mol="IDD" Charge="0"
lab="C1"	NH="0" 
lab="C2"	NH="1" 
lab="C3"	NH="1" 
lab="C4"	NH="1" 
lab="C5"	NH="1" 
lab="C6"	NH="1" 
lab="C1B"	NH="0" 
lab="C2B"	NH="1" 
lab="C3B"	NH="1" 
lab="C4B"	NH="1" 
lab="C5B"	NH="1" 
lab="C6B"	NH="2" 
lab="O2B"	NH="1" 
lab="O3B"	NH="1" 
lab="O4B"	NH="1" 
lab="N1B"	NH="0" 
lab="O6B"	NH="1" 
lab="N2B"	NH="0" 
lab="C7B"	NH="0" 
lab="C8B"	NH="1" 
