mol="TAV" Charge="0"
lab="C1"	NH="0" 
lab="C2"	NH="1" 
lab="C3"	NH="0" 
lab="C4"	NH="0" 
lab="C5"	NH="1" 
lab="C6"	NH="1" 
lab="C9"	NH="1" 
lab="C10"	NH="1" 
lab="C13"	NH="1" 
lab="C14"	NH="1" 
lab="S18"	NH="0" 
lab="O19"	NH="0" 
lab="N20"	NH="1" 
lab="C21"	NH="1" 
lab="C22"	NH="1" 
lab="C23"	NH="0" 
lab="C24"	NH="0" 
lab="C25"	NH="1" 
lab="C26"	NH="0" 
lab="C29"	NH="0" 
lab="S31"	NH="0" 
lab="C32"	NH="1" 
lab="C33"	NH="1" 
lab="C34"	NH="0" 
lab="C35"	NH="0" 
lab="C36"	NH="1" 
lab="C37"	NH="1" 
lab="C41"	NH="1" 
lab="C42"	NH="1" 
lab="C45"	NH="0" 
lab="C46"	NH="1" 
lab="N49"	NH="0" 
lab="O50"	NH="0" 
lab="O51"	NH="0" 
lab="O52"	NH="0" 
lab="O53"	NH="0" 
lab="O54"	NH="0" 
lab="C56"	NH="3" 
lab="C57"	NH="1" 
lab="C61"	NH="0" 
lab="O62"	NH="1" 
lab="O63"	NH="0" 
lab="C64"	NH="0" 
lab="O65"	NH="1" 
lab="O66"	NH="0" 
lab="C67"	NH="2" 
