0  B5R0.3  CCC(=O)NN B015434 [0,0,0,0,0,0|3,0,0]=3
1  B5R0.3  CC\C(N)=N\O B030359 [0,0,0,0,0,0|3,0,0]=3
2  B4R0.1  C#CC(=C)C B048766 [1,0,0,0,0,0|2,0,1]=4
3  B4R0.1  OCC(F)F B019710 [1,0,0,0,0,0|2,0,1]=4
4  B6R0.1  C#CC(=O)OCC B051748 [0,1,0,0,0,0|2,0,1]=4
5  B6R0.1  CCNC(C)CO B039551 [0,1,0,0,0,0|2,0,1]=4
6  B6R0.1  COCC(=O)NN B015437 [0,1,0,0,0,0|2,0,0]=3
7  B5R0.1  C#CCC(=O)O B050921 [1,1,0,0,0,0|1,0,0]=3
8  B5R0.1  CC(N)CCO B039558 [1,1,0,0,0,0|1,0,1]=4
9  B5R0.5  CC(=O)C(F)F B016253 [1,1,0,0,0,0|1,0,0]=3
10  B5R0.2  CCSCCO B049702 [1,1,0,0,0,0|1,0,1]=4
11  B7R0.5  CCOC(=O)C(F)F B020251 [0,2,0,0,0,0|2,0,0]=4
12  B7R0.7  CCOC(=O)CNN B020270 [0,2,0,0,0,0|2,0,0]=4
13  B7R0.7  O=S(CCO)CCO B048617 [0,2,0,0,0,0|1,0,0]=3