mol="5RS"	Charge="0"
lab="C14"	NH="0"
lab="C11"	NH="1"
lab="C10"	NH="2"
lab="C12"	NH="2"
lab="C01"	NH="3"
lab="C02"	NH="2"
lab="C03"	NH="1"
lab="C04"	NH="2"
lab="C05"	NH="0"
lab="N06"	NH="1"
lab="C07"	NH="0"
lab="O08"	NH="0"
lab="C09"	NH="1"
lab="N13"	NH="0"
lab="O15"	NH="0"
lab="C16"	NH="1"
lab="N17"	NH="1"
lab="C18"	NH="0"
lab="O19"	NH="0"
lab="O20"	NH="0"
lab="C21"	NH="0"
lab="C22"	NH="3"
lab="C23"	NH="3"
lab="C24"	NH="3"
lab="C25"	NH="0"
lab="C26"	NH="3"
lab="C27"	NH="3"
lab="C28"	NH="3"
lab="O29"	NH="0"
lab="C30"	NH="0"
lab="C31"	NH="0"
lab="C32"	NH="2"
lab="C33"	NH="3"
lab="N34"	NH="0"
lab="C35"	NH="0"
lab="C36"	NH="1"
lab="C37"	NH="1"
lab="C38"	NH="0"
lab="C39"	NH="1"
lab="C40"	NH="0"
lab="N41"	NH="0"
lab="O42"	NH="0"
lab="C43"	NH="3"
lab="C44"	NH="0"
lab="O45"	NH="0"
lab="N46"	NH="1"
lab="S47"	NH="0"
lab="O48"	NH="0"
lab="O49"	NH="0"
lab="C50"	NH="1"
lab="C51"	NH="2"
lab="C52"	NH="2"
lab="H111"	NH="0"
lab="H101"	NH="0"
lab="H102"	NH="0"
lab="H121"	NH="0"
lab="H122"	NH="0"
lab="H011"	NH="0"
lab="H012"	NH="0"
lab="H1"	NH="0"
lab="H2"	NH="0"
lab="H3"	NH="0"
lab="H031"	NH="0"
lab="H041"	NH="0"
lab="H042"	NH="0"
lab="H061"	NH="0"
lab="H091"	NH="0"
lab="H161"	NH="0"
lab="H171"	NH="0"
lab="H221"	NH="0"
lab="H222"	NH="0"
lab="H223"	NH="0"
lab="H231"	NH="0"
lab="H232"	NH="0"
lab="H233"	NH="0"
lab="H241"	NH="0"
lab="H242"	NH="0"
lab="H243"	NH="0"
lab="H261"	NH="0"
lab="H262"	NH="0"
lab="H263"	NH="0"
lab="H271"	NH="0"
lab="H272"	NH="0"
lab="H273"	NH="0"
lab="H281"	NH="0"
lab="H282"	NH="0"
lab="H283"	NH="0"
lab="H321"	NH="0"
lab="H322"	NH="0"
lab="H331"	NH="0"
lab="H332"	NH="0"
lab="H333"	NH="0"
lab="H361"	NH="0"
lab="H371"	NH="0"
lab="H391"	NH="0"
lab="H431"	NH="0"
lab="H432"	NH="0"
lab="H433"	NH="0"
lab="H461"	NH="0"
lab="H501"	NH="0"
lab="H511"	NH="0"
lab="H512"	NH="0"
lab="H521"	NH="0"
lab="H522"	NH="0"
