0  B6R0.2  CC(=O)OC(C)=O 035908 [0,0,0,0,0,0|1,0,0]=1
1  B5R0.1  CCOC(=S)Cl 470560 [1,0,0,0,0,0|1,1,1]=4
2  B5R0.1  CCOC(N)=S 105176 [1,0,0,0,0,0|1,1,1]=4
3  B5R0.1  [2H]C(=O)OCC 105259 [1,0,0,0,0,0|1,0,1]=3
4  B7R0.2  C=CC(C)CC(=O)O 229282 [0,1,0,0,0,0|2,0,1]=4
5  B7R0.16  CC(=O)C(F)C(C)=O 049764 [0,1,0,0,0,0|2,0,0]=3
6  B7R1.2  CC1=CN=C(Cl)S1 092987 [0,0,0,1,0,0|2,1,0]=4
7  B4R0.1  COC(N)=S 105257 [2,0,0,0,0,0|1,1,0]=4
8  B4R0.1  [13CH](=O)N(C)C 105188 [2,0,0,0,0,0|1,0,1]=4
9  B4R0.1  [2H]C(=O)OC 105254 [2,0,0,0,0,0|1,0,0]=3
10  B4R0.2  COCC=O 105128 [2,0,0,0,0,0|2,0,0]=4
11  B6R0.1  CCOC(=O)OC 075947 [1,1,0,0,0,0|0,0,1]=3
12  B6R0.4  CCCCC(C)=O 098350 [1,1,0,0,0,0|1,0,1]=4
13  B8R1.4  C[C@@H]1CCCC(=O)O1 329497 [0,1,0,1,0,0|0,0,2]=4
14  B8R1.4  O=C1CSCC(=O)C1 093606 [0,1,0,1,0,0|2,0,0]=4
15  B8R1.18  CC1=CC(=O)NC1=O 105167 [0,1,0,1,0,0|2,0,0]=4