0 B8R1.2 C=CC1=CC=CC=C1 C07083 [0,0,0,0,0,0|3,0,1]=4 1 B8R1.2 C=CC1=CC=CC=C1 C19506 [0,0,0,0,0,0|3,0,1]=4 2 B8R1.2 C=CC1=CC=CC=C1 C19573 [0,0,0,0,0,0|3,0,1]=4 3 B8R1.2 C=CC1=CC=CC=C1 C19575 [0,0,0,0,0,0|3,0,1]=4 4 B8R1.2 CCC1=CC=CC=C1 C07111 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.2 CNC1=CC=CC=C1 C02299 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.2 COC1=CC=CC=C1 C01403 [0,0,0,0,0,0|2,0,0]=2 7 B8R1.2 ClCC1=CC=CC=C1 C19167 [0,0,0,0,0,0|4,0,0]=4 8 B8R1.2 N#CC1=CC=CC=C1 C09814 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.2 N#CC1=CC=CC=N1 C02221 [0,0,0,0,0,0|3,0,0]=3 10 B8R1.2 N#CC1=CN=CC=N1 C02018 [0,0,0,0,0,0|2,0,0]=2 11 B8R1.2 N#[N+]C1=CC=CC=C1 C20284 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.2 NCC1=CC=CC=C1 C15562 [0,0,0,0,0,0|4,0,0]=4 13 B8R1.2 NCC1=CC=CC=N1 C17926 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.2 NNC1=CC=CC=C1 C02304 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.2 O=CC1=CC=CC=C1 C00193 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.2 O=CC1=CC=CC=C1 C00261 [0,0,0,0,0,0|4,0,0]=4 17 B8R1.2 O=CC1=CN=CC=C1 C07327 [0,0,0,0,0,0|3,0,0]=3 18 B8R1.2 O=NC1=CC=CC=C1 C06876 [0,0,0,0,0,0|4,0,0]=4 19 B8R1.2 OCC1=CC=CC=C1 C00556 [0,0,0,0,0,0|4,0,0]=4 20 B8R1.2 OCC1=CC=CC=C1 C03485 [0,0,0,0,0,0|4,0,0]=4 21 B8R1.2 ONC1=CC=CC=C1 C02720 [0,0,0,0,0,0|4,0,0]=4 22 B7R1.3 BrC1=CC=CC=C1 C11036 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.3 CC1=CC=CC=C1 C01455 [1,0,0,0,0,0|2,0,0]=3 24 B7R1.3 CC1=NC=CC=C1 C14447 [1,0,0,0,0,0|1,0,0]=2 25 B7R1.3 C[N+]1=CC=CC=C1 C02724 [1,0,0,0,0,0|3,0,0]=4 26 B7R1.3 ClC1=CC=CC=C1 C06990 [1,0,0,0,0,0|3,0,0]=4 27 B7R1.3 FC1=CC=CC=C1 C11272 [1,0,0,0,0,0|3,0,0]=4 28 B7R1.3 NC1=CC=CC=C1 C00292 [1,0,0,0,0,0|3,0,0]=4 29 B7R1.3 OC1=CC=CC=C1 C00146 [1,0,0,0,0,0|2,0,0]=3 30 B7R1.3 OC1=CC=CC=C1 C15584 [1,0,0,0,0,0|2,0,0]=3 31 B7R1.3 OC1=CC=CC=N1 C02502 [1,0,0,0,0,0|1,0,0]=2 32 B7R1.3 [*]C1=CC=CC=C1 C03122 [1,0,0,0,0,0|3,0,0]=4 33 B7R1.3 [Hg+]C1=CC=CC=C1 C01783 [1,0,0,0,0,0|3,0,0]=4 34 B9R1.1 CCC1=CC=C(O)C=C1 C13637 [0,1,0,0,0,0|3,0,0]=4 35 B9R1.1 CNC1=CC=C(O)C=C1 C11206 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.1 COC1=CC=C(N)C=C1 C19326 [0,1,0,0,0,0|2,0,0]=3 37 B9R1.2 CCC1=CC(O)=CC=C1 C14386 [0,1,0,0,0,0|3,0,0]=4 38 B9R1.2 CCC1=CC=CC(C)=C1 C14522 [0,1,0,0,0,0|3,0,0]=4 39 B9R1.6 C=C(C)C1=CC=CC=C1 C14395 [0,1,0,0,0,0|3,0,0]=4 40 B9R1.6 CC(=O)C1=CC=CC=C1 C07113 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.6 CC(C)C1=CC=CC=C1 C14396 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.6 CC(N)C1=CC=CC=C1 C02455 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.6 CC(O)C1=CC=CC=C1 C07112 [0,1,0,0,0,0|3,0,0]=4 44 B9R1.6 CN(C)C1=CC=CC=C1 C02846 [0,1,0,0,0,0|3,0,0]=4 45 B9R1.6 C[C@H](O)C1=CC=CC=C1 C11348 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.6 NC(=O)C1=CN=CC=C1 C00153 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.6 NC(=O)C1=CN=CC=N1 C01956 [0,1,0,0,0,0|2,0,0]=3 48 B9R1.6 NC(=O)C1=NC=CC=C1 C01950 [0,1,0,0,0,0|3,0,0]=4 49 B9R1.6 O=C(O)C1=CN=CC=C1 C00253 [0,1,0,0,0,0|3,0,0]=4 50 B9R1.6 O=C(O)C1=NC=CC=C1 C10164 [0,1,0,0,0,0|3,0,0]=4 51 B9R1.6 O=C(O)C1=NC=CN=C1 C19915 [0,1,0,0,0,0|2,0,0]=3 52 B9R1.8 CCNC1=CC=CC=C1 C14455 [0,1,0,0,0,0|3,0,0]=4 53 B9R1.8 NCCC1=CC=CC=C1 C05332 [0,1,0,0,0,0|3,0,0]=4 54 B9R1.8 OCCC1=CC=CC=C1 C05853 [0,1,0,0,0,0|3,0,0]=4 55 B9R1.15 CCC1=C(C)C=CC=C1 C14572 [0,1,0,0,0,0|3,0,0]=4 56 B9R1.15 CCC1=CC=CC=C1O C14385 [0,1,0,0,0,0|3,0,0]=4 57 B9R1.15 COC1=C(N)C=CC=C1 C19191 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.15 COC1=CC=CC=C1I C03575 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.15 COC1=CC=CC=C1O C01502 [0,1,0,0,0,0|2,0,0]=3 60 B9R1.15 COC1=CC=CC=C1O C15572 [0,1,0,0,0,0|2,0,0]=3 61 B7R1.1 Cl[Hg]C1=CC=CO1 C14282 [0,0,0,0,1,0|3,0,0]=4 62 B7R1.1 O=CC1=CC=CO1 C14279 [0,0,0,0,1,0|3,0,0]=4 63 B7R1.1 OCC1=CC=CO1 C20441 [0,0,0,0,1,0|3,0,0]=4 64 B7R1.1 OCC1=CN=CN1 C05562 [0,0,0,0,1,0|2,0,1]=4 65 B6R0.6 C\C=C\C=C\C=O C19249 [1,0,1,0,0,0|2,0,0]=4 66 B6R1.1 C1=CC=CC=C1 C01407 [2,0,0,0,0,0|2,0,0]=4 67 B6R1.1 C1=CC=NC=C1 C00747 [2,0,0,0,0,0|1,0,0]=3 68 B6R1.1 C1=CN=CN=C1 C00396 [2,0,0,0,0,0|2,0,0]=4 69 B8R1.3 CC1=CC=C(C)C=C1 C06756 [1,1,0,0,0,0|2,0,0]=4 70 B8R1.3 CC1=CC=C(Cl)C=C1 C14451 [1,1,0,0,0,0|2,0,0]=4 71 B8R1.3 CC1=CC=C(O)C=C1 C01468 [1,1,0,0,0,0|2,0,0]=4 72 B8R1.3 NC1=CC=C(O)C=C1 C02372 [1,1,0,0,0,0|2,0,0]=4 73 B8R1.3 OC1=CC=C(Br)C=C1 C14453 [1,1,0,0,0,0|2,0,0]=4 74 B8R1.3 OC1=CC=C(Cl)C=C1 C02124 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.3 OC1=CC=C(F)C=C1 C16485 [1,1,0,0,0,0|2,0,0]=4 76 B8R1.3 OC1=CC=C(O)C=C1 C00530 [1,1,0,0,0,0|2,0,0]=4 77 B8R1.3 OC1=CC=C(O)N=C1 C01059 [1,1,0,0,0,0|1,0,0]=3 78 B8R1.3 [O]C1=CC=C(O)C=C1 C02389 [1,1,0,0,0,0|2,0,0]=4 79 B8R1.4 CC1=CC(O)=CC=C1 C01467 [1,1,0,0,0,0|2,0,0]=4 80 B8R1.4 CC1=CC=CC(C)=C1 C07208 [1,1,0,0,0,0|2,0,0]=4 81 B8R1.4 NC1=CC(O)=CC=C1 C05058 [1,1,0,0,0,0|2,0,0]=4 82 B8R1.4 OC1=CC=CC(Cl)=C1 C14270 [1,1,0,0,0,0|2,0,0]=4 83 B8R1.4 OC1=CC=CC(O)=C1 C01751 [1,1,0,0,0,0|2,0,0]=4 84 B8R1.4 OC1=CC=CC(O)=N1 C03056 [1,1,0,0,0,0|1,0,0]=3 85 B8R1.5 CC1=C(C)C=CC=C1 C07212 [1,1,0,0,0,0|2,0,0]=4 86 B8R1.5 CC1=C(N)C=CC=C1 C14403 [1,1,0,0,0,0|2,0,0]=4 87 B8R1.5 CC1=CC=CC=C1O C01542 [1,1,0,0,0,0|2,0,0]=4 88 B8R1.5 NC1=CC=CC=C1O C01987 [1,1,0,0,0,0|2,0,0]=4 89 B8R1.5 O=C1C=CNC=C1O C03927 [1,1,0,0,0,0|1,0,1]=4 90 B8R1.5 OC1=C(Br)C=CC=C1 C14841 [1,1,0,0,0,0|2,0,0]=4 91 B8R1.5 OC1=C(O)C=CC=C1 C01785 [1,1,0,0,0,0|2,0,0]=4 92 B8R1.5 OC1=CC=CC=C1Cl C14219 [1,1,0,0,0,0|2,0,0]=4 93 B8R1.5 OC1=CC=CC=C1I C01874 [1,1,0,0,0,0|2,0,0]=4 94 B8R1.5 OC1=CC=CC=C1O C00090 [1,1,0,0,0,0|2,0,0]=4 95 B8R1.5 OC1=CC=CC=C1O C15571 [1,1,0,0,0,0|2,0,0]=4 96 B8R1.5 OC1=CC=NC=C1O C02932 [1,1,0,0,0,0|1,0,0]=3 97 B8R1.5 [O]C1=C(O)C=CC=C1 C05060 [1,1,0,0,0,0|2,0,0]=4 98 B8R1.7 CC(=O)N1C=CN=C1 C02560 [0,1,0,0,1,0|2,0,0]=4 99 B8R1.8 NCCC1=CNC=N1 C00388 [0,1,0,0,1,0|1,0,1]=4 100 B8R1.8 NCCC1=NC=CS1 C17927 [0,1,0,0,1,0|2,0,0]=4 101 B10R1.3 COC1=CC=C(C=O)C=C1 C10761 [0,2,0,0,0,0|2,0,0]=4 102 B10R1.25 COC1=C(N)C=C(C)C=C1 C19216 [0,2,0,0,0,0|2,0,0]=4 103 B10R1.25 COC1=C(N)C=C(N)C=C1 C19218 [0,2,0,0,0,0|2,0,0]=4 104 B10R1.176 COC1=CC(C)=C(N)C=C1 C19376 [0,2,0,0,0,0|2,0,0]=4 105 B10R1.2 COC1=CC=CC(I)=C1O C12251 [0,2,0,0,0,0|2,0,0]=4 106 B10R1.172 COC1=CC(CO)=CC=C1 C03352 [0,2,0,0,0,0|2,0,0]=4 107 B10R1.15 COC(=O)C1=CC=CC=C1 C20645 [0,2,0,0,0,0|2,0,0]=4 108 B10R1.17 COCCC1=NC=CC=C1 C18396 [0,2,0,0,0,0|1,0,0]=3 109 B10R1.18 CC(=O)OC1=CC=CC=C1 C00548 [0,2,0,0,0,0|2,0,0]=4 110 B10R1.18 CC(=O)OC1=CC=CC=C1 C15583 [0,2,0,0,0,0|2,0,0]=4 111 B10R2.6 C1=CC=C(C2CO2)C=C1 C02083 [0,1,0,1,0,0|2,0,0]=4 112 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 C20782 [0,1,0,1,0,0|2,0,0]=4 113 B6R1.2 CC1=CN=CN1 C19262 [1,0,0,0,1,0|0,0,1]=3 114 B6R1.2 CC1=CNN=C1 C07837 [1,0,0,0,1,0|1,0,0]=3 115 B6R1.2 CC1=NC=CN1 C19261 [1,0,0,0,1,0|0,0,1]=3 116 B6R1.2 NC1=CN=CN1 C05239 [1,0,0,0,1,0|1,0,1]=4 117 B6R1.2 NC1=NNC=N1 C11261 [1,0,0,0,1,0|2,0,0]=4