mol="SM4" Charge="0"
lab="O24"	NH="1" 
lab="C22"	NH="0" 
lab="O23"	NH="0" 
lab="C21"	NH="1" 
lab="CAU"	NH="1" 
lab="CAR"	NH="0" 
lab="CAQ"	NH="1" 
lab="CAS"	NH="1" 
lab="CAN"	NH="1" 
lab="CAM"	NH="1" 
lab="CAL"	NH="0" 
lab="CAK"	NH="1" 
lab="B"	NH="0" 
lab="OAT"	NH="1" 
lab="OAO"	NH="1" 
lab="N"	NH="1" 
lab="CAH"	NH="0" 
lab="OAI"	NH="0" 
lab="CAG"	NH="2" 
lab="CAE"	NH="0" 
lab="CAF"	NH="1" 
lab="CAC"	NH="1" 
lab="CAB"	NH="1" 
lab="SAD"	NH="0" 
