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Obsolete: NGR

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O2C2sing1.43Å1.43Å
C2C1sing1.53Å1.52Å
C2C3sing1.53Å1.51Å
O3C3sing1.43Å1.43Å
C1O5sing1.43Å1.44Å
C1OAsing1.43Å1.44Å
O14C14sing1.43Å1.44Å
C3C4sing1.53Å1.51Å
O5C5sing1.43Å1.44Å
O16C16sing1.43Å1.43Å
OAC13sing1.43Å1.44Å
C14C13sing1.53Å1.52Å
C14C15sing1.53Å1.52Å
C4C5sing1.53Å1.53Å
C4O4sing1.43Å1.43Å
C16C15sing1.53Å1.53Å
O6C6sing1.43Å1.43Å
C5C6sing1.53Å1.53Å
C13C12sing1.53Å1.52Å
C15O15sing1.43Å1.44Å
C12O12sing1.43Å1.44Å
C12C11sing1.53Å1.52Å
O15C11sing1.43Å1.44Å
C11O11sing1.43Å1.43Å
O2HO2sing0.97Å0.95Å
C1H1sing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C3H3sing1.09Å1.10Å
O3HO3sing0.97Å0.95Å
C4H4sing1.09Å1.10Å
O4HO4sing0.97Å0.95Å
C5H5sing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C6H6Asing1.09Å1.10Å
O6HO6sing0.97Å0.95Å
C11H11sing1.09Å1.10Å
O11HO11sing0.97Å0.95Å
C12H12sing1.09Å1.10Å
O12HO12sing0.97Å0.95Å
C13H13sing1.09Å1.10Å
C14H14sing1.09Å1.10Å
O14HO14sing0.97Å0.95Å
C15H15sing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C16H16Asing1.09Å1.10Å
O16HO16sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O2C2C1110.3°109.5°
O2C2C3109.2°109.5°
C2O2HO2109.5°114.0°
O2C2H2110.6°109.5°
C1C2C3108.1°109.2°
C2C1O5109.2°109.4°
C2C1OA107.9°109.5°
C2C1H1108.5°109.5°
C1C2H2109.3°109.5°
C2C3O3110.0°109.5°
C2C3C4107.9°109.0°
C3C2H2109.4°109.5°
C2C3H3109.1°109.5°
O3C3C4110.6°109.6°
O3C3H3110.2°109.6°
C3O3HO3109.5°114.0°
O5C1OA112.2°109.5°
C1O5C5111.9°114.1°
O5C1H1109.5°109.5°
C1OAC13116.8°114.0°
OAC1H1109.5°109.5°
O14C14C13110.6°109.5°
O14C14C15109.1°109.5°
O14C14H14110.1°109.6°
C14O14HO14109.5°114.0°
C3C4C5108.6°109.2°
C3C4O4109.7°109.5°
C4C3H3109.1°109.6°
C3C4H4109.4°109.6°
O5C5C4110.4°109.4°
O5C5C6109.7°109.5°
O5C5H5109.8°109.5°
O16C16C15109.1°109.5°
O16C16H16109.6°109.5°
O16C16H16A109.6°109.5°
C16O16HO16109.5°114.0°
OAC13C14111.6°109.6°
OAC13C12107.8°109.6°
OAC13H13110.5°109.6°
C13C14C15109.1°109.2°
C14C13C12107.9°109.0°
C14C13H13109.5°109.5°
C13C14H14109.0°109.5°
C14C15C16109.5°109.5°
C14C15O15110.1°109.4°
C15C14H14108.9°109.5°
C14C15H15109.2°109.5°
C5C4O4109.6°109.5°
C4C5C6109.7°109.5°
C5C4H4109.2°109.5°
C4C5H5108.7°109.5°
O4C4H4110.5°109.6°
C4O4HO4109.5°113.9°
C16C15O15108.5°109.5°
C16C15H15109.2°109.5°
C15C16H16109.6°109.5°
C15C16H16A109.6°109.5°
O6C6C5110.0°109.4°
O6C6H6109.3°109.5°
O6C6H6A109.3°109.4°
C6O6HO6109.5°114.0°
C6C5H5108.6°109.5°
C5C6H6109.3°109.5°
C5C6H6A109.4°109.5°
C13C12O12109.7°109.5°
C13C12C11109.8°109.2°
C13C12H12108.8°109.6°
C12C13H13109.5°109.5°
C15O15C11111.0°114.1°
O15C15H15110.4°109.5°
O12C12C11109.7°109.5°
O12C12H12109.9°109.5°
C12O12HO12109.5°114.0°
C12C11O15109.7°109.4°
C12C11O11109.7°109.5°
C12C11H11108.6°109.5°
C11C12H12108.8°109.5°
O15C11O11109.5°109.5°
O15C11H11109.7°109.5°
O11C11H11109.7°109.4°
C11O11HO11109.5°114.0°
H6C6H6A109.5°109.5°
H16C16H16A109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O2C2C1C3119.2°119.9°
O2C2C1H2121.7°120.1°
O2C2C3H2121.1°120.1°
O2C2C3O357.7°63.2°
O2C2C1O5179.0°177.5°
O2C2C1OA58.8°57.5°
O2C2C3C4178.3°176.9°
O2C2C1H159.8°62.5°
O2C2C3H363.3°57.0°
C1C2C3H2118.9°119.9°
C1C2C3O3177.6°176.9°
C2C1O5OA119.6°120.0°
C2C1O5H1118.6°120.0°
C2C1OAH1117.9°120.0°
C1C2C3C461.7°57.0°
C2C1O5C561.0°61.2°
C2C1OAC13173.3°162.6°
C1C2O2HO2180.0°59.9°
C1C2C3H356.6°62.9°
C2C3O3C4119.1°119.5°
C2C3O3H3120.3°120.2°
C3C2C1O561.7°57.6°
C3C2C1OA60.5°62.4°
C2C3C4H3118.4°119.8°
C2C3C4C559.8°57.0°
C2C3C4O4179.5°176.9°
C3C2O2HO261.4°179.6°
C3C2C1H1179.0°177.6°
C2C3O3HO3180.0°60.0°
C2C3C4H459.2°62.9°
O3C3C4H3121.3°120.3°
O3C3C4C5179.9°176.8°
O3C3C4O460.2°63.3°
O3C3C2H263.5°56.9°
O3C3C4H461.1°56.9°
O5C1OAH1121.8°120.1°
O5C1OAC1352.9°77.4°
C1O5C5C459.4°61.2°
C1O5C5C6179.7°178.9°
O5C1C2H257.3°62.3°
C1O5C5H560.4°58.8°
OAC1O5C558.6°58.8°
C1OAC13C1467.9°93.6°
C1OAC13C12173.8°146.8°
OAC1C2H2179.5°177.7°
C1OAC13H1354.1°26.6°
O14C14C13OA64.5°63.2°
O14C14C13C15120.0°119.9°
O14C14C13H14121.2°120.2°
O14C14C15H14120.2°120.2°
O14C14C15C1660.1°62.5°
O14C14C13C12177.2°176.9°
O14C14C15O15179.3°177.5°
O14C14C13H1358.1°57.0°
O14C14C15H1559.4°57.6°
C3C4C5O558.2°57.6°
C3C4C5O4119.7°119.9°
C3C4C5H4119.1°120.0°
C3C4O4H4120.6°120.2°
C3C4C5C6179.2°177.6°
C4C3C2H257.2°62.9°
C4C3O3HO360.9°179.5°
C3C4O4HO4180.0°60.0°
C3C4C5H562.3°62.4°
O5C5C4C6121.0°120.0°
O5C5C4H5120.5°120.0°
O5C5C4O4178.0°177.5°
O5C5C6O656.7°66.4°
O5C5C6H5120.0°120.1°
C5O5C1H1179.6°178.8°
O5C5C4H460.9°62.3°
O5C5C6H6176.7°173.6°
O5C5C6H6A63.4°53.5°
O16C16C15C1471.5°175.0°
O16C16C15H16119.9°120.1°
O16C16C15H16A120.0°120.0°
O16C16C15O1548.6°65.0°
O16C16C15H15169.0°55.0°
O16C16H16H16A120.2°120.0°
OAC13C14C12118.2°119.9°
OAC13C14H13122.7°120.2°
OAC13C14C15175.4°176.9°
OAC13C12H13120.3°120.2°
OAC13C12O1261.2°63.2°
OAC13C12C11178.2°176.9°
C13OAC1H168.8°42.6°
OAC13C12H1259.1°57.0°
OAC13C14H1456.6°57.0°
C13C14C15H14118.8°119.9°
C13C14C15C16178.9°177.6°
C14C13C12H13119.1°119.9°
C13C14C15O1559.7°57.6°
C14C13C12O12178.2°176.9°
C14C13C12C1157.5°57.0°
C14C13C12H1261.5°63.0°
C13C14O14HO14180.0°180.0°
C13C14C15H1561.6°62.3°
C14C15C16O15120.2°120.0°
C14C15C16H15119.5°120.0°
C15C14C13C1257.2°57.0°
C14C15O15H15120.6°120.0°
C14C15O15C1162.2°61.1°
C15C14C13H1361.9°62.9°
C15C14O14HO1460.0°60.3°
C14C15C16H1648.4°54.9°
C14C15C16H16A168.5°65.0°
C5C4O4H4120.3°120.1°
C4C5C6O664.7°173.7°
C4C5C6H5118.6°120.0°
C5C4C3H358.6°62.8°
C5C4O4HO461.0°179.7°
C4C5C6H655.4°53.7°
C4C5C6H6A175.3°66.4°
O4C4C5C661.1°62.5°
O4C4C3H361.1°57.0°
O4C4C5H557.5°57.5°
C16C15O15H15119.6°120.0°
C16C15O15C11178.0°178.8°
C16C15C14H1460.1°57.7°
C15C16H16H16A120.1°120.0°
C15C16O16HO16180.0°180.0°
O6C6C5H6120.1°120.0°
O6C6C5H6A120.1°119.9°
O6C6C5H5176.7°53.7°
O6C6H6H6A119.8°119.9°
C6C5C4H460.0°57.7°
C5C6H6H6A119.8°120.1°
C5C6O6HO6180.0°180.0°
C13C12O12C11120.7°119.7°
C13C12O12H12119.7°120.2°
C13C12C11H12119.0°120.0°
C13C12C11O1559.7°57.6°
C13C12C11O1160.6°62.4°
C13C12C11H11179.5°177.6°
C13C12O12HO12180.0°179.4°
C12C13C14H1461.6°62.9°
C15O15C11C1261.8°61.2°
C15O15C11O1158.6°58.9°
C15O15C11H11179.0°178.8°
O15C15C14H1459.1°62.3°
O15C15C16H16168.6°174.9°
O15C15C16H16A71.3°55.0°
O12C12C11H12120.3°120.1°
O12C12C11O15179.6°177.6°
O12C12C11O1160.1°57.5°
O12C12C11H1159.8°62.4°
O12C12C13H1359.1°57.0°
C12C11O15O11120.4°120.0°
C12C11O15H11119.1°120.0°
C12C11O11H11119.2°120.0°
C12C11O11HO11180.0°180.0°
C11C12O12HO1259.3°60.9°
C11C12C13H1361.6°62.9°
O15C11O11H11120.4°120.0°
O15C11O11HO1159.6°60.0°
O15C11C12H1259.3°62.3°
C11O15C15H1558.4°58.8°
O11C11C12H12179.6°177.6°
HO2O2C2H259.0°60.2°
H1C1C2H262.0°57.7°
H2C2C3H3175.5°177.2°
H3C3O3HO359.7°60.2°
H3C3C4H4177.6°177.2°
H4C4O4HO459.4°60.2°
H4C4C5H5178.6°177.7°
H5C5C6H663.2°66.4°
H5C5C6H6A56.7°173.6°
H6C6O6HO659.9°60.0°
H6AC6O6HO659.9°60.0°
H11C11O11HO1160.8°60.0°
H11C11C12H1260.5°57.7°
H12C12O12HO1260.3°59.2°
H12C12C13H13179.4°177.2°
H13C13C14H14179.3°177.2°
H14C14O14HO1459.5°59.8°
H14C14C15H15179.6°177.8°
H15C15C16H1671.1°65.1°
H15C15C16H16A49.0°175.0°
H16C16O16HO1660.0°60.0°
H16AC16O16HO1660.1°60.0°

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