mol="HIT" Charge="0"
lab="CA1"	NH="1" 
lab="C3"	NH="1" 
lab="C5"	NH="3" 
lab="C9"	NH="3" 
lab="C13"	NH="0" 
lab="O14"	NH="0" 
lab="CA2"	NH="1" 
lab="C17"	NH="3" 
lab="C21"	NH="0" 
lab="O22"	NH="1" 
lab="O1"	NH="0" 
lab="O25"	NH="1" 
