# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-11T09:22:50+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 'Journal of Molecular Structure') AND volume = 706 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
"1536001","8.761","","11.957","","13.858","","90","","90","","90","","1451.7","","","","","","","","","","","","","4","P b c m","-P 2c 2b","57","","(Cu Br)2 P8 Se3","","- Br2 Cu2 P8 Se3 -","- Br2 Cu2 P8 Se3 -","- Br8 Cu8 P32 Se12 -","4","0.5","","Nilges, S.; Nilges, T.; Pfitzner, A.; Haeuseler, H.","(Cu Br)2 P8 Se3: preparation, structural, and vibrational sprectroscopic characterization of an adduct of P8 Se3 cages to Cu2 Br2 rhombs","Journal of Molecular Structure","2004","706","","89","94","","","","","","","","","","","","","","","","","","","","","","has coordinates","163554","2020-10-21","18:00:00",""