Search results

Result: there are 526193 entries in the selection

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format

We are unable to provide that many records as a single archive.
You can instead download the entire COD archive as a single .zip, .tgz or .txz archive.

Displaying all data in COD

First | Previous 500 | of 1053 | Next 500 | Last | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID	Links	Formula	Space group	Cell parameters	Cell volume	Bibliography
9012216	CIF	Al2.15 H12.92 O22.34 Rb2.11 Si6.85	C 1 2/m 1	17.686; 18.007; 7.403 90; 116.15; 90	2116.33	Yang, P.; Armbruster, T. Na, K, Rb and Cs exchange in heulandite single-crystals: X-ray structure refinements at 100 K Sample: T = 100 K Journal of Solid State Chemistry, 1996, 123, 140-149
9012217	CIF	Al4.34 Ca0.2 Cs4.16 H30 O42.35 Si13.66	C -1	17.76; 18.095; 7.428 89.91; 115.93; 90.18	2146.79	Yang, P.; Armbruster, T. Na, K, Rb and Cs exchange in heulandite single-crystals: X-ray structure refinements at 100 K Sample: T = 100 K Journal of Solid State Chemistry, 1996, 123, 140-149
9012218	CIF	H In2 K2 O10 P2	P 21 21 21	9.277; 9.339; 11.245 90; 90; 90	974.243	Hriljac, J. A.; Grey, C. P.; Cheetham, A. K.; VerNooy, P. D.; Torardi, C. C. Synthesis and structure of KIn(OH)PO4: Chains of hydroxide-bridged InO4(OH)2 octahedra Journal of Solid State Chemistry, 1996, 123, 243-248
9012219	CIF	Mg0.01 O5 V2	P m n 21	11.544; 4.383; 3.574 90; 90; 90	180.835	Shklover, V.; Haibach, T.; Ried, F.; Nesper, R.; Novak, P. Crystal structure of the product of Mg2+ insertion into V2O5 single crystals Sample: I Journal of Solid State Chemistry, 1996, 123, 317-323
9012220	CIF	O5 V2	P m n 21	11.544; 4.383; 3.571 90; 90; 90	180.683	Shklover, V.; Haibach, T.; Ried, F.; Nesper, R.; Novak, P. Crystal structure of the product of Mg2+ insertion into V2O5 single crystals Sample: IIa Journal of Solid State Chemistry, 1996, 123, 317-323
9012221	CIF	O5 V2	P m m n :2	11.544; 3.571; 4.383 90; 90; 90	180.683	Shklover, V.; Haibach, T.; Ried, F.; Nesper, R.; Novak, P. Crystal structure of the product of Mg2+ insertion into V2O5 single crystals Sample: IIb Journal of Solid State Chemistry, 1996, 123, 317-323
9012222	CIF	Mg Nb2 O6	P b c n	14.1875; 5.7001; 5.0331 90; 90; 90	407.028	Pagola, S.; Carbonio, R. E.; Alonso, J. A.; Fernandez-Diaz M T Crystal structure refinement of Mg Nb2 O6 columbite from neutron powder diffraction data and study of the ternary system MgO-Nb2O5-NbO, with evidence of formation of new reduced pseudobrookite Mg5-xNb4+xO15-d (1.14<x<1.60) phases Locality: synthetic Note: reported and calculated Biso(O2)'s do not match Journal of Solid State Chemistry, 1997, 134, 76-84
9012224	CIF	Cu0.999 S1.5 Sn0.501	I -4 2 m	5.413; 5.413; 10.824 90; 90; 90	317.149	Chen, X.; Wada, H.; Sato, A.; Mieno, M. Synthesis, electrical conductivity, and crystal structure of Cu4Sn7S16 and structure refinement of Cu2SnS3 Journal of Solid State Chemistry, 1998, 139, 144-151
9012225	CIF	Cu4 S16 Sn7	R -3 m :H	7.372; 7.372; 36.01 90; 90; 120	1694.82	Chen, X.; Wada, H.; Sato, A.; Mieno, M. Synthesis, electrical conductivity, and crystal structure of Cu4Sn7S16 and structure refinement of Cu2SnS3 Journal of Solid State Chemistry, 1998, 139, 144-151
9012226	CIF	Al0.06 Ca1.04 Fe0.19 H0.91 Mn0.07 Na0.01 O6.91 Sb1.64 Ti0.76	F d -3 m :2	10.277; 10.277; 10.277 90; 90; 90	1085.42	Rouse, R. C.; Dunn, P. J.; Peacor, D. R.; Wang, L. Structural studies of the natural antimonian pyrochlores I. Mixed valency, cation site splitting, and symmetry reduction in lewisite Sample: Fd-3m refinement Journal of Solid State Chemistry, 1998, 141, 562-569
9012227	CIF	Al0.06 Ca1.04 Fe0.19 H0.91 Mn0.07 Na0.01 O6.91 Sb1.64 Ti0.76	F -4 3 m	10.277; 10.277; 10.277 90; 90; 90	1085.42	Rouse, R. C.; Dunn, P. J.; Peacor, D. R.; Wang, L. Structural studies of the natural antimonian pyrochlores I. Mixed valency, cation site splitting, and symmetry reduction in lewisite Sample: F-43m refinement Journal of Solid State Chemistry, 1998, 141, 562-569
9012228	CIF	Al0.06 Ca1.04 Fe0.19 H0.91 Mn0.07 Na0.01 O6.91 Sb1.64 Ti0.76	F 2 3	10.277; 10.277; 10.277 90; 90; 90	1085.42	Rouse, R. C.; Dunn, P. J.; Peacor, D. R.; Wang, L. Structural studies of the natural antimonian pyrochlores I. Mixed valency, cation site splitting, and symmetry reduction in lewisite Sample: F23 refinement Journal of Solid State Chemistry, 1998, 141, 562-569
9012229	CIF	Cl Fe2 H3 O12 Te4	P -1	5.103; 6.653; 9.012 73.4; 78.03; 76.76	282.09	Feger, C. R.; Kolis, J. W.; Gorny, K.; Pennington, C. Rodalquilarite revisited: the hydrothermal synthesis and structural reinvestigation of H3Fe2(TeO3)4Cl Journal of Solid State Chemistry, 1999, 143, 254-259
9012244	CIF	Ga H4 N O8 P2 Zn	P 1 21/a 1	9.406; 9.881; 8.612 90; 90.58; 90	800.364	Logar, N. Z.; Mrak, M.; Kaucic, V. Syntheses and structures of two ammonium zinc gallophosphates: analcime and paracelsian analogs Sample: Paracelsian analog Journal of Solid State Chemistry, 2001, 156, 480-486
9012245	CIF	Ga H8 N2 O12 P3 Zn2	I 21 3	13.456; 13.456; 13.456 90; 90; 90	2436.4	Logar, N. Z.; Mrak, M.; Kaucic, V. Syntheses and structures of two ammonium zinc gallophosphates: analcime and paracelsian analogs Sample: analcime analog Note: changed O1(x,y) and O3(x,y,z) to match reported bond distances Journal of Solid State Chemistry, 2001, 156, 480-486
9012246	CIF	H6 In2 Na2 O17 P4	P -1	9.30131; 9.4976; 9.2685 98.71; 98.953; 60.228	699.418	Mi, J. X.; Huang, Y. X.; Mao, S. Y.; Huang, X. D.; Wei, Z. B.; Huang, Z. L.; Zhao, J. T. Hydrothermal synthesis and crystal structure of Na2In2[PO3(OH)]4*H2O with a new structure type Journal of Solid State Chemistry, 2001, 157, 213-219
9012247	CIF	Al H O2	C m c m	2.851; 12.12; 3.736 90; 90; 90	129.094	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 23 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012248	CIF	Al H O2	C m c m	2.8796; 12.205; 3.761 90; 90; 90	132.182	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 30 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012249	CIF	Al H O2	C m c m	2.8675; 12.274; 3.733 90; 90; 90	131.386	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 50 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012250	CIF	Al H O2	C m c m	2.8686; 12.265; 3.715 90; 90; 90	130.706	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 100 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012251	CIF	Al H O2	C m c m	2.8695; 12.232; 3.6945 90; 90; 90	129.676	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 140 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012252	CIF	Al H O2	C m c m	2.8681; 12.2256; 3.6941 90; 90; 90	129.531	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 180 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012253	CIF	Al H O2	C m c m	2.8678; 12.2188; 3.6941 90; 90; 90	129.445	Bokhimi, X.; Toledo-Antonio J A; Guzman-Castillo M L; Hernandez-Beltran F Relationship between crystallite size and bond lengths in boehmite Sample: preparation T = 240 C Journal of Solid State Chemistry, 2001, 159, 32-40
9012254	CIF	F7 In Mg Na2	P n m a	10.435; 7.345; 7.553 90; 90; 90	578.9	Caramanian, A.; Souron, J. P.; Gredin, P.; de Kozak, A. The crystal structure of the weberite Na2MgInF7 Journal of Solid State Chemistry, 2001, 159, 234-238
9012255	CIF	Ca Mn2 O4	P b c m	3.15886; 9.9958; 9.6776 90; 90; 90	305.573	Ling, C. D.; Neumeier, J. J.; Argyriou, D. N. Observation of antiferromagnetism in marokite CaMn2O4 Sample: T = 300 K Journal of Solid State Chemistry, 2001, 160, 167-173
9012256	CIF	Ca Mn2 O4	P b c m	3.14685; 9.9528; 9.67166 90; 90; 90	302.916	Ling, C. D.; Neumeier, J. J.; Argyriou, D. N. Observation of antiferromagnetism in marokite CaMn2O4 Sample: T = 20 K Journal of Solid State Chemistry, 2001, 160, 167-173
9012257	CIF	Ni P S	P 21 3	5.5386; 5.5386; 5.5386 90; 90; 90	169.903	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012258	CIF	As Ni S	P 21 3	5.6888; 5.6888; 5.6888 90; 90; 90	184.103	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012259	CIF	Ni S Sb	P 21 3	5.9341; 5.9341; 5.9341 90; 90; 90	208.961	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012260	CIF	As Ni Se	P 21 3	5.8469; 5.8469; 5.8469 90; 90; 90	199.884	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012261	CIF	Ni Sb Se	P 21 3	6.0868; 6.0868; 6.0868 90; 90; 90	225.511	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012262	CIF	As Pd S	P 21 3	5.9507; 5.9507; 5.9507 90; 90; 90	210.719	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012263	CIF	As Pd Se	P 21 3	6.0948; 6.0948; 6.0948 90; 90; 90	226.401	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012264	CIF	Pd Sb Se	P 21 3	6.324; 6.324; 6.324 90; 90; 90	252.916	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012265	CIF	Pd Sb Te	P 21 3	6.5362; 6.5362; 6.5362 90; 90; 90	279.239	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012266	CIF	Ni P1.86 Se0.14	P a -3	5.479; 5.479; 5.479 90; 90; 90	164.477	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012267	CIF	Ni P0.24 Se1.76	P a -3	5.901; 5.901; 5.901 90; 90; 90	205.483	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012268	CIF	Ni0.766 Sb0.5 Te0.5	P 63/m m c	3.9158; 3.9158; 5.2011 90; 90; 120	69.066	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012269	CIF	P Pd Se	P b c n	13.594; 5.8317; 5.8583 90; 90; 90	464.423	Foecker, A. J.; Jeitschko, W. The atomic order of the pnictogen and chalcogen atoms in equiatomic ternary compounds TPnCh (T = Ni, Pd; Pn = P, As, Sb; Ch = S, Se, Te) Journal of Solid State Chemistry, 2001, 162, 69-78
9012270	CIF	H13 N3 O8 S2	C 1 2/c 1	15.418; 5.905; 10.223 90; 102.806; 90	907.585	Friese, K.; Aroyo, M. I.; Schwalowsky, I.; Adiwidjaja, G.; Bismayer, U. The disordered high-temperature structure of (NH4)3H(SO4)2 and its relationship to the room-temperature phase Locality: synthetic Sample: T = 293 K Journal of Solid State Chemistry, 2002, 165, 136-147
9012271	CIF	H13 N3 O8 S2	R -3 m :H	5.9039; 5.9039; 22.536 90; 90; 120	680.276	Friese, K.; Aroyo, M. I.; Schwalowsky, I.; Adiwidjaja, G.; Bismayer, U. The disordered high-temperature structure of (NH4)3H(SO4)2 and its relationship to the room-temperature phase Locality: synthetic Sample: T = 420 K Note: high-temperature polymorph of letovicite Journal of Solid State Chemistry, 2002, 165, 136-147
9012272	CIF	H5 In N O5 P	P 43 21 2	9.416; 9.416; 11.159 90; 90; 90	989.369	Mao, S. Y.; Li, M. R.; Huang, Y. X.; Mi, J. X.; Chen, H. H.; Wei, Z. B.; Zhao, J. T. Hydrothermal synthesis and crystal structure of the first ammonium indium(III) phosphate NH4In(OH)PO4 with spiral chains of InO4(OH)2 Journal of Solid State Chemistry, 2002, 165, 209-213
9012273	CIF	Al H O2	C m c m	2.8656; 12.226; 3.6886 90; 90; 90	129.229	Bokhimi, X.; Sanchez-Valente J; Pedraza, F. Crystallization of sol-gel boehmite via hydrothermal annealing Sample: annealed t = 3 days, T = 473 K Journal of Solid State Chemistry, 2002, 166, 182-190
9012274	CIF	Al H O2	C m c m	2.86676; 12.223; 3.6907 90; 90; 90	129.324	Bokhimi, X.; Sanchez-Valente J; Pedraza, F. Crystallization of sol-gel boehmite via hydrothermal annealing Sample: annealed t = 7 days, T = 473 K Journal of Solid State Chemistry, 2002, 166, 182-190
9012275	CIF	Al H O2	C m c m	2.8668; 12.2189; 3.6922 90; 90; 90	129.335	Bokhimi, X.; Sanchez-Valente J; Pedraza, F. Crystallization of sol-gel boehmite via hydrothermal annealing Sample: annealed t = 15 days, T = 473 K Journal of Solid State Chemistry, 2002, 166, 182-190
9012276	CIF	H5 In N O5 P	P 43 21 2	9.4232; 9.4232; 11.1766 90; 90; 90	992.445	Filaretov, A. A.; Zhizhin, M. G.; Komissarova, L. N.; Danilov, V. P.; Chernyshev, V. V.; Lazoryak, B. I. Synthesis and structure of the new ammonium indium phosphate (NH4)In(OH)PO4 Journal of Solid State Chemistry, 2002, 166, 362-368
9012277	CIF	S Tl2	R 3 :H	12.15; 12.15; 18.19 90; 90; 120	2325.5	Giester, G.; Lengauer, C. L.; Tillmanns, E.; Zemann, J. Tl2S: Re-determination of crystal structure and stereochemical discussion Journal of Solid State Chemistry, 2002, 168, 322-330
9012278	CIF	S Tl2	R 3 :H	12.15; 12.15; 18.19 90; 90; 120	2325.5	Giester, G.; Lengauer, C. L.; Tillmanns, E.; Zemann, J. Tl2S: Re-determination of crystal structure and stereochemical discussion Sample: hypothetical idealized structure Journal of Solid State Chemistry, 2002, 168, 322-330
9012279	CIF	Al F6 Li Na2	P 1 21/n 1	5.2842; 5.3698; 7.5063 90; 89.98; 90	212.992	Ross, K. C.; Mitchell, R. H.; Chakhmouradian, A. R. The crystal structure of synthetic simmonsite, Na2LiAlF6 Journal of Solid State Chemistry, 2003, 172, 95-101
9012280	CIF	Al F6 Na3	P 1 21/n 1	5.4058; 5.5926; 7.7699 90; 90.195; 90	234.902	Ross, K. C.; Mitchell, R. H.; Chakhmouradian, A. R. The crystal structure of synthetic simmonsite, Na2LiAlF6 Journal of Solid State Chemistry, 2003, 172, 95-101
9012281	CIF	Al F6 Na3	P 1 21/n 1	5.4054; 5.5934; 7.7672 90; 89.81; 90	234.837	Ross, K. C.; Mitchell, R. H.; Chakhmouradian, A. R. The crystal structure of synthetic simmonsite, Na2LiAlF6 Journal of Solid State Chemistry, 2003, 172, 95-101
9012282	CIF	Ca3.906 Nd0.154 O14 Ta3.78 Zr0.16	P 31 2 1	7.356; 7.356; 18.116 90; 90; 120	848.939	Grey, I. E.; Mumme, W. G.; Ness, T. J.; Roth, R. S.; Smith, K. L. Structural relations between weberite and zirconolite polytypes - refinements of doped 3T and 4M Ca2Ta2O7 and 3T CaZrTi2O7 Sample: T = 123 K, 3T weberite-type structure Journal of Solid State Chemistry, 2003, 174, 285-295
9012283	CIF	Ca7.676 Nd0.324 O28 Ta7.705 Zr0.295	C 1 2 1	12.761; 7.358; 24.565 90; 100.17; 90	2270.3	Grey, I. E.; Mumme, W. G.; Ness, T. J.; Roth, R. S.; Smith, K. L. Structural relations between weberite and zirconolite polytypes - refinements of doped 3T and 4M Ca2Ta2O7 and 3T CaZrTi2O7 Sample: T = 295 K, 4M weberite-type structure Journal of Solid State Chemistry, 2003, 174, 285-295
9012284	CIF	Al F6 Na3	P 1 21/n 1	5.3956; 5.5821; 7.7568 90; 90.181; 90	233.624	Zhou, Q.; Kennedy, B. J. High-temperature powder synchrotron diffraction studies of synthetic cryolite Na3AlF6 Locality: synthetic Sample: T = room temperature Note: reported and calculated bond lengths disagree Journal of Solid State Chemistry, 2004, 177, 654-659
9012285	CIF	Al F6 Na3	F m -3 m	7.935; 7.935; 7.935 90; 90; 90	499.621	Zhou, Q.; Kennedy, B. J. High-temperature powder synchrotron diffraction studies of synthetic cryolite Na3AlF6 Locality: synthetic Sample: T = 600 C, ordered model Journal of Solid State Chemistry, 2004, 177, 654-659
9012286	CIF	Al F6 Na3	F m -3 m	7.935; 7.935; 7.935 90; 90; 90	499.621	Zhou, Q.; Kennedy, B. J. High-temperature powder synchrotron diffraction studies of synthetic cryolite Na3AlF6 Locality: synthetic Sample: T = 600 C, disordered model Journal of Solid State Chemistry, 2004, 177, 654-659
9012287	CIF	O4 Pb3	P -4 b 2	8.86; 8.86; 6.66 90; 90; 90	522.807	Gross, S. T. The crystal structure of Pb3O4 Journal of the American Chemical Society, 1943, 65, 1107-1110
9012288	CIF	B	P -4 n 2	8.73; 8.73; 5.03 90; 90; 90	383.351	Hoard, J. L.; Geller, S.; Hughes, R. E. On the structure of elementary boron Journal of the American Chemical Society, 1951, 73, 1892-1893
9012289	CIF	C	F d -3 m :1	3.56669; 3.56669; 3.56669 90; 90; 90	45.373	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646
9012290	CIF	C	F d -3 m :1	3.56672; 3.56672; 3.56672 90; 90; 90	45.374	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646
9012291	CIF	C	F d -3 m :1	3.56678; 3.56678; 3.56678 90; 90; 90	45.376	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646
9012292	CIF	C	F d -3 m :1	3.56684; 3.56684; 3.56684 90; 90; 90	45.379	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646
9012293	CIF	C	F d -3 m :1	3.5669; 3.5669; 3.5669 90; 90; 90	45.381	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: Diamond #1, lattice parameter is average of three runs Journal of the American Chemical Society, 1951, 73, 5643-5646
9012294	CIF	C	F d -3 m :1	3.5667; 3.5667; 3.5667 90; 90; 90	45.373	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012295	CIF	C	F d -3 m :1	3.56674; 3.56674; 3.56674 90; 90; 90	45.375	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012296	CIF	C	F d -3 m :1	3.56675; 3.56675; 3.56675 90; 90; 90	45.375	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012297	CIF	C	F d -3 m :1	3.56683; 3.56683; 3.56683 90; 90; 90	45.378	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012298	CIF	C	F d -3 m :1	3.56689; 3.56689; 3.56689 90; 90; 90	45.38	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: white boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012299	CIF	C	F d -3 m :1	3.5668; 3.5668; 3.5668 90; 90; 90	45.377	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 10 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012300	CIF	C	F d -3 m :1	3.5668; 3.5668; 3.5668 90; 90; 90	45.377	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012301	CIF	C	F d -3 m :1	3.56684; 3.56684; 3.56684 90; 90; 90	45.379	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 30 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012302	CIF	C	F d -3 m :1	3.56689; 3.56689; 3.56689 90; 90; 90	45.38	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 40 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012303	CIF	C	F d -3 m :1	3.567; 3.567; 3.567 90; 90; 90	45.385	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 50 C Note: grey boart Journal of the American Chemical Society, 1951, 73, 5643-5646
9012305	CIF	C	F d -3 m :1	3.56678; 3.56678; 3.56678 90; 90; 90	45.376	Straumanis, M. E.; Aka, E. Z. Precision determination of lattice parameter, coefficient of thermal expansion and atomic weight of carbon in diamond Locality: Belgian Congo Sample: at T = 20 C Note: Diamond #2 Journal of the American Chemical Society, 1951, 73, 5643-5646
9012309	CIF	B	P 42/n n m :1	8.74; 8.74; 5.068 90; 90; 90	387.132	Hoard, J. L.; Hughes, R. E.; Sands, D. E. The structure of tetragonal boron Sample: needle III Journal of the American Chemical Society, 1958, 80, 4507-4515
9012310	CIF	B	P 42/n n m :1	8.771; 8.771; 5.088 90; 90; 90	391.422	Hoard, J. L.; Hughes, R. E.; Sands, D. E. The structure of tetragonal boron Sample: plate Journal of the American Chemical Society, 1958, 80, 4507-4515
9012311	CIF	S6	R -3 :H	10.818; 10.818; 4.28 90; 90; 120	433.779	Donohue, J.; Caron, A.; Goldish, E. The crystal and molecular structure of S6 (sulfur-6) Locality: synthetic Journal of the American Chemical Society, 1961, 83, 3748-3751
9012312	CIF	As Cu0.5 H16 O10 U	P 42/n m c	7.1; 7.1; 17.7 90; 90; 90	892.257	Hanic, F. The crystal structure of meta-zeunerite Cu(UO2)2(AsO4)2*8H2O Czechoslovak Journal of Physics B, 1960, 10, 169-181
9012315	CIF	Bi F3	P -4 3 m	5.853; 5.853; 5.853 90; 90; 90	200.51	Hund, F.; Fricke, R. Der kristallbau von a-BiF3 Zeitschrift fur Anorganische und Allgemeine Chemie, 1949, 258, 198-204
9012316	CIF	H2 Ni O2	R -3 m :H	3.07; 3.07; 23.2 90; 90; 120	189.363	Glemser, O.; Einerhand, J. Die struktur hoherer nickelhydroxyde Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 261, 43-51
9012317	CIF	H2 Ni O2	R -3 m :R	7.93; 7.93; 7.93 22.32; 22.32; 22.32	63.077	Glemser, O.; Einerhand, J. Die struktur hoherer nickelhydroxyde Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 261, 43-51
9012318	CIF	H Ni O2	R -3 m :H	2.82; 2.82; 20.65 90; 90; 120	142.216	Glemser, O.; Einerhand, J. Die struktur hoherer nickelhydroxyde Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 261, 43-51
9012319	CIF	H Ni O2	R -3 m :R	7.07; 7.07; 7.07 23; 23; 23	47.352	Glemser, O.; Einerhand, J. Die struktur hoherer nickelhydroxyde Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 261, 43-51
9012321	CIF	In2 Mg S4	F d -3 m :1	10.687; 10.687; 10.687 90; 90; 90	1220.58	Hahn, H.; Klingler, W. Untersuchungen uber ternaere chalkogenide. I. Uber die kristallstruktur einiger ternarer sulfide, die sich vom In2S3 ableiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 263, 177-190
9012322	CIF	Ca In2 S4	F d -3 m :1	10.774; 10.774; 10.774 90; 90; 90	1250.64	Hahn, H.; Klingler, W. Untersuchungen uber ternare chalkogenide. I. Uber die kristallstruktur einiger ternaerer sulfide, die sich vom In2S3 ableiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 263, 177-190
9012323	CIF	Cd In2 S4	F d -3 m :1	10.797; 10.797; 10.797 90; 90; 90	1258.66	Hahn, H.; Klingler, W. Untersuchungen uber ternare chalkogenide. I. Uber die kristallstruktur einiger ternaerer sulfide, die sich vom In2S3 ableiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 263, 177-190
9012324	CIF	Hg In2 S4	F d -3 m :1	10.812; 10.812; 10.812 90; 90; 90	1263.92	Hahn, H.; Klingler, W. Untersuchungen uber ternaere chalkogenide. I. Uber die kristallstruktur einiger ternaerer sulfide, die sich vom In2S3 ableiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 263, 177-190
9012325	CIF	In2 Mn S4	F d -3 m :1	10.694; 10.694; 10.694 90; 90; 90	1222.98	Hahn, H.; Klingler, W. Untersuchungen uber ternare chalkogenide. I. Uber die kristallstruktur einiger ternaerer sulfide, die sich vom In2S3 ableiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 263, 177-190
9012326	CIF	Fe In2 S4	F d -3 m :1	10.598; 10.598; 10.598 90; 90; 90	1190.34	Hahn, H.; Klingler, W. Untersuchungen uber ternaere chalkogenide. I. Uber die kristallstruktur einiger ternaerer sulfide, die sich vom In2S3 ableiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1950, 263, 177-190
9012327	CIF	Bi2 O3	P -4 b 2	7.74; 7.74; 5.63 90; 90; 90	337.28	Gattow, G.; Schutze, D. Uber Wismutoxide. VI. Uber ein Wismut(III)-oxid mit hoherem sauerstoffgehalt (beta-modifikation) Note: transformed from C-42b Zeitschrift fur Anorganische und Allgemeine Chemie, 1964, 328, 44-68
9012328	CIF	Bi2 O3	C -4 2 b	10.95; 10.95; 5.63 90; 90; 90	675.051	Gattow, G.; Schutze, D. Uber Wismutoxide. VI. Uber ein Wismut(III)-oxid mit hoherem sauerstoffgehalt (beta-modifikation) Zeitschrift fur Anorganische und Allgemeine Chemie, 1964, 328, 44-68
9012329	CIF	Fe O4 V2	F d -3 m :1	8.453; 8.453; 8.453 90; 90; 90	603.994	Reuter, B.; Riedel, E.; Hug, P.; Arndt, D.; Geisler, U.; Behnke, J. Zur kristallchemie der vanadin(III)-spinelle Zeitschrift fur Anorganische und Allgemeine Chemie, 1969, 369, 306-312
9012330	CIF	Cd O4 V2	F d -3 m :1	8.695; 8.695; 8.695 90; 90; 90	657.368	Reuter, B.; Riedel, E.; Hug, P.; Arndt, D.; Geisler, U.; Behnke, J. Zur kristallchemie der vanadin(III)-spinelle Zeitschrift fur Anorganische und Allgemeine Chemie, 1969, 369, 306-312
9012331	CIF	O4 V2 Zn	F d -3 m :1	8.409; 8.409; 8.409 90; 90; 90	594.611	Reuter, B.; Riedel, E.; Hug, P.; Arndt, D.; Geisler, U.; Behnke, J. Zur kristallchemie der vanadin(III)-spinelle Zeitschrift fur Anorganische und Allgemeine Chemie, 1969, 369, 306-312
9012332	CIF	Al Ca F6 Li	P -3 1 c	4.996; 4.996; 9.636 90; 90; 120	208.292	Viebahn, W. Untersuchungen an quaternaren fluoriden LiMeIIMeIIIF6 die struktur von LiCaAlF6 Zeitschrift fur Anorganische und Allgemeine Chemie, 1971, 386, 335-339
9012333	CIF	S18	P 21 21 21	21.152; 11.441; 7.581 90; 90; 90	1834.6	Schmidt, V. M.; Wilhelm, E.; Debaerdemaeker, T.; Hellner, E.; Kutoglu, A. Darstellung und kristallstruktur von cyclooktadekaschwefel, S18, und cycloikosaschwefel, S20 Note: structure for S18 Zeitschrift fur Anorganische und Allgemeine Chemie, 1974, 405, 153-162
9012334	CIF	S20	P b c n	18.58; 13.181; 8.6 90; 90; 90	2106.17	Schmidt, V. M.; Wilhelm, E.; Debaerdemaeker, T.; Hellner, E.; Kutoglu, A. Darstellung und kristallstruktur von cyclooktadekaschwefel, S18, und cycloikosaschwefel, S20 Note: structure for S20 Zeitschrift fur Anorganische und Allgemeine Chemie, 1974, 405, 153-162
9012335	CIF	As S	P 1 21/n 1	11.193; 9.994; 7.153 90; 92.8; 90	799.2	Kutoglu, A. Darstellung und kristallstruktur einer neuen isomeren form von As4S4 Zeitschrift fur Anorganische und Allgemeine Chemie, 1976, 419, 176-184
9012336	CIF	As Co H3 O5	P -1	7.865; 15.699; 6.719 94.25; 96.89; 90.28	821.277	Zettler, F.; Riffel, H.; Hess, H.; Keller, P. Cobalthydrogenarsenat-monohydrat. Darstellung und kristallstruktur Zeitschrift fur Anorganische und Allgemeine Chemie, 1979, 454, 134-144
9012337	CIF	Al O4 V2	F d -3 m :1	8.192; 8.192; 8.192 90; 90; 90	549.756	Reuter, B.; Aust, R.; Colsmann, G.; Neuwald, C. Darstellung und eigenschaften vanadium(II)-haltiger und damit n-leitender vanadium(III)-spinelle Zeitschrift fur Anorganische und Allgemeine Chemie, 1983, 500, 188-198
9012338	CIF	Mg O4 V2	F d -3 m :1	8.42; 8.42; 8.42 90; 90; 90	596.948	Reuter, B.; Aust, R.; Colsmann, G.; Neuwald, C. Darstellung und eigenschaften vanadium(II)-haltiger und damit n-leitender vanadium(III)-spinelle Zeitschrift fur Anorganische und Allgemeine Chemie, 1983, 500, 188-198
9012339	CIF	H Na2 O4 P	P 1 21/m 1	5.451; 6.847; 5.473 90; 116.34; 90	183.061	Wiench, D. M.; Jansen, M. Kristallstruktur von wasserfreiem Na2HPO4 Zeitschrift fur Anorganische und Allgemeine Chemie, 1983, 501, 95-101
9012340	CIF	As2 Fe	P n n m	5.3001; 5.9838; 2.8821 90; 90; 90	91.405	Lutz, H. D.; Jung, M.; Waschenbach, G. Kristallstrukturen des lollingits FeAs2 und des pyrits RuTe2 Zeitschrift fur Anorganische und Allgemeine Chemie, 1987, 554, 87-91
9012341	CIF	Ru Te2	P a -3	6.391; 6.391; 6.391 90; 90; 90	261.04	Lutz, H. D.; Jung, M.; Waschenbach, G. Kristallstrukturen des lollingits FeAs2 und des pyrits RuTe2 Zeitschrift fur Anorganische und Allgemeine Chemie, 1987, 554, 87-91
9012342	CIF	Cl Hg2 O	C 1 2/c 1	11.953; 5.904; 9.466 90; 105.59; 90	643.444	Brodersen, K.; Gobel, G.; Liehr, G. Terlinguait Hg4O2Cl2 - ein mineral mit ungewohnlichen Hg3-baueinheiten Zeitschrift fur Anorganische und Allgemeine Chemie, 1989, 575, 145-153
9012343	CIF	As O5 Sb	P 21 21 21	9.1607; 8.7524; 4.9035 90; 90; 90	393.153	Jansen, M.; Begemann, B.; Geb, J. Mischkristallbildung in den systemen As2O5/SbAsO5 und As2O5/AsPO5 bestimmung der spontanen deformationen und verfeinerung der kristallstrukturen der ternaren randphasen Zeitschrift fur Anorganische und Allgemeine Chemie, 1992, 610, 139-144
9012344	CIF	As O5 P	P 21 21 21	8.417; 8.171; 4.536 90; 90; 90	311.965	Jansen, M.; Begemann, B.; Geb, J. Mischkristallbildung in den Systemen As2O5/SbAsO5 und As2O5/AsPO5: bestimmung der spontanen deformationen und verfeinerung der kristallstrukturen der ternaren randphasen Zeitschrift fur Anorganische und Allgemeine Chemie, 1992, 610, 139-144
9012345	CIF	Bi2 Pt	P a -3	6.7014; 6.7014; 6.7014 90; 90; 90	300.952	Brese, N. E.; von Schnering, H. G. Bonding trends in pyrites and a reinvestigation of the structures of PdAs2, PdSb2, PtSb2 and PtBi2 Zeitschrift fur Anorganische und Allgemeine Chemie, 1994, 620, 393-404
9012346	CIF	As2 Pd	P a -3	5.979; 5.979; 5.979 90; 90; 90	213.74	Brese, N. E.; von Schnering, H. G. Bonding trends in pyrites and a reinvestigation of the structures of PdAs2, PdSb2, PtSb2 and PtBi2 Zeitschrift fur Anorganische und Allgemeine Chemie, 1994, 620, 393-404
9012347	CIF	Pd Sb2	P a -3	6.464; 6.464; 6.464 90; 90; 90	270.087	Brese, N. E.; von Schnering, H. G. Bonding trends in pyrites and a reinvestigation of the structures of PdAs2, PdSb2, PtSb2 and PtBi2 Zeitschrift fur Anorganische und Allgemeine Chemie, 1994, 620, 393-404
9012348	CIF	Pt Sb2	P a -3	6.4423; 6.4423; 6.4423 90; 90; 90	267.376	Brese, N. E.; von Schnering, H. G. Bonding trends in pyrites and a reinvestigation of the structures of PdAs2, PdSb2, PtSb2 and PtBi2 Zeitschrift fur Anorganische und Allgemeine Chemie, 1994, 620, 393-404
9012349	CIF	F O10 Si3 Y3	P 1 21/n 1	7.3038; 11.1247; 10.3714 90; 97.235; 90	835.993	Schleid, T.; Muller-Bunz H Einkristalle von Y3F[Si3O10] im thalenit-typ Zeitschrift fur Anorganische und Allgemeine Chemie, 1998, 624, 1082-1084
9012350	CIF	Al3 D12 K0.875 O14.125 S2	R -3 m :H	6.943; 6.943; 17.227 90; 90; 120	719.175	Schukow, H.; Breitinger, D. K.; Zeiske, T.; Kubanek, F.; Mohr, J.; Schwab, R. G. Localization of hydrogen and content of oxonium cations in alunite via neutron diffraction Locality: synthetic Sample: T = 2 K Zeitschrift fur Anorganische und Allgemeine Chemie, 1999, 625, 1047-1050
9012352	CIF	Cl8 Cu5 H8 K2 O6	P 1 21/c 1	11.6424; 6.5639; 11.771 90; 91.09; 90	899.372	Kahlenberg, V. On the crystal structure of K2Cu5Cl8(OH)4*2H2O Zeitschrift fur Anorganische und Allgemeine Chemie, 2004, 630, 900-903
9012353	CIF	Be D2 O2	P 21 21 21	4.5356; 4.6317; 7.0379 90; 90; 90	147.849	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 245 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012354	CIF	Be D2 O2	P 21 21 21	4.526; 4.6318; 7.0192 90; 90; 90	147.147	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 50 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012355	CIF	Be D2 O2	P 21 21 21	4.5259; 4.6314; 7.0193 90; 90; 90	147.133	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 5 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012356	CIF	D2 O2 Zn	P 21 21 21	4.90855; 5.14641; 8.488 90; 90; 90	214.419	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 298 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012357	CIF	D2 O2 Zn	P 21 21 21	4.88877; 5.12854; 8.5029 90; 90; 90	213.187	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 120 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012358	CIF	D2 O2 Zn	P 21 21 21	4.88626; 5.12609; 8.5066 90; 90; 90	213.068	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 50 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012359	CIF	D2 O2 Zn	P 21 21 21	4.88564; 5.12565; 8.50702 90; 90; 90	213.033	Jacobs, H.; Niemann, A.; Kockelmann, W. Low temperature investigations of hydrogen bridge bonds in the hydroxides beta-Be(OH)2 and epsilon-Zn(OH)2 by Raman-spectroscopy as well as X-ray and neutron diffraction Locality: synthetic Sample: T = 5 K Zeitschrift fur Anorganische und Allgemeine Chemie, 2005, 631, 1247-1254
9012360	CIF	H10 Mn O9 S	P -1	6.36; 10.77; 6.16 80.3; 110.1; 106	379.62	Caminiti, R.; Marongiu, G.; Paschina, G. A comparative X-ray diffraction study of aqueous MnSO4 and crystals of MnSO4*5H2O Locality: synthetic Zeitschrift fur Naturforschung A, 1982, 37, 581-586
9012361	CIF	S6	R -3 :H	10.766; 10.766; 4.225 90; 90; 120	424.098	Steidel, J.; Pickardt, J.; Steudel, R. Redetermination of the crystal and molecular structure of cyclohexasulfur, S6 Zeitschrift fur Naturforschung B, 1978, 33, 1554-1555
9012362	CIF	S10	C 1 2/c 1	12.533; 10.275; 12.776 90; 37.98; 90	1012.46	Steudel, R.; Steidel, J.; Reinhardt, R. X-ray structural analyses of cyclodecasulfur (S10) and of a cyclohexasulfur-cyclodecasulfur molecular addition compound (S6*S10) Locality: synthetic Sample: at T = 163 K Zeitschrift fur Naturforschung B, 1983, 38, 1548-1556
9012363	CIF	S16	I 1 2/a 1	19.541; 9.431; 8.831 90; 105.11; 90	1571.21	Steudel, R.; Steidel, J.; Reinhardt, R. X-ray structural analyses of cyclodecasulfur (S10) and of a cyclohexasulfur-cyclodecasulfur molecular addition compound (S6*S10) Locality: synthetic Sample: at T = 163 K Note: structure pertaining to mix of S6 and S10 Zeitschrift fur Naturforschung B, 1983, 38, 1548-1556
9012366	CIF	Co D14 O11 S	P 1 21/c 1	14.048; 6.4941; 10.925 90; 105.232; 90	961.665	Kellersohn, T.; Delaplane, R. G.; Olovsson, I. Disorder of a trigonally planar coordinated water molecule in cobalt sulfate heptahydrate, CoSO4*7D2O Zeitschrift fur Naturforschung B, 1991, 46, 1635-1640
9012367	CIF	Al5 H30 K3 O44 P8	R -3 c :H	8.69; 8.69; 82.27 90; 90; 120	5380.36	Dick, S.; Zeiske, T. Francoanellit K3Al5(HPO4)6(PO4)2*12H2O: struktur und synthese durch topochemische entwasserung von taranakit Zeitschrift fur Naturforschung B, 1998, 53, 711-719
9012368	CIF	Cl Hg3 O4 P	P 21 3	8.2912; 8.2912; 8.2912 90; 90; 90	569.97	Weil, M. Preparation and crystal structures of (Hg3)(PO4)Cl, (Hg3)(AsO4)Cl and (Hg3)(AsO4)Br - mercury compounds with the triangular Hg4+3 cluster Zeitschrift fur Naturforschung B, 2001, 56, 753-758
9012369	CIF	As Cl Hg3 O4	P 21 3	8.3983; 8.3983; 8.3983 90; 90; 90	592.344	Weil, M. Preparation and crystal structures of (Hg3)(PO4)Cl, (Hg3)(AsO4)Cl and (Hg3)(AsO4)Br - mercury compounds with the triangular Hg4+3 cluster Zeitschrift fur Naturforschung B, 2001, 56, 753-758
9012370	CIF	As Br Hg3 O4	P 21 3	8.4611; 8.4611; 8.4611 90; 90; 90	605.732	Weil, M. Preparation and crystal structures of (Hg3)(PO4)Cl, (Hg3)(AsO4)Cl and (Hg3)(AsO4)Br - mercury compounds with the triangular Hg4+3 cluster Zeitschrift fur Naturforschung B, 2001, 56, 753-758
9012371	CIF	Cu4 H6 Mo2 O16 U	C 1 2/m 1	19.94; 6.116; 5.52 90; 104.18; 90	652.67	Pushcharovsky, D. Y.; Rastsvetaeva, R. K.; Sarp, H. Crystal structure of deloryite, Cu4(UO2)[Mo2O8](OH)6 Journal of Alloys and Compounds, 1996, 239, 23-26
9012372	CIF	Ca Mn2 O4	P b c m	3.1492; 9.98; 9.66 90; 90; 90	303.604	Zouari, S.; Ranno, L.; Cheikh-Rouhou A; Isnard, O.; Pernet, M.; Wolfers, P.; Strobel, P. New model for the magnetic structure of the marokite-type oxide CaMn2O4 Sample: T = 280 K Journal of Alloys and Compounds, 2003, 353, 5-11
9012373	CIF	Ca Mn2 O4	P b c a	6.2545; 9.8995; 9.627 90; 90; 90	596.069	Zouari, S.; Ranno, L.; Cheikh-Rouhou A; Isnard, O.; Pernet, M.; Wolfers, P.; Strobel, P. New model for the magnetic structure of the marokite-type oxide CaMn2O4 Note: reported bond lengths are inconsistent with reported structure Sample: T = 1.5 K Journal of Alloys and Compounds, 2003, 353, 5-11
9012374	CIF	In	I 4/m m m	4.5912; 4.5912; 4.9355 90; 90; 90	104.036	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: 99.9999% indium Journal of the Less-Common Metals, 1964, 7, 17-22
9012375	CIF	In	I 4/m m m	4.5899; 4.5899; 4.9379 90; 90; 90	104.028	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: 99.999% indium Journal of the Less-Common Metals, 1964, 7, 17-22
9012376	CIF	In	I 4/m m m	4.5902; 4.5902; 4.9379 90; 90; 90	104.041	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: 99.97% indium Journal of the Less-Common Metals, 1964, 7, 17-22
9012377	CIF	In	I 4/m m m	4.5903; 4.5903; 4.9357 90; 90; 90	103.999	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: .1 atomic % thallium Journal of the Less-Common Metals, 1964, 7, 17-22
9012378	CIF	In	I 4/m m m	4.5914; 4.5914; 4.9328 90; 90; 90	103.988	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: .2 atomic % cadmium Journal of the Less-Common Metals, 1964, 7, 17-22
9012379	CIF	In	I 4/m m m	4.5895; 4.5895; 4.9378 90; 90; 90	104.007	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: .2 atomic % tin Journal of the Less-Common Metals, 1964, 7, 17-22
9012380	CIF	In	I 4/m m m	4.5902; 4.5902; 4.939 90; 90; 90	104.064	Smith, J. F.; Schneider, V. L. Anisotropic thermal expansion of indium Sample: .2 atomic % lead Journal of the Less-Common Metals, 1964, 7, 17-22
9012381	CIF	As Pd2	C m c 21	3.245; 16.844; 6.576 90; 90; 90	359.436	Balz, U.; Schubert, K. Kristallstruktur von Pd2As(r) und Pd2Sb Journal of the Less-Common Metals, 1969, 19, 300-304
9012382	CIF	Pd5 Sb2	P 63 c m	7.606; 7.606; 13.863 90; 90; 120	694.545	El-Boragy M; Bhan, S.; Schubert, K. Die kristallstruktur von Pd5Sb2 und Ni5As2 und einigen varianten Journal of the Less-Common Metals, 1970, 22, 445-458
9012383	CIF	As2 Ni5	P 63 c m	6.825; 6.825; 12.513 90; 90; 120	504.774	El-Boragy M; Bhan, S.; Schubert, K. Die kristallstruktur von Pd5Sb2 und Ni5As2 und einigen varianten Journal of the Less-Common Metals, 1970, 22, 445-458
9012384	CIF	As2 Cu5	I b a m	5.977; 11.577; 5.491 90; 90; 90	379.954	Liebisch, W.; Schubert, K. Zur struktur der mischung kupfer-arsen Journal of the Less-Common Metals, 1971, 23, 231-236
9012385	CIF	Y	F m -3 m	5.83; 5.83; 5.83 90; 90; 90	198.155	Kaul, V. K.; Srivastava, O. N. A new fcc phase in yttrium films Journal of the Less-Common Metals, 1976, 44, 137-140
9012386	CIF	Pd20 Sb7	R -3 :H	11.734; 11.734; 11.021 90; 90; 120	1314.15	Wopersnow, W.; Schubert, K. Kristallstrukturen von Pd20Sb7 und Pd20Te7 Note: isotypic with keithconnite Journal of the Less-Common Metals, 1977, 51, 35-44
9012387	CIF	Pt5 Se4	P 1 21/c 1	6.577; 4.61; 11.122 90; 101.59; 90	330.343	Matkovic, P.; Schubert, K. Kristallstruktur von Pt5Se4 Journal of the Less-Common Metals, 1977, 55, 185-190
9012388	CIF	Pd9 Te4	P 1 21/c 1	7.458; 13.938; 8.839 90; 91.97; 90	918.267	Matkovic, P.; Schubert, K. Kristallstruktur von Pd9Te4 Journal of the Less-Common Metals, 1978, 58, P39-P46
9012389	CIF	Bi Pb Pd2	C c m 21	7.15; 8.681; 10.535 90; 90; 90	653.898	Mayer, H. W.; Bhatt, Y. C.; Schubert, K. Kristallstrukturen von Pd2PbBi und Pd4PbBi3 Journal of the Less-Common Metals, 1979, 66, 1-9
9012390	CIF	Bi Pb Pd2	C 1 m 1	7.171; 8.677; 5.575 90; 71.74; 90	329.424	Mayer, H. W.; Bhatt, Y. C.; Schubert, K. Kristallstrukturen von Pd2PbBi und Pd4PbBi3 Journal of the Less-Common Metals, 1979, 66, 1-9
9012391	CIF	As3.5 Rh6	P 63/m	9.297; 9.297; 3.657 90; 90; 120	273.742	Pivan, J. Y.; Guerin, R.; Sergent, M. Rh12As7, a host structure for rare earth elements: Crystal structures of Rh12As7 and Ho2Rh12As7 Locality: synthetic Note: x(RhII) corrected Journal of the Less-Common Metals, 1985, 107, 249-258
9012392	CIF	Cu2 S2 Tl	I 4/m m m	3.7771; 3.7771; 13.3791 90; 90; 90	190.873	Berger, R. Synthesis and characterization of the layered metal TlCu2S2 Journal of the Less-Common Metals, 1989, 147, 141-148
9012393	CIF	As3.5 Ho Rh6	P 63/m	9.892; 9.892; 3.859 90; 90; 120	327.019	Pivan, J. Y.; Guerin, R.; Sergent, M. Rh12As7, a host structure for rare earth elements: Crystal structures of Rh12As7 and Ho2Rh12As7 Journal of the Less-Common Metals, 1985, 107, 249-258
9012394	CIF	As3.5 Rh6	P 63/m	9.315; 9.315; 3.659 90; 90; 120	274.953	Lambert-Andron B; Dhahri, E.; Chaudouet, P.; Madar, R. Crystal structure of Rh12As7 Journal of the Less-Common Metals, 1985, 108, 353-358
9012395	CIF	Ca3 O12 Te2 Zn3	I a -3 d	12.632; 12.632; 12.632 90; 90; 90	2015.66	Jarosch, D.; Zemann, J. Yafsoanite: a garnet type calcium-tellurium(VI)-zinc oxide Mineralogy and Petrology, 1989, 40, 111-116
9012396	CIF	Be1.694 Ca1.9 Fe2.449 H2 K0.072 Mg2.551 Na0.1 O24 Pb0.928 Si6.306	P 1 2/a 1	9.915; 17.951; 5.243 90; 105.95; 90	897.246	Moore, P. B.; Davis, A. M.; Van Derveer, D. G.; Sen Gutpa, P. K. Joesmithite, a plumbous amphibole revisited and comments on bond valences Mineralogy and Petrology, 1993, 48, 97-113
9012398	CIF	Ca13 F10 H12 O34 Si10	R -3 :H	9.377; 9.377; 36.57 90; 90; 120	2784.73	Mikenda, W.; Pertlik, F.; Povondra, P.; Ulrych, J. On zeophyllite from Radejcin, Ceske stredohori Mts.: X-ray and IR-investigations Locality: Alter Berg, Radzein Note: z-coordinate of Si2 was changed from 0.70304 to 0.07304 to match reported bond lengths Mineralogy and Petrology, 1997, 61, 199-209
9012399	CIF	Cd Cu4 H14 O18 S2	P 1 21/m 1	5.543; 21.995; 6.079 90; 92.04; 90	740.672	Giester, G.; Rieck, B.; Brandstatter, F. Niedermayrite, Cu4Cd(SO4)2(OH)6*4H2O, a new mineral from the Lavrion Mining District, Greece Locality: Lavrion mining district, Attica peninsula, Greece Mineralogy and Petrology, 1998, 63, 19-34
9012400	CIF	Ba Ca0.3 Fe3.7 H3 O15 P3	P 1 21/m 1	9.2; 12.369; 5.003 90; 100.21; 90	560.3	Kolitsch, U.; Pring, A.; Tiekink, E. R. T. Johntomaite, a new member of the bjarebyite group of barium phosphates: description and structure refinement Locality: Spring Creek copper mine, southern Flinders Ranges, South Australia Mineralogy and Petrology, 2000, 70, 1-14
9012401	CIF	C H6 Mg O6	P 1 21/n 1	7.701; 5.365; 12.126 90; 90.41; 90	500.983	Giester, G.; Lengauer, C. L.; Rieck, B. The crystal structure of nesquehonite, MgCO3*3H2O, from Lavrion, Greece Mineralogy and Petrology, 2000, 70, 153-163
9012402	CIF	As4 Cu10 H22 O34 S	C 1 2/c 1	21.77; 12.327; 10.72 90; 92.85; 90	2873.25	Lengauer, C. L.; Giester, G.; Kirchner, E. Leogangite, Cu10(AsO4)4(SO4)(OH)6*8H2O, a new mineral from the Leogang mining district, Salzburg province, Austria Locality: Leogang polymetallic ore district, Salzburg province, Austria Mineralogy and Petrology, 2004, 81, 187-201
9012403	CIF	Bi Fe S4 Sb	P n a m	11.413; 14.164; 3.759 90; 90; 90	607.656	Bindi, L.; Menchetti, S. Garavellite, FeSbBiS4, from the Caspari mine, North Rhine-Westphalia, Germany: composition, physical properties and determination of the crystal structure Locality: Caspari mine, North Rhine-Westphalia, Germany Mineralogy and Petrology, 2005, 85, 131-139
9012404	CIF	Kr	P 63/m m c	4; 4; 6.53 90; 90; 120	90.482	Sonnenblick, Y.; Alexander, E.; Kalman, Z. H.; Steinberger, I. T. Hexagonal close packed krypton and xenon Sample: at T = 26 K Chemical Physics Letters, 1977, 52, 276-278
9012405	CIF	Xe	P 63/m m c	4.34; 4.34; 7.09 90; 90; 120	115.653	Sonnenblick, Y.; Alexander, E.; Kalman, Z. H.; Steinberger, I. T. Hexagonal close packed krypton and xenon Sample: at T = 26 K Chemical Physics Letters, 1977, 52, 276-278
9012406	CIF	Ru Se2	P a -3	5.935; 5.935; 5.935 90; 90; 90	209.056	Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163
9012407	CIF	Os Se2	P a -3	5.946; 5.946; 5.946 90; 90; 90	210.22	Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163
9012408	CIF	As2 Pt	P a -3	5.9665; 5.9665; 5.9665 90; 90; 90	212.402	Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163
9012409	CIF	As2 Pt	P a -3	5.968; 5.968; 5.968 90; 90; 90	212.562	Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163
9012410	CIF	As2 Ni	P b c a	5.77; 5.838; 11.419 90; 90; 90	384.652	Stassen, W. N.; Heyding, R. D. Crystal structures of RuSe2, OsSe2, PtAs2, and alpha-NiAs2 Canadian Journal of Chemistry, 1968, 46, 2159-2163
9012411	CIF	B F4 K	P b n m	7.032; 8.674; 5.496 90; 90; 90	335.232	Clark, M. J. R.; Lynton, H. Crystal structures of potassium, ammonium, rubidium and cesium tetrafluoroborates Locality: synthetic Canadian Journal of Chemistry, 1969, 47, 2579-2586
9012412	CIF	B F4 N	P b n m	7.278; 9.072; 5.678 90; 90; 90	374.896	Clark, M. J. R.; Lynton, H. Crystal structures of potassium, ammonium, rubidium and cesium tetrafluoroborates Canadian Journal of Chemistry, 1969, 47, 2579-2586
9012413	CIF	B F4 Rb	P b n m	7.296; 9.108; 5.636 90; 90; 90	374.523	Clark, M. J. R.; Lynton, H. Crystal structures of potassium, ammonium, rubidium and cesium tetrafluoroborates Canadian Journal of Chemistry, 1969, 47, 2579-2586
9012414	CIF	B Cs F4	P b n m	7.647; 9.675; 5.885 90; 90; 90	435.4	Clark, M. J. R.; Lynton, H. Crystal structures of potassium, ammonium, rubidium and cesium tetrafluoroborates Canadian Journal of Chemistry, 1969, 47, 2579-2586
9012415	CIF	Ca9 H Mg O28 P7	R 3 c :H	10.35; 10.35; 37.085 90; 90; 120	3440.41	Gopal, R.; Calvo, C.; Ito, J.; Sabine, W. K. Crystal structure of synthetic Mg-whitlockite, Ca18Mg2H2(PO4)14 Canadian Journal of Chemistry, 1974, 52, 1155-1164
9012416	CIF	Al2 Ca H8.606 O12.303 Si2	P 1 21/c 1	10.011; 10.614; 9.853 90; 93.11; 90	1045.41	Artioli, G.; Rinaldi, R.; Kvick, A.; Smith, J. V. Neutron diffraction structure refinement of the zeolite gismondine at 15 K Sample: T = 15 K Zeolites, 1986, 6, 361-366
9012417	CIF	Al2 Ca H8 O12 Si2	P 1 21 1	9.989; 10.616; 9.82 90; 92.57; 90	1040.3	Vezzalini, G.; Quartieri, S.; Alberti, A. Structural modifications induced by dehydration in the zeolite gismondine Locality: Montalto di Castro, Italy Sample: dehydration t = 1 hr Zeolites, 1993, 13, 34-42
9012418	CIF	Al2 Ca H4 O10 Si2	P 21 21 21	13.902; 8.892; 13.952 90; 90; 90	1724.7	Vezzalini, G.; Quartieri, S.; Alberti, A. Structural modifications induced by dehydration in the zeolite gismondine Locality: Montalto di Castro, Italy Sample: dehydration t = 24 hr Zeolites, 1993, 13, 34-42
9012419	CIF	Al2.808 Ca0.685 H44.28 Na0.444 O56.971 Si21.192	P n m a	20.201; 19.991; 13.469 90; 90; 90	5439.3	Vezzalini, G.; Quartieri, S.; Galli, E.; Alberti, A.; Cruciani, G.; Kvick, A. Crystal structure of the zeolite mutinaite, the natural analog of ZSM-5 Note: reported occupancies do not match reported chemistry Zeolites, 1997, 19, 323-325
9012420	CIF	Bi2 S Te2	R -3 m :R	10.31; 10.31; 10.31 24.17; 24.17; 24.17	161.469	Lange, P. W. Ein Vergleich zwischen Bi2Te3 und Bi2Te2S Naturwissenschaften, 1939, 27, 133-134
9012421	CIF	Ca0.3 Mg0.02 Mn0.56 O5 Te2 Zn0.12	P 42/n b c :2	8.82; 8.82; 13.04 90; 90; 90	1014.41	Walitzi, E. M. Die kristallstruktur von denningit, (Mn,Ca,Zn)Te2O5 Naturwissenschaften, 1964, 51, 334-335
9012422	CIF	O S2 Sb2	F -1	20.971; 8.16; 20.378 90; 101.5; 90	3417.15	Kupcik, V. Die kristallstruktur des kermesits, Sb2S2O Naturwissenschaften, 1967, 54, 114-114
9012423	CIF	As2 Ca2 H4 Mn O10	P 1 21/c 1	5.65; 12.8; 5.65 90; 80.5; 90	403.004	Dahlman, B. The crystal structures of krohnkite, CuNa2(SO4)2*2H2O and brandtite, MnCa2(AsO4)2*2H2O Locality: Harstigen mine, Sweden Arkiv for Mineralogi och Geologi, 1952, 1, 339-366
9012424	CIF	Cu H4 Na2 O10 S2	P 1 21/c 1	5.78; 12.58; 5.48 90; 71.5; 90	377.873	Dahlman, B. The crystal structures of krohnkite, CuNa2(SO4)2*2H2O and brandtite, MnCa2(AsO4)2*2H2O Locality: Chuquicamata, Chile Arkiv for Mineralogi och Geologi, 1952, 1, 339-366
9012425	CIF	Bi Cl O2 Pb	B m m b	5.627; 5.575; 12.425 90; 90; 90	389.779	Gillberg, M. Perite, a new oxyhalide mineral from Langban, Sweden Arkiv for Mineralogi och Geologi, 1960, 2, 565-570
9012427	CIF	Ni	F m -3 m	3.5168; 3.5168; 3.5168 90; 90; 90	43.495	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25C Note: latice parameter is average of four samples Journal of Chemical Physics, 1935, 3, 605-616
9012428	CIF	Al	F m -3 m	4.0413; 4.0413; 4.0413 90; 90; 90	66.003	Jette, E. R.; Foote, F. Precision determination of lattice constants Locality: synthetic Sample: at T = 25 C Note: lattice parameter is average of two samples Journal of Chemical Physics, 1935, 3, 605-616
9012430	CIF	Au	F m -3 m	4.0704; 4.0704; 4.0704 90; 90; 90	67.439	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of 1 sample Journal of Chemical Physics, 1935, 3, 605-616
9012431	CIF	Ag	F m -3 m	4.0778; 4.0778; 4.0778 90; 90; 90	67.808	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of 1 sample Journal of Chemical Physics, 1935, 3, 605-616
9012432	CIF	Mo	I m -3 m	3.141; 3.141; 3.141 90; 90; 90	30.989	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of two samples Journal of Chemical Physics, 1935, 3, 605-616
9012433	CIF	W	I m -3 m	3.1583; 3.1583; 3.1583 90; 90; 90	31.504	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: sample 1 Journal of Chemical Physics, 1935, 3, 605-616
9012434	CIF	Mg	P 63/m m c	3.203; 3.203; 5.2002 90; 90; 120	46.202	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of four samples Journal of Chemical Physics, 1935, 3, 605-616
9012435	CIF	Zn	P 63/m m c	2.6594; 2.6594; 4.9368 90; 90; 120	30.237	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of three samples Journal of Chemical Physics, 1935, 3, 605-616
9012436	CIF	Cd	P 63/m m c	2.9731; 2.9731; 5.6069 90; 90; 120	42.921	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of two samples Journal of Chemical Physics, 1935, 3, 605-616
9012437	CIF	Bi	P 63/m m c	4.5372; 4.5372; 11.8381 90; 90; 120	211.052	Jette, E. R.; Foote, F. Precision determination of lattice constants Sample: at T = 25 C Note: lattice parameter is average of three samples Journal of Chemical Physics, 1935, 3, 605-616
9012438	CIF	Cu Fe2 O4	F d -3 m :1	8.37; 8.37; 8.37 90; 90; 90	586.376	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012439	CIF	Cr2 Mg O4	F d -3 m :1	8.312; 8.312; 8.312 90; 90; 90	574.271	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012440	CIF	Cd Cr2 O4	F d -3 m :1	8.567; 8.567; 8.567 90; 90; 90	628.762	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012441	CIF	Fe2 O4 Zn	F d -3 m :1	8.416; 8.416; 8.416 90; 90; 90	596.097	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012442	CIF	Cu0.5 Fe2 O4 Zn0.5	F d -3 m :1	8.388; 8.388; 8.388 90; 90; 90	590.167	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012443	CIF	Cu0.4 Fe2 O4 Zn0.6	F d -3 m :1	8.402; 8.402; 8.402 90; 90; 90	593.127	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012444	CIF	O4 Ti Zn2	F d -3 m :1	8.445; 8.445; 8.445 90; 90; 90	602.281	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012445	CIF	Cr2 Ni O4	F d -3 m :1	8.299; 8.299; 8.299 90; 90; 90	571.58	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012446	CIF	Al Fe2 O4	F d -3 m :1	8.273; 8.273; 8.273 90; 90; 90	566.225	Verwey, E. J. W.; Heilmann, E. L. Physical properties and cation arrangement of oxides with spinel structures Journal of Chemical Physics, 1947, 15, 174-180
9012447	CIF	Li	I m -3 m	3.5107; 3.5107; 3.5107 90; 90; 90	43.269	Covington, E. J.; Montgomery, D. J. Sample: at T = 20 C Note: Li6 isotope Journal of Chemical Physics, 1957, 27, 1030-1032
9012448	CIF	Li	I m -3 m	3.5092; 3.5092; 3.5092 90; 90; 90	43.214	Covington, E. J.; Montgomery, D. J. Sample: at T = 20 C Note: Li7 isotope Journal of Chemical Physics, 1957, 27, 1030-1032
9012449	CIF	Xe	F m -3 m	6.1317; 6.1317; 6.1317 90; 90; 90	230.538	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Journal of Chemical Physics, 1962, 37, 3002-3006
9012450	CIF	Xe	F m -3 m	6.1318; 6.1318; 6.1318 90; 90; 90	230.549	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 5 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012451	CIF	Xe	F m -3 m	6.1325; 6.1325; 6.1325 90; 90; 90	230.628	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 10 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012452	CIF	Xe	F m -3 m	6.134; 6.134; 6.134 90; 90; 90	230.798	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 15 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012453	CIF	Xe	F m -3 m	6.1364; 6.1364; 6.1364 90; 90; 90	231.069	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 20 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012454	CIF	Xe	F m -3 m	6.1397; 6.1397; 6.1397 90; 90; 90	231.442	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 25 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012455	CIF	Xe	F m -3 m	6.1349; 6.1349; 6.1349 90; 90; 90	230.899	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 30 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012456	CIF	Xe	F m -3 m	6.1488; 6.1488; 6.1488 90; 90; 90	232.472	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 35 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012457	CIF	Xe	F m -3 m	6.1542; 6.1542; 6.1542 90; 90; 90	233.085	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 40 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012458	CIF	Xe	F m -3 m	6.1599; 6.1599; 6.1599 90; 90; 90	233.734	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 45 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012459	CIF	Xe	F m -3 m	6.166; 6.166; 6.166 90; 90; 90	234.429	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 50 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012460	CIF	Xe	F m -3 m	6.1727; 6.1727; 6.1727 90; 90; 90	235.194	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 55 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012461	CIF	Xe	F m -3 m	6.1796; 6.1796; 6.1796 90; 90; 90	235.983	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 60 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012462	CIF	Xe	F m -3 m	6.1869; 6.1869; 6.1869 90; 90; 90	236.82	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 65 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012463	CIF	Xe	F m -3 m	6.1945; 6.1945; 6.1945 90; 90; 90	237.694	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 70 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012464	CIF	Xe	F m -3 m	6.2023; 6.2023; 6.2023 90; 90; 90	238.593	Sears, D. R.; Klug, H. P. Density and expansivity of solid xenon Sample: at T = 75 K Journal of Chemical Physics, 1962, 37, 3002-3006
9012465	CIF	F	P m -3 n	6.67; 6.67; 6.67 90; 90; 90	296.741	Jordan, T. H.; Streib, W. E.; Lipscomb, W. N. Single-crystal X-ray diffraction study of beta-fluorine Note: T = 50 K Note: beta phase, stable between T = 45.55 K & 53.54 K Journal of Chemical Physics, 1964, 41, 760-764
9012466	CIF	Cl2 Fe H4 O2	C 1 2/m 1	7.355; 8.548; 3.637 90; 98.18; 90	226.334	Morosin, B.; Graeber, E. J. Crystal structures of manganese(II) and iron(II) chloride dihydrate Journal of Chemical Physics, 1965, 42, 898-901
9012467	CIF	Cl2 H4 Mn O2	C 1 2/m 1	7.409; 8.8; 3.691 90; 98.67; 90	237.9	Morosin, B.; Graeber, E. J. Crystal structures of manganese(II) and iron(II) chloride dihydrate Journal of Chemical Physics, 1965, 42, 898-901
9012468	CIF	C6.2 H46 O26	P m -3 n	12.03; 12.03; 12.03 90; 90; 90	1740.99	McMullan, R. K.; Jeffery, G. A. Polyhedral clathrate hydrates. IX. Structure of ethylene oxide hydrate Sample: T = -25 C, 6.4C2H4O*46H2O Journal of Chemical Physics, 1965, 42, 2725-2732
9012469	CIF	F6 N2 Si	P -3 m 1	5.784; 5.784; 4.796 90; 90; 120	138.953	Schlemper, E. O.; Hamilton, W. C. On the structure of trigonal ammonium fluorosilicate Journal of Chemical Physics, 1966, 45, 408-409
9012470	CIF	C	P 63/m m c	2.52; 2.52; 4.12 90; 90; 120	22.658	Bundy, F. P.; Kasper, J. S. Hexagonal diamond-a new form of carbon Journal of Chemical Physics, 1967, 46, 3437-3446
9012471	CIF	F2	C 1 2/m 1	5.5; 3.28; 10.01 90; 134.66; 90	128.445	Meyer, L.; Barrett, C. S.; Greer, S. C. Crystal structure of alpha-fluorine Sample: at T = 23 K Note: alpha phase, stable between T = 0 K & 45.6 K Journal of Chemical Physics, 1968, 49, 1902-1907
9012472	CIF	Cl2 H12 Ni O6	C 1 2/m 1	10.23; 7.05; 6.57 90; 122.17; 90	401.091	Kleinberg, R. Crystal structure of NiCl2*6H2O at room temperature and 4.2 K by neutron diffraction Sample: T = room temp, X-ray data Journal of Chemical Physics, 1969, 50, 4690-4696
9012473	CIF	Cl2 H12 Ni O6	C 1 2/m 1	10.24; 7.04; 6.58 90; 122.23; 90	401.259	Kleinberg, R. Crystal structure of NiCl2*6H2O at room temperature and 4.2 K by neutron diffraction Sample: T = room temp, neutron data Journal of Chemical Physics, 1969, 50, 4690-4696
9012474	CIF	Cl2 H12 Ni O6	C 1 2/m 1	10.2; 7.05; 6.5 90; 122.53; 90	394.082	Kleinberg, R. Crystal structure of NiCl2*6H2O at room temperature and 4.2 K by neutron diffraction Sample: T = 4.2 K, neutron data Journal of Chemical Physics, 1969, 50, 4690-4696
9012475	CIF	N2	P 42/m n m	3.957; 3.957; 5.109 90; 90; 90	79.996	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 20.5 K and P = .4068 GPa Note: gamma phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012476	CIF	N2	P 63/m m c	4.05; 4.05; 6.604 90; 90; 120	93.81	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 46 K Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012477	CIF	N2	P 63/m m c	3.967; 3.967; 6.496 90; 90; 120	88.532	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 46.5 K and P = .1484 GPa Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012478	CIF	N2	P 63/m m c	3.924; 3.924; 6.356 90; 90; 120	84.756	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 49 K and P = .2818 GPa Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012479	CIF	N2	P 63/m m c	3.861; 3.861; 6.265 90; 90; 120	80.882	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 49 K and P = .4180 GPa Note: beta phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012480	CIF	N	P 21 3	5.649; 5.649; 5.649 90; 90; 90	180.266	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 20 K Note: alpha phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012481	CIF	N	P 21 3	5.495; 5.495; 5.495 90; 90; 90	165.922	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 20 K and P = .2690 GPa Note: alpha phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012482	CIF	N	P 21 3	5.433; 5.433; 5.433 90; 90; 90	160.369	Schuch, A. F.; Mills, R. L. Crystal structures of the three modifications of nitrogen 14 and nitrogen 15 at high pressure Sample: at T = 19.6 K and P = .3835 GPa Note: alpha phase Journal of Chemical Physics, 1970, 52, 6000-6008
9012483	CIF	Ga	I 4/m m m	2.813; 2.813; 4.452 90; 90; 90	35.229	Bosio, L. Crystal structures of Ga(II) and Ga(III) Sample: at P = 2.8 GPa, T = 298 K Note: structure known as Ga(III) phase Journal of Chemical Physics, 1978, 68, 1221-1223
9012484	CIF	Ga	I -4 3 d	5.951; 5.951; 5.951 90; 90; 90	210.751	Bosio, L. Crystal structures of Ga(II) and Ga(III) Loclailty: synthetic Sample: at P = 2.6 GPa, T = 313 K Note: structure known as Ga(II) phase Journal of Chemical Physics, 1978, 68, 1221-1223
9012485	CIF	Ga	C m c m	2.9; 8.13; 3.17 90; 90; 90	74.739	Curien, H.; Rimsky, A.; Defrain, A. Structure atomique d'une phase cristalline du gallium, instable a la pression atmospherique Locality: synthetic Sample: at T = 256.85 K Bulletin de la Societe Francaise de Mineralogie et de Cristallographie, 1961, 84, 260-264
9012486	CIF	P	C m c e	3.3133; 10.473; 4.374 90; 90; 90	151.779	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012487	CIF	P	C m c e	3.3121; 10.408; 4.35 90; 90; 90	149.955	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = .41 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012488	CIF	P	C m c e	3.3105; 10.363; 4.335 90; 90; 90	148.72	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = .71 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012489	CIF	P	C m c e	3.3109; 10.319; 4.317 90; 90; 90	147.491	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.02 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012490	CIF	P	C m c e	3.3109; 10.209; 4.302 90; 90; 90	145.412	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.27 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012491	CIF	P	C m c e	3.3116; 10.26; 4.289 90; 90; 90	145.727	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.51 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012492	CIF	P	C m c e	3.3114; 10.233; 4.278 90; 90; 90	144.962	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.73 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012493	CIF	P	C m c e	3.3111; 10.215; 4.266 90; 90; 90	144.288	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 1.93 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012494	CIF	P	C m c e	3.3114; 10.189; 4.254 90; 90; 90	143.529	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.16 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012495	CIF	P	C m c e	3.3117; 10.158; 4.243 90; 90; 90	142.736	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.43 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012496	CIF	P	C m c e	3.312; 10.14; 4.229 90; 90; 90	142.025	Cartz, L.; Srinivasa, S. R.; Riedner, R. J.; Jorgensen, J. D.; Worlton, T. G. Effect of pressure on bonding in black phosphorus Locality: synthetic Sample: at P = 2.66 GPa Note: pressures calculated from the measured unit cell volume Journal of Chemical Physics, 1979, 71, 1718-1721
9012497	CIF	Ce O4 Si	I 41/a m d :2	6.9564; 6.9564; 6.1953 90; 90; 90	299.8	Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P. The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2 Powder Diffraction, 2000, 15, 234-238
9012498	CIF	Ca1.011 Ce3.989 O13 Si3	P 63/m	9.4343; 9.4343; 6.8885 90; 90; 120	530.976	Skakle, J. M. S.; Dickson, C. L.; Glasser, F. P. The crystal structures of CeSiO4 and Ca2Ce8(SiO4)6O2 Powder Diffraction, 2000, 15, 234-238
9012499	CIF	P	C m c e	3.3199; 10.3678; 4.3154 90; 90; 90	148.536	Crichton, W. A.; Mezouar, M.; Monaco, G.; Falconi, S. Phosphorus: new in situ powder data from large-volume apparatus Locality: synthetic Sample: at P = 1.2 GPa and T = 1100 K Powder Diffraction, 2003, 18, 155-158
9012500	CIF	Li3 O4 P	P m n 21	6.115; 5.2394; 4.8554 90; 90; 90	155.562	Keffer, C.; Mighell, A. D.; Mauer, F.; Swanson, H.; Block, S. The crystal structure of twinned low-temperature lithium phosphate Note: dimorphic with lithiophosphate Inorganic Chemistry, 1967, 6, 119-125
9012501	CIF	Se	P 31 2 1	4.3662; 4.3662; 4.9536 90; 90; 120	81.782	Cherin, P.; Unger, P. The crystal structure of trigonal selenium Inorganic Chemistry, 1967, 6, 1589-1591
9012502	CIF	As2 Ni	P a -3	5.77; 5.77; 5.77 90; 90; 90	192.1	Munson, R. A. The synthesis of iridium disulfide and nickel diarsenide having the pyrite structure Locality: synthetic Inorganic Chemistry, 1968, 7, 389-390
9012503	CIF	Ni P2	P a -3	5.4706; 5.4706; 5.4706 90; 90; 90	163.721	Donohue, P. C.; Bither, T. A.; Young, H. S. High-pressure synthesis of pyrite-type nickel diphosphide and nickel diarsenide Locality: synthetic Inorganic Chemistry, 1968, 7, 998-1001
9012504	CIF	C3 H16 La2 O17	P c c n	8.984; 9.58; 17 90; 90; 90	1463.13	Shinn, D. B.; Eick, H. A. The crystal structure of lanthanum carbonate octahydrate Inorganic Chemistry, 1968, 7, 1340-1345
9012505	CIF	Ca2 Fe3 H6 O17 P3	A 1 a 1	17.553; 19.354; 11.248 90; 95.84; 90	3801.35	Moore, P. B.; Araki, T. Mitridatite, Ca6(H2O)6[FeIII9O6(PO4)9]*3H2O. A noteworthy octahedral sheet structure Inorganic Chemistry, 1977, 16, 1096-1106
9012506	CIF	C14 Cl2 N2 Zn	C 1 2/c 1	9.115; 11.942; 14.428 90; 90.77; 90	1570.36	Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336
9012507	CIF	As Mg0.92 Mn4.08 O12 Sb Si	A 1 2/a 1	10.048; 19.418; 9.735 90; 95.83; 90	1889.59	Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336
9012508	CIF	C6 Cd N5 S2	P -1	12.46; 9.07; 7.52 121.8; 123.4; 83.9	582.41	Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336
9012509	CIF	C3 H6 Ca O6	C 1 2/m 1	13.955; 6.855; 6.835 90; 106.28; 90	627.629	Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336
9012510	CIF	H Mo Na O5 Zn	P n a m	7.85; 9.292; 6.148 90; 90; 90	448.449	Marsh, R. E.; Schomaker, V. Some incorrect space groups in Inorganic Chemistry, Volume 16 Inorganic Chemistry, 1979, 18, 2331-2336
9012511	CIF	C4 H4 Cu Na2 O10	P -1	7.536; 9.473; 3.576 81.9; 103.77; 108.09	235.071	Gleizes, A.; Maury, F.; Galy, J. Crystal structure and magnetism of solum bis(oxalato)cuprate(II) dihydrate, Na2Cu(C2O4)2*2H2O. A deductive proposal for the structure of copper oxalate, CuC2O4*xH2O (0 < x < 1) Inorganic Chemistry, 1980, 19, 2074-2078
9012512	CIF	Fe O4 P	P 31 2 1	5.036; 5.036; 11.255 90; 90; 120	247.199	Long, G. J.; Cheetham, A. K.; Battle, P. D. Study of the iron-phosphorus-oxygen system by Mossbauer effect, neutron diffraction, magnetic susceptibility, and analytical electron microscopy: some pitfalls and solutions in the analysis of a complex mixture Inorganic Chemistry, 1983, 22, 3012-3016
9012513	CIF	Fe5 H6 O20 P4	C 1 2/c 1	17.492; 9.038; 9.349 90; 96.23; 90	1469.28	Corbin, D. R.; Whitney, J. F.; Fultz, W. C.; Stucky, G. D.; Eddy, M. M.; Cheetham, A. K. Synthesis of open-framework transition-metal phosphates using organometallic precursors in acidic media. Preparation and structural characterization of Fe5P4O20H10 and NaFe3P3O12 Note: structure from ICSD Inorganic Chemistry, 1986, 25, 2279-2280
9012514	CIF	Fe3 Na O12 P3	C 1 2/c 1	11.998; 12.328; 6.5 90; 114.185; 90	877.037	Corbin, D. R.; Whitney, J. F.; Fultz, W. C.; Stucky, G. D.; Eddy, M. M.; Cheetham, A. K. Synthesis of open-framework transition-metal phosphates using organometallic precursors in acidic media. Preparation and structural characterization of Fe5P4O20H10 and NaFe3P3O12 Note: structure from ICSD Inorganic Chemistry, 1986, 25, 2279-2280
9012515	CIF	H2 Mn O5 P	C 1 2/c 1	6.912; 7.47; 7.357 90; 112.3; 90	351.451	Lightfoot, P.; Cheetham, A. K.; Sleight, A. W. Structure of MnPO4*H2O by synchrotron X-ray powder diffraction Inorganic Chemistry, 1987, 26, 3544-3547
9012516	CIF	O2 Sb	P n a 21	5.434; 4.8091; 11.779 90; 90; 90	307.816	Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C Diantimony tetraoxides revisited Note: displacement parameters from ICSD Inorganic Chemistry, 1988, 27, 1367-1370
9012517	CIF	O2 Sb	C 1 2/c 1	12.057; 4.8352; 5.384 90; 104.56; 90	303.796	Amador, J.; Gutierrez-Puebla E; Monge, M. A.; Rasines, I.; Ruiz-Valero C Diantimony tetraoxides revisited Note: displacement parameters from ICSD Inorganic Chemistry, 1988, 27, 1367-1370
9012518	CIF	Co O14 P2 V2	I 4/m m m	6.264; 6.264; 13.428 90; 90; 90	526.884	Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748
9012519	CIF	Ca H8 O14 P2 V2	P 1	6.3484; 6.35; 6.597 106.81; 94.09; 90.02	253.867	Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748
9012520	CIF	H8 O14 P2 Sr V2	C 1 c 1	9.026; 9.01; 12.841 90; 100.19; 90	1027.81	Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748
9012521	CIF	H6 O14 P2 Pb V2	C 1 c 1	9.03; 9.021; 12.874 90; 100.16; 90	1032.27	Kang, H. Y.; Lee, W. C.; Wang, S. L. Hydrothermal synthesis and structural characterization of four layered vanadyl(IV) phosphate hydrates A(VO)2(PO4)2*4H2O (A=Co,Ca,Sr,Pb) Inorganic Chemistry, 1992, 31, 4743-4748
9012522	CIF	As Be2 H9 O9	P 1 21/a 1	7.2349; 12.686; 8.6548 90; 98.439; 90	785.754	Harrison, W. T. A.; Nenoff, T. M.; Gier, T. E.; Stucky, G. D. Tetrahedral-atom 3-ring groupings in 1-dimensional inorganic chains: Be2AsO4OH*4H2O and Na2ZnPO4OH*7H2O Inorganic Chemistry, 1993, 32, 2437-2441
9012523	CIF	H15 Na2 O12 P Zn	P 1 21/a 1	6.4212; 21.612; 8.6813 90; 109.899; 90	1132.82	Harrison, W. T. A.; Nenoff, T. M.; Gier, T. E.; Stucky, G. D. Tetrahedral-atom 3-ring groupings in 1-dimensional inorganic chains: Be2AsO4OH*4H2O and Na2ZnPO4OH*7H2O Inorganic Chemistry, 1993, 32, 2437-2441
9012524	CIF	D6 Mn N O5 P	P m n 21	5.7173; 8.8312; 4.8774 90; 90; 90	246.263	Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 1.6 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927
9012525	CIF	D6 Mn N O5 P	P m n 21	5.7142; 8.8255; 4.8762 90; 90; 90	245.91	Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 21.4 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927
9012526	CIF	D6 Mn N O5 P	P m n 21	5.7302; 8.8191; 4.9087 90; 90; 90	248.062	Carling, S. G.; Day, P.; Visser, D. Crystal and magnetic structures of layer transition metal phosphate hydrates Locality: synthetic Sample: T = 295 K Note: atomic positions from ICSD Inorganic Chemistry, 1995, 34, 3917-3927
9012527	CIF	Ba H8 O14 P2 V2	P 1 n 1	6.386; 12.7796; 6.387 90; 90.172; 90	521.244	Roca, M.; Marcos, M. D.; Amoros, P.; Alamo, J.; Beltran-Porter A; Beltran-Porter D Synthesis and crystal structure of a novel lamellar barium derivative: Ba(VOPO4)2*4H2O. Synthetic pathways for layered oxovanadium phosphate hydrates M(VOPO4)2*nH2O Inorganic Chemistry, 1997, 36, 3414-3421
9012528	CIF	H2 In O5 P	P -1	5.4342; 5.5508; 6.5446 97.593; 94.558; 107.565	185.064	Tang, X. J.; Lachgar, A. The missing link: synthesis, crystal structure, and thermogravimetric studies of InPO4*H2O Inorganic Chemistry, 1998, 37, 6181-6185
9012529	CIF	Ca2 H4 In O13 P3	C 1 2/c 1	7.573; 15.838; 9.3126 90; 113.55; 90	1023.93	X. Tang; A. Jones; A. Lachgar; B. J. Gross; J. L. Yarger Synthesis, crystal structure, NMR studies, and thermal stability of mixed iron-indium phosphates with quasi-one-dimensional frameworks Inorganic Chemistry, 1999, 38, 6032-6038
9012530	CIF	Hg O	P n m a	6.6129; 5.5208; 3.5219 90; 90; 90	128.579	Aurivillius, K. Least-squares refinement of the crystal structures of orthorhombic HgO and of Hg2O2NaI Locality: synthetic Acta Chemica Scandinavica, 1964, 18, 1305-1306
9012531	CIF	Hg2 I Na O2	P 62 2 2	6.667; 6.667; 10.054 90; 90; 120	387.017	Aurivillius, K. Least-squares refinement of the crystal structures of orthorhombic HgO and of Hg2O2NaI Locality: synthetic Acta Chemica Scandinavica, 1964, 18, 1305-1306
9012532	CIF	N2 O Si2	C m c 21	8.843; 5.473; 4.835 90; 90; 90	234.003	Idrestedt, I.; Brosset, C. Structure of Si2N2O Acta Chemica Scandinavica, 1964, 18, 1879-1886
9012533	CIF	C4.98 Cr K3 N6 O1.02	P n c 2	13.38; 10.37; 8.38 90; 90; 90	1162.73	Vannerberg, N. G. The crystal structure of K3Cr(CN)5NO Acta Chemica Scandinavica, 1966, 20, 1571-1576
9012534	CIF	Mg3 O8 P2	P 1 21/n 1	7.5957; 8.2305; 5.0775 90; 94.05; 90	316.634	Nord, A. G.; Kierkegaard, P. The crystal structure of Mg3(PO4)2 Acta Chemica Scandinavica, 1968, 22, 1466-1474
9012535	CIF	Cu7 Hg6	R 3 m :R	9.4024; 9.4024; 9.4024 90.425; 90.425; 90.425	831.151	Lindahl, T.; Westman, S. The structure of the rhombohedral gamma brass like phase in the copper-mercury system Locality: synthetic Acta Chemica Scandinavica, 1969, 23, 1181-1190
9012536	CIF	Co Se2	P a -3	5.8593; 5.8593; 5.8593 90; 90; 90	201.158	Furuseth, S.; Kjekshus, A.; Andresen, A. F. On the magnetic properties of CoSe2, NiS2, and NiSe2 Acta Chemica Scandinavica, 1969, 23, 2325-2334
9012537	CIF	Ni Se2	P a -3	5.9629; 5.9629; 5.9629 90; 90; 90	212.018	Furuseth, S.; Kjekshus, A.; Andresen, A. F. On the magnetic properties of CoSe2, NiS2, and NiSe2 Acta Chemica Scandinavica, 1969, 23, 2325-2334
9012538	CIF	Ni S2	P a -3	5.6873; 5.6873; 5.6873 90; 90; 90	183.958	Furuseth, S.; Kjekshus, A.; Andresen, A. F. On the magnetic properties of CoSe2, NiS2, and NiSe2 Acta Chemica Scandinavica, 1969, 23, 2325-2334
9012539	CIF	Fe Sb2	P n n m	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray diffractometer with strip charts Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012540	CIF	Fe Sb2	P n n 2	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray diffractometer with strip charts Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012541	CIF	Fe Sb2	P n n m	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray counted by step-scanning Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012542	CIF	Fe Sb2	P n n 2	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder X-ray counted by step-scanning Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012543	CIF	Fe Sb2	P n n m	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Powder neutron counted by step-scanning Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012544	CIF	Fe Sb2	P n n m	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Single crystal X-ray from integrated Weissenberg film Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012545	CIF	Fe Sb2	P n n 2	5.8328; 6.5376; 3.1973 90; 90; 90	121.921	Holseth, H.; Kjekshus, A. Compounds with the marcasite type crystal structure IV. The crystal structure of FeSb2 Note: Single crystal X-ray from integrated Weissenberg film Acta Chemica Scandinavica, 1969, 23, 3043-3050
9012546	CIF	Bi2 O3	P 1 21/c 1	5.8486; 8.1661; 7.5097 90; 113; 90	330.153	Malmros, G. The crystal structure of alpha-Bi2O3 Acta Chemica Scandinavica, 1970, 24, 384-396
9012547	CIF	H3 Na O5 S	C 1 c 1	7.799; 7.79; 8.23 90; 119.95; 90	433.237	Grimvall, S. The crystal structure of NaHSO4H2O Acta Chemica Scandinavica, 1971, 25, 3213-3219
9012548	CIF	C H Nd O4	P -6	12.32; 12.32; 9.88 90; 90; 120	1298.7	Christensen, N. Hydrothermal preparation of rare earth hydroxycarbonates. The crystal structure of NdOHCO3 Acta Chemica Scandinavica, 1973, 27, 2973-2982
9012550	CIF	As2 Fe	P n n m	5.3012; 5.9858; 2.8822 90; 90; 90	91.458	Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012551	CIF	Fe Se2	P n n m	4.8002; 5.7823; 3.5834 90; 90; 90	99.462	Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012552	CIF	As2 Ni	P n n m	4.7582; 5.7949; 3.544 90; 90; 90	97.72	Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012553	CIF	Ni Sb2	P n n m	5.1823; 6.3168; 3.8403 90; 90; 90	125.714	Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012554	CIF	Cu Se2	P n n m	5.0226; 6.1957; 3.7468 90; 90; 90	116.595	Kjekshus, A.; Rakke, T.; Andresen, A. Compounds of the marcasite type crystal structure. IX. Structural data for FeAs2, FeSe2, NiAs2, NiSb2, and CuSe2 Acta Chemica Scandinavica A, 1974, 28, 996-1000
9012563	CIF	H3.78 Na O4.89 V	P 1 21/a 1	16.756; 3.6391; 8.023 90; 111.18; 90	456.17	Bjornberg, A.; Hedman, B. The crystal structure of NaVO3*1.89H2O Note: one of the H atoms could not be found Acta Chemica Scandinavica A, 1977, 31, 579-584
9012564	CIF	C Ti	F m -3 m	4.328; 4.328; 4.328 90; 90; 90	81.07	Christensen, A. N. The temperature factor parameters of some transition metal carbides and nitrides by single crystal X-ray and neutron diffraction Acta Chemica Scandinavica A, 1978, 32, 89-90
9012565	CIF	As2 Cr0.79 Fe0.21	P n n m	5.4174; 6.2433; 2.9803 90; 90; 90	100.801	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012566	CIF	As2 Fe0.63 Ni0.37	P n n m	5.3971; 6.1893; 2.9539 90; 90; 90	98.673	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012567	CIF	As2 Cr0.47 Fe0.53	P n n m	5.3771; 6.1368; 2.9309 90; 90; 90	96.714	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.53Cr.47As2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012568	CIF	As2 Cr0.32 Fe0.68	P n n m	5.3544; 6.0853; 2.9112 90; 90; 90	94.856	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.68Cr.32As2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012569	CIF	As2 Fe	P n n m	5.3013; 5.9859; 2.8822 90; 90; 90	91.461	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: FeAs2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012570	CIF	As2 Fe0.75 Ni0.25	P n n m	5.2309; 5.9555; 2.9693 90; 90; 90	92.501	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.75Ni.25As2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012571	CIF	As2 Fe0.5 Ni0.5	P n n m	5.1377; 5.9205; 3.1077 90; 90; 90	94.529	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.5Ni.5As2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012572	CIF	As2 Ni	P n n m	4.7583; 5.7954; 3.5449 90; 90; 90	97.755	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: NiAs2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012573	CIF	Cr Sb2	P n n m	6.0275; 6.8738; 3.2715 90; 90; 90	135.544	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012574	CIF	Cr0.93 Fe0.07 Sb2	P n n m	6.0205; 6.8491; 3.2628 90; 90; 90	134.542	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012575	CIF	Cr0.88 Fe0.12 Sb2	P n n m	6.0156; 6.8341; 3.2569 90; 90; 90	133.895	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012576	CIF	Cr0.72 Fe0.28 Sb2	P n n m	5.9862; 6.781; 3.237 90; 90; 90	131.398	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012577	CIF	Cr0.6 Fe0.4 Sb2	P n n m	5.9632; 6.7391; 3.2233 90; 90; 90	129.533	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012578	CIF	Cr0.45 Fe0.55 Sb2	P n n m	5.9378; 6.886; 3.2147 90; 90; 90	131.442	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.55Cr.45Sb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012579	CIF	Cr0.21 Fe0.79 Sb2	P n n m	5.8833; 6.6072; 3.2004 90; 90; 90	124.406	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.79Cr.21Sb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012580	CIF	Fe Sb2	P n n m	5.8328; 6.7356; 3.1973 90; 90; 90	125.614	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: FeSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012581	CIF	Fe0.75 Ni0.25 Sb2	P n n m	5.7535; 6.4928; 3.2681 90; 90; 90	122.084	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.75Ni.25Sb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012582	CIF	Fe0.5 Ni0.5 Sb2	P n n m	5.6417; 6.4402; 3.3855 90; 90; 90	123.008	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: Fe.5Ni.5Sb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012583	CIF	Ni Sb2	P n n m	5.1837; 6.3184; 3.4808 90; 90; 90	114.006	Kjekshus, A.; Peterzens, P. G.; Rakke, T.; Andresen, A. F. Compounds with the marcasite type crystal structure. XIII. Structural and magnetic properties of CrtFe1-tAs2, CrtFe1-tSb2, Fe1-tNitAs2 and Fe1-tNitSb2 Sample: NiSb2 Acta Chemica Scandinavica A, 1979, 33, 469-480
9012584	CIF	As Co0.9 Ni0.1	P n m a	5.16; 3.54; 5.87 90; 90; 90	107.224	Fjellvag, H.; Selte, K.; Stave, F. E. On the structural and magnetic properties of Co1-tNitAs and CoAs1-xSbx Acta Chemica Scandinavica A, 1984, 38, 687-691
9012585	CIF	As0.95 Co Sb0.05	P n m a	5.16; 3.54; 5.87 90; 90; 90	107.224	Fjellvag, H.; Selte, K.; Stave, F. E. On the structural and magnetic properties of Co1-tNitAs and CoAs1-xSbx Acta Chemica Scandinavica A, 1984, 38, 687-691
9012586	CIF	Al0.66 B4 Fe1.475 Mg9.314 O20 Sb0.482 Ti0.069	P b a m	18.525; 12.272; 3.0218 90; 90; 90	686.972	Alfredsson, V.; Bovin, J. O.; Norrestam, R.; Terasaki, O. The structure of the mineral chestermanite, Mg2.25Al0.16Fe0.43Ti0.02Sb0.13O2BO3. A combined single-crystal X-ray and HREM study Acta Chemica Scandinavica, 1991, 45, 797-804
9012587	CIF	Ca O6 Ta2	P n m a	11.068; 7.505; 5.378 90; 90; 90	446.725	Jahnberg, L. Crystal structure of orthorhombic CaTa2O6 Acta Chemica Scandinavica, 1963, 17, 2548-2559
9012588	CIF	C	F d -3 m :1	3.5667; 3.5667; 3.5667 90; 90; 90	45.373	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: cubic, 3C structure Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012589	CIF	C	P 63/m m c	2.5221; 2.5221; 4.1186 90; 90; 120	22.688	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: hexagonal, 2H structure known as lonsdaleite Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012590	CIF	C	P 63/m m c	2.5221; 2.5221; 8.2371 90; 90; 120	45.376	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: hexagonal, 4H structure Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012591	CIF	C	P 63/m m c	2.5221; 2.5221; 12.3557 90; 90; 120	68.065	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: hexagonal, 6H structure Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012592	CIF	C	P 63/m m c	2.5221; 2.5221; 16.4743 90; 90; 120	90.753	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: hexagonal, 8H structure Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012593	CIF	C	R -3 m :H	2.5221; 2.5221; 30.8893 90; 90; 120	170.162	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: rhombohedral, 15R structure Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012594	CIF	C	R -3 m :H	2.5221; 2.5221; 43.245 90; 90; 120	238.227	Ownby, P. D.; Yang, X.; Liu, J. Calculated X-ray diffraction data for diamond polytypes Note: rhombohedral, 21R structure Note: theoretically calculated structure values Journal of the American Ceramic Society, 1992, 75, 1876-1883
9012595	CIF	Bi2.28 Pb0.57 Te4	R -3 m :H	4.45; 4.45; 41.532 90; 90; 120	712.252	Zhukova, T. B.; Zaslavskii, A. I. X-ray structure determination of PbBi4Te7 Zhurnal Strukturnoi Khimii, 1970, 11, 462-468
9012596	CIF	C2 H8 K2 Mg O10	P 1 21/n 1	11.404; 6.228; 6.826 90; 99.66; 90	477.936	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
9012597	CIF	Cl5 Fe H10 N2 O	P n m a	13.706; 9.924; 7.024 90; 90; 90	955.393	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
9012598	CIF	Ag3 Cu S2	I 41/a m d :2	8.6705; 8.6705; 11.7573 90; 90; 90	883.885	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
9012599	CIF	Sb	I m -3 m	3.45; 3.45; 3.45 90; 90; 90	41.064	Aoki, K.; Fujiwara, S.; Kusakabe, M. New phase transition into the b.c.c structure in antimony at high pressure Sample: at P = 28 GPa Note: cell parameters from ICSD Note: phase known as Sb(IV) Solid State Communications, 1983, 45, 161-163
9012600	CIF	O2 Si	P 31 2 1	4.914; 4.914; 5.406 90; 90; 120	113.052	Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 1 bar Solid State Communications, 1989, 72, 507-511
9012601	CIF	O2 Si	P 31 2 1	4.812; 4.812; 5.327 90; 90; 120	106.823	Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 2.0 Gpa Solid State Communications, 1989, 72, 507-511
9012602	CIF	O2 Si	P 31 2 1	4.705; 4.705; 5.25 90; 90; 120	100.649	Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 5.1 GPa Solid State Communications, 1989, 72, 507-511
9012603	CIF	O2 Si	P 31 2 1	4.625; 4.625; 5.216 90; 90; 120	96.625	Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 8.0 GPa Solid State Communications, 1989, 72, 507-511
9012604	CIF	O2 Si	P 31 2 1	4.594; 4.594; 5.2 90; 90; 120	95.042	Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 9.5 GPa Solid State Communications, 1989, 72, 507-511
9012605	CIF	O2 Si	P 31 2 1	4.535; 4.535; 5.17 90; 90; 120	92.082	Hazen, R. M.; Finger, L. W.; Hemley, R. J.; Mao, H. K. High-pressure crystal chemistry and amorphization of alpha-quartz Sample: P = 12.5 GPa Solid State Communications, 1989, 72, 507-511
9012607	CIF	Ag0.06 Cu9.9 Fe0.06 S13 Sb3.88 Zn1.86	I -4 3 m	10.382; 10.382; 10.382 90; 90; 90	1119.03	Rozhdestvenskaya, I. V.; Zayakina, N. V.; Samusikov, V. P. Crystal structure features of minerals from a series of tetrahedrite-freibergite Sample: 1 Mineralogiceskij Zhurnal, 1993, 15, 9-17
9012608	CIF	Ag2.88 Cu7.02 Fe0.84 S13 Sb4 Zn1.26	I -4 3 m	10.529; 10.529; 10.529 90; 90; 90	1167.24	Rozhdestvenskaya, I. V.; Zayakina, N. V.; Samusikov, V. P. Crystal structure features of minerals from a series of tetrahedrite-freibergite Sample: 2 Mineralogiceskij Zhurnal, 1993, 15, 9-17
9012609	CIF	Ag3.54 Cu6.3 Fe0.72 S13 Sb4 Zn1.44	I -4 3 m	10.576; 10.576; 10.576 90; 90; 90	1182.94	Rozhdestvenskaya, I. V.; Zayakina, N. V.; Samusikov, V. P. Crystal structure features of minerals from a series of tetrahedrite-freibergite Sample: 3 Mineralogiceskij Zhurnal, 1993, 15, 9-17
9012610	CIF	Ag6 Cu4.2 Fe1.2 S12.01 Sb4 Zn0.6	I -4 3 m	10.492; 10.492; 10.492 90; 90; 90	1154.98	Rozhdestvenskaya, I. V.; Zayakina, N. V.; Samusikov, V. P. Crystal structure features of minerals from a series of tetrahedrite-freibergite Sample: 4 Mineralogiceskij Zhurnal, 1993, 15, 9-17
9012611	CIF	C2 H4 Mg O6	P 1 21/c 1	8.69; 7.18; 9.39 90; 97.6; 90	580.735	Osaki, K.; Nakai, Y.; Watanabe, T. The crystal structure of magnesium formate dihydrate and manganous formate dihydrate Journal of the Physical Society of Japan, 1964, 19, 717-723
9012612	CIF	C2 H4 Mn O6	P 1 21/c 1	8.86; 7.29; 9.6 90; 97.7; 90	614.467	Osaki, K.; Nakai, Y.; Watanabe, T. The crystal structure of magnesium formate dihydrate and manganous formate dihydrate Journal of the Physical Society of Japan, 1964, 19, 717-723
9012613	CIF	Cr	P m -3	4.588; 4.588; 4.588 90; 90; 90	96.576	Kimoto, K.; Nishida, I. An electron diffraction study on the crystal structure of a new modification of chromium Journal of the Physical Society of Japan, 1967, 22, 744-756
9012614	CIF	Cu21 Pd7	P 4 m m	3.71; 3.71; 25.655 90; 90; 90	353.118	Okamura, K. Lattice modulation in the long period ordered alloys studied by X-ray diffraction. III. Cu3Pd Locality: synthetic Note: Coordinates of Cu6 altered to reproduce reported bond lengths Journal of the Physical Society of Japan, 1970, 28, 1005-1014
9012615	CIF	Fe2 P	P -6 2 m	5.868; 5.868; 3.458 90; 90; 120	103.118	Fujii, H.; Komura, S.; Takeda, T.; Okamoto, T.; Ito, Y.; Akimitsu, J. Polarized neutron diffraction study of Fe2P single crystal Sample: T = 295 K Journal of the Physical Society of Japan, 1979, 46, 1616-1621
9012616	CIF	Fe2 P	P -6 2 m	5.877; 5.877; 3.437 90; 90; 120	102.807	Fujii, H.; Komura, S.; Takeda, T.; Okamoto, T.; Ito, Y.; Akimitsu, J. Polarized neutron diffraction study of Fe2P single crystal Sample: T = 85 K Journal of the Physical Society of Japan, 1979, 46, 1616-1621
9012617	CIF	Fe0.9 H12 K3 Mn0.7 Na4 O28 Si8 Ti0.4	P -1	10.244; 11.924; 5.276 103.491; 96.96; 91.945	620.766	Rastsvetaeva, R. K.; Rekhlova, O. Y.; Khomyakov, A. P. Crystal structure of a new natural Na,K,Fe silicate Crystallography Reports, 1991, 36, 500-503
9012618	CIF	Al Ca F6 Li	P -3 1 c	5.007; 5.007; 9.642 90; 90; 120	209.34	Bolotina, N. B.; Maksimov, B. A.; Simonov, V. I.; Derzhavin, S. I.; Uvarova, T. V.; Apollonov, V. V. Atomic structure and spectral properties of LiCaAlF6:Cr3+ single crystals Crystallography Reports, 1993, 38, 446-450
9012619	CIF	Al Ca F6 Li	P -3 1 c	5.008; 5.008; 9.642 90; 90; 120	209.424	Bolotina, N. B.; Maksimov, B. A.; Simonov, V. I.; Derzhavin, S. I.; Uvarova, T. V.; Apollonov, V. V. Atomic structure and spectral properties of LiCaAlF6:Cr3+ single crystals Sample: LiCaAlF6:Cr3+ Crystallography Reports, 1993, 38, 446-450
9012620	CIF	Ca6 H6 O13 Si2	P 3	10.035; 10.035; 7.499 90; 90; 120	653.986	Yamnova, N. A.; Sarp, K.; Egorov-Tismenko Y K; Pushcharovskii, D. Y. Crystal structure of jaffeite Crystallography Reports, 1993, 38, 464-467
9012621	CIF	B9 Ca2 H8 Na O20	P 1 1 21/b	11.503; 10.53; 12.58 90; 90; 99.48	1502.96	Yamnova, N. A.; Egorov-Tismenko Yu K; Pushcharovskii D Yu; Malinko, S. V.; Dorokhova, G. I. Crystal structure of a new natural Na,Ca-hydroborate NaCa2[B9O14(OH)4]*2H2O Crystallography Reports, 1993, 38, 749-752
9012622	CIF	Li Na5 O8 P2	P 21 21 21	10.124; 14.794; 10.132 90; 90; 90	1517.52	Rastsvetaeva, R. K.; Khomyakov, A. P. A comparative crystal-chemical study of the lithium-sodium phosphates (lithiophosphate, nalipoite, olympite, and Na3PO4) Note: O5(y) made negative to match reported bond distances Crystallography Reports, 1994, 39, 35-41
9012623	CIF	B3 Ca H3 O7	P 1 21/a 1	8.386; 8.142; 7.249 90; 98.33; 90	489.731	Yamnova, N. A.; Egorov-Tismenko Y K; Malinko, S. V.; Pushcharovskii, D. Y.; Dorokhova, G. I. Crystal structure of a new natural calcium hydroborate Ca[B3O4(OH)3] Crystallography Reports, 1994, 39, 991-993
9012624	CIF	Al1.06 Ca1.65 F2 Fe0.85 K0.33 Mg3.74 Mn0.04 Na1.22 O22 Si6.94 Sr0.01 Ti0.16	C 1 2/m 1	9.911; 18.03; 5.279 90; 104.94; 90	911.445	Rastsvetaeva, R. K.; Pushcharovsky, D. Y.; Borutskii, B. E. Crystal structure of K,F-edenite from Khibini Locality: Khibini alkali massif, Yum'erchorr mountain, Kola Peninsula, Russia Crystallography Reports, 1995, 40, 27-30
9012625	CIF	Ba0.9 Fe0.6 H2 Mg0.3 Mn0.2 Na2.8 O18 Si4 Sr1.1 Ti2.1	C 1 2/m 1	19.744; 7.099; 5.409 90; 96.77; 90	752.854	Rastsvetaeva, R. K.; Dorfman, M. D. Crystal structure of Ba-lamprophyllite in the isomorphous lamprophyllite- baritolamprophyllite series Crystallography Reports, 1995, 40, 951-954
9012626	CIF	Ca0.02 Fe0.04 H13 K0.45 Mn0.94 Na5.8 Nb0.25 O32 Si10 Ti0.75	I 1 2/m 1	13.033; 18.717; 12.264 90; 99.62; 90	2949.59	Yamnova, N. A.; Egorov-Tismenko Y K; Khomyakov, A. P. Crystal structure of a new natural (Na,Mn,Ti)-phyllosilicate Crystallography Reports, 1996, 41, 239-244
9012627	CIF	C0.5 H9 Al Mg2 O9	P -6 2 m	5.283; 5.283; 15.15 90; 90; 120	366.188	Arakcheeva, A. V.; Pushcharovsky, D. Y.; Rastsvetaeva, R. K.; Atencio, D.; Lubman, G. U. Crystal structure and comparative crystal chemistry of Al2Mg4(OH)12(CO3)*3H2O, a new mineral from the hydrotalcite-manasseite group Note polytype 2H Locality: synthetic Crystallography Reports, 1996, 41, 972-981
9012628	CIF	Al1.28 Ba0.14 Cr1.42 F0.3 H1.7 K0.82 Mg0.18 Na0.04 O11.7 Si3 V0.12	C 1 2/c 1	5.24; 9.103; 19.93 90; 95.59; 90	946.134	Evsyunin, V. G.; Kashaev, A. A.; Rastsvetaeva, R. K. Crystal structure of a new representative of Cr micas Crystallography Reports, 1997, 42, 571-574
9012631	CIF	H O13 P3 Pb5	P 63/m	9.774; 9.774; 7.291 90; 90; 120	603.201	Barinova, A. V.; Bonin, M.; Pushcharovsky, D. Y.; Rastsvetaeva, R. K.; Schenk, K.; Dimitrova, O. V. Crystal structure of synthetic hydroxylpyromorphite Pb5(PO4)3(OH) Note: y(O3) corrected Crystallography Reports, 1998, 43, 189-192
9012632	CIF	Ba2.5 Ca F4 Fe6.1 H8 K1.2 Mn9.4 Na3 Nb0.32 O72 Si16 Ti7.68 Zr0.3	C 1 2 1	10.731; 13.841; 20.845 90; 95.06; 90	3084	Yamnova, N. A.; Egorov-Tismenko Y K; Pekov, I. V. Crystal structure of perraultite from the coastal region of the Sea of Azov Crystallography Reports, 1998, 43, 401-410
9012633	CIF	H15.68 K3.4 Mn0.2 Na2 Nb0.8 O32.4 Si8 Ti3.2	C 1 2/m 1	14.42; 13.91; 7.8 90; 116.9; 90	1395.25	Rastsvetaeva, R. K.; Chukanov, N. V.; Pekov, I. V.; Shlyukova, Z. V.; Khomyakov, A. P. Structures of two potassium-rich labuntsovites in relation to the crystal chemistry of minerals of the labuntsovite-nenadkevichite family Sample: I Crystallography Reports, 1998, 43, 820-827
9012634	CIF	Ba0.4 Fe0.063 H16 K2.8 Mg0.025 Mn0.063 Na2.25 Nb0.4 O32.3 Si8 Ti3.6	C 1 2/m 1	14.33; 13.83; 7.79 90; 117.1; 90	1374.36	Rastsvetaeva, R. K.; Chukanov, N. V.; Pekov, I. V.; Shlyukova, Z. V.; Khomyakov, A. P. Structures of two potassium-rich labuntsovites in relation to the crystal chemistry of minerals of the labuntsovite-nenadkevichite family Sample: II Crystallography Reports, 1998, 43, 820-827
9012635	CIF	H19.2 Mn3 Na3 O32 Si8 Ti0.25	C 1 2/m 1	15.1; 17.6; 5.29 90; 100.5; 90	1382.33	Pushcharovsky, D. Y.; Pekov, I. V.; Pluth, J. J.; Smith, J. V.; Ferraris, G.; Vinogradova, S. A.; Arakcheeva, A. V.; Soboleva, S. V.; Semenov, E. I. Raite, manganonordite-(Ce), and ferronordite-(Ce) from the Lovozero massif: Crystal structures and mineralogical geochemistry Kola Peninsula, Russia Crystallography Reports, 1999, 44, 565-574
9012636	CIF	Ba0.019 Ca0.051 Ce0.52 Fe0.23 La0.43 Mg0.1 Mn0.42 Na2.949 Nd0.05 O17 Si6 Sr0.981 Zn0.24	P c c a	14.44; 5.187; 19.82 90; 90; 90	1484.52	Pushcharovsky, D. Y.; Pekov, I. V.; Pluth, J. J.; Smith, J.; Ferraris, G.; Vinogradova, S. A.; Arakcheeva, A. V.; Soboleva, S. V.; Semenov, E. I. Raite, manganonordite-(Ce), and ferronordite-(Ce) from the Lovozero massif: Crystal structures and mineralogical geochemistry Crystallography Reports, 1999, 44, 565-574
9012637	CIF	Ba0.02 Ca0.099 Ce0.51 Fe0.42 La0.42 Mg0.1 Mn0.26 Na2.901 Nd0.04 O17 Pr0.03 Si6 Sr0.98 Zn0.22	P c c a	14.46; 5.194; 19.874 90; 90; 90	1492.64	Pushcharovsky, D. Y.; Pekov, I. V.; Pluth, J. J.; Smith, J.; Ferraris, G.; Vinogradova, S. A.; Arakcheeva, A. V.; Soboleva, S. V.; Semenov, E. I. Raite, manganonordite-(Ce), and ferronordite-(Ce) from the Lovozero massif: Crystal structures and mineralogical geochemistry Crystallography Reports, 1999, 44, 565-574
9012638	CIF	Ca2.1 Ce0.579 Cl0.3 F0.5 Fe0.15 H3.816 Hf0.051 K0.099 La0.342 Mn3.6 Na16.002 Nb0.4 Nd0.228 O77.11 Si25.6 Sr0.45 Ti0.099 Zr3.3	R 3 :H	14.182; 14.182; 30.37 90; 90; 120	5289.94	Rastsvetaeva, R. K.; Khomyakov, A. P.; Nekrasov, Y. V. Crystal structure of a novel analog of eudialyte with R3 symmetry Crystallography Reports, 1999, 44, 765-769
9012639	CIF	Ca2.1 Ce0.54 Cl0.17 F0.28 Fe0.15 H3.78 Hf0.051 K0.099 La0.312 Mn3.6 Na16.002 Nb0.4 Nd0.198 O77.11 Si25.6 Sr0.45 Ti0.099 Y0.099 Zr3.3	R 3 :H	14.182; 14.182; 30.37 90; 90; 120	5289.94	Rastsvetaeva, R. K.; Khomyakov, A. P.; Nekrasov, Y. V. Crystal structure of a novel analog of eudialyte with R3 symmetry Locality: Alluaiv mountain, Lovozero alakaline massif, Kola Peninsula, Russia Crystallography Reports, 1999, 44, 824-828
9012640	CIF	Al As Cu O5	P 1 21/c 1	7.335; 10.255; 5.599 90; 99.79; 90	415.026	Krivovichev, S. V.; Molchanov, A. V.; Filatov, S. K. Crystal structure of urusovite Cu(AlAsO5): a new type of an aluminoarsenate tetrahedral polyanion Crystallography Reports, 2000, 45, 723-727
9012641	CIF	Ba0.03 Fe0.4 H13.17 K1.63 Mn0.56 Na0.18 Nb0.34 O32.25 Si8 Ti3.4	C 1 m 1	14.369; 13.906; 7.812 90; 117.09; 90	1389.71	Rastsvetaeva, R. K.; Chukanov, N. V.; Pekov, I. V. Refined crystal structure of kuzmenkoite Crystallography Reports, 2000, 45, 759-761
9012643	CIF	Al0.18 Ca0.01 Fe0.01 H10 Hf0.01 K0.01 Mn0.14 Na2.51 O18.45 Si5.82 Ti0.01 Zr0.96	C 1 m 1	10.589; 10.217; 7.355 90; 92.91; 90	794.695	Yamnova, N. A.; Egorov-Tismenko Y K; Pekov, I. V.; Ekimenkova, I. A. Crystal structure of litvinskite: A new natural member of the lovozerite group Locality: Alluaiv mountain, Lovozero massif, Kola Peninsula, Russia Crystallography Reports, 2001, 46, 190-193
9012644	CIF	Ca0.89 Ce0.11 Nb1.3 O6 Ti0.7	P c a n	5.762; 14.988; 5.246 90; 90; 90	453.049	Gurbanova, O. A.; Rastsvetaeva, R. K.; Kashaev, A. A.; Smolin, A. S. Refined crystal structure of TR-fersmite (TR = Ce) Crystallography Reports, 2001, 46, 194-195
9012645	CIF	Ca12 Ce0.102 Cl2.68 F0.68 Fe2.19 H11.56 K1.452 Mn0.81 Na34.53 O151.54 Si51.2 Sr0.735 Ti0.52 Zr6	R 3 :H	14.239; 14.239; 60.733 90; 90; 120	10663.9	Rastsvetaeva, R. K.; Khomyakov, A. P. Modular structure of a sodium-rich analogue of eudialyte with the doubled c-parameter and the R3 symmetry Crystallography Reports, 2001, 46, 752-757
9012646	CIF	C5 Ba0.501 Ca1.437 Ce0.438 La0.243 Na2.667 Nd0.099 O15 Sr0.549	P 63 m c	10.4974; 10.4974; 6.4309 90; 90; 120	613.714	Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Kabalov, Y. K.; Subbotin, V. V. Crystal structure of calcioburbankite and the characteristic features of the burbankite structure type Crystallography Reports, 2001, 46, 927-931
9012647	CIF	Ca0.35 Fe0.14 H10.8 Hf0.03 K0.09 Mn0.08 Na2.39 O18.9 Si6 Ti0.03 Zr0.8	R 3 :H	10.18; 10.18; 13.13 90; 90; 120	1178.4	Yamnova, N. A.; Egorov-Tismenko Y K; Pekov, I. V. Refined crystal structure of lovozerite Na2CaZr[Si6O12(OH,O)6]*H2O Crystallography Reports, 2001, 46, 937-941
9012648	CIF	C5 Ba1.08 Ca0.87 Ce0.48 La0.18 Na2.58 Nd0.15 O15 Pr0.03 Sr0.63	P 63 m c	10.579; 10.579; 6.5446 90; 90; 120	634.312	Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Kabalov, Y. K.; Schneider, J. Determination of the crystal structure of khanneshite by the Rietveld method Crystallography Reports, 2002, 47, 39-42
9012649	CIF	C H3 Ba1.27 Ca0.21 F Fe0.675 K0.2 Mn0.375 Na1.95 Nb0.05 O13 Si2 Sr0.32 Ti0.95	P -1	5.399; 7.016; 16.254 102.44; 93.18; 90.1	600.251	Zhou, H.; Rastsvetaeva, R. K.; Khomyakov, A. P.; Ma, Z.; Shi, N. Crystal structure of new micalike titanosilicate - bussenite, Na2Ba2Fe2+[TiSi2O7][CO3]O(OH)(H2O)F Crystallography Reports, 2002, 47, 43-46
9012650	CIF	Ca0.55 F2 Mn0.85 Na3.2 O16 Si4 Ti1.15 Zr1.85	P 1 2/c 1	5.627; 7.134; 18.59 90; 102.68; 90	728.058	Pushcharovskii D Yu; Pasero, M.; Merlino, S.; Vladykin, N. V.; Zubkova, N. V.; Gobechiya, E. R. Crystal structure of zirconium-rich seidozerite Crystallography Reports, 2002, 47, 196-200
9012651	CIF	C2 H2.83 Ba0.01 Ca0.02 Ce0.52 F0.13 La0.28 Nd0.11 O7.73 Pr0.04 Sm0.01 Sr0.97	P m c 21	5.0634; 8.5898; 7.2781 90; 90; 90	316.551	Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Yamnova, N. A.; Kabalov, Y. K.; Chukanov, N. V.; Schneider, J. Crystal structures of two ancylite modifications Locality: Lovchorrite Mine, Hackman Velley, Khibiny massif, Kola Peninsula, Russia Sample: Specimen 52 Crystallography Reports, 2002, 47, 223-228
9012652	CIF	C H2.225 Ba0.005 Ca0.025 Ce0.31 F0.075 La0.2 Nd0.045 O3.925 Pr0.015 Sr0.4	P m c n	5.0577; 8.5665; 7.3151 90; 90; 90	316.94	Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Yamnova, N. A.; Kabalov, Y. K.; Chukanov, N. V.; Schneider, J. Crystal structures of two ancylite modifications Sample: Specimen 54 Crystallography Reports, 2002, 47, 223-228
9012653	CIF	Al3 Ca0.828 Cl0.048 Na3.172 O13.76 S1.022 Si3	P 2 3	9.077; 9.077; 9.077 90; 90; 90	747.872	Rastsvetaeva, R. K.; Bolotina, N. B.; Sapozhnikov, A. N.; Kashaev, A. A.; Schoenleber, A.; Chapuis, G. Average structure of cubic lazurite with a three-dimensional incommensurate modulation Crystallography Reports, 2002, 47, 404-407
9012654	CIF	Ca0.333 H4 Na0.333 O11 Si3 Zr	R 3 2 :H	10.498; 10.498; 7.975 90; 90; 120	761.157	Pushcharovsky, D. Y.; Pekov, I. V.; Pasero, M.; Gobechiya, E. R.; Merlino, S.; Zubkova, N. V. Crystal structure of cation-deficient calciohilairite and possible mechanisms of decationization in mixed-framework minerals Locality: Lovozero massif, Kola Peninsula, Russia Crystallography Reports, 2002, 47, 748-752
9012655	CIF	Al0.84 Ca0.82 F0.29 Fe2.1 H1.47 K0.13 Mg2.7 Mn0.02 Na2.05 O23.71 Si7.16 Ti0.17	C 1 2/m 1	9.875; 18.01; 5.309 90; 104.39; 90	914.576	Pushcharovsky, D. Y.; Lebedeva, Y. S.; Pekov, I. V.; Ferraris, G.; Novakova, A. A.; Ivaldi, G. Crystal structure of magnesioferrikatophorite Locality: Turiy Cape, Kola Peninsula, Russia Crystallography Reports, 2003, 48, 16-23
9012657	CIF	Ba3.3 Ca2.4 F8 Fe8 H4 K0.7 Mn7.4 Na2.2 Nb0.8 O68 Si16 Ti6.4 Zr0.8	C 1 2 1	10.723; 13.826; 20.791 90; 95; 90	3070.67	Rozenberg, K. A.; Rastsvetaeva, R. K.; Verin, I. A. Crystal structure of surkhobite - new mineral from the family of titanosilicate micas Crystallography Reports, 2003, 48, 384-389
9012658	CIF	Ca3.3 Ce0.33 Cl0.74 Fe2.1 H18.453 K0.3 La0.132 Mn1.398 Na9.627 Nb0.1 Nd0.036 O79.661 Si24.3 Sr0.504 Ti0.1 Zr3.4	R 3 m :H	14.167; 14.167; 30.081 90; 90; 120	5228.52	Rastsvetaeva, R. K.; Chukanov, N. V. Ikranite: composition and structure of a new mineral of the eudialyte group Crystallography Reports, 2003, 48, 717-720
9012659	CIF	As4 Cl Cu5 H10 Na O21 Pb	P 1 21/n 1	10.023; 19.55; 10.023 90; 90.02; 90	1964	Zubkova, N. V.; Pushcharovsky, D. Y.; Sarp, H.; Teat, S. J.; MacLean, E. J. Crystal structure of zdenekite NaPbCu5(AsO4)4Cl*5H2O Crystallography Reports, 2003, 48, 939-943
9012660	CIF	Ba0.05 Ca0.4 H6.136 K0.4 Na1.4 Nb1.6 O35.3 Si8 Sr0.8 Ti2.4	C 1 2/m 1	14.596; 14.249; 15.852 90; 117.27; 90	2930.45	Organova, N. I.; Krivovichev, S. V.; Shlyukova, Z. V.; Zadov, A. E.; Rozhdestvenskaya, I. V.; Ivanova, T. I. Structure of new mineral paratsepinite-Na and its place in the labuntsovite group Crystallography Reports, 2004, 49, 946-952
9012661	CIF	Ba1.9 Ce2 F0.7 Fe0.16 H2.3 K0.05 Mg0.05 Mn0.52 Na0.95 O27.3 Si8 Sr0.1 Ti2 Zn0.27	A m a 2	22.301; 10.514; 9.669 90; 90; 90	2267.12	Zubkova, N. V.; Pushcharovsky, D. Y.; Giester, G.; Tillmanns, E.; Pekov, I. V.; Krotova, O. D. Crystal structure of byelorussite-(Ce) NaMnBa2Ce2(TiO)2[Si4O12]2(F,OH)*H2O Crystallography Reports, 2004, 49, 964-968
9012662	CIF	C2 H8 Al0.12 B3.51 Ca6 Cl0.408 Fe0.351 Mg1.649 O18.888 Si0.49	F d -3 m :2	14.679; 14.679; 14.679 90; 90; 90	3162.93	Yakubovich, O. V.; Steele, I. M.; Gavrilenko, P. G.; Urusov, V. S. Crystal structure of sakhaite from the Solongo deposit in connection with the crystal chemical interpretation of the sakhaite-harkerite mineral series Crystallography Reports, 2005, 50, 226-234
9012663	CIF	C H6.82 Al0.08 Ca9.348 Ce0.102 Cl0.29 Fe2.19 K0.6 Mn0.3 Na10.44 Nb0.57 O78.53 Si24.66 Zr3	R 3 m :H	14.231; 14.231; 29.984 90; 90; 120	5258.85	Rozenberg, K. A.; Rastsvetaeva, R. K.; Chukanov, N. V.; Verin, I. A. Crystal structure of golyshevite Crystallography Reports, 2005, 50, 539-543
9012664	CIF	Al3.996 Ca0.84 H75 K1.333 Na1.02 O36.168 Si8.004	R -3 m :H	13.831; 13.831; 15.023 90; 90; 120	2488.83	Yakubovich, O. V.; Massa, W.; Gavrilenko, P. G.; Pekov, I. V. Crystal structure of chabazite K Sample: T = 193 K Crystallography Reports, 2005, 50, 544-553
9012665	CIF	Ca9.434 F41.06 Ho0.48 Na1.958 Nd0.954 Y5.298	R -3 :H	17.02; 17.02; 9.679 90; 90; 120	2428.18	Yakubovich, O. V.; Massa, W.; Pekov, I. V.; Gavrilenko, P. G. Crystal structure of tveitite-(Y): fractionation of rare-earth elements between positions and the variety of defects Crystallography Reports, 2007, 52, 71-79
9012666	CIF	Al2 H4 O9 Si2	C 1 c 1	8.91; 5.144; 14.593 90; 100.5; 90	657.642	Zhukhlistov, A. P. Crystal structure of nacrite from the electron diffraction data Crystallography Reports, 2008, 53, 76-82
9012667	CIF	Ca8 Cl2 Mg O16 Si4	P 1	15.1; 15.11; 15.092 90.06; 90.01; 89.93	3443.4	Rastsvetaeva, R. K.; Zadov, A. E.; Chukanov, N. V. Crystal structure of low-symmetry rondorfite Crystallography Reports, 2008, 53, 199-205
9012668	CIF	C2 B3.468 F2 Mg9 O58 Pb14.144 Si10.532	P -1	9.3409; 9.3579; 18.8333 80.365; 75.816; 59.87	1378.47	Yakubovich, O. V.; Massa, W.; Chukanov, N. V. Crystal structure of britvinite [Pb7(OH)3F(BO3)2(CO3)][Mg4.5(OH)3(Si5O14)]: A new layered silicate with an original type of silicon-oxygen networks Crystallography Reports, 2008, 53, 206-215
9012669	CIF	Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.28 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03	R 3 m :H	15.894; 15.894; 7.115 90; 90; 120	1556.58	Rozhdestvenskaya, I. V.; Bronzova, Y. M.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I. Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic) Locality: Sangilen Upland, Tuva Republic Crystallography Reports, 2008, 53, 223-227
9012670	CIF	Pt1.012 S0.988	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012671	CIF	Pt1.001 S	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012672	CIF	Pt0.997 S1.003	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012673	CIF	Fe0.001 Pt0.992 S1.007	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012674	CIF	Fe0.001 Pt0.989 S1.01	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012675	CIF	Pt0.982 S1.018	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012676	CIF	Fe0.001 Pt0.98 S1.019	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012677	CIF	Fe0.001 Pt0.974 S1.025	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012678	CIF	Fe0.001 Pt0.97 S1.029	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012679	CIF	Fe0.002 Pt0.964 S1.034	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012680	CIF	Fe0.001 Pt0.954 S1.045	P 42/m m c	3.471; 3.471; 6.1084 90; 90; 90	73.593	Rozhdestvina, V. I.; Ivanov, A. V.; Zaremba, M. A.; Antsutkin, O. N.; Forsling, W. Single-crystalline cooperite (PtS): Crystal-chemical characterization, ESR spectroscopy, and 195Pt NMR Spectroscopy Locality: Sea of Okhotsk region, Maimakansk zone, Far East Crystallography Reports, 2008, 53, 391-397
9012681	CIF	Ca2 O4 Si	P b n m	5.07389; 11.21128; 6.7534 90; 90; 90	384.166	Gobechiya, E. R.; Yamnova, N. A.; Zadov, A. E.; Gazeev, V. M. Calcio-olivine gamma-Ca2SiO4: I. Rietveld refinement of the crystal structure Crystallography Reports, 2008, 53, 404-408
9012682	CIF	Ba1.44 Ca0.76 F2 Fe6 H8 K0.8 Mg0.5 Mn1.5 Na Nb0.2 O38 Si8 Ti3.6 Zr0.2	P 1 2/m 1	5.35; 6.909; 20.96 90; 99.83; 90	763.373	Rastsvetaeva, R. K.; Chukanov, N. V.; Rozenberg, K. A crystal structure of jinshajiangite from the Norra Karr complex (Sweden) Crystallography Reports, 2008, 53, 553-556
9012683	CIF	As0.66 Fe0.19 H20 Mg0.81 O22 P1.34 U2	P 1 21/n 1	6.952; 19.865; 6.969 90; 90.806; 90	962.334	Yakubovich, O. V.; Steele, I. M.; Atencio, D.; Menezes, L. A.; Chukanov, N. V. Crystal structure of the (Mg,Fe)[UO2(P,As)O4]2*10H2O solid solution- a novel mineral variety of saleeite Crystallography Reports, 2008, 53, 764-770
9012684	CIF	As1.22 H12.72 N1.15 Na0.09 O18 P0.78 U2	P 1	7.173; 7.167; 9.3 90.13; 90.09; 89.96	478.101	Rastsvetaeva, R. K.; Sidorenko, G. A.; Ivanova, A. G.; Chukanov, N. V. Structural model of uramarsite Crystallography Reports, 2008, 53, 771-774
9012685	CIF	Al24 Ca2.665 Cl H10 K8.076 Na21.256 O118.45 S5 Si24	P 3 1 c	12.856; 12.856; 42.256 90; 90; 120	6048.26	Bonaccorsi, E. The crystal structure of giuseppettite, the 16-layer member of the cancrinite- sodalite group Locality: Sacrofano, Biachella Valley, Latium, Italy Microporous and Mesoporous Materials, 2004, 73, 129-136
9012686	CIF	O7.5 Sc0.06 Ta2.94	I 1 2 1	3.81; 3.81; 35.764 90; 90; 90	519.154	Stephenson, N. C.; Roth, R. S. The crystal structure of the high temperature form of Ta2O2 Journal of Solid State Chemistry, 1971, 3, 145-153
9012687	CIF	Na2 O7 Si2 Zr	P -1	6.66; 8.83; 5.42 92.75; 94.25; 72.33	302.756	Voronkov, A. A.; Shumyatskaya, N. G.; Pyatenko, Y. A. Crystal structure of a new natural modification of Na2Zr[Si2O7] Journal of Structural Chemistry, 1970, 11, 866-867
9012688	CIF	As2.79 Cu12.55 S16 V1.11	P -4 3 n	10.527; 10.527; 10.527 90; 90; 90	1166.58	Frank-Kamenetskaya O V; Rozhdestvenskaya, I. V.; Yanulova, L. A. New data on the crystal structures of colusites and arsenosulvanites Sample: 1 Journal of Structural Chemistry, 2002, 43, 89-100
9012689	CIF	As2.1 Cu12.67 Ge0.6 S16 Sb0.24 Sn0.06 V0.9	P -4 3 n	10.6; 10.6; 10.6 90; 90; 90	1191.02	Frank-Kamenetskaya O V; Rozhdestvenskaya, I. V.; Yanulova, L. A. New data on the crystal structures of colusites and arsenosulvanites Sample: 2 Journal of Structural Chemistry, 2002, 43, 89-100
9012690	CIF	As1.8 Cu12.92 S16 Sb0.3 Sn0.9 V	P -4 3 n	10.653; 10.653; 10.653 90; 90; 90	1208.97	Frank-Kamenetskaya O V; Rozhdestvenskaya, I. V.; Yanulova, L. A. New data on the crystal structures of colusites and arsenosulvanites Sample: 3 Journal of Structural Chemistry, 2002, 43, 89-100
9012691	CIF	O2 Si	P 42/m n m	4.1773; 4.1773; 2.6655 90; 90; 90	46.513	Hill, R. J.; Newton, M. D.; Gibbs, G. V. A crystal chemical study of stishovite Journal of Solid State Chemistry, 1983, 47, 185-200
9012692	CIF	Fe2 O3	P 43 21 2	8.3396; 8.3396; 8.322 90; 90; 90	578.786	Greaves, C. A powder neutron diffraction investigation of vacancy ordering and covalence in gamma-Fe2O3 Locality: synthetic Sample: T = 4 K Journal of Solid State Chemistry, 1983, 49, 325-333
9012693	CIF	Li0.02 Na0.98 Nb O3	P c 21 b	5.494; 15.461; 5.551 90; 90; 90	471.517	von der Muhll, R.; Sadel, A.; Hagenmuller, P. Structure cristalline a 295K de la phase ferroelectrique Li0.02Na0.98Nb O3 Note: x(O3) corrected to match reported bond lengths Journal of Solid State Chemistry, 1984, 51, 176-182
9012694	CIF	O Pb	C m m a	5.6124; 5.6089; 4.9924 90; 90; 90	157.158	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 2 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012695	CIF	O Pb	C m m a	5.6112; 5.6091; 4.9935 90; 90; 90	157.164	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 30 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012696	CIF	O Pb	C m m a	5.6118; 5.6114; 4.9988 90; 90; 90	157.412	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 77 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012697	CIF	O Pb	C m m a	5.6253; 5.6253; 5.0259 90; 90; 90	159.04	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: Neutron Diffraction T = 300 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012698	CIF	O Pb	P 4/n m m :1	3.9645; 3.9645; 4.9956 90; 90; 90	78.517	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 77.6 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012699	CIF	O Pb	P 4/n m m :1	3.9634; 3.9634; 5.0088 90; 90; 90	78.681	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 182 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012700	CIF	O Pb	P 4/n m m :1	3.9744; 3.9744; 5.022 90; 90; 90	79.327	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction; in the cryostat T = 295 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012701	CIF	O Pb	P 4/n m m :1	3.9744; 3.9744; 5.0219 90; 90; 90	79.325	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction; in the four-circle diffractometer T = 295 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012702	CIF	O Pb	P 4/n m m :1	3.9854; 3.9854; 5.0435 90; 90; 90	80.108	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 473 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012703	CIF	O Pb	P 4/n m m :1	3.9998; 3.9998; 5.0654 90; 90; 90	81.038	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Method: X-ray Diffraction T = 673 K Locality: synthetic Journal of Solid State Chemistry, 1985, 57, 343-350
9012704	CIF	O Pb	P 4/n m m :1	4.0039; 4.0039; 5.0712 90; 90; 90	81.297	Boher, P.; Garnier, P.; Gavarri, J. R.; Hewat, A. W. Monoxyde quadratique PbO alpha(I): Description de la transition structurale ferroelastique Locality: synthetic Method: X-ray Diffraction T = 723 K Journal of Solid State Chemistry, 1985, 57, 343-350
9012706	CIF	Fe	F m -3 m	3.639; 3.639; 3.639 90; 90; 90	48.189	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1189 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012707	CIF	Fe	F m -3 m	3.639; 3.639; 3.639 90; 90; 90	48.189	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1196 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012708	CIF	Fe	F m -3 m	3.642; 3.642; 3.642 90; 90; 90	48.308	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1223 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012709	CIF	Fe	F m -3 m	3.652; 3.652; 3.652 90; 90; 90	48.707	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1347 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012710	CIF	Fe	F m -3 m	3.662; 3.662; 3.662 90; 90; 90	49.108	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1457 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012711	CIF	Fe	F m -3 m	3.671; 3.671; 3.671 90; 90; 90	49.471	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1565 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012712	CIF	Fe	F m -3 m	3.677; 3.677; 3.677 90; 90; 90	49.714	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1635 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012713	CIF	Fe	F m -3 m	3.679; 3.679; 3.679 90; 90; 90	49.795	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1653 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012714	CIF	Fe	F m -3 m	3.679; 3.679; 3.679 90; 90; 90	49.795	Basinski, Z. S.; Hume-Rothery W; Sutton, A. L. The lattice expansion of iron Sample: at T = 1661 K Proceedings of the Royal Society of London A, 1955, 229, 459-467
9012715	CIF	Cu2 H3 N O6	P 21 21 21	6.087; 13.813; 5.597 90; 90; 90	470.594	Bovio, B.; Locchi, S. Crystal structure of the orthorhombic basic copper nitrate, Cu2(OH)3NO3 Journal of Crystallographic and Spectroscopic Research, 1982, 12, 507-517
9012716	CIF	F Mg2 O4 P	P 1 21/c 1	9.644; 12.679; 11.957 90; 108.3; 90	1388.11	Coda, A.; Giuseppetti, G.; Tadini, C.; Carobbi, S. G. The crystal structure of wagnerite Atti della Accademia Nazionale dei Lincei, 1967, 43, 212-224
9012717	CIF	As Ni0.808 Pd1.192	P -6 2 c	6.3165; 6.3165; 7.4278 90; 90; 120	256.652	Evstigneeva, T.; Kabalov, Y.; Schneider, J. Crystal structure of PdNiAs, ordered member of isomorphous series Pd2As-Ni2As Materials Science Forum, 2000, 321, 700-705
9012718	CIF	K2 O8 Pb S2	R -3 m :H	5.497; 5.497; 20.864 90; 90; 120	545.984	Tissot, R. G.; Rodriguez, M. A.; Sipola, D. L.; Voigt, J. A. X-ray powder diffraction study of synthetic palmierite, K2Pb(SO4)2 Powder Diffraction, 2001, 16, 92-97
9012719	CIF	Ca5 F O12 S1.5 Si1.5	P 63/m	9.44174; 9.44174; 6.93964 90; 90; 120	535.762	Pajares, I.; De la Torre, A. G.; Martinez-Ramirez S; Puertas, F.; Blanco-Varela M T; Aranda, M. A. G. Quantitative analysis of mineralized white Portland clinkers: The structure of fluorellestadite Locality: synthetic Powder Diffraction, 2002, 17, 281-286
9012721	CIF	Al0.828 Ca0.156 Fe0.772 Mg2.254 Mn3.1 Na2.624 O24 P6	P 1 21/n 1	11.856; 12.411; 6.421 90; 114.45; 90	860.088	Zhesheng, M.; Nicheng, S.; Zhizhong, P. Crystal structure of a new phosphatic mineral-qingheiite Locality: Northwestern Qinghe County, Altay Prefecture, Uygur Autonomous Region, Xinjiang Note: changed P3(z) to match reported bond distances Scientia Sinica, Series B, 1983, 26, 876-884
9012722	CIF	Cs	F m -3 m	6.465; 6.465; 6.465 90; 90; 90	270.213	Weir, C. E.; Piermarini, G. J.; Block, S. On the crystal structures of Cs II and Ga II Sample: at room T Note: known as cesium-II Journal of Physical Chemistry, 1971, 54, 2768-2770
9012723	CIF	Ga	I 4/m m m	2.808; 2.808; 4.458 90; 90; 90	35.151	Weir, C. E.; Piermarini, G. J.; Block, S. On the crystal structures of Cs II and Ga II Sample: at P > .002 GPa & room T Note: known as gallium-II Journal of Physical Chemistry, 1971, 54, 2768-2770
9012724	CIF	Si	F m -3 m	3.34; 3.34; 3.34 90; 90; 90	37.26	Duclos, S. J.; Vohra, Y. K.; Ruoff, A. L. hcp-to-fcc transition in silicon at 78 GPa and studies to 100 GPa Sample: at P = 87 GPa Note: fcc structure stable above 78 GPa Physical Review Letters, 1987, 58, 775-777
9012725	CIF	Cs	P 63/m m c	3.011; 3.011; 4.855 90; 90; 90	44.016	Takemura, K.; Shimomura, O.; Fujihisa, H. Cs(VI): a new high-pressure polymorph of cesium above 72 GPa Sample: at P = 92 GPa Note: stable above P = 72 GPa Note: known as cesium-VI Physical Review Letters, 1991, 66, 2014-2017
9012726	CIF	Sr	F m -3 m	6.076; 6.076; 6.076 90; 90; 90	224.312	Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 25 C note: known as alpha-strontium Journal of Physical Chemistry, 1956, 60, 302-304
9012727	CIF	Sr	I m -3 m	4.87; 4.87; 4.87 90; 90; 90	115.501	Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 628 C note: known as beta-strontium Journal of Physical Chemistry, 1956, 60, 302-304
9012728	CIF	Sr	P 63/m m c	4.28; 4.28; 7.05 90; 90; 120	111.843	Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 225 C note: known as gamma-strontium Journal of Physical Chemistry, 1956, 60, 302-304
9012729	CIF	Ba	I m -3 m	5.013; 5.013; 5.013 90; 90; 90	125.978	Hirst, R. G.; King, A. J.; Kanda, F. A. The barium-strontium equilibrium system Sample: at T = 25 C Journal of Physical Chemistry, 1956, 60, 302-304
9012730	CIF	Ca	P 63/m m c	4; 4; 6.5 90; 90; 120	90.067	Schottmiller, J. C.; King, A. J.; Kanda, F. A. The calcium-strontium metal phase system Sample: at T = 415 C Journal of Physical Chemistry, 1958, 62, 1446-1449
9012731	CIF	Ca	F m -3 m	5.601; 5.601; 5.601 90; 90; 90	175.71	Schottmiller, J. C.; King, A. J.; Kanda, F. A. The calcium-strontium metal phase system Sample: at T = 25 C Journal of Physical Chemistry, 1958, 62, 1446-1449
9012732	CIF	Ca	I m -3 m	4.488; 4.488; 4.488 90; 90; 90	90.398	Schottmiller, J. C.; King, A. J.; Kanda, F. A. The calcium-strontium metal phase system Sample: at T = 615 C Journal of Physical Chemistry, 1958, 62, 1446-1449
9012733	CIF	D2 O	F d -3 m :2	17.103; 17.103; 17.103 90; 90; 90	5002.84	Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 7 K, host lattice Note: y(D7) corrected Journal of Physical Chemistry B, 2003, 107, 6026-6031
9012734	CIF	D2 O	F d -3 m :2	17.109; 17.109; 17.109 90; 90; 90	5008.11	Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 75 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031
9012735	CIF	D2 O	F d -3 m :2	17.15; 17.15; 17.15 90; 90; 90	5044.2	Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 140 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031
9012736	CIF	D2 O	F d -3 m :2	17.198; 17.198; 17.198 90; 90; 90	5086.67	Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 205 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031
9012737	CIF	D2 O	F d -3 m :2	17.262; 17.262; 17.262 90; 90; 90	5143.67	Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: T = 265 K, host lattice Journal of Physical Chemistry B, 2003, 107, 6026-6031
9012738	CIF	C0.333 H0.667 O0.083	F d -3 m :2	17.103; 17.103; 17.103 90; 90; 90	5002.84	Jones, C. Y.; Marshall, S. L.; Chakoumakos, B. C.; Rawn, C. J.; Ishii, Y. Structure and thermal expansivity of tetrahydrofuran deuterate determined by neutron powder diffraction Sample: cell T = 7 K, positions T = 5 K, guest molecule Note: occupancies of C11 and H14 switched to reproduce reported formula Journal of Physical Chemistry B, 2003, 107, 6026-6031
9012739	CIF	O6 Sb2 Zn	P 42/m n m	4.66; 4.66; 9.24 90; 90; 90	200.652	Bystrom, A.; Hok, B.; Mason, B. The crystal structure of zinc metantimonate and similar compounds Arkiv for Kemi, Mineralogi och Geologi,, 1942, 1-8
9012740	CIF	Cu O6 Sb2	P 1 21/c 1	4.62; 4.62; 9.28 90; 88.5; 90	198.008	Bystrom, A.; Hok, B.; Mason, B. The crystal structure of zinc metantimonate and similar compounds Arkiv for Kemi, Mineralogi och Geologi,, 1942, 1-8
9012741	CIF	K O6 U V	P 1 21/c 1	6.59; 8.403; 10.43 90; 104.2; 90	559.922	Sundberg, I.; Sillen, L. G. On the crystal structure of KUO2VO4 (synthetic anhydrous carnotite) Arkiv for Kemi, 1949, 1, 337-351
9012742	CIF	Ca O10 S6 Sb10	C 1 2/c 1	25.33; 5.655; 16.88 90; 117.51; 90	2144.52	Nakai, I.; Koto, K.; Nagashima, K.; Morimoto, N. The crystal structure of sarabauite CaSb10O10S6, a new oxide sulfide mineral Chemistry Letters, 1977, 1977, 275-276
9012743	CIF	Be4 Ca3 K2 Li0.25 Na3.75 O38 Si12 Ti2	F d d d :2	14.243; 13.045; 33.4839 90; 90; 90	6221.31	Rastsvetaeva, R. K.; Evsyunin, V. G.; Kashaev, A. A. Crystal structure of a new representative of ring silicates Doklady Chemistry, 1995, 340, 49-51
9012744	CIF	Dy0.3 Gd0.2 H12 Na5 Nb0.2 O24 Si6 Ti0.8 Y0.5	R 3 2 :H	10.696; 10.696; 15.728 90; 90; 120	1558.29	Rastsvetaeva, R. K.; Khomyakov, A. P. Crystal structure of pyatenkoite-(Y) Na5YTiSi6O18*6H2O, a new mineral of the hilairite group: crystal structure Doklady Chemistry, 1996, 351, 283-286
9012745	CIF	H1.23 K0.875 Na0.43 Nb0.3 O7.89 Si2 Ti0.7	C 1 2/m 1	14.39; 13.9; 7.825 90; 117.6; 90	1387.05	Rastsvetaeva, R. K.; Arakcheeva, A. V.; Khomyakov, A. P. Crystal structure and microtwinning of a new monoclinic analog of nenadkevichite Doklady Chemistry, 1996, 351, 294-297
9012746	CIF	Al0.745 Cu F0.73 H4.5 O4	C 1 2/m 1	12.326; 2.907; 10.369 90; 97.9; 90	368.013	Rastsvetaeva, R. K.; Chukanov, N. V.; Karpenko, V. Y. Crystal structure of new native compound Cu4Al3(OH)14F3(H2O)2 Doklady Chemistry, 1997, 353, 45-48
9012747	CIF	Ba0.033 Ca6.333 Ce0.468 Cl1.6 Fe2.55 H7.38 K0.249 Mn1.188 Na12 Nb0.8 O81.18 Si25.2 Sr0.717 Ti0.06 Y0.132 Zr3.27	R 3 m :H	14.262; 14.262; 29.949 90; 90; 120	5275.62	Ekimenkova, I. A.; Rastsvetaeva, R. K.; Khomyakov, A. P. Crystal structure of the Fe,Cl-analogue of kentbrooksite Doklady Chemistry, 2000, 370, 17-20
9012748	CIF	Ba0.08 Fe0.02 H11.94 K0.44 Na1.09 Nb1.8 O32.44 Si8 Sr0.2 Ti2.2	C 1 m 1	14.604; 14.274; 7.933 90; 117.4; 90	1468.17	Rastsvetaeva, R. K.; Organova, N. I.; Rozhdestvenskaya, I. V.; Shlyukova, Z. V.; Chukanov, N. V. Crystal structure of oxonium mineral of the nenadkevichite-labuntsovite group from Khibiny massif Locality: Khibinpakhchorr mountain, Khibiny massif, Kola Peninsula, Russia Doklady Chemistry, 2000, 371, 52-56
9012749	CIF	Ca3.3 Ce0.498 Cl0.26 Fe2.1 H14.43 K0.3 Mn1.398 Na9.63 Nb0.1 O79.16 Si24.3 Sr0.504 Ti0.1 Zr3.399	R 3 m :H	14.167; 14.167; 30.081 90; 90; 120	5228.52	Ekimenkova, I. A.; Rastsvetaeva, R. K.; Chukanov, N. V.; Khasanov, S. S. Crystal structure of an oxonium-containing analogue of eudialyte Doklady Chemistry, 2000, 371, 65-69
9012750	CIF	Al0.2 Ca3.708 Ce0.3 Cl Fe2.199 H3.537 Hf0.099 K0.201 Mg0.15 Mn0.9 Na15.591 Nb0.2 O76.6 Si25.3 Sr0.201 Ti0.15 Zr3.801	R 3 :H	14.229; 14.229; 30.019 90; 90; 120	5263.51	Ekimenkova, I. A.; Rastsvetaeva, R. K.; Chukanov, N. V. Ordering of calcium and iron in a mineral of the eudialyte group with the symmetry R3 Locality: Lovozero massif, Kola Peninsula, Russia Doklady Chemistry, 2000, 374, 195-198
9012751	CIF	Ca H12 O17 Si2 U2	P 1 1 21/b	6.67; 15.92; 6.985 90; 90; 97.3	735.7	Barinova, A. V.; Rastsvetaeva, R. K.; Sidorenko, G. A.; Pushcharovsky, D. Y. Crystal structure of high-symmetry alpha-uranophane Doklady Chemistry, 2001, 378, 122-124
9012752	CIF	Al0.2 Be2 Ca Fe1.6 H9 Mg0.2 Mn0.35 O17 P3	C 1 2/c 1	15.903; 11.885; 6.677 90; 94.68; 90	1257.79	Rastsvetaeva, R. K.; Gurbanova, O. A.; Chukanov, N. V. Crystal structure of greifensteinite Ca2Be4(Fe2+,Mn)5(PO4)6(OH)4*6H2O Doklady Chemistry, 2002, 383, 78-81
9012753	CIF	Ca4.6 F2.75 H2.05 K3 Mn0.4 Na3 O32.25 Si12	C 1 m 1	18.846; 7.242; 12.65 90; 111.84; 90	1602.59	Rastsvetaeva, R. K.; Rozenberg, K. A.; Khomyakov, A. P.; Rozhdestvenskaya, I. V. Crystal structure of F-canasite Doklady Chemistry, 2003, 391, 177-180
9012754	CIF	K N O3	P m c n	5.4142; 9.1659; 6.4309 90; 90; 90	319.14	Nimmo, J. K.; Lucas, B. W. A neutron diffraction determination of the crystal structure of alpha-phase potassium nitrate at 25 C and 100 C Sample: T = 25 C Journal of Physics C: Solid State Physics, 1973, 6, 201-211
9012755	CIF	K N O3	P m c n	5.423; 9.1827; 6.5189 90; 90; 90	324.627	Nimmo, J. K.; Lucas, B. W. A neutron diffraction determination of the crystal structure of alpha-phase potassium nitrate at 25 C and 100 C Sample: T = 100 C Journal of Physics C: Solid State Physics, 1973, 6, 201-211
9012756	CIF	Al5 H O8	C m c 21	5.6152; 9.7264; 8.8241 90; 90; 90	481.934	Demichelis, R.; Noel, Y.; Zicovich-Wilson C M; Roetti, C.; Valenzano, L.; Dovesi, R. Ab-initio quantum mechanical study of akdalaite (5Al2O3*H2O): Structure and vibrational spectrum, Journal of Physics: Conference Series, 2008, 117, 012013-012013
9012757	CIF	Al5 H O8	P 3 1 c	5.6153; 5.6153; 8.8249 90; 90; 120	240.983	Demichelis, R.; Noel, Y.; Zicovich-Wilson C M; Roetti, C.; Valenzano, L.; Dovesi, R. Ab-initio quantum mechanical study of akdalaite (5Al2O3*H2O): Structure and vibrational spectrum, Journal of Physics: Conference Series, 2008, 117, 012013-012013
9012758	CIF	Al5 H O8	P 63 m c	5.6153; 5.6153; 8.8247 90; 90; 120	240.978	Demichelis, R.; Noel, Y.; Zicovich-Wilson C M; Roetti, C.; Valenzano, L.; Dovesi, R. Ab-initio quantum mechanical study of akdalaite (5Al2O3*H2O): Structure and vibrational spectrum, Journal of Physics: Conference Series, 2008, 117, 012013-012013
9012759	CIF	Sr	I m -3 m	4.434; 4.434; 4.434 90; 90; 90	87.174	McWhan, D. B.; Jayaraman, A. Crystal structure of strontium metal above 35 kbar and its relation to ytterbium Sample: at P = 4.2 GPa & T = room T Applied Physics Letters, 1963, 3, 129-131