Search results

Formula: - F0.45 Fe1.21 H0.92 O4.55 P -
Comments: Loiseau, Th; Lacorre, Ph; Calage, Y; Greneche, J M; Ferey, G Crystal structure and magnetic study of a new iron(III) phosphate, Fe~1.21~PO~4~X (X=F, OH, H~2~O), isostructural with 3MgSO~4~ . Mg(OH)~2~ . H~2~O Journal of Solid State Chemistry 105 (1993) 417-427
Space group: I 41/a m d :2
Cell volume: 350.4
Cell parameters: 5.184; 5.184; 13.04; 90; 90; 90;

COD ID: 1000356
CIF file	Formula: - H12 Mo N4 O4 Pd - Comments: Laligant, Y Crystal structure of the first palladium ammine molybdate: Pd(NH~3~)~4~(MoO~4~) European Journal of Solid State Inorganic Chemistry 30 (1993) 1017-1023 Space group: I 41/a m d :2 Cell volume: 866.2 Cell parameters: 7.4618; 7.4618; 15.5565; 90; 90; 90;

COD ID: 1000485
CIF file	Formula: - Ba Cu F7 In - Comments: de Kozak, A; Samouel, M; Renaudin, J; Ferey, G Structure of Ba Cu In F7: The interpretation beween a pyrochlor-like edge-sharing network of octahedra and a defect fluorite structure Zeitschrift fuer Kristallographie (149,1979-) 189 (1989) 77-87 Space group: I 41/a m d :2 Cell volume: 562 Cell parameters: 6.843; 6.843; 12.001; 90; 90; 90;

COD ID: 1004026
CIF file	Formula: - F1.8 H0.98 O2.2 Si0.305 Zr - Comments: Valéro, R.; Paillaud, J. L.; Durand, B.; Guth, J. L.; Chopin, T. Rietveld refinement of two fluoro-hydroxy-zircons European Journal of Solid State and Inorganic Chemistry 35(10-11) (1998) 735-743 Space group: I 41/a m d :2 Cell volume: 261.3 Cell parameters: 6.64025; 6.64025; 5.92625; 90; 90; 90;

COD ID: 1004027
CIF file	Formula: - F1.8 H1.376 O2.2 Si0.206 Zr - Comments: Valéro, R.; Paillaud, J. L.; Durand, B.; Guth, J. L.; Chopin, T. Rietveld refinement of two fluoro-hydroxy-zircons European Journal of Solid State and Inorganic Chemistry 35(10-11) (1998) 735-743 Space group: I 41/a m d :2 Cell volume: 261.1 Cell parameters: 6.64821; 6.64821; 5.90758; 90; 90; 90;

COD ID: 1004130

Formula: - Bi0.72 Eu0.28 O4 V -
Comments: Blin, J L; Lorriaux-Rubbens, A; Wallart, F; Wignacourt, J P Synthesis and structural investigation of the Eu1-x Bix V O4 scheelite phase: X-ray diffraction, Raman scattering and Eu(3+) luminescence Journal of Materials Chemistry 6(3) (1996) 385-389
Space group: I 41/a m d :2
Cell volume: 341.3
Cell parameters: 7.28296; 7.28296; 6.43407; 90; 90; 90;

COD ID: 1007117
CIF file	Formula: - As O4 Sm - Comments: Durif, A; Forrat, F Sur quelques arseniates des terres rares a structure zircon. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 245 (1957) 1636-1638 Space group: I 41/a m d :2 Cell volume: 331.8 Cell parameters: 7.2; 7.2; 6.4; 90; 90; 90;

COD ID: 1007118
CIF file	Formula: - As Gd O4 - Comments: Durif, A; Forrat, F Sur quelques arseniates des terres rares a structure zircon. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 245 (1957) 1636-1638 Space group: I 41/a m d :2 Cell volume: 323.2 Cell parameters: 7.14; 7.14; 6.34; 90; 90; 90;

COD ID: 1007119
CIF file	Formula: - As Dy O4 - Comments: Durif, A; Forrat, F Sur quelques arseniates des terres rares a structure zircon. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 245 (1957) 1636-1638 Space group: I 41/a m d :2 Cell volume: 317.4 Cell parameters: 7.09; 7.09; 6.315; 90; 90; 90;

COD ID: 1007120
CIF file	Formula: - As Er O4 - Comments: Durif, A; Forrat, F Sur quelques arseniates des terres rares a structure zircon. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 245 (1957) 1636-1638 Space group: I 41/a m d :2 Cell volume: 312.7 Cell parameters: 7.045; 7.045; 6.3; 90; 90; 90;

COD ID: 1007121
CIF file	Formula: - As O4 Yb - Comments: Durif, A; Forrat, F Sur quelques arseniates des terres rares a structure zircon. Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 245 (1957) 1636-1638 Space group: I 41/a m d :2 Cell volume: 304.9 Cell parameters: 6.99; 6.99; 6.24; 90; 90; 90;

COD ID: 1008231
CIF file	Formula: - Li O2 Y - Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137 Space group: I 41/a m d :2 Cell volume: 204 Cell parameters: 4.44; 4.44; 10.35; 90; 90; 90;

COD ID: 1008232
CIF file	Formula: - Er Li O2 - Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137 Space group: I 41/a m d :2 Cell volume: 199.3 Cell parameters: 4.42; 4.42; 10.2; 90; 90; 90;

COD ID: 1008233
CIF file	Formula: - Li O2 Tm - Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137 Space group: I 41/a m d :2 Cell volume: 197 Cell parameters: 4.405; 4.405; 10.15; 90; 90; 90;

COD ID: 1008234
CIF file	Formula: - Li O2 Yb - Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137 Space group: I 41/a m d :2 Cell volume: 193.9 Cell parameters: 4.39; 4.39; 10.06; 90; 90; 90;

COD ID: 1008235
CIF file	Formula: - Li Lu O2 - Comments: Bertaut, F; Gondrand, M Etude des combinaisons d'oxydes de terres rares et de lithium du type T Li O~2~ Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) 255 (1962) 1135-1137 Space group: I 41/a m d :2 Cell volume: 190 Cell parameters: 4.37; 4.37; 9.95; 90; 90; 90;

COD ID: 1008499
CIF file	Formula: - C1.5 Fe11 Th - Comments: Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Magnetic characterization and structural study of new ternary carbides: ThFe~11~C~x~(1.5<= x<= 2) Journal of Physics: Condensed Matter 4 (1992) 6367-6374 Space group: I 41/a m d :2 Cell volume: 688.2 Cell parameters: 10.203; 10.203; 6.611; 90; 90; 90;

COD ID: 1008500
CIF file	Formula: - C2 Fe11 Th - Comments: Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Magnetic characterization and structural study of new ternary carbides: ThFe~11~C~x~(1.5<= x<= 2) Journal of Physics: Condensed Matter 4 (1992) 6367-6374 Space group: I 41/a m d :2 Cell volume: 698.4 Cell parameters: 10.249; 10.249; 6.649; 90; 90; 90;

COD ID: 1008501
CIF file	Formula: - C1.35 Fe11 Th - Comments: Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Magnetic characterization and structural study of new ternary carbides: ThFe~11~C~x~(1.5<= x<= 2) Journal of Physics: Condensed Matter 4 (1992) 6367-6374 Space group: I 41/a m d :2 Cell volume: 686.4 Cell parameters: 10.191; 10.191; 6.609; 90; 90; 90;

COD ID: 1008502
CIF file	Formula: - C1.5 Fe11 Th - Comments: Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Magnetic characterization and structural study of new ternary carbides: ThFe~11~C~x~(1.5<= x<= 2) Journal of Physics: Condensed Matter 4 (1992) 6367-6374 Space group: I 41/a m d :2 Cell volume: 684.5 Cell parameters: 10.19; 10.19; 6.592; 90; 90; 90;

COD ID: 1008503
CIF file	Formula: - C2 Fe11 Th - Comments: Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Magnetic characterization and structural study of new ternary carbides: ThFe~11~C~x~(1.5<= x<= 2) Journal of Physics: Condensed Matter 4 (1992) 6367-6374 Space group: I 41/a m d :2 Cell volume: 700.9 Cell parameters: 10.262; 10.262; 6.656; 90; 90; 90;

COD ID: 1008504
CIF file	Formula: - C1.35 Fe11 Th - Comments: Isnard, O; Soubeyroux, J L; Fruchart, D; Jacobs, T H; Buschow, K H J Magnetic characterization and structural study of new ternary carbides: ThFe~11~C~x~(1.5<= x<= 2) Journal of Physics: Condensed Matter 4 (1992) 6367-6374 Space group: I 41/a m d :2 Cell volume: 681.2 Cell parameters: 10.174; 10.174; 6.581; 90; 90; 90;

COD ID: 1008689
CIF file	Formula: - C0.6 Co9 Si2 Sm - Comments: Skolozdra, R; Akselrud, L; Fruchart, D; Gignoux, D; Gorolenko, Yu; Soubeyroux, J L; Tomey, E Magnetic and structural properties of new Sm Co9 Si2 Cx compounds (x=0.,0.6,0.9) Journal of Magnetism and Magnetic Materials 140 (1995) 915-916 Space group: I 41/a m d :2 Cell volume: 617.2 Cell parameters: 9.838; 9.838; 6.377; 90; 90; 90;

COD ID: 1008896
CIF file	Formula: - Co9 Si2 Sm - Comments: Garcia-Landa, B; Fruchart, D; Gignoux, D; Skolozdra, R; Soubeyroux, J L Synthesis, structural and magnetic properties of the interstitial compounds R Co9 Si2 Cx with R = Sm, Nd, Y and 0<x<1.8 Journal of Alloys Compd. 278 (1998) 6-16 Space group: I 41/a m d :2 Cell volume: 599.5 Cell parameters: 9.752; 9.752; 6.304; 90; 90; 90;

COD ID: 1008897
CIF file	Formula: - C1.575 Co9 Si2 Sm - Comments: Garcia-Landa, B; Fruchart, D; Gignoux, D; Skolozdra, R; Soubeyroux, J L Synthesis, structural and magnetic properties of the interstitial compounds R Co9 Si2 Cx with R = Sm, Nd, Y and 0<x<1.8 Journal of Alloys Compd. 278 (1998) 6-16 Space group: I 41/a m d :2 Cell volume: 642.1 Cell parameters: 9.954; 9.954; 6.48; 90; 90; 90;

COD ID: 1009064
CIF file	Formula: - Li0.89 Mn2 O3.84 - Comments: Strobel, P; Le Cras, F; Seguin, L; Anne, M; Tarascon, J M Oxygen nonstoichiometry in Li-Mn-O spinel oxides: a powder neutron diffraction study Journal of Solid State Chemistry 135 (1998) 132-139 Space group: I 41/a m d :2 Cell volume: 285.6 Cell parameters: 5.7396; 5.7396; 8.6709; 90; 90; 90;

COD ID: 1100029
CIF file	Formula: - N Ti2 - Comments: Lobier, G; Marcon, J P Etude et structure d'une nouvelle phase du sous-nitrure de titane Ti~2~ N Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 268 (1969) 1132-1135 Space group: I 41/a m d :2 Cell volume: 150.9 Cell parameters: 4.14; 4.14; 8.805; 90; 90; 90;

COD ID: 1100030
CIF file	Formula: - N Ti2 - Comments: Christensen, A. N.; Alamo, A.; Landesman, J. P. Structure of vacancy-ordered titanium heminitride δ'-Ti~2~N by powder neutron diffraction Acta Crystallographica, Section C: Crystal Structure Communications 41(7) (1985) 1009-1011 Space group: I 41/a m d :2 Cell volume: 151.3 Cell parameters: 4.1493; 4.1493; 8.7858; 90; 90; 90;

COD ID: 1100075
CIF file	Formula: - H1.3332 Mg1.3333 O4.9999 S - Comments: Keefer, K D; Hochella, M F jr.; de Jong, B H W S The Structure of the Magnesium Hydroxide Sulfate Hydrate Mg S O~4~ (Mg (O H)~2~)~.3333~ (H~2~ O)~.3333~ Acta Crystallographica B (24,1968-38,1982) 37 (1981) 1003-1006 Space group: I 41/a m d :2 Cell volume: 357.1 Cell parameters: 5.242; 5.242; 12.995; 90; 90; 90;

COD ID: 1100098
CIF file	Formula: ? Comments: Yamnova, N A; Pushcharovskii, D Y; Apollonov, V N Vestnik Moskovskogo Universiteta, Geologiya 5 (1989) 73-75 Space group: I 41/a m d :2 Cell volume: 358.1 Cell parameters: 5.254; 5.254; 12.971; 90; 90; 90;

COD ID: 1509001
CIF file	Formula: - Ag0.58 Ce Si1.42 - Comments: Ferro, R.; Saccone, A.; Kaczorowski, D.; Rogl, P.; Cordruwisch, E. Constitution, structural chemistry and magnetism in the ternary system Ce - Ag- Si Journal of Alloys Compd. 320 (2001) 308-319 Space group: I 41/a m d :2 Cell volume: 261.794 Cell parameters: 4.2291; 4.2291; 14.6374; 90; 90; 90;

COD ID: 1509027
CIF file	Formula: - Ag0.7 Ce Si1.3 - Comments: Rogl, P.; Ferro, R.; Cordruwisch, E.; Saccone, A.; Kaczorowski, D. Constitution, structural chemistry and magnetism in the ternary system Ce - Ag- Si Journal of Alloys Compd. 320 (2001) 308-319 Space group: I 41/a m d :2 Cell volume: 263.642 Cell parameters: 4.2352; 4.2352; 14.6983; 90; 90; 90;

COD ID: 1509086
CIF file	Formula: - Ag0.3 Ce Si1.7 - Comments: Rogl, P.; Kaczorowski, D.; Saccone, A.; Ferro, R.; Cordruwisch, E. Constitution, structural chemistry and magnetism in the ternary system Ce - Ag- Si Journal of Alloys Compd. 320 (2001) 308-319 Space group: I 41/a m d :2 Cell volume: 253.48 Cell parameters: 4.2131; 4.2131; 14.2804; 90; 90; 90;

COD ID: 1509784
CIF file	Formula: - Ag2 Cu2 O3 - Comments: Jansen, M.; Vensky, S.; Adelsberger, K.; Curda, J. High-pressure synthesis and electrochemical investigation of Ag2 Cu2 O3 Journal of Solid State Chemistry 158 (2001) 82-86 Space group: I 41/a m d :2 Cell volume: 372.676 Cell parameters: 5.8978; 5.8978; 10.714; 90; 90; 90;

COD ID: 1509785
CIF file	Formula: - Ag2 Cu2 O3 - Comments: Tejada-Rosales, E.M.; Gomez-Romero, P.; Palacin, M.R. Ag2 Cu2 O3 : the first silver copper oxide Angew. Chem. Int. ed. 38 (1999) 524-525 Space group: I 41/a m d :2 Cell volume: 370.206 Cell parameters: 5.8857; 5.8857; 10.6868; 90; 90; 90;

COD ID: 1510088
CIF file	Formula: - Au Cl - Comments: Folmer, J.C.W.; Wiegers, G.A.; Janssen, E.M.W. The preparation and crystal structure of gold monochloride, Au Cl Journal of the Less-Common Metals 38 (1974) 71-76 Space group: I 41/a m d :2 Cell volume: 393.338 Cell parameters: 6.734; 6.734; 8.674; 90; 90; 90;

COD ID: 1510609
CIF file	Formula: - Au Br - Comments: Janssen, E.M.W.; Wiegers, G.A. Crystal growth and the crystal structures of two modifications of gold monobromide, I-AuBr and P-Au Br Journal of the Less-Common Metals 57 (1978) 47-57 Space group: I 41/a m d :2 Cell volume: 445.61 Cell parameters: 6.94; 6.94; 9.252; 90; 90; 90;

COD ID: 1511367

Formula: - B10 Cs0.96 Li5.16 Se18 -
Comments: Pruss, T.; Kuchinke, J.; Doech, M.; Krebs, B.; Lindemann, A.; Koester, C. Li6-x Csx B10 Q18 (Q= S, Se; X<>1): New chalcogenoborates with polymeric layered anion networks Phosphorus, Sulfur, Silicon and Related Elements 169 (2001) 281-284
Space group: I 41/a m d :2
Cell volume: 2790.14
Cell parameters: 10.0285; 10.0285; 27.743; 90; 90; 90;

COD ID: 1511368
CIF file	Formula: - B10 Cs Li5 S18 - Comments: Kuchinke, J.; Krebs, B.; Pruss, T.; Doech, M.; Lindemann, A.; Koester, C. Li6-x Csx B10 Q18 (Q= S, Se; X<>1): New chalcogenoborates with polymeric layered anion networks Phosphorus, Sulfur, Silicon and Related Elements 169 (2001) 281-284 Space group: I 41/a m d :2 Cell volume: 2371.15 Cell parameters: 9.458; 9.458; 26.507; 90; 90; 90;

COD ID: 1511506
CIF file	Formula: - B4 Re4 - Comments: Mykhalenko, S.I.; Zavalii, P.Yu.; Kuz'ma, Yu.B. New incommensurate structures of the borides Pr41(Mn4B4)35 and Pr7(Re4B4)6 Journal of Alloys Compd. 203 (1994) 55-59 Space group: I 41/a m d :2 Cell volume: 470.778 Cell parameters: 10.586; 10.586; 4.201; 90; 90; 90;

COD ID: 1511555
CIF file	Formula: - B5 Pd14 Y2 - Comments: Salamakha, P.; Sologub, O.L.; Almeida, M.; Goncalves, A.P. Crystal structure and magnetism of the Y2 Pd14 B5 compound Journal of Alloys Compd. 360 (2003) 61-68 Space group: I 41/a m d :2 Cell volume: 1186.92 Cell parameters: 8.484; 8.484; 16.49; 90; 90; 90;

COD ID: 1513963
CIF file	Formula: - Li Mn O2 - Comments: Mosbah, A.; Verbaere, A.; Tournoux, M. Phases Lix Mn O2 lambda rattachees au type spinelle Materials Research Bulletin 18 (1938) 1375-1381 Space group: I 41/a m d :2 Cell volume: 295.07 Cell parameters: 5.6504; 5.6504; 9.242; 90; 90; 90;

COD ID: 1513971
CIF file	Formula: - Li1.5 Mn0.97 O2 - Comments: David, W. I. F.; Thackeray, M. M.; Bruce, P. G.; Goodenough, J. B. Lithium insertion into beta-MnO2 and the rutile spinel transformation Materials Research Bulletin 19 (1984) 99-106 Space group: I 41/a m d :2 Cell volume: 295.399 Cell parameters: 5.672; 5.672; 9.182; 90; 90; 90;

COD ID: 1514039
CIF file	Formula: - Li Mn3 O4 - Comments: Thackeray, M. M.; David, W. I. F.; Bruce, P. G.; Goodenough, J. B. Lithium insertion into manganese spinels Materials Research Bulletin 18 (1983) 461-472 Space group: I 41/a m d :2 Cell volume: 326.8 Cell parameters: 6.022; 6.022; 9.011; 90; 90; 90;

COD ID: 1514040
CIF file	Formula: - Li2 Mn2 O4 - Comments: Thackeray, M. M.; David, W. I. F.; Bruce, P. G.; Goodenough, J. B. Lithium insertion into manganese spinels Materials Research Bulletin 18 (1983) 461-472 Space group: I 41/a m d :2 Cell volume: 297.3 Cell parameters: 5.662; 5.662; 9.274; 90; 90; 90;

COD ID: 1514068
CIF file	Formula: - Li Mn3 O4 - Comments: Goodenough, J. B.; Thackeray, M. M.; David, W. I. F.; Bruce, P. G. Lithium insertion/extraction reactions with manganese oxides Revue de Chimie Minerale 21 (1984) 435-455 Space group: I 41/a m d :2 Cell volume: 326.8 Cell parameters: 6.022; 6.022; 9.011; 90; 90; 90;

COD ID: 1514069
CIF file	Formula: - Li2 Mn2 O4 - Comments: Goodenough, J. B.; Thackeray, M. M.; David, W. I. F.; Bruce, P. G. Lithium insertion/extraction reactions with manganese oxides Revue de Chimie Minerale 21 (1984) 435-455 Space group: I 41/a m d :2 Cell volume: 297.3 Cell parameters: 5.662; 5.662; 9.274; 90; 90; 90;

COD ID: 1514070
CIF file	Formula: - Li2 Mn2 O4 - Comments: David, W. I. F.; Thackeray, M. M.; de Picciotto, L. A.; Goodenough, J. B. Structure refinement of the spinel-related phases Li2 Mn2 O4 and Li.2 Mn2 O4 Journal of Solid State Chemistry 67 (1987) 316-323 Space group: I 41/a m d :2 Cell volume: 298.121 Cell parameters: 5.653; 5.653; 9.329; 90; 90; 90;

COD ID: 1514115
CIF file	Formula: - Mn3 O4 - Comments: Jarosch, D. Crystal structure refinement and reflectance measurements of hausmannite, Mn3 O4 Mineralogy and Petrology 37 (1987) 15-23 Space group: I 41/a m d :2 Cell volume: 313.81 Cell parameters: 5.765; 5.765; 9.442; 90; 90; 90;

COD ID: 1515890
CIF file	Formula: - C17 H20 Co N5 O1.5 - Comments: Choi, Hye Jin; Dincă, Mircea; Dailly, Anne; Long, Jeffrey R. Hydrogen storage in water-stable metal‒organic frameworks incorporating 1,3- and 1,4-benzenedipyrazolate Energy & Environmental Science 3(1) (2010) 117 Space group: I 41/a m d :2 Cell volume: 6503 Cell parameters: 22.847; 22.847; 12.458; 90; 90; 90;

COD ID: 1519064
CIF file	Formula: - Co0.46 H1.26 O5 P V0.94 - Comments: E. Le Fur; A. Riou; O. Pena; J.Y. Pivan Crystal structure of (V0.94Co0.46)[PO4(OH)0.74(OH2)0.26]: a mixed-valence phosphate related to the mineral caminite and the synthetic lipscombite Solid State Sciences 2 (2000) 135-141 Space group: I 41/a m d :2 Cell volume: 352.17 Cell parameters: 5.213; 5.213; 12.959; 90; 90; 90;

COD ID: 1520871

Formula: - F2 Na2 O8 Si U2 -
Comments: Blaton, N.; Vochten, R.; Peters, O.M.; van Springel, K. The crystal structure of Na2 (U O2)2 Si O4 F2, a compound structurally related to soddyite, and formed during uranyl silicate synthesis in Teflon-lined bombs Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-) 1999 (1999) 253-264
Space group: I 41/a m d :2
Cell volume: 890.793
Cell parameters: 6.975; 6.975; 18.31; 90; 90; 90;

COD ID: 1521002
CIF file	Formula: - Nd Si1.7 Zn0.3 - Comments: Demchenko, P.; Bodak, O. Crystal structure of the Nd Zn Si, Nd Zn0.3 Si1.7 and Nd Zn Sn ternary compounds Journal of Alloys Compd. 307 (2000) 215-217 Space group: I 41/a m d :2 Cell volume: 244.541 Cell parameters: 4.1478; 4.1478; 14.214; 90; 90; 90;

COD ID: 1521169
CIF file	Formula: - Cl Cu Te - Comments: Hirota, M.; Arai, M.; Sakuma, T.; Ishii, Y. Neutron diffraction study of Cu Cl Te Electrochemistry (Tokyo) 68 (2000) 522-525 Space group: I 41/a m d :2 Cell volume: 1158.47 Cell parameters: 15.537; 15.537; 4.799; 90; 90; 90;

COD ID: 1521239
CIF file	Formula: - Cr Nd O4 - Comments: Jimenez, E.; Isasi, J.; Saez-Puche, R. Synthesis, structural characterization and magnetic properties of R Cr O4 oxides, R = Nd, Sm, Eu and Lu Journal of Alloys Compd. 312 (2000) 53-59 Space group: I 41/a m d :2 Cell volume: 341.203 Cell parameters: 7.305; 7.305; 6.394; 90; 90; 90;

COD ID: 1521241
CIF file	Formula: - Cr O4 Sm - Comments: Jimenez, E.; Isasi, J.; Saez-Puche, R. Synthesis, structural characterization and magnetic properties of R Cr O4 oxides, R = Nd, Sm, Eu and Lu Journal of Alloys Compd. 312 (2000) 53-59 Space group: I 41/a m d :2 Cell volume: 333.062 Cell parameters: 7.244; 7.244; 6.347; 90; 90; 90;

COD ID: 1521894
CIF file	Formula: - Fe3.44 O10 P1.98 - Comments: Schmid-Beurmann, P. Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3 Journal of Solid State Chemistry 153 (2000) 237-247 Space group: I 41/a m d :2 Cell volume: 356.387 Cell parameters: 5.3053; 5.3053; 12.662; 90; 90; 90;

COD ID: 1521895
CIF file	Formula: - Fe3.32 H1.24 O10 P1.96 - Comments: Schmid-Beurmann, P. Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3 Journal of Solid State Chemistry 153 (2000) 237-247 Space group: I 41/a m d :2 Cell volume: 355.227 Cell parameters: 5.2718; 5.2718; 12.7817; 90; 90; 90;

COD ID: 1521896
CIF file	Formula: - Fe3.16 H1.45 O10 P1.96 - Comments: Schmid-Beurmann, P. Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3 Journal of Solid State Chemistry 153 (2000) 237-247 Space group: I 41/a m d :2 Cell volume: 354.181 Cell parameters: 5.2536; 5.2536; 12.8325; 90; 90; 90;

COD ID: 1521897
CIF file	Formula: - Fe3.08 H1.53 O10 P2.04 - Comments: Schmid-Beurmann, P. Synthesis and phase characterization of a solid solution series between beta-(Fe2 (P O4) O) and Fe4 (P O4)3 (O H)3 Journal of Solid State Chemistry 153 (2000) 237-247 Space group: I 41/a m d :2 Cell volume: 352.242 Cell parameters: 5.2273; 5.2273; 12.891; 90; 90; 90;

COD ID: 1521928
CIF file	Formula: - O7 S3 Si2 Sm4 - Comments: Sieke, C.; Schleid, T. Sm4 S3 (Si2 O7) und Na Sm9 S2 (Si O4)6 : zwei Sulfidsilicate mit dreiwertigem Samarium Zeitschrift fuer Anorganische und Allgemeine Chemie 625 (1999) 131-136 Space group: I 41/a m d :2 Cell volume: 1952.27 Cell parameters: 11.864; 11.864; 13.87; 90; 90; 90;

COD ID: 1522114
CIF file	Formula: - Ga1.272 Gd Ge0.728 - Comments: Venturini, G.; Verniere, A. Crystallographic data and magnetic properties of new Th Si2 and Gd Si2 derivative compounds in the Gd - Ga - Ge system Journal of Alloys Compd. 305 (2000) 7-13 Space group: I 41/a m d :2 Cell volume: 248.534 Cell parameters: 4.154; 4.154; 14.403; 90; 90; 90;

COD ID: 1522322
CIF file	Formula: - La4 O7 S3 Si2 - Comments: Zeng, H.-Y.; Mao, J.-G.; Huang, J.-S. Synthesis and crystal structure of La4 S3 Si2 O7 Journal of Alloys Compd. 291 (1999) 89-93 Space group: I 41/a m d :2 Cell volume: 2104.53 Cell parameters: 12.098; 12.098; 14.379; 90; 90; 90;

COD ID: 1523084

Formula: - Li2 O4 W -
Comments: Wilhelmi, K.A.; Waltersson, K.; Werner, P.E. The structure of Li2 W O4 (II). A high pressure polymorph of lithium wolframate. A structure derived by use of an x-ray powder photograph, also containing an additional phase. Crystal Structure Communications 6 (1977) 231-235
Space group: I 41/a m d :2
Cell volume: 1202.86
Cell parameters: 11.9541; 11.9541; 8.4175; 90; 90; 90;

COD ID: 1523842
CIF file	Formula: - Li2 O4 W - Comments: Horiuchi, H.; Morimoto, N.; Yamaoka, S. The crystal structure of Li2 W O4 II: A structure related to spinel Journal of Solid State Chemistry 30 (1979) 129-135 Space group: I 41/a m d :2 Cell volume: 1201.77 Cell parameters: 11.954; 11.954; 8.41; 90; 90; 90;

COD ID: 1525927
CIF file	Formula: - C1.213 Fe9.196 Nd Si1.804 - Comments: Du Honglin; Zhang, B.-S.; Chang, H.; Zhang, X.-D.; Yang, Y.-C. Neutron and X-ray diffraction studies on Nd (Fe, Si)11 C1.5 alloy Yuanzineng Kexue Jishu 35 (2001) 289-292 Space group: I 41/a m d :2 Cell volume: 668.744 Cell parameters: 10.1053; 10.1053; 6.5488; 90; 90; 90;

COD ID: 1526017
CIF file	Formula: - Dy0.015 O4 Si1.016 Zr0.985 - Comments: Finch, R.J.; Hanchar, J.M.; Hoskin, P.W.O.; Burns, P.C. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 262.266 Cell parameters: 6.6175; 6.6175; 5.989; 90; 90; 90;

COD ID: 1526018
CIF file	Formula: - O4 P0.012 Si0.988 Sm0.01 Zr0.99 - Comments: Finch, R.J.; Hanchar, J.M.; Burns, P.C.; Hoskin, P.W.O. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 261.56 Cell parameters: 6.6119; 6.6119; 5.983; 90; 90; 90;

COD ID: 1526019
CIF file	Formula: - Gd0.024 O4 P0.024 Si0.964 Zr0.976 - Comments: Finch, R.J.; Hanchar, J.M.; Burns, P.C.; Hoskin, P.W.O. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 262.519 Cell parameters: 6.6213; 6.6213; 5.9879; 90; 90; 90;

COD ID: 1526021
CIF file	Formula: - Dy0.058 O4 P0.058 Si0.91 Zr0.942 - Comments: Finch, R.J.; Hanchar, J.M.; Hoskin, P.W.O.; Burns, P.C. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 262.809 Cell parameters: 6.626; 6.626; 5.986; 90; 90; 90;

COD ID: 1526023
CIF file	Formula: - Er0.062 O4 P0.062 Si0.962 Zr0.938 - Comments: Finch, R.J.; Hanchar, J.M.; Hoskin, P.W.O.; Burns, P.C. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 263.695 Cell parameters: 6.6355; 6.6355; 5.989; 90; 90; 90;

COD ID: 1526025
CIF file	Formula: - O4 P0.087 Si0.913 Yb0.087 Zr0.913 - Comments: Finch, R.J.; Hanchar, J.M.; Hoskin, P.W.O.; Burns, P.C. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 262.541 Cell parameters: 6.6265; 6.6265; 5.979; 90; 90; 90;

COD ID: 1526027
CIF file	Formula: - O4 P0.13 Si0.85 Y0.13 Zr0.87 - Comments: Finch, R.J.; Hanchar, J.M.; Hoskin, P.W.O.; Burns, P.C. Rare-earth elements in synthetic zircon: Part 2. A single-crystal X-ray study of xenotime substitution American Mineralogist 86 (2001) 681-689 Space group: I 41/a m d :2 Cell volume: 263.356 Cell parameters: 6.6329; 6.6329; 5.986; 90; 90; 90;

COD ID: 1526134
CIF file	Formula: - Ca1.998 F0.996 N1.053 - Comments: Nicklow, R.A.; Wagner, T.R.; Raymond, C.C. Preparation and single-crystal structure analysis of Ca2 N F Journal of Solid State Chemistry 160 (2001) 134-138 Space group: I 41/a m d :2 Cell volume: 252.675 Cell parameters: 4.9018; 4.9018; 10.516; 90; 90; 90;

COD ID: 1526353
CIF file	Formula: - D2.272 Nd - Comments: Renaudin, G.; Fischer, P.; Yvon, K. Tetragonal structure of neodymium deuteride Nd D2.27 revisited Journal of Alloys Compd. 329 (2001) 9-13 Space group: I 41/a m d :2 Cell volume: 320.308 Cell parameters: 5.42542; 5.42542; 10.8818; 90; 90; 90;

COD ID: 1526432
CIF file	Formula: - Ge1.667 Nd - Comments: Salamakha, P.S.; Sologub, O.L.; Righi, L.; Demchenko, P.; Bocelli, G. Crystal structure of the Nd Ge1.66 compound Journal of Alloys Compd. 315 (2001) 1-3 Space group: I 41/a m d :2 Cell volume: 244.264 Cell parameters: 4.18; 4.18; 13.98; 90; 90; 90;

COD ID: 1526625
CIF file	Formula: - O7 Pr4 S3 Si2 - Comments: Sieke, C.; Schleid, T. Pr4 S3 (Si2 O7) und Pr3 Cl3 (Si2 O7) : durch weiche Fremdanionen modifizierte Derivate von Praseodymsilicat Zeitschrift fuer Anorganische und Allgemeine Chemie 626 (2000) 196-201 Space group: I 41/a m d :2 Cell volume: 2038.71 Cell parameters: 12.016; 12.016; 14.12; 90; 90; 90;

COD ID: 1526931
CIF file	Formula: - O2 Ti - Comments: Weirich, T.E.; Winterer, M.; Seifried, S.; Fuess, H.; Hahn, H. Rietveld analysis of electron powder diffraction data from nanocrystalline anatase, Ti O2 Ultramicroscopy 81 (2000) 263-270 Space group: I 41/a m d :2 Cell volume: 134.099 Cell parameters: 3.771; 3.771; 9.43; 90; 90; 90;

COD ID: 1527192
CIF file	Formula: - Br4 Pa - Comments: Brown, D.; Petcher, T.J.; Smith, A.J. Crystal structure of protactinium tetrabromide Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971) 1971 (1971) 908-910 Space group: I 41/a m d :2 Cell volume: 619.556 Cell parameters: 8.824; 8.824; 7.957; 90; 90; 90;

COD ID: 1527580
CIF file	Formula: - Eu H4 N2 - Comments: Jacobs, H.; Fink, U. Untersuchung des Systems Kalium/Europium/Ammoniak Zeitschrift fuer Anorganische und Allgemeine Chemie 438 (1978) 151-159 Space group: I 41/a m d :2 Cell volume: 322.835 Cell parameters: 5.454; 5.454; 10.853; 90; 90; 90;

COD ID: 1527741
CIF file	Formula: - O3 U - Comments: Loopstra, B.O.; Taylor, J.C.; Waugh, A.B. Neutron powder profile studies of the gamma uranium trioxide phases Journal of Solid State Chemistry 20 (1977) 9-19 Space group: I 41/a m d :2 Cell volume: 951.387 Cell parameters: 6.9013; 6.9013; 19.9754; 90; 90; 90;

COD ID: 1528271
CIF file	Formula: - Br Cu0.99 Te - Comments: von Alpen, U.; Fenner, J.; Predel, B.; Schluckebier, G.; Rabenau, A. Zur Phasenumwandlung von Cu Te Br und zur Struktur der Hochtemperaturphase Zeitschrift fuer Anorganische und Allgemeine Chemie 438 (1978) 5-14 Space group: I 41/a m d :2 Cell volume: 1280.49 Cell parameters: 16.45; 16.45; 4.732; 90; 90; 90;

COD ID: 1528822
CIF file	Formula: - Li2 O15 P2 U3 - Comments: Renard, C.; Obbade, S.; Abraham, F. Channels occupany and distortion in new lithium uranyl phosphates with three-dimensional open-frameworks Journal of Solid State Chemistry 182 (2009) 1377-1386 Space group: I 41/a m d :2 Cell volume: 1266.18 Cell parameters: 7.1109; 7.1109; 25.0407; 90; 90; 90;

COD ID: 1528861
CIF file	Formula: - Be F12 Li6 Zr - Comments: Sears, D.R.; Burns, J.H. Crystal structure of Li6 Be F4 Zr F8 Journal of Chemical Physics 41 (1964) 3478-3483 Space group: I 41/a m d :2 Cell volume: 803.73 Cell parameters: 6.57; 6.57; 18.62; 90; 90; 90;

COD ID: 1529004
CIF file	Formula: - Mg0.05 N0.85 O1.15 Ta0.95 - Comments: Wolff, H.; Lerch, M.; Schilling, H.; Baehtz, C.; Dronskowski, R. A density-functional study on the stability of anatase-type phases in the system Mg-Ta-O-N Journal of Solid State Chemistry 181 (2008) 2684-2689 Space group: I 41/a m d :2 Cell volume: 155.372 Cell parameters: 3.91986; 3.91986; 10.1119; 90; 90; 90;

COD ID: 1529049
CIF file	Formula: - O4 P Yb - Comments: Zhang, F.X.; Lang, M.; Ewing, R.C.; Wang, Z.W.; Lian, J.; Boatner, L.A.; Hu, J. Pressure-induced zircon-type to scheelite-type phase transitions on Yb P O4 and Lu P O4 Journal of Solid State Chemistry 181 (2008) 2633-2638 Space group: I 41/a m d :2 Cell volume: 275.903 Cell parameters: 6.801; 6.801; 5.965; 90; 90; 90;

COD ID: 1529606

Formula: - Ce O4 V -
Comments: Baudracco-Gritti, C.; Quartieri, S.; Vezzalini, G.; Rinaldi, R.; Permingeat, F.; Pillard, F. Une wakefieldite-(Ce) non plombifere: nouvelles donnees sur l'espece minerale correspondant a l'orthovanadate de cerium Bulletin de Mineralogie (101,1978-) 110 (1987) 657-663
Space group: I 41/a m d :2
Cell volume: 350.88
Cell parameters: 7.354; 7.354; 6.488; 90; 90; 90;

COD ID: 1529649
CIF file	Formula: - Ce Ni8.6 Si2.4 - Comments: Bodak, O.I.; Gladyshevskii, E.I. Crystal structure of the compound Ce Ni8.6 Si2.4 and related componnds Dopovidi Akademii Nauk Ukrains'koi RSR, Seriya A: Fiziko-Tekhnichni ta Matematichni Nauki 1969 (1969) 452-455 Space group: I 41/a m d :2 Cell volume: 600.031 Cell parameters: 9.799; 9.799; 6.249; 90; 90; 90;

COD ID: 1529829

Formula: - Cr Ni O5 P -
Comments: Ech Chahed, B.; Jeannot, F.; Gleitzer, C.; Malaman, B. Preparation et etude d'une variete basse temperature du l'oxyphosphate de fer de valence mixte beta Fe2 (P O4) O et de Ni Cr (P O4) O: Un cas d'echange electronique rapide Journal of Solid State Chemistry 74 (1988) 47-59
Space group: I 41/a m d :2
Cell volume: 339.268
Cell parameters: 5.298; 5.298; 12.087; 90; 90; 90;

COD ID: 1530224
CIF file	Formula: - D2 O - Comments: Kuhs, W.F.; Finney, J.L.; Vettier, C.; Bliss, D.V. Structure and hydrogen ordering in ices VI, VII, and VIII by neutron powder diffraction Journal of Chemical Physics 81 (1984) 3612-3623 Space group: I 41/a m d :2 Cell volume: 146.871 Cell parameters: 4.656; 4.656; 6.775; 90; 90; 90;

COD ID: 1530427
CIF file	Formula: - O4 P Y - Comments: Milligan, W.O.; Beall, G.W.; Mullica, D.F.; Boatner, L.A. Structural investigations of Y P O4, Sc P O4, and Lu P O4 Inorganica Chimica Acta 60 (1982) 39-43 Space group: I 41/a m d :2 Cell volume: 284.985 Cell parameters: 6.8817; 6.8817; 6.0177; 90; 90; 90;

COD ID: 1530428
CIF file	Formula: - O4 P Sc - Comments: Milligan, W.O.; Mullica, D.F.; Boatner, L.A.; Beall, G.W. Structural investigations of Y P O4, Sc P O4, and Lu P O4 Inorganica Chimica Acta 60 (1982) 39-43 Space group: I 41/a m d :2 Cell volume: 250.272 Cell parameters: 6.574; 6.574; 5.791; 90; 90; 90;

COD ID: 1530460
CIF file	Formula: - Gd0.5 O4 P Yb0.5 - Comments: Mullica, D.F.; Grossie, D.A.; Boatner, L.A. Crystal structure of 1:1 Gadolinium/ytterbium orthophosphate Inorganica Chimica Acta 118 (1986) 173-176 Space group: I 41/a m d :2 Cell volume: 282.958 Cell parameters: 6.865; 6.865; 6.004; 90; 90; 90;

COD ID: 1530629
CIF file	Formula: - Li4 O8 Zr2.62 - Comments: Quintana, P.; Howie, R.A.; Leal, J.; West, A.R. Li2 Zr O3: A New Polymorph with the alpha- Li Fe O2 Structure Materials Research Bulletin 24 (1989) 1385-1389 Space group: I 41/a m d :2 Cell volume: 163.983 Cell parameters: 4.265; 4.265; 9.0149; 90; 90; 90;

COD ID: 1530942

Formula: - Nb2 O8 Pb3 -
Comments: Vandenborre, M.T.; Chubb, M.; Mahe, R.; Brusset, H. Etude structurale de composes 3 Pd O - B2 O5 (B = Nb, Ta) de type pyrochlore Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-) 284 (1977) 179-182
Space group: I 41/a m d :2
Cell volume: 613.504
Cell parameters: 7.53; 7.53; 10.82; 90; 90; 90;

COD ID: 1531194

Formula: - Mn2 Ni O4 -
Comments: Bodak, O.; Aksel'rud, L.G.; Demchenko, P.; Kotur, B.; Mrooz, O.; Shpotyuk, O.; Hadzaman, I.; Aldinger, F.; Pekhnyo, V.; Seifert, H.; Volkov, S. Microstructure, crystal structure and electrical properties of Cu0.1 Ni0.8 Co0.2 Mn1.9 O4 ceramics obtained at different sinteringconditions Journal of Alloys Compd. 347 (2002) 14-23
Space group: I 41/a m d :2
Cell volume: 300.744
Cell parameters: 5.9764; 5.9764; 8.4201; 90; 90; 90;

COD ID: 1531197

Formula: - Co0.19 Cu0.09 Mn2.049 Ni0.671 O4 -
Comments: Bodak, O.; Aksel'rud, L.G.; Aldinger, F.; Kotur, B.; Demchenko, P.; Pekhnyo, V.; Mrooz, O.; Hadzaman, I.; Volkov, S.; Seifert, H.; Shpotyuk, O. Microstructure, crystal structure and electrical properties of Cu0.1 Ni0.8 Co0.2 Mn1.9 O4 ceramics obtained at different sintering conditions Journal of Alloys Compd. 347 (2002) 14-23
Space group: I 41/a m d :2
Cell volume: 297.174
Cell parameters: 5.941; 5.941; 8.4196; 90; 90; 90;

COD ID: 1531218
CIF file	Formula: - Mg0.014 Mn2.924 O4 Zn0.062 - Comments: Bosi, F.; della Giusta, A.; Lucchesi, S. Structural relationships in (Mn1-x Znx) Mn2 O4 (0 <= x <= 0.26): the "dragging effect" of the tetrahedron on the octahedron American Mineralogist 87 (2002) 1121-1127 Space group: I 41/a m d :2 Cell volume: 313.275 Cell parameters: 5.7584; 5.7584; 9.4476; 90; 90; 90;

COD ID: 1531220
CIF file	Formula: - Mg0.006 Mn2.847 O4 Zn0.147 - Comments: Bosi, F.; Lucchesi, S.; della Giusta, A. Structural relationships in (Mn1-x Znx) Mn2 O4 (0 <= x <= 0.26): the "dragging effect" of the tetrahedron on the octahedron American Mineralogist 87 (2002) 1121-1127 Space group: I 41/a m d :2 Cell volume: 312.099 Cell parameters: 5.7535; 5.7535; 9.4282; 90; 90; 90;

COD ID: 1531222
CIF file	Formula: - Mn2.758 O4 Zn0.244 - Comments: Bosi, F.; Lucchesi, S.; della Giusta, A. Structural relationships in (Mn1-x Znx) Mn2 O4 (0 <= x <= 0.26): the "dragging effect" of the tetrahedron on the octahedron American Mineralogist 87 (2002) 1121-1127 Space group: I 41/a m d :2 Cell volume: 311.305 Cell parameters: 5.7524; 5.7524; 9.4078; 90; 90; 90;

COD ID: 1531223
CIF file	Formula: - Mg0.005 Mn2.995 O4 - Comments: Bosi, F.; della Giusta, A.; Lucchesi, S. Structural relationships in (Mn1-x Znx) Mn2 O4 (0 <= x <= 0.26): the "dragging effect" of the tetrahedron on the octahedron American Mineralogist 87 (2002) 1121-1127 Space group: I 41/a m d :2 Cell volume: 314.169 Cell parameters: 5.7625; 5.7625; 9.4611; 90; 90; 90;

COD ID: 1531226
CIF file	Formula: - Al0.003 Mg0.001 Mn2.98 O4 Zn0.018 - Comments: Bosi, F.; Lucchesi, S.; della Giusta, A. Structural relationships in (Mn1-x Znx) Mn2 O4 (0 <= x <= 0.26): the "dragging effect" of the tetrahedron on the octahedron American Mineralogist 87 (2002) 1121-1127 Space group: I 41/a m d :2 Cell volume: 314.033 Cell parameters: 5.7632; 5.7632; 9.4547; 90; 90; 90;

COD ID: 1531244
CIF file	Formula: - Np Si1.72 - Comments: Boulet, P.; Rebizant, J.; Bouexiere, D.; Wastin, F. Structural chemistry of the neptunium-silicon binary system Journal of Alloys Compd. 349 (2003) 172-179 Space group: I 41/a m d :2 Cell volume: 214.319 Cell parameters: 3.955; 3.955; 13.7015; 90; 90; 90;

COD ID: 1531274
CIF file	Formula: - Gd Si1.52 Zn0.48 - Comments: Demchenko, P.; Bodak, O.; Muratova, L. X-ray investigation of the Gd - Zn - Si system Journal of Alloys Compd. 346 (2002) 170-175 Space group: I 41/a m d :2 Cell volume: 231.241 Cell parameters: 4.0687; 4.0687; 13.9686; 90; 90; 90;

COD ID: 1531276
CIF file	Formula: - Gd Si1.46 Zn0.54 - Comments: Demchenko, P.; Bodak, O.; Muratova, L. X-ray investigation of the Gd - Zn - Si system Journal of Alloys Compd. 346 (2002) 170-175 Space group: I 41/a m d :2 Cell volume: 234.881 Cell parameters: 4.0782; 4.0782; 14.1225; 90; 90; 90;

COD ID: 1531282

Formula: - C1.419 Fe9.253 Nd Si1.747 -
Comments: Chang, H.; Yang, Y.-C.; Zhang, X.-D.; Yang, J.-B.; Du Honglin; Li, F.-S.; Ma, Y.; Zhang, B.-S.; Xue, D.-S.; Jiang, J.-S. A neutron diffraction study of Nd Fe9.25 Si1.75 Cx compounds Journal of Magnetism and Magnetic Materials 248 (2002) 341-347
Space group: I 41/a m d :2
Cell volume: 672.279
Cell parameters: 10.1261; 10.1261; 6.5564; 90; 90; 90;

COD ID: 1531403
CIF file	Formula: - Cs4 F12 Mn2 Pd - Comments: Fischer, R.; Mueller, B.G. Synthese und Struktur einer tetragonalen Fluorperowskitvariante mit Kationendefizit - Cs4 Pd Mn2 F12 Zeitschrift fuer Anorganische und Allgemeine Chemie 628 (2002) 1532-1536 Space group: I 41/a m d :2 Cell volume: 1417.46 Cell parameters: 8.5898; 8.5898; 19.2108; 90; 90; 90;

COD ID: 1531580

Formula: - D2.18 V2 Zr -
Comments: Irodova, A.V.; Bouree, F.; Andre, G. Hydrogen redistribution in the solid solutions Zr V2 Dx, 2.2 <= x <= 2.7. II. Structure of the intermediate phase: 'lattice liquid crystal'. A neutron diffraction study Journal of Alloys Compd. 350 (2003) 196-204
Space group: I 41/a m d :2
Cell volume: 226.134
Cell parameters: 5.4357; 5.4357; 7.6534; 90; 90; 90;

COD ID: 1531582

Formula: - D2.35 V2 Zr -
Comments: Irodova, A.V.; Andre, G.; Bouree, F. Hydrogen redistribution in the solid solutions Zr V2 Dx, 2.2 <= x <= 2.7. II. Structure of the intermediate phase: 'lattice liquid crystal'. A neutron diffraction study Journal of Alloys Compd. 350 (2003) 196-204
Space group: I 41/a m d :2
Cell volume: 227.877
Cell parameters: 5.4375; 5.4375; 7.7073; 90; 90; 90;

COD ID: 1531650
CIF file	Formula: - Cr Er O4 - Comments: Jimenez, E.; Fernandez, M.T.; Isasi, J.; Saez-Puche, R. Magnetic behavior of Er Cr O4 oxide Journal of Alloys Compd. 2000 (2002) 369-374 Space group: I 41/a m d :2 Cell volume: 309.255 Cell parameters: 7.062; 7.062; 6.201; 90; 90; 90;

COD ID: 1532137
CIF file	Formula: - Cr Nd O4 - Comments: Saez-Puche, R.; Jimenez, E.; Fernandez-Diaz, M.T.; Isasi, J.; Garcia-Munoz, J.L. Structural and magnetic characterization of R Cr O4 oxides (R = Nd, Er and Tm) Journal of Solid State Chemistry 171 (2003) 161-169 Space group: I 41/a m d :2 Cell volume: 335.669 Cell parameters: 7.266; 7.266; 6.358; 90; 90; 90;

COD ID: 1532138
CIF file	Formula: - Cr Er O4 - Comments: Saez-Puche, R.; Jimenez, E.; Isasi, J.; Fernandez-Diaz, M.T.; Garcia-Munoz, J.L. Structural and magnetic characterization of R Cr O4 oxides (R = Nd,Er and Tm) Journal of Solid State Chemistry 171 (2003) 161-169 Space group: I 41/a m d :2 Cell volume: 308.244 Cell parameters: 7.055; 7.055; 6.193; 90; 90; 90;

COD ID: 1532139
CIF file	Formula: - Cr O4 Tm - Comments: Saez-Puche, R.; Garcia-Munoz, J.L.; Jimenez, E.; Isasi, J.; Fernandez-Diaz, M.T. Structural and magnetic characterization of R Cr O4 oxides (R = Nd,Er and Tm) Journal of Solid State Chemistry 171 (2003) 161-169 Space group: I 41/a m d :2 Cell volume: 305.644 Cell parameters: 7.032; 7.032; 6.181; 90; 90; 90;

COD ID: 1532262
CIF file	Formula: - O4 Si0.993 V0.007 Zr - Comments: Torres, F.J.; Tena, M.A.; Alarcon, J. Rietveld refinement study of vanadium distribution in V(+4) - (Zr Si O4) solid solutions obtained from gels Journal of the European Ceramic Society 22 (2002) 1991-1994 Space group: I 41/a m d :2 Cell volume: 260.624 Cell parameters: 6.6011; 6.6011; 5.9811; 90; 90; 90;

COD ID: 1532429
CIF file	Formula: - Ho4 O7 S3 Si2 - Comments: Zeng, H.-Y.; Mao, J.-G.; Dong Zhenchao; Guo, G.-C.; Huang, J.-S. Synthesis and crystal structure of Ho4 S3 Si2 O7 Jiegon Huaxue 21 (2002) 157-160 Space group: I 41/a m d :2 Cell volume: 1849.95 Cell parameters: 11.666; 11.666; 13.593; 90; 90; 90;

COD ID: 1532518
CIF file	Formula: - N2 O Si2 - Comments: Kroll, P.; Milko, M. Theoretical investigation of the solid state reaction of silicon nitride and silicon dioxide forming silicon oxynitride (Si2 N2 O) under pressure Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 1737-1750 Space group: I 41/a m d :2 Cell volume: 675.88 Cell parameters: 5.4158; 5.4158; 23.0433; 90; 90; 90;

COD ID: 1532606
CIF file	Formula: - Li N2 U - Comments: Jacobs, H.; Heckers, U.; Zachwieja, U.; Kockelmann, W. Lithium - Uran - Nitride : Li U N2 und Li2 U N2 Zeitschrift fuer Anorganische und Allgemeine Chemie 629 (2003) 2240-2243 Space group: I 41/a m d :2 Cell volume: 212.919 Cell parameters: 4.39082; 4.39082; 11.0439; 90; 90; 90;

COD ID: 1532793
CIF file	Formula: - Na O20 U4 V3 - Comments: Obbade, S.; Dion, C.; Rivenet, M.; Saadi, M.; Abraham, F. A novel open-framework with open non-crossing channels in the uranyl vanadates A (U O2)4 (V O4)3 (A = Li, Na) Journal of Solid State Chemistry 177 (2004) 2058-2067 Space group: I 41/a m d :2 Cell volume: 1779.78 Cell parameters: 7.2267; 7.2267; 34.079; 90; 90; 90;

COD ID: 1532802
CIF file	Formula: - Al Li O2 - Comments: Li Xijun; Kobayashi, T.; Zhang Fuxiang; Sekine, T.; Kimoto, K. A new high-pressure phase of Li Al O2 Journal of Solid State Chemistry 177 (2004) 1939-1943 Space group: I 41/a m d :2 Cell volume: 125.378 Cell parameters: 3.8866; 3.8866; 8.3001; 90; 90; 90;

COD ID: 1533115
CIF file	Formula: - Cr2 Mg O4 - Comments: Ehrenberg, H.; Knapp, M.; Baehtz, C.; Klemme, S. Tetragonal low-temperature phase of Mg Cr2 O4 Powder Diffraction 17 (2002) 230-233 Space group: I 41/a m d :2 Cell volume: 288.721 Cell parameters: 5.89199; 5.89199; 8.31677; 90; 90; 90;

COD ID: 1533469
CIF file	Formula: - H4 O10 Pu2 Si - Comments: Grigor'ev, M.S.; Bessonov, A.A.; Makarenkov, V.I.; Fedoseev, A.M. Model of the (Pu O2)2 Si O4 * 2(H2 O) crystal structure based on powder X-ray diffraction data Radiokhimiya 45 (2003) 236-239 Space group: I 41/a m d :2 Cell volume: 886.861 Cell parameters: 6.912; 6.912; 18.563; 90; 90; 90;

COD ID: 1533595
CIF file	Formula: - La6 O12 S3 Sb4 - Comments: So Won-Wook; LaCour, A.; Aliev, V.O.; Dorhout, P.K. Synthesis and characterization of a new quaternary lanthanum oxythioantimonite: La6 Sb4 O12 S3 Journal of Alloys Compd. 374 (2004) 234-239 Space group: I 41/a m d :2 Cell volume: 1806.24 Cell parameters: 10.86; 10.86; 15.315; 90; 90; 90;

COD ID: 1533640
CIF file	Formula: - Ga1.34 Nd Si0.66 - Comments: Tokaychuk, Ya.O.; Fedorchuk, A.O.; Bodak, O.I.; Mokra, I.R. Phase relations in the Nd - Ga - Si system at 870 K Journal of Alloys Compd. 367 (2004) 64-69 Space group: I 41/a m d :2 Cell volume: 254.672 Cell parameters: 4.20329; 4.20329; 14.4146; 90; 90; 90;

COD ID: 1533643
CIF file	Formula: - Ga1.04 Nd Si0.96 - Comments: Tokaychuk, Ya.O.; Mokra, I.R.; Fedorchuk, A.O.; Bodak, O.I. Phase relations in the Nd - Ga - Si system at 870 K Journal of Alloys Compd. 367 (2004) 64-69 Space group: I 41/a m d :2 Cell volume: 251.258 Cell parameters: 4.1922; 4.1922; 14.2967; 90; 90; 90;

COD ID: 1533874
CIF file	Formula: - Al0.6336 Ge1.1264 Th - Comments: Kavecansky, V.; Rogl, P.; Noel, H.; Wochowski, K.; Mihalik, M.; Troc, R. X-ray investigation of alloys with composition Th37.5 M25 M'37.5; M= Al, Ga, M' = Si, Ge Journal of Alloys Compd. 365 (2004) 173-177 Space group: I 41/a m d :2 Cell volume: 253.349 Cell parameters: 4.19281; 4.19281; 14.4115; 90; 90; 90;

COD ID: 1533876
CIF file	Formula: - Ga0.5832 Ge1.0368 Th - Comments: Kavecansky, V.; Rogl, P.; Noel, H.; Mihalik, M.; Wochowski, K.; Troc, R. X-ray investigation of alloys with composition Th37.5 M25 M'37.5; M= Al, Ga, M' = Si, Ge Journal of Alloys Compd. 365 (2004) 173-177 Space group: I 41/a m d :2 Cell volume: 250.41 Cell parameters: 4.18581; 4.18581; 14.292; 90; 90; 90;

COD ID: 1533936
CIF file	Formula: - Al2.666 O3.999 - Comments: Paglia, G.; Buckley, C.E.; Rohl, A.L.; Hart, R.D.; Hunter, B.A.; Hanna, J.V.; Byrne, L.T. Tetragonal structure model for boehmite-derived gamma-alumina Physical Review, Serie 3. B - Condensed Matter (18,1978-) 68 (2003) 144110-1-144110-11 Space group: I 41/a m d :2 Cell volume: 251.44 Cell parameters: 5.652; 5.652; 7.871; 90; 90; 90;

COD ID: 1533940
CIF file	Formula: - Si2 Sr - Comments: Palenzona, A.; Pani, M. The phase diagram of the Sr - Si system Journal of Alloys Compd. 373 (2004) 214-219 Space group: I 41/a m d :2 Cell volume: 271.525 Cell parameters: 4.429; 4.429; 13.842; 90; 90; 90;

COD ID: 1533941
CIF file	Formula: - Si1.693 Sr - Comments: Palenzona, A.; Pani, M. The phase diagram of the Sr - Si system Journal of Alloys Compd. 373 (2004) 214-219 Space group: I 41/a m d :2 Cell volume: 269.781 Cell parameters: 4.403; 4.403; 13.916; 90; 90; 90;

COD ID: 1533983
CIF file	Formula: - Al0.6942 Si1.0858 Th - Comments: Kavecansky, V.; Rogl, P.; Mihalik, M.; Noel, H.; Wochowski, K.; Troc, R. X-ray investigation of alloys with composition Th37.5 M25 M'37.5; M= Al, Ga, M' = Si, Ge Journal of Alloys Compd. 365 (2004) 173-177 Space group: I 41/a m d :2 Cell volume: 249.646 Cell parameters: 4.17118; 4.17118; 14.3485; 90; 90; 90;

COD ID: 1533984
CIF file	Formula: - Ga0.2445 Si1.3855 Th - Comments: Kavecansky, V.; Troc, R.; Noel, H.; Mihalik, M.; Rogl, P.; Wochowski, K. X-ray investigation of alloys with composition Th37.5 M25 M'37.5; M= Al, Ga, M' = Si, Ge Journal of Alloys Compd. 365 (2004) 173-177 Space group: I 41/a m d :2 Cell volume: 236.785 Cell parameters: 4.1136; 4.1136; 13.993; 90; 90; 90;

COD ID: 1534405
CIF file	Formula: - H5 K O3 - Comments: Ruetter, H.; Mootz, D. Die Kristallstrukturen von KOH2H2O (Substruktur) und KOH4H2O Zeitschrift fuer Anorganische und Allgemeine Chemie 601 (1991) 73-82 Space group: I 41/a m d :2 Cell volume: 686.576 Cell parameters: 7.154; 7.154; 13.415; 90; 90; 90;

COD ID: 1535213
CIF file	Formula: - H15 Mo12 O46 P - Comments: Strandberg, R. Multicomponent polyanions. 13. The crystal structure of a hydrated dodecamolybdophosphoric acid, H3 Mo12 P O40 (H2 O)31 Acta Chemica Scandinavica, Series A: (28,1974-) 29 (1975) 359-364 Space group: I 41/a m d :2 Cell volume: 6332.45 Cell parameters: 16.473; 16.473; 23.336; 90; 90; 90;

COD ID: 1535243

Formula: - Ir0.266 Si1.734 Sm -
Comments: Heying, B.; Poettgen, R.; Valldor, M.; Hoffmann, R.D.; Rodewald, U.C.; Mishra, R. Synthesis, structure and magnetic properties of the silicides RE Ir Si (RE = Ce, Pr, Er, Tm, Lu) and Sm Ir0.266(8) Si1.734(8) Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-) 135 (2004) 1335-1347
Space group: I 41/a m d :2
Cell volume: 234.068
Cell parameters: 4.093; 4.093; 13.972; 90; 90; 90;

COD ID: 1535335

Formula: - Al Gd Si -
Comments: Bobev, S.; Tobash, P.H.; Fritsch, V.; Thompson, J.D.; Hundley, M.F.; Sarrao, J.L.; Fisk, Z. Ternary rare-earth alumo-silicides - single-crystal growth from Al flux, structural and physical properties Journal of Solid State Chemistry 178 (2005) 2091-2103
Space group: I 41/a m d :2
Cell volume: 245.629
Cell parameters: 4.1255; 4.1255; 14.432; 90; 90; 90;

COD ID: 1535852
CIF file	Formula: - H4 N2 Sr - Comments: Nagib, M.; Kistrup, H.; Jacobs, H. Neutronenbeugung am Strontiumdeuteroamid, Sr N D2, bei Temperaturen von 31 bis 570 K Atomkernenergie 33 (1979) 38-42 Space group: I 41/a m d :2 Cell volume: 324.173 Cell parameters: 5.451; 5.451; 10.91; 90; 90; 90;

COD ID: 1535899
CIF file	Formula: - C8 Ag9 Cl6 Cs5 N8 - Comments: Urban, V.; Pretsch, T.; Hartl, H. From Ag C N chains to a fivefold helix and a fishnet-shaped framework structure Angew. Chem. Int. ed. 44 (2005) 2794-2797 Space group: I 41/a m d :2 Cell volume: 3612.42 Cell parameters: 22.4176; 22.4176; 7.1882; 90; 90; 90;

COD ID: 1536115
CIF file	Formula: - Cu1.035 I Te - Comments: Fenner, J.; Rabenau, A. Die Kristallstruktur von Cu Te I Zeitschrift fuer Anorganische und Allgemeine Chemie 426 (1976) 7-14 Space group: I 41/a m d :2 Cell volume: 1437.49 Cell parameters: 17.17; 17.17; 4.876; 90; 90; 90;

COD ID: 1536148
CIF file	Formula: - Cs H O4 S - Comments: Nozik, Yu.Z.; Sarin, V.A.; Lyakhovitskaya, O.I.; Shchagina, N.M. Neutron diffraction study of crystal structures of I,II,III phases of cesium hydrosulphate by full-profile analysis technique Kristallografiya 35 (1990) 658-660 Space group: I 41/a m d :2 Cell volume: 466.393 Cell parameters: 5.729; 5.729; 14.21; 90; 90; 90;

COD ID: 1537126
CIF file	Formula: - Al4.5 H8 K4.5 O36 Si11.5 - Comments: Ross, C.R.II.; Paris, E.; Rubie, D.C. Montesommaite, (K, Na)9 Al9 Si23 O64 * 10(H2 O), a new zeolite related to merlinoite and the gismondine group American Mineralogist 75 (1990) 1415-1420 Space group: I 41/a m d :2 Cell volume: 882.551 Cell parameters: 7.141; 7.141; 17.307; 90; 90; 90;

COD ID: 1538013
CIF file	Formula: - As8 Ni11 - Comments: Fleet, M.E. The crystal structure of maucherite American Mineralogist 58 (1973) 203-210 Space group: I 41/a m d :2 Cell volume: 257.651 Cell parameters: 3.4362; 3.4362; 21.821; 90; 90; 90;

COD ID: 1538046
CIF file	Formula: - F12 K4 Mn3 - Comments: Frenzen, G.; Massa, W.; Kummer, S.; Babel, D. Tetragonale Fluorperowskite A M.75 F3 mit Kationendefizit: K4 Mn(II) Mn(III)2 F12 und Ba2 Cs2 Cu3 F12 Zeitschrift fuer Anorganische und Allgemeine Chemie 553 (1987) 75-84 Space group: I 41/a m d :2 Cell volume: 1137.87 Cell parameters: 8.322; 8.322; 16.43; 90; 90; 90;

COD ID: 1538048
CIF file	Formula: - Ba2 Cs2 Cu3 F12 - Comments: Frenzen, G.; Babel, D.; Kummer, S.; Massa, W. Tetragonale Fluorperowskite A M.75 F3 mit Kationendefizit: K4 Mn(II) Mn(III)2 F12 und Ba2 Cs2 Cu3 F12 Zeitschrift fuer Anorganische und Allgemeine Chemie 553 (1987) 75-84 Space group: I 41/a m d :2 Cell volume: 1137.87 Cell parameters: 8.322; 8.322; 16.43; 90; 90; 90;

COD ID: 1541233
CIF file	Formula: - Cl Cu Te - Comments: Milius, W. Strukturverfeinerung des Kupferionenleiters Cu Te Cl Zeitschrift fuer Anorganische und Allgemeine Chemie 586 (1990) 175-184 Space group: I 41/a m d :2 Cell volume: 1168.26 Cell parameters: 15.609; 15.609; 4.795; 90; 90; 90;

COD ID: 1543899

Formula: - Cr2 Cu O4 -
Comments: Tarantino, Serena C.; Giannini, Mattia; Carpenter, Michael A.; Zema, Michele Cooperative Jahn‒Teller effect and the role of strain in the tetragonal-to-cubic phase transition in Mg~x~Cu~1{ηskip0.16667em~{-}{ηskip0.16667em}x}Cr~2~O~4~ IUCrJ 3(5) (2016)
Space group: I 41/a m d :2
Cell volume: 282.777
Cell parameters: 6.0287; 6.0287; 7.7803; 90; 90; 90;

COD ID: 1545074
CIF file	Formula: - Fe2 O5 P - Comments: Ijjaali, M.; Malaman, B.; Gleitzer, C.; Warner, J. K.; Hriljac, J. A.; Cheetham, A. K. Stability, structure refinement, and magnetic properties of beta-Fe2(PO4)O Journal of Solid State Chemistry 86 (1990) 195-205 Space group: I 41/a m d :2 Cell volume: 354.69 Cell parameters: 5.336; 5.336; 12.457; 90; 90; 90;

COD ID: 1545075
CIF file	Formula: - Fe2 O5 P - Comments: Ijjaali, M.; Malaman, B.; Gleitzer, C.; Warner, J. K.; Hriljac, J. A.; Cheetham, A. K. Stability, structure refinement, and magnetic properties of beta-Fe2(PO4)O Journal of Solid State Chemistry 86 (1990) 195-205 Space group: I 41/a m d :2 Cell volume: 358.89 Cell parameters: 5.3573; 5.3573; 12.5046; 90; 90; 90;

COD ID: 1545076
CIF file	Formula: - Fe2 O5 P - Comments: Ijjaali, M.; Malaman, B.; Gleitzer, C.; Warner, J. K.; Hriljac, J. A.; Cheetham, A. K. Stability, structure refinement, and magnetic properties of beta-Fe2(PO4)O Journal of Solid State Chemistry 86 (1990) 195-205 Space group: I 41/a m d :2 Cell volume: 356.23 Cell parameters: 5.3417; 5.3417; 12.4846; 90; 90; 90;

COD ID: 1555264

Formula: - C20.02 H28.86 O8 -
Comments: Cui, Peng; McMahon, David P.; Spackman, Peter R.; Alston, Ben M.; Little, Marc A.; Day, Graeme M.; Cooper, Andrew I. Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights Chemical Science 10(43) (2019) 9988
Space group: I 41/a m d :2
Cell volume: 1986
Cell parameters: 16.429; 16.429; 7.358; 90; 90; 90;

COD ID: 1555282
CIF file	Formula: - C57 H28 O16 Zr3 - Comments: Zhang, Yingmu; Pang, Jiandong; Li, Jialuo; Yang, Xinyu; Feng, Mingbao; Cai, Peiyu; Zhou, Hong-Cai Visible-light harvesting pyrene-based MOFs as efficient ROS generators Chemical Science 10(36) (2019) 8455 Space group: I 41/a m d :2 Cell volume: 22434 Cell parameters: 15.092; 15.092; 98.494; 90; 90; 90;

COD ID: 1560989

Formula: - Eu0.15 O7 S3 Si2 Y3.85 -
Comments: Tarasenko, Maria S.; Berezin, Alexey S.; Kiryakov, Alexander S.; Piryazev, Dmitry A.; Filatova, Irina Yu.; Naumov, Nikolay G. Synthesis, crystal structure and photoluminescence of Eu3+ or Tb3+ doped solid solutions (Y1-xREx)4S3(Si2O7) Journal of Solid State Chemistry 265 (2018) 36-41
Space group: I 41/a m d :2
Cell volume: 1846.7
Cell parameters: 11.6506; 11.6506; 13.6054; 90; 90; 90;

COD ID: 1560990

Formula: - O7 S3 Si2 Tb2 Y2 -
Comments: Tarasenko, Maria S.; Berezin, Alexey S.; Kiryakov, Alexander S.; Piryazev, Dmitry A.; Filatova, Irina Yu.; Naumov, Nikolay G. Synthesis, crystal structure and photoluminescence of Eu3+ or Tb3+ doped solid solutions (Y1-xREx)4S3(Si2O7) Journal of Solid State Chemistry 265 (2018) 36-41
Space group: I 41/a m d :2
Cell volume: 1860.2
Cell parameters: 11.6794; 11.6794; 13.637; 90; 90; 90;

COD ID: 1561315

Formula: - C46 H29 Cu3 N4 O13 -
Comments: Wei, Lian-Qiang; Li, Yue; Mao, Li-Yuan; Chen, Qing; Lin, Ning A series of porous metal‒organic frameworks with hendecahedron cage: Structural variation and drug slow release properties Journal of Solid State Chemistry 257 (2018) 58-63
Space group: I 41/a m d :2
Cell volume: 22994.7
Cell parameters: 19.5046; 19.5046; 60.444; 90; 90; 90;

COD ID: 1561316

Formula: - C50 H29 Cu3 N2 O13 -
Comments: Wei, Lian-Qiang; Li, Yue; Mao, Li-Yuan; Chen, Qing; Lin, Ning A series of porous metal‒organic frameworks with hendecahedron cage: Structural variation and drug slow release properties Journal of Solid State Chemistry 257 (2018) 58-63
Space group: I 41/a m d :2
Cell volume: 23221.5
Cell parameters: 19.6856; 19.6856; 59.9228; 90; 90; 90;

COD ID: 1561317

Formula: - C42 H25 Cu3 N0 O15 -
Comments: Wei, Lian-Qiang; Li, Yue; Mao, Li-Yuan; Chen, Qing; Lin, Ning A series of porous metal‒organic frameworks with hendecahedron cage: Structural variation and drug slow release properties Journal of Solid State Chemistry 257 (2018) 58-63
Space group: I 41/a m d :2
Cell volume: 23469.7
Cell parameters: 19.8736; 19.8736; 59.423; 90; 90; 90;

COD ID: 1561318

Formula: - C46 H27 Cu3 N2 O13 -
Comments: Wei, Lian-Qiang; Li, Yue; Mao, Li-Yuan; Chen, Qing; Lin, Ning A series of porous metal‒organic frameworks with hendecahedron cage: Structural variation and drug slow release properties Journal of Solid State Chemistry 257 (2018) 58-63
Space group: I 41/a m d :2
Cell volume: 23131.2
Cell parameters: 19.5653; 19.5653; 60.4261; 90; 90; 90;

COD ID: 1561856
CIF file	Formula: - Ag1.06 Ce2 Ge2.94 - Comments: Sarkar, Sumanta; Mumbaraddi, Dundappa; Halappa, Pramod; Kalsi, Deepti; Rayaprol, Sudhindra; Peter, Sebastian C. Structure and physical properties of RE2AgGe3 (RE=Ce, Pr, Nd) compounds Journal of Solid State Chemistry 229 (2015) 287-295 Space group: I 41/a m d :2 Cell volume: 268.44 Cell parameters: 4.2754; 4.2754; 14.6855; 90; 90; 90;

COD ID: 1561857
CIF file	Formula: - Ag1.23 Ge2.77 Pr2 - Comments: Sarkar, Sumanta; Mumbaraddi, Dundappa; Halappa, Pramod; Kalsi, Deepti; Rayaprol, Sudhindra; Peter, Sebastian C. Structure and physical properties of RE2AgGe3 (RE=Ce, Pr, Nd) compounds Journal of Solid State Chemistry 229 (2015) 287-295 Space group: I 41/a m d :2 Cell volume: 262.68 Cell parameters: 4.2401; 4.2401; 14.611; 90; 90; 90;

COD ID: 1561858
CIF file	Formula: - Ag1.08 Ge2.92 Nd2 - Comments: Sarkar, Sumanta; Mumbaraddi, Dundappa; Halappa, Pramod; Kalsi, Deepti; Rayaprol, Sudhindra; Peter, Sebastian C. Structure and physical properties of RE2AgGe3 (RE=Ce, Pr, Nd) compounds Journal of Solid State Chemistry 229 (2015) 287-295 Space group: I 41/a m d :2 Cell volume: 255.39 Cell parameters: 4.1886; 4.1886; 14.557; 90; 90; 90;

COD ID: 1563568
CIF file	Formula: - Ce Ir2 Si - Comments: Gribanov, Alexander; Grytsiv, Andriy; Rogl, Peter; Seropegin, Yurii; Giester, Gerald X-ray structural study of intermetallic alloys RT2Si and RTSi2 (R=rare earth, T=noble metal) Journal of Solid State Chemistry 183(6) (2010) 1278-1289 Space group: I 41/a m d :2 Cell volume: 586.48 Cell parameters: 4.0698; 4.0698; 35.4085; 90; 90; 90;

COD ID: 1564910

Formula: - C24 H15 Br3 Fe3 O16 -
Comments: Bara, Dominic; Meekel, Emily G.; Pakamorė, Ignas; Wilson, Claire; Ling, Sanliang; Forgan, Ross S. Exploring and expanding the Fe-terephthalate metal-organic framework phase space by coordination and oxidation modulation. Materials horizons 8(12) (2021) 3377-3386
Space group: I 41/a m d :2
Cell volume: 14054.1
Cell parameters: 16.3069; 16.3069; 52.852; 90; 90; 90;

COD ID: 1566643
CIF file	Formula: - D2 O - Comments: Kuhs, W. F.; Finney, J. L.; Vettier, C.; Bliss, D. V. Structure and hydrogen ordering in ices VI, VII, and VIII by neutron powder diffraction Journal of Chemical Physics 81 (1984) 3612 Space group: I 41/a m d :2 Cell volume: 148.46 Cell parameters: 4.669; 4.669; 6.81; 90; 90; 90;

COD ID: 1566658
CIF file	Formula: - D2 O - Comments: Jorgensen, J. D.; Beyerlein, R. A.; Watanabe, N.; Worlton, T. G. Structure of D2O ice VIII from in situ powder neutron diffraction The Journal of Chemical Physics 81 (1984) 3211 Space group: I 41/a m d :2 Cell volume: 148.87 Cell parameters: 4.6779; 4.6779; 6.8029; 90; 90; 90;

COD ID: 1566661
CIF file	Formula: - D2 O - Comments: Besson, J. M.; Pruzan, Ph.; Klotz, S.; Hamel, G.; Silvi, B.; Nelmes, R. J.; Loveday, J. S.; Wilson, R. M.; Hull, S. Variation of interatomic distances in ice VIII to 10 GPa Physical Review B 49 (1984) 12540 Space group: I 41/a m d :2 Cell volume: 126.95 Cell parameters: 4.4493; 4.4493; 6.413; 90; 90; 90;

COD ID: 1566662
CIF file	Formula: - D2 O - Comments: Komatsu, K.; Klotz, S.; Machida, S.; Sano-Furukawa, A.; Hattori, T.; Kagi, H. Anomalous hydrogen dynamics of the ice VII-VIII transition revealed by high-pressure neutron diffraction Proceedings of the National Academy of Sciences 117 (2020) 6356 Space group: I 41/a m d :2 Cell volume: 121.475 Cell parameters: 4.39005; 4.39005; 6.303; 90; 90; 90;

COD ID: 2002207
CIF file	Formula: - Ag6 O8 S Si - Comments: Keller, H L; Mueller-Buschbaum, Hk Zur Kenntnis von Ag6 S O4 Si O4 Zeitschrift fuer Anorganische und Allgemeine Chemie 408 (1974) 205-208 Space group: I 41/a m d :2 Cell volume: 880.2 Cell parameters: 7.06; 7.06; 17.65999; 90; 90; 90;

COD ID: 2002215
CIF file	Formula: - Ba Cu2 O2 - Comments: Teske, C L; Mueller-Buschbaum, Hk Zur Kenntnis von Ba Cu2 O2 Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977) 27 (1972) 296-301 Space group: I 41/a m d :2 Cell volume: 329.5 Cell parameters: 5.722; 5.722; 10.064; 90; 90; 90;

COD ID: 2006190
CIF file Original IUCr paper	Formula: - Cr2 Cu O4 - Comments: W.A. Dollase; H.St.C. O'Neill The Spinels CuCr~2~O~4~ and CuRh~2~O~4~ Acta Crystallographica Section C 53(6) (1997) 657-659 Space group: I 41/a m d :2 Cell volume: 283.59 Cell parameters: 6.0341; 6.0341; 7.7888; 90; 90; 90;

COD ID: 2006191
CIF file Original IUCr paper	Formula: - Cu O4 Rh2 - Comments: W.A. Dollase; H.St.C. O'Neill The Spinels CuCr~2~O~4~ and CuRh~2~O~4~ Acta Crystallographica Section C 53(6) (1997) 657-659 Space group: I 41/a m d :2 Cell volume: 301.31 Cell parameters: 6.1756; 6.1756; 7.9006; 90; 90; 90;

COD ID: 2009227
CIF file Original IUCr paper	Formula: - Cr2 Ni O4 - Comments: Ueno, Go; Sato, Shoichi; Kino, Yoshihiro The low-temperature tetragonal phase of NiCr~2~O~4~ Acta Crystallographica Section C 55(12) (1999) 1963-1966 Space group: I 41/a m d :2 Cell volume: 286.29 Cell parameters: 5.8102; 5.8102; 8.4806; 90; 90; 90;

COD ID: 2010669

Formula: - Cr H2 O6 Zr -
Comments: Casari, Barbara M.; Langer, Vratislav Zirconium dihydroxide chromate Acta Crystallographica Section C 56(2) (2000) e36-e37
Space group: I 41/a m d :2
Cell volume: 1371.11
Cell parameters: 6.8709; 6.8709; 29.0432; 90; 90; 90;

COD ID: 2011899

Formula: - Li0.91 Mn2.09 O4 -
Comments: Björk, Helen; Dabkowska, Hanna; Greedan, John E.; Gustafsson, Torbjörn; Thomas, John O. (Li~0.91~Mn~0.09~)Mn~2~O~4~ Acta Crystallographica Section C 57(4) (2001) 331-332
Space group: I 41/a m d :2
Cell volume: 285.58
Cell parameters: 5.7502; 5.7502; 8.637; 90; 90; 90;

COD ID: 2012559
CIF file Original IUCr paper	Formula: - Cs H3 O2 - Comments: Černý, Radovan; Favre-Nicolin, Vincent; Bertheville, Bernard A tetragonal polymorph of caesium hydroxide monohydrate, CsOH·H~2~O, from X-ray powder data Acta Crystallographica Section C 58(3) (2002) i31-i32 Space group: I 41/a m d :2 Cell volume: 296.811 Cell parameters: 4.38088; 4.38088; 15.46525; 90; 90; 90;

COD ID: 2015674

Formula: - Ce K4 O16 P4 Zr -
Comments: Ogorodnyk, Ivan V.; Zatovsky, Igor V.; Baumer, Vyacheslav N.; Slobodyanik, Nikolay S.; Shishkin, Oleg V. A disordered cerium(IV) phosphate with a tunnel structure, K~4~CeZr(PO~4~)~4~ Acta Crystallographica Section C 62(12) (2006) i100-i102
Space group: I 41/a m d :2
Cell volume: 766.9
Cell parameters: 6.7039; 6.7039; 17.065; 90; 90; 90;

COD ID: 2020379
CIF file	Formula: - F6 Hg2.881 Nb - Comments: Tun, Z.; Brown, I.D.; Ummat, P.K. The Room-Temperature Structures of Mercury Niobium Fluoride, Hg3-d Nb F6, and Mercury Tantalum Fluoride, Hg3-d Ta F6 Acta Crystallographica C (39,1983-) 40 (1984) 1301-1303 Space group: I 41/a m d :2 Cell volume: 750.177 Cell parameters: 7.692; 7.692; 12.679; 90; 90; 90;

COD ID: 2020380
CIF file	Formula: - F6 Hg2.884 Ta - Comments: Tun, Z.; Brown, I.D.; Ummat, P.K. The Room-Temperature Structures of Mercury Niobium Fluoride, Hg3-d Nb F6, and Mercury Tantalum Fluoride, Hg3-d Ta F6 Acta Crystallographica C (39,1983-) 40 (1984) 1301-1303 Space group: I 41/a m d :2 Cell volume: 755.968 Cell parameters: 7.711; 7.711; 12.714; 90; 90; 90;

COD ID: 2100520

Formula: - C6 D7 N O -
Comments: Damay, F.; Carretero-Genevrier, A.; Cousson, A.; Rodriguez-Carvajal, J.; Van Beek, W.; Fillaux, F. Synchrotron and neutron diffraction study of 4-methylpyridine-N-oxide at low temperature Acta Crystallographica Section B 62(4) (2006) 627-633
Space group: I 41/a m d :2
Cell volume: 1236.01
Cell parameters: 7.9411; 7.9411; 19.6002; 90; 90; 90;

COD ID: 2102112
CIF file Original IUCr paper	Formula: ? Comments: Zhao, Yusheng; Chu, Fuming; Von Dreele, Robert B.; Zhu, Qing Structural phase transitions of HfV~2~ at low temperatures Acta Crystallographica Section B 56(4) (2000) 601-606 Space group: I 41/a m d :2 Cell volume: 200.683 Cell parameters: 5.20713; 5.20713; 7.40141; 90; 90; 90;

COD ID: 2102170
CIF file Original IUCr paper	Formula: - Hf0.01 O24 Si Zr0.99 - Comments: Ríos, Susana; Malcherek, Thomas; Salje, Ekhard K. H.; Domeneghetti, Chiara Localized defects in radiation-damaged zircon Acta Crystallographica Section B 56(6) (2000) 947-952 Space group: I 41/a m d :2 Cell volume: 263.6 Cell parameters: 6.618; 6.618; 6.019; 90; 90; 90;

COD ID: 2103469
CIF file Original IUCr paper	Formula: - Hg I2 - Comments: Hostettler, Marc; Birkedal, Henrik; Schwarzenbach, Dieter The structure of orange HgI~2~. I. Polytypic layer structure Acta Crystallographica Section B 58(6) (2002) 903-913 Space group: I 41/a m d :2 Cell volume: 1904.3 Cell parameters: 8.7863; 8.7863; 24.667; 90; 90; 90;

COD ID: 2104413
CIF file Original IUCr paper	Formula: - C2 H2 O4 Sr - Comments: Ståhl, Kenny; Andersen, Jens E. T.; Shim, Irene; Christgau, Stephan Structures of strontium diformate and strontium fumarate. A synchrotron powder diffraction study Acta Crystallographica Section B 65(4) (2009) 481-487 Space group: I 41/a m d :2 Cell volume: 511.274 Cell parameters: 7.09042; 7.09042; 10.16973; 90; 90; 90;

COD ID: 2104415
CIF file Original IUCr paper	Formula: - C4 H2 O4 Sr - Comments: Ståhl, Kenny; Andersen, Jens E. T.; Shim, Irene; Christgau, Stephan Structures of strontium diformate and strontium fumarate. A synchrotron powder diffraction study Acta Crystallographica Section B 65(4) (2009) 481-487 Space group: I 41/a m d :2 Cell volume: 525.769 Cell parameters: 7.24689; 7.24689; 10.01133; 90; 90; 90;

COD ID: 2105381
CIF file	Formula: - Ag8 O4 S2 Si - Comments: Schultze-Rhonhof, E. Die Kristallstruktur des Silbersulfidorthosilicates, Ag8 S2 Si O4 Acta Crystallographica B (24,1968-38,1982) 30 (1974) 2553-2558 Space group: I 41/a m d :2 Cell volume: 870.993 Cell parameters: 7.005; 7.005; 17.75; 90; 90; 90;

COD ID: 2106291
CIF file	Formula: - Cu16 O14.15 - Comments: Datta, N.; Jeffery, J.W. The crystal structure of paramelaconite, (Cu2+)12 (Cu+)4 O14 Acta Crystallographica B (24,1968-38,1982) 34 (1978) 22-26 Space group: I 41/a m d :2 Cell volume: 334.754 Cell parameters: 5.817; 5.817; 9.893; 90; 90; 90;

COD ID: 2107082
CIF file	Formula: - Cl4 Th - Comments: Mucker, K.F.; Smith, G.S.; Johnson, Q.; Elson, R.E. Refinement of the crystal structure of Th Cl4 Acta Crystallographica B (24,1968-38,1982) 25 (1969) 2362-2365 Space group: I 41/a m d :2 Cell volume: 537.571 Cell parameters: 8.486; 8.486; 7.465; 90; 90; 90;

COD ID: 2107221
CIF file	Formula: - Cs D1.17 O4 S - Comments: Belushkin, A. V.; David, W. I. F.; Shuvalov, L. A.; Ibberson, R. M. High-resolution neutron powder diffraction studies of the structure of CsDSO4 Acta Crystallographica B (39,1983-) 47(2) (1991) 161-166 Space group: I 41/a m d :2 Cell volume: 471.889 Cell parameters: 5.74147; 5.74147; 14.31508; 90; 90; 90;

COD ID: 2107283
CIF file Original IUCr paper	Formula: - Mn2 Si3.5 - Comments: Akselrud, L.; Cardoso Gil, R.; Wagner-Reetz, M.; Grin, Yu. Disorder in the composite crystal structure of the manganese `disilicide' MnSi~1.73~ from powder X-ray diffraction data Acta Crystallographica Section B 71(6) (2015) 707-712 Space group: I 41/a m d :2 Cell volume: 133.123 Cell parameters: 5.5235; 5.5235; 4.3634; 90; 90; 90;

COD ID: 2107379
CIF file	Formula: - S2 Zr9 - Comments: Cheng Horng, Y.; Franzen, H.F. The crystal structure of Zr9 S2 Acta Crystallographica B (24,1968-38,1982) 28 (1972) 1399-1404 Space group: I 41/a m d :2 Cell volume: 1827.47 Cell parameters: 9.752; 9.752; 19.216; 90; 90; 90;

COD ID: 2107538

Formula: - In31.14 S48 -
Comments: Pistor, Paul; Merino Álvarez, Jose M.; León, Máximo; di Michiel, Marco; Schorr, Susan; Klenk, Reiner; Lehmann, Sebastian Structure reinvestigation of α-, β- and γ-In~2~S~3~ Acta Crystallographica Section B 72(3) (2016) 410-415
Space group: I 41/a m d :2
Cell volume: 1880.4
Cell parameters: 7.6231; 7.6231; 32.358; 90; 90; 90;

COD ID: 2206092

Formula: - Ag0.28 Si1.72 Yb -
Comments: Bobev, Svilen; Bauer, Eric D. YbAg~x~Si~2{-~x} [x = 0.28(1)] with the tetragonal α-ThSi~2~ structure type Acta Crystallographica Section E 61(6) (2005) i96-i98
Space group: I 41/a m d :2
Cell volume: 235.82
Cell parameters: 4.0757; 4.0757; 14.1965; 90; 90; 90;

COD ID: 2207683
CIF file Original IUCr paper	Formula: - As O4 Yb - Comments: Kang, Dong-Hee; Höss, Patrick; Schleid, Thomas Xenotime-type Yb[AsO~4~] Acta Crystallographica, Section E 61(12) (2005) i270-i272 Space group: I 41/a m d :2 Cell volume: 303.4 Cell parameters: 6.9712; 6.9712; 6.2431; 90; 90; 90;

COD ID: 2210409

Formula: - C4 H11.44 Bi N O11.72 -
Comments: Yang, Jun-Ying; Fu, Yun-Long; Chu, Jia; Ng, Seik Weng Redetermination of ammonium bisoxalatobismuthate(III) x-hydrate from single-crystal data Acta Crystallographica Section E 62(9) (2006) m2310-m2312
Space group: I 41/a m d :2
Cell volume: 1261.22
Cell parameters: 11.674; 11.674; 9.2545; 90; 90; 90;

COD ID: 2222724

Formula: - C10 H6 Ca N4 O4 -
Comments: Zhang, Bing-Yu; Nie, Jing-Jing; Xu, Duan-Jun Poly[bis(μ~2~-pyrimidine-2-carboxylato-κ^4^O,N:O',N')calcium] Acta Crystallographica Section E 65(8) (2009) m878-m879
Space group: I 41/a m d :2
Cell volume: 1097.7
Cell parameters: 6.5312; 6.5312; 25.734; 90; 90; 90;

COD ID: 2229262

Formula: - O7 S3 Si2 Y4 -
Comments: Koscielski, Lukasz A.; Ibers, James A. Tetrayttrium(III) trisulfide disilicate Acta Crystallographica Section E 67(2) (2011) i16
Space group: I 41/a m d :2
Cell volume: 1850.6
Cell parameters: 11.6706; 11.6706; 13.5873; 90; 90; 90;

COD ID: 2300281
CIF file	Formula: - Co0.23 Mn0.52 O - Comments: Purwanto, A.; Fajar, A.; Mugirahardjo, H.; Fergus, J. W.; Wang, K. Cation distribution in spinel (Mn,Co,Cr)~3~O~4~ at room temperature Journal of Applied Crystallography 43(3) (2010) 394-400 Space group: I 41/a m d :2 Cell volume: 301.1 Cell parameters: 5.7184; 5.7184; 9.2079; 90; 90; 90;

COD ID: 2310376
CIF file	Formula: - O3 U - Comments: Engmann, R.; de Wolff, P.M. The crystal structure of gamma-U O3 Acta Crystallographica (1,1948-23,1967) 16 (1963) 993-996 Space group: I 41/a m d :2 Cell volume: 946.594 Cell parameters: 6.89; 6.89; 19.94; 90; 90; 90;

COD ID: 2310710
CIF file	Formula: - O2 Ti - Comments: Weirich, T. E.; Winterer, M.; Seifried, S.; Mayer, J. Structure of nanocrystalline anatase solved and refined from electron powder data Acta Crystallographica Section A 58(4) (2002) 308-315 Space group: I 41/a m d :2 Cell volume: 144.167 Cell parameters: 3.872; 3.872; 9.616; 90; 90; 90;

COD ID: 2310824
CIF file	Formula: - O64 V51.61 - Comments: Morinaga, M.; Cohen, J.B. The defect structure of V Ox. The ordered phase, V O1.3 Acta Crystallographica A (24,1968-38,1982) 35 (1979) 745-756 Space group: I 41/a m d :2 Cell volume: 1134.53 Cell parameters: 11.707; 11.707; 8.278; 90; 90; 90;

COD ID: 4000547
CIF file	Formula: - Fe1.375 O5 P - Comments: Chemistry of Materials (2005) Space group: I 41/a m d :2 Cell volume: 350.22 Cell parameters: 5.19183; 5.19183; 12.9927; 90; 90; 90;

COD ID: 4000552
CIF file	Formula: - Fe1.176 O5 P - Comments: Chemistry of Materials (2005) Space group: I 41/a m d :2 Cell volume: 349.78 Cell parameters: 5.18029; 5.18029; 13.0341; 90; 90; 90;

COD ID: 4000813
CIF file	Formula: - In2 S3 - Comments: Lafond, A.; Rocquefelte, X.; Paris, M.; Guillot-Deudon, C.; Jouenne, V. Crystal Chemistry and Electronic Structure of the Photovoltaic Buffer Layer, (In1-xAlx)2S3 Chemistry of Materials 23(23) (2011) 5168 Space group: I 41/a m d :2 Cell volume: 1879.23 Cell parameters: 7.6205; 7.6205; 32.3603; 90; 90; 90;

COD ID: 4000814
CIF file	Formula: - Al0.06 In1.94 S3 - Comments: Lafond, A.; Rocquefelte, X.; Paris, M.; Guillot-Deudon, C.; Jouenne, V. Crystal Chemistry and Electronic Structure of the Photovoltaic Buffer Layer, (In1-xAlx)2S3 Chemistry of Materials 23(23) (2011) 5168 Space group: I 41/a m d :2 Cell volume: 1865.2 Cell parameters: 7.6038; 7.6038; 32.26; 90; 90; 90;

COD ID: 4001046

Formula: - C4 H0 Ho K O12 -
Comments: Mohapatra, Sudip; Hembram, K. P. S. S.; Waghmare, Umesh; Maji, Tapas Kumar Immobilization of Alkali Metal Ions in a 3D Lanthanide-Organic Framework: Selective Sorption and H2Storage Characteristics Chemistry of Materials 21(22) (2009) 5406
Space group: I 41/a m d :2
Cell volume: 1171.92
Cell parameters: 11.4651; 11.4651; 8.9154; 90; 90; 90;

COD ID: 4001771

Formula: - C4 H8 Dy K O12 -
Comments: Mohapatra, Sudip; Rajeswaran, Bharath; Chakraborty, Anindita; Sundaresan, A.; Maji, Tapas Kumar Bimodal Magneto-Luminescent Dysprosium (DyIII)-Potassium (KI)-Oxalate Framework: Magnetic Switchability with High Anisotropic Barrier and Solvent Sensing Chemistry of Materials 25(9) (2013) 1673
Space group: I 41/a m d :2
Cell volume: 1180.8
Cell parameters: 11.5128; 11.5128; 8.9087; 90; 90; 90;

COD ID: 4001840
CIF file	Formula: - Er H5 O10 S2 - Comments: Wickleder, Mathias S. Synthesis, Crystal Structure, and Thermal Behavior of the Rare Earth Sulfates (H5O2)M(SO4)2(M = Ho, Er, Y) Chemistry of Materials 10(10) (1998) 3212 Space group: I 41/a m d :2 Cell volume: 816.49 Cell parameters: 6.8967; 6.8967; 17.166; 90; 90; 90;

COD ID: 4001894
CIF file	Formula: - Li Mn2 O4 - Comments: Wills, A. S.; Raju, N. P.; Greedan, J. E. Low-temperature structure and magnetic properties of the spinel LiMn~2~O~4~: a frustrated antiferromagnet and cathode material Chemistry of Materials 11(6) (1999) 1510-1518 Space group: I 41/a m d :2 Cell volume: 2515.5 Cell parameters: 17.51709; 17.51709; 8.198; 90; 90; 90;

COD ID: 4001895
CIF file	Formula: - Li Mn2 O4 - Comments: Wills, A. S.; Raju, N. P.; Greedan, J. E. Low-temperature structure and magnetic properties of the spinel LiMn~2~O~4~: a frustrated antiferromagnet and cathode material Chemistry of Materials 11(6) (1999) 1510-1518 Space group: I 41/a m d :2 Cell volume: 2524.38 Cell parameters: 17.54019; 17.54019; 8.20515; 90; 90; 90;

COD ID: 4030676
CIF file	Formula: - Bi2 Cd O4 - Comments: Champarnaud-mesjard, J.-C.; Frit, B.; Aftati, A.; El Farissi, M. Crystal structure of Bi2CdO4 European Journal of Solid State and Inorganic Chemistry 31 (1994) 473-486 Space group: I 41/a m d :2 Cell volume: 1958.38 Cell parameters: 14.4963; 14.4963; 9.3193; 90; 90; 90;

COD ID: 4031205

Formula: - Cl4 Th -
Comments: Brown, D.; Hall, T.L.; Moseley, P.T. Structural parameters and unit cell dimensions for the tetragonal actinide tetrachlorides (Th, Pa, U, and Np) and tetrabromides (Th and Pa) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1973 (1973) 686-691
Space group: I 41/a m d :2
Cell volume: 539.502
Cell parameters: 8.491; 8.491; 7.483; 90; 90; 90;

COD ID: 4031206

Formula: - Cl4 Pa -
Comments: Brown, D.; Hall, T.L.; Moseley, P.T. Structural Parameters and Unit Cell Dimensions for the Tetragonal Actinide Tetrachlorides (Th, Pa, U, and Np) and Tetrabromides (Th and Pa) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1973 (1973) 686-691
Space group: I 41/a m d :2
Cell volume: 524.973
Cell parameters: 8.377; 8.377; 7.481; 90; 90; 90;

COD ID: 4031207

Formula: - Cl4 Np -
Comments: Brown, D.; Moseley, P.T.; Hall, T.L. Structural Parameters and Unit Cell Dimensions for the Tetragonal Actinide Tetrachlorides (Th, Pa, U, and Np) and Tetrabromides (Th and Pa) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1973 (1973) 686-691
Space group: I 41/a m d :2
Cell volume: 507.542
Cell parameters: 8.25; 8.25; 7.457; 90; 90; 90;

COD ID: 4031208

Formula: - Br4 Th -
Comments: Brown, D.; Hall, T.L.; Moseley, P.T. Structural parameters and unit cell dimensions for the tetragonal actinide tetrachlorides (Th, Pa, U, and Np) and tetrabromides (Th and Pa) Journal of the Chemical Society. Dalton Transactions, Inorganic Chemistry (1972-) 1973 (1973) 686-691
Space group: I 41/a m d :2
Cell volume: 635.151
Cell parameters: 8.931; 8.931; 7.963; 90; 90; 90;

COD ID: 4031700
CIF file	Formula: - C12 Bi4 Co4 O12 - Comments: Ciani, G.; Moret, M.; Fumagalli, A.; Martinengo, S. Bi-Co heteronuclear carbonyl compounds. Synthesis and crystal structure of the cubane-like species (Co (C O)3 (mue3-Bi))4 Journal of Organometallic Chemistry 362 (1989) 291-296 Space group: I 41/a m d :2 Cell volume: 2294.58 Cell parameters: 14.731; 14.731; 10.574; 90; 90; 90;

COD ID: 4103728

Formula: - C32 H100 Co4 N16 O44 -
Comments: Shuang Wang; Tingting Zhao; Guanghua Li; Lukasz Wojtas; Qisheng Huo; Mohamed Eddaoudi; Yunling Liu From Metal-Organic Squares to Porous Zeolite-like Supramolecular Assemblies Journal of the American Chemical Society 132 (2010) 18038-18041
Space group: I 41/a m d :2
Cell volume: 7518
Cell parameters: 18.057; 18.057; 23.058; 90; 90; 90;

COD ID: 4103953

Formula: - C69 H62 N6 Na3 Ni O28.75 S4 -
Comments: Rita De Zorzi; Nicol Guidolin; Lucio Randaccio; Roberto Purrello; Silvano Geremia Nanoporous Crystals of Calixarene/Porphyrin Supramolecular Complex Functionalized by Diffusion and Coordination of Metal Ions Journal of the American Chemical Society 131 (2009) 2487-2489
Space group: I 41/a m d :2
Cell volume: 124695
Cell parameters: 49.646; 49.646; 50.592; 90; 90; 90;

COD ID: 4107507

Formula: - C40 H60 N4 O128 Si64 -
Comments: Darren H. Brouwer; Gary D. Enright Probing Local Structure in Zeolite Frameworks: Ultrahigh-Field NMR Measurements and Accurate First-Principles Calculations of Zeolite 29Si Magnetic Shielding Tensors Journal of the American Chemical Society 130 (2008) 3095-3105
Space group: I 41/a m d :2
Cell volume: 3597.44
Cell parameters: 10.2316; 10.2316; 34.3642; 90; 90; 90;

COD ID: 4108920

Formula: - H14 Na2 O11 S -
Comments: Iain D. H. Oswald; Andrea Hamilton; Christopher Hall; William G. Marshall; Timothy J. Prior; Colin R. Pulham In Situ Characterization of Elusive Salt Hydrates-The Crystal Structures of the Heptahydrate and Octahydrate of Sodium Sulfate Journal of the American Chemical Society 130 (2008) 17795-17800
Space group: I 41/a m d :2
Cell volume: 1127.57
Cell parameters: 7.1413; 7.1413; 22.1101; 90; 90; 90;

COD ID: 4112023

Formula: - C8 H25 Ag6 Cl N16 O7 -
Comments: Jie-Peng Zhang; Yan-Yong Lin; Wei-Xiong Zhang; Xiao-Ming Chen Temperature- or Guest-Induced Drastic Single-Crystal-to-Single-Crystal Transformations of a Nanoporous Coordination Polymer Journal of the American Chemical Society 127 (2005) 14162-14163
Space group: I 41/a m d :2
Cell volume: 3022.6
Cell parameters: 29.601; 29.601; 3.4496; 90; 90; 90;

COD ID: 4113071

Formula: - Li0.6 Mg0.03 Mn0.44 Ni0.03 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: I 41/a m d :2
Cell volume: 285
Cell parameters: 5.7375; 5.7375; 8.6575; 90; 90; 90;

COD ID: 4113072

Formula: - Li0.45 Mg0.03 Mn0.34 Ni0.14 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: I 41/a m d :2
Cell volume: 294
Cell parameters: 5.7175; 5.7175; 8.9936; 90; 90; 90;

COD ID: 4115442
CIF file	Formula: - Ga Nd Sb2 - Comments: Allison M. Mills; Arthur Mar Layered Rare-Earth Gallium Antimonides REGaSb2 (RE= La-Nd, Sm) Journal of the American Chemical Society 123 (2001) 1151-1158 Space group: I 41/a m d :2 Cell volume: 843 Cell parameters: 4.3486; 4.3486; 44.579; 90; 90; 90;

COD ID: 4117539
CIF file	Formula: - C40 Cd13 In22 N4 S52 - Comments: Tao Wu; Xianhui Bu; Puhong Liao; Le Wang; Shou-Tian Zheng; Richard Ma; Pingyun Feng Superbase Route to Supertetrahedral Chalcogenide Clusters Journal of the American Chemical Society 134 (2012) 3619-3622 Space group: I 41/a m d :2 Cell volume: 21066.1 Cell parameters: 28.0877; 28.0877; 26.7025; 90; 90; 90;

COD ID: 4117540
CIF file	Formula: - Cd13 In22 N4 S52 - Comments: Tao Wu; Xianhui Bu; Puhong Liao; Le Wang; Shou-Tian Zheng; Richard Ma; Pingyun Feng Superbase Route to Supertetrahedral Chalcogenide Clusters Journal of the American Chemical Society 134 (2012) 3619-3622 Space group: I 41/a m d :2 Cell volume: 21066.1 Cell parameters: 28.0877; 28.0877; 26.7025; 90; 90; 90;

COD ID: 4119419

Formula: - Co3 H2 O10 S2 -
Comments: Chinmayee V. Subban; Mohamed Ati; Gwenaëlle Rousse; Artem M. Abakumov; Gustaaf Van Tendeloo; Raphaël Janot; Jean-Marie Tarascon Preparation, Structure, and Electrochemistry of Layered Polyanionic Hydroxysulfates: LiMSO4OH (M = Fe, Co, Mn) Electrodes for Li-Ion Batteries Journal of the American Chemical Society 135 (2013) 3653-3661
Space group: I 41/a m d :2
Cell volume: 360.23
Cell parameters: 5.2969; 5.2969; 12.839; 90; 90; 90;

COD ID: 4119420

Formula: - Fe3 H2 O10 S2 -
Comments: Chinmayee V. Subban; Mohamed Ati; Gwenaëlle Rousse; Artem M. Abakumov; Gustaaf Van Tendeloo; Raphaël Janot; Jean-Marie Tarascon Preparation, Structure, and Electrochemistry of Layered Polyanionic Hydroxysulfates: LiMSO4OH (M = Fe, Co, Mn) Electrodes for Li-Ion Batteries Journal of the American Chemical Society 135 (2013) 3653-3661
Space group: I 41/a m d :2
Cell volume: 366.59
Cell parameters: 5.293; 5.293; 13.0851; 90; 90; 90;

COD ID: 4120111

Formula: - Cd6 In28 S56 -
Comments: Tao Wu; Qian Zhang; Yang Hou; Le Wang; Chengyu Mao; Shou-Tian Zheng; Xianhui Bu; Pingyun Feng Monocopper Doping in Cd-In-S Supertetrahedral Nanocluster via Two-Step Strategy and Enhanced Photoelectric Response Journal of the American Chemical Society 135 (2013) 10250-10253
Space group: I 41/a m d :2
Cell volume: 20752
Cell parameters: 26.8178; 26.8178; 28.8539; 90; 90; 90;

COD ID: 4120112

Formula: - Cd6 Cu0.4 In28 O4 S52 -
Comments: Tao Wu; Qian Zhang; Yang Hou; Le Wang; Chengyu Mao; Shou-Tian Zheng; Xianhui Bu; Pingyun Feng Monocopper Doping in Cd-In-S Supertetrahedral Nanocluster via Two-Step Strategy and Enhanced Photoelectric Response Journal of the American Chemical Society 135 (2013) 10250-10253
Space group: I 41/a m d :2
Cell volume: 20125.4
Cell parameters: 27.4878; 27.4878; 26.6357; 90; 90; 90;

COD ID: 4120113

Formula: - Cd6 Cu In28 O4 S52 -
Comments: Tao Wu; Qian Zhang; Yang Hou; Le Wang; Chengyu Mao; Shou-Tian Zheng; Xianhui Bu; Pingyun Feng Monocopper Doping in Cd-In-S Supertetrahedral Nanocluster via Two-Step Strategy and Enhanced Photoelectric Response Journal of the American Chemical Society 135 (2013) 10250-10253
Space group: I 41/a m d :2
Cell volume: 20225.5
Cell parameters: 27.5529; 27.5529; 26.6418; 90; 90; 90;

COD ID: 4120114

Formula: - Cd6 In28 S54 -
Comments: Tao Wu; Qian Zhang; Yang Hou; Le Wang; Chengyu Mao; Shou-Tian Zheng; Xianhui Bu; Pingyun Feng Monocopper Doping in Cd-In-S Supertetrahedral Nanocluster via Two-Step Strategy and Enhanced Photoelectric Response Journal of the American Chemical Society 135 (2013) 10250-10253
Space group: I 41/a m d :2
Cell volume: 18576
Cell parameters: 19.6365; 19.6365; 48.175; 90; 90; 90;

COD ID: 4120804

Formula: - C48 H26 N4 O16 Zr3 -
Comments: Hai-Long Jiang; Dawei Feng; Kecheng Wang; Zhi-Yuan Gu; Zhangwen Wei; Ying-Pin Chen; Hong-Cai Zhou An Exceptionally Stable, Porphyrinic Zr Metal-Organic Framework Exhibiting pH-Dependent Fluorescence Journal of the American Chemical Society 135 (2013) 13934-13938
Space group: I 41/a m d :2
Cell volume: 21527
Cell parameters: 16.581; 16.581; 78.3; 90; 90; 90;

COD ID: 4124518
CIF file	Formula: - Li0.026 O2 Ti - Comments: Wagemaker, M.; van Well, A.A.; Kearley, G.J.; Mutka, H.; Mulder, F.M. Multiple Li positions inside oxygen octahedra in lithiated Ti O2 anatase Journal of the American Chemical Society 125 (2003) 840-848 Space group: I 41/a m d :2 Cell volume: 136.557 Cell parameters: 3.7919; 3.7919; 9.4973; 90; 90; 90;

COD ID: 4133086

Formula: - C44 H24 N2 O44.544 S14.272 Zr3 -
Comments: Carter, Joseph H.; Han, Xue; Moreau, Florian Y.; da Silva, Ivan; Nevin, Adam; Godfrey, Harry G. W.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin Exceptional Adsorption and Binding of Sulfur Dioxide in a Robust Zirconium-Based Metal-Organic Framework. Journal of the American Chemical Society 140(46) (2018) 15564-15567
Space group: I 41/a m d :2
Cell volume: 28369.5
Cell parameters: 20.56; 20.56; 67.1128; 90; 90; 90;

COD ID: 4133087

Formula: - C38.13 H20 N1.73 O11.47 Zr2 -
Comments: Carter, Joseph H.; Han, Xue; Moreau, Florian Y.; da Silva, Ivan; Nevin, Adam; Godfrey, Harry G. W.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin Exceptional Adsorption and Binding of Sulfur Dioxide in a Robust Zirconium-Based Metal-Organic Framework. Journal of the American Chemical Society 140(46) (2018) 15564-15567
Space group: I 41/a m d :2
Cell volume: 28352.5
Cell parameters: 20.5905; 20.5905; 66.874; 90; 90; 90;

COD ID: 4133088

Formula: - C44 H24 N2 O16 Zr3 -
Comments: Carter, Joseph H.; Han, Xue; Moreau, Florian Y.; da Silva, Ivan; Nevin, Adam; Godfrey, Harry G. W.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin Exceptional Adsorption and Binding of Sulfur Dioxide in a Robust Zirconium-Based Metal-Organic Framework. Journal of the American Chemical Society 140(46) (2018) 15564-15567
Space group: I 41/a m d :2
Cell volume: 28593
Cell parameters: 20.7442; 20.7442; 66.4456; 90; 90; 90;

COD ID: 4133089

Formula: - C51.36 H24 N2 O28.72 Zr3 -
Comments: Carter, Joseph H.; Han, Xue; Moreau, Florian Y.; da Silva, Ivan; Nevin, Adam; Godfrey, Harry G. W.; Tang, Chiu C.; Yang, Sihai; Schröder, Martin Exceptional Adsorption and Binding of Sulfur Dioxide in a Robust Zirconium-Based Metal-Organic Framework. Journal of the American Chemical Society 140(46) (2018) 15564-15567
Space group: I 41/a m d :2
Cell volume: 28548.7
Cell parameters: 20.6839; 20.6839; 66.7301; 90; 90; 90;

COD ID: 4301933
CIF file	Formula: - C20 H20 Cl18 Co2 W6 - Comments: Sonja Tragl; Markus Ströbele; Jochen Glaser; Cristian Vicent; Rosa Llusar; H.-Jürgen Meyer Compounds with the Electron-Rich [W6Cl18]2- Cluster Anion Inorganic Chemistry 48 (2009) 3825-3831 Space group: I 41/a m d :2 Cell volume: 3974.3 Cell parameters: 13.4793; 13.4793; 21.874; 90; 90; 90;

COD ID: 4302866
CIF file	Formula: - Cl2 Cs2 N2 O6 Pb - Comments: Min Kyung Kim; Vinna Jo; Kang Min Ok New Variant of Highly Symmetric Layered Perovskite with Coordinated NO3- Ligand: Hydrothermal Synthesis, Structure, and Characterization of Cs2PbCl2(NO3)2 Inorganic Chemistry 48 (2009) 7368-7372 Space group: I 41/a m d :2 Cell volume: 1066.9 Cell parameters: 5.6905; 5.6905; 32.946; 90; 90; 90;

COD ID: 4307757

Formula: - C64 H84 Cu8 Mn12 N12 O70 -
Comments: Satoshi Yamashita; Takuya Shiga; Masashi Kurashina; Masayuki Nihei; Hiroyuki Nojiri; Hiroshi Sawa; Toru Kakiuchi; Hiroki Oshio Manganese(III,IV) and Manganese(III) Oxide Clusters Trapped by Copper(II) Complexes Inorganic Chemistry 46 (2007) 3810-3812
Space group: I 41/a m d :2
Cell volume: 12426
Cell parameters: 24.702; 24.702; 20.365; 90; 90; 90;

COD ID: 4310396
CIF file	Formula: - C4 Bi N O11.7 - Comments: G. Vanhoyland; A. Le Bail; J. Mullens; L. C. Van Poucke Characterization and structure determination of ammonium bismuth oxalate hydrate Bi(NH~4~)(C~2~O~4~)~2~.xH~2~O Inorganic Chemistry 43 (2004) 785-789 Space group: I 41/a m d :2 Cell volume: 1262.03 Cell parameters: 11.6896; 11.6896; 9.2357; 90; 90; 90;

COD ID: 4310466

Formula: - C8 H6 N4 Ni O2 -
Comments: Elisa Barea; Jorge A. R. Navarro; Juan M. Salas; Norberto Masciocchi; Simona Galli; Angelo Sironi Coordination Frameworks Containing the Pyrimidin-4-olate Ligand. Synthesis, Thermal, Magnetic, and ab Initio XRPD Structural Characterization of Nickel and Zinc Derivatives Inorganic Chemistry 43 (2004) 473-481
Space group: I 41/a m d :2
Cell volume: 888.22
Cell parameters: 6.51413; 6.51413; 20.9318; 90; 90; 90;

COD ID: 4310718
CIF file	Formula: - C12 Mo4 N12 Na8 Se4 - Comments: Carmela Magliocchi; Xiaobing Xie; Timothy Hughbanks Cyanide-Melt Synthesis of Reduced Molybdenum Selenide Clusters Inorganic Chemistry 43 (2004) 1902-1911 Space group: I 41/a m d :2 Cell volume: 2608.9 Cell parameters: 15.362; 15.362; 11.055; 90; 90; 90;

COD ID: 4319054

Formula: - Ag2 Cu2 O3 -
Comments: Eva M. Tejada-Rosales; Juan Rodríguez-Carvajal; Nieves Casañ-Pastor; Pere Alemany; Eliseo Ruiz; M. Salah El-Fallah; Santiago Alvarez; Pedro Gómez-Romero Room-Temperature Synthesis and Crystal, Magnetic, and Electronic Structure of the First Silver Copper Oxide Inorganic Chemistry 41 (2002) 6604-6613
Space group: I 41/a m d :2
Cell volume: 370.35
Cell parameters: 5.8862; 5.8862; 10.6892; 90; 90; 90;

COD ID: 4320451

Formula: - C24 H20 As4 Mo12 O50 -
Comments: Bret J. S. Johnson; Rick C. Schroden; Changcheng Zhu; Andreas Stein Synthesis and Characterization of 2D and 3D Structures from Organic Derivatives of Polyoxometalate Clusters: Role of Organic Moiety, Counterion, and Solvent Inorganic Chemistry 40 (2001) 5972-5978
Space group: I 41/a m d :2
Cell volume: 9425
Cell parameters: 28.45; 28.45; 11.645; 90; 90; 90;

COD ID: 4329903
CIF file	Formula: - C75 H129 Cu3 N11 O37 - Comments: Chao Hou; Qing Liu; Jian Fan; Yue Zhao; Peng Wang; Wei-Yin Sun Novel (3,4,6)-Connected Metal-Organic Framework with High Stability and Gas-Uptake Capability Inorganic Chemistry 51 (2012) 8402-8408 Space group: I 41/a m d :2 Cell volume: 22491 Cell parameters: 19.156; 19.156; 61.292; 90; 90; 90;

COD ID: 4337659
CIF file	Formula: - Co8 H4 O20 P4 - Comments: Wang, Guangmei; Valldor, Martin; Spielberg, Eike T.; Mudring, Anja-Verena Ionothermal Synthesis, Crystal Structure, and Magnetic Study of Co2PO4OH Isostructural with Caminite. Inorganic chemistry 53(6) (2014) 3072-3077 Space group: I 41/a m d :2 Cell volume: 358.64 Cell parameters: 5.2713; 5.2713; 12.907; 90; 90; 90;

COD ID: 4340365

Formula: - C27 H15 O17 Zr3 -
Comments: Wang, Rongming; Wang, Zhiying; Xu, Yuwen; Dai, Fangna; Zhang, Liangliang; Sun, Daofeng Porous Zirconium Metal-Organic Framework Constructed from 2D ρightarrow 3D Interpenetration Based on a 3,6-Connected kgd Net. Inorganic chemistry 53(14) (2014) 7086-7088
Space group: I 41/a m d :2
Cell volume: 24211
Cell parameters: 34.4985; 34.4985; 20.3429; 90; 90; 90;

COD ID: 4340937

Formula: - Co Mn2 O4 -
Comments: Habjanič, Jelena; Jurić, Marijana; Popović, Jasminka; Molčanov, Krešimir; Pajić, Damir A 3D oxalate-based network as a precursor for the CoMn₂O₄ spinel: synthesis and structural and magnetic studies. Inorganic chemistry 53(18) (2014) 9633-9643
Space group: I 41/a m d :2
Cell volume: 303.65
Cell parameters: 5.7235; 5.7235; 9.2695; 90; 90; 90;

COD ID: 4341196

Formula: - As2 Cs2 O8 Th -
Comments: Yu, Na; Klepov, Vladislav V.; Modolo, Giuseppe; Bosbach, Dirk; Suleimanov, Evgeny V.; Gesing, Thorsten M.; Robben, Lars; Alekseev, Evgeny V. Morphotropy and Temperature-Driven Polymorphism in A2Th(AsO4)2 (A = Li, Na, K, Rb, Cs) Series. Inorganic chemistry 53(20) (2014) 11231-11241
Space group: I 41/a m d :2
Cell volume: 998.01
Cell parameters: 7.3205; 7.3205; 18.6231; 90; 90; 90;

COD ID: 4341306

Formula: - N O Ta -
Comments: Lüdtke, Tobias; Schmidt, Alexander; Göbel, Caren; Fischer, Anna; Becker, Nils; Reimann, Christoph; Bredow, Thomas; Dronskowski, Richard; Lerch, Martin Synthesis and Crystal Structure of δ-TaON, a Metastable Polymorph of Tantalum Oxide Nitride. Inorganic chemistry 53(21) (2014) 11691-11698
Space group: I 41/a m d :2
Cell volume: 155.367
Cell parameters: 3.91954; 3.91954; 10.1132; 90; 90; 90;

COD ID: 4343798
CIF file	Formula: - As0.94 F5.64 Hg2.8 - Comments: Schultz, A.J.; Williams, J.M.; Miro, N.D.; MacDiarmid, A.G.; Heeger, A.J. A neutron diffraction investigation of the crystal and molecular structure of the anisotropic superconductor Hg3 As F6 Inorganic Chemistry 17 (1978) 646-649 Space group: I 41/a m d :2 Cell volume: 706.074 Cell parameters: 7.549; 7.549; 12.39; 90; 90; 90;

COD ID: 4345176

Formula: - H1.97 O5.33 P V1.23 -
Comments: Vaughey, J. T.; Harrison, William T. A.; Jacobson, Allan J.; Gosborn, David P.; Johnson, Jack W. Synthesis, structure, and properties of two new vanadium(III) phosphates: VPO4.H2O and V1.23(PO4)(OH)0.69(H2O)0.31.0.33H2O Inorganic Chemistry 33 (1994) 2481-2487
Space group: I 41/a m d :2
Cell volume: 347.17
Cell parameters: 5.1811; 5.1811; 12.9329; 90; 90; 90;

COD ID: 4349282
CIF file	Formula: - C12 H32 I3 P4 Sc - Comments: Carravetta, Marina; Concistre, Maria; Levason, William; Reid, Gillian; Zhang, Wenjian Rare Neutral Diphosphine Complexes of Scandium(III) and Yttrium(III) Halides. Inorganic chemistry 55(24) (2016) 12890-12896 Space group: I 41/a m d :2 Cell volume: 4945.5 Cell parameters: 13.902; 13.902; 25.589; 90; 90; 90;

COD ID: 4501647
CIF file	Formula: - C20 H38 Cu4 I4 N8 O3 - Comments: Zhang, Ying; Wu, Tao; Liu, Rui; Dou, Tao; Bu, Xianhui; Feng, Pingyun Three-Dimensional Photoluminescent Frameworks Constructed from Size-Tunable CuI Clusters Crystal Growth & Design 10(5) (2010) 2047 Space group: I 41/a m d :2 Cell volume: 6710.6 Cell parameters: 17.028; 17.028; 23.1439; 90; 90; 90;

COD ID: 4501809
CIF file	Formula: - O4 Sc V - Comments: Cong, Hengjiang; Zhang, Huaijin; Yao, Bin; Yu, Wentao; Zhao, Xian; Wang, Jiyang; Zhang, Guangcai ScVO4: Explorations of Novel Crystalline Inorganic Optical Materials in Rare-Earth Orthovanadate Systems Crystal Growth & Design 10(10) (2010) 4389 Space group: I 41/a m d :2 Cell volume: 282.92 Cell parameters: 6.7885; 6.7885; 6.1392; 90; 90; 90;

COD ID: 4502534

Formula: - C10 H6 Cd N12 -
Comments: Zhang, Jian-Yong; Cheng, Ai-Ling; Sun, Qian; Yue, Qi; Gao, En-Qing Syntheses, Structures, and Properties of Honeycomb and Square Grid Coordination Polymers with In Situ Formed 5-(2′-Pyrimidyl)tetrazolate Crystal Growth & Design 10(7) (2010) 2908
Space group: I 41/a m d :2
Cell volume: 1372.86
Cell parameters: 6.469; 6.469; 32.806; 90; 90; 90;

COD ID: 4511737

Formula: - C14 H12 Li2 O10 -
Comments: Aliev, Sokhrab B.; Samsonenko, Denis G.; Rakhmanova, Mariana I.; Dybtsev, Danil N.; Fedin, Vladimir P. Syntheses and Structural Characterization of Lithium Carboxylate Frameworks and Guest-Dependent Photoluminescence Study Crystal Growth & Design 14(9) (2014) 4355
Space group: I 41/a m d :2
Cell volume: 3029
Cell parameters: 17.301; 17.301; 10.1195; 90; 90; 90;

COD ID: 4513638

Formula: - C48 H24 Cu2 N8 O56 P W12 -
Comments: Liao, Jian-Zhen; Wu, Xiao-Yuan; Yong, Jian-Ping; Zhang, Hai-Long; Yang, Wen-Bing; Yu, Rongmin; Lu, Can-Zhong Anion−π Interaction-Directed Assembly of Polyoxometalate-Based Host‒Guest Compounds and Its Contribution to Photochromism Crystal Growth & Design 15(10) (2015) 4952
Space group: I 41/a m d :2
Cell volume: 15032.6
Cell parameters: 19.4044; 19.4044; 39.924; 90; 90; 90;

COD ID: 4514076

Formula: - C46 H26 O16 Zr3 -
Comments: Wang, Bin; Yang, Qi; Guo, Chao; Sun, Yuxiu; Xie, Lin-Hua; Li, Jian-Rong Stable Zr(IV)-Based Metal-Organic Frameworks with Predesigned Functionalized Ligands for Highly Selective Detection of Fe(III) Ions in Water. ACS applied materials & interfaces 9(11) (2017) 10286-10295
Space group: I 41/a m d :2
Cell volume: 28720.7
Cell parameters: 20.707; 20.707; 66.9823; 90; 90; 90;

COD ID: 4514077

Formula: - C44 H24 N2 O16 Zr3 -
Comments: Wang, Bin; Yang, Qi; Guo, Chao; Sun, Yuxiu; Xie, Lin-Hua; Li, Jian-Rong Stable Zr(IV)-Based Metal-Organic Frameworks with Predesigned Functionalized Ligands for Highly Selective Detection of Fe(III) Ions in Water. ACS applied materials & interfaces 9(11) (2017) 10286-10295
Space group: I 41/a m d :2
Cell volume: 28455.5
Cell parameters: 20.6568; 20.6568; 66.6868; 90; 90; 90;

COD ID: 4514261

Formula: - C32 H100 Co4 N16 O44 -
Comments: Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces 9(39) (2017) 33521-33527
Space group: I 41/a m d :2
Cell volume: 7843
Cell parameters: 19.368; 19.368; 20.907; 90; 90; 90;

COD ID: 4514262

Formula: - C36 H102 Co4 N16 O41 -
Comments: Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces 9(39) (2017) 33521-33527
Space group: I 41/a m d :2
Cell volume: 7491
Cell parameters: 18.631; 18.631; 21.582; 90; 90; 90;

COD ID: 4514263

Formula: - C40 H106 Co4 N16 O39 -
Comments: Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces 9(39) (2017) 33521-33527
Space group: I 41/a m d :2
Cell volume: 8115
Cell parameters: 19.802; 19.802; 20.696; 90; 90; 90;

COD ID: 4514264

Formula: - C36 H102 Co4 N16 O41 -
Comments: Wang, Shuang; Belmabkhout, Youssef; Cairns, Amy J.; Li, Guanghua; Huo, Qisheng; Liu, Yunling; Eddaoudi, Mohamed Tuning Gas Adsorption Properties of Zeolite-like Supramolecular Assemblies with gis Topology via Functionalization of Isoreticular Metal-Organic Squares. ACS applied materials & interfaces 9(39) (2017) 33521-33527
Space group: I 41/a m d :2
Cell volume: 8130
Cell parameters: 19.959; 19.959; 20.408; 90; 90; 90;

COD ID: 4515408

Formula: - C27 H21 Co3 N9 O10 -
Comments: Ye, Yingxiang; Chen, Shimin; Chen, Liangji; Huang, Jitao; Ma, Zhenlin; Li, Ziyin; Yao, Zizhu; Zhang, Jindan; Zhang, Zhangjing; Xiang, Shengchang Additive-Induced Supramolecular Isomerism and Enhancement of Robustness in Co(II)-Based MOFs for Efficiently Trapping Acetylene from Acetylene-Containing Mixtures. ACS applied materials & interfaces 10(36) (2018) 30912-30918
Space group: I 41/a m d :2
Cell volume: 19494.4
Cell parameters: 17.7497; 17.7497; 61.8767; 90; 90; 90;

COD ID: 5000119
CIF file	Formula: - Zr Si O4 - Comments: Robinson, K.; Gibbs, G. V.; Ribbe, P. H. The structure of zircon: A comparison with garnet American Mineralogist 56 (1971) 782-790 Space group: I 41/a m d :2 Cell volume: 261.1 Cell parameters: 6.607; 6.607; 5.982; 90; 90; 90;

COD ID: 5910171
CIF file	Formula: - Ho O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 319.125 Cell parameters: 7.1214; 7.1214; 6.2926; 90; 90; 90;

COD ID: 5910204
CIF file	Formula: - Ce O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 355.625 Cell parameters: 7.399; 7.399; 6.496; 90; 90; 90;

COD ID: 5910211
CIF file	Formula: - As O4 Sc - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 275.223 Cell parameters: 6.7101; 6.7101; 6.1126; 90; 90; 90;

COD ID: 5910221
CIF file	Formula: - O4 Sm V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 337.57 Cell parameters: 7.266; 7.266; 6.394; 90; 90; 90;

COD ID: 5910222
CIF file	Formula: - Lu O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 307.591 Cell parameters: 7.026; 7.026; 6.231; 90; 90; 90;

COD ID: 5910223
CIF file	Formula: - O4 Tm V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 313.144 Cell parameters: 7.071; 7.071; 6.263; 90; 90; 90;

COD ID: 5910233
CIF file	Formula: - Gd O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 330.191 Cell parameters: 7.211; 7.211; 6.35; 90; 90; 90;

COD ID: 5910246
CIF file	Formula: - Nd O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 345.683 Cell parameters: 7.329; 7.329; 6.4356; 90; 90; 90;

COD ID: 5910248
CIF file	Formula: - As O4 Tb - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 320.511 Cell parameters: 7.1025; 7.1025; 6.3536; 90; 90; 90;

COD ID: 5910256
CIF file	Formula: - As O4 Tl - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 306.181 Cell parameters: 6.9939; 6.9939; 6.2595; 90; 90; 90;

COD ID: 5910257
CIF file	Formula: - As Lu O4 - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 301.098 Cell parameters: 6.952; 6.952; 6.23; 90; 90; 90;

COD ID: 5910259
CIF file	Formula: - As O4 Tm - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 306.544 Cell parameters: 7; 7; 6.256; 90; 90; 90;

COD ID: 5910276
CIF file	Formula: - As Eu O4 - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 327.319 Cell parameters: 7.1541; 7.1541; 6.3953; 90; 90; 90;

COD ID: 5910297
CIF file	Formula: - O4 Tb V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 325.927 Cell parameters: 7.179; 7.179; 6.324; 90; 90; 90;

COD ID: 5910299
CIF file	Formula: - Er O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 316.524 Cell parameters: 7.1; 7.1; 6.279; 90; 90; 90;

COD ID: 5910300
CIF file	Formula: - O4 V Yb - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 309.925 Cell parameters: 7.043; 7.043; 6.248; 90; 90; 90;

COD ID: 5910303
CIF file	Formula: - B O4 Ta - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 211.767 Cell parameters: 6.213; 6.213; 5.486; 90; 90; 90;

COD ID: 5910304
CIF file	Formula: - O4 Pr V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 351.036 Cell parameters: 7.367; 7.367; 6.468; 90; 90; 90;

COD ID: 5910311
CIF file	Formula: - Bi O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 344.1 Cell parameters: 7.2999; 7.2999; 6.4573; 90; 90; 90;

COD ID: 5910313
CIF file	Formula: - Be F12 Li6 Zr - Comments: Wyckoff, R. W. G. Pages 57 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 4 (1951) 57-57 Space group: I 41/a m d :2 Cell volume: 803.73 Cell parameters: 6.57; 6.57; 18.62; 90; 90; 90;

COD ID: 5910322
CIF file	Formula: - Dy O4 V - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 322.141 Cell parameters: 7.1434; 7.1434; 6.313; 90; 90; 90;

COD ID: 5910341
CIF file	Formula: - As Ho O4 - Comments: Wyckoff, R. W. G. Pages 15 & 17 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951 The Structure of Crystals 3 (1951) 15-17 Space group: I 41/a m d :2 Cell volume: 314.344 Cell parameters: 7.0548; 7.0548; 6.3159; 90; 90; 90;

COD ID: 7001236
CIF file	Formula: - Fe1.5 H2 O5 P - Comments: Redrup, Kate V.; Weller, Mark T. Synthesis and crystal structures of iron hydrogen phosphates Dalton Transactions (issue 19) (2009) 3786-3792 Space group: I 41/a m d :2 Cell volume: 351.29 Cell parameters: 5.2061; 5.2061; 12.9609; 90; 90; 90;

COD ID: 7009160
CIF file	Formula: - In10 S18 - Comments: Cahill, Christopher L.; Parise, J. B. On the formation of framework indium sulfides Journal of the Chemical Society, Dalton Transactions (issue 9) (2000) 1475 Space group: I 41/a m d :2 Cell volume: 6552.55 Cell parameters: 11.7958; 11.7958; 47.0929; 90; 90; 90;

COD ID: 7013942

Formula: - C13 H13 Cl3 Cu2 I2 N4 -
Comments: Solntsev, Pavlo V.; Sieler, Joachim; Krautscheid, Harald; Domasevitch, Konstantin V. Fused pyridazines: rigid multidentates for designing and fine-tuning the structure of hybrid organic/inorganic frameworks. Dalton transactions (Cambridge, England : 2003) (issue 8) (2004) 1153-1158
Space group: I 41/a m d :2
Cell volume: 4075.5
Cell parameters: 17.614; 17.614; 13.136; 90; 90; 90;

COD ID: 7018492

Formula: - C44 H44 N12 O12 Zn2 -
Comments: Richards, Victoria J.; Argent, Stephen P.; Kewley, Adam; Blake, Alexander J.; Lewis, William; Champness, Neil R. Supramolecular isomers of metal-organic frameworks: the role of a new mixed donor imidazolate-carboxylate tetradentate ligand. Dalton transactions (Cambridge, England : 2003) 41(14) (2012) 4020-4026
Space group: I 41/a m d :2
Cell volume: 5994
Cell parameters: 19.496; 19.496; 15.769; 90; 90; 90;

COD ID: 7018686

Formula: - C4 H4 Cu N6 -
Comments: Grzywa, Maciej; Denysenko, Dmytro; Hanss, Jan; Scheidt, Ernst-Wilhelm; Scherer, Wolfgang; Weil, Matthias; Volkmer, Dirk CuN(6) Jahn-Teller centers in coordination frameworks comprising fully condensed Kuratowski-type secondary building units: phase transitions and magneto-structural correlations. Dalton transactions (Cambridge, England : 2003) 41(14) (2012) 4239-4248
Space group: I 41/a m d :2
Cell volume: 2662.6
Cell parameters: 11.8447; 11.8447; 18.9782; 90; 90; 90;

COD ID: 7020137

Formula: - C24.48 H29 Ca3 O17.37 -
Comments: Nielsen, Renie Birkedal; Norby, Poul; Kongshaug, Kjell Ove; Fjellvåg, Helmer Synthesis, crystal structure and thermal properties of Ca6(C12H14O4)4(CO3)(OH)2(H2O)x‒a 3D inorganic hybrid material. Dalton transactions (Cambridge, England : 2003) 41(39) (2012) 12082-12089
Space group: I 41/a m d :2
Cell volume: 13440
Cell parameters: 29.1153; 29.1153; 15.8546; 90; 90; 90;

COD ID: 7021639

Formula: - C38 H72 N2 O4 P4 Pt6 -
Comments: Anselmi, Martina; Bonuccelli, Veronica; Funaioli, Tiziana; Leoni, Piero; Marchetti, Fabio; Marchetti, Lorella; Mohapatra, Swagat Kumar; Pasquali, Marco Synthesis and electrochemical characterization of hexanuclear platinum bis-pseudohalides. Dalton transactions (Cambridge, England : 2003) 42(30) (2013) 10855-10866
Space group: I 41/a m d :2
Cell volume: 5396.4
Cell parameters: 17.4421; 17.4421; 17.738; 90; 90; 90;

COD ID: 7023131
CIF file	Formula: - Ba O9 P2 U - Comments: Villa, Eric M.; Diwu, Juan; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E Structural changes within the alkaline earth uranyl phosphites. Dalton transactions (Cambridge, England : 2003) 42(26) (2013) 9637-9644 Space group: I 41/a m d :2 Cell volume: 824.1 Cell parameters: 6.8496; 6.8496; 17.566; 90; 90; 90;

COD ID: 7036237

Formula: - C14.08 H15.28 In N1.04 O10 -
Comments: Bu, Fei; Lin, Qipu; Zhai, Quan-Guo; Bu, Xianhui; Feng, Pingyun Charge-tunable indium-organic frameworks built from cationic, anionic, and neutral building blocks. Dalton transactions (Cambridge, England : 2003) 44(38) (2015) 16671-16674
Space group: I 41/a m d :2
Cell volume: 2952.2
Cell parameters: 9.746; 9.746; 31.081; 90; 90; 90;

COD ID: 7037540

Formula: - C9 H20 Br N3 O6 Pt -
Comments: Xu, Zoufeng; Wang, Zhigang; Yiu, Shek-Man; Zhu, Guangyu Mono- and di-bromo platinum(iv) prodrugs via oxidative bromination: synthesis, characterization, and cytotoxicity. Dalton transactions (Cambridge, England : 2003) 44(46) (2015) 19918-19926
Space group: I 41/a m d :2
Cell volume: 6864.22
Cell parameters: 16.8735; 16.8735; 24.1091; 90; 90; 90;

COD ID: 7038109

Formula: - C46 H28 Cu3 N2 O13 -
Comments: Wei, Lian-Qiang; Chen, Qing; Tang, Li-Le; Zhuang, Chong; Zhu, Wen-Run; Lin, Ning A porous metal-organic framework with a unique hendecahedron-shaped cage: structure and controlled drug release. Dalton transactions (Cambridge, England : 2003) 45(9) (2016) 3694-3697
Space group: I 41/a m d :2
Cell volume: 22709.1
Cell parameters: 19.259; 19.259; 61.2256; 90; 90; 90;

COD ID: 7040217