0  B4R0.1  CC(=O)NO DB00551 [1,0,0,0,0,0|2,0,0]=3
1  B4R0.1  NC(=O)NO DB01005 [1,0,0,0,0,0|3,0,0]=4
2  B4R0.1  NCC(O)=O DB00145 [1,0,0,0,0,0|1,0,1]=3
3  B4R0.1  OCC(O)=O DB03085 [1,0,0,0,0,0|1,0,1]=3
4  B3R0.2  CC(O)=O DB03166 [2,0,0,0,0,0|0,0,1]=3
5  B3R0.2  CC([O-])=O DB00258 [2,0,0,0,0,0|1,0,0]=3
6  B3R0.2  CC([O-])=O DB09395 [2,0,0,0,0,0|1,0,0]=3
7  B3R0.2  CS(C)=O DB01093 [2,0,0,0,0,0|1,0,1]=4
8  B3R0.2  NC(O)=N DB11129 [2,0,0,0,0,0|2,0,0]=4
9  B3R0.2  N[13C](O)=N DB09510 [2,0,0,0,0,0|2,0,0]=4
10  B3R0.2  N[14C](N)=O DB09513 [2,0,0,0,0,0|2,0,0]=4
11  B3R0.2  OC([O-])=O DB01390 [2,0,0,0,0,0|1,0,0]=3
12  B3R0.2  OC([O-])=O DB11098 [2,0,0,0,0,0|1,0,0]=3
13  B3R0.2  [O-]C([O-])=O DB06724 [2,0,0,0,0,0|1,0,1]=4
14  B3R0.2  [O-]C([O-])=O DB06792 [2,0,0,0,0,0|1,0,1]=4
15  B3R0.2  [O-]C([O-])=O DB09481 [2,0,0,0,0,0|1,0,1]=4
16  B5R0.5  CC(=O)C(O)=O DB00119 [1,1,0,0,0,0|0,0,1]=3
17  B5R0.5  CC(O)C(O)=O DB04398 [1,1,0,0,0,0|0,0,2]=4
18  B5R0.5  CC(O)C([O-])=O DB06768 [1,1,0,0,0,0|2,0,0]=4
19  B5R0.5  C[C@H](N)C(O)=O DB00160 [1,1,0,0,0,0|0,0,2]=4
20  B7R1.4  CN1C=CNC1=S DB00763 [0,1,0,1,0,0|1,1,0]=4
21  B7R1.4  N[C@@H]1CONC1=O DB00260 [0,1,0,1,0,0|1,0,1]=4