mol="A85" Charge="0"
lab="C1"	NH="0" 
lab="O2"	NH="0" 
lab="N3"	NH="0" 
lab="C4"	NH="3" 
lab="C5"	NH="2" 
lab="C6"	NH="0" 
lab="C7"	NH="1" 
lab="N8"	NH="0" 
lab="C9"	NH="1" 
lab="C10"	NH="1" 
lab="C11"	NH="1" 
lab="N21"	NH="1" 
lab="C22"	NH="1" 
lab="C23"	NH="0" 
lab="O24"	NH="0" 
lab="C25"	NH="1" 
lab="C26"	NH="3" 
lab="C27"	NH="3" 
lab="N37"	NH="1" 
lab="C38"	NH="1" 
lab="C39"	NH="2" 
lab="C40"	NH="0" 
lab="C41"	NH="1" 
lab="C42"	NH="1" 
lab="C43"	NH="1" 
lab="C44"	NH="1" 
lab="C45"	NH="1" 
lab="C46"	NH="0" 
lab="F1"	NH="0" 
lab="F2"	NH="0" 
lab="C49"	NH="0" 
lab="O47"	NH="1" 
lab="O48"	NH="1" 
lab="N50"	NH="1" 
lab="C51"	NH="1" 
lab="C52"	NH="2" 
lab="C53"	NH="0" 
lab="C54"	NH="1" 
lab="C55"	NH="1" 
lab="C56"	NH="1" 
lab="C57"	NH="1" 
lab="C58"	NH="1" 
lab="N81"	NH="1" 
lab="C82"	NH="1" 
lab="C83"	NH="0" 
lab="O84"	NH="0" 
lab="C85"	NH="1" 
lab="C86"	NH="3" 
lab="C87"	NH="3" 
lab="C97"	NH="0" 
lab="O98"	NH="0" 
lab="N99"	NH="0" 
lab="C2"	NH="3" 
lab="C3"	NH="2" 
lab="C8"	NH="0" 
lab="C12"	NH="1" 
lab="N10"	NH="0" 
lab="C13"	NH="1" 
lab="C14"	NH="1" 
lab="C15"	NH="1" 
