0 B6R1.1 C1=CC=CC=C1 C01407 [0,0,0,0,0,0|1,0,0]=1 1 B6R1.1 C1=CC=NC=C1 C00747 [0,0,0,0,0,0|0,0,0]=0 2 B6R1.1 C1=CCN=CC1 C16933 [0,0,0,0,0,0|0,0,2]=2 3 B6R1.1 C1=CN=CN=C1 C00396 [0,0,0,0,0,0|1,0,0]=1 4 B6R1.1 C1=NCCCC1 C06181 [0,0,0,0,0,0|0,0,4]=4 5 B7R1.3 BrC1=CC=CC=C1 C11036 [0,1,0,0,0,0|1,0,0]=2 6 B7R1.3 CC1=CC=CC=C1 C01455 [0,1,0,0,0,0|1,0,0]=2 7 B7R1.3 CC1=NC=CC=C1 C14447 [0,1,0,0,0,0|0,0,0]=1 8 B7R1.3 C[N+]1=CC=CC=C1 C02724 [0,1,0,0,0,0|0,0,1]=2 9 B7R1.3 ClC1=CC=CC=C1 C06990 [0,1,0,0,0,0|1,0,0]=2 10 B7R1.3 FC1=CC=CC=C1 C11272 [0,1,0,0,0,0|1,0,0]=2 11 B7R1.3 NC1=CC=CC=C1 C00292 [0,1,0,0,0,0|1,0,0]=2 12 B7R1.3 NC1=CC=NC=C1 C13728 [0,1,0,0,0,0|0,0,0]=1 13 B7R1.3 NC1=NCNC=C1 C02026 [0,1,0,0,0,0|1,0,1]=3 14 B7R1.3 O=C1C=CCCC1 C02395 [0,1,0,0,0,0|1,0,2]=4 15 B7R1.3 OC1=CC=CC=C1 C00146 [0,1,0,0,0,0|1,0,0]=2 16 B7R1.3 OC1=CC=CC=C1 C15584 [0,1,0,0,0,0|1,0,0]=2 17 B7R1.3 OC1=CC=CC=N1 C02502 [0,1,0,0,0,0|0,0,0]=1 18 B7R1.3 [*]C1=CC=CC=C1 C03122 [0,1,0,0,0,0|1,0,0]=2 19 B7R1.3 [Hg+]C1=CC=CC=C1 C01783 [0,1,0,0,0,0|1,0,0]=2 20 B5R0.2 C=CCN=C=S C19317 [0,0,1,0,0,0|1,0,2]=4 21 B5R1.1 C1=CNC=C1 C19907 [0,0,0,0,1,0|0,0,1]=2 22 B5R1.1 C1=CNC=N1 C01589 [0,0,0,0,1,0|1,0,0]=2 23 B5R1.1 C1=CNN=C1 C00481 [0,0,0,0,1,0|1,0,0]=2 24 B5R1.1 C1=COC=C1 C14275 [0,0,0,0,1,0|1,0,0]=2 25 B5R1.1 C1=NCCC1 C15668 [0,0,0,0,1,0|0,0,3]=4 26 B4R0.2 C=COC=C C17721 [1,0,1,0,0,0|1,0,0]=3 27 B4R0.2 C\C=C\C=O C19377 [1,0,1,0,0,0|1,0,1]=4 28 B4R0.2 O=C\C=C/Cl C16348 [1,0,1,0,0,0|2,0,0]=4 29 B4R0.2 O=C\C=C\Cl C06613 [1,0,1,0,0,0|2,0,0]=4 30 B6R0.6 C=CCSCC=C C08370 [0,1,1,0,0,0|1,0,1]=4 31 B6R0.6 C\C=C\C=C\C=O C19249 [0,1,1,0,0,0|1,0,0]=3 32 B6R1.2 CC1=CN=CN1 C19262 [0,1,0,0,1,0|1,0,0]=3 33 B6R1.2 CC1=CNN=C1 C07837 [0,1,0,0,1,0|1,0,0]=3 34 B6R1.2 CC1=NC=CN1 C19261 [0,1,0,0,1,0|1,0,0]=3 35 B6R1.2 NC1=CN=CN1 C05239 [0,1,0,0,1,0|1,0,0]=3 36 B6R1.2 NC1=NNC=N1 C11261 [0,1,0,0,1,0|2,0,0]=4 37 B6R1.2 O=C1C=CCO1 C17601 [0,1,0,0,1,0|1,0,1]=4 38 B6R1.2 O=C1C=CNO1 C20891 [0,1,0,0,1,0|1,0,1]=4 39 B6R1.2 O=C1CC=CO1 C17602 [0,1,0,0,1,0|1,0,1]=4 40 B6R1.2 O=C1CNC=N1 C06195 [0,1,0,0,1,0|1,0,1]=4 41 B6R1.2 O=C1NC=CN1 C20382 [0,1,0,0,1,0|1,0,1]=4 42 B8R1.2 C=CC1=CC=CC=C1 C07083 [0,2,0,0,0,0|1,0,0]=3 43 B8R1.2 C=CC1=CC=CC=C1 C19506 [0,2,0,0,0,0|1,0,0]=3 44 B8R1.2 C=CC1=CC=CC=C1 C19573 [0,2,0,0,0,0|1,0,0]=3 45 B8R1.2 C=CC1=CC=CC=C1 C19575 [0,2,0,0,0,0|1,0,0]=3 46 B8R1.2 CCC1=CC=CC=C1 C07111 [0,2,0,0,0,0|1,0,0]=3 47 B8R1.2 CNC1=CC=CC=C1 C02299 [0,2,0,0,0,0|1,0,0]=3 48 B8R1.2 COC1=CC=CC=C1 C01403 [0,2,0,0,0,0|1,0,0]=3 49 B8R1.2 ClCC1=CC=CC=C1 C19167 [0,2,0,0,0,0|1,0,0]=3 50 B8R1.2 N#CC1=CC=CC=C1 C09814 [0,2,0,0,0,0|1,0,0]=3 51 B8R1.2 N#CC1=CC=CC=N1 C02221 [0,2,0,0,0,0|0,0,0]=2 52 B8R1.2 N#CC1=CC=NC=C1 C02234 [0,2,0,0,0,0|0,0,0]=2 53 B8R1.2 N#CC1=CN=CC=N1 C02018 [0,2,0,0,0,0|1,0,0]=3 54 B8R1.2 N#[N+]C1=CC=CC=C1 C20284 [0,2,0,0,0,0|1,0,0]=3 55 B8R1.2 NCC1=CC=CC=C1 C15562 [0,2,0,0,0,0|1,0,0]=3 56 B8R1.2 NCC1=CC=CC=N1 C17926 [0,2,0,0,0,0|0,0,0]=2 57 B8R1.2 NNC1=CC=CC=C1 C02304 [0,2,0,0,0,0|1,0,0]=3 58 B8R1.2 O=CC1=CC=CC=C1 C00193 [0,2,0,0,0,0|1,0,0]=3 59 B8R1.2 O=CC1=CC=CC=C1 C00261 [0,2,0,0,0,0|1,0,0]=3 60 B8R1.2 O=CC1=CN=CC=C1 C07327 [0,2,0,0,0,0|0,0,0]=2 61 B8R1.2 O=NC1=CC=CC=C1 C06876 [0,2,0,0,0,0|1,0,0]=3 62 B8R1.2 O=[C]C1=CC=NC=C1 C21754 [0,2,0,0,0,0|0,0,0]=2 63 B8R1.2 OCC1=CC=CC=C1 C00556 [0,2,0,0,0,0|1,0,0]=3 64 B8R1.2 OCC1=CC=CC=C1 C03485 [0,2,0,0,0,0|1,0,0]=3 65 B8R1.2 ONC1=CC=CC=C1 C02720 [0,2,0,0,0,0|1,0,0]=3 66 B8R1.3 CC1=CC=C(C)C=C1 C06756 [0,2,0,0,0,0|1,0,0]=3 67 B8R1.3 CC1=CC=C(Cl)C=C1 C14451 [0,2,0,0,0,0|1,0,0]=3 68 B8R1.3 CC1=CC=C(O)C=C1 C01468 [0,2,0,0,0,0|1,0,0]=3 69 B8R1.3 ClC1=CC=C(Cl)C=C1 C07092 [0,2,0,0,0,0|1,0,0]=3 70 B8R1.3 NC1=CC=C(Cl)C=C1 C14450 [0,2,0,0,0,0|1,0,0]=3 71 B8R1.3 NC1=CC=C(F)C=C1 C11014 [0,2,0,0,0,0|1,0,0]=3 72 B8R1.3 NC1=CC=C(N)C=C1 C19499 [0,2,0,0,0,0|1,0,0]=3 73 B8R1.3 NC1=CC=C(O)C=C1 C02372 [0,2,0,0,0,0|1,0,0]=3 74 B8R1.3 O=C1C=CC(=O)C=C1 C00472 [0,2,0,0,0,0|1,0,0]=3 75 B8R1.3 O=C1C=CC(=O)NN1 C18474 [0,2,0,0,0,0|1,0,1]=4 76 B8R1.3 OC1=CC=C(Br)C=C1 C14453 [0,2,0,0,0,0|1,0,0]=3 77 B8R1.3 OC1=CC=C(Cl)C=C1 C02124 [0,2,0,0,0,0|1,0,0]=3 78 B8R1.3 OC1=CC=C(F)C=C1 C16485 [0,2,0,0,0,0|1,0,0]=3 79 B8R1.3 OC1=CC=C(O)C=C1 C00530 [0,2,0,0,0,0|1,0,0]=3 80 B8R1.3 OC1=CC=C(O)N=C1 C01059 [0,2,0,0,0,0|0,0,0]=2 81 B8R1.3 [*]C1=CC=C(N)C=C1 C03084 [0,2,0,0,0,0|1,0,0]=3 82 B8R1.3 [O]C1=CC=C(O)C=C1 C02389 [0,2,0,0,0,0|1,0,0]=3 83 B8R1.4 CC1=CC(O)=CC=C1 C01467 [0,2,0,0,0,0|1,0,0]=3 84 B8R1.4 CC1=CC=CC(C)=C1 C07208 [0,2,0,0,0,0|1,0,0]=3 85 B8R1.4 ClC1=CC=CC(Cl)=C1 C19397 [0,2,0,0,0,0|1,0,0]=3 86 B8R1.4 NC1=CC(F)=CC=C1 C11013 [0,2,0,0,0,0|1,0,0]=3 87 B8R1.4 NC1=CC(O)=CC=C1 C05058 [0,2,0,0,0,0|1,0,0]=3 88 B8R1.4 NC1=CC=CC(N)=C1 C02454 [0,2,0,0,0,0|1,0,0]=3 89 B8R1.4 NC1=NC(=O)NC=C1 C00380 [0,2,0,0,0,0|1,0,0]=3 90 B8R1.4 O=C1C=CNC(=O)N1 C00106 [0,2,0,0,0,0|1,0,1]=4 91 B8R1.4 O=C1C=CNC(=S)N1 C19304 [0,2,0,0,0,0|1,0,1]=4 92 B8R1.4 OC1=CC=CC(Cl)=C1 C14270 [0,2,0,0,0,0|1,0,0]=3 93 B8R1.4 OC1=CC=CC(O)=C1 C01751 [0,2,0,0,0,0|1,0,0]=3 94 B8R1.4 OC1=CC=CC(O)=N1 C03056 [0,2,0,0,0,0|0,0,0]=2 95 B8R1.5 CC1=C(C)C=CC=C1 C07212 [0,2,0,0,0,0|1,0,0]=3 96 B8R1.5 CC1=C(N)C=CC=C1 C14403 [0,2,0,0,0,0|1,0,0]=3 97 B8R1.5 CC1=CC=CC=C1O C01542 [0,2,0,0,0,0|1,0,0]=3 98 B8R1.5 ClC1=C(Cl)C=CC=C1 C14328 [0,2,0,0,0,0|1,0,0]=3 99 B8R1.5 ClC1C=CC=CC1Cl C11352 [0,2,0,0,0,0|1,0,1]=4 100 B8R1.5 N=C1C=CC=CC1=O C17500 [0,2,0,0,0,0|1,0,0]=3 101 B8R1.5 NC1=C(F)C=CC=C1 C11010 [0,2,0,0,0,0|1,0,0]=3 102 B8R1.5 NC1=C(N)C=CC=C1 C14402 [0,2,0,0,0,0|1,0,0]=3 103 B8R1.5 NC1=CC=CC=C1O C01987 [0,2,0,0,0,0|1,0,0]=3 104 B8R1.5 O=C1C=CC=CC1=O C02351 [0,2,0,0,0,0|1,0,0]=3 105 B8R1.5 O=C1C=CNC=C1O C03927 [0,2,0,0,0,0|0,0,1]=3 106 B8R1.5 OC1=C(Br)C=CC=C1 C14841 [0,2,0,0,0,0|1,0,0]=3 107 B8R1.5 OC1=C(O)C=CC=C1 C01785 [0,2,0,0,0,0|1,0,0]=3 108 B8R1.5 OC1=CC=CC=C1Cl C14219 [0,2,0,0,0,0|1,0,0]=3 109 B8R1.5 OC1=CC=CC=C1I C01874 [0,2,0,0,0,0|1,0,0]=3 110 B8R1.5 OC1=CC=CC=C1O C00090 [0,2,0,0,0,0|1,0,0]=3 111 B8R1.5 OC1=CC=CC=C1O C15571 [0,2,0,0,0,0|1,0,0]=3 112 B8R1.5 OC1=CC=NC=C1O C02932 [0,2,0,0,0,0|0,0,0]=2 113 B8R1.5 O[C@@H]1C=CC=C[C@H]1O C04221 [0,2,0,0,0,0|1,0,1]=4 114 B8R1.5 O[C@H]1C=CC=C[C@H]1O C04091 [0,2,0,0,0,0|1,0,1]=4 115 B8R1.5 [O-]N1C=CC=CC1=S C13427 [0,2,0,0,0,0|0,0,1]=3 116 B8R1.5 [O]C1=C(O)C=CC=C1 C05060 [0,2,0,0,0,0|1,0,0]=3 117 B8R2.25 C1=CC2OC2C=C1 C01782 [0,0,0,1,0,1|1,0,1]=4