# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-11T07:20:45+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 'ACS Macro Letters') AND volume = 6 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
"4516805","13.2424","0.0009","23.4593","0.0018","5.5565","0.0004","90","","90","","90","","1726.2","0.2","90","0.5","90","0.5","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C7 H11 N O2 S -","- C7 H11 N O2 S -","- C56 H88 N8 O16 S8 -","8","2","","Cao, Jinbao; Siefker, David; Chan, Brandon A.; Yu, Tianyi; Lu, Lu; Saputra, Mirza A.; Fronczek, Frank R.; Xie, Weiwei; Zhang, Donghui","Interfacial Ring-Opening Polymerization of Amino-Acid-Derived N-Thiocarboxyanhydrides Toward Well-Defined Polypeptides","ACS Macro Letters","2017","6","8","836","","10.1021/acsmacrolett.7b00411","","","0.71073","MoKα","","0.0702","0.0449","","","0.0833","0.0911","","","","","","1.017","","","","has coordinates","239554","2020-10-21","18:00:00",""
"4516806","13.6224","0.0007","9.1977","0.0004","10.4122","0.0005","90","","93.725","0.002","90","","1301.84","0.11","90","0.5","90","0.5","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 N O4 S -","- C13 H13 N O4 S -","- C52 H52 N4 O16 S4 -","4","1","","Cao, Jinbao; Siefker, David; Chan, Brandon A.; Yu, Tianyi; Lu, Lu; Saputra, Mirza A.; Fronczek, Frank R.; Xie, Weiwei; Zhang, Donghui","Interfacial Ring-Opening Polymerization of Amino-Acid-Derived N-Thiocarboxyanhydrides Toward Well-Defined Polypeptides","ACS Macro Letters","2017","6","8","836","","10.1021/acsmacrolett.7b00411","","","0.71073","MoKα","","0.051","0.0412","","","0.1095","0.1153","","","","","","1.119","","","","has coordinates,has disorder","301843","2025-08-21","01:58:47",""
"4516807","7.9376","0.0006","18.7907","0.001","11.1825","0.0009","90","","108.097","0.003","90","","1585.4","0.2","200","0.5","200","0.5","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H18 N2 O4 S -","- C15 H18 N2 O4 S -","- C60 H72 N8 O16 S4 -","4","2","","Cao, Jinbao; Siefker, David; Chan, Brandon A.; Yu, Tianyi; Lu, Lu; Saputra, Mirza A.; Fronczek, Frank R.; Xie, Weiwei; Zhang, Donghui","Interfacial Ring-Opening Polymerization of Amino-Acid-Derived N-Thiocarboxyanhydrides Toward Well-Defined Polypeptides","ACS Macro Letters","2017","6","8","836","","10.1021/acsmacrolett.7b00411","","","0.71073","MoKα","","0.1511","0.0648","","","0.1143","0.1452","","","","","","1.004","","","","has coordinates","239556","2020-10-21","18:00:00",""
"4516808","8.8965","0.0005","8.8965","0.0005","30.3964","0.0018","90","","90","","90","","2405.8","0.2","296","2","296","2","","","","","","","","5","P 43","P 4cw","78","","","","- C26 H29 I N2 O -","- C26 H27 I N2 O -","- C104 H108 I4 N8 O4 -","4","1","","Fan, Jiantao; Wright, Andrew G.; Britton, Benjamin; Weissbach, Thomas; Skalski, Thomas J. G.; Ward, Jonathan; Peckham, Timothy J.; Holdcroft, Steven","Cationic Polyelectrolytes, Stable in 10 M KOHaq at 100 °C","ACS Macro Letters","2017","6","10","1089","","10.1021/acsmacrolett.7b00679","","","1.54178","CuKα","","0.0645","0.064","","","0.1821","0.1826","","","","","","1.15","","","","has coordinates","239557","2020-10-21","18:00:00",""