0  B8R1.8  CCCN1C=CC=N1 F2169-1036 [0,0,0,0,0,0|3,0,1]=4
1  B8R1.8  CNCC1=CC=CS1 F2169-1271 [0,0,0,0,0,0|4,0,0]=4
2  B8R1.8  CNCC1=CN=CS1 F8881-1460 [0,0,0,0,0,0|3,0,0]=3
3  B8R1.8  N#CCC1=CSC=C1 F0001-0473 [0,0,0,0,0,0|2,0,2]=4
4  B8R1.8  N#CCN1C=CN=C1 F3020-0289 [0,0,0,0,0,0|2,0,2]=4
5  B8R1.8  NCCN1C=NC=N1 F2191-0287 [0,0,0,0,0,0|1,0,1]=2
6  B8R1.8  OCCC1=CC=CS1 F0001-1418 [0,0,0,0,0,0|3,0,0]=3
7  B8R1.8  OCCC1=CNN=C1 F2198-2728 [0,0,0,0,0,0|3,0,0]=3
8  B8R1.8  OCCC1=CSC=C1 F0001-0474 [0,0,0,0,0,0|3,0,0]=3
9  B7R1.1  NCC1=CSC=C1 F2189-0326 [1,0,0,0,0,0|2,0,0]=3
10  B7R1.1  NCC1=NOC=C1 F8888-3862 [1,0,0,0,0,0|2,0,1]=4
11  B7R1.1  OCC1=CSC=N1 F2173-0020 [1,0,0,0,0,0|2,0,1]=4
12  B9R1.7  CC1=NC(CCO)=CS1 F2173-0017 [0,1,0,0,0,0|2,0,1]=4
13  B9R1.7  NCCC1=NC(N)=NN1 F3367-0208 [0,1,0,0,0,0|1,0,1]=3
14  B9R1.7  NCCC1=NNC(N)=N1 F0451-0452 [0,1,0,0,0,0|1,0,2]=4
15  B9R1.11  CCC(N)C1=CC=CS1 F8888-5229 [0,1,0,0,0,0|3,0,0]=4
16  B9R1.12  CCNCC1=CC=CS1 F8889-3020 [0,1,0,0,0,0|3,0,0]=4
17  B9R1.13  CC(N)CC1=CC=CS1 F2189-0008 [0,1,0,0,0,0|2,0,0]=3
18  B9R1.33  CC1=NC=CN1CCN F2158-0292 [0,1,0,0,0,0|2,0,0]=3
19  B9R1.33  CNCC1=CC=CN1C F2169-1278 [0,1,0,0,0,0|3,0,0]=4
20  B9R1.8  BrCCC1=NC=CC=C1 F8884-9163 [0,0,0,0,0,1|2,0,1]=4
21  B9R1.8  CNCC1=CC=NC=C1 F2148-2247 [0,0,0,0,0,1|3,0,0]=4
22  B9R1.8  CNCC1=CN=CC=C1 F2158-0857 [0,0,0,0,0,1|3,0,0]=4
23  B9R1.8  NCCC1=CC=CN=C1 F0001-0713 [0,0,0,0,0,1|1,0,0]=2
24  B9R1.8  OCCC1=CC=NC=C1 F8882-3307 [0,0,0,0,0,1|2,0,0]=3
25  B9R1.8  OCCC1=CN=CC=C1 F1910-8470 [0,0,0,0,0,1|2,0,0]=3
26  B6R1.2  CC1=CC=NO1 F0001-2561 [2,0,0,0,0,0|2,0,0]=4
27  B6R1.2  CC1=CNC=C1 F8889-1676 [2,0,0,0,0,0|1,0,1]=4
28  B6R1.2  SC1=NN=CN1 F1294-0001 [2,0,0,0,0,0|2,0,0]=4
29  B8R1.1  CC1=CC=C(CN)O1 F0001-0484 [1,1,0,0,0,0|2,0,0]=4
30  B8R1.1  CCC1=CC=C(C)S1 F0001-1487 [1,1,0,0,0,0|2,0,0]=4
31  B8R1.1  CN1C=C(CN)C=N1 F1913-3345 [1,1,0,0,0,0|2,0,0]=4
32  B8R1.1  CSC1=NN=C(N)N1 F3308-3772 [1,1,0,0,0,0|2,0,0]=4
33  B8R1.1  NCC1=CC=C(Br)S1 F2169-1273 [1,1,0,0,0,0|2,0,0]=4
34  B8R1.7  CC(N)C1=CC=CS1 F3145-1890 [1,1,0,0,0,0|2,0,0]=4
35  B8R1.11  CC1=C(CN)SN=N1 F2135-1125 [1,1,0,0,0,0|2,0,0]=4
36  B8R1.11  CC1=NNC=C1CN F1905-6462 [1,1,0,0,0,0|2,0,0]=4
37  B8R1.11  CN1N=CC=C1CN F1905-0589 [1,1,0,0,0,0|2,0,0]=4
38  B10R1.10  NCCC1=CC(Cl)=CC=C1 F0001-2428 [0,1,0,0,0,1|2,0,0]=4
39  B10R1.17  CNCCC1=NC=CC=C1 F2158-0901 [0,1,0,0,0,1|1,0,1]=4
40  B10R1.17  NCCOC1=CN=CC=C1 F8881-5754 [0,1,0,0,0,1|1,0,0]=3
41  B10R1.17  NCCOC1=NC=CC=C1 F2147-1481 [0,1,0,0,0,1|1,0,1]=4
42  B10R1.29  CC1=C(CCCN)C=NN1 F8889-3846 [0,2,0,0,0,0|2,0,0]=4