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2CV

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C9C12sing1.53Å1.53Å
C9C1sing1.53Å1.53Å
C12C15sing1.53Å1.53Å
C15C18sing1.53Å1.54Å
C18C21sing1.53Å1.54Å
C21C24sing1.53Å1.54Å
C24C27sing1.53Å1.54Å
C27C30sing1.51Å1.55Å
C30N33sing1.35Å1.35Å
C30O34doub1.21Å1.23Å
N33C35sing1.46Å1.48Å
N33C36sing1.46Å1.49Å
C35C60sing1.53Å1.53Å
C36C37sing1.53Å1.54Å
C37C40sing1.53Å1.53Å
C37O47sing1.43Å1.43Å
C40C41sing1.53Å1.55Å
C40O49sing1.43Å1.43Å
C41C42sing1.53Å1.56Å
C41O51sing1.43Å1.43Å
C42C43sing1.53Å1.54Å
C42O53sing1.43Å1.44Å
C43O44sing1.43Å1.43Å
C60O63sing1.43Å1.43Å
C1C0sing1.53Å1.53Å
C9H91Csing1.09Å1.10Å
C9H92Csing1.09Å1.10Å
C12H121sing1.09Å1.10Å
C12H122sing1.09Å1.10Å
C1H11Csing1.09Å1.10Å
C1H12Csing1.09Å1.10Å
C15H151sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C18H181sing1.09Å1.10Å
C18H182sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C24H241sing1.09Å1.10Å
C24H242sing1.09Å1.10Å
C27H271sing1.09Å1.10Å
C27H272sing1.09Å1.10Å
C35H351sing1.09Å1.10Å
C35H352sing1.09Å1.10Å
C36H361sing1.09Å1.10Å
C36H362sing1.09Å1.10Å
C60H601sing1.09Å1.10Å
C60H602sing1.09Å1.10Å
C37H37sing1.09Å1.10Å
C40H40sing1.09Å1.10Å
O47H47sing0.97Å0.95Å
C41H41sing1.09Å1.10Å
O49H49sing0.97Å0.95Å
C42H42sing1.09Å1.10Å
O51H51sing0.97Å0.95Å
C43H431sing1.09Å1.10Å
C43H432sing1.09Å1.10Å
O53H53sing0.97Å0.95Å
O44H44sing0.97Å0.95Å
O63H63sing0.97Å0.95Å
C0H01Csing1.09Å1.10Å
C0H02Csing1.09Å1.10Å
C0H03Csing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C12C9C1111.4°109.5°
C9C12C15110.2°109.5°
C12C9H91C108.9°109.5°
C12C9H92C108.4°109.4°
C9C12H121109.2°109.4°
C9C12H122109.0°109.5°
C9C1C0110.1°109.5°
C1C9H91C108.8°109.5°
C1C9H92C108.4°109.5°
C9C1H11C109.3°109.5°
C9C1H12C109.2°109.4°
C12C15C18112.8°109.4°
C15C12H121109.2°109.5°
C15C12H122109.0°109.5°
C12C15H151108.4°109.4°
C12C15H152107.6°109.4°
C15C18C21110.3°109.4°
C18C15H151108.4°109.5°
C18C15H152107.6°109.5°
C15C18H181109.2°109.5°
C15C18H182109.0°109.5°
C18C21C24113.6°109.4°
C21C18H181109.2°109.5°
C21C18H182109.0°109.4°
C18C21H211108.1°109.5°
C18C21H212107.2°109.5°
C21C24C27111.6°109.4°
C24C21H211108.1°109.5°
C24C21H212107.1°109.4°
C21C24H241108.8°109.5°
C21C24H242108.3°109.5°
C24C27C30113.8°109.5°
C27C24H241108.8°109.5°
C27C24H242108.3°109.5°
C24C27H271108.0°109.5°
C24C27H272107.0°109.5°
C27C30N33117.5°120.0°
C27C30O34119.5°120.0°
C30C27H271108.1°109.5°
C30C27H272107.1°109.4°
N33C30O34122.9°120.0°
C30N33C35121.5°120.0°
C30N33C36119.4°120.0°
C35N33C36118.8°120.0°
N33C35C60113.7°109.5°
N33C35H351108.1°109.5°
N33C35H352107.1°109.5°
N33C36C37114.6°109.5°
N33C36H361107.8°109.5°
N33C36H362106.6°109.5°
C35C60O63107.6°109.5°
C60C35H351108.1°109.4°
C60C35H352107.1°109.5°
C35C60H601110.1°109.5°
C35C60H602110.5°109.4°
C36C37C40112.0°109.5°
C36C37O47110.5°109.4°
C37C36H361107.8°109.5°
C37C36H362106.6°109.4°
C36C37H37106.9°109.4°
C40C37O47108.9°109.5°
C37C40C41113.1°109.5°
C37C40O49108.2°109.4°
C40C37H37108.5°109.5°
C37C40H40108.5°109.4°
O47C37H37110.0°109.5°
C37O47H47109.5°114.0°
C41C40O49111.1°109.5°
C40C41C42114.0°109.4°
C40C41O51108.1°109.5°
C41C40H40105.4°109.5°
C40C41H41108.2°109.4°
O49C40H40110.5°109.5°
C40O49H49109.5°114.0°
C42C41O51111.9°109.5°
C41C42C43114.6°109.4°
C41C42O53109.9°109.5°
C42C41H41104.1°109.5°
C41C42H42105.1°109.4°
O51C41H41110.4°109.5°
C41O51H51109.5°114.0°
C43C42O53107.7°109.5°
C42C43O44110.7°109.5°
C43C42H42107.4°109.5°
C42C43H431109.1°109.5°
C42C43H432108.8°109.5°
O53C42H42112.3°109.5°
C42O53H53109.5°114.0°
O44C43H431109.1°109.5°
O44C43H432108.8°109.5°
C43O44H44109.5°114.0°
O63C60H601110.1°109.5°
O63C60H602110.5°109.5°
C60O63H63109.5°114.0°
C0C1H11C109.3°109.5°
C0C1H12C109.1°109.5°
C1C0H01C109.5°109.5°
C1C0H02C109.5°109.5°
C1C0H03C109.4°109.5°
H91CC9H92C111.0°109.5°
H121C12H122110.1°109.5°
H11CC1H12C109.9°109.4°
H151C15H152112.1°109.5°
H181C18H182110.2°109.5°
H211C21H212112.8°109.5°
H241C24H242111.1°109.5°
H271C27H272112.9°109.5°
H351C35H352112.8°109.4°
H361C36H362113.6°109.5°
H601C60H602108.0°109.5°
H431C43H432110.4°109.5°
H01CC0H02C109.5°109.4°
H01CC0H03C109.5°109.4°
H02CC0H03C109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C12C9C1H91C120.0°120.0°
C12C9C1H92C119.2°120.0°
C9C12C15H121120.0°120.0°
C9C12C15H122119.7°120.0°
C9C12C15C18165.3°180.0°
C12C9C1C0171.1°180.0°
C12C9H91CH92C119.2°120.0°
C9C12H121H122119.7°120.0°
C12C9C1H11C51.1°60.0°
C12C9C1H12C69.1°60.0°
C9C12C15H15145.2°60.0°
C9C12C15H15276.2°60.0°
C1C9C12C15167.8°NaN°
C9C1C0H11C120.0°120.0°
C9C1C0H12C119.8°120.0°
C1C9H91CH92C119.2°120.0°
C1C9C12H12147.8°60.0°
C1C9C12H12272.6°60.0°
C9C1H11CH12C119.8°120.0°
C9C1C0H01C74.0°60.0°
C9C1C0H02C166.0°60.0°
C9C1C0H03C46.0°180.0°
C12C15C18H151120.0°120.0°
C12C15C18H152118.6°120.0°
C12C15C18C21133.1°180.0°
C15C12C9H91C47.8°60.0°
C15C12C9H92C73.1°60.0°
C15C12H121H122119.7°120.0°
C12C15H151H152118.6°120.0°
C12C15C18H18113.1°60.0°
C12C15C18H182107.3°60.1°
C15C18C21H181120.0°120.0°
C15C18C21H182119.6°120.0°
C15C18C21C24136.6°180.0°
C18C15C12H12174.7°60.0°
C18C15C12H12245.6°60.0°
C18C15H151H152118.6°120.1°
C15C18H181H182119.6°120.1°
C15C18C21H21116.5°60.0°
C15C18C21H212105.3°60.1°
C18C21C24H211120.0°120.0°
C18C21C24H212118.2°120.0°
C18C21C24C2779.3°180.0°
C21C18C15H151106.9°60.0°
C21C18C15H15214.5°60.1°
C21C18H181H182119.7°119.9°
C18C21H211H212118.3°120.0°
C18C21C24H24140.7°60.0°
C18C21C24H242161.6°60.1°
C21C24C27H241120.0°120.0°
C21C24C27H242119.1°119.9°
C21C24C27C3084.8°180.0°
C24C21C18H181103.4°60.0°
C24C21C18H18216.9°60.0°
C24C21H211H212118.3°120.0°
C21C24H241H242119.2°120.0°
C21C24C27H27135.2°60.0°
C21C24C27H272157.1°60.0°
C24C27C30H271120.0°120.0°
C24C27C30H272118.1°120.0°
C24C27C30N33143.7°180.0°
C24C27C30O3439.5°0.1°
C27C24C21H211160.7°60.0°
C27C24C21H21238.9°60.0°
C27C24H241H242119.1°120.0°
C24C27H271H272118.2°120.0°
C27C30N33O34176.7°179.9°
C27C30N33C354.0°0.1°
C27C30N33C36178.4°180.0°
C30C27C24H241155.2°60.0°
C30C27C24H24234.3°60.1°
C30C27H271H272118.2°120.0°
C30N33C35C36174.5°179.9°
C30N33C35C6090.4°90.0°
C30N33C36C37135.4°90.0°
N33C30C27H27196.3°60.0°
N33C30C27H27225.6°60.1°
C30N33C35H35129.6°150.0°
C30N33C35H352151.5°30.1°
C30N33C36H361104.6°150.0°
C30N33C36H36217.7°30.0°
O34C30N33C35179.3°180.0°
O34C30N33C364.8°0.1°
O34C30C27H27180.5°119.9°
O34C30C27H272157.6°120.0°
N33C35C60H351120.0°120.0°
N33C35C60H352118.1°120.0°
C35N33C36C3750.0°90.1°
N33C35C60O63174.1°64.9°
N33C35H351H352118.3°120.0°
C35N33C36H36170.0°30.0°
C35N33C36H362167.7°150.0°
N33C35C60H60165.9°175.0°
N33C35C60H60253.3°55.0°
C36N33C35C6095.1°90.0°
N33C36C37H361120.0°120.0°
N33C36C37H362117.7°120.0°
N33C36C37C40176.0°175.0°
N33C36C37O4762.3°65.0°
C36N33C35H351144.9°30.0°
C36N33C35H35223.1°150.0°
N33C36H361H362117.9°120.0°
N33C36C37H3757.4°55.0°
C35C60O63H601120.0°120.1°
C35C60O63H602120.7°119.9°
C60C35H351H352118.3°120.0°
C35C60H601H602120.8°120.0°
C35C60O63H63121.9°180.0°
C36C37C40O47122.5°120.0°
C36C37C40H37117.7°120.0°
C36C37O47H37117.8°119.9°
C36C37C40C41100.8°180.0°
C36C37C40O49135.6°60.0°
C37C36H361H362117.9°120.0°
C36C37C40H4015.7°60.0°
C36C37O47H47157.2°60.0°
C40C37O47H37118.8°120.1°
C37C40C41O49121.9°120.0°
C37C40C41H40118.3°120.0°
C37C40O49H40118.6°119.9°
C37C40C41C42102.4°180.0°
C37C40C41O51132.5°60.0°
C40C37C36H36164.0°65.0°
C40C37C36H36258.3°55.0°
C40C37O47H4733.8°60.0°
C37C40C41H4112.9°60.0°
C37C40O49H4968.3°60.0°
O47C37C40C4121.7°60.0°
O47C37C40O49101.8°180.0°
O47C37C36H36157.7°55.0°
O47C37C36H362180.0°175.0°
O47C37C40H40138.2°60.0°
C41C40O49H40116.7°120.0°
C40C41C42O51123.0°120.1°
C40C41C42H41117.7°119.9°
C40C41O51H41118.2°120.0°
C40C41C42C43144.1°180.0°
C40C41C42O5394.5°60.0°
C41C40C37H37141.5°60.0°
C41C40O49H49167.0°60.0°
C40C41C42H4226.5°60.0°
C40C41O51H5165.6°60.0°
O49C40C41C4219.5°60.0°
O49C40C41O51105.6°180.0°
O49C40C37H3717.9°60.0°
O49C40C41H41134.8°60.0°
C42C41O51H41115.5°120.0°
C41C42C43O53122.6°120.0°
C41C42C43H42116.3°120.0°
C41C42O53H42116.6°120.0°
C41C42C43O4462.2°175.0°
C42C41C40H40139.3°60.1°
C42C41O51H51168.1°60.1°
C41C42C43H431177.8°65.0°
C41C42C43H43257.3°55.0°
C41C42O53H53176.6°60.0°
O51C41C42C4321.0°60.0°
O51C41C42O53142.5°180.0°
O51C41C40H4014.2°60.0°
O51C41C42H4296.5°60.0°
C43C42O53H42118.0°120.0°
C42C43O44H431120.0°120.0°
C42C43O44H432119.5°120.0°
C43C42C41H4198.2°60.0°
C42C43H431H432119.5°120.0°
C43C42O53H5351.2°60.0°
C42C43O44H4452.7°180.0°
O53C42C43O44175.2°65.0°
O53C42C41H4123.2°59.9°
O53C42C43H43155.2°55.0°
O53C42C43H43265.3°175.0°
O44C43C42H4254.1°55.0°
O44C43H431H432119.5°120.0°
O63C60C35H35154.0°55.1°
O63C60C35H35267.8°175.0°
O63C60H601H602120.7°120.0°
C0C1C9H91C68.8°60.0°
C0C1C9H92C52.0°60.0°
C0C1H11CH12C119.7°120.0°
C1C0H01CH02C120.0°120.0°
C1C0H01CH03C120.0°120.0°
C1C0H02CH03C120.0°120.0°
H91CC9C12H12172.2°60.0°
H91CC9C12H122167.5°180.0°
H91CC9C1H11C171.2°180.0°
H91CC9C1H12C50.9°60.0°
H92CC9C12H121166.9°180.0°
H92CC9C12H12246.6°60.0°
H92CC9C1H11C68.0°60.0°
H92CC9C1H12C171.7°180.0°
H121C12C15H151165.3°180.0°
H121C12C15H15243.9°60.0°
H122C12C15H15174.4°60.0°
H122C12C15H152164.2°180.0°
H11CC1C0H01C46.0°180.0°
H11CC1C0H02C74.0°60.0°
H11CC1C0H03C166.0°60.0°
H12CC1C0H01C166.2°60.0°
H12CC1C0H02C46.2°180.0°
H12CC1C0H03C73.8°60.0°
H151C15C18H181133.1°180.0°
H151C15C18H18212.8°59.9°
H152C15C18H181105.5°59.9°
H152C15C18H182134.2°180.0°
H181C18C21H211136.5°180.0°
H181C18C21H21214.7°60.0°
H182C18C21H211103.1°60.0°
H182C18C21H212135.1°180.0°
H211C21C24H24179.3°180.0°
H211C21C24H24241.6°60.0°
H212C21C24H241158.9°60.0°
H212C21C24H24280.2°180.0°
H241C24C27H27184.8°180.0°
H241C24C27H27237.1°59.9°
H242C24C27H271154.3°60.0°
H242C24C27H27283.8°180.0°
H351C35C60H601174.0°65.0°
H351C35C60H60266.7°175.1°
H352C35C60H60152.2°55.0°
H352C35C60H602171.5°65.0°
H361C36C37H37177.4°175.0°
H362C36C37H3760.3°65.0°
H601C60O63H631.9°59.9°
H602C60O63H63117.3°60.1°
H37C37C40H40102.0°180.0°
H37C37O47H4785.0°179.9°
H40C40C41H41105.5°180.0°
H40C40O49H4950.3°180.0°
H41C41C42H42144.2°180.0°
H41C41O51H5152.6°179.9°
H42C42C43H43165.9°175.0°
H42C42C43H432173.6°65.0°
H42C42O53H5366.8°180.0°
H431C43O44H44172.7°60.0°
H432C43O44H4466.8°60.0°
H01CC0H02CH03C120.0°119.9°

222415

PDB entries from 2024-07-10

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