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9DP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C3C1doub1.38Å1.39ÅAromatic
C1CL1sing1.74Å1.82Å
C1C2sing1.38Å1.39ÅAromatic
C6N1sing1.40Å1.37Å
N1C7sing1.35Å1.34Å
N1HN1sing0.97Å1.00Å
C7O1doub1.22Å1.23Å
C6C2doub1.39Å1.39ÅAromatic
C2CL2sing1.74Å1.75Å
C7N2sing1.35Å1.34Å
N2C8sing1.40Å1.34Å
N2HN2sing0.97Å1.00Å
O2C24sing1.34Å1.25Å
O2HO2sing0.97Å0.95Å
C4C3sing1.38Å1.41ÅAromatic
C3H3sing1.08Å1.08Å
N4N3sing1.40Å1.40ÅAromatic
N3C10doub1.31Å1.36ÅAromatic
O3C24doub1.21Å1.26Å
C4C5doub1.38Å1.40ÅAromatic
C4H4sing1.08Å1.08Å
C16N4sing1.40Å1.34ÅAromatic
C8N4sing1.36Å1.34ÅAromatic
C5C6sing1.39Å1.39ÅAromatic
C5H5sing1.08Å1.08Å
C22N5sing1.47Å1.45Å
N5C21sing1.47Å1.45Å
N5HN5sing1.01Å1.00Å
C8C9doub1.36Å1.40ÅAromatic
C9C10sing1.40Å1.40ÅAromatic
C9H9sing1.08Å1.08Å
C10C11sing1.51Å1.51Å
C13C11sing1.53Å1.52Å
C11C14sing1.53Å1.52Å
C11C12sing1.53Å1.52Å
C12H12sing1.09Å1.10Å
C12H12Asing1.09Å1.10Å
C12H12Bsing1.09Å1.10Å
C13H13sing1.09Å1.10Å
C13H13Asing1.09Å1.10Å
C13H13Bsing1.09Å1.10Å
C14H14sing1.09Å1.10Å
C14H14Asing1.09Å1.10Å
C14H14Bsing1.09Å1.10Å
C18C15doub1.38Å1.37ÅAromatic
C16C15sing1.39Å1.39ÅAromatic
C15H15sing1.08Å1.08Å
C17C16doub1.39Å1.40ÅAromatic
C20C17sing1.39Å1.39ÅAromatic
C17H17sing1.08Å1.08Å
C19C18sing1.39Å1.38ÅAromatic
C18H18sing1.08Å1.08Å
C20C19doub1.38Å1.38ÅAromatic
C21C19sing1.51Å1.50Å
C23C20sing1.51Å1.52Å
C21H21sing1.09Å1.10Å
C21H21Asing1.09Å1.10Å
C24C22sing1.51Å1.52Å
C22C23sing1.53Å1.53Å
C22H22sing1.09Å1.10Å
C23H23sing1.09Å1.10Å
C23H23Asing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C3C1CL1120.9°120.0°
C3C1C2116.5°120.0°
C1C3C4119.5°120.1°
C1C3H3120.2°120.0°
CL1C1C2122.5°119.9°
C1C2C6125.5°119.9°
C1C2CL2119.6°120.1°
C6N1C7125.5°120.0°
C6N1HN1117.3°120.0°
N1C6C2117.3°120.0°
N1C6C5125.3°120.1°
C7N1HN1117.2°120.0°
N1C7O1121.5°120.0°
N1C7N2117.7°120.0°
O1C7N2120.8°120.0°
C6C2CL2115.0°120.1°
C2C6C5117.3°119.9°
C7N2C8120.7°120.0°
C7N2HN2119.7°120.0°
C8N2HN2119.7°120.0°
N2C8N4119.5°126.2°
N2C8C9133.3°126.3°
C24O2HO2109.5°117.0°
O2C24O3121.5°120.0°
O2C24C22114.9°120.0°
C4C3H3120.2°119.9°
C3C4C5122.4°120.1°
C3C4H4118.8°120.0°
N4N3C10101.5°108.5°
N3N4C16117.6°126.2°
N3N4C8113.4°107.7°
N3C10C9113.9°108.5°
N3C10C11123.1°125.8°
O3C24C22123.6°120.0°
C5C4H4118.8°119.9°
C4C5C6118.7°120.0°
C4C5H5120.7°120.0°
C16N4C8128.9°126.1°
N4C16C15120.0°120.1°
N4C16C17124.3°120.1°
N4C8C9107.0°107.5°
C6C5H5120.6°120.0°
C22N5C21124.1°110.3°
C22N5HN5104.8°111.0°
N5C22C24107.2°109.6°
N5C22C23109.0°108.5°
N5C22H22112.4°109.6°
C21N5HN5104.9°111.0°
N5C21C19107.6°110.5°
N5C21H21110.1°109.3°
N5C21H21A110.1°109.3°
C8C9C10104.1°107.9°
C8C9H9127.9°126.1°
C10C9H9127.9°126.0°
C9C10C11123.0°125.8°
C10C11C13109.0°109.5°
C10C11C14111.9°109.5°
C10C11C12109.9°109.4°
C13C11C14106.5°109.5°
C13C11C12110.9°109.5°
C11C13H13109.5°109.5°
C11C13H13A109.4°109.5°
C11C13H13B109.5°109.5°
C14C11C12108.7°109.5°
C11C14H14109.5°109.5°
C11C14H14A109.4°109.5°
C11C14H14B109.5°109.4°
C11C12H12109.5°109.5°
C11C12H12A109.4°109.4°
C11C12H12B109.4°109.5°
H12C12H12A109.5°109.5°
H12C12H12B109.5°109.5°
H12AC12H12B109.5°109.4°
H13C13H13A109.5°109.5°
H13C13H13B109.5°109.5°
H13AC13H13B109.5°109.4°
H14C14H14A109.5°109.5°
H14C14H14B109.4°109.5°
H14AC14H14B109.5°109.5°
C18C15C16122.0°119.7°
C18C15H15119.0°120.1°
C15C18C19120.5°120.5°
C15C18H18119.8°119.7°
C16C15H15119.0°120.1°
C15C16C17115.7°119.7°
C16C17C20123.4°120.3°
C16C17H17118.3°119.8°
C20C17H17118.3°119.9°
C17C20C19118.2°119.9°
C17C20C23117.9°118.4°
C19C18H18119.8°119.8°
C18C19C20120.2°119.9°
C18C19C21117.3°118.4°
C20C19C21122.5°121.8°
C19C20C23123.8°121.7°
C19C21H21110.1°109.3°
C19C21H21A110.1°109.3°
C20C23C22113.0°109.9°
C20C23H23108.3°109.4°
C20C23H23A108.3°109.4°
H21C21H21A108.8°109.2°
C24C22C23112.7°109.6°
C24C22H22108.7°109.8°
C23C22H22106.9°109.6°
C22C23H23108.3°109.4°
C22C23H23A108.3°109.4°
H23C23H23A110.6°109.3°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C3C1CL1C2179.3°179.8°
C3C1C2C60.3°0.2°
C3C1C2CL2179.2°179.7°
C1C3C4H3180.0°180.0°
C1C3C4C50.1°0.1°
C1C3C4H4179.9°180.0°
CL1C1C2C6179.0°180.0°
CL1C1C2CL21.5°0.1°
CL1C1C3C4179.1°180.0°
CL1C1C3H30.8°0.1°
C1C2C6N1179.1°179.8°
C1C2C6CL2179.5°179.9°
C2C1C3C40.2°0.2°
C2C1C3H3179.9°179.7°
C1C2C6C50.3°0.0°
C6N1C7HN1180.0°180.0°
C6N1C7O13.6°4.4°
N1C6C2C5178.8°179.7°
N1C6C2CL20.4°0.3°
C6N1C7N2178.3°175.5°
N1C6C5C4179.0°180.0°
N1C6C5H51.0°0.3°
N1C7O1N2178.0°179.9°
C7N1C6C2141.1°145.0°
N1C7N2C8179.5°180.0°
N1C7N2HN20.6°0.1°
C7N1C6C537.6°34.7°
HN1N1C7O1176.4°175.6°
HN1N1C6C238.9°34.9°
HN1N1C7N21.7°4.5°
HN1N1C6C5142.4°145.4°
O1C7N2C82.5°0.1°
O1C7N2HN2177.5°180.0°
C2C6C5C40.2°0.3°
C2C6C5H5179.7°180.0°
CL2C2C6C5179.2°180.0°
C7N2C8HN2180.0°179.9°
C7N2C8N4163.1°179.9°
C7N2C8C921.9°0.0°
N2C8N4N3178.1°180.0°
N2C8N4C164.3°0.1°
N2C8N4C9176.2°179.9°
N2C8C9C10177.1°180.0°
N2C8C9H92.9°0.1°
HN2N2C8N416.9°0.0°
HN2N2C8C9158.1°179.9°
O2C24O3C22179.9°180.0°
O2C24C22N56.3°160.0°
O2C24C22C23113.6°81.0°
O2C24C22H22128.0°39.5°
HO2O2C24O30.0°0.0°
HO2O2C24C22179.9°179.9°
C3C4C5H4180.0°180.0°
C3C4C5C60.2°0.3°
C3C4C5H5179.8°180.0°
H3C3C4C5179.9°180.0°
H3C3C4H40.1°0.0°
N3N4C16C8177.5°180.0°
N3N4C8C91.9°0.0°
N4N3C10C90.2°0.0°
N4N3C10C11179.5°180.0°
N3N4C16C1551.2°145.0°
N3N4C16C17125.4°35.0°
C10N3N4C16179.2°180.0°
C10N3N4C81.3°0.0°
N3C10C9C80.9°0.0°
N3C10C9C11179.3°180.0°
N3C10C9H9179.1°180.0°
N3C10C11C13124.8°135.0°
N3C10C11C147.2°105.0°
N3C10C11C12113.6°15.0°
O3C24C22N5173.7°20.0°
O3C24C22C2366.3°99.0°
O3C24C22H2252.0°140.5°
C4C5C6H5180.0°179.7°
H4C4C5C6179.8°179.7°
H4C4C5H50.2°0.0°
C16N4C8C9179.5°180.0°
N4C16C15C18177.0°179.8°
N4C16C15C17176.9°179.9°
N4C16C15H153.0°0.2°
N4C16C17C20177.2°179.9°
N4C16C17H172.8°0.0°
N4C8C9C101.6°0.0°
N4C8C9H9178.4°180.0°
C8N4C16C15131.3°34.9°
C8N4C16C1752.1°145.0°
C22N5C21HN5120.0°123.4°
C22N5C21C1945.2°52.6°
N5C22C23C2032.7°50.4°
C22N5C21H2174.8°67.7°
C22N5C21H21A165.2°172.9°
N5C22C24C23120.0°119.0°
N5C22C24H22121.7°120.5°
N5C22C23H22121.7°119.7°
N5C22C23H23152.7°170.6°
N5C22C23H23A87.3°69.7°
N5C21C19C18165.8°162.6°
N5C21C19C2014.1°17.7°
N5C21C19H21120.0°120.3°
N5C21C19H21A120.0°120.3°
N5C21H21H21A120.8°119.5°
C21N5C22C24178.3°169.1°
C21N5C22C2356.0°71.3°
C21N5C22H2262.3°48.5°
HN5N5C21C19165.2°176.0°
HN5N5C21H2145.2°55.7°
HN5N5C21H21A74.8°63.7°
HN5N5C22C2461.6°45.6°
HN5N5C22C23176.0°165.3°
HN5N5C22H2257.7°75.0°
C8C9C10H9180.0°180.0°
C8C9C10C11178.4°179.9°
C9C10C11C1354.5°45.0°
C9C10C11C14172.0°75.0°
C9C10C11C1267.2°165.0°
H9C9C10C111.6°0.0°
C10C11C13C14120.9°120.0°
C10C11C13C12121.1°120.0°
C10C11C14C12121.5°120.0°
C10C11C12H12180.0°60.0°
C10C11C12H12A60.0°180.0°
C10C11C12H12B60.0°60.1°
C10C11C13H13180.0°60.0°
C10C11C13H13A60.0°179.9°
C10C11C13H13B60.0°60.0°
C10C11C14H14180.0°60.0°
C10C11C14H14A60.0°180.0°
C10C11C14H14B60.0°60.0°
C13C11C14C12119.5°120.0°
C13C11C12H1259.4°60.0°
C13C11C12H12A60.6°60.0°
C13C11C12H12B179.4°180.0°
C11C13H13H13A120.0°120.0°
C11C13H13H13B120.0°120.0°
C11C13H13AH13B120.0°120.0°
C13C11C14H1461.0°180.0°
C13C11C14H14A179.0°60.0°
C13C11C14H14B59.0°60.0°
C14C11C12H1257.3°180.0°
C14C11C12H12A177.3°60.0°
C14C11C12H12B62.7°59.9°
C14C11C13H1359.1°60.0°
C14C11C13H13A60.9°60.0°
C14C11C13H13B179.1°179.9°
C11C14H14H14A120.0°120.1°
C11C14H14H14B120.0°120.0°
C11C14H14AH14B120.0°120.0°
C11C12H12H12A120.0°120.0°
C11C12H12H12B120.0°120.1°
C11C12H12AH12B120.0°120.0°
C12C11C13H1358.9°180.0°
C12C11C13H13A178.9°60.0°
C12C11C13H13B61.1°59.9°
C12C11C14H1458.5°60.0°
C12C11C14H14A61.5°60.0°
C12C11C14H14B178.5°180.0°
H12C12H12AH12B120.0°120.0°
H13C13H13AH13B120.0°120.0°
H14C14H14AH14B120.0°120.0°
C18C15C16H15180.0°180.0°
C18C15C16C170.2°0.1°
C15C18C19H18180.0°179.9°
C15C18C19C201.4°0.2°
C15C18C19C21178.7°179.6°
C15C16C17C200.5°0.0°
C15C16C17H17179.5°179.9°
C16C15C18C190.8°0.0°
C16C15C18H18179.3°179.9°
H15C15C16C17179.9°179.9°
H15C15C18C19179.2°180.0°
H15C15C18H180.8°0.1°
C16C17C20H17180.0°179.9°
C16C17C20C190.1°0.2°
C16C17C20C23179.3°179.6°
C17C20C19C181.1°0.3°
C17C20C19C23179.1°179.8°
C17C20C19C21179.0°179.5°
C17C20C23C22169.1°163.1°
C17C20C23H2349.1°42.9°
C17C20C23H23A70.9°76.8°
H17C17C20C19179.9°179.7°
H17C17C20C230.7°0.5°
C18C19C20C21180.0°179.7°
C18C19C20C23179.8°179.5°
C18C19C21H2174.2°77.2°
C18C19C21H21A45.8°42.3°
H18C18C19C20178.6°179.7°
H18C18C19C211.3°0.5°
C20C19C21H21105.8°102.5°
C20C19C21H21A134.1°138.0°
C19C20C23C2210.0°17.1°
C19C20C23H23130.0°137.3°
C19C20C23H23A110.0°103.0°
C21C19C20C230.2°0.7°
C19C21H21H21A120.8°119.5°
C20C23C22C24151.6°170.1°
C20C23C22H23120.0°120.2°
C20C23C22H23A120.0°120.1°
C20C23C22H2289.0°69.3°
C20C23H23H23A118.6°119.8°
C24C22C23H22119.4°120.6°
C24C22C23H2388.3°69.7°
C24C22C23H23A31.6°50.0°
C22C23H23H23A118.5°119.8°
H22C22C23H2331.0°50.9°
H22C22C23H23A151.0°170.6°

223532

PDB entries from 2024-08-07

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