0  B9R0.8  CCCC[C@@H](C(=O)OC)N NLO [2,0,0,0,0,0|1,0,0]=3
1  B9R0.13  CCCC[C@H](C(=O)O)NC DNM [2,0,0,0,0,0|1,0,0]=3
2  B9R0.13  CN[C@@H](CCSC)C(=O)O MME [2,0,0,0,0,0|2,0,0]=4