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H7R

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C18S17sing1.81Å1.88Å
S17C05sing1.76Å1.86Å
C24N23sing1.47Å1.50Å
C24C25sing1.53Å1.54Å
N23C22sing1.47Å1.52Å
S06C05sing1.76Å1.81ÅAromatic
S06C01sing1.76Å1.78ÅAromatic
C05N04doub1.29Å1.35ÅAromatic
C25C20sing1.53Å1.52Å
C22C21sing1.53Å1.52Å
N04C02sing1.35Å1.46ÅAromatic
C20C21sing1.53Å1.52Å
C20C19sing1.53Å1.50Å
C01C02doub1.40Å1.43ÅAromatic
C01N03sing1.33Å1.34ÅAromatic
C02C15sing1.41Å1.36ÅAromatic
N03C07doub1.33Å1.41ÅAromatic
C19S16sing1.81Å1.88Å
C15S16sing1.76Å1.78Å
C15C12doub1.41Å1.48ÅAromatic
C07C12sing1.42Å1.38ÅAromatic
C07C08sing1.41Å1.48ÅAromatic
C12C11sing1.40Å1.50ÅAromatic
C08C09doub1.36Å1.45ÅAromatic
C11C10doub1.37Å1.39ÅAromatic
C09C10sing1.40Å1.44ÅAromatic
C10O13sing1.36Å1.37Å
O13C14sing1.43Å1.45Å
C20H1sing1.09Å1.10Å
C21H2sing1.09Å1.10Å
C21H3sing1.09Å1.10Å
C22H4sing1.09Å1.10Å
C22H5sing1.09Å1.10Å
C24H6sing1.09Å1.10Å
C24H7sing1.09Å1.10Å
C08H8sing1.08Å1.08Å
C09H9sing1.08Å1.08Å
C11H10sing1.08Å1.08Å
C14H11sing1.09Å1.10Å
C14H12sing1.09Å1.10Å
C14H13sing1.09Å1.10Å
C18H14sing1.09Å1.10Å
C18H15sing1.09Å1.10Å
C18H16sing1.09Å1.10Å
C19H17sing1.09Å1.10Å
C19H18sing1.09Å1.10Å
C25H19sing1.09Å1.10Å
C25H20sing1.09Å1.10Å
N23H21sing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C18S17C05116.9°100.0°
S17C18H14109.5°109.5°
S17C18H15109.5°109.4°
S17C18H16109.5°109.5°
S17C05S06118.9°124.7°
S17C05N04129.1°124.7°
N23C24C25112.6°109.5°
C24N23C22112.6°111.2°
N23C24H6108.7°109.4°
N23C24H7108.7°109.4°
C24N23H21108.7°111.0°
C24C25C20111.6°109.3°
C25C24H6108.7°109.5°
C25C24H7108.7°109.5°
C24C25H19108.9°109.6°
C24C25H20108.9°109.5°
N23C22C21114.2°109.5°
N23C22H4108.3°109.5°
N23C22H5108.3°109.5°
C22N23H21108.7°111.0°
C05S06C0191.8°90.6°
S06C05N04112.0°110.6°
S06C01C02109.0°108.1°
S06C01N03124.6°130.3°
C05N04C02112.8°117.8°
C25C20C21107.3°109.1°
C25C20C19111.2°109.6°
C25C20H1109.5°109.6°
C20C25H19109.0°109.5°
C20C25H20109.0°109.5°
C22C21C20112.9°109.3°
C22C21H2108.6°109.5°
C22C21H3108.6°109.6°
C21C22H4108.3°109.4°
C21C22H5108.3°109.5°
N04C02C01114.5°112.9°
N04C02C15130.9°128.6°
C21C20C19109.5°109.5°
C21C20H1109.5°109.5°
C20C21H2108.6°109.5°
C20C21H3108.6°109.5°
C20C19S16109.7°109.5°
C19C20H1109.7°109.5°
C20C19H17109.4°109.4°
C20C19H18109.4°109.5°
C02C01N03126.4°121.6°
C01C02C15114.6°118.5°
C01N03C07118.4°122.2°
C02C15S16119.5°120.7°
C02C15C12121.8°118.5°
N03C07C12120.0°120.0°
N03C07C08116.7°120.9°
C19S16C15115.5°100.0°
S16C19H17109.4°109.5°
S16C19H18109.4°109.5°
S16C15C12118.7°120.8°
C15C12C07118.8°119.2°
C15C12C11126.0°121.1°
C12C07C08123.3°119.1°
C07C12C11115.2°119.7°
C07C08C09119.9°119.9°
C07C08H8120.1°120.0°
C12C11C10123.0°119.7°
C12C11H10118.5°120.2°
C08C09C10117.2°121.0°
C09C08H8120.1°120.1°
C08C09H9121.3°119.5°
C11C10C09121.4°120.7°
C11C10O13119.4°119.7°
C10C11H10118.5°120.1°
C09C10O13119.2°119.6°
C10C09H9121.4°119.6°
C10O13C14120.4°117.0°
O13C14H11109.5°109.5°
O13C14H12109.4°109.5°
O13C14H13109.5°109.5°
H2C21H3109.5°109.5°
H4C22H5109.5°109.5°
H6C24H7109.5°109.5°
H11C14H12109.5°109.5°
H11C14H13109.4°109.4°
H12C14H13109.5°109.4°
H14C18H15109.5°109.5°
H14C18H16109.4°109.5°
H15C18H16109.4°109.4°
H17C19H18109.5°109.5°
H19C25H20109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C18S17C05S06114.8°0.0°
C18S17C05N0466.4°180.0°
S17C18H14H15120.0°120.0°
S17C18H14H16120.0°120.1°
S17C18H15H16120.0°120.0°
S17C05S06N04178.9°180.0°
S17C05S06C01179.5°180.0°
S17C05N04C02179.3°180.0°
C05S17C18H14180.0°180.0°
C05S17C18H1560.0°60.0°
C05S17C18H1660.0°60.0°
N23C24C25H6120.5°120.0°
N23C24C25H7120.5°120.0°
C24N23C22H21120.5°124.1°
N23C24C25C2056.9°59.2°
C24N23C22C2145.2°61.8°
C24N23C22H475.5°178.2°
C24N23C22H5165.9°58.2°
N23C24H6H7118.6°119.9°
N23C24C25H1963.4°179.1°
N23C24C25H20177.3°60.8°
C25C24N23C2247.7°61.8°
C24C25C20H19120.3°120.0°
C24C25C20H20120.3°119.9°
C24C25C20C2160.0°57.6°
C24C25C20C19179.8°177.6°
C24C25C20H158.7°62.3°
C25C24H6H7118.6°120.0°
C24C25H19H20119.0°120.1°
C25C24N23H21168.1°174.2°
N23C22C21H4120.7°120.0°
N23C22C21H5120.7°120.0°
N23C22C21C2051.3°59.2°
N23C22C21H2171.8°60.7°
N23C22C21H369.2°179.2°
N23C22H4H5117.9°120.0°
C22N23C24H6168.1°58.3°
C22N23C24H772.8°178.2°
S06C05N04C020.5°0.0°
C05S06C01C020.4°0.0°
C05S06C01N03179.6°180.0°
C01S06C05N040.6°0.0°
S06C01C02N040.2°0.0°
S06C01C02N03180.0°180.0°
S06C01C02C15179.6°180.0°
S06C01N03C07179.8°180.0°
C05N04C02C010.2°0.0°
C05N04C02C15179.0°180.0°
C25C20C21C2257.4°57.6°
C25C20C21C19120.9°120.0°
C25C20C21H1118.7°119.9°
C25C20C19H1121.3°120.2°
C25C20C19S16171.0°65.3°
C25C20C21H2177.9°62.4°
C25C20C21H363.1°177.6°
C20C25C24H6177.4°60.8°
C20C25C24H763.5°179.2°
C25C20C19H1750.9°174.7°
C25C20C19H1869.0°54.7°
C20C25H19H20119.1°120.0°
C22C21C20H2120.5°120.0°
C22C21C20H3120.5°120.0°
C22C21C20C19178.3°177.6°
C22C21C20H161.4°62.3°
C22C21H2H3118.4°120.1°
C21C22H4H5117.8°120.0°
C21C22N23H21165.7°174.2°
N04C02C01C15179.3°180.0°
N04C02C01N03179.8°180.0°
N04C02C15S161.4°0.1°
N04C02C15C12179.5°180.0°
C21C20C19H1120.2°120.1°
C21C20C19S1652.5°175.0°
C20C21H2H3118.4°120.0°
C20C21C22H469.4°179.2°
C20C21C22H5172.0°60.8°
C21C20C19H1767.6°55.0°
C21C20C19H18172.5°65.0°
C21C20C25H1960.3°177.6°
C21C20C25H20179.7°62.3°
C20C19S16H17120.0°120.0°
C20C19S16H18120.0°120.0°
C20C19S16C1561.1°180.0°
C19C20C21H261.2°57.6°
C19C20C21H357.8°62.4°
C20C19H17H18119.9°120.0°
C19C20C25H1959.5°62.4°
C19C20C25H2059.8°57.6°
C02C01N03C070.2°0.0°
C01C02C15S16179.4°180.0°
C01C02C15C120.3°0.0°
N03C01C02C150.4°0.0°
C01N03C07C120.2°0.0°
C01N03C07C08179.7°179.7°
C02C15S16C1931.8°90.0°
C02C15S16C12179.2°179.9°
C02C15C12C070.1°0.0°
C02C15C12C11179.1°180.0°
N03C07C12C150.4°0.0°
N03C07C12C08179.4°179.7°
N03C07C12C11179.4°180.0°
N03C07C08C09179.7°180.0°
N03C07C08H80.3°0.3°
C19S16C15C12149.1°90.0°
S16C19C20H167.8°54.9°
S16C19H17H18119.9°120.0°
S16C15C12C07179.0°180.0°
S16C15C12C110.1°0.1°
C15S16C19H17178.9°60.1°
C15S16C19H1858.9°60.0°
C15C12C07C11179.1°180.0°
C15C12C07C08179.8°179.7°
C15C12C11C10179.9°180.0°
C15C12C11H100.1°0.0°
C12C07C08C090.9°0.3°
C07C12C11C100.9°0.0°
C12C07C08H8179.1°180.0°
C07C12C11H10179.1°180.0°
C08C07C12C111.1°0.3°
C07C08C09H8180.0°179.7°
C07C08C09C100.2°0.0°
C07C08C09H9179.8°180.0°
C12C11C10H10180.0°179.9°
C12C11C10C090.4°0.4°
C12C11C10O13178.9°180.0°
C08C09C10C110.0°0.4°
C08C09C10H9180.0°179.9°
C08C09C10O13179.2°180.0°
C11C10C09O13179.2°179.7°
C11C10O13C146.3°179.7°
C11C10C09H9180.0°179.7°
C09C10O13C14172.9°0.0°
C10C09C08H8179.8°179.7°
C09C10C11H10179.7°179.7°
O13C10C09H90.8°0.1°
O13C10C11H101.1°0.0°
C10O13C14H11180.0°180.0°
C10O13C14H1260.0°60.0°
C10O13C14H1360.0°60.0°
O13C14H11H12120.0°120.1°
O13C14H11H13120.0°120.0°
O13C14H12H13120.0°120.0°
H1C20C21H259.1°177.7°
H1C20C21H3178.1°57.7°
H1C20C19H17172.2°65.1°
H1C20C19H1852.3°174.9°
H1C20C25H19179.0°57.8°
H1C20C25H2061.6°177.8°
H2C21C22H451.1°59.2°
H2C21C22H567.5°179.2°
H3C21C22H4170.1°60.8°
H3C21C22H551.5°59.1°
H4C22N23H2145.0°54.2°
H5C22N23H2173.7°65.8°
H6C24C25H1957.1°59.1°
H6C24C25H2062.2°179.2°
H6C24N23H2171.4°65.8°
H7C24C25H19176.1°60.9°
H7C24C25H2056.8°59.2°
H7C24N23H2147.6°54.2°
H8C08C09H90.2°0.2°
H11C14H12H13120.0°119.9°
H14C18H15H16120.0°120.0°

225946

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