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9ZL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F10C07sing1.40Å1.36Å
F09C07sing1.40Å1.36Å
C07F08sing1.40Å1.37Å
C07C06sing1.51Å1.52Å
N01C06doub1.32Å1.32ÅAromatic
N01C02sing1.32Å1.32ÅAromatic
CL1C22sing1.74Å1.78Å
C06C05sing1.38Å1.39ÅAromatic
C02C03doub1.38Å1.39ÅAromatic
C28C26sing1.53Å1.53Å
C05C04doub1.39Å1.39ÅAromatic
C22C23doub1.38Å1.37ÅAromatic
C22C21sing1.39Å1.39ÅAromatic
C03C04sing1.39Å1.39ÅAromatic
C23C18sing1.40Å1.38ÅAromatic
C26O25sing1.43Å1.41Å
C26C27sing1.53Å1.53Å
O25C21sing1.36Å1.41Å
C04N11sing1.39Å1.47Å
C21C20doub1.39Å1.40ÅAromatic
N14C13sing1.31Å1.36ÅAromatic
N14C15doub1.30Å1.33ÅAromatic
C13C12doub1.34Å1.40ÅAromatic
C18C15sing1.48Å1.52Å
C18C19doub1.40Å1.38ÅAromatic
C15S16sing1.76Å1.69ÅAromatic
C20C19sing1.38Å1.39ÅAromatic
N11C17sing1.46Å1.47Å
C12S16sing1.76Å1.69ÅAromatic
C12C17sing1.51Å1.53Å
C13H131sing1.08Å1.08Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C20H201sing1.08Å1.08Å
C26H261sing1.09Å1.10Å
C28H283sing1.09Å1.10Å
C28H282sing1.09Å1.10Å
C28H281sing1.09Å1.10Å
C02H021sing1.08Å1.08Å
C03H031sing1.08Å1.08Å
C05H051sing1.08Å1.08Å
C19H191sing1.08Å1.08Å
C23H231sing1.08Å1.08Å
C27H271sing1.09Å1.10Å
C27H273sing1.09Å1.10Å
C27H272sing1.09Å1.10Å
N11H111sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F10C07F09108.5°109.5°
F10C07F08110.9°109.5°
F10C07C06108.8°109.5°
F09C07F08110.6°109.4°
F09C07C06110.5°109.5°
F08C07C06107.6°109.5°
C07C06N01118.2°119.6°
C07C06C05121.5°119.6°
C06N01C02121.7°121.9°
N01C06C05120.3°120.8°
N01C02C03120.9°120.8°
N01C02H021119.6°119.6°
CL1C22C23117.2°120.0°
CL1C22C21123.2°119.9°
C06C05C04120.4°119.1°
C06C05H051119.8°120.4°
C02C03C04120.3°119.1°
C03C02H021119.6°119.6°
C02C03H031119.9°120.4°
C28C26O25111.1°109.4°
C28C26C27111.1°109.5°
C28C26H261108.7°109.5°
C26C28H283109.5°109.4°
C26C28H282109.5°109.5°
C26C28H281109.5°109.5°
C05C04C03116.5°118.3°
C05C04N11121.8°120.9°
C04C05H051119.8°120.5°
C23C22C21119.7°120.1°
C22C23C18120.5°119.9°
C22C23H231119.7°120.1°
C22C21O25119.6°119.9°
C22C21C20119.5°120.1°
C03C04N11121.7°120.9°
C04C03H031119.8°120.5°
C23C18C15114.5°120.1°
C23C18C19121.1°119.8°
C18C23H231119.8°120.0°
O25C26C27106.7°109.5°
C26O25C21115.0°117.0°
O25C26H261110.4°109.4°
C27C26H261108.7°109.5°
C26C27H271109.5°109.5°
C26C27H273109.5°109.5°
C26C27H272109.5°109.5°
O25C21C20120.9°119.9°
C04N11C17122.4°120.0°
C04N11H111106.1°120.0°
C21C20C19120.7°120.1°
C21C20H201119.6°119.9°
C13N14C15115.1°117.0°
N14C13C12115.1°115.9°
N14C13H131122.4°122.0°
N14C15C18124.0°125.5°
N14C15S16108.3°109.1°
C13C12S16105.2°108.3°
C13C12C17126.2°125.9°
C12C13H131122.4°122.1°
C15C18C19124.3°120.1°
C18C15S16127.7°125.5°
C18C19C20118.5°120.0°
C18C19H191120.8°120.0°
C15S16C1296.3°89.8°
C19C20H201119.7°120.0°
C20C19H191120.7°120.0°
N11C17C12109.6°109.5°
N11C17H171109.5°109.5°
N11C17H172109.5°109.4°
C17N11H111106.2°120.0°
S16C12C17128.6°125.8°
C12C17H171109.5°109.5°
C12C17H172109.4°109.5°
H171C17H172109.5°109.5°
H283C28H282109.5°109.5°
H283C28H281109.4°109.4°
H282C28H281109.5°109.5°
H271C27H273109.4°109.5°
H271C27H272109.5°109.5°
H273C27H272109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F10C07F09F08121.8°120.0°
F10C07F09C06119.2°120.0°
F10C07F08C06118.8°120.0°
F10C07C06N015.7°150.3°
F10C07C06C05175.1°30.0°
F09C07F08C06120.8°120.0°
F09C07C06N01124.7°30.3°
F09C07C06C0556.1°150.0°
F08C07C06N01114.4°89.7°
F08C07C06C0564.7°90.0°
C07C06N01C05179.2°179.7°
C07C06N01C02179.8°179.7°
C07C06C05C04179.7°180.0°
C07C06C05H0510.3°0.1°
C06N01C02C030.7°0.6°
N01C06C05C040.6°0.3°
C06N01C02H021179.3°179.7°
N01C06C05H051179.4°179.7°
C02N01C06C050.6°0.6°
N01C02C03H021180.0°179.7°
N01C02C03C040.8°0.3°
N01C02C03H031179.2°179.8°
CL1C22C23C21179.9°180.0°
CL1C22C23C18178.8°179.7°
CL1C22C21O250.1°0.0°
CL1C22C21C20179.6°180.0°
CL1C22C23H2311.2°0.0°
C06C05C04H051180.0°179.9°
C06C05C04C030.6°0.1°
C06C05C04N11179.8°180.0°
C02C03C04C050.8°0.1°
C02C03C04H031180.0°179.9°
C02C03C04N11179.9°180.0°
C28C26O25C27121.3°120.0°
C28C26O25H261120.7°120.0°
C28C26C27H261119.6°120.0°
C28C26O25C2189.3°84.8°
C26C28H283H282120.0°120.0°
C26C28H283H281120.0°119.9°
C26C28H282H281120.0°120.0°
C28C26C27H271180.0°180.0°
C28C26C27H27360.0°60.0°
C28C26C27H27260.0°59.9°
C05C04C03N11179.2°180.0°
C05C04N11C17174.8°180.0°
C05C04C03H031179.2°180.0°
C05C04N11H11163.4°0.0°
C22C23C18H231180.0°179.7°
C23C22C21O25179.8°180.0°
C23C22C21C200.6°0.0°
C22C23C18C15178.5°180.0°
C22C23C18C192.4°0.6°
C21C22C23C181.3°0.3°
C22C21O25C26126.3°174.6°
C22C21O25C20179.7°180.0°
C22C21C20C190.9°0.0°
C22C21C20H201179.1°179.7°
C21C22C23H231178.7°179.9°
C03C04N11C176.0°0.0°
C04C03C02H021179.2°180.0°
C03C04C05H051179.3°180.0°
C03C04N11H111115.8°179.9°
C23C18C15N1419.7°179.0°
C23C18C15C19176.0°179.4°
C23C18C15S16156.9°0.6°
C23C18C19C202.7°0.6°
C23C18C19H191177.3°179.4°
O25C26C27H261119.1°120.0°
C26O25C21C2054.1°5.5°
O25C26C28H283180.0°180.0°
O25C26C28H28260.0°60.0°
O25C26C28H28160.0°60.1°
O25C26C27H27158.7°60.0°
O25C26C27H273178.7°180.0°
O25C26C27H27261.3°60.1°
C27C26O25C21149.4°155.1°
C27C26C28H28361.3°60.0°
C27C26C28H282178.6°180.0°
C27C26C28H28158.7°59.9°
C26C27H271H273120.0°120.0°
C26C27H271H272120.0°120.0°
C26C27H273H272120.0°120.0°
O25C21C20C19179.4°180.0°
O25C21C20H2010.6°0.2°
C21O25C26H26131.4°35.1°
C04N11C17H111121.8°179.9°
C04N11C17C1268.5°180.0°
C04N11C17H17151.5°60.0°
C04N11C17H172171.5°60.0°
N11C04C03H0310.1°0.1°
N11C04C05H0510.2°0.0°
C21C20C19C181.9°0.3°
C21C20C19H201180.0°179.8°
C21C20C19H191178.1°179.7°
N14C13C12H131180.0°179.8°
C13N14C15C18178.0°179.9°
C13N14C15S160.8°0.3°
N14C13C12S160.4°0.2°
N14C13C12C17178.8°179.7°
C15N14C13C120.8°0.0°
N14C15C18S16176.7°179.6°
N14C15C18C19164.3°0.4°
N14C15S16C120.5°0.3°
C15N14C13H131179.3°179.7°
C13C12S16C150.1°0.3°
C13C12C17N1185.1°89.9°
C13C12S16C17179.1°179.9°
C13C12C17H17135.0°150.0°
C13C12C17H172154.9°30.0°
C15C18C19C20178.4°180.0°
C18C15S16C12177.6°180.0°
C15C18C19H1911.6°0.0°
C15C18C23H2311.4°0.3°
C19C18C15S1619.1°180.0°
C18C19C20H191180.0°180.0°
C18C19C20H201178.1°180.0°
C19C18C23H231177.6°179.8°
C15S16C12C17179.2°179.7°
N11C17C12S1693.9°90.0°
N11C17C12H171120.0°120.0°
N11C17C12H172120.0°119.9°
N11C17H171H172120.0°120.0°
S16C12C13H131179.7°180.0°
S16C12C17H171146.1°30.0°
S16C12C17H17226.1°150.1°
C17C12C13H1311.2°0.0°
C12C17H171H172119.9°120.0°
C12C17N11H111169.7°0.1°
H171C17N11H11170.2°119.9°
H172C17N11H11149.7°120.1°
H201C20C19H1911.9°0.0°
H261C26C28H28358.3°60.1°
H261C26C28H28261.8°60.0°
H261C26C28H281178.2°180.0°
H261C26C27H27160.4°60.0°
H261C26C27H27359.6°60.0°
H261C26C27H272179.6°180.0°
H283C28H282H281120.0°120.0°
H021C02C03H0310.8°0.1°
H271C27H273H272120.0°120.0°

224931

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