# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-29T20:39:38+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 'Journal of the American Chemical Society') AND volume = 72 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
"4124644","5.05","","5.05","","5.05","","90","","90","","90","","128.788","","","","","","","","","","","","","2","F m -3 m","-F 4 2 3","225","","Pa O2","","- O2 Pa -","- O2 Pa -","- O8 Pa4 -","4","0.0208333","","Elson, R.; Zachariasen, W.H.; Sellers, P.A.; Fried, S.","The tetravalent and pentavalent states of protactinium","Journal of the American Chemical Society","1950","72","","5791","5791","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124650","7.79","","7.5","","7.8","","90","","91.33","","90","","455.592","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K (Cr O3 Cl)","","- Cl Cr K O3 -","- Cl Cr K O3 -","- Cl4 Cr4 K4 O12 -","4","1","","Helmholz, L.; Foster, W.R.","The crystal structure of potassium chlorochromate, K Cr O3 Cl","Journal of the American Chemical Society","1950","72","","4971","4974","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124703","14.36","","10.61","","7.38","","90","","90","","90","","1124.41","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Cs2 Tl Cl5 (H2 O)","","- Cl5 Cs2 H2 O Tl -","- Cl5 Cs2 O Tl -","- Cl20 Cs8 O4 Tl4 -","4","0.5","","Watanabe, T.; Atoji, M.","Crystal Structure of Cesium pentachloromonoaquothallate, Cs2 Tl Cl5 (H2 O)","Journal of the American Chemical Society","1950","72","","3819","3820","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"5000016","13.611","0.02","7.738","0.008","5.142","0.005","90","","90","","90","","541.57","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C4 H9 N O3 -","- C4 H9 N O3 -","- C16 H36 N4 O12 -","4","1","","Shoemaker, David P.; Donohue, Jerry; Schomaker, Verner; Corey, Robert B.","The Crystal Structure of L~s~-Threonine","Journal of the American Chemical Society","1950","72","6","2328","2349","10.1021/ja01162a002","","","","","","","","","","","","","","","","","","","","","has coordinates","187363","2020-10-21","18:00:00",""
"5900020","6.01","","6.01","","29.4","","90","","90","","90","","1061.93","","","","","","","","","","","","","4","P 41 21 2","","92","","2,2- Diiodide diethylene trisulfide","","- C4 H8 I2 S3 -","- C4 I2 S4 -","- C16 I8 S16 -","4","0.5","","","","J. Am. Chem. Soc.","1950","72","","2701","","10.1021/ja01162a098","","","","","","","","","","","","","","","","","","","","","has coordinates","264769","2021-05-03","12:41:22",""