# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-06T17:16:09+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P 4/n c c :1' 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
"1004051","8.51","0.001","8.51","0.001","5.814","0.001","90","","90","","90","","421.1","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","Bismuth copper oxide","","- Bi2 Cu O4 -","- Bi2 Cu O4 -","- Bi8 Cu4 O16 -","4","0.25","","Boivin, J C; Trehoux, J; Thomas, D","Etude structurale de Cu Bi~2~ O~4~","Bulletin de la Societe Francaise de Mineralogie et de Cristallographie (72,1949-100,1977)","1976","99","","193","196","","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1523244","10.941","","10.941","","6.0203","","90","","90","","90","","720.663","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Pu5 Rh3 -","- Pu5 Rh3 -","- Pu20 Rh12 -","4","0.25","","Beznosikova, A.V.; Chebotarev, N.T.; Luk'yanov, A.S.; Smirnova, A.E.; Chernyi, A.V.","Crystal structures of Pu5 Ru3, Pu5 Rh3, Pu5 Os3, Pu5 Ir3, Pu5 Pt3","Atomnaya Energiya","1974","37","","144","148","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523403","7.939","","7.939","","14.5","","90","","90","","90","","913.902","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ga3 Pr5 -","- Ga3 Pr5 -","- Ga12 Pr20 -","4","0.25","","Cirafici, S.; Franceschi, E.","The praseodymium-gallium system from 0 to 50 at.% Ga","Journal of the Less-Common Metals","1979","66","","137","143","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525398","5.924","","5.924","","18.13","","90","","90","","90","","636.25","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","K3 I O5","","- I K3 O5 -","- I K3 O5 -","- I4 K12 O20 -","4","0.25","","Troemel, M.; Doelling, H.","Die Kristallstruktur von K3 I O5","Zeitschrift fuer Anorganische und Allgemeine Chemie","1975","411","","41","48","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527173","7.1785","","7.1785","","10.742","","90","","90","","90","","553.545","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","K3 Be F5","","- Be F5 K3 -","- Be F5 K3 -","- Be4 F20 K12 -","4","0.25","","Boucherle, G.; Aleonard, S.","Diagramme d'equilibre du systeme Tl F - Be F2. Structure des Composes M3 Be F5","Materials Research Bulletin","1971","6","","525","536","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528253","7.716","","7.716","","14.223","","90","","90","","90","","846.79","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ga3 Gd5 -","- Ga3 Gd5 -","- Ga12 Gd20 -","4","0.25","","Zhao Jingthai; Corbett, J.D.","R5 Ga3 compounds of selected rare earth metals R: structure and properties","Journal of Alloys Compd.","1994","210","","1","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528254","8.068","","8.068","","14.756","","90","","90","","90","","960.507","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ga3 La5 -","- Ga3 La5 -","- Ga12 La20 -","4","0.25","","Zhao Jingthai; Corbett, J.D.","R5 Ga3 compounds of selected rare earth metals R: structure and properties","Journal of Alloys Compd.","1994","210","","1","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1528255","7.6474","","7.6474","","14.147","","90","","90","","90","","827.355","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ga3 Y5 -","- Ga3 Y5 -","- Ga12 Y20 -","4","0.25","","Zhao Jingthai; Corbett, J.D.","R5 Ga3 compounds of selected rare earth metals R: structure and properties","Journal of Alloys Compd.","1994","210","","1","7","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1537761","10.7","","10.7","","6.6","","90","","90","","90","","755.634","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","(U Se2)10.66","","- Se20 U10.2 -","- Se20 U10.2 -","- Se20 U10.2 -","1","0.0625","","Beck, H.P.; Dausch, W.","The refinement of alpha-U Se2, twinning in a Sr Br2-type structure","Journal of Solid State Chemistry","1989","80","","32","39","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1538965","8.424","","8.424","","12.728","","90","","90","","90","","903.227","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","Cs3 H (Mg H4)","","- Cs3 H5 Mg -","- Cs3 H5 Mg -","- Cs12 H20 Mg4 -","4","0.25","","Park, H.-H.; Pezat, M.; Darriet, B.","Mise en evidence de tetraedres (Mg H4)(2-) dans les phases Cs3 Mg H5 et Rb3 Mg H5","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (1984-1993)","1988","307","","555","558","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538966","8.051","","8.051","","12.348","","90","","90","","90","","800.38","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","Rb3 H (Mg H4)","","- H5 Mg Rb3 -","- H5 Mg Rb3 -","- H20 Mg4 Rb12 -","4","0.25","","Park, H.-H.; Pezat, M.; Darriet, B.","Mise en evidence de tetraedres (Mg H4)(2-) dans les phases Cs3 Mg H5 et Rb3 Mg H5","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (1984-1993)","1988","307","","555","558","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542137","6.952","","6.952","","10.76","","90","","90","","90","","520.034","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","Sr3 (Si O4) O","","- O5 Si Sr3 -","- O5 Si Sr3 -","- O20 Si4 Sr12 -","4","0.25","","Mansmann, M.","Die Kristallstruktur von Tribariumpentaoxometallaten(IV) und isotyper Verbindungen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1965","339","","52","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2000776","7.44","0.002","7.44","0.002","16.097","0.006","90","","90","","90","","891","0.5","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ba Cu O10 Si4 -","- Ba2 Cu4 O10 Si4 -","- Ba8 Cu16 O40 Si16 -","4","0.25","BX0572","Lin, H. C.; Liao, F. L.; Wang, S. L.","Structure of BaCuSi~4~O~10~","Acta Crystallographica Section C","1992","48","7","1297","1299","10.1107/S0108270192001203","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2000777","7.447","0.001","7.447","0.001","16.138","0.002","90","","90","","90","","895","0.2","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ba Cu O10 Si4 -","- Ba Cu O10 Si4 -","- Ba4 Cu4 O40 Si16 -","4","0.25","AB0258","Janczak, J.; Kubiak, R.","Refinement of the structure of barium copper silicate BaCu[Si~4~O~10~] at 300 K","Acta Crystallographica Section C","1992","48","7","1299","1301","10.1107/S0108270191014580","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176343","2020-10-21","18:00:00",""
"2100155","8.999","0.001","8.999","0.001","11.566","0.002","90","","90","","90","","936.6","0.2","200","","200","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- H18 O10 Sr -","- H18 O10 Sr -","- H72 O40 Sr4 -","4","0.25","BS5014","Ricci, John S.; Stevens, Raymond C.; McMullan, Richard K.; Klooster, Wim T.","Structure of strontium hydroxide octahydrate, Sr(OH)~2~·8H~2~O, at 20, 100 and 200K from neutron diffraction","Acta Crystallographica Section B","2005","61","4","381","386","10.1107/S0108768105013480","","neutron","1.1594","neutron","","0.038","0.038","","0.051","0.051","","","","1.069","1.069","1.069","","","","","has coordinates","282086","2023-03-28","13:50:54",""
"2100156","8.99","0.001","8.99","0.001","11.534","0.002","90","","90","","90","","932.2","0.2","100","","100","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- H18 O10 Sr -","- H18 O10 Sr -","- H72 O40 Sr4 -","4","0.25","BS5014","Ricci, John S.; Stevens, Raymond C.; McMullan, Richard K.; Klooster, Wim T.","Structure of strontium hydroxide octahydrate, Sr(OH)~2~·8H~2~O, at 20, 100 and 200K from neutron diffraction","Acta Crystallographica Section B","2005","61","4","381","386","10.1107/S0108768105013480","","neutron","1.1594","neutron","","0.037","0.037","","0.05","0.05","","","","1.128","1.128","1.128","","","","","has coordinates","282086","2023-03-28","13:50:54",""
"2100157","8.984","0.001","8.984","0.001","11.517","0.002","90","","90","","90","","929.6","0.2","20","","20","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- H18 O10 Sr -","- H18 O10 Sr -","- H72 O40 Sr4 -","4","0.25","BS5014","Ricci, John S.; Stevens, Raymond C.; McMullan, Richard K.; Klooster, Wim T.","Structure of strontium hydroxide octahydrate, Sr(OH)~2~·8H~2~O, at 20, 100 and 200K from neutron diffraction","Acta Crystallographica Section B","2005","61","4","381","386","10.1107/S0108768105013480","","neutron","1.1594","neutron","","0.031","0.031","","0.044","0.044","","","","1.079","1.079","1.079","","","","","has coordinates","282086","2023-03-28","13:50:54",""
"2310560","6.934","","6.934","","10.72","","90","","90","","90","","515.421","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","Sr3 (Si O4) O","","- O5 Si Sr3 -","- O5 Si Sr3 -","- O20 Si4 Sr12 -","4","0.25","","Dent Glasser, L.S.; Glasser, F.P.","Silicates M3 Si O5. I. Sr3 Si O5","Acta Crystallographica (1,1948-23,1967)","1965","18","","453","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310965","9","","9","","11.58","","90","","90","","90","","937.98","","","","","","","","","","","","","3","P 4/n c c :1","P 4ab 2n -1ab","130","","Sr (O H)2 (H2 O)8","","- H18 O10 Sr -","- O10 Sr -","- O40 Sr4 -","4","0.25","","Smith, H.G.","The crystal structure of strontium hydroxide octahydrate, Sr (O H)2 (H2 O)8","Acta Crystallographica (1,1948-23,1967)","1953","6","","604","609","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222852","8.436","","8.436","","16.535","","90","","90","","90","","1176.73","","","","","","","","","","","","","2","P 4/n c c :1","P 4ab 2n -1ab","130","","","","- Ba5 Si3 -","- Ba5 Si3 -","- Ba20 Si12 -","4","0.25","","Janzon, K.H.; Schaefer, H.; Weiss, A.","Die Kristallstruktur der Phase Ba5 Si3","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (2,1947-32,1977)","1966","21","","287","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8103941","7.314","","7.314","","15.168","","90","","90","","90","","811.406","","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","Ca Cu Si4 O10","","- Ca Cu O10 Si4 -","- Ca Cu O10 Si4 -","- Ca4 Cu4 O40 Si16 -","4","0.25","","Bensch, W.; Schur, M.","Crystal structure of calcium copper phyllo-decaoxotetrasilicate, Ca Cu Si4 O10","Zeitschrift fuer Kristallographie (149,1979-)","1995","210","","530","530","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9000027","7.495","","7.495","","16.05","","90","","90","","90","","901.609","","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","Gillespite","- Ba Fe O10 Si4 -","- Ba Fe O10 Si4 -","- Ba4 Fe4 O40 Si16 -","4","0.25","","Pabst, A.","Crystal structure of gillespite, BaFeSi4O10","American Mineralogist","1943","28","","372","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000418","7.5164","","7.5164","","16.0768","","90","","90","","90","","908.279","","","","","","","","100","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","Gillespite","- Ba Fe O10 Si4 -","- Ba Fe O10 Si4 -","- Ba4 Fe4 O40 Si16 -","4","0.25","","Hazen, R. M.; Burnham, C. W.","The crystal structures of gillespite I and II: A structure determination at high pressure P = 1 atm","American Mineralogist","1974","59","","1166","1176","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000935","7.378","","7.378","","15.119","","90","","90","","90","","823.001","","","","","","","","","","","","","4","P 4/n c c :1","P 4ab 2n -1ab","130","","","Gillespite","- Ca Cr O10 Si4 -","- Ca Cr O10 Si4 -","- Ca4 Cr4 O40 Si16 -","4","0.25","","Belsky, H. L.; Rossman, G. R.; Prewitt, C. T.; Gasparik, T.","Crystal structure and optical spectroscopy (300 to 2200 nm) of CaCrSi4O10","American Mineralogist","1984","69","","771","776","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:40",""