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CIO

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O25C23sing1.34Å1.30Å
O25H25sing0.97Å0.95Å
C23O24doub1.21Å1.28Å
C23C4sing1.51Å1.52Å
C4C5sing1.53Å1.51Å
C4C3sing1.53Å1.51Å
C4H4sing1.09Å1.12Å
C5C6sing1.53Å1.53Å
C5H51sing1.09Å1.11Å
C5H52sing1.09Å1.12Å
C6C1sing1.53Å1.52Å
C6H61sing1.09Å1.11Å
C6H62sing1.09Å1.12Å
C3C2sing1.53Å1.56Å
C3H31sing1.09Å1.11Å
C3H32sing1.09Å1.12Å
C2C1sing1.53Å1.54Å
C2H21sing1.09Å1.11Å
C2H22sing1.09Å1.12Å
C1C21sing1.47Å1.45Å
C1C7sing1.51Å1.54Å
C21N22trip1.14Å1.16Å
C7C8doub1.38Å1.40ÅAromatic
C7C20sing1.38Å1.41ÅAromatic
C8C9sing1.38Å1.41ÅAromatic
C8H8sing1.08Å1.10Å
C9C10doub1.39Å1.42ÅAromatic
C9H9sing1.08Å1.10Å
C10O11sing1.36Å1.41Å
C10C13sing1.39Å1.39ÅAromatic
O11C12sing1.43Å1.45Å
C12H121sing1.09Å1.11Å
C12H122sing1.09Å1.11Å
C12H123sing1.09Å1.11Å
C13C20doub1.39Å1.42ÅAromatic
C13O14sing1.36Å1.37Å
C20H20sing1.08Å1.10Å
O14C15sing1.43Å1.47Å
C15C16sing1.54Å1.50Å
C15C19sing1.54Å1.50Å
C15H15sing1.09Å1.12Å
C16C17sing1.55Å1.49Å
C16H161sing1.09Å1.11Å
C16H162sing1.09Å1.12Å
C17C18sing1.55Å1.50Å
C17H171sing1.09Å1.11Å
C17H172sing1.09Å1.11Å
C18C19sing1.54Å1.51Å
C18H181sing1.09Å1.12Å
C18H182sing1.09Å1.11Å
C19H191sing1.09Å1.12Å
C19H192sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C23O25H25124.5°120.0°
O25C23O24124.5°120.0°
O25C23C4118.1°120.0°
O24C23C4117.3°120.0°
C23C4C5110.4°109.5°
C23C4C3114.9°109.5°
C23C4H4103.7°109.5°
C5C4C3105.1°109.5°
C5C4H4113.8°109.4°
C4C5C6112.7°109.5°
C4C5H51111.0°109.4°
C4C5H52111.0°109.4°
C3C4H4109.2°109.5°
C4C3C2105.6°109.5°
C4C3H31113.6°109.4°
C4C3H32113.7°109.5°
C6C5H51111.0°109.5°
C6C5H52111.0°109.5°
C5C6C1111.6°109.5°
C5C6H61111.5°109.4°
C5C6H62111.5°109.4°
H51C5H5299.3°109.5°
C1C6H61111.4°109.5°
C1C6H62111.4°109.6°
C6C1C2105.0°109.4°
C6C1C21105.8°109.5°
C6C1C7114.6°109.5°
H61C6H6298.9°109.4°
C2C3H31113.7°109.5°
C2C3H32113.7°109.5°
C3C2C1117.4°109.5°
C3C2H21109.4°109.5°
C3C2H22109.4°109.4°
H31C3H3296.8°109.4°
C1C2H21109.4°109.5°
C1C2H22109.3°109.4°
C2C1C21112.7°109.5°
C2C1C7116.6°109.5°
H21C2H22100.7°109.5°
C21C1C7101.9°109.5°
C1C21N22175.8°180.0°
C1C7C8124.1°119.9°
C1C7C20119.2°119.9°
C8C7C20116.6°120.2°
C7C8C9121.0°120.1°
C7C8H8119.3°120.0°
C7C20C13122.4°120.0°
C7C20H20118.7°120.0°
C9C8H8119.7°119.9°
C8C9C10122.2°120.0°
C8C9H9118.3°120.0°
C10C9H9119.5°120.0°
C9C10O11123.6°120.1°
C9C10C13117.0°119.8°
O11C10C13119.4°120.1°
C10O11C12122.0°106.8°
C10C13C20120.7°119.9°
C10C13O14117.5°120.1°
O11C12H121107.7°109.5°
O11C12H122122.0°109.4°
O11C12H123107.7°109.5°
H121C12H122107.8°109.4°
H121C12H123102.1°109.5°
H122C12H123107.8°109.5°
C20C13O14121.8°120.1°
C13C20H20118.9°120.0°
C13O14C15116.4°106.8°
O14C15C16108.3°110.0°
O14C15C19113.8°110.1°
O14C15H15105.1°110.0°
C16C15C19101.1°106.6°
C16C15H15117.1°110.0°
C15C16C17101.1°104.2°
C15C16H161115.4°110.5°
C15C16H162115.4°110.5°
C19C15H15111.8°110.0°
C15C19C18100.3°106.6°
C15C19H191115.7°110.0°
C15C19H192115.7°110.0°
C17C16H161115.4°110.5°
C17C16H162115.4°110.5°
C16C17C18105.2°102.8°
C16C17H171113.8°110.8°
C16C17H172113.8°110.8°
H161C16H16295.0°110.6°
C18C17H171113.8°110.8°
C18C17H172113.8°110.7°
C17C18C19106.2°104.2°
C17C18H181113.4°110.5°
C17C18H182113.4°110.6°
H171C17H17296.7°110.8°
C19C18H181113.4°110.5°
C19C18H182113.4°110.5°
C18C19H191115.7°110.0°
C18C19H192115.7°110.0°
H181C18H18297.0°110.5°
H191C19H19294.7°110.1°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O25C23O24C4177.3°180.0°
O25C23C4C5121.9°180.0°
O25C23C4C3119.5°60.0°
O25C23C4H40.5°60.1°
H25O25C23O24180.0°0.0°
H25O25C23C42.7°180.0°
O24C23C4C555.6°0.0°
O24C23C4C363.0°120.0°
O24C23C4H4177.9°120.0°
C23C4C5C3124.4°120.1°
C23C4C5H4116.2°120.0°
C23C4C3H4116.0°120.0°
C23C4C5C6169.2°180.0°
C23C4C5H5165.5°60.0°
C23C4C5H5244.0°59.9°
C23C4C3C2176.8°180.0°
C23C4C3H3151.6°60.0°
C23C4C3H3257.9°60.0°
C5C4C3H4122.5°119.9°
C4C5C6H51125.3°119.9°
C4C5C6H52125.3°120.0°
C4C5H51H52116.9°119.9°
C4C5C6C162.2°60.0°
C4C5C6H61172.5°180.0°
C4C5C6H6263.1°60.1°
C5C4C3C261.7°60.0°
C5C4C3H31173.1°180.0°
C5C4C3H3263.6°60.1°
C3C4C5C666.3°60.0°
C3C4C5H5159.0°60.0°
C3C4C5H52168.4°180.0°
C4C3C2H31125.2°120.0°
C4C3C2H32125.3°120.1°
C4C3H31H32119.6°120.0°
C4C3C2C162.1°60.1°
C4C3C2H2163.2°60.0°
C4C3C2H22172.6°180.0°
H4C4C5C653.1°60.0°
H4C4C5H51178.3°180.0°
H4C4C5H5272.2°60.0°
H4C4C3C260.8°59.9°
H4C4C3H3164.5°60.0°
H4C4C3H32174.0°180.0°
C6C5H51H52116.9°120.1°
C5C6C1H61125.3°119.9°
C5C6C1H62125.3°120.0°
C5C6H61H62117.3°119.9°
C5C6C1C250.7°60.1°
C5C6C1C2168.8°60.0°
C5C6C1C7179.9°180.0°
H51C5C6C163.1°59.9°
H51C5C6H6162.2°60.0°
H51C5C6H62171.6°180.0°
H52C5C6C1172.5°180.0°
H52C5C6H6147.3°60.0°
H52C5C6H6262.2°59.9°
C1C6H61H62117.3°120.1°
C6C1C2C354.4°60.1°
C6C1C2C21114.7°120.0°
C6C1C2C7128.0°120.0°
C6C1C2H2170.8°60.0°
C6C1C2H22179.7°180.0°
C6C1C21C7120.0°120.0°
C6C1C21N2261.7°159.1°
C6C1C7C8125.7°0.0°
C6C1C7C2056.1°180.0°
H61C6C1C2175.9°180.0°
H61C6C1C2156.5°60.0°
H61C6C1C754.8°60.0°
H62C6C1C274.6°60.0°
H62C6C1C21165.9°180.0°
H62C6C1C754.6°60.0°
C2C3H31H32119.6°120.0°
C3C2C1H21125.3°120.1°
C3C2C1H22125.3°119.9°
C3C2H21H22115.1°120.0°
C3C2C1C2160.2°60.0°
C3C2C1C7177.6°180.0°
H31C3C2C1172.6°180.0°
H31C3C2H2162.1°60.0°
H31C3C2H2247.4°60.0°
H32C3C2C163.1°60.0°
H32C3C2H21171.6°179.9°
H32C3C2H2262.1°59.9°
C1C2H21H22115.1°120.0°
C2C1C21C7125.7°120.0°
C2C1C21N22175.9°39.1°
C2C1C7C82.5°119.9°
C2C1C7C20179.3°60.1°
H21C2C1C21174.5°180.0°
H21C2C1C757.1°60.0°
H22C2C1C2165.0°60.0°
H22C2C1C752.3°60.1°
C21C1C7C8120.6°120.0°
C21C1C7C2057.6°60.0°
C7C1C21N2258.4°80.9°
C1C7C8C20178.2°180.0°
C1C7C8C9178.8°180.0°
C1C7C8H81.2°0.1°
C1C7C20C13179.5°179.8°
C1C7C20H200.5°0.0°
C7C8C9H8180.0°179.9°
C7C8C9C100.0°0.0°
C7C8C9H9179.9°179.9°
C8C7C20C131.1°0.2°
C8C7C20H20178.9°180.0°
C20C7C8C90.5°0.0°
C20C7C8H8179.5°179.9°
C7C20C13C101.2°0.6°
C7C20C13H20180.0°179.7°
C7C20C13O14179.7°180.0°
C8C9C10H9180.0°179.9°
C8C9C10O11179.8°180.0°
C8C9C10C130.1°0.3°
H8C8C9C10180.0°179.9°
H8C8C9H90.1°0.0°
C9C10O11C13179.8°179.7°
C9C10O11C123.9°0.0°
C9C10C13C200.6°0.6°
C9C10C13O14179.2°180.0°
H9C9C10O110.2°0.1°
H9C9C10C13179.9°179.7°
C10O11C12H12154.7°179.9°
C10O11C12H122180.0°60.0°
C10O11C12H12354.7°60.0°
O11C10C13C20179.2°179.7°
O11C10C13O140.7°0.3°
C13C10O11C12176.0°179.7°
C10C13C20O14178.5°179.4°
C10C13C20H20178.8°179.7°
C10C13O14C15169.8°174.0°
O11C12H121H122133.3°120.0°
O11C12H121H123113.3°120.1°
O11C12H122H123125.2°120.0°
H121C12H122H123109.5°120.0°
C20C13O14C1511.6°6.6°
O14C13C20H200.3°0.3°
C13O14C15C16134.6°84.6°
C13O14C15C19113.9°158.2°
C13O14C15H158.8°36.8°
O14C15C16C19119.8°119.4°
O14C15C16H15118.4°121.4°
O14C15C19H15118.9°121.4°
O14C15C16C1770.4°142.9°
O14C15C16H16154.8°24.3°
O14C15C16H162164.3°98.4°
O14C15C19C1868.5°119.2°
O14C15C19H191166.2°121.5°
O14C15C19H19256.8°0.0°
C16C15C19H15125.3°119.3°
C15C16C17H161125.3°118.6°
C15C16C17H162125.2°118.7°
C15C16H161H162121.2°122.6°
C15C16C17C1831.6°37.9°
C15C16C17H17193.7°80.4°
C15C16C17H172156.8°156.3°
C16C15C19C1847.3°0.1°
C16C15C19H19177.9°119.2°
C16C15C19H192172.6°119.3°
C19C15C16C1749.4°23.6°
C19C15C16H161174.7°95.1°
C19C15C16H16275.9°142.2°
C15C19C18C1727.6°23.7°
C15C19C18H191125.3°119.3°
C15C19C18H192125.3°119.2°
C15C19C18H18197.7°142.3°
C15C19C18H182152.8°95.1°
C15C19H191H192121.5°121.4°
H15C15C16C17171.1°95.7°
H15C15C16H16163.6°145.7°
H15C15C16H16245.9°23.0°
H15C15C19C18172.6°119.3°
H15C15C19H19147.4°0.0°
H15C15C19H19262.1°121.4°
C17C16H161H162121.3°122.6°
C16C17C18H171125.3°118.3°
C16C17C18H172125.3°118.3°
C16C17H171H172119.7°123.3°
C16C17C18C192.3°38.0°
C16C17C18H181127.6°156.6°
C16C17C18H182122.9°80.8°
H161C16C17C18156.9°80.7°
H161C16C17H17131.6°160.9°
H161C16C17H17277.9°37.6°
H162C16C17C1893.7°156.6°
H162C16C17H171141.1°38.3°
H162C16C17H17231.6°85.0°
C18C17H171H172119.7°123.3°
C17C18C19H181125.2°118.6°
C17C18C19H182125.3°118.8°
C17C18H181H182119.4°122.7°
C17C18C19H19197.7°95.6°
C17C18C19H192152.8°142.9°
H171C17C18C19122.9°80.3°
H171C17C18H1812.3°38.3°
H171C17C18H182111.8°160.9°
H172C17C18C19127.6°156.3°
H172C17C18H181107.2°85.0°
H172C17C18H1822.3°37.6°
C19C18H181H182119.4°122.6°
C18C19H191H192121.5°121.4°
H181C18C19H191137.1°23.0°
H181C18C19H19227.6°98.5°
H182C18C19H19127.6°145.6°
H182C18C19H19281.9°24.1°

223790

PDB entries from 2024-08-14

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