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GLE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O1sing1.43Å1.44Å
C1C2sing1.53Å1.53Å
C1H11sing1.09Å1.11Å
C1H12sing1.09Å1.12Å
O1C11sing1.43Å1.45Å
C2O2sing1.43Å1.48Å
C2C3sing1.53Å1.58Å
C2H2sing1.09Å1.12Å
O2P2sing1.61Å1.62Å
C3O3sing1.43Å1.46Å
C3H31sing1.09Å1.11Å
C3H32sing1.09Å1.11Å
O3C31sing1.43Å1.41Å
C31C32sing1.53Å1.58Å
C31H311sing1.09Å1.11Å
C31H312sing1.09Å1.12Å
C32F31sing1.40Å1.53Å
C32F32sing1.40Å1.50Å
C32F33sing1.40Å1.53Å
P2O21doub1.48Å1.66Å
P2O22sing1.61Å1.49Å
P2O23sing1.61Å1.61Å
O22HO2sing0.97Å0.95Å
C2PO23sing1.43Å1.42Å
C2PH2P1sing1.09Å1.12Å
C2PH2P2sing1.09Å1.11Å
C2PH2P3sing1.09Å1.11Å
C11C12sing1.53Å1.52Å
C11H111sing1.09Å1.11Å
C11H112sing1.09Å1.11Å
C12C13sing1.53Å1.56Å
C12H121sing1.09Å1.12Å
C12H122sing1.09Å1.12Å
C13C14sing1.53Å1.55Å
C13H131sing1.09Å1.11Å
C13H132sing1.09Å1.11Å
C14C15sing1.53Å1.61Å
C14H141sing1.09Å1.11Å
C14H142sing1.09Å1.12Å
C15C16sing1.53Å1.60Å
C15H151sing1.09Å1.11Å
C15H152sing1.09Å1.11Å
C16C17sing1.53Å1.54Å
C16H161sing1.09Å1.12Å
C16H162sing1.09Å1.11Å
C17C18sing1.53Å1.54Å
C17H171sing1.09Å1.11Å
C17H172sing1.09Å1.12Å
C18C19sing1.53Å1.55Å
C18H181sing1.09Å1.12Å
C18H182sing1.09Å1.11Å
C19C20sing1.53Å1.56Å
C19H191sing1.09Å1.11Å
C19H192sing1.09Å1.11Å
C20H201sing1.09Å1.11Å
C20H202sing1.09Å1.12Å
C20H203sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C1C2107.2°109.5°
O1C1H11113.0°109.5°
O1C1H12113.1°109.4°
C1O1C11113.5°106.8°
C2C1H11113.0°109.5°
C2C1H12113.0°109.4°
C1C2O2117.9°109.5°
C1C2C3113.1°109.5°
C1C2H2130.8°109.4°
H11C1H1297.5°109.5°
O1C11C12106.7°109.5°
O1C11H111113.2°109.5°
O1C11H112113.3°109.5°
O2C2C3128.0°109.5°
O2C2H266.5°109.4°
C2O2P2116.8°106.8°
C3C2H287.6°109.4°
C2C3O3122.9°109.5°
C2C3H31107.5°109.5°
C2C3H32107.5°109.4°
O2P2O21106.4°109.5°
O2P2O22107.1°109.5°
O2P2O23115.8°109.5°
O3C3H31107.4°109.5°
O3C3H32107.4°109.4°
C3O3C31104.7°106.8°
H31C3H32102.4°109.5°
O3C31C32113.1°109.5°
O3C31H311110.9°109.5°
O3C31H312110.9°109.4°
C32C31H311110.8°109.5°
C32C31H312110.8°109.5°
C31C32F31112.8°109.5°
C31C32F32110.5°109.5°
C31C32F33111.8°109.4°
H311C31H31299.5°109.4°
F31C32F32106.5°109.5°
F31C32F33108.0°109.5°
F32C32F33106.9°109.4°
O21P2O22106.7°109.4°
O21P2O23110.4°109.5°
O22P2O23110.0°109.4°
P2O22HO2107.1°106.8°
P2O23C2P108.6°106.9°
O23C2PH2P1108.6°109.5°
O23C2PH2P2112.5°109.5°
O23C2PH2P3112.6°109.4°
H2P1C2PH2P2112.5°109.4°
H2P1C2PH2P3112.4°109.5°
H2P2C2PH2P397.9°109.5°
C12C11H111113.2°109.5°
C12C11H112113.2°109.5°
C11C12C13111.4°109.5°
C11C12H121111.5°109.5°
C11C12H122111.5°109.4°
H111C11H11297.3°109.4°
C13C12H121111.5°109.5°
C13C12H122111.5°109.4°
C12C13C14111.5°109.5°
C12C13H131111.5°109.5°
C12C13H132111.4°109.5°
H121C12H12298.8°109.6°
C14C13H131111.4°109.6°
C14C13H132111.5°109.5°
C13C14C15112.3°109.5°
C13C14H141111.2°109.5°
C13C14H142111.2°109.4°
H131C13H13298.9°109.4°
C15C14H141111.1°109.5°
C15C14H142111.1°109.4°
C14C15C16112.1°109.5°
C14C15H151111.2°109.6°
C14C15H152111.2°109.4°
H141C14H14299.2°109.5°
C16C15H151111.2°109.5°
C16C15H152111.2°109.4°
C15C16C17111.0°109.5°
C15C16H161111.7°109.5°
C15C16H162111.7°109.4°
H151C15H15299.2°109.4°
C17C16H161111.6°109.5°
C17C16H162111.7°109.5°
C16C17C18110.2°109.5°
C16C17H171111.9°109.5°
C16C17H172111.9°109.4°
H161C16H16298.7°109.4°
C18C17H171111.9°109.5°
C18C17H172111.9°109.4°
C17C18C19111.9°109.5°
C17C18H181111.3°109.5°
C17C18H182111.3°109.4°
H171C17H17298.5°109.4°
C19C18H181111.3°109.5°
C19C18H182111.4°109.5°
C18C19C20112.0°109.5°
C18C19H191111.3°109.5°
C18C19H192111.2°109.5°
H181C18H18299.1°109.5°
C20C19H191111.3°109.5°
C20C19H192111.3°109.4°
C19C20H201112.0°109.6°
C19C20H202111.3°109.4°
C19C20H203111.3°109.5°
H191C19H19299.1°109.4°
H201C20H202111.3°109.4°
H201C20H203111.3°109.5°
H202C20H20399.0°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C1C2H11125.3°120.1°
O1C1C2H12125.2°119.9°
O1C1H11H12119.0°120.0°
O1C1C2O2131.8°59.9°
O1C1C2C338.3°180.0°
O1C1C2H2146.2°60.0°
C1O1C11C12129.1°180.0°
C1O1C11H1113.9°59.9°
C1O1C11H112105.7°60.0°
C2C1H11H12118.9°119.9°
C2C1O1C11176.7°180.0°
C1C2O2C3168.3°120.1°
C1C2O2H2125.2°119.9°
C1C2C3H2133.9°119.9°
C1C2O2P2114.6°120.0°
C1C2C3O3128.7°180.0°
C1C2C3H313.5°59.9°
C1C2C3H32106.1°60.1°
H11C1O1C1151.5°60.0°
H11C1C2O26.5°180.0°
H11C1C2C3163.5°59.9°
H11C1C2H288.6°60.1°
H12C1O1C1158.1°60.1°
H12C1C2O2103.0°60.0°
H12C1C2C387.0°60.1°
H12C1C2H220.9°180.0°
O1C11C12H111125.2°120.1°
O1C11C12H112125.3°120.0°
O1C11H111H112119.2°120.0°
O1C11C12C13172.1°180.0°
O1C11C12H12146.8°60.0°
O1C11C12H12262.7°60.1°
O2C2C3H257.3°120.0°
O2C2C3O362.5°59.9°
O2C2C3H31172.3°180.0°
O2C2C3H3262.7°60.0°
C2O2P2O21166.1°60.0°
C2O2P2O2280.1°60.0°
C2O2P2O2343.1°180.0°
C3C2O2P277.0°119.9°
C2C3O3H31125.3°120.1°
C2C3O3H32125.2°119.9°
C2C3H31H32113.0°120.0°
C2C3O3C31133.0°180.0°
H2C2O2P210.6°0.0°
H2C2C3O35.2°60.1°
H2C2C3H31130.4°60.0°
H2C2C3H32120.0°180.0°
O2P2O21O22114.1°120.0°
O2P2O21O23126.4°120.1°
O2P2O22O23126.6°120.1°
O2P2O22HO2180.0°60.0°
O2P2O23C2P146.6°180.0°
O3C3H31H32112.9°119.9°
C3O3C31C3295.4°180.0°
C3O3C31H31129.8°59.9°
C3O3C31H312139.3°60.0°
H31C3O3C31101.8°59.9°
H32C3O3C317.7°60.1°
O3C31C32H311125.3°120.1°
O3C31C32H312125.3°119.9°
O3C31H311H312116.8°119.9°
O3C31C32F312.1°180.0°
O3C31C32F32117.1°59.9°
O3C31C32F33124.0°60.1°
C32C31H311H312116.7°120.0°
C31C32F31F32121.5°120.1°
C31C32F31F33124.0°120.0°
C31C32F32F33121.8°120.0°
H311C31C32F31123.1°59.9°
H311C31C32F32117.7°180.0°
H311C31C32F331.2°60.0°
H312C31C32F31127.4°60.0°
H312C31C32F328.2°60.0°
H312C31C32F33110.7°180.0°
F31C32F32F33115.3°120.0°
O21P2O22O23119.7°120.0°
O21P2O22HO266.4°180.0°
O21P2O23C2P25.6°60.0°
O22P2O23C2P91.8°60.0°
O23P2O22HO253.3°60.0°
P2O23C2PH2P1180.0°180.0°
P2O23C2PH2P254.7°60.0°
P2O23C2PH2P354.8°60.0°
O23C2PH2P1H2P2125.3°120.0°
O23C2PH2P1H2P3125.3°120.0°
O23C2PH2P2H2P3118.5°120.0°
H2P1C2PH2P2H2P3118.4°120.0°
C12C11H111H112119.2°120.0°
C11C12C13H121125.3°120.0°
C11C12C13H122125.3°119.9°
C11C12H121H122117.4°120.0°
C11C12C13C14120.5°180.0°
C11C12C13H1314.8°59.9°
C11C12C13H132114.3°60.0°
H111C11C12C1362.7°59.9°
H111C11C12H121172.0°179.9°
H111C11C12H12262.6°60.0°
H112C11C12C1346.8°60.0°
H112C11C12H12178.5°60.0°
H112C11C12H122172.1°179.9°
C13C12H121H122117.4°120.0°
C12C13C14H131125.3°120.1°
C12C13C14H132125.3°120.0°
C12C13H131H132117.3°119.9°
C12C13C14C15110.7°180.0°
C12C13C14H141124.1°60.0°
C12C13C14H14214.6°60.1°
H121C12C13C14114.3°60.0°
H121C12C13H131120.5°179.9°
H121C12C13H13211.0°60.0°
H122C12C13C144.8°60.1°
H122C12C13H131130.1°60.0°
H122C12C13H132120.4°179.9°
C14C13H131H132117.4°120.0°
C13C14C15H141125.3°120.1°
C13C14C15H142125.2°119.9°
C13C14H141H142117.1°120.0°
C13C14C15C16123.6°180.0°
C13C14C15H1511.6°59.9°
C13C14C15H152111.2°60.1°
H131C13C14C1514.6°59.9°
H131C13C14H141110.7°180.0°
H131C13C14H142139.8°59.9°
H132C13C14C15124.1°60.1°
H132C13C14H1411.2°60.0°
H132C13C14H142110.7°179.9°
C15C14H141H142117.0°119.9°
C14C15C16H151125.2°120.1°
C14C15C16H152125.2°119.9°
C14C15H151H152117.2°120.0°
C14C15C16C17104.4°180.0°
C14C15C16H16120.9°59.9°
C14C15C16H162130.3°60.0°
H141C14C15C16111.1°59.9°
H141C14C15H151123.7°180.0°
H141C14C15H15214.1°60.0°
H142C14C15C161.6°60.1°
H142C14C15H151126.9°60.0°
H142C14C15H152123.6°179.9°
C16C15H151H152117.1°119.9°
C15C16C17H161125.3°120.0°
C15C16C17H162125.3°120.0°
C15C16H161H162117.6°119.9°
C15C16C17C18100.5°180.0°
C15C16C17H17124.8°59.9°
C15C16C17H172134.2°60.0°
H151C15C16C17130.4°59.9°
H151C15C16H161104.4°180.0°
H151C15C16H1625.1°60.1°
H152C15C16C1720.8°60.0°
H152C15C16H161146.1°60.0°
H152C15C16H162104.5°180.0°
C17C16H161H162117.5°120.0°
C16C17C18H171125.3°120.1°
C16C17C18H172125.3°120.0°
C16C17H171H172117.8°119.9°
C16C17C18C19111.6°180.0°
C16C17C18H181123.1°59.9°
C16C17C18H18213.7°60.0°
H161C16C17C18134.2°60.0°
H161C16C17H171100.5°179.9°
H161C16C17H1729.0°60.0°
H162C16C17C1824.8°60.0°
H162C16C17H171150.1°60.1°
H162C16C17H172100.5°180.0°
C18C17H171H172117.8°120.0°
C17C18C19H181125.2°120.0°
C17C18C19H182125.3°120.0°
C17C18H181H182117.2°119.9°
C17C18C19C20117.1°180.0°
C17C18C19H191117.6°59.9°
C17C18C19H1928.1°60.0°
H171C17C18C1913.7°59.9°
H171C17C18H181111.6°180.0°
H171C17C18H182139.0°60.0°
H172C17C18C19123.1°60.0°
H172C17C18H1812.1°60.0°
H172C17C18H182111.6°180.0°
C19C18H181H182117.3°120.0°
C18C19C20H191125.3°120.1°
C18C19C20H192125.2°120.0°
C18C19H191H192117.1°120.0°
C18C19C20H201180.0°179.9°
C18C19C20H20254.7°60.0°
C18C19C20H20354.7°60.0°
H181C18C19C208.1°60.0°
H181C18C19H191117.2°180.0°
H181C18C19H192133.3°60.0°
H182C18C19C20117.6°60.0°
H182C18C19H1917.7°60.0°
H182C18C19H192117.2°180.0°
C20C19H191H192117.2°119.9°
C19C20H201H202125.3°120.0°
C19C20H201H203125.3°120.1°
C19C20H202H203117.1°120.0°
H191C19C20H20154.7°59.9°
H191C19C20H202179.9°60.1°
H191C19C20H20370.6°179.9°
H192C19C20H20154.8°60.0°
H192C19C20H20270.6°180.0°
H192C19C20H203179.9°60.1°
H201C20H202H203117.1°119.9°

222415

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