mol="CPQ" Charge="0"
lab="C1"	NH="2" 
lab="C2"	NH="0" 
lab="C3"	NH="2" 
lab="C4"	NH="1" 
lab="C5"	NH="0" 
lab="C6"	NH="1" 
lab="C7"	NH="2" 
lab="C8"	NH="2" 
lab="C9"	NH="1" 
lab="C10"	NH="3" 
lab="C11"	NH="3" 
lab="C12"	NH="2" 
lab="C13"	NH="1" 
lab="C14"	NH="2" 
lab="C15"	NH="1" 
lab="C16"	NH="2" 
lab="C17"	NH="2" 
lab="C18"	NH="1" 
lab="C19"	NH="1" 
lab="C20"	NH="1" 
lab="C21"	NH="3" 
lab="C22"	NH="2" 
lab="C23"	NH="2" 
lab="O2"	NH="1" 
lab="O4"	NH="1" 
lab="C57"	NH="0" 
lab="N59"	NH="0" 
lab="C74"	NH="2" 
lab="C75"	NH="2" 
lab="C76"	NH="2" 
lab="N77"	NH="1" 
lab="C78"	NH="0" 
lab="C80"	NH="1" 
lab="O86"	NH="1" 
lab="C81"	NH="1" 
lab="O87"	NH="1" 
lab="C82"	NH="1" 
lab="O88"	NH="1" 
lab="C83"	NH="1" 
lab="O89"	NH="1" 
lab="C84"	NH="2" 
lab="O85"	NH="1" 
lab="O79"	NH="0" 
lab="C68"	NH="2" 
lab="C69"	NH="2" 
lab="C70"	NH="2" 
lab="N71"	NH="1" 
lab="C72"	NH="0" 
lab="C90"	NH="1" 
lab="O96"	NH="1" 
lab="C91"	NH="1" 
lab="O97"	NH="1" 
lab="C92"	NH="1" 
lab="O98"	NH="1" 
lab="C93"	NH="1" 
lab="O99"	NH="1" 
lab="C94"	NH="2" 
lab="O95"	NH="1" 
lab="O73"	NH="0" 
lab="O58"	NH="0" 
