mol="4SS"	Charge="0"
lab="C2"	NH="0"
lab="C3"	NH="1"
lab="C44"	NH="0"
lab="C45"	NH="0"
lab="C46"	NH="1"
lab="C48"	NH="0"
lab="C49"	NH="1"
lab="C51"	NH="1"
lab="C53"	NH="3"
lab="C58"	NH="2"
lab="C12"	NH="1"
lab="C15"	NH="0"
lab="C16"	NH="2"
lab="C19"	NH="0"
lab="C20"	NH="0"
lab="C21"	NH="1"
lab="C23"	NH="0"
lab="C24"	NH="0"
lab="C25"	NH="1"
lab="C28"	NH="2"
lab="CL1"	NH="0"
lab="C5"	NH="1"
lab="C7"	NH="0"
lab="C8"	NH="1"
lab="C10"	NH="1"
lab="N14"	NH="0"
lab="O27"	NH="0"
lab="C31"	NH="3"
lab="O35"	NH="0"
lab="C36"	NH="2"
lab="C39"	NH="3"
lab="O43"	NH="0"
lab="O57"	NH="0"
lab="C61"	NH="0"
lab="N62"	NH="1"
lab="N63"	NH="0"
lab="N65"	NH="0"
lab="N66"	NH="0"
lab="H1"	NH="0"
lab="H2"	NH="0"
lab="H3"	NH="0"
lab="H4"	NH="0"
lab="H5"	NH="0"
lab="H6"	NH="0"
lab="H7"	NH="0"
lab="H8"	NH="0"
lab="H9"	NH="0"
lab="H10"	NH="0"
lab="H11"	NH="0"
lab="H12"	NH="0"
lab="H13"	NH="0"
lab="H14"	NH="0"
lab="H15"	NH="0"
lab="H16"	NH="0"
lab="H17"	NH="0"
lab="H18"	NH="0"
lab="H19"	NH="0"
lab="H20"	NH="0"
lab="H21"	NH="0"
lab="H22"	NH="0"
lab="H23"	NH="0"
lab="H24"	NH="0"
lab="H25"	NH="0"
lab="H26"	NH="0"
lab="H27"	NH="0"
lab="H28"	NH="0"
