0 B10R1.3 CCC1=CC=C(CC)C=C1 C14583 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.3 COC1=CC=C(C=O)C=C1 C10761 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.3 NNC1=CC=C(CO)C=C1 C03994 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.3 ON=C1C=CC(=NO)C=C1 C19345 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.1 C=CC1=CC=C(O)C=C1 C05627 [1,0,0,0,0,0|1,0,1]=3 5 B9R1.1 CC1=CC=C(C=O)C=C1 C06758 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.1 CC1=CC=C(CO)C=C1 C06757 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.1 CCC1=CC=C(O)C=C1 C13637 [1,0,0,0,0,0|1,0,0]=2 8 B9R1.1 CNC1=CC=C(O)C=C1 C11206 [1,0,0,0,0,0|1,0,0]=2 9 B9R1.1 COC1=CC=C(N)C=C1 C19326 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.1 O=CC1=CC=C(Cl)C=C1 C06648 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.1 O=CC1=CC=C(O)C=C1 C00633 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.1 OCC1=CC=C(O)C=C1 C17467 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.3 CC(C)C1=CC=C(C=O)C=C1 C06577 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.3 CC(C)C1=CC=C(CO)C=C1 C06576 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.3 CN(C)C1=CC=C(N=O)C=C1 C19680 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.3 CN(C)C1=CC=C(NO)C=C1 C19681 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.3 CN(C)C1=CC=C([N+]#N)C=C1 C13681 [0,1,0,0,0,0|3,0,0]=4 18 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 C03522 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.3 COC1=CC=C(C(=O)O)C=C1 C02519 [0,1,0,0,0,0|2,0,0]=3 20 B11R1.3 COC1=CC=C([N+](=O)[O-])C=C1 C07555 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.83 C=CCC1=CC=C(OC)C=C1 C10452 [0,1,0,0,0,0|1,0,1]=3 22 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 C10428 [0,1,0,0,0,0|1,0,0]=2 23 B8R1.2 C=CC1=CC=CC=C1 C07083 [2,0,0,0,0,0|1,0,1]=4 24 B8R1.2 C=CC1=CC=CC=C1 C19506 [2,0,0,0,0,0|1,0,1]=4 25 B8R1.2 C=CC1=CC=CC=C1 C19573 [2,0,0,0,0,0|1,0,1]=4 26 B8R1.2 C=CC1=CC=CC=C1 C19575 [2,0,0,0,0,0|1,0,1]=4 27 B8R1.2 CCC1=CC=CC=C1 C07111 [2,0,0,0,0,0|1,0,0]=3 28 B8R1.2 CNC1=CC=CC=C1 C02299 [2,0,0,0,0,0|1,0,0]=3 29 B8R1.2 COC1=CC=CC=C1 C01403 [2,0,0,0,0,0|0,0,0]=2 30 B8R1.2 ClCC1=CC=CC=C1 C19167 [2,0,0,0,0,0|2,0,0]=4 31 B8R1.2 N#CC1=CC=CC=C1 C09814 [2,0,0,0,0,0|2,0,0]=4 32 B8R1.2 N#[N+]C1=CC=CC=C1 C20284 [2,0,0,0,0,0|2,0,0]=4 33 B8R1.2 NCC1=CC=CC=C1 C15562 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.2 NNC1=CC=CC=C1 C02304 [2,0,0,0,0,0|2,0,0]=4 35 B8R1.2 O=CC1=CC=CC=C1 C00193 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.2 O=CC1=CC=CC=C1 C00261 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.2 O=NC1=CC=CC=C1 C06876 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.2 OCC1=CC=CC=C1 C00556 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.2 OCC1=CC=CC=C1 C03485 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.2 ONC1=CC=CC=C1 C02720 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.3 CC1=CC=C(C)C=C1 C06756 [2,0,0,0,0,0|0,0,0]=2 42 B8R1.3 CC1=CC=C(Cl)C=C1 C14451 [2,0,0,0,0,0|1,0,0]=3 43 B8R1.3 CC1=CC=C(O)C=C1 C01468 [2,0,0,0,0,0|0,0,0]=2 44 B8R1.3 ClC1=CC=C(Cl)C=C1 C07092 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.3 NC1=CC=C(Cl)C=C1 C14450 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.3 NC1=CC=C(F)C=C1 C11014 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.3 NC1=CC=C(N)C=C1 C19499 [2,0,0,0,0,0|2,0,0]=4 48 B8R1.3 NC1=CC=C(O)C=C1 C02372 [2,0,0,0,0,0|1,0,0]=3 49 B8R1.3 O=C1C=CC(=O)C=C1 C00472 [2,0,0,0,0,0|0,0,2]=4 50 B8R1.3 OC1=CC=C(Br)C=C1 C14453 [2,0,0,0,0,0|1,0,0]=3 51 B8R1.3 OC1=CC=C(Cl)C=C1 C02124 [2,0,0,0,0,0|1,0,0]=3 52 B8R1.3 OC1=CC=C(F)C=C1 C16485 [2,0,0,0,0,0|1,0,0]=3 53 B8R1.3 OC1=CC=C(O)C=C1 C00530 [2,0,0,0,0,0|0,0,0]=2 54 B8R1.3 OC1=CC=C(O)N=C1 C01059 [2,0,0,0,0,0|1,0,0]=3 55 B8R1.3 [*]C1=CC=C(N)C=C1 C03084 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.3 [O]C1=CC=C(O)C=C1 C02389 [2,0,0,0,0,0|0,0,1]=3 57 B10R0.46 COC(=O)\C=C(/C)C(=O)OC C05126 [0,1,1,0,0,0|2,0,0]=4 58 B10R1.1 C=CCC1=CC=C(O)C=C1 C16930 [1,1,0,0,0,0|1,0,1]=4 59 B10R1.1 CCCC1=CC=C(O)C=C1 C14311 [1,1,0,0,0,0|1,0,0]=3 60 B10R1.1 C\C=C\C1=CC=C(O)C=C1 C20464 [1,1,0,0,0,0|1,0,0]=3 61 B10R1.1 N#CCC1=CC=C(O)C=C1 C03766 [1,1,0,0,0,0|1,0,1]=4 62 B10R1.1 NCCC1=CC=C(O)C=C1 C00483 [1,1,0,0,0,0|1,0,0]=3 63 B10R1.1 O=CCC1=CC=C(O)C=C1 C03765 [1,1,0,0,0,0|1,0,1]=4 64 B10R1.1 OCCC1=CC=C(O)C=C1 C06044 [1,1,0,0,0,0|1,0,0]=3 65 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 C06647 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.13 CC(=O)C1=CC=C(O)C=C1 C10700 [1,1,0,0,0,0|1,0,0]=3 67 B10R1.13 CC(N)C1=CC=C(O)C=C1 C03473 [1,1,0,0,0,0|1,0,0]=3 68 B10R1.13 CC(O)C1=CC=C(O)C=C1 C13638 [1,1,0,0,0,0|1,0,0]=3 69 B10R1.13 CC1=CC=C(C(=O)O)C=C1 C01454 [1,1,0,0,0,0|2,0,0]=4 70 B10R1.13 CC1=CC=C(C(C)C)C=C1 C06575 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.13 CC1=CC=C([N+](=O)[O-])C=C1 C14394 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.13 CN(C)C1=CC=C(N)C=C1 C04203 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.13 O=C(O)C1=CC=C(O)C=C1 C00156 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 C00870 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.25 COC1=C(N)C=C(C)C=C1 C19216 [1,1,0,0,0,0|0,0,0]=2 76 B10R1.25 COC1=C(N)C=C(N)C=C1 C19218 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.176 C=CC1=CC=C(O)C(O)=C1 C06224 [1,1,0,0,0,0|1,0,1]=4 78 B10R1.176 CC1=C(O)C=CC(C=O)=C1 C21166 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.176 COC1=CC(C)=C(N)C=C1 C19376 [1,1,0,0,0,0|1,0,0]=3 80 B10R1.176 O=CC1=CC(O)=C(O)C=C1 C16700 [1,1,0,0,0,0|2,0,0]=4 81 B10R1.176 OCC1=CC=C(O)C(O)=C1 C14110 [1,1,0,0,0,0|2,0,0]=4 82 B12R1.48 COC1=C(N)C=C([N+](=O)[O-])C=C1 C19469 [0,2,0,0,0,0|2,0,0]=4 83 B12R1.48 COC1=C(O)C=C([N+](=O)[O-])C=C1 C17385 [0,2,0,0,0,0|2,0,0]=4 84 B12R1.452 COC1=CC=C(C(=O)O)C(O)=C1 C18346 [0,2,0,0,0,0|2,0,0]=4 85 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 C10712 [0,2,0,0,0,0|1,0,0]=3 86 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 C10475 [0,2,0,0,0,0|1,0,1]=4 87 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 C02201 [0,2,0,0,0,0|2,0,0]=4 88 B12R1.78 COC1=C(OC)C=C(CO)C=C1 C21420 [0,2,0,0,0,0|2,0,0]=4 89 B12R1.78 COC1=C(OC)C=C(C[O])C=C1 C21421 [0,2,0,0,0,0|2,0,0]=4 90 B12R1.450 COC1=CC(Cl)=C(OC)C=C1Cl C11252 [0,2,0,0,0,0|0,0,0]=2 91 B12R2.44 O=CC1=CC2=C(C=C1)OCO2 C10812 [0,1,0,1,0,0|2,0,0]=4 92 B10R1.172 COC1=CC(CO)=CC=C1 C03352 [0,0,0,0,1,1|2,0,0]=4