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UMI

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F30C29sing1.40Å1.31Å
C29F32sing1.40Å1.32Å
C29C27sing1.51Å1.49Å
C29F31sing1.40Å1.32Å
C28C27doub1.38Å1.38ÅAromatic
C28C23sing1.38Å1.39ÅAromatic
C27C26sing1.38Å1.39ÅAromatic
C22C23sing1.51Å1.51Å
C22C11sing1.53Å1.53Å
C23C24doub1.38Å1.39ÅAromatic
C26C25doub1.38Å1.39ÅAromatic
C24C25sing1.38Å1.39ÅAromatic
N16C17sing1.49Å1.47Å
N16C8sing1.47Å1.47Å
N16C15sing1.49Å1.47Å
C17C11sing1.54Å1.52Å
C8C9sing1.51Å1.50Å
C11C14sing1.54Å1.52Å
C11C30sing1.53Å1.52Å
C14C15sing1.54Å1.51Å
C21C20doub1.37Å1.38ÅAromatic
C21C16sing1.40Å1.38ÅAromatic
C20C19sing1.39Å1.38ÅAromatic
N12C30sing1.47Å1.45Å
N12C5sing1.40Å1.35Å
C9C16sing1.46Å1.47ÅAromatic
C9C10doub1.34Å1.39ÅAromatic
C16C12doub1.41Å1.46ÅAromatic
C19C18doub1.38Å1.38ÅAromatic
C5C6doub1.39Å1.39ÅAromatic
C5C4sing1.39Å1.39ÅAromatic
C6C1sing1.38Å1.40ÅAromatic
C10N11sing1.37Å1.36ÅAromatic
C12C18sing1.39Å1.37ÅAromatic
C12N11sing1.38Å1.34ÅAromatic
C4C3doub1.39Å1.38ÅAromatic
C1C2doub1.38Å1.40ÅAromatic
C3C2sing1.39Å1.38ÅAromatic
C3N8sing1.40Å1.41Å
C2C7sing1.51Å1.49Å
O11N8sing1.46Å1.39Å
N8O10sing1.46Å1.40Å
O9C7sing1.43Å1.43Å
C1H1sing1.08Å1.08Å
C10H2sing1.08Å1.08Å
C14H3sing1.09Å1.10Å
C14H4sing1.09Å1.10Å
C15H5sing1.09Å1.10Å
C15H6sing1.09Å1.10Å
C17H7sing1.09Å1.10Å
C17H8sing1.09Å1.10Å
C18H9sing1.08Å1.08Å
C19H10sing1.08Å1.08Å
C20H11sing1.08Å1.08Å
C21H12sing1.08Å1.08Å
C22H13sing1.09Å1.10Å
C22H14sing1.09Å1.10Å
C24H15sing1.08Å1.08Å
C25H16sing1.08Å1.08Å
C26H17sing1.08Å1.08Å
C28H18sing1.08Å1.08Å
C30H19sing1.09Å1.10Å
C30H20sing1.09Å1.10Å
C4H21sing1.08Å1.08Å
C6H22sing1.08Å1.08Å
C7H23sing1.09Å1.10Å
C7H24sing1.09Å1.10Å
C8H25sing1.09Å1.10Å
C8H26sing1.09Å1.10Å
N12H28sing0.97Å1.00Å
O9H30sing0.97Å0.95Å
N11H27sing0.97Å1.00Å
O10H29sing0.97Å0.95Å
O11H31sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F30C29F32109.4°109.4°
F30C29C27109.2°109.5°
F30C29F31109.6°109.5°
F32C29C27109.8°109.5°
F32C29F31110.1°109.5°
C27C29F31108.8°109.5°
C29C27C28119.3°120.0°
C29C27C26120.3°120.0°
C27C28C23120.3°120.0°
C28C27C26120.4°120.0°
C27C28H18119.9°120.0°
C28C23C22120.3°120.0°
C28C23C24119.4°120.0°
C23C28H18119.9°120.0°
C27C26C25119.7°120.0°
C27C26H17120.2°120.0°
C23C22C11114.0°109.5°
C22C23C24120.3°120.0°
C23C22H13108.3°109.5°
C23C22H14108.3°109.5°
C22C11C17108.1°110.4°
C22C11C14113.8°110.4°
C22C11C30111.2°110.3°
C11C22H13108.3°109.5°
C11C22H14108.3°109.5°
C23C24C25120.3°120.0°
C23C24H15119.9°120.0°
C26C25C24119.9°120.1°
C26C25H16120.1°120.0°
C25C26H17120.1°120.0°
C25C24H15119.8°120.0°
C24C25H16120.0°119.9°
C17N16C8113.9°111.0°
C17N16C15106.4°104.2°
N16C17C11105.3°104.6°
N16C17H7110.5°110.4°
N16C17H8110.5°110.5°
C8N16C15111.4°111.0°
N16C8C9110.1°109.5°
N16C8H25109.3°109.4°
N16C8H26109.3°109.5°
N16C15C14104.1°104.6°
N16C15H5110.8°110.4°
N16C15H6110.8°110.5°
C17C11C14105.5°105.0°
C17C11C30110.4°110.3°
C11C17H7110.5°110.4°
C11C17H8110.5°110.4°
C8C9C16126.3°126.5°
C8C9C10127.8°126.6°
C9C8H25109.3°109.4°
C9C8H26109.3°109.5°
C14C11C30107.7°110.3°
C11C14C15106.1°105.1°
C11C14H3110.3°110.3°
C11C14H4110.3°110.3°
C11C30N12110.3°109.5°
C11C30H19109.3°109.5°
C11C30H20109.3°109.4°
C15C14H3110.3°110.3°
C15C14H4110.3°110.4°
C14C15H5110.8°110.4°
C14C15H6110.8°110.4°
C20C21C16116.3°119.8°
C21C20C19121.3°120.5°
C21C20H11119.3°119.7°
C20C21H12121.8°120.1°
C21C16C9132.4°134.0°
C21C16C12122.8°119.9°
C16C21H12121.8°120.1°
C20C19C18123.0°120.7°
C20C19H10118.5°119.7°
C19C20H11119.4°119.7°
C30N12C5118.8°120.0°
N12C30H19109.3°109.5°
N12C30H20109.2°109.4°
C30N12H28107.1°120.0°
N12C5C6120.5°120.0°
N12C5C4118.9°120.0°
C5N12H28107.1°120.0°
C16C9C10105.9°107.0°
C9C16C12104.8°106.0°
C9C10N11110.1°110.0°
C9C10H2124.9°125.0°
C16C12C18117.8°119.3°
C16C12N11107.9°107.2°
C19C18C12118.6°119.8°
C19C18H9120.7°120.1°
C18C19H10118.5°119.6°
C6C5C4120.6°120.0°
C5C6C1121.0°120.0°
C5C6H22119.5°120.0°
C5C4C3119.4°119.8°
C5C4H21120.3°120.1°
C6C1C2116.4°120.2°
C6C1H1121.8°119.9°
C1C6H22119.4°119.9°
C10N11C12111.3°109.9°
N11C10H2124.9°125.0°
C10N11H27124.3°125.1°
C18C12N11134.3°133.5°
C12C18H9120.7°120.1°
C12N11H27124.4°125.1°
C4C3C2119.2°119.9°
C4C3N8121.2°120.1°
C3C4H21120.3°120.0°
C1C2C3123.3°120.1°
C1C2C7120.0°120.0°
C2C1H1121.8°119.9°
C2C3N8119.7°120.0°
C3C2C7116.6°120.0°
C3N8O11118.9°111.0°
C3N8O10123.7°111.0°
C2C7O9100.6°109.5°
C2C7H23111.6°109.4°
C2C7H24111.6°109.5°
O11N8O10117.4°111.0°
N8O11H31109.5°114.0°
N8O10H29109.5°114.0°
O9C7H23111.6°109.5°
O9C7H24111.7°109.5°
C7O9H30109.5°114.0°
H3C14H4109.5°110.4°
H5C15H6109.5°110.4°
H7C17H8109.5°110.4°
H13C22H14109.5°109.5°
H19C30H20109.5°109.5°
H23C7H24109.5°109.5°
H25C8H26109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F30C29F32C27119.8°120.0°
F30C29F32F31120.5°120.0°
F30C29C27F31119.6°120.1°
F30C29C27C2895.2°64.9°
F30C29C27C2684.2°114.8°
F32C29C27F31120.5°120.0°
F32C29C27C2824.7°175.1°
F32C29C27C26155.9°5.1°
C29C27C28C26179.4°179.7°
C29C27C28C23179.2°179.7°
C29C27C26C25179.9°179.9°
C29C27C26H170.1°0.1°
C29C27C28H180.8°0.2°
F31C29C27C28145.2°55.1°
F31C29C27C2635.4°125.1°
C27C28C23H18180.0°179.5°
C27C28C23C22179.8°179.7°
C27C28C23C241.9°0.5°
C28C27C26C250.5°0.3°
C28C27C26H17179.5°179.8°
C23C28C27C261.4°0.5°
C28C23C22C24178.3°179.8°
C28C23C22C1183.1°84.7°
C28C23C24C251.4°0.2°
C28C23C22H13156.2°155.3°
C28C23C22H1437.6°35.3°
C28C23C24H15178.5°179.8°
C27C26C25H17180.0°179.9°
C27C26C25C240.1°0.1°
C27C26C25H16180.0°180.0°
C26C27C28H18178.6°180.0°
C23C22C11H13120.7°120.0°
C23C22C11H14120.7°120.0°
C22C23C24C25179.7°180.0°
C23C22C11C17175.3°175.7°
C23C22C11C1458.5°60.0°
C23C22C11C3063.3°62.1°
C23C22H13H14117.9°120.0°
C22C23C24H150.2°0.0°
C22C23C28H180.1°0.2°
C11C22C23C2498.6°95.5°
C22C11C17N16106.4°95.1°
C22C11C17C14122.1°119.0°
C22C11C17C30121.9°122.2°
C22C11C14C30123.7°122.2°
C22C11C14C15124.5°119.0°
C22C11C30N1276.8°58.6°
C22C11C14H35.0°0.1°
C22C11C14H4116.1°122.1°
C22C11C17H712.9°146.1°
C22C11C17H8134.3°23.8°
C11C22H13H14117.9°120.0°
C22C11C30H19163.1°178.6°
C22C11C30H2043.3°61.3°
C23C24C25C260.5°0.0°
C23C24C25H15180.0°180.0°
C24C23C22H1322.1°24.5°
C24C23C22H14140.7°144.5°
C23C24C25H16179.5°180.0°
C24C23C28H18178.2°180.0°
C26C25C24H16180.0°180.0°
C26C25C24H15179.4°180.0°
C24C25C26H17180.0°179.9°
C17N16C8C15120.3°115.4°
N16C17C11H7119.4°118.8°
N16C17C11H8119.3°118.9°
C17N16C8C946.0°170.0°
N16C17C11C1415.6°23.9°
N16C17C11C30131.7°142.7°
C17N16C15C1436.3°39.5°
C17N16C15H582.8°158.2°
C17N16C15H6155.5°79.4°
N16C17H7H8121.9°122.5°
C17N16C8H2574.1°50.0°
C17N16C8H26166.0°70.0°
C8N16C17C11155.7°159.0°
N16C8C9H25120.1°119.9°
N16C8C9H26120.1°120.0°
C8N16C15C14160.9°159.0°
N16C8C9C1694.3°80.0°
N16C8C9C1085.9°100.0°
C8N16C15H541.8°82.2°
C8N16C15H679.9°40.2°
C8N16C17H785.0°40.3°
C8N16C17H836.4°82.2°
N16C8H25H26119.7°120.0°
C15N16C17C1132.6°39.5°
C15N16C8C974.3°74.6°
N16C15C14C1125.7°23.8°
N16C15C14H5119.1°118.8°
N16C15C14H6119.1°118.9°
N16C15C14H393.7°95.0°
N16C15C14H4145.2°142.7°
N16C15H5H6122.5°122.5°
C15N16C17H7151.9°79.3°
C15N16C17H886.7°158.3°
C15N16C8H25165.6°165.4°
C15N16C8H2645.8°45.4°
C17C11C14C30117.9°118.8°
C17C11C14C156.1°0.0°
C17C11C30N1243.2°63.7°
C17C11C14H3113.3°118.9°
C17C11C14H4125.6°118.9°
C11C17H7H8121.9°122.4°
C17C11C22H1364.0°55.7°
C17C11C22H1454.6°64.3°
C17C11C30H1976.9°56.4°
C17C11C30H20163.3°176.4°
C8C9C16C210.6°0.2°
C8C9C16C10179.8°180.0°
C8C9C16C12179.7°179.7°
C8C9C10N11180.0°180.0°
C8C9C10H20.0°0.2°
C9C8H25H26119.7°120.0°
C11C14C15H3119.5°118.9°
C11C14C15H4119.4°118.9°
C14C11C30N12157.9°179.2°
C11C14H3H4121.5°122.1°
C11C14C15H593.4°142.6°
C11C14C15H6144.9°95.1°
C14C11C17H7135.0°94.9°
C14C11C17H8103.7°142.7°
C14C11C22H13179.2°60.0°
C14C11C22H1462.2°180.0°
C14C11C30H1937.8°59.2°
C14C11C30H2082.0°60.9°
C30C11C14C15111.8°118.9°
C11C30N12H19120.1°120.1°
C11C30N12H20120.1°119.9°
C11C30N12C5131.8°175.0°
C30C11C14H3128.8°122.3°
C30C11C14H47.7°0.1°
C30C11C17H7109.0°23.9°
C30C11C17H812.4°98.4°
C30C11C22H1357.4°177.9°
C30C11C22H14176.0°57.9°
C11C30H19H20119.6°120.0°
C11C30N12H28106.9°5.0°
C15C14H3H4121.6°122.2°
C14C15H5H6122.5°122.4°
C20C21C16H12180.0°178.6°
C21C20C19H11180.0°179.0°
C20C21C16C9179.5°179.0°
C20C21C16C120.5°1.0°
C21C20C19C183.7°1.0°
C21C20C19H10176.3°179.0°
C16C21C20C190.9°1.4°
C21C16C9C12179.1°179.9°
C21C16C9C10179.6°179.8°
C21C16C12C180.7°0.0°
C21C16C12N11179.8°179.7°
C16C21C20H11179.1°179.6°
C20C19C18H10180.0°180.0°
C20C19C18C124.9°0.0°
C20C19C18H9175.1°180.0°
C19C20C21H12179.1°180.0°
C30N12C5H28121.3°179.9°
C30N12C5C6163.0°5.1°
C30N12C5C417.1°175.4°
N12C30H19H20119.6°120.0°
N12C5C6C4179.9°179.5°
N12C5C6C1179.4°180.0°
N12C5C4C3179.3°179.8°
C5N12C30H1911.6°64.9°
C5N12C30H20108.1°55.1°
N12C5C4H210.6°0.3°
N12C5C6H220.6°0.5°
C16C9C10N110.2°0.0°
C9C16C12C18178.5°179.9°
C9C16C12N110.6°0.4°
C16C9C10H2179.8°179.8°
C9C16C21H120.5°0.4°
C16C9C8H2525.8°160.0°
C16C9C8H26145.6°40.0°
C10C9C16C120.5°0.3°
C9C10N11H2180.0°179.8°
C9C10N11C120.2°0.2°
C10C9C8H25154.0°20.0°
C10C9C8H2634.2°140.0°
C9C10N11H27179.7°179.7°
C16C12C18C193.2°0.5°
C16C12N11C100.5°0.4°
C16C12C18N11178.9°179.6°
C16C12C18H9176.8°179.5°
C12C16C21H12179.5°179.5°
C16C12N11H27179.4°179.6°
C19C18C12H9180.0°179.9°
C19C18C12N11177.9°180.0°
C18C19C20H11176.3°180.0°
C5C6C1H22180.0°179.5°
C6C5C4C30.8°0.3°
C5C6C1C20.6°0.5°
C5C6C1H1179.4°179.8°
C6C5C4H21179.2°179.8°
C6C5N12H2841.7°174.9°
C4C5C6C10.4°0.5°
C5C4C3H21180.0°180.0°
C5C4C3C21.8°0.1°
C5C4C3N8179.4°180.0°
C4C5C6H22179.6°180.0°
C4C5N12H28138.5°4.6°
C6C1C2H1180.0°179.7°
C6C1C2C30.4°0.3°
C6C1C2C7177.7°179.8°
C10N11C12C18178.4°180.0°
C10N11C12H27180.0°179.9°
C12C18C19H10175.1°179.9°
C18C12N11H271.6°0.0°
C12N11C10H2179.8°180.0°
N11C12C18H92.1°0.1°
C4C3C2C11.6°0.1°
C4C3C2N8177.7°179.9°
C4C3C2C7179.0°180.0°
C4C3N8O1153.5°39.2°
C4C3N8O10127.5°84.8°
C1C2C3C7177.4°179.9°
C1C2C3N8179.2°180.0°
C1C2C7O913.9°0.1°
C2C1C6H22179.4°179.9°
C1C2C7H23104.7°120.0°
C1C2C7H24132.4°119.9°
C2C3N8O11124.1°140.9°
C2C3N8O1054.9°95.2°
C3C2C7O9163.6°179.9°
C3C2C1H1179.6°180.0°
C2C3C4H21178.3°180.0°
C3C2C7H2377.9°60.1°
C3C2C7H2445.0°59.9°
N8C3C2C73.4°0.1°
C3N8O11O10179.1°124.0°
N8C3C4H210.7°0.0°
C3N8O10H29180.0°56.0°
C3N8O11H31180.0°61.6°
C2C7O9H23118.5°119.9°
C2C7O9H24118.5°120.0°
C7C2C1H12.3°0.1°
C2C7H23H24124.1°120.0°
C2C7O9H30180.0°180.0°
O11N8O10H291.0°180.0°
O10N8O11H310.9°174.4°
O9C7H23H24124.2°120.0°
H1C1C6H220.6°0.2°
H2C10N11H270.2°0.1°
H3C14C15H5147.1°23.7°
H3C14C15H625.4°146.0°
H4C14C15H526.0°98.5°
H4C14C15H695.7°23.8°
H9C18C19H104.9°0.0°
H10C19C20H113.7°0.0°
H11C20C21H120.9°1.0°
H15C24C25H160.5°0.0°
H16C25C26H170.0°0.1°
H19C30N12H28132.9°115.0°
H20C30N12H2813.2°125.0°
H23C7O9H3061.5°60.0°
H24C7O9H3061.4°60.0°

248335

PDB entries from 2026-01-28

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