0  B19R2.82512  CC1=C(CCO)SC=[N]1Cc2cnc(C)nc2N Amb17679044 [0,0,0,0,0,0|0,0,0]=0
1  B19R2.82512  Cc1[n]c(N)c(C[n+]2c[s]c(CCCl)c2C)c[n]1 Amb22054374 [0,0,0,0,0,0|1,0,0]=1
2  B19R2.82512  Cc1c(CCO)sc[n+]1Cc2cnc(C)nc2N Amb17943814 [0,0,0,0,0,0|0,0,0]=0
3  B19R2.82512  Cc1ccc(C[n+]2c[s]c(CCO)c2C)c(N)[n]1 Amb24088296 [0,0,0,0,0,0|1,0,0]=1
4  B19R2.82512  OCC[13c]1sc[n+]([13c]1[13CH3])Cc2cnc(nc2N)C Amb17620580 [0,0,0,0,0,0|0,0,0]=0
5  B19R2.82512  OCCc1sc[n+](c1C)Cc2cnc(nc2O)C Amb10843892 [0,0,0,0,0,0|1,0,0]=1
6  B18R2.52913  OCCc1sc[n+](c1C)Cc2cncnc2N Amb17618751 [1,0,0,0,0,0|0,0,0]=1
7  B18R2.53152  Cc1[n]cc(C[n+]2cc(CCO)[s]c2)c(N)[n]1 Amb22261454 [1,0,0,0,0,0|0,0,0]=1
8  B20R2.125772  Cc1c(CCO)[s]c[n+]1Cc2c[n]c(C)[n]c2N=O Amb22265111 [0,1,0,0,0,0|0,0,1]=2
9  B20R2.125774  OCCc1sc[n+](c1C)Cc2cnc(nc2N)CC Amb17614188 [0,1,0,0,0,0|0,0,0]=1
10  B20R2.180809  Cc1[n]cc(CN2C(=O)SC(CCO)=C2C)c(N)[n]1 Amb19133552 [0,1,0,0,0,0|0,0,1]=2
11  B20R2.180809  Cc1[n]cc(CN2C(=S)SC(CCO)=C2C)c(N)[n]1 Amb18548674 [0,1,0,0,0,0|0,0,1]=2
12  B20R2.346603  Cc1[n]c(O)c(C[n+]2c[s]c(CCO)c2C)c(N)[n]1 Amb22734103 [0,1,0,0,0,0|0,0,0]=1
13  B20R3.18155065  CC1=C(CCO)SC2=Nc3nc(C)ncc3CN12 Amb17938048 [0,0,0,1,0,0|0,0,2]=3
14  B20R2.182815  OCCc1ccc[n+](c1C)Cc2cnc(nc2N)C Amb17619725 [0,0,0,0,0,1|1,0,0]=2
15  B17R2.4563  CC1=C(CCO)SC=[N]1Cc2ccccc2 Amb17679046 [2,0,0,0,0,0|2,0,0]=4
16  B17R2.4563  OCCc1sc[n+](c1C)Cc2ccccc2 Amb1631304 [2,0,0,0,0,0|2,0,0]=4
17  B17R2.4563  OCCc1sc[n+](c1C)Cc2ccccc2 Amb1911515 [2,0,0,0,0,0|2,0,0]=4
18  B21R2.4126309  OCCc1sc[n+](c1C)Cc2cn(CC)c(nc2=O)C Amb10573519 [0,2,0,0,0,0|1,0,1]=4