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PC5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C14C13sing1.53Å1.56Å
C14H141sing1.09Å1.11Å
C14H142sing1.09Å1.12Å
C14H143sing1.09Å1.12Å
C13C12sing1.53Å1.55Å
C13H131sing1.09Å1.11Å
C13H132sing1.09Å1.12Å
C12C11sing1.53Å1.54Å
C12H121sing1.09Å1.12Å
C12H122sing1.09Å1.12Å
C11C10sing1.51Å1.55Å
C11H111sing1.09Å1.11Å
C11H112sing1.09Å1.11Å
C10O7doub1.21Å1.25Å
C10O6sing1.34Å1.52Å
O6C9sing1.45Å1.49Å
C9C8sing1.53Å1.54Å
C9H91sing1.09Å1.12Å
C9H92sing1.09Å1.11Å
C8O5sing1.45Å1.46Å
C8C7sing1.53Å1.57Å
C8H8sing1.09Å1.11Å
O5C15sing1.34Å1.49Å
C15O8doub1.21Å1.26Å
C15C16sing1.51Å1.56Å
C16C17sing1.53Å1.54Å
C16H161sing1.09Å1.12Å
C16H162sing1.09Å1.11Å
C17C18sing1.53Å1.55Å
C17H171sing1.09Å1.12Å
C17H172sing1.09Å1.11Å
C18C19sing1.53Å1.55Å
C18H181sing1.09Å1.11Å
C18H182sing1.09Å1.12Å
C19H191sing1.09Å1.12Å
C19H192sing1.09Å1.11Å
C19H193sing1.09Å1.11Å
C7O1sing1.43Å1.47Å
C7H71sing1.09Å1.11Å
C7H72sing1.09Å1.11Å
O1P1sing1.61Å1.66Å
P1S2sing1.99Å1.81Å
P1S3doub1.99Å1.94Å
P1O4sing1.61Å1.67Å
O4C5sing1.43Å1.48Å
C5C4sing1.53Å1.57Å
C5H51sing1.09Å1.11Å
C5H52sing1.09Å1.11Å
C4N1sing1.47Å1.59Å
C4H41sing1.09Å1.11Å
C4H42sing1.09Å1.11Å
N1C1sing1.47Å1.52Å
N1C2sing1.47Å1.53Å
N1C3sing1.47Å1.53Å
C1H11sing1.09Å1.12Å
C1H12sing1.09Å1.11Å
C1H13sing1.09Å1.11Å
C2H21sing1.09Å1.12Å
C2H22sing1.09Å1.11Å
C2H23sing1.09Å1.12Å
C3H31sing1.09Å1.12Å
C3H32sing1.09Å1.11Å
C3H33sing1.09Å1.11Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C13C14H141113.7°109.5°
C13C14H142110.7°109.5°
C13C14H143110.7°109.5°
C14C13C12113.7°109.5°
C14C13H131110.7°109.5°
C14C13H132110.7°109.4°
H141C14H142110.7°109.4°
H141C14H143110.7°109.5°
H142C14H14399.6°109.5°
C12C13H131110.7°109.5°
C12C13H132110.6°109.5°
C13C12C11106.5°109.4°
C13C12H121113.3°109.5°
C13C12H122113.3°109.4°
H131C13H13299.7°109.4°
C11C12H121113.3°109.5°
C11C12H122113.3°109.5°
C12C11C10121.8°109.4°
C12C11H111107.8°109.5°
C12C11H112107.8°109.5°
H121C12H12297.1°109.5°
C10C11H111107.8°109.5°
C10C11H112107.8°109.5°
C11C10O7116.0°120.0°
C11C10O6125.0°120.0°
H111C11H112102.1°109.5°
O7C10O6119.0°120.0°
C10O6C9132.8°117.0°
O6C9C8118.0°109.4°
O6C9H91109.1°109.5°
O6C9H92109.1°109.5°
C8C9H91109.2°109.5°
C8C9H92109.2°109.5°
C9C8O5105.5°109.5°
C9C8C7122.6°109.5°
C9C8H8102.9°109.5°
H91C9H92100.9°109.5°
O5C8C7108.7°109.5°
O5C8H8118.5°109.4°
C8O5C15128.4°117.0°
C7C8H899.4°109.4°
C8C7O1123.5°109.5°
C8C7H71107.3°109.4°
C8C7H72107.2°109.5°
O5C15O8119.0°120.0°
O5C15C16117.5°120.0°
O8C15C16119.6°120.0°
C15C16C17118.0°109.5°
C15C16H161109.1°109.5°
C15C16H162109.2°109.5°
C17C16H161109.1°109.4°
C17C16H162109.1°109.5°
C16C17C18111.6°109.5°
C16C17H171111.4°109.4°
C16C17H172111.4°109.4°
H161C16H162101.0°109.5°
C18C17H171111.4°109.5°
C18C17H172111.5°109.5°
C17C18C19112.3°109.5°
C17C18H181111.2°109.5°
C17C18H182111.1°109.5°
H171C17H17299.0°109.5°
C19C18H181111.2°109.4°
C19C18H182111.2°109.5°
C18C19H191112.3°109.5°
C18C19H192111.1°109.4°
C18C19H193111.1°109.4°
H181C18H18299.1°109.5°
H191C19H192111.1°109.5°
H191C19H193111.2°109.5°
H192C19H19399.3°109.5°
O1C7H71107.2°109.5°
O1C7H72107.2°109.5°
C7O1P1128.5°123.0°
H71C7H72102.5°109.4°
O1P1S2119.9°109.5°
O1P1S3112.4°109.5°
O1P1O492.6°109.4°
S2P1S3110.2°109.5°
S2P1O4112.6°109.5°
S3P1O4107.5°109.5°
P1O4C5129.7°123.0°
O4C5C4116.4°109.5°
O4C5H51109.7°109.4°
O4C5H52109.7°109.5°
C4C5H51109.7°109.5°
C4C5H52109.7°109.5°
C5C4N1126.2°109.4°
C5C4H41106.4°109.4°
C5C4H42106.3°109.5°
H51C5H52100.5°109.5°
N1C4H41106.3°109.5°
N1C4H42106.3°109.4°
C4N1C1110.4°109.5°
C4N1C2115.3°109.5°
C4N1C3112.7°109.5°
H41C4H42103.2°109.5°
C1N1C2104.1°109.4°
C1N1C3101.0°109.5°
N1C1H11110.5°109.5°
N1C1H12111.9°109.5°
N1C1H13111.9°109.5°
C2N1C3111.9°109.5°
N1C2H21115.4°109.4°
N1C2H22110.1°109.5°
N1C2H23110.1°109.5°
N1C3H31112.6°109.5°
N1C3H32111.1°109.5°
N1C3H33111.0°109.5°
H11C1H12111.9°109.5°
H11C1H13111.8°109.5°
H12C1H1398.6°109.5°
H21C2H22110.0°109.5°
H21C2H23110.0°109.4°
H22C2H23100.2°109.5°
H31C3H32111.0°109.4°
H31C3H33111.0°109.5°
H32C3H3399.4°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C13C14H141H142125.3°120.0°
C13C14H141H143125.3°120.0°
C13C14H142H143116.5°120.0°
C14C13C12H131125.3°120.1°
C14C13C12H132125.2°119.9°
C14C13H131H132116.5°119.9°
C14C13C12C11129.4°180.0°
C14C13C12H121105.3°60.0°
C14C13C12H1224.2°60.0°
H141C14H142H143116.6°120.0°
H141C14C13C12180.0°180.0°
H141C14C13H13154.7°59.9°
H141C14C13H13254.8°60.0°
H142C14C13C1254.7°60.0°
H142C14C13H13170.6°60.0°
H142C14C13H132179.9°180.0°
H143C14C13C1254.7°60.0°
H143C14C13H131179.9°180.0°
H143C14C13H13270.5°60.0°
C12C13H131H132116.5°120.0°
C13C12C11H121125.3°120.0°
C13C12C11H122125.3°120.0°
C13C12H121H122119.2°120.0°
C13C12C11C10178.5°180.0°
C13C12C11H11156.3°60.0°
C13C12C11H11253.3°60.0°
H131C13C12C114.2°60.0°
H131C13C12H121129.5°180.0°
H131C13C12H122121.1°60.0°
H132C13C12C11105.4°60.0°
H132C13C12H12120.0°59.9°
H132C13C12H122129.4°180.0°
C11C12H121H122119.2°120.0°
C12C11C10H111125.2°120.0°
C12C11C10H112125.2°120.0°
C12C11H111H112113.4°120.0°
C12C11C10O7173.5°0.0°
C12C11C10O65.3°180.0°
H121C12C11C1053.2°60.0°
H121C12C11H111178.4°180.0°
H121C12C11H11272.0°60.0°
H122C12C11C1056.2°60.0°
H122C12C11H11169.0°60.0°
H122C12C11H112178.5°180.0°
C10C11H111H112113.4°120.0°
C11C10O7O6178.9°180.0°
C11C10O6C9170.5°180.0°
H111C11C10O748.3°120.0°
H111C11C10O6130.5°60.0°
H112C11C10O761.3°120.0°
H112C11C10O6120.0°60.0°
O7C10O6C98.2°0.0°
C10O6C9C863.8°180.0°
C10O6C9H91171.0°60.0°
C10O6C9H9261.6°60.0°
O6C9C8H91125.2°120.0°
O6C9C8H92125.3°120.0°
O6C9H91H92114.8°120.0°
O6C9C8O563.8°65.0°
O6C9C8C7171.3°175.0°
O6C9C8H861.1°55.1°
C8C9H91H92114.9°120.1°
C9C8O5C7133.2°120.0°
C9C8O5H8114.5°120.1°
C9C8C7H8112.0°120.0°
C9C8O5C1599.6°90.0°
C9C8C7O115.1°175.0°
C9C8C7H71140.4°65.0°
C9C8C7H72110.1°55.0°
H91C9C8O561.4°55.0°
H91C9C8C763.5°65.0°
H91C9C8H8173.7°175.0°
H92C9C8O5170.9°175.0°
H92C9C8C746.0°55.0°
H92C9C8H864.2°64.9°
O5C8C7H8124.5°119.9°
C8O5C15O832.6°0.0°
C8O5C15C16169.8°180.0°
O5C8C7O1138.7°65.0°
O5C8C7H7196.1°55.0°
O5C8C7H7213.4°175.0°
C7C8O5C15127.2°150.0°
C8C7O1H71125.3°120.0°
C8C7O1H72125.2°120.0°
C8C7H71H72112.7°120.0°
C8C7O1P190.2°180.0°
H8C8O5C1514.9°30.0°
H8C8C7O196.8°55.0°
H8C8C7H7128.4°175.0°
H8C8C7H72137.9°65.1°
O5C15O8C16157.0°179.9°
O5C15C16C17124.5°180.0°
O5C15C16H1610.7°60.0°
O5C15C16H162110.2°60.1°
O8C15C16C1778.1°0.0°
O8C15C16H161156.7°119.9°
O8C15C16H16247.2°120.0°
C15C16C17H161125.3°120.0°
C15C16C17H162125.3°120.0°
C15C16H161H162114.9°120.0°
C15C16C17C1868.0°180.0°
C15C16C17H171166.8°60.0°
C15C16C17H17257.3°60.0°
C17C16H161H162114.8°120.0°
C16C17C18H171125.2°119.9°
C16C17C18H172125.3°120.0°
C16C17H171H172117.3°119.9°
C16C17C18C19164.7°NaN°
C16C17C18H18139.3°60.0°
C16C17C18H18270.0°60.0°
H161C16C17C1857.3°60.0°
H161C16C17H17168.0°180.0°
H161C16C17H172177.4°60.0°
H162C16C17C18166.7°60.0°
H162C16C17H17141.5°60.0°
H162C16C17H17268.0°180.0°
C18C17H171H172117.4°120.1°
C17C18C19H181125.3°120.0°
C17C18C19H182125.3°120.0°
C17C18H181H182117.0°120.0°
C17C18C19H191180.0°180.0°
C17C18C19H19254.8°60.0°
C17C18C19H19354.8°60.0°
H171C17C18C1970.1°60.1°
H171C17C18H181164.6°180.0°
H171C17C18H18255.2°59.9°
H172C17C18C1939.4°60.0°
H172C17C18H18185.9°59.9°
H172C17C18H182164.7°180.0°
C19C18H181H182117.0°120.0°
C18C19H191H192125.2°119.9°
C18C19H191H193125.3°120.0°
C18C19H192H193117.1°119.9°
H181C18C19H19154.7°60.1°
H181C18C19H192179.9°180.0°
H181C18C19H19370.5°60.0°
H182C18C19H19154.7°60.0°
H182C18C19H19270.5°60.0°
H182C18C19H193180.0°180.0°
H191C19H192H193117.1°120.1°
O1C7H71H72112.8°120.0°
C7O1P1S221.8°75.0°
C7O1P1S3153.6°45.0°
C7O1P1O496.2°165.0°
H71C7O1P135.0°60.0°
H72C7O1P1144.6°60.0°
O1P1S2S3132.8°120.0°
O1P1S2O4107.1°120.0°
O1P1S3O4100.4°119.9°
O1P1O4C5133.4°165.0°
S2P1S3O4123.1°120.0°
S2P1O4C59.4°45.0°
S3P1O4C5112.2°75.0°
P1O4C5C4159.0°180.0°
P1O4C5H5175.8°60.0°
P1O4C5H5233.8°60.0°
O4C5C4H51125.2°120.0°
O4C5C4H52125.3°120.0°
O4C5H51H52115.5°120.0°
O4C5C4N160.7°66.5°
O4C5C4H41174.1°173.5°
O4C5C4H4264.6°53.4°
C4C5H51H52115.5°120.0°
C5C4N1H41125.3°119.9°
C5C4N1H42125.2°120.0°
C5C4H41H42111.7°120.1°
C5C4N1C1178.3°54.4°
C5C4N1C260.7°174.4°
C5C4N1C369.5°65.6°
H51C5C4N164.6°53.5°
H51C5C4H4160.7°66.5°
H51C5C4H42170.2°173.4°
H52C5C4N1174.1°173.5°
H52C5C4H4148.8°53.5°
H52C5C4H4260.7°66.5°
N1C4H41H42111.6°120.0°
C4N1C1C2124.4°120.0°
C4N1C1C3119.5°120.0°
C4N1C2C3130.6°120.0°
C4N1C1H11180.0°60.0°
C4N1C1H1254.7°180.0°
C4N1C1H1354.8°60.0°
C4N1C2H21180.0°60.0°
C4N1C2H2254.8°180.0°
C4N1C2H2354.8°60.0°
C4N1C3H31180.0°71.1°
C4N1C3H3254.8°168.9°
C4N1C3H3354.8°48.9°
H41C4N1C156.4°65.5°
H41C4N1C2174.0°54.4°
H41C4N1C355.8°174.5°
H42C4N1C153.1°174.4°
H42C4N1C264.5°65.6°
H42C4N1C3165.2°54.4°
C1N1C2C3108.3°120.0°
N1C1H11H12125.3°120.0°
N1C1H11H13125.2°120.0°
N1C1H12H13117.8°120.0°
C1N1C2H2158.8°180.0°
C1N1C2H2266.4°60.0°
C1N1C2H23175.9°60.0°
C1N1C3H3162.2°48.9°
C1N1C3H32172.6°71.1°
C1N1C3H3363.1°168.9°
C2N1C1H1155.6°60.0°
C2N1C1H12179.1°60.0°
C2N1C1H1369.6°180.0°
N1C2H21H22125.3°120.0°
N1C2H21H23125.3°120.0°
N1C2H22H23116.0°120.1°
C2N1C3H3148.1°168.9°
C2N1C3H3277.2°48.9°
C2N1C3H33173.3°71.1°
C3N1C1H1160.6°180.0°
C3N1C1H1264.7°60.0°
C3N1C1H13174.3°60.0°
C3N1C2H2149.4°60.1°
C3N1C2H22174.6°60.0°
C3N1C2H2375.8°180.0°
N1C3H31H32125.3°120.0°
N1C3H31H33125.2°120.0°
N1C3H32H33116.9°120.0°
H11C1H12H13117.7°120.0°
H21C2H22H23115.8°120.0°
H31C3H32H33116.9°119.9°

223532

PDB entries from 2024-08-07

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