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KHK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O76N74doub0.00Å1.19Å
O75N74doub0.00Å1.32Å
N74C01sing0.00Å1.44Å
C01C02doub0.00Å1.41ÅAromatic
C01C04sing0.00Å1.42ÅAromatic
C02C03sing0.00Å1.40ÅAromatic
C04C05doub0.00Å1.40ÅAromatic
C03C06doub0.00Å1.40ÅAromatic
C05C06sing0.00Å1.44ÅAromatic
C05N07sing0.00Å1.31ÅAromatic
C06N10sing0.00Å1.30ÅAromatic
N07C08doub0.00Å1.35ÅAromatic
C41C40doub0.00Å1.44ÅAromatic
C41C42sing0.00Å1.29ÅAromatic
C40C39sing0.00Å1.35ÅAromatic
N10C09doub0.00Å1.35ÅAromatic
C08C09sing0.00Å1.43ÅAromatic
C08C11sing0.00Å1.40ÅAromatic
C09C18sing0.00Å1.39ÅAromatic
C42C44doub0.00Å1.48ÅAromatic
C42C43sing0.00Å1.44ÅAromatic
C39N38doub0.00Å1.41ÅAromatic
C44C45sing0.00Å1.37ÅAromatic
C12C11doub0.00Å1.36ÅAromatic
C12C13sing0.00Å1.50ÅAromatic
C11C16sing0.00Å1.38ÅAromatic
C18C23doub0.00Å1.36ÅAromatic
C18C17sing0.00Å1.37ÅAromatic
C13C14doub0.00Å1.34ÅAromatic
C23C22sing0.00Å1.49ÅAromatic
C43N38sing0.00Å1.39ÅAromatic
C43C47doub0.00Å1.33ÅAromatic
C45C46doub0.00Å1.48ÅAromatic
N38RU19sing0.00Å1.99Å
C16C17sing0.00Å1.40ÅAromatic
C16N15doub0.00Å1.40ÅAromatic
C17N20doub0.00Å1.39ÅAromatic
C14N15sing0.00Å1.41ÅAromatic
N15RU19sing0.00Å2.00Å
C22C21doub0.00Å1.35ÅAromatic
C47C46sing0.00Å1.44ÅAromatic
C47N48sing0.00Å1.38ÅAromatic
N20C21sing0.00Å1.41ÅAromatic
N20RU19sing0.00Å2.01Å
C46C49sing0.00Å1.30ÅAromatic
RU19N48sing0.00Å2.01Å
RU19N24sing0.00Å2.01Å
RU19N37sing0.00Å1.99Å
C25N24doub0.00Å1.41ÅAromatic
C25C26sing0.00Å1.35ÅAromatic
N48C51doub0.00Å1.41ÅAromatic
C49C50doub0.00Å1.44ÅAromatic
N24C28sing0.00Å1.38ÅAromatic
C26C27doub0.00Å1.44ÅAromatic
C51C50sing0.00Å1.35ÅAromatic
N37C35doub0.00Å1.41ÅAromatic
N37C36sing0.00Å1.38ÅAromatic
C35C34sing0.00Å1.34ÅAromatic
C28C36doub0.00Å1.35ÅAromatic
C28C29sing0.00Å1.43ÅAromatic
C27C29sing0.00Å1.31ÅAromatic
C36C32sing0.00Å1.43ÅAromatic
C29C30doub0.00Å1.49ÅAromatic
C34C33doub0.00Å1.44ÅAromatic
C32C33sing0.00Å1.30ÅAromatic
C32C31doub0.00Å1.48ÅAromatic
C30C31sing0.00Å1.37ÅAromatic
C13H55sing0.00Å1.08Å
C22H79sing0.00Å1.08Å
C26H59sing0.00Å1.08Å
C14H56sing0.00Å1.08Å
C41H68sing0.00Å1.08Å
C23H57sing0.00Å1.08Å
C25H58sing0.00Å1.08Å
C02H52sing0.00Å1.08Å
C03H53sing0.00Å1.08Å
C04H77sing0.00Å1.08Å
C12H54sing0.00Å1.08Å
C21H78sing0.00Å1.08Å
C27H60sing0.00Å1.08Å
C30H61sing0.00Å1.08Å
C31H62sing0.00Å1.08Å
C33H63sing0.00Å1.08Å
C34H64sing0.00Å1.08Å
C35H65sing0.00Å1.08Å
C39H66sing0.00Å1.08Å
C40H67sing0.00Å1.08Å
C44H69sing0.00Å1.08Å
C45H70sing0.00Å1.08Å
C49H71sing0.00Å1.08Å
C50H72sing0.00Å1.08Å
C51H73sing0.00Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O76N74O75118.5°90.0°
O76N74C01120.4°90.0°
O75N74C01121.1°90.0°
N74C01C02120.3°90.0°
N74C01C04121.0°90.0°
C02C01C04118.7°90.0°
C01C02C03121.0°90.0°
C01C02H52119.5°90.0°
C01C04C05121.1°90.0°
C01C04H77119.4°90.0°
C02C03C06120.7°90.0°
C03C02H52119.5°90.0°
C02C03H53119.7°90.0°
C04C05C06119.2°90.0°
C04C05N07120.9°90.0°
C05C04H77119.4°90.0°
C03C06C05119.3°90.0°
C03C06N10119.6°90.0°
C06C03H53119.7°90.0°
C06C05N07119.9°90.0°
C05C06N10121.1°90.0°
C05N07C08120.4°90.0°
C06N10C09119.5°90.0°
N07C08C09119.1°90.0°
N07C08C11120.2°90.0°
C40C41C42121.5°90.0°
C41C40C39121.2°90.0°
C40C41H68119.2°90.0°
C41C40H67119.4°90.0°
C41C42C44124.0°90.0°
C41C42C43119.5°90.0°
C42C41H68119.3°90.0°
C40C39N38117.8°90.0°
C40C39H66121.1°90.0°
C39C40H67119.4°90.0°
N10C09C08120.0°90.0°
N10C09C18118.8°90.0°
C09C08C11120.7°90.0°
C08C09C18121.2°90.0°
C08C11C12124.3°90.0°
C08C11C16116.9°90.0°
C09C18C23123.6°90.0°
C09C18C17117.1°90.0°
C44C42C43116.5°90.0°
C42C44C45121.0°90.0°
C42C44H69119.5°90.0°
C42C43N38118.9°90.0°
C42C43C47122.6°90.0°
C39N38C43121.1°90.0°
C39N38RU19129.4°90.0°
N38C39H66121.1°90.0°
C44C45C46120.7°90.0°
C45C44H69119.5°90.0°
C44C45H70119.7°90.0°
C11C12C13121.3°90.0°
C12C11C16118.9°90.0°
C11C12H54119.4°90.0°
C12C13C14119.1°90.0°
C12C13H55120.5°90.0°
C13C12H54119.4°90.0°
C11C16C17122.1°90.0°
C11C16N15119.9°90.0°
C23C18C17119.4°90.0°
C18C23C22121.1°90.0°
C18C23H57119.5°90.0°
C18C17C16122.1°90.0°
C18C17N20119.4°90.0°
C13C14N15117.8°90.0°
C14C13H55120.4°90.0°
C13C14H56121.1°90.0°
C23C22C21118.8°90.0°
C23C22H79120.6°90.0°
C22C23H57119.4°90.0°
N38C43C47118.5°90.0°
C43N38RU19109.5°90.0°
C43C47C46122.6°90.0°
C43C47N48119.4°90.0°
C45C46C47116.6°90.0°
C45C46C49124.0°90.0°
C46C45H70119.7°90.0°
N38RU19N1586.1°90.0°
N38RU19N2092.3°90.0°
N38RU19N4883.8°90.0°
N38RU19N2490.2°90.0°
N38RU19N37173.4°90.0°
C17C16N15118.0°90.0°
C16C17N20118.4°90.0°
C16N15C14123.1°90.0°
C16N15RU19109.0°90.0°
C17N20C21123.3°90.0°
C17N20RU19108.7°90.0°
C14N15RU19127.6°90.0°
N15C14H56121.1°90.0°
N15RU19N2085.4°90.0°
N15RU19N4890.9°90.0°
N15RU19N24176.3°90.0°
N15RU19N3798.4°90.0°
C22C21N20117.9°90.0°
C21C22H79120.6°90.0°
C22C21H78121.1°90.0°
C46C47N48118.0°90.0°
C47C46C49119.3°90.0°
C47N48RU19108.8°90.0°
C47N48C51122.7°90.0°
C21N20RU19127.7°90.0°
N20C21H78121.0°90.0°
N20RU19N48174.8°90.0°
N20RU19N2494.2°90.0°
N20RU19N3792.8°90.0°
C46C49C50122.2°90.0°
C46C49H71118.9°90.0°
N48RU19N2489.2°90.0°
N48RU19N3791.4°90.0°
RU19N48C51128.4°90.0°
N24RU19N3785.2°90.0°
RU19N24C25130.1°90.0°
RU19N24C28107.8°90.0°
RU19N37C35128.1°90.0°
RU19N37C36107.8°90.0°
N24C25C26117.7°90.0°
C25N24C28122.1°90.0°
N24C25H58121.1°90.0°
C25C26C27120.4°90.0°
C25C26H59119.8°90.0°
C26C25H58121.2°90.0°
N48C51C50117.4°90.0°
N48C51H73121.3°90.0°
C49C50C51120.4°90.0°
C50C49H71118.9°90.0°
C49C50H72119.8°90.0°
N24C28C36118.9°90.0°
N24C28C29118.6°90.0°
C26C27C29121.7°90.0°
C27C26H59119.8°90.0°
C26C27H60119.1°90.0°
C51C50H72119.8°90.0°
C50C51H73121.3°90.0°
C35N37C36124.0°90.0°
N37C35C34116.4°90.0°
N37C35H65121.8°90.0°
N37C36C28120.3°90.0°
N37C36C32117.1°90.0°
C35C34C33120.6°90.0°
C35C34H64119.7°90.0°
C34C35H65121.8°90.0°
C36C28C29122.5°90.0°
C28C36C32122.6°90.0°
C28C29C27119.4°90.0°
C28C29C30116.5°90.0°
C27C29C30124.1°90.0°
C29C27H60119.1°90.0°
C36C32C33119.3°90.0°
C36C32C31116.6°90.0°
C29C30C31120.8°90.0°
C29C30H61119.6°90.0°
C34C33C32122.5°90.0°
C34C33H63118.7°90.0°
C33C34H64119.7°90.0°
C33C32C31124.1°90.0°
C32C33H63118.7°90.0°
C32C31C30120.9°90.0°
C32C31H62119.5°90.0°
C31C30H61119.6°90.0°
C30C31H62119.5°90.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O76N74O75C01179.0°90.0°
O76N74C01C02144.9°90.0°
O76N74C01C0434.6°90.0°
O75N74C01C0234.1°90.0°
O75N74C01C04146.4°90.0°
N74C01C02C04179.5°90.0°
N74C01C02C03179.8°90.0°
N74C01C04C05179.9°90.0°
N74C01C02H520.2°90.0°
N74C01C04H770.1°90.0°
C01C02C03H52180.0°90.0°
C02C01C04C050.6°90.0°
C01C02C03C060.1°90.0°
C01C02C03H53179.9°90.0°
C02C01C04H77179.4°90.0°
C04C01C02C030.3°90.0°
C01C04C05H77180.0°90.0°
C01C04C05C060.7°90.0°
C01C04C05N07180.0°90.0°
C04C01C02H52179.7°90.0°
C02C03C06H53180.0°90.0°
C02C03C06C050.1°90.0°
C02C03C06N10180.0°90.0°
C04C05C06C030.4°90.0°
C04C05C06N07179.3°90.0°
C04C05C06N10179.7°90.0°
C04C05N07C08179.8°90.0°
C03C06C05N10179.9°90.0°
C03C06C05N07179.7°90.0°
C03C06N10C09179.9°90.0°
C06C03C02H52179.9°90.0°
C06C05N07C080.5°90.0°
C05C06N10C090.0°90.0°
C05C06C03H53179.9°90.0°
C06C05C04H77179.3°90.0°
N07C05C06N100.3°90.0°
C05N07C08C090.4°90.0°
C05N07C08C11179.3°90.0°
N07C05C04H770.0°90.0°
C06N10C09C080.1°90.0°
C06N10C09C18180.0°90.0°
N10C06C03H530.0°90.0°
N07C08C09N100.0°90.0°
N07C08C09C11179.7°90.0°
N07C08C09C18179.8°90.0°
N07C08C11C120.4°90.0°
N07C08C11C16179.8°90.0°
C40C41C42H68180.0°90.0°
C41C40C39H67180.0°90.0°
C40C41C42C44179.9°90.0°
C40C41C42C430.4°90.0°
C41C40C39N380.5°90.0°
C41C40C39H66179.4°90.0°
C42C41C40C390.3°90.0°
C41C42C44C43179.5°90.0°
C41C42C44C45179.9°90.0°
C41C42C43N380.7°90.0°
C41C42C43C47179.9°90.0°
C42C41C40H67179.7°90.0°
C41C42C44H690.1°90.0°
C40C39N38H66180.0°90.0°
C40C39N38C430.9°90.0°
C40C39N38RU19179.2°90.0°
C39C40C41H68179.7°90.0°
N10C09C08C18179.8°90.0°
N10C09C08C11179.7°90.0°
N10C09C18C230.0°90.0°
N10C09C18C17180.0°90.0°
C09C08C11C12179.9°90.0°
C09C08C11C160.5°90.0°
C08C09C18C23179.8°90.0°
C08C09C18C170.2°90.0°
C11C08C09C180.5°90.0°
C08C11C12C16179.4°90.0°
C08C11C12C13179.7°90.0°
C08C11C16C170.2°90.0°
C08C11C16N15179.7°90.0°
C08C11C12H540.3°90.0°
C09C18C23C17180.0°90.0°
C09C18C23C22179.9°90.0°
C09C18C17C160.1°90.0°
C09C18C17N20179.3°90.0°
C09C18C23H570.2°90.0°
C42C44C45H69180.0°90.0°
C44C42C43N38179.7°90.0°
C44C42C43C470.3°90.0°
C42C44C45C460.3°90.0°
C44C42C41H680.1°90.0°
C42C44C45H70179.7°90.0°
C42C43N38C391.0°90.0°
C43C42C44C450.4°90.0°
C42C43N38C47179.4°90.0°
C42C43N38RU19179.1°90.0°
C42C43C47C460.1°90.0°
C42C43C47N48178.6°90.0°
C43C42C41H68179.6°90.0°
C43C42C44H69179.6°90.0°
C39N38C43RU19179.9°90.0°
C39N38C43C47179.6°90.0°
C39N38RU19N1588.6°90.0°
C39N38RU19N203.4°90.0°
C39N38RU19N48180.0°90.0°
C39N38RU19N2490.9°90.0°
C39N38RU19N37137.0°90.0°
N38C39C40H67179.5°90.0°
C44C45C46H70180.0°90.0°
C44C45C46C470.1°90.0°
C44C45C46C49179.2°90.0°
C11C12C13H54180.0°90.0°
C11C12C13C140.5°90.0°
C12C11C16C17179.6°90.0°
C12C11C16N150.9°90.0°
C11C12C13H55179.5°90.0°
C13C12C11C160.3°90.0°
C12C13C14H55180.0°90.0°
C12C13C14N151.2°90.0°
C12C13C14H56178.8°90.0°
C11C16C17C180.0°90.0°
C11C16C17N15179.4°90.0°
C11C16C17N20179.3°90.0°
C11C16N15C141.7°90.0°
C11C16N15RU19176.0°90.0°
C16C11C12H54179.7°90.0°
C18C23C22H57180.0°90.0°
C23C18C17C16179.9°90.0°
C23C18C17N200.7°90.0°
C18C23C22C210.2°90.0°
C18C23C22H79179.8°90.0°
C17C18C23C220.1°90.0°
C18C17C16N20179.2°90.0°
C18C17C16N15179.4°90.0°
C18C17N20C211.4°90.0°
C18C17N20RU19176.0°90.0°
C17C18C23H57179.9°90.0°
C13C14N15C161.9°90.0°
C13C14N15H56180.0°90.0°
C13C14N15RU19175.1°90.0°
C14C13C12H54179.5°90.0°
C23C22C21H79180.0°90.0°
C23C22C21N200.8°90.0°
C23C22C21H78179.2°90.0°
C43N38RU19N1591.3°90.0°
N38C43C47C46179.5°90.0°
N38C43C47N480.8°90.0°
C43N38RU19N20176.6°90.0°
C43N38RU19N480.0°90.0°
C43N38RU19N2489.2°90.0°
C43N38RU19N3743.1°90.0°
C43N38C39H66179.1°90.0°
C43C47C46C450.1°90.0°
C47C43N38RU190.4°90.0°
C43C47C46N48178.7°90.0°
C43C47C46C49179.4°90.0°
C43C47N48RU190.8°90.0°
C43C47N48C51178.7°90.0°
C45C46C47C49179.3°90.0°
C45C46C47N48178.8°90.0°
C45C46C49C50179.8°90.0°
C46C45C44H69179.7°90.0°
C45C46C49H710.1°90.0°
N38RU19N15C1687.1°90.0°
N38RU19N20C1780.3°90.0°
N38RU19N15C1486.9°90.0°
N38RU19N15N2092.6°90.0°
N38RU19N15N4883.7°90.0°
N38RU19N15N247.6°90.0°
N38RU19N15N37175.3°90.0°
N38RU19N48C470.4°90.0°
N38RU19N20C2193.9°90.0°
N38RU19N20N4840.7°90.0°
N38RU19N20N2490.4°90.0°
N38RU19N20N37175.8°90.0°
N38RU19N48N2490.3°90.0°
N38RU19N48N37175.5°90.0°
N38RU19N24N37175.3°90.0°
N38RU19N24C254.4°90.0°
N38RU19N48C51178.2°90.0°
N38RU19N24C28173.5°90.0°
N38RU19N37C35133.1°90.0°
N38RU19N37C3644.7°90.0°
RU19N38C39H660.8°90.0°
C17C16N15C14178.8°90.0°
C17C16N15RU194.5°90.0°
C16C17N20C21179.3°90.0°
C16C17N20RU194.8°90.0°
N15C16C17N200.2°90.0°
C16N15C14RU19173.2°90.0°
C16N15RU19N205.5°90.0°
C16N15RU19N48170.8°90.0°
C16N15RU19N2479.5°90.0°
C16N15RU19N3797.7°90.0°
C16N15C14H56178.1°90.0°
C17N20RU19N155.6°90.0°
C17N20C21C221.5°90.0°
C17N20C21RU19173.5°90.0°
C17N20RU19N4839.7°90.0°
C17N20RU19N24170.7°90.0°
C17N20RU19N37103.8°90.0°
C17N20C21H78178.5°90.0°
C14N15RU19N20179.5°90.0°
C14N15RU19N483.1°90.0°
C14N15RU19N2494.5°90.0°
C14N15RU19N3788.4°90.0°
N15C14C13H55178.8°90.0°
N15RU19N48C4785.6°90.0°
N15RU19N20C21179.9°90.0°
N15RU19N20N4845.3°90.0°
N15RU19N20N24176.3°90.0°
N15RU19N20N3798.2°90.0°
N15RU19N48N24176.3°90.0°
N15RU19N48N3798.5°90.0°
N15RU19N24N37177.2°90.0°
N15RU19N24C253.2°90.0°
N15RU19N48C5192.2°90.0°
N15RU19N24C28178.9°90.0°
N15RU19N37C350.8°90.0°
N15RU19N37C36178.6°90.0°
RU19N15C14H564.9°90.0°
C22C21N20H78180.0°90.0°
C22C21N20RU19175.0°90.0°
C21C22C23H57179.8°90.0°
C46C47N48RU19179.5°90.0°
C46C47N48C512.5°90.0°
C47C46C49C500.6°90.0°
C47C46C45H70179.9°90.0°
C47C46C49H71179.4°90.0°
C47N48RU19N2040.5°90.0°
N48C47C46C491.9°90.0°
C47N48RU19C51177.8°90.0°
C47N48RU19N2490.7°90.0°
C47N48RU19N37175.9°90.0°
C47N48C51C501.7°90.0°
C47N48C51H73178.3°90.0°
C21N20RU19N48134.6°90.0°
C21N20RU19N243.5°90.0°
C21N20RU19N3781.9°90.0°
N20C21C22H79179.2°90.0°
N20RU19N48N24131.2°90.0°
N20RU19N48N37143.6°90.0°
N20RU19N24N3792.5°90.0°
N20RU19N24C2587.9°90.0°
N20RU19N48C51137.3°90.0°
N20RU19N24C2894.2°90.0°
N20RU19N37C3586.6°90.0°
N20RU19N37C3695.7°90.0°
RU19N20C21H785.0°90.0°
C46C49C50H71180.0°90.0°
C46C49C50C510.2°90.0°
C49C46C45H700.8°90.0°
C46C49C50H72179.8°90.0°
N48RU19N24N3791.4°90.0°
N48RU19N24C2588.2°90.0°
N48RU19N24C2889.7°90.0°
RU19N48C51C50179.3°90.0°
N48RU19N37C3590.3°90.0°
N48RU19N37C3687.4°90.0°
RU19N48C51H730.8°90.0°
RU19N24C25C28177.6°90.0°
RU19N24C25C26178.6°90.0°
N24RU19N48C5191.5°90.0°
N24RU19N37C35179.4°90.0°
N24RU19N37C361.6°90.0°
RU19N24C28C361.5°90.0°
RU19N24C28C29178.9°90.0°
RU19N24C25H581.5°90.0°
N37RU19N24C25179.6°90.0°
N37RU19N48C516.3°90.0°
N37RU19N24C281.7°90.0°
RU19N37C35C36177.4°90.0°
RU19N37C35C34178.5°90.0°
RU19N37C36C281.3°90.0°
RU19N37C36C32178.9°90.0°
RU19N37C35H651.5°90.0°
N24C25C26H58180.0°90.0°
N24C25C26C270.4°90.0°
C25N24C28C36179.6°90.0°
C25N24C28C290.8°90.0°
N24C25C26H59179.6°90.0°
C26C25N24C280.9°90.0°
C25C26C27H59180.0°90.0°
C25C26C27C290.1°90.0°
C25C26C27H60179.9°90.0°
N48C51C50C490.3°90.0°
N48C51C50H73180.0°90.0°
N48C51C50H72179.7°90.0°
C49C50C51H72180.0°90.0°
C49C50C51H73179.7°90.0°
N24C28C36N370.2°90.0°
N24C28C36C29179.5°90.0°
N24C28C29C270.3°90.0°
N24C28C36C32179.6°90.0°
N24C28C29C30179.3°90.0°
C28N24C25H58179.1°90.0°
C26C27C29C280.2°90.0°
C26C27C29H60180.0°90.0°
C26C27C29C30179.7°90.0°
C27C26C25H58179.6°90.0°
C51C50C49H71179.8°90.0°
N37C35C34H65180.0°90.0°
C35N37C36C28179.1°90.0°
C35N37C36C321.0°90.0°
N37C35C34C330.4°90.0°
N37C35C34H64179.6°90.0°
C36N37C35C341.2°90.0°
N37C36C28C32179.8°90.0°
N37C36C28C29179.7°90.0°
N37C36C32C330.2°90.0°
N37C36C32C31179.3°90.0°
C36N37C35H65178.8°90.0°
C35C34C33H64180.0°90.0°
C35C34C33C320.4°90.0°
C35C34C33H63179.6°90.0°
C36C28C29C27179.8°90.0°
C36C28C29C300.2°90.0°
C28C36C32C33180.0°90.0°
C28C36C32C310.5°90.0°
C28C29C27C30179.5°90.0°
C29C28C36C320.1°90.0°
C28C29C30C310.1°90.0°
C28C29C27H60179.8°90.0°
C28C29C30H61179.9°90.0°
C27C29C30C31179.6°90.0°
C29C27C26H59179.9°90.0°
C27C29C30H610.4°90.0°
C36C32C33C340.5°90.0°
C36C32C33C31179.4°90.0°
C36C32C31C300.6°90.0°
C36C32C31H62179.4°90.0°
C36C32C33H63179.5°90.0°
C29C30C31C320.3°90.0°
C29C30C31H61180.0°90.0°
C30C29C27H600.3°90.0°
C29C30C31H62179.7°90.0°
C34C33C32H63180.0°90.0°
C34C33C32C31179.9°90.0°
C33C34C35H65179.6°90.0°
C33C32C31C30179.9°90.0°
C33C32C31H620.0°90.0°
C32C33C34H64179.6°90.0°
C32C31C30H62180.0°90.0°
C32C31C30H61179.6°90.0°
C31C32C33H630.1°90.0°
H55C13C14H561.2°90.0°
H55C13C12H540.5°90.0°
H79C22C23H570.2°90.0°
H79C22C21H780.8°90.0°
H59C26C25H580.4°90.0°
H59C26C27H600.1°90.0°
H68C41C40H670.3°90.0°
H52C02C03H530.0°90.0°
H61C30C31H620.3°90.0°
H63C33C34H640.4°90.0°
H64C34C35H650.4°90.0°
H66C39C40H670.6°90.0°
H69C44C45H700.3°90.0°
H71C49C50H720.2°90.0°
H72C50C51H730.3°90.0°

223532

PDB entries from 2024-08-07

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