0 B7R0.1 CCCOCCCO 9024AJ [0,0,0,0,0,0|1,0,3]=4 1 B8R0.4 CCC\C=C\C=C\C=O R556 [0,1,0,0,0,0|0,0,2]=3 2 B8R0.4 CCC\C=C\C=C\C=O W5281 [0,1,0,0,0,0|0,0,2]=3 3 B8R0.4 CCC\C=C\CCCC 6655AL [0,1,0,0,0,0|1,0,2]=4 4 B8R0.6 C\C=C\C=C\C(=O)OC 8249AL [0,1,0,0,0,0|2,0,1]=4 5 B8R0.7 CCCC\C=C\C(C)O 6145AL [0,1,0,0,0,0|0,0,2]=3 6 B8R1.2 BrCC1=CN=CC=C1 0834AC [0,0,0,1,0,0|2,0,1]=4 7 B8R1.2 BrCC1=NC=CC=C1 8088AB [0,0,0,1,0,0|2,0,1]=4 8 B8R1.2 CNC1=CC=CC=C1 7883AF [0,0,0,1,0,0|2,0,1]=4 9 B8R1.2 O[Hg]C1=CC=CC=C1 7647AF [0,0,0,1,0,0|1,0,2]=4 10 B8R1.8 CNCC1=CC=CO1 6487AB [0,0,0,1,0,0|1,0,2]=4 11 B8R1.8 O\N=C\C1=CSC=C1 3142AE [0,0,0,1,0,0|2,0,1]=4 12 B8R1.11 CC1=C(CN)SC=C1 0965AA [0,0,0,1,0,0|2,0,1]=4 13 B8R1.11 CN1C=NC=C1CN Y9200 [0,0,0,1,0,0|3,0,0]=4 14 B8R1.11 OC[C@@H]1CC=C[C@@H]1O 2847AH [0,0,0,1,0,0|1,0,2]=4 15 B5R0.2 C#C\C=C\CO 9879AL [2,0,0,0,0,0|0,0,2]=4 16 B5R0.2 C=C\C=C\C=O Y1559 [2,0,0,0,0,0|0,0,2]=4 17 B5R0.2 C=C\C=C\CC 4582AL [2,0,0,0,0,0|0,0,0]=2 18 B5R0.2 CCO\C=C/Br 7961AD [2,0,0,0,0,0|2,0,0]=4 19 B5R0.2 ClC\C=C\CCl 9862AF [2,0,0,0,0,0|2,0,0]=4 20 B5R0.2 OC\C=C\CCl Y3343 [2,0,0,0,0,0|1,0,0]=3 21 B7R0.3 CCC(=O)\C=C\C=O Z6191 [1,1,0,0,0,0|0,0,1]=3 22 B7R0.3 CC\C=C\C(=O)OC Y2122 [1,1,0,0,0,0|1,0,0]=3 23 B7R0.3 COC(=O)\C=C\C=O 1381AC [1,1,0,0,0,0|1,0,1]=4 24 B7R0.3 C\C=C(/C)CCCC 6098AL [1,1,0,0,0,0|0,0,2]=4 25 B7R0.4 CCC\C=C\C(C)C 7959AF [1,1,0,0,0,0|0,0,2]=4 26 B9R0.2 CCC\C=C/CCC(=O)O Z6190 [0,2,0,0,0,0|0,0,2]=4 27 B9R0.38 CC(C)(C)C#C\C=C\CO U572 [0,2,0,0,0,0|0,0,2]=4 28 B7R1.1 CNC1=CC=CS1 1494AC [1,0,0,1,0,0|1,1,0]=4 29 B7R1.1 COC1=CC=CN1 Y1596 [1,0,0,1,0,0|2,0,0]=4 30 B7R1.1 ClCC1=CC=CO1 Z5545 [1,0,0,1,0,0|1,0,0]=3 31 B7R1.1 NCC1=CN=CO1 Y4206 [1,0,0,1,0,0|2,0,0]=4 32 B7R1.1 NCC1=NC=CO1 4279AC [1,0,0,1,0,0|2,0,0]=4 33 B7R1.1 O=CC1=CC=NO1 8334AA [1,0,0,1,0,0|2,0,0]=4 34 B7R1.1 OCC1=CSC=N1 Y7005 [1,0,0,1,0,0|2,0,0]=4 35 B7R1.3 CC1CC=CCC1 6594AL [1,0,0,1,0,0|0,0,2]=4 36 B7R1.3 N[C@H]1CC=CCC1 9037AH [1,0,0,1,0,0|1,0,1]=4 37 B7R1.3 OC1=CC=CC=C1 8781AL [1,0,0,1,0,0|0,0,2]=4 38 B7R1.3 OC1C=CCNC1 9589AH [1,0,0,1,0,0|1,0,1]=4 39 B7R1.3 OC1CC=CCC1 Y4155 [1,0,0,1,0,0|0,0,1]=3 40 B7R1.4 CC1=C(C)SC=C1 Z5548 [1,0,0,1,0,0|1,0,1]=4 41 B7R1.24 C1=CCCCC=C1 5492AB [1,0,0,1,0,0|0,0,0]=2 42 B9R1.2 CCC1=CC=C[N+]([O-])=C1 7429AA [0,1,0,1,0,0|1,0,1]=4 43 B9R1.2 OC[C@@H]1CC=C[C@H](O)C1 8910AH [0,1,0,1,0,0|0,0,2]=4 44 B9R1.8 CCCC1=CN=CC=C1 6392AB [0,1,0,1,0,0|2,0,0]=4 45 B9R1.15 CCC1=C(C)C=CN=C1 R348 [0,1,0,1,0,0|1,0,1]=4 46 B9R1.15 CCC1=C(F)C=NC=C1 6558AA [0,1,0,1,0,0|1,0,1]=4 47 B9R1.15 CCC1=CC=CN=C1C X8230 [0,1,0,1,0,0|1,0,1]=4 48 B9R1.15 OCC1=C(O)C=NC=C1 W7832 [0,1,0,1,0,0|1,0,1]=4 49 B9R1.69 CC1=CC=C(N)C=C1O I725 [0,1,0,1,0,0|0,0,2]=4 50 B9R1.1 CCC1=CC=C(Br)N=N1 7660AA [0,1,0,1,0,0|2,0,0]=4 51 B9R1.1 CCC1=CN=C(C)C=C1 6769AL [0,1,0,1,0,0|2,0,0]=4 52 B9R1.21 CCC1=NC=C(CO)N1 1332AC [0,1,0,1,0,0|1,0,0]=3 53 B9R1.21 ClCC1=CC=C(CCl)S1 2808AB [0,1,0,1,0,0|2,0,0]=4 54 B9R1.6 CC(I)C1=CC=CC=C1 7383AJ [0,1,0,1,0,0|1,0,1]=4 55 B9R2.39 OC1CC2C=CC1C2 X4118 [0,0,0,2,0,0|0,0,2]=4