# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T15:44:51+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 'Chemistry Central Journal') AND volume = 63 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
"1547210","7.4432","0.0015","9.993","0.002","16.648","0.003","77.55","0.02","87.54","0.03","87.09","0.03","1206.9","0.4","180","2","180","2","","","","","","","","3","P -1","-P 1","2","Triamterene","6-phenylpteridine-2,4,7-triamine","","- C12 H11 N7 -","- C12 H11 N7 -","- C48 H44 N28 -","4","2","","Rehman, A.; Delori, A.; Hughes, D. S.; Jones, W.","Using crystallography, topology and graph set analysis for the description of the hydrogen bond network of triamterene: A rational approach to solid form selection","Chemistry Central Journal","2017","63","","11","","10.1186/s13065-017-0293-1","","","1.54178","CuKα","","0.0457","0.036","","","0.0917","0.0984","","","","","","1.032","","","","has coordinates","200975","2020-10-21","18:00:00",""