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T6F

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1APAdoub1.48Å1.49Å
O2BPBdoub1.48Å1.51Å
PAO7sing1.61Å1.61Å
PAO2Asing1.61Å1.50Å
PAO3Asing1.61Å1.61Å
O7C7sing1.43Å1.42Å
PBO3Asing1.61Å1.61Å
PBO1Bsing1.61Å1.50Å
PBO3Bsing1.61Å1.51Å
C7C6sing1.53Å1.51Å
C6C5sing1.51Å1.51Å
CM4C4sing1.51Å1.52Å
C5C4doub1.34Å1.38ÅAromatic
C5S1sing1.76Å1.80ÅAromatic
C4N3sing1.32Å1.35ÅAromatic
S1C2sing1.71Å1.83ÅAromatic
N1,C6,doub1.33Å1.34ÅAromatic
N1,C2,sing1.32Å1.35ÅAromatic
C6,C5,sing1.38Å1.39ÅAromatic
N3C7,sing1.47Å1.45Å
N3C2doub1.29Å1.35ÅAromatic
CM2C2,sing1.51Å1.50Å
C2,N3,doub1.32Å1.35ÅAromatic
C5,C7,sing1.51Å1.52Å
C5,C4,doub1.40Å1.41ÅAromatic
C2CF2sing1.51Å1.52Å
N3,C4,sing1.33Å1.36ÅAromatic
C4,N4,sing1.38Å1.37Å
OF3CF3sing1.43Å1.44Å
OF5CF5sing1.43Å1.44Å
CF3CF2sing1.53Å1.55Å
CF3CF4sing1.53Å1.54Å
CF2CF1sing1.53Å1.54Å
CF2OF2sing1.43Å1.43Å
CF5CF4sing1.53Å1.54Å
CF5CF6sing1.53Å1.53Å
CF1OF1sing1.43Å1.45Å
CF4OF4sing1.43Å1.44Å
OF8PFdoub1.48Å1.52Å
OF6CF6sing1.43Å1.43Å
OF6PFsing1.61Å1.62Å
PFOF9sing1.61Å1.52Å
PFOF7sing1.61Å1.52Å
O2AHO2Asing0.97Å0.95Å
O3BHO3Bsing0.97Å0.95Å
O1BHO1Bsing0.97Å0.95Å
C7H71sing1.09Å1.10Å
C7H72sing1.09Å1.10Å
C6H61sing1.09Å1.10Å
C6H62sing1.09Å1.10Å
OF2HOF2sing0.97Å0.95Å
CF1HF11sing1.09Å1.10Å
CF1HF12sing1.09Å1.10Å
OF1HOF1sing0.97Å0.95Å
CF3HF3sing1.09Å1.10Å
OF3HOF3sing0.97Å0.95Å
CF4HF4sing1.09Å1.10Å
OF4HOF4sing0.97Å0.95Å
CF5HF5sing1.09Å1.10Å
OF5HOF5sing0.97Å0.95Å
CF6HF61sing1.09Å1.10Å
CF6HF62sing1.09Å1.10Å
OF7HOF7sing0.97Å0.95Å
OF9HOF9sing0.97Å0.95Å
CM4HM41sing1.09Å1.10Å
CM4HM42sing1.09Å1.10Å
CM4HM43sing1.09Å1.10Å
C7,H7,1sing1.09Å1.10Å
C7,H7,2sing1.09Å1.10Å
N4,H4,1sing0.97Å1.00Å
N4,H4,2sing0.97Å1.00Å
CM2HM21sing1.09Å1.10Å
CM2HM22sing1.09Å1.10Å
CM2HM23sing1.09Å1.10Å
C6,H6,sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1APAO7100.0°109.5°
O1APAO2A121.7°109.4°
O1APAO3A112.9°109.5°
O2BPBO3A110.8°109.5°
O2BPBO1B112.8°109.5°
O2BPBO3B114.7°109.5°
O7PAO2A110.8°109.4°
O7PAO3A100.2°109.5°
PAO7C7124.8°123.0°
O2APAO3A108.8°109.5°
PAO2AHO2A109.5°114.0°
PAO3APB132.8°134.0°
O7C7C6104.4°109.5°
O7C7H71111.2°109.4°
O7C7H72112.3°109.5°
O3APBO1B106.2°109.5°
O3APBO3B101.4°109.4°
O1BPBO3B110.1°109.5°
PBO1BHO1B109.5°114.0°
PBO3BHO3B109.5°114.0°
C7C6C5110.0°109.5°
C6C7H71111.2°109.5°
C6C7H72112.3°109.5°
C7C6H61109.3°109.5°
C7C6H62109.2°109.5°
C6C5C4122.8°126.0°
C6C5S1128.4°126.0°
C5C6H61109.3°109.5°
C5C6H62109.2°109.5°
CM4C4C5118.1°122.8°
CM4C4N3129.4°122.7°
C4CM4HM41109.5°109.5°
C4CM4HM42109.5°109.5°
C4CM4HM43109.5°109.5°
C4C5S1105.9°108.0°
C5C4N3111.7°114.5°
C5S1C294.9°90.3°
C4N3C7,115.6°121.4°
C4N3C2125.8°117.1°
S1C2N398.1°110.1°
S1C2CF2126.9°125.0°
C6,N1,C2,121.0°121.0°
N1,C6,C5,119.7°119.3°
N1,C6,H6,120.2°120.3°
N1,C2,CM2118.9°119.1°
N1,C2,N3,120.8°121.8°
C6,C5,C7,116.5°120.9°
C6,C5,C4,118.9°118.3°
C5,C6,H6,120.1°120.4°
C7,N3C2118.5°121.4°
N3C7,C5,113.4°109.5°
N3C7,H7,1108.2°109.5°
N3C7,H7,2107.3°109.5°
N3C2CF2132.9°124.9°
CM2C2,N3,120.2°119.0°
C2,CM2HM21109.5°109.5°
C2,CM2HM22109.5°109.4°
C2,CM2HM23109.5°109.5°
C2,N3,C4,120.6°120.7°
C7,C5,C4,124.6°120.8°
C5,C7,H7,1108.2°109.5°
C5,C7,H7,2107.3°109.5°
C5,C4,N3,118.9°118.9°
C5,C4,N4,123.5°120.5°
C2CF2CF3109.6°109.5°
C2CF2CF1108.5°109.5°
C2CF2OF2110.1°109.5°
N3,C4,N4,117.5°120.6°
C4,N4,H4,1109.5°120.0°
C4,N4,H4,2109.5°120.0°
OF3CF3CF2111.7°109.5°
OF3CF3CF4107.8°109.5°
OF3CF3HF3112.3°109.5°
CF3OF3HOF3109.5°114.0°
OF5CF5CF4112.3°109.5°
OF5CF5CF6108.0°109.4°
OF5CF5HF5109.9°109.5°
CF5OF5HOF5109.5°114.0°
CF2CF3CF4117.2°109.5°
CF3CF2CF1114.1°109.4°
CF3CF2OF2108.6°109.5°
CF2CF3HF3101.7°109.4°
CF3CF4CF5112.2°109.5°
CF3CF4OF4110.6°109.4°
CF4CF3HF3106.1°109.4°
CF3CF4HF4106.2°109.5°
CF1CF2OF2105.8°109.5°
CF2CF1OF1113.3°109.5°
CF2CF1HF11108.2°109.4°
CF2CF1HF12107.3°109.5°
CF2OF2HOF2109.5°114.0°
CF4CF5CF6113.0°109.5°
CF5CF4OF4107.5°109.5°
CF5CF4HF4109.4°109.5°
CF4CF5HF5104.5°109.5°
CF5CF6OF6108.4°109.5°
CF6CF5HF5109.1°109.5°
CF5CF6HF61109.9°109.4°
CF5CF6HF62110.1°109.5°
OF1CF1HF11108.2°109.5°
OF1CF1HF12107.4°109.5°
CF1OF1HOF1109.5°114.0°
OF4CF4HF4111.0°109.5°
CF4OF4HOF4109.5°114.0°
OF8PFOF6104.7°109.5°
OF8PFOF9112.7°109.5°
OF8PFOF7115.7°109.5°
CF6OF6PF122.1°123.0°
OF6CF6HF61109.8°109.5°
OF6CF6HF62110.1°109.5°
OF6PFOF9104.0°109.4°
OF6PFOF7104.1°109.5°
OF9PFOF7114.0°109.5°
PFOF9HOF9109.5°113.9°
PFOF7HOF7109.5°114.0°
H71C7H72105.6°109.5°
H61C6H62109.9°109.5°
HF11CF1HF12112.5°109.4°
HF61CF6HF62108.6°109.5°
HM41CM4HM42109.5°109.4°
HM41CM4HM43109.4°109.4°
HM42CM4HM43109.5°109.5°
H7,1C7,H7,2112.6°109.5°
H4,1N4,H4,2109.5°119.9°
HM21CM2HM22109.4°109.5°
HM21CM2HM23109.4°109.5°
HM22CM2HM23109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1APAO7O2A129.6°120.0°
O1APAO7O3A115.7°120.1°
O1APAO2AO3A133.9°120.0°
O1APAO7C7146.1°55.0°
O1APAO3APB33.7°45.0°
O1APAO2AHO2A4.3°180.0°
O2BPBO3APA31.0°45.0°
O2BPBO3AO1B122.8°120.0°
O2BPBO3AO3B122.2°120.0°
O2BPBO1BO3B129.5°120.1°
O2BPBO3BHO3B19.2°180.0°
O2BPBO1BHO1B147.7°60.0°
O7PAO2AO3A109.2°120.0°
O7PAO3APB139.1°165.0°
PAO7C7C6129.9°180.0°
O7PAO2AHO2A121.1°60.0°
PAO7C7H71110.1°60.0°
PAO7C7H728.0°60.0°
O2APAO7C784.4°65.0°
O2APAO3APB104.6°75.0°
O3APAO7C730.4°175.0°
PAO3APBO1B153.8°165.0°
PAO3APBO3B91.2°75.0°
O3APAO2AHO2A129.6°60.0°
O7C7C6H71120.0°120.0°
O7C7C6H72121.9°120.0°
O7C7C6C5154.8°180.0°
O7C7H71H72122.1°120.0°
O7C7C6H6134.8°60.0°
O7C7C6H6285.4°60.0°
O3APBO1BO3B108.9°120.0°
O3APBO3BHO3B100.2°60.0°
O3APBO1BHO1B90.8°180.0°
O1BPBO3BHO3B147.7°59.9°
O3BPBO1BHO1B18.2°60.1°
C7C6C5H61120.0°120.0°
C7C6C5H62119.8°120.0°
C7C6C5C4161.7°90.0°
C7C6C5S140.0°89.7°
C6C7H71H72122.0°120.0°
C7C6H61H62119.8°120.0°
C6C5C4CM424.3°0.0°
C6C5C4S1162.5°179.7°
C6C5C4N3164.7°179.8°
C6C5S1C2172.2°180.0°
C5C6C7H7185.2°60.0°
C5C6C7H7232.9°60.0°
C5C6H61H62119.8°120.0°
CM4C4C5N3171.1°179.8°
CM4C4C5S1173.3°179.7°
CM4C4N3C7,20.4°0.0°
CM4C4N3C2156.2°179.7°
C4CM4HM41HM42120.0°120.0°
C4CM4HM41HM43120.0°120.0°
C4CM4HM42HM43120.0°120.1°
C4C5S1C211.1°0.3°
C5C4N3C7,169.8°179.7°
C5C4N3C213.6°0.6°
C4C5C6H6178.3°30.0°
C4C5C6H6241.9°150.0°
C5C4CM4HM41162.8°98.2°
C5C4CM4HM4242.8°141.8°
C5C4CM4HM4377.2°21.8°
S1C5C4N32.2°0.5°
C5S1C2N315.8°0.0°
C5S1C2CF2149.6°179.9°
S1C5C6H6180.0°150.4°
S1C5C6H62159.8°30.4°
C4N3C2S120.2°0.3°
C4N3C7,C2176.8°179.7°
C4N3C7,C5,79.3°59.0°
C4N3C2CF2143.8°179.6°
N3C4CM4HM4128.0°81.6°
N3C4CM4HM42148.0°38.4°
N3C4CM4HM4392.0°158.5°
C4N3C7,H7,140.7°61.1°
C4N3C7,H7,2162.4°178.9°
S1C2N3C7,163.3°180.0°
S1C2N3CF2164.0°179.9°
S1C2CF2CF381.7°6.3°
S1C2CF2CF143.5°113.7°
S1C2CF2OF2158.9°126.3°
N1,C6,C5,H6,180.0°179.6°
C6,N1,C2,CM2180.0°179.8°
C6,N1,C2,N3,0.8°0.2°
N1,C6,C5,C7,178.6°179.8°
N1,C6,C5,C4,0.6°0.4°
C2,N1,C6,C5,1.4°0.4°
N1,C2,CM2N3,179.2°180.0°
N1,C2,N3,C4,0.7°0.0°
N1,C2,CM2HM21124.5°89.9°
N1,C2,CM2HM22115.5°30.1°
N1,C2,CM2HM234.5°150.0°
C2,N1,C6,H6,178.6°180.0°
C6,C5,C7,N3115.7°70.9°
C6,C5,C7,C4,179.2°179.8°
C6,C5,C4,N3,0.9°0.2°
C6,C5,C4,N4,179.6°179.8°
C6,C5,C7,H7,14.3°169.1°
C6,C5,C7,H7,2126.0°49.1°
N3C7,C5,H7,1120.0°120.0°
N3C7,C5,H7,2118.3°120.0°
N3C7,C5,C4,65.2°109.3°
C7,N3C2CF232.7°0.1°
N3C7,H7,1H7,2118.4°120.0°
C2N3C7,C5,103.8°120.7°
N3C2CF2CF378.4°173.8°
N3C2CF2CF1156.4°66.2°
N3C2CF2OF241.0°53.8°
C2N3C7,H7,1136.2°119.2°
C2N3C7,H7,214.4°0.8°
CM2C2,N3,C4,178.5°180.0°
C2,CM2HM21HM22120.0°120.0°
C2,CM2HM21HM23120.0°120.1°
C2,CM2HM22HM23120.0°120.0°
C2,N3,C4,C5,1.5°0.0°
C2,N3,C4,N4,178.9°180.0°
N3,C2,CM2HM2154.8°90.0°
N3,C2,CM2HM2265.2°150.0°
N3,C2,CM2HM23174.8°30.0°
C7,C5,C4,N3,180.0°180.0°
C7,C5,C4,N4,0.4°0.0°
C5,C7,H7,1H7,2118.4°120.0°
C7,C5,C6,H6,1.4°0.2°
C5,C4,N3,N4,179.6°180.0°
C4,C5,C7,H7,1174.8°10.7°
C4,C5,C7,H7,253.1°130.7°
C5,C4,N4,H4,162.8°9.7°
C5,C4,N4,H4,2177.1°170.4°
C4,C5,C6,H6,179.4°179.9°
C2CF2CF3OF375.8°65.2°
C2CF2CF3CF1121.9°120.0°
C2CF2CF3OF2120.3°120.0°
C2CF2CF3CF4159.2°174.8°
C2CF2CF1OF2118.1°120.0°
C2CF2CF1OF173.4°57.5°
C2CF2OF2HOF2161.5°60.0°
C2CF2CF1HF11166.6°62.5°
C2CF2CF1HF1244.9°177.6°
C2CF2CF3HF344.1°54.8°
N3,C4,N4,H4,1116.8°170.3°
N3,C4,N4,H4,23.3°9.6°
C4,N4,H4,1H4,2120.0°179.9°
OF3CF3CF2CF4125.0°120.0°
OF3CF3CF2HF3119.9°120.0°
OF3CF3CF4HF3120.4°120.0°
OF3CF3CF2CF146.1°54.8°
OF3CF3CF2OF2163.9°174.8°
OF3CF3CF4CF563.0°65.2°
OF3CF3CF4OF457.1°54.8°
OF3CF3CF4HF4177.6°174.7°
OF5CF5CF4CF354.4°60.0°
OF5CF5CF4CF6122.5°120.0°
OF5CF5CF4HF5119.0°120.0°
OF5CF5CF6HF5119.4°119.9°
OF5CF5CF4OF4176.2°NaN°
OF5CF5CF6OF655.1°65.0°
OF5CF5CF4HF463.2°60.0°
OF5CF5CF6HF61175.1°175.0°
OF5CF5CF6HF6265.3°55.1°
CF2CF3CF4HF3112.6°120.0°
CF3CF2CF1OF2119.4°120.0°
CF2CF3CF4CF5170.1°174.7°
CF3CF2CF1OF1164.0°62.5°
CF2CF3CF4OF469.9°65.3°
CF3CF2OF2HOF278.5°60.0°
CF3CF2CF1HF1144.0°177.5°
CF3CF2CF1HF1277.6°57.6°
CF2CF3OF3HOF386.4°68.9°
CF2CF3CF4HF450.6°54.7°
CF4CF3CF2CF178.9°65.2°
CF4CF3CF2OF238.9°54.8°
CF3CF4CF5OF4121.8°120.0°
CF3CF4CF5HF4117.6°120.0°
CF3CF4CF5CF6176.9°180.0°
CF3CF4OF4HF4117.6°119.9°
CF4CF3OF3HOF3143.6°51.2°
CF3CF4OF4HOF459.2°60.0°
CF3CF4CF5HF564.6°60.0°
CF2CF1OF1HF11120.0°120.0°
CF2CF1OF1HF12118.3°120.1°
CF1CF2OF2HOF244.5°180.0°
CF2CF1HF11HF12118.4°120.0°
CF2CF1OF1HOF181.3°180.0°
CF1CF2CF3HF3166.0°174.8°
OF2CF2CF1OF144.7°177.5°
OF2CF2CF1HF1175.3°57.6°
OF2CF2CF1HF12163.0°62.4°
OF2CF2CF3HF376.2°65.2°
CF4CF5CF6HF5115.8°120.0°
CF5CF4OF4HF4119.6°120.0°
CF4CF5CF6OF6179.9°175.0°
CF5CF4CF3HF357.5°54.8°
CF5CF4OF4HOF463.6°60.0°
CF4CF5OF5HOF562.5°60.0°
CF4CF5CF6HF6160.1°55.0°
CF4CF5CF6HF6259.5°65.0°
CF6CF5CF4OF461.3°60.0°
CF5CF6OF6HF61120.0°120.0°
CF5CF6OF6HF62120.4°120.0°
CF5CF6OF6PF165.7°180.0°
CF6CF5CF4HF459.4°60.0°
CF6CF5OF5HOF562.8°60.0°
CF5CF6HF61HF62120.5°120.0°
OF1CF1HF11HF12118.4°120.0°
OF4CF4CF3HF3177.5°174.8°
OF4CF4CF5HF557.2°60.0°
OF8PFOF6CF6134.9°55.0°
OF8PFOF6OF9118.5°120.0°
OF8PFOF6OF7121.9°120.0°
OF8PFOF9OF7134.5°120.0°
OF8PFOF7HOF7137.0°180.0°
OF8PFOF9HOF956.5°60.0°
CF6OF6PFOF9106.7°175.0°
CF6OF6PFOF713.0°65.0°
OF6CF6CF5HF564.3°55.0°
OF6CF6HF61HF62120.4°120.0°
OF6PFOF9OF7112.7°120.0°
PFOF6CF6HF6174.3°60.0°
PFOF6CF6HF6245.3°60.0°
OF6PFOF7HOF7108.7°60.0°
OF6PFOF9HOF956.3°180.0°
OF9PFOF7HOF73.9°60.0°
OF7PFOF9HOF9169.0°60.0°
H71C7C6H61154.8°180.0°
H71C7C6H6234.6°60.0°
H72C7C6H6187.1°60.0°
H72C7C6H62152.7°180.0°
HF11CF1OF1HOF1158.7°60.0°
HF12CF1OF1HOF137.1°60.0°
HF3CF3OF3HOF327.1°171.1°
HF3CF3CF4HF462.0°65.3°
HF4CF4OF4HOF4176.8°180.0°
HF4CF4CF5HF5177.8°180.0°
HF5CF5OF5HOF5178.3°180.0°
HF5CF5CF6HF6155.7°65.0°
HF5CF5CF6HF62175.3°175.0°
HM41CM4HM42HM43120.0°119.9°
HM21CM2HM22HM23120.0°120.0°

225158

PDB entries from 2024-09-18

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