# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-09-28T06:11:43+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Inorganic Chemistry') AND volume = 8 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
"1008058","6.2821","0.0007","3.6491","0.0004","10.844","0.001","90","","92.24","0.01","90","","248.4","","","","","","","","","","","","","3","I 1 2/m 1","-I 2y","12","","Nickel dirhodium(III) selenide","","- Ni Rh2 Se4 -","- Ni Rh2 Se4 -","- Ni2 Rh4 Se8 -","2","0.25","","Bouchard, R J","The crystal structure and transport properties of Ni Rh~2~ Se~4~","Inorganic Chemistry","1969","8","","850","856","10.1021/ic50074a030","","","","","","0.053","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"4331453","7.503","","7.503","","10.784","","90","","90","","90","","607.085","","","","","","","","","","","","","4","P 42/n m c :2","-P 4ac 2a","137","","Zn (N H3)4 (B8 H8)","","- B8 H8 N4 Zn -","- B8 H8 N4 Zn -","- B16 H16 N8 Zn2 -","2","0.125","","Guggenberger, L.J.","The Crystal Structure of Tetraamminezinc Octahydrooctaborate(-2), Zn (N H3)4 (B8 H8)","Inorganic Chemistry","1969","8","","2771","2774","10.1021/ic50082a046","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4331455","13.893","","10.578","","6.075","","90","","90","","90","","892.783","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","B4 F6 P F3","","- B4 F9 P -","- B4 F9 P -","- B16 F36 P4 -","4","0.5","","de Boer, B.G.; Templeton, D.H.; Zalkin, A.","The crystal and molecular structure of phosphorus trifluoride-tris(difluoroboryl)borane, B4 F6 P F3","Inorganic Chemistry","1969","8","","836","841","10.1021/ic50074a028","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4343742","7.608","","10.616","","11.101","","90","","108.5","","90","","850.257","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Eu4 Al2 O9","","- Al2 Eu4 O9 -","- Al2 Eu4 O9 -","- Al8 Eu16 O36 -","4","1","","Brandle, C.D.; Steinfink, H.","The crystal structure of Eu4 Al2 O9","Inorganic Chemistry","1969","8","","1320","1324","","","","","","","","","","","","","","","","","","","","","","has coordinates","148572","2020-10-21","18:00:00",""
"4343756","7.089","","19.24","","20.682","","90","","98","","90","","2793.41","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","Cs2 (B9 C2 H11) Co (B8 C2 H10) Co (B9 C2 H11) H2 O","","- C6 H34 B26 Co2 Cs2 O -","- C6 H32 B26 Co2 Cs2 O -","- C24 H128 B104 Co8 Cs8 O4 -","4","1","","Clair, D.S.; Templeton, D.H.; Zalkin, A.","The crystal structure of Cs2 (B9 C2 H11) Co (B8 C2 H10) Co (B9 C2 H11) H2 O)","Inorganic Chemistry","1969","8","","2080","2086","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343765","3.438","","11.88","","4.725","","90","","90","","90","","192.985","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","","","- Nb P S -","- Nb P S -","- Nb4 P4 S4 -","4","0.25","","Donohue, P.C.; Bierstedt, P.E.","The synthesis, crystal structure, and superconducting properties of niobium phosphorus sulfide, niobium phosphorus selenide, and tantalum phosphorus sulfide","Inorganic Chemistry","1969","8","","2690","2694","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343766","3.462","","12.33","","4.821","","90","","90","","90","","205.791","","","","","","","","","","","","","3","I m m m","-I 2 2","71","","","","- Nb P Se -","- Nb P Se -","- Nb4 P4 Se4 -","4","0.25","","Donohue, P.C.; Bierstedt, P.E.","The synthesis, crystal structure, and superconducting properties of niobium phosphorus sulfide, niobium phosphorus selenide, and tantalum phosphorus sulfide","Inorganic Chemistry","1969","8","","2690","2694","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343770","24.18","","12.69","","14.14","","90","","92.1","","90","","4335.86","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","Na12 (Mn Nb12 O38) (H2 O)50","","- Mn Nb12 O86 -","- Mn Nb12 O86 -","- Mn2 Nb24 O172 -","2","0.5","","Flynn, C.M.; Stucky, G.D.","The crystal structure of sodium 12-niobomanganate(IV), Na12 Mn Nb12 O38 (H2 O)50","Inorganic Chemistry","1969","8","","335","344","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343771","11.72","","6.74","","9.65","","90","","107.8","","90","","725.79","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Mn (N O) (C O)4","","- C4 Mn N O5 -","- C4 Mn N O5 -","- C16 Mn4 N4 O20 -","4","0.5","","Frenz, B.A.; Enemark, J.H.; Ibers, J.A.","The structure of nitrosyltetracarbonylmanganese, Mn (N O) (C O)4","Inorganic Chemistry","1969","8","","1288","1293","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343773","8.4","","7.17","","19.52","","90","","97.3","","90","","1166.12","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Cu2 (N S C)3 (N H3)3","","- C3 H9 Cu2 N6 S3 -","- C3 Cu2 N6 S3 -","- C12 Cu8 N24 S12 -","4","1","","Garaj, J.","The crystal chemistry of tri-mue-thiocyanato-triammine copper(I)copper(II)","Inorganic Chemistry","1969","8","","304","308","","","","","","","","","","","","","","","","","","","","","","has coordinates","148955","2020-10-21","18:00:00",""
"4343774","6.846","","6.846","","5.744","","90","","90","","120","","233.141","","","","","","","","","","","","","3","P 63/m m c","-P 6c 2c","194","","Ba Ta S3","","- Ba S3 Ta -","- Ba S3 Ta -","- Ba2 S6 Ta2 -","2","0.0833333","","Gardner, R.A.; Vlasse, M.; Wold, A.","Electrical properties and crystal structure of barium tantalum sulfide, Ba Ta S3","Inorganic Chemistry","1969","8","","2784","2787","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343777","12.85","","5.912","","7.434","","90","","111.2","","90","","526.535","","","","","","","","","","","","","5","C 1 2/m 1","-C 2y","12","","(N H4)2 Zn (N H3)2 (Cr O4)2","","- Cr2 H14 N4 O8 Zn -","- Cr2 N4 O8 Zn -","- Cr4 N8 O16 Zn2 -","2","0.25","","Harel, M.; Knobler, C.; McCullough, J.D.","The crystal structure of the ammonium salt of catena-di-mue-chromato-diamminezincate(II), (N H4)2 (Zn (N H3)2 (Cr O4)2)","Inorganic Chemistry","1969","8","","11","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343779","7.374","","6.811","","8.185","","90","","90","","90","","411.086","","","","","","","","","","","","","4","P n 21 a","P -2ac -2n","33","","K Xe O3 F","","- F K O3 Xe -","- F K O3 Xe -","- F4 K4 O12 Xe4 -","4","1","","Hodgson, D.J.; Ibers, J.A.","The crystal and molecular structure of potassium monofluoroxenate(VI), K Xe O3 F","Inorganic Chemistry","1969","8","","326","331","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343785","12.508","","15.196","","5.448","","90","","90","","90","","1035.51","","","","","","","","","","","","","2","P 21 21 21","P 2ac 2ab","19","","Re2 O7","","- O7 Re2 -","- O7 Re2 -","- O56 Re16 -","8","2","","Krebs, B.; Mueller, A.; Beyer, H.H.","The crystal structure of rhenium(VII) oxide","Inorganic Chemistry","1969","8","","436","443","","","","","","","","","","","","","","","","","","","","","","has coordinates","149375","2020-10-21","18:00:00",""
"4343793","5.487","","5.487","","14.51","","90","","90","","120","","378.328","","","","","","","","","","","","","2","R -3 c :H","-R 3 2""c","167","","","","- In2 O3 -","- In2 O3 -","- In12 O18 -","6","0.166667","","Prewitt, C.T.; Rogers, D.B.; Shannon, R.D.; Sleight, W.W.","The C rare earth oxide-corundum transition and crystal chemistry of oxides having the corundum structure","Inorganic Chemistry","1969","8","","1985","1993","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343799","8.93","","5.921","","7.488","","90","","90","","90","","395.924","","","","","","","","","","","","","3","P n m a","-P 2ac 2n","62","","K Br O4","","- Br K O4 -","- Br K O4 -","- Br4 K4 O16 -","4","0.5","","Siegel, S.; Tani, B.S.; Appelman, E.","The crystal structure of potassium perbromate","Inorganic Chemistry","1969","8","","1190","1191","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343801","4.4493","","4.4493","","11.8037","","90","","90","","120","","202.363","","","","","","","","","","","","","2","R -3 c :H","-R 3 2""c","167","","","","- Al H3 -","- Al H3 -","- Al6 H18 -","6","0.166667","","Turley, J.W.; Rinn, H.W.","The crystal structure of aluminium hydride","Inorganic Chemistry","1969","8","","17","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343802","4.4309","","4.4309","","11.7744","","90","","90","","120","","200.195","","","","","","","","","","","","","2","R -3 c :H","-R 3 2""c","167","","","","- Al D3 -","- Al D3 -","- Al6 D18 -","6","0.166667","","Turley, J.W.; Rinn, H.W.","The crystal structure of aluminium hydride","Inorganic Chemistry","1969","8","","17","22","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4343805","12.16","","6.28","","19.34","","90","","91.2","","90","","1476.57","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","H Mn (C O)5","","- C5 H Mn O5 -","- C5 H Mn O5 -","- C40 H8 Mn8 O40 -","8","1","","la Placa, S.J.; Hamilton, W.C.; Davison, A.; Ibers, J.A.","Nature of the metal-hydrogen bond in transition metal-hydrogen complexes: Neutron and X-ray diffraction studies of beta pentacarbonylmanganese hydride","Inorganic Chemistry","1969","8","","1928","1935","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4343806","14.23","","20.26","","5.62","","90","","90","","90","","1620.24","","","","","","","","","","","","","2","P 1 2/c 1","-P 2yc","13","","","","- B10 D14 -","- B5 D7 -","- B40 D56 -","8","2","","Tippe, A.; Hamilton, W.C.","Neutron diffraction study of decaborane","Inorganic Chemistry","1969","8","","464","470","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344145","10.814","","16.706","","26.273","","90","","90","","90","","4746.45","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","Pb6 O (O H)6 (Cl O4)4 (H2 O)","","- Cl4 H8 O24 Pb6 -","- Cl4 O24 Pb6 -","- Cl32 O192 Pb48 -","8","1","","Spiro, G.T.; Zalkin, A.; Templeton, D.H.","The Crystal Structure of a Hexanuclear Basic Lead(II) Perchlorate Hydrate: Pb6 O (O H)6 (Cl O4)4 (H2 O)","Inorganic Chemistry","1969","8","","856","861","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344162","7.026","","12.098","","7.439","","90","","90","","90","","632.319","","","","","","","","","","","","","4","P b c n","-P 2n 2ab","60","","(N H4)2 Ce F6","","- Ce F6 H8 N2 -","- Ce F6 N2 -","- Ce4 F24 N8 -","4","0.5","","Ryan, R.R.; Kruse, F.H.; Larson, A.C.","Crystal Structure of Ammonium Hexafluorocerate(IV), (N H4)2 Ce F6","Inorganic Chemistry","1969","8","","33","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344191","7.19","","7.19","","16.662","","90","","90","","120","","745.96","","","","","","","","","","","","","3","P -6 2 c","P -6c -2c","190","","Rb3 (Mo2 Cl8)","","- Cl8 Mo2 Rb3 -","- Cl8.0001 Mo2 Rb3 -","- Cl16.0002 Mo4 Rb6 -","2","0.166667","","Bennett, M.J.; Brencic, J.V.; Cotton, F.A.","The preparation and structural characterization of trirubidium octachlorodimolybdenum. A binuclear structure with strong metal-metal bonding.","Inorganic Chemistry","1969","8","","1060","1065","","","","","","","","","","","","","","","","","","","","","","has coordinates","160793","2020-10-21","18:00:00",""
"4344195","8.005","","13.267","","8.059","","90","","90","","90","","855.885","","","","","","","","","","","","","5","P b a m","-P 2 2ab","55","","K4 Mo2 Cl8 (H2 O)2","","- Cl8 H4 K4 Mo2 O2 -","- Cl8 K4 Mo2 O2 -","- Cl16 K8 Mo4 O4 -","2","0.25","","Brencic, J.V.; Cotton, F.A.","The Octachlorodimolybdate(II) Ion. A New Species with a Quadruple Metal-Metal Bond","Inorganic Chemistry","1969","8","","7","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344197","13.27","","9.85","","6.84","","90","","90","","90","","894.053","","","","","","","","","","","","","4","P n m a","-P 2ac 2n","62","","K2 Os N Cl5","","- Cl5 K2 N Os -","- Cl5 K2 N Os -","- Cl20 K8 N4 Os4 -","4","0.5","","Bright, D.; Ibers, J.A.","Studies of Metal-Nitrogen Multiple Bonds. V. The Crystal Structure of Potassium Nitridopentachloroosmate(VI), K2 Os N Cl5","Inorganic Chemistry","1969","8","","709","716","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344211","8.451","","13.196","","17.304","","90","","103.9","","90","","1873.22","","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","((N H3)4 Co (N H2) (O2) Co (N H3)4) (N O3)4","","- Co2 H26 N13 O14 -","- Co2 H26 N13 O14 -","- Co8 H104 N52 O56 -","4","1","","Christoph, G.G.; Schaefer, W.P.; Marsh, R.E.","The Crystal Structure of mue-Amido-mue-superoxobis(tetraamminecobalt(III)) Tetranitrate ((N H3)4 Co (N H2) (O2) Co (N H3)4) (N O3)4","Inorganic Chemistry","1969","8","","291","297","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344318","8.225","","8.225","","8.225","","90","","90","","90","","556.426","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","Tm2.667 S4","","- S4 Tm2.667 -","- S4 Tm2.667 -","- S16 Tm10.668 -","4","0.0833333","","Eatough, N.L.; Webb, A.W.; Hall, H.T.","High-pressure Th3P4-type polymorphs of rare earth sesquichalcogenides","Inorganic Chemistry","1969","8","","2069","2071","","","","","","","","","","","","","","","","","","","","","","has coordinates","166177","2020-10-21","18:00:00",""
"4344319","8.306","","8.306","","8.306","","90","","90","","90","","573.028","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","Y2.667 S4","","- S4 Y2.667 -","- S4 Y2.667 -","- S16 Y10.668 -","4","0.0833333","","Eatough, N.L.; Hall, H.T.; Webb, A.W.","High-pressure Th3P4-type polymorphs of rare earth sesquichalcogenides","Inorganic Chemistry","1969","8","","2069","2071","","","","","","","","","","","","","","","","","","","","","","has coordinates","166180","2020-10-21","18:00:00",""
"4344320","8.224","","8.224","","8.224","","90","","90","","90","","556.223","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","Yb2.667 S4","","- S4 Yb2.667 -","- S4 Yb2.667 -","- S16 Yb10.668 -","4","0.0833333","","Eatough, N.L.; Webb, A.W.; Hall, H.T.","High-pressure Th3P4-type polymorphs of rare earth sesquichalcogenides","Inorganic Chemistry","1969","8","","2069","2071","","","","","","","","","","","","","","","","","","","","","","has coordinates","166183","2020-10-21","18:00:00",""
"4344321","8.265","","8.265","","8.265","","90","","90","","90","","564.584","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","","","- Ho2.667 S4 -","- Ho2.667 S4 -","- Ho10.668 S16 -","4","0.0833333","","Eatough, N.L.; Webb, A.W.; Hall, H.T.","Highpressure Th3P4-type polymorphs of rare earth sesquichalcogenides","Inorganic Chemistry","1969","8","","2069","2071","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344322","8.614","","8.614","","8.614","","90","","90","","90","","639.167","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","","","- Ho2.667 Se4 -","- Ho2.667 Se4 -","- Ho10.668 Se16 -","4","0.0833333","","Eatough, N.L.; Webb, A.W.; Hall, H.T.","Highpressure Th3P4-type polymorphs of rare earth sesquichalcogenides","Inorganic Chemistry","1969","8","","2069","2071","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344323","8.198","","8.198","","8.198","","90","","90","","90","","550.965","","","","","","","","","","","","","2","I -4 3 d","I -4bd 2c 3","220","","","","- Lu2.667 S4 -","- Lu2.667 S4 -","- Lu10.668 S16 -","4","0.0833333","","Eatough, N.L.; Webb, A.W.; Hall, H.T.","High-pressure Th3P4-type polymorphs of rare earth sesquichalcogenides","Inorganic Chemistry","1969","8","","2069","2071","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344329","12.318","","3.6491","","6.2821","","90","","118.36","","90","","248.487","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","","","- Ni Rh2 Se4 -","- Ni Rh2 Se4 -","- Ni2 Rh4 Se8 -","2","0.25","","Bouchard, R.J.","The crystal structure and transport properties of Ni Rh2 Se4","Inorganic Chemistry","1969","8","","850","856","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344516","9.24","","12.02","","17.74","","90","","90.01","","90","","1970.29","","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Rh4 (C O)12","","- C12 O12 Rh4 -","- C12 O12 Rh4 -","- C48 O48 Rh16 -","4","1","","Wei, C.H.","Structural analyses of tetracobalt dodecacarbonyl and tetrarhodium dodecacarbonyl. crystallographic treatments of a disordered structure and a twinned composite","Inorganic Chemistry","1969","8","","2384","2397","","","","","","","","","","","","","","","","","","","","","","has coordinates","173227","2020-10-21","18:00:00",""
"9009889","11.34","","20.096","","6.034","","90","","90","","90","","1375.08","","","","","","","","","","","","Synthetic","5","F d d 2","F 2 -2d","43","","","Pirssonite","- C2 H4 Ca Na2 O8 -","- C2 H4 Ca Na2 O8 -","- C16 H32 Ca8 Na16 O64 -","8","0.5","","Dickens, B.; Brown, W. E.","The crystal structures of CaNa2(CO3)2*5(H2O), synthetic gaylussite, and CaNa2(CO3)2*2(H2O), synthetic pirssonite","Inorganic Chemistry","1969","8","","2093","2103","10.1021/ic50080a012","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""
"9009890","14.361","","7.781","","11.209","","90","","127.84","","90","","989.154","","","","","","","","","","","","Synthetic","5","C 1 2/c 1","-C 2yc","15","","","Gaylussite","- C2 H10 Ca Na2 O11 -","- C2 H10 Ca Na2 O11 -","- C8 H40 Ca4 Na8 O44 -","4","0.5","","Dickens, B.; Brown, W. E.","The crystal structures of CaNa2(CO3)2*5(H2O), synthetic gaylussite, and CaNa2(CO3)2*2(H2O), synthetic pirssonite","Inorganic Chemistry","1969","8","","2093","2103","10.1021/ic50080a012","","","","","","","","","","","","","","","","","","","","","has coordinates","283850","2023-05-18","07:16:48",""