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HWL

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C21C22sing1.53Å1.45Å
C21C20sing1.53Å1.53Å
C22C23sing1.53Å1.46Å
C20N1sing1.47Å1.46Å
C23C24sing1.53Å1.52Å
N1C24sing1.47Å1.45Å
N1C19sing1.47Å1.28Å
C19C18sing1.53Å1.54Å
C6C7doub1.38Å1.41ÅAromatic
C6C5sing1.38Å1.39ÅAromatic
C7C8sing1.40Å1.40ÅAromatic
C18O4sing1.45Å1.42Å
O4C17sing1.35Å1.37Å
C5C4doub1.39Å1.43ÅAromatic
C8C17sing1.47Å1.51Å
C8C9doub1.40Å1.42ÅAromatic
C17O3doub1.22Å1.21Å
C4C9sing1.40Å1.36ÅAromatic
C4C3sing1.48Å1.44Å
C9O2sing1.35Å1.36Å
O1C3doub1.22Å1.35Å
C3C2sing1.42Å1.42Å
O2C10sing1.34Å1.33Å
C10C2doub1.36Å1.40Å
C10C11sing1.48Å1.51Å
C2C1sing1.51Å1.53Å
C12C11doub1.40Å1.40ÅAromatic
C12C13sing1.38Å1.40ÅAromatic
C11C16sing1.40Å1.41ÅAromatic
C13C14doub1.38Å1.39ÅAromatic
C16C15doub1.38Å1.39ÅAromatic
C14C15sing1.38Å1.40ÅAromatic
C1H1sing1.09Å1.10Å
C1H2sing1.09Å1.10Å
C1H3sing1.09Å1.10Å
C12H5sing1.08Å1.08Å
C13H6sing1.08Å1.08Å
C14H7sing1.08Å1.08Å
C15H8sing1.08Å1.08Å
C16H9sing1.08Å1.08Å
C18H10sing1.09Å1.10Å
C18H11sing1.09Å1.10Å
C19H12sing1.09Å1.10Å
C19H13sing1.09Å1.10Å
C20H14sing1.09Å1.10Å
C20H15sing1.09Å1.10Å
C21H16sing1.09Å1.10Å
C21H17sing1.09Å1.10Å
C22H18sing1.09Å1.10Å
C22H19sing1.09Å1.10Å
C23H20sing1.09Å1.10Å
C23H21sing1.09Å1.10Å
C24H22sing1.09Å1.10Å
C24H23sing1.09Å1.10Å
C5H24sing1.08Å1.08Å
C6H25sing1.08Å1.08Å
C7H26sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C22C21C20113.2°109.3°
C21C22C23114.2°109.2°
C22C21H16108.5°109.5°
C22C21H17108.6°109.5°
C21C22H18108.3°109.6°
C21C22H19108.3°109.6°
C21C20N1113.3°109.5°
C21C20H14108.5°109.5°
C21C20H15108.5°109.4°
C20C21H16108.5°109.5°
C20C21H17108.5°109.5°
C22C23C24111.4°109.3°
C23C22H18108.3°109.5°
C23C22H19108.3°109.5°
C22C23H20109.0°109.5°
C22C23H21109.0°109.5°
C20N1C24110.1°111.2°
C20N1C19108.5°111.0°
N1C20H14108.5°109.5°
N1C20H15108.5°109.5°
C23C24N1112.4°109.5°
C24C23H20109.0°109.5°
C24C23H21109.0°109.5°
C23C24H22108.7°109.5°
C23C24H23108.7°109.5°
C24N1C19111.1°111.0°
N1C24H22108.8°109.4°
N1C24H23108.7°109.5°
N1C19C18117.8°109.5°
N1C19H12107.4°109.5°
N1C19H13107.4°109.5°
C19C18O4104.9°109.4°
C19C18H10110.6°109.5°
C19C18H11110.6°109.4°
C18C19H12107.4°109.4°
C18C19H13107.3°109.4°
C7C6C5120.3°120.5°
C6C7C8119.9°120.5°
C7C6H25119.9°119.7°
C6C7H26120.1°119.7°
C6C5C4118.5°119.9°
C6C5H24120.8°120.1°
C5C6H25119.9°119.7°
C7C8C17118.9°120.2°
C7C8C9120.2°119.6°
C8C7H26120.0°119.8°
C18O4C17115.5°117.0°
O4C18H10110.6°109.5°
O4C18H11110.6°109.5°
O4C17C8113.2°120.0°
O4C17O3120.7°120.0°
C5C4C9122.0°120.3°
C5C4C3120.9°121.3°
C4C5H24120.8°120.0°
C17C8C9120.9°120.2°
C8C17O3126.1°120.0°
C8C9C4119.1°119.2°
C8C9O2117.6°120.8°
C9C4C3117.0°118.4°
C4C9O2123.2°119.9°
C4C3O1120.7°121.4°
C4C3C2119.3°117.3°
C9O2C10120.6°122.4°
O1C3C2120.0°121.3°
C3C2C10118.0°119.5°
C3C2C1116.1°120.3°
O2C10C2121.7°122.5°
O2C10C11113.0°118.8°
C2C10C11125.0°118.7°
C10C2C1125.9°120.2°
C10C11C12115.0°120.2°
C10C11C16123.5°120.1°
C2C1H1109.5°109.4°
C2C1H2109.5°109.5°
C2C1H3109.5°109.5°
C11C12C13118.9°119.8°
C12C11C16121.4°119.7°
C11C12H5120.5°120.0°
C12C13C14119.8°120.2°
C13C12H5120.6°120.1°
C12C13H6120.1°119.9°
C11C16C15118.4°119.8°
C11C16H9120.8°120.1°
C13C14C15120.7°120.3°
C14C13H6120.1°119.9°
C13C14H7119.7°119.9°
C16C15C14120.6°120.2°
C16C15H8119.7°119.9°
C15C16H9120.8°120.1°
C15C14H7119.6°119.8°
C14C15H8119.7°119.9°
H1C1H2109.5°109.5°
H1C1H3109.5°109.5°
H2C1H3109.5°109.5°
H10C18H11109.5°109.5°
H12C19H13109.4°109.5°
H14C20H15109.5°109.4°
H16C21H17109.5°109.5°
H18C22H19109.4°109.6°
H20C23H21109.5°109.5°
H22C24H23109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C22C21C20H16120.5°120.0°
C22C21C20H17120.6°120.0°
C21C22C23H18120.7°119.9°
C21C22C23H19120.7°119.9°
C22C21C20N148.3°59.2°
C21C22C23C2449.3°57.7°
C22C21C20H14168.8°179.2°
C22C21C20H1572.3°60.9°
C22C21H16H17118.3°120.1°
C21C22H18H19117.9°120.2°
C21C22C23H20169.5°177.6°
C21C22C23H2171.0°62.3°
C20C21C22C2346.1°57.7°
C21C20N1H14120.6°120.0°
C21C20N1H15120.6°120.0°
C21C20N1C2453.5°61.7°
C21C20N1C19175.3°174.1°
C21C20H14H15118.3°119.9°
C20C21H16H17118.3°120.1°
C20C21C22H1874.7°62.2°
C20C21C22H19166.8°177.6°
C22C23C24H20120.3°120.0°
C22C23C24H21120.3°119.9°
C22C23C24N155.4°59.1°
C23C22C21H1674.5°177.6°
C23C22C21H17166.6°62.3°
C23C22H18H19117.8°120.1°
C22C23H20H21119.2°120.1°
C22C23C24H2265.1°60.8°
C22C23C24H23175.8°179.2°
C20N1C24C2357.3°61.7°
C20N1C24C19120.3°124.2°
C20N1C19C18156.5°170.0°
C20N1C19H1235.3°70.0°
C20N1C19H1382.3°50.0°
N1C20H14H15118.2°120.0°
N1C20C21H1672.3°179.1°
N1C20C21H17168.8°60.8°
C20N1C24H2263.1°58.3°
C20N1C24H23177.7°178.2°
C23C24N1H22120.4°120.0°
C23C24N1H23120.4°120.1°
C23C24N1C19177.6°174.1°
C24C23C22H1871.5°62.3°
C24C23C22H19170.0°177.6°
C24C23H20H21119.1°120.1°
C23C24H22H23118.6°120.0°
C24N1C19C1882.2°65.7°
C24N1C19H12156.5°54.2°
C24N1C19H1339.0°174.3°
C24N1C20H14174.1°178.3°
C24N1C20H1567.0°58.3°
N1C24C23H20175.7°179.1°
N1C24C23H2164.9°60.8°
N1C24H22H23118.7°120.0°
N1C19C18H12121.2°120.0°
N1C19C18H13121.2°120.1°
N1C19C18O484.4°65.0°
N1C19C18H10156.3°175.0°
N1C19C18H1134.9°54.9°
N1C19H12H13116.2°120.1°
C19N1C20H1464.1°54.1°
C19N1C20H1554.8°65.9°
C19N1C24H2257.1°65.9°
C19N1C24H2362.0°54.0°
C19C18O4H10119.3°120.0°
C19C18O4H11119.3°119.9°
C19C18O4C17146.7°180.0°
C19C18H10H11122.1°120.0°
C18C19H12H13116.2°119.9°
C7C6C5H25180.0°179.9°
C6C7C8H26180.0°180.0°
C7C6C5C42.2°0.1°
C6C7C8C17176.8°180.0°
C6C7C8C90.2°0.0°
C7C6C5H24177.8°179.9°
C5C6C7C81.8°0.1°
C6C5C4H24180.0°180.0°
C6C5C4C90.5°0.0°
C6C5C4C3178.4°180.0°
C5C6C7H26178.1°179.9°
C7C8C17O416.0°0.1°
C7C8C17C9176.6°180.0°
C7C8C17O3166.4°180.0°
C7C8C9C41.9°0.0°
C7C8C9O2179.4°180.0°
C8C7C6H25178.2°180.0°
C18O4C17C8168.6°180.0°
C18O4C17O313.7°0.1°
O4C18H10H11122.1°120.0°
O4C18C19H1236.8°175.0°
O4C18C19H13154.4°55.1°
O4C17C8O3177.6°179.9°
O4C17C8C9160.6°180.0°
C17O4C18H1094.0°60.0°
C17O4C18H1127.5°60.1°
C5C4C9C81.5°0.0°
C5C4C9C3179.0°180.0°
C5C4C9O2179.8°180.0°
C5C4C3O12.3°0.3°
C5C4C3C2178.6°180.0°
C4C5C6H25177.8°180.0°
C17C8C9C4178.4°180.0°
C17C8C9O22.8°0.0°
C17C8C7H263.2°0.0°
C9C8C17O317.0°0.0°
C8C9C4O2178.7°180.0°
C8C9C4C3179.5°180.0°
C8C9O2C10179.9°180.0°
C9C8C7H26179.8°180.0°
C9C4C3O1178.7°179.7°
C9C4C3C22.4°0.0°
C4C9O2C101.2°0.0°
C9C4C5H24179.5°179.9°
C3C4C9O20.8°0.0°
C4C3O1C2176.3°179.7°
C4C3C2C104.3°0.1°
C4C3C2C1178.3°180.0°
C3C4C5H241.5°0.1°
C9O2C10C23.2°0.0°
C9O2C10C11177.7°180.0°
O1C3C2C10179.4°179.8°
O1C3C2C12.0°0.3°
C3C2C10O24.7°0.1°
C3C2C10C1177.1°180.0°
C3C2C10C11178.5°180.0°
C3C2C1H1180.0°5.2°
C3C2C1H260.0°114.8°
C3C2C1H360.0°125.1°
O2C10C2C11173.8°179.9°
O2C10C2C1178.2°179.9°
O2C10C11C1226.3°127.1°
O2C10C11C16151.4°52.7°
C2C10C11C12147.9°52.9°
C2C10C11C1634.3°127.3°
C10C2C1H12.8°174.9°
C10C2C1H2122.8°65.2°
C10C2C1H3117.2°54.9°
C11C10C2C14.4°0.0°
C10C11C12C16177.8°179.8°
C10C11C12C13179.4°180.0°
C10C11C16C15179.5°179.7°
C10C11C12H50.7°0.0°
C10C11C16H90.5°0.1°
C2C1H1H2120.0°120.0°
C2C1H1H3120.0°120.0°
C2C1H2H3120.0°120.1°
C11C12C13H5180.0°180.0°
C11C12C13C140.3°0.1°
C12C11C16C151.8°0.5°
C11C12C13H6179.7°180.0°
C12C11C16H9178.2°179.7°
C13C12C11C161.5°0.2°
C12C13C14H6180.0°180.0°
C12C13C14C150.6°0.0°
C12C13C14H7179.4°180.0°
C11C16C15H9180.0°179.8°
C11C16C15C140.9°0.5°
C16C11C12H5178.5°179.7°
C11C16C15H8179.1°179.8°
C13C14C15C160.3°0.3°
C13C14C15H7180.0°180.0°
C14C13C12H5179.7°180.0°
C13C14C15H8179.7°180.0°
C16C15C14H8180.0°179.7°
C16C15C14H7179.7°179.7°
C15C14C13H6179.4°180.0°
C14C15C16H9179.1°179.6°
H1C1H2H3120.0°120.0°
H5C12C13H60.3°0.0°
H6C13C14H70.5°0.0°
H7C14C15H80.3°0.1°
H8C15C16H90.9°0.1°
H10C18C19H1282.5°55.0°
H10C18C19H1335.1°65.0°
H11C18C19H12156.1°65.0°
H11C18C19H1386.3°175.0°
H14C20C21H1648.3°60.8°
H14C20C21H1770.6°59.3°
H15C20C21H16167.2°59.1°
H15C20C21H1748.3°179.2°
H16C21C22H18164.8°57.7°
H16C21C22H1946.2°62.5°
H17C21C22H1845.9°177.9°
H17C21C22H1972.7°57.6°
H18C22C23H2048.8°57.7°
H18C22C23H21168.3°177.8°
H19C22C23H2069.7°62.5°
H19C22C23H2149.7°57.7°
H20C23C24H2255.2°59.2°
H20C23C24H2363.9°60.8°
H21C23C24H22174.6°179.2°
H21C23C24H2355.5°59.3°
H24C5C6H252.2°0.0°
H25C6C7H261.9°0.0°

222415

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