mol="12W" Charge="0"
lab="C25"	NH="0" 
lab="O26"	NH="0" 
lab="O27"	NH="0" 
lab="C28"	NH="1" 
lab="C29"	NH="2" 
lab="C30"	NH="2" 
lab="C31"	NH="2" 
lab="C32"	NH="2" 
lab="OXT"	NH="1" 
