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7M8

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1C20doub1.22Å1.22Å
C22N1sing1.46Å1.46Å
C20N1sing1.35Å1.38Å
C20N2sing1.35Å1.39Å
N1C18sing1.39Å1.40Å
N2C21sing1.46Å1.46Å
N2C17sing1.39Å1.40Å
C18C17doub1.40Å1.39ÅAromatic
C18C19sing1.39Å1.38ÅAromatic
C17C16sing1.39Å1.39ÅAromatic
C19C14doub1.39Å1.39ÅAromatic
O3C24doub1.22Å1.22Å
C16C15doub1.38Å1.40ÅAromatic
C14C15sing1.39Å1.40ÅAromatic
C14Nsing1.40Å1.44Å
C24Nsing1.35Å1.40Å
C24C3sing1.47Å1.48Å
C2C3doub1.39Å1.38ÅAromatic
C2C1sing1.39Å1.39ÅAromatic
C15C23sing1.51Å1.51Å
NC13sing1.35Å1.40Å
C3C4sing1.41Å1.42ÅAromatic
C1Cdoub1.37Å1.37ÅAromatic
C4C5doub1.41Å1.42ÅAromatic
C4C10sing1.41Å1.41ÅAromatic
CC5sing1.41Å1.42ÅAromatic
C13C10sing1.47Å1.48Å
C13O2doub1.22Å1.22Å
C5C6sing1.41Å1.43ÅAromatic
C10C11doub1.39Å1.38ÅAromatic
C11C12sing1.39Å1.38ÅAromatic
C6C12doub1.37Å1.38ÅAromatic
C6C7sing1.51Å1.51Å
C7C8sing1.53Å1.54Å
C8C9sing1.53Å1.50Å
C9Osing1.43Å1.40Å
C1H1sing1.08Å1.08Å
C2H2sing1.08Å1.08Å
C8H3sing1.09Å1.10Å
C8H4sing1.09Å1.10Å
C9H5sing1.09Å1.10Å
C9H6sing1.09Å1.10Å
C11H7sing1.08Å1.08Å
C12H8sing1.08Å1.08Å
C16H9sing1.08Å1.08Å
C19H10sing1.08Å1.08Å
C21H11sing1.09Å1.10Å
C21H12sing1.09Å1.10Å
C21H13sing1.09Å1.10Å
C7H14sing1.09Å1.10Å
C7H15sing1.09Å1.10Å
OH16sing0.97Å0.95Å
CH17sing1.08Å1.08Å
C22H18sing1.09Å1.10Å
C22H19sing1.09Å1.10Å
C22H20sing1.09Å1.10Å
C23H21sing1.09Å1.10Å
C23H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C20N1127.2°125.2°
O1C20N2126.8°125.1°
C22N1C20124.6°125.8°
C22N1C18125.6°125.8°
N1C22H18109.5°109.5°
N1C22H19109.5°109.5°
N1C22H20109.5°109.5°
N1C20N2105.9°109.7°
C20N1C18109.8°108.4°
C20N2C21124.0°125.9°
C20N2C17109.8°108.3°
N1C18C17107.4°106.8°
N1C18C19131.8°133.3°
C21N2C17126.2°125.9°
N2C21H11109.5°109.5°
N2C21H12109.5°109.5°
N2C21H13109.5°109.5°
N2C17C18107.0°106.8°
N2C17C16132.0°133.2°
C17C18C19120.8°119.9°
C18C17C16120.9°120.0°
C18C19C14117.9°119.8°
C18C19H10121.1°120.1°
C17C16C15119.7°119.9°
C17C16H9120.2°120.0°
C19C14C15122.7°120.1°
C19C14N118.0°119.9°
C14C19H10121.0°120.1°
O3C24N120.4°119.8°
O3C24C3123.1°119.8°
C16C15C14118.0°120.2°
C16C15C23120.0°119.9°
C15C16H9120.2°120.0°
C15C14N119.3°120.0°
C14C15C23121.9°119.9°
C14NC24117.2°118.8°
C14NC13116.9°118.7°
NC24C3116.6°120.4°
C24NC13125.6°122.4°
C24C3C2119.8°122.3°
C24C3C4120.0°118.7°
C3C2C1120.3°120.2°
C2C3C4120.2°119.0°
C3C2H2119.9°119.9°
C2C1C120.9°121.6°
C2C1H1119.5°119.2°
C1C2H2119.8°119.9°
C15C23H21109.5°109.5°
C15C23H22109.5°109.5°
C15C23H23109.5°109.4°
NC13C10116.5°120.4°
NC13O2120.3°119.8°
C3C4C5119.7°120.2°
C3C4C10120.9°119.5°
C1CC5120.9°120.1°
CC1H1119.5°119.2°
C1CH17119.5°120.0°
C5C4C10119.4°120.2°
C4C5C118.0°118.9°
C4C5C6119.1°118.9°
C4C10C13120.2°118.7°
C4C10C11120.1°119.1°
CC5C6122.9°122.2°
C5CH17119.5°119.9°
C10C13O2123.1°119.9°
C13C10C11119.8°122.3°
C5C6C12119.2°120.0°
C5C6C7121.2°120.0°
C10C11C12120.7°120.2°
C10C11H7119.7°119.9°
C11C12C6121.5°121.6°
C12C11H7119.6°119.9°
C11C12H8119.2°119.2°
C12C6C7119.6°120.0°
C6C12H8119.2°119.2°
C6C7C8114.3°109.5°
C6C7H14108.2°109.5°
C6C7H15108.2°109.5°
C7C8C9111.2°109.5°
C7C8H3109.0°109.4°
C7C8H4109.0°109.5°
C8C7H14108.3°109.5°
C8C7H15108.3°109.5°
C8C9O106.2°109.5°
C9C8H3109.0°109.5°
C9C8H4109.0°109.5°
C8C9H5110.3°109.5°
C8C9H6110.3°109.5°
OC9H5110.3°109.5°
OC9H6110.3°109.5°
C9OH16109.5°114.0°
H3C8H4109.5°109.5°
H5C9H6109.5°109.4°
H11C21H12109.5°109.4°
H11C21H13109.5°109.5°
H12C21H13109.5°109.5°
H14C7H15109.5°109.4°
H18C22H19109.5°109.4°
H18C22H20109.5°109.4°
H19C22H20109.5°109.5°
H21C23H22109.5°109.5°
H21C23H23109.4°109.5°
H22C23H23109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C20N1C223.2°0.0°
O1C20N1N2178.6°180.0°
O1C20N1C18178.1°179.9°
O1C20N2C211.8°0.0°
O1C20N2C17178.3°180.0°
C22N1C20C18178.7°180.0°
C22N1C20N2178.3°180.0°
C22N1C18C17178.3°180.0°
C22N1C18C191.6°0.3°
N1C22H18H19120.0°120.0°
N1C22H18H20120.0°120.0°
N1C22H19H20120.0°120.1°
N1C20N2C21179.7°180.0°
N1C20N2C170.3°0.0°
C20N1C18C170.4°0.0°
C20N1C18C19179.7°179.7°
C20N1C22H18180.0°0.0°
C20N1C22H1960.0°120.0°
C20N1C22H2060.0°120.0°
N2C20N1C180.5°0.0°
C20N2C21C17180.0°180.0°
C20N2C17C180.1°0.0°
C20N2C17C16179.0°180.0°
C20N2C21H11180.0°0.0°
C20N2C21H1260.0°119.9°
C20N2C21H1360.0°120.0°
N1C18C17N20.2°0.0°
N1C18C17C19179.9°179.8°
N1C18C17C16179.4°180.0°
N1C18C19C14179.7°179.8°
N1C18C19H100.3°0.3°
C18N1C22H181.5°180.0°
C18N1C22H19121.5°60.0°
C18N1C22H20118.5°60.1°
C21N2C17C18179.9°180.0°
C21N2C17C161.0°0.0°
N2C21H11H12120.0°120.0°
N2C21H11H13120.0°120.0°
N2C21H12H13120.0°120.0°
N2C17C18C16179.2°180.0°
N2C17C18C19179.9°179.7°
N2C17C16C15178.8°180.0°
N2C17C16H91.1°0.1°
C17N2C21H110.0°180.0°
C17N2C21H12120.0°60.1°
C17N2C21H13120.0°60.0°
C17C18C19C140.4°0.5°
C18C17C16C150.1°0.0°
C18C17C16H9179.9°180.0°
C17C18C19H10179.6°180.0°
C19C18C17C160.7°0.2°
C18C19C14H10180.0°179.4°
C18C19C14C150.7°0.6°
C18C19C14N178.6°179.8°
C17C16C15H9180.0°179.9°
C17C16C15C141.1°0.0°
C17C16C15C23176.6°180.0°
C19C14C15C161.5°0.3°
C19C14C15N179.3°179.6°
C19C14NC2482.8°89.7°
C19C14C15C23176.2°179.7°
C19C14NC1391.4°90.4°
O3C24NC146.6°0.1°
O3C24NC3178.5°180.0°
O3C24C3C23.2°0.1°
O3C24NC13179.7°180.0°
O3C24C3C4176.4°180.0°
C16C15C14C23177.7°179.9°
C16C15C14N177.9°179.9°
C16C15C23H2188.8°90.0°
C16C15C23H22151.2°30.0°
C16C15C23H2331.2°150.0°
C15C14NC2496.6°89.9°
C15C14NC1389.2°90.0°
C14C15C16H9178.9°179.9°
C15C14C19H10179.3°180.0°
C14C15C23H2188.8°90.0°
C14C15C23H2231.2°150.0°
C14C15C23H23151.2°29.9°
C14NC24C13173.7°179.9°
C14NC24C3171.9°179.9°
NC14C15C234.5°0.1°
C14NC13C10168.9°179.9°
C14NC13O214.5°0.1°
NC14C19H101.4°0.4°
NC24C3C2178.4°179.9°
NC24C3C42.0°0.0°
C24NC13C104.8°0.0°
C24NC13O2171.8°180.0°
C24C3C2C4179.6°179.9°
C24C3C2C1179.4°180.0°
C3C24NC131.8°0.0°
C24C3C4C5177.6°179.9°
C24C3C4C102.5°0.0°
C24C3C2H20.6°0.1°
C3C2C1H2180.0°179.9°
C3C2C1C1.2°0.0°
C2C3C4C52.0°0.0°
C2C3C4C10177.9°179.9°
C3C2C1H1178.8°179.8°
C1C2C3C40.2°0.1°
C2C1CH1180.0°179.7°
C2C1CC50.8°0.0°
C2C1CH17179.2°179.7°
C23C15C16H93.4°0.0°
C15C23H21H22120.0°120.0°
C15C23H21H23120.0°119.9°
C15C23H22H23120.0°120.0°
NC13C10C44.1°0.0°
NC13C10O2176.5°180.0°
NC13C10C11174.4°180.0°
C3C4C5C10180.0°179.9°
C3C4C5C2.4°0.1°
C3C4C10C130.6°0.0°
C3C4C5C6178.0°179.9°
C3C4C10C11177.8°179.9°
C4C3C2H2179.8°180.0°
C1CC5C41.0°0.1°
C1CC5H17180.0°179.7°
C1CC5C6179.4°179.9°
CC1C2H2178.8°179.9°
C4C5CC6179.7°179.8°
C5C4C10C13179.3°179.9°
C5C4C10C112.2°0.1°
C4C5C6C120.5°0.1°
C4C5C6C7179.5°179.9°
C4C5CH17179.0°179.8°
C10C4C5C177.6°180.0°
C4C10C13C11178.4°179.9°
C4C10C13O2172.4°180.0°
C10C4C5C62.1°0.1°
C4C10C11C120.8°0.1°
C4C10C11H7179.2°180.0°
CC5C6C12179.1°180.0°
CC5C6C70.8°0.1°
C5CC1H1179.2°179.7°
C13C10C11C12179.2°180.0°
C13C10C11H70.8°0.1°
O2C13C10C119.2°0.1°
C5C6C12C110.9°0.1°
C5C6C12C7179.9°179.9°
C5C6C7C8171.9°85.0°
C5C6C12H8179.1°180.0°
C5C6C7H1451.1°35.0°
C5C6C7H1567.4°154.9°
C6C5CH170.7°0.4°
C10C11C12H7180.0°179.9°
C10C11C12C60.8°0.1°
C10C11C12H8179.2°179.9°
C11C12C6H8180.0°179.9°
C11C12C6C7179.0°180.0°
C12C6C7C88.2°95.0°
C6C12C11H7179.2°180.0°
C12C6C7H14128.9°145.0°
C12C6C7H15112.5°25.0°
C6C7C8H14120.7°120.0°
C6C7C8H15120.7°120.0°
C6C7C8C9164.9°180.0°
C6C7C8H374.8°60.0°
C6C7C8H444.6°60.0°
C7C6C12H81.0°0.1°
C6C7H14H15117.8°120.0°
C7C8C9H3120.3°119.9°
C7C8C9H4120.3°120.0°
C7C8C9O52.8°180.0°
C7C8H3H4119.2°120.0°
C7C8C9H5172.3°59.9°
C7C8C9H666.7°60.0°
C8C7H14H15117.8°120.0°
C8C9OH5119.5°120.0°
C8C9OH6119.5°120.0°
C9C8H3H4119.2°120.0°
C8C9H5H6121.5°120.0°
C9C8C7H1444.2°60.0°
C9C8C7H1574.4°60.0°
C8C9OH16180.0°180.0°
OC9C8H367.5°60.0°
OC9C8H4173.1°60.0°
OC9H5H6121.5°120.0°
H1C1C2H21.2°0.3°
H1C1CH170.7°0.0°
H3C8C9H552.0°60.0°
H3C8C9H6173.1°179.9°
H3C8C7H14164.5°180.0°
H3C8C7H1545.9°60.0°
H4C8C9H567.5°180.0°
H4C8C9H653.6°60.0°
H4C8C7H1476.1°60.0°
H4C8C7H15165.3°180.0°
H5C9OH1660.6°59.9°
H6C9OH1660.5°60.0°
H7C11C12H80.8°0.1°
H11C21H12H13120.0°120.0°
H18C22H19H20120.0°119.9°
H21C23H22H23119.9°120.0°

224931

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