mol="2WS" Charge="0"
lab="C01"	NH="2" 
lab="C02"	NH="1" 
lab="C03"	NH="1" 
lab="C04"	NH="1" 
lab="C05"	NH="1" 
lab="O06"	NH="0" 
lab="O07"	NH="0" 
lab="C08"	NH="1" 
lab="C09"	NH="2" 
lab="O10"	NH="0" 
lab="C11"	NH="1" 
lab="C12"	NH="1" 
lab="C13"	NH="1" 
lab="O14"	NH="1" 
lab="O15"	NH="1" 
lab="O16"	NH="0" 
lab="C17"	NH="1" 
lab="C18"	NH="2" 
lab="O19"	NH="0" 
lab="C20"	NH="1" 
lab="C21"	NH="1" 
lab="C22"	NH="1" 
lab="O23"	NH="1" 
lab="O24"	NH="1" 
lab="O25"	NH="1" 
lab="O26"	NH="1" 
lab="O27"	NH="1" 
lab="O28"	NH="1" 
