0 B9R1.6 CC(=O)C1=CSCCN1 8361AA [0,0,0,0,0,0|2,0,2]=4 1 B9R1.6 CC(Cl)C1=CC=CC=C1 U237 [0,0,0,0,0,0|1,0,1]=2 2 B9R1.6 CC(Cl)C1=NC=CN=C1 Z2354 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.6 CN(C)C1=CC=NC=C1 6487AL [0,0,0,0,0,0|3,0,0]=3 4 B9R1.6 CN(C)C1=NC=CC=C1 8318AB [0,0,0,0,0,0|3,0,0]=3 5 B9R1.6 CN(C)C1=NC=NC=C1 3385AB [0,0,0,0,0,0|4,0,0]=4 6 B9R1.6 CN(N)C1=CN=CC=N1 1013AJ [0,0,0,0,0,0|4,0,0]=4 7 B9R1.6 CP(C)C1=CC=CC=C1 7271AL [0,0,0,0,0,0|2,0,0]=2 8 B9R1.6 CS(=O)C1=NC=CC=C1 7769AJ [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 CS(=O)C1=NC=CC=N1 7770AJ [0,0,0,0,0,0|3,0,0]=3 10 B9R1.6 C[C@@H](N)C1=CC=CC=N1 6298AA [0,0,0,0,0,0|2,0,1]=3 11 B9R1.6 C[C@@H](N)C1=CC=CN=C1 8353AH [0,0,0,0,0,0|2,0,1]=3 12 B9R1.6 C[C@H](N)C1=CC=NC=C1 4830AJ [0,0,0,0,0,0|2,0,1]=3 13 B9R1.6 ClB(Cl)C1=CC=CC=C1 Z8862 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.6 Cl[IH2](Cl)C1=CC=CC=C1 Y1609 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.6 FC(F)C1=CC=NC=C1 0239AF [0,0,0,0,0,0|3,0,1]=4 16 B9R1.6 N=C(N)C1=CC=CC=C1 9278AB [0,0,0,0,0,0|2,0,0]=2 17 B9R1.6 N=C(N)C1=NC=CC=N1 6289AB [0,0,0,0,0,0|4,0,0]=4 18 B9R1.6 NC(=O)C1=CC=NN=C1 Z3384 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.6 NC(=O)C1=CN=CC=C1 1853AE [0,0,0,0,0,0|2,0,0]=2 20 B9R1.6 NC(=O)C1=NC=CC=N1 Z3390 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.6 O=C(O)C1C=CCC=C1 Y5447 [0,0,0,0,0,0|1,0,2]=3 22 B9R1.6 O=C(S)C1=CN=CC=C1 9152AL [0,0,0,0,0,0|2,0,0]=2 23 B9R1.6 O=C([O-])C1=CC=NC=N1 2020AH [0,0,0,0,0,0|3,0,0]=3 24 B9R1.6 O=C([O-])C1=NC=CC=C1 8839AL [0,0,0,0,0,0|2,0,0]=2 25 B9R1.6 OB(O)C1=NC=CC=C1 X0604 [0,0,0,0,0,0|3,0,1]=4 26 B8R1.2 BrCC1=CC=NC=C1 V2331 [1,0,0,0,0,0|2,0,1]=4 27 B8R1.2 Br[Se]C1=CC=CC=C1 8804AL [1,0,0,0,0,0|2,0,0]=3 28 B8R1.2 C=CC1=NC=CN=C1 R581 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.2 CC[N+]1=CC=CC=C1 E438 [1,0,0,0,0,0|1,0,1]=3 30 B8R1.2 CNC1=CN=CN=C1 5460AB [1,0,0,0,0,0|3,0,0]=4 31 B8R1.2 COC1=CC=NN=C1 Z5489 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.2 FCC1=CC=NC=C1 2557AL [1,0,0,0,0,0|2,0,1]=4 33 B8R1.2 ICC1=CN=CC=C1 5715AJ [1,0,0,0,0,0|2,0,1]=4 34 B8R1.2 NCC1=CC=CC=C1 7149AL [1,0,0,0,0,0|1,0,1]=3 35 B8R1.2 NNC1=CC=NC=C1 0864AQ [1,0,0,0,0,0|3,0,0]=4 36 B8R1.2 NOC1=CC=CC=C1 X4801 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 O=CC1=CN=NC=C1 7044AB [1,0,0,0,0,0|2,0,0]=3 38 B8R1.2 O=CC1=NC=CC=N1 Y3220 [1,0,0,0,0,0|2,0,0]=3 39 B8R1.2 O=[As]C1=CC=CC=C1 7620AF [1,0,0,0,0,0|1,0,0]=2 40 B8R1.2 ONC1=CC=CC=C1 0019AQ [1,0,0,0,0,0|1,0,1]=3 41 B8R1.2 SCC1=CC=CN=C1 Z2753 [1,0,0,0,0,0|1,1,1]=4 42 B10R1.13 C=C(C)C1=CC=C(C)C=C1 3347AA [0,1,0,0,0,0|1,0,0]=2 43 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,1,0,0,0,0|1,0,0]=2 44 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,1,0,0,0,0|0,0,0]=1 45 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,1,0,0,0,0|1,0,0]=2 46 B10R1.13 CC(=O)C1=CN=C(O)C=N1 2581AA [0,1,0,0,0,0|2,0,0]=3 47 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 0919AB [0,1,0,0,0,0|2,0,0]=3 48 B10R1.13 CC(Br)C1=CC=C(Br)C=C1 1606AL [0,1,0,0,0,0|1,0,1]=3 49 B10R1.13 CC(C)C1=CC=C(O)C=N1 0499AA [0,1,0,0,0,0|2,0,1]=4 50 B10R1.13 CC(C)C1=CC=C(S)C=C1 L740 [0,1,0,0,0,0|1,0,1]=3 51 B10R1.13 CC(C)C1=CN=C(N)C=C1 W7287 [0,1,0,0,0,0|2,0,1]=4 52 B10R1.13 CC(N)C1=CC=C(I)C=C1 4982AC [0,1,0,0,0,0|1,0,1]=3 53 B10R1.13 CC(N)C1=CC=C(N)C=C1 2415AJ [0,1,0,0,0,0|1,0,1]=3 54 B10R1.13 CC(N)C1=NC=C(Br)C=C1 3774AC [0,1,0,0,0,0|2,0,1]=4 55 B10R1.13 CC(N)C1=NC=C(F)C=C1 5402AC [0,1,0,0,0,0|2,0,1]=4 56 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [0,1,0,0,0,0|1,0,0]=2 57 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [0,1,0,0,0,0|2,0,1]=4 58 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [0,1,0,0,0,0|2,0,1]=4 59 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 5443AB [0,1,0,0,0,0|1,0,1]=3 60 B10R1.13 CC1=CC=C([S@@](C)=O)C=C1 N143 [0,1,0,0,0,0|1,0,0]=2 61 B10R1.13 CC1=NN=C(C(=O)O)C=C1 Y9703 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6241AL [0,1,0,0,0,0|3,0,0]=4 63 B10R1.13 CN(C)C1=CC=[N+]([O-])C=C1 6486AL [0,1,0,0,0,0|3,0,0]=4 64 B10R1.13 CN(C)C1=NC=C(N)C=C1 6679AB [0,1,0,0,0,0|3,0,0]=4 65 B10R1.13 CN(C)C1=NC=C(N)C=C1 W5002 [0,1,0,0,0,0|3,0,0]=4 66 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 X4561 [0,1,0,0,0,0|1,0,1]=3 67 B10R1.13 C[C@@H](N)C1=CC=C(O)C=C1 X3988 [0,1,0,0,0,0|1,0,1]=3 68 B10R1.13 C[C@@H](O)C1=CC=C(F)C=C1 0354AA [0,1,0,0,0,0|0,0,2]=3 69 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 7591AD [0,1,0,0,0,0|1,0,1]=3 70 B10R1.13 C[C@H](O)C1=CC=C(F)C=C1 0357AA [0,1,0,0,0,0|0,0,2]=3 71 B10R1.13 N=C(N)C1=CC=C(I)C=C1 2844AJ [0,1,0,0,0,0|2,0,0]=3 72 B10R1.13 N=C(N)C1=CC=C(N)C=C1 W8418 [0,1,0,0,0,0|2,0,0]=3 73 B10R1.13 NC(=O)C1=NC=C(N)C=N1 8288AB [0,1,0,0,0,0|3,0,0]=4 74 B10R1.13 NC(=O)C1=NN=C(O)C=C1 6449AJ [0,1,0,0,0,0|3,0,0]=4 75 B10R1.13 NC(=S)C1=CN=C(Cl)C=C1 3526AJ [0,1,0,0,0,0|2,1,0]=4 76 B10R1.13 NC(=S)C1=CN=C(N)C=C1 7552AB [0,1,0,0,0,0|2,1,0]=4 77 B10R1.13 NC1=CC=C(C(=O)O)C=N1 3422AJ [0,1,0,0,0,0|2,0,0]=3 78 B10R1.13 NC1=CC=C(C(F)F)C=C1 Z1981 [0,1,0,0,0,0|2,0,1]=4 79 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 7653AF [0,1,0,0,0,0|2,0,0]=3 80 B10R1.13 NC1=CN=C(C(=O)O)N=C1 Z4892 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.13 O=C(O)C1=CN=C(O)N=C1 W5910 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.13 O=C([O-])C1=NN=C(Cl)C=C1 Y4602 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.13 O=S(O)C1=CC=C(Br)C=C1 3348AA [0,1,0,0,0,0|2,0,0]=3 84 B10R1.13 O=[N+]([O-])C1=NC=C(O)C=C1 W3318 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.13 O=[PH](O)C1=CC=C(Br)C=C1 5127AB [0,1,0,0,0,0|2,0,0]=3 86 B10R1.15 C#CC(=O)C1=CC=CC=C1 0047AQ [0,1,0,0,0,0|0,0,1]=2 87 B10R1.15 C#C[C@@H](O)C1=CC=CC=C1 4800AJ [0,1,0,0,0,0|0,0,3]=4 88 B10R1.15 C#C[C@H](O)C1=CC=CC=C1 4836AJ [0,1,0,0,0,0|0,0,3]=4 89 B10R1.15 C=C(CBr)C1=CC=CC=C1 Z4610 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.15 CCC(=O)C1=CC=NC=C1 8726AA [0,1,0,0,0,0|1,0,0]=2 91 B10R1.15 CCC(=O)C1=NC=CN=C1 7151AB [0,1,0,0,0,0|2,0,0]=3 92 B10R1.15 CCC(Cl)C1=CC=CC=C1 1017AL [0,1,0,0,0,0|1,0,1]=3 93 B10R1.15 CCC(N)C1=CC=CC=C1 8188AD [0,1,0,0,0,0|1,0,1]=3 94 B10R1.15 CCC(N)C1=CC=CN=C1 4943AJ [0,1,0,0,0,0|2,0,1]=4 95 B10R1.15 CCC(N)C1=CC=CN=C1 4945AJ [0,1,0,0,0,0|2,0,1]=4 96 B10R1.15 CN(N=O)C1=CC=CC=C1 8617AL [0,1,0,0,0,0|1,0,0]=2 97 B10R1.15 COC(=N)C1=NC=CN=C1 9109AE [0,1,0,0,0,0|3,0,0]=4 98 B10R1.15 COC(=O)N1C=CC=CC1 3960AB [0,1,0,0,0,0|1,0,1]=3 99 B10R1.15 C[C@H](CO)C1=CC=CC=C1 4835AB [0,1,0,0,0,0|0,0,2]=3 100 B10R1.15 C\C(=N/N)C1=CC=CC=C1 1678AL [0,1,0,0,0,0|1,0,0]=2 101 B10R1.15 FC(CBr)C1=CC=CC=C1 9366AA [0,1,0,0,0,0|1,0,1]=3 102 B10R1.15 NC(CF)C1=CC=CC=C1 0514AQ [0,1,0,0,0,0|1,0,1]=3 103 B10R1.15 NC(CO)C1=CC=CN=C1 W5825 [0,1,0,0,0,0|2,0,1]=4 104 B10R1.15 NC(CO)C1=CC=NC=C1 1467AJ [0,1,0,0,0,0|2,0,1]=4 105 B10R1.15 NCC(=O)C1=CN=CC=C1 1455AJ [0,1,0,0,0,0|1,0,0]=2 106 B10R1.15 NCC(O)C1=CC=CC=N1 1453AJ [0,1,0,0,0,0|1,0,2]=4 107 B10R1.15 NCC(O)C1=CC=CN=C1 5133AH [0,1,0,0,0,0|1,0,2]=4 108 B10R1.15 NCC(O)C1=NC=CC=C1 9384AJ [0,1,0,0,0,0|1,0,2]=4 109 B10R1.15 NC[C@@H](F)C1=CC=CC=C1 0407AQ [0,1,0,0,0,0|1,0,1]=3 110 B10R1.15 NC[C@H](O)C1=CC=CN=C1 Z3832 [0,1,0,0,0,0|1,0,2]=4 111 B10R1.15 NNC(=O)C1=CC=NC=N1 Y5417 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.15 NNC(=O)C1=CN=CN=C1 5591AB [0,1,0,0,0,0|3,0,0]=4 113 B10R1.15 O=C(CBr)C1=CC=NC=C1 9348AB [0,1,0,0,0,0|1,0,0]=2 114 B10R1.15 O=C(CBr)C1=CN=CC=C1 9347AB [0,1,0,0,0,0|1,0,0]=2 115 B10R1.15 O=C(CBr)C1=NC=CN=C1 Z2340 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.15 O=C(CCl)C1=CC=NC=C1 5498AJ [0,1,0,0,0,0|1,0,0]=2 117 B10R1.15 O=C(N[O-])C1=CC=CC=C1 8985AL [0,1,0,0,0,0|1,0,0]=2 118 B10R1.15 OC(CBr)C1=CC=CC=C1 W4218 [0,1,0,0,0,0|0,0,2]=3 119 B10R1.28 CC(C)(N)C1=CC=NC=C1 5311AJ [0,1,0,0,0,0|2,0,1]=4 120 B10R1.28 CC(F)(F)C1=CC=NC=C1 9493AC [0,1,0,0,0,0|2,0,1]=4 121 B10R1.28 CC(F)(F)C1=CN=CC=C1 9489AC [0,1,0,0,0,0|2,0,1]=4 122 B10R1.28 CC(F)(F)C1=NC=CC=C1 9488AC [0,1,0,0,0,0|2,0,1]=4 123 B10R1.28 CS(=O)(=O)C1=NC=CC=C1 Y7797 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.28 C[Sn](C)(C)C1=CC=CC=N1 9304AL [0,1,0,0,0,0|3,0,0]=4 125 B10R1.28 Cl[Ge](Cl)(Cl)C1=CC=CC=C1 8821AL [0,1,0,0,0,0|2,1,0]=4 126 B10R1.28 NS(=O)(=O)C1=CC=NC=C1 7561AE [0,1,0,0,0,0|3,0,0]=4 127 B10R1.28 O=S(=O)(Cl)C1=[NH+]C=CC=C1 Y7048 [0,1,0,0,0,0|3,0,0]=4 128 B10R1.28 O=S(=O)(O)C1=CC=CC=C1 Z8042 [0,1,0,0,0,0|2,0,0]=3 129 B10R1.28 O=S(=O)(O)C1=CC=NC=C1 Y9394 [0,1,0,0,0,0|3,0,0]=4 130 B10R1.28 O=S(=O)([O-])C1=CC=CC=C1 5121AF [0,1,0,0,0,0|2,0,0]=3 131 B10R1.61 C=C(C)C1=C(C)C=CC=C1 5671AL [0,1,0,0,0,0|1,0,0]=2 132 B10R1.61 CC(=O)C1=C(O)C=NC=C1 Z4577 [0,1,0,0,0,0|1,0,0]=2 133 B10R1.61 CC(=O)C1=CC=CNC1=O W7482 [0,1,0,0,0,0|1,0,0]=2 134 B10R1.61 CC(=O)C1=NC=CC=C1Cl 5776AA [0,1,0,0,0,0|1,0,0]=2 135 B10R1.61 CC(=O)C1=NC=CC=C1O Z4085 [0,1,0,0,0,0|1,0,0]=2 136 B10R1.61 CC(Br)C1=CC=CC=C1F Y9030 [0,1,0,0,0,0|1,0,1]=3 137 B10R1.61 CC(N)C1=CC=CC=C1Br Z7493 [0,1,0,0,0,0|1,0,1]=3 138 B10R1.61 CC(O)C1=C(Cl)C=CC=C1 6296AA [0,1,0,0,0,0|0,0,2]=3 139 B10R1.61 CC(O)C1=CC=CN=C1N 9393AH [0,1,0,0,0,0|1,0,2]=4 140 B10R1.61 CC1=C(C(=N)N)N=CC=C1 2362AJ [0,1,0,0,0,0|3,0,0]=4 141 B10R1.61 CC1=C(C(=O)O)N=CC=C1 4521AA [0,1,0,0,0,0|2,0,0]=3 142 B10R1.61 CC1=C(C(C)C)C=CC=C1 8715AL [0,1,0,0,0,0|1,0,1]=3 143 B10R1.61 CC1=C(C(N)=S)N=CC=C1 0825AQ [0,1,0,0,0,0|2,1,0]=4 144 B10R1.61 CC1=C([C@@H](C)N)C=CC=C1 3317AC [0,1,0,0,0,0|1,0,1]=3 145 B10R1.61 CC1=C([N+](=O)[O-])C=NC=C1 3324AC [0,1,0,0,0,0|3,0,0]=4 146 B10R1.61 CC1=CC=CN=C1C(C)N 9674AE [0,1,0,0,0,0|2,0,1]=4 147 B10R1.61 CC1=CC=CN=C1C(N)=O 3720AF [0,1,0,0,0,0|2,0,0]=3 148 B10R1.61 CC1=CCC=CC1C(=O)O 0416AQ [0,1,0,0,0,0|1,0,2]=4 149 B10R1.61 CC1=NC=CN=C1S(C)=O 7966AJ [0,1,0,0,0,0|3,0,0]=4 150 B10R1.61 CN(C)C1=C(Br)C=NC=C1 2989AC [0,1,0,0,0,0|3,0,0]=4 151 B10R1.61 CN(C)C1=C(N)C=CC=N1 4383AE [0,1,0,0,0,0|3,0,0]=4 152 B10R1.61 CS(=O)C1=CC=CC=C1Br 8910AE [0,1,0,0,0,0|1,0,0]=2 153 B10R1.61 CS(=O)C1=CC=CC=C1O Z7171 [0,1,0,0,0,0|1,0,0]=2 154 B10R1.61 C[C@@H](N)C1=C(Br)C=CC=C1 8346AH [0,1,0,0,0,0|1,0,1]=3 155 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br 2344AA [0,1,0,0,0,0|1,0,1]=3 156 B10R1.61 C[C@@H](N)C1=CC=CC=C1F X9177 [0,1,0,0,0,0|1,0,1]=3 157 B10R1.61 C[C@@H](O)C1=C(Br)C=CC=C1 N446 [0,1,0,0,0,0|0,0,2]=3 158 B10R1.61 C[C@H](N)C1=CC=CC=C1Br Z4151 [0,1,0,0,0,0|1,0,1]=3 159 B10R1.61 C[C@H](O)C1=C(F)C=CC=C1 8791AA [0,1,0,0,0,0|0,0,2]=3 160 B10R1.61 C[C@H](O)C1=CC=CC=C1Br N448 [0,1,0,0,0,0|0,0,2]=3 161 B10R1.61 C[C@H](O)C1=CC=CN=C1N 5914AC [0,1,0,0,0,0|1,0,2]=4 162 B10R1.61 N=C(N)C1=C(Br)C=CC=C1 1622AJ [0,1,0,0,0,0|2,0,0]=3 163 B10R1.61 N=C(N)C1=C(F)C=CC=N1 2279AJ [0,1,0,0,0,0|3,0,0]=4 164 B10R1.61 N=C(N)C1=CC=CC=C1F 1049AC [0,1,0,0,0,0|2,0,0]=3 165 B10R1.61 N=C(N)C1=CC=CNC1=O 1879AF [0,1,0,0,0,0|3,0,0]=4 166 B10R1.61 NC(=O)C1=C(Br)N=CC=C1 W9002 [0,1,0,0,0,0|2,0,0]=3 167 B10R1.61 NC(=O)C1=C(Cl)C=CN=C1 Y3257 [0,1,0,0,0,0|2,0,0]=3 168 B10R1.61 NC(=O)C1=C(N)N=CN=C1 Z2814 [0,1,0,0,0,0|3,0,0]=4 169 B10R1.61 NC(=S)C1=CC=CC=C1Br 1055AQ [0,1,0,0,0,0|1,1,0]=3 170 B10R1.61 NC1=C([N+](=O)[O-])C=CN=C1 Z4105 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.61 NC1=CN=CN=C1C(=O)O 8941AB [0,1,0,0,0,0|3,0,0]=4 172 B10R1.61 O=C(O)C1=C(I)C=NC=C1 Y5476 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.61 O=C(O)C1=NC=CN=C1Br W9637 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.61 O=C(O)C1=NC=CN=C1I W4424 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.61 O=[N+]([O-])C1=C(F)C=CN=C1 Z7729 [0,1,0,0,0,0|3,0,0]=4 176 B10R1.61 O=[N+]([O-])C1=C(I)C=NC=C1 5896AJ [0,1,0,0,0,0|3,0,0]=4 177 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 W6093 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.113 CC(=O)C1=CC(C)=NC=N1 W7770 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.113 CC(=O)C1=CC(F)=CN=C1 3535AA [0,1,0,0,0,0|1,0,0]=2 180 B10R1.113 CC(=O)C1=NC(F)=CC=C1 6832AB [0,1,0,0,0,0|1,0,0]=2 181 B10R1.113 CC(=O)C1=NC(N)=NC=C1 8301AC [0,1,0,0,0,0|2,0,0]=3 182 B10R1.113 CC(C)C1=CC=CC(Cl)=N1 Y3806 [0,1,0,0,0,0|2,0,1]=4 183 B10R1.113 CC(C)C1=CC=CC(N)=N1 W8437 [0,1,0,0,0,0|2,0,1]=4 184 B10R1.113 CC(C)C1=NC=CC(Cl)=C1 6890AC [0,1,0,0,0,0|2,0,1]=4 185 B10R1.113 CC(N)C1=CC(O)=CC=C1 Y9690 [0,1,0,0,0,0|1,0,1]=3 186 B10R1.113 CC(N)C1=CC=CC(Cl)=C1 V5733 [0,1,0,0,0,0|1,0,1]=3 187 B10R1.113 CC1=CC(C(=N)N)=CC=C1 2354AJ [0,1,0,0,0,0|2,0,0]=3 188 B10R1.113 CC1=CC(C(C)N)=NC=C1 5999AE [0,1,0,0,0,0|2,0,1]=4 189 B10R1.113 CC1=CC(C(N)=O)=NC=C1 5258AE [0,1,0,0,0,0|2,0,0]=3 190 B10R1.113 CC1=CC(C(N)=S)=NC=C1 5196AD [0,1,0,0,0,0|2,1,0]=4 191 B10R1.113 CC1=CC(N(C)C)=NC=C1 0347AB [0,1,0,0,0,0|3,0,0]=4 192 B10R1.113 CC1=CC([N+](=O)[O-])=CN=C1 Y9848 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.113 CC1=CC=CC(C(C)C)=C1 5135AE [0,1,0,0,0,0|1,0,1]=3 194 B10R1.113 CC1=NC(C(=O)O)=NC=C1 Z5358 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.113 CC1=NC(C(C)N)=CC=C1 9513AH [0,1,0,0,0,0|2,0,1]=4 196 B10R1.113 CC1=NC(C(N)=O)=NC=C1 6042AA [0,1,0,0,0,0|3,0,0]=4 197 B10R1.113 CN(C)C1=CC=CC(Cl)=N1 8284AC [0,1,0,0,0,0|3,0,0]=4 198 B10R1.113 CN(C)C1=CC=CC(N)=C1 2773AB [0,1,0,0,0,0|2,0,0]=3 199 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 W5401 [0,1,0,0,0,0|1,0,1]=3 200 B10R1.113 C[C@@H](N)C1=CC=CC(F)=C1 Z5107 [0,1,0,0,0,0|1,0,1]=3 201 B10R1.113 C[C@@H](O)C1=CC(Cl)=CC=C1 3482AA [0,1,0,0,0,0|0,0,2]=3 202 B10R1.113 C[C@@H](O)C1=CC=CC(F)=C1 5245AA [0,1,0,0,0,0|0,0,2]=3 203 B10R1.113 C[C@H](N)C1=CC=CC(F)=C1 W5400 [0,1,0,0,0,0|1,0,1]=3 204 B10R1.113 C[C@H](O)C1=CC(Br)=CC=C1 6219AA [0,1,0,0,0,0|0,0,2]=3 205 B10R1.113 C[C@H](O)C1=CC(F)=CC=C1 5244AA [0,1,0,0,0,0|0,0,2]=3 206 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 7814AH [0,1,0,0,0,0|2,0,0]=3 207 B10R1.113 FC1=CC(C(Br)Br)=CC=C1 O150 [0,1,0,0,0,0|2,0,1]=4 208 B10R1.113 FC1=CC=CC(C(F)F)=C1 8582AD [0,1,0,0,0,0|2,0,1]=4 209 B10R1.113 N=C(N)C1=CC=CC(Br)=C1 2211AJ [0,1,0,0,0,0|2,0,0]=3 210 B10R1.113 NC(=O)C1=NC(F)=CC=C1 V5539 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.113 NC(=S)C1=CC(N)=NC=C1 4163AC [0,1,0,0,0,0|2,1,0]=4 212 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 Z2563 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.113 O=C(O)C1=CN=CC(I)=C1 Z4205 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.113 O=C(O)C1=NC=CC(F)=C1 W9141 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.113 O=C([O-])C1=CC(O)=CC=C1 8975AL [0,1,0,0,0,0|1,0,0]=2 216 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 6772AE [0,1,0,0,0,0|2,0,0]=3 217 B10R1.113 O=S([O-])C1=CC=CC(Br)=C1 V8824 [0,1,0,0,0,0|2,0,0]=3 218 B10R1.113 O=[N+]([O-])C1=NC=CC(O)=C1 0431AA [0,1,0,0,0,0|3,0,0]=4 219 B10R2.6 C1=CC(C2CC2)=CC=N1 Z0635 [0,0,0,1,0,0|2,0,1]=4 220 B8R1.7 C=C(C)C1=NC=CS1 5670AL [0,0,0,0,1,0|3,0,0]=4 221 B8R1.7 CC(=O)C1=CC=NO1 4156AC [0,0,0,0,1,0|2,0,0]=3 222 B8R1.7 CC(=O)C1=CN=CS1 5381AC [0,0,0,0,1,0|2,0,0]=3 223 B8R1.7 CC(=O)C1=NC=CO1 W8389 [0,0,0,0,1,0|2,0,0]=3 224 B8R1.7 CC(=O)C1=NC=NN1 4769AD [0,0,0,0,1,0|3,0,0]=4 225 B8R1.7 CC(=O)C1=NOC=C1 4155AC [0,0,0,0,1,0|2,0,0]=3 226 B8R1.7 CC(N)C1=CC=CS1 9580AB [0,0,0,0,1,0|2,0,1]=4 227 B8R1.7 CC(N)C1=CSC=C1 0073AD [0,0,0,0,1,0|2,0,1]=4 228 B8R1.7 CC(O)C1=CC=CN1 Z2357 [0,0,0,0,1,0|1,0,2]=4 229 B8R1.7 CC(O)C1=CC=CO1 0311AQ [0,0,0,0,1,0|1,0,2]=4 230 B8R1.7 CC(O)C1=COC=C1 3660AD [0,0,0,0,1,0|1,0,2]=4 231 B8R1.7 N=C(N)C1=COC=C1 5391AE [0,0,0,0,1,0|3,0,0]=4 232 B8R1.7 NC(=O)C1=CC=CN1 V6031 [0,0,0,0,1,0|2,0,0]=3 233 B8R1.7 NC(=O)C1=CN=CO1 Y7670 [0,0,0,0,1,0|3,0,0]=4 234 B8R1.7 NC(=O)C1=CNC=C1 1113AC [0,0,0,0,1,0|2,0,0]=3 235 B8R1.7 NC(=O)C1=CNC=N1 2439AB [0,0,0,0,1,0|3,0,0]=4 236 B8R1.7 NC(=O)C1=CNN=C1 3575AE [0,0,0,0,1,0|3,0,0]=4 237 B8R1.7 NC(=O)C1=COC=N1 Z4456 [0,0,0,0,1,0|3,0,0]=4 238 B8R1.7 NC(=O)C1=CSC=N1 Y5399 [0,0,0,0,1,0|3,0,0]=4 239 B8R1.7 NC(=O)C1=NC=CS1 X5637 [0,0,0,0,1,0|3,0,0]=4 240 B8R1.7 O=C(O)C1=NC=CO1 Z1844 [0,0,0,0,1,0|3,0,0]=4 241 B8R1.7 O=C(O)C1=NSC=C1 6302AB [0,0,0,0,1,0|3,0,0]=4 242 B8R1.7 O=C(O)N1C=CC=C1 Z3516 [0,0,0,0,1,0|2,0,0]=3 243 B8R1.7 O=C([O-])C1=NC=CS1 4281AE [0,0,0,0,1,0|3,0,0]=4 244 B10R1.18 CC(=O)CC1=CN=CC=C1 9974AH [0,0,0,0,0,1|1,0,0]=2 245 B10R1.18 CC(=O)CC1=NC=CN=C1 0450AC [0,0,0,0,0,1|2,0,0]=3 246 B10R1.18 CC(=S)NC1=CC=CC=C1 8077AF [0,0,0,0,0,1|0,1,0]=2 247 B10R1.18 CC(C)=CC1=CC=CC=C1 1982AC [0,0,0,0,0,1|1,0,0]=2 248 B10R1.18 CC(C)CC1=CC=CC=N1 9571AB [0,0,0,0,0,1|2,0,1]=4 249 B10R1.18 CC(C)CC1=CC=NC=C1 6191AJ [0,0,0,0,0,1|2,0,1]=4 250 B10R1.18 CC(N)CC1=CC=CC=N1 4560AE [0,0,0,0,0,1|2,0,1]=4 251 B10R1.18 CC(O)CC1=CC=CC=N1 5034AE [0,0,0,0,0,1|1,0,2]=4 252 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 7881AA [0,0,0,0,0,1|0,0,2]=3 253 B10R1.18 C[C@H](O)CC1=CC=CC=C1 7611AA [0,0,0,0,0,1|0,0,2]=3 254 B10R1.18 N=C(N)CC1=CC=CC=C1 1942AB [0,0,0,0,0,1|2,0,0]=3 255 B10R1.18 N=C(N)CC1=NC=CC=C1 0398AD [0,0,0,0,0,1|3,0,0]=4 256 B10R1.18 NC(=S)CC1=CC=CC=C1 7353AE [0,0,0,0,0,1|1,1,0]=3 257 B10R1.18 O=C(O)CC1=CC=NC=N1 W5433 [0,0,0,0,0,1|3,0,0]=4 258 B10R1.18 O=C(O)CC1=NC=CC=C1 Y7391 [0,0,0,0,0,1|2,0,0]=3 259 B10R1.18 O=C(O)CC1=NC=CC=N1 W7752 [0,0,0,0,0,1|3,0,0]=4 260 B10R1.18 S=C(Cl)SC1=CC=CC=C1 5446AD [0,0,0,0,0,1|1,1,0]=3 261 B7R0.4 C\C=C\C=C\C(=O)Cl Y2082 [1,0,1,0,0,0|1,0,1]=4 262 B7R1.3 CC1=CC=CN=N1 X0232 [2,0,0,0,0,0|2,0,0]=4 263 B7R1.3 CC1=CCC=CC1 7751AF [2,0,0,0,0,0|0,0,2]=4 264 B7R1.3 C[N+]1=CC=CC=C1 1581AB [2,0,0,0,0,0|1,0,0]=3 265 B7R1.3 F[N+]1=CC=CC=C1 4861AL [2,0,0,0,0,0|2,0,0]=4 266 B7R1.3 [SeH]C1=CC=CC=C1 8806AL [2,0,0,0,0,0|0,1,0]=3 267 B9R1.1 C#CC1=CC=C(I)C=C1 1951AC [1,1,0,0,0,0|0,0,2]=4 268 B9R1.1 C=CC1=NC=C(Br)C=C1 1393AB [1,1,0,0,0,0|1,0,1]=4 269 B9R1.1 CC1=CN=C(C=O)N=C1 5145AC [1,1,0,0,0,0|2,0,0]=4 270 B9R1.1 CCC1=CC=C(C)C=C1 9372AB [1,1,0,0,0,0|0,0,1]=3 271 B9R1.1 CCC1=CC=C(Cl)C=N1 2584AA [1,1,0,0,0,0|1,0,1]=4 272 B9R1.1 CCC1=CC=C(N)C=N1 5249AA [1,1,0,0,0,0|1,0,1]=4 273 B9R1.1 CCC1=CC=C(S)C=C1 S243 [1,1,0,0,0,0|0,0,1]=3 274 B9R1.1 CCC1=CNC(=O)C=C1 7602AB [1,1,0,0,0,0|1,0,1]=4 275 B9R1.1 CNC1=CC=C(Br)C=C1 V7923 [1,1,0,0,0,0|1,0,0]=3 276 B9R1.1 CNC1=CC=C(Cl)C=C1 V5059 [1,1,0,0,0,0|1,0,0]=3 277 B9R1.1 CNC1=CC=C(N)C=C1 F921 [1,1,0,0,0,0|1,0,0]=3 278 B9R1.1 CNC1=NC=C(N)C=C1 2702AB [1,1,0,0,0,0|2,0,0]=4 279 B9R1.1 CSC1=CC=C(S)C=C1 U208 [1,1,0,0,0,0|1,0,0]=3 280 B9R1.1 CSC1=CN=C(Br)C=C1 Z0124 [1,1,0,0,0,0|2,0,0]=4 281 B9R1.1 CSC1=NC=C(Cl)C=C1 Z1031 [1,1,0,0,0,0|2,0,0]=4 282 B9R1.1 N#[N+]C1=CC=C(Br)C=C1 6428AL [1,1,0,0,0,0|2,0,0]=4 283 B9R1.1 O=C1C=CC(=NCl)C=C1 8527AL [1,1,0,0,0,0|2,0,0]=4 284 B9R1.1 O=CC1=CC=[N+]([O-])C=C1 0867AQ [1,1,0,0,0,0|1,0,0]=3 285 B9R1.1 O=CC1=NC=C(Br)C=N1 6187AC [1,1,0,0,0,0|2,0,0]=4 286 B9R1.1 O=CC1=NC=C(F)C=N1 3220AJ [1,1,0,0,0,0|2,0,0]=4 287 B9R1.2 C=CC1=CC(Br)=CN=C1 9938AA [1,1,0,0,0,0|1,0,1]=4 288 B9R1.2 C=CC1=CC(C)=CC=C1 6123AL [1,1,0,0,0,0|0,0,1]=3 289 B9R1.2 C=CC1=CC(C)=CC=N1 6788AA [1,1,0,0,0,0|1,0,1]=4 290 B9R1.2 C=CC1=NC=CC(Br)=C1 6873AB [1,1,0,0,0,0|1,0,1]=4 291 B9R1.2 C=CC1=NC=CC(N)=C1 0535AA [1,1,0,0,0,0|1,0,1]=4 292 B9R1.2 CC1=CN=CC(C=O)=N1 2745AA [1,1,0,0,0,0|2,0,0]=4 293 B9R1.2 CC1=NC=CC(C=O)=C1 9828AC [1,1,0,0,0,0|1,0,0]=3 294 B9R1.2 CCC1=CC(F)=CC=C1 0760AC [1,1,0,0,0,0|0,0,1]=3 295 B9R1.2 CCC1=CC(N)=CC=N1 5543AJ [1,1,0,0,0,0|1,0,1]=4 296 B9R1.2 CCC1=CC=NC(Cl)=C1 5411AB [1,1,0,0,0,0|1,0,1]=4 297 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [1,1,0,0,0,0|1,0,1]=4 298 B9R1.2 COC1=CC(C)=CN=C1 2251AC [1,1,0,0,0,0|2,0,0]=4 299 B9R1.2 COC1=CN=CC(F)=C1 Y3600 [1,1,0,0,0,0|2,0,0]=4 300 B9R1.2 COC1=CN=CC(I)=C1 1202AF [1,1,0,0,0,0|2,0,0]=4 301 B9R1.2 COC1=CN=CC(N)=C1 2136AJ [1,1,0,0,0,0|2,0,0]=4 302 B9R1.2 COC1=C[N+]([O-])=CC=C1 7428AA [1,1,0,0,0,0|2,0,0]=4 303 B9R1.2 CSC1=CC=CC(O)=C1 1026AE [1,1,0,0,0,0|1,0,0]=3 304 B9R1.2 CSC1=NC=CC(Cl)=C1 W5514 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.2 NC1=CC=CC(C=O)=C1 X3987 [1,1,0,0,0,0|0,0,0]=2 306 B9R1.2 NC1=CC=CC(C=O)=N1 3868AB [1,1,0,0,0,0|1,0,0]=3 307 B9R1.2 O=CC1=CC(F)=NC=C1 X9807 [1,1,0,0,0,0|1,0,0]=3 308 B9R1.2 O=CC1=CC(I)=CN=C1 1479AF [1,1,0,0,0,0|1,0,0]=3 309 B9R1.2 O=CC1=CC=CC(=O)N1 4493AB [1,1,0,0,0,0|1,0,0]=3 310 B9R1.2 O=CC1=CC=CC(F)=N1 N399 [1,1,0,0,0,0|1,0,0]=3 311 B9R1.2 O=CC1=NC(Cl)=CN=C1 3835AC [1,1,0,0,0,0|2,0,0]=4 312 B9R1.2 OC1=CC=CC(CBr)=C1 Y9989 [1,1,0,0,0,0|1,0,1]=4 313 B9R1.2 OCC1=CC(S)=CC=C1 0333AF [1,1,0,0,0,0|0,0,2]=4 314 B9R1.8 BrCCC1=CC=CC=N1 5125AB [1,1,0,0,0,0|1,0,1]=4 315 B9R1.8 CCC[N+]1=CC=CC=C1 4961AL [1,1,0,0,0,0|1,0,1]=4 316 B9R1.8 CCC[N+]1=CC=CC=C1 K559 [1,1,0,0,0,0|1,0,1]=4 317 B9R1.8 CNCC1=CC=CC=C1 3855AD [1,1,0,0,0,0|0,0,1]=3 318 B9R1.8 CNCC1=CC=CC=N1 7146AD [1,1,0,0,0,0|1,0,1]=4 319 B9R1.8 CNNC1=CC=CC=C1 V2456 [1,1,0,0,0,0|1,0,0]=3 320 B9R1.8 C\C=C\C1=CC=CC=C1 7209AE [1,1,0,0,0,0|0,0,0]=2 321 B9R1.8 ClCCC1=NC=CC=C1 X6257 [1,1,0,0,0,0|1,0,1]=4 322 B9R1.8 NCCC1=CC=CN=C1 5033AC [1,1,0,0,0,0|1,0,1]=4 323 B9R1.8 O=C=NC1=CC=CN=C1 Y9342 [1,1,0,0,0,0|1,0,1]=4 324 B9R1.8 O=CNC1=NC=CC=C1 1807AL [1,1,0,0,0,0|1,0,0]=3 325 B9R1.8 [N-]=[N+]=NC1=CC=CC=C1 0023AQ [1,1,0,0,0,0|2,0,0]=4 326 B9R1.15 C#CC1=CC=CC=C1Br 1939AC [1,1,0,0,0,0|0,0,2]=4 327 B9R1.15 C=CC1=C(C)C=CC=C1 8079AF [1,1,0,0,0,0|0,0,1]=3 328 B9R1.15 C=CC1=CC=CC=C1N 3518AA [1,1,0,0,0,0|0,0,1]=3 329 B9R1.15 C=CC1=CC=CC=[N+]1C 0254AQ [1,1,0,0,0,0|1,0,1]=4 330 B9R1.15 CC1=CC=CC=C1[Mg]Br X5408 [1,1,0,0,0,0|2,0,0]=4 331 B9R1.15 CCC1=C(Br)C=CN=C1 0440AA [1,1,0,0,0,0|1,0,1]=4 332 B9R1.15 CCC1=C(Br)C=NC=C1 W9928 [1,1,0,0,0,0|1,0,1]=4 333 B9R1.15 CCC1=CC=CC=C1C Z4941 [1,1,0,0,0,0|0,0,1]=3 334 B9R1.15 CCC1=[N+]([O-])C=CC=C1 7886AF [1,1,0,0,0,0|1,0,1]=4 335 B9R1.15 CNC1=CC=CC=C1Br 0544AC [1,1,0,0,0,0|1,0,0]=3 336 B9R1.15 CNC1=CC=CN=C1N 8234AB [1,1,0,0,0,0|2,0,0]=4 337 B9R1.15 CNC1=NC=CC=C1N 6884AB [1,1,0,0,0,0|2,0,0]=4 338 B9R1.15 COC1=C(Br)C=CN=C1 X8928 [1,1,0,0,0,0|2,0,0]=4 339 B9R1.15 COC1=C(Cl)C=NC=C1 3447AC [1,1,0,0,0,0|2,0,0]=4 340 B9R1.15 COC1=C(O)C=NC=C1 7687AA [1,1,0,0,0,0|2,0,0]=4 341 B9R1.15 COC1=CC=CN=C1I Y4758 [1,1,0,0,0,0|2,0,0]=4 342 B9R1.15 COC1=CN=CC=C1O 9525AB [1,1,0,0,0,0|2,0,0]=4 343 B9R1.15 COC1=NC=CC=C1F Z7565 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.15 CSC1=NC=CC=C1Br V6364 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.15 ClCC1=C(Br)C=CC=C1 8546AB [1,1,0,0,0,0|1,0,1]=4 346 B9R1.15 NC1=C(C=O)C=CN=C1 2155AJ [1,1,0,0,0,0|1,0,0]=3 347 B9R1.15 NC1=CN=CC=C1C=O 3083AA [1,1,0,0,0,0|1,0,0]=3 348 B9R1.15 NC1=NC=CN=C1C=O W5450 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.15 NCC1=C(I)C=CC=C1 1744AJ [1,1,0,0,0,0|1,0,1]=4 350 B9R1.15 NCC1=CC=CC=C1N W5201 [1,1,0,0,0,0|1,0,1]=4 351 B9R1.15 NNC1=CC=CC=C1I W6607 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.15 O=CC1=C(Br)C=CN=C1 Y5203 [1,1,0,0,0,0|1,0,0]=3 353 B9R1.15 O=CC1=CN=CC=C1Br W3357 [1,1,0,0,0,0|1,0,0]=3 354 B9R1.15 O=CC1=CN=CC=C1O Z1966 [1,1,0,0,0,0|1,0,0]=3 355 B9R1.11 CCC(=O)C1=CC=CO1 Z5507 [0,1,0,0,1,0|1,0,0]=3 356 B9R1.11 COC(=O)C1=CNN=C1 9533AA [0,1,0,0,1,0|2,0,0]=4 357 B9R1.11 COC(=O)C1=NC=CO1 3452AB [0,1,0,0,1,0|2,0,0]=4 358 B9R1.11 CSC(=O)C1=CSC=N1 V9051 [0,1,0,0,1,0|2,0,0]=4 359 B9R1.11 N#CC(=O)C1=CC=CO1 9015AB [0,1,0,0,1,0|1,0,1]=4 360 B9R1.11 N#CC(=O)C1=CC=CS1 6481AE [0,1,0,0,1,0|1,0,1]=4 361 B9R1.11 NNC(=O)C1=CSC=C1 2321AE [0,1,0,0,1,0|2,0,0]=4 362 B9R1.11 O=C(CBr)C1=CSC=N1 3999AJ [0,1,0,0,1,0|2,0,0]=4 363 B9R1.11 O=C(CBr)C1=NC=CS1 6733AD [0,1,0,0,1,0|2,0,0]=4 364 B9R1.11 O=C(CCl)C1=NC=CO1 1641AJ [0,1,0,0,1,0|2,0,0]=4 365 B9R1.11 O=CC(=O)C1=CC=CO1 8783AA [0,1,0,0,1,0|1,0,1]=4 366 B9R1.11 O=CC(=O)C1=CC=CS1 W3018 [0,1,0,0,1,0|1,0,1]=4 367 B9R1.19 CS(=O)(=O)N1C=CC=C1 V6357 [0,1,0,0,1,0|2,0,0]=4 368 B9R1.35 CC(=O)C1=CC(Cl)=CS1 W5634 [0,1,0,0,1,0|1,0,0]=3 369 B9R1.35 CC(=O)C1=CC=C(Br)O1 3520AB [0,1,0,0,1,0|1,0,0]=3 370 B9R1.35 CC(=O)C1=NC(C)=CN1 2011AB [0,1,0,0,1,0|2,0,0]=4 371 B9R1.35 CC(=O)C1=NC(C)=CO1 5140AC [0,1,0,0,1,0|2,0,0]=4 372 B9R1.35 CC(=O)C1=NC=C(Br)S1 2132AC [0,1,0,0,1,0|2,0,0]=4 373 B9R1.35 CC1=CC(C(=O)O)=CN1 X8465 [0,1,0,0,1,0|2,0,0]=4 374 B9R1.35 CC1=CC=C(C(=O)O)N1 4808AB [0,1,0,0,1,0|2,0,0]=4 375 B9R1.35 CC1=CNC(C(=O)O)=C1 V0508 [0,1,0,0,1,0|2,0,0]=4 376 B9R1.35 NC(=O)C1=CC=C(Br)N1 9191AA [0,1,0,0,1,0|2,0,0]=4 377 B9R1.35 NC1=CSC(C(=O)O)=C1 6089AJ [0,1,0,0,1,0|2,0,0]=4 378 B9R1.35 O=C(O)C1=CC(F)=CS1 3617AB [0,1,0,0,1,0|2,0,0]=4 379 B9R1.35 O=C(O)C1=CC=C(I)O1 6244AD [0,1,0,0,1,0|2,0,0]=4 380 B9R1.41 CC(=O)C1=C(C)C=CS1 Z5455 [0,1,0,0,1,0|1,0,0]=3 381 B9R1.41 CC(=O)C1=C(C)NN=C1 4180AF [0,1,0,0,1,0|2,0,0]=4 382 B9R1.41 CC(=O)C1=C(N)C=CS1 3514AB [0,1,0,0,1,0|1,0,0]=3 383 B9R1.41 CC(=O)N1C=CC=C1Br 5036AJ [0,1,0,0,1,0|1,0,0]=3 384 B9R1.41 CC1=C(C(=O)O)NC=C1 W9332 [0,1,0,0,1,0|2,0,0]=4 385 B9R1.41 CC1=C(C(N)=O)C=CS1 0775AQ [0,1,0,0,1,0|2,0,0]=4 386 B9R1.41 NC(=O)C1=C(Br)SC=C1 9864AA [0,1,0,0,1,0|2,0,0]=4 387 B9R1.41 NC(=O)C1=CSC=C1Br 0861AQ [0,1,0,0,1,0|2,0,0]=4 388 B9R1.41 O=C(O)C1=C(Br)OC=C1 Z5486 [0,1,0,0,1,0|2,0,0]=4 389 B11R1.20 CC(=O)NC1=CC=C(Br)N=C1 Y8599 [0,1,0,0,0,1|1,0,0]=3 390 B11R1.20 CC(=O)NC1=CC=C(O)C=N1 8000AA [0,1,0,0,0,1|1,0,0]=3 391 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [0,1,0,0,0,1|1,0,0]=3 392 B11R1.20 CC(=O)NC1=NC=C(Br)C=N1 V3896 [0,1,0,0,0,1|2,0,0]=4 393 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,1,0,0,0,1|1,0,0]=3 394 B11R1.20 CC(=O)OC1=CC=C(Cl)C=C1 X5399 [0,1,0,0,0,1|0,0,0]=2 395 B11R1.20 CC(C)NC1=CC=C(Cl)C=C1 V3609 [0,1,0,0,0,1|1,0,1]=4 396 B11R1.20 CC(C)OC1=CC=C(F)C=C1 Z0614 [0,1,0,0,0,1|1,0,1]=4 397 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,1,0,0,0,1|2,0,0]=4 398 B11R1.20 CC1=CC=C(N=C(N)N)C=C1 7745AB [0,1,0,0,0,1|2,0,0]=4 399 B11R1.20 CC1=CC=C(NC(=N)N)C=C1 4423AJ [0,1,0,0,0,1|2,0,0]=4 400 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 6863AE [0,1,0,0,0,1|1,0,0]=3 401 B11R1.20 CC1=CC=C(\C=[N+](\C)[O-])C=C1 5147AD [0,1,0,0,0,1|1,0,1]=4 402 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 W8749 [0,1,0,0,0,1|2,0,0]=4 403 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 6320AE [0,1,0,0,0,1|2,0,0]=4 404 B11R1.20 N=C(N)NC1=CC=C(F)C=C1 0100AC [0,1,0,0,0,1|2,0,0]=4 405 B11R1.20 NC(=O)CC1=CC=C(N)C=C1 1746AL [0,1,0,0,0,1|1,0,0]=3 406 B11R1.20 NC(=O)NC1=CC=C(O)C=C1 7848AA [0,1,0,0,0,1|1,0,0]=3 407 B11R1.20 NC(=S)CC1=CC=C(Br)C=C1 4488AD [0,1,0,0,0,1|1,1,0]=4 408 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 2203AE [0,1,0,0,0,1|2,0,0]=4 409 B11R1.20 NC(N)=NC1=CC=C(Cl)C=C1 6322AB [0,1,0,0,0,1|2,0,0]=4 410 B11R1.20 NC1=NC=C(CC(=O)O)C=C1 5213AB [0,1,0,0,0,1|2,0,0]=4 411 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 9998AA [0,1,0,0,0,1|2,0,0]=4 412 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 3963AE [0,1,0,0,0,1|2,0,0]=4 413 B11R1.20 S=C(Cl)OC1=CC=C(Cl)C=C1 6457AL [0,1,0,0,0,1|1,1,0]=4 414 B11R1.36 BrC(Br)=C(Br)C1=CC=CC=C1 O760 [0,1,0,0,0,1|2,0,0]=4 415 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 E850 [0,1,0,0,0,1|0,0,0]=2 416 B11R1.36 CC(C)C(N)C1=CC=CC=C1 1780AB [0,1,0,0,0,1|1,0,1]=4 417 B11R1.36 CC(C)[C@H](O)C1=CC=CC=C1 N145 [0,1,0,0,0,1|1,0,1]=4 418 B11R1.36 CN(C(=O)Cl)C1=CC=CC=C1 Y1505 [0,1,0,0,0,1|1,0,0]=3 419 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 9111AE [0,1,0,0,0,1|1,0,0]=3 420 B11R1.36 NC(C(=O)O)C1=NC=CC=C1 Z5933 [0,1,0,0,0,1|2,0,0]=4 421 B11R1.36 O=C(O)C(=O)C1=CC=CN=C1 5219AB [0,1,0,0,0,1|2,0,0]=4 422 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 7920AA [0,1,0,0,0,1|1,0,0]=3 423 B11R1.40 CC(C#N)NC1=CC=CC=C1 5308AJ [0,1,0,0,0,1|1,0,1]=4 424 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [0,1,0,0,0,1|1,0,1]=4 425 B11R1.40 CC(CN)OC1=CC=CC=C1 Y9709 [0,1,0,0,0,1|1,0,1]=4 426 B11R1.40 CCC(=O)OC1=CC=CC=C1 8795AL [0,1,0,0,0,1|0,0,0]=2 427 B11R1.40 CNC(=O)CC1=CN=CC=C1 8304AC [0,1,0,0,0,1|1,0,0]=3 428 B11R1.40 CNC(=S)NC1=CC=CC=C1 S792 [0,1,0,0,0,1|0,1,0]=3 429 B11R1.40 COC(=O)CC1=CC=CN=C1 7040AJ [0,1,0,0,0,1|1,0,0]=3 430 B11R1.40 COC(=O)CC1=NC=NC=C1 Y1676 [0,1,0,0,0,1|2,0,0]=4 431 B11R1.40 C\C(=C/C1=CC=CC=C1)CO 5715AL [0,1,0,0,0,1|0,0,1]=3 432 B11R1.40 NCC(=O)NC1=CC=CC=C1 4165AE [0,1,0,0,0,1|0,0,0]=2 433 B11R1.40 NNC(=O)CC1=CC=NC=C1 Y5522 [0,1,0,0,0,1|2,0,0]=4 434 B11R1.40 O=C(CCl)NC1=CC=CN=C1 2248AC [0,1,0,0,0,1|1,0,0]=3 435 B11R1.86 CC(=O)CC1=CC=CC=C1C 7072AB [0,1,0,0,0,1|0,0,0]=2 436 B11R1.86 CC(=O)CC1=CC=CC=C1O 5670AA [0,1,0,0,0,1|0,0,0]=2 437 B11R1.86 CC(=O)NC1=C(Br)N=CC=C1 8863AJ [0,1,0,0,0,1|1,0,0]=3 438 B11R1.86 CC(=O)NC1=C(N)C=NC=C1 Z3279 [0,1,0,0,0,1|1,0,0]=3 439 B11R1.86 CC(=O)NC1=C(O)C=NC=C1 8398AE [0,1,0,0,0,1|1,0,0]=3 440 B11R1.86 CC(=O)NC1=CC=CNC1=O 9389AE [0,1,0,0,0,1|1,0,0]=3 441 B11R1.86 CC(=O)NC1=NC=CC=C1O 9933AD [0,1,0,0,0,1|1,0,0]=3 442 B11R1.86 CC(=O)NC1=NN=CC=C1C 5765AJ [0,1,0,0,0,1|2,0,0]=4 443 B11R1.86 CC(C)CC1=C(N)C=CC=C1 5195AJ [0,1,0,0,0,1|1,0,1]=4 444 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7575AH [0,1,0,0,0,1|2,0,0]=4 445 B11R1.86 CC1=C(NC(=N)N)C=CC=C1 7576AH [0,1,0,0,0,1|2,0,0]=4 446 B11R1.86 CN(C)CC1=C(F)C=CC=C1 1557AB [0,1,0,0,0,1|2,0,0]=4 447 B11R1.86 CN(C)CC1=C(N)C=CC=C1 9911AA [0,1,0,0,0,1|2,0,0]=4 448 B11R1.86 CN(C)CC1=C(O)C=CC=C1 8448AD [0,1,0,0,0,1|2,0,0]=4 449 B11R1.86 N=C(N)CC1=CC=CC=C1Br 3452AD [0,1,0,0,0,1|2,0,0]=4 450 B11R1.86 N=C(N)NC1=C(F)C=CC=C1 5657AB [0,1,0,0,0,1|2,0,0]=4 451 B11R1.86 NC(=S)CC1=CC=CC=C1Br Z6609 [0,1,0,0,0,1|1,1,0]=4 452 B11R1.86 NC(=S)NC1=CC=CC=C1Br V6496 [0,1,0,0,0,1|1,1,0]=4 453 B11R1.86 NC1=NC=CC=C1CC(=O)O 0495AA [0,1,0,0,0,1|2,0,0]=4 454 B11R1.86 O=C(O)CN1C=CC=CC1=O 1070AL [0,1,0,0,0,1|2,0,0]=4 455 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 Z4417 [0,1,0,0,0,1|0,0,0]=2 456 B11R1.157 CC(=O)CC1=CC=CC(Cl)=C1 6862AA [0,1,0,0,0,1|0,0,0]=2 457 B11R1.157 CC(=O)CC1=NC(C)=CC=C1 9512AH [0,1,0,0,0,1|1,0,0]=3 458 B11R1.157 CC(=O)CC1=NC=CC(C)=C1 3153AE [0,1,0,0,0,1|1,0,0]=3 459 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 1694AC [0,1,0,0,0,1|1,0,0]=3 460 B11R1.157 CC(=O)NC1=NN=CC(C)=C1 5766AJ [0,1,0,0,0,1|2,0,0]=4 461 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 X7036 [0,1,0,0,0,1|2,0,0]=4 462 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 9927AB [0,1,0,0,0,1|2,0,0]=4 463 B11R1.157 N=C(N)NC1=CC(Cl)=CC=C1 9218AB [0,1,0,0,0,1|2,0,0]=4 464 B11R1.157 NC(=O)NC1=CC(N)=CC=C1 2129AB [0,1,0,0,0,1|1,0,0]=3 465 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 0766AQ [0,1,0,0,0,1|2,0,0]=4 466 B11R1.157 O=C(O)CC1=CC(S)=CC=C1 9631AB [0,1,0,0,0,1|1,0,0]=3 467 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 5351AA [0,1,0,0,0,1|2,0,0]=4 468 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 7156AL [0,1,0,0,0,1|2,0,0]=4 469 B11R1.509 C[Si](C)(C)OC1=CC=CC=C1 9306AL [0,1,0,0,0,1|1,1,0]=4 470 B11R1.509 C[Si](C)(Cl)CC1=CC=CC=C1 7150AL [0,1,0,0,0,1|1,1,0]=4 471 B11R1.509 O=P(O)(O)OC1=CC=CC=C1 8803AL [0,1,0,0,0,1|2,0,0]=4 472 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 9483AH [0,2,0,0,0,0|0,0,0]=2 473 B11R1.3 CC(=O)C1=CN=C(C#N)C=N1 5435AC [0,2,0,0,0,0|2,0,0]=4 474 B11R1.3 CCC1=CC=C(C(C)N)C=C1 4489AD [0,2,0,0,0,0|1,0,1]=4 475 B11R1.3 CCC1=CC=C([C@H](C)N)C=C1 0840AB [0,2,0,0,0,0|1,0,1]=4 476 B11R1.3 COC1=CC=C(C(C)N)C=C1 4964AJ [0,2,0,0,0,0|1,0,1]=4 477 B11R1.3 COC1=CN=C(C(N)=O)C=C1 V8588 [0,2,0,0,0,0|2,0,0]=4 478 B11R1.3 CSC1=CC=C(C(=O)Cl)C=C1 0486AQ [0,2,0,0,0,0|1,0,0]=3 479 B11R1.3 C[C@@H](N)C1=CC=C(C#N)C=C1 W4398 [0,2,0,0,0,0|1,0,1]=4 480 B11R1.3 O=C(Br)C1=CC=C(CBr)C=C1 Z2833 [0,2,0,0,0,0|1,0,0]=3 481 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 2161AC [0,2,0,0,0,0|2,0,0]=4 482 B11R1.3 O=[N+]([O-])C1=CC=C(CS)C=C1 0403AQ [0,2,0,0,0,0|2,0,0]=4 483 B11R1.3 [C@@H](C)(N)C1=CC=C(C#N)C=C1 0683AP [0,2,0,0,0,0|1,0,1]=4 484 B11R1.19 CC(C)(C)C1=CC=C(F)C=C1 V7377 [0,2,0,0,0,0|1,0,1]=4 485 B11R1.19 CC(C)(N)C1=CC=C(Br)C=C1 5952AD [0,2,0,0,0,0|1,0,1]=4 486 B11R1.19 CC(C)(O)C1=CC=C(F)C=C1 V5764 [0,2,0,0,0,0|0,0,2]=4 487 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 0092AA [0,2,0,0,0,0|1,0,1]=4 488 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 0487AB [0,2,0,0,0,0|2,0,0]=4 489 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3478AC [0,2,0,0,0,0|2,0,0]=4 490 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 3773AA [0,2,0,0,0,0|2,0,0]=4 491 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5422AL [0,2,0,0,0,0|2,0,0]=4 492 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 5497AL [0,2,0,0,0,0|2,0,0]=4 493 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 X3142 [0,2,0,0,0,0|2,0,0]=4 494 B11R1.19 CC1=CC=C(S(=O)(=O)[O-])C=C1 0063AQ [0,2,0,0,0,0|2,0,0]=4 495 B11R1.19 CS(=O)(=O)C1=CC=C(I)C=C1 5137AJ [0,2,0,0,0,0|1,0,0]=3 496 B11R1.19 CS(=O)(=O)C1=NC=C(Br)C=C1 Y4885 [0,2,0,0,0,0|2,0,0]=4 497 B11R1.19 CS(=O)(=O)C1=NC=C(N)C=C1 6291AD [0,2,0,0,0,0|2,0,0]=4 498 B11R1.19 C[Si](C)(C)C1=CC=C(F)C=C1 1626AL [0,2,0,0,0,0|1,1,0]=4 499 B11R1.19 O=S(=O)(F)C1=CC=C(F)C=C1 N508 [0,2,0,0,0,0|2,0,0]=4 500 B11R1.19 O=S(=O)([O-])C1=CC=C(Br)C=C1 L660 [0,2,0,0,0,0|2,0,0]=4 501 B11R1.19 O=S(=O)([O-])C1=CC=C(Cl)C=C1 L693 [0,2,0,0,0,0|2,0,0]=4 502 B11R1.19 O=[As](O)(O)C1=CC=C(O)C=C1 7666AF [0,2,0,0,0,0|2,0,0]=4 503 B11R1.21 CC(=O)C1=CC(I)=C(N)C=C1 X7016 [0,2,0,0,0,0|0,0,0]=2 504 B11R1.21 CC(=O)C1=CC(I)=C(O)C=C1 1108AQ [0,2,0,0,0,0|0,0,0]=2 505 B11R1.21 CC(=O)C1=CC(N)=C(Br)C=C1 1073AQ [0,2,0,0,0,0|0,0,0]=2 506 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [0,2,0,0,0,0|0,0,0]=2 507 B11R1.21 CC(=O)C1=CC=C(C)C(O)=C1 W5512 [0,2,0,0,0,0|0,0,0]=2 508 B11R1.21 CC(=O)C1=CN=C(C)C(C)=N1 7817AB [0,2,0,0,0,0|2,0,0]=4 509 B11R1.21 CC(C)C1=CC(Br)=C(O)C=C1 6556AD [0,2,0,0,0,0|1,0,1]=4 510 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 7727AC [0,2,0,0,0,0|1,0,1]=4 511 B11R1.21 CC(N)C1=CC=C(Cl)C(Cl)=C1 V8866 [0,2,0,0,0,0|1,0,1]=4 512 B11R1.21 CC(O)C1=CC(Br)=C(F)C=C1 4966AC [0,2,0,0,0,0|0,0,2]=4 513 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 2930AF [0,2,0,0,0,0|1,0,1]=4 514 B11R1.21 CC1=C(C)C=C(C(N)=S)C=C1 2091AJ [0,2,0,0,0,0|1,1,0]=4 515 B11R1.21 CC1=C(Cl)N=CC(C(N)=O)=C1 7444AE [0,2,0,0,0,0|2,0,0]=4 516 B11R1.21 CC1=C(F)C=C(C(N)=S)C=C1 5832AD [0,2,0,0,0,0|1,1,0]=4 517 B11R1.21 CC1=C(F)C=CC([C@@H](C)N)=C1 3792AA [0,2,0,0,0,0|1,0,1]=4 518 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3798AA [0,2,0,0,0,0|1,0,1]=4 519 B11R1.21 CC1=C(F)C=CC([C@H](C)N)=C1 3799AA [0,2,0,0,0,0|1,0,1]=4 520 B11R1.21 CC1=CC(C(=O)O)=CNC1=O 0272AC [0,2,0,0,0,0|2,0,0]=4 521 B11R1.21 CC1=CC(N(C)C)=CC=C1N 1607AB [0,2,0,0,0,0|2,0,0]=4 522 B11R1.21 CC1=CC=C(C(=N)N)C=C1C 5252AH [0,2,0,0,0,0|2,0,0]=4 523 B11R1.21 CC1=CC=C(C(=O)O)N=C1C 2856AC [0,2,0,0,0,0|2,0,0]=4 524 B11R1.21 CC1=CC=C(C(=O)O)NC1=O 2494AA [0,2,0,0,0,0|2,0,0]=4 525 B11R1.21 CC1=CC=C(C(C)C)C=C1N B800 [0,2,0,0,0,0|1,0,1]=4 526 B11R1.21 CC1=CC=C([C@H](C)N)C=C1Cl 3803AA [0,2,0,0,0,0|1,0,1]=4 527 B11R1.21 CC1=NC(C(N)=O)=CC=C1Br Y3916 [0,2,0,0,0,0|2,0,0]=4 528 B11R1.21 C[C@@H](N)C1=CC(Cl)=C(F)C=C1 0358AA [0,2,0,0,0,0|1,0,1]=4 529 B11R1.21 C[C@@H](N)C1=CC(F)=C(Cl)C=C1 1180AL [0,2,0,0,0,0|1,0,1]=4 530 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 4775AA [0,2,0,0,0,0|1,0,1]=4 531 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 X9639 [0,2,0,0,0,0|1,0,1]=4 532 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 W5394 [0,2,0,0,0,0|1,0,1]=4 533 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 7502AA [0,2,0,0,0,0|1,0,1]=4 534 B11R1.21 C[C@H](N)C1=CC(F)=C(Cl)C=C1 2069AA [0,2,0,0,0,0|1,0,1]=4 535 B11R1.21 C[C@H](N)C1=CC(F)=C(F)C=C1 X3908 [0,2,0,0,0,0|1,0,1]=4 536 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 X9597 [0,2,0,0,0,0|1,0,1]=4 537 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 2235AJ [0,2,0,0,0,0|2,0,0]=4 538 B11R1.21 N=C(N)C1=CC(Cl)=C(F)C=C1 5315AH [0,2,0,0,0,0|2,0,0]=4 539 B11R1.21 N=C(N)C1=CC=C(F)C(Br)=C1 Y4731 [0,2,0,0,0,0|2,0,0]=4 540 B11R1.21 N=C(N)C1=CC=C(F)C(F)=C1 2075AJ [0,2,0,0,0,0|2,0,0]=4 541 B11R1.21 NC(=O)C1=CC(N)=C(F)C=C1 6127AC [0,2,0,0,0,0|1,0,0]=3 542 B11R1.21 NC(=O)C1=CC(O)=C(O)C=C1 9447AJ [0,2,0,0,0,0|1,0,0]=3 543 B11R1.21 NC(=O)C1=CC=C(Br)C(Cl)=C1 Z8676 [0,2,0,0,0,0|1,0,0]=3 544 B11R1.21 NC(=O)C1=CC=C(Cl)C(Br)=C1 V7781 [0,2,0,0,0,0|1,0,0]=3 545 B11R1.21 NC(=O)C1=CC=C(Cl)C(Cl)=C1 8805AD [0,2,0,0,0,0|1,0,0]=3 546 B11R1.21 NC(=O)C1=CC=C(N)C(N)=C1 8382AE [0,2,0,0,0,0|1,0,0]=3 547 B11R1.21 NC(=O)C1=CN=C(Cl)C(Cl)=C1 9219AE [0,2,0,0,0,0|2,0,0]=4 548 B11R1.21 NC1=C(I)C=C(C(=O)O)C=N1 5309AE [0,2,0,0,0,0|2,0,0]=4 549 B11R1.21 NC1=C(I)C=CC([N+](=O)[O-])=C1 7907AB [0,2,0,0,0,0|2,0,0]=4 550 B11R1.21 NC1=CC(C(=O)O)=CC=C1F V5597 [0,2,0,0,0,0|1,0,0]=3 551 B11R1.21 NC1=CC(C(=O)O)=CC=C1O D461 [0,2,0,0,0,0|1,0,0]=3 552 B11R1.21 O=C(O)C1=CC(=O)C(O)=CO1 0899AQ [0,2,0,0,0,0|2,0,0]=4 553 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=N1 X3304 [0,2,0,0,0,0|2,0,0]=4 554 B11R1.21 O=C(O)C1=CC(Cl)=C(F)N=C1 4922AB [0,2,0,0,0,0|2,0,0]=4 555 B11R1.21 O=C(O)C1=CC(F)=C(F)N=C1 Y4245 [0,2,0,0,0,0|2,0,0]=4 556 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=N1 1126AD [0,2,0,0,0,0|2,0,0]=4 557 B11R1.21 O=C(O)C1=CC=C(I)C(Cl)=C1 X6546 [0,2,0,0,0,0|1,0,0]=3 558 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 Y6596 [0,2,0,0,0,0|2,0,0]=4 559 B11R1.21 O=C(O)C1=NC(F)=C(F)C=C1 Y4247 [0,2,0,0,0,0|2,0,0]=4 560 B11R1.21 O=C(O)C1=NC=C(Br)C(Cl)=C1 1343AA [0,2,0,0,0,0|2,0,0]=4 561 B11R1.21 O=C([O-])C1=CC=C(F)C(F)=C1 3820AL [0,2,0,0,0,0|1,0,0]=3 562 B11R1.22 C=CC(=O)C1=CC=C(F)C=C1 7203AB [0,2,0,0,0,0|0,0,1]=3 563 B11R1.22 CC(C#N)C1=CC=C(N)C=C1 2826AB [0,2,0,0,0,0|1,0,1]=4 564 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 7936AB [0,2,0,0,0,0|0,0,0]=2 565 B11R1.22 CC1=CC=C(C(O)CN)C=C1 7582AB [0,2,0,0,0,0|0,0,2]=4 566 B11R1.22 CC1=CC=C(C(O)CN)C=C1 9378AJ [0,2,0,0,0,0|0,0,2]=4 567 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [0,2,0,0,0,0|1,0,0]=3 568 B11R1.22 CCC(=O)C1=CC=C(I)C=C1 1437AL [0,2,0,0,0,0|0,0,0]=2 569 B11R1.22 CCC(=O)C1=NC=C(Br)C=N1 Y3142 [0,2,0,0,0,0|2,0,0]=4 570 B11R1.22 CCC(N)C1=CC=C(Br)C=C1 1643AC [0,2,0,0,0,0|1,0,1]=4 571 B11R1.22 CCC(N)C1=CC=C(C)C=C1 5656AD [0,2,0,0,0,0|1,0,1]=4 572 B11R1.22 CCC(N)C1=CC=C(F)C=C1 8597AC [0,2,0,0,0,0|1,0,1]=4 573 B11R1.22 CCC(N)C1=CC=C(F)C=C1 9157AE [0,2,0,0,0,0|1,0,1]=4 574 B11R1.22 CCC(O)C1=CC=C(Br)C=C1 1423AL [0,2,0,0,0,0|0,0,2]=4 575 B11R1.22 CCN(N)C1=CC=C(C)C=C1 4836AL [0,2,0,0,0,0|2,0,0]=4 576 B11R1.22 CC[C@@H](N)C1=CC=C(C)C=C1 1684AB [0,2,0,0,0,0|1,0,1]=4 577 B11R1.22 CC[C@H](N)C1=CC=C(Cl)C=C1 Y6691 [0,2,0,0,0,0|1,0,1]=4 578 B11R1.22 CC[C@H](N)C1=CC=C(F)C=C1 X9085 [0,2,0,0,0,0|1,0,1]=4 579 B11R1.22 CNC(=O)C1=CC=C(O)C=C1 2642AB [0,2,0,0,0,0|0,0,0]=2 580 B11R1.22 CNC(=O)C1=CN=C(Cl)N=C1 6428AA [0,2,0,0,0,0|2,0,0]=4 581 B11R1.22 CNC(C)C1=CC=C(F)C=C1 5899AE [0,2,0,0,0,0|1,0,1]=4 582 B11R1.22 COC(=O)C1=CC=C(N)C=C1 3562AL [0,2,0,0,0,0|0,0,0]=2 583 B11R1.22 COC(=O)C1=CN=C(C)N=C1 5600AE [0,2,0,0,0,0|2,0,0]=4 584 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 W5141 [0,2,0,0,0,0|2,0,0]=4 585 B11R1.22 COC(=O)C1=CN=C(I)C=C1 V3781 [0,2,0,0,0,0|1,0,0]=3 586 B11R1.22 COC(=O)C1=CNC(=O)N=C1 6987AB [0,2,0,0,0,0|2,0,0]=4 587 B11R1.22 COC(=O)C1=NC=C(F)C=N1 7118AJ [0,2,0,0,0,0|2,0,0]=4 588 B11R1.22 COC(=O)C1=NC=C(N)C=N1 3573AL [0,2,0,0,0,0|2,0,0]=4 589 B11R1.22 COC(=O)C1=NN=C(C)C=C1 8321AC [0,2,0,0,0,0|2,0,0]=4 590 B11R1.22 COC(C)C1=CC=C(Br)C=C1 6457AE [0,2,0,0,0,0|0,0,2]=4 591 B11R1.22 C\C(=N/O)C1=CC=C(Cl)C=C1 6594AD [0,2,0,0,0,0|0,0,1]=3 592 B11R1.22 ClC1=CC=C(C(Br)CBr)C=C1 0999AQ [0,2,0,0,0,0|1,0,1]=4 593 B11R1.22 N#CC(=O)C1=CC=C(Br)C=C1 2661AL [0,2,0,0,0,0|0,0,1]=3 594 B11R1.22 N#CC(=O)C1=CC=C(F)C=C1 7543AE [0,2,0,0,0,0|0,0,1]=3 595 B11R1.22 N=C(NO)C1=CC=C(Br)C=C1 9499AJ [0,2,0,0,0,0|1,0,1]=4 596 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 2630AL [0,2,0,0,0,0|0,0,0]=2 597 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [0,2,0,0,0,0|0,0,0]=2 598 B11R1.22 NCC(O)C1=CC=C(Cl)C=C1 9601AB [0,2,0,0,0,0|0,0,2]=4 599 B11R1.22 NCC(O)C1=CC=C(F)C=C1 3928AE [0,2,0,0,0,0|0,0,2]=4 600 B11R1.22 NCC(O)C1=CC=C(F)C=C1 5412AB [0,2,0,0,0,0|0,0,2]=4 601 B11R1.22 NNC(=O)C1=CC=C(Cl)C=N1 7212AA [0,2,0,0,0,0|2,0,0]=4 602 B11R1.22 NNC(=O)C1=CN=C(N)C=C1 Z3023 [0,2,0,0,0,0|2,0,0]=4 603 B11R1.22 NNC(=O)C1=NC=C(F)C=C1 Z4030 [0,2,0,0,0,0|2,0,0]=4 604 B11R1.22 NNC(=O)C1=NC=C(O)C=C1 Z2983 [0,2,0,0,0,0|2,0,0]=4 605 B11R1.22 N\C(=N/O)C1=CC=C(Cl)C=C1 W6566 [0,2,0,0,0,0|1,0,1]=4 606 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 W7901 [0,2,0,0,0,0|1,0,1]=4 607 B11R1.22 O=C(CBr)C1=CC=C(Br)N=C1 Y6042 [0,2,0,0,0,0|1,0,0]=3 608 B11R1.22 O=C(CBr)C1=CN=C(Cl)N=C1 0273AA [0,2,0,0,0,0|2,0,0]=4 609 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 7216AA [0,2,0,0,0,0|1,0,0]=3 610 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 Y4820 [0,2,0,0,0,0|1,0,0]=3 611 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 9573AB [0,2,0,0,0,0|0,0,0]=2 612 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 Y8738 [0,2,0,0,0,0|0,0,0]=2 613 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 3895AB [0,2,0,0,0,0|0,0,0]=2 614 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 2338AC [0,2,0,0,0,0|0,0,0]=2 615 B11R1.22 O=CC(=O)C1=CC=C(Br)C=C1 A977 [0,2,0,0,0,0|0,0,1]=3 616 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 5627AH [0,2,0,0,0,0|0,0,1]=3 617 B11R1.22 O=CC(=O)C1=CC=C(O)C=C1 W4184 [0,2,0,0,0,0|0,0,1]=3 618 B11R1.22 OCC(Cl)C1=CC=C(Cl)C=C1 2030AL [0,2,0,0,0,0|1,0,1]=4 619 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 5554AC [0,2,0,0,0,0|0,0,2]=4 620 B11R1.22 OC[C@H](O)C1=CC=C(Cl)C=C1 X3150 [0,2,0,0,0,0|0,0,2]=4 621 B11R1.22 O\N=C(/Cl)C1=CC=C(Br)C=C1 9497AJ [0,2,0,0,0,0|1,0,1]=4 622 B11R1.22 O\N=C(/Cl)C1=CC=C(Cl)C=C1 2731AB [0,2,0,0,0,0|1,0,1]=4 623 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [0,2,0,0,0,0|0,0,0]=2 624 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 5596AH [0,2,0,0,0,0|0,0,0]=2 625 B11R1.166 CC(=O)C1=CC=C(Br)C=C1N X9573 [0,2,0,0,0,0|0,0,0]=2 626 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 2069AF [0,2,0,0,0,0|1,0,0]=3 627 B11R1.166 CC(=O)C1=CNC(=O)N=C1C X9048 [0,2,0,0,0,0|2,0,0]=4 628 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F Z7758 [0,2,0,0,0,0|1,0,0]=3 629 B11R1.166 CC(=O)C1=NC=C(Cl)C=C1Cl 6873AA [0,2,0,0,0,0|1,0,0]=3 630 B11R1.166 CC1=C(C(=N)N)C=CC(Cl)=C1 1883AF [0,2,0,0,0,0|2,0,0]=4 631 B11R1.166 CC1=C(C(N)=S)C=CC(Cl)=C1 8169AD [0,2,0,0,0,0|1,1,0]=4 632 B11R1.166 CC1=C(N(C)C)C=CC(N)=C1 9005AD [0,2,0,0,0,0|2,0,0]=4 633 B11R1.166 CC1=CC(Br)=CC=C1N(C)C V6277 [0,2,0,0,0,0|2,0,0]=4 634 B11R1.166 CC1=CC(Br)=CN=C1C(N)=O V3028 [0,2,0,0,0,0|2,0,0]=4 635 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 1357AA [0,2,0,0,0,0|2,0,0]=4 636 B11R1.166 CC1=CC(N)=C(C(N)=O)N=C1 1002AD [0,2,0,0,0,0|2,0,0]=4 637 B11R1.166 CC1=CC(N)=C(N(C)C)C=C1 6144AD [0,2,0,0,0,0|2,0,0]=4 638 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 1620AJ [0,2,0,0,0,0|2,0,0]=4 639 B11R1.166 CC1=NC(N)=CC=C1C(=O)O 0478AC [0,2,0,0,0,0|2,0,0]=4 640 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 X9715 [0,2,0,0,0,0|2,0,0]=4 641 B11R1.166 CN(C)C1=C(F)C=C(N)C=C1 2086AE [0,2,0,0,0,0|2,0,0]=4 642 B11R1.166 CN(C)C1=C(N)C=C(F)C=C1 6145AD [0,2,0,0,0,0|2,0,0]=4 643 B11R1.166 CN(C)C1=CC=C(N)C=C1Cl 6600AE [0,2,0,0,0,0|2,0,0]=4 644 B11R1.166 C[C@@H](N)C1=C(Cl)C=C(Cl)C=C1 1178AL [0,2,0,0,0,0|1,0,1]=4 645 B11R1.166 C[C@@H](N)C1=C(F)C=C(F)C=C1 2379AC [0,2,0,0,0,0|1,0,1]=4 646 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8708 [0,2,0,0,0,0|1,0,1]=4 647 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F W8720 [0,2,0,0,0,0|1,0,1]=4 648 B11R1.166 N=C(N)C1=C(F)C=C(Br)C=C1 2690AJ [0,2,0,0,0,0|2,0,0]=4 649 B11R1.166 N=C(N)C1=CC=C(Br)C=C1F 3281AH [0,2,0,0,0,0|2,0,0]=4 650 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1Cl 1384AJ [0,2,0,0,0,0|2,0,0]=4 651 B11R1.166 N=C(N)C1=CC=C(Cl)C=C1F 5593AH [0,2,0,0,0,0|2,0,0]=4 652 B11R1.166 N=C(N)C1=CC=C(F)C=C1Cl 5020AH [0,2,0,0,0,0|2,0,0]=4 653 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=N1 2582AB [0,2,0,0,0,0|2,0,0]=4 654 B11R1.166 NC(=O)C1=C(O)C=C(Cl)C=C1 4852AB [0,2,0,0,0,0|1,0,0]=3 655 B11R1.166 NC(=O)C1=CC=C(Br)C=C1Cl V5905 [0,2,0,0,0,0|1,0,0]=3 656 B11R1.166 NC(=O)C1=CN=C(O)C=C1O 6041AJ [0,2,0,0,0,0|2,0,0]=4 657 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O 7647AB [0,2,0,0,0,0|2,0,0]=4 658 B11R1.166 NC1=CC(O)=NC=C1C(=O)O Z5190 [0,2,0,0,0,0|2,0,0]=4 659 B11R1.166 O=C(Cl)C1=CC=C(Cl)N=C1Cl Z0711 [0,2,0,0,0,0|2,0,0]=4 660 B11R1.166 O=C(O)C1=C(Cl)N=C(F)C=C1 3712AA [0,2,0,0,0,0|2,0,0]=4 661 B11R1.166 O=C(O)C1=C(F)C=C(F)N=C1 3121AC [0,2,0,0,0,0|2,0,0]=4 662 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Cl 1385AA [0,2,0,0,0,0|2,0,0]=4 663 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Br 1384AA [0,2,0,0,0,0|2,0,0]=4 664 B11R1.166 O=C(O)C1=CC=C(I)C=C1O 8615AA [0,2,0,0,0,0|1,0,0]=3 665 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F Y8203 [0,2,0,0,0,0|2,0,0]=4 666 B11R1.7 C=C[Si](C)(Cl)C1=CC=CC=C1 0115AQ [0,2,0,0,0,0|1,1,0]=4 667 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 3361AA [0,2,0,0,0,0|1,0,1]=4 668 B11R1.7 CC(C)(CN)C1=CC=CC=C1 0879AB [0,2,0,0,0,0|1,0,1]=4 669 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Y6483 [0,2,0,0,0,0|0,0,2]=4 670 B11R1.7 CC(O)(CN)C1=CC=CC=C1 4663AH [0,2,0,0,0,0|0,0,2]=4 671 B11R1.7 CCC(F)(F)C1=CC=CC=C1 9060AE [0,2,0,0,0,0|1,0,1]=4 672 B11R1.7 CCS(=O)(=O)C1=CC=CC=C1 M421 [0,2,0,0,0,0|1,0,0]=3 673 B11R1.7 FC(F)(CBr)C1=CC=CC=C1 Y7004 [0,2,0,0,0,0|1,0,1]=4 674 B11R1.12 CCC(CN)C1=CC=CC=C1 V4239 [0,2,0,0,0,0|1,0,1]=4 675 B11R1.12 CCC(NC)C1=CC=CC=C1 8595AL [0,2,0,0,0,0|1,0,1]=4 676 B11R1.12 CCC(NN)C1=CC=CC=C1 8342AH [0,2,0,0,0,0|1,0,1]=4 677 B11R1.12 CN[C@@H](CO)C1=CC=CC=C1 3045AC [0,2,0,0,0,0|0,0,2]=4 678 B11R1.12 CN[C@H](CO)C1=CC=CC=C1 7034AA [0,2,0,0,0,0|0,0,2]=4 679 B11R1.16 C#CCC(N)C1=CC=CC=C1 2882AA [0,2,0,0,0,0|1,0,1]=4 680 B11R1.16 C=CC[C@@H](N)C1=CC=CC=C1 1033AL [0,2,0,0,0,0|1,0,1]=4 681 B11R1.16 CC(CCN)C1=CC=CC=C1 2059AE [0,2,0,0,0,0|1,0,1]=4 682 B11R1.16 CC(N=C=O)C1=CC=CC=C1 6171AD [0,2,0,0,0,0|0,0,1]=3 683 B11R1.16 CCNC(C)C1=CC=CC=C1 7343AC [0,2,0,0,0,0|1,0,1]=4 684 B11R1.16 CCOC(=N)C1=CC=NC=C1 Y9045 [0,2,0,0,0,0|2,0,0]=4 685 B11R1.16 CCOC(=O)C1=CC=NN=C1 5094AB [0,2,0,0,0,0|2,0,0]=4 686 B11R1.16 CN(CCN)C1=CC=CC=C1 5337AD [0,2,0,0,0,0|2,0,0]=4 687 B11R1.16 CNCC(C)C1=CC=CC=C1 3764AF [0,2,0,0,0,0|1,0,1]=4 688 B11R1.16 CNCC(C)C1=CC=CC=C1 6409AE [0,2,0,0,0,0|1,0,1]=4 689 B11R1.16 C\C=C\C(=O)C1=CC=CC=C1 6705AB [0,2,0,0,0,0|0,0,0]=2 690 B11R1.16 ClCCC(Br)C1=CC=CC=C1 V4390 [0,2,0,0,0,0|1,0,1]=4 691 B11R1.16 N#CNC(=O)C1=CC=CC=C1 4699AD [0,2,0,0,0,0|0,0,1]=3 692 B11R1.16 N#C\N=C(/N)C1=CC=CC=C1 5678AD [0,2,0,0,0,0|1,0,1]=4 693 B11R1.16 O=C(\C=C\Cl)C1=CC=CC=C1 0138AQ [0,2,0,0,0,0|0,0,1]=3 694 B11R1.23 CC1=CC=CC(C(=O)C#N)=C1 5362AH [0,2,0,0,0,0|0,0,1]=3 695 B11R1.23 CC1=CC=CC(C(=O)CBr)=C1 7064AB [0,2,0,0,0,0|0,0,0]=2 696 B11R1.23 CC1=CC=CC(C(O)CN)=C1 7583AB [0,2,0,0,0,0|0,0,2]=4 697 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 2535AE [0,2,0,0,0,0|1,0,1]=4 698 B11R1.23 CCC(N)C1=CC(N)=CC=C1 1913AJ [0,2,0,0,0,0|1,0,1]=4 699 B11R1.23 CCS(=O)C1=CC(Br)=CC=C1 V3491 [0,2,0,0,0,0|1,0,0]=3 700 B11R1.23 CC[C@@H](N)C1=CC=CC(F)=C1 X9176 [0,2,0,0,0,0|1,0,1]=4 701 B11R1.23 CC[C@H](N)C1=CC=CC(Cl)=C1 9082AH [0,2,0,0,0,0|1,0,1]=4 702 B11R1.23 CNC(=O)C1=CC(Br)=NC=C1 V5272 [0,2,0,0,0,0|1,0,0]=3 703 B11R1.23 CNC(=O)C1=CC(Cl)=CC=C1 8051AJ [0,2,0,0,0,0|0,0,0]=2 704 B11R1.23 CNC(=O)C1=CC=CC(O)=C1 2288AJ [0,2,0,0,0,0|0,0,0]=2 705 B11R1.23 CNC(=O)C1=NC(Br)=CC=C1 V5271 [0,2,0,0,0,0|1,0,0]=3 706 B11R1.23 COC(=O)C1=CC(N)=NC=N1 2200AC [0,2,0,0,0,0|2,0,0]=4 707 B11R1.23 COC(=O)C1=CN=CC(O)=C1 7119AJ [0,2,0,0,0,0|1,0,0]=3 708 B11R1.23 COC(=O)C1=NC(N)=NC=C1 1008AB [0,2,0,0,0,0|2,0,0]=4 709 B11R1.23 COC(=O)C1=NC=CC(C)=N1 Z4587 [0,2,0,0,0,0|2,0,0]=4 710 B11R1.23 COC(=O)C1=NC=CC(O)=C1 4279AJ [0,2,0,0,0,0|1,0,0]=3 711 B11R1.23 N#CC(=O)C1=CC(F)=CC=C1 2278AJ [0,2,0,0,0,0|0,0,1]=3 712 B11R1.23 N=C(NO)C1=CC=CC(Br)=C1 V3789 [0,2,0,0,0,0|1,0,1]=4 713 B11R1.23 N=C(NO)C1=CC=CC(Cl)=C1 W4576 [0,2,0,0,0,0|1,0,1]=4 714 B11R1.23 NC(CO)C1=CC(Cl)=CC=C1 3155AH [0,2,0,0,0,0|1,0,1]=4 715 B11R1.23 NCC(=O)C1=CC(Br)=CC=C1 9285AB [0,2,0,0,0,0|0,0,0]=2 716 B11R1.23 NCC(=O)C1=CC(F)=CC=C1 5755AC [0,2,0,0,0,0|0,0,0]=2 717 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 V2280 [0,2,0,0,0,0|0,0,0]=2 718 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 2712AC [0,2,0,0,0,0|0,0,2]=4 719 B11R1.23 NCC(O)C1=CC(F)=CC=C1 5405AB [0,2,0,0,0,0|0,0,2]=4 720 B11R1.23 NNC(=O)C1=CC(Cl)=NC=C1 6071AE [0,2,0,0,0,0|2,0,0]=4 721 B11R1.23 NNC(=O)C1=NC(Cl)=CC=C1 4594AF [0,2,0,0,0,0|2,0,0]=4 722 B11R1.23 NNC(=O)C1=NC(I)=CC=C1 0675AF [0,2,0,0,0,0|2,0,0]=4 723 B11R1.23 N[C@@H](CO)C1=CC(Cl)=CC=C1 N836 [0,2,0,0,0,0|1,0,1]=4 724 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 8352AB [0,2,0,0,0,0|1,0,0]=3 725 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 7664AB [0,2,0,0,0,0|0,0,0]=2 726 B11R1.23 O=CC(=O)C1=CC=CC(Br)=C1 X8794 [0,2,0,0,0,0|0,0,1]=3 727 B11R1.23 OCC(Cl)C1=CC=CC(Cl)=C1 2029AL [0,2,0,0,0,0|1,0,1]=4 728 B11R1.23 OC[C@H](O)C1=CC=CC(Cl)=C1 X3148 [0,2,0,0,0,0|0,0,2]=4 729 B11R1.23 O[C@@H](CCl)C1=CC=CC(Cl)=C1 6985AA [0,2,0,0,0,0|0,0,2]=4 730 B11R1.23 O\N=C(/Cl)C1=CC(Br)=CC=C1 9462AJ [0,2,0,0,0,0|1,0,1]=4 731 B11R1.23 O\N=C(/Cl)C1=CC(F)=CC=C1 9466AJ [0,2,0,0,0,0|1,0,1]=4 732 B11R1.222 CC1=C(C(=O)NN)C=CC=N1 6633AD [0,2,0,0,0,0|2,0,0]=4 733 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 2680AE [0,2,0,0,0,0|1,0,1]=4 734 B11R1.222 CC1=CC=CC=C1C(=O)C#N S734 [0,2,0,0,0,0|0,0,1]=3 735 B11R1.222 CC1=CC=CC=C1C(=O)CN X6576 [0,2,0,0,0,0|0,0,0]=2 736 B11R1.222 CCC(=O)C1=CC=CN=C1Cl 5775AA [0,2,0,0,0,0|1,0,0]=3 737 B11R1.222 CCC(=O)C1=NC=CC=C1C V9138 [0,2,0,0,0,0|1,0,0]=3 738 B11R1.222 CC[C@@H](N)C1=CC=CC=C1C W8813 [0,2,0,0,0,0|1,0,1]=4 739 B11R1.222 CC[C@H](N)C1=CC=CC=C1Cl W8965 [0,2,0,0,0,0|1,0,1]=4 740 B11R1.222 CNC(=O)C1=NC=CN=C1N 4576AB [0,2,0,0,0,0|2,0,0]=4 741 B11R1.222 COC(=O)C1=C(Cl)C=CN=C1 9708AB [0,2,0,0,0,0|1,0,0]=3 742 B11R1.222 COC(=O)C1=CC=CN=C1S 9094AE [0,2,0,0,0,0|1,0,0]=3 743 B11R1.222 COC(=O)C1=CN=CC=C1Cl X9905 [0,2,0,0,0,0|1,0,0]=3 744 B11R1.222 COC(=O)C1=CN=CC=C1O V7225 [0,2,0,0,0,0|1,0,0]=3 745 B11R1.222 COC(=O)C1=NC=CN=C1I W3780 [0,2,0,0,0,0|2,0,0]=4 746 B11R1.222 N=C(NO)C1=C(Br)C=CC=C1 9398AJ [0,2,0,0,0,0|1,0,1]=4 747 B11R1.222 N=C(NO)C1=CC=CC=C1Cl 9402AJ [0,2,0,0,0,0|1,0,1]=4 748 B11R1.222 NC1=CC=CC=C1C(=O)NO 5665AE [0,2,0,0,0,0|1,0,0]=3 749 B11R1.222 NCC(O)C1=C(Cl)C=CC=C1 5504AB [0,2,0,0,0,0|0,0,2]=4 750 B11R1.222 NCC(O)C1=CC=CC=C1F 3587AB [0,2,0,0,0,0|0,0,2]=4 751 B11R1.222 NNC(=O)C1=C(N)C=NC=C1 7290AE [0,2,0,0,0,0|2,0,0]=4 752 B11R1.222 NNC(=O)C1=CC=CC=C1I 0066AE [0,2,0,0,0,0|1,0,0]=3 753 B11R1.222 NNC(=O)C1=CC=CN=C1N Y9355 [0,2,0,0,0,0|2,0,0]=4 754 B11R1.222 NNC(=O)C1=NC=CC=C1F 1032AA [0,2,0,0,0,0|2,0,0]=4 755 B11R1.222 N\C(=N\O)C1=CC=CC=C1F 9412AJ [0,2,0,0,0,0|1,0,1]=4 756 B11R1.222 O=C(CO)C1=C(Cl)C=CC=C1 4897AJ [0,2,0,0,0,0|0,0,0]=2 757 B11R1.222 O\N=C(/Cl)C1=C(Br)C=CC=C1 9397AJ [0,2,0,0,0,0|1,0,1]=4 758 B11R1.87 CC(C)(N)C1=C(Br)C=CC=C1 8926AA [0,2,0,0,0,0|1,0,1]=4 759 B11R1.87 CC(C)(O)C1=CC=CC=C1F V5135 [0,2,0,0,0,0|0,0,2]=4 760 B11R1.87 CC(F)(F)C1=CC=CC=C1Br 0997AQ [0,2,0,0,0,0|1,0,1]=4 761 B11R1.87 CC1=C(C(C)(C)C)C=CC=C1 1688AL [0,2,0,0,0,0|1,0,1]=4 762 B11R1.87 CS(=O)(=O)C1=CC=CC=C1Cl 9053AA [0,2,0,0,0,0|1,0,0]=3 763 B11R1.87 O=S(=O)(F)C1=C(F)C=CC=C1 5560AJ [0,2,0,0,0,0|2,0,0]=4 764 B11R1.87 O=S(=O)(O)C1=C(I)C=CC=C1 5660AL [0,2,0,0,0,0|2,0,0]=4 765 B11R1.155 CC(C)(O)C1=CC=CC(F)=C1 V5757 [0,2,0,0,0,0|0,0,2]=4 766 B11R1.155 CC1=CC(S(=O)(=O)F)=CC=C1 0481AQ [0,2,0,0,0,0|2,0,0]=4 767 B11R1.155 CC1=CC(S(N)(=O)=O)=CC=C1 V3660 [0,2,0,0,0,0|2,0,0]=4 768 B11R1.155 CC1=CC=CC(C(C)(C)C)=C1 6162AL [0,2,0,0,0,0|1,0,1]=4 769 B11R1.155 CS(=O)(=O)C1=CC(N)=CC=N1 X3607 [0,2,0,0,0,0|2,0,0]=4 770 B11R1.155 CS(=O)(=O)C1=CC(O)=CC=C1 2313AJ [0,2,0,0,0,0|1,0,0]=3 771 B11R1.155 CS(=O)(=O)C1=CC=CC(F)=C1 0090AC [0,2,0,0,0,0|1,0,0]=3 772 B11R1.155 NC1=CC(S(=O)(=O)[O-])=CC=C1 V0480 [0,2,0,0,0,0|2,0,0]=4 773 B11R1.155 O=S(=O)(F)C1=CC=CC(Br)=C1 V6027 [0,2,0,0,0,0|2,0,0]=4 774 B11R1.155 O=S(=O)(O)C1=CC(I)=CC=C1 5350AH [0,2,0,0,0,0|2,0,0]=4 775 B11R1.53 C#CC1=C(C(C)=O)C=CC=C1 1385AL [0,2,0,0,0,0|0,0,0]=2 776 B11R1.53 C=CC1=CC=CC=C1C(=O)O 2578AB [0,2,0,0,0,0|1,0,0]=3 777 B11R1.53 CC(C)C1=CC=CC=C1CO 0808AB [0,2,0,0,0,0|1,0,1]=4 778 B11R1.53 CCC1=C(C(=O)O)C=CN=C1 5553AB [0,2,0,0,0,0|2,0,0]=4 779 B11R1.53 CNC1=C(C(=O)O)C=CC=N1 3608AB [0,2,0,0,0,0|2,0,0]=4 780 B11R1.53 COC1=C(C(=O)O)C=CN=C1 Y9427 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.53 COC1=C(C(C)=O)C=CN=C1 2865AC [0,2,0,0,0,0|1,0,0]=3 782 B11R1.53 COC1=C(C(N)=O)C=NC=C1 1526AC [0,2,0,0,0,0|2,0,0]=4 783 B11R1.53 COC1=C([C@@H](C)N)C=CC=C1 0915AC [0,2,0,0,0,0|1,0,1]=4 784 B11R1.53 COC1=C([C@H](C)N)C=CC=C1 6065AA [0,2,0,0,0,0|1,0,1]=4 785 B11R1.53 COC1=CC=CC=C1C(=N)N 1766AJ [0,2,0,0,0,0|2,0,0]=4 786 B11R1.53 COC1=CC=CC=C1C(=N)N 4779AE [0,2,0,0,0,0|2,0,0]=4 787 B11R1.53 COC1=CC=CN=C1C(C)=O Z4678 [0,2,0,0,0,0|1,0,0]=3 788 B11R1.53 CSC1=C(C(N)=O)C=CC=N1 Y7856 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.53 CSC1=CC=CC=C1C(C)=O W3214 [0,2,0,0,0,0|0,0,0]=2 790 B11R1.53 CSC1=CC=CC=C1[N+](=O)[O-] W5298 [0,2,0,0,0,0|2,0,0]=4 791 B11R1.53 N#CC1=C(C(=O)O)C=CC=N1 1354AC [0,2,0,0,0,0|2,0,0]=4 792 B11R1.53 N#CC1=C(C(=O)O)C=CN=C1 1346AA [0,2,0,0,0,0|2,0,0]=4 793 B11R1.53 N#CC1=C(C(=O)O)C=NC=C1 Z0867 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.53 NCC1=CC=CC=C1C(=O)O 7123AC [0,2,0,0,0,0|1,0,0]=3 795 B11R1.53 NNC1=C(C(=O)O)C=CC=N1 3348AE [0,2,0,0,0,0|2,0,0]=4 796 B11R1.53 O=C(Br)C1=C(CBr)C=CC=C1 2821AE [0,2,0,0,0,0|1,0,0]=3 797 B11R1.53 O=CC1=C(C(=O)O)C=CC=N1 1604AB [0,2,0,0,0,0|2,0,0]=4 798 B11R1.53 O=[N+]([O-])C1=C(SCl)C=CC=C1 P643 [0,2,0,0,0,0|2,0,0]=4 799 B11R1.156 CC(=O)C1=C(C)C=CC=C1O 5570AJ [0,2,0,0,0,0|0,0,0]=2 800 B11R1.156 CC(=O)C1=C(Cl)C=NC=C1Cl X5513 [0,2,0,0,0,0|1,0,0]=3 801 B11R1.156 CC1=C(C(=O)O)C(O)=NC=C1 4902AB [0,2,0,0,0,0|2,0,0]=4 802 B11R1.156 CC1=C(C(N)=O)C(Cl)=CC=C1 0333AA [0,2,0,0,0,0|1,0,0]=3 803 B11R1.156 CC1=CC=CC(C)=C1[C@H](C)N 3805AA [0,2,0,0,0,0|1,0,1]=4 804 B11R1.156 CC1=CC=NC(Cl)=C1C(=O)O 6948AA [0,2,0,0,0,0|2,0,0]=4 805 B11R1.156 CC1=CN=CC(F)=C1C(=O)O 3721AA [0,2,0,0,0,0|2,0,0]=4 806 B11R1.156 CC1=NC=CC(Br)=C1C(=O)O 1355AA [0,2,0,0,0,0|2,0,0]=4 807 B11R1.156 CC1=NC=CC(C)=C1C(=O)O 8068AB [0,2,0,0,0,0|2,0,0]=4 808 B11R1.156 CN(C)C1=C(Cl)C=CC=C1N 9963AC [0,2,0,0,0,0|2,0,0]=4 809 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1F 1259AL [0,2,0,0,0,0|1,0,1]=4 810 B11R1.156 N=C(N)C1=C(Cl)C=CC=C1Cl 1411AJ [0,2,0,0,0,0|2,0,0]=4 811 B11R1.156 N=C(N)C1=C(F)C=CC=C1Cl 1668AJ [0,2,0,0,0,0|2,0,0]=4 812 B11R1.156 N=C(N)C1=C(F)C=CC=C1Cl 5026AH [0,2,0,0,0,0|2,0,0]=4 813 B11R1.156 N=C(N)C1=C(F)C=CC=C1F 1413AJ [0,2,0,0,0,0|2,0,0]=4 814 B11R1.156 NC(=O)C1=C(Cl)N=CC=C1Cl 8467AE [0,2,0,0,0,0|2,0,0]=4 815 B11R1.156 NC1=CC=CC(O)=C1C(=O)O W7041 [0,2,0,0,0,0|1,0,0]=3 816 B11R1.156 O=C(Cl)C1=C(Cl)C=CN=C1Cl 0732AQ [0,2,0,0,0,0|2,0,0]=4 817 B11R1.156 O=C(O)C1=C(Br)C=CC=C1O 5040AB [0,2,0,0,0,0|1,0,0]=3 818 B11R1.156 O=C(O)C1=C(Br)C=NC=C1F Z1166 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.156 O=C(O)C1=C(Cl)N=CC=C1Br Y3602 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.156 O=[N+]([O-])C1=C(I)C=CC=C1O Z1987 [0,2,0,0,0,0|2,0,0]=4 821 B11R1.159 CC(=O)C1=C(N)C(Br)=CC=C1 Q602 [0,2,0,0,0,0|0,0,0]=2 822 B11R1.159 CC(=O)C1=CC=CC(O)=C1F Z8077 [0,2,0,0,0,0|0,0,0]=2 823 B11R1.159 CC(C)C1=CC=CC(O)=C1O 0871AB [0,2,0,0,0,0|1,0,1]=4 824 B11R1.159 CC(O)C1=C(F)C(Br)=CC=C1 4219AA [0,2,0,0,0,0|0,0,2]=4 825 B11R1.159 CC(O)C1=CC=CC(F)=C1F 4879AJ [0,2,0,0,0,0|0,0,2]=4 826 B11R1.159 CC1=C(Br)C=NC=C1C(=O)O Z0772 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.159 CC1=C(C(=O)O)C=NC=C1N 3079AJ [0,2,0,0,0,0|2,0,0]=4 828 B11R1.159 CC1=C(O)C(C(N)=O)=CC=C1 5564AJ [0,2,0,0,0,0|1,0,0]=3 829 B11R1.159 CC1=C([O-])C(C(=O)O)=CC=C1 3660AB [0,2,0,0,0,0|1,0,0]=3 830 B11R1.159 CN1C(=O)C=CC=C1C(=O)O Z4924 [0,2,0,0,0,0|2,0,0]=4 831 B11R1.159 N=C(N)C1=CC=CC(Cl)=C1Cl 1343AJ [0,2,0,0,0,0|2,0,0]=4 832 B11R1.159 NC(=O)C1=CC=CC(N)=C1N Y6362 [0,2,0,0,0,0|1,0,0]=3 833 B11R1.159 NC(=S)C1=C(Cl)C(Cl)=CC=C1 0542AF [0,2,0,0,0,0|1,1,0]=4 834 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O Z4830 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.159 NC1=C(C(=O)O)C=CC=C1O 6062AL [0,2,0,0,0,0|1,0,0]=3 836 B11R1.159 NC1=C(I)C=CC=C1C(=O)O X2788 [0,2,0,0,0,0|1,0,0]=3 837 B11R1.159 NC1=CC=CC(C(=O)O)=C1I 0474AQ [0,2,0,0,0,0|1,0,0]=3 838 B11R1.159 O=C(O)C1=C(Cl)C(Br)=NC=C1 3884AA [0,2,0,0,0,0|2,0,0]=4 839 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I 4447AA [0,2,0,0,0,0|1,0,0]=3 840 B11R1.159 O=C(O)C1=CC=CC(O)=C1Br 5445AC [0,2,0,0,0,0|1,0,0]=3 841 B11R1.159 O=C(O)C1=CC=CC(O)=C1F Z1094 [0,2,0,0,0,0|1,0,0]=3 842 B11R1.159 O=C(O)C1=CC=NC(Br)=C1I 0532AF [0,2,0,0,0,0|2,0,0]=4 843 B11R1.159 O=C(O)C1=CN=CC(Br)=C1I 0608AQ [0,2,0,0,0,0|2,0,0]=4 844 B11R1.159 O=C(O)C1=CN=CC(Cl)=C1Cl 4093AE [0,2,0,0,0,0|2,0,0]=4 845 B11R1.159 O=[N+]([O-])C1=C(Br)C(Br)=CC=C1 V4790 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.159 O=[N+]([O-])C1=CC=CC(F)=C1I 4260AA [0,2,0,0,0,0|2,0,0]=4 847 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1O 0237AC [0,2,0,0,0,0|2,0,0]=4 848 B11R1.167 CC(=O)C1=C(Br)C=CC(C)=C1 X7080 [0,2,0,0,0,0|0,0,0]=2 849 B11R1.167 CC(=O)C1=CC(Br)=NC=C1F X5166 [0,2,0,0,0,0|1,0,0]=3 850 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl 1794AF [0,2,0,0,0,0|1,0,0]=3 851 B11R1.167 CC(=O)C1=CC(F)=CC=C1C X8233 [0,2,0,0,0,0|0,0,0]=2 852 B11R1.167 CC(=O)C1=CC(F)=CN=C1Cl 3519AA [0,2,0,0,0,0|1,0,0]=3 853 B11R1.167 CC(C)C1=C(I)C=CC(O)=C1 0454AA [0,2,0,0,0,0|1,0,1]=4 854 B11R1.167 CC(C)C1=CC(Br)=CC=C1O Z0453 [0,2,0,0,0,0|1,0,1]=4 855 B11R1.167 CC(N)C1=C(Cl)C=CC(Cl)=C1 9385AH [0,2,0,0,0,0|1,0,1]=4 856 B11R1.167 CC1=C(C(=O)O)C=C(I)C=N1 0904AQ [0,2,0,0,0,0|2,0,0]=4 857 B11R1.167 CC1=C(C(=O)O)C=C(N)C=N1 1797AA [0,2,0,0,0,0|2,0,0]=4 858 B11R1.167 CC1=C(C(=O)O)OC(=O)C=C1 3225AB [0,2,0,0,0,0|2,0,0]=4 859 B11R1.167 CC1=C(C(N)=O)C=[N+](C)C=C1 8765AC [0,2,0,0,0,0|2,0,0]=4 860 B11R1.167 CC1=C(N(C)C)C=C(N)C=C1 9814AB [0,2,0,0,0,0|2,0,0]=4 861 B11R1.167 CC1=CC(C(=O)O)=C(N)N=C1 X7039 [0,2,0,0,0,0|2,0,0]=4 862 B11R1.167 CC1=CC=C(Cl)C=C1C(N)=O Y5855 [0,2,0,0,0,0|1,0,0]=3 863 B11R1.167 CC1=CC=C(F)C=C1C(=N)N 1880AF [0,2,0,0,0,0|2,0,0]=4 864 B11R1.167 CC1=CC=C(F)C=C1C(=N)N 5851AH [0,2,0,0,0,0|2,0,0]=4 865 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 Y3581 [0,2,0,0,0,0|2,0,0]=4 866 B11R1.167 CC1=NC(C(=O)O)=C(Br)C=C1 2220AC [0,2,0,0,0,0|2,0,0]=4 867 B11R1.167 CC1=NC(C(=O)O)=C(C)C=C1 2855AC [0,2,0,0,0,0|2,0,0]=4 868 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=C1 Z3850 [0,2,0,0,0,0|2,0,0]=4 869 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O Y5175 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 4148AC [0,2,0,0,0,0|2,0,0]=4 871 B11R1.167 C[C@H](N)C1=C(Cl)C=CC(Cl)=C1 8392AH [0,2,0,0,0,0|1,0,1]=4 872 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 0380AC [0,2,0,0,0,0|2,0,0]=4 873 B11R1.167 N=C(N)C1=C(F)C=CC(Cl)=C1 5824AH [0,2,0,0,0,0|2,0,0]=4 874 B11R1.167 N=C(N)C1=CC(Br)=CC=C1F 5799AH [0,2,0,0,0,0|2,0,0]=4 875 B11R1.167 N=C(N)C1=CC(F)=CC=C1F 1401AJ [0,2,0,0,0,0|2,0,0]=4 876 B11R1.167 NC(=O)C1=C(Br)N=CC(Br)=C1 Z1272 [0,2,0,0,0,0|2,0,0]=4 877 B11R1.167 NC(=O)C1=C(Cl)C=CC(Cl)=N1 7688AA [0,2,0,0,0,0|2,0,0]=4 878 B11R1.167 NC(=O)C1=C(F)C=CC(Cl)=C1 2259AB [0,2,0,0,0,0|1,0,0]=3 879 B11R1.167 NC(=O)C1=CC(Br)=CN=C1F Z0071 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.167 NC(=O)C1=CC(Cl)=NC=C1Cl Y3868 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.167 NC(=O)C1=NC(Br)=CC=C1Cl 2973AD [0,2,0,0,0,0|2,0,0]=4 882 B11R1.167 NC(=O)C1=NC(Cl)=CC=C1Br 5390AA [0,2,0,0,0,0|2,0,0]=4 883 B11R1.167 NC(=S)C1=C(Cl)C=CC(Cl)=C1 8311AE [0,2,0,0,0,0|1,1,0]=4 884 B11R1.167 NC1=C(C(=O)O)C=C(F)C=N1 Z8105 [0,2,0,0,0,0|2,0,0]=4 885 B11R1.167 NC1=CC(C(=O)O)=C(N)C=C1 9139AB [0,2,0,0,0,0|1,0,0]=3 886 B11R1.167 NC1=CC=C(Cl)C(C(=O)O)=N1 Z6498 [0,2,0,0,0,0|2,0,0]=4 887 B11R1.167 NC1=CC=C(Cl)N=C1C(=O)O 2138AJ [0,2,0,0,0,0|2,0,0]=4 888 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=N1 3738AA [0,2,0,0,0,0|2,0,0]=4 889 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=N1 1202AA [0,2,0,0,0,0|2,0,0]=4 890 B11R1.167 O=C(O)C1=CC(Br)=CC=C1S X6084 [0,2,0,0,0,0|1,0,0]=3 891 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1O 1351AA [0,2,0,0,0,0|2,0,0]=4 892 B11R1.167 O=C(O)C1=CC(F)=NC=C1F 0694AF [0,2,0,0,0,0|2,0,0]=4 893 B11R1.167 O=C(O)C1=NC(Br)=CC=C1Cl Z6839 [0,2,0,0,0,0|2,0,0]=4 894 B11R1.167 O=C(O)C1=NC(O)=CC=C1Br 3831AA [0,2,0,0,0,0|2,0,0]=4 895 B11R1.167 O=C(O)C1=NC(O)=CC=C1F 9014AB [0,2,0,0,0,0|2,0,0]=4 896 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1O 8130AA [0,2,0,0,0,0|2,0,0]=4 897 B11R1.74 C=C(C)C1=CC(Cl)=CC(Cl)=C1 8134AE [0,2,0,0,0,0|1,0,0]=3 898 B11R1.74 CC(=O)C1=CC(C)=NC(C)=C1 1375AL [0,2,0,0,0,0|1,0,0]=3 899 B11R1.74 CC1=CC(=O)C=C(C(=O)O)N1 4279AD [0,2,0,0,0,0|2,0,0]=4 900 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=N1 4513AC [0,2,0,0,0,0|2,0,0]=4 901 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 3341AC [0,2,0,0,0,0|2,0,0]=4 902 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 Z4314 [0,2,0,0,0,0|2,0,0]=4 903 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 X4379 [0,2,0,0,0,0|2,0,0]=4 904 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 3141AB [0,2,0,0,0,0|2,0,0]=4 905 B11R1.74 C[C@H](N)C1=CC(F)=CC(F)=C1 W6333 [0,2,0,0,0,0|1,0,1]=4 906 B11R1.74 N=C(N)C1=CC(Cl)=CC(Cl)=C1 2098AJ [0,2,0,0,0,0|2,0,0]=4 907 B11R1.74 N=C(N)C1=CC(F)=CC(F)=C1 8619AB [0,2,0,0,0,0|2,0,0]=4 908 B11R1.74 NC(=O)C1=CC(N)=CC(F)=C1 0881AA [0,2,0,0,0,0|1,0,0]=3 909 B11R1.74 NC(=O)C1=CC(O)=CC(Br)=C1 Z8779 [0,2,0,0,0,0|1,0,0]=3 910 B11R1.74 NC(=O)C1=CC(O)=CC(O)=C1 W5351 [0,2,0,0,0,0|1,0,0]=3 911 B11R1.74 NC(=O)C1=CC(O)=NC(O)=C1 5359AJ [0,2,0,0,0,0|2,0,0]=4 912 B11R1.74 NC1=CC(F)=CC([N+](=O)[O-])=C1 X0285 [0,2,0,0,0,0|2,0,0]=4 913 B11R1.74 NC1=CC(N)=CC([N+](=O)[O-])=C1 4422AE [0,2,0,0,0,0|2,0,0]=4 914 B11R1.74 NC1=NC(Cl)=CC(C(=O)O)=C1 7060AE [0,2,0,0,0,0|2,0,0]=4 915 B11R1.74 O=C(O)C1=NC(Cl)=CC(Br)=C1 Y0526 [0,2,0,0,0,0|2,0,0]=4 916 B11R1.74 O=C1C=C(C(=O)O)C=C(Cl)N1 9048AF [0,2,0,0,0,0|2,0,0]=4 917 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(I)=C1 4437AA [0,2,0,0,0,0|2,0,0]=4 918 B11R1.74 O=[N+]([O-])C1=CC(F)=CC(O)=C1 V4588 [0,2,0,0,0,0|2,0,0]=4 919 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 6794AA [0,2,0,0,0,0|0,0,0]=2 920 B11R1.266 C#CC1=CC=CC(C(N)=O)=C1 8729AB [0,2,0,0,0,0|1,0,0]=3 921 B11R1.266 CC(=O)C1=CC=CC(CCl)=C1 W6202 [0,2,0,0,0,0|0,0,0]=2 922 B11R1.266 CC(C)C1=CC=CC(NN)=C1 2311AJ [0,2,0,0,0,0|1,0,1]=4 923 B11R1.266 CC(C)C1=CC=CC(NN)=C1 8650AH [0,2,0,0,0,0|1,0,1]=4 924 B11R1.266 CCC1=CC(C(C)=O)=CC=C1 1395AB [0,2,0,0,0,0|0,0,0]=2 925 B11R1.266 CCC1=CC=CC(C(N)=O)=N1 2254AC [0,2,0,0,0,0|2,0,0]=4 926 B11R1.266 CCC1=NC(C(=O)O)=CC=C1 6504AB [0,2,0,0,0,0|2,0,0]=4 927 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 0646AE [0,2,0,0,0,0|2,0,0]=4 928 B11R1.266 CNC1=NC=CC(C(=O)O)=C1 3929AC [0,2,0,0,0,0|2,0,0]=4 929 B11R1.266 COC1=CC=CC([N+](=O)[O-])=C1 F824 [0,2,0,0,0,0|2,0,0]=4 930 B11R1.266 COC1=CN=CC(C(C)=O)=C1 X7999 [0,2,0,0,0,0|1,0,0]=3 931 B11R1.266 COC1=NC=CC(C(N)=O)=C1 Z6815 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.266 CSC1=NC=CC(C(C)=O)=N1 W6524 [0,2,0,0,0,0|2,0,0]=4 933 B11R1.266 C[C@@H](N)C1=CC(C#N)=CC=C1 X9714 [0,2,0,0,0,0|1,0,1]=4 934 B11R1.266 C[C@@H](N)C1=CC(C#N)=CC=C1 X9730 [0,2,0,0,0,0|1,0,1]=4 935 B11R1.266 N#CC1=CC(C(=O)O)=CN=C1 4593AC [0,2,0,0,0,0|2,0,0]=4 936 B11R1.266 N#CC1=CC=CC(C(=O)O)=N1 Z5234 [0,2,0,0,0,0|2,0,0]=4 937 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 5693AB [0,2,0,0,0,0|2,0,0]=4 938 B11R1.266 NNC1=CC=CC(C(=O)O)=N1 4602AC [0,2,0,0,0,0|2,0,0]=4 939 B11R1.266 NNC1=NC=CC(C(=O)O)=C1 4603AC [0,2,0,0,0,0|2,0,0]=4 940 B11R1.266 O=C(Br)C1=CC=CC(CBr)=C1 7128AD [0,2,0,0,0,0|1,0,0]=3 941 B9R1.13 CC(=O)CC1=CC=CS1 4644AD [0,0,1,1,0,0|1,0,1]=4 942 B9R1.13 CC(=O)NC1=CC=CS1 D141 [0,0,1,1,0,0|2,0,0]=4 943 B9R1.13 CN(C)C=C1C=CC=C1 0768AC [0,0,1,1,0,0|2,0,0]=4 944 B9R1.5 O=C1C=CC=CC=C1Cl 5558AL [0,0,1,1,0,0|1,0,1]=4 945 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [0,0,0,1,0,1|1,0,1]=4 946 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [0,0,0,1,0,1|1,0,1]=4 947 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [0,0,0,1,0,1|1,0,1]=4 948 B11R2.10 CC1=CC2=C(C=CC=C2)O1 X5959 [0,0,0,1,0,1|0,0,1]=3 949 B11R2.10 CC1=CC2=NC=CC=C2N1 W8141 [0,0,0,1,0,1|2,0,0]=4 950 B11R2.10 IC1=CC2=C(C=CC=C2)S1 7957AJ [0,0,0,1,0,1|1,0,1]=4 951 B11R2.10 IC1=CC2=CC=CC=C2N1 2333AB [0,0,0,1,0,1|1,0,1]=4 952 B11R2.10 O=C1C=C2C=CC=CN2N1 8937AB [0,0,0,1,0,1|1,0,1]=4 953 B11R2.10 O=C1CN2C=CC=CC2=N1 7452AB [0,0,0,1,0,1|1,0,0]=3 954 B11R2.10 O=C1NC2=C(C=NC=C2)O1 0581AC [0,0,0,1,0,1|2,0,0]=4 955 B11R2.10 O=C1OC2=C(C=CC=C2)O1 1033AB [0,0,0,1,0,1|1,0,0]=3 956 B11R2.10 S=C1CC2=C(C=CC=C2)N1 6726AB [0,0,0,1,0,1|0,1,0]=3 957 B11R2.34 BrC1=CC=C(C2CO2)C=C1 1753AL [0,1,0,1,0,0|0,0,2]=4 958 B11R2.34 ClC1=CC=C(C2CO2)C=C1 0625AQ [0,1,0,1,0,0|0,0,2]=4 959 B11R2.34 FC1=CC=C(C2CO2)C=C1 0449AQ [0,1,0,1,0,0|0,0,2]=4 960 B11R2.1 BrC1=COC2=CC=CC=C12 Y9562 [0,1,0,1,0,0|1,0,1]=4 961 B11R2.1 BrC1=NOC2=C1C=CC=C2 5187AA [0,1,0,1,0,0|1,0,1]=4 962 B11R2.1 CC1=NN=C2C=CC=CN12 1751AA [0,1,0,1,0,0|2,0,0]=4 963 B11R2.1 CC1=NN=C2C=CC=CN12 Z3789 [0,1,0,1,0,0|2,0,0]=4 964 B11R2.1 NC1=CSC2=CC=CC=C12 W5550 [0,1,0,1,0,0|1,0,1]=4 965 B11R2.1 NC1=CSC2=CC=CC=C12 Y5306 [0,1,0,1,0,0|1,0,1]=4 966 B11R2.1 NC1COC2=CC=CC=C21 4904AH [0,1,0,1,0,0|1,0,1]=4 967 B11R2.1 N[C@H]1COC2=C1C=CC=C2 1110AL [0,1,0,1,0,0|1,0,1]=4 968 B11R2.1 O=C1C=CC2=C1C=CC=C2 Y5096 [0,1,0,1,0,0|0,0,1]=3 969 B11R2.1 O=C1CCC2=NC=CC=C12 4182AA [0,1,0,1,0,0|1,0,0]=3 970 B11R2.1 O=C1COC2=CN=CC=C12 4128AJ [0,1,0,1,0,0|1,0,0]=3 971 B11R2.1 O=C1NCC2=C1C=CN=C2 1363AJ [0,1,0,1,0,0|1,0,0]=3 972 B11R2.1 O=C1NNC2=CC=CN=C12 7206AB [0,1,0,1,0,0|2,0,0]=4 973 B11R2.1 O=C1NNC2=NC=CC=C12 Z4567 [0,1,0,1,0,0|2,0,0]=4 974 B11R2.988 OCC1=CC2=CC=CC=C21 K959 [0,1,0,1,0,0|1,0,0]=3 975 B11R2.55 BrC1=C(C2CC2)C=CC=C1 8539AB [0,1,0,1,0,0|1,0,1]=4 976 B11R2.55 NC1=CC=CC=C1C2CC2 Z0502 [0,1,0,1,0,0|1,0,1]=4 977 B11R2.35 ClC1=CC([C@@H]2CO2)=CC=C1 I069 [0,1,0,1,0,0|0,0,2]=4 978 B7R1.1 COC1=CC=CO1 2109AL [1,0,0,0,1,0|2,0,0]=4 979 B7R1.1 O=CC1=CC=C[Se]1 5634AL [1,0,0,0,1,0|1,0,0]=3 980 B7R1.1 O=CC1=NC=CO1 7478AE [1,0,0,0,1,0|2,0,0]=4 981 B7R1.18 CC(=O)N1C=CC1 6529AA [0,0,0,0,2,0|1,0,1]=4 982 B11R1.91 CC(=N)NCC1=CC=CC=C1 1916AH [0,0,0,0,0,2|1,0,0]=3 983 B11R1.91 CC(=N)SCC1=CC=CC=C1 3158AL [0,0,0,0,0,2|1,0,0]=3 984 B11R1.91 CC(=O)OCC1=CC=NC=C1 N216 [0,0,0,0,0,2|1,0,0]=3 985 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [0,0,0,0,0,2|1,0,1]=4 986 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [0,0,0,0,0,2|1,0,1]=4 987 B11R1.91 N=C(N)CCC1=CC=CC=C1 8227AD [0,0,0,0,0,2|2,0,0]=4 988 B11R1.91 N=C(N)COC1=CC=CC=C1 0368AC [0,0,0,0,0,2|2,0,0]=4 989 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2381AJ [0,0,0,0,0,2|2,0,0]=4 990 B11R1.91 N=C(N)\C=C\C1=CC=CC=C1 2382AJ [0,0,0,0,0,2|2,0,0]=4 991 B11R1.91 NC(=O)C#CC1=CC=CC=C1 2477AL [0,0,0,0,0,2|1,0,0]=3 992 B11R1.91 NC(=O)CCC1=NC=CC=C1 5628AJ [0,0,0,0,0,2|2,0,0]=4 993 B11R1.91 NC(=O)CNC1=CC=CC=C1 V4420 [0,0,0,0,0,2|1,0,0]=3 994 B11R1.91 NC(N)=NCC1=CC=CC=C1 7568AD [0,0,0,0,0,2|2,0,0]=4 995 B11R1.91 O=C(O)C#CC1=CC=CN=C1 5647AJ [0,0,0,0,0,2|2,0,0]=4 996 B11R1.91 O=C(O)C#CC1=CC=NC=C1 5670AJ [0,0,0,0,0,2|2,0,0]=4 997 B11R1.91 O=C(O)CCC1=NC=CC=C1 V3472 [0,0,0,0,0,2|2,0,0]=4 998 B11R1.91 O=C(O)CNC1=CC=NC=C1 Z3284 [0,0,0,0,0,2|2,0,0]=4 999 B11R1.91 O=C(O)CSC1=NC=CC=C1 7051AC [0,0,0,0,0,2|2,0,0]=4 1000 B11R1.91 O=C([O-])C#CC1=CC=CC=C1 8155AF [0,0,0,0,0,2|1,0,0]=3