0  B4R0.1  CC(O)CN HY-W015969R [1,0,0,0,0,0|3,0,0]=4
1  B4R0.1  CC[C@@H](C)O HY-W087952R [1,0,0,0,0,0|2,0,0]=3
2  B4R0.1  C[C@H](O)CO HY-79334R [1,0,0,0,0,0|2,0,0]=3
3  B6R0.2  CC(C)CC(C)N HY-W114255 [0,1,0,0,0,0|2,0,0]=3
4  B6R0.2  C[C@@H](O)CC(=O)O HY-W051723R [0,1,0,0,0,0|2,0,1]=4
5  B6R0.3  N[13C@@H](CO)C(=O)O HY-N0650S4 [0,1,0,0,0,0|3,0,0]=4
6  B6R1.2  O=C1CCOC1 HY-33900R [0,0,0,1,0,0|2,0,0]=3
7  B3R0.1  OCCO HY-Y0873B1 [2,0,0,0,0,0|1,0,0]=3
8  B5R0.3  O=C(CO)CO HY-Y0335R [1,1,0,0,0,0|2,0,0]=4
9  B5R0.5  CC(=O)N(C)C HY-W042416R [1,1,0,0,0,0|0,0,1]=3
10  B7R0.9  CC(O)C[N+](C)(C)C HY-W127641 [0,2,0,0,0,0|0,0,1]=3
11  B7R0.16  CC(C)C(O)C(=O)O HY-W008150R [0,2,0,0,0,0|1,0,1]=4
12  B7R0.16  CC(C)[C@H]([15NH2])[13C](=O)O HY-N0717S7 [0,2,0,0,0,0|1,0,1]=4