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22B

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.57Å1.56Å
C1C16sing1.54Å1.59Å
C1C17sing1.54Å1.58Å
C1O26sing1.43Å1.55Å
C2C3sing1.52Å1.58Å
C2C21sing1.55Å1.57Å
C2H2sing1.10Å1.10Å
C3C4doub1.34Å1.54Å
C3H3sing1.09Å1.08Å
C4C5sing1.46Å1.54Å
C4H4sing1.09Å1.08Å
C5C6doub1.35Å1.42Å
C5C18sing1.51Å1.47Å
C6C7sing1.45Å1.42Å
C6H6sing1.09Å1.08Å
C7C8doub1.34Å1.30Å
C7H7sing1.09Å1.08Å
C8C9sing1.46Å1.44Å
C8H8sing1.09Å1.08Å
C9C10doub1.35Å1.35Å
C9C19sing1.51Å1.54Å
C10C11sing1.45Å1.31Å
C10H10sing1.09Å1.08Å
C11C12doub1.34Å1.38Å
C11H11sing1.08Å1.08Å
C12C13sing1.46Å1.48Å
C12H12sing1.09Å1.08Å
C13C14doub1.35Å1.35Å
C13C20sing1.50Å1.52Å
C14C15sing1.45Å1.46Å
C14H14sing1.09Å1.08Å
C15C45doub1.34Å1.31Å
C15H15sing1.09Å1.08Å
C16H161sing1.09Å1.10Å
C16H162sing1.10Å1.10Å
C16H163sing1.09Å1.10Å
C17H171sing1.10Å1.10Å
C17H172sing1.09Å1.10Å
C17H173sing1.09Å1.10Å
C18H181sing1.10Å1.10Å
C18H182sing1.10Å1.10Å
C18H183sing1.10Å1.10Å
C19H191sing1.10Å1.10Å
C19H192sing1.10Å1.10Å
C19H193sing1.10Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.10Å1.10Å
C20H203sing1.10Å1.10Å
C21C22sing1.54Å1.55Å
C21H211sing1.10Å1.10Å
C21H212sing1.10Å1.10Å
C22C23sing1.54Å1.56Å
C22H221sing1.10Å1.10Å
C22H222sing1.10Å1.10Å
C23C24sing1.53Å1.55Å
C23C25sing1.53Å1.56Å
C23O27sing1.43Å1.52Å
C24H241sing1.10Å1.10Å
C24H242sing1.10Å1.10Å
C24H243sing1.09Å1.10Å
C25H251sing1.10Å1.10Å
C25H252sing1.10Å1.10Å
C25H253sing1.09Å1.10Å
O26H26sing0.97Å0.95Å
O27H27sing0.97Å0.95Å
C38C39sing1.46Å1.45Å
C38C27doub1.34Å64.59Å
C38H38sing1.09Å1.08Å
C39C40doub1.35Å1.49Å
C39C26sing1.51Å64.80Å
C40C41sing1.45Å1.40Å
C40H40sing1.09Å1.08Å
C41C42doub1.34Å1.35Å
C41H41sing1.08Å1.08Å
C42C43sing1.46Å1.40Å
C42H42sing1.09Å1.08Å
C43C50sing1.51Å1.58Å
C43C44doub1.35Å1.49Å
C44C45sing1.45Å1.34Å
C44H44sing1.09Å1.08Å
C45H45sing1.09Å1.08Å
C50H501sing1.10Å1.10Å
C50H502sing1.10Å1.10Å
C50H503sing1.10Å1.10Å
C26H261sing1.09Å0.00Å
C26H262sing1.09Å0.00Å
C26H263sing1.09Å0.00Å
C27C28sing1.45Å0.00Å
C27H1sing1.09Å0.00Å
C28C29doub1.35Å0.00Å
C28H28sing1.09Å0.00Å
C29C30sing1.51Å0.00Å
C29C31sing1.46Å0.00Å
C30H301sing1.10Å0.00Å
C30H302sing1.09Å0.00Å
C30H303sing1.10Å0.00Å
C31C32doub1.34Å0.00Å
C31H31sing1.09Å0.00Å
C32C33sing1.53Å0.00Å
C32H32sing1.09Å0.00Å
C33C34sing1.56Å0.00Å
C33C47sing1.57Å0.00Å
C33H33sing1.10Å0.00Å
C34C35sing1.54Å0.00Å
C34H341sing1.09Å0.00Å
C34H342sing1.10Å0.00Å
C35C36sing1.54Å0.00Å
C35H351sing1.10Å0.00Å
C35H352sing1.09Å0.00Å
C36C37sing1.53Å0.00Å
C36C46sing1.53Å0.00Å
C36O1sing1.43Å0.00Å
C37H371sing1.10Å0.00Å
C37H372sing1.10Å0.00Å
C37H373sing1.09Å0.00Å
C46H461sing1.10Å0.00Å
C46H462sing1.10Å0.00Å
C46H463sing1.09Å0.00Å
O1HO1sing0.97Å0.00Å
C47C48sing1.53Å0.00Å
C47C49sing1.54Å0.00Å
C47O2sing1.44Å0.00Å
C48H481sing1.09Å0.00Å
C48H482sing1.10Å0.00Å
C48H483sing1.10Å0.00Å
C49H491sing1.10Å0.00Å
C49H492sing1.09Å0.00Å
C49H493sing1.09Å0.00Å
O2HO2sing0.97Å0.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C16113.3°112.0°
C2C1C17112.0°112.3°
C2C1O26111.5°110.0°
C1C2C3111.0°111.0°
C1C2C21110.4°113.4°
C1C2H2107.2°106.6°
C16C1C17106.7°108.0°
C16C1O26106.5°106.7°
C1C16H161109.5°111.8°
C1C16H162109.5°110.8°
C1C16H163109.5°111.5°
C17C1O26106.3°107.6°
C1C17H171109.5°110.8°
C1C17H172109.5°111.9°
C1C17H173109.5°111.5°
C1O26H26109.5°106.2°
C3C2C21107.5°114.0°
C3C2H2110.1°105.5°
C2C3C4122.0°126.5°
C2C3H3119.0°113.9°
C21C2H2110.7°105.6°
C2C21C22107.1°113.3°
C2C21H211110.3°110.4°
C2C21H212110.8°108.9°
C4C3H3119.0°119.6°
C3C4C5123.2°126.3°
C3C4H4118.4°117.6°
C5C4H4118.4°116.1°
C4C5C6114.5°123.4°
C4C5C18121.7°117.9°
C6C5C18123.8°118.6°
C5C6C7124.4°128.5°
C5C6H6117.8°118.8°
C5C18H181109.5°112.3°
C5C18H182109.5°110.9°
C5C18H183109.4°110.6°
C7C6H6117.8°112.6°
C6C7C8120.1°123.8°
C6C7H7119.9°114.6°
C8C7H7119.9°121.5°
C7C8C9122.0°126.3°
C7C8H8119.0°117.0°
C9C8H8119.0°116.6°
C8C9C10111.9°124.0°
C8C9C19123.7°117.4°
C10C9C19124.4°118.6°
C9C10C11125.8°128.1°
C9C10H10117.1°117.7°
C9C19H191109.5°110.8°
C9C19H192109.4°112.3°
C9C19H193109.4°110.8°
C11C10H10117.1°114.2°
C10C11C12119.8°123.0°
C10C11H11120.1°118.1°
C12C11H11120.1°118.9°
C11C12C13124.8°124.8°
C11C12H12117.6°119.8°
C13C12H12117.6°115.3°
C12C13C14113.5°121.0°
C12C13C20121.5°113.2°
C14C13C20125.0°125.8°
C13C14C15126.4°127.3°
C13C14H14116.8°117.9°
C13C20H201109.5°113.5°
C13C20H202109.5°110.4°
C13C20H203109.5°110.4°
C15C14H14116.8°114.8°
C14C15C45120.7°125.8°
C14C15H15119.6°117.5°
C45C15H15119.7°116.7°
C15C45C44119.5°126.9°
C15C45H45120.2°118.4°
H161C16H162109.4°105.4°
H161C16H163109.5°108.9°
H162C16H163109.5°108.2°
H171C17H172109.5°105.2°
H171C17H173109.4°108.2°
H172C17H173109.5°109.0°
H181C18H182109.4°107.0°
H181C18H183109.5°106.9°
H182C18H183109.5°109.0°
H191C19H192109.5°107.0°
H191C19H193109.5°108.9°
H192C19H193109.5°106.8°
H201C20H202109.4°106.4°
H201C20H203109.5°107.7°
H202C20H203109.5°108.2°
C22C21H211110.3°109.8°
C22C21H212110.8°107.7°
C21C22C23115.0°114.3°
C21C22H221107.7°107.8°
C21C22H222106.4°109.8°
H211C21H212107.6°106.5°
C23C22H221107.7°108.2°
C23C22H222106.4°109.1°
C22C23C24109.8°112.4°
C22C23C25109.2°109.5°
C22C23O27110.0°108.3°
H221C22H222113.9°107.3°
C24C23C25110.0°110.4°
C24C23O27110.4°108.3°
C23C24H241109.5°110.9°
C23C24H242109.5°111.4°
C23C24H243109.4°111.5°
C25C23O27107.4°107.8°
C23C25H251109.5°110.8°
C23C25H252109.4°111.0°
C23C25H253109.4°111.6°
C23O27H27109.5°106.3°
H241C24H242109.5°105.9°
H241C24H243109.4°108.4°
H242C24H243109.5°108.7°
H251C25H252109.5°106.2°
H251C25H253109.4°108.5°
H252C25H253109.5°108.5°
C39C38C2797.8°128.8°
C39C38H38131.1°114.1°
C38C39C40120.0°126.7°
C38C39C2680.9°113.0°
C27C38H38131.1°117.1°
C38C27C2890.0°127.8°
C38C27H190.0°117.9°
C40C39C2699.7°120.2°
C39C40C41119.6°127.7°
C39C40H40120.2°117.7°
C39C26H26190.0°110.7°
C39C26H26290.0°112.2°
C39C26H26390.0°110.6°
C41C40H40120.2°114.6°
C40C41C42119.8°122.7°
C40C41H41120.1°117.0°
C42C41H41120.1°120.3°
C41C42C43123.3°126.2°
C41C42H42118.3°117.6°
C43C42H42118.3°116.1°
C42C43C50121.8°117.9°
C42C43C44116.9°123.2°
C50C43C44121.3°118.8°
C43C50H501109.5°110.8°
C43C50H502109.4°112.3°
C43C50H503109.5°110.7°
C43C44C45122.7°127.7°
C43C44H44118.6°119.2°
C45C44H44118.7°113.1°
C44C45H45120.3°114.7°
H501C50H502109.5°107.0°
H501C50H503109.5°109.0°
H502C50H503109.5°107.0°
H261C26H26290.0°107.2°
H261C26H26390.0°108.3°
H262C26H26390.0°107.5°
C28C27H190.0°114.3°
C27C28C2990.0°128.3°
C27C28H2890.0°112.3°
C29C28H2890.0°119.4°
C28C29C3090.0°123.8°
C28C29C3190.0°118.2°
C30C29C3190.0°118.0°
C29C30H30190.0°110.7°
C29C30H30290.0°112.9°
C29C30H30390.0°110.7°
C29C31C3290.0°126.7°
C29C31H3190.0°115.3°
H301C30H30290.0°107.9°
H301C30H30390.0°108.7°
H302C30H30390.0°105.8°
C32C31H3190.0°117.9°
C31C32C3390.0°126.6°
C31C32H3290.0°119.5°
C33C32H3290.0°113.9°
C32C33C3490.0°113.0°
C32C33C4790.0°110.1°
C32C33H3390.0°103.9°
C34C33C4790.0°115.0°
C34C33H3390.0°106.9°
C33C34C3590.0°113.1°
C33C34H34190.0°110.2°
C33C34H34290.0°109.8°
C47C33H3390.0°107.2°
C33C47C4890.0°112.9°
C33C47C4990.0°113.8°
C33C47O290.0°107.1°
C35C34H34190.0°110.6°
C35C34H34290.0°106.3°
C34C35C3690.0°115.5°
C34C35H35190.0°108.7°
C34C35H35290.0°110.8°
H341C34H34290.0°106.6°
C36C35H35190.0°108.6°
C36C35H35290.0°108.2°
C35C36C3790.0°112.1°
C35C36C4690.0°112.5°
C35C36O190.0°106.2°
H351C35H35290.0°104.5°
C37C36C4690.0°110.6°
C37C36O190.0°107.5°
C36C37H37190.0°110.8°
C36C37H37290.0°110.8°
C36C37H37390.0°112.2°
C46C36O190.0°107.7°
C36C46H46190.0°110.8°
C36C46H46290.0°110.8°
C36C46H46390.0°112.2°
C36O1HO190.0°106.0°
H371C37H37290.0°106.3°
H371C37H37390.0°108.5°
H372C37H37390.0°107.9°
H461C46H46290.0°106.3°
H461C46H46390.0°108.0°
H462C46H46390.0°108.6°
C48C47C4990.0°109.0°
C48C47O290.0°106.2°
C47C48H48190.0°112.2°
C47C48H48290.0°110.8°
C47C48H48390.0°110.8°
C49C47O290.0°107.4°
C47C49H49190.0°110.6°
C47C49H49290.0°111.7°
C47C49H49390.0°112.3°
C47O2HO290.0°105.7°
H481C48H48290.0°107.6°
H481C48H48390.0°109.3°
H482C48H48390.0°105.8°
H491C49H49290.0°105.3°
H491C49H49390.0°107.7°
H492C49H49390.0°108.9°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C16C17123.8°124.1°
C2C1C16O26122.9°120.4°
C2C1C17O26122.0°121.1°
C1C2C3C21120.8°129.5°
C1C2C3H2118.6°115.1°
C1C2C21H2118.6°116.3°
C1C2C3C460.0°115.0°
C1C2C3H3120.1°66.6°
C2C1C16H16193.4°65.4°
C2C1C16H16226.6°177.3°
C2C1C16H163146.6°56.7°
C2C1C17H171117.9°175.2°
C2C1C17H172122.2°67.7°
C2C1C17H1732.1°54.6°
C1C2C21C22125.0°168.2°
C1C2C21H2115.0°68.2°
C1C2C21H212114.1°48.4°
C2C1O26H2663.2°26.1°
C16C1C17O26113.4°114.9°
C16C1C2C359.1°60.0°
C16C1C2C2159.9°170.2°
C16C1C2H2179.4°54.4°
C1C16H161H162120.0°120.4°
C1C16H161H163120.0°123.7°
C1C16H162H163120.0°122.5°
C16C1C17H171117.6°51.3°
C16C1C17H1722.4°168.3°
C16C1C17H173122.5°69.3°
C16C1O26H2660.9°147.8°
C17C1C2C3179.9°178.3°
C17C1C2C2160.9°48.5°
C17C1C2H259.8°67.3°
C17C1C16H161142.8°170.5°
C17C1C16H16297.2°53.2°
C17C1C16H16322.8°67.4°
C1C17H171H172120.0°121.1°
C1C17H171H173120.0°122.5°
C1C17H172H173120.0°123.7°
C17C1O26H26174.4°96.5°
O26C1C2C361.1°58.5°
O26C1C2C21179.9°71.3°
O26C1C2H259.2°172.9°
O26C1C16H16129.5°55.0°
O26C1C16H162149.5°62.2°
O26C1C16H16390.5°177.2°
O26C1C17H1714.1°63.6°
O26C1C17H172115.9°53.4°
O26C1C17H173124.1°175.8°
C3C2C21H2120.3°115.4°
C2C3C4H3180.0°178.3°
C2C3C4C5177.8°180.0°
C2C3C4H42.2°2.1°
C3C2C21C22113.9°63.5°
C3C2C21H211126.1°60.0°
C3C2C21H2127.1°176.7°
C21C2C3C4179.3°115.5°
C21C2C3H30.7°62.9°
C2C21C22H211120.0°123.9°
C2C21C22H212120.9°120.5°
C2C21H211H212121.0°118.1°
C2C21C22C23115.9°179.6°
C2C21C22H2214.1°60.0°
C2C21C22H222126.5°56.5°
H2C2C3C458.6°0.0°
H2C2C3H3121.4°178.3°
H2C2C21C226.4°51.9°
H2C2C21H211113.6°175.4°
H2C2C21H212127.4°67.9°
C3C4C5H4180.0°177.9°
C3C4C5C6178.8°180.0°
C3C4C5C180.8°2.3°
H3C3C4C52.2°1.7°
H3C3C4H4177.8°176.2°
C4C5C6C18177.9°177.7°
C4C5C6C7171.9°180.0°
C4C5C6H68.1°1.4°
C4C5C18H1811.3°176.0°
C4C5C18H182118.7°56.4°
C4C5C18H183121.3°64.7°
H4C4C5C61.2°2.1°
H4C4C5C18179.1°175.7°
C5C6C7H6180.0°178.7°
C5C6C7C8175.3°180.0°
C5C6C7H74.7°4.7°
C6C5C18H181179.1°1.9°
C6C5C18H18259.1°121.5°
C6C5C18H18360.9°117.5°
C18C5C6C76.1°2.3°
C18C5C6H6174.0°179.1°
C5C18H181H182120.0°121.9°
C5C18H181H183120.0°121.5°
C5C18H182H183120.0°122.0°
C6C7C8H7180.0°174.9°
C6C7C8C9176.7°180.0°
C6C7C8H83.3°0.7°
H6C6C7C84.7°1.3°
H6C6C7H7175.3°174.0°
C7C8C9H8180.0°179.3°
C7C8C9C10177.6°179.9°
C7C8C9C190.5°0.4°
H7C7C8C93.3°5.1°
H7C7C8H8176.7°174.3°
C8C9C10C19178.0°179.6°
C8C9C10C11179.2°180.0°
C8C9C10H100.8°0.8°
C8C9C19H1917.6°64.2°
C8C9C19H192127.6°176.2°
C8C9C19H193112.4°56.8°
H8C8C9C102.5°0.7°
H8C8C9C19179.5°179.7°
C9C10C11H10180.0°179.3°
C9C10C11C12178.7°180.0°
C9C10C11H111.3°0.3°
C10C9C19H191170.2°116.2°
C10C9C19H19250.2°3.4°
C10C9C19H19369.8°122.8°
C19C9C10C112.8°0.5°
C19C9C10H10177.2°178.8°
C9C19H191H192120.0°122.7°
C9C19H191H193120.0°122.1°
C9C19H192H193120.0°121.7°
C10C11C12H11180.0°179.7°
C10C11C12C13177.0°179.6°
C10C11C12H123.0°1.2°
H10C10C11C121.3°0.7°
H10C10C11H11178.7°179.5°
C11C12C13H12180.0°178.5°
C11C12C13C14178.6°180.0°
C11C12C13C201.3°1.7°
H11C11C12C133.0°0.1°
H11C11C12H12177.0°178.6°
C12C13C14C20177.1°178.1°
C12C13C14C15175.6°179.9°
C12C13C14H144.4°1.9°
C12C13C20H2018.8°170.3°
C12C13C20H202128.8°51.0°
C12C13C20H203111.2°68.7°
H12C12C13C141.4°1.5°
H12C12C13C20178.7°176.8°
C13C14C15H14180.0°178.1°
C13C14C15C45179.7°180.0°
C13C14C15H150.3°2.5°
C14C13C20H201168.1°11.5°
C14C13C20H20248.1°130.8°
C14C13C20H20371.9°109.5°
C20C13C14C151.6°1.9°
C20C13C14H14178.4°176.1°
C13C20H201H202120.0°121.6°
C13C20H201H203120.0°122.6°
C13C20H202H203120.0°121.0°
C14C15C45H15180.0°177.6°
C14C15C45C44179.0°180.0°
C14C15C45H451.0°2.2°
H14C14C15C450.4°1.9°
H14C14C15H15179.7°175.6°
C15C45C44C43179.5°180.0°
C15C45C44H45180.0°177.9°
C15C45C44H440.5°1.5°
H15C15C45C441.0°2.5°
H15C15C45H45179.0°179.8°
H161C16H162H163120.0°116.3°
H171C17H172H173120.0°115.9°
H181C18H182H183120.0°115.2°
H191C19H192H193120.0°116.6°
H201C20H202H203120.0°115.5°
C22C21H211H212121.0°116.3°
C21C22C23H221120.0°120.1°
C21C22C23H222117.6°123.4°
C21C22H221H222117.8°118.2°
C21C22C23C2456.6°59.9°
C21C22C23C2564.1°177.1°
C21C22C23O27178.3°59.8°
H211C21C22C23124.1°55.7°
H211C21C22H221115.9°176.1°
H211C21C22H2226.5°67.3°
H212C21C22C235.0°59.9°
H212C21C22H221125.0°60.5°
H212C21C22H222112.5°177.1°
C23C22H221H222117.7°117.7°
C22C23C24C25120.2°122.6°
C22C23C24O27121.5°119.7°
C22C23C25O27119.3°117.6°
C22C23C24H24170.5°173.5°
C22C23C24H24249.6°68.8°
C22C23C24H243169.6°52.7°
C22C23C25H251133.3°60.7°
C22C23C25H252106.6°178.5°
C22C23C25H25313.4°60.3°
C22C23O27H2773.4°93.1°
H221C22C23C24176.6°180.0°
H221C22C23C2555.9°56.9°
H221C22C23O2761.7°60.4°
H222C22C23C2461.0°63.6°
H222C22C23C25178.4°59.5°
H222C22C23O2760.8°176.8°
C24C23C25O27120.2°118.1°
C23C24H241H242120.0°120.9°
C23C24H241H243120.0°122.6°
C23C24H242H243120.0°123.2°
C24C23C25H251106.1°175.0°
C24C23C25H25213.9°57.2°
C24C23C25H253134.0°64.0°
C24C23O27H2748.0°144.8°
C25C23C24H241169.3°51.0°
C25C23C24H24270.6°168.6°
C25C23C24H24349.4°69.9°
C23C25H251H252120.0°120.7°
C23C25H251H253120.0°122.8°
C23C25H252H253120.0°122.9°
C25C23O27H27167.9°25.3°
O27C23C24H24151.0°66.8°
O27C23C24H242171.1°50.8°
O27C23C24H24368.9°172.4°
O27C23C25H25114.1°56.9°
O27C23C25H252134.1°60.9°
O27C23C25H253105.9°177.9°
H241C24H242H243120.0°116.2°
H251C25H252H253120.0°116.5°
C39C38C27H38180.0°177.1°
C38C39C40C2685.0°179.1°
C38C39C40C41178.4°180.0°
C38C39C40H401.6°0.4°
C38C39C26H26190.0°59.1°
C38C39C26H26290.0°178.8°
C38C39C26H26390.0°61.1°
C39C38C27C2890.0°180.0°
C39C38C27H190.0°4.2°
C27C38C39C4096.0°180.0°
C27C38C39C260.0°0.8°
C38C27C28H190.0°175.9°
C38C27C28C2990.0°180.0°
C38C27C28H2890.0°0.5°
H38C38C39C4084.0°2.8°
H38C38C39C26180.0°176.3°
H38C38C27C2890.0°2.9°
H38C38C27H190.0°172.9°
C39C40C41H40180.0°179.6°
C39C40C41C42179.0°180.0°
C39C40C41H411.0°1.7°
C40C39C26H26190.0°121.7°
C40C39C26H26290.0°2.0°
C40C39C26H26390.0°118.2°
C26C39C40C4193.4°0.9°
C26C39C40H4086.6°178.7°
C39C26H261H26290.0°122.7°
C39C26H261H26390.0°121.5°
C39C26H262H26390.0°121.9°
C40C41C42H41180.0°178.2°
C40C41C42C43179.5°179.9°
C40C41C42H420.5°3.3°
H40C40C41C421.0°0.4°
H40C40C41H41179.0°177.9°
C41C42C43H42180.0°176.7°
C41C42C43C500.3°2.5°
C41C42C43C44179.6°180.0°
H41C41C42C430.5°1.7°
H41C41C42H42179.5°174.9°
C42C43C50C44179.8°177.6°
C42C43C44C45173.2°179.9°
C42C43C44H446.8°1.5°
C42C43C50H5018.4°59.2°
C42C43C50H502111.6°178.8°
C42C43C50H503128.4°61.8°
H42C42C43C50179.7°174.2°
H42C42C43C440.4°3.3°
C50C43C44C456.7°2.6°
C50C43C44H44173.3°179.0°
C43C50H501H502120.0°122.6°
C43C50H501H503120.0°122.1°
C43C50H502H503120.0°121.6°
C43C44C45H44180.0°178.6°
C43C44C45H450.5°2.2°
C44C43C50H501171.4°118.4°
C44C43C50H50268.6°1.1°
C44C43C50H50351.4°120.6°
H44C44C45H45179.6°176.4°
H501C50H502H503120.0°116.6°
H261C26H262H26390.0°116.3°
C27C28C29H2890.0°179.4°
C27C28C29C3090.0°0.3°
C27C28C29C3190.0°180.0°
H1C27C28C2990.0°4.1°
H1C27C28H2890.0°176.4°
C28C29C30C3190.0°179.8°
C28C29C30H30190.0°111.3°
C28C29C30H30290.0°9.7°
C28C29C30H30390.0°128.0°
C28C29C31C3290.0°180.0°
C28C29C31H3190.0°3.0°
H28C28C29C3090.0°179.7°
H28C28C29C3190.0°0.5°
C29C30H301H30290.0°123.9°
C29C30H301H30390.0°121.8°
C29C30H302H30390.0°121.2°
C30C29C31C3290.0°0.2°
C30C29C31H3190.0°177.2°
C31C29C30H30190.0°68.9°
C31C29C30H30290.0°170.1°
C31C29C30H30390.0°51.7°
C29C31C32H3190.0°176.9°
C29C31C32C3390.0°179.9°
C29C31C32H3290.0°1.7°
H301C30H302H30390.0°116.2°
C31C32C33H3290.0°178.5°
C31C32C33C3490.0°115.5°
C31C32C33C4790.0°114.4°
C31C32C33H3390.0°0.1°
H31C31C32C3390.0°3.2°
H31C31C32H3290.0°175.2°
C32C33C34C4790.0°127.5°
C32C33C34H3390.0°113.6°
C32C33C47H3390.0°112.3°
C32C33C34C3590.0°55.6°
C32C33C34H34190.0°180.0°
C32C33C34H34290.0°62.9°
C32C33C47C4890.0°180.0°
C32C33C47C4990.0°55.1°
C32C33C47O290.0°63.5°
H32C32C33C3490.0°62.9°
H32C32C33C4790.0°67.1°
H32C32C33H3390.0°178.4°
C34C33C47H3390.0°118.7°
C33C34C35H34190.0°124.2°
C33C34C35H34290.0°120.5°
C33C34H341H34290.0°119.0°
C33C34C35C3690.0°177.8°
C33C34C35H35190.0°60.0°
C33C34C35H35290.0°54.3°
C34C33C47C4890.0°51.0°
C34C33C47C4990.0°73.9°
C34C33C47O290.0°167.5°
C47C33C34C3590.0°176.9°
C47C33C34H34190.0°52.5°
C47C33C34H34290.0°64.6°
C33C47C48C4990.0°127.5°
C33C47C48O290.0°117.1°
C33C47C49O290.0°118.4°
C33C47C48H48190.0°67.7°
C33C47C48H48290.0°172.0°
C33C47C48H48390.0°54.8°
C33C47C49H49190.0°178.7°
C33C47C49H49290.0°64.3°
C33C47C49H49390.0°58.3°
C33C47O2HO290.0°83.7°
H33C33C34C3590.0°58.1°
H33C33C34H34190.0°66.4°
H33C33C34H34290.0°176.6°
H33C33C47C4890.0°67.7°
H33C33C47C4990.0°167.4°
H33C33C47O290.0°48.8°
C35C34H341H34290.0°115.1°
C34C35C36H35190.0°122.3°
C34C35C36H35290.0°124.9°
C34C35H351H35290.0°118.4°
C34C35C36C3790.0°57.7°
C34C35C36C4690.0°67.6°
C34C35C36O190.0°174.9°
H341C34C35C3690.0°53.6°
H341C34C35H35190.0°175.8°
H341C34C35H35290.0°69.9°
H342C34C35C3690.0°61.7°
H342C34C35H35190.0°60.5°
H342C34C35H35290.0°174.8°
C36C35H351H35290.0°115.3°
C35C36C37C4690.0°126.4°
C35C36C37O190.0°116.3°
C35C36C46O190.0°116.6°
C35C36C37H37190.0°54.2°
C35C36C37H37290.0°172.0°
C35C36C37H37390.0°67.3°
C35C36C46H46190.0°171.9°
C35C36C46H46290.0°54.1°
C35C36C46H46390.0°67.4°
C35C36O1HO190.0°40.5°
H351C35C36C3790.0°180.0°
H351C35C36C4690.0°54.7°
H351C35C36O190.0°62.8°
H352C35C36C3790.0°67.1°
H352C35C36C4690.0°167.5°
H352C35C36O190.0°50.0°
C37C36C46O190.0°117.2°
C36C37H371H37290.0°120.5°
C36C37H371H37390.0°123.7°
C36C37H372H37390.0°123.3°
C37C36C46H46190.0°62.0°
C37C36C46H46290.0°179.7°
C37C36C46H46390.0°58.8°
C37C36O1HO190.0°160.7°
C46C36C37H37190.0°179.4°
C46C36C37H37290.0°61.7°
C46C36C37H37390.0°59.0°
C36C46H461H46290.0°120.4°
C36C46H461H46390.0°123.2°
C36C46H462H46390.0°123.6°
C46C36O1HO190.0°80.1°
O1C36C37H37190.0°62.1°
O1C36C37H37290.0°55.6°
O1C36C37H37390.0°176.4°
O1C36C46H46190.0°55.2°
O1C36C46H46290.0°62.5°
O1C36C46H46390.0°176.0°
H371C37H372H37390.0°116.3°
H461C46H462H46390.0°115.9°
C48C47C49O290.0°114.7°
C47C48H481H48290.0°122.2°
C47C48H481H48390.0°123.3°
C47C48H482H48390.0°120.2°
C48C47C49H49190.0°51.8°
C48C47C49H49290.0°168.7°
C48C47C49H49390.0°68.6°
C48C47O2HO290.0°37.1°
C49C47C48H48190.0°59.8°
C49C47C48H48290.0°60.6°
C49C47C48H48390.0°177.7°
C47C49H491H49290.0°120.8°
C47C49H491H49390.0°123.1°
C47C49H492H49390.0°124.6°
C49C47O2HO290.0°153.7°
O2C47C48H48190.0°175.2°
O2C47C48H48290.0°54.9°
O2C47C48H48390.0°62.3°
O2C47C49H49190.0°62.9°
O2C47C49H49290.0°54.1°
O2C47C49H49390.0°176.7°
H481C48H482H48390.0°116.8°
H491C49H492H49390.0°115.3°

249697

PDB entries from 2026-02-25

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