0  B8R1.8  NCCC1=CN=CN1 M14782 [0,0,0,0,0,0|0,0,0]=0
1  B8R1.8  NCCC1=CNC=N1 M18704 [0,0,0,0,0,0|0,0,2]=2
2  B9R1.7  CN1C=NC(CCN)=C1 M22893 [0,1,0,0,0,0|0,0,2]=3
3  B9R1.33  CC1=C(CCCl)SC=N1 M26108 [0,1,0,0,0,0|2,0,0]=3
4  B9R1.33  Cc1ncsc1CCCl M24511 [0,1,0,0,0,0|2,0,0]=3
5  B9R1.33  Cn1cncc1CCN M19737 [0,1,0,0,0,0|0,0,0]=1
6  B9R1.8  NCCc1ccccc1 M18943 [0,0,0,0,0,1|2,0,0]=3
7  B9R1.8  NCCc1ccccc1 M20880 [0,0,0,0,0,1|2,0,0]=3
8  B9R1.8  NCCc1ccccn1 M24275 [0,0,0,0,0,1|1,0,1]=3
9  B9R1.8  OCCC1=CC=CC=C1 M15237 [0,0,0,0,0,1|3,0,0]=4
10  B9R1.8  OCCC1=CC=CC=N1 M10186 [0,0,0,0,0,1|2,0,1]=4
11  B6R0.6  CCC\C=C\C=O M21392 [1,0,1,0,0,0|2,0,0]=4
12  B6R1.2  CC1=CNN=C1 M15874 [2,0,0,0,0,0|2,0,0]=4
13  B6R1.2  CN1C=CN=C1 M15328 [2,0,0,0,0,0|2,0,0]=4
14  B10R1.1  NCCC1=CC=C(O)C=C1 M13750 [0,1,0,0,0,1|2,0,0]=4
15  B10R1.1  NCCc1ccc(O)cc1 M18703 [0,1,0,0,0,1|2,0,0]=4
16  B10R1.1  NCCc1ccc(O)cc1 M21102 [0,1,0,0,0,1|2,0,0]=4
17  B10R1.15  NCC(O)c1ccccc1 M19713 [0,1,0,0,0,1|2,0,0]=4
18  B10R1.17  CNCCC1=CC=CC=N1 M14976 [0,1,0,0,0,1|1,0,1]=4
19  B10R1.17  CNCCC1=CC=CC=N1 M15030 [0,1,0,0,0,1|1,0,1]=4
20  B10R1.17  CNCCc1ccccn1 M18815 [0,1,0,0,0,1|1,0,1]=4
21  B10R1.17  NNCCC1=CC=CC=C1 M28748 [0,1,0,0,0,1|2,0,0]=4
22  B10R1.17  NNCCc1ccccc1 M22671 [0,1,0,0,0,1|2,0,0]=4
23  B10R1.17  NNCCc1ccccc1 M28381 [0,1,0,0,0,1|2,0,0]=4
24  B10R1.130  Cc1nc(N)sc1CCN M28465 [0,2,0,0,0,0|1,0,0]=3
25  B8R1.2  NCC1=CC=CN=C1 M14288 [0,0,1,1,0,0|1,0,1]=4
26  B8R1.4  O=C1CCNC(=O)N1 M19694 [0,0,1,1,0,0|2,0,0]=4