mol="TD1" Charge="0"
lab="C1"	NH="0" 
lab="C2"	NH="0" 
lab="C3"	NH="0" 
lab="C4"	NH="1" 
lab="C5"	NH="1" 
lab="C6"	NH="1" 
lab="C7"	NH="0" 
lab="O8"	NH="0" 
lab="N9"	NH="1" 
lab="O10"	NH="1" 
lab="O11"	NH="1" 
lab="C12"	NH="1" 
lab="C13"	NH="0" 
lab="C14"	NH="2" 
lab="O15"	NH="0" 
lab="O16"	NH="1" 
lab="O17"	NH="0" 
lab="C24"	NH="0" 
lab="O25"	NH="0" 
lab="C26"	NH="1" 
lab="N27"	NH="2" 
lab="C28"	NH="2" 
lab="O45"	NH="1" 
