mol="3MM" Charge="1"
lab="CAA"	NH="3" 
lab="SAI"	NH="0" 
lab="CAG"	NH="2" 
lab="CAH"	NH="2" 
lab="CAK"	NH="1" 
lab="CAJ"	NH="0" 
lab="OAF"	NH="0" 
lab="NAL"	NH="0" 
lab="CAB"	NH="3" 
lab="CAC"	NH="3" 
lab="CAD"	NH="3" 
lab="OXT"	NH="1" 
