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7WR

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O08C07sing1.36Å1.40Å
C07C06doub1.38Å1.41ÅAromatic
C07C09sing1.39Å1.37ÅAromatic
C06C05sing1.40Å1.39ÅAromatic
O12C11doub1.22Å1.26Å
O10C09sing1.36Å1.39Å
C09C03doub1.39Å1.38ÅAromatic
C05C11sing1.47Å1.53Å
C05C04doub1.40Å1.40ÅAromatic
C11O13sing1.35Å1.27Å
C03C04sing1.38Å1.38ÅAromatic
C03O02sing1.36Å1.41Å
C01O02sing1.43Å1.41Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
C04H4sing1.08Å1.08Å
C06H5sing1.08Å1.08Å
O08H6sing0.97Å0.95Å
O10H7sing0.97Å0.95Å
O13H8sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O08C07C06123.1°120.0°
O08C07C09115.6°119.9°
C07O08H6109.5°114.0°
C06C07C09121.4°120.1°
C07C06C05117.5°119.9°
C07C06H5121.2°120.0°
C07C09O10117.6°120.0°
C07C09C03120.9°120.1°
C06C05C11123.1°120.1°
C06C05C04120.6°119.9°
C05C06H5121.3°120.1°
O12C11C05120.7°120.0°
O12C11O13121.4°120.0°
O10C09C03121.5°120.0°
C09O10H7109.5°114.0°
C09C03C04118.4°120.1°
C09C03O02121.5°119.9°
C11C05C04116.3°120.1°
C05C11O13117.9°120.0°
C05C04C03121.2°119.9°
C05C04H4119.4°120.0°
C11O13H8109.5°117.0°
C04C03O02120.1°120.0°
C03C04H4119.4°120.0°
C03O02C01116.0°117.0°
O02C01H1109.5°109.5°
O02C01H2109.4°109.5°
O02C01H3109.4°109.5°
H1C01H2109.5°109.4°
H1C01H3109.5°109.5°
H2C01H3109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O08C07C06C09179.9°179.8°
O08C07C06C05179.6°179.9°
O08C07C09O100.5°0.1°
O08C07C09C03179.5°179.7°
O08C07C06H50.4°0.0°
C07C06C05H5180.0°180.0°
C06C07C09O10179.5°180.0°
C06C07C09C030.5°0.5°
C07C06C05C11179.6°180.0°
C07C06C05C041.3°0.0°
C06C07O08H6180.0°90.0°
C09C07C06C050.4°0.2°
C07C09O10C03179.0°179.6°
C07C09C03C040.5°0.5°
C07C09C03O02179.6°179.8°
C09C07C06H5179.6°179.8°
C09C07O08H60.1°89.8°
C07C09O10H7180.0°90.0°
C06C05C11O127.5°180.0°
C06C05C11C04178.4°180.0°
C06C05C11O13172.7°0.0°
C06C05C04C031.4°0.0°
C06C05C04H4178.6°180.0°
O12C11C05O13179.8°180.0°
O12C11C05C04174.2°0.0°
O12C11O13H80.0°0.0°
O10C09C03C04179.4°180.0°
O10C09C03O021.5°0.2°
C09C03C04C050.5°0.2°
C09C03C04O02179.1°179.8°
C09C03O02C0166.4°179.8°
C09C03C04H4179.5°179.8°
C03C09O10H71.0°90.5°
C11C05C04C03179.8°180.0°
C11C05C04H40.2°0.0°
C11C05C06H50.4°0.0°
C05C11O13H8179.8°180.0°
C04C05C11O135.6°180.0°
C05C04C03H4180.0°180.0°
C05C04C03O02178.6°180.0°
C04C05C06H5178.7°180.0°
C04C03O02C01114.5°0.0°
C03O02C01H1180.0°179.9°
C03O02C01H260.0°60.0°
C03O02C01H360.0°60.0°
O02C03C04H41.3°0.0°
O02C01H1H2120.0°120.0°
O02C01H1H3120.0°120.1°
O02C01H2H3120.0°120.0°
H1C01H2H3120.1°119.9°

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