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E1V

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C01C02sing1.53Å1.53Å
C26C27sing1.53Å1.53Å
C26C25sing1.53Å1.53Å
O05C04doub1.22Å1.18Å
C27C22sing1.53Å1.53Å
C02O03sing1.45Å1.40Å
C25C24sing1.53Å1.53Å
O03C04sing1.35Å1.40Å
C04C06sing1.47Å1.54Å
C22C23sing1.53Å1.51Å
C22C21sing1.53Å1.53Å
C24C23sing1.53Å1.53Å
C21N20sing1.47Å1.46Å
C06N20sing1.38Å1.33ÅAromatic
C06C07doub1.36Å1.40ÅAromatic
N20C19sing1.37Å1.36ÅAromatic
C07C08sing1.42Å1.43ÅAromatic
C19C08doub1.41Å1.37ÅAromatic
C19C18sing1.39Å1.42ÅAromatic
C08C09sing1.40Å1.42ÅAromatic
C18C17doub1.36Å1.39ÅAromatic
C09C10doub1.39Å1.39ÅAromatic
C17C10sing1.40Å1.39ÅAromatic
C10C11sing1.48Å1.39Å
C11C12doub1.40Å1.38ÅAromatic
C11C16sing1.40Å1.39ÅAromatic
C12C13sing1.38Å1.39ÅAromatic
C16C15doub1.38Å1.39ÅAromatic
C13N14doub1.32Å1.32ÅAromatic
C15N14sing1.32Å1.32ÅAromatic
C12H121sing1.08Å1.08Å
C13H131sing1.08Å1.08Å
C24H242sing1.09Å1.10Å
C24H241sing1.09Å1.10Å
C25H251sing1.09Å1.10Å
C25H252sing1.09Å1.10Å
C26H262sing1.09Å1.10Å
C26H261sing1.09Å1.10Å
C27H271sing1.09Å1.10Å
C27H272sing1.09Å1.10Å
C23H231sing1.09Å1.10Å
C23H232sing1.09Å1.10Å
C15H151sing1.08Å1.08Å
C22H221sing1.09Å1.10Å
C01H011sing1.09Å1.10Å
C01H012sing1.09Å1.10Å
C01H013sing1.09Å1.10Å
C02H021sing1.09Å1.10Å
C02H022sing1.09Å1.10Å
C07H071sing1.08Å1.08Å
C09H091sing1.08Å1.08Å
C16H161sing1.08Å1.08Å
C17H171sing1.08Å1.08Å
C18H181sing1.08Å1.08Å
C21H212sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02O03108.2°109.5°
C02C01H011109.5°109.4°
C02C01H012109.4°109.5°
C02C01H013109.5°109.5°
C01C02H021109.8°109.5°
C01C02H022109.8°109.5°
C27C26C25116.3°109.5°
C26C27C22115.8°109.4°
C27C26H262107.8°109.5°
C27C26H261107.7°109.4°
C26C27H271107.9°109.4°
C26C27H272107.8°109.5°
C26C25C24116.4°109.5°
C26C25H251107.7°109.5°
C26C25H252107.7°109.5°
C25C26H262107.7°109.5°
C25C26H261107.8°109.5°
O05C04O03119.1°120.0°
O05C04C06122.0°120.0°
C27C22C23110.1°109.5°
C27C22C21107.0°109.5°
C22C27H271107.9°109.4°
C22C27H272107.9°109.5°
C27C22H221108.9°109.5°
C02O03C04115.2°117.0°
O03C02H021109.8°109.4°
O03C02H022109.8°109.5°
C25C24C23114.7°109.5°
C25C24H242108.1°109.4°
C25C24H241108.1°109.5°
C24C25H251107.7°109.5°
C24C25H252107.7°109.5°
O03C04C06118.9°120.0°
C04C06N20127.7°125.4°
C04C06C07123.7°125.4°
C23C22C21112.6°109.4°
C22C23C24111.0°109.5°
C22C23H231109.1°109.5°
C22C23H232109.1°109.5°
C23C22H221109.2°109.5°
C22C21N20114.0°109.5°
C21C22H221109.0°109.4°
C22C21H212108.3°109.5°
C22C21H211108.3°109.5°
C23C24H242108.1°109.4°
C23C24H241108.1°109.5°
C24C23H231109.1°109.5°
C24C23H232109.1°109.4°
C21N20C06126.8°125.6°
C21N20C19124.0°125.6°
N20C21H212108.3°109.5°
N20C21H211108.4°109.5°
N20C06C07108.6°109.1°
C06N20C19109.2°108.8°
C06C07C08106.6°107.7°
C06C07H071126.7°126.2°
N20C19C08109.9°107.4°
N20C19C18129.5°133.0°
C07C08C19105.7°106.9°
C07C08C09134.9°133.3°
C08C07H071126.7°126.1°
C08C19C18120.6°119.7°
C19C08C09119.4°119.7°
C19C18C17119.8°120.3°
C19C18H181120.1°119.9°
C08C09C10120.0°119.5°
C08C09H091120.0°120.2°
C18C17C10120.2°120.7°
C18C17H171119.9°119.7°
C17C18H181120.1°119.8°
C09C10C17120.0°120.2°
C09C10C11121.3°119.9°
C10C09H091120.0°120.3°
C17C10C11118.7°119.9°
C10C17H171119.9°119.6°
C10C11C12120.1°120.9°
C10C11C16120.9°121.0°
C12C11C16118.9°118.1°
C11C12C13118.7°119.1°
C11C12H121120.6°120.5°
C11C16C15118.7°119.1°
C11C16H161120.6°120.5°
C12C13N14121.5°120.8°
C13C12H121120.6°120.4°
C12C13H131119.2°119.6°
C16C15N14121.4°120.9°
C16C15H151119.3°119.6°
C15C16H161120.7°120.5°
C13N14C15120.8°122.0°
N14C13H131119.3°119.6°
N14C15H151119.3°119.6°
H242C24H241109.5°109.5°
H251C25H252109.5°109.4°
H262C26H261109.5°109.5°
H271C27H272109.5°109.5°
H231C23H232109.5°109.5°
H011C01H012109.5°109.5°
H011C01H013109.5°109.5°
H012C01H013109.5°109.5°
H021C02H022109.5°109.4°
H212C21H211109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02O03H021119.8°120.0°
C01C02O03H022119.8°120.1°
C01C02O03C04119.2°180.0°
C02C01H011H012120.0°120.0°
C02C01H011H013120.0°120.0°
C02C01H012H013120.0°120.0°
C01C02H021H022120.6°120.0°
C27C26C25H262121.0°120.0°
C27C26C25H261121.0°119.9°
C26C27C22H271120.9°119.9°
C26C27C22H272120.9°120.1°
C27C26C25C2436.5°60.0°
C26C27C22C2335.9°60.0°
C26C27C22C21158.6°180.0°
C27C26C25H25184.5°60.1°
C27C26C25H252157.5°180.0°
C27C26H262H261116.9°119.9°
C26C27H271H272117.1°120.0°
C26C27C22H22183.8°60.1°
C25C26C27C2213.6°59.9°
C26C25C24H251121.0°120.0°
C26C25C24H252121.0°120.0°
C26C25C24C238.1°60.0°
C26C25C24H242128.8°60.0°
C26C25C24H241112.7°180.0°
C26C25H251H252116.9°119.9°
C25C26H262H261116.9°120.1°
C25C26C27H271134.5°60.0°
C25C26C27H272107.3°180.0°
O05C04O03C0287.9°0.0°
O05C04O03C06179.0°180.0°
O05C04C06N2015.9°180.0°
O05C04C06C07165.4°0.0°
C27C22C23C21119.3°120.0°
C27C22C23H221119.5°120.1°
C27C22C21H221117.6°120.0°
C27C22C23C2464.7°60.0°
C27C22C21N20144.8°175.0°
C22C27C26H262134.6°180.0°
C22C27C26H261107.4°60.0°
C22C27H271H272117.1°120.1°
C27C22C23H23155.6°180.0°
C27C22C23H232175.1°59.9°
C27C22C21H21224.2°65.0°
C27C22C21H21194.5°55.0°
C02O03C04C0693.1°179.9°
O03C02C01H011180.0°179.9°
O03C02C01H01260.0°60.0°
O03C02C01H01360.0°60.1°
O03C02H021H022120.6°120.0°
C25C24C23C2242.2°59.9°
C25C24C23H242120.8°120.0°
C25C24C23H241120.7°120.0°
C25C24H242H241117.6°120.0°
C24C25H251H252116.9°120.0°
C24C25C26H262157.5°180.0°
C24C25C26H26184.5°59.9°
C25C24C23H23178.1°180.0°
C25C24C23H232162.4°60.0°
O03C04C06N20163.0°0.0°
O03C04C06C0715.7°179.9°
C04O03C02H0210.6°60.0°
C04O03C02H022121.0°59.9°
C04C06N20C210.6°0.0°
C04C06N20C07178.9°180.0°
C04C06N20C19178.9°180.0°
C04C06C07C08179.2°180.0°
C04C06C07H0710.8°0.0°
C23C22C21H221121.3°119.9°
C22C23C24H231120.2°120.1°
C22C23C24H232120.2°119.9°
C23C22C21N2023.7°65.0°
C22C23C24H24278.6°60.0°
C22C23C24H241162.9°180.0°
C23C22C27H27185.0°59.9°
C23C22C27H272156.8°180.0°
C22C23H231H232119.3°120.0°
C23C22C21H21296.9°55.0°
C23C22C21H211144.4°175.0°
C21C22C23C24176.1°180.0°
C22C21N20H212120.6°120.1°
C22C21N20H211120.7°120.0°
C22C21N20C06105.9°90.0°
C22C21N20C1974.7°90.0°
C21C22C27H27137.6°60.1°
C21C22C27H27280.5°60.0°
C21C22C23H23163.7°60.0°
C21C22C23H23255.8°60.1°
C22C21H212H211117.9°120.0°
C23C24H242H241117.6°120.0°
C23C24C25H251112.9°60.0°
C23C24C25H252129.1°180.0°
C24C23H231H232119.3°119.9°
C24C23C22H22154.9°60.1°
C21N20C06C19179.5°180.0°
C21N20C06C07179.5°180.0°
C21N20C19C08179.8°180.0°
C21N20C19C180.8°0.4°
N20C21C22H22197.6°55.0°
N20C21H212H211118.0°120.0°
N20C06C07C080.3°0.0°
C06N20C19C080.3°0.1°
C06N20C19C18179.7°179.7°
N20C06C07H071179.7°180.0°
C06N20C21H21214.7°30.0°
C06N20C21H211133.4°150.0°
C07C06N20C190.0°0.0°
C06C07C08H071180.0°180.0°
C06C07C08C190.5°0.1°
C06C07C08C09179.7°180.0°
N20C19C08C070.5°0.1°
N20C19C08C18179.4°179.7°
N20C19C08C09179.6°180.0°
N20C19C18C17179.5°179.9°
N20C19C18H1810.4°0.1°
C19N20C21H212164.7°149.9°
C19N20C21H21146.0°30.0°
C07C08C19C09179.9°179.9°
C07C08C19C18179.9°179.7°
C07C08C09C10179.3°179.9°
C07C08C09H0910.7°0.1°
C08C19C18C170.2°0.4°
C19C08C09C100.9°0.0°
C19C08C07H071179.5°180.0°
C19C08C09H091179.1°180.0°
C08C19C18H181179.8°179.7°
C18C19C08C090.2°0.3°
C19C18C17H181180.0°179.9°
C19C18C17C100.9°0.1°
C19C18C17H171179.1°180.0°
C08C09C10H091180.0°180.0°
C08C09C10C171.6°0.3°
C08C09C10C11178.4°180.0°
C09C08C07H0710.3°0.1°
C18C17C10C091.6°0.2°
C18C17C10H171180.0°179.9°
C18C17C10C11178.5°179.9°
C09C10C17C11176.9°179.7°
C09C10C11C1217.4°180.0°
C09C10C11C16165.3°0.3°
C09C10C17H171178.4°179.7°
C17C10C11C12159.5°0.3°
C17C10C11C1617.8°180.0°
C17C10C09H091178.4°179.7°
C10C17C18H181179.1°180.0°
C10C11C12C16177.3°179.7°
C10C11C12C13178.3°179.7°
C10C11C16C15178.5°179.7°
C10C11C12H1211.7°0.2°
C11C10C09H0911.6°0.0°
C10C11C16H1611.5°0.3°
C11C10C17H1711.6°0.0°
C11C12C13H121180.0°180.0°
C12C11C16C151.2°0.0°
C11C12C13N140.2°0.0°
C11C12C13H131179.8°180.0°
C12C11C16H161178.8°179.9°
C16C11C12C131.0°0.0°
C11C16C15H161180.0°180.0°
C11C16C15N140.6°0.0°
C16C11C12H121179.0°180.0°
C11C16C15H151179.3°180.0°
C12C13N14H131180.0°180.0°
C12C13N14C150.4°0.0°
C16C15N14C130.1°0.0°
C16C15N14H151180.0°180.0°
N14C13C12H121179.8°179.9°
C13N14C15H151179.9°180.0°
C15N14C13H131179.6°179.9°
N14C15C16H161179.3°180.0°
H121C12C13H1310.2°0.1°
H242C24C25H2517.9°180.0°
H242C24C25H252110.2°60.0°
H242C24C23H231161.2°60.0°
H242C24C23H23241.6°180.0°
H241C24C25H251126.3°60.0°
H241C24C25H2528.3°59.9°
H241C24C23H23142.7°59.9°
H241C24C23H23276.8°60.0°
H251C25C26H26236.5°59.9°
H251C25C26H261154.5°180.0°
H252C25C26H26281.5°60.0°
H252C25C26H26136.5°60.1°
H262C26C27H271104.5°60.1°
H262C26C27H27213.7°59.9°
H261C26C27H27113.5°180.0°
H261C26C27H272131.7°60.0°
H271C27C22H221155.3°180.0°
H272C27C22H22137.1°60.0°
H231C23C22H221175.1°59.9°
H232C23C22H22165.4°180.0°
H151C15C16H1610.7°0.1°
H221C22C21H212141.8°175.0°
H221C22C21H21123.1°65.0°
H011C01H012H013120.0°120.0°
H011C01C02H02160.2°60.0°
H011C01C02H02260.2°60.0°
H012C01C02H02159.8°60.0°
H012C01C02H022179.7°179.9°
H013C01C02H021179.8°180.0°
H013C01C02H02259.8°60.0°
H171C17C18H1810.9°0.1°

224931

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