# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-21T15:16:26+01:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P 42 c 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
"1528438","11.164","","11.164","","10.638","","90","","90","","90","","1325.87","","","","","","","","","","","","","5","P 42 c m","P 4c -2c","101","","((C H3)4 N) (Cu2 (N C S)3)","","- C7 H12 Cu2 N4 S3 -","- C7 H12 Cu2 N4 S3 -","- C28 H48 Cu8 N16 S12 -","4","0.5","","Dilshad, R.; Klepp, K.O.; Boller, H.","[Me4 N] [Cu2 (N C S)3] a compound having a framework structure with large channels","Solid State Sciences","2005","7","","1230","1235","","","","","","","","","","","","","","","","","","","","","","has coordinates","150668","2020-10-21","18:00:00",""
"1532684","9.851","","9.851","","6.868","","90","","90","","90","","666.486","","","","","","","","","","","","","3","P 42 c m","P 4c -2c","101","","","","- Mg11.92 Ni2.32 Sn1.76 -","- Mg11.92 Ni2.32 Sn1.76 -","- Mg23.84 Ni4.64 Sn3.52 -","2","0.25","","Boudard, M.; Vincent, H.; Bordet, P.; Audebert, F.","The structure of the Y-phase in the Mg - Ni - Sn system","Journal of Alloys Compd.","2004","372","","121","128","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4070050","19.7811","0.0003","19.7811","0.0003","9.1039","0.0002","90","","90","","90","","3562.28","0.11","100","2","100","2","","","","","","","","5","P 42 c m","P 4c -2c","101","","","","- C15.06 H25.88 Cl0.13 In1.5 O1.63 -","- C15.0625 H25.88 Cl0.125 In1.5 O1.625 -","- C120.5 H207.04 Cl In12 O13 -","8","1","","Ziemkowska, Wanda; Cyrański, Michal̷ K.","Synthesis and Structural Characterization of Some Alkylindium Bisphenoxides","Organometallics","2009","28","18","5593","","10.1021/om900585y","","","0.71073","MoKα","","0.0215","0.0202","","","0.0533","0.0541","","","","","","0.972","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4128540","11.92662","0.00028","11.92662","","19.8484","0.0005","90","","90","","90","","2823.32","0.1","298","","298","","","","","","","","","5","P 42 c m","P 4c -2c","101","","","","- C22 H40 Fe2 N S4 -","- C22 H40 Fe2 N S4 -","- C88 H160 Fe8 N4 S16 -","4","0.5","","Horwitz, Noah E.; Xie, Jiaze; Filatov, Alexander S.; Papoular, Robert J.; Shepard, William E.; Zee, David Z.; Grahn, Mia P.; Gilder, Chloe; Anderson, John S.","Redox-Active 1D Coordination Polymers of Iron-Sulfur Clusters.","Journal of the American Chemical Society","2019","141","9","3940","3951","10.1021/jacs.8b12339","powder diffraction","x-ray","0.412748","synchrotron","","","","","","","","0.26224","","2.79","","","","","","","has coordinates","221621","2020-10-21","18:00:00",""
"4344946","8.9525","0.0003","8.9525","0.0003","36.5514","0.0015","90","","90","","90","","2929.49","0.18","120","","120","","","","","","","","","5","P 42 c m","P 4c -2c","101","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","","0.1546","0.1263","","","0.2145","0.2198","","","","4.35","4.35","3.9","","","","has coordinates","191346","2020-10-21","18:00:00",""