mol="ATX" Charge="0"
lab="N"	NH="2" 
lab="CA"	NH="1" 
lab="C"	NH="0" 
lab="O"	NH="0" 
lab="CB"	NH="3" 
lab="C5"	NH="0" 
lab="N4"	NH="0" 
lab="N3"	NH="0" 
lab="C2"	NH="0" 
lab="O1"	NH="0" 
lab="C6"	NH="0" 
lab="C7"	NH="3" 
lab="C8"	NH="3" 
lab="C9"	NH="3" 
