0  B11R0.160  CCCCC(NC(C)=O)C(=O)O 4158-1-92 [1,0,0,0,0,0|2,0,1]=4
1  B11R0.160  CCCC[C@@H](NC(C)=O)C(=O)O 4158-1-RX [1,0,0,0,0,0|2,0,1]=4
2  B11R0.160  CCCC[C@H](NC(C)=O)C(=O)O 4158-1-SX [1,0,0,0,0,0|2,0,1]=4
3  B11R0.160  CSCCC(NC(=N)N)C(=O)O 8166-1-05 [1,0,0,0,0,0|3,0,0]=4
4  B13R0.256  [C@@H](CCC(=O)O)(NC(=O)CCl)C(=O)O 4158-5-37 [0,1,0,0,0,0|1,0,0]=2
5  B11R0.32  NC(=O)NC(NC(N)=O)C(=O)O 4153-1-0F [0,0,0,0,1,0|2,0,0]=3
6  B11R0.32  O=C(O)\C=C(/CC(=O)O)C(=O)O 2321-1-22 [0,0,0,0,1,0|2,0,1]=4
7  B10R0.88  CCCC[C@H](NC=O)C(=O)O 4H58-1-S0M [2,0,0,0,0,0|1,0,1]=4
8  B10R0.23  CCC[C@@H](NC(C)=O)C(=O)O 4258-1-RB [2,0,0,0,0,0|1,0,1]=4
9  B10R0.23  CCC[C@H](NC(C)=O)C(=O)O 4158-1-SB [2,0,0,0,0,0|1,0,1]=4
10  B10R0.23  [C@H](CCC)(NC(C)=O)C(=O)O 4158-1-16 [2,0,0,0,0,0|1,0,1]=4
11  B12R0.43  C=C(C(=O)O)C(CC(=O)O)C(=O)O 2321-1-16 [0,1,0,0,1,0|2,0,0]=4
12  B12R0.694  O=C(O)CC(O)(CC(=O)O)C(=O)O 4133-1-03 [0,1,0,0,1,0|2,0,0]=4
13  B12R0.694  O=C(O)CC(O)(CC(=O)O)C(=O)O 9126-1-X1 [0,1,0,0,1,0|2,0,0]=4