0 B11R1.3 CC(C)C1=CC=C(NN)C=C1 BB56-1861 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.3 NC(=O)C1=CC=C(C=O)C=C1 BB12-1599 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.3 CCC1=CC=C(NN)C=C1 BB56-0994 [1,0,0,0,0,0|2,0,0]=3 3 B10R1.3 COC1=CC=C(NN)C=C1 BB56-2536 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.3 NCC1=CC=C(CO)C=C1 BB12-1471 [1,0,0,0,0,0|1,0,2]=4 5 B10R1.3 [C-]#[N+]C1=CC=C(CC)C=C1 BB56-1198 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.5 CCC(C)C1=CC=C(NN)C=C1 BB56-0337 [0,1,0,0,0,0|2,0,0]=3 9 B12R1.5 CSC1=CC=C(C(N)CO)C=C1 BB56-2165 [0,1,0,0,0,0|3,0,0]=4 10 B12R1.6 CC(C)(C)C1=CC=C(NN)C=C1 BB56-2619 [0,1,0,0,0,0|2,0,0]=3 11 B12R1.6 NS(=O)(=O)C1=CC=C(C=O)C=C1 BB12-2131 [0,1,0,0,0,0|3,0,0]=4 12 B12R1.48 COC1=C(F)C=C(C(C)N)C=C1 BB53-1497 [0,1,0,0,0,0|3,0,0]=4 13 B12R1.113 CC(=O)C1=CC=C(N=C=O)C=C1 BB01-6587 [0,1,0,0,0,0|1,0,2]=4 14 B12R1.113 CC(C)C1=CC=C(N=C=S)C=C1 BB53-1310 [0,1,0,0,0,0|0,1,1]=3 15 B12R1.256 CN(C)C1=CC=C([N+](=O)[O-])C=C1 BB17-0745 [0,1,0,0,0,0|2,0,0]=3 16 B12R1.256 CN(C)C1=NC=C(C(=O)O)C=C1 BB12-3628 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.31 CN(C)C1=CC=C(C=O)O1 BB17-1323 [0,0,0,0,1,0|2,0,0]=3 18 B9R1.1 CC1=CN=C(C=O)C=C1 BB12-2174 [2,0,0,0,0,0|1,0,0]=3 19 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [2,0,0,0,0,0|1,0,1]=4 20 B11R1.83 [C-]#[N+]C1=CC=C(OCC)C=C1 BB56-1768 [1,1,0,0,0,0|2,0,0]=4 21 B11R1.279 COC1=C(I)C=C(C=O)C=C1 BB17-1449 [1,1,0,0,0,0|1,0,0]=3 22 B11R1.21 CC(N)C1=CC(Cl)=C(Cl)C=C1 BB17-1112 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 BB53-1533 [1,1,0,0,0,0|1,0,1]=4 24 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [1,1,0,0,0,0|1,0,1]=4 25 B11R1.22 CNC(C)C1=CC=C(F)C=C1 BB12-1331 [1,1,0,0,0,0|1,0,0]=3 26 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 BB56-2167 [1,1,0,0,0,0|2,0,0]=4 27 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 BB56-2226 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.22 NC(CO)C1=CC=C(F)C=C1 BB12-1444 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.22 [C-]#[N+]C(C)C1=CC=C(Cl)C=C1 BB56-1668 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.166 CN(C)C1=CC=C(Br)C=C1N BB12-2661 [1,1,0,0,0,0|2,0,0]=4 31 B11R1.175 CC(C)C1=CC(C(=O)Cl)=NO1 BB55-4168 [0,1,0,0,1,0|2,0,0]=4 32 B11R1.175 CC(C)C1=CC(C(=O)O)=NO1 BB55-3899 [0,1,0,0,1,0|2,0,0]=4 33 B11R1.175 CC(C)C1=NC(C(=O)O)=CS1 BB12-3273 [0,1,0,0,1,0|2,0,0]=4 34 B11R1.175 CC(C)N1C=C(C(=O)O)C=N1 BB12-1474 [0,1,0,0,1,0|2,0,0]=4 35 B13R1.585 CC(=O)NC1=CC=C(C(C)=O)C=C1 BB12-1266 [0,1,0,0,0,1|1,0,1]=4 36 B13R1.585 CC(C)OC1=CC=C(C(N)=O)C=C1 BB17-0471 [0,1,0,0,0,1|0,0,0]=2 37 B13R1.653 CC(C)OC1=CC=C(C=O)C=C1Br BB17-1887 [0,1,0,0,0,1|0,0,0]=2 38 B13R1.537 CC(C)C1=CC=C(C(N)CO)C=C1 BB56-2163 [0,2,0,0,0,0|0,0,2]=4 39 B13R1.537 CN(C)C1=CC=C(\C(N)=N\O)C=C1 BB01-3936 [0,2,0,0,0,0|1,0,1]=4 40 B13R1.3088 CNC(C)C1=CC(F)=C(OC)C=C1 BB53-1614 [0,2,0,0,0,0|2,0,0]=4 41 B13R1.120 CN(C)C1=C(N)C=C(C(=O)O)C=C1 BB12-4764 [0,2,0,0,0,0|1,0,0]=3 42 B11R2.21 O=CC1=CC(C2CC2)=NN1 BB12-3455 [0,0,0,1,1,0|2,0,0]=4