1mol="DIT" Charge="2" 2lab="C1" NH="1" 3lab="N2" NH="0" 4lab="C3" NH="1" 5lab="C4" NH="1" 6lab="C5" NH="1" 7lab="C6" NH="1" 8lab="N7" NH="1" 9lab="C8" NH="1" 10lab="C9" NH="1" 11lab="C10" NH="0" 12lab="O10" NH="0" 13lab="C11" NH="1" 14lab="C12" NH="0" 15lab="C13" NH="0" 16lab="C14" NH="0" 17lab="C15" NH="0" 18lab="C16" NH="0" 19lab="C17" NH="0" 20lab="C18" NH="3" 21lab="C19" NH="2" 22lab="C20" NH="2" 23lab="N21" NH="0" 24lab="C22" NH="2" 25lab="C23" NH="2" 26lab="C24" NH="1" 27lab="C25" NH="2" 28lab="C26" NH="2" 29lab="C1X" NH="1" 30lab="N2X" NH="0" 31lab="C3X" NH="1" 32lab="C4X" NH="1" 33lab="C5X" NH="1" 34lab="C6X" NH="1" 35lab="N7X" NH="1" 36lab="C8X" NH="1" 37lab="C9X" NH="1" 38lab="CAX" NH="0" 39lab="OAX" NH="0" 40lab="CBX" NH="1" 41lab="CCX" NH="0" 42lab="CDX" NH="0" 43lab="CEX" NH="0" 44lab="CFX" NH="0" 45lab="CGX" NH="0" 46lab="CHX" NH="0" 47lab="CIX" NH="3" 48lab="CJX" NH="2" 49lab="CKX" NH="2" 50lab="NLX" NH="0" 51lab="CMX" NH="2" 52lab="CNX" NH="2" 53lab="COX" NH="1" 54lab="CPX" NH="2" 55lab="CQX" NH="2" 56