mol="MS2" Charge="0"
lab="C"	NH="3" 
lab="BR1"	NH="0" 
lab="C1"	NH="0" 
lab="C2A"	NH="1" 
lab="C3A"	NH="1" 
lab="C4"	NH="0" 
lab="C3B"	NH="1" 
lab="C2B"	NH="1" 
lab="C5"	NH="1" 
lab="C6"	NH="3" 
lab="N1"	NH="1" 
lab="C7"	NH="0" 
lab="O1"	NH="0" 
lab="C8"	NH="0" 
lab="C9A"	NH="0" 
lab="CL15"	NH="0" 
lab="CL16"	NH="0" 
lab="C17"	NH="1" 
lab="O9B"	NH="0" 
lab="S9B"	NH="0" 
lab="C12"	NH="3" 
