mol="DMU" Charge="0"
lab="C1"	NH="1" 
lab="C2"	NH="1" 
lab="C3"	NH="1" 
lab="C4"	NH="1" 
lab="O5"	NH="0" 
lab="C6"	NH="1" 
lab="O7"	NH="0" 
lab="O16"	NH="0" 
lab="C18"	NH="2" 
lab="C19"	NH="2" 
lab="C22"	NH="2" 
lab="C25"	NH="2" 
lab="C28"	NH="2" 
lab="C31"	NH="2" 
lab="C34"	NH="2" 
lab="C37"	NH="2" 
lab="C40"	NH="2" 
lab="C43"	NH="3" 
lab="O49"	NH="1" 
lab="O55"	NH="1" 
lab="C57"	NH="2" 
lab="O61"	NH="1" 
lab="C5"	NH="1" 
lab="C7"	NH="1" 
lab="C8"	NH="1" 
lab="C9"	NH="1" 
lab="O1"	NH="0" 
lab="C10"	NH="1" 
lab="O2"	NH="1" 
lab="O3"	NH="1" 
lab="O4"	NH="1" 
lab="C11"	NH="2" 
lab="O6"	NH="1" 
