# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-03-13T22:05:25+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'C m m 2' AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical'))
# ORDER BY file asc
file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold
"1010008","8.18","","8.29","","3.96","","90","","90","","90","","268.5","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Diamminecadmium chloride","","- Cd Cl2 H6 N2 -","- Cd Cl2 H6 N2 -","- Cd2 Cl4 H12 N4 -","2","0.25","","MacGillavry, C H; Bijvoet, J M","Die Kristallstruktur der Cadmium- und Quecksilber- Diammin-Dihalogenide","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1936","94","","231","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1010010","8.55","","8.55","","4.13","","90","","90","","90","","301.9","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Diamminecadmium bromide","","- Br2 Cd H6 N2 -","- Br2 Cd H6 N2 -","- Br4 Cd2 H12 N4 -","2","0.25","","MacGillavry, C H; Bijvoet, J M","Die Kristallstruktur der Cadmium- und Quecksilber- Diammin-Dihalogenide","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1936","94","","231","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1517037","23.195","0.01","6.51","0.005","6.894","0.005","90","","90","","90","","1041","1.2","293","2","293","2","","","","","","","","5","C m m 2","C 2 -2","35","","","","- C20 H20 Cd N6 O8 -","- C20 H20 Cd N6 O8 -","- C40 H40 Cd2 N12 O16 -","2","0.25","","Shantanu Hazra; Biswarup Sarkar; Subrata Naiya; Michael G.B. Drew; Ashutosh Ghosh","Structural variations in the complexes of cadmium(II), hexamethylenetetramine, and 2-, 3- and 4-nitrobenzoates","Inorganica Chimica Acta","2013","402","","12","19","","","","0.71073","MoKα","","0.059","0.059","","","0.1384","0.1384","","","","","","1.294","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518101","12.773","0.003","25.564","0.006","8.052","0.001","90","","90","","90","","2629.2","0.9","","","293","","","","","","","","","4","C m m 2","C 2 -2","35","","","","- F11 H12 N3 Sn3 -","- F11 H12 N3 Sn3 -","- F88 H96 N24 Sn24 -","8","1","","Soufiane, A.; Vilminot, S.","Sur un fluorure mixte d'etain II et IV : (NH4)3Sn3F11","Revue de Chimie Minerale","1985","22","","799","808","","","x-ray","0.71069","MoKα","","","0.042","","","","","","","","","","","","","","has coordinates","186596","2020-10-21","18:00:00",""
"1520511","5.6878","0.0003","5.723","0.0003","9.726","0.0006","90","","90","","90","","316.59","0.03","","","293","","","","","","","","","4","C m m 2","C 2 -2","35","","","","- Bi5 I2 O8.5 Te -","- Bi5 I2 O8.5 Te -","- Bi5 I2 O8.5 Te -","1","0.125","","Peter S. Berdonosov; Dmitry O. Charkin; Ardak M. Kusainova; Charles H. Hervoches; Valeriy A. Dolgikh; Philip Lightfoot","The crystal structures of BiTeO3I, NdTeO3X (X=Cl, Br) and Bi5TeO8.5I2: some crystal chemistry peculiarities of layered Bi(Ln)Te oxyhalides","Solid State Sciences","2000","2","","553","562","","powder diffraction","neutron","","white","","","","","","","","","","","","","","","","","has coordinates","139077","2020-10-21","18:00:00",""
"1520982","17.579","","17.509","","7.788","","90","","90","","90","","2397.07","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Sr6 (Sn2 Nb8 O30)","","- Nb8 O30 Sn2 Sr6 -","- Nb7.9997 O30 Sn2.0003 Sr6 -","- Nb31.9988 O120 Sn8.0012 Sr24 -","4","0.5","","Fang, L.; Wu, B.-L.; Zhang, H.; Yuan, R.-Z.","Synthesis and crystal structure of a new compound Sr6 Sn2 Nb8 O30","Journal of Wuhan University of Technology","1999","14","","35","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","140595","2020-10-21","18:00:00",""
"1530136","30.87","","7.387","","7.12","","90","","90","","90","","1623.62","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Na Nd Si6 O13 (O H)2 (H2 O)1.0","","- Na Nd O15 Si6 -","- Na Nd O15 Si6 -","- Na4 Nd4 O60 Si24 -","4","0.5","","Karpov, O.G.; Pushcharovskii, D.Yu.; Pobedimskaya, E.A.; Burshtein, I.F.; Belov, N.V.","The crystal structure of the rare-earth silicate Na Nd Si6 O13 (O H)2 *n(H2 O)","Doklady Akademii Nauk SSSR","1977","236","","593","596","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535735","12.31","","12.292","","5.366","","90","","90","","90","","811.954","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Ba2 Ge2 Ti O8","","- Ba2 Ge2 O8 Ti -","- Ba2 Ge2 O8 Ti -","- Ba8 Ge8 O32 Ti4 -","4","0.5","","Iijima, K.; Kimura, M.; Marumo, F.; Kawamura, T.","Structure of a ferroelastic crystal Ba2 Ti Ge2 O8 and its thermal phase transition.","Nippon Kagaku Kaishi (= J.Chem.Soc.Japan) (1947-)","1981","1981","","1557","1563","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538319","19.4","","3.62","","4.13","","90","","90","","90","","290.042","","","","","","","","","","","","","3","C m m 2","C 2 -2","35","","Mo V2 O8","","- Mo O8 V2 -","- Mo O8 V2 -","- Mo2 O16 V4 -","2","0.25","","Mahe-Pailleret, P.","Contribution a l'etude chimique et structurale des composes A B2 O8 rencontres dans les systemes Mo-V-O, U-V-O et U-Mo-O","Revue de Chimie Minerale","1970","7","","807","846","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2002329","14.358","","16.825","","5.321","","90","","90","","90","","1285.4","","","","","","","","","","","","","3","C m m 2","C 2 -2","35","","Tricalcium tetragallium oxide","","- Ca3 Ga4 O9 -","- Ca3 Ga4 O9 -","- Ca18 Ga24 O54 -","6","0.75","","Schulze, A R; Mueller-Buschbaum, Hk","Ueber Erdalkalimetalloxogallate (VIII) Synthese und Aufbau eines neuen Calciumoxogallats Ca3 Ga4 O9","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1981","112","","149","156","","","","","","","0.062","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2101673","7.385","0.002","30.831","0.007","7.1168","0.0013","90","","90","","90","","1620.4","0.6","","","","","","","","","","","","5","C m m 2","C 2 -2","35","","","","- H4 Na3 Nd O17 Si6 -","- H4 Na3.005 Nd O17 Si6 -","- H16 Na12.02 Nd4 O68 Si24 -","4","0.5","DU0411","Haile, S. M.; Wuensch, B. J.; Laudise, R. A.; Maier, J.","Structure of Na~3~NdSi~6~O~15~.2H~2~O ‒ a Layered Silicate with Paths for Possible Fast-Ion Conduction","Acta Crystallographica Section B","1997","53","1","7","17","10.1107/S0108768196009950","","","0.71073","MoKα","","","0.0267","","","0.0817","","","","","","","","","","","has coordinates","191104","2020-10-21","18:00:00",""
"2104697","7.4128","0.0001","30.9652","0.0006","7.1756","0.0001","90","","90","","90","","1647.08","0.05","293","2","293","2","","","","","","","","6","C m m 2","C 2 -2","35","Sodium Potassium Cerium Silicate Hydrate","Trisodium Cerium Phyllo-hexasilicate Dihydrate","","- Ce H4.5 K0.26 Na2.74 O17.25 Si6 -","- Ce K0.252 Na2.748 O17.25 Si6 -","- Ce4 K1.008 Na10.992 O69 Si24 -","4","0.5","WH5009","Cadoni, Marcella; Cheah, Yan Ling; Ferraris, Giovanni","New RE microporous heteropolyhedral silicates containing 4^1^5^1^6^1^8^2^ tetrahedral sheets","Acta Crystallographica Section B","2010","66","2","158","164","10.1107/S0108768109055359","","","0.71073","MoKα","","0.0365","0.0326","","","0.0901","0.0934","","","","","","0.644","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2104698","7.4217","0.0002","31.0393","0.0007","7.1962","0.0001","90","","90","","90","","1657.75","0.06","293","2","293","2","","","","","","","","6","C m m 2","C 2 -2","35","Sodium Potassium Lanthanum Silicate Hydrate","Trisodium Lanthanum Phyllo-hexasilicate Dihydrate","","- H4.5 K0.28 La Na2.72 O17.25 Si6 -","- K0.27 La Na2.73 O17.25 Si6 -","- K1.08 La4 Na10.92 O69 Si24 -","4","0.5","WH5009","Cadoni, Marcella; Cheah, Yan Ling; Ferraris, Giovanni","New RE microporous heteropolyhedral silicates containing 4^1^5^1^6^1^8^2^ tetrahedral sheets","Acta Crystallographica Section B","2010","66","2","158","164","10.1107/S0108768109055359","","","0.71073","MoKα","","0.0778","0.074","","","0.1706","0.1723","","","","","","1.378","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2104699","7.4153","0.0003","31.0018","0.0014","7.1532","0.0003","90","","90","","90","","1644.43","0.12","293","2","293","2","","","","","","","","5","C m m 2","C 2 -2","35","Sodium Lanthanum Silicate Hydrate","Trisodium Lanthanum Phyllo-hexasilicate Dihydrate","","- H4.5 La Na3 O17.25 Si6 -","- La Na3 O17.25 Si6 -","- La4 Na12 O69 Si24 -","4","0.5","WH5009","Cadoni, Marcella; Cheah, Yan Ling; Ferraris, Giovanni","New RE microporous heteropolyhedral silicates containing 4^1^5^1^6^1^8^2^ tetrahedral sheets","Acta Crystallographica Section B","2010","66","2","158","164","10.1107/S0108768109055359","","","0.71073","MoKα","","0.0548","0.0528","","","0.1491","0.15","","","","","","1.285","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2104700","7.3907","0.0001","30.8726","0.0006","7.1271","0.0001","90","","90","","90","","1626.19","0.04","293","2","293","2","","","","","","","","6","C m m 2","C 2 -2","35","Sodium Europium Lanthanum Silicate Hydrate","Trisodium Europium Lanthanum Phyllo-hexasilicate Dihydrate","","- Eu0.32 H5.28 La0.68 Na2.74 O17.51 Si6 -","- Eu0.32 La0.68 Na2.7 O17.55 Si6 -","- Eu1.28 La2.72 Na10.8 O70.2 Si24 -","4","0.5","WH5009","Cadoni, Marcella; Cheah, Yan Ling; Ferraris, Giovanni","New RE microporous heteropolyhedral silicates containing 4^1^5^1^6^1^8^2^ tetrahedral sheets","Acta Crystallographica Section B","2010","66","2","158","164","10.1107/S0108768109055359","","","0.71073","MoKα","","0.0587","0.0513","","","0.1324","0.1358","","","","","","1.044","","","","has coordinates","176768","2020-10-21","18:00:00",""
"3000498","5.6604","0.0013","5.6637","0.0013","4.0266","0.001","90","","90","","90","","129.09","0.05","296.15","","296.15","","","","","","","","","3","C m m 2","C 2 -2","","","","","- K Nb O3 -","","","","","","Junseong Lee","","To be published in Materials","","","","","","","","","0.71073","MoKα","","0.0356","0.0356","","","0.092","0.092","","","","","","1.197","","","","","291404","2024-04-29","02:04:16","2025-04-27"
"7219949","7.3669","0.0007","30.714","0.003","7.0885","0.0007","90","","90","","90","","1603.9","0.3","296","2","296","2","","","","","","","","4","C m m 2","C 2 -2","35","","","","- Eu Na3 O16.47 Si6 -","- Eu Na3 O16.47 Si6 -","- Eu4 Na12 O65.88 Si24 -","4","0.5","","Liu, Wei; Ji, Ying; Liu, Fuyang; Yang, Min; Wang, Ying; Zhao, Xudong; Liu, Xiaoyang","Synthesis, crystal structure, and luminescence properties of a new microporous europium silicate: Na3EuSi6O15•1.47H2O","RSC Adv.","2015","","","","","10.1039/C5RA00423C","","","0.71073","MoKα","","0.0353","0.0346","","","0.0947","0.0951","","","","","","1.196","","","","has coordinates","180530","2020-10-21","18:00:00",""
"7222200","7.4812","","18.1849","","3.741","","90","","90","","90","","508.944","","","","","","","","","","","","","4","C m m 2","C 2 -2","35","","Tl0.47 Sr2.53 Co O4.8","","- Co O4.8 Sr2.53 Tl0.47 -","- Co O4.8 Sr2.5275 Tl0.4726 -","- Co4 O19.2 Sr10.11 Tl1.8904 -","4","0.5","","Maignan, A.; Pelloquin, D.; Hervieu, M.; Martin, C.; Raveau, B.","A new form of oxygen deficient 1201-cobaltite (Tl0.4 Sr0.5 Co0.1) Sr2 Co O5-d: structure, transport and magnetic properties","Journal of Materials Chemistry","2002","12","","1009","1016","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7700287","8.61","0.003","17.215","0.006","5.733","0.002","90","","90","","90","","849.8","0.5","296","2","296.15","","","","","","","","","5","C m m 2","C 2 -2","35","","","","- Br Cd Cs3 O12 V4 -","- Br Cd Cs3 O12 V4 -","- Br2 Cd2 Cs6 O24 V8 -","2","0.25","","Li, Yanjun; Zhang, Dan; Liu, Lili; Zhang, Weiguo; Zhang, Jiang; Cong, Ye; Li, Xuanke; Halasyamani, P. Shiv","Cs<sub>2</sub>CdV<sub>2</sub>O<sub>6</sub>Cl<sub>2</sub> and Cs<sub>3</sub>CdV<sub>4</sub>O<sub>12</sub>Br: two new non-centrosymmetric oxyhalides containing d<sup>0</sup> and d<sup>10</sup> cations and exhibiting second harmonic generation activity.","Dalton transactions (Cambridge, England : 2003)","2019","48","28","10642","10651","10.1039/c9dt02099c","","","0.71073","MoKα","","0.014","0.0139","","","0.0352","0.0357","","","","","","1.077","","","","has coordinates","223768","2020-10-21","18:00:00",""
"9008052","8.196","","8.307","","3.968","","90","","90","","90","","270.158","","","","","","","","","","","","","3","C m m 2","C 2 -2","35","","","","- Cd Cl2 N2 -","- Cd Cl2 N2 -","- Cd2 Cl4 N4 -","2","0.25","","MacGillavry, C. H.; Bijvoet, J. M.","Die kristallstruktur der cadmium-und quecksilber-diammin-dihalogenide Locality: synthetic","Zeitschrift fur Kristallographie","1936","94","","231","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9008056","8.55","","8.55","","4.13","","90","","90","","90","","301.913","","","","","","","","","","","","","3","C m m 2","C 2 -2","35","","","","- Br2 Cd N2 -","- Br2 Cd N2 -","- Br4 Cd2 N4 -","2","0.25","","MacGillavry, C. H.; Bijvoet, J. M.","Die kristallstruktur der cadmium-und quecksilber-diammin-dihalogenide Locality: synthetic","Zeitschrift fur Kristallographie","1936","94","","231","245","","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9013945","7.971","","7.976","","27.341","","90","","90","","90","","1738.25","","","","","","","","","","","","San Rafael mine, Sierra Gorda, Chile","4","C m m 2","C 2 -2","35","","","Seeligerite","- Cl3 I O4 Pb3 -","- Cl3 I O4 Pb3 -","- Cl24 I8 O32 Pb24 -","8","1","","Bindi, L.; Welch, M. D.; Bonazzi, P.; Pratesi, G.; Menchetti, S.","The crystal structure of seeligerite, Pb3IO4Cl3, a rare Pb-I-oxychloride from the San Rafael mine, Sierra Gorda, Chile Locality: San Rafael mine, Sierra Gorda, Chile","Mineralogical Magazine","2008","71","","771","783","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""