mol="S33" Charge="0"
lab="S26"	NH="0" 
lab="CL4"	NH="0" 
lab="C1"	NH="0" 
lab="C45"	NH="3" 
lab="O44"	NH="0" 
lab="C43"	NH="0" 
lab="O5"	NH="0" 
lab="O42"	NH="0" 
lab="C47"	NH="1" 
lab="C40"	NH="1" 
lab="C46"	NH="1" 
lab="C41"	NH="0" 
lab="C8"	NH="0" 
lab="N3"	NH="1" 
lab="O9"	NH="0" 
lab="C31"	NH="2" 
lab="C32"	NH="0" 
lab="C33"	NH="1" 
lab="C34"	NH="1" 
lab="C35"	NH="0" 
lab="C36"	NH="1" 
lab="C37"	NH="1" 
lab="C38"	NH="0" 
lab="N39"	NH="0" 
lab="C6"	NH="1" 
lab="C7"	NH="2" 
lab="C28"	NH="0" 
lab="O29"	NH="0" 
lab="N30"	NH="1" 
lab="N10"	NH="0" 
lab="C11"	NH="1" 
lab="C15"	NH="0" 
lab="O16"	NH="0" 
lab="C12"	NH="2" 
lab="C13"	NH="2" 
lab="C14"	NH="2" 
lab="N17"	NH="1" 
lab="C18"	NH="2" 
lab="C19"	NH="0" 
lab="C20"	NH="0" 
lab="C25"	NH="2" 
lab="N27"	NH="2" 
lab="C21"	NH="1" 
lab="C22"	NH="1" 
lab="C23"	NH="0" 
lab="CL2"	NH="0" 
lab="C24"	NH="1" 
