mol="13M" Charge="0"
lab="C1"	NH="0" 
lab="O1"	NH="0" 
lab="C2"	NH="1" 
lab="O2"	NH="1" 
lab="C3"	NH="2" 
lab="O3"	NH="0" 
lab="C4"	NH="3" 
lab="C5"	NH="2" 
lab="C6"	NH="0" 
lab="C7"	NH="1" 
lab="C8"	NH="0" 
lab="C9"	NH="0" 
lab="C10"	NH="1" 
lab="C11"	NH="1" 
lab="C12"	NH="3" 
lab="C15"	NH="2" 
lab="C17"	NH="0" 
lab="C19"	NH="0" 
lab="C22"	NH="1" 
lab="C85"	NH="1" 
lab="C86"	NH="1" 
lab="C87"	NH="0" 
lab="C88"	NH="1" 
lab="C89"	NH="0" 
lab="C91"	NH="1" 
lab="C92"	NH="1" 
lab="C93"	NH="1" 
lab="C94"	NH="1" 
lab="C95"	NH="0" 
lab="C96"	NH="0" 
lab="C97"	NH="0" 
lab="C98"	NH="0" 
lab="C99"	NH="1" 
lab="N99"	NH="1" 
lab="O99"	NH="0" 
