0 B9R1.23 CC1=C(C)OC(C=O)=C1 2H15-1-06 [0,0,0,0,0,0|2,0,1]=3 1 B9R1.23 CC1=CC(CO)=NN1C 4H01-1-W4 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.23 CCN1C=C(N)C(C)=N1 3H30-5-W6 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.1 CC1=CC(CBr)=NO1 4H56-9-Q5 [1,0,0,0,0,0|3,0,0]=4 4 B8R1.1 CC1=CC(CCl)=NO1 4H56-5-X9 [1,0,0,0,0,0|3,0,0]=4 5 B8R1.1 CC1=CC(CO)=NO1 4H56-1-WH [1,0,0,0,0,0|3,0,0]=4 6 B8R1.1 CC1=CC=C(CN)S1 7H30-5-X2 [1,0,0,0,0,0|2,1,0]=4 7 B8R1.1 CC1=CC=C(CO)O1 2H01-1-X2 [1,0,0,0,0,0|2,0,0]=3 8 B8R1.1 CC1=CSC(C=O)=N1 8H70-1-M1 [1,0,0,0,0,0|1,1,1]=4 9 B8R1.1 CC1=CSC(CO)=N1 8H70-1-M2 [1,0,0,0,0,0|1,1,0]=3 10 B8R1.1 CC1=NC(CCl)=CS1 7H70-5-Y7 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.1 CC1=NC(CCl)=CS1 7H70-5-Z8 [1,0,0,0,0,0|3,0,0]=4 12 B8R1.1 CC1=NOC(CBr)=C1 4H44-9-X1 [1,0,0,0,0,0|3,0,0]=4 13 B8R1.1 CCN1C=C(Br)C=N1 3H32-9-4B [1,0,0,0,0,0|3,0,0]=4 14 B8R1.1 CCN1C=C(I)C=N1 3H32-H-0L [1,0,0,0,0,0|3,0,0]=4 15 B8R1.1 CCN1C=CC(N)=N1 3H30-1-KJ [1,0,0,0,0,0|3,0,0]=4 16 B8R1.1 CN1C=CC(CCl)=N1 3H32-5-H3 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.1 CN1C=CC(CCl)=N1 3H32-5-N6 [1,0,0,0,0,0|3,0,0]=4 18 B8R1.1 CN1C=CC(CN)=N1 3H30-1-L6 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.1 CN1C=CC(CO)=N1 4H01-1-Y4 [1,0,0,0,0,0|3,0,0]=4 20 B8R1.1 CN1C=NC(CO)=N1 4H56-1-920 [1,0,0,0,0,0|3,0,0]=4 21 B8R1.1 COC1=NC(Br)=CS1 8H70-1-N8 [1,0,0,0,0,0|2,1,0]=4 22 B8R1.1 COC1=NC=C(Br)S1 8H70-9-X8 [1,0,0,0,0,0|2,1,0]=4 23 B8R1.1 CSC1=NC(Br)=CS1 5H70-9-X6 [1,0,0,0,0,0|2,1,0]=4 24 B8R1.18 CC1=C(Br)SC(Br)=N1 7H70-9-Z8 [1,0,0,0,0,0|2,1,0]=4 25 B8R1.18 CC1=C(Br)SC(N)=N1 7H30-D-02 [1,0,0,0,0,0|2,1,0]=4 26 B8R1.18 CC1=C(C)SC(N)=N1 7H70-1-Y3 [1,0,0,0,0,0|1,1,0]=3 27 B8R1.18 CC1=C(C)SC(N)=N1 7H70-5-74 [1,0,0,0,0,0|1,1,0]=3 28 B8R1.18 CC1=C(Cl)SC(N)=N1 7H30-5-X0 [1,0,0,0,0,0|2,1,0]=4 29 B8R1.18 CC1=CC(=O)OC1=O 2H26-1-Y0 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.18 CC1=CC(C)=NN1C 3H32-1-52 [1,0,0,0,0,0|2,0,0]=3 31 B8R1.18 CC1=NC(Br)=CN1C 3H32-9-54 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.18 CC1=NC(C)=C(Br)S1 7H70-9-X2 [1,0,0,0,0,0|1,1,0]=3 33 B8R1.18 CC1=NC(I)=C(I)N1 3H32-H-40 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.18 CC1=NN(C)C(=O)C1 4H48-1-U6 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.18 CC1=NN(C)C(Br)=C1 3H32-9-91 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.18 CC1=NN(C)C(N)=C1 3H30-1-P8 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.18 CC1=NN(C)C=C1Br 3H32-9-CQ [1,0,0,0,0,0|3,0,0]=4 38 B8R1.18 CC1=NN(C)C=C1N 3H30-1-95 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.35 CCC1=NC(C)=C(C=O)N1 4H15-1-U7 [0,1,0,0,0,0|1,0,1]=3 40 B8R0.19 CCC(=O)OC(=O)CC 2126-1-03 [0,0,1,0,0,0|2,0,1]=4 41 B10R1.8 CC1=CC(C)=CC(CBr)=C1 1700-9-X0 [0,0,0,0,0,1|3,0,0]=4 42 B10R1.8 CC1=CC(C)=CC(CN)=C1 3730-1-21 [0,0,0,0,0,1|3,0,0]=4 43 B10R1.8 CC1=CC(C)=NC(C#N)=N1 3H37-1-Y6 [0,0,0,0,0,1|2,0,1]=4 44 B10R1.8 CC1=CC(C)=NC(CBr)=C1 3H32-9-J5 [0,0,0,0,0,1|2,0,0]=3 45 B10R1.8 CC1=CC(NN)=NC(C)=N1 3H39-1-X8 [0,0,0,0,0,1|3,0,0]=4 46 B10R1.8 CCC1=CC(O)=NC(N)=N1 4H56-1-7Q [0,0,0,0,0,1|3,0,0]=4 47 B10R1.8 COC1=CC(C)=CC(C)=C1 2707-1-X5 [0,0,0,0,0,1|3,0,0]=4 48 B10R1.8 COC1=NC(C)=NC(N)=N1 4H30-1-56 [0,0,0,0,0,1|3,0,0]=4 49 B10R1.8 CSC1=CC(Cl)=NC(C)=N1 7H66-5-52 [0,0,0,0,0,1|3,0,0]=4 50 B10R1.8 CSC1=NC(=O)C=C(C)N1 8H66-1-04 [0,0,0,0,0,1|3,0,0]=4 51 B10R1.8 CSC1=NC(C)=CC(C)=N1 7H66-1-01 [0,0,0,0,0,1|2,0,0]=3 52 B10R1.8 CSC1=NC(C)=CC(Cl)=N1 7H66-5-04 [0,0,0,0,0,1|3,0,0]=4 53 B10R1.8 CSC1=NC(C)=CC(I)=N1 7H66-H-X2 [0,0,0,0,0,1|3,0,0]=4 54 B10R1.176 CC1=CC=C(CCl)C=C1C 1700-1-06 [0,0,0,0,0,1|3,0,0]=4 55 B10R1.176 CC1=CC=C(CN)C=C1C 3730-1-20 [0,0,0,0,0,1|3,0,0]=4 56 B10R1.176 CC1=CC=C(CO)C=C1C 2701-1-12 [0,0,0,0,0,1|3,0,0]=4 57 B10R1.176 COC1=CC(C)=C(N)C=N1 4H31-1-18 [0,0,0,0,0,1|3,0,0]=4 58 B10R1.176 COC1=CC=C(Br)C(C)=N1 4H07-9-Y1 [0,0,0,0,0,1|3,0,0]=4 59 B10R1.176 COC1=NC=C(Br)C(C)=C1 4H07-9-06 [0,0,0,0,0,1|3,0,0]=4 60 B7R0.5 CCOC(=O)C(C)=O 2129-1-01 [1,0,1,0,0,0|2,0,0]=4 61 B7R1.1 CCC1=CC=CN1 3H32-1-48 [2,0,0,0,0,0|1,0,1]=4 62 B7R1.1 CCC1=CC=CO1 2H10-1-17 [2,0,0,0,0,0|1,0,0]=3 63 B7R1.1 COC1=NC=CS1 8H70-1-81 [2,0,0,0,0,0|1,1,0]=4 64 B7R1.1 CSC1=NC=CS1 7H66-1-0U [2,0,0,0,0,0|1,1,0]=4 65 B7R1.1 NCC1=CC=CO1 4H56-1-1H [2,0,0,0,0,0|2,0,0]=4 66 B7R1.1 NCC1=NC=CN1 3H30-1-55 [2,0,0,0,0,0|2,0,0]=4 67 B7R1.1 NCC1=NC=CN1 3H30-5-16 [2,0,0,0,0,0|2,0,0]=4 68 B7R1.1 NCC1=NC=CS1 7H30-1-Y5 [2,0,0,0,0,0|1,1,0]=4 69 B7R1.1 NCC1=NC=CS1 7H30-7-X0 [2,0,0,0,0,0|1,1,0]=4 70 B7R1.1 OCC1=CC=CO1 2H01-1-16 [2,0,0,0,0,0|2,0,0]=4 71 B7R1.1 OCC1=NC=CS1 8H01-1-X5 [2,0,0,0,0,0|1,1,0]=4 72 B7R1.2 CC1=CC(C)=NN1 3H31-1-X3 [2,0,0,0,0,0|2,0,0]=4 73 B7R1.2 CC1=CC(C)=NO1 4H44-1-44 [2,0,0,0,0,0|2,0,0]=4 74 B7R1.2 CC1=CC=C(C)O1 2H10-1-X9 [2,0,0,0,0,0|1,0,0]=3 75 B7R1.2 CC1=CC=C(C)S1 5H66-1-X3 [2,0,0,0,0,0|1,1,0]=4 76 B7R1.2 CC1=CN=C(Br)S1 7H70-9-33 [2,0,0,0,0,0|1,1,0]=4 77 B7R1.2 CC1=CN=C(C)S1 7H66-1-X4 [2,0,0,0,0,0|0,1,0]=3 78 B7R1.2 CC1=CN=C(N)S1 7H30-1-W3 [2,0,0,0,0,0|1,1,0]=4 79 B7R1.2 CC1=CNC(C)=N1 3H31-1-Y7 [2,0,0,0,0,0|1,0,0]=3 80 B7R1.2 CC1=CSC(Br)=N1 P612-A-22 [2,0,0,0,0,0|1,1,0]=4 81 B7R1.2 CC1=CSC(C)=N1 7H70-1-1M [2,0,0,0,0,0|0,1,0]=3 82 B7R1.2 CC1=CSC(N)=N1 7H70-1-W9 [2,0,0,0,0,0|1,1,0]=4 83 B7R1.2 CC1=CSC(S)=N1 7H61-1-X4 [2,0,0,0,0,0|1,1,0]=4 84 B7R1.2 CC1=NC(Br)=CN1 3H32-9-G9 [2,0,0,0,0,0|2,0,0]=4 85 B7R1.2 CC1=NC(Br)=CS1 7H70-9-Z7 [2,0,0,0,0,0|1,1,0]=4 86 B7R1.2 CC1=NC(I)=CN1 3H31-H-12 [2,0,0,0,0,0|2,0,0]=4 87 B7R1.2 CC1=NC=C(Br)S1 7H66-9-X0 [2,0,0,0,0,0|1,1,0]=4 88 B7R1.2 CC1=NN(C)C=C1 3H32-1-2N [2,0,0,0,0,0|2,0,0]=4 89 B7R1.2 CC1=NN=C(C)N1 3H32-1-8Z [2,0,0,0,0,0|2,0,0]=4 90 B7R1.2 CC1=NN=C(C)S1 7H70-1-1T [2,0,0,0,0,0|1,1,0]=4 91 B7R1.2 CC1=NN=C(N)O1 4H30-1-05 [2,0,0,0,0,0|2,0,0]=4 92 B7R1.4 CC1=C(Br)N=CN1 3H32-9-K1 [2,0,0,0,0,0|2,0,0]=4 93 B7R1.4 CC1=C(Br)SC=N1 7H70-9-W1 [2,0,0,0,0,0|1,1,0]=4 94 B7R1.4 CC1=C(I)N=CN1 3H31-H-14 [2,0,0,0,0,0|2,0,0]=4 95 B7R1.4 CC1=CC=NN1C 3H32-1-J0 [2,0,0,0,0,0|2,0,0]=4 96 B7R1.4 CC1=CNN=C1C 3H31-1-9B [2,0,0,0,0,0|2,0,0]=4 97 B7R1.4 CC1=CNN=C1C 6H75-1-00 [2,0,0,0,0,0|2,0,0]=4 98 B9R1.7 CC1=NC(CCO)=CS1 8H01-1-X0 [1,1,0,0,0,0|2,0,0]=4 99 B9R1.7 CCOC1=NC(Br)=CS1 8H70-9-Z3 [1,1,0,0,0,0|1,1,0]=4 100 B9R1.21 OCC1=CC=C(CO)O1 2H04-1-01 [1,1,0,0,0,0|2,0,0]=4 101 B9R1.35 CC1=CSC(C(C)C)=N1 7H70-1-46 [1,1,0,0,0,0|0,1,0]=3 102 B9R1.37 CC1=NN(C)C(C)=C1I 3H32-H-49 [1,1,0,0,0,0|2,0,0]=4 103 B9R1.37 CC1=NN(C)C(C)=C1N 3H30-1-M7 [1,1,0,0,0,0|2,0,0]=4 104 B11R1.9 COC1=CC(OC)=NC(C)=N1 4H08-1-0K [0,1,0,0,0,1|2,0,0]=4 105 B11R1.192 CC1=CC=C(CCN)C=C1C 3730-1-24 [0,1,0,0,0,1|2,0,0]=4 106 B9R1.69 CC1=CN=C(C)C(C)=C1 3H32-1-1F [0,0,1,1,0,0|1,0,1]=4 107 B9R1.1 CC1=CC=C(CN)N=C1 3H30-1-BP [1,0,0,0,0,1|2,0,0]=4 108 B9R1.1 CC1=CC=C(CO)C=N1 3H01-1-X2 [1,0,0,0,0,1|2,0,0]=4 109 B9R1.1 CCC1=CC=C(Br)C=N1 3H32-9-8N [1,0,0,0,0,1|2,0,0]=4 110 B9R1.1 CCC1=CC=C(C)N=C1 3H32-1-2W [1,0,0,0,0,1|1,0,0]=3 111 B9R1.34 CC1=CC(=O)C=C(C)O1 2H17-1-Y2 [1,0,0,0,0,1|2,0,0]=4 112 B9R1.34 CC1=CC(Br)=CC(C)=N1 P311-A-33 [1,0,0,0,0,1|2,0,0]=4 113 B9R1.34 CC1=CC(C)=CC(C)=C1 1700-1-03 [1,0,0,0,0,1|2,0,0]=4 114 B9R1.34 CC1=CC(C)=NC(=O)N1 4H48-1-MT [1,0,0,0,0,1|2,0,0]=4 115 B9R1.34 CC1=CC(C)=NC(C)=C1 3H32-1-W1 [1,0,0,0,0,1|1,0,0]=3 116 B9R1.34 CC1=CC(C)=NC(Cl)=C1 3H32-5-U3 [1,0,0,0,0,1|2,0,0]=4 117 B9R1.34 CC1=CC(C)=NC(Cl)=N1 3H32-5-U4 [1,0,0,0,0,1|2,0,0]=4 118 B9R1.34 CC1=CC(C)=NC(N)=C1 3H30-1-P6 [1,0,0,0,0,1|2,0,0]=4 119 B9R1.34 CC1=CC(C)=NC(O)=C1 4H01-1-W1 [1,0,0,0,0,1|2,0,0]=4 120 B9R1.34 CC1=CC(C)=NC(O)=N1 4H56-5-CR [1,0,0,0,0,1|2,0,0]=4 121 B9R1.34 CC1=CC(Cl)=CC(C)=N1 P612-A-59 [1,0,0,0,0,1|2,0,0]=4 122 B9R1.34 CC1=CC(N)=CC(C)=N1 3H30-1-P7 [1,0,0,0,0,1|2,0,0]=4 123 B9R1.34 CC1=CC(O)=CC(C)=N1 4H01-1-W5 [1,0,0,0,0,1|2,0,0]=4 124 B9R1.34 CC1=CC(O)=NC(C)=N1 4H01-1-W6 [1,0,0,0,0,1|2,0,0]=4 125 B9R1.34 CC1=NC(C)=NC(Cl)=C1 3H32-5-AE [1,0,0,0,0,1|2,0,0]=4