0 B9R1.15 COc1ccccc1O T1301 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.15 NCc1ccccc1O T41358 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.15 OCc1ccccc1O T0311 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.2 COc1cnccn1 TN6755 [1,0,0,0,0,0|1,0,0]=2 4 B8R1.2 NCc1ccccc1 TN3497 [1,0,0,0,0,0|3,0,0]=4 5 B8R1.2 NCc1cccnc1 T1581 [1,0,0,0,0,0|2,0,0]=3 6 B8R1.2 OCc1ccccc1 T0732 [1,0,0,0,0,0|3,0,0]=4 7 B8R1.2 OCc1ccccn1 T1112 [1,0,0,0,0,0|2,0,0]=3 8 B8R1.2 OCc1cccnc1 T1299 [1,0,0,0,0,0|2,0,0]=3 9 B8R1.5 Cc1ncccc1O T5901 [1,0,0,0,0,0|2,0,0]=3 10 B8R1.5 Nc1ncccc1O T7923 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.2 CCc1occc(=O)c1O T5566 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.4 CCOc1ccccc1Br T20308 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.4 CSCc1ccccc1O T33357 [0,1,0,0,0,0|3,0,0]=4 14 B10R1.20 COc1ccccc1CN T1372 [0,1,0,0,0,0|3,0,0]=4 15 B10R1.20 COc1ccccc1OC T20326 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.25 CCc1ccc(C)cc1O T29345 [0,1,0,0,0,0|3,0,0]=4 17 B10R1.30 CCc1nc(C)ccc1O T7875 [0,1,0,0,0,0|2,0,0]=3 18 B10R1.30 CCc1nc(C)ccc1O T8624 [0,1,0,0,0,0|2,0,0]=3 19 B10R1.61 CC(=O)c1ccccc1C T36788 [0,1,0,0,0,0|2,0,1]=4 20 B10R1.61 NC(=O)c1nccnc1O T7785 [0,1,0,0,0,0|2,0,1]=4 21 B10R1.245 COc1c(C)cccc1O T29355 [0,1,0,0,0,0|3,0,0]=4 22 B10R2.7 C1Cc2ccccc2O1 Fr14127 [0,0,0,1,0,0|3,0,0]=4 23 B8R1.11 CSc1nccn1C T8612 [0,0,0,0,1,0|2,0,0]=3 24 B7R0.10 C/C(=N\O)/C(/C)=N/O T20408 [1,0,1,0,0,0|2,0,0]=4 25 B7R1.3 Cc1ccccn1 T21323 [2,0,0,0,0,0|1,0,0]=3 26 B7R1.3 Clc1cnccn1 T2193 [2,0,0,0,0,0|1,0,0]=3 27 B7R1.3 Nc1nccnn1 T8826 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.1 CCc1ccc(O)cc1 T5883 [1,1,0,0,0,0|2,0,0]=4 29 B9R1.1 Clc1cnc(cn1)C#N T3507 [1,1,0,0,0,0|1,0,1]=4 30 B9R1.1 OCc1ccc(cn1)O T40502 [1,1,0,0,0,0|2,0,0]=4 31 B9R1.2 CCc1cccc(N)c1 T21169 [1,1,0,0,0,0|2,0,0]=4 32 B9R1.2 CCc1cccc(O)c1 T21170 [1,1,0,0,0,0|2,0,0]=4 33 B9R1.6 CC(=O)c1cnccn1 T5596 [1,1,0,0,0,0|0,0,1]=3 34 B9R1.6 C[C@H](O)c1ccccc1 T4784 [1,1,0,0,0,0|2,0,0]=4 35 B9R1.6 NC(=O)c1cnccn1 T1426 [1,1,0,0,0,0|1,0,1]=4 36 B9R1.6 OC(=O)c1cnccn1 T0569 [1,1,0,0,0,0|1,0,1]=4 37 B9R1.8 CCOc1ccccc1 T19753 [1,1,0,0,0,0|2,0,0]=4 38 B9R1.8 CNCc1ccccc1 T8016 [1,1,0,0,0,0|2,0,0]=4 39 B9R1.8 NCCc1ccccc1 T2935 [1,1,0,0,0,0|2,0,0]=4 40 B9R1.8 NCCc1ccccc1 T7433 [1,1,0,0,0,0|2,0,0]=4 41 B9R1.8 NCCc1ccccn1 T22501 [1,1,0,0,0,0|1,0,0]=3 42 B9R1.8 OCCc1ccccc1 T0011 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.8 OCCc1ccccn1 T0658 [1,1,0,0,0,0|1,0,0]=3 44 B9R1.69 Cc1cnc(O)c(C)n1 T31572 [1,1,0,0,0,0|1,0,0]=3 45 B9R1.33 CC1=C(CCCl)SC=N1 T10796 [0,1,0,0,1,0|1,0,0]=3 46 B9R1.33 Cc1[nH]cnc1CCN T50049 [0,1,0,0,1,0|0,0,1]=3 47 B9R1.33 Cc1ncsc1CCCl T14983 [0,1,0,0,1,0|1,0,0]=3 48 B11R1.222 COC(=O)c1nccnc1N T22363 [0,2,0,0,0,0|1,0,1]=4 49 B7R1.1 COc1ccoc1 TN2959 [1,0,0,0,1,0|2,0,0]=4 50 B7R1.4 Cn1ccnc1S T0840 [1,0,0,0,1,0|2,0,0]=4