0 B9R1.6 C=C(C)C1=CC=CC=C1 C14395 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(=O)C1=CC=CC=C1 C07113 [0,0,0,0,0,0|1,0,0]=1 2 B9R1.6 CC(C)C1=CC=CC=C1 C14396 [0,0,0,0,0,0|2,0,1]=3 3 B9R1.6 CC(N)C1=CC=CC=C1 C02455 [0,0,0,0,0,0|2,0,1]=3 4 B9R1.6 CC(O)C1=CC=CC=C1 C07112 [0,0,0,0,0,0|1,0,1]=2 5 B9R1.6 CN(C)C1=CC=CC=C1 C02846 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.6 C[C@H](O)C1=CC=CC=C1 C11348 [0,0,0,0,0,0|1,0,1]=2 7 B9R1.6 ClC(Cl)C1=CC=CC=C1 C19165 [0,0,0,0,0,0|2,0,1]=3 8 B9R1.6 N=C(N)C1=CC=CC=C1 C01784 [0,0,0,0,0,0|2,0,0]=2 9 B9R1.6 NC(=O)C1=CC=CC=C1 C09815 [0,0,0,0,0,0|1,0,0]=1 10 B9R1.6 NC(=O)C1=CC=NC=C1 C02421 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.6 NC(=O)C1=CN=CC=C1 C00153 [0,0,0,0,0,0|2,0,0]=2 12 B9R1.6 NC(=O)C1=CN=CC=N1 C01956 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.6 NC(=O)C1=NC=CC=C1 C01950 [0,0,0,0,0,0|2,0,0]=2 14 B9R1.6 NC(=S)C1=CC=CC=C1 C16281 [0,0,0,0,0,0|1,1,0]=2 15 B9R1.6 O=C(Cl)C1=CC=CC=C1 C19168 [0,0,0,0,0,0|1,0,0]=1 16 B9R1.6 O=C(O)C1=CC=CC=C1 C00180 [0,0,0,0,0,0|0,0,0]=0 17 B9R1.6 O=C(O)C1=CC=CC=C1 C00539 [0,0,0,0,0,0|0,0,0]=0 18 B9R1.6 O=C(O)C1=CC=NC=C1 C07446 [0,0,0,0,0,0|1,0,0]=1 19 B9R1.6 O=C(O)C1=CCCCC1 C12101 [0,0,0,0,0,0|0,0,4]=4 20 B9R1.6 O=C(O)C1=CCCNC1 C10149 [0,0,0,0,0,0|1,0,3]=4 21 B9R1.6 O=C(O)C1=CCNCC1 C13694 [0,0,0,0,0,0|1,0,3]=4 22 B9R1.6 O=C(O)C1=CN=CC=C1 C00253 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.6 O=C(O)C1=NC=CC=C1 C10164 [0,0,0,0,0,0|1,0,0]=1 24 B9R1.6 O=C(O)C1=NC=CN=C1 C19915 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.6 O=C(O)C1C=CCN=C1 C16671 [0,0,0,0,0,0|1,0,2]=3 26 B9R1.6 O=C(O)[C@@H]1CC=CCN1 C08268 [0,0,0,0,0,0|1,0,3]=4 27 B9R1.6 O=[N+]([O-])C1=CC=CC=C1 C06813 [0,0,0,0,0,0|1,0,1]=2 28 B9R1.6 OB(O)C1=CC=CC=C1 C16200 [0,0,0,0,0,0|1,0,1]=2 29 B9R1.6 [*]N([*])C1=CC=CC=C1 C02401 [0,0,0,0,0,0|3,0,0]=3 30 B8R1.2 C=CC1=CC=CC=C1 C07083 [1,0,0,0,0,0|1,0,0]=2 31 B8R1.2 C=CC1=CC=CC=C1 C19506 [1,0,0,0,0,0|1,0,0]=2 32 B8R1.2 C=CC1=CC=CC=C1 C19573 [1,0,0,0,0,0|1,0,0]=2 33 B8R1.2 C=CC1=CC=CC=C1 C19575 [1,0,0,0,0,0|1,0,0]=2 34 B8R1.2 CCC1=CC=CC=C1 C07111 [1,0,0,0,0,0|1,0,1]=3 35 B8R1.2 CNC1=CC=CC=C1 C02299 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.2 COC1=CC=CC=C1 C01403 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.2 ClCC1=CC=CC=C1 C19167 [1,0,0,0,0,0|1,0,1]=3 38 B8R1.2 N#CC1=CC=CC=C1 C09814 [1,0,0,0,0,0|1,0,1]=3 39 B8R1.2 N#CC1=CC=CC=N1 C02221 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.2 N#CC1=CC=NC=C1 C02234 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.2 N#[N+]C1=CC=CC=C1 C20284 [1,0,0,0,0,0|2,0,0]=3 42 B8R1.2 NCC1=CC=CC=C1 C15562 [1,0,0,0,0,0|1,0,1]=3 43 B8R1.2 NCC1=CC=CC=N1 C17926 [1,0,0,0,0,0|2,0,1]=4 44 B8R1.2 NNC1=CC=CC=C1 C02304 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.2 O=CC1=CC=CC=C1 C00193 [1,0,0,0,0,0|0,0,0]=1 46 B8R1.2 O=CC1=CC=CC=C1 C00261 [1,0,0,0,0,0|0,0,0]=1 47 B8R1.2 O=CC1=CN=CC=C1 C07327 [1,0,0,0,0,0|1,0,0]=2 48 B8R1.2 O=NC1=CC=CC=C1 C06876 [1,0,0,0,0,0|1,0,0]=2 49 B8R1.2 O=[C]C1=CC=NC=C1 C21754 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.2 OCC1=CC=CC=C1 C00556 [1,0,0,0,0,0|0,0,1]=2 51 B8R1.2 OCC1=CC=CC=C1 C03485 [1,0,0,0,0,0|0,0,1]=2 52 B8R1.2 ONC1=CC=CC=C1 C02720 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C06647 [0,1,0,0,0,0|1,0,0]=2 54 B10R1.13 CC(=O)C1=CC=C(O)C=C1 C10700 [0,1,0,0,0,0|1,0,0]=2 55 B10R1.13 CC(N)C1=CC=C(O)C=C1 C03473 [0,1,0,0,0,0|2,0,1]=4 56 B10R1.13 CC(O)C1=CC=C(O)C=C1 C13638 [0,1,0,0,0,0|1,0,1]=3 57 B10R1.13 CC1=CC=C(C(=O)O)C=C1 C01454 [0,1,0,0,0,0|0,0,0]=1 58 B10R1.13 CC1=CC=C(C(C)C)C=C1 C06575 [0,1,0,0,0,0|2,0,1]=4 59 B10R1.13 CC1=CC=C([N+](=O)[O-])C=C1 C14394 [0,1,0,0,0,0|1,0,1]=3 60 B10R1.13 CN(C)C1=CC=C(N)C=C1 C04203 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.13 N=C(N)C1=CC=C(N)C=C1 C11628 [0,1,0,0,0,0|2,0,0]=3 62 B10R1.13 NC1=CC=C(C(=O)O)C=C1 C00568 [0,1,0,0,0,0|0,0,0]=1 63 B10R1.13 NC1=CC=C([N+](=O)[O-])C=C1 C02126 [0,1,0,0,0,0|1,0,1]=3 64 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 C02370 [0,1,0,0,0,0|0,0,0]=1 65 B10R1.13 O=C(O)C1=CC=C(F)C=C1 C02371 [0,1,0,0,0,0|0,0,0]=1 66 B10R1.13 O=C(O)C1=CC=C(O)C=C1 C00156 [0,1,0,0,0,0|0,0,0]=1 67 B10R1.13 O=C(O)C1=CN=C(O)C=C1 C01020 [0,1,0,0,0,0|1,0,0]=2 68 B10R1.13 O=C1CCC(C(=O)O)=CN1 C04226 [0,1,0,0,0,0|1,0,2]=4 69 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 C14456 [0,1,0,0,0,0|1,0,1]=3 70 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 C00870 [0,1,0,0,0,0|1,0,1]=3 71 B10R1.15 C=C(C=O)C1=CC=CC=C1 C16592 [0,1,0,0,0,0|1,0,0]=2 72 B10R1.15 CCC(C)C1=CC=CC=C1 C14142 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.15 COC(=O)C1=CC=CC=C1 C20645 [0,1,0,0,0,0|0,0,0]=1 74 B10R1.15 N#CC(=O)C1=CC=CC=C1 C21329 [0,1,0,0,0,0|1,0,0]=2 75 B10R1.15 N#C[C@@H](O)C1=CC=CC=C1 C02615 [0,1,0,0,0,0|1,0,1]=3 76 B10R1.15 N#C[C@H](O)C1=CC=CC=C1 C00561 [0,1,0,0,0,0|1,0,1]=3 77 B10R1.15 NC(=S=O)C1=CC=CC=C1 C16283 [0,1,0,0,0,0|1,0,0]=2 78 B10R1.15 NCC(O)C1=CC=CC=C1 C02735 [0,1,0,0,0,0|1,0,1]=3 79 B10R1.15 NNC(=O)C1=CC=NC=C1 C07054 [0,1,0,0,0,0|2,0,0]=3 80 B10R1.15 O=C(CO)C1=CC=CC=C1 C07189 [0,1,0,0,0,0|0,0,0]=1 81 B10R1.28 C[N+](C)([O-])C1=CC=CC=C1 C01183 [0,1,0,0,0,0|2,0,1]=4 82 B10R1.28 ClC(Cl)(Cl)C1=CC=CC=C1 C19166 [0,1,0,0,0,0|2,0,1]=4 83 B10R1.61 CC1=C(C(=O)O)C=CC=C1 C07215 [0,1,0,0,0,0|0,0,0]=1 84 B10R1.61 CC1=C([N+](=O)[O-])C=CC=C1 C19597 [0,1,0,0,0,0|1,0,1]=3 85 B10R1.61 NC1=CC=CC=C1C(=O)O C00108 [0,1,0,0,0,0|0,0,0]=1 86 B10R1.61 O=C(O)C1=CC=CC=C1Cl C02357 [0,1,0,0,0,0|0,0,0]=1 87 B10R1.61 O=C(O)C1=CC=CC=C1F C02359 [0,1,0,0,0,0|0,0,0]=1 88 B10R1.61 O=C(O)C1=CC=CC=C1O C00805 [0,1,0,0,0,0|0,0,0]=1 89 B10R1.61 O=C(O)C1=NC=CC=C1O C18620 [0,1,0,0,0,0|1,0,0]=2 90 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 C07587 [0,1,0,0,0,0|0,0,1]=2 91 B10R1.61 O=C([O-])C1=C(S)C=CC=C1 C08171 [0,1,0,0,0,0|0,0,1]=2 92 B10R1.61 O=[N+]([O-])C1=C(Cl)C=CC=C1 C14407 [0,1,0,0,0,0|1,0,1]=3 93 B10R1.61 O=[N+]([O-])C1=CC=CC=C1O C01988 [0,1,0,0,0,0|1,0,1]=3 94 B10R1.113 CC1=CC([N+](=O)[O-])=CC=C1 C19486 [0,1,0,0,0,0|1,0,1]=3 95 B10R1.113 CC1=CC=CC(C(=O)O)=C1 C07211 [0,1,0,0,0,0|0,0,0]=1 96 B10R1.113 C[N+]1=CC=CC(C(=O)[O-])=C1 C01004 [0,1,0,0,0,0|1,0,1]=3 97 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 C02918 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.113 NC(=O)C1=CC(Cl)=CC=C1 C11731 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.113 NC1C=CC=C(C(=O)O)C1 C12110 [0,1,0,0,0,0|0,0,2]=3 100 B10R1.113 O=C(O)C1=CC(O)=CC=C1 C00587 [0,1,0,0,0,0|0,0,0]=1 101 B10R1.113 O=C(O)C1=CC=CC(F)=C1 C02364 [0,1,0,0,0,0|0,0,0]=1 102 B10R1.113 O=[N+]([O-])C1=CC=CC(Cl)=C1 C19364 [0,1,0,0,0,0|1,0,1]=3 103 B10R1.113 O=[N+]([O-])C1=CC=CC(O)=C1 C14418 [0,1,0,0,0,0|1,0,1]=3 104 B8R0.8 C\C=C/C=C(/O)C(=O)O C11354 [0,0,1,0,0,0|1,0,1]=3 105 B8R0.8 C\C=C/C=C(\O)C(=O)O C20240 [0,0,1,0,0,0|1,0,1]=3 106 B8R0.8 C\C=C\CC(=O)C(=O)O C06761 [0,0,1,0,0,0|1,0,2]=4 107 B10R2.6 C1=CC=C(C2CO2)C=C1 C02083 [0,0,0,1,0,0|1,0,1]=3 108 B10R2.6 C1=CC=C([C@H]2CO2)C=C1 C20782 [0,0,0,1,0,0|1,0,1]=3 109 B8R1.7 CC(=O)N1C=CN=C1 C02560 [0,0,0,0,1,0|3,0,0]=4 110 B8R1.7 N=C(N)C1=CNC=C1 C10133 [0,0,0,0,1,0|3,0,0]=4 111 B8R1.7 O=C(O)C1=CC=CN1 C05942 [0,0,0,0,1,0|1,0,0]=2 112 B8R1.7 O=C(O)C1=CC=CO1 C01546 [0,0,0,0,1,0|1,0,0]=2 113 B8R1.7 O=[N+]([O-])C1=CC=CO1 C14414 [0,0,0,0,1,0|2,0,1]=4 114 B10R1.18 CC(=O)CC1=CC=CC=C1 C15512 [0,0,0,0,0,1|1,0,0]=2 115 B10R1.18 CC(=O)NC1=CC=CC=C1 C07565 [0,0,0,0,0,1|1,0,0]=2 116 B10R1.18 CC(=O)OC1=CC=CC=C1 C00548 [0,0,0,0,0,1|1,0,0]=2 117 B10R1.18 CC(=O)OC1=CC=CC=C1 C15583 [0,0,0,0,0,1|1,0,0]=2 118 B10R1.18 CC(N)CC1=CC=CC=C1 C07514 [0,0,0,0,0,1|2,0,1]=4 119 B10R1.18 C[C@H](N)CC1=CC=CC=C1 C07884 [0,0,0,0,0,1|2,0,1]=4 120 B10R1.18 NC(=O)CC1=CC=CC=C1 C02505 [0,0,0,0,0,1|1,0,0]=2 121 B10R1.18 NC(=S)CC1=CC=CC=N1 C15663 [0,0,0,0,0,1|2,1,0]=4 122 B10R1.18 O=C(O)CC1=CC=CC=C1 C07086 [0,0,0,0,0,1|0,0,0]=1 123 B10R1.18 [*]C(=O)NC1=CC=CC=C1 C00484 [0,0,0,0,0,1|1,0,0]=2 124 B10R1.18 [*]C(=O)NC1=CC=CC=C1 C01402 [0,0,0,0,0,1|1,0,0]=2 125 B7R0.5 C=C\C=C(\O)C(=O)O C00596 [1,0,1,0,0,0|1,0,0]=3 126 B7R1.3 BrC1=CC=CC=C1 C11036 [2,0,0,0,0,0|1,0,0]=3 127 B7R1.3 CC1=CC=CC=C1 C01455 [2,0,0,0,0,0|0,0,1]=3 128 B7R1.3 CC1=NC=CC=C1 C14447 [2,0,0,0,0,0|1,0,1]=4 129 B7R1.3 C[N+]1=CC=CC=C1 C02724 [2,0,0,0,0,0|1,0,1]=4 130 B7R1.3 ClC1=CC=CC=C1 C06990 [2,0,0,0,0,0|1,0,0]=3 131 B7R1.3 FC1=CC=CC=C1 C11272 [2,0,0,0,0,0|1,0,0]=3 132 B7R1.3 NC1=CC=CC=C1 C00292 [2,0,0,0,0,0|1,0,0]=3 133 B7R1.3 NC1=CC=NC=C1 C13728 [2,0,0,0,0,0|2,0,0]=4 134 B7R1.3 OC1=CC=CC=C1 C00146 [2,0,0,0,0,0|0,0,0]=2 135 B7R1.3 OC1=CC=CC=C1 C15584 [2,0,0,0,0,0|0,0,0]=2 136 B7R1.3 OC1=CC=CC=N1 C02502 [2,0,0,0,0,0|1,0,0]=3 137 B7R1.3 [*]C1=CC=CC=C1 C03122 [2,0,0,0,0,0|1,0,0]=3 138 B7R1.3 [Hg+]C1=CC=CC=C1 C01783 [2,0,0,0,0,0|1,0,0]=3 139 B9R0.1 CC(=O)\C=C\C=C(/C)C=O C11480 [0,1,1,0,0,0|2,0,0]=4 140 B9R0.47 N\C(=C\C=C/C=O)C(=O)O C03824 [0,1,1,0,0,0|1,0,0]=3 141 B9R0.47 O=C\C=C/C=C(/O)C(=O)O C00682 [0,1,1,0,0,0|1,0,0]=3 142 B9R0.48 O=CNC(=O)\C=C/C(=O)O C18232 [0,1,1,0,0,0|2,0,0]=4 143 B9R0.48 O=C\C=C(O)/C=C\C(=O)O C06603 [0,1,1,0,0,0|1,0,0]=3 144 B9R0.55 O=C(O)\C=C/C=C/C(=O)O C03647 [0,1,1,0,0,0|1,0,0]=3 145 B9R0.55 O=C(O)\C=C/C=C\C(=O)O C02480 [0,1,1,0,0,0|1,0,0]=3 146 B9R0.15 C=C\C=C(/CCC)C(=O)O C16656 [0,1,1,0,0,0|0,0,2]=4 147 B9R1.1 C=CC1=CC=C(O)C=C1 C05627 [1,1,0,0,0,0|1,0,0]=3 148 B9R1.1 CC1=CC=C(C=O)C=C1 C06758 [1,1,0,0,0,0|0,0,0]=2 149 B9R1.1 CC1=CC=C(CO)C=C1 C06757 [1,1,0,0,0,0|0,0,1]=3 150 B9R1.1 CCC1=CC=C(O)C=C1 C13637 [1,1,0,0,0,0|1,0,1]=4 151 B9R1.1 CNC1=CC=C(O)C=C1 C11206 [1,1,0,0,0,0|2,0,0]=4 152 B9R1.1 COC1=CC=C(N)C=C1 C19326 [1,1,0,0,0,0|2,0,0]=4 153 B9R1.1 O=CC1=CC=C(Cl)C=C1 C06648 [1,1,0,0,0,0|0,0,0]=2 154 B9R1.1 O=CC1=CC=C(O)C=C1 C00633 [1,1,0,0,0,0|0,0,0]=2 155 B9R1.1 OCC1=CC=C(O)C=C1 C17467 [1,1,0,0,0,0|0,0,1]=3 156 B9R1.2 CC1=CC=CC(C=O)=C1 C07209 [1,1,0,0,0,0|0,0,0]=2 157 B9R1.2 CC1=CC=CC(CO)=C1 C07216 [1,1,0,0,0,0|0,0,1]=3 158 B9R1.2 CCC1=CC(O)=CC=C1 C14386 [1,1,0,0,0,0|1,0,1]=4 159 B9R1.2 CCC1=CC=CC(C)=C1 C14522 [1,1,0,0,0,0|1,0,1]=4 160 B9R1.2 O=CC1=CC=CC(O)=C1 C03067 [1,1,0,0,0,0|0,0,0]=2 161 B9R1.2 OCC1=CC=CC(O)=C1 C03351 [1,1,0,0,0,0|0,0,1]=3 162 B9R1.2 ONC1=CC(O)=CC=C1 C14602 [1,1,0,0,0,0|1,0,0]=3 163 B9R1.8 CCNC1=CC=CC=C1 C14455 [1,1,0,0,0,0|1,0,1]=4 164 B9R1.8 N#CCC1=CC=CC=C1 C16074 [1,1,0,0,0,0|1,0,1]=4 165 B9R1.8 NCCC1=CC=CC=C1 C05332 [1,1,0,0,0,0|1,0,1]=4 166 B9R1.8 O=CCC1=CC=CC=C1 C00601 [1,1,0,0,0,0|0,0,0]=2 167 B9R1.8 OCCC1=CC=CC=C1 C05853 [1,1,0,0,0,0|0,0,1]=3 168 B9R1.15 CC1=C(C=O)C=CC=C1 C07214 [1,1,0,0,0,0|0,0,0]=2 169 B9R1.15 CC1=C(CO)C=CC=C1 C07213 [1,1,0,0,0,0|0,0,1]=3 170 B9R1.15 CCC1=C(C)C=CC=C1 C14572 [1,1,0,0,0,0|1,0,1]=4 171 B9R1.15 CCC1=CC=CC=C1O C14385 [1,1,0,0,0,0|1,0,1]=4 172 B9R1.15 COC1=C(N)C=CC=C1 C19191 [1,1,0,0,0,0|2,0,0]=4 173 B9R1.15 COC1=CC=CC=C1I C03575 [1,1,0,0,0,0|2,0,0]=4 174 B9R1.15 COC1=CC=CC=C1O C01502 [1,1,0,0,0,0|2,0,0]=4 175 B9R1.15 COC1=CC=CC=C1O C15572 [1,1,0,0,0,0|2,0,0]=4 176 B9R1.15 NNC1=C(Cl)C=CC=C1 C11582 [1,1,0,0,0,0|2,0,0]=4 177 B9R1.15 O=CC1=C(O)C=CC=C1 C06202 [1,1,0,0,0,0|0,0,0]=2 178 B9R1.15 OCC1=CC=CC=C1O C02323 [1,1,0,0,0,0|0,0,1]=3 179 B9R1.11 [*]SC(=O)C1=CC=CN1 C12483 [0,1,0,0,1,0|1,1,0]=4 180 B9R1.11 [*]SC(=O)C1=CC=CN1 C21567 [0,1,0,0,1,0|1,1,0]=4 181 B9R1.35 O=C(O)C1=CC=C(O)N1 C19721 [0,1,0,0,1,0|1,0,0]=3 182 B9R1.41 NC1=C(C(=O)O)N=CN1 C05516 [0,1,0,0,1,0|2,0,0]=4 183 B11R1.20 CC(=O)NC1=CC=C(Cl)C=C1 C14494 [0,1,0,0,0,1|1,0,0]=3 184 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 C06804 [0,1,0,0,0,1|1,0,0]=3 185 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 C01963 [0,1,0,0,0,1|1,0,0]=3 186 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 C13636 [0,1,0,0,0,1|1,0,0]=3 187 B11R1.20 NC(=S)NC1=CC=C(Br)C=C1 C14644 [0,1,0,0,0,1|1,1,0]=4 188 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 C03076 [0,1,0,0,0,1|0,0,0]=2 189 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 C03077 [0,1,0,0,0,1|0,0,0]=2 190 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 C00642 [0,1,0,0,0,1|0,0,0]=2 191 B11R1.20 [*]C(=O)NC1=CC=C([*])C=C1 C03083 [0,1,0,0,0,1|1,0,0]=3 192 B11R1.20 [*]C1=CC=C(CC(=O)O)C=C1 C03768 [0,1,0,0,0,1|0,0,0]=2 193 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 C17268 [0,1,0,0,0,1|1,0,0]=3 194 B11R1.36 N=C(C1=CC=CC=C1)S(=O)O C16285 [0,1,0,0,0,1|1,0,0]=3 195 B11R1.36 NC(=O)[C@H](O)C1=CC=CC=C1 C07301 [0,1,0,0,0,1|1,0,0]=3 196 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 C18623 [0,1,0,0,0,1|0,0,0]=2 197 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 C02137 [0,1,0,0,0,1|0,0,0]=2 198 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 C01984 [0,1,0,0,0,1|0,0,0]=2 199 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 C01983 [0,1,0,0,0,1|0,0,0]=2 200 B11R1.40 O\N=C(/S)CC1=CC=CC=C1 C03719 [0,1,0,0,0,1|0,1,0]=3 201 B11R1.86 CC(=O)NC1=C(Cl)C=CC=C1 C14619 [0,1,0,0,0,1|1,0,0]=3 202 B11R1.86 O=C(O)CC1=CC=CC=C1O C05852 [0,1,0,0,0,1|0,0,0]=2 203 B11R1.157 CC(=O)OC1=CC(O)=CC=C1 C12064 [0,1,0,0,0,1|1,0,0]=3 204 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 C05593 [0,1,0,0,0,1|0,0,0]=2 205 B11R1.509 O=P(O)(O)OC1=CC=CC=C1 C02734 [0,1,0,0,0,1|1,0,0]=3 206 B11R1.509 O=S(=O)(F)CC1=CC=CC=C1 C06747 [0,1,0,0,0,1|1,0,1]=4 207 B11R1.509 O=S(=O)(O)OC1=CC=CC=C1 C00850 [0,1,0,0,0,1|1,0,0]=3 208 B11R1.509 O=S(=O)(O)OC1=CC=CC=C1 C02180 [0,1,0,0,0,1|1,0,0]=3 209 B11R1.509 O=S(=O)([O-])NC1=CC=CC=C1 C06011 [0,1,0,0,0,1|1,0,1]=4 210 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 C03522 [0,2,0,0,0,0|0,0,0]=2 211 B11R1.3 COC1=CC=C(C(=O)O)C=C1 C02519 [0,2,0,0,0,0|0,0,0]=2 212 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 C07555 [0,2,0,0,0,0|1,0,1]=4 213 B11R1.3 O=C(O)C1=CC=C([Hg]Cl)C=C1 C03444 [0,2,0,0,0,0|0,0,0]=2 214 B11R1.3 [*][Hg]C1=CC=C(C(=O)O)C=C1 C00985 [0,2,0,0,0,0|0,0,0]=2 215 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 C06677 [0,2,0,0,0,0|1,0,0]=3 216 B11R1.19 CC1=CC=C(S(N)(=O)=O)C=C1 C14412 [0,2,0,0,0,0|1,0,1]=4 217 B11R1.19 NC1=CC=C(S(=O)(=O)O)C=C1 C06335 [0,2,0,0,0,0|1,0,0]=3 218 B11R1.19 NC1=CC=C(S(N)(=O)=O)C=C1 C07458 [0,2,0,0,0,0|1,0,1]=4 219 B11R1.19 O=S(=O)(O)C1=CC=C(O)C=C1 C12849 [0,2,0,0,0,0|1,0,0]=3 220 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 C10675 [0,2,0,0,0,0|1,0,0]=3 221 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 C21167 [0,2,0,0,0,0|0,0,0]=2 222 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1N C16398 [0,2,0,0,0,0|1,0,1]=4 223 B11R1.21 CC1=NC=C(C(=O)O)C=C1O C01270 [0,2,0,0,0,0|1,0,0]=3 224 B11R1.21 CN1C=C(C(N)=O)C=CC1=O C05842 [0,2,0,0,0,0|2,0,0]=4 225 B11R1.21 NC1=C(N)C=C([N+](=O)[O-])C=C1 C19384 [0,2,0,0,0,0|1,0,1]=4 226 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 C12115 [0,2,0,0,0,0|0,0,0]=2 227 B11R1.21 NC1=CC([N+](=O)[O-])=CC=C1O C19321 [0,2,0,0,0,0|1,0,1]=4 228 B11R1.21 NC1=CC=C([N+](=O)[O-])C=C1O C19322 [0,2,0,0,0,0|1,0,1]=4 229 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 C00230 [0,2,0,0,0,0|0,0,0]=2 230 B11R1.21 O=C(O)C1=C[C@@H](O)[C@H](O)C=C1 C20710 [0,2,0,0,0,0|0,0,2]=4 231 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(O)=C1 C02235 [0,2,0,0,0,0|1,0,1]=4 232 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 C13342 [0,2,0,0,0,0|1,0,0]=3 233 B11R1.22 N#CC(O)C1=CC=C(O)C=C1 C00650 [0,2,0,0,0,0|1,0,1]=4 234 B11R1.22 N#C[C@@H](O)C1=CC=C(O)C=C1 C03742 [0,2,0,0,0,0|1,0,1]=4 235 B11R1.22 NC[C@H](O)C1=CC=C(O)C=C1 C04227 [0,2,0,0,0,0|1,0,1]=4 236 B11R1.22 O=C(CO)C1=CC=C(O)C=C1 C13635 [0,2,0,0,0,0|0,0,0]=2 237 B11R1.22 [*]SC(=O)C1=CC=C(O)C=C1 C21505 [0,2,0,0,0,0|0,1,0]=3 238 B11R1.166 CC(=O)C1=CC=C(O)C=C1O C03663 [0,2,0,0,0,0|1,0,0]=3 239 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 C14103 [0,2,0,0,0,0|0,0,0]=2 240 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 C02518 [0,2,0,0,0,0|0,0,0]=2 241 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 C08055 [0,2,0,0,0,0|0,0,1]=3 242 B11R1.166 NC1=CC=C(C(=O)[O-])C([O-])=C1 C13104 [0,2,0,0,0,0|0,0,1]=3 243 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 C06670 [0,2,0,0,0,0|0,0,0]=2 244 B11R1.166 O=C(O)C1=C(O)N=C(O)C=C1 C15523 [0,2,0,0,0,0|1,0,0]=3 245 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 C03030 [0,2,0,0,0,0|2,0,0]=4 246 B11R1.16 CNCC(O)C1=CC=CC=C1 C03711 [0,2,0,0,0,0|1,0,1]=4 247 B11R1.16 O=C(N=C=S)C1=CC=CC=C1 C20170 [0,2,0,0,0,0|0,1,0]=3 248 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 C17512 [0,2,0,0,0,0|1,0,0]=3 249 B11R1.222 COC(=O)C1=CC=CC=C1N C20634 [0,2,0,0,0,0|0,0,0]=2 250 B11R1.222 COC(=O)C1=CC=CC=C1O C12305 [0,2,0,0,0,0|0,0,0]=2 251 B11R1.222 O=C(NO)C1=C(O)C=CC=C1 C11343 [0,2,0,0,0,0|0,0,0]=2 252 B11R1.87 NC1=C(S(=O)(=O)O)C=CC=C1 C06333 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.155 NC1=CC=CC(S(=O)(=O)O)=C1 C06334 [0,2,0,0,0,0|1,0,0]=3 254 B11R1.53 CNC1=CC=CC=C1C(=O)O C03005 [0,2,0,0,0,0|0,0,0]=2 255 B11R1.53 COC1=CC=CC=C1[N+](=O)[O-] C19270 [0,2,0,0,0,0|1,0,1]=4 256 B11R1.53 O=C(O)C1=C(NO)C=CC=C1 C16235 [0,2,0,0,0,0|0,0,0]=2 257 B11R1.53 O=C(O)C1=CC=CC=C1CO C10804 [0,2,0,0,0,0|0,0,0]=2 258 B11R1.53 O=CC1=CC=CC=C1C(=O)O C03057 [0,2,0,0,0,0|0,0,0]=2 259 B11R1.156 CC1=C(C(=O)O)C(O)=CC=C1 C02657 [0,2,0,0,0,0|0,0,0]=2 260 B11R1.156 NC(=O)C1=C(Cl)C=CC=C1Cl C10934 [0,2,0,0,0,0|1,0,0]=3 261 B11R1.156 NC(=S)C1=C(Cl)C=CC=C1Cl C11041 [0,2,0,0,0,0|1,1,0]=4 262 B11R1.156 O=C(O)C1=C(O)C=CC=C1O C21298 [0,2,0,0,0,0|0,0,0]=2 263 B11R1.159 CC1=C(N)C(C(=O)O)=CC=C1 C16571 [0,2,0,0,0,0|0,0,0]=2 264 B11R1.159 CC1=C(O)C(C(=O)O)=CC=C1 C14088 [0,2,0,0,0,0|0,0,0]=2 265 B11R1.159 N=C1C(=O)C=CC=C1C(=O)O C04584 [0,2,0,0,0,0|0,0,0]=2 266 B11R1.159 NC1=C(O)C=CC=C1C(=O)O C00632 [0,2,0,0,0,0|0,0,0]=2 267 B11R1.159 N[C@H]1C(C(=O)O)=CC=C[C@@H]1O C19830 [0,2,0,0,0,0|0,0,2]=4 268 B11R1.159 O=C(O)C1=CC=CC(O)=C1O C00196 [0,2,0,0,0,0|0,0,0]=2 269 B11R1.159 O=C(O)C1=CC=C[C@H](O)[C@H]1O C04171 [0,2,0,0,0,0|0,0,2]=4 270 B11R1.167 CC1=CC=C(N)C=C1[N+](=O)[O-] C18320 [0,2,0,0,0,0|1,0,1]=4 271 B11R1.167 CN1C=CC(=O)C(C(N)=O)=C1 C05843 [0,2,0,0,0,0|2,0,0]=4 272 B11R1.167 NC1=CC([N+](=O)[O-])=C(N)C=C1 C19385 [0,2,0,0,0,0|1,0,1]=4 273 B11R1.167 NC1=CC=C(O)C([N+](=O)[O-])=C1 C19323 [0,2,0,0,0,0|1,0,1]=4 274 B11R1.167 O=C(O)C1=CC(O)=CC=C1O C00628 [0,2,0,0,0,0|0,0,0]=2 275 B11R1.167 O=C(O)C1=NC(Cl)=CC=C1Cl C18779 [0,2,0,0,0,0|1,0,0]=3 276 B11R1.520 O=C(O)C1(O)C=CC=CC1O C04634 [0,2,0,0,0,0|0,0,2]=4 277 B11R1.520 O=C(O)[C@@]1(O)C=CC=C[C@@H]1O C06321 [0,2,0,0,0,0|0,0,2]=4 278 B11R1.74 NC1=CC(O)=CC(C(=O)O)=C1 C12107 [0,2,0,0,0,0|0,0,0]=2 279 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 C00295 [0,2,0,0,0,0|2,0,0]=4 280 B9R1.13 O=C(O)CC1=CC=CS1 C02595 [0,0,1,1,0,0|1,0,1]=4 281 B9R1.5 O=C1C=CC=CC=C1O C15474 [0,0,1,1,0,0|2,0,0]=4 282 B11R2.10 NC1=NC2=C(C=CC=C2)N1 C10901 [0,0,0,1,0,1|2,0,0]=4 283 B11R2.10 O=C1CC2=C(C=CC=C2)N1 C12312 [0,0,0,1,0,1|1,0,0]=3 284 B11R2.10 O=C1CC2=CC=CC=C2C1 C07727 [0,0,0,1,0,1|1,0,0]=3 285 B11R2.10 SC1=NC2=C(C=CC=C2)S1 C14437 [0,0,0,1,0,1|0,2,0]=4 286 B11R2.1 CC1=CNC2=C1C=CC=C2 C08313 [0,1,0,1,0,0|2,0,0]=4 287 B11R2.1 NC1=CNC2=CC=CC=C12 C01819 [0,1,0,1,0,0|2,0,0]=4 288 B11R2.1 O=C1CCC2=C1C=CC=C2 C01504 [0,1,0,1,0,0|1,0,0]=3 289 B11R2.1 OC1=CNC2=CC=CC=C12 C05658 [0,1,0,1,0,0|1,0,0]=3 290 B11R2.1 OC1CCC2=C1C=CC=C2 C01710 [0,1,0,1,0,0|1,0,1]=4 291 B7R1.1 O=CC1=CC=CO1 C14279 [1,0,0,0,1,0|1,0,0]=3 292 B7R1.1 OCC1=CC=CO1 C20441 [1,0,0,0,1,0|1,0,1]=4 293 B11R1.91 CC(=O)OCC1=CC=CC=C1 C15513 [0,0,0,0,0,2|1,0,0]=3 294 B11R1.91 CC(=O)ONC1=CC=CC=C1 C02709 [0,0,0,0,0,2|1,0,0]=3 295 B11R1.91 CC(=O)O[Hg]C1=CC=CC=C1 C11151 [0,0,0,0,0,2|1,0,0]=3 296 B11R1.91 NC(=O)NNC1=CC=CC=C1 C19498 [0,0,0,0,0,2|1,0,0]=3 297 B11R1.91 O=C(O)CCC1=CC=CC=C1 C05629 [0,0,0,0,0,2|0,0,0]=2 298 B11R1.91 O=C(O)COC1=CC=CC=C1 C02181 [0,0,0,0,0,2|0,0,0]=2 299 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 C00423 [0,0,0,0,0,2|0,0,0]=2 300 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 C10438 [0,0,0,0,0,2|0,0,0]=2 301 B11R1.91 [O-]\[N+](O)=C\CC1=CC=CC=C1 C21623 [0,0,0,0,0,2|1,0,1]=4