0  B8R1.18  C=C1CC(=O)OC1=O T5321 [0,0,0,0,0,0|3,0,1]=4
1  B8R1.18  CC1=CC(=O)C(C)O1 T22309 [0,0,0,0,0,0|2,0,1]=3
2  B8R1.18  CN1CC(=O)N=C1N T0496 [0,0,0,0,0,0|4,0,0]=4
3  B7R1.2  Cc1cc(N)no1 T0644 [1,0,0,0,0,0|3,0,0]=4
4  B7R1.2  Cn1ccc(N)n1 T3295 [1,0,0,0,0,0|3,0,0]=4
5  B9R1.22  CC1=CC(C)=C(C=O)N1 T21347 [0,1,0,0,0,0|1,0,2]=4
6  B9R1.37  CC1=C(O)C(=O)C(C)O1 T5547 [0,1,0,0,0,0|2,0,1]=4
7  B6R0.2  CC(C)=CC(=O)O T5305 [1,0,1,0,0,0|2,0,0]=4
8  B6R0.3  CC(=O)\C(C)=N\O T2176 [1,0,1,0,0,0|1,0,1]=4
9  B6R0.3  C\C=C(/C)C(=O)O T5542 [1,0,1,0,0,0|1,0,0]=3
10  B6R0.3  C\C=C(\C)C(=O)O T3328 [1,0,1,0,0,0|1,0,0]=3
11  B6R1.2  Cn1ccnc1 T0575 [2,0,0,0,0,0|2,0,0]=4
12  B6R1.2  Nc1nccs1 T0495 [2,0,0,0,0,0|1,1,0]=4
13  B8R1.1  CC1=CC=C(C=O)O1 TCP2934 [1,1,0,0,0,0|1,0,1]=4
14  B8R1.11  CSc1nccn1C T8612 [1,1,0,0,0,0|2,0,0]=4
15  B10R1.30  CCc1nc(C)ccc1O T7875 [0,1,0,0,0,1|2,0,0]=4
16  B10R1.30  CCc1nc(C)ccc1O T8624 [0,1,0,0,0,1|2,0,0]=4
17  B10R1.118  Cc1nc(C)c(C)nc1C T2722 [0,1,0,0,0,1|1,0,0]=3
18  B10R1.118  Cc1nc(C)c(C)nc1C T2953 [0,1,0,0,0,1|1,0,0]=3
19  B10R1.130  CC1=C(CCN)SC(N)=N1 T22570 [0,2,0,0,0,0|1,1,0]=4
20  B8R1.3  Cc1cnc(C)cn1 T4801 [1,0,0,0,0,1|1,0,0]=3