Crystallography Open Database
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Searching space group like 'P c a b'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 7004244 | CIF | C11 H13 Hg N O S2 | P c a b | 9.43; 12.031; 21.6724 90; 90; 90 | 2458.78 | Singh, Nanhai; Kumar, Abhinav; Molloy, Kieran C.; Mahon, Mary F. Syntheses, crystal and molecular structures, and properties of some new phenylmercury(ii) dithiolate complexes Dalton Transactions, 2008, 4999-5007 |
| 7004687 | CIF | C16 H34 Co P3 S | P c a b | 12.3187; 12.7608; 26.99 90; 90; 90 | 4242.7 | Beck, Robert; Frey, Markus; Camadanli, Sebnem; Klein, Hans-Friedrich Four- and five-membered cobaltacycles by regioselective cyclometallation of benzyl sulfide derivatives via Co(v) intermediates Dalton Transactions, 2008, 4981-4983 |
| 7005125 | CIF | C50 H62 N6 P2 Pd2 S2 | P c a b | 39.276; 8.758; 14.875 90; 90; 90 | 5116.7 | Chang, Xiaohong; Kim, Mi-Young; Kim, Yong-Joo; Huh, Hyun Sue; Lee, Soon W. Dinuclear palladium-azido complexes containing thiophene derivatives: reactivity toward organic isocyanides and isothiocyanates. Dalton transactions (Cambridge, England : 2003), 2007, 792-801 |
| 7006584 | CIF | C20 H18 Cu2 N6 O4 | P c a b | 17.217; 6.42; 17.644 90; 90; 90 | 1950.2 | Mukherjee, Jhumpa; Mukherjee, Rabindranath Reaction with dioxygen of a Cu(I) complex of 1-benzyl-[3-(2'-pyridyl)]pyrazole triggers ethyl acetate hydrolysis: acetato-/pyrazolato-, dihydroxo- and diacetato-bridged Cu(II) complexes. Dalton transactions (Cambridge, England : 2003), 2006, 1611-1621 |
| 7007570 | CIF | C26 H63 P5 Pt2 | P c a b | 14.46; 20.302; 24.218 90; 90; 90 | 7110 | Jones, Cameron; Schulten, Christian; Stasch, Andreas The first complexes and cyclodimerisations of methylphosphaalkyne (P[triple bond]CMe). Dalton transactions (Cambridge, England : 2003), 2006, 3733-3735 |
| 7008795 | CIF | C13 H18 N6 | P c a b | 8.4387; 17.711; 18.242 90; 90; 90 | 2726.4 | García-Raso, Angel; Fiol, Juan J.; Tasada, Andrés; Albertí, Francisca M.; Molins, Elies; Basallote, Manuel G.; Máñez, María A.; Fernández-Trujillo, María J.; Sánchez, David Ag(i) complexes with alkylidene-bis(2-aminopyrimidines) as building units for discrete metallomacrocyclic frames. A structural and solution study Dalton Transactions, 2005, 3763 |
| 7009123 | CIF | C12 H17 Mo N3 S3 | P c a b | 15.1833; 12.2873; 16.861 90; 90; 90 | 3145.6 | Davies, Sian C.; Hughes, David L.; Richards, Raymond L.; Sanders, J. Roger Molybdenum and tungsten complexes of the N(CH2CH2S)33− (NS3) ligand with oxide, sulfide, diazenide, hydrazide and nitrosyl co-ligands Journal of the Chemical Society, Dalton Transactions, 2000, 719 |
| 7009534 | CIF | C48 H48 Ag4 N8 O16 S4 | P c a b | 14.981; 16.923; 21.999 90; 90; 90 | 5577 | Su, Cheng-Yong; Liao, Sen; Zhu, Hai-Liang; Kang, Bei-Sheng; Chen, Xiao-Ming; Liu, Han-Qin Silver(I) complexes with quinoline based linear multidentate ligands: self-assembly of sulfur-bridged tetrametallotricyclic boxes † Journal of the Chemical Society, Dalton Transactions, 2000, 1985 |
| 7010610 | CIF | C7 H15 Cd N5 Se2 | P c a b | 11.357; 12.311; 19.422 90; 90; 90 | 2715.5 | Maji, Tapas Kumar; Sain, Saugata; Mostafa, Golam; Das, Debasis; Lu, Tian-Huey; Chaudhuri, Nirmalendu Ray Synthesis and crystal structure of selenocyanato bridged two dimensional supramolecular coordination compounds of cadmium(ii)Electronic supplementary information (ESI) available: Corey–Pauling–Koltun diagram of 2. See http://www.rsc.org/suppdata/dt/b1/b101064f/ Journal of the Chemical Society, Dalton Transactions, 2001, 3149 |
| 7014783 | CIF | C34 H33 Br Cl2 P2 W | P c a b | 23.3121; 9.3925; 27.8933 90; 90; 90 | 6107.5 | Lancashire, Hannah N.; Brown, Neil J.; Carthy, Laura; Collison, David; Fitzgerald, Emma C.; Edge, Ruth; Helliwell, Madeleine; Holden, Mark; Low, Paul J.; McDouall, Joseph J. W.; Whiteley, Mark W. Synthesis, spectroscopy and electronic structure of the vinylidene and alkynyl complexes [W(C=CHR)(dppe)(η-C₇H₇)](+) and [W(C≡CR)(dppe)(η-C₇H₇](n+) (n = 0 or 1). Dalton transactions (Cambridge, England : 2003), 2011, 40, 1267-1278 |
| 7014850 | CIF | C19 H31 N O2 | P c a b | 8.8637; 10.15; 40.261 90; 90; 90 | 3622.1 | Poirier, Valentin; Roisnel, Thierry; Carpentier, Jean-François; Sarazin, Yann Zinc and magnesium complexes supported by bulky multidentate amino-ether phenolate ligands: potent pre-catalysts for the immortal ring-opening polymerisation of cyclic esters. Dalton transactions (Cambridge, England : 2003), 2011, 40, 523-534 |
| 7015192 | CIF | C18 H12 N2 O Pd | P c a b | 7.732; 16.2417; 22.1839 90; 90; 90 | 2785.9 | Santana, M. Dolores; García-Bueno, Rocío; García, Gabriel; Sánchez, Gregorio; García, Joaquín; Pérez, José; García, Luis; Serrano, J. Luis Synthesis and luminescence properties of cyclopalladated complexes with S^N and O^N donor ligands. Dalton transactions (Cambridge, England : 2003), 2011, 40, 3537-3546 |
| 7015722 | CIF | C18 H20 Ag2 N4 O8 | P c a b | 7.389; 15.962; 17.759 90; 90; 90 | 2094.55 | Burrows, Andrew D.; Kelly, David J.; Mahon, Mary F.; Raithby, Paul R.; Richardson, Christopher; Stevenson, Anna J. Silver coordination networks and cages based on a semi-rigid bis(isoxazolyl) ligand. Dalton transactions (Cambridge, England : 2003), 2011, 40, 5483-5493 |
| 7016669 | CIF | C43 H43 Cl N4 Ni O7 | P c a b | 16.0204; 19.2924; 25.0918 90; 90; 90 | 7755.2 | Grubel, Katarzyna; Ingle, Gajendrasingh K.; Fuller, Amy L.; Arif, Atta M.; Berreau, Lisa M. Influence of water on the formation of O(2)-reactive divalent metal enolate complexes of relevance to acireductone dioxygenases. Dalton transactions (Cambridge, England : 2003), 2011, 40, 10609-10620 |
| 7016915 | CIF | C27 H19 Br N3 O4 Re | P c a b | 17.395; 13.956; 20.464 90; 90; 90 | 4967.9 | Griffiths, D. Vaughan; Cheong, Yuen-Ki; Duncanson, Philip; Motevalli, Majid Studies of the reactions of tripodal pyridine-containing ligands with Re(CO)(5)Br leading to rheniumtricarbonyl complexes with potential biomedical applications. Dalton transactions (Cambridge, England : 2003), 2011, 40, 10215-10228 |
| 7017107 | CIF | C39 H55 Al N2 O2 | P c a b | 10.04; 22.875; 31.745 90; 90; 90 | 7290.7 | Whitelaw, Emma L.; Loraine, Gaynor; Mahon, Mary F.; Jones, Matthew D. Salalen aluminium complexes and their exploitation for the ring opening polymerisation of rac-lactide. Dalton transactions (Cambridge, England : 2003), 2011, 40, 11469-11473 |
| 7018671 | CIF | C41 H41 Cl2 O2 P Ru | P c a b | 11.309; 23.9659; 26.7843 90; 90; 90 | 7259.4 | Kabro, Anzhelika; Ghattas, Ghazi; Roisnel, Thierry; Fischmeister, Cédric; Bruneau, Christian New ruthenium metathesis catalysts with chelating indenylidene ligands: synthesis, characterization and reactivity. Dalton transactions (Cambridge, England : 2003), 2012, 41, 3695-3700 |
| 7019795 | CIF | C45 H45 Mo12 N3 O46 P Zn4 | P c a b | 17.563; 30.229; 31.886 90; 90; 90 | 16929 | Rodriguez-Albelo, L Marleny; Rousseau, Guillaume; Mialane, Pierre; Marrot, Jérôme; Mellot-Draznieks, Caroline; Ruiz-Salvador, A Rabdel; Li, Shiwen; Liu, Rongji; Zhang, Guangjin; Keita, Bineta; Dolbecq, Anne ε-Keggin-based coordination networks: Synthesis, structure and application toward green synthesis of polyoxometalate@graphene hybrids. Dalton transactions (Cambridge, England : 2003), 2012, 41, 9989-9999 |
| 7022572 | CIF | C22 H46 Cu2 N4 O2 | P c a b | 11.061; 12.933; 18.269 90; 90; 90 | 2613.42 | Willcocks, Alexander M.; Pugh, Thomas; Hamilton, Jeff A.; Johnson, Andrew L.; Richards, Stephen P.; Kingsley, Andrew J. CVD of pure copper films from novel iso-ureate complexes. Dalton transactions (Cambridge, England : 2003), 2013, 42, 5554-5565 |
| 7022808 | CIF | C42 H61 N4 O3 Si2 Y | P c a b | 8.6929; 52.4298; 19.5627 90; 90; 90 | 8916 | Tu, Jing; Li, Wenbo; Xue, Mingqiang; Zhang, Yong; Shen, Qi Bridged bis(amidinate) lanthanide aryloxides: syntheses, structures, and catalytic activity for addition of amines to carbodiimides. Dalton transactions (Cambridge, England : 2003), 2013, 42, 5890-5901 |
| 7024699 | CIF | C150 H118 La2 N2 O9 Si4 | P c a b | 22.4713; 29.6425; 39.18 90; 90; 90 | 26098 | Grunova, Ekaterina; Kirillov, Evgueni; Roisnel, Thierry; Carpentier, Jean-François Group 3 metal complexes supported by tridentate pyridine- and thiophene-linked bis(naphtholate) ligands: synthesis, structure, and use in stereoselective ring-opening polymerization of racemic lactide and beta-butyrolactone. Dalton transactions (Cambridge, England : 2003), 2010, 39, 6739-6752 |
| 7027442 | CIF | C38 H59 O2 Sb | P c a b | 11.4906; 20.0826; 31.2742 90; 90; 90 | 7216.9 | Jones, Cameron; Steed, Jonathan W.; Thomas, Ryan C. Compounds containing λ3,σ2-SbC bonds: synthesis and structural characterisation of the first stiba-enol, Mes*C(O)SbC(OH)Mes* (Mes* = C6H2But3-2,4,6) and a 2,3-distibabutadiene, {Mes(Me3SiO)CSb}2 (Mes = C6H2Me3-2,4,6) † Journal of the Chemical Society, Dalton Transactions, 1999, 1541 |
| 7030864 | CIF | C8 H25 N2 O9 P3 | P c a b | 10.50568; 10.9861; 30.33966 90; 90; 90 | 3501.7 | Mangstl, Martin; Celinski, Vinicius R.; Johansson, Sebastian; Weber, Johannes; An, Feng; Schmedt Auf der Günne, Jörn Low temperature synthesis of ionic phosphates in dimethyl sulfoxide. Dalton transactions (Cambridge, England : 2003), 2014, 43, 10033-10039 |
| 7031615 | CIF | C44 H62 Cl4 N12 O16.5 P2 Ru2 S6 | P c a b | 20.543; 24.132; 28.016 90; 90; 90 | 13889 | Iengo, E.; Demitri, N.; Balducci, G.; Alessio, E. An irresolute linker: separation, and structural and spectroscopic characterization of the two linkage isomers of a Ru(ii)-(2-(2'-pyridyl)pyrimidine-4-carboxylic acid) complex. Dalton transactions (Cambridge, England : 2003), 2014, 43, 12160-12163 |
| 7033285 | CIF | C18 H17 Fe N2 S2 Tl | P c a b | 9.6634; 10.5339; 37.35 90; 90; 90 | 3802 | Kumar, Vinod; Singh, Vikram; Gupta, Ajit N.; Drew, Michael G. B.; Singh, Nanhai Intermolecular Tl···H-C anagostic interactions in luminescent pyridyl functionalized thallium(I) dithiocarbamates. Dalton transactions (Cambridge, England : 2003), 2015, 44, 1716-1723 |
| 7033562 | CIF | C54 H94 Cu6 N34 O20 | P c a b | 29.507; 12.23; 20.978 90; 90; 90 | 7570.34 | Pitarch-Jarque, Javier; Belda, Raquel; Lloret, Francesc; Ferrando-Soria, Jesús; Navarro, Pilar; Lopera, Alberto; García-España, Enrique "3 + 1 = 6 + 2" in Cu(ii) coordination chemistry of 1H-pyrazole aza cryptands. Dalton transactions (Cambridge, England : 2003), 2015, 44, 3378-3383 |
| 7034168 | CIF | C27 H28 Fe2 S | P c a b | 9.7243; 13.7133; 32.524 90; 90; 90 | 4337.1 | Kowalski, Konrad; Karpowicz, Rafał; Mlostoń, Grzegorz; Miesel, Dominique; Hildebrandt, Alexander; Lang, Heinrich; Czerwieniec, Rafał; Therrien, Bruno Synthesis and (spectro)electrochemistry of mixed-valent diferrocenyl-dihydrothiopyran derivatives. Dalton transactions (Cambridge, England : 2003), 2015, 44, 6268-6276 |
| 7035009 | CIF | C41 H22 Cu F26 N2 O P3 | P c a b | 20.0258; 20.3253; 23.228 90; 90; 90 | 9454.5 | Nishikawa, Michihiro; Wakita, Yuri; Nishi, Tatsuya; Miura, Takumi; Tsubomura, Taro Long-lived and oxygen-responsive photoluminescence in the solid state of copper(i) complexes bearing fluorinated diphosphine and bipyridine ligands. Dalton transactions (Cambridge, England : 2003), 2015, 44, 9170-9181 |
| 7036510 | CIF | C25 H22 Fe N2 Ni O2 | P c a b | 7.5236; 22.6943; 23.9482 90; 90; 90 | 4089 | Novoa, Néstor; Roisnel, Thierry; Hamon, Paul; Kahlal, Samia; Manzur, Carolina; Ngo, Hoang Minh; Ledoux-Rak, Isabelle; Saillard, Jean-Yves; Carrillo, David; Hamon, Jean-René Four-coordinate nickel(ii) and copper(ii) complex based ONO tridentate Schiff base ligands: synthesis, molecular structure, electrochemical, linear and nonlinear properties, and computational study. Dalton transactions (Cambridge, England : 2003), 2015, 44, 18019-18037 |
| 7040470 | CIF | C96 H204 Dy Mo16 N13 O52 | P c a b | 17.7626; 32.9141; 47.7196 90; 90; 90 | 27898.8 | Baldoví, José J; Duan, Yan; Bustos, Carlos; Cardona-Serra, Salvador; Gouzerh, Pierre; Villanneau, Richard; Gontard, Geoffrey; Clemente-Juan, Juan M; Gaita-Ariño, Alejandro; Giménez-Saiz, Carlos; Proust, Anna; Coronado, Eugenio Single ion magnets based on lanthanoid polyoxomolybdate complexes. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16653-16660 |
| 7040471 | CIF | C96 H204 Ho Mo16 N13 O52 | P c a b | 17.8839; 32.8402; 47.8961 90; 90; 90 | 28129.9 | Baldoví, José J; Duan, Yan; Bustos, Carlos; Cardona-Serra, Salvador; Gouzerh, Pierre; Villanneau, Richard; Gontard, Geoffrey; Clemente-Juan, Juan M; Gaita-Ariño, Alejandro; Giménez-Saiz, Carlos; Proust, Anna; Coronado, Eugenio Single ion magnets based on lanthanoid polyoxomolybdate complexes. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16653-16660 |
| 7040472 | CIF | C96 H204 Er Mo16 N13 O52 | P c a b | 17.811; 33.158; 48.1554 90; 90; 90 | 28439.5 | Baldoví, José J; Duan, Yan; Bustos, Carlos; Cardona-Serra, Salvador; Gouzerh, Pierre; Villanneau, Richard; Gontard, Geoffrey; Clemente-Juan, Juan M; Gaita-Ariño, Alejandro; Giménez-Saiz, Carlos; Proust, Anna; Coronado, Eugenio Single ion magnets based on lanthanoid polyoxomolybdate complexes. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16653-16660 |
| 7040473 | CIF | C96 H204 Mo16 N13 O52 Tm | P c a b | 17.8375; 32.8499; 47.7986 90; 90; 90 | 28008.1 | Baldoví, José J; Duan, Yan; Bustos, Carlos; Cardona-Serra, Salvador; Gouzerh, Pierre; Villanneau, Richard; Gontard, Geoffrey; Clemente-Juan, Juan M; Gaita-Ariño, Alejandro; Giménez-Saiz, Carlos; Proust, Anna; Coronado, Eugenio Single ion magnets based on lanthanoid polyoxomolybdate complexes. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16653-16660 |
| 7040474 | CIF | C96 H204 Mo16 N13 O52 Yb | P c a b | 17.8722; 32.7932; 47.8651 90; 90; 90 | 28053.1 | Baldoví, José J; Duan, Yan; Bustos, Carlos; Cardona-Serra, Salvador; Gouzerh, Pierre; Villanneau, Richard; Gontard, Geoffrey; Clemente-Juan, Juan M; Gaita-Ariño, Alejandro; Giménez-Saiz, Carlos; Proust, Anna; Coronado, Eugenio Single ion magnets based on lanthanoid polyoxomolybdate complexes. Dalton transactions (Cambridge, England : 2003), 2016, 45, 16653-16660 |
| 7044610 | CIF | C17 H17 N2 O3 | P c a b | 7.2782; 12.8154; 30.621 90; 90; 90 | 2856.1 | Ghosh, Tapas; Patra, Debashis; Paul, Subhabrata; Majumder, Indira; Sepay, Nayim; Bera, Sachinath; Kundu, Rita; Drew, Michael G. B. Exploring the role of substituent in the hydrazone ligand of a family of m-oxidodivanadium(V) hydrazone complexes on structure, DNA binding and anticancer activity Dalton Transactions, 2017 |
| 7046440 | CIF | C100 H97 Mo24 N20 O88 P2 Ru2 Zn4 | P c a b | 23.7521; 26.2871; 27.5687 90; 90; 90 | 17213 | Salomon, William; Rivière, Eric; López, Xavier; Suaud, Nicolas; Mialane, Pierre; Haouas, Mohamed; Saad, Ali; Marrot, Jérôme; Dolbecq, Anne Bicapped Keggin polyoxomolybdates: discrete species and experimental and theoretical investigations on the electronic delocalization in a chain compound. Dalton transactions (Cambridge, England : 2003), 2018, 47, 10636-10645 |
| 7047962 | CIF | C55 H42 F12 Fe2 N20 O21 S4 | P c a b | 15.1365; 21.8413; 22.3085 90; 90; 90 | 7375.2 | García-López, Víctor; Palacios-Corella, Mario; Abhervé, Alexandre; Pellicer-Carreño, Isaac; Desplanches, Cédric; Clemente-León, Miguel; Coronado, Eugenio Spin-crossover compounds based on iron(ii) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic acid. Dalton transactions (Cambridge, England : 2003), 2018, 47, 16958-16968 |
| 7047966 | CIF | C29 H24 F6 Fe N10 O11 S2 | P c a b | 14.8997; 21.7329; 22.2566 90; 90; 90 | 7207 | García-López, Víctor; Palacios-Corella, Mario; Abhervé, Alexandre; Pellicer-Carreño, Isaac; Desplanches, Cédric; Clemente-León, Miguel; Coronado, Eugenio Spin-crossover compounds based on iron(ii) complexes of 2,6-bis(pyrazol-1-yl)pyridine (bpp) functionalized with carboxylic acid and ethyl carboxylic acid. Dalton transactions (Cambridge, England : 2003), 2018, 47, 16958-16968 |
| 7050037 | CIF | C41.24 H39.47 Br2 Cl2.47 N Ni O P2 | P c a b | 13.535; 23.464; 27.85 90; 90; 90 | 8844.7 | Sofia I. Pascu; Karl S. Coleman; A. R. Cowley; Malcolm L. H. Green; Nicholas H. Rees New group 10 complexes of the bulky iminophosphine ligands [Ph2PCH2C(Ph)?N(2,6-R2C6H3)], where R = Me, iPr New Journal of Chemistry, 2005, 29, 385 |
| 7051331 | CIF | C4 H15 Br2 N3 | P c a b | 11.6664; 9.1552; 17.5536 90; 90; 90 | 1874.9 | New Journal of Chemistry, 2000 |
| 7051455 | CIF | C26 H28 F12 N2 P2 Ru S4 | P c a b | 19.95; 14.86; 21.52 90; 90; 90 | 6382 | Santos, Teresa M.; Goodfellow, Brian J.; Madureira, João; Pedrosa de Jesus, Júlio; Félix, Vitor; Drew, Michael G. B. Synthesis and structural characterisation of new Ru^II^[12]aneS~4~ complexes with polypyridylic and related ligands New Journal of Chemistry, 1999, 23, 1015-1025 |
| 7053969 | CIF | C20 H22 Cl2 N2 | P c a b | 13.7371; 6.922; 20.0985 90; 90; 90 | 1911.13 | Rojas-Sáenz, Héctor; Suárez-Moreno, Galdina V.; Ramos-García, Iris; Duarte-Hernández, Angélica M.; Mijangos, Edgar; Peña-Hueso, Adrián; Contreras, Rosalinda; Flores-Parra, Angelina 1,4-Dialkyl-1,4-diazabutadienes: their reactions with aluminum and indium halides New Journal of Chemistry, 2014, 38, 391 |
| 7057090 | CIF | C26 H38 Mo N2 O4 | P c a b | 12.9405; 14.038; 28.3268 90; 90; 90 | 5145.8 | Maurya, Mannar R.; Mengesha, Bekele; Uprety, Bhawna; Jangra, Nancy; Tomar, Reshu; Avecilla, Fernando Oxygen atom transfer between DMSO and benzoin catalyzed by cis-dioxidomolybdenum(vi) complexes of tetradentate Mannich bases New Journal of Chemistry, 2018, 42, 6225 |
| 7101699 | CIF | C30 H17 N O2 | P c a b | 9.329; 17.981; 25.306 90; 90; 90 | 4245 | Benanti, Travis L; Saejueng, Pranorm; Venkataraman, D Segregated assemblies in bridged electron-rich and electron-poor pi-conjugated moieties. Chemical communications (Cambridge, England), 2007, 692-694 |
| 7103967 | CIF | C15 H27 Cl N P Si | P c a b | 14.969; 15.3; 15.506 90; 90; 90 | 3551 | Wiacek, Robert J.; Macdonald, Charles L. B.; Jones, Jamie N.; Pietryga, Jeffrey M.; Cowley, Alan H. The contrasting behaviour of bridged amido-cyclopentadienyl (constrained geometry) group 15 chlorides and cations derived therefrom Chemical Communications (Cambridge, United Kingdom), 2003, 430-431 |
| 7107186 | CIF | C60 H42 F36 Gd2 O18 S4 | P c a b | 17.251; 24.093; 41.951 90; 90; 90 | 17436 | Fabrice Fabrice Pointillart; Svetlana Klementieva; Viacheslav Kuropatov; Yann Le Gal; Stephane Golhen; Olivier Cador; Vladimir Cherkasov; Lahcene Ouahab A single molecule magnet behaviour in a D3h symmetry Dy(III) complex involving a quinone-tetrathiafulvalene-quinone bridge Chem.Commun., 2012, 48, 714 |
| 7122510 | CIF | C12 H16 N3 O7 P | P c a b | 7.0408; 19.834; 23.634 90; 90; 90 | 3300.4 | Zhou, Lin; Shi, Ping-Ping; Zheng, Xuan; Geng, Fu-Juan; Ye, Qiong; Fu, Da-Wei Molecular design of high-temperature organic dielectric switches. Chemical communications (Cambridge, England), 2018, 54, 13111-13114 |
| 7127779 | CIF | C20 H14 Br Cl Mn N3 O4 | P c a b | 7.6931; 17.523; 30.345 90; 90; 90 | 4090.7 | Stenger-Smith, Jenny; Chakraborty, Indranil; Ouattara, Ramatoulaye; Sameera, W. M. C.; Rue, Kelly; Mascharak, Pradip CO release from Mn(i)-based photoCORMs with single photons in the phototherapeutic region. Chemical communications (Cambridge, England), 2021, 57, 1101-1104 |
| 7130617 | CIF | C7 H4 Br Cl N2 | P c a b | 9.3593; 12.3411; 13.8369 90; 90; 90 | 1598.2 | Dhaka, Arun; Jeannin, olivier; Aubert, Emmanuel; Espinosa, Enrique; Fourmigué, Marc; Jeon, Ie-Rang N-chlorobenzimidazoles as efficient and structurally diverse amphoteric halogen bond donors in crystal engineering Chemical Communications, 2022 |
| 7150783 | CIF | C12 H6 Cl I N2 S | P c a b | 5.8116; 16.782; 24.6525 90; 90; 90 | 2404.37 | Snégaroff, Katia; Lassagne, Frédéric; Bentabed-Ababsa, Ghenia; Nassar, Ekhlass; Ely, Sidaty Cheikh Sid; Hesse, Stéphanie; Perspicace, Enrico; Derdour, Aïcha; Mongin, Florence Direct metallation of thienopyrimidines using a mixed lithium‒cadmium base and antitumor activity of functionalized derivatives Organic & Biomolecular Chemistry, 2009, 7, 4782 |
| 7151679 | CIF | C19 H16 N2 O6 | P c a b | 11.2975; 15.8036; 20.145 90; 90; 90 | 3596.71 | Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes. Organic & biomolecular chemistry, 2011, 9, 363-366 |
| 7153641 | CIF | C15 H25 B O4 Si | P c a b | 12.5; 12.661; 22.056 90; 90; 90 | 3490.64 | Goggins, Sean; Rosevere, Eleanor; Bellini, Clément; Allen, Joseph C.; Marsh, Barrie J.; Mahon, Mary F.; Frost, Christopher G. Silyl-protected dioxaborinanes: application in the Suzuki cross-coupling reaction. Organic & biomolecular chemistry, 2014, 12, 47-52 |
| 7154567 | CIF | C10 H10 N2 O2 S4 | P c a b | 6.8237; 8.5474; 22.3448 90; 90; 90 | 1303.26 | Le Gal, Y.; Ameline, D.; Bellec, N.; Vacher, A.; Roisnel, T.; Dorcet, V.; Jeannin, O.; Lorcy, D. Efficient routes towards a series of 5,5'-bithiazolidinylidenes as π-electron acceptors. Organic & biomolecular chemistry, 2015, 13, 8479-8486 |
| 7157358 | CIF | C21 H15 N O3 | P c a b | 7.2265; 13.6852; 32.525 90; 90; 90 | 3216.6 | Dong, Shanliang; Huang, Jingjing; Sha, Hongkai; Qiu, Lihua; Hu, Wenhao; Xu, Xinfang Copper-catalyzed formal [1 + 2 + 2]-annulation of alkyne-tethered diazoacetates and pyridines: access to polycyclic indolizines. Organic & biomolecular chemistry, 2020, 18, 1926-1932 |
| 7201831 | CIF | C14 H17 N5 O | P c a b | 9.386; 11.4412; 27.4207 90; 90; 90 | 2944.6 | Legrand, Yves-Marie; Michau, Mathieu; van der Lee, Arie; Barboiu, Mihail Homomeric and heteromeric self-assembly of hybrid ureido‒imidazole compounds CrystEngComm, 2008, 10, 490 |
| 7202577 | CIF | C43 H49 O16 P2 | P c a b | 15.888; 16.518; 33.306 90; 90; 90 | 8741 | Daly, Susan M.; Grassi, Michele; Shenoy, Devanand K.; Ugozzoli, Franco; Dalcanale, Enrico Supramolecular surface plasmon resonance (SPR) sensors for organophosphorus vapor detection Journal of Materials Chemistry, 2007, 17, 1809 |
| 7203861 | CIF | C3 H16 Ga3 N2 O15 P3 | P c a b | 10.043; 15.989; 18.308 90; 90; 90 | 2939.9 | Chantal Brouca-Cabarrecq; Alain Mosset New potential open-framework materials in gallophosphate systems. Preparation and crystal structure of [NH3(CH2)3NH3]Ga3(PO4)3(OH)2·H2O and [NH2(CH2)3NH2]Ga3(PO4)3(H2O) J. Mater. Chem., 2000, 10, 445-450 |
| 7204554 | CIF | C36 H44 N4 O10 | P c a b | 8.9755; 16.22; 23.691 90; 90; 90 | 3449 | Neumann, Bernhard; Hegmann, Torsten; Wagner, Christoph; Ashton, Peter R.; Wolf, Raik; Tschierske, Carsten Liquid crystalline macrocycles containing phenylpyrimidine unitsElectronic supplementary information (ESI) available: the procedures and analytical data for all compounds and a table with selected bond distances and bond angles of the crystal structure of compound C are available as supplementary data. See http://www.rsc.org/suppdata/jm/b2/b210271d/ Journal of Materials Chemistry, 2003, 13, 778 |
| 7206402 | CIF | C7 H10 N2 O S | P c a b | 28.67338; 11.152871; 10.668212 90; 90; 90 | 3411.59 | Ferreira, Fabio Furlan; Trindade, Antonio Carlos; Antonio, Selma Gutierrez; de Oliveira Paiva-Santos, Carlos Crystal structure of propylthiouracil determined using high-resolution synchrotron X-ray powder diffraction CrystEngComm, 2011, 13, 5474 |
| 7211403 | CIF | C13 H5 F4 N5 S4 | P c a b | 10.8996; 19.1551; 29.1067 90; 90; 90 | 6077 | Robinson, Sean W.; Haynes, Delia A.; Rawson, Jeremy M. Co-crystal formation with 1,2,3,5-dithiadiazolyl radicals CrystEngComm, 2013, 15, 10205 |
| 7212364 | CIF | C13 H13 N O2 | P c a b | 9.1168; 13.8294; 17.2443 90; 90; 90 | 2174.16 | Raihan, Mustafa J.; Kavala, Veerababurao; Kuo, Chun-Wei; Raju, B. Rama; Yao, Ching-Fa ‘On-water’ synthesis of chromeno-isoxazoles mediated by [hydroxy(tosyloxy)iodo]benzene (HTIB) Green Chemistry, 2010, 12, 1090 |
| 7216465 | CIF | C12 H8 N4 O2 S Zn | P c a b | 14.545; 14.834; 12.805 90; 90; 90 | 2762.8 | De la Pinta, Noelia; Caballero, Ana B.; Madariaga, Gotzon; Ezpeleta, José M.; Rodriguez-Dieguez, Antonio; Salas, Juan M.; Cortés, Roberto DPDS‒DPS in situ transformation at room temperature via a 1,2-nucleophilic addition mechanism CrystEngComm, 2014, 16, 8322 |
| 7219525 | CIF | C39 H41 Co N2 P3 | P c a b | 16.666; 19.745; 21.037 90; 90; 90 | 6922.6 | zhu, gengyu; wang, lin; Sun, Hongjian; Li, Xiaoyan Formation of PCP pincer cobalt complexes with cobaltacyclopropane moieties via double Csp3-H bond activation† RSC Adv., 2015 |
| 7220657 | CIF | C16 H18 N4 | P c a b | 19.379; 24.584; 12.3 90; 90; 90 | 5860 | Baig, Fayaz; Kant, Rajni; Gupta, Vivek; Sarkar, Madhushree Effects of Non Covalent Interactions in Light Emitting Properties of bis-pyridyl-alkyl-di-imines RSC Adv., 2015 |
| 7222283 | CIF | C16 H20 Cl Cu N3 O7 | P c a b | 11.051; 15.58; 21.736 90; 90; 90 | 3742.39 | AGGOUN, Djouhra; OURARI, Ali; DERAFA, Wassila A novel unsymmetrical tetradentate copper (II)-Schiff base complex: Synthesis, Crystal structure, Electrochemical, Morphological and Electrocatalytic behaviors towards electroreduction of alkyl and aryl halides RSC Adv., 2015 |
| 7225673 | CIF | C20 H20 Cl2 N2 O4 | P c a b | 7.5644; 15.7136; 16.6651 90; 90; 90 | 1980.9 | Sovago, Ioana; Thomas, Lynne H.; Adam, Martin S.; Capelli, Silvia C.; Wilson, Chick C.; Farrugia, Louis J. High resolution X-ray and neutron diffraction studies on molecular complexes of chloranilic acid and lutidines CrystEngComm, 2016, 18, 5697 |
| 7225674 | CIF | C20 H20 Cl2 N2 O4 | P c a b | 7.5644; 15.7136; 16.6651 90; 90; 90 | 1980.9 | Sovago, Ioana; Thomas, Lynne H.; Adam, Martin S.; Capelli, Silvia C.; Wilson, Chick C.; Farrugia, Louis J. High resolution X-ray and neutron diffraction studies on molecular complexes of chloranilic acid and lutidines CrystEngComm, 2016, 18, 5697 |
| 7227253 | CIF | C20 H22 N4 O2 | P c a b | 10.2451; 11.074; 15.3632 90; 90; 90 | 1743 | Leblanc, Nicolas; Genovese, Damiano; De Cola, Luisa; Powell, Annie K. A platform with connections in many directions - further remarkable facets to the multifaceted methylbiquinoxen dication. Physical chemistry chemical physics : PCCP, 2017, 19, 6981-6988 |
| 7228159 | CIF | C14 H8 N2 S3 | P c a b | 9.969; 12.775; 20.278 90; 90; 90 | 2582.5 | Iagatti, Alessandro; Patrizi, Barbara; Basagni, Andrea; Marcelli, Agnese; Alessi, Andrea; Zanardi, Stefano; Fusco, Roberto; Salvalaggio, Mario; Bussotti, Laura; FOGGI, Paolo Photophysical properties and excited state dynamics of 4,7-dithien-2-yl-2,1,3-benzothiadiazole Phys. Chem. Chem. Phys., 2017 |
| 7228654 | CIF | C13 H34 Br3 N O8 Pb | P c a b | 7.7705; 21.1114; 29.069 90; 90; 90 | 4768.7 | Kollek, Tom; Polarz, Sebastian Facet-Controlled Preparation of Hybrid Perovskite Microcrystals in the Gas Phase and the Remarkable Effect on Optoelectronic Properties CrystEngComm, 2017 |
| 7231012 | CIF | C9 H21 Br2 N3 O6 Sr | P c a b | 8.7723; 10.5359; 36.582 90; 90; 90 | 3381.1 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
| 7231016 | CIF | C9 H21 Br2 N3 O6 Sr | P c a b | 8.8611; 10.5404; 36.611 90; 90; 90 | 3419.5 | Clulow, Rebecca; Lightfoot, Philip New sarcosine‒metal halide complexes related to ferroelectric TSCC CrystEngComm, 2018, 20, 4012 |
| 7232164 | CIF | C24 H19 Cl N2 | P c a b | 8.2062; 18.5089; 24.6576 90; 90; 90 | 3745.19 | Leduskrasts, Kaspars; Suna, Edgars Aggregation induced emission by pyridinium‒pyridinium interactions RSC Advances, 2019, 9, 460 |
| 7232431 | CIF | C52 H28 Br16 N4 O9 V | P c a b | 20.733; 26.304; 28.112 90; 90; 90 | 15331 | Dar, Tawseef Ahmad; Uprety, Bhawna; Sankar, Muniappan; Maurya, Mannar R. Robust and electron deficient oxidovanadium(iv) porphyrin catalysts for selective epoxidation and oxidative bromination reactions in aqueous media Green Chemistry, 2019, 21, 1757 |
| 7234656 | CIF | C56 H58 | P c a b | 12.3292; 14.816; 23.194 90; 90; 90 | 4236.8 | Tarek H. El-Assaad; Manuel Auer; Raul Castaneda; Kassem M. Hallal; Fadi M. Jradi; Lorenzo Mosca; Rony S. Khnayzer; Digambara Patra; Tatiana V. Timofeeva; Jean-Luc Bredas; Emil J. W. List-Kratochvil; Brigitte Wex; Bilal R. Kaafarani Tetraaryl pyrenes: photophysical properties, computational studies, crystal structures, and application in OLEDs Journal of Materials Chemistry C, 2016, 4, 3041-3058 |
| 7238346 | CIF | C12 H19 Co3 O11 P3 | P c a b | 10.078; 16.9209; 20.2287 90; 90; 90 | 3449.58 | Yang, Chen-I.; Song, Yu-Tang; Yeh, Yung-Jie; Liu, Yen-Hsiang; Tseng, Tien-Wen; Lu, Kuang-Lieh A flexible tris-phosphonate for the design of copper and cobalt coordination polymers: unusual cage array topology and magnetic properties CrystEngComm, 2011, 13, 2678 |
| 7238446 | CIF | C22 H21 N O2 | P c a b | 8.5808; 46.211; 8.7745 90; 90; 90 | 3479.3 | Kundu, Kshama; Nayak, Sandip K. (±)-Camphor-10-sulfonic acid catalyzed direct one-pot three-component Mannich type reaction of alkyl (hetero)aryl ketones under solvent-free conditions: application to the synthesis of aminochromans RSC Adv., 2012, 2, 480 |
| 7238881 | CIF | C88 H80 Fe4 O4 | P c a b | 15.7383; 50.6519; 18.0535 90; 90; 90 | 14391.8 | Sharma, Rekha; Margani, Ramesh; Mobin, Shaikh M.; Misra, Rajneesh Ferrocenyl substituted calixarenes: synthesis, structure and properties RSC Advances, 2013, 3, 5785 |
| 7701917 | CIF | C20 H20 N2 O10 Ru3 | P c a b | 13.569; 13.83; 27.858 90; 90; 90 | 5227.81 | Ellul, Charles E.; Lowe, John P.; Mahon, Mary F.; Raithby, Paul R.; Whittlesey, Michael K. [Ru<sub>3</sub>(6-NHC)(CO)<sub>10</sub>]: synthesis, characterisation and reactivity of rare 46-electron tri-ruthenium clusters. Dalton transactions (Cambridge, England : 2003), 2018, 47, 4518-4523 |
| 7702363 | CIF | C24 H13 O8 P Re2 S | P c a b | 14.781; 16.863; 20.407 90; 90; 90 | 5086 | Deeming, Antony J.; Shinhmar, Mukesh K.; Arce, Alejandro J.; De Sanctis, Ysaura Two different types of 2-thienyl bridge in dinuclear manganese and rhenium compounds Journal of the Chemical Society, Dalton Transactions, 1999, 1153 |
| 7702439 | CIF | C8 H17 Cu N2 O10 P3 | P c a b | 10.982; 15.846; 18.236 90; 90; 90 | 3173 | Cecconi, Franco; Ghilardi, Carlo A.; Lorenzo Luis, Pablo A.; Midollini, Stefano; Orlandini, Annabella; Dakternieks, Dainis; Duthie, Andrew; Dominguez, Sixto; Berti, Elisabetta; Vacca, Alberto Complexes of the tripodal nitrilotrimethylenetrisphosphonic (H6L) and P,P′,P ″-triphenylnitrilotrimethylenetrisphosphinic (H3L°) acids with the copper(II) ion. Synthesis and characterization of [Hpy][Cu(H3L)(H2O)] and [Cu(HL°)(py)]2·2Me2CO† Journal of the Chemical Society, Dalton Transactions, 2001, 211 |
| 7709286 | CIF | C31 H48 N4 O12 Pd S2 | P c a b | 14.7548; 14.9919; 33.94 90; 90; 90 | 7507.6 | Serrano, Jose Luis; Gaware, Sujeet; Pérez de Haro, Jose Antonio; Pérez, Jose; Lozano, Pedro; Kori, Santosh; Dandela, Rambabu; Sanghvi, Yogesh S.; Kapdi, Anant R. Quadrol-Pd(II) complexes: phosphine-free precatalysts for the room-temperature Suzuki-Miyaura synthesis of nucleoside analogues in aqueous media Dalton Transactions, 2022 |
| 7715663 | CIF | C25 H38 Mo O2 Si2 | P c a b | 15.221; 16.815; 20.546 90; 90; 90 | 5258.6 | Muraoka, Takako; Ishita, Taichi; Kawachi, Kosuke; Nishio, Takuya; Ishihara, Hiroto; Ueno, Keiji Reactions of (mesityl)<sub><i>n</i></sub>(methyl)<sub>2-<i>n</i></sub>silylene complexes with pyridine-<i>N</i>-oxide (<i>n</i> = 1 and 0): formation of silanone complexes and a disiloxanyloxy complex. Dalton transactions (Cambridge, England : 2003), 2024, 53, 7105-7114 |
| 7715664 | CIF | C25 H38 O2 Si2 W | P c a b | 15.2435; 16.7605; 20.4763 90; 90; 90 | 5231.5 | Muraoka, Takako; Ishita, Taichi; Kawachi, Kosuke; Nishio, Takuya; Ishihara, Hiroto; Ueno, Keiji Reactions of (mesityl)<sub><i>n</i></sub>(methyl)<sub>2-<i>n</i></sub>silylene complexes with pyridine-<i>N</i>-oxide (<i>n</i> = 1 and 0): formation of silanone complexes and a disiloxanyloxy complex. Dalton transactions (Cambridge, England : 2003), 2024, 53, 7105-7114 |
| 8100435 | CIF | C4 H5 N3 | P c a b | 10.983; 12.287; 14.052 90; 90; 90 | 1896.3 | Van Meervelt, Luc; Uytterhoeven, Koen Crystal structure of 4-aminopyrimidine, C~4~H~5~N~3~ Zeitschrift für Kristallographie - New Crystal Structures, 2003, 218, 481-482 |
| 8101828 | CIF | C10 H11 Cl N2 O2 S2 | P c a b | 8.5908; 12.0056; 24.2133 90; 90; 90 | 2497.3 | L. Dupont; S. Boverie; P. de Tullio; B. Pirotte Crystal structure of 7-chloro-3-isopropylsulfanyl-4H-1,2,4-benzothiadiazine 1,1-dioxide, C~10~H~11~ClN~2~O~2~S~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 467-468 |
| 8101834 | CIF | C7 H12 N8 S2 | P c a b | 9.1455; 14.113; 18.998 90; 90; 90 | 2452.1 | Dou, Y.-L.; Zhang, G.-F.; Lei, Y.-J.; Fan, X.-Z. Crystal structure of 1,3-bis(1-methyl-1H-tetrazol-5-ylthio)propane, C~3~H~6~(SCN~4~CH~3~)~2~ Zeitschrift für Kristallographie - New Crystal Structures, 2005, 220, 485-486 |
| 9000567 | CIF | Cu5 H2 O14 Si4 | P c a b | 9.885; 19.832; 5.3825 90; 90; 90 | 1055.18 | Evans, H. T.; Mrose, M. E. The crystal chemistry of the hydrous copper silicates, shattuckite and plancheite Note: sample is from Ajo, Arizona American Mineralogist, 1977, 62, 491-502 |
| 9001109 | CIF | As6 Ca2.121 Fe H4 Mn5 Na0.73 O26 | P c a b | 12.855; 13.487; 12.047 90; 90; 90 | 2088.65 | Bianchi, R.; Pilati, T.; Mannucci, G. Crystal structure of grischunite American Mineralogist, 1987, 72, 1225-1229 |
| 9002249 | CIF | Al0.09 Ca1.03 Fe0.94 H2 Mg0.44 Mn1.89 Na0.1 O13 P3 Zn0.02 | P c a b | 12.559; 12.834; 11.714 90; 90; 90 | 1888.09 | Galliski, M. A.; Cooper, M. A.; Hawthorne, F. C.; Cerny, P. Bederite, a new pegmatite phosphate mineral from Nevados de Palermo, Argentina: Description and crystal structure American Mineralogist, 1999, 84, 1674-1679 |
| 9004455 | CIF | Al0.18 Ca2 Fe4.24 H4 Mg0.96 Mn0.6 Na O26 P6 | P c a b | 12.524; 12.907; 11.646 90; 90; 90 | 1882.54 | Cooper, M. A.; Hawthorne, F. C. The crystal structure of wicksite The Canadian Mineralogist, 1997, 35, 777-784 |
| 9007520 | CIF | Mn2 O3 | P c a b | 9.4157; 9.4233; 9.4047 90; 90; 90 | 834.45 | Geller, S. Structures of alpha-Mn203, (MnO.983Fe0.017)203 and (Mn0.37Fe0.63)2O3 and relation to magnetic ordering Acta Crystallographica, Section B, 1971, 27, 821-828 |
| 9008275 | CIF | Ge3 O7 Pb | P c a b | 5.27; 14.097; 16.059 90; 90; 90 | 1193.04 | Otto, H. H. Die kristallstruktur von PbGe3O7 mit Ge4+ in trigonal-dipyramidaler neben tetraedrischer koordination Zeitschrift fur Kristallographie, 1979, 149, 197-205 |
| 9009149 | CIF | Cl H O Zn | P c a b | 5.86; 6.58; 11.33 90; 90; 90 | 436.871 | Wyckoff R W G Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 282-287 |
| 9009150 | CIF | Br Co H O | P c a b | 5.903; 6.7; 11.86 90; 90; 90 | 469.064 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 282-287 |
| 9009309 | CIF | Ca0.5 H2 Mn0.5 Na4 O16 Si6 | P c a b | 10.213; 15.878; 9.058 90; 90; 90 | 1468.86 | Johnsen, O.; Leonardsen, E. S.; Falth, L.; Annehed, H. Crystal structure of kvanefjeldite: The introduction of [Si3O7OH] layers with eight-membered rings Neues Jahrbuch fur Mineralogie, Monatshefte, 1983, 1983, 505-512 |
| 9009709 | CIF | Al F H10 O9 S | P c a b | 11.181; 13.048; 10.885 90; 90; 90 | 1588.01 | Bachet, B.; Cesbron, F.; Chevalier, R. Structure cristalline de la khademite Al(SO4)F*5H2O Bulletin de Mineralogie, 1981, 104, 19-22 |
| 9011544 | CIF | Br H O Zn | P c a b | 5.903; 6.7; 11.86 90; 90; 90 | 469.064 | Wyckoff, R. W. G. Second edition. Interscience Publishers, New York, New York Crystal Structures, 1963, 1, 282-287 |
| 9016581 | CIF | As Fe H4 O6 | P c a b | 8.937; 10.278; 9.996 90; 90; 90 | 918.177 | Hawthorne, F. C. The hydrogen positions in scorodite Acta Crystallographica, Section B, 1976, 32, 2891-2892 |
| 9017711 | CIF | Ca2 Fe2.52 H4 Mg1.56 Mn1.92 Na0.9 O26 P6 | P c a b | 12.526; 12.914; 11.664 90; 90; 90 | 1886.78 | Pieczka, A.; Hawthorne, F. C.; Golebiowska, B.; Wlodek, A.; Grochowina, A. Maneckiite, ideally NaCa2Fe2+2(Fe3+Mg)Mn2(PO4)6(H2O)2, a new phosphate mineral of the wicksite supergroup from the Michalkowa pegmatite, Gory Sowie Block, southwestern Poland Mineralogical Magazine, 2017, 81, 723-736 |
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