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Obsolete: 0AM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
P1O1doub1.48Å1.47Å
P1O2sing1.61Å1.48Å
P1O3sing1.61Å1.59Å
P1O6sing1.61Å1.61Å
O2H1sing0.97Å0.95Å
O3C1sing1.43Å1.40Å
C1C2sing1.53Å1.50Å
C1H3sing1.09Å1.10Å
C1H4sing1.09Å1.10Å
C2O4sing1.44Å1.45Å
C2C3sing1.55Å1.53Å
C2H5sing1.09Å1.10Å
O4C5sing1.44Å1.42Å
C3O5sing1.43Å1.42Å
C3C4sing1.55Å1.53Å
C3H6sing1.09Å1.10Å
O5H8sing0.97Å0.95Å
C4C5sing1.54Å1.53Å
C4H9sing1.09Å1.10Å
C4H10sing1.09Å1.10Å
C5N1sing1.47Å1.47Å
C5H7sing1.09Å1.10Å
N1C6sing1.36Å1.37ÅAromatic
N1C16sing1.37Å1.38ÅAromatic
C6N2doub1.30Å1.31ÅAromatic
C6H11sing1.08Å1.08Å
N2C7sing1.35Å1.40ÅAromatic
C7C8sing1.41Å1.41ÅAromatic
C7C16doub1.40Å1.38ÅAromatic
C8N3sing1.38Å1.33Å
C8N4doub1.33Å1.35ÅAromatic
N3C9sing1.47Å1.45Å
S1S2sing2.05Å2.03Å
S1C11sing1.81Å1.81Å
S2C14sing1.81Å1.82Å
C9C10sing1.53Å1.53Å
C9H12sing1.09Å1.10Å
C9H13sing1.09Å1.10Å
C10C11sing1.53Å1.52Å
C10H18sing1.09Å1.10Å
C10H19sing1.09Å1.10Å
C11H14sing1.09Å1.10Å
C11H15sing1.09Å1.10Å
C12C13sing1.53Å1.51Å
C12H20sing1.09Å1.10Å
C12H21sing1.09Å1.10Å
C12H22sing1.09Å1.10Å
C13C14sing1.53Å1.52Å
C13H23sing1.09Å1.10Å
C13H24sing1.09Å1.10Å
C14H16sing1.09Å1.10Å
C14H17sing1.09Å1.10Å
N4C15sing1.32Å1.33Å
C15N5doub1.32Å1.34ÅAromatic
C15H25sing1.08Å1.08ÅAromatic
C16N5sing1.33Å1.34Å
O6H2sing0.97Å0.95ÅAromatic
N3H26sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1P1O2120.8°109.5°
O1P1O3103.7°109.5°
O1P1O6106.1°109.5°
O2P1O3108.4°109.5°
O2P1O6112.8°109.4°
P1O2H1109.5°114.0°
O3P1O6103.3°109.5°
P1O3C1120.1°123.0°
P1O6H2109.5°114.0°
O3C1C2109.1°109.5°
O3C1H3109.6°109.5°
O3C1H4109.7°109.5°
C2C1H3109.6°109.5°
C2C1H4109.7°109.4°
C1C2O4108.3°110.6°
C1C2C3113.6°110.7°
C1C2H5106.6°110.6°
H3C1H4109.1°109.5°
O4C2C3106.7°103.5°
O4C2H5113.6°110.6°
C2O4C5110.2°107.0°
C3C2H5108.2°110.7°
C2C3O5106.1°110.9°
C2C3C4104.0°102.1°
C2C3H6117.0°110.8°
O4C5C4104.0°107.3°
O4C5N1107.1°109.9°
O4C5H7116.7°109.9°
O5C3C4114.8°110.9°
O5C3H6106.6°110.8°
C3O5H8109.5°114.1°
C4C3H6108.6°110.9°
C3C4C5103.6°104.2°
C3C4H9111.5°110.5°
C3C4H10112.7°110.4°
C5C4H9111.5°110.5°
C5C4H10112.7°110.5°
C4C5N1115.6°109.9°
C4C5H7108.5°109.9°
H9C4H10105.0°110.6°
N1C5H7105.4°109.9°
C5N1C6126.6°126.2°
C5N1C16127.8°126.3°
C6N1C16105.6°107.5°
N1C6N2114.4°109.9°
N1C6H11122.8°125.1°
N1C16C7105.7°105.9°
N1C16N5127.3°134.9°
N2C6H11122.8°125.0°
C6N2C7103.6°109.5°
N2C7C8132.3°134.7°
N2C7C16110.7°107.2°
C8C7C16117.0°118.1°
C7C8N3124.2°120.8°
C7C8N4117.2°118.4°
C7C16N5127.0°119.1°
N3C8N4118.5°120.8°
C8N3C9128.3°120.0°
C8N3H26103.6°120.0°
C8N4C15118.9°121.2°
N3C9C10124.4°109.5°
N3C9H12104.8°109.5°
N3C9H13101.3°109.4°
C9N3H26103.6°119.9°
S2S1C11118.5°103.0°
S1S2C14119.0°103.0°
S1C11C10106.5°109.5°
S1C11H14110.5°109.5°
S1C11H15111.1°109.5°
S2C14C13108.9°109.5°
S2C14H16109.6°109.5°
S2C14H17109.8°109.5°
C10C9H12104.8°109.5°
C10C9H13101.3°109.5°
C9C10C11106.9°109.5°
C9C10H18110.3°109.4°
C9C10H19110.9°109.5°
H12C9H13122.1°109.4°
C11C10H18110.4°109.5°
C11C10H19110.9°109.5°
C10C11H14110.5°109.5°
C10C11H15111.1°109.5°
H18C10H19107.5°109.5°
H14C11H15107.2°109.4°
C13C12H20109.5°109.5°
C13C12H21109.5°109.5°
C13C12H22109.5°109.4°
C12C13C14104.0°109.5°
C12C13H23111.4°109.5°
C12C13H24112.5°109.5°
H20C12H21109.4°109.5°
H20C12H22109.4°109.5°
H21C12H22109.5°109.5°
C14C13H23111.4°109.5°
C14C13H24112.5°109.5°
C13C14H16109.7°109.5°
C13C14H17109.7°109.5°
H23C13H24105.3°109.4°
H16C14H17109.1°109.4°
N4C15N5129.6°122.4°
N4C15H25115.2°118.8°
N5C15H25115.2°118.8°
C15N5C16110.3°120.7°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1P1O2O3119.2°120.0°
O1P1O2O6127.0°119.9°
O1P1O3O6110.5°120.0°
O1P1O2H170.7°180.0°
O1P1O3C141.3°55.0°
O1P1O6H2154.7°60.0°
O2P1O3O6119.9°120.0°
O2P1O3C1170.9°65.0°
O2P1O6H220.2°60.0°
O3P1O2H148.5°59.9°
P1O3C1C2168.7°180.0°
P1O3C1H348.7°60.0°
P1O3C1H471.1°60.0°
O3P1O6H296.6°180.0°
O6P1O2H1162.3°60.1°
O6P1O3C169.2°175.0°
O3C1C2H3120.0°120.1°
O3C1C2H4120.2°120.0°
O3C1H3H4120.2°120.0°
O3C1C2O467.3°66.5°
O3C1C2C351.0°179.5°
O3C1C2H5170.1°56.4°
C2C1H3H4120.1°119.9°
C1C2O4C3122.7°118.5°
C1C2O4H5118.2°122.9°
C1C2C3H5118.2°123.0°
C1C2O4C5136.9°158.6°
C1C2C3O5127.3°86.3°
C1C2C3C4111.2°155.5°
C1C2C3H68.5°37.3°
H3C1C2O4172.7°53.6°
H3C1C2C369.0°60.5°
H3C1C2H550.1°176.4°
H4C1C2O452.9°173.5°
H4C1C2C3171.2°59.5°
H4C1C2H569.7°63.6°
O4C2C3H5122.5°118.5°
O4C2C3O5113.5°155.2°
O4C2C3C48.0°37.0°
O4C2C3H6127.8°81.2°
C2O4C5C430.4°26.5°
C2O4C5N1153.2°146.0°
C2O4C5H789.0°93.0°
C3C2O4C514.3°40.0°
C2C3O5C4114.3°112.8°
C2C3O5H6125.4°123.5°
C2C3C4H6125.3°118.1°
C2C3O5H833.0°180.0°
C2C3C4C525.2°20.9°
C2C3C4H994.8°139.5°
C2C3C4H10147.4°97.8°
H5C2O4C5104.9°78.6°
H5C2C3O59.1°36.7°
H5C2C3C4130.6°81.5°
H5C2C3H6109.7°160.3°
O4C5C4C334.1°2.1°
O4C5C4N1117.1°119.4°
O4C5C4H7124.9°119.5°
O4C5C4H985.9°116.7°
O4C5C4H10156.3°120.7°
O4C5N1H7125.0°121.1°
O4C5N1C664.5°23.6°
O4C5N1C16115.1°156.7°
O5C3C4H6119.3°123.6°
O5C3C4C590.3°139.1°
O5C3C4H9149.7°102.2°
O5C3C4H1031.9°20.4°
C4C3O5H8147.2°67.3°
C3C4C5H9120.0°118.7°
C3C4C5H10122.2°118.6°
C3C4H9H10122.4°122.6°
C3C4C5N1151.2°121.5°
C3C4C5H790.8°117.4°
H6C3O5H892.4°56.4°
H6C3C4C5150.5°97.3°
H6C3C4H930.4°21.4°
H6C3C4H1087.4°144.1°
C5C4H9H10122.4°122.6°
C4C5N1H7119.7°121.1°
C4C5N1C650.8°94.3°
C4C5N1C16129.6°85.4°
H9C4C5N131.2°2.8°
H9C4C5H7149.2°123.9°
H10C4C5N186.7°119.9°
H10C4C5H731.4°1.2°
C5N1C6C16179.7°179.7°
C5N1C6N2179.4°180.0°
C5N1C6H110.6°0.1°
C5N1C16C7179.4°179.9°
C5N1C16N50.8°0.8°
H7C5N1C6170.5°144.7°
H7C5N1C169.8°35.7°
N1C6N2H11180.0°179.9°
N1C6N2C70.2°0.0°
C6N1C16C70.3°0.4°
C6N1C16N5179.5°179.5°
C16N1C6N20.3°0.3°
C16N1C6H11179.7°179.8°
N1C16C7N20.2°0.4°
N1C16C7C8180.0°179.8°
N1C16C7N5179.8°179.2°
N1C16N5C15179.9°179.6°
C6N2C7C8179.7°180.0°
C6N2C7C160.0°0.3°
H11C6N2C7179.8°180.0°
N2C7C8C16179.8°179.7°
N2C7C8N31.1°0.0°
N2C7C8N4179.7°179.9°
N2C7C16N5179.6°179.7°
C7C8N3N4179.2°179.9°
C7C8N3C90.5°180.0°
C7C8N4C150.1°0.1°
C8C7C16N50.2°0.6°
C7C8N3H26119.5°0.1°
C16C7C8N3179.1°179.6°
C16C7C8N40.1°0.3°
C7C16N5C150.1°0.6°
C8N3C9H26120.0°179.9°
C8N3C9C1088.5°180.0°
C8N3C9H12151.4°60.0°
C8N3C9H1323.7°59.9°
N3C8N4C15179.3°180.0°
N4C8N3C9178.7°0.1°
C8N4C15N50.1°0.0°
C8N4C15H25179.9°179.9°
N4C8N3H2661.3°180.0°
N3C9C10H12120.0°120.0°
N3C9C10H13112.2°120.0°
N3C9H12H13113.8°119.9°
N3C9C10C11179.2°180.0°
N3C9C10H1860.8°60.0°
N3C9C10H1958.2°60.0°
S2S1C11C1049.0°70.0°
S2S1C11H1471.0°170.0°
S2S1C11H15170.2°50.0°
S1S2C14C1352.8°70.0°
S1S2C14H1667.2°170.0°
S1S2C14H17173.0°50.0°
C11S1S2C14102.8°85.0°
S1C11C10C989.5°180.0°
S1C11C10H14120.0°120.0°
S1C11C10H15121.1°120.1°
S1C11C10H18150.5°60.0°
S1C11C10H1931.5°60.0°
S1C11H14H15121.2°120.0°
S2C14C13C1291.0°180.0°
S2C14C13H16120.0°120.0°
S2C14C13H17120.2°120.0°
S2C14C13H23149.0°60.0°
S2C14C13H2431.1°60.0°
S2C14H16H17120.2°120.0°
C10C9H12H13113.8°120.0°
C9C10C11H18120.0°120.0°
C9C10C11H19121.0°120.0°
C9C10H18H19121.0°120.0°
C9C10C11H14150.5°60.0°
C9C10C11H1531.7°60.0°
C10C9N3H2631.4°0.1°
H12C9C10C1159.2°60.0°
H12C9C10H18179.2°179.9°
H12C9C10H1961.8°60.1°
H12C9N3H2688.6°120.1°
H13C9C10C1168.6°60.0°
H13C9C10H1851.4°60.0°
H13C9C10H19170.4°180.0°
H13C9N3H26143.6°120.0°
C11C10H18H19121.1°120.0°
C10C11H14H15121.2°120.0°
H18C10C11H1430.5°60.0°
H18C10C11H1588.4°179.9°
H19C10C11H1488.5°180.0°
H19C10C11H15152.7°60.1°
C13C12H20H21120.0°120.0°
C13C12H20H22120.0°120.0°
C13C12H21H22120.0°119.9°
C12C13C14H23120.0°120.0°
C12C13C14H24122.1°120.0°
C12C13H23H24122.2°120.0°
C12C13C14H16149.1°60.0°
C12C13C14H1729.3°60.0°
H20C12H21H22120.0°120.0°
H20C12C13C14159.8°60.0°
H20C12C13H2380.2°60.0°
H20C12C13H2437.8°180.0°
H21C12C13C1480.2°60.0°
H21C12C13H2339.8°180.0°
H21C12C13H24157.7°60.0°
H22C12C13C1439.8°180.0°
H22C12C13H23159.8°60.0°
H22C12C13H2482.2°60.0°
C14C13H23H24122.2°120.0°
C13C14H16H17120.2°120.0°
H23C13C14H1629.0°60.0°
H23C13C14H1790.7°180.0°
H24C13C14H1688.9°180.0°
H24C13C14H17151.3°60.0°
N4C15N5H25180.0°180.0°
N4C15N5C160.0°0.3°
H25C15N5C16180.0°179.7°

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