# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T14:52:48+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'A e 2 a' 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
"2000576","19.9686","0.0007","16.733","0.0006","11.8636","0.0004","90","","90","","90","","3964","0.2","293","","293","","","","","","","","","6","A e 2 a","A -2ab -2ab","41","","1,3-bis-[triphenylphosphonio]-propadien-bis-[trifluormethanesulfonate]","","- C41 H32 F6 O6 P2 S2 -","- C41 H32 F6 O6 P2 S2 -","- C164 H128 F24 O24 P8 S8 -","4","0.5","SH1002","Bram, A.; Burzlaff, H.; Hadawi, D.; Bestmann, H.-J.","Structure of the allene C~39~H~32~P~2~^2+^.2CF~3~O~3~S^{-^}","Acta Crystallographica Section C","1992","48","10","1904","1906","10.1107/S0108270192006127","","","0.7093","MoKα~1~","","","0.041","","","0.027","","","","","2.66","2.66","","","","","has coordinates","203891","2020-10-21","18:00:00",""
"4344947","9.0513","0.001","9.044","0.0009","36.226","0.003","90","","90","","90","","2965.5","0.5","293","","293","","","","","","","","","5","A e 2 a","A -2ab -2ab","41","Isopropylammonium Tin Iodide","","","- C9 H30 I7 N3 Sn2 -","- C9 H20 I7 N3 Sn2 -","- C36 H80 I28 N12 Sn8 -","4","0.5","","Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites.","Inorganic chemistry","2017","56","1","56","73","10.1021/acs.inorgchem.6b02764","","x-ray","0.71073","MoKα","","0.2001","0.0884","","","0.1083","0.1237","","","","1.91","1.91","1.38","","","","has coordinates","191346","2020-10-21","18:00:00",""