# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-09T02:36:31+01:00
# 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 'Molecular pharmaceutics') AND volume = 8 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
"1501794","10.3089","0.0003","14.8531","0.0004","15.1994","0.0005","90","","100.612","0.002","90","","2287.51","0.12","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H24 N4 O10 -","- C24 H24 N4 O10 -","- C96 H96 N16 O40 -","4","1","","Smith, Adam J.; Kavuru, Padmini; Wojtas, Lukasz; Zaworotko, Michael J.; Shytle, R. Douglas","Cocrystals of quercetin with improved solubility and oral bioavailability.","Molecular pharmaceutics","2011","8","5","1867","1876","10.1021/mp200209j","","","1.54178","CuKα","","0.062","0.0434","","","0.109","0.1225","","","","","","1.035","","","","has coordinates","301775","2025-08-18","14:01:16",""
"1501795","4.978","0.001","12.636","0.003","15.571","0.003","110.53","0.03","97.63","0.03","99.39","0.03","885.6","0.4","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H16 N2 O8 -","- C21 H16 N2 O8 -","- C42 H32 N4 O16 -","2","1","","Smith, Adam J.; Kavuru, Padmini; Wojtas, Lukasz; Zaworotko, Michael J.; Shytle, R. Douglas","Cocrystals of quercetin with improved solubility and oral bioavailability.","Molecular pharmaceutics","2011","8","5","1867","1876","10.1021/mp200209j","","","0.71073","MoKα","","0.089","0.0592","","","0.1267","0.1418","","","","","","1.091","","","","has coordinates","301775","2025-08-18","14:01:16",""