0  B9R1.69  Cc1c[nH]c(=O)nc1N T5270 [0,0,0,0,0,0|4,0,0]=4
1  B9R1.69  Cc1cc(O)ccc1N T21284 [0,0,0,0,0,0|4,0,0]=4
2  B9R1.69  Cc1cc(ccc1O)O TN4871 [0,0,0,0,0,0|4,0,0]=4
3  B9R1.69  Cc1ccc(N)c(C)c1 T21114 [0,0,0,0,0,0|3,0,0]=3
4  B9R1.69  Cc1ccc(N)c(N)c1 T7988 [0,0,0,0,0,0|4,0,0]=4
5  B9R1.69  Cc1ccc(O)c(N)c1 T9441 [0,0,0,0,0,0|4,0,0]=4
6  B9R1.69  Cc1ccc(O)c(O)c1 T4779 [0,0,0,0,0,0|4,0,0]=4
7  B9R1.69  Cc1cnc(O)c(C)n1 T31572 [0,0,0,0,0,0|1,0,0]=1
8  B9R1.69  Cc1n[nH]c(=O)[nH]c1=O T8648 [0,0,0,0,0,0|3,0,1]=4
9  B9R1.69  Cn1ccc(N)nc1=O T10019 [0,0,0,0,0,0|4,0,0]=4
10  B8R1.3  Cc1cnc(C)cn1 T4801 [1,0,0,0,0,0|0,0,0]=1
11  B8R1.3  Nc1ccc(Cl)nc1 T7234 [1,0,0,0,0,0|3,0,0]=4
12  B8R1.4  Cc1cccc(O)c1 T33229 [1,0,0,0,0,0|3,0,0]=4
13  B8R1.4  Cc1cccc([O-])c1 T33983 [1,0,0,0,0,0|3,0,0]=4
14  B8R1.4  Oc1cccc(O)n1 T4720 [1,0,0,0,0,0|3,0,0]=4
15  B8R1.5  Cc1ncccc1O T5901 [1,0,0,0,0,0|2,0,0]=3
16  B8R1.5  Nc1ncccc1O T7923 [1,0,0,0,0,0|3,0,0]=4
17  B10R1.25  CCc1ccc(C)cc1O T29345 [0,1,0,0,0,0|3,0,0]=4
18  B10R1.25  CSc1ccc(C)cc1O T33232 [0,1,0,0,0,0|3,0,0]=4
19  B10R1.30  CCc1nc(C)ccc1O T7875 [0,1,0,0,0,0|2,0,0]=3
20  B10R1.30  CCc1nc(C)ccc1O T8624 [0,1,0,0,0,0|2,0,0]=3
21  B10R1.30  COc1cc(C)ccc1O T20446 [0,1,0,0,0,0|3,0,0]=4
22  B10R1.118  Cc1nc(C)c(C)nc1C T2722 [0,1,0,0,0,0|0,0,0]=1
23  B10R1.118  Cc1nc(C)c(C)nc1C T2953 [0,1,0,0,0,0|0,0,0]=1
24  B8R1.18  CC1=CC(=O)OC1=O TN6957 [0,0,0,0,1,0|3,0,0]=4
25  B8R1.18  CC1OC(C)=CC1=O T22309 [0,0,0,0,1,0|2,0,1]=4
26  B7R0.10  C/C(=N\O)/C(/C)=N/O T20408 [1,0,1,0,0,0|2,0,0]=4
27  B7R1.3  Cc1ccccn1 T21323 [2,0,0,0,0,0|1,0,0]=3
28  B7R1.3  Clc1cnccn1 T2193 [2,0,0,0,0,0|1,0,0]=3
29  B7R1.3  Nc1nccnn1 T8826 [2,0,0,0,0,0|2,0,0]=4
30  B9R1.1  Clc1cnc(cn1)C#N T3507 [1,1,0,0,0,0|1,0,1]=4
31  B9R1.1  OCc1ccc(cn1)O T40502 [1,1,0,0,0,0|2,0,0]=4
32  B9R1.2  CNc1cccc(C)c1 T0557 [1,1,0,0,0,0|2,0,0]=4
33  B9R1.2  COc1cccc(C)c1 T21278 [1,1,0,0,0,0|2,0,0]=4
34  B9R1.22  Cc1cc(C)c(C=O)[nH]1 T21347 [0,1,0,0,1,0|0,0,2]=4
35  B11R1.278  Cc1ncc(CO)c(C)c1O T38294 [0,2,0,0,0,0|2,0,0]=4
36  B7R1.2  Cc1cc(N)no1 T0644 [1,0,0,0,1,0|2,0,0]=4
37  B9R0.1  C\C(C)=C/C=C/C(C)=C/C T20298 [0,0,1,0,0,1|2,0,0]=4