0  B10R1.20  C#CC1=C(OC)N=CC=N1 F8885-4902 [0,0,0,0,0,0|0,1,2]=3
1  B10R1.20  C#CC1=CC=CN=C1OC F2147-2845 [0,0,0,0,0,0|1,1,2]=4
2  B10R1.20  C#CC1=NC=CC=C1OC F2197-2457 [0,0,0,0,0,0|1,1,2]=4
3  B10R1.20  C#CC1=NC=CN=C1C#N F2167-2839 [0,0,0,0,0,0|2,0,2]=4
4  B10R1.20  CNC1=C(OC)C=NC=N1 F2147-1588 [0,0,0,0,0,0|3,1,0]=4
5  B10R1.20  COC1=CC=CN=C1CN F2147-1532 [0,0,0,0,0,0|2,1,0]=3
6  B9R1.15  CC1=CN=CN=C1CN F1967-2332 [1,0,0,0,0,0|3,0,0]=4
7  B9R1.15  CC1=CN=CN=C1CO F1904-2108 [1,0,0,0,0,0|3,0,0]=4
8  B9R1.15  COC1=C(S)N=CN=C1 F2147-1088 [1,0,0,0,0,0|3,0,0]=4
9  B9R1.15  NC1=C(CBr)C=CC=N1 F8888-7971 [1,0,0,0,0,0|3,0,0]=4
10  B9R1.15  NC1=CC=CN=C1CF F2147-5474 [1,0,0,0,0,0|3,0,0]=4
11  B11R1.37  CCC1=CC(=O)NN=C1CC F1911-2965 [0,1,0,0,0,0|3,0,0]=4
12  B11R1.41  C#CC1=CC=CN=C1OCC F2147-2846 [0,1,0,0,0,0|2,0,1]=4
13  B11R1.41  CCOC1=CC=CN=C1C#N F2147-2394 [0,1,0,0,0,0|3,0,0]=4
14  B11R1.41  CCOC1=CN=CN=C1NC F2147-5274 [0,1,0,0,0,0|3,0,0]=4
15  B9R1.14  CCC1=NNC=C1C#N F2198-3920 [0,0,0,0,1,0|3,0,0]=4
16  B9R1.14  CCC1=NNC=C1C=O F2198-3904 [0,0,0,0,1,0|3,0,0]=4
17  B9R1.14  CCC1=NNC=C1CCl F2198-3912 [0,0,0,0,1,0|3,0,0]=4
18  B9R1.14  CCC1=NNC=C1CN F2198-3936 [0,0,0,0,1,0|3,0,0]=4
19  B9R1.14  CCC1=NNC=C1CO F2198-3896 [0,0,0,0,1,0|3,0,0]=4
20  B9R1.14  COC1=C(CN)SC=C1 F2147-1218 [0,0,0,0,1,0|2,1,0]=4
21  B8R1.2  ClCC1=NC=CN=C1 F2167-4934 [2,0,0,0,0,0|1,0,0]=3
22  B10R1.2  CCC1=C(C)C(Cl)=NC=N1 F1911-2985 [1,1,0,0,0,0|2,0,0]=4
23  B10R1.25  CCC1=C(C)C=C(N)N=N1 F8883-3485 [1,1,0,0,0,0|2,0,0]=4
24  B10R1.30  C#CC1=NC(C)=CN=C1C F2197-7960 [1,1,0,0,0,0|0,0,2]=4
25  B10R1.5  CCC1=NNC=C1CCCl F2198-4016 [0,1,0,0,1,0|2,0,0]=4
26  B10R1.5  CCC1=NNC=C1CCN F2198-3995 [0,1,0,0,1,0|2,0,0]=4
27  B10R1.5  CCC1=NNC=C1CCO F2198-4003 [0,1,0,0,1,0|2,0,0]=4
28  B10R1.5  CCC1=NNC=C1CNC F2198-4024 [0,1,0,0,1,0|2,0,0]=4
29  B10R1.5  CCNC1=NC=CN1CC F2158-0752 [0,1,0,0,1,0|2,0,0]=4
30  B12R1.121  COC1=CC=CN=C1OCCN F2197-4815 [0,2,0,0,0,0|1,1,0]=4
31  B12R2.24  CC1CNC2=CC=CN=C2N1 F6170-0035 [0,1,0,1,0,0|2,0,0]=4
32  B12R2.24  CC1CNC2=NC=CC=C2C1 F1913-3722 [0,1,0,1,0,0|2,0,0]=4
33  B12R2.24  FC1CNC2=NC=CC=C2C1 F1913-3732 [0,1,0,1,0,0|2,0,0]=4
34  B12R2.24  NC1CNC2=NC=CC=C2C1 F1913-3739 [0,1,0,1,0,0|2,0,0]=4
35  B12R2.1081  CC1=C2CCCNC2=NC=C1 F1957-0092 [0,1,0,1,0,0|2,0,0]=4
36  B12R2.1081  OC1CCOC2=NC=CC=C21 F2147-3466 [0,1,0,1,0,0|1,1,0]=4
37  B12R2.2048  NCC1=NC=CN=C1C2CC2 F2167-4836 [0,1,0,1,0,0|2,0,0]=4
38  B8R1.11  CC1=NNC=C1CBr F2198-1482 [1,0,0,0,1,0|2,0,0]=4
39  B8R1.11  CC1=NNC=C1CCl F2198-3765 [1,0,0,0,1,0|2,0,0]=4
40  B8R1.11  CN1N=CN=C1CN F3367-0271 [1,0,0,0,1,0|2,0,0]=4