0  B11R0.160  CSCCC(NC(N)=O)C(=O)O SBB028030 [0,0,0,0,0,0|1,0,0]=1
1  B11R0.160  CSCC[C@H](NC(C)=O)C(=O)O SBB006737 [0,0,0,0,0,0|0,0,0]=0
2  B10R0.88  CSCC[C@H](NC=O)C(=O)O SBB066408 [1,0,0,0,0,0|0,0,0]=1
3  B12R0.120  CC(=O)N[C@@H](CCCCN)C(=O)O SBB067149 [0,1,0,0,0,0|1,0,0]=2
4  B12R0.138  CC(=O)NC(CCC(N)=O)C(=O)O SBB067153 [0,1,0,0,0,0|2,0,0]=3
5  B12R0.138  CC(=O)N[C@@H](CCC(=O)O)C(=O)O SBB058021 [0,1,0,0,0,0|2,0,0]=3
6  B12R1.261  CC(=O)N1CCCCC1C(=O)O SBB085475 [0,0,0,1,0,0|1,0,0]=2
7  B12R1.261  O=C(O)C1CCCCC1C(=O)O SBB043503 [0,0,0,1,0,0|3,0,0]=4
8  B12R1.1218  O=C1CCC(C(=O)O)NC(=O)N1 SBB010534 [0,0,0,1,0,0|3,0,0]=4
9  B10R0.17  CC(=O)C(CCC#N)C(C)=O SBB022086 [0,0,0,0,1,0|3,0,0]=4
10  B10R0.17  CCCCC(C(=O)O)C(=O)O SBB057490 [0,0,0,0,1,0|2,0,0]=3
11  B9R0.15  CCCC(CCC)C(=O)O SBB065764 [2,0,0,0,0,0|1,0,1]=4
12  B9R0.39  CC(=O)NC(CO)C(=O)O SBB028465 [2,0,0,0,0,0|0,1,0]=3
13  B9R0.39  CC(=O)NC(CS)C(=O)O SBB007593 [2,0,0,0,0,0|0,0,0]=2
14  B9R0.13  CCCCC(CC)C(=O)O SBB060021 [2,0,0,0,0,0|1,0,1]=4
15  B11R0.32  CC(=O)N[C@@H](CC(=O)O)C(=O)O SBB067192 [1,1,0,0,0,0|0,1,1]=4
16  B11R0.32  CC(=O)N[C@@H](CC(C)C)C(=O)O SBB017526 [1,1,0,0,0,0|0,0,0]=2
17  B11R0.32  CC(=O)N[C@@H](CC(N)=O)C(=O)O SBB067259 [1,1,0,0,0,0|0,1,1]=4
18  B11R0.32  CC(C)CC(NC(N)=O)C(=O)O SBB085290 [1,1,0,0,0,0|1,0,0]=3
19  B11R0.115  CCC(C)C(NC(C)=O)C(=O)O SBB000181 [1,1,0,0,0,0|0,0,0]=2
20  B11R0.153  CCCCCC(C(=O)O)C(=O)O SBB057500 [0,1,0,0,1,0|2,0,0]=4
21  B13R0.146  COC(=O)[C@H](CCCCN)NC(C)=O SBB003225 [0,2,0,0,0,0|1,0,0]=3
22  B13R0.253  COC(=O)[C@H](CSC(C)=O)NC(C)=O SBB058055 [0,2,0,0,0,0|2,0,0]=4
23  B11R1.178  CC(=O)N1CCCC1C(=O)O SBB005365 [1,0,0,1,0,0|0,0,0]=2
24  B11R1.178  O=C(O)[C@@H]1CCC[C@H]1C(=O)O SBB065858 [1,0,0,1,0,0|2,0,0]=4
25  B11R1.21  CC1=C(C)CC(C(=O)O)CC1 SBB302002 [1,0,0,1,0,0|2,0,0]=4
26  B11R1.21  CN1CCC(C(=O)O)CC1=O SBB046476 [1,0,0,1,0,0|2,0,0]=4
27  B11R0.35  CCCC(CC(=O)O)CC(=O)O SBB007755 [1,0,0,0,0,1|2,0,0]=4