# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T06:39:17+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (volume = 295 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
"1001326","10.883","","10.73","","10.674","","90","","95.67","","90","","1240.4","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Bis(octasulfur) diimidohexasulfur","","- H2 N2 S22 -","- H5 N2 S22 -","- H10 N4 S44 -","2","0.5","","Garcia-Fernandez, H; Gasperin, M; Freymann, R","Etude chimique structurale et spectrographique du complexe par transfert de charge 2S~8~-S~6~(N H)~2~","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1982","295","","1109","1112","","","","","","","0.066","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1007142","10.497","0.008","10.497","0.008","10.497","0.008","90","","90","","90","","1156.6","","","","","","","","","","","","","3","I -4 3 d","I -4bd 2c 3","220","","Bismuth germanate","","- Bi4 Ge3 O12 -","- Bi4 Ge3 O12 -","- Bi16 Ge12 O48 -","4","0.0833333","","Durif, A; Averbuch-Pouchot, M T","Affinement de la structure cristalline du germanate de bismuth Bi~4~ (Ge O~4~)~3~.","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1982","295","","555","556","","","","","","","0.017","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1529799","4.356","","6.701","","7.385","","116.79","","106.78","","90.71","","181.654","","","","","","","","","","","","","3","P 1","P 1","1","","Te2 Se2 O8","","- O8 Se2 Te2 -","- O8 Se2 Te2 -","- O8 Se2 Te2 -","1","1","","Delage, C.; Goursolle, M.; Carpy, A.","The Te O2 - Se O2 system. Crystal structure of Te2 Se2 O8.","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1982","295","","981","983","","","","","","","","","","","","","","","","","","","","","","has coordinates","154429","2020-10-21","18:00:00",""
"1530952","6.543","","7.406","","12.258","","90","","93.9","","90","","592.616","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Cu (Ga Cl4)2","","- Cl8 Cu Ga2 -","- Cl8 Cu Ga2 -","- Cl16 Cu2 Ga4 -","2","0.5","","Verries-Peylhard, C.","Synthesis, Raman spectrum and crystal structure of Cu (Ga Cl4)2","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie C, Sciences Chimiques (1966-)","1982","295","","171","174","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531357","3.87093","","3.60341","","13.01507","","90","","90","","90","","181.541","","","","","","","","","","","","","5","I m m m","-I 2 2","71","","La Sr Co O3 H0.7","","- Co H0.7 La O3 Sr -","- Co H0.7 La O3 Sr -","- Co2 H1.4 La2 O6 Sr2 -","2","0.125","","Hayward, M.A.; Claridge, J.B.; Cussen, E.J.; Bieringer, M.; Rosseinsky, M.J.; Pratt, F.L.; Kiely, C.J.; Marshall, I.M.; Blundell, S.J.","The hydride anion in an extended transition metal oxide array : La Sr Co O3 H0.7","Science","2002","295","","1882","1884","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1538284","4.378","","4.378","","9.348","","90","","90","","90","","179.172","","","","","","","","","","","","","3","I 41/a m d :1","I 4bw 2bw -1bw","141","","","","- In Li O2 -","- In Li O2 -","- In4 Li4 O8 -","4","0.125","","Hoppe, R.","Ueber Alkaliindate: Li ln O2 und Na ln O2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","233","233","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538554","3.79","","3.38","","8.03","","90","","90","","90","","102.866","","","","","","","","","","","","","3","P m m n :1","P 2 2ab -1ab","59","","Ti O Cl","","- Cl O Ti -","- Cl O Ti -","- Cl2 O2 Ti2 -","2","0.25","","Schaefer, H.; Wartenpfuhl, F.; Weise, E.","Titan(III)-oxychlorid","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","268","280","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541385","6.985","","6.985","","6.985","","90","","90","","90","","340.8","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","La.11 Sr.89 Cl2.11","","- Cl2.11 La0.11 Sr0.89 -","- Cl2.11 La0.11 Sr0.89 -","- Cl8.44 La0.44 Sr3.56 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172698","2020-10-21","18:00:00",""
"1541386","6.987","","6.987","","6.987","","90","","90","","90","","341.093","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Sr0.96 Th0.04) Cl2.08","","- Cl2.08 Sr0.96 Th0.04 -","- Cl2.08 Sr0.96 Th0.04 -","- Cl8.32 Sr3.84 Th0.16 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172699","2020-10-21","18:00:00",""
"1541387","6.999","","6.999","","6.999","","90","","90","","90","","342.853","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Th.08 Sr.92 Cl2.16","","- Cl2.16 Sr0.92 Th0.08 -","- Cl2.16 Sr0.92 Th0.08 -","- Cl8.64 Sr3.68 Th0.32 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172700","2020-10-21","18:00:00",""
"1541388","7.005","","7.005","","7.005","","90","","90","","90","","343.736","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Th.14 Sr.86 Cl2.28","","- Cl2.28 Sr0.86 Th0.14 -","- Cl2.28 Sr0.86 Th0.14 -","- Cl9.12 Sr3.44 Th0.56 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172701","2020-10-21","18:00:00",""
"1541389","7.018","","7.018","","7.018","","90","","90","","90","","345.653","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Th.18 Sr.82 Cl2.36","","- Cl2.36 Sr0.82 Th0.18 -","- Cl2.36 Sr0.82 Th0.18 -","- Cl9.44 Sr3.28 Th0.72 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172702","2020-10-21","18:00:00",""
"1541509","6.971","","6.971","","6.971","","90","","90","","90","","338.755","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Sr Cl2","","- Cl2 Sr -","- Cl2 Sr -","- Cl8 Sr4 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541511","6.949","","6.949","","6.949","","90","","90","","90","","335.557","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ca.10 Sr.90 Cl2","","- Ca0.1 Cl2 Sr0.9 -","- Ca0.1 Cl2 Sr0.9 -","- Ca0.4 Cl8 Sr3.6 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172855","2020-10-21","18:00:00",""
"1541513","6.939","","6.939","","6.939","","90","","90","","90","","334.111","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ca.15 Sr.85 Cl2","","- Ca0.15 Cl2 Sr0.85 -","- Ca0.15 Cl2 Sr0.85 -","- Ca0.6 Cl8 Sr3.4 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172857","2020-10-21","18:00:00",""
"1541514","6.931","","6.931","","6.931","","90","","90","","90","","332.957","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ca.175 Sr.825 Cl2","","- Ca0.175 Cl2 Sr0.825 -","- Ca0.175 Cl2 Sr0.825 -","- Ca0.7 Cl8 Sr3.3 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172859","2020-10-21","18:00:00",""
"1541515","7.008","","7.008","","7.008","","90","","90","","90","","344.177","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ba.12 Sr.88 Cl2","","- Ba0.12 Cl2 Sr0.88 -","- Ba0.12 Cl2 Sr0.88 -","- Ba0.48 Cl8 Sr3.52 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172860","2020-10-21","18:00:00",""
"1541517","7.041","","7.041","","7.041","","90","","90","","90","","349.062","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Ba.20 Sr.80 Cl2","","- Ba0.2 Cl2 Sr0.8 -","- Ba0.2 Cl2 Sr0.8 -","- Ba0.8 Cl8 Sr3.2 -","4","0.0208333","","Brauer, G.; Mueller, O.","Zur Kristallchemie des Strontiumchlorids","Zeitschrift fuer Anorganische und Allgemeine Chemie","1958","295","","218","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","172862","2020-10-21","18:00:00",""