# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-03T04:55:29+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 'Journal of Structural Chemistry') AND volume = 44 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
"1529382","8.2079","0.0007","13.096","0.001","13.65","0.001","90","","100.635","0.007","90","","1442","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C4 H5 N5 O3 -","- C4 H5 N5 O3 -","- C32 H40 N40 O24 -","8","2","","A.D. Vasiliev; A.M. Astakhov; V.E. Zadov; M.S. Molokeev; O.V. Bindarovich; L.A. Kruglyakova; R.S. Stepanov","Crystal and Molecular Structure of 5-Acetylamino-3-nitro-1,2,4-triazole","Journal of Structural Chemistry","2003","44","5","897","901","10.1023/B:JORY.0000029834.68326.fc","","","1.54051","","","0.0456","0.0349","","","0.0932","0.0989","","","","","","1.018","","","","has coordinates,has Fobs","153312","2020-10-21","18:00:00",""
"1529383","4.469","0.0002","15.566","0.001","9.4131","0.0007","90","","94.896","0.005","90","","652.43","0.07","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C2 H6 N6 O3 -","- C2 H6 N6 O3 -","- C8 H24 N24 O12 -","4","1","","A.M. Astakhov; A.D. Vasilev; M.S. Molokeev; Yu.V. Kekin; L.A. Kruglyakova; R.S. Stepanov","Crystal and Molecular Structure of 2-nitro-1-ureidoguanidine","Journal of Structural Chemistry","2003","44","2","326","329","10.1023/A:1025579614640","","","1.5406","","","0.0532","0.0473","","","0.1266","0.1315","","","","","","1.092","","","","has coordinates,has Fobs","153313","2020-10-21","18:00:00",""