# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-22T07:31:16+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 'Acta Crystallographica, Section C: Crystal Structure Communications') AND volume = 40 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
"1100080","5.933","0.002","5.933","0.002","5.933","0.002","96.28","0.02","96.28","0.02","96.28","0.02","204.8","","","","","","","","","","","","","4","R 3 :R","P 3*","146","","Magnesium sulfate(IV) hexahydrate","","- H12 Mg O9 S -","- H12 Mg O9 S -","- H12 Mg O9 S -","1","0.333333","","Anderson, L.; Lindquist, O.","Neutron Diffraction Refinement of Magnesium Sulfite Hexahydrate, MgSO~3~.(H~2~O)~6~","Acta Crystallographica, Section C: Crystal Structure Communications","1984","40","4","584","586","10.1107/S0108270184004972","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","184397","2020-10-21","18:00:00",""
"2000049","7.924","0.003","12.154","0.005","7.188","0.003","90","","110.67","0.08","90","","647.702","","","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H18 N2 O11 Te -","- C4 H26 N2 O18 Te -","- C8 H52 N4 O36 Te2 -","2","0.5","","Qui, D. T.; Vicat, J.; Durif, A.","Structure of telluric acid-glycine (1:2) monohydrate, Te(OH)~6~ . 2C~2~H~5~NO~2~ . H2O, at 120 K and determination of hydrogen positions","Acta Crystallographica, Section C: Crystal Structure Communications","1984","40","1","181","184","10.1107/s0108270184003504","","","","","","","0.02","","","0.02","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""