mol="B94" Charge="0"
lab="C1"	NH="3" 
lab="C2"	NH="0" 
lab="O3"	NH="0" 
lab="C4"	NH="1" 
lab="C5"	NH="2" 
lab="C6"	NH="0" 
lab="O7"	NH="1" 
lab="O8"	NH="0" 
lab="N9"	NH="1" 
lab="C10"	NH="0" 
lab="O11"	NH="0" 
lab="C12"	NH="1" 
lab="C13"	NH="1" 
lab="C14"	NH="1" 
lab="C15"	NH="1" 
lab="C16"	NH="2" 
lab="N29"	NH="0" 
lab="N30"	NH="0" 
lab="C31"	NH="0" 
lab="O32"	NH="0" 
lab="N33"	NH="0" 
lab="C34"	NH="2" 
lab="C35"	NH="2" 
lab="C36"	NH="2" 
lab="C37"	NH="0" 
lab="O38"	NH="0" 
lab="O39"	NH="1" 
lab="C40"	NH="0" 
lab="O41"	NH="0" 
lab="C18"	NH="2" 
lab="N5"	NH="1" 
lab="C19"	NH="0" 
lab="C20"	NH="2" 
lab="O9"	NH="0" 
lab="C21"	NH="0" 
lab="C22"	NH="1" 
lab="C23"	NH="1" 
lab="C24"	NH="0" 
lab="C25"	NH="1" 
lab="C26"	NH="1" 
lab="CL1"	NH="0" 
