# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-07-05T22:29:22+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 'ACS chemical biology') AND volume = 9 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
"4510217","24.304","0.003","13.1642","0.0019","14.231","0.002","90","","90","","90","","4553.3","1.1","100","2","100","2","","","","","","","","7","P c a 21","P 2c -2ac","29","","","","- C38 H45 Br Cl6 N O8 P -","- C38 H45 Br Cl6 N O8 P -","- C152 H180 Br4 Cl24 N4 O32 P4 -","4","1","","Pathak, Rakesh K.; Marrache, Sean; Harn, Donald A.; Dhar, Shanta","Mito-DCA: A Mitochondria Targeted Molecular Scaffold for Efficacious Delivery of Metabolic Modulator Dichloroacetate.","ACS chemical biology","2014","9","5","1178","1187","10.1021/cb400944y","","","0.71073","MoKα","","0.1251","0.0629","","","0.1289","0.1556","","","","","","1.002","","","","has coordinates,has disorder","179649","2020-10-21","18:00:00",""