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Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C32SIsing1.86Å1.87Å
C4C5doub1.38Å1.40ÅAromatic
C4C3sing1.39Å1.40ÅAromatic
O2C1sing1.43Å1.43Å
O2C3sing1.36Å1.37Å
C25C24doub1.38Å1.39ÅAromatic
C25C26sing1.38Å1.40ÅAromatic
C5C6sing1.38Å1.40ÅAromatic
C24C23sing1.39Å1.40ÅAromatic
C3C8doub1.39Å1.41ÅAromatic
C31SIsing1.86Å1.86Å
SIC26sing1.87Å1.87Å
SIC30sing1.86Å1.86Å
C26C27doub1.38Å1.39ÅAromatic
C23N22sing1.40Å1.40Å
C23C28doub1.39Å1.41ÅAromatic
C6C9sing1.51Å1.53Å
C6C7doub1.38Å1.40ÅAromatic
N22C20sing1.35Å1.37Å
C8C7sing1.38Å1.39ÅAromatic
C9C20sing1.51Å1.52Å
C9N10sing1.46Å1.49Å
C27C28sing1.38Å1.39ÅAromatic
C20O21doub1.21Å1.22Å
N10C11sing1.46Å1.48Å
N10C12sing1.35Å1.35Å
O13C12doub1.21Å1.21Å
C12C14sing1.48Å1.46Å
C15C14doub1.36Å1.37Å
C15C16sing1.42Å1.41Å
C14O19sing1.34Å1.35Å
C16O17doub1.22Å1.36Å
C16N18sing1.35Å1.32Å
O19N18sing1.21Å1.21Å
C4H1sing1.08Å1.08Å
C5H2sing1.08Å1.08Å
C7H3sing1.08Å1.08Å
C8H4sing1.08Å1.08Å
C15H5sing1.08Å1.08Å
C24H6sing1.08Å1.08Å
C28H7sing1.08Å1.08Å
C1H8sing1.09Å1.10Å
C1H9sing1.09Å1.10Å
C1H10sing1.09Å1.10Å
C9H11sing1.09Å1.10Å
C11H12sing1.09Å1.10Å
C11H13sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
N18H15sing0.97Å1.00Å
N22H16sing0.97Å1.00Å
C25H17sing1.08Å1.08Å
C27H18sing1.08Å1.08Å
C30H19sing1.09Å1.10Å
C30H20sing1.09Å1.10Å
C30H21sing1.09Å1.10Å
C31H22sing1.09Å1.10Å
C31H23sing1.09Å1.10Å
C31H24sing1.09Å1.10Å
C32H25sing1.09Å1.10Å
C32H26sing1.09Å1.10Å
C32H27sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C32SIC31109.4°109.5°
C32SIC26109.8°109.5°
C32SIC30111.9°109.5°
SIC32H25109.5°109.5°
SIC32H26109.5°109.5°
SIC32H27109.5°109.5°
C5C4C3120.4°120.0°
C4C5C6120.7°120.0°
C5C4H1119.8°120.0°
C4C5H2119.6°120.0°
C4C3O2118.2°120.0°
C4C3C8119.1°119.9°
C3C4H1119.8°120.0°
C1O2C3122.0°117.0°
O2C1H8109.5°109.5°
O2C1H9109.5°109.5°
O2C1H10109.4°109.5°
O2C3C8122.7°120.1°
C24C25C26119.3°120.1°
C25C24C23120.2°119.9°
C25C24H6119.9°120.1°
C24C25H17120.4°119.9°
C25C26SI119.3°120.0°
C25C26C27121.3°120.1°
C26C25H17120.3°120.0°
C5C6C9118.6°119.9°
C5C6C7119.0°120.1°
C6C5H2119.7°119.9°
C24C23N22115.2°120.1°
C24C23C28119.6°119.8°
C23C24H6119.9°120.0°
C3C8C7120.3°119.9°
C3C8H4119.8°120.1°
C31SIC26104.5°109.4°
C31SIC30107.1°109.5°
SIC31H22109.5°109.5°
SIC31H23109.5°109.4°
SIC31H24109.5°109.5°
C26SIC30113.7°109.5°
SIC26C27119.3°119.9°
SIC30H19109.5°109.5°
SIC30H20109.5°109.5°
SIC30H21109.5°109.5°
C26C27C28119.1°120.1°
C26C27H18120.5°119.9°
N22C23C28124.5°120.1°
C23N22C20129.2°120.0°
C23N22H16115.4°120.0°
C23C28C27120.5°119.9°
C23C28H7119.8°120.0°
C9C6C7122.4°119.9°
C6C9C20103.0°109.4°
C6C9N10114.5°109.5°
C6C9H11106.6°109.5°
C6C7C8120.5°120.1°
C6C7H3119.8°120.0°
N22C20C9118.1°120.0°
N22C20O21122.4°120.0°
C20N22H16115.4°120.0°
C8C7H3119.7°119.9°
C7C8H4119.8°120.1°
C20C9N10118.2°109.5°
C9C20O21119.5°120.0°
C20C9H11106.7°109.5°
C9N10C11120.9°120.0°
C9N10C12119.7°120.0°
N10C9H11107.1°109.5°
C27C28H7119.8°120.1°
C28C27H18120.4°120.0°
C11N10C12119.4°120.0°
N10C11H12109.5°109.5°
N10C11H13109.5°109.5°
N10C11H14109.5°109.5°
N10C12O13121.2°120.0°
N10C12C14123.3°120.0°
O13C12C14115.5°120.0°
C12C14C15124.0°126.4°
C12C14O19128.1°126.4°
C14C15C16102.7°104.0°
C15C14O19107.8°107.2°
C14C15H5128.7°128.0°
C15C16O17124.6°127.1°
C15C16N18107.1°105.7°
C16C15H5128.6°128.0°
C14O19N18110.5°112.2°
O17C16N18128.3°127.2°
C16N18O19111.8°110.8°
C16N18H15124.1°124.6°
O19N18H15124.1°124.6°
H8C1H9109.4°109.4°
H8C1H10109.5°109.5°
H9C1H10109.5°109.4°
H12C11H13109.5°109.4°
H12C11H14109.5°109.5°
H13C11H14109.5°109.5°
H19C30H20109.5°109.4°
H19C30H21109.4°109.5°
H20C30H21109.5°109.5°
H22C31H23109.5°109.5°
H22C31H24109.5°109.5°
H23C31H24109.5°109.5°
H25C32H26109.4°109.4°
H25C32H27109.5°109.5°
H26C32H27109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C32SIC26C2512.0°150.3°
C32SIC31C26117.6°120.0°
C32SIC31C30121.5°120.0°
C32SIC26C30126.3°120.0°
C32SIC26C27170.7°30.0°
C32SIC30H19180.0°180.0°
C32SIC30H2060.0°60.0°
C32SIC30H2160.0°60.0°
C32SIC31H22180.0°60.0°
C32SIC31H2360.0°60.0°
C32SIC31H2460.0°180.0°
SIC32H25H26120.0°120.0°
SIC32H25H27120.0°120.0°
SIC32H26H27120.0°120.0°
C5C4C3H1180.0°179.7°
C5C4C3O2179.3°180.0°
C4C5C6H2180.0°180.0°
C5C4C3C80.2°0.1°
C4C5C6C9178.9°180.0°
C4C5C6C70.7°0.0°
C4C3O2C1156.3°179.9°
C4C3O2C8179.5°179.9°
C3C4C5C60.2°0.0°
C4C3C8C70.0°0.1°
C3C4C5H2179.9°180.0°
C4C3C8H4179.9°179.9°
C1O2C3C824.2°0.1°
O2C1H8H9120.0°120.0°
O2C1H8H10120.0°120.1°
O2C1H9H10120.0°120.0°
O2C3C8C7179.5°180.0°
O2C3C4H10.7°0.3°
O2C3C8H40.6°0.0°
C3O2C1H8180.0°60.0°
C3O2C1H960.0°60.0°
C3O2C1H1060.0°180.0°
C24C25C26H17180.0°179.9°
C25C24C23H6180.0°179.8°
C24C25C26SI178.3°179.7°
C24C25C26C271.2°0.0°
C25C24C23N22174.7°179.7°
C25C24C23C284.1°0.2°
C26C25C24C231.5°0.0°
C25C26SIC31105.2°30.3°
C25C26SIC27177.2°179.7°
C25C26SIC30138.3°89.7°
C25C26C27C281.1°0.3°
C26C25C24H6178.5°179.7°
C25C26C27H18178.9°180.0°
C5C6C9C7178.2°180.0°
C5C6C7C80.8°0.0°
C5C6C9C20108.0°106.3°
C5C6C9N10122.4°133.7°
C6C5C4H1179.9°179.7°
C5C6C7H3179.2°180.0°
C5C6C9H114.1°13.7°
C24C23N22C28170.0°180.0°
C24C23N22C20159.1°36.4°
C24C23C28C274.2°0.5°
C24C23C28H7175.8°180.0°
C24C23N22H1620.9°143.7°
C23C24C25H17178.5°180.0°
C3C8C7C60.5°0.1°
C3C8C7H4180.0°180.0°
C8C3C4H1179.8°179.8°
C3C8C7H3179.5°179.9°
C31SIC26C30116.5°120.0°
C31SIC26C2772.0°150.0°
C31SIC30H1960.1°60.0°
C31SIC30H2059.9°60.0°
C31SIC30H21179.9°180.0°
SIC31H22H23120.0°120.0°
SIC31H22H24120.0°120.0°
SIC31H23H24120.0°120.0°
C31SIC32H25180.0°180.0°
C31SIC32H2660.0°60.0°
C31SIC32H2760.0°60.0°
SIC26C27C28178.3°180.0°
SIC26C25H171.6°0.2°
SIC26C27H181.7°0.3°
C26SIC30H1954.8°60.0°
C26SIC30H20174.8°179.9°
C26SIC30H2165.1°60.0°
C26SIC31H2262.4°60.0°
C26SIC31H2357.6°180.0°
C26SIC31H24177.5°60.0°
C26SIC32H2565.8°60.0°
C26SIC32H26174.2°180.0°
C26SIC32H2754.2°60.0°
C30SIC26C2744.5°90.0°
SIC30H19H20120.0°120.0°
SIC30H19H21120.0°120.0°
SIC30H20H21120.0°120.0°
C30SIC31H2258.5°180.0°
C30SIC31H23178.5°60.0°
C30SIC31H2461.5°60.0°
C30SIC32H2561.4°60.0°
C30SIC32H2658.6°60.0°
C30SIC32H27178.6°180.0°
C26C27C28C231.6°0.5°
C26C27C28H18180.0°179.8°
C26C27C28H7178.4°180.0°
C27C26C25H17178.8°179.9°
C23N22C20H16180.0°179.9°
C23N22C20C9169.9°175.4°
N22C23C28C27173.9°179.5°
C23N22C20O2110.3°4.7°
N22C23C24H65.3°0.0°
N22C23C28H76.1°0.0°
C28C23N22C2011.0°143.6°
C23C28C27H7180.0°179.5°
C28C23C24H6175.8°180.0°
C28C23N22H16169.0°36.3°
C23C28C27H18178.4°179.7°
C6C9C20N2298.6°80.0°
C9C6C7C8179.0°180.0°
C6C9C20N10127.3°120.0°
C6C9C20H11112.1°120.0°
C6C9N10H11118.0°120.0°
C6C9C20O2181.6°100.0°
C6C9N10C1121.0°67.8°
C6C9N10C12161.2°112.3°
C9C6C5H21.1°0.0°
C9C6C7H31.0°0.0°
C6C7C8H3180.0°180.0°
C7C6C9C2070.2°73.6°
C7C6C9N1059.4°46.3°
C7C6C5H2179.3°180.0°
C6C7C8H4179.5°180.0°
C7C6C9H11177.7°166.3°
N22C20C9O21179.8°179.9°
N22C20C9N10134.0°160.0°
N22C20C9H1113.4°39.9°
C20C9N10H11120.4°120.1°
C20C9N10C11142.6°52.2°
C20C9N10C1239.5°127.7°
C9C20N22H1610.1°4.5°
N10C9C20O2145.8°19.9°
C9N10C11C12177.8°179.9°
C9N10C12O130.2°173.6°
C9N10C12C14177.7°6.5°
C9N10C11H12180.0°5.5°
C9N10C11H1360.0°125.5°
C9N10C11H1460.0°114.5°
O21C20C9H11166.4°140.0°
O21C20N22H16169.7°175.4°
C11N10C12O13178.1°6.3°
C11N10C12C140.2°173.6°
C11N10C9H1197.0°172.3°
N10C11H12H13120.0°120.0°
N10C11H12H14120.0°120.0°
N10C11H13H14120.0°120.0°
N10C12O13C14178.0°179.9°
N10C12C14C1571.0°172.4°
N10C12C14O19111.6°7.5°
C12N10C9H1180.9°7.7°
C12N10C11H122.2°174.4°
C12N10C11H13117.8°54.4°
C12N10C11H14122.2°65.6°
O13C12C14C15107.0°7.7°
O13C12C14O1970.5°172.4°
C12C14C15O19177.9°180.0°
C12C14C15C16178.6°180.0°
C12C14O19N18178.6°180.0°
C12C14C15H51.4°0.3°
C14C15C16H5180.0°179.7°
C14C15C16O17179.4°180.0°
C14C15C16N180.4°0.0°
C15C14O19N180.8°0.0°
C16C15C14O190.7°0.0°
C15C16O17N18179.7°179.9°
C15C16N18O190.1°0.0°
C15C16N18H15179.9°179.9°
C14O19N18C160.5°0.0°
O19C14C15H5179.3°179.7°
C14O19N18H15179.4°180.0°
O17C16N18O19179.8°180.0°
O17C16C15H50.6°0.4°
O17C16N18H150.1°0.0°
C16N18O19H15180.0°180.0°
N18C16C15H5179.6°179.7°
H1C4C5H20.1°0.3°
H3C7C8H40.5°0.1°
H6C24C25H171.5°0.2°
H7C28C27H181.6°0.2°
H8C1H9H10120.0°120.0°
H12C11H13H14120.0°120.0°
H19C30H20H21120.0°120.0°
H22C31H23H24120.0°120.0°
H25C32H26H27120.0°120.0°

226707

PDB entries from 2024-10-30

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