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H28

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O12C11doub1.21Å1.22Å
CL1C2sing1.74Å1.75Å
F34C33sing1.35Å1.35Å
C11N13sing1.34Å1.34Å
C11C9sing1.51Å1.53Å
C2C33doub1.39Å1.39ÅAromatic
C2C3sing1.38Å1.39ÅAromatic
N13C14doub1.29Å1.47Å
C33C6sing1.38Å1.40ÅAromatic
C3C4doub1.38Å1.38ÅAromatic
C6C7sing1.51Å1.53Å
C6C5doub1.38Å1.41ÅAromatic
C4C5sing1.38Å1.40ÅAromatic
C7C9sing1.55Å1.54Å
C7C22sing1.54Å1.55Å
C9C15sing1.55Å1.56Å
C14C15sing1.51Å1.56Å
C31C30doub1.38Å1.39ÅAromatic
C31C32sing1.38Å1.40ÅAromatic
C30C28sing1.38Å1.38ÅAromatic
C15N17sing1.48Å1.48Å
C22C32sing1.50Å1.51Å
C22N17sing1.47Å1.48Å
C22C23sing1.50Å1.53Å
C32C26doub1.39Å1.40ÅAromatic
N17C18sing1.47Å1.49Å
C28CL9sing1.74Å1.72Å
C28C27doub1.38Å1.39ÅAromatic
C21C19sing1.53Å1.52Å
C21C20sing1.53Å1.54Å
C26C27sing1.39Å1.40ÅAromatic
C26N25sing1.40Å1.40Å
C23O24doub1.21Å1.21Å
C23N25sing1.35Å1.35Å
C19C18sing1.53Å1.53Å
C19C20sing1.53Å1.52Å
C4H1sing1.08Å1.08Å
C5H2sing1.08Å1.08Å
C7H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C20H5sing1.09Å1.10Å
C20H6sing1.09Å1.10Å
C21H7sing1.09Å1.10Å
C21H8sing1.09Å1.10Å
C3H9sing1.08Å1.08Å
C9H10sing1.09Å1.10Å
C14H11sing1.08Å1.08Å
C18H13sing1.09Å1.10Å
C18H14sing1.09Å1.10Å
C19H15sing1.09Å1.10Å
N25H16sing0.97Å1.00Å
C27H17sing1.08Å1.08Å
C30H18sing1.08Å1.08Å
C31H19sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O12C11N13122.9°125.5°
O12C11C9126.0°125.6°
CL1C2C33118.2°120.0°
CL1C2C3122.8°120.0°
F34C33C2117.0°120.0°
F34C33C6121.4°120.1°
N13C11C9111.1°108.9°
C11N13C14111.4°115.5°
C11C9C7113.1°109.1°
C11C9C15106.5°102.6°
C11C9H10111.0°113.4°
C33C2C3119.0°120.0°
C2C33C6121.7°119.9°
C2C3C4120.6°120.0°
C2C3H9119.7°120.0°
N13C14C15108.7°110.1°
N13C14H11125.6°125.0°
C33C6C7117.0°120.0°
C33C6C5118.3°119.9°
C3C4C5120.7°120.1°
C3C4H1119.6°120.0°
C4C3H9119.7°120.0°
C7C6C5124.8°120.1°
C6C7C9115.9°110.7°
C6C7C22112.9°110.7°
C6C7H3108.1°110.7°
C6C5C4119.8°120.1°
C6C5H2120.1°119.9°
C5C4H1119.6°120.0°
C4C5H2120.1°120.0°
C9C7C22103.6°102.9°
C7C9C15104.5°105.0°
C9C7H3108.0°110.8°
C7C9H10110.8°112.9°
C7C22C32114.8°111.6°
C7C22N17101.5°104.8°
C7C22C23113.1°111.5°
C22C7H3107.9°110.9°
C9C15C14102.3°103.0°
C9C15N17105.7°106.9°
C9C15H4111.9°112.4°
C15C9H10110.6°113.0°
C14C15N17111.6°108.9°
C14C15H4111.8°112.8°
C15C14H11125.6°125.0°
C30C31C32118.7°120.0°
C31C30C28121.3°119.9°
C31C30H18119.3°120.1°
C30C31H19120.6°119.9°
C31C32C22133.2°133.6°
C31C32C26120.3°120.7°
C32C31H19120.7°120.0°
C30C28CL9118.1°119.9°
C30C28C27120.4°120.3°
C28C30H18119.4°120.1°
C15N17C22105.4°106.0°
C15N17C18113.0°111.0°
N17C15H4113.0°112.3°
C32C22N17111.7°112.0°
C32C22C23103.8°105.2°
C22C32C26106.5°105.8°
N17C22C23112.2°112.0°
C22N17C18114.8°111.0°
C22C23O24126.2°126.7°
C22C23N25107.5°106.7°
C32C26C27119.9°118.9°
C32C26N25110.4°110.2°
N17C18C19110.8°109.5°
N17C18H13109.1°109.5°
N17C18H14109.1°109.5°
CL9C28C27121.5°119.8°
C28C27C26119.4°120.2°
C28C27H17120.3°119.9°
C19C21C2059.5°60.0°
C21C19C18115.7°117.5°
C21C19C2060.9°60.0°
C19C21H7120.1°117.5°
C19C21H8120.1°117.5°
C21C19H15117.8°117.5°
C21C20C1959.6°60.0°
C21C20H5120.0°117.5°
C21C20H6120.1°117.5°
C20C21H7120.1°117.5°
C20C21H8120.1°117.6°
C27C26N25129.7°130.9°
C26C27H17120.3°119.8°
C26N25C23111.8°112.1°
C26N25H16124.1°123.9°
O24C23N25126.2°126.7°
C23N25H16124.1°124.0°
C18C19C20114.6°117.5°
C19C18H13109.1°109.5°
C19C18H14109.1°109.5°
C18C19H15117.7°115.6°
C19C20H5120.1°117.5°
C19C20H6120.0°117.5°
C20C19H15117.8°117.5°
H5C20H6109.5°115.6°
H7C21H8109.5°115.5°
H13C18H14109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O12C11N13C9178.1°179.9°
O12C11N13C14180.0°179.3°
O12C11C9C765.2°67.9°
O12C11C9C15179.3°178.9°
O12C11C9H1060.2°58.9°
CL1C2C33F341.4°0.8°
CL1C2C33C3178.8°179.2°
CL1C2C33C6179.7°180.0°
CL1C2C3C4179.0°179.8°
CL1C2C3H91.0°0.8°
F34C33C2C6179.0°179.2°
F34C33C2C3179.9°180.0°
F34C33C6C70.0°0.3°
F34C33C6C5179.6°179.7°
N13C11C9C7116.8°112.1°
N13C11C9C152.6°1.0°
C11N13C14C150.4°0.1°
N13C11C9H10117.9°121.2°
C11N13C14H11179.6°179.8°
C9C11N13C141.9°0.6°
C11C9C7C699.4°110.9°
C11C9C7C15115.4°109.4°
C11C9C7H10125.5°127.0°
C11C9C7C22136.3°130.8°
C11C9C15H10120.8°122.5°
C11C9C15C142.1°1.0°
C11C9C15N17114.7°113.6°
C11C9C7H322.0°12.3°
C11C9C15H4121.9°122.7°
C33C2C3C40.2°0.5°
C2C33C6C7179.0°179.5°
C2C33C6C50.6°0.5°
C33C2C3H9179.8°180.0°
C3C2C33C60.9°0.8°
C2C3C4H9180.0°179.4°
C2C3C4C50.6°0.0°
C2C3C4H1179.4°179.7°
N13C14C15C91.2°0.8°
N13C14C15H11180.0°180.0°
N13C14C15N17111.3°112.4°
N13C14C15H4121.0°122.2°
C33C6C7C5179.6°180.0°
C33C6C5C40.2°0.0°
C33C6C7C9148.0°143.5°
C33C6C7C2292.7°103.1°
C33C6C5H2179.8°180.0°
C33C6C7H326.6°20.2°
C3C4C5C60.8°0.3°
C3C4C5H1180.0°179.7°
C3C4C5H2179.2°179.8°
C7C6C5C4179.8°180.0°
C6C7C9C22124.3°118.3°
C6C7C9H3121.4°123.1°
C6C7C22H3119.4°123.2°
C6C7C9C15145.2°139.7°
C6C7C22C3273.6°84.0°
C6C7C22N17165.8°154.6°
C6C7C22C2345.3°33.3°
C7C6C5H20.2°0.0°
C6C7C9H1026.0°16.2°
C6C5C4H2180.0°179.9°
C5C6C7C931.6°36.6°
C5C6C7C2287.7°76.9°
C6C5C4H1179.1°180.0°
C5C6C7H3153.0°159.8°
C5C4C3H9179.4°179.5°
C9C7C22H3114.4°118.4°
C7C9C15H10119.3°123.5°
C7C9C15C14122.1°115.1°
C7C9C15N175.2°0.4°
C9C7C22C32160.3°157.6°
C9C7C22N1739.6°36.3°
C9C7C22C2380.8°85.0°
C7C9C15H4118.2°123.2°
C22C7C9C1521.0°21.4°
C7C22C32C3158.4°58.9°
C7C22N17C1544.0°37.6°
C7C22C32N17114.8°117.1°
C7C22C32C23124.0°121.1°
C7C22N17C23121.1°121.0°
C7C22C32C26122.9°121.0°
C7C22N17C18169.0°158.2°
C7C22C23O2455.9°58.9°
C7C22C23N25123.8°121.1°
C22C7C9H1098.2°102.2°
C9C15C14N17112.5°113.2°
C9C15C14H4119.8°121.4°
C9C15N17H4122.7°123.7°
C9C15N17C2231.0°23.5°
C9C15N17C18157.1°144.1°
C15C9C7H393.4°97.1°
C9C15C14H11178.8°179.2°
C14C15N17H4127.0°125.7°
C14C15N17C22141.3°134.1°
C14C15N17C1892.5°105.3°
C14C15C9H10118.6°121.4°
C30C31C32H19180.0°180.0°
C31C30C28H18180.0°180.0°
C30C31C32C22179.9°180.0°
C30C31C32C261.3°0.0°
C31C30C28CL9179.1°179.9°
C31C30C28C270.3°0.0°
C32C31C30C281.0°0.0°
C31C32C22C26178.8°179.9°
C31C32C22N1756.4°58.1°
C31C32C22C23177.6°180.0°
C31C32C26C270.4°0.0°
C31C32C26N25178.2°180.0°
C32C31C30H18179.0°180.0°
C30C28CL9C27178.7°180.0°
C30C28C27C261.2°0.0°
C30C28C27H17178.7°179.9°
C28C30C31H19179.0°180.0°
C15N17C22C32166.7°158.7°
C15N17C22C18125.0°120.6°
C15N17C22C2377.1°83.5°
C15N17C18C1983.0°69.9°
N17C15C9H10124.6°123.9°
N17C15C14H1168.7°67.6°
C15N17C18H1337.2°50.1°
C15N17C18H14156.9°170.1°
C32C22N17C23116.1°117.9°
C32C22N17C1868.2°80.7°
C22C32C26C27179.3°180.0°
C22C32C26N250.7°0.1°
C32C22C23O24179.0°180.0°
C32C22C23N251.2°0.0°
C32C22C7H345.8°39.2°
C22C32C31H190.1°0.1°
N17C22C32C26122.3°121.9°
N17C22C23O2458.2°58.1°
N17C22C23N25122.0°121.9°
C22N17C18C19156.1°172.5°
N17C22C7H374.8°82.1°
C22N17C15H491.7°100.2°
C22N17C18H1383.7°67.5°
C22N17C18H1435.9°52.5°
C23C22C32C261.2°0.1°
C23C22N17C1847.9°37.2°
C22C23N25C260.9°0.0°
C22C23O24N25179.7°180.0°
C23C22C7H3164.8°156.5°
C22C23N25H16179.1°180.0°
C32C26C27C280.9°0.0°
C32C26C27N25178.3°179.9°
C32C26N25C230.1°0.1°
C32C26N25H16179.8°180.0°
C32C26C27H17179.1°179.9°
C26C32C31H19178.7°180.0°
N17C18C19C2180.9°175.0°
N17C18C19H13120.2°120.0°
N17C18C19H14120.2°120.0°
N17C18C19C20149.0°116.4°
C18N17C15H434.5°20.4°
N17C18H13H14119.4°120.0°
N17C18C19H1565.9°29.3°
CL9C28C27C26179.9°180.0°
CL9C28C27H170.0°0.1°
CL9C28C30H180.9°0.0°
C28C27C26H17180.0°180.0°
C28C27C26N25179.2°179.9°
C27C28C30H18179.7°180.0°
C19C21C20H7109.3°107.5°
C19C21C20H8109.3°107.5°
C21C19C18C2068.1°68.6°
C21C19C18H15146.8°145.7°
C21C19C20H15108.1°107.5°
C19C21C20H5109.4°107.5°
C19C21C20H6109.4°107.5°
C19C21H7H8145.0°145.6°
C21C19C18H13158.9°65.0°
C21C19C18H1439.2°55.1°
C21C20H5H6144.9°145.6°
C20C21H7H8145.0°145.8°
C27C26N25C23178.3°180.0°
C27C26N25H161.7°0.1°
C26N25C23O24179.4°180.0°
C26N25C23H16180.0°180.0°
N25C26C27H170.8°0.0°
O24C23N25H160.6°0.0°
C18C19C20H15145.0°145.0°
C18C19C20H52.4°0.0°
C18C19C20H6143.7°145.1°
C18C19C21H74.2°145.0°
C18C19C21H8145.6°0.1°
C19C18H13H14119.4°120.0°
C19C20H5H6145.0°145.8°
C20C19C18H1390.8°3.6°
C20C19C18H1428.8°123.7°
H1C4C5H20.8°0.0°
H1C4C3H90.6°0.3°
H3C7C9H10147.4°139.3°
H4C15C9H101.2°0.3°
H4C15C14H1159.0°57.7°
H5C20C21H70.0°145.1°
H5C20C21H8141.3°0.0°
H5C20C19H15142.6°145.1°
H6C20C21H7141.3°0.1°
H6C20C21H80.0°145.0°
H6C20C19H151.3°0.0°
H7C21C19H15142.6°0.0°
H8C21C19H151.2°145.0°
H13C18C19H1554.3°149.3°
H14C18C19H15173.9°90.6°
H18C30C31H191.0°0.0°

223532

PDB entries from 2024-08-07

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