0|1,0,0]=3 2247 B11R1.159 NC(=O)C1=C(N)C(Cl)=NC=C1 A42826 [0,2,0,0,0,0|2,0,0]=4 2248 B11R1.159 NC(=O)C1=C(N)C(N)=CC=C1 D11950 [0,2,0,0,0,0|1,0,0]=3 2249 B11R1.159 NC(=O)C1=CC=CC(Cl)=C1F C45048 [0,2,0,0,0,0|1,0,0]=3 2250 B11R1.159 NC(=O)C1=CC=CC(N)=C1F A45708 [0,2,0,0,0,0|1,0,0]=3 2251 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O A45327 [0,2,0,0,0,0|0,0,0]=2 2252 B11R1.159 NC1=C(Br)C=CC=C1[N+](=O)[O-] B42383 [0,2,0,0,0,0|1,0,1]=4 2253 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O A67805 [0,2,0,0,0,0|1,0,0]=3 2254 B11R1.159 NC1=C(C(=O)O)C=CC=C1O A38066 [0,2,0,0,0,0|0,0,0]=2 2255 B11R1.159 NC1=C(C(=O)O)C=CN=C1Cl A42405 [0,2,0,0,0,0|1,0,0]=3 2256 B11R1.159 NC1=C(Cl)C(C(=O)O)=CC=C1 A45353 [0,2,0,0,0,0|0,0,0]=2 2257 B11R1.159 NC1=C(Cl)C(C(=O)O)=NC=N1 A9767 [0,2,0,0,0,0|2,0,0]=4 2258 B11R1.159 NC1=C(Cl)C=CC=C1C(=O)O A39383 [0,2,0,0,0,0|0,0,0]=2 2259 B11R1.159 NC1=C(Cl)C=CC=C1[N+](=O)[O-] C60917 [0,2,0,0,0,0|1,0,1]=4 2260 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 A45376 [0,2,0,0,0,0|0,0,0]=2 2261 B11R1.159 NC1=C(F)C=CC=C1C(=O)O A45375 [0,2,0,0,0,0|0,0,0]=2 2262 B11R1.159 NC1=C(F)C=CC=C1[N+](=O)[O-] F42415 [0,2,0,0,0,0|1,0,1]=4 2263 B11R1.159 NC1=C(I)C=CC=C1C(=O)O A45393 [0,2,0,0,0,0|0,0,0]=2 2264 B11R1.159 NC1=C([N+](=O)[O-])C=CC=C1O A42781 [0,2,0,0,0,0|1,0,1]=4 2265 B11R1.159 NC1=CC=CC(C(=O)O)=C1N D45990 [0,2,0,0,0,0|0,0,0]=2 2266 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Br B42380 [0,2,0,0,0,0|1,0,1]=4 2267 B11R1.159 NC1=CC=CC([N+](=O)[O-])=C1Cl C42398 [0,2,0,0,0,0|1,0,1]=4 2268 B11R1.159 O=C(O)C1=C(Br)C(Br)=NC=C1 D41902 [0,2,0,0,0,0|1,0,0]=3 2269 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 D21983 [0,2,0,0,0,0|1,0,0]=3 2270 B11R1.159 O=C(O)C1=C(F)C(Br)=NC=C1 B37448 [0,2,0,0,0,0|1,0,0]=3 2271 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 C41941 [0,2,0,0,0,0|1,0,0]=3 2272 B11R1.159 O=C(O)C1=C(F)C(F)=NC=C1 D14905 [0,2,0,0,0,0|1,0,0]=3 2273 B11R1.159 O=C(O)C1=CC=CC(=O)N1O H42616 [0,2,0,0,0,0|1,0,0]=3 2274 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Br D44561 [0,2,0,0,0,0|0,0,0]=2 2275 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl B44567 [0,2,0,0,0,0|0,0,0]=2 2276 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F B14138 [0,2,0,0,0,0|0,0,0]=2 2277 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I B38866 [0,2,0,0,0,0|0,0,0]=2 2278 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O B45111 [0,2,0,0,0,0|0,0,0]=2 2279 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br B36699 [0,2,0,0,0,0|0,0,0]=2 2280 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl D39337 [0,2,0,0,0,0|0,0,0]=2 2281 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F C44590 [0,2,0,0,0,0|0,0,0]=2 2282 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I C44599 [0,2,0,0,0,0|0,0,0]=2 2283 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O C45118 [0,2,0,0,0,0|0,0,0]=2 2284 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br B37233 [0,2,0,0,0,0|0,0,0]=2 2285 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl C44588 [0,2,0,0,0,0|0,0,0]=2 2286 B11R1.159 O=C(O)C1=CC=CC(F)=C1F D44604 [0,2,0,0,0,0|0,0,0]=2 2287 B11R1.159 O=C(O)C1=CC=CC(F)=C1I F44615 [0,2,0,0,0,0|0,0,0]=2 2288 B11R1.159 O=C(O)C1=CC=CC(F)=C1O F68862 [0,2,0,0,0,0|0,0,0]=2 2289 B11R1.159 O=C(O)C1=CC=CC(I)=C1Br B44581 [0,2,0,0,0,0|0,0,0]=2 2290 B11R1.159 O=C(O)C1=CC=CC(I)=C1F F44612 [0,2,0,0,0,0|0,0,0]=2 2291 B11R1.159 O=C(O)C1=CN=CC(Br)=C1Cl B41905 [0,2,0,0,0,0|1,0,0]=3 2292 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1Cl B41908 [0,2,0,0,0,0|1,0,1]=4 2293 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1F B24394 [0,2,0,0,0,0|1,0,1]=4 2294 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1I B41924 [0,2,0,0,0,0|1,0,1]=4 2295 B11R1.159 O=[N+]([O-])C1=CC=CC(Br)=C1O B42261 [0,2,0,0,0,0|1,0,1]=4 2296 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1Br B41912 [0,2,0,0,0,0|1,0,1]=4 2297 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1F C68995 [0,2,0,0,0,0|1,0,1]=4 2298 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1I C41945 [0,2,0,0,0,0|1,0,1]=4 2299 B11R1.159 O=[N+]([O-])C1=CC=CC(Cl)=C1O C42267 [0,2,0,0,0,0|1,0,1]=4 2300 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Br B41914 [0,2,0,0,0,0|1,0,1]=4 2301 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1Cl C41932 [0,2,0,0,0,0|1,0,1]=4 2302 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1F D41949 [0,2,0,0,0,0|1,0,1]=4 2303 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1O F42281 [0,2,0,0,0,0|1,0,1]=4 2304 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Br B42259 [0,2,0,0,0,0|1,0,1]=4 2305 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Cl C42265 [0,2,0,0,0,0|1,0,1]=4 2306 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1F F21926 [0,2,0,0,0,0|1,0,1]=4 2307 B11R1.159 OB(O)C1=CC=CC(Br)=C1F B42687 [0,2,0,0,0,0|1,0,1]=4 2308 B11R1.159 OB(O)C1=CC=CC(Cl)=C1Cl D2480 [0,2,0,0,0,0|1,0,1]=4 2309 B11R1.159 OB(O)C1=CC=CC(Cl)=C1F C42689 [0,2,0,0,0,0|1,0,1]=4 2310 B11R1.159 OB(O)C1=CC=CC(F)=C1Br B61357 [0,2,0,0,0,0|1,0,1]=4 2311 B11R1.159 OB(O)C1=CC=CC(F)=C1Cl C11182 [0,2,0,0,0,0|1,0,1]=4 2312 B11R1.159 OB(O)C1=CC=CC(I)=C1F F42693 [0,2,0,0,0,0|1,0,1]=4 2313 B11R1.159 OB(O)C1=CC=CC(O)=C1F F42950 [0,2,0,0,0,0|1,0,1]=4 2314 B11R1.167 CC(=O)C1=C(Br)C=CC(Cl)=C1 B48243 [0,2,0,0,0,0|1,0,0]=3 2315 B11R1.167 CC(=O)C1=C(Br)C=CC(F)=C1 B48249 [0,2,0,0,0,0|1,0,0]=3 2316 B11R1.167 CC(=O)C1=C(C)C=CC(Br)=C1 B61483 [0,2,0,0,0,0|1,0,0]=3 2317 B11R1.167 CC(=O)C1=C(C)C=CC(F)=C1 F62666 [0,2,0,0,0,0|1,0,0]=3 2318 B11R1.167 CC(=O)C1=C(Cl)C=CC(Br)=C1 B48247 [0,2,0,0,0,0|1,0,0]=3 2319 B11R1.167 CC(=O)C1=C(F)C=CC(Br)=N1 B45033 [0,2,0,0,0,0|2,0,0]=4 2320 B11R1.167 CC(=O)C1=C(F)C=CC(Cl)=C1 C48279 [0,2,0,0,0,0|1,0,0]=3 2321 B11R1.167 CC(=O)C1=C(F)C=CC(F)=C1 D48287 [0,2,0,0,0,0|1,0,0]=3 2322 B11R1.167 CC(=O)C1=C(F)C=CC(N)=C1 A49053 [0,2,0,0,0,0|1,0,0]=3 2323 B11R1.167 CC(=O)C1=C(F)C=CC(O)=C1 F48623 [0,2,0,0,0,0|1,0,0]=3 2324 B11R1.167 CC(=O)C1=C(I)C=CC(F)=C1 F48292 [0,2,0,0,0,0|1,0,0]=3 2325 B11R1.167 CC(=O)C1=C(N)C=CC(Br)=C1 A49025 [0,2,0,0,0,0|1,0,0]=3 2326 B11R1.167 CC(=O)C1=C(N)C=CC(Cl)=C1 A49038 [0,2,0,0,0,0|1,0,0]=3 2327 B11R1.167 CC(=O)C1=C(N)C=CC(F)=C1 A49049 [0,2,0,0,0,0|1,0,0]=3 2328 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 B3183 [0,2,0,0,0,0|1,0,0]=3 2329 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 H49899 [0,2,0,0,0,0|1,0,0]=3 2330 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 C48603 [0,2,0,0,0,0|1,0,0]=3 2331 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 F39496 [0,2,0,0,0,0|1,0,0]=3 2332 B11R1.167 CC(=O)C1=C(O)C=CC(N)=C1 A49291 [0,2,0,0,0,0|1,0,0]=3 2333 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 D39506 [0,2,0,0,0,0|1,0,0]=3 2334 B11R1.167 CC(=O)C1=CC(Br)=CN=C1C B49027 [0,2,0,0,0,0|2,0,0]=4 2335 B11R1.167 CC(=O)C1=CC(Br)=CN=C1Cl B12729 [0,2,0,0,0,0|2,0,0]=4 2336 B11R1.167 CC(=O)C1=CC(Br)=CN=C1F B10880 [0,2,0,0,0,0|2,0,0]=4 2337 B11R1.167 CC1=C(B(O)O)C=C(Cl)C=C1 C2230 [0,2,0,0,0,0|1,0,1]=4 2338 B11R1.167 CC1=C(B(O)O)C=C(F)C=C1 F3332 [0,2,0,0,0,0|1,0,1]=4 2339 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 B25445 [0,2,0,0,0,0|0,0,0]=2 2340 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 C39492 [0,2,0,0,0,0|0,0,0]=2 2341 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 F48616 [0,2,0,0,0,0|0,0,0]=2 2342 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 K48634 [0,2,0,0,0,0|0,0,0]=2 2343 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 A38108 [0,2,0,0,0,0|0,0,0]=2 2344 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 H49098 [0,2,0,0,0,0|0,0,0]=2 2345 B11R1.167 CC1=C(C(=O)O)N=C(Br)C=C1 B31303 [0,2,0,0,0,0|1,0,0]=3 2346 B11R1.167 CC1=C(C(=O)O)N=C(Cl)C=C1 C17394 [0,2,0,0,0,0|1,0,0]=3 2347 B11R1.167 CC1=C(C(=O)O)N=C(Cl)N=C1 C38918 [0,2,0,0,0,0|2,0,0]=4 2348 B11R1.167 CC1=C([C@H](C)O)C=C(Cl)C=C1 C50163 [0,2,0,0,0,0|1,0,1]=4 2349 B11R1.167 CC1=C([N+](=O)[O-])C=C(Br)C=C1 B39378 [0,2,0,0,0,0|1,0,1]=4 2350 B11R1.167 CC1=C([N+](=O)[O-])C=C(F)C=C1 F68864 [0,2,0,0,0,0|1,0,1]=4 2351 B11R1.167 CC1=C([N+](=O)[O-])C=C(I)C=C1 K45390 [0,2,0,0,0,0|1,0,1]=4 2352 B11R1.167 CC1=C([N+](=O)[O-])C=C(O)C=C1 M45832 [0,2,0,0,0,0|1,0,1]=4 2353 B11R1.167 CC1=CC(B(O)O)=C(C)C=C1 D2940 [0,2,0,0,0,0|1,0,1]=4 2354 B11R1.167 CC1=CC(B(O)O)=C(Cl)C=C1 C69025 [0,2,0,0,0,0|1,0,1]=4 2355 B11R1.167 CC1=CC(B(O)O)=C(F)C=C1 F3284 [0,2,0,0,0,0|1,0,1]=4 2356 B11R1.167 CC1=CC(B(O)O)=C(O)C=C1 H46445 [0,2,0,0,0,0|1,0,1]=4 2357 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 B48567 [0,2,0,0,0,0|0,0,0]=2 2358 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 D39532 [0,2,0,0,0,0|0,0,0]=2 2359 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 C48592 [0,2,0,0,0,0|0,0,0]=2 2360 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=N1 C45365 [0,2,0,0,0,0|1,0,0]=3 2361 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 F48611 [0,2,0,0,0,0|0,0,0]=2 2362 B11R1.167 CC1=CC(C(=O)O)=C(F)C=N1 F45384 [0,2,0,0,0,0|1,0,0]=3 2363 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 I24082 [0,2,0,0,0,0|0,0,0]=2 2364 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 A67448 [0,2,0,0,0,0|0,0,0]=2 2365 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 A1742 [0,2,0,0,0,0|1,0,0]=3 2366 B11R1.167 CC1=CC(C(=O)O)=C(N)C=N1 A31834 [0,2,0,0,0,0|1,0,0]=3 2367 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 A46002 [0,2,0,0,0,0|1,0,0]=3 2368 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 H60608 [0,2,0,0,0,0|0,0,0]=2 2369 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 A46652 [0,2,0,0,0,0|1,0,0]=3 2370 B11R1.167 CC1=CC([N+](=O)[O-])=C(Br)C=C1 B39380 [0,2,0,0,0,0|1,0,1]=4 2371 B11R1.167 CC1=CC([N+](=O)[O-])=C(C)C=C1 D39515 [0,2,0,0,0,0|1,0,1]=4 2372 B11R1.167 CC1=CC([N+](=O)[O-])=C(Cl)C=C1 C39384 [0,2,0,0,0,0|1,0,1]=4 2373 B11R1.167 CC1=CC([N+](=O)[O-])=C(F)C=C1 F39386 [0,2,0,0,0,0|1,0,1]=4 2374 B11R1.167 CC1=CC([N+](=O)[O-])=C(I)C=C1 K45399 [0,2,0,0,0,0|1,0,1]=4 2375 B11R1.167 CC1=CC=C(N)C(C(=O)O)=N1 A13502 [0,2,0,0,0,0|1,0,0]=3 2376 B11R1.167 CC1=CC=C(O)C(C(=O)O)=N1 H45842 [0,2,0,0,0,0|1,0,0]=3 2377 B11R1.167 CC1=CC=C(O)N=C1C(=O)O H45843 [0,2,0,0,0,0|1,0,0]=3 2378 B11R1.167 CC1=CN=C(C)C(C(=O)O)=N1 D46014 [0,2,0,0,0,0|2,0,0]=4 2379 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=C1 C45357 [0,2,0,0,0,0|1,0,0]=3 2380 B11R1.167 CC1=CN=C(Cl)C(C(=O)O)=N1 C42409 [0,2,0,0,0,0|2,0,0]=4 2381 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 F45381 [0,2,0,0,0,0|1,0,0]=3 2382 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=N1 B14424 [0,2,0,0,0,0|2,0,0]=4 2383 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=C1 C62178 [0,2,0,0,0,0|1,0,0]=3 2384 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=N1 C11200 [0,2,0,0,0,0|2,0,0]=4 2385 B11R1.167 CC1=NC=C(Br)C=C1C(=O)O B45336 [0,2,0,0,0,0|1,0,0]=3 2386 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O C9688 [0,2,0,0,0,0|1,0,0]=3 2387 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 C2950 [0,2,0,0,0,0|2,0,0]=4 2388 B11R1.167 CC1=NNC(=O)C(C(=O)O)=C1 M2951 [0,2,0,0,0,0|2,0,0]=4 2389 B11R1.167 C[C@H](O)C1=C(Cl)C=CC(Cl)=C1 D68314 [0,2,0,0,0,0|1,0,1]=4 2390 B11R1.167 C[C@H](O)C1=C(F)C=CC(Br)=C1 B49140 [0,2,0,0,0,0|1,0,1]=4 2391 B11R1.167 C[C@H](O)C1=C(I)C=CC(F)=C1 F62425 [0,2,0,0,0,0|1,0,1]=4 2392 B11R1.167 NC(=O)C1=C(Cl)C=CC(Cl)=C1 D45044 [0,2,0,0,0,0|1,0,0]=3 2393 B11R1.167 NC(=O)C1=C(F)C=CC(F)=C1 D45063 [0,2,0,0,0,0|1,0,0]=3 2394 B11R1.167 NC(=O)C1=C(F)C=CC(N)=C1 A45709 [0,2,0,0,0,0|1,0,0]=3 2395 B11R1.167 NC(=O)C1=C(I)C=CC(Br)=C1 B63006 [0,2,0,0,0,0|1,0,0]=3 2396 B11R1.167 NC(=O)C1=C(N)C=CC(Br)=C1 A45687 [0,2,0,0,0,0|1,0,0]=3 2397 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=C1 A45696 [0,2,0,0,0,0|1,0,0]=3 2398 B11R1.167 NC(=O)C1=C(N)C=CC(Cl)=N1 A12696 [0,2,0,0,0,0|2,0,0]=4 2399 B11R1.167 NC(=O)C1=C(N)C=CC(F)=C1 A45707 [0,2,0,0,0,0|1,0,0]=3 2400 B11R1.167 NC(=O)C1=C(O)C=CC(Br)=C1 B69552 [0,2,0,0,0,0|1,0,0]=3 2401 B11R1.167 NC(=O)C1=C(O)C=CC(Cl)=C1 C69022 [0,2,0,0,0,0|1,0,0]=3 2402 B11R1.167 NC(=O)C1=CC(Br)=CN=C1Cl B42127 [0,2,0,0,0,0|2,0,0]=4 2403 B11R1.167 NC(=O)C1=CC(Br)=CN=C1N A42824 [0,2,0,0,0,0|2,0,0]=4 2404 B11R1.167 NC(=O)C1=CC(Br)=NC=C1F B42129 [0,2,0,0,0,0|2,0,0]=4 2405 B11R1.167 NC(=O)C1=CC(Cl)=CN=C1Cl D67499 [0,2,0,0,0,0|2,0,0]=4 2406 B11R1.167 NC1=C(B(O)O)C=C(F)C=C1 A62205 [0,2,0,0,0,0|1,0,1]=4 2407 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 B68128 [0,2,0,0,0,0|0,0,0]=2 2408 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 A69316 [0,2,0,0,0,0|0,0,0]=2 2409 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 A69260 [0,2,0,0,0,0|0,0,0]=2 2410 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 A39389 [0,2,0,0,0,0|0,0,0]=2 2411 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 A67447 [0,2,0,0,0,0|0,0,0]=2 2412 B11R1.167 NC1=C(C(=O)O)N=C(Br)C=C1 A60557 [0,2,0,0,0,0|1,0,0]=3 2413 B11R1.167 NC1=C(C(=O)O)N=C(Br)C=N1 A40798 [0,2,0,0,0,0|2,0,0]=4 2414 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=C1 A12514 [0,2,0,0,0,0|1,0,0]=3 2415 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=C1 A7590 [0,2,0,0,0,0|1,0,0]=3 2416 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=N1 A37991 [0,2,0,0,0,0|2,0,0]=4 2417 B11R1.167 NC1=C(C(=O)O)N=C(Cl)N=C1 A62107 [0,2,0,0,0,0|2,0,0]=4 2418 B11R1.167 NC1=C([N+](=O)[O-])C=C(Br)C=C1 B67863 [0,2,0,0,0,0|1,0,1]=4 2419 B11R1.167 NC1=C([N+](=O)[O-])C=C(F)C=C1 F39254 [0,2,0,0,0,0|1,0,1]=4 2420 B11R1.167 NC1=C([N+](=O)[O-])C=C(I)C=C1 K42426 [0,2,0,0,0,0|1,0,1]=4 2421 B11R1.167 NC1=C([N+](=O)[O-])C=C(O)C=C1 H39263 [0,2,0,0,0,0|1,0,1]=4 2422 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 A45331 [0,2,0,0,0,0|0,0,0]=2 2423 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=N1 A42391 [0,2,0,0,0,0|1,0,0]=3 2424 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 A45355 [0,2,0,0,0,0|0,0,0]=2 2425 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 A45380 [0,2,0,0,0,0|0,0,0]=2 2426 B11R1.167 NC1=CC(C(=O)[O-])=C(O)C=C1 S46456 [0,2,0,0,0,0|0,0,1]=3 2427 B11R1.167 NC1=CC([N+](=O)[O-])=C(Br)C=C1 B42387 [0,2,0,0,0,0|1,0,1]=4 2428 B11R1.167 NC1=CC([N+](=O)[O-])=C(Cl)C=C1 C69016 [0,2,0,0,0,0|1,0,1]=4 2429 B11R1.167 NC1=CC([N+](=O)[O-])=C(F)C=C1 F69239 [0,2,0,0,0,0|1,0,1]=4 2430 B11R1.167 NC1=CC([N+](=O)[O-])=C(I)C=C1 K63925 [0,2,0,0,0,0|1,0,1]=4 2431 B11R1.167 NC1=CC([N+](=O)[O-])=C(N)C=C1 N69075 [0,2,0,0,0,0|1,0,1]=4 2432 B11R1.167 NC1=CC([N+](=O)[O-])=C(O)C=C1 A37628 [0,2,0,0,0,0|1,0,1]=4 2433 B11R1.167 NC1=CN=C(Br)C=C1C(=O)O A12854 [0,2,0,0,0,0|1,0,0]=3 2434 B11R1.167 NC1=CN=C(Cl)C(C(=O)O)=C1 A10459 [0,2,0,0,0,0|1,0,0]=3 2435 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O A0384 [0,2,0,0,0,0|1,0,0]=3 2436 B11R1.167 NC1=CN=C(F)C=C1C(=O)O A12853 [0,2,0,0,0,0|1,0,0]=3 2437 B11R1.167 NC1=NC(C(=O)O)=C(Br)C=C1 A42390 [0,2,0,0,0,0|1,0,0]=3 2438 B11R1.167 NC1=NC(C(=O)O)=C(Br)C=N1 A40799 [0,2,0,0,0,0|2,0,0]=4 2439 B11R1.167 NC1=NC(C(=O)O)=C(Cl)C=N1 A40802 [0,2,0,0,0,0|2,0,0]=4 2440 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O A4501 [0,2,0,0,0,0|1,0,0]=3 2441 B11R1.167 NC1=NC=C(Cl)C=C1C(=O)O A42408 [0,2,0,0,0,0|1,0,0]=3 2442 B11R1.167 NC1=NC=C(I)C=C1C(=O)O A42427 [0,2,0,0,0,0|1,0,0]=3 2443 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 D44563 [0,2,0,0,0,0|0,0,0]=2 2444 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=N1 D41895 [0,2,0,0,0,0|1,0,0]=3 2445 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 B44565 [0,2,0,0,0,0|0,0,0]=2 2446 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=N1 B10907 [0,2,0,0,0,0|1,0,0]=3 2447 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 B39335 [0,2,0,0,0,0|0,0,0]=2 2448 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 B44583 [0,2,0,0,0,0|0,0,0]=2 2449 B11R1.167 O=C(O)C1=C(Br)C=CC(O)=C1 B45110 [0,2,0,0,0,0|0,0,0]=2 2450 B11R1.167 O=C(O)C1=C(Br)C=NC(Cl)=C1 B26174 [0,2,0,0,0,0|1,0,0]=3 2451 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 B39334 [0,2,0,0,0,0|0,0,0]=2 2452 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 D68554 [0,2,0,0,0,0|0,0,0]=2 2453 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 C44589 [0,2,0,0,0,0|0,0,0]=2 2454 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 C44598 [0,2,0,0,0,0|0,0,0]=2 2455 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 C37903 [0,2,0,0,0,0|0,0,0]=2 2456 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=N1 C42273 [0,2,0,0,0,0|1,0,0]=3 2457 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 B44577 [0,2,0,0,0,0|0,0,0]=2 2458 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=N1 B32291 [0,2,0,0,0,0|1,0,0]=3 2459 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 C37880 [0,2,0,0,0,0|0,0,0]=2 2460 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=N1 C26076 [0,2,0,0,0,0|1,0,0]=3 2461 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 F17987 [0,2,0,0,0,0|0,0,0]=2 2462 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 B13763 [0,2,0,0,0,0|0,0,0]=2 2463 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 C44603 [0,2,0,0,0,0|0,0,0]=2 2464 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 F28645 [0,2,0,0,0,0|0,0,0]=2 2465 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 D68213 [0,2,0,0,0,0|0,0,0]=2 2466 B11R1.167 O=C(O)C1=C(I)C=CC(O)=C1 H45127 [0,2,0,0,0,0|0,0,0]=2 2467 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 B67995 [0,2,0,0,0,0|0,0,0]=2 2468 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 F68863 [0,2,0,0,0,0|0,0,0]=2 2469 B11R1.167 O=C(O)C1=C(O)C=CC(I)=C1 H62399 [0,2,0,0,0,0|0,0,0]=2 2470 B11R1.167 O=C(O)C1=C(O)N=CC(Br)=N1 B40593 [0,2,0,0,0,0|2,0,0]=4 2471 B11R1.167 O=C(O)C1=C(S)C=CC(Br)=C1 B45087 [0,2,0,0,0,0|0,0,0]=2 2472 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Br D12518 [0,2,0,0,0,0|1,0,0]=3 2473 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl B0471 [0,2,0,0,0,0|1,0,0]=3 2474 B11R1.167 O=C(O)C1=CC(Br)=CN=C1F B12898 [0,2,0,0,0,0|1,0,0]=3 2475 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O B4668 [0,2,0,0,0,0|1,0,0]=3 2476 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br D3437 [0,2,0,0,0,0|1,0,0]=3 2477 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Cl B24103 [0,2,0,0,0,0|1,0,0]=3 2478 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F B26159 [0,2,0,0,0,0|1,0,0]=3 2479 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl D41926 [0,2,0,0,0,0|1,0,0]=3 2480 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl D3788 [0,2,0,0,0,0|1,0,0]=3 2481 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F C41942 [0,2,0,0,0,0|1,0,0]=3 2482 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O C42276 [0,2,0,0,0,0|1,0,0]=3 2483 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1Cl D1516 [0,2,0,0,0,0|2,0,0]=4 2484 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1O C40601 [0,2,0,0,0,0|2,0,0]=4 2485 B11R1.167 O=C(O)C1=CC(F)=CN=C1Br B63733 [0,2,0,0,0,0|1,0,0]=3 2486 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl C8175 [0,2,0,0,0,0|1,0,0]=3 2487 B11R1.167 O=C(O)C1=CC(F)=CN=C1O F42283 [0,2,0,0,0,0|1,0,0]=3 2488 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl C41943 [0,2,0,0,0,0|1,0,0]=3 2489 B11R1.167 O=C(O)C1=CC(I)=CN=C1O H42286 [0,2,0,0,0,0|1,0,0]=3 2490 B11R1.167 O=C(O)C1=CC(O)=CN=C1Cl C42272 [0,2,0,0,0,0|1,0,0]=3 2491 B11R1.167 O=C(O)C1=NC(Br)=CN=C1Br D26920 [0,2,0,0,0,0|2,0,0]=4 2492 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Br B32284 [0,2,0,0,0,0|2,0,0]=4 2493 B11R1.167 O=C(O)C1=NC(Cl)=CN=C1Cl D40471 [0,2,0,0,0,0|2,0,0]=4 2494 B11R1.167 O=C([O-])C1=C(O)C=CC(O)=C1 S68994 [0,2,0,0,0,0|0,0,1]=3 2495 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(Br)=C1 D67443 [0,2,0,0,0,0|1,0,1]=4 2496 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(Cl)=C1 B38714 [0,2,0,0,0,0|1,0,1]=4 2497 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(F)=C1 B41915 [0,2,0,0,0,0|1,0,1]=4 2498 B11R1.167 O=[N+]([O-])C1=C(Br)C=CC(O)=C1 B42263 [0,2,0,0,0,0|1,0,1]=4 2499 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(Br)=C1 B21691 [0,2,0,0,0,0|1,0,1]=4 2500 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(F)=C1 C41933 [0,2,0,0,0,0|1,0,1]=4 2501 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(I)=C1 C41947 [0,2,0,0,0,0|1,0,1]=4 2502 B11R1.167 O=[N+]([O-])C1=C(Cl)C=CC(O)=C1 C42270 [0,2,0,0,0,0|1,0,1]=4 2503 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(Br)=C1 B41918 [0,2,0,0,0,0|1,0,1]=4 2504 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(Cl)=C1 C39230 [0,2,0,0,0,0|1,0,1]=4 2505 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(F)=C1 D68331 [0,2,0,0,0,0|1,0,1]=4 2506 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(I)=C1 F41956 [0,2,0,0,0,0|1,0,1]=4 2507 B11R1.167 O=[N+]([O-])C1=C(F)C=CC(O)=C1 F22309 [0,2,0,0,0,0|1,0,1]=4 2508 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(Br)=C1 B41925 [0,2,0,0,0,0|1,0,1]=4 2509 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(Cl)=C1 C41948 [0,2,0,0,0,0|1,0,1]=4 2510 B11R1.167 O=[N+]([O-])C1=C(I)C=CC(I)=C1 D41958 [0,2,0,0,0,0|1,0,1]=4 2511 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(Br)=C1 B25315 [0,2,0,0,0,0|1,0,1]=4 2512 B11R1.167 O=[N+]([O-])C1=C(O)C=CC(F)=C1 F39245 [0,2,0,0,0,0|1,0,1]=4 2513 B11R1.167 OB(O)C1=C(Br)C=CC(Br)=C1 D42682 [0,2,0,0,0,0|1,0,1]=4 2514 B11R1.167 OB(O)C1=C(Br)C=CC(F)=C1 B42685 [0,2,0,0,0,0|1,0,1]=4 2515 B11R1.167 OB(O)C1=C(Cl)C=CC(Cl)=C1 D2520 [0,2,0,0,0,0|1,0,1]=4 2516 B11R1.167 OB(O)C1=C(Cl)C=CC(F)=C1 C42691 [0,2,0,0,0,0|1,0,1]=4 2517 B11R1.167 OB(O)C1=C(Cl)C=CC(O)=C1 C63873 [0,2,0,0,0,0|1,0,1]=4 2518 B11R1.167 OB(O)C1=C(F)C=CC(Br)=C1 B68733 [0,2,0,0,0,0|1,0,1]=4 2519 B11R1.167 OB(O)C1=C(F)C=CC(Cl)=C1 C2202 [0,2,0,0,0,0|1,0,1]=4 2520 B11R1.167 OB(O)C1=C(F)C=CC(F)=C1 D2640 [0,2,0,0,0,0|1,0,1]=4 2521 B11R1.167 OB(O)C1=C(F)C=CC(O)=C1 F42951 [0,2,0,0,0,0|1,0,1]=4 2522 B11R1.167 OB(O)C1=C(O)C=CC(F)=C1 F3216 [0,2,0,0,0,0|1,0,1]=4 2523 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 D38007 [0,2,0,0,0,0|1,0,0]=3 2524 B11R1.74 CC(=O)C1=CC(Br)=CC(Cl)=C1 B20352 [0,2,0,0,0,0|1,0,0]=3 2525 B11R1.74 CC(=O)C1=CC(Br)=CC(F)=C1 B48253 [0,2,0,0,0,0|1,0,0]=3 2526 B11R1.74 CC(=O)C1=CC(C)=CC(Br)=C1 B52033 [0,2,0,0,0,0|1,0,0]=3 2527 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 D52785 [0,2,0,0,0,0|1,0,0]=3 2528 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 D48272 [0,2,0,0,0,0|1,0,0]=3 2529 B11R1.74 CC(=O)C1=CC(F)=CC(F)=C1 D48284 [0,2,0,0,0,0|1,0,0]=3 2530 B11R1.74 CC(=O)C1=CC(O)=CC(C)=C1 H49902 [0,2,0,0,0,0|1,0,0]=3 2531 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 D49099 [0,2,0,0,0,0|1,0,0]=3 2532 B11R1.74 CC1=CC(B(O)O)=CC(Br)=C1 B46235 [0,2,0,0,0,0|1,0,1]=4 2533 B11R1.74 CC1=CC(B(O)O)=CC(Cl)=C1 C46239 [0,2,0,0,0,0|1,0,1]=4 2534 B11R1.74 CC1=CC(B(O)O)=CC(F)=C1 F46242 [0,2,0,0,0,0|1,0,1]=4 2535 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 B48571 [0,2,0,0,0,0|0,0,0]=2 2536 B11R1.74 CC1=CC(Br)=CC([N+](=O)[O-])=C1 B45338 [0,2,0,0,0,0|1,0,1]=4 2537 B11R1.74 CC1=CC(C(=O)O)=CC(Br)=N1 B63466 [0,2,0,0,0,0|1,0,0]=3 2538 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 D24167 [0,2,0,0,0,0|1,0,0]=3 2539 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 C14183 [0,2,0,0,0,0|1,0,0]=3 2540 B11R1.74 CC1=CC(C(=O)O)=CC(N)=C1 A49283 [0,2,0,0,0,0|0,0,0]=2 2541 B11R1.74 CC1=CC(C(=O)O)=CC(N)=N1 A12069 [0,2,0,0,0,0|1,0,0]=3 2542 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 H49096 [0,2,0,0,0,0|0,0,0]=2 2543 B11R1.74 CC1=CC(C(=O)O)=CC(O)=N1 H45844 [0,2,0,0,0,0|1,0,0]=3 2544 B11R1.74 CC1=CC(C)=CC(B(O)O)=C1 D2980 [0,2,0,0,0,0|1,0,1]=4 2545 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 C48594 [0,2,0,0,0,0|0,0,0]=2 2546 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 C45370 [0,2,0,0,0,0|1,0,0]=3 2547 B11R1.74 CC1=CC(Cl)=CC([N+](=O)[O-])=C1 C45359 [0,2,0,0,0,0|1,0,1]=4 2548 B11R1.74 CC1=CC(Cl)=NC(C(=O)O)=C1 C45368 [0,2,0,0,0,0|1,0,0]=3 2549 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 F48614 [0,2,0,0,0,0|0,0,0]=2 2550 B11R1.74 CC1=CC(F)=CC([N+](=O)[O-])=C1 F45373 [0,2,0,0,0,0|1,0,1]=4 2551 B11R1.74 CC1=CC(I)=CC(C(=O)O)=C1 K48633 [0,2,0,0,0,0|0,0,0]=2 2552 B11R1.74 CC1=CC([N+](=O)[O-])=CC(N)=C1 M45994 [0,2,0,0,0,0|1,0,1]=4 2553 B11R1.74 CC1=CC([N+](=O)[O-])=CC(O)=C1 M45831 [0,2,0,0,0,0|1,0,1]=4 2554 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 M61613 [0,2,0,0,0,0|2,0,0]=4 2555 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 D46527 [0,2,0,0,0,0|2,0,0]=4 2556 B11R1.74 NC(=O)C1=CC(Br)=CC(Br)=C1 D61940 [0,2,0,0,0,0|1,0,0]=3 2557 B11R1.74 NC(=O)C1=CC(Cl)=CC(F)=C1 C45049 [0,2,0,0,0,0|1,0,0]=3 2558 B11R1.74 NC1=CC(Br)=CC([N+](=O)[O-])=C1 B42386 [0,2,0,0,0,0|1,0,1]=4 2559 B11R1.74 NC1=CC(C(=O)O)=CC(Br)=C1 A45329 [0,2,0,0,0,0|0,0,0]=2 2560 B11R1.74 NC1=CC(C(=O)O)=CC(Cl)=C1 A45354 [0,2,0,0,0,0|0,0,0]=2 2561 B11R1.74 NC1=CC(C(=O)O)=CC(F)=C1 A38712 [0,2,0,0,0,0|0,0,0]=2 2562 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 A46552 [0,2,0,0,0,0|0,0,0]=2 2563 B11R1.74 NC1=CC(Cl)=CC([N+](=O)[O-])=C1 C32215 [0,2,0,0,0,0|1,0,1]=4 2564 B11R1.74 NC1=CC(F)=CC([N+](=O)[O-])=C1 F42417 [0,2,0,0,0,0|1,0,1]=4 2565 B11R1.74 NC1=CC(N)=CC([N+](=O)[O-])=C1 N43102 [0,2,0,0,0,0|1,0,1]=4 2566 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 D39333 [0,2,0,0,0,0|0,0,0]=2 2567 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 B44569 [0,2,0,0,0,0|0,0,0]=2 2568 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=N1 B32412 [0,2,0,0,0,0|1,0,0]=3 2569 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 B44575 [0,2,0,0,0,0|0,0,0]=2 2570 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 B68739 [0,2,0,0,0,0|0,0,0]=2 2571 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 D11893 [0,2,0,0,0,0|1,0,0]=3 2572 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=N1 B32061 [0,2,0,0,0,0|1,0,0]=3 2573 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 D64931 [0,2,0,0,0,0|0,0,0]=2 2574 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=N1 D26222 [0,2,0,0,0,0|1,0,0]=3 2575 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 C44592 [0,2,0,0,0,0|0,0,0]=2 2576 B11R1.74 O=C(O)C1=CC(Cl)=CC(O)=C1 C45119 [0,2,0,0,0,0|0,0,0]=2 2577 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 D68859 [0,2,0,0,0,0|0,0,0]=2 2578 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 F45123 [0,2,0,0,0,0|0,0,0]=2 2579 B11R1.74 O=C(O)C1=CC(F)=NC(F)=C1 D10069 [0,2,0,0,0,0|1,0,0]=3 2580 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 B44585 [0,2,0,0,0,0|0,0,0]=2 2581 B11R1.74 O=C(O)C1=CC(I)=CC(Cl)=C1 C44600 [0,2,0,0,0,0|0,0,0]=2 2582 B11R1.74 O=C(O)C1=CC(I)=CC(F)=C1 F36855 [0,2,0,0,0,0|0,0,0]=2 2583 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 D44618 [0,2,0,0,0,0|0,0,0]=2 2584 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 D40474 [0,2,0,0,0,0|2,0,0]=4 2585 B11R1.74 O=C([O-])C1=CC(F)=CC(F)=N1 S60243 [0,2,0,0,0,0|1,0,1]=4 2586 B11R1.74 O=C1C=C(C(=O)O)C=C(Cl)N1 C42278 [0,2,0,0,0,0|1,0,0]=3 2587 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(Br)=C1 D41901 [0,2,0,0,0,0|1,0,1]=4 2588 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(Cl)=C1 B41911 [0,2,0,0,0,0|1,0,1]=4 2589 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(F)=C1 B41921 [0,2,0,0,0,0|1,0,1]=4 2590 B11R1.74 O=[N+]([O-])C1=CC(Br)=CC(O)=C1 B32433 [0,2,0,0,0,0|1,0,1]=4 2591 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(Cl)=C1 D41930 [0,2,0,0,0,0|1,0,1]=4 2592 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(F)=C1 C41939 [0,2,0,0,0,0|1,0,1]=4 2593 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(O)=C1 C38376 [0,2,0,0,0,0|1,0,1]=4 2594 B11R1.74 O=[N+]([O-])C1=CC(I)=CC(Cl)=C1 C41946 [0,2,0,0,0,0|1,0,1]=4 2595 B11R1.74 O=[N+]([O-])C1=CC(I)=CC(F)=C1 F41955 [0,2,0,0,0,0|1,0,1]=4 2596 B11R1.74 OB(O)C1=CC(Br)=CC(Br)=C1 D2460 [0,2,0,0,0,0|1,0,1]=4 2597 B11R1.74 OB(O)C1=CC(Br)=CC(Cl)=C1 B42683 [0,2,0,0,0,0|1,0,1]=4 2598 B11R1.74 OB(O)C1=CC(Cl)=CC(Cl)=C1 D2580 [0,2,0,0,0,0|1,0,1]=4 2599 B11R1.74 OB(O)C1=CC(Cl)=CC(F)=C1 C42690 [0,2,0,0,0,0|1,0,1]=4 2600 B11R1.74 OB(O)C1=CC(Cl)=CC(O)=C1 C42948 [0,2,0,0,0,0|1,0,1]=4 2601 B11R1.74 OB(O)C1=CC(F)=CC(F)=C1 D2700 [0,2,0,0,0,0|1,0,1]=4 2602 B11R1.74 OB(O)C1=CC(F)=CC(O)=C1 F42954 [0,2,0,0,0,0|1,0,1]=4 2603 B11R1.266 C#CC1=CC=CC(B(O)O)=C1 E7799 [0,2,0,0,0,0|1,0,1]=4 2604 B11R1.266 C#CC1=CC=CC(C(=O)O)=C1 E50962 [0,2,0,0,0,0|0,0,0]=2 2605 B11R1.266 C#CC1=CC=CC([N+](=O)[O-])=C1 E37913 [0,2,0,0,0,0|1,0,1]=4 2606 B11R1.266 C=CC1=CC=CC(B(O)O)=C1 V5639 [0,2,0,0,0,0|1,0,1]=4 2607 B11R1.266 CC(=O)C1=CC(C#N)=CC=C1 A51159 [0,2,0,0,0,0|1,0,0]=3 2608 B11R1.266 CC(=O)C1=NC(C#N)=CC=C1 A47868 [0,2,0,0,0,0|2,0,0]=4 2609 B11R1.266 CC(=O)C1=NC=CC(C#N)=C1 A38324 [0,2,0,0,0,0|2,0,0]=4 2610 B11R1.266 CCC1=CC=CC(B(O)O)=C1 E2596 [0,2,0,0,0,0|1,0,1]=4 2611 B11R1.266 CCC1=CC=CC([N+](=O)[O-])=C1 E49272 [0,2,0,0,0,0|1,0,1]=4 2612 B11R1.266 COC1=CC(B(O)O)=CC=C1 M4280 [0,2,0,0,0,0|1,0,1]=4 2613 B11R1.266 COC1=CC(C(=N)N)=CC=C1 M49491 [0,2,0,0,0,0|2,0,0]=4 2614 B11R1.266 COC1=CC(C(=O)O)=CN=C1 M45836 [0,2,0,0,0,0|1,0,0]=3 2615 B11R1.266 COC1=CC(C(=O)O)=CN=N1 M19640 [0,2,0,0,0,0|2,0,0]=4 2616 B11R1.266 COC1=CC(C(=O)O)=NC=C1 M3752 [0,2,0,0,0,0|1,0,0]=3 2617 B11R1.266 COC1=CC(C(=O)O)=NC=N1 M23407 [0,2,0,0,0,0|2,0,0]=4 2618 B11R1.266 COC1=CC([C@H](C)O)=CC=C1 M50283 [0,2,0,0,0,0|1,0,1]=4 2619 B11R1.266 COC1=CC=CC(C(=O)O)=N1 M45837 [0,2,0,0,0,0|1,0,0]=3 2620 B11R1.266 COC1=CC=CC(C(C)=O)=C1 M27970 [0,2,0,0,0,0|1,0,0]=3 2621 B11R1.266 COC1=CC=CC(C(C)=O)=N1 A49277 [0,2,0,0,0,0|2,0,0]=4 2622 B11R1.266 COC1=CC=CC(C(N)=O)=N1 M39020 [0,2,0,0,0,0|2,0,0]=4 2623 B11R1.266 COC1=CN=CC(C(=O)O)=N1 M42788 [0,2,0,0,0,0|2,0,0]=4 2624 B11R1.266 COC1=NC=CC(C(=O)O)=C1 M12734 [0,2,0,0,0,0|1,0,0]=3 2625 B11R1.266 COC1=NC=CC(C(=O)O)=N1 M38982 [0,2,0,0,0,0|2,0,0]=4 2626 B11R1.266 CSC1=CC(B(O)O)=CC=C1 M4640 [0,2,0,0,0,0|1,0,1]=4 2627 B11R1.266 CSC1=CC(C(=O)O)=CC=C1 M49088 [0,2,0,0,0,0|0,0,0]=2 2628 B11R1.266 CSC1=NC(C(=O)O)=CC=N1 M28646 [0,2,0,0,0,0|2,0,0]=4 2629 B11R1.266 N#CC1=CC=CC(B(O)O)=C1 C2340 [0,2,0,0,0,0|1,0,1]=4 2630 B11R1.266 N#CC1=CC=CC(C(=O)Cl)=C1 C47437 [0,2,0,0,0,0|1,0,0]=3 2631 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 C39460 [0,2,0,0,0,0|0,0,0]=2 2632 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 C44350 [0,2,0,0,0,0|1,0,0]=3 2633 B11R1.266 N#CC1=CC=CC(C(N)=O)=C1 C47866 [0,2,0,0,0,0|1,0,0]=3 2634 B11R1.266 N#CC1=CC=CC(C(N)=O)=N1 C44865 [0,2,0,0,0,0|2,0,0]=4 2635 B11R1.266 N#CC1=CC=CC([N+](=O)[O-])=C1 N61918 [0,2,0,0,0,0|1,0,1]=4 2636 B11R1.266 N#CC1=NC=CC(C(=O)O)=C1 C20592 [0,2,0,0,0,0|1,0,0]=3 2637 B11R1.266 NC(=O)C1=CC(C=O)=CC=C1 F48454 [0,2,0,0,0,0|1,0,0]=3 2638 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 B39073 [0,2,0,0,0,0|1,0,0]=3 2639 B11R1.266 NCC1=CC=CC(B(O)O)=C1 A1260 [0,2,0,0,0,0|1,0,1]=4 2640 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 A49646 [0,2,0,0,0,0|0,0,0]=2 2641 B11R1.266 NCC1=CC=CC(C(N)=O)=C1 A46649 [0,2,0,0,0,0|1,0,0]=3 2642 B11R1.266 NNC1=NC=CC(C(=O)O)=C1 H12517 [0,2,0,0,0,0|1,0,0]=3 2643 B11R1.266 O=C(O)C1=CC(CO)=CC=C1 H62311 [0,2,0,0,0,0|0,0,0]=2 2644 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 H63529 [0,2,0,0,0,0|1,0,0]=3 2645 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 B38629 [0,2,0,0,0,0|0,0,0]=2 2646 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 C48590 [0,2,0,0,0,0|0,0,0]=2 2647 B11R1.266 O=C(O)C1=NC(CO)=CC=C1 H45841 [0,2,0,0,0,0|1,0,0]=3 2648 B11R1.266 O=CC1=CC(B(O)O)=CC=C1 F3520 [0,2,0,0,0,0|1,0,1]=4 2649 B11R1.266 O=CC1=CC=CC(C(=O)O)=C1 F27989 [0,2,0,0,0,0|0,0,0]=2 2650 B11R1.266 O=CC1=CC=CC(C(=O)O)=N1 F45004 [0,2,0,0,0,0|1,0,0]=3 2651 B11R1.266 O=CC1=CC=CC([N+](=O)[O-])=C1 N69085 [0,2,0,0,0,0|1,0,1]=4 2652 B11R1.266 O=[N+]([O-])C1=CC(CO)=CC=C1 N63272 [0,2,0,0,0,0|1,0,1]=4 2653 B11R1.266 O=[N+]([O-])C1=CC=CC(CBr)=C1 B45333 [0,2,0,0,0,0|1,0,1]=4 2654 B11R1.266 OB(O)C1=CC=CC(CBr)=C1 B46234 [0,2,0,0,0,0|1,0,1]=4 2655 B11R1.266 OCC1=CC(B(O)O)=CC=C1 H3700 [0,2,0,0,0,0|1,0,1]=4 2656 B9R1.13 O=C(O)CC1=CC=CO1 F42944 [0,0,1,1,0,0|1,0,1]=4 2657 B9R1.13 O=C(O)CC1=CC=CS1 T12816 [0,0,1,1,0,0|1,0,1]=4 2658 B9R1.13 O=C(O)CC1=CSC=C1 T12830 [0,0,1,1,0,0|1,0,1]=4 2659 B9R1.5 NC1=CC=CC=CC1=O A62027 [0,0,1,1,0,0|2,0,0]=4 2660 B9R2.50 C1=CC2=C(C=C1)CC2 B68912 [1,0,0,1,0,0|1,0,1]=4 2661 B11R2.10 BrC1=CC2=C(C=CC=C2)C1 B51041 [0,0,0,1,0,1|2,0,0]=4 2662 B11R2.10 BrC1=CC2=C(C=CC=C2)O1 B47828 [0,0,0,1,0,1|1,0,0]=3 2663 B11R2.10 BrC1=CC2=C(C=CC=C2)S1 B47534 [0,0,0,1,0,1|1,1,0]=4 2664 B11R2.10 BrC1=NC2=C(C=CC=C2)N1 B36657 [0,0,0,1,0,1|2,0,0]=4 2665 B11R2.10 BrC1=NC2=C(C=CC=C2)S1 B44414 [0,0,0,1,0,1|1,1,0]=4 2666 B11R2.10 CC1=CC2=C(C=CC=C2)C1 M38071 [0,0,0,1,0,1|2,0,0]=4 2667 B11R2.10 CC1=CC2=C(C=CC=C2)N1 M13893 [0,0,0,1,0,1|2,0,0]=4 2668 B11R2.10 CC1=CC2=C(C=CC=C2)S1 M51663 [0,0,0,1,0,1|1,1,0]=4 2669 B11R2.10 CC1=NC2=C(C=CC=C2)O1 M63131 [0,0,0,1,0,1|1,0,0]=3 2670 B11R2.10 CC1=NC2=C(C=CC=C2)S1 M39486 [0,0,0,1,0,1|1,1,0]=4 2671 B11R2.10 CC1=NC2=C(C=CC=N2)O1 M38652 [0,0,0,1,0,1|2,0,0]=4 2672 B11R2.10 ClC1=CC2=C(C=CC=C2)N1 C47956 [0,0,0,1,0,1|2,0,0]=4 2673 B11R2.10 ClC1=NC2=C(C=CC=C2)N1 C39352 [0,0,0,1,0,1|2,0,0]=4 2674 B11R2.10 ClC1=NC2=C(C=CC=C2)O1 C44527 [0,0,0,1,0,1|1,0,0]=3 2675 B11R2.10 ClC1=NC2=C(C=CC=C2)S1 C39328 [0,0,0,1,0,1|1,1,0]=4 2676 B11R2.10 ClC1=NC2=C(C=CC=N2)O1 C38306 [0,0,0,1,0,1|2,0,0]=4 2677 B11R2.10 ClC1=NC2=C(C=CC=N2)O1 C41854 [0,0,0,1,0,1|2,0,0]=4 2678 B11R2.10 IC1=CC2=C(C=CC=C2)N1 K47983 [0,0,0,1,0,1|2,0,0]=4 2679 B11R2.10 IC1=NC2=C(C=CC=C2)S1 K44444 [0,0,0,1,0,1|1,1,0]=4 2680 B11R2.10 NC1=CC2=C(C=CC=C2)S1 B39092 [0,0,0,1,0,1|1,1,0]=4 2681 B11R2.10 NC1=NC2=C(C=CC=C2)N1 K64925 [0,0,0,1,0,1|2,0,0]=4 2682 B11R2.10 NC1=NC2=C(C=CC=C2)O1 B45208 [0,0,0,1,0,1|1,0,0]=3 2683 B11R2.10 NC1=NC2=C(C=CN=C2)O1 X42470 [0,0,0,1,0,1|2,0,0]=4 2684 B11R2.10 NC1=NC2=C(C=NC=C2)O1 X42471 [0,0,0,1,0,1|2,0,0]=4 2685 B11R2.10 O=C1C=C2C=CC=CN2N1 P45223 [0,0,0,1,0,1|2,0,0]=4 2686 B11R2.10 O=C1CC2=C(C=CC=C2)C1 K24552 [0,0,0,1,0,1|1,0,0]=3 2687 B11R2.10 O=C1CC2=C(C=CC=N2)N1 D0382 [0,0,0,1,0,1|2,0,0]=4 2688 B11R2.10 O=C1CC2=C(C=CN=C2)N1 D0077 [0,0,0,1,0,1|2,0,0]=4 2689 B11R2.10 O=C1CC2=C(C=NC=C2)N1 D0383 [0,0,0,1,0,1|2,0,0]=4 2690 B11R2.10 O=C1CC2=C(N=CC=C2)N1 D0034 [0,0,0,1,0,1|2,0,0]=4 2691 B11R2.10 O=C1CC2=C(N=CC=C2)N1 D15765 [0,0,0,1,0,1|2,0,0]=4 2692 B11R2.10 O=C1CN2C=CC=CC2=N1 K46529 [0,0,0,1,0,1|2,0,0]=4 2693 B11R2.10 O=C1NC2=C(C=CC=C2)N1 H67954 [0,0,0,1,0,1|1,0,0]=3 2694 B11R2.10 O=C1NC2=C(C=CC=N2)O1 X39239 [0,0,0,1,0,1|1,0,0]=3 2695 B11R2.10 O=C1NC2=C(C=CC=N2)S1 T42138 [0,0,0,1,0,1|1,1,0]=4 2696 B11R2.10 O=C1NC2=C(C=NC=C2)N1 I38762 [0,0,0,1,0,1|2,0,0]=4 2697 B11R2.10 O=C1NC2=C(N=CC=C2)N1 K42475 [0,0,0,1,0,1|2,0,0]=4 2698 B11R2.10 O=C1OC2=C(C=CC=C2)O1 B44621 [0,0,0,1,0,1|0,0,0]=2 2699 B11R2.10 OC1=CN2C=CC=CC2=N1 K45215 [0,0,0,1,0,1|2,0,0]=4 2700 B11R2.10 OC1CC2=C(C=CC=C2)C1 D67665 [0,0,0,1,0,1|1,0,1]=4 2701 B11R2.10 S=C1NC2=C(C=CC=C2)N1 B69662 [0,0,0,1,0,1|1,1,0]=4 2702 B11R2.10 S=C1NC2=C(C=CC=C2)S1 B69039 [0,0,0,1,0,1|0,2,0]=4 2703 B11R2.10 S=C1NC2=C(C=CC=N2)O1 X42139 [0,0,0,1,0,1|1,1,0]=4 2704 B11R2.10 SC1=NC2=C(C=CC=N2)O1 X42137 [0,0,0,1,0,1|1,1,0]=4 2705 B11R2.34 FC1=CC=C([C@@H]2CO2)C=C1 F62188 [0,1,0,1,0,0|1,0,1]=4 2706 B11R2.1 BrC1=COC2=C1C=CC=C2 B47829 [0,1,0,1,0,0|1,0,0]=3 2707 B11R2.1 BrC1=CSC2=C1C=CC=C2 B47535 [0,1,0,1,0,0|1,1,0]=4 2708 B11R2.1 BrC1=NNC2=C1C=CC=C2 B0436 [0,1,0,1,0,0|2,0,0]=4 2709 B11R2.1 BrC1=NOC2=C1C=CC=N2 B41851 [0,1,0,1,0,0|2,0,0]=4 2710 B11R2.1 CC1=CCC2=C1C=CC=C2 M52270 [0,1,0,1,0,0|2,0,0]=4 2711 B11R2.1 CC1=CNC2=C1C=CC=C2 M13894 [0,1,0,1,0,0|2,0,0]=4 2712 B11R2.1 CC1=NNC2=C1C=CC=C2 M1829 [0,1,0,1,0,0|2,0,0]=4 2713 B11R2.1 CC1=NOC2=C1C=CC=C2 M68053 [0,1,0,1,0,0|1,0,0]=3 2714 B11R2.1 ClC1=NNC2=C1C=CC=C2 C44767 [0,1,0,1,0,0|2,0,0]=4 2715 B11R2.1 ClC1=NOC2=C1C=CC=C2 C44531 [0,1,0,1,0,0|1,0,0]=3 2716 B11R2.1 ClC1=NOC2=CC=CN=C21 C41855 [0,1,0,1,0,0|2,0,0]=4 2717 B11R2.1 ClC1=NSC2=C1C=CC=C2 C25325 [0,1,0,1,0,0|1,1,0]=4 2718 B11R2.1 FC1=NNC2=C1C=CC=C2 F39022 [0,1,0,1,0,0|2,0,0]=4 2719 B11R2.1 IC1=NNC2=C1C=CC=C2 X9686 [0,1,0,1,0,0|2,0,0]=4 2720 B11R2.1 NC1=NCC2=C1C=CC=C2 K49609 [0,1,0,1,0,0|2,0,0]=4 2721 B11R2.1 NC1=NCC2=C1C=CC=C2 K64548 [0,1,0,1,0,0|2,0,0]=4 2722 B11R2.1 NC1=NOC2=C1C=CC=C2 B45214 [0,1,0,1,0,0|1,0,0]=3 2723 B11R2.1 NC1=NOC2=C1C=CN=C2 K42473 [0,1,0,1,0,0|2,0,0]=4 2724 B11R2.1 NC1=NOC2=C1N=CC=C2 A11385 [0,1,0,1,0,0|2,0,0]=4 2725 B11R2.1 NC1=NOC2=NC=CC=C12 K42472 [0,1,0,1,0,0|2,0,0]=4 2726 B11R2.1 NC1=NSC2=C1C=CC=C2 B69175 [0,1,0,1,0,0|1,1,0]=4 2727 B11R2.1 O=C1CCC2=C1C=CC=N2 D5364 [0,1,0,1,0,0|2,0,0]=4 2728 B11R2.1 O=C1CCC2=C1C=CN=C2 C23220 [0,1,0,1,0,0|2,0,0]=4 2729 B11R2.1 O=C1CCC2=C1C=NC=C2 C24049 [0,1,0,1,0,0|2,0,0]=4 2730 B11R2.1 O=C1CCC2=CC=CN=C12 C48452 [0,1,0,1,0,0|2,0,0]=4 2731 B11R2.1 O=C1COC2=C1C=CN=C2 F37015 [0,1,0,1,0,0|1,0,0]=3 2732 B11R2.1 O=C1NCC2=C1C=CC=C2 I12007 [0,1,0,1,0,0|1,0,0]=3 2733 B11R2.1 O=C1NCC2=C1C=CC=N2 D45227 [0,1,0,1,0,0|2,0,0]=4 2734 B11R2.1 O=C1NCC2=C1C=NC=C2 D1721 [0,1,0,1,0,0|2,0,0]=4 2735 B11R2.1 O=C1NN=C2C=CC=CN12 T42480 [0,1,0,1,0,0|2,0,0]=4 2736 B11R2.1 O=C1NNC2=C1C=CC=N2 P42478 [0,1,0,1,0,0|2,0,0]=4 2737 B11R2.1 O=C1NNC2=C1C=CN=C2 P42479 [0,1,0,1,0,0|2,0,0]=4 2738 B11R2.1 O=C1OCC2=C1C=CC=N2 F44926 [0,1,0,1,0,0|1,0,0]=3 2739 B11R2.1 O=[S@]1C=NC2=C1C=CC=C2 B45069 [0,1,0,1,0,0|2,0,0]=4 2740 B11R2.1 OB1OCC2=C1C=CC=C2 H3680 [0,1,0,1,0,0|1,0,1]=4 2741 B11R2.1 OC1=COC2=C1N=CC=C2 F32399 [0,1,0,1,0,0|1,0,1]=4 2742 B11R2.1 O[C@@H]1CCC2=C1C=CC=C2 D68576 [0,1,0,1,0,0|1,0,1]=4 2743 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D60804 [0,1,0,1,0,0|1,0,1]=4 2744 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 D68574 [0,1,0,1,0,0|1,0,1]=4 2745 B11R2.988 OC[C@H]1CC2=C1C=CC=C2 B49879 [0,1,0,1,0,0|1,0,1]=4 2746 B7R1.1 C=CC1=CC=CS1 V38168 [1,0,0,0,1,0|2,0,0]=4 2747 B7R1.1 O=CC1=CC=CN1 P64891 [1,0,0,0,1,0|1,0,0]=3 2748 B7R1.1 O=CC1=CC=CS1 T68614 [1,0,0,0,1,0|1,0,0]=3 2749 B7R1.1 O=CC1=CC=NO1 K40060 [1,0,0,0,1,0|2,0,0]=4 2750 B7R1.1 O=CC1=CN=CO1 X11928 [1,0,0,0,1,0|2,0,0]=4 2751 B7R1.1 O=CC1=CN=CS1 T2161 [1,0,0,0,1,0|2,0,0]=4 2752 B7R1.1 O=CC1=CNC=C1 P25022 [1,0,0,0,1,0|1,0,0]=3 2753 B7R1.1 O=CC1=CNN=C1 P0675 [1,0,0,0,1,0|2,0,0]=4 2754 B7R1.1 O=CC1=CNN=C1 P7759 [1,0,0,0,1,0|2,0,0]=4 2755 B7R1.1 O=CC1=COC=C1 F65465 [1,0,0,0,1,0|1,0,0]=3 2756 B7R1.1 O=CC1=CSC=C1 T12697 [1,0,0,0,1,0|1,0,0]=3 2757 B7R1.1 O=CC1=CSC=N1 T2159 [1,0,0,0,1,0|2,0,0]=4 2758 B7R1.1 O=CC1=NC=CN1 F2135 [1,0,0,0,1,0|2,0,0]=4 2759 B7R1.1 O=CC1=NC=CS1 T2877 [1,0,0,0,1,0|2,0,0]=4 2760 B7R1.1 O=CC1=NNC=C1 P23454 [1,0,0,0,1,0|2,0,0]=4 2761 B7R1.1 O=CC1=NOC=C1 I0114 [1,0,0,0,1,0|2,0,0]=4 2762 B7R1.1 OCC1=CC=CS1 T12815 [1,0,0,0,1,0|1,0,1]=4 2763 B7R1.1 OCC1=COC=C1 F41115 [1,0,0,0,1,0|1,0,1]=4 2764 B7R1.1 OCC1=CSC=C1 T12827 [1,0,0,0,1,0|1,0,1]=4 2765 B11R1.91 CC(=O)NNC1=CC=CC=C1 P69088 [0,0,0,0,0,2|1,0,0]=3 2766 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 P68564 [0,0,0,0,0,2|1,0,0]=3 2767 B11R1.91 NC(=O)CSC1=CC=CC=C1 P10024 [0,0,0,0,0,2|1,0,0]=3 2768 B11R1.91 NC(=O)OCC1=CC=CC=C1 B37832 [0,0,0,0,0,2|1,0,0]=3 2769 B11R1.91 NC(=O)\C=C\C1=CC=CC=C1 C61979 [0,0,0,0,0,2|1,0,0]=3 2770 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 H52037 [0,0,0,0,0,2|1,0,0]=3 2771 B11R1.91 O=C(O)C#CC1=CC=CC=C1 P67832 [0,0,0,0,0,2|0,0,0]=2 2772 B11R1.91 O=C(O)C#CC1=CN=CC=C1 P47713 [0,0,0,0,0,2|1,0,0]=3 2773 B11R1.91 O=C(O)C=CC1=CN=CC=C1 P48460 [0,0,0,0,0,2|1,0,0]=3 2774 B11R1.91 O=C(O)C=CC1=NC=CC=C1 P48456 [0,0,0,0,0,2|1,0,0]=3 2775 B11R1.91 O=C(O)CCC1=CN=NC=C1 P60455 [0,0,0,0,0,2|2,0,0]=4 2776 B11R1.91 O=C(O)CCC1=NC=CC=C1 P49281 [0,0,0,0,0,2|1,0,0]=3 2777 B11R1.91 O=C(O)CNC1=CC=CC=C1 P68874 [0,0,0,0,0,2|0,0,0]=2 2778 B11R1.91 O=C(O)CNC1=CN=CC=C1 P46005 [0,0,0,0,0,2|1,0,0]=3 2779 B11R1.91 O=C(O)COC1=CC=NC=C1 P45840 [0,0,0,0,0,2|1,0,0]=3 2780 B11R1.91 O=C(O)COC1=CN=CC=C1 P45834 [0,0,0,0,0,2|1,0,0]=3 2781 B11R1.91 O=C(O)CSC1=CC=NC=C1 P68840 [0,0,0,0,0,2|1,0,0]=3 2782 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 C37831 [0,0,0,0,0,2|0,0,0]=2 2783 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 P69501 [0,0,0,0,0,2|1,0,0]=3 2784 B11R1.91 O=C(O)\C=C\C1=CN=CC=C1 P48463 [0,0,0,0,0,2|1,0,0]=3 2785 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 N69452 [0,0,0,0,0,2|1,0,1]=4 2786 B11R1.91 OB(O)CCC1=CC=CC=C1 P4926 [0,0,0,0,0,2|1,0,1]=4 2787 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 P4986 [0,0,0,0,0,2|1,0,1]=4