# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-01T01:25:13+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 'Journal of the American Chemical Society') AND volume = 93 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
"4123980","16.627","","9.582","","19.446","","90","","120.58","","90","","2667.25","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","H2 Ru6 (C O)18","","- C18 H2 O18 Ru6 -","- C18 O18 Ru6 -","- C72 O72 Ru24 -","4","1","","Churchill, M.R.; Wormald, J.","Crystal structure and molecular geometry of octadecacarbonylhexaruthenium dihydride","Journal of the American Chemical Society","1971","93","","5670","5677","","","","","","","","","","","","","","","","","","","","","","has coordinates","148687","2020-10-21","18:00:00",""
"4123988","9.56","","13.12","","13.38","","109.83","","107.62","","97.52","","1452.69","","","","","","","","","","","","","5","P -1","-P 1","2","","Fe Co2 (C O)9 S","","- C9 Co2 Fe O9 S -","- C9 Co1.998 Fe0.999 O9 S -","- C36 Co7.992 Fe3.996 O36 S4 -","4","2","","Stevenson, D.L.; Wei, C.H.; Dahl, L.F.","XXI. Stereochemical analysis of the mixed-metal Fe Co2 (C O)9 S cluster system and resulting bond-length evidence for antibonding trimetal character of the unpaired electron in the isostructural Co3 (C O)9 S cluster system","Journal of the American Chemical Society","1971","93","","6027","6031","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123989","9.503","","13.9184","","14.1229","","114.317","","117.752","","84.556","","1495.55","","","","","","","","","","","","","4","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","(Co3 (C O)9) Se","","- C9 Co3 O9 Se -","- C9 Co3 O9 Se -","- C36 Co12 O36 Se4 -","4","","","Strouse, C.E.; Dahl, L.F.","XXII. Syntheses and structural analyses by X-ray diffraction and electron spin resonance single-crystal methods of Co3 (C O)9 Se, Fe Co2 (C O)9 Se and Fe Co2 (C O)9 Te. The antibonding metallic nature of an unpaired electron in ...","Journal of the American Chemical Society","1971","93","","6032","6041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123990","9.4595","","13.8419","","14.0908","","114.005","","117.66","","84.608","","1482.52","","","","","","","","","","","","","5","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","(Fe Co2 (C O)9) Se","","- C9 Co2 Fe O9 Se -","- C9 Co1.998 Fe0.999 O9 Se -","- C36 Co7.992 Fe3.996 O36 Se4 -","4","","","Strouse, C.E.; Dahl, L.F.","XXII. Syntheses and structural analyses by x-ray diffraction and electron spin resonance single-crystal methods of Co3 (C O)9 Se, Fe Co2 (C O)9 Se and Fe Co2 (C O)9 Te. The antibonding metallic nature of an unpaired electron in ...","Journal of the American Chemical Society","1971","93","","6032","6041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4123991","8.773","","15.205","","14.578","","117.29","","118.73","","78.42","","1514.94","","","","","","","","","","","","","5","C -1","-P 1 (1/2*x+1/2*y,1/2*x-1/2*y,-z)","2","","(Fe Co2 (C O)9) Te","","- C9 Co2 Fe O9 Te -","- C9 Co1.998 Fe0.999 O9 Te -","- C36 Co7.992 Fe3.996 O36 Te4 -","4","","","Strouse, C.E.; Dahl, L.F.","XXII. Syntheses and structural analyses by x-ray diffraction and electron spin resonance single-crystal methods of Co3 (C O)9 Se, Fe Co2 (C O)9 Se and Fe Co2 (C O)9 Te. The antibonding metallic nature of an unpaired electron in ...","Journal of the American Chemical Society","1971","93","","6032","6041","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""