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Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
N1C2doub1.33Å1.33ÅAromatic
N1C6sing1.32Å1.35ÅAromatic
C2C3sing1.40Å1.41ÅAromatic
C2C7sing1.48Å1.51ÅAromatic
C3C4doub1.39Å1.40ÅAromatic
C4N5sing1.32Å1.34ÅAromatic
C4C8sing1.51Å1.51Å
N5C6doub1.33Å1.34ÅAromatic
C6C26sing1.43Å1.47Å
C7C12doub1.39Å1.40ÅAromatic
C7C16sing1.39Å1.39ÅAromatic
C8C9sing1.53Å1.52Å
C9C10sing1.53Å1.54Å
C10N11sing1.47Å1.50Å
N11C21sing1.47Å1.49Å
N11C25sing1.47Å1.47Å
C12C13sing1.38Å1.39ÅAromatic
C13C14doub1.38Å1.40ÅAromatic
C13C17sing1.51Å1.50Å
C14C15sing1.38Å1.39ÅAromatic
C15C16doub1.38Å1.39ÅAromatic
C17F18sing1.40Å1.33Å
C17F19sing1.40Å1.30Å
C17F20sing1.40Å1.32Å
C21C22sing1.53Å1.54Å
C22C23sing1.53Å1.53Å
C23C24sing1.53Å1.53Å
C24C25sing1.53Å1.52Å
C26N27trip1.14Å1.26Å
C3H3sing1.08Å1.08Å
C8H8sing1.09Å1.10Å
C8H8Asing1.09Å1.10Å
C9H9sing1.09Å1.10Å
C9H9Asing1.09Å1.10Å
C10H10sing1.09Å1.10Å
C10H10Asing1.09Å1.10Å
C12H12sing1.08Å1.08Å
C14H14sing1.08Å1.08Å
C15H15sing1.08Å1.08Å
C16H16sing1.08Å1.08Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
C24H24sing1.09Å1.10Å
C24H24Asing1.09Å1.10Å
C25H25sing1.09Å1.10Å
C25H25Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
C2N1C6120.1°120.7°
N1C2C3117.7°119.0°
N1C2C7116.9°120.5°
N1C6N5123.3°121.7°
N1C6C26120.6°119.2°
C3C2C7125.2°120.5°
C2C3C4120.7°118.5°
C2C3H3119.6°120.8°
C2C7C12118.5°120.1°
C2C7C16122.7°120.1°
C3C4N5118.5°119.2°
C3C4C8122.0°120.4°
C4C3H3119.7°120.7°
N5C4C8119.5°120.4°
C4N5C6119.5°121.0°
C4C8C9111.7°109.5°
C4C8H8108.7°109.5°
C4C8H8A108.7°109.5°
N5C6C26116.0°119.2°
C6C26N27115.9°179.9°
C12C7C16118.8°119.7°
C7C12C13122.3°119.9°
C7C12H12118.9°120.0°
C7C16C15119.1°119.9°
C7C16H16120.5°120.1°
C8C9C10111.1°109.5°
C9C8H8108.7°109.4°
C9C8H8A108.7°109.4°
C8C9H9108.9°109.5°
C8C9H9A108.9°109.5°
C9C10N11118.6°109.5°
C10C9H9109.0°109.5°
C10C9H9A108.9°109.4°
C9C10H10106.6°109.5°
C9C10H10A106.5°109.4°
C10N11C21114.6°111.0°
C10N11C25107.8°111.0°
N11C10H10106.5°109.5°
N11C10H10A106.5°109.5°
C21N11C25115.8°111.2°
N11C21C22118.3°109.5°
N11C21H21106.6°109.4°
N11C21H21A106.6°109.5°
N11C25C24111.3°109.5°
N11C25H25108.9°109.5°
N11C25H25A108.9°109.5°
C12C13C14118.5°120.1°
C12C13C17121.0°120.0°
C13C12H12118.9°120.1°
C14C13C17120.5°119.9°
C13C14C15119.3°120.2°
C13C14H14120.3°119.9°
C13C17F18111.8°109.5°
C13C17F19106.8°109.5°
C13C17F20115.0°109.4°
C14C15C16122.1°120.1°
C15C14H14120.3°119.9°
C14C15H15119.0°119.9°
C16C15H15119.0°120.0°
C15C16H16120.5°120.1°
F18C17F19108.2°109.5°
F18C17F20109.1°109.5°
F19C17F20105.5°109.5°
C21C22C23116.7°109.3°
C22C21H21106.6°109.4°
C22C21H21A106.6°109.5°
C21C22H22107.1°109.5°
C21C22H22A107.1°109.4°
C22C23C24118.7°109.2°
C23C22H22107.1°109.5°
C23C22H22A107.1°109.5°
C22C23H23106.5°109.5°
C22C23H23A106.5°109.5°
C23C24C25116.0°109.2°
C24C23H23106.5°109.5°
C24C23H23A106.5°109.5°
C23C24H24107.3°109.5°
C23C24H24A107.3°109.5°
C25C24H24107.4°109.5°
C25C24H24A107.3°109.5°
C24C25H25108.9°109.4°
C24C25H25A108.9°109.4°
H8C8H8A110.2°109.5°
H9C9H9A110.0°109.4°
H10C10H10A112.2°109.5°
H21C21H21A112.2°109.5°
H22C22H22A111.7°109.5°
H23C23H23A112.3°109.6°
H24C24H24A111.5°109.6°
H25C25H25A110.1°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
N1C2C3C7175.0°180.0°
N1C2C3C44.4°0.0°
C2N1C6N51.6°0.0°
C2N1C6C26177.6°180.0°
N1C2C7C1211.2°0.0°
N1C2C7C16166.1°179.7°
N1C2C3H3175.6°180.0°
C6N1C2C32.3°0.0°
C6N1C2C7177.8°180.0°
N1C6N5C43.4°0.0°
N1C6N5C26176.2°180.0°
N1C6C26N27173.4°47.5°
C2C3C4H3180.0°179.9°
C2C3C4N52.7°0.0°
C2C3C4C8179.2°180.0°
C3C2C7C12173.8°180.0°
C3C2C7C168.9°0.3°
C7C2C3C4179.5°180.0°
C2C7C12C16177.4°179.7°
C2C7C12C13177.7°180.0°
C2C7C16C15177.3°179.7°
C7C2C3H30.6°0.1°
C2C7C12H122.3°0.0°
C2C7C16H162.7°0.1°
C3C4N5C8178.2°180.0°
C3C4N5C61.2°0.0°
C3C4C8C9125.2°125.0°
C3C4C8H8114.8°115.1°
C3C4C8H8A5.2°5.0°
C4N5C6C26179.6°180.0°
N5C4C8C952.9°55.1°
N5C4C3H3177.3°180.0°
N5C4C8H867.1°64.9°
N5C4C8H8A172.9°175.0°
C8C4N5C6177.0°180.0°
C4C8C9H8120.0°120.0°
C4C8C9H8A120.0°120.0°
C4C8C9C1061.6°180.0°
C8C4C3H30.8°0.0°
C4C8H8H8A119.1°120.0°
C4C8C9H958.4°59.9°
C4C8C9H9A178.4°60.0°
N5C6C26N272.9°132.5°
C7C12C13H12180.0°180.0°
C7C12C13C140.3°0.0°
C7C12C13C17179.5°180.0°
C12C7C16C150.0°0.6°
C12C7C16H16180.0°179.7°
C16C7C12C130.3°0.3°
C7C16C15C140.2°0.6°
C7C16C15H16180.0°179.7°
C16C7C12H12179.7°179.7°
C7C16C15H15179.8°179.7°
C8C9C10H9120.0°120.1°
C8C9C10H9A120.0°120.0°
C8C9C10N11168.4°180.0°
C9C8H8H8A119.1°120.0°
C8C9H9H9A119.3°120.0°
C8C9C10H1048.4°59.9°
C8C9C10H10A71.6°60.0°
C9C10N11H10120.0°120.0°
C9C10N11H10A120.0°119.9°
C9C10N11C2118.4°170.0°
C9C10N11C25148.8°65.8°
C10C9C8H8178.4°60.0°
C10C9C8H8A58.4°60.0°
C10C9H9H9A119.3°119.9°
C9C10H10H10A116.3°119.9°
C10N11C21C25126.4°124.1°
C10N11C21C22163.8°174.2°
C10N11C25C24174.6°174.2°
N11C10C9H971.6°59.9°
N11C10C9H9A48.4°60.0°
N11C10H10H10A116.2°120.1°
C10N11C21H2143.8°65.8°
C10N11C21H21A76.2°54.1°
C10N11C25H2554.6°54.2°
C10N11C25H25A65.4°65.8°
N11C21C22H21120.0°120.0°
N11C21C22H21A120.0°120.1°
N11C21C22C2310.3°59.1°
C21N11C25C2455.6°61.8°
C21N11C10H10138.4°70.0°
C21N11C10H10A101.6°50.0°
N11C21H21H21A116.4°120.0°
N11C21C22H22130.3°179.1°
N11C21C22H22A109.7°60.8°
C21N11C25H25175.6°178.3°
C21N11C25H25A64.4°58.2°
C25N11C21C2237.4°61.7°
N11C25C24C2347.8°59.2°
N11C25C24H25120.0°120.0°
N11C25C24H25A120.0°120.0°
C25N11C10H1091.2°54.2°
C25N11C10H10A28.8°174.2°
C25N11C21H2182.5°58.2°
C25N11C21H21A157.4°178.2°
N11C25C24H24167.8°179.1°
N11C25C24H24A72.1°60.7°
N11C25H25H25A119.3°120.0°
C12C13C14C17179.8°180.0°
C12C13C14C150.1°0.0°
C12C13C17F1854.4°90.0°
C12C13C17F19172.6°150.0°
C12C13C17F2070.8°30.0°
C12C13C14H14179.9°180.0°
C13C14C15H14180.0°180.0°
C13C14C15C160.1°0.3°
C14C13C17F18125.8°90.0°
C14C13C17F197.6°30.0°
C14C13C17F20109.1°150.0°
C14C13C12H12179.7°180.0°
C13C14C15H15179.8°180.0°
C17C13C14C15179.7°180.0°
C13C17F18F19117.4°120.0°
C13C17F18F20128.3°119.9°
C13C17F19F20122.8°119.9°
C17C13C12H120.5°0.0°
C17C13C14H140.3°0.0°
C14C15C16H15180.0°179.7°
C14C15C16H16179.8°179.8°
C16C15C14H14179.9°179.8°
F18C17F19F20116.7°120.1°
C21C22C23H22120.0°120.0°
C21C22C23H22A120.0°119.9°
C21C22C23C243.5°57.6°
C22C21H21H21A116.4°120.0°
C21C22H22H22A117.0°120.0°
C21C22C23H23116.5°62.2°
C21C22C23H23A123.5°177.5°
C22C23C24H23120.0°119.9°
C22C23C24H23A120.0°119.9°
C22C23C24C2522.6°57.6°
C23C22C21H21109.7°60.8°
C23C22C21H21A130.3°179.2°
C23C22H22H22A117.1°120.1°
C22C23H23H23A116.2°120.2°
C22C23C24H24142.6°177.6°
C22C23C24H24A97.4°62.3°
C23C24C25H24120.0°119.9°
C23C24C25H24A120.0°119.9°
C24C23C22H22123.5°177.6°
C24C23C22H22A116.5°62.2°
C24C23H23H23A116.2°120.1°
C23C24H24H24A117.3°120.2°
C23C24C25H25167.8°179.2°
C23C24C25H25A72.2°60.8°
C25C24C23H2397.5°62.2°
C25C24C23H23A142.6°177.5°
C25C24H24H24A117.3°120.1°
C24C25H25H25A119.3°119.9°
H8C8C9H961.6°180.0°
H8C8C9H9A58.4°60.0°
H8AC8C9H9178.4°60.0°
H8AC8C9H9A61.6°180.0°
H9C9C10H10168.4°180.0°
H9C9C10H10A48.4°60.1°
H9AC9C10H1071.6°60.0°
H9AC9C10H10A168.4°180.0°
H14C14C15H150.1°0.0°
H15C15C16H160.2°0.0°
H21C21C22H2210.3°59.1°
H21C21C22H22A130.3°179.2°
H21AC21C22H22109.7°60.8°
H21AC21C22H22A10.3°59.3°
H22C22C23H233.5°57.7°
H22C22C23H23A116.5°62.5°
H22AC22C23H23123.5°177.9°
H22AC22C23H23A3.5°57.6°
H23C23C24H2422.6°57.7°
H23C23C24H24A142.6°177.9°
H23AC23C24H2497.4°62.6°
H23AC23C24H24A22.6°57.6°
H24C24C25H2572.2°60.9°
H24C24C25H25A47.8°59.1°
H24AC24C25H2547.8°59.3°
H24AC24C25H25A167.9°179.2°

251422

PDB entries from 2026-04-01

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