0 B11R2.191 C=Cn1cnc2sccc21 Amb27862933 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.21 O=CNCCc1ccoc1 Amb29872332 [0,0,1,0,0,0|2,0,1]=4 2 B10R1.161 O=Cc1ccoccoc1 Amb28050025 [0,0,1,0,0,0|3,0,0]=4 3 B12R3.1603 C1=Cc2cnc3ncc1c23 Amb28143471 [0,0,0,1,0,0|3,0,0]=4 4 B12R2.1 C=CC1C=Nc2ccccc21 Amb28368575 [0,0,0,0,0,1|3,0,0]=4 5 B12R2.1 C=Cn1cnc2ccccc21 Amb1035881 [0,0,0,0,0,1|2,0,0]=3 6 B12R2.1 C=Cn1cnc2cncnc21 Amb25682380 [0,0,0,0,0,1|2,0,0]=3 7 B12R2.1 C=Cn1nnc2ccccc21 Amb10559409 [0,0,0,0,0,1|3,0,0]=4 8 B12R2.1 CCn1cnc2ccccc21 Amb1104116 [0,0,0,0,0,1|2,0,1]=4 9 B12R2.1 CCn1cnc2cccnc21 Amb24078855 [0,0,0,0,0,1|2,0,1]=4 10 B12R2.1 CCn1cnc2cncnc21 Amb24700641 [0,0,0,0,0,1|2,0,1]=4 11 B12R2.1 CCn1cnc2ncccc21 Amb24089042 [0,0,0,0,0,1|2,0,1]=4 12 B12R2.1 CNn1cnc2ccccc21 Amb26640547 [0,0,0,0,0,1|3,0,0]=4 13 B12R2.1 N#Cn1cnc2ncncc21 Amb25350607 [0,0,0,0,0,1|1,0,2]=4 14 B12R2.1 O=CC1C=Nc2ccccc21 Amb21952746 [0,0,0,0,0,1|3,0,0]=4 15 B12R2.1 O=Cn1nnc2ccccc21 Amb3374289 [0,0,0,0,0,1|3,0,0]=4 16 B12R2.1 O=Nn1cnc2ccccc21 Amb26451421 [0,0,0,0,0,1|3,0,0]=4 17 B12R2.1 OCn1cnc2ccccc21 Amb1151978 [0,0,0,0,0,1|2,0,1]=4 18 B12R2.1 OCn1cnc2cncnc21 Amb27758883 [0,0,0,0,0,1|2,0,1]=4 19 B12R2.44 O=Cc1ccc2cocc2c1 Amb18831460 [0,0,0,0,0,1|3,0,0]=4 20 B12R2.315 O=Cc1cccc2cocc12 Amb24529551 [0,0,0,0,0,1|3,0,0]=4 21 B9R1.14 C=Cc1cncn1CC Amb26479035 [1,0,1,0,0,0|1,0,1]=4 22 B9R1.12 O=CNCc1ccoc1 Amb28188531 [1,0,1,0,0,0|1,0,1]=4 23 B9R1.12 O=C\C=C\c1ccoc1 Amb33136412 [1,0,1,0,0,0|2,0,0]=4 24 B11R1.172 CC(=N)NCCc1ccoc1 Amb29872195 [0,1,1,0,0,0|1,0,1]=4 25 B11R1.172 N=C(N)NCCc1ccoc1 Amb35605283 [0,1,1,0,0,0|1,0,1]=4 26 B11R1.44 C=Cn1cnc(C(=O)OC)c1 Amb27227747 [0,1,1,0,0,0|1,0,1]=4 27 B13R2.1 C=C=Cn1cnc2ccccc21 Amb27768003 [0,1,0,0,0,1|2,0,0]=4 28 B13R2.1 C=CCn1cnc2ccccc21 Amb1744546 [0,1,0,0,0,1|2,0,0]=4 29 B13R2.1 O=CCn1cnc2cncnc21 Amb18829826 [0,1,0,0,0,1|2,0,0]=4 30 B13R2.9 C=Cn1cnc2c(N)ncnc21 Amb28436854 [0,1,0,0,0,1|2,0,0]=4 31 B13R2.72 C=C(C)n1cnc2ccccc21 Amb27615230 [0,1,0,0,0,1|2,0,0]=4 32 B13R2.72 CC(=O)n1cnc2ncncc21 Amb27590238 [0,1,0,0,0,1|2,0,0]=4 33 B13R2.72 N=C(N)n1nnc2ccccc21 Amb27668966 [0,1,0,0,0,1|2,0,0]=4 34 B13R2.72 N=C(N)n1nnc2ccccc21 Amb5719675 [0,1,0,0,0,1|2,0,0]=4 35 B11R2.18 C1=CN=CN2C=NNC2=C1 Amb25758972 [0,0,1,1,0,0|2,0,0]=4 36 B11R2.106 Brc1cccc2cncn12 Amb22169741 [0,0,1,1,0,0|2,0,0]=4 37 B11R2.106 Brc1cccc2cncn12 Amb30594754 [0,0,1,1,0,0|2,0,0]=4 38 B11R2.106 Cc1cccc2cncn12 Amb22494013 [0,0,1,1,0,0|2,0,0]=4 39 B11R2.106 Clc1cccc2cncn12 Amb25147799 [0,0,1,1,0,0|2,0,0]=4 40 B11R2.106 Fc1cccc2cncn12 Amb26982081 [0,0,1,1,0,0|2,0,0]=4 41 B11R2.106 Ic1cccc2cncn12 Amb26935886 [0,0,1,1,0,0|2,0,0]=4 42 B11R2.106 Nc1cccc2cncn12 Amb22751511 [0,0,1,1,0,0|1,0,1]=4 43 B11R2.106 Oc1cccc2cncn12 Amb27972019 [0,0,1,1,0,0|2,0,0]=4 44 B11R2.2 c1cc(-c2cnoc2)co1 Amb27623516 [0,0,1,1,0,0|2,0,0]=4