0  B9R1.33  CC1=NC=CN1CCN M10690687P [0,0,0,0,0,0|3,0,0]=3
1  B8R1.8  BrCCC1=CC=CS1 M10194071P [1,0,0,0,0,0|2,0,0]=3
2  B8R1.8  ClCCN1C=CN=C1 M10158400P [1,0,0,0,0,0|3,0,0]=4
3  B8R1.8  NCCC1=CNC=N1 M10000170P [1,0,0,0,0,0|2,0,1]=4
4  B8R1.8  NCCC1=CSC=C1 M10306606P [1,0,0,0,0,0|3,0,0]=4
5  B8R1.11  N#CC1=C(C)C=CS1 M10282344P [1,0,0,0,0,0|2,0,1]=4
6  B8R1.11  NC1=NNC=C1CC M10250285P [1,0,0,0,0,0|3,0,0]=4
7  B8R1.11  OCC1=C(Br)N=CS1 M10848388P [1,0,0,0,0,0|1,0,0]=2
8  B8R1.11  OCC1=C(Br)SC=C1 M10437755P [1,0,0,0,0,0|3,0,0]=4
9  B8R1.11  OCC1=C(C)SC=N1 M10997559P [1,0,0,0,0,0|2,0,0]=3
10  B10R1.29  N#CCCN1C=CN=C1C M10182689P [0,1,0,0,0,0|3,0,0]=4
11  B10R1.64  O=C(O)CC1=C(C)N=CS1 M10069998P [0,1,0,0,0,0|0,0,1]=2
12  B10R1.149  O=C(C1=C(C)N=CS1)OC M10483938P [0,1,0,0,0,0|2,0,1]=4
13  B10R2.7  C=12C=CSC1CCNC2 M10279367P [0,0,0,1,0,0|2,0,0]=3
14  B10R2.7  C=12NC=NC1CCNC2 M10016963P [0,0,0,1,0,0|2,0,1]=4
15  B10R2.7  C=12NC=NC1CCNC2 M10353812P [0,0,0,1,0,0|2,0,1]=4
16  B10R1.4  CC1=CC=CC=C1CCO M10162794P [0,0,0,0,0,1|2,0,0]=3
17  B10R1.4  CC1=NC=CN=C1OCC M10218072P [0,0,0,0,0,1|3,0,0]=4
18  B10R1.4  FC1=CC=CC=C1CCO M10256724P [0,0,0,0,0,1|3,0,0]=4
19  B10R1.10  CC1=CC(CCO)=CC=C1 M10037423P [0,0,0,0,0,1|2,0,0]=3
20  B10R1.10  ClC1=NC=CC(CCN)=N1 M10506927P [0,0,0,0,0,1|3,0,0]=4
21  B10R1.10  FC1=CC(CCO)=CC=C1 M10263285P [0,0,0,0,0,1|3,0,0]=4
22  B10R1.10  NC1=CC(CCO)=CC=C1 M10264436P [0,0,0,0,0,1|3,0,0]=4
23  B7R1.1  CCC1=NC=CS1 M10138064P [2,0,0,0,0,0|2,0,0]=4
24  B7R1.1  CCN1N=CN=C1 M10145084P [2,0,0,0,0,0|2,0,0]=4
25  B7R1.1  ClCC1=CC=CS1 M10020165P [2,0,0,0,0,0|2,0,0]=4
26  B7R1.1  NCC1=CN=CO1 M10111263P [2,0,0,0,0,0|1,1,0]=4
27  B7R1.1  NCC1=CN=CS1 M10790734P [2,0,0,0,0,0|1,0,0]=3
28  B7R1.1  OCC1=CNC=N1 M10021336P [2,0,0,0,0,0|1,0,1]=4
29  B7R1.1  SCC1=CC=CS1 M10085524P [2,0,0,0,0,0|1,1,0]=4
30  B7R1.4  CC1=C(C)SC=C1 M11197216P [2,0,0,0,0,0|1,0,0]=3
31  B7R1.4  CC1=CNN=C1C M10047993P [2,0,0,0,0,0|2,0,0]=4
32  B7R1.4  CC1=CNN=C1C M10830281P [2,0,0,0,0,0|2,0,0]=4
33  B9R1.12  CCCCC1=CC=CS1 M10031024P [1,1,0,0,0,0|2,0,0]=4
34  B9R1.22  OCC1=C(C)OC(C)=N1 M10612235P [1,1,0,0,0,0|2,0,0]=4
35  B9R1.27  CC1=CNC(C)=C1CC M10012904P [1,1,0,0,0,0|1,0,1]=4
36  B9R1.41  CC1=C(B(O)O)SC=C1 M10806176P [1,1,0,0,0,0|2,0,0]=4
37  B11R1.189  COC1=CC(CCO)=CC=C1 M10068061P [0,1,0,0,0,1|2,0,0]=4
38  B11R2.20  C12=C(N=CC=N1)CCCC2 M10223803P [0,0,0,1,0,1|2,0,0]=4