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FI7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C27C28sing1.53Å1.65Å
C27C26sing1.53Å1.37Å
C28C20sing1.50Å1.44Å
C26C25sing1.53Å1.65Å
C01C02sing1.53Å1.54Å
C20N19sing1.37Å1.47Å
C20C21doub1.33Å1.60Å
N19C17sing1.35Å1.49Å
C25C21sing1.50Å1.43Å
C21C22sing1.42Å1.55Å
C17C02sing1.51Å1.56Å
C17O18doub1.21Å1.19Å
C02C03sing1.53Å1.53Å
C02C04sing1.53Å1.58Å
C22O23doub1.22Å1.26Å
C22O24sing1.35Å1.27Å
O16N15sing1.21Å1.37ÅAromatic
O16C05sing1.34Å1.35ÅAromatic
C04C05sing1.51Å1.58Å
N15C07doub1.31Å1.32ÅAromatic
C05N06doub1.31Å1.32ÅAromatic
C07N06sing1.35Å1.31ÅAromatic
C07C08sing1.48Å1.39Å
C09C08doub1.39Å1.39ÅAromatic
C09C10sing1.38Å1.38ÅAromatic
C08N14sing1.33Å1.32ÅAromatic
C10C11doub1.39Å1.38ÅAromatic
N14C13doub1.32Å1.32ÅAromatic
C11C13sing1.39Å1.39ÅAromatic
C11O12sing1.36Å1.38Å
C10H1sing1.08Å1.08Å
C13H2sing1.08Å1.08Å
C26H5sing1.09Å1.10Å
C26H6sing1.09Å1.10Å
C28H7sing1.09Å1.10Å
C28H8sing1.09Å1.10Å
C01H9sing1.09Å1.10Å
C01H10sing1.09Å1.10Å
C01H11sing1.09Å1.10Å
C03H12sing1.09Å1.10Å
C03H13sing1.09Å1.10Å
C03H14sing1.09Å1.10Å
C04H15sing1.09Å1.10Å
C04H16sing1.09Å1.10Å
C09H17sing1.08Å1.08Å
C25H18sing1.09Å1.10Å
C25H19sing1.09Å1.10Å
C27H20sing1.09Å1.10Å
C27H21sing1.09Å1.10Å
N19H22sing0.97Å1.00Å
O12H23sing0.97Å0.95Å
O24H24sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C28C27C26112.2°108.5°
C27C28C20112.7°110.1°
C27C28H7108.7°109.4°
C27C28H8108.6°109.2°
C28C27H20108.8°109.6°
C28C27H21108.8°109.6°
C27C26C25112.0°108.7°
C27C26H5108.8°109.6°
C27C26H6108.8°109.6°
C26C27H20108.8°109.7°
C26C27H21108.7°109.6°
C28C20N19119.5°118.2°
C28C20C21116.5°123.5°
C20C28H7108.7°109.4°
C20C28H8108.6°109.4°
C26C25C21112.9°110.1°
C25C26H5108.8°109.6°
C25C26H6108.9°109.6°
C26C25H18108.6°109.4°
C26C25H19108.6°109.3°
C01C02C17109.4°109.5°
C01C02C03109.6°109.4°
C01C02C04108.9°109.5°
C02C01H9109.5°109.5°
C02C01H10109.4°109.5°
C02C01H11109.5°109.4°
N19C20C21118.1°118.2°
C20N19C17121.1°120.0°
C20N19H22119.4°120.0°
C20C21C25117.5°123.6°
C20C21C22120.4°118.2°
N19C17C02117.8°120.0°
N19C17O18121.3°120.0°
C17N19H22119.5°120.0°
C25C21C22120.8°118.2°
C21C25H18108.6°109.2°
C21C25H19108.6°109.5°
C21C22O23119.5°120.0°
C21C22O24120.3°120.0°
C02C17O18120.9°120.0°
C17C02C03106.5°109.5°
C17C02C04111.4°109.5°
C03C02C04111.0°109.4°
C02C03H12109.5°109.5°
C02C03H13109.4°109.5°
C02C03H14109.5°109.5°
C02C04C05111.5°109.5°
C02C04H15109.0°109.5°
C02C04H16109.0°109.5°
O23C22O24120.2°120.0°
C22O24H24109.5°114.1°
N15O16C05106.8°110.1°
O16N15C07107.2°110.1°
O16C05C04127.7°126.5°
O16C05N06107.7°107.1°
C04C05N06124.6°126.4°
C05C04H15109.0°109.4°
C05C04H16109.0°109.5°
N15C07N06108.9°107.2°
N15C07C08128.6°126.4°
C05N06C07109.4°105.6°
N06C07C08122.5°126.4°
C07C08C09118.5°119.7°
C07C08N14119.0°119.6°
C08C09C10117.9°119.1°
C09C08N14122.5°120.7°
C08C09H17121.1°120.4°
C09C10C11118.3°118.5°
C09C10H1120.9°120.7°
C10C09H17121.1°120.4°
C08N14C13121.1°121.7°
C10C11C13120.6°119.2°
C10C11O12119.7°120.4°
C11C10H1120.9°120.8°
N14C13C11119.7°120.8°
N14C13H2120.2°119.6°
C13C11O12119.8°120.3°
C11C13H2120.1°119.6°
C11O12H23109.5°114.0°
H5C26H6109.5°109.7°
H7C28H8109.5°109.3°
H9C01H10109.4°109.5°
H9C01H11109.5°109.5°
H10C01H11109.5°109.5°
H12C03H13109.5°109.5°
H12C03H14109.4°109.4°
H13C03H14109.5°109.5°
H15C04H16109.5°109.4°
H18C25H19109.5°109.3°
H20C27H21109.5°109.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C28C27C26H20120.4°119.7°
C28C27C26H21120.4°119.6°
C27C28C20H7120.5°120.2°
C27C28C20H8120.5°120.0°
C28C27C26C2557.4°68.5°
C27C28C20N19169.9°162.6°
C27C28C20C2137.7°17.7°
C28C27C26H5177.8°171.8°
C28C27C26H663.0°51.4°
C27C28H7H8118.5°119.6°
C28C27H20H21118.8°120.4°
C26C27C28C2053.3°50.2°
C27C26C25H5120.4°119.8°
C27C26C25H6120.4°119.8°
C27C26C25C2152.2°49.9°
C27C26H5H6118.8°120.4°
C26C27C28H767.2°70.1°
C26C27C28H8173.8°170.3°
C27C26C25H1868.3°70.1°
C27C26C25H19172.7°170.2°
C26C27H20H21118.7°120.5°
C28C20N19C21151.9°179.7°
C28C20N19C1792.6°59.2°
C28C20C21C2534.4°0.9°
C28C20C21C22132.1°179.0°
C20C28H7H8118.5°119.8°
C20C28C27H2067.1°69.6°
C20C28C27H21173.7°169.8°
C28C20N19H2287.4°120.8°
C26C25C21C2037.1°17.4°
C26C25C21H18120.5°120.1°
C26C25C21H19120.5°120.2°
C26C25C21C22129.4°162.6°
C25C26H5H6118.9°120.4°
C26C25H18H19118.5°119.7°
C25C26C27H2063.0°51.3°
C25C26C27H21177.8°171.9°
C01C02C17N1976.2°60.0°
C01C02C17C03118.3°120.0°
C01C02C17C04120.5°120.0°
C01C02C17O18104.2°120.1°
C01C02C03C04120.4°120.0°
C01C02C04C0560.6°60.0°
C02C01H9H10120.0°120.0°
C02C01H9H11120.0°120.0°
C02C01H10H11120.0°119.9°
C01C02C03H12180.0°180.0°
C01C02C03H1360.0°60.0°
C01C02C03H1460.0°60.0°
C01C02C04H1559.7°180.0°
C01C02C04H16179.1°60.0°
C20N19C17H22180.0°179.9°
N19C20C21C25172.8°179.4°
N19C20C21C2220.7°0.6°
C20N19C17C02179.7°175.5°
C20N19C17O180.1°4.5°
N19C20C28H769.6°77.2°
N19C20C28H849.5°42.6°
C21C20N19C17115.5°120.5°
C20C21C25C22166.5°179.9°
C20C21C22O239.1°5.6°
C20C21C22O24170.6°174.4°
C21C20C28H782.8°102.5°
C21C20C28H8158.1°137.7°
C20C21C25H1883.4°102.8°
C20C21C25H19157.6°137.6°
C21C20N19H2264.5°59.5°
N19C17C02O18179.6°180.0°
N19C17C02C0342.2°60.0°
N19C17C02C04163.4°180.0°
C25C21C22O23175.2°174.4°
C25C21C22O244.6°5.7°
C21C25C26H5172.6°169.7°
C21C25C26H668.2°69.9°
C21C25H18H19118.4°119.8°
C21C22O23O24179.7°180.0°
C22C21C25H18110.1°77.3°
C22C21C25H198.8°42.4°
C21C22O24H24179.7°180.0°
C17C02C03C04121.5°120.0°
C17C02C04C05178.7°180.0°
C17C02C01H9180.0°60.0°
C17C02C01H1060.0°180.0°
C17C02C01H1160.0°60.0°
C17C02C03H1261.8°60.0°
C17C02C03H1358.2°180.0°
C17C02C03H14178.2°60.0°
C17C02C04H1561.0°60.0°
C17C02C04H1658.4°60.0°
C02C17N19H220.3°4.5°
O18C17C02C03137.4°120.0°
O18C17C02C0416.2°0.0°
O18C17N19H22179.9°175.4°
C03C02C04C0560.2°60.0°
C03C02C01H963.6°60.0°
C03C02C01H1056.3°60.0°
C03C02C01H11176.3°180.0°
C02C03H12H13120.0°120.1°
C02C03H12H14120.0°120.0°
C02C03H13H14120.0°120.0°
C03C02C04H15179.5°60.0°
C03C02C04H1660.1°180.0°
C02C04C05O1692.9°90.3°
C02C04C05H15120.3°120.0°
C02C04C05H16120.3°120.0°
C02C04C05N0687.7°90.0°
C04C02C01H958.0°180.0°
C04C02C01H10178.0°60.0°
C04C02C01H1162.0°60.0°
C04C02C03H1259.6°60.1°
C04C02C03H13179.6°60.0°
C04C02C03H1460.4°180.0°
C02C04H15H16119.1°120.0°
O23C22O24H240.0°0.1°
N15O16C05C04179.8°180.0°
N15O16C05N060.3°0.2°
O16N15C07N060.2°0.1°
O16N15C07C08179.4°179.9°
O16C05C04N06179.4°179.7°
C05O16N15C070.1°0.1°
O16C05N06C070.5°0.3°
O16C05C04H1527.5°149.7°
O16C05C04H16146.9°29.7°
C04C05N06C07180.0°180.0°
C05C04H15H16119.1°120.0°
N15C07N06C050.5°0.2°
N15C07N06C08179.7°179.8°
N15C07C08C0966.2°1.0°
N15C07C08N14115.7°179.7°
C05N06C07C08179.2°180.0°
N06C05C04H15151.9°30.0°
N06C05C04H1632.5°150.0°
N06C07C08C09113.4°179.3°
N06C07C08N1464.7°0.0°
C07C08C09N14178.0°179.2°
C07C08C09C10179.1°179.8°
C07C08N14C13179.1°180.0°
C07C08C09H170.9°0.3°
C08C09C10H17180.0°179.9°
C08C09C10C110.5°0.0°
C09C08N14C131.1°0.7°
C08C09C10H1179.5°179.7°
C10C09C08N141.1°0.5°
C09C10C11H1180.0°179.8°
C09C10C11C130.1°0.2°
C09C10C11O12179.8°179.8°
C08N14C13C110.5°0.4°
C08N14C13H2179.5°179.5°
N14C08C09H17179.0°179.6°
C10C11C13N140.1°0.1°
C10C11C13O12179.7°180.0°
C10C11C13H2179.9°180.0°
C11C10C09H17179.6°180.0°
C10C11O12H23180.0°89.9°
N14C13C11H2180.0°179.9°
N14C13C11O12179.8°180.0°
C13C11C10H1179.9°180.0°
C13C11O12H230.3°90.0°
O12C11C10H10.2°0.0°
O12C11C13H20.2°0.0°
H1C10C09H170.4°0.2°
H5C26C25H1852.1°49.7°
H5C26C25H1966.9°70.0°
H5C26C27H2057.4°68.4°
H5C26C27H2161.8°52.2°
H6C26C25H18171.3°170.1°
H6C26C25H1952.3°50.4°
H6C26C27H20176.6°171.1°
H6C26C27H2157.4°68.3°
H7C28C27H20172.4°170.1°
H7C28C27H2153.2°49.6°
H8C28C27H2053.4°50.5°
H8C28C27H2165.8°70.1°
H9C01H10H11120.0°120.1°
H12C03H13H14120.0°119.9°

224931

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