# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-01-31T15:33:17+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 'Kristallografiya') AND volume = 53 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
"1528348","12.549","","27.84","","7.091","","90","","90","","101.86","","2424.46","","","","","","","","","","","","","3","B 1 1 b","B -2b","9","","La (I O3)3","","- I3 La O9 -","- I3 La O9 -","- I36 La12 O108 -","12","3","","Belokoneva, E.L.","Prediction of the structures in the family of La (I O3)3 iodates based on topology and symmetry analysis within the OD theory","Kristallografiya","2008","53","","431","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528811","15.1","","15.11","","15.092","","90.06","","90.01","","89.93","","3443.4","","","","","","","","","","","","","7","P 1","P 1","1","","Ca16 (Mg2 (Si7 Al) (O31 (O H))) Cl4","","- Al Ca16 Cl4 H Mg2 O32 Si7 -","- Al Ca16 Cl4 Mg2 O32 Si7 -","- Al4 Ca64 Cl16 Mg8 O128 Si28 -","4","4","","Rastsvetaeva, R.K.; Zadov, A.E.; Chukanov, N.V.","Crystal structure of low-symmetry rondorfite","Kristallografiya","2008","53","","226","232","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528812","5.35","","6.909","","20.96","","90","","90","","90","","774.748","","","","","","","","","","","","","14","P 1 2/m 1","-P 2y","10","","(Ba1.44 K0.8 Na Ca0.76) Ti2 (Ti1.6 Nb0.2 Zr0.2) (Fe6 Mn1.5 Mg0.5) (Si2 O7)4 O2 (O H)8 F2","","- Ba1.44 Ca0.76 F2 Fe6 H8 K0.8 Mg0.5 Mn1.5 Na Nb0.2 O38 Si8 Ti3.6 Zr0.2 -","- Ba1.44 Ca0.76 F2 Fe6 K0.8 Mg0.5 Mn1.5 Na Nb0.2 O38 Si8 Ti3.6 Zr0.2 -","- Ba1.44 Ca0.76 F2 Fe6 K0.8 Mg0.5 Mn1.5 Na Nb0.2 O38 Si8 Ti3.6 Zr0.2 -","1","0.25","","Rastsvetaeva, R.K.; Chukanov, N.V.; Rozenberg, K.A.","Crystal structure of Jinshajiangite from the Norra Kaerr complex (Sweden)","Kristallografiya","2008","53","","593","596","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528888","15.261","","5.8027","","10.065","","90","","101.81","","90","","872.439","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Rb0.11 (N H4)0.89)3 H (S O4)2","","- H11.68 N2.67 O8 Rb0.33 S2 -","- N2.67 O8 Rb0.33 S2 -","- N10.68 O32 Rb1.32 S8 -","4","0.5","","Smirnov, L.S.; Wozniak, K.; Dominiak, P.; Loose, A.; Frontasyeva, M.V.; Baranov, A.I.; Natkaniec, I.; Pomyakushina, E.V.; Dolbinina, V.V.","Refinement of the crystal structure of [Rb(x) (N H4)(1-x)]3 H (S O4)2 (x = 0.11) by single-crystal x-ray and neutron diffraction: I. Phase II at 300 K","Kristallografiya","2008","53","","450","459","","","","","","","","","","","","","","","","","","","","","","has coordinates","151669","2020-10-21","18:00:00",""
"1528900","5.454","","5.454","","5.454","","90","","90","","90","","162.235","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Cd0.9 La0.1) F2.1","","- Cd0.9 F2.1 La0.1 -","- Cd0.9 F2.10012 La0.1 -","- Cd3.6 F8.40048 La0.4 -","4","0.0208333","","Sul'yanova, E.A.; Molchanov, V.N.; Sobolev, B.P.","Crystal growth and defect crystal structure of Cd F2 and nonstoichiometric phases Cd(1-x) R(x) F(2+x) (R= rare earth element or In). 5. Crystal structure of as-grown Cd(0.9) R(0.1) F(2.1) (R= La - Nd) single crystals: nanoclusters of structural defects","Kristallografiya","2008","53","","605","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","151715","2020-10-21","18:00:00",""
"1528901","5.457","","5.457","","5.457","","90","","90","","90","","162.503","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","(Cd0.9 Ce0.1) F2.1","","- Cd0.9 Ce0.1 F2.1 -","- Cd0.9 Ce0.1 F2.09996 -","- Cd3.6 Ce0.4 F8.39984 -","4","0.0208333","","Sul'yanova, E.A.; Molchanov, V.N.; Sobolev, B.P.","Crystal growth and defect crystal structure of Cd F2 and nonstoichiometric phases Cd(1-x) R(x) F(2+x) (R= rare earth element or In). 5. Crystal structure of as-grown Cd(0.9) R(0.1) F(2.1) (R= La - Nd) single crystals: nanoclusters of structural defects","Kristallografiya","2008","53","","605","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","151716","2020-10-21","18:00:00",""
"1528902","5.449","","5.449","","5.449","","90","","90","","90","","161.79","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Cd0.9 Pr0.1 F2.1","","- Cd0.9 F2.1 Pr0.1 -","- Cd0.9 F2.10012 Pr0.1 -","- Cd3.6 F8.40048 Pr0.4 -","4","0.0208333","","Sul'yanova, E.A.; Molchanov, V.N.; Sobolev, B.P.","Crystal growth and defect crystal structure of Cd F2 and nonstoichiometric phases Cd(1-x) R(x) F(2+x) (R = rare earth element or In). 5. Crystal structure of as-grown Cd(0.9) R(0.1) F(2.1) (R = La - Nd) single crystals: nanoclusters of structural defects","Kristallografiya","2008","53","","605","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","151717","2020-10-21","18:00:00",""
"1528903","5.448","","5.448","","5.448","","90","","90","","90","","161.7","","","","","","","","","","","","","3","F m -3 m","-F 4 2 3","225","","Cd0.9 Nd0.1 F2.1","","- Cd0.9 F2.1 Nd0.1 -","- Cd0.9 F2.10016 Nd0.1 -","- Cd3.6 F8.40064 Nd0.4 -","4","0.0208333","","Sul'yanova, E.A.; Molchanov, V.N.; Sobolev, B.P.","Crystal growth and defect crystal structure of Cd F2 and nonstoichiometric phases Cd(1-x) R(x) F(2+x) (R = rare earth element or In). 5. Crystal structure of as-grown Cd(0.9) R(0.1) F(2.1) (R = La - Nd) single crystals: nanoclusters of structural defects","Kristallografiya","2008","53","","605","611","","","","","","","","","","","","","","","","","","","","","","has coordinates","151718","2020-10-21","18:00:00",""