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9EM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F62C60sing1.40Å1.33Å
F63C60sing1.40Å1.33Å
F61C60sing1.40Å1.33Å
C60C57sing1.53Å1.50Å
O1C2doub1.21Å1.22Å
C15C14sing1.53Å1.53Å
C57N56sing1.47Å1.45Å
N55N56sing1.40Å1.37ÅAromatic
N55C53doub1.31Å1.33ÅAromatic
N56C50sing1.36Å1.36ÅAromatic
N42C41sing1.38Å1.35Å
C2C3sing1.51Å1.50Å
C2N7sing1.35Å1.40Å
C53C51sing1.40Å1.39ÅAromatic
C50C51doub1.38Å1.40ÅAromatic
C50C39sing1.48Å1.46Å
C41N45doub1.32Å1.33ÅAromatic
C41C40sing1.41Å1.43ÅAromatic
C14N7sing1.47Å1.50Å
C14C19sing1.53Å1.53Å
C14C23sing1.50Å1.54Å
N45C46sing1.33Å1.33ÅAromatic
N7C8sing1.47Å1.47Å
C40C39doub1.40Å1.41ÅAromatic
C40N49sing1.38Å1.38ÅAromatic
C39C37sing1.40Å1.42ÅAromatic
C46N48doub1.31Å1.30ÅAromatic
C23O24doub1.21Å1.23Å
C23N25sing1.33Å1.37Å
N49N48sing1.40Å1.39ÅAromatic
N49C36sing1.36Å1.41ÅAromatic
C37C36doub1.38Å1.37ÅAromatic
C11N25sing1.46Å1.47Å
C11C8sing1.53Å1.50Å
N25C26sing1.40Å1.43Å
C36C33sing1.48Å1.48Å
C31C26doub1.39Å1.40ÅAromatic
C31C33sing1.40Å1.39ÅAromatic
C26C27sing1.39Å1.40ÅAromatic
C33C34doub1.40Å1.39ÅAromatic
C27C29doub1.38Å1.39ÅAromatic
C34C29sing1.38Å1.39ÅAromatic
C15H1sing1.09Å1.10Å
C15H2sing1.09Å1.10Å
C15H3sing1.09Å1.10Å
C19H4sing1.09Å1.10Å
C19H5sing1.09Å1.10Å
C19H6sing1.09Å1.10Å
C11H7sing1.09Å1.10Å
C11H8sing1.09Å1.10Å
C34H9sing1.08Å1.08Å
C27H10sing1.08Å1.08Å
C3H11sing1.09Å1.10Å
C3H12sing1.09Å1.10Å
C3H13sing1.09Å1.10Å
C8H14sing1.09Å1.10Å
C8H15sing1.09Å1.10Å
C29H16sing1.08Å1.08Å
C31H17sing1.08Å1.08Å
C37H18sing1.08Å1.08Å
N42H19sing0.97Å1.00Å
N42H20sing0.97Å1.00Å
C46H21sing1.08Å1.08Å
C51H22sing1.08Å1.08Å
C53H23sing1.08Å1.08Å
C57H24sing1.09Å1.10Å
C57H25sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F62C60F63106.4°109.5°
F62C60F61106.3°109.5°
F62C60C57111.7°109.5°
F63C60F61107.6°109.4°
F63C60C57113.3°109.5°
F61C60C57111.1°109.5°
C60C57N56111.0°109.5°
C60C57H24109.1°109.5°
C60C57H25109.1°109.5°
O1C2C3120.0°120.0°
O1C2N7122.0°120.0°
C15C14N7110.9°109.6°
C15C14C19107.9°109.6°
C15C14C23105.8°109.6°
C14C15H1109.5°109.5°
C14C15H2109.5°109.5°
C14C15H3109.5°109.5°
C57N56N55119.4°126.1°
C57N56C50128.9°126.1°
N56C57H24109.1°109.5°
N56C57H25109.1°109.4°
N56N55C53104.5°108.7°
N55N56C50111.7°107.8°
N55C53C51112.6°108.7°
N55C53H23123.7°125.6°
N56C50C51106.4°107.1°
N56C50C39128.0°126.4°
N42C41N45118.2°120.4°
N42C41C40121.6°120.4°
C41N42H19109.5°120.0°
C41N42H20109.5°120.0°
C3C2N7118.0°120.0°
C2C3H11109.5°109.5°
C2C3H12109.5°109.5°
C2C3H13109.5°109.4°
C2N7C14124.4°121.3°
C2N7C8120.1°121.4°
C53C51C50104.7°107.6°
C53C51H22127.6°126.2°
C51C53H23123.7°125.7°
C51C50C39125.6°126.5°
C50C51H22127.7°126.2°
C50C39C40126.8°126.5°
C50C39C37125.6°126.6°
N45C41C40120.2°119.2°
C41N45C46118.6°121.6°
C41C40C39138.6°133.5°
C41C40N49115.1°118.6°
N7C14C19110.0°109.7°
N7C14C23114.4°108.9°
C14N7C8115.4°117.3°
C19C14C23107.5°109.5°
C14C19H4109.5°109.5°
C14C19H5109.5°109.5°
C14C19H6109.5°109.5°
C14C23O24119.6°118.5°
C14C23N25119.6°123.0°
N45C46N48128.1°122.2°
N45C46H21115.9°118.9°
N7C8C11112.1°108.3°
N7C8H14108.8°109.8°
N7C8H15108.8°109.5°
C39C40N49106.3°107.9°
C40C39C37107.6°106.9°
C40N49N48124.5°118.4°
C40N49C36110.9°108.7°
C39C37C36109.0°107.6°
C39C37H18125.5°126.2°
C46N48N49113.5°120.0°
N48C46H21116.0°118.9°
O24C23N25120.8°118.5°
C23N25C11123.1°124.6°
C23N25C26123.4°117.7°
N48N49C36124.6°132.9°
N49C36C37106.2°108.9°
N49C36C33124.4°125.6°
C37C36C33129.3°125.6°
C36C37H18125.5°126.2°
N25C11C8108.7°110.8°
C11N25C26113.4°117.7°
N25C11H7109.6°109.2°
N25C11H8109.6°109.2°
C8C11H7109.7°109.2°
C8C11H8109.7°109.2°
C11C8H14108.8°109.8°
C11C8H15108.8°109.7°
N25C26C31119.2°120.0°
N25C26C27121.0°120.0°
C36C33C31118.8°120.1°
C36C33C34121.8°120.1°
C26C31C33120.4°119.8°
C31C26C27119.8°120.0°
C26C31H17119.8°120.1°
C31C33C34119.4°119.8°
C33C31H17119.8°120.1°
C26C27C29119.7°120.2°
C26C27H10120.1°119.9°
C33C34C29120.4°120.0°
C33C34H9119.8°120.0°
C27C29C34120.3°120.2°
C29C27H10120.2°119.9°
C27C29H16119.9°119.9°
C29C34H9119.8°120.1°
C34C29H16119.8°119.8°
H1C15H2109.5°109.4°
H1C15H3109.5°109.5°
H2C15H3109.5°109.4°
H4C19H5109.5°109.4°
H4C19H6109.4°109.4°
H5C19H6109.5°109.5°
H7C11H8109.5°109.2°
H11C3H12109.4°109.5°
H11C3H13109.5°109.5°
H12C3H13109.5°109.4°
H14C8H15109.4°109.7°
H19N42H20109.5°119.9°
H24C57H25109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F62C60F63F61113.6°120.0°
F62C60F63C57123.2°120.0°
F62C60F61C57121.8°120.0°
F62C60C57N5662.3°179.9°
F62C60C57H2457.9°60.0°
F62C60C57H25177.5°60.0°
F63C60F61C57124.6°120.0°
F63C60C57N56177.5°59.9°
F63C60C57H2462.3°180.0°
F63C60C57H2557.3°60.0°
F61C60C57N5656.3°60.1°
F61C60C57H24176.5°60.0°
F61C60C57H2564.0°180.0°
C60C57N56H24120.3°120.1°
C60C57N56H25120.2°119.9°
C60C57N56N5566.9°84.8°
C60C57N56C50112.0°95.6°
C60C57H24H25119.3°120.0°
O1C2C3N7179.5°179.9°
O1C2N7C141.1°4.6°
O1C2N7C8178.8°175.4°
O1C2C3H110.0°93.1°
O1C2C3H12120.0°146.8°
O1C2C3H13120.0°26.9°
C15C14N7C242.0°17.3°
C15C14N7C19119.3°120.3°
C15C14N7C23119.6°119.8°
C15C14C19C23113.7°120.2°
C15C14N7C8138.1°162.6°
C15C14C23O2465.3°47.4°
C15C14C23N25114.4°132.8°
C14C15H1H2120.0°120.0°
C14C15H1H3120.0°120.1°
C14C15H2H3120.0°120.0°
C15C14C19H4180.0°60.0°
C15C14C19H560.0°180.0°
C15C14C19H660.0°60.0°
C57N56N55C50179.1°179.7°
C57N56N55C53179.0°179.9°
C57N56C50C51178.9°180.0°
C57N56C50C391.5°0.2°
N56C57H24H25119.3°119.9°
N56N55C53C510.1°0.3°
N55N56C50C510.1°0.3°
N55N56C50C39179.5°179.9°
N56N55C53H23179.9°179.8°
N55N56C57H2453.3°155.2°
N55N56C57H25172.8°35.2°
C53N55N56C500.1°0.4°
N55C53C51H23180.0°179.9°
N55C53C51C500.0°0.1°
N55C53C51H22180.0°180.0°
N56C50C51C530.1°0.2°
N56C50C51C39179.6°179.8°
N56C50C39C40138.0°125.5°
N56C50C39C3742.7°54.5°
N56C50C51H22179.9°179.8°
C50N56C57H24127.7°24.5°
C50N56C57H258.2°144.4°
N42C41N45C40179.8°179.9°
N42C41N45C46179.5°179.9°
N42C41C40C390.8°0.2°
N42C41C40N49179.4°179.7°
C41N42H19H20120.0°179.9°
C3C2N7C14179.4°175.5°
C3C2N7C80.7°4.5°
C2C3H11H12120.0°120.0°
C2C3H11H13120.0°119.9°
C2C3H12H13120.0°119.9°
C2N7C14C8179.9°179.9°
C2N7C14C1977.3°103.0°
C2N7C14C23161.6°137.1°
C2N7C8C11127.6°118.5°
N7C2C3H11179.5°86.8°
N7C2C3H1260.5°33.2°
N7C2C3H1359.5°153.2°
C2N7C8H14112.0°1.3°
C2N7C8H157.1°121.8°
C53C51C50H22180.0°180.0°
C53C51C50C39179.5°180.0°
C51C50C39C4042.5°54.3°
C51C50C39C37136.8°125.7°
C50C51C53H23180.0°180.0°
C50C39C40C410.4°0.1°
C50C39C40C37179.4°180.0°
C50C39C40N49179.3°179.8°
C50C39C37C36179.4°180.0°
C50C39C37H180.6°0.0°
C39C50C51H220.5°0.0°
N45C41C40C39179.4°180.0°
N45C41C40N490.4°0.2°
C41N45C46N480.1°0.0°
N45C41N42H190.0°10.5°
N45C41N42H20120.0°169.5°
C41N45C46H21179.9°180.0°
C40C41N45C460.3°0.0°
C41C40C39N49179.8°179.9°
C41C40C39C37179.8°179.9°
C41C40N49N480.2°0.4°
C41C40N49C36179.9°179.8°
C40C41N42H19179.8°169.4°
C40C41N42H2059.8°10.7°
N7C14C19C23125.2°119.5°
N7C14C23O24172.3°167.2°
N7C14C23N258.0°13.0°
C14N7C8C1152.5°61.4°
N7C14C15H1180.0°67.3°
N7C14C15H260.0°172.7°
N7C14C15H360.0°52.7°
N7C14C19H458.9°60.3°
N7C14C19H5178.9°59.7°
N7C14C19H661.1°179.7°
C14N7C8H1467.9°178.8°
C14N7C8H15172.9°58.3°
C19C14N7C8102.6°77.1°
C19C14C23O2449.8°72.8°
C19C14C23N25130.5°107.0°
C19C14C15H159.5°53.1°
C19C14C15H2179.5°66.9°
C19C14C15H360.6°173.1°
C14C19H4H5120.0°120.0°
C14C19H4H6120.0°120.1°
C14C19H5H6120.0°120.1°
C23C14N7C818.5°42.8°
C14C23O24N25179.7°179.8°
C14C23N25C110.1°4.6°
C14C23N25C26179.7°175.4°
C23C14C15H155.3°173.3°
C23C14C15H264.7°53.3°
C23C14C15H3175.4°66.7°
C23C14C19H466.3°179.8°
C23C14C19H553.7°59.8°
C23C14C19H6173.7°60.2°
N45C46N48H21180.0°180.0°
N45C46N48N490.2°0.2°
N7C8C11N2557.9°46.6°
N7C8C11H14120.4°119.8°
N7C8C11H15120.4°119.5°
N7C8C11H762.0°166.9°
N7C8C11H8177.8°73.8°
N7C8H14H15118.8°120.4°
C39C40N49N48179.6°179.7°
C39C40N49C360.1°0.3°
C40C39C37C360.0°0.0°
C40C39C37H18180.0°179.9°
N49C40C39C370.1°0.2°
C40N49N48C460.1°0.4°
C40N49N48C36179.6°179.2°
C40N49C36C370.0°0.3°
C40N49C36C33179.8°179.8°
C39C37C36N490.0°0.2°
C39C37C36H18180.0°180.0°
C39C37C36C33179.8°180.0°
C46N48N49C36179.6°179.6°
O24C23N25C11179.7°175.7°
O24C23N25C260.0°4.3°
C23N25C11C26179.7°180.0°
C23N25C11C832.4°21.9°
C23N25C26C31114.3°98.4°
C23N25C26C2766.0°81.1°
C23N25C11H787.5°142.3°
C23N25C11H8152.3°98.4°
N48N49C36C37179.6°179.6°
N48N49C36C330.1°0.6°
N49N48C46H21179.8°179.8°
N49C36C37C33179.8°179.8°
N49C36C33C3154.2°179.7°
N49C36C33C34125.0°0.2°
N49C36C37H18180.0°179.7°
C37C36C33C31126.1°0.1°
C37C36C33C3454.7°180.0°
N25C11C8H7119.9°120.4°
N25C11C8H8119.9°120.3°
C11N25C26C3165.3°81.6°
C11N25C26C27114.4°98.9°
N25C11H7H8120.3°119.4°
N25C11C8H1462.5°166.4°
N25C11C8H15178.3°72.9°
C8C11N25C26147.9°158.1°
C8C11H7H8120.4°119.3°
C11C8H14H15118.8°120.7°
N25C26C31C27179.7°179.4°
N25C26C31C33179.6°179.8°
N25C26C27C29179.8°180.0°
C26N25C11H792.2°37.7°
C26N25C11H828.0°81.6°
N25C26C27H100.2°0.6°
N25C26C31H170.3°0.6°
C36C33C31C26179.0°180.0°
C36C33C31C34179.2°179.8°
C36C33C34C29179.0°180.0°
C36C33C34H91.1°0.4°
C36C33C31H171.0°0.4°
C33C36C37H180.2°0.1°
C26C31C33H17180.0°179.7°
C26C31C33C340.2°0.1°
C31C26C27C290.1°0.6°
C31C26C27H10179.9°180.0°
C33C31C26C270.1°0.3°
C31C33C34C290.2°0.1°
C31C33C34H9179.8°179.7°
C26C27C29H10180.0°179.4°
C26C27C29C340.1°0.6°
C26C27C29H16179.9°179.4°
C27C26C31H17179.9°180.0°
C33C34C29C270.1°0.4°
C33C34C29H9180.0°179.6°
C33C34C29H16180.0°179.7°
C34C33C31H17179.8°179.8°
C27C29C34H16180.0°179.9°
C27C29C34H9179.9°180.0°
C34C29C27H10179.9°180.0°
H1C15H2H3120.0°120.0°
H4C19H5H6120.0°119.9°
H7C11C8H14177.6°73.2°
H7C11C8H1558.4°47.4°
H8C11C8H1457.4°46.0°
H8C11C8H1561.8°166.7°
H9C34C29H160.1°0.1°
H10C27C29H160.1°0.0°
H11C3H12H13120.0°120.0°
H22C51C53H230.0°0.0°

222624

PDB entries from 2024-07-17

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