0 B10R1.13 CN(C)C1=CC=C(I)C=C1 BB12-5133 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.1 CC1=NC=C(C=O)C=N1 BB52-2214 [1,0,0,0,0,0|2,0,0]=3 2 B9R1.1 NC1=NC=C(C=O)C=N1 BB52-2221 [1,0,0,0,0,0|3,0,0]=4 3 B11R1.3 CCC1=NC=C(C(=O)O)C=N1 BB52-2759 [0,1,0,0,0,0|3,0,0]=4 4 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(Br)C=C1 BB12-5221 [0,1,0,0,0,0|3,0,0]=4 5 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(I)C=C1 BB12-5222 [0,1,0,0,0,0|3,0,0]=4 6 B11R1.22 CCN(C)C1=CC=C(N)C=C1 BB12-5200 [0,1,0,0,0,0|3,0,0]=4 7 B11R1.166 CC(=O)C1=CN=C(N)N=C1C BB52-6467 [0,1,0,0,0,0|3,0,0]=4 8 B11R1.166 CC(=O)C1=CN=C(O)N=C1C BB52-6466 [0,1,0,0,0,0|3,0,0]=4 9 B11R1.166 CC(=O)C1=CN=C(S)N=C1C BB52-6465 [0,1,0,0,0,0|3,0,0]=4 10 B11R1.166 CC1=C([N+](=O)[O-])C=CC(Cl)=C1 BB12-5188 [0,1,0,0,0,0|3,0,0]=4 11 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BB52-5680 [0,1,0,0,0,0|2,0,0]=3 12 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 BB52-1580 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.166 CC1=NC=C(C(=O)O)C(=O)N1 BB52-1800 [0,1,0,0,0,0|3,0,0]=4 14 B11R1.166 CN(C)C1=C(Br)C=C(I)C=C1 BB12-5134 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.166 O=C(O)C1=C(Br)C=C(O)C=C1 BB17-0814 [0,1,0,0,0,0|2,0,0]=3 16 B9R1.35 CC1=CC=C([N+](=O)[O-])O1 BB17-0710 [0,0,0,0,1,0|3,0,0]=4 17 B9R1.35 CC1=NC(C(=O)O)=CO1 BB52-2189 [0,0,0,0,1,0|3,0,0]=4 18 B9R1.35 O=C(O)C1=CC(Br)=CN1 BB52-8147 [0,0,0,0,1,0|3,0,0]=4 19 B8R1.2 O=CC1=NN=CC=C1 BB52-3335 [2,0,0,0,0,0|2,0,0]=4 20 B10R1.3 CCC1=NC=C(C=O)C=N1 BB52-2735 [1,1,0,0,0,0|2,0,0]=4 21 B10R1.3 CSC1=NC=C(C=O)C=N1 BB52-2222 [1,1,0,0,0,0|2,0,0]=4 22 B12R1.893 CC1=CC=C(C(=O)O)C(=O)N1C BB52-5681 [0,2,0,0,0,0|2,0,0]=4 23 B12R1.1005 NC(=O)C1=CC(Cl)=C(Br)C(Cl)=C1 BB12-5839 [0,2,0,0,0,0|2,0,0]=4 24 B12R1.1005 NC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1 BB12-5845 [0,2,0,0,0,0|2,0,0]=4 25 B12R1.1005 NC1=CC(C(=O)O)=CC(Cl)=C1N BB12-5853 [0,2,0,0,0,0|2,0,0]=4 26 B12R1.1005 O=C(Cl)C1=CC(Cl)=C(Br)C(Cl)=C1 BB12-5838 [0,2,0,0,0,0|2,0,0]=4 27 B12R1.1005 O=C(Cl)C1=CC(Cl)=C(Cl)C(Cl)=C1 BB12-5844 [0,2,0,0,0,0|2,0,0]=4 28 B12R1.1005 O=C(O)C1=CC(Br)=C(O)C(Cl)=C1 BB17-0741 [0,2,0,0,0,0|2,0,0]=4 29 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(=O)N1 BB52-5668 [0,2,0,0,0,0|2,0,0]=4 30 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(N)=N1 BB52-1586 [0,2,0,0,0,0|2,0,0]=4 31 B12R1.1000 CC1=CC(C)=C(C(N)=O)C(N)=N1 BB52-1591 [0,2,0,0,0,0|2,0,0]=4 32 B12R2.606 CC1=NC2=C(C=CC(N)=C2)O1 BB51-0380 [0,0,0,1,0,1|2,0,0]=4 33 B12R2.606 CC1=NC2=CC(Cl)=CC=C2N1 BB12-5463 [0,0,0,1,0,1|2,0,0]=4 34 B12R2.606 CC1=NC2=CC=C(N)C=C2N1 BB52-1070 [0,0,0,1,0,1|2,0,0]=4 35 B12R2.606 CC1=NC2=CC=C(N)C=C2S1 BB52-2319 [0,0,0,1,0,1|1,1,0]=4 36 B8R1.1 CC1=NC(C=O)=CO1 BB52-2373 [1,0,0,0,1,0|2,0,0]=4 37 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 BB12-5413 [0,0,0,0,0,2|2,0,0]=4 38 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BB12-5412 [0,0,0,0,0,2|2,0,0]=4