0 B9R1.1 OCC1=CC=C(O)C=C1 c08578 [0,0,0,0,0,0|3,0,0]=3 1 B8R1.2 N#CC1=CC=CN=C1 c08847 [1,0,0,0,0,0|3,0,0]=4 2 B8R1.3 CC1=CC=C(I)C=C1 a06235 [1,0,0,0,0,0|1,0,0]=2 3 B10R1.1 O\N=C\C1=CC=C(O)C=C1 c05010 [0,1,0,0,0,0|3,0,0]=4 4 B10R1.13 CC(N)C1=CC=C(O)C=C1 c07375 [0,1,0,0,0,0|2,0,0]=3 5 B10R1.13 CN(C)C1=CC=C(N)C=C1 c08318 [0,1,0,0,0,0|2,0,0]=3 6 B10R1.13 O=[N+]([O-])C1=CC=C(I)C=C1 c08153 [0,1,0,0,0,0|3,0,0]=4 7 B10R1.25 COC1=C(Br)C=C(C)C=C1 a03095 [0,1,0,0,0,0|0,0,0]=1 8 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 c07575 [0,1,0,0,0,0|3,0,0]=4 9 B10R1.176 COC1=CC=C(N)C(C)=C1 c07873 [0,1,0,0,0,0|1,0,0]=2 10 B7R1.3 NC1=CC=NC=C1 c08484 [2,0,0,0,0,0|2,0,0]=4 11 B9R1.6 CC(=O)C1=CC=CC=C1 c08846 [1,1,0,0,0,0|1,0,0]=3 12 B9R1.6 NC(=O)C1=CC=CC=C1 a03942 [1,1,0,0,0,0|2,0,0]=4 13 B9R1.6 O=C(O)C1=CC=CC=C1 e00688 [1,1,0,0,0,0|2,0,0]=4 14 B9R1.6 OB(O)C1=CC=CC=C1 c00853 [1,1,0,0,0,0|2,0,0]=4 15 B9R1.8 BrCC[N+]1=CC=CC=C1 a01518 [1,1,0,0,0,0|2,0,0]=4 16 B9R1.8 C\C=C\C1=NC=CC=C1 a03932 [1,1,0,0,0,0|2,0,0]=4 17 B9R1.69 CC1=C(N)C=C(N)C=C1 a09035 [1,1,0,0,0,0|1,0,0]=3 18 B9R1.69 CC1=C(N)C=CC(I)=C1 e00843 [1,1,0,0,0,0|2,0,0]=4 19 B9R1.69 CC1=C(O)C=CC(Br)=C1 a00144 [1,1,0,0,0,0|1,0,0]=3 20 B9R1.69 CC1=CC(=O)C=CC1=O a03614 [1,1,0,0,0,0|1,0,1]=4 21 B9R1.69 CC1=CC=C(Br)C(C)=C1 a03938 [1,1,0,0,0,0|1,0,0]=3 22 B9R1.69 NC1=CC=C(Br)C(Cl)=C1 c07779 [1,1,0,0,0,0|2,0,0]=4 23 B9R1.69 OC1=C(Br)C=C(Cl)C=C1 c01122 [1,1,0,0,0,0|1,0,0]=3 24 B9R1.69 OC1=CC=C(Br)C=C1Br m09466 [1,1,0,0,0,0|1,0,0]=3 25 B9R1.69 OC1=CC=C(Br)C=C1Cl a03355 [1,1,0,0,0,0|1,0,0]=3 26 B11R1.1 C=CCOC1=CC=C(N)C=C1 c01982 [0,2,0,0,0,0|1,0,0]=3 27 B11R1.1 CCNCC1=CC=C(Cl)C=C1 c04044 [0,2,0,0,0,0|2,0,0]=4 28 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 e00712 [0,2,0,0,0,0|2,0,0]=4 29 B11R1.22 CC1=CC=C(\C(C)=N\O)C=C1 m02696 [0,2,0,0,0,0|1,0,0]=3 30 B11R1.22 CCC(N)C1=CC=C(O)C=C1 c07399 [0,2,0,0,0,0|2,0,0]=4 31 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 c07252 [0,2,0,0,0,0|2,0,0]=4 32 B11R1.22 COC(=O)C1=CC=C(N)C=C1 c04948 [0,2,0,0,0,0|1,0,0]=3 33 B11R1.22 COC(=O)C1=CC=C(O)C=C1 e00879 [0,2,0,0,0,0|1,0,0]=3 34 B11R1.22 C\C(=N\O)C1=CC=C(Br)C=C1 a01486 [0,2,0,0,0,0|2,0,0]=4 35 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 a08341 [0,2,0,0,0,0|2,0,0]=4 36 B11R1.83 CCOC1=CC=C(CO)C=C1 c04426 [0,2,0,0,0,0|0,0,0]=2 37 B11R1.83 COC1=CC=C(\C=N\O)C=C1 c04966 [0,2,0,0,0,0|0,0,1]=3 38 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 c08636 [0,2,0,0,0,0|2,0,0]=4 39 B11R1.21 CC1=C(I)C=C(C(N)=O)C=C1 a05058 [0,2,0,0,0,0|2,0,0]=4 40 B11R1.21 CC1=CC=C(C(=O)O)C=C1Br a00556 [0,2,0,0,0,0|2,0,0]=4 41 B11R1.21 CC1=CC=C(C(N)=O)C=C1Br a03147 [0,2,0,0,0,0|2,0,0]=4 42 B11R1.21 CC1=CC=C([N+](=O)[O-])C=C1Br c07904 [0,2,0,0,0,0|2,0,0]=4 43 B11R1.166 CC(N)C1=C(F)C=C(F)C=C1 c07386 [0,2,0,0,0,0|2,0,0]=4 44 B11R1.37 COC1=C(C=O)C=C(Cl)C=C1 c04102 [0,2,0,0,0,0|1,0,0]=3 45 B11R1.277 COC1=C(O)C=C(Br)C(Br)=C1 a05924 [0,2,0,0,0,0|1,0,0]=3 46 B11R1.464 COC1=C(Cl)C=C(Cl)C=C1Br c02641 [0,2,0,0,0,0|1,0,0]=3 47 B7R1.2 CC1=NNC(O)=C1 a07322 [1,0,0,0,1,0|2,0,0]=4