# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T20:59:25+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 'Zeitschrift fuer Kristallographie (149,1979-)') AND volume = 164 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
"1007084","7.268","0.004","8.151","0.005","7.851","0.005","121.52","0.05","102.06","0.05","73","0.05","378.3","","","","","","","","","","","","","4","P -1","-P 1","2","","Lead tetrasodium cyclo-triphosphate","","- Na4 O18 P6 Pb -","- Na4 O18 P6 Pb -","- Na4 O18 P6 Pb -","1","0.5","","Averbuch-Pouchot, M T; Durif, A","Crystal structure of lead-tetrasodium trimetaphosphate: Pb Na~4~ (P~3~ O~9~)~2~, Crystal data for Ba Na~4~ (P~3~ O~9~)~2~","Zeitschrift fuer Kristallographie (149,1979-)","1983","164","","307","313","","","","","","","0.049","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008176","14.258","0.003","22.686","0.004","13.503","0.003","90","","90","","90","","4367.6","","","","","","","","","","","","","7","C c c a :2","-C 2a 2ac","68","","Copper(I) 1,2dithiooxalicacidamide chloride hydrate","","- C3 H6.9 Cl Cu N3 O0.45 S3 -","- C3 H6.9 Cl Cu N3 O0.45 S3 -","- C48 H110.4 Cl16 Cu16 N48 O7.2 S48 -","16","1","","Mosset, A; Abboudi, M; Galy, J","Synthese, structure moleculaire et cristalline d'un rubeanate de cuivre(I): Cu Cl (C~2~ N~2~ S~2~ H~4~)~1.5~ (H~2~ O)~0.45~","Zeitschrift fuer Kristallographie (149,1979-)","1983","164","","171","180","","","","","","","0.051","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1008177","15.576","0.003","6.923","0.003","11.416","0.003","90","","90","","90","","1231","","","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","Copper(I) 1,2dithiooxalicacidamide chloride","","- C2 H4 Cl Cu N2 S2 -","- C2 H4 Cl Cu N2 S2 -","- C16 H32 Cl8 Cu8 N16 S16 -","8","1","","Mosset, A; Abboudi, M; Galy, J","Etude structurale, par diffraction des rayons X, du rubeanate de cuivre(I): Cu Cl (C~2~ N~2~ S~2~ H~4~)","Zeitschrift fuer Kristallographie (149,1979-)","1983","164","","181","188","","","","","","","0.074","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"8104346","9.586","","12.42","","14.645","","90","","106.62","","90","","1670.76","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Ni (H2 O)3 (B6 O7 (O H)6) C2 H5 O H (H2 O)0.42","","- C2 H14 B6 Ni O17.42 -","- C2 H14 B6 Ni O17.42 -","- C8 H56 B24 Ni4 O69.68 -","4","1","","Heller, G.; Schellhaas, J.","Die Kristallstruktur von Ni0.8 Mn0.2 (H2 O)3 (B6 O7 (O H)6) C2 H5 O H (H2 O)0.42; feste Loesungen von Metall(II)-Ionen in Nickelhexaborat","Zeitschrift fuer Kristallographie (149,1979-)","1983","164","","237","246","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104357","13.436","","13.436","","13.436","","90","","90","","90","","2425.55","","","","","","","","","","","","","3","P m -3 n","-P 4n 2 3","223","","(Si O2)46 (C O2)1.32 (N2)4.68 (C H4)2","","- N4.68 O92 Si46 -","- N4.68 O92 Si46 -","- N4.68 O92 Si46 -","1","0.0208333","","Gies, H.","Studies on clathrasils. III. Crystal structure of melanophlogite, a natural clathrate compound of silica","Zeitschrift fuer Kristallographie (149,1979-)","1983","164","","247","257","","","","","","","","","","","","","","","","","","","","","","has coordinates","173105","2020-10-21","18:00:00",""
"9008307","4.706","","5.553","","5.024","","90","","90","","90","","131.289","","","","","","","","","","","","Rakwana, Sri Lanka","3","P b c n","-P 2n 2ab","60","","","Srilankite","- O2 Ti0.67 Zr0.33 -","- O2 Ti0.67 Zr0.33 -","- O8 Ti2.68 Zr1.32 -","4","0.5","","Willgallis, A.; Hartl, H.","(Zr0.33Ti0.67)O2 - ein naturliches zirkonium-titanoxid mit alpha-PbO2-struktur Locality: Rakwana, Sri Lanka","Zeitschrift fur Kristallographie","1983","164","","59","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:58",""
"9008308","7.137","","12.37","","7.174","","90","","120.33","","90","","546.668","","","","","","","","","","","","Synthetic","2","C 1 2/c 1","-C 2yc","15","","","Coesite","- O2 Si -","- O2 Si -","- O32 Si16 -","16","2","","Sasaki, S.; Chen, H. K.; Prewitt, C. T.; Nakajima, Y.","Re-examination of ""P2_1/a coesite"" Note: z(O7), z(O8) corrected Note: This is not the structure of coesite, it is a model for a twin","Zeitschrift fur Kristallographie","1983","164","","67","77","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:58",""
"9008309","13.436","","13.436","","13.436","","90","","90","","90","","2425.55","","","","","","","","","","","","","4","P m -3 n","-P 4n 2 3","223","","","Melanophlogite","- C1.66 N2.34 O46 Si23 -","- C1.66 N2.34 O46 Si23 -","- C3.32 N4.68 O92 Si46 -","2","0.0416667","","Gies, H.","Studies on clathrasils. III. Crystal structure of melanophlogite, a natural clathrate compound of silica","Zeitschrift fur Kristallographie","1983","164","","247","257","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:58",""