mol="KGT" Charge="0"
lab="C01"	NH="2" 
lab="C02"	NH="2" 
lab="C03"	NH="0" 
lab="O04"	NH="0" 
lab="N05"	NH="1" 
lab="C06"	NH="1" 
lab="C07"	NH="2" 
lab="S08"	NH="1" 
lab="C09"	NH="0" 
lab="O10"	NH="0" 
lab="N11"	NH="1" 
lab="C12"	NH="2" 
lab="C13"	NH="0" 
lab="O14"	NH="0" 
lab="O15"	NH="1" 
lab="C16"	NH="0" 
lab="C17"	NH="0" 
lab="O18"	NH="1" 
lab="O19"	NH="0" 
lab="O20"	NH="0" 
