# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-01-08T05:26:57+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 Chemical & Engineering Data') AND volume = 56 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
"1501656","10.323","0.0018","11.261","0.002","16.139","0.003","89.022","0.003","71.794","0.002","66.99","0.002","1628.5","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C36 H26 Co N15 O -","- C36 H26 Co N15 O -","- C72 H52 Co2 N30 O2 -","2","1","","Li, Bing; Wei, Qing; Yang, Qi; Chen, Sanping; Gao, Shengli","Synthesis, Structure, and Thermophysical Properties of an Energetic Complex Co(3-(2-pyridyl)-5-(3′-pyridyl)-1H-1,2,4-triazole)3·H2O","Journal of Chemical & Engineering Data","2011","56","7","3043","","10.1021/je2000364","","","0.71073","MoKα","","0.1315","0.0633","","","0.1541","0.1971","","","","","","0.956","","","","has coordinates","176729","2020-10-21","18:00:00",""