# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-05-03T07:00:34+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'C c m e' 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
"1568966","35.08","0.0007","36.9265","0.0007","34.8114","0.0006","90","","90","","90","","45094","1.5","100","2","100.15","","","","","","","","","5","C c m e","-C 2ac 2ac","64","","","","- Cs10 Fe30 Mo84 O382 P -","- Cs10 Fe30 Mo83.9992 O382 P -","- Cs40 Fe120 Mo335.997 O1528 P4 -","4","0.25","","Tamai, Nanako; Ogiwara, Naoki; Hayashi, Eri; Kamata, Keigo; Misawa, Toshiyuki; Ito, Takeru; Kojima, Tatsuhiro; Segado, Mireia; Petrus, Enric; Bo, Carles; Uchida, Sayaka","A redox-active inorganic crown ether based on a polyoxometalate capsule.","Chemical science","2023","14","20","5453","5459","10.1039/d3sc01077e","","","0.4132","synchrotron","","0.0905","0.0701","","","0.1797","0.1939","","","","","","1.021","","","","has coordinates,has disorder","284226","2023-06-05","04:03:28",""
"2100854","16.106","0.003","21.627","0.007","14.899","0.002","90","","90","","90","","5190","2","","","","","","","","","","","","5","C c m e","-C 2ac 2ac","64","","","","- C H Cl18 N3 P5 -","- C H Cl18 N3 P5 -","- C8 H8 Cl144 N24 P40 -","8","0.5","SE0086","Belaj, F.","Structures and electron density distributions of [Cl-P(NPCl~3~)~3~]^+^.Cl^{-^} and [Cl-P(NPCl~3~)~3~]^+^.PCl~6~^{-^}.1/2C~2~H~2~Cl~4~ at 100 K","Acta Crystallographica Section B","1992","48","5","598","604","10.1107/S010876819200363X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:18:34",""
"2107385","11.58","","18.54","","10.48","","90","","90","","90","","2249.99","","","","","","","","","","","","","4","C c m e","-C 2ac 2ac","64","","Na6 (P6 O18) (H2 O)6","","- H12 Na6 O24 P6 -","- Na6 O24 P6 -","- Na24 O96 P24 -","4","0.25","","McAdam, A.; Jost, K.H.; Beagley, B.","Refinement of the structure of sodium hexametaphosphate hexahydrate, Na6 (P6 O18) (H2 O)6","Acta Crystallographica B (24,1968-38,1982)","1972","28","","2740","2743","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4517983","23","0.5","24.8","0.5","30.1","0.6","90","","90","","90","","17169","6","293","2","293","2","","","","","","","","4","C c m e","-C 2ac 2ac","64","","","","- Al6.38 Ca3 O33 Si9.62 -","- Al6.4 Ca3 O33 Si9.6 -","- Al102.4 Ca48 O528 Si153.6 -","16","1","","Mugnaioli, Enrico; Lanza, Arianna E.; Bortolozzi, Giorgio; Righi, Lara; Merlini, Marco; Cappello, Valentina; Marini, Lara; Athanassiou, Athanassia; Gemmi, Mauro","Electron Diffraction on Flash-Frozen Cowlesite Reveals the Structure of the First Two-Dimensional Natural Zeolite","ACS Central Science","2020","","","","","10.1021/acscentsci.9b01100","","","0.0335","electron","","0.4471","0.4423","","","0.7412","0.7424","","","","","","3.954","","","","has coordinates","255628","2020-10-21","18:00:00",""
"4517984","23","0.5","24.4","0.5","25.4","0.5","90","","90","","90","","14254","5","293","2","293","2","","","","","","","","4","C c m e","-C 2ac 2ac","64","","","","- Al6.38 Ca1.5 O32 Si9.62 -","- Al6.4 Ca1.5 O32 Si9.6 -","- Al102.4 Ca24 O512 Si153.6 -","16","1","","Mugnaioli, Enrico; Lanza, Arianna E.; Bortolozzi, Giorgio; Righi, Lara; Merlini, Marco; Cappello, Valentina; Marini, Lara; Athanassiou, Athanassia; Gemmi, Mauro","Electron Diffraction on Flash-Frozen Cowlesite Reveals the Structure of the First Two-Dimensional Natural Zeolite","ACS Central Science","2020","","","","","10.1021/acscentsci.9b01100","","","0.0335","electron","","0.4698","0.4637","","","0.7578","0.7651","","","","","","3.626","","","","has coordinates","255629","2020-10-21","18:00:00",""
"9009340","6.615","","11.639","","12.693","","90","","90","","90","","977.259","","","","","","","","","","","","","3","C c m e","-C 2ac 2ac","64","","","Sternbergite","- Ag Fe2 S3 -","- Ag Fe2 S3 -","- Ag8 Fe16 S24 -","8","0.5","","Pertlik, F.","Crystal structure of sternbergite, AgFe2S3 Locality: Medenec, Krusne hory Mts, Czechoslovakia","Neues Jahrbuch fur Mineralogie, Monatshefte","1987","1987","","458","464","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30",""