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9M2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
FC13sing1.35Å1.39Å
C13C14doub1.38Å1.41ÅAromatic
C13C12sing1.39Å1.38ÅAromatic
C14C15sing1.39Å1.38ÅAromatic
C23C22sing1.51Å1.50Å
C12C11doub1.38Å1.39ÅAromatic
C16C17sing1.53Å1.56Å
C16Osing1.43Å1.49Å
C15Osing1.36Å1.35Å
C15C10doub1.40Å1.47ÅAromatic
C11C10sing1.39Å1.43ÅAromatic
C22N4doub1.31Å1.31ÅAromatic
C22C18sing1.40Å1.49ÅAromatic
C17C18sing1.51Å1.47Å
C10C7sing1.48Å1.45Å
N4N3sing1.40Å1.40ÅAromatic
C18C19doub1.35Å1.46ÅAromatic
N3C19sing1.35Å1.34ÅAromatic
N3C21sing1.47Å1.46Å
C7C8doub1.38Å1.42ÅAromatic
C7C6sing1.41Å1.42ÅAromatic
C19C20sing1.51Å1.50Å
C8C9sing1.41Å1.42ÅAromatic
C6C5doub1.35Å1.41ÅAromatic
CNsing1.47Å1.47Å
C9C3doub1.38Å1.51ÅAromatic
C9C4sing1.47Å1.41ÅAromatic
NC2sing1.47Å1.50Å
NC1sing1.47Å1.53Å
C5C4sing1.41Å1.40ÅAromatic
C2C3sing1.51Å1.51Å
C3N1sing1.34Å1.30ÅAromatic
C4N2doub1.32Å1.37ÅAromatic
N1N2sing1.40Å1.39ÅAromatic
C12H1sing1.08Å1.08Å
C8H2sing1.08Å1.08Å
C11H3sing1.08Å1.08Å
C6H4sing1.08Å1.08Å
N1H5sing0.97Å1.00Å
C5H6sing1.08Å1.08Å
C14H7sing1.08Å1.08Å
C2H8sing1.09Å1.10Å
C2H9sing1.09Å1.10Å
C1H11sing1.09Å1.10Å
C1H12sing1.09Å1.10Å
C1H13sing1.09Å1.10Å
CH14sing1.09Å1.10Å
CH15sing1.09Å1.10Å
CH16sing1.09Å1.10Å
C16H17sing1.09Å1.10Å
C16H18sing1.09Å1.10Å
C17H19sing1.09Å1.10Å
C17H20sing1.09Å1.10Å
C23H21sing1.09Å1.10Å
C23H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C21H24sing1.09Å1.10Å
C21H25sing1.09Å1.10Å
C21H26sing1.09Å1.10Å
C20H27sing1.09Å1.10Å
C20H28sing1.09Å1.10Å
C20H29sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
FC13C14116.3°119.8°
FC13C12118.5°119.9°
C14C13C12125.0°120.3°
C13C14C15117.3°120.0°
C13C14H7121.4°120.0°
C13C12C11117.0°120.2°
C13C12H1121.5°119.9°
C14C15O123.4°120.1°
C14C15C10120.9°119.8°
C15C14H7121.3°119.9°
C23C22N4117.8°125.9°
C23C22C18126.7°125.9°
C22C23H21109.5°109.5°
C22C23H22109.4°109.5°
C22C23H23109.5°109.5°
C12C11C10122.7°120.0°
C11C12H1121.5°119.9°
C12C11H3118.6°120.0°
C17C16O110.7°109.5°
C16C17C18114.3°109.5°
C17C16H17109.2°109.5°
C17C16H18109.2°109.5°
C16C17H19108.3°109.5°
C16C17H20108.3°109.5°
C16OC15113.9°117.0°
OC16H17109.2°109.5°
OC16H18109.2°109.4°
OC15C10115.7°120.1°
C15C10C11116.9°119.7°
C15C10C7121.9°120.1°
C11C10C7121.0°120.1°
C10C11H3118.7°120.0°
N4C22C18115.5°108.2°
C22N4N397.8°108.2°
C22C18C17133.6°126.0°
C22C18C19103.4°107.9°
C17C18C19123.0°126.1°
C18C17H19108.3°109.5°
C18C17H20108.3°109.5°
C10C7C8115.2°119.4°
C10C7C6125.7°119.3°
N4N3C19123.1°108.0°
N4N3C21110.6°126.0°
C18C19N3100.1°107.7°
C18C19C20133.6°126.1°
C19N3C21126.2°126.0°
N3C19C20124.9°126.2°
N3C21H24109.5°109.5°
N3C21H25109.5°109.5°
N3C21H26109.5°109.4°
C8C7C6118.9°121.3°
C7C8C9116.0°119.4°
C7C8H2122.0°120.3°
C7C6C5124.7°121.7°
C7C6H4117.6°119.1°
C19C20H27109.5°109.5°
C19C20H28109.5°109.4°
C19C20H29109.5°109.5°
C8C9C3131.5°134.7°
C8C9C4124.1°118.9°
C9C8H2122.0°120.3°
C6C5C4115.7°119.9°
C5C6H4117.6°119.2°
C6C5H6122.2°120.1°
CNC2115.5°111.0°
CNC1110.4°111.0°
NCH14109.5°109.4°
NCH15109.4°109.5°
NCH16109.4°109.5°
C3C9C4104.4°106.4°
C9C3C2131.6°126.1°
C9C3N1107.2°107.8°
C9C4C5120.6°118.8°
C9C4N2107.9°106.7°
C2NC1107.2°111.0°
NC2C3113.0°109.5°
NC2H8108.6°109.4°
NC2H9108.6°109.4°
NC1H11109.5°109.5°
NC1H12109.5°109.5°
NC1H13109.4°109.4°
C5C4N2131.5°134.4°
C4C5H6122.1°120.0°
C2C3N1120.6°126.1°
C3C2H8108.6°109.5°
C3C2H9108.6°109.5°
C3N1N2111.1°110.0°
C3N1H5124.5°125.0°
C4N2N1109.4°109.0°
N2N1H5124.5°125.0°
H8C2H9109.5°109.4°
H11C1H12109.4°109.5°
H11C1H13109.5°109.4°
H12C1H13109.5°109.5°
H14CH15109.5°109.5°
H14CH16109.5°109.5°
H15CH16109.5°109.5°
H17C16H18109.5°109.4°
H19C17H20109.4°109.4°
H21C23H22109.5°109.5°
H21C23H23109.4°109.4°
H22C23H23109.5°109.5°
H24C21H25109.4°109.5°
H24C21H26109.5°109.5°
H25C21H26109.5°109.4°
H27C20H28109.5°109.5°
H27C20H29109.5°109.5°
H28C20H29109.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
FC13C14C12175.8°180.0°
FC13C14C15179.9°180.0°
FC13C12C11179.3°179.9°
FC13C12H10.7°0.2°
FC13C14H70.1°0.0°
C13C14C15H7180.0°180.0°
C14C13C12C115.0°0.1°
C13C14C15O179.5°180.0°
C13C14C15C101.1°0.2°
C14C13C12H1175.0°179.7°
C12C13C14C154.1°0.1°
C13C12C11H1180.0°179.8°
C13C12C11C103.0°0.2°
C13C12C11H3177.0°179.8°
C12C13C14H7175.9°180.0°
C14C15OC166.6°0.0°
C14C15OC10179.4°179.8°
C14C15C10C110.6°0.5°
C14C15C10C7175.1°180.0°
C23C22N4C18179.3°180.0°
C23C22C18C170.1°0.0°
C23C22N4N3177.4°180.0°
C23C22C18C19177.4°179.8°
C22C23H21H22120.0°120.1°
C22C23H21H23120.0°120.0°
C22C23H22H23120.0°120.0°
C12C11C10C150.4°0.5°
C12C11C10H3180.0°180.0°
C12C11C10C7176.1°180.0°
C17C16OH17120.2°120.0°
C17C16OH18120.2°120.0°
C17C16OC15179.1°180.0°
C16C17C18C2279.2°89.7°
C16C17C18H19120.7°120.0°
C16C17C18H20120.7°120.0°
C16C17C18C19103.9°90.0°
C17C16H17H18119.4°120.0°
C16C17H19H20117.8°120.0°
C16OC15C10172.7°179.8°
OC16C17C1877.6°180.0°
OC16H17H18119.4°120.0°
OC16C17H1943.1°60.0°
OC16C17H20161.7°60.0°
OC15C10C11178.9°179.7°
OC15C10C75.5°0.2°
OC15C14H70.5°0.0°
C15OC16H1760.7°60.0°
C15OC16H1858.9°60.0°
C15C10C11C7175.7°179.5°
C15C10C7C8136.2°130.6°
C15C10C7C649.7°49.5°
C15C10C11H3179.6°179.5°
C10C15C14H7178.9°179.8°
C11C10C7C848.3°49.9°
C11C10C7C6125.7°130.0°
C10C11C12H1177.0°180.0°
N4C22C18C17179.3°180.0°
N4C22C18C193.4°0.2°
C22N4N3C192.5°0.2°
C22N4N3C21179.0°180.0°
N4C22C23H210.0°90.0°
N4C22C23H22120.0°150.0°
N4C22C23H23120.0°30.0°
C22C18C17C19176.9°179.7°
C18C22N4N33.3°0.0°
C22C18C19N31.5°0.3°
C22C18C19C20167.9°179.8°
C22C18C17H19160.1°150.3°
C22C18C17H2041.6°30.3°
C18C22C23H21179.1°90.0°
C18C22C23H2260.8°30.0°
C18C22C23H2359.2°150.0°
C17C18C19N3179.2°179.9°
C17C18C19C2014.3°0.0°
C18C17C16H1742.6°60.0°
C18C17C16H18162.2°60.0°
C18C17H19H20117.8°120.0°
C10C7C8C6174.5°179.9°
C10C7C8C9174.1°180.0°
C10C7C6C5172.1°180.0°
C10C7C8H25.9°0.2°
C7C10C11H33.9°0.0°
C10C7C6H47.8°0.0°
N4N3C19C180.5°0.3°
N4N3C19C21178.3°179.8°
N4N3C19C20167.5°179.8°
N4N3C21H240.0°90.0°
N4N3C21H25120.0°150.0°
N4N3C21H26120.0°30.0°
C18C19N3C20168.1°179.9°
C18C19N3C21178.8°179.9°
C19C18C17H1916.8°29.9°
C19C18C17H20135.4°149.9°
C18C19C20H2799.5°90.0°
C18C19C20H28140.5°149.9°
C18C19C20H2920.6°30.0°
C19N3C21H24178.5°89.8°
C19N3C21H2558.5°30.3°
C19N3C21H2661.5°150.2°
N3C19C20H2796.9°89.8°
N3C19C20H2823.1°30.2°
N3C19C20H29143.1°150.1°
C21N3C19C2010.7°0.0°
N3C21H24H25120.0°120.0°
N3C21H24H26120.0°120.0°
N3C21H25H26120.0°119.9°
C7C8C9H2180.0°179.8°
C8C7C6C51.7°0.1°
C7C8C9C3179.6°179.8°
C7C8C9C40.4°0.2°
C8C7C6H4178.3°180.0°
C6C7C8C90.4°0.1°
C7C6C5H4180.0°180.0°
C7C6C5C42.0°0.3°
C6C7C8H2179.6°179.7°
C7C6C5H6178.0°180.0°
C19C20H27H28120.0°120.0°
C19C20H27H29120.1°120.0°
C19C20H28H29120.0°119.9°
C8C9C3C4179.3°180.0°
C8C9C4C50.1°0.5°
C8C9C3C28.4°0.0°
C8C9C3N1179.0°180.0°
C8C9C4N2179.3°180.0°
C6C5C4C91.0°0.6°
C6C5C4H6180.0°179.7°
C6C5C4N2177.9°179.8°
CNC2C1123.5°123.9°
CNC2C354.9°170.0°
CNC2H865.6°70.0°
CNC2H9175.4°49.9°
CNC1H11180.0°64.0°
CNC1H1260.0°56.1°
CNC1H1360.0°176.1°
NCH14H15120.0°120.0°
NCH14H16120.0°120.0°
NCH15H16120.0°120.0°
C9C3C2N93.4°80.0°
C3C9C4C5179.5°179.5°
C9C3C2N1169.5°180.0°
C3C9C4N21.4°0.0°
C9C3N1N21.4°0.0°
C3C9C8H20.4°0.0°
C9C3N1H5178.5°179.9°
C9C3C2H827.1°160.0°
C9C3C2H9146.1°40.0°
C9C4C5N2178.9°179.2°
C4C9C3C2172.3°180.0°
C4C9C3N11.8°0.0°
C9C4N2N10.6°0.0°
C4C9C8H2179.6°179.9°
C9C4C5H6179.0°179.7°
NC2C3H8120.5°120.0°
NC2C3H9120.5°120.0°
NC2C3N197.1°100.0°
NC2H8H9118.4°119.9°
C2NC1H1153.5°60.0°
C2NC1H12173.5°180.0°
C2NC1H1366.5°60.0°
C2NCH14180.0°60.0°
C2NCH1560.0°180.0°
C2NCH1660.0°60.0°
C1NC2C368.6°66.0°
C1NC2H8170.9°54.0°
C1NC2H951.9°173.9°
NC1H11H12120.0°120.1°
NC1H11H13120.0°119.9°
NC1H12H13120.0°120.0°
C1NCH1458.3°176.0°
C1NCH15178.2°56.0°
C1NCH1661.7°64.0°
C5C4N2N1179.6°179.3°
C4C5C6H4178.0°179.7°
C2C3N1N2173.3°180.0°
C2C3N1H56.7°0.1°
C3C2H8H9118.4°120.1°
C3N1N2C40.6°0.0°
C3N1N2H5180.0°179.9°
N1C3C2H8142.4°20.0°
N1C3C2H923.4°140.0°
C4N2N1H5179.4°179.9°
N2C4C5H62.1°0.5°
H1C12C11H32.9°0.1°
H4C6C5H61.9°0.0°
H11C1H12H13120.0°120.0°
H14CH15H16120.0°120.0°
H17C16C17H19163.3°180.0°
H17C16C17H2078.1°60.1°
H18C16C17H1977.1°60.0°
H18C16C17H2041.5°179.9°
H21C23H22H23120.0°119.9°
H24C21H25H26120.0°120.1°
H27C20H28H29120.0°120.1°

222624

PDB entries from 2024-07-17

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