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F5S

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O01C02sing1.36Å1.41Å
C34C02doub1.39Å1.39ÅAromatic
C34C32sing1.38Å1.39ÅAromatic
C02C03sing1.41Å1.39ÅAromatic
O08C04doub1.22Å1.22Å
O33C32sing1.36Å1.41Å
C32C31doub1.38Å1.40ÅAromatic
C03C04sing1.48Å1.53Å
C03C09doub1.40Å1.41ÅAromatic
C04O05sing1.34Å1.42Å
C31C09sing1.38Å1.40ÅAromatic
C09C10sing1.52Å1.56Å
C19C06sing1.52Å1.51Å
C19C17sing1.52Å1.52Å
O05C06sing1.44Å1.39Å
C06C07sing1.52Å1.52Å
O18C17sing1.43Å1.49Å
O18C16sing1.43Å1.51Å
C28O27sing1.43Å1.41Å
C17C16sing1.54Å1.58Å
C10C11sing1.50Å1.53Å
C29C30doub1.38Å1.39ÅAromatic
C29C26sing1.39Å1.40ÅAromatic
O27C26sing1.36Å1.41Å
C30C23sing1.38Å1.39ÅAromatic
C13C14sing1.46Å1.53Å
C13C12doub1.34Å1.37Å
C26C25doub1.39Å1.39ÅAromatic
C15C14doub1.34Å1.36Å
C11C12sing1.45Å1.53Å
C11N20doub1.30Å1.33Å
O21N20sing1.42Å1.37Å
O21C22sing1.43Å1.42Å
C23C22sing1.51Å1.52Å
C23C24doub1.38Å1.39ÅAromatic
C25C24sing1.38Å1.39ÅAromatic
C10H102sing1.09Å1.10Å
C10H101sing1.09Å1.10Å
C13H131sing1.10Å1.08Å
C15H151sing1.07Å1.08Å
C17H171sing1.10Å1.10Å
C22H222sing1.09Å1.10Å
C22H221sing1.09Å1.10Å
C24H241sing1.08Å1.08Å
C28H282sing1.09Å1.10Å
C28H281sing1.09Å1.10Å
C28H283sing1.09Å1.10Å
O01H011sing0.97Å0.95Å
C06H061sing1.10Å1.10Å
C07H073sing1.09Å1.10Å
C07H071sing1.09Å1.10Å
C07H072sing1.09Å1.10Å
C12H121sing1.09Å1.08Å
C14H141sing1.07Å1.08Å
C16H2sing1.08Å1.10Å
C19H192sing1.09Å1.10Å
C19H191sing1.09Å1.10Å
C25H251sing1.08Å1.08Å
C29H291sing1.08Å1.08Å
C30H301sing1.08Å1.08Å
C31H311sing1.08Å1.08Å
O33H331sing0.97Å0.95Å
C34H341sing1.08Å1.08Å
C16C15sing1.51Å1.70Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O01C02C34120.3°119.6°
O01C02C03119.2°120.9°
C02O01H011109.5°114.0°
C02C34C32119.6°120.1°
C34C02C03120.5°119.6°
C02C34H341120.2°119.9°
C34C32O33119.0°119.8°
C34C32C31120.4°120.5°
C32C34H341120.2°120.0°
C02C03C04116.2°118.3°
C02C03C09120.7°119.2°
O08C04C03119.3°119.3°
O08C04O05121.5°119.6°
O33C32C31120.6°119.8°
C32O33H331109.5°114.0°
C32C31C09120.3°120.3°
C32C31H311119.9°120.1°
C04C03C09123.1°122.5°
C03C04O05119.2°121.1°
C03C09C31118.5°120.4°
C03C09C10121.0°121.7°
C04O05C06115.4°123.0°
C31C09C10120.4°118.0°
C09C31H311119.8°119.7°
C09C10C11119.9°108.3°
C09C10H102106.8°109.7°
C09C10H101106.8°109.7°
C06C19C17113.2°111.6°
C19C06O05106.8°110.5°
C19C06C07109.6°111.7°
C19C06H061109.5°107.8°
C06C19H192108.5°109.5°
C06C19H191108.5°109.2°
C19C17O18111.1°119.5°
C19C17C16122.7°116.4°
C19C17H171117.0°116.8°
C17C19H192108.5°109.3°
C17C19H191108.5°109.2°
O05C06C07110.6°111.1°
O05C06H061111.1°107.8°
C07C06H061109.3°107.8°
C06C07H073109.5°109.4°
C06C07H071109.5°109.5°
C06C07H072109.5°109.5°
C17O18C1663.3°65.4°
O18C17C1659.0°57.2°
O18C17H171117.5°118.6°
O18C16C1757.7°57.4°
O18C16H2103.5°117.7°
O18C16C15132.1°118.5°
C28O27C26120.8°117.1°
O27C28H282109.5°109.4°
O27C28H281109.5°109.5°
O27C28H283109.5°109.5°
C16C17H171115.9°114.4°
C17C16H2103.0°117.8°
C17C16C15149.0°116.4°
C10C11C12122.9°123.7°
C10C11N20119.8°118.2°
C11C10H102106.8°109.8°
C11C10H101106.8°109.9°
C30C29C26119.9°120.0°
C29C30C23119.4°120.0°
C30C29H291120.1°120.0°
C29C30H301120.3°120.0°
C29C26O27123.5°120.0°
C29C26C25120.3°119.9°
C26C29H291120.1°120.0°
O27C26C25116.2°120.1°
C30C23C22119.4°119.9°
C30C23C24121.0°120.1°
C23C30H301120.3°119.9°
C14C13C12118.0°125.0°
C13C14C15126.2°117.2°
C14C13H131121.0°115.9°
C13C14H141116.9°121.7°
C13C12C11123.7°120.6°
C12C13H131121.0°119.1°
C13C12H121118.1°121.0°
C26C25C24120.0°120.0°
C26C25H251120.0°120.0°
C14C15H151118.9°121.6°
C15C14H141116.9°121.1°
C14C15C16122.3°118.8°
C12C11N20117.3°118.1°
C11C12H121118.2°118.5°
C11N20O21120.7°120.0°
N20O21C22106.9°114.0°
O21C22C23105.5°109.5°
O21C22H222110.4°109.4°
O21C22H221110.5°109.5°
C22C23C24119.6°119.9°
C23C22H222110.5°109.4°
C23C22H221110.4°109.5°
C23C24C25119.4°120.0°
C23C24H241120.3°120.0°
C25C24H241120.3°120.0°
C24C25H251120.0°120.0°
H102C10H101109.4°109.5°
H151C15C16118.8°119.5°
H222C22H221109.5°109.5°
H282C28H281109.5°109.5°
H282C28H283109.5°109.5°
H281C28H283109.5°109.5°
H073C07H071109.5°109.5°
H073C07H072109.5°109.5°
H071C07H072109.5°109.5°
H2C16C15102.0°116.2°
H192C19H191109.5°108.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O01C02C34C03179.8°179.8°
O01C02C34C32179.7°179.8°
O01C02C03C040.4°1.3°
O01C02C03C09179.5°179.7°
O01C02C34H3410.3°0.4°
C02C34C32H341180.0°179.8°
C02C34C32O33179.9°179.9°
C02C34C32C310.2°0.0°
C34C02C03C04179.9°178.6°
C34C02C03C090.7°0.5°
C34C02O01H011164.4°90.2°
C32C34C02C030.0°0.4°
C34C32O33C31179.7°179.9°
C34C32C31C090.5°0.3°
C34C32C31H311179.5°179.8°
C34C32O33H331180.0°90.0°
C02C03C04O0841.7°170.1°
C02C03C04C09179.1°179.0°
C02C03C04O05137.1°8.3°
C02C03C09C311.4°0.2°
C02C03C09C10179.0°180.0°
C03C02O01H01115.4°90.0°
C03C02C34H341180.0°179.5°
O08C04C03O05178.8°178.4°
O08C04C03C09139.2°10.9°
O08C04O05C069.2°20.2°
O33C32C31C09179.3°179.8°
O33C32C31H3110.7°0.1°
O33C32C34H3410.1°0.2°
C32C31C09C031.2°0.2°
C32C31C09H311180.0°179.9°
C32C31C09C10178.8°179.6°
C31C32O33H3310.2°90.1°
C31C32C34H341179.8°179.8°
C04C03C09C31179.6°178.8°
C04C03C09C102.0°1.0°
C03C04O05C06171.9°161.4°
C09C03C04O0542.0°170.7°
C03C09C31C10177.6°179.8°
C03C09C10C11119.0°58.4°
C03C09C10H102119.5°178.2°
C03C09C10H1012.5°61.6°
C03C09C31H311178.8°179.9°
C04O05C06C1993.9°51.2°
C04O05C06C07146.9°73.4°
C04O05C06H06125.4°168.7°
C31C09C10C1163.5°121.4°
C31C09C10H10258.0°1.7°
C31C09C10H101175.1°118.6°
C09C10C11H102121.5°119.7°
C09C10C11H101121.5°119.9°
C09C10C11C1271.6°149.6°
C09C10C11N20111.7°31.0°
C09C10H102H101115.3°120.4°
C10C09C31H3111.2°0.3°
C06C19C17H192120.5°121.2°
C06C19C17H191120.5°120.8°
C19C06O05C07119.1°124.6°
C19C06O05H061119.3°117.5°
C19C06C07H061120.0°118.2°
C06C19C17O18135.2°101.1°
C06C19C17C1669.2°166.6°
C06C19C17H17186.1°53.2°
C19C06C07H073180.0°176.1°
C19C06C07H07160.0°56.1°
C19C06C07H07260.0°63.9°
C06C19H192H191118.3°118.8°
C17C19C06O0573.3°116.4°
C17C19C06C0746.5°7.8°
C19C17O18C16116.3°104.1°
C19C17O18H171138.5°153.9°
C19C17C16H171155.6°141.1°
C17C19C06H061166.4°126.1°
C19C17C16H21.4°2.8°
C17C19H192H191118.3°118.7°
C19C17C16C15144.3°142.2°
O05C06C07H061122.6°117.9°
O05C06C07H07362.6°60.0°
O05C06C07H071177.4°180.0°
O05C06C07H07257.4°60.0°
O05C06C19H192166.2°4.7°
O05C06C19H19147.3°122.9°
C06C07H073H071120.0°120.0°
C06C07H073H072120.0°120.0°
C06C07H071H072120.0°120.0°
C07C06C19H19274.0°128.9°
C07C06C19H191167.1°112.9°
O18C17C16H171107.9°109.4°
C17O18C16H296.9°106.8°
O18C17C19H192104.3°137.7°
O18C17C19H19114.7°19.6°
C17O18C16C15142.7°104.6°
O18C16C15C14151.8°118.7°
O18C16C15H15128.2°58.6°
O18C16H2C15139.1°149.2°
C28O27C26C298.9°0.0°
C28O27C26C25171.5°180.0°
O27C28H282H281120.0°120.0°
O27C28H282H283120.0°120.0°
O27C28H281H283120.0°120.0°
C17C16C15C14112.2°53.2°
C17C16C15H15167.8°124.1°
C17C16H2C15161.5°145.0°
C16C17C19H192170.2°72.2°
C16C17C19H19151.3°45.9°
C10C11C12C1357.0°154.9°
C10C11C12N20176.7°179.4°
C10C11N20O211.9°0.0°
C11C10H102H101115.2°120.7°
C10C11C12H121123.0°25.0°
C30C29C26H291180.0°179.8°
C30C29C26O27179.6°179.8°
C29C30C23H301180.0°179.7°
C30C29C26C250.0°0.2°
C29C30C23C22179.9°180.0°
C29C30C23C240.4°0.0°
C29C26O27C25179.7°180.0°
C26C29C30C230.3°0.2°
C29C26C25C240.4°0.0°
C29C26C25H251179.6°179.9°
C26C29C30H301179.7°180.0°
O27C26C25C24179.3°180.0°
C26O27C28H282180.0°60.0°
C26O27C28H28160.0°180.0°
C26O27C28H28360.0°60.0°
O27C26C25H2510.7°0.1°
O27C26C29H2910.4°0.1°
C30C23C22O2153.5°90.0°
C30C23C22C24179.5°180.0°
C30C23C24C250.0°0.3°
C30C23C22H22265.9°150.0°
C30C23C22H221172.8°30.0°
C30C23C24H241180.0°180.0°
C23C30C29H291179.7°179.9°
C14C13C12H131180.0°179.5°
C13C14C15H141180.0°180.0°
C14C13C12C11177.3°179.6°
C13C14C15H151177.1°176.8°
C14C13C12H1212.7°0.6°
C13C14C15C162.9°6.0°
C12C13C14C15101.9°150.5°
C13C12C11H121180.0°179.9°
C13C12C11N20126.3°25.7°
C12C13C14H14178.1°29.5°
C26C25C24C230.4°0.3°
C26C25C24H251180.0°179.9°
C26C25C24H241179.6°180.0°
C25C26C29H291179.9°179.9°
C15C14C13H13178.1°30.0°
C14C15H151C16180.0°177.2°
C14C15C16H230.9°92.4°
C12C11N20O21178.7°179.4°
C12C11C10H102166.9°90.7°
C12C11C10H10149.9°29.8°
C11C12C13H1312.7°0.1°
C11N20O21C22168.2°180.0°
N20C11C10H1029.8°88.7°
N20C11C10H101126.8°150.9°
N20C11C12H12153.7°154.4°
N20O21C22C2390.5°180.0°
N20O21C22H222150.1°60.0°
N20O21C22H22128.8°60.0°
O21C22C23H222119.4°119.9°
O21C22C23H221119.4°120.0°
O21C22C23C24126.0°90.0°
O21C22H222H221121.9°120.0°
C22C23C24C25179.5°179.7°
C23C22H222H221121.8°120.0°
C22C23C24H2410.5°0.0°
C22C23C30H3010.2°0.3°
C23C24C25H241180.0°179.8°
C24C23C22H222114.6°30.0°
C24C23C22H2216.7°150.0°
C23C24C25H251179.6°179.7°
C24C23C30H301179.7°179.7°
H131C13C12H121177.3°180.0°
H131C13C14H141101.9°150.0°
H151C15C14H1412.9°3.3°
H151C15C16H2149.1°90.4°
H171C17C16H2154.2°144.0°
H171C17C19H19234.5°68.0°
H171C17C19H191153.4°174.0°
H171C17C16C1511.3°1.1°
H241C24C25H2510.3°0.1°
H282C28H281H283120.0°120.0°
H061C06C07H07360.0°57.8°
H061C06C07H07160.0°62.2°
H061C06C07H072180.0°177.8°
H061C06C19H19245.9°112.8°
H061C06C19H19173.1°5.3°
H073C07H071H072120.0°120.0°
H141C14C15C16177.1°174.0°
H291C29C30H3010.3°0.2°

224931

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