# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-10T07:49:28+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Powder Diffraction') AND volume = 30 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
"3000041","6.36216","0.00017","12.7523","0.0004","11.4102","0.0003","90","","90","","90","","925.73","0.05","295","","295","","","","","","","","","3","P m n 21","P 2ac -2","31","","","","- Al3 Cs6 F15 -","- Al3 Cs6 F15 -","- Al6 Cs12 F30 -","2","0.5","","Armel Le Bail; Lubomir Smrcok","Face-sharing octahedra in Cs~2~AlF~5~ and Cs~3~Al~2~F~9~","Powder Diffraction","2015","30","2","130","138","10.1017/S0885715614001444","powder diffraction","","1.5418","CuKα","","","","","","","","","3.953","2.569","","","","","","","has coordinates","176722","2020-10-21","18:00:00",""
"3000042","6.2535","0.00019","6.2535","0.00019","14.7193","0.0006","90","","90","","120","","498.5","0.03","295","","295","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","","","- Al2 Cs3 F9 -","- Al2 Cs3 F9 -","- Al4 Cs6 F18 -","2","0.0833333","","Armel Le Bail; Lubomir Smrcok","Face-sharing octahedra in Cs~2~AlF~5~ and Cs~3~Al~2~F~9~","Powder Diffraction","2015","30","2","130","138","10.1017/S0885715614001444","powder diffraction","","1.5418","CuKα","","","","","","","","","5.9856","3.154","","","","","","","has coordinates","176722","2020-10-21","18:00:00",""