0  B8R0.2  CC[C@@H](C)[C@H](O)[C@@H](C)O T259209 [1,0,0,0,0,0|2,0,1]=4
1  B10R0.35  C(=O)[C@@H](N)[C@@H](O)[C@H](O)CCO L169218 [0,1,0,0,0,0|1,0,0]=2
2  B10R0.56  C(C)(O)C(O)C(O)C(O)CO S965022 [0,1,0,0,0,0|0,0,2]=3
3  B10R1.119  OC1COC(C(C1O)O)O S358045 [0,0,0,1,0,0|0,0,2]=3
4  B7R0.2  C=C(Cl)C[C@H](O)CO T269794 [2,0,0,0,0,0|1,0,1]=4
5  B7R0.2  C=CC(O)CC(C)C PH008414 [2,0,0,0,0,0|2,0,0]=4
6  B7R0.2  CCC(O)CC(C)O PH001987 [2,0,0,0,0,0|1,0,1]=4
7  B7R0.2  NC(=O)C[C@H](O)CO PH015444 [2,0,0,0,0,0|1,0,1]=4
8  B7R0.2  N[C@H](CO)CC(=O)O CDS007412 [2,0,0,0,0,0|1,0,1]=4
9  B7R0.10  C=C[C@@H](O)[C@@H](O)CO T269530 [2,0,0,0,0,0|0,0,1]=3
10  B7R0.10  [C@H](O)(CO)C(=O)CO R426385 [2,0,0,0,0,0|0,0,2]=4
11  B7R0.16  CC(O)C(Cl)C(=O)O PH007142 [2,0,0,0,0,0|1,0,1]=4
12  B7R0.3  C=CCCC(O)CC PH011335 [2,0,0,0,0,0|2,0,0]=4
13  B7R0.7  C=CCC(O)CCC S350389 [2,0,0,0,0,0|2,0,0]=4
14  B9R0.79  O=C(O)C(O)C(O)C(=O)O PH001767 [1,1,0,0,0,0|0,0,2]=4
15  B9R0.79  O=C(O)C(O)C(O)C(=O)O R580627 [1,1,0,0,0,0|0,0,2]=4
16  B9R0.79  O=C(O)C(O)C(O)C(=O)O S573264 [1,1,0,0,0,0|0,0,2]=4
17  B11R0.66  C(=O)[C@H](N)[C@@H](O)[C@H](O)[C@H](O)CO CDS025223 [0,1,0,0,0,1|1,0,0]=3
18  B11R0.66  C(O)(CO)C(O)C(O)C(O)CO S641154 [0,1,0,0,0,1|0,0,2]=4
19  B11R0.66  NCC(O)C(O)C(O)C(O)CO S922056 [0,1,0,0,0,1|1,0,1]=4
20  B11R0.66  O=C(C(O)CO)C(O)C(O)CO S641170 [0,1,0,0,0,1|0,0,2]=4
21  B11R0.66  OCC(O)C(O)C(O)C(O)CS PH001067 [0,1,0,0,0,1|0,1,1]=4
22  B9R1.3  CC1OCCC(C1O)O PH008649 [1,0,0,1,0,0|1,0,1]=4
23  B11R1.865  OCC(O)[C@H]1OC[C@@H]([C@@H]1O)O PH009516 [0,0,0,1,0,1|0,0,2]=4
24  B11R1.865  [C@@H]1(OC[C@@H]([C@H]1O)O)[C@H](O)CO PH006861 [0,0,0,1,0,1|0,0,2]=4
25  B11R1.278  OCC1OCC(C(C1O)O)O S490199 [0,1,0,1,0,0|0,0,2]=4
26  B11R1.672  O=C(O)C1OC(C(C1O)O)O PH008547 [0,1,0,1,0,0|0,0,0]=2