Crystallography Open Database

Result : There are 25 entries in the selection

You can download the COD numbers of the selection as a text file

You can download all files as a single ZIP archive

Searching space group like 'A 1 2 1'

COD ID: 1008163
CIF file Formula: - O8 Pb3 V2 -
Comments: Garnier, P.; Calvarin, G.; Berar, J. F.; Weigel, D. Etude des Phases Ferroelastiques de Pb~3~V~2~O~8~: Determination de la Maille Cristalline de la Phase α Ferroelectrique Basse Temperature Materials Research Bulletin 19(4) (1984) 407-414
Space group: A 1 2 1
Cell volume: 385.9
Cell parameters: 7.46; 6.191; 9.348; 90; 116.63; 90;  

COD ID: 1530514
CIF file Formula: - Mo6 Na0.9 O17 -
Comments: Onoda, M.; Masuda, Y.; Sato, M. Structure determination of low-dimensional conductor sodium molybdenum purple bronze Na.9 Mo6 O17 Journal of Solid State Chemistry 69 (1987) 67-75
Space group: A 1 2 1
Cell volume: 687.101
Cell parameters: 12.983; 5.518; 9.591; 90; 89.94; 90;  

COD ID: 1530539
CIF file Formula: - H2 O10 P3 Yb -
Comments: Palkina, K.K.; Maksimova, S.I.; Kuznetsov, V.G. Structure of crystals of acid ytterbium tripolyphosphate Yb H2 P3 O10 Izvestiya Akademii Nauk SSSR, Neorganicheskie Materialy 15 (1979) 2168-2170
Space group: A 1 2 1
Cell volume: 371.786
Cell parameters: 5.617; 6.666; 10.011; 90; 97.32; 90;  

COD ID: 1533744
CIF file Formula: - Bi0.7 O6 W Yb1.3 -
Comments: Berdonosov, P.S.; Charkin, D.O.; Dolgikh, V.A.; Smith, R.I.; Stefanovich, S.Yu.; Lightfoot, P. Bi2-x Lnx W O6 : a novel layered structure type related to the Aurivillius phases Journal of Solid State Chemistry 177 (2004) 2632-2634
Space group: A 1 2 1
Cell volume: 462.452
Cell parameters: 8.107; 3.7048; 15.8379; 90; 103.548; 90;  

COD ID: 1538332
CIF file Formula: - Ge2 La3 O14 Sb Zn3 -
Comments: Maksimov, B.A.; Kasantsev, S.S.; Molchanov, V.N.; Verin, I.A.; Mill, B.V. Crystal structure and microtwinning of monoclinic La3SbZn3Ge2O14 crystals of the langasite family Kristallografiya 49 (2004) 662-667
Space group: A 1 2 1
Cell volume: 622.382
Cell parameters: 5.202; 8.312; 14.394; 90; 90.02; 90;  

COD ID: 1541844
CIF file Formula: - Ca2 H8 Mn2 O17 Si4 -
Comments: Hawthorne, F.C. The crystal structure of ruizite, a sorosilicate with an (Si4 O13) cluster TMPM. Tschermaks Mineralogische und Petrographische Mitteilungen (1979-) 33 (1984) 135-146
Space group: A 1 2 1
Cell volume: 669.117
Cell parameters: 11.974; 6.175; 9.052; 90; 91.34; 90;  

COD ID: 2012283
CIF file

HKL data

Original IUCr paper

 Formula: - C25 H27 N3 O5 -
Comments: Vijayaraghavan, Rangachari; Kumar, Pravindra; Dey, Sharmistha; Singh, Tej P. Design of peptides with α,β-dehydro residues: a dipeptide with a branched β-carbon dehydro residue at the (<i>i</i>+1) position, methyl <i>N</i>-(benzyloxycarbonyl)-α,β-didehydrovalyl-<small>L</small>-tryptophanate Acta Crystallographica Section C 57(10) (2001) 1220-1221
Space group: A 1 2 1
Cell volume: 2269.6
Cell parameters: 17.1524; 6.1439; 22.6183; 90; 107.791; 90;  

COD ID: 2103503
CIF file Formula: - Ga11 La6 O28 Ta -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 554.2
Cell parameters: 5.024; 7.98; 13.823; 90; 90; 90;  

COD ID: 2103507
CIF file Formula: - Ga11 La6 O28 Ta -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 552.7
Cell parameters: 5.021; 7.972; 13.808; 90; 90; 90;  

COD ID: 2103512
CIF file Formula: - Ga11 La6 O28 Ta -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 547.9
Cell parameters: 5.013; 7.944; 13.759; 90; 90; 90;  

COD ID: 2103517
CIF file Formula: - Ga11 La6 O28 Ta -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 536.6
Cell parameters: 4.999; 7.872; 13.635; 90; 90; 90;  

COD ID: 2103520
CIF file Formula: - Ga11 La6 Nb O28 -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 524
Cell parameters: 4.994; 7.783; 13.481; 90; 90; 90;  

COD ID: 2103524
CIF file Formula: - Ga11 La6 Nb O28 -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 511.3
Cell parameters: 4.985; 7.695; 13.328; 90; 90; 90;  

COD ID: 2103527
CIF file Formula: - Ga11 La6 Nb O28 -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La~3~Nb~0.5~Ga~5.5~O~14~ and La~3~Ta~0.5~Ga~5.5~O~14~ Acta Crystallographica Section B 58(6) (2002) 939-947
Space group: A 1 2 1
Cell volume: 507.7
Cell parameters: 4.97; 7.68; 13.302; 90; 90; 90;  

COD ID: 2106771
CIF file Formula: - Ga5.5 La3 O14 Ta0.5 -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La3 Nb0.5 Ga5.5 O14 and La3 Ta0.5 Ga5.5O14 Acta Crystallographica B (39,1983-) 58 (2002) 939-947
Space group: A 1 2 1
Cell volume: 536.566
Cell parameters: 4.999; 7.872; 13.635; 90; 90; 90;  

COD ID: 2106774
CIF file Formula: - Ga5.5 La3 Nb0.5 O14 -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La3 Nb0.5 Ga5.5 O14 and La3 Ta0.5 Ga5.5 O14 Acta Crystallographica B (39,1983-) 58 (2002) 939-947
Space group: A 1 2 1
Cell volume: 550.756
Cell parameters: 5.0236; 7.956; 13.78; 90; 90; 90;  

COD ID: 2106775
CIF file Formula: - Ga5.5 La3 Nb0.5 O14 -
Comments: Pavlovska, A.; Werner, S.; Maximov, B.; Mill, B. Pressure-induced phase transitions of piezoelectric single crystals from the langasite family: La3 Nb0.5 Ga5.5 O14 and La3 Ta0.5 Ga5.5 O14 Acta Crystallographica B (39,1983-) 58 (2002) 939-947
Space group: A 1 2 1
Cell volume: 507.032
Cell parameters: 4.984; 7.664; 13.274; 90; 90; 90;  

COD ID: 2106901
CIF file Formula: - O4 Pb2 Si -
Comments: Dent Glasser, L.S.; Howie, R.A.; Smart, R.M. The Structure of Lead 'Orthosilicate', (Pb O)2 Si O2 Acta Crystallographica B (24,1968-38,1982) 37 (1981) 303-306
Space group: A 1 2 1
Cell volume: 1792.93
Cell parameters: 19.43; 7.64; 12.24; 90; 99.33; 90;  

COD ID: 2107238
CIF file Formula: - C2 H30 Cl4 Co3 N12 Na O24 -
Comments: Weiss, J.; Siebert, H.; Wieghardt, K. Die Kristall- und Molekuelstruktur von (Co3 (N H3)8 (O H)2 (N O2)2 (C N)2) (Cl O4)3 (Na Cl O4) (H2 O)2 Acta Crystallographica B (24,1968-38,1982) 26(11) (1970) 1709-1712
Space group: A 1 2 1
Cell volume: 1524.25
Cell parameters: 14.114; 7.864; 14.843; 90; 112.3; 90;  

COD ID: 7046618
CIF file Formula: - C58 H80 Cl2 N2 O4 Ti -
Comments: Miller-Shakesby, David M; Nigam, Shubhanchi; Hughes, David L.; Lopez-Estelles, Enrique; Elsegood, Mark R. J.; Cawthorne, Christopher J.; Archibald, Stephen J.; Redshaw, Carl Synthesis, crystal structure, and cytotoxicity studies of titanacalix[4 and 8]arene complexes. Dalton transactions (Cambridge, England : 2003) 47(27) (2018) 8992-8999
Space group: A 1 2 1
Cell volume: 5571.1
Cell parameters: 17.2312; 12.162; 27.103; 90; 101.229; 90;  

COD ID: 7203868
CIF file Formula: ?
Comments: Kinbara, Kazushi; Kobayashi, Yuka; Saigo, Kazuhiko Chiral discrimination of 2-arylalkanoic acids by (1S,2R)-1-aminoindan-2-ol through the formation of a consistent columnar supramolecular hydrogen-bond network † Journal of the Chemical Society, Perkin Transactions 2 (issue 1) (2000) 111
Space group: A 1 2 1
Cell volume: 1843.1
Cell parameters: 17.045; 6.148; 17.931; 90; 101.22; 90;  

COD ID: 7238825
CIF file Formula: - C13 H9 Br N2 O2 -
Comments: Subashini, Ashokkumar; Leela, Sundararaman; Ramamurthi, Kandasamy; Arakcheeva, Alla; Stoeckli-Evans, Helen; Petříček, Vaclav; Chapuis, Gervais; Pattison, Philip; Reji, Philip Synthesis, growth and characterization of 4-bromo-4′-nitrobenzylidene aniline (BNBA): a novel nonlinear optical material with a (3+1)-dimensional incommensurately modulated structure CrystEngComm 15(13) (2013) 2474
Space group: A 1 2 1
Cell volume: 1224.83
Cell parameters: 10.6408; 16.2706; 7.5669; 90; 110.783; 90;  

COD ID: 7238826
CIF file Formula: - C13 H9 Br N2 O2 -
Comments: Subashini, Ashokkumar; Leela, Sundararaman; Ramamurthi, Kandasamy; Arakcheeva, Alla; Stoeckli-Evans, Helen; Petříček, Vaclav; Chapuis, Gervais; Pattison, Philip; Reji, Philip Synthesis, growth and characterization of 4-bromo-4′-nitrobenzylidene aniline (BNBA): a novel nonlinear optical material with a (3+1)-dimensional incommensurately modulated structure CrystEngComm 15(13) (2013) 2474
Space group: A 1 2 1
Cell volume: 1190.2
Cell parameters: 10.5217; 16.2535; 7.4403; 90; 110.709; 90;  

COD ID: 7701692
CIF file Formula: - C20 H42 Fe2 O4 P4 -
Comments: Whitmire, Kenton H.; Schipper, Desmond E. In pursuit of advanced materials from single-source precursors based on metal carbonyls. Dalton transactions (Cambridge, England : 2003) 48(7) (2019) 2248-2262
Space group: A 1 2 1
Cell volume: 2908.3
Cell parameters: 33.553; 6.68483; 22.247; 90; 144.35; 90;  

COD ID: 9013161
CIF file Formula: - Fe4 H4 K2 Mg2 Na2 O30 Si8 Ti2 -
Comments: Shi, N.; Ma, Z.; Li, G.; Yamnova, M. A.; Pushcharovsky, D. Y. Structure Refinement of Monoclinic Astrophyllite Acta Crystallographica Section B 54(2) (1998) 109-114
Space group: A 1 2 1
Cell volume: 1258.78
Cell parameters: 10.37; 23.129; 5.322; 90; 99.55; 90;  


Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.