0 B9R1.8 C1=CC=C(C=C1)CC#N R0018U [0,0,0,0,0,0|0,0,2]=2 1 B9R1.8 C1=CC=NC(=C1)CC#N R0011B [0,0,0,0,0,0|1,0,2]=3 2 B9R1.8 C1=CN=CC=C1CC#N R0017Z [0,0,0,0,0,0|1,0,2]=3 3 B9R1.8 COCC1=CC=CC=N1 R0011X [0,0,0,0,0,0|3,0,0]=3 4 B8R1.2 C1=CC(=CN=C1)C#N R0016D [1,0,0,0,0,0|1,0,2]=4 5 B8R1.2 C1=CC(=CN=C1)CCl R00167 [1,0,0,0,0,0|2,0,0]=3 6 B8R1.2 C1=CC=NC(=C1)C#N R000WD [1,0,0,0,0,0|1,0,2]=4 7 B8R1.2 C1=CC=NC(=C1)C=O R000XZ [1,0,0,0,0,0|2,0,1]=4 8 B8R1.2 C1=CC=NC(=C1)CCl R0011I [1,0,0,0,0,0|2,0,0]=3 9 B8R1.2 C1=CC=NC(=C1)CO R000W3 [1,0,0,0,0,0|2,0,0]=3 10 B8R1.2 C1=CN=C(N=C1)NN R000S3 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.2 C1=CN=CC=C1C#N R00182 [1,0,0,0,0,0|1,0,2]=4 12 B8R1.2 C1=CN=CC=C1CCl R00181 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.2 C1=CN=CC=C1CO R00180 [1,0,0,0,0,0|2,0,0]=3 14 B8R1.2 COC1=CC=CC=N1 R0011W [1,0,0,0,0,0|2,0,0]=3 15 B10R1.1 C1=CC(=CC=C1CC#N)Cl R001AU [0,1,0,0,0,0|0,0,2]=3 16 B10R1.1 C1=CC(=CC=C1CCO)Cl R001AV [0,1,0,0,0,0|1,0,0]=2 17 B10R1.1 C1=CC(=NC=C1CC#N)Cl R001BT [0,1,0,0,0,0|1,0,2]=4 18 B10R1.4 C1=CC=C(C(=C1)CCO)Cl R001AY [0,1,0,0,0,0|1,0,0]=2 19 B10R1.15 C#CC(C1=CC=CC=C1)O R0018L [0,1,0,0,0,0|1,0,1]=3 20 B10R1.15 C1=CC=C(C=C1)[C@@H](CO)N R000UJ [0,1,0,0,0,0|1,0,0]=2 21 B10R1.15 C1=CC=C(C=C1)[C@H](CO)N R000UK [0,1,0,0,0,0|1,0,0]=2 22 B10R1.15 CCC(=O)C1=CC=CC=C1 R001AL [0,1,0,0,0,0|1,0,1]=3 23 B10R1.18 C1=CC=NC(=C1)CC(=O)O R0011E [0,1,0,0,0,0|2,0,1]=4 24 B10R2.7 C1=CC=C2C(=C1)C=CN2 R001A3 [0,0,0,1,0,0|0,0,2]=3 25 B10R2.7 C1CC2=C(C1)N=CC=C2 R000YV [0,0,0,1,0,0|2,0,0]=3 26 B7R1.3 C1=CC(=CN=C1)Br R0016G [2,0,0,0,0,0|2,0,0]=4 27 B7R1.3 C1=CC(=CN=C1)N R0016C [2,0,0,0,0,0|1,0,0]=3 28 B7R1.3 C1=CC(=CN=C1)O R0016E [2,0,0,0,0,0|2,0,0]=4 29 B7R1.3 C1=CC=C(C=C1)Br R0018D [2,0,0,0,0,0|1,0,0]=3 30 B7R1.3 C1=CC=NC(=C1)Br R0014G [2,0,0,0,0,0|2,0,0]=4 31 B7R1.3 C1=CC=NC(=C1)F R0014K [2,0,0,0,0,0|2,0,0]=4 32 B7R1.3 C1=CC=NC(=C1)N R0014J [2,0,0,0,0,0|1,0,0]=3 33 B7R1.3 C1=CN=CC=C1Br R00187 [2,0,0,0,0,0|2,0,0]=4 34 B7R1.3 C1=CN=CC=C1N R00183 [2,0,0,0,0,0|1,0,0]=3 35 B7R1.3 C1=CNC=CC1=O R00185 [2,0,0,0,0,0|2,0,0]=4 36 B7R1.3 CC1=CC=CC=N1 R000XX [2,0,0,0,0,0|1,0,0]=3 37 B7R1.3 CC1=CC=NC=C1 R00184 [2,0,0,0,0,0|1,0,0]=3 38 B7R1.3 CC1=CN=CC=C1 R0016F [2,0,0,0,0,0|1,0,0]=3 39 B9R1.1 C#CC1=CC=C(C=C1)Br R0017K [1,1,0,0,0,0|0,0,2]=4 40 B9R1.1 C#CC1=CC=C(C=C1)N R00144 [1,1,0,0,0,0|0,0,2]=4 41 B9R1.1 C1=CC(=CC=C1CO)Cl R001B3 [1,1,0,0,0,0|1,0,0]=3 42 B9R1.1 C1=CC(=NC=C1Br)CO R001C1 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.1 CNC1=CC=C(C=C1)Br R000T0 [1,1,0,0,0,0|1,0,0]=3 44 B9R1.1 COC1=CC=C(C=C1)N R000UY [1,1,0,0,0,0|1,0,0]=3 45 B9R1.2 C1=CC(=CC(=C1)Cl)CCl R00171 [1,1,0,0,0,0|1,0,0]=3 46 B9R1.2 C1=CC(=CC(=C1)O)C=O R000SR [1,1,0,0,0,0|1,0,1]=4 47 B9R1.2 C1=CN=C(C=C1CO)Cl R00147 [1,1,0,0,0,0|2,0,0]=4 48 B9R1.2 CC1=NC(=CC=C1)CCl R0014F [1,1,0,0,0,0|2,0,0]=4 49 B9R1.2 CC1=NC(=CC=C1)CO R001BE [1,1,0,0,0,0|2,0,0]=4 50 B9R1.2 COC1=CC(=CC=C1)Cl R0011C [1,1,0,0,0,0|1,0,0]=3 51 B9R1.2 COC1=CC(=CC=C1)F R000SE [1,1,0,0,0,0|1,0,0]=3 52 B9R1.6 B(C1=CC=CC=C1)(O)O R000VC [1,1,0,0,0,0|2,0,0]=4 53 B9R1.6 CC(=O)C1=CC=CC=N1 R0014L [1,1,0,0,0,0|1,0,1]=4 54 B9R1.6 CC(=O)C1=CC=NC=C1 R00186 [1,1,0,0,0,0|1,0,1]=4 55 B9R1.6 CC(=O)C1=CN=CC=C1 R0016Z [1,1,0,0,0,0|1,0,1]=4 56 B9R1.6 C[Si](C)C1=CC=CC=C1 R0017M [1,1,0,0,0,0|0,1,0]=3 57 B9R1.15 C1=CC(=C(N=C1)Cl)CO R000YG [1,1,0,0,0,0|2,0,0]=4 58 B9R1.15 C1=CC=C(C(=C1)C#N)Cl R001A4 [1,1,0,0,0,0|0,0,2]=4 59 B9R1.15 C1=CC=C(C(=C1)CO)Cl R001B5 [1,1,0,0,0,0|1,0,0]=3 60 B9R1.15 COC1=CC=CC=C1N R000UV [1,1,0,0,0,0|1,0,0]=3 61 B11R1.20 C1=CC(=CC=C1CC(=O)O)Cl R001AW [0,2,0,0,0,0|1,0,1]=4 62 B11R1.22 CCC(=O)C1=CC=C(C=C1)O R001AM [0,2,0,0,0,0|1,0,1]=4 63 B11R1.86 C1=CC=C(C(=C1)CC(=O)O)Cl R001B1 [0,2,0,0,0,0|1,0,1]=4 64 B11R1.36 CC(C1=CC=CC=C1)C(=O)O R0014U [0,2,0,0,0,0|1,0,1]=4 65 B11R1.28 C1=CC=C(C=C1)COCCBr R000WU [0,2,0,0,0,0|1,0,0]=3 66 B11R1.40 C1=CC=C(C=C1)C[C@@H](CO)N R000US [0,2,0,0,0,0|0,0,0]=2 67 B11R1.40 C1=CC=C(C=C1)C[C@H](CO)N R000UR [0,2,0,0,0,0|0,0,0]=2 68 B11R1.40 C1=CC=C(C=C1)OC(=O)CBr R000V6 [0,2,0,0,0,0|1,0,1]=4 69 B11R2.10 C1=CC=C2C(=C1)NC(=N2)N R0015S [0,1,0,1,0,0|1,0,1]=4 70 B11R2.10 C1=CC=C2C(=C1)NC(=O)N2 R000YD [0,1,0,1,0,0|1,0,1]=4 71 B11R2.20 C1CNCC2=CC=CC=C21 R000SX [0,1,0,1,0,0|0,0,0]=2 72 B11R2.20 C1CNCC2=CC=CC=C21 R000TN [0,1,0,1,0,0|0,0,0]=2