# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-08T06:33:37+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 'Organic Process Research & Development') AND volume = 12 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
"1504997","52.7951","0.0012","7.8456","0.0002","12.2836","0.0002","90","","99.379","0.001","90","","5019.96","0.19","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H27 N3 O3 -","- C30 H27 N3 O3 -","- C240 H216 N24 O24 -","8","1","","Norris, Timothy; VanAlsten, John; Hubbs, Stephen; Ewing, Marcus; Cai, Weiling; Jorgensen, Matthew L.; Bordner, Jon; Jensen, Grace O.","Commercialization and Late-Stage Development of a Semisynthetic Antifungal API: Anidulafungin/d-Fructose (Eraxis)","Organic Process Research & Development","2008","12","3","447","","10.1021/op800055h","","","1.54178","CuKα","","0.0873","0.0688","","","0.1955","0.2172","","","","","","1.008","","","","has coordinates","301775","2025-08-18","14:03:02",""
"1504998","13.3413","0.0002","13.3413","0.0002","46.8389","0.0007","90","","90","","120","","7219.94","0.19","298","2","298","2","","","","","","","","5","P 32 2 1","P 32 2""","154","","","","- C34 H63 Cl N7 O20.5 -","- C34 H52 Cl N7 O20.5 -","- C204 H312 Cl6 N42 O123 -","6","1","","Norris, Timothy; VanAlsten, John; Hubbs, Stephen; Ewing, Marcus; Cai, Weiling; Jorgensen, Matthew L.; Bordner, Jon; Jensen, Grace O.","Commercialization and Late-Stage Development of a Semisynthetic Antifungal API: Anidulafungin/d-Fructose (Eraxis)","Organic Process Research & Development","2008","12","3","447","","10.1021/op800055h","","","1.54178","CuKα","","0.0874","0.0787","","","0.2223","0.2294","","","","","","1.07","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1504999","7.9047","0.0005","13.4494","0.0008","18.2343","0.0011","90","","90","","90","","1938.6","0.2","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C21 H27 N5 -","- C21 H27 N5 -","- C84 H108 N20 -","4","1","","Crawford, Jason B.; Chen, Gang; Gauthier, David; Wilson, Trevor; Carpenter, Bryon; Baird, Ian R.; McEachern, Ernie; Kaller, Alan; Harwig, Curtis; Atsma, Bem; Skerlj, Renato T.; Bridger, Gary J.","AMD070, a CXCR4 Chemokine Receptor Antagonist: Practical Large-Scale Laboratory Synthesis","Organic Process Research & Development","2008","12","5","823","","10.1021/op8000993","","","0.71069","MoKα","","0.0523","0.0373","","","0.0756","0.0806","","","","","","0.904","","","","has coordinates","301775","2025-08-18","14:03:02",""