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EIM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1C2sing1.54Å1.56Å
C1C6sing1.51Å1.53Å
C2C3sing1.53Å1.55Å
C3C4sing1.52Å1.51Å
C4C5sing1.50Å1.50Å
C4C10doub1.33Å1.35Å
C5C6sing1.56Å1.54Å
C5C7sing1.53Å1.50Å
C6C9sing1.52Å1.55Å
C6C20sing1.53Å1.56Å
C7C8sing1.55Å1.52Å
C7O31sing1.43Å1.41Å
C8C9sing1.55Å1.56Å
C9C19sing1.53Å1.55Å
C10C11sing1.46Å1.47Å
C11C12doub1.35Å1.36Å
C12C13sing1.52Å1.52Å
C12C17sing1.48Å1.47Å
C13C14sing1.53Å1.54Å
C14C15sing1.53Å1.53Å
C14O22sing1.43Å1.45Å
C15C16sing1.53Å1.52Å
C16C17sing1.52Å1.50Å
C16O21sing1.43Å1.43Å
C17C18doub1.33Å1.33Å
C19C23sing1.53Å1.54Å
C19C24sing1.53Å1.53Å
C24C25sing1.53Å1.53Å
C25C26sing1.53Å1.53Å
C26C27sing1.53Å1.52Å
C27C28sing1.53Å1.51Å
C27C29sing1.53Å1.52Å
C27O30sing1.43Å1.44Å
O31C33sing1.43Å1.41Å
C1H1sing1.09Å1.10Å
C1H1Asing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C2H2Asing1.09Å1.10Å
C3H3sing1.09Å1.10Å
C3H3Asing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
C8H8Asing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C10H10sing1.08Å1.08Å
C11H11sing1.08Å1.08Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C15H15Asing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C18H18sing1.08Å1.08Å
C18H18Asing1.08Å1.08Å
C19H19sing1.09Å1.10Å
C20H20sing1.09Å1.10Å
C20H20Asing1.09Å1.10Å
C20H20Bsing1.09Å1.10Å
O21HO21sing0.97Å0.95Å
O22HO22sing0.97Å0.95Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C23H23Bsing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
C26H26sing1.09Å1.10Å
C26H26Asing1.09Å1.10Å
C28H28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
C28H28Bsing1.09Å1.10Å
C29H29sing1.09Å1.10Å
C29H29Asing1.09Å1.10Å
C29H29Bsing1.09Å1.10Å
O30HO30sing0.97Å0.95Å
C33H33sing1.09Å1.10Å
C33H33Asing1.09Å1.10Å
C33H33Bsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2C1C6113.4°107.5°
C1C2C3114.9°111.8°
C2C1H1108.2°109.9°
C2C1H1A108.2°109.8°
C1C2H2107.7°109.0°
C1C2H2A107.7°109.0°
C1C6C5105.7°107.6°
C1C6C9118.4°118.4°
C1C6C20109.7°109.3°
C6C1H1108.2°109.8°
C6C1H1A108.2°109.8°
C2C3C4111.0°110.7°
C3C2H2107.7°109.0°
C3C2H2A107.7°109.0°
C2C3H3109.0°109.3°
C2C3H3A109.0°109.2°
C3C4C5109.3°115.2°
C3C4C10124.3°122.4°
C4C3H3109.0°109.3°
C4C3H3A108.9°109.2°
C5C4C10126.3°122.4°
C4C5C6111.4°105.5°
C4C5C7131.1°116.7°
C4C5H588.2°110.7°
C4C10C11123.0°120.0°
C4C10H10118.5°120.0°
C6C5C7102.3°101.2°
C5C6C999.7°103.2°
C5C6C20112.6°109.2°
C6C5H5125.5°110.9°
C5C7C8112.2°102.8°
C5C7O31124.5°110.8°
C7C5H5100.2°111.2°
C5C7H7101.2°110.8°
C9C6C20110.2°108.8°
C6C9C8101.6°105.1°
C6C9C19117.7°110.3°
C6C9H9115.0°110.3°
C6C20H20109.5°109.5°
C6C20H20A109.5°109.5°
C6C20H20B109.4°109.4°
C8C7O31120.9°110.7°
C7C8C993.3°106.3°
C8C7H7111.7°110.8°
C7C8H8115.3°110.1°
C7C8H8A115.3°110.1°
C7O31C33111.5°114.0°
O31C7H774.4°110.8°
C8C9C19121.5°110.3°
C9C8H8115.2°110.0°
C9C8H8A115.3°110.1°
C8C9H9110.5°110.3°
C9C19C23111.7°109.4°
C9C19C24115.6°109.5°
C19C9H990.9°110.4°
C9C19H19103.1°109.4°
C10C11C12124.4°120.0°
C11C10H10118.5°120.0°
C10C11H11117.8°120.0°
C11C12C13118.7°121.6°
C11C12C17124.0°121.6°
C12C11H11117.8°120.0°
C13C12C17117.3°116.8°
C12C13C14111.8°108.4°
C12C13H13108.7°109.7°
C12C13H13A108.7°109.6°
C12C17C16117.0°116.5°
C12C17C18121.7°121.6°
C13C14C15111.7°109.8°
C13C14O22111.4°109.4°
C14C13H13108.7°109.7°
C14C13H13A108.7°109.7°
C13C14H14106.7°109.4°
C15C14O22109.6°109.4°
C14C15C16113.7°109.8°
C15C14H14108.5°109.4°
C14C15H15108.1°109.4°
C14C15H15A108.1°109.5°
O22C14H14108.8°109.4°
C14O22HO22109.5°114.0°
C15C16C17111.0°108.3°
C15C16O21106.6°109.7°
C16C15H15108.1°109.4°
C16C15H15A108.1°109.4°
C15C16H16110.8°109.6°
C17C16O21110.6°109.9°
C16C17C18121.4°121.9°
C17C16H16106.7°109.6°
O21C16H16111.2°109.8°
C16O21HO21109.5°114.0°
C17C18H18120.0°120.0°
C17C18H18A120.0°120.0°
C23C19C24108.3°109.5°
C23C19H19111.1°109.5°
C19C23H23109.5°109.5°
C19C23H23A109.4°109.4°
C19C23H23B109.4°109.4°
C19C24C25112.0°109.4°
C24C19H19106.9°109.5°
C19C24H24108.6°109.4°
C19C24H24A108.6°109.5°
C24C25C26106.8°109.4°
C25C24H24108.6°109.5°
C25C24H24A108.6°109.5°
C24C25H25110.3°109.5°
C24C25H25A110.4°109.5°
C25C26C27115.8°109.5°
C26C25H25110.4°109.5°
C26C25H25A110.3°109.4°
C25C26H26107.4°109.5°
C25C26H26A107.4°109.4°
C26C27C28113.1°109.5°
C26C27C29107.2°109.5°
C26C27O30110.6°109.4°
C27C26H26107.4°109.5°
C27C26H26A107.4°109.5°
C28C27C29109.2°109.5°
C28C27O30108.3°109.5°
C27C28H28109.5°109.4°
C27C28H28A109.5°109.4°
C27C28H28B109.4°109.4°
C29C27O30108.2°109.5°
C27C29H29109.5°109.5°
C27C29H29A109.5°109.4°
C27C29H29B109.5°109.5°
C27O30HO30109.5°114.0°
O31C33H33109.5°109.5°
O31C33H33A109.4°109.5°
O31C33H33B109.5°109.5°
H1C1H1A110.7°109.9°
H2C2H2A111.2°108.9°
H3C3H3A110.0°109.2°
H8C8H8A103.1°110.2°
H13C13H13A110.2°109.7°
H15C15H15A110.8°109.3°
H18C18H18A120.0°120.0°
H20C20H20A109.5°109.5°
H20C20H20B109.5°109.5°
H20AC20H20B109.5°109.5°
H23C23H23A109.5°109.5°
H23C23H23B109.5°109.5°
H23AC23H23B109.5°109.5°
H24C24H24A110.3°109.6°
H25C25H25A108.6°109.5°
H26C26H26A111.5°109.4°
H28C28H28A109.5°109.5°
H28C28H28B109.5°109.5°
H28AC28H28B109.5°109.5°
H29C29H29A109.5°109.5°
H29C29H29B109.5°109.5°
H29AC29H29B109.4°109.4°
H33C33H33A109.5°109.5°
H33C33H33B109.5°109.5°
H33AC33H33B109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C2C1C6H1120.0°119.5°
C2C1C6H1A120.0°119.5°
C1C2C3H2120.0°120.6°
C1C2C3H2A120.0°120.6°
C1C2C3C444.2°48.6°
C2C1C6C553.0°68.1°
C2C1C6C9163.6°175.6°
C2C1C6C2068.7°50.4°
C2C1H1H1A118.4°121.0°
C1C2H2H2A117.7°118.8°
C1C2C3H3164.2°168.9°
C1C2C3H3A75.8°71.7°
C6C1C2C345.6°59.1°
C1C6C5C465.5°66.5°
C1C6C5C9123.4°125.9°
C1C6C5C20119.8°118.5°
C1C6C5C7150.6°171.4°
C1C6C9C20127.5°125.5°
C1C6C9C8165.5°148.8°
C1C6C9C1959.2°92.3°
C6C1H1H1A118.4°120.9°
C6C1C2H274.5°61.6°
C6C1C2H2A165.6°179.7°
C1C6C5H538.3°53.4°
C1C6C9H946.1°30.0°
C1C6C20H20180.0°66.1°
C1C6C20H20A60.0°173.9°
C1C6C20H20B60.0°53.9°
C2C3C4H3120.0°120.4°
C2C3C4H3A120.0°120.3°
C2C3C4C553.9°50.2°
C2C3C4C10123.3°129.8°
C3C2C1H174.4°60.4°
C3C2C1H1A165.6°178.5°
C3C2H2H2A117.8°118.9°
C2C3H3H3A119.4°119.4°
C3C4C5C10177.1°180.0°
C3C4C5C667.5°58.2°
C3C4C5C7162.3°169.6°
C3C4C10C111.4°0.0°
C4C3C2H275.8°72.1°
C4C3C2H2A164.2°169.2°
C4C3H3H3A119.3°119.4°
C3C4C5H560.2°61.9°
C3C4C10H10178.6°180.0°
C4C5C6C7144.0°122.0°
C4C5C6H5103.8°119.9°
C4C5C7H596.6°128.3°
C4C5C6C9171.2°167.6°
C4C5C6C2054.3°52.0°
C4C5C7C8127.1°156.2°
C4C5C7O3170.8°85.5°
C5C4C10C11178.1°180.0°
C5C4C3H3173.9°170.6°
C5C4C3H3A66.1°70.1°
C4C5C7H77.9°37.9°
C5C4C10H101.9°0.0°
C10C4C5C6109.7°121.9°
C10C4C5C720.6°10.4°
C4C10C11H10180.0°180.0°
C4C10C11C12155.7°180.0°
C10C4C3H33.3°9.4°
C10C4C3H3A116.7°109.9°
C10C4C5H5122.7°118.1°
C4C10C11H1124.3°0.0°
C6C5C7H5130.0°117.9°
C5C6C9C20118.6°115.8°
C6C5C7C86.3°42.3°
C6C5C7O31155.9°160.6°
C5C6C9C851.6°30.2°
C5C6C9C19173.1°149.1°
C5C6C1H167.0°51.5°
C5C6C1H1A173.0°172.5°
C6C5C7H7125.5°76.0°
C5C6C9H967.8°88.6°
C5C6C20H2062.6°51.4°
C5C6C20H20A177.4°68.7°
C5C6C20H20B57.4°171.3°
C7C5C6C927.2°45.5°
C7C5C6C2089.6°70.0°
C5C7C8O31162.9°118.3°
C5C7C8H7112.8°118.3°
C5C7O31H793.0°123.3°
C5C7C8C936.1°24.2°
C5C7O31C3332.7°150.0°
C5C7C8H883.9°143.4°
C5C7C8H8A156.1°95.0°
C6C9C8C752.2°3.9°
C6C9C8C19133.1°118.9°
C6C9C8H9122.5°118.9°
C6C9C19H9119.1°122.2°
C6C9C19C23142.7°65.8°
C6C9C19C2492.9°174.2°
C9C6C1H143.6°64.9°
C9C6C1H1A76.4°56.1°
C9C6C5H585.0°72.5°
C6C9C8H867.8°115.2°
C6C9C8H8A172.2°123.2°
C6C9C19H1923.3°54.2°
C9C6C20H2047.8°163.3°
C9C6C20H20A72.2°43.3°
C9C6C20H20B167.9°76.8°
C20C6C9C867.0°85.6°
C20C6C9C1968.2°33.3°
C20C6C1H1171.3°169.9°
C20C6C1H1A51.3°69.1°
C20C6C5H5158.1°172.0°
C20C6C9H9173.6°155.5°
C6C20H20H20A120.0°120.0°
C6C20H20H20B120.0°119.9°
C6C20H20AH20B120.0°120.0°
C8C7O31H7106.3°123.3°
C7C8C9H8120.0°119.2°
C7C8C9H8A120.0°119.2°
C7C8C9C19174.7°122.9°
C8C7O31C33166.7°96.7°
C8C7C5H5136.3°75.6°
C7C8H8H8A126.5°121.6°
C7C8C9H970.3°114.9°
O31C7C8C9126.8°142.5°
O31C7C5H525.9°42.8°
O31C7C8H8113.2°98.3°
O31C7C8H8A6.8°23.3°
C7O31C33H33180.0°60.0°
C7O31C33H33A60.0°60.0°
C7O31C33H33B60.0°180.0°
C8C9C19H9114.9°122.2°
C8C9C19C2391.3°178.5°
C8C9C19C2433.2°58.5°
C9C8C7H7148.9°94.1°
C9C8H8H8A126.4°121.6°
C8C9C19H19149.4°61.5°
C9C19C23C24128.4°120.0°
C9C19C23H19114.5°120.0°
C9C19C24H19114.0°120.0°
C9C19C24C25166.5°175.0°
C19C9C8H865.2°3.7°
C19C9C8H8A54.7°117.9°
C9C19C23H23180.0°63.8°
C9C19C23H23A60.0°176.2°
C9C19C23H23B60.0°56.2°
C9C19C24H2446.4°55.0°
C9C19C24H24A73.6°65.0°
C10C11C12H11180.0°180.0°
C10C11C12C13179.4°180.0°
C10C11C12C171.4°0.3°
C11C12C13C17179.3°179.7°
C11C12C13C14137.0°133.4°
C11C12C17C16137.6°136.8°
C11C12C17C1843.6°43.0°
C12C11C10H1024.2°0.0°
C11C12C13H13103.1°13.7°
C11C12C13H13A17.0°106.8°
C12C13C14H13120.0°119.7°
C12C13C14H13A120.0°119.7°
C12C13C14C1548.0°57.7°
C12C13C14O2275.0°177.8°
C13C12C17C1641.6°43.5°
C13C12C17C18137.2°136.7°
C13C12C11H110.6°0.0°
C12C13H13H13A119.1°120.5°
C12C13C14H14166.4°62.4°
C17C12C13C1442.3°46.9°
C12C17C16C1544.6°47.0°
C12C17C16C18178.9°179.8°
C12C17C16O21162.7°72.8°
C17C12C11H11178.6°179.7°
C17C12C13H1377.7°166.6°
C17C12C13H13A162.3°72.9°
C12C17C16H1676.2°166.5°
C12C17C18H18178.8°0.1°
C12C17C18H18A1.2°180.0°
C13C14C15O22124.0°120.1°
C13C14C15H14117.3°120.1°
C13C14O22H14117.3°119.8°
C13C14C15C1654.7°66.2°
C14C13H13H13A119.0°120.6°
C13C14C15H1565.3°173.7°
C13C14C15H15A174.7°53.9°
C13C14O22HO22180.0°60.0°
C15C14O22H14118.6°119.8°
C14C15C16H15120.0°120.1°
C14C15C16H15A120.0°120.2°
C14C15C16C1751.6°57.9°
C14C15C16O21172.1°62.0°
C15C14C13H1372.0°177.4°
C15C14C13H13A168.0°62.0°
C14C15H15H15A118.3°119.9°
C14C15C16H1666.8°177.4°
C15C14O22HO2255.9°179.7°
O22C14C15C1669.2°173.6°
O22C14C13H13165.0°62.5°
O22C14C13H13A45.1°58.1°
O22C14C15H15170.8°53.6°
O22C14C15H15A50.7°66.2°
C15C16C17O21118.1°119.8°
C15C16C17H16120.8°119.5°
C15C16O21H16120.8°120.5°
C15C16C17C18134.2°133.2°
C16C15C14H14172.0°53.8°
C16C15H15H15A118.3°119.8°
C15C16O21HO21180.0°180.0°
C17C16O21H16118.4°120.6°
C17C16C15H1568.4°178.0°
C17C16C15H15A171.5°62.2°
C16C17C18H180.0°179.9°
C16C17C18H18A180.0°0.2°
C17C16O21HO2159.2°61.1°
O21C16C17C1816.1°107.0°
O21C16C15H1552.1°58.1°
O21C16C15H15A67.9°177.8°
C18C17C16H16104.9°13.7°
C17C18H18H18A180.0°179.9°
C23C19C24H19119.8°120.1°
C23C19C24C2567.3°65.0°
C23C19C9H923.6°56.4°
C19C23H23H23A120.0°119.9°
C19C23H23H23B120.0°120.0°
C19C23H23AH23B120.0°120.0°
C23C19C24H24172.7°175.0°
C23C19C24H24A52.7°54.9°
C19C24C25H24120.0°119.9°
C19C24C25H24A120.0°120.0°
C19C24C25C26177.1°180.0°
C24C19C9H9148.1°63.6°
C24C19C23H2351.6°176.3°
C24C19C23H23A68.4°56.3°
C24C19C23H23B171.6°63.7°
C19C24H24H24A118.9°120.0°
C19C24C25H2562.8°60.0°
C19C24C25H25A57.2°60.0°
C24C25C26H25120.0°120.0°
C24C25C26H25A120.0°120.0°
C24C25C26C27165.9°180.0°
C25C24C19H1952.5°55.0°
C25C24H24H24A119.0°120.1°
C24C25H25H25A121.1°120.0°
C24C25C26H2674.2°60.0°
C24C25C26H26A45.9°60.0°
C25C26C27H26120.0°120.1°
C25C26C27H26A120.0°120.0°
C25C26C27C2859.1°175.0°
C25C26C27C29179.5°55.0°
C25C26C27O3062.7°65.0°
C26C25C24H2457.1°60.0°
C26C25C24H24A62.9°60.1°
C26C25H25H25A121.1°120.0°
C25C26H26H26A117.4°120.0°
C26C27C28C29119.3°120.0°
C26C27C28O30123.1°120.0°
C26C27C29O30119.4°120.0°
C27C26C25H2545.9°60.0°
C27C26C25H25A74.1°60.1°
C27C26H26H26A117.4°120.0°
C26C27C28H28180.0°60.0°
C26C27C28H28A60.0°180.0°
C26C27C28H28B60.0°60.0°
C26C27C29H29180.0°60.0°
C26C27C29H29A60.0°180.0°
C26C27C29H29B60.0°60.1°
C26C27O30HO30180.0°60.0°
C28C27C29O30117.7°120.0°
C28C27C26H2660.9°65.0°
C28C27C26H26A179.0°55.0°
C27C28H28H28A120.0°119.9°
C27C28H28H28B120.0°120.0°
C27C28H28AH28B120.0°120.0°
C28C27C29H2957.1°180.0°
C28C27C29H29A62.9°60.0°
C28C27C29H29B177.1°59.9°
C28C27O30HO3055.4°60.0°
C29C27C26H2659.5°175.0°
C29C27C26H26A60.5°65.0°
C29C27C28H2860.7°60.0°
C29C27C28H28A179.3°60.0°
C29C27C28H28B59.3°180.0°
C27C29H29H29A120.0°120.0°
C27C29H29H29B120.0°120.1°
C27C29H29AH29B120.0°120.0°
C29C27O30HO3062.9°180.0°
O30C27C26H26177.3°55.0°
O30C27C26H26A57.3°175.0°
O30C27C28H2856.9°180.0°
O30C27C28H28A63.1°60.0°
O30C27C28H28B177.0°60.0°
O30C27C29H2960.6°60.0°
O30C27C29H29A179.4°60.0°
O30C27C29H29B59.4°180.0°
C33O31C7H760.4°26.6°
O31C33H33H33A120.0°120.0°
O31C33H33H33B120.0°120.0°
O31C33H33AH33B120.0°120.0°
H1C1C2H2165.6°178.9°
H1C1C2H2A45.6°60.2°
H1AC1C2H245.5°57.9°
H1AC1C2H2A74.4°60.8°
H2C2C3H344.2°48.3°
H2C2C3H3A164.2°167.7°
H2AC2C3H375.8°70.4°
H2AC2C3H3A44.2°48.9°
H5C5C7H7104.5°166.1°
H7C7C8H828.9°25.0°
H7C7C8H8A91.1°146.6°
H8C8C9H9169.7°125.9°
H8AC8C9H949.7°4.3°
H9C9C19H1995.8°176.4°
H10C10C11H11155.7°180.0°
H13C13C14H1446.4°57.3°
H13AC13C14H1473.6°177.9°
H14C14C15H1552.0°66.2°
H14C14C15H15A68.0°174.0°
H14C14O22HO2262.7°59.8°
H15C15C16H16173.2°62.5°
H15AC15C16H1653.2°57.2°
H16C16O21HO2159.2°59.5°
H19C19C23H2365.5°56.2°
H19C19C23H23A174.5°63.8°
H19C19C23H23B54.5°176.2°
H19C19C24H2467.6°64.9°
H19C19C24H24A172.4°175.0°
H20C20H20AH20B120.0°120.0°
H23C23H23AH23B120.0°120.1°
H24C24C25H25177.2°180.0°
H24C24C25H25A62.8°59.9°
H24AC24C25H2557.1°59.9°
H24AC24C25H25A177.1°180.0°
H25C25C26H26165.8°180.0°
H25C25C26H26A74.1°60.0°
H25AC25C26H2645.8°60.0°
H25AC25C26H26A165.9°180.0°
H28C28H28AH28B120.0°120.1°
H29C29H29AH29B120.0°120.0°
H33C33H33AH33B120.0°120.0°

248636

PDB entries from 2026-02-04

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