mol="QUS" Charge="0"
lab="C01"	NH="0" 
lab="C02"	NH="1" 
lab="C03"	NH="2" 
lab="C04"	NH="0" 
lab="C05"	NH="0" 
lab="NP3"	NH="2" 
lab="N14"	NH="0" 
lab="N15"	NH="1" 
lab="O16"	NH="0" 
lab="O17"	NH="1" 
lab="O18"	NH="0" 
lab="O19"	NH="0" 
lab="O20"	NH="0" 
