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63I

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F25C24sing1.35Å1.34Å
N16C15doub1.31Å1.31ÅAromatic
N16C17sing1.33Å1.33ÅAromatic
C15C14sing1.40Å1.40ÅAromatic
N18C17sing1.39Å1.40Å
N18C19sing1.40Å1.41Å
C24C19doub1.39Å1.40ÅAromatic
C24C23sing1.38Å1.38ÅAromatic
C17C31doub1.38Å1.39ÅAromatic
C19C20sing1.39Å1.39ÅAromatic
C23C22doub1.39Å1.39ÅAromatic
C14C13doub1.41Å1.40ÅAromatic
C14C32sing1.42Å1.42ÅAromatic
C13C12sing1.37Å1.37ÅAromatic
C31C32sing1.40Å1.41ÅAromatic
C20C21doub1.38Å1.38ÅAromatic
C22C21sing1.39Å1.40ÅAromatic
C22N26sing1.40Å1.41Å
C32N33doub1.33Å1.34ÅAromatic
N30N26sing1.40Å1.40ÅAromatic
N30C29doub1.31Å1.31ÅAromatic
N26C27sing1.35Å1.36ÅAromatic
C12C11doub1.39Å1.39ÅAromatic
C29C28sing1.40Å1.39ÅAromatic
N33C11sing1.31Å1.32ÅAromatic
C11C8sing1.51Å1.52Å
C27C28doub1.35Å1.36ÅAromatic
C8O10sing1.43Å1.44Å
C8C9sing1.53Å1.53Å
C8C5sing1.53Å1.54Å
C4C5sing1.53Å1.54Å
C4C3sing1.53Å1.53Å
C5C6sing1.53Å1.53Å
C3N2sing1.47Å1.47Å
C6C7sing1.53Å1.52Å
N2C7sing1.47Å1.46Å
N2C1sing1.47Å1.48Å
C4H1sing1.09Å1.10Å
C4H2sing1.09Å1.10Å
C5H3sing1.09Å1.10Å
C6H4sing1.09Å1.10Å
C6H5sing1.09Å1.10Å
C7H6sing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C13H8sing1.08Å1.08Å
C15H9sing1.08Å1.08Å
C20H10sing1.08Å1.08Å
C21H11sing1.08Å1.08Å
C28H12sing1.08Å1.08Å
C1H13sing1.09Å1.10Å
C1H14sing1.09Å1.10Å
C1H15sing1.09Å1.10Å
C3H17sing1.09Å1.10Å
C3H18sing1.09Å1.10Å
C9H19sing1.09Å1.10Å
C9H20sing1.09Å1.10Å
C9H21sing1.09Å1.10Å
O10H22sing0.97Å0.95Å
C12H23sing1.08Å1.08Å
N18H24sing0.97Å1.00Å
C23H25sing1.08Å1.08Å
C27H26sing1.08Å1.08Å
C29H27sing1.08Å1.08Å
C31H28sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F25C24C19118.3°120.0°
F25C24C23120.0°120.0°
C15N16C17122.9°122.5°
N16C15C14121.0°120.1°
N16C15H9119.5°119.9°
N16C17N18115.1°119.2°
N16C17C31120.0°121.6°
C15C14C13122.0°122.0°
C15C14C32118.8°119.1°
C14C15H9119.5°119.9°
C17N18C19125.2°120.0°
N18C17C31124.8°119.2°
C17N18H24117.4°120.0°
N18C19C24117.5°120.0°
N18C19C20123.9°120.1°
C19N18H24117.3°120.1°
C19C24C23121.6°120.0°
C24C19C20118.6°119.9°
C24C23C22119.8°120.0°
C24C23H25120.1°120.0°
C17C31C32119.5°118.7°
C17C31H28120.3°120.7°
C19C20C21119.9°120.1°
C19C20H10120.1°120.0°
C23C22C21118.8°120.0°
C23C22N26120.2°120.0°
C22C23H25120.1°120.0°
C13C14C32119.2°118.9°
C14C13C12118.5°118.0°
C14C13H8120.8°121.0°
C14C32C31117.8°118.0°
C14C32N33118.9°120.1°
C13C12C11120.2°120.1°
C12C13H8120.7°121.0°
C13C12H23119.9°120.0°
C31C32N33123.3°121.9°
C32C31H28120.2°120.6°
C20C21C22121.3°120.0°
C21C20H10120.0°120.0°
C20C21H11119.4°120.0°
C21C22N26120.9°120.0°
C22C21H11119.4°120.0°
C22N26N30125.5°126.1°
C22N26C27127.9°126.1°
C32N33C11122.6°121.1°
N26N30C29109.0°108.2°
N30N26C27106.4°107.9°
N30C29C28108.4°108.2°
N30C29H27125.8°125.9°
N26C27C28108.7°107.7°
N26C27H26125.7°126.1°
C12C11N33120.5°121.8°
C12C11C8119.8°119.1°
C11C12H23119.9°120.0°
C29C28C27107.4°107.9°
C29C28H12126.3°126.0°
C28C29H27125.8°125.9°
N33C11C8119.7°119.1°
C11C8O10111.5°109.5°
C11C8C9108.3°109.5°
C11C8C5109.2°109.5°
C27C28H12126.3°126.1°
C28C27H26125.6°126.1°
O10C8C9107.9°109.5°
O10C8C5111.2°109.5°
C8O10H22109.5°114.0°
C9C8C5108.7°109.4°
C8C9H19109.5°109.5°
C8C9H20109.5°109.5°
C8C9H21109.4°109.5°
C8C5C4110.8°109.5°
C8C5C6111.1°109.5°
C8C5H3108.9°109.6°
C5C4C3111.1°109.2°
C4C5C6108.2°109.1°
C5C4H1109.1°109.5°
C5C4H2109.1°109.5°
C4C5H3108.9°109.5°
C4C3N2112.2°109.6°
C3C4H1109.1°109.5°
C3C4H2109.1°109.5°
C4C3H17108.8°109.5°
C4C3H18108.8°109.4°
C5C6C7107.2°109.3°
C6C5H3108.9°109.6°
C5C6H4110.0°109.5°
C5C6H5110.0°109.5°
C3N2C7111.9°111.2°
C3N2C1110.9°111.0°
N2C3H17108.8°109.5°
N2C3H18108.8°109.5°
C6C7N2109.6°109.5°
C7C6H4110.0°109.5°
C7C6H5110.0°109.5°
C6C7H6109.5°109.5°
C6C7H7109.4°109.5°
C7N2C1108.7°111.0°
N2C7H6109.4°109.4°
N2C7H7109.5°109.4°
N2C1H13109.5°109.5°
N2C1H14109.5°109.4°
N2C1H15109.4°109.5°
H1C4H2109.5°109.6°
H4C6H5109.5°109.6°
H6C7H7109.4°109.5°
H13C1H14109.5°109.5°
H13C1H15109.5°109.5°
H14C1H15109.5°109.5°
H17C3H18109.5°109.4°
H19C9H20109.5°109.5°
H19C9H21109.5°109.5°
H20C9H21109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F25C24C19N180.1°0.0°
F25C24C19C23179.2°180.0°
F25C24C19C20179.8°179.4°
F25C24C23C22179.7°179.2°
F25C24C23H250.3°0.0°
N16C15C14H9180.0°179.9°
C15N16C17N18179.9°180.0°
C15N16C17C310.1°0.0°
N16C15C14C13179.0°180.0°
N16C15C14C320.9°0.1°
C17N16C15C141.0°0.0°
N16C17N18C31179.7°180.0°
N16C17N18C19161.6°6.8°
N16C17C31C321.2°0.0°
C17N16C15H9179.0°179.9°
N16C17N18H2418.3°173.3°
N16C17C31H28178.8°180.0°
C15C14C13C32179.9°179.9°
C15C14C13C12179.5°180.0°
C15C14C32C310.2°0.1°
C15C14C32N33180.0°179.9°
C15C14C13H80.5°0.4°
C17N18C19H24180.0°179.9°
C17N18C19C24149.0°153.4°
C17N18C19C2031.3°26.0°
N18C17C31C32179.1°180.0°
N18C17C31H280.9°0.0°
N18C19C24C20179.7°179.5°
N18C19C24C23179.2°180.0°
C19N18C17C3118.6°173.2°
N18C19C20C21178.9°179.4°
N18C19C20H101.1°0.3°
C19C24C23C221.2°0.8°
C24C19C20C211.4°0.0°
C24C19C20H10178.6°179.8°
C24C19N18H2431.0°26.7°
C19C24C23H25178.8°180.0°
C23C24C19C201.0°0.6°
C24C23C22H25180.0°179.2°
C24C23C22C211.6°0.5°
C24C23C22N26178.0°179.4°
C17C31C32C141.2°0.1°
C17C31C32H28180.0°180.0°
C17C31C32N33179.0°179.9°
C31C17N18H24161.4°6.7°
C19C20C21H10180.0°179.7°
C19C20C21C221.9°0.3°
C19C20C21H11178.1°179.7°
C20C19N18H24148.7°153.9°
C23C22C21C202.0°0.1°
C23C22C21N26176.3°179.9°
C23C22N26N308.6°179.8°
C23C22N26C27176.9°0.1°
C23C22C21H11178.0°180.0°
C14C13C12H8180.0°179.7°
C13C14C32C31179.9°180.0°
C13C14C32N330.1°0.0°
C14C13C12C110.1°0.3°
C13C14C15H91.0°0.1°
C14C13C12H23179.9°179.7°
C32C14C13C120.4°0.1°
C14C32C31N33179.8°179.9°
C14C32N33C111.1°0.2°
C32C14C13H8179.6°179.7°
C32C14C15H9179.1°180.0°
C14C32C31H28178.8°180.0°
C13C12C11H23180.0°179.9°
C13C12C11N330.9°0.6°
C13C12C11C8179.8°180.0°
C31C32N33C11179.1°179.8°
C20C21C22H11180.0°180.0°
C20C21C22N26178.3°180.0°
C21C22N26N30167.7°0.1°
C21C22N26C276.8°180.0°
C22C21C20H10178.1°179.9°
C21C22C23H25178.4°179.7°
C22N26N30C27175.5°179.9°
C22N26N30C29177.1°179.9°
C22N26C27C28177.0°179.9°
N26C22C21H111.7°0.0°
N26C22C23H252.0°0.2°
C22N26C27H263.0°0.0°
C32N33C11C121.5°0.5°
C32N33C11C8179.6°180.0°
N33C32C31H281.0°0.1°
N26N30C29C281.0°0.2°
N30N26C27C281.7°0.2°
N30N26C27H26178.3°179.8°
N26N30C29H27179.0°179.9°
C29N30N26C271.6°0.0°
N30C29C28H27180.0°179.9°
N30C29C28C270.1°0.3°
N30C29C28H12179.9°179.9°
N26C27C28C291.1°0.3°
N26C27C28H26180.0°180.0°
N26C27C28H12178.9°179.9°
C12C11N33C8178.9°179.5°
C12C11C8O1029.1°52.8°
C12C11C8C989.4°67.2°
C12C11C8C5152.4°172.8°
C11C12C13H8180.0°180.0°
C29C28C27H12180.0°179.6°
C29C28C27H26178.9°179.7°
N33C11C8O10151.9°127.7°
N33C11C8C989.6°112.3°
N33C11C8C528.6°7.7°
N33C11C12H23179.1°179.5°
C11C8O10C9118.8°120.1°
C11C8O10C5122.1°120.0°
C11C8C9C5118.5°120.0°
C11C8C5C468.4°67.9°
C11C8C5C6171.3°172.5°
C11C8C5H351.3°52.2°
C11C8C9H19180.0°60.0°
C11C8C9H2060.0°60.0°
C11C8C9H2160.0°180.0°
C11C8O10H22180.0°59.9°
C8C11C12H230.2°0.0°
C27C28C29H27179.9°179.8°
O10C8C9C5120.7°120.0°
O10C8C5C455.1°52.1°
O10C8C5C665.2°67.5°
O10C8C5H3174.8°172.3°
O10C8C9H1959.2°60.0°
O10C8C9H2060.8°180.0°
O10C8C9H21179.2°60.0°
C9C8C5C4173.7°172.1°
C9C8C5C653.4°52.5°
C9C8C5H366.6°67.8°
C8C9H19H20120.0°120.0°
C8C9H19H21120.0°120.0°
C8C9H20H21120.0°120.0°
C9C8O10H2261.2°180.0°
C8C5C4C6122.1°119.9°
C8C5C4H3119.7°120.2°
C8C5C4C3177.9°177.5°
C8C5C6H3119.9°120.2°
C8C5C6C7176.0°177.6°
C8C5C4H161.9°62.5°
C8C5C4H257.7°57.6°
C8C5C6H464.4°57.6°
C8C5C6H556.4°62.6°
C5C8C9H1961.5°180.0°
C5C8C9H20178.5°60.0°
C5C8C9H2158.5°60.0°
C5C8O10H2257.9°60.1°
C5C4C3H1120.2°119.9°
C5C4C3H2120.2°119.9°
C4C5C6H3118.2°119.9°
C5C4C3N251.3°59.2°
C4C5C6C762.1°57.7°
C5C4H1H2119.3°120.1°
C4C5C6H457.5°62.3°
C4C5C6H5178.2°177.6°
C5C4C3H1769.1°60.9°
C5C4C3H18171.7°179.3°
C3C4C5C655.8°57.7°
C4C3N2H17120.4°120.1°
C4C3N2H18120.4°120.0°
C4C3N2C753.8°61.7°
C4C3N2C1175.3°174.1°
C3C4H1H2119.3°120.1°
C3C4C5H362.4°62.3°
C4C3H17H18118.8°119.9°
C5C6C7H4119.6°120.0°
C5C6C7H5119.6°119.9°
C5C6C7N265.2°59.2°
C6C5C4H1176.0°177.6°
C6C5C4H264.4°62.2°
C5C6H4H5121.1°120.1°
C5C6C7H6174.8°179.2°
C5C6C7H754.8°60.8°
C3N2C7C661.1°61.7°
C3N2C7C1122.8°124.1°
N2C3C4H1171.5°179.1°
N2C3C4H268.9°60.7°
C3N2C7H6178.8°178.3°
C3N2C7H758.9°58.3°
C3N2C1H13180.0°64.2°
C3N2C1H1460.0°55.8°
C3N2C1H1560.0°175.8°
N2C3H17H18118.8°120.0°
C6C7N2H6120.0°120.0°
C6C7N2H7120.0°120.1°
C6C7N2C1176.1°174.1°
C7C6C5H356.1°62.2°
C7C6H4H5121.1°120.1°
C6C7H6H7119.9°120.1°
N2C7C6H454.4°60.7°
N2C7C6H5175.2°179.1°
N2C7H6H7119.9°119.9°
C7N2C1H1356.5°60.0°
C7N2C1H1463.5°180.0°
C7N2C1H15176.5°60.0°
C7N2C3H1766.7°58.3°
C7N2C3H18174.1°178.2°
C1N2C7H656.0°54.1°
C1N2C7H763.9°65.8°
N2C1H13H14120.0°119.9°
N2C1H13H15120.0°120.0°
N2C1H14H15120.0°120.0°
C1N2C3H1754.9°65.8°
C1N2C3H1864.3°54.1°
H1C4C5H357.8°57.6°
H1C4C3H1751.1°59.0°
H1C4C3H1868.1°60.8°
H2C4C5H3177.4°177.8°
H2C4C3H17170.7°179.2°
H2C4C3H1851.5°59.3°
H3C5C6H4175.7°177.8°
H3C5C6H563.6°57.7°
H4C6C7H665.6°59.3°
H4C6C7H7174.5°179.3°
H5C6C7H655.1°60.9°
H5C6C7H764.8°59.1°
H8C13C12H230.0°0.1°
H10C20C21H111.9°0.1°
H12C28C27H261.1°0.1°
H12C28C29H270.1°0.1°
H13C1H14H15120.0°120.0°
H19C9H20H21120.0°120.0°

222415

PDB entries from 2024-07-10

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