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9SU

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C26C01sing1.53Å1.51Å
C26C25sing1.53Å1.51Å
C01C02sing1.50Å1.52Å
C25C24sing1.53Å1.51Å
O04C03doub1.22Å1.26Å
C02C03sing1.41Å1.47Å
C02C23doub1.36Å1.34Å
C24C23sing1.51Å1.59Å
C03N05sing1.35Å1.47Å
C23N22sing1.34Å1.40Å
N05C06sing1.36Å1.47Å
N22C06doub1.32Å1.28Å
C06N07sing1.37Å1.47Å
N07C21sing1.47Å1.53Å
N07C08sing1.47Å1.47Å
C21C20sing1.53Å1.55Å
C08C09sing1.53Å1.52Å
C20C10sing1.53Å1.50Å
C09C10sing1.53Å1.50Å
C10C19sing1.53Å1.53Å
C10C11sing1.51Å1.50Å
C19N18sing1.47Å1.50Å
CL1C12sing1.74Å1.82Å
C11C12doub1.38Å1.35ÅAromatic
C11C17sing1.39Å1.40ÅAromatic
C12C14sing1.38Å1.40ÅAromatic
N18C17sing1.40Å1.41Å
C17C16doub1.40Å1.42ÅAromatic
C14C15doub1.38Å1.42ÅAromatic
C16C15sing1.38Å1.43ÅAromatic
C14H1sing1.08Å1.08Å
C15H2sing1.08Å1.08Å
C01H3sing1.09Å1.10Å
C01H4sing1.09Å1.10Å
C08H5sing1.09Å1.10Å
C08H6sing1.09Å1.10Å
C09H7sing1.09Å1.10Å
C09H8sing1.09Å1.10Å
C16H9sing1.08Å1.08Å
C19H10sing1.09Å1.10Å
C20H11sing1.09Å1.10Å
C20H12sing1.09Å1.10Å
C21H13sing1.09Å1.10Å
C21H14sing1.09Å1.10Å
C24H15sing1.09Å1.10Å
C24H16sing1.09Å1.10Å
C25H17sing1.09Å1.10Å
C25H18sing1.09Å1.10Å
C26H19sing1.09Å1.10Å
C26H20sing1.09Å1.10Å
N05H21sing0.97Å1.00Å
C19H22sing1.09Å1.10Å
N18H23sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C26C25109.7°108.3°
C26C01C02113.7°110.6°
C26C01H3108.4°109.3°
C26C01H4108.4°109.2°
C01C26H19109.4°109.7°
C01C26H20109.4°109.7°
C26C25C24109.3°108.4°
C26C25H17109.5°109.7°
C26C25H18109.5°109.7°
C25C26H19109.4°109.7°
C25C26H20109.4°109.7°
C01C02C03119.4°118.1°
C01C02C23121.0°123.0°
C02C01H3108.4°109.2°
C02C01H4108.4°109.2°
C25C24C23114.7°110.6°
C25C24H15108.2°109.3°
C25C24H16108.1°109.3°
C24C25H17109.5°109.7°
C24C25H18109.5°109.7°
O04C03C02127.1°120.4°
O04C03N05114.7°120.5°
C03C02C23119.7°118.9°
C02C03N05118.2°119.1°
C02C23C24120.3°122.7°
C02C23N22121.8°119.6°
C24C23N22117.9°117.7°
C23C24H15108.1°109.2°
C23C24H16108.1°109.2°
C03N05C06114.9°119.5°
C03N05H21122.6°120.3°
C23N22C06121.9°121.9°
N05C06N22123.5°121.0°
N05C06N07112.0°119.5°
C06N05H21122.6°120.2°
N22C06N07124.4°119.5°
C06N07C21127.6°120.6°
C06N07C08120.4°120.6°
C21N07C08111.9°118.8°
N07C21C20116.1°108.8°
N07C21H13107.8°109.6°
N07C21H14107.8°109.7°
N07C08C09114.1°108.7°
N07C08H5108.3°109.7°
N07C08H6108.3°109.7°
C21C20C10116.7°109.4°
C21C20H11107.6°109.4°
C21C20H12107.6°109.5°
C20C21H13107.8°109.6°
C20C21H14107.8°109.6°
C08C09C10115.2°109.4°
C09C08H5108.3°109.6°
C09C08H6108.3°109.6°
C08C09H7108.0°109.5°
C08C09H8108.0°109.5°
C20C10C09105.6°110.6°
C20C10C19117.7°110.3°
C20C10C11111.9°110.4°
C10C20H11107.7°109.5°
C10C20H12107.6°109.5°
C09C10C19101.2°110.2°
C09C10C11116.2°110.3°
C10C09H7108.0°109.5°
C10C09H8108.0°109.5°
C19C10C11104.3°104.9°
C10C19N18106.3°105.1°
C10C19H10110.3°110.3°
C10C19H22110.2°110.3°
C10C11C12132.0°131.2°
C10C11C17109.4°108.3°
C19N18C17107.7°110.1°
N18C19H10110.3°110.3°
N18C19H22110.3°110.4°
C19N18H23109.9°125.0°
CL1C12C11117.0°120.0°
CL1C12C14116.5°119.9°
C12C11C17118.4°120.4°
C11C12C14126.5°120.1°
C11C17N18112.1°111.7°
C11C17C16120.1°119.0°
C12C14C15115.0°119.8°
C12C14H1122.5°120.1°
N18C17C16127.8°129.3°
C17N18H23109.9°125.0°
C17C16C15118.7°120.3°
C17C16H9120.7°119.8°
C14C15C16121.2°120.2°
C15C14H1122.5°120.1°
C14C15H2119.4°119.9°
C16C15H2119.4°119.9°
C15C16H9120.6°119.8°
H3C01H4109.5°109.3°
H5C08H6109.5°109.6°
H7C09H8109.5°109.5°
H10C19H22109.4°110.4°
H11C20H12109.5°109.4°
H13C21H14109.4°109.6°
H15C24H16109.4°109.2°
H17C25H18109.5°109.6°
H19C26H20109.4°109.7°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C26C25H19120.0°119.7°
C01C26C25H20120.1°119.7°
C26C01C02H3120.6°120.3°
C26C01C02H4120.7°120.2°
C01C26C25C2463.6°69.2°
C26C01C02C03158.3°162.3°
C26C01C02C2320.8°17.8°
C26C01H3H4118.1°119.4°
C01C26C25H1756.4°171.0°
C01C26C25H18176.5°50.5°
C01C26H19H20119.9°120.6°
C25C26C01C0253.2°50.6°
C26C25C24H17120.0°119.7°
C26C25C24H18120.0°119.8°
C26C25C24C2342.1°51.0°
C25C26C01H3173.8°69.6°
C25C26C01H467.4°170.9°
C26C25C24H15162.9°69.3°
C26C25C24H1678.7°171.3°
C26C25H17H18120.1°120.6°
C25C26H19H20119.9°120.6°
C01C02C03O041.0°0.5°
C01C02C03C23179.0°179.9°
C01C02C23C240.8°1.0°
C01C02C03N05179.8°179.5°
C01C02C23N22178.9°179.4°
C02C01H3H4118.1°119.5°
C02C01C26H19173.3°170.3°
C02C01C26H2066.8°69.1°
C25C24C23C0210.5°18.0°
C25C24C23H15120.8°120.3°
C25C24C23H16120.8°120.3°
C25C24C23N22169.8°162.4°
C25C24H15H16117.6°119.5°
C24C25H17H18120.1°120.5°
C24C25C26H19176.4°171.1°
C24C25C26H2056.5°50.5°
O04C03C02N05179.1°180.0°
O04C03C02C23179.9°179.6°
O04C03N05C06179.9°180.0°
O04C03N05H210.1°0.0°
C03C02C23C24179.8°179.1°
C03C02C23N220.1°0.5°
C02C03N05C060.8°0.0°
C03C02C01H337.7°77.4°
C03C02C01H481.1°42.1°
C02C03N05H21179.2°180.0°
C02C23C24N22179.7°179.6°
C23C02C03N050.8°0.4°
C02C23N22C061.0°0.3°
C23C02C01H3141.4°102.6°
C23C02C01H499.9°138.0°
C02C23C24H15131.3°102.3°
C02C23C24H16110.3°138.3°
C24C23N22C06179.3°179.3°
C23C24H15H16117.6°119.4°
C23C24C25H1777.9°170.7°
C23C24C25H18162.1°68.8°
C03N05C06H21180.0°180.0°
C03N05C06N220.0°0.2°
C03N05C06N07179.8°179.8°
C23N22C06N050.9°0.1°
C23N22C06N07179.3°179.9°
N22C23C24H1549.0°77.3°
N22C23C24H1669.5°42.1°
N05C06N22N07179.8°180.0°
N05C06N07C212.8°174.4°
N05C06N07C08179.2°5.6°
N22C06N07C21177.0°5.6°
N22C06N07C080.6°174.4°
N22C06N05H21180.0°179.7°
C06N07C21C08176.7°180.0°
C06N07C21C20146.2°126.0°
C06N07C08C09139.2°126.0°
C06N07C08H518.6°114.3°
C06N07C08H6100.1°6.1°
C06N07C21H1392.8°6.2°
C06N07C21H1425.2°114.2°
N07C06N05H210.2°0.2°
N07C21C20H13121.0°119.8°
N07C21C20H14121.0°119.9°
C21N07C08C0943.8°54.1°
N07C21C20C1042.9°53.9°
C21N07C08H5164.5°65.7°
C21N07C08H676.9°173.9°
N07C21C20H11164.0°66.1°
N07C21C20H1278.1°174.0°
N07C21H13H14117.0°120.4°
C08N07C21C2037.1°54.0°
N07C08C09H5120.7°119.8°
N07C08C09H6120.7°119.9°
N07C08C09C1058.2°54.0°
N07C08H5H6117.9°120.5°
N07C08C09H762.7°174.0°
N07C08C09H8179.0°66.0°
C08N07C21H1383.9°173.8°
C08N07C21H14158.1°65.8°
C21C20C10H11121.0°119.9°
C21C20C10H12121.0°120.1°
C21C20C10C0950.1°60.2°
C21C20C10C1961.8°61.9°
C21C20C10C11177.3°177.4°
C21C20H11H12116.7°120.0°
C20C21H13H14117.0°120.2°
C08C09C10C2057.6°60.3°
C08C09C10H7120.8°120.0°
C08C09C10H8120.9°120.0°
C08C09C10C1965.6°61.9°
C08C09C10C11177.8°177.2°
C09C08H5H6117.9°120.3°
C08C09H7H8117.4°120.0°
C20C10C09C19123.2°122.2°
C20C10C09C11124.6°122.5°
C20C10C19C11124.7°118.9°
C20C10C19N18128.2°119.0°
C20C10C11C1252.6°61.1°
C20C10C11C17132.1°118.9°
C20C10C09H763.2°179.7°
C20C10C09H8178.5°59.7°
C20C10C19H10112.3°122.2°
C10C20H11H12116.7°120.1°
C10C20C21H1378.0°173.7°
C10C20C21H14163.9°66.1°
C20C10C19H228.7°0.0°
C09C10C19C11121.0°118.7°
C09C10C19N18117.4°118.6°
C09C10C11C1268.6°61.5°
C09C10C11C17106.7°118.6°
C10C09C08H5178.9°65.8°
C10C09C08H662.5°173.9°
C10C09H7H8117.4°120.1°
C09C10C19H102.1°0.2°
C09C10C20H11171.1°59.7°
C09C10C20H1270.9°179.7°
C09C10C19H22123.1°122.5°
C10C19N18H10119.5°118.9°
C10C19N18H22119.5°118.9°
C19C10C11C12179.0°179.9°
C19C10C11C173.7°0.1°
C10C19N18C172.3°0.0°
C19C10C09H7173.6°58.1°
C19C10C09H855.3°178.1°
C10C19H10H22121.4°122.1°
C19C10C20H1159.2°178.1°
C19C10C20H12177.1°58.1°
C10C19N18H23117.4°179.9°
C11C10C19N183.6°0.1°
C10C11C12CL13.2°0.0°
C10C11C12C17175.0°180.0°
C10C11C12C14178.3°180.0°
C10C11C17N182.5°0.1°
C10C11C17C16179.1°180.0°
C11C10C09H761.4°57.3°
C11C10C09H856.9°62.8°
C11C10C19H10123.1°118.9°
C11C10C20H1161.6°62.7°
C11C10C20H1256.3°57.3°
C11C10C19H22116.0°118.8°
C19N18C17C110.1°0.0°
C19N18C17H23119.7°179.9°
C19N18C17C16178.3°180.0°
N18C19H10H22121.5°122.3°
CL1C12C11C14178.5°180.0°
CL1C12C11C17178.1°179.9°
CL1C12C14C15179.6°180.0°
CL1C12C14H10.4°0.0°
C12C11C17N18178.5°179.9°
C12C11C17C163.1°0.1°
C11C12C14C151.9°0.0°
C11C12C14H1178.1°180.0°
C17C11C12C143.4°0.1°
C11C17N18C16178.2°180.0°
C11C17C16C151.5°0.0°
C11C17C16H9178.5°180.0°
C11C17N18H23119.8°179.9°
C12C14C15H1180.0°180.0°
C12C14C15C160.2°0.1°
C12C14C15H2179.8°180.0°
N18C17C16C15179.7°180.0°
N18C17C16H90.3°0.1°
C17N18C19H10121.8°118.9°
C17N18C19H22117.2°118.8°
C17C16C15C140.1°0.1°
C17C16C15H9180.0°180.0°
C17C16C15H2179.9°180.0°
C16C17N18H2362.0°0.1°
C14C15C16H2180.0°179.9°
C14C15C16H9179.9°179.9°
C16C15C14H1179.9°179.9°
H1C14C15H20.2°0.0°
H2C15C16H90.1°0.0°
H3C01C26H1966.1°50.1°
H3C01C26H2053.8°170.6°
H4C01C26H1952.6°69.4°
H4C01C26H20172.5°51.1°
H5C08C09H758.0°54.2°
H5C08C09H860.3°174.2°
H6C08C09H7176.6°66.1°
H6C08C09H858.3°53.9°
H10C19N18H232.1°61.0°
H11C20C21H1343.0°53.7°
H11C20C21H1475.0°174.0°
H12C20C21H13160.9°66.2°
H12C20C21H1442.9°54.0°
H15C24C25H1742.9°50.4°
H15C24C25H1877.1°170.9°
H16C24C25H17161.4°69.0°
H16C24C25H1841.3°51.5°
H17C25C26H1963.6°51.3°
H17C25C26H20176.5°69.2°
H18C25C26H1956.4°69.2°
H18C25C26H2063.5°170.3°
H22C19N18H23123.0°61.3°

222415

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