0  B8R1.18  CC1=CC(=O)NC1=O 105167 [0,1,0,0,0,0|1,0,2]=4
1  B6R0.1  CCOC(=O)OC 075947 [0,0,1,0,0,0|2,0,1]=4
2  B6R0.2  CC(=O)OC(C)=O 035908 [0,0,1,0,0,0|0,0,0]=1
3  B6R0.4  CCCCC(C)=O 098350 [0,0,1,0,0,0|2,0,1]=4
4  B6R0.4  O=CNCC(=O)O 242940 [0,0,1,0,0,0|1,0,0]=2
5  B8R1.3  O=C1CCS(=O)CC1 094783 [0,0,0,0,0,1|2,0,0]=3
6  B8R1.4  C[C@@H]1CCCC(=O)O1 329497 [0,0,0,0,0,1|1,0,1]=3
7  B8R1.4  O=C1CSCC(=O)C1 093606 [0,0,0,0,0,1|1,0,0]=2
8  B5R0.1  [2H]C(=O)OCC 105259 [1,0,1,0,0,0|1,0,1]=4
9  B5R0.2  N#CCCC=O 101160 [1,0,1,0,0,0|1,0,1]=4
10  B5R1.1  C1CCOC1 046883 [2,0,0,0,0,0|0,0,2]=4
11  B5R1.1  C1CCOC1 046883 [2,0,0,0,0,0|0,0,2]=4
12  B5R1.1  C1CCOC1 106169 [2,0,0,0,0,0|0,0,2]=4
13  B7R0.3  C=CCOC(=O)CBr 246134 [0,1,1,0,0,0|2,0,0]=4
14  B7R0.7  CCOC(=O)OCC 094215 [0,1,1,0,0,0|1,0,1]=4
15  B7R0.16  CC(=O)C(F)C(C)=O 049764 [0,1,1,0,0,0|1,0,0]=3
16  B7R0.4  CNCCCC(=O)O 242011 [0,1,1,0,0,0|1,0,1]=4