# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-01T14:38:02+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 'Acta Crystallographica') AND volume = 21 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
"2310067","3.6787","","3.6787","","3.6787","","90","","90","","90","","49.783","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Ag Yb -","- Ag Yb -","- Ag Yb -","1","0.0208333","","Baenziger, N.C.; Humphreys, J.E.; Gordon, R.O.; Moriarty, J.L.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","10.1107/S0365110X6600402X","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310080","3.5634","","3.5634","","3.5634","","90","","90","","90","","45.247","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Au Yb -","- Au Yb -","- Au Yb -","1","0.0208333","","Moriarty, J.L.jr.; Baenziger, N.C.; Humphreys, J.E.; Gordon, R.O.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","10.1107/S0365110X6600402X","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310226","4.456","","7.039","","7.641","","90","","90","","90","","239.666","","","","","","","","","","","","","2","I m m a","-I 2b 2","74","","","","- Ho Zn2 -","- Ho Zn2 -","- Ho4 Zn8 -","4","0.25","","Michel, D.J.; Ryba, E.","The crystal structure of Ho Zn2","Acta Crystallographica (1,1948-23,1967)","1966","21","","818","818","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310229","4.059","","4.059","","4.059","","90","","90","","90","","66.874","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Nd Pt3 -","- Nd Pt3 -","- Nd Pt3 -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310230","4.0633","","4.0633","","4.0633","","90","","90","","90","","67.087","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Pt3 Sm -","- Pt3 Sm -","- Pt3 Sm -","1","0.0208333","","Moriarty, J.L.; Gordon, R.O.; Humphreys, J.E.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310231","4.0839","","4.0839","","4.0839","","90","","90","","90","","68.112","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Pt3 Tb -","- Pt3 Tb -","- Pt3 Tb -","1","0.0208333","","Moriarty, J.L.; Gordon, R.O.; Humphreys, J.E.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310232","7.556","","7.556","","7.556","","90","","90","","90","","431.396","","","","","","","","","","","","","2","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Pt2 Tm -","- Pt2 Tm -","- Pt16 Tm8 -","8","0.0416667","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310233","4.0455","","4.0455","","4.0455","","90","","90","","90","","66.209","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Pt3 Yb -","- Pt3 Yb -","- Pt3 Yb -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Baenziger, N.C.; Gordon, R.O.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310234","4.0745","","4.0745","","4.0745","","90","","90","","90","","67.643","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- La Pt3 -","- La Pt3 -","- La Pt3 -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310241","8.582","","8.582","","12.462","","90","","90","","120","","794.869","","","","","","","","","","","","","2","R -3 m :H","-R 3 2""","166","","","","- Fe7 Pr -","- Fe7.00286 Pr0.998571 -","- Fe49.02 Pr6.99 -","7","0.194444","","Ray, A.E.","The crystal structures of Ce Fe7, Pr Fe7, Nd Fe7, and Sm Fe7","Acta Crystallographica (1,1948-23,1967)","1966","21","","426","430","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310262","5.186","","5.186","","8.566","","90","","90","","120","","199.514","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Lu Mn5 -","- Lu Mn5 -","- Lu2 Mn10 -","2","0.166667","","Wang, F.E.; Gilfrich, J.V.","The crystal structures of Lu Mn5 and the R Mn12 compounds (where R= Gd, Tb, Dy, Ho, Er and Tm)","Acta Crystallographica (1,1948-23,1967)","1966","21","","476","481","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310296","4.215","","4.215","","4.215","","90","","90","","90","","74.885","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Cd3 Nb -","- Cd3 Nb -","- Cd3 Nb -","1","0.0208333","","Holleck, H.","Die Phase Nb Cd3","Acta Crystallographica (1,1948-23,1967)","1966","21","","451","451","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310308","4.718","","4.718","","4.718","","90","","90","","90","","105.02","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Eu Tl3 -","- Eu Tl3 -","- Eu Tl3 -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310309","4.162","","4.162","","4.162","","90","","90","","90","","72.095","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Ce Pt3 -","- Ce Pt3 -","- Ce Pt3 -","1","0.0208333","","Moriarty, J.L.jr.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310319","8.67","","8.67","","4.76","","90","","90","","90","","357.804","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","","","- Dy Mn12 -","- Dy Mn12 -","- Dy2 Mn24 -","2","0.0625","","Wang, F.E.; Gilfrich, J.V.","The crystal structures of Lu Mn6 and R Mn12 compounds (where R= Gd, Tb, Dy, Ho, Er and Tm)","Acta Crystallographica (1,1948-23,1967)","1966","21","","476","481","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310332","5.759","","5.759","","9.903","","90","","90","","120","","284.441","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Zn2 Mo3 O8","","- Mo3 O8 Zn2 -","- Mo3 O8 Zn2 -","- Mo6 O16 Zn4 -","2","0.166667","","Ansell, G.B.; Katz, L.","A refinement of the crystal structure of zinc molybdenum(IV) oxide, Zn2 Mo3 O8","Acta Crystallographica (1,1948-23,1967)","1966","21","","482","485","","","","","","","","","","","","","","","","","","","","","","has coordinates","148394","2020-10-21","18:00:00",""
"2310337","9.65","","9.73","","6.47","","90","","104.9","","90","","587.071","","","","","","","","","","","","","2","C 1 2/c 1","-C 2yc","15","","","","- N4 Se4 -","- N4 Se4 -","- N16 Se16 -","4","0.5","","Baernighausen, H.; Jander, J.; von Volkmann, T.","Die Kristallstruktur von Tetrastickstofftetraselenid N4 Se4","Acta Crystallographica (1,1948-23,1967)","1966","21","","571","577","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310340","9.84","","9.84","","9.84","","90","","90","","90","","952.764","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","(N H4)2 Pd Cl6","","- Cl6 H8 N2 Pd -","- Cl6 H8 N2 Pd -","- Cl24 H32 N8 Pd4 -","4","0.0208333","","Bell, J. D.; Hall, D.; Waters, T. N.","The similarity of atomic radius of palladium(II) and palladium(IV)","Acta Crystallographica (1,1948-23,1967)","1966","21","","440","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","189063","2020-10-21","18:00:00",""
"2310341","9.398","","9.398","","9.398","","23.78","","23.78","","23.78","","118.555","","","","","","","","","","","","","2","R -3 m :R","-P 3* 2","166","","Th3 N4","","- N4 Th3 -","- N4 Th3 -","- N4 Th3 -","1","0.0833333","","Benz, R.; Zachariasen, W.H.","Th3 N4 crystal structure and comparison with that of Th2 N2 O","Acta Crystallographica (1,1948-23,1967)","1966","21","","838","840","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"2310348","3.633","","3.633","","6.036","","90","","90","","90","","79.667","","","","","","","","","","","","","2","I 4/m m m","-I 4 2","139","","U C2","","- C2 U -","- C2 U -","- C4 U2 -","2","0.0625","","Bowman, A.L.; Arnold, G.P.; Witteman, W.G.; Nereson, N.G.; Wallace, T.C.","The crystal structures of U C2","Acta Crystallographica (1,1948-23,1967)","1966","21","","670","671","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310359","14.884","","14.884","","6.547","","90","","90","","90","","1450.38","","","","","","","","","","","","","3","I 41/a :2","-I 4ad","88","","Li U F5","","- F5 Li U -","- F5 Li U -","- F80 Li16 U16 -","16","1","","Brunton, G.","The Crystal Structure of Li U F5","Acta Crystallographica (1,1948-23,1967)","1966","21","","814","817","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310368","12.352","","12.352","","12.352","","90","","90","","90","","1884.57","","","","","","","","","","","","","5","P a -3","-P 2ac 2ab 3","205","","Cs Al (S O4)2 (H2 O)12","","- Al Cs H24 O20 S2 -","- Al Cs H24 O20 S2 -","- Al4 Cs4 H96 O80 S8 -","4","0.166667","","Cromer, D.T.; Kay, M.I.; Larson, A.C.","Refinement of the alum structures. I. X-ray and neutron diffraction study of Cs Al (S O4)2 * (H2 O)12, a beta Alum","Acta Crystallographica (1,1948-23,1967)","1966","21","","383","389","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310373","10.34","","14.33","","3.91","","90","","99.03","","90","","572.173","","","","","","","","","","","","","2","P 1 21 1","P 2yb","4","","U O3","","- O3 U -","- O3 U -","- O30 U10 -","10","5","","Debets, P.C.","The Structure of beta - U O3","Acta Crystallographica (1,1948-23,1967)","1966","21","","589","593","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310375","8.56","","6.87","","12.84","","90","","90","","90","","755.084","","","","","","","","","","","","","3","P b c a","-P 2ac 2ab","61","","S (C N)2","","- C2 N2 S -","- C2 N2 S -","- C16 N16 S8 -","8","1","","Emerson, K.","The Crystal and Molecular Structure of Sulfur Dicyanide","Acta Crystallographica (1,1948-23,1967)","1966","21","","970","974","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310381","9.611","","9.611","","9.611","","90","","90","","90","","887.781","","","","","","","","","","","","","4","P 21 3","P 2ac 2ab 3","198","","Sr (Mn O4)2 (H2 O)3","","- H6 Mn2 O11 Sr -","- H6 Mn2 O11 Sr -","- H24 Mn8 O44 Sr4 -","4","0.333333","","Ferrari, A.; Braibanti, A.; Bigliardi, G.; Lanfredi, A.M.M.","The Crystal Structure of Strontium Permanganate Trihydrate","Acta Crystallographica","1966","21","5","681","685","10.1107/s0365110x66003700","","","","","","","","","","","","","","","","","","","","","has coordinates","203505","2020-10-21","18:00:00",""
"2310382","13.814","","13.814","","5.759","","90","","90","","90","","1098.97","","","","","","","","","","","","","6","I 4/m","-I 4","87","","Na4 (Cu (N H3)4) (Cu (S2 O3)2)2","","- Cu3 H12 N4 Na4 O12 S8 -","- Cu3 N4 Na4 O12 S8 -","- Cu6 N8 Na8 O24 S16 -","2","0.125","","Ferrari, A.; Braibanti, A.; Tiripicchio, A.","The crystal structure of tetrasodium tetramminecopper(II) di-catena-di-mue-thiosulphato-cuprate(I)","Acta Crystallographica (1,1948-23,1967)","1966","21","","605","610","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310419","7.27","","5.7","","4.67","","99.8","","98","","99.7","","185.142","","","","","","","","","","","","","3","P -1","-P 1","2","","H5 As3 O10","","- As3 H5 O10 -","- As3 H5 O10 -","- As3 H5 O10 -","1","0.5","","Jost, K.H.; Worzala, H.; Thilo, E.","Die Struktur des As2 O5 (H2 O)1.6666","Acta Crystallographica (1,1948-23,1967)","1966","21","","808","813","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310420","7.96","","9.61","","6.67","","70.1","","104.3","","122.5","","403.3","","","","","","","","","","","","","4","P -1","-P 1","2","","Na2 (H2 Si O4) (H2 O)4","","- H10 Na2 O8 Si -","- Na2 O8 Si -","- Na4 O16 Si2 -","2","1","","Jost, K.H.; Hilmer, W.","Die Struktur von Na2 H2 Si O4 (H2 O)4","Acta Crystallographica (1,1948-23,1967)","1966","21","","583","589","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310421","5.478","","5.478","","5.17","","90","","90","","120","","134.359","","","","","","","","","","","","","3","P 63","P 6c","173","","Li (I O3)","","- I Li O3 -","- I Li O3 -","- I2 Li2 O6 -","2","0.333333","","de Boer, J.L.; van Bolhuis, F.; Olthof-Hazekamp, R.; Vos, A.","Reinvestigation of the crystal structure of lithium iodate","Acta Crystallographica (1,1948-23,1967)","1966","21","","841","843","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310422","5.67","","10.25","","3.41","","90","","91.4","","90","","198.122","","","","","","","","","","","","","3","I 1 m 1","I -2y","8","","Cd (O H)2","","- Cd H2 O2 -","- Cd O2 -","- Cd4 O8 -","4","1","","de Wolff, P.M.","The crystal structure of gamma- Cd (O H)2","Acta Crystallographica (1,1948-23,1967)","1966","21","","432","433","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310423","7.476","","7.476","","6.039","","90","","90","","120","","292.304","","","","","","","","","","","","","3","P -3 m 1","-P 3 2""","164","","Cs2 Ce Cl6","","- Ce Cl6 Cs2 -","- Ce Cl6 Cs2 -","- Ce Cl6 Cs2 -","1","0.0833333","","Kaatz, T.; Marcovich, M.","The crystal structure of the compound Cs2 Ce Cl6","Acta Crystallographica (1,1948-23,1967)","1966","21","","1011","1011","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310439","5.828","","25.86","","11.002","","90","","90","","90","","1658.13","","","","","","","","","","","","","4","F d d 2","F 2 -2d","43","","Cd (N O3)2 (H2 O)4","","- Cd H8 N2 O10 -","- Cd H8 N2 O10 -","- Cd8 H64 N16 O80 -","8","0.5","","Matkovic, B.; Ribar, B.; Zelenko, B.; Peterson, S.W.","Refinement of the Structure of Cd (N O3 2 (H2 O)4","Acta Crystallographica (1,1948-23,1967)","1966","21","","719","725","","","","","","","","","","","","","","","","","","","","","","has coordinates","194538","2020-10-21","18:00:00",""
"2310451","3.67","","3.67","","3.67","","90","","90","","90","","49.431","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Tl Tm -","- Tl Tm -","- Tl Tm -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310452","4.679","","4.679","","4.679","","90","","90","","90","","102.438","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Tb Tl3 -","- Tb Tl3 -","- Tb Tl3 -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310463","8.811","","8.811","","8.811","","90","","90","","90","","684.031","","","","","","","","","","","","","4","P -4 3 m","P -4 2 3","215","","P4 O6 (Ni (C O)3)4","","- C12 Ni4 O18 P4 -","- C12 Ni4 O18 P4 -","- C12 Ni4 O18 P4 -","1","0.0416667","","Pierron, E.D.; Wheatley, P.J.; Riess, J.G.","Structure of P, P(I), P(II), P(III) - Tetrakistricarbonylnickel-tetraphosphorus hexaoxide","Acta Crystallographica (1,1948-23,1967)","1966","21","","288","289","","","","","","","","","","","","","","","","","","","","","","has coordinates","149743","2020-10-21","18:00:00",""
"2310468","12.483","","6.66","","9.195","","90","","111.63","","90","","710.613","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Ba S2 O6 (H2 O)2","","- Ba H4 O8 S2 -","- Ba H4 O8 S2 -","- Ba4 H16 O32 S8 -","4","0.5","","Rausell-Colom, J. A.; Garcia-Blanco, S.","The Crystal Structure of Barium Dithionate Dihydrate, Ba S2 O6 (H2 O)2","Acta Crystallographica (1,1948-23,1967)","1966","21","5","672","675","10.1107/S0365110X66003682","","","","","","","","","","","","","","","","","","","","","has coordinates","189185","2020-10-21","18:00:00",""
"2310475","9.822","","3.824","","7.036","","90","","118.84","","90","","231.49","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Th Ti2 O6","","- O6 Th Ti2 -","- O6 Th Ti2 -","- O12 Th2 Ti4 -","2","0.25","","Ruh, R.; Wadsley, A.D.","The crystal structure of Th Ti2 O6 (Brannerite)","Acta Crystallographica (1,1948-23,1967)","1966","21","","974","978","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310481","16.36","","13.946","","9.978","","90","","90","","90","","2276.55","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(N H3)5 Co O2 Co (N H3)5 S O4 (H S O4)3","","- Co2 H33 N10 O18 S4 -","- Co2 H33 N10 O18 S4 -","- Co8 H132 N40 O72 S16 -","4","1","","Schaefer, W.P.; Marsh, G.E.","The Structure of Decammine - mue-peroxo-dicobalt Monosulfate Tris(bisulfate)","Acta Crystallographica (1,1948-23,1967)","1966","21","","735","743","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310497","16.834","","10.156","","10.921","","90","","93.13","","90","","1864.33","","","","","","","","","","","","","4","I 1 2 1","I 2y","5","","Ca3 (V10 O28) (H2 O)17","","- Ca3 H34 O45 V10 -","- Ca3 O45 V10 -","- Ca6 O90 V20 -","2","0.5","","Swallow, A.G.; Ahmed, F.R.; Barnes, W.H.","The crystal structure of pascoite, Ca3 V10 O28 (H2 O)17","Acta Crystallographica (1,1948-23,1967)","1966","21","","397","405","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310498","6.58","","6.767","","6.143","","90","","121.73","","90","","232.646","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","(N H4) (O O H)","","- H5 N O2 -","- N O2 -","- N4 O8 -","4","1","","Tegenfeldt, J.; Olovsson, I.","Hydrogen bond studies. X. The crystal structure of ammonium hydrogenperoxide","Acta Crystallographica (1,1948-23,1967)","1966","21","","934","941","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310502","14.547","","8.77","","4.446","","90","","90","","90","","567.208","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","(Te2 O4) (H N O3)","","- H N O7 Te2 -","- N O7 Te2 -","- N4 O28 Te8 -","4","0.5","","Twink, L.N.; Carpenter, G.B.","The crystal structure of basic tellurium nitrate, Te2 O4 (H N O3)","Acta Crystallographica (1,1948-23,1967)","1966","21","","578","583","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310724","29.74","","3.824","","25.97","","90","","92.3","","90","","2951.08","","","","","","","","","","","","","3","C 1 2 1","C 2y","5","","W4 Nb26 O77","","- Nb26 O77 W4 -","- Nb26.0008 O77 W3.9992 -","- Nb52.0016 O154 W7.9984 -","2","0.5","","Andersson, S.; Mumme, W.G.; Wadsley, A.D.","Multiple phase formation in the binary system Nb2 O5-W O3. V. The structure of W4 Nb26 O77 an ordered intergrowth of the adjoining compounds W Nb12 O33 and W3 Nb14 O44","Acta Crystallographica (1,1948-23,1967)","1966","21","","802","808","","","","","","","","","","","","","","","","","","","","","","has coordinates","160657","2020-10-21","18:00:00",""
"2310910","9.153","","9.153","","9.153","","90","","90","","90","","766.815","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","Pr4 Ge3","","- Ge3 Pr4 -","- Ge3 Pr4 -","- Ge12 Pr16 -","4","0.0833333","","Hohnke, D.; Parthe, E.","The anti-Th3P4 structure type for rare earth germanides, antimonides and bismuthides","Acta Crystallographica (1,1948-23,1967)","1966","21","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","166707","2020-10-21","18:00:00",""
"2310911","9.458","","9.458","","9.458","","90","","90","","90","","846.054","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","","","- Pr4 Sb3 -","- Pr4 Sb3 -","- Pr16 Sb12 -","4","0.0833333","","Hohnke, D.; Parthe, E.","The anti-Th3P4 structure type for rare earth germanides, antimonides and bismuthides","Acta Crystallographica (1,1948-23,1967)","1966","21","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310912","9.159","","9.159","","9.159","","90","","90","","90","","768.324","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","Tb4 Sb3","","- Sb3 Tb4 -","- Sb3 Tb4 -","- Sb12 Tb16 -","4","0.0833333","","Hohnke, D.; Parthe, E.","The anti-Th3P4 structure type for rare earth germanides, antimonides and bismuthides","Acta Crystallographica (1,1948-23,1967)","1966","21","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","166709","2020-10-21","18:00:00",""
"2310913","9.072","","9.072","","9.072","","90","","90","","90","","746.636","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","","","- Ho4 Sb3 -","- Ho4 Sb3 -","- Ho16 Sb12 -","4","0.0833333","","Hohnke, D.; Parthe, E.","The anti-Th3P4 structure type for rare earth germanides, antimonides and bismuthides","Acta Crystallographica (1,1948-23,1967)","1966","21","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310914","9.406","","9.406","","9.406","","90","","90","","90","","832.175","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","","","- Nd4 Sb3 -","- Nd4 Sb3 -","- Nd16 Sb12 -","4","0.0833333","","Hohnke, D.; Parthe, E.","The anti-Th3P4 structure type for rare earth germanides, antimonides and bismuthides","Acta Crystallographica (1,1948-23,1967)","1966","21","","435","437","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310949","7.381","","7.381","","7.381","","90","","90","","90","","402.111","","","","","","","","","","","","","2","F d -3 m :1","F 4d 2 3 -1d","227","","","","- Pt2 Yb -","- Pt2 Yb -","- Pt16 Yb8 -","8","0.0416667","","Moriarty, J.L.; Humphreys, J.E.; Baenziger, N.C.; Gordon, R.O.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310950","4.9296","","4.9296","","4.9296","","90","","90","","90","","119.794","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In Nd3 -","- In Nd3 -","- In Nd3 -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310951","4.9636","","4.9636","","4.9636","","90","","90","","90","","122.29","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In Pr3 -","- In Pr3 -","- In Pr3 -","1","0.0208333","","Moriarty, J.L.; Baenziger, N.C.; Gordon, R.O.; Humphreys, J.E.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310952","4.5896","","4.5896","","4.5896","","90","","90","","90","","96.677","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In3 Tb -","- In3 Tb -","- In3 Tb -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Baenziger, N.C.; Gordon, R.O.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310953","3.739","","3.739","","3.739","","90","","90","","90","","52.272","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In Tm -","- In Tm -","- In Tm -","1","0.0208333","","Moriarty, J.L.; Baenziger, N.C.; Humphreys, J.E.; Gordon, R.O.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310954","4.561","","4.561","","4.561","","90","","90","","90","","94.881","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In3 Tm -","- In3 Tm -","- In3 Tm -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310955","4.6164","","4.6164","","4.6164","","90","","90","","90","","98.381","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- In3 Yb -","- In3 Yb -","- In3 Yb -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2311041","7.688","","7.539","","10.515","","90","","136.06","","90","","422.899","","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","W O3","","- O3 W -","- O3 W -","- O24 W8 -","8","2","","Loopstra, B.O.; Boldrini, P.","Neutron diffraction investigation of W O3","Acta Crystallographica (1,1948-23,1967)","1966","21","","158","162","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2311054","4.6554","","4.6554","","4.6554","","90","","90","","90","","100.895","","","","","","","","","","","","","2","P m -3 m","-P 4 2 3","221","","","","- Tl3 Tm -","- Tl3 Tm -","- Tl3 Tm -","1","0.0208333","","Moriarty, J.L.; Humphreys, J.E.; Gordon, R.O.; Baenziger, N.C.","X-ray examination of some rare-earth-containing binary alloy systems","Acta Crystallographica (1,1948-23,1967)","1966","21","","840","841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"5000083","9.56","0.02","7.9","0.03","11.78","0.02","90","","111.37","0.03","90","","828.5","","","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H30 O2 -","- C19 H30 O2 -","- C38 H60 O4 -","2","1","","High, D. F.; Kraut, J.","The crystal structure of androsterone","Acta Crystallographica","1966","21","1","88","96","10.1107/S0365110X66002378","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"5000147","7.27","0.01","11.06","0.02","12.27","0.02","90","","98.8","0.3","90","","974.97","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H3 N5 O8 -","- C6 H3 N5 O8 -","- C24 H12 N20 O32 -","4","1","","Dickinson, C.; Stewart, J. M.; Holden, J. R.","A direct determination of the crystal structure of 2,3,4,6-tetranitroaniline","Acta Crystallographica","1966","21","5","663","670","10.1107/S0365110X66003669","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"9007489","10.063","","10.522","","6.107","","90","","90","","90","","646.627","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","Euchroite","- As Cu2 H7 O8 -","- As Cu2 H7 O8 -","- As4 Cu8 H28 O32 -","4","1","","Finney, J. J.","Refinement of the crystal structure of euchroite, Cu2(AsO4)(OH)*3H2O","Acta Crystallographica","1966","21","","437","440","10.1107/S0365110X66003104","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46",""
"9011062","6.79","","6.79","","18.305","","90","","90","","90","","843.936","","","","","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","","","Retgersite (deuterated)","- D12 Ni O10 S -","- D12 Ni O10 S -","- D48 Ni4 O40 S4 -","4","0.5","","O'Connor B H; Dale, D. H.","A neutron diffraction analysis of the crystal structure of tetragonal nickel sulphate hexadeuterate Locality: synthetic","Acta Crystallographica","1966","21","","705","709","10.1107/S0365110X66003748","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47",""
"9014323","16.46","","12.5","","10.01","","90","","115.43","","90","","1860.01","","","","","","","","","","","","San Benito, California, USA","7","C 1 2/c 1","-C 2yc","15","","","Neptunite","- Fe2 K Li Na2 O24 Si8 Ti2 -","- Fe2 K Li Na2 O24 Si8 Ti2 -","- Fe8 K4 Li4 Na8 O96 Si32 Ti8 -","4","0.5","","Cannillo, E.; Mazzi, F.; Rossi, G.","The crystal structure of neptunite","Acta Crystallographica","1966","21","","200","208","10.1107/S0365110X66002627","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17",""
"9016354","19.156","","14.127","","7.489","","90","","90","","90","","2026.65","","","","","","","","","","","","Kamloops Lake, British Columbia, Canada","6","I m m m","-I 2 2","71","","","Ferrierite-Mg","- Al2.754 H12 Mg Na0.75 O42 Si15.246 -","- Al2.754 H12 Mg Na0.75 O42 Si15.246 -","- Al5.508 H24 Mg2 Na1.5 O84 Si30.492 -","2","0.125","","Vaughan, P. A.","The crystal structure of the zeolite ferrierite","Acta Crystallographica","1966","21","","983","990","10.1107/S0365110X66004298","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52",""