# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-01T04:38:38+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 'Acta Crystallographica (1,1948-23,1967)') AND volume = 10 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
"1008748","4.513","","4.513","","7.355","","90","","90","","120","","129.7","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Dideuterium oxide","Ice Ih deuterated","- D2 O -","- D2 H2 O -","- D8 H8 O4 -","4","0.166667","","Peterson, S W; Levy, H A","A Single-Crystal Neutron Diffraction Study of Heavy Ice","Acta Crystallographica (1,1948-23,1967)","1957","10","","70","76","10.1107/S0365110X5700016X","","","","","","0.063","","","","","","","","","","","","","","","has coordinates","202026","2020-10-21","18:00:00",""
"1008749","4.489","","4.489","","7.327","","90","","90","","120","","127.9","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Dideuterium oxide","Ice Ih deuterated","- D2 O -","- D2 O -","- D8 O4 -","4","0.166667","","Peterson, S W; Levy, H A","A Single-Crystal Neutron Diffraction Study of Heavy Ice","Acta Crystallographica (1,1948-23,1967)","1957","10","","70","76","10.1107/S0365110X5700016X","","","","","","0.069","","","","","","","","","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1008776","5.661","","5.661","","4.712","","90","","90","","90","","151","","","","","","","","","","","","synthetic by evaporation at 316 K","4","P -4 21 m","P -4 2ab","113","","Urea","Urea","- C H4 N2 O -","- C H4 N2 O -","- C2 H8 N4 O2 -","2","0.25","","Worsham, J E jr.; Levy, H A; Peterson, S W","The positions of hydrogen atoms in urea by neutron diffraction","Acta Crystallographica (1,1948-23,1967)","1957","10","","319","323","10.1107/S0365110X57000924","","","","","","","","","","","","","","","","","","","","","has coordinates","186305","2020-10-21","18:00:00",""
"2310023","4.08","","11.48","","4.65","","90","","90","","90","","217.799","","","","","","","","","","","","","2","C m c 21","C 2c -2","36","","","","- Ag Ca -","- Ag Ca -","- Ag4 Ca4 -","4","0.5","","Dunsmore, R.S.; Calvert, L.D.; Tse, R.S.; Kuhi, L.V.","The crystal structure of Ag Ca and Ag2 Ca","Acta Crystallographica (1,1948-23,1967)","1957","10","","775","775","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310062","6.07","","6.13","","6.68","","90","","90","","90","","248.557","","","","","","","","","","","","","3","C m m a","-C 2a 2","67","","","","- Ag Cl O2 -","- Ag Cl O2 -","- Ag4 Cl4 O8 -","4","0.25","","Curti, R.; Riganti, V.; Locchi, S.","The Crystal Structure of Ag Cl O2","Acta Crystallographica (1,1948-23,1967)","1957","10","","687","691","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310070","7.26","","4.68","","8.14","","90","","90","","90","","276.571","","","","","","","","","","","","","2","I m m a","-I 2b 2","74","","","","- Ag2 Ca -","- Ag2 Ca -","- Ag8 Ca4 -","4","0.25","","Dunsmore, R.S.; Kuhi, L.V.; Calvert, L.D.; Tse, R.S.","The crystal structure of Ag Ca and Ag2 Ca","Acta Crystallographica (1,1948-23,1967)","1957","10","","775","775","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310104","8.78","","5.41","","7.16","","90","","90","","90","","340.099","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","Ba B O F3","","- B Ba F3 O -","- B Ba F3 O -","- B4 Ba4 F12 O4 -","4","0.5","","Chackraburtty, D.M.","The Structure of Ba B O F3","Acta Crystallographica (1,1948-23,1967)","1957","10","","199","200","10.1107/S0365110X57000638","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2310210","3.427","","3.427","","9.834","","90","","90","","90","","115.494","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","","","- Mo U2 -","- Mo U2 -","- Mo2 U4 -","2","0.0625","","Halteman, E.K.","The crystal structure of U2 Mo","Acta Crystallographica (1,1948-23,1967)","1957","10","","166","169","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310264","5.54","","5.54","","23.15","","90","","90","","120","","615.32","","","","","","","","","","","","","1","R -3 m :H","-R 3 2""","166","","Na5 Pb2","","- Pb2 -","- Pb2 -","- Pb6 -","3","0.0833333","","Weston, N.E.; Shoemaker, D.P.","The crystal structures of three phases in the Pb-Na system","Acta Crystallographica (1,1948-23,1967)","1957","10","","775","775","","","","","","","","","","","","","","","","","","","","","","has coordinates","143487","2020-10-21","18:00:00",""
"2310265","5.51","","5.51","","40.39","","90","","90","","120","","1061.96","","","","","","","","","","","","","1","P 63/m m c","-P 6c 2c","194","","Na13 Pb5","","- Pb5 -","- Pb5 -","- Pb10 -","2","0.0833333","","Weston, N.E.; Shoemaker, D.P.","The crystal structures of three phases in the Pb-Na system","Acta Crystallographica (1,1948-23,1967)","1957","10","","775","775","","","","","","","","","","","","","","","","","","","","","","has coordinates","143489","2020-10-21","18:00:00",""
"2310313","16.983","","4.752","","9.07","","90","","90","","90","","731.978","","","","","","","","","","","","","3","P b n m","-P 2c 2ab","62","","","","- Cr9.54 Mo25.24 Ni21.22 -","- Cr9.54 Mo25.24 Ni21.22 -","- Cr9.54 Mo25.24 Ni21.22 -","1","0.125","","Shoemaker, D.P.; Shoemaker, C.B.; Wilson, F.C.","The crystal structure of the P-phase, Mo - Ni - Cr. II. Refinemant of parameters and discussion of atomic coordination","Acta Crystallographica (1,1948-23,1967)","1957","10","","1","14","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310525","6.65","","4.79","","7.86","","90","","112.4","","90","","231.477","","","","","","","","","","","","","3","A 1 2/a 1","-A 2ya","15","","N H2 N O2","","- H2 N2 O2 -","- H2 N2 O2 -","- H8 N8 O8 -","4","0.5","","Beevers, C.A.; Trotman-Dickenson, A.F.","The Crystal Structure of Nitramide, N H2 N O2","Acta Crystallographica (1,1948-23,1967)","1957","10","","34","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","194474","2020-10-21","18:00:00",""
"2310537","7.78","","11.07","","6","","90","","103.1","","90","","503.3","","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","C (N H2)2 (N H N H2) Cl","","- C H7 Cl N4 -","- C Cl N4 -","- C4 Cl4 N16 -","4","1","","Bryden, J.H.","The Crystal Structure of Aminoguanidine Hydrochloride","Acta Crystallographica (1,1948-23,1967)","1957","10","","677","680","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310561","5.155","","7.842","","6.338","","90","","90","","90","","256.217","","","","","","","","","","","","","3","C m c m","-C 2c 2","63","","Ni S O4","","- Ni O4 S -","- Ni O4 S -","- Ni4 O16 S4 -","4","0.25","","Dimaras, P.I.","Morphology and Structure of Anhydrous Nickel Sulphate","Acta Crystallographica (1,1948-23,1967)","1957","10","","313","315","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310566","4.787","","4.787","","4.787","","36.3","","36.3","","36.3","","34.405","","","","","","","","","","","","","3","R -3 m :R","-P 3* 2","166","","H (Cr O2)","","- Cr H O2 -","- Cr H O2 -","- Cr H O2 -","1","0.0833333","","Douglass, R.M.","The crystal structure of H Cr O2","Acta Crystallographica (1,1948-23,1967)","1957","10","","423","427","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310582","10.25","","10.25","","3.84","","90","","90","","90","","403.44","","","","","","","","","","","","","4","I -4","I -4","82","","N H4 Cu7 S4","","- Cu7 H4 N S4 -","- Cu7 N S4 -","- Cu14 N2 S8 -","2","0.25","","Gattow, G.","Die Kristallstruktur von N H4 Cu7 S4","Acta Crystallographica (1,1948-23,1967)","1957","10","","549","553","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310587","5.525","","5.53","","7.819","","90","","90","","90","","238.896","","","","","","","","","","","","","4","P b n m","-P 2c 2ab","62","","La Co0.2 Mn0.8 O3","","- Co0.2 La Mn0.8 O3 -","- Co0.2 La Mn0.8 O3 -","- Co0.8 La4 Mn3.2 O12 -","4","0.5","","Gilleo, M.A.","Crystallographic Studies of Perovskite-Like Compounds. III. Mn(1-x) O3 with M = Co, Fe and Cr","Acta Crystallographica (1,1948-23,1967)","1957","10","","161","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310589","5.46","","5.541","","7.531","","90","","90","","90","","227.842","","","","","","","","","","","","","2","P b c a","-P 2ac 2ab","61","","","","- Pd S2 -","- Pd S2 -","- Pd4 S8 -","4","0.5","","Gronvold, F.; Rost, E.","The crystal structure of Pd Se2 and Pd S2","Acta Crystallographica (1,1948-23,1967)","1957","10","","329","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310594","9.52","","5.47","","18.19","","90","","101.65","","90","","927.72","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Fe7 Mg1.2 (Al15 Si8 O40) (O H)12","","- Al15 Fe7 H12 Mg1.2 O52 Si8 -","- Al15 Fe7 Mg1.2 O52 Si8 -","- Al15 Fe7 Mg1.2 O52 Si8 -","1","0.125","","Harrison, F.W.; Brindley, G.W.","The crystal structure of chloritoid","Acta Crystallographica (1,1948-23,1967)","1957","10","","77","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310596","15.45","","4.05","","9.43","","90","","116.83","","90","","526.539","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Na (O H) (H2 O)4","","- H9 Na O5 -","- Na O5 -","- Na4 O20 -","4","0.5","","Hemily, P.W.","Structures cristallines des hydrates de la soude. I. Structure cristalline de Na O H (H2 O)4","Acta Crystallographica (1,1948-23,1967)","1957","10","","37","44","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310597","5.279","","5.279","","5.279","","56.97","","56.97","","56.97","","96.757","","","","","","","","","","","","","2","R -3 c :R","-P 3* 2n","167","","","","- Co F3 -","- Co F3 -","- Co2 F6 -","2","0.166667","","Hepworth, M.A.; Jack, K.H.; Peacock, R.D.; Westland, G.J.","The crystal structures of the trifluorides of iron, cobalt, ruthenium, rhodium, palladium and iridium","Acta Crystallographica (1,1948-23,1967)","1957","10","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310598","5.408","","5.408","","5.408","","54.67","","54.67","","54.67","","97.951","","","","","","","","","","","","","2","R -3 c :R","-P 3* 2n","167","","Ru F3","","- F3 Ru -","- F3 Ru -","- F6 Ru2 -","2","0.166667","","Hepworth, M.A.; Jack, K.H.; Westland, G.J.; Peacock, R.D.","The crystal structures of the trifluorides of iron, cobalt, ruthenium, rhodium, palladium and iridium","Acta Crystallographica (1,1948-23,1967)","1957","10","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310599","5.33","","5.33","","5.33","","54.42","","54.42","","54.42","","93.137","","","","","","","","","","","","","2","R -3 c :R","-P 3* 2n","167","","Rh F3","","- F3 Rh -","- F3 Rh -","- F6 Rh2 -","2","0.166667","","Hepworth, M.A.; Peacock, R.D.; Jack, K.H.; Westland, G.J.","The crystal structures of the trifluorides of iron, cobalt, ruthenium, rhodium, palladium and iridium","Acta Crystallographica (1,1948-23,1967)","1957","10","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310600","5.5234","","5.5234","","5.5234","","53.925","","53.925","","53.925","","102.241","","","","","","","","","","","","","2","R -3 c :R","-P 3* 2n","167","","Pd F3","","- F3 Pd -","- F3 Pd -","- F6 Pd2 -","2","0.166667","","Hepworth, M.A.; Peacock, R.D.; Jack, K.H.; Westland, G.J.","The crystal structures of the trifluorides of iron, cobalt, ruthenium, rhodium, palladium and iridium","Acta Crystallographica (1,1948-23,1967)","1957","10","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310601","5.418","","5.418","","5.418","","54.13","","54.13","","54.13","","97.049","","","","","","","","","","","","","2","R -3 c :R","-P 3* 2n","167","","Ir F3","","- F3 Ir -","- F3 Ir -","- F6 Ir2 -","2","0.166667","","Hepworth, M.A.; Jack, K.H.; Peacock, R.D.; Westland, G.J.","The crystal structures of the trifluorides of iron, cobalt, ruthenium, rhodium, palladium and iridium","Acta Crystallographica (1,1948-23,1967)","1957","10","","63","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310616","5.348","","7.615","","5.417","","90","","90","","90","","220.607","","","","","","","","","","","","","3","P c 21 n","P -2n -2ac","33","","Cd Ti O3","","- Cd O3 Ti -","- Cd O3 Ti -","- Cd4 O12 Ti4 -","4","1","","Kay, H.F.; Miles, J.L.","The Structure of Cadmium Titanate and Sodium Tantalate","Acta Crystallographica (1,1948-23,1967)","1957","10","","213","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310617","5.4941","","7.7508","","5.513","","90","","90","","90","","234.764","","","","","","","","","","","","","3","P c 21 n","P -2n -2ac","33","","Na (Ta O3)","","- Na O3 Ta -","- Na O3 Ta -","- Na4 O12 Ta4 -","4","1","","Kay, H.F.; Miles, J.L.","The structure of cadmium titanate and sodium tantalate","Acta Crystallographica (1,1948-23,1967)","1957","10","","213","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310618","5.367","","7.6438","","5.4439","","90","","90","","90","","223.332","","","","","","","","","","","","","3","P c m n","-P 2n 2ac","62","","Ca (Ti O3)","","- Ca O3 Ti -","- Ca O3 Ti -","- Ca4 O12 Ti4 -","4","0.5","","Kay, H.F.; Bailey, P.C.","Structure and properties of Ca Ti O3","Acta Crystallographica (1,1948-23,1967)","1957","10","","219","226","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310619","4.6","","5.66","","4.91","","90","","90.01","","90","","127.837","","","","","","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","Ni (W O4)","","- Ni O4 W -","- Ni O4 W -","- Ni2 O8 W2 -","2","0.5","","Keeling, R.O.jr.","The structure of Ni W O4","Acta Crystallographica (1,1948-23,1967)","1957","10","","209","213","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310627","8.74","","7.96","","12.32","","90","","138.6","","90","","566.815","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ag (S C N)","","- C Ag N S -","- C Ag N S -","- C8 Ag8 N8 S8 -","8","1","","Lindqvist, I.","On the crystal structure of silver thiocyanate","Acta Crystallographica (1,1948-23,1967)","1957","10","","29","32","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310628","4.02","","23.86","","7.23","","90","","96.08","","90","","689.581","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(N H4) Ag (S C N)2","","- C2 H4 Ag N3 S2 -","- C2 Ag N3 S2 -","- C8 Ag4 N12 S8 -","4","1","","Lindqvist, I.; Strandberg, B.","The crystal structure of ammonium silver dithiocyanate","Acta Crystallographica (1,1948-23,1967)","1957","10","","173","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310629","6.936","","6.166","","7.548","","90","","102.61","","90","","315.022","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","K2 (S2 O5)","","- K2 O5 S2 -","- K2 O5 S2 -","- K4 O10 S4 -","2","0.5","","Lindqvist, I.; Moertsell, M.","The structure of potassium pyrosulfite and the nature of the pyrosulfite ion","Acta Crystallographica (1,1948-23,1967)","1957","10","","406","409","","","","","","","","","","","","","","","","","","","","","","has coordinates","151274","2020-10-21","18:00:00",""
"2310643","7.528","","7.528","","6.253","","90","","90","","120","","306.887","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","(N H2 N H)3 C Cl","","- C H9 Cl N6 -","- C H9 Cl N6 -","- C2 H18 Cl2 N12 -","2","0.166667","","Okaya, Y.; Pepinsky, R.","Crystal Structure of Triaminoguanidium Chloride, (NH~2~.NH)~3~C.Cl","Acta Crystallographica (1,1948-23,1967)","1957","10","11","681","684","10.1107/S0365110X57002364","","","","","","","","","","","","","","","","","","","","","has coordinates","189486","2020-10-21","18:00:00",""
"2310653","6.04","","6.04","","7.78","","90","","90","","90","","283.827","","","","","","","","","","","","","3","I -4 2 d","I -4 2bw","122","","Cu Cr2 O4","","- Cr2 Cu O4 -","- Cr2 Cu O4 -","- Cr8 Cu4 O16 -","4","0.25","","Prince, E.","Crystal and magnetic structure of copper chromite","Acta Crystallographica (1,1948-23,1967)","1957","10","","554","556","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310654","4.74","","5.64","","13.8","","90","","90","","90","","368.924","","","","","","","","","","","","","3","P c m n","-P 2n 2ac","62","","K (Cl O3)","","- Cl K O3 -","- Cl K O3 -","- Cl4 K4 O12 -","4","0.5","","Ramachandran, G.N.; Lonappan, M.A.","The structure of high-temperature potassium chlorate","Acta Crystallographica (1,1948-23,1967)","1957","10","","281","287","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310672","3.7893","","14.975","","3.7606","","90","","90","","90","","213.394","","","","","","","","","","","","","2","C m c m","-C 2c 2","63","","Zr Ge2","","- Ge2 Zr -","- Ge2 Zr -","- Ge8 Zr4 -","4","0.25","","Smith, J.F.; Bailey, D.M.","The Structures of Zr Ge2, Hf Si2 and Hf Ge2","Acta Crystallographica (1,1948-23,1967)","1957","10","","341","342","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310673","3.8154","","15.004","","3.7798","","90","","90","","90","","216.379","","","","","","","","","","","","","2","C m c m","-C 2c 2","63","","Hf Ge2","","- Ge2 Hf -","- Ge2 Hf -","- Ge8 Hf4 -","4","0.25","","Smith, J.F.; Bailey, D.M.","The Structures of Zr Ge2, Hf Si2 and Hf Ge2","Acta Crystallographica (1,1948-23,1967)","1957","10","","341","342","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310690","6.68","","3.6","","12.03","","90","","107.83","","90","","275.402","","","","","","","","","","","","","3","P 1 21/m 1","-P 2yb","11","","Li V3 O8","","- Li O8 V3 -","- Li O8 V3 -","- Li2 O16 V6 -","2","0.5","","Wadsley, A.D.","Crystal chemistry of non-stoichiometric pentavalent vanadium O crystal structure of Li(1+X) V3 O8","Acta Crystallographica (1,1948-23,1967)","1957","10","","261","267","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310695","7.22","","7.22","","17.93","","90","","90","","120","","809.441","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Cs3 (Cr2 Cl9)","","- Cl9 Cr2 Cs3 -","- Cl9 Cr2 Cs3 -","- Cl18 Cr4 Cs6 -","2","0.0833333","","Wessel, G.J.; Ijdo, D.J.W.","The crystal structure of Cs3 Cr2 Cl9","Acta Crystallographica (1,1948-23,1967)","1957","10","","466","468","","","","","","","","","","","","","","","","","","","","","","has coordinates","151869","2020-10-21","18:00:00",""
"2310700","6.21","","11.72","","6.05","","90","","90","","90","","440.326","","","","","","","","","","","","","3","P c a b","-P 2bc 2ac","61","","Na (O H) (H2 O)","","- H3 Na O2 -","- Na O2 -","- Na8 O16 -","8","1","","Wunderlich, J.A.","Structures cristallines des hydrates de la soude. III. La structure cristalline de Na O H H2 O","Acta Crystallographica (1,1948-23,1967)","1957","10","","462","463","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310703","8.39","","5","","6.21","","90","","114.5","","90","","237.054","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Li2 (C O3)","","- C Li2 O3 -","- C Li2 O3 -","- C4 Li8 O12 -","4","0.5","","Zemann, J.","Die Kristallstruktur von Li2 C O3","Acta Crystallographica (1,1948-23,1967)","1957","10","","664","666","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310706","8.904","","5.037","","13.448","","90","","92.74","","90","","602.446","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","Mn F3","","- F3 Mn -","- F3 Mn -","- F36 Mn12 -","12","1.5","","Hepworth, M.A.; Jack, K.H.","The crystal structure of manganese trifluoride, Mn F3","Acta Crystallographica (1,1948-23,1967)","1957","10","","345","351","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310974","11.77","","3.962","","11.62","","90","","90","","90","","541.872","","","","","","","","","","","","","2","P n m a","-P 2ac 2n","62","","","","- Sb2 Se3 -","- Sb2 Se3 -","- Sb8 Se12 -","4","0.5","","Tideswell, N.W.; Kruse, F.H.; McCullough, J.D.","The crystal structure of antimony selenide, Sb2 Se3","Acta Crystallographica (1,1948-23,1967)","1957","10","","99","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2311006","4.2","","4.2","","8.01","","90","","90","","90","","141.296","","","","","","","","","","","","","2","I 41/a m d :1","I 4bw 2bw -1bw","141","","","","- Mo2 N0.76 -","- Mo2 N0.76 -","- Mo8 N3.04 -","4","0.125","","Evans, D.A.; Jack, K.H.","The alpha->beta phase transformation in the Mo-N system","Acta Crystallographica (1,1948-23,1967)","1957","10","","833","834","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"5000190","5.33","","5.14","","11.25","","102.7","","135.17","","85.17","","210.816","","","","","","","","","","","","","3","P -1","-P 1","2","","Malonic acid","","- C3 H4 O4 -","- C3 O4 -","- C6 O8 -","2","1","","Goedkoop, J. A.; MacGillavry, C. H.","The crystal structure of malonic acid","Acta Crystallographica","1957","10","2","125","127","10.1107/S0365110X57000353","","","","","","","13.2","","","13.2","","","","","","","","","","","has coordinates","174775","2020-10-21","18:00:00",""
"9007437","11.62","","11.77","","3.962","","90","","90","","90","","541.872","","","","","","","","","","","","Synthetic","2","P b n m","-P 2c 2ab","62","","","Antimonselite","- Sb2 Se3 -","- Sb2 Se3 -","- Sb8 Se12 -","4","0.5","","Tideswell, N. W.; Kruse, F. H.; McCullough, J. D.","The crystal structure of antimony selenide, Sb2Se3","Acta Crystallographica","1957","10","","99","102","10.1107/S0365110X57000298","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007438","3.464","","3.464","","5.763","","90","","90","","120","","59.887","","","","","","","","","","","","","2","P -3 m 1","-P 3 2""","164","","","","- Cr0.875 S -","- Cr0.875 S -","- Cr1.75 S2 -","2","0.166667","","Jellinek, F.","The structures of the chromium sulphides","Acta Crystallographica","1957","10","","620","628","10.1107/S0365110X57002200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007439","5.982","","5.982","","11.509","","90","","90","","120","","356.665","","","","","","","","","","","","Synthetic","2","P -3 1 c","-P 3 2c","163","","","Murchisite","- Cr5 S6 -","- Cr5 S6 -","- Cr10 S12 -","2","0.166667","","Jellinek, F.","The structures of the chromium sulphides","Acta Crystallographica","1957","10","","620","628","10.1107/S0365110X57002200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007440","5.939","","5.939","","11.192","","90","","90","","120","","341.873","","","","","","","","","","","","","2","P -3 1 c","-P 3 2c","163","","","","- Cr2 S3 -","- Cr2 S3 -","- Cr8 S12 -","4","0.333333","","Jellinek, F.","The structures of the chromium sulphides","Acta Crystallographica","1957","10","","620","628","10.1107/S0365110X57002200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007441","5.937","","5.937","","16.698","","90","","90","","120","","509.717","","","","","","","","","","","","","2","R -3 :H","-R 3","148","","","","- Cr2 S3 -","- Cr2 S3 -","- Cr12 S18 -","6","0.333333","","Jellinek, F.","The structures of the chromium sulphides","Acta Crystallographica","1957","10","","620","628","10.1107/S0365110X57002200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007442","5.694","","3.428","","11.272","","90","","91.5","","90","","219.943","","","","","","","","","","","","Synthetic","2","I 1 2/m 1","-I 2y","12","","","Brezinaite","- Cr3 S4 -","- Cr3 S4 -","- Cr6 S8 -","2","0.25","","Jellinek, F.","The structures of the chromium sulphides","Acta Crystallographica","1957","10","","620","628","10.1107/S0365110X57002200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007443","3.826","","5.913","","6.089","","90","","101.6","","90","","134.939","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- Cr S -","- Cr S -","- Cr4 S4 -","4","0.5","","Jellinek, F.","The structures of the chromium sulphides","Acta Crystallographica","1957","10","","620","628","10.1107/S0365110X57002200","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9011013","7.62","","7.62","","8.19","","90","","90","","90","","475.547","","","","","","","","","","","","Stassfurt, Germany","4","P 42/n :1","P 4n -1n","86","","","Pinnoite","- B2 H6 Mg O7 -","- B2 H6 Mg O7 -","- B8 H24 Mg4 O28 -","4","0.5","","Paton, F.; MacDonald, S. G. G.","The crystal structure of pinnoite","Acta Crystallographica","1957","10","","653","656","10.1107/S0365110X57002273","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:48",""