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68L

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CL1C23sing1.74Å1.74Å
C23C22doub1.39Å1.38ÅAromatic
C23C24sing1.39Å1.40ÅAromatic
C22N5sing1.32Å1.32ÅAromatic
C24C25doub1.39Å1.40ÅAromatic
N5C21doub1.33Å1.35ÅAromatic
C25C21sing1.39Å1.39ÅAromatic
C21C20sing1.48Å1.52Å
C20N2sing1.35Å1.34Å
C20O4doub1.21Å1.22Å
N2C1sing1.40Å1.35Å
N4C14sing1.37Å1.33Å
C1C6doub1.39Å1.38ÅAromatic
C1C2sing1.39Å1.40ÅAromatic
C14N3doub1.30Å1.32Å
C14O2sing1.35Å1.38Å
C6C5sing1.38Å1.38ÅAromatic
C2C3doub1.38Å1.40ÅAromatic
N3C9sing1.47Å1.49Å
O2C13sing1.44Å1.45Å
C5C9sing1.50Å1.52Å
C5C4doub1.39Å1.40ÅAromatic
C3C4sing1.39Å1.39ÅAromatic
C9C13sing1.54Å1.53Å
C9C8sing1.50Å1.52Å
C4O1sing1.36Å1.35Å
C8C12doub1.38Å1.40ÅAromatic
C8C7sing1.39Å1.40ÅAromatic
O1C7sing1.35Å1.35Å
C12C11sing1.40Å1.40ÅAromatic
C7C10doub1.39Å1.39ÅAromatic
C19C18sing1.50Å1.40Å
C19C15doub1.32Å1.39Å
C11C15sing1.48Å1.41Å
C11N1doub1.33Å1.35ÅAromatic
C10N1sing1.32Å1.33ÅAromatic
C18C17sing1.53Å1.53Å
C15C16sing1.50Å1.41Å
C17O3sing1.43Å1.44Å
C16O3sing1.43Å1.46Å
C16H1sing1.09Å1.10Å
C16H2sing1.09Å1.10Å
C17H3sing1.09Å1.10Å
C17H4sing1.09Å1.10Å
C18H5sing1.09Å1.10Å
C18H6sing1.09Å1.10Å
C19H7sing1.08Å1.08Å
C12H8sing1.08Å1.08Å
C10H9sing1.08Å1.08Å
C13H10sing1.09Å1.10Å
C13H11sing1.09Å1.10Å
N4H15sing0.97Å1.00Å
N4H16sing0.97Å1.00Å
C6H18sing1.08Å1.08Å
C3H19sing1.08Å1.08Å
C2H20sing1.08Å1.08Å
N2H21sing0.97Å1.00Å
C25H22sing1.08Å1.08Å
C24H23sing1.08Å1.08Å
C22H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CL1C23C22118.3°120.4°
CL1C23C24122.7°120.3°
C22C23C24119.0°119.3°
C23C22N5121.3°120.9°
C23C22H24119.3°119.5°
C23C24C25118.8°118.5°
C23C24H23120.6°120.8°
C22N5C21121.7°121.6°
N5C22H24119.4°119.6°
C24C25C21119.2°119.1°
C24C25H22120.4°120.5°
C25C24H23120.6°120.7°
N5C21C25120.0°120.6°
N5C21C20116.9°119.7°
C25C21C20123.0°119.7°
C21C25H22120.4°120.5°
C21C20N2113.0°119.9°
C21C20O4121.1°120.0°
N2C20O4125.9°120.0°
C20N2C1128.3°119.9°
C20N2H21115.8°120.1°
N2C1C6116.3°120.0°
N2C1C2125.0°120.1°
C1N2H21115.8°120.0°
N4C14N3123.6°123.1°
N4C14O2123.1°123.1°
C14N4H15120.0°120.0°
C14N4H16120.0°120.0°
C6C1C2118.6°119.9°
C1C6C5122.0°120.2°
C1C6H18119.0°119.9°
C1C2C3119.8°119.9°
C1C2H20120.1°120.0°
N3C14O2113.3°113.8°
C14N3C9109.5°108.2°
C14O2C13107.7°107.8°
C6C5C9117.8°119.7°
C6C5C4119.8°119.9°
C5C6H18119.0°119.9°
C2C3C4120.9°120.3°
C2C3H19119.5°119.9°
C3C2H20120.1°120.1°
N3C9C5108.8°110.7°
N3C9C13102.2°102.7°
N3C9C8110.2°111.0°
O2C13C9105.0°101.2°
O2C13H10110.6°111.1°
O2C13H11110.6°111.0°
C9C5C4122.3°120.5°
C5C9C13111.5°110.2°
C5C9C8110.0°111.5°
C5C4C3118.9°119.9°
C5C4O1122.5°120.9°
C3C4O1118.6°119.2°
C4C3H19119.6°119.9°
C13C9C8113.8°110.5°
C9C13H10110.6°111.1°
C9C13H11110.6°111.1°
C9C8C12120.2°120.6°
C9C8C7120.8°120.6°
C4O1C7118.9°120.5°
C12C8C7119.1°118.7°
C8C12C11120.3°119.1°
C8C12H8119.8°120.5°
C8C7O1124.1°120.8°
C8C7C10118.2°119.1°
O1C7C10117.6°120.0°
C12C11C15122.9°119.7°
C12C11N1118.2°120.5°
C11C12H8119.9°120.4°
C7C10N1121.4°120.8°
C7C10H9119.3°119.6°
C18C19C15126.0°122.3°
C19C18C17113.4°109.6°
C19C18H5108.5°109.4°
C19C18H6108.4°109.5°
C18C19H7117.0°118.8°
C19C15C11123.6°118.7°
C19C15C16116.1°122.6°
C15C19H7117.0°118.9°
C15C11N1118.8°119.7°
C11C15C16120.4°118.7°
C11N1C10122.8°121.8°
N1C10H9119.3°119.6°
C18C17O3112.6°108.5°
C18C17H3108.7°109.6°
C18C17H4108.7°109.8°
C17C18H5108.4°109.5°
C17C18H6108.5°109.4°
C15C16O3120.4°110.1°
C15C16H1106.7°109.4°
C15C16H2106.7°109.3°
C17O3C16112.4°113.1°
O3C17H3108.7°109.6°
O3C17H4108.7°109.6°
O3C16H1106.7°109.4°
O3C16H2106.7°109.3°
H1C16H2109.4°109.3°
H3C17H4109.5°109.7°
H5C18H6109.5°109.5°
H10C13H11109.5°111.0°
H15N4H16120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CL1C23C22C24179.8°179.7°
CL1C23C22N5180.0°180.0°
CL1C23C24C25179.9°179.7°
CL1C23C24H230.2°0.2°
CL1C23C22H240.1°0.2°
C23C22N5H24180.0°179.8°
C22C23C24C250.1°0.0°
C23C22N5C210.5°0.5°
C22C23C24H23179.9°180.0°
C24C23C22N50.2°0.2°
C23C24C25H23180.0°180.0°
C23C24C25C210.3°0.0°
C23C24C25H22179.7°179.9°
C24C23C22H24179.8°180.0°
C22N5C21C250.8°0.5°
C22N5C21C20179.8°179.7°
C24C25C21N50.7°0.3°
C24C25C21H22180.0°179.9°
C24C25C21C20179.6°180.0°
N5C21C25C20178.9°179.8°
N5C21C20N231.4°0.2°
N5C21C20O4150.6°179.7°
N5C21C25H22179.4°179.8°
C21N5C22H24179.5°179.7°
C25C21C20N2147.6°180.0°
C25C21C20O430.4°0.0°
C21C25C24H23179.7°180.0°
C21C20N2O4177.9°179.9°
C21C20N2C1175.9°175.4°
C21C20N2H214.1°4.6°
C20C21C25H220.4°0.0°
C20N2C1H21180.0°180.0°
C20N2C1C6167.2°144.9°
C20N2C1C216.3°35.1°
O4C20N2C16.2°4.6°
O4C20N2H21173.8°175.4°
N2C1C6C2176.7°180.0°
N2C1C6C5178.4°180.0°
N2C1C2C3177.8°179.8°
N2C1C6H181.6°0.0°
N2C1C2H202.2°0.1°
N4C14N3O2178.2°179.9°
N4C14N3C9178.9°179.5°
N4C14O2C13171.0°163.0°
C14N4H15H16180.0°179.9°
C1C6C5H18180.0°180.0°
C6C1C2C31.4°0.2°
C1C6C5C9178.6°179.9°
C1C6C5C41.0°0.1°
C6C1C2H20178.6°179.9°
C6C1N2H2112.8°35.1°
C2C1C6C51.7°0.0°
C1C2C3H20180.0°179.8°
C1C2C3C40.4°0.2°
C2C1C6H18178.3°180.0°
C1C2C3H19179.6°179.9°
C2C1N2H21163.7°144.9°
N3C14O2C137.3°17.0°
C14N3C9C5107.0°132.4°
C14N3C9C1311.0°14.8°
C14N3C9C8132.3°103.2°
N3C14N4H150.0°0.1°
N3C14N4H16180.0°180.0°
O2C14N3C92.9°0.4°
C14O2C13C913.8°24.3°
C14O2C13H10105.6°93.7°
C14O2C13H11133.0°142.3°
O2C14N4H15178.0°180.0°
O2C14N4H162.0°0.0°
C6C5C9N350.5°72.6°
C6C5C9C4179.6°179.8°
C6C5C4C30.1°0.1°
C6C5C9C1361.5°40.2°
C6C5C9C8171.3°163.3°
C6C5C4O1178.9°179.7°
C2C3C4C50.3°0.0°
C2C3C4H19180.0°179.9°
C2C3C4O1179.2°179.6°
N3C9C13O214.6°23.1°
N3C9C5C13112.0°112.9°
N3C9C5C8120.8°124.1°
N3C9C5C4130.0°107.6°
N3C9C13C8118.8°118.4°
N3C9C8C1250.7°72.7°
N3C9C8C7127.4°107.3°
N3C9C13H10104.7°94.9°
N3C9C13H11133.9°140.9°
O2C13C9C5101.5°141.1°
O2C13C9H10119.3°118.0°
O2C13C9H11119.3°117.9°
O2C13C9C8133.4°95.3°
O2C13H10H11122.1°124.0°
C9C5C4C3179.6°179.9°
C5C9C13C8125.1°123.6°
C9C5C4O11.5°0.5°
C5C9C8C12170.8°163.3°
C5C9C8C77.4°16.6°
C5C9C13H10139.2°23.1°
C5C9C13H1117.8°101.1°
C9C5C6H181.4°0.1°
C5C4C3O1178.9°179.6°
C4C5C9C13118.1°139.6°
C4C5C9C89.1°16.5°
C5C4O1C78.9°19.8°
C4C5C6H18179.0°179.9°
C5C4C3H19179.6°180.0°
C3C4O1C7169.9°160.6°
C4C3C2H20179.6°179.9°
C13C9C8C1263.3°40.4°
C13C9C8C7118.6°139.5°
C9C13H10H11122.1°124.2°
C9C8C12C7178.2°179.9°
C9C8C7O12.1°0.3°
C9C8C12C11179.0°179.8°
C9C8C7C10178.8°180.0°
C9C8C12H80.9°0.1°
C8C9C13H1014.1°146.7°
C8C9C13H11107.3°22.6°
C4O1C7C810.8°19.7°
C4O1C7C10170.1°160.7°
O1C4C3H190.7°0.4°
C12C8C7O1179.8°179.7°
C8C12C11H8180.0°179.9°
C12C8C7C100.7°0.1°
C8C12C11C15179.7°180.0°
C8C12C11N11.0°0.3°
C8C7O1C10179.1°179.6°
C7C8C12C110.9°0.1°
C8C7C10N10.7°0.2°
C7C8C12H8179.1°179.9°
C8C7C10H9179.4°179.8°
O1C7C10N1179.8°179.8°
O1C7C10H90.2°0.2°
C12C11C15C190.3°0.3°
C12C11C15N1178.6°179.7°
C12C11N1C101.0°0.2°
C12C11C15C16179.0°179.7°
C7C10N1C110.8°0.0°
C7C10N1H9180.0°180.0°
C18C19C15H7180.0°179.9°
C18C19C15C11179.7°179.6°
C19C18C17H5120.6°120.0°
C19C18C17H6120.6°120.1°
C18C19C15C161.6°0.5°
C19C18C17O337.2°48.1°
C19C18C17H383.2°71.5°
C19C18C17H4157.7°167.9°
C19C18H5H6118.2°119.9°
C19C15C11C16178.7°180.0°
C19C15C11N1178.3°179.9°
C15C19C18C1712.9°16.7°
C19C15C16O315.3°15.7°
C19C15C16H1136.9°135.9°
C19C15C16H2106.2°104.4°
C15C19C18H5133.5°136.7°
C15C19C18H6107.7°103.3°
C15C11N1C10179.7°179.9°
C11C15C16O3165.9°164.4°
C11C15C16H144.4°44.2°
C11C15C16H272.5°75.5°
C11C15C19H70.3°0.4°
C15C11C12H80.3°0.1°
N1C11C15C160.4°0.0°
N1C11C12H8179.0°179.8°
C11N1C10H9179.2°180.0°
C18C17O3H3120.5°119.6°
C18C17O3H4120.5°119.9°
C18C17O3C1650.0°68.7°
C18C17H3H4118.6°120.7°
C17C18H5H6118.2°120.0°
C17C18C19H7167.1°163.3°
C15C16O3C1740.7°50.5°
C15C16O3H1121.6°120.2°
C15C16O3H2121.5°120.1°
C15C16H1H2115.0°119.7°
C16C15C19H7178.4°179.6°
C17O3C16H1162.3°170.7°
C17O3C16H280.8°69.7°
O3C17H3H4118.5°120.4°
O3C17C18H5157.8°168.1°
O3C17C18H683.3°72.0°
O3C16H1H2115.1°119.7°
C16O3C17H370.4°51.0°
C16O3C17H4170.5°171.4°
H3C17C18H537.4°48.4°
H3C17C18H6156.2°168.4°
H4C17C18H581.7°72.1°
H4C17C18H637.1°47.8°
H5C18C19H746.6°43.3°
H6C18C19H772.3°76.6°
H19C3C2H200.4°0.1°
H22C25C24H230.3°0.0°

221051

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