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BI7

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O13C6doub1.21Å1.23Å
C6N12sing1.34Å1.37Å
C6C2sing1.51Å1.51Å
N12C19sing1.46Å1.48Å
N12C11sing1.34Å1.38Å
C19C21sing1.53Å1.52Å
C21C23sing1.53Å1.52Å
C23N29sing1.47Å1.48Å
N29C30sing1.47Å1.47Å
N29C31sing1.47Å1.46Å
N29C32sing1.47Å1.48Å
C2C1sing1.54Å1.53Å
C2C5sing1.55Å1.52Å
C1N3sing1.48Å1.47Å
C1C4sing1.51Å1.49Å
N3C8sing1.48Å1.47Å
N3C7sing1.49Å1.48Å
C8C15sing1.54Å1.53Å
C15C14sing1.55Å1.53Å
C14C7sing1.55Å1.53Å
C7C5sing1.54Å1.52Å
C5C11sing1.51Å1.50Å
C11O18doub1.21Å1.23Å
C4C16sing1.41Å1.41ÅAromatic
C4N9doub1.30Å1.35ÅAromatic
C16C17doub1.37Å1.40ÅAromatic
N9O10sing1.21Å1.42ÅAromatic
O10C17sing1.35Å1.35ÅAromatic
C17C20sing1.47Å1.39Å
C20C22doub1.36Å1.39ÅAromatic
C20S1sing1.76Å1.74ÅAromatic
C22C24sing1.38Å1.40ÅAromatic
C24C25doub1.34Å1.39ÅAromatic
S1C25sing1.76Å1.72ÅAromatic
C25CL1sing1.74Å1.81Å
C2H2sing1.09Å1.10Å
C19H191sing1.09Å1.10Å
C19H192sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C23H231sing1.09Å1.10Å
C23H232sing1.09Å1.10Å
C30H301sing1.09Å1.10Å
C30H302sing1.09Å1.10Å
C30H303sing1.09Å1.10Å
C31H311sing1.09Å1.10Å
C31H312sing1.09Å1.10Å
C31H313sing1.09Å1.10Å
C32H321sing1.09Å1.10Å
C32H322sing1.09Å1.10Å
C32H323sing1.09Å1.10Å
C1H1sing1.09Å1.10Å
C5H5sing1.09Å1.10Å
C8H81Csing1.09Å1.10Å
C8H82Csing1.09Å1.10Å
C7H7sing1.09Å1.10Å
C15H151sing1.09Å1.10Å
C15H152sing1.09Å1.10Å
C14H141sing1.09Å1.10Å
C14H142sing1.09Å1.10Å
C16H16sing1.08Å1.08Å
C22H22sing1.08Å1.08Å
C24H24sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O13C6N12121.6°125.4°
O13C6C2126.0°125.3°
N12C6C2112.3°109.4°
C6N12C19117.0°122.8°
C6N12C11105.2°114.5°
C6C2C1117.8°109.5°
C6C2C5102.9°103.4°
C6C2H2110.4°112.6°
C19N12C11116.9°122.7°
N12C19C21101.3°109.5°
N12C19H191111.5°109.4°
N12C19H192111.5°109.4°
N12C11C5113.6°109.4°
N12C11O18121.8°125.3°
C19C21C23114.9°109.5°
C21C19H191111.5°109.5°
C21C19H192111.5°109.5°
C19C21H211108.1°109.5°
C19C21H212108.1°109.4°
C21C23N29114.3°109.5°
C23C21H211108.1°109.5°
C23C21H212108.1°109.5°
C21C23H231108.2°109.5°
C21C23H232108.3°109.4°
C23N29C30112.8°109.5°
C23N29C31106.7°109.5°
C23N29C32112.1°109.5°
N29C23H231108.2°109.4°
N29C23H232108.3°109.5°
C30N29C31106.7°109.5°
C30N29C32109.9°109.4°
N29C30H301109.5°109.4°
N29C30H302109.5°109.5°
N29C30H303109.5°109.5°
C31N29C32108.3°109.5°
N29C31H311109.5°109.4°
N29C31H312109.5°109.5°
N29C31H313109.5°109.4°
N29C32H321109.5°109.5°
N29C32H322109.5°109.5°
N29C32H323109.5°109.4°
C1C2C5104.8°105.0°
C2C1N3106.3°105.4°
C2C1C4112.6°110.2°
C1C2H2110.1°112.5°
C2C1H1104.6°110.2°
C2C5C7105.7°105.2°
C2C5C11102.5°103.3°
C5C2H2110.3°113.2°
C2C5H5111.5°112.7°
N3C1C4121.6°110.3°
C1N3C8111.4°109.5°
C1N3C7104.5°104.7°
N3C1H1105.2°110.3°
C1C4C16122.3°126.7°
C1C4N9124.4°126.7°
C4C1H1105.0°110.3°
C8N3C7107.5°105.9°
N3C8C15107.3°107.4°
N3C8H81C110.0°109.9°
N3C8H82C110.0°109.9°
N3C7C14107.0°103.5°
N3C7C5108.2°105.3°
N3C7H7110.4°112.7°
C8C15C14106.6°105.2°
C15C8H81C110.0°109.8°
C15C8H82C110.0°109.9°
C8C15H151110.2°110.3°
C8C15H152110.2°110.3°
C15C14C7105.9°103.2°
C14C15H151110.2°110.3°
C14C15H152110.2°110.3°
C15C14H141110.4°110.6°
C15C14H142110.3°110.7°
C14C7C5111.6°109.1°
C14C7H7109.7°112.6°
C7C14H141110.4°110.6°
C7C14H142110.4°110.7°
C7C5C11113.4°109.1°
C7C5H5111.5°112.5°
C5C7H7109.9°113.0°
C5C11O18124.6°125.3°
C11C5H5111.7°113.2°
C16C4N9113.3°106.7°
C4C16C17102.4°103.9°
C4C16H16128.8°128.1°
C4N9O10104.3°112.0°
C16C17O10110.9°106.0°
C16C17C20127.1°127.0°
C17C16H16128.8°128.0°
N9O10C17108.8°111.4°
O10C17C20121.1°127.0°
C17C20C22128.1°125.3°
C17C20S1114.5°125.3°
C22C20S1117.4°109.4°
C20C22C24110.3°114.4°
C20C22H22124.9°122.8°
C20S1C2584.5°91.1°
C22C24C25108.8°115.2°
C24C22H22124.8°122.8°
C22C24H24125.6°122.4°
C24C25S1119.0°110.0°
C24C25CL1123.9°125.0°
C25C24H24125.6°122.4°
S1C25CL1117.1°125.0°
H191C19H192109.4°109.4°
H211C21H212109.5°109.4°
H231C23H232109.5°109.5°
H301C30H302109.5°109.5°
H301C30H303109.4°109.5°
H302C30H303109.5°109.5°
H311C31H312109.5°109.4°
H311C31H313109.5°109.6°
H312C31H313109.4°109.5°
H321C32H322109.5°109.5°
H321C32H323109.5°109.5°
H322C32H323109.5°109.5°
H81CC8H82C109.5°110.0°
H151C15H152109.5°110.4°
H141C14H142109.5°110.8°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O13C6N12C2176.8°179.8°
O13C6N12C1932.1°0.2°
O13C6N12C11163.8°179.8°
O13C6C2C152.5°67.8°
O13C6C2C5167.1°179.3°
O13C6C2H275.2°58.2°
C6N12C19C11126.1°180.0°
C6N12C19C21111.6°89.9°
N12C6C2C1130.9°111.9°
N12C6C2C516.2°0.5°
C6N12C11C515.1°0.4°
C6N12C11O18167.0°179.7°
N12C6C2H2101.5°122.1°
C6N12C19H1917.0°150.0°
C6N12C19H192129.7°30.1°
C2C6N12C19151.1°180.0°
C2C6N12C1119.4°0.0°
C6C2C1C5113.6°110.5°
C6C2C1H2127.8°126.0°
C6C2C5H2117.8°122.1°
C6C2C1N386.2°87.1°
C6C2C1C449.4°31.9°
C6C2C5C7112.9°113.8°
C6C2C5C116.2°0.7°
C6C2C1H1162.9°153.8°
C6C2C5H5125.8°123.3°
N12C19C21H191118.7°120.0°
N12C19C21H192118.7°120.0°
N12C19C21C23179.8°180.0°
C19N12C11C5146.8°179.5°
C19N12C11O1835.3°0.3°
N12C19H191H192123.8°119.9°
N12C19C21H21159.4°59.9°
N12C19C21H21259.0°60.0°
C11N12C19C21122.3°90.0°
N12C11C5C25.0°0.7°
N12C11C5C7118.6°110.9°
N12C11C5O18177.9°179.8°
C11N12C19H191119.0°30.0°
C11N12C19H1923.6°150.0°
N12C11C5H5114.4°122.9°
C19C21C23H211120.8°120.1°
C19C21C23H212120.8°120.0°
C19C21C23N29177.5°180.0°
C21C19H191H192123.8°120.0°
C19C21H211H212117.6°119.9°
C19C21C23H23161.8°60.0°
C19C21C23H23256.8°60.0°
C21C23N29H231120.7°120.0°
C21C23N29H232120.7°120.0°
C21C23N29C3059.2°60.0°
C21C23N29C31176.1°180.0°
C21C23N29C3265.5°60.0°
C23C21C19H19161.1°60.0°
C23C21C19H19261.5°60.0°
C23C21H211H212117.5°120.0°
C21C23H231H232117.8°120.0°
C23N29C30C31116.8°120.1°
C23N29C30C32125.9°120.0°
C23N29C31C32120.8°120.0°
N29C23C21H21156.7°60.0°
N29C23C21H21261.7°60.0°
N29C23H231H232117.8°120.0°
C23N29C30H301180.0°60.0°
C23N29C30H30260.0°180.0°
C23N29C30H30360.0°60.0°
C23N29C31H311180.0°60.0°
C23N29C31H31260.0°180.0°
C23N29C31H31360.0°60.0°
C23N29C32H321180.0°60.0°
C23N29C32H32260.0°180.0°
C23N29C32H32360.0°60.1°
C30N29C31C32118.3°119.9°
C30N29C23H23161.5°60.0°
C30N29C23H232180.0°180.0°
N29C30H301H302120.0°120.0°
N29C30H301H303120.0°119.9°
N29C30H302H303120.0°120.0°
C30N29C31H31159.2°179.9°
C30N29C31H31260.9°60.0°
C30N29C31H313179.2°60.0°
C30N29C32H32153.7°60.0°
C30N29C32H322173.7°60.0°
C30N29C32H32366.3°179.9°
C31N29C23H23155.4°60.0°
C31N29C23H23263.2°60.0°
C31N29C30H30163.2°60.1°
C31N29C30H302176.8°60.0°
C31N29C30H30356.8°180.0°
N29C31H311H312120.0°119.9°
N29C31H311H313120.0°120.0°
N29C31H312H313120.0°120.0°
C31N29C32H32162.6°180.0°
C31N29C32H32257.4°60.0°
C31N29C32H323177.4°60.0°
C32N29C23H231173.8°180.0°
C32N29C23H23255.2°60.0°
C32N29C30H30154.1°179.9°
C32N29C30H30265.9°60.0°
C32N29C30H303174.0°60.0°
C32N29C31H31159.2°60.0°
C32N29C31H312179.2°60.0°
C32N29C31H31360.8°180.0°
N29C32H321H322120.0°120.0°
N29C32H321H323120.0°120.0°
N29C32H322H323120.0°119.9°
C1C2C5H2118.5°123.1°
C2C1N3C4130.6°118.9°
C2C1N3H1110.6°119.0°
C2C1C4H1113.2°121.9°
C2C1N3C8148.9°150.5°
C2C1N3C733.1°37.4°
C1C2C5C710.8°1.0°
C1C2C5C11129.9°115.4°
C2C1C4C16106.4°125.0°
C2C1C4N971.5°55.4°
C1C2C5H5110.4°122.0°
C5C2C1N327.4°23.3°
C5C2C1C4163.0°142.3°
C2C5C7N39.2°21.5°
C2C5C7C14108.2°89.1°
C2C5C7C11111.6°110.3°
C2C5C7H5121.3°123.1°
C2C5C11H5119.5°122.3°
C2C5C11O18177.1°179.5°
C5C2C1H183.5°95.7°
C2C5C7H7129.8°144.9°
N3C1C4H1118.9°122.1°
C1N3C8C7113.9°112.3°
C1N3C8C1591.2°88.3°
C1N3C7C1494.1°77.8°
C1N3C7C526.4°36.7°
N3C1C4C1621.5°119.1°
N3C1C4N9160.6°60.6°
N3C1C2H2146.0°146.9°
C1N3C8H81C149.1°152.3°
C1N3C8H82C28.4°31.1°
C1N3C7H7146.7°160.3°
C4C1N3C880.5°90.6°
C4C1N3C7163.8°156.3°
C1C4C16N9178.1°179.7°
C1C4C16C17178.9°180.0°
C1C4N9O10178.7°179.9°
C4C1C2H278.4°94.1°
C1C4C16H161.1°0.0°
N3C8C15H81C119.6°119.4°
N3C8C15H82C119.6°119.5°
N3C8C15C1412.1°0.6°
C8N3C7C1424.4°37.8°
C8N3C7C5144.8°152.3°
C8N3C1H138.3°31.5°
N3C8H81CH82C121.0°121.1°
C8N3C7H794.9°84.1°
N3C8C15H151131.6°119.6°
N3C8C15H152107.5°118.2°
C7N3C8C1522.7°24.0°
N3C7C14C1516.4°36.5°
N3C7C14C5118.2°111.7°
N3C7C14H7119.7°122.0°
N3C7C5H7120.6°123.4°
N3C7C5C11102.4°88.9°
C7N3C1H177.4°81.6°
N3C7C5H5130.5°144.6°
C7N3C8H81C97.0°95.4°
C7N3C8H82C142.3°143.5°
N3C7C14H141135.9°154.9°
N3C7C14H142103.0°82.0°
C8C15C14H151119.6°119.0°
C8C15C14H152119.6°118.9°
C8C15C14C72.7°21.8°
C15C8H81CH82C121.0°121.0°
C8C15H151H152121.3°122.1°
C8C15C14H141122.1°140.2°
C8C15C14H142116.8°96.6°
C15C14C7H141119.5°118.4°
C15C14C7H142119.4°118.5°
C15C14C7C5134.6°148.2°
C14C15C8H81C107.6°118.8°
C14C15C8H82C131.7°120.1°
C15C14C7H7103.3°85.5°
C14C15H151H152121.3°122.1°
C15C14H141H142121.6°123.1°
C14C7C5H7122.0°126.0°
C14C7C5C11140.2°160.5°
C14C7C5H513.1°34.0°
C7C14C15H151116.9°97.1°
C7C14C15H152122.3°140.7°
C7C14H141H142121.7°123.1°
C7C5C11H5127.0°126.1°
C7C5C11O1863.6°68.9°
C7C5C2H2129.3°124.2°
C5C7C14H141105.9°93.4°
C5C7C14H14215.2°29.8°
C11C5C2H2111.6°121.4°
C11C5C7H718.2°34.5°
O18C11C5H563.4°57.2°
C4C16C17H16180.0°180.0°
C16C4N9O100.6°0.2°
C4C16C17O104.4°0.2°
C4C16C17C20174.1°180.0°
C16C4C1H1140.4°3.0°
N9C4C16C173.0°0.3°
C4N9O10C172.3°0.1°
N9C4C1H141.7°177.3°
N9C4C16H16177.0°179.7°
C16C17O10N94.3°0.1°
C16C17O10C20170.4°179.8°
C16C17C20C2230.9°180.0°
C16C17C20S1145.7°0.3°
N9O10C17C20174.7°179.9°
O10C17C20C22160.4°0.2°
O10C17C20S123.0°180.0°
O10C17C16H16175.6°179.7°
C17C20C22S1176.5°179.8°
C17C20C22C24176.2°180.0°
C17C20S1C25175.9°179.9°
C20C17C16H165.9°0.0°
C17C20C22H223.8°0.0°
C20C22C24H22180.0°179.9°
C20C22C24C250.8°0.1°
C22C20S1C251.1°0.3°
C20C22C24H24179.2°180.0°
S1C20C22C240.3°0.2°
C20S1C25C241.6°0.3°
C20S1C25CL1179.6°179.9°
S1C20C22H22179.7°179.7°
C22C24C25H24180.0°179.9°
C22C24C25S11.8°0.3°
C22C24C25CL1179.5°180.0°
C24C25S1CL1178.8°179.7°
C25C24C22H22179.2°180.0°
S1C25C24H24178.2°179.8°
CL1C25C24H240.5°0.1°
H2C2C1H135.0°27.8°
H2C2C5H58.0°1.2°
H191C19C21H211178.1°180.0°
H191C19C21H21259.6°60.0°
H192C19C21H21159.3°60.0°
H192C19C21H212177.7°180.0°
H211C21C23H231177.4°179.9°
H211C21C23H23264.1°60.1°
H212C21C23H23159.0°60.0°
H212C21C23H232177.5°180.0°
H301C30H302H303120.0°120.0°
H311C31H312H313120.0°120.1°
H321C32H322H323120.0°120.1°
H5C5C7H7108.9°92.0°
H81CC8C15H15112.0°0.2°
H81CC8C15H152132.8°122.3°
H82CC8C15H151108.7°120.9°
H82CC8C15H15212.1°1.2°
H7C7C14H14116.2°32.8°
H7C7C14H142137.3°156.0°
H151C15C14H1412.6°21.2°
H151C15C14H142123.7°144.4°
H152C15C14H141118.3°100.9°
H152C15C14H1422.8°22.2°
H22C22C24H240.8°0.1°

223532

PDB entries from 2024-08-07

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