0 B12R1.56 COC1=C(I)C=CC([N+](=O)[O-])=C1 BB12-4663 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.56 NNC1=CC(C(=O)O)=CC=C1Cl BB56-0613 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.56 O=[N+]([O-])C1=CC=C(O)C(CCl)=C1 BB12-1837 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [1,0,0,0,0,0|2,0,0]=3 4 B11R1.21 CC1=C(Cl)C=CC([N+](=O)[O-])=C1 BB17-0545 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.21 NC1=C(O)C=C([N+](=O)[O-])C=C1 BB12-1569 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 BB12-2280 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.266 N#CC1=CC=CC(C(N)=O)=C1 BB12-1669 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.280 CC1=C(C#N)C=C(C=O)C=C1 BB12-1259 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.280 COC1=C(O)C=CC(CO)=C1 BB17-0749 [1,0,0,0,0,0|0,0,1]=2 11 B11R1.280 N#CC1=C(F)C=CC(C=O)=C1 BB12-3557 [1,0,0,0,0,0|3,0,0]=4 12 B13R1.298 COC1=C(I)C(Cl)=CC([N+](=O)[O-])=C1 BB17-2798 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.298 COC1=C(N)C(Cl)=CC([N+](=O)[O-])=C1 BB17-2784 [0,1,0,0,0,0|2,0,1]=4 14 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 15 B13R1.3230 CC1=C(C#N)C(O)=NC=C1C(=O)O BB12-4437 [0,1,0,0,0,0|3,0,0]=4 16 B13R2.430 O=C(O)C1=CC=C2C=NNC2=C1 BB01-2605 [0,0,0,1,0,0|3,0,0]=4 17 B13R2.430 O=C(O)C1=CC=C2N=CNC2=C1 BB12-2808 [0,0,0,1,0,0|2,0,1]=4 18 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [2,0,0,0,0,0|2,0,0]=4 19 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [2,0,0,0,0,0|1,0,0]=3 21 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [2,0,0,0,0,0|1,0,1]=4 22 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.176 CC1=C(Br)C=C(C=O)C=C1 BB12-1260 [2,0,0,0,0,0|2,0,0]=4 24 B10R1.176 CC1=C(F)C=C(C=O)C=C1 BB12-2251 [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 B12R1.48 COC1=C(F)C=C(C(C)=O)C=C1 BB53-1298 [1,1,0,0,0,0|2,0,0]=4 28 B12R1.48 COC1=C(N)C=C(C(C)=O)C=C1 BB12-0014 [1,1,0,0,0,0|2,0,0]=4 29 B12R1.48 COC1=CNC(C(=O)O)=CC1=O BB26-0368 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.48 COC1=COC(C(=O)O)=CC1=O BB26-0367 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1C BB12-4724 [1,1,0,0,0,0|1,0,0]=3 32 B12R1.232 NC1=C(Cl)C=C(Cl)C(C(=O)O)=C1 BB12-4680 [1,1,0,0,0,0|2,0,0]=4 33 B12R1.367 CC1=C(C)C=C(C(=O)CCl)C=C1 BB12-1806 [1,1,0,0,0,0|2,0,0]=4 34 B12R1.367 COC(=O)C1=CC(Cl)=C(Br)C=C1 BB17-0831 [1,1,0,0,0,0|2,0,0]=4 35 B12R1.367 COC(=O)C1=CC=C(F)C(Cl)=C1 BB12-4595 [1,1,0,0,0,0|2,0,0]=4 36 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 BB17-0815 [1,1,0,0,0,0|1,0,0]=3 37 B12R1.1005 CC1=C(Br)C=C(C(=O)O)C=C1Br BB12-4597 [1,1,0,0,0,0|2,0,0]=4 38 B12R1.1005 CC1=C(Cl)C=C(C(=O)O)C=C1N BB17-0446 [1,1,0,0,0,0|2,0,0]=4 39 B12R1.1005 CC1=C(N)C=C(C(=O)O)C=C1N BB12-4598 [1,1,0,0,0,0|2,0,0]=4 40 B12R1.1005 NC1=C(Cl)C(Cl)=CC(C(=O)O)=C1 BB12-4678 [1,1,0,0,0,0|2,0,0]=4 41 B12R1.1005 O=C(O)C1=CC(Cl)=C(Br)C(Cl)=C1 BB12-4611 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 BB12-4610 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.1005 O=C(O)C1=CC(Cl)=C(I)C(Cl)=C1 BB12-4720 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.11 COC1=CC(N)=CC([N+](=O)[O-])=C1 BB12-1977 [1,1,0,0,0,0|1,0,1]=4 45 B12R1.279 O=C(O)C1=CC(N=C=S)=CC=C1 BB12-1379 [1,1,0,0,0,0|1,0,1]=4 46 B12R1.435 COC(=O)C1=CC=CC(CN)=C1 BB20-4654 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.435 COC1=CC(C(=O)CN)=CC=C1 BB26-0152 [1,1,0,0,0,0|1,0,0]=3 48 B12R1.435 COC1=CC=CC(C(=O)CBr)=C1 BB01-6358 [1,1,0,0,0,0|1,0,0]=3 49 B12R1.453 COC1=CC(C(=O)O)=C(O)C=C1 BB12-4643 [1,1,0,0,0,0|0,0,0]=2 50 B12R1.453 COC1=CC([N+](=O)[O-])=C(Cl)C=C1 BB17-0386 [1,1,0,0,0,0|1,0,1]=4 51 B12R1.453 NNC1=CC(C(=O)O)=C(Cl)C=C1 BB17-0985 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.449 COC1=C(O)C=C(Cl)C(C=O)=C1 BB17-1452 [1,1,0,0,0,0|0,0,0]=2 53 B14R1.41 COC1=C(O)C=CC(C(N)C(=O)O)=C1 BB56-0073 [0,1,0,0,0,1|0,0,0]=2 54 B14R1.705 O=C(O)CC1=CC([N+](=O)[O-])=C(O)C=C1 BB56-1112 [0,1,0,0,0,1|2,0,0]=4 55 B14R1.881 COC1=CN(CC(=O)O)C(C)=CC1=O BB26-0804 [0,1,0,0,0,1|1,0,1]=4 56 B14R1.350 COC1=C(OC)C(I)=CC(C(=O)O)=C1 BB17-2461 [0,2,0,0,0,0|0,0,0]=2 57 B14R1.362 COC1=CC([N+](=O)[O-])=CC(C=O)=C1O BB12-2868 [0,2,0,0,0,0|1,0,1]=4 58 B14R1.676 CC(=O)NC1=CC(C(=O)O)=CC=C1Cl BB17-2573 [0,2,0,0,0,0|2,0,0]=4 59 B14R1.43 NNC1=CC(C(=O)O)=CC=C1C(=O)O BB56-0401 [0,2,0,0,0,0|2,0,0]=4 60 B14R1.2023 COC1=C(OC)C(Br)=C([N+](=O)[O-])C=C1 BB17-0675 [0,2,0,0,0,0|1,0,1]=4 61 B12R2.44 ClCC1=CC2=C(C=C1)OCO2 BB01-4892 [1,0,0,1,0,0|1,0,1]=4 62 B14R2.966 NC(CO)C1=CC2=C(C=C1)OCO2 BB56-2231 [0,1,0,1,0,0|1,0,1]=4 63 B14R2.601 CC1=CC2=CC(C(=O)O)=CC=C2O1 BB12-1983 [0,1,0,1,0,0|1,0,0]=3 64 B12R1.87 COC1=C(C(N)=O)C=CC=C1C BB17-0496 [0,0,0,0,1,1|2,0,0]=4 65 B14R1.42 COC1=CC(\C=C\C(=O)O)=CC=C1O BB12-2811 [0,0,0,0,0,2|0,0,0]=2