0 B8R0.4 CCC\C=C\C=C\C=O R556 [0,1,0,0,0,0|0,0,0]=1 1 B8R0.4 CCC\C=C\C=C\C=O W5281 [0,1,0,0,0,0|0,0,0]=1 2 B8R0.6 CCCCOC(=O)C=O 3194AL [0,1,0,0,0,0|1,0,2]=4 3 B8R0.6 C\C=C\C=C\C(=O)OC 8249AL [0,1,0,0,0,0|2,0,0]=3 4 B8R1.2 BrCC1=CN=CC=C1 0834AC [0,0,0,1,0,0|3,0,0]=4 5 B8R1.2 BrCC1=NC=CC=C1 8088AB [0,0,0,1,0,0|2,0,0]=3 6 B8R1.2 BrCC1=NC=CN=C1 Y9584 [0,0,0,1,0,0|3,0,0]=4 7 B8R1.2 CNC1=CC=CC=C1 7883AF [0,0,0,1,0,0|2,0,0]=3 8 B8R1.2 NCC1=NC=CC=N1 Z1925 [0,0,0,1,0,0|3,0,0]=4 9 B8R1.2 NNC1=CC=CC=C1 5128AF [0,0,0,1,0,0|3,0,0]=4 10 B8R1.2 O=CC1=CC=NC=C1 7668AH [0,0,0,1,0,0|1,0,2]=4 11 B8R1.2 O=CC1=NN=CC=N1 9261AH [0,0,0,1,0,0|3,0,0]=4 12 B8R1.2 O=[IH2]C1=CC=CC=C1 X3757 [0,0,0,1,0,0|1,0,2]=4 13 B8R1.2 O[Hg]C1=CC=CC=C1 7647AF [0,0,0,1,0,0|3,0,0]=4 14 B8R1.5 CC1=C(Br)C=CN=C1 N224 [0,0,0,1,0,0|2,0,1]=4 15 B8R1.5 ClC1=CC=CC=C1Cl 9816AF [0,0,0,1,0,0|2,0,1]=4 16 B8R1.8 CNCC1=CC=CO1 6487AB [0,0,0,1,0,0|1,0,2]=4 17 B8R1.11 CC1=C(CN)SC=C1 0965AA [0,0,0,1,0,0|3,0,0]=4 18 B8R1.11 CCC1=NNC=C1Br Y5291 [0,0,0,1,0,0|3,0,0]=4 19 B8R1.11 NCC1=C(Br)SC=C1 8484AH [0,0,0,1,0,0|3,0,0]=4 20 B8R1.49 C1=CCCC=CCC1 8418AJ [0,0,0,1,0,0|1,0,2]=4 21 B5R0.2 C=C\C=C\C=O Y1559 [2,0,0,0,0,0|0,0,0]=2 22 B5R0.2 C=C\C=C\CC 4582AL [2,0,0,0,0,0|0,0,0]=2 23 B5R0.2 CCO\C=C/Br 7961AD [2,0,0,0,0,0|2,0,0]=4 24 B7R0.3 C=CCOC(=O)CC 7475AF [1,1,0,0,0,0|1,0,1]=4 25 B7R0.3 C=CCOC(=S)CC U627 [1,1,0,0,0,0|1,0,1]=4 26 B7R0.3 CCC(=O)\C=C\C=O Z6191 [1,1,0,0,0,0|0,0,0]=2 27 B7R0.3 CC\C=C\C(=O)OC Y2122 [1,1,0,0,0,0|1,0,1]=4 28 B7R0.3 COC(=O)\C=C\C=O 1381AC [1,1,0,0,0,0|1,0,0]=3 29 B7R0.4 CCCC=C[N+](=O)[O-] 9974AL [1,1,0,0,0,0|1,0,1]=4 30 B7R0.4 C\C=C\COC(C)=O 7476AF [1,1,0,0,0,0|1,0,1]=4 31 B9R0.48 CCOC(=O)\C=C\C(=O)Cl V0861 [0,2,0,0,0,0|1,0,0]=3 32 B9R0.2 CCCCC\C=C\C(=O)O 7944AF [0,2,0,0,0,0|0,0,2]=4 33 B9R0.2 CCC\C=C/CCC(=O)O Z6190 [0,2,0,0,0,0|0,0,2]=4 34 B9R0.45 CCCCCC\C=C\C=O Y1535 [0,2,0,0,0,0|0,0,2]=4 35 B7R1.1 CNC1=CC=CS1 1494AC [1,0,0,1,0,0|1,1,0]=4 36 B7R1.1 COC1=CC=CN1 Y1596 [1,0,0,1,0,0|2,0,0]=4 37 B7R1.1 COC1=COC=C1 W1886 [1,0,0,1,0,0|2,0,0]=4 38 B7R1.1 ClCC1=CC=CO1 Z5545 [1,0,0,1,0,0|1,0,1]=4 39 B7R1.1 ClCC1=COC=C1 W3162 [1,0,0,1,0,0|2,0,0]=4 40 B7R1.1 O=CC1=CC=NO1 8334AA [1,0,0,1,0,0|2,0,0]=4 41 B7R1.3 ClC1=NC=CC=C1 7352AF [1,0,0,1,0,0|2,0,0]=4 42 B7R1.3 FC1=NC=CC=C1 7353AF [1,0,0,1,0,0|2,0,0]=4 43 B7R1.3 NC1=CC=CC=C1 2738AC [1,0,0,1,0,0|1,0,1]=4 44 B7R1.3 NC1=CC=CC=C1 5126AF [1,0,0,1,0,0|1,0,1]=4 45 B7R1.3 O=C1CC=CN=N1 Y4431 [1,0,0,1,0,0|2,0,0]=4 46 B7R1.3 O=C1N=CC=CN1 9421AJ [1,0,0,1,0,0|2,0,0]=4 47 B7R1.3 OC1=CC=CC=C1 8781AL [1,0,0,1,0,0|0,0,2]=4 48 B7R1.3 [O-][N+]1=CC=CC=C1 7360AF [1,0,0,1,0,0|2,0,0]=4 49 B7R1.4 CC1=C(Br)OC=C1 Z5551 [1,0,0,1,0,0|2,0,0]=4 50 B7R1.4 CC1=C(C)SC=C1 Z5548 [1,0,0,1,0,0|2,0,0]=4 51 B7R1.24 C1=CCCCC=C1 5492AB [1,0,0,1,0,0|0,0,1]=3 52 B9R1.2 CCC1=CC=C[N+]([O-])=C1 7429AA [0,1,0,1,0,0|1,0,1]=4 53 B9R1.2 CCC1=NC(C)=CN=C1 R550 [0,1,0,1,0,0|2,0,0]=4 54 B9R1.2 CNC1=NC(=O)NC=C1 Z2895 [0,1,0,1,0,0|2,0,0]=4 55 B9R1.2 CNC1=NC=CC(I)=C1 Z1369 [0,1,0,1,0,0|2,0,0]=4 56 B9R1.2 NC1=CC(C=O)=CC=C1 8788AA [0,1,0,1,0,0|0,0,2]=4 57 B9R1.2 NCC1=CC(=O)NC=C1 5769AA [0,1,0,1,0,0|2,0,0]=4 58 B9R1.8 CCCC1=CN=CC=C1 6392AB [0,1,0,1,0,0|1,0,1]=4 59 B9R1.8 C\C=C\C1=NC=CC=C1 Y6273 [0,1,0,1,0,0|1,0,1]=4 60 B9R1.15 CC1=C(NN)C=CC=C1 1069AL [0,1,0,1,0,0|1,0,1]=4 61 B9R1.15 CCC1=C(C)C=CN=C1 R348 [0,1,0,1,0,0|1,0,0]=3 62 B9R1.15 CCC1=C(F)C=NC=C1 6558AA [0,1,0,1,0,0|1,0,0]=3 63 B9R1.15 CCC1=CC=CN=C1C X8230 [0,1,0,1,0,0|1,0,0]=3 64 B9R1.15 CCC1=CN=CNC1=O 3205AJ [0,1,0,1,0,0|1,0,0]=3 65 B9R1.15 CNC1=NC=CC=C1I Y3706 [0,1,0,1,0,0|2,0,0]=4 66 B9R1.15 CSC1=C(Br)C=CN=C1 Z1487 [0,1,0,1,0,0|2,0,0]=4 67 B9R1.15 CSC1=CC=CN=C1Cl Z0760 [0,1,0,1,0,0|2,0,0]=4 68 B9R1.15 FC1=C(CBr)C=CN=C1 Y7275 [0,1,0,1,0,0|2,0,0]=4 69 B9R1.15 FC1=C(CBr)N=CC=C1 4239AA [0,1,0,1,0,0|2,0,0]=4 70 B9R1.15 OCC1=C(O)C=NC=C1 W7832 [0,1,0,1,0,0|1,0,1]=4 71 B9R1.69 CC1=CC=C(N)C=C1O I725 [0,1,0,1,0,0|0,0,2]=4 72 B9R1.14 CCC1=NNC=C1C=O Y5289 [0,1,0,1,0,0|1,0,0]=3 73 B9R1.14 CSC1=C(C=O)C=CS1 Z0839 [0,1,0,1,0,0|1,0,0]=3 74 B9R1.14 O=CC1=CSC=C1C=O 1543AA [0,1,0,1,0,0|1,0,1]=4 75 B9R1.1 CC1=CN=C(CCl)C=C1 1952AC [0,1,0,1,0,0|2,0,0]=4 76 B9R1.1 CCC1=CC=C(Br)N=N1 7660AA [0,1,0,1,0,0|2,0,0]=4 77 B9R1.1 CCC1=CN=C(C)C=C1 6769AL [0,1,0,1,0,0|2,0,0]=4 78 B9R1.1 NC1=CC=C(CCl)N=C1 5924AH [0,1,0,1,0,0|2,0,0]=4 79 B9R1.1 NCC1=NC=C(F)C=C1 Y2001 [0,1,0,1,0,0|2,0,0]=4 80 B9R1.3 CC1=C(I)C=CC=C1I Y5130 [0,1,0,1,0,0|1,0,1]=4 81 B9R1.11 CCC(N)C1=CC=CS1 7066AE [0,1,0,1,0,0|0,1,1]=4 82 B9R1.21 CSC1=CC(C=O)=CS1 Z0992 [0,1,0,1,0,0|2,0,0]=4 83 B9R1.21 O=CC1=CC(CO)=CO1 Y6573 [0,1,0,1,0,0|2,0,0]=4 84 B9R1.6 CC(C)C1=NC=CN=C1 R572 [0,1,0,1,0,0|2,0,0]=4 85 B9R1.6 CC(I)C1=CC=CC=C1 7383AJ [0,1,0,1,0,0|1,0,0]=3 86 B9R1.6 CN(N)C1=CC=CC=C1 7753AF [0,1,0,1,0,0|2,0,0]=4 87 B9R1.6 CN(N)C1=CC=CC=C1 7754AF [0,1,0,1,0,0|2,0,0]=4 88 B9R1.6 C[PH](=O)C1=CC=CC=C1 0011AB [0,1,0,1,0,0|2,0,0]=4 89 B9R1.6 NC(=O)C1=NC=CC=C1 7986AJ [0,1,0,1,0,0|1,0,1]=4 90 B9R1.6 O=C(O)C1=CC=CN=C1 7629AF [0,1,0,1,0,0|1,0,1]=4 91 B9R1.6 O=C(O)C1=NC=CC=C1 5114AH [0,1,0,1,0,0|1,0,1]=4 92 B9R1.6 O=C([O-])C1=CC=CC=C1 M138 [0,1,0,1,0,0|0,0,2]=4 93 B9R1.6 O=C([O-])C1=CC=CC=C1 V1440 [0,1,0,1,0,0|0,0,2]=4 94 B9R1.6 O=C([O-])C1=CC=CC=C1 V1449 [0,1,0,1,0,0|0,0,2]=4 95 B9R1.6 O=C([O-])C1=CC=CC=C1 V1986 [0,1,0,1,0,0|0,0,2]=4 96 B9R1.13 CC(N)CC1=CC=CN1 9883AH [0,1,0,1,0,0|1,0,1]=4 97 B9R1.13 CC(N)CC1=CC=CS1 3185AB [0,1,0,1,0,0|0,1,1]=4