# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-02-19T16:03:39+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 'Inorganica Chimica Acta') AND volume = 89 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
"1529609","7.827","","9.208","","7.456","","90","","112.57","","90","","496.206","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Mn (S C N)2 (H2 O)4","","- C2 H8 Mn N2 O4 S2 -","- C2 H8 Mn N2 O4 S2 -","- C4 H16 Mn2 N4 O8 S4 -","2","0.5","","Beagley, B.; McAuliffe, C.A.; Mackie, A.G.; Pritchard, R.G.","Preparation and crystal structure of manganese(II) isothiocyanate tetrahydrate","Inorganica Chimica Acta","1984","89","","163","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""
"1529688","8.638","","14.517","","9.145","","90","","112.71","","90","","1057.86","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Co (N H3)5) (P O4) (H2 O)3","","- Co H21 N5 O7 P -","- Co H21 N5 O7 P -","- Co4 H84 N20 O28 P4 -","4","1","","Brewer, G.; Grisham, C.; Drucker, S.; Girard, J.; Sinn, E.","The crystal and molecular structure of Co (N H3)5 P O4 (H2 O)3 a Na+ -K+ ATPase probe","Inorganica Chimica Acta","1984","89","","105","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08",""