0 B12R1.78 [C-]#[N+]C1=C(OC)C=C(OC)C=C1 BB56-1820 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.37 COC1=C(C#N)C=C(N)C=C1 BB53-1291 [1,0,0,0,0,0|3,0,0]=4 2 B11R1.37 COC1=C(CO)C=C(Cl)C=C1 BB53-1861 [1,0,0,0,0,0|3,0,0]=4 3 B11R1.37 COC1=C(OC)C=C(I)C=C1 BB12-5007 [1,0,0,0,0,0|1,0,0]=2 4 B11R1.37 COC1=CC=C(Cl)C=C1NN BB56-0969 [1,0,0,0,0,0|3,0,0]=4 5 B11R1.279 COC1=C(Cl)C=C(NN)C=C1 BB56-0919 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.279 COC1=C(I)C=C(C=O)C=C1 BB17-1449 [1,0,0,0,0,0|1,0,0]=2 7 B11R1.279 [C-]#[N+]C1=CC(Cl)=C(OC)C=C1 BB56-1215 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.280 CC1=C(C#N)C=C(C=O)C=C1 BB12-1259 [1,0,0,0,0,0|2,0,0]=3 9 B11R1.280 COC1=C(O)C=CC(CO)=C1 BB17-0749 [1,0,0,0,0,0|0,0,2]=3 10 B11R1.280 N#CC1=C(F)C=CC(C=O)=C1 BB12-3557 [1,0,0,0,0,0|3,0,0]=4 11 B13R1.386 COC1=C(OC)C=C(CC#N)C=C1 BB12-2718 [0,1,0,0,0,0|1,0,1]=3 12 B13R1.1249 CCOC1=C(OC)C=C(CN)C=C1 BB01-6610 [0,1,0,0,0,0|1,0,1]=3 13 B13R1.2200 COC1=C(OC)C=C(C=O)C(Cl)=C1 BB17-2298 [0,1,0,0,0,0|0,0,0]=1 14 B13R1.3091 COC1=C(C#N)C=C([N+](=O)[O-])C=C1 BB12-0213 [0,1,0,0,0,0|3,0,0]=4 15 B13R1.3091 [C-]#[N+]C1=C(OC)C=C([N+](=O)[O-])C=C1 BB56-1774 [0,1,0,0,0,0|2,0,1]=4 16 B13R2.57 NNC1=CC=C2OCCOC2=C1 BB56-0053 [0,0,0,1,0,0|2,0,0]=3 17 B10R1.20 COC1=CC=CC=C1NN BB56-0061 [2,0,0,0,0,0|2,0,0]=4 18 B10R1.20 [C-]#[N+]C1=CC=CC=C1OC BB56-1195 [2,0,0,0,0,0|1,0,1]=4 19 B10R1.25 CNC1=C(C)C=C(Cl)C=C1 BB01-7288 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.30 CNC1=C(C)C=CC(Cl)=C1 BB01-7292 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.3 COC1=CC=C(NN)C=C1 BB56-2536 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 BB12-1260 [2,0,0,0,0,0|1,0,0]=3 23 B10R1.176 CC1=C(F)C=C(C=O)C=C1 BB12-2251 [2,0,0,0,0,0|1,0,0]=3 24 B10R1.176 CC1=CC=C(NN)C=C1C BB56-2531 [2,0,0,0,0,0|2,0,0]=4 25 B10R1.176 O=CC1=CC(I)=C(O)C=C1 BB17-2246 [2,0,0,0,0,0|1,0,0]=3 26 B10R1.176 O=CC1=CC=C(F)C(Cl)=C1 BB12-4694 [2,0,0,0,0,0|2,0,0]=4 27 B10R1.176 [C-]#[N+]C1=CC=C(C)C(C)=C1 BB56-1194 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB53-1298 [1,1,0,0,0,0|1,0,0]=3 29 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 BB12-0014 [1,1,0,0,0,0|1,0,0]=3 30 B12R1.48 COC1=CNC(C(=O)O)=CC1=O BB26-0368 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.48 COC1=COC(C(=O)O)=CC1=O BB26-0367 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.288 COC1=CC=C(N=C=O)C=C1Cl BB01-6578 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.301 COC1=C(Br)C=C(C=O)C=C1Br BB17-1184 [1,1,0,0,0,0|1,0,0]=3 34 B12R1.301 COC1=C(Cl)C=C(C=O)C=C1Cl BB17-1175 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 BB12-4663 [1,1,0,0,0,0|2,0,0]=4 36 B12R1.449 COC1=C(O)C=C(Cl)C(C=O)=C1 BB17-1452 [1,1,0,0,0,0|0,0,0]=2 37 B14R1.759 C#CCOC1=C(OC)C=CC(C=O)=C1 BB17-1445 [0,2,0,0,0,0|0,0,0]=2 38 B14R1.759 CCOCC1=CC(C=O)=CC=C1OC BB12-2102 [0,2,0,0,0,0|0,0,0]=2 39 B14R1.3723 COC1=C(CN(C)C)C=C(C=O)C=C1 BB56-1556 [0,2,0,0,0,0|1,0,0]=3 40 B14R1.5236 CCOC1=CC=C(CN)C=C1OCC BB01-6395 [0,2,0,0,0,0|1,0,1]=4 41 B14R1.5317 CCOC1=C(OC)C(I)=CC(C=O)=C1 BB17-1568 [0,2,0,0,0,0|0,0,0]=2 42 B14R1.5317 CCOC1=CC(C=O)=CC(Cl)=C1OC BB17-1176 [0,2,0,0,0,0|0,0,0]=2 43 B14R1.5317 CCOC1=CC(CO)=CC(Br)=C1OC BB17-1801 [0,2,0,0,0,0|0,0,2]=4 44 B14R1.793 C(=O)NCC1=CC(OC)=C(OC)C=C1 BB20-3389 [0,2,0,0,0,0|0,0,0]=2 45 B14R1.793 [C-]#[N+]CCC1=CC=C(OC)C(OC)=C1 BB56-0009 [0,2,0,0,0,0|1,0,1]=4 46 B14R1.3651 COC1=C(C#N)C=C(NC(C)=O)C=C1 BB53-1528 [0,2,0,0,0,0|2,0,0]=4 47 B14R1.350 COC1=C(OC)C(I)=CC(C(=O)O)=C1 BB17-2461 [0,2,0,0,0,0|0,0,0]=2 48 B14R1.556 COC1=C(OC)C(Br)=C(Br)C(C=O)=C1 BB17-1628 [0,2,0,0,0,0|0,0,0]=2 49 B14R1.14885 CCOC1=C(Cl)C=C(C=O)C=C1OC BB17-1164 [0,2,0,0,0,0|0,0,0]=2 50 B14R1.14885 CCOC1=C(OC)C=C(C=O)C=C1I BB17-1174 [0,2,0,0,0,0|0,0,0]=2 51 B14R1.2282 COC1=CC(OC)=C(OC)C=C1CO BB12-2203 [0,2,0,0,0,0|0,0,2]=4 52 B14R1.2023 COC1=C(OC)C(Br)=C([N+](=O)[O-])C=C1 BB17-0675 [0,2,0,0,0,0|1,0,0]=3 53 B14R1.31 COC1=CC=C(C(C)=O)C=C1[N+](=O)[O-] BB12-0017 [0,2,0,0,0,0|2,0,0]=4 54 B12R1.619 COC(=O)C1=CC=C(C=O)N1C BB20-3088 [0,0,1,1,0,0|2,0,0]=4 55 B12R2.44 ClCC1=CC2=C(C=C1)OCO2 BB01-4892 [1,0,0,1,0,0|1,0,1]=4 56 B14R2.112 CCNC1=CC2=C(C=C1)OCCO2 BB01-7306 [0,1,0,1,0,0|1,0,1]=4 57 B14R2.112 O\N=C\C1=CC2=C(C=C1)OCCO2 BB20-3235 [0,1,0,1,0,0|0,0,1]=3