mol="WS7" Charge="0"
lab="O04"	NH="0" 
lab="C04"	NH="0" 
lab="N03"	NH="1" 
lab="C02"	NH="0" 
lab="N02"	NH="2" 
lab="N01"	NH="0" 
lab="C1A"	NH="0" 
lab="C4A"	NH="0" 
lab="N05"	NH="0" 
lab="N10"	NH="1" 
lab="C9A"	NH="0" 
lab="C09"	NH="2" 
lab="C10"	NH="3" 
lab="C5A"	NH="0" 
lab="C06"	NH="2" 
lab="C07"	NH="2" 
lab="C08"	NH="2" 
