# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T15:44:36+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 'Zeitschrift fur Kristallographie') AND volume = 169 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
"1008944","18.01399","0.008","8.535","0.003","11.584","0.005","90","","104.48","0.02","90","","1724.5","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Dibarium trilithium heptakis(catena-phosphate)","","- Ba2 Li3 O21 P7 -","- Ba2 Li3 O21 P7 -","- Ba8 Li12 O84 P28 -","4","1","","El Horr, N; Bagieu, M; Guitel, J C; Tordjman, I","Crystal data and crystal structure of barium-lithium polyphosphate Ba2 Li3 (P O3)7","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","73","82","10.1524/zkri.1984.169.1-4.73","","","","","","0.036","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8103397","5.623","","8.349","","7.14","","90","","92.44","","90","","334.894","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- Ag Mn O4 -","- Ag Mn O4 -","- Ag4 Mn4 O16 -","4","1","","Chang, F.M.; Jansen, M.","Crystal structure refinement of silver permanganate","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","295","298","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104344","8.188","","12.882","","14.196","","93.37","","116.04","","90.87","","1341.63","","","","","","","","","","","","","5","I -1","-P 1 (-1/2*x+1/2*y+1/2*z,1/2*x-1/2*y+1/2*z,1/2*x+1/2*y-1/2*z)","2","","Ca.85 Na.14 Al1.86 Si2.14 O8","","- Al1.86 Ca0.85 Na0.14 O8 Si2.14 -","- Al1.855 Ca0.85 Na0.14 O8 Si2.145 -","- Al14.84 Ca6.8 Na1.12 O64 Si17.16 -","8","","","Chiari, G.; Benna, P.; Bruno, E.","The structure of bytownite (An85). A new refinement.","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","35","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"8104347","13.608","","26.771","","6.016","","90","","95.61","","90","","2181.13","","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","(S C (N H2)2)2 (Pb Br2)","","- C2 H8 Br2 N4 Pb S2 -","- C2 Br2 N4 Pb S2 -","- C16 Br16 N32 Pb8 S16 -","8","4","","Herbstein, F.H.; Reisner, G.M.","Crystal chemistry of thiourea complexes of lead(II) salts crystal structure of bis(thiourea)lead(II) bromide (form I) Pb Br2 (S C (N H2)2)2","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","83","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104359","19.22","","14.124","","7.493","","90","","90","","90","","2034.07","","","","","","","","","","","","","8","I m m m","-I 2 2","71","","(Na0.2 K0.8) Ca0.5 Mg2 (Al7 Si29 O72) (H2 O)22.64","","- Al7 Ca0.5 H45.28 K0.8 Mg2 Na0.2 O94.64 Si29 -","- Al6.984 K0.8 Mg2 Na0.2 O94.64 Si29.016 -","- Al6.984 K0.8 Mg2 Na0.2 O94.64 Si29.016 -","1","0.0625","","Gramlich-Meier, R.; Meier, W.M.; Smith, B.K.","On faults in the framework structure of the zeolite ferrierite","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","201","210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104360","23.033","","32.887","","5.453","","90","","90","","90","","4130.57","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","K2 Ge O3","","- Ge K2 O3 -","- Ge K2 O3 -","- Ge40 K80 O120 -","40","5","","Halwax, E.; Voellenkle, H.","Die Kristallstruktur des Kaliummetagermanats, K2 Ge O3","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","63","71","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104368","6.279","","7.44","","10.776","","94.53","","99.49","","95.33","","492.088","","","","","","","","","","","","","4","P -1","-P 1","2","","Cs (H C2 O4) (H2 C2 O4) (H2 O)2","","- C4 H7 Cs O10 -","- C4 H7 Cs O10 -","- C8 H14 Cs2 O20 -","2","1","","Clegg, W.","Crystal structure of cesium tetroxalate dihydrate, Cs (H C2 O4) (H2 C2 O4) (H2 O)2","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","211","217","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104402","10.142","","6.158","","8.748","","90","","93.33","","90","","545.429","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","(N H4)2 (S2 O3)","","- H8 N2 O3 S2 -","- H8 N2 O3 S2 -","- H32 N8 O12 S8 -","4","1","","Teng, S.T.; Fuess, H.; Ihringer, J.","Structural phase transitions in (N H4)2 S2 O3","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","257","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","173429","2020-10-21","18:00:00",""
"8104450","12.052","","13.763","","6.386","","90","","109.61","","90","","997.818","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Na (S C N) (H2 O)2","","- C H4 N Na O2 S -","- C H4 N Na O2 S -","- C8 H32 N8 Na8 O16 S8 -","8","1","","Mereiter, K.; Preisinger, A.","Crystal structures and Raman spectra of alpha- and beta-Na S C N (H2 O)2","Zeitschrift fuer Kristallographie (149,1979-)","1984","169","","95","107","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9011455","21.555","","8.761","","9.304","","90","","91.55","","90","","1756.36","","","","","","","","","","","","Taurus mountains, Southwest Turkey","5","C 1 2/c 1","-C 2yc","15","","","Partheite","- Al4 Ca2 H10 O21 Si4 -","- Al4 Ca2 H10 O21 Si4 -","- Al16 Ca8 H40 O84 Si16 -","4","0.5","","Engel, N.; Yvon, K.","The crystal structure of partheite","Zeitschrift fur Kristallographie","1984","169","","165","175","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:27",""
"9011456","8.76","","4.41","","10.15","","90","","125.2","","90","","320.411","","","","","","","","","","","","Cripple Creek, Colorado, USA","2","P 1 c 1","P -2yc","7","","","Calaverite","- Au Te2 -","- Au Te2 -","- Au4 Te8 -","4","2","","Pertlik, F.","Kristallchemie naturlicher telluride III: Die kristallstruktur des minerals calaverit, AuTe2 Locality: Cripple Creek, Colorado, USA","Zeitschrift fur Kristallographie","1984","169","","227","236","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9014682","5.328","","5.052","","12.003","","90","","90","","90","","323.085","","","","","","","","","","","","Schneeberg, Saxony","3","P n c a","-P 2a 2n","60","","","Pucherite","- Bi O4 V -","- Bi O4 V -","- Bi4 O16 V4 -","4","0.5","","Granzin, J.; Pohl, D.","Refinement of pucherite, BiVO4","Zeitschrift fur Kristallographie","1969","169","","289","294","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18",""
"9017364","8.188","","12.822","","14.196","","93.37","","116.04","","90.87","","1335.38","","","","","","","","","","","","Traversella stock, Sesia Lanzo zone, Western Alps, Italy","5","P -1","-P 1","2","","","Bytownite","- Al3.71 Ca1.72 Na0.28 O16 Si4.29 -","- Al3.71 Ca1.72 Na0.28 O16 Si4.29 -","- Al14.84 Ca6.88 Na1.12 O64 Si17.16 -","4","2","","Chiari, G.; Benna, P.; Bruno, E.","The structure of bytownite (An85). A new refinement","Zeitschrift fur Kristallographie","1984","169","","35","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","287586","2023-11-14","17:15:05",""
"9017365","8.188","","12.822","","14.196","","93.37","","116.04","","90.87","","1335.38","","","","","","","","","","","","Traversella stock, Sesia Lanzo zone, Western Alps, Italy","5","I -1","-I 1","2","","","Bytownite","- Al3.71 Ca1.72 Na0.28 O16 Si4.29 -","- Al3.71 Ca1.72 Na0.28 O16 Si4.29 -","- Al14.84 Ca6.88 Na1.12 O64 Si17.16 -","4","","","Chiari, G.; Benna, P.; Bruno, E.","The structure of bytownite (An85). A new refinement","Zeitschrift fur Kristallographie","1984","169","","35","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:12",""