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0W3

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O0C2sing1.44Å1.44Å
O0C4sing1.44Å1.45Å
C5O1sing1.44Å1.45Å
O1C3sing1.43Å1.44Å
C3C2sing1.53Å1.53Å
C2C6sing1.55Å1.54Å
C2H2sing1.09Å1.10Å
O2C11sing1.43Å1.44Å
O2HO2sing0.97Å0.95Å
C10C3sing1.53Å1.54Å
C3C7sing1.54Å1.54Å
C14O3sing1.43Å1.43Å
O3HO3sing0.97Å0.95Å
C11C4sing1.53Å1.54Å
C4C8sing1.54Å1.53Å
C4C13sing1.53Å1.54Å
C17O4sing1.43Å1.42Å
O4HO4sing0.97Å0.95Å
C12C5sing1.53Å1.55Å
C5C9sing1.55Å1.54Å
C5H5sing1.09Å1.10Å
C26O5doub1.21Å1.34Å
C6C8sing1.55Å1.55Å
C6H6sing1.09Å1.10Å
C6H6Asing1.09Å1.10Å
O6C27doub1.21Å1.22Å
C9C7sing1.55Å1.53Å
C7H7sing1.09Å1.10Å
C7H7Asing1.09Å1.10Å
C42O7doub1.21Å1.26Å
C8H8sing1.09Å1.10Å
C8H8Asing1.09Å1.10Å
C42O8sing1.34Å1.25Å
O8HO8sing0.97Å0.95Å
C9H9sing1.09Å1.10Å
C9H9Asing1.09Å1.10Å
C10H10sing1.09Å1.10Å
C10H10Asing1.09Å1.10Å
C10H10Bsing1.09Å1.10Å
C15C11sing1.53Å1.53Å
C11H11sing1.09Å1.10Å
C14C12sing1.53Å1.54Å
C12H12sing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C13H13Bsing1.09Å1.10Å
C16C14sing1.53Å1.53Å
C14H14sing1.09Å1.10Å
C15H15sing1.09Å1.10Å
C15H15Asing1.09Å1.10Å
C15H15Bsing1.09Å1.10Å
C18C16sing1.53Å1.52Å
C16C17sing1.53Å1.53Å
C16H16sing1.09Å1.10Å
C19C17sing1.53Å1.53Å
C17H17sing1.09Å1.10Å
C18H18sing1.09Å1.10Å
C18H18Asing1.09Å1.10Å
C18H18Bsing1.09Å1.10Å
C21C19sing1.53Å1.54Å
C19C20sing1.51Å1.53Å
C19H19sing1.09Å1.10Å
C22C20doub1.31Å1.37Å
C20H20sing1.08Å1.08Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C21H21Bsing1.09Å1.10Å
C23C22sing1.51Å1.54Å
C22H22sing1.08Å1.08Å
C23C24sing1.53Å1.54Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C28C24sing1.53Å1.53Å
C24C33sing1.53Å1.53Å
C24H24sing1.09Å1.10Å
C28C25sing1.53Å1.54Å
C26C25sing1.51Å1.50Å
C25C34sing1.53Å1.51Å
C25H25sing1.09Å1.10Å
C30C26sing1.51Å1.35Å
C29C27sing1.51Å1.49Å
C27C30sing1.51Å1.48Å
C28H28sing1.09Å1.10Å
C28H28Asing1.09Å1.10Å
C36C29sing1.53Å1.51Å
C29C31sing1.53Å1.53Å
C29H29sing1.09Å1.10Å
C30H30sing1.09Å1.10Å
C30H30Asing1.09Å1.10Å
C31C32sing1.53Å1.51Å
C31H31sing1.09Å1.10Å
C31H31Asing1.09Å1.10Å
C38C32sing1.53Å1.52Å
C32C35sing1.53Å1.52Å
C32H32sing1.09Å1.10Å
C33H33sing1.09Å1.10Å
C33H33Asing1.09Å1.10Å
C33H33Bsing1.09Å1.10Å
C34H34sing1.09Å1.10Å
C34H34Asing1.09Å1.10Å
C34H34Bsing1.09Å1.10Å
C35C37sing1.53Å1.53Å
C35H35sing1.09Å1.10Å
C35H35Asing1.09Å1.10Å
C36H36sing1.09Å1.10Å
C36H36Asing1.09Å1.10Å
C36H36Bsing1.09Å1.10Å
C37C40sing1.53Å1.53Å
C37C39sing1.53Å1.54Å
C37H37sing1.09Å1.10Å
C38H38sing1.09Å1.10Å
C38H38Asing1.09Å1.10Å
C38H38Bsing1.09Å1.10Å
C39C41sing1.53Å1.53Å
C39H39sing1.09Å1.10Å
C39H39Asing1.09Å1.10Å
C40H40sing1.09Å1.10Å
C40H40Asing1.09Å1.10Å
C40H40Bsing1.09Å1.10Å
C41C42sing1.51Å1.51Å
C41H41sing1.09Å1.10Å
C41H41Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C2O0C4109.5°107.0°
O0C2C3111.2°110.6°
O0C2C6108.6°103.5°
O0C2H2106.5°110.6°
O0C4C11101.4°109.9°
O0C4C8106.4°107.3°
O0C4C13115.2°109.9°
C5O1C3112.5°110.0°
O1C5C12112.9°110.3°
O1C5C9106.3°105.2°
O1C5H5108.4°110.3°
O1C3C2116.3°109.9°
O1C3C10109.5°109.9°
O1C3C7105.4°107.6°
C3C2C6118.9°110.6°
C3C2H2105.4°110.7°
C2C3C10103.7°109.8°
C2C3C7107.0°109.8°
C6C2H2105.4°110.6°
C2C6C8102.2°102.1°
C2C6H6111.3°110.9°
C2C6H6A111.2°110.9°
C11O2HO2109.5°114.0°
O2C11C4110.5°109.5°
O2C11C15106.3°109.5°
O2C11H11110.4°109.5°
C10C3C7115.3°109.9°
C3C10H10109.5°109.5°
C3C10H10A109.5°109.5°
C3C10H10B109.5°109.5°
C3C7C9105.2°102.3°
C3C7H7110.5°110.9°
C3C7H7A110.5°110.9°
C14O3HO3109.5°114.0°
O3C14C12107.7°109.5°
O3C14C16106.3°109.5°
O3C14H14110.1°109.5°
C11C4C8112.6°109.8°
C11C4C13112.4°110.0°
C4C11C15111.4°109.4°
C4C11H11109.1°109.5°
C8C4C13108.7°109.9°
C4C8C6103.2°104.2°
C4C8H8111.0°110.5°
C4C8H8A111.0°110.5°
C4C13H13109.5°109.5°
C4C13H13A109.5°109.5°
C4C13H13B109.5°109.4°
C17O4HO4109.5°113.9°
O4C17C16105.3°109.5°
O4C17C19105.3°109.5°
O4C17H17111.1°109.5°
C12C5C9114.4°110.4°
C12C5H5107.3°110.4°
C5C12C14112.6°109.5°
C5C12H12108.7°109.4°
C5C12H12A108.7°109.4°
C9C5H5107.3°110.3°
C5C9C7105.5°100.9°
C5C9H9110.5°111.1°
C5C9H9A110.5°111.2°
O5C26C25118.0°120.0°
O5C26C30122.2°120.0°
C8C6H6111.3°111.0°
C8C6H6A111.2°110.9°
C6C8H8111.0°110.5°
C6C8H8A111.0°110.5°
H6C6H6A109.5°110.8°
O6C27C29121.0°120.0°
O6C27C30123.6°120.0°
C9C7H7110.5°110.8°
C9C7H7A110.5°111.0°
C7C9H9110.5°111.1°
C7C9H9A110.4°111.2°
H7C7H7A109.5°110.7°
O7C42O8122.2°119.9°
O7C42C41120.9°120.0°
H8C8H8A109.5°110.6°
C42O8HO8109.5°117.0°
O8C42C41116.8°120.0°
H9C9H9A109.5°111.0°
H10C10H10A109.5°109.5°
H10C10H10B109.4°109.5°
H10AC10H10B109.5°109.5°
C15C11H11109.2°109.4°
C11C15H15109.5°109.5°
C11C15H15A109.5°109.5°
C11C15H15B109.5°109.5°
C14C12H12108.7°109.5°
C14C12H12A108.7°109.5°
C12C14C16115.1°109.4°
C12C14H14108.7°109.5°
H12C12H12A109.5°109.5°
H13C13H13A109.5°109.5°
H13C13H13B109.4°109.4°
H13AC13H13B109.5°109.5°
C16C14H14108.8°109.4°
C14C16C18108.1°109.5°
C14C16C17113.0°109.4°
C14C16H16108.1°109.5°
H15C15H15A109.4°109.5°
H15C15H15B109.5°109.4°
H15AC15H15B109.4°109.4°
C18C16C17111.2°109.4°
C18C16H16108.2°109.5°
C16C18H18109.5°109.5°
C16C18H18A109.5°109.5°
C16C18H18B109.5°109.5°
C17C16H16108.1°109.5°
C16C17C19115.7°109.5°
C16C17H17109.6°109.5°
C19C17H17109.7°109.5°
C17C19C21111.7°109.5°
C17C19C20113.2°109.5°
C17C19H19107.5°109.5°
H18C18H18A109.5°109.4°
H18C18H18B109.5°109.5°
H18AC18H18B109.5°109.5°
C21C19C20109.4°109.5°
C21C19H19107.4°109.5°
C19C21H21109.5°109.5°
C19C21H21A109.5°109.4°
C19C21H21B109.4°109.5°
C20C19H19107.5°109.4°
C19C20C22123.4°120.0°
C19C20H20118.3°120.0°
C22C20H20118.3°120.0°
C20C22C23129.3°120.0°
C20C22H22115.4°120.1°
H21C21H21A109.5°109.4°
H21C21H21B109.5°109.5°
H21AC21H21B109.5°109.5°
C23C22H22115.3°120.0°
C22C23C24108.9°109.5°
C22C23H23109.6°109.5°
C22C23H23A109.6°109.5°
C24C23H23109.6°109.4°
C24C23H23A109.6°109.4°
C23C24C28118.0°109.5°
C23C24C33108.4°109.5°
C23C24H24107.1°109.4°
H23C23H23A109.5°109.4°
C28C24C33108.5°109.5°
C28C24H24107.1°109.5°
C24C28C25111.2°109.5°
C24C28H28109.0°109.5°
C24C28H28A109.0°109.5°
C33C24H24107.2°109.5°
C24C33H33109.5°109.5°
C24C33H33A109.4°109.5°
C24C33H33B109.5°109.5°
C28C25C26112.6°109.5°
C28C25C34112.7°109.5°
C28C25H25109.2°109.5°
C25C28H28109.0°109.5°
C25C28H28A109.0°109.4°
C26C25C34102.6°109.5°
C26C25H25109.9°109.5°
C25C26C30119.8°120.0°
C34C25H25109.7°109.4°
C25C34H34109.5°109.5°
C25C34H34A109.5°109.4°
C25C34H34B109.5°109.5°
C26C30C27126.1°109.5°
C26C30H30105.1°109.5°
C26C30H30A105.2°109.4°
C29C27C30115.1°120.0°
C27C29C3699.0°109.4°
C27C29C31119.4°109.5°
C27C29H29110.3°109.5°
C27C30H30105.2°109.5°
C27C30H30A105.2°109.5°
H28C28H28A109.5°109.5°
C36C29C31107.6°109.5°
C36C29H29110.0°109.5°
C29C36H36109.5°109.5°
C29C36H36A109.5°109.4°
C29C36H36B109.5°109.5°
C31C29H29109.7°109.5°
C29C31C32116.6°109.4°
C29C31H31107.7°109.5°
C29C31H31A107.6°109.5°
H30C30H30A109.5°109.5°
C32C31H31107.7°109.5°
C32C31H31A107.7°109.5°
C31C32C38114.6°109.5°
C31C32C35105.8°109.5°
C31C32H32108.0°109.5°
H31C31H31A109.5°109.5°
C38C32C35112.4°109.5°
C38C32H32107.8°109.4°
C32C38H38109.5°109.5°
C32C38H38A109.5°109.5°
C32C38H38B109.5°109.5°
C35C32H32107.9°109.5°
C32C35C37105.7°109.5°
C32C35H35110.4°109.5°
C32C35H35A110.4°109.5°
H33C33H33A109.4°109.4°
H33C33H33B109.5°109.5°
H33AC33H33B109.5°109.4°
H34C34H34A109.5°109.5°
H34C34H34B109.5°109.4°
H34AC34H34B109.5°109.5°
C37C35H35110.4°109.5°
C37C35H35A110.4°109.5°
C35C37C40110.6°109.4°
C35C37C39112.1°109.4°
C35C37H37107.3°109.5°
H35C35H35A109.5°109.5°
H36C36H36A109.5°109.5°
H36C36H36B109.5°109.5°
H36AC36H36B109.5°109.5°
C40C37C39112.1°109.5°
C40C37H37107.3°109.5°
C37C40H40109.5°109.5°
C37C40H40A109.5°109.4°
C37C40H40B109.4°109.5°
C39C37H37107.1°109.5°
C37C39C41109.2°109.5°
C37C39H39109.5°109.5°
C37C39H39A109.5°109.5°
H38C38H38A109.4°109.5°
H38C38H38B109.5°109.4°
H38AC38H38B109.5°109.5°
C41C39H39109.6°109.4°
C41C39H39A109.6°109.5°
C39C41C42114.4°109.5°
C39C41H41108.2°109.5°
C39C41H41A108.2°109.5°
H39C39H39A109.5°109.5°
H40C40H40A109.5°109.4°
H40C40H40B109.5°109.5°
H40AC40H40B109.5°109.5°
C42C41H41108.2°109.5°
C42C41H41A108.2°109.5°
H41C41H41A109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O0C2C3O181.9°177.0°
O0C2C3C6127.2°114.1°
O0C2C3H2115.0°123.0°
O0C2C6H2113.7°118.5°
O0C2C3C1038.3°56.1°
O0C2C3C7160.6°64.9°
C2O0C4C11102.0°145.9°
C2O0C4C815.8°26.5°
C2O0C4C13136.4°92.9°
O0C2C6C822.4°37.0°
O0C2C6H6141.3°155.3°
O0C2C6H6A96.4°81.2°
C4O0C2C3137.1°158.5°
C4O0C2C64.5°40.1°
C4O0C2H2108.5°78.4°
O0C4C11O272.8°173.6°
O0C4C11C8113.3°117.8°
O0C4C11C13123.5°121.1°
O0C4C8C13124.6°119.4°
O0C4C8C629.3°2.0°
O0C4C8H8148.3°116.7°
O0C4C8H8A89.7°120.7°
O0C4C11C1545.1°66.4°
O0C4C11H11165.7°53.5°
O0C4C13H13180.0°58.5°
O0C4C13H13A60.0°178.6°
O0C4C13H13B60.0°61.4°
C5O1C3C2100.5°117.8°
C5O1C3C10142.4°121.3°
C5O1C3C717.8°1.7°
O1C5C12C9121.7°115.8°
O1C5C12H5119.4°122.1°
O1C5C9H5115.9°118.9°
O1C5C9C79.5°36.4°
O1C5C9H9128.8°81.5°
O1C5C9H9A109.9°154.4°
O1C5C12C1465.4°66.4°
O1C5C12H1255.0°173.6°
O1C5C12H12A174.1°53.6°
O1C3C2C10120.3°120.9°
O1C3C2C7117.4°118.1°
O1C3C2C645.3°62.9°
O1C3C2H2163.1°60.0°
O1C3C10C7118.7°118.2°
C3O1C5C12131.5°143.4°
C3O1C5C95.4°24.4°
C3O1C5H5109.7°94.5°
O1C3C7C922.8°21.3°
O1C3C7H7142.1°96.8°
O1C3C7H7A96.5°139.8°
O1C3C10H10180.0°66.4°
O1C3C10H10A60.0°173.6°
O1C3C10H10B60.0°53.6°
C3C2C6H2117.8°123.0°
C2C3C10C7116.6°120.9°
C3C2C6C8150.8°155.5°
C3C2C6H690.3°86.2°
C3C2C6H6A32.0°37.3°
C2C3C7C9101.5°140.9°
C2C3C7H717.8°22.7°
C2C3C7H7A139.1°100.7°
C2C3C10H1055.3°172.7°
C2C3C10H10A64.8°52.6°
C2C3C10H10B175.2°67.4°
C6C2C3C10165.5°58.0°
C6C2C3C772.2°179.0°
C2C6C8C430.6°20.9°
C2C6C8H6118.8°118.2°
C2C6C8H6A118.8°118.2°
C2C6H6H6A123.3°123.6°
C2C6C8H8149.6°139.5°
C2C6C8H8A88.3°97.8°
H2C2C3C1076.7°179.0°
H2C2C3C745.6°58.1°
H2C2C6C891.3°81.5°
H2C2C6H627.5°36.7°
H2C2C6H6A149.9°160.3°
O2C11C4C15117.9°120.0°
O2C11C4H11121.5°120.1°
O2C11C4C8173.9°55.8°
O2C11C4C1350.8°65.3°
O2C11C15H11119.1°120.1°
O2C11C15H15180.0°60.0°
O2C11C15H15A60.0°180.0°
O2C11C15H15B60.0°60.0°
HO2O2C11C4180.0°180.0°
HO2O2C11C1559.0°60.0°
HO2O2C11H1159.3°60.0°
C10C3C7C9143.8°98.2°
C10C3C7H796.9°143.6°
C10C3C7H7A24.4°20.2°
C3C10H10H10A120.0°120.0°
C3C10H10H10B120.0°120.0°
C3C10H10AH10B120.0°120.0°
C3C7C9C519.6°34.1°
C3C7C9H7119.3°118.2°
C3C7C9H7A119.3°118.3°
C3C7H7H7A121.9°123.5°
C3C7C9H9138.9°83.7°
C3C7C9H9A99.8°152.0°
C7C3C10H1061.3°51.8°
C7C3C10H10A178.7°68.3°
C7C3C10H10B58.7°171.8°
O3C14C12C514.0°65.0°
O3C14C12C16118.4°120.0°
O3C14C12H14119.3°120.0°
O3C14C12H12106.4°175.0°
O3C14C12H12A134.5°55.0°
O3C14C16H14118.6°120.0°
O3C14C16C18148.3°179.9°
O3C14C16C1724.8°60.0°
O3C14C16H1694.8°60.0°
HO3O3C14C12180.0°60.0°
HO3O3C14C1656.1°60.0°
HO3O3C14H1461.6°180.0°
C11C4C8C13125.2°121.2°
C11C4C8C680.9°121.5°
C11C4C8H838.1°2.8°
C11C4C8H8A160.1°119.9°
C4C11C15H11120.5°120.0°
C11C4C13H1364.6°179.6°
C11C4C13H13A55.4°60.3°
C11C4C13H13B175.4°59.7°
C4C11C15H1559.6°179.9°
C4C11C15H15A60.4°60.0°
C4C11C15H15B179.6°60.0°
C4C8C6H8119.0°118.7°
C4C8C6H8A119.0°118.6°
C4C8C6H6149.5°139.0°
C4C8C6H6A88.2°97.3°
C4C8H8H8A122.9°122.6°
C8C4C11C1568.2°175.8°
C8C4C11H1152.4°64.3°
C8C4C13H1360.7°59.3°
C8C4C13H13A179.3°60.7°
C8C4C13H13B59.3°179.2°
C13C4C8C6153.9°117.4°
C13C4C8H887.1°123.9°
C13C4C8H8A34.9°1.3°
C13C4C11C15168.6°54.7°
C13C4C11H1170.8°174.6°
C4C13H13H13A120.0°120.0°
C4C13H13H13B120.0°119.9°
C4C13H13AH13B120.0°120.0°
O4C17C16C1466.9°54.2°
O4C17C16C18171.4°174.2°
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O4C17C19C21163.5°55.2°
O4C17C19C2072.6°64.8°
O4C17C19H1946.0°175.2°
HO4O4C17C16180.0°60.0°
HO4O4C17C1957.3°60.0°
HO4O4C17H1761.4°180.0°
C12C5C9H5118.8°122.2°
C12C5C9C7115.8°155.3°
C12C5C9H93.6°37.5°
C12C5C9H9A124.8°86.7°
C5C12C14H12120.4°120.0°
C5C12C14H12A120.5°120.0°
C5C12H12H12A118.6°119.9°
C5C12C14C16104.3°175.0°
C5C12C14H14133.3°55.1°
C5C9C7H9119.4°117.8°
C5C9C7H9A119.3°118.0°
C5C9C7H7138.9°84.1°
C5C9C7H7A99.7°152.4°
C5C9H9H9A121.8°124.2°
C9C5C12C1456.3°177.8°
C9C5C12H12176.7°57.8°
C9C5C12H12A64.2°62.1°
H5C5C9C7125.3°82.5°
H5C5C9H9115.3°159.7°
H5C5C9H9A6.0°35.5°
H5C5C12C14175.2°55.7°
H5C5C12H1264.4°64.3°
H5C5C12H12A54.7°175.7°
O5C26C25C28123.8°25.0°
O5C26C25C30178.4°179.9°
O5C26C25C342.3°95.1°
O5C26C25H25114.2°145.0°
O5C26C30C273.0°0.0°
O5C26C30H30125.2°120.0°
O5C26C30H30A119.2°120.1°
C8C6H6H6A123.4°123.7°
C6C8H8H8A122.9°122.6°
H6C6C8H891.5°102.3°
H6C6C8H8A30.5°20.4°
H6AC6C8H830.8°21.4°
H6AC6C8H8A152.9°144.0°
O6C27C30C266.8°0.0°
O6C27C29C30173.8°179.9°
O6C27C29C36160.2°90.0°
O6C27C29C3183.6°30.0°
O6C27C29H2944.9°150.0°
O6C27C30H30115.4°120.0°
O6C27C30H30A129.0°120.0°
C9C7H7H7A122.0°123.7°
C7C9H9H9A121.9°124.3°
H7C7C9H9101.7°158.0°
H7C7C9H9A19.6°33.8°
H7AC7C9H919.6°34.6°
H7AC7C9H9A140.9°89.7°
O7C42O8C41179.9°180.0°
O7C42O8HO80.0°0.1°
O7C42C41C3927.9°0.0°
O7C42C41H4192.8°120.0°
O7C42C41H41A148.7°120.0°
O8C42C41C39152.1°180.0°
O8C42C41H4187.1°60.0°
O8C42C41H41A31.4°60.0°
HO8O8C42C41180.0°180.0°
H10C10H10AH10B120.0°120.0°
C11C15H15H15A120.0°120.1°
C11C15H15H15B120.0°120.0°
C11C15H15AH15B120.0°120.0°
H11C11C15H1560.9°60.1°
H11C11C15H15A179.1°60.0°
H11C11C15H15B59.1°180.0°
C14C12H12H12A118.6°120.1°
C12C14C16H14122.3°120.0°
C12C14C16C1892.6°60.0°
C12C14C16C17143.9°180.0°
C12C14C16H1624.4°60.0°
H12C12C14C16135.2°55.0°
H12C12C14H1412.9°64.9°
H12AC12C14C1616.1°65.0°
H12AC12C14H14106.2°175.0°
H13C13H13AH13B119.9°120.0°
C14C16C18C17124.6°120.0°
C14C16C18H16116.8°120.0°
C14C16C17H16119.5°120.0°
C14C16C17C19177.3°174.1°
C14C16C17H1752.7°65.9°
C14C16C18H18180.0°63.2°
C14C16C18H18A60.0°56.7°
C14C16C18H18B60.0°176.7°
H14C14C16C1829.8°60.0°
H14C14C16C1793.8°60.0°
H14C14C16H16146.7°180.0°
H15C15H15AH15B120.0°120.0°
C18C16C17H16118.7°120.0°
C18C16C17C1955.5°65.8°
C18C16C17H1769.0°54.2°
C16C18H18H18A120.0°119.9°
C16C18H18H18B120.0°120.0°
C16C18H18AH18B120.0°120.0°
C16C17C19H17124.5°120.0°
C17C16C18H1855.4°56.8°
C17C16C18H18A64.6°176.7°
C17C16C18H18B175.4°63.3°
C16C17C19C2147.7°175.2°
C16C17C19C20171.6°55.2°
C16C17C19H1969.8°64.8°
H16C16C17C1963.1°54.2°
H16C16C17H17172.3°174.2°
H16C16C18H1863.2°176.7°
H16C16C18H18A176.8°63.3°
H16C16C18H18B56.8°56.7°
C17C19C21C20126.1°120.0°
C17C19C21H19117.6°120.0°
C17C19C20H19118.5°120.0°
C17C19C20C22174.1°127.4°
C17C19C20H205.9°52.6°
C17C19C21H21180.0°64.6°
C17C19C21H21A60.0°175.4°
C17C19C21H21B60.0°55.4°
H17C17C19C2176.9°64.8°
H17C17C19C2047.1°175.2°
H17C17C19H19165.6°55.2°
H18C18H18AH18B120.0°120.0°
C21C19C20H19116.3°120.0°
C21C19C20C2248.9°112.7°
C21C19C20H20131.1°67.4°
C19C21H21H21A120.0°120.0°
C19C21H21H21B120.0°120.0°
C19C21H21AH21B120.0°120.0°
C19C20C22H20180.0°180.0°
C20C19C21H2153.9°175.4°
C20C19C21H21A66.1°55.4°
C20C19C21H21B173.9°64.6°
C19C20C22C230.2°6.3°
C19C20C22H22179.7°173.7°
H19C19C20C2267.3°7.4°
H19C19C20H20112.7°172.6°
H19C19C21H2162.4°55.4°
H19C19C21H21A177.6°64.6°
H19C19C21H21B57.6°175.4°
C20C22C23H22180.0°180.0°
C20C22C23C2437.2°128.2°
C20C22C23H23157.1°111.8°
C20C22C23H23A82.7°8.2°
H20C20C22C23179.8°173.7°
H20C20C22H220.3°6.3°
H21C21H21AH21B120.0°120.0°
C22C23C24H23119.9°120.1°
C22C23C24H23A119.9°120.0°
C22C23H23H23A120.3°120.1°
C22C23C24C28172.9°175.0°
C22C23C24C3349.2°65.0°
C22C23C24H2466.2°55.0°
H22C22C23C24142.8°51.8°
H22C22C23H2322.9°68.2°
H22C22C23H23A97.3°171.8°
C24C23H23H23A120.3°119.9°
C23C24C28C33123.7°120.0°
C23C24C28H24120.8°120.0°
C23C24C33H24115.4°120.0°
C23C24C28C25151.3°174.0°
C23C24C28H2831.1°65.9°
C23C24C28H28A88.4°54.1°
C23C24C33H33180.0°174.8°
C23C24C33H33A60.0°54.8°
C23C24C33H33B60.0°65.2°
H23C23C24C2853.0°64.9°
H23C23C24C3370.7°55.1°
H23C23C24H24173.9°175.1°
H23AC23C24C2867.2°55.0°
H23AC23C24C33169.1°175.0°
H23AC23C24H2453.7°65.0°
C28C24C33H24115.4°120.0°
C24C28C25H28120.3°120.0°
C24C28C25H28A120.2°120.0°
C24C28C25C2694.8°67.1°
C24C28C25C34149.7°172.8°
C24C28C25H2527.5°52.9°
C24C28H28H28A119.2°120.0°
C28C24C33H3350.8°65.2°
C28C24C33H33A170.8°174.8°
C28C24C33H33B69.2°54.8°
C33C24C28C2527.6°66.0°
C33C24C28H2892.6°54.1°
C33C24C28H28A147.9°174.1°
C24C33H33H33A120.0°120.0°
C24C33H33H33B120.0°120.0°
C24C33H33AH33B120.0°120.0°
H24C24C28C2587.8°54.1°
H24C24C28H28151.9°174.1°
H24C24C28H28A32.4°65.9°
H24C24C33H3364.6°54.8°
H24C24C33H33A55.3°65.2°
H24C24C33H33B175.4°174.8°
C28C25C26C34121.4°120.1°
C28C25C26H25122.0°120.0°
C28C25C34H25121.9°120.0°
C28C25C26C3057.8°155.0°
C25C28H28H28A119.2°119.9°
C28C25C34H34180.0°55.2°
C28C25C34H34A60.0°175.2°
C28C25C34H34B60.0°64.8°
C26C25C34H25116.7°120.0°
C25C26C30C27178.6°180.0°
C26C25C28H28144.9°172.8°
C26C25C28H28A25.4°52.9°
C25C26C30H3056.4°60.0°
C25C26C30H30A59.1°60.0°
C26C25C34H3458.7°64.9°
C26C25C34H34A178.7°55.1°
C26C25C34H34B61.3°175.2°
C34C25C26C30179.3°85.0°
C34C25C28H2829.4°52.8°
C34C25C28H28A90.1°67.2°
C25C34H34H34A120.0°120.0°
C25C34H34H34B120.0°120.0°
C25C34H34AH34B120.0°120.0°
H25C25C26C3064.1°35.0°
H25C25C28H2892.8°67.2°
H25C25C28H28A147.7°172.9°
H25C25C34H3458.1°175.2°
H25C25C34H34A61.9°64.8°
H25C25C34H34B178.1°55.2°
C26C30C27C29179.6°180.0°
C26C30C27H30122.2°120.0°
C26C30C27H30A122.2°120.0°
C26C30H30H30A112.5°120.0°
C27C29C36C31124.9°120.0°
C27C29C36H29115.6°120.0°
C27C29C31H29128.7°120.0°
C29C27C30H3058.2°60.0°
C29C27C30H30A57.4°60.0°
C27C29C31C324.6°177.5°
C27C29C31H31125.6°62.5°
C27C29C31H31A116.4°57.5°
C27C29C36H36180.0°56.5°
C27C29C36H36A60.0°176.5°
C27C29C36H36B60.0°63.5°
C30C27C29C3613.6°90.0°
C30C27C29C31102.6°150.0°
C30C27C29H29128.9°30.0°
C27C30H30H30A112.6°120.0°
C36C29C31H29119.7°120.0°
C36C29C31C32116.2°62.5°
C36C29C31H31122.8°57.5°
C36C29C31H31A4.9°177.5°
C29C36H36H36A120.0°120.0°
C29C36H36H36B120.0°120.0°
C29C36H36AH36B120.0°120.0°
C29C31C32H31121.0°120.0°
C29C31C32H31A121.0°120.0°
C29C31H31H31A116.7°120.0°
C29C31C32C3818.3°177.5°
C29C31C32C35142.7°62.5°
C29C31C32H32102.0°57.5°
C31C29C36H3655.1°63.5°
C31C29C36H36A175.1°56.5°
C31C29C36H36B64.9°176.5°
H29C29C31C32124.1°57.5°
H29C29C31H313.1°177.5°
H29C29C31H31A114.8°62.4°
H29C29C36H3664.4°176.4°
H29C29C36H36A55.6°63.6°
H29C29C36H36B175.6°56.4°
C32C31H31H31A116.8°120.0°
C31C32C38C35120.9°120.0°
C31C32C38H32120.4°120.0°
C31C32C35H32115.4°120.0°
C31C32C35C37108.0°175.0°
C31C32C35H35132.7°65.0°
C31C32C35H35A11.4°55.0°
C31C32C38H38180.0°174.3°
C31C32C38H38A60.0°54.3°
C31C32C38H38B60.0°65.8°
H31C31C32C38102.8°57.5°
H31C31C32C3521.7°177.5°
H31C31C32H32137.0°62.5°
H31AC31C32C38139.3°62.5°
H31AC31C32C3596.3°57.5°
H31AC31C32H3219.0°177.5°
C38C32C35H32118.7°120.0°
C38C32C35C37126.2°65.0°
C38C32C35H356.8°55.0°
C38C32C35H35A114.4°175.0°
C32C38H38H38A120.0°120.0°
C32C38H38H38B120.0°120.0°
C32C38H38AH38B120.0°120.0°
C32C35C37H35119.4°120.0°
C32C35C37H35A119.4°120.0°
C32C35H35H35A121.7°120.0°
C32C35C37C40161.8°65.0°
C32C35C37C3972.3°175.0°
C32C35C37H3745.1°55.0°
C35C32C38H3859.1°65.7°
C35C32C38H38A179.1°174.3°
C35C32C38H38B60.9°54.2°
H32C32C35C377.5°55.0°
H32C32C35H35111.9°175.0°
H32C32C35H35A126.9°65.0°
H32C32C38H3859.6°54.2°
H32C32C38H38A60.4°65.8°
H32C32C38H38B179.6°174.2°
H33C33H33AH33B120.0°120.0°
H34C34H34AH34B120.0°120.0°
C37C35H35H35A121.8°120.0°
C35C37C40C39126.0°119.9°
C35C37C40H37116.7°120.0°
C35C37C39H37117.4°120.0°
C35C37C39C41172.1°175.0°
C35C37C39H3967.9°55.1°
C35C37C39H39A52.2°65.0°
C35C37C40H40180.0°60.1°
C35C37C40H40A60.0°180.0°
C35C37C40H40B60.0°60.0°
H35C35C37C4078.8°175.0°
H35C35C37C3947.1°55.0°
H35C35C37H37164.5°65.0°
H35AC35C37C4042.4°54.9°
H35AC35C37C39168.4°65.0°
H35AC35C37H3774.3°175.0°
H36C36H36AH36B120.0°120.0°
C40C37C39H37117.4°120.1°
C40C37C39C4147.0°65.1°
C40C37C39H39166.9°175.0°
C40C37C39H39A73.0°55.0°
C37C40H40H40A120.0°120.0°
C37C40H40H40B120.0°120.1°
C37C40H40AH40B120.0°120.0°
C37C39C41H39119.9°119.9°
C37C39C41H39A119.9°120.1°
C37C39H39H39A120.1°120.1°
C39C37C40H4054.1°180.0°
C39C37C40H40A65.9°60.0°
C39C37C40H40B174.0°60.0°
C37C39C41C42138.9°180.0°
C37C39C41H41100.4°60.0°
C37C39C41H41A18.2°60.0°
H37C37C39C4170.5°55.0°
H37C37C39H3949.5°64.9°
H37C37C39H39A169.6°175.0°
H37C37C40H4063.3°59.9°
H37C37C40H40A176.7°60.0°
H37C37C40H40B56.7°180.0°
H38C38H38AH38B120.0°119.9°
C41C39H39H39A120.2°120.0°
C39C41C42H41120.7°120.0°
C39C41C42H41A120.8°120.0°
C39C41H41H41A117.8°120.0°
H39C39C41C4219.0°60.0°
H39C39C41H41139.7°179.9°
H39C39C41H41A101.8°60.0°
H39AC39C41C42101.1°60.0°
H39AC39C41H4119.6°60.1°
H39AC39C41H41A138.1°179.9°
H40C40H40AH40B120.0°120.0°
C42C41H41H41A117.7°120.0°

226262

PDB entries from 2024-10-16

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