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9ZX

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C21O3sing1.43Å1.43Å
C21C20sing1.53Å1.52Å
C9C10doub1.38Å1.39ÅAromatic
C9C8sing1.38Å1.40ÅAromatic
C10C11sing1.38Å1.40ÅAromatic
O3C22sing1.43Å1.43Å
C20Nsing1.47Å1.48Å
C8C7doub1.38Å1.40ÅAromatic
C17C16sing1.51Å1.52Å
C11C12doub1.38Å1.40ÅAromatic
C22C23sing1.53Å1.52Å
C14C13doub1.36Å1.38ÅAromatic
C14C15sing1.40Å1.40ÅAromatic
C13C3sing1.39Å1.40ÅAromatic
NC23sing1.47Å1.49Å
NC19sing1.47Å1.46Å
C16C15sing1.46Å1.39Å
C16C18doub1.36Å1.50Å
C7C12sing1.38Å1.40ÅAromatic
C7C5sing1.51Å1.49Å
C15C1doub1.41Å1.41ÅAromatic
C3O2sing1.36Å1.35Å
C3C2doub1.38Å1.38ÅAromatic
O2C4sing1.43Å1.42Å
C19C18sing1.51Å1.51Å
C18Csing1.41Å1.41Å
C1C2sing1.39Å1.39ÅAromatic
C1O1sing1.35Å1.38Å
C5C4sing1.53Å1.53Å
C5C6sing1.53Å1.51Å
CO1sing1.34Å1.38Å
COdoub1.22Å1.28Å
C2H1sing1.08Å1.08Å
C4H2sing1.09Å1.10Å
C4H3sing1.09Å1.10Å
C5H4sing1.09Å1.10Å
C8H5sing1.08Å1.08Å
C9H6sing1.08Å1.08Å
C10H7sing1.08Å1.08Å
C11H8sing1.08Å1.08Å
C12H9sing1.08Å1.08Å
C6H10sing1.09Å1.10Å
C6H11sing1.09Å1.10Å
C6H12sing1.09Å1.10Å
C13H13sing1.08Å1.08Å
C14H14sing1.08Å1.08Å
C17H15sing1.09Å1.10Å
C17H16sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C19H18sing1.09Å1.10Å
C19H19sing1.09Å1.10Å
C20H21sing1.09Å1.10Å
C20H22sing1.09Å1.10Å
C21H23sing1.09Å1.10Å
C21H24sing1.09Å1.10Å
C22H25sing1.09Å1.10Å
C22H26sing1.09Å1.10Å
C23H27sing1.09Å1.10Å
C23H28sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O3C21C20110.4°109.3°
C21O3C22112.6°113.8°
O3C21H23109.2°109.5°
O3C21H24109.2°109.5°
C21C20N110.9°109.2°
C21C20H21109.1°109.5°
C21C20H22109.1°109.5°
C20C21H23109.3°109.5°
C20C21H24109.3°109.5°
C10C9C8120.9°120.0°
C9C10C11118.9°120.1°
C10C9H6119.5°120.0°
C9C10H7120.5°120.0°
C9C8C7120.0°120.0°
C9C8H5120.0°120.0°
C8C9H6119.5°120.0°
C10C11C12120.4°119.9°
C11C10H7120.5°119.9°
C10C11H8119.8°120.1°
O3C22C23106.7°109.3°
O3C22H25110.2°109.6°
O3C22H26110.2°109.5°
C20NC23114.1°110.8°
C20NC19108.9°111.0°
NC20H21109.1°109.5°
NC20H22109.1°109.5°
C8C7C12119.2°120.0°
C8C7C5118.2°120.0°
C7C8H5120.0°120.0°
C17C16C15117.7°120.9°
C17C16C18124.2°120.9°
C16C17H15109.5°109.4°
C16C17H16109.5°109.4°
C16C17H17109.5°109.4°
C11C12C7120.5°120.0°
C12C11H8119.8°120.0°
C11C12H9119.7°120.0°
C22C23N111.5°109.2°
C23C22H25110.2°109.5°
C23C22H26110.2°109.5°
C22C23H27108.9°109.5°
C22C23H28109.0°109.5°
C13C14C15120.1°119.8°
C14C13C3119.6°120.4°
C14C13H13120.2°119.8°
C13C14H14119.9°120.1°
C14C15C16120.5°121.0°
C14C15C1119.6°120.0°
C15C14H14120.0°120.1°
C13C3O2117.1°119.7°
C13C3C2120.9°120.6°
C3C13H13120.2°119.8°
C23NC19106.7°111.0°
NC23H27109.0°109.5°
NC23H28108.9°109.5°
NC19C18113.8°109.5°
NC19H18108.3°109.5°
NC19H19108.4°109.5°
C15C16C18118.0°118.2°
C16C15C1119.9°118.9°
C16C18C19120.8°120.1°
C16C18C119.4°119.8°
C12C7C5122.5°120.0°
C7C12H9119.8°120.0°
C7C5C4108.0°109.5°
C7C5C6115.4°109.4°
C7C5H4106.3°109.5°
C15C1C2120.1°119.4°
C15C1O1121.7°119.8°
O2C3C2121.9°119.7°
C3O2C4126.8°117.0°
C3C2C1119.6°119.8°
C3C2H1120.2°120.1°
O2C4C598.9°109.5°
O2C4H2112.0°109.5°
O2C4H3112.0°109.5°
C19C18C119.7°120.1°
C18C19H18108.4°109.5°
C18C19H19108.4°109.5°
C18CO1119.3°121.7°
C18CO123.2°119.2°
C2C1O1118.1°120.8°
C1C2H1120.2°120.1°
C1O1C121.6°121.5°
C4C5C6114.5°109.5°
C5C4H2112.1°109.5°
C5C4H3112.0°109.5°
C4C5H4105.9°109.5°
C6C5H4106.0°109.5°
C5C6H10109.5°109.5°
C5C6H11109.5°109.4°
C5C6H12109.5°109.5°
O1CO117.5°119.1°
H2C4H3109.5°109.5°
H10C6H11109.4°109.4°
H10C6H12109.5°109.5°
H11C6H12109.5°109.4°
H15C17H16109.5°109.5°
H15C17H17109.5°109.5°
H16C17H17109.5°109.6°
H18C19H19109.5°109.4°
H21C20H22109.5°109.5°
H23C21H24109.5°109.5°
H25C22H26109.5°109.5°
H27C23H28109.5°109.6°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O3C21C20H23120.1°120.0°
O3C21C20H24120.1°119.9°
O3C21C20N50.5°56.8°
C21O3C22C2365.2°58.6°
O3C21C20H21170.7°63.1°
O3C21C20H2269.7°176.8°
O3C21H23H24119.6°120.1°
C21O3C22H25175.3°178.6°
C21O3C22H2654.4°61.3°
C20C21O3C2263.1°58.6°
C21C20NH21120.2°119.9°
C21C20NH22120.2°119.9°
C21C20NC2345.7°58.7°
C21C20NC19164.8°177.6°
C21C20H21H22119.4°120.1°
C20C21H23H24119.6°120.1°
C10C9C8H6180.0°180.0°
C9C10C11H7180.0°180.0°
C10C9C8C71.7°0.0°
C9C10C11C120.7°0.1°
C10C9C8H5178.3°180.0°
C9C10C11H8179.3°180.0°
C8C9C10C111.1°0.0°
C9C8C7H5180.0°180.0°
C9C8C7C121.9°0.0°
C9C8C7C5178.7°179.7°
C8C9C10H7178.9°180.0°
C10C11C12H8180.0°180.0°
C10C11C12C70.9°0.1°
C11C10C9H6178.9°180.0°
C10C11C12H9179.1°179.8°
O3C22C23H25119.6°120.0°
O3C22C23H26119.6°119.9°
O3C22C23N56.9°56.8°
C22O3C21H2357.0°178.6°
C22O3C21H24176.7°61.3°
O3C22H25H26121.3°120.1°
O3C22C23H2763.4°176.8°
O3C22C23H28177.3°63.1°
C20NC23C2250.0°58.6°
C20NC23C19120.3°123.7°
C20NC19C18110.1°66.4°
C20NC19H1810.6°173.6°
C20NC19H19129.3°53.6°
NC20H21H22119.3°120.1°
NC20C21H2369.6°176.8°
NC20C21H24170.6°63.1°
C20NC23H2770.3°178.5°
C20NC23H28170.3°61.3°
C8C7C12C111.5°0.0°
C8C7C12C5176.6°179.7°
C8C7C5C4131.7°59.7°
C8C7C5C698.7°60.3°
C8C7C5H418.5°179.7°
C7C8C9H6178.3°179.9°
C8C7C12H9178.5°179.7°
C17C16C15C141.1°0.0°
C17C16C15C18178.7°179.6°
C17C16C15C1179.6°180.0°
C17C16C18C192.8°0.4°
C17C16C18C179.6°179.8°
C16C17H15H16120.0°119.9°
C16C17H15H17120.0°119.9°
C16C17H16H17120.0°120.0°
C11C12C7H9180.0°179.7°
C11C12C7C5178.1°179.7°
C12C11C10H7179.3°180.0°
C22C23NH27120.3°119.9°
C22C23NH28120.3°119.9°
C22C23NC19170.3°177.6°
C23C22H25H26121.3°120.1°
C22C23H27H28119.1°120.1°
C13C14C15H14180.0°180.0°
C14C13C3H13180.0°180.0°
C13C14C15C16177.2°180.0°
C13C14C15C11.3°0.0°
C14C13C3O2176.9°180.0°
C14C13C3C20.8°0.0°
C15C14C13C31.0°0.0°
C14C15C16C1178.4°180.0°
C14C15C16C18179.8°179.6°
C14C15C1C21.2°0.0°
C14C15C1O1178.9°179.9°
C15C14C13H13179.0°180.0°
C13C3O2C2177.7°180.0°
C13C3O2C4167.0°0.0°
C13C3C2C10.7°0.0°
C13C3C2H1179.3°179.9°
C3C13C14H14179.0°180.0°
C23NC19C18126.4°170.0°
C23NC19H18113.0°50.0°
C23NC19H195.7°70.0°
C23NC20H21166.0°61.3°
C23NC20H2274.5°178.6°
NC23C22H25176.5°176.8°
NC23C22H2662.6°63.1°
NC23H27H28119.0°120.2°
NC19C18C1695.3°95.0°
NC19C18H18120.6°120.0°
NC19C18H19120.7°120.0°
NC19C18C87.9°85.6°
NC19H18H19118.0°120.0°
C19NC20H2175.0°62.4°
C19NC20H2244.6°57.7°
C19NC23H2750.0°57.7°
C19NC23H2869.4°62.5°
C15C16C18C19178.6°180.0°
C15C16C18C1.8°0.7°
C16C15C1C2177.3°180.0°
C16C15C1O10.5°0.1°
C16C15C14H142.8°0.0°
C15C16C17H15180.0°0.0°
C15C16C17H1660.0°119.9°
C15C16C17H1760.0°120.0°
C18C16C15C11.7°0.4°
C16C18C19C176.7°179.3°
C16C18CO10.6°0.7°
C16C18CO179.7°179.7°
C18C16C17H151.4°179.6°
C18C16C17H16121.4°59.6°
C18C16C17H17118.6°60.5°
C16C18C19H1825.3°144.9°
C16C18C19H19144.0°25.0°
C12C7C5C444.9°120.0°
C12C7C5C684.7°120.0°
C12C7C5H4158.2°0.0°
C12C7C8H5178.1°180.0°
C7C12C11H8179.1°180.0°
C7C5C4O290.2°175.0°
C7C5C4C6130.1°120.0°
C7C5C4H4113.5°120.0°
C7C5C6H4117.3°120.0°
C7C5C4H2151.6°65.0°
C7C5C4H328.1°55.0°
C5C7C8H51.3°0.3°
C5C7C12H91.9°0.0°
C7C5C6H10180.0°60.0°
C7C5C6H1160.0°180.0°
C7C5C6H1260.0°60.1°
C15C1C2C30.9°0.1°
C15C1C2O1177.8°179.9°
C15C1O1C0.8°0.0°
C15C1C2H1179.1°179.9°
C1C15C14H14178.8°180.0°
O2C3C2C1176.9°180.0°
C3O2C4C5177.4°180.0°
O2C3C2H13.1°0.1°
C3O2C4H259.2°60.0°
C3O2C4H364.3°60.0°
O2C3C13H133.1°0.0°
C2C3O2C415.4°180.0°
C3C2C1H1180.0°179.9°
C3C2C1O1178.7°180.0°
C2C3C13H13179.2°180.0°
O2C4C5H2118.3°120.0°
O2C4C5H3118.2°120.0°
O2C4C5C6139.8°65.0°
O2C4H2H3124.9°120.0°
O2C4C5H423.4°55.0°
C19C18CO1177.4°180.0°
C19C18CO2.9°0.3°
C18C19H18H19118.1°120.0°
C18CO1C10.7°0.3°
C18CO1O179.7°179.7°
CC18C19H18151.4°34.4°
CC18C19H1932.7°154.3°
C2C1O1C178.6°179.9°
C1O1CO179.0°180.0°
O1C1C2H11.3°0.2°
C4C5C6H4116.3°120.0°
C5C4H2H3124.9°120.0°
C4C5C6H1053.6°180.0°
C4C5C6H1166.4°60.0°
C4C5C6H12173.6°59.9°
C6C5C4H221.5°55.0°
C6C5C4H3102.0°175.0°
C5C6H10H11120.0°120.0°
C5C6H10H12120.0°120.1°
C5C6H11H12120.0°120.0°
H2C4C5H494.9°175.0°
H3C4C5H4141.6°65.0°
H4C5C6H1062.7°60.0°
H4C5C6H11177.3°60.0°
H4C5C6H1257.3°179.9°
H5C8C9H61.7°0.0°
H6C9C10H71.1°0.0°
H7C10C11H80.7°0.0°
H8C11C12H90.9°0.3°
H10C6H11H12120.0°120.0°
H13C13C14H141.0°0.0°
H15C17H16H17120.0°120.1°
H21C20C21H2350.6°56.9°
H21C20C21H2469.1°177.0°
H22C20C21H23170.2°63.3°
H22C20C21H2450.4°56.8°
H25C22C23H2756.2°63.2°
H25C22C23H2863.2°56.9°
H26C22C23H27177.0°56.9°
H26C22C23H2857.7°177.0°

225946

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