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X81

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1P1sing1.54Å1.58Å
O2P1doub1.55Å1.59Å
P1O3sing1.61Å1.60Å
P1O4sing1.61Å1.60Å
O3H1sing0.97Å0.98Å
O4C1sing1.43Å1.42Å
C1C2sing1.53Å1.54Å
C1H2sing1.09Å1.11Å
C1H3sing1.09Å1.11Å
C2C3sing1.53Å1.53Å
C2O7sing1.45Å1.42Å
C2H4sing1.09Å1.10Å
C3O5sing1.45Å1.41Å
C3H5sing1.09Å1.11Å
C3H6sing1.09Å1.11Å
O5C4sing1.34Å1.35Å
C4O6doub1.21Å1.21Å
C4C5sing1.51Å1.52Å
C5C6sing1.53Å1.54Å
C5H7sing1.09Å1.11Å
C5H8sing1.09Å1.11Å
C6C7sing1.53Å1.54Å
C6H9sing1.09Å1.11Å
C6H10sing1.09Å1.11Å
C7C8sing1.53Å1.54Å
C7H11sing1.09Å1.11Å
C7H12sing1.09Å1.11Å
C8C9sing1.53Å1.54Å
C8H13sing1.09Å1.11Å
C8H14sing1.09Å1.11Å
C9C10sing1.53Å1.54Å
C9H15sing1.09Å1.11Å
C9H16sing1.09Å1.11Å
C10C11sing1.53Å1.54Å
C10H17sing1.09Å1.11Å
C10H18sing1.09Å1.11Å
C11C12sing1.53Å1.51Å
C11H19sing1.09Å1.11Å
C11H20sing1.09Å1.11Å
C12C13sing1.53Å1.35Å
C12H54sing1.09Å1.12Å
C12H21sing1.09Å1.10Å
C13C14sing1.53Å1.51Å
C13H56sing1.09Å1.12Å
C13H22sing1.09Å1.10Å
C14C15sing1.53Å1.54Å
C14H23sing1.09Å1.11Å
C14H24sing1.09Å1.11Å
C15C16sing1.53Å1.54Å
C15H25sing1.09Å1.11Å
C15H26sing1.09Å1.11Å
C16C17sing1.53Å1.54Å
C16H27sing1.09Å1.11Å
C16H28sing1.09Å1.11Å
C17C18sing1.53Å1.54Å
C17H29sing1.09Å1.11Å
C17H30sing1.09Å1.11Å
C18C19sing1.53Å1.54Å
C18H31sing1.09Å1.11Å
C18H32sing1.09Å1.11Å
C19C20sing1.53Å1.53Å
C19H33sing1.09Å1.11Å
C19H34sing1.09Å1.11Å
C20C21sing1.53Å1.54Å
C20H35sing1.09Å1.11Å
C20H36sing1.09Å1.11Å
C21H37sing1.09Å1.11Å
C21H38sing1.09Å1.11Å
C21H39sing1.09Å1.11Å
O7C22sing1.34Å1.35Å
C22O8doub1.21Å1.21Å
C22C23sing1.51Å1.52Å
C23C24sing1.53Å1.54Å
C23H40sing1.09Å1.11Å
C23H41sing1.09Å1.11Å
C24C25sing1.53Å1.54Å
C24H42sing1.09Å1.11Å
C24H43sing1.09Å1.11Å
C25C26sing1.53Å1.54Å
C25H44sing1.09Å1.11Å
C25H45sing1.09Å1.11Å
C26C27sing1.53Å1.54Å
C26H46sing1.09Å1.11Å
C26H47sing1.09Å1.11Å
C27C28sing1.53Å1.54Å
C27H48sing1.09Å1.11Å
C27H49sing1.09Å1.11Å
C28C29sing1.53Å1.54Å
C28H50sing1.09Å1.11Å
C28H51sing1.09Å1.11Å
C29C30sing1.51Å1.54Å
C29H52sing1.09Å1.11Å
C29H53sing1.09Å1.11Å
C30C31doub1.31Å1.54Å
C30H55sing1.08Å1.11Å
C31C32sing1.51Å1.54Å
C31H57sing1.08Å1.11Å
C32C33sing1.53Å1.54Å
C32H58sing1.09Å1.11Å
C32H59sing1.09Å1.11Å
C33C34sing1.53Å1.54Å
C33H60sing1.09Å1.11Å
C33H61sing1.09Å1.11Å
C34C35sing1.53Å1.54Å
C34H62sing1.09Å1.11Å
C34H63sing1.09Å1.11Å
C35C36sing1.53Å1.54Å
C35H64sing1.09Å1.11Å
C35H65sing1.09Å1.11Å
C36C37sing1.53Å1.54Å
C36H66sing1.09Å1.11Å
C36H67sing1.09Å1.11Å
C37C38sing1.53Å1.54Å
C37H68sing1.09Å1.11Å
C37H69sing1.09Å1.11Å
C38C39sing1.53Å1.54Å
C38H70sing1.09Å1.11Å
C38H71sing1.09Å1.11Å
C39H72sing1.09Å1.11Å
C39H73sing1.09Å1.11Å
C39H74sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1P1O291.3°109.5°
O1P1O3113.0°109.5°
O1P1O4112.8°109.5°
O2P1O3114.9°109.5°
O2P1O4117.9°109.4°
O3P1O4106.6°109.5°
P1O3H1107.0°106.8°
P1O4C1120.4°106.8°
O4C1C2111.3°109.5°
O4C1H2108.2°109.5°
O4C1H3108.3°109.4°
C2C1H2111.9°109.5°
C2C1H3111.8°109.5°
C1C2C3119.2°109.4°
C1C2O7112.6°109.5°
C1C2H4103.6°109.5°
H2C1H3105.0°109.4°
C3C2O7113.2°109.4°
C3C2H4103.0°109.5°
C2C3O5109.6°109.5°
C2C3H5112.3°109.5°
C2C3H6112.4°109.5°
O7C2H4102.6°109.5°
C2O7C22132.7°120.0°
O5C3H5108.7°109.4°
O5C3H6108.7°109.5°
C3O5C4127.5°120.0°
H5C3H6105.0°109.5°
O5C4O6120.2°120.0°
O5C4C5115.7°119.9°
O6C4C5124.2°120.0°
C4C5C6113.9°109.4°
C4C5H7109.0°109.5°
C4C5H8109.1°109.5°
C6C5H7109.8°109.4°
C6C5H8109.7°109.4°
C5C6C7113.1°109.5°
C5C6H9109.6°109.5°
C5C6H10109.6°109.5°
H7C5H8104.9°109.5°
C7C6H9109.6°109.5°
C7C6H10109.6°109.5°
C6C7C8113.6°109.5°
C6C7H11109.5°109.5°
C6C7H12109.5°109.5°
H9C6H10105.0°109.5°
C8C7H11109.4°109.5°
C8C7H12109.4°109.4°
C7C8C9114.3°109.5°
C7C8H13109.3°109.5°
C7C8H14109.2°109.5°
H11C7H12104.9°109.5°
C9C8H13109.2°109.4°
C9C8H14109.3°109.5°
C8C9C10110.9°109.5°
C8C9H15110.2°109.4°
C8C9H16110.2°109.5°
H13C8H14105.0°109.5°
C10C9H15110.1°109.5°
C10C9H16110.3°109.5°
C9C10C11114.9°109.5°
C9C10H17109.2°109.4°
C9C10H18109.1°109.4°
H15C9H16104.9°109.5°
C11C10H17109.1°109.5°
C11C10H18109.1°109.5°
C10C11C12114.7°109.5°
C10C11H19109.6°109.5°
C10C11H20109.6°109.5°
H17C10H18105.0°109.5°
C12C11H19108.7°109.5°
C12C11H20108.7°109.4°
C11C12C13124.7°109.4°
C11C12H54106.8°109.4°
C11C12H21123.9°109.5°
H19C11H20105.0°109.5°
C13C12H54106.8°109.5°
C13C12H21111.4°109.5°
C12C13C14124.9°109.5°
C12C13H56106.8°109.5°
C12C13H22111.3°109.5°
H54C12H2151.8°109.5°
C14C13H56106.7°109.5°
C14C13H22123.8°109.4°
C13C14C15112.9°109.5°
C13C14H23109.2°109.4°
C13C14H24109.2°109.4°
H56C13H2251.7°109.5°
C15C14H23110.0°109.5°
C15C14H24110.0°109.5°
C14C15C16111.2°109.5°
C14C15H25110.0°109.5°
C14C15H26110.1°109.5°
H23C14H24105.1°109.5°
C16C15H25110.1°109.4°
C16C15H26110.2°109.5°
C15C16C17112.0°109.5°
C15C16H27110.0°109.5°
C15C16H28109.8°109.5°
H25C15H26105.0°109.5°
C17C16H27109.8°109.4°
C17C16H28109.9°109.5°
C16C17C18113.5°109.5°
C16C17H29109.5°109.4°
C16C17H30109.4°109.5°
H27C16H28105.1°109.4°
C18C17H29109.5°109.5°
C18C17H30109.5°109.5°
C17C18C19115.1°109.5°
C17C18H31109.1°109.5°
C17C18H32109.1°109.5°
H29C17H30105.1°109.4°
C19C18H31109.0°109.4°
C19C18H32109.1°109.5°
C18C19C20114.6°109.5°
C18C19H33109.3°109.4°
C18C19H34109.2°109.5°
H31C18H32105.0°109.5°
C20C19H33109.2°109.5°
C20C19H34109.1°109.5°
C19C20C21111.9°109.5°
C19C20H35110.0°109.4°
C19C20H36110.0°109.5°
H33C19H34105.0°109.5°
C21C20H35109.9°109.5°
C21C20H36109.9°109.5°
C20C21H37110.0°109.5°
C20C21H38110.0°109.5°
C20C21H39110.0°109.5°
H35C20H36104.9°109.5°
H37C21H38108.9°109.4°
H37C21H39109.0°109.5°
H38C21H39108.9°109.5°
O7C22O8120.3°120.0°
O7C22C23118.8°120.0°
O8C22C23120.9°120.1°
C22C23C24113.7°109.4°
C22C23H40109.2°109.5°
C22C23H41109.1°109.5°
C24C23H40109.8°109.5°
C24C23H41109.9°109.4°
C23C24C25114.3°109.5°
C23C24H42109.4°109.5°
C23C24H43109.3°109.5°
H40C23H41104.9°109.5°
C25C24H42109.2°109.5°
C25C24H43109.3°109.4°
C24C25C26113.2°109.5°
C24C25H44109.5°109.5°
C24C25H45109.5°109.4°
H42C24H43105.0°109.5°
C26C25H44109.7°109.5°
C26C25H45109.6°109.5°
C25C26C27113.6°109.5°
C25C26H46109.5°109.5°
C25C26H47109.4°109.5°
H44C25H45105.0°109.5°
C27C26H46109.5°109.4°
C27C26H47109.5°109.5°
C26C27C28112.4°109.4°
C26C27H48109.8°109.5°
C26C27H49109.8°109.5°
H46C26H47105.0°109.5°
C28C27H48109.8°109.4°
C28C27H49109.8°109.5°
C27C28C29113.2°109.4°
C27C28H50109.6°109.5°
C27C28H51109.5°109.5°
H48C27H49105.1°109.5°
C29C28H50109.6°109.4°
C29C28H51109.7°109.5°
C28C29C30115.6°109.5°
C28C29H52108.9°109.5°
C28C29H53108.9°109.5°
H50C28H51105.0°109.5°
C30C29H52109.0°109.4°
C30C29H53109.0°109.5°
C29C30C31115.7°120.0°
C29C30H55108.9°120.0°
H52C29H53105.0°109.5°
C31C30H55108.9°119.9°
C30C31C32113.4°120.0°
C30C31H57109.6°120.0°
C32C31H57109.4°120.0°
C31C32C33114.2°109.5°
C31C32H58109.3°109.4°
C31C32H59109.2°109.5°
C33C32H58109.4°109.4°
C33C32H59109.4°109.5°
C32C33C34113.8°109.5°
C32C33H60109.5°109.4°
C32C33H61109.4°109.5°
H58C32H59104.9°109.5°
C34C33H60109.4°109.5°
C34C33H61109.4°109.5°
C33C34C35112.5°109.4°
C33C34H62109.8°109.4°
C33C34H63109.8°109.5°
H60C33H61105.0°109.5°
C35C34H62109.8°109.5°
C35C34H63109.7°109.5°
C34C35C36111.8°109.5°
C34C35H64109.9°109.5°
C34C35H65110.0°109.5°
H62C34H63105.0°109.5°
C36C35H64109.9°109.5°
C36C35H65110.0°109.4°
C35C36C37111.9°109.5°
C35C36H66110.0°109.5°
C35C36H67110.0°109.5°
H64C35H65105.0°109.5°
C37C36H66110.0°109.5°
C37C36H67109.9°109.5°
C36C37C38113.9°109.5°
C36C37H68109.4°109.4°
C36C37H69109.4°109.5°
H66C36H67104.9°109.4°
C38C37H68109.5°109.5°
C38C37H69109.4°109.5°
C37C38C39113.6°109.4°
C37C38H70109.5°109.5°
C37C38H71109.6°109.5°
H68C37H69104.9°109.5°
C39C38H70109.4°109.5°
C39C38H71109.4°109.4°
C38C39H72110.0°109.5°
C38C39H73110.0°109.5°
C38C39H74110.1°109.5°
H70C38H71105.0°109.5°
H72C39H73108.9°109.5°
H72C39H74109.0°109.5°
H73C39H74108.9°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1P1O2O3116.2°120.0°
O1P1O2O4116.8°120.0°
O1P1O3O4124.4°120.0°
O1P1O3H132.8°60.0°
O1P1O4C152.4°55.0°
O2P1O3O4132.6°119.9°
O2P1O3H170.2°60.1°
O2P1O4C1156.9°65.0°
O3P1O4C172.1°175.1°
O4P1O3H1157.2°180.0°
P1O4C1C2129.1°180.0°
P1O4C1H2107.5°60.0°
P1O4C1H35.8°60.0°
O4C1C2H2121.2°120.1°
O4C1C2H3121.3°120.0°
O4C1H2H3115.6°120.0°
O4C1C2C381.2°55.0°
O4C1C2O755.0°64.9°
O4C1C2H4165.2°175.0°
C2C1H2H3121.5°120.0°
C1C2C3O7136.0°120.0°
C1C2C3H4114.0°120.0°
C1C2O7H4110.8°120.1°
C1C2C3O5110.1°55.0°
C1C2C3H5129.0°65.0°
C1C2C3H610.8°175.0°
C1C2O7C2260.3°90.1°
H2C1C2C3157.6°65.0°
H2C1C2O766.2°175.0°
H2C1C2H444.0°54.9°
H3C1C2C340.1°175.0°
H3C1C2O7176.4°55.0°
H3C1C2H473.5°65.0°
C3C2O7H4110.3°120.0°
C2C3O5H5123.1°120.0°
C2C3O5H6123.2°120.0°
C2C3H5H6122.4°120.0°
C2C3O5C4136.7°180.0°
C3C2O7C22160.7°150.0°
O7C2C3O5113.9°65.0°
O7C2C3H57.0°175.0°
O7C2C3H6125.2°55.0°
C2O7C22O8179.6°0.1°
C2O7C22C230.3°180.0°
H4C2C3O53.9°175.0°
H4C2C3H5117.0°55.0°
H4C2C3H6124.8°65.0°
H4C2O7C2250.5°30.0°
O5C3H5H6116.2°120.0°
C3O5C4O6177.1°0.0°
C3O5C4C53.9°180.0°
H5C3O5C413.6°60.0°
H6C3O5C4100.2°60.0°
O5C4O6C5178.9°180.0°
O5C4C5C6167.4°180.0°
O5C4C5H744.3°60.0°
O5C4C5H869.7°60.0°
O6C4C5C611.6°0.0°
O6C4C5H7134.6°120.0°
O6C4C5H8111.4°120.0°
C4C5C6H7122.6°120.0°
C4C5C6H8122.6°120.0°
C4C5H7H8116.7°120.1°
C4C5C6C7125.7°180.0°
C4C5C6H9111.7°60.0°
C4C5C6H103.0°60.0°
C6C5H7H8117.8°120.0°
C5C6C7H9122.6°120.0°
C5C6C7H10122.7°120.0°
C5C6H9H10117.7°120.0°
C5C6C7C849.6°NaN°
C5C6C7H11172.3°60.0°
C5C6C7H1273.1°60.1°
H7C5C6C7111.7°60.0°
H7C5C6H910.9°60.0°
H7C5C6H10125.7°180.0°
H8C5C6C73.1°60.0°
H8C5C6H9125.7°180.0°
H8C5C6H10119.6°60.0°
C7C6H9H10117.6°120.0°
C6C7C8H11122.7°120.0°
C6C7C8H12122.8°120.0°
C6C7H11H12117.5°120.0°
C6C7C8C959.5°180.0°
C6C7C8H1363.3°60.0°
C6C7C8H14177.7°60.0°
H9C6C7C8172.2°60.0°
H9C6C7H1165.1°60.0°
H9C6C7H1249.5°180.0°
H10C6C7C873.1°60.0°
H10C6C7H1149.6°180.0°
H10C6C7H12164.2°59.9°
C8C7H11H12117.4°120.0°
C7C8C9H13122.8°120.0°
C7C8C9H14122.8°120.1°
C7C8H13H14117.1°120.0°
C7C8C9C10166.9°180.0°
C7C8C9H1544.7°60.0°
C7C8C9H1670.6°59.9°
H11C7C8C963.3°60.0°
H11C7C8H13174.0°180.0°
H11C7C8H1459.6°60.0°
H12C7C8C9177.7°60.0°
H12C7C8H1359.5°60.0°
H12C7C8H1454.9°180.0°
C9C8H13H14117.2°119.9°
C8C9C10H15122.3°120.0°
C8C9C10H16122.4°120.0°
C8C9H15H16118.7°119.9°
C8C9C10C1125.8°179.9°
C8C9C10H17148.8°60.0°
C8C9C10H1897.0°60.0°
H13C8C9C1044.2°60.0°
H13C8C9H1578.0°180.0°
H13C8C9H16166.6°60.1°
H14C8C9C1070.3°60.0°
H14C8C9H15167.5°60.1°
H14C8C9H1652.2°180.0°
C10C9H15H16118.6°120.0°
C9C10C11H17123.0°120.0°
C9C10C11H18122.8°120.0°
C9C10H17H18116.9°119.9°
C9C10C11C12146.5°180.0°
C9C10C11H1990.9°59.9°
C9C10C11H2023.8°60.0°
H15C9C10C11148.1°60.0°
H15C9C10H1789.0°180.0°
H15C9C10H1825.3°60.0°
H16C9C10C1196.6°60.0°
H16C9C10H1726.3°60.0°
H16C9C10H18140.6°180.0°
C11C10H17H18116.8°120.0°
C10C11C12H19123.0°120.0°
C10C11C12H20123.1°120.0°
C10C11H19H20117.7°120.0°
C10C11C12C1365.1°180.0°
C10C11C12H54169.7°60.1°
C10C11C12H21114.8°59.9°
H17C10C11C1290.5°60.0°
H17C10C11H1932.0°179.9°
H17C10C11H20146.8°60.0°
H18C10C11C1223.7°60.1°
H18C10C11H19146.3°60.0°
H18C10C11H2099.0°180.0°
C12C11H19H20116.2°120.0°
C11C12C13H54125.2°119.9°
C11C12C13H21179.9°120.0°
C11C12H54H21120.3°120.0°
C11C12C13C141.5°180.0°
C11C12C13H56123.7°60.1°
C11C12C13H22178.4°60.0°
H19C11C12C1358.0°60.0°
H19C11C12H5467.3°60.0°
H19C11C12H21122.1°180.0°
H20C11C12C13171.8°60.0°
H20C11C12H5446.6°180.0°
H20C11C12H218.3°60.0°
C13C12H54H21104.3°120.0°
C12C13C14H56125.2°120.0°
C12C13C14H22180.0°120.0°
C12C13H56H22104.2°120.1°
C12C13C14C1591.6°180.0°
C12C13C14H2331.2°60.0°
C12C13C14H24145.7°60.0°
H54C12C13C14126.8°60.1°
H54C12C13H561.5°180.0°
H54C12C13H2253.2°59.9°
H21C12C13C14178.4°60.0°
H21C12C13H5656.4°60.0°
H21C12C13H221.7°180.0°
C14C13H56H22120.1°119.9°
C13C14C15H23122.3°120.0°
C13C14C15H24122.3°120.0°
C13C14H23H24117.1°120.0°
C13C14C15C1686.9°180.0°
C13C14C15H25150.8°60.0°
C13C14C15H2635.5°60.0°
H56C13C14C1533.7°60.0°
H56C13C14H23156.4°60.0°
H56C13C14H2489.1°180.0°
H22C13C14C1588.4°60.0°
H22C13C14H23148.9°180.0°
H22C13C14H2434.4°60.0°
C15C14H23H24118.5°120.1°
C14C15C16H25122.3°120.0°
C14C15C16H26122.3°120.0°
C14C15H25H26118.4°120.1°
C14C15C16C1764.1°180.0°
C14C15C16H27173.4°60.0°
C14C15C16H2858.3°60.0°
H23C14C15C16150.8°60.0°
H23C14C15H2528.5°NaN°
H23C14C15H2686.8°60.0°
H24C14C15C1635.4°60.0°
H24C14C15H2586.9°59.9°
H24C14C15H26157.8°180.0°
C16C15H25H26118.6°120.0°
C15C16C17H27122.5°120.0°
C15C16C17H28122.4°120.0°
C15C16H27H28118.1°120.0°
C15C16C17C18104.9°180.0°
C15C16C17H29132.4°60.0°
C15C16C17H3017.8°60.0°
H25C15C16C17173.6°60.0°
H25C15C16H2751.1°180.0°
H25C15C16H2864.0°60.0°
H26C15C16C1758.2°60.0°
H26C15C16H2764.2°60.0°
H26C15C16H28179.4°180.0°
C17C16H27H28118.1°119.9°
C16C17C18H29122.7°120.0°
C16C17C18H30122.6°120.0°
C16C17H29H30117.4°119.9°
C16C17C18C19170.8°180.0°
C16C17C18H3147.9°60.0°
C16C17C18H3266.3°60.0°
H27C16C17C18132.6°60.0°
H27C16C17H299.9°180.0°
H27C16C17H30104.7°60.1°
H28C16C17C1817.5°59.9°
H28C16C17H29105.2°60.1°
H28C16C17H30140.1°180.0°
C18C17H29H30117.5°120.1°
C17C18C19H31122.9°120.0°
C17C18C19H32123.0°120.1°
C17C18H31H32116.8°120.1°
C17C18C19C2031.0°180.0°
C17C18C19H3391.9°60.0°
C17C18C19H34153.7°59.9°
H29C17C18C1948.1°60.1°
H29C17C18H3174.8°180.0°
H29C17C18H32171.0°60.0°
H30C17C18C1966.6°60.0°
H30C17C18H31170.5°60.0°
H30C17C18H3256.3°180.0°
C19C18H31H32116.8°120.0°
C18C19C20H33122.9°120.0°
C18C19C20H34122.8°120.0°
C18C19H33H34117.1°120.0°
C18C19C20C2184.6°179.9°
C18C19C20H3537.9°60.0°
C18C19C20H36153.0°60.0°
H31C18C19C2091.9°60.0°
H31C18C19H33145.2°180.0°
H31C18C19H3430.8°60.0°
H32C18C19C20153.9°59.9°
H32C18C19H3331.1°60.0°
H32C18C19H3483.3°180.0°
C20C19H33H34116.9°120.0°
C19C20C21H35122.5°120.0°
C19C20C21H36122.5°120.0°
C19C20H35H36118.3°120.0°
C19C20C21H37162.2°180.0°
C19C20C21H3877.8°60.0°
C19C20C21H3942.1°60.0°
H33C19C20C2138.3°60.0°
H33C19C20H35160.8°180.0°
H33C19C20H3684.1°60.0°
H34C19C20C21152.6°60.0°
H34C19C20H3585.0°60.0°
H34C19C20H3630.2°180.0°
C21C20H35H36118.1°120.0°
C20C21H37H38120.6°120.0°
C20C21H37H39120.7°120.0°
C20C21H38H39120.6°120.0°
H35C20C21H3739.7°60.0°
H35C20C21H38159.7°60.0°
H35C20C21H3980.4°180.0°
H36C20C21H3775.3°60.0°
H36C20C21H3844.7°NaN°
H36C20C21H39164.6°60.0°
H37C21H38H39118.8°120.0°
O7C22O8C23180.0°179.9°
O7C22C23C24111.1°179.9°
O7C22C23H4011.8°60.1°
O7C22C23H41125.9°60.0°
O8C22C23C2468.9°0.0°
O8C22C23H40168.1°120.0°
O8C22C23H4154.0°119.9°
C22C23C24H40122.6°120.0°
C22C23C24H41122.6°120.0°
C22C23H40H41116.8°120.1°
C22C23C24C25134.9°180.0°
C22C23C24H42102.3°60.0°
C22C23C24H4312.1°60.0°
C24C23H40H41118.0°119.9°
C23C24C25H42122.9°120.0°
C23C24C25H43122.8°120.0°
C23C24H42H43117.2°120.0°
C23C24C25C26121.9°180.0°
C23C24C25H440.8°60.0°
C23C24C25H45115.4°60.0°
H40C23C24C25102.5°60.0°
H40C23C24H4220.3°180.0°
H40C23C24H43134.7°60.0°
H41C23C24C2512.4°60.0°
H41C23C24H42135.2°60.0°
H41C23C24H43110.4°180.0°
C25C24H42H43117.1°120.0°
C24C25C26H44122.6°120.0°
C24C25C26H45122.6°119.9°
C24C25H44H45117.5°120.0°
C24C25C26C2756.2°180.0°
C24C25C26H4666.4°60.0°
C24C25C26H47178.9°60.1°
H42C24C25C261.0°60.0°
H42C24C25H44123.7°180.0°
H42C24C25H45121.7°60.0°
H43C24C25C26115.3°60.0°
H43C24C25H44122.0°60.0°
H43C24C25H457.4°180.0°
C26C25H44H45117.7°120.0°
C25C26C27H46122.7°120.0°
C25C26C27H47122.7°120.0°
C25C26H46H47117.4°120.0°
C25C26C27C2840.1°180.0°
C25C26C27H48162.5°60.0°
C25C26C27H4982.5°60.0°
H44C25C26C2766.4°60.0°
H44C25C26H46170.9°180.0°
H44C25C26H4756.3°60.0°
H45C25C26C27178.9°60.0°
H45C25C26H4656.2°60.0°
H45C25C26H4758.4°180.0°
C27C26H46H47117.5°120.0°
C26C27C28H48122.5°120.0°
C26C27C28H49122.5°120.0°
C26C27H48H49118.0°120.0°
C26C27C28C29175.6°180.0°
C26C27C28H5061.7°60.0°
C26C27C28H5153.0°60.0°
H46C26C27C28162.8°60.0°
H46C26C27H4874.8°180.0°
H46C26C27H4940.2°60.0°
H47C26C27C2882.6°60.0°
H47C26C27H4839.9°60.0°
H47C26C27H49154.9°180.0°
C28C27H48H49118.0°120.0°
C27C28C29H50122.7°120.0°
C27C28C29H51122.5°120.0°
C27C28H50H51117.5°120.0°
C27C28C29C3064.6°180.0°
C27C28C29H52172.4°60.1°
C27C28C29H5358.4°60.0°
H48C27C28C2961.9°60.0°
H48C27C28H5060.8°180.0°
H48C27C28H51175.5°60.0°
H49C27C28C2953.1°60.0°
H49C27C28H50175.8°60.0°
H49C27C28H5169.5°180.0°
C29C28H50H51117.7°120.0°
C28C29C30H52123.0°120.0°
C28C29C30H53123.0°120.0°
C28C29H52H53116.5°120.0°
C28C29C30C3198.9°127.6°
C28C29C30H55138.1°52.4°
H50C28C29C30172.7°60.0°
H50C28C29H5249.7°180.0°
H50C28C29H5364.2°60.0°
H51C28C29C3058.0°60.0°
H51C28C29H5265.1°60.0°
H51C28C29H53179.0°180.0°
C30C29H52H53116.6°120.0°
C29C30C31H55123.1°180.0°
C29C30C31C3259.6°7.6°
C29C30C31H5763.0°172.5°
H52C29C30C3124.1°7.6°
H52C29C30H5598.9°172.4°
H53C29C30C31138.2°112.4°
H53C29C30H5515.1°67.6°
C30C31C32H57122.7°179.9°
C30C31C32C3329.3°126.3°
C30C31C32H5893.6°113.7°
C30C31C32H59152.1°6.2°
H55C30C31C3263.5°172.4°
H55C30C31H57173.9°7.5°
C31C32C33H58122.8°120.0°
C31C32C33H59122.7°120.0°
C31C32H58H59117.0°120.0°
C31C32C33C34168.8°180.0°
C31C32C33H6068.4°60.0°
C31C32C33H6146.2°60.0°
H57C31C32C33152.0°53.6°
H57C31C32H5829.1°66.3°
H57C31C32H5985.1°173.7°
C33C32H58H59117.3°120.0°
C32C33C34H60122.8°120.0°
C32C33C34H61122.7°120.1°
C32C33H60H61117.3°120.0°
C32C33C34C3598.5°180.0°
C32C33C34H62138.9°60.0°
C32C33C34H6324.0°60.0°
H58C32C33C3468.3°60.0°
H58C32C33H6054.5°180.0°
H58C32C33H61169.0°60.0°
H59C32C33C3446.1°60.0°
H59C32C33H60168.9°60.0°
H59C32C33H6176.6°180.0°
C34C33H60H61117.3°120.0°
C33C34C35H62122.5°120.0°
C33C34C35H63122.5°120.0°
C33C34H62H63117.9°120.0°
C33C34C35C36110.8°180.0°
C33C34C35H6411.5°60.0°
C33C34C35H65126.6°60.0°
H60C33C34C35138.6°60.0°
H60C33C34H6216.1°180.0°
H60C33C34H6398.9°60.0°
H61C33C34C3524.2°60.0°
H61C33C34H6298.4°60.0°
H61C33C34H63146.6°180.0°
C35C34H62H63117.9°120.0°
C34C35C36H64122.4°120.0°
C34C35C36H65122.5°120.0°
C34C35H64H65118.3°120.1°
C34C35C36C3758.1°180.0°
C34C35C36H6664.4°59.9°
C34C35C36H67179.5°60.0°
H62C34C35C3611.7°60.0°
H62C34C35H64134.0°180.0°
H62C34C35H65110.8°59.9°
H63C34C35C36126.7°60.1°
H63C34C35H64111.0°59.9°
H63C34C35H654.1°180.0°
C36C35H64H65118.3°120.0°
C35C36C37H66122.5°120.0°
C35C36C37H67122.5°120.0°
C35C36H66H67118.3°120.0°
C35C36C37C38170.5°180.0°
C35C36C37H6847.6°60.0°
C35C36C37H6966.8°60.0°
H64C35C36C3764.3°60.0°
H64C35C36H66173.3°179.9°
H64C35C36H6758.2°60.0°
H65C35C36C37179.4°60.0°
H65C35C36H6658.1°60.0°
H65C35C36H6756.9°180.0°
C37C36H66H67118.1°120.0°
C36C37C38H68122.8°120.0°
C36C37C38H69122.7°120.0°
C36C37H68H69117.2°120.0°
C36C37C38C3927.7°180.0°
C36C37C38H70150.3°60.0°
C36C37C38H7195.0°60.0°
H66C36C37C3848.0°60.0°
H66C36C37H6874.9°180.0°
H66C36C37H69170.7°60.1°
H67C36C37C3867.0°59.9°
H67C36C37H68170.1°60.0°
H67C36C37H6955.7°180.0°
C38C37H68H69117.3°120.0°
C37C38C39H70122.7°120.0°
C37C38C39H71122.8°120.0°
C37C38H70H71117.6°120.1°
C37C38C39H7249.6°60.0°
C37C38C39H7370.3°180.0°
C37C38C39H74169.7°60.0°
H68C37C38C39150.5°60.0°
H68C37C38H7086.9°180.0°
H68C37C38H7127.8°59.9°
H69C37C38C3995.0°60.0°
H69C37C38H7027.6°60.0°
H69C37C38H71142.3°179.9°
C39C38H70H71117.3°120.0°
C38C39H72H73120.5°120.0°
C38C39H72H74120.8°120.0°
C38C39H73H74120.7°120.0°
H70C38C39H72172.2°60.0°
H70C38C39H7352.4°60.0°
H70C38C39H7467.6°180.0°
H71C38C39H7273.3°180.0°
H71C38C39H73166.9°60.0°
H71C38C39H7446.9°60.0°
H72C39H73H74118.8°120.0°

226262

PDB entries from 2024-10-16

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