# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-01T04:06:09+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 'Molecular Physics') AND volume = 77 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
"6000557","8.146","","5.8533","","7.9616","","90","","111.722","","90","","352.66","","","","1.5","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C Br F3 -","- C Br F3 -","- C4 Br4 F12 -","4","1","","Jouanneaux, A.; Fitch, A. N.; Cockcroft, J. K.","The crystal-structure of CBrF3 by high-resolution powder neutron-diffraction","Molecular Physics","1992","77","","45","50","10.1080/00268979200102301","","","","","","","","","","","","","","","","","","","","","has coordinates","208444","2020-10-21","18:00:00",""