mol="0CR" Charge="0"
lab="N1"	NH="2" 
lab="N2"	NH="0" 
lab="N3"	NH="0" 
lab="C01"	NH="2" 
lab="C02"	NH="0" 
lab="C03"	NH="1" 
lab="C04"	NH="0" 
lab="C05"	NH="0" 
lab="C06"	NH="1" 
lab="C07"	NH="0" 
lab="C08"	NH="2" 
lab="C09"	NH="0" 
lab="C10"	NH="1" 
lab="C11"	NH="0" 
lab="C12"	NH="0" 
lab="C13"	NH="1" 
lab="C14"	NH="0" 
lab="C15"	NH="2" 
lab="C16"	NH="0" 
lab="C17"	NH="1" 
lab="C18"	NH="0" 
lab="C19"	NH="0" 
lab="C20"	NH="1" 
lab="C21"	NH="0" 
lab="C22"	NH="2" 
lab="C23"	NH="0" 
lab="C24"	NH="1" 
lab="C25"	NH="0" 
lab="C26"	NH="0" 
lab="C27"	NH="1" 
lab="C28"	NH="0" 
lab="C29"	NH="2" 
lab="C30"	NH="0" 
lab="C31"	NH="1" 
lab="C32"	NH="0" 
lab="C33"	NH="0" 
lab="C34"	NH="1" 
lab="C35"	NH="0" 
lab="C36"	NH="2" 
lab="C37"	NH="0" 
lab="C38"	NH="1" 
lab="C39"	NH="0" 
lab="C40"	NH="0" 
lab="C41"	NH="1" 
lab="C42"	NH="0" 
lab="C46"	NH="2" 
lab="C47"	NH="2" 
lab="C51"	NH="3" 
lab="C52"	NH="2" 
lab="C56"	NH="3" 
lab="C57"	NH="2" 
lab="C58"	NH="2" 
lab="C59"	NH="3" 
lab="C60"	NH="2" 
lab="O01"	NH="0" 
lab="O02"	NH="0" 
lab="O03"	NH="0" 
lab="O04"	NH="0" 
lab="O05"	NH="0" 
lab="O06"	NH="0" 
lab="O07"	NH="0" 
lab="O08"	NH="0" 
lab="O09"	NH="0" 
lab="O10"	NH="0" 
lab="O11"	NH="0" 
lab="O12"	NH="0" 
lab="C61"	NH="0" 
lab="C62"	NH="1" 
lab="C64"	NH="1" 
lab="C65"	NH="0" 
lab="C66"	NH="1" 
lab="C67"	NH="1" 
lab="C68"	NH="2" 
lab="C69"	NH="2" 
lab="O13"	NH="0" 
lab="O14"	NH="0" 
lab="S1"	NH="0" 
lab="C70"	NH="2" 
lab="C71"	NH="0" 
lab="C72"	NH="1" 
lab="N4"	NH="0" 
lab="CT5"	NH="2" 
lab="CN5"	NH="0" 
lab="CN6"	NH="1" 
lab="NN7"	NH="0" 
lab="NN8"	NH="0" 
lab="NN9"	NH="0" 
lab="CI5"	NH="2" 
lab="CI6"	NH="2" 
lab="CO5"	NH="0" 
lab="O51"	NH="1" 
lab="O52"	NH="0" 
lab="CO3"	NH="0" 
lab="O31"	NH="1" 
lab="O32"	NH="0" 
lab="CI3"	NH="2" 
lab="CI4"	NH="2" 
lab="NN4"	NH="0" 
lab="NN5"	NH="0" 
lab="NN6"	NH="0" 
lab="CT3"	NH="2" 
lab="CN3"	NH="0" 
lab="CN4"	NH="1" 
