# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-26T12:50:22+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P b 21 m' 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
"1528527","4.8","","8.5","","2.93","","90","","90","","90","","119.544","","","","","","","","","","","","","3","P b 21 m","P -2 -2b","26","","Cu (Ge O3)","","- Cu Ge O3 -","- Cu Ge O3 -","- Cu2 Ge2 O6 -","2","0.5","","Ginetti, Y.","Structure cristalline du metagermanate de cuivre","Bulletin de la Societe Chimique de Belgique","1954","63","","209","216","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541022","5.466","","7.547","","8.541","","90","","90","","90","","352.332","","","","","","","","","","","","","4","P b 21 m","P -2 -2b","26","","(N H2)2 C S","","- C H4 N2 S -","- C N2 S -","- C2 N4 S2 -","2","0.5","","Takahashi, I.","Structure of the Incommensurate Phase in Thiourea","Nippon Kessho Gakkaishi","1990","31","6","283","288","10.5940/jcrsj.31.6_283","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4001780","12.132","0.0002","6.0606","0.0001","8.0956","0.0001","90","","90","","90","","595.247","0.016","","","","","","","","","","","","4","P b 21 m","P -2 -2b","26","","","","- Ba2 Fe O5.5 Y -","- Ba2 Fe O5.5 Y -","- Ba8 Fe4 O22 Y4 -","4","1","","Luo, Kun; Johnson, Roger D.; Tran, Thao T.; Halasyamani, P. Shiv; Radaelli, Paolo G.; Hayward, Michael A.","Ba2YFeO5.5: A Ferromagnetic Pyroelectric Phase Prepared by Topochemical Oxidation.","Chemistry of Materials","2013","25","9","1800","","10.1021/cm400364y","","","","","","","","","","","","","","","","","","","","","has coordinates","176427","2020-10-21","18:00:00",""
"4003535","5.7416","0.0004","11.4227","0.0002","11.4054","0.0003","90","","90","","90","","748.02","0.06","360.1","0.1","360.1","0.1","","","","","","","","5","P b 21 m","P -2 -2b","26","","","","- C H7 Cl3 N2 Pb -","- C H7 Cl3 N2 Pb -","- C4 H28 Cl12 N8 Pb4 -","4","1","","Ma̧czka, Mirosław; Gagor, Anna; Zarȩba, Jan K.; Stefanska, Dagmara; Drozd, Marek; Balciunas, Sergejus; Šimėnas, Mantas; Banys, Juras; Sieradzki, Adam","Three-Dimensional Perovskite Methylhydrazinium Lead Chloride with Two Polar Phases and Unusual Second-Harmonic Generation Bistability above Room Temperature","Chemistry of Materials","2020","","","","","10.1021/acs.chemmater.0c00973","","x-ray","0.71073","MoKα","","0.0329","0.031","","","0.0728","0.0748","","","","","","1.053","","","","has coordinates","251025","2020-10-21","18:00:00",""
"4303102","7.3241","0.0002","13.6857","0.0003","25.6837","0.0006","90","","90","","90","","2574.42","0.11","123","0.1","123","0.1","","","","","","","synthesis as described","5","P b 21 m","P -2 -2b","26","","","","- C22 H30 N4 O9 U -","- C22 H30 N4 O9 U -","- C88 H120 N16 O36 U4 -","4","1","","Massimo Cametti; Laura Ilander; Kari Rissanen","Recognition of Li+ by a Salophen-UO2 Homodimeric Complex","Inorganic Chemistry","2009","48","","8632","8637","10.1021/ic901136b","","x-ray","0.71073","MoKα","","0.0333","0.026","","","0.0584","0.0621","","","","","","1.062","","","","has coordinates,has disorder","179069","2020-10-21","18:00:00",""
"7114741","11.495","0.0004","20.2486","0.0007","28.7007","0.0009","90","","90","","90","","6680.3","0.4","113","2","113","2","","","","","","","","6","P b 21 m","P -2 -2b","26","","","","- C68 H54 Ag F6 O3 P5 -","- C68 H48 Ag F6 O2.75 P5 -","- C272 H192 Ag4 F24 O11 P20 -","4","1","","Schmitt, Elbert W.; Huffman, John C.; Zaleski, Jeffrey M.","Thermal reactivities of isostructural d10 metalloenediynes: metal-dependent Bergman cyclization","Chemical Communications","2001","","2","167","","10.1039/b008337m","","","0.71073","MoKα","","","0.0574","","","","0.0737","","","","","","1.4965","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"9000474","7.512","","10","","6.492","","90","","90","","90","","487.679","","","","","","","","","","","","","7","P b 21 m","P -2 -2b","26","","","Olmsteadite","- Fe2 H4 K Nb0.59 O12 P2 Ta0.41 -","- Fe2 H4 K Nb0.59 O12 P2 Ta0.41 -","- Fe4 H8 K2 Nb1.18 O24 P4 Ta0.82 -","2","0.5","","Moore, P. B.; Araki, T.; Kampf, A. R.; Steele, I. M.","Olmstaedite, K2Fe2[Fe2(Nb,Ta)2O4(H2O)4(PO4)4], a new species, its crystal structure and relation to vauxite and montgomeryite","American Mineralogist","1976","61","","5","11","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:30",""
"9011929","10.88","","12.003","","3.874","","90","","90","","90","","505.916","","","","","","","","","","","","","5","P b 21 m","P -2 -2b","26","","","Miharaite","- Bi Cu4 Fe Pb S6 -","- Bi Cu4 Fe Pb S6 -","- Bi2 Cu8 Fe2 Pb2 S12 -","2","0.5","","Petrova, I. V.; Pobedimskaya, E. A.; Bryzgalov, I. A.","Crystal structure of micharaite Cu4FePbBiS6","Doklady Akademii Nauk SSSR","1988","299","","123","127","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9013937","11.15","","11.51","","4.01","","90","","90","","90","","514.629","","","","","","","","","","","","Krupka, Ore Mountains, NW-Bohemia","4","P b 21 m","","","","","Krupkaite","- Bi3 Cu Pb S6 -","- Bi3 Cu Pb S6 -","- Bi6 Cu2 Pb2 S12 -","2","0.5","","Synecek, V.; Hybler, J.","The crystal structures of krupkaite, CuPbBi3S6, and of gladite, CuPbBi5S9, and the classification of superstructures in the bismuthinite-aikinite group,","Neues Jahrbuch fur Mineralogie, Monatshefte","1974","1974","","541","560","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""