0 B9R1.33 CC1=C(CCO)SC=N1 8H01-1-X2 [0,0,0,0,0,0|0,0,0]=0 1 B9R1.33 CNCC1=CC=NN1C 3H31-1-Y3 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.8 CNCC1=CN=CS1 7H33-5-0A [1,0,0,0,0,0|2,0,0]=3 3 B8R1.8 N#CCC1=CC=CS1 7H37-1-N5 [1,0,0,0,0,0|2,0,1]=4 4 B8R1.8 NCCC1=CC=CS1 7H30-1-X0 [1,0,0,0,0,0|2,0,0]=3 5 B8R1.8 NCCC1=CNC=N1 3H30-5-V3 [1,0,0,0,0,0|2,0,1]=4 6 B8R1.8 NCCC1=CSC=C1 7H30-5-X3 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.8 NCCN1C=CN=C1 3H30-9-Y4 [1,0,0,0,0,0|3,0,0]=4 8 B8R1.8 NCCN1C=NC=N1 3H30-5-X9 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.8 OCCC1=CC=CS1 6H01-1-01 [1,0,0,0,0,0|1,0,0]=2 10 B8R1.8 OCCC1=CNC=N1 4H56-1-833 [1,0,0,0,0,0|1,0,1]=3 11 B8R1.8 OCCC1=CNN=C1 4H01-1-Y9 [1,0,0,0,0,0|2,0,0]=3 12 B8R1.8 OCCC1=CSC=C1 6H01-1-12 [1,0,0,0,0,0|2,0,0]=3 13 B8R1.8 OCCN1C=CC=C1 4H01-1-66 [1,0,0,0,0,0|3,0,0]=4 14 B8R1.8 OCCN1C=CC=N1 4H01-1-U5 [1,0,0,0,0,0|3,0,0]=4 15 B8R1.8 O\N=C\C1=CC=CS1 8H47-1-0B [1,0,0,0,0,0|2,0,1]=4 16 B8R1.11 CC1=C(C=O)NC=N1 4H15-1-Z5 [1,0,0,0,0,0|1,0,2]=4 17 B8R1.11 CC1=C(C=O)SC=C1 6H15-1-X3 [1,0,0,0,0,0|1,0,2]=4 18 B8R1.11 CC1=C(CCl)NC=N1 3H32-5-Q4 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.11 CC1=C(CO)C=CO1 2H01-1-X7 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.11 CC1=C(CO)N=CO1 4H01-1-6R [1,0,0,0,0,0|2,0,0]=3 21 B8R1.11 CC1=C(CO)NC=N1 3H01-5-X0 [1,0,0,0,0,0|1,0,0]=2 22 B8R1.11 CC1=NON=C1CO 4H56-1-2E [1,0,0,0,0,0|2,0,0]=3 23 B8R1.11 CN1C=CN=C1CO 4H01-1-V5 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.11 CN1N=CC=C1CCl 3H32-5-NU [1,0,0,0,0,0|3,0,0]=4 25 B8R1.11 CN1N=CC=C1CO 4H01-1-U0 [1,0,0,0,0,0|2,0,0]=3 26 B10R1.187 CC1=NNC(C)=C1CCBr 3H32-9-G8 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.187 CC1=NNC(C)=C1CCN 3H30-9-Y7 [0,1,0,0,0,0|3,0,0]=4 28 B10R2.7 C1=CC2=C(CCNC2)S1 7H66-5-64 [0,0,0,1,0,0|2,0,0]=3 29 B10R1.4 CC1=CC=CC=C1CCN 3730-1-29 [0,0,0,0,0,1|3,0,0]=4 30 B10R1.4 CC1=CC=CC=C1CCO 2701-1-0E [0,0,0,0,0,1|2,0,0]=3 31 B10R1.4 CCCC1=NC=NC=C1Br 3H32-9-Z9 [0,0,0,0,0,1|3,0,0]=4 32 B10R1.4 OCCC1=C(Br)C=CC=C1 2701-9-01 [0,0,0,0,0,1|3,0,0]=4 33 B10R1.10 CC1=CC=CC(CCN)=C1 3730-1-30 [0,0,0,0,0,1|3,0,0]=4 34 B10R1.10 OCCC1=CC=CC(Br)=C1 2701-9-00 [0,0,0,0,0,1|3,0,0]=4 35 B10R1.10 OCCC1=CC=CC(F)=C1 2601-3-Y1 [0,0,0,0,0,1|3,0,0]=4 36 B10R1.10 OCCC1=CC=CC(O)=C1 2604-1-0D [0,0,0,0,0,1|3,0,0]=4 37 B7R1.1 CCC1=CC=CN1 3H32-1-48 [2,0,0,0,0,0|2,0,0]=4 38 B7R1.1 CCC1=CC=CO1 2H10-1-17 [2,0,0,0,0,0|1,1,0]=4 39 B7R1.1 CCN1C=CN=C1 3H32-1-W0 [2,0,0,0,0,0|2,0,0]=4 40 B7R1.1 CSC1=CC=CS1 5H66-1-X2 [2,0,0,0,0,0|2,0,0]=4 41 B7R1.1 NCC1=CC=CS1 7H30-1-X3 [2,0,0,0,0,0|2,0,0]=4 42 B7R1.1 NCC1=CN=CO1 4H30-5-X0 [2,0,0,0,0,0|1,1,0]=4 43 B7R1.1 O=CC1=CN=CS1 8H15-1-Y4 [2,0,0,0,0,0|0,0,2]=4 44 B7R1.1 OCC1=CC=CO1 2H01-1-16 [2,0,0,0,0,0|1,1,0]=4 45 B7R1.1 OCC1=CC=CS1 6H01-1-X6 [2,0,0,0,0,0|1,0,0]=3 46 B7R1.1 OCC1=CN=CS1 P311-A-67 [2,0,0,0,0,0|0,0,0]=2 47 B7R1.1 OCC1=CNC=N1 G311-A-53 [2,0,0,0,0,0|1,0,1]=4 48 B7R1.1 OCC1=COC=N1 4H01-1-Q8 [2,0,0,0,0,0|2,0,0]=4 49 B7R1.1 OCC1=CSC=C1 6H01-1-X0 [2,0,0,0,0,0|2,0,0]=4 50 B7R1.1 OCC1=NC=CS1 8H01-1-X5 [2,0,0,0,0,0|2,0,0]=4 51 B7R1.4 CC1=C(Br)C=CS1 5H66-9-X9 [2,0,0,0,0,0|2,0,0]=4 52 B7R1.4 CC1=C(Br)N=CN1 3H32-9-K1 [2,0,0,0,0,0|2,0,0]=4 53 B7R1.4 CC1=C(Br)SC=C1 5H70-9-X0 [2,0,0,0,0,0|2,0,0]=4 54 B7R1.4 CC1=C(Br)SC=N1 7H70-9-W1 [2,0,0,0,0,0|1,0,0]=3 55 B7R1.4 CC1=C(Cl)SC=C1 5H66-5-X0 [2,0,0,0,0,0|2,0,0]=4 56 B7R1.4 CC1=C(I)N=CN1 3H31-H-14 [2,0,0,0,0,0|2,0,0]=4 57 B7R1.4 CC1=CC=NN1C 3H32-1-J0 [2,0,0,0,0,0|2,0,0]=4 58 B7R1.4 CC1=CNN=C1C 3H31-1-9B [2,0,0,0,0,0|2,0,0]=4 59 B7R1.4 CC1=CNN=C1C 6H75-1-00 [2,0,0,0,0,0|2,0,0]=4 60 B7R1.4 CN1N=CC=C1O 4H01-1-1R [2,0,0,0,0,0|2,0,0]=4 61 B9R1.7 CC1=NC(CCO)=CS1 8H01-1-X0 [1,1,0,0,0,0|2,0,0]=4 62 B9R1.12 OCCCN1C=CN=C1 4H01-1-46 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.13 O=C(O)CC1=CC=CS1 6H21-1-X5 [1,1,0,0,0,0|1,0,1]=4 64 B9R1.22 CC1=C(C=O)SC(Br)=N1 8H15-9-03 [1,1,0,0,0,0|0,0,2]=4 65 B9R1.22 CC1=C(CO)OC(=O)O1 2H25-1-2V [1,1,0,0,0,0|1,1,0]=4 66 B9R1.22 CC1=NC(C)=C(CO)S1 8H01-1-Y3 [1,1,0,0,0,0|0,0,0]=2 67 B9R1.22 CC1=NC(CO)=C(C)O1 4H01-1-W9 [1,1,0,0,0,0|2,0,0]=4 68 B9R1.22 CC1=NN(C)C(CO)=C1 4H01-1-W3 [1,1,0,0,0,0|2,0,0]=4 69 B9R1.27 CCC1=C(C)NC=C1C 3H31-1-54 [1,1,0,0,0,0|1,0,1]=4 70 B9R1.41 CC1=C(B(O)O)SC=C1 6H60-1-W1 [1,1,0,0,0,0|2,0,0]=4 71 B9R1.41 CC1=C(C(=O)O)SC=C1 6H21-1-X8 [1,1,0,0,0,0|1,0,1]=4 72 B9R1.41 CC1=C(C(=O)O)SC=N1 8H21-1-Y0 [1,1,0,0,0,0|0,0,1]=3 73 B9R1.41 CC1=C(C(=O)O)SN=N1 8H21-1-10 [1,1,0,0,0,0|1,0,1]=4 74 B11R1.17 OCCNC1=NC=CN=C1Cl 4H56-5-J0 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.41 COC1=CC=CC=C1CCO 2607-1-0H [0,1,0,0,0,1|2,0,0]=4 76 B11R1.24 CC1=CC=CC(CCCO)=N1 4H56-1-893 [0,1,0,0,0,1|2,0,0]=4 77 B11R2.10 OC1CC2=CC=CC=C2C1 2701-1-X7 [0,0,0,1,0,1|2,0,0]=4 78 B11R2.20 C1=CC=C2COCCC2=C1 2H10-1-X8 [0,0,0,1,0,1|2,0,0]=4