0 B10R2.7 C1=CC2=C(C=NN=C2)N1 Y3163 [0,0,0,0,0,0|3,0,1]=4 1 B10R2.7 C1=CC2=C(CC=C2)N=C1 2529AB [0,0,0,0,0,0|3,0,0]=3 2 B10R2.7 C1=CC2=CNC=C2C=C1 0763AP [0,0,0,0,0,0|3,0,0]=3 3 B10R2.7 C1=CC2=NN=CN2N=C1 Y3145 [0,0,0,0,0,0|4,0,0]=4 4 B10R2.7 C1=CC=C2NCNC2=C1 6469AB [0,0,0,0,0,0|1,0,2]=3 5 B10R2.7 C1=CN=C2NC=CC2=C1 7845AF [0,0,0,0,0,0|2,0,1]=3 6 B10R2.7 C1=CN=C2OC=CC2=C1 Y8520 [0,0,0,0,0,0|2,1,0]=3 7 B11R2.1 CC1C=CC2=C1C=CC=C2 1961AC [0,1,0,0,0,0|2,0,0]=3 8 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 6111AL [0,1,0,0,0,0|0,0,1]=2 9 B11R2.1 ClC1=CN=C2N=CC=CN12 4329AD [0,1,0,0,0,0|3,0,0]=4 10 B11R2.1 IC1=CNC2=C1C=CC=C2 2307AJ [0,1,0,0,0,0|1,0,1]=3 11 B11R2.1 NC1=CNC2=C1C=CC=C2 8737AE [0,1,0,0,0,0|1,0,1]=3 12 B11R2.1 N[C@@H]1CCC2=CC=CC=C21 0674AA [0,1,0,0,0,0|2,0,1]=4 13 B11R2.1 OC1=CSC2=CC=CC=C12 Z5532 [0,1,0,0,0,0|1,0,0]=2 14 B11R2.1 O[C@H]1CCC2=C1C=CC=C2 V1332 [0,1,0,0,0,0|2,0,1]=4 15 B11R2.10 BrC1=NN2C=CC=NC2=C1 Y1675 [0,1,0,0,0,0|3,0,0]=4 16 B11R2.10 CC1=CC2=C(C=CN=C2)N1 X9076 [0,1,0,0,0,0|2,0,1]=4 17 B11R2.10 CC1=CC2=C(C=NC=C2)S1 Y6380 [0,1,0,0,0,0|2,0,0]=3 18 B11R2.10 CC1=NC2=C(C=NC=C2)N1 1790AJ [0,1,0,0,0,0|2,0,0]=3 19 B11R2.10 CC1=NC2=CC=CC=C2[Se]1 E607 [0,1,0,0,0,0|0,1,0]=2 20 B11R2.10 ClC1=NC2=C(C=NC=C2)O1 5454AC [0,1,0,0,0,0|1,1,0]=3 21 B11R2.10 FC1=NC2=CC=CC=C2N1 Z6062 [0,1,0,0,0,0|1,0,0]=2 22 B11R2.10 NC1=CC2=C(C=CC=C2)O1 6755AA [0,1,0,0,0,0|1,1,0]=3 23 B11R2.10 NC1=NC2=CC=CN=C2O1 5177AC [0,1,0,0,0,0|1,1,0]=3 24 B11R2.10 [S-]C1=NC2=CC=CC=C2N1 V1484 [0,1,0,0,0,0|1,0,0]=2 25 B11R2.36 BrC1=CC2=C(C=C1)C=NS2 3952AC [0,1,0,0,0,0|2,0,0]=3 26 B11R2.36 CC1=CC2=C(C=C1)S[Zn]S2 9167AL [0,1,0,0,0,0|2,0,0]=3 27 B11R2.36 FC1=CC2=C(C=C1)OC=C2 1825AB [0,1,0,0,0,0|1,1,0]=3 28 B11R2.36 NC1=CC2=C(C=C1)OCO2 2287AB [0,1,0,0,0,0|1,1,1]=4 29 B11R2.36 NC1=CC2=NON=C2C=C1 1229AF [0,1,0,0,0,0|2,0,0]=3 30 B11R2.36 NC1=CC=C2NC=NC2=C1 5513AE [0,1,0,0,0,0|1,0,0]=2 31 B11R2.36 NC1=CN2C=CN=C2N=C1 4149AJ [0,1,0,0,0,0|3,0,0]=4 32 B11R2.36 OC1=CC=C2N=NSC2=C1 Y4044 [0,1,0,0,0,0|1,0,0]=2 33 B11R2.36 OC1=CC=C2SN=NC2=C1 Y4045 [0,1,0,0,0,0|1,0,0]=2 34 B11R2.106 BrC1=CC=CC2=NSN=C12 W4545 [0,1,0,0,0,0|2,0,0]=3 35 B11R2.106 CC1=CC=CC2=C1N=CS2 8174AJ [0,1,0,0,0,0|0,0,0]=1 36 B11R2.106 ClC1=CC=CC2=C1SC=N2 8294AJ [0,1,0,0,0,0|0,0,0]=1 37 B11R2.106 IC1=C2OCCC2=CC=C1 Y8502 [0,1,0,0,0,0|1,1,1]=4 38 B11R2.106 NC1=CC=CC2=NON=C12 Y4038 [0,1,0,0,0,0|2,0,0]=3 39 B11R2.106 NC1=NC=CC2=CC=NN21 4476AJ [0,1,0,0,0,0|3,0,0]=4 40 B11R2.106 OC1=CC=CC2=C1SC=N2 3829AJ [0,1,0,0,0,0|0,0,0]=1 41 B11R2.106 OC1=CC=CN2C=CN=C12 3471AL [0,1,0,0,0,0|2,0,0]=3 42 B11R2.106 SC1=C2N=CN=C2NC=N1 6004AH [0,1,0,0,0,0|3,0,0]=4 43 B11R2.106 [O-][N+]1=CC=CC2=C1NC=C2 3386AH [0,1,0,0,0,0|2,0,1]=4 44 B9R1.8 C\C=C\C1=NC=CC=C1 Y6273 [0,0,1,0,0,0|3,0,0]=4 45 B9R1.8 N#C[Se]C1=CC=CC=C1 7419AD [0,0,1,0,0,0|0,1,2]=4 46 B9R1.8 O=C=NC1=CC=CC=C1 9929AF [0,0,1,0,0,0|0,1,1]=3 47 B9R1.8 O\N=C\C1=CC=CC=C1 R588 [0,0,1,0,0,0|2,1,0]=4 48 B9R1.8 S=C=NC1=CC=NC=C1 3292AH [0,0,1,0,0,0|1,0,2]=4 49 B9R1.14 O=CC1=C(C=O)SC=N1 2465AE [0,0,1,0,0,0|2,0,0]=3 50 B9R1.15 CC1=C(NN)C=CC=C1 1069AL [0,0,1,0,0,0|2,0,1]=4 51 B9R1.15 CSC1=C(Br)C=CN=C1 Z1487 [0,0,1,0,0,0|2,0,1]=4 52 B9R1.15 CSC1=CC=CN=C1Cl Z0760 [0,0,1,0,0,0|2,0,1]=4 53 B9R1.15 N#CC1=C(S)C=CC=C1 Y1771 [0,0,1,0,0,0|2,0,0]=3 54 B9R1.15 N#[N+]C1=CC=CC=C1Cl T270 [0,0,1,0,0,0|2,0,1]=4 55 B9R2.3 C1=CC2=C(N=CS2)N1 3070AB [0,0,0,0,1,0|1,0,0]=2 56 B9R2.3 C1=CN2N=CC=C2N1 1981AB [0,0,0,0,1,0|3,0,0]=4 57 B9R2.3 C1=NC2=C(CNC2)S1 3032AJ [0,0,0,0,1,0|1,0,2]=4 58 B9R2.3 C1=NC2=C(CNC2)S1 3033AJ [0,0,0,0,1,0|1,0,2]=4 59 B11R2.20 C1=CC=C2SCCSC2=C1 6902AE [0,0,0,0,0,1|1,0,1]=3 60 B8R1.2 CNC1=CC=CC=C1 7883AF [1,0,1,0,0,0|0,0,2]=4 61 B8R1.2 NNC1=CC=CC=C1 5128AF [1,0,1,0,0,0|1,0,1]=4 62 B8R1.2 O=CC1=CC=NC=C1 7668AH [1,0,1,0,0,0|1,1,0]=4 63 B8R1.2 O=[IH2]C1=CC=CC=C1 X3757 [1,0,1,0,0,0|1,1,0]=4 64 B8R1.2 O[Hg]C1=CC=CC=C1 7647AF [1,0,1,0,0,0|1,1,0]=4 65 B8R1.5 ClC1=CC=CC=C1Cl 9816AF [1,0,1,0,0,0|2,0,0]=4 66 B8R1.5 NC1=C(S)C=NC=C1 7377AB [1,0,1,0,0,0|1,0,1]=4 67 B10R1.1 CC1=CC=C(CC=O)C=C1 U064 [0,1,1,0,0,0|1,1,0]=4 68 B10R1.1 O=CCC1=CC=C(O)C=C1 Y9945 [0,1,1,0,0,0|1,1,0]=4 69 B10R1.17 C=C\C=C\C1=CC=CC=C1 1673AL [0,1,1,0,0,0|2,0,0]=4 70 B10R1.17 CO\C=C\C1=CC=CC=C1 6472AB [0,1,1,0,0,0|1,1,0]=4 71 B10R1.18 NC(N)=NC1=CC=CC=C1 Y8090 [0,1,1,0,0,0|1,0,0]=3 72 B10R1.2 CSC1=C(O)C(F)=CC=C1 Z0334 [0,1,1,0,0,0|1,0,1]=4 73 B10R1.20 CSC1=CC=CC=C1C=O I066 [0,1,1,0,0,0|1,0,1]=4 74 B10R1.20 CSC1=CC=CC=C1CN Y9469 [0,1,1,0,0,0|0,0,2]=4 75 B10R1.20 SCC1=CC=CC=C1CS 0786AP [0,1,1,0,0,0|2,0,0]=4 76 B10R1.25 CC1=C(N=O)C=CC(O)=C1 7860AF [0,1,1,0,0,0|2,0,0]=4 77 B10R1.30 C=CC1=CC(Cl)=CC=C1Cl 1914AL [0,1,1,0,0,0|2,0,0]=4 78 B10R1.30 CSC1=CC(C)=CC=C1Cl Z1327 [0,1,1,0,0,0|1,0,1]=4 79 B10R1.30 CSC1=CC(C)=CC=C1F Z1248 [0,1,1,0,0,0|1,0,1]=4 80 B10R1.30 CSC1=CC(I)=CC=C1Br Y3558 [0,1,1,0,0,0|1,0,1]=4 81 B10R1.245 C=CC1=C(C)C=CC=C1C Y8170 [0,1,1,0,0,0|2,0,0]=4 82 B10R1.245 CSC1=C(Br)C=CC=C1Br Z0491 [0,1,1,0,0,0|1,0,1]=4 83 B10R1.245 CSC1=C(Cl)C=CC=C1Br Z1315 [0,1,1,0,0,0|1,0,1]=4 84 B12R2.1041 BrC1=NC2=CC=CC=CC2=C1 Y6430 [0,1,0,0,0,1|1,0,0]=3 85 B12R2.1041 O=C1C=C2C=CC=CC=C2N1 Y6126 [0,1,0,0,0,1|1,0,1]=4 86 B12R2.24 CC1=CC2=C(C=C1)N=NC=C2 3487AB [0,1,0,0,0,1|1,0,0]=3 87 B12R2.24 CC1=CC=C2C=CN=CC2=C1 7738AB [0,1,0,0,0,1|1,0,0]=3 88 B12R2.24 ClC1=NN=C2C=CC=CC2=C1 5859AJ [0,1,0,0,0,1|1,0,0]=3 89 B12R2.24 FC1=CC2=C(C=CC=N2)N=C1 2273AJ [0,1,0,0,0,1|2,0,0]=4 90 B12R2.24 IC1=CC2=CC=CC=C2C=N1 Y5506 [0,1,0,0,0,1|1,0,0]=3 91 B12R2.24 NC1=CC2=C(C=CN=N2)C=C1 0380AA [0,1,0,0,0,1|1,0,0]=3 92 B12R2.24 OC1=CC2=C(C=CC=N2)C=C1 3083AL [0,1,0,0,0,1|1,0,0]=3 93 B12R2.24 OC1=CC2=CC=CC=C2C=N1 W8331 [0,1,0,0,0,1|1,0,0]=3 94 B12R2.1081 BrC1=CC=CC2=C1C=CN=N2 1774AB [0,1,0,0,0,1|1,0,0]=3 95 B12R2.1081 BrC1=CC=NC2=NC=CC=C12 7902AB [0,1,0,0,0,1|2,0,0]=4 96 B12R2.1081 CC1=CC=CC2=C1C=CN=C2 9523AB [0,1,0,0,0,1|1,0,0]=3 97 B12R2.1081 CC1=CN=NC2=C1C=CC=C2 7316AA [0,1,0,0,0,1|1,0,0]=3 98 B12R2.1081 ClC1=CC=CC2=C1N=CN=C2 1743AC [0,1,0,0,0,1|1,0,0]=3 99 B12R2.1081 NC1=C2N=CC=NC2=CC=C1 8405AA [0,1,0,0,0,1|1,0,0]=3 100 B12R2.1081 NC1=CC=CC2=C1C=CN=C2 V3480 [0,1,0,0,0,1|1,0,0]=3 101 B12R2.1 NCC1=CNC2=C1C=CC=C2 W4590 [0,2,0,0,0,0|1,0,1]=4 102 B12R2.1 OCC1=CNC2=CC=CC=C12 2717AD [0,2,0,0,0,0|1,0,1]=4 103 B12R2.1 OCC1=CSC2=CC=CC=C12 Y9385 [0,2,0,0,0,0|1,0,0]=3 104 B12R2.18 BrC1=C(Br)C2=CC=CC=C2O1 Z2437 [0,2,0,0,0,0|1,1,0]=4 105 B12R2.18 CC1=C(N)C2=C(C=NC=C2)S1 Y5970 [0,2,0,0,0,0|2,0,0]=4 106 B12R2.18 CN1C(=S)OC2=CC=CC=C21 Y7468 [0,2,0,0,0,0|0,1,1]=4 107 B12R2.18 O=C1OC2=C(C=CC=C2)C1=O 6525AJ [0,2,0,0,0,0|1,1,0]=4 108 B12R2.196 NC1=C2NC=C(Br)C2=CC=C1 2179AJ [0,2,0,0,0,0|1,0,1]=4 109 B12R2.196 NC1=C2OC=C(Cl)C2=CC=C1 Y8928 [0,2,0,0,0,0|1,1,0]=4 110 B12R2.203 ClC1=C2C(Br)=CNC2=CC=C1 2959AA [0,2,0,0,0,0|1,0,1]=4 111 B12R2.612 FC1=CC2=C(C=C1)C(Br)=CN2 1860AA [0,2,0,0,0,0|1,0,1]=4 112 B12R2.32 ClCC1=NC2=CC=CN=C2O1 Y7014 [0,2,0,0,0,0|1,1,0]=4 113 B12R2.32 NCC1=NC2=CC=CC=C2S1 Y8582 [0,2,0,0,0,0|0,0,0]=2 114 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 8732AD [0,2,0,0,0,0|1,1,0]=4 115 B12R2.202 CC1=CN2C=CC=C(N)C2=N1 N046 [0,2,0,0,0,0|2,0,0]=4 116 B12R2.202 NC1=NC2=C(C=CC=C2Cl)S1 7832AF [0,2,0,0,0,0|0,0,0]=2 117 B12R2.606 ClC1=NC2=CC(Br)=CC=C2N1 V7275 [0,2,0,0,0,0|1,0,0]=3 118 B12R2.606 NC1=NC2=C(C=C(Cl)C=C2)S1 9273AB [0,2,0,0,0,0|0,0,0]=2 119 B12R2.44 NCC1=CC2=NON=C2C=C1 8435AH [0,2,0,0,0,0|2,0,0]=4 120 B12R2.44 OCC1=CC2=C(C=CN2)C=C1 Z7180 [0,2,0,0,0,0|1,0,1]=4 121 B12R2.82 CC1=C(C)C2=C(C=C1)SC=N2 8113AJ [0,2,0,0,0,0|0,0,0]=2 122 B12R2.82 ClC1=CC=C2N=CSC2=C1Cl 8246AJ [0,2,0,0,0,0|0,0,0]=2 123 B12R2.100 CC1=C(N)C=C2C=CNC2=C1 Y1632 [0,2,0,0,0,0|1,0,1]=4 124 B12R2.100 CC1=CC2=NC=NN2C=C1Br 2812AA [0,2,0,0,0,0|2,0,0]=4 125 B12R2.246 CC1=C2NC=CC2=CC(N)=C1 Y1634 [0,2,0,0,0,0|1,0,1]=4 126 B12R2.246 CC1=CC(C)=C2N=CSC2=C1 8118AJ [0,2,0,0,0,0|0,0,0]=2 127 B12R2.246 ClC1=CC(Cl)=C2SC=NC2=C1 8212AJ [0,2,0,0,0,0|0,0,0]=2 128 B12R2.246 ClC1=CC2=C(N=CS2)C(Cl)=C1 8114AJ [0,2,0,0,0,0|0,0,0]=2 129 B12R2.246 FC1=CC(F)=C2N=CSC2=C1 8116AJ [0,2,0,0,0,0|0,0,0]=2 130 B12R2.246 FC1=CC(F)=C2SC=NC2=C1 8214AJ [0,2,0,0,0,0|0,0,0]=2 131 B12R2.246 OC1=CC(Cl)=CN2C=CN=C12 9725AL [0,2,0,0,0,0|2,0,0]=4 132 B12R2.221 FC1=C2N=CSC2=C(F)C=C1 8120AJ [0,2,0,0,0,0|0,0,0]=2 133 B12R2.315 NCC1=CC=CC2=C1C=CS2 5989AJ [0,2,0,0,0,0|1,0,0]=3