# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-07-24T21:45:00+02:00
# 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 'Plos One') AND volume = 7 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
"1548559","8.6489","0.0013","10.414","0.0015","27.136","0.004","90","","90","","90","","2444.1","0.6","140","2","140","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C27 H25 Cl N2 O5 -","- C27 H25 Cl N2 O5 -","- C108 H100 Cl4 N8 O20 -","4","1","","Muneer Ahamed; Bun Chan; Paul Jensen; Matthew H. Todd","The Outcome of the Oxidations of Unusual Enediamide Motifs Is Governed by the Stabilities of the Intermediate Iminium Ions","Plos One","2012","7","","47224","","10.1371/journal.pone.0047224","","","0.71073","MoKα","","0.0685","0.0334","","","0.0366","0.0397","","","","","","0.934","","","","has coordinates","301779","2025-08-18","16:06:53",""
"1548560","10.449","0.002","15.744","0.002","10.855","0.002","90","","100.646","0.005","90","","1755","0.5","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H22 N2 O4 -","- C19 H22 N2 O4 -","- C76 H88 N8 O16 -","4","1","","Muneer Ahamed; Bun Chan; Paul Jensen; Matthew H. Todd","The Outcome of the Oxidations of Unusual Enediamide Motifs Is Governed by the Stabilities of the Intermediate Iminium Ions","Plos One","2012","7","","47224","","10.1371/journal.pone.0047224","","","0.71073","MoKα","","0.0591","0.0504","","","0.1324","0.1398","","","","","","1.043","","","","has coordinates","301779","2025-08-18","16:06:54",""