# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-05-15T06:18:21+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'R 3 c' 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
"1550827","9.867","0.0009","9.867","0.0009","36.735","0.003","90","","90","","120","","3097.3","0.5","100","2","100","2","","","","","","","synthetic","6","R 3 c","R 3 -2""c","161","Stepanovite","Sodium magnesium Iron(iii) oxalate nonahydrate","","- C6 H18 Fe Mg Na O21 -","- C6 H18 Fe Mg Na O21 -","- C36 H108 Fe6 Mg6 Na6 O126 -","6","","","Huskic, Igor; Novendra, Novendra; Lim, Dae-Woon; Topić, Filip; Titi, Hatem M.; Pekov, I. V.; Krivovichev, S.; Navrotsky, Alexandra; Kitagawa, Hiroshi; Friščić, Tomislav","Functionality in Metal-Organic Framework Minerals: Proton Conductivity, Stability and Potential for Polymorphism","Chemical Science","2019","","","","","10.1039/C8SC05088K","","x-ray","0.71073","MoKα","","0.0229","0.0225","","","0.0547","0.0549","","","","","","1.105","","","","has coordinates","214453","2020-10-21","18:00:00",""
"7047946","31.315","0.003","31.315","0.003","29.732","0.005","90","","90","","120","","25250","5","100","2","100","2","","","","","","","","7","R 3 c","R 3 -2""c","161","","","","- C52 H58 Co F6 N6 O2 P -","- C52 H58 Co F5.99999 N6 O2 P -","- C936 H1044 Co18 F108 N108 O36 P18.0001 -","18","","","Rajput, Amit; Sharma, Anuj K.; Barman, Suman K.; Lloret, Francesc; Mukherjee, Rabi","Six-coordinate [CoIII(L)2]z (z = 1‒, 0, 1+) complexes of an azo-appended o-aminophenolate in amidate(2‒) and iminosemiquinonate π-radical (1‒) redox-levels: existence of valence-tautomerism","Dalton Transactions","2018","","","","","10.1039/C8DT03257B","","","0.71073","MoKα","","0.1038","0.0786","","","0.1985","0.2197","","","","","","1.0419","","","","has coordinates,has disorder","211772","2020-10-21","18:00:00",""
"7232362","22.931","0.008","22.931","0.008","15.931","0.006","90","","90","","120","","7255","5","93","2","93.15","","","","","","","","","4","R 3 c","R 3 -2""c","161","","","","- C8 H4 O7 Zn2 -","- C8 H3.578 O7 Zn2 -","- C144 H64.404 O126 Zn36 -","18","","","Henkelis, Susan Elizabeth; Vornholt, Simon Maximilian; Cordes, David Bradford; Slawin, Alexandra; Wheatley, Paul Stewart S.; Morris, Russell","A single crystal study of CPO-27 and UTSA-74 for nitric oxide storage and release","CrystEngComm","2019","","","","","10.1039/C9CE00098D","","","0.71075","MoKα","","0.0456","0.0426","","","0.136","0.1386","","","","","","1.181","","","","has coordinates,has disorder","213647","2020-10-21","18:00:00",""