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7K0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C11C12doub1.38Å1.40ÅAromatic
C11C10sing1.38Å1.40ÅAromatic
C12C1sing1.38Å1.40ÅAromatic
C10C9doub1.38Å1.39ÅAromatic
C1C2sing1.51Å1.50Å
C1C8doub1.38Å1.42ÅAromatic
C9C8sing1.38Å1.40ÅAromatic
C2O3sing1.45Å1.45Å
O3C4sing1.35Å1.35Å
O7C4doub1.21Å1.22Å
C4N5sing1.35Å1.36Å
N5C6sing1.47Å1.47Å
C6P13sing1.82Å1.82Å
O15P13doub1.48Å1.55Å
O14P13sing1.61Å1.50Å
P13N16sing1.68Å1.74Å
O30C28doub1.21Å1.25Å
O29C28sing1.34Å1.26Å
C28C20sing1.51Å1.56Å
C20N19sing1.47Å1.47Å
C20C21sing1.53Å1.53Å
N16C17sing1.47Å1.51Å
N19C18sing1.35Å1.36Å
C18O27doub1.21Å1.22Å
C18C17sing1.51Å1.52Å
C17C25sing1.53Å1.53Å
C21C22sing1.53Å1.51Å
C22C24sing1.53Å1.53Å
C22C23sing1.53Å1.52Å
C25N26sing1.47Å1.47Å
C2H1sing1.09Å1.10Å
C2H2sing1.09Å1.10Å
C8H3sing1.08Å1.08Å
C9H4sing1.08Å1.08Å
C10H5sing1.08Å1.08Å
C11H6sing1.08Å1.08Å
C12H7sing1.08Å1.08Å
C20H8sing1.09Å1.10Å
C21H9sing1.09Å1.10Å
C21H10sing1.09Å1.10Å
C22H11sing1.09Å1.10Å
C24H12sing1.09Å1.10Å
C24H13sing1.09Å1.10Å
C24H14sing1.09Å1.10Å
N26H15sing1.01Å1.00Å
N26H16sing1.01Å1.00Å
C6H18sing1.09Å1.10Å
C6H19sing1.09Å1.10Å
O14H20sing0.97Å0.95Å
N16H21sing1.01Å1.00Å
C17H22sing1.09Å1.10Å
N19H23sing0.97Å1.00Å
C23H24sing1.09Å1.10Å
C23H25sing1.09Å1.10Å
C23H26sing1.09Å1.10Å
O29H27sing0.97Å0.95Å
N5H28sing0.97Å1.00Å
C25H29sing1.09Å1.10Å
C25H30sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C12C11C10121.4°120.0°
C11C12C1119.9°120.0°
C12C11H6119.3°120.0°
C11C12H7120.0°120.0°
C11C10C9119.0°120.0°
C11C10H5120.5°120.0°
C10C11H6119.3°120.0°
C12C1C2119.6°120.0°
C12C1C8118.8°120.0°
C1C12H7120.1°120.0°
C10C9C8120.4°120.0°
C10C9H4119.8°120.0°
C9C10H5120.5°120.0°
C2C1C8121.6°120.0°
C1C2O3107.2°109.4°
C1C2H1110.0°109.5°
C1C2H2110.0°109.5°
C1C8C9120.5°120.0°
C1C8H3119.7°120.0°
C9C8H3119.8°120.0°
C8C9H4119.8°120.0°
C2O3C4121.7°117.0°
O3C2H1110.0°109.5°
O3C2H2110.1°109.4°
O3C4O7118.0°120.0°
O3C4N5116.9°120.0°
O7C4N5125.1°120.0°
C4N5C6123.0°120.0°
C4N5H28118.5°120.0°
N5C6P13105.9°109.5°
N5C6H18110.3°109.4°
N5C6H19110.4°109.5°
C6N5H28118.5°120.0°
C6P13O15111.7°109.5°
C6P13O14112.1°109.5°
C6P13N16100.1°109.4°
P13C6H18110.4°109.5°
P13C6H19110.3°109.5°
O15P13O14110.8°109.5°
O15P13N16110.1°109.5°
O14P13N16111.6°109.5°
P13O14H20109.5°114.0°
P13N16C17116.0°111.0°
P13N16H21107.8°111.0°
O30C28O29128.1°120.0°
O30C28C20114.0°120.0°
O29C28C20117.8°120.0°
C28O29H27109.5°117.0°
C28C20N19108.7°109.5°
C28C20C21115.6°109.5°
C28C20H8106.3°109.5°
N19C20C21112.1°109.4°
C20N19C18119.6°120.0°
N19C20H8107.2°109.4°
C20N19H23120.2°120.0°
C20C21C22116.0°109.5°
C21C20H8106.5°109.5°
C20C21H9107.8°109.5°
C20C21H10107.8°109.4°
N16C17C18112.3°109.5°
N16C17C25101.4°109.5°
C17N16H21107.8°110.9°
N16C17H22111.0°109.5°
N19C18O27121.7°120.0°
N19C18C17118.6°120.0°
C18N19H23120.2°120.0°
O27C18C17119.6°120.0°
C18C17C25110.4°109.4°
C18C17H22110.8°109.5°
C17C25N26110.0°109.4°
C25C17H22110.6°109.5°
C17C25H29109.3°109.5°
C17C25H30109.4°109.5°
C21C22C24113.9°109.5°
C21C22C23109.9°109.5°
C22C21H9107.8°109.5°
C22C21H10107.8°109.5°
C21C22H11108.2°109.4°
C24C22C23108.6°109.5°
C24C22H11108.0°109.5°
C22C24H12109.5°109.5°
C22C24H13109.5°109.4°
C22C24H14109.4°109.4°
C23C22H11108.1°109.5°
C22C23H24109.5°109.4°
C22C23H25109.4°109.4°
C22C23H26109.5°109.5°
C25N26H15109.5°111.0°
C25N26H16109.4°111.0°
N26C25H29109.3°109.4°
N26C25H30109.3°109.5°
H1C2H2109.5°109.5°
H9C21H10109.5°109.4°
H12C24H13109.5°109.5°
H12C24H14109.5°109.5°
H13C24H14109.5°109.5°
H15N26H16109.5°111.0°
H18C6H19109.5°109.5°
H24C23H25109.5°109.5°
H24C23H26109.5°109.5°
H25C23H26109.5°109.5°
H29C25H30109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C12C11C10H6180.0°179.3°
C11C12C1H7180.0°179.4°
C12C11C10C91.5°0.3°
C11C12C1C2179.5°179.7°
C11C12C1C80.4°0.6°
C12C11C10H5178.5°179.7°
C10C11C12C10.5°0.7°
C11C10C9H5180.0°179.9°
C11C10C9C82.5°0.0°
C11C10C9H4177.5°179.9°
C10C11C12H7179.5°180.0°
C12C1C2C8179.1°179.7°
C12C1C8C91.4°0.3°
C12C1C2O3109.3°90.3°
C12C1C2H1131.0°29.7°
C12C1C2H210.3°149.8°
C12C1C8H3178.6°179.7°
C1C12C11H6179.5°179.9°
C10C9C8C12.4°0.0°
C10C9C8H4180.0°179.9°
C10C9C8H3177.6°180.0°
C9C10C11H6178.5°179.6°
C2C1C8C9179.5°180.0°
C1C2O3H1119.6°120.0°
C1C2O3H2119.6°120.0°
C1C2O3C4143.3°180.0°
C1C2H1H2121.0°120.0°
C2C1C8H30.5°0.0°
C2C1C12H70.5°0.3°
C1C8C9H3180.0°180.0°
C8C1C2O369.8°90.0°
C8C1C2H149.9°150.0°
C8C1C2H2170.6°29.9°
C1C8C9H4177.6°179.9°
C8C1C12H7179.6°180.0°
C8C9C10H5177.5°179.9°
C2O3C4O718.3°0.0°
C2O3C4N5160.6°180.0°
O3C2H1H2121.1°120.0°
O3C4O7N5178.8°180.0°
O3C4N5C6176.1°180.0°
C4O3C2H123.7°60.0°
C4O3C2H297.0°60.0°
O3C4N5H283.9°0.1°
O7C4N5C62.8°0.0°
O7C4N5H28177.2°180.0°
C4N5C6H28180.0°179.9°
C4N5C6P13148.7°95.0°
C4N5C6H1891.8°25.0°
C4N5C6H1929.3°144.9°
N5C6P13H18119.4°119.9°
N5C6P13H19119.5°120.0°
N5C6P13O1585.3°60.0°
N5C6P13O1439.8°60.0°
N5C6P13N16158.2°180.0°
N5C6H18H19121.7°120.0°
C6P13O15O14125.8°120.0°
C6P13O15N16110.3°120.0°
C6P13O14N16111.4°120.0°
C6P13N16C17134.2°175.4°
P13C6H18H19121.6°120.1°
C6P13O14H20125.6°60.1°
C6P13N16H21104.9°51.6°
P13C6N5H2831.3°85.0°
O15P13O14N16123.1°120.0°
O15P13N16C1716.4°64.6°
O15P13C6H18155.3°60.0°
O15P13C6H1934.2°180.0°
O15P13O14H200.0°180.0°
O15P13N16H21137.4°171.5°
O14P13N16C17107.0°55.5°
O14P13C6H1879.7°179.9°
O14P13C6H19159.2°60.0°
O14P13N16H2113.9°68.4°
P13N16C17H21120.9°123.9°
P13N16C17C1883.6°114.5°
P13N16C17C25158.6°125.5°
N16P13C6H1838.7°60.0°
N16P13C6H1982.4°60.0°
N16P13O14H20123.0°59.9°
P13N16C17H2241.1°5.5°
O30C28O29C20175.6°179.9°
O30C28C20N19168.5°0.0°
O30C28C20C2164.4°120.0°
O30C28C20H853.5°120.0°
O30C28O29H270.0°0.1°
O29C28C20N197.7°180.0°
O29C28C20C21119.4°60.1°
O29C28C20H8122.7°60.0°
C28C20N19C21129.0°120.0°
C28C20N19H8114.5°120.0°
C28C20C21H8117.8°120.1°
C28C20N19C18145.8°85.0°
C28C20C21C2262.1°175.0°
C28C20C21H958.8°64.9°
C28C20C21H10176.9°55.0°
C28C20N19H2334.3°95.0°
C20C28O29H27175.6°180.0°
N19C20C21H8116.9°119.9°
C20N19C18H23180.0°180.0°
C20N19C18O272.5°0.0°
C20N19C18C17178.4°180.0°
N19C20C21C2263.2°65.0°
N19C20C21H9175.9°55.1°
N19C20C21H1057.8°175.0°
C21C20N19C1885.2°155.0°
C20C21C22H9120.9°120.0°
C20C21C22H10121.0°120.0°
C20C21C22C24150.7°175.0°
C20C21C22C2387.2°65.0°
C20C21H9H10117.1°119.9°
C20C21C22H1130.6°55.0°
C21C20N19H2394.8°25.0°
N16C17C18N1923.2°180.0°
N16C17C18O27157.7°0.0°
N16C17C18C25112.4°120.0°
N16C17C18H22124.7°120.0°
N16C17C25H22117.8°120.1°
N16C17C25N26177.0°56.3°
N16C17C25H2956.9°176.2°
N16C17C25H3063.0°63.7°
N19C18O27C17179.1°180.0°
N19C18C17C2589.2°60.0°
C18N19C20H831.3°35.0°
N19C18C17H22147.9°59.9°
O27C18C17C2589.9°120.0°
O27C18C17H2233.0°120.0°
O27C18N19H23177.5°180.0°
C18C17C25H22123.0°120.0°
C18C17C25N2663.9°176.3°
C18C17N16H21155.5°121.6°
C17C18N19H231.6°0.0°
C18C17C25H29176.1°63.8°
C18C17C25H3056.2°56.3°
C17C25N26H29120.1°120.0°
C17C25N26H30120.1°120.0°
C17C25N26H15180.0°174.6°
C17C25N26H1660.0°61.5°
C25C17N16H2137.6°1.6°
C17C25H29H30119.8°120.1°
C21C22C24C23122.8°120.0°
C21C22C24H11120.2°120.0°
C21C22C23H11117.9°120.0°
C22C21C20H8179.9°54.9°
C22C21H9H10117.1°120.0°
C21C22C24H12180.0°60.0°
C21C22C24H1360.0°179.9°
C21C22C24H1460.0°60.0°
C21C22C23H24180.0°180.0°
C21C22C23H2560.0°60.0°
C21C22C23H2660.0°60.0°
C24C22C23H11116.9°120.0°
C24C22C21H929.8°55.0°
C24C22C21H1088.3°65.0°
C22C24H12H13120.0°120.0°
C22C24H12H14120.0°120.0°
C22C24H13H14120.0°119.9°
C24C22C23H2454.8°60.0°
C24C22C23H2565.2°60.0°
C24C22C23H26174.9°180.0°
C23C22C21H9151.9°175.0°
C23C22C21H1033.7°55.0°
C23C22C24H1257.2°60.0°
C23C22C24H13177.2°60.1°
C23C22C24H1462.8°180.0°
C22C23H24H25120.0°120.0°
C22C23H24H26120.0°120.0°
C22C23H25H26120.0°120.0°
C25N26H15H16120.0°124.0°
N26C25C17H2259.2°63.8°
N26C25H29H30119.7°120.0°
H3C8C9H42.4°0.1°
H4C9C10H52.5°0.1°
H5C10C11H61.5°0.4°
H6C11C12H70.5°0.7°
H8C20C21H959.0°175.0°
H8C20C21H1059.1°65.1°
H8C20N19H23148.7°145.0°
H9C21C22H1190.3°65.0°
H10C21C22H11151.6°175.0°
H11C22C24H1259.8°180.0°
H11C22C24H1360.2°60.0°
H11C22C24H14179.8°60.0°
H11C22C23H2462.1°60.1°
H11C22C23H25177.9°180.0°
H11C22C23H2657.9°60.0°
H12C24H13H14120.0°120.1°
H15N26C25H2959.9°65.5°
H15N26C25H3059.9°54.6°
H16N26C25H29179.9°58.5°
H16N26C25H3060.1°178.5°
H18C6N5H2888.2°155.0°
H19C6N5H28150.7°35.0°
H21N16C17H2279.9°118.4°
H22C17C25H2960.9°56.2°
H22C17C25H30179.2°176.2°
H24C23H25H26120.0°120.1°

222415

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