Crystallography Open Database

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4001130 CIFC32 H28 Co3 N24 O6 W2P 1 21/n 17.179; 14.634; 22.134
90; 91.121; 90
2324.9Ohkoshi, Shin-ichi; Hamada, Yoshiho; Matsuda, Tomoyuki; Tsunobuchi, Yoshihide; Tokoro, Hiroko
Crystal Structure, Charge-Transfer-Induced Spin Transition, and Photoreversible Magnetism in a Cyano-Bridged Cobalt−Tungstate Bimetallic Assembly
Chemistry of Materials, 2008, 20, 3048
4001131 CIFC32 H14 F12 N2 O4P -14.7402; 11.6558; 12.7944
72.455; 85.757; 84.292
669.95See, Kevin C.; Landis, Chad; Sarjeant, Amy; Katz, Howard E.
Easily Synthesized Naphthalene Tetracarboxylic Diimide Semiconductors with High Electron Mobility in Air
Chemistry of Materials, 2008, 20, 3609
4001132 CIFC6 H2 Fe Mn N6 O RbF -4 3 m10.521; 10.521; 10.521
90; 90; 90
1164.6Vertelman, Esther J. M.; Lummen, Tom T. A.; Meetsma, Auke; Bouwkamp, Marco W.; Molnar, Gabor; van Loosdrecht, Paul H. M.; van Koningsbruggen, Petra J.
Light- and Temperature-Induced Electron Transfer in Single Crystals of RbMn[Fe(CN)6]·H2O
Chemistry of Materials, 2008, 20, 1236
4001133 CIFGe0.98 Sn1.02 TmC m c m4.2022; 15.935; 4.0247
90; 90; 90
269.5Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001134 CIFGe2 TmC m c m3.997; 15.719; 3.8604
90; 90; 90
242.54Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001135 CIFGd Ge0.83 Sn1.17C m c m4.3005; 16.441; 4.0944
90; 90; 90
289.49Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001136 CIFGe0.89 Sn1.11 TbC m c m4.266; 16.293; 4.062
90; 90; 90
282.3Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001137 CIFDy Ge0.91 Sn1.09C m c m4.251; 16.197; 4.0584
90; 90; 90
279.4Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001138 CIFGe0.9 Ho Sn1.1C m c m4.2473; 16.127; 4.0693
90; 90; 90
278.7Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001139 CIFEr Ge0.92 Sn1.08C m c m4.209; 16.006; 4.029
90; 90; 90
271.4Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001140 CIFGe0.86 Sn1.14 YC m c m4.2511; 16.296; 4.0633
90; 90; 90
281.49Tobash, Paul H.; Meyers, John J.; DiFilippo, Gary; Bobev, Svilen; Ronning, Filip; Thompson, Joe D.; Sarrao, John L.
Structure and Properties of a New Family of Nearly Equiatomic Rare-Earth Metal-Tin-Germanides RESn1+xGe1−x(RE = Y, Gd−Tm): an Unusual Example of Site Preferences Between Elements from the Same Group
Chemistry of Materials, 2008, 20, 2151
4001141 CIFGe Sb4 Te7P -3 m 14.236; 4.236; 23.7609
90; 90; 120
369.24Matsunaga, Toshiyuki; Kojima, Rie; Yamada, Noboru; Kifune, Kouichi; Kubota, Yoshiki; Takata, Masaki
Structural Features of Ge1Sb4Te7, an Intermetallic Compound in the GeTe-Sb2Te3Homologous Series
Chemistry of Materials, 2008, 20, 5750
4001142 CIFC22 H22 S4P 1 21/n 13.948; 11.007; 27.36
90; 90.278; 90
1188.9Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun
Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes
Chemistry of Materials, 2008, 20, 4883
4001143 CIFC32 H18 S4P 1 2/n 114.192; 6.135; 15.912
90; 116.158; 90
1244Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun
Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes
Chemistry of Materials, 2008, 20, 4883
4001144 CIFC24 H14 S2P 1 21/n 111.971; 3.944; 35.7
90; 90.454; 90
1685.5Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun
Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes
Chemistry of Materials, 2008, 20, 4883
4001145 CIFC24 H14 S2P b c a7.88; 11.44; 18.11
90; 90; 90
1633Ashizawa, Minoru; Yamada, Koichi; Fukaya, Atsuko; Kato, Reizo; Hara, Kouji; Takeya, Jun
Effect of Molecular Packing on Field-Effect Performance of Single Crystals of Thienyl-Substituted Pyrenes
Chemistry of Materials, 2008, 20, 4883
4001146 CIFC19 H19 Cu Dy F12 N4 O9P -110.5791; 11.0987; 14.1662
71.53; 75.669; 84.702
1528.4Okazawa, Atsushi; Nogami, Takashi; Nojiri, Hiroyuki; Ishida, Takayuki
Exchange Coupling and Energy-Level Crossing in a Magnetic Chain [Dy2Cu2]nEvaluated by High-Frequency Electron Paramagnetic Resonance
Chemistry of Materials, 2008, 20, 3110
4001147 CIFC90 H146 Cl2 Fe4 O20C 1 2/c 119.371; 22.47; 24.009
90; 107.886; 90
9945Condorelli, Guglielmo G.; Motta, Alessandro; Pellegrino, Giovanna; Cornia, Andrea; Gorini, Lapo; Fragalà, Ignazio L.; Sangregorio, Claudio; Sorace, Lorenzo
Site-Specific Anchoring of Tetrairon(III) Single Molecule Magnets on Functionalized Si(100) Surfaces
Chemistry of Materials, 2008, 20, 2405
4001148 CIFMn0.78 Sb11 Yb14 Zn0.22I 41/a c d :216.5899; 16.5899; 21.909
90; 90; 90
6029.9Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey
Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering
Chemistry of Materials, 2008, 20, 3412
4001149 CIFMn0.77 Sb11 Yb14 Zn0.23I 41/a c d :216.5883; 16.5883; 21.9115
90; 90; 90
6029.4Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey
Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering
Chemistry of Materials, 2008, 20, 3412
4001150 CIFMn0.67 Sb11 Yb14 Zn0.33I 41/a c d :216.5776; 16.5776; 21.8888
90; 90; 90
6015.4Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey
Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering
Chemistry of Materials, 2008, 20, 3412
4001151 CIFMn0.32 Sb11 Yb14 Zn0.68I 41/a c d :216.5893; 16.5893; 21.8917
90; 90; 90
6024.7Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey
Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering
Chemistry of Materials, 2008, 20, 3412
4001152 CIFMn0.19 Sb11 Yb14 Zn0.81I 41/a c d :216.581; 16.581; 21.8748
90; 90; 90
6014Brown, Shawna R.; Toberer, Eric S.; Ikeda, Teruyuki; Cox, Catherine A.; Gascoin, Franck; Kauzlarich, Susan M.; Snyder, G. Jeffrey
Improved Thermoelectric Performance in Yb14Mn1−xZnxSb11by the Reduction of Spin-Disorder Scattering
Chemistry of Materials, 2008, 20, 3412
4001153 CIFCe0.445 O3 Sr0.352 TiR -3 c :H5.486; 5.486; 13.4539
90; 90; 120
350.663Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas
Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series
Chemistry of Materials, 2008, 20, 3127
4001154 CIFCe0.269 O3 Sr0.601 TiR -3 c :H5.5005; 5.5005; 13.4797
90; 90; 120
353.196Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas
Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series
Chemistry of Materials, 2008, 20, 3127
4001155 CIFCe0.167 O3 Sr0.744 TiR -3 c :H5.5062; 5.5062; 13.4989
90; 90; 120
354.432Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas
Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series
Chemistry of Materials, 2008, 20, 3127
4001156 CIFCe0.133 O3 Sr0.795 TiR -3 c :H5.5091; 5.5091; 13.5071
90; 90; 120
355.021Ubic, Rick; Subodh, Ganesanpotti; Sebastian, Mailadil T.; Gout, Delphine; Proffen, Thomas
Structure of Compounds in the Sr1‒3x/2CexTiO3Homologous Series
Chemistry of Materials, 2008, 20, 3127
4001157 CIFC H5 O7 P PrP -16.6764; 7.0684; 7.8103
111.141; 95.415; 90.457
341.89Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001158 CIFC H5 Nd O7 PP -16.6544; 7.038; 7.7938
111.16; 95.307; 90.59
338.57Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001159 CIFC H5 Eu O7 PP -16.5619; 6.9442; 7.7412
111.369; 95.495; 90.824
326.52Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001160 CIFC H5 Gd O7 PP -16.5434; 6.9311; 7.7465
111.487; 95.645; 90.833
324.839Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001161 CIFC H5 Ho O7 PP -16.4628; 6.8519; 7.6936
111.646; 95.779; 91.028
314.497Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001162 CIFC H5 Er O7 PP -16.44; 6.8326; 7.6747
111.654; 95.757; 91.096
311.71Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001163 CIFC H5 O7 P YbP -16.4075; 6.805; 7.6647
111.753; 95.858; 91.204
308.16Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Chemistry of Materials, 2008, 20, 2857
4001164 CIFB1.5 H3.42 Na O7.96 P V0.5I -4 3 m20.1007; 20.1007; 20.1007
90; 90; 90
8121.4Yang, Weiting; Li, Jiyang; Pan, Qinhe; Jin, Zhao; Yu, Jihong; Xu, Ruren
Na2[VB3P2O12(OH)]·2.92H2O: A New Open-Framework Vanadium Borophosphate Containing Extra-Large 16-Ring Pore Openings and 128166Super Cavities Synthesized by Using the Boric Acid Flux Method
Chemistry of Materials, 2008, 20, 4900
4001165 CIFAu N5 O14P 1 21/n 17.751; 8.1021; 8.987
90; 112.67; 90
520.8Wickleder, Mathias S.; Büchner, Oliver; Gerlach, Frauke; Necke, Mandus; Al-Shamery, Katharina; Wich, Thomas; Luttermann, Tim
Synthesis, Characterization and Electron Beam Assisted Decomposition of (NO2)[Au(NO3)4]
Chemistry of Materials, 2008, 20, 5181
4001166 CIFGd6 Ni1.667 Si3P 63/m11.7433; 11.7433; 4.1857
90; 90; 120
499.895Gaudin, Etienne; Tencé, Sophie; Weill, François; Rodriguez Fernandez, Jesus; Chevalier, Bernard
Structural and Magnetocaloric Properties of the New Ternary Silicides Gd6M5/3Si3with M = Co and Ni
Chemistry of Materials, 2008, 20, 2972
4001167 CIFGd6 Ni1.667 Si3P 63/m11.7123; 11.7123; 4.1705
90; 90; 120
495.45Gaudin, Etienne; Tencé, Sophie; Weill, François; Rodriguez Fernandez, Jesus; Chevalier, Bernard
Structural and Magnetocaloric Properties of the New Ternary Silicides Gd6M5/3Si3with M = Co and Ni
Chemistry of Materials, 2008, 20, 2972
4001168 CIFC20 H26 N2 OP 3215.599; 15.599; 6.246
90; 90; 120
1316.2Sliwa, Michel; Spangenberg, Arnaud; Malfant, Isabelle; Lacroix, Pascal G.; Métivier, Rémi; Pansu, Robert B.; Nakatani, Keitaro
Structural, Optical, and Theoretical Studies of a Thermochromic Organic Crystal with Reversibly Variable Second Harmonic Generation
Chemistry of Materials, 2008, 20, 4062
4001169 CIFC32 H46 N6 O13P -16.289; 8.009; 18.625
78.018; 88.648; 89.537
917.4Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai
Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes
Chemistry of Materials, 2008, 20, 3145
4001170 CIFC16 H10 Cu2 N2 O10R -3 :H18.814; 18.814; 30.58
90; 90; 120
9374Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai
Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes
Chemistry of Materials, 2008, 20, 3145
4001171 CIFC34 H48 N4 O12P -17.32; 10.709; 12.668
65.56; 89.18; 88.097
903.6Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai
Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes
Chemistry of Materials, 2008, 20, 3145
4001172 CIFC18 H12 Cu2 O10R -3 :H18.795; 18.795; 31.28
90; 90; 120
9569Wang, Xi-Sen; Ma, Shengqian; Rauch, Karsten; Simmons, Jason M.; Yuan, Daqiang; Wang, Xiaoping; Yildirim, Taner; Cole, William C.; López, Joseph J.; Meijere, Armin de; Zhou, Hong-Cai
Metal−Organic Frameworks Based on Double-Bond-Coupled Di-Isophthalate Linkers with High Hydrogen and Methane Uptakes
Chemistry of Materials, 2008, 20, 3145
4001173 CIFC3 H7 N11 O2P 1 21/c 17.941; 6.7131; 17.7867
90; 95.269; 90
944.18Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.
Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials
Chemistry of Materials, 2008, 20, 4519
4001174 CIFC2 H3 Ag N6 O2P 1 21/c 110.774; 8.4315; 6.4111
90; 103.816; 90
565.54Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.
Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials
Chemistry of Materials, 2008, 20, 4519
4001175 CIFC3 H13 N11 O3P -17.081; 7.3612; 10.515
80.68; 88.59; 74.05
519.9Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.
Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials
Chemistry of Materials, 2008, 20, 4519
4001176 CIFC3 H9 N9 O2C 1 2/c 121.2356; 6.8969; 12.1761
90; 102.457; 90
1741.33Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.
Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials
Chemistry of Materials, 2008, 20, 4519
4001177 CIFC3 H12 N12 O2P -16.865; 7.98; 10.518
101.311; 103.776; 103.123
525.6Klapötke, Thomas M.; Stierstorfer, Jörg; Wallek, Andreas U.
Nitrogen-Rich Salts of 1-Methyl-5-nitriminotetrazolate: An Auspicious Class of Thermally Stable Energetic Materials
Chemistry of Materials, 2008, 20, 4519
4001178 CIFAg19 Br7 Te6R -3 m :H7.8548; 7.8548; 44.184
90; 90; 120
2360.8Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan
Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7
Chemistry of Materials, 2008, 20, 4080
4001179 CIFAg19 Br7 Te6C 1 2/m 113.604; 7.857; 15.395
90; 107.13; 90
1572.5Nilges, Tom; Messel, Julia; Bawohl, Melanie; Lange, Stefan
Silver(I) Chalcogenide Halides Ag19Te6Br7, Ag19Te6Br5.4I1.6, and Ag19Te5SeBr7
Chemistry of Materials, 2008, 20, 4080

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