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8VP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C27C26sing1.53Å1.53Å
C24N25doub1.32Å1.35ÅAromatic
C24C23sing1.39Å1.41ÅAromatic
N25C20sing1.32Å1.38ÅAromatic
C26C23sing1.51Å1.51Å
C23C22doub1.39Å1.41ÅAromatic
C16N17sing1.47Å1.49Å
C16C15sing1.53Å1.54Å
C20N17sing1.38Å1.47Å
C20N21doub1.32Å1.39ÅAromatic
N17C18sing1.47Å1.48Å
C22N21sing1.32Å1.35ÅAromatic
C15C14sing1.53Å1.53Å
C18C19sing1.53Å1.54Å
C14C19sing1.53Å1.56Å
C14C12sing1.51Å1.53Å
C12N13doub1.29Å1.34ÅAromatic
C12S11sing1.71Å1.77ÅAromatic
N13C9sing1.32Å1.45ÅAromatic
C9C8sing1.51Å1.58Å
C9C10doub1.34Å1.36ÅAromatic
S11C10sing1.76Å1.71ÅAromatic
C8O7sing1.43Å1.45Å
O7C6sing1.36Å1.39Å
C5C6doub1.39Å1.41ÅAromatic
C5C4sing1.38Å1.40ÅAromatic
C6C1sing1.39Å1.42ÅAromatic
C4C3doub1.39Å1.40ÅAromatic
C1C2doub1.38Å1.40ÅAromatic
C3C2sing1.39Å1.41ÅAromatic
C3N28sing1.40Å1.48Å
N32N28sing1.41Å1.40ÅAromatic
N32N31doub1.29Å1.31ÅAromatic
N28C29sing1.35Å1.40ÅAromatic
N31N30sing1.28Å1.37ÅAromatic
C29N30doub1.31Å1.34ÅAromatic
C22H1sing1.08Å1.08Å
C19H2sing1.09Å1.10Å
C19H3sing1.09Å1.10Å
C18H4sing1.09Å1.10Å
C18H5sing1.09Å1.10Å
C10H6sing1.08Å1.08Å
C16H7sing1.09Å1.10Å
C16H8sing1.09Å1.10Å
C15H9sing1.09Å1.10Å
C15H10sing1.09Å1.10Å
C14H11sing1.09Å1.10Å
C24H12sing1.08Å1.08Å
C26H13sing1.09Å1.10Å
C26H14sing1.09Å1.10Å
C1H15sing1.08Å1.08Å
C2H16sing1.08Å1.08Å
C4H17sing1.08Å1.08Å
C5H18sing1.08Å1.08Å
C8H19sing1.09Å1.10Å
C8H20sing1.09Å1.10Å
C27H21sing1.09Å1.10Å
C27H22sing1.09Å1.10Å
C27H23sing1.09Å1.10Å
C29H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C27C26C23114.6°109.5°
C27C26H13108.2°109.4°
C27C26H14108.2°109.5°
C26C27H21109.5°109.4°
C26C27H22109.5°109.5°
C26C27H23109.5°109.4°
N25C24C23125.9°119.2°
C24N25C20118.9°120.7°
N25C24H12117.1°120.4°
C24C23C26123.9°120.7°
C24C23C22111.1°118.6°
C23C24H12117.0°120.4°
N25C20N17120.5°119.2°
N25C20N21120.0°121.6°
C26C23C22125.1°120.8°
C23C26H13108.2°109.5°
C23C26H14108.2°109.5°
C23C22N21126.2°119.2°
C23C22H1116.9°120.4°
N17C16C15118.0°109.5°
C16N17C20121.4°111.0°
C16N17C18107.9°111.2°
N17C16H7107.3°109.5°
N17C16H8107.3°109.5°
C16C15C14114.5°109.3°
C15C16H7107.3°109.4°
C15C16H8107.3°109.4°
C16C15H9108.2°109.5°
C16C15H10108.2°109.5°
N17C20N21119.5°119.2°
C20N17C18121.9°111.0°
C20N21C22117.9°120.7°
N17C18C19114.9°109.5°
N17C18H4108.1°109.5°
N17C18H5108.1°109.5°
N21C22H1116.9°120.4°
C15C14C19108.6°109.2°
C15C14C12113.6°109.5°
C14C15H9108.2°109.5°
C14C15H10108.2°109.5°
C15C14H11108.2°109.5°
C18C19C14115.1°109.3°
C18C19H2108.1°109.5°
C18C19H3108.1°109.5°
C19C18H4108.1°109.4°
C19C18H5108.1°109.5°
C19C14C12110.2°109.5°
C14C19H2108.1°109.5°
C14C19H3108.0°109.6°
C19C14H11107.8°109.5°
C14C12N13131.1°124.9°
C14C12S11116.7°124.9°
C12C14H11108.2°109.6°
N13C12S11112.2°110.2°
C12N13C9112.6°117.1°
C12S11C1089.9°90.3°
N13C9C8124.1°122.8°
N13C9C10111.2°114.5°
C8C9C10124.7°122.8°
C9C8O7116.9°109.5°
C9C8H19107.6°109.5°
C9C8H20107.6°109.5°
C9C10S11114.0°108.0°
C9C10H6123.0°126.0°
S11C10H6123.0°126.1°
C8O7C6120.8°117.0°
O7C8H19107.6°109.4°
O7C8H20107.6°109.5°
O7C6C5124.4°120.0°
O7C6C1120.9°120.0°
C6C5C4122.5°120.0°
C5C6C1114.7°120.0°
C6C5H18118.7°120.0°
C5C4C3122.8°120.0°
C5C4H17118.6°120.0°
C4C5H18118.8°120.0°
C6C1C2122.7°120.0°
C6C1H15118.6°120.0°
C4C3C2115.2°120.0°
C4C3N28122.1°120.0°
C3C4H17118.6°120.0°
C1C2C3122.0°120.0°
C2C1H15118.6°120.0°
C1C2H16119.0°120.0°
C2C3N28122.7°120.0°
C3C2H16119.0°120.0°
C3N28N32125.8°127.4°
C3N28C29130.0°127.4°
N28N32N31108.1°106.7°
N32N28C29104.2°105.2°
N32N31N30111.9°110.2°
N28C29N30110.6°107.3°
N28C29H24124.7°126.3°
N31N30C29105.1°110.6°
N30C29H24124.7°126.4°
H2C19H3109.4°109.5°
H4C18H5109.5°109.4°
H7C16H8109.5°109.5°
H9C15H10109.5°109.5°
H13C26H14109.5°109.5°
H19C8H20109.5°109.5°
H21C27H22109.4°109.5°
H21C27H23109.5°109.5°
H22C27H23109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C27C26C23C24102.4°90.1°
C27C26C23H13120.7°119.9°
C27C26C23H14120.7°120.1°
C27C26C23C2277.6°90.0°
C27C26H13H14117.7°120.0°
C26C27H21H22120.0°120.0°
C26C27H21H23120.0°119.9°
C26C27H22H23120.0°120.0°
N25C24C23H12180.0°179.8°
N25C24C23C26180.0°180.0°
N25C24C23C220.1°0.1°
C24N25C20N17179.7°180.0°
C24N25C20N210.2°0.5°
C23C24N25C200.1°0.2°
C24C23C26C22179.9°179.9°
C24C23C22N210.1°0.1°
C24C23C22H1179.9°179.7°
C24C23C26H1318.3°150.0°
C24C23C26H14136.9°30.0°
N25C20N17C1612.2°124.8°
N25C20N17N21179.6°179.5°
N25C20N17C18155.7°0.5°
N25C20N21C220.2°0.5°
C20N25C24H12179.9°180.0°
C26C23C22N21180.0°180.0°
C26C23C22H10.0°0.2°
C26C23C24H120.0°0.2°
C23C26H13H14117.7°120.0°
C23C26C27H21180.0°60.0°
C23C26C27H2260.0°60.0°
C23C26C27H2360.0°180.0°
C23C22N21C200.1°0.2°
C23C22N21H1180.0°179.8°
C22C23C24H12179.9°179.7°
C22C23C26H13161.6°29.9°
C22C23C26H1443.1°149.9°
N17C16C15H7121.2°120.0°
N17C16C15H8121.2°120.0°
C16N17C20C18143.5°124.3°
C16N17C20N21168.3°55.7°
N17C16C15C1427.9°59.2°
C16N17C18C1960.7°61.7°
C16N17C18H4178.4°58.3°
C16N17C18H560.0°178.2°
N17C16H7H8116.1°120.0°
N17C16C15H992.8°60.8°
N17C16C15H10148.6°179.1°
C15C16N17C20119.9°174.1°
C15C16N17C1828.1°61.7°
C16C15C14H9120.7°119.9°
C16C15C14H10120.7°120.0°
C16C15C14C1951.6°57.6°
C16C15C14C12174.6°177.5°
C15C16H7H8116.2°119.9°
C16C15H9H10117.7°120.1°
C16C15C14H1165.2°62.3°
N17C20N21C22179.8°180.0°
C20N17C18C1987.1°174.1°
C20N17C18H433.8°65.9°
C20N17C18H5152.2°54.1°
C20N17C16H7118.9°54.1°
C20N17C16H81.3°65.9°
N21C20N17C1824.7°180.0°
C20N21C22H1179.9°180.0°
N17C18C19H4120.8°120.0°
N17C18C19H5120.8°120.1°
N17C18C19C1435.9°59.1°
N17C18C19H284.9°179.1°
N17C18C19H3156.8°60.8°
N17C18H4H5117.5°120.0°
C18N17C16H793.1°178.3°
C18N17C16H8149.3°58.2°
C15C14C19C1820.7°57.6°
C15C14C19C12125.0°119.9°
C15C14C19H11117.1°119.9°
C15C14C12H11120.2°120.1°
C15C14C12N1317.2°120.0°
C15C14C12S11162.7°59.7°
C15C14C19H2141.5°177.6°
C15C14C19H3100.2°62.3°
C14C15C16H7149.1°179.2°
C14C15C16H893.3°60.9°
C14C15H9H10117.7°120.1°
C18C19C14H2120.8°120.0°
C18C19C14H3120.8°119.9°
C18C19C14C12145.6°177.5°
C18C19H2H3117.5°120.0°
C19C18H4H5117.5°120.0°
C18C19C14H1196.4°62.3°
C19C14C12H11117.7°120.2°
C19C14C12N13139.3°120.3°
C19C14C12S1140.6°60.0°
C14C19H2H3117.4°120.1°
C14C19C18H4156.8°60.9°
C14C19C18H584.8°179.2°
C19C14C15H969.1°62.3°
C19C14C15H10172.3°177.6°
C14C12N13S11179.9°179.7°
C14C12N13C9179.9°180.0°
C14C12S11C10180.0°179.9°
C12C14C19H293.5°62.5°
C12C14C19H324.8°57.6°
C12C14C15H953.8°57.6°
C12C14C15H1064.7°62.5°
C12N13C9C8179.8°180.0°
C12N13C9C100.2°0.0°
N13C12S11C100.1°0.4°
N13C12C14H11103.0°0.2°
S11C12N13C90.0°0.3°
C12S11C10C90.2°0.4°
C12S11C10H6179.8°179.9°
S11C12C14H1177.0°179.8°
N13C9C8C10179.5°180.0°
N13C9C10S110.3°0.3°
N13C9C8O7106.1°180.0°
N13C9C10H6179.7°180.0°
N13C9C8H1914.9°60.0°
N13C9C8H20132.8°60.0°
C8C9C10S11179.9°179.7°
C9C8O7H19121.1°120.0°
C9C8O7H20121.1°120.0°
C9C8O7C6179.6°180.0°
C8C9C10H60.1°0.0°
C9C8H19H20116.7°120.0°
C9C10S11H6180.0°179.7°
C10C9C8O774.3°0.0°
C10C9C8H19164.6°120.0°
C10C9C8H2046.7°120.0°
C8O7C6C524.0°180.0°
C8O7C6C1155.9°0.6°
O7C8H19H20116.6°120.0°
O7C6C5C1180.0°179.4°
O7C6C5C4179.9°180.0°
O7C6C1C2179.9°180.0°
O7C6C1H150.0°0.3°
O7C6C5H180.1°0.5°
C6O7C8H1959.3°60.0°
C6O7C8H2058.5°59.9°
C6C5C4H18180.0°179.5°
C6C5C4C30.1°0.3°
C5C6C1C20.1°0.5°
C5C6C1H15179.9°179.7°
C6C5C4H17179.9°179.7°
C4C5C6C10.1°0.6°
C5C4C3H17180.0°179.9°
C5C4C3C20.0°0.0°
C5C4C3N28180.0°180.0°
C6C1C2H15180.0°179.7°
C6C1C2C30.0°0.2°
C6C1C2H16180.0°179.7°
C1C6C5H18179.9°180.0°
C4C3C2C10.1°0.0°
C4C3C2N28179.9°180.0°
C4C3N28N327.1°180.0°
C4C3N28C29172.3°0.0°
C4C3C2H16179.9°180.0°
C3C4C5H18179.9°179.8°
C1C2C3H16180.0°180.0°
C1C2C3N28180.0°180.0°
C2C3N28N32172.8°0.0°
C2C3N28C297.8°180.0°
C3C2C1H15180.0°180.0°
C2C3C4H17180.0°180.0°
C3N28N32C29179.5°180.0°
C3N28N32N31179.7°179.8°
C3N28C29N30179.7°180.0°
N28C3C2H160.0°0.0°
N28C3C4H170.1°0.0°
C3N28C29H240.3°0.3°
N28N32N31N300.0°0.4°
N32N28C29N300.2°0.0°
N32N28C29H24179.8°179.7°
N31N32N28C290.2°0.3°
N32N31N30C290.1°0.4°
N28C29N30N310.2°0.2°
N28C29N30H24180.0°179.7°
N31N30C29H24179.8°180.0°
H2C19C18H435.9°59.1°
H2C19C18H5154.3°60.8°
H2C19C14H1124.4°57.7°
H3C19C18H482.4°179.2°
H3C19C18H536.0°59.2°
H3C19C14H11142.7°177.8°
H7C16C15H928.4°59.3°
H7C16C15H1090.2°60.8°
H8C16C15H9146.0°179.2°
H8C16C15H1027.4°59.1°
H9C15C14H11174.1°177.8°
H10C15C14H1155.5°57.7°
H13C26C27H2159.2°180.0°
H13C26C27H2260.7°60.0°
H13C26C27H23179.3°60.0°
H14C26C27H2159.3°60.0°
H14C26C27H22179.3°180.0°
H14C26C27H2360.7°59.9°
H15C1C2H160.0°0.0°
H17C4C5H180.1°0.3°
H21C27H22H23120.0°120.1°

224931

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