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DJ8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C4C5doub1.38Å1.38ÅAromatic
C4C3sing1.38Å1.37ÅAromatic
CLC3sing1.74Å1.74Å
O2C16sing1.42Å1.43Å
O2C17sing1.43Å1.44Å
C5C6sing1.38Å1.39ÅAromatic
C16C15sing1.53Å1.51Å
C3C2doub1.38Å1.38ÅAromatic
C15O1sing1.43Å1.45Å
C17C18sing1.53Å1.51Å
C18N2sing1.48Å1.46Å
C6C7sing1.51Å1.51Å
C6C1doub1.38Å1.41ÅAromatic
O1C14sing1.36Å1.37Å
NC7sing1.46Å1.46Å
NC8sing1.35Å1.36Å
C2C1sing1.38Å1.39ÅAromatic
C1Csing1.51Å1.51Å
N1C8sing1.35Å1.37Å
N1C9sing1.40Å1.42Å
N2C19sing1.40Å1.36Å
C14C9doub1.39Å1.40ÅAromatic
C14C13sing1.38Å1.38ÅAromatic
C8Odoub1.22Å1.23Å
C9C10sing1.39Å1.39ÅAromatic
C13C12doub1.39Å1.39ÅAromatic
C19N5doub1.32Å1.33ÅAromatic
C19C20sing1.41Å1.43ÅAromatic
N5C24sing1.34Å1.34ÅAromatic
C10C11doub1.38Å1.38ÅAromatic
C12C11sing1.40Å1.39ÅAromatic
C12C23sing1.48Å1.48Å
C20C21doub1.35Å1.35ÅAromatic
C24C23doub1.40Å1.40ÅAromatic
C24N3sing1.37Å1.36ÅAromatic
C23C22sing1.40Å1.40ÅAromatic
C21N3sing1.37Å1.36ÅAromatic
N3N4sing1.40Å1.38ÅAromatic
C22N4doub1.31Å1.32ÅAromatic
N1H1sing0.97Å1.00Å
C7H2sing1.09Å1.10Å
C7H3sing1.09Å1.10Å
N2H4sing0.97Å1.00Å
C5H5sing1.08Å1.08Å
C4H6sing1.08Å1.08Å
C2H7sing1.08Å1.08Å
NH8sing0.97Å1.00Å
CH9sing1.09Å1.10Å
CH10sing1.09Å1.10Å
CH11sing1.09Å1.10Å
C13H12sing1.08Å1.08Å
C15H13sing1.09Å1.10Å
C15H14sing1.09Å1.10Å
C16H15sing1.09Å1.10Å
C16H16sing1.09Å1.10Å
C17H17sing1.09Å1.10Å
C17H18sing1.09Å1.10Å
C18H19sing1.09Å1.10Å
C18H20sing1.09Å1.10Å
C21H21sing1.08Å1.08Å
C20H22sing1.08Å1.08Å
C22H23sing1.08Å1.08Å
C11H24sing1.08Å1.08Å
C10H25sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C5C4C3118.8°120.0°
C4C5C6121.3°120.0°
C4C5H5119.3°120.0°
C5C4H6120.6°120.0°
C4C3CL119.3°120.1°
C4C3C2121.3°119.9°
C3C4H6120.5°119.9°
CLC3C2119.3°120.0°
C16O2C17117.2°114.7°
O2C16C15110.2°110.1°
O2C16H15109.3°109.0°
O2C16H16109.3°109.4°
O2C17C18109.3°108.7°
O2C17H17109.5°109.6°
O2C17H18109.5°109.6°
C5C6C7119.4°120.0°
C5C6C1119.5°120.0°
C6C5H5119.4°120.0°
C16C15O1111.0°108.9°
C16C15H13109.1°109.6°
C16C15H14109.1°109.7°
C15C16H15109.3°109.4°
C15C16H16109.3°109.4°
C3C2C1120.5°120.0°
C3C2H7119.8°120.0°
C15O1C14118.3°117.4°
O1C15H13109.1°109.6°
O1C15H14109.1°109.5°
C17C18N2113.3°108.5°
C18C17H17109.5°109.6°
C18C17H18109.5°109.6°
C17C18H19108.5°109.6°
C17C18H20108.5°109.6°
C18N2C19124.5°115.7°
C18N2H4105.6°122.2°
N2C18H19108.5°109.7°
N2C18H20108.5°109.7°
C7C6C1121.1°120.0°
C6C7N113.3°109.5°
C6C7H2108.5°109.5°
C6C7H3108.5°109.4°
C6C1C2118.5°120.0°
C6C1C121.9°120.0°
O1C14C9115.8°119.3°
O1C14C13123.5°120.9°
C7NC8122.4°120.0°
NC7H2108.5°109.5°
NC7H3108.5°109.5°
C7NH8118.8°120.0°
NC8N1114.4°120.0°
NC8O122.7°120.0°
C8NH8118.8°120.0°
C2C1C119.5°120.0°
C1C2H7119.7°120.0°
C1CH9109.5°109.4°
C1CH10109.5°109.5°
C1CH11109.5°109.5°
C8N1C9124.2°119.9°
N1C8O122.8°120.0°
C8N1H1117.9°120.0°
N1C9C14119.2°119.8°
N1C9C10121.4°119.9°
C9N1H1117.9°120.0°
N2C19N5115.3°120.8°
N2C19C20121.1°118.8°
C19N2H4105.6°122.2°
C9C14C13120.6°119.8°
C14C9C10119.2°120.2°
C14C13C12120.0°120.1°
C14C13H12120.0°120.0°
C9C10C11120.0°120.0°
C9C10H25120.0°120.0°
C13C12C11119.4°119.7°
C13C12C23119.6°121.4°
C12C13H12120.0°120.0°
N5C19C20123.5°120.4°
C19N5C24115.8°120.9°
C19C20C21117.6°119.1°
C19C20H22121.2°120.5°
N5C24C23129.9°133.2°
N5C24N3122.8°120.1°
C10C11C12120.8°120.1°
C10C11H24119.6°120.0°
C11C10H25120.0°119.9°
C11C12C23121.0°118.8°
C12C11H24119.6°119.9°
C12C23C24127.5°128.3°
C12C23C22128.3°124.5°
C20C21N3118.7°119.2°
C20C21H21120.6°120.4°
C21C20H22121.2°120.5°
C23C24N3106.3°106.7°
C24C23C22104.3°107.1°
C24N3C21120.8°120.2°
C24N3N4112.3°108.0°
C23C22N4113.2°108.9°
C23C22H23123.4°125.5°
C21N3N4126.9°131.8°
N3C21H21120.7°120.3°
N3N4C22104.1°109.2°
N4C22H23123.4°125.6°
H2C7H3109.5°109.4°
H9CH10109.5°109.5°
H9CH11109.5°109.5°
H10CH11109.5°109.5°
H13C15H14109.5°109.5°
H15C16H16109.5°109.5°
H17C17H18109.5°109.8°
H19C18H20109.5°109.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C5C4C3H6180.0°179.7°
C5C4C3CL175.6°180.0°
C4C5C6H5180.0°179.9°
C5C4C3C21.1°0.3°
C4C5C6C7180.0°180.0°
C4C5C6C10.4°0.0°
C4C3CLC2176.7°179.7°
C3C4C5C60.3°0.3°
C4C3C2C11.0°0.0°
C3C4C5H5179.7°179.7°
C4C3C2H7179.0°180.0°
CLC3C2C1175.6°179.7°
CLC3C4H64.4°0.3°
CLC3C2H74.3°0.3°
O2C16C15H15120.1°119.8°
O2C16C15H16120.1°120.3°
O2C16C15O1175.3°151.9°
C16O2C17C1882.1°148.7°
O2C16C15H1364.4°88.2°
O2C16C15H1455.1°32.1°
O2C16H15H16119.7°119.6°
C16O2C17H1737.9°28.9°
C16O2C17H18158.0°91.6°
C17O2C16C1587.0°97.8°
O2C17C18H17119.9°119.8°
O2C17C18H18119.9°119.7°
O2C17C18N2167.0°175.5°
C17O2C16H1533.1°22.3°
C17O2C16H16152.9°141.9°
O2C17H17H18120.1°120.4°
O2C17C18H1972.4°64.7°
O2C17C18H2046.5°55.8°
C5C6C7C1179.5°180.0°
C5C6C7N92.0°100.0°
C5C6C1C20.5°0.3°
C5C6C1C179.6°180.0°
C5C6C7H2147.4°20.0°
C5C6C7H328.5°140.0°
C6C5C4H6179.7°180.0°
C16C15O1H13120.2°119.9°
C16C15O1H14120.2°120.0°
C16C15O1C1476.4°105.0°
C16C15H13H14119.3°120.4°
C15C16H15H16119.7°119.9°
C3C2C1C60.2°0.3°
C3C2C1H7180.0°180.0°
C3C2C1C179.7°180.0°
C2C3C4H6179.0°180.0°
C15O1C14C9177.2°150.5°
C15O1C14C131.8°29.7°
O1C15H13H14119.3°120.2°
O1C15C16H1555.2°32.1°
O1C15C16H1664.6°87.8°
C17C18N2H19120.5°119.7°
C17C18N2H20120.6°119.7°
C17C18N2C1977.6°67.8°
C17C18N2H444.5°111.9°
C18C17H17H18120.1°120.4°
C17C18H19H20118.3°120.4°
C18N2C19H4122.1°179.7°
C18N2C19N55.0°14.7°
C18N2C19C20174.9°165.0°
N2C18C17H1747.1°64.7°
N2C18C17H1873.0°55.8°
N2C18H19H20118.3°120.6°
C6C7NH2120.6°120.0°
C6C7NH3120.5°120.0°
C6C7NC8133.1°180.0°
C7C6C1C2180.0°179.7°
C7C6C1C0.1°0.0°
C6C7H2H3118.2°119.9°
C7C6C5H50.0°0.0°
C6C7NH846.9°0.1°
C1C6C7N87.5°80.0°
C6C1C2C179.9°179.7°
C1C6C7H233.0°160.0°
C1C6C7H3151.9°40.0°
C1C6C5H5179.6°180.0°
C6C1C2H7179.8°179.7°
C6C1CH990.1°90.0°
C6C1CH10149.9°150.0°
C6C1CH1130.0°30.0°
O1C14C9N18.7°0.4°
O1C14C9C13179.0°179.8°
O1C14C9C10177.4°179.5°
O1C14C13C12178.5°179.8°
O1C14C13H121.5°0.2°
C14O1C15H13163.4°135.1°
C14O1C15H1443.8°15.0°
C7NC8H8180.0°179.9°
C7NC8N1175.1°180.0°
C7NC8O0.1°0.0°
NC7H2H3118.3°120.1°
NC8N1O175.0°180.0°
NC8N1C9175.5°174.4°
NC8N1H14.5°5.9°
C8NC7H212.5°60.0°
C8NC7H3106.4°60.0°
C2C1CH990.0°90.3°
C2C1CH1030.0°29.7°
C2C1CH11149.9°149.7°
CC1C2H70.3°0.0°
C1CH9H10120.0°120.0°
C1CH9H11120.0°120.0°
C1CH10H11120.0°120.0°
C8N1C9H1180.0°179.8°
C8N1C9C14140.0°155.3°
C8N1C9C1046.3°24.8°
N1C8NH84.9°0.1°
N1C9C14C10173.9°179.9°
N1C9C14C13172.3°179.4°
C9N1C8O9.5°5.6°
N1C9C10C11172.0°179.7°
N1C9C10H258.0°0.2°
N2C19N5C20179.9°179.8°
N2C19N5C24172.7°179.3°
N2C19C20C21178.6°178.8°
C19N2C18H19161.8°51.9°
C19N2C18H2043.0°172.5°
N2C19C20H221.4°1.2°
C9C14C13C120.4°0.4°
C14C9C10C111.7°0.4°
C14C9N1H140.0°24.5°
C9C14C13H12179.6°179.6°
C14C9C10H25178.3°179.7°
C13C14C9C101.5°0.7°
C14C13C12H12180.0°180.0°
C14C13C12C110.6°0.2°
C14C13C12C23179.6°179.5°
OC8N1H1170.5°174.1°
OC8NH8179.9°180.0°
C9C10C11H25180.0°179.9°
C9C10C11C120.7°0.2°
C10C9N1H1133.8°155.4°
C9C10C11H24179.3°179.7°
C13C12C11C100.5°0.5°
C13C12C11C23179.8°179.7°
C13C12C23C2417.4°3.6°
C13C12C23C22161.7°175.7°
C13C12C11H24179.5°179.4°
N5C19C20C211.5°1.0°
C19N5C24C23177.4°179.1°
C19N5C24N310.6°0.8°
N5C19N2H4117.0°164.9°
N5C19C20H22178.5°179.0°
C20C19N5C247.3°0.5°
C19C20C21H22180.0°180.0°
C19C20C21N31.5°0.2°
C20C19N2H463.0°15.3°
C19C20C21H21178.5°179.7°
N5C24C23C1211.7°1.9°
N5C24C23N3168.5°180.0°
N5C24C23C22169.0°178.7°
N5C24N3C218.1°1.6°
N5C24N3N4170.0°178.5°
C10C11C12H24180.0°179.9°
C10C11C12C23179.8°179.2°
C11C12C23C24162.8°176.6°
C11C12C23C2218.1°4.1°
C11C12C13H12179.4°179.8°
C12C11C10H25179.3°179.7°
C12C23C24C22179.3°179.4°
C12C23C24N3179.8°178.1°
C12C23C22N4179.7°178.8°
C23C12C13H120.4°0.5°
C12C23C22H230.3°1.3°
C23C12C11H240.2°0.9°
C20C21N3C241.6°1.1°
C20C21N3H21180.0°179.9°
C20C21N3N4176.2°179.2°
C23C24N3C21177.6°178.3°
C23C24N3N40.5°1.5°
C24C23C22N40.4°0.6°
C24C23C22H23179.6°179.3°
N3C24C23C220.6°1.3°
C24N3C21N4177.8°179.7°
C24N3N4C220.3°1.1°
C24N3C21H21178.4°179.0°
C23C22N4N30.1°0.3°
C23C22N4H23180.0°179.9°
C21N3N4C22177.7°178.6°
N3C21C20H22178.5°179.8°
N4N3C21H213.8°0.8°
N3N4C22H23179.9°179.8°
H2C7NH8167.5°119.9°
H3C7NH873.6°120.0°
H4N2C18H1976.1°128.4°
H4N2C18H20165.0°7.8°
H5C5C4H60.3°0.0°
H9CH10H11120.0°120.0°
H13C15C16H15175.5°152.0°
H13C15C16H1655.7°32.0°
H14C15C16H1565.0°87.7°
H14C15C16H16175.2°152.3°
H17C17C18H19167.6°55.1°
H17C17C18H2073.5°175.6°
H18C17C18H1947.5°175.5°
H18C17C18H20166.4°63.9°
H21C21C20H221.5°0.3°
H24C11C10H250.7°0.3°

225946

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