0 B9R1.15 CC1=C(CS)C=CC=C1 105405 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.15 CC1=CC=NC=C1C=O 065210 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.15 CSC1=C(S)C=CC=C1 037946 [0,0,0,0,0,0|0,2,0]=2 3 B9R1.15 N#CC1=NC=CC=C1I 077305 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.15 NNC1=NC=CC=C1Br 061116 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.2 COC1=CC=CC=C1 M03556 [1,0,0,0,0,0|0,0,0]=1 6 B8R1.2 NCC1=CC=CC=C1 098408 [1,0,0,0,0,0|2,0,0]=3 7 B8R1.2 [15NH2]CC1=CC=CC=C1 105185 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.2 CC1=C(Cl)C(CN)=CC=C1 075958 [0,1,0,0,0,0|3,0,0]=4 9 B10R1.2 CSC1=C(C)C(Cl)=CC=C1 094705 [0,1,0,0,0,0|1,1,0]=3 10 B10R1.2 CSC1=CC=CC(Br)=C1Cl 105294 [0,1,0,0,0,0|1,1,0]=3 11 B10R1.4 CCOC1=C(I)C=CC=C1 038700 [0,1,0,0,0,0|1,0,0]=2 12 B10R1.4 ClC1=C(CCBr)C=CC=C1 020893 [0,1,0,0,0,0|2,0,0]=3 13 B10R1.4 N#COC1=C(Br)C=CC=C1 104805 [0,1,0,0,0,0|1,0,1]=3 14 B10R1.4 [N-]=[N+]=NC1=C(I)C=CC=C1 101266 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.25 CC1=CC(C)=C(CO)C=C1 049893 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.25 CC1=CC=C(CBr)C(C)=C1 221500 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.25 COC1=C(F)C=C(C)C=C1 009215 [0,1,0,0,0,0|1,0,0]=2 18 B10R1.25 COC1=C(F)C=C(I)C=C1 038782 [0,1,0,0,0,0|1,0,0]=2 19 B10R1.25 COC1=C(O)C=C(C)C=C1 009947 [0,1,0,0,0,0|0,0,0]=1 20 B10R1.25 ClC1=CC(Br)=C(CBr)C=C1 097690 [0,1,0,0,0,0|3,0,0]=4 21 B10R1.25 OCC1=CC=C(Br)C=C1Br 222555 [0,1,0,0,0,0|3,0,0]=4 22 B10R1.25 OCC1=CC=C(Br)C=C1O 217533 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.30 C=CC1=C(F)C=CC(F)=C1 474850 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.30 CC1=C(CBr)C=C(Br)C=C1 246530 [0,1,0,0,0,0|3,0,0]=4 25 B10R1.30 CC1=CC(C#N)=C(Cl)C=C1 070845 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.30 CC1=CC(CN)=C(Cl)C=C1 070846 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.30 CC1=CC(CO)=C(C)C=C1 104981 [0,1,0,0,0,0|3,0,0]=4 28 B10R1.30 CCC1=C(F)C=CC(Br)=C1 037701 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.30 COC1=C(Cl)C=CC(I)=C1 075709 [0,1,0,0,0,0|1,0,0]=2 30 B10R1.30 COC1=C(Cl)C=CC(S)=C1 075710 [0,1,0,0,0,0|1,0,0]=2 31 B10R1.30 COC1=CC(C)=CC=C1Cl 038664 [0,1,0,0,0,0|1,0,0]=2 32 B10R1.30 COC1=CC(C)=CC=C1O 216346 [0,1,0,0,0,0|0,0,0]=1 33 B10R1.30 CSC1=C(F)C=CC(Br)=C1 098206 [0,1,0,0,0,0|1,1,0]=3 34 B10R1.30 ClCC1=C(I)C=CC(Br)=C1 331982 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.30 OCC1=C(I)C=CC(Br)=C1 331559 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.61 CC(F)C1=C(Br)C=CC=C1 035830 [0,1,0,0,0,0|2,0,0]=3 37 B10R1.61 CS(=O)C1=C(Cl)C=CC=C1 064490 [0,1,0,0,0,0|1,1,0]=3 38 B10R1.61 CS(=O)C1=C(F)C=CC=C1 064511 [0,1,0,0,0,0|1,1,0]=3 39 B10R1.245 C=CC1=C(F)C=CC=C1F 233345 [0,1,0,0,0,0|2,0,1]=4 40 B10R1.245 CC1=C(CBr)C(Cl)=CC=C1 246422 [0,1,0,0,0,0|3,0,0]=4 41 B10R1.245 CC1=CC=CC(Cl)=C1CN 070847 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.245 FC1=CC=CC(Cl)=C1CS 004446 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.1 CC1=CC=C(CS)C=C1 105406 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.1 CNC1=CC=C(I)C=C1 045902 [1,1,0,0,0,0|1,0,0]=3 45 B9R1.1 COC1=NC=C(I)C=C1 033478 [1,1,0,0,0,0|1,0,0]=3 46 B9R1.2 CC1=CC=CC(CS)=C1 105403 [1,1,0,0,0,0|2,0,0]=4 47 B9R1.2 CSC1=CC=CC(S)=C1 037948 [1,1,0,0,0,0|0,1,0]=3 48 B9R1.6 CC(N)C1=CC=CC=N1 300972 [1,1,0,0,0,0|2,0,0]=4 49 B9R1.8 COCC1=CC=NC=C1 097899 [1,1,0,0,0,0|1,0,0]=3 50 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 480957 [1,1,0,0,0,0|1,0,1]=4 51 B9R1.3 BrC1=CC=CC(Br)=C1Br 043140 [1,1,0,0,0,0|2,0,0]=4 52 B9R1.3 CC1=C(Cl)C=CC=C1S 037936 [1,1,0,0,0,0|0,1,0]=3 53 B9R1.3 CC1=C(S)C(Br)=CC=C1 070731 [1,1,0,0,0,0|0,1,0]=3 54 B9R1.3 CC1=CC=CC(Br)=C1Br 038623 [1,1,0,0,0,0|1,0,0]=3 55 B9R1.3 CC1=CC=CC(Cl)=C1S 070849 [1,1,0,0,0,0|0,1,0]=3 56 B9R1.3 CC1=CC=CC(F)=C1S 038010 [1,1,0,0,0,0|0,1,0]=3 57 B9R1.3 CN1C=CC=C(N)C1=O 230459 [1,1,0,0,0,0|1,0,1]=4 58 B9R1.3 ClC1=C(I)C=CC=C1Br 062572 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.3 FC1=C(S)C(Br)=CC=C1 061591 [1,1,0,0,0,0|1,1,0]=4 60 B9R1.3 FC1=CC=CC(I)=C1I 043101 [1,1,0,0,0,0|2,0,0]=4 61 B9R1.3 NC1=C(Cl)C(I)=CC=C1 105010 [1,1,0,0,0,0|2,0,0]=4 62 B9R1.3 NC1=C(I)C(Br)=CC=C1 546297 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.3 SC1=C(Cl)C=CC=C1Br 061707 [1,1,0,0,0,0|1,1,0]=4 64 B9R1.3 [2H]C1=C(F)C=CC=C1F 043267 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.69 CC1=C(Br)C=CC(S)=C1 037916 [1,1,0,0,0,0|1,0,0]=3 66 B9R1.69 CC1=C(Cl)C=CC(S)=C1 023133 [1,1,0,0,0,0|1,0,0]=3 67 B9R1.69 CC1=C(S)C=C(F)C=C1 023128 [1,1,0,0,0,0|0,1,0]=3 68 B9R1.69 CC1=CC(F)=C(S)C=C1 037941 [1,1,0,0,0,0|1,1,0]=4 69 B9R1.69 CC1=CC(I)=C(Cl)C=C1 070844 [1,1,0,0,0,0|2,0,0]=4 70 B9R1.69 CC1=CC(S)=C(Cl)C=C1 070848 [1,1,0,0,0,0|1,1,0]=4 71 B9R1.69 CC1=CC=C(S)C(Br)=C1 037914 [1,1,0,0,0,0|1,1,0]=4 72 B9R1.69 CC1=CC=C(S)C=C1Cl 037966 [1,1,0,0,0,0|1,0,0]=3 73 B9R1.69 FC1=CC(S)=C(Cl)C=C1 037925 [1,1,0,0,0,0|1,1,0]=4 74 B9R1.69 NC1=C(F)C=CC(I)=C1 040840 [1,1,0,0,0,0|2,0,0]=4 75 B9R1.69 NC1=CC(N)=C(F)C=C1 075178 [1,1,0,0,0,0|2,0,0]=4 76 B9R1.69 NC1=CC=C(Cl)C(I)=C1 334410 [1,1,0,0,0,0|2,0,0]=4 77 B9R1.69 SC1=CC(Br)=C(Br)C=C1 037994 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.8 CCC1=C(I)C(Br)=CC(Br)=C1 037703 [0,2,0,0,0,0|2,0,0]=4 79 B11R1.8 CCC1=CC(Br)=CC(C)=C1Br 038645 [0,2,0,0,0,0|2,0,0]=4 80 B11R1.8 CCC1=CC(Br)=CC(C)=C1I 038644 [0,2,0,0,0,0|2,0,0]=4 81 B11R1.8 COC1=C(Cl)C(Br)=CC(N)=C1 061630 [0,2,0,0,0,0|1,0,0]=3 82 B11R1.8 COC1=C(I)C(Br)=CC(N)=C1 061629 [0,2,0,0,0,0|1,0,0]=3 83 B11R1.8 COC1=CC(C)=CC(Br)=C1Br 038671 [0,2,0,0,0,0|1,0,0]=3 84 B11R1.8 COC1=CC(C)=CC(Br)=C1Cl 038670 [0,2,0,0,0,0|1,0,0]=3 85 B11R1.8 COC1=CC(C)=CC(Br)=C1I 038672 [0,2,0,0,0,0|1,0,0]=3 86 B11R1.13 CCSC1=C(Br)C(C)=CC=C1 105098 [0,2,0,0,0,0|1,1,0]=4 87 B11R1.72 COC1=C(Cl)C=CC(F)=C1Br 043239 [0,2,0,0,0,0|1,0,0]=3 88 B11R1.72 COC1=C(Cl)C=CC(F)=C1C 043244 [0,2,0,0,0,0|1,0,0]=3 89 B11R1.72 COC1=C(F)C=CC(F)=C1I 043235 [0,2,0,0,0,0|1,0,0]=3 90 B11R1.72 COC1=C(F)C=CC(F)=C1S 043237 [0,2,0,0,0,0|0,1,0]=3 91 B11R1.265 COC1=C(Br)C=CC=C1C=O 079917 [0,2,0,0,0,0|0,0,1]=3 92 B11R1.267 COC1=CC=CC(OC)=C1F 038795 [0,2,0,0,0,0|1,0,0]=3 93 B11R1.267 COC1=CC=CC(OC)=C1S 068202 [0,2,0,0,0,0|0,1,0]=3 94 B11R1.278 COC1=C(Cl)C(N)=C(F)C=C1 342696 [0,2,0,0,0,0|1,0,0]=3 95 B11R1.278 COC1=C(I)C(Cl)=C(Cl)C=C1 105293 [0,2,0,0,0,0|1,0,0]=3 96 B11R1.278 COC1=CC=C(Br)C(C)=C1N 304928 [0,2,0,0,0,0|1,0,0]=3 97 B11R1.81 CCOC1=C(F)C=C(Cl)C=C1 013280 [0,2,0,0,0,0|1,0,0]=3 98 B11R1.81 CCOC1=CC=C(Cl)C=C1N 038510 [0,2,0,0,0,0|1,0,0]=3 99 B11R1.81 CCOC1=CC=C(N)C=C1C 038824 [0,2,0,0,0,0|1,0,0]=3 100 B11R1.81 CCOC1=CC=C(S)C=C1F 070623 [0,2,0,0,0,0|1,0,0]=3 101 B11R1.86 CC(C)OC1=CC=CC=C1S 038807 [0,2,0,0,0,0|0,1,0]=3 102 B11R1.182 CCNC1=C(N)C=CC(Br)=C1 105267 [0,2,0,0,0,0|2,0,0]=4 103 B11R1.182 CCOC1=C(Br)C=CC(Br)=C1 038698 [0,2,0,0,0,0|1,0,0]=3 104 B11R1.182 COCC1=C(Br)C=CC(F)=C1 013237 [0,2,0,0,0,0|1,0,0]=3 105 B11R1.605 CCOC1=C(Br)C=CC=C1C 038819 [0,2,0,0,0,0|1,0,0]=3 106 B11R1.605 CCOC1=C(I)C=CC=C1C 038815 [0,2,0,0,0,0|1,0,0]=3 107 B11R1.605 CCOC1=C(N)C=CC=C1Cl 310412 [0,2,0,0,0,0|1,0,0]=3 108 B11R1.37 CCC1=C(C#N)C=CC(Br)=C1 069432 [0,2,0,0,0,0|2,0,0]=4 109 B11R1.37 COC1=C(C=O)C=CC(Cl)=C1 075241 [0,2,0,0,0,0|0,0,1]=3 110 B11R1.37 COC1=C(CBr)C=C(Cl)C=C1 238552 [0,2,0,0,0,0|1,0,0]=3 111 B11R1.37 COC1=C(CO)C=C(Cl)C=C1 097795 [0,2,0,0,0,0|0,0,0]=2 112 B11R1.37 COC1=CC(C)=CC=C1C=O 038667 [0,2,0,0,0,0|0,0,1]=3 113 B11R1.53 COC1=C(S(C)=O)C=CC=C1 064503 [0,2,0,0,0,0|0,0,1]=3 114 B11R1.277 COC1=C(Br)C=C(Cl)C(Br)=C1 037539 [0,2,0,0,0,0|1,0,0]=3 115 B11R1.277 COC1=C(Br)C=C(F)C(C)=C1 104803 [0,2,0,0,0,0|1,0,0]=3 116 B11R1.277 COC1=C(Cl)C=C(F)C(Br)=C1 040856 [0,2,0,0,0,0|1,0,0]=3 117 B11R1.277 COC1=C(S)C=C(Cl)C(Br)=C1 037998 [0,2,0,0,0,0|0,1,0]=3 118 B11R1.277 COC1=CC(Br)=C(C)C=C1Br 038678 [0,2,0,0,0,0|1,0,0]=3 119 B11R1.277 COC1=CC(F)=C(S)C=C1F 038035 [0,2,0,0,0,0|1,0,0]=3 120 B11R1.279 COC1=CC=C(SC)C=C1S 070484 [0,2,0,0,0,0|0,1,0]=3 121 B11R1.464 COC1=C(C)C=C(I)C=C1C 038045 [0,2,0,0,0,0|1,0,0]=3 122 B11R1.464 COC1=C(F)C=C(Br)C=C1Br 013292 [0,2,0,0,0,0|1,0,0]=3 123 B11R1.464 COC1=C(F)C=C(S)C=C1F 038034 [0,2,0,0,0,0|1,0,0]=3 124 B11R1.464 COC1=C(N)C=C(Cl)C=C1Br 062569 [0,2,0,0,0,0|1,0,0]=3 125 B11R1.464 COC1=C(S)C=C(F)C=C1F 038036 [0,2,0,0,0,0|0,1,0]=3 126 B11R1.167 CC(C)C1=CC(Br)=CC=C1O 244071 [0,2,0,0,0,0|1,0,0]=3 127 B11R1.167 CC1=CC(S(C)=O)=C(C)C=C1 064521 [0,2,0,0,0,0|1,1,0]=4 128 B11R1.280 CCC1=C(Cl)C=CC(C#N)=C1 069718 [0,2,0,0,0,0|2,0,0]=4 129 B11R1.280 CCC1=C(F)C=CC(C=O)=C1 098390 [0,2,0,0,0,0|2,0,0]=4 130 B11R1.280 CCC1=CC(C#N)=CC=C1Br 069709 [0,2,0,0,0,0|2,0,0]=4 131 B11R1.280 CCC1=CC(C#N)=CC=C1F 334525 [0,2,0,0,0,0|2,0,0]=4 132 B11R1.280 COC1=C(Cl)C=CC(C#N)=C1 075714 [0,2,0,0,0,0|1,0,0]=3 133 B11R1.280 COC1=CC(OC)=C(C)C=C1 045100 [0,2,0,0,0,0|1,0,0]=3 134 B11R1.156 CS(=O)C1=C(Cl)C=CC=C1Cl 064531 [0,2,0,0,0,0|1,1,0]=4 135 B11R2.106 OC1=CC=CC2=C1C=CS2 048268 [0,1,0,1,0,0|1,0,1]=4 136 B11R2.1 ON1N=NC2=C1C=CC=C2 M02875 [0,1,0,1,0,0|2,0,0]=4 137 B11R2.1 ON1N=NC2=CC=CC=C21 105380 [0,1,0,1,0,0|2,0,0]=4 138 B7R1.1 CSC1=CSC=C1 068554 [1,0,0,0,1,0|1,1,0]=4