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AM6

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C9C10doub1.38Å1.43ÅAromatic
C9C21sing1.38Å1.43ÅAromatic
C10C11sing1.39Å1.44ÅAromatic
C11N3sing1.40Å1.37Å
C11C12doub1.39Å1.43ÅAromatic
N3C7sing1.35Å1.41Å
C7C14sing1.48Å1.44Å
C7O1doub1.22Å1.24Å
C14C15doub1.40Å1.43ÅAromatic
C14C16sing1.40Å1.46ÅAromatic
C15C19sing1.38Å1.41ÅAromatic
C19C18doub1.38Å1.42ÅAromatic
C18C17sing1.38Å1.45ÅAromatic
C17C16doub1.38Å1.44ÅAromatic
C17C20sing1.51Å1.57Å
C16C27sing1.51Å1.52Å
C20F1sing1.40Å1.29Å
C20F3sing1.40Å1.34Å
C20F2sing1.40Å1.35Å
C12C13sing1.40Å1.42ÅAromatic
C13C21doub1.40Å1.42ÅAromatic
C13C8sing1.48Å1.43Å
C21C22sing1.51Å1.51Å
N1C23doub1.32Å1.33ÅAromatic
N1C26sing1.32Å1.32ÅAromatic
C23C24sing1.39Å1.45ÅAromatic
C24C25doub1.39Å1.43ÅAromatic
C24N6sing1.40Å1.34Å
C25N4sing1.32Å1.27ÅAromatic
N4C26doub1.32Å1.38ÅAromatic
C26N7sing1.39Å1.28Å
N6C8sing1.35Å1.39Å
C8O2doub1.22Å1.23Å
N7C5sing1.40Å1.33Å
C28C29doub1.39Å1.48ÅAromatic
C28C32sing1.38Å1.42ÅAromatic
C29C30sing1.39Å1.50ÅAromatic
C29N5sing1.40Å1.36Å
C30C31doub1.38Å1.49ÅAromatic
C31C5sing1.39Å1.41ÅAromatic
C5C32doub1.39Å1.48ÅAromatic
C1N2sing1.47Å1.51Å
C1C6sing1.53Å1.46Å
N2C3sing1.47Å1.51Å
N2C2sing1.47Å1.44Å
C3C4sing1.53Å1.42Å
C4N5sing1.47Å1.53Å
N5C6sing1.47Å1.56Å
C9H9sing1.08Å1.08Å
C10H10sing1.08Å1.08Å
N3HN3sing0.97Å1.00Å
C15H15sing1.08Å1.08Å
C19H19sing1.08Å1.08Å
C18H18sing1.08Å1.08Å
C12H12sing1.08Å1.08Å
C22H22sing1.09Å1.10Å
C22H22Asing1.09Å1.10Å
C22H22Bsing1.09Å1.10Å
C23H23sing1.08Å1.08Å
C25H25sing1.08Å1.08Å
N6HN6sing0.97Å1.00Å
N7HN7sing0.97Å1.00Å
C27H27sing1.09Å1.10Å
C27H27Asing1.09Å1.10Å
C27H27Bsing1.09Å1.10Å
C28H28sing1.08Å1.08Å
C30H30sing1.08Å1.08Å
C31H31sing1.08Å1.08Å
C32H32sing1.08Å1.08Å
C1H1sing1.09Å1.10Å
C1H1Asing1.09Å1.10Å
C3H3sing1.09Å1.10Å
C3H3Asing1.09Å1.10Å
C4H4sing1.09Å1.10Å
C4H4Asing1.09Å1.10Å
C6H6sing1.09Å1.10Å
C6H6Asing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C2H2Asing1.09Å1.10Å
C2H2Bsing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C10C9C21117.1°120.2°
C9C10C11120.6°120.2°
C10C9H9121.5°119.9°
C9C10H10119.7°119.9°
C9C21C13121.0°120.0°
C9C21C22122.2°120.0°
C21C9H9121.4°119.9°
C10C11N3117.4°120.0°
C10C11C12122.6°120.0°
C11C10H10119.7°119.9°
N3C11C12119.9°120.0°
C11N3C7129.3°120.0°
C11N3HN3115.3°120.0°
C11C12C13115.4°119.8°
C11C12H12122.3°120.1°
N3C7C14114.9°120.0°
N3C7O1126.8°120.0°
C7N3HN3115.4°120.0°
C14C7O1118.3°120.0°
C7C14C15118.4°120.1°
C7C14C16120.2°120.2°
C15C14C16121.4°119.7°
C14C15C19120.2°119.8°
C14C15H15119.9°120.1°
C14C16C17118.7°119.8°
C14C16C27121.6°120.0°
C15C19C18118.8°120.2°
C19C15H15119.9°120.1°
C15C19H19120.6°119.9°
C19C18C17123.3°120.3°
C18C19H19120.6°119.9°
C19C18H18118.4°119.9°
C18C17C16117.6°120.2°
C18C17C20118.7°119.9°
C17C18H18118.4°119.8°
C16C17C20123.8°119.9°
C17C16C27119.7°120.1°
C17C20F1116.1°109.5°
C17C20F3110.4°109.5°
C17C20F2109.4°109.5°
C16C27H27109.5°109.5°
C16C27H27A109.4°109.4°
C16C27H27B109.5°109.5°
F1C20F3102.1°109.5°
F1C20F2102.9°109.5°
F3C20F2115.9°109.5°
C12C13C21123.3°119.8°
C12C13C8116.8°120.1°
C13C12H12122.3°120.1°
C21C13C8119.9°120.1°
C13C21C22116.8°120.0°
C13C8N6115.7°120.0°
C13C8O2117.0°120.0°
C21C22H22109.5°109.4°
C21C22H22A109.5°109.5°
C21C22H22B109.5°109.4°
C23N1C26115.3°120.8°
N1C23C24120.3°119.1°
N1C23H23119.9°120.5°
N1C26N4125.9°121.8°
N1C26N7116.7°119.1°
C23C24C25120.5°118.4°
C23C24N6120.7°120.8°
C24C23H23119.8°120.5°
C25C24N6118.8°120.8°
C24C25N4114.9°119.1°
C24C25H25122.5°120.4°
C24N6C8125.0°120.0°
C24N6HN6117.5°120.0°
C25N4C26123.1°120.8°
N4C25H25122.6°120.4°
N4C26N7117.4°119.1°
C26N7C5122.0°120.0°
C26N7HN7119.0°120.0°
N6C8O2127.4°120.0°
C8N6HN6117.5°120.0°
N7C5C31100.6°120.0°
N7C5C32128.6°120.0°
C5N7HN7119.0°120.0°
C29C28C32118.2°120.0°
C28C29C30121.1°120.0°
C28C29N5114.2°120.0°
C29C28H28120.9°120.0°
C28C32C5117.1°120.0°
C32C28H28120.9°120.0°
C28C32H32121.4°120.0°
C30C29N5124.6°120.0°
C29C30C31121.4°120.0°
C29C30H30119.3°120.0°
C29N5C4121.5°111.0°
C29N5C6128.6°111.0°
C30C31C5111.3°120.0°
C31C30H30119.3°120.0°
C30C31H31124.3°120.0°
C31C5C32130.8°120.0°
C5C31H31124.3°120.0°
C5C32H32121.5°120.0°
N2C1C699.9°109.4°
C1N2C3116.3°110.9°
C1N2C296.4°111.0°
N2C1H1112.8°109.5°
N2C1H1A114.8°109.5°
C1C6N5107.7°109.4°
C6C1H1112.8°109.5°
C6C1H1A114.8°109.5°
C1C6H6110.1°109.5°
C1C6H6A110.5°109.5°
C3N2C2101.0°111.0°
N2C3C498.2°109.4°
N2C3H3113.4°109.5°
N2C3H3A115.7°109.5°
N2C2H2109.5°109.5°
N2C2H2A109.5°109.5°
N2C2H2B109.4°109.5°
C3C4N5111.4°109.4°
C4C3H3113.4°109.5°
C4C3H3A115.7°109.5°
C3C4H4108.8°109.5°
C3C4H4A108.4°109.5°
C4N5C6109.4°110.9°
N5C4H4108.8°109.5°
N5C4H4A108.4°109.5°
N5C6H6110.1°109.5°
N5C6H6A110.5°109.5°
H22C22H22A109.5°109.6°
H22C22H22B109.5°109.5°
H22AC22H22B109.5°109.4°
H27C27H27A109.5°109.4°
H27C27H27B109.4°109.5°
H27AC27H27B109.5°109.5°
H1C1H1A102.4°109.5°
H3C3H3A101.1°109.5°
H4C4H4A111.0°109.5°
H6C6H6A108.1°109.5°
H2C2H2A109.4°109.5°
H2C2H2B109.5°109.4°
H2AC2H2B109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C10C9C21H9180.0°179.7°
C9C10C11H10180.0°180.0°
C9C10C11N3175.8°180.0°
C9C10C11C120.8°0.0°
C10C9C21C130.7°0.0°
C10C9C21C22177.8°180.0°
C21C9C10C110.0°0.0°
C9C21C13C120.6°0.1°
C9C21C13C22178.6°180.0°
C9C21C13C8177.8°180.0°
C21C9C10H10180.0°180.0°
C9C21C22H22143.1°96.8°
C9C21C22H22A96.9°143.1°
C9C21C22H22B23.1°23.1°
C10C11N3C12176.7°180.0°
C10C11N3C7165.1°144.8°
C10C11C12C130.9°0.0°
C11C10C9H9180.0°179.7°
C10C11N3HN314.9°35.2°
C10C11C12H12179.1°180.0°
C11N3C7HN3180.0°180.0°
C11N3C7C14179.4°175.4°
C11N3C7O11.4°4.5°
N3C11C12C13175.7°179.9°
N3C11C10H104.2°0.0°
N3C11C12H124.3°0.0°
C12C11N3C711.7°35.2°
C11C12C13H12180.0°180.0°
C11C12C13C210.1°0.1°
C11C12C13C8178.7°180.0°
C12C11C10H10179.2°180.0°
C12C11N3HN3168.4°144.8°
N3C7C14O1179.3°180.0°
N3C7C14C1543.0°4.4°
N3C7C14C16138.5°175.9°
C7C14C15C16178.5°179.7°
C7C14C15C19178.4°180.0°
C7C14C16C17178.1°179.7°
C7C14C16C272.5°0.0°
C14C7N3HN30.6°4.6°
C7C14C15H151.6°0.1°
O1C7C14C15136.3°175.6°
O1C7C14C1642.2°4.1°
O1C7N3HN3178.6°175.5°
C14C15C19H15180.0°179.9°
C14C15C19C180.1°0.0°
C15C14C16C170.3°0.6°
C15C14C16C27179.0°179.7°
C14C15C19H19179.9°179.9°
C16C14C15C190.2°0.3°
C14C16C17C180.3°0.6°
C14C16C17C27179.4°179.7°
C14C16C17C20179.3°179.7°
C16C14C15H15179.8°179.8°
C14C16C27H27158.0°82.7°
C14C16C27H27A82.0°157.3°
C14C16C27H27B38.0°37.4°
C15C19C18H19180.0°179.9°
C15C19C18C170.1°0.0°
C15C19C18H18179.9°180.0°
C19C18C17H18180.0°179.9°
C19C18C17C160.1°0.3°
C19C18C17C20179.5°180.0°
C18C19C15H15179.9°180.0°
C18C17C16C20179.6°179.8°
C18C17C16C27179.1°179.7°
C18C17C20F110.8°0.0°
C18C17C20F3104.7°120.0°
C18C17C20F2126.6°120.0°
C17C18C19H19179.9°179.9°
C16C17C20F1168.8°179.7°
C16C17C20F375.7°59.8°
C16C17C20F253.0°60.3°
C16C17C18H18179.9°179.8°
C17C16C27H2721.4°97.0°
C17C16C27H27A98.6°22.9°
C17C16C27H27B141.4°142.9°
C20C17C16C271.3°0.0°
C17C20F1F3120.1°120.0°
C17C20F1F2119.4°120.0°
C17C20F3F2125.1°120.0°
C20C17C18H180.4°0.0°
C16C27H27H27A120.0°119.9°
C16C27H27H27B120.0°120.1°
C16C27H27AH27B120.0°120.0°
F1C20F3F2110.9°120.0°
C12C13C21C8178.5°179.9°
C12C13C21C22177.9°180.0°
C12C13C8N6102.2°6.2°
C12C13C8O277.5°173.8°
C21C13C8N679.2°173.8°
C21C13C8O2101.1°6.1°
C13C21C9H9179.3°179.7°
C21C13C12H12179.9°180.0°
C13C21C22H2235.5°83.2°
C13C21C22H22A84.5°36.9°
C13C21C22H22B155.5°156.8°
C8C13C21C223.6°0.1°
C13C8N6C24174.9°174.9°
C13C8N6O2179.7°180.0°
C8C13C12H121.4°0.1°
C13C8N6HN65.1°5.1°
C22C21C9H92.2°0.3°
C21C22H22H22A120.0°120.0°
C21C22H22H22B120.0°119.9°
C21C22H22AH22B120.0°119.9°
N1C23C24H23180.0°180.0°
N1C23C24C250.3°0.0°
N1C23C24N6179.7°180.0°
C23N1C26N40.3°0.0°
C23N1C26N7178.8°180.0°
C26N1C23C240.0°0.0°
N1C26N4C250.4°0.0°
N1C26N4N7179.1°180.0°
N1C26N7C5157.1°174.4°
C26N1C23H23180.0°180.0°
N1C26N7HN722.9°5.6°
C23C24C25N6180.0°180.0°
C23C24C25N40.2°0.0°
C23C24N6C8162.5°34.2°
C23C24C25H25179.9°179.9°
C23C24N6HN617.5°145.8°
C24C25N4H25180.0°179.9°
C24C25N4C260.1°0.0°
C25C24N6C817.5°145.8°
C25C24C23H23179.7°180.0°
C25C24N6HN6162.5°34.2°
N6C24C25N4179.8°180.0°
C24N6C8HN6180.0°180.0°
C24N6C8O25.4°5.1°
N6C24C23H230.3°0.0°
N6C24C25H250.2°0.1°
C25N4C26N7178.7°179.9°
N4C26N7C522.1°5.6°
C26N4C25H25179.8°179.9°
N4C26N7HN7157.9°174.4°
C26N7C5HN7180.0°180.0°
C26N7C5C31157.6°34.5°
C26N7C5C3223.4°145.4°
O2C8N6HN6174.6°174.9°
N7C5C32C28179.2°180.0°
N7C5C31C30178.5°180.0°
N7C5C31C32179.0°179.9°
N7C5C31H311.6°0.1°
N7C5C32H320.8°0.0°
C29C28C32H28180.0°179.7°
C28C29C30N5179.0°180.0°
C28C29C30C310.1°0.1°
C29C28C32C51.3°0.0°
C28C29N5C4160.7°180.0°
C28C29N5C628.1°56.2°
C28C29C30H30180.0°180.0°
C29C28C32H32178.7°180.0°
C32C28C29C301.1°0.0°
C32C28C29N5178.0°180.0°
C28C32C5C310.5°0.1°
C28C32C5H32180.0°180.0°
C29C30C31H30180.0°180.0°
C29C30C31C50.7°0.1°
C30C29N5C418.4°0.1°
C30C29N5C6152.9°123.8°
C30C29C28H28178.9°179.7°
C29C30C31H31179.3°180.0°
N5C29C30C31179.0°180.0°
C29N5C6C1111.2°176.8°
C29N5C4C3109.6°176.8°
C29N5C4C6172.7°123.8°
N5C29C28H282.0°0.3°
N5C29C30H301.0°0.0°
C29N5C4H4130.4°56.9°
C29N5C4H4A9.6°63.2°
C29N5C6H68.8°63.2°
C29N5C6H6A128.1°56.9°
C30C31C5H31180.0°179.9°
C30C31C5C320.5°0.1°
C31C5N7HN722.4°145.6°
C5C31C30H30179.3°179.9°
C31C5C32H32179.5°179.9°
C32C5N7HN7156.6°34.5°
C5C32C28H28178.7°179.7°
C32C5C31H31179.5°180.0°
N2C1C6H1120.0°120.0°
N2C1C6H1A123.3°120.0°
C1N2C3C2102.9°123.9°
C1N2C3C472.7°59.3°
N2C1C6N560.5°58.4°
N2C1H1H1A123.8°120.1°
C1N2C3H3167.3°60.6°
C1N2C3H3A51.0°179.3°
N2C1C6H6179.5°61.5°
N2C1C6H6A60.2°178.4°
C1N2C2H2171.5°59.9°
C1N2C2H2A51.5°180.0°
C1N2C2H2B68.5°60.0°
C6C1N2C373.8°59.3°
C6C1N2C2179.4°64.5°
C1C6N5C460.8°59.3°
C1C6N5H6120.0°120.0°
C1C6N5H6A120.7°120.0°
C6C1H1H1A123.9°120.0°
C1C6H6H6A120.7°120.1°
N2C3C4H3120.0°120.0°
N2C3C4H3A123.8°120.0°
N2C3C4N561.6°58.4°
C3N2C1H146.3°179.3°
C3N2C1H1A163.0°60.6°
N2C3H3H3A124.5°120.1°
N2C3C4H458.4°178.4°
N2C3C4H4A179.2°61.6°
C3N2C2H270.1°63.8°
C3N2C2H2A170.0°56.2°
C3N2C2H2B49.9°176.2°
C2N2C3C4175.7°64.5°
C2N2C1H159.4°55.4°
C2N2C1H1A57.3°175.5°
C2N2C3H364.4°175.5°
C2N2C3H3A51.9°55.4°
N2C2H2H2A120.0°120.1°
N2C2H2H2B120.0°120.0°
N2C2H2AH2B120.0°120.0°
C3C4N5H4120.0°120.0°
C3C4N5H4A119.2°119.9°
C3C4N5C663.1°59.3°
C4C3H3H3A124.5°120.1°
C3C4H4H4A119.2°120.1°
N5C4C3H3178.4°61.5°
N5C4C3H3A62.2°178.4°
N5C4H4H4A119.3°120.1°
C4N5C6H6179.1°60.6°
C4N5C6H6A59.9°179.3°
N5C6C1H159.5°178.4°
N5C6C1H1A176.3°61.6°
C6N5C4H456.8°179.3°
C6N5C4H4A177.7°60.6°
N5C6H6H6A120.7°120.1°
H9C9C10H100.0°0.3°
H15C15C19H190.1°0.0°
H19C19C18H180.1°0.0°
H22C22H22AH22B120.0°120.0°
H27C27H27AH27B120.0°120.0°
H28C28C32H321.3°0.2°
H30C30C31H310.7°0.0°
H1C1C6H660.5°58.4°
H1C1C6H6A179.8°61.6°
H1AC1C6H656.2°178.5°
H1AC1C6H6A63.0°58.4°
H3C3C4H461.6°58.4°
H3C3C4H4A59.2°178.5°
H3AC3C4H4177.9°61.7°
H3AC3C4H4A57.1°58.4°
H2C2H2AH2B120.0°119.9°

220113

PDB entries from 2024-05-22

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