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Y9T

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C6C1doub1.39Å1.38ÅAromatic
C6C5sing1.39Å1.38ÅAromatic
F10C7sing1.40Å1.40Å
C1C2sing1.39Å1.39ÅAromatic
C5C4doub1.39Å1.39ÅAromatic
C2C7sing1.51Å1.51Å
C2N3doub1.32Å1.32ÅAromatic
C7F9sing1.40Å1.41Å
C7F8sing1.40Å1.40Å
N3C4sing1.33Å1.34ÅAromatic
C4C11sing1.48Å1.49Å
C11O12doub1.22Å1.21Å
C11N13sing1.35Å1.33Å
N13C14sing1.40Å1.40Å
C30C29sing1.53Å1.54Å
C31C29sing1.53Å1.52Å
C14C19doub1.36Å1.35ÅAromatic
C14C15sing1.40Å1.40ÅAromatic
C29C15sing1.51Å1.50Å
C29O32sing1.43Å1.41Å
C19C18sing1.41Å1.42ÅAromatic
C15C16doub1.36Å1.35ÅAromatic
C18C17sing1.47Å1.47ÅAromatic
C18C22doub1.38Å1.38ÅAromatic
C16C17sing1.41Å1.38ÅAromatic
C17N20doub1.32Å1.32ÅAromatic
C22N21sing1.34Å1.35ÅAromatic
N20N21sing1.40Å1.40ÅAromatic
N21C23sing1.47Å1.45Å
C24C23sing1.53Å1.53Å
C24C25sing1.53Å1.54Å
C26C25sing1.53Å1.55Å
C25O28sing1.43Å1.46Å
C25C27sing1.53Å1.54Å
C5H1sing1.08Å1.08Å
C6H2sing1.08Å1.08Å
C22H3sing1.08Å1.08Å
C24H4sing1.09Å1.10Å
C24H5sing1.09Å1.10Å
C26H6sing1.09Å1.10Å
C26H7sing1.09Å1.10Å
C26H8sing1.09Å1.10Å
C1H9sing1.08Å1.08Å
N13H10sing0.97Å1.00Å
C16H11sing1.08Å1.08Å
C19H12sing1.08Å1.08Å
C23H13sing1.09Å1.10Å
C23H14sing1.09Å1.10Å
C27H15sing1.09Å1.10Å
C27H16sing1.09Å1.10Å
C27H17sing1.09Å1.10Å
O28H18sing0.97Å0.95Å
C30H19sing1.09Å1.10Å
C30H20sing1.09Å1.10Å
C30H21sing1.09Å1.10Å
C31H22sing1.09Å1.10Å
C31H23sing1.09Å1.10Å
C31H24sing1.09Å1.10Å
O32H25sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C1C6C5118.2°118.5°
C6C1C2120.3°119.4°
C1C6H2120.9°120.8°
C6C1H9119.9°120.3°
C6C5C4119.4°119.1°
C6C5H1120.3°120.4°
C5C6H2120.9°120.8°
F10C7C2110.1°109.4°
F10C7F9110.5°109.5°
F10C7F8107.1°109.5°
C1C2C7120.2°119.5°
C1C2N3120.0°120.9°
C2C1H9119.9°120.3°
C5C4N3120.3°120.6°
C5C4C11120.0°119.7°
C4C5H1120.3°120.5°
C7C2N3119.7°119.6°
C2C7F9115.2°109.5°
C2C7F8105.0°109.4°
C2N3C4121.7°121.6°
F9C7F8108.5°109.5°
N3C4C11119.7°119.7°
C4C11O12120.4°119.9°
C4C11N13116.0°120.0°
O12C11N13123.5°120.0°
C11N13C14131.8°120.0°
C11N13H10114.1°120.0°
N13C14C19124.6°119.2°
N13C14C15116.0°119.2°
C14N13H10114.1°120.0°
C30C29C31113.7°109.5°
C30C29C15110.8°109.4°
C30C29O32111.0°109.5°
C29C30H19109.5°109.5°
C29C30H20109.4°109.5°
C29C30H21109.5°109.5°
C31C29C15114.0°109.5°
C31C29O32101.8°109.5°
C29C31H22109.5°109.5°
C29C31H23109.5°109.5°
C29C31H24109.5°109.5°
C19C14C15119.3°121.5°
C14C19C18119.7°119.5°
C14C19H12120.2°120.2°
C14C15C29121.4°119.1°
C14C15C16123.7°121.8°
C15C29O32104.7°109.4°
C29C15C16114.9°119.1°
C29O32H25109.5°114.0°
C19C18C17119.6°118.8°
C19C18C22135.2°134.8°
C18C19H12120.2°120.2°
C15C16C17120.2°119.7°
C15C16H11119.9°120.1°
C17C18C22105.1°106.4°
C18C17C16117.5°118.7°
C18C17N20109.4°106.8°
C18C22N21107.3°107.9°
C18C22H3126.3°126.0°
C16C17N20133.1°134.6°
C17C16H11119.9°120.2°
C17N20N21106.2°109.0°
C22N21N20111.9°109.9°
C22N21C23125.6°125.1°
N21C22H3126.3°126.1°
N20N21C23122.3°125.0°
N21C23C24111.5°109.5°
N21C23H13109.0°109.4°
N21C23H14109.0°109.5°
C23C24C25108.5°109.4°
C23C24H4109.7°109.5°
C23C24H5109.7°109.5°
C24C23H13108.9°109.5°
C24C23H14109.0°109.5°
C24C25C26105.2°109.5°
C24C25O28111.6°109.5°
C24C25C27109.0°109.5°
C25C24H4109.7°109.4°
C25C24H5109.7°109.5°
C26C25O28112.8°109.5°
C26C25C27113.1°109.5°
C25C26H6109.5°109.5°
C25C26H7109.4°109.5°
C25C26H8109.4°109.5°
O28C25C27105.2°109.5°
C25O28H18109.5°114.0°
C25C27H15109.5°109.5°
C25C27H16109.4°109.5°
C25C27H17109.5°109.5°
H4C24H5109.5°109.5°
H6C26H7109.5°109.5°
H6C26H8109.5°109.4°
H7C26H8109.5°109.4°
H13C23H14109.5°109.5°
H15C27H16109.5°109.5°
H15C27H17109.5°109.4°
H16C27H17109.5°109.4°
H19C30H20109.5°109.5°
H19C30H21109.4°109.4°
H20C30H21109.5°109.5°
H22C31H23109.5°109.5°
H22C31H24109.4°109.5°
H23C31H24109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C1C6C5H2180.0°179.9°
C6C1C2H9180.0°180.0°
C1C6C5C41.4°0.0°
C6C1C2C7178.4°180.0°
C6C1C2N30.3°0.0°
C1C6C5H1178.6°180.0°
C5C6C1C21.0°0.0°
C6C5C4H1180.0°180.0°
C6C5C4N31.1°0.0°
C6C5C4C11179.6°180.0°
C5C6C1H9179.0°180.0°
F10C7C2C10.1°150.0°
F10C7C2F9125.7°120.0°
F10C7C2F8115.0°119.9°
F10C7C2N3178.0°30.0°
F10C7F9F8117.1°120.0°
C1C2C7N3178.1°180.0°
C1C2C7F9125.7°90.0°
C1C2C7F8115.0°30.1°
C1C2N3C40.0°0.0°
C2C1C6H2178.9°179.9°
C5C4N3C20.4°0.0°
C5C4N3C11178.5°179.9°
C5C4C11O1227.9°0.1°
C5C4C11N13154.9°180.0°
C4C5C6H2178.6°179.9°
C2C7F9F8117.3°120.0°
C7C2N3C4178.1°180.0°
C7C2C1H91.6°0.0°
N3C2C7F956.2°89.9°
N3C2C7F863.0°150.0°
C2N3C4C11178.9°180.0°
N3C2C1H9179.7°180.0°
N3C4C11O12150.6°180.0°
N3C4C11N1326.6°0.1°
N3C4C5H1178.9°180.0°
C4C11O12N13177.0°179.9°
C4C11N13C14178.3°175.6°
C11C4C5H10.4°0.0°
C4C11N13H101.7°4.4°
O12C11N13C144.6°4.5°
O12C11N13H10175.4°175.5°
C11N13C14H10180.0°179.9°
C11N13C14C1914.3°31.9°
C11N13C14C15170.5°148.1°
N13C14C19C15175.1°180.0°
N13C14C15C293.6°0.2°
N13C14C19C18176.6°180.0°
N13C14C15C16176.3°180.0°
N13C14C19H123.4°0.0°
C30C29C31C15128.3°120.0°
C30C29C31O32119.5°120.0°
C30C29C15C1481.9°53.0°
C30C29C15O32119.8°120.0°
C30C29C15C1698.1°126.8°
C29C30H19H20120.0°120.0°
C29C30H19H21120.0°120.0°
C29C30H20H21120.0°120.0°
C30C29C31H22180.0°169.8°
C30C29C31H2360.0°49.8°
C30C29C31H2460.0°70.2°
C30C29O32H25180.0°60.0°
C31C29C15C1447.9°67.0°
C31C29C15O32110.4°120.0°
C31C29C15C16132.1°113.2°
C31C29C30H19180.0°52.2°
C31C29C30H2060.0°67.8°
C31C29C30H2160.0°172.2°
C29C31H22H23120.0°120.0°
C29C31H22H24120.0°120.1°
C29C31H23H24120.0°120.0°
C31C29O32H2558.6°60.1°
C19C14C15C29179.1°179.7°
C14C19C18H12180.0°180.0°
C19C14C15C160.9°0.0°
C14C19C18C171.2°0.0°
C14C19C18C22179.8°180.0°
C19C14N13H10165.6°148.2°
C14C15C29C16180.0°179.8°
C14C15C29O32158.3°173.0°
C15C14C19C181.5°0.0°
C14C15C16C170.2°0.1°
C15C14N13H109.6°31.8°
C14C15C16H11179.8°179.9°
C15C14C19H12178.4°180.0°
C29C15C16C17179.8°179.7°
C29C15C16H110.2°0.1°
C15C29C30H1950.1°67.8°
C15C29C30H2069.9°172.2°
C15C29C30H21170.1°52.2°
C15C29C31H2251.7°70.2°
C15C29C31H23171.7°169.8°
C15C29C31H2468.3°49.8°
C15C29O32H2560.4°179.9°
O32C29C15C1621.7°6.8°
O32C29C30H1965.9°172.3°
O32C29C30H20174.1°52.3°
O32C29C30H2154.1°67.8°
O32C29C31H2260.5°49.8°
O32C29C31H2359.5°70.2°
O32C29C31H24179.5°169.8°
C19C18C17C22179.3°180.0°
C19C18C17C160.1°0.0°
C19C18C17N20179.5°180.0°
C19C18C22N21178.7°180.0°
C19C18C22H31.3°0.0°
C15C16C17C180.6°0.1°
C15C16C17H11180.0°179.9°
C15C16C17N20179.9°180.0°
C18C17C16N20179.5°179.9°
C17C18C22N210.4°0.1°
C18C17N20N210.7°0.0°
C17C18C22H3179.6°180.0°
C18C17C16H11179.4°179.9°
C17C18C19H12178.8°180.0°
C22C18C17C16179.4°180.0°
C22C18C17N200.2°0.0°
C18C22N21H3180.0°179.9°
C18C22N21N200.9°0.0°
C18C22N21C23176.6°179.9°
C22C18C19H120.2°0.0°
C16C17N20N21178.8°179.9°
C17N20N21C221.0°0.0°
C17N20N21C23176.9°180.0°
N20C17C16H110.1°0.2°
C22N21N20C23175.9°180.0°
C22N21C23C2463.0°125.0°
C22N21C23H13176.7°5.0°
C22N21C23H1457.3°115.0°
N20N21C23C24121.7°55.0°
N20N21C22H3179.1°180.0°
N20N21C23H131.4°175.0°
N20N21C23H14118.0°65.0°
N21C23C24H13120.3°120.0°
N21C23C24H14120.3°120.0°
N21C23C24C25161.5°180.0°
C23N21C22H33.4°0.0°
N21C23C24H478.6°60.0°
N21C23C24H541.7°60.0°
N21C23H13H14119.1°120.0°
C23C24C25H4119.8°120.0°
C23C24C25H5119.9°120.0°
C23C24C25C26163.8°175.0°
C23C24C25O2841.1°65.0°
C23C24C25C2774.7°55.0°
C23C24H4H5120.5°120.0°
C24C23H13H14119.1°120.0°
C24C25C26O28121.9°120.0°
C24C25C26C27118.9°120.0°
C24C25O28C27118.1°120.0°
C25C24H4H5120.5°120.0°
C24C25C26H6180.0°60.0°
C24C25C26H760.0°180.0°
C24C25C26H860.0°60.0°
C25C24C23H1341.2°60.0°
C25C24C23H1478.1°60.0°
C24C25C27H15180.0°60.0°
C24C25C27H1660.0°180.0°
C24C25C27H1760.0°60.0°
C24C25O28H18180.0°179.9°
C26C25O28C27123.7°120.0°
C26C25C24H476.4°65.0°
C26C25C24H543.9°55.0°
C25C26H6H7120.0°120.0°
C25C26H6H8120.0°120.0°
C25C26H7H8120.0°120.0°
C26C25C27H1563.4°180.0°
C26C25C27H16176.6°60.0°
C26C25C27H1756.7°60.0°
C26C25O28H1861.8°59.9°
O28C25C24H4160.9°55.0°
O28C25C24H578.7°175.0°
O28C25C26H658.1°180.0°
O28C25C26H7178.1°60.0°
O28C25C26H861.9°60.0°
O28C25C27H1560.2°60.0°
O28C25C27H1659.8°60.0°
O28C25C27H17179.8°180.0°
C27C25C24H445.1°175.0°
C27C25C24H5165.5°65.0°
C27C25C26H661.1°60.0°
C27C25C26H758.8°60.0°
C27C25C26H8178.9°180.0°
C25C27H15H16120.0°120.1°
C25C27H15H17120.0°120.0°
C25C27H16H17120.0°120.0°
C27C25O28H1861.9°60.0°
H1C5C6H21.4°0.1°
H2C6C1H91.1°0.1°
H4C24C23H13161.1°60.0°
H4C24C23H1441.7°180.0°
H5C24C23H1378.6°180.0°
H5C24C23H14162.0°60.0°
H6C26H7H8120.0°119.9°
H15C27H16H17120.0°119.9°
H19C30H20H21120.0°119.9°
H22C31H23H24120.0°120.0°

222926

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