Crystallography Open Database

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Searching space group like 'P 43 3 2'

COD ID: 1007066
CIF file Formula: - Li2 Mn3 O8 Zn -
Comments: Joubert, J C; Durif, A Etude de deux types d'ordre dans le spinelle Mn~3~ Li~2~ Zn O~8~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 258 (1964) 4482-4485
Space group: P 43 3 2
Cell volume: 550
Cell parameters: 8.193; 8.193; 8.193; 90; 90; 90;  

COD ID: 1007069
CIF file Formula: - Ge3 Li2 O8 Zn -
Comments: Durif, A; Joubert, J C Etude de deux germanates spinelles. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 2471-2473
Space group: P 43 3 2
Cell volume: 549.4
Cell parameters: 8.19; 8.19; 8.19; 90; 90; 90;  

COD ID: 1007070
CIF file Formula: - Co Ge3 Li2 O8 -
Comments: Durif, A; Joubert, J C Etude de deux germanates spinelles. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 2471-2473
Space group: P 43 3 2
Cell volume: 552.2
Cell parameters: 8.204; 8.204; 8.204; 90; 90; 90;  

COD ID: 1007185
CIF file Formula: - Ga5 Li O8 -
Comments: Joubert, J; Brunel, M; Waintal, A; Durif, A Etude cristallographique du gallate de lithium et de sa solution solide avec l`aluminate Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 256 (1963) 5324-5326
Space group: P 43 3 2
Cell volume: 552
Cell parameters: 8.203; 8.203; 8.203; 90; 90; 90;  

COD ID: 1007256
CIF file Formula: - Ge3 O8 Zn2 -
Comments: Joubert, J C; Durif, A Preparation de spinelles lacunaires par reaction d'echange a l'etat solide. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 256 (1963) 4403-4405
Space group: P 43 3 2
Cell volume: 554
Cell parameters: 8.213; 8.213; 8.213; 90; 90; 90;  

COD ID: 1509080
CIF file Formula: - Ag0.25 Hf3 Li5 S8 -
Comments: Ishii, M.; Wada, H.; Sakamaki, K. Electrochemical and structural characterization of silver hafnium sulfide cathodes Solid State Ionics 136 (2000) 469-472
Space group: P 43 3 2
Cell volume: 1133.42
Cell parameters: 10.4263; 10.4263; 10.4263; 90; 90; 90;  

COD ID: 1509875
CIF file Formula: - Ag4 Hf3 S8 -
Comments: Amiel, O.; Wada, H. Crystal structure and conductivity of the new superionic conductor Ag4 Hf3 S8 Journal of Solid State Chemistry 115 (1995) 112-119
Space group: P 43 3 2
Cell volume: 1296.85
Cell parameters: 10.9051; 10.9051; 10.9051; 90; 90; 90;  

COD ID: 1509877
CIF file Formula: - Ag4 I5 Rb -
Comments: Greene, P.D.; Bradley, J.N. Relationship of Structure and Ionic Mobility in Solid M Ag4 I5 Transactions of the Faraday Society 63 (1967) 2516-2521
Space group: P 43 3 2
Cell volume: 1401.17
Cell parameters: 11.19; 11.19; 11.19; 90; 90; 90;  

COD ID: 1509887
CIF file Formula: - Ag4 Mn3 O8 -
Comments: Jansen, M.; Ahlert, S.; Dinnebier, R. The crystal structures of the high temperature phases of Ag4 Mn3 O8 Zeitschrift fuer Anorganische und Allgemeine Chemie 631 (2005) 90-98
Space group: P 43 3 2
Cell volume: 719.314
Cell parameters: 8.95996; 8.95996; 8.95996; 90; 90; 90;  

COD ID: 1509891
CIF file Formula: - Ag4.021 S8 Zr3 -
Comments: Amiel, O.; Wada, H.; Frankel, D.C. Crystal structure and conductivity of the new superionic conductors Ag4 Zr3 S8 and Ag3.8 Sn3 S8 Journal of Solid State Chemistry 116 (1995) 409-421
Space group: P 43 3 2
Cell volume: 1310.31
Cell parameters: 10.9427; 10.9427; 10.9427; 90; 90; 90;  

COD ID: 1511224
CIF file Formula: - B Li2 Pd3 -
Comments: Eibenstein, U.; Jung, W. Li2 Pd3 B and Li2 Pt3 B; ternary lithium borides of palladium and platinum with boron in octahedral coordination Journal of Solid State Chemistry 133 (1997) 21-24
Space group: P 43 3 2
Cell volume: 308.012
Cell parameters: 6.7534; 6.7534; 6.7534; 90; 90; 90;  

COD ID: 1511225
CIF file Formula: - B Li2 Pt3 -
Comments: Jung, W.; Eibenstein, U. Li2 Pd3 B and Li2 Pt3 B; ternary lithium borides of palladium and platinum with boron in octahedral coordination Journal of Solid State Chemistry 133 (1997) 21-24
Space group: P 43 3 2
Cell volume: 308.258
Cell parameters: 6.7552; 6.7552; 6.7552; 90; 90; 90;  

COD ID: 1514018
CIF file Formula: - Li1.09 Mn1.96 O4 -
Comments: Woodley, S. M.; Catlow, C. R. A.; Piszora, P.; Stempin, K.; Wolska, E. Computer modeling study of the lithium ion distribution in quaternary Li- Mn - Fe - O spinels Journal of Solid State Chemistry 153 (2000) 310-316
Space group: P 43 3 2
Cell volume: 554.683
Cell parameters: 8.2164; 8.2164; 8.2164; 90; 90; 90;  

COD ID: 1521402
CIF file Formula: - Ba6 Ge23.32 Sn1.68 -
Comments: Kim, S.-J.; Hu, S.-Q.; Corbett, J.D.; Hogan, T.; Uher, C.; Huang, B.-Q.; Kanatzidis, M.G. Structure and thermoelectric properties of Ba6 Ge25-x, Ba6 Ge23 Sn2, and Ba6 Ge22 In3: Zintl phases with a chiral clathrate structure Journal of Solid State Chemistry 153 (2000) 321-329
Space group: P 43 3 2
Cell volume: 3181.26
Cell parameters: 14.7073; 14.7073; 14.7073; 90; 90; 90;  

COD ID: 1521403
CIF file Formula: - Ba6 Ge21.94 In3.06 -
Comments: Kim, S.-J.; Hu, S.-Q.; Uher, C.; Hogan, T.; Huang, B.-Q.; Corbett, J.D.; Kanatzidis, M.G. Structure and thermoelectric properties of Ba6 Ge25-x, Ba6 Ge23 Sn2, and Ba6 Ge22 In3: Zintl phases with a chiral clathrate structure Journal of Solid State Chemistry 153 (2000) 321-329
Space group: P 43 3 2
Cell volume: 3203.11
Cell parameters: 14.7409; 14.7409; 14.7409; 90; 90; 90;  

COD ID: 1523595
CIF file Formula: - Al5 Li O8 -
Comments: Famery, R.; Herpin, P.; Queyroux, F.; Gilles, J.C. Etude structurale de la forme ordonnee de Li Al5 O8 Journal of Solid State Chemistry 30 (1979) 257-263
Space group: P 43 3 2
Cell volume: 494.538
Cell parameters: 7.908; 7.908; 7.908; 90; 90; 90;  

COD ID: 1528326
CIF file Formula: - Fe0.5 Li O4 Ti1.5 -
Comments: Avdeev, G.; Petrov, K.; Mitov, I. X-ray diffraction and Moessbauer spectroscopy studies of Li Fe0.5 Ti1.5 O4 - a new primitive cubic ordered spinel Solid State Sciences 9 (2007) 1135-1139
Space group: P 43 3 2
Cell volume: 593.721
Cell parameters: 8.4048; 8.4048; 8.4048; 90; 90; 90;  

COD ID: 1528613
CIF file Formula: - Co Li2 O8 Ti3 -
Comments: Joubert, J.C.; Durif-Varambon, A. Etude cristallographique de trois titanates du type spinelle Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977) 86 (1963) 92-92
Space group: P 43 3 2
Cell volume: 587.849
Cell parameters: 8.377; 8.377; 8.377; 90; 90; 90;  

COD ID: 1531078
CIF file Formula: - Fe4.79 Li0.8 Mg0.4 O8 -
Comments: Antic, B.; Kacarevic-Popovic, Z.; Rodic, D.; Nikolic, A.S.; Karanovic, Lj. The change of crystal symmetry and cation ordering in Li - Mg ferrites Journal of Alloys Compd. 336 (2002) 286-291
Space group: P 43 3 2
Cell volume: 580.302
Cell parameters: 8.341; 8.341; 8.341; 90; 90; 90;  

COD ID: 1531079
CIF file Formula: - Fe4.84 Li0.94 Mg0.2 O8 -
Comments: Antic, B.; Nikolic, A.S.; Rodic, D.; Kacarevic-Popovic, Z.; Karanovic, Lj. The change of crystal symmetry and cation ordering in Li - Mg ferrites Journal of Alloys Compd. 336 (2002) 286-291
Space group: P 43 3 2
Cell volume: 578.905
Cell parameters: 8.3343; 8.3343; 8.3343; 90; 90; 90;  

COD ID: 1531998
CIF file Formula: - Li Mn1.476 Ni0.478 O4 -
Comments: Ooms, F.G.B.; Kelder, E.M.; Wagemaker, M.; Mulder, F.M.; van Well, A.A.; Schoonman, J. Structure determination of high-voltage Li Mgx Ni0.5-x Mn1.5 O4 spinels for Li-ion batteries Appl. Phys. A 74 (2002) S1089-S1091
Space group: P 43 3 2
Cell volume: 545.038
Cell parameters: 8.1685; 8.1685; 8.1685; 90; 90; 90;  

COD ID: 1532000
CIF file Formula: - Li Mg0.041 Mn1.544 Ni0.395 O4 -
Comments: Ooms, F.G.B.; Kelder, E.M.; van Well, A.A.; Wagemaker, M.; Mulder, F.M.; Schoonman, J. Structure determination of high-voltage Li Mgx Ni0.5-x Mn1.5 O4 spinels for Li-ion batteries Appl. Phys. A 74 (2002) S1089-S1091
Space group: P 43 3 2
Cell volume: 545.399
Cell parameters: 8.1703; 8.1703; 8.1703; 90; 90; 90;  

COD ID: 1532002
CIF file Formula: - Li Mg0.096 Mn1.34 Ni0.36 O4 -
Comments: Ooms, F.G.B.; Mulder, F.M.; Wagemaker, M.; van Well, A.A.; Schoonman, J.; Kelder, E.M. Structure determination of high-voltage Li Mgx Ni0.5-x Mn1.5 O4 spinels for Li-ion batteries Appl. Phys. A 74 (2002) S1089-S1091
Space group: P 43 3 2
Cell volume: 546
Cell parameters: 8.1733; 8.1733; 8.1733; 90; 90; 90;  

COD ID: 1532826
CIF file Formula: - Li1.96 O8 Ti3 Zn1.04 -
Comments: Camara, M.S.C.; Gama, L.; Lisboa-Filho, P.N.; Longo, E.; Cabrelon, M.D.; Ortiz, W.A.; Paiva-Santos, C.O.; Leite, E.R. Synthesis and characterization of Li2 Zn Ti3 O8 spinel using the modified polymeric precursor method Materials Chemistry and Physics 82 (2003) 68-72
Space group: P 43 3 2
Cell volume: 587.175
Cell parameters: 8.3738; 8.3738; 8.3738; 90; 90; 90;  

COD ID: 1532957
CIF file Formula: - Co1.971 Li1.362 O8 Ti2.67 -
Comments: Jovic, N.; Antic, B.; Spasojevic-de Bire, A.; Kremenovic, A.; Spasojevic, V. Cation ordering and order-disorder phase transition in Co-substituted Li4 Ti5 O12 spinels Physica Status Solidi, Sectio A: Applied Research 198 (2003) 18-28
Space group: P 43 3 2
Cell volume: 590.21
Cell parameters: 8.3882; 8.3882; 8.3882; 90; 90; 90;  

COD ID: 1532959
CIF file Formula: - Co1.041 Li1.959 O8 Ti3.001 -
Comments: Jovic, N.; Antic, B.; Kremenovic, A.; Spasojevic-de Bire, A.; Spasojevic, V. Cation ordering and order-disorder phase transition in Co-substituted Li4 Ti5 O12 spinels Physica Status Solidi, Sectio A: Applied Research 198 (2003) 18-28
Space group: P 43 3 2
Cell volume: 587.365
Cell parameters: 8.3747; 8.3747; 8.3747; 90; 90; 90;  

COD ID: 1532960
CIF file Formula: - Co0.521 Li2.299 O8 Ti3.18 -
Comments: Jovic, N.; Antic, B.; Kremenovic, A.; Spasojevic-de Bire, A.; Spasojevic, V. Cation ordering and order-disorder phase transition in Co-substituted Li4 Ti5 O12 spinels Physica Status Solidi, Sectio A: Applied Research 198 (2003) 18-28
Space group: P 43 3 2
Cell volume: 586.103
Cell parameters: 8.3687; 8.3687; 8.3687; 90; 90; 90;  

COD ID: 1533788
CIF file Formula: - Li1.06 Mn1.5 Ni0.44 O4 -
Comments: Strobel, P.; Ibarra-Palos, A.; Anne, M.; Poinsignon, C.; Crisci, A. Cation ordering in Li2 Mn3 M O8 spinels: structural and vibration spectroscopy studies Solid State Sciences 5 (2003) 1009-1018
Space group: P 43 3 2
Cell volume: 544.678
Cell parameters: 8.1667; 8.1667; 8.1667; 90; 90; 90;  

COD ID: 1533791
CIF file Formula: - Cu0.33 Li1.17 Mn1.5 O4 -
Comments: Strobel, P.; Ibarra-Palos, A.; Crisci, A.; Poinsignon, C.; Anne, M. Cation ordering in Li2 Mn3 M O8 spinels: structural and vibration spectroscopy studies Solid State Sciences 5 (2003) 1009-1018
Space group: P 43 3 2
Cell volume: 549.112
Cell parameters: 8.1888; 8.1888; 8.1888; 90; 90; 90;  

COD ID: 1536066
CIF file Formula: - K3 N9 Nd2 O27 -
Comments: Vigdorchik, A.G.; Malinovskii, Yu.A.; Dryuchko, A.G.; Verin, I.A. Low-temperature X-ray investigation of potassium-neodymium nitratesK3(Nd2(NO3)9) and K2(Nd(NO3)5(H2O)2). Kristallografiya 37 (1992) 882-888
Space group: P 43 3 2
Cell volume: 2446.19
Cell parameters: 13.474; 13.474; 13.474; 90; 90; 90;  

COD ID: 1536083
CIF file Formula: - Si2 Sr -
Comments: Evers, J. Transformation of three-dimensional three-connected silicon nets in Sr Si2 Journal of Solid State Chemistry 24 (1978) 199-207
Space group: P 43 3 2
Cell volume: 279.085
Cell parameters: 6.535; 6.535; 6.535; 90; 90; 90;  

COD ID: 1541958
CIF file Formula: - Fe5 Li O8 -
Comments: Braun, P.B. A superstructure in spinels Nature (London) 170 (1952) 1123-1123
Space group: P 43 3 2
Cell volume: 578.01
Cell parameters: 8.33; 8.33; 8.33; 90; 90; 90;  

COD ID: 1544335
CIF file Formula: - Fe5 Li O8 -
Comments: Marin, S.J.; O'Keeffe, M.; Partin, D.E. Structures and crystal chemistry of ordered spinels: LiFe5O8, LiZnNbO4, and Zn2TiO4 Journal of Solid State Chemistry 113 (1994) 413-419
Space group: P 43 3 2
Cell volume: 575.827
Cell parameters: 8.3195; 8.3195; 8.3195; 90; 90; 90;  

COD ID: 1545068
CIF file Formula: - Ge3 Li2 Ni O8 -
Comments: Hirota, K.; Ohtani, M.; Mochida, N.; Ohtsuka, A. Formation and structure of spinel solid solution in Li2O-MO-GeO2 (M=Zn,Co,Ni) system Journal of the Ceramic Society of Japan 96 (1988) 92-96
Space group: P 43 3 2
Cell volume: 547.544
Cell parameters: 8.181; 8.181; 8.181; 90; 90; 90;  

COD ID: 1545069
CIF file Formula: - Ge3 Li2 O8 Zn -
Comments: Hirota, K.; Ohtani, M.; Mochida, N.; Ohtsuka, A. Formation and structure of spinel solid solution in Li2O-MO-GeO2 (M=Zn,Co,Ni) system Journal of the Ceramic Society of Japan 96 (1988) 92-96
Space group: P 43 3 2
Cell volume: 549.957
Cell parameters: 8.193; 8.193; 8.193; 90; 90; 90;  

COD ID: 1545070
CIF file Formula: - Co Ge3 Li2 O8 -
Comments: Hirota, K.; Ohtani, M.; Mochida, N.; Ohtsuka, A. Formation and structure of spinel solid solution in Li2O-MO-GeO2 (M=Zn,Co,Ni) system Journal of the Ceramic Society of Japan 96 (1988) 92-96
Space group: P 43 3 2
Cell volume: 552.175
Cell parameters: 8.204; 8.204; 8.204; 90; 90; 90;  

COD ID: 1546015
CIF file Formula: - C36 H24 B0.5 Br5.5 F8 -
Comments: Cavallo, Gabriella; Murray, Jane S.; Politzer, Peter; Pilati, Tullio; Ursini, Maurizio; Resnati, Giuseppe Halogen bonding in hypervalent iodine and bromine derivatives: halonium salts IUCrJ 4(4) (2017)
Space group: P 43 3 2
Cell volume: 3669.9
Cell parameters: 15.4248; 15.4248; 15.4248; 90; 90; 90;  

COD ID: 1557462
CIF file Formula: - Ga5 Li O8 -
Comments: Ahman, Johan; Svensson, Goran; Albertsson, Jorgen Structure of LiGa5O8 Acta Chemica Scandinavica 50 (1996) 391-394
Space group: P 43 3 2
Cell volume: 551.83
Cell parameters: 8.2023; 8.2023; 8.2023; 90; 90; 90;  

COD ID: 1560614
CIF file Formula: - Fe0.801 Li2.403 O8 Ti2.799 -
Comments: Mukai, Kazuhiko; Kato, Yuichi; Nakano, Hideyuki Determination of cation distribution in the Fe[Li 1/2 Fe 3/2 ]O 4 −LiFeTiO 4 −Li[Li 1/3 Ti 5/3 ]O 4 system: Mixed nature of solid solution and superlattice Journal of Solid State Chemistry 247 (2017) 67-76
Space group: P 43 3 2
Cell volume: 582.21
Cell parameters: 8.35013; 8.35013; 8.35013; 90; 90; 90;  

COD ID: 1562753
CIF file Formula: - C65 I8 Sn2 -
Comments: Straus, Daniel B.; Cava, Robert J. Generalizing the Chiral Self-Assembly of Spheres and Tetrahedra to Non-Spherical and Polydisperse Molecules in (C70)x(C60)1‒x(SnI4)2 Nano Letters (2021)
Space group: P 43 3 2
Cell volume: 4806.5
Cell parameters: 16.8763; 16.8763; 16.8763; 90; 90; 90;  

COD ID: 1562754
CIF file Formula: - C62.5 I8 Sn2 -
Comments: Straus, Daniel B.; Cava, Robert J. Generalizing the Chiral Self-Assembly of Spheres and Tetrahedra to Non-Spherical and Polydisperse Molecules in (C70)x(C60)1‒x(SnI4)2 Nano Letters (2021)
Space group: P 43 3 2
Cell volume: 4690.2
Cell parameters: 16.739; 16.739; 16.739; 90; 90; 90;  

COD ID: 1562755
CIF file Formula: - C67.5 I8 Sn2 -
Comments: Straus, Daniel B.; Cava, Robert J. Generalizing the Chiral Self-Assembly of Spheres and Tetrahedra to Non-Spherical and Polydisperse Molecules in (C70)x(C60)1‒x(SnI4)2 Nano Letters (2021)
Space group: P 43 3 2
Cell volume: 4940.1
Cell parameters: 17.0312; 17.0312; 17.0312; 90; 90; 90;  

COD ID: 2107402
CIF file Formula: - Si2 Sr -
Comments: Pringle, G.E. The structure of Sr Si2: a crystal of class O (432) Acta Crystallographica B (24,1968-38,1982) 28 (1972) 2326-2328
Space group: P 43 3 2
Cell volume: 276.531
Cell parameters: 6.515; 6.515; 6.515; 90; 90; 90;  

COD ID: 2300617
CIF file

Original IUCr paper

 Formula: - Fe2 O3 -
Comments: Solano, Eduardo; Frontera, Carlos; Puig, Teresa; Obradors, Xavier; Ricart, Susagna; Ros, Josep Neutron and X-ray diffraction study of ferrite nanocrystals obtained by microwave-assisted growth. A structural comparison with the thermal synthetic route Journal of Applied Crystallography 47(1) (2014) 414-420
Space group: P 43 3 2
Cell volume: 579.34
Cell parameters: 8.3364; 8.3364; 8.3364; 90; 90; 90;  

COD ID: 2312024
CIF file

HKL data

Original IUCr paper

 Formula: - C12 Fe2 Na O24 Rb5 -
Comments: Piro, O. E.; Echeverría, G A; Baran, E. J. Spontaneous enanti-omorphism in poly-phased alkaline salts of tris-(oxalato)ferrate(III): crystal structure of cubic NaRb<sub>5</sub>[Fe(C<sub>2</sub>O<sub>4</sub>)<sub>3</sub>]<sub>2</sub>. Acta crystallographica. Section E, Crystallographic communications 74(Pt 7) (2018) 905-909
Space group: P 43 3 2
Cell volume: 2631.39
Cell parameters: 13.8058; 13.8058; 13.8058; 90; 90; 90;  

COD ID: 4000789
CIF file Formula: - Ge3 Li2.03 Ni O8 -
Comments: Reeves-McLaren, Nik; Smith, Ronald I.; West, Anthony R. Lithium-Ion Conduction Pathways in Complex Lithium Spinels Li2MGe3O8(M = Ni or Zn) Chemistry of Materials 23(15) (2011) 3556
Space group: P 43 3 2
Cell volume: 566.693
Cell parameters: 8.27528; 8.27528; 8.27528; 90; 90; 90;  

COD ID: 4000790
CIF file Formula: - Ge3 Li2 Ni O8 -
Comments: Reeves-McLaren, Nik; Smith, Ronald I.; West, Anthony R. Lithium-Ion Conduction Pathways in Complex Lithium Spinels Li2MGe3O8(M = Ni or Zn) Chemistry of Materials 23(15) (2011) 3556
Space group: P 43 3 2
Cell volume: 551.067
Cell parameters: 8.19851; 8.19851; 8.19851; 90; 90; 90;  

COD ID: 4000791
CIF file Formula: - Ge3 Li1.99 O8 Zn -
Comments: Reeves-McLaren, Nik; Smith, Ronald I.; West, Anthony R. Lithium-Ion Conduction Pathways in Complex Lithium Spinels Li2MGe3O8(M = Ni or Zn) Chemistry of Materials 23(15) (2011) 3556
Space group: P 43 3 2
Cell volume: 569.358
Cell parameters: 8.28823; 8.28823; 8.28823; 90; 90; 90;  

COD ID: 4002456
CIF file Formula: - Li2 Mg1.001 Mn2.999 O8 -
Comments: Branford, W.; Green, M.A.; Neumann, D.A. Structure and ferromagnetism in Mn(4+) spinels: A M0.5 Mn1.5 O4 (A = Li, Cu; M = Ni, Mg) Chemistry of Materials (1,1989-) 14 (2002) 1649-1656
Space group: P 43 3 2
Cell volume: 548.794
Cell parameters: 8.18722; 8.18722; 8.18722; 90; 90; 90;  

COD ID: 4002457
CIF file Formula: - Cu2 Mg1.001 Mn2.999 O8 -
Comments: Branford, W.; Green, M.A.; Neumann, D.A. Structure and ferromagnetism in Mn(4+) spinels: A M0.5 Mn1.5 O4 (A = Li, Cu; M = Ni, Mg) Chemistry of Materials (1,1989-) 14 (2002) 1649-1656
Space group: P 43 3 2
Cell volume: 568.032
Cell parameters: 8.28179; 8.28179; 8.28179; 90; 90; 90;  

COD ID: 4030603
CIF file Formula: - N9 O27 Pr2 Rb3 -
Comments: Manek, E.; Meyer, G. Ternary rubidium rare-earth nitrates: Rb3[M2(NO3)9] (M = La, Pr-Sm) and Rb2[M(NO3)5] (M = Eu-Lu, Y) European Journal of Solid State and Inorganic Chemistry 30 (1993) 883-894
Space group: P 43 3 2
Cell volume: 2635.5
Cell parameters: 13.813; 13.813; 13.813; 90; 90; 90;  

COD ID: 4031549
CIF file Formula: - Fe0.58 Li1.14 O4 Ti1.28 -
Comments: Arillo, M.A.; Martinez, J.L.; Lopez, M.L.; Pico, C.; Veiga, M.L.; Campo, J.; Santrich-Badal, A. Order - disorder transitions and magnetic behaviour in lithium ferrites Li0.5+0.5x Fe2.5-1.5x Tix O4 (x=1.28 and 1.50) European Journal of Inorganic Chemistry 2003 (2003) 2397-2405
Space group: P 43 3 2
Cell volume: 586.902
Cell parameters: 8.3725; 8.3725; 8.3725; 90; 90; 90;  

COD ID: 4031550
CIF file Formula: - Fe0.25 Li1.25 O4 Ti1.5 -
Comments: Arillo, M.A.; Martinez, J.L.; Lopez, M.L.; Pico, C.; Campo, J.; Veiga, M.L.; Santrich-Badal, A. Order - disorder transitions and magnetic behaviour in lithium ferrites Li0.5+0.5x Fe2.5-1.5x Tix O4 (x=1.28 and 1.50) European Journal of Inorganic Chemistry 2003 (2003) 2397-2405
Space group: P 43 3 2
Cell volume: 583.208
Cell parameters: 8.3549; 8.3549; 8.3549; 90; 90; 90;  

COD ID: 4113070
CIF file Formula: - Li0.25 Mg0.03 Mn0.39 Ni0.09 O -
Comments: Marnix Wagemaker; Frans G. B. Ooms; Erik M. Kelder; Joop Schoonman; Fokko M. Mulder Extensive Migration of Ni and Mn by Lithiation of Ordered LiMg0.1Ni0.4Mn1.5O4 Spinel Journal of the American Chemical Society 126 (2004) 13526-13533
Space group: P 43 3 2
Cell volume: 542.759
Cell parameters: 8.1571; 8.1571; 8.1571; 90; 90; 90;  

COD ID: 4128771
CIF file Formula: - C16 H16 Cu N10 O4 -
Comments: Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society 141(36) (2019) 14306-14316
Space group: P 43 3 2
Cell volume: 8318.5
Cell parameters: 20.262; 20.262; 20.262; 90; 90; 90;  

COD ID: 4128772
CIF file Formula: - C8 H15 Cu0.5 N5 O5.5 -
Comments: Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society 141(36) (2019) 14306-14316
Space group: P 43 3 2
Cell volume: 8145
Cell parameters: 20.12; 20.12; 20.12; 90; 90; 90;  

COD ID: 4128773
CIF file Formula: - C16 H25.33 Cu N10 O8.67 -
Comments: Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society 141(36) (2019) 14306-14316
Space group: P 43 3 2
Cell volume: 8208.2
Cell parameters: 20.172; 20.172; 20.172; 90; 90; 90;  

COD ID: 4128774
CIF file Formula: - C16 H28.67 Cu N10 O9.67 -
Comments: Corella-Ochoa, M Nieves; Tapia, Jesús B; Rubin, Heather N.; Lillo, Vanesa; González-Cobos, Jesús; Núñez-Rico, José Luis; Balestra, Salvador R. G.; Almora-Barrios, Neyvis; Lledós, Marina; Güell-Bara, Arnau; Cabezas-Giménez, Juanjo; Escudero-Adán, Eduardo C; Vidal-Ferran, Anton; Calero, Sofía; Reynolds, Melissa; Martí-Gastaldo, Carlos; Galán-Mascarós, José Ramón Homochiral Metal-Organic Frameworks for Enantioselective Separations in Liquid Chromatography. Journal of the American Chemical Society 141(36) (2019) 14306-14316
Space group: P 43 3 2
Cell volume: 8136.7
Cell parameters: 20.1133; 20.1133; 20.1133; 90; 90; 90;  

COD ID: 4308024
CIF file Formula: - C48 H28 N6 O14 Zn3 -
Comments: Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity Inorganic Chemistry 46 (2007) 2725-2734
Space group: P 43 3 2
Cell volume: 16845.9
Cell parameters: 25.6349; 25.6349; 25.6349; 90; 90; 90;  

COD ID: 4308026
CIF file Formula: - C48 H28 Cd3 N6 O14 -
Comments: Daofeng Sun; Yanxiong Ke; David J. Collins; Gary A. Lorigan; Hong-Cai Zhou Construction of Robust Open Metal-Organic Frameworks with Chiral Channels and Permanent Porosity Inorganic Chemistry 46 (2007) 2725-2734
Space group: P 43 3 2
Cell volume: 17578
Cell parameters: 26.001; 26.001; 26.001; 90; 90; 90;  

COD ID: 4317426
CIF file Formula: - C39 H36 Ag2 Cl2 O8 S6 -
Comments: Xian-He Bu; Wei Chen; Miao Du; Kumar Biradha; Wen-Zhen Wang; Ruo-Hua Zhang Chiral Noninterpenetrated (10,3)-a Net in the Crystal Structure of Ag(I) and Bisthioether Inorganic Chemistry 41 (2002) 437-439
Space group: P 43 3 2
Cell volume: 5222.7
Cell parameters: 17.35; 17.35; 17.35; 90; 90; 90;  

COD ID: 4327693
CIF file Formula: - C42 H81 Co N6 Sn3 -
Comments: Tianyan Niu; Jian Lu; Xiqu Wang; James D. Korp; Allan J. Jacobson Syntheses and Structural Characterizations of Two Three-Dimensional Polymers: [{(n-C4H9)3Sn}3M(CN)6] (M = Fe, Co) Inorganic Chemistry 37 (1998) 5324-5328
Space group: P 43 3 2
Cell volume: 5141.6
Cell parameters: 17.2597; 17.2597; 17.2597; 90; 90; 90;  

COD ID: 4340224
CIF file Formula: - C54 H28 N14 O14 Zn3 -
Comments: Ke, Yanxiong; Collins, David J.; Sun, Daofeng; Zhou, Hong-Cai (10,3)-a Noninterpenetrated network built from a Piedfort ligand pair. Inorganic chemistry 45(5) (2006) 1897-1899
Space group: P 43 3 2
Cell volume: 25665
Cell parameters: 29.497; 29.497; 29.497; 90; 90; 90;  

COD ID: 4343133
CIF file Formula: - Li Mn O4 Ti -
Comments: Murphy, Denissa T.; Schmid, Siegbert; Hester, James R.; Blanchard, Peter E. R.; Miiller, Wojciech Coordination Site Disorder in Spinel-Type LiMnTiO4. Inorganic chemistry 54(10) (2015) 4636-4643
Space group: P 43 3 2
Cell volume: 594.34
Cell parameters: 8.4077; 8.4077; 8.4077; 90; 90; 90;  

COD ID: 4343135
CIF file Formula: - Li Mn O4 Ti -
Comments: Murphy, Denissa T.; Schmid, Siegbert; Hester, James R.; Blanchard, Peter E. R.; Miiller, Wojciech Coordination Site Disorder in Spinel-Type LiMnTiO4. Inorganic chemistry 54(10) (2015) 4636-4643
Space group: P 43 3 2
Cell volume: 594.738
Cell parameters: 8.4096; 8.4096; 8.4096; 90; 90; 90;  

COD ID: 4343706
CIF file Formula: - K3 N9 O27 Pr2 -
Comments: Carnall, W.T.; Siegel, S.; Ferraro, J.R.; Tani, B.S.; Gebert, E. A new series of anhydrous double nitrate salts of the lanthanides. Structural and spectral characterization Inorganic Chemistry 12 (1973) 560-564
Space group: P 43 3 2
Cell volume: 2471.33
Cell parameters: 13.52; 13.52; 13.52; 90; 90; 90;  

COD ID: 4512659
CIF file Formula: - C30 H30 B2 Cu2 F8 N12 -
Comments: Ferguson, Jayne L.; Fitchett, Christopher M. N,N′-Dimethylene-2,2′-biimidazole—A Mimic of Carboxylate for the Formation of Complexes with Copper(I) And the Anion Directed Formation of a Solvent Pocket Crystal Growth & Design 15(3) (2015) 1280
Space group: P 43 3 2
Cell volume: 3429.2
Cell parameters: 15.0798; 15.0798; 15.0798; 90; 90; 90;  

COD ID: 4512661
CIF file Formula: - C30 H30 Cu2 N14 O6 -
Comments: Ferguson, Jayne L.; Fitchett, Christopher M. N,N′-Dimethylene-2,2′-biimidazole—A Mimic of Carboxylate for the Formation of Complexes with Copper(I) And the Anion Directed Formation of a Solvent Pocket Crystal Growth & Design 15(3) (2015) 1280
Space group: P 43 3 2
Cell volume: 3307.95
Cell parameters: 14.9; 14.9; 14.9; 90; 90; 90;  

COD ID: 4512665
CIF file Formula: - C30 H30 Cl2 Cu2 N12 O8 -
Comments: Ferguson, Jayne L.; Fitchett, Christopher M. N,N′-Dimethylene-2,2′-biimidazole—A Mimic of Carboxylate for the Formation of Complexes with Copper(I) And the Anion Directed Formation of a Solvent Pocket Crystal Growth & Design 15(3) (2015) 1280
Space group: P 43 3 2
Cell volume: 3496.72
Cell parameters: 15.1782; 15.1782; 15.1782; 90; 90; 90;  

COD ID: 4515314
CIF file Formula: - C90 H51 O35 Zr6 -
Comments: Zhang, Yong-Zheng; He, Tao; Kong, Xiang-Jing; Lv, Xiu-Liang; Wu, Xue-Qian; Li, Jian-Rong Tuning Water Sorption in Highly Stable Zr(IV)-Metal-Organic Frameworks through Local Functionalization of Metal Clusters. ACS applied materials & interfaces 10(33) (2018) 27868-27874
Space group: P 43 3 2
Cell volume: 35168.3
Cell parameters: 32.763; 32.763; 32.763; 90; 90; 90;  

COD ID: 4515315
CIF file Formula: - C93 H54 O41 Zr6 -
Comments: Zhang, Yong-Zheng; He, Tao; Kong, Xiang-Jing; Lv, Xiu-Liang; Wu, Xue-Qian; Li, Jian-Rong Tuning Water Sorption in Highly Stable Zr(IV)-Metal-Organic Frameworks through Local Functionalization of Metal Clusters. ACS applied materials & interfaces 10(33) (2018) 27868-27874
Space group: P 43 3 2
Cell volume: 35437.2
Cell parameters: 32.8463; 32.8463; 32.8463; 90; 90; 90;  

COD ID: 4515316
CIF file Formula: - C102 H54 O35 Zr6 -
Comments: Zhang, Yong-Zheng; He, Tao; Kong, Xiang-Jing; Lv, Xiu-Liang; Wu, Xue-Qian; Li, Jian-Rong Tuning Water Sorption in Highly Stable Zr(IV)-Metal-Organic Frameworks through Local Functionalization of Metal Clusters. ACS applied materials & interfaces 10(33) (2018) 27868-27874
Space group: P 43 3 2
Cell volume: 35556.4
Cell parameters: 32.8831; 32.8831; 32.8831; 90; 90; 90;  

COD ID: 4515317
CIF file Formula: - C96 H60 O35 Zr6 -
Comments: Zhang, Yong-Zheng; He, Tao; Kong, Xiang-Jing; Lv, Xiu-Liang; Wu, Xue-Qian; Li, Jian-Rong Tuning Water Sorption in Highly Stable Zr(IV)-Metal-Organic Frameworks through Local Functionalization of Metal Clusters. ACS applied materials & interfaces 10(33) (2018) 27868-27874
Space group: P 43 3 2
Cell volume: 35684.4
Cell parameters: 32.9225; 32.9225; 32.9225; 90; 90; 90;  

COD ID: 4515318
CIF file Formula: - C93 H54 O35 Zr6 -
Comments: Zhang, Yong-Zheng; He, Tao; Kong, Xiang-Jing; Lv, Xiu-Liang; Wu, Xue-Qian; Li, Jian-Rong Tuning Water Sorption in Highly Stable Zr(IV)-Metal-Organic Frameworks through Local Functionalization of Metal Clusters. ACS applied materials & interfaces 10(33) (2018) 27868-27874
Space group: P 43 3 2
Cell volume: 34873
Cell parameters: 32.67104; 32.67104; 32.67104; 90; 90; 90;  

COD ID: 6000362
CIF file Formula: - Ag4 Hf3 S8 -
Comments: Wada, H.; Amiel, O.; Takenouchi, S. Insertion of lithium into Ag~4~Hf~3~S~8~ and Ag~2~HfS~3~ by n-BuLi and its structural change Solid State Ionics 115 (1998) 487-491
Space group: P 43 3 2
Cell volume: 1295.56
Cell parameters: 10.9015; 10.9015; 10.9015; 90; 90; 90;  

COD ID: 6000363
CIF file Formula: - Ag2 Hf3 Li5 S8 -
Comments: Wada, H.; Amiel, O.; Takenouchi, S. Insertion of lithium into Ag~4~Hf~3~S~8~ and Ag~2~HfS~3~ by n-BuLi and its structural change Solid State Ionics 115 (1998) 487-491
Space group: P 43 3 2
Cell volume: 1135.51
Cell parameters: 10.4327; 10.4327; 10.4327; 90; 90; 90;  

COD ID: 7005393
CIF file Formula: - Ca12 F8 Nb16 O48 -
Comments: Françoise Le Berre; Marie-Pierre Crosnier-Lopez; Cyrille Galven; Jean-Louis Fourquet; Christophe Legein; Monique Body; Jean-Yves Buzaré Ca2+/vacancies and O2?/F? ordering in new oxyfluoride pyrochlores Li2xCa1.5?x?0.5?xM2O6F (M = Nb,Ta) for 0 ?x? 0.5 Dalton Transactions (issue 23) (2007) 2457
Space group: P 43 3 2
Cell volume: 1141.36
Cell parameters: 10.4506; 10.4506; 10.4506; 90; 90; 90;  

COD ID: 7034022
CIF file Formula: - C40 H122 Cl7 Dy6 N8 Na O87 -
Comments: Zheng, Xiu-Ying; Zhang, Han; Cao, Ling-Yun; Kong, Xiang-Jian; Long, La-Sheng; Zheng, Lan-Sun Chirality detection of two enantiomorphic 3D lanthanide coordination polymers by vibrational circular dichroism spectra. Dalton transactions (Cambridge, England : 2003) 44(12) (2015) 5299-5302
Space group: P 43 3 2
Cell volume: 44197
Cell parameters: 35.3561; 35.3561; 35.3561; 90; 90; 90;  

COD ID: 7036966
CIF file Formula: - C36 H24 Cu Mn2 N6 O13 -
Comments: Jurić, Marijana; Pajić, Damir; Žilić, Dijana; Rakvin, Boris; Molčanov, Krešimir; Popović, Jasminka Magnetic order in a novel 3D oxalate-based coordination polymer {[Cu(bpy)3][Mn2(C2O4)3]·H2O}n. Dalton transactions (Cambridge, England : 2003) 44(47) (2015) 20626-20635
Space group: P 43 3 2
Cell volume: 3805.48
Cell parameters: 15.6124; 15.6124; 15.6124; 90; 90; 90;  

COD ID: 7059842
CIF file Formula: - C21 H21 Br0.6 I1.4 Sb -
Comments: Sharutin, Vladimir V.; Sharutina, Olga K.; Novikov, Alexander S.; Adonin, Sergey A. Substituent-dependent reactivity of triarylantimony(iii) toward I2: isolation of [Ar3SbI]+ salt New Journal of Chemistry 44(34) (2020) 14339-14342
Space group: P 43 3 2
Cell volume: 2238.7
Cell parameters: 13.0818; 13.0818; 13.0818; 90; 90; 90;  

COD ID: 7104639
CIF file Formula: - C30 H54 Co5 O27 -
Comments: Livage, Carine; Guillou, Nathalie; Rabu, Pierre; Pattison, Philip; Marrot, Jérôme; Férey, Gérard Bulk homochirality of a 3-D inorganic framework: ligand control of inorganic network chirality. Chemical communications (Cambridge, England) 34(30) (2009) 4551-4553
Space group: P 43 3 2
Cell volume: 4672.21
Cell parameters: 16.7176; 16.7176; 16.7176; 90; 90; 90;  

COD ID: 7105698
CIF file Formula: - C24 H42 Cd2 Cl N12 Na3 O18 -
Comments: Qilong Zhu; Tianlu Sheng; Ruibiao Fu; Chunhong Tan; Shengmin Hu; Xintao Wu Two luminescent enantiomorphic 3D metal-organic frameworks with 3D homochiral double helices Chem.Commun. 46 (2010) 9001
Space group: P 43 3 2
Cell volume: 3932.19
Cell parameters: 15.7838; 15.7838; 15.7838; 90; 90; 90;  

COD ID: 7112752
CIF file Formula: - C6 H7 B N9 Na -
Comments: Brianna C. Hughes; Zheng Lu; David M. Jenkins The final unadorned tris(azolyl)borate: finishing what Trofimenko started in 1966 Chem.Commun. 50 (2014) 5273
Space group: P 43 3 2
Cell volume: 2272.79
Cell parameters: 13.1478; 13.1478; 13.1478; 90; 90; 90;  

COD ID: 7116177
CIF file Formula: - C48 H36 Cd3 N10 O18 -
Comments: Xu, Zhong-Xuan; Tan, Yan-Xi; Fu, Hong-Ru; Kang, Yao; Zhang, Jian Integration of rigid and flexible organic parts for the construction of a homochiral metal-organic framework with high porosity. Chemical communications (Cambridge, England) 51(13) (2015) 2565-2568
Space group: P 43 3 2
Cell volume: 25922.5
Cell parameters: 29.5955; 29.5955; 29.5955; 90; 90; 90;  

COD ID: 7125274
CIF file Formula: - C130 H130 N10 -
Comments: Qiao, Bo; Liu, Yun; Lee, Semin; Pink, Maren; Flood, Amar H. A high-yield synthesis and acid-base response of phosphate-templated [3]rotaxanes. Chemical communications (Cambridge, England) 52(94) (2016) 13675-13678
Space group: P 43 3 2
Cell volume: 50483
Cell parameters: 36.9585; 36.9585; 36.9585; 90; 90; 90;  

COD ID: 7211666
CIF file Formula: - C11 H26 N1.67 O8 S0.5 -
Comments: Das, Madhab C.; Ghosh, Sujit K.; Bharadwaj, Parimal K. Diversity of binding of sulfate and nitrate anions with laterally asymmetric aza cryptands CrystEngComm 12(2) (2010) 413
Space group: P 43 3 2
Cell volume: 10607
Cell parameters: 21.972; 21.972; 21.972; 90; 90; 90;  

COD ID: 7242177
CIF file Formula: - C2 H12 N6 O4 S -
Comments: Brummel, Beau R.; Lee, Kinsey G.; Kolis, Joseph W.; Whitehead, Daniel C.; McMillen, Colin D. Guanidinium sulfates as directors of noncentrosymmetric structures CrystEngComm 23(7) (2021) 1643-1656
Space group: P 43 3 2
Cell volume: 5665.7
Cell parameters: 17.8273; 17.8273; 17.8273; 90; 90; 90;  

COD ID: 9001114
CIF file Formula: - Fe2.18 O4 Ti0.42 -
Comments: Collyer, S.; Grimes, N. W.; Vaughan, D. J.; Longworth, G. Studies of the crystal structure and crystal chemistry of titanomaghemite American Mineralogist 73 (1988) 153-160
Space group: P 43 3 2
Cell volume: 580.302
Cell parameters: 8.341; 8.341; 8.341; 90; 90; 90;  

COD ID: 9017489
CIF file Formula: - Fe2.668 O4 -
Comments: Shmakov, A. N.; Kryukova, G. N.; Tsybulya, S. V.; Chuvilin, A. L.; Solovyeva, L. P. Vacancy ordering in gamma-Fe2O3: synchrotron x-ray powder diffraction and high- resolution electron microscopy studies Journal of Applied Crystallography 28 (1995) 141-145
Space group: P 43 3 2
Cell volume: 581.639
Cell parameters: 8.3474; 8.3474; 8.3474; 90; 90; 90;  

COD ID: 9017493
CIF file Formula: - Fe2.645 O3.99 -
Comments: Solano, E.; Frontera, C.; Puig, T.; Obradors, X.; Ricart, S.; Ros, J. Neutron and X-ray diffraction study of ferrite nanocrystals obtained by microwave-assisted growth. A structural comparison with the thermal synthetic route Journal of Applied Crystallography 47 (2014) 414-420
Space group: P 43 3 2
Cell volume: 579.343
Cell parameters: 8.3364; 8.3364; 8.3364; 90; 90; 90;  

COD ID: 9017519
CIF file Formula: - Fe2.645 O3.99 -
Comments: Shin HS A study on the structure of maghemite (gamma-Fe2O3) I. Rietveld analysis of powder XRD patterns Journal of the Korean Ceramic Society 35 (1998) 1113-1119
Space group: P 43 3 2
Cell volume: 581.284
Cell parameters: 8.3457; 8.3457; 8.3457; 90; 90; 90;  


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