0 B9R1.69 BrC1=CN=C(I)C(Br)=C1 Z0594 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.69 CC1=CC(Br)=CN=C1N Z1301 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.69 CC1=CC(N)=C(N)C=N1 3453AC [0,0,0,0,0,0|4,0,0]=4 3 B9R1.69 CC1=CC=C(C)C(C)=N1 7915AF [0,0,0,0,0,0|4,0,0]=4 4 B9R1.69 CC1=CC=C(N)C=C1O I725 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.69 CC1=NC=C(Cl)C(Cl)=C1 X3720 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 ClC1=CC=C(I)C(I)=C1 X6555 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 FC1=CN=C(Cl)C(I)=C1 4120AC [0,0,0,0,0,0|3,0,1]=4 8 B9R1.69 NC1=C(S)C=C(Br)C=C1 1980AL [0,0,0,0,0,0|3,1,0]=4 9 B9R1.69 NC1=CC(Cl)=CN=C1F N241 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.69 NC1=CC(I)=C(Cl)N=C1 Y9127 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.69 NC1=CC=C(I)C=C1O 7023AC [0,0,0,0,0,0|3,0,0]=3 12 B9R1.69 NC1=CC=C(O)C(O)=C1 5570AA [0,0,0,0,0,0|2,0,1]=3 13 B9R1.69 NC1=NC=C(O)C=C1Cl 4975AH [0,0,0,0,0,0|3,0,1]=4 14 B9R1.69 OC1=C(Cl)C=C(Cl)C=C1 8996AJ [0,0,0,0,0,0|3,0,1]=4 15 B9R1.69 OC1=C(Cl)C=CC(Cl)=C1 7598AF [0,0,0,0,0,0|3,0,0]=3 16 B9R1.69 OC1=CC(I)=C(I)C=C1 4595AA [0,0,0,0,0,0|4,0,0]=4 17 B8R1.3 CC1=CC=C(C)C=C1 X8103 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.3 CC1=CC=C(O)C=C1 7878AF [1,0,0,0,0,0|1,0,1]=3 19 B8R1.3 NC1=CN=C(N)C=C1 N556 [1,0,0,0,0,0|2,0,1]=4 20 B8R1.4 CC1=CC(Br)=CC=N1 2699AJ [1,0,0,0,0,0|3,0,0]=4 21 B8R1.4 CC1=CN=NC(Br)=C1 4887AA [1,0,0,0,0,0|2,0,1]=4 22 B8R1.4 OC1=CC(O)=NN=C1 8905AA [1,0,0,0,0,0|2,0,1]=4 23 B8R1.4 OC1=CC=CC(O)=C1 O780 [1,0,0,0,0,0|2,0,0]=3 24 B8R1.4 OC1=CC=CC(O)=N1 5119AF [1,0,0,0,0,0|3,0,0]=4 25 B8R1.4 [O-][N+]1=CN=CC(O)=C1 4036AC [1,0,0,0,0,0|2,0,1]=4 26 B8R1.5 ClC1=CC=CC=C1Cl 9816AF [1,0,0,0,0,0|3,0,0]=4 27 B8R1.5 NC1=CC=CN=C1Cl 1676AJ [1,0,0,0,0,0|2,0,1]=4 28 B8R1.5 OC1=C(F)C=CN=C1 1350AA [1,0,0,0,0,0|3,0,0]=4 29 B10R1.22 CC1=CC(Cl)=C(Br)C(Cl)=C1 Z0324 [0,1,0,0,0,0|3,0,0]=4 30 B10R1.22 CC1=CC(F)=C(O)C(Br)=C1 Z1318 [0,1,0,0,0,0|2,0,1]=4 31 B10R1.22 CC1=CC(I)=C(N)C(C)=C1 5611AB [0,1,0,0,0,0|3,0,0]=4 32 B10R1.22 CC1=C[N+]([O-])=C(C)C(C)=C1 Z2435 [0,1,0,0,0,0|2,0,1]=4 33 B10R1.22 OC1=C(Cl)C(Cl)=CC(Cl)=C1 1866AL [0,1,0,0,0,0|3,0,0]=4 34 B10R1.25 CC1=C(N=O)C=CC(O)=C1 7860AF [0,1,0,0,0,0|3,0,0]=4 35 B10R1.25 CC1=CC=C(CBr)C(C)=C1 Z5135 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.25 CC1=CC=C(NN)C(Br)=C1 V7214 [0,1,0,0,0,0|3,0,0]=4 37 B10R1.25 CC1=CC=C(NN)C(C)=C1 1052AL [0,1,0,0,0,0|3,0,0]=4 38 B10R1.25 O=CC1=CN=C(Cl)C=C1O 3514AJ [0,1,0,0,0,0|3,0,0]=4 39 B10R1.30 CC1=CC(C#N)=C(C)C=C1 6569AA [0,1,0,0,0,0|3,0,0]=4 40 B10R1.30 CC1=CC([Mg]Br)=C(C)C=C1 7835AJ [0,1,0,0,0,0|3,0,0]=4 41 B10R1.30 CC1=CC=C(C)C(CN)=C1 W9616 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.30 CN1C=CC(=O)C(C#N)=C1 W2806 [0,1,0,0,0,0|3,0,0]=4 43 B10R1.30 COC1=CC(Cl)=CN=C1F Y3901 [0,1,0,0,0,0|2,0,1]=4 44 B10R1.30 COC1=CC(N)=CC=C1I X6495 [0,1,0,0,0,0|3,0,0]=4 45 B10R1.30 CSC1=CC(C)=CC=C1Cl Z1327 [0,1,0,0,0,0|2,1,0]=4 46 B10R1.30 CSC1=CC(C)=CC=C1F Z1248 [0,1,0,0,0,0|2,1,0]=4 47 B10R1.118 CC1=C(C)C=C(N)C(N)=C1 8112AJ [0,1,0,0,0,0|3,0,0]=4 48 B10R1.118 CC1=CC(C)=C(O)C=C1C 8101AF [0,1,0,0,0,0|2,0,0]=3 49 B10R1.118 OC1=CC(Cl)=C(O)C=C1Cl 2750AC [0,1,0,0,0,0|3,0,0]=4 50 B10R1.118 OC1=CC(I)=C(Br)N=C1Br 8740AC [0,1,0,0,0,0|2,0,1]=4 51 B10R1.119 CC1=C(C)C(C)=C(O)C=C1 9704AL [0,1,0,0,0,0|2,0,1]=4 52 B10R1.119 CC1=C(Cl)C(C)=C(C)N=C1 9851AL [0,1,0,0,0,0|2,0,1]=4 53 B10R1.119 CC1=C(O)C(C)=C(O)C=C1 9685AB [0,1,0,0,0,0|2,0,1]=4 54 B10R1.119 CC1=CC=C(N)C(O)=C1C 7914AD [0,1,0,0,0,0|2,0,0]=3 55 B10R1.119 CN1C=CC(=O)C(Cl)=C1Cl Z1255 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.119 OC1=C(Br)C=CC(Cl)=C1F Z0307 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.119 OC1=C(Cl)C=CC(Br)=C1Cl Y3745 [0,1,0,0,0,0|3,0,0]=4 58 B10R1.119 OC1=C(F)C=CC(F)=C1O Y1811 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.176 C=CC1=CC=C(O)C(O)=C1 9031AB [0,1,0,0,0,0|1,0,2]=4 60 B10R1.176 CC1=C(Cl)C=C(CCl)C=C1 L514 [0,1,0,0,0,0|3,0,0]=4 61 B10R1.176 CC1=C(F)C=C(CO)C=C1 6496AD [0,1,0,0,0,0|3,0,0]=4 62 B10R1.176 CC1=C(F)N=CC(CO)=C1 Y3984 [0,1,0,0,0,0|2,0,1]=4 63 B10R1.176 CNC1=CC=C(Cl)C(Cl)=C1 W6130 [0,1,0,0,0,0|3,0,0]=4 64 B10R1.176 COC1=CC(C)=C(C)C=C1 6400AB [0,1,0,0,0,0|3,0,0]=4 65 B10R1.176 COC1=CN=C(F)C(C)=C1 Y3921 [0,1,0,0,0,0|2,0,1]=4 66 B10R1.176 CSC1=CC=C(C)C(O)=C1 Y3611 [0,1,0,0,0,0|2,0,0]=3 67 B10R1.176 CSC1=CC=C(F)C(F)=C1 Z0048 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.176 CSC1=CC=C(F)C(O)=C1 Y3947 [0,1,0,0,0,0|2,0,0]=3 69 B8R1.18 CC1=CC(C)=C(C)S1 Z5478 [0,0,0,0,1,0|3,0,0]=4 70 B8R1.50 CC1=C(O)C(=O)CC1 5650AL [0,0,0,0,1,0|1,0,1]=3 71 B8R1.50 CC1=CSC(Br)=C1Br 4753AA [0,0,0,0,1,0|3,0,0]=4 72 B8R1.50 CC1=NNC(N)=C1Cl 5535AA [0,0,0,0,1,0|3,0,0]=4 73 B7R0.6 NC(=O)\C=C/C(N)=O 8173AL [1,0,1,0,0,0|2,0,0]=4 74 B7R1.3 ClC1=NC=CC=C1 7352AF [2,0,0,0,0,0|1,0,1]=4 75 B7R1.3 FC1=NC=CC=C1 7353AF [2,0,0,0,0,0|1,0,1]=4 76 B7R1.3 NC1=CC=CC=C1 2738AC [2,0,0,0,0,0|2,0,0]=4 77 B7R1.3 NC1=CC=CC=C1 5126AF [2,0,0,0,0,0|2,0,0]=4 78 B7R1.3 O=C1N=CC=CN1 9421AJ [2,0,0,0,0,0|1,0,0]=3 79 B7R1.3 OC1=CC=CC=C1 8781AL [2,0,0,0,0,0|1,0,0]=3 80 B9R1.1 CC1=CC=C(CN)C=N1 Y9493 [1,1,0,0,0,0|1,0,1]=4 81 B9R1.1 CC1=CC=C(N=O)C=C1 F922 [1,1,0,0,0,0|1,0,0]=3 82 B9R1.1 CC1=CC=C([Hg]Cl)C=C1 7857AF [1,1,0,0,0,0|2,0,0]=4 83 B9R1.1 CC1=CN=C(CCl)C=C1 1952AC [1,1,0,0,0,0|1,0,1]=4 84 B9R1.1 CC1=NC=C(CBr)C=C1 2397AC [1,1,0,0,0,0|1,0,1]=4 85 B9R1.1 CCC1=CN=C(C)C=C1 6769AL [1,1,0,0,0,0|1,0,1]=4 86 B9R1.1 CSC1=CN=C(F)C=C1 Y3574 [1,1,0,0,0,0|1,0,1]=4 87 B9R1.2 C=CC1=CN=CC(C)=C1 2455AL [1,1,0,0,0,0|1,0,1]=4 88 B9R1.2 CC1=CC(NN)=CC=C1 7665AB [1,1,0,0,0,0|2,0,0]=4 89 B9R1.3 OC1=C(Cl)C(Br)=CN=C1 4842AA [1,1,0,0,0,0|1,0,1]=4 90 B9R1.3 OC1=C(Cl)C(Cl)=CC=C1 7597AF [1,1,0,0,0,0|2,0,0]=4 91 B9R1.34 CC1=CC(F)=NC(O)=C1 X2037 [1,1,0,0,0,0|2,0,0]=4 92 B9R1.34 CC1=CC(O)=CC(=O)N1 7748AJ [1,1,0,0,0,0|2,0,0]=4 93 B9R1.34 CC1=CC(O)=CC(F)=N1 X2038 [1,1,0,0,0,0|2,0,0]=4 94 B9R1.15 CCC1=CN=CNC1=O 3205AJ [1,1,0,0,0,0|2,0,0]=4 95 B9R1.37 CC1OC(=O)C(O)=C1O 1519AE [0,1,0,0,1,0|1,0,1]=4 96 B11R1.14 COC1=CC(O)=C(C)C(C)=C1 4259AB [0,2,0,0,0,0|2,0,0]=4 97 B11R1.37 CC1=CC(C=O)=C(C=O)C=C1 9676AL [0,2,0,0,0,0|1,0,1]=4 98 B11R1.166 CC1=CC=C(B(O)O)C(O)=C1 2171AB [0,2,0,0,0,0|1,0,1]=4 99 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 Q197 [0,2,0,0,0,0|1,0,0]=3 100 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 7684AH [0,2,0,0,0,0|2,0,0]=4 101 B11R1.166 NC1=CC=C(C(=O)[O-])C(O)=C1 Q822 [0,2,0,0,0,0|2,0,0]=4 102 B11R1.277 CC1=CC(N=O)=C(C)C=C1O X5506 [0,2,0,0,0,0|2,0,0]=4 103 B11R1.277 CC1=CC(O)=C(C=O)C=C1Br 9930AL [0,2,0,0,0,0|1,0,0]=3 104 B11R1.277 CN1C=C(C#N)C(=O)NC1=O 9115AE [0,2,0,0,0,0|2,0,0]=4 105 B11R1.72 CC1=C(Cl)C(CO)=C(Br)C=C1 Z1574 [0,2,0,0,0,0|2,0,0]=4 106 B11R1.72 CC1=C(F)C(CO)=C(Br)C=C1 Z1577 [0,2,0,0,0,0|2,0,0]=4 107 B11R1.167 CC1=CN=C(F)C(C(C)O)=C1 Z1231 [0,2,0,0,0,0|1,0,1]=4 108 B11R1.167 CC1=CN=C(O)C(B(O)O)=C1 W9945 [0,2,0,0,0,0|0,0,2]=4 109 B9R1.21 O=CC1=COC(C=O)=C1 Y6580 [0,0,1,1,0,0|1,0,1]=4 110 B7R1.2 C=C1C=CC(=O)O1 1661AA [1,0,0,0,1,0|1,0,1]=4 111 B7R1.2 CC1=COC(C)=C1 Y6577 [1,0,0,0,1,0|2,0,0]=4 112 B7R1.15 O=C1C=C([O-])C1=O 8854AJ [0,0,0,0,2,0|1,0,1]=4