# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-08-10T10:36:19+02:00
# 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 'Inorganic Chemistry') AND volume = 27 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
"4331401","6.1736","","6.1736","","12.897","","90","","90","","120","","425.693","","","","","","","","","","","","","4","P -3 1 c","-P 3 2c","163","","Ag Sc (P2 S6)","","- Ag P2 S6 Sc -","- Ag P2 S6 Sc -","- Ag2 P4 S12 Sc2 -","2","0.166667","","Lee, S.; Colombet, P.; Ouvrard, G.; Brec, R.","General trends observed in the substituted thiophosphate family. Synthesis and structure of Ag Sc P2 S6 and Cd Fe P2 S6.","Inorganic Chemistry","1988","27","","1291","1294","10.1021/ic00280a041","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331423","8.6042","","5.4496","","10.8673","","90","","90","","90","","509.562","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","Mn (B F4)2","","- B2 F8 Mn -","- B2 F8 Mn -","- B8 F32 Mn4 -","4","0.5","","McCormick, M.J.; O'Donnell, T.A.; Hoskins, B.F.; Cockman, R.W.","Isolation and crystal structure of manganese(II) tetrafluoroborate: A unique example of manganese(II) with seven unidentate ligands.","Inorganic Chemistry","1988","27","","2742","2745","10.1021/ic00288a034","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331444","9.92","","9.92","","6.23","","90","","90","","90","","613.072","","","","","","","","","","","","","3","P -4 21 m","P -4 2ab","113","","(N F4) (B F4)","","- B F8 N -","- B F8 N -","- B4 F32 N4 -","4","0.5","","Fawcett, J.; Christe, K.O.; Russell, D.R.; Thorup, N.; David, L.M.","Crystal structure of (N F4)(+) salts","Inorganic Chemistry","1988","27","","2450","2454","10.1021/ic00287a016","","","","","","","","","","","","","","","","","","","","","has coordinates","301839","2025-08-20","22:57:33",""
"4344348","17.459","","12.185","","5.2431","","90","","90","","90","","1115.41","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","V2 (V O) (P2 O7)2","","- O15 P4 V3 -","- O15 P4 V3 -","- O60 P16 V12 -","4","0.5","","Johnson, J.W.; Johnston, D.C.; King, H.E.jr.; Brody, J.F.; Halbert, T.R.; Goshorn, D.P.","Structure and magnetic properties of V2 (V O) (P2 O7)2. A mixed-valence vanadium(III,III,IV) pyrophosphate.","Inorganic Chemistry","1988","27","","1646","1648","","","","","","","","","","","","","","","","","","","","","","has coordinates","167254","2020-10-21","18:00:00",""
"4344363","8.012","","10.588","","6.687","","90","","90","","90","","567.265","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","K2 (Ru (O H)2 O3)","","- H2 K2 O5 Ru -","- K2 O5 Ru -","- K8 O20 Ru4 -","4","1","","Elout, M.O.; Haije, W.G.; Maaskant, W.J.A.","Crystal structure determination of dipotassium dihydroxotrioxoruthenate(VI): configuration of the ruthenate ion and its electronic properties","Inorganic Chemistry","1988","27","","610","614","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344383","12.841","","7.146","","12.994","","90","","106.18","","90","","1145.12","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Na2 (Ti2 (Se2)3 Se2)","","- Na2 Se8 Ti2 -","- Na2 Se8 Ti2 -","- Na8 Se32 Ti8 -","4","1","","Kang, D.; Ibers, J.A.","Synthesis and characterization of Na2 Ti2 Se8, a new one-dimensional solid-state polyselenide","Inorganic Chemistry","1988","27","","549","551","","","","","","","","","","","","","","","","","","","","","","has coordinates","169424","2020-10-21","18:00:00",""
"9012516","5.434","","4.8091","","11.779","","90","","90","","90","","307.816","","","","","","","","","","","","Synthetic","2","P n a 21","P 2c -2n","33","","","Cervantite","- O2 Sb -","- O2 Sb -","- O16 Sb8 -","8","2","","Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C","Diantimony tetraoxides revisited Note: displacement parameters from ICSD","Inorganic Chemistry","1988","27","","1367","1370","10.1021/ic00281a011","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012517","12.057","","4.8352","","5.384","","90","","104.56","","90","","303.796","","","","","","","","","","","","Synthetic","2","C 1 2/c 1","-C 2yc","15","","","Clinocervantite","- O2 Sb -","- O2 Sb -","- O16 Sb8 -","8","1","","Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C","Diantimony tetraoxides revisited Note: displacement parameters from ICSD","Inorganic Chemistry","1988","27","","1367","1370","10.1021/ic00281a011","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""