0  B10R1.20  COc1ccccc1SC CSC000037525 [0,0,0,0,0,0|3,0,0]=3
1  B10R1.20  CSc1ccccc1C#N CSC011217975 [0,0,0,0,0,0|3,0,1]=4
2  B9R1.15  CNc1ncccc1Br CSC000700899 [1,0,0,0,0,0|3,0,0]=4
3  B9R1.15  CSc1ccccc1Br CSC000230855 [1,0,0,0,0,0|3,0,0]=4
4  B9R1.15  CSc1ccccc1Cl CSC000000335 [1,0,0,0,0,0|3,0,0]=4
5  B9R1.15  CSc1ccccc1F CSC000000233 [1,0,0,0,0,0|3,0,0]=4
6  B9R1.15  CSc1ccccc1O CSC011216402 [1,0,0,0,0,0|3,0,0]=4
7  B11R1.41  CCNc1ccccc1CC CSC000221538 [0,1,0,0,0,0|3,0,0]=4
8  B11R1.41  CCNc1ccccc1OC CSC000219754 [0,1,0,0,0,0|2,1,0]=4
9  B11R1.41  CCNc1ncccc1C#N CSC000156588 [0,1,0,0,0,0|3,0,0]=4
10  B11R1.41  CCNc1ncccc1OC CSC011290862 [0,1,0,0,0,0|1,1,0]=3
11  B11R1.41  CCOc1ccccc1OC CSC000005897 [0,1,0,0,0,0|2,1,0]=4
12  B11R1.41  CCOc1ccccc1SC CSC010366423 [0,1,0,0,0,0|2,0,0]=3
13  B11R1.41  CCSc1ccccc1OC CSC000055740 [0,1,0,0,0,0|2,1,0]=4
14  B11R1.41  COc1ccccc1CCO CSC011218620 [0,1,0,0,0,0|2,1,0]=4
15  B11R1.41  COc1ccccc1CSC CSC000053060 [0,1,0,0,0,0|2,1,0]=4
16  B8R1.2  CSc1ncccn1 CSC000000289 [2,0,0,0,0,0|2,0,0]=4
17  B10R1.4  CCSc1ccccc1C CSC000053911 [1,1,0,0,0,0|2,0,0]=4
18  B10R1.25  CSc1ccc(cc1C)C CSC000001076 [1,1,0,0,0,0|2,0,0]=4
19  B10R1.30  CSc1cc(ccc1C)C CSC000001074 [1,1,0,0,0,0|2,0,0]=4
20  B10R1.5  CCc1nccn1CCO CSC011473219 [0,1,0,0,1,0|2,0,0]=4
21  B12R1.77  COC(=O)c1cccnc1SC CSC000149765 [0,2,0,0,0,0|1,0,1]=4
22  B12R1.121  CCCOc1ccccc1SC CSC010368029 [0,2,0,0,0,0|2,0,0]=4
23  B12R1.121  OCCSc1nccnc1C#N CSC011726480 [0,2,0,0,0,0|1,0,1]=4
24  B8R1.11  CSc1nccn1C CSC000000347 [1,0,0,0,1,0|1,0,0]=3