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LN4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F38C37sing1.40Å1.34Å
C05C06doub1.38Å1.38ÅAromatic
C05C04sing1.38Å1.40ÅAromatic
C06C07sing1.38Å1.39ÅAromatic
F01C04sing1.35Å1.34Å
C04C03doub1.39Å1.42ÅAromatic
C07C37sing1.51Å1.52Å
C07C02doub1.38Å1.41ÅAromatic
C37F40sing1.40Å1.34Å
C37F39sing1.40Å1.34Å
C03C02sing1.39Å1.41ÅAromatic
C03N08sing1.40Å1.45Å
N08C09sing1.35Å1.44Å
C09N10sing1.35Å1.43Å
C09O11doub1.22Å1.22Å
N10C13sing1.40Å1.45Å
C13C12doub1.39Å1.40ÅAromatic
C13C14sing1.39Å1.40ÅAromatic
C12C17sing1.38Å1.40ÅAromatic
C14C15doub1.38Å1.40ÅAromatic
C17C16doub1.39Å1.41ÅAromatic
C15C16sing1.39Å1.40ÅAromatic
C16N18sing1.40Å1.45Å
C25C24doub1.38Å1.39ÅAromatic
C25C20sing1.40Å1.43ÅAromatic
C24N23sing1.32Å1.35ÅAromatic
N18C20sing1.39Å1.45Å
N18C19sing1.46Å1.48Å
C20N21doub1.33Å1.39ÅAromatic
N23C22doub1.32Å1.39ÅAromatic
N21C22sing1.33Å1.40ÅAromatic
C22N26sing1.39Å1.43Å
N26C27sing1.40Å1.44Å
C27C32doub1.39Å1.42ÅAromatic
C27C28sing1.39Å1.41ÅAromatic
C32C31sing1.38Å1.41ÅAromatic
O35S33doub1.42Å1.42Å
C28C29doub1.38Å1.40ÅAromatic
C31S33sing1.76Å1.78Å
C31C30doub1.38Å1.41ÅAromatic
S33O36doub1.42Å1.42Å
S33N34sing1.66Å1.65Å
C29C30sing1.38Å1.40ÅAromatic
C12H1sing1.08Å1.08Å
C02H2sing1.08Å1.08Å
C05H3sing1.08Å1.08Å
C06H4sing1.08Å1.08Å
C14H5sing1.08Å1.08Å
C15H6sing1.08Å1.08Å
C17H7sing1.08Å1.08Å
C19H8sing1.09Å1.10Å
C19H9sing1.09Å1.10Å
C19H10sing1.09Å1.10Å
C24H11sing1.08Å1.08Å
C25H12sing1.08Å1.08Å
C28H13sing1.08Å1.08Å
C29H14sing1.08Å1.08Å
C30H15sing1.08Å1.08Å
C32H16sing1.08Å1.08Å
N08H17sing0.97Å1.00Å
N10H18sing0.97Å1.00Å
N26H19sing0.97Å1.00Å
N34H20sing0.97Å1.00Å
N34H21sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F38C37C07114.4°109.5°
F38C37F40104.5°109.5°
F38C37F39103.6°109.5°
C06C05C04119.6°120.1°
C05C06C07119.6°120.2°
C06C05H3120.2°120.0°
C05C06H4120.2°119.9°
C05C04F01117.0°120.1°
C05C04C03123.6°119.9°
C04C05H3120.2°120.0°
C06C07C37117.7°120.0°
C06C07C02120.1°120.1°
C07C06H4120.2°119.9°
F01C04C03119.4°120.0°
C04C03C02114.5°119.8°
C04C03N08119.8°120.1°
C37C07C02122.2°119.9°
C07C37F40113.6°109.5°
C07C37F39115.7°109.5°
C07C02C03122.6°120.0°
C07C02H2118.7°120.0°
F40C37F39103.8°109.5°
C02C03N08125.6°120.1°
C03C02H2118.7°120.0°
C03N08C09122.4°120.0°
C03N08H17118.8°120.0°
N08C09N10123.5°120.0°
N08C09O11117.6°120.0°
C09N08H17118.8°120.0°
N10C09O11119.0°120.0°
C09N10C13123.9°120.0°
C09N10H18118.0°120.1°
N10C13C12124.1°120.0°
N10C13C14122.0°120.0°
C13N10H18118.1°120.0°
C12C13C14113.9°120.0°
C13C12C17122.8°120.0°
C13C12H1118.6°120.0°
C13C14C15123.4°120.0°
C13C14H5118.3°120.0°
C12C17C16123.1°120.0°
C17C12H1118.6°120.0°
C12C17H7118.5°120.0°
C14C15C16123.1°120.0°
C15C14H5118.3°120.0°
C14C15H6118.4°120.0°
C17C16C15113.7°120.0°
C17C16N18123.6°120.0°
C16C17H7118.4°120.0°
C15C16N18122.6°120.0°
C16C15H6118.5°120.1°
C16N18C20124.2°120.0°
C16N18C19117.3°120.0°
C24C25C20118.1°118.5°
C25C24N23123.8°119.3°
C25C24H11118.1°120.4°
C24C25H12120.9°120.8°
C25C20N18118.4°120.5°
C25C20N21120.1°119.0°
C20C25H12121.0°120.7°
C24N23C22116.6°120.9°
N23C24H11118.1°120.3°
C20N18C19118.5°120.0°
N18C20N21121.5°120.5°
N18C19H8109.5°109.5°
N18C19H9109.5°109.4°
N18C19H10109.4°109.5°
C20N21C22117.2°120.6°
N23C22N21124.2°121.7°
N23C22N26115.6°119.2°
N21C22N26120.2°119.2°
C22N26C27127.1°120.0°
C22N26H19116.5°120.0°
N26C27C32124.8°120.1°
N26C27C28118.8°120.1°
C27N26H19116.5°120.0°
C32C27C28116.4°119.8°
C27C32C31126.0°119.9°
C27C32H16117.0°120.0°
C27C28C29119.9°120.0°
C27C28H13120.1°120.0°
C32C31S33123.8°120.0°
C32C31C30114.1°120.1°
C31C32H16117.0°120.0°
O35S33C31111.3°106.4°
O35S33O36114.9°123.1°
O35S33N34105.7°106.4°
C28C29C30121.3°120.0°
C29C28H13120.0°120.0°
C28C29H14119.4°120.0°
S33C31C30122.2°120.0°
C31S33O36110.2°106.4°
C31S33N34107.1°107.3°
C31C30C29122.3°120.2°
C31C30H15118.8°120.0°
O36S33N34107.1°106.4°
S33N34H20109.5°120.0°
S33N34H21109.5°120.0°
C30C29H14119.3°120.0°
C29C30H15118.8°119.9°
H8C19H9109.5°109.5°
H8C19H10109.4°109.5°
H9C19H10109.5°109.5°
H20N34H21109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F38C37C07C0687.9°120.0°
F38C37C07F40119.9°120.0°
F38C37C07F39120.2°120.0°
F38C37C07C0292.1°60.5°
F38C37F40F39108.3°120.0°
C06C05C04H3180.0°179.7°
C05C06C07H4180.0°179.8°
C06C05C04F01179.9°180.0°
C06C05C04C030.8°0.1°
C05C06C07C37179.9°180.0°
C05C06C07C020.0°0.5°
C04C05C06C070.1°0.2°
C05C04F01C03179.4°180.0°
C05C04C03C021.3°0.1°
C05C04C03N08178.8°180.0°
C04C05C06H4180.0°180.0°
C06C07C37C02179.9°179.5°
C06C07C37F4032.0°0.0°
C06C07C37F39151.9°120.0°
C06C07C02C030.7°0.5°
C06C07C02H2179.3°179.8°
C07C06C05H3179.9°180.0°
F01C04C03C02179.3°180.0°
F01C04C03N081.8°0.0°
F01C04C05H30.1°0.3°
C04C03C02C071.3°0.2°
C04C03C02N08177.4°179.9°
C04C03N08C09129.6°145.2°
C04C03C02H2178.8°180.0°
C03C04C05H3179.2°179.7°
C04C03N08H1750.4°34.8°
C07C37F40F39126.4°120.0°
C37C07C02C03179.3°180.0°
C37C07C02H20.7°0.3°
C37C07C06H40.1°0.2°
C02C07C37F40148.1°179.5°
C02C07C37F3928.2°59.5°
C07C02C03H2180.0°179.7°
C07C02C03N08178.6°179.7°
C02C07C06H4180.0°179.7°
C02C03N08C0947.6°34.7°
C02C03N08H17132.4°145.3°
C03N08C09H17180.0°180.0°
C03N08C09N10177.9°175.5°
C03N08C09O112.3°4.6°
N08C03C02H21.4°0.0°
N08C09N10O11179.8°179.9°
N08C09N10C13179.7°174.0°
N08C09N10H180.3°6.0°
C09N10C13H18180.0°180.0°
C09N10C13C12160.8°153.7°
C09N10C13C1420.0°26.2°
N10C09N08H172.1°4.5°
O11C09N10C130.0°6.1°
O11C09N08H17177.6°175.4°
O11C09N10H18180.0°173.9°
N10C13C12C14179.2°179.9°
N10C13C12C17179.6°180.0°
N10C13C14C15179.5°180.0°
N10C13C12H10.4°0.3°
N10C13C14H50.5°0.0°
C13C12C17H1180.0°179.6°
C12C13C14C151.2°0.1°
C13C12C17C161.1°0.1°
C12C13C14H5178.8°179.9°
C13C12C17H7178.9°179.7°
C12C13N10H1819.2°26.3°
C14C13C12C171.1°0.1°
C13C14C15H5180.0°179.9°
C13C14C15C161.3°0.1°
C14C13C12H1178.8°179.8°
C13C14C15H6178.7°180.0°
C14C13N10H18160.0°153.8°
C12C17C16H7180.0°179.8°
C12C17C16C151.0°0.0°
C12C17C16N18178.9°180.0°
C14C15C16C171.1°0.0°
C14C15C16H6180.0°179.9°
C14C15C16N18179.0°180.0°
C17C16C15N18177.9°180.0°
C17C16N18C2063.1°175.1°
C17C16N18C19118.3°4.9°
C16C17C12H1178.8°179.7°
C17C16C15H6178.9°180.0°
C15C16N18C20114.6°4.9°
C15C16N18C1964.0°175.1°
C16C15C14H5178.7°180.0°
C15C16C17H7179.0°179.7°
C16N18C20C251.8°85.1°
C16N18C20C19178.6°180.0°
C16N18C20N21177.9°95.2°
N18C16C15H61.0°0.1°
N18C16C17H71.1°0.2°
C16N18C19H8180.0°90.0°
C16N18C19H960.0°150.0°
C16N18C19H1060.0°30.0°
C24C25C20H12180.0°180.0°
C25C24N23H11180.0°179.9°
C24C25C20N18179.9°179.7°
C24C25C20N210.2°0.0°
C25C24N23C220.2°0.1°
C20C25C24N230.3°0.1°
C25C20N18N21179.7°179.7°
C25C20N18C19179.6°94.9°
C25C20N21C220.1°0.0°
C20C25C24H11179.7°180.0°
C24N23C22N210.1°0.0°
C24N23C22N26180.0°180.0°
N23C24C25H12179.7°180.0°
N18C20N21C22179.8°179.7°
C20N18C19H81.3°90.0°
C20N18C19H9118.8°30.0°
C20N18C19H10121.3°150.0°
N18C20C25H120.1°0.2°
C19N18C20N210.7°84.8°
N18C19H8H9120.0°120.0°
N18C19H8H10120.0°120.0°
N18C19H9H10120.0°120.0°
C20N21C22N230.0°0.0°
C20N21C22N26180.0°180.0°
N21C20C25H12179.8°180.0°
N23C22N21N26180.0°180.0°
N23C22N26C27167.8°5.4°
C22N23C24H11179.8°180.0°
N23C22N26H1912.2°174.6°
N21C22N26C2712.3°174.5°
N21C22N26H19167.7°5.5°
C22N26C27H19180.0°180.0°
C22N26C27C329.4°34.7°
C22N26C27C28170.9°145.0°
N26C27C32C28179.8°179.7°
N26C27C32C31179.9°179.8°
N26C27C28C29180.0°179.7°
N26C27C28H130.0°0.3°
N26C27C32H160.0°0.2°
C27C32C31H16180.0°180.0°
C32C27C28C290.2°0.0°
C27C32C31S33179.8°180.0°
C27C32C31C300.1°0.1°
C32C27C28H13179.8°180.0°
C32C27N26H19170.6°145.3°
C28C27C32C310.2°0.1°
C27C28C29H13180.0°180.0°
C27C28C29C300.1°0.0°
C27C28C29H14179.9°180.0°
C28C27C32H16179.8°179.9°
C28C27N26H199.1°35.0°
C32C31S33O3514.0°23.6°
C32C31S33C30179.8°179.9°
C32C31S33O36114.7°156.5°
C32C31S33N34129.1°89.9°
C32C31C30C290.0°0.1°
C32C31C30H15179.9°180.0°
O35S33C31O36128.6°132.9°
O35S33C31N34115.1°113.6°
O35S33C31C30166.2°156.5°
O35S33O36N34117.1°122.9°
O35S33N34H20180.0°36.5°
O35S33N34H2160.0°143.6°
C28C29C30C310.0°0.0°
C28C29C30H14180.0°180.0°
C28C29C30H15180.0°180.0°
C31S33O36N34116.2°114.2°
S33C31C30C29179.9°180.0°
S33C31C30H150.1°0.1°
S33C31C32H160.2°0.0°
C31S33N34H2061.2°150.0°
C31S33N34H2158.8°30.0°
C30C31S33O3665.2°23.6°
C30C31S33N3451.1°90.0°
C31C30C29H15180.0°180.0°
C31C30C29H14179.9°180.0°
C30C31C32H16179.9°179.9°
O36S33N34H2057.1°96.4°
O36S33N34H21177.1°83.5°
S33N34H20H21120.0°179.9°
C30C29C28H13179.9°180.0°
H1C12C17H71.2°0.1°
H3C05C06H40.1°0.2°
H5C14C15H61.3°0.1°
H8C19H9H10120.0°120.0°
H11C24C25H120.3°0.1°
H13C28C29H140.1°0.0°
H14C29C30H150.1°0.0°

225399

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