0  B9R0.7  CC(S)C(=O)NCC(=O)O SBB057668 [0,0,0,0,0,0|0,0,2]=2
1  B9R0.7  CN(C)C(=O)CCC(=O)O SBB008073 [0,0,0,0,0,0|3,0,1]=4
2  B8R0.9  CCC(=O)CCC(=O)O SBB072628 [1,0,0,0,0,0|1,0,1]=3
3  B8R0.9  CNC(=O)CCC(=O)O SBB007999 [1,0,0,0,0,0|2,0,1]=4
4  B8R0.9  COC(=O)CCC(=O)O SBB061270 [1,0,0,0,0,0|2,0,1]=4
5  B8R0.9  NCC(=O)CCC(=O)O SBB003880 [1,0,0,0,0,0|2,0,1]=4
6  B8R0.9  NCC(=O)CCC(=O)O SBB071696 [1,0,0,0,0,0|2,0,1]=4
7  B8R0.9  NCC(=O)NCC(=O)O SBB067231 [1,0,0,0,0,0|1,0,2]=4
8  B8R0.28  CC(C)CCCC(=O)O SBB072713 [1,0,0,0,0,0|2,0,1]=4
9  B7R0.4  CCCCCC(=O)O SBB053586 [2,0,0,0,0,0|1,0,1]=4
10  B7R0.4  CCOCCC(=O)O SBB053607 [2,0,0,0,0,0|2,0,0]=4
11  B7R0.4  OC(=O)C\C=C/CC SBB006610 [2,0,0,0,0,0|1,0,0]=3
12  B7R0.6  CC(=O)CCC(=O)O SBB040561 [2,0,0,0,0,0|1,0,1]=4
13  B7R0.6  CC(=O)NCC(=O)O SBB036034 [2,0,0,0,0,0|0,0,2]=4
14  B7R0.6  O=C(O)CCC(=O)O SBB040562 [2,0,0,0,0,0|1,1,0]=4
15  B9R0.48  OC(=O)CSC(=S)OCC SBB058117 [1,1,0,0,0,0|1,1,0]=4
16  B7R0.2  CCC(C)CC(=O)O SBB008180 [1,0,0,0,1,0|1,0,1]=4
17  B7R0.2  NC[C@@H](O)CC(=O)O SBB065945 [1,0,0,0,1,0|1,0,1]=4
18  B7R0.16  CC(C)[C@@H](O)C(=O)O SBB053572 [0,0,0,0,2,0|1,0,1]=4