mol="IVS" Charge="0"
lab="C57"	NH="2" 
lab="O56"	NH="0" 
lab="C53"	NH="0" 
lab="O75"	NH="0" 
lab="C52"	NH="2" 
lab="C51"	NH="1" 
lab="O72"	NH="1" 
lab="C23"	NH="1" 
lab="C58"	NH="2" 
lab="N22"	NH="1" 
lab="C21"	NH="0" 
lab="O19"	NH="0" 
lab="C20"	NH="1" 
lab="N19"	NH="1" 
lab="C18"	NH="0" 
lab="O36"	NH="0" 
lab="C17"	NH="1" 
lab="N16"	NH="1" 
lab="C12"	NH="0" 
lab="O15"	NH="0" 
lab="C10"	NH="2" 
lab="C2"	NH="1" 
lab="C6"	NH="3" 
lab="C76"	NH="3" 
lab="C60"	NH="1" 
lab="C67"	NH="3" 
lab="C63"	NH="3" 
lab="C38"	NH="1" 
lab="C40"	NH="3" 
lab="C44"	NH="3" 
lab="C25"	NH="1" 
lab="C27"	NH="3" 
lab="C31"	NH="3" 
lab="C1"	NH="3" 
