0 B6R1.2 C1=C(C=NN1)I R000V0 [0,0,0,0,0,0|1,0,0]=1 1 B7R1.1 C#CC1=CSC=C1 R00199 [0,1,0,0,0,0|2,0,1]=4 2 B7R1.1 C1=C(NC=N1)C#N R0012S [0,1,0,0,0,0|2,0,1]=4 3 B7R1.2 CN1C=CC(=N1)I R0012Q [0,1,0,0,0,0|3,0,0]=4 4 B7R1.3 C1=CC(=CN=C1)Br R0016G [0,0,0,0,0,1|2,0,0]=3 5 B7R1.3 C1=CC(=CN=C1)N R0016C [0,0,0,0,0,1|2,0,0]=3 6 B7R1.3 C1=CC(=CN=C1)O R0016E [0,0,0,0,0,1|2,0,0]=3 7 B7R1.3 C1=CC=C(C=C1)Br R0018D [0,0,0,0,0,1|3,0,0]=4 8 B7R1.3 C1=CC=NC(=C1)Br R0014G [0,0,0,0,0,1|3,0,0]=4 9 B7R1.3 C1=CC=NC(=C1)F R0014K [0,0,0,0,0,1|3,0,0]=4 10 B7R1.3 C1=CC=NC(=C1)N R0014J [0,0,0,0,0,1|3,0,0]=4 11 B7R1.3 C1=CN=CC=C1Br R00187 [0,0,0,0,0,1|2,0,0]=3 12 B7R1.3 C1=CN=CC=C1N R00183 [0,0,0,0,0,1|2,0,0]=3 13 B7R1.3 C1=CNC=CC1=O R00185 [0,0,0,0,0,1|2,0,0]=3 14 B7R1.3 CC1=CC=CC=N1 R000XX [0,0,0,0,0,1|2,0,0]=3 15 B7R1.3 CC1=CC=NC=C1 R00184 [0,0,0,0,0,1|1,0,0]=2 16 B7R1.3 CC1=CN=CC=C1 R0016F [0,0,0,0,0,1|1,0,0]=2 17 B4R0.1 CC(=O)NC R000SZ [1,0,1,0,0,0|2,0,0]=4 18 B8R1.2 C1=CC(=CN=C1)C#N R0016D [0,1,0,0,0,1|1,0,1]=4 19 B8R1.2 C1=CC(=CN=C1)CCl R00167 [0,1,0,0,0,1|1,0,0]=3 20 B8R1.2 C1=CC=NC(=C1)CCl R0011I [0,1,0,0,0,1|2,0,0]=4 21 B8R1.2 C1=CC=NC(=C1)CO R000W3 [0,1,0,0,0,1|2,0,0]=4 22 B8R1.2 C1=CN=CC=C1C#N R00182 [0,1,0,0,0,1|1,0,1]=4 23 B8R1.2 C1=CN=CC=C1CCl R00181 [0,1,0,0,0,1|1,0,0]=3 24 B8R1.2 C1=CN=CC=C1CO R00180 [0,1,0,0,0,1|1,0,0]=3 25 B8R1.2 COC1=CC=CC=N1 R0011W [0,1,0,0,0,1|2,0,0]=4 26 B8R1.3 C1=CC(=NC=C1Br)Br R0014P [0,1,0,0,0,1|2,0,0]=4 27 B8R1.3 C1=CC(=NC=C1Br)N R0014N [0,1,0,0,0,1|2,0,0]=4 28 B8R1.3 C1=CC(=NC=C1Cl)N R0014O [0,1,0,0,0,1|2,0,0]=4 29 B8R1.3 C1=CC(=NC=C1F)N R0017T [0,1,0,0,0,1|2,0,0]=4 30 B8R1.3 CC1=CN=C(C=C1)Br R00124 [0,1,0,0,0,1|1,0,0]=3 31 B8R1.3 CC1=CN=C(C=C1)Cl R00129 [0,1,0,0,0,1|1,0,0]=3 32 B8R1.3 CC1=CN=C(C=C1)F R0015W [0,1,0,0,0,1|1,0,0]=3 33 B8R1.3 CC1=CN=C(C=C1)N R0011Z [0,1,0,0,0,1|1,0,0]=3 34 B8R1.3 CC1=NC=C(C=C1)Br R00108 [0,1,0,0,0,1|2,0,0]=4 35 B8R1.3 CC1=NC=C(C=C1)Br R001C3 [0,1,0,0,0,1|2,0,0]=4 36 B8R1.4 C1=CN=C(C=C1Cl)N R0017L [0,1,0,0,0,1|2,0,0]=4 37 B8R1.4 C1=CNC(=O)NC1=O R000VZ [0,1,0,0,0,1|2,0,0]=4 38 B8R1.4 CC1=CC(=CN=C1)C R0016B [0,1,0,0,0,1|1,0,0]=3 39 B8R1.4 CC1=CC(=NC=C1)Br R00123 [0,1,0,0,0,1|1,0,0]=3 40 B8R1.4 CC1=CC(=NC=C1)Cl R00119 [0,1,0,0,0,1|1,0,0]=3 41 B8R1.4 CC1=CC(=NC=C1)Cl R00128 [0,1,0,0,0,1|1,0,0]=3 42 B8R1.4 CC1=CC(=NC=C1)F R0015V [0,1,0,0,0,1|1,0,0]=3 43 B8R1.4 CC1=CC(=NC=C1)N R00120 [0,1,0,0,0,1|1,0,0]=3 44 B8R1.4 CC1=CC(=O)NC=C1 R0011U [0,1,0,0,0,1|1,0,0]=3 45 B8R1.4 CC1=CC=CC(=O)N1 R0011V [0,1,0,0,0,1|2,0,0]=4 46 B8R1.4 CC1=C[N+](=CC=C1)[O-] R00165 [0,1,0,0,0,1|1,0,1]=4 47 B8R1.4 CC1=NC(=CC=C1)Br R00125 [0,1,0,0,0,1|2,0,0]=4 48 B8R1.4 CC1=NC(=CC=C1)C R0012C [0,1,0,0,0,1|2,0,0]=4 49 B8R1.4 CC1=NC(=CC=C1)Cl R0012A [0,1,0,0,0,1|2,0,0]=4 50 B8R1.4 CC1=NC(=CC=C1)F R0015X [0,1,0,0,0,1|2,0,0]=4 51 B8R1.4 CC1=NC(=CC=C1)N R0011Y [0,1,0,0,0,1|2,0,0]=4 52 B8R1.4 CC1=NC=CC(=C1)Br R0011Q [0,1,0,0,0,1|2,0,0]=4 53 B8R1.4 CC1=NC=CC(=C1)Cl R0011S [0,1,0,0,0,1|2,0,0]=4 54 B8R1.4 CC1=NC=CC(=C1)F R0011T [0,1,0,0,0,1|2,0,0]=4 55 B8R1.4 CC1=NC=CC(=C1)N R0011P [0,1,0,0,0,1|2,0,0]=4 56 B8R1.5 C1=CC(=C(N=C1)Cl)Cl R0012G [0,1,0,0,0,1|2,0,0]=4 57 B8R1.5 C1=CC(=C(N=C1)Cl)O R00149 [0,1,0,0,0,1|2,0,0]=4 58 B8R1.5 CC1=C(C=CC=N1)O R0017W [0,1,0,0,0,1|2,0,0]=4 59 B8R1.5 CC1=C(C=NC=C1)Br R0016S [0,1,0,0,0,1|1,0,0]=3 60 B8R1.5 CC1=C(N=CC=C1)Br R00122 [0,1,0,0,0,1|1,0,0]=3 61 B8R1.5 CC1=C(N=CC=C1)Cl R00127 [0,1,0,0,0,1|1,0,0]=3 62 B8R1.5 CC1=C(N=CC=C1)F R0015U [0,1,0,0,0,1|1,0,0]=3 63 B8R1.5 CC1=C(N=CC=C1)N R00121 [0,1,0,0,0,1|1,0,0]=3 64 B8R1.5 CC1=CC=CC=[N+]1[O-] R0011M [0,1,0,0,0,1|2,0,0]=4 65 B6R1.1 C1=CC=NC=C1 R00192 [0,0,1,1,0,0|1,0,1]=4