0  B9R1.33  CC1=C(CC#N)N=CN1 4743AE [0,0,0,0,0,0|2,0,2]=4
1  B8R1.8  ClCCC1=CNC=N1 6287AA [1,0,0,0,0,0|2,0,1]=4
2  B8R1.8  ClCCN1C=NC=N1 3602AB [1,0,0,0,0,0|3,0,0]=4
3  B8R1.8  OCCN1C=NC=N1 0298AE [1,0,0,0,0,0|2,0,0]=3
4  B8R1.11  CC1=C(CN)SC=C1 0965AA [1,0,0,0,0,0|2,0,0]=3
5  B10R1.5  CCCN1C=CN=C1CN 1963AF [0,1,0,0,0,0|3,0,0]=4
6  B10R1.29  CN1C=CN=C1SCCO Y9349 [0,1,0,0,0,0|3,0,0]=4
7  B10R1.187  CC1=NNC(C)=C1CCN 3104AE [0,1,0,0,0,0|3,0,0]=4
8  B10R2.2  N[C@H]1CC2=NC=CN2C1 9192AH [0,0,0,1,0,0|3,0,0]=4
9  B10R2.7  C1=CC2=C(C1)CCCC2 S943 [0,0,0,1,0,0|3,0,0]=4
10  B10R2.7  C1=NC2=C(COCC2)N1 2072AJ [0,0,0,1,0,0|1,0,1]=3
11  B10R1.4  CCCC1=C(C)C=CN=C1 Z0694 [0,0,0,0,0,1|3,0,0]=4
12  B10R1.10  CC1=CC(CCN)=CC=C1 1118AJ [0,0,0,0,0,1|3,0,0]=4
13  B10R1.10  CC1=CC(CCN)=CC=C1 W6970 [0,0,0,0,0,1|3,0,0]=4
14  B7R0.5  C=C(C)C(=O)NCO V0404 [1,0,1,0,0,0|1,1,0]=4
15  B7R1.1  CNC1=CC=CS1 1494AC [2,0,0,0,0,0|2,0,0]=4
16  B7R1.1  NCC1=CN=CO1 Y4206 [2,0,0,0,0,0|1,1,0]=4
17  B7R1.1  OCC1=CSC=N1 Y7005 [2,0,0,0,0,0|2,0,0]=4
18  B7R1.4  CC1=C(C)SC=C1 Z5548 [2,0,0,0,0,0|1,0,0]=3
19  B9R1.7  CCCC1=CN=C(Br)O1 Y3059 [1,1,0,0,0,0|1,1,0]=4
20  B9R1.7  NCCC1=CC=C(Br)S1 4915AB [1,1,0,0,0,0|2,0,0]=4
21  B9R1.7  NCCC1=CC=C(Cl)S1 1212AJ [1,1,0,0,0,0|2,0,0]=4
22  B9R1.7  O=C1CC=C(CCO)O1 3979AC [1,1,0,0,0,0|1,1,0]=4
23  B9R1.11  CCC(N)C1=CC=CS1 7066AE [1,1,0,0,0,0|2,0,0]=4
24  B9R1.11  NCC(O)C1=CC=CS1 9385AJ [1,1,0,0,0,0|2,0,0]=4
25  B9R1.13  CC(N)CC1=CC=CS1 3185AB [1,1,0,0,0,0|2,0,0]=4
26  B9R2.3  C1=NC2=C(CNC2)S1 3032AJ [1,0,0,1,0,0|2,0,0]=4
27  B9R2.3  C1=NC2=C(CNC2)S1 3033AJ [1,0,0,1,0,0|2,0,0]=4
28  B11R2.18  C1=CC2=C(CNCCC2)S1 3011AJ [0,1,0,1,0,0|2,0,0]=4