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A1L69

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C02C01sing1.53Å1.53Å
C02C03sing1.53Å1.53Å
C04C03sing1.53Å1.54Å
C04C05sing1.53Å1.54Å
C05C06sing1.53Å1.54Å
C06C07sing1.53Å1.55Å
C07C08sing1.53Å1.55Å
C08C09sing1.53Å1.55Å
C09C10sing1.53Å1.55Å
C10C11sing1.53Å1.55Å
C11C12sing1.51Å1.51Å
N22C15sing1.47Å1.47Å
O23C14sing1.43Å1.40Å
C14C15sing1.53Å1.57Å
C14C13sing1.51Å1.51Å
C12C13doub1.31Å1.34Å
C15C16sing1.53Å1.59Å
O17C16sing1.43Å1.34Å
O17P18sing1.61Å1.84Å
O19P18doub1.48Å1.51Å
O20P18sing1.61Å1.51Å
P18O21sing1.61Å1.51Å
C11H1sing1.09Å1.10Å
C11H2sing1.09Å1.10Å
C14H3sing1.09Å1.10Å
C15H4sing1.09Å1.10Å
C16H5sing1.09Å1.10Å
C16H6sing1.09Å1.10Å
C01H7sing1.09Å1.10Å
C01H8sing1.09Å1.10Å
C01H9sing1.09Å1.10Å
C02H10sing1.09Å1.10Å
C02H11sing1.09Å1.10Å
C03H12sing1.09Å1.10Å
C03H13sing1.09Å1.10Å
C04H14sing1.09Å1.10Å
C04H15sing1.09Å1.10Å
C05H16sing1.09Å1.10Å
C05H17sing1.09Å1.10Å
C06H18sing1.09Å1.10Å
C06H19sing1.09Å1.10Å
C07H20sing1.09Å1.10Å
C07H21sing1.09Å1.10Å
C08H22sing1.09Å1.10Å
C08H23sing1.09Å1.10Å
C09H24sing1.09Å1.10Å
C09H25sing1.09Å1.10Å
C10H26sing1.09Å1.10Å
C10H27sing1.09Å1.10Å
C12H28sing1.08Å1.08Å
C13H29sing1.08Å1.08Å
N22H30sing1.01Å1.00Å
N22H31sing1.01Å1.00Å
O20H33sing0.97Å0.95Å
O21H34sing0.97Å0.95Å
O23H35sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C01C02C03113.3°109.5°
C02C01H7109.5°109.5°
C02C01H8109.5°109.4°
C02C01H9109.5°109.4°
C01C02H10108.5°109.4°
C01C02H11108.5°109.5°
C02C03C04113.3°109.5°
C03C02H10108.5°109.4°
C03C02H11108.5°109.5°
C02C03H12108.5°109.5°
C02C03H13108.5°109.5°
C03C04C05113.1°109.5°
C04C03H12108.5°109.5°
C04C03H13108.5°109.5°
C03C04H14108.5°109.5°
C03C04H15108.5°109.5°
C04C05C06115.1°109.5°
C05C04H14108.6°109.5°
C05C04H15108.5°109.5°
C04C05H16108.0°109.5°
C04C05H17108.1°109.5°
C05C06C07114.1°109.5°
C06C05H16108.1°109.5°
C06C05H17108.0°109.4°
C05C06H18108.3°109.5°
C05C06H19108.3°109.5°
C06C07C08114.9°109.5°
C07C06H18108.3°109.5°
C07C06H19108.3°109.4°
C06C07H20108.1°109.5°
C06C07H21108.1°109.4°
C07C08C09114.8°109.5°
C08C07H20108.1°109.5°
C08C07H21108.1°109.5°
C07C08H22108.1°109.5°
C07C08H23108.1°109.5°
C08C09C10116.0°109.4°
C09C08H22108.1°109.5°
C09C08H23108.2°109.5°
C08C09H24107.8°109.4°
C08C09H25107.8°109.5°
C09C10C11115.7°109.4°
C10C09H24107.8°109.5°
C10C09H25107.8°109.5°
C09C10H26107.9°109.5°
C09C10H27107.9°109.4°
C10C11C12115.2°109.4°
C10C11H1108.0°109.5°
C10C11H2108.0°109.5°
C11C10H26107.9°109.5°
C11C10H27107.9°109.5°
C11C12C13123.2°120.0°
C12C11H1108.0°109.5°
C12C11H2108.0°109.5°
C11C12H28118.4°120.0°
N22C15C14108.9°109.5°
N22C15C16112.1°109.5°
N22C15H4107.3°109.5°
C15N22H30109.5°111.1°
C15N22H31109.5°111.0°
O23C14C15112.1°109.5°
O23C14C13106.7°109.4°
O23C14H3107.7°109.5°
C14O23H35109.5°114.1°
C15C14C13117.8°109.5°
C14C15C16116.0°109.5°
C15C14H3105.7°109.5°
C14C15H4106.2°109.5°
C14C13C12125.2°120.0°
C13C14H3106.4°109.5°
C14C13H29117.4°120.0°
C13C12H28118.4°120.0°
C12C13H29117.4°120.0°
C15C16O17107.8°109.5°
C16C15H4105.9°109.4°
C15C16H5109.9°109.5°
C15C16H6109.9°109.5°
C16O17P18121.3°123.0°
O17C16H5109.9°109.5°
O17C16H6109.9°109.5°
O17P18O19100.8°109.4°
O17P18O20100.9°109.5°
O17P18O2199.9°109.5°
O19P18O20116.8°109.4°
O19P18O21117.4°109.5°
O20P18O21116.0°109.5°
P18O20H33109.5°114.0°
P18O21H34109.5°114.0°
H1C11H2109.5°109.4°
H5C16H6109.5°109.4°
H7C01H8109.5°109.5°
H7C01H9109.5°109.6°
H8C01H9109.5°109.4°
H10C02H11109.5°109.5°
H12C03H13109.5°109.5°
H14C04H15109.5°109.4°
H16C05H17109.5°109.4°
H18C06H19109.4°109.5°
H20C07H21109.5°109.5°
H22C08H23109.5°109.5°
H24C09H25109.5°109.5°
H26C10H27109.4°109.5°
H30N22H31109.4°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C01C02C03H10120.6°119.9°
C01C02C03H11120.6°120.1°
C01C02C03C04167.2°180.0°
C02C01H7H8120.0°120.0°
C02C01H7H9120.0°120.0°
C02C01H8H9120.0°119.9°
C01C02H10H11118.2°120.0°
C01C02C03H1272.2°60.0°
C01C02C03H1346.7°59.9°
C02C03C04H12120.6°120.0°
C02C03C04H13120.5°120.0°
C02C03C04C05175.9°180.0°
C03C02C01H7180.0°59.9°
C03C02C01H860.0°60.1°
C03C02C01H960.0°180.0°
C03C02H10H11118.2°120.0°
C02C03H12H13118.2°120.0°
C02C03C04H1463.5°60.0°
C02C03C04H1555.4°59.9°
C03C04C05H14120.5°120.0°
C03C04C05H15120.5°120.0°
C03C04C05C06157.6°180.0°
C04C03C02H1046.6°60.0°
C04C03C02H1172.2°60.0°
C04C03H12H13118.3°120.0°
C03C04H14H15118.3°120.0°
C03C04C05H1681.6°60.0°
C03C04C05H1736.8°60.0°
C04C05C06H16120.8°120.0°
C04C05C06H17120.8°120.0°
C04C05C06C07146.6°180.0°
C05C04C03H1255.3°60.0°
C05C04C03H1363.5°60.0°
C05C04H14H15118.3°120.0°
C04C05H16H17117.4°120.0°
C04C05C06H1825.9°60.0°
C04C05C06H1992.7°60.0°
C05C06C07H18120.7°120.1°
C05C06C07H19120.7°120.0°
C05C06C07C08123.6°180.0°
C06C05C04H1437.0°59.9°
C06C05C04H1581.9°60.0°
C06C05H16H17117.4°119.9°
C05C06H18H19117.9°120.0°
C05C06C07H202.8°60.0°
C05C06C07H21115.6°60.0°
C06C07C08H20120.8°120.1°
C06C07C08H21120.8°119.9°
C06C07C08C09173.7°180.0°
C07C06C05H1692.6°59.9°
C07C06C05H1725.8°60.0°
C07C06H18H19117.9°119.9°
C06C07H20H21117.5°120.0°
C06C07C08H2252.9°59.9°
C06C07C08H2365.5°60.1°
C07C08C09H22120.8°120.0°
C07C08C09H23120.8°120.0°
C07C08C09C10128.5°180.0°
C08C07C06H18115.7°59.9°
C08C07C06H192.9°60.0°
C08C07H20H21117.5°120.0°
C07C08H22H23117.6°120.0°
C07C08C09H247.5°60.0°
C07C08C09H25110.6°60.0°
C08C09C10H24120.9°119.9°
C08C09C10H25121.0°120.0°
C08C09C10C11135.8°180.0°
C09C08C07H2065.5°60.0°
C09C08C07H2152.9°60.0°
C09C08H22H23117.6°120.0°
C08C09H24H25117.0°120.0°
C08C09C10H2614.9°60.0°
C08C09C10H27103.3°60.0°
C09C10C11H26120.9°120.0°
C09C10C11H27120.9°119.9°
C09C10C11C12122.4°180.0°
C09C10C11H11.6°60.0°
C09C10C11H2116.8°60.0°
C10C09C08H22110.8°60.0°
C10C09C08H237.7°60.0°
C10C09H24H25117.0°120.1°
C09C10H26H27117.1°120.0°
C10C11C12H1120.8°120.0°
C10C11C12H2120.8°120.0°
C10C11C12C13156.7°127.6°
C10C11H1H2117.4°120.1°
C11C10C09H24103.3°60.1°
C11C10C09H2514.8°60.0°
C11C10H26H27117.2°120.0°
C10C11C12H2823.3°52.5°
C11C12C13C140.0°7.8°
C11C12C13H28180.0°179.9°
C12C11H1H2117.4°120.0°
C12C11C10H26116.7°60.0°
C12C11C10H271.5°60.1°
C11C12C13H29180.0°172.2°
N22C15C14O2374.1°180.0°
N22C15C14C16127.5°120.1°
N22C15C14H4115.2°120.0°
N22C15C14C13161.6°60.0°
N22C15C16H4116.7°120.0°
N22C15C16O1750.0°65.0°
N22C15C14H343.0°60.0°
N22C15C16H569.8°175.0°
N22C15C16H6169.7°55.0°
C15N22H30H31120.0°124.0°
O23C14C15C13124.3°120.0°
O23C14C15H3117.1°120.0°
O23C14C13H3114.8°120.0°
O23C14C13C1280.4°112.1°
O23C14C15C1653.4°60.0°
O23C14C15H4170.7°60.0°
O23C14C13H2999.6°67.9°
C15C14C13H3118.3°120.0°
C15C14C13C12152.7°127.9°
C14C15C16H4117.5°120.0°
C14C15C16O1775.9°175.0°
C14C15C16H5164.3°55.0°
C14C15C16H643.8°65.0°
C15C14C13H2927.4°52.1°
C14C15N22H30180.0°176.0°
C14C15N22H3160.0°60.0°
C15C14O23H35180.0°60.0°
C14C13C12H29180.0°180.0°
C13C14C15C1670.9°180.0°
C13C14C15H446.4°60.0°
C14C13C12H28180.0°172.1°
C13C14O23H3549.7°60.0°
C13C12C11H182.5°7.6°
C13C12C11H235.8°112.4°
C12C13C14H334.4°7.8°
C15C16O17H5119.7°120.1°
C15C16O17H6119.7°120.0°
C15C16O17P18165.7°179.9°
C16C15C14H3170.5°60.0°
C15C16H5H6120.7°120.0°
C16C15N22H3050.3°63.9°
C16C15N22H3169.7°60.0°
C16O17P18O19156.0°55.0°
C16O17P18O2083.8°64.9°
C16O17P18O2135.4°175.0°
O17C16C15H4166.6°55.0°
O17C16H5H6120.8°120.0°
O17P18O19O20108.1°120.0°
O17P18O19O21107.3°120.0°
O17P18O20O21106.8°120.0°
P18O17C16H545.9°60.0°
P18O17C16H674.6°60.0°
O17P18O20H33108.1°60.1°
O17P18O21H34107.8°179.9°
O19P18O20O21145.1°120.0°
O19P18O20H330.0°180.0°
O19P18O21H340.0°59.9°
O20P18O21H34144.9°60.1°
O21P18O20H33145.1°60.0°
H1C11C10H26122.5°60.0°
H1C11C10H27119.4°180.0°
H1C11C12H2897.5°172.5°
H2C11C10H264.1°180.0°
H2C11C10H27122.3°59.9°
H2C11C12H28144.1°67.5°
H3C14C15H472.2°180.0°
H3C14C13H29145.7°172.1°
H3C14O23H3564.1°180.0°
H4C15C16H546.9°65.0°
H4C15C16H673.6°175.0°
H4C15N22H3065.5°56.1°
H4C15N22H31174.5°180.0°
H7C01H8H9120.0°120.1°
H7C01C02H1059.4°60.0°
H7C01C02H1159.4°180.0°
H8C01C02H1060.6°180.0°
H8C01C02H11179.5°60.0°
H9C01C02H10179.4°60.1°
H9C01C02H1160.6°60.0°
H10C02C03H12167.2°180.0°
H10C02C03H1373.9°60.0°
H11C02C03H1248.4°60.0°
H11C02C03H13167.2°NaN°
H12C03C04H14175.9°180.0°
H12C03C04H1565.2°60.1°
H13C03C04H1457.0°60.0°
H13C03C04H15175.9°179.9°
H14C04C05H16157.9°180.0°
H14C04C05H1783.8°60.0°
H15C04C05H1639.0°60.1°
H15C04C05H17157.3°180.0°
H16C05C06H18146.7°180.0°
H16C05C06H1928.1°60.0°
H17C05C06H1894.9°60.0°
H17C05C06H19146.5°180.0°
H18C06C07H20123.5°180.0°
H18C06C07H215.1°60.0°
H19C06C07H20117.9°60.0°
H19C06C07H21123.7°180.0°
H20C07C08H22173.7°180.0°
H20C07C08H2355.3°60.0°
H21C07C08H2267.9°60.0°
H21C07C08H23173.6°180.0°
H22C08C09H24128.3°180.0°
H22C08C09H2510.2°60.0°
H23C08C09H24113.3°60.0°
H23C08C09H25128.7°180.0°
H24C09C10H26135.8°60.0°
H24C09C10H2717.7°180.0°
H25C09C10H26106.1°180.0°
H25C09C10H27135.8°59.9°
H28C12C13H290.0°7.9°

247947

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