mol="XW1" Charge="0"
lab="C1"	NH="0" 
lab="N"	NH="2" 
lab="CA"	NH="1" 
lab="C13"	NH="2" 
lab="C14"	NH="2" 
lab="C15"	NH="2" 
lab="C17"	NH="2" 
lab="C"	NH="0" 
lab="O"	NH="0" 
lab="O91"	NH="0" 
lab="O92"	NH="0" 
lab="C93"	NH="2" 
lab="C94"	NH="3" 
lab="OXT"	NH="1" 
