# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-04-22T06:11:20+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 'Australian Journal of Chemistry') 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
"1000427","6.9909","0.0003","7.9593","0.0003","18.89629","0.0008","90","","95.176","0.003","90","","1047.2","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Dibismuth tetratellurium oxide","Chekhovichite","- Bi2 O11 Te4 -","- Bi2 O11 Te4 -","- Bi8 O44 Te16 -","4","1","","Rossell, H. J.; Leblanc, M.; Ferey, G.; Bevan, D. J. M.; Simpson, D. J.; Taylor, M. R.","On the crystal structure of Bi2Te4O11 Locality: synthetic","Australian Journal of Chemistry","1992","45","","1415","1425","10.1071/CH9921415","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1509471","7.913","","10.721","","10.857","","90","","90","","90","","921.057","","","","","","","","","","","","","4","F d 2 d","F -2d -2d","43","","Na Ag (N O2)2","","- Ag N2 Na O4 -","- Ag N2 Na O4 -","- Ag8 N16 Na8 O32 -","8","0.5","","Skelton, B.W.; White, A.H.","Crystal structure of sodium O,O-nitritonitroargentate(I)","Australian Journal of Chemistry","1979","32","","297","300","10.1071/CH9790297","","","","","","","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1511079","6.2633","","5.7967","","5.6009","","90","","90","","90","","203.349","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","Cs Na2 (B O3)","","- B Cs Na2 O3 -","- B Cs Na2 O3 -","- B2 Cs2 Na4 O6 -","2","0.25","","Hoppe, R.; Schlaeger, M.","Preparation and Crystal Structure of CsNa2(BO3) and RbNa2(BO3)","Australian Journal of Chemistry","1992","45","","1427","1439","10.1071/CH9921427","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1511251","6.133","","5.68","","5.549","","90","","90","","90","","193.302","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","Rb Na2 (B O3)","","- B Na2 O3 Rb -","- B Na2 O3 Rb -","- B2 Na4 O6 Rb2 -","2","0.25","","Hoppe, R.; Schlaeger, M.","Preparation and Crystal Structure of CsNa2(BO3) and RbNa2(BO3)","Australian Journal of Chemistry","1992","45","","1427","1439","10.1071/CH9921427","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1514117","4.4041","0.0001","4.4041","0.0001","2.8765","0.0001","90","","90","","90","","55.793","0.003","","","","","","","","","","","","2","P 42/m n m","-P 4n 2n","136","","Manganese(IV) Oxide - Beta","Pyrolusite","- Mn O2 -","- Mn O2 -","- Mn2 O4 -","2","0.125","","Bolzan, A. A.; Fong, C.; Kennedy, B. J.; Howard, C. J.","Powder neutron diffraction study of pyrolusite, beta-Mn O2","Australian Journal of Chemistry","1993","46","","939","944","10.1071/CH9930939","","","","","","0.017","","","","","","","","","","","","","","","has coordinates","176808","2020-10-21","18:00:00",""
"1521047","11.108","","10.955","","11.666","","90","","103.32","","90","","1381.42","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","(Ni (S2 O3)) (C14 H12 N2)","","- C14 H12 N2 Ni O3 S2 -","- C14 N2 Ni O3 S2 -","- C56 N8 Ni4 O12 S8 -","4","1","","Freire, E.; Baggio, S.; Suescun, L.; Baggio, R.","X-ray study of two nickel(II)-thiosulfate compounds","Australian Journal of Chemistry","2000","53","","785","790","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521676","19.118","","19.118","","12.383","","90","","90","","120","","3919.6","","","","","","","","","","","","","4","P 62 2 2","P 62 2 (0 0 4)","180","","K6 (Co W12 O40) (H2 O)16","","- Co K5 O46 W12 -","- Co K5 O46 W12 -","- Co3 K15 O138 W36 -","3","0.25","","Nolan, A.L.; Allen, C.C.; Burns, R.C.; Craig, D.C.; Lawrance, G.A.","X-ray structural studies of K6 (Co(II) W12 O40) . ca 16(H2 O) and K5 (Co(III) W12 O40). ca 16(H2 O) and structural trends along the (X W12 O40)(n-) series, where X = P(V), Si(IV), Co(III) and Co(II)","Australian Journal of Chemistry","2000","53","","59","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521677","19.111","","19.111","","12.509","","90","","90","","120","","3956.58","","","","","","","","","","","","","5","P 62 2 2","P 62 2 (0 0 4)","180","","K5 (Co W12 O40) (H2 O)3","","- Co H6 K5 O43 W12 -","- Co K5 O43 W12 -","- Co3 K15 O129 W36 -","3","0.25","","Nolan, A.L.; Allen, C.C.; Burns, R.C.; Lawrance, G.A.; Craig, D.C.","X-ray structural studies of K6 (Co(II) W12 O40) . ca 16(H2 O) and K5 (Co(III) W12 O40). ca 16(H2 O) and structural trends along the (X W12 O40)(n-) series, where X = P(V), Si(IV), Co(III) and Co(II)","Australian Journal of Chemistry","2000","53","","59","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525769","11.758","","8.016","","8.858","","90","","90","","90","","834.885","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(La (H2 O)9) I3","","- H18 I3 La O9 -","- I3 La O9 -","- I6 La2 O18 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally') hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525771","11.26","","7.933","","8.844","","90","","90","","90","","789.995","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Ho (H2 O)9) I3","","- H18 Ho I3 O9 -","- H18 Ho I3 O9 -","- H36 Ho2 I6 O18 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","191025","2020-10-21","18:00:00",""
"1525772","11.53","","7.928","","8.907","","90","","90","","90","","814.187","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Sm (H2 O)9) I3","","- H18 I3 O9 Sm -","- H18 I3 O9 Sm -","- H36 I6 O18 Sm2 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525773","11.47","","7.902","","8.923","","90","","90","","90","","808.744","","","","","","","","","","","","","4","P m m n :2","-P 2ab 2a","59","","(Gd (H2 O)9) I3","","- Gd H18 I3 O9 -","- Gd H18 I3 O9 -","- Gd2 H36 I6 O18 -","2","0.25","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525775","8.196","","12.87","","17.106","","90","","103.676","","90","","1753.23","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Er (H2 O)8) I3 (H2 O)2","","- Er H20 I3 O10 -","- Er I3 O10 -","- Er4 I12 O40 -","4","1","","Lim, K.C.; White, A.H.; Skelton, B.W.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525777","8.162","","12.836","","17.059","","90","","103.785","","90","","1735.75","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Lu (H2 O)8) I3 (H2 O)2","","- H20 I3 Lu O10 -","- I3 Lu O10 -","- I12 Lu4 O40 -","4","1","","Lim, K.C.; Skelton, B.W.; White, A.H.","Structural systematics of rare earth complexes. XXII. ('Maximally')hydrated rare earth iodides","Australian Journal of Chemistry","2000","53","","867","873","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525779","7.516","","7.564","","9.468","","90","","99.212","","90","","531.323","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Sc (H2 O)7) Cl3","","- Cl3 H14 O7 Sc -","- Cl3 H14 O7 Sc -","- Cl6 H28 O14 Sc2 -","2","0.5","","Lim, K.C.; Skelton, B.W.; White, A.H.","Crystal structures of the 'maximally' hydrated scandium halides, Sc X3 . n(H2 O) (X = Cl, Br, I)","Australian Journal of Chemistry","2000","53","","875","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525781","7.714","","7.764","","9.762","","90","","98.876","","90","","577.659","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Sc (H2 O)7) Br3","","- Br3 H14 O7 Sc -","- Br3 O7 Sc -","- Br6 O14 Sc2 -","2","0.5","","Lim, K.C.; Skelton, B.W.; White, A.H.","Crystal structures of the 'maximally' hydrated scandium halides, ScX3 . n(H2 O) (X = Cl, Br, I)","Australian Journal of Chemistry","2000","53","","875","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525783","13.584","","8.216","","14.172","","90","","113.45","","90","","1451.05","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(Sc (H2 O)7) I3 (H2 O)","","- H16 I3 O8 Sc -","- H16 I3 O8 Sc -","- H64 I12 O32 Sc4 -","4","1","","Lim, K.C.; Skelton, B.W.; White, A.H.","Crystal structures of the 'maximally' hydrated scandium halides, ScX3 . n(H2 O) (X = Cl, Br, I)","Australian Journal of Chemistry","2000","53","","875","878","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529582","15.453","","3.8368","","9.123","","90","","99.25","","90","","533.87","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","(K0.58 Ba0.36)2 (Ti6 O13)","","- Ba0.72 K1.16 O13 Ti6 -","- Ba0.72 K1.16 O13 Ti6 -","- Ba1.44 K2.32 O26 Ti12 -","2","0.25","","Bagshaw, A.N.; Doran, B.H.; White, A.H.; Willis, A.C.","Crystal structure of a natural potassium-barium hexatitanate isostructural with K2 Ti6 O13","Australian Journal of Chemistry","1977","30","","1195","1200","","","","","","","","","","","","","","","","","","","","","","has coordinates","154032","2020-10-21","18:00:00",""
"1529925","7.047","","10.4","","8.384","","90","","107.29","","90","","586.688","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","K3 (Fe (C N)6)","","- C6 Fe K3 N6 -","- C6 Fe K3 N6 -","- C12 Fe2 K6 N12 -","2","0.5","","Figgis, B.N.; Skelton, B.W.; White, A.H.","Crystal structures of the simple monoclinic and orthorhombic polytypes of tripotassium hexacyanoferrate(III)","Australian Journal of Chemistry","1978","31","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529926","13.422","","10.399","","8.381","","90","","90","","90","","1169.78","","","","","","","","","","","","","4","P n c a","-P 2a 2n","60","","K3 (Fe (C N)6)","","- C6 Fe K3 N6 -","- C6 Fe K3 N6 -","- C24 Fe4 K12 N24 -","4","0.5","","Figgis, B.N.; Skelton, B.W.; White, A.H.","Crystal structures of the simple monoclinic and orthorhombic polytypes of tripotassium hexacyanoferrate(III)","Australian Journal of Chemistry","1978","31","","1195","1199","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529927","8.594","","8.598","","18.126","","90","","90","","90","","1339.35","","","","","","","","","","","","","6","P c m n","-P 2n 2ac","62","","(Co (N H3)6) (Cr O4) Cl (H2 O)3","","- Cl Co Cr H24 N6 O7 -","- Cl Co Cr H24 N6 O7 -","- Cl4 Co4 Cr4 H96 N24 O28 -","4","0.5","","Figgis, B.N.; Skelton, B.W.; White, A.H.","Crystal structure of Hexaamminecobalt(III) Chloride chromate trihydrate","Australian Journal of Chemistry","1979","32","","417","419","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529928","10.58","","6.72","","5.863","","90","","114.82","","90","","378.342","","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","Ni (N D3)4 (N O2)2","","- D12 N6 Ni O4 -","- D12 N6 Ni O4 -","- D24 N12 Ni2 O8 -","2","0.25","","Figgis, B.N.; Williams, G.A.; Reynolds, P.A.; Lehner, N.","The crystal structure of deuterated trans-tetraamminedinitronickel(II) at 4.2 K by neutron diffraction","Australian Journal of Chemistry","1981","34","","993","999","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529929","9.46","","9.46","","15.04","","90","","90","","90","","1345.95","","","","","","","","","","","","","3","I 4/m c m","-I 4 2c","140","","Cs3 Co Br5","","- Br5 Co Cs3 -","- Br5 Co Cs3 -","- Br20 Co4 Cs12 -","4","0.125","","Figgis, B.N.; Reynolds, P.A.","The crystal structure of tricesium tetrabromocobalte(II) bromide, Cs3 Co Br5, at 4.2 K by neutron diffraction","Australian Journal of Chemistry","1981","34","","2495","2498","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530104","11.716","","11.716","","8.988","","90","","90","","90","","1233.73","","","","","","","","","","","","","5","I -4","I -4","82","","(Re (C O)3 F)4 (H2 O)4","","- C12 H8 F4 O16 Re4 -","- C12 F4 O16 Re4 -","- C24 F8 O32 Re8 -","2","0.25","","Horn, E.; Snow, M.R.","A tetranuclear carbonyl fluoro rhenium(I) cluster, (Re (C O)3 F)4 (H2 O)4","Australian Journal of Chemistry","1981","34","","737","743","","","","","","","","","","","","","","","","","","","","","","has coordinates","155079","2020-10-21","18:00:00",""
"1530105","27.085","","7.208","","13.404","","90","","105.5","","90","","2521.67","","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","Re (C O)5 (H2 O) As F6","","- C5 H2 As F6 O6 Re -","- C5 As F6 O6 Re -","- C40 As8 F48 O48 Re8 -","8","1","","Horn, E.; Snow, M.R.","Aqua and perfluoro anion ((BF4)(-), (AsF6)(-)). Coordination isomers of manganese and rhenium carbonyls","Australian Journal of Chemistry","1984","37","","1375","1393","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530878","6.202","","6.202","","7.41","","90","","90","","90","","285.024","","","","","","","","","","","","","4","P 4/n m m :2","-P 4a 2a","129","","(V O) (P O4) (H2 O)2","","- H4 O7 P V -","- O7 P V -","- O14 P2 V2 -","2","0.125","","Tietze, H.R.","The crystal and molecular structure of oxovanadium(V) orthophosphate dihydrate, V O P O4 (H2 O)2","Australian Journal of Chemistry","1981","34","","2035","2038","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534508","9.659","","6.529","","7.936","","90","","93.67","","90","","499.446","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Eu Cl2 (O H2)6) Cl","","- Cl3 Eu H12 O6 -","- Cl3 Eu H12 O6 -","- Cl6 Eu2 H24 O12 -","2","0.5","","Lepert, D.L.; Patrick, J.M.; White, A.H.","Structure and Stereochemistry in 'f-Block' Complexes of High Coordination Number. VII The (M(unidentate X)2(unidentate Y)6) System: Crystal Structure of Hexaaquadichloroeuropium(III) Chloride (a Redetermination)","Australian Journal of Chemistry","1983","36","","477","482","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534990","7.207","","23.84","","4.014","","90","","95.24","","90","","686.783","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","N H4 Ag (S C N)2","","- C2 H4 Ag N3 S2 -","- C2 H4 Ag N3 S2 -","- C8 H16 Ag4 N12 S8 -","4","1","","Hall, S.R.; White, A.H.; Mills, N.K.","Crystal structure of ammonium bis(thiocyanato)argentate (I) (a redetermination)","Australian Journal of Chemistry","1983","36","","1255","1258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535038","13.99","","13.99","","7.444","","90","","90","","120","","1261.75","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(La (H2 O)9) ((C F3) S O3)3","","- C3 H18 F9 La O18 S3 -","- C3 H18 F9 La O18 S3 -","- C6 H36 F18 La2 O36 S6 -","2","0.166667","","Harrowfield, J.M.B.; Patrick, J.M.; Kepert, D.L.; White, A.H.","Structure and stereochemistry in 'f-block' complexes of high coordination number. VIII The (M(unidentate)9) system. Crystal structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535041","13.7","","13.7","","7.512","","90","","90","","120","","1221.03","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Gd (H2 O)9) ((C F3) S O3)3","","- C3 H18 F9 Gd O18 S3 -","- C3 H18 F9 Gd O18 S3 -","- C6 H36 F18 Gd2 O36 S6 -","2","0.166667","","Harrowfield, J.M.B.; Kepert, D.L.; Patrick, J.M.; White, A.H.","Structure and stereochemistry in 'f-block' complexes of high coordination number. VIII The (M(unidentate)9) system. Crystal structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535042","13.259","","13.259","","7.751","","90","","90","","120","","1180.08","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Lu (H2 O)9) (C F3 S O3)3","","- C3 H18 F9 Lu O18 S3 -","- C3 H18 F9 Lu O18 S3 -","- C6 H36 F18 Lu2 O36 S6 -","2","0.166667","","Harrowfield, J.M.B.; Kepert, D.L.; Patrick, J.M.; White, A.H.","Structure and Stereochemistry in 'f-Block' Complexes of High Coordination Number. VIII The (M(unidentate)9) System. Crystal Structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535043","13.52","","13.52","","7.653","","90","","90","","120","","1211.48","","","","","","","","","","","","","6","P 63/m","-P 6c","176","","(Y (H2 O)9) (C F3 S O3)3","","- C3 H18 F9 O18 S3 Y -","- C3 H18 F9 O18 S3 Y -","- C6 H36 F18 O36 S6 Y2 -","2","0.166667","","Harrowfield, J.M.B.; Kepert, D.L.; Patrick, J.M.; White, A.H.","Structure and Stereochemistry in 'f-Block' Complexes of High Coordination Number. VIII The (M(unidentate)9) System. Crystal Structures of (M (O H2)9) (C F3 S O3)3, M= La, Gd, Lu, Y","Australian Journal of Chemistry","1983","36","","483","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536455","24.739","","24.739","","4.412","","90","","90","","120","","2338.46","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(As I3) (S8)3","","- As I3 S24 -","- As I3 S24 -","- As3 I9 S72 -","3","0.166667","","Kelly, J.F.; Krausz, E.; Samoc, A.; Samoc, M.; Willis, A.C.","Crystal structure of the second order nonlinear optical addition complex, (As I3) * 3(S8)","Australian Journal of Chemistry","2002","55","","709","714","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536832","12.436","","15.682","","12.072","","90","","90","","90","","2354.3","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","K3 (Ir Cl6) H2 O","","- Cl6 H2 Ir K3 O -","- Cl6 Ir K3 O -","- Cl48 Ir8 K24 O8 -","8","1","","Rankin, D.A.","The chloro and bromo complexes of iridium(III) and iridium(IV). II. Structural chemistry of Ir(III) complexes","Australian Journal of Chemistry","1983","36","","771","883","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536834","12.229","","7.011","","14.088","","90","","90","","90","","1207.87","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","(N H4)3 (Ir Cl6) (H2 O)","","- Cl6 H14 Ir N3 O -","- Cl6 H14 Ir N3 O -","- Cl24 H56 Ir4 N12 O4 -","4","0.5","","Rankin, D.A.","The chloro and bromo complexes of iridium(III) and iridium(IV). II Structural chemistry of Ir(III) complexes","Australian Journal of Chemistry","1983","36","","871","883","","","","","","","","","","","","","","","","","","","","","","has coordinates","186592","2020-10-21","18:00:00",""
"1536837","12.768","","7.391","","14.982","","90","","90","","90","","1413.83","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Rb3 Ir Br6 H2 O","","- Br6 H2 Ir O Rb3 -","- Br6 Ir O Rb3 -","- Br24 Ir4 O4 Rb12 -","4","0.5","","Rankin, D.A.","The chloro and bromo complexes of iridium(III) and iridium(IV). II. Structural chemistry of Ir(III) complexes","Australian Journal of Chemistry","1983","36","","871","883","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539737","9.13","","12.32","","6.25","","90","","107","","90","","672.292","","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","(N D4)2 V (S O4)2 (D2 O)6","","- D20 N2 O14 S2 V -","- D20 N2 O14 S2 V -","- D40 N4 O28 S4 V2 -","2","0.5","","Deeth, R.J.; Kucharski, E.S.; Figgis, B.N.; Forsyth, J.B.; Reynolds, P.A.","Structures of (ND4)2V(SO4)2(D2O)6 and (ND4)2 V.45Zn.55(SO4)2(D2O)6 at 5.8 K by neutron diffraction","Australian Journal of Chemistry","1988","41","","1289","1294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539741","9.14","","12.32","","6.25","","90","","107","","90","","673.028","","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","(N D4)2 (V.45 Zn.55) (S O4)2 (D2 O)6","","- D20 N2 O14 S2 V0.45 Zn0.55 -","- D20 N2 O14 S2 V0.45 Zn0.55 -","- D40 N4 O28 S4 V0.9 Zn1.1 -","2","0.5","","Deeth, R.J.; Figgis, B.N.; Forsyth, J.B.; Kucharski, E.S.; Reynolds, P.A.","Structures of (ND4)2V(SO4)2(D2O)6 and (ND4)2 V.45Zn.55(SO4)2(D2O)6 at 5.8 K by neutron diffraction","Australian Journal of Chemistry","1988","41","","1289","1294","","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1541223","3.95","","3.95","","6.64","","90","","90","","120","","89.721","","","","","","","","","","","","","2","P 63/m m c","-P 6c 2c","194","","Zr Te","","- Te Zr -","- Te Zr -","- Te2 Zr2 -","2","0.0833333","","McTaggart, F.K.; Wadsley, A.D.","The sulphides, selenides, and tellurides of titanium, zirconium, hafnium, and thorium. I. Preparation and characterization","Australian Journal of Chemistry","1958","11","","445","457","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1548686","5.5769","0.0002","4.8986","0.0001","5.6644","0.0002","90","","120.678","0.001","90","","133.089","0.007","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","Tungsten dioxide","","- O2 W -","- O2 W -","- O8 W4 -","4","1","","Bolzan, Adrian A.; Kennedy, Brendan J.; Howard, Christopher J.","Neutron Powder Diffraction Study of Molybdenum and Tungsten Dioxides","Australian Journal of Chemistry","1995","48","8","1473","1477","10.1071/ch9951473","powder diffraction","neutron","1.4925","","","","","","","","","","0.0191","","","","","","","","has coordinates","205200","2020-10-21","18:00:00",""
"1548687","5.6102","0.0003","4.8573","0.0002","5.6265","0.0003","90","","120.915","0.002","90","","131.542","0.012","","","","","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","Molybdenum dioxide","","- Mo O2 -","- Mo O2 -","- Mo4 O8 -","4","1","","Bolzan, Adrian A.; Kennedy, Brendan J.; Howard, Christopher J.","Neutron Powder Diffraction Study of Molybdenum and Tungsten Dioxides","Australian Journal of Chemistry","1995","48","8","1473","1477","10.1071/ch9951473","powder diffraction","neutron","1.4925","","","","","","","","","","0.0157","","","","","","","","has coordinates","205200","2020-10-21","18:00:00",""
"5000113","12.35","0.01","10.521","0.007","9.39","0.008","90","","90","","90","","1220.08","","","","","","","","","","","","","3","P n c a","-P 2a 2n","60","","","","- C12 H6 Cl4 -","- C24 H12 Cl8 -","- C96 H48 Cl32 -","4","0.5","","Field, L. D.; Skelton, B. W.; Sternhell, S.; White, A. H.","Structual Studies of Some 2,6(2',6')-Halogen-Substituted Biphenyl Derivatives","Australian Journal of Chemistry","1985","38","3","391","399","10.1071/CH9850391","","","","","","","","","","","","","","","","","","","","","has coordinates","175379","2020-10-21","18:00:00",""
"5000176","15.762","0.005","7.694","0.002","12.526","0.004","90","","93.38","0.02","90","","1516.42","","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C10 H6 Cl8 -","- C10 H6 Cl8 -","- C40 H24 Cl32 -","4","1","","Knox, J. R.; Raston, C. L.; White, A. H.","Crystal Structures of the cis - and trans -Chlordanes and Their Photoisomers","Australian Journal of Chemistry","1979","32","3","553","565","10.1071/CH9790553","","","","","","","","","","","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"6000036","9.4302","","9.4302","","6.8911","","90","","90","","120","","530.72","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 H2 O26 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000037","9.3475","0.0003","9.3475","0.0003","6.8646","0.0001","90","","90","","120","","519.5","","","","","","","","","","","","","4","P 63/m","-P 6c","176","","","","- Ca10 F2 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","203334","2020-10-21","18:00:00",""
"6000038","9.5902","","9.5902","","6.7666","","90","","90","","120","","538.96","","","","","","","","","","","","","4","P 63/m","","","","","","- Ca10 Cl2 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000039","9.6482","","9.6482","","6.7788","","90","","90","","120","","546.48","","","","","","","","","","","","","4","P 63/m","","","","","","- Br2 Ca10 O24 P6 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000040","9.8612","","9.8612","","7.4242","","90","","90","","120","","625.23","","","","","","","","","","","","","4","P 63/m","","","","","","- H2 O26 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000041","9.7547","","9.7547","","7.2832","","90","","90","","120","","600.18","","","","","","","","","","","","","4","P 63/m","","","","","","- F2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000042","9.9767","","9.9767","","7.3255","","90","","90","","120","","631.45","","","","","","","","","","","","","4","P 63/m","","","","","","- Cl2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000043","10.0618","","10.0618","","7.3792","","90","","90","","120","","646.98","","","","","","","","","","","","","4","P 63/m","","","","","","- Br2 O24 P6 Pb10 -","","","","","","Kim, J. Y.; Fenton, R. R.; Hunter, B. A.; Kennedy, B. J.","Powder diffraction studies of synthetic calcium and lead apatites","Australian Journal of Chemistry","2000","53","","679","686","10.1071/CH00060","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"9009927","5.7344","","6.78","","5.4413","","97.29","","108.56","","107.28","","185.681","","","","","","","","","","","","","5","P -1","-P 1","2","","","Collinsite","- Ca2 H4 Mg O10 P2 -","- Ca2 H4 Mg O10 P2 -","- Ca2 H4 Mg O10 P2 -","1","0.5","","Brotherton, P. D.; Maslen, E. N.; Pryce, M. W.; White, A. H.","Crystal structure of collinsite","Australian Journal of Chemistry","1974","27","","653","656","10.1071/CH9740653","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9012596","11.404","","6.228","","6.826","","90","","99.66","","90","","477.936","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","Baylissite","- C2 H8 K2 Mg O10 -","- C2 H8 K2 Mg O10 -","- C4 H16 K4 Mg2 O20 -","2","0.5","","Bucat, R. B.; Patrick, J. M.; White, A. H.; Willis, A. C.","Crystal structure of baylissite, K2Mg(CO3)2,4H2O","Australian Journal of Chemistry","1977","30","","1379","1382","10.1071/CH9771379","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9012597","13.706","","9.924","","7.024","","90","","90","","90","","955.393","","","","","","","","","","","","Synthetic","5","P n m a","-P 2ac 2n","62","","","Kremersite","- Cl5 Fe H10 N2 O -","- Cl5 Fe H10 N2 O -","- Cl20 Fe4 H40 N8 O4 -","4","0.5","","Figgis, B. N.; Raston, C. L.; Sharma, R. P.; White, A. H.","Crystal structure of diammonium aquapentachloroferrate(III)","Australian Journal of Chemistry","1978","31","","2717","2720","10.1071/CH9782717","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012598","8.6705","","8.6705","","11.7573","","90","","90","","90","","883.885","","","","","","","","","","","","Synthetic","3","I 41/a m d :2","-I 4bd 2","141","","","Jalpaite","- Ag3 Cu S2 -","- Ag3 Cu S2 -","- Ag24 Cu8 S16 -","8","0.25","","Baker, C. L.; Lincoln, F. J.; Johnson, W. S.","Crystal structure determination of Ag3CuS2 from powder X-ray diffraction data","Australian Journal of Chemistry","1992","45","","1441","1449","10.1071/CH9921441","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""